Browse entries in the PDBbind-CN Database
HEADER 6FQO_COMPLEX COMPND 6FQO_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 115 LYS ILE PHE LYS PRO GLU GLU LEU ARG GLN ALA LEU MET SEQRES 2 A 115 PRO THR LEU GLU ALA LEU TYR ARG GLN ASP PRO GLU SER SEQRES 3 A 115 LEU PRO PHE ARG GLN PRO VAL ASP PRO GLN LEU LEU GLY SEQRES 4 A 115 ILE PRO ASP TYR PHE ASP ILE VAL LYS ASN PRO MET ASP SEQRES 5 A 115 LEU SER THR ILE LYS ARG LYS LEU ASP THR GLY GLN TYR SEQRES 6 A 115 GLN GLU PRO TRP GLN TYR VAL ASP ASP VAL TRP LEU MET SEQRES 7 A 115 PHE ASN ASN ALA TRP LEU TYR ASN ARG LYS THR SER ARG SEQRES 8 A 115 VAL TYR LYS PHE CYS SER LYS LEU ALA GLU VAL PHE GLU SEQRES 9 A 115 GLN GLU ILE ASP PRO VAL MET GLN SER LEU GLY HET E A 2T 58 ATOM 1 N LYS A1083 26.333 17.656 4.489 1.00 52.42 N ATOM 2 CA LYS A1083 25.465 18.399 3.582 1.00 53.27 C ATOM 3 C LYS A1083 24.088 18.609 4.205 1.00 52.77 C ATOM 4 O LYS A1083 23.854 18.238 5.355 1.00 56.48 O ATOM 5 CB LYS A1083 25.325 17.660 2.249 1.00 51.72 C ATOM 6 CG LYS A1083 24.487 16.394 2.336 1.00 48.77 C ATOM 7 CD LYS A1083 24.610 15.539 1.086 1.00 49.08 C ATOM 8 CE LYS A1083 23.238 15.172 0.544 1.00 48.90 C ATOM 9 NZ LYS A1083 23.235 13.848 -0.138 1.00 49.41 N ATOM 10 HZ1 LYS A1083 23.902 13.869 -0.936 1.00 0.00 H ATOM 11 HZ2 LYS A1083 23.523 13.111 0.537 1.00 0.00 H ATOM 12 HZ3 LYS A1083 22.278 13.643 -0.490 1.00 0.00 H ATOM 13 HN3 LYS A1083 25.909 16.728 4.690 1.00 0.00 H ATOM 14 HN2 LYS A1083 26.442 18.188 5.376 1.00 0.00 H ATOM 15 HN1 LYS A1083 27.264 17.524 4.045 1.00 0.00 H ATOM 16 N ILE A1084 23.182 19.209 3.437 1.00 51.02 N ATOM 17 CA ILE A1084 21.799 19.419 3.851 1.00 48.23 C ATOM 18 C ILE A1084 20.933 18.386 3.143 1.00 43.32 C ATOM 19 O ILE A1084 21.058 18.187 1.928 1.00 48.75 O ATOM 20 CB ILE A1084 21.339 20.851 3.525 1.00 48.95 C ATOM 21 CG1 ILE A1084 22.046 21.858 4.436 1.00 47.91 C ATOM 22 CG2 ILE A1084 19.829 20.982 3.662 1.00 48.98 C ATOM 23 CD1 ILE A1084 21.898 23.296 3.988 1.00 49.41 C ATOM 24 H ILE A1084 23.474 19.544 2.497 1.00 0.00 H ATOM 25 N PHE A1085 20.058 17.725 3.896 1.00 30.42 N ATOM 26 CA PHE A1085 19.260 16.620 3.384 1.00 25.66 C ATOM 27 C PHE A1085 17.794 17.016 3.303 1.00 27.46 C ATOM 28 O PHE A1085 17.248 17.611 4.238 1.00 35.08 O ATOM 29 CB PHE A1085 19.400 15.394 4.288 1.00 24.03 C ATOM 30 CG PHE A1085 20.801 14.859 4.362 1.00 24.26 C ATOM 31 CD1 PHE A1085 21.696 15.351 5.299 1.00 24.91 C ATOM 32 CD2 PHE A1085 21.225 13.870 3.492 1.00 26.91 C ATOM 33 CE1 PHE A1085 22.986 14.866 5.368 1.00 25.67 C ATOM 34 CE2 PHE A1085 22.512 13.381 3.557 1.00 27.02 C ATOM 35 CZ PHE A1085 23.390 13.876 4.499 1.00 24.70 C ATOM 36 H PHE A1085 19.939 18.009 4.889 1.00 0.00 H ATOM 37 N LYS A1086 17.163 16.675 2.185 1.00 24.67 N ATOM 38 CA LYS A1086 15.731 16.902 2.065 1.00 25.42 C ATOM 39 C LYS A1086 14.973 15.747 2.717 1.00 25.00 C ATOM 40 O LYS A1086 15.422 14.598 2.659 1.00 21.27 O ATOM 41 CB LYS A1086 15.331 17.017 0.595 1.00 27.24 C ATOM 42 CG LYS A1086 16.010 18.171 -0.146 1.00 28.80 C ATOM 43 CD LYS A1086 16.184 17.855 -1.625 1.00 30.26 C ATOM 44 CE LYS A1086 16.903 18.973 -2.364 1.00 32.69 C ATOM 45 NZ LYS A1086 18.378 18.745 -2.411 1.00 34.21 N ATOM 46 HZ1 LYS A1086 18.752 18.700 -1.441 1.00 0.00 H ATOM 47 HZ2 LYS A1086 18.574 17.849 -2.901 1.00 0.00 H ATOM 48 HZ3 LYS A1086 18.832 19.528 -2.923 1.00 0.00 H ATOM 49 H LYS A1086 17.691 16.247 1.398 1.00 0.00 H ATOM 50 N PRO A1087 13.835 16.020 3.359 1.00 20.78 N ATOM 51 CA PRO A1087 13.100 14.929 4.025 1.00 21.90 C ATOM 52 C PRO A1087 12.754 13.769 3.107 1.00 17.53 C ATOM 53 O PRO A1087 12.871 12.607 3.515 1.00 18.04 O ATOM 54 CB PRO A1087 11.847 15.625 4.583 1.00 23.86 C ATOM 55 CG PRO A1087 11.796 16.963 3.908 1.00 28.68 C ATOM 56 CD PRO A1087 13.203 17.331 3.575 1.00 24.02 C ATOM 57 N GLU A1088 12.326 14.061 1.875 1.00 19.37 N ATOM 58 CA GLU A1088 11.990 13.007 0.924 1.00 19.61 C ATOM 59 C GLU A1088 13.211 12.177 0.556 1.00 19.48 C ATOM 60 O GLU A1088 13.096 10.962 0.355 1.00 19.64 O ATOM 61 CB GLU A1088 11.358 13.625 -0.324 1.00 20.18 C ATOM 62 CG GLU A1088 10.006 14.266 -0.064 1.00 21.53 C ATOM 63 CD GLU A1088 10.100 15.720 0.385 1.00 21.34 C ATOM 64 OE1 GLU A1088 11.224 16.240 0.583 1.00 17.31 O ATOM 65 OE2 GLU A1088 9.032 16.345 0.550 1.00 28.92 O ATOM 66 H GLU A1088 12.231 15.056 1.589 1.00 0.00 H ATOM 67 N GLU A1089 14.380 12.813 0.473 1.00 18.02 N ATOM 68 CA GLU A1089 15.615 12.087 0.198 1.00 19.01 C ATOM 69 C GLU A1089 15.940 11.125 1.326 1.00 20.74 C ATOM 70 O GLU A1089 16.320 9.974 1.080 1.00 20.88 O ATOM 71 CB GLU A1089 16.770 13.069 0.037 1.00 27.05 C ATOM 72 CG GLU A1089 16.987 13.533 -1.376 1.00 36.58 C ATOM 73 CD GLU A1089 17.880 14.752 -1.437 1.00 46.21 C ATOM 74 OE1 GLU A1089 18.445 15.116 -0.380 1.00 49.76 O ATOM 75 OE2 GLU A1089 18.024 15.334 -2.538 1.00 43.97 O ATOM 76 H GLU A1089 14.412 13.844 0.607 1.00 0.00 H ATOM 77 N LEU A1090 15.816 11.583 2.570 1.00 16.64 N ATOM 78 CA LEU A1090 16.088 10.704 3.696 1.00 17.13 C ATOM 79 C LEU A1090 15.094 9.562 3.727 1.00 17.62 C ATOM 80 O LEU A1090 15.460 8.412 3.995 1.00 17.90 O ATOM 81 CB LEU A1090 15.997 11.490 5.003 1.00 19.13 C ATOM 82 CG LEU A1090 17.111 12.508 5.240 1.00 18.53 C ATOM 83 CD1 LEU A1090 16.844 13.254 6.530 1.00 22.70 C ATOM 84 CD2 LEU A1090 18.479 11.831 5.270 1.00 22.28 C ATOM 85 H LEU A1090 15.525 12.568 2.736 1.00 0.00 H ATOM 86 N ARG A1091 13.820 9.859 3.469 1.00 15.45 N ATOM 87 CA ARG A1091 12.802 8.828 3.557 1.00 15.76 C ATOM 88 C ARG A1091 13.028 7.748 2.510 1.00 16.20 C ATOM 89 O ARG A1091 13.009 6.554 2.824 1.00 18.26 O ATOM 90 CB ARG A1091 11.414 9.453 3.430 1.00 18.43 C ATOM 91 CG ARG A1091 10.272 8.478 3.614 1.00 19.41 C ATOM 92 CD ARG A1091 8.943 9.216 3.532 1.00 25.34 C ATOM 93 NE ARG A1091 7.812 8.330 3.775 1.00 28.10 N ATOM 94 CZ ARG A1091 7.197 7.631 2.828 1.00 39.17 C ATOM 95 NH1 ARG A1091 7.609 7.716 1.571 1.00 43.65 N ATOM 96 NH2 ARG A1091 6.174 6.847 3.140 1.00 40.51 N ATOM 97 HE ARG A1091 7.465 8.239 4.751 1.00 0.00 H ATOM 98 HH12 ARG A1091 7.128 7.169 0.828 1.00 0.00 H ATOM 99 HH11 ARG A1091 8.413 8.329 1.328 1.00 0.00 H ATOM 100 HH22 ARG A1091 5.693 6.300 2.398 1.00 0.00 H ATOM 101 HH21 ARG A1091 5.853 6.779 4.127 1.00 0.00 H ATOM 102 H ARG A1091 13.556 10.829 3.205 1.00 0.00 H ATOM 103 N GLN A1092 13.275 8.144 1.260 1.00 16.97 N ATOM 104 CA GLN A1092 13.441 7.140 0.215 1.00 18.60 C ATOM 105 C GLN A1092 14.680 6.288 0.458 1.00 20.12 C ATOM 106 O GLN A1092 14.664 5.074 0.220 1.00 20.39 O ATOM 107 CB GLN A1092 13.473 7.809 -1.158 1.00 27.42 C ATOM 108 CG GLN A1092 12.117 8.366 -1.562 1.00 40.44 C ATOM 109 CD GLN A1092 10.987 7.382 -1.302 1.00 52.00 C ATOM 110 OE1 GLN A1092 10.209 7.542 -0.358 1.00 54.97 O ATOM 111 NE2 GLN A1092 10.892 6.357 -2.140 1.00 56.04 N ATOM 112 HE22 GLN A1092 11.570 6.261 -2.923 1.00 0.00 H ATOM 113 HE21 GLN A1092 10.140 5.650 -2.014 1.00 0.00 H ATOM 114 H GLN A1092 13.348 9.156 1.033 1.00 0.00 H ATOM 115 N ALA A1093 15.751 6.899 0.961 1.00 17.02 N ATOM 116 CA ALA A1093 16.994 6.171 1.174 1.00 18.89 C ATOM 117 C ALA A1093 16.906 5.257 2.386 1.00 18.25 C ATOM 118 O ALA A1093 17.383 4.118 2.342 1.00 19.42 O ATOM 119 CB ALA A1093 18.142 7.158 1.360 1.00 17.46 C ATOM 120 H ALA A1093 15.699 7.909 1.205 1.00 0.00 H ATOM 121 N LEU A1094 16.294 5.730 3.471 1.00 15.04 N ATOM 122 CA LEU A1094 16.384 5.032 4.749 1.00 15.40 C ATOM 123 C LEU A1094 15.227 4.086 5.013 1.00 18.91 C ATOM 124 O LEU A1094 15.408 3.100 5.741 1.00 17.70 O ATOM 125 CB LEU A1094 16.487 6.038 5.896 1.00 13.97 C ATOM 126 CG LEU A1094 17.767 6.872 5.920 1.00 15.59 C ATOM 127 CD1 LEU A1094 17.629 7.972 6.951 1.00 16.15 C ATOM 128 CD2 LEU A1094 19.022 6.034 6.182 1.00 16.04 C ATOM 129 H LEU A1094 15.744 6.610 3.406 1.00 0.00 H ATOM 130 N MET A1095 14.043 4.356 4.468 1.00 18.47 N ATOM 131 CA MET A1095 12.900 3.484 4.742 1.00 19.06 C ATOM 132 C MET A1095 13.155 2.007 4.443 1.00 20.37 C ATOM 133 O MET A1095 12.684 1.165 5.225 1.00 18.92 O ATOM 134 CB MET A1095 11.608 4.002 4.083 1.00 22.30 C ATOM 135 CG MET A1095 10.323 3.352 4.621 1.00 21.64 C ATOM 136 SD MET A1095 9.948 3.717 6.352 1.00 25.73 S ATOM 137 CE MET A1095 9.366 5.402 6.222 1.00 25.45 C ATOM 138 H MET A1095 13.930 5.184 3.849 1.00 0.00 H ATOM 139 N PRO A1096 13.867 1.623 3.378 1.00 17.68 N ATOM 140 CA PRO A1096 14.179 0.192 3.192 1.00 22.31 C ATOM 141 C PRO A1096 14.946 -0.438 4.347 1.00 21.42 C ATOM 142 O PRO A1096 14.733 -1.622 4.641 1.00 18.44 O ATOM 143 CB PRO A1096 14.988 0.172 1.890 1.00 24.35 C ATOM 144 CG PRO A1096 14.503 1.367 1.139 1.00 27.24 C ATOM 145 CD PRO A1096 14.213 2.414 2.180 1.00 23.35 C ATOM 146 N THR A1097 15.845 0.300 5.002 1.00 16.27 N ATOM 147 CA THR A1097 16.532 -0.275 6.158 1.00 14.90 C ATOM 148 C THR A1097 15.579 -0.473 7.326 1.00 15.42 C ATOM 149 O THR A1097 15.722 -1.433 8.091 1.00 16.87 O ATOM 150 CB THR A1097 17.724 0.585 6.571 1.00 13.11 C ATOM 151 OG1 THR A1097 17.273 1.820 7.153 1.00 14.22 O ATOM 152 CG2 THR A1097 18.619 0.879 5.373 1.00 18.32 C ATOM 153 HG1 THR A1097 16.730 2.317 6.491 1.00 0.00 H ATOM 154 H THR A1097 16.054 1.271 4.694 1.00 0.00 H ATOM 155 N LEU A1098 14.594 0.411 7.477 1.00 12.11 N ATOM 156 CA LEU A1098 13.599 0.230 8.524 1.00 15.39 C ATOM 157 C LEU A1098 12.663 -0.927 8.194 1.00 16.28 C ATOM 158 O LEU A1098 12.306 -1.722 9.074 1.00 15.32 O ATOM 159 CB LEU A1098 12.817 1.529 8.704 1.00 15.38 C ATOM 160 CG LEU A1098 11.878 1.573 9.907 1.00 18.54 C ATOM 161 CD1 LEU A1098 12.666 1.481 11.192 1.00 19.78 C ATOM 162 CD2 LEU A1098 11.055 2.854 9.865 1.00 23.49 C ATOM 163 H LEU A1098 14.536 1.234 6.844 1.00 0.00 H ATOM 164 N GLU A1099 12.257 -1.045 6.931 1.00 16.60 N ATOM 165 CA GLU A1099 11.367 -2.133 6.547 1.00 17.84 C ATOM 166 C GLU A1099 12.048 -3.489 6.681 1.00 16.58 C ATOM 167 O GLU A1099 11.384 -4.480 7.004 1.00 15.68 O ATOM 168 CB GLU A1099 10.830 -1.899 5.136 1.00 22.98 C ATOM 169 CG GLU A1099 9.746 -0.816 5.055 1.00 29.09 C ATOM 170 CD GLU A1099 8.595 -1.048 6.026 1.00 35.41 C ATOM 171 OE1 GLU A1099 8.266 -0.123 6.795 1.00 34.37 O ATOM 172 OE2 GLU A1099 8.018 -2.156 6.021 1.00 35.73 O ATOM 173 H GLU A1099 12.576 -0.359 6.217 1.00 0.00 H ATOM 174 N ALA A1100 13.369 -3.546 6.484 1.00 15.78 N ATOM 175 CA ALA A1100 14.099 -4.786 6.743 1.00 17.05 C ATOM 176 C ALA A1100 13.948 -5.229 8.194 1.00 15.43 C ATOM 177 O ALA A1100 13.940 -6.434 8.481 1.00 16.56 O ATOM 178 CB ALA A1100 15.576 -4.610 6.402 1.00 15.84 C ATOM 179 H ALA A1100 13.879 -2.705 6.145 1.00 0.00 H ATOM 180 N LEU A1101 13.846 -4.282 9.126 1.00 14.44 N ATOM 181 CA LEU A1101 13.599 -4.656 10.514 1.00 13.73 C ATOM 182 C LEU A1101 12.175 -5.160 10.696 1.00 14.35 C ATOM 183 O LEU A1101 11.955 -6.212 11.306 1.00 14.07 O ATOM 184 CB LEU A1101 13.903 -3.480 11.442 1.00 14.42 C ATOM 185 CG LEU A1101 15.303 -2.873 11.305 1.00 12.69 C ATOM 186 CD1 LEU A1101 15.513 -1.856 12.405 1.00 13.96 C ATOM 187 CD2 LEU A1101 16.375 -3.954 11.360 1.00 17.00 C ATOM 188 H LEU A1101 13.942 -3.280 8.865 1.00 0.00 H ATOM 189 N TYR A1102 11.192 -4.424 10.164 1.00 13.80 N ATOM 190 CA TYR A1102 9.793 -4.845 10.248 1.00 15.75 C ATOM 191 C TYR A1102 9.565 -6.231 9.660 1.00 15.29 C ATOM 192 O TYR A1102 8.703 -6.974 10.147 1.00 17.12 O ATOM 193 CB TYR A1102 8.910 -3.863 9.481 1.00 17.70 C ATOM 194 CG TYR A1102 8.438 -2.685 10.282 1.00 14.04 C ATOM 195 CD1 TYR A1102 7.261 -2.746 11.017 1.00 14.77 C ATOM 196 CD2 TYR A1102 9.145 -1.491 10.273 1.00 15.70 C ATOM 197 CE1 TYR A1102 6.815 -1.655 11.749 1.00 13.09 C ATOM 198 CE2 TYR A1102 8.717 -0.406 10.999 1.00 15.38 C ATOM 199 CZ TYR A1102 7.551 -0.488 11.727 1.00 14.64 C ATOM 200 OH TYR A1102 7.122 0.611 12.424 1.00 16.06 O ATOM 201 HH TYR A1102 6.277 0.394 12.892 1.00 0.00 H ATOM 202 H TYR A1102 11.427 -3.534 9.681 1.00 0.00 H ATOM 203 N ARG A1103 10.295 -6.594 8.608 1.00 15.27 N ATOM 204 CA ARG A1103 10.021 -7.882 7.979 1.00 18.04 C ATOM 205 C ARG A1103 10.497 -9.067 8.811 1.00 20.58 C ATOM 206 O ARG A1103 10.087 -10.199 8.535 1.00 20.56 O ATOM 207 CB ARG A1103 10.565 -7.921 6.549 1.00 24.43 C ATOM 208 CG ARG A1103 12.044 -8.168 6.418 1.00 31.56 C ATOM 209 CD ARG A1103 12.358 -8.676 5.015 1.00 36.55 C ATOM 210 NE ARG A1103 13.673 -8.242 4.561 1.00 39.61 N ATOM 211 CZ ARG A1103 13.905 -7.091 3.939 1.00 39.38 C ATOM 212 NH1 ARG A1103 15.138 -6.778 3.562 1.00 44.32 N ATOM 213 NH2 ARG A1103 12.904 -6.257 3.690 1.00 34.45 N ATOM 214 HE ARG A1103 14.481 -8.873 4.735 1.00 0.00 H ATOM 215 HH12 ARG A1103 15.320 -5.877 3.075 1.00 0.00 H ATOM 216 HH11 ARG A1103 15.922 -7.433 3.753 1.00 0.00 H ATOM 217 HH22 ARG A1103 13.086 -5.356 3.203 1.00 0.00 H ATOM 218 HH21 ARG A1103 11.937 -6.504 3.982 1.00 0.00 H ATOM 219 H ARG A1103 11.045 -5.973 8.242 1.00 0.00 H ATOM 220 N GLN A1104 11.323 -8.843 9.829 1.00 16.38 N ATOM 221 CA GLN A1104 11.717 -9.934 10.715 1.00 15.81 C ATOM 222 C GLN A1104 10.529 -10.320 11.584 1.00 14.27 C ATOM 223 O GLN A1104 10.086 -9.546 12.437 1.00 13.66 O ATOM 224 CB GLN A1104 12.908 -9.522 11.573 1.00 15.99 C ATOM 225 CG GLN A1104 14.099 -8.972 10.804 1.00 19.41 C ATOM 226 CD GLN A1104 14.493 -9.830 9.626 1.00 21.45 C ATOM 227 OE1 GLN A1104 14.669 -11.039 9.754 1.00 20.11 O ATOM 228 NE2 GLN A1104 14.647 -9.203 8.470 1.00 18.52 N ATOM 229 HE22 GLN A1104 14.487 -8.177 8.409 1.00 0.00 H ATOM 230 HE21 GLN A1104 14.928 -9.736 7.623 1.00 0.00 H ATOM 231 H GLN A1104 11.691 -7.884 9.995 1.00 0.00 H ATOM 232 N ASP A1105 10.013 -11.528 11.367 1.00 16.55 N ATOM 233 CA ASP A1105 8.893 -12.064 12.130 1.00 18.40 C ATOM 234 C ASP A1105 9.375 -13.400 12.672 1.00 18.22 C ATOM 235 O ASP A1105 9.760 -14.285 11.878 1.00 20.29 O ATOM 236 CB ASP A1105 7.687 -12.251 11.205 1.00 21.83 C ATOM 237 CG ASP A1105 6.372 -12.337 11.957 1.00 26.19 C ATOM 238 OD1 ASP A1105 6.352 -12.870 13.081 1.00 28.33 O ATOM 239 OD2 ASP A1105 5.347 -11.881 11.411 1.00 34.18 O ATOM 240 H ASP A1105 10.429 -12.117 10.618 1.00 0.00 H ATOM 241 N PRO A1106 9.360 -13.616 13.995 1.00 16.09 N ATOM 242 CA PRO A1106 8.738 -12.798 15.040 1.00 13.55 C ATOM 243 C PRO A1106 9.618 -11.706 15.659 1.00 12.07 C ATOM 244 O PRO A1106 9.164 -11.020 16.566 1.00 13.62 O ATOM 245 CB PRO A1106 8.409 -13.841 16.116 1.00 17.24 C ATOM 246 CG PRO A1106 9.517 -14.831 15.986 1.00 16.68 C ATOM 247 CD PRO A1106 9.845 -14.908 14.520 1.00 15.76 C ATOM 248 N GLU A1107 10.847 -11.548 15.179 1.00 11.21 N ATOM 249 CA GLU A1107 11.820 -10.789 15.960 1.00 11.63 C ATOM 250 C GLU A1107 11.486 -9.306 16.079 1.00 12.22 C ATOM 251 O GLU A1107 11.914 -8.660 17.040 1.00 12.01 O ATOM 252 CB GLU A1107 13.227 -10.997 15.408 1.00 12.13 C ATOM 253 CG GLU A1107 13.767 -12.405 15.621 1.00 14.37 C ATOM 254 CD GLU A1107 13.505 -13.316 14.438 1.00 16.66 C ATOM 255 OE1 GLU A1107 14.142 -14.388 14.368 1.00 19.63 O ATOM 256 OE2 GLU A1107 12.671 -12.977 13.576 1.00 16.56 O ATOM 257 H GLU A1107 11.112 -11.959 14.261 1.00 0.00 H ATOM 258 N SER A1108 10.730 -8.741 15.143 1.00 10.64 N ATOM 259 CA SER A1108 10.371 -7.334 15.261 1.00 10.78 C ATOM 260 C SER A1108 9.149 -7.112 16.134 1.00 11.78 C ATOM 261 O SER A1108 8.849 -5.966 16.472 1.00 10.12 O ATOM 262 CB SER A1108 10.135 -6.704 13.885 1.00 13.23 C ATOM 263 OG SER A1108 8.917 -7.164 13.317 1.00 12.41 O ATOM 264 HG SER A1108 8.953 -8.148 13.214 1.00 0.00 H ATOM 265 H SER A1108 10.397 -9.300 14.332 1.00 0.00 H ATOM 266 N LEU A1109 8.428 -8.174 16.491 1.00 11.06 N ATOM 267 CA LEU A1109 7.171 -7.980 17.209 1.00 10.58 C ATOM 268 C LEU A1109 7.314 -7.213 18.519 1.00 11.50 C ATOM 269 O LEU A1109 6.422 -6.407 18.830 1.00 12.59 O ATOM 270 CB LEU A1109 6.418 -9.307 17.386 1.00 12.01 C ATOM 271 CG LEU A1109 6.055 -10.013 16.078 1.00 13.08 C ATOM 272 CD1 LEU A1109 5.371 -11.354 16.341 1.00 15.85 C ATOM 273 CD2 LEU A1109 5.192 -9.139 15.178 1.00 16.65 C ATOM 274 H LEU A1109 8.757 -9.133 16.260 1.00 0.00 H ATOM 275 N PRO A1110 8.370 -7.395 19.321 1.00 9.30 N ATOM 276 CA PRO A1110 8.478 -6.590 20.549 1.00 9.12 C ATOM 277 C PRO A1110 8.730 -5.112 20.312 1.00 8.60 C ATOM 278 O PRO A1110 8.674 -4.350 21.288 1.00 9.40 O ATOM 279 CB PRO A1110 9.681 -7.223 21.283 1.00 10.29 C ATOM 280 CG PRO A1110 9.779 -8.624 20.742 1.00 10.48 C ATOM 281 CD PRO A1110 9.371 -8.482 19.289 1.00 9.85 C ATOM 282 N PHE A1111 8.998 -4.697 19.070 1.00 8.36 N ATOM 283 CA PHE A1111 9.559 -3.391 18.765 1.00 8.90 C ATOM 284 C PHE A1111 8.670 -2.559 17.864 1.00 10.27 C ATOM 285 O PHE A1111 9.018 -1.414 17.575 1.00 10.17 O ATOM 286 CB PHE A1111 10.932 -3.572 18.105 1.00 10.64 C ATOM 287 CG PHE A1111 11.884 -4.380 18.937 1.00 10.36 C ATOM 288 CD1 PHE A1111 12.510 -3.802 20.026 1.00 15.44 C ATOM 289 CD2 PHE A1111 12.120 -5.714 18.658 1.00 11.26 C ATOM 290 CE1 PHE A1111 13.375 -4.536 20.810 1.00 16.37 C ATOM 291 CE2 PHE A1111 12.987 -6.458 19.442 1.00 12.52 C ATOM 292 CZ PHE A1111 13.614 -5.864 20.518 1.00 15.84 C ATOM 293 H PHE A1111 8.794 -5.342 18.280 1.00 0.00 H ATOM 294 N ARG A1112 7.543 -3.097 17.403 1.00 10.04 N ATOM 295 CA ARG A1112 6.720 -2.390 16.426 1.00 9.68 C ATOM 296 C ARG A1112 5.921 -1.243 17.021 1.00 10.69 C ATOM 297 O ARG A1112 5.591 -0.305 16.292 1.00 13.93 O ATOM 298 CB ARG A1112 5.773 -3.361 15.730 1.00 11.22 C ATOM 299 CG ARG A1112 6.483 -4.261 14.739 1.00 11.46 C ATOM 300 CD ARG A1112 5.526 -5.230 14.069 1.00 13.27 C ATOM 301 NE ARG A1112 6.213 -6.071 13.095 1.00 13.43 N ATOM 302 CZ ARG A1112 5.598 -6.919 12.282 1.00 15.45 C ATOM 303 NH1 ARG A1112 4.274 -7.032 12.319 1.00 18.52 N ATOM 304 NH2 ARG A1112 6.306 -7.635 11.423 1.00 17.25 N ATOM 305 HE ARG A1112 7.249 -6.001 13.035 1.00 0.00 H ATOM 306 HH12 ARG A1112 3.791 -7.697 11.682 1.00 0.00 H ATOM 307 HH11 ARG A1112 3.721 -6.456 12.985 1.00 0.00 H ATOM 308 HH22 ARG A1112 5.828 -8.301 10.783 1.00 0.00 H ATOM 309 HH21 ARG A1112 7.340 -7.531 11.388 1.00 0.00 H ATOM 310 H ARG A1112 7.245 -4.033 17.743 1.00 0.00 H ATOM 311 N GLN A1113 5.600 -1.288 18.303 1.00 9.53 N ATOM 312 CA GLN A1113 4.857 -0.241 18.987 1.00 10.16 C ATOM 313 C GLN A1113 5.602 0.125 20.260 1.00 10.86 C ATOM 314 O GLN A1113 6.483 -0.615 20.707 1.00 10.66 O ATOM 315 CB GLN A1113 3.441 -0.724 19.346 1.00 13.15 C ATOM 316 CG GLN A1113 2.604 -1.292 18.182 1.00 15.24 C ATOM 317 CD GLN A1113 2.431 -0.346 17.007 1.00 24.06 C ATOM 318 OE1 GLN A1113 2.309 0.864 17.177 1.00 21.96 O ATOM 319 NE2 GLN A1113 2.404 -0.907 15.800 1.00 25.51 N ATOM 320 HE22 GLN A1113 2.511 -1.937 15.703 1.00 0.00 H ATOM 321 HE21 GLN A1113 2.276 -0.315 14.954 1.00 0.00 H ATOM 322 H GLN A1113 5.896 -2.119 18.854 1.00 0.00 H ATOM 323 N PRO A1114 5.289 1.263 20.861 1.00 10.85 N ATOM 324 CA PRO A1114 5.986 1.640 22.092 1.00 13.00 C ATOM 325 C PRO A1114 5.681 0.674 23.219 1.00 12.04 C ATOM 326 O PRO A1114 4.595 0.092 23.305 1.00 12.86 O ATOM 327 CB PRO A1114 5.426 3.033 22.408 1.00 12.61 C ATOM 328 CG PRO A1114 4.925 3.553 21.084 1.00 13.33 C ATOM 329 CD PRO A1114 4.406 2.337 20.365 1.00 11.74 C ATOM 330 N VAL A1115 6.672 0.494 24.083 1.00 12.22 N ATOM 331 CA VAL A1115 6.483 -0.290 25.298 1.00 12.31 C ATOM 332 C VAL A1115 5.487 0.421 26.203 1.00 13.05 C ATOM 333 O VAL A1115 5.688 1.576 26.596 1.00 14.59 O ATOM 334 CB VAL A1115 7.820 -0.508 26.021 1.00 11.91 C ATOM 335 CG1 VAL A1115 7.597 -1.025 27.451 1.00 15.04 C ATOM 336 CG2 VAL A1115 8.699 -1.474 25.235 1.00 14.77 C ATOM 337 H VAL A1115 7.601 0.920 23.890 1.00 0.00 H ATOM 338 N ASP A1116 4.400 -0.272 26.538 1.00 13.98 N ATOM 339 CA ASP A1116 3.476 0.173 27.573 1.00 13.32 C ATOM 340 C ASP A1116 3.646 -0.785 28.741 1.00 12.83 C ATOM 341 O ASP A1116 3.193 -1.937 28.661 1.00 14.02 O ATOM 342 CB ASP A1116 2.035 0.134 27.053 1.00 15.99 C ATOM 343 CG ASP A1116 1.024 0.651 28.069 1.00 21.15 C ATOM 344 OD1 ASP A1116 1.099 0.282 29.255 1.00 16.56 O ATOM 345 OD2 ASP A1116 0.137 1.438 27.678 1.00 26.32 O ATOM 346 H ASP A1116 4.203 -1.165 26.042 1.00 0.00 H ATOM 347 N PRO A1117 4.307 -0.379 29.822 1.00 12.15 N ATOM 348 CA PRO A1117 4.604 -1.338 30.900 1.00 12.34 C ATOM 349 C PRO A1117 3.366 -1.920 31.553 1.00 14.55 C ATOM 350 O PRO A1117 3.419 -3.046 32.064 1.00 14.53 O ATOM 351 CB PRO A1117 5.457 -0.515 31.879 1.00 14.69 C ATOM 352 CG PRO A1117 6.061 0.565 31.025 1.00 16.36 C ATOM 353 CD PRO A1117 5.001 0.906 30.012 1.00 14.56 C ATOM 354 N GLN A1118 2.248 -1.195 31.535 1.00 14.81 N ATOM 355 CA GLN A1118 1.008 -1.726 32.095 1.00 16.77 C ATOM 356 C GLN A1118 0.434 -2.837 31.222 1.00 17.70 C ATOM 357 O GLN A1118 0.048 -3.896 31.724 1.00 20.28 O ATOM 358 CB GLN A1118 0.002 -0.592 32.288 1.00 20.94 C ATOM 359 CG GLN A1118 -1.349 -1.052 32.799 1.00 26.33 C ATOM 360 CD GLN A1118 -2.277 0.103 33.133 1.00 27.35 C ATOM 361 OE1 GLN A1118 -3.002 0.058 34.130 1.00 30.22 O ATOM 362 NE2 GLN A1118 -2.270 1.139 32.294 1.00 25.43 N ATOM 363 HE22 GLN A1118 -1.641 1.133 31.466 1.00 0.00 H ATOM 364 HE21 GLN A1118 -2.893 1.953 32.468 1.00 0.00 H ATOM 365 H GLN A1118 2.259 -0.242 31.118 1.00 0.00 H ATOM 366 N LEU A1119 0.370 -2.615 29.909 1.00 14.43 N ATOM 367 CA LEU A1119 -0.114 -3.649 29.000 1.00 16.69 C ATOM 368 C LEU A1119 0.807 -4.858 28.977 1.00 18.50 C ATOM 369 O LEU A1119 0.342 -5.991 28.798 1.00 21.66 O ATOM 370 CB LEU A1119 -0.235 -3.083 27.586 1.00 19.41 C ATOM 371 CG LEU A1119 -1.337 -2.058 27.360 1.00 20.99 C ATOM 372 CD1 LEU A1119 -1.405 -1.659 25.892 1.00 18.34 C ATOM 373 CD2 LEU A1119 -2.672 -2.619 27.823 1.00 23.42 C ATOM 374 H LEU A1119 0.668 -1.694 29.528 1.00 0.00 H ATOM 375 N LEU A1120 2.112 -4.648 29.144 1.00 17.03 N ATOM 376 CA LEU A1120 3.059 -5.750 29.059 1.00 16.85 C ATOM 377 C LEU A1120 3.289 -6.440 30.393 1.00 18.13 C ATOM 378 O LEU A1120 3.831 -7.555 30.410 1.00 20.92 O ATOM 379 CB LEU A1120 4.398 -5.271 28.487 1.00 16.55 C ATOM 380 CG LEU A1120 4.335 -4.714 27.061 1.00 13.58 C ATOM 381 CD1 LEU A1120 5.727 -4.314 26.595 1.00 14.34 C ATOM 382 CD2 LEU A1120 3.721 -5.726 26.112 1.00 17.17 C ATOM 383 H LEU A1120 2.458 -3.686 29.337 1.00 0.00 H ATOM 384 N GLY A1121 2.898 -5.816 31.498 1.00 13.76 N ATOM 385 CA GLY A1121 3.135 -6.404 32.808 1.00 16.65 C ATOM 386 C GLY A1121 4.582 -6.353 33.250 1.00 21.26 C ATOM 387 O GLY A1121 5.082 -7.326 33.836 1.00 24.13 O ATOM 388 H GLY A1121 2.417 -4.897 31.426 1.00 0.00 H ATOM 389 N ILE A1122 5.264 -5.241 32.979 1.00 17.32 N ATOM 390 CA ILE A1122 6.661 -5.010 33.353 1.00 22.82 C ATOM 391 C ILE A1122 6.776 -3.620 33.987 1.00 18.12 C ATOM 392 O ILE A1122 7.309 -2.680 33.369 1.00 20.30 O ATOM 393 CB ILE A1122 7.598 -5.206 32.144 1.00 19.68 C ATOM 394 CG1 ILE A1122 7.181 -4.326 30.959 1.00 15.99 C ATOM 395 CG2 ILE A1122 7.618 -6.671 31.705 1.00 22.11 C ATOM 396 CD1 ILE A1122 8.218 -4.250 29.865 1.00 14.89 C ATOM 397 H ILE A1122 4.769 -4.484 32.466 1.00 0.00 H ATOM 398 N PRO A1123 6.312 -3.444 35.225 1.00 25.22 N ATOM 399 CA PRO A1123 6.171 -2.082 35.777 1.00 22.28 C ATOM 400 C PRO A1123 7.478 -1.335 36.047 1.00 26.17 C ATOM 401 O PRO A1123 7.425 -0.111 36.220 1.00 26.55 O ATOM 402 CB PRO A1123 5.365 -2.301 37.068 1.00 30.97 C ATOM 403 CG PRO A1123 5.570 -3.746 37.412 1.00 33.14 C ATOM 404 CD PRO A1123 5.743 -4.474 36.114 1.00 29.70 C ATOM 405 N ASP A1124 8.633 -2.003 36.109 1.00 23.45 N ATOM 406 CA ASP A1124 9.907 -1.346 36.391 1.00 22.50 C ATOM 407 C ASP A1124 10.574 -0.763 35.144 1.00 17.61 C ATOM 408 O ASP A1124 11.711 -0.288 35.221 1.00 19.95 O ATOM 409 CB ASP A1124 10.865 -2.326 37.066 1.00 27.36 C ATOM 410 CG ASP A1124 11.191 -3.509 36.184 1.00 27.92 C ATOM 411 OD1 ASP A1124 10.504 -3.681 35.155 1.00 19.82 O ATOM 412 OD2 ASP A1124 12.134 -4.259 36.518 1.00 34.76 O ATOM 413 H ASP A1124 8.625 -3.031 35.950 1.00 0.00 H ATOM 414 N TYR A1125 9.876 -0.760 34.013 1.00 17.87 N ATOM 415 CA TYR A1125 10.527 -0.505 32.732 1.00 14.42 C ATOM 416 C TYR A1125 11.115 0.902 32.659 1.00 14.76 C ATOM 417 O TYR A1125 12.288 1.080 32.299 1.00 14.41 O ATOM 418 CB TYR A1125 9.534 -0.744 31.606 1.00 13.60 C ATOM 419 CG TYR A1125 10.151 -0.546 30.253 1.00 12.80 C ATOM 420 CD1 TYR A1125 10.938 -1.534 29.672 1.00 10.54 C ATOM 421 CD2 TYR A1125 9.949 0.633 29.548 1.00 10.78 C ATOM 422 CE1 TYR A1125 11.503 -1.360 28.437 1.00 9.42 C ATOM 423 CE2 TYR A1125 10.523 0.828 28.314 1.00 10.86 C ATOM 424 CZ TYR A1125 11.304 -0.172 27.761 1.00 11.37 C ATOM 425 OH TYR A1125 11.870 0.024 26.529 1.00 11.78 O ATOM 426 HH TYR A1125 12.394 -0.777 26.276 1.00 0.00 H ATOM 427 H TYR A1125 8.852 -0.942 34.041 1.00 0.00 H ATOM 428 N PHE A1126 10.316 1.922 32.988 1.00 15.93 N ATOM 429 CA PHE A1126 10.793 3.297 32.861 1.00 15.74 C ATOM 430 C PHE A1126 11.791 3.689 33.942 1.00 16.56 C ATOM 431 O PHE A1126 12.452 4.724 33.798 1.00 22.14 O ATOM 432 CB PHE A1126 9.617 4.269 32.855 1.00 16.14 C ATOM 433 CG PHE A1126 8.725 4.135 31.662 1.00 14.20 C ATOM 434 CD1 PHE A1126 9.264 3.986 30.385 1.00 13.60 C ATOM 435 CD2 PHE A1126 7.340 4.160 31.803 1.00 13.29 C ATOM 436 CE1 PHE A1126 8.440 3.862 29.280 1.00 11.83 C ATOM 437 CE2 PHE A1126 6.514 4.048 30.701 1.00 13.61 C ATOM 438 CZ PHE A1126 7.059 3.892 29.435 1.00 12.98 C ATOM 439 H PHE A1126 9.353 1.736 33.335 1.00 0.00 H ATOM 440 N ASP A1127 11.918 2.905 35.012 1.00 20.23 N ATOM 441 CA ASP A1127 13.003 3.144 35.956 1.00 23.13 C ATOM 442 C ASP A1127 14.346 2.829 35.323 1.00 23.23 C ATOM 443 O ASP A1127 15.366 3.423 35.691 1.00 26.39 O ATOM 444 CB ASP A1127 12.809 2.279 37.200 1.00 27.08 C ATOM 445 CG ASP A1127 11.494 2.553 37.897 1.00 37.56 C ATOM 446 OD1 ASP A1127 11.082 3.732 37.952 1.00 42.05 O ATOM 447 OD2 ASP A1127 10.872 1.588 38.386 1.00 40.01 O ATOM 448 H ASP A1127 11.247 2.127 35.173 1.00 0.00 H ATOM 449 N ILE A1128 14.359 1.910 34.364 1.00 18.99 N ATOM 450 CA ILE A1128 15.582 1.454 33.726 1.00 16.75 C ATOM 451 C ILE A1128 15.783 2.114 32.370 1.00 13.17 C ATOM 452 O ILE A1128 16.895 2.525 32.038 1.00 15.40 O ATOM 453 CB ILE A1128 15.554 -0.085 33.614 1.00 17.79 C ATOM 454 CG1 ILE A1128 15.661 -0.703 35.007 1.00 22.27 C ATOM 455 CG2 ILE A1128 16.664 -0.606 32.719 1.00 16.20 C ATOM 456 CD1 ILE A1128 15.275 -2.154 35.062 1.00 25.43 C ATOM 457 H ILE A1128 13.454 1.499 34.057 1.00 0.00 H ATOM 458 N VAL A1129 14.704 2.252 31.602 1.00 13.22 N ATOM 459 CA VAL A1129 14.743 2.807 30.253 1.00 11.91 C ATOM 460 C VAL A1129 14.186 4.225 30.323 1.00 14.27 C ATOM 461 O VAL A1129 12.966 4.437 30.360 1.00 16.43 O ATOM 462 CB VAL A1129 13.976 1.925 29.263 1.00 10.56 C ATOM 463 CG1 VAL A1129 13.940 2.563 27.892 1.00 11.33 C ATOM 464 CG2 VAL A1129 14.632 0.548 29.179 1.00 13.25 C ATOM 465 H VAL A1129 13.785 1.948 31.984 1.00 0.00 H ATOM 466 N LYS A1130 15.089 5.203 30.302 1.00 16.26 N ATOM 467 CA LYS A1130 14.699 6.594 30.483 1.00 17.22 C ATOM 468 C LYS A1130 14.473 7.340 29.176 1.00 15.12 C ATOM 469 O LYS A1130 13.863 8.413 29.189 1.00 17.78 O ATOM 470 CB LYS A1130 15.736 7.310 31.344 1.00 21.32 C ATOM 471 CG LYS A1130 15.859 6.684 32.732 1.00 24.83 C ATOM 472 CD LYS A1130 17.135 7.108 33.431 1.00 29.10 C ATOM 473 CE LYS A1130 17.202 6.532 34.837 1.00 26.88 C ATOM 474 NZ LYS A1130 18.521 6.815 35.478 1.00 30.65 N ATOM 475 HZ1 LYS A1130 19.280 6.389 34.909 1.00 0.00 H ATOM 476 HZ2 LYS A1130 18.664 7.844 35.534 1.00 0.00 H ATOM 477 HZ3 LYS A1130 18.534 6.409 36.435 1.00 0.00 H ATOM 478 H LYS A1130 16.091 4.969 30.154 1.00 0.00 H ATOM 479 N ASN A1131 14.943 6.800 28.051 1.00 13.53 N ATOM 480 CA ASN A1131 14.762 7.405 26.731 1.00 12.25 C ATOM 481 C ASN A1131 14.195 6.340 25.804 1.00 11.15 C ATOM 482 O ASN A1131 14.933 5.750 25.003 1.00 11.71 O ATOM 483 CB ASN A1131 16.090 7.926 26.174 1.00 13.76 C ATOM 484 CG ASN A1131 16.596 9.148 26.904 1.00 13.17 C ATOM 485 OD1 ASN A1131 17.676 9.131 27.491 1.00 18.66 O ATOM 486 ND2 ASN A1131 15.817 10.217 26.870 1.00 13.33 N ATOM 487 HD22 ASN A1131 14.911 10.184 26.360 1.00 0.00 H ATOM 488 HD21 ASN A1131 16.111 11.090 27.353 1.00 0.00 H ATOM 489 H ASN A1131 15.465 5.903 28.115 1.00 0.00 H ATOM 490 N PRO A1132 12.892 6.067 25.877 1.00 10.00 N ATOM 491 CA PRO A1132 12.316 4.972 25.083 1.00 9.57 C ATOM 492 C PRO A1132 12.327 5.267 23.590 1.00 10.99 C ATOM 493 O PRO A1132 12.319 6.422 23.154 1.00 12.87 O ATOM 494 CB PRO A1132 10.875 4.863 25.611 1.00 10.13 C ATOM 495 CG PRO A1132 10.877 5.580 26.929 1.00 12.57 C ATOM 496 CD PRO A1132 11.905 6.657 26.803 1.00 12.81 C ATOM 497 N MET A1133 12.324 4.190 22.802 1.00 9.80 N ATOM 498 CA MET A1133 12.275 4.310 21.353 1.00 9.62 C ATOM 499 C MET A1133 11.730 3.004 20.783 1.00 9.49 C ATOM 500 O MET A1133 11.932 1.934 21.359 1.00 9.93 O ATOM 501 CB MET A1133 13.663 4.631 20.786 1.00 9.42 C ATOM 502 CG MET A1133 13.685 4.930 19.296 1.00 11.16 C ATOM 503 SD MET A1133 12.531 6.226 18.772 1.00 10.61 S ATOM 504 CE MET A1133 13.039 7.599 19.814 1.00 11.04 C ATOM 505 H MET A1133 12.357 3.244 23.233 1.00 0.00 H ATOM 506 N ASP A1134 11.042 3.098 19.647 1.00 9.90 N ATOM 507 CA ASP A1134 10.448 1.921 19.017 1.00 9.28 C ATOM 508 C ASP A1134 10.286 2.182 17.524 1.00 8.79 C ATOM 509 O ASP A1134 10.423 3.314 17.054 1.00 9.52 O ATOM 510 CB ASP A1134 9.097 1.580 19.642 1.00 10.66 C ATOM 511 CG ASP A1134 8.014 2.517 19.185 1.00 10.46 C ATOM 512 OD1 ASP A1134 8.046 3.690 19.608 1.00 11.06 O ATOM 513 OD2 ASP A1134 7.143 2.079 18.399 1.00 13.40 O ATOM 514 H ASP A1134 10.925 4.029 19.198 1.00 0.00 H ATOM 515 N LEU A1135 9.943 1.124 16.785 1.00 9.04 N ATOM 516 CA LEU A1135 9.868 1.232 15.328 1.00 9.86 C ATOM 517 C LEU A1135 8.783 2.202 14.868 1.00 9.77 C ATOM 518 O LEU A1135 8.969 2.904 13.869 1.00 10.77 O ATOM 519 CB LEU A1135 9.640 -0.140 14.696 1.00 9.80 C ATOM 520 CG LEU A1135 10.797 -1.139 14.819 1.00 9.86 C ATOM 521 CD1 LEU A1135 10.341 -2.525 14.375 1.00 12.84 C ATOM 522 CD2 LEU A1135 11.996 -0.704 13.993 1.00 11.63 C ATOM 523 H LEU A1135 9.728 0.218 17.248 1.00 0.00 H ATOM 524 N SER A1136 7.627 2.233 15.549 1.00 10.36 N ATOM 525 CA SER A1136 6.547 3.124 15.119 1.00 10.30 C ATOM 526 C SER A1136 6.960 4.587 15.221 1.00 11.20 C ATOM 527 O SER A1136 6.582 5.412 14.381 1.00 11.48 O ATOM 528 CB SER A1136 5.260 2.868 15.919 1.00 10.96 C ATOM 529 OG SER A1136 5.301 3.426 17.221 1.00 13.51 O ATOM 530 HG SER A1136 6.055 3.029 17.725 1.00 0.00 H ATOM 531 H SER A1136 7.498 1.624 16.382 1.00 0.00 H ATOM 532 N THR A1137 7.725 4.930 16.255 1.00 9.75 N ATOM 533 CA THR A1137 8.199 6.303 16.404 1.00 10.14 C ATOM 534 C THR A1137 9.190 6.652 15.306 1.00 9.99 C ATOM 535 O THR A1137 9.114 7.734 14.703 1.00 10.57 O ATOM 536 CB THR A1137 8.825 6.480 17.787 1.00 9.40 C ATOM 537 OG1 THR A1137 7.828 6.229 18.782 1.00 11.52 O ATOM 538 CG2 THR A1137 9.358 7.903 17.960 1.00 11.69 C ATOM 539 HG1 THR A1137 7.081 6.869 18.668 1.00 0.00 H ATOM 540 H THR A1137 7.987 4.214 16.962 1.00 0.00 H ATOM 541 N ILE A1138 10.117 5.734 15.022 1.00 9.88 N ATOM 542 CA ILE A1138 11.101 5.959 13.969 1.00 9.42 C ATOM 543 C ILE A1138 10.415 6.088 12.620 1.00 10.22 C ATOM 544 O ILE A1138 10.730 6.986 11.831 1.00 11.63 O ATOM 545 CB ILE A1138 12.145 4.832 13.979 1.00 11.15 C ATOM 546 CG1 ILE A1138 12.903 4.831 15.304 1.00 11.58 C ATOM 547 CG2 ILE A1138 13.097 5.006 12.824 1.00 13.04 C ATOM 548 CD1 ILE A1138 13.748 3.581 15.534 1.00 11.01 C ATOM 549 H ILE A1138 10.138 4.844 15.560 1.00 0.00 H ATOM 550 N LYS A1139 9.454 5.204 12.340 1.00 10.62 N ATOM 551 CA LYS A1139 8.746 5.257 11.066 1.00 12.15 C ATOM 552 C LYS A1139 7.999 6.578 10.903 1.00 11.16 C ATOM 553 O LYS A1139 8.061 7.214 9.847 1.00 13.34 O ATOM 554 CB LYS A1139 7.796 4.067 10.952 1.00 11.77 C ATOM 555 CG LYS A1139 6.968 4.085 9.665 1.00 15.37 C ATOM 556 CD LYS A1139 6.148 2.820 9.504 1.00 18.05 C ATOM 557 CE LYS A1139 7.014 1.714 8.959 1.00 23.61 C ATOM 558 NZ LYS A1139 6.212 0.597 8.375 1.00 26.79 N ATOM 559 HZ1 LYS A1139 5.598 0.192 9.110 1.00 0.00 H ATOM 560 HZ2 LYS A1139 5.628 0.962 7.596 1.00 0.00 H ATOM 561 HZ3 LYS A1139 6.854 -0.137 8.014 1.00 0.00 H ATOM 562 H LYS A1139 9.208 4.472 13.036 1.00 0.00 H ATOM 563 N ARG A1140 7.284 7.010 11.943 1.00 11.07 N ATOM 564 CA ARG A1140 6.565 8.276 11.847 1.00 11.25 C ATOM 565 C ARG A1140 7.528 9.446 11.683 1.00 11.69 C ATOM 566 O ARG A1140 7.279 10.349 10.875 1.00 12.97 O ATOM 567 CB ARG A1140 5.675 8.464 13.077 1.00 11.95 C ATOM 568 CG ARG A1140 4.887 9.766 13.045 1.00 13.58 C ATOM 569 CD ARG A1140 3.894 9.849 14.194 1.00 14.81 C ATOM 570 NE ARG A1140 4.533 9.623 15.490 1.00 16.00 N ATOM 571 CZ ARG A1140 5.278 10.514 16.137 1.00 18.48 C ATOM 572 NH1 ARG A1140 5.482 11.718 15.620 1.00 20.99 N ATOM 573 NH2 ARG A1140 5.821 10.194 17.307 1.00 20.70 N ATOM 574 HE ARG A1140 4.394 8.695 15.939 1.00 0.00 H ATOM 575 HH12 ARG A1140 6.066 12.411 16.131 1.00 0.00 H ATOM 576 HH11 ARG A1140 5.058 11.969 14.704 1.00 0.00 H ATOM 577 HH22 ARG A1140 6.404 10.888 17.817 1.00 0.00 H ATOM 578 HH21 ARG A1140 5.662 9.250 17.713 1.00 0.00 H ATOM 579 H ARG A1140 7.239 6.448 12.817 1.00 0.00 H ATOM 580 N LYS A1141 8.647 9.440 12.415 1.00 10.84 N ATOM 581 CA LYS A1141 9.624 10.516 12.276 1.00 11.69 C ATOM 582 C LYS A1141 10.161 10.587 10.854 1.00 12.07 C ATOM 583 O LYS A1141 10.260 11.674 10.273 1.00 14.14 O ATOM 584 CB LYS A1141 10.756 10.329 13.290 1.00 11.71 C ATOM 585 CG LYS A1141 10.347 10.755 14.698 1.00 13.22 C ATOM 586 CD LYS A1141 11.421 10.483 15.743 1.00 15.92 C ATOM 587 CE LYS A1141 12.553 11.493 15.681 1.00 15.37 C ATOM 588 NZ LYS A1141 13.461 11.367 16.865 1.00 13.83 N ATOM 589 HZ1 LYS A1141 12.917 11.532 17.736 1.00 0.00 H ATOM 590 HZ2 LYS A1141 13.871 10.411 16.886 1.00 0.00 H ATOM 591 HZ3 LYS A1141 14.223 12.071 16.792 1.00 0.00 H ATOM 592 H LYS A1141 8.822 8.665 13.086 1.00 0.00 H ATOM 593 N LEU A1142 10.487 9.431 10.276 1.00 12.47 N ATOM 594 CA LEU A1142 10.997 9.388 8.911 1.00 15.76 C ATOM 595 C LEU A1142 9.924 9.797 7.906 1.00 15.13 C ATOM 596 O LEU A1142 10.216 10.488 6.922 1.00 17.54 O ATOM 597 CB LEU A1142 11.526 7.983 8.620 1.00 17.36 C ATOM 598 CG LEU A1142 12.444 7.757 7.421 1.00 18.19 C ATOM 599 CD1 LEU A1142 13.668 8.637 7.496 1.00 19.07 C ATOM 600 CD2 LEU A1142 12.840 6.290 7.375 1.00 20.10 C ATOM 601 H LEU A1142 10.376 8.544 10.808 1.00 0.00 H ATOM 602 N ASP A1143 8.676 9.387 8.142 1.00 15.65 N ATOM 603 CA ASP A1143 7.596 9.698 7.206 1.00 17.26 C ATOM 604 C ASP A1143 7.253 11.177 7.200 1.00 23.31 C ATOM 605 O ASP A1143 6.829 11.709 6.167 1.00 23.16 O ATOM 606 CB ASP A1143 6.350 8.891 7.566 1.00 19.09 C ATOM 607 CG ASP A1143 6.297 7.571 6.855 1.00 23.43 C ATOM 608 OD1 ASP A1143 7.104 7.370 5.929 1.00 28.68 O ATOM 609 OD2 ASP A1143 5.448 6.730 7.220 1.00 30.85 O ATOM 610 H ASP A1143 8.469 8.840 9.002 1.00 0.00 H ATOM 611 N THR A1144 7.428 11.861 8.332 1.00 18.86 N ATOM 612 CA THR A1144 6.957 13.229 8.498 1.00 20.31 C ATOM 613 C THR A1144 8.095 14.243 8.585 1.00 22.35 C ATOM 614 O THR A1144 7.868 15.389 8.990 1.00 25.63 O ATOM 615 CB THR A1144 6.027 13.323 9.707 1.00 19.40 C ATOM 616 OG1 THR A1144 6.752 12.974 10.891 1.00 17.86 O ATOM 617 CG2 THR A1144 4.838 12.374 9.541 1.00 22.61 C ATOM 618 HG1 THR A1144 7.094 12.049 10.807 1.00 0.00 H ATOM 619 H THR A1144 7.919 11.400 9.125 1.00 0.00 H ATOM 620 N GLY A1145 9.310 13.853 8.202 1.00 19.44 N ATOM 621 CA GLY A1145 10.405 14.798 8.075 1.00 19.56 C ATOM 622 C GLY A1145 11.025 15.279 9.369 1.00 20.14 C ATOM 623 O GLY A1145 11.591 16.377 9.409 1.00 25.40 O ATOM 624 H GLY A1145 9.478 12.849 7.989 1.00 0.00 H ATOM 625 N GLN A1146 10.956 14.483 10.432 1.00 16.17 N ATOM 626 CA GLN A1146 11.474 14.919 11.720 1.00 19.56 C ATOM 627 C GLN A1146 12.979 14.749 11.846 1.00 17.23 C ATOM 628 O GLN A1146 13.557 15.226 12.829 1.00 18.72 O ATOM 629 CB GLN A1146 10.769 14.169 12.852 1.00 18.04 C ATOM 630 CG GLN A1146 9.274 14.420 12.910 1.00 21.45 C ATOM 631 CD GLN A1146 8.946 15.869 13.209 1.00 28.63 C ATOM 632 OE1 GLN A1146 8.730 16.668 12.298 1.00 27.60 O ATOM 633 NE2 GLN A1146 8.904 16.214 14.490 1.00 33.99 N ATOM 634 HE22 GLN A1146 9.094 15.504 15.226 1.00 0.00 H ATOM 635 HE21 GLN A1146 8.681 17.194 14.758 1.00 0.00 H ATOM 636 H GLN A1146 10.528 13.540 10.342 1.00 0.00 H ATOM 637 N TYR A1147 13.624 14.085 10.892 1.00 18.11 N ATOM 638 CA TYR A1147 15.069 13.903 10.896 1.00 16.28 C ATOM 639 C TYR A1147 15.696 14.907 9.939 1.00 18.72 C ATOM 640 O TYR A1147 15.274 15.021 8.783 1.00 20.42 O ATOM 641 CB TYR A1147 15.433 12.482 10.453 1.00 15.85 C ATOM 642 CG TYR A1147 15.031 11.381 11.411 1.00 13.53 C ATOM 643 CD1 TYR A1147 15.491 11.366 12.718 1.00 14.43 C ATOM 644 CD2 TYR A1147 14.208 10.341 10.995 1.00 15.34 C ATOM 645 CE1 TYR A1147 15.136 10.350 13.592 1.00 13.53 C ATOM 646 CE2 TYR A1147 13.844 9.324 11.863 1.00 13.45 C ATOM 647 CZ TYR A1147 14.310 9.328 13.159 1.00 12.92 C ATOM 648 OH TYR A1147 13.946 8.332 14.024 1.00 13.88 O ATOM 649 HH TYR A1147 14.368 8.491 14.905 1.00 0.00 H ATOM 650 H TYR A1147 13.073 13.678 10.109 1.00 0.00 H ATOM 651 N GLN A1148 16.695 15.639 10.424 1.00 18.24 N ATOM 652 CA GLN A1148 17.411 16.585 9.582 1.00 17.77 C ATOM 653 C GLN A1148 18.552 15.938 8.814 1.00 18.92 C ATOM 654 O GLN A1148 18.916 16.422 7.737 1.00 22.26 O ATOM 655 CB GLN A1148 17.957 17.733 10.436 1.00 24.61 C ATOM 656 CG GLN A1148 16.870 18.611 11.024 1.00 37.35 C ATOM 657 CD GLN A1148 16.629 18.319 12.487 1.00 47.94 C ATOM 658 OE1 GLN A1148 17.528 18.462 13.316 1.00 49.38 O ATOM 659 NE2 GLN A1148 15.411 17.899 12.814 1.00 52.14 N ATOM 660 HE22 GLN A1148 14.683 17.793 12.079 1.00 0.00 H ATOM 661 HE21 GLN A1148 15.186 17.676 13.805 1.00 0.00 H ATOM 662 H GLN A1148 16.969 15.533 11.422 1.00 0.00 H ATOM 663 N GLU A1149 19.115 14.851 9.332 1.00 17.05 N ATOM 664 CA GLU A1149 20.257 14.210 8.701 1.00 17.87 C ATOM 665 C GLU A1149 20.289 12.753 9.142 1.00 14.32 C ATOM 666 O GLU A1149 19.716 12.405 10.187 1.00 15.30 O ATOM 667 CB GLU A1149 21.565 14.947 9.039 1.00 19.76 C ATOM 668 CG GLU A1149 21.821 15.133 10.513 1.00 18.92 C ATOM 669 CD GLU A1149 22.578 13.969 11.088 1.00 21.71 C ATOM 670 OE1 GLU A1149 22.712 13.899 12.326 1.00 20.04 O ATOM 671 OE2 GLU A1149 23.034 13.117 10.292 1.00 19.26 O ATOM 672 H GLU A1149 18.729 14.449 10.210 1.00 0.00 H ATOM 673 N PRO A1150 20.928 11.874 8.362 1.00 14.99 N ATOM 674 CA PRO A1150 20.664 10.434 8.530 1.00 17.05 C ATOM 675 C PRO A1150 21.169 9.843 9.829 1.00 14.57 C ATOM 676 O PRO A1150 20.615 8.833 10.276 1.00 14.24 O ATOM 677 CB PRO A1150 21.347 9.780 7.318 1.00 20.24 C ATOM 678 CG PRO A1150 21.776 10.893 6.432 1.00 25.89 C ATOM 679 CD PRO A1150 21.830 12.146 7.228 1.00 16.85 C ATOM 680 N TRP A1151 22.212 10.412 10.439 1.00 13.91 N ATOM 681 CA TRP A1151 22.703 9.841 11.687 1.00 13.54 C ATOM 682 C TRP A1151 21.706 9.997 12.829 1.00 13.22 C ATOM 683 O TRP A1151 21.798 9.265 13.818 1.00 14.18 O ATOM 684 CB TRP A1151 24.073 10.424 12.031 1.00 16.97 C ATOM 685 CG TRP A1151 25.140 9.914 11.108 1.00 19.94 C ATOM 686 CD1 TRP A1151 25.680 10.567 10.039 1.00 24.18 C ATOM 687 CD2 TRP A1151 25.766 8.626 11.153 1.00 26.05 C ATOM 688 NE1 TRP A1151 26.619 9.770 9.426 1.00 28.19 N ATOM 689 CE2 TRP A1151 26.695 8.576 10.095 1.00 30.12 C ATOM 690 CE3 TRP A1151 25.642 7.517 11.996 1.00 23.97 C ATOM 691 CZ2 TRP A1151 27.489 7.455 9.849 1.00 37.08 C ATOM 692 CZ3 TRP A1151 26.431 6.405 11.754 1.00 32.16 C ATOM 693 CH2 TRP A1151 27.344 6.383 10.688 1.00 36.91 C ATOM 694 HE1 TRP A1151 27.180 10.031 8.590 1.00 0.00 H ATOM 695 H TRP A1151 22.668 11.252 10.029 1.00 0.00 H ATOM 696 N GLN A1152 20.751 10.921 12.719 1.00 11.93 N ATOM 697 CA GLN A1152 19.713 11.000 13.743 1.00 13.23 C ATOM 698 C GLN A1152 18.818 9.768 13.695 1.00 11.00 C ATOM 699 O GLN A1152 18.387 9.255 14.737 1.00 11.36 O ATOM 700 CB GLN A1152 18.896 12.278 13.556 1.00 13.67 C ATOM 701 CG GLN A1152 19.678 13.559 13.808 1.00 15.22 C ATOM 702 CD GLN A1152 18.911 14.789 13.398 1.00 19.22 C ATOM 703 OE1 GLN A1152 18.095 14.744 12.482 1.00 21.18 O ATOM 704 NE2 GLN A1152 19.184 15.907 14.062 1.00 23.68 N ATOM 705 HE22 GLN A1152 19.884 15.897 14.832 1.00 0.00 H ATOM 706 HE21 GLN A1152 18.698 16.792 13.812 1.00 0.00 H ATOM 707 H GLN A1152 20.745 11.578 11.913 1.00 0.00 H ATOM 708 N TYR A1153 18.541 9.272 12.491 1.00 12.75 N ATOM 709 CA TYR A1153 17.780 8.035 12.338 1.00 12.27 C ATOM 710 C TYR A1153 18.563 6.843 12.879 1.00 10.57 C ATOM 711 O TYR A1153 18.019 6.010 13.609 1.00 11.53 O ATOM 712 CB TYR A1153 17.443 7.840 10.856 1.00 13.33 C ATOM 713 CG TYR A1153 17.043 6.440 10.464 1.00 11.82 C ATOM 714 CD1 TYR A1153 15.743 6.001 10.642 1.00 12.66 C ATOM 715 CD2 TYR A1153 17.970 5.556 9.909 1.00 12.83 C ATOM 716 CE1 TYR A1153 15.368 4.718 10.280 1.00 12.24 C ATOM 717 CE2 TYR A1153 17.605 4.277 9.546 1.00 12.29 C ATOM 718 CZ TYR A1153 16.303 3.863 9.736 1.00 12.40 C ATOM 719 OH TYR A1153 15.910 2.591 9.373 1.00 13.02 O ATOM 720 HH TYR A1153 16.056 2.466 8.402 1.00 0.00 H ATOM 721 H TYR A1153 18.873 9.775 11.643 1.00 0.00 H ATOM 722 N VAL A1154 19.852 6.754 12.536 1.00 12.59 N ATOM 723 CA VAL A1154 20.691 5.667 13.036 1.00 13.64 C ATOM 724 C VAL A1154 20.731 5.676 14.560 1.00 11.91 C ATOM 725 O VAL A1154 20.637 4.620 15.207 1.00 11.63 O ATOM 726 CB VAL A1154 22.095 5.790 12.417 1.00 13.47 C ATOM 727 CG1 VAL A1154 23.043 4.749 13.018 1.00 14.97 C ATOM 728 CG2 VAL A1154 22.002 5.629 10.906 1.00 17.44 C ATOM 729 H VAL A1154 20.264 7.469 11.904 1.00 0.00 H ATOM 730 N ASP A1155 20.852 6.873 15.150 1.00 12.16 N ATOM 731 CA ASP A1155 20.879 7.033 16.605 1.00 13.12 C ATOM 732 C ASP A1155 19.609 6.468 17.230 1.00 12.01 C ATOM 733 O ASP A1155 19.670 5.749 18.236 1.00 11.10 O ATOM 734 CB ASP A1155 21.012 8.544 16.890 1.00 14.72 C ATOM 735 CG ASP A1155 21.405 8.907 18.337 1.00 21.21 C ATOM 736 OD1 ASP A1155 21.933 8.095 19.092 1.00 14.90 O ATOM 737 OD2 ASP A1155 21.200 10.087 18.715 1.00 22.21 O ATOM 738 H ASP A1155 20.930 7.720 14.552 1.00 0.00 H ATOM 739 N ASP A1156 18.449 6.757 16.632 1.00 9.64 N ATOM 740 CA ASP A1156 17.195 6.260 17.190 1.00 10.40 C ATOM 741 C ASP A1156 17.103 4.741 17.095 1.00 9.98 C ATOM 742 O ASP A1156 16.630 4.088 18.031 1.00 9.71 O ATOM 743 CB ASP A1156 15.999 6.896 16.480 1.00 10.83 C ATOM 744 CG ASP A1156 15.620 8.255 17.048 1.00 11.97 C ATOM 745 OD1 ASP A1156 16.197 8.675 18.077 1.00 13.13 O ATOM 746 OD2 ASP A1156 14.735 8.905 16.448 1.00 12.68 O ATOM 747 H ASP A1156 18.440 7.336 15.768 1.00 0.00 H ATOM 748 N VAL A1157 17.532 4.161 15.971 1.00 9.69 N ATOM 749 CA VAL A1157 17.509 2.707 15.841 1.00 10.09 C ATOM 750 C VAL A1157 18.371 2.065 16.925 1.00 10.33 C ATOM 751 O VAL A1157 17.938 1.134 17.616 1.00 9.55 O ATOM 752 CB VAL A1157 17.931 2.274 14.425 1.00 10.84 C ATOM 753 CG1 VAL A1157 18.031 0.749 14.341 1.00 12.80 C ATOM 754 CG2 VAL A1157 16.942 2.804 13.396 1.00 12.79 C ATOM 755 H VAL A1157 17.883 4.746 15.187 1.00 0.00 H ATOM 756 N TRP A1158 19.597 2.568 17.109 1.00 10.11 N ATOM 757 CA TRP A1158 20.462 1.980 18.125 1.00 9.60 C ATOM 758 C TRP A1158 19.946 2.256 19.532 1.00 10.05 C ATOM 759 O TRP A1158 20.116 1.417 20.421 1.00 9.93 O ATOM 760 CB TRP A1158 21.910 2.437 17.953 1.00 11.11 C ATOM 761 CG TRP A1158 22.630 1.659 16.906 1.00 12.72 C ATOM 762 CD1 TRP A1158 22.748 1.985 15.587 1.00 18.02 C ATOM 763 CD2 TRP A1158 23.311 0.408 17.074 1.00 13.41 C ATOM 764 NE1 TRP A1158 23.471 1.023 14.925 1.00 16.94 N ATOM 765 CE2 TRP A1158 23.822 0.041 15.815 1.00 14.60 C ATOM 766 CE3 TRP A1158 23.532 -0.437 18.166 1.00 14.38 C ATOM 767 CZ2 TRP A1158 24.557 -1.133 15.615 1.00 18.40 C ATOM 768 CZ3 TRP A1158 24.269 -1.611 17.964 1.00 18.19 C ATOM 769 CH2 TRP A1158 24.767 -1.940 16.699 1.00 16.08 C ATOM 770 HE1 TRP A1158 23.713 1.037 13.914 1.00 0.00 H ATOM 771 H TRP A1158 19.929 3.369 16.534 1.00 0.00 H ATOM 772 N LEU A1159 19.285 3.389 19.754 1.00 9.05 N ATOM 773 CA LEU A1159 18.676 3.626 21.060 1.00 9.61 C ATOM 774 C LEU A1159 17.644 2.552 21.372 1.00 8.65 C ATOM 775 O LEU A1159 17.598 2.018 22.488 1.00 10.02 O ATOM 776 CB LEU A1159 18.029 5.016 21.074 1.00 10.75 C ATOM 777 CG LEU A1159 17.278 5.392 22.351 1.00 9.96 C ATOM 778 CD1 LEU A1159 18.199 5.320 23.573 1.00 12.75 C ATOM 779 CD2 LEU A1159 16.629 6.774 22.220 1.00 12.43 C ATOM 780 H LEU A1159 19.202 4.102 19.002 1.00 0.00 H ATOM 781 N MET A1160 16.818 2.213 20.385 1.00 9.02 N ATOM 782 CA MET A1160 15.857 1.133 20.546 1.00 8.47 C ATOM 783 C MET A1160 16.553 -0.181 20.900 1.00 8.04 C ATOM 784 O MET A1160 16.123 -0.893 21.814 1.00 8.99 O ATOM 785 CB MET A1160 15.053 1.012 19.254 1.00 9.00 C ATOM 786 CG MET A1160 14.044 -0.114 19.294 1.00 9.77 C ATOM 787 SD MET A1160 13.182 -0.315 17.724 1.00 10.52 S ATOM 788 CE MET A1160 14.406 -1.227 16.793 1.00 17.83 C ATOM 789 H MET A1160 16.860 2.729 19.483 1.00 0.00 H ATOM 790 N PHE A1161 17.617 -0.538 20.171 1.00 8.45 N ATOM 791 CA PHE A1161 18.336 -1.776 20.474 1.00 10.01 C ATOM 792 C PHE A1161 18.948 -1.722 21.866 1.00 9.26 C ATOM 793 O PHE A1161 18.845 -2.683 22.640 1.00 10.03 O ATOM 794 CB PHE A1161 19.481 -2.013 19.486 1.00 9.96 C ATOM 795 CG PHE A1161 19.065 -2.213 18.051 1.00 10.13 C ATOM 796 CD1 PHE A1161 17.821 -2.715 17.706 1.00 11.47 C ATOM 797 CD2 PHE A1161 19.976 -1.933 17.038 1.00 11.99 C ATOM 798 CE1 PHE A1161 17.490 -2.912 16.371 1.00 11.24 C ATOM 799 CE2 PHE A1161 19.644 -2.127 15.707 1.00 13.98 C ATOM 800 CZ PHE A1161 18.407 -2.617 15.374 1.00 13.80 C ATOM 801 H PHE A1161 17.934 0.067 19.386 1.00 0.00 H ATOM 802 N ASN A1162 19.626 -0.615 22.183 1.00 9.89 N ATOM 803 CA ASN A1162 20.322 -0.513 23.461 1.00 10.64 C ATOM 804 C ASN A1162 19.353 -0.582 24.627 1.00 9.05 C ATOM 805 O ASN A1162 19.648 -1.197 25.654 1.00 10.04 O ATOM 806 CB ASN A1162 21.116 0.792 23.544 1.00 10.96 C ATOM 807 CG ASN A1162 22.332 0.825 22.621 1.00 12.52 C ATOM 808 OD1 ASN A1162 22.892 1.902 22.368 1.00 18.04 O ATOM 809 ND2 ASN A1162 22.746 -0.319 22.119 1.00 10.38 N ATOM 810 HD22 ASN A1162 22.249 -1.201 22.356 1.00 0.00 H ATOM 811 HD21 ASN A1162 23.571 -0.341 21.486 1.00 0.00 H ATOM 812 H ASN A1162 19.658 0.180 21.513 1.00 0.00 H ATOM 813 N ASN A1163 18.188 0.053 24.494 1.00 9.56 N ATOM 814 CA ASN A1163 17.172 -0.050 25.537 1.00 9.45 C ATOM 815 C ASN A1163 16.776 -1.499 25.782 1.00 9.79 C ATOM 816 O ASN A1163 16.636 -1.927 26.931 1.00 10.44 O ATOM 817 CB ASN A1163 15.923 0.741 25.146 1.00 9.93 C ATOM 818 CG ASN A1163 16.129 2.235 25.203 1.00 9.98 C ATOM 819 OD1 ASN A1163 17.093 2.737 25.803 1.00 10.39 O ATOM 820 ND2 ASN A1163 15.211 2.963 24.581 1.00 11.34 N ATOM 821 HD22 ASN A1163 14.421 2.496 24.092 1.00 0.00 H ATOM 822 HD21 ASN A1163 15.281 4.001 24.583 1.00 0.00 H ATOM 823 H ASN A1163 18.003 0.623 23.644 1.00 0.00 H ATOM 824 N ALA A1164 16.567 -2.264 24.712 1.00 8.85 N ATOM 825 CA ALA A1164 16.120 -3.638 24.871 1.00 9.96 C ATOM 826 C ALA A1164 17.227 -4.507 25.450 1.00 9.19 C ATOM 827 O ALA A1164 16.965 -5.386 26.274 1.00 10.86 O ATOM 828 CB ALA A1164 15.624 -4.185 23.529 1.00 10.57 C ATOM 829 H ALA A1164 16.724 -1.877 23.760 1.00 0.00 H ATOM 830 N TRP A1165 18.476 -4.266 25.046 1.00 9.83 N ATOM 831 CA TRP A1165 19.575 -5.021 25.631 1.00 9.81 C ATOM 832 C TRP A1165 19.788 -4.639 27.088 1.00 10.78 C ATOM 833 O TRP A1165 20.249 -5.467 27.881 1.00 13.82 O ATOM 834 CB TRP A1165 20.854 -4.788 24.834 1.00 11.31 C ATOM 835 CG TRP A1165 20.954 -5.498 23.511 1.00 10.29 C ATOM 836 CD1 TRP A1165 20.524 -6.769 23.199 1.00 10.89 C ATOM 837 CD2 TRP A1165 21.556 -4.976 22.324 1.00 10.66 C ATOM 838 NE1 TRP A1165 20.822 -7.054 21.881 1.00 11.37 N ATOM 839 CE2 TRP A1165 21.467 -5.975 21.329 1.00 10.99 C ATOM 840 CE3 TRP A1165 22.182 -3.763 22.009 1.00 10.30 C ATOM 841 CZ2 TRP A1165 21.980 -5.789 20.037 1.00 12.46 C ATOM 842 CZ3 TRP A1165 22.687 -3.581 20.730 1.00 12.35 C ATOM 843 CH2 TRP A1165 22.584 -4.577 19.760 1.00 13.47 C ATOM 844 HE1 TRP A1165 20.595 -7.941 21.387 1.00 0.00 H ATOM 845 H TRP A1165 18.663 -3.545 24.320 1.00 0.00 H ATOM 846 N LEU A1166 19.471 -3.401 27.457 1.00 11.10 N ATOM 847 CA LEU A1166 19.614 -2.985 28.849 1.00 12.35 C ATOM 848 C LEU A1166 18.526 -3.599 29.715 1.00 10.96 C ATOM 849 O LEU A1166 18.802 -4.126 30.802 1.00 13.96 O ATOM 850 CB LEU A1166 19.569 -1.461 28.940 1.00 12.95 C ATOM 851 CG LEU A1166 19.634 -0.915 30.366 1.00 14.52 C ATOM 852 CD1 LEU A1166 21.002 -1.190 30.974 1.00 18.32 C ATOM 853 CD2 LEU A1166 19.311 0.575 30.380 1.00 15.92 C ATOM 854 H LEU A1166 19.119 -2.725 26.749 1.00 0.00 H ATOM 855 N TYR A1167 17.282 -3.557 29.246 1.00 10.82 N ATOM 856 CA TYR A1167 16.173 -3.955 30.098 1.00 10.39 C ATOM 857 C TYR A1167 16.026 -5.464 30.172 1.00 11.81 C ATOM 858 O TYR A1167 15.722 -6.004 31.241 1.00 13.43 O ATOM 859 CB TYR A1167 14.867 -3.325 29.604 1.00 11.23 C ATOM 860 CG TYR A1167 13.737 -3.761 30.483 1.00 11.82 C ATOM 861 CD1 TYR A1167 13.595 -3.234 31.756 1.00 11.72 C ATOM 862 CD2 TYR A1167 12.862 -4.759 30.081 1.00 11.00 C ATOM 863 CE1 TYR A1167 12.598 -3.677 32.603 1.00 14.46 C ATOM 864 CE2 TYR A1167 11.853 -5.212 30.921 1.00 11.73 C ATOM 865 CZ TYR A1167 11.736 -4.664 32.183 1.00 12.79 C ATOM 866 OH TYR A1167 10.745 -5.107 33.037 1.00 15.68 O ATOM 867 HH TYR A1167 10.803 -4.613 33.893 1.00 0.00 H ATOM 868 H TYR A1167 17.103 -3.240 28.272 1.00 0.00 H ATOM 869 N ASN A1168 16.192 -6.155 29.052 1.00 10.39 N ATOM 870 CA ASN A1168 15.912 -7.584 29.000 1.00 10.75 C ATOM 871 C ASN A1168 17.158 -8.387 29.340 1.00 10.51 C ATOM 872 O ASN A1168 18.278 -7.966 29.049 1.00 12.43 O ATOM 873 CB ASN A1168 15.376 -7.949 27.615 1.00 9.69 C ATOM 874 CG ASN A1168 14.093 -7.204 27.292 1.00 11.16 C ATOM 875 OD1 ASN A1168 13.014 -7.591 27.747 1.00 11.46 O ATOM 876 ND2 ASN A1168 14.199 -6.128 26.531 1.00 10.97 N ATOM 877 HD22 ASN A1168 15.129 -5.837 26.168 1.00 0.00 H ATOM 878 HD21 ASN A1168 13.352 -5.572 26.295 1.00 0.00 H ATOM 879 H ASN A1168 16.528 -5.669 28.196 1.00 0.00 H ATOM 880 N ARG A1169 16.950 -9.547 29.960 1.00 12.16 N ATOM 881 CA ARG A1169 18.079 -10.388 30.347 1.00 13.31 C ATOM 882 C ARG A1169 18.714 -11.033 29.120 1.00 11.33 C ATOM 883 O ARG A1169 18.063 -11.253 28.098 1.00 10.89 O ATOM 884 CB ARG A1169 17.632 -11.489 31.311 1.00 15.19 C ATOM 885 CG ARG A1169 16.986 -10.973 32.587 1.00 17.93 C ATOM 886 CD ARG A1169 18.021 -10.427 33.557 1.00 22.48 C ATOM 887 NE ARG A1169 17.370 -9.784 34.696 1.00 24.64 N ATOM 888 CZ ARG A1169 18.014 -9.290 35.747 1.00 24.74 C ATOM 889 NH1 ARG A1169 19.336 -9.356 35.807 1.00 21.69 N ATOM 890 NH2 ARG A1169 17.330 -8.723 36.735 1.00 24.12 N ATOM 891 HE ARG A1169 16.333 -9.708 34.683 1.00 0.00 H ATOM 892 HH12 ARG A1169 19.839 -8.969 36.631 1.00 0.00 H ATOM 893 HH11 ARG A1169 19.871 -9.795 35.030 1.00 0.00 H ATOM 894 HH22 ARG A1169 17.832 -8.335 37.559 1.00 0.00 H ATOM 895 HH21 ARG A1169 16.293 -8.667 36.684 1.00 0.00 H ATOM 896 H ARG A1169 15.979 -9.855 30.169 1.00 0.00 H ATOM 897 N LYS A1170 20.009 -11.331 29.222 1.00 12.51 N ATOM 898 CA LYS A1170 20.734 -11.864 28.074 1.00 12.36 C ATOM 899 C LYS A1170 20.154 -13.181 27.593 1.00 12.53 C ATOM 900 O LYS A1170 20.240 -13.486 26.403 1.00 15.44 O ATOM 901 CB LYS A1170 22.209 -12.039 28.416 1.00 17.93 C ATOM 902 CG LYS A1170 22.886 -10.743 28.814 1.00 24.96 C ATOM 903 CD LYS A1170 24.341 -10.989 29.159 1.00 29.94 C ATOM 904 CE LYS A1170 24.474 -12.221 30.038 1.00 35.07 C ATOM 905 NZ LYS A1170 23.791 -12.089 31.358 1.00 37.60 N ATOM 906 HZ1 LYS A1170 24.200 -11.288 31.880 1.00 0.00 H ATOM 907 HZ2 LYS A1170 22.776 -11.923 31.206 1.00 0.00 H ATOM 908 HZ3 LYS A1170 23.923 -12.964 31.904 1.00 0.00 H ATOM 909 H LYS A1170 20.505 -11.183 30.124 1.00 0.00 H ATOM 910 N THR A1171 19.562 -13.968 28.491 1.00 13.06 N ATOM 911 CA THR A1171 18.960 -15.240 28.115 1.00 12.95 C ATOM 912 C THR A1171 17.512 -15.102 27.660 1.00 12.13 C ATOM 913 O THR A1171 16.884 -16.123 27.361 1.00 14.73 O ATOM 914 CB THR A1171 19.003 -16.217 29.296 1.00 14.74 C ATOM 915 OG1 THR A1171 18.317 -15.634 30.415 1.00 17.64 O ATOM 916 CG2 THR A1171 20.446 -16.537 29.681 1.00 15.25 C ATOM 917 HG1 THR A1171 18.343 -16.262 31.180 1.00 0.00 H ATOM 918 H THR A1171 19.529 -13.666 29.486 1.00 0.00 H ATOM 919 N SER A1172 16.967 -13.892 27.596 1.00 11.25 N ATOM 920 CA SER A1172 15.547 -13.732 27.317 1.00 11.29 C ATOM 921 C SER A1172 15.263 -13.694 25.821 1.00 12.28 C ATOM 922 O SER A1172 16.097 -13.302 24.997 1.00 12.67 O ATOM 923 CB SER A1172 15.013 -12.449 27.951 1.00 11.45 C ATOM 924 OG SER A1172 15.461 -11.286 27.254 1.00 11.27 O ATOM 925 HG SER A1172 16.450 -11.253 27.271 1.00 0.00 H ATOM 926 H SER A1172 17.560 -13.051 27.747 1.00 0.00 H ATOM 927 N ARG A1173 14.024 -14.057 25.494 1.00 12.25 N ATOM 928 CA ARG A1173 13.561 -14.037 24.115 1.00 11.42 C ATOM 929 C ARG A1173 13.692 -12.647 23.499 1.00 10.00 C ATOM 930 O ARG A1173 14.172 -12.501 22.366 1.00 10.82 O ATOM 931 CB ARG A1173 12.101 -14.486 24.116 1.00 13.26 C ATOM 932 CG ARG A1173 11.353 -14.286 22.826 1.00 15.05 C ATOM 933 CD ARG A1173 9.867 -14.648 22.999 1.00 12.79 C ATOM 934 NE ARG A1173 9.109 -13.587 23.655 1.00 13.02 N ATOM 935 CZ ARG A1173 8.719 -13.598 24.927 1.00 12.46 C ATOM 936 NH1 ARG A1173 8.039 -12.570 25.399 1.00 16.50 N ATOM 937 NH2 ARG A1173 8.999 -14.622 25.718 1.00 15.82 N ATOM 938 HE ARG A1173 8.854 -12.757 23.083 1.00 0.00 H ATOM 939 HH12 ARG A1173 7.727 -12.564 26.391 1.00 0.00 H ATOM 940 HH11 ARG A1173 7.815 -11.766 24.779 1.00 0.00 H ATOM 941 HH22 ARG A1173 8.686 -14.614 26.710 1.00 0.00 H ATOM 942 HH21 ARG A1173 9.532 -15.435 25.348 1.00 0.00 H ATOM 943 H ARG A1173 13.371 -14.363 26.243 1.00 0.00 H ATOM 944 N VAL A1174 13.270 -11.610 24.225 1.00 8.93 N ATOM 945 CA VAL A1174 13.274 -10.275 23.630 1.00 9.62 C ATOM 946 C VAL A1174 14.703 -9.812 23.362 1.00 9.86 C ATOM 947 O VAL A1174 14.979 -9.186 22.330 1.00 11.31 O ATOM 948 CB VAL A1174 12.447 -9.271 24.464 1.00 9.53 C ATOM 949 CG1 VAL A1174 12.650 -7.828 23.976 1.00 11.68 C ATOM 950 CG2 VAL A1174 10.966 -9.635 24.404 1.00 11.07 C ATOM 951 H VAL A1174 12.942 -11.750 25.202 1.00 0.00 H ATOM 952 N TYR A1175 15.643 -10.152 24.254 1.00 9.81 N ATOM 953 CA TYR A1175 17.042 -9.809 24.020 1.00 9.28 C ATOM 954 C TYR A1175 17.553 -10.475 22.752 1.00 10.74 C ATOM 955 O TYR A1175 18.216 -9.837 21.924 1.00 11.11 O ATOM 956 CB TYR A1175 17.856 -10.236 25.236 1.00 9.96 C ATOM 957 CG TYR A1175 19.297 -9.786 25.281 1.00 9.91 C ATOM 958 CD1 TYR A1175 20.266 -10.387 24.486 1.00 10.99 C ATOM 959 CD2 TYR A1175 19.697 -8.780 26.164 1.00 10.04 C ATOM 960 CE1 TYR A1175 21.595 -9.991 24.550 1.00 11.62 C ATOM 961 CE2 TYR A1175 21.031 -8.386 26.241 1.00 10.63 C ATOM 962 CZ TYR A1175 21.960 -8.989 25.424 1.00 11.29 C ATOM 963 OH TYR A1175 23.279 -8.606 25.484 1.00 14.64 O ATOM 964 HH TYR A1175 23.805 -9.137 24.835 1.00 0.00 H ATOM 965 H TYR A1175 15.374 -10.664 25.119 1.00 0.00 H ATOM 966 N LYS A1176 17.254 -11.764 22.580 1.00 11.06 N ATOM 967 CA LYS A1176 17.686 -12.479 21.390 1.00 12.32 C ATOM 968 C LYS A1176 17.048 -11.899 20.135 1.00 10.92 C ATOM 969 O LYS A1176 17.708 -11.779 19.095 1.00 13.05 O ATOM 970 CB LYS A1176 17.363 -13.961 21.557 1.00 12.48 C ATOM 971 CG LYS A1176 18.211 -14.586 22.650 1.00 22.17 C ATOM 972 CD LYS A1176 18.004 -16.085 22.747 1.00 28.73 C ATOM 973 CE LYS A1176 16.901 -16.415 23.729 1.00 35.42 C ATOM 974 NZ LYS A1176 16.786 -17.889 23.928 1.00 34.04 N ATOM 975 HZ1 LYS A1176 16.571 -18.345 23.018 1.00 0.00 H ATOM 976 HZ2 LYS A1176 17.685 -18.259 24.298 1.00 0.00 H ATOM 977 HZ3 LYS A1176 16.023 -18.088 24.606 1.00 0.00 H ATOM 978 H LYS A1176 16.704 -12.264 23.307 1.00 0.00 H ATOM 979 N PHE A1177 15.764 -11.540 20.209 1.00 10.55 N ATOM 980 CA PHE A1177 15.104 -10.909 19.070 1.00 10.92 C ATOM 981 C PHE A1177 15.796 -9.596 18.715 1.00 10.25 C ATOM 982 O PHE A1177 16.003 -9.288 17.532 1.00 12.02 O ATOM 983 CB PHE A1177 13.628 -10.639 19.399 1.00 11.53 C ATOM 984 CG PHE A1177 12.721 -11.860 19.358 1.00 11.51 C ATOM 985 CD1 PHE A1177 13.207 -13.155 19.239 1.00 14.38 C ATOM 986 CD2 PHE A1177 11.350 -11.679 19.455 1.00 12.61 C ATOM 987 CE1 PHE A1177 12.322 -14.240 19.204 1.00 13.95 C ATOM 988 CE2 PHE A1177 10.479 -12.756 19.428 1.00 12.44 C ATOM 989 CZ PHE A1177 10.968 -14.029 19.307 1.00 12.68 C ATOM 990 H PHE A1177 15.230 -11.711 21.085 1.00 0.00 H ATOM 991 N CYS A1178 16.139 -8.796 19.729 1.00 9.44 N ATOM 992 CA CYS A1178 16.853 -7.548 19.494 1.00 10.50 C ATOM 993 C CYS A1178 18.160 -7.803 18.756 1.00 10.18 C ATOM 994 O CYS A1178 18.494 -7.097 17.797 1.00 11.63 O ATOM 995 CB CYS A1178 17.132 -6.862 20.828 1.00 11.06 C ATOM 996 SG CYS A1178 17.949 -5.282 20.607 1.00 11.34 S ATOM 997 H CYS A1178 15.892 -9.069 20.702 1.00 0.00 H ATOM 998 N SER A1179 18.917 -8.816 19.186 1.00 10.81 N ATOM 999 CA SER A1179 20.203 -9.084 18.550 1.00 11.11 C ATOM 1000 C SER A1179 20.028 -9.444 17.081 1.00 12.73 C ATOM 1001 O SER A1179 20.848 -9.056 16.242 1.00 13.12 O ATOM 1002 CB SER A1179 20.934 -10.196 19.294 1.00 11.94 C ATOM 1003 OG SER A1179 21.238 -9.779 20.610 1.00 14.33 O ATOM 1004 HG SER A1179 21.712 -10.507 21.084 1.00 0.00 H ATOM 1005 H SER A1179 18.591 -9.413 19.973 1.00 0.00 H ATOM 1006 N LYS A1180 18.964 -10.178 16.751 1.00 12.46 N ATOM 1007 CA LYS A1180 18.671 -10.465 15.348 1.00 13.93 C ATOM 1008 C LYS A1180 18.414 -9.180 14.558 1.00 13.42 C ATOM 1009 O LYS A1180 18.956 -8.994 13.463 1.00 13.84 O ATOM 1010 CB LYS A1180 17.477 -11.415 15.240 1.00 16.51 C ATOM 1011 CG LYS A1180 17.010 -11.651 13.809 1.00 17.99 C ATOM 1012 CD LYS A1180 18.064 -12.363 12.981 1.00 19.54 C ATOM 1013 CE LYS A1180 17.549 -12.619 11.574 1.00 26.39 C ATOM 1014 NZ LYS A1180 18.568 -13.286 10.727 1.00 28.51 N ATOM 1015 HZ1 LYS A1180 19.412 -12.682 10.661 1.00 0.00 H ATOM 1016 HZ2 LYS A1180 18.826 -14.199 11.152 1.00 0.00 H ATOM 1017 HZ3 LYS A1180 18.178 -13.443 9.776 1.00 0.00 H ATOM 1018 H LYS A1180 18.340 -10.548 17.496 1.00 0.00 H ATOM 1019 N LEU A1181 17.591 -8.279 15.098 1.00 11.72 N ATOM 1020 CA LEU A1181 17.345 -7.010 14.412 1.00 12.60 C ATOM 1021 C LEU A1181 18.635 -6.227 14.223 1.00 13.68 C ATOM 1022 O LEU A1181 18.869 -5.638 13.159 1.00 13.67 O ATOM 1023 CB LEU A1181 16.342 -6.159 15.183 1.00 13.08 C ATOM 1024 CG LEU A1181 14.922 -6.675 15.374 1.00 16.52 C ATOM 1025 CD1 LEU A1181 14.010 -5.503 15.696 1.00 17.26 C ATOM 1026 CD2 LEU A1181 14.420 -7.405 14.144 1.00 19.40 C ATOM 1027 H LEU A1181 17.125 -8.479 16.006 1.00 0.00 H ATOM 1028 N ALA A1182 19.496 -6.211 15.239 1.00 11.71 N ATOM 1029 CA ALA A1182 20.736 -5.462 15.103 1.00 13.13 C ATOM 1030 C ALA A1182 21.627 -6.060 14.020 1.00 14.86 C ATOM 1031 O ALA A1182 22.305 -5.320 13.294 1.00 15.03 O ATOM 1032 CB ALA A1182 21.460 -5.388 16.443 1.00 15.19 C ATOM 1033 H ALA A1182 19.285 -6.727 16.117 1.00 0.00 H ATOM 1034 N GLU A1183 21.632 -7.392 13.895 1.00 13.79 N ATOM 1035 CA GLU A1183 22.405 -8.036 12.837 1.00 17.78 C ATOM 1036 C GLU A1183 21.894 -7.605 11.469 1.00 16.97 C ATOM 1037 O GLU A1183 22.675 -7.223 10.587 1.00 18.24 O ATOM 1038 CB GLU A1183 22.319 -9.556 12.990 1.00 17.27 C ATOM 1039 CG GLU A1183 23.176 -10.111 14.123 1.00 20.96 C ATOM 1040 CD GLU A1183 22.844 -11.556 14.460 1.00 28.91 C ATOM 1041 OE1 GLU A1183 21.978 -12.146 13.778 1.00 27.46 O ATOM 1042 OE2 GLU A1183 23.454 -12.105 15.405 1.00 30.48 O ATOM 1043 H GLU A1183 21.080 -7.974 14.557 1.00 0.00 H ATOM 1044 N VAL A1184 20.576 -7.635 11.288 1.00 15.30 N ATOM 1045 CA VAL A1184 19.967 -7.200 10.033 1.00 16.90 C ATOM 1046 C VAL A1184 20.292 -5.736 9.756 1.00 16.12 C ATOM 1047 O VAL A1184 20.695 -5.373 8.643 1.00 17.60 O ATOM 1048 CB VAL A1184 18.450 -7.456 10.070 1.00 16.72 C ATOM 1049 CG1 VAL A1184 17.766 -6.849 8.852 1.00 20.16 C ATOM 1050 CG2 VAL A1184 18.171 -8.953 10.160 1.00 17.76 C ATOM 1051 H VAL A1184 19.965 -7.976 12.058 1.00 0.00 H ATOM 1052 N PHE A1185 20.126 -4.875 10.765 1.00 13.92 N ATOM 1053 CA PHE A1185 20.364 -3.445 10.560 1.00 15.13 C ATOM 1054 C PHE A1185 21.803 -3.178 10.150 1.00 18.90 C ATOM 1055 O PHE A1185 22.059 -2.368 9.251 1.00 17.90 O ATOM 1056 CB PHE A1185 20.026 -2.648 11.822 1.00 14.11 C ATOM 1057 CG PHE A1185 20.025 -1.162 11.608 1.00 12.85 C ATOM 1058 CD1 PHE A1185 19.074 -0.572 10.793 1.00 14.67 C ATOM 1059 CD2 PHE A1185 20.978 -0.360 12.213 1.00 14.24 C ATOM 1060 CE1 PHE A1185 19.069 0.803 10.594 1.00 15.06 C ATOM 1061 CE2 PHE A1185 20.981 1.017 12.022 1.00 14.91 C ATOM 1062 CZ PHE A1185 20.018 1.595 11.206 1.00 14.47 C ATOM 1063 H PHE A1185 19.827 -5.222 11.699 1.00 0.00 H ATOM 1064 N GLU A1186 22.757 -3.854 10.796 1.00 17.40 N ATOM 1065 CA GLU A1186 24.161 -3.648 10.458 1.00 21.30 C ATOM 1066 C GLU A1186 24.434 -4.005 9.002 1.00 24.92 C ATOM 1067 O GLU A1186 25.234 -3.340 8.335 1.00 27.20 O ATOM 1068 CB GLU A1186 25.050 -4.455 11.401 1.00 19.58 C ATOM 1069 CG GLU A1186 25.263 -3.797 12.752 1.00 26.76 C ATOM 1070 H GLU A1186 22.498 -4.530 11.543 1.00 0.00 H ATOM 1071 N GLN A1187 23.760 -5.036 8.485 1.00 19.66 N ATOM 1072 CA GLN A1187 23.955 -5.422 7.091 1.00 22.81 C ATOM 1073 C GLN A1187 23.357 -4.394 6.137 1.00 23.83 C ATOM 1074 O GLN A1187 23.903 -4.150 5.055 1.00 30.46 O ATOM 1075 CB GLN A1187 23.351 -6.804 6.840 1.00 27.72 C ATOM 1076 H GLN A1187 23.092 -5.567 9.080 1.00 0.00 H ATOM 1077 N GLU A1188 22.240 -3.779 6.515 1.00 22.74 N ATOM 1078 CA GLU A1188 21.514 -2.908 5.598 1.00 22.44 C ATOM 1079 C GLU A1188 22.010 -1.470 5.613 1.00 25.81 C ATOM 1080 O GLU A1188 21.976 -0.803 4.572 1.00 25.11 O ATOM 1081 CB GLU A1188 20.019 -2.903 5.935 1.00 26.38 C ATOM 1082 CG GLU A1188 19.357 -4.275 5.944 1.00 31.11 C ATOM 1083 CD GLU A1188 19.031 -4.783 4.552 1.00 43.92 C ATOM 1084 OE1 GLU A1188 18.867 -3.948 3.637 1.00 46.86 O ATOM 1085 OE2 GLU A1188 18.938 -6.017 4.373 1.00 47.10 O ATOM 1086 H GLU A1188 21.879 -3.921 7.480 1.00 0.00 H ATOM 1087 N ILE A1189 22.487 -0.978 6.758 1.00 21.23 N ATOM 1088 CA ILE A1189 22.637 0.465 6.932 1.00 19.88 C ATOM 1089 C ILE A1189 23.876 1.015 6.231 1.00 19.85 C ATOM 1090 O ILE A1189 23.848 2.134 5.710 1.00 19.34 O ATOM 1091 CB ILE A1189 22.568 0.856 8.421 1.00 18.02 C ATOM 1092 CG1 ILE A1189 22.409 2.373 8.566 1.00 18.24 C ATOM 1093 CG2 ILE A1189 23.804 0.383 9.171 1.00 21.04 C ATOM 1094 CD1 ILE A1189 21.189 2.938 7.855 1.00 18.06 C ATOM 1095 H ILE A1189 22.753 -1.624 7.529 1.00 0.00 H ATOM 1096 N ASP A1190 24.993 0.274 6.210 1.00 25.98 N ATOM 1097 CA ASP A1190 26.232 0.900 5.743 1.00 28.57 C ATOM 1098 C ASP A1190 26.218 1.306 4.270 1.00 23.12 C ATOM 1099 O ASP A1190 26.616 2.445 3.969 1.00 29.27 O ATOM 1100 CB ASP A1190 27.477 0.120 6.193 1.00 42.57 C ATOM 1101 CG ASP A1190 27.399 -1.357 5.883 1.00 51.13 C ATOM 1102 OD1 ASP A1190 26.396 -1.994 6.264 1.00 53.45 O ATOM 1103 OD2 ASP A1190 28.351 -1.882 5.264 1.00 54.20 O ATOM 1104 H ASP A1190 24.980 -0.719 6.517 1.00 0.00 H ATOM 1105 N PRO A1191 25.766 0.477 3.320 1.00 24.76 N ATOM 1106 CA PRO A1191 25.704 0.961 1.929 1.00 27.11 C ATOM 1107 C PRO A1191 24.760 2.134 1.749 1.00 22.92 C ATOM 1108 O PRO A1191 25.004 3.001 0.900 1.00 23.55 O ATOM 1109 CB PRO A1191 25.227 -0.270 1.147 1.00 31.37 C ATOM 1110 CG PRO A1191 24.536 -1.108 2.150 1.00 34.31 C ATOM 1111 CD PRO A1191 25.315 -0.922 3.411 1.00 27.41 C ATOM 1112 N VAL A1192 23.690 2.197 2.540 1.00 23.71 N ATOM 1113 CA VAL A1192 22.771 3.323 2.441 1.00 21.66 C ATOM 1114 C VAL A1192 23.428 4.602 2.946 1.00 20.04 C ATOM 1115 O VAL A1192 23.325 5.662 2.314 1.00 21.57 O ATOM 1116 CB VAL A1192 21.460 2.994 3.175 1.00 18.28 C ATOM 1117 CG1 VAL A1192 20.586 4.240 3.294 1.00 21.93 C ATOM 1118 CG2 VAL A1192 20.725 1.887 2.436 1.00 19.19 C ATOM 1119 H VAL A1192 23.510 1.440 3.230 1.00 0.00 H ATOM 1120 N MET A1193 24.122 4.529 4.084 1.00 20.34 N ATOM 1121 CA MET A1193 24.798 5.716 4.597 1.00 22.34 C ATOM 1122 C MET A1193 25.901 6.189 3.656 1.00 26.18 C ATOM 1123 O MET A1193 26.125 7.398 3.523 1.00 26.49 O ATOM 1124 CB MET A1193 25.343 5.449 6.001 1.00 20.26 C ATOM 1125 CG MET A1193 24.252 5.140 7.026 1.00 21.17 C ATOM 1126 SD MET A1193 23.075 6.500 7.260 1.00 22.80 S ATOM 1127 CE MET A1193 24.068 7.611 8.244 1.00 23.84 C ATOM 1128 H MET A1193 24.181 3.630 4.603 1.00 0.00 H ATOM 1129 N GLN A1194 26.584 5.259 2.987 1.00 23.08 N ATOM 1130 CA GLN A1194 27.609 5.651 2.025 1.00 28.24 C ATOM 1131 C GLN A1194 26.993 6.357 0.823 1.00 28.91 C ATOM 1132 O GLN A1194 27.544 7.347 0.328 1.00 31.17 O ATOM 1133 CB GLN A1194 28.407 4.424 1.582 1.00 32.83 C ATOM 1134 CG GLN A1194 29.240 3.778 2.684 1.00 39.35 C ATOM 1135 CD GLN A1194 30.264 4.726 3.285 1.00 45.41 C ATOM 1136 OE1 GLN A1194 31.081 5.309 2.571 1.00 51.25 O ATOM 1137 NE2 GLN A1194 30.226 4.882 4.605 1.00 39.15 N ATOM 1138 HE22 GLN A1194 29.518 4.369 5.169 1.00 0.00 H ATOM 1139 HE21 GLN A1194 30.904 5.517 5.073 1.00 0.00 H ATOM 1140 H GLN A1194 26.386 4.251 3.151 1.00 0.00 H ATOM 1141 N SER A1195 25.848 5.867 0.344 1.00 25.23 N ATOM 1142 CA SER A1195 25.180 6.511 -0.784 1.00 29.48 C ATOM 1143 C SER A1195 24.652 7.893 -0.416 1.00 32.52 C ATOM 1144 O SER A1195 24.534 8.763 -1.287 1.00 33.48 O ATOM 1145 CB SER A1195 24.053 5.619 -1.303 1.00 33.31 C ATOM 1146 OG SER A1195 22.911 5.701 -0.467 1.00 38.79 O ATOM 1147 HG SER A1195 23.151 5.408 0.448 1.00 0.00 H ATOM 1148 H SER A1195 25.428 5.020 0.777 1.00 0.00 H ATOM 1149 N LEU A1196 24.320 8.110 0.853 1.00 27.38 N ATOM 1150 CA LEU A1196 23.964 9.435 1.334 1.00 29.04 C ATOM 1151 C LEU A1196 25.250 10.169 1.699 1.00 44.76 C ATOM 1152 O LEU A1196 26.331 9.579 1.689 1.00 52.79 O ATOM 1153 CB LEU A1196 23.057 9.338 2.563 1.00 24.45 C ATOM 1154 CG LEU A1196 21.628 8.817 2.383 1.00 26.89 C ATOM 1155 CD1 LEU A1196 21.032 8.455 3.731 1.00 24.95 C ATOM 1156 CD2 LEU A1196 20.752 9.848 1.676 1.00 24.97 C ATOM 1157 H LEU A1196 24.315 7.311 1.519 1.00 0.00 H ATOM 1158 N GLY A1197 25.133 11.451 2.027 1.00 47.70 N ATOM 1159 CA GLY A1197 26.286 12.241 2.420 1.00 49.21 C ATOM 1160 H GLY A1197 24.195 11.899 2.002 1.00 0.00 H TER 1161 GLY A1197 HETATM 1162 O HOH 1 13.207 10.197 25.777 1.00 28.63 O HETATM 1163 O HOH 2 24.796 -11.034 17.017 1.00 32.18 O HETATM 1164 O HOH 3 5.621 4.689 6.023 1.00 30.35 O HETATM 1165 O HOH 4 12.893 9.019 23.382 1.00 22.06 O HETATM 1166 O HOH 5 5.214 -9.842 9.868 1.00 27.88 O HETATM 1167 O HOH 6 13.447 17.969 10.224 1.00 34.62 O HETATM 1168 O HOH 7 22.438 15.884 13.951 1.00 33.57 O HETATM 1169 O HOH 8 20.400 -6.649 30.170 1.00 16.66 O HETATM 1170 O HOH 9 13.380 -1.850 25.570 1.00 9.78 O HETATM 1171 O HOH 10 17.897 -18.250 26.278 1.00 29.46 O HETATM 1172 O HOH 11 19.454 18.740 6.705 1.00 29.84 O HETATM 1173 O HOH 12 13.567 -16.379 12.805 1.00 34.99 O HETATM 1174 O HOH 13 3.588 5.178 18.097 1.00 28.96 O HETATM 1175 O HOH 14 12.051 17.702 -1.433 1.00 28.95 O HETATM 1176 O HOH 15 -0.060 -4.604 34.254 1.00 32.81 O HETATM 1177 O HOH 16 15.323 10.782 19.423 1.00 24.65 O HETATM 1178 O HOH 17 7.624 1.615 34.209 1.00 21.36 O HETATM 1179 O HOH 18 16.245 -12.704 8.404 1.00 35.84 O HETATM 1180 O HOH 19 20.430 17.171 -0.450 1.00 41.73 O HETATM 1181 O HOH 20 12.199 -9.937 28.710 1.00 13.13 O HETATM 1182 O HOH 21 4.423 12.370 5.230 1.00 26.79 O HETATM 1183 O HOH 22 12.660 7.242 34.676 1.00 27.14 O HETATM 1184 O HOH 23 -2.107 -6.568 27.870 1.00 27.21 O HETATM 1185 O HOH 24 20.870 12.100 16.971 1.00 20.77 O HETATM 1186 O HOH 25 12.379 11.919 6.229 1.00 23.17 O HETATM 1187 O HOH 26 9.034 4.207 22.054 1.00 12.78 O HETATM 1188 O HOH 27 26.753 2.486 -1.076 1.00 31.41 O HETATM 1189 O HOH 28 18.683 -3.912 33.481 1.00 38.68 O HETATM 1190 O HOH 29 5.570 7.617 19.260 1.00 36.05 O HETATM 1191 O HOH 30 5.119 -4.059 19.059 1.00 19.75 O HETATM 1192 O HOH 31 4.801 0.136 13.717 1.00 19.09 O HETATM 1193 O HOH 32 16.013 -15.086 16.196 1.00 31.48 O HETATM 1194 O HOH 33 11.959 -15.704 11.165 1.00 49.94 O HETATM 1195 O HOH 34 14.883 10.882 29.661 1.00 24.58 O HETATM 1196 O HOH 35 12.671 3.631 -0.931 1.00 34.88 O HETATM 1197 O HOH 36 25.341 -1.123 22.005 1.00 20.67 O HETATM 1198 O HOH 37 14.777 -8.957 34.558 1.00 35.71 O HETATM 1199 O HOH 38 18.077 2.671 0.130 1.00 31.15 O HETATM 1200 O HOH 39 13.540 -13.217 10.969 1.00 25.85 O HETATM 1201 O HOH 40 13.299 13.249 8.108 1.00 28.09 O HETATM 1202 O HOH 41 22.073 -13.475 24.363 1.00 26.44 O HETATM 1203 O HOH 42 4.496 6.911 15.899 1.00 19.86 O HETATM 1204 O HOH 43 15.543 4.863 38.019 1.00 34.02 O HETATM 1205 O HOH 44 10.569 -16.871 25.784 1.00 23.50 O HETATM 1206 O HOH 45 19.094 2.600 33.679 1.00 22.33 O HETATM 1207 O HOH 46 8.836 -1.650 21.788 1.00 10.13 O HETATM 1208 O HOH 47 3.690 -2.243 24.755 1.00 15.00 O HETATM 1209 O HOH 48 12.339 1.540 24.277 1.00 14.54 O HETATM 1210 O HOH 49 17.038 4.802 27.634 1.00 13.84 O HETATM 1211 O HOH 50 21.580 -12.248 21.803 1.00 18.24 O HETATM 1212 O HOH 51 17.965 4.166 30.085 1.00 17.76 O HETATM 1213 O HOH 52 1.322 -3.452 24.315 1.00 18.17 O HETATM 1214 O HOH 53 15.088 15.375 15.154 1.00 35.16 O HETATM 1215 O HOH 54 15.642 13.015 16.308 1.00 20.60 O HETATM 1216 O HOH 55 13.574 -0.939 22.960 1.00 12.14 O HETATM 1217 O HOH 56 13.895 -3.572 2.821 1.00 32.99 O HETATM 1218 O HOH 57 11.355 -0.811 21.451 1.00 13.89 O HETATM 1219 O HOH 58 19.897 2.928 25.906 1.00 17.64 O HETATM 1220 O HOH 59 21.133 -12.157 10.979 1.00 36.01 O HETATM 1221 O HOH 60 25.373 -7.991 10.808 1.00 29.50 O HETATM 1222 O HOH 61 -4.188 3.189 32.491 1.00 25.17 O HETATM 1223 O HOH 62 24.807 -9.235 23.195 1.00 31.37 O HETATM 1224 O HOH 63 3.887 -6.010 17.646 1.00 28.89 O HETATM 1225 O HOH 64 11.155 -7.884 32.681 1.00 21.64 O HETATM 1226 O HOH 65 5.276 13.316 13.287 1.00 30.86 O HETATM 1227 O HOH 66 13.982 -8.033 32.190 1.00 19.88 O HETATM 1228 O HOH 67 20.256 5.246 33.867 1.00 38.28 O HETATM 1229 O HOH 68 8.110 2.903 25.929 1.00 19.85 O HETATM 1230 O HOH 69 16.416 -4.885 33.770 1.00 32.67 O HETATM 1231 O HOH 70 25.068 13.822 8.419 1.00 30.28 O HETATM 1232 O HOH 71 3.716 -10.496 20.184 1.00 23.48 O HETATM 1233 O HOH 72 3.122 -12.262 13.179 1.00 39.86 O HETATM 1234 O HOH 73 18.067 11.252 16.778 1.00 19.83 O HETATM 1235 O HOH 74 1.693 2.517 14.903 1.00 26.62 O HETATM 1236 O HOH 75 23.482 -8.371 17.202 1.00 24.56 O HETATM 1237 O HOH 76 17.295 9.324 -1.558 1.00 29.88 O HETATM 1238 O HOH 77 26.984 -1.193 9.176 1.00 39.46 O HETATM 1239 O HOH 78 0.362 1.919 20.694 1.00 31.98 O HETATM 1240 O HOH 79 -5.734 0.586 35.001 1.00 30.75 O HETATM 1241 O HOH 80 3.860 -10.198 31.646 1.00 27.37 O HETATM 1242 O HOH 81 23.900 -8.728 20.038 1.00 26.68 O HETATM 1243 O HOH 82 8.948 -4.844 5.348 1.00 39.68 O HETATM 1244 O HOH 83 4.055 4.005 26.409 1.00 29.15 O HETATM 1245 O HOH 84 19.673 -13.601 17.898 1.00 23.11 O HETATM 1246 O HOH 85 14.188 -10.276 30.656 1.00 15.02 O HETATM 1247 O HOH 86 7.300 -10.350 7.587 1.00 36.47 O HETATM 1248 O HOH 87 14.431 -17.198 28.593 1.00 23.96 O HETATM 1249 O HOH 88 2.848 -7.729 9.824 1.00 26.08 O HETATM 1250 O HOH 89 -2.738 -4.885 31.500 1.00 32.92 O HETATM 1251 O HOH 90 21.804 4.010 24.150 1.00 17.44 O HETATM 1252 O HOH 91 12.549 -15.822 27.369 1.00 19.62 O HETATM 1253 O HOH 92 15.325 16.579 6.252 1.00 30.04 O HETATM 1254 O HOH 93 11.284 -13.269 9.321 1.00 24.55 O HETATM 1255 O HOH 94 15.121 -10.558 5.784 1.00 41.87 O HETATM 1256 O HOH 95 2.301 -6.182 14.421 1.00 36.46 O HETATM 1257 O HOH 96 8.228 -15.166 28.574 1.00 19.15 O HETATM 1258 O HOH 97 11.723 -11.956 26.809 1.00 13.60 O HETATM 1259 O HOH 98 11.288 6.583 36.940 1.00 34.01 O HETATM 1260 O HOH 99 9.272 2.068 23.733 1.00 14.87 O HETATM 1261 O HOH 100 4.705 1.262 36.616 1.00 34.73 O HETATM 1262 O HOH 101 2.302 -3.914 15.128 1.00 27.15 O HETATM 1263 O HOH 102 25.102 2.466 20.284 1.00 29.55 O HETATM 1264 O HOH 103 13.426 5.676 38.502 1.00 45.03 O HETATM 1265 O HOH 104 2.303 -8.051 18.565 1.00 24.45 O HETATM 1266 O HOH 105 6.621 -13.178 28.167 1.00 29.76 O HETATM 1267 O HOH 106 14.742 13.008 27.970 1.00 29.65 O HETATM 1268 O HOH 107 25.213 1.814 12.308 1.00 27.70 O HETATM 1269 O HOH 108 0.827 -6.214 24.259 1.00 23.42 O HETATM 1270 O HOH 109 24.773 -6.437 15.211 1.00 35.93 O HETATM 1271 O HOH 110 16.113 2.933 -1.899 1.00 41.45 O HETATM 1272 O HOH 111 16.227 17.191 16.264 1.00 37.81 O HETATM 1273 O HOH 112 19.573 6.240 27.180 1.00 25.52 O HETATM 1274 O HOH 113 2.566 -8.813 24.537 1.00 32.70 O HETATM 1275 O HOH 114 10.811 -14.093 28.686 1.00 18.57 O HETATM 1276 O HOH 115 13.217 12.581 26.146 1.00 36.74 O HETATM 1277 O HOH 116 -2.480 3.860 34.639 1.00 38.55 O HETATM 1278 O HOH 117 13.956 10.674 21.533 1.00 24.31 O HETATM 1279 O HOH 118 1.358 -8.251 14.257 1.00 37.14 O HETATM 1280 O HOH 119 15.010 20.456 3.162 1.00 52.92 O HETATM 1281 O HOH 120 14.905 12.745 22.953 1.00 26.74 O HETATM 1282 O HOH 121 17.227 10.768 31.008 1.00 32.64 O HETATM 1283 O HOH 122 3.664 2.365 12.929 1.00 32.94 O HETATM 1284 O HOH 123 3.118 0.021 35.188 1.00 39.11 O HETATM 1285 O HOH 124 17.340 12.239 -4.894 1.00 42.22 O HETATM 1286 O HOH 125 14.743 18.813 7.722 1.00 40.92 O HETATM 1287 O HOH 126 23.239 -13.187 19.932 1.00 30.51 O HETATM 1288 O HOH 127 15.032 -15.436 10.568 1.00 42.69 O HETATM 1289 O HOH 128 -6.354 -1.949 35.270 1.00 31.88 O HETATM 1290 O HOH 129 10.079 -9.034 30.188 1.00 17.43 O HETATM 1291 O HOH 130 8.023 -10.197 33.900 1.00 36.54 O HETATM 1292 O HOH 131 25.094 -7.304 22.004 1.00 33.95 O HETATM 1293 O HOH 132 20.639 11.075 -1.825 1.00 49.03 O HETATM 1294 O HOH 133 3.016 4.245 28.747 1.00 32.65 O HETATM 1295 O HOH 134 6.526 -10.931 32.082 1.00 36.60 O HETATM 1296 O HOH 135 16.043 10.815 -3.106 1.00 40.70 O HETATM 1297 O HOH 136 26.123 -0.799 11.782 1.00 36.82 O HETATM 1298 O HOH 137 21.756 2.318 27.288 1.00 35.17 O HETATM 1299 O HOH 138 4.974 3.469 37.100 1.00 37.75 O HETATM 1300 O HOH 139 22.371 14.324 17.872 1.00 47.21 O HETATM 1301 O HOH 140 4.929 3.040 34.193 1.00 31.96 O HETATM 1302 O HOH 141 19.828 0.571 34.907 1.00 35.97 O HETATM 1303 O HOH 142 14.302 8.428 36.114 1.00 37.23 O HETATM 1304 O HOH 143 19.591 -1.806 34.657 1.00 35.67 O HETATM 1305 O HOH 144 14.099 -12.724 31.708 1.00 25.66 O HETATM 1306 O HOH 145 3.367 -12.494 18.690 1.00 34.02 O HETATM 1307 O HOH 146 22.452 4.193 35.448 1.00 39.57 O HETATM 1308 O HOH 147 20.664 4.996 30.076 1.00 29.19 O HETATM 1309 CAA E A 2 6.833 -8.544 28.733 1.00 -0.04 C HETATM 1310 CAQ E A 2 7.589 -9.205 27.588 1.00 0.07 C HETATM 1311 OAS E A 2 7.343 -8.489 26.376 1.00 -0.31 O HETATM 1312 CBC E A 2 8.256 -7.500 26.106 1.00 0.11 C HETATM 1313 CAL E A 2 9.266 -7.111 26.991 1.00 -0.02 C HETATM 1314 CAK E A 2 10.155 -6.087 26.671 1.00 -0.05 C HETATM 1315 CAY E A 2 10.065 -5.452 25.435 1.00 0.02 C HETATM 1316 CAP E A 2 9.047 -5.865 24.549 1.00 -0.04 C HETATM 1317 CBE E A 2 8.127 -6.890 24.862 1.00 0.01 C HETATM 1318 CAZ E A 2 7.150 -7.258 23.894 1.00 -0.04 C HETATM 1319 CAM E A 2 7.138 -8.537 23.304 1.00 -0.05 C HETATM 1320 CAX E A 2 6.203 -8.895 22.322 1.00 0.05 C HETATM 1321 CAN E A 2 5.267 -7.926 21.928 1.00 -0.05 C HETATM 1322 CBA E A 2 5.216 -6.637 22.476 1.00 -0.06 C HETATM 1323 CAO E A 2 6.183 -6.350 23.462 1.00 -0.08 C HETATM 1324 H20 E A 2 6.174 -5.364 23.912 1.00 0.04 H HETATM 1325 CBF E A 2 4.263 -5.713 22.033 1.00 0.07 C HETATM 1326 CBB E A 2 4.412 -4.365 21.901 1.00 0.15 C HETATM 1327 CAC E A 2 5.612 -3.465 22.214 1.00 0.02 C HETATM 1328 H7 E A 2 5.359 -2.421 21.977 1.00 0.05 H HETATM 1329 H8 E A 2 6.474 -3.780 21.608 1.00 0.05 H HETATM 1330 H9 E A 2 5.864 -3.548 23.281 1.00 0.05 H HETATM 1331 OAU E A 2 3.287 -3.786 21.423 1.00 -0.15 O HETATM 1332 NBH E A 2 2.403 -4.790 21.233 1.00 -0.12 N HETATM 1333 CAD E A 2 1.049 -4.469 20.698 1.00 0.06 C HETATM 1334 H10 E A 2 0.969 -3.385 20.529 1.00 0.05 H HETATM 1335 H11 E A 2 0.284 -4.785 21.423 1.00 0.05 H HETATM 1336 H12 E A 2 0.895 -5.000 19.747 1.00 0.05 H HETATM 1337 CBG E A 2 2.986 -5.943 21.594 1.00 0.20 C HETATM 1338 OAG E A 2 2.386 -7.034 21.524 1.00 -0.42 O HETATM 1339 H19 E A 2 4.547 -8.188 21.161 1.00 0.04 H HETATM 1340 NAR E A 2 6.128 -10.116 21.667 1.00 -0.24 N HETATM 1341 CAW E A 2 6.926 -11.195 21.843 1.00 0.26 C HETATM 1342 CBD E A 2 6.702 -12.291 21.066 1.00 0.19 C HETATM 1343 CAJ E A 2 6.065 -12.442 19.896 1.00 -0.04 C HETATM 1344 CAH E A 2 6.127 -13.733 19.514 1.00 -0.06 C HETATM 1345 CAI E A 2 6.823 -14.400 20.427 1.00 0.09 C HETATM 1346 OAT E A 2 7.202 -13.504 21.405 1.00 -0.25 O HETATM 1347 H14 E A 2 7.053 -15.464 20.407 1.00 0.10 H HETATM 1348 H13 E A 2 5.684 -14.155 18.613 1.00 0.04 H HETATM 1349 H15 E A 2 5.574 -11.645 19.340 1.00 0.04 H HETATM 1350 OAF E A 2 7.819 -11.254 22.686 1.00 -0.38 O HETATM 1351 H24 E A 2 5.401 -10.210 20.987 1.00 0.22 H HETATM 1352 H18 E A 2 7.875 -9.267 23.619 1.00 0.04 H HETATM 1353 H21 E A 2 8.968 -5.374 23.586 1.00 0.07 H HETATM 1354 CAV E A 2 11.013 -4.462 25.106 1.00 0.12 C HETATM 1355 CAB E A 2 10.895 -3.786 23.742 1.00 0.01 C HETATM 1356 H4 E A 2 11.698 -3.042 23.631 1.00 0.04 H HETATM 1357 H5 E A 2 9.919 -3.285 23.664 1.00 0.04 H HETATM 1358 H6 E A 2 10.983 -4.543 22.949 1.00 0.04 H HETATM 1359 OAE E A 2 11.997 -4.215 25.813 1.00 -0.38 O HETATM 1360 H16 E A 2 10.915 -5.785 27.383 1.00 0.06 H HETATM 1361 H17 E A 2 9.359 -7.616 27.945 1.00 0.06 H HETATM 1362 H22 E A 2 7.247 -10.244 27.475 1.00 0.06 H HETATM 1363 H23 E A 2 8.667 -9.195 27.807 1.00 0.06 H HETATM 1364 H1 E A 2 7.023 -9.096 29.665 1.00 0.03 H HETATM 1365 H2 E A 2 5.755 -8.554 28.515 1.00 0.03 H HETATM 1366 H3 E A 2 7.175 -7.505 28.846 1.00 0.03 H CONECT 1 2 13 14 15 CONECT 13 1 CONECT 14 1 CONECT 15 1 CONECT 1309 1310 1364 1365 1366 CONECT 1310 1309 1311 1362 1363 CONECT 1311 1310 1312 CONECT 1312 1311 1313 1317 CONECT 1313 1312 1314 1361 CONECT 1314 1313 1315 1360 CONECT 1315 1314 1316 1354 CONECT 1316 1315 1317 1353 CONECT 1317 1312 1316 1318 CONECT 1318 1317 1319 1323 CONECT 1319 1318 1320 1352 CONECT 1320 1319 1321 1340 CONECT 1321 1320 1322 1339 CONECT 1322 1321 1323 1325 CONECT 1323 1318 1322 1324 CONECT 1324 1323 CONECT 1325 1322 1326 1337 CONECT 1326 1325 1327 1331 CONECT 1327 1326 1328 1329 1330 CONECT 1328 1327 CONECT 1329 1327 CONECT 1330 1327 CONECT 1331 1326 1332 CONECT 1332 1331 1333 1337 CONECT 1333 1332 1334 1335 1336 CONECT 1334 1333 CONECT 1335 1333 CONECT 1336 1333 CONECT 1337 1325 1332 1338 CONECT 1338 1337 CONECT 1339 1321 CONECT 1340 1320 1341 1351 CONECT 1341 1340 1342 1350 CONECT 1342 1341 1343 1346 CONECT 1343 1342 1344 1349 CONECT 1344 1343 1345 1348 CONECT 1345 1344 1346 1347 CONECT 1346 1342 1345 CONECT 1347 1345 CONECT 1348 1344 CONECT 1349 1343 CONECT 1350 1341 CONECT 1351 1340 CONECT 1352 1319 CONECT 1353 1316 CONECT 1354 1315 1355 1359 CONECT 1355 1354 1356 1357 1358 CONECT 1356 1355 CONECT 1357 1355 CONECT 1358 1355 CONECT 1359 1354 CONECT 1360 1314 CONECT 1361 1313 CONECT 1362 1310 CONECT 1363 1310 CONECT 1364 1309 CONECT 1365 1309 CONECT 1366 1309 MASTER 0 0 0 0 0 0 0 0 1365 1 62 9 END
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Structure:
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Related entries of code: 6fqo
Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
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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%
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%
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
6fqo
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
CREB-binding protein
Ligand Name
E2T
EC.Number
E.C.2.3.1.48
Resolution
1.35(Å)
Affinity (Kd/Ki/IC50)
IC50=0.140uM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) ACS Med Chem Lett Vol. 9: pp. 929-934
Ligand Properties
Formula
C
2
6
H
2
4
N
2
O
6
Molecular Weight
460.479
Exact Mass
460.163
No. of atoms
58
No. of bonds
61
Polar Surface Area
103.68
LOGP Value
3.79 (
Computed with XLOGP3
)
5.14 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 8
No. of Nitrogen and Oxygen Atoms: 8
No. of Rings: 4
Canonical SMILES
CCOc1ccc(cc1c1cc(NC(=O)c2ccco2)cc(c1)c1c(C)on(c1=O)C)C(=O)C
InChI String
InChI=1S/C26H24N2O6/c1-5-32-22-9-8-17(15(2)29)14-21(22)18-11-19(24-16(3)34-28(4)26(24)31)13-20(12-18)27-25(30)23-7-6-10-33-23/h6-14H,5H2,1-4H3,(H,27,30)
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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