Browse entries in the PDBbind-CN Database
HEADER 5MPN_COMPLEX COMPND 5MPN_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 118 SER MET ARG LYS LYS ILE PHE LYS PRO GLU GLU LEU ARG SEQRES 2 A 118 GLN ALA LEU MET PRO THR LEU GLU ALA LEU TYR ARG GLN SEQRES 3 A 118 ASP PRO GLU SER LEU PRO PHE ARG GLN PRO VAL ASP PRO SEQRES 4 A 118 GLN LEU LEU GLY ILE PRO ASP TYR PHE ASP ILE VAL LYS SEQRES 5 A 118 ASN PRO MET ASP LEU SER THR ILE LYS ARG LYS LEU ASP SEQRES 6 A 118 THR GLY GLN TYR GLN GLU PRO TRP GLN TYR VAL ASP ASP SEQRES 7 A 118 VAL TRP LEU MET PHE ASN ASN ALA TRP LEU TYR ASN ARG SEQRES 8 A 118 LYS THR SER ARG VAL TYR LYS PHE CYS SER LYS LEU ALA SEQRES 9 A 118 GLU VAL PHE GLU GLN GLU ILE ASP PRO VAL MET GLN SER SEQRES 10 A 118 LEU HET YE A 5 39 ATOM 1 N SER A1079 12.511 1.991 37.599 1.00 27.29 N ATOM 2 CA SER A1079 12.908 2.023 36.200 1.00 26.12 C ATOM 3 C SER A1079 11.784 1.453 35.352 1.00 24.69 C ATOM 4 O SER A1079 10.852 0.832 35.863 1.00 24.61 O ATOM 5 CB SER A1079 14.189 1.212 35.983 1.00 26.12 C ATOM 6 OG SER A1079 13.937 -0.180 36.085 1.00 25.61 O ATOM 7 HG SER A1079 14.780 -0.678 35.941 1.00 0.00 H ATOM 8 HN3 SER A1079 12.322 1.008 37.882 1.00 0.00 H ATOM 9 HN2 SER A1079 11.651 2.562 37.727 1.00 0.00 H ATOM 10 HN1 SER A1079 13.277 2.380 38.185 1.00 0.00 H ATOM 11 N MET A1080 11.866 1.668 34.046 1.00 23.64 N ATOM 12 CA MET A1080 10.945 1.063 33.091 1.00 22.27 C ATOM 13 C MET A1080 11.761 0.066 32.288 1.00 30.14 C ATOM 14 O MET A1080 12.464 0.435 31.342 1.00 34.29 O ATOM 15 CB MET A1080 10.277 2.115 32.217 1.00 21.69 C ATOM 16 CG MET A1080 9.217 2.881 32.973 1.00 22.25 C ATOM 17 SD MET A1080 8.351 4.065 31.951 1.00 21.58 S ATOM 18 CE MET A1080 7.364 2.968 30.941 1.00 27.27 C ATOM 19 H MET A1080 12.617 2.293 33.689 1.00 0.00 H ATOM 20 N ARG A1081 11.679 -1.193 32.695 1.00 36.91 N ATOM 21 CA ARG A1081 12.456 -2.264 32.100 1.00 40.05 C ATOM 22 C ARG A1081 11.698 -2.838 30.914 1.00 38.12 C ATOM 23 O ARG A1081 10.470 -2.959 30.946 1.00 37.37 O ATOM 24 CB ARG A1081 12.668 -3.359 33.143 1.00 44.60 C ATOM 25 CG ARG A1081 12.743 -2.826 34.563 1.00 48.22 C ATOM 26 CD ARG A1081 13.117 -3.919 35.535 1.00 52.83 C ATOM 27 NE ARG A1081 12.041 -4.877 35.762 1.00 54.44 N ATOM 28 CZ ARG A1081 11.397 -5.007 36.916 1.00 56.27 C ATOM 29 NH1 ARG A1081 10.430 -5.905 37.042 1.00 54.11 N ATOM 30 NH2 ARG A1081 11.728 -4.241 37.949 1.00 55.52 N ATOM 31 HE ARG A1081 11.762 -5.495 34.973 1.00 0.00 H ATOM 32 HH12 ARG A1081 9.927 -6.004 37.947 1.00 0.00 H ATOM 33 HH11 ARG A1081 10.174 -6.510 36.236 1.00 0.00 H ATOM 34 HH22 ARG A1081 11.225 -4.342 38.853 1.00 0.00 H ATOM 35 HH21 ARG A1081 12.491 -3.540 37.854 1.00 0.00 H ATOM 36 H ARG A1081 11.030 -1.423 33.474 1.00 0.00 H ATOM 37 N LYS A1082 12.432 -3.179 29.861 1.00 43.68 N ATOM 38 CA LYS A1082 11.842 -3.860 28.719 1.00 46.37 C ATOM 39 C LYS A1082 11.835 -5.354 29.009 1.00 41.11 C ATOM 40 O LYS A1082 12.894 -5.958 29.208 1.00 42.08 O ATOM 41 CB LYS A1082 12.613 -3.571 27.434 1.00 49.88 C ATOM 42 CG LYS A1082 11.888 -4.076 26.198 1.00 51.09 C ATOM 43 CD LYS A1082 10.499 -3.459 26.112 1.00 53.63 C ATOM 44 CE LYS A1082 9.597 -4.211 25.146 1.00 54.01 C ATOM 45 NZ LYS A1082 9.126 -5.505 25.716 1.00 54.55 N ATOM 46 HZ1 LYS A1082 9.946 -6.107 25.931 1.00 0.00 H ATOM 47 HZ2 LYS A1082 8.590 -5.323 26.588 1.00 0.00 H ATOM 48 HZ3 LYS A1082 8.514 -5.985 25.025 1.00 0.00 H ATOM 49 H LYS A1082 13.448 -2.955 29.853 1.00 0.00 H ATOM 50 N LYS A1083 10.645 -5.942 29.047 1.00 36.50 N ATOM 51 CA LYS A1083 10.528 -7.358 29.351 1.00 34.90 C ATOM 52 C LYS A1083 11.030 -8.190 28.177 1.00 31.89 C ATOM 53 O LYS A1083 10.820 -7.842 27.011 1.00 34.57 O ATOM 54 CB LYS A1083 9.072 -7.702 29.659 1.00 42.46 C ATOM 55 CG LYS A1083 8.889 -8.899 30.579 1.00 46.88 C ATOM 56 CD LYS A1083 7.420 -9.119 30.903 1.00 50.05 C ATOM 57 CE LYS A1083 7.208 -10.405 31.687 1.00 54.89 C ATOM 58 NZ LYS A1083 5.760 -10.682 31.908 1.00 56.27 N ATOM 59 HZ1 LYS A1083 5.336 -9.897 32.443 1.00 0.00 H ATOM 60 HZ2 LYS A1083 5.282 -10.775 30.989 1.00 0.00 H ATOM 61 HZ3 LYS A1083 5.656 -11.566 32.446 1.00 0.00 H ATOM 62 H LYS A1083 9.788 -5.384 28.857 1.00 0.00 H ATOM 63 N ILE A1084 11.717 -9.282 28.492 1.00 30.00 N ATOM 64 CA ILE A1084 12.181 -10.245 27.501 1.00 28.80 C ATOM 65 C ILE A1084 11.166 -11.373 27.442 1.00 25.61 C ATOM 66 O ILE A1084 10.709 -11.865 28.482 1.00 26.94 O ATOM 67 CB ILE A1084 13.573 -10.788 27.873 1.00 35.95 C ATOM 68 CG1 ILE A1084 14.544 -9.636 28.134 1.00 42.32 C ATOM 69 CG2 ILE A1084 14.099 -11.706 26.781 1.00 38.01 C ATOM 70 CD1 ILE A1084 14.713 -8.701 26.962 1.00 45.79 C ATOM 71 H ILE A1084 11.934 -9.459 29.494 1.00 0.00 H ATOM 72 N PHE A1085 10.809 -11.790 26.229 1.00 21.63 N ATOM 73 CA PHE A1085 9.809 -12.826 26.029 1.00 18.64 C ATOM 74 C PHE A1085 10.418 -14.015 25.300 1.00 24.24 C ATOM 75 O PHE A1085 11.170 -13.850 24.335 1.00 33.39 O ATOM 76 CB PHE A1085 8.631 -12.295 25.211 1.00 21.89 C ATOM 77 CG PHE A1085 7.974 -11.088 25.812 1.00 22.03 C ATOM 78 CD1 PHE A1085 7.021 -11.230 26.809 1.00 25.79 C ATOM 79 CD2 PHE A1085 8.310 -9.811 25.388 1.00 22.71 C ATOM 80 CE1 PHE A1085 6.409 -10.121 27.371 1.00 29.25 C ATOM 81 CE2 PHE A1085 7.702 -8.696 25.945 1.00 25.17 C ATOM 82 CZ PHE A1085 6.749 -8.855 26.938 1.00 28.04 C ATOM 83 H PHE A1085 11.261 -11.360 25.397 1.00 0.00 H ATOM 84 N LYS A1086 10.082 -15.209 25.763 1.00 18.26 N ATOM 85 CA LYS A1086 10.462 -16.435 25.079 1.00 17.59 C ATOM 86 C LYS A1086 9.349 -16.839 24.122 1.00 15.19 C ATOM 87 O LYS A1086 8.171 -16.632 24.426 1.00 16.10 O ATOM 88 CB LYS A1086 10.655 -17.558 26.085 1.00 17.25 C ATOM 89 CG LYS A1086 11.681 -17.249 27.155 1.00 20.08 C ATOM 90 CD LYS A1086 11.704 -18.362 28.181 1.00 19.56 C ATOM 91 CE LYS A1086 12.695 -18.092 29.296 1.00 26.92 C ATOM 92 NZ LYS A1086 12.653 -19.177 30.315 1.00 34.45 N ATOM 93 HZ1 LYS A1086 11.697 -19.233 30.721 1.00 0.00 H ATOM 94 HZ2 LYS A1086 12.893 -20.083 29.865 1.00 0.00 H ATOM 95 HZ3 LYS A1086 13.340 -18.970 31.068 1.00 0.00 H ATOM 96 H LYS A1086 9.530 -15.272 26.642 1.00 0.00 H ATOM 97 N PRO A1087 9.690 -17.412 22.966 1.00 14.56 N ATOM 98 CA PRO A1087 8.639 -17.742 21.988 1.00 15.56 C ATOM 99 C PRO A1087 7.563 -18.652 22.548 1.00 12.61 C ATOM 100 O PRO A1087 6.378 -18.454 22.262 1.00 12.42 O ATOM 101 CB PRO A1087 9.422 -18.410 20.848 1.00 19.06 C ATOM 102 CG PRO A1087 10.797 -17.835 20.958 1.00 24.53 C ATOM 103 CD PRO A1087 11.044 -17.659 22.434 1.00 17.42 C ATOM 104 N GLU A1088 7.941 -19.649 23.343 1.00 12.73 N ATOM 105 CA GLU A1088 6.947 -20.565 23.885 1.00 12.48 C ATOM 106 C GLU A1088 6.035 -19.864 24.883 1.00 12.60 C ATOM 107 O GLU A1088 4.870 -20.251 25.044 1.00 13.11 O ATOM 108 CB GLU A1088 7.643 -21.791 24.488 1.00 13.70 C ATOM 109 CG GLU A1088 8.576 -21.507 25.675 1.00 13.68 C ATOM 110 CD GLU A1088 10.005 -21.094 25.296 1.00 13.74 C ATOM 111 OE1 GLU A1088 10.267 -20.724 24.132 1.00 15.16 O ATOM 112 OE2 GLU A1088 10.872 -21.126 26.195 1.00 17.78 O ATOM 113 H GLU A1088 8.946 -19.774 23.578 1.00 0.00 H ATOM 114 N GLU A1089 6.540 -18.823 25.551 1.00 13.17 N ATOM 115 CA GLU A1089 5.685 -18.017 26.415 1.00 14.62 C ATOM 116 C GLU A1089 4.718 -17.181 25.594 1.00 14.78 C ATOM 117 O GLU A1089 3.555 -17.005 25.978 1.00 15.26 O ATOM 118 CB GLU A1089 6.549 -17.100 27.278 1.00 15.44 C ATOM 119 CG GLU A1089 7.454 -17.828 28.252 1.00 22.05 C ATOM 120 CD GLU A1089 8.371 -16.879 29.008 1.00 27.88 C ATOM 121 OE1 GLU A1089 8.679 -15.790 28.472 1.00 30.00 O ATOM 122 OE2 GLU A1089 8.781 -17.223 30.137 1.00 34.04 O ATOM 123 H GLU A1089 7.548 -18.586 25.454 1.00 0.00 H ATOM 124 N LEU A1090 5.187 -16.642 24.471 1.00 12.64 N ATOM 125 CA LEU A1090 4.296 -15.890 23.599 1.00 13.58 C ATOM 126 C LEU A1090 3.221 -16.789 23.006 1.00 11.62 C ATOM 127 O LEU A1090 2.065 -16.376 22.868 1.00 12.86 O ATOM 128 CB LEU A1090 5.092 -15.175 22.509 1.00 13.12 C ATOM 129 CG LEU A1090 6.017 -14.058 22.998 1.00 15.03 C ATOM 130 CD1 LEU A1090 6.641 -13.338 21.816 1.00 19.10 C ATOM 131 CD2 LEU A1090 5.251 -13.082 23.883 1.00 18.16 C ATOM 132 H LEU A1090 6.189 -16.758 24.217 1.00 0.00 H ATOM 133 N ARG A1091 3.571 -18.031 22.667 1.00 12.09 N ATOM 134 CA ARG A1091 2.555 -18.940 22.146 1.00 10.65 C ATOM 135 C ARG A1091 1.465 -19.168 23.183 1.00 11.09 C ATOM 136 O ARG A1091 0.271 -19.067 22.882 1.00 11.14 O ATOM 137 CB ARG A1091 3.185 -20.262 21.710 1.00 11.40 C ATOM 138 CG ARG A1091 2.197 -21.186 21.010 1.00 11.12 C ATOM 139 CD ARG A1091 2.783 -22.566 20.723 1.00 11.47 C ATOM 140 NE ARG A1091 1.953 -23.345 19.793 1.00 11.23 N ATOM 141 CZ ARG A1091 1.087 -24.298 20.136 1.00 12.11 C ATOM 142 NH1 ARG A1091 0.914 -24.627 21.408 1.00 14.22 N ATOM 143 NH2 ARG A1091 0.386 -24.926 19.194 1.00 14.46 N ATOM 144 HE ARG A1091 2.050 -23.134 18.779 1.00 0.00 H ATOM 145 HH12 ARG A1091 0.236 -25.372 21.665 1.00 0.00 H ATOM 146 HH11 ARG A1091 1.457 -24.140 22.150 1.00 0.00 H ATOM 147 HH22 ARG A1091 -0.291 -25.670 19.459 1.00 0.00 H ATOM 148 HH21 ARG A1091 0.515 -24.672 18.194 1.00 0.00 H ATOM 149 H ARG A1091 4.556 -18.348 22.773 1.00 0.00 H ATOM 150 N GLN A1092 1.856 -19.444 24.428 1.00 12.68 N ATOM 151 CA GLN A1092 0.850 -19.719 25.452 1.00 13.19 C ATOM 152 C GLN A1092 -0.046 -18.510 25.706 1.00 12.55 C ATOM 153 O GLN A1092 -1.261 -18.659 25.878 1.00 14.45 O ATOM 154 CB GLN A1092 1.496 -20.216 26.748 1.00 20.70 C ATOM 155 CG GLN A1092 0.483 -20.358 27.892 1.00 21.59 C ATOM 156 CD GLN A1092 0.807 -21.462 28.890 1.00 30.69 C ATOM 157 OE1 GLN A1092 0.111 -22.482 28.955 1.00 31.46 O ATOM 158 NE2 GLN A1092 1.842 -21.248 29.696 1.00 21.55 N ATOM 159 HE22 GLN A1092 2.400 -20.375 29.605 1.00 0.00 H ATOM 160 HE21 GLN A1092 2.094 -21.954 30.417 1.00 0.00 H ATOM 161 H GLN A1092 2.868 -19.463 24.668 1.00 0.00 H ATOM 162 N ALA A1093 0.536 -17.308 25.728 1.00 13.01 N ATOM 163 CA ALA A1093 -0.234 -16.100 26.017 1.00 13.39 C ATOM 164 C ALA A1093 -1.096 -15.671 24.841 1.00 12.99 C ATOM 165 O ALA A1093 -2.242 -15.244 25.031 1.00 14.65 O ATOM 166 CB ALA A1093 0.708 -14.954 26.372 1.00 14.79 C ATOM 167 H ALA A1093 1.555 -17.230 25.536 1.00 0.00 H ATOM 168 N LEU A1094 -0.559 -15.734 23.625 1.00 10.94 N ATOM 169 CA LEU A1094 -1.202 -15.111 22.476 1.00 11.16 C ATOM 170 C LEU A1094 -2.073 -16.065 21.677 1.00 10.40 C ATOM 171 O LEU A1094 -3.038 -15.619 21.047 1.00 11.06 O ATOM 172 CB LEU A1094 -0.143 -14.497 21.555 1.00 10.80 C ATOM 173 CG LEU A1094 0.704 -13.398 22.192 1.00 12.05 C ATOM 174 CD1 LEU A1094 1.845 -13.012 21.273 1.00 14.31 C ATOM 175 CD2 LEU A1094 -0.160 -12.183 22.544 1.00 14.72 C ATOM 176 H LEU A1094 0.340 -16.239 23.492 1.00 0.00 H ATOM 177 N MET A1095 -1.757 -17.357 21.649 1.00 11.29 N ATOM 178 CA MET A1095 -2.572 -18.279 20.859 1.00 11.04 C ATOM 179 C MET A1095 -4.057 -18.228 21.202 1.00 10.41 C ATOM 180 O MET A1095 -4.877 -18.286 20.269 1.00 10.57 O ATOM 181 CB MET A1095 -2.019 -19.710 20.912 1.00 12.42 C ATOM 182 CG MET A1095 -2.725 -20.645 19.940 1.00 14.39 C ATOM 183 SD MET A1095 -2.287 -20.340 18.219 1.00 12.07 S ATOM 184 CE MET A1095 -0.654 -21.063 18.184 1.00 13.31 C ATOM 185 H MET A1095 -0.937 -17.708 22.184 1.00 0.00 H ATOM 186 N PRO A1096 -4.476 -18.083 22.461 1.00 11.39 N ATOM 187 CA PRO A1096 -5.916 -17.972 22.726 1.00 11.55 C ATOM 188 C PRO A1096 -6.576 -16.792 22.035 1.00 11.45 C ATOM 189 O PRO A1096 -7.762 -16.880 21.701 1.00 11.96 O ATOM 190 CB PRO A1096 -5.980 -17.849 24.252 1.00 15.32 C ATOM 191 CG PRO A1096 -4.760 -18.553 24.723 1.00 14.06 C ATOM 192 CD PRO A1096 -3.708 -18.181 23.716 1.00 12.56 C ATOM 193 N THR A1097 -5.856 -15.686 21.823 1.00 10.65 N ATOM 194 CA THR A1097 -6.466 -14.563 21.118 1.00 11.48 C ATOM 195 C THR A1097 -6.645 -14.872 19.638 1.00 10.13 C ATOM 196 O THR A1097 -7.580 -14.369 19.007 1.00 12.05 O ATOM 197 CB THR A1097 -5.664 -13.271 21.318 1.00 10.99 C ATOM 198 OG1 THR A1097 -4.420 -13.328 20.600 1.00 10.17 O ATOM 199 CG2 THR A1097 -5.401 -13.021 22.802 1.00 12.75 C ATOM 200 HG1 THR A1097 -3.884 -14.092 20.931 1.00 0.00 H ATOM 201 H THR A1097 -4.873 -15.626 22.156 1.00 0.00 H ATOM 202 N LEU A1098 -5.750 -15.677 19.066 1.00 9.50 N ATOM 203 CA LEU A1098 -5.907 -16.100 17.681 1.00 9.26 C ATOM 204 C LEU A1098 -7.014 -17.134 17.563 1.00 9.16 C ATOM 205 O LEU A1098 -7.824 -17.092 16.626 1.00 9.28 O ATOM 206 CB LEU A1098 -4.590 -16.679 17.174 1.00 9.84 C ATOM 207 CG LEU A1098 -4.455 -16.799 15.655 1.00 11.33 C ATOM 208 CD1 LEU A1098 -4.439 -15.417 15.010 1.00 11.90 C ATOM 209 CD2 LEU A1098 -3.208 -17.587 15.279 1.00 12.76 C ATOM 210 H LEU A1098 -4.930 -16.007 19.615 1.00 0.00 H ATOM 211 N GLU A1099 -7.053 -18.071 18.510 1.00 9.84 N ATOM 212 CA GLU A1099 -8.128 -19.047 18.564 1.00 10.46 C ATOM 213 C GLU A1099 -9.488 -18.366 18.577 1.00 10.67 C ATOM 214 O GLU A1099 -10.425 -18.827 17.918 1.00 10.56 O ATOM 215 CB GLU A1099 -7.961 -19.887 19.828 1.00 11.53 C ATOM 216 CG GLU A1099 -9.092 -20.872 20.040 1.00 11.99 C ATOM 217 CD GLU A1099 -9.105 -21.482 21.426 1.00 12.29 C ATOM 218 OE1 GLU A1099 -8.091 -21.388 22.154 1.00 14.06 O ATOM 219 OE2 GLU A1099 -10.146 -22.055 21.796 1.00 15.35 O ATOM 220 H GLU A1099 -6.298 -18.104 19.225 1.00 0.00 H ATOM 221 N ALA A1100 -9.616 -17.271 19.335 1.00 10.48 N ATOM 222 CA ALA A1100 -10.885 -16.551 19.397 1.00 11.71 C ATOM 223 C ALA A1100 -11.333 -16.075 18.022 1.00 11.15 C ATOM 224 O ALA A1100 -12.535 -16.023 17.744 1.00 12.45 O ATOM 225 CB ALA A1100 -10.766 -15.362 20.348 1.00 12.85 C ATOM 226 H ALA A1100 -8.803 -16.929 19.886 1.00 0.00 H ATOM 227 N LEU A1101 -10.387 -15.726 17.145 1.00 9.75 N ATOM 228 CA LEU A1101 -10.755 -15.336 15.790 1.00 8.82 C ATOM 229 C LEU A1101 -11.212 -16.542 14.987 1.00 8.74 C ATOM 230 O LEU A1101 -12.263 -16.507 14.336 1.00 9.30 O ATOM 231 CB LEU A1101 -9.576 -14.641 15.107 1.00 9.77 C ATOM 232 CG LEU A1101 -9.032 -13.442 15.884 1.00 8.91 C ATOM 233 CD1 LEU A1101 -7.913 -12.765 15.118 1.00 10.95 C ATOM 234 CD2 LEU A1101 -10.145 -12.452 16.211 1.00 13.18 C ATOM 235 H LEU A1101 -9.387 -15.733 17.430 1.00 0.00 H ATOM 236 N TYR A1102 -10.436 -17.626 15.032 1.00 8.74 N ATOM 237 CA TYR A1102 -10.806 -18.839 14.310 1.00 10.45 C ATOM 238 C TYR A1102 -12.169 -19.368 14.736 1.00 11.43 C ATOM 239 O TYR A1102 -12.880 -19.974 13.925 1.00 11.93 O ATOM 240 CB TYR A1102 -9.780 -19.921 14.585 1.00 10.25 C ATOM 241 CG TYR A1102 -8.569 -19.950 13.697 1.00 8.65 C ATOM 242 CD1 TYR A1102 -8.607 -20.605 12.476 1.00 9.44 C ATOM 243 CD2 TYR A1102 -7.364 -19.396 14.112 1.00 10.51 C ATOM 244 CE1 TYR A1102 -7.482 -20.679 11.670 1.00 9.31 C ATOM 245 CE2 TYR A1102 -6.231 -19.469 13.314 1.00 10.79 C ATOM 246 CZ TYR A1102 -6.298 -20.122 12.103 1.00 9.58 C ATOM 247 OH TYR A1102 -5.164 -20.210 11.330 1.00 11.31 O ATOM 248 HH TYR A1102 -5.371 -20.704 10.497 1.00 0.00 H ATOM 249 H TYR A1102 -9.557 -17.606 15.588 1.00 0.00 H ATOM 250 N ARG A1103 -12.542 -19.183 16.001 1.00 10.24 N ATOM 251 CA ARG A1103 -13.818 -19.716 16.456 1.00 10.71 C ATOM 252 C ARG A1103 -15.010 -18.945 15.915 1.00 13.67 C ATOM 253 O ARG A1103 -16.141 -19.438 16.019 1.00 16.10 O ATOM 254 CB ARG A1103 -13.828 -19.814 17.980 1.00 13.61 C ATOM 255 CG ARG A1103 -12.829 -20.872 18.464 1.00 19.27 C ATOM 256 CD ARG A1103 -13.209 -21.632 19.730 1.00 24.80 C ATOM 257 NE ARG A1103 -12.162 -22.614 20.021 1.00 23.69 N ATOM 258 CZ ARG A1103 -12.206 -23.898 19.674 1.00 28.32 C ATOM 259 NH1 ARG A1103 -13.269 -24.389 19.045 1.00 26.22 N ATOM 260 NH2 ARG A1103 -11.186 -24.697 19.969 1.00 23.70 N ATOM 261 HE ARG A1103 -11.322 -22.283 20.537 1.00 0.00 H ATOM 262 HH12 ARG A1103 -13.297 -25.393 18.777 1.00 0.00 H ATOM 263 HH11 ARG A1103 -14.073 -23.769 18.821 1.00 0.00 H ATOM 264 HH22 ARG A1103 -11.217 -25.701 19.699 1.00 0.00 H ATOM 265 HH21 ARG A1103 -10.357 -24.318 20.470 1.00 0.00 H ATOM 266 H ARG A1103 -11.927 -18.662 16.658 1.00 0.00 H ATOM 267 N GLN A1104 -14.791 -17.767 15.337 1.00 11.07 N ATOM 268 CA GLN A1104 -15.859 -17.042 14.664 1.00 12.53 C ATOM 269 C GLN A1104 -16.109 -17.707 13.321 1.00 11.53 C ATOM 270 O GLN A1104 -15.256 -17.664 12.427 1.00 12.11 O ATOM 271 CB GLN A1104 -15.469 -15.584 14.457 1.00 12.25 C ATOM 272 CG GLN A1104 -15.138 -14.852 15.731 1.00 15.18 C ATOM 273 CD GLN A1104 -16.234 -14.963 16.761 1.00 26.06 C ATOM 274 OE1 GLN A1104 -17.393 -14.669 16.486 1.00 28.31 O ATOM 275 NE2 GLN A1104 -15.872 -15.400 17.959 1.00 37.90 N ATOM 276 HE22 GLN A1104 -14.877 -15.637 18.147 1.00 0.00 H ATOM 277 HE21 GLN A1104 -16.583 -15.505 18.711 1.00 0.00 H ATOM 278 H GLN A1104 -13.836 -17.355 15.367 1.00 0.00 H ATOM 279 N ASP A1105 -17.285 -18.307 13.175 1.00 13.03 N ATOM 280 CA ASP A1105 -17.684 -18.987 11.952 1.00 14.69 C ATOM 281 C ASP A1105 -19.074 -18.450 11.644 1.00 15.33 C ATOM 282 O ASP A1105 -19.991 -18.599 12.480 1.00 15.84 O ATOM 283 CB ASP A1105 -17.712 -20.495 12.204 1.00 18.31 C ATOM 284 CG ASP A1105 -17.876 -21.306 10.933 1.00 24.46 C ATOM 285 OD1 ASP A1105 -18.651 -20.896 10.049 1.00 23.16 O ATOM 286 OD2 ASP A1105 -17.225 -22.366 10.821 1.00 30.91 O ATOM 287 H ASP A1105 -17.952 -18.290 13.973 1.00 0.00 H ATOM 288 N PRO A1106 -19.302 -17.858 10.465 1.00 13.52 N ATOM 289 CA PRO A1106 -18.449 -17.884 9.273 1.00 11.97 C ATOM 290 C PRO A1106 -17.361 -16.812 9.192 1.00 9.87 C ATOM 291 O PRO A1106 -16.606 -16.810 8.215 1.00 10.10 O ATOM 292 CB PRO A1106 -19.462 -17.650 8.149 1.00 14.77 C ATOM 293 CG PRO A1106 -20.452 -16.737 8.766 1.00 14.35 C ATOM 294 CD PRO A1106 -20.603 -17.219 10.190 1.00 13.67 C ATOM 295 N GLU A1107 -17.281 -15.911 10.174 1.00 10.30 N ATOM 296 CA GLU A1107 -16.525 -14.678 9.961 1.00 9.96 C ATOM 297 C GLU A1107 -15.040 -14.916 9.701 1.00 8.54 C ATOM 298 O GLU A1107 -14.426 -14.153 8.951 1.00 8.90 O ATOM 299 CB GLU A1107 -16.735 -13.695 11.111 1.00 11.70 C ATOM 300 CG GLU A1107 -18.134 -13.088 11.173 1.00 12.78 C ATOM 301 CD GLU A1107 -19.122 -13.914 11.982 1.00 14.83 C ATOM 302 OE1 GLU A1107 -18.803 -15.058 12.376 1.00 13.74 O ATOM 303 OE2 GLU A1107 -20.238 -13.406 12.225 1.00 18.75 O ATOM 304 H GLU A1107 -17.753 -16.085 11.084 1.00 0.00 H ATOM 305 N SER A1108 -14.439 -15.952 10.291 1.00 8.87 N ATOM 306 CA SER A1108 -13.020 -16.198 10.051 1.00 8.13 C ATOM 307 C SER A1108 -12.729 -16.924 8.746 1.00 8.11 C ATOM 308 O SER A1108 -11.558 -16.981 8.347 1.00 8.04 O ATOM 309 CB SER A1108 -12.385 -16.995 11.191 1.00 9.38 C ATOM 310 OG SER A1108 -12.830 -18.345 11.190 1.00 10.01 O ATOM 311 HG SER A1108 -13.814 -18.367 11.300 1.00 0.00 H ATOM 312 H SER A1108 -14.979 -16.581 10.919 1.00 0.00 H ATOM 313 N LEU A1109 -13.732 -17.487 8.077 1.00 8.73 N ATOM 314 CA LEU A1109 -13.436 -18.328 6.919 1.00 8.69 C ATOM 315 C LEU A1109 -12.612 -17.633 5.841 1.00 8.18 C ATOM 316 O LEU A1109 -11.674 -18.263 5.320 1.00 8.72 O ATOM 317 CB LEU A1109 -14.724 -18.939 6.355 1.00 11.26 C ATOM 318 CG LEU A1109 -15.507 -19.817 7.333 1.00 11.20 C ATOM 319 CD1 LEU A1109 -16.783 -20.345 6.696 1.00 13.39 C ATOM 320 CD2 LEU A1109 -14.627 -20.951 7.849 1.00 15.24 C ATOM 321 H LEU A1109 -14.716 -17.330 8.375 1.00 0.00 H ATOM 322 N PRO A1110 -12.872 -16.374 5.473 1.00 7.97 N ATOM 323 CA PRO A1110 -12.044 -15.734 4.439 1.00 7.59 C ATOM 324 C PRO A1110 -10.606 -15.514 4.850 1.00 7.25 C ATOM 325 O PRO A1110 -9.786 -15.193 3.984 1.00 7.94 O ATOM 326 CB PRO A1110 -12.747 -14.387 4.203 1.00 8.40 C ATOM 327 CG PRO A1110 -14.156 -14.623 4.641 1.00 8.66 C ATOM 328 CD PRO A1110 -14.033 -15.538 5.834 1.00 8.04 C ATOM 329 N PHE A1111 -10.290 -15.648 6.137 1.00 7.32 N ATOM 330 CA PHE A1111 -9.007 -15.272 6.710 1.00 7.39 C ATOM 331 C PHE A1111 -8.156 -16.468 7.090 1.00 7.75 C ATOM 332 O PHE A1111 -7.024 -16.288 7.554 1.00 7.63 O ATOM 333 CB PHE A1111 -9.234 -14.381 7.936 1.00 7.18 C ATOM 334 CG PHE A1111 -10.016 -13.155 7.619 1.00 7.69 C ATOM 335 CD1 PHE A1111 -9.371 -12.017 7.197 1.00 10.40 C ATOM 336 CD2 PHE A1111 -11.397 -13.147 7.702 1.00 8.07 C ATOM 337 CE1 PHE A1111 -10.087 -10.879 6.870 1.00 12.41 C ATOM 338 CE2 PHE A1111 -12.122 -12.013 7.365 1.00 9.77 C ATOM 339 CZ PHE A1111 -11.463 -10.886 6.952 1.00 11.44 C ATOM 340 H PHE A1111 -11.008 -16.048 6.774 1.00 0.00 H ATOM 341 N ARG A1112 -8.655 -17.686 6.892 1.00 7.63 N ATOM 342 CA ARG A1112 -7.947 -18.856 7.389 1.00 8.93 C ATOM 343 C ARG A1112 -6.762 -19.269 6.525 1.00 9.42 C ATOM 344 O ARG A1112 -5.876 -19.977 7.019 1.00 13.96 O ATOM 345 CB ARG A1112 -8.914 -20.025 7.579 1.00 10.57 C ATOM 346 CG ARG A1112 -9.837 -19.826 8.769 1.00 10.15 C ATOM 347 CD ARG A1112 -10.749 -21.002 8.953 1.00 11.19 C ATOM 348 NE ARG A1112 -11.617 -20.831 10.113 1.00 11.00 N ATOM 349 CZ ARG A1112 -12.406 -21.790 10.581 1.00 11.88 C ATOM 350 NH1 ARG A1112 -12.425 -22.973 9.986 1.00 14.22 N ATOM 351 NH2 ARG A1112 -13.166 -21.567 11.642 1.00 13.49 N ATOM 352 HE ARG A1112 -11.618 -19.911 10.598 1.00 0.00 H ATOM 353 HH12 ARG A1112 -13.042 -23.728 10.349 1.00 0.00 H ATOM 354 HH11 ARG A1112 -11.823 -23.147 9.156 1.00 0.00 H ATOM 355 HH22 ARG A1112 -13.783 -22.320 12.007 1.00 0.00 H ATOM 356 HH21 ARG A1112 -13.145 -20.639 12.111 1.00 0.00 H ATOM 357 H ARG A1112 -9.553 -17.802 6.381 1.00 0.00 H ATOM 358 N GLN A1113 -6.698 -18.854 5.271 1.00 8.60 N ATOM 359 CA GLN A1113 -5.586 -19.187 4.394 1.00 8.58 C ATOM 360 C GLN A1113 -5.199 -17.938 3.627 1.00 8.49 C ATOM 361 O GLN A1113 -6.002 -17.007 3.511 1.00 8.25 O ATOM 362 CB GLN A1113 -5.994 -20.288 3.409 1.00 11.78 C ATOM 363 CG GLN A1113 -6.191 -21.654 4.055 1.00 18.51 C ATOM 364 CD GLN A1113 -4.902 -22.221 4.634 1.00 25.49 C ATOM 365 OE1 GLN A1113 -3.829 -22.082 4.045 1.00 29.25 O ATOM 366 NE2 GLN A1113 -5.003 -22.857 5.796 1.00 27.33 N ATOM 367 HE22 GLN A1113 -5.930 -22.951 6.258 1.00 0.00 H ATOM 368 HE21 GLN A1113 -4.155 -23.261 6.243 1.00 0.00 H ATOM 369 H GLN A1113 -7.472 -18.268 4.898 1.00 0.00 H ATOM 370 N PRO A1114 -3.984 -17.880 3.085 1.00 8.54 N ATOM 371 CA PRO A1114 -3.609 -16.704 2.294 1.00 8.94 C ATOM 372 C PRO A1114 -4.545 -16.523 1.110 1.00 8.76 C ATOM 373 O PRO A1114 -4.926 -17.484 0.440 1.00 9.69 O ATOM 374 CB PRO A1114 -2.190 -17.030 1.823 1.00 9.45 C ATOM 375 CG PRO A1114 -1.676 -18.022 2.801 1.00 10.96 C ATOM 376 CD PRO A1114 -2.874 -18.844 3.197 1.00 10.70 C ATOM 377 N VAL A1115 -4.909 -15.268 0.846 1.00 8.46 N ATOM 378 CA VAL A1115 -5.679 -14.963 -0.354 1.00 9.30 C ATOM 379 C VAL A1115 -4.924 -15.463 -1.574 1.00 8.85 C ATOM 380 O VAL A1115 -3.727 -15.191 -1.734 1.00 8.73 O ATOM 381 CB VAL A1115 -5.915 -13.447 -0.439 1.00 9.13 C ATOM 382 CG1 VAL A1115 -6.430 -13.044 -1.816 1.00 10.99 C ATOM 383 CG2 VAL A1115 -6.885 -13.023 0.636 1.00 10.79 C ATOM 384 H VAL A1115 -4.643 -14.503 1.499 1.00 0.00 H ATOM 385 N ASP A1116 -5.617 -16.196 -2.445 1.00 9.82 N ATOM 386 CA ASP A1116 -5.046 -16.611 -3.723 1.00 9.41 C ATOM 387 C ASP A1116 -5.765 -15.829 -4.811 1.00 8.86 C ATOM 388 O ASP A1116 -6.910 -16.164 -5.164 1.00 10.15 O ATOM 389 CB ASP A1116 -5.229 -18.116 -3.936 1.00 11.09 C ATOM 390 CG ASP A1116 -4.495 -18.623 -5.164 1.00 12.70 C ATOM 391 OD1 ASP A1116 -4.524 -17.933 -6.201 1.00 13.34 O ATOM 392 OD2 ASP A1116 -3.873 -19.705 -5.089 1.00 15.24 O ATOM 393 H ASP A1116 -6.589 -16.480 -2.208 1.00 0.00 H ATOM 394 N PRO A1117 -5.149 -14.791 -5.376 1.00 8.90 N ATOM 395 CA PRO A1117 -5.888 -13.931 -6.315 1.00 10.70 C ATOM 396 C PRO A1117 -6.321 -14.642 -7.573 1.00 12.27 C ATOM 397 O PRO A1117 -7.335 -14.260 -8.170 1.00 13.27 O ATOM 398 CB PRO A1117 -4.892 -12.804 -6.620 1.00 10.42 C ATOM 399 CG PRO A1117 -4.009 -12.758 -5.400 1.00 11.40 C ATOM 400 CD PRO A1117 -3.852 -14.202 -4.998 1.00 11.74 C ATOM 401 N GLN A1118 -5.572 -15.647 -8.013 1.00 11.32 N ATOM 402 CA GLN A1118 -5.979 -16.407 -9.185 1.00 12.71 C ATOM 403 C GLN A1118 -7.233 -17.219 -8.900 1.00 13.14 C ATOM 404 O GLN A1118 -8.193 -17.186 -9.676 1.00 16.12 O ATOM 405 CB GLN A1118 -4.831 -17.305 -9.642 1.00 15.55 C ATOM 406 CG GLN A1118 -5.114 -18.051 -10.940 1.00 34.95 C ATOM 407 CD GLN A1118 -5.403 -17.121 -12.108 1.00 54.07 C ATOM 408 OE1 GLN A1118 -4.888 -16.003 -12.172 1.00 60.06 O ATOM 409 NE2 GLN A1118 -6.232 -17.582 -13.040 1.00 58.63 N ATOM 410 HE22 GLN A1118 -6.644 -18.532 -12.946 1.00 0.00 H ATOM 411 HE21 GLN A1118 -6.468 -16.992 -13.863 1.00 0.00 H ATOM 412 H GLN A1118 -4.691 -15.892 -7.518 1.00 0.00 H ATOM 413 N LEU A1119 -7.250 -17.953 -7.787 1.00 13.29 N ATOM 414 CA LEU A1119 -8.420 -18.755 -7.444 1.00 12.41 C ATOM 415 C LEU A1119 -9.643 -17.900 -7.145 1.00 14.84 C ATOM 416 O LEU A1119 -10.771 -18.331 -7.409 1.00 15.85 O ATOM 417 CB LEU A1119 -8.122 -19.666 -6.258 1.00 13.70 C ATOM 418 CG LEU A1119 -7.053 -20.723 -6.512 1.00 17.70 C ATOM 419 CD1 LEU A1119 -6.852 -21.571 -5.269 1.00 17.89 C ATOM 420 CD2 LEU A1119 -7.418 -21.586 -7.713 1.00 21.05 C ATOM 421 H LEU A1119 -6.422 -17.954 -7.158 1.00 0.00 H ATOM 422 N LEU A1120 -9.456 -16.708 -6.597 1.00 11.99 N ATOM 423 CA LEU A1120 -10.579 -15.834 -6.289 1.00 12.99 C ATOM 424 C LEU A1120 -10.934 -14.903 -7.441 1.00 13.11 C ATOM 425 O LEU A1120 -11.918 -14.159 -7.343 1.00 16.54 O ATOM 426 CB LEU A1120 -10.299 -15.035 -5.008 1.00 12.32 C ATOM 427 CG LEU A1120 -10.154 -15.876 -3.737 1.00 12.49 C ATOM 428 CD1 LEU A1120 -9.696 -15.011 -2.581 1.00 15.19 C ATOM 429 CD2 LEU A1120 -11.455 -16.605 -3.393 1.00 15.33 C ATOM 430 H LEU A1120 -8.489 -16.391 -6.383 1.00 0.00 H ATOM 431 N GLY A1121 -10.164 -14.919 -8.521 1.00 12.83 N ATOM 432 CA GLY A1121 -10.475 -14.067 -9.655 1.00 13.87 C ATOM 433 C GLY A1121 -10.351 -12.587 -9.367 1.00 15.34 C ATOM 434 O GLY A1121 -11.156 -11.788 -9.868 1.00 17.29 O ATOM 435 H GLY A1121 -9.334 -15.545 -8.556 1.00 0.00 H ATOM 436 N ILE A1122 -9.367 -12.203 -8.560 1.00 13.39 N ATOM 437 CA ILE A1122 -9.152 -10.806 -8.186 1.00 14.41 C ATOM 438 C ILE A1122 -7.727 -10.394 -8.549 1.00 13.73 C ATOM 439 O ILE A1122 -6.873 -10.231 -7.661 1.00 12.50 O ATOM 440 CB ILE A1122 -9.513 -10.562 -6.710 1.00 13.75 C ATOM 441 CG1 ILE A1122 -8.843 -11.584 -5.779 1.00 13.55 C ATOM 442 CG2 ILE A1122 -11.024 -10.624 -6.522 1.00 17.18 C ATOM 443 CD1 ILE A1122 -9.158 -11.338 -4.309 1.00 12.97 C ATOM 444 H ILE A1122 -8.724 -12.926 -8.179 1.00 0.00 H ATOM 445 N PRO A1123 -7.428 -10.192 -9.835 1.00 14.17 N ATOM 446 CA PRO A1123 -6.024 -10.024 -10.245 1.00 15.80 C ATOM 447 C PRO A1123 -5.357 -8.771 -9.711 1.00 13.89 C ATOM 448 O PRO A1123 -4.123 -8.703 -9.724 1.00 15.52 O ATOM 449 CB PRO A1123 -6.093 -10.022 -11.782 1.00 16.01 C ATOM 450 CG PRO A1123 -7.510 -9.643 -12.100 1.00 19.88 C ATOM 451 CD PRO A1123 -8.343 -10.224 -10.992 1.00 17.55 C ATOM 452 N ASP A1124 -6.113 -7.785 -9.239 1.00 12.56 N ATOM 453 CA ASP A1124 -5.504 -6.580 -8.686 1.00 12.55 C ATOM 454 C ASP A1124 -5.111 -6.722 -7.218 1.00 10.98 C ATOM 455 O ASP A1124 -4.541 -5.777 -6.657 1.00 10.88 O ATOM 456 CB ASP A1124 -6.427 -5.373 -8.873 1.00 16.04 C ATOM 457 CG ASP A1124 -7.755 -5.539 -8.174 1.00 21.41 C ATOM 458 OD1 ASP A1124 -8.058 -6.661 -7.716 1.00 22.39 O ATOM 459 OD2 ASP A1124 -8.501 -4.539 -8.082 1.00 29.99 O ATOM 460 H ASP A1124 -7.149 -7.873 -9.264 1.00 0.00 H ATOM 461 N TYR A1125 -5.382 -7.873 -6.598 1.00 9.64 N ATOM 462 CA TYR A1125 -5.217 -7.996 -5.153 1.00 8.83 C ATOM 463 C TYR A1125 -3.799 -7.652 -4.706 1.00 9.37 C ATOM 464 O TYR A1125 -3.614 -6.848 -3.788 1.00 8.64 O ATOM 465 CB TYR A1125 -5.614 -9.393 -4.688 1.00 9.44 C ATOM 466 CG TYR A1125 -5.554 -9.502 -3.187 1.00 7.64 C ATOM 467 CD1 TYR A1125 -6.596 -9.035 -2.396 1.00 8.44 C ATOM 468 CD2 TYR A1125 -4.437 -10.026 -2.550 1.00 8.82 C ATOM 469 CE1 TYR A1125 -6.533 -9.108 -1.014 1.00 9.85 C ATOM 470 CE2 TYR A1125 -4.355 -10.094 -1.169 1.00 8.69 C ATOM 471 CZ TYR A1125 -5.412 -9.634 -0.405 1.00 8.71 C ATOM 472 OH TYR A1125 -5.348 -9.691 0.975 1.00 9.90 O ATOM 473 HH TYR A1125 -6.183 -9.323 1.358 1.00 0.00 H ATOM 474 H TYR A1125 -5.714 -8.690 -7.150 1.00 0.00 H ATOM 475 N PHE A1126 -2.786 -8.239 -5.349 1.00 8.51 N ATOM 476 CA PHE A1126 -1.409 -8.011 -4.921 1.00 8.73 C ATOM 477 C PHE A1126 -0.882 -6.633 -5.311 1.00 9.44 C ATOM 478 O PHE A1126 0.166 -6.212 -4.799 1.00 10.68 O ATOM 479 CB PHE A1126 -0.470 -9.080 -5.488 1.00 8.92 C ATOM 480 CG PHE A1126 -0.619 -10.463 -4.879 1.00 8.46 C ATOM 481 CD1 PHE A1126 -0.992 -10.662 -3.554 1.00 9.52 C ATOM 482 CD2 PHE A1126 -0.325 -11.572 -5.654 1.00 10.16 C ATOM 483 CE1 PHE A1126 -1.099 -11.955 -3.030 1.00 9.54 C ATOM 484 CE2 PHE A1126 -0.420 -12.851 -5.136 1.00 10.01 C ATOM 485 CZ PHE A1126 -0.798 -13.041 -3.829 1.00 9.67 C ATOM 486 H PHE A1126 -2.979 -8.862 -6.159 1.00 0.00 H ATOM 487 N ASP A1127 -1.561 -5.921 -6.205 1.00 9.66 N ATOM 488 CA ASP A1127 -1.192 -4.525 -6.405 1.00 10.26 C ATOM 489 C ASP A1127 -1.640 -3.692 -5.217 1.00 11.39 C ATOM 490 O ASP A1127 -0.874 -2.870 -4.694 1.00 13.96 O ATOM 491 CB ASP A1127 -1.817 -3.998 -7.692 1.00 13.67 C ATOM 492 CG ASP A1127 -1.257 -2.651 -8.111 1.00 26.21 C ATOM 493 OD1 ASP A1127 -0.071 -2.364 -7.833 1.00 27.12 O ATOM 494 OD2 ASP A1127 -2.019 -1.869 -8.712 1.00 34.47 O ATOM 495 H ASP A1127 -2.337 -6.350 -6.749 1.00 0.00 H ATOM 496 N ILE A1128 -2.864 -3.932 -4.755 1.00 9.33 N ATOM 497 CA ILE A1128 -3.447 -3.163 -3.659 1.00 9.83 C ATOM 498 C ILE A1128 -2.849 -3.569 -2.320 1.00 9.83 C ATOM 499 O ILE A1128 -2.593 -2.717 -1.459 1.00 9.94 O ATOM 500 CB ILE A1128 -4.977 -3.340 -3.669 1.00 10.50 C ATOM 501 CG1 ILE A1128 -5.567 -2.827 -4.982 1.00 13.99 C ATOM 502 CG2 ILE A1128 -5.626 -2.636 -2.476 1.00 11.26 C ATOM 503 CD1 ILE A1128 -5.390 -1.349 -5.178 1.00 15.21 C ATOM 504 H ILE A1128 -3.425 -4.693 -5.189 1.00 0.00 H ATOM 505 N VAL A1129 -2.638 -4.863 -2.118 1.00 8.11 N ATOM 506 CA VAL A1129 -2.184 -5.417 -0.846 1.00 8.76 C ATOM 507 C VAL A1129 -0.723 -5.821 -1.013 1.00 8.15 C ATOM 508 O VAL A1129 -0.407 -6.883 -1.565 1.00 9.24 O ATOM 509 CB VAL A1129 -3.057 -6.594 -0.399 1.00 7.75 C ATOM 510 CG1 VAL A1129 -2.520 -7.208 0.879 1.00 8.66 C ATOM 511 CG2 VAL A1129 -4.485 -6.133 -0.207 1.00 9.63 C ATOM 512 H VAL A1129 -2.805 -5.518 -2.908 1.00 0.00 H ATOM 513 N LYS A1130 0.182 -4.978 -0.507 1.00 8.73 N ATOM 514 CA LYS A1130 1.611 -5.213 -0.671 1.00 10.24 C ATOM 515 C LYS A1130 2.161 -6.215 0.327 1.00 8.09 C ATOM 516 O LYS A1130 3.187 -6.837 0.053 1.00 10.01 O ATOM 517 CB LYS A1130 2.395 -3.908 -0.500 1.00 11.23 C ATOM 518 CG LYS A1130 2.247 -2.912 -1.631 1.00 12.42 C ATOM 519 CD LYS A1130 3.096 -1.670 -1.368 1.00 14.20 C ATOM 520 CE LYS A1130 3.042 -0.680 -2.524 1.00 15.62 C ATOM 521 NZ LYS A1130 3.679 -1.239 -3.753 1.00 14.13 N ATOM 522 HZ1 LYS A1130 4.676 -1.461 -3.555 1.00 0.00 H ATOM 523 HZ2 LYS A1130 3.179 -2.106 -4.037 1.00 0.00 H ATOM 524 HZ3 LYS A1130 3.624 -0.538 -4.520 1.00 0.00 H ATOM 525 H LYS A1130 -0.140 -4.138 0.014 1.00 0.00 H ATOM 526 N ASN A1131 1.525 -6.349 1.490 1.00 8.62 N ATOM 527 CA ASN A1131 1.978 -7.243 2.554 1.00 8.79 C ATOM 528 C ASN A1131 0.791 -8.089 2.986 1.00 8.47 C ATOM 529 O ASN A1131 0.125 -7.774 3.982 1.00 7.70 O ATOM 530 CB ASN A1131 2.495 -6.455 3.760 1.00 11.15 C ATOM 531 CG ASN A1131 3.528 -5.407 3.390 1.00 15.04 C ATOM 532 OD1 ASN A1131 3.263 -4.503 2.601 1.00 18.86 O ATOM 533 ND2 ASN A1131 4.703 -5.502 3.998 1.00 22.26 N ATOM 534 HD22 ASN A1131 4.885 -6.284 4.659 1.00 0.00 H ATOM 535 HD21 ASN A1131 5.443 -4.794 3.814 1.00 0.00 H ATOM 536 H ASN A1131 0.663 -5.789 1.649 1.00 0.00 H ATOM 537 N PRO A1132 0.486 -9.164 2.259 1.00 7.70 N ATOM 538 CA PRO A1132 -0.642 -10.015 2.660 1.00 7.42 C ATOM 539 C PRO A1132 -0.386 -10.684 4.000 1.00 7.94 C ATOM 540 O PRO A1132 0.749 -10.956 4.383 1.00 8.89 O ATOM 541 CB PRO A1132 -0.726 -11.056 1.537 1.00 8.96 C ATOM 542 CG PRO A1132 -0.045 -10.418 0.358 1.00 10.43 C ATOM 543 CD PRO A1132 1.034 -9.547 0.941 1.00 9.02 C ATOM 544 N MET A1133 -1.469 -10.964 4.711 1.00 7.06 N ATOM 545 CA MET A1133 -1.366 -11.663 5.982 1.00 6.97 C ATOM 546 C MET A1133 -2.675 -12.382 6.240 1.00 7.55 C ATOM 547 O MET A1133 -3.741 -11.919 5.830 1.00 8.66 O ATOM 548 CB MET A1133 -1.083 -10.671 7.113 1.00 7.44 C ATOM 549 CG MET A1133 -0.810 -11.313 8.479 1.00 9.25 C ATOM 550 SD MET A1133 0.489 -12.567 8.470 1.00 9.65 S ATOM 551 CE MET A1133 1.849 -11.680 7.717 1.00 11.41 C ATOM 552 H MET A1133 -2.404 -10.680 4.355 1.00 0.00 H ATOM 553 N ASP A1134 -2.596 -13.512 6.927 1.00 7.50 N ATOM 554 CA ASP A1134 -3.782 -14.312 7.194 1.00 7.68 C ATOM 555 C ASP A1134 -3.538 -15.119 8.458 1.00 7.63 C ATOM 556 O ASP A1134 -2.414 -15.212 8.959 1.00 7.95 O ATOM 557 CB ASP A1134 -4.095 -15.247 6.033 1.00 9.02 C ATOM 558 CG ASP A1134 -3.122 -16.362 5.957 1.00 10.09 C ATOM 559 OD1 ASP A1134 -1.945 -16.104 5.649 1.00 11.63 O ATOM 560 OD2 ASP A1134 -3.525 -17.501 6.263 1.00 12.20 O ATOM 561 H ASP A1134 -1.672 -13.832 7.281 1.00 0.00 H ATOM 562 N LEU A1135 -4.607 -15.771 8.928 1.00 7.46 N ATOM 563 CA LEU A1135 -4.549 -16.483 10.203 1.00 7.51 C ATOM 564 C LEU A1135 -3.551 -17.628 10.168 1.00 7.70 C ATOM 565 O LEU A1135 -2.853 -17.871 11.160 1.00 9.10 O ATOM 566 CB LEU A1135 -5.930 -17.022 10.590 1.00 8.40 C ATOM 567 CG LEU A1135 -6.991 -15.969 10.893 1.00 7.33 C ATOM 568 CD1 LEU A1135 -8.347 -16.612 10.972 1.00 9.44 C ATOM 569 CD2 LEU A1135 -6.672 -15.238 12.180 1.00 9.07 C ATOM 570 H LEU A1135 -5.491 -15.771 8.379 1.00 0.00 H ATOM 571 N SER A1136 -3.493 -18.374 9.058 1.00 7.77 N ATOM 572 CA SER A1136 -2.602 -19.535 9.013 1.00 9.31 C ATOM 573 C SER A1136 -1.144 -19.120 9.149 1.00 8.66 C ATOM 574 O SER A1136 -0.339 -19.828 9.767 1.00 9.08 O ATOM 575 CB SER A1136 -2.805 -20.328 7.714 1.00 11.12 C ATOM 576 OG SER A1136 -2.297 -19.645 6.577 1.00 12.36 O ATOM 577 HG SER A1136 -2.761 -18.776 6.481 1.00 0.00 H ATOM 578 H SER A1136 -4.077 -18.130 8.233 1.00 0.00 H ATOM 579 N THR A1137 -0.784 -17.987 8.560 1.00 7.43 N ATOM 580 CA THR A1137 0.586 -17.496 8.653 1.00 8.35 C ATOM 581 C THR A1137 0.906 -17.090 10.078 1.00 7.78 C ATOM 582 O THR A1137 1.964 -17.441 10.612 1.00 8.70 O ATOM 583 CB THR A1137 0.761 -16.321 7.693 1.00 8.53 C ATOM 584 OG1 THR A1137 0.501 -16.775 6.358 1.00 11.27 O ATOM 585 CG2 THR A1137 2.174 -15.748 7.762 1.00 9.99 C ATOM 586 HG1 THR A1137 1.138 -17.497 6.126 1.00 0.00 H ATOM 587 H THR A1137 -1.489 -17.441 8.024 1.00 0.00 H ATOM 588 N ILE A1138 -0.020 -16.376 10.711 1.00 7.52 N ATOM 589 CA ILE A1138 0.167 -15.950 12.089 1.00 7.62 C ATOM 590 C ILE A1138 0.285 -17.157 13.007 1.00 7.25 C ATOM 591 O ILE A1138 1.153 -17.203 13.887 1.00 8.61 O ATOM 592 CB ILE A1138 -0.977 -15.014 12.505 1.00 7.67 C ATOM 593 CG1 ILE A1138 -0.982 -13.760 11.625 1.00 8.03 C ATOM 594 CG2 ILE A1138 -0.844 -14.659 13.963 1.00 9.58 C ATOM 595 CD1 ILE A1138 -2.207 -12.897 11.784 1.00 9.61 C ATOM 596 H ILE A1138 -0.895 -16.117 10.211 1.00 0.00 H ATOM 597 N LYS A1139 -0.580 -18.154 12.812 1.00 7.67 N ATOM 598 CA LYS A1139 -0.549 -19.348 13.647 1.00 8.68 C ATOM 599 C LYS A1139 0.796 -20.049 13.528 1.00 8.26 C ATOM 600 O LYS A1139 1.401 -20.435 14.534 1.00 8.59 O ATOM 601 CB LYS A1139 -1.699 -20.268 13.237 1.00 8.49 C ATOM 602 CG LYS A1139 -2.191 -21.159 14.351 1.00 14.33 C ATOM 603 CD LYS A1139 -1.506 -22.481 14.379 1.00 19.35 C ATOM 604 CE LYS A1139 -2.143 -23.383 15.425 1.00 13.97 C ATOM 605 NZ LYS A1139 -1.369 -24.628 15.470 1.00 12.21 N ATOM 606 HZ1 LYS A1139 -1.393 -25.084 14.535 1.00 0.00 H ATOM 607 HZ2 LYS A1139 -0.384 -24.414 15.727 1.00 0.00 H ATOM 608 HZ3 LYS A1139 -1.783 -25.267 16.179 1.00 0.00 H ATOM 609 H LYS A1139 -1.287 -18.078 12.053 1.00 0.00 H ATOM 610 N ARG A1140 1.289 -20.207 12.299 1.00 8.04 N ATOM 611 CA ARG A1140 2.571 -20.873 12.105 1.00 9.15 C ATOM 612 C ARG A1140 3.707 -20.074 12.732 1.00 8.55 C ATOM 613 O ARG A1140 4.640 -20.650 13.307 1.00 9.71 O ATOM 614 CB ARG A1140 2.821 -21.075 10.612 1.00 10.32 C ATOM 615 CG ARG A1140 4.101 -21.847 10.331 1.00 12.86 C ATOM 616 CD ARG A1140 4.296 -22.104 8.844 1.00 15.23 C ATOM 617 NE ARG A1140 4.383 -20.843 8.114 1.00 20.64 N ATOM 618 CZ ARG A1140 3.427 -20.354 7.328 1.00 17.60 C ATOM 619 NH1 ARG A1140 2.305 -21.026 7.142 1.00 16.55 N ATOM 620 NH2 ARG A1140 3.600 -19.187 6.727 1.00 20.55 N ATOM 621 HE ARG A1140 5.256 -20.286 8.216 1.00 0.00 H ATOM 622 HH12 ARG A1140 1.562 -20.638 6.526 1.00 0.00 H ATOM 623 HH11 ARG A1140 2.164 -21.943 7.611 1.00 0.00 H ATOM 624 HH22 ARG A1140 2.854 -18.803 6.112 1.00 0.00 H ATOM 625 HH21 ARG A1140 4.482 -18.654 6.870 1.00 0.00 H ATOM 626 H ARG A1140 0.758 -19.854 11.477 1.00 0.00 H ATOM 627 N LYS A1141 3.641 -18.745 12.651 1.00 8.70 N ATOM 628 CA LYS A1141 4.674 -17.923 13.262 1.00 9.93 C ATOM 629 C LYS A1141 4.668 -18.069 14.782 1.00 9.57 C ATOM 630 O LYS A1141 5.731 -18.105 15.409 1.00 10.24 O ATOM 631 CB LYS A1141 4.521 -16.467 12.811 1.00 9.87 C ATOM 632 CG LYS A1141 4.912 -16.273 11.340 1.00 11.27 C ATOM 633 CD LYS A1141 4.575 -14.898 10.793 1.00 13.32 C ATOM 634 CE LYS A1141 5.549 -13.869 11.289 1.00 13.34 C ATOM 635 NZ LYS A1141 5.322 -12.540 10.622 1.00 13.73 N ATOM 636 HZ1 LYS A1141 5.443 -12.644 9.594 1.00 0.00 H ATOM 637 HZ2 LYS A1141 4.357 -12.211 10.827 1.00 0.00 H ATOM 638 HZ3 LYS A1141 6.010 -11.849 10.985 1.00 0.00 H ATOM 639 H LYS A1141 2.849 -18.295 12.150 1.00 0.00 H ATOM 640 N LEU A1142 3.486 -18.181 15.396 1.00 9.04 N ATOM 641 CA LEU A1142 3.428 -18.455 16.831 1.00 11.00 C ATOM 642 C LEU A1142 3.956 -19.847 17.162 1.00 9.52 C ATOM 643 O LEU A1142 4.699 -20.020 18.140 1.00 11.06 O ATOM 644 CB LEU A1142 1.994 -18.333 17.336 1.00 13.15 C ATOM 645 CG LEU A1142 1.441 -16.950 17.631 1.00 12.49 C ATOM 646 CD1 LEU A1142 -0.027 -17.067 17.988 1.00 15.36 C ATOM 647 CD2 LEU A1142 2.218 -16.298 18.767 1.00 14.84 C ATOM 648 H LEU A1142 2.606 -18.073 14.852 1.00 0.00 H ATOM 649 N ASP A1143 3.560 -20.862 16.387 1.00 9.48 N ATOM 650 CA ASP A1143 3.988 -22.229 16.679 1.00 9.21 C ATOM 651 C ASP A1143 5.499 -22.360 16.608 1.00 10.46 C ATOM 652 O ASP A1143 6.110 -23.051 17.431 1.00 10.71 O ATOM 653 CB ASP A1143 3.395 -23.205 15.658 1.00 10.48 C ATOM 654 CG ASP A1143 1.957 -23.558 15.930 1.00 12.10 C ATOM 655 OD1 ASP A1143 1.463 -23.368 17.056 1.00 13.07 O ATOM 656 OD2 ASP A1143 1.303 -24.050 14.990 1.00 14.47 O ATOM 657 H ASP A1143 2.943 -20.678 15.570 1.00 0.00 H ATOM 658 N THR A1144 6.114 -21.732 15.608 1.00 10.84 N ATOM 659 CA THR A1144 7.522 -21.919 15.289 1.00 11.27 C ATOM 660 C THR A1144 8.413 -20.856 15.904 1.00 13.29 C ATOM 661 O THR A1144 9.633 -20.894 15.703 1.00 16.78 O ATOM 662 CB THR A1144 7.727 -21.964 13.766 1.00 12.32 C ATOM 663 OG1 THR A1144 7.364 -20.701 13.198 1.00 11.81 O ATOM 664 CG2 THR A1144 6.876 -23.053 13.126 1.00 13.65 C ATOM 665 HG1 THR A1144 7.496 -20.731 12.217 1.00 0.00 H ATOM 666 H THR A1144 5.560 -21.074 15.024 1.00 0.00 H ATOM 667 N GLY A1145 7.841 -19.925 16.654 1.00 12.47 N ATOM 668 CA GLY A1145 8.638 -18.965 17.395 1.00 13.63 C ATOM 669 C GLY A1145 9.233 -17.837 16.580 1.00 15.21 C ATOM 670 O GLY A1145 10.357 -17.398 16.865 1.00 16.58 O ATOM 671 H GLY A1145 6.804 -19.882 16.712 1.00 0.00 H ATOM 672 N GLN A1146 8.511 -17.339 15.581 1.00 12.02 N ATOM 673 CA GLN A1146 9.006 -16.265 14.727 1.00 13.53 C ATOM 674 C GLN A1146 8.693 -14.874 15.257 1.00 14.66 C ATOM 675 O GLN A1146 9.101 -13.884 14.636 1.00 15.95 O ATOM 676 CB GLN A1146 8.434 -16.395 13.319 1.00 13.75 C ATOM 677 CG GLN A1146 8.922 -17.610 12.568 1.00 15.29 C ATOM 678 CD GLN A1146 8.393 -17.639 11.156 1.00 17.61 C ATOM 679 OE1 GLN A1146 8.485 -16.653 10.428 1.00 17.46 O ATOM 680 NE2 GLN A1146 7.812 -18.764 10.767 1.00 19.42 N ATOM 681 HE22 GLN A1146 7.757 -19.573 11.418 1.00 0.00 H ATOM 682 HE21 GLN A1146 7.410 -18.838 9.811 1.00 0.00 H ATOM 683 H GLN A1146 7.563 -17.728 15.403 1.00 0.00 H ATOM 684 N TYR A1147 7.967 -14.764 16.360 1.00 12.37 N ATOM 685 CA TYR A1147 7.723 -13.481 17.006 1.00 13.72 C ATOM 686 C TYR A1147 8.671 -13.320 18.189 1.00 15.84 C ATOM 687 O TYR A1147 8.627 -14.108 19.142 1.00 17.85 O ATOM 688 CB TYR A1147 6.278 -13.370 17.483 1.00 13.51 C ATOM 689 CG TYR A1147 5.254 -13.382 16.376 1.00 12.02 C ATOM 690 CD1 TYR A1147 5.265 -12.405 15.381 1.00 11.34 C ATOM 691 CD2 TYR A1147 4.262 -14.347 16.337 1.00 12.34 C ATOM 692 CE1 TYR A1147 4.325 -12.404 14.379 1.00 11.29 C ATOM 693 CE2 TYR A1147 3.316 -14.350 15.346 1.00 11.44 C ATOM 694 CZ TYR A1147 3.353 -13.380 14.371 1.00 9.81 C ATOM 695 OH TYR A1147 2.407 -13.395 13.387 1.00 10.93 O ATOM 696 HH TYR A1147 2.566 -12.640 12.766 1.00 0.00 H ATOM 697 H TYR A1147 7.557 -15.623 16.779 1.00 0.00 H ATOM 698 N GLN A1148 9.519 -12.297 18.132 1.00 15.66 N ATOM 699 CA GLN A1148 10.388 -12.007 19.263 1.00 19.61 C ATOM 700 C GLN A1148 9.657 -11.219 20.341 1.00 15.73 C ATOM 701 O GLN A1148 9.961 -11.366 21.530 1.00 16.28 O ATOM 702 CB GLN A1148 11.636 -11.258 18.787 1.00 27.11 C ATOM 703 CG GLN A1148 12.372 -11.963 17.651 1.00 39.72 C ATOM 704 CD GLN A1148 13.675 -11.282 17.274 1.00 52.86 C ATOM 705 OE1 GLN A1148 13.910 -10.971 16.106 1.00 55.38 O ATOM 706 NE2 GLN A1148 14.535 -11.060 18.262 1.00 57.87 N ATOM 707 HE22 GLN A1148 14.294 -11.340 19.234 1.00 0.00 H ATOM 708 HE21 GLN A1148 15.450 -10.606 18.063 1.00 0.00 H ATOM 709 H GLN A1148 9.561 -11.704 17.279 1.00 0.00 H ATOM 710 N GLU A1149 8.690 -10.397 19.951 1.00 16.16 N ATOM 711 CA GLU A1149 7.984 -9.514 20.863 1.00 15.94 C ATOM 712 C GLU A1149 6.496 -9.565 20.553 1.00 12.78 C ATOM 713 O GLU A1149 6.109 -9.732 19.391 1.00 13.74 O ATOM 714 CB GLU A1149 8.466 -8.065 20.690 1.00 17.40 C ATOM 715 CG GLU A1149 9.924 -7.834 21.034 1.00 31.82 C ATOM 716 CD GLU A1149 10.084 -7.005 22.288 1.00 49.95 C ATOM 717 OE1 GLU A1149 9.908 -7.559 23.393 1.00 55.84 O ATOM 718 OE2 GLU A1149 10.365 -5.794 22.168 1.00 56.68 O ATOM 719 H GLU A1149 8.426 -10.385 18.945 1.00 0.00 H ATOM 720 N PRO A1150 5.640 -9.403 21.565 1.00 13.16 N ATOM 721 CA PRO A1150 4.190 -9.441 21.304 1.00 14.68 C ATOM 722 C PRO A1150 3.718 -8.421 20.280 1.00 12.62 C ATOM 723 O PRO A1150 2.751 -8.703 19.555 1.00 12.19 O ATOM 724 CB PRO A1150 3.566 -9.189 22.685 1.00 19.91 C ATOM 725 CG PRO A1150 4.660 -9.424 23.677 1.00 17.15 C ATOM 726 CD PRO A1150 5.957 -9.164 22.984 1.00 16.14 C ATOM 727 N TRP A1151 4.364 -7.251 20.187 1.00 11.79 N ATOM 728 CA TRP A1151 3.905 -6.245 19.231 1.00 12.00 C ATOM 729 C TRP A1151 3.930 -6.777 17.810 1.00 10.92 C ATOM 730 O TRP A1151 3.124 -6.349 16.981 1.00 10.38 O ATOM 731 CB TRP A1151 4.713 -4.942 19.340 1.00 13.15 C ATOM 732 CG TRP A1151 6.082 -4.971 18.710 1.00 13.04 C ATOM 733 CD1 TRP A1151 7.269 -5.171 19.359 1.00 15.51 C ATOM 734 CD2 TRP A1151 6.413 -4.762 17.328 1.00 14.23 C ATOM 735 NE1 TRP A1151 8.309 -5.128 18.465 1.00 16.42 N ATOM 736 CE2 TRP A1151 7.814 -4.872 17.215 1.00 16.59 C ATOM 737 CE3 TRP A1151 5.665 -4.502 16.176 1.00 16.16 C ATOM 738 CZ2 TRP A1151 8.479 -4.734 15.999 1.00 18.53 C ATOM 739 CZ3 TRP A1151 6.332 -4.366 14.968 1.00 18.12 C ATOM 740 CH2 TRP A1151 7.724 -4.480 14.892 1.00 20.28 C ATOM 741 HE1 TRP A1151 9.313 -5.268 18.700 1.00 0.00 H ATOM 742 H TRP A1151 5.188 -7.059 20.792 1.00 0.00 H ATOM 743 N GLN A1152 4.833 -7.709 17.509 1.00 9.94 N ATOM 744 CA GLN A1152 4.931 -8.207 16.144 1.00 10.70 C ATOM 745 C GLN A1152 3.719 -9.051 15.788 1.00 9.93 C ATOM 746 O GLN A1152 3.251 -9.021 14.648 1.00 10.03 O ATOM 747 CB GLN A1152 6.219 -9.003 15.970 1.00 11.79 C ATOM 748 CG GLN A1152 7.489 -8.195 16.203 1.00 14.32 C ATOM 749 CD GLN A1152 8.710 -9.078 16.204 1.00 18.35 C ATOM 750 OE1 GLN A1152 8.779 -10.046 16.954 1.00 18.48 O ATOM 751 NE2 GLN A1152 9.679 -8.759 15.352 1.00 24.87 N ATOM 752 HE22 GLN A1152 9.576 -7.928 14.735 1.00 0.00 H ATOM 753 HE21 GLN A1152 10.540 -9.340 15.302 1.00 0.00 H ATOM 754 H GLN A1152 5.466 -8.080 18.246 1.00 0.00 H ATOM 755 N TYR A1153 3.217 -9.827 16.751 1.00 9.68 N ATOM 756 CA TYR A1153 1.986 -10.586 16.551 1.00 9.48 C ATOM 757 C TYR A1153 0.804 -9.650 16.362 1.00 8.14 C ATOM 758 O TYR A1153 0.008 -9.800 15.427 1.00 8.47 O ATOM 759 CB TYR A1153 1.767 -11.492 17.765 1.00 9.67 C ATOM 760 CG TYR A1153 0.375 -12.055 17.859 1.00 8.49 C ATOM 761 CD1 TYR A1153 -0.003 -13.150 17.100 1.00 9.24 C ATOM 762 CD2 TYR A1153 -0.564 -11.487 18.697 1.00 10.23 C ATOM 763 CE1 TYR A1153 -1.282 -13.671 17.188 1.00 9.01 C ATOM 764 CE2 TYR A1153 -1.844 -11.993 18.792 1.00 8.94 C ATOM 765 CZ TYR A1153 -2.199 -13.087 18.024 1.00 8.46 C ATOM 766 OH TYR A1153 -3.468 -13.618 18.086 1.00 10.12 O ATOM 767 HH TYR A1153 -3.655 -13.916 19.011 1.00 0.00 H ATOM 768 H TYR A1153 3.713 -9.892 17.663 1.00 0.00 H ATOM 769 N VAL A1154 0.697 -8.654 17.236 1.00 8.90 N ATOM 770 CA VAL A1154 -0.396 -7.695 17.143 1.00 9.56 C ATOM 771 C VAL A1154 -0.356 -6.969 15.806 1.00 8.71 C ATOM 772 O VAL A1154 -1.397 -6.747 15.175 1.00 8.84 O ATOM 773 CB VAL A1154 -0.319 -6.723 18.335 1.00 8.96 C ATOM 774 CG1 VAL A1154 -1.295 -5.566 18.171 1.00 10.90 C ATOM 775 CG2 VAL A1154 -0.601 -7.470 19.622 1.00 12.03 C ATOM 776 H VAL A1154 1.402 -8.558 17.995 1.00 0.00 H ATOM 777 N ASP A1155 0.846 -6.611 15.340 1.00 8.89 N ATOM 778 CA ASP A1155 0.961 -5.934 14.056 1.00 8.27 C ATOM 779 C ASP A1155 0.460 -6.809 12.922 1.00 8.15 C ATOM 780 O ASP A1155 -0.222 -6.316 12.021 1.00 8.65 O ATOM 781 CB ASP A1155 2.392 -5.482 13.773 1.00 10.72 C ATOM 782 CG ASP A1155 2.464 -4.615 12.529 1.00 12.81 C ATOM 783 OD1 ASP A1155 2.137 -3.420 12.639 1.00 12.03 O ATOM 784 OD2 ASP A1155 2.752 -5.122 11.417 1.00 16.27 O ATOM 785 H ASP A1155 1.700 -6.817 15.896 1.00 0.00 H ATOM 786 N ASP A1156 0.797 -8.100 12.939 1.00 8.44 N ATOM 787 CA ASP A1156 0.323 -8.991 11.889 1.00 7.79 C ATOM 788 C ASP A1156 -1.195 -9.101 11.892 1.00 6.83 C ATOM 789 O ASP A1156 -1.817 -9.139 10.826 1.00 7.00 O ATOM 790 CB ASP A1156 0.938 -10.378 12.041 1.00 8.31 C ATOM 791 CG ASP A1156 2.259 -10.535 11.306 1.00 9.54 C ATOM 792 OD1 ASP A1156 2.636 -9.657 10.492 1.00 12.42 O ATOM 793 OD2 ASP A1156 2.919 -11.566 11.530 1.00 10.74 O ATOM 794 H ASP A1156 1.398 -8.470 13.702 1.00 0.00 H ATOM 795 N VAL A1157 -1.816 -9.132 13.071 1.00 7.07 N ATOM 796 CA VAL A1157 -3.272 -9.227 13.104 1.00 7.64 C ATOM 797 C VAL A1157 -3.905 -7.978 12.509 1.00 6.62 C ATOM 798 O VAL A1157 -4.799 -8.062 11.664 1.00 7.23 O ATOM 799 CB VAL A1157 -3.776 -9.522 14.525 1.00 8.19 C ATOM 800 CG1 VAL A1157 -5.301 -9.489 14.563 1.00 8.86 C ATOM 801 CG2 VAL A1157 -3.244 -10.872 15.022 1.00 8.78 C ATOM 802 H VAL A1157 -1.270 -9.089 13.955 1.00 0.00 H ATOM 803 N TRP A1158 -3.450 -6.797 12.945 1.00 7.18 N ATOM 804 CA TRP A1158 -4.015 -5.570 12.398 1.00 7.78 C ATOM 805 C TRP A1158 -3.688 -5.396 10.924 1.00 7.01 C ATOM 806 O TRP A1158 -4.480 -4.803 10.189 1.00 7.35 O ATOM 807 CB TRP A1158 -3.586 -4.343 13.207 1.00 8.06 C ATOM 808 CG TRP A1158 -4.249 -4.323 14.540 1.00 8.26 C ATOM 809 CD1 TRP A1158 -3.655 -4.505 15.749 1.00 9.71 C ATOM 810 CD2 TRP A1158 -5.649 -4.168 14.796 1.00 8.32 C ATOM 811 NE1 TRP A1158 -4.602 -4.472 16.746 1.00 10.32 N ATOM 812 CE2 TRP A1158 -5.834 -4.278 16.183 1.00 10.05 C ATOM 813 CE3 TRP A1158 -6.766 -3.948 13.986 1.00 10.60 C ATOM 814 CZ2 TRP A1158 -7.091 -4.166 16.784 1.00 11.89 C ATOM 815 CZ3 TRP A1158 -8.015 -3.843 14.588 1.00 12.60 C ATOM 816 CH2 TRP A1158 -8.163 -3.956 15.970 1.00 13.11 C ATOM 817 HE1 TRP A1158 -4.412 -4.577 17.763 1.00 0.00 H ATOM 818 H TRP A1158 -2.702 -6.756 13.666 1.00 0.00 H ATOM 819 N LEU A1159 -2.542 -5.904 10.476 1.00 7.09 N ATOM 820 CA LEU A1159 -2.227 -5.902 9.053 1.00 7.71 C ATOM 821 C LEU A1159 -3.251 -6.716 8.275 1.00 6.53 C ATOM 822 O LEU A1159 -3.781 -6.266 7.249 1.00 7.27 O ATOM 823 CB LEU A1159 -0.820 -6.464 8.851 1.00 7.77 C ATOM 824 CG LEU A1159 -0.392 -6.747 7.410 1.00 7.73 C ATOM 825 CD1 LEU A1159 -0.377 -5.463 6.587 1.00 9.30 C ATOM 826 CD2 LEU A1159 0.964 -7.418 7.399 1.00 9.02 C ATOM 827 H LEU A1159 -1.862 -6.308 11.151 1.00 0.00 H ATOM 828 N MET A1160 -3.541 -7.925 8.756 1.00 6.72 N ATOM 829 CA MET A1160 -4.556 -8.762 8.133 1.00 6.86 C ATOM 830 C MET A1160 -5.882 -8.019 8.005 1.00 6.36 C ATOM 831 O MET A1160 -6.508 -8.025 6.940 1.00 6.77 O ATOM 832 CB MET A1160 -4.718 -10.024 8.974 1.00 7.26 C ATOM 833 CG MET A1160 -5.867 -10.905 8.554 1.00 7.66 C ATOM 834 SD MET A1160 -6.009 -12.411 9.533 1.00 8.73 S ATOM 835 CE MET A1160 -6.106 -11.751 11.197 1.00 12.91 C ATOM 836 H MET A1160 -3.032 -8.277 9.592 1.00 0.00 H ATOM 837 N PHE A1161 -6.329 -7.379 9.086 1.00 6.06 N ATOM 838 CA PHE A1161 -7.621 -6.695 9.047 1.00 6.11 C ATOM 839 C PHE A1161 -7.573 -5.485 8.123 1.00 6.27 C ATOM 840 O PHE A1161 -8.502 -5.251 7.339 1.00 7.46 O ATOM 841 CB PHE A1161 -8.019 -6.223 10.440 1.00 7.08 C ATOM 842 CG PHE A1161 -8.304 -7.329 11.421 1.00 7.08 C ATOM 843 CD1 PHE A1161 -8.824 -8.552 11.026 1.00 7.96 C ATOM 844 CD2 PHE A1161 -8.062 -7.126 12.761 1.00 8.21 C ATOM 845 CE1 PHE A1161 -9.101 -9.540 11.972 1.00 9.26 C ATOM 846 CE2 PHE A1161 -8.332 -8.110 13.707 1.00 9.70 C ATOM 847 CZ PHE A1161 -8.843 -9.310 13.310 1.00 9.92 C ATOM 848 H PHE A1161 -5.759 -7.366 9.956 1.00 0.00 H ATOM 849 N ASN A1162 -6.516 -4.674 8.227 1.00 6.76 N ATOM 850 CA ASN A1162 -6.436 -3.481 7.397 1.00 7.54 C ATOM 851 C ASN A1162 -6.310 -3.829 5.920 1.00 7.66 C ATOM 852 O ASN A1162 -6.873 -3.132 5.075 1.00 8.21 O ATOM 853 CB ASN A1162 -5.332 -2.549 7.893 1.00 7.80 C ATOM 854 CG ASN A1162 -5.808 -1.688 9.041 1.00 8.03 C ATOM 855 OD1 ASN A1162 -6.437 -0.657 8.821 1.00 9.77 O ATOM 856 ND2 ASN A1162 -5.551 -2.125 10.277 1.00 8.18 N ATOM 857 HD22 ASN A1162 -5.014 -3.005 10.416 1.00 0.00 H ATOM 858 HD21 ASN A1162 -5.888 -1.586 11.100 1.00 0.00 H ATOM 859 H ASN A1162 -5.753 -4.894 8.899 1.00 0.00 H ATOM 860 N ASN A1163 -5.611 -4.913 5.591 1.00 7.09 N ATOM 861 CA ASN A1163 -5.590 -5.385 4.207 1.00 7.04 C ATOM 862 C ASN A1163 -7.000 -5.657 3.711 1.00 6.60 C ATOM 863 O ASN A1163 -7.361 -5.299 2.581 1.00 8.01 O ATOM 864 CB ASN A1163 -4.779 -6.674 4.085 1.00 7.68 C ATOM 865 CG ASN A1163 -3.289 -6.457 4.197 1.00 7.56 C ATOM 866 OD1 ASN A1163 -2.800 -5.332 4.091 1.00 8.56 O ATOM 867 ND2 ASN A1163 -2.556 -7.548 4.385 1.00 8.20 N ATOM 868 HD22 ASN A1163 -3.017 -8.476 4.468 1.00 0.00 H ATOM 869 HD21 ASN A1163 -1.521 -7.474 4.449 1.00 0.00 H ATOM 870 H ASN A1163 -5.078 -5.426 6.321 1.00 0.00 H ATOM 871 N ALA A1164 -7.806 -6.329 4.532 1.00 6.36 N ATOM 872 CA ALA A1164 -9.137 -6.714 4.085 1.00 7.39 C ATOM 873 C ALA A1164 -10.059 -5.509 3.964 1.00 6.44 C ATOM 874 O ALA A1164 -10.861 -5.431 3.022 1.00 7.43 O ATOM 875 CB ALA A1164 -9.730 -7.780 5.002 1.00 7.94 C ATOM 876 H ALA A1164 -7.485 -6.578 5.489 1.00 0.00 H ATOM 877 N TRP A1165 -9.965 -4.559 4.902 1.00 7.28 N ATOM 878 CA TRP A1165 -10.757 -3.341 4.779 1.00 7.28 C ATOM 879 C TRP A1165 -10.328 -2.532 3.564 1.00 9.27 C ATOM 880 O TRP A1165 -11.160 -1.912 2.891 1.00 10.07 O ATOM 881 CB TRP A1165 -10.603 -2.492 6.032 1.00 9.29 C ATOM 882 CG TRP A1165 -11.333 -2.980 7.230 1.00 8.53 C ATOM 883 CD1 TRP A1165 -12.601 -3.499 7.290 1.00 8.71 C ATOM 884 CD2 TRP A1165 -10.848 -2.949 8.571 1.00 8.58 C ATOM 885 NE1 TRP A1165 -12.925 -3.805 8.595 1.00 9.68 N ATOM 886 CE2 TRP A1165 -11.862 -3.478 9.396 1.00 8.55 C ATOM 887 CE3 TRP A1165 -9.647 -2.530 9.155 1.00 8.71 C ATOM 888 CZ2 TRP A1165 -11.714 -3.593 10.776 1.00 10.93 C ATOM 889 CZ3 TRP A1165 -9.504 -2.648 10.525 1.00 11.07 C ATOM 890 CH2 TRP A1165 -10.530 -3.177 11.320 1.00 10.63 C ATOM 891 HE1 TRP A1165 -13.825 -4.215 8.917 1.00 0.00 H ATOM 892 H TRP A1165 -9.330 -4.689 5.715 1.00 0.00 H ATOM 893 N LEU A1166 -9.035 -2.526 3.269 1.00 7.61 N ATOM 894 CA LEU A1166 -8.540 -1.781 2.120 1.00 9.25 C ATOM 895 C LEU A1166 -9.029 -2.384 0.816 1.00 8.95 C ATOM 896 O LEU A1166 -9.521 -1.668 -0.061 1.00 10.93 O ATOM 897 CB LEU A1166 -7.018 -1.756 2.143 1.00 10.22 C ATOM 898 CG LEU A1166 -6.360 -0.940 1.035 1.00 11.49 C ATOM 899 CD1 LEU A1166 -6.644 0.538 1.243 1.00 16.40 C ATOM 900 CD2 LEU A1166 -4.864 -1.210 1.003 1.00 17.39 C ATOM 901 H LEU A1166 -8.368 -3.058 3.864 1.00 0.00 H ATOM 902 N TYR A1167 -8.885 -3.699 0.660 1.00 7.69 N ATOM 903 CA TYR A1167 -9.185 -4.328 -0.619 1.00 8.30 C ATOM 904 C TYR A1167 -10.686 -4.440 -0.866 1.00 7.25 C ATOM 905 O TYR A1167 -11.156 -4.217 -1.986 1.00 8.72 O ATOM 906 CB TYR A1167 -8.529 -5.714 -0.726 1.00 8.58 C ATOM 907 CG TYR A1167 -8.855 -6.271 -2.074 1.00 9.35 C ATOM 908 CD1 TYR A1167 -8.198 -5.797 -3.191 1.00 9.97 C ATOM 909 CD2 TYR A1167 -9.891 -7.188 -2.253 1.00 10.73 C ATOM 910 CE1 TYR A1167 -8.533 -6.222 -4.448 1.00 11.46 C ATOM 911 CE2 TYR A1167 -10.232 -7.626 -3.519 1.00 12.73 C ATOM 912 CZ TYR A1167 -9.540 -7.138 -4.602 1.00 11.29 C ATOM 913 OH TYR A1167 -9.865 -7.546 -5.875 1.00 16.26 O ATOM 914 HH TYR A1167 -9.269 -7.098 -6.526 1.00 0.00 H ATOM 915 H TYR A1167 -8.556 -4.281 1.457 1.00 0.00 H ATOM 916 N ASN A1168 -11.452 -4.812 0.147 1.00 7.91 N ATOM 917 CA ASN A1168 -12.855 -5.151 -0.046 1.00 8.53 C ATOM 918 C ASN A1168 -13.739 -3.926 0.139 1.00 8.84 C ATOM 919 O ASN A1168 -13.391 -2.991 0.856 1.00 10.33 O ATOM 920 CB ASN A1168 -13.254 -6.264 0.922 1.00 7.92 C ATOM 921 CG ASN A1168 -12.470 -7.532 0.677 1.00 7.58 C ATOM 922 OD1 ASN A1168 -12.794 -8.306 -0.224 1.00 9.16 O ATOM 923 ND2 ASN A1168 -11.411 -7.742 1.440 1.00 8.17 N ATOM 924 HD22 ASN A1168 -11.169 -7.065 2.192 1.00 0.00 H ATOM 925 HD21 ASN A1168 -10.820 -8.584 1.289 1.00 0.00 H ATOM 926 H ASN A1168 -11.043 -4.863 1.102 1.00 0.00 H ATOM 927 N ARG A1169 -14.895 -3.934 -0.516 1.00 9.12 N ATOM 928 CA ARG A1169 -15.814 -2.810 -0.406 1.00 8.60 C ATOM 929 C ARG A1169 -16.562 -2.828 0.920 1.00 9.12 C ATOM 930 O ARG A1169 -16.798 -3.880 1.512 1.00 8.51 O ATOM 931 CB ARG A1169 -16.824 -2.838 -1.547 1.00 11.44 C ATOM 932 CG ARG A1169 -16.179 -2.717 -2.911 1.00 15.42 C ATOM 933 CD ARG A1169 -17.216 -2.614 -4.005 1.00 18.25 C ATOM 934 NE ARG A1169 -17.790 -1.275 -4.096 1.00 20.60 N ATOM 935 CZ ARG A1169 -17.241 -0.281 -4.789 1.00 28.63 C ATOM 936 NH1 ARG A1169 -17.825 0.908 -4.829 1.00 33.25 N ATOM 937 NH2 ARG A1169 -16.102 -0.476 -5.438 1.00 29.51 N ATOM 938 HE ARG A1169 -18.679 -1.087 -3.590 1.00 0.00 H ATOM 939 HH12 ARG A1169 -17.392 1.682 -5.372 1.00 0.00 H ATOM 940 HH11 ARG A1169 -18.716 1.067 -4.317 1.00 0.00 H ATOM 941 HH22 ARG A1169 -15.673 0.301 -5.980 1.00 0.00 H ATOM 942 HH21 ARG A1169 -15.638 -1.406 -5.405 1.00 0.00 H ATOM 943 H ARG A1169 -15.145 -4.749 -1.112 1.00 0.00 H ATOM 944 N LYS A1170 -16.953 -1.636 1.378 1.00 9.22 N ATOM 945 CA LYS A1170 -17.651 -1.515 2.652 1.00 10.43 C ATOM 946 C LYS A1170 -18.927 -2.347 2.693 1.00 9.83 C ATOM 947 O LYS A1170 -19.317 -2.820 3.761 1.00 10.57 O ATOM 948 CB LYS A1170 -18.002 -0.049 2.908 1.00 14.01 C ATOM 949 CG LYS A1170 -17.327 0.569 4.113 1.00 29.83 C ATOM 950 CD LYS A1170 -17.897 1.949 4.405 1.00 32.59 C ATOM 951 CE LYS A1170 -17.098 2.659 5.487 1.00 42.12 C ATOM 952 NZ LYS A1170 -17.026 1.866 6.746 1.00 45.46 N ATOM 953 HZ1 LYS A1170 -17.988 1.704 7.108 1.00 0.00 H ATOM 954 HZ2 LYS A1170 -16.568 0.952 6.553 1.00 0.00 H ATOM 955 HZ3 LYS A1170 -16.472 2.390 7.453 1.00 0.00 H ATOM 956 H LYS A1170 -16.757 -0.782 0.818 1.00 0.00 H ATOM 957 N THR A1171 -19.595 -2.520 1.558 1.00 8.79 N ATOM 958 CA THR A1171 -20.815 -3.313 1.476 1.00 9.67 C ATOM 959 C THR A1171 -20.552 -4.809 1.418 1.00 9.03 C ATOM 960 O THR A1171 -21.512 -5.585 1.429 1.00 10.05 O ATOM 961 CB THR A1171 -21.617 -2.907 0.237 1.00 10.41 C ATOM 962 OG1 THR A1171 -20.756 -2.969 -0.907 1.00 11.32 O ATOM 963 CG2 THR A1171 -22.171 -1.493 0.368 1.00 13.32 C ATOM 964 HG1 THR A1171 -20.416 -3.893 -1.013 1.00 0.00 H ATOM 965 H THR A1171 -19.233 -2.071 0.693 1.00 0.00 H ATOM 966 N SER A1172 -19.298 -5.234 1.355 1.00 8.49 N ATOM 967 CA SER A1172 -19.002 -6.632 1.089 1.00 7.68 C ATOM 968 C SER A1172 -19.039 -7.486 2.350 1.00 7.98 C ATOM 969 O SER A1172 -18.816 -7.013 3.471 1.00 8.25 O ATOM 970 CB SER A1172 -17.652 -6.797 0.391 1.00 8.16 C ATOM 971 OG SER A1172 -16.570 -6.586 1.286 1.00 8.48 O ATOM 972 HG SER A1172 -16.622 -5.668 1.654 1.00 0.00 H ATOM 973 H SER A1172 -18.518 -4.561 1.497 1.00 0.00 H ATOM 974 N ARG A1173 -19.327 -8.766 2.130 1.00 7.74 N ATOM 975 CA ARG A1173 -19.315 -9.766 3.188 1.00 8.30 C ATOM 976 C ARG A1173 -17.962 -9.812 3.889 1.00 7.35 C ATOM 977 O ARG A1173 -17.895 -9.832 5.123 1.00 7.40 O ATOM 978 CB ARG A1173 -19.657 -11.111 2.552 1.00 8.05 C ATOM 979 CG ARG A1173 -19.591 -12.321 3.452 1.00 8.04 C ATOM 980 CD ARG A1173 -20.114 -13.504 2.663 1.00 8.70 C ATOM 981 NE ARG A1173 -20.063 -14.766 3.387 1.00 8.65 N ATOM 982 CZ ARG A1173 -18.980 -15.535 3.477 1.00 8.34 C ATOM 983 NH1 ARG A1173 -19.055 -16.676 4.153 1.00 9.74 N ATOM 984 NH2 ARG A1173 -17.828 -15.161 2.936 1.00 8.57 N ATOM 985 HE ARG A1173 -20.929 -15.088 3.865 1.00 0.00 H ATOM 986 HH12 ARG A1173 -18.219 -17.289 4.233 1.00 0.00 H ATOM 987 HH11 ARG A1173 -19.950 -16.957 4.602 1.00 0.00 H ATOM 988 HH22 ARG A1173 -16.992 -15.775 3.016 1.00 0.00 H ATOM 989 HH21 ARG A1173 -17.761 -14.254 2.432 1.00 0.00 H ATOM 990 H ARG A1173 -19.570 -9.064 1.164 1.00 0.00 H ATOM 991 N VAL A1174 -16.870 -9.848 3.124 1.00 7.61 N ATOM 992 CA VAL A1174 -15.558 -9.977 3.749 1.00 7.54 C ATOM 993 C VAL A1174 -15.235 -8.755 4.595 1.00 7.30 C ATOM 994 O VAL A1174 -14.675 -8.883 5.684 1.00 7.28 O ATOM 995 CB VAL A1174 -14.468 -10.285 2.712 1.00 8.32 C ATOM 996 CG1 VAL A1174 -13.089 -10.188 3.353 1.00 9.45 C ATOM 997 CG2 VAL A1174 -14.685 -11.686 2.137 1.00 10.15 C ATOM 998 H VAL A1174 -16.953 -9.785 2.089 1.00 0.00 H ATOM 999 N TYR A1175 -15.571 -7.558 4.118 1.00 7.20 N ATOM 1000 CA TYR A1175 -15.321 -6.356 4.910 1.00 7.50 C ATOM 1001 C TYR A1175 -16.087 -6.410 6.226 1.00 6.96 C ATOM 1002 O TYR A1175 -15.543 -6.106 7.297 1.00 7.95 O ATOM 1003 CB TYR A1175 -15.741 -5.139 4.092 1.00 8.01 C ATOM 1004 CG TYR A1175 -15.449 -3.782 4.689 1.00 7.68 C ATOM 1005 CD1 TYR A1175 -16.191 -3.287 5.765 1.00 9.76 C ATOM 1006 CD2 TYR A1175 -14.490 -2.957 4.121 1.00 8.42 C ATOM 1007 CE1 TYR A1175 -15.942 -2.024 6.281 1.00 9.82 C ATOM 1008 CE2 TYR A1175 -14.239 -1.699 4.636 1.00 9.83 C ATOM 1009 CZ TYR A1175 -14.970 -1.242 5.709 1.00 10.14 C ATOM 1010 OH TYR A1175 -14.733 0.023 6.213 1.00 12.32 O ATOM 1011 HH TYR A1175 -15.340 0.192 6.977 1.00 0.00 H ATOM 1012 H TYR A1175 -16.012 -7.479 3.180 1.00 0.00 H ATOM 1013 N LYS A1176 -17.357 -6.803 6.161 1.00 7.58 N ATOM 1014 CA LYS A1176 -18.172 -6.878 7.364 1.00 8.64 C ATOM 1015 C LYS A1176 -17.677 -7.969 8.310 1.00 7.66 C ATOM 1016 O LYS A1176 -17.679 -7.778 9.533 1.00 9.63 O ATOM 1017 CB LYS A1176 -19.632 -7.061 6.965 1.00 9.93 C ATOM 1018 CG LYS A1176 -20.176 -5.796 6.309 1.00 9.46 C ATOM 1019 CD LYS A1176 -21.541 -5.987 5.667 1.00 10.03 C ATOM 1020 CE LYS A1176 -22.007 -4.730 4.949 1.00 11.28 C ATOM 1021 NZ LYS A1176 -22.259 -3.612 5.890 1.00 14.10 N ATOM 1022 HZ1 LYS A1176 -22.996 -3.891 6.568 1.00 0.00 H ATOM 1023 HZ2 LYS A1176 -21.382 -3.387 6.402 1.00 0.00 H ATOM 1024 HZ3 LYS A1176 -22.574 -2.776 5.357 1.00 0.00 H ATOM 1025 H LYS A1176 -17.771 -7.059 5.242 1.00 0.00 H ATOM 1026 N PHE A1177 -17.241 -9.113 7.774 1.00 7.95 N ATOM 1027 CA PHE A1177 -16.631 -10.146 8.610 1.00 8.17 C ATOM 1028 C PHE A1177 -15.379 -9.616 9.290 1.00 8.50 C ATOM 1029 O PHE A1177 -15.144 -9.861 10.485 1.00 8.64 O ATOM 1030 CB PHE A1177 -16.240 -11.343 7.742 1.00 8.48 C ATOM 1031 CG PHE A1177 -17.378 -12.264 7.383 1.00 8.44 C ATOM 1032 CD1 PHE A1177 -18.700 -11.950 7.661 1.00 8.46 C ATOM 1033 CD2 PHE A1177 -17.104 -13.474 6.757 1.00 9.15 C ATOM 1034 CE1 PHE A1177 -19.723 -12.844 7.337 1.00 9.23 C ATOM 1035 CE2 PHE A1177 -18.104 -14.352 6.422 1.00 9.15 C ATOM 1036 CZ PHE A1177 -19.414 -14.048 6.715 1.00 8.84 C ATOM 1037 H PHE A1177 -17.337 -9.270 6.750 1.00 0.00 H ATOM 1038 N CYS A1178 -14.562 -8.881 8.538 1.00 7.69 N ATOM 1039 CA CYS A1178 -13.355 -8.288 9.088 1.00 8.34 C ATOM 1040 C CYS A1178 -13.685 -7.409 10.283 1.00 8.06 C ATOM 1041 O CYS A1178 -13.031 -7.487 11.330 1.00 8.97 O ATOM 1042 CB CYS A1178 -12.659 -7.470 8.000 1.00 7.53 C ATOM 1043 SG CYS A1178 -11.067 -6.864 8.555 1.00 9.01 S ATOM 1044 H CYS A1178 -14.793 -8.728 7.536 1.00 0.00 H ATOM 1045 N SER A1179 -14.703 -6.561 10.146 1.00 7.99 N ATOM 1046 CA SER A1179 -15.074 -5.672 11.240 1.00 10.27 C ATOM 1047 C SER A1179 -15.467 -6.450 12.487 1.00 9.83 C ATOM 1048 O SER A1179 -15.121 -6.054 13.608 1.00 10.90 O ATOM 1049 CB SER A1179 -16.205 -4.761 10.787 1.00 10.10 C ATOM 1050 OG SER A1179 -15.716 -3.923 9.760 1.00 10.75 O ATOM 1051 HG SER A1179 -16.440 -3.322 9.453 1.00 0.00 H ATOM 1052 H SER A1179 -15.236 -6.533 9.253 1.00 0.00 H ATOM 1053 N LYS A1180 -16.187 -7.560 12.316 1.00 9.15 N ATOM 1054 CA LYS A1180 -16.551 -8.392 13.461 1.00 10.74 C ATOM 1055 C LYS A1180 -15.315 -8.992 14.117 1.00 10.66 C ATOM 1056 O LYS A1180 -15.178 -8.972 15.350 1.00 11.09 O ATOM 1057 CB LYS A1180 -17.517 -9.491 13.019 1.00 12.19 C ATOM 1058 CG LYS A1180 -17.807 -10.555 14.086 1.00 15.40 C ATOM 1059 CD LYS A1180 -18.462 -9.962 15.323 1.00 20.08 C ATOM 1060 CE LYS A1180 -18.803 -11.057 16.326 1.00 28.80 C ATOM 1061 NZ LYS A1180 -19.395 -10.504 17.574 1.00 34.02 N ATOM 1062 HZ1 LYS A1180 -18.716 -9.854 18.020 1.00 0.00 H ATOM 1063 HZ2 LYS A1180 -20.269 -9.990 17.343 1.00 0.00 H ATOM 1064 HZ3 LYS A1180 -19.612 -11.283 18.228 1.00 0.00 H ATOM 1065 H LYS A1180 -16.492 -7.835 11.360 1.00 0.00 H ATOM 1066 N LEU A1181 -14.397 -9.535 13.310 1.00 9.87 N ATOM 1067 CA LEU A1181 -13.186 -10.125 13.873 1.00 9.33 C ATOM 1068 C LEU A1181 -12.361 -9.089 14.608 1.00 9.24 C ATOM 1069 O LEU A1181 -11.775 -9.388 15.651 1.00 9.12 O ATOM 1070 CB LEU A1181 -12.331 -10.750 12.780 1.00 11.38 C ATOM 1071 CG LEU A1181 -12.946 -11.927 12.038 1.00 10.67 C ATOM 1072 CD1 LEU A1181 -11.972 -12.384 10.980 1.00 14.67 C ATOM 1073 CD2 LEU A1181 -13.315 -13.067 12.977 1.00 12.69 C ATOM 1074 H LEU A1181 -14.546 -9.537 12.281 1.00 0.00 H ATOM 1075 N ALA A1182 -12.289 -7.869 14.075 1.00 8.46 N ATOM 1076 CA ALA A1182 -11.497 -6.829 14.720 1.00 9.75 C ATOM 1077 C ALA A1182 -12.088 -6.449 16.068 1.00 11.10 C ATOM 1078 O ALA A1182 -11.346 -6.164 17.015 1.00 11.29 O ATOM 1079 CB ALA A1182 -11.414 -5.614 13.801 1.00 10.34 C ATOM 1080 H ALA A1182 -12.801 -7.658 13.194 1.00 0.00 H ATOM 1081 N GLU A1183 -13.416 -6.447 16.176 1.00 10.72 N ATOM 1082 CA GLU A1183 -14.045 -6.175 17.462 1.00 12.34 C ATOM 1083 C GLU A1183 -13.705 -7.261 18.467 1.00 12.00 C ATOM 1084 O GLU A1183 -13.392 -6.973 19.628 1.00 14.25 O ATOM 1085 CB GLU A1183 -15.561 -6.081 17.285 1.00 16.39 C ATOM 1086 CG GLU A1183 -16.030 -4.826 16.571 1.00 23.64 C ATOM 1087 H GLU A1183 -14.005 -6.640 15.341 1.00 0.00 H ATOM 1088 N VAL A1184 -13.767 -8.519 18.036 1.00 10.82 N ATOM 1089 CA VAL A1184 -13.383 -9.635 18.894 1.00 12.82 C ATOM 1090 C VAL A1184 -11.926 -9.504 19.309 1.00 11.42 C ATOM 1091 O VAL A1184 -11.578 -9.658 20.489 1.00 12.91 O ATOM 1092 CB VAL A1184 -13.653 -10.973 18.179 1.00 12.36 C ATOM 1093 CG1 VAL A1184 -13.073 -12.141 18.974 1.00 14.49 C ATOM 1094 CG2 VAL A1184 -15.141 -11.155 17.930 1.00 14.14 C ATOM 1095 H VAL A1184 -14.096 -8.710 17.068 1.00 0.00 H ATOM 1096 N PHE A1185 -11.052 -9.206 18.348 1.00 10.88 N ATOM 1097 CA PHE A1185 -9.629 -9.143 18.655 1.00 10.30 C ATOM 1098 C PHE A1185 -9.328 -8.044 19.664 1.00 11.71 C ATOM 1099 O PHE A1185 -8.563 -8.252 20.609 1.00 12.07 O ATOM 1100 CB PHE A1185 -8.802 -8.934 17.394 1.00 10.79 C ATOM 1101 CG PHE A1185 -7.329 -9.012 17.651 1.00 9.86 C ATOM 1102 CD1 PHE A1185 -6.759 -10.211 18.058 1.00 9.89 C ATOM 1103 CD2 PHE A1185 -6.517 -7.905 17.494 1.00 11.24 C ATOM 1104 CE1 PHE A1185 -5.403 -10.309 18.300 1.00 9.50 C ATOM 1105 CE2 PHE A1185 -5.157 -7.988 17.747 1.00 11.96 C ATOM 1106 CZ PHE A1185 -4.596 -9.193 18.150 1.00 10.42 C ATOM 1107 H PHE A1185 -11.385 -9.019 17.381 1.00 0.00 H ATOM 1108 N GLU A1186 -9.901 -6.862 19.468 1.00 12.43 N ATOM 1109 CA GLU A1186 -9.649 -5.768 20.401 1.00 14.53 C ATOM 1110 C GLU A1186 -10.044 -6.156 21.821 1.00 15.52 C ATOM 1111 O GLU A1186 -9.327 -5.845 22.784 1.00 16.46 O ATOM 1112 CB GLU A1186 -10.403 -4.525 19.937 1.00 17.13 C ATOM 1113 CG GLU A1186 -10.197 -3.299 20.805 1.00 29.65 C ATOM 1114 CD GLU A1186 -10.800 -2.053 20.190 1.00 45.34 C ATOM 1115 OE1 GLU A1186 -10.303 -1.613 19.131 1.00 50.97 O ATOM 1116 OE2 GLU A1186 -11.776 -1.521 20.758 1.00 53.97 O ATOM 1117 H GLU A1186 -10.528 -6.716 18.651 1.00 0.00 H ATOM 1118 N GLN A1187 -11.165 -6.864 21.969 1.00 13.37 N ATOM 1119 CA GLN A1187 -11.610 -7.304 23.288 1.00 16.07 C ATOM 1120 C GLN A1187 -10.651 -8.323 23.892 1.00 14.12 C ATOM 1121 O GLN A1187 -10.404 -8.307 25.104 1.00 18.01 O ATOM 1122 CB GLN A1187 -13.007 -7.910 23.183 1.00 19.31 C ATOM 1123 CG GLN A1187 -14.090 -6.941 22.748 1.00 41.53 C ATOM 1124 CD GLN A1187 -15.419 -7.631 22.501 1.00 58.10 C ATOM 1125 OE1 GLN A1187 -15.577 -8.820 22.786 1.00 62.84 O ATOM 1126 NE2 GLN A1187 -16.381 -6.889 21.965 1.00 63.84 N ATOM 1127 HE22 GLN A1187 -16.203 -5.889 21.741 1.00 0.00 H ATOM 1128 HE21 GLN A1187 -17.313 -7.308 21.769 1.00 0.00 H ATOM 1129 H GLN A1187 -11.731 -7.106 21.131 1.00 0.00 H ATOM 1130 N GLU A1188 -10.110 -9.225 23.074 1.00 15.31 N ATOM 1131 CA GLU A1188 -9.272 -10.303 23.594 1.00 14.80 C ATOM 1132 C GLU A1188 -7.833 -9.853 23.821 1.00 14.89 C ATOM 1133 O GLU A1188 -7.185 -10.304 24.774 1.00 16.08 O ATOM 1134 CB GLU A1188 -9.295 -11.502 22.639 1.00 19.86 C ATOM 1135 CG GLU A1188 -10.672 -12.117 22.408 1.00 23.75 C ATOM 1136 CD GLU A1188 -11.142 -12.984 23.563 1.00 42.40 C ATOM 1137 OE1 GLU A1188 -10.334 -13.268 24.472 1.00 50.13 O ATOM 1138 OE2 GLU A1188 -12.325 -13.385 23.558 1.00 48.28 O ATOM 1139 H GLU A1188 -10.287 -9.161 22.051 1.00 0.00 H ATOM 1140 N ILE A1189 -7.312 -8.968 22.968 1.00 15.48 N ATOM 1141 CA ILE A1189 -5.881 -8.670 23.006 1.00 14.92 C ATOM 1142 C ILE A1189 -5.530 -7.743 24.160 1.00 15.94 C ATOM 1143 O ILE A1189 -4.441 -7.853 24.734 1.00 16.71 O ATOM 1144 CB ILE A1189 -5.383 -8.127 21.652 1.00 12.50 C ATOM 1145 CG1 ILE A1189 -3.855 -8.187 21.556 1.00 13.80 C ATOM 1146 CG2 ILE A1189 -5.863 -6.690 21.416 1.00 16.22 C ATOM 1147 CD1 ILE A1189 -3.251 -9.570 21.768 1.00 14.92 C ATOM 1148 H ILE A1189 -7.924 -8.490 22.276 1.00 0.00 H ATOM 1149 N ASP A1190 -6.433 -6.826 24.519 1.00 17.56 N ATOM 1150 CA ASP A1190 -6.128 -5.850 25.565 1.00 20.24 C ATOM 1151 C ASP A1190 -5.786 -6.482 26.910 1.00 17.98 C ATOM 1152 O ASP A1190 -4.721 -6.158 27.463 1.00 22.77 O ATOM 1153 CB ASP A1190 -7.237 -4.794 25.654 1.00 33.15 C ATOM 1154 CG ASP A1190 -7.238 -3.839 24.472 1.00 49.52 C ATOM 1155 OD1 ASP A1190 -6.327 -3.932 23.621 1.00 53.00 O ATOM 1156 OD2 ASP A1190 -8.153 -2.992 24.394 1.00 53.32 O ATOM 1157 H ASP A1190 -7.361 -6.806 24.050 1.00 0.00 H ATOM 1158 N PRO A1191 -6.601 -7.373 27.487 1.00 20.18 N ATOM 1159 CA PRO A1191 -6.213 -7.962 28.779 1.00 25.77 C ATOM 1160 C PRO A1191 -5.018 -8.893 28.682 1.00 22.04 C ATOM 1161 O PRO A1191 -4.261 -9.020 29.652 1.00 24.16 O ATOM 1162 CB PRO A1191 -7.480 -8.700 29.233 1.00 28.02 C ATOM 1163 CG PRO A1191 -8.206 -9.000 27.976 1.00 30.62 C ATOM 1164 CD PRO A1191 -7.927 -7.850 27.050 1.00 27.16 C ATOM 1165 N VAL A1192 -4.821 -9.551 27.539 1.00 20.97 N ATOM 1166 CA VAL A1192 -3.647 -10.398 27.378 1.00 19.37 C ATOM 1167 C VAL A1192 -2.378 -9.557 27.341 1.00 18.90 C ATOM 1168 O VAL A1192 -1.382 -9.887 27.999 1.00 19.97 O ATOM 1169 CB VAL A1192 -3.796 -11.295 26.138 1.00 16.45 C ATOM 1170 CG1 VAL A1192 -2.475 -11.969 25.808 1.00 20.62 C ATOM 1171 CG2 VAL A1192 -4.889 -12.326 26.366 1.00 21.80 C ATOM 1172 H VAL A1192 -5.506 -9.459 26.762 1.00 0.00 H ATOM 1173 N MET A1193 -2.393 -8.451 26.592 1.00 20.83 N ATOM 1174 CA MET A1193 -1.221 -7.583 26.547 1.00 21.21 C ATOM 1175 C MET A1193 -0.964 -6.928 27.898 1.00 26.53 C ATOM 1176 O MET A1193 0.196 -6.728 28.278 1.00 30.49 O ATOM 1177 CB MET A1193 -1.355 -6.530 25.442 1.00 24.50 C ATOM 1178 CG MET A1193 -1.336 -7.100 24.022 1.00 21.20 C ATOM 1179 SD MET A1193 0.239 -7.850 23.530 1.00 22.61 S ATOM 1180 CE MET A1193 1.190 -6.404 23.091 1.00 22.71 C ATOM 1181 H MET A1193 -3.241 -8.208 26.041 1.00 0.00 H ATOM 1182 N GLN A1194 -2.027 -6.612 28.643 1.00 24.94 N ATOM 1183 CA GLN A1194 -1.855 -6.077 29.988 1.00 29.17 C ATOM 1184 C GLN A1194 -1.199 -7.103 30.903 1.00 30.11 C ATOM 1185 O GLN A1194 -0.358 -6.753 31.741 1.00 32.40 O ATOM 1186 CB GLN A1194 -3.210 -5.636 30.541 1.00 30.10 C ATOM 1187 CG GLN A1194 -3.148 -4.873 31.854 1.00 40.98 C ATOM 1188 CD GLN A1194 -4.504 -4.332 32.266 1.00 50.17 C ATOM 1189 OE1 GLN A1194 -5.092 -4.781 33.251 1.00 54.12 O ATOM 1190 NE2 GLN A1194 -5.010 -3.363 31.510 1.00 52.31 N ATOM 1191 HE22 GLN A1194 -4.478 -3.014 30.687 1.00 0.00 H ATOM 1192 HE21 GLN A1194 -5.938 -2.954 31.741 1.00 0.00 H ATOM 1193 H GLN A1194 -2.984 -6.749 28.260 1.00 0.00 H ATOM 1194 N SER A1195 -1.563 -8.380 30.755 1.00 30.11 N ATOM 1195 CA SER A1195 -0.928 -9.426 31.547 1.00 30.13 C ATOM 1196 C SER A1195 0.513 -9.679 31.125 1.00 32.37 C ATOM 1197 O SER A1195 1.306 -10.163 31.940 1.00 37.01 O ATOM 1198 CB SER A1195 -1.739 -10.721 31.482 1.00 32.05 C ATOM 1199 OG SER A1195 -1.753 -11.250 30.167 1.00 38.53 O ATOM 1200 HG SER A1195 -2.160 -10.590 29.551 1.00 0.00 H ATOM 1201 H SER A1195 -2.305 -8.629 30.070 1.00 0.00 H ATOM 1202 N LEU A1196 0.871 -9.361 29.885 1.00 30.19 N ATOM 1203 CA LEU A1196 2.244 -9.524 29.416 1.00 33.07 C ATOM 1204 C LEU A1196 3.090 -8.305 29.770 1.00 42.67 C ATOM 1205 O LEU A1196 4.321 -8.363 29.743 1.00 44.61 O ATOM 1206 CB LEU A1196 2.278 -9.764 27.904 1.00 25.62 C ATOM 1207 CG LEU A1196 1.732 -11.103 27.407 1.00 24.83 C ATOM 1208 CD1 LEU A1196 1.665 -11.129 25.884 1.00 22.61 C ATOM 1209 CD2 LEU A1196 2.591 -12.245 27.928 1.00 29.53 C ATOM 1210 H LEU A1196 0.154 -8.986 29.232 1.00 0.00 H TER 1211 LEU A1196 HETATM 1212 O HOH 1 8.074 -20.834 10.686 1.00 45.40 O HETATM 1213 O HOH 2 -4.263 -3.321 23.785 1.00 38.64 O HETATM 1214 O HOH 3 3.097 -19.451 29.438 1.00 25.91 O HETATM 1215 O HOH 4 -14.527 -15.999 19.633 1.00 24.27 O HETATM 1216 O HOH 5 10.269 -3.670 21.375 1.00 37.64 O HETATM 1217 O HOH 6 10.051 -2.989 38.919 1.00 38.59 O HETATM 1218 O HOH 7 -11.987 -0.939 0.930 1.00 11.72 O HETATM 1219 O HOH 8 -16.894 -20.527 -3.626 1.00 45.73 O HETATM 1220 O HOH 9 -10.391 -3.855 -6.776 1.00 39.51 O HETATM 1221 O HOH 10 -8.069 -0.941 23.141 1.00 40.36 O HETATM 1222 O HOH 11 3.349 -2.098 2.662 1.00 37.72 O HETATM 1223 O HOH 12 -1.702 -22.240 2.847 1.00 41.42 O HETATM 1224 O HOH 13 2.091 -1.204 -7.691 1.00 23.70 O HETATM 1225 O HOH 14 -8.286 -16.386 -12.308 1.00 40.62 O HETATM 1226 O HOH 15 12.260 -7.960 24.189 1.00 34.62 O HETATM 1227 O HOH 16 3.666 -7.352 10.491 1.00 20.45 O HETATM 1228 O HOH 17 -3.487 -21.218 -3.060 1.00 28.73 O HETATM 1229 O HOH 18 1.662 -18.464 4.814 1.00 23.95 O HETATM 1230 O HOH 19 -22.428 -14.577 12.968 1.00 33.25 O HETATM 1231 O HOH 20 -7.444 -8.976 2.332 1.00 8.95 O HETATM 1232 O HOH 21 11.485 -13.477 13.417 1.00 25.44 O HETATM 1233 O HOH 22 -5.632 -21.595 9.164 1.00 14.30 O HETATM 1234 O HOH 23 -2.405 -21.008 25.937 1.00 23.62 O HETATM 1235 O HOH 24 13.412 -20.642 25.763 1.00 16.94 O HETATM 1236 O HOH 25 11.991 -10.643 14.348 1.00 33.54 O HETATM 1237 O HOH 26 9.524 -19.702 30.590 1.00 35.58 O HETATM 1238 O HOH 27 -19.988 -15.951 14.547 1.00 32.09 O HETATM 1239 O HOH 28 4.536 -10.153 2.547 1.00 31.77 O HETATM 1240 O HOH 29 10.734 -21.449 28.815 1.00 19.53 O HETATM 1241 O HOH 30 -8.270 -12.607 26.005 1.00 28.21 O HETATM 1242 O HOH 31 0.097 -20.045 5.497 1.00 22.14 O HETATM 1243 O HOH 32 -15.343 -23.305 12.445 1.00 30.67 O HETATM 1244 O HOH 33 10.831 -14.620 10.725 1.00 42.24 O HETATM 1245 O HOH 34 11.373 -22.510 14.468 1.00 34.57 O HETATM 1246 O HOH 35 -15.148 -8.793 -1.404 1.00 12.64 O HETATM 1247 O HOH 36 -15.760 -23.593 18.467 1.00 40.86 O HETATM 1248 O HOH 37 -16.770 -22.054 16.211 1.00 34.25 O HETATM 1249 O HOH 38 -3.671 -15.640 27.292 1.00 22.79 O HETATM 1250 O HOH 39 -19.645 -6.605 10.977 1.00 25.88 O HETATM 1251 O HOH 40 -19.636 -2.324 6.406 1.00 12.52 O HETATM 1252 O HOH 41 11.522 -0.031 28.838 1.00 39.35 O HETATM 1253 O HOH 42 6.731 -10.698 12.048 1.00 23.93 O HETATM 1254 O HOH 43 14.512 -19.237 21.834 1.00 41.38 O HETATM 1255 O HOH 44 -5.365 -21.382 22.067 1.00 17.75 O HETATM 1256 O HOH 45 -6.389 -12.468 5.465 1.00 9.69 O HETATM 1257 O HOH 46 -1.452 -14.118 3.842 1.00 11.26 O HETATM 1258 O HOH 47 -3.279 -21.134 -7.338 1.00 22.19 O HETATM 1259 O HOH 48 7.251 -16.381 18.499 1.00 18.04 O HETATM 1260 O HOH 49 15.915 -9.607 14.839 1.00 42.15 O HETATM 1261 O HOH 50 -4.008 -10.225 3.300 1.00 10.29 O HETATM 1262 O HOH 51 2.991 -16.831 28.652 1.00 22.17 O HETATM 1263 O HOH 52 1.031 -24.993 29.553 1.00 12.91 O HETATM 1264 O HOH 53 -7.100 -14.514 3.841 1.00 9.60 O HETATM 1265 O HOH 54 -20.086 -5.333 -2.133 1.00 12.18 O HETATM 1266 O HOH 55 -2.776 0.000 -1.815 1.00 14.74 O HETATM 1267 O HOH 56 3.632 -22.665 24.617 1.00 19.23 O HETATM 1268 O HOH 57 -2.106 -17.736 -7.491 1.00 18.23 O HETATM 1269 O HOH 58 4.878 -10.105 8.957 1.00 15.37 O HETATM 1270 O HOH 59 2.069 -24.283 12.355 1.00 15.20 O HETATM 1271 O HOH 60 -5.288 -8.756 32.197 1.00 31.93 O HETATM 1272 O HOH 61 -24.124 -5.155 2.216 1.00 14.86 O HETATM 1273 O HOH 62 -3.386 -19.419 -0.793 1.00 20.62 O HETATM 1274 O HOH 63 -10.098 -2.762 -4.088 1.00 22.76 O HETATM 1275 O HOH 64 11.947 -15.197 17.400 1.00 33.30 O HETATM 1276 O HOH 65 5.405 -17.838 19.696 1.00 14.38 O HETATM 1277 O HOH 66 8.750 -13.362 29.807 1.00 45.17 O HETATM 1278 O HOH 67 -2.010 -26.114 13.220 1.00 12.72 O HETATM 1279 O HOH 68 10.770 -15.503 31.073 1.00 30.77 O HETATM 1280 O HOH 69 10.094 -1.549 37.109 1.00 34.62 O HETATM 1281 O HOH 70 -20.779 -10.694 11.837 1.00 38.01 O HETATM 1282 O HOH 71 -11.538 1.151 19.974 1.00 37.32 O HETATM 1283 O HOH 72 -0.964 -22.545 9.965 1.00 19.83 O HETATM 1284 O HOH 73 -2.263 -13.457 -0.102 1.00 10.20 O HETATM 1285 O HOH 74 1.466 -3.139 4.253 1.00 14.26 O HETATM 1286 O HOH 75 -6.501 -9.825 4.797 1.00 8.08 O HETATM 1287 O HOH 76 1.417 -23.043 23.661 1.00 23.88 O HETATM 1288 O HOH 77 2.991 -1.766 10.544 1.00 16.16 O HETATM 1289 O HOH 78 -0.448 -4.547 2.780 1.00 9.23 O HETATM 1290 O HOH 79 -3.709 -3.641 26.747 1.00 34.14 O HETATM 1291 O HOH 80 -14.103 -14.493 -5.611 1.00 33.16 O HETATM 1292 O HOH 81 15.812 -1.166 34.240 1.00 28.08 O HETATM 1293 O HOH 82 -7.794 0.832 10.780 1.00 21.48 O HETATM 1294 O HOH 83 -8.196 -16.819 1.756 1.00 17.79 O HETATM 1295 O HOH 84 -22.998 -1.616 4.036 1.00 18.74 O HETATM 1296 O HOH 85 10.031 -7.185 13.029 1.00 35.98 O HETATM 1297 O HOH 86 -3.009 -10.091 -7.525 1.00 12.45 O HETATM 1298 O HOH 87 4.951 -8.941 -0.632 1.00 13.02 O HETATM 1299 O HOH 88 10.158 -14.620 21.468 1.00 24.55 O HETATM 1300 O HOH 89 5.113 -8.428 12.599 1.00 18.65 O HETATM 1301 O HOH 90 4.812 -10.205 6.321 1.00 25.61 O HETATM 1302 O HOH 91 1.920 -2.928 -5.204 1.00 15.39 O HETATM 1303 O HOH 92 10.555 -21.098 19.373 1.00 23.02 O HETATM 1304 O HOH 93 -1.660 -7.340 -9.316 1.00 28.88 O HETATM 1305 O HOH 94 1.748 -3.789 9.106 1.00 13.70 O HETATM 1306 O HOH 95 5.716 -17.291 6.495 1.00 31.57 O HETATM 1307 O HOH 96 -13.924 -4.365 20.673 1.00 26.54 O HETATM 1308 O HOH 97 -0.550 -0.114 -3.972 1.00 35.30 O HETATM 1309 O HOH 98 11.828 -10.825 23.639 1.00 32.35 O HETATM 1310 O HOH 99 -22.444 -17.381 13.337 1.00 27.29 O HETATM 1311 O HOH 100 12.169 -14.137 29.454 1.00 26.29 O HETATM 1312 O HOH 101 -12.888 -9.499 -9.864 1.00 40.94 O HETATM 1313 O HOH 102 4.300 1.172 -5.186 1.00 31.01 O HETATM 1314 O HOH 103 -11.762 -21.141 5.171 1.00 21.88 O HETATM 1315 O HOH 104 -20.191 -0.699 -2.605 1.00 29.89 O HETATM 1316 O HOH 105 -18.337 -3.291 8.727 1.00 11.84 O HETATM 1317 O HOH 106 -13.196 -5.271 -3.737 1.00 15.68 O HETATM 1318 O HOH 107 -13.675 -21.755 3.244 1.00 23.71 O HETATM 1319 O HOH 108 -7.717 -23.624 6.465 1.00 45.09 O HETATM 1320 O HOH 109 -8.270 0.420 -1.645 1.00 38.11 O HETATM 1321 O HOH 110 12.261 -19.013 18.355 1.00 37.35 O HETATM 1322 O HOH 111 -19.176 -18.452 15.381 1.00 24.23 O HETATM 1323 O HOH 112 -22.013 -8.146 0.137 1.00 15.99 O HETATM 1324 O HOH 113 -14.401 -3.235 13.728 1.00 21.98 O HETATM 1325 O HOH 114 -4.943 -24.754 23.966 1.00 20.73 O HETATM 1326 O HOH 115 -6.322 -13.252 -10.712 1.00 24.65 O HETATM 1327 O HOH 116 -3.947 -3.523 19.429 1.00 13.77 O HETATM 1328 O HOH 117 -12.782 -7.473 -5.697 1.00 26.18 O HETATM 1329 O HOH 118 -4.953 -1.789 -8.709 1.00 34.86 O HETATM 1330 O HOH 119 -9.253 -18.578 3.687 1.00 13.45 O HETATM 1331 O HOH 120 -15.435 -6.184 -2.326 1.00 11.34 O HETATM 1332 O HOH 121 14.758 -17.850 31.894 1.00 30.00 O HETATM 1333 O HOH 122 5.167 -6.770 8.319 1.00 20.13 O HETATM 1334 O HOH 123 1.096 -23.539 8.126 1.00 28.15 O HETATM 1335 O HOH 124 -14.077 -25.312 10.739 1.00 44.55 O HETATM 1336 O HOH 125 -3.538 -13.177 2.437 1.00 9.99 O HETATM 1337 O HOH 126 2.824 -4.023 6.509 1.00 16.22 O HETATM 1338 O HOH 127 -14.609 -17.230 -5.343 1.00 27.50 O HETATM 1339 O HOH 128 -11.078 -6.139 27.076 1.00 32.67 O HETATM 1340 O HOH 129 5.687 -13.265 7.724 1.00 27.15 O HETATM 1341 O HOH 130 -11.829 -23.656 7.112 1.00 30.49 O HETATM 1342 O HOH 131 -16.001 0.786 -0.189 1.00 16.72 O HETATM 1343 O HOH 132 -22.940 -1.328 7.781 1.00 30.82 O HETATM 1344 O HOH 133 -22.079 -9.703 16.343 1.00 45.42 O HETATM 1345 O HOH 134 -8.014 -0.667 20.955 1.00 41.24 O HETATM 1346 O HOH 135 -22.096 -13.224 9.777 1.00 37.39 O HETATM 1347 O HOH 136 11.381 -5.052 18.203 1.00 36.63 O HETATM 1348 O HOH 137 -0.511 -23.038 25.965 1.00 25.86 O HETATM 1349 O HOH 138 14.493 -13.008 20.685 1.00 45.97 O HETATM 1350 O HOH 139 -3.086 -18.677 28.398 1.00 38.85 O HETATM 1351 O HOH 140 -2.354 -19.548 -2.378 1.00 29.11 O HETATM 1352 O HOH 141 5.668 -5.840 22.635 1.00 16.49 O HETATM 1353 O HOH 142 -21.688 -21.101 10.757 1.00 40.88 O HETATM 1354 O HOH 143 -5.829 -11.688 30.124 1.00 45.21 O HETATM 1355 O HOH 144 13.783 -21.548 28.598 1.00 23.74 O HETATM 1356 O HOH 145 -19.730 -9.597 -0.870 1.00 11.17 O HETATM 1357 O HOH 146 -3.355 -21.939 0.904 1.00 23.93 O HETATM 1358 O HOH 147 -19.006 0.075 -0.388 1.00 27.34 O HETATM 1359 O HOH 148 -17.049 -10.426 -0.068 1.00 10.68 O HETATM 1360 O HOH 149 -6.375 -2.850 20.533 1.00 21.47 O HETATM 1361 O HOH 150 -7.758 -14.509 -12.793 1.00 45.28 O HETATM 1362 O HOH 151 -3.083 -2.054 4.313 1.00 26.07 O HETATM 1363 O HOH 152 -3.010 -14.235 29.351 1.00 34.29 O HETATM 1364 O HOH 153 -3.428 -23.506 8.677 1.00 26.99 O HETATM 1365 O HOH 154 17.110 -11.368 15.080 1.00 40.63 O HETATM 1366 O HOH 155 -14.177 -3.255 -5.612 1.00 31.89 O HETATM 1367 O HOH 156 6.215 0.983 -4.075 1.00 35.58 O HETATM 1368 O HOH 157 -17.116 -17.764 20.064 1.00 46.22 O HETATM 1369 O HOH 158 14.125 -15.339 25.152 1.00 43.79 O HETATM 1370 O HOH 159 -12.603 -0.310 -1.211 1.00 28.42 O HETATM 1371 O HOH 160 -10.086 -13.567 -12.717 1.00 42.43 O HETATM 1372 O HOH 161 -3.593 -12.881 -10.944 1.00 26.80 O HETATM 1373 O HOH 162 13.555 -20.591 10.994 1.00 44.09 O HETATM 1374 O HOH 163 14.166 -18.150 24.386 1.00 27.21 O HETATM 1375 O HOH 164 -13.249 -3.719 23.367 1.00 41.27 O HETATM 1376 O HOH 165 12.274 -6.184 16.087 1.00 39.43 O HETATM 1377 O HOH 166 -1.582 -1.854 31.345 1.00 33.67 O HETATM 1378 O HOH 167 -7.633 -7.463 32.608 1.00 26.06 O HETATM 1379 O HOH 168 13.350 -15.201 14.276 1.00 35.77 O HETATM 1380 O HOH 169 12.692 -7.651 17.457 1.00 44.89 O HETATM 1381 O HOH 170 -20.423 0.224 7.071 1.00 33.64 O HETATM 1382 O HOH 171 -15.119 -13.669 -9.464 1.00 28.09 O HETATM 1383 O HOH 172 -7.657 -28.477 20.404 1.00 38.82 O HETATM 1384 O HOH 173 -1.668 -14.906 -8.137 1.00 16.25 O HETATM 1385 O HOH 174 -14.324 -24.681 6.922 1.00 39.80 O HETATM 1386 O HOH 175 8.171 -0.204 29.139 1.00 36.50 O HETATM 1387 O HOH 176 18.002 -0.244 36.309 1.00 31.93 O HETATM 1388 O HOH 177 0.894 -14.597 2.556 1.00 20.40 O HETATM 1389 O HOH 178 7.213 -10.225 5.380 1.00 28.60 O HETATM 1390 O HOH 179 -0.445 -24.784 11.335 1.00 23.03 O HETATM 1391 O HOH 180 4.718 -16.364 3.894 1.00 23.25 O HETATM 1392 O HOH 181 -6.024 -22.860 0.603 1.00 46.78 O HETATM 1393 O HOH 182 0.873 1.594 -4.933 1.00 42.79 O HETATM 1394 O HOH 183 -3.486 -23.777 -5.853 1.00 44.16 O HETATM 1395 O HOH 184 8.203 -13.094 7.660 1.00 45.65 O HETATM 1396 O HOH 185 -19.841 -3.912 10.556 1.00 31.38 O HETATM 1397 O HOH 186 -14.048 -10.139 -3.857 1.00 31.39 O HETATM 1398 O HOH 187 -3.241 -26.032 8.094 1.00 24.69 O HETATM 1399 O HOH 188 5.068 -19.007 31.478 1.00 26.47 O HETATM 1400 O HOH 189 -2.148 -18.860 -10.326 1.00 34.64 O HETATM 1401 O HOH 190 -14.575 -1.021 24.088 1.00 39.66 O HETATM 1402 O HOH 191 -8.041 -23.785 8.891 1.00 41.27 O HETATM 1403 O HOH 192 4.475 -13.335 5.213 1.00 38.88 O HETATM 1404 O HOH 193 -9.571 -20.921 2.359 1.00 26.75 O HETATM 1405 O HOH 194 -2.011 -12.536 -8.643 1.00 21.36 O HETATM 1406 O HOH 195 15.868 -3.339 32.843 1.00 45.16 O HETATM 1407 O HOH 196 0.946 -4.238 20.539 1.00 28.21 O HETATM 1408 O HOH 197 -22.292 -10.734 9.114 1.00 42.07 O HETATM 1409 O HOH 198 -18.694 -1.701 12.470 1.00 49.84 O HETATM 1410 O HOH 199 -4.281 -20.750 -9.932 1.00 36.95 O HETATM 1411 O HOH 200 -22.078 0.919 4.222 1.00 42.20 O HETATM 1412 O HOH 201 -1.989 -4.014 21.800 1.00 17.13 O HETATM 1413 O HOH 202 -9.695 -22.963 5.420 1.00 31.51 O HETATM 1414 O HOH 203 -22.135 -6.266 10.067 1.00 28.57 O HETATM 1415 O HOH 204 5.371 -21.236 32.898 1.00 25.86 O HETATM 1416 CAA YE A 5 -15.734 -14.796 -2.462 1.00 -0.04 C HETATM 1417 CAK YE A 5 -14.672 -13.777 -2.044 1.00 0.07 C HETATM 1418 OAP YE A 5 -13.749 -14.446 -1.176 1.00 -0.31 O HETATM 1419 CAU YE A 5 -12.827 -13.676 -0.539 1.00 0.11 C HETATM 1420 CAH YE A 5 -12.594 -12.332 -0.855 1.00 -0.02 C HETATM 1421 CAG YE A 5 -11.632 -11.604 -0.154 1.00 -0.05 C HETATM 1422 CAR YE A 5 -10.894 -12.208 0.865 1.00 0.02 C HETATM 1423 CAJ YE A 5 -11.147 -13.561 1.142 1.00 -0.04 C HETATM 1424 CAV YE A 5 -12.105 -14.327 0.458 1.00 0.02 C HETATM 1425 CAS YE A 5 -12.289 -15.693 0.817 1.00 -0.02 C HETATM 1426 CAE YE A 5 -11.207 -16.578 0.704 1.00 -0.05 C HETATM 1427 CAD YE A 5 -11.327 -17.910 1.094 1.00 -0.06 C HETATM 1428 CAF YE A 5 -12.537 -18.370 1.602 1.00 -0.05 C HETATM 1429 CAT YE A 5 -13.648 -17.535 1.729 1.00 0.04 C HETATM 1430 CAI YE A 5 -13.503 -16.191 1.332 1.00 -0.04 C HETATM 1431 H12 YE A 5 -14.350 -15.520 1.425 1.00 0.07 H HETATM 1432 CAW YE A 5 -14.792 -18.048 2.270 1.00 0.19 C HETATM 1433 NAM YE A 5 -15.828 -17.365 2.759 1.00 -0.15 N HETATM 1434 NAL YE A 5 -16.696 -18.250 3.223 1.00 -0.06 N HETATM 1435 NAO YE A 5 -16.221 -19.417 3.052 1.00 -0.14 N HETATM 1436 NAN YE A 5 -15.061 -19.336 2.483 1.00 -0.21 N HETATM 1437 H16 YE A 5 -15.933 -16.340 2.773 1.00 0.27 H HETATM 1438 H9 YE A 5 -12.620 -19.407 1.908 1.00 0.06 H HETATM 1439 H7 YE A 5 -10.483 -18.584 1.002 1.00 0.06 H HETATM 1440 H8 YE A 5 -10.264 -16.220 0.307 1.00 0.06 H HETATM 1441 H13 YE A 5 -10.572 -14.040 1.926 1.00 0.07 H HETATM 1442 CAQ YE A 5 -9.961 -11.438 1.595 1.00 0.12 C HETATM 1443 CAB YE A 5 -9.379 -12.015 2.887 1.00 0.01 C HETATM 1444 H4 YE A 5 -8.675 -11.293 3.326 1.00 0.04 H HETATM 1445 H5 YE A 5 -8.850 -12.954 2.664 1.00 0.04 H HETATM 1446 H6 YE A 5 -10.193 -12.213 3.599 1.00 0.04 H HETATM 1447 OAC YE A 5 -9.728 -10.254 1.328 1.00 -0.38 O HETATM 1448 H10 YE A 5 -11.457 -10.563 -0.402 1.00 0.06 H HETATM 1449 H11 YE A 5 -13.162 -11.856 -1.646 1.00 0.06 H HETATM 1450 H14 YE A 5 -15.145 -12.938 -1.513 1.00 0.06 H HETATM 1451 H15 YE A 5 -14.145 -13.399 -2.932 1.00 0.06 H HETATM 1452 H1 YE A 5 -16.461 -14.314 -3.131 1.00 0.03 H HETATM 1453 H2 YE A 5 -16.252 -15.173 -1.568 1.00 0.03 H HETATM 1454 H3 YE A 5 -15.252 -15.634 -2.987 1.00 0.03 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 1416 1417 1452 1453 1454 CONECT 1417 1416 1418 1450 1451 CONECT 1418 1417 1419 CONECT 1419 1418 1420 1424 CONECT 1420 1419 1421 1449 CONECT 1421 1420 1422 1448 CONECT 1422 1421 1423 1442 CONECT 1423 1422 1424 1441 CONECT 1424 1419 1423 1425 CONECT 1425 1424 1426 1430 CONECT 1426 1425 1427 1440 CONECT 1427 1426 1428 1439 CONECT 1428 1427 1429 1438 CONECT 1429 1428 1430 1432 CONECT 1430 1425 1429 1431 CONECT 1431 1430 CONECT 1432 1429 1433 1436 CONECT 1433 1432 1434 1437 CONECT 1434 1433 1435 CONECT 1435 1434 1436 CONECT 1436 1432 1435 CONECT 1437 1433 CONECT 1438 1428 CONECT 1439 1427 CONECT 1440 1426 CONECT 1441 1423 CONECT 1442 1422 1443 1447 CONECT 1443 1442 1444 1445 1446 CONECT 1444 1443 CONECT 1445 1443 CONECT 1446 1443 CONECT 1447 1442 CONECT 1448 1421 CONECT 1449 1420 CONECT 1450 1417 CONECT 1451 1417 CONECT 1452 1416 CONECT 1453 1416 CONECT 1454 1416 MASTER 0 0 0 0 0 0 0 0 1453 1 43 10 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 5mpn
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%
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%
6fqo
RCSB PDB
PDBbind
119aa, >6FQO_1|Chains... at 98%
6fqu
RCSB PDB
PDBbind
119aa, >6FQU_1|Chain... at 98%
6fr0
RCSB PDB
PDBbind
119aa, >6FR0_1|Chains... at 98%
6frf
RCSB PDB
PDBbind
119aa, >6FRF_1|Chains... at 98%
6alc
RCSB PDB
PDBbind
114aa, >6ALC_1|Chains... at 97%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5mpn
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
CREB-binding protein
Ligand Name
YE5
EC.Number
E.C.2.3.1.48
Resolution
1.23(Å)
Affinity (Kd/Ki/IC50)
Kd=0.085uM
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
1
7
H
1
6
N
4
O
2
Molecular Weight
308.335
Exact Mass
308.127
No. of atoms
39
No. of bonds
41
Polar Surface Area
80.76
LOGP Value
2.86 (
Computed with XLOGP3
)
3.14 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 6
No. of Rings: 3
Canonical SMILES
CCOc1ccc(cc1c1cccc(c1)c1nnn[nH]1)C(=O)C
InChI String
InChI=1S/C17H16N4O2/c1-3-23-16-8-7-12(11(2)22)10-15(16)13-5-4-6-14(9-13)17-18-20-21-19-17/h4-10H,3H2,1-2H3,(H,18,19,20,21)
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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