Browse entries in the PDBbind-CN Database
HEADER 5LPJ_COMPLEX COMPND 5LPJ_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 116 LYS LYS ILE PHE LYS PRO GLU GLU LEU ARG GLN ALA LEU SEQRES 2 A 116 MET PRO THR LEU GLU ALA LEU TYR ARG GLN ASP PRO GLU SEQRES 3 A 116 SER LEU PRO PHE ARG GLN PRO VAL ASP PRO GLN LEU LEU SEQRES 4 A 116 GLY ILE PRO ASP TYR PHE ASP ILE VAL LYS ASN PRO MET SEQRES 5 A 116 ASP LEU SER THR ILE LYS ARG LYS LEU ASP THR GLY GLN SEQRES 6 A 116 TYR GLN GLU PRO TRP GLN TYR VAL ASP ASP VAL TRP LEU SEQRES 7 A 116 MET PHE ASN ASN ALA TRP LEU TYR ASN ARG LYS THR SER SEQRES 8 A 116 ARG VAL TYR LYS PHE CYS SER LYS LEU ALA GLU VAL PHE SEQRES 9 A 116 GLU GLN GLU ILE ASP PRO VAL MET GLN SER LEU GLY HET XDM A 328 41 ATOM 1 N LYS A1082 0.952 48.129 20.595 1.00 59.15 N ATOM 2 CA LYS A1082 -0.151 48.966 20.138 1.00 56.41 C ATOM 3 C LYS A1082 -1.277 48.987 21.165 1.00 54.78 C ATOM 4 O LYS A1082 -1.396 48.078 21.987 1.00 52.99 O ATOM 5 CB LYS A1082 -0.678 48.474 18.788 1.00 56.61 C ATOM 6 HN3 LYS A1082 0.611 47.157 20.739 1.00 0.00 H ATOM 7 HN2 LYS A1082 1.322 48.505 21.491 1.00 0.00 H ATOM 8 HN1 LYS A1082 1.706 48.130 19.879 1.00 0.00 H ATOM 9 N LYS A1083 -2.099 50.032 21.117 1.00 53.32 N ATOM 10 CA LYS A1083 -3.235 50.131 22.022 1.00 47.45 C ATOM 11 C LYS A1083 -4.266 49.061 21.686 1.00 45.44 C ATOM 12 O LYS A1083 -4.702 48.942 20.537 1.00 46.35 O ATOM 13 CB LYS A1083 -3.871 51.518 21.934 1.00 47.10 C ATOM 14 CG LYS A1083 -5.031 51.719 22.897 1.00 47.21 C ATOM 15 CD LYS A1083 -5.772 53.018 22.629 1.00 46.49 C ATOM 16 CE LYS A1083 -6.787 53.300 23.725 1.00 52.22 C ATOM 17 NZ LYS A1083 -7.615 52.099 24.037 1.00 54.59 N ATOM 18 HZ1 LYS A1083 -8.130 51.803 23.183 1.00 0.00 H ATOM 19 HZ2 LYS A1083 -6.996 51.326 24.356 1.00 0.00 H ATOM 20 HZ3 LYS A1083 -8.294 52.333 24.789 1.00 0.00 H ATOM 21 H LYS A1083 -1.928 50.788 20.424 1.00 0.00 H ATOM 22 N ILE A1084 -4.651 48.277 22.685 1.00 48.15 N ATOM 23 CA ILE A1084 -5.688 47.268 22.518 1.00 40.55 C ATOM 24 C ILE A1084 -7.024 47.879 22.915 1.00 37.52 C ATOM 25 O ILE A1084 -7.129 48.554 23.946 1.00 37.64 O ATOM 26 CB ILE A1084 -5.379 46.014 23.351 1.00 43.66 C ATOM 27 CG1 ILE A1084 -4.004 45.461 22.982 1.00 47.25 C ATOM 28 CG2 ILE A1084 -6.444 44.954 23.129 1.00 42.76 C ATOM 29 CD1 ILE A1084 -3.628 44.212 23.742 1.00 53.71 C ATOM 30 H ILE A1084 -4.199 48.386 23.615 1.00 0.00 H ATOM 31 N PHE A1085 -8.041 47.658 22.090 1.00 31.12 N ATOM 32 CA PHE A1085 -9.390 48.128 22.364 1.00 30.36 C ATOM 33 C PHE A1085 -10.253 46.952 22.796 1.00 32.78 C ATOM 34 O PHE A1085 -10.289 45.921 22.116 1.00 42.97 O ATOM 35 CB PHE A1085 -9.997 48.809 21.137 1.00 27.47 C ATOM 36 CG PHE A1085 -9.304 50.081 20.749 1.00 27.71 C ATOM 37 CD1 PHE A1085 -9.703 51.294 21.285 1.00 30.29 C ATOM 38 CD2 PHE A1085 -8.251 50.066 19.851 1.00 29.95 C ATOM 39 CE1 PHE A1085 -9.066 52.467 20.930 1.00 29.38 C ATOM 40 CE2 PHE A1085 -7.610 51.234 19.494 1.00 31.63 C ATOM 41 CZ PHE A1085 -8.019 52.437 20.034 1.00 32.26 C ATOM 42 H PHE A1085 -7.866 47.128 21.213 1.00 0.00 H ATOM 43 N LYS A1086 -10.942 47.110 23.920 1.00 26.94 N ATOM 44 CA LYS A1086 -11.843 46.071 24.383 1.00 29.05 C ATOM 45 C LYS A1086 -13.143 46.115 23.585 1.00 30.40 C ATOM 46 O LYS A1086 -13.579 47.188 23.158 1.00 31.35 O ATOM 47 CB LYS A1086 -12.135 46.238 25.873 1.00 33.12 C ATOM 48 CG LYS A1086 -10.920 46.038 26.765 1.00 33.91 C ATOM 49 CD LYS A1086 -11.259 46.267 28.231 1.00 38.68 C ATOM 50 CE LYS A1086 -10.048 46.044 29.127 1.00 48.55 C ATOM 51 NZ LYS A1086 -8.953 47.007 28.826 1.00 52.22 N ATOM 52 HZ1 LYS A1086 -8.654 46.892 27.837 1.00 0.00 H ATOM 53 HZ2 LYS A1086 -9.296 47.978 28.975 1.00 0.00 H ATOM 54 HZ3 LYS A1086 -8.147 46.822 29.457 1.00 0.00 H ATOM 55 H LYS A1086 -10.835 47.985 24.472 1.00 0.00 H ATOM 56 N PRO A1087 -13.767 44.955 23.355 1.00 31.47 N ATOM 57 CA PRO A1087 -14.985 44.938 22.526 1.00 32.22 C ATOM 58 C PRO A1087 -16.064 45.876 23.029 1.00 25.97 C ATOM 59 O PRO A1087 -16.671 46.602 22.227 1.00 24.66 O ATOM 60 CB PRO A1087 -15.427 43.469 22.593 1.00 37.15 C ATOM 61 CG PRO A1087 -14.178 42.713 22.902 1.00 35.05 C ATOM 62 CD PRO A1087 -13.376 43.608 23.800 1.00 34.21 C ATOM 63 N GLU A1088 -16.303 45.896 24.346 1.00 27.71 N ATOM 64 CA GLU A1088 -17.314 46.786 24.907 1.00 29.54 C ATOM 65 C GLU A1088 -16.881 48.242 24.823 1.00 26.72 C ATOM 66 O GLU A1088 -17.726 49.135 24.685 1.00 24.68 O ATOM 67 CB GLU A1088 -17.612 46.396 26.356 1.00 28.16 C ATOM 68 CG GLU A1088 -18.800 47.119 26.972 1.00 24.90 C ATOM 69 CD GLU A1088 -20.093 46.876 26.209 1.00 27.05 C ATOM 70 OE1 GLU A1088 -20.102 46.020 25.300 1.00 27.12 O ATOM 71 OE2 GLU A1088 -21.102 47.548 26.512 1.00 28.23 O ATOM 72 H GLU A1088 -15.762 45.270 24.976 1.00 0.00 H ATOM 73 N GLU A1089 -15.574 48.497 24.910 1.00 24.60 N ATOM 74 CA GLU A1089 -15.059 49.848 24.707 1.00 27.77 C ATOM 75 C GLU A1089 -15.415 50.367 23.320 1.00 23.17 C ATOM 76 O GLU A1089 -15.905 51.493 23.168 1.00 22.91 O ATOM 77 CB GLU A1089 -13.545 49.852 24.918 1.00 31.72 C ATOM 78 CG GLU A1089 -12.872 51.179 24.633 1.00 34.61 C ATOM 79 CD GLU A1089 -11.369 51.114 24.819 1.00 41.12 C ATOM 80 OE1 GLU A1089 -10.710 52.164 24.670 1.00 45.81 O ATOM 81 OE2 GLU A1089 -10.850 50.016 25.117 1.00 42.80 O ATOM 82 H GLU A1089 -14.913 47.723 25.125 1.00 0.00 H ATOM 83 N LEU A1090 -15.173 49.556 22.288 1.00 22.33 N ATOM 84 CA LEU A1090 -15.531 49.964 20.936 1.00 21.68 C ATOM 85 C LEU A1090 -17.038 50.101 20.788 1.00 18.49 C ATOM 86 O LEU A1090 -17.524 51.019 20.121 1.00 20.76 O ATOM 87 CB LEU A1090 -14.983 48.962 19.920 1.00 23.28 C ATOM 88 CG LEU A1090 -13.461 48.909 19.844 1.00 28.41 C ATOM 89 CD1 LEU A1090 -13.008 47.824 18.877 1.00 33.27 C ATOM 90 CD2 LEU A1090 -12.923 50.277 19.436 1.00 26.69 C ATOM 91 H LEU A1090 -14.728 48.630 22.449 1.00 0.00 H ATOM 92 N ARG A1091 -17.796 49.199 21.412 1.00 18.46 N ATOM 93 CA ARG A1091 -19.247 49.229 21.277 1.00 20.77 C ATOM 94 C ARG A1091 -19.829 50.494 21.901 1.00 21.13 C ATOM 95 O ARG A1091 -20.654 51.180 21.289 1.00 22.99 O ATOM 96 CB ARG A1091 -19.847 47.972 21.911 1.00 24.96 C ATOM 97 CG ARG A1091 -21.062 47.416 21.192 1.00 23.02 C ATOM 98 CD ARG A1091 -21.582 46.172 21.895 1.00 24.42 C ATOM 99 NE ARG A1091 -21.943 46.451 23.280 1.00 32.90 N ATOM 100 CZ ARG A1091 -23.137 46.885 23.669 1.00 35.65 C ATOM 101 NH1 ARG A1091 -23.377 47.111 24.957 1.00 29.77 N ATOM 102 NH2 ARG A1091 -24.090 47.094 22.771 1.00 41.92 N ATOM 103 HE ARG A1091 -21.219 46.300 24.011 1.00 0.00 H ATOM 104 HH12 ARG A1091 -24.312 47.451 25.260 1.00 0.00 H ATOM 105 HH11 ARG A1091 -22.630 46.948 25.662 1.00 0.00 H ATOM 106 HH22 ARG A1091 -25.025 47.434 23.074 1.00 0.00 H ATOM 107 HH21 ARG A1091 -23.903 46.918 21.763 1.00 0.00 H ATOM 108 H ARG A1091 -17.348 48.468 22.000 1.00 0.00 H ATOM 109 N GLN A1092 -19.394 50.829 23.119 1.00 21.73 N ATOM 110 CA GLN A1092 -19.905 52.023 23.786 1.00 18.49 C ATOM 111 C GLN A1092 -19.517 53.294 23.041 1.00 19.43 C ATOM 112 O GLN A1092 -20.299 54.251 22.975 1.00 18.24 O ATOM 113 CB GLN A1092 -19.385 52.075 25.221 1.00 19.91 C ATOM 114 CG GLN A1092 -19.996 51.025 26.123 1.00 21.27 C ATOM 115 CD GLN A1092 -21.449 51.307 26.404 1.00 27.88 C ATOM 116 OE1 GLN A1092 -21.858 52.466 26.493 1.00 26.50 O ATOM 117 NE2 GLN A1092 -22.247 50.253 26.530 1.00 25.83 N ATOM 118 HE22 GLN A1092 -21.857 49.293 26.447 1.00 0.00 H ATOM 119 HE21 GLN A1092 -23.262 50.388 26.711 1.00 0.00 H ATOM 120 H GLN A1092 -18.686 50.235 23.596 1.00 0.00 H ATOM 121 N ALA A1093 -18.309 53.327 22.482 1.00 19.20 N ATOM 122 CA ALA A1093 -17.842 54.525 21.796 1.00 19.53 C ATOM 123 C ALA A1093 -18.477 54.670 20.420 1.00 18.72 C ATOM 124 O ALA A1093 -18.871 55.775 20.030 1.00 21.09 O ATOM 125 CB ALA A1093 -16.319 54.499 21.669 1.00 16.92 C ATOM 126 H ALA A1093 -17.693 52.491 22.535 1.00 0.00 H ATOM 127 N LEU A1094 -18.592 53.573 19.674 1.00 15.58 N ATOM 128 CA LEU A1094 -18.955 53.660 18.265 1.00 14.42 C ATOM 129 C LEU A1094 -20.436 53.440 17.991 1.00 17.95 C ATOM 130 O LEU A1094 -20.938 53.949 16.984 1.00 20.86 O ATOM 131 CB LEU A1094 -18.133 52.657 17.449 1.00 14.70 C ATOM 132 CG LEU A1094 -16.609 52.787 17.521 1.00 15.70 C ATOM 133 CD1 LEU A1094 -15.949 51.606 16.817 1.00 18.79 C ATOM 134 CD2 LEU A1094 -16.137 54.093 16.916 1.00 14.74 C ATOM 135 H LEU A1094 -18.420 52.641 20.103 1.00 0.00 H ATOM 136 N MET A1095 -21.156 52.699 18.838 1.00 17.43 N ATOM 137 CA MET A1095 -22.569 52.462 18.548 1.00 22.09 C ATOM 138 C MET A1095 -23.372 53.758 18.475 1.00 21.08 C ATOM 139 O MET A1095 -24.275 53.845 17.621 1.00 20.60 O ATOM 140 CB MET A1095 -23.168 51.492 19.576 1.00 29.59 C ATOM 141 CG MET A1095 -24.507 50.884 19.146 1.00 30.95 C ATOM 142 SD MET A1095 -24.431 49.907 17.621 1.00 36.71 S ATOM 143 CE MET A1095 -23.628 48.417 18.215 1.00 44.95 C ATOM 144 H MET A1095 -20.718 52.297 19.691 1.00 0.00 H ATOM 145 N PRO A1096 -23.100 54.784 19.287 1.00 17.86 N ATOM 146 CA PRO A1096 -23.831 56.051 19.127 1.00 17.29 C ATOM 147 C PRO A1096 -23.637 56.697 17.768 1.00 17.23 C ATOM 148 O PRO A1096 -24.564 57.350 17.271 1.00 20.08 O ATOM 149 CB PRO A1096 -23.265 56.924 20.253 1.00 20.01 C ATOM 150 CG PRO A1096 -22.834 55.936 21.298 1.00 23.47 C ATOM 151 CD PRO A1096 -22.304 54.760 20.529 1.00 20.26 C ATOM 152 N THR A1097 -22.460 56.552 17.152 1.00 14.72 N ATOM 153 CA THR A1097 -22.282 57.097 15.808 1.00 14.93 C ATOM 154 C THR A1097 -23.085 56.301 14.789 1.00 16.05 C ATOM 155 O THR A1097 -23.600 56.873 13.819 1.00 16.74 O ATOM 156 CB THR A1097 -20.801 57.124 15.415 1.00 16.81 C ATOM 157 OG1 THR A1097 -20.332 55.792 15.178 1.00 16.64 O ATOM 158 CG2 THR A1097 -19.952 57.770 16.516 1.00 14.83 C ATOM 159 HG1 THR A1097 -20.441 55.254 16.002 1.00 0.00 H ATOM 160 H THR A1097 -21.678 56.056 17.625 1.00 0.00 H ATOM 161 N LEU A1098 -23.217 54.990 15.000 1.00 15.40 N ATOM 162 CA LEU A1098 -24.053 54.185 14.118 1.00 18.46 C ATOM 163 C LEU A1098 -25.527 54.526 14.302 1.00 17.62 C ATOM 164 O LEU A1098 -26.274 54.626 13.322 1.00 20.69 O ATOM 165 CB LEU A1098 -23.802 52.700 14.371 1.00 18.45 C ATOM 166 CG LEU A1098 -24.395 51.748 13.333 1.00 24.09 C ATOM 167 CD1 LEU A1098 -23.821 52.047 11.964 1.00 24.24 C ATOM 168 CD2 LEU A1098 -24.142 50.301 13.728 1.00 25.23 C ATOM 169 H LEU A1098 -22.722 54.541 15.797 1.00 0.00 H ATOM 170 N GLU A1099 -25.964 54.713 15.551 1.00 18.17 N ATOM 171 CA GLU A1099 -27.343 55.123 15.804 1.00 19.36 C ATOM 172 C GLU A1099 -27.648 56.470 15.160 1.00 19.17 C ATOM 173 O GLU A1099 -28.771 56.702 14.697 1.00 20.57 O ATOM 174 CB GLU A1099 -27.600 55.178 17.313 1.00 23.65 C ATOM 175 CG GLU A1099 -27.365 53.849 18.018 1.00 30.12 C ATOM 176 CD GLU A1099 -27.526 53.931 19.527 1.00 32.25 C ATOM 177 OE1 GLU A1099 -27.463 55.049 20.082 1.00 33.48 O ATOM 178 OE2 GLU A1099 -27.717 52.869 20.157 1.00 34.42 O ATOM 179 H GLU A1099 -25.316 54.565 16.351 1.00 0.00 H ATOM 180 N ALA A1100 -26.663 57.369 15.123 1.00 17.02 N ATOM 181 CA ALA A1100 -26.878 58.665 14.491 1.00 16.92 C ATOM 182 C ALA A1100 -27.201 58.502 13.013 1.00 18.35 C ATOM 183 O ALA A1100 -28.035 59.232 12.469 1.00 18.71 O ATOM 184 CB ALA A1100 -25.651 59.558 14.675 1.00 21.98 C ATOM 185 H ALA A1100 -25.740 57.145 15.546 1.00 0.00 H ATOM 186 N LEU A1101 -26.552 57.548 12.346 1.00 17.67 N ATOM 187 CA LEU A1101 -26.880 57.284 10.948 1.00 13.56 C ATOM 188 C LEU A1101 -28.284 56.701 10.823 1.00 16.90 C ATOM 189 O LEU A1101 -29.074 57.142 9.982 1.00 18.34 O ATOM 190 CB LEU A1101 -25.836 56.355 10.328 1.00 18.52 C ATOM 191 CG LEU A1101 -24.422 56.944 10.289 1.00 20.38 C ATOM 192 CD1 LEU A1101 -23.473 56.073 9.475 1.00 20.24 C ATOM 193 CD2 LEU A1101 -24.446 58.367 9.743 1.00 19.84 C ATOM 194 H LEU A1101 -25.812 56.992 12.821 1.00 0.00 H ATOM 195 N TYR A1102 -28.621 55.718 11.672 1.00 16.32 N ATOM 196 CA TYR A1102 -29.964 55.137 11.645 1.00 14.80 C ATOM 197 C TYR A1102 -31.046 56.183 11.879 1.00 17.26 C ATOM 198 O TYR A1102 -32.155 56.054 11.348 1.00 20.85 O ATOM 199 CB TYR A1102 -30.105 54.041 12.701 1.00 17.70 C ATOM 200 CG TYR A1102 -29.685 52.644 12.294 1.00 21.40 C ATOM 201 CD1 TYR A1102 -30.588 51.763 11.706 1.00 20.33 C ATOM 202 CD2 TYR A1102 -28.398 52.189 12.544 1.00 19.55 C ATOM 203 CE1 TYR A1102 -30.208 50.472 11.365 1.00 24.56 C ATOM 204 CE2 TYR A1102 -28.013 50.907 12.214 1.00 23.86 C ATOM 205 CZ TYR A1102 -28.917 50.052 11.625 1.00 22.10 C ATOM 206 OH TYR A1102 -28.518 48.774 11.298 1.00 23.72 O ATOM 207 HH TYR A1102 -29.276 48.288 10.886 1.00 0.00 H ATOM 208 H TYR A1102 -27.921 55.366 12.356 1.00 0.00 H ATOM 209 N ARG A1103 -30.764 57.203 12.695 1.00 16.74 N ATOM 210 CA ARG A1103 -31.772 58.213 12.997 1.00 20.88 C ATOM 211 C ARG A1103 -32.134 59.057 11.785 1.00 20.13 C ATOM 212 O ARG A1103 -33.170 59.731 11.806 1.00 22.35 O ATOM 213 CB ARG A1103 -31.293 59.140 14.115 1.00 21.16 C ATOM 214 CG ARG A1103 -31.483 58.598 15.514 1.00 31.03 C ATOM 215 CD ARG A1103 -31.328 59.710 16.540 1.00 30.51 C ATOM 216 NE ARG A1103 -29.985 60.286 16.547 1.00 36.23 N ATOM 217 CZ ARG A1103 -28.975 59.802 17.263 1.00 32.87 C ATOM 218 NH1 ARG A1103 -27.785 60.385 17.223 1.00 31.69 N ATOM 219 NH2 ARG A1103 -29.158 58.729 18.018 1.00 36.82 N ATOM 220 HE ARG A1103 -29.809 61.124 15.957 1.00 0.00 H ATOM 221 HH12 ARG A1103 -26.999 60.001 17.786 1.00 0.00 H ATOM 222 HH11 ARG A1103 -27.638 61.226 16.629 1.00 0.00 H ATOM 223 HH22 ARG A1103 -28.370 58.348 18.579 1.00 0.00 H ATOM 224 HH21 ARG A1103 -30.090 58.268 18.049 1.00 0.00 H ATOM 225 H ARG A1103 -29.817 57.277 13.119 1.00 0.00 H ATOM 226 N GLN A1104 -31.304 59.057 10.749 1.00 17.90 N ATOM 227 CA GLN A1104 -31.556 59.911 9.597 1.00 15.53 C ATOM 228 C GLN A1104 -32.704 59.341 8.774 1.00 20.48 C ATOM 229 O GLN A1104 -32.629 58.211 8.278 1.00 19.07 O ATOM 230 CB GLN A1104 -30.293 60.052 8.750 1.00 19.47 C ATOM 231 CG GLN A1104 -29.077 60.556 9.531 1.00 22.77 C ATOM 232 CD GLN A1104 -29.340 61.854 10.276 1.00 23.72 C ATOM 233 OE1 GLN A1104 -29.894 62.805 9.726 1.00 23.31 O ATOM 234 NE2 GLN A1104 -28.943 61.896 11.542 1.00 22.49 N ATOM 235 HE22 GLN A1104 -28.478 61.069 11.969 1.00 0.00 H ATOM 236 HE21 GLN A1104 -29.097 62.756 12.107 1.00 0.00 H ATOM 237 H GLN A1104 -30.466 58.441 10.760 1.00 0.00 H ATOM 238 N ASP A1105 -33.767 60.121 8.648 1.00 17.01 N ATOM 239 CA ASP A1105 -34.920 59.768 7.842 1.00 19.28 C ATOM 240 C ASP A1105 -35.197 61.003 7.004 1.00 18.57 C ATOM 241 O ASP A1105 -35.345 62.095 7.551 1.00 18.65 O ATOM 242 CB ASP A1105 -36.110 59.388 8.729 1.00 21.45 C ATOM 243 CG ASP A1105 -37.276 58.795 7.950 1.00 28.94 C ATOM 244 OD1 ASP A1105 -37.600 59.284 6.842 1.00 26.88 O ATOM 245 OD2 ASP A1105 -37.894 57.839 8.472 1.00 28.43 O ATOM 246 H ASP A1105 -33.775 61.031 9.152 1.00 0.00 H ATOM 247 N PRO A1106 -35.280 60.844 5.677 1.00 18.16 N ATOM 248 CA PRO A1106 -35.341 59.594 4.911 1.00 17.15 C ATOM 249 C PRO A1106 -34.006 58.949 4.547 1.00 16.65 C ATOM 250 O PRO A1106 -34.017 57.882 3.928 1.00 17.82 O ATOM 251 CB PRO A1106 -36.048 60.033 3.629 1.00 18.47 C ATOM 252 CG PRO A1106 -35.531 61.423 3.414 1.00 16.03 C ATOM 253 CD PRO A1106 -35.393 62.025 4.802 1.00 19.22 C ATOM 254 N GLU A1107 -32.881 59.559 4.929 1.00 14.37 N ATOM 255 CA GLU A1107 -31.629 59.257 4.237 1.00 15.77 C ATOM 256 C GLU A1107 -31.054 57.885 4.591 1.00 16.25 C ATOM 257 O GLU A1107 -30.352 57.291 3.768 1.00 15.70 O ATOM 258 CB GLU A1107 -30.596 60.347 4.514 1.00 16.13 C ATOM 259 CG GLU A1107 -30.942 61.712 3.911 1.00 14.41 C ATOM 260 CD GLU A1107 -31.724 62.604 4.854 1.00 19.98 C ATOM 261 OE1 GLU A1107 -32.152 62.130 5.931 1.00 17.81 O ATOM 262 OE2 GLU A1107 -31.911 63.793 4.516 1.00 21.87 O ATOM 263 H GLU A1107 -32.895 60.243 5.712 1.00 0.00 H ATOM 264 N SER A1108 -31.311 57.366 5.792 1.00 14.70 N ATOM 265 CA SER A1108 -30.710 56.080 6.142 1.00 12.36 C ATOM 266 C SER A1108 -31.496 54.886 5.612 1.00 15.60 C ATOM 267 O SER A1108 -30.954 53.777 5.582 1.00 15.43 O ATOM 268 CB SER A1108 -30.564 55.934 7.661 1.00 13.59 C ATOM 269 OG SER A1108 -31.818 55.665 8.264 1.00 15.02 O ATOM 270 HG SER A1108 -32.441 56.410 8.073 1.00 0.00 H ATOM 271 H SER A1108 -31.926 57.865 6.466 1.00 0.00 H ATOM 272 N LEU A1109 -32.748 55.082 5.201 1.00 15.96 N ATOM 273 CA LEU A1109 -33.614 53.953 4.866 1.00 19.33 C ATOM 274 C LEU A1109 -32.980 52.990 3.873 1.00 19.63 C ATOM 275 O LEU A1109 -32.999 51.775 4.126 1.00 16.70 O ATOM 276 CB LEU A1109 -34.957 54.481 4.345 1.00 21.36 C ATOM 277 CG LEU A1109 -35.978 54.915 5.403 1.00 30.83 C ATOM 278 CD1 LEU A1109 -36.526 53.708 6.140 1.00 37.45 C ATOM 279 CD2 LEU A1109 -35.363 55.903 6.384 1.00 30.98 C ATOM 280 H LEU A1109 -33.114 56.052 5.117 1.00 0.00 H ATOM 281 N PRO A1110 -32.401 53.439 2.757 1.00 17.38 N ATOM 282 CA PRO A1110 -31.805 52.491 1.801 1.00 15.81 C ATOM 283 C PRO A1110 -30.547 51.797 2.301 1.00 16.46 C ATOM 284 O PRO A1110 -30.020 50.932 1.590 1.00 16.12 O ATOM 285 CB PRO A1110 -31.483 53.376 0.581 1.00 21.21 C ATOM 286 CG PRO A1110 -32.233 54.648 0.797 1.00 22.81 C ATOM 287 CD PRO A1110 -32.373 54.824 2.264 1.00 20.50 C ATOM 288 N PHE A1111 -30.038 52.148 3.483 1.00 16.18 N ATOM 289 CA PHE A1111 -28.792 51.602 4.003 1.00 15.30 C ATOM 290 C PHE A1111 -28.993 50.704 5.210 1.00 13.99 C ATOM 291 O PHE A1111 -28.011 50.178 5.741 1.00 17.01 O ATOM 292 CB PHE A1111 -27.837 52.740 4.364 1.00 12.73 C ATOM 293 CG PHE A1111 -27.500 53.618 3.197 1.00 14.83 C ATOM 294 CD1 PHE A1111 -26.452 53.294 2.360 1.00 17.40 C ATOM 295 CD2 PHE A1111 -28.241 54.759 2.931 1.00 14.65 C ATOM 296 CE1 PHE A1111 -26.140 54.095 1.268 1.00 17.20 C ATOM 297 CE2 PHE A1111 -27.937 55.567 1.849 1.00 17.76 C ATOM 298 CZ PHE A1111 -26.882 55.232 1.018 1.00 17.83 C ATOM 299 H PHE A1111 -30.554 52.843 4.059 1.00 0.00 H ATOM 300 N ARG A1112 -30.234 50.505 5.639 1.00 16.21 N ATOM 301 CA ARG A1112 -30.545 49.757 6.851 1.00 15.94 C ATOM 302 C ARG A1112 -30.521 48.245 6.650 1.00 21.07 C ATOM 303 O ARG A1112 -30.684 47.504 7.627 1.00 22.48 O ATOM 304 CB ARG A1112 -31.913 50.190 7.379 1.00 17.88 C ATOM 305 CG ARG A1112 -31.948 51.612 7.947 1.00 18.15 C ATOM 306 CD ARG A1112 -33.364 51.991 8.368 1.00 21.78 C ATOM 307 NE ARG A1112 -33.430 53.287 9.041 1.00 22.66 N ATOM 308 CZ ARG A1112 -34.545 53.809 9.542 1.00 25.44 C ATOM 309 NH1 ARG A1112 -35.688 53.146 9.442 1.00 28.33 N ATOM 310 NH2 ARG A1112 -34.521 54.992 10.145 1.00 24.11 N ATOM 311 HE ARG A1112 -32.550 53.834 9.133 1.00 0.00 H ATOM 312 HH12 ARG A1112 -36.561 53.553 9.833 1.00 0.00 H ATOM 313 HH11 ARG A1112 -35.712 52.219 8.972 1.00 0.00 H ATOM 314 HH22 ARG A1112 -35.397 55.395 10.535 1.00 0.00 H ATOM 315 HH21 ARG A1112 -33.626 55.516 10.227 1.00 0.00 H ATOM 316 H ARG A1112 -31.020 50.901 5.085 1.00 0.00 H ATOM 317 N GLN A1113 -30.327 47.774 5.424 1.00 19.90 N ATOM 318 CA GLN A1113 -30.330 46.353 5.113 1.00 17.14 C ATOM 319 C GLN A1113 -29.448 46.135 3.897 1.00 17.55 C ATOM 320 O GLN A1113 -29.232 47.062 3.109 1.00 18.22 O ATOM 321 CB GLN A1113 -31.748 45.835 4.838 1.00 21.10 C ATOM 322 CG GLN A1113 -32.442 46.539 3.670 1.00 22.42 C ATOM 323 CD GLN A1113 -32.897 47.943 4.024 1.00 24.14 C ATOM 324 OE1 GLN A1113 -33.553 48.152 5.048 1.00 28.76 O ATOM 325 NE2 GLN A1113 -32.546 48.916 3.184 1.00 20.88 N ATOM 326 HE22 GLN A1113 -31.992 48.693 2.332 1.00 0.00 H ATOM 327 HE21 GLN A1113 -32.826 49.898 3.380 1.00 0.00 H ATOM 328 H GLN A1113 -30.166 48.451 4.651 1.00 0.00 H ATOM 329 N PRO A1114 -28.915 44.930 3.718 1.00 19.46 N ATOM 330 CA PRO A1114 -28.085 44.676 2.537 1.00 17.19 C ATOM 331 C PRO A1114 -28.871 44.908 1.258 1.00 19.85 C ATOM 332 O PRO A1114 -30.057 44.583 1.165 1.00 21.38 O ATOM 333 CB PRO A1114 -27.684 43.207 2.692 1.00 20.40 C ATOM 334 CG PRO A1114 -27.761 42.964 4.168 1.00 19.21 C ATOM 335 CD PRO A1114 -28.948 43.769 4.623 1.00 22.42 C ATOM 336 N VAL A1115 -28.195 45.486 0.267 1.00 19.03 N ATOM 337 CA VAL A1115 -28.798 45.593 -1.054 1.00 18.55 C ATOM 338 C VAL A1115 -29.185 44.205 -1.538 1.00 20.83 C ATOM 339 O VAL A1115 -28.364 43.279 -1.555 1.00 21.18 O ATOM 340 CB VAL A1115 -27.838 46.277 -2.036 1.00 15.94 C ATOM 341 CG1 VAL A1115 -28.459 46.320 -3.426 1.00 19.15 C ATOM 342 CG2 VAL A1115 -27.500 47.686 -1.558 1.00 18.38 C ATOM 343 H VAL A1115 -27.239 45.860 0.436 1.00 0.00 H ATOM 344 N ASP A1116 -30.453 44.051 -1.922 1.00 21.96 N ATOM 345 CA ASP A1116 -30.954 42.838 -2.551 1.00 20.98 C ATOM 346 C ASP A1116 -31.140 43.121 -4.040 1.00 22.29 C ATOM 347 O ASP A1116 -32.188 43.652 -4.434 1.00 24.60 O ATOM 348 CB ASP A1116 -32.281 42.416 -1.913 1.00 21.43 C ATOM 349 CG ASP A1116 -32.783 41.072 -2.414 1.00 26.74 C ATOM 350 OD1 ASP A1116 -32.511 40.697 -3.578 1.00 29.21 O ATOM 351 OD2 ASP A1116 -33.470 40.385 -1.635 1.00 31.01 O ATOM 352 H ASP A1116 -31.116 44.836 -1.764 1.00 0.00 H ATOM 353 N PRO A1117 -30.172 42.787 -4.902 1.00 23.19 N ATOM 354 CA PRO A1117 -30.297 43.166 -6.323 1.00 22.84 C ATOM 355 C PRO A1117 -31.494 42.554 -7.019 1.00 28.57 C ATOM 356 O PRO A1117 -32.008 43.145 -7.977 1.00 24.88 O ATOM 357 CB PRO A1117 -28.982 42.661 -6.937 1.00 26.70 C ATOM 358 CG PRO A1117 -28.040 42.546 -5.778 1.00 27.41 C ATOM 359 CD PRO A1117 -28.896 42.108 -4.627 1.00 26.01 C ATOM 360 N GLN A1118 -31.953 41.383 -6.579 1.00 26.68 N ATOM 361 CA GLN A1118 -33.097 40.755 -7.232 1.00 30.93 C ATOM 362 C GLN A1118 -34.392 41.468 -6.863 1.00 30.73 C ATOM 363 O GLN A1118 -35.197 41.810 -7.736 1.00 27.73 O ATOM 364 CB GLN A1118 -33.162 39.275 -6.860 1.00 34.28 C ATOM 365 CG GLN A1118 -34.282 38.510 -7.528 1.00 42.77 C ATOM 366 CD GLN A1118 -34.251 37.034 -7.188 1.00 51.40 C ATOM 367 OE1 GLN A1118 -33.438 36.589 -6.376 1.00 53.16 O ATOM 368 NE2 GLN A1118 -35.136 36.263 -7.812 1.00 56.80 N ATOM 369 HE22 GLN A1118 -35.804 36.682 -8.490 1.00 0.00 H ATOM 370 HE21 GLN A1118 -35.160 35.241 -7.622 1.00 0.00 H ATOM 371 H GLN A1118 -31.496 40.916 -5.770 1.00 0.00 H ATOM 372 N LEU A1119 -34.601 41.713 -5.567 1.00 27.64 N ATOM 373 CA LEU A1119 -35.792 42.431 -5.126 1.00 30.44 C ATOM 374 C LEU A1119 -35.827 43.854 -5.669 1.00 29.25 C ATOM 375 O LEU A1119 -36.906 44.378 -5.969 1.00 29.27 O ATOM 376 CB LEU A1119 -35.853 42.449 -3.600 1.00 32.42 C ATOM 377 CG LEU A1119 -36.902 43.363 -2.967 1.00 39.16 C ATOM 378 CD1 LEU A1119 -38.292 42.765 -3.108 1.00 45.96 C ATOM 379 CD2 LEU A1119 -36.566 43.635 -1.504 1.00 41.26 C ATOM 380 H LEU A1119 -33.907 41.388 -4.864 1.00 0.00 H ATOM 381 N LEU A1120 -34.669 44.495 -5.798 1.00 22.11 N ATOM 382 CA LEU A1120 -34.596 45.878 -6.249 1.00 20.70 C ATOM 383 C LEU A1120 -34.491 46.010 -7.761 1.00 25.53 C ATOM 384 O LEU A1120 -34.425 47.136 -8.262 1.00 27.20 O ATOM 385 CB LEU A1120 -33.410 46.582 -5.589 1.00 20.61 C ATOM 386 CG LEU A1120 -33.486 46.696 -4.069 1.00 22.21 C ATOM 387 CD1 LEU A1120 -32.156 47.162 -3.516 1.00 21.26 C ATOM 388 CD2 LEU A1120 -34.603 47.650 -3.672 1.00 24.77 C ATOM 389 H LEU A1120 -33.787 43.993 -5.570 1.00 0.00 H ATOM 390 N GLY A1121 -34.472 44.900 -8.495 1.00 23.40 N ATOM 391 CA GLY A1121 -34.453 44.966 -9.945 1.00 28.38 C ATOM 392 C GLY A1121 -33.172 45.500 -10.540 1.00 27.10 C ATOM 393 O GLY A1121 -33.201 46.097 -11.622 1.00 28.12 O ATOM 394 H GLY A1121 -34.471 43.973 -8.023 1.00 0.00 H ATOM 395 N ILE A1122 -32.043 45.297 -9.869 1.00 21.81 N ATOM 396 CA ILE A1122 -30.758 45.790 -10.361 1.00 22.61 C ATOM 397 C ILE A1122 -29.770 44.630 -10.412 1.00 22.57 C ATOM 398 O ILE A1122 -28.796 44.605 -9.646 1.00 24.20 O ATOM 399 CB ILE A1122 -30.235 46.947 -9.497 1.00 20.19 C ATOM 400 CG1 ILE A1122 -30.359 46.611 -8.004 1.00 18.12 C ATOM 401 CG2 ILE A1122 -30.986 48.230 -9.827 1.00 21.59 C ATOM 402 CD1 ILE A1122 -29.614 47.582 -7.104 1.00 19.72 C ATOM 403 H ILE A1122 -32.075 44.774 -8.971 1.00 0.00 H ATOM 404 N PRO A1123 -29.961 43.673 -11.324 1.00 25.02 N ATOM 405 CA PRO A1123 -29.107 42.473 -11.336 1.00 24.49 C ATOM 406 C PRO A1123 -27.632 42.754 -11.586 1.00 25.87 C ATOM 407 O PRO A1123 -26.807 41.862 -11.354 1.00 29.88 O ATOM 408 CB PRO A1123 -29.711 41.624 -12.464 1.00 29.34 C ATOM 409 CG PRO A1123 -30.453 42.610 -13.329 1.00 31.17 C ATOM 410 CD PRO A1123 -30.979 43.649 -12.385 1.00 24.65 C ATOM 411 N ASP A1124 -27.269 43.948 -12.052 1.00 24.87 N ATOM 412 CA ASP A1124 -25.867 44.268 -12.289 1.00 22.29 C ATOM 413 C ASP A1124 -25.140 44.729 -11.033 1.00 20.97 C ATOM 414 O ASP A1124 -23.947 45.044 -11.112 1.00 24.61 O ATOM 415 CB ASP A1124 -25.744 45.344 -13.373 1.00 25.26 C ATOM 416 CG ASP A1124 -26.320 46.688 -12.945 1.00 24.83 C ATOM 417 OD1 ASP A1124 -26.953 46.771 -11.871 1.00 22.91 O ATOM 418 OD2 ASP A1124 -26.150 47.668 -13.702 1.00 28.16 O ATOM 419 H ASP A1124 -27.998 44.663 -12.250 1.00 0.00 H ATOM 420 N TYR A1125 -25.818 44.775 -9.885 1.00 20.92 N ATOM 421 CA TYR A1125 -25.223 45.405 -8.711 1.00 22.42 C ATOM 422 C TYR A1125 -23.931 44.707 -8.304 1.00 23.50 C ATOM 423 O TYR A1125 -22.895 45.355 -8.114 1.00 24.48 O ATOM 424 CB TYR A1125 -26.217 45.419 -7.547 1.00 21.43 C ATOM 425 CG TYR A1125 -25.658 46.096 -6.315 1.00 20.20 C ATOM 426 CD1 TYR A1125 -25.523 47.477 -6.261 1.00 21.98 C ATOM 427 CD2 TYR A1125 -25.254 45.355 -5.212 1.00 18.99 C ATOM 428 CE1 TYR A1125 -25.006 48.103 -5.142 1.00 16.42 C ATOM 429 CE2 TYR A1125 -24.735 45.972 -4.086 1.00 17.74 C ATOM 430 CZ TYR A1125 -24.613 47.346 -4.057 1.00 18.15 C ATOM 431 OH TYR A1125 -24.097 47.970 -2.940 1.00 18.25 O ATOM 432 HH TYR A1125 -24.081 48.949 -3.088 1.00 0.00 H ATOM 433 H TYR A1125 -26.771 44.362 -9.827 1.00 0.00 H ATOM 434 N PHE A1126 -23.972 43.380 -8.164 1.00 25.58 N ATOM 435 CA PHE A1126 -22.797 42.656 -7.692 1.00 28.40 C ATOM 436 C PHE A1126 -21.683 42.623 -8.728 1.00 31.22 C ATOM 437 O PHE A1126 -20.538 42.321 -8.376 1.00 32.25 O ATOM 438 CB PHE A1126 -23.185 41.237 -7.283 1.00 29.60 C ATOM 439 CG PHE A1126 -23.954 41.171 -5.996 1.00 28.70 C ATOM 440 CD1 PHE A1126 -23.737 42.106 -4.997 1.00 30.20 C ATOM 441 CD2 PHE A1126 -24.899 40.182 -5.787 1.00 29.20 C ATOM 442 CE1 PHE A1126 -24.441 42.048 -3.811 1.00 24.83 C ATOM 443 CE2 PHE A1126 -25.608 40.122 -4.607 1.00 28.00 C ATOM 444 CZ PHE A1126 -25.379 41.054 -3.616 1.00 24.84 C ATOM 445 H PHE A1126 -24.844 42.861 -8.392 1.00 0.00 H ATOM 446 N ASP A1127 -21.993 42.914 -9.995 1.00 29.64 N ATOM 447 CA ASP A1127 -20.951 43.080 -11.001 1.00 30.51 C ATOM 448 C ASP A1127 -20.155 44.358 -10.785 1.00 31.81 C ATOM 449 O ASP A1127 -19.006 44.448 -11.230 1.00 33.47 O ATOM 450 CB ASP A1127 -21.559 43.095 -12.404 1.00 33.04 C ATOM 451 CG ASP A1127 -22.259 41.801 -12.753 1.00 40.20 C ATOM 452 OD1 ASP A1127 -21.871 40.744 -12.212 1.00 37.93 O ATOM 453 OD2 ASP A1127 -23.200 41.842 -13.572 1.00 43.28 O ATOM 454 H ASP A1127 -22.991 43.023 -10.267 1.00 0.00 H ATOM 455 N ILE A1128 -20.746 45.343 -10.118 1.00 26.58 N ATOM 456 CA ILE A1128 -20.103 46.628 -9.884 1.00 23.30 C ATOM 457 C ILE A1128 -19.585 46.744 -8.457 1.00 21.78 C ATOM 458 O ILE A1128 -18.474 47.224 -8.236 1.00 21.60 O ATOM 459 CB ILE A1128 -21.085 47.773 -10.212 1.00 24.75 C ATOM 460 CG1 ILE A1128 -21.478 47.732 -11.692 1.00 27.00 C ATOM 461 CG2 ILE A1128 -20.487 49.121 -9.826 1.00 23.51 C ATOM 462 CD1 ILE A1128 -22.607 48.673 -12.050 1.00 30.44 C ATOM 463 H ILE A1128 -21.706 45.190 -9.748 1.00 0.00 H ATOM 464 N VAL A1129 -20.377 46.308 -7.487 1.00 17.61 N ATOM 465 CA VAL A1129 -20.018 46.398 -6.078 1.00 16.51 C ATOM 466 C VAL A1129 -19.545 45.022 -5.630 1.00 28.53 C ATOM 467 O VAL A1129 -20.351 44.103 -5.450 1.00 25.68 O ATOM 468 CB VAL A1129 -21.191 46.893 -5.225 1.00 20.90 C ATOM 469 CG1 VAL A1129 -20.816 46.840 -3.749 1.00 15.61 C ATOM 470 CG2 VAL A1129 -21.570 48.309 -5.624 1.00 21.82 C ATOM 471 H VAL A1129 -21.292 45.884 -7.743 1.00 0.00 H ATOM 472 N LYS A1130 -18.231 44.885 -5.443 1.00 24.16 N ATOM 473 CA LYS A1130 -17.624 43.604 -5.112 1.00 22.67 C ATOM 474 C LYS A1130 -17.646 43.289 -3.622 1.00 20.89 C ATOM 475 O LYS A1130 -17.586 42.109 -3.254 1.00 24.89 O ATOM 476 CB LYS A1130 -16.178 43.567 -5.612 1.00 25.75 C ATOM 477 CG LYS A1130 -16.063 43.631 -7.124 1.00 28.79 C ATOM 478 CD LYS A1130 -17.005 42.625 -7.761 1.00 33.70 C ATOM 479 CE LYS A1130 -16.863 42.584 -9.275 1.00 41.33 C ATOM 480 NZ LYS A1130 -17.741 41.529 -9.850 1.00 44.05 N ATOM 481 HZ1 LYS A1130 -17.471 40.604 -9.459 1.00 0.00 H ATOM 482 HZ2 LYS A1130 -18.731 41.734 -9.608 1.00 0.00 H ATOM 483 HZ3 LYS A1130 -17.632 41.515 -10.884 1.00 0.00 H ATOM 484 H LYS A1130 -17.620 45.721 -5.537 1.00 0.00 H ATOM 485 N ASN A1131 -17.715 44.302 -2.763 1.00 18.19 N ATOM 486 CA ASN A1131 -17.714 44.117 -1.311 1.00 20.01 C ATOM 487 C ASN A1131 -18.871 44.906 -0.720 1.00 19.09 C ATOM 488 O ASN A1131 -18.687 46.027 -0.228 1.00 17.72 O ATOM 489 CB ASN A1131 -16.381 44.545 -0.697 1.00 23.32 C ATOM 490 CG ASN A1131 -15.224 43.689 -1.168 1.00 28.84 C ATOM 491 OD1 ASN A1131 -15.100 42.530 -0.778 1.00 29.86 O ATOM 492 ND2 ASN A1131 -14.371 44.256 -2.012 1.00 31.07 N ATOM 493 HD22 ASN A1131 -14.516 45.240 -2.315 1.00 0.00 H ATOM 494 HD21 ASN A1131 -13.558 43.716 -2.370 1.00 0.00 H ATOM 495 H ASN A1131 -17.772 45.270 -3.140 1.00 0.00 H ATOM 496 N PRO A1132 -20.081 44.347 -0.746 1.00 19.63 N ATOM 497 CA PRO A1132 -21.239 45.076 -0.222 1.00 18.44 C ATOM 498 C PRO A1132 -21.099 45.350 1.267 1.00 19.61 C ATOM 499 O PRO A1132 -20.430 44.620 2.001 1.00 18.87 O ATOM 500 CB PRO A1132 -22.414 44.130 -0.508 1.00 21.32 C ATOM 501 CG PRO A1132 -21.921 43.219 -1.595 1.00 27.25 C ATOM 502 CD PRO A1132 -20.457 43.049 -1.329 1.00 25.99 C ATOM 503 N MET A1133 -21.741 46.427 1.707 1.00 16.09 N ATOM 504 CA MET A1133 -21.759 46.784 3.118 1.00 17.79 C ATOM 505 C MET A1133 -23.013 47.605 3.382 1.00 18.83 C ATOM 506 O MET A1133 -23.523 48.287 2.489 1.00 17.74 O ATOM 507 CB MET A1133 -20.485 47.549 3.506 1.00 15.14 C ATOM 508 CG MET A1133 -20.324 47.810 5.008 1.00 15.39 C ATOM 509 SD MET A1133 -20.462 46.328 6.042 1.00 19.19 S ATOM 510 CE MET A1133 -19.140 45.287 5.427 1.00 19.53 C ATOM 511 H MET A1133 -22.244 47.031 1.025 1.00 0.00 H ATOM 512 N ASP A1134 -23.521 47.510 4.609 1.00 16.14 N ATOM 513 CA ASP A1134 -24.729 48.233 4.990 1.00 12.31 C ATOM 514 C ASP A1134 -24.742 48.378 6.506 1.00 17.18 C ATOM 515 O ASP A1134 -23.939 47.766 7.213 1.00 16.92 O ATOM 516 CB ASP A1134 -25.992 47.515 4.513 1.00 12.24 C ATOM 517 CG ASP A1134 -26.353 46.338 5.394 1.00 18.63 C ATOM 518 OD1 ASP A1134 -25.640 45.315 5.332 1.00 19.66 O ATOM 519 OD2 ASP A1134 -27.348 46.440 6.143 1.00 21.12 O ATOM 520 H ASP A1134 -23.046 46.907 5.311 1.00 0.00 H ATOM 521 N LEU A1135 -25.695 49.176 6.996 1.00 16.01 N ATOM 522 CA LEU A1135 -25.734 49.496 8.421 1.00 13.40 C ATOM 523 C LEU A1135 -25.963 48.255 9.271 1.00 16.05 C ATOM 524 O LEU A1135 -25.381 48.123 10.354 1.00 18.85 O ATOM 525 CB LEU A1135 -26.822 50.529 8.703 1.00 16.71 C ATOM 526 CG LEU A1135 -26.628 51.915 8.104 1.00 16.35 C ATOM 527 CD1 LEU A1135 -27.853 52.775 8.392 1.00 17.55 C ATOM 528 CD2 LEU A1135 -25.355 52.557 8.649 1.00 13.75 C ATOM 529 H LEU A1135 -26.415 49.572 6.358 1.00 0.00 H ATOM 530 N SER A1136 -26.829 47.346 8.818 1.00 17.90 N ATOM 531 CA SER A1136 -27.138 46.174 9.636 1.00 18.64 C ATOM 532 C SER A1136 -25.940 45.241 9.759 1.00 21.29 C ATOM 533 O SER A1136 -25.763 44.592 10.797 1.00 19.67 O ATOM 534 CB SER A1136 -28.335 45.426 9.058 1.00 20.02 C ATOM 535 OG SER A1136 -27.978 44.729 7.874 1.00 22.57 O ATOM 536 HG SER A1136 -27.651 45.374 7.198 1.00 0.00 H ATOM 537 H SER A1136 -27.281 47.470 7.890 1.00 0.00 H ATOM 538 N THR A1137 -25.112 45.159 8.717 1.00 17.87 N ATOM 539 CA THR A1137 -23.909 44.340 8.797 1.00 17.30 C ATOM 540 C THR A1137 -22.889 44.967 9.736 1.00 19.36 C ATOM 541 O THR A1137 -22.257 44.268 10.538 1.00 22.09 O ATOM 542 CB THR A1137 -23.318 44.152 7.400 1.00 19.12 C ATOM 543 OG1 THR A1137 -24.282 43.491 6.571 1.00 19.79 O ATOM 544 CG2 THR A1137 -22.041 43.321 7.459 1.00 21.91 C ATOM 545 HG1 THR A1137 -24.503 42.609 6.962 1.00 0.00 H ATOM 546 H THR A1137 -25.325 45.682 7.844 1.00 0.00 H ATOM 547 N ILE A1138 -22.730 46.288 9.652 1.00 18.04 N ATOM 548 CA ILE A1138 -21.847 47.008 10.563 1.00 12.75 C ATOM 549 C ILE A1138 -22.321 46.838 11.998 1.00 15.47 C ATOM 550 O ILE A1138 -21.516 46.606 12.913 1.00 15.88 O ATOM 551 CB ILE A1138 -21.775 48.491 10.157 1.00 13.95 C ATOM 552 CG1 ILE A1138 -21.084 48.636 8.796 1.00 19.41 C ATOM 553 CG2 ILE A1138 -21.053 49.292 11.214 1.00 17.36 C ATOM 554 CD1 ILE A1138 -21.233 50.023 8.179 1.00 18.79 C ATOM 555 H ILE A1138 -23.247 46.817 8.921 1.00 0.00 H ATOM 556 N LYS A1139 -23.633 46.945 12.221 1.00 15.71 N ATOM 557 CA LYS A1139 -24.160 46.766 13.574 1.00 17.41 C ATOM 558 C LYS A1139 -23.856 45.369 14.097 1.00 20.51 C ATOM 559 O LYS A1139 -23.431 45.204 15.247 1.00 20.67 O ATOM 560 CB LYS A1139 -25.665 47.026 13.595 1.00 17.63 C ATOM 561 CG LYS A1139 -26.291 46.913 14.983 1.00 24.33 C ATOM 562 CD LYS A1139 -27.799 47.063 14.924 1.00 27.73 C ATOM 563 CE LYS A1139 -28.411 46.994 16.315 1.00 39.32 C ATOM 564 NZ LYS A1139 -27.993 45.765 17.051 1.00 47.29 N ATOM 565 HZ1 LYS A1139 -28.297 44.924 16.520 1.00 0.00 H ATOM 566 HZ2 LYS A1139 -26.958 45.757 17.151 1.00 0.00 H ATOM 567 HZ3 LYS A1139 -28.433 45.760 17.993 1.00 0.00 H ATOM 568 H LYS A1139 -24.279 47.155 11.434 1.00 0.00 H ATOM 569 N ARG A1140 -24.066 44.348 13.260 1.00 19.45 N ATOM 570 CA ARG A1140 -23.781 42.978 13.677 1.00 22.04 C ATOM 571 C ARG A1140 -22.299 42.790 13.963 1.00 18.37 C ATOM 572 O ARG A1140 -21.924 42.062 14.891 1.00 20.11 O ATOM 573 CB ARG A1140 -24.246 42.000 12.599 1.00 22.72 C ATOM 574 CG ARG A1140 -23.810 40.558 12.826 1.00 23.12 C ATOM 575 CD ARG A1140 -24.579 39.904 13.954 1.00 32.59 C ATOM 576 NE ARG A1140 -24.396 38.453 13.948 1.00 37.43 N ATOM 577 CZ ARG A1140 -24.856 37.633 14.887 1.00 39.62 C ATOM 578 NH1 ARG A1140 -25.528 38.114 15.924 1.00 42.86 N ATOM 579 NH2 ARG A1140 -24.637 36.329 14.789 1.00 43.86 N ATOM 580 HE ARG A1140 -23.870 38.034 13.155 1.00 0.00 H ATOM 581 HH12 ARG A1140 -25.886 37.468 16.656 1.00 0.00 H ATOM 582 HH11 ARG A1140 -25.697 39.137 16.005 1.00 0.00 H ATOM 583 HH22 ARG A1140 -24.996 35.685 15.522 1.00 0.00 H ATOM 584 HH21 ARG A1140 -24.106 35.950 13.979 1.00 0.00 H ATOM 585 H ARG A1140 -24.435 44.531 12.305 1.00 0.00 H ATOM 586 N LYS A1141 -21.438 43.435 13.168 1.00 17.92 N ATOM 587 CA LYS A1141 -20.004 43.302 13.394 1.00 21.96 C ATOM 588 C LYS A1141 -19.594 43.973 14.698 1.00 22.42 C ATOM 589 O LYS A1141 -18.737 43.458 15.425 1.00 23.06 O ATOM 590 CB LYS A1141 -19.230 43.874 12.207 1.00 21.92 C ATOM 591 CG LYS A1141 -19.370 43.020 10.952 1.00 18.52 C ATOM 592 CD LYS A1141 -18.584 43.592 9.776 1.00 19.00 C ATOM 593 CE LYS A1141 -17.085 43.393 9.944 1.00 21.41 C ATOM 594 NZ LYS A1141 -16.357 43.732 8.682 1.00 22.60 N ATOM 595 HZ1 LYS A1141 -16.693 43.117 7.914 1.00 0.00 H ATOM 596 HZ2 LYS A1141 -16.537 44.726 8.436 1.00 0.00 H ATOM 597 HZ3 LYS A1141 -15.337 43.588 8.822 1.00 0.00 H ATOM 598 H LYS A1141 -21.791 44.030 12.391 1.00 0.00 H ATOM 599 N LEU A1142 -20.202 45.118 15.011 1.00 19.37 N ATOM 600 CA LEU A1142 -19.929 45.775 16.286 1.00 20.87 C ATOM 601 C LEU A1142 -20.450 44.948 17.453 1.00 22.72 C ATOM 602 O LEU A1142 -19.821 44.899 18.514 1.00 24.77 O ATOM 603 CB LEU A1142 -20.549 47.173 16.308 1.00 20.51 C ATOM 604 CG LEU A1142 -19.710 48.358 15.823 1.00 22.54 C ATOM 605 CD1 LEU A1142 -20.527 49.637 15.882 1.00 22.12 C ATOM 606 CD2 LEU A1142 -18.442 48.504 16.651 1.00 20.18 C ATOM 607 H LEU A1142 -20.875 45.545 14.343 1.00 0.00 H ATOM 608 N ASP A1143 -21.597 44.286 17.277 1.00 21.12 N ATOM 609 CA ASP A1143 -22.165 43.479 18.351 1.00 22.90 C ATOM 610 C ASP A1143 -21.408 42.174 18.572 1.00 25.78 C ATOM 611 O ASP A1143 -21.535 41.577 19.644 1.00 26.81 O ATOM 612 CB ASP A1143 -23.638 43.179 18.057 1.00 24.97 C ATOM 613 CG ASP A1143 -24.387 42.673 19.277 1.00 28.34 C ATOM 614 OD1 ASP A1143 -24.194 43.242 20.372 1.00 31.61 O ATOM 615 OD2 ASP A1143 -25.167 41.707 19.143 1.00 32.82 O ATOM 616 H ASP A1143 -22.091 44.347 16.364 1.00 0.00 H ATOM 617 N THR A1144 -20.631 41.712 17.589 1.00 20.66 N ATOM 618 CA THR A1144 -19.944 40.429 17.690 1.00 24.73 C ATOM 619 C THR A1144 -18.426 40.573 17.752 1.00 22.18 C ATOM 620 O THR A1144 -17.707 39.602 17.493 1.00 23.33 O ATOM 621 CB THR A1144 -20.344 39.522 16.525 1.00 23.61 C ATOM 622 OG1 THR A1144 -20.055 40.179 15.286 1.00 22.37 O ATOM 623 CG2 THR A1144 -21.827 39.188 16.595 1.00 23.11 C ATOM 624 HG1 THR A1144 -20.566 41.026 15.236 1.00 0.00 H ATOM 625 H THR A1144 -20.512 42.283 16.728 1.00 0.00 H ATOM 626 N GLY A1145 -17.928 41.763 18.080 1.00 22.38 N ATOM 627 CA GLY A1145 -16.504 41.953 18.296 1.00 23.11 C ATOM 628 C GLY A1145 -15.645 41.763 17.067 1.00 25.97 C ATOM 629 O GLY A1145 -14.477 41.377 17.187 1.00 26.22 O ATOM 630 H GLY A1145 -18.571 42.573 18.184 1.00 0.00 H ATOM 631 N GLN A1146 -16.190 42.023 15.883 1.00 25.09 N ATOM 632 CA GLN A1146 -15.414 41.826 14.667 1.00 25.41 C ATOM 633 C GLN A1146 -14.507 43.005 14.340 1.00 27.02 C ATOM 634 O GLN A1146 -13.730 42.915 13.384 1.00 29.38 O ATOM 635 CB GLN A1146 -16.346 41.527 13.491 1.00 21.45 C ATOM 636 CG GLN A1146 -17.014 40.162 13.596 1.00 24.18 C ATOM 637 CD GLN A1146 -17.777 39.769 12.346 1.00 24.57 C ATOM 638 OE1 GLN A1146 -17.267 39.875 11.230 1.00 26.82 O ATOM 639 NE2 GLN A1146 -19.009 39.305 12.529 1.00 25.47 N ATOM 640 HE22 GLN A1146 -19.400 39.232 13.490 1.00 0.00 H ATOM 641 HE21 GLN A1146 -19.582 39.014 11.711 1.00 0.00 H ATOM 642 H GLN A1146 -17.170 42.367 15.825 1.00 0.00 H ATOM 643 N TYR A1147 -14.560 44.083 15.113 1.00 22.39 N ATOM 644 CA TYR A1147 -13.659 45.215 14.939 1.00 22.08 C ATOM 645 C TYR A1147 -12.647 45.192 16.078 1.00 24.71 C ATOM 646 O TYR A1147 -13.033 45.144 17.252 1.00 28.02 O ATOM 647 CB TYR A1147 -14.424 46.541 14.916 1.00 21.36 C ATOM 648 CG TYR A1147 -15.429 46.662 13.788 1.00 21.55 C ATOM 649 CD1 TYR A1147 -15.022 46.625 12.461 1.00 23.61 C ATOM 650 CD2 TYR A1147 -16.784 46.818 14.054 1.00 18.07 C ATOM 651 CE1 TYR A1147 -15.939 46.737 11.429 1.00 18.70 C ATOM 652 CE2 TYR A1147 -17.705 46.934 13.039 1.00 16.23 C ATOM 653 CZ TYR A1147 -17.278 46.891 11.721 1.00 18.58 C ATOM 654 OH TYR A1147 -18.199 47.002 10.710 1.00 18.72 O ATOM 655 HH TYR A1147 -17.736 46.953 9.836 1.00 0.00 H ATOM 656 H TYR A1147 -15.271 44.121 15.871 1.00 0.00 H ATOM 657 N GLN A1148 -11.358 45.186 15.735 1.00 23.78 N ATOM 658 CA GLN A1148 -10.325 45.273 16.757 1.00 26.74 C ATOM 659 C GLN A1148 -9.824 46.697 16.952 1.00 27.85 C ATOM 660 O GLN A1148 -9.350 47.032 18.045 1.00 28.75 O ATOM 661 CB GLN A1148 -9.147 44.357 16.407 1.00 31.27 C ATOM 662 CG GLN A1148 -9.556 42.949 15.991 1.00 35.50 C ATOM 663 CD GLN A1148 -10.597 42.338 16.913 1.00 38.30 C ATOM 664 OE1 GLN A1148 -10.434 42.324 18.134 1.00 42.48 O ATOM 665 NE2 GLN A1148 -11.679 41.833 16.330 1.00 41.07 N ATOM 666 HE22 GLN A1148 -11.775 41.866 15.295 1.00 0.00 H ATOM 667 HE21 GLN A1148 -12.429 41.405 16.909 1.00 0.00 H ATOM 668 H GLN A1148 -11.090 45.119 14.732 1.00 0.00 H ATOM 669 N GLU A1149 -9.937 47.540 15.925 1.00 25.27 N ATOM 670 CA GLU A1149 -9.532 48.934 15.911 1.00 26.42 C ATOM 671 C GLU A1149 -10.704 49.806 15.479 1.00 23.87 C ATOM 672 O GLU A1149 -11.529 49.380 14.664 1.00 19.19 O ATOM 673 CB GLU A1149 -8.359 49.167 14.946 1.00 30.37 C ATOM 674 CG GLU A1149 -7.243 48.140 15.037 1.00 39.10 C ATOM 675 CD GLU A1149 -6.360 48.339 16.253 1.00 42.27 C ATOM 676 OE1 GLU A1149 -6.306 49.471 16.775 1.00 41.22 O ATOM 677 OE2 GLU A1149 -5.717 47.360 16.688 1.00 47.96 O ATOM 678 H GLU A1149 -10.355 47.163 15.051 1.00 0.00 H ATOM 679 N PRO A1150 -10.803 51.030 15.999 1.00 18.48 N ATOM 680 CA PRO A1150 -11.875 51.924 15.536 1.00 15.00 C ATOM 681 C PRO A1150 -11.847 52.166 14.038 1.00 17.97 C ATOM 682 O PRO A1150 -12.911 52.292 13.426 1.00 17.19 O ATOM 683 CB PRO A1150 -11.616 53.220 16.319 1.00 19.21 C ATOM 684 CG PRO A1150 -10.834 52.787 17.517 1.00 24.39 C ATOM 685 CD PRO A1150 -9.980 51.647 17.051 1.00 20.26 C ATOM 686 N TRP A1151 -10.664 52.199 13.420 1.00 19.76 N ATOM 687 CA TRP A1151 -10.614 52.525 11.999 1.00 18.78 C ATOM 688 C TRP A1151 -11.188 51.410 11.133 1.00 20.14 C ATOM 689 O TRP A1151 -11.617 51.682 10.007 1.00 19.82 O ATOM 690 CB TRP A1151 -9.182 52.869 11.568 1.00 21.59 C ATOM 691 CG TRP A1151 -8.153 51.805 11.816 1.00 22.29 C ATOM 692 CD1 TRP A1151 -7.304 51.717 12.883 1.00 26.34 C ATOM 693 CD2 TRP A1151 -7.841 50.696 10.964 1.00 22.95 C ATOM 694 NE1 TRP A1151 -6.495 50.614 12.755 1.00 28.73 N ATOM 695 CE2 TRP A1151 -6.806 49.970 11.586 1.00 28.44 C ATOM 696 CE3 TRP A1151 -8.344 50.240 9.742 1.00 18.51 C ATOM 697 CZ2 TRP A1151 -6.263 48.816 11.025 1.00 28.16 C ATOM 698 CZ3 TRP A1151 -7.804 49.094 9.187 1.00 21.66 C ATOM 699 CH2 TRP A1151 -6.774 48.396 9.828 1.00 28.84 C ATOM 700 HE1 TRP A1151 -5.766 50.316 13.434 1.00 0.00 H ATOM 701 H TRP A1151 -9.790 51.995 13.945 1.00 0.00 H ATOM 702 N GLN A1152 -11.227 50.172 11.630 1.00 20.35 N ATOM 703 CA GLN A1152 -11.891 49.114 10.872 1.00 20.80 C ATOM 704 C GLN A1152 -13.385 49.386 10.767 1.00 19.56 C ATOM 705 O GLN A1152 -14.008 49.116 9.732 1.00 18.87 O ATOM 706 CB GLN A1152 -11.641 47.760 11.527 1.00 17.06 C ATOM 707 CG GLN A1152 -10.189 47.335 11.538 1.00 24.44 C ATOM 708 CD GLN A1152 -9.962 46.110 12.396 1.00 29.06 C ATOM 709 OE1 GLN A1152 -10.661 45.896 13.383 1.00 27.24 O ATOM 710 NE2 GLN A1152 -8.989 45.288 12.015 1.00 31.99 N ATOM 711 HE22 GLN A1152 -8.422 45.509 11.172 1.00 0.00 H ATOM 712 HE21 GLN A1152 -8.795 44.424 12.560 1.00 0.00 H ATOM 713 H GLN A1152 -10.788 49.962 12.549 1.00 0.00 H ATOM 714 N TYR A1153 -13.978 49.915 11.837 1.00 16.40 N ATOM 715 CA TYR A1153 -15.374 50.335 11.793 1.00 12.84 C ATOM 716 C TYR A1153 -15.562 51.498 10.825 1.00 15.76 C ATOM 717 O TYR A1153 -16.471 51.478 9.988 1.00 17.23 O ATOM 718 CB TYR A1153 -15.839 50.709 13.202 1.00 16.95 C ATOM 719 CG TYR A1153 -17.120 51.504 13.265 1.00 14.62 C ATOM 720 CD1 TYR A1153 -18.357 50.878 13.164 1.00 15.20 C ATOM 721 CD2 TYR A1153 -17.094 52.878 13.466 1.00 12.31 C ATOM 722 CE1 TYR A1153 -19.531 51.603 13.241 1.00 16.60 C ATOM 723 CE2 TYR A1153 -18.263 53.613 13.535 1.00 14.37 C ATOM 724 CZ TYR A1153 -19.477 52.967 13.433 1.00 14.56 C ATOM 725 OH TYR A1153 -20.642 53.689 13.509 1.00 15.56 O ATOM 726 HH TYR A1153 -20.686 54.151 14.384 1.00 0.00 H ATOM 727 H TYR A1153 -13.437 50.030 12.717 1.00 0.00 H ATOM 728 N VAL A1154 -14.705 52.518 10.921 1.00 15.91 N ATOM 729 CA VAL A1154 -14.777 53.642 9.989 1.00 14.91 C ATOM 730 C VAL A1154 -14.642 53.151 8.554 1.00 16.48 C ATOM 731 O VAL A1154 -15.358 53.616 7.657 1.00 16.35 O ATOM 732 CB VAL A1154 -13.706 54.694 10.331 1.00 14.87 C ATOM 733 CG1 VAL A1154 -13.707 55.824 9.300 1.00 15.49 C ATOM 734 CG2 VAL A1154 -13.945 55.249 11.723 1.00 17.93 C ATOM 735 H VAL A1154 -13.979 52.513 11.666 1.00 0.00 H ATOM 736 N ASP A1155 -13.740 52.193 8.319 1.00 17.51 N ATOM 737 CA ASP A1155 -13.557 51.654 6.968 1.00 12.74 C ATOM 738 C ASP A1155 -14.842 51.031 6.434 1.00 18.79 C ATOM 739 O ASP A1155 -15.164 51.184 5.249 1.00 17.30 O ATOM 740 CB ASP A1155 -12.430 50.622 6.952 1.00 20.75 C ATOM 741 CG ASP A1155 -11.049 51.254 6.967 1.00 25.27 C ATOM 742 OD1 ASP A1155 -10.942 52.490 6.811 1.00 24.23 O ATOM 743 OD2 ASP A1155 -10.063 50.502 7.121 1.00 26.07 O ATOM 744 H ASP A1155 -13.162 51.826 9.102 1.00 0.00 H ATOM 745 N ASP A1156 -15.584 50.312 7.284 1.00 16.36 N ATOM 746 CA ASP A1156 -16.818 49.682 6.822 1.00 15.00 C ATOM 747 C ASP A1156 -17.889 50.721 6.518 1.00 15.00 C ATOM 748 O ASP A1156 -18.645 50.576 5.550 1.00 17.08 O ATOM 749 CB ASP A1156 -17.335 48.679 7.855 1.00 17.24 C ATOM 750 CG ASP A1156 -16.878 47.257 7.578 1.00 18.91 C ATOM 751 OD1 ASP A1156 -16.372 46.985 6.469 1.00 18.63 O ATOM 752 OD2 ASP A1156 -17.045 46.401 8.469 1.00 18.33 O ATOM 753 H ASP A1156 -15.282 50.202 8.273 1.00 0.00 H ATOM 754 N VAL A1157 -17.988 51.764 7.345 1.00 14.03 N ATOM 755 CA VAL A1157 -18.933 52.836 7.055 1.00 11.40 C ATOM 756 C VAL A1157 -18.581 53.499 5.729 1.00 12.37 C ATOM 757 O VAL A1157 -19.457 53.769 4.898 1.00 16.31 O ATOM 758 CB VAL A1157 -18.967 53.856 8.207 1.00 12.48 C ATOM 759 CG1 VAL A1157 -19.883 55.020 7.846 1.00 13.57 C ATOM 760 CG2 VAL A1157 -19.439 53.181 9.497 1.00 13.60 C ATOM 761 H VAL A1157 -17.392 51.812 8.196 1.00 0.00 H ATOM 762 N TRP A1158 -17.292 53.751 5.497 1.00 13.09 N ATOM 763 CA TRP A1158 -16.896 54.381 4.240 1.00 13.82 C ATOM 764 C TRP A1158 -17.004 53.426 3.056 1.00 16.92 C ATOM 765 O TRP A1158 -17.227 53.873 1.924 1.00 17.48 O ATOM 766 CB TRP A1158 -15.489 54.953 4.371 1.00 14.61 C ATOM 767 CG TRP A1158 -15.547 56.351 4.885 1.00 14.65 C ATOM 768 CD1 TRP A1158 -15.608 56.753 6.192 1.00 16.53 C ATOM 769 CD2 TRP A1158 -15.598 57.542 4.095 1.00 13.12 C ATOM 770 NE1 TRP A1158 -15.679 58.128 6.259 1.00 20.33 N ATOM 771 CE2 TRP A1158 -15.678 58.633 4.984 1.00 19.64 C ATOM 772 CE3 TRP A1158 -15.579 57.791 2.721 1.00 18.72 C ATOM 773 CZ2 TRP A1158 -15.731 59.954 4.542 1.00 18.45 C ATOM 774 CZ3 TRP A1158 -15.633 59.105 2.284 1.00 17.24 C ATOM 775 CH2 TRP A1158 -15.707 60.167 3.190 1.00 15.25 C ATOM 776 HE1 TRP A1158 -15.726 58.690 7.133 1.00 0.00 H ATOM 777 H TRP A1158 -16.574 53.501 6.206 1.00 0.00 H ATOM 778 N LEU A1159 -16.862 52.121 3.289 1.00 15.53 N ATOM 779 CA LEU A1159 -17.139 51.154 2.233 1.00 14.24 C ATOM 780 C LEU A1159 -18.598 51.227 1.801 1.00 17.91 C ATOM 781 O LEU A1159 -18.902 51.220 0.601 1.00 16.16 O ATOM 782 CB LEU A1159 -16.773 49.745 2.708 1.00 14.49 C ATOM 783 CG LEU A1159 -17.122 48.592 1.762 1.00 15.24 C ATOM 784 CD1 LEU A1159 -16.389 48.738 0.437 1.00 19.39 C ATOM 785 CD2 LEU A1159 -16.795 47.248 2.418 1.00 18.45 C ATOM 786 H LEU A1159 -16.553 51.792 4.226 1.00 0.00 H ATOM 787 N MET A1160 -19.515 51.315 2.766 1.00 16.09 N ATOM 788 CA MET A1160 -20.925 51.512 2.444 1.00 16.09 C ATOM 789 C MET A1160 -21.128 52.771 1.606 1.00 14.83 C ATOM 790 O MET A1160 -21.816 52.747 0.575 1.00 14.99 O ATOM 791 CB MET A1160 -21.734 51.592 3.738 1.00 15.06 C ATOM 792 CG MET A1160 -23.232 51.695 3.533 1.00 16.84 C ATOM 793 SD MET A1160 -24.060 51.852 5.120 1.00 16.55 S ATOM 794 CE MET A1160 -23.568 53.507 5.598 1.00 20.01 C ATOM 795 H MET A1160 -19.221 51.242 3.761 1.00 0.00 H ATOM 796 N PHE A1161 -20.530 53.886 2.034 1.00 14.15 N ATOM 797 CA PHE A1161 -20.646 55.132 1.279 1.00 14.55 C ATOM 798 C PHE A1161 -20.072 54.980 -0.122 1.00 13.73 C ATOM 799 O PHE A1161 -20.711 55.350 -1.111 1.00 13.72 O ATOM 800 CB PHE A1161 -19.921 56.266 2.000 1.00 13.52 C ATOM 801 CG PHE A1161 -20.510 56.636 3.329 1.00 12.77 C ATOM 802 CD1 PHE A1161 -21.826 56.327 3.648 1.00 14.06 C ATOM 803 CD2 PHE A1161 -19.746 57.331 4.250 1.00 13.92 C ATOM 804 CE1 PHE A1161 -22.360 56.702 4.882 1.00 15.68 C ATOM 805 CE2 PHE A1161 -20.273 57.706 5.485 1.00 15.38 C ATOM 806 CZ PHE A1161 -21.575 57.397 5.794 1.00 11.23 C ATOM 807 H PHE A1161 -19.976 53.867 2.914 1.00 0.00 H ATOM 808 N ASN A1162 -18.847 54.466 -0.223 1.00 14.65 N ATOM 809 CA ASN A1162 -18.192 54.418 -1.525 1.00 15.72 C ATOM 810 C ASN A1162 -18.910 53.474 -2.480 1.00 15.90 C ATOM 811 O ASN A1162 -18.953 53.738 -3.689 1.00 15.42 O ATOM 812 CB ASN A1162 -16.723 54.027 -1.356 1.00 14.61 C ATOM 813 CG ASN A1162 -15.851 55.212 -0.975 1.00 24.10 C ATOM 814 OD1 ASN A1162 -16.050 56.324 -1.472 1.00 25.93 O ATOM 815 ND2 ASN A1162 -14.880 54.982 -0.096 1.00 22.97 N ATOM 816 HD22 ASN A1162 -14.749 54.028 0.297 1.00 0.00 H ATOM 817 HD21 ASN A1162 -14.251 55.756 0.199 1.00 0.00 H ATOM 818 H ASN A1162 -18.361 54.101 0.621 1.00 0.00 H ATOM 819 N ASN A1163 -19.492 52.386 -1.965 1.00 16.53 N ATOM 820 CA ASN A1163 -20.307 51.523 -2.816 1.00 17.54 C ATOM 821 C ASN A1163 -21.461 52.304 -3.433 1.00 15.31 C ATOM 822 O ASN A1163 -21.711 52.219 -4.642 1.00 16.10 O ATOM 823 CB ASN A1163 -20.843 50.334 -2.016 1.00 15.15 C ATOM 824 CG ASN A1163 -19.774 49.311 -1.690 1.00 14.40 C ATOM 825 OD1 ASN A1163 -18.683 49.329 -2.253 1.00 16.32 O ATOM 826 ND2 ASN A1163 -20.094 48.399 -0.776 1.00 14.76 N ATOM 827 HD22 ASN A1163 -21.031 48.422 -0.324 1.00 0.00 H ATOM 828 HD21 ASN A1163 -19.408 47.663 -0.513 1.00 0.00 H ATOM 829 H ASN A1163 -19.364 52.154 -0.959 1.00 0.00 H ATOM 830 N ALA A1164 -22.174 53.077 -2.610 1.00 14.83 N ATOM 831 CA ALA A1164 -23.326 53.823 -3.103 1.00 14.90 C ATOM 832 C ALA A1164 -22.912 54.918 -4.079 1.00 14.39 C ATOM 833 O ALA A1164 -23.600 55.151 -5.079 1.00 15.75 O ATOM 834 CB ALA A1164 -24.106 54.416 -1.933 1.00 12.71 C ATOM 835 H ALA A1164 -21.905 53.148 -1.608 1.00 0.00 H ATOM 836 N TRP A1165 -21.799 55.609 -3.805 1.00 13.83 N ATOM 837 CA TRP A1165 -21.319 56.629 -4.734 1.00 13.65 C ATOM 838 C TRP A1165 -20.809 56.014 -6.029 1.00 15.88 C ATOM 839 O TRP A1165 -20.866 56.654 -7.085 1.00 15.92 O ATOM 840 CB TRP A1165 -20.205 57.454 -4.096 1.00 14.38 C ATOM 841 CG TRP A1165 -20.653 58.462 -3.083 1.00 11.95 C ATOM 842 CD1 TRP A1165 -21.781 59.237 -3.119 1.00 13.84 C ATOM 843 CD2 TRP A1165 -19.967 58.808 -1.878 1.00 11.81 C ATOM 844 NE1 TRP A1165 -21.830 60.052 -2.010 1.00 15.52 N ATOM 845 CE2 TRP A1165 -20.728 59.803 -1.232 1.00 12.09 C ATOM 846 CE3 TRP A1165 -18.779 58.374 -1.286 1.00 16.74 C ATOM 847 CZ2 TRP A1165 -20.336 60.372 -0.024 1.00 16.45 C ATOM 848 CZ3 TRP A1165 -18.394 58.937 -0.086 1.00 15.66 C ATOM 849 CH2 TRP A1165 -19.170 59.924 0.532 1.00 18.65 C ATOM 850 HE1 TRP A1165 -22.579 60.742 -1.798 1.00 0.00 H ATOM 851 H TRP A1165 -21.274 55.419 -2.928 1.00 0.00 H ATOM 852 N LEU A1166 -20.278 54.795 -5.962 1.00 14.51 N ATOM 853 CA LEU A1166 -19.810 54.130 -7.173 1.00 16.78 C ATOM 854 C LEU A1166 -20.982 53.668 -8.027 1.00 14.87 C ATOM 855 O LEU A1166 -21.007 53.896 -9.245 1.00 16.74 O ATOM 856 CB LEU A1166 -18.914 52.949 -6.801 1.00 17.01 C ATOM 857 CG LEU A1166 -18.491 52.026 -7.946 1.00 19.54 C ATOM 858 CD1 LEU A1166 -17.613 52.766 -8.946 1.00 24.61 C ATOM 859 CD2 LEU A1166 -17.774 50.810 -7.384 1.00 23.31 C ATOM 860 H LEU A1166 -20.197 54.315 -5.043 1.00 0.00 H ATOM 861 N TYR A1167 -21.976 53.029 -7.405 1.00 16.58 N ATOM 862 CA TYR A1167 -23.006 52.365 -8.197 1.00 18.75 C ATOM 863 C TYR A1167 -24.055 53.340 -8.719 1.00 17.54 C ATOM 864 O TYR A1167 -24.470 53.244 -9.882 1.00 19.37 O ATOM 865 CB TYR A1167 -23.698 51.265 -7.389 1.00 16.34 C ATOM 866 CG TYR A1167 -24.774 50.605 -8.220 1.00 17.59 C ATOM 867 CD1 TYR A1167 -24.465 49.562 -9.085 1.00 17.12 C ATOM 868 CD2 TYR A1167 -26.089 51.058 -8.185 1.00 16.95 C ATOM 869 CE1 TYR A1167 -25.439 48.975 -9.881 1.00 19.16 C ATOM 870 CE2 TYR A1167 -27.071 50.475 -8.978 1.00 21.35 C ATOM 871 CZ TYR A1167 -26.738 49.433 -9.817 1.00 19.66 C ATOM 872 OH TYR A1167 -27.706 48.852 -10.605 1.00 21.19 O ATOM 873 HH TYR A1167 -27.301 48.126 -11.142 1.00 0.00 H ATOM 874 H TYR A1167 -22.016 53.005 -6.366 1.00 0.00 H ATOM 875 N ASN A1168 -24.497 54.272 -7.885 1.00 15.82 N ATOM 876 CA ASN A1168 -25.683 55.060 -8.180 1.00 16.91 C ATOM 877 C ASN A1168 -25.344 56.331 -8.943 1.00 18.53 C ATOM 878 O ASN A1168 -24.250 56.888 -8.812 1.00 17.95 O ATOM 879 CB ASN A1168 -26.413 55.411 -6.890 1.00 13.85 C ATOM 880 CG ASN A1168 -26.858 54.184 -6.138 1.00 14.00 C ATOM 881 OD1 ASN A1168 -27.879 53.583 -6.467 1.00 16.74 O ATOM 882 ND2 ASN A1168 -26.080 53.786 -5.133 1.00 15.02 N ATOM 883 HD22 ASN A1168 -25.225 54.327 -4.891 1.00 0.00 H ATOM 884 HD21 ASN A1168 -26.327 52.934 -4.590 1.00 0.00 H ATOM 885 H ASN A1168 -23.982 54.443 -6.998 1.00 0.00 H ATOM 886 N ARG A1169 -26.299 56.776 -9.759 1.00 17.40 N ATOM 887 CA ARG A1169 -26.151 58.035 -10.477 1.00 17.58 C ATOM 888 C ARG A1169 -26.200 59.213 -9.508 1.00 15.06 C ATOM 889 O ARG A1169 -26.856 59.160 -8.465 1.00 16.56 O ATOM 890 CB ARG A1169 -27.253 58.183 -11.524 1.00 17.87 C ATOM 891 CG ARG A1169 -27.278 57.082 -12.571 1.00 20.91 C ATOM 892 CD ARG A1169 -26.175 57.259 -13.600 1.00 29.35 C ATOM 893 NE ARG A1169 -26.089 56.099 -14.483 1.00 35.83 N ATOM 894 CZ ARG A1169 -26.798 55.951 -15.598 1.00 40.45 C ATOM 895 NH1 ARG A1169 -27.645 56.900 -15.977 1.00 34.93 N ATOM 896 NH2 ARG A1169 -26.659 54.856 -16.334 1.00 43.14 N ATOM 897 HE ARG A1169 -25.429 55.338 -14.222 1.00 0.00 H ATOM 898 HH12 ARG A1169 -28.199 56.784 -16.849 1.00 0.00 H ATOM 899 HH11 ARG A1169 -27.754 57.760 -15.402 1.00 0.00 H ATOM 900 HH22 ARG A1169 -27.214 54.742 -17.206 1.00 0.00 H ATOM 901 HH21 ARG A1169 -25.995 54.112 -16.039 1.00 0.00 H ATOM 902 H ARG A1169 -27.165 56.215 -9.886 1.00 0.00 H ATOM 903 N LYS A1170 -25.501 60.297 -9.872 1.00 17.98 N ATOM 904 CA LYS A1170 -25.385 61.443 -8.967 1.00 16.49 C ATOM 905 C LYS A1170 -26.740 62.059 -8.636 1.00 19.64 C ATOM 906 O LYS A1170 -26.888 62.687 -7.581 1.00 18.57 O ATOM 907 CB LYS A1170 -24.489 62.528 -9.566 1.00 20.78 C ATOM 908 CG LYS A1170 -23.176 62.070 -10.155 1.00 36.76 C ATOM 909 CD LYS A1170 -22.439 63.272 -10.740 1.00 41.35 C ATOM 910 CE LYS A1170 -21.771 62.943 -12.061 1.00 48.25 C ATOM 911 NZ LYS A1170 -20.935 64.079 -12.544 1.00 52.96 N ATOM 912 HZ1 LYS A1170 -21.535 64.918 -12.676 1.00 0.00 H ATOM 913 HZ2 LYS A1170 -20.196 64.287 -11.842 1.00 0.00 H ATOM 914 HZ3 LYS A1170 -20.492 63.822 -13.449 1.00 0.00 H ATOM 915 H LYS A1170 -25.038 60.325 -10.803 1.00 0.00 H ATOM 916 N THR A1171 -27.727 61.924 -9.526 1.00 16.21 N ATOM 917 CA THR A1171 -29.047 62.500 -9.288 1.00 15.00 C ATOM 918 C THR A1171 -29.950 61.609 -8.444 1.00 15.74 C ATOM 919 O THR A1171 -31.039 62.052 -8.063 1.00 18.94 O ATOM 920 CB THR A1171 -29.766 62.789 -10.609 1.00 17.36 C ATOM 921 OG1 THR A1171 -29.762 61.613 -11.427 1.00 16.96 O ATOM 922 CG2 THR A1171 -29.104 63.942 -11.361 1.00 19.35 C ATOM 923 HG1 THR A1171 -30.228 60.880 -10.952 1.00 0.00 H ATOM 924 H THR A1171 -27.551 61.398 -10.406 1.00 0.00 H ATOM 925 N SER A1172 -29.539 60.379 -8.160 1.00 15.19 N ATOM 926 CA SER A1172 -30.418 59.423 -7.501 1.00 14.29 C ATOM 927 C SER A1172 -30.552 59.722 -6.008 1.00 17.41 C ATOM 928 O SER A1172 -29.682 60.335 -5.383 1.00 15.98 O ATOM 929 CB SER A1172 -29.907 57.998 -7.697 1.00 19.70 C ATOM 930 OG SER A1172 -28.667 57.809 -7.042 1.00 15.80 O ATOM 931 HG SER A1172 -28.000 58.440 -7.412 1.00 0.00 H ATOM 932 H SER A1172 -28.572 60.093 -8.413 1.00 0.00 H ATOM 933 N ARG A1173 -31.675 59.272 -5.440 1.00 13.29 N ATOM 934 CA ARG A1173 -31.909 59.438 -4.007 1.00 13.19 C ATOM 935 C ARG A1173 -30.806 58.786 -3.183 1.00 15.60 C ATOM 936 O ARG A1173 -30.299 59.377 -2.221 1.00 14.91 O ATOM 937 CB ARG A1173 -33.262 58.843 -3.623 1.00 13.60 C ATOM 938 CG ARG A1173 -34.459 59.516 -4.267 1.00 14.80 C ATOM 939 CD ARG A1173 -35.714 58.732 -3.960 1.00 20.88 C ATOM 940 NE ARG A1173 -35.673 57.402 -4.558 1.00 21.62 N ATOM 941 CZ ARG A1173 -36.466 56.400 -4.193 1.00 30.77 C ATOM 942 NH1 ARG A1173 -37.357 56.578 -3.229 1.00 31.46 N ATOM 943 NH2 ARG A1173 -36.368 55.220 -4.790 1.00 33.96 N ATOM 944 HE ARG A1173 -34.982 57.228 -5.315 1.00 0.00 H ATOM 945 HH12 ARG A1173 -37.978 55.794 -2.943 1.00 0.00 H ATOM 946 HH11 ARG A1173 -37.436 57.502 -2.758 1.00 0.00 H ATOM 947 HH22 ARG A1173 -36.990 54.438 -4.502 1.00 0.00 H ATOM 948 HH21 ARG A1173 -35.669 55.076 -5.546 1.00 0.00 H ATOM 949 H ARG A1173 -32.392 58.797 -6.025 1.00 0.00 H ATOM 950 N VAL A1174 -30.447 57.547 -3.523 1.00 15.76 N ATOM 951 CA VAL A1174 -29.458 56.828 -2.723 1.00 13.04 C ATOM 952 C VAL A1174 -28.123 57.561 -2.741 1.00 14.55 C ATOM 953 O VAL A1174 -27.417 57.619 -1.728 1.00 13.88 O ATOM 954 CB VAL A1174 -29.325 55.377 -3.222 1.00 13.55 C ATOM 955 CG1 VAL A1174 -28.122 54.688 -2.582 1.00 13.63 C ATOM 956 CG2 VAL A1174 -30.602 54.616 -2.918 1.00 14.72 C ATOM 957 H VAL A1174 -30.871 57.093 -4.357 1.00 0.00 H ATOM 958 N TYR A1175 -27.758 58.140 -3.886 1.00 14.00 N ATOM 959 CA TYR A1175 -26.511 58.893 -3.966 1.00 12.38 C ATOM 960 C TYR A1175 -26.565 60.129 -3.077 1.00 13.78 C ATOM 961 O TYR A1175 -25.638 60.391 -2.301 1.00 13.81 O ATOM 962 CB TYR A1175 -26.243 59.288 -5.416 1.00 13.62 C ATOM 963 CG TYR A1175 -24.864 59.835 -5.717 1.00 15.08 C ATOM 964 CD1 TYR A1175 -24.518 61.150 -5.404 1.00 16.34 C ATOM 965 CD2 TYR A1175 -23.922 59.046 -6.362 1.00 13.18 C ATOM 966 CE1 TYR A1175 -23.251 61.649 -5.713 1.00 15.15 C ATOM 967 CE2 TYR A1175 -22.672 59.532 -6.677 1.00 15.80 C ATOM 968 CZ TYR A1175 -22.341 60.829 -6.359 1.00 16.60 C ATOM 969 OH TYR A1175 -21.086 61.288 -6.683 1.00 21.62 O ATOM 970 HH TYR A1175 -20.957 61.228 -7.663 1.00 0.00 H ATOM 971 H TYR A1175 -28.365 58.054 -4.726 1.00 0.00 H ATOM 972 N LYS A1176 -27.644 60.908 -3.185 1.00 13.35 N ATOM 973 CA LYS A1176 -27.745 62.121 -2.381 1.00 11.26 C ATOM 974 C LYS A1176 -27.947 61.793 -0.907 1.00 15.43 C ATOM 975 O LYS A1176 -27.415 62.490 -0.035 1.00 13.61 O ATOM 976 CB LYS A1176 -28.870 63.005 -2.909 1.00 14.29 C ATOM 977 CG LYS A1176 -28.507 63.646 -4.243 1.00 14.63 C ATOM 978 CD LYS A1176 -29.567 64.614 -4.732 1.00 23.99 C ATOM 979 CE LYS A1176 -29.137 65.276 -6.034 1.00 24.71 C ATOM 980 NZ LYS A1176 -27.928 66.139 -5.862 1.00 27.62 N ATOM 981 HZ1 LYS A1176 -28.135 66.889 -5.172 1.00 0.00 H ATOM 982 HZ2 LYS A1176 -27.136 65.559 -5.519 1.00 0.00 H ATOM 983 HZ3 LYS A1176 -27.676 66.566 -6.776 1.00 0.00 H ATOM 984 H LYS A1176 -28.410 60.651 -3.840 1.00 0.00 H ATOM 985 N PHE A1177 -28.702 60.731 -0.611 1.00 12.69 N ATOM 986 CA PHE A1177 -28.836 60.290 0.778 1.00 12.74 C ATOM 987 C PHE A1177 -27.490 59.861 1.339 1.00 14.56 C ATOM 988 O PHE A1177 -27.169 60.150 2.498 1.00 13.70 O ATOM 989 CB PHE A1177 -29.828 59.132 0.880 1.00 15.29 C ATOM 990 CG PHE A1177 -31.264 59.520 0.656 1.00 13.93 C ATOM 991 CD1 PHE A1177 -31.626 60.837 0.433 1.00 14.14 C ATOM 992 CD2 PHE A1177 -32.257 58.555 0.684 1.00 14.99 C ATOM 993 CE1 PHE A1177 -32.956 61.181 0.233 1.00 13.87 C ATOM 994 CE2 PHE A1177 -33.583 58.891 0.490 1.00 15.31 C ATOM 995 CZ PHE A1177 -33.935 60.206 0.259 1.00 15.98 C ATOM 996 H PHE A1177 -29.195 60.217 -1.369 1.00 0.00 H ATOM 997 N CYS A1178 -26.696 59.154 0.532 1.00 13.87 N ATOM 998 CA CYS A1178 -25.352 58.774 0.951 1.00 12.43 C ATOM 999 C CYS A1178 -24.529 59.999 1.321 1.00 14.34 C ATOM 1000 O CYS A1178 -23.852 60.017 2.357 1.00 14.78 O ATOM 1001 CB CYS A1178 -24.658 57.991 -0.161 1.00 13.67 C ATOM 1002 SG CYS A1178 -23.002 57.488 0.308 1.00 14.53 S ATOM 1003 H CYS A1178 -27.040 58.871 -0.408 1.00 0.00 H ATOM 1004 N SER A1179 -24.584 61.038 0.488 1.00 12.89 N ATOM 1005 CA SER A1179 -23.815 62.243 0.765 1.00 12.10 C ATOM 1006 C SER A1179 -24.232 62.868 2.086 1.00 15.10 C ATOM 1007 O SER A1179 -23.387 63.370 2.834 1.00 16.37 O ATOM 1008 CB SER A1179 -23.975 63.239 -0.379 1.00 15.40 C ATOM 1009 OG SER A1179 -23.259 62.779 -1.511 1.00 15.95 O ATOM 1010 HG SER A1179 -23.364 63.427 -2.252 1.00 0.00 H ATOM 1011 H SER A1179 -25.179 60.988 -0.364 1.00 0.00 H ATOM 1012 N LYS A1180 -25.530 62.833 2.395 1.00 14.16 N ATOM 1013 CA LYS A1180 -25.998 63.344 3.680 1.00 14.58 C ATOM 1014 C LYS A1180 -25.478 62.491 4.833 1.00 16.81 C ATOM 1015 O LYS A1180 -25.010 63.023 5.848 1.00 15.18 O ATOM 1016 CB LYS A1180 -27.526 63.401 3.693 1.00 14.02 C ATOM 1017 CG LYS A1180 -28.133 63.712 5.054 1.00 23.19 C ATOM 1018 CD LYS A1180 -27.663 65.055 5.585 1.00 29.76 C ATOM 1019 CE LYS A1180 -28.403 65.431 6.863 1.00 37.55 C ATOM 1020 NZ LYS A1180 -29.857 65.644 6.620 1.00 47.46 N ATOM 1021 HZ1 LYS A1180 -29.983 66.413 5.931 1.00 0.00 H ATOM 1022 HZ2 LYS A1180 -30.276 64.769 6.245 1.00 0.00 H ATOM 1023 HZ3 LYS A1180 -30.323 65.898 7.514 1.00 0.00 H ATOM 1024 H LYS A1180 -26.212 62.439 1.716 1.00 0.00 H ATOM 1025 N LEU A1181 -25.558 61.163 4.699 1.00 12.37 N ATOM 1026 CA LEU A1181 -25.072 60.291 5.764 1.00 14.23 C ATOM 1027 C LEU A1181 -23.584 60.495 6.003 1.00 16.44 C ATOM 1028 O LEU A1181 -23.114 60.425 7.143 1.00 14.14 O ATOM 1029 CB LEU A1181 -25.361 58.826 5.432 1.00 17.76 C ATOM 1030 CG LEU A1181 -26.818 58.356 5.417 1.00 18.25 C ATOM 1031 CD1 LEU A1181 -26.868 56.841 5.257 1.00 20.76 C ATOM 1032 CD2 LEU A1181 -27.554 58.789 6.680 1.00 15.11 C ATOM 1033 H LEU A1181 -25.967 60.751 3.836 1.00 0.00 H ATOM 1034 N ALA A1182 -22.825 60.758 4.938 1.00 16.09 N ATOM 1035 CA ALA A1182 -21.394 60.985 5.104 1.00 12.32 C ATOM 1036 C ALA A1182 -21.127 62.280 5.859 1.00 12.67 C ATOM 1037 O ALA A1182 -20.186 62.361 6.658 1.00 16.80 O ATOM 1038 CB ALA A1182 -20.702 60.995 3.740 1.00 12.14 C ATOM 1039 H ALA A1182 -23.253 60.801 3.991 1.00 0.00 H ATOM 1040 N GLU A1183 -21.950 63.301 5.630 1.00 13.85 N ATOM 1041 CA GLU A1183 -21.801 64.534 6.393 1.00 14.38 C ATOM 1042 C GLU A1183 -22.108 64.302 7.867 1.00 15.41 C ATOM 1043 O GLU A1183 -21.368 64.765 8.745 1.00 16.98 O ATOM 1044 CB GLU A1183 -22.706 65.617 5.812 1.00 18.63 C ATOM 1045 CG GLU A1183 -22.660 66.928 6.565 1.00 22.69 C ATOM 1046 CD GLU A1183 -23.488 68.002 5.898 1.00 33.62 C ATOM 1047 OE1 GLU A1183 -22.917 69.049 5.528 1.00 39.99 O ATOM 1048 OE2 GLU A1183 -24.708 67.791 5.735 1.00 34.85 O ATOM 1049 H GLU A1183 -22.696 63.219 4.910 1.00 0.00 H ATOM 1050 N VAL A1184 -23.193 63.580 8.158 1.00 11.45 N ATOM 1051 CA VAL A1184 -23.526 63.266 9.547 1.00 14.04 C ATOM 1052 C VAL A1184 -22.422 62.440 10.184 1.00 15.59 C ATOM 1053 O VAL A1184 -21.995 62.712 11.312 1.00 15.78 O ATOM 1054 CB VAL A1184 -24.882 62.541 9.626 1.00 14.25 C ATOM 1055 CG1 VAL A1184 -25.134 62.015 11.045 1.00 18.71 C ATOM 1056 CG2 VAL A1184 -25.998 63.470 9.187 1.00 17.44 C ATOM 1057 H VAL A1184 -23.806 63.238 7.391 1.00 0.00 H ATOM 1058 N PHE A1185 -21.943 61.416 9.477 1.00 12.90 N ATOM 1059 CA PHE A1185 -20.969 60.518 10.083 1.00 14.28 C ATOM 1060 C PHE A1185 -19.668 61.239 10.412 1.00 15.10 C ATOM 1061 O PHE A1185 -19.100 61.035 11.489 1.00 14.59 O ATOM 1062 CB PHE A1185 -20.698 59.316 9.177 1.00 13.68 C ATOM 1063 CG PHE A1185 -19.790 58.298 9.809 1.00 13.53 C ATOM 1064 CD1 PHE A1185 -20.229 57.544 10.889 1.00 16.94 C ATOM 1065 CD2 PHE A1185 -18.485 58.139 9.374 1.00 13.92 C ATOM 1066 CE1 PHE A1185 -19.397 56.619 11.494 1.00 16.65 C ATOM 1067 CE2 PHE A1185 -17.646 57.220 9.976 1.00 17.74 C ATOM 1068 CZ PHE A1185 -18.103 56.460 11.037 1.00 16.09 C ATOM 1069 H PHE A1185 -22.262 61.259 8.500 1.00 0.00 H ATOM 1070 N GLU A1186 -19.173 62.089 9.507 1.00 15.08 N ATOM 1071 CA GLU A1186 -17.907 62.761 9.790 1.00 12.69 C ATOM 1072 C GLU A1186 -18.020 63.645 11.027 1.00 16.38 C ATOM 1073 O GLU A1186 -17.056 63.775 11.790 1.00 16.91 O ATOM 1074 CB GLU A1186 -17.439 63.582 8.584 1.00 16.78 C ATOM 1075 CG GLU A1186 -18.101 64.930 8.448 1.00 22.47 C ATOM 1076 CD GLU A1186 -17.406 65.851 7.450 1.00 28.06 C ATOM 1077 OE1 GLU A1186 -16.366 65.463 6.880 1.00 19.32 O ATOM 1078 OE2 GLU A1186 -17.909 66.972 7.236 1.00 30.37 O ATOM 1079 H GLU A1186 -19.680 62.269 8.617 1.00 0.00 H ATOM 1080 N GLN A1187 -19.188 64.253 11.244 1.00 16.85 N ATOM 1081 CA GLN A1187 -19.380 65.082 12.430 1.00 13.79 C ATOM 1082 C GLN A1187 -19.441 64.238 13.696 1.00 16.56 C ATOM 1083 O GLN A1187 -18.953 64.661 14.751 1.00 18.23 O ATOM 1084 CB GLN A1187 -20.651 65.911 12.282 1.00 15.20 C ATOM 1085 CG GLN A1187 -20.580 66.927 11.152 1.00 19.66 C ATOM 1086 CD GLN A1187 -21.908 67.609 10.902 1.00 30.48 C ATOM 1087 OE1 GLN A1187 -22.865 67.425 11.657 1.00 35.12 O ATOM 1088 NE2 GLN A1187 -21.976 68.398 9.835 1.00 28.34 N ATOM 1089 HE22 GLN A1187 -21.142 68.523 9.227 1.00 0.00 H ATOM 1090 HE21 GLN A1187 -22.863 68.891 9.608 1.00 0.00 H ATOM 1091 H GLN A1187 -19.966 64.135 10.564 1.00 0.00 H ATOM 1092 N GLU A1188 -20.042 63.049 13.617 1.00 14.82 N ATOM 1093 CA GLU A1188 -20.210 62.236 14.818 1.00 18.53 C ATOM 1094 C GLU A1188 -18.925 61.507 15.190 1.00 16.48 C ATOM 1095 O GLU A1188 -18.613 61.357 16.380 1.00 18.88 O ATOM 1096 CB GLU A1188 -21.344 61.230 14.614 1.00 20.40 C ATOM 1097 CG GLU A1188 -22.703 61.864 14.373 1.00 25.00 C ATOM 1098 CD GLU A1188 -23.344 62.359 15.650 1.00 33.43 C ATOM 1099 OE1 GLU A1188 -23.284 61.625 16.660 1.00 31.41 O ATOM 1100 OE2 GLU A1188 -23.898 63.478 15.647 1.00 42.57 O ATOM 1101 H GLU A1188 -20.390 62.702 12.701 1.00 0.00 H ATOM 1102 N ILE A1189 -18.171 61.049 14.188 1.00 16.75 N ATOM 1103 CA ILE A1189 -17.037 60.175 14.451 1.00 14.73 C ATOM 1104 C ILE A1189 -15.829 60.963 14.958 1.00 16.95 C ATOM 1105 O ILE A1189 -14.986 60.415 15.677 1.00 15.20 O ATOM 1106 CB ILE A1189 -16.702 59.371 13.180 1.00 13.33 C ATOM 1107 CG1 ILE A1189 -15.772 58.201 13.501 1.00 14.64 C ATOM 1108 CG2 ILE A1189 -16.049 60.274 12.131 1.00 12.67 C ATOM 1109 CD1 ILE A1189 -16.346 57.216 14.487 1.00 16.81 C ATOM 1110 H ILE A1189 -18.396 61.319 13.209 1.00 0.00 H ATOM 1111 N ASP A1190 -15.739 62.252 14.614 1.00 16.34 N ATOM 1112 CA ASP A1190 -14.571 63.054 14.984 1.00 15.18 C ATOM 1113 C ASP A1190 -14.357 63.095 16.491 1.00 17.40 C ATOM 1114 O ASP A1190 -13.282 62.683 16.963 1.00 15.91 O ATOM 1115 CB ASP A1190 -14.733 64.452 14.375 1.00 18.92 C ATOM 1116 CG ASP A1190 -13.629 65.423 14.787 1.00 24.09 C ATOM 1117 OD1 ASP A1190 -13.360 65.575 15.996 1.00 21.17 O ATOM 1118 OD2 ASP A1190 -13.038 66.058 13.886 1.00 27.38 O ATOM 1119 H ASP A1190 -16.511 62.692 14.075 1.00 0.00 H ATOM 1120 N PRO A1191 -15.300 63.589 17.295 1.00 18.22 N ATOM 1121 CA PRO A1191 -15.057 63.627 18.746 1.00 18.06 C ATOM 1122 C PRO A1191 -14.859 62.246 19.338 1.00 16.21 C ATOM 1123 O PRO A1191 -14.114 62.093 20.314 1.00 18.48 O ATOM 1124 CB PRO A1191 -16.315 64.314 19.297 1.00 19.32 C ATOM 1125 CG PRO A1191 -17.371 64.072 18.240 1.00 19.12 C ATOM 1126 CD PRO A1191 -16.628 64.119 16.939 1.00 19.30 C ATOM 1127 N VAL A1192 -15.489 61.228 18.752 1.00 16.32 N ATOM 1128 CA VAL A1192 -15.345 59.872 19.266 1.00 18.16 C ATOM 1129 C VAL A1192 -13.924 59.367 19.057 1.00 17.15 C ATOM 1130 O VAL A1192 -13.334 58.751 19.953 1.00 21.74 O ATOM 1131 CB VAL A1192 -16.385 58.952 18.605 1.00 20.09 C ATOM 1132 CG1 VAL A1192 -16.143 57.507 18.998 1.00 23.01 C ATOM 1133 CG2 VAL A1192 -17.785 59.396 18.999 1.00 19.65 C ATOM 1134 H VAL A1192 -16.089 61.403 17.921 1.00 0.00 H ATOM 1135 N MET A1193 -13.356 59.609 17.871 1.00 15.68 N ATOM 1136 CA MET A1193 -11.966 59.237 17.632 1.00 19.69 C ATOM 1137 C MET A1193 -11.035 59.959 18.594 1.00 19.64 C ATOM 1138 O MET A1193 -10.048 59.382 19.067 1.00 21.42 O ATOM 1139 CB MET A1193 -11.573 59.539 16.185 1.00 16.63 C ATOM 1140 CG MET A1193 -12.335 58.727 15.151 1.00 21.09 C ATOM 1141 SD MET A1193 -12.112 56.953 15.375 1.00 28.59 S ATOM 1142 CE MET A1193 -10.374 56.777 14.997 1.00 31.46 C ATOM 1143 H MET A1193 -13.907 60.064 17.116 1.00 0.00 H ATOM 1144 N GLN A1194 -11.323 61.229 18.888 1.00 18.80 N ATOM 1145 CA GLN A1194 -10.525 61.943 19.878 1.00 19.87 C ATOM 1146 C GLN A1194 -10.631 61.281 21.244 1.00 22.83 C ATOM 1147 O GLN A1194 -9.640 61.195 21.977 1.00 27.26 O ATOM 1148 CB GLN A1194 -10.957 63.408 19.950 1.00 21.84 C ATOM 1149 CG GLN A1194 -10.753 64.162 18.646 1.00 26.97 C ATOM 1150 CD GLN A1194 -9.339 64.033 18.122 1.00 37.15 C ATOM 1151 OE1 GLN A1194 -8.388 64.502 18.747 1.00 44.74 O ATOM 1152 NE2 GLN A1194 -9.193 63.388 16.972 1.00 41.26 N ATOM 1153 HE22 GLN A1194 -10.026 63.009 16.479 1.00 0.00 H ATOM 1154 HE21 GLN A1194 -8.245 63.262 16.563 1.00 0.00 H ATOM 1155 H GLN A1194 -12.114 61.708 18.412 1.00 0.00 H ATOM 1156 N SER A1195 -11.820 60.784 21.596 1.00 20.64 N ATOM 1157 CA SER A1195 -11.991 60.140 22.895 1.00 21.47 C ATOM 1158 C SER A1195 -11.287 58.789 22.940 1.00 24.13 C ATOM 1159 O SER A1195 -10.688 58.430 23.960 1.00 28.99 O ATOM 1160 CB SER A1195 -13.478 59.978 23.215 1.00 21.24 C ATOM 1161 OG SER A1195 -13.662 59.497 24.537 1.00 22.11 O ATOM 1162 HG SER A1195 -14.630 59.401 24.720 1.00 0.00 H ATOM 1163 H SER A1195 -12.626 60.856 20.943 1.00 0.00 H ATOM 1164 N LEU A1196 -11.352 58.027 21.853 1.00 22.72 N ATOM 1165 CA LEU A1196 -10.692 56.731 21.814 1.00 25.82 C ATOM 1166 C LEU A1196 -9.179 56.911 21.699 1.00 34.64 C ATOM 1167 O LEU A1196 -8.667 58.012 21.485 1.00 41.57 O ATOM 1168 CB LEU A1196 -11.223 55.895 20.650 1.00 22.53 C ATOM 1169 CG LEU A1196 -12.687 55.463 20.742 1.00 21.51 C ATOM 1170 CD1 LEU A1196 -13.191 54.963 19.405 1.00 24.20 C ATOM 1171 CD2 LEU A1196 -12.863 54.392 21.819 1.00 24.99 C ATOM 1172 H LEU A1196 -11.880 58.361 21.022 1.00 0.00 H ATOM 1173 N GLY A1197 -8.461 55.804 21.848 1.00 42.68 N ATOM 1174 CA GLY A1197 -7.012 55.822 21.758 1.00 52.91 C ATOM 1175 C GLY A1197 -6.478 56.362 20.443 1.00 53.01 C ATOM 1176 O GLY A1197 -6.975 56.021 19.369 1.00 52.95 O ATOM 1177 H GLY A1197 -8.948 54.904 22.033 1.00 0.00 H TER 1178 GLY A1197 HETATM 1179 O HOH 1 -10.745 63.325 15.223 1.00 33.72 O HETATM 1180 O HOH 2 -22.738 59.735 17.753 1.00 38.99 O HETATM 1181 O HOH 3 -8.275 43.001 13.050 1.00 40.14 O HETATM 1182 O HOH 4 -22.602 43.224 21.988 1.00 33.71 O HETATM 1183 O HOH 5 -19.729 39.949 -11.774 1.00 48.77 O HETATM 1184 O HOH 6 -19.341 68.563 8.154 1.00 35.42 O HETATM 1185 O HOH 7 -4.574 50.117 18.519 1.00 43.58 O HETATM 1186 O HOH 8 -30.777 55.141 16.051 1.00 37.28 O HETATM 1187 O HOH 9 -8.805 56.686 17.937 1.00 46.80 O HETATM 1188 O HOH 10 -18.592 43.461 20.060 1.00 39.44 O HETATM 1189 O HOH 11 -33.107 63.317 -8.393 1.00 23.88 O HETATM 1190 O HOH 12 -29.812 67.853 5.562 1.00 48.67 O HETATM 1191 O HOH 13 -5.133 46.641 18.964 1.00 43.36 O HETATM 1192 O HOH 14 -18.167 39.873 8.915 1.00 39.81 O HETATM 1193 O HOH 15 -14.837 39.790 10.605 1.00 39.49 O HETATM 1194 O HOH 16 -26.038 59.201 18.593 1.00 31.86 O HETATM 1195 O HOH 17 -6.292 51.894 16.028 1.00 33.53 O HETATM 1196 O HOH 18 -32.232 63.251 8.205 1.00 28.47 O HETATM 1197 O HOH 19 -25.552 41.312 6.871 1.00 45.48 O HETATM 1198 O HOH 20 -25.499 67.073 8.055 1.00 43.63 O HETATM 1199 O HOH 21 -21.012 70.303 6.678 1.00 37.74 O HETATM 1200 O HOH 22 -12.168 40.188 13.951 1.00 45.30 O HETATM 1201 O HOH 23 -13.876 67.146 17.986 1.00 34.31 O HETATM 1202 O HOH 24 -7.256 62.038 21.404 1.00 43.69 O HETATM 1203 O HOH 25 -24.437 50.587 -2.765 1.00 16.07 O HETATM 1204 O HOH 26 -7.744 45.993 19.820 1.00 30.00 O HETATM 1205 O HOH 27 -27.356 57.650 19.881 1.00 45.18 O HETATM 1206 O HOH 28 -28.124 61.168 -13.418 1.00 28.22 O HETATM 1207 O HOH 29 -12.055 68.695 14.207 1.00 26.85 O HETATM 1208 O HOH 30 -27.670 42.119 7.841 1.00 31.38 O HETATM 1209 O HOH 31 -15.187 67.782 15.898 1.00 39.05 O HETATM 1210 O HOH 32 -24.233 64.203 -3.505 1.00 21.20 O HETATM 1211 O HOH 33 -23.323 47.794 -0.424 1.00 17.38 O HETATM 1212 O HOH 34 -31.633 42.825 2.353 1.00 29.11 O HETATM 1213 O HOH 35 -34.822 38.521 -2.935 1.00 49.22 O HETATM 1214 O HOH 36 -33.490 65.417 5.881 1.00 30.18 O HETATM 1215 O HOH 37 -18.140 43.291 1.981 1.00 30.74 O HETATM 1216 O HOH 38 -34.806 46.611 6.804 1.00 37.65 O HETATM 1217 O HOH 39 -20.778 38.656 10.653 1.00 45.77 O HETATM 1218 O HOH 40 -37.169 56.405 10.591 1.00 35.16 O HETATM 1219 O HOH 41 -17.129 41.890 6.926 1.00 37.87 O HETATM 1220 O HOH 42 -21.897 47.478 29.049 1.00 27.38 O HETATM 1221 O HOH 43 -10.549 47.898 7.430 1.00 29.82 O HETATM 1222 O HOH 44 -24.720 53.910 -13.798 1.00 42.20 O HETATM 1223 O HOH 45 -35.496 46.457 -12.947 1.00 34.48 O HETATM 1224 O HOH 46 -25.779 52.582 -12.123 1.00 32.70 O HETATM 1225 O HOH 47 -15.512 44.537 5.788 1.00 27.71 O HETATM 1226 O HOH 48 -21.092 64.164 1.689 1.00 21.29 O HETATM 1227 O HOH 49 -16.755 48.038 -10.131 1.00 35.16 O HETATM 1228 O HOH 50 -27.660 43.753 12.503 1.00 32.38 O HETATM 1229 O HOH 51 -14.299 58.331 -1.864 1.00 32.78 O HETATM 1230 O HOH 52 -28.056 48.996 1.649 1.00 19.02 O HETATM 1231 O HOH 53 -21.915 57.878 -9.724 1.00 29.00 O HETATM 1232 O HOH 54 -23.008 43.825 -15.390 1.00 48.72 O HETATM 1233 O HOH 55 -30.880 47.534 10.321 1.00 31.75 O HETATM 1234 O HOH 56 -15.707 53.528 24.934 1.00 29.16 O HETATM 1235 O HOH 57 -22.753 53.968 24.432 1.00 24.00 O HETATM 1236 O HOH 58 -20.385 61.683 18.400 1.00 25.46 O HETATM 1237 O HOH 59 -17.081 39.819 -4.621 1.00 38.13 O HETATM 1238 O HOH 60 -19.570 57.969 21.490 1.00 25.68 O HETATM 1239 O HOH 61 -30.139 54.399 -7.760 1.00 18.61 O HETATM 1240 O HOH 62 -13.392 51.600 3.213 1.00 21.54 O HETATM 1241 O HOH 63 -18.146 60.547 6.544 1.00 24.17 O HETATM 1242 O HOH 64 -15.755 45.020 17.487 1.00 29.64 O HETATM 1243 O HOH 65 -13.056 47.184 8.046 1.00 21.66 O HETATM 1244 O HOH 66 -20.247 41.385 -5.118 1.00 36.56 O HETATM 1245 O HOH 67 -28.888 40.763 -0.591 1.00 38.15 O HETATM 1246 O HOH 68 -31.593 59.637 -10.898 1.00 19.36 O HETATM 1247 O HOH 69 -25.604 49.902 1.696 1.00 19.39 O HETATM 1248 O HOH 70 -16.832 37.160 18.416 1.00 36.45 O HETATM 1249 O HOH 71 -11.471 43.927 20.623 1.00 48.42 O HETATM 1250 O HOH 72 -13.922 47.732 5.446 1.00 26.14 O HETATM 1251 O HOH 73 -19.731 55.983 -10.524 1.00 41.11 O HETATM 1252 O HOH 74 -25.688 43.499 -0.897 1.00 22.33 O HETATM 1253 O HOH 75 -24.408 44.739 2.925 1.00 20.77 O HETATM 1254 O HOH 76 -25.403 64.486 -6.097 1.00 19.05 O HETATM 1255 O HOH 77 -27.176 65.246 -0.037 1.00 23.82 O HETATM 1256 O HOH 78 -34.809 41.664 0.425 1.00 42.88 O HETATM 1257 O HOH 79 -29.521 65.455 10.464 1.00 41.84 O HETATM 1258 O HOH 80 -16.958 45.303 19.789 1.00 35.62 O HETATM 1259 O HOH 81 -13.275 41.160 19.683 1.00 41.19 O HETATM 1260 O HOH 82 -26.339 63.860 14.374 1.00 44.82 O HETATM 1261 O HOH 83 -14.603 67.314 5.786 1.00 17.95 O HETATM 1262 O HOH 84 -34.889 49.756 0.917 1.00 31.05 O HETATM 1263 O HOH 85 -13.860 66.052 11.208 1.00 21.14 O HETATM 1264 O HOH 86 -17.213 47.159 -3.244 1.00 22.34 O HETATM 1265 O HOH 87 -35.564 64.897 7.525 1.00 29.96 O HETATM 1266 O HOH 88 -26.011 39.684 -12.944 1.00 53.63 O HETATM 1267 O HOH 89 -25.797 50.461 -13.669 1.00 27.58 O HETATM 1268 O HOH 90 -35.300 50.336 5.382 1.00 31.41 O HETATM 1269 O HOH 91 -16.902 55.394 -4.699 1.00 26.61 O HETATM 1270 O HOH 92 -12.619 44.005 11.027 1.00 45.44 O HETATM 1271 O HOH 93 -29.148 62.542 15.054 1.00 45.43 O HETATM 1272 O HOH 94 -26.121 41.581 -8.598 1.00 28.49 O HETATM 1273 O HOH 95 -23.612 49.890 22.847 1.00 41.80 O HETATM 1274 O HOH 96 -14.354 46.979 -2.822 1.00 32.51 O HETATM 1275 O HOH 97 -16.501 51.013 -2.964 1.00 23.40 O HETATM 1276 O HOH 98 -21.414 42.198 3.130 1.00 34.50 O HETATM 1277 O HOH 99 -25.203 66.509 10.307 1.00 44.30 O HETATM 1278 O HOH 100 -16.571 47.354 -6.116 1.00 27.51 O HETATM 1279 O HOH 101 -33.890 54.015 -5.559 1.00 34.67 O HETATM 1280 O HOH 102 -23.853 50.876 -0.174 1.00 18.12 O HETATM 1281 O HOH 103 -28.839 55.447 -9.995 1.00 19.90 O HETATM 1282 O HOH 104 -24.222 47.256 -15.804 1.00 46.43 O HETATM 1283 O HOH 105 -26.023 41.107 16.454 1.00 38.19 O HETATM 1284 O HOH 106 1.320 50.403 22.332 1.00 55.62 O HETATM 1285 O HOH 107 -24.118 60.218 -12.408 1.00 28.62 O HETATM 1286 O HOH 108 -25.343 45.825 0.620 1.00 21.07 O HETATM 1287 O HOH 109 -20.699 52.429 -11.729 1.00 40.53 O HETATM 1288 O HOH 110 -29.944 50.378 15.195 1.00 39.97 O HETATM 1289 O HOH 111 -14.990 44.401 26.484 1.00 34.94 O HETATM 1290 O HOH 112 -40.606 57.328 7.512 1.00 30.46 O HETATM 1291 O HOH 113 -31.364 48.188 0.591 1.00 22.00 O HETATM 1292 O HOH 114 -36.459 50.753 7.936 1.00 31.45 O HETATM 1293 O HOH 115 -14.009 52.340 0.856 1.00 23.76 O HETATM 1294 O HOH 116 -32.359 45.641 -0.331 1.00 23.88 O HETATM 1295 O HOH 117 -14.286 37.390 15.869 1.00 48.02 O HETATM 1296 O HOH 118 -28.400 67.361 -3.219 1.00 36.09 O HETATM 1297 O HOH 119 -17.350 67.105 14.352 1.00 22.48 O HETATM 1298 O HOH 120 -20.747 64.197 -0.881 1.00 21.19 O HETATM 1299 O HOH 121 -31.152 56.540 18.207 1.00 39.62 O HETATM 1300 O HOH 122 -22.950 51.864 -12.028 1.00 39.22 O HETATM 1301 O HOH 123 -12.446 56.437 0.917 1.00 40.67 O HETATM 1302 O HOH 124 -38.971 58.077 4.442 1.00 28.78 O HETATM 1303 O HOH 125 -17.080 58.897 22.655 1.00 33.97 O HETATM 1304 O HOH 126 -34.366 51.641 -5.482 1.00 23.89 O HETATM 1305 O HOH 127 -20.643 60.222 -9.512 1.00 27.31 O HETATM 1306 O HOH 128 -13.478 44.727 9.005 1.00 31.62 O HETATM 1307 O HOH 129 -11.602 53.112 3.878 1.00 38.57 O HETATM 1308 O HOH 130 -8.297 43.436 20.057 1.00 38.29 O HETATM 1309 O HOH 131 -3.750 49.013 25.541 1.00 49.87 O HETATM 1310 O HOH 132 -7.544 45.287 9.282 1.00 46.55 O HETATM 1311 O HOH 133 -36.625 57.158 2.417 1.00 30.79 O HETATM 1312 O HOH 134 -38.476 53.206 10.796 1.00 38.58 O HETATM 1313 O HOH 135 -21.427 69.680 2.877 1.00 42.10 O HETATM 1314 O HOH 136 -26.641 34.563 16.375 1.00 51.76 O HETATM 1315 O HOH 137 -20.348 57.245 23.847 1.00 28.34 O HETATM 1316 O HOH 138 -27.093 43.028 15.136 1.00 33.73 O HETATM 1317 O HOH 139 -33.685 62.820 10.257 1.00 36.83 O HETATM 1318 O HOH 140 -33.645 50.096 -7.422 1.00 35.64 O HETATM 1319 O HOH 141 -17.586 40.984 0.499 1.00 41.89 O HETATM 1320 O HOH 142 -39.494 56.028 -0.794 1.00 44.28 O HETATM 1321 O HOH 143 -23.669 55.557 -12.203 1.00 41.40 O HETATM 1322 O HOH 144 -32.628 44.769 8.293 1.00 44.97 O HETATM 1323 O HOH 145 -34.421 49.373 -11.791 1.00 40.10 O HETATM 1324 O HOH 146 -25.815 66.321 2.076 1.00 43.83 O HETATM 1325 O HOH 147 -30.430 45.868 11.880 1.00 37.69 O HETATM 1326 O HOH 148 -32.534 63.103 12.667 1.00 50.37 O HETATM 1327 O HOH 149 -7.969 53.356 15.532 1.00 48.49 O HETATM 1328 O HOH 150 -6.566 61.335 19.117 1.00 51.20 O HETATM 1329 O HOH 151 -15.563 52.942 -4.927 1.00 35.74 O HETATM 1330 O HOH 152 -27.195 42.151 -15.285 1.00 38.27 O HETATM 1331 O HOH 153 -16.002 67.499 11.866 1.00 31.29 O HETATM 1332 O HOH 154 -19.345 70.404 11.501 1.00 40.21 O HETATM 1333 O HOH 155 -21.129 64.029 18.496 1.00 40.50 O HETATM 1334 O HOH 156 -11.100 38.241 17.337 1.00 50.29 O HETATM 1335 O HOH 157 -14.566 38.375 19.430 1.00 47.24 O HETATM 1336 O HOH 158 -17.441 55.931 25.054 1.00 38.54 O HETATM 1337 O HOH 159 -22.951 45.044 28.650 1.00 32.14 O HETATM 1338 O HOH 160 -29.843 67.441 3.272 1.00 43.76 O HETATM 1339 O HOH 161 -13.036 53.124 -2.936 1.00 45.49 O HETATM 1340 O HOH 162 -13.276 43.362 6.379 1.00 40.24 O HETATM 1341 O HOH 163 -34.191 50.977 12.306 1.00 44.42 O HETATM 1342 O HOH 164 -17.702 56.851 -9.352 1.00 37.49 O HETATM 1343 O HOH 165 -11.235 53.600 0.006 1.00 46.36 O HETATM 1344 O HOH 166 -12.746 48.844 3.249 1.00 30.83 O HETATM 1345 O HOH 167 -17.398 69.429 10.327 1.00 36.27 O HETATM 1346 O HOH 168 -23.809 42.069 2.817 1.00 27.90 O HETATM 1347 O HOH 169 -13.549 44.997 2.038 1.00 36.50 O HETATM 1348 O HOH 170 -24.839 52.984 23.052 1.00 41.33 O HETATM 1349 O HOH 171 -15.762 43.715 3.077 1.00 38.46 O HETATM 1350 O HOH 172 -34.053 43.590 1.385 1.00 40.66 O HETATM 1351 O HOH 173 -27.504 48.360 20.711 1.00 42.87 O HETATM 1352 O HOH 174 -25.628 66.217 -2.160 1.00 27.88 O HETATM 1353 O HOH 175 -24.972 40.315 9.289 1.00 40.71 O HETATM 1354 O HOH 176 -13.047 47.167 -4.832 1.00 47.36 O HETATM 1355 O HOH 177 -12.833 47.088 0.808 1.00 44.02 O HETATM 1356 O HOH 178 -30.892 52.110 -9.195 1.00 27.71 O HETATM 1357 O HOH 179 -14.318 50.931 -1.519 1.00 28.79 O HETATM 1358 O HOH 180 -27.117 39.715 0.637 1.00 39.61 O HETATM 1359 O HOH 181 -28.832 38.913 -2.039 1.00 48.39 O HETATM 1360 O HOH 182 -36.978 50.903 -5.239 1.00 40.64 O HETATM 1361 O HOH 183 -19.421 41.534 5.019 1.00 35.98 O HETATM 1362 O HOH 184 -14.570 41.228 3.430 1.00 44.21 O HETATM 1363 O HOH 185 -13.163 48.523 -1.413 1.00 40.50 O HETATM 1364 O HOH 186 -8.374 60.436 13.691 1.00 39.35 O HETATM 1365 O HOH 187 -31.320 68.959 9.284 1.00 56.60 O HETATM 1366 O HOH 188 -33.068 51.215 -9.586 1.00 43.10 O HETATM 1367 O HOH 189 -27.640 39.318 -7.726 1.00 37.86 O HETATM 1368 O HOH 190 -22.340 46.031 -15.510 1.00 48.32 O HETATM 1369 O HOH 191 -21.142 59.848 20.254 1.00 29.19 O HETATM 1370 O HOH 192 -24.737 41.247 0.348 1.00 26.08 O HETATM 1371 O HOH 193 -33.314 49.169 11.094 1.00 44.30 O HETATM 1372 O HOH 194 -21.554 39.725 -3.160 1.00 38.27 O HETATM 1373 O HOH 195 -12.611 44.947 4.573 1.00 39.65 O HETATM 1374 O HOH 196 -40.397 55.488 5.237 1.00 42.58 O HETATM 1375 O HOH 197 -21.094 39.998 1.237 1.00 45.94 O HETATM 1376 O HOH 198 -22.573 58.250 24.399 1.00 33.15 O HETATM 1377 O HOH 199 -37.296 48.444 -0.905 1.00 42.97 O HETATM 1378 O HOH 200 -30.501 40.875 5.977 1.00 43.06 O HETATM 1379 O HOH 201 -31.219 70.583 6.903 1.00 44.93 O HETATM 1380 O HOH 202 -22.934 60.465 21.692 1.00 40.04 O HETATM 1381 O HOH 203 -17.074 50.616 -11.979 1.00 42.82 O HETATM 1382 O HOH 204 -21.332 51.129 -13.744 1.00 43.13 O HETATM 1383 O HOH 205 -38.559 55.389 2.492 1.00 36.28 O HETATM 1384 O HOH 206 -22.901 39.586 -0.891 1.00 40.14 O HETATM 1385 O HOH 207 -38.489 52.550 2.927 1.00 39.94 O HETATM 1386 O HOH 208 -27.452 38.948 3.315 1.00 40.75 O HETATM 1387 O HOH 209 -0.601 46.077 13.104 1.00 59.16 O HETATM 1388 O HOH 210 -39.590 51.506 0.958 1.00 49.07 O HETATM 1389 O HOH 211 -23.341 37.096 -0.661 1.00 44.15 O HETATM 1390 N1 XDM A 212 -33.406 50.799 -2.723 1.00 -0.28 N HETATM 1391 C9 XDM A 212 -32.440 50.722 -1.808 1.00 0.20 C HETATM 1392 C8 XDM A 212 -31.037 50.800 -2.263 1.00 0.12 C HETATM 1393 C5 XDM A 212 -30.339 50.796 -3.482 1.00 -0.03 C HETATM 1394 C2 XDM A 212 -28.940 50.887 -3.138 1.00 0.03 C HETATM 1395 C3 XDM A 212 -27.765 50.916 -4.018 1.00 0.10 C HETATM 1396 C4 XDM A 212 -27.790 50.264 -5.365 1.00 0.00 C HETATM 1397 H2 XDM A 212 -26.816 50.401 -5.857 1.00 0.04 H HETATM 1398 H3 XDM A 212 -28.579 50.722 -5.980 1.00 0.04 H HETATM 1399 H4 XDM A 212 -27.994 49.189 -5.248 1.00 0.04 H HETATM 1400 O XDM A 212 -26.730 51.468 -3.645 1.00 -0.40 O HETATM 1401 C XDM A 212 -28.848 50.937 -1.753 1.00 0.06 C HETATM 1402 C1 XDM A 212 -27.668 51.116 -0.851 1.00 -0.00 C HETATM 1403 H15 XDM A 212 -28.002 51.101 0.197 1.00 0.04 H HETATM 1404 H16 XDM A 212 -27.184 52.080 -1.068 1.00 0.04 H HETATM 1405 H17 XDM A 212 -26.951 50.299 -1.019 1.00 0.04 H HETATM 1406 N XDM A 212 -30.115 50.852 -1.247 1.00 -0.27 N HETATM 1407 H18 XDM A 212 -30.346 50.830 -0.243 1.00 0.23 H HETATM 1408 C6 XDM A 212 -30.912 50.685 -4.868 1.00 -0.03 C HETATM 1409 C7 XDM A 212 -31.168 52.030 -5.505 1.00 -0.06 C HETATM 1410 H12 XDM A 212 -31.585 51.885 -6.513 1.00 0.02 H HETATM 1411 H13 XDM A 212 -30.223 52.588 -5.576 1.00 0.02 H HETATM 1412 H14 XDM A 212 -31.883 52.597 -4.890 1.00 0.02 H HETATM 1413 H5 XDM A 212 -31.863 50.136 -4.812 1.00 0.04 H HETATM 1414 H6 XDM A 212 -30.203 50.127 -5.498 1.00 0.04 H HETATM 1415 O1 XDM A 212 -32.686 50.496 -0.623 1.00 -0.40 O HETATM 1416 C10 XDM A 212 -34.810 50.882 -2.350 1.00 0.06 C HETATM 1417 C11 XDM A 212 -35.146 52.142 -1.588 1.00 -0.02 C HETATM 1418 C12 XDM A 212 -36.051 52.107 -0.539 1.00 -0.06 C HETATM 1419 C13 XDM A 212 -36.350 53.252 0.179 1.00 -0.07 C HETATM 1420 C14 XDM A 212 -35.754 54.457 -0.145 1.00 -0.05 C HETATM 1421 C15 XDM A 212 -34.863 54.490 -1.194 1.00 0.03 C HETATM 1422 C16 XDM A 212 -34.548 53.355 -1.914 1.00 -0.04 C HETATM 1423 H19 XDM A 212 -33.837 53.409 -2.731 1.00 0.06 H HETATM 1424 CL XDM A 212 -34.126 56.006 -1.637 1.00 -0.07 CL HETATM 1425 H11 XDM A 212 -35.983 55.356 0.415 1.00 0.06 H HETATM 1426 H10 XDM A 212 -37.056 53.204 1.000 1.00 0.06 H HETATM 1427 H9 XDM A 212 -36.531 51.171 -0.277 1.00 0.06 H HETATM 1428 H7 XDM A 212 -35.057 50.015 -1.720 1.00 0.07 H HETATM 1429 H8 XDM A 212 -35.418 50.854 -3.266 1.00 0.07 H HETATM 1430 H1 XDM A 212 -33.159 50.800 -3.692 1.00 0.19 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 1390 1391 1416 1430 CONECT 1391 1390 1392 1415 CONECT 1392 1391 1393 1406 CONECT 1393 1392 1394 1408 CONECT 1394 1393 1395 1401 CONECT 1395 1394 1396 1400 CONECT 1396 1395 1397 1398 1399 CONECT 1397 1396 CONECT 1398 1396 CONECT 1399 1396 CONECT 1400 1395 CONECT 1401 1394 1402 1406 CONECT 1402 1401 1403 1404 1405 CONECT 1403 1402 CONECT 1404 1402 CONECT 1405 1402 CONECT 1406 1392 1401 1407 CONECT 1407 1406 CONECT 1408 1393 1409 1413 1414 CONECT 1409 1408 1410 1411 1412 CONECT 1410 1409 CONECT 1411 1409 CONECT 1412 1409 CONECT 1413 1408 CONECT 1414 1408 CONECT 1415 1391 CONECT 1416 1390 1417 1428 1429 CONECT 1417 1416 1418 1422 CONECT 1418 1417 1419 1427 CONECT 1419 1418 1420 1426 CONECT 1420 1419 1421 1425 CONECT 1421 1420 1422 1424 CONECT 1422 1417 1421 1423 CONECT 1423 1422 CONECT 1424 1421 CONECT 1425 1420 CONECT 1426 1419 CONECT 1427 1418 CONECT 1428 1416 CONECT 1429 1416 CONECT 1430 1390 MASTER 0 0 0 0 0 0 0 0 1429 1 45 9 END
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Structure:
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
5lpk
RCSB PDB
PDBbind
XDM
Entry Information
PDB ID
5lpj
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
CREB-binding protein
Ligand Name
XDM
EC.Number
E.C.-.-.-.-
Resolution
1.65(Å)
Affinity (Kd/Ki/IC50)
Kd=10.1uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) Angew. Chem. Int. Ed. Engl. Vol. 56: pp. 12476-12480
Ligand Properties
Formula
C
1
7
H
1
9
ClN
2
O
2
Molecular Weight
318.798
Exact Mass
318.114
No. of atoms
41
No. of bonds
42
Polar Surface Area
61.96
LOGP Value
3.32 (
Computed with XLOGP3
)
4.06 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 4
No. of Rings: 2
Canonical SMILES
CCc1c([nH]c(c1C(=O)C)C)C(=O)NCc1cccc(c1)Cl
InChI String
InChI=1S/C17H19ClN2O2/c1-4-14-15(11(3)21)10(2)20-16(14)17(22)19-9-12-6-5-7-13(18)8-12/h5-8,20H,4,9H2,1-3H3,(H,19,22)
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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