Browse entries in the PDBbind-CN Database
HEADER 5EP7_COMPLEX COMPND 5EP7_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 119 SER MET ARG LYS LYS ILE PHE LYS PRO GLU GLU LEU ARG SEQRES 2 A 119 GLN ALA LEU MET PRO THR LEU GLU ALA LEU TYR ARG GLN SEQRES 3 A 119 ASP PRO GLU SER LEU PRO PHE ARG GLN PRO VAL ASP PRO SEQRES 4 A 119 GLN LEU LEU GLY ILE PRO ASP TYR PHE ASP ILE VAL LYS SEQRES 5 A 119 ASN PRO MET ASP LEU SER THR ILE LYS ARG LYS LEU ASP SEQRES 6 A 119 THR GLY GLN TYR GLN GLU PRO TRP GLN TYR VAL ASP ASP SEQRES 7 A 119 VAL TRP LEU MET PHE ASN ASN ALA TRP LEU TYR ASN ARG SEQRES 8 A 119 LYS THR SER ARG VAL TYR LYS PHE CYS SER LYS LEU ALA SEQRES 9 A 119 GLU VAL PHE GLU GLN GLU ILE ASP PRO VAL MET GLN SER SEQRES 10 A 119 LEU GLY HET UNN A 333 31 ATOM 1 N SER A1079 14.320 20.279 10.562 1.00 48.19 N ATOM 2 CA SER A1079 14.075 18.907 11.012 1.00 43.97 C ATOM 3 C SER A1079 13.407 18.086 9.912 1.00 40.86 C ATOM 4 O SER A1079 13.227 18.558 8.787 1.00 34.55 O ATOM 5 CB SER A1079 13.205 18.905 12.272 1.00 39.67 C ATOM 6 OG SER A1079 13.560 19.988 13.130 1.00 43.77 O ATOM 7 HG SER A1079 12.987 19.969 13.937 1.00 0.00 H ATOM 8 HN3 SER A1079 13.416 20.727 10.311 1.00 0.00 H ATOM 9 HN2 SER A1079 14.943 20.263 9.730 1.00 0.00 H ATOM 10 HN1 SER A1079 14.775 20.817 11.327 1.00 0.00 H ATOM 11 N MET A1080 12.997 16.887 10.248 1.00 37.33 N ATOM 12 CA MET A1080 12.424 15.991 9.297 1.00 34.44 C ATOM 13 C MET A1080 11.100 16.408 8.705 1.00 31.30 C ATOM 14 O MET A1080 10.312 17.133 9.336 1.00 24.05 O ATOM 15 CB MET A1080 12.279 14.642 9.964 1.00 28.56 C ATOM 16 CG MET A1080 11.166 14.650 11.040 1.00 32.96 C ATOM 17 SD MET A1080 11.019 13.042 11.846 1.00 33.50 S ATOM 18 CE MET A1080 10.613 13.462 13.497 1.00 40.93 C ATOM 19 H MET A1080 13.092 16.580 11.237 1.00 0.00 H ATOM 20 N ARG A1081 10.873 15.913 7.505 1.00 25.51 N ATOM 21 CA ARG A1081 9.565 16.168 6.929 1.00 28.80 C ATOM 22 C ARG A1081 8.501 15.365 7.661 1.00 27.67 C ATOM 23 O ARG A1081 8.759 14.284 8.199 1.00 26.77 O ATOM 24 CB ARG A1081 9.550 15.775 5.459 1.00 28.60 C ATOM 25 CG ARG A1081 10.025 16.863 4.549 1.00 33.77 C ATOM 26 CD ARG A1081 10.516 16.310 3.238 1.00 31.67 C ATOM 27 NE ARG A1081 11.099 17.384 2.449 1.00 26.52 N ATOM 28 CZ ARG A1081 12.369 17.430 2.071 1.00 17.58 C ATOM 29 NH1 ARG A1081 13.206 16.451 2.396 1.00 19.80 N ATOM 30 NH2 ARG A1081 12.799 18.458 1.367 1.00 32.84 N ATOM 31 HE ARG A1081 10.478 18.168 2.162 1.00 0.00 H ATOM 32 HH12 ARG A1081 14.200 16.496 2.095 1.00 0.00 H ATOM 33 HH11 ARG A1081 12.867 15.640 2.951 1.00 0.00 H ATOM 34 HH22 ARG A1081 13.794 18.503 1.066 1.00 0.00 H ATOM 35 HH21 ARG A1081 12.144 19.224 1.112 1.00 0.00 H ATOM 36 H ARG A1081 11.596 15.366 6.995 1.00 0.00 H ATOM 37 N LYS A1082 7.289 15.904 7.669 1.00 19.67 N ATOM 38 CA LYS A1082 6.179 15.265 8.349 1.00 19.11 C ATOM 39 C LYS A1082 4.940 15.361 7.485 1.00 17.35 C ATOM 40 O LYS A1082 4.795 16.285 6.678 1.00 16.12 O ATOM 41 CB LYS A1082 5.898 15.897 9.712 1.00 25.17 C ATOM 42 CG LYS A1082 6.923 15.536 10.752 1.00 32.87 C ATOM 43 CD LYS A1082 6.822 16.420 11.963 1.00 35.13 C ATOM 44 CE LYS A1082 7.909 16.048 12.950 1.00 33.30 C ATOM 45 NZ LYS A1082 8.275 17.197 13.809 1.00 34.65 N ATOM 46 HZ1 LYS A1082 8.621 17.977 13.214 1.00 0.00 H ATOM 47 HZ2 LYS A1082 7.438 17.511 14.341 1.00 0.00 H ATOM 48 HZ3 LYS A1082 9.021 16.908 14.473 1.00 0.00 H ATOM 49 H LYS A1082 7.131 16.806 7.176 1.00 0.00 H ATOM 50 N LYS A1083 4.054 14.388 7.670 1.00 13.03 N ATOM 51 CA LYS A1083 2.741 14.391 7.042 1.00 13.18 C ATOM 52 C LYS A1083 2.863 14.554 5.531 1.00 10.50 C ATOM 53 O LYS A1083 2.224 15.412 4.915 1.00 12.55 O ATOM 54 CB LYS A1083 1.838 15.458 7.659 1.00 15.52 C ATOM 55 CG LYS A1083 1.623 15.291 9.156 1.00 20.81 C ATOM 56 CD LYS A1083 0.668 16.347 9.686 1.00 24.30 C ATOM 57 CE LYS A1083 0.595 16.312 11.203 1.00 30.94 C ATOM 58 NZ LYS A1083 1.939 16.430 11.830 1.00 39.56 N ATOM 59 HZ1 LYS A1083 2.538 15.640 11.515 1.00 0.00 H ATOM 60 HZ2 LYS A1083 2.375 17.331 11.546 1.00 0.00 H ATOM 61 HZ3 LYS A1083 1.841 16.401 12.865 1.00 0.00 H ATOM 62 H LYS A1083 4.309 13.592 8.289 1.00 0.00 H ATOM 63 N ILE A1084 3.704 13.713 4.931 1.00 9.55 N ATOM 64 CA ILE A1084 3.891 13.805 3.488 1.00 8.36 C ATOM 65 C ILE A1084 2.735 13.202 2.716 1.00 8.37 C ATOM 66 O ILE A1084 2.536 13.559 1.548 1.00 8.91 O ATOM 67 CB ILE A1084 5.218 13.201 2.991 1.00 10.70 C ATOM 68 CG1 ILE A1084 5.218 11.677 3.118 1.00 11.66 C ATOM 69 CG2 ILE A1084 6.417 13.833 3.699 1.00 12.83 C ATOM 70 CD1 ILE A1084 6.449 11.002 2.521 1.00 11.69 C ATOM 71 H ILE A1084 4.220 13.000 5.485 1.00 0.00 H ATOM 72 N PHE A1085 1.997 12.266 3.308 1.00 8.67 N ATOM 73 CA PHE A1085 0.868 11.641 2.635 1.00 8.68 C ATOM 74 C PHE A1085 -0.430 12.349 2.992 1.00 9.17 C ATOM 75 O PHE A1085 -0.620 12.805 4.125 1.00 10.22 O ATOM 76 CB PHE A1085 0.747 10.169 3.036 1.00 8.92 C ATOM 77 CG PHE A1085 1.887 9.322 2.569 1.00 9.00 C ATOM 78 CD1 PHE A1085 1.953 8.910 1.253 1.00 10.46 C ATOM 79 CD2 PHE A1085 2.890 8.934 3.442 1.00 10.52 C ATOM 80 CE1 PHE A1085 3.004 8.130 0.814 1.00 12.62 C ATOM 81 CE2 PHE A1085 3.936 8.150 3.009 1.00 12.17 C ATOM 82 CZ PHE A1085 3.998 7.754 1.697 1.00 12.56 C ATOM 83 H PHE A1085 2.233 11.973 4.278 1.00 0.00 H ATOM 84 N LYS A1086 -1.340 12.418 2.029 1.00 8.56 N ATOM 85 CA LYS A1086 -2.679 12.881 2.347 1.00 8.22 C ATOM 86 C LYS A1086 -3.384 11.812 3.172 1.00 7.82 C ATOM 87 O LYS A1086 -3.170 10.619 2.938 1.00 7.92 O ATOM 88 CB LYS A1086 -3.472 13.129 1.069 1.00 10.06 C ATOM 89 CG LYS A1086 -2.820 14.151 0.164 1.00 9.75 C ATOM 90 CD LYS A1086 -3.656 14.472 -1.059 1.00 11.33 C ATOM 91 CE LYS A1086 -2.945 15.507 -1.934 1.00 12.82 C ATOM 92 NZ LYS A1086 -3.792 15.974 -3.073 1.00 16.13 N ATOM 93 HZ1 LYS A1086 -4.040 15.163 -3.674 1.00 0.00 H ATOM 94 HZ2 LYS A1086 -4.660 16.410 -2.702 1.00 0.00 H ATOM 95 HZ3 LYS A1086 -3.263 16.673 -3.633 1.00 0.00 H ATOM 96 H LYS A1086 -1.097 12.143 1.056 1.00 0.00 H ATOM 97 N PRO A1087 -4.228 12.200 4.125 1.00 8.12 N ATOM 98 CA PRO A1087 -4.975 11.180 4.873 1.00 9.11 C ATOM 99 C PRO A1087 -5.759 10.245 3.975 1.00 8.05 C ATOM 100 O PRO A1087 -5.922 9.061 4.306 1.00 8.10 O ATOM 101 CB PRO A1087 -5.882 12.019 5.780 1.00 10.03 C ATOM 102 CG PRO A1087 -5.094 13.274 6.004 1.00 10.93 C ATOM 103 CD PRO A1087 -4.447 13.553 4.669 1.00 9.16 C ATOM 104 N GLU A1088 -6.223 10.743 2.826 1.00 7.85 N ATOM 105 CA GLU A1088 -6.981 9.916 1.901 1.00 7.90 C ATOM 106 C GLU A1088 -6.085 8.938 1.148 1.00 7.42 C ATOM 107 O GLU A1088 -6.547 7.875 0.728 1.00 8.54 O ATOM 108 CB GLU A1088 -7.756 10.824 0.942 1.00 9.76 C ATOM 109 CG GLU A1088 -8.767 11.742 1.634 1.00 10.28 C ATOM 110 CD GLU A1088 -8.170 13.026 2.201 1.00 12.43 C ATOM 111 OE1 GLU A1088 -6.955 13.282 2.043 1.00 11.57 O ATOM 112 OE2 GLU A1088 -8.935 13.802 2.811 1.00 15.33 O ATOM 113 H GLU A1088 -6.039 11.739 2.589 1.00 0.00 H ATOM 114 N GLU A1089 -4.812 9.292 0.935 1.00 8.06 N ATOM 115 CA GLU A1089 -3.857 8.319 0.408 1.00 7.85 C ATOM 116 C GLU A1089 -3.615 7.209 1.416 1.00 8.08 C ATOM 117 O GLU A1089 -3.522 6.034 1.046 1.00 8.56 O ATOM 118 CB GLU A1089 -2.539 9.005 0.049 1.00 8.54 C ATOM 119 CG GLU A1089 -2.620 9.880 -1.191 1.00 8.26 C ATOM 120 CD GLU A1089 -1.378 10.731 -1.409 1.00 8.51 C ATOM 121 OE1 GLU A1089 -0.705 11.114 -0.431 1.00 8.87 O ATOM 122 OE2 GLU A1089 -1.066 11.020 -2.591 1.00 10.90 O ATOM 123 H GLU A1089 -4.501 10.262 1.145 1.00 0.00 H ATOM 124 N LEU A1090 -3.507 7.568 2.694 1.00 7.27 N ATOM 125 CA LEU A1090 -3.334 6.557 3.729 1.00 7.14 C ATOM 126 C LEU A1090 -4.564 5.667 3.829 1.00 7.77 C ATOM 127 O LEU A1090 -4.445 4.442 3.984 1.00 7.87 O ATOM 128 CB LEU A1090 -3.035 7.230 5.064 1.00 7.70 C ATOM 129 CG LEU A1090 -1.719 8.010 5.092 1.00 8.78 C ATOM 130 CD1 LEU A1090 -1.500 8.613 6.472 1.00 10.16 C ATOM 131 CD2 LEU A1090 -0.540 7.143 4.691 1.00 9.84 C ATOM 132 H LEU A1090 -3.546 8.574 2.954 1.00 0.00 H ATOM 133 N ARG A1091 -5.758 6.266 3.738 1.00 7.50 N ATOM 134 CA ARG A1091 -6.988 5.480 3.735 1.00 7.77 C ATOM 135 C ARG A1091 -6.963 4.443 2.625 1.00 8.65 C ATOM 136 O ARG A1091 -7.225 3.258 2.858 1.00 9.49 O ATOM 137 CB ARG A1091 -8.196 6.404 3.595 1.00 8.14 C ATOM 138 CG ARG A1091 -9.531 5.688 3.460 1.00 9.56 C ATOM 139 CD ARG A1091 -10.684 6.675 3.420 1.00 9.65 C ATOM 140 NE ARG A1091 -10.640 7.500 2.212 1.00 8.68 N ATOM 141 CZ ARG A1091 -11.307 8.640 2.066 1.00 8.75 C ATOM 142 NH1 ARG A1091 -11.214 9.317 0.926 1.00 8.89 N ATOM 143 NH2 ARG A1091 -12.033 9.138 3.061 1.00 9.75 N ATOM 144 HE ARG A1091 -10.051 7.174 1.419 1.00 0.00 H ATOM 145 HH12 ARG A1091 -11.734 10.210 0.807 1.00 0.00 H ATOM 146 HH11 ARG A1091 -10.621 8.954 0.153 1.00 0.00 H ATOM 147 HH22 ARG A1091 -12.549 10.031 2.931 1.00 0.00 H ATOM 148 HH21 ARG A1091 -12.085 8.634 3.970 1.00 0.00 H ATOM 149 H ARG A1091 -5.810 7.302 3.669 1.00 0.00 H ATOM 150 N GLN A1092 -6.613 4.863 1.413 1.00 8.86 N ATOM 151 CA GLN A1092 -6.600 3.940 0.289 1.00 9.73 C ATOM 152 C GLN A1092 -5.547 2.853 0.467 1.00 9.12 C ATOM 153 O GLN A1092 -5.811 1.677 0.202 1.00 10.74 O ATOM 154 CB GLN A1092 -6.353 4.709 -1.003 1.00 10.40 C ATOM 155 CG GLN A1092 -6.385 3.829 -2.229 1.00 13.51 C ATOM 156 CD GLN A1092 -6.137 4.620 -3.480 1.00 16.87 C ATOM 157 OE1 GLN A1092 -5.008 4.999 -3.762 1.00 17.34 O ATOM 158 NE2 GLN A1092 -7.203 4.921 -4.213 1.00 16.49 N ATOM 159 HE22 GLN A1092 -8.142 4.575 -3.931 1.00 0.00 H ATOM 160 HE21 GLN A1092 -7.098 5.503 -5.069 1.00 0.00 H ATOM 161 H GLN A1092 -6.347 5.858 1.268 1.00 0.00 H ATOM 162 N ALA A1093 -4.348 3.221 0.912 1.00 8.42 N ATOM 163 CA ALA A1093 -3.273 2.239 1.001 1.00 8.12 C ATOM 164 C ALA A1093 -3.510 1.247 2.130 1.00 8.66 C ATOM 165 O ALA A1093 -3.182 0.064 2.001 1.00 9.38 O ATOM 166 CB ALA A1093 -1.935 2.938 1.218 1.00 10.03 C ATOM 167 H ALA A1093 -4.178 4.207 1.196 1.00 0.00 H ATOM 168 N LEU A1094 -4.048 1.712 3.254 1.00 7.96 N ATOM 169 CA LEU A1094 -4.105 0.887 4.452 1.00 6.86 C ATOM 170 C LEU A1094 -5.412 0.131 4.615 1.00 7.56 C ATOM 171 O LEU A1094 -5.434 -0.902 5.300 1.00 8.93 O ATOM 172 CB LEU A1094 -3.854 1.754 5.686 1.00 8.54 C ATOM 173 CG LEU A1094 -2.473 2.415 5.738 1.00 9.02 C ATOM 174 CD1 LEU A1094 -2.433 3.508 6.775 1.00 10.27 C ATOM 175 CD2 LEU A1094 -1.389 1.395 6.001 1.00 11.37 C ATOM 176 H LEU A1094 -4.433 2.678 3.277 1.00 0.00 H ATOM 177 N MET A1095 -6.503 0.603 4.021 1.00 9.29 N ATOM 178 CA MET A1095 -7.784 -0.083 4.178 1.00 11.42 C ATOM 179 C MET A1095 -7.737 -1.576 3.868 1.00 11.53 C ATOM 180 O MET A1095 -8.387 -2.344 4.598 1.00 11.29 O ATOM 181 CB MET A1095 -8.888 0.624 3.375 1.00 13.69 C ATOM 182 CG MET A1095 -10.291 0.091 3.680 1.00 17.98 C ATOM 183 SD MET A1095 -10.826 0.466 5.362 1.00 17.88 S ATOM 184 CE MET A1095 -10.970 2.245 5.257 1.00 22.45 C ATOM 185 H MET A1095 -6.445 1.465 3.442 1.00 0.00 H ATOM 186 N PRO A1096 -7.018 -2.062 2.850 1.00 10.77 N ATOM 187 CA PRO A1096 -6.992 -3.518 2.632 1.00 11.68 C ATOM 188 C PRO A1096 -6.459 -4.307 3.814 1.00 10.39 C ATOM 189 O PRO A1096 -6.897 -5.447 4.024 1.00 10.69 O ATOM 190 CB PRO A1096 -6.115 -3.676 1.381 1.00 13.98 C ATOM 191 CG PRO A1096 -6.276 -2.373 0.658 1.00 15.10 C ATOM 192 CD PRO A1096 -6.363 -1.337 1.742 1.00 11.61 C ATOM 193 N THR A1097 -5.530 -3.743 4.590 1.00 9.41 N ATOM 194 CA THR A1097 -5.040 -4.461 5.764 1.00 9.15 C ATOM 195 C THR A1097 -6.113 -4.573 6.837 1.00 8.31 C ATOM 196 O THR A1097 -6.180 -5.590 7.542 1.00 9.92 O ATOM 197 CB THR A1097 -3.760 -3.827 6.328 1.00 9.22 C ATOM 198 OG1 THR A1097 -4.045 -2.563 6.953 1.00 8.60 O ATOM 199 CG2 THR A1097 -2.724 -3.638 5.224 1.00 10.35 C ATOM 200 HG1 THR A1097 -4.438 -1.947 6.285 1.00 0.00 H ATOM 201 H THR A1097 -5.158 -2.799 4.360 1.00 0.00 H ATOM 202 N LEU A1098 -6.962 -3.553 6.956 1.00 9.03 N ATOM 203 CA LEU A1098 -8.067 -3.604 7.906 1.00 9.36 C ATOM 204 C LEU A1098 -9.137 -4.578 7.434 1.00 9.08 C ATOM 205 O LEU A1098 -9.678 -5.356 8.233 1.00 9.73 O ATOM 206 CB LEU A1098 -8.650 -2.200 8.070 1.00 11.54 C ATOM 207 CG LEU A1098 -9.690 -2.024 9.168 1.00 12.32 C ATOM 208 CD1 LEU A1098 -9.068 -2.362 10.486 1.00 13.18 C ATOM 209 CD2 LEU A1098 -10.196 -0.596 9.165 1.00 14.36 C ATOM 210 H LEU A1098 -6.835 -2.708 6.363 1.00 0.00 H ATOM 211 N GLU A1099 -9.435 -4.573 6.135 1.00 9.91 N ATOM 212 CA GLU A1099 -10.388 -5.530 5.590 1.00 11.87 C ATOM 213 C GLU A1099 -9.937 -6.965 5.821 1.00 10.90 C ATOM 214 O GLU A1099 -10.777 -7.842 6.060 1.00 11.12 O ATOM 215 CB GLU A1099 -10.613 -5.255 4.101 1.00 13.17 C ATOM 216 CG GLU A1099 -11.370 -3.962 3.831 1.00 16.60 C ATOM 217 CD GLU A1099 -11.422 -3.587 2.358 1.00 24.97 C ATOM 218 OE1 GLU A1099 -10.574 -4.073 1.581 1.00 28.28 O ATOM 219 OE2 GLU A1099 -12.310 -2.789 1.983 1.00 30.56 O ATOM 220 H GLU A1099 -8.983 -3.880 5.505 1.00 0.00 H ATOM 221 N ALA A1100 -8.627 -7.220 5.765 1.00 10.78 N ATOM 222 CA ALA A1100 -8.109 -8.556 6.040 1.00 11.12 C ATOM 223 C ALA A1100 -8.439 -8.996 7.462 1.00 10.39 C ATOM 224 O ALA A1100 -8.712 -10.180 7.709 1.00 11.82 O ATOM 225 CB ALA A1100 -6.601 -8.604 5.792 1.00 11.10 C ATOM 226 H ALA A1100 -7.966 -6.455 5.522 1.00 0.00 H ATOM 227 N LEU A1101 -8.410 -8.064 8.418 1.00 9.32 N ATOM 228 CA LEU A1101 -8.796 -8.427 9.779 1.00 9.64 C ATOM 229 C LEU A1101 -10.289 -8.724 9.867 1.00 8.27 C ATOM 230 O LEU A1101 -10.695 -9.709 10.503 1.00 9.97 O ATOM 231 CB LEU A1101 -8.397 -7.324 10.756 1.00 9.11 C ATOM 232 CG LEU A1101 -6.910 -6.957 10.772 1.00 10.08 C ATOM 233 CD1 LEU A1101 -6.626 -5.866 11.798 1.00 11.34 C ATOM 234 CD2 LEU A1101 -6.050 -8.190 11.038 1.00 13.82 C ATOM 235 H LEU A1101 -8.116 -7.091 8.196 1.00 0.00 H ATOM 236 N TYR A1102 -11.120 -7.904 9.216 1.00 10.13 N ATOM 237 CA TYR A1102 -12.562 -8.133 9.233 1.00 10.58 C ATOM 238 C TYR A1102 -12.939 -9.461 8.593 1.00 11.27 C ATOM 239 O TYR A1102 -13.966 -10.043 8.950 1.00 13.31 O ATOM 240 CB TYR A1102 -13.295 -6.998 8.516 1.00 9.94 C ATOM 241 CG TYR A1102 -13.637 -5.803 9.378 1.00 9.58 C ATOM 242 CD1 TYR A1102 -14.854 -5.730 10.048 1.00 12.30 C ATOM 243 CD2 TYR A1102 -12.765 -4.734 9.494 1.00 10.22 C ATOM 244 CE1 TYR A1102 -15.181 -4.632 10.823 1.00 11.62 C ATOM 245 CE2 TYR A1102 -13.083 -3.634 10.268 1.00 10.41 C ATOM 246 CZ TYR A1102 -14.292 -3.587 10.932 1.00 9.68 C ATOM 247 OH TYR A1102 -14.618 -2.490 11.699 1.00 10.23 O ATOM 248 HH TYR A1102 -15.513 -2.623 12.100 1.00 0.00 H ATOM 249 H TYR A1102 -10.735 -7.093 8.691 1.00 0.00 H ATOM 250 N ARG A1103 -12.138 -9.952 7.648 1.00 11.27 N ATOM 251 CA ARG A1103 -12.451 -11.214 6.987 1.00 12.09 C ATOM 252 C ARG A1103 -12.191 -12.432 7.861 1.00 11.61 C ATOM 253 O ARG A1103 -12.608 -13.535 7.491 1.00 14.46 O ATOM 254 CB ARG A1103 -11.649 -11.354 5.691 1.00 14.24 C ATOM 255 CG ARG A1103 -12.222 -10.595 4.504 1.00 18.13 C ATOM 256 CD ARG A1103 -11.619 -11.074 3.186 1.00 20.02 C ATOM 257 NE ARG A1103 -10.165 -10.934 3.140 1.00 17.35 N ATOM 258 CZ ARG A1103 -9.528 -9.836 2.739 1.00 14.59 C ATOM 259 NH1 ARG A1103 -10.216 -8.770 2.349 1.00 19.81 N ATOM 260 NH2 ARG A1103 -8.205 -9.805 2.726 1.00 20.74 N ATOM 261 HE ARG A1103 -9.590 -11.746 3.441 1.00 0.00 H ATOM 262 HH12 ARG A1103 -9.715 -7.914 2.036 1.00 0.00 H ATOM 263 HH11 ARG A1103 -11.256 -8.791 2.356 1.00 0.00 H ATOM 264 HH22 ARG A1103 -7.708 -8.947 2.413 1.00 0.00 H ATOM 265 HH21 ARG A1103 -7.662 -10.639 3.029 1.00 0.00 H ATOM 266 H ARG A1103 -11.280 -9.430 7.379 1.00 0.00 H ATOM 267 N GLN A1104 -11.504 -12.281 8.989 1.00 10.59 N ATOM 268 CA GLN A1104 -11.194 -13.426 9.840 1.00 10.75 C ATOM 269 C GLN A1104 -12.432 -13.810 10.639 1.00 11.30 C ATOM 270 O GLN A1104 -12.892 -13.048 11.497 1.00 12.28 O ATOM 271 CB GLN A1104 -10.031 -13.115 10.775 1.00 12.59 C ATOM 272 CG GLN A1104 -8.772 -12.647 10.070 1.00 12.89 C ATOM 273 CD GLN A1104 -8.339 -13.561 8.946 1.00 12.81 C ATOM 274 OE1 GLN A1104 -8.179 -14.768 9.132 1.00 14.10 O ATOM 275 NE2 GLN A1104 -8.142 -12.988 7.765 1.00 13.83 N ATOM 276 HE22 GLN A1104 -8.289 -11.965 7.653 1.00 0.00 H ATOM 277 HE21 GLN A1104 -7.841 -13.562 6.952 1.00 0.00 H ATOM 278 H GLN A1104 -11.182 -11.333 9.270 1.00 0.00 H ATOM 279 N ASP A1105 -12.953 -15.003 10.370 1.00 11.82 N ATOM 280 CA ASP A1105 -14.142 -15.532 11.025 1.00 12.36 C ATOM 281 C ASP A1105 -13.733 -16.875 11.603 1.00 12.98 C ATOM 282 O ASP A1105 -13.330 -17.762 10.855 1.00 13.92 O ATOM 283 CB ASP A1105 -15.235 -15.708 9.961 1.00 17.34 C ATOM 284 CG ASP A1105 -16.468 -16.437 10.476 1.00 24.57 C ATOM 285 OD1 ASP A1105 -16.718 -16.449 11.701 1.00 21.57 O ATOM 286 OD2 ASP A1105 -17.199 -17.008 9.628 1.00 36.95 O ATOM 287 H ASP A1105 -12.486 -15.592 9.652 1.00 0.00 H ATOM 288 N PRO A1106 -13.878 -17.064 12.927 1.00 11.78 N ATOM 289 CA PRO A1106 -14.561 -16.192 13.891 1.00 12.31 C ATOM 290 C PRO A1106 -13.669 -15.188 14.616 1.00 10.57 C ATOM 291 O PRO A1106 -14.170 -14.474 15.485 1.00 11.92 O ATOM 292 CB PRO A1106 -15.087 -17.196 14.918 1.00 13.86 C ATOM 293 CG PRO A1106 -14.018 -18.230 14.965 1.00 14.37 C ATOM 294 CD PRO A1106 -13.530 -18.366 13.532 1.00 13.38 C ATOM 295 N GLU A1107 -12.386 -15.114 14.263 1.00 10.65 N ATOM 296 CA GLU A1107 -11.431 -14.444 15.141 1.00 11.53 C ATOM 297 C GLU A1107 -11.647 -12.939 15.244 1.00 9.68 C ATOM 298 O GLU A1107 -11.265 -12.352 16.264 1.00 10.61 O ATOM 299 CB GLU A1107 -9.994 -14.776 14.753 1.00 11.81 C ATOM 300 CG GLU A1107 -9.636 -16.243 14.952 1.00 12.57 C ATOM 301 CD GLU A1107 -9.861 -17.098 13.706 1.00 13.52 C ATOM 302 OE1 GLU A1107 -10.521 -16.642 12.746 1.00 12.38 O ATOM 303 OE2 GLU A1107 -9.372 -18.247 13.686 1.00 17.73 O ATOM 304 H GLU A1107 -12.066 -15.532 13.366 1.00 0.00 H ATOM 305 N SER A1108 -12.263 -12.302 14.248 1.00 9.56 N ATOM 306 CA SER A1108 -12.499 -10.866 14.335 1.00 9.59 C ATOM 307 C SER A1108 -13.706 -10.510 15.194 1.00 8.36 C ATOM 308 O SER A1108 -13.842 -9.347 15.594 1.00 8.73 O ATOM 309 CB SER A1108 -12.676 -10.263 12.944 1.00 13.47 C ATOM 310 OG SER A1108 -13.886 -10.699 12.373 1.00 14.79 O ATOM 311 HG SER A1108 -13.878 -11.686 12.299 1.00 0.00 H ATOM 312 H SER A1108 -12.575 -12.830 13.408 1.00 0.00 H ATOM 313 N LEU A1109 -14.588 -11.467 15.485 1.00 9.04 N ATOM 314 CA LEU A1109 -15.846 -11.120 16.140 1.00 9.58 C ATOM 315 C LEU A1109 -15.667 -10.421 17.481 1.00 9.12 C ATOM 316 O LEU A1109 -16.399 -9.449 17.736 1.00 9.52 O ATOM 317 CB LEU A1109 -16.766 -12.344 16.245 1.00 10.80 C ATOM 318 CG LEU A1109 -17.264 -12.891 14.906 1.00 13.97 C ATOM 319 CD1 LEU A1109 -18.060 -14.178 15.107 1.00 15.16 C ATOM 320 CD2 LEU A1109 -18.091 -11.852 14.164 1.00 21.94 C ATOM 321 H LEU A1109 -14.380 -12.458 15.246 1.00 0.00 H ATOM 322 N PRO A1110 -14.743 -10.830 18.358 1.00 8.17 N ATOM 323 CA PRO A1110 -14.577 -10.105 19.624 1.00 8.53 C ATOM 324 C PRO A1110 -13.959 -8.725 19.480 1.00 7.95 C ATOM 325 O PRO A1110 -13.843 -8.018 20.492 1.00 8.31 O ATOM 326 CB PRO A1110 -13.659 -11.030 20.442 1.00 9.27 C ATOM 327 CG PRO A1110 -13.806 -12.376 19.811 1.00 9.82 C ATOM 328 CD PRO A1110 -13.960 -12.079 18.350 1.00 9.80 C ATOM 329 N PHE A1111 -13.548 -8.331 18.272 1.00 7.22 N ATOM 330 CA PHE A1111 -12.834 -7.083 18.041 1.00 6.60 C ATOM 331 C PHE A1111 -13.621 -6.093 17.210 1.00 6.48 C ATOM 332 O PHE A1111 -13.143 -4.975 16.989 1.00 7.71 O ATOM 333 CB PHE A1111 -11.463 -7.363 17.412 1.00 8.16 C ATOM 334 CG PHE A1111 -10.609 -8.229 18.276 1.00 7.49 C ATOM 335 CD1 PHE A1111 -9.793 -7.662 19.235 1.00 10.21 C ATOM 336 CD2 PHE A1111 -10.673 -9.616 18.187 1.00 10.78 C ATOM 337 CE1 PHE A1111 -9.039 -8.465 20.075 1.00 12.09 C ATOM 338 CE2 PHE A1111 -9.919 -10.411 19.017 1.00 12.73 C ATOM 339 CZ PHE A1111 -9.105 -9.840 19.961 1.00 13.22 C ATOM 340 H PHE A1111 -13.747 -8.945 17.457 1.00 0.00 H ATOM 341 N ARG A1112 -14.826 -6.459 16.769 1.00 7.07 N ATOM 342 CA ARG A1112 -15.577 -5.601 15.866 1.00 8.01 C ATOM 343 C ARG A1112 -16.136 -4.368 16.556 1.00 7.65 C ATOM 344 O ARG A1112 -16.304 -3.330 15.907 1.00 9.39 O ATOM 345 CB ARG A1112 -16.699 -6.395 15.205 1.00 9.78 C ATOM 346 CG ARG A1112 -16.196 -7.280 14.106 1.00 10.87 C ATOM 347 CD ARG A1112 -17.308 -8.085 13.494 1.00 12.66 C ATOM 348 NE ARG A1112 -16.847 -8.734 12.271 1.00 14.83 N ATOM 349 CZ ARG A1112 -17.206 -8.362 11.047 1.00 14.61 C ATOM 350 NH1 ARG A1112 -18.046 -7.352 10.877 1.00 13.98 N ATOM 351 NH2 ARG A1112 -16.726 -9.009 9.994 1.00 18.39 N ATOM 352 HE ARG A1112 -16.196 -9.539 12.363 1.00 0.00 H ATOM 353 HH12 ARG A1112 -18.325 -7.063 9.918 1.00 0.00 H ATOM 354 HH11 ARG A1112 -18.427 -6.848 11.703 1.00 0.00 H ATOM 355 HH22 ARG A1112 -17.005 -8.720 9.035 1.00 0.00 H ATOM 356 HH21 ARG A1112 -16.070 -9.805 10.127 1.00 0.00 H ATOM 357 H ARG A1112 -15.232 -7.367 17.074 1.00 0.00 H ATOM 358 N GLN A1113 -16.441 -4.456 17.843 1.00 7.76 N ATOM 359 CA GLN A1113 -17.044 -3.357 18.571 1.00 7.72 C ATOM 360 C GLN A1113 -16.264 -3.132 19.854 1.00 7.70 C ATOM 361 O GLN A1113 -15.539 -4.019 20.312 1.00 7.74 O ATOM 362 CB GLN A1113 -18.519 -3.665 18.876 1.00 10.46 C ATOM 363 CG GLN A1113 -19.423 -3.616 17.640 1.00 10.92 C ATOM 364 CD GLN A1113 -19.694 -2.200 17.162 1.00 13.03 C ATOM 365 OE1 GLN A1113 -20.046 -1.326 17.955 1.00 13.14 O ATOM 366 NE2 GLN A1113 -19.528 -1.964 15.863 1.00 13.18 N ATOM 367 HE22 GLN A1113 -19.229 -2.732 15.229 1.00 0.00 H ATOM 368 HE21 GLN A1113 -19.697 -1.011 15.482 1.00 0.00 H ATOM 369 H GLN A1113 -16.241 -5.343 18.347 1.00 0.00 H ATOM 370 N PRO A1114 -16.372 -1.939 20.443 1.00 7.77 N ATOM 371 CA PRO A1114 -15.646 -1.669 21.688 1.00 7.82 C ATOM 372 C PRO A1114 -16.054 -2.648 22.775 1.00 7.57 C ATOM 373 O PRO A1114 -17.230 -2.997 22.914 1.00 8.26 O ATOM 374 CB PRO A1114 -16.085 -0.246 22.050 1.00 8.78 C ATOM 375 CG PRO A1114 -16.502 0.358 20.749 1.00 9.36 C ATOM 376 CD PRO A1114 -17.139 -0.762 19.993 1.00 8.26 C ATOM 377 N VAL A1115 -15.068 -3.084 23.558 1.00 7.48 N ATOM 378 CA VAL A1115 -15.360 -3.883 24.744 1.00 8.01 C ATOM 379 C VAL A1115 -16.350 -3.145 25.632 1.00 7.70 C ATOM 380 O VAL A1115 -16.145 -1.974 25.972 1.00 8.38 O ATOM 381 CB VAL A1115 -14.070 -4.193 25.514 1.00 7.92 C ATOM 382 CG1 VAL A1115 -14.394 -4.829 26.865 1.00 9.21 C ATOM 383 CG2 VAL A1115 -13.174 -5.091 24.688 1.00 10.00 C ATOM 384 H VAL A1115 -14.082 -2.853 23.322 1.00 0.00 H ATOM 385 N ASP A1116 -17.430 -3.837 26.019 1.00 8.37 N ATOM 386 CA ASP A1116 -18.443 -3.310 26.931 1.00 8.91 C ATOM 387 C ASP A1116 -18.289 -4.037 28.262 1.00 9.22 C ATOM 388 O ASP A1116 -18.724 -5.193 28.388 1.00 9.05 O ATOM 389 CB ASP A1116 -19.835 -3.554 26.336 1.00 11.78 C ATOM 390 CG ASP A1116 -20.957 -2.942 27.167 1.00 13.16 C ATOM 391 OD1 ASP A1116 -20.793 -2.780 28.393 1.00 14.00 O ATOM 392 OD2 ASP A1116 -22.018 -2.632 26.580 1.00 16.83 O ATOM 393 H ASP A1116 -17.554 -4.802 25.650 1.00 0.00 H ATOM 394 N PRO A1117 -17.660 -3.427 29.270 1.00 8.34 N ATOM 395 CA PRO A1117 -17.410 -4.153 30.522 1.00 9.71 C ATOM 396 C PRO A1117 -18.674 -4.572 31.246 1.00 10.42 C ATOM 397 O PRO A1117 -18.664 -5.594 31.943 1.00 11.65 O ATOM 398 CB PRO A1117 -16.589 -3.149 31.341 1.00 10.09 C ATOM 399 CG PRO A1117 -15.911 -2.290 30.301 1.00 9.47 C ATOM 400 CD PRO A1117 -16.974 -2.122 29.252 1.00 9.54 C ATOM 401 N GLN A1118 -19.755 -3.806 31.127 1.00 10.69 N ATOM 402 CA GLN A1118 -20.992 -4.201 31.794 1.00 12.31 C ATOM 403 C GLN A1118 -21.601 -5.416 31.109 1.00 12.21 C ATOM 404 O GLN A1118 -21.956 -6.404 31.764 1.00 13.81 O ATOM 405 CB GLN A1118 -21.976 -3.034 31.807 1.00 15.71 C ATOM 406 CG GLN A1118 -23.213 -3.320 32.635 1.00 18.17 C ATOM 407 CD GLN A1118 -24.236 -2.209 32.559 1.00 28.41 C ATOM 408 OE1 GLN A1118 -24.048 -1.216 31.854 1.00 31.17 O ATOM 409 NE2 GLN A1118 -25.333 -2.374 33.285 1.00 23.73 N ATOM 410 HE22 GLN A1118 -25.449 -3.229 33.866 1.00 0.00 H ATOM 411 HE21 GLN A1118 -26.078 -1.648 33.274 1.00 0.00 H ATOM 412 H GLN A1118 -19.719 -2.933 30.563 1.00 0.00 H ATOM 413 N LEU A1119 -21.716 -5.358 29.782 1.00 13.10 N ATOM 414 CA LEU A1119 -22.233 -6.485 29.017 1.00 13.26 C ATOM 415 C LEU A1119 -21.434 -7.747 29.293 1.00 11.76 C ATOM 416 O LEU A1119 -22.005 -8.833 29.473 1.00 14.75 O ATOM 417 CB LEU A1119 -22.168 -6.137 27.532 1.00 13.28 C ATOM 418 CG LEU A1119 -22.538 -7.223 26.533 1.00 12.55 C ATOM 419 CD1 LEU A1119 -23.985 -7.655 26.740 1.00 17.06 C ATOM 420 CD2 LEU A1119 -22.311 -6.721 25.111 1.00 17.36 C ATOM 421 H LEU A1119 -21.431 -4.491 29.283 1.00 0.00 H ATOM 422 N LEU A1120 -20.113 -7.624 29.351 1.00 10.86 N ATOM 423 CA LEU A1120 -19.229 -8.764 29.495 1.00 10.90 C ATOM 424 C LEU A1120 -18.954 -9.125 30.949 1.00 12.79 C ATOM 425 O LEU A1120 -18.257 -10.112 31.203 1.00 15.75 O ATOM 426 CB LEU A1120 -17.923 -8.525 28.727 1.00 12.64 C ATOM 427 CG LEU A1120 -18.146 -8.342 27.220 1.00 13.88 C ATOM 428 CD1 LEU A1120 -16.909 -7.768 26.553 1.00 14.05 C ATOM 429 CD2 LEU A1120 -18.574 -9.642 26.542 1.00 18.57 C ATOM 430 H LEU A1120 -19.696 -6.673 29.291 1.00 0.00 H ATOM 431 N GLY A1121 -19.484 -8.367 31.902 1.00 12.39 N ATOM 432 CA GLY A1121 -19.304 -8.703 33.306 1.00 15.29 C ATOM 433 C GLY A1121 -17.871 -8.617 33.782 1.00 13.91 C ATOM 434 O GLY A1121 -17.441 -9.441 34.601 1.00 15.93 O ATOM 435 H GLY A1121 -20.034 -7.524 31.642 1.00 0.00 H ATOM 436 N ILE A1122 -17.122 -7.633 33.291 1.00 12.61 N ATOM 437 CA ILE A1122 -15.714 -7.449 33.642 1.00 11.84 C ATOM 438 C ILE A1122 -15.496 -6.020 34.138 1.00 11.86 C ATOM 439 O ILE A1122 -14.888 -5.197 33.435 1.00 10.89 O ATOM 440 CB ILE A1122 -14.791 -7.843 32.473 1.00 12.58 C ATOM 441 CG1 ILE A1122 -15.227 -7.192 31.150 1.00 11.14 C ATOM 442 CG2 ILE A1122 -14.769 -9.361 32.308 1.00 14.49 C ATOM 443 CD1 ILE A1122 -14.307 -7.515 29.989 1.00 12.69 C ATOM 444 H ILE A1122 -17.558 -6.963 32.626 1.00 0.00 H ATOM 445 N PRO A1123 -15.971 -5.674 35.338 1.00 11.64 N ATOM 446 CA PRO A1123 -15.928 -4.266 35.766 1.00 12.45 C ATOM 447 C PRO A1123 -14.532 -3.698 35.946 1.00 11.04 C ATOM 448 O PRO A1123 -14.399 -2.470 35.989 1.00 13.74 O ATOM 449 CB PRO A1123 -16.722 -4.262 37.081 1.00 16.06 C ATOM 450 CG PRO A1123 -16.735 -5.687 37.529 1.00 17.82 C ATOM 451 CD PRO A1123 -16.715 -6.517 36.289 1.00 14.33 C ATOM 452 N ASP A1124 -13.491 -4.526 36.040 1.00 10.25 N ATOM 453 CA ASP A1124 -12.138 -3.992 36.135 1.00 10.62 C ATOM 454 C ASP A1124 -11.529 -3.633 34.784 1.00 9.17 C ATOM 455 O ASP A1124 -10.392 -3.156 34.755 1.00 10.63 O ATOM 456 CB ASP A1124 -11.209 -4.952 36.887 1.00 11.63 C ATOM 457 CG ASP A1124 -10.949 -6.236 36.133 1.00 10.72 C ATOM 458 OD1 ASP A1124 -11.788 -6.644 35.308 1.00 10.70 O ATOM 459 OD2 ASP A1124 -9.885 -6.843 36.371 1.00 14.64 O ATOM 460 H ASP A1124 -13.645 -5.555 36.046 1.00 0.00 H ATOM 461 N TYR A1125 -12.254 -3.819 33.677 1.00 8.82 N ATOM 462 CA TYR A1125 -11.644 -3.664 32.358 1.00 7.74 C ATOM 463 C TYR A1125 -11.039 -2.275 32.169 1.00 7.33 C ATOM 464 O TYR A1125 -9.872 -2.144 31.778 1.00 7.92 O ATOM 465 CB TYR A1125 -12.656 -3.968 31.258 1.00 8.37 C ATOM 466 CG TYR A1125 -12.017 -3.902 29.890 1.00 7.00 C ATOM 467 CD1 TYR A1125 -11.291 -4.978 29.398 1.00 7.49 C ATOM 468 CD2 TYR A1125 -12.118 -2.761 29.097 1.00 7.93 C ATOM 469 CE1 TYR A1125 -10.678 -4.924 28.148 1.00 8.48 C ATOM 470 CE2 TYR A1125 -11.515 -2.698 27.848 1.00 8.38 C ATOM 471 CZ TYR A1125 -10.796 -3.775 27.382 1.00 7.60 C ATOM 472 OH TYR A1125 -10.196 -3.699 26.145 1.00 8.04 O ATOM 473 HH TYR A1125 -9.721 -4.547 25.957 1.00 0.00 H ATOM 474 H TYR A1125 -13.259 -4.076 33.755 1.00 0.00 H ATOM 475 N PHE A1126 -11.815 -1.220 32.436 1.00 7.64 N ATOM 476 CA PHE A1126 -11.307 0.133 32.235 1.00 8.41 C ATOM 477 C PHE A1126 -10.282 0.543 33.287 1.00 8.40 C ATOM 478 O PHE A1126 -9.597 1.556 33.092 1.00 10.35 O ATOM 479 CB PHE A1126 -12.454 1.142 32.239 1.00 8.76 C ATOM 480 CG PHE A1126 -13.336 1.106 31.013 1.00 8.63 C ATOM 481 CD1 PHE A1126 -12.849 0.759 29.751 1.00 9.05 C ATOM 482 CD2 PHE A1126 -14.673 1.452 31.135 1.00 9.83 C ATOM 483 CE1 PHE A1126 -13.697 0.759 28.647 1.00 9.92 C ATOM 484 CE2 PHE A1126 -15.515 1.451 30.049 1.00 10.48 C ATOM 485 CZ PHE A1126 -15.030 1.108 28.802 1.00 9.45 C ATOM 486 H PHE A1126 -12.783 -1.364 32.788 1.00 0.00 H ATOM 487 N ASP A1127 -10.171 -0.191 34.396 1.00 9.05 N ATOM 488 CA ASP A1127 -9.069 0.049 35.322 1.00 10.06 C ATOM 489 C ASP A1127 -7.751 -0.405 34.716 1.00 10.90 C ATOM 490 O ASP A1127 -6.717 0.252 34.892 1.00 12.97 O ATOM 491 CB ASP A1127 -9.297 -0.695 36.640 1.00 13.37 C ATOM 492 CG ASP A1127 -10.487 -0.173 37.418 1.00 16.04 C ATOM 493 OD1 ASP A1127 -10.728 1.049 37.404 1.00 27.12 O ATOM 494 OD2 ASP A1127 -11.179 -0.991 38.062 1.00 25.01 O ATOM 495 H ASP A1127 -10.870 -0.934 34.600 1.00 0.00 H ATOM 496 N ILE A1128 -7.769 -1.524 33.994 1.00 10.55 N ATOM 497 CA ILE A1128 -6.558 -2.117 33.434 1.00 9.60 C ATOM 498 C ILE A1128 -6.240 -1.554 32.057 1.00 9.49 C ATOM 499 O ILE A1128 -5.073 -1.309 31.735 1.00 9.83 O ATOM 500 CB ILE A1128 -6.708 -3.652 33.400 1.00 10.85 C ATOM 501 CG1 ILE A1128 -6.724 -4.209 34.826 1.00 14.40 C ATOM 502 CG2 ILE A1128 -5.593 -4.295 32.587 1.00 11.69 C ATOM 503 CD1 ILE A1128 -6.877 -5.712 34.888 1.00 20.73 C ATOM 504 H ILE A1128 -8.681 -1.994 33.822 1.00 0.00 H ATOM 505 N VAL A1129 -7.266 -1.368 31.234 1.00 8.76 N ATOM 506 CA VAL A1129 -7.116 -0.918 29.855 1.00 8.84 C ATOM 507 C VAL A1129 -7.439 0.569 29.827 1.00 8.87 C ATOM 508 O VAL A1129 -8.609 0.973 29.809 1.00 9.71 O ATOM 509 CB VAL A1129 -8.005 -1.725 28.905 1.00 7.41 C ATOM 510 CG1 VAL A1129 -7.915 -1.194 27.487 1.00 8.80 C ATOM 511 CG2 VAL A1129 -7.599 -3.190 28.952 1.00 10.05 C ATOM 512 H VAL A1129 -8.225 -1.553 31.591 1.00 0.00 H ATOM 513 N LYS A1130 -6.390 1.391 29.814 1.00 8.38 N ATOM 514 CA LYS A1130 -6.567 2.833 29.901 1.00 9.52 C ATOM 515 C LYS A1130 -6.899 3.469 28.562 1.00 9.03 C ATOM 516 O LYS A1130 -7.456 4.572 28.539 1.00 9.92 O ATOM 517 CB LYS A1130 -5.320 3.479 30.508 1.00 13.54 C ATOM 518 CG LYS A1130 -5.003 2.994 31.913 1.00 18.64 C ATOM 519 CD LYS A1130 -3.977 3.905 32.577 1.00 22.65 C ATOM 520 CE LYS A1130 -3.532 3.361 33.922 1.00 33.90 C ATOM 521 NZ LYS A1130 -4.403 2.242 34.358 1.00 37.30 N ATOM 522 HZ1 LYS A1130 -5.383 2.580 34.442 1.00 0.00 H ATOM 523 HZ2 LYS A1130 -4.358 1.476 33.656 1.00 0.00 H ATOM 524 HZ3 LYS A1130 -4.076 1.889 35.280 1.00 0.00 H ATOM 525 H LYS A1130 -5.431 0.996 29.741 1.00 0.00 H ATOM 526 N ASN A1131 -6.564 2.817 27.457 1.00 7.90 N ATOM 527 CA ASN A1131 -6.823 3.345 26.118 1.00 7.97 C ATOM 528 C ASN A1131 -7.428 2.250 25.252 1.00 6.89 C ATOM 529 O ASN A1131 -6.731 1.621 24.447 1.00 7.38 O ATOM 530 CB ASN A1131 -5.554 3.911 25.486 1.00 9.26 C ATOM 531 CG ASN A1131 -5.031 5.108 26.238 1.00 12.03 C ATOM 532 OD1 ASN A1131 -5.614 6.189 26.177 1.00 13.36 O ATOM 533 ND2 ASN A1131 -3.935 4.923 26.965 1.00 16.18 N ATOM 534 HD22 ASN A1131 -3.476 3.990 26.986 1.00 0.00 H ATOM 535 HD21 ASN A1131 -3.536 5.711 27.514 1.00 0.00 H ATOM 536 H ASN A1131 -6.098 1.892 27.546 1.00 0.00 H ATOM 537 N PRO A1132 -8.729 1.999 25.391 1.00 6.59 N ATOM 538 CA PRO A1132 -9.367 0.932 24.610 1.00 6.11 C ATOM 539 C PRO A1132 -9.312 1.215 23.116 1.00 7.00 C ATOM 540 O PRO A1132 -9.286 2.368 22.677 1.00 7.74 O ATOM 541 CB PRO A1132 -10.816 0.946 25.115 1.00 8.15 C ATOM 542 CG PRO A1132 -10.727 1.563 26.489 1.00 8.24 C ATOM 543 CD PRO A1132 -9.644 2.595 26.380 1.00 8.41 C ATOM 544 N MET A1133 -9.330 0.147 22.324 1.00 6.55 N ATOM 545 CA MET A1133 -9.330 0.288 20.876 1.00 6.56 C ATOM 546 C MET A1133 -9.972 -0.956 20.283 1.00 5.88 C ATOM 547 O MET A1133 -9.878 -2.045 20.852 1.00 7.08 O ATOM 548 CB MET A1133 -7.899 0.469 20.347 1.00 6.66 C ATOM 549 CG MET A1133 -7.785 0.799 18.862 1.00 7.40 C ATOM 550 SD MET A1133 -8.726 2.255 18.338 1.00 7.93 S ATOM 551 CE MET A1133 -8.119 3.536 19.447 1.00 9.67 C ATOM 552 H MET A1133 -9.344 -0.803 22.746 1.00 0.00 H ATOM 553 N ASP A1134 -10.627 -0.792 19.137 1.00 6.36 N ATOM 554 CA ASP A1134 -11.310 -1.896 18.477 1.00 6.56 C ATOM 555 C ASP A1134 -11.409 -1.581 16.989 1.00 6.43 C ATOM 556 O ASP A1134 -11.112 -0.465 16.550 1.00 6.83 O ATOM 557 CB ASP A1134 -12.721 -2.108 19.044 1.00 7.50 C ATOM 558 CG ASP A1134 -13.649 -1.005 18.651 1.00 7.71 C ATOM 559 OD1 ASP A1134 -13.443 0.126 19.126 1.00 8.88 O ATOM 560 OD2 ASP A1134 -14.563 -1.254 17.839 1.00 9.35 O ATOM 561 H ASP A1134 -10.652 0.151 18.700 1.00 0.00 H ATOM 562 N LEU A1135 -11.862 -2.569 16.209 1.00 6.85 N ATOM 563 CA LEU A1135 -11.913 -2.416 14.757 1.00 7.20 C ATOM 564 C LEU A1135 -12.829 -1.276 14.328 1.00 7.74 C ATOM 565 O LEU A1135 -12.500 -0.540 13.391 1.00 8.01 O ATOM 566 CB LEU A1135 -12.351 -3.721 14.101 1.00 8.43 C ATOM 567 CG LEU A1135 -11.368 -4.884 14.148 1.00 7.35 C ATOM 568 CD1 LEU A1135 -12.043 -6.164 13.659 1.00 9.48 C ATOM 569 CD2 LEU A1135 -10.106 -4.592 13.328 1.00 9.14 C ATOM 570 H LEU A1135 -12.182 -3.458 16.642 1.00 0.00 H ATOM 571 N SER A1136 -13.989 -1.110 14.981 1.00 7.83 N ATOM 572 CA SER A1136 -14.903 -0.058 14.537 1.00 8.13 C ATOM 573 C SER A1136 -14.282 1.320 14.711 1.00 7.31 C ATOM 574 O SER A1136 -14.513 2.220 13.896 1.00 8.49 O ATOM 575 CB SER A1136 -16.249 -0.143 15.266 1.00 9.46 C ATOM 576 OG SER A1136 -16.184 0.381 16.584 1.00 9.56 O ATOM 577 HG SER A1136 -15.518 -0.130 17.109 1.00 0.00 H ATOM 578 H SER A1136 -14.234 -1.718 15.788 1.00 0.00 H ATOM 579 N THR A1137 -13.498 1.508 15.776 1.00 7.42 N ATOM 580 CA THR A1137 -12.881 2.806 16.017 1.00 7.35 C ATOM 581 C THR A1137 -11.782 3.077 14.999 1.00 6.99 C ATOM 582 O THR A1137 -11.679 4.187 14.458 1.00 7.79 O ATOM 583 CB THR A1137 -12.348 2.845 17.447 1.00 7.68 C ATOM 584 OG1 THR A1137 -13.446 2.657 18.347 1.00 8.42 O ATOM 585 CG2 THR A1137 -11.689 4.167 17.756 1.00 9.19 C ATOM 586 HG1 THR A1137 -13.871 1.781 18.168 1.00 0.00 H ATOM 587 H THR A1137 -13.327 0.724 16.437 1.00 0.00 H ATOM 588 N ILE A1138 -10.976 2.058 14.702 1.00 6.56 N ATOM 589 CA ILE A1138 -9.929 2.189 13.695 1.00 7.29 C ATOM 590 C ILE A1138 -10.547 2.465 12.336 1.00 6.79 C ATOM 591 O ILE A1138 -10.096 3.348 11.591 1.00 7.92 O ATOM 592 CB ILE A1138 -9.062 0.919 13.670 1.00 6.69 C ATOM 593 CG1 ILE A1138 -8.363 0.721 15.016 1.00 7.69 C ATOM 594 CG2 ILE A1138 -8.050 0.980 12.529 1.00 8.76 C ATOM 595 CD1 ILE A1138 -7.708 -0.633 15.185 1.00 8.24 C ATOM 596 H ILE A1138 -11.096 1.152 15.198 1.00 0.00 H ATOM 597 N LYS A1139 -11.590 1.706 11.989 1.00 7.45 N ATOM 598 CA LYS A1139 -12.251 1.883 10.701 1.00 8.48 C ATOM 599 C LYS A1139 -12.791 3.296 10.548 1.00 7.80 C ATOM 600 O LYS A1139 -12.595 3.939 9.509 1.00 9.08 O ATOM 601 CB LYS A1139 -13.379 0.862 10.558 1.00 9.65 C ATOM 602 CG LYS A1139 -14.197 1.029 9.284 1.00 14.52 C ATOM 603 CD LYS A1139 -15.415 0.112 9.264 1.00 20.94 C ATOM 604 CE LYS A1139 -16.449 0.585 8.248 1.00 34.95 C ATOM 605 NZ LYS A1139 -15.860 0.780 6.889 1.00 38.13 N ATOM 606 HZ1 LYS A1139 -15.106 1.494 6.939 1.00 0.00 H ATOM 607 HZ2 LYS A1139 -15.464 -0.121 6.552 1.00 0.00 H ATOM 608 HZ3 LYS A1139 -16.601 1.101 6.234 1.00 0.00 H ATOM 609 H LYS A1139 -11.936 0.978 12.647 1.00 0.00 H ATOM 610 N ARG A1140 -13.470 3.804 11.576 1.00 8.42 N ATOM 611 CA ARG A1140 -14.032 5.148 11.476 1.00 9.42 C ATOM 612 C ARG A1140 -12.939 6.203 11.346 1.00 8.51 C ATOM 613 O ARG A1140 -13.079 7.165 10.577 1.00 10.13 O ATOM 614 CB ARG A1140 -14.968 5.410 12.657 1.00 10.02 C ATOM 615 CG ARG A1140 -16.204 4.515 12.598 1.00 12.56 C ATOM 616 CD ARG A1140 -16.993 4.487 13.904 1.00 16.27 C ATOM 617 NE ARG A1140 -17.964 3.393 13.904 1.00 17.38 N ATOM 618 CZ ARG A1140 -18.991 3.299 14.743 1.00 14.38 C ATOM 619 NH1 ARG A1140 -19.199 4.248 15.643 1.00 13.78 N ATOM 620 NH2 ARG A1140 -19.819 2.263 14.661 1.00 19.82 N ATOM 621 HE ARG A1140 -17.843 2.637 13.200 1.00 0.00 H ATOM 622 HH12 ARG A1140 -20.002 4.175 16.300 1.00 0.00 H ATOM 623 HH11 ARG A1140 -18.559 5.066 15.693 1.00 0.00 H ATOM 624 HH22 ARG A1140 -20.623 2.187 15.316 1.00 0.00 H ATOM 625 HH21 ARG A1140 -19.663 1.528 13.942 1.00 0.00 H ATOM 626 H ARG A1140 -13.599 3.246 12.444 1.00 0.00 H ATOM 627 N LYS A1141 -11.828 6.027 12.062 1.00 8.11 N ATOM 628 CA LYS A1141 -10.718 6.970 11.942 1.00 8.18 C ATOM 629 C LYS A1141 -10.096 6.927 10.554 1.00 8.26 C ATOM 630 O LYS A1141 -9.801 7.974 9.964 1.00 9.47 O ATOM 631 CB LYS A1141 -9.668 6.702 13.019 1.00 8.75 C ATOM 632 CG LYS A1141 -10.169 7.057 14.410 1.00 10.28 C ATOM 633 CD LYS A1141 -9.201 6.673 15.513 1.00 12.27 C ATOM 634 CE LYS A1141 -7.976 7.550 15.525 1.00 13.16 C ATOM 635 NZ LYS A1141 -7.123 7.260 16.722 1.00 14.15 N ATOM 636 HZ1 LYS A1141 -7.671 7.438 17.588 1.00 0.00 H ATOM 637 HZ2 LYS A1141 -6.822 6.265 16.699 1.00 0.00 H ATOM 638 HZ3 LYS A1141 -6.286 7.877 16.707 1.00 0.00 H ATOM 639 H LYS A1141 -11.751 5.216 12.708 1.00 0.00 H ATOM 640 N LEU A1142 -9.910 5.730 10.005 1.00 7.43 N ATOM 641 CA LEU A1142 -9.320 5.627 8.675 1.00 8.59 C ATOM 642 C LEU A1142 -10.279 6.148 7.608 1.00 8.75 C ATOM 643 O LEU A1142 -9.866 6.886 6.703 1.00 9.71 O ATOM 644 CB LEU A1142 -8.909 4.180 8.397 1.00 9.07 C ATOM 645 CG LEU A1142 -8.023 3.934 7.168 1.00 8.29 C ATOM 646 CD1 LEU A1142 -6.689 4.662 7.281 1.00 9.77 C ATOM 647 CD2 LEU A1142 -7.791 2.435 6.982 1.00 11.72 C ATOM 648 H LEU A1142 -10.184 4.870 10.522 1.00 0.00 H ATOM 649 N ASP A1143 -11.565 5.792 7.713 1.00 9.35 N ATOM 650 CA ASP A1143 -12.583 6.244 6.761 1.00 11.21 C ATOM 651 C ASP A1143 -12.648 7.760 6.688 1.00 8.99 C ATOM 652 O ASP A1143 -12.917 8.325 5.620 1.00 10.28 O ATOM 653 CB ASP A1143 -13.967 5.783 7.225 1.00 14.34 C ATOM 654 CG ASP A1143 -14.249 4.331 6.951 1.00 21.60 C ATOM 655 OD1 ASP A1143 -13.519 3.700 6.171 1.00 20.64 O ATOM 656 OD2 ASP A1143 -15.240 3.822 7.522 1.00 30.54 O ATOM 657 H ASP A1143 -11.852 5.173 8.498 1.00 0.00 H ATOM 658 N THR A1144 -12.489 8.436 7.822 1.00 9.90 N ATOM 659 CA THR A1144 -12.700 9.873 7.902 1.00 11.32 C ATOM 660 C THR A1144 -11.408 10.658 7.776 1.00 11.24 C ATOM 661 O THR A1144 -11.427 11.884 7.923 1.00 14.14 O ATOM 662 CB THR A1144 -13.448 10.254 9.190 1.00 12.23 C ATOM 663 OG1 THR A1144 -12.700 9.830 10.334 1.00 12.70 O ATOM 664 CG2 THR A1144 -14.838 9.622 9.219 1.00 14.89 C ATOM 665 HG1 THR A1144 -12.582 8.848 10.304 1.00 0.00 H ATOM 666 H THR A1144 -12.205 7.921 8.679 1.00 0.00 H ATOM 667 N GLY A1145 -10.291 9.987 7.501 1.00 10.39 N ATOM 668 CA GLY A1145 -9.035 10.676 7.285 1.00 12.18 C ATOM 669 C GLY A1145 -8.405 11.233 8.537 1.00 11.60 C ATOM 670 O GLY A1145 -7.727 12.259 8.470 1.00 13.67 O ATOM 671 H GLY A1145 -10.321 8.949 7.440 1.00 0.00 H ATOM 672 N GLN A1146 -8.604 10.581 9.685 1.00 10.28 N ATOM 673 CA GLN A1146 -8.020 11.071 10.926 1.00 10.51 C ATOM 674 C GLN A1146 -6.567 10.666 11.100 1.00 10.28 C ATOM 675 O GLN A1146 -5.860 11.278 11.909 1.00 13.55 O ATOM 676 CB GLN A1146 -8.832 10.610 12.129 1.00 10.08 C ATOM 677 CG GLN A1146 -10.159 11.317 12.248 1.00 12.38 C ATOM 678 CD GLN A1146 -10.975 10.814 13.414 1.00 12.43 C ATOM 679 OE1 GLN A1146 -10.527 10.846 14.558 1.00 14.21 O ATOM 680 NE2 GLN A1146 -12.174 10.324 13.124 1.00 14.14 N ATOM 681 HE22 GLN A1146 -12.509 10.319 12.140 1.00 0.00 H ATOM 682 HE21 GLN A1146 -12.778 9.945 13.881 1.00 0.00 H ATOM 683 H GLN A1146 -9.181 9.716 9.693 1.00 0.00 H ATOM 684 N TYR A1147 -6.103 9.657 10.375 1.00 9.87 N ATOM 685 CA TYR A1147 -4.705 9.263 10.460 1.00 8.90 C ATOM 686 C TYR A1147 -3.884 10.138 9.525 1.00 9.17 C ATOM 687 O TYR A1147 -4.154 10.199 8.319 1.00 11.77 O ATOM 688 CB TYR A1147 -4.548 7.791 10.101 1.00 9.70 C ATOM 689 CG TYR A1147 -5.189 6.859 11.101 1.00 7.77 C ATOM 690 CD1 TYR A1147 -4.772 6.840 12.430 1.00 8.81 C ATOM 691 CD2 TYR A1147 -6.196 5.994 10.722 1.00 8.70 C ATOM 692 CE1 TYR A1147 -5.357 5.984 13.350 1.00 9.06 C ATOM 693 CE2 TYR A1147 -6.774 5.136 11.626 1.00 8.18 C ATOM 694 CZ TYR A1147 -6.355 5.132 12.937 1.00 7.63 C ATOM 695 OH TYR A1147 -6.948 4.271 13.841 1.00 9.15 O ATOM 696 HH TYR A1147 -6.534 4.394 14.732 1.00 0.00 H ATOM 697 H TYR A1147 -6.745 9.142 9.739 1.00 0.00 H ATOM 698 N GLN A1148 -2.908 10.839 10.084 1.00 8.87 N ATOM 699 CA GLN A1148 -2.073 11.746 9.309 1.00 9.50 C ATOM 700 C GLN A1148 -0.707 11.169 8.984 1.00 8.42 C ATOM 701 O GLN A1148 0.006 11.736 8.147 1.00 9.47 O ATOM 702 CB GLN A1148 -1.934 13.089 10.037 1.00 12.89 C ATOM 703 CG GLN A1148 -3.260 13.853 10.117 1.00 17.67 C ATOM 704 CD GLN A1148 -3.235 15.002 11.105 1.00 23.46 C ATOM 705 OE1 GLN A1148 -2.248 15.216 11.807 1.00 25.61 O ATOM 706 NE2 GLN A1148 -4.326 15.755 11.158 1.00 36.21 N ATOM 707 HE22 GLN A1148 -5.138 15.538 10.546 1.00 0.00 H ATOM 708 HE21 GLN A1148 -4.369 16.563 11.812 1.00 0.00 H ATOM 709 H GLN A1148 -2.734 10.739 11.104 1.00 0.00 H ATOM 710 N GLU A1149 -0.336 10.058 9.608 1.00 8.52 N ATOM 711 CA GLU A1149 0.896 9.342 9.337 1.00 8.58 C ATOM 712 C GLU A1149 0.563 7.860 9.318 1.00 9.32 C ATOM 713 O GLU A1149 -0.301 7.412 10.085 1.00 8.45 O ATOM 714 CB GLU A1149 1.943 9.585 10.438 1.00 10.53 C ATOM 715 CG GLU A1149 2.376 11.030 10.615 1.00 11.55 C ATOM 716 CD GLU A1149 3.355 11.496 9.544 1.00 12.37 C ATOM 717 OE1 GLU A1149 3.481 10.835 8.494 1.00 13.05 O ATOM 718 OE2 GLU A1149 4.013 12.532 9.764 1.00 15.08 O ATOM 719 H GLU A1149 -0.970 9.676 10.339 1.00 0.00 H ATOM 720 N PRO A1150 1.220 7.071 8.464 1.00 8.58 N ATOM 721 CA PRO A1150 0.885 5.641 8.409 1.00 9.51 C ATOM 722 C PRO A1150 1.079 4.927 9.731 1.00 8.37 C ATOM 723 O PRO A1150 0.302 4.018 10.052 1.00 8.84 O ATOM 724 CB PRO A1150 1.812 5.092 7.313 1.00 11.50 C ATOM 725 CG PRO A1150 2.875 6.112 7.150 1.00 15.39 C ATOM 726 CD PRO A1150 2.285 7.432 7.511 1.00 9.67 C ATOM 727 N TRP A1151 2.085 5.320 10.515 1.00 8.20 N ATOM 728 CA TRP A1151 2.343 4.649 11.782 1.00 7.87 C ATOM 729 C TRP A1151 1.265 4.911 12.821 1.00 7.21 C ATOM 730 O TRP A1151 1.170 4.154 13.793 1.00 7.95 O ATOM 731 CB TRP A1151 3.721 5.014 12.346 1.00 10.60 C ATOM 732 CG TRP A1151 3.981 6.487 12.477 1.00 13.03 C ATOM 733 CD1 TRP A1151 4.657 7.281 11.589 1.00 14.80 C ATOM 734 CD2 TRP A1151 3.590 7.342 13.559 1.00 17.31 C ATOM 735 NE1 TRP A1151 4.704 8.570 12.051 1.00 19.29 N ATOM 736 CE2 TRP A1151 4.056 8.639 13.255 1.00 14.57 C ATOM 737 CE3 TRP A1151 2.890 7.143 14.749 1.00 21.62 C ATOM 738 CZ2 TRP A1151 3.846 9.725 14.097 1.00 25.98 C ATOM 739 CZ3 TRP A1151 2.685 8.226 15.588 1.00 24.97 C ATOM 740 CH2 TRP A1151 3.159 9.501 15.255 1.00 27.79 C ATOM 741 HE1 TRP A1151 5.159 9.369 11.565 1.00 0.00 H ATOM 742 H TRP A1151 2.690 6.112 10.219 1.00 0.00 H ATOM 743 N GLN A1152 0.465 5.962 12.660 1.00 7.67 N ATOM 744 CA GLN A1152 -0.619 6.185 13.608 1.00 7.74 C ATOM 745 C GLN A1152 -1.680 5.102 13.480 1.00 7.05 C ATOM 746 O GLN A1152 -2.283 4.688 14.483 1.00 7.84 O ATOM 747 CB GLN A1152 -1.226 7.563 13.390 1.00 7.86 C ATOM 748 CG GLN A1152 -0.291 8.696 13.748 1.00 9.04 C ATOM 749 CD GLN A1152 -0.864 10.045 13.387 1.00 10.20 C ATOM 750 OE1 GLN A1152 -1.674 10.170 12.478 1.00 11.65 O ATOM 751 NE2 GLN A1152 -0.428 11.078 14.098 1.00 17.05 N ATOM 752 HE22 GLN A1152 0.261 10.929 14.863 1.00 0.00 H ATOM 753 HE21 GLN A1152 -0.775 12.036 13.890 1.00 0.00 H ATOM 754 H GLN A1152 0.612 6.617 11.866 1.00 0.00 H ATOM 755 N TYR A1153 -1.931 4.644 12.253 1.00 7.13 N ATOM 756 CA TYR A1153 -2.839 3.530 12.033 1.00 7.47 C ATOM 757 C TYR A1153 -2.264 2.252 12.626 1.00 6.53 C ATOM 758 O TYR A1153 -2.945 1.535 13.372 1.00 7.36 O ATOM 759 CB TYR A1153 -3.087 3.372 10.528 1.00 7.49 C ATOM 760 CG TYR A1153 -3.705 2.051 10.143 1.00 7.02 C ATOM 761 CD1 TYR A1153 -5.070 1.822 10.315 1.00 8.11 C ATOM 762 CD2 TYR A1153 -2.933 1.036 9.599 1.00 7.62 C ATOM 763 CE1 TYR A1153 -5.640 0.619 9.961 1.00 8.16 C ATOM 764 CE2 TYR A1153 -3.493 -0.165 9.241 1.00 7.65 C ATOM 765 CZ TYR A1153 -4.848 -0.371 9.426 1.00 7.11 C ATOM 766 OH TYR A1153 -5.439 -1.565 9.092 1.00 9.17 O ATOM 767 HH TYR A1153 -5.312 -1.736 8.125 1.00 0.00 H ATOM 768 H TYR A1153 -1.468 5.093 11.437 1.00 0.00 H ATOM 769 N VAL A1154 -0.995 1.963 12.315 1.00 7.20 N ATOM 770 CA VAL A1154 -0.329 0.787 12.869 1.00 7.32 C ATOM 771 C VAL A1154 -0.368 0.813 14.391 1.00 7.75 C ATOM 772 O VAL A1154 -0.638 -0.209 15.034 1.00 7.75 O ATOM 773 CB VAL A1154 1.108 0.681 12.324 1.00 7.75 C ATOM 774 CG1 VAL A1154 1.850 -0.466 12.993 1.00 9.47 C ATOM 775 CG2 VAL A1154 1.081 0.509 10.800 1.00 9.31 C ATOM 776 H VAL A1154 -0.473 2.587 11.667 1.00 0.00 H ATOM 777 N ASP A1155 -0.123 1.983 14.989 1.00 7.28 N ATOM 778 CA ASP A1155 -0.145 2.100 16.443 1.00 7.63 C ATOM 779 C ASP A1155 -1.502 1.717 17.017 1.00 7.13 C ATOM 780 O ASP A1155 -1.570 1.082 18.076 1.00 7.23 O ATOM 781 CB ASP A1155 0.212 3.525 16.871 1.00 10.71 C ATOM 782 CG ASP A1155 1.698 3.828 16.766 1.00 15.91 C ATOM 783 OD1 ASP A1155 2.497 2.884 16.664 1.00 16.02 O ATOM 784 OD2 ASP A1155 2.056 5.025 16.795 1.00 21.10 O ATOM 785 H ASP A1155 0.086 2.821 14.410 1.00 0.00 H ATOM 786 N ASP A1156 -2.594 2.139 16.369 1.00 7.27 N ATOM 787 CA ASP A1156 -3.920 1.814 16.891 1.00 7.15 C ATOM 788 C ASP A1156 -4.220 0.333 16.750 1.00 6.66 C ATOM 789 O ASP A1156 -4.845 -0.259 17.635 1.00 6.93 O ATOM 790 CB ASP A1156 -5.010 2.625 16.190 1.00 7.80 C ATOM 791 CG ASP A1156 -5.327 3.941 16.888 1.00 9.01 C ATOM 792 OD1 ASP A1156 -4.846 4.177 18.015 1.00 11.62 O ATOM 793 OD2 ASP A1156 -6.095 4.740 16.298 1.00 9.73 O ATOM 794 H ASP A1156 -2.500 2.697 15.496 1.00 0.00 H ATOM 795 N VAL A1157 -3.818 -0.282 15.642 1.00 6.90 N ATOM 796 CA VAL A1157 -4.019 -1.721 15.502 1.00 6.66 C ATOM 797 C VAL A1157 -3.274 -2.465 16.607 1.00 6.91 C ATOM 798 O VAL A1157 -3.829 -3.343 17.287 1.00 6.89 O ATOM 799 CB VAL A1157 -3.606 -2.195 14.097 1.00 8.04 C ATOM 800 CG1 VAL A1157 -3.686 -3.710 14.028 1.00 10.36 C ATOM 801 CG2 VAL A1157 -4.474 -1.553 13.017 1.00 8.15 C ATOM 802 H VAL A1157 -3.363 0.259 14.879 1.00 0.00 H ATOM 803 N TRP A1158 -2.017 -2.086 16.844 1.00 7.17 N ATOM 804 CA TRP A1158 -1.244 -2.735 17.899 1.00 7.64 C ATOM 805 C TRP A1158 -1.818 -2.458 19.274 1.00 8.02 C ATOM 806 O TRP A1158 -1.771 -3.330 20.151 1.00 8.96 O ATOM 807 CB TRP A1158 0.227 -2.333 17.838 1.00 7.17 C ATOM 808 CG TRP A1158 0.943 -3.180 16.893 1.00 7.29 C ATOM 809 CD1 TRP A1158 1.522 -2.791 15.733 1.00 9.27 C ATOM 810 CD2 TRP A1158 1.120 -4.595 16.985 1.00 9.61 C ATOM 811 NE1 TRP A1158 2.071 -3.874 15.092 1.00 9.62 N ATOM 812 CE2 TRP A1158 1.835 -4.995 15.843 1.00 8.43 C ATOM 813 CE3 TRP A1158 0.746 -5.564 17.923 1.00 11.95 C ATOM 814 CZ2 TRP A1158 2.194 -6.323 15.614 1.00 11.18 C ATOM 815 CZ3 TRP A1158 1.094 -6.885 17.690 1.00 15.11 C ATOM 816 CH2 TRP A1158 1.810 -7.250 16.547 1.00 16.70 C ATOM 817 HE1 TRP A1158 2.581 -3.848 14.186 1.00 0.00 H ATOM 818 H TRP A1158 -1.587 -1.328 16.277 1.00 0.00 H ATOM 819 N LEU A1159 -2.357 -1.260 19.494 1.00 6.83 N ATOM 820 CA LEU A1159 -2.994 -0.958 20.771 1.00 7.43 C ATOM 821 C LEU A1159 -4.156 -1.911 21.033 1.00 6.29 C ATOM 822 O LEU A1159 -4.311 -2.444 22.143 1.00 7.01 O ATOM 823 CB LEU A1159 -3.462 0.493 20.754 1.00 7.21 C ATOM 824 CG LEU A1159 -4.264 0.974 21.960 1.00 6.95 C ATOM 825 CD1 LEU A1159 -3.470 0.898 23.252 1.00 9.33 C ATOM 826 CD2 LEU A1159 -4.723 2.395 21.702 1.00 9.13 C ATOM 827 H LEU A1159 -2.323 -0.534 18.750 1.00 0.00 H ATOM 828 N MET A1160 -4.990 -2.132 20.017 1.00 6.27 N ATOM 829 CA MET A1160 -6.088 -3.086 20.135 1.00 6.27 C ATOM 830 C MET A1160 -5.586 -4.466 20.548 1.00 6.12 C ATOM 831 O MET A1160 -6.139 -5.094 21.458 1.00 6.50 O ATOM 832 CB MET A1160 -6.830 -3.157 18.800 1.00 6.34 C ATOM 833 CG MET A1160 -7.903 -4.224 18.740 1.00 7.85 C ATOM 834 SD MET A1160 -8.777 -4.258 17.150 1.00 8.03 S ATOM 835 CE MET A1160 -7.405 -4.442 16.002 1.00 14.08 C ATOM 836 H MET A1160 -4.856 -1.615 19.124 1.00 0.00 H ATOM 837 N PHE A1161 -4.545 -4.968 19.879 1.00 6.57 N ATOM 838 CA PHE A1161 -4.037 -6.299 20.206 1.00 6.71 C ATOM 839 C PHE A1161 -3.398 -6.318 21.592 1.00 7.01 C ATOM 840 O PHE A1161 -3.615 -7.253 22.380 1.00 7.08 O ATOM 841 CB PHE A1161 -2.998 -6.748 19.177 1.00 8.30 C ATOM 842 CG PHE A1161 -3.519 -6.899 17.765 1.00 8.10 C ATOM 843 CD1 PHE A1161 -4.829 -7.248 17.488 1.00 9.85 C ATOM 844 CD2 PHE A1161 -2.652 -6.703 16.703 1.00 9.43 C ATOM 845 CE1 PHE A1161 -5.261 -7.388 16.165 1.00 10.50 C ATOM 846 CE2 PHE A1161 -3.075 -6.844 15.392 1.00 9.77 C ATOM 847 CZ PHE A1161 -4.375 -7.178 15.122 1.00 11.07 C ATOM 848 H PHE A1161 -4.095 -4.411 19.124 1.00 0.00 H ATOM 849 N ASN A1162 -2.585 -5.311 21.901 1.00 6.73 N ATOM 850 CA ASN A1162 -1.891 -5.304 23.181 1.00 7.97 C ATOM 851 C ASN A1162 -2.872 -5.201 24.341 1.00 6.97 C ATOM 852 O ASN A1162 -2.655 -5.809 25.393 1.00 7.64 O ATOM 853 CB ASN A1162 -0.858 -4.179 23.214 1.00 8.48 C ATOM 854 CG ASN A1162 0.334 -4.458 22.301 1.00 10.26 C ATOM 855 OD1 ASN A1162 0.742 -5.602 22.114 1.00 12.87 O ATOM 856 ND2 ASN A1162 0.881 -3.405 21.709 1.00 13.70 N ATOM 857 HD22 ASN A1162 0.507 -2.452 21.893 1.00 0.00 H ATOM 858 HD21 ASN A1162 1.684 -3.532 21.061 1.00 0.00 H ATOM 859 H ASN A1162 -2.445 -4.530 21.229 1.00 0.00 H ATOM 860 N ASN A1163 -3.962 -4.444 24.170 1.00 6.76 N ATOM 861 CA ASN A1163 -4.977 -4.383 25.215 1.00 6.79 C ATOM 862 C ASN A1163 -5.554 -5.758 25.484 1.00 6.69 C ATOM 863 O ASN A1163 -5.741 -6.143 26.644 1.00 7.62 O ATOM 864 CB ASN A1163 -6.119 -3.455 24.803 1.00 6.82 C ATOM 865 CG ASN A1163 -5.745 -1.989 24.839 1.00 6.20 C ATOM 866 OD1 ASN A1163 -4.757 -1.593 25.460 1.00 6.94 O ATOM 867 ND2 ASN A1163 -6.554 -1.171 24.183 1.00 6.89 N ATOM 868 HD22 ASN A1163 -7.376 -1.552 23.673 1.00 0.00 H ATOM 869 HD21 ASN A1163 -6.367 -0.148 24.178 1.00 0.00 H ATOM 870 H ASN A1163 -4.085 -3.900 23.292 1.00 0.00 H ATOM 871 N ALA A1164 -5.866 -6.500 24.423 1.00 6.62 N ATOM 872 CA ALA A1164 -6.498 -7.800 24.595 1.00 6.94 C ATOM 873 C ALA A1164 -5.534 -8.803 25.197 1.00 7.27 C ATOM 874 O ALA A1164 -5.928 -9.620 26.036 1.00 7.74 O ATOM 875 CB ALA A1164 -7.043 -8.297 23.260 1.00 8.12 C ATOM 876 H ALA A1164 -5.657 -6.149 23.467 1.00 0.00 H ATOM 877 N TRP A1165 -4.270 -8.765 24.783 1.00 7.01 N ATOM 878 CA TRP A1165 -3.274 -9.644 25.387 1.00 7.84 C ATOM 879 C TRP A1165 -3.028 -9.277 26.846 1.00 9.11 C ATOM 880 O TRP A1165 -2.799 -10.157 27.685 1.00 10.99 O ATOM 881 CB TRP A1165 -1.975 -9.563 24.598 1.00 9.17 C ATOM 882 CG TRP A1165 -1.936 -10.316 23.296 1.00 8.17 C ATOM 883 CD1 TRP A1165 -2.606 -11.467 22.951 1.00 9.22 C ATOM 884 CD2 TRP A1165 -1.136 -9.969 22.171 1.00 9.10 C ATOM 885 NE1 TRP A1165 -2.266 -11.841 21.670 1.00 9.41 N ATOM 886 CE2 TRP A1165 -1.367 -10.934 21.171 1.00 9.50 C ATOM 887 CE3 TRP A1165 -0.244 -8.922 21.908 1.00 10.08 C ATOM 888 CZ2 TRP A1165 -0.733 -10.888 19.932 1.00 13.29 C ATOM 889 CZ3 TRP A1165 0.384 -8.877 20.680 1.00 13.18 C ATOM 890 CH2 TRP A1165 0.130 -9.849 19.703 1.00 14.60 C ATOM 891 HE1 TRP A1165 -2.631 -12.674 21.165 1.00 0.00 H ATOM 892 H TRP A1165 -3.991 -8.107 24.027 1.00 0.00 H ATOM 893 N LEU A1166 -3.069 -7.983 27.174 1.00 7.92 N ATOM 894 CA LEU A1166 -2.885 -7.564 28.562 1.00 8.51 C ATOM 895 C LEU A1166 -4.033 -8.049 29.441 1.00 8.22 C ATOM 896 O LEU A1166 -3.817 -8.594 30.535 1.00 10.06 O ATOM 897 CB LEU A1166 -2.788 -6.039 28.629 1.00 8.65 C ATOM 898 CG LEU A1166 -2.738 -5.424 30.030 1.00 9.60 C ATOM 899 CD1 LEU A1166 -1.430 -5.758 30.721 1.00 14.26 C ATOM 900 CD2 LEU A1166 -2.949 -3.906 29.958 1.00 10.80 C ATOM 901 H LEU A1166 -3.233 -7.268 26.436 1.00 0.00 H ATOM 902 N TYR A1167 -5.268 -7.839 28.992 1.00 7.53 N ATOM 903 CA TYR A1167 -6.404 -8.041 29.878 1.00 8.88 C ATOM 904 C TYR A1167 -6.770 -9.513 30.018 1.00 7.88 C ATOM 905 O TYR A1167 -7.128 -9.973 31.114 1.00 9.43 O ATOM 906 CB TYR A1167 -7.625 -7.235 29.409 1.00 8.16 C ATOM 907 CG TYR A1167 -8.738 -7.439 30.392 1.00 7.88 C ATOM 908 CD1 TYR A1167 -8.731 -6.760 31.599 1.00 9.58 C ATOM 909 CD2 TYR A1167 -9.741 -8.374 30.168 1.00 8.21 C ATOM 910 CE1 TYR A1167 -9.700 -6.993 32.552 1.00 9.97 C ATOM 911 CE2 TYR A1167 -10.714 -8.606 31.109 1.00 10.24 C ATOM 912 CZ TYR A1167 -10.689 -7.912 32.297 1.00 8.58 C ATOM 913 OH TYR A1167 -11.663 -8.170 33.238 1.00 10.45 O ATOM 914 HH TYR A1167 -11.513 -7.598 34.032 1.00 0.00 H ATOM 915 H TYR A1167 -5.421 -7.531 28.010 1.00 0.00 H ATOM 916 N ASN A1168 -6.726 -10.257 28.922 1.00 8.51 N ATOM 917 CA ASN A1168 -7.251 -11.613 28.895 1.00 9.82 C ATOM 918 C ASN A1168 -6.182 -12.632 29.250 1.00 8.98 C ATOM 919 O ASN A1168 -4.997 -12.440 28.983 1.00 10.63 O ATOM 920 CB ASN A1168 -7.814 -11.931 27.517 1.00 9.08 C ATOM 921 CG ASN A1168 -8.973 -11.049 27.172 1.00 9.40 C ATOM 922 OD1 ASN A1168 -10.109 -11.326 27.562 1.00 11.06 O ATOM 923 ND2 ASN A1168 -8.703 -9.960 26.464 1.00 9.25 N ATOM 924 HD22 ASN A1168 -7.728 -9.768 26.157 1.00 0.00 H ATOM 925 HD21 ASN A1168 -9.466 -9.298 26.216 1.00 0.00 H ATOM 926 H ASN A1168 -6.305 -9.860 28.058 1.00 0.00 H ATOM 927 N ARG A1169 -6.623 -13.731 29.855 1.00 10.82 N ATOM 928 CA ARG A1169 -5.720 -14.817 30.209 1.00 11.59 C ATOM 929 C ARG A1169 -5.100 -15.414 28.949 1.00 10.55 C ATOM 930 O ARG A1169 -5.753 -15.525 27.911 1.00 10.16 O ATOM 931 CB ARG A1169 -6.527 -15.884 30.950 1.00 14.34 C ATOM 932 CG ARG A1169 -5.737 -16.809 31.846 1.00 14.53 C ATOM 933 CD ARG A1169 -6.677 -17.683 32.672 1.00 15.61 C ATOM 934 NE ARG A1169 -6.056 -18.937 33.073 1.00 14.99 N ATOM 935 CZ ARG A1169 -6.631 -19.839 33.862 1.00 11.68 C ATOM 936 NH1 ARG A1169 -7.847 -19.630 34.351 1.00 15.36 N ATOM 937 NH2 ARG A1169 -5.987 -20.954 34.147 1.00 14.92 N ATOM 938 HE ARG A1169 -5.100 -19.141 32.719 1.00 0.00 H ATOM 939 HH12 ARG A1169 -8.289 -20.341 34.968 1.00 0.00 H ATOM 940 HH11 ARG A1169 -8.358 -18.755 34.118 1.00 0.00 H ATOM 941 HH22 ARG A1169 -6.428 -21.666 34.763 1.00 0.00 H ATOM 942 HH21 ARG A1169 -5.038 -21.121 33.755 1.00 0.00 H ATOM 943 H ARG A1169 -7.635 -13.817 30.080 1.00 0.00 H ATOM 944 N LYS A1170 -3.830 -15.818 29.039 1.00 10.99 N ATOM 945 CA LYS A1170 -3.133 -16.333 27.862 1.00 11.00 C ATOM 946 C LYS A1170 -3.790 -17.588 27.301 1.00 11.37 C ATOM 947 O LYS A1170 -3.636 -17.893 26.114 1.00 11.96 O ATOM 948 CB LYS A1170 -1.676 -16.633 28.191 1.00 12.41 C ATOM 949 CG LYS A1170 -0.840 -15.409 28.488 1.00 15.71 C ATOM 950 CD LYS A1170 0.619 -15.715 28.216 1.00 25.62 C ATOM 951 CE LYS A1170 1.502 -14.490 28.376 1.00 29.95 C ATOM 952 NZ LYS A1170 2.801 -14.687 27.669 1.00 35.55 N ATOM 953 HZ1 LYS A1170 3.291 -15.512 28.070 1.00 0.00 H ATOM 954 HZ2 LYS A1170 2.623 -14.846 26.657 1.00 0.00 H ATOM 955 HZ3 LYS A1170 3.392 -13.840 27.789 1.00 0.00 H ATOM 956 H LYS A1170 -3.334 -15.766 29.952 1.00 0.00 H ATOM 957 N THR A1171 -4.503 -18.332 28.141 1.00 10.32 N ATOM 958 CA THR A1171 -5.213 -19.543 27.755 1.00 11.65 C ATOM 959 C THR A1171 -6.595 -19.267 27.180 1.00 10.79 C ATOM 960 O THR A1171 -7.279 -20.220 26.787 1.00 11.08 O ATOM 961 CB THR A1171 -5.371 -20.441 28.987 1.00 11.40 C ATOM 962 OG1 THR A1171 -5.987 -19.686 30.034 1.00 12.22 O ATOM 963 CG2 THR A1171 -4.018 -20.952 29.465 1.00 14.97 C ATOM 964 HG1 THR A1171 -6.876 -19.370 29.733 1.00 0.00 H ATOM 965 H THR A1171 -4.557 -18.030 29.135 1.00 0.00 H ATOM 966 N SER A1172 -7.029 -18.009 27.129 1.00 10.10 N ATOM 967 CA SER A1172 -8.410 -17.711 26.798 1.00 10.08 C ATOM 968 C SER A1172 -8.639 -17.684 25.290 1.00 8.76 C ATOM 969 O SER A1172 -7.714 -17.523 24.481 1.00 9.70 O ATOM 970 CB SER A1172 -8.836 -16.374 27.405 1.00 9.46 C ATOM 971 OG SER A1172 -8.185 -15.271 26.763 1.00 9.18 O ATOM 972 HG SER A1172 -7.205 -15.363 26.866 1.00 0.00 H ATOM 973 H SER A1172 -6.370 -17.230 27.329 1.00 0.00 H ATOM 974 N ARG A1173 -9.917 -17.829 24.932 1.00 9.06 N ATOM 975 CA ARG A1173 -10.336 -17.793 23.536 1.00 9.36 C ATOM 976 C ARG A1173 -10.040 -16.434 22.909 1.00 8.77 C ATOM 977 O ARG A1173 -9.497 -16.360 21.800 1.00 9.13 O ATOM 978 CB ARG A1173 -11.825 -18.128 23.462 1.00 9.46 C ATOM 979 CG ARG A1173 -12.424 -18.220 22.073 1.00 9.86 C ATOM 980 CD ARG A1173 -13.851 -18.748 22.183 1.00 10.17 C ATOM 981 NE ARG A1173 -14.514 -18.959 20.896 1.00 9.84 N ATOM 982 CZ ARG A1173 -15.191 -18.024 20.242 1.00 10.19 C ATOM 983 NH1 ARG A1173 -15.279 -16.797 20.730 1.00 11.57 N ATOM 984 NH2 ARG A1173 -15.761 -18.317 19.083 1.00 11.13 N ATOM 985 HE ARG A1173 -14.450 -19.904 20.466 1.00 0.00 H ATOM 986 HH12 ARG A1173 -15.811 -16.069 20.213 1.00 0.00 H ATOM 987 HH11 ARG A1173 -14.816 -16.561 21.631 1.00 0.00 H ATOM 988 HH22 ARG A1173 -16.293 -17.588 18.566 1.00 0.00 H ATOM 989 HH21 ARG A1173 -15.677 -19.276 18.690 1.00 0.00 H ATOM 990 H ARG A1173 -10.635 -17.972 25.671 1.00 0.00 H ATOM 991 N VAL A1174 -10.362 -15.344 23.617 1.00 8.36 N ATOM 992 CA VAL A1174 -10.099 -14.009 23.072 1.00 7.39 C ATOM 993 C VAL A1174 -8.604 -13.782 22.853 1.00 8.51 C ATOM 994 O VAL A1174 -8.196 -13.174 21.855 1.00 8.26 O ATOM 995 CB VAL A1174 -10.752 -12.915 23.944 1.00 8.96 C ATOM 996 CG1 VAL A1174 -10.246 -11.515 23.564 1.00 10.70 C ATOM 997 CG2 VAL A1174 -12.267 -12.959 23.823 1.00 12.44 C ATOM 998 H VAL A1174 -10.799 -15.445 24.555 1.00 0.00 H ATOM 999 N TYR A1175 -7.766 -14.239 23.784 1.00 9.03 N ATOM 1000 CA TYR A1175 -6.325 -14.085 23.616 1.00 8.42 C ATOM 1001 C TYR A1175 -5.842 -14.820 22.370 1.00 8.98 C ATOM 1002 O TYR A1175 -5.046 -14.287 21.590 1.00 9.14 O ATOM 1003 CB TYR A1175 -5.605 -14.588 24.871 1.00 8.45 C ATOM 1004 CG TYR A1175 -4.124 -14.289 24.942 1.00 9.27 C ATOM 1005 CD1 TYR A1175 -3.219 -14.971 24.154 1.00 10.48 C ATOM 1006 CD2 TYR A1175 -3.634 -13.349 25.835 1.00 9.89 C ATOM 1007 CE1 TYR A1175 -1.869 -14.705 24.229 1.00 11.86 C ATOM 1008 CE2 TYR A1175 -2.284 -13.074 25.922 1.00 11.41 C ATOM 1009 CZ TYR A1175 -1.409 -13.752 25.116 1.00 12.02 C ATOM 1010 OH TYR A1175 -0.061 -13.481 25.196 1.00 16.20 O ATOM 1011 HH TYR A1175 0.428 -14.052 24.552 1.00 0.00 H ATOM 1012 H TYR A1175 -8.141 -14.707 24.633 1.00 0.00 H ATOM 1013 N LYS A1176 -6.307 -16.063 22.173 1.00 9.12 N ATOM 1014 CA LYS A1176 -5.933 -16.830 20.985 1.00 9.94 C ATOM 1015 C LYS A1176 -6.407 -16.146 19.711 1.00 8.98 C ATOM 1016 O LYS A1176 -5.675 -16.087 18.713 1.00 9.57 O ATOM 1017 CB LYS A1176 -6.528 -18.239 21.067 1.00 11.87 C ATOM 1018 CG LYS A1176 -6.367 -19.074 19.789 1.00 14.77 C ATOM 1019 CD LYS A1176 -4.905 -19.394 19.530 1.00 20.68 C ATOM 1020 CE LYS A1176 -4.730 -20.203 18.254 1.00 28.34 C ATOM 1021 NZ LYS A1176 -3.326 -20.680 18.118 1.00 33.98 N ATOM 1022 HZ1 LYS A1176 -2.685 -19.862 18.087 1.00 0.00 H ATOM 1023 HZ2 LYS A1176 -3.085 -21.281 18.932 1.00 0.00 H ATOM 1024 HZ3 LYS A1176 -3.231 -21.229 17.240 1.00 0.00 H ATOM 1025 H LYS A1176 -6.944 -16.488 22.877 1.00 0.00 H ATOM 1026 N PHE A1177 -7.637 -15.642 19.715 1.00 9.54 N ATOM 1027 CA PHE A1177 -8.140 -14.944 18.541 1.00 9.59 C ATOM 1028 C PHE A1177 -7.323 -13.690 18.263 1.00 8.69 C ATOM 1029 O PHE A1177 -7.052 -13.368 17.102 1.00 9.91 O ATOM 1030 CB PHE A1177 -9.620 -14.604 18.720 1.00 8.89 C ATOM 1031 CG PHE A1177 -10.559 -15.789 18.564 1.00 9.15 C ATOM 1032 CD1 PHE A1177 -10.087 -17.091 18.497 1.00 9.69 C ATOM 1033 CD2 PHE A1177 -11.924 -15.576 18.454 1.00 9.62 C ATOM 1034 CE1 PHE A1177 -10.964 -18.160 18.334 1.00 10.62 C ATOM 1035 CE2 PHE A1177 -12.810 -16.635 18.295 1.00 9.84 C ATOM 1036 CZ PHE A1177 -12.320 -17.933 18.230 1.00 10.70 C ATOM 1037 H PHE A1177 -8.239 -15.746 20.556 1.00 0.00 H ATOM 1038 N CYS A1178 -6.923 -12.970 19.318 1.00 9.11 N ATOM 1039 CA CYS A1178 -6.053 -11.810 19.153 1.00 8.48 C ATOM 1040 C CYS A1178 -4.764 -12.201 18.447 1.00 7.59 C ATOM 1041 O CYS A1178 -4.334 -11.536 17.492 1.00 8.86 O ATOM 1042 CB CYS A1178 -5.743 -11.204 20.521 1.00 8.66 C ATOM 1043 SG CYS A1178 -4.814 -9.694 20.373 1.00 9.03 S ATOM 1044 H CYS A1178 -7.237 -13.242 20.271 1.00 0.00 H ATOM 1045 N SER A1179 -4.139 -13.291 18.897 1.00 9.30 N ATOM 1046 CA SER A1179 -2.901 -13.752 18.276 1.00 9.21 C ATOM 1047 C SER A1179 -3.093 -14.069 16.798 1.00 10.38 C ATOM 1048 O SER A1179 -2.205 -13.798 15.983 1.00 10.04 O ATOM 1049 CB SER A1179 -2.358 -14.968 19.025 1.00 11.00 C ATOM 1050 OG SER A1179 -1.999 -14.609 20.339 1.00 11.39 O ATOM 1051 HG SER A1179 -1.649 -15.404 20.813 1.00 0.00 H ATOM 1052 H SER A1179 -4.539 -13.818 19.700 1.00 0.00 H ATOM 1053 N LYS A1180 -4.237 -14.653 16.432 1.00 9.45 N ATOM 1054 CA LYS A1180 -4.509 -14.922 15.023 1.00 11.04 C ATOM 1055 C LYS A1180 -4.601 -13.627 14.221 1.00 9.31 C ATOM 1056 O LYS A1180 -4.007 -13.508 13.141 1.00 10.97 O ATOM 1057 CB LYS A1180 -5.793 -15.737 14.886 1.00 12.07 C ATOM 1058 CG LYS A1180 -6.278 -15.897 13.450 1.00 15.28 C ATOM 1059 CD LYS A1180 -5.302 -16.669 12.569 1.00 16.43 C ATOM 1060 CE LYS A1180 -5.838 -16.748 11.150 1.00 17.49 C ATOM 1061 NZ LYS A1180 -5.009 -17.601 10.261 1.00 19.93 N ATOM 1062 HZ1 LYS A1180 -4.044 -17.215 10.213 1.00 0.00 H ATOM 1063 HZ2 LYS A1180 -4.978 -18.569 10.641 1.00 0.00 H ATOM 1064 HZ3 LYS A1180 -5.426 -17.615 9.308 1.00 0.00 H ATOM 1065 H LYS A1180 -4.937 -14.917 17.154 1.00 0.00 H ATOM 1066 N LEU A1181 -5.336 -12.641 14.734 1.00 9.27 N ATOM 1067 CA LEU A1181 -5.433 -11.363 14.037 1.00 9.44 C ATOM 1068 C LEU A1181 -4.071 -10.697 13.914 1.00 8.94 C ATOM 1069 O LEU A1181 -3.769 -10.080 12.886 1.00 9.07 O ATOM 1070 CB LEU A1181 -6.397 -10.427 14.760 1.00 9.83 C ATOM 1071 CG LEU A1181 -7.864 -10.827 14.826 1.00 11.69 C ATOM 1072 CD1 LEU A1181 -8.680 -9.664 15.368 1.00 14.61 C ATOM 1073 CD2 LEU A1181 -8.364 -11.230 13.456 1.00 14.31 C ATOM 1074 H LEU A1181 -5.841 -12.783 15.632 1.00 0.00 H ATOM 1075 N ALA A1182 -3.250 -10.783 14.958 1.00 9.23 N ATOM 1076 CA ALA A1182 -1.939 -10.144 14.920 1.00 9.89 C ATOM 1077 C ALA A1182 -1.053 -10.780 13.859 1.00 9.91 C ATOM 1078 O ALA A1182 -0.288 -10.088 13.176 1.00 9.91 O ATOM 1079 CB ALA A1182 -1.278 -10.211 16.295 1.00 10.04 C ATOM 1080 H ALA A1182 -3.545 -11.309 15.806 1.00 0.00 H ATOM 1081 N GLU A1183 -1.139 -12.104 13.710 1.00 9.63 N ATOM 1082 CA GLU A1183 -0.386 -12.794 12.669 1.00 11.53 C ATOM 1083 C GLU A1183 -0.839 -12.354 11.281 1.00 10.37 C ATOM 1084 O GLU A1183 -0.014 -12.068 10.403 1.00 11.35 O ATOM 1085 CB GLU A1183 -0.546 -14.305 12.850 1.00 12.09 C ATOM 1086 CG GLU A1183 0.178 -15.146 11.815 1.00 16.85 C ATOM 1087 CD GLU A1183 0.127 -16.624 12.150 1.00 21.49 C ATOM 1088 OE1 GLU A1183 0.918 -17.068 13.011 1.00 24.09 O ATOM 1089 OE2 GLU A1183 -0.722 -17.336 11.576 1.00 23.99 O ATOM 1090 H GLU A1183 -1.753 -12.652 14.346 1.00 0.00 H ATOM 1091 N VAL A1184 -2.150 -12.297 11.063 1.00 10.26 N ATOM 1092 CA VAL A1184 -2.673 -11.800 9.794 1.00 11.14 C ATOM 1093 C VAL A1184 -2.193 -10.377 9.540 1.00 9.70 C ATOM 1094 O VAL A1184 -1.769 -10.035 8.426 1.00 11.14 O ATOM 1095 CB VAL A1184 -4.211 -11.887 9.785 1.00 10.96 C ATOM 1096 CG1 VAL A1184 -4.789 -11.159 8.588 1.00 14.52 C ATOM 1097 CG2 VAL A1184 -4.673 -13.336 9.801 1.00 12.64 C ATOM 1098 H VAL A1184 -2.809 -12.610 11.804 1.00 0.00 H ATOM 1099 N PHE A1185 -2.256 -9.524 10.565 1.00 9.92 N ATOM 1100 CA PHE A1185 -1.875 -8.129 10.378 1.00 9.72 C ATOM 1101 C PHE A1185 -0.417 -7.998 9.968 1.00 9.35 C ATOM 1102 O PHE A1185 -0.087 -7.237 9.053 1.00 10.47 O ATOM 1103 CB PHE A1185 -2.154 -7.299 11.629 1.00 9.82 C ATOM 1104 CG PHE A1185 -1.898 -5.839 11.425 1.00 8.89 C ATOM 1105 CD1 PHE A1185 -2.704 -5.106 10.576 1.00 9.30 C ATOM 1106 CD2 PHE A1185 -0.852 -5.205 12.058 1.00 9.48 C ATOM 1107 CE1 PHE A1185 -2.472 -3.757 10.359 1.00 9.58 C ATOM 1108 CE2 PHE A1185 -0.619 -3.856 11.844 1.00 10.82 C ATOM 1109 CZ PHE A1185 -1.436 -3.135 11.000 1.00 10.09 C ATOM 1110 H PHE A1185 -2.577 -9.855 11.497 1.00 0.00 H ATOM 1111 N GLU A1186 0.476 -8.701 10.658 1.00 9.51 N ATOM 1112 CA GLU A1186 1.894 -8.621 10.317 1.00 10.85 C ATOM 1113 C GLU A1186 2.138 -9.057 8.877 1.00 11.60 C ATOM 1114 O GLU A1186 2.933 -8.440 8.156 1.00 13.49 O ATOM 1115 CB GLU A1186 2.703 -9.490 11.273 1.00 13.03 C ATOM 1116 CG GLU A1186 2.923 -8.874 12.646 1.00 15.04 C ATOM 1117 CD GLU A1186 3.123 -9.931 13.721 1.00 36.93 C ATOM 1118 OE1 GLU A1186 3.023 -11.138 13.396 1.00 43.84 O ATOM 1119 OE2 GLU A1186 3.418 -9.556 14.885 1.00 45.16 O ATOM 1120 H GLU A1186 0.164 -9.309 11.442 1.00 0.00 H ATOM 1121 N GLN A1187 1.454 -10.115 8.436 1.00 11.39 N ATOM 1122 CA GLN A1187 1.618 -10.581 7.065 1.00 12.62 C ATOM 1123 C GLN A1187 1.148 -9.532 6.068 1.00 13.03 C ATOM 1124 O GLN A1187 1.770 -9.340 5.014 1.00 13.94 O ATOM 1125 CB GLN A1187 0.834 -11.878 6.874 1.00 15.35 C ATOM 1126 CG GLN A1187 0.947 -12.477 5.475 1.00 19.94 C ATOM 1127 CD GLN A1187 2.296 -13.129 5.233 1.00 30.96 C ATOM 1128 OE1 GLN A1187 2.986 -13.513 6.176 1.00 35.76 O ATOM 1129 NE2 GLN A1187 2.678 -13.257 3.964 1.00 34.72 N ATOM 1130 HE22 GLN A1187 2.061 -12.917 3.199 1.00 0.00 H ATOM 1131 HE21 GLN A1187 3.593 -13.697 3.738 1.00 0.00 H ATOM 1132 H GLN A1187 0.800 -10.610 9.075 1.00 0.00 H ATOM 1133 N GLU A1188 0.062 -8.857 6.348 1.00 12.17 N ATOM 1134 CA GLU A1188 -0.465 -7.907 5.432 1.00 13.06 C ATOM 1135 C GLU A1188 0.185 -6.518 5.473 1.00 11.95 C ATOM 1136 O GLU A1188 0.249 -5.853 4.455 1.00 12.30 O ATOM 1137 CB GLU A1188 -1.970 -7.732 5.693 1.00 14.21 C ATOM 1138 CG GLU A1188 -2.798 -8.990 5.535 1.00 18.37 C ATOM 1139 CD GLU A1188 -2.667 -9.635 4.174 1.00 32.06 C ATOM 1140 OE1 GLU A1188 -2.870 -8.941 3.202 1.00 33.12 O ATOM 1141 OE2 GLU A1188 -2.334 -10.834 4.090 1.00 36.89 O ATOM 1142 H GLU A1188 -0.422 -9.018 7.254 1.00 0.00 H ATOM 1143 N ILE A1189 0.695 -6.113 6.638 1.00 10.84 N ATOM 1144 CA ILE A1189 1.159 -4.736 6.770 1.00 10.70 C ATOM 1145 C ILE A1189 2.517 -4.532 6.110 1.00 10.88 C ATOM 1146 O ILE A1189 2.786 -3.449 5.576 1.00 10.89 O ATOM 1147 CB ILE A1189 1.136 -4.276 8.241 1.00 10.57 C ATOM 1148 CG1 ILE A1189 1.263 -2.752 8.344 1.00 11.55 C ATOM 1149 CG2 ILE A1189 2.226 -4.958 9.045 1.00 12.30 C ATOM 1150 CD1 ILE A1189 0.152 -1.982 7.665 1.00 12.94 C ATOM 1151 H ILE A1189 0.761 -6.770 7.441 1.00 0.00 H ATOM 1152 N ASP A1190 3.448 -5.630 6.125 1.00 12.62 N ATOM 1153 CA ASP A1190 4.794 -5.357 5.621 1.00 11.47 C ATOM 1154 C ASP A1190 4.816 -4.976 4.152 1.00 12.02 C ATOM 1155 O ASP A1190 5.383 -3.920 3.826 1.00 13.63 O ATOM 1156 CB ASP A1190 5.692 -6.574 5.848 1.00 14.97 C ATOM 1157 CG ASP A1190 6.032 -6.782 7.311 1.00 15.14 C ATOM 1158 OD1 ASP A1190 5.820 -5.847 8.110 1.00 16.14 O ATOM 1159 OD2 ASP A1190 6.514 -7.847 7.752 1.00 21.89 O ATOM 1160 H ASP A1190 3.177 -6.571 6.477 1.00 0.00 H ATOM 1161 N PRO A1191 4.058 -5.668 3.204 1.00 12.20 N ATOM 1162 CA PRO A1191 4.089 -5.202 1.809 1.00 12.43 C ATOM 1163 C PRO A1191 3.442 -3.844 1.621 1.00 12.52 C ATOM 1164 O PRO A1191 3.873 -3.071 0.756 1.00 13.00 O ATOM 1165 CB PRO A1191 3.351 -6.307 1.041 1.00 16.18 C ATOM 1166 CG PRO A1191 2.503 -6.983 2.060 1.00 18.64 C ATOM 1167 CD PRO A1191 3.272 -6.909 3.348 1.00 13.05 C ATOM 1168 N VAL A1192 2.414 -3.520 2.405 1.00 11.92 N ATOM 1169 CA VAL A1192 1.783 -2.215 2.272 1.00 11.80 C ATOM 1170 C VAL A1192 2.731 -1.112 2.720 1.00 11.35 C ATOM 1171 O VAL A1192 2.854 -0.077 2.054 1.00 11.54 O ATOM 1172 CB VAL A1192 0.440 -2.183 3.020 1.00 12.55 C ATOM 1173 CG1 VAL A1192 -0.101 -0.772 3.082 1.00 14.58 C ATOM 1174 CG2 VAL A1192 -0.551 -3.107 2.337 1.00 14.29 C ATOM 1175 H VAL A1192 2.063 -4.199 3.111 1.00 0.00 H ATOM 1176 N MET A1193 3.436 -1.313 3.833 1.00 11.29 N ATOM 1177 CA MET A1193 4.402 -0.300 4.252 1.00 12.02 C ATOM 1178 C MET A1193 5.512 -0.137 3.213 1.00 12.42 C ATOM 1179 O MET A1193 5.965 0.985 2.950 1.00 14.18 O ATOM 1180 CB MET A1193 4.963 -0.620 5.638 1.00 12.87 C ATOM 1181 CG MET A1193 3.946 -0.441 6.774 1.00 18.29 C ATOM 1182 SD MET A1193 3.174 1.199 6.847 1.00 21.81 S ATOM 1183 CE MET A1193 4.165 1.965 8.113 1.00 27.36 C ATOM 1184 H MET A1193 3.301 -2.178 4.395 1.00 0.00 H ATOM 1185 N GLN A1194 5.946 -1.238 2.595 1.00 13.75 N ATOM 1186 CA GLN A1194 6.923 -1.139 1.513 1.00 15.35 C ATOM 1187 C GLN A1194 6.396 -0.277 0.369 1.00 15.23 C ATOM 1188 O GLN A1194 7.148 0.508 -0.224 1.00 16.10 O ATOM 1189 CB GLN A1194 7.291 -2.538 1.020 1.00 15.82 C ATOM 1190 CG GLN A1194 8.080 -3.353 2.034 1.00 30.34 C ATOM 1191 CD GLN A1194 8.011 -4.846 1.776 1.00 45.81 C ATOM 1192 OE1 GLN A1194 7.519 -5.287 0.737 1.00 51.90 O ATOM 1193 NE2 GLN A1194 8.491 -5.633 2.733 1.00 49.65 N ATOM 1194 HE22 GLN A1194 8.898 -5.216 3.594 1.00 0.00 H ATOM 1195 HE21 GLN A1194 8.460 -6.666 2.621 1.00 0.00 H ATOM 1196 H GLN A1194 5.587 -2.170 2.885 1.00 0.00 H ATOM 1197 N SER A1195 5.104 -0.398 0.051 1.00 14.52 N ATOM 1198 CA SER A1195 4.495 0.396 -1.013 1.00 14.53 C ATOM 1199 C SER A1195 4.406 1.878 -0.675 1.00 15.53 C ATOM 1200 O SER A1195 4.127 2.685 -1.571 1.00 17.65 O ATOM 1201 CB SER A1195 3.102 -0.140 -1.360 1.00 14.79 C ATOM 1202 OG SER A1195 2.123 0.300 -0.433 1.00 15.45 O ATOM 1203 HG SER A1195 2.362 -0.018 0.474 1.00 0.00 H ATOM 1204 H SER A1195 4.516 -1.076 0.576 1.00 0.00 H ATOM 1205 N LEU A1196 4.621 2.253 0.582 1.00 14.12 N ATOM 1206 CA LEU A1196 4.683 3.644 0.998 1.00 12.71 C ATOM 1207 C LEU A1196 6.121 4.136 1.125 1.00 16.20 C ATOM 1208 O LEU A1196 6.350 5.246 1.622 1.00 17.25 O ATOM 1209 CB LEU A1196 3.929 3.827 2.319 1.00 14.11 C ATOM 1210 CG LEU A1196 2.408 3.634 2.271 1.00 12.60 C ATOM 1211 CD1 LEU A1196 1.841 3.597 3.675 1.00 15.57 C ATOM 1212 CD2 LEU A1196 1.748 4.755 1.484 1.00 15.24 C ATOM 1213 H LEU A1196 4.751 1.515 1.303 1.00 0.00 H ATOM 1214 N GLY A1197 7.088 3.334 0.688 1.00 14.15 N ATOM 1215 CA GLY A1197 8.497 3.668 0.835 1.00 16.74 C ATOM 1216 C GLY A1197 9.110 4.341 -0.376 1.00 20.50 C ATOM 1217 O GLY A1197 8.402 4.738 -1.301 1.00 25.36 O ATOM 1218 H GLY A1197 6.829 2.439 0.226 1.00 0.00 H TER 1219 GLY A1197 HETATM 1220 O HOH 1 -16.224 -14.922 18.686 1.00 20.21 O HETATM 1221 O HOH 2 12.751 20.481 1.669 1.00 25.39 O HETATM 1222 O HOH 3 -25.073 -0.814 29.872 1.00 39.34 O HETATM 1223 O HOH 4 -3.203 -11.142 29.732 1.00 20.29 O HETATM 1224 O HOH 5 -9.887 -19.944 12.164 1.00 37.83 O HETATM 1225 O HOH 6 -21.100 -1.466 20.425 1.00 20.64 O HETATM 1226 O HOH 7 12.475 21.578 9.795 1.00 37.51 O HETATM 1227 O HOH 8 -15.910 -12.745 26.186 1.00 26.57 O HETATM 1228 O HOH 9 5.549 -10.122 7.467 1.00 30.92 O HETATM 1229 O HOH 10 -4.189 -6.826 3.209 1.00 34.99 O HETATM 1230 O HOH 11 9.949 17.860 12.077 1.00 25.53 O HETATM 1231 O HOH 12 -21.887 -1.541 24.288 1.00 22.67 O HETATM 1232 O HOH 13 -2.562 -13.280 6.078 1.00 35.71 O HETATM 1233 O HOH 14 -27.432 -0.938 33.531 1.00 19.51 O HETATM 1234 O HOH 15 10.192 12.510 7.041 1.00 27.32 O HETATM 1235 O HOH 16 3.843 6.559 17.813 1.00 31.63 O HETATM 1236 O HOH 17 0.668 -0.881 21.294 1.00 15.40 O HETATM 1237 O HOH 18 -18.797 -17.183 13.025 1.00 28.08 O HETATM 1238 O HOH 19 -2.589 -16.391 10.066 1.00 27.86 O HETATM 1239 O HOH 20 -9.107 -5.838 25.148 1.00 8.01 O HETATM 1240 O HOH 21 -9.267 -6.268 1.015 1.00 29.30 O HETATM 1241 O HOH 22 -8.567 -19.297 29.749 1.00 14.33 O HETATM 1242 O HOH 23 -13.713 4.808 3.798 1.00 22.36 O HETATM 1243 O HOH 24 -11.825 -19.944 10.759 1.00 25.83 O HETATM 1244 O HOH 25 -2.378 4.446 18.956 1.00 15.71 O HETATM 1245 O HOH 26 -11.491 14.002 3.521 1.00 21.53 O HETATM 1246 O HOH 27 -6.424 -22.566 25.869 1.00 12.36 O HETATM 1247 O HOH 28 -1.549 -19.776 12.248 1.00 38.42 O HETATM 1248 O HOH 29 5.278 -9.465 16.791 1.00 24.17 O HETATM 1249 O HOH 30 -11.545 14.124 6.470 1.00 25.84 O HETATM 1250 O HOH 31 3.970 13.789 12.125 1.00 22.87 O HETATM 1251 O HOH 32 5.131 11.697 6.562 1.00 17.84 O HETATM 1252 O HOH 33 0.353 -13.790 16.826 1.00 24.68 O HETATM 1253 O HOH 34 -6.672 -9.049 33.603 1.00 16.33 O HETATM 1254 O HOH 35 -16.754 -3.004 13.260 1.00 13.30 O HETATM 1255 O HOH 36 -1.819 -18.082 24.133 1.00 16.50 O HETATM 1256 O HOH 37 -10.847 10.129 17.137 1.00 20.16 O HETATM 1257 O HOH 38 -8.699 12.727 15.187 1.00 18.27 O HETATM 1258 O HOH 39 3.435 -17.052 28.802 1.00 16.98 O HETATM 1259 O HOH 40 -5.691 6.312 19.450 1.00 15.90 O HETATM 1260 O HOH 41 9.426 6.306 -3.260 1.00 22.38 O HETATM 1261 O HOH 42 5.943 -3.157 8.426 1.00 24.78 O HETATM 1262 O HOH 43 3.354 2.185 19.140 1.00 31.50 O HETATM 1263 O HOH 44 0.415 1.137 19.923 1.00 13.54 O HETATM 1264 O HOH 45 -2.510 6.296 16.656 1.00 15.05 O HETATM 1265 O HOH 46 -13.381 -5.407 21.195 1.00 9.11 O HETATM 1266 O HOH 47 -1.254 13.710 6.605 1.00 14.50 O HETATM 1267 O HOH 48 -22.584 -6.572 34.405 1.00 23.37 O HETATM 1268 O HOH 49 -2.135 -17.061 21.509 1.00 17.84 O HETATM 1269 O HOH 50 -8.542 -9.041 35.494 1.00 18.07 O HETATM 1270 O HOH 51 -7.917 15.364 4.812 1.00 21.70 O HETATM 1271 O HOH 52 -0.742 -6.824 2.098 1.00 23.08 O HETATM 1272 O HOH 53 3.114 15.819 0.120 1.00 12.55 O HETATM 1273 O HOH 54 -9.601 -16.961 10.186 1.00 16.74 O HETATM 1274 O HOH 55 -10.984 -13.813 28.305 1.00 17.12 O HETATM 1275 O HOH 56 -12.487 0.451 21.677 1.00 9.14 O HETATM 1276 O HOH 57 -16.752 -12.145 30.139 1.00 24.28 O HETATM 1277 O HOH 58 -6.526 14.587 9.290 1.00 20.75 O HETATM 1278 O HOH 59 -7.316 2.818 35.670 1.00 26.43 O HETATM 1279 O HOH 60 -9.511 -2.415 23.814 1.00 7.82 O HETATM 1280 O HOH 61 -16.201 -6.649 22.175 1.00 16.54 O HETATM 1281 O HOH 62 -19.902 -2.475 22.532 1.00 19.38 O HETATM 1282 O HOH 63 -5.341 -18.873 24.156 1.00 15.79 O HETATM 1283 O HOH 64 -7.823 0.418 -1.188 1.00 26.10 O HETATM 1284 O HOH 65 -2.606 -1.162 -0.393 1.00 17.56 O HETATM 1285 O HOH 66 -2.514 -22.055 20.358 1.00 35.29 O HETATM 1286 O HOH 67 -13.810 -7.810 36.776 1.00 23.73 O HETATM 1287 O HOH 68 4.164 -10.478 4.213 1.00 24.90 O HETATM 1288 O HOH 69 -8.287 4.889 23.208 1.00 14.08 O HETATM 1289 O HOH 70 -6.656 13.483 13.374 1.00 16.05 O HETATM 1290 O HOH 71 -14.709 -14.241 5.832 1.00 31.48 O HETATM 1291 O HOH 72 4.649 -3.807 -1.799 1.00 29.82 O HETATM 1292 O HOH 73 -4.567 0.619 27.117 1.00 9.95 O HETATM 1293 O HOH 74 -17.862 -15.484 22.895 1.00 18.51 O HETATM 1294 O HOH 75 -10.746 -4.678 20.839 1.00 8.20 O HETATM 1295 O HOH 76 1.531 17.993 5.683 1.00 25.07 O HETATM 1296 O HOH 77 -0.908 13.974 13.904 1.00 29.36 O HETATM 1297 O HOH 78 3.829 -12.529 29.096 1.00 36.49 O HETATM 1298 O HOH 79 1.120 10.825 -4.305 1.00 26.40 O HETATM 1299 O HOH 80 -2.748 11.636 -4.727 1.00 21.26 O HETATM 1300 O HOH 81 -13.813 4.254 20.607 1.00 13.40 O HETATM 1301 O HOH 82 -14.474 -1.363 33.423 1.00 12.25 O HETATM 1302 O HOH 83 -3.722 -0.022 29.649 1.00 11.17 O HETATM 1303 O HOH 84 -7.448 -18.994 15.585 1.00 26.62 O HETATM 1304 O HOH 85 -24.424 -2.342 28.005 1.00 25.06 O HETATM 1305 O HOH 86 -6.737 -7.511 2.027 1.00 24.35 O HETATM 1306 O HOH 87 8.058 12.860 10.521 1.00 24.59 O HETATM 1307 O HOH 88 2.321 -14.950 24.881 1.00 27.04 O HETATM 1308 O HOH 89 3.049 -15.580 14.096 1.00 28.12 O HETATM 1309 O HOH 90 -8.708 -4.880 22.601 1.00 6.76 O HETATM 1310 O HOH 91 0.797 -14.261 20.155 1.00 28.67 O HETATM 1311 O HOH 92 -6.271 8.645 7.270 1.00 14.48 O HETATM 1312 O HOH 93 -13.806 -0.503 25.342 1.00 9.04 O HETATM 1313 O HOH 94 -6.440 16.057 1.681 1.00 22.34 O HETATM 1314 O HOH 95 9.962 0.358 -0.635 1.00 31.27 O HETATM 1315 O HOH 96 -8.361 6.475 25.473 1.00 21.45 O HETATM 1316 O HOH 97 -1.916 -1.829 25.473 1.00 14.20 O HETATM 1317 O HOH 98 -11.492 4.059 22.037 1.00 20.74 O HETATM 1318 O HOH 99 9.909 19.939 9.019 1.00 38.74 O HETATM 1319 O HOH 100 -3.483 13.721 -4.796 1.00 23.15 O HETATM 1320 O HOH 101 -15.757 -12.241 8.609 1.00 31.41 O HETATM 1321 O HOH 102 -6.435 -16.597 7.801 1.00 24.01 O HETATM 1322 O HOH 103 -11.626 -10.998 33.683 1.00 19.31 O HETATM 1323 O HOH 104 -3.115 3.280 -2.474 1.00 26.23 O HETATM 1324 O HOH 105 1.885 11.116 6.077 1.00 10.06 O HETATM 1325 O HOH 106 -8.978 14.462 7.125 1.00 25.76 O HETATM 1326 O HOH 107 -16.932 -7.115 19.329 1.00 11.57 O HETATM 1327 O HOH 108 -5.710 9.014 25.586 1.00 36.41 O HETATM 1328 O HOH 109 -2.524 2.414 26.696 1.00 16.39 O HETATM 1329 O HOH 110 -13.437 1.804 36.725 1.00 34.85 O HETATM 1330 O HOH 111 -17.771 -16.878 17.577 1.00 23.38 O HETATM 1331 O HOH 112 -4.232 -7.808 33.294 1.00 27.36 O HETATM 1332 O HOH 113 -4.337 -20.138 11.492 1.00 35.55 O HETATM 1333 O HOH 114 -12.428 -10.778 29.215 1.00 21.14 O HETATM 1334 O HOH 115 -0.070 -1.479 -1.119 1.00 24.91 O HETATM 1335 O HOH 116 3.633 -5.525 21.813 1.00 20.61 O HETATM 1336 O HOH 117 -14.051 8.933 14.860 1.00 22.44 O HETATM 1337 O HOH 118 -18.090 -13.111 24.762 1.00 30.97 O HETATM 1338 O HOH 119 -18.715 -11.973 35.302 1.00 38.40 O HETATM 1339 O HOH 120 7.272 18.598 6.536 1.00 21.85 O HETATM 1340 O HOH 121 -13.069 -8.107 2.311 1.00 27.45 O HETATM 1341 O HOH 122 -9.167 -11.754 32.254 1.00 21.58 O HETATM 1342 O HOH 123 -1.018 -11.523 29.589 1.00 31.28 O HETATM 1343 O HOH 124 -18.293 -5.645 23.654 1.00 19.95 O HETATM 1344 O HOH 125 -12.433 -1.793 23.184 1.00 7.79 O HETATM 1345 O HOH 126 -11.716 -16.710 8.289 1.00 16.74 O HETATM 1346 O HOH 127 -9.813 3.762 -3.390 1.00 25.35 O HETATM 1347 O HOH 128 -9.512 -14.038 30.484 1.00 13.43 O HETATM 1348 O HOH 129 -13.496 -7.361 4.957 1.00 17.59 O HETATM 1349 O HOH 130 -8.019 -14.521 5.209 1.00 35.95 O HETATM 1350 O HOH 131 -4.057 -0.402 36.081 1.00 35.52 O HETATM 1351 O HOH 132 -9.036 -2.540 39.470 1.00 31.67 O HETATM 1352 O HOH 133 -2.630 -15.335 31.742 1.00 17.44 O HETATM 1353 O HOH 134 -18.967 -4.385 34.670 1.00 23.79 O HETATM 1354 O HOH 135 -13.171 -18.824 8.051 1.00 35.39 O HETATM 1355 O HOH 136 -17.915 6.910 16.333 1.00 21.63 O HETATM 1356 O HOH 137 -11.937 -18.279 27.165 1.00 8.16 O HETATM 1357 O HOH 138 -12.035 -15.407 26.167 1.00 11.89 O HETATM 1358 O HOH 139 -17.341 5.568 8.917 1.00 37.28 O HETATM 1359 O HOH 140 -19.621 -6.949 19.718 1.00 24.71 O HETATM 1360 O HOH 141 -7.913 2.097 38.111 1.00 27.01 O HETATM 1361 O HOH 142 -9.023 -16.820 34.845 1.00 15.73 O HETATM 1362 O HOH 143 13.776 15.726 13.016 1.00 30.16 O HETATM 1363 O HOH 144 -18.658 0.783 12.190 1.00 26.30 O HETATM 1364 O HOH 145 8.705 -8.850 5.777 1.00 20.59 O HETATM 1365 O HOH 146 -20.295 -0.613 24.927 1.00 28.46 O HETATM 1366 O HOH 147 -1.763 3.918 24.949 1.00 18.42 O HETATM 1367 O HOH 148 -9.780 6.673 28.324 1.00 25.58 O HETATM 1368 O HOH 149 -16.442 -19.585 11.342 1.00 35.11 O HETATM 1369 O HOH 150 3.673 19.163 7.490 1.00 37.25 O HETATM 1370 O HOH 151 -9.275 7.055 19.100 1.00 22.18 O HETATM 1371 O HOH 152 -4.178 18.247 13.192 1.00 35.43 O HETATM 1372 O HOH 153 -0.720 5.213 27.234 1.00 23.36 O HETATM 1373 O HOH 154 -25.698 1.361 32.976 1.00 35.52 O HETATM 1374 O HOH 155 -0.193 7.316 17.444 1.00 18.26 O HETATM 1375 O HOH 156 0.014 10.246 17.250 1.00 24.92 O HETATM 1376 O HOH 157 -10.312 -20.696 28.078 1.00 19.02 O HETATM 1377 O HOH 158 -3.308 -11.614 31.905 1.00 39.52 O HETATM 1378 O HOH 159 -17.880 -12.172 9.844 1.00 33.49 O HETATM 1379 O HOH 160 -10.677 0.852 40.859 1.00 30.37 O HETATM 1380 O HOH 161 -2.616 -18.105 31.303 1.00 27.34 O HETATM 1381 O HOH 162 3.289 -8.751 18.227 1.00 38.66 O HETATM 1382 O HOH 163 -1.815 4.709 29.772 1.00 36.23 O HETATM 1383 O HOH 164 1.018 -4.169 -1.001 1.00 37.10 O HETATM 1384 O HOH 165 -5.013 16.549 7.774 1.00 29.12 O HETATM 1385 O HOH 166 -0.926 16.371 3.519 1.00 24.06 O HETATM 1386 O HOH 167 -7.870 15.333 11.625 1.00 24.20 O HETATM 1387 O HOH 168 -19.821 -8.439 37.129 1.00 29.31 O HETATM 1388 O HOH 169 5.747 8.922 6.427 1.00 31.21 O HETATM 1389 O HOH 170 7.744 8.541 14.045 1.00 33.59 O HETATM 1390 O HOH 171 -0.066 -0.587 23.803 1.00 16.06 O HETATM 1391 O HOH 172 -8.223 -19.316 9.700 1.00 38.59 O HETATM 1392 O HOH 173 -3.133 -5.524 1.726 1.00 36.25 O HETATM 1393 O HOH 174 -22.438 1.001 25.629 1.00 34.31 O HETATM 1394 O HOH 175 -3.790 0.353 -2.709 1.00 29.63 O HETATM 1395 O HOH 176 6.258 -14.143 29.174 1.00 28.04 O HETATM 1396 O HOH 177 5.639 -1.605 -3.525 1.00 35.17 O HETATM 1397 O HOH 178 -25.910 1.712 30.167 1.00 32.59 O HETATM 1398 O HOH 179 12.159 5.576 -1.697 1.00 24.90 O HETATM 1399 O HOH 180 -5.384 -22.655 20.789 1.00 24.36 O HETATM 1400 O HOH 181 -5.376 -21.422 23.548 1.00 20.14 O HETATM 1401 O HOH 182 -9.790 -0.225 0.266 1.00 35.22 O HETATM 1402 O HOH 183 -6.009 5.961 22.207 1.00 17.18 O HETATM 1403 O HOH 184 -9.866 4.349 -0.927 1.00 31.90 O HETATM 1404 O HOH 185 -4.314 8.672 19.354 1.00 33.58 O HETATM 1405 O HOH 186 -18.957 -1.851 34.725 1.00 27.31 O HETATM 1406 O HOH 187 7.432 5.825 -5.212 1.00 32.34 O HETATM 1407 O HOH 188 -15.047 -11.492 28.450 1.00 24.77 O HETATM 1408 O HOH 189 -3.675 6.225 35.466 1.00 28.86 O HETATM 1409 O HOH 190 -14.780 -15.027 25.630 1.00 22.27 O HETATM 1410 O HOH 191 -12.532 3.766 1.708 1.00 26.35 O HETATM 1411 O HOH 192 -10.321 6.245 21.325 1.00 24.42 O HETATM 1412 O HOH 193 -13.864 1.215 2.731 1.00 38.78 O HETATM 1413 O HOH 194 -15.228 -13.028 31.992 1.00 34.22 O HETATM 1414 O HOH 195 -2.351 16.033 7.324 1.00 20.96 O HETATM 1415 O HOH 196 -5.364 -20.393 14.284 1.00 35.83 O HETATM 1416 O HOH 197 -19.608 -1.981 10.344 1.00 33.97 O HETATM 1417 O HOH 198 -14.010 6.849 19.651 1.00 14.64 O HETATM 1418 O HOH 199 -9.583 -11.603 35.185 1.00 30.72 O HETATM 1419 O HOH 200 0.198 3.359 21.490 1.00 22.81 O HETATM 1420 O HOH 201 -17.051 -0.067 33.304 1.00 15.43 O HETATM 1421 O HOH 202 1.589 -17.504 30.964 1.00 16.49 O HETATM 1422 O HOH 203 -12.369 -12.300 31.399 1.00 31.40 O HETATM 1423 O HOH 204 -3.800 16.702 15.833 1.00 30.33 O HETATM 1424 O HOH 205 -8.571 -20.807 17.398 1.00 23.01 O HETATM 1425 O HOH 206 -0.758 18.295 6.902 1.00 26.37 O HETATM 1426 O HOH 207 -27.309 -6.243 34.946 1.00 38.87 O HETATM 1427 O HOH 208 -3.098 -3.868 -0.552 1.00 31.41 O HETATM 1428 O HOH 209 -13.147 -14.155 29.745 1.00 31.36 O HETATM 1429 O HOH 210 -5.077 -10.685 35.278 1.00 38.13 O HETATM 1430 O HOH 211 -11.937 7.680 17.822 1.00 18.11 O HETATM 1431 O HOH 212 -0.254 7.488 20.155 1.00 22.20 O HETATM 1432 O HOH 213 -0.042 -20.508 27.962 1.00 19.08 O HETATM 1433 C10 UNN A 214 -19.798 -9.106 21.475 1.00 -0.07 C HETATM 1434 C11 UNN A 214 -19.733 -10.262 20.730 1.00 -0.06 C HETATM 1435 C12 UNN A 214 -18.624 -11.049 20.721 1.00 -0.00 C HETATM 1436 C13 UNN A 214 -18.494 -12.371 20.022 1.00 0.06 C HETATM 1437 O15 UNN A 214 -17.499 -13.085 20.106 1.00 -0.56 O HETATM 1438 O14 UNN A 214 -19.454 -12.849 19.384 1.00 -0.56 O HETATM 1439 C16 UNN A 214 -17.527 -10.681 21.502 1.00 -0.03 C HETATM 1440 C08 UNN A 214 -17.621 -9.588 22.174 1.00 0.07 C HETATM 1441 N07 UNN A 214 -16.361 -9.293 22.908 1.00 -0.24 N HETATM 1442 C05 UNN A 214 -15.628 -10.109 23.860 1.00 0.21 C HETATM 1443 C04 UNN A 214 -14.265 -9.513 24.433 1.00 0.08 C HETATM 1444 C17 UNN A 214 -13.845 -9.722 25.729 1.00 -0.06 C HETATM 1445 C18 UNN A 214 -12.627 -9.175 26.123 1.00 -0.01 C HETATM 1446 C19 UNN A 214 -11.763 -8.467 25.231 1.00 0.20 C HETATM 1447 O20 UNN A 214 -10.700 -8.022 25.564 1.00 -0.42 O HETATM 1448 N02 UNN A 214 -12.215 -8.328 23.993 1.00 -0.20 N HETATM 1449 C01 UNN A 214 -11.401 -7.622 22.966 1.00 0.06 C HETATM 1450 H3 UNN A 214 -11.945 -7.612 22.010 1.00 0.06 H HETATM 1451 H4 UNN A 214 -10.442 -8.144 22.836 1.00 0.06 H HETATM 1452 H5 UNN A 214 -11.215 -6.588 23.293 1.00 0.06 H HETATM 1453 C03 UNN A 214 -13.380 -8.814 23.584 1.00 0.09 C HETATM 1454 H7 UNN A 214 -13.667 -8.667 22.544 1.00 0.14 H HETATM 1455 H6 UNN A 214 -12.318 -9.292 27.160 1.00 0.04 H HETATM 1456 H2 UNN A 214 -14.450 -10.300 26.426 1.00 0.07 H HETATM 1457 O06 UNN A 214 -15.974 -11.126 24.328 1.00 -0.39 O HETATM 1458 H8 UNN A 214 -15.958 -8.398 22.717 1.00 0.22 H HETATM 1459 C09 UNN A 214 -18.690 -8.731 22.178 1.00 -0.04 C HETATM 1460 H11 UNN A 214 -18.657 -7.792 22.718 1.00 0.05 H HETATM 1461 H9 UNN A 214 -16.632 -11.291 21.541 1.00 0.05 H HETATM 1462 H10 UNN A 214 -20.590 -10.553 20.134 1.00 0.05 H HETATM 1463 H1 UNN A 214 -20.703 -8.511 21.502 1.00 0.06 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 1433 1434 1459 1463 CONECT 1434 1433 1435 1462 CONECT 1435 1434 1436 1439 CONECT 1436 1435 1437 1438 CONECT 1437 1436 CONECT 1438 1436 CONECT 1439 1435 1440 1461 CONECT 1440 1439 1441 1459 CONECT 1441 1440 1442 1458 CONECT 1442 1441 1443 1457 CONECT 1443 1442 1444 1453 CONECT 1444 1443 1445 1456 CONECT 1445 1444 1446 1455 CONECT 1446 1445 1447 1448 CONECT 1447 1446 CONECT 1448 1446 1449 1453 CONECT 1449 1448 1450 1451 1452 CONECT 1450 1449 CONECT 1451 1449 CONECT 1452 1449 CONECT 1453 1443 1448 1454 CONECT 1454 1453 CONECT 1455 1445 CONECT 1456 1444 CONECT 1457 1442 CONECT 1458 1441 CONECT 1459 1433 1440 1460 CONECT 1460 1459 CONECT 1461 1439 CONECT 1462 1434 CONECT 1463 1433 MASTER 0 0 0 0 0 0 0 0 1462 1 35 10 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 5ep7
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%
5h85
RCSB PDB
PDBbind
119aa, >5H85_1|Chain... at 98%
5i83
RCSB PDB
PDBbind
118aa, >5I83_1|Chain... at 98%
5i86
RCSB PDB
PDBbind
118aa, >5I86_1|Chains... at 98%
5i89
RCSB PDB
PDBbind
118aa, >5I89_1|Chain... at 98%
5i8b
RCSB PDB
PDBbind
264aa, >5I8B_1|Chain... *
5i8g
RCSB PDB
PDBbind
264aa, >5I8G_1|Chain... at 100%
5j0d
RCSB PDB
PDBbind
119aa, >5J0D_1|Chain... at 98%
5ktu
RCSB PDB
PDBbind
118aa, >5KTU_1|Chains... at 98%
5ktw
RCSB PDB
PDBbind
114aa, >5KTW_1|Chains... at 97%
5ktx
RCSB PDB
PDBbind
114aa, >5KTX_1|Chain... at 97%
5lpj
RCSB PDB
PDBbind
119aa, >5LPJ_1|Chain... at 98%
5lpk
RCSB PDB
PDBbind
122aa, >5LPK_1|Chains... at 92%
5lpl
RCSB PDB
PDBbind
119aa, >5LPL_1|Chain... at 98%
5lpm
RCSB PDB
PDBbind
116aa, >5LPM_1|Chains... at 94%
5mme
RCSB PDB
PDBbind
119aa, >5MME_1|Chains... at 98%
5mmg
RCSB PDB
PDBbind
119aa, >5MMG_1|Chain... at 98%
5mpk
RCSB PDB
PDBbind
119aa, >5MPK_1|Chains... at 98%
5mpn
RCSB PDB
PDBbind
119aa, >5MPN_1|Chain... at 98%
5mpz
RCSB PDB
PDBbind
119aa, >5MPZ_1|Chain... at 98%
5mqe
RCSB PDB
PDBbind
119aa, >5MQE_1|Chains... at 98%
5nlk
RCSB PDB
PDBbind
119aa, >5NLK_1|Chain... at 98%
5nu3
RCSB PDB
PDBbind
119aa, >5NU3_1|Chain... at 98%
5nu5
RCSB PDB
PDBbind
116aa, >5NU5_1|Chains... at 94%
5tb6
RCSB PDB
PDBbind
119aa, >5TB6_1|Chain... at 98%
5w0e
RCSB PDB
PDBbind
148aa, >5W0E_1|Chain... at 100%
5w0f
RCSB PDB
PDBbind
148aa, >5W0F_1|Chain... at 100%
5w0i
RCSB PDB
PDBbind
148aa, >5W0I_1|Chain... at 100%
5w0l
RCSB PDB
PDBbind
148aa, >5W0L_1|Chains... at 100%
5w0q
RCSB PDB
PDBbind
148aa, >5W0Q_1|Chain... at 100%
6axq
RCSB PDB
PDBbind
114aa, >6AXQ_1|Chains... at 98%
6ay3
RCSB PDB
PDBbind
115aa, >6AY3_1|Chains... at 100%
6ay5
RCSB PDB
PDBbind
115aa, >6AY5_1|Chain... at 100%
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
5ep7
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
CREB-binding protein
Ligand Name
5QR
EC.Number
E.C.2.3.1.48
Resolution
1.2(Å)
Affinity (Kd/Ki/IC50)
Kd=4uM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) ACS Med Chem Lett Vol. 9: pp. 929-934
Ligand Properties
Formula
C
1
4
H
1
2
N
2
O
4
Molecular Weight
272.256
Exact Mass
272.080
No. of atoms
32
No. of bonds
33
Polar Surface Area
88.4
LOGP Value
1.55 (
Computed with XLOGP3
)
1.41 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 3
No. of Nitrogen and Oxygen Atoms: 6
No. of Rings: 2
Canonical SMILES
O=C(c1ccc(=O)n(c1)C)Nc1cccc(c1)C(=O)O
InChI String
InChI=1S/C14H12N2O4/c1-16-8-10(5-6-12(16)17)13(18)15-11-4-2-3-9(7-11)14(19)20/h2-8H,1H3,(H,15,18)(H,19,20)
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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