Browse entries in the PDBbind-CN Database
HEADER 6EVN_COMPLEX COMPND 6EVN_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 95 MET LEU SER VAL ASP ASP CYS PHE GLY MET GLY ARG SER SEQRES 2 A 95 ALA TYR ASN GLU GLY ASP TYR TYR HIS THR VAL LEU TRP SEQRES 3 A 95 MET GLU GLN VAL LEU LYS GLN LEU ASP ALA GLY GLU GLU SEQRES 4 A 95 ALA THR THR THR LYS SER GLN VAL LEU ASP TYR LEU SER SEQRES 5 A 95 TYR ALA VAL PHE GLN LEU GLY ASP LEU HIS ARG ALA LEU SEQRES 6 A 95 GLU LEU THR ARG ARG LEU LEU SER LEU ASP PRO SER HIS SEQRES 7 A 95 GLU ARG ALA GLY GLY ASN LEU ARG TYR PHE GLU GLN LEU SEQRES 8 A 95 LEU GLU GLU GLU HET PRO A 187 104 ATOM 1 N MET A 144 41.080 11.201 -13.823 1.00 96.93 N ATOM 2 CA MET A 144 40.608 9.851 -13.527 1.00 88.69 C ATOM 3 C MET A 144 39.901 9.776 -12.176 1.00 92.41 C ATOM 4 O MET A 144 40.282 10.449 -11.215 1.00 87.34 O ATOM 5 CB MET A 144 41.775 8.859 -13.531 1.00 94.21 C ATOM 6 CG MET A 144 42.213 8.382 -14.908 1.00110.05 C ATOM 7 SD MET A 144 42.906 9.692 -15.933 1.00131.30 S ATOM 8 CE MET A 144 43.814 8.728 -17.141 1.00105.40 C ATOM 9 HN3 MET A 144 41.751 11.501 -13.087 1.00 0.00 H ATOM 10 HN2 MET A 144 40.270 11.853 -13.843 1.00 0.00 H ATOM 11 HN1 MET A 144 41.554 11.206 -14.749 1.00 0.00 H ATOM 12 N LEU A 145 38.861 8.952 -12.121 1.00 72.95 N ATOM 13 CA LEU A 145 38.240 8.548 -10.871 1.00 52.07 C ATOM 14 C LEU A 145 38.859 7.230 -10.420 1.00 40.03 C ATOM 15 O LEU A 145 39.372 6.455 -11.226 1.00 44.11 O ATOM 16 CB LEU A 145 36.733 8.358 -11.075 1.00 40.98 C ATOM 17 CG LEU A 145 35.901 9.620 -11.344 1.00 39.29 C ATOM 18 CD1 LEU A 145 34.700 9.305 -12.216 1.00 42.98 C ATOM 19 CD2 LEU A 145 35.440 10.243 -10.040 1.00 48.57 C ATOM 20 H LEU A 145 38.474 8.580 -13.012 1.00 0.00 H ATOM 21 N SER A 146 38.787 6.970 -9.119 1.00 35.50 N ATOM 22 CA SER A 146 39.351 5.737 -8.589 1.00 38.60 C ATOM 23 C SER A 146 38.465 4.544 -8.950 1.00 39.66 C ATOM 24 O SER A 146 37.319 4.691 -9.388 1.00 32.37 O ATOM 25 CB SER A 146 39.518 5.820 -7.075 1.00 36.84 C ATOM 26 OG SER A 146 38.289 5.638 -6.392 1.00 35.99 O ATOM 27 HG SER A 146 38.443 5.699 -5.416 1.00 0.00 H ATOM 28 H SER A 146 38.327 7.648 -8.479 1.00 0.00 H ATOM 29 N VAL A 147 39.032 3.345 -8.771 1.00 33.54 N ATOM 30 CA VAL A 147 38.280 2.110 -8.985 1.00 34.37 C ATOM 31 C VAL A 147 36.988 2.135 -8.186 1.00 31.78 C ATOM 32 O VAL A 147 35.903 1.871 -8.711 1.00 27.32 O ATOM 33 CB VAL A 147 39.145 0.891 -8.613 1.00 43.11 C ATOM 34 CG1 VAL A 147 38.323 -0.384 -8.656 1.00 41.10 C ATOM 35 CG2 VAL A 147 40.324 0.779 -9.553 1.00 42.34 C ATOM 36 H VAL A 147 40.027 3.291 -8.474 1.00 0.00 H ATOM 37 N ASP A 148 37.088 2.421 -6.888 1.00 27.75 N ATOM 38 CA ASP A 148 35.902 2.399 -6.045 1.00 26.19 C ATOM 39 C ASP A 148 34.923 3.522 -6.414 1.00 25.45 C ATOM 40 O ASP A 148 33.708 3.323 -6.334 1.00 26.41 O ATOM 41 CB ASP A 148 36.301 2.431 -4.564 1.00 31.86 C ATOM 42 CG ASP A 148 36.930 1.122 -4.091 1.00 39.88 C ATOM 43 OD1 ASP A 148 36.736 0.076 -4.737 1.00 30.62 O ATOM 44 OD2 ASP A 148 37.601 1.120 -3.046 1.00 35.75 O ATOM 45 H ASP A 148 38.013 2.660 -6.478 1.00 0.00 H ATOM 46 N ASP A 149 35.424 4.689 -6.826 1.00 29.91 N ATOM 47 CA ASP A 149 34.546 5.750 -7.324 1.00 28.36 C ATOM 48 C ASP A 149 33.770 5.288 -8.559 1.00 24.98 C ATOM 49 O ASP A 149 32.554 5.481 -8.651 1.00 24.01 O ATOM 50 CB ASP A 149 35.354 6.997 -7.694 1.00 32.77 C ATOM 51 CG ASP A 149 36.006 7.677 -6.500 1.00 36.41 C ATOM 52 OD1 ASP A 149 35.552 7.484 -5.353 1.00 35.29 O ATOM 53 OD2 ASP A 149 36.972 8.436 -6.748 1.00 40.63 O ATOM 54 H ASP A 149 36.451 4.847 -6.793 1.00 0.00 H ATOM 55 N CYS A 150 34.472 4.721 -9.540 1.00 25.63 N ATOM 56 CA CYS A 150 33.803 4.211 -10.740 1.00 22.98 C ATOM 57 C CYS A 150 32.780 3.134 -10.397 1.00 23.69 C ATOM 58 O CYS A 150 31.693 3.084 -10.984 1.00 21.02 O ATOM 59 CB CYS A 150 34.838 3.664 -11.721 1.00 27.27 C ATOM 60 SG CYS A 150 35.790 4.934 -12.538 1.00 30.75 S ATOM 61 H CYS A 150 35.505 4.640 -9.453 1.00 0.00 H ATOM 62 N PHE A 151 33.111 2.248 -9.456 1.00 21.81 N ATOM 63 CA PHE A 151 32.142 1.254 -9.014 1.00 21.45 C ATOM 64 C PHE A 151 30.901 1.930 -8.441 1.00 21.90 C ATOM 65 O PHE A 151 29.767 1.513 -8.710 1.00 19.05 O ATOM 66 CB PHE A 151 32.800 0.327 -7.985 1.00 19.97 C ATOM 67 CG PHE A 151 31.897 -0.761 -7.496 1.00 21.25 C ATOM 68 CD1 PHE A 151 31.519 -1.779 -8.346 1.00 21.95 C ATOM 69 CD2 PHE A 151 31.442 -0.784 -6.193 1.00 24.74 C ATOM 70 CE1 PHE A 151 30.675 -2.785 -7.935 1.00 23.77 C ATOM 71 CE2 PHE A 151 30.600 -1.808 -5.759 1.00 25.89 C ATOM 72 CZ PHE A 151 30.227 -2.812 -6.621 1.00 25.93 C ATOM 73 H PHE A 151 34.063 2.267 -9.037 1.00 0.00 H ATOM 74 N GLY A 152 31.100 2.979 -7.640 1.00 21.10 N ATOM 75 CA GLY A 152 29.966 3.691 -7.074 1.00 22.03 C ATOM 76 C GLY A 152 29.123 4.348 -8.152 1.00 18.08 C ATOM 77 O GLY A 152 27.884 4.332 -8.084 1.00 20.67 O ATOM 78 H GLY A 152 32.069 3.288 -7.420 1.00 0.00 H ATOM 79 N MET A 153 29.783 4.888 -9.173 1.00 19.70 N ATOM 80 CA MET A 153 29.058 5.433 -10.323 1.00 20.26 C ATOM 81 C MET A 153 28.247 4.356 -11.025 1.00 19.09 C ATOM 82 O MET A 153 27.097 4.583 -11.399 1.00 17.79 O ATOM 83 CB MET A 153 30.025 6.072 -11.316 1.00 22.20 C ATOM 84 CG MET A 153 30.771 7.281 -10.823 1.00 27.93 C ATOM 85 SD MET A 153 29.670 8.715 -10.739 1.00 25.16 S ATOM 86 CE MET A 153 30.785 9.877 -9.976 1.00 30.38 C ATOM 87 H MET A 153 30.822 4.923 -9.154 1.00 0.00 H ATOM 88 N GLY A 154 28.840 3.183 -11.243 1.00 18.06 N ATOM 89 CA GLY A 154 28.106 2.100 -11.885 1.00 18.52 C ATOM 90 C GLY A 154 26.918 1.642 -11.067 1.00 18.35 C ATOM 91 O GLY A 154 25.855 1.329 -11.603 1.00 19.61 O ATOM 92 H GLY A 154 29.829 3.040 -10.954 1.00 0.00 H ATOM 93 N ARG A 155 27.086 1.593 -9.742 1.00 18.86 N ATOM 94 CA ARG A 155 25.971 1.198 -8.892 1.00 22.31 C ATOM 95 C ARG A 155 24.870 2.248 -8.912 1.00 17.98 C ATOM 96 O ARG A 155 23.687 1.906 -8.956 1.00 21.07 O ATOM 97 CB ARG A 155 26.463 0.964 -7.464 1.00 23.37 C ATOM 98 CG ARG A 155 27.234 -0.309 -7.292 1.00 26.02 C ATOM 99 CD ARG A 155 27.511 -0.564 -5.795 1.00 31.52 C ATOM 100 NE ARG A 155 26.276 -0.684 -5.030 1.00 27.60 N ATOM 101 CZ ARG A 155 25.959 0.025 -3.952 1.00 45.86 C ATOM 102 NH1 ARG A 155 26.782 0.950 -3.470 1.00 44.40 N ATOM 103 NH2 ARG A 155 24.799 -0.199 -3.351 1.00 48.80 N ATOM 104 HE ARG A 155 25.582 -1.386 -5.357 1.00 0.00 H ATOM 105 HH12 ARG A 155 26.515 1.494 -2.625 1.00 0.00 H ATOM 106 HH11 ARG A 155 27.693 1.130 -3.938 1.00 0.00 H ATOM 107 HH22 ARG A 155 24.537 0.348 -2.506 1.00 0.00 H ATOM 108 HH21 ARG A 155 24.151 -0.922 -3.724 1.00 0.00 H ATOM 109 H ARG A 155 28.006 1.835 -9.321 1.00 0.00 H ATOM 110 N SER A 156 25.255 3.518 -8.955 1.00 19.06 N ATOM 111 CA SER A 156 24.283 4.603 -9.055 1.00 20.65 C ATOM 112 C SER A 156 23.466 4.481 -10.335 1.00 23.48 C ATOM 113 O SER A 156 22.231 4.515 -10.319 1.00 24.84 O ATOM 114 CB SER A 156 25.049 5.911 -9.026 1.00 21.89 C ATOM 115 OG SER A 156 24.228 7.036 -9.285 1.00 25.96 O ATOM 116 HG SER A 156 23.515 7.088 -8.600 1.00 0.00 H ATOM 117 H SER A 156 26.269 3.745 -8.917 1.00 0.00 H ATOM 118 N ALA A 157 24.145 4.305 -11.466 1.00 20.63 N ATOM 119 CA ALA A 157 23.437 4.104 -12.722 1.00 22.10 C ATOM 120 C ALA A 157 22.502 2.897 -12.651 1.00 22.30 C ATOM 121 O ALA A 157 21.325 2.979 -13.017 1.00 24.21 O ATOM 122 CB ALA A 157 24.462 3.955 -13.837 1.00 20.30 C ATOM 123 H ALA A 157 25.185 4.311 -11.452 1.00 0.00 H ATOM 124 N TYR A 158 22.997 1.769 -12.119 1.00 20.11 N ATOM 125 CA TYR A 158 22.183 0.567 -12.014 1.00 20.07 C ATOM 126 C TYR A 158 20.935 0.814 -11.173 1.00 24.68 C ATOM 127 O TYR A 158 19.842 0.342 -11.515 1.00 27.80 O ATOM 128 CB TYR A 158 23.045 -0.521 -11.360 1.00 22.46 C ATOM 129 CG TYR A 158 22.352 -1.837 -11.136 1.00 21.53 C ATOM 130 CD1 TYR A 158 22.293 -2.802 -12.124 1.00 22.26 C ATOM 131 CD2 TYR A 158 21.769 -2.121 -9.902 1.00 22.86 C ATOM 132 CE1 TYR A 158 21.668 -4.017 -11.900 1.00 22.13 C ATOM 133 CE2 TYR A 158 21.139 -3.312 -9.679 1.00 23.24 C ATOM 134 CZ TYR A 158 21.098 -4.261 -10.662 1.00 21.55 C ATOM 135 OH TYR A 158 20.471 -5.449 -10.424 1.00 25.51 O ATOM 136 HH TYR A 158 20.909 -5.905 -9.662 1.00 0.00 H ATOM 137 H TYR A 158 23.979 1.753 -11.776 1.00 0.00 H ATOM 138 N ASN A 159 21.086 1.522 -10.064 1.00 23.37 N ATOM 139 CA ASN A 159 19.950 1.762 -9.178 1.00 26.21 C ATOM 140 C ASN A 159 18.923 2.697 -9.812 1.00 37.26 C ATOM 141 O ASN A 159 17.769 2.719 -9.376 1.00 37.08 O ATOM 142 CB ASN A 159 20.461 2.207 -7.807 1.00 30.56 C ATOM 143 CG ASN A 159 21.082 1.039 -7.015 1.00 27.83 C ATOM 144 OD1 ASN A 159 20.638 -0.102 -7.149 1.00 35.42 O ATOM 145 ND2 ASN A 159 22.113 1.319 -6.241 1.00 36.57 N ATOM 146 HD22 ASN A 159 22.452 2.299 -6.160 1.00 0.00 H ATOM 147 HD21 ASN A 159 22.587 0.560 -5.712 1.00 0.00 H ATOM 148 H ASN A 159 22.020 1.910 -9.822 1.00 0.00 H ATOM 149 N GLU A 160 19.303 3.434 -10.856 1.00 31.73 N ATOM 150 CA GLU A 160 18.347 4.200 -11.654 1.00 33.88 C ATOM 151 C GLU A 160 17.761 3.403 -12.812 1.00 34.78 C ATOM 152 O GLU A 160 17.017 3.969 -13.622 1.00 39.02 O ATOM 153 CB GLU A 160 19.017 5.468 -12.203 1.00 30.04 C ATOM 154 CG GLU A 160 19.555 6.398 -11.154 1.00 27.88 C ATOM 155 CD GLU A 160 18.469 6.986 -10.252 1.00 37.68 C ATOM 156 OE1 GLU A 160 17.276 6.877 -10.602 1.00 44.02 O ATOM 157 OE2 GLU A 160 18.818 7.542 -9.201 1.00 42.44 O ATOM 158 H GLU A 160 20.311 3.465 -11.111 1.00 0.00 H ATOM 159 N GLY A 161 18.080 2.112 -12.927 1.00 30.86 N ATOM 160 CA GLY A 161 17.675 1.332 -14.073 1.00 34.23 C ATOM 161 C GLY A 161 18.379 1.701 -15.359 1.00 29.88 C ATOM 162 O GLY A 161 17.895 1.366 -16.441 1.00 34.35 O ATOM 163 H GLY A 161 18.633 1.657 -12.173 1.00 0.00 H ATOM 164 N ASP A 162 19.519 2.395 -15.264 1.00 27.29 N ATOM 165 CA ASP A 162 20.312 2.781 -16.422 1.00 22.35 C ATOM 166 C ASP A 162 21.388 1.729 -16.668 1.00 24.81 C ATOM 167 O ASP A 162 22.533 1.846 -16.218 1.00 24.11 O ATOM 168 CB ASP A 162 20.905 4.160 -16.190 1.00 22.66 C ATOM 169 CG ASP A 162 21.627 4.702 -17.391 1.00 25.43 C ATOM 170 OD1 ASP A 162 21.961 3.924 -18.320 1.00 25.64 O ATOM 171 OD2 ASP A 162 21.936 5.906 -17.366 1.00 24.27 O ATOM 172 H ASP A 162 19.854 2.671 -14.319 1.00 0.00 H ATOM 173 N TYR A 163 21.016 0.705 -17.431 1.00 21.39 N ATOM 174 CA TYR A 163 21.925 -0.412 -17.687 1.00 20.70 C ATOM 175 C TYR A 163 23.087 -0.003 -18.580 1.00 19.45 C ATOM 176 O TYR A 163 24.202 -0.513 -18.441 1.00 21.06 O ATOM 177 CB TYR A 163 21.133 -1.608 -18.223 1.00 21.44 C ATOM 178 CG TYR A 163 20.115 -2.053 -17.206 1.00 22.64 C ATOM 179 CD1 TYR A 163 20.525 -2.491 -15.965 1.00 22.10 C ATOM 180 CD2 TYR A 163 18.750 -1.983 -17.452 1.00 24.08 C ATOM 181 CE1 TYR A 163 19.618 -2.881 -15.005 1.00 25.52 C ATOM 182 CE2 TYR A 163 17.832 -2.372 -16.503 1.00 27.78 C ATOM 183 CZ TYR A 163 18.277 -2.815 -15.270 1.00 29.45 C ATOM 184 OH TYR A 163 17.390 -3.207 -14.299 1.00 32.97 O ATOM 185 HH TYR A 163 17.889 -3.490 -13.492 1.00 0.00 H ATOM 186 H TYR A 163 20.065 0.698 -17.852 1.00 0.00 H ATOM 187 N TYR A 164 22.849 0.880 -19.561 1.00 20.27 N ATOM 188 CA TYR A 164 23.933 1.299 -20.425 1.00 19.12 C ATOM 189 C TYR A 164 25.046 1.978 -19.631 1.00 19.33 C ATOM 190 O TYR A 164 26.227 1.656 -19.804 1.00 19.04 O ATOM 191 CB TYR A 164 23.410 2.202 -21.563 1.00 21.76 C ATOM 192 CG TYR A 164 24.532 2.578 -22.480 1.00 20.72 C ATOM 193 CD1 TYR A 164 25.163 1.606 -23.240 1.00 24.51 C ATOM 194 CD2 TYR A 164 25.008 3.877 -22.572 1.00 20.82 C ATOM 195 CE1 TYR A 164 26.220 1.912 -24.058 1.00 24.51 C ATOM 196 CE2 TYR A 164 26.063 4.206 -23.391 1.00 23.31 C ATOM 197 CZ TYR A 164 26.682 3.213 -24.139 1.00 23.17 C ATOM 198 OH TYR A 164 27.742 3.502 -24.968 1.00 26.11 O ATOM 199 HH TYR A 164 28.483 3.882 -24.433 1.00 0.00 H ATOM 200 H TYR A 164 21.892 1.262 -19.700 1.00 0.00 H ATOM 201 N HIS A 165 24.687 2.913 -18.759 1.00 22.71 N ATOM 202 CA HIS A 165 25.723 3.566 -17.963 1.00 22.85 C ATOM 203 C HIS A 165 26.319 2.620 -16.927 1.00 21.50 C ATOM 204 O HIS A 165 27.515 2.702 -16.652 1.00 21.61 O ATOM 205 CB HIS A 165 25.205 4.886 -17.399 1.00 20.69 C ATOM 206 CG HIS A 165 25.047 5.936 -18.461 1.00 20.44 C ATOM 207 ND1 HIS A 165 23.834 6.484 -18.800 1.00 22.18 N ATOM 208 CD2 HIS A 165 25.958 6.511 -19.266 1.00 22.70 C ATOM 209 CE1 HIS A 165 23.997 7.348 -19.789 1.00 22.59 C ATOM 210 NE2 HIS A 165 25.277 7.380 -20.097 1.00 22.59 N ATOM 211 H HIS A 165 23.687 3.175 -18.645 1.00 0.00 H ATOM 212 N THR A 166 25.548 1.648 -16.458 1.00 21.08 N ATOM 213 CA THR A 166 26.144 0.605 -15.612 1.00 19.03 C ATOM 214 C THR A 166 27.278 -0.102 -16.339 1.00 19.17 C ATOM 215 O THR A 166 28.363 -0.300 -15.787 1.00 18.16 O ATOM 216 CB THR A 166 25.102 -0.425 -15.202 1.00 18.70 C ATOM 217 OG1 THR A 166 24.014 0.183 -14.510 1.00 20.77 O ATOM 218 CG2 THR A 166 25.723 -1.465 -14.255 1.00 20.12 C ATOM 219 HG1 THR A 166 23.582 0.851 -15.099 1.00 0.00 H ATOM 220 H THR A 166 24.534 1.624 -16.686 1.00 0.00 H ATOM 221 N VAL A 167 27.065 -0.472 -17.609 1.00 18.98 N ATOM 222 CA VAL A 167 28.114 -1.146 -18.364 1.00 17.12 C ATOM 223 C VAL A 167 29.337 -0.251 -18.498 1.00 17.38 C ATOM 224 O VAL A 167 30.473 -0.696 -18.318 1.00 20.00 O ATOM 225 CB VAL A 167 27.596 -1.570 -19.756 1.00 20.82 C ATOM 226 CG1 VAL A 167 28.763 -2.073 -20.647 1.00 23.35 C ATOM 227 CG2 VAL A 167 26.512 -2.656 -19.619 1.00 23.15 C ATOM 228 H VAL A 167 26.147 -0.277 -18.058 1.00 0.00 H ATOM 229 N LEU A 168 29.123 1.032 -18.855 1.00 18.94 N ATOM 230 CA LEU A 168 30.274 1.909 -19.092 1.00 22.59 C ATOM 231 C LEU A 168 31.146 1.985 -17.846 1.00 19.67 C ATOM 232 O LEU A 168 32.370 1.845 -17.914 1.00 21.55 O ATOM 233 CB LEU A 168 29.820 3.312 -19.501 1.00 22.67 C ATOM 234 CG LEU A 168 29.079 3.516 -20.820 1.00 29.20 C ATOM 235 CD1 LEU A 168 29.007 5.011 -21.137 1.00 29.18 C ATOM 236 CD2 LEU A 168 29.775 2.751 -21.926 1.00 36.82 C ATOM 237 H LEU A 168 28.154 1.395 -18.961 1.00 0.00 H ATOM 238 N TRP A 169 30.525 2.167 -16.683 1.00 19.80 N ATOM 239 CA TRP A 169 31.302 2.320 -15.465 1.00 19.15 C ATOM 240 C TRP A 169 31.938 1.000 -15.051 1.00 17.88 C ATOM 241 O TRP A 169 33.107 0.972 -14.663 1.00 19.91 O ATOM 242 CB TRP A 169 30.414 2.855 -14.344 1.00 18.39 C ATOM 243 CG TRP A 169 30.017 4.286 -14.525 1.00 17.33 C ATOM 244 CD1 TRP A 169 28.776 4.755 -14.800 1.00 16.85 C ATOM 245 CD2 TRP A 169 30.879 5.422 -14.489 1.00 17.72 C ATOM 246 NE1 TRP A 169 28.797 6.118 -14.915 1.00 17.91 N ATOM 247 CE2 TRP A 169 30.080 6.555 -14.749 1.00 18.83 C ATOM 248 CE3 TRP A 169 32.249 5.593 -14.262 1.00 20.98 C ATOM 249 CZ2 TRP A 169 30.600 7.849 -14.756 1.00 21.26 C ATOM 250 CZ3 TRP A 169 32.767 6.876 -14.266 1.00 21.96 C ATOM 251 CH2 TRP A 169 31.940 7.990 -14.521 1.00 22.52 C ATOM 252 HE1 TRP A 169 27.971 6.722 -15.099 1.00 0.00 H ATOM 253 H TRP A 169 29.486 2.200 -16.646 1.00 0.00 H ATOM 254 N MET A 170 31.193 -0.101 -15.135 1.00 17.27 N ATOM 255 CA MET A 170 31.748 -1.362 -14.659 1.00 18.29 C ATOM 256 C MET A 170 32.850 -1.885 -15.559 1.00 20.40 C ATOM 257 O MET A 170 33.811 -2.477 -15.057 1.00 21.54 O ATOM 258 CB MET A 170 30.648 -2.402 -14.467 1.00 19.17 C ATOM 259 CG MET A 170 29.607 -2.045 -13.431 1.00 17.32 C ATOM 260 SD MET A 170 30.357 -1.521 -11.856 1.00 20.25 S ATOM 261 CE MET A 170 28.878 -1.385 -10.836 1.00 19.03 C ATOM 262 H MET A 170 30.233 -0.062 -15.533 1.00 0.00 H ATOM 263 N GLU A 171 32.745 -1.647 -16.870 1.00 20.48 N ATOM 264 CA GLU A 171 33.849 -1.980 -17.760 1.00 24.02 C ATOM 265 C GLU A 171 35.108 -1.213 -17.374 1.00 25.37 C ATOM 266 O GLU A 171 36.208 -1.772 -17.378 1.00 26.74 O ATOM 267 CB GLU A 171 33.464 -1.717 -19.221 1.00 24.39 C ATOM 268 CG GLU A 171 32.293 -2.562 -19.740 1.00 28.37 C ATOM 269 CD GLU A 171 32.712 -3.927 -20.241 1.00 36.17 C ATOM 270 OE1 GLU A 171 33.826 -4.380 -19.906 1.00 46.70 O ATOM 271 OE2 GLU A 171 31.915 -4.543 -20.981 1.00 40.70 O ATOM 272 H GLU A 171 31.876 -1.224 -17.254 1.00 0.00 H ATOM 273 N GLN A 172 34.968 0.065 -17.019 1.00 22.78 N ATOM 274 CA GLN A 172 36.125 0.839 -16.588 1.00 27.61 C ATOM 275 C GLN A 172 36.701 0.292 -15.287 1.00 27.60 C ATOM 276 O GLN A 172 37.921 0.255 -15.105 1.00 28.33 O ATOM 277 CB GLN A 172 35.732 2.307 -16.435 1.00 27.27 C ATOM 278 CG GLN A 172 36.895 3.221 -16.057 1.00 32.83 C ATOM 279 CD GLN A 172 37.931 3.340 -17.160 1.00 34.30 C ATOM 280 OE1 GLN A 172 37.606 3.271 -18.339 1.00 36.91 O ATOM 281 NE2 GLN A 172 39.188 3.529 -16.775 1.00 41.27 N ATOM 282 HE22 GLN A 172 39.419 3.581 -15.762 1.00 0.00 H ATOM 283 HE21 GLN A 172 39.941 3.625 -17.486 1.00 0.00 H ATOM 284 H GLN A 172 34.029 0.511 -17.050 1.00 0.00 H ATOM 285 N VAL A 173 35.842 -0.106 -14.345 1.00 23.42 N ATOM 286 CA VAL A 173 36.322 -0.735 -13.121 1.00 24.17 C ATOM 287 C VAL A 173 37.195 -1.940 -13.450 1.00 26.47 C ATOM 288 O VAL A 173 38.294 -2.097 -12.904 1.00 27.95 O ATOM 289 CB VAL A 173 35.145 -1.129 -12.212 1.00 22.76 C ATOM 290 CG1 VAL A 173 35.637 -1.913 -11.019 1.00 24.91 C ATOM 291 CG2 VAL A 173 34.380 0.086 -11.741 1.00 22.28 C ATOM 292 H VAL A 173 34.821 0.034 -14.486 1.00 0.00 H ATOM 293 N LEU A 174 36.716 -2.813 -14.337 1.00 26.87 N ATOM 294 CA LEU A 174 37.495 -4.006 -14.654 1.00 31.52 C ATOM 295 C LEU A 174 38.847 -3.630 -15.238 1.00 31.69 C ATOM 296 O LEU A 174 39.864 -4.243 -14.902 1.00 34.78 O ATOM 297 CB LEU A 174 36.742 -4.902 -15.630 1.00 32.67 C ATOM 298 CG LEU A 174 35.474 -5.561 -15.096 1.00 27.20 C ATOM 299 CD1 LEU A 174 34.867 -6.366 -16.219 1.00 29.08 C ATOM 300 CD2 LEU A 174 35.758 -6.448 -13.898 1.00 29.52 C ATOM 301 H LEU A 174 35.799 -2.646 -14.797 1.00 0.00 H ATOM 302 N LYS A 175 38.877 -2.617 -16.103 1.00 30.75 N ATOM 303 CA LYS A 175 40.141 -2.164 -16.675 1.00 35.36 C ATOM 304 C LYS A 175 41.110 -1.732 -15.583 1.00 41.01 C ATOM 305 O LYS A 175 42.283 -2.123 -15.588 1.00 40.47 O ATOM 306 CB LYS A 175 39.874 -1.016 -17.648 1.00 38.88 C ATOM 307 CG LYS A 175 41.110 -0.449 -18.325 1.00 42.67 C ATOM 308 CD LYS A 175 40.724 0.574 -19.378 1.00 47.20 C ATOM 309 CE LYS A 175 41.940 1.074 -20.137 1.00 53.19 C ATOM 310 NZ LYS A 175 41.560 1.663 -21.446 1.00 65.83 N ATOM 311 HZ1 LYS A 175 41.084 0.942 -22.024 1.00 0.00 H ATOM 312 HZ2 LYS A 175 40.916 2.465 -21.290 1.00 0.00 H ATOM 313 HZ3 LYS A 175 42.415 1.994 -21.937 1.00 0.00 H ATOM 314 H LYS A 175 37.991 -2.144 -16.373 1.00 0.00 H ATOM 315 N GLN A 176 40.635 -0.928 -14.629 1.00 32.28 N ATOM 316 CA GLN A 176 41.538 -0.424 -13.603 1.00 34.20 C ATOM 317 C GLN A 176 41.943 -1.519 -12.618 1.00 41.80 C ATOM 318 O GLN A 176 43.060 -1.488 -12.088 1.00 41.23 O ATOM 319 CB GLN A 176 40.923 0.807 -12.925 1.00 33.36 C ATOM 320 CG GLN A 176 40.767 1.989 -13.890 1.00 38.67 C ATOM 321 CD GLN A 176 40.051 3.206 -13.304 1.00 37.64 C ATOM 322 OE1 GLN A 176 39.326 3.903 -14.016 1.00 42.01 O ATOM 323 NE2 GLN A 176 40.283 3.489 -12.028 1.00 44.36 N ATOM 324 HE22 GLN A 176 40.902 2.873 -11.463 1.00 0.00 H ATOM 325 HE21 GLN A 176 39.846 4.327 -11.593 1.00 0.00 H ATOM 326 H GLN A 176 39.629 -0.664 -14.618 1.00 0.00 H ATOM 327 N LEU A 177 41.073 -2.504 -12.375 1.00 36.11 N ATOM 328 CA LEU A 177 41.473 -3.650 -11.560 1.00 36.49 C ATOM 329 C LEU A 177 42.543 -4.476 -12.265 1.00 39.20 C ATOM 330 O LEU A 177 43.513 -4.918 -11.636 1.00 47.04 O ATOM 331 CB LEU A 177 40.261 -4.523 -11.237 1.00 32.18 C ATOM 332 CG LEU A 177 39.307 -3.999 -10.161 1.00 29.42 C ATOM 333 CD1 LEU A 177 38.092 -4.897 -10.049 1.00 28.91 C ATOM 334 CD2 LEU A 177 39.989 -3.919 -8.817 1.00 34.27 C ATOM 335 H LEU A 177 40.111 -2.455 -12.766 1.00 0.00 H ATOM 336 N ASP A 178 42.383 -4.696 -13.568 1.00 37.46 N ATOM 337 CA ASP A 178 43.390 -5.441 -14.317 1.00 46.59 C ATOM 338 C ASP A 178 44.718 -4.699 -14.368 1.00 50.23 C ATOM 339 O ASP A 178 45.776 -5.329 -14.481 1.00 52.50 O ATOM 340 CB ASP A 178 42.878 -5.734 -15.723 1.00 41.02 C ATOM 341 CG ASP A 178 41.772 -6.768 -15.726 1.00 42.02 C ATOM 342 OD1 ASP A 178 41.534 -7.364 -14.654 1.00 44.48 O ATOM 343 OD2 ASP A 178 41.140 -6.974 -16.779 1.00 44.64 O ATOM 344 H ASP A 178 41.537 -4.336 -14.054 1.00 0.00 H ATOM 345 N ALA A 179 44.687 -3.370 -14.288 1.00 51.94 N ATOM 346 CA ALA A 179 45.904 -2.569 -14.243 1.00 48.07 C ATOM 347 C ALA A 179 46.579 -2.599 -12.880 1.00 52.45 C ATOM 348 O ALA A 179 47.565 -1.883 -12.677 1.00 66.08 O ATOM 349 CB ALA A 179 45.598 -1.121 -14.636 1.00 47.16 C ATOM 350 H ALA A 179 43.766 -2.889 -14.257 1.00 0.00 H ATOM 351 N GLY A 180 46.066 -3.396 -11.946 1.00 49.18 N ATOM 352 CA GLY A 180 46.660 -3.517 -10.634 1.00 48.12 C ATOM 353 C GLY A 180 46.313 -2.416 -9.663 1.00 51.02 C ATOM 354 O GLY A 180 46.957 -2.317 -8.615 1.00 56.31 O ATOM 355 H GLY A 180 45.213 -3.948 -12.167 1.00 0.00 H ATOM 356 N GLU A 181 45.318 -1.587 -9.965 1.00 51.40 N ATOM 357 CA GLU A 181 44.964 -0.511 -9.053 1.00 55.04 C ATOM 358 C GLU A 181 44.337 -1.083 -7.791 1.00 50.32 C ATOM 359 O GLU A 181 43.616 -2.083 -7.831 1.00 49.95 O ATOM 360 CB GLU A 181 44.006 0.470 -9.728 1.00 53.66 C ATOM 361 CG GLU A 181 44.588 1.103 -10.987 1.00 56.03 C ATOM 362 CD GLU A 181 43.828 2.341 -11.442 1.00 62.84 C ATOM 363 OE1 GLU A 181 42.920 2.802 -10.709 1.00 52.57 O ATOM 364 OE2 GLU A 181 44.143 2.853 -12.537 1.00 67.00 O ATOM 365 H GLU A 181 44.793 -1.708 -10.854 1.00 0.00 H ATOM 366 N GLU A 182 44.631 -0.452 -6.662 1.00 51.52 N ATOM 367 CA GLU A 182 44.110 -0.913 -5.388 1.00 58.67 C ATOM 368 C GLU A 182 42.653 -0.502 -5.252 1.00 48.63 C ATOM 369 O GLU A 182 42.243 0.568 -5.711 1.00 48.55 O ATOM 370 CB GLU A 182 44.929 -0.333 -4.234 1.00 72.83 C ATOM 371 CG GLU A 182 46.352 -0.896 -4.135 1.00 83.99 C ATOM 372 CD GLU A 182 46.429 -2.205 -3.359 1.00 89.33 C ATOM 373 OE1 GLU A 182 45.400 -2.636 -2.793 1.00 87.19 O ATOM 374 OE2 GLU A 182 47.526 -2.803 -3.313 1.00 93.04 O ATOM 375 H GLU A 182 45.245 0.387 -6.690 1.00 0.00 H ATOM 376 N ALA A 183 41.870 -1.371 -4.628 1.00 43.93 N ATOM 377 CA ALA A 183 40.443 -1.145 -4.514 1.00 39.07 C ATOM 378 C ALA A 183 39.894 -2.064 -3.443 1.00 32.74 C ATOM 379 O ALA A 183 40.392 -3.171 -3.237 1.00 39.27 O ATOM 380 CB ALA A 183 39.742 -1.444 -5.843 1.00 34.42 C ATOM 381 H ALA A 183 42.287 -2.229 -4.213 1.00 0.00 H ATOM 382 N THR A 184 38.842 -1.603 -2.782 1.00 30.23 N ATOM 383 CA THR A 184 38.090 -2.479 -1.908 1.00 34.49 C ATOM 384 C THR A 184 37.119 -3.343 -2.705 1.00 31.34 C ATOM 385 O THR A 184 36.854 -4.484 -2.318 1.00 34.41 O ATOM 386 CB THR A 184 37.345 -1.648 -0.864 1.00 42.91 C ATOM 387 OG1 THR A 184 36.439 -0.757 -1.520 1.00 48.30 O ATOM 388 CG2 THR A 184 38.329 -0.822 -0.025 1.00 39.82 C ATOM 389 HG1 THR A 184 36.946 -0.155 -2.120 1.00 0.00 H ATOM 390 H THR A 184 38.556 -0.609 -2.891 1.00 0.00 H ATOM 391 N THR A 185 36.593 -2.824 -3.816 1.00 28.82 N ATOM 392 CA THR A 185 35.689 -3.591 -4.668 1.00 27.80 C ATOM 393 C THR A 185 36.399 -4.804 -5.254 1.00 24.22 C ATOM 394 O THR A 185 37.543 -4.712 -5.710 1.00 29.46 O ATOM 395 CB THR A 185 35.225 -2.718 -5.838 1.00 28.75 C ATOM 396 OG1 THR A 185 34.618 -1.506 -5.365 1.00 33.63 O ATOM 397 CG2 THR A 185 34.217 -3.462 -6.669 1.00 26.85 C ATOM 398 HG1 THR A 185 35.276 -0.996 -4.829 1.00 0.00 H ATOM 399 H THR A 185 36.833 -1.848 -4.082 1.00 0.00 H ATOM 400 N THR A 186 35.681 -5.928 -5.322 1.00 23.83 N ATOM 401 CA THR A 186 36.229 -7.139 -5.921 1.00 23.17 C ATOM 402 C THR A 186 35.652 -7.357 -7.317 1.00 21.68 C ATOM 403 O THR A 186 34.544 -6.914 -7.637 1.00 21.49 O ATOM 404 CB THR A 186 35.922 -8.372 -5.078 1.00 23.09 C ATOM 405 OG1 THR A 186 34.538 -8.671 -5.159 1.00 26.51 O ATOM 406 CG2 THR A 186 36.283 -8.143 -3.614 1.00 27.09 C ATOM 407 HG1 THR A 186 34.015 -7.902 -4.820 1.00 0.00 H ATOM 408 H THR A 186 34.713 -5.940 -4.941 1.00 0.00 H ATOM 409 N LYS A 187 36.414 -8.075 -8.141 1.00 21.39 N ATOM 410 CA LYS A 187 35.958 -8.356 -9.499 1.00 20.62 C ATOM 411 C LYS A 187 34.607 -9.061 -9.500 1.00 19.36 C ATOM 412 O LYS A 187 33.749 -8.766 -10.340 1.00 19.28 O ATOM 413 CB LYS A 187 36.999 -9.183 -10.253 1.00 24.31 C ATOM 414 CG LYS A 187 36.643 -9.392 -11.704 1.00 26.00 C ATOM 415 CD LYS A 187 37.856 -9.798 -12.539 1.00 33.80 C ATOM 416 CE LYS A 187 38.784 -8.612 -12.805 1.00 36.48 C ATOM 417 NZ LYS A 187 39.621 -8.840 -14.013 1.00 44.60 N ATOM 418 HZ1 LYS A 187 40.203 -9.691 -13.875 1.00 0.00 H ATOM 419 HZ2 LYS A 187 39.005 -8.970 -14.841 1.00 0.00 H ATOM 420 HZ3 LYS A 187 40.239 -8.017 -14.165 1.00 0.00 H ATOM 421 H LYS A 187 37.334 -8.435 -7.817 1.00 0.00 H ATOM 422 N SER A 188 34.389 -9.998 -8.566 1.00 19.16 N ATOM 423 CA SER A 188 33.114 -10.714 -8.561 1.00 18.98 C ATOM 424 C SER A 188 31.946 -9.752 -8.384 1.00 20.29 C ATOM 425 O SER A 188 30.917 -9.877 -9.068 1.00 18.71 O ATOM 426 CB SER A 188 33.095 -11.843 -7.534 1.00 21.46 C ATOM 427 OG SER A 188 33.159 -11.347 -6.221 1.00 22.77 O ATOM 428 HG SER A 188 32.381 -10.758 -6.054 1.00 0.00 H ATOM 429 H SER A 188 35.117 -10.213 -7.855 1.00 0.00 H ATOM 430 N GLN A 189 32.102 -8.752 -7.512 1.00 19.30 N ATOM 431 CA GLN A 189 31.017 -7.796 -7.313 1.00 20.18 C ATOM 432 C GLN A 189 30.741 -7.006 -8.586 1.00 18.06 C ATOM 433 O GLN A 189 29.578 -6.766 -8.933 1.00 20.02 O ATOM 434 CB GLN A 189 31.346 -6.844 -6.175 1.00 20.74 C ATOM 435 CG GLN A 189 31.515 -7.524 -4.845 1.00 23.74 C ATOM 436 CD GLN A 189 31.926 -6.545 -3.777 1.00 26.22 C ATOM 437 OE1 GLN A 189 33.084 -6.156 -3.684 1.00 29.26 O ATOM 438 NE2 GLN A 189 30.956 -6.105 -2.989 1.00 29.97 N ATOM 439 HE22 GLN A 189 29.987 -6.465 -3.106 1.00 0.00 H ATOM 440 HE21 GLN A 189 31.163 -5.400 -2.253 1.00 0.00 H ATOM 441 H GLN A 189 32.990 -8.655 -6.979 1.00 0.00 H ATOM 442 N VAL A 190 31.797 -6.618 -9.302 1.00 18.45 N ATOM 443 CA VAL A 190 31.652 -5.895 -10.567 1.00 18.56 C ATOM 444 C VAL A 190 30.918 -6.759 -11.584 1.00 19.61 C ATOM 445 O VAL A 190 29.983 -6.313 -12.266 1.00 18.11 O ATOM 446 CB VAL A 190 33.035 -5.470 -11.088 1.00 20.37 C ATOM 447 CG1 VAL A 190 32.899 -4.689 -12.383 1.00 21.12 C ATOM 448 CG2 VAL A 190 33.803 -4.647 -10.034 1.00 22.20 C ATOM 449 H VAL A 190 32.752 -6.835 -8.952 1.00 0.00 H ATOM 450 N LEU A 191 31.308 -8.030 -11.676 1.00 18.12 N ATOM 451 CA LEU A 191 30.714 -8.939 -12.649 1.00 17.04 C ATOM 452 C LEU A 191 29.243 -9.186 -12.378 1.00 16.65 C ATOM 453 O LEU A 191 28.469 -9.435 -13.310 1.00 17.97 O ATOM 454 CB LEU A 191 31.500 -10.262 -12.685 1.00 17.59 C ATOM 455 CG LEU A 191 32.910 -10.129 -13.225 1.00 17.47 C ATOM 456 CD1 LEU A 191 33.658 -11.409 -12.941 1.00 19.92 C ATOM 457 CD2 LEU A 191 32.895 -9.830 -14.734 1.00 19.74 C ATOM 458 H LEU A 191 32.052 -8.381 -11.040 1.00 0.00 H ATOM 459 N ASP A 192 28.838 -9.103 -11.114 1.00 16.73 N ATOM 460 CA ASP A 192 27.434 -9.269 -10.769 1.00 18.18 C ATOM 461 C ASP A 192 26.575 -8.178 -11.435 1.00 18.52 C ATOM 462 O ASP A 192 25.613 -8.469 -12.147 1.00 19.55 O ATOM 463 CB ASP A 192 27.348 -9.268 -9.235 1.00 18.80 C ATOM 464 CG ASP A 192 26.098 -9.898 -8.698 1.00 19.72 C ATOM 465 OD1 ASP A 192 25.162 -10.158 -9.449 1.00 20.61 O ATOM 466 OD2 ASP A 192 26.083 -10.106 -7.450 1.00 22.31 O ATOM 467 H ASP A 192 29.533 -8.917 -10.363 1.00 0.00 H ATOM 468 N TYR A 193 26.940 -6.921 -11.248 1.00 16.18 N ATOM 469 CA TYR A 193 26.234 -5.828 -11.914 1.00 16.76 C ATOM 470 C TYR A 193 26.380 -5.924 -13.432 1.00 17.36 C ATOM 471 O TYR A 193 25.407 -5.759 -14.176 1.00 17.82 O ATOM 472 CB TYR A 193 26.761 -4.479 -11.427 1.00 17.31 C ATOM 473 CG TYR A 193 26.382 -4.156 -10.011 1.00 17.76 C ATOM 474 CD1 TYR A 193 25.138 -3.629 -9.716 1.00 19.22 C ATOM 475 CD2 TYR A 193 27.268 -4.383 -8.982 1.00 20.15 C ATOM 476 CE1 TYR A 193 24.779 -3.369 -8.395 1.00 20.79 C ATOM 477 CE2 TYR A 193 26.915 -4.138 -7.670 1.00 20.11 C ATOM 478 CZ TYR A 193 25.679 -3.620 -7.403 1.00 20.89 C ATOM 479 OH TYR A 193 25.342 -3.354 -6.079 1.00 23.04 O ATOM 480 HH TYR A 193 24.424 -2.985 -6.041 1.00 0.00 H ATOM 481 H TYR A 193 27.740 -6.707 -10.619 1.00 0.00 H ATOM 482 N LEU A 194 27.608 -6.138 -13.907 1.00 16.45 N ATOM 483 CA LEU A 194 27.856 -6.054 -15.345 1.00 15.97 C ATOM 484 C LEU A 194 27.123 -7.144 -16.116 1.00 17.19 C ATOM 485 O LEU A 194 26.580 -6.881 -17.196 1.00 16.90 O ATOM 486 CB LEU A 194 29.355 -6.084 -15.603 1.00 16.49 C ATOM 487 CG LEU A 194 29.810 -5.969 -17.066 1.00 16.36 C ATOM 488 CD1 LEU A 194 29.396 -4.644 -17.695 1.00 17.60 C ATOM 489 CD2 LEU A 194 31.288 -6.134 -17.106 1.00 19.54 C ATOM 490 H LEU A 194 28.387 -6.364 -13.256 1.00 0.00 H ATOM 491 N SER A 195 27.156 -8.389 -15.631 1.00 16.87 N ATOM 492 CA SER A 195 26.489 -9.476 -16.336 1.00 16.43 C ATOM 493 C SER A 195 25.004 -9.205 -16.509 1.00 17.94 C ATOM 494 O SER A 195 24.444 -9.434 -17.590 1.00 17.88 O ATOM 495 CB SER A 195 26.725 -10.797 -15.631 1.00 17.60 C ATOM 496 OG SER A 195 26.191 -10.802 -14.307 1.00 18.29 O ATOM 497 HG SER A 195 26.623 -10.087 -13.776 1.00 0.00 H ATOM 498 H SER A 195 27.662 -8.584 -14.743 1.00 0.00 H ATOM 499 N TYR A 196 24.349 -8.715 -15.467 1.00 16.64 N ATOM 500 CA TYR A 196 22.931 -8.440 -15.583 1.00 18.15 C ATOM 501 C TYR A 196 22.675 -7.277 -16.536 1.00 17.75 C ATOM 502 O TYR A 196 21.763 -7.341 -17.373 1.00 17.48 O ATOM 503 CB TYR A 196 22.345 -8.165 -14.209 1.00 18.22 C ATOM 504 CG TYR A 196 20.846 -8.018 -14.251 1.00 20.35 C ATOM 505 CD1 TYR A 196 20.030 -9.129 -14.329 1.00 23.78 C ATOM 506 CD2 TYR A 196 20.258 -6.771 -14.238 1.00 22.73 C ATOM 507 CE1 TYR A 196 18.646 -8.999 -14.380 1.00 28.53 C ATOM 508 CE2 TYR A 196 18.873 -6.627 -14.284 1.00 26.55 C ATOM 509 CZ TYR A 196 18.082 -7.743 -14.348 1.00 32.53 C ATOM 510 OH TYR A 196 16.712 -7.589 -14.401 1.00 37.66 O ATOM 511 HH TYR A 196 16.282 -8.480 -14.444 1.00 0.00 H ATOM 512 H TYR A 196 24.848 -8.529 -14.574 1.00 0.00 H ATOM 513 N ALA A 197 23.481 -6.223 -16.433 1.00 17.06 N ATOM 514 CA ALA A 197 23.311 -5.052 -17.286 1.00 17.83 C ATOM 515 C ALA A 197 23.497 -5.408 -18.755 1.00 18.95 C ATOM 516 O ALA A 197 22.705 -4.976 -19.602 1.00 19.63 O ATOM 517 CB ALA A 197 24.281 -3.957 -16.864 1.00 19.09 C ATOM 518 H ALA A 197 24.248 -6.234 -15.730 1.00 0.00 H ATOM 519 N VAL A 198 24.525 -6.197 -19.094 1.00 16.85 N ATOM 520 CA VAL A 198 24.711 -6.532 -20.513 1.00 18.55 C ATOM 521 C VAL A 198 23.557 -7.387 -21.029 1.00 19.56 C ATOM 522 O VAL A 198 23.169 -7.283 -22.200 1.00 20.42 O ATOM 523 CB VAL A 198 26.081 -7.167 -20.830 1.00 21.61 C ATOM 524 CG1 VAL A 198 27.226 -6.275 -20.408 1.00 20.72 C ATOM 525 CG2 VAL A 198 26.206 -8.546 -20.277 1.00 24.33 C ATOM 526 H VAL A 198 25.176 -6.564 -18.371 1.00 0.00 H ATOM 527 N PHE A 199 22.988 -8.245 -20.187 1.00 18.04 N ATOM 528 CA PHE A 199 21.792 -8.977 -20.579 1.00 18.88 C ATOM 529 C PHE A 199 20.632 -8.037 -20.869 1.00 17.51 C ATOM 530 O PHE A 199 19.948 -8.204 -21.893 1.00 20.35 O ATOM 531 CB PHE A 199 21.406 -9.989 -19.504 1.00 18.75 C ATOM 532 CG PHE A 199 20.087 -10.640 -19.747 1.00 22.07 C ATOM 533 CD1 PHE A 199 19.940 -11.541 -20.773 1.00 24.27 C ATOM 534 CD2 PHE A 199 18.996 -10.331 -18.958 1.00 27.04 C ATOM 535 CE1 PHE A 199 18.712 -12.150 -21.018 1.00 28.06 C ATOM 536 CE2 PHE A 199 17.766 -10.934 -19.197 1.00 30.15 C ATOM 537 CZ PHE A 199 17.631 -11.832 -20.208 1.00 27.98 C ATOM 538 H PHE A 199 23.400 -8.394 -19.244 1.00 0.00 H ATOM 539 N GLN A 200 20.407 -7.036 -20.026 1.00 20.14 N ATOM 540 CA GLN A 200 19.292 -6.122 -20.261 1.00 21.16 C ATOM 541 C GLN A 200 19.455 -5.395 -21.582 1.00 24.36 C ATOM 542 O GLN A 200 18.458 -5.039 -22.223 1.00 25.67 O ATOM 543 CB GLN A 200 19.194 -5.103 -19.134 1.00 21.94 C ATOM 544 CG GLN A 200 18.684 -5.693 -17.805 1.00 22.07 C ATOM 545 CD GLN A 200 17.277 -6.220 -17.939 1.00 28.99 C ATOM 546 OE1 GLN A 200 16.450 -5.621 -18.625 1.00 42.69 O ATOM 547 NE2 GLN A 200 17.013 -7.361 -17.337 1.00 44.53 N ATOM 548 HE22 GLN A 200 17.746 -7.830 -16.767 1.00 0.00 H ATOM 549 HE21 GLN A 200 16.072 -7.793 -17.431 1.00 0.00 H ATOM 550 H GLN A 200 21.024 -6.903 -19.199 1.00 0.00 H ATOM 551 N LEU A 201 20.693 -5.171 -22.000 1.00 18.39 N ATOM 552 CA LEU A 201 20.985 -4.488 -23.251 1.00 19.39 C ATOM 553 C LEU A 201 20.989 -5.433 -24.446 1.00 21.69 C ATOM 554 O LEU A 201 21.293 -4.994 -25.567 1.00 22.91 O ATOM 555 CB LEU A 201 22.338 -3.774 -23.150 1.00 18.96 C ATOM 556 CG LEU A 201 22.359 -2.612 -22.156 1.00 21.95 C ATOM 557 CD1 LEU A 201 23.780 -2.306 -21.776 1.00 25.80 C ATOM 558 CD2 LEU A 201 21.671 -1.376 -22.731 1.00 28.94 C ATOM 559 H LEU A 201 21.486 -5.496 -21.411 1.00 0.00 H ATOM 560 N GLY A 202 20.702 -6.722 -24.247 1.00 20.67 N ATOM 561 CA GLY A 202 20.576 -7.664 -25.348 1.00 19.54 C ATOM 562 C GLY A 202 21.827 -8.388 -25.773 1.00 22.76 C ATOM 563 O GLY A 202 21.872 -8.932 -26.886 1.00 22.08 O ATOM 564 H GLY A 202 20.564 -7.063 -23.274 1.00 0.00 H ATOM 565 N ASP A 203 22.862 -8.436 -24.940 1.00 19.35 N ATOM 566 CA ASP A 203 24.151 -8.988 -25.342 1.00 18.89 C ATOM 567 C ASP A 203 24.293 -10.383 -24.735 1.00 23.42 C ATOM 568 O ASP A 203 24.977 -10.590 -23.730 1.00 22.80 O ATOM 569 CB ASP A 203 25.295 -8.062 -24.916 1.00 22.60 C ATOM 570 CG ASP A 203 26.600 -8.289 -25.711 1.00 20.36 C ATOM 571 OD1 ASP A 203 26.549 -8.887 -26.795 1.00 23.47 O ATOM 572 OD2 ASP A 203 27.667 -7.814 -25.262 1.00 24.31 O ATOM 573 H ASP A 203 22.749 -8.069 -23.973 1.00 0.00 H ATOM 574 N LEU A 204 23.696 -11.369 -25.408 1.00 19.65 N ATOM 575 CA LEU A 204 23.333 -12.631 -24.767 1.00 18.53 C ATOM 576 C LEU A 204 24.546 -13.487 -24.423 1.00 17.93 C ATOM 577 O LEU A 204 24.704 -13.907 -23.267 1.00 17.61 O ATOM 578 CB LEU A 204 22.355 -13.411 -25.654 1.00 19.86 C ATOM 579 CG LEU A 204 21.008 -12.721 -25.845 1.00 21.85 C ATOM 580 CD1 LEU A 204 20.116 -13.649 -26.677 1.00 26.10 C ATOM 581 CD2 LEU A 204 20.325 -12.339 -24.533 1.00 30.31 C ATOM 582 H LEU A 204 23.483 -11.235 -26.417 1.00 0.00 H ATOM 583 N HIS A 205 25.416 -13.773 -25.378 1.00 16.95 N ATOM 584 CA HIS A 205 26.544 -14.648 -25.055 1.00 17.73 C ATOM 585 C HIS A 205 27.554 -13.958 -24.149 1.00 17.90 C ATOM 586 O HIS A 205 28.237 -14.644 -23.378 1.00 18.47 O ATOM 587 CB HIS A 205 27.197 -15.222 -26.311 1.00 18.52 C ATOM 588 CG HIS A 205 26.483 -16.427 -26.846 1.00 19.57 C ATOM 589 ND1 HIS A 205 25.320 -16.344 -27.593 1.00 19.67 N ATOM 590 CD2 HIS A 205 26.742 -17.748 -26.699 1.00 21.64 C ATOM 591 CE1 HIS A 205 24.902 -17.564 -27.879 1.00 21.07 C ATOM 592 NE2 HIS A 205 25.750 -18.432 -27.360 1.00 21.97 N ATOM 593 H HIS A 205 25.301 -13.385 -26.336 1.00 0.00 H ATOM 594 N ARG A 206 27.652 -12.627 -24.194 1.00 16.10 N ATOM 595 CA ARG A 206 28.501 -11.922 -23.237 1.00 17.98 C ATOM 596 C ARG A 206 27.948 -12.058 -21.829 1.00 16.43 C ATOM 597 O ARG A 206 28.700 -12.286 -20.875 1.00 17.04 O ATOM 598 CB ARG A 206 28.560 -10.452 -23.640 1.00 18.28 C ATOM 599 CG ARG A 206 29.367 -9.533 -22.737 1.00 22.25 C ATOM 600 CD ARG A 206 30.808 -9.930 -22.696 1.00 18.25 C ATOM 601 NE ARG A 206 31.618 -8.904 -22.020 1.00 21.37 N ATOM 602 CZ ARG A 206 32.890 -9.066 -21.672 1.00 22.45 C ATOM 603 NH1 ARG A 206 33.520 -10.223 -21.881 1.00 25.05 N ATOM 604 NH2 ARG A 206 33.528 -8.064 -21.080 1.00 23.84 N ATOM 605 HE ARG A 206 31.166 -7.994 -21.801 1.00 0.00 H ATOM 606 HH12 ARG A 206 34.516 -10.331 -21.602 1.00 0.00 H ATOM 607 HH11 ARG A 206 33.015 -11.017 -22.323 1.00 0.00 H ATOM 608 HH22 ARG A 206 34.524 -8.174 -20.801 1.00 0.00 H ATOM 609 HH21 ARG A 206 33.032 -7.169 -20.895 1.00 0.00 H ATOM 610 H ARG A 206 27.123 -12.091 -24.912 1.00 0.00 H ATOM 611 N ALA A 207 26.630 -11.916 -21.674 1.00 16.68 N ATOM 612 CA ALA A 207 26.024 -12.121 -20.361 1.00 15.61 C ATOM 613 C ALA A 207 26.331 -13.522 -19.833 1.00 17.12 C ATOM 614 O ALA A 207 26.618 -13.689 -18.638 1.00 17.73 O ATOM 615 CB ALA A 207 24.516 -11.882 -20.427 1.00 19.22 C ATOM 616 H ALA A 207 26.035 -11.660 -22.487 1.00 0.00 H ATOM 617 N LEU A 208 26.269 -14.541 -20.690 1.00 17.78 N ATOM 618 CA LEU A 208 26.631 -15.901 -20.287 1.00 18.55 C ATOM 619 C LEU A 208 28.095 -15.980 -19.862 1.00 18.91 C ATOM 620 O LEU A 208 28.416 -16.537 -18.805 1.00 17.57 O ATOM 621 CB LEU A 208 26.359 -16.860 -21.455 1.00 19.06 C ATOM 622 CG LEU A 208 26.878 -18.280 -21.267 1.00 19.41 C ATOM 623 CD1 LEU A 208 26.303 -18.948 -19.985 1.00 23.31 C ATOM 624 CD2 LEU A 208 26.563 -19.121 -22.514 1.00 24.92 C ATOM 625 H LEU A 208 25.957 -14.366 -21.666 1.00 0.00 H ATOM 626 N GLU A 209 28.997 -15.425 -20.669 1.00 16.76 N ATOM 627 CA GLU A 209 30.416 -15.476 -20.370 1.00 16.98 C ATOM 628 C GLU A 209 30.703 -14.816 -19.020 1.00 18.00 C ATOM 629 O GLU A 209 31.453 -15.357 -18.206 1.00 17.93 O ATOM 630 CB GLU A 209 31.176 -14.760 -21.486 1.00 18.12 C ATOM 631 CG GLU A 209 32.694 -14.733 -21.291 1.00 22.62 C ATOM 632 CD GLU A 209 33.428 -13.810 -22.278 1.00 39.34 C ATOM 633 OE1 GLU A 209 34.676 -13.823 -22.268 1.00 60.04 O ATOM 634 OE2 GLU A 209 32.775 -13.062 -23.048 1.00 34.69 O ATOM 635 H GLU A 209 28.677 -14.944 -21.534 1.00 0.00 H ATOM 636 N LEU A 210 30.130 -13.633 -18.781 1.00 16.37 N ATOM 637 CA LEU A 210 30.394 -12.929 -17.535 1.00 15.92 C ATOM 638 C LEU A 210 29.749 -13.624 -16.359 1.00 16.12 C ATOM 639 O LEU A 210 30.287 -13.550 -15.242 1.00 16.39 O ATOM 640 CB LEU A 210 29.884 -11.491 -17.639 1.00 15.57 C ATOM 641 CG LEU A 210 30.535 -10.631 -18.712 1.00 16.51 C ATOM 642 CD1 LEU A 210 29.825 -9.302 -18.806 1.00 20.61 C ATOM 643 CD2 LEU A 210 32.028 -10.464 -18.463 1.00 19.42 C ATOM 644 H LEU A 210 29.493 -13.214 -19.488 1.00 0.00 H ATOM 645 N THR A 211 28.614 -14.288 -16.569 1.00 16.85 N ATOM 646 CA THR A 211 28.001 -15.045 -15.487 1.00 17.52 C ATOM 647 C THR A 211 28.867 -16.240 -15.104 1.00 17.98 C ATOM 648 O THR A 211 29.038 -16.538 -13.916 1.00 17.33 O ATOM 649 CB THR A 211 26.589 -15.465 -15.873 1.00 19.85 C ATOM 650 OG1 THR A 211 25.784 -14.299 -16.069 1.00 18.92 O ATOM 651 CG2 THR A 211 25.937 -16.320 -14.776 1.00 19.20 C ATOM 652 HG1 THR A 211 25.756 -13.774 -15.230 1.00 0.00 H ATOM 653 H THR A 211 28.165 -14.266 -17.507 1.00 0.00 H ATOM 654 N ARG A 212 29.439 -16.925 -16.089 1.00 16.68 N ATOM 655 CA ARG A 212 30.374 -18.003 -15.800 1.00 17.63 C ATOM 656 C ARG A 212 31.574 -17.480 -15.023 1.00 19.18 C ATOM 657 O ARG A 212 31.993 -18.088 -14.034 1.00 18.64 O ATOM 658 CB ARG A 212 30.846 -18.659 -17.105 1.00 18.51 C ATOM 659 CG ARG A 212 29.805 -19.578 -17.712 1.00 22.85 C ATOM 660 CD ARG A 212 30.287 -20.125 -19.043 1.00 25.54 C ATOM 661 NE ARG A 212 29.357 -21.124 -19.575 1.00 28.20 N ATOM 662 CZ ARG A 212 29.314 -21.499 -20.846 1.00 32.15 C ATOM 663 NH1 ARG A 212 30.127 -20.951 -21.725 1.00 30.55 N ATOM 664 NH2 ARG A 212 28.445 -22.420 -21.232 1.00 37.40 N ATOM 665 HE ARG A 212 28.688 -21.567 -18.914 1.00 0.00 H ATOM 666 HH12 ARG A 212 30.091 -21.247 -22.721 1.00 0.00 H ATOM 667 HH11 ARG A 212 30.805 -20.222 -21.423 1.00 0.00 H ATOM 668 HH22 ARG A 212 28.409 -22.716 -22.228 1.00 0.00 H ATOM 669 HH21 ARG A 212 27.798 -22.848 -20.539 1.00 0.00 H ATOM 670 H ARG A 212 29.216 -16.688 -17.077 1.00 0.00 H ATOM 671 N ARG A 213 32.115 -16.330 -15.417 1.00 17.26 N ATOM 672 CA ARG A 213 33.259 -15.765 -14.720 1.00 17.96 C ATOM 673 C ARG A 213 32.887 -15.390 -13.292 1.00 17.15 C ATOM 674 O ARG A 213 33.674 -15.617 -12.364 1.00 18.08 O ATOM 675 CB ARG A 213 33.777 -14.536 -15.463 1.00 19.06 C ATOM 676 CG ARG A 213 35.135 -14.122 -14.985 1.00 23.97 C ATOM 677 CD ARG A 213 35.692 -12.942 -15.771 1.00 28.52 C ATOM 678 NE ARG A 213 35.708 -13.237 -17.197 1.00 29.63 N ATOM 679 CZ ARG A 213 35.753 -12.315 -18.154 1.00 43.75 C ATOM 680 NH1 ARG A 213 35.793 -11.019 -17.850 1.00 34.44 N ATOM 681 NH2 ARG A 213 35.758 -12.698 -19.420 1.00 37.96 N ATOM 682 HE ARG A 213 35.683 -14.236 -17.486 1.00 0.00 H ATOM 683 HH12 ARG A 213 35.828 -10.308 -18.608 1.00 0.00 H ATOM 684 HH11 ARG A 213 35.789 -10.718 -16.855 1.00 0.00 H ATOM 685 HH22 ARG A 213 35.793 -11.987 -20.178 1.00 0.00 H ATOM 686 HH21 ARG A 213 35.727 -13.710 -19.657 1.00 0.00 H ATOM 687 H ARG A 213 31.714 -15.828 -16.235 1.00 0.00 H ATOM 688 N LEU A 214 31.696 -14.814 -13.117 1.00 16.57 N ATOM 689 CA LEU A 214 31.210 -14.472 -11.787 1.00 18.97 C ATOM 690 C LEU A 214 31.201 -15.708 -10.905 1.00 17.39 C ATOM 691 O LEU A 214 31.714 -15.686 -9.774 1.00 17.52 O ATOM 692 CB LEU A 214 29.804 -13.889 -11.885 1.00 18.07 C ATOM 693 CG LEU A 214 29.004 -13.661 -10.602 1.00 19.64 C ATOM 694 CD1 LEU A 214 29.750 -12.777 -9.652 1.00 21.17 C ATOM 695 CD2 LEU A 214 27.669 -13.042 -11.012 1.00 20.77 C ATOM 696 H LEU A 214 31.104 -14.605 -13.946 1.00 0.00 H ATOM 697 N LEU A 215 30.571 -16.785 -11.371 1.00 16.82 N ATOM 698 CA LEU A 215 30.488 -17.985 -10.543 1.00 18.44 C ATOM 699 C LEU A 215 31.868 -18.568 -10.288 1.00 17.25 C ATOM 700 O LEU A 215 32.126 -19.102 -9.197 1.00 17.08 O ATOM 701 CB LEU A 215 29.549 -19.006 -11.157 1.00 19.50 C ATOM 702 CG LEU A 215 29.097 -20.173 -10.297 1.00 24.21 C ATOM 703 CD1 LEU A 215 28.144 -19.632 -9.226 1.00 22.20 C ATOM 704 CD2 LEU A 215 28.414 -21.224 -11.134 1.00 23.93 C ATOM 705 H LEU A 215 30.141 -16.771 -12.318 1.00 0.00 H ATOM 706 N SER A 216 32.784 -18.448 -11.239 1.00 17.78 N ATOM 707 CA SER A 216 34.113 -18.999 -11.038 1.00 17.96 C ATOM 708 C SER A 216 34.790 -18.352 -9.839 1.00 18.47 C ATOM 709 O SER A 216 35.574 -18.995 -9.139 1.00 19.29 O ATOM 710 CB SER A 216 34.984 -18.855 -12.296 1.00 19.81 C ATOM 711 OG SER A 216 35.500 -17.552 -12.478 1.00 21.57 O ATOM 712 HG SER A 216 34.751 -16.910 -12.560 1.00 0.00 H ATOM 713 H SER A 216 32.551 -17.960 -12.128 1.00 0.00 H ATOM 714 N LEU A 217 34.479 -17.081 -9.574 1.00 16.98 N ATOM 715 CA LEU A 217 35.096 -16.298 -8.530 1.00 17.96 C ATOM 716 C LEU A 217 34.264 -16.271 -7.251 1.00 18.03 C ATOM 717 O LEU A 217 34.713 -15.717 -6.246 1.00 20.89 O ATOM 718 CB LEU A 217 35.311 -14.867 -9.014 1.00 18.25 C ATOM 719 CG LEU A 217 36.202 -14.704 -10.245 1.00 18.05 C ATOM 720 CD1 LEU A 217 36.330 -13.229 -10.595 1.00 20.16 C ATOM 721 CD2 LEU A 217 37.564 -15.309 -10.059 1.00 22.93 C ATOM 722 H LEU A 217 33.747 -16.627 -10.156 1.00 0.00 H ATOM 723 N ASP A 218 33.078 -16.835 -7.271 1.00 17.64 N ATOM 724 CA ASP A 218 32.156 -16.764 -6.134 1.00 17.79 C ATOM 725 C ASP A 218 31.217 -17.957 -6.234 1.00 16.81 C ATOM 726 O ASP A 218 30.026 -17.806 -6.499 1.00 18.59 O ATOM 727 CB ASP A 218 31.433 -15.410 -6.155 1.00 18.28 C ATOM 728 CG ASP A 218 30.797 -15.038 -4.829 1.00 20.22 C ATOM 729 OD1 ASP A 218 30.879 -15.844 -3.878 1.00 20.45 O ATOM 730 OD2 ASP A 218 30.207 -13.936 -4.770 1.00 19.55 O ATOM 731 H ASP A 218 32.783 -17.351 -8.124 1.00 0.00 H ATOM 732 N PRO A 219 31.718 -19.180 -6.016 1.00 17.18 N ATOM 733 CA PRO A 219 30.928 -20.364 -6.365 1.00 18.29 C ATOM 734 C PRO A 219 29.668 -20.571 -5.553 1.00 18.71 C ATOM 735 O PRO A 219 28.749 -21.262 -6.025 1.00 21.49 O ATOM 736 CB PRO A 219 31.925 -21.517 -6.191 1.00 17.02 C ATOM 737 CG PRO A 219 33.244 -20.879 -6.279 1.00 19.12 C ATOM 738 CD PRO A 219 33.107 -19.540 -5.670 1.00 17.17 C ATOM 739 N SER A 220 29.595 -20.021 -4.345 1.00 17.25 N ATOM 740 CA SER A 220 28.401 -20.163 -3.516 1.00 18.62 C ATOM 741 C SER A 220 27.389 -19.048 -3.733 1.00 20.74 C ATOM 742 O SER A 220 26.415 -18.931 -2.980 1.00 21.54 O ATOM 743 CB SER A 220 28.780 -20.225 -2.033 1.00 17.64 C ATOM 744 OG SER A 220 29.646 -21.332 -1.800 1.00 20.87 O ATOM 745 HG SER A 220 30.467 -21.227 -2.343 1.00 0.00 H ATOM 746 H SER A 220 30.405 -19.478 -3.983 1.00 0.00 H ATOM 747 N HIS A 221 27.574 -18.252 -4.782 1.00 18.63 N ATOM 748 CA HIS A 221 26.653 -17.171 -5.124 1.00 17.90 C ATOM 749 C HIS A 221 25.415 -17.803 -5.752 1.00 20.44 C ATOM 750 O HIS A 221 25.409 -18.136 -6.940 1.00 18.62 O ATOM 751 CB HIS A 221 27.374 -16.238 -6.086 1.00 18.37 C ATOM 752 CG HIS A 221 26.665 -14.951 -6.368 1.00 19.37 C ATOM 753 ND1 HIS A 221 25.295 -14.836 -6.391 1.00 24.60 N ATOM 754 CD2 HIS A 221 27.155 -13.716 -6.627 1.00 18.61 C ATOM 755 CE1 HIS A 221 24.973 -13.580 -6.658 1.00 23.41 C ATOM 756 NE2 HIS A 221 26.082 -12.883 -6.804 1.00 19.26 N ATOM 757 H HIS A 221 28.408 -18.405 -5.383 1.00 0.00 H ATOM 758 N GLU A 222 24.355 -17.984 -4.961 1.00 21.76 N ATOM 759 CA GLU A 222 23.206 -18.767 -5.405 1.00 23.16 C ATOM 760 C GLU A 222 22.484 -18.094 -6.564 1.00 21.98 C ATOM 761 O GLU A 222 22.095 -18.756 -7.529 1.00 22.06 O ATOM 762 CB GLU A 222 22.240 -18.954 -4.237 1.00 28.71 C ATOM 763 CG GLU A 222 21.126 -19.931 -4.483 1.00 40.06 C ATOM 764 CD GLU A 222 20.365 -20.233 -3.202 1.00 62.35 C ATOM 765 OE1 GLU A 222 20.969 -20.828 -2.282 1.00 55.84 O ATOM 766 OE2 GLU A 222 19.182 -19.848 -3.105 1.00 64.88 O ATOM 767 H GLU A 222 24.348 -17.560 -4.012 1.00 0.00 H ATOM 768 N ARG A 223 22.312 -16.786 -6.481 1.00 22.54 N ATOM 769 CA ARG A 223 21.651 -16.059 -7.563 1.00 24.06 C ATOM 770 C ARG A 223 22.446 -16.173 -8.857 1.00 21.64 C ATOM 771 O ARG A 223 21.871 -16.366 -9.947 1.00 22.45 O ATOM 772 CB ARG A 223 21.465 -14.613 -7.134 1.00 25.97 C ATOM 773 CG ARG A 223 20.836 -13.707 -8.172 1.00 29.95 C ATOM 774 CD ARG A 223 20.374 -12.397 -7.520 1.00 28.40 C ATOM 775 NE ARG A 223 21.424 -11.736 -6.742 1.00 26.15 N ATOM 776 CZ ARG A 223 22.476 -11.139 -7.290 1.00 24.01 C ATOM 777 NH1 ARG A 223 23.387 -10.560 -6.536 1.00 23.48 N ATOM 778 NH2 ARG A 223 22.615 -11.136 -8.600 1.00 24.27 N ATOM 779 HE ARG A 223 21.341 -11.734 -5.705 1.00 0.00 H ATOM 780 HH12 ARG A 223 24.207 -10.095 -6.976 1.00 0.00 H ATOM 781 HH11 ARG A 223 23.287 -10.567 -5.501 1.00 0.00 H ATOM 782 HH22 ARG A 223 23.437 -10.670 -9.035 1.00 0.00 H ATOM 783 HH21 ARG A 223 21.903 -11.600 -9.200 1.00 0.00 H ATOM 784 H ARG A 223 22.649 -16.272 -5.642 1.00 0.00 H ATOM 785 N ALA A 224 23.778 -16.073 -8.770 1.00 20.34 N ATOM 786 CA ALA A 224 24.604 -16.238 -9.965 1.00 20.61 C ATOM 787 C ALA A 224 24.462 -17.637 -10.552 1.00 21.30 C ATOM 788 O ALA A 224 24.444 -17.806 -11.780 1.00 20.79 O ATOM 789 CB ALA A 224 26.068 -15.935 -9.666 1.00 23.02 C ATOM 790 H ALA A 224 24.226 -15.878 -7.852 1.00 0.00 H ATOM 791 N GLY A 225 24.356 -18.659 -9.701 1.00 21.06 N ATOM 792 CA GLY A 225 24.136 -20.006 -10.194 1.00 21.65 C ATOM 793 C GLY A 225 22.804 -20.148 -10.907 1.00 21.61 C ATOM 794 O GLY A 225 22.717 -20.810 -11.942 1.00 22.47 O ATOM 795 H GLY A 225 24.432 -18.489 -8.678 1.00 0.00 H ATOM 796 N GLY A 226 21.763 -19.509 -10.375 1.00 20.69 N ATOM 797 CA GLY A 226 20.478 -19.487 -11.044 1.00 21.08 C ATOM 798 C GLY A 226 20.548 -18.771 -12.375 1.00 21.61 C ATOM 799 O GLY A 226 19.983 -19.231 -13.364 1.00 23.09 O ATOM 800 H GLY A 226 21.875 -19.018 -9.465 1.00 0.00 H ATOM 801 N ASN A 227 21.253 -17.644 -12.411 1.00 18.92 N ATOM 802 CA ASN A 227 21.461 -16.942 -13.682 1.00 18.60 C ATOM 803 C ASN A 227 22.182 -17.818 -14.701 1.00 19.75 C ATOM 804 O ASN A 227 21.857 -17.797 -15.900 1.00 20.13 O ATOM 805 CB ASN A 227 22.251 -15.653 -13.442 1.00 18.63 C ATOM 806 CG ASN A 227 21.475 -14.609 -12.672 1.00 19.66 C ATOM 807 OD1 ASN A 227 20.292 -14.802 -12.344 1.00 21.94 O ATOM 808 ND2 ASN A 227 22.117 -13.482 -12.395 1.00 21.99 N ATOM 809 HD22 ASN A 227 23.108 -13.362 -12.688 1.00 0.00 H ATOM 810 HD21 ASN A 227 21.630 -12.718 -11.885 1.00 0.00 H ATOM 811 H ASN A 227 21.659 -17.259 -11.534 1.00 0.00 H ATOM 812 N LEU A 228 23.197 -18.559 -14.273 1.00 20.07 N ATOM 813 CA LEU A 228 23.941 -19.413 -15.174 1.00 21.53 C ATOM 814 C LEU A 228 23.049 -20.494 -15.759 1.00 23.43 C ATOM 815 O LEU A 228 23.078 -20.742 -16.967 1.00 22.56 O ATOM 816 CB LEU A 228 25.153 -20.022 -14.464 1.00 21.55 C ATOM 817 CG LEU A 228 26.018 -20.936 -15.329 1.00 22.39 C ATOM 818 CD1 LEU A 228 26.593 -20.186 -16.538 1.00 24.08 C ATOM 819 CD2 LEU A 228 27.150 -21.575 -14.540 1.00 27.44 C ATOM 820 H LEU A 228 23.463 -18.525 -13.268 1.00 0.00 H ATOM 821 N ARG A 229 22.226 -21.126 -14.924 1.00 22.66 N ATOM 822 CA ARG A 229 21.289 -22.112 -15.435 1.00 24.47 C ATOM 823 C ARG A 229 20.325 -21.489 -16.428 1.00 23.12 C ATOM 824 O ARG A 229 20.064 -22.079 -17.481 1.00 23.84 O ATOM 825 CB ARG A 229 20.566 -22.794 -14.273 1.00 27.85 C ATOM 826 CG ARG A 229 21.473 -23.731 -13.479 1.00 39.68 C ATOM 827 CD ARG A 229 20.703 -24.585 -12.473 1.00 48.61 C ATOM 828 NE ARG A 229 20.116 -23.793 -11.393 1.00 53.76 N ATOM 829 CZ ARG A 229 20.779 -23.363 -10.321 1.00 56.62 C ATOM 830 NH1 ARG A 229 22.075 -23.634 -10.168 1.00 45.22 N ATOM 831 NH2 ARG A 229 20.143 -22.649 -9.400 1.00 46.18 N ATOM 832 HE ARG A 229 19.108 -23.548 -11.467 1.00 0.00 H ATOM 833 HH12 ARG A 229 22.582 -23.293 -9.326 1.00 0.00 H ATOM 834 HH11 ARG A 229 22.579 -24.187 -10.890 1.00 0.00 H ATOM 835 HH22 ARG A 229 20.654 -22.310 -8.560 1.00 0.00 H ATOM 836 HH21 ARG A 229 19.133 -22.429 -9.518 1.00 0.00 H ATOM 837 H ARG A 229 22.254 -20.914 -13.906 1.00 0.00 H ATOM 838 N TYR A 230 19.824 -20.291 -16.138 1.00 23.00 N ATOM 839 CA TYR A 230 18.944 -19.615 -17.080 1.00 23.71 C ATOM 840 C TYR A 230 19.636 -19.390 -18.417 1.00 25.20 C ATOM 841 O TYR A 230 19.079 -19.711 -19.479 1.00 23.98 O ATOM 842 CB TYR A 230 18.459 -18.290 -16.511 1.00 24.67 C ATOM 843 CG TYR A 230 17.717 -17.505 -17.565 1.00 30.03 C ATOM 844 CD1 TYR A 230 16.370 -17.741 -17.817 1.00 34.98 C ATOM 845 CD2 TYR A 230 18.377 -16.560 -18.332 1.00 31.23 C ATOM 846 CE1 TYR A 230 15.699 -17.036 -18.802 1.00 37.08 C ATOM 847 CE2 TYR A 230 17.722 -15.855 -19.322 1.00 34.86 C ATOM 848 CZ TYR A 230 16.383 -16.095 -19.549 1.00 39.43 C ATOM 849 OH TYR A 230 15.746 -15.377 -20.536 1.00 40.16 O ATOM 850 HH TYR A 230 14.797 -15.654 -20.584 1.00 0.00 H ATOM 851 H TYR A 230 20.062 -19.835 -15.234 1.00 0.00 H ATOM 852 N PHE A 231 20.831 -18.785 -18.397 1.00 22.50 N ATOM 853 CA PHE A 231 21.491 -18.432 -19.654 1.00 22.43 C ATOM 854 C PHE A 231 21.917 -19.674 -20.425 1.00 23.38 C ATOM 855 O PHE A 231 21.864 -19.691 -21.666 1.00 24.63 O ATOM 856 CB PHE A 231 22.709 -17.514 -19.431 1.00 21.92 C ATOM 857 CG PHE A 231 22.380 -16.152 -18.921 1.00 20.48 C ATOM 858 CD1 PHE A 231 21.402 -15.366 -19.512 1.00 30.21 C ATOM 859 CD2 PHE A 231 23.065 -15.626 -17.849 1.00 20.57 C ATOM 860 CE1 PHE A 231 21.107 -14.100 -18.992 1.00 27.05 C ATOM 861 CE2 PHE A 231 22.775 -14.374 -17.346 1.00 23.31 C ATOM 862 CZ PHE A 231 21.793 -13.610 -17.915 1.00 28.37 C ATOM 863 H PHE A 231 21.289 -18.567 -17.489 1.00 0.00 H ATOM 864 N GLU A 232 22.344 -20.726 -19.734 1.00 24.41 N ATOM 865 CA GLU A 232 22.746 -21.930 -20.439 1.00 24.36 C ATOM 866 C GLU A 232 21.552 -22.614 -21.094 1.00 30.94 C ATOM 867 O GLU A 232 21.661 -23.104 -22.222 1.00 29.11 O ATOM 868 CB GLU A 232 23.501 -22.868 -19.499 1.00 27.97 C ATOM 869 CG GLU A 232 24.892 -22.305 -19.183 1.00 30.73 C ATOM 870 CD GLU A 232 25.840 -23.324 -18.601 1.00 40.38 C ATOM 871 OE1 GLU A 232 25.358 -24.284 -17.972 1.00 40.97 O ATOM 872 OE2 GLU A 232 27.068 -23.161 -18.794 1.00 37.43 O ATOM 873 H GLU A 232 22.390 -20.687 -18.696 1.00 0.00 H ATOM 874 N GLN A 233 20.397 -22.632 -20.426 1.00 26.18 N ATOM 875 CA GLN A 233 19.206 -23.190 -21.065 1.00 33.27 C ATOM 876 C GLN A 233 18.721 -22.289 -22.202 1.00 29.17 C ATOM 877 O GLN A 233 18.289 -22.776 -23.262 1.00 30.21 O ATOM 878 CB GLN A 233 18.106 -23.370 -20.026 1.00 30.43 C ATOM 879 CG GLN A 233 17.017 -24.328 -20.461 1.00 51.08 C ATOM 880 CD GLN A 233 15.634 -23.718 -20.376 1.00 64.68 C ATOM 881 OE1 GLN A 233 15.373 -22.652 -20.946 1.00 66.07 O ATOM 882 NE2 GLN A 233 14.735 -24.391 -19.663 1.00 64.31 N ATOM 883 HE22 GLN A 233 15.001 -25.284 -19.201 1.00 0.00 H ATOM 884 HE21 GLN A 233 13.767 -24.024 -19.568 1.00 0.00 H ATOM 885 H GLN A 233 20.344 -22.252 -19.459 1.00 0.00 H ATOM 886 N LEU A 234 18.778 -20.973 -21.994 1.00 26.84 N ATOM 887 CA LEU A 234 18.315 -20.030 -23.015 1.00 26.14 C ATOM 888 C LEU A 234 19.112 -20.181 -24.293 1.00 28.97 C ATOM 889 O LEU A 234 18.548 -20.171 -25.396 1.00 27.49 O ATOM 890 CB LEU A 234 18.443 -18.596 -22.503 1.00 27.50 C ATOM 891 CG LEU A 234 18.073 -17.483 -23.498 1.00 28.76 C ATOM 892 CD1 LEU A 234 16.565 -17.461 -23.692 1.00 32.20 C ATOM 893 CD2 LEU A 234 18.595 -16.150 -23.025 1.00 30.41 C ATOM 894 H LEU A 234 19.156 -20.611 -21.095 1.00 0.00 H ATOM 895 N LEU A 235 20.423 -20.327 -24.172 1.00 27.05 N ATOM 896 CA LEU A 235 21.330 -20.338 -25.312 1.00 27.62 C ATOM 897 C LEU A 235 21.762 -21.748 -25.709 1.00 31.65 C ATOM 898 O LEU A 235 22.638 -21.906 -26.576 1.00 31.93 O ATOM 899 CB LEU A 235 22.555 -19.461 -25.011 1.00 23.61 C ATOM 900 CG LEU A 235 22.209 -18.016 -24.657 1.00 22.36 C ATOM 901 CD1 LEU A 235 23.444 -17.235 -24.265 1.00 22.49 C ATOM 902 CD2 LEU A 235 21.464 -17.312 -25.810 1.00 26.33 C ATOM 903 H LEU A 235 20.823 -20.439 -23.219 1.00 0.00 H ATOM 904 N GLU A 236 21.148 -22.775 -25.122 1.00 28.58 N ATOM 905 CA GLU A 236 21.532 -24.158 -25.384 1.00 35.13 C ATOM 906 C GLU A 236 23.043 -24.343 -25.243 1.00 40.56 C ATOM 907 O GLU A 236 23.698 -24.972 -26.073 1.00 43.11 O ATOM 908 CB GLU A 236 21.025 -24.612 -26.760 1.00 50.78 C ATOM 909 CG GLU A 236 19.505 -24.675 -26.859 1.00 46.69 C ATOM 910 CD GLU A 236 18.917 -25.817 -26.051 1.00 57.67 C ATOM 911 OE1 GLU A 236 19.634 -26.819 -25.839 1.00 48.89 O ATOM 912 OE2 GLU A 236 17.745 -25.711 -25.626 1.00 57.42 O ATOM 913 H GLU A 236 20.371 -22.585 -24.457 1.00 0.00 H ATOM 914 N GLU A 237 23.611 -23.763 -24.184 1.00 36.25 N ATOM 915 CA GLU A 237 25.035 -23.878 -23.883 1.00 41.57 C ATOM 916 C GLU A 237 25.279 -24.708 -22.623 1.00 50.45 C ATOM 917 O GLU A 237 26.287 -24.528 -21.933 1.00 45.53 O ATOM 918 CB GLU A 237 25.679 -22.496 -23.747 1.00 46.14 C ATOM 919 CG GLU A 237 25.583 -21.612 -24.991 1.00 46.83 C ATOM 920 CD GLU A 237 26.731 -21.818 -25.970 1.00 45.81 C ATOM 921 OE1 GLU A 237 27.649 -22.608 -25.663 1.00 54.40 O ATOM 922 OE2 GLU A 237 26.711 -21.182 -27.052 1.00 38.80 O ATOM 923 H GLU A 237 23.012 -23.204 -23.544 1.00 0.00 H ATOM 924 N GLU A 238 24.360 -25.618 -22.316 1.00 42.49 N ATOM 925 CA GLU A 238 24.456 -26.459 -21.130 1.00 51.27 C ATOM 926 C GLU A 238 25.589 -27.465 -21.268 1.00 59.91 C ATOM 927 O GLU A 238 26.238 -27.795 -20.275 1.00 51.95 O ATOM 928 CB GLU A 238 23.131 -27.188 -20.897 1.00 52.07 C ATOM 929 CG GLU A 238 22.060 -26.314 -20.263 1.00 56.44 C ATOM 930 CD GLU A 238 20.655 -26.828 -20.496 1.00 58.98 C ATOM 931 OE1 GLU A 238 20.471 -27.691 -21.378 1.00 69.91 O ATOM 932 OE2 GLU A 238 19.731 -26.357 -19.801 1.00 58.35 O ATOM 933 OXT GLU A 238 25.880 -27.957 -22.363 1.00 55.47 O ATOM 934 H GLU A 238 23.541 -25.734 -22.946 1.00 0.00 H TER 935 GLU A 238 HETATM 936 O HOH 1 25.035 -21.096 -28.005 1.00 30.02 O HETATM 937 O HOH 2 34.827 6.065 -3.885 1.00 46.18 O HETATM 938 O HOH 3 29.254 -22.238 -24.151 1.00 55.43 O HETATM 939 O HOH 4 42.012 3.359 -8.457 1.00 46.88 O HETATM 940 O HOH 5 43.679 -4.450 -8.681 1.00 47.90 O HETATM 941 O HOH 6 16.221 -20.471 -20.000 1.00 39.41 O HETATM 942 O HOH 7 21.096 -5.461 -28.130 1.00 28.42 O HETATM 943 O HOH 8 33.616 -11.601 -25.050 1.00 34.79 O HETATM 944 O HOH 9 28.865 5.872 -24.786 1.00 27.62 O HETATM 945 O HOH 10 31.306 -18.209 -2.748 1.00 17.63 O HETATM 946 O HOH 11 30.546 -11.360 -5.675 1.00 28.26 O HETATM 947 O HOH 12 33.523 -1.112 -2.960 1.00 39.45 O HETATM 948 O HOH 13 36.374 1.582 -20.039 1.00 38.80 O HETATM 949 O HOH 14 37.086 -9.964 -15.734 1.00 45.34 O HETATM 950 O HOH 15 40.041 -5.624 -5.257 1.00 41.58 O HETATM 951 O HOH 16 32.276 -21.589 -2.489 1.00 24.60 O HETATM 952 O HOH 17 34.481 -5.504 -1.429 1.00 34.72 O HETATM 953 O HOH 18 33.683 1.996 -20.311 1.00 29.22 O HETATM 954 O HOH 19 36.874 -3.794 -19.150 1.00 43.02 O HETATM 955 O HOH 20 24.687 -13.160 -13.788 1.00 26.65 O HETATM 956 O HOH 21 26.568 4.320 -5.639 1.00 33.63 O HETATM 957 O HOH 22 31.386 7.444 -7.066 1.00 38.93 O HETATM 958 O HOH 23 17.509 -20.497 -13.261 1.00 35.48 O HETATM 959 O HOH 24 28.126 -10.103 -5.543 1.00 24.49 O HETATM 960 O HOH 25 23.670 -20.217 -28.552 1.00 26.56 O HETATM 961 O HOH 26 38.993 -8.805 -7.340 1.00 34.36 O HETATM 962 O HOH 27 22.002 -21.563 -7.536 1.00 36.20 O HETATM 963 O HOH 28 33.793 -14.150 -4.083 1.00 28.54 O HETATM 964 O HOH 29 25.976 -20.982 -6.501 1.00 34.33 O HETATM 965 O HOH 30 23.989 -10.794 -11.949 1.00 23.43 O HETATM 966 O HOH 31 25.268 -20.168 -0.694 1.00 35.43 O HETATM 967 O HOH 32 38.540 -8.120 -16.920 1.00 47.09 O HETATM 968 O HOH 33 43.693 -2.812 -17.965 1.00 48.60 O HETATM 969 O HOH 34 22.998 -25.239 -16.684 1.00 39.75 O HETATM 970 O HOH 35 15.518 6.309 -12.967 1.00 51.42 O HETATM 971 O HOH 36 17.520 -22.622 -11.177 1.00 54.40 O HETATM 972 O HOH 37 38.388 6.594 -14.228 1.00 51.92 O HETATM 973 O HOH 38 15.259 0.408 -17.012 1.00 49.36 O HETATM 974 O HOH 39 17.627 -4.808 -24.962 1.00 40.53 O HETATM 975 O HOH 40 32.051 2.545 -4.116 1.00 36.20 O HETATM 976 O HOH 41 20.199 -11.971 -4.147 1.00 46.28 O HETATM 977 O HOH 42 29.496 1.822 -3.880 1.00 38.64 O HETATM 978 O HOH 43 17.376 -9.152 -22.787 1.00 42.23 O HETATM 979 O HOH 44 38.455 5.337 -3.528 1.00 44.85 O HETATM 980 O HOH 45 14.440 -19.953 -21.459 1.00 50.53 O HETATM 981 O HOH 46 36.504 -11.309 -7.056 1.00 25.79 O HETATM 982 O HOH 47 33.575 -17.222 -18.938 1.00 35.02 O HETATM 983 O HOH 48 28.677 -23.413 -8.003 1.00 40.05 O HETATM 984 O HOH 49 29.452 -23.346 -17.106 1.00 40.09 O HETATM 985 O HOH 50 29.187 -20.190 -28.268 1.00 28.90 O HETATM 986 O HOH 51 39.687 2.490 -5.488 1.00 37.99 O HETATM 987 O HOH 52 26.292 8.411 -7.661 1.00 43.39 O HETATM 988 O HOH 53 23.977 -16.807 -2.264 1.00 28.31 O HETATM 989 O HOH 54 21.423 6.459 -8.131 1.00 37.32 O HETATM 990 O HOH 55 18.200 -1.077 -20.895 1.00 44.64 O HETATM 991 O HOH 56 22.015 -26.891 -23.952 1.00 46.00 O HETATM 992 O HOH 57 29.543 -17.329 -24.078 1.00 30.53 O HETATM 993 O HOH 58 24.698 -23.153 -12.030 1.00 42.19 O HETATM 994 O HOH 59 35.804 -15.721 -20.029 1.00 51.88 O HETATM 995 O HOH 60 18.766 -16.409 -10.193 1.00 34.58 O HETATM 996 O HOH 61 24.115 3.562 -5.524 1.00 42.24 O HETATM 997 O HOH 62 36.082 -12.403 -5.872 1.00 28.45 O HETATM 998 O HOH 63 50.066 -2.753 -8.580 1.00 69.93 O HETATM 999 O HOH 64 19.268 7.511 -16.922 1.00 38.92 O HETATM 1000 O HOH 65 19.819 -10.733 -28.565 1.00 31.42 O HETATM 1001 O HOH 66 15.343 -20.305 -25.858 1.00 45.12 O HETATM 1002 O HOH 67 18.866 -18.768 -7.897 1.00 44.54 O HETATM 1003 O HOH 68 28.226 3.865 -3.570 1.00 49.14 O HETATM 1004 O HOH 69 31.946 7.525 -21.454 1.00 41.47 O HETATM 1005 O HOH 70 32.438 -18.594 -21.432 1.00 36.26 O HETATM 1006 O HOH 71 48.607 0.446 -10.432 1.00 58.41 O HETATM 1007 O HOH 72 32.166 -3.034 -2.043 1.00 46.34 O HETATM 1008 O HOH 73 28.576 7.595 -6.974 1.00 43.96 O HETATM 1009 O HOH 74 40.426 5.376 -3.607 1.00 52.84 O HETATM 1010 O HOH 75 24.384 -22.546 -7.724 1.00 46.07 O HETATM 1011 O HOH 76 23.759 -17.675 -0.922 1.00 29.01 O HETATM 1012 O HOH 77 18.616 -17.357 -5.702 1.00 48.29 O HETATM 1013 O HOH 78 29.260 0.000 -24.314 1.00 42.53 O HETATM 1014 O HOH 79 19.810 -15.743 -3.640 1.00 41.79 O HETATM 1015 O HOH 80 16.199 -1.978 -20.227 1.00 48.18 O HETATM 1016 O HOH 81 44.255 0.000 -18.346 1.00 53.47 O HETATM 1017 O HOH 82 17.924 -1.124 -23.557 1.00 49.20 O HETATM 1018 O HOH 83 42.321 -4.173 -19.643 1.00 49.82 O HETATM 1019 O HOH 84 35.509 -7.555 0.270 1.00 42.61 O HETATM 1020 O HOH 85 17.566 -8.545 -27.930 1.00 46.90 O HETATM 1021 O HOH 86 32.877 0.059 -22.138 1.00 38.01 O HETATM 1022 O HOH 87 39.761 -9.238 -4.780 1.00 47.66 O HETATM 1023 O HOH 88 17.730 -9.512 -7.092 1.00 40.49 O HETATM 1024 O HOH 89 15.326 -10.090 -14.871 1.00 43.84 O HETATM 1025 O HOH 90 21.208 0.186 -3.093 1.00 48.87 O HETATM 1026 O HOH 91 17.299 -16.339 -11.566 1.00 42.52 O HETATM 1027 N PRO A 92 8.637 -13.804 -13.729 1.00 0.25 N HETATM 1028 CA PRO A 92 8.805 -14.430 -15.046 1.00 0.07 C HETATM 1029 C PRO A 92 10.171 -15.105 -15.181 1.00 0.23 C HETATM 1030 O PRO A 92 11.030 -14.902 -14.320 1.00 -0.39 O HETATM 1031 N PRO A 92 10.371 -15.895 -16.249 1.00 -0.25 N HETATM 1032 CA PRO A 92 11.602 -16.688 -16.379 1.00 0.13 C HETATM 1033 C PRO A 92 12.767 -15.806 -16.802 1.00 0.20 C HETATM 1034 O PRO A 92 12.815 -15.314 -17.933 1.00 -0.39 O HETATM 1035 N PRO A 92 13.715 -15.603 -15.887 1.00 -0.27 N HETATM 1036 CA PRO A 92 14.856 -14.770 -16.186 1.00 0.12 C HETATM 1037 C PRO A 92 15.907 -14.712 -15.097 1.00 0.20 C HETATM 1038 O PRO A 92 15.762 -15.279 -14.014 1.00 -0.39 O HETATM 1039 N PRO A 92 17.003 -14.027 -15.384 1.00 -0.25 N HETATM 1040 CA PRO A 92 18.047 -13.841 -14.380 1.00 0.13 C HETATM 1041 C PRO A 92 17.636 -12.774 -13.385 1.00 0.20 C HETATM 1042 O PRO A 92 16.641 -12.066 -13.540 1.00 -0.39 O HETATM 1043 N PRO A 92 18.439 -12.660 -12.343 1.00 -0.26 N HETATM 1044 CA PRO A 92 18.220 -11.636 -11.348 1.00 0.13 C HETATM 1045 C PRO A 92 19.547 -10.977 -11.032 1.00 0.20 C HETATM 1046 O PRO A 92 20.534 -11.666 -10.754 1.00 -0.39 O HETATM 1047 N PRO A 92 19.563 -9.647 -11.061 1.00 -0.27 N HETATM 1048 CA PRO A 92 20.747 -8.900 -10.733 1.00 0.12 C HETATM 1049 C PRO A 92 20.793 -8.567 -9.252 1.00 0.20 C HETATM 1050 O PRO A 92 19.908 -8.954 -8.479 1.00 -0.39 O HETATM 1051 N PRO A 92 21.806 -7.817 -8.837 1.00 -0.25 N HETATM 1052 CA PRO A 92 21.887 -7.377 -7.450 1.00 0.13 C HETATM 1053 C PRO A 92 20.636 -6.618 -7.052 1.00 0.21 C HETATM 1054 O PRO A 92 20.069 -5.848 -7.848 1.00 -0.39 O HETATM 1055 N PRO A 92 20.173 -6.809 -5.816 1.00 -0.25 N HETATM 1056 CA PRO A 92 18.990 -6.075 -5.358 1.00 0.13 C HETATM 1057 C PRO A 92 19.191 -4.577 -5.321 1.00 0.20 C HETATM 1058 O PRO A 92 18.206 -3.833 -5.403 1.00 -0.39 O HETATM 1059 N PRO A 92 20.431 -4.113 -5.211 1.00 -0.27 N HETATM 1060 CA PRO A 92 20.728 -2.701 -5.099 1.00 0.08 C HETATM 1061 C PRO A 92 22.224 -2.513 -5.215 1.00 0.06 C HETATM 1062 O PRO A 92 22.908 -3.454 -5.612 1.00 -0.57 O HETATM 1063 OXT PRO A 92 22.788 -1.465 -4.895 1.00 -0.57 O HETATM 1064 H50 PRO A 92 20.382 -2.325 -4.125 1.00 0.07 H HETATM 1065 H51 PRO A 92 20.222 -2.151 -5.905 1.00 0.07 H HETATM 1066 H49 PRO A 92 21.189 -4.765 -5.205 1.00 0.19 H HETATM 1067 CB PRO A 92 18.759 -6.642 -3.948 1.00 -0.01 C HETATM 1068 CG PRO A 92 19.382 -8.002 -3.982 1.00 -0.03 C HETATM 1069 CD PRO A 92 20.586 -7.856 -4.866 1.00 0.04 C HETATM 1070 H47 PRO A 92 21.466 -7.540 -4.287 1.00 0.05 H HETATM 1071 H48 PRO A 92 20.810 -8.798 -5.388 1.00 0.05 H HETATM 1072 H45 PRO A 92 18.681 -8.738 -4.402 1.00 0.03 H HETATM 1073 H46 PRO A 92 19.681 -8.316 -2.971 1.00 0.03 H HETATM 1074 H43 PRO A 92 17.683 -6.713 -3.729 1.00 0.03 H HETATM 1075 H44 PRO A 92 19.246 -6.010 -3.191 1.00 0.03 H HETATM 1076 H42 PRO A 92 18.131 -6.296 -6.009 1.00 0.08 H HETATM 1077 CB PRO A 92 23.121 -6.453 -7.445 1.00 -0.01 C HETATM 1078 CG PRO A 92 23.963 -6.978 -8.559 1.00 -0.03 C HETATM 1079 CD PRO A 92 23.005 -7.436 -9.608 1.00 0.04 C HETATM 1080 H40 PRO A 92 22.777 -6.624 -10.314 1.00 0.05 H HETATM 1081 H41 PRO A 92 23.408 -8.298 -10.159 1.00 0.05 H HETATM 1082 H38 PRO A 92 24.580 -7.819 -8.210 1.00 0.03 H HETATM 1083 H39 PRO A 92 24.614 -6.184 -8.954 1.00 0.03 H HETATM 1084 H36 PRO A 92 23.655 -6.518 -6.486 1.00 0.03 H HETATM 1085 H37 PRO A 92 22.830 -5.409 -7.633 1.00 0.03 H HETATM 1086 H35 PRO A 92 22.031 -8.231 -6.772 1.00 0.08 H HETATM 1087 H33 PRO A 92 20.753 -7.964 -11.312 1.00 0.08 H HETATM 1088 H34 PRO A 92 21.633 -9.498 -10.994 1.00 0.08 H HETATM 1089 H32 PRO A 92 18.731 -9.155 -11.317 1.00 0.19 H HETATM 1090 CB PRO A 92 17.614 -12.253 -10.090 1.00 -0.02 C HETATM 1091 H29 PRO A 92 17.451 -11.467 -9.338 1.00 0.03 H HETATM 1092 H30 PRO A 92 18.302 -13.010 -9.685 1.00 0.03 H HETATM 1093 H31 PRO A 92 16.653 -12.726 -10.340 1.00 0.03 H HETATM 1094 H28 PRO A 92 17.526 -10.882 -11.747 1.00 0.08 H HETATM 1095 H27 PRO A 92 19.209 -13.290 -12.241 1.00 0.19 H HETATM 1096 CB PRO A 92 19.236 -13.370 -15.209 1.00 -0.01 C HETATM 1097 CG PRO A 92 18.592 -12.598 -16.327 1.00 -0.03 C HETATM 1098 CD PRO A 92 17.337 -13.362 -16.650 1.00 0.04 C HETATM 1099 H25 PRO A 92 16.531 -12.681 -16.960 1.00 0.05 H HETATM 1100 H26 PRO A 92 17.520 -14.100 -17.445 1.00 0.05 H HETATM 1101 H23 PRO A 92 19.257 -12.557 -17.203 1.00 0.03 H HETATM 1102 H24 PRO A 92 18.350 -11.575 -16.002 1.00 0.03 H HETATM 1103 H21 PRO A 92 19.808 -14.225 -15.599 1.00 0.03 H HETATM 1104 H22 PRO A 92 19.900 -12.724 -14.615 1.00 0.03 H HETATM 1105 H20 PRO A 92 18.271 -14.780 -13.853 1.00 0.08 H HETATM 1106 H18 PRO A 92 14.494 -13.747 -16.366 1.00 0.08 H HETATM 1107 H19 PRO A 92 15.332 -15.157 -17.099 1.00 0.08 H HETATM 1108 H17 PRO A 92 13.635 -16.031 -14.987 1.00 0.19 H HETATM 1109 CB PRO A 92 11.234 -17.708 -17.467 1.00 -0.01 C HETATM 1110 CG PRO A 92 10.289 -16.959 -18.353 1.00 -0.03 C HETATM 1111 CD PRO A 92 9.524 -15.999 -17.454 1.00 0.04 C HETATM 1112 H15 PRO A 92 9.408 -15.018 -17.937 1.00 0.05 H HETATM 1113 H16 PRO A 92 8.533 -16.404 -17.203 1.00 0.05 H HETATM 1114 H13 PRO A 92 9.594 -17.657 -18.843 1.00 0.03 H HETATM 1115 H14 PRO A 92 10.848 -16.400 -19.118 1.00 0.03 H HETATM 1116 H11 PRO A 92 10.744 -18.590 -17.028 1.00 0.03 H HETATM 1117 H12 PRO A 92 12.127 -18.025 -18.026 1.00 0.03 H HETATM 1118 H10 PRO A 92 11.851 -17.193 -15.434 1.00 0.08 H HETATM 1119 CB PRO A 92 8.667 -13.250 -16.016 1.00 0.01 C HETATM 1120 CG PRO A 92 7.889 -12.221 -15.256 1.00 -0.01 C HETATM 1121 CD PRO A 92 8.328 -12.368 -13.834 1.00 -0.03 C HETATM 1122 H8 PRO A 92 9.219 -11.756 -13.630 1.00 0.08 H HETATM 1123 H9 PRO A 92 7.522 -12.085 -13.140 1.00 0.08 H HETATM 1124 H6 PRO A 92 6.809 -12.409 -15.348 1.00 0.03 H HETATM 1125 H7 PRO A 92 8.118 -11.212 -15.628 1.00 0.03 H HETATM 1126 H4 PRO A 92 8.124 -13.555 -16.923 1.00 0.03 H HETATM 1127 H5 PRO A 92 9.657 -12.860 -16.295 1.00 0.03 H HETATM 1128 H3 PRO A 92 8.016 -15.176 -15.225 1.00 0.11 H HETATM 1129 H1 PRO A 92 9.491 -13.915 -13.205 1.00 0.20 H HETATM 1130 H2 PRO A 92 7.883 -14.264 -13.244 1.00 0.20 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 1027 1028 1121 1129 1130 CONECT 1028 1027 1029 1119 1128 CONECT 1029 1028 1030 1031 CONECT 1030 1029 CONECT 1031 1029 1032 1111 CONECT 1032 1031 1033 1109 1118 CONECT 1033 1032 1034 1035 CONECT 1034 1033 CONECT 1035 1033 1036 1108 CONECT 1036 1035 1037 1106 1107 CONECT 1037 1036 1038 1039 CONECT 1038 1037 CONECT 1039 1037 1040 1098 CONECT 1040 1039 1041 1096 1105 CONECT 1041 1040 1042 1043 CONECT 1042 1041 CONECT 1043 1041 1044 1095 CONECT 1044 1043 1045 1090 1094 CONECT 1045 1044 1046 1047 CONECT 1046 1045 CONECT 1047 1045 1048 1089 CONECT 1048 1047 1049 1087 1088 CONECT 1049 1048 1050 1051 CONECT 1050 1049 CONECT 1051 1049 1052 1079 CONECT 1052 1051 1053 1077 1086 CONECT 1053 1052 1054 1055 CONECT 1054 1053 CONECT 1055 1053 1056 1069 CONECT 1056 1055 1057 1067 1076 CONECT 1057 1056 1058 1059 CONECT 1058 1057 CONECT 1059 1057 1060 1066 CONECT 1060 1059 1061 1064 1065 CONECT 1061 1060 1062 1063 CONECT 1062 1061 CONECT 1063 1061 CONECT 1064 1060 CONECT 1065 1060 CONECT 1066 1059 CONECT 1067 1056 1068 1074 1075 CONECT 1068 1067 1069 1072 1073 CONECT 1069 1055 1068 1070 1071 CONECT 1070 1069 CONECT 1071 1069 CONECT 1072 1068 CONECT 1073 1068 CONECT 1074 1067 CONECT 1075 1067 CONECT 1076 1056 CONECT 1077 1052 1078 1084 1085 CONECT 1078 1077 1079 1082 1083 CONECT 1079 1051 1078 1080 1081 CONECT 1080 1079 CONECT 1081 1079 CONECT 1082 1078 CONECT 1083 1078 CONECT 1084 1077 CONECT 1085 1077 CONECT 1086 1052 CONECT 1087 1048 CONECT 1088 1048 CONECT 1089 1047 CONECT 1090 1044 1091 1092 1093 CONECT 1091 1090 CONECT 1092 1090 CONECT 1093 1090 CONECT 1094 1044 CONECT 1095 1043 CONECT 1096 1040 1097 1103 1104 CONECT 1097 1096 1098 1101 1102 CONECT 1098 1039 1097 1099 1100 CONECT 1099 1098 CONECT 1100 1098 CONECT 1101 1097 CONECT 1102 1097 CONECT 1103 1096 CONECT 1104 1096 CONECT 1105 1040 CONECT 1106 1036 CONECT 1107 1036 CONECT 1108 1035 CONECT 1109 1032 1110 1116 1117 CONECT 1110 1109 1111 1114 1115 CONECT 1111 1031 1110 1112 1113 CONECT 1112 1111 CONECT 1113 1111 CONECT 1114 1110 CONECT 1115 1110 CONECT 1116 1109 CONECT 1117 1109 CONECT 1118 1032 CONECT 1119 1028 1120 1126 1127 CONECT 1120 1119 1121 1124 1125 CONECT 1121 1027 1120 1122 1123 CONECT 1122 1121 CONECT 1123 1121 CONECT 1124 1120 CONECT 1125 1120 CONECT 1126 1119 CONECT 1127 1119 CONECT 1128 1028 CONECT 1129 1027 CONECT 1130 1027 MASTER 0 0 0 0 0 0 0 0 1129 1 108 8 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 6evn
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
6evm
RCSB PDB
PDBbind
102aa, >6EVM_1|Chain... *
6evo
RCSB PDB
PDBbind
102aa, >6EVO_1|Chain... at 100%
6evp
RCSB PDB
PDBbind
102aa, >6EVP_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1bmb
RCSB PDB
PDBbind
9-mer
1f90
RCSB PDB
PDBbind
9-mer
1fzk
RCSB PDB
PDBbind
9-mer
1fzo
RCSB PDB
PDBbind
9-mer
1g3f
RCSB PDB
PDBbind
9-mer
1g7p
RCSB PDB
PDBbind
9-mer
1gux
RCSB PDB
PDBbind
9-mer
1gwq
RCSB PDB
PDBbind
9-mer
1h24
RCSB PDB
PDBbind
9-mer
1inq
RCSB PDB
PDBbind
9-mer
1jp5
RCSB PDB
PDBbind
9-mer
1juf
RCSB PDB
PDBbind
9-mer
1kl3
RCSB PDB
PDBbind
9-mer
1kl5
RCSB PDB
PDBbind
9-mer
1lb6
RCSB PDB
PDBbind
9-mer
1mfg
RCSB PDB
PDBbind
9-mer
1mpa
RCSB PDB
PDBbind
9-mer
1nlo
RCSB PDB
PDBbind
9-mer
1oai
RCSB PDB
PDBbind
9-mer
1oxn
RCSB PDB
PDBbind
9-mer
1oxq
RCSB PDB
PDBbind
9-mer
1oy7
RCSB PDB
PDBbind
9-mer
1pcg
RCSB PDB
PDBbind
9-mer
1prl
RCSB PDB
PDBbind
9-mer
1prm
RCSB PDB
PDBbind
9-mer
1rlp
RCSB PDB
PDBbind
9-mer
1rlq
RCSB PDB
PDBbind
9-mer
1rst
RCSB PDB
PDBbind
9-mer
1utc
RCSB PDB
PDBbind
9-mer
1vwf
RCSB PDB
PDBbind
9-mer
1vwl
RCSB PDB
PDBbind
9-mer
1x7q
RCSB PDB
PDBbind
9-mer
1xr8
RCSB PDB
PDBbind
9-mer
1xr9
RCSB PDB
PDBbind
9-mer
1zea
RCSB PDB
PDBbind
9-mer
2bgn
RCSB PDB
PDBbind
9-mer
2bgr
RCSB PDB
PDBbind
9-mer
2e7l
RCSB PDB
PDBbind
9-mer
2gv2
RCSB PDB
PDBbind
9-mer
2h6q
RCSB PDB
PDBbind
9-mer
2hkf
RCSB PDB
PDBbind
9-mer
2jo9
RCSB PDB
PDBbind
9-mer
2jup
RCSB PDB
PDBbind
9-mer
2kgi
RCSB PDB
PDBbind
9-mer
2khh
RCSB PDB
PDBbind
9-mer
2lnw
RCSB PDB
PDBbind
9-mer
2lsv
RCSB PDB
PDBbind
9-mer
2mpa
RCSB PDB
PDBbind
9-mer
2ms4
RCSB PDB
PDBbind
9-mer
2oei
RCSB PDB
PDBbind
9-mer
2oi9
RCSB PDB
PDBbind
9-mer
2q8y
RCSB PDB
PDBbind
9-mer
2qt5
RCSB PDB
PDBbind
9-mer
2rm0
RCSB PDB
PDBbind
9-mer
2v83
RCSB PDB
PDBbind
9-mer
2v86
RCSB PDB
PDBbind
9-mer
2vpe
RCSB PDB
PDBbind
9-mer
2w0z
RCSB PDB
PDBbind
9-mer
2x3t
RCSB PDB
PDBbind
9-mer
2x4o
RCSB PDB
PDBbind
9-mer
2x4r
RCSB PDB
PDBbind
9-mer
2x4s
RCSB PDB
PDBbind
9-mer
2x4t
RCSB PDB
PDBbind
9-mer
2x4u
RCSB PDB
PDBbind
9-mer
2xhs
RCSB PDB
PDBbind
9-mer
2ymt
RCSB PDB
PDBbind
9-mer
3ah8
RCSB PDB
PDBbind
9-mer
3bgm
RCSB PDB
PDBbind
9-mer
3bze
RCSB PDB
PDBbind
9-mer
3bzf
RCSB PDB
PDBbind
9-mer
3bzi
RCSB PDB
PDBbind
9-mer
3cii
RCSB PDB
PDBbind
9-mer
3cyy
RCSB PDB
PDBbind
9-mer
3d1f
RCSB PDB
PDBbind
9-mer
3d25
RCSB PDB
PDBbind
9-mer
3drg
RCSB PDB
PDBbind
9-mer
3ery
RCSB PDB
PDBbind
9-mer
3fbr
RCSB PDB
PDBbind
9-mer
3fn0
RCSB PDB
PDBbind
9-mer
3ft2
RCSB PDB
PDBbind
9-mer
3ft3
RCSB PDB
PDBbind
9-mer
3ft4
RCSB PDB
PDBbind
9-mer
3gl6
RCSB PDB
PDBbind
9-mer
3iet
RCSB PDB
PDBbind
9-mer
3k27
RCSB PDB
PDBbind
9-mer
3lqi
RCSB PDB
PDBbind
9-mer
3lqj
RCSB PDB
PDBbind
9-mer
3mxc
RCSB PDB
PDBbind
9-mer
3mxy
RCSB PDB
PDBbind
9-mer
3o4l
RCSB PDB
PDBbind
9-mer
3o6m
RCSB PDB
PDBbind
9-mer
3obq
RCSB PDB
PDBbind
9-mer
3obu
RCSB PDB
PDBbind
9-mer
3obx
RCSB PDB
PDBbind
9-mer
3qfd
RCSB PDB
PDBbind
9-mer
3r0h
RCSB PDB
PDBbind
9-mer
3r42
RCSB PDB
PDBbind
9-mer
3rwc
RCSB PDB
PDBbind
9-mer
3rwe
RCSB PDB
PDBbind
9-mer
3rwf
RCSB PDB
PDBbind
9-mer
3rwg
RCSB PDB
PDBbind
9-mer
3soq
RCSB PDB
PDBbind
9-mer
3sou
RCSB PDB
PDBbind
9-mer
3sov
RCSB PDB
PDBbind
9-mer
3sow
RCSB PDB
PDBbind
9-mer
3t5i
RCSB PDB
PDBbind
9-mer
3tf7
RCSB PDB
PDBbind
9-mer
3tfk
RCSB PDB
PDBbind
9-mer
3tjh
RCSB PDB
PDBbind
9-mer
3tpu
RCSB PDB
PDBbind
9-mer
3zhf
RCSB PDB
PDBbind
9-mer
4bt9
RCSB PDB
PDBbind
9-mer
4btb
RCSB PDB
PDBbind
9-mer
4cdr
RCSB PDB
PDBbind
9-mer
4ezq
RCSB PDB
PDBbind
9-mer
4ezt
RCSB PDB
PDBbind
9-mer
4fcm
RCSB PDB
PDBbind
9-mer
4fmn
RCSB PDB
PDBbind
9-mer
4i80
RCSB PDB
PDBbind
9-mer
4iho
RCSB PDB
PDBbind
9-mer
4j3u
RCSB PDB
PDBbind
9-mer
4mex
RCSB PDB
PDBbind
9-mer
4mnq
RCSB PDB
PDBbind
9-mer
4mzf
RCSB PDB
PDBbind
9-mer
4mzh
RCSB PDB
PDBbind
9-mer
4o2e
RCSB PDB
PDBbind
9-mer
4od7
RCSB PDB
PDBbind
9-mer
4pg9
RCSB PDB
PDBbind
9-mer
4pgb
RCSB PDB
PDBbind
9-mer
4pgc
RCSB PDB
PDBbind
9-mer
4pgd
RCSB PDB
PDBbind
9-mer
4pge
RCSB PDB
PDBbind
9-mer
4qbm
RCSB PDB
PDBbind
9-mer
4rh5
RCSB PDB
PDBbind
9-mer
4utn
RCSB PDB
PDBbind
9-mer
4utr
RCSB PDB
PDBbind
9-mer
4utv
RCSB PDB
PDBbind
9-mer
4utx
RCSB PDB
PDBbind
9-mer
4uu7
RCSB PDB
PDBbind
9-mer
4uu8
RCSB PDB
PDBbind
9-mer
4uua
RCSB PDB
PDBbind
9-mer
4uub
RCSB PDB
PDBbind
9-mer
4x3h
RCSB PDB
PDBbind
9-mer
4y5i
RCSB PDB
PDBbind
9-mer
4yoz
RCSB PDB
PDBbind
9-mer
5apr
RCSB PDB
PDBbind
9-mer
5brz
RCSB PDB
PDBbind
9-mer
5bs0
RCSB PDB
PDBbind
9-mer
5cvd
RCSB PDB
PDBbind
9-mer
5d0j
RCSB PDB
PDBbind
9-mer
5dms
RCSB PDB
PDBbind
9-mer
5e4w
RCSB PDB
PDBbind
9-mer
5eel
RCSB PDB
PDBbind
9-mer
5eok
RCSB PDB
PDBbind
9-mer
5fjw
RCSB PDB
PDBbind
9-mer
5gu4
RCSB PDB
PDBbind
9-mer
5hda
RCSB PDB
PDBbind
9-mer
5heb
RCSB PDB
PDBbind
9-mer
5hed
RCSB PDB
PDBbind
9-mer
5hey
RCSB PDB
PDBbind
9-mer
5hf1
RCSB PDB
PDBbind
9-mer
5hfb
RCSB PDB
PDBbind
9-mer
5hfc
RCSB PDB
PDBbind
9-mer
5hff
RCSB PDB
PDBbind
9-mer
5hjc
RCSB PDB
PDBbind
9-mer
5hkh
RCSB PDB
PDBbind
9-mer
5i8c
RCSB PDB
PDBbind
9-mer
5isz
RCSB PDB
PDBbind
9-mer
5jhd
RCSB PDB
PDBbind
9-mer
5lb7
RCSB PDB
PDBbind
9-mer
5lgs
RCSB PDB
PDBbind
9-mer
5nme
RCSB PDB
PDBbind
9-mer
5nmf
RCSB PDB
PDBbind
9-mer
5nmg
RCSB PDB
PDBbind
9-mer
5npr
RCSB PDB
PDBbind
9-mer
5nps
RCSB PDB
PDBbind
9-mer
5swf
RCSB PDB
PDBbind
9-mer
5u98
RCSB PDB
PDBbind
9-mer
5w1v
RCSB PDB
PDBbind
9-mer
5w1w
RCSB PDB
PDBbind
9-mer
5w7x
RCSB PDB
PDBbind
9-mer
5yc3
RCSB PDB
PDBbind
9-mer
5yc4
RCSB PDB
PDBbind
9-mer
5ygf
RCSB PDB
PDBbind
9-mer
5yvx
RCSB PDB
PDBbind
9-mer
5yy4
RCSB PDB
PDBbind
9-mer
5zia
RCSB PDB
PDBbind
9-mer
6bj2
RCSB PDB
PDBbind
9-mer
6bj3
RCSB PDB
PDBbind
9-mer
6c4u
RCSB PDB
PDBbind
9-mer
6evm
RCSB PDB
PDBbind
9-mer
6evo
RCSB PDB
PDBbind
9-mer
6evp
RCSB PDB
PDBbind
9-mer
6fdp
RCSB PDB
PDBbind
9-mer
6fdt
RCSB PDB
PDBbind
9-mer
6qts
RCSB PDB
PDBbind
9-mer
6qtq
RCSB PDB
PDBbind
9-mer
6q38
RCSB PDB
PDBbind
9-mer
6o9c
RCSB PDB
PDBbind
9-mer
6o9b
RCSB PDB
PDBbind
9-mer
6ncp
RCSB PDB
PDBbind
9-mer
6mt6
RCSB PDB
PDBbind
9-mer
6mt5
RCSB PDB
PDBbind
9-mer
6mt4
RCSB PDB
PDBbind
9-mer
6i7a
RCSB PDB
PDBbind
9-mer
6i68
RCSB PDB
PDBbind
9-mer
6i5p
RCSB PDB
PDBbind
9-mer
6i41
RCSB PDB
PDBbind
9-mer
6hlb
RCSB PDB
PDBbind
9-mer
6eqa
RCSB PDB
PDBbind
9-mer
6d78
RCSB PDB
PDBbind
9-mer
6aee
RCSB PDB
PDBbind
9-mer
5y5w
RCSB PDB
PDBbind
9-mer
5wlg
RCSB PDB
PDBbind
9-mer
5u1q
RCSB PDB
PDBbind
9-mer
5u06
RCSB PDB
PDBbind
9-mer
5tyi
RCSB PDB
PDBbind
9-mer
5iza
RCSB PDB
PDBbind
9-mer
5iz9
RCSB PDB
PDBbind
9-mer
5iz6
RCSB PDB
PDBbind
9-mer
6a9c
RCSB PDB
PDBbind
9-mer
5b6g
RCSB PDB
PDBbind
9-mer
Entry Information
PDB ID
6evn
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Prolyl 4-hydroxylase subunit alpha-2
Ligand Name
9-mer
EC.Number
E.C.1.14.11.2
Resolution
1.48(Å)
Affinity (Kd/Ki/IC50)
Kd=19.7uM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) Protein Sci. Vol. 27: pp. 1692-1703
Ligand Properties
Formula
C
3
4
H
5
2
N
9
O
1
0
Molecular Weight
746.831
Exact Mass
746.384
No. of atoms
105
No. of bonds
109
Polar Surface Area
251.55
LOGP Value
-3.50 (
Computed with XLOGP3
)
-1.50 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 5
No. of Hydrogen Bond Acceptors: 10
No. of Rotatable Bonds: 20
No. of Nitrogen and Oxygen Atoms: 19
No. of Rings: 5
Canonical SMILES
OC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCC[NH2+]1)C
InChI String
InChI=1S/C34H51N9O10/c1-20(29(48)36-17-27(45)41-14-6-11-25(41)34(53)43-16-5-9-23(43)31(50)38-19-28(46)47)39-32(51)24-10-3-13-40(24)26(44)18-37-30(49)22-8-4-15-42(22)33(52)21-7-2-12-35-21/h20-25,35H,2-19H2,1H3,(H,36,48)(H,37,49)(H,38,50)(H,39,51)(H,46,47)/p+1/t20-,21-,22-,23-,24-,25-/m0/s1
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):
O15460
Entrez Gene ID
NCBI Entrez Gene ID:
8974
ASD
Information of known allosteric effects of PDB entries
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