Browse entries in the PDBbind-CN Database
HEADER 6OQB_COMPLEX COMPND 6OQB_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 155 ASP GLU LEU TYR ARG GLN SER LEU GLU ILE ILE SER ARG SEQRES 2 A 155 TYR LEU ARG GLU GLN ALA THR GLY ALA LYS ASP THR LYS SEQRES 3 A 155 PRO MET GLY ARG SER GLY ALA THR SER ARG LYS ALA LEU SEQRES 4 A 155 GLU THR LEU ARG ARG VAL GLY ASP GLY VAL GLN ARG ASN SEQRES 5 A 155 HIS GLU THR ALA PHE GLN GLY MET LEU ARG LYS LEU ASP SEQRES 6 A 155 ILE LYS ASN GLU ASP ASP VAL LYS SER LEU SER ARG VAL SEQRES 7 A 155 MET ILE HIS VAL PHE SER ASP GLY VAL THR ASN TRP GLY SEQRES 8 A 155 ARG ILE VAL THR LEU ILE SER PHE GLY ALA PHE VAL ALA SEQRES 9 A 155 LYS HIS LEU LYS THR ILE ASN GLN GLU SER CYS ILE GLU SEQRES 10 A 155 PRO LEU ALA GLU SER ILE THR ASP VAL LEU VAL ARG THR SEQRES 11 A 155 LYS ARG ASP TRP LEU VAL LYS GLN ARG GLY TRP ASP GLY SEQRES 12 A 155 PHE VAL GLU PHE PHE HIS VAL GLU ASP LEU GLU GLY HET N A 0J 80 ATOM 1 N ASP A 172 3.062 16.067 75.302 1.00 19.59 N ATOM 2 CA ASP A 172 2.502 15.277 76.400 1.00 17.27 C ATOM 3 C ASP A 172 2.440 16.151 77.643 1.00 11.68 C ATOM 4 O ASP A 172 3.391 16.181 78.439 1.00 12.08 O ATOM 5 CB ASP A 172 3.383 14.037 76.644 1.00 13.72 C ATOM 6 CG ASP A 172 2.790 13.057 77.681 1.00 10.85 C ATOM 7 OD1 ASP A 172 1.840 13.416 78.389 1.00 11.49 O ATOM 8 OD2 ASP A 172 3.320 11.925 77.778 1.00 10.88 O ATOM 9 HN3 ASP A 172 4.018 16.387 75.559 1.00 0.00 H ATOM 10 HN2 ASP A 172 2.455 16.892 75.126 1.00 0.00 H ATOM 11 HN1 ASP A 172 3.110 15.481 74.444 1.00 0.00 H ATOM 12 N GLU A 173 1.323 16.857 77.814 1.00 12.62 N ATOM 13 CA GLU A 173 1.217 17.861 78.859 1.00 17.62 C ATOM 14 C GLU A 173 1.256 17.235 80.233 1.00 14.46 C ATOM 15 O GLU A 173 1.863 17.790 81.135 1.00 13.04 O ATOM 16 CB GLU A 173 -0.070 18.666 78.746 1.00 19.16 C ATOM 17 CG GLU A 173 -0.154 19.766 79.777 1.00 30.67 C ATOM 18 CD GLU A 173 1.047 20.701 79.719 1.00 41.11 C ATOM 19 OE1 GLU A 173 1.201 21.410 78.700 1.00 47.81 O ATOM 20 OE2 GLU A 173 1.849 20.712 80.682 1.00 34.14 O ATOM 21 H GLU A 173 0.511 16.686 77.187 1.00 0.00 H ATOM 22 N LEU A 174 0.583 16.101 80.396 1.00 10.44 N ATOM 23 CA LEU A 174 0.534 15.452 81.699 1.00 9.29 C ATOM 24 C LEU A 174 1.946 15.034 82.135 1.00 7.88 C ATOM 25 O LEU A 174 2.309 15.207 83.295 1.00 8.80 O ATOM 26 CB LEU A 174 -0.435 14.248 81.687 1.00 11.23 C ATOM 27 CG LEU A 174 -0.455 13.429 82.981 1.00 9.08 C ATOM 28 CD1 LEU A 174 -0.956 14.263 84.157 1.00 11.47 C ATOM 29 CD2 LEU A 174 -1.323 12.201 82.814 1.00 10.73 C ATOM 30 H LEU A 174 0.088 15.674 79.587 1.00 0.00 H ATOM 31 N TYR A 175 2.742 14.490 81.224 1.00 7.65 N ATOM 32 CA TYR A 175 4.110 14.105 81.576 1.00 7.37 C ATOM 33 C TYR A 175 4.913 15.331 81.989 1.00 9.57 C ATOM 34 O TYR A 175 5.571 15.347 83.037 1.00 7.07 O ATOM 35 CB TYR A 175 4.831 13.346 80.440 1.00 6.34 C ATOM 36 CG TYR A 175 6.180 12.853 80.912 1.00 10.47 C ATOM 37 CD1 TYR A 175 6.313 11.606 81.520 1.00 11.94 C ATOM 38 CD2 TYR A 175 7.308 13.655 80.816 1.00 15.40 C ATOM 39 CE1 TYR A 175 7.526 11.179 82.011 1.00 11.08 C ATOM 40 CE2 TYR A 175 8.534 13.223 81.294 1.00 14.39 C ATOM 41 CZ TYR A 175 8.635 11.985 81.892 1.00 17.12 C ATOM 42 OH TYR A 175 9.852 11.545 82.377 1.00 19.68 O ATOM 43 HH TYR A 175 9.743 10.643 82.770 1.00 0.00 H ATOM 44 H TYR A 175 2.393 14.336 80.256 1.00 0.00 H ATOM 45 N ARG A 176 4.856 16.370 81.157 1.00 11.13 N ATOM 46 CA ARG A 176 5.643 17.580 81.394 1.00 10.53 C ATOM 47 C ARG A 176 5.294 18.214 82.733 1.00 7.51 C ATOM 48 O ARG A 176 6.176 18.619 83.489 1.00 9.63 O ATOM 49 CB ARG A 176 5.395 18.596 80.265 1.00 13.57 C ATOM 50 CG ARG A 176 6.258 19.874 80.354 1.00 21.63 C ATOM 51 CD ARG A 176 5.553 21.099 79.737 1.00 25.80 C ATOM 52 NE ARG A 176 4.350 21.451 80.490 1.00 33.65 N ATOM 53 CZ ARG A 176 4.355 21.985 81.714 1.00 30.43 C ATOM 54 NH1 ARG A 176 5.502 22.250 82.330 1.00 35.15 N ATOM 55 NH2 ARG A 176 3.212 22.259 82.324 1.00 31.59 N ATOM 56 HE ARG A 176 3.428 21.274 80.042 1.00 0.00 H ATOM 57 HH12 ARG A 176 5.496 22.666 83.283 1.00 0.00 H ATOM 58 HH11 ARG A 176 6.405 22.042 81.859 1.00 0.00 H ATOM 59 HH22 ARG A 176 3.218 22.675 83.277 1.00 0.00 H ATOM 60 HH21 ARG A 176 2.308 22.058 81.850 1.00 0.00 H ATOM 61 H ARG A 176 4.239 16.320 80.321 1.00 0.00 H ATOM 62 N GLN A 177 4.012 18.286 83.030 1.00 8.69 N ATOM 63 CA GLN A 177 3.557 18.901 84.241 1.00 7.76 C ATOM 64 C GLN A 177 3.974 18.052 85.451 1.00 7.94 C ATOM 65 O GLN A 177 4.438 18.572 86.467 1.00 9.03 O ATOM 66 CB GLN A 177 2.048 19.040 84.191 1.00 11.84 C ATOM 67 CG GLN A 177 1.513 19.717 85.394 1.00 11.90 C ATOM 68 CD GLN A 177 0.040 19.972 85.302 1.00 17.11 C ATOM 69 OE1 GLN A 177 -0.702 19.181 84.731 1.00 12.26 O ATOM 70 NE2 GLN A 177 -0.396 21.095 85.858 1.00 16.12 N ATOM 71 HE22 GLN A 177 0.273 21.735 86.332 1.00 0.00 H ATOM 72 HE21 GLN A 177 -1.407 21.336 85.820 1.00 0.00 H ATOM 73 H GLN A 177 3.314 17.887 82.370 1.00 0.00 H ATOM 74 N SER A 178 3.821 16.740 85.325 1.00 9.01 N ATOM 75 CA SER A 178 4.224 15.817 86.393 1.00 6.10 C ATOM 76 C SER A 178 5.703 15.972 86.700 1.00 7.36 C ATOM 77 O SER A 178 6.112 16.019 87.866 1.00 8.64 O ATOM 78 CB SER A 178 3.925 14.362 86.023 1.00 4.96 C ATOM 79 OG SER A 178 2.519 14.189 85.757 1.00 7.95 O ATOM 80 HG SER A 178 2.252 14.775 85.005 1.00 0.00 H ATOM 81 H SER A 178 3.407 16.357 84.451 1.00 0.00 H ATOM 82 N LEU A 179 6.510 16.037 85.654 1.00 6.94 N ATOM 83 CA LEU A 179 7.945 16.090 85.841 1.00 8.19 C ATOM 84 C LEU A 179 8.321 17.377 86.563 1.00 8.05 C ATOM 85 O LEU A 179 9.190 17.382 87.454 1.00 9.49 O ATOM 86 CB LEU A 179 8.670 16.004 84.497 1.00 8.71 C ATOM 87 CG LEU A 179 10.202 16.005 84.578 1.00 12.33 C ATOM 88 CD1 LEU A 179 10.767 14.876 85.451 1.00 18.49 C ATOM 89 CD2 LEU A 179 10.789 15.912 83.161 1.00 14.47 C ATOM 90 H LEU A 179 6.112 16.050 84.693 1.00 0.00 H ATOM 91 N GLU A 180 7.693 18.477 86.168 1.00 7.91 N ATOM 92 CA GLU A 180 7.992 19.765 86.792 1.00 10.07 C ATOM 93 C GLU A 180 7.637 19.783 88.287 1.00 11.95 C ATOM 94 O GLU A 180 8.438 20.226 89.118 1.00 10.87 O ATOM 95 CB GLU A 180 7.305 20.920 86.055 1.00 17.66 C ATOM 96 CG GLU A 180 7.899 22.257 86.441 1.00 20.03 C ATOM 97 CD GLU A 180 7.628 23.334 85.436 1.00 27.45 C ATOM 98 OE1 GLU A 180 6.486 23.413 84.947 1.00 32.05 O ATOM 99 OE2 GLU A 180 8.566 24.102 85.148 1.00 33.88 O ATOM 100 H GLU A 180 6.983 18.423 85.410 1.00 0.00 H ATOM 101 N ILE A 181 6.460 19.285 88.639 1.00 8.01 N ATOM 102 CA ILE A 181 6.032 19.263 90.032 1.00 7.73 C ATOM 103 C ILE A 181 6.938 18.352 90.873 1.00 8.35 C ATOM 104 O ILE A 181 7.398 18.724 91.958 1.00 8.23 O ATOM 105 CB ILE A 181 4.564 18.768 90.113 1.00 9.03 C ATOM 106 CG1 ILE A 181 3.603 19.811 89.547 1.00 10.05 C ATOM 107 CG2 ILE A 181 4.169 18.456 91.533 1.00 8.68 C ATOM 108 CD1 ILE A 181 2.256 19.227 89.167 1.00 8.75 C ATOM 109 H ILE A 181 5.829 18.902 87.906 1.00 0.00 H ATOM 110 N ILE A 182 7.170 17.145 90.385 1.00 6.85 N ATOM 111 CA ILE A 182 7.962 16.161 91.130 1.00 5.96 C ATOM 112 C ILE A 182 9.420 16.615 91.250 1.00 6.82 C ATOM 113 O ILE A 182 10.029 16.525 92.322 1.00 6.03 O ATOM 114 CB ILE A 182 7.817 14.766 90.496 1.00 7.63 C ATOM 115 CG1 ILE A 182 6.398 14.254 90.728 1.00 6.53 C ATOM 116 CG2 ILE A 182 8.813 13.759 91.092 1.00 5.14 C ATOM 117 CD1 ILE A 182 6.040 13.037 89.934 1.00 5.62 C ATOM 118 H ILE A 182 6.783 16.889 89.454 1.00 0.00 H ATOM 119 N SER A 183 9.971 17.132 90.164 1.00 7.32 N ATOM 120 CA SER A 183 11.337 17.609 90.163 1.00 9.05 C ATOM 121 C SER A 183 11.527 18.788 91.118 1.00 7.05 C ATOM 122 O SER A 183 12.510 18.826 91.882 1.00 8.66 O ATOM 123 CB SER A 183 11.731 18.020 88.735 1.00 10.46 C ATOM 124 OG SER A 183 13.016 18.611 88.737 1.00 27.50 O ATOM 125 HG SER A 183 13.260 18.872 87.813 1.00 0.00 H ATOM 126 H SER A 183 9.409 17.197 89.291 1.00 0.00 H ATOM 127 N ARG A 184 10.597 19.737 91.109 1.00 9.33 N ATOM 128 CA ARG A 184 10.685 20.865 92.033 1.00 8.81 C ATOM 129 C ARG A 184 10.599 20.461 93.510 1.00 11.27 C ATOM 130 O ARG A 184 11.387 20.935 94.347 1.00 10.42 O ATOM 131 CB ARG A 184 9.617 21.894 91.723 1.00 11.79 C ATOM 132 CG ARG A 184 9.925 22.617 90.433 1.00 17.71 C ATOM 133 CD ARG A 184 9.232 23.938 90.366 1.00 19.16 C ATOM 134 NE ARG A 184 9.458 24.532 89.053 1.00 19.67 N ATOM 135 CZ ARG A 184 9.599 25.829 88.825 1.00 20.47 C ATOM 136 NH1 ARG A 184 9.545 26.700 89.817 1.00 14.30 N ATOM 137 NH2 ARG A 184 9.810 26.251 87.588 1.00 16.37 N ATOM 138 HE ARG A 184 9.512 23.890 88.236 1.00 0.00 H ATOM 139 HH12 ARG A 184 9.657 27.716 89.624 1.00 0.00 H ATOM 140 HH11 ARG A 184 9.390 26.370 90.791 1.00 0.00 H ATOM 141 HH22 ARG A 184 9.922 27.267 87.397 1.00 0.00 H ATOM 142 HH21 ARG A 184 9.864 25.566 86.807 1.00 0.00 H ATOM 143 H ARG A 184 9.802 19.676 90.441 1.00 0.00 H ATOM 144 N TYR A 185 9.651 19.592 93.844 1.00 8.57 N ATOM 145 CA TYR A 185 9.535 19.124 95.218 1.00 9.50 C ATOM 146 C TYR A 185 10.806 18.401 95.674 1.00 9.93 C ATOM 147 O TYR A 185 11.303 18.662 96.764 1.00 9.27 O ATOM 148 CB TYR A 185 8.311 18.214 95.399 1.00 10.17 C ATOM 149 CG TYR A 185 8.073 17.748 96.821 1.00 9.01 C ATOM 150 CD1 TYR A 185 7.938 18.654 97.863 1.00 12.15 C ATOM 151 CD2 TYR A 185 7.960 16.402 97.116 1.00 8.58 C ATOM 152 CE1 TYR A 185 7.725 18.232 99.158 1.00 10.64 C ATOM 153 CE2 TYR A 185 7.743 15.968 98.415 1.00 7.84 C ATOM 154 CZ TYR A 185 7.614 16.889 99.427 1.00 9.36 C ATOM 155 OH TYR A 185 7.389 16.472 100.733 1.00 10.31 O ATOM 156 HH TYR A 185 7.323 17.263 101.324 1.00 0.00 H ATOM 157 H TYR A 185 8.989 19.245 93.121 1.00 0.00 H ATOM 158 N LEU A 186 11.323 17.480 94.861 1.00 7.93 N ATOM 159 CA LEU A 186 12.521 16.746 95.261 1.00 10.85 C ATOM 160 C LEU A 186 13.704 17.700 95.419 1.00 12.25 C ATOM 161 O LEU A 186 14.498 17.550 96.346 1.00 8.47 O ATOM 162 CB LEU A 186 12.862 15.640 94.279 1.00 7.64 C ATOM 163 CG LEU A 186 12.351 14.245 94.676 1.00 6.20 C ATOM 164 CD1 LEU A 186 10.833 14.217 94.887 1.00 8.58 C ATOM 165 CD2 LEU A 186 12.777 13.212 93.632 1.00 8.46 C ATOM 166 H LEU A 186 10.874 17.284 93.943 1.00 0.00 H ATOM 167 N ARG A 187 13.832 18.670 94.516 1.00 9.93 N ATOM 168 CA ARG A 187 14.928 19.638 94.629 1.00 12.10 C ATOM 169 C ARG A 187 14.793 20.557 95.855 1.00 11.52 C ATOM 170 O ARG A 187 15.799 20.888 96.517 1.00 15.76 O ATOM 171 CB ARG A 187 15.029 20.487 93.354 1.00 15.14 C ATOM 172 CG ARG A 187 15.733 19.807 92.221 1.00 22.64 C ATOM 173 CD ARG A 187 16.028 20.781 91.088 1.00 28.22 C ATOM 174 NE ARG A 187 14.977 20.785 90.076 1.00 40.31 N ATOM 175 CZ ARG A 187 14.057 21.736 89.909 1.00 38.55 C ATOM 176 NH1 ARG A 187 14.014 22.829 90.688 1.00 27.53 N ATOM 177 NH2 ARG A 187 13.162 21.587 88.936 1.00 26.33 N ATOM 178 HE ARG A 187 14.942 19.973 89.427 1.00 0.00 H ATOM 179 HH12 ARG A 187 13.283 23.552 90.530 1.00 0.00 H ATOM 180 HH11 ARG A 187 14.712 22.953 91.449 1.00 0.00 H ATOM 181 HH22 ARG A 187 12.434 22.313 88.784 1.00 0.00 H ATOM 182 HH21 ARG A 187 13.191 20.744 88.328 1.00 0.00 H ATOM 183 H ARG A 187 13.155 18.741 93.730 1.00 0.00 H ATOM 184 N GLU A 188 13.570 20.987 96.151 1.00 12.75 N ATOM 185 CA GLU A 188 13.275 21.823 97.317 1.00 14.88 C ATOM 186 C GLU A 188 13.657 21.095 98.579 1.00 18.38 C ATOM 187 O GLU A 188 14.280 21.638 99.496 1.00 14.56 O ATOM 188 CB GLU A 188 11.776 22.030 97.391 1.00 19.41 C ATOM 189 CG GLU A 188 11.329 23.388 97.631 1.00 28.75 C ATOM 190 CD GLU A 188 9.848 23.482 97.406 1.00 26.25 C ATOM 191 OE1 GLU A 188 9.460 24.244 96.524 1.00 21.22 O ATOM 192 OE2 GLU A 188 9.073 22.788 98.102 1.00 25.77 O ATOM 193 H GLU A 188 12.785 20.717 95.524 1.00 0.00 H ATOM 194 N GLN A 189 13.239 19.844 98.615 1.00 13.37 N ATOM 195 CA GLN A 189 13.413 19.006 99.782 1.00 14.77 C ATOM 196 C GLN A 189 14.893 18.820 100.053 1.00 13.83 C ATOM 197 O GLN A 189 15.334 18.916 101.202 1.00 19.34 O ATOM 198 CB GLN A 189 12.672 17.672 99.587 1.00 10.98 C ATOM 199 CG GLN A 189 11.180 17.806 99.738 1.00 14.10 C ATOM 200 CD GLN A 189 10.740 17.765 101.187 1.00 17.32 C ATOM 201 OE1 GLN A 189 11.022 16.809 101.900 1.00 16.46 O ATOM 202 NE2 GLN A 189 10.068 18.811 101.633 1.00 14.01 N ATOM 203 HE22 GLN A 189 9.850 19.601 100.992 1.00 0.00 H ATOM 204 HE21 GLN A 189 9.757 18.845 102.625 1.00 0.00 H ATOM 205 H GLN A 189 12.769 19.447 97.777 1.00 0.00 H ATOM 206 N ALA A 190 15.665 18.600 98.996 1.00 15.45 N ATOM 207 CA ALA A 190 17.100 18.382 99.121 1.00 18.77 C ATOM 208 C ALA A 190 17.843 19.645 99.520 1.00 24.53 C ATOM 209 O ALA A 190 18.711 19.602 100.396 1.00 26.95 O ATOM 210 CB ALA A 190 17.670 17.852 97.815 1.00 16.69 C ATOM 211 H ALA A 190 15.233 18.583 98.050 1.00 0.00 H ATOM 212 N THR A 191 17.514 20.763 98.881 1.00 19.84 N ATOM 213 CA THR A 191 18.310 21.985 99.042 1.00 20.23 C ATOM 214 C THR A 191 17.792 22.968 100.083 1.00 22.59 C ATOM 215 O THR A 191 18.546 23.832 100.552 1.00 23.20 O ATOM 216 CB THR A 191 18.419 22.750 97.716 1.00 23.26 C ATOM 217 OG1 THR A 191 17.159 23.364 97.405 1.00 22.69 O ATOM 218 CG2 THR A 191 18.846 21.810 96.599 1.00 22.48 C ATOM 219 HG1 THR A 191 16.463 22.664 97.324 1.00 0.00 H ATOM 220 H THR A 191 16.681 20.772 98.258 1.00 0.00 H ATOM 221 N GLY A 192 16.516 22.853 100.435 1.00 20.10 N ATOM 222 CA GLY A 192 15.883 23.745 101.392 1.00 17.28 C ATOM 223 C GLY A 192 15.540 25.139 100.893 1.00 19.69 C ATOM 224 O GLY A 192 15.239 26.031 101.683 1.00 21.15 O ATOM 225 H GLY A 192 15.947 22.094 100.008 1.00 0.00 H ATOM 226 N ALA A 193 15.555 25.325 99.580 1.00 21.79 N ATOM 227 CA ALA A 193 15.259 26.622 98.995 1.00 17.61 C ATOM 228 C ALA A 193 14.236 26.453 97.893 1.00 21.16 C ATOM 229 O ALA A 193 14.215 25.422 97.223 1.00 20.71 O ATOM 230 CB ALA A 193 16.520 27.242 98.438 1.00 24.37 C ATOM 231 H ALA A 193 15.784 24.525 98.955 1.00 0.00 H ATOM 232 N LYS A 194 13.397 27.465 97.724 1.00 19.79 N ATOM 233 CA LYS A 194 12.374 27.455 96.697 1.00 27.21 C ATOM 234 C LYS A 194 12.983 27.881 95.366 1.00 23.44 C ATOM 235 O LYS A 194 13.843 28.747 95.320 1.00 22.59 O ATOM 236 CB LYS A 194 11.249 28.402 97.095 1.00 29.35 C ATOM 237 CG LYS A 194 10.074 28.419 96.144 1.00 32.72 C ATOM 238 CD LYS A 194 8.956 29.327 96.658 1.00 41.16 C ATOM 239 CE LYS A 194 8.516 28.929 98.059 1.00 49.88 C ATOM 240 NZ LYS A 194 7.294 29.659 98.497 1.00 62.32 N ATOM 241 HZ1 LYS A 194 7.484 30.682 98.497 1.00 0.00 H ATOM 242 HZ2 LYS A 194 6.513 29.450 97.842 1.00 0.00 H ATOM 243 HZ3 LYS A 194 7.034 29.353 99.457 1.00 0.00 H ATOM 244 H LYS A 194 13.475 28.293 98.348 1.00 0.00 H ATOM 245 N ASP A 195 12.555 27.240 94.289 1.00 16.51 N ATOM 246 CA ASP A 195 12.932 27.657 92.937 1.00 16.63 C ATOM 247 C ASP A 195 11.998 28.781 92.522 1.00 17.30 C ATOM 248 O ASP A 195 10.782 28.606 92.497 1.00 15.28 O ATOM 249 CB ASP A 195 12.806 26.468 91.992 1.00 15.69 C ATOM 250 CG ASP A 195 13.339 26.754 90.606 1.00 18.14 C ATOM 251 OD1 ASP A 195 13.557 27.938 90.262 1.00 16.99 O ATOM 252 OD2 ASP A 195 13.515 25.773 89.859 1.00 19.89 O ATOM 253 H ASP A 195 11.932 26.415 94.407 1.00 0.00 H ATOM 254 N THR A 196 12.572 29.940 92.213 1.00 16.92 N ATOM 255 CA THR A 196 11.795 31.131 91.891 1.00 21.61 C ATOM 256 C THR A 196 11.462 31.265 90.403 1.00 16.62 C ATOM 257 O THR A 196 10.794 32.208 89.992 1.00 21.83 O ATOM 258 CB THR A 196 12.541 32.426 92.322 1.00 26.72 C ATOM 259 OG1 THR A 196 11.960 33.546 91.653 1.00 37.89 O ATOM 260 CG2 THR A 196 13.997 32.361 91.964 1.00 25.09 C ATOM 261 HG1 THR A 196 12.043 33.424 90.674 1.00 0.00 H ATOM 262 H THR A 196 13.610 29.999 92.201 1.00 0.00 H ATOM 263 N LYS A 197 11.900 30.331 89.581 1.00 14.02 N ATOM 264 CA LYS A 197 11.575 30.449 88.184 1.00 15.65 C ATOM 265 C LYS A 197 10.126 30.075 87.948 1.00 14.12 C ATOM 266 O LYS A 197 9.556 29.257 88.671 1.00 14.69 O ATOM 267 CB LYS A 197 12.528 29.645 87.313 1.00 20.18 C ATOM 268 CG LYS A 197 12.462 28.157 87.445 1.00 24.85 C ATOM 269 CD LYS A 197 13.810 27.527 87.044 1.00 30.64 C ATOM 270 CE LYS A 197 14.787 28.544 86.430 1.00 27.93 C ATOM 271 NZ LYS A 197 16.025 27.897 85.918 1.00 34.30 N ATOM 272 HZ1 LYS A 197 16.511 27.413 86.700 1.00 0.00 H ATOM 273 HZ2 LYS A 197 15.775 27.205 85.183 1.00 0.00 H ATOM 274 HZ3 LYS A 197 16.652 28.622 85.514 1.00 0.00 H ATOM 275 H LYS A 197 12.465 29.531 89.933 1.00 0.00 H ATOM 276 N PRO A 198 9.508 30.719 86.966 1.00 12.69 N ATOM 277 CA PRO A 198 8.113 30.426 86.641 1.00 11.67 C ATOM 278 C PRO A 198 7.917 28.976 86.234 1.00 14.67 C ATOM 279 O PRO A 198 8.821 28.320 85.722 1.00 12.37 O ATOM 280 CB PRO A 198 7.834 31.328 85.437 1.00 17.45 C ATOM 281 CG PRO A 198 8.891 32.362 85.457 1.00 15.30 C ATOM 282 CD PRO A 198 10.068 31.786 86.112 1.00 14.86 C ATOM 283 N MET A 199 6.712 28.475 86.461 1.00 18.29 N ATOM 284 CA MET A 199 6.335 27.179 85.942 1.00 15.77 C ATOM 285 C MET A 199 6.086 27.290 84.449 1.00 25.41 C ATOM 286 O MET A 199 5.997 28.389 83.893 1.00 25.27 O ATOM 287 CB MET A 199 5.055 26.703 86.622 1.00 20.51 C ATOM 288 CG MET A 199 5.203 26.530 88.103 1.00 23.98 C ATOM 289 SD MET A 199 6.043 24.993 88.464 1.00 26.32 S ATOM 290 CE MET A 199 5.607 24.857 90.196 1.00 24.34 C ATOM 291 H MET A 199 6.027 29.022 87.021 1.00 0.00 H ATOM 292 N GLY A 200 5.966 26.152 83.793 1.00 29.45 N ATOM 293 CA GLY A 200 5.659 26.154 82.376 1.00 35.04 C ATOM 294 C GLY A 200 4.176 26.352 82.129 1.00 29.00 C ATOM 295 O GLY A 200 3.515 27.207 82.737 1.00 31.05 O ATOM 296 H GLY A 200 6.092 25.250 84.294 1.00 0.00 H ATOM 297 N ARG A 201 3.653 25.552 81.214 1.00 36.94 N ATOM 298 CA ARG A 201 2.235 25.520 80.934 1.00 34.53 C ATOM 299 C ARG A 201 1.501 25.202 82.232 1.00 31.95 C ATOM 300 O ARG A 201 2.087 24.639 83.162 1.00 36.48 O ATOM 301 CB ARG A 201 1.952 24.431 79.894 1.00 42.96 C ATOM 302 CG ARG A 201 0.852 24.745 78.888 1.00 44.73 C ATOM 303 CD ARG A 201 1.318 24.420 77.463 1.00 45.33 C ATOM 304 NE ARG A 201 2.414 25.306 77.064 1.00 50.73 N ATOM 305 CZ ARG A 201 3.696 24.957 76.960 1.00 49.01 C ATOM 306 NH1 ARG A 201 4.587 25.871 76.604 1.00 43.22 N ATOM 307 NH2 ARG A 201 4.101 23.713 77.197 1.00 48.94 N ATOM 308 HE ARG A 201 2.171 26.293 76.843 1.00 0.00 H ATOM 309 HH12 ARG A 201 5.591 25.613 76.519 1.00 0.00 H ATOM 310 HH11 ARG A 201 4.282 26.846 76.410 1.00 0.00 H ATOM 311 HH22 ARG A 201 5.108 23.468 77.108 1.00 0.00 H ATOM 312 HH21 ARG A 201 3.411 22.985 77.471 1.00 0.00 H ATOM 313 H ARG A 201 4.284 24.924 80.677 1.00 0.00 H ATOM 314 N SER A 202 0.230 25.579 82.290 1.00 27.95 N ATOM 315 CA SER A 202 -0.625 25.266 83.436 1.00 28.62 C ATOM 316 C SER A 202 0.015 25.644 84.767 1.00 22.78 C ATOM 317 O SER A 202 -0.143 24.929 85.754 1.00 19.14 O ATOM 318 CB SER A 202 -0.948 23.773 83.462 1.00 26.96 C ATOM 319 OG SER A 202 -1.415 23.331 82.204 1.00 33.81 O ATOM 320 HG SER A 202 -1.616 22.363 82.250 1.00 0.00 H ATOM 321 H SER A 202 -0.172 26.115 81.494 1.00 0.00 H ATOM 322 N GLY A 203 0.703 26.781 84.791 1.00 20.59 N ATOM 323 CA GLY A 203 1.421 27.223 85.968 1.00 23.09 C ATOM 324 C GLY A 203 0.608 27.309 87.248 1.00 22.33 C ATOM 325 O GLY A 203 1.124 26.992 88.319 1.00 21.47 O ATOM 326 H GLY A 203 0.726 27.373 83.936 1.00 0.00 H ATOM 327 N ALA A 204 -0.636 27.773 87.160 1.00 18.69 N ATOM 328 CA ALA A 204 -1.459 27.965 88.355 1.00 18.05 C ATOM 329 C ALA A 204 -1.730 26.636 89.051 1.00 19.78 C ATOM 330 O ALA A 204 -1.638 26.530 90.278 1.00 18.35 O ATOM 331 CB ALA A 204 -2.760 28.664 88.002 1.00 24.73 C ATOM 332 H ALA A 204 -1.030 28.003 86.226 1.00 0.00 H ATOM 333 N THR A 205 -2.081 25.627 88.266 1.00 19.35 N ATOM 334 CA THR A 205 -2.333 24.294 88.821 1.00 17.13 C ATOM 335 C THR A 205 -1.048 23.656 89.336 1.00 17.95 C ATOM 336 O THR A 205 -1.045 23.055 90.410 1.00 14.64 O ATOM 337 CB THR A 205 -2.997 23.380 87.781 1.00 23.98 C ATOM 338 OG1 THR A 205 -4.323 23.857 87.537 1.00 23.84 O ATOM 339 CG2 THR A 205 -3.067 21.929 88.292 1.00 21.40 C ATOM 340 HG1 THR A 205 -4.763 23.276 86.867 1.00 0.00 H ATOM 341 H THR A 205 -2.179 25.783 87.242 1.00 0.00 H ATOM 342 N SER A 206 0.043 23.794 88.588 1.00 15.54 N ATOM 343 CA SER A 206 1.317 23.228 89.024 1.00 15.59 C ATOM 344 C SER A 206 1.795 23.881 90.318 1.00 16.39 C ATOM 345 O SER A 206 2.361 23.209 91.177 1.00 11.69 O ATOM 346 CB SER A 206 2.387 23.373 87.940 1.00 17.74 C ATOM 347 OG SER A 206 2.012 22.663 86.784 1.00 18.50 O ATOM 348 HG SER A 206 2.713 22.766 86.093 1.00 0.00 H ATOM 349 H SER A 206 -0.011 24.309 87.686 1.00 0.00 H ATOM 350 N ARG A 207 1.587 25.191 90.451 1.00 14.44 N ATOM 351 CA ARG A 207 1.942 25.889 91.687 1.00 17.39 C ATOM 352 C ARG A 207 1.137 25.348 92.866 1.00 15.53 C ATOM 353 O ARG A 207 1.664 25.117 93.951 1.00 13.27 O ATOM 354 CB ARG A 207 1.691 27.404 91.559 1.00 19.77 C ATOM 355 CG ARG A 207 2.725 28.138 90.746 1.00 24.70 C ATOM 356 CD ARG A 207 2.641 29.667 90.907 1.00 31.44 C ATOM 357 NE ARG A 207 1.421 30.250 90.342 1.00 29.95 N ATOM 358 CZ ARG A 207 1.232 30.528 89.052 1.00 28.20 C ATOM 359 NH1 ARG A 207 2.171 30.266 88.153 1.00 34.55 N ATOM 360 NH2 ARG A 207 0.086 31.055 88.653 1.00 31.69 N ATOM 361 HE ARG A 207 0.643 30.463 90.998 1.00 0.00 H ATOM 362 HH12 ARG A 207 2.008 30.489 87.150 1.00 0.00 H ATOM 363 HH11 ARG A 207 3.071 29.837 88.451 1.00 0.00 H ATOM 364 HH22 ARG A 207 -0.064 31.273 87.647 1.00 0.00 H ATOM 365 HH21 ARG A 207 -0.665 31.251 89.345 1.00 0.00 H ATOM 366 H ARG A 207 1.166 25.725 89.664 1.00 0.00 H ATOM 367 N LYS A 208 -0.156 25.157 92.662 1.00 14.81 N ATOM 368 CA LYS A 208 -1.006 24.683 93.742 1.00 11.89 C ATOM 369 C LYS A 208 -0.679 23.230 94.059 1.00 11.57 C ATOM 370 O LYS A 208 -0.756 22.806 95.213 1.00 12.43 O ATOM 371 CB LYS A 208 -2.477 24.807 93.375 1.00 16.29 C ATOM 372 CG LYS A 208 -2.956 26.244 93.267 1.00 18.42 C ATOM 373 CD LYS A 208 -4.425 26.314 92.922 1.00 29.59 C ATOM 374 CE LYS A 208 -4.937 27.742 93.005 1.00 41.15 C ATOM 375 NZ LYS A 208 -6.317 27.864 92.471 1.00 42.69 N ATOM 376 HZ1 LYS A 208 -6.329 27.569 91.474 1.00 0.00 H ATOM 377 HZ2 LYS A 208 -6.955 27.255 93.021 1.00 0.00 H ATOM 378 HZ3 LYS A 208 -6.630 28.853 92.545 1.00 0.00 H ATOM 379 H LYS A 208 -0.566 25.347 91.725 1.00 0.00 H ATOM 380 N ALA A 209 -0.351 22.467 93.030 1.00 10.20 N ATOM 381 CA ALA A 209 0.022 21.065 93.251 1.00 11.29 C ATOM 382 C ALA A 209 1.296 20.957 94.075 1.00 12.82 C ATOM 383 O ALA A 209 1.397 20.126 94.971 1.00 12.05 O ATOM 384 CB ALA A 209 0.183 20.340 91.932 1.00 12.43 C ATOM 385 H ALA A 209 -0.357 22.859 92.067 1.00 0.00 H ATOM 386 N LEU A 210 2.289 21.780 93.756 1.00 11.06 N ATOM 387 CA LEU A 210 3.523 21.814 94.532 1.00 9.76 C ATOM 388 C LEU A 210 3.263 22.251 95.970 1.00 11.16 C ATOM 389 O LEU A 210 3.817 21.683 96.938 1.00 10.11 O ATOM 390 CB LEU A 210 4.548 22.734 93.864 1.00 10.13 C ATOM 391 CG LEU A 210 5.882 22.895 94.575 1.00 13.55 C ATOM 392 CD1 LEU A 210 6.543 21.541 94.818 1.00 13.16 C ATOM 393 CD2 LEU A 210 6.789 23.776 93.737 1.00 13.91 C ATOM 394 H LEU A 210 2.184 22.412 92.937 1.00 0.00 H ATOM 395 N GLU A 211 2.395 23.247 96.137 1.00 12.07 N ATOM 396 CA GLU A 211 2.022 23.703 97.472 1.00 13.43 C ATOM 397 C GLU A 211 1.345 22.593 98.285 1.00 15.50 C ATOM 398 O GLU A 211 1.607 22.436 99.474 1.00 12.27 O ATOM 399 CB GLU A 211 1.134 24.953 97.389 1.00 14.85 C ATOM 400 CG GLU A 211 1.894 26.194 96.929 1.00 31.18 C ATOM 401 CD GLU A 211 0.983 27.314 96.417 1.00 36.62 C ATOM 402 OE1 GLU A 211 -0.254 27.200 96.555 1.00 33.76 O ATOM 403 OE2 GLU A 211 1.515 28.307 95.871 1.00 45.16 O ATOM 404 H GLU A 211 1.977 23.707 95.303 1.00 0.00 H ATOM 405 N THR A 212 0.505 21.809 97.621 1.00 8.53 N ATOM 406 CA THR A 212 -0.187 20.686 98.243 1.00 10.13 C ATOM 407 C THR A 212 0.796 19.576 98.616 1.00 13.86 C ATOM 408 O THR A 212 0.750 19.048 99.730 1.00 12.19 O ATOM 409 CB THR A 212 -1.277 20.142 97.302 1.00 10.65 C ATOM 410 OG1 THR A 212 -2.292 21.136 97.111 1.00 14.68 O ATOM 411 CG2 THR A 212 -1.913 18.893 97.842 1.00 9.32 C ATOM 412 HG1 THR A 212 -1.888 21.946 96.711 1.00 0.00 H ATOM 413 H THR A 212 0.333 22.004 96.614 1.00 0.00 H ATOM 414 N LEU A 213 1.693 19.222 97.698 1.00 11.16 N ATOM 415 CA LEU A 213 2.737 18.234 97.968 1.00 15.21 C ATOM 416 C LEU A 213 3.580 18.598 99.161 1.00 16.69 C ATOM 417 O LEU A 213 3.909 17.737 99.979 1.00 20.47 O ATOM 418 CB LEU A 213 3.683 18.102 96.782 1.00 15.50 C ATOM 419 CG LEU A 213 3.543 16.907 95.891 1.00 19.01 C ATOM 420 CD1 LEU A 213 4.643 16.963 94.856 1.00 11.29 C ATOM 421 CD2 LEU A 213 3.590 15.609 96.701 1.00 12.68 C ATOM 422 H LEU A 213 1.650 19.663 96.757 1.00 0.00 H ATOM 423 N ARG A 214 3.986 19.861 99.243 1.00 11.75 N ATOM 424 CA ARG A 214 4.698 20.344 100.412 1.00 21.28 C ATOM 425 C ARG A 214 3.934 20.028 101.675 1.00 20.12 C ATOM 426 O ARG A 214 4.442 19.389 102.585 1.00 23.26 O ATOM 427 CB ARG A 214 4.852 21.851 100.359 1.00 22.93 C ATOM 428 CG ARG A 214 6.026 22.332 99.580 1.00 27.79 C ATOM 429 CD ARG A 214 6.064 23.837 99.645 1.00 32.14 C ATOM 430 NE ARG A 214 6.868 24.359 98.559 1.00 20.63 N ATOM 431 CZ ARG A 214 6.570 25.434 97.841 1.00 26.57 C ATOM 432 NH1 ARG A 214 5.480 26.150 98.102 1.00 33.50 N ATOM 433 NH2 ARG A 214 7.374 25.802 96.865 1.00 26.45 N ATOM 434 HE ARG A 214 7.746 23.853 98.324 1.00 0.00 H ATOM 435 HH12 ARG A 214 5.260 26.990 97.530 1.00 0.00 H ATOM 436 HH11 ARG A 214 4.847 25.870 98.878 1.00 0.00 H ATOM 437 HH22 ARG A 214 7.150 26.643 96.296 1.00 0.00 H ATOM 438 HH21 ARG A 214 8.233 25.251 96.663 1.00 0.00 H ATOM 439 H ARG A 214 3.790 20.513 98.457 1.00 0.00 H ATOM 440 N ARG A 215 2.709 20.517 101.733 1.00 16.88 N ATOM 441 CA ARG A 215 1.900 20.398 102.928 1.00 17.56 C ATOM 442 C ARG A 215 1.708 18.934 103.329 1.00 18.67 C ATOM 443 O ARG A 215 1.860 18.570 104.507 1.00 19.63 O ATOM 444 CB ARG A 215 0.548 21.076 102.694 1.00 16.56 C ATOM 445 CG ARG A 215 -0.446 20.862 103.814 1.00 17.89 C ATOM 446 CD ARG A 215 -1.676 21.774 103.669 1.00 21.72 C ATOM 447 NE ARG A 215 -2.312 21.671 102.349 1.00 22.40 N ATOM 448 CZ ARG A 215 -3.232 20.766 102.019 1.00 25.07 C ATOM 449 NH1 ARG A 215 -3.644 19.851 102.894 1.00 28.75 N ATOM 450 NH2 ARG A 215 -3.734 20.776 100.795 1.00 23.75 N ATOM 451 HE ARG A 215 -2.023 22.354 101.620 1.00 0.00 H ATOM 452 HH12 ARG A 215 -4.363 19.153 102.617 1.00 0.00 H ATOM 453 HH11 ARG A 215 -3.246 19.834 103.855 1.00 0.00 H ATOM 454 HH22 ARG A 215 -4.453 20.076 100.522 1.00 0.00 H ATOM 455 HH21 ARG A 215 -3.410 21.484 100.106 1.00 0.00 H ATOM 456 H ARG A 215 2.315 20.999 100.900 1.00 0.00 H ATOM 457 N VAL A 216 1.375 18.092 102.358 1.00 13.51 N ATOM 458 CA VAL A 216 1.022 16.702 102.643 1.00 10.67 C ATOM 459 C VAL A 216 2.245 15.793 102.720 1.00 15.18 C ATOM 460 O VAL A 216 2.369 14.994 103.648 1.00 12.69 O ATOM 461 CB VAL A 216 0.002 16.155 101.631 1.00 13.07 C ATOM 462 CG1 VAL A 216 -0.378 14.731 101.963 1.00 14.67 C ATOM 463 CG2 VAL A 216 -1.268 17.017 101.637 1.00 18.08 C ATOM 464 H VAL A 216 1.365 18.428 101.374 1.00 0.00 H ATOM 465 N GLY A 217 3.161 15.928 101.768 1.00 10.28 N ATOM 466 CA GLY A 217 4.349 15.090 101.725 1.00 11.12 C ATOM 467 C GLY A 217 5.259 15.199 102.931 1.00 9.73 C ATOM 468 O GLY A 217 5.848 14.200 103.378 1.00 7.28 O ATOM 469 H GLY A 217 3.025 16.652 101.034 1.00 0.00 H ATOM 470 N ASP A 218 5.396 16.406 103.474 1.00 12.20 N ATOM 471 CA ASP A 218 6.227 16.603 104.642 1.00 12.62 C ATOM 472 C ASP A 218 5.667 15.798 105.829 1.00 13.63 C ATOM 473 O ASP A 218 6.415 15.203 106.591 1.00 15.19 O ATOM 474 CB ASP A 218 6.333 18.095 104.993 1.00 20.74 C ATOM 475 CG ASP A 218 7.022 18.926 103.894 1.00 23.19 C ATOM 476 OD1 ASP A 218 7.279 18.409 102.780 1.00 18.74 O ATOM 477 OD2 ASP A 218 7.272 20.124 104.138 1.00 19.69 O ATOM 478 H ASP A 218 4.900 17.218 103.054 1.00 0.00 H ATOM 479 N GLY A 219 4.349 15.741 105.942 1.00 12.78 N ATOM 480 CA GLY A 219 3.716 14.961 106.990 1.00 10.51 C ATOM 481 C GLY A 219 3.886 13.467 106.779 1.00 7.49 C ATOM 482 O GLY A 219 4.129 12.720 107.720 1.00 8.24 O ATOM 483 H GLY A 219 3.756 16.265 105.267 1.00 0.00 H ATOM 484 N VAL A 220 3.803 13.021 105.534 1.00 5.87 N ATOM 485 CA VAL A 220 3.911 11.592 105.207 1.00 5.31 C ATOM 486 C VAL A 220 5.280 11.033 105.601 1.00 6.36 C ATOM 487 O VAL A 220 5.400 9.934 106.166 1.00 6.25 O ATOM 488 CB VAL A 220 3.631 11.385 103.697 1.00 7.31 C ATOM 489 CG1 VAL A 220 4.048 10.009 103.228 1.00 7.58 C ATOM 490 CG2 VAL A 220 2.156 11.639 103.390 1.00 9.25 C ATOM 491 H VAL A 220 3.657 13.704 104.763 1.00 0.00 H ATOM 492 N GLN A 221 6.319 11.807 105.329 1.00 7.10 N ATOM 493 CA GLN A 221 7.672 11.411 105.662 1.00 5.11 C ATOM 494 C GLN A 221 7.862 11.213 107.158 1.00 6.05 C ATOM 495 O GLN A 221 8.705 10.409 107.583 1.00 8.94 O ATOM 496 CB GLN A 221 8.658 12.457 105.139 1.00 8.04 C ATOM 497 CG GLN A 221 8.699 12.559 103.606 1.00 9.38 C ATOM 498 CD GLN A 221 9.756 13.535 103.105 1.00 11.21 C ATOM 499 OE1 GLN A 221 10.944 13.354 103.373 1.00 10.97 O ATOM 500 NE2 GLN A 221 9.323 14.593 102.402 1.00 8.04 N ATOM 501 HE22 GLN A 221 8.309 14.703 102.200 1.00 0.00 H ATOM 502 HE21 GLN A 221 10.002 15.303 102.059 1.00 0.00 H ATOM 503 H GLN A 221 6.160 12.723 104.864 1.00 0.00 H ATOM 504 N ARG A 222 7.119 11.979 107.945 1.00 5.53 N ATOM 505 CA ARG A 222 7.210 11.876 109.412 1.00 6.28 C ATOM 506 C ARG A 222 6.292 10.780 109.962 1.00 8.20 C ATOM 507 O ARG A 222 6.695 9.977 110.825 1.00 6.63 O ATOM 508 CB ARG A 222 6.905 13.227 110.031 1.00 7.28 C ATOM 509 CG ARG A 222 7.949 14.328 109.705 1.00 14.42 C ATOM 510 CD ARG A 222 9.171 14.228 110.626 1.00 18.58 C ATOM 511 NE ARG A 222 10.053 13.102 110.328 1.00 33.80 N ATOM 512 CZ ARG A 222 10.959 12.625 111.181 1.00 33.29 C ATOM 513 NH1 ARG A 222 11.090 13.165 112.395 1.00 39.75 N ATOM 514 NH2 ARG A 222 11.727 11.600 110.834 1.00 31.76 N ATOM 515 HE ARG A 222 9.969 12.647 109.397 1.00 0.00 H ATOM 516 HH12 ARG A 222 11.798 12.790 113.057 1.00 0.00 H ATOM 517 HH11 ARG A 222 10.484 13.961 112.678 1.00 0.00 H ATOM 518 HH22 ARG A 222 12.433 11.230 111.502 1.00 0.00 H ATOM 519 HH21 ARG A 222 11.623 11.167 109.894 1.00 0.00 H ATOM 520 H ARG A 222 6.461 12.664 107.520 1.00 0.00 H ATOM 521 N ASN A 223 5.080 10.697 109.426 1.00 7.24 N ATOM 522 CA ASN A 223 4.162 9.657 109.894 1.00 4.52 C ATOM 523 C ASN A 223 4.687 8.260 109.599 1.00 7.02 C ATOM 524 O ASN A 223 4.385 7.303 110.325 1.00 9.35 O ATOM 525 CB ASN A 223 2.820 9.822 109.209 1.00 4.54 C ATOM 526 CG ASN A 223 1.987 10.901 109.837 1.00 10.01 C ATOM 527 OD1 ASN A 223 1.999 11.088 111.060 1.00 11.65 O ATOM 528 ND2 ASN A 223 1.227 11.607 109.007 1.00 12.41 N ATOM 529 HD22 ASN A 223 1.252 11.412 107.986 1.00 0.00 H ATOM 530 HD21 ASN A 223 0.607 12.355 109.378 1.00 0.00 H ATOM 531 H ASN A 223 4.786 11.363 108.683 1.00 0.00 H ATOM 532 N HIS A 224 5.473 8.134 108.529 1.00 6.73 N ATOM 533 CA HIS A 224 6.074 6.838 108.153 1.00 7.76 C ATOM 534 C HIS A 224 7.588 6.803 108.332 1.00 6.77 C ATOM 535 O HIS A 224 8.299 6.017 107.683 1.00 8.41 O ATOM 536 CB HIS A 224 5.748 6.474 106.709 1.00 5.93 C ATOM 537 CG HIS A 224 4.285 6.366 106.434 1.00 9.14 C ATOM 538 ND1 HIS A 224 3.479 5.437 107.050 1.00 10.87 N ATOM 539 CD2 HIS A 224 3.483 7.066 105.594 1.00 15.61 C ATOM 540 CE1 HIS A 224 2.241 5.565 106.601 1.00 13.85 C ATOM 541 NE2 HIS A 224 2.216 6.551 105.722 1.00 16.74 N ATOM 542 H HIS A 224 5.668 8.971 107.943 1.00 0.00 H ATOM 543 N GLU A 225 8.083 7.610 109.262 1.00 6.43 N ATOM 544 CA GLU A 225 9.513 7.741 109.481 1.00 8.31 C ATOM 545 C GLU A 225 10.217 6.401 109.638 1.00 7.81 C ATOM 546 O GLU A 225 11.221 6.162 109.003 1.00 7.43 O ATOM 547 CB GLU A 225 9.769 8.609 110.709 1.00 13.30 C ATOM 548 CG GLU A 225 11.228 8.586 111.170 1.00 17.05 C ATOM 549 CD GLU A 225 11.445 9.179 112.569 1.00 27.17 C ATOM 550 OE1 GLU A 225 10.979 8.600 113.588 1.00 21.02 O ATOM 551 OE2 GLU A 225 12.105 10.232 112.638 1.00 20.36 O ATOM 552 H GLU A 225 7.429 8.164 109.851 1.00 0.00 H ATOM 553 N THR A 226 9.725 5.543 110.536 1.00 12.23 N ATOM 554 CA THR A 226 10.379 4.262 110.787 1.00 13.47 C ATOM 555 C THR A 226 10.453 3.391 109.535 1.00 12.43 C ATOM 556 O THR A 226 11.517 2.876 109.202 1.00 11.28 O ATOM 557 CB THR A 226 9.681 3.488 111.930 1.00 13.05 C ATOM 558 OG1 THR A 226 9.621 4.327 113.093 1.00 15.25 O ATOM 559 CG2 THR A 226 10.443 2.200 112.273 1.00 14.59 C ATOM 560 HG1 THR A 226 9.175 3.837 113.829 1.00 0.00 H ATOM 561 H THR A 226 8.864 5.791 111.064 1.00 0.00 H ATOM 562 N ALA A 227 9.334 3.243 108.839 1.00 9.56 N ATOM 563 CA ALA A 227 9.296 2.477 107.597 1.00 8.05 C ATOM 564 C ALA A 227 10.183 3.079 106.504 1.00 7.15 C ATOM 565 O ALA A 227 10.831 2.340 105.747 1.00 8.77 O ATOM 566 CB ALA A 227 7.878 2.342 107.097 1.00 9.15 C ATOM 567 H ALA A 227 8.459 3.685 109.188 1.00 0.00 H ATOM 568 N PHE A 228 10.185 4.404 106.399 1.00 5.93 N ATOM 569 CA PHE A 228 10.981 5.087 105.382 1.00 5.02 C ATOM 570 C PHE A 228 12.464 4.828 105.663 1.00 10.66 C ATOM 571 O PHE A 228 13.219 4.462 104.762 1.00 10.21 O ATOM 572 CB PHE A 228 10.694 6.602 105.326 1.00 6.00 C ATOM 573 CG PHE A 228 9.518 6.994 104.442 1.00 5.63 C ATOM 574 CD1 PHE A 228 8.466 6.141 104.240 1.00 6.07 C ATOM 575 CD2 PHE A 228 9.493 8.239 103.825 1.00 7.96 C ATOM 576 CE1 PHE A 228 7.395 6.489 103.414 1.00 4.51 C ATOM 577 CE2 PHE A 228 8.446 8.594 103.006 1.00 6.12 C ATOM 578 CZ PHE A 228 7.402 7.725 102.798 1.00 7.25 C ATOM 579 H PHE A 228 9.607 4.967 107.055 1.00 0.00 H ATOM 580 N GLN A 229 12.865 5.000 106.914 1.00 8.87 N ATOM 581 CA GLN A 229 14.254 4.754 107.290 1.00 11.33 C ATOM 582 C GLN A 229 14.621 3.296 106.986 1.00 12.83 C ATOM 583 O GLN A 229 15.708 3.022 106.472 1.00 13.56 O ATOM 584 CB GLN A 229 14.466 5.068 108.777 1.00 10.57 C ATOM 585 CG GLN A 229 14.387 6.551 109.126 1.00 18.44 C ATOM 586 CD GLN A 229 14.447 6.816 110.638 1.00 31.30 C ATOM 587 OE1 GLN A 229 14.322 5.893 111.458 1.00 36.23 O ATOM 588 NE2 GLN A 229 14.638 8.088 111.008 1.00 24.86 N ATOM 589 HE22 GLN A 229 14.738 8.830 110.286 1.00 0.00 H ATOM 590 HE21 GLN A 229 14.687 8.334 112.017 1.00 0.00 H ATOM 591 H GLN A 229 12.184 5.313 107.635 1.00 0.00 H ATOM 592 N GLY A 230 13.720 2.367 107.311 1.00 11.36 N ATOM 593 CA GLY A 230 13.965 0.942 107.120 1.00 12.46 C ATOM 594 C GLY A 230 14.168 0.592 105.660 1.00 18.71 C ATOM 595 O GLY A 230 15.103 -0.119 105.290 1.00 16.27 O ATOM 596 H GLY A 230 12.811 2.670 107.715 1.00 0.00 H ATOM 597 N MET A 231 13.296 1.112 104.810 1.00 13.79 N ATOM 598 CA MET A 231 13.431 0.873 103.380 1.00 10.81 C ATOM 599 C MET A 231 14.702 1.499 102.777 1.00 12.53 C ATOM 600 O MET A 231 15.351 0.879 101.941 1.00 19.10 O ATOM 601 CB MET A 231 12.177 1.360 102.627 1.00 11.86 C ATOM 602 CG MET A 231 12.220 1.162 101.094 1.00 11.12 C ATOM 603 SD MET A 231 12.366 -0.568 100.568 1.00 15.48 S ATOM 604 CE MET A 231 10.737 -1.165 100.951 1.00 16.56 C ATOM 605 H MET A 231 12.511 1.694 105.165 1.00 0.00 H ATOM 606 N LEU A 232 15.036 2.721 103.184 1.00 12.54 N ATOM 607 CA LEU A 232 16.240 3.401 102.713 1.00 12.04 C ATOM 608 C LEU A 232 17.459 2.554 103.072 1.00 15.60 C ATOM 609 O LEU A 232 18.318 2.290 102.238 1.00 18.18 O ATOM 610 CB LEU A 232 16.358 4.810 103.320 1.00 14.31 C ATOM 611 CG LEU A 232 17.538 5.650 102.806 1.00 17.41 C ATOM 612 CD1 LEU A 232 17.435 5.901 101.289 1.00 17.78 C ATOM 613 CD2 LEU A 232 17.655 6.963 103.548 1.00 16.48 C ATOM 614 H LEU A 232 14.417 3.210 103.862 1.00 0.00 H ATOM 615 N ARG A 233 17.510 2.084 104.307 1.00 17.64 N ATOM 616 CA ARG A 233 18.621 1.238 104.719 1.00 22.87 C ATOM 617 C ARG A 233 18.712 -0.021 103.857 1.00 22.80 C ATOM 618 O ARG A 233 19.798 -0.386 103.402 1.00 28.01 O ATOM 619 CB ARG A 233 18.504 0.856 106.196 1.00 20.65 C ATOM 620 CG ARG A 233 19.625 -0.073 106.617 1.00 36.17 C ATOM 621 CD ARG A 233 19.849 -0.080 108.110 1.00 34.48 C ATOM 622 NE ARG A 233 21.003 -0.913 108.434 1.00 39.50 N ATOM 623 CZ ARG A 233 20.957 -2.237 108.547 1.00 43.55 C ATOM 624 NH1 ARG A 233 19.812 -2.888 108.376 1.00 45.83 N ATOM 625 NH2 ARG A 233 22.060 -2.913 108.827 1.00 40.01 N ATOM 626 HE ARG A 233 21.918 -0.442 108.586 1.00 0.00 H ATOM 627 HH12 ARG A 233 19.784 -3.924 108.466 1.00 0.00 H ATOM 628 HH11 ARG A 233 18.943 -2.362 108.152 1.00 0.00 H ATOM 629 HH22 ARG A 233 22.027 -3.949 108.916 1.00 0.00 H ATOM 630 HH21 ARG A 233 22.960 -2.408 108.958 1.00 0.00 H ATOM 631 H ARG A 233 16.756 2.319 104.984 1.00 0.00 H ATOM 632 N LYS A 234 17.573 -0.664 103.628 1.00 21.14 N ATOM 633 CA LYS A 234 17.486 -1.890 102.841 1.00 21.71 C ATOM 634 C LYS A 234 17.961 -1.685 101.392 1.00 24.21 C ATOM 635 O LYS A 234 18.655 -2.534 100.833 1.00 28.71 O ATOM 636 CB LYS A 234 16.053 -2.413 102.867 1.00 29.18 C ATOM 637 CG LYS A 234 15.860 -3.743 102.181 1.00 33.71 C ATOM 638 CD LYS A 234 14.417 -4.224 102.284 1.00 47.92 C ATOM 639 CE LYS A 234 14.239 -5.601 101.647 1.00 53.82 C ATOM 640 NZ LYS A 234 12.845 -6.120 101.783 1.00 56.70 N ATOM 641 HZ1 LYS A 234 12.603 -6.200 102.791 1.00 0.00 H ATOM 642 HZ2 LYS A 234 12.185 -5.464 101.318 1.00 0.00 H ATOM 643 HZ3 LYS A 234 12.780 -7.056 101.334 1.00 0.00 H ATOM 644 H LYS A 234 16.697 -0.274 104.030 1.00 0.00 H ATOM 645 N LEU A 235 17.605 -0.551 100.798 1.00 18.11 N ATOM 646 CA LEU A 235 17.997 -0.235 99.415 1.00 19.71 C ATOM 647 C LEU A 235 19.502 0.035 99.241 1.00 27.04 C ATOM 648 O LEU A 235 20.065 -0.214 98.165 1.00 24.04 O ATOM 649 CB LEU A 235 17.198 0.974 98.902 1.00 17.65 C ATOM 650 CG LEU A 235 15.690 0.751 98.720 1.00 12.28 C ATOM 651 CD1 LEU A 235 14.965 2.080 98.509 1.00 10.05 C ATOM 652 CD2 LEU A 235 15.427 -0.176 97.558 1.00 15.78 C ATOM 653 H LEU A 235 17.031 0.136 101.328 1.00 0.00 H ATOM 654 N ASP A 236 20.133 0.569 100.283 1.00 27.45 N ATOM 655 CA ASP A 236 21.566 0.898 100.270 1.00 30.07 C ATOM 656 C ASP A 236 22.019 1.710 99.056 1.00 27.25 C ATOM 657 O ASP A 236 22.772 1.219 98.214 1.00 33.96 O ATOM 658 CB ASP A 236 22.406 -0.374 100.355 1.00 30.44 C ATOM 659 CG ASP A 236 23.858 -0.081 100.675 1.00 36.70 C ATOM 660 OD1 ASP A 236 24.103 0.887 101.427 1.00 40.26 O ATOM 661 OD2 ASP A 236 24.749 -0.801 100.174 1.00 39.20 O ATOM 662 H ASP A 236 19.588 0.763 101.147 1.00 0.00 H ATOM 663 N ILE A 237 21.588 2.963 98.979 1.00 24.76 N ATOM 664 CA ILE A 237 21.856 3.790 97.808 1.00 22.44 C ATOM 665 C ILE A 237 23.164 4.562 97.954 1.00 28.92 C ATOM 666 O ILE A 237 23.350 5.335 98.906 1.00 24.20 O ATOM 667 CB ILE A 237 20.688 4.756 97.563 1.00 23.90 C ATOM 668 CG1 ILE A 237 19.388 3.958 97.450 1.00 17.47 C ATOM 669 CG2 ILE A 237 20.934 5.579 96.315 1.00 25.11 C ATOM 670 CD1 ILE A 237 18.149 4.785 97.678 1.00 17.60 C ATOM 671 H ILE A 237 21.047 3.364 99.772 1.00 0.00 H ATOM 672 N LYS A 238 24.065 4.342 96.997 1.00 33.45 N ATOM 673 CA LYS A 238 25.434 4.848 97.080 1.00 33.86 C ATOM 674 C LYS A 238 25.840 5.712 95.892 1.00 33.74 C ATOM 675 O LYS A 238 26.697 6.587 96.016 1.00 34.54 O ATOM 676 CB LYS A 238 26.407 3.668 97.195 1.00 34.29 C ATOM 677 CG LYS A 238 26.314 2.946 98.525 1.00 26.51 C ATOM 678 CD LYS A 238 26.959 1.571 98.484 1.00 30.80 C ATOM 679 CE LYS A 238 26.213 0.623 97.553 1.00 40.47 C ATOM 680 NZ LYS A 238 26.641 -0.794 97.736 1.00 45.34 N ATOM 681 HZ1 LYS A 238 27.658 -0.876 97.536 1.00 0.00 H ATOM 682 HZ2 LYS A 238 26.454 -1.087 98.716 1.00 0.00 H ATOM 683 HZ3 LYS A 238 26.108 -1.403 97.083 1.00 0.00 H ATOM 684 H LYS A 238 23.784 3.791 96.161 1.00 0.00 H ATOM 685 N ASN A 239 25.218 5.486 94.744 1.00 34.64 N ATOM 686 CA ASN A 239 25.740 6.039 93.505 1.00 36.02 C ATOM 687 C ASN A 239 24.697 5.992 92.399 1.00 39.23 C ATOM 688 O ASN A 239 23.555 5.598 92.631 1.00 29.93 O ATOM 689 CB ASN A 239 26.952 5.219 93.101 1.00 41.89 C ATOM 690 CG ASN A 239 26.614 3.758 92.947 1.00 40.43 C ATOM 691 OD1 ASN A 239 25.632 3.413 92.286 1.00 37.75 O ATOM 692 ND2 ASN A 239 27.402 2.890 93.574 1.00 32.77 N ATOM 693 HD22 ASN A 239 28.219 3.230 94.120 1.00 0.00 H ATOM 694 HD21 ASN A 239 27.201 1.871 93.519 1.00 0.00 H ATOM 695 H ASN A 239 24.352 4.910 94.729 1.00 0.00 H ATOM 696 N GLU A 240 25.086 6.379 91.191 1.00 37.37 N ATOM 697 CA GLU A 240 24.124 6.453 90.100 1.00 32.17 C ATOM 698 C GLU A 240 23.576 5.078 89.693 1.00 32.24 C ATOM 699 O GLU A 240 22.445 4.986 89.220 1.00 27.17 O ATOM 700 CB GLU A 240 24.720 7.179 88.895 1.00 34.10 C ATOM 701 CG GLU A 240 25.838 6.449 88.202 1.00 44.86 C ATOM 702 CD GLU A 240 26.140 7.044 86.846 1.00 47.64 C ATOM 703 OE1 GLU A 240 26.958 6.453 86.113 1.00 55.59 O ATOM 704 OE2 GLU A 240 25.556 8.100 86.510 1.00 47.02 O ATOM 705 H GLU A 240 26.081 6.630 91.023 1.00 0.00 H ATOM 706 N ASP A 241 24.353 4.015 89.889 1.00 33.19 N ATOM 707 CA ASP A 241 23.902 2.676 89.510 1.00 33.36 C ATOM 708 C ASP A 241 22.763 2.179 90.401 1.00 32.98 C ATOM 709 O ASP A 241 21.793 1.601 89.903 1.00 23.61 O ATOM 710 CB ASP A 241 25.052 1.671 89.539 1.00 35.95 C ATOM 711 CG ASP A 241 25.849 1.649 88.240 1.00 52.26 C ATOM 712 OD1 ASP A 241 25.333 2.114 87.194 1.00 43.85 O ATOM 713 OD2 ASP A 241 26.998 1.156 88.267 1.00 53.28 O ATOM 714 H ASP A 241 25.293 4.138 90.317 1.00 0.00 H ATOM 715 N ASP A 242 22.891 2.395 91.710 1.00 28.06 N ATOM 716 CA ASP A 242 21.833 2.044 92.657 1.00 24.21 C ATOM 717 C ASP A 242 20.575 2.851 92.369 1.00 21.85 C ATOM 718 O ASP A 242 19.463 2.328 92.422 1.00 24.20 O ATOM 719 CB ASP A 242 22.282 2.328 94.090 1.00 25.14 C ATOM 720 CG ASP A 242 23.480 1.489 94.509 1.00 36.41 C ATOM 721 OD1 ASP A 242 23.598 0.330 94.054 1.00 32.42 O ATOM 722 OD2 ASP A 242 24.291 1.997 95.312 1.00 33.52 O ATOM 723 H ASP A 242 23.768 2.825 92.068 1.00 0.00 H ATOM 724 N VAL A 243 20.757 4.127 92.070 1.00 19.22 N ATOM 725 CA VAL A 243 19.630 5.020 91.829 1.00 21.25 C ATOM 726 C VAL A 243 18.874 4.570 90.577 1.00 19.99 C ATOM 727 O VAL A 243 17.635 4.571 90.541 1.00 18.71 O ATOM 728 CB VAL A 243 20.100 6.482 91.708 1.00 20.94 C ATOM 729 CG1 VAL A 243 18.966 7.391 91.284 1.00 19.56 C ATOM 730 CG2 VAL A 243 20.694 6.944 93.038 1.00 25.11 C ATOM 731 H VAL A 243 21.725 4.501 92.005 1.00 0.00 H ATOM 732 N LYS A 244 19.620 4.133 89.565 1.00 19.35 N ATOM 733 CA LYS A 244 19.020 3.616 88.344 1.00 17.80 C ATOM 734 C LYS A 244 18.192 2.356 88.600 1.00 18.32 C ATOM 735 O LYS A 244 17.158 2.139 87.973 1.00 17.44 O ATOM 736 CB LYS A 244 20.115 3.321 87.318 1.00 19.02 C ATOM 737 CG LYS A 244 20.651 4.561 86.634 1.00 30.07 C ATOM 738 CD LYS A 244 21.623 4.210 85.498 1.00 29.92 C ATOM 739 CE LYS A 244 22.208 5.470 84.866 1.00 40.54 C ATOM 740 NZ LYS A 244 23.075 5.173 83.689 1.00 58.61 N ATOM 741 HZ1 LYS A 244 23.867 4.568 83.987 1.00 0.00 H ATOM 742 HZ2 LYS A 244 22.515 4.682 82.963 1.00 0.00 H ATOM 743 HZ3 LYS A 244 23.445 6.063 83.299 1.00 0.00 H ATOM 744 H LYS A 244 20.656 4.162 89.649 1.00 0.00 H ATOM 745 N SER A 245 18.642 1.541 89.543 1.00 20.04 N ATOM 746 CA SER A 245 17.962 0.296 89.885 1.00 20.65 C ATOM 747 C SER A 245 16.590 0.515 90.549 1.00 19.20 C ATOM 748 O SER A 245 15.828 -0.435 90.722 1.00 18.98 O ATOM 749 CB SER A 245 18.823 -0.518 90.845 1.00 26.52 C ATOM 750 OG SER A 245 18.873 0.107 92.116 1.00 32.45 O ATOM 751 HG SER A 245 19.262 1.012 92.022 1.00 0.00 H ATOM 752 H SER A 245 19.509 1.797 90.057 1.00 0.00 H ATOM 753 N LEU A 246 16.283 1.753 90.927 1.00 17.93 N ATOM 754 CA LEU A 246 15.082 2.000 91.736 1.00 13.88 C ATOM 755 C LEU A 246 13.806 1.923 90.908 1.00 11.63 C ATOM 756 O LEU A 246 12.731 1.622 91.438 1.00 9.85 O ATOM 757 CB LEU A 246 15.181 3.349 92.462 1.00 9.55 C ATOM 758 CG LEU A 246 16.282 3.454 93.518 1.00 11.34 C ATOM 759 CD1 LEU A 246 16.390 4.877 94.073 1.00 11.49 C ATOM 760 CD2 LEU A 246 16.057 2.455 94.640 1.00 16.58 C ATOM 761 H LEU A 246 16.894 2.547 90.649 1.00 0.00 H ATOM 762 N SER A 247 13.898 2.191 89.612 1.00 12.07 N ATOM 763 CA SER A 247 12.715 2.089 88.773 1.00 11.28 C ATOM 764 C SER A 247 12.050 0.712 88.852 1.00 8.77 C ATOM 765 O SER A 247 10.818 0.605 88.954 1.00 8.54 O ATOM 766 CB SER A 247 13.052 2.434 87.321 1.00 22.00 C ATOM 767 OG SER A 247 13.601 3.738 87.262 1.00 28.85 O ATOM 768 HG SER A 247 14.425 3.773 87.810 1.00 0.00 H ATOM 769 H SER A 247 14.810 2.472 89.199 1.00 0.00 H ATOM 770 N ARG A 248 12.856 -0.342 88.842 1.00 10.69 N ATOM 771 CA ARG A 248 12.316 -1.699 88.934 1.00 12.37 C ATOM 772 C ARG A 248 11.591 -1.938 90.261 1.00 8.08 C ATOM 773 O ARG A 248 10.572 -2.628 90.309 1.00 9.19 O ATOM 774 CB ARG A 248 13.436 -2.735 88.772 1.00 15.23 C ATOM 775 CG ARG A 248 12.950 -4.166 88.914 1.00 23.77 C ATOM 776 CD ARG A 248 14.060 -5.213 88.716 1.00 35.45 C ATOM 777 NE ARG A 248 13.488 -6.558 88.659 1.00 39.50 N ATOM 778 CZ ARG A 248 14.148 -7.683 88.930 1.00 51.44 C ATOM 779 NH1 ARG A 248 15.431 -7.656 89.286 1.00 45.81 N ATOM 780 NH2 ARG A 248 13.512 -8.847 88.844 1.00 46.84 N ATOM 781 HE ARG A 248 12.488 -6.643 88.386 1.00 0.00 H ATOM 782 HH12 ARG A 248 15.932 -8.543 89.494 1.00 0.00 H ATOM 783 HH11 ARG A 248 15.932 -6.747 89.356 1.00 0.00 H ATOM 784 HH22 ARG A 248 14.017 -9.732 89.053 1.00 0.00 H ATOM 785 HH21 ARG A 248 12.510 -8.873 88.568 1.00 0.00 H ATOM 786 H ARG A 248 13.884 -0.202 88.768 1.00 0.00 H ATOM 787 N VAL A 249 12.129 -1.369 91.334 1.00 8.54 N ATOM 788 CA VAL A 249 11.541 -1.522 92.647 1.00 7.42 C ATOM 789 C VAL A 249 10.256 -0.718 92.725 1.00 8.34 C ATOM 790 O VAL A 249 9.276 -1.183 93.285 1.00 6.22 O ATOM 791 CB VAL A 249 12.496 -1.062 93.762 1.00 12.00 C ATOM 792 CG1 VAL A 249 11.948 -1.461 95.107 1.00 10.29 C ATOM 793 CG2 VAL A 249 13.877 -1.676 93.565 1.00 13.17 C ATOM 794 H VAL A 249 12.993 -0.800 91.228 1.00 0.00 H ATOM 795 N MET A 250 10.239 0.483 92.147 1.00 7.25 N ATOM 796 CA MET A 250 8.997 1.267 92.121 1.00 5.14 C ATOM 797 C MET A 250 7.874 0.577 91.346 1.00 5.77 C ATOM 798 O MET A 250 6.720 0.604 91.754 1.00 5.96 O ATOM 799 CB MET A 250 9.234 2.670 91.532 1.00 6.66 C ATOM 800 CG MET A 250 10.150 3.544 92.385 1.00 6.23 C ATOM 801 SD MET A 250 10.229 5.241 91.759 1.00 13.08 S ATOM 802 CE MET A 250 11.545 5.156 90.571 1.00 12.22 C ATOM 803 H MET A 250 11.104 0.865 91.715 1.00 0.00 H ATOM 804 N ILE A 251 8.186 -0.018 90.202 1.00 5.20 N ATOM 805 CA ILE A 251 7.182 -0.787 89.477 1.00 6.62 C ATOM 806 C ILE A 251 6.638 -1.945 90.313 1.00 6.87 C ATOM 807 O ILE A 251 5.432 -2.163 90.397 1.00 8.47 O ATOM 808 CB ILE A 251 7.800 -1.316 88.153 1.00 11.77 C ATOM 809 CG1 ILE A 251 8.128 -0.140 87.228 1.00 13.37 C ATOM 810 CG2 ILE A 251 6.882 -2.254 87.493 1.00 13.43 C ATOM 811 CD1 ILE A 251 6.911 0.492 86.657 1.00 16.94 C ATOM 812 H ILE A 251 9.150 0.064 89.821 1.00 0.00 H ATOM 813 N HIS A 252 7.539 -2.660 90.976 1.00 6.98 N ATOM 814 CA HIS A 252 7.175 -3.772 91.840 1.00 7.44 C ATOM 815 C HIS A 252 6.255 -3.358 92.988 1.00 6.69 C ATOM 816 O HIS A 252 5.241 -4.015 93.223 1.00 11.12 O ATOM 817 CB HIS A 252 8.462 -4.395 92.397 1.00 8.06 C ATOM 818 CG HIS A 252 8.272 -5.698 93.109 1.00 18.88 C ATOM 819 ND1 HIS A 252 8.768 -6.887 92.618 1.00 26.88 N ATOM 820 CD2 HIS A 252 7.659 -6.000 94.274 1.00 24.23 C ATOM 821 CE1 HIS A 252 8.461 -7.868 93.451 1.00 24.09 C ATOM 822 NE2 HIS A 252 7.789 -7.356 94.465 1.00 19.33 N ATOM 823 H HIS A 252 8.545 -2.415 90.874 1.00 0.00 H ATOM 824 N VAL A 253 6.600 -2.278 93.693 1.00 4.74 N ATOM 825 CA VAL A 253 5.904 -1.916 94.917 1.00 5.46 C ATOM 826 C VAL A 253 4.741 -0.948 94.680 1.00 6.02 C ATOM 827 O VAL A 253 3.628 -1.169 95.195 1.00 7.00 O ATOM 828 CB VAL A 253 6.860 -1.335 95.946 1.00 6.82 C ATOM 829 CG1 VAL A 253 6.088 -0.813 97.154 1.00 8.44 C ATOM 830 CG2 VAL A 253 7.891 -2.379 96.333 1.00 8.17 C ATOM 831 H VAL A 253 7.384 -1.682 93.359 1.00 0.00 H ATOM 832 N PHE A 254 4.998 0.110 93.918 1.00 5.34 N ATOM 833 CA PHE A 254 3.942 1.082 93.624 1.00 5.76 C ATOM 834 C PHE A 254 2.972 0.640 92.515 1.00 5.59 C ATOM 835 O PHE A 254 1.731 0.643 92.731 1.00 5.57 O ATOM 836 CB PHE A 254 4.510 2.461 93.287 1.00 4.24 C ATOM 837 CG PHE A 254 3.478 3.392 92.716 1.00 4.89 C ATOM 838 CD1 PHE A 254 2.548 3.987 93.531 1.00 4.21 C ATOM 839 CD2 PHE A 254 3.409 3.617 91.356 1.00 5.24 C ATOM 840 CE1 PHE A 254 1.557 4.834 92.984 1.00 4.71 C ATOM 841 CE2 PHE A 254 2.442 4.434 90.816 1.00 5.43 C ATOM 842 CZ PHE A 254 1.519 5.044 91.621 1.00 7.81 C ATOM 843 H PHE A 254 5.952 0.249 93.529 1.00 0.00 H ATOM 844 N SER A 255 3.491 0.283 91.327 1.00 5.07 N ATOM 845 CA SER A 255 2.586 0.025 90.208 1.00 3.85 C ATOM 846 C SER A 255 1.709 -1.210 90.440 1.00 7.76 C ATOM 847 O SER A 255 0.529 -1.223 90.067 1.00 5.46 O ATOM 848 CB SER A 255 3.327 -0.142 88.879 1.00 6.57 C ATOM 849 OG SER A 255 4.073 1.008 88.596 1.00 6.95 O ATOM 850 HG SER A 255 3.465 1.787 88.534 1.00 0.00 H ATOM 851 H SER A 255 4.520 0.192 91.206 1.00 0.00 H ATOM 852 N ASP A 256 2.272 -2.239 91.055 1.00 6.07 N ATOM 853 CA ASP A 256 1.550 -3.506 91.227 1.00 5.51 C ATOM 854 C ASP A 256 0.738 -3.437 92.510 1.00 9.57 C ATOM 855 O ASP A 256 1.012 -4.127 93.486 1.00 9.63 O ATOM 856 CB ASP A 256 2.535 -4.659 91.278 1.00 7.85 C ATOM 857 CG ASP A 256 1.881 -6.021 91.174 1.00 11.29 C ATOM 858 OD1 ASP A 256 0.691 -6.118 90.832 1.00 9.05 O ATOM 859 OD2 ASP A 256 2.605 -7.000 91.456 1.00 11.54 O ATOM 860 H ASP A 256 3.241 -2.148 91.422 1.00 0.00 H ATOM 861 N GLY A 257 -0.264 -2.577 92.500 1.00 8.56 N ATOM 862 CA GLY A 257 -1.120 -2.392 93.658 1.00 10.83 C ATOM 863 C GLY A 257 -2.267 -1.465 93.323 1.00 16.32 C ATOM 864 O GLY A 257 -2.302 -0.873 92.259 1.00 12.70 O ATOM 865 H GLY A 257 -0.444 -2.018 91.641 1.00 0.00 H ATOM 866 N VAL A 258 -3.208 -1.331 94.246 1.00 15.98 N ATOM 867 CA VAL A 258 -4.333 -0.424 94.064 1.00 16.94 C ATOM 868 C VAL A 258 -3.817 0.982 93.844 1.00 12.74 C ATOM 869 O VAL A 258 -2.802 1.371 94.430 1.00 16.84 O ATOM 870 CB VAL A 258 -5.236 -0.420 95.318 1.00 20.41 C ATOM 871 CG1 VAL A 258 -5.899 -1.787 95.504 1.00 31.88 C ATOM 872 CG2 VAL A 258 -4.438 -0.029 96.556 1.00 25.92 C ATOM 873 H VAL A 258 -3.142 -1.887 95.122 1.00 0.00 H ATOM 874 N THR A 259 -4.450 1.735 92.955 1.00 6.26 N ATOM 875 CA THR A 259 -4.059 3.123 92.783 1.00 9.46 C ATOM 876 C THR A 259 -5.015 4.056 93.535 1.00 7.16 C ATOM 877 O THR A 259 -6.243 3.961 93.383 1.00 8.47 O ATOM 878 CB THR A 259 -4.053 3.547 91.317 1.00 12.39 C ATOM 879 OG1 THR A 259 -3.339 2.578 90.541 1.00 14.81 O ATOM 880 CG2 THR A 259 -3.394 4.904 91.165 1.00 12.22 C ATOM 881 HG1 THR A 259 -3.781 1.697 90.628 1.00 0.00 H ATOM 882 H THR A 259 -5.222 1.334 92.384 1.00 0.00 H ATOM 883 N ASN A 260 -4.446 4.955 94.329 1.00 6.37 N ATOM 884 CA ASN A 260 -5.189 6.045 94.957 1.00 6.01 C ATOM 885 C ASN A 260 -4.222 7.182 95.236 1.00 5.65 C ATOM 886 O ASN A 260 -3.012 7.028 95.113 1.00 4.23 O ATOM 887 CB ASN A 260 -5.954 5.590 96.214 1.00 6.45 C ATOM 888 CG ASN A 260 -5.071 4.922 97.239 1.00 7.37 C ATOM 889 OD1 ASN A 260 -4.039 5.465 97.672 1.00 7.96 O ATOM 890 ND2 ASN A 260 -5.468 3.720 97.639 1.00 9.38 N ATOM 891 HD22 ASN A 260 -6.338 3.304 97.250 1.00 0.00 H ATOM 892 HD21 ASN A 260 -4.909 3.195 98.341 1.00 0.00 H ATOM 893 H ASN A 260 -3.425 4.880 94.512 1.00 0.00 H ATOM 894 N TRP A 261 -4.730 8.360 95.560 1.00 5.97 N ATOM 895 CA TRP A 261 -3.837 9.485 95.699 1.00 5.08 C ATOM 896 C TRP A 261 -2.852 9.284 96.884 1.00 4.73 C ATOM 897 O TRP A 261 -1.730 9.740 96.804 1.00 4.07 O ATOM 898 CB TRP A 261 -4.621 10.796 95.875 1.00 4.39 C ATOM 899 CG TRP A 261 -5.227 11.369 94.607 1.00 5.52 C ATOM 900 CD1 TRP A 261 -6.555 11.611 94.380 1.00 9.55 C ATOM 901 CD2 TRP A 261 -4.534 11.787 93.409 1.00 6.59 C ATOM 902 NE1 TRP A 261 -6.730 12.148 93.123 1.00 8.28 N ATOM 903 CE2 TRP A 261 -5.512 12.262 92.503 1.00 7.37 C ATOM 904 CE3 TRP A 261 -3.194 11.795 93.014 1.00 7.04 C ATOM 905 CZ2 TRP A 261 -5.183 12.757 91.238 1.00 7.46 C ATOM 906 CZ3 TRP A 261 -2.867 12.288 91.762 1.00 7.69 C ATOM 907 CH2 TRP A 261 -3.866 12.745 90.876 1.00 7.15 C ATOM 908 HE1 TRP A 261 -7.643 12.424 92.709 1.00 0.00 H ATOM 909 H TRP A 261 -5.753 8.473 95.711 1.00 0.00 H ATOM 910 N GLY A 262 -3.265 8.593 97.948 1.00 3.36 N ATOM 911 CA GLY A 262 -2.385 8.310 99.073 1.00 4.29 C ATOM 912 C GLY A 262 -1.136 7.573 98.635 1.00 4.15 C ATOM 913 O GLY A 262 -0.046 7.896 99.058 1.00 4.63 O ATOM 914 H GLY A 262 -4.245 8.246 97.975 1.00 0.00 H ATOM 915 N ARG A 263 -1.303 6.559 97.803 1.00 4.21 N ATOM 916 CA ARG A 263 -0.162 5.765 97.349 1.00 4.03 C ATOM 917 C ARG A 263 0.728 6.566 96.418 1.00 5.50 C ATOM 918 O ARG A 263 1.954 6.373 96.406 1.00 4.15 O ATOM 919 CB ARG A 263 -0.637 4.449 96.690 1.00 5.27 C ATOM 920 CG ARG A 263 -1.293 3.526 97.698 1.00 6.85 C ATOM 921 CD ARG A 263 -1.466 2.064 97.266 1.00 13.73 C ATOM 922 NE ARG A 263 -0.218 1.325 97.526 1.00 17.93 N ATOM 923 CZ ARG A 263 0.533 0.770 96.592 1.00 18.74 C ATOM 924 NH1 ARG A 263 1.661 0.169 96.926 1.00 23.05 N ATOM 925 NH2 ARG A 263 0.176 0.817 95.322 1.00 20.17 N ATOM 926 HE ARG A 263 0.093 1.234 98.514 1.00 0.00 H ATOM 927 HH12 ARG A 263 2.254 -0.269 96.192 1.00 0.00 H ATOM 928 HH11 ARG A 263 1.956 0.134 97.923 1.00 0.00 H ATOM 929 HH22 ARG A 263 0.776 0.376 94.596 1.00 0.00 H ATOM 930 HH21 ARG A 263 -0.706 1.295 95.047 1.00 0.00 H ATOM 931 H ARG A 263 -2.259 6.323 97.467 1.00 0.00 H ATOM 932 N ILE A 264 0.122 7.451 95.627 1.00 4.36 N ATOM 933 CA ILE A 264 0.891 8.358 94.770 1.00 3.18 C ATOM 934 C ILE A 264 1.734 9.345 95.600 1.00 3.91 C ATOM 935 O ILE A 264 2.908 9.596 95.308 1.00 3.24 O ATOM 936 CB ILE A 264 -0.027 9.075 93.780 1.00 3.08 C ATOM 937 CG1 ILE A 264 -0.484 8.068 92.737 1.00 5.33 C ATOM 938 CG2 ILE A 264 0.702 10.235 93.098 1.00 6.03 C ATOM 939 CD1 ILE A 264 -1.652 8.492 91.867 1.00 5.65 C ATOM 940 H ILE A 264 -0.917 7.499 95.618 1.00 0.00 H ATOM 941 N VAL A 265 1.132 9.888 96.638 1.00 4.99 N ATOM 942 CA VAL A 265 1.873 10.713 97.574 1.00 4.40 C ATOM 943 C VAL A 265 3.026 9.939 98.275 1.00 5.55 C ATOM 944 O VAL A 265 4.128 10.486 98.458 1.00 5.21 O ATOM 945 CB VAL A 265 0.920 11.399 98.579 1.00 5.41 C ATOM 946 CG1 VAL A 265 1.733 12.128 99.658 1.00 7.63 C ATOM 947 CG2 VAL A 265 -0.012 12.377 97.846 1.00 4.85 C ATOM 948 H VAL A 265 0.116 9.724 96.788 1.00 0.00 H ATOM 949 N THR A 266 2.818 8.664 98.612 1.00 4.12 N ATOM 950 CA THR A 266 3.878 7.894 99.271 1.00 4.42 C ATOM 951 C THR A 266 5.023 7.700 98.276 1.00 3.65 C ATOM 952 O THR A 266 6.174 7.857 98.618 1.00 4.09 O ATOM 953 CB THR A 266 3.400 6.519 99.752 1.00 4.96 C ATOM 954 OG1 THR A 266 2.398 6.700 100.772 1.00 8.86 O ATOM 955 CG2 THR A 266 4.555 5.684 100.329 1.00 5.09 C ATOM 956 HG1 THR A 266 1.635 7.207 100.397 1.00 0.00 H ATOM 957 H THR A 266 1.902 8.216 98.407 1.00 0.00 H ATOM 958 N LEU A 267 4.686 7.420 97.023 1.00 4.61 N ATOM 959 CA LEU A 267 5.685 7.292 95.966 1.00 2.93 C ATOM 960 C LEU A 267 6.577 8.521 95.881 1.00 3.99 C ATOM 961 O LEU A 267 7.807 8.414 95.900 1.00 4.69 O ATOM 962 CB LEU A 267 5.002 7.056 94.597 1.00 2.51 C ATOM 963 CG LEU A 267 5.861 7.096 93.331 1.00 1.82 C ATOM 964 CD1 LEU A 267 6.713 5.859 93.225 1.00 3.73 C ATOM 965 CD2 LEU A 267 5.029 7.236 92.076 1.00 3.80 C ATOM 966 H LEU A 267 3.682 7.288 96.787 1.00 0.00 H ATOM 967 N ILE A 268 5.946 9.687 95.778 1.00 3.60 N ATOM 968 CA ILE A 268 6.652 10.943 95.627 1.00 3.90 C ATOM 969 C ILE A 268 7.366 11.335 96.939 1.00 4.23 C ATOM 970 O ILE A 268 8.495 11.804 96.895 1.00 4.89 O ATOM 971 CB ILE A 268 5.703 12.060 95.166 1.00 5.05 C ATOM 972 CG1 ILE A 268 5.194 11.765 93.756 1.00 4.28 C ATOM 973 CG2 ILE A 268 6.430 13.418 95.156 1.00 7.51 C ATOM 974 CD1 ILE A 268 3.997 12.574 93.360 1.00 4.96 C ATOM 975 H ILE A 268 4.906 9.698 95.807 1.00 0.00 H ATOM 976 N SER A 269 6.747 11.083 98.093 1.00 4.74 N ATOM 977 CA SER A 269 7.320 11.451 99.395 1.00 4.71 C ATOM 978 C SER A 269 8.538 10.603 99.748 1.00 4.78 C ATOM 979 O SER A 269 9.517 11.110 100.316 1.00 4.83 O ATOM 980 CB SER A 269 6.278 11.316 100.504 1.00 4.86 C ATOM 981 OG SER A 269 5.172 12.197 100.323 1.00 7.68 O ATOM 982 HG SER A 269 4.729 11.996 99.461 1.00 0.00 H ATOM 983 H SER A 269 5.822 10.607 98.071 1.00 0.00 H ATOM 984 N PHE A 270 8.500 9.317 99.405 1.00 4.50 N ATOM 985 CA PHE A 270 9.690 8.504 99.562 1.00 4.67 C ATOM 986 C PHE A 270 10.780 8.977 98.597 1.00 6.16 C ATOM 987 O PHE A 270 11.961 8.972 98.931 1.00 6.75 O ATOM 988 CB PHE A 270 9.414 6.994 99.442 1.00 4.29 C ATOM 989 CG PHE A 270 10.596 6.157 99.852 1.00 4.54 C ATOM 990 CD1 PHE A 270 10.960 6.083 101.187 1.00 7.59 C ATOM 991 CD2 PHE A 270 11.382 5.515 98.910 1.00 9.10 C ATOM 992 CE1 PHE A 270 12.060 5.349 101.576 1.00 8.49 C ATOM 993 CE2 PHE A 270 12.451 4.791 99.281 1.00 6.91 C ATOM 994 CZ PHE A 270 12.812 4.705 100.629 1.00 9.61 C ATOM 995 H PHE A 270 7.625 8.900 99.028 1.00 0.00 H ATOM 996 N GLY A 271 10.390 9.425 97.405 1.00 5.34 N ATOM 997 CA GLY A 271 11.347 10.019 96.495 1.00 5.80 C ATOM 998 C GLY A 271 12.067 11.216 97.088 1.00 6.03 C ATOM 999 O GLY A 271 13.280 11.378 96.914 1.00 7.06 O ATOM 1000 H GLY A 271 9.391 9.348 97.126 1.00 0.00 H ATOM 1001 N ALA A 272 11.327 12.059 97.791 1.00 5.16 N ATOM 1002 CA ALA A 272 11.905 13.224 98.448 1.00 3.95 C ATOM 1003 C ALA A 272 12.846 12.757 99.543 1.00 6.41 C ATOM 1004 O ALA A 272 13.893 13.343 99.736 1.00 7.52 O ATOM 1005 CB ALA A 272 10.812 14.131 99.005 1.00 6.56 C ATOM 1006 H ALA A 272 10.305 11.885 97.877 1.00 0.00 H ATOM 1007 N PHE A 273 12.449 11.709 100.280 1.00 5.85 N ATOM 1008 CA PHE A 273 13.287 11.137 101.331 1.00 6.62 C ATOM 1009 C PHE A 273 14.600 10.638 100.735 1.00 7.40 C ATOM 1010 O PHE A 273 15.679 10.880 101.294 1.00 9.06 O ATOM 1011 CB PHE A 273 12.497 10.012 102.024 1.00 4.33 C ATOM 1012 CG PHE A 273 13.056 9.562 103.359 1.00 5.83 C ATOM 1013 CD1 PHE A 273 12.765 10.259 104.515 1.00 11.87 C ATOM 1014 CD2 PHE A 273 13.773 8.386 103.444 1.00 9.60 C ATOM 1015 CE1 PHE A 273 13.268 9.807 105.745 1.00 12.02 C ATOM 1016 CE2 PHE A 273 14.274 7.940 104.665 1.00 9.90 C ATOM 1017 CZ PHE A 273 13.999 8.648 105.792 1.00 10.57 C ATOM 1018 H PHE A 273 11.515 11.290 100.097 1.00 0.00 H ATOM 1019 N VAL A 274 14.512 9.973 99.593 1.00 6.08 N ATOM 1020 CA VAL A 274 15.726 9.507 98.905 1.00 8.47 C ATOM 1021 C VAL A 274 16.561 10.674 98.404 1.00 12.71 C ATOM 1022 O VAL A 274 17.794 10.642 98.489 1.00 9.40 O ATOM 1023 CB VAL A 274 15.413 8.522 97.762 1.00 7.99 C ATOM 1024 CG1 VAL A 274 16.680 8.217 96.930 1.00 11.63 C ATOM 1025 CG2 VAL A 274 14.776 7.238 98.331 1.00 11.31 C ATOM 1026 H VAL A 274 13.578 9.779 99.180 1.00 0.00 H ATOM 1027 N ALA A 275 15.916 11.709 97.881 1.00 9.58 N ATOM 1028 CA ALA A 275 16.654 12.854 97.357 1.00 11.33 C ATOM 1029 C ALA A 275 17.461 13.508 98.467 1.00 16.36 C ATOM 1030 O ALA A 275 18.623 13.868 98.257 1.00 15.42 O ATOM 1031 CB ALA A 275 15.720 13.862 96.698 1.00 11.94 C ATOM 1032 H ALA A 275 14.877 11.704 97.844 1.00 0.00 H ATOM 1033 N LYS A 276 16.852 13.652 99.642 1.00 9.82 N ATOM 1034 CA LYS A 276 17.540 14.229 100.808 1.00 10.74 C ATOM 1035 C LYS A 276 18.748 13.376 101.146 1.00 14.81 C ATOM 1036 O LYS A 276 19.823 13.898 101.452 1.00 14.04 O ATOM 1037 CB LYS A 276 16.592 14.351 102.001 1.00 9.53 C ATOM 1038 CG LYS A 276 15.640 15.548 101.862 1.00 13.33 C ATOM 1039 CD LYS A 276 14.812 15.812 103.087 1.00 26.05 C ATOM 1040 CE LYS A 276 13.659 14.849 103.218 1.00 19.60 C ATOM 1041 NZ LYS A 276 12.792 15.287 104.332 1.00 24.90 N ATOM 1042 HZ1 LYS A 276 13.343 15.299 105.214 1.00 0.00 H ATOM 1043 HZ2 LYS A 276 12.432 16.242 104.134 1.00 0.00 H ATOM 1044 HZ3 LYS A 276 11.994 14.627 104.429 1.00 0.00 H ATOM 1045 H LYS A 276 15.862 13.348 99.739 1.00 0.00 H ATOM 1046 N HIS A 277 18.585 12.061 101.070 1.00 11.37 N ATOM 1047 CA HIS A 277 19.711 11.172 101.312 1.00 12.50 C ATOM 1048 C HIS A 277 20.810 11.419 100.280 1.00 19.01 C ATOM 1049 O HIS A 277 21.985 11.437 100.627 1.00 17.54 O ATOM 1050 CB HIS A 277 19.239 9.730 101.321 1.00 11.78 C ATOM 1051 CG HIS A 277 20.341 8.726 101.256 1.00 16.65 C ATOM 1052 ND1 HIS A 277 21.159 8.447 102.330 1.00 22.73 N ATOM 1053 CD2 HIS A 277 20.762 7.934 100.242 1.00 25.29 C ATOM 1054 CE1 HIS A 277 22.038 7.525 101.976 1.00 25.45 C ATOM 1055 NE2 HIS A 277 21.821 7.200 100.715 1.00 26.17 N ATOM 1056 H HIS A 277 17.652 11.666 100.837 1.00 0.00 H ATOM 1057 N LEU A 278 20.430 11.665 99.025 1.00 15.20 N ATOM 1058 CA LEU A 278 21.421 11.915 97.965 1.00 16.01 C ATOM 1059 C LEU A 278 22.232 13.188 98.195 1.00 19.54 C ATOM 1060 O LEU A 278 23.430 13.242 97.879 1.00 25.45 O ATOM 1061 CB LEU A 278 20.720 11.954 96.592 1.00 16.22 C ATOM 1062 CG LEU A 278 20.260 10.574 96.134 1.00 12.87 C ATOM 1063 CD1 LEU A 278 19.378 10.664 94.874 1.00 14.28 C ATOM 1064 CD2 LEU A 278 21.443 9.675 95.848 1.00 22.03 C ATOM 1065 H LEU A 278 19.417 11.680 98.791 1.00 0.00 H ATOM 1066 N LYS A 279 21.588 14.215 98.727 1.00 18.63 N ATOM 1067 CA LYS A 279 22.269 15.446 99.101 1.00 20.35 C ATOM 1068 C LYS A 279 23.263 15.175 100.231 1.00 24.92 C ATOM 1069 O LYS A 279 24.368 15.720 100.214 1.00 22.27 O ATOM 1070 CB LYS A 279 21.245 16.493 99.554 1.00 29.86 C ATOM 1071 CG LYS A 279 21.828 17.817 100.054 1.00 26.75 C ATOM 1072 CD LYS A 279 21.982 18.808 98.918 1.00 39.31 C ATOM 1073 CE LYS A 279 22.761 20.049 99.336 1.00 43.43 C ATOM 1074 NZ LYS A 279 22.545 21.181 98.375 1.00 41.82 N ATOM 1075 HZ1 LYS A 279 22.863 20.895 97.427 1.00 0.00 H ATOM 1076 HZ2 LYS A 279 21.533 21.420 98.345 1.00 0.00 H ATOM 1077 HZ3 LYS A 279 23.089 22.010 98.689 1.00 0.00 H ATOM 1078 H LYS A 279 20.562 14.140 98.883 1.00 0.00 H ATOM 1079 N THR A 280 22.890 14.330 101.199 1.00 22.98 N ATOM 1080 CA THR A 280 23.756 14.108 102.375 1.00 20.91 C ATOM 1081 C THR A 280 25.043 13.385 102.000 1.00 32.35 C ATOM 1082 O THR A 280 26.094 13.622 102.603 1.00 31.66 O ATOM 1083 CB THR A 280 23.069 13.305 103.525 1.00 24.11 C ATOM 1084 OG1 THR A 280 22.953 11.920 103.175 1.00 31.17 O ATOM 1085 CG2 THR A 280 21.723 13.884 103.857 1.00 23.24 C ATOM 1086 HG1 THR A 280 22.408 11.833 102.353 1.00 0.00 H ATOM 1087 H THR A 280 21.984 13.826 101.123 1.00 0.00 H ATOM 1088 N ILE A 281 24.956 12.489 101.025 1.00 24.35 N ATOM 1089 CA ILE A 281 26.141 11.818 100.503 1.00 28.72 C ATOM 1090 C ILE A 281 26.719 12.541 99.268 1.00 23.64 C ATOM 1091 O ILE A 281 27.438 11.952 98.465 1.00 27.13 O ATOM 1092 CB ILE A 281 25.855 10.330 100.200 1.00 27.28 C ATOM 1093 CG1 ILE A 281 24.911 10.164 99.001 1.00 27.03 C ATOM 1094 CG2 ILE A 281 25.239 9.656 101.408 1.00 29.65 C ATOM 1095 CD1 ILE A 281 24.633 8.714 98.676 1.00 22.73 C ATOM 1096 H ILE A 281 24.024 12.261 100.625 1.00 0.00 H ATOM 1097 N ASN A 282 26.408 13.828 99.129 1.00 25.63 N ATOM 1098 CA ASN A 282 27.019 14.663 98.088 1.00 33.52 C ATOM 1099 C ASN A 282 26.830 14.122 96.669 1.00 34.12 C ATOM 1100 O ASN A 282 27.696 14.313 95.807 1.00 29.90 O ATOM 1101 CB ASN A 282 28.521 14.832 98.373 1.00 37.09 C ATOM 1102 CG ASN A 282 28.856 14.677 99.850 1.00 43.29 C ATOM 1103 OD1 ASN A 282 28.539 15.546 100.666 1.00 53.64 O ATOM 1104 ND2 ASN A 282 29.503 13.566 100.199 1.00 45.79 N ATOM 1105 HD22 ASN A 282 29.750 12.860 99.477 1.00 0.00 H ATOM 1106 HD21 ASN A 282 29.761 13.405 101.194 1.00 0.00 H ATOM 1107 H ASN A 282 25.713 14.253 99.776 1.00 0.00 H ATOM 1108 N GLN A 283 25.695 13.461 96.435 1.00 27.00 N ATOM 1109 CA GLN A 283 25.350 12.916 95.121 1.00 30.74 C ATOM 1110 C GLN A 283 24.131 13.621 94.559 1.00 17.30 C ATOM 1111 O GLN A 283 23.216 12.966 94.037 1.00 23.64 O ATOM 1112 CB GLN A 283 25.030 11.427 95.219 1.00 23.89 C ATOM 1113 CG GLN A 283 26.164 10.582 95.717 1.00 31.46 C ATOM 1114 CD GLN A 283 27.226 10.402 94.676 1.00 45.55 C ATOM 1115 OE1 GLN A 283 26.997 9.765 93.645 1.00 43.49 O ATOM 1116 NE2 GLN A 283 28.398 10.977 94.924 1.00 39.93 N ATOM 1117 HE22 GLN A 283 28.542 11.504 95.809 1.00 0.00 H ATOM 1118 HE21 GLN A 283 29.171 10.900 94.233 1.00 0.00 H ATOM 1119 H GLN A 283 25.026 13.327 97.220 1.00 0.00 H ATOM 1120 N GLU A 284 24.122 14.945 94.669 1.00 21.09 N ATOM 1121 CA GLU A 284 22.997 15.747 94.240 1.00 22.58 C ATOM 1122 C GLU A 284 22.693 15.565 92.779 1.00 25.60 C ATOM 1123 O GLU A 284 21.570 15.813 92.375 1.00 21.44 O ATOM 1124 CB GLU A 284 23.261 17.229 94.476 1.00 32.82 C ATOM 1125 CG GLU A 284 23.123 17.674 95.900 1.00 35.97 C ATOM 1126 CD GLU A 284 23.729 19.043 96.114 1.00 44.63 C ATOM 1127 OE1 GLU A 284 24.646 19.161 96.956 1.00 44.76 O ATOM 1128 OE2 GLU A 284 23.291 20.000 95.436 1.00 50.09 O ATOM 1129 H GLU A 284 24.952 15.421 95.077 1.00 0.00 H ATOM 1130 N SER A 285 23.687 15.165 91.986 1.00 19.95 N ATOM 1131 CA SER A 285 23.505 15.088 90.542 1.00 18.93 C ATOM 1132 C SER A 285 22.519 13.994 90.161 1.00 20.73 C ATOM 1133 O SER A 285 22.005 13.997 89.046 1.00 17.98 O ATOM 1134 CB SER A 285 24.842 14.861 89.821 1.00 19.67 C ATOM 1135 OG SER A 285 25.388 13.600 90.166 1.00 29.82 O ATOM 1136 HG SER A 285 25.540 13.564 91.144 1.00 0.00 H ATOM 1137 H SER A 285 24.604 14.905 92.403 1.00 0.00 H ATOM 1138 N CYS A 286 22.250 13.057 91.076 1.00 16.27 N ATOM 1139 CA CYS A 286 21.339 11.955 90.761 1.00 12.97 C ATOM 1140 C CYS A 286 19.890 12.311 91.049 1.00 11.92 C ATOM 1141 O CYS A 286 19.009 11.523 90.711 1.00 11.67 O ATOM 1142 CB CYS A 286 21.681 10.689 91.535 1.00 15.27 C ATOM 1143 SG CYS A 286 23.183 9.870 91.003 1.00 15.49 S ATOM 1144 H CYS A 286 22.690 13.111 92.017 1.00 0.00 H ATOM 1145 N ILE A 287 19.652 13.484 91.623 1.00 10.59 N ATOM 1146 CA ILE A 287 18.298 13.884 92.007 1.00 13.12 C ATOM 1147 C ILE A 287 17.387 14.100 90.806 1.00 13.01 C ATOM 1148 O ILE A 287 16.244 13.648 90.804 1.00 10.77 O ATOM 1149 CB ILE A 287 18.315 15.131 92.896 1.00 19.04 C ATOM 1150 CG1 ILE A 287 18.930 14.770 94.249 1.00 18.25 C ATOM 1151 CG2 ILE A 287 16.911 15.694 93.081 1.00 16.02 C ATOM 1152 CD1 ILE A 287 19.043 15.937 95.207 1.00 20.52 C ATOM 1153 H ILE A 287 20.445 14.132 91.804 1.00 0.00 H ATOM 1154 N GLU A 288 17.857 14.789 89.771 1.00 14.96 N ATOM 1155 CA GLU A 288 16.963 15.003 88.638 1.00 12.50 C ATOM 1156 C GLU A 288 16.664 13.695 87.892 1.00 13.50 C ATOM 1157 O GLU A 288 15.531 13.466 87.488 1.00 10.96 O ATOM 1158 CB GLU A 288 17.480 16.101 87.704 1.00 18.75 C ATOM 1159 CG GLU A 288 16.646 16.269 86.418 1.00 30.70 C ATOM 1160 CD GLU A 288 15.193 16.731 86.649 1.00 42.52 C ATOM 1161 OE1 GLU A 288 14.986 17.931 86.953 1.00 44.68 O ATOM 1162 OE2 GLU A 288 14.258 15.897 86.496 1.00 27.50 O ATOM 1163 H GLU A 288 18.828 15.162 89.769 1.00 0.00 H ATOM 1164 N PRO A 289 17.670 12.834 87.699 1.00 10.62 N ATOM 1165 CA PRO A 289 17.388 11.527 87.104 1.00 9.92 C ATOM 1166 C PRO A 289 16.364 10.747 87.924 1.00 12.00 C ATOM 1167 O PRO A 289 15.507 10.067 87.342 1.00 12.91 O ATOM 1168 CB PRO A 289 18.754 10.832 87.135 1.00 21.46 C ATOM 1169 CG PRO A 289 19.709 11.946 87.051 1.00 18.33 C ATOM 1170 CD PRO A 289 19.121 13.110 87.746 1.00 15.53 C ATOM 1171 N LEU A 290 16.469 10.842 89.249 1.00 11.78 N ATOM 1172 CA LEU A 290 15.540 10.142 90.143 1.00 9.29 C ATOM 1173 C LEU A 290 14.129 10.684 89.949 1.00 10.58 C ATOM 1174 O LEU A 290 13.165 9.904 89.867 1.00 8.84 O ATOM 1175 CB LEU A 290 15.977 10.294 91.596 1.00 11.08 C ATOM 1176 CG LEU A 290 15.037 9.706 92.650 1.00 14.33 C ATOM 1177 CD1 LEU A 290 15.022 8.201 92.527 1.00 19.50 C ATOM 1178 CD2 LEU A 290 15.468 10.145 94.010 1.00 19.26 C ATOM 1179 H LEU A 290 17.226 11.425 89.658 1.00 0.00 H ATOM 1180 N ALA A 291 14.003 12.005 89.850 1.00 10.19 N ATOM 1181 CA ALA A 291 12.691 12.608 89.617 1.00 6.48 C ATOM 1182 C ALA A 291 12.111 12.156 88.272 1.00 9.15 C ATOM 1183 O ALA A 291 10.932 11.915 88.160 1.00 5.64 O ATOM 1184 CB ALA A 291 12.776 14.139 89.682 1.00 9.63 C ATOM 1185 H ALA A 291 14.843 12.612 89.939 1.00 0.00 H ATOM 1186 N GLU A 292 12.950 12.036 87.256 1.00 7.62 N ATOM 1187 CA GLU A 292 12.512 11.539 85.956 1.00 7.92 C ATOM 1188 C GLU A 292 12.037 10.085 86.053 1.00 7.74 C ATOM 1189 O GLU A 292 11.033 9.701 85.439 1.00 7.31 O ATOM 1190 CB GLU A 292 13.655 11.656 84.939 1.00 11.94 C ATOM 1191 CG GLU A 292 13.285 11.137 83.579 1.00 17.96 C ATOM 1192 CD GLU A 292 14.348 11.421 82.535 1.00 33.57 C ATOM 1193 OE1 GLU A 292 15.551 11.401 82.872 1.00 34.45 O ATOM 1194 OE2 GLU A 292 13.963 11.659 81.376 1.00 31.90 O ATOM 1195 H GLU A 292 13.947 12.303 87.387 1.00 0.00 H ATOM 1196 N SER A 293 12.744 9.274 86.827 1.00 7.34 N ATOM 1197 CA SER A 293 12.359 7.881 87.007 1.00 6.41 C ATOM 1198 C SER A 293 11.009 7.753 87.689 1.00 5.46 C ATOM 1199 O SER A 293 10.190 6.935 87.309 1.00 7.01 O ATOM 1200 CB SER A 293 13.421 7.131 87.807 1.00 12.61 C ATOM 1201 OG SER A 293 14.603 7.036 87.045 1.00 22.71 O ATOM 1202 HG SER A 293 14.931 7.945 86.832 1.00 0.00 H ATOM 1203 H SER A 293 13.588 9.638 87.314 1.00 0.00 H ATOM 1204 N ILE A 294 10.800 8.540 88.729 1.00 4.63 N ATOM 1205 CA ILE A 294 9.542 8.487 89.460 1.00 3.73 C ATOM 1206 C ILE A 294 8.399 8.923 88.533 1.00 4.51 C ATOM 1207 O ILE A 294 7.323 8.323 88.511 1.00 4.62 O ATOM 1208 CB ILE A 294 9.596 9.404 90.694 1.00 5.55 C ATOM 1209 CG1 ILE A 294 10.575 8.881 91.747 1.00 5.48 C ATOM 1210 CG2 ILE A 294 8.200 9.537 91.326 1.00 4.23 C ATOM 1211 CD1 ILE A 294 10.918 9.922 92.769 1.00 7.39 C ATOM 1212 H ILE A 294 11.542 9.204 89.029 1.00 0.00 H ATOM 1213 N THR A 295 8.629 10.003 87.796 1.00 2.84 N ATOM 1214 CA THR A 295 7.629 10.514 86.868 1.00 3.46 C ATOM 1215 C THR A 295 7.298 9.464 85.802 1.00 4.59 C ATOM 1216 O THR A 295 6.136 9.314 85.425 1.00 4.36 O ATOM 1217 CB THR A 295 8.116 11.820 86.184 1.00 5.73 C ATOM 1218 OG1 THR A 295 8.412 12.834 87.168 1.00 6.18 O ATOM 1219 CG2 THR A 295 7.045 12.381 85.281 1.00 7.55 C ATOM 1220 HG1 THR A 295 9.123 12.506 87.774 1.00 0.00 H ATOM 1221 H THR A 295 9.542 10.494 87.883 1.00 0.00 H ATOM 1222 N ASP A 296 8.313 8.773 85.288 1.00 5.02 N ATOM 1223 CA ASP A 296 8.081 7.718 84.302 1.00 5.87 C ATOM 1224 C ASP A 296 7.198 6.618 84.870 1.00 5.32 C ATOM 1225 O ASP A 296 6.242 6.173 84.232 1.00 6.30 O ATOM 1226 CB ASP A 296 9.398 7.100 83.830 1.00 6.03 C ATOM 1227 CG ASP A 296 10.186 8.002 82.909 1.00 14.28 C ATOM 1228 OD1 ASP A 296 9.607 8.913 82.264 1.00 12.18 O ATOM 1229 OD2 ASP A 296 11.417 7.788 82.845 1.00 16.86 O ATOM 1230 H ASP A 296 9.285 8.986 85.592 1.00 0.00 H ATOM 1231 N VAL A 297 7.535 6.129 86.053 1.00 4.44 N ATOM 1232 CA VAL A 297 6.703 5.109 86.683 1.00 6.88 C ATOM 1233 C VAL A 297 5.257 5.602 86.869 1.00 6.83 C ATOM 1234 O VAL A 297 4.292 4.924 86.515 1.00 5.84 O ATOM 1235 CB VAL A 297 7.320 4.622 87.988 1.00 5.99 C ATOM 1236 CG1 VAL A 297 6.348 3.693 88.746 1.00 11.19 C ATOM 1237 CG2 VAL A 297 8.605 3.897 87.688 1.00 9.68 C ATOM 1238 H VAL A 297 8.392 6.471 86.533 1.00 0.00 H ATOM 1239 N LEU A 298 5.082 6.802 87.404 1.00 5.00 N ATOM 1240 CA LEU A 298 3.753 7.298 87.702 1.00 5.39 C ATOM 1241 C LEU A 298 2.952 7.476 86.433 1.00 6.51 C ATOM 1242 O LEU A 298 1.868 6.926 86.283 1.00 5.82 O ATOM 1243 CB LEU A 298 3.845 8.633 88.453 1.00 3.44 C ATOM 1244 CG LEU A 298 2.515 9.335 88.721 1.00 3.20 C ATOM 1245 CD1 LEU A 298 1.643 8.443 89.550 1.00 5.41 C ATOM 1246 CD2 LEU A 298 2.773 10.653 89.449 1.00 6.73 C ATOM 1247 H LEU A 298 5.910 7.396 87.613 1.00 0.00 H ATOM 1248 N VAL A 299 3.477 8.269 85.512 1.00 3.92 N ATOM 1249 CA VAL A 299 2.716 8.599 84.319 1.00 4.42 C ATOM 1250 C VAL A 299 2.582 7.434 83.340 1.00 5.49 C ATOM 1251 O VAL A 299 1.505 7.239 82.783 1.00 6.08 O ATOM 1252 CB VAL A 299 3.312 9.834 83.607 1.00 3.12 C ATOM 1253 CG1 VAL A 299 2.497 10.193 82.370 1.00 8.11 C ATOM 1254 CG2 VAL A 299 3.340 11.015 84.519 1.00 7.41 C ATOM 1255 H VAL A 299 4.434 8.656 85.642 1.00 0.00 H ATOM 1256 N ARG A 300 3.658 6.692 83.106 1.00 7.24 N ATOM 1257 CA ARG A 300 3.632 5.673 82.084 1.00 4.80 C ATOM 1258 C ARG A 300 2.901 4.424 82.551 1.00 5.56 C ATOM 1259 O ARG A 300 2.434 3.657 81.720 1.00 8.77 O ATOM 1260 CB ARG A 300 5.050 5.418 81.525 1.00 9.23 C ATOM 1261 CG ARG A 300 5.708 6.749 81.162 1.00 14.81 C ATOM 1262 CD ARG A 300 6.702 6.726 80.017 1.00 24.62 C ATOM 1263 NE ARG A 300 7.365 8.025 79.828 1.00 26.94 N ATOM 1264 CZ ARG A 300 6.947 8.988 79.000 1.00 29.02 C ATOM 1265 NH1 ARG A 300 5.849 8.837 78.279 1.00 22.37 N ATOM 1266 NH2 ARG A 300 7.628 10.121 78.904 1.00 27.54 N ATOM 1267 HE ARG A 300 8.226 8.209 80.382 1.00 0.00 H ATOM 1268 HH12 ARG A 300 5.538 9.596 77.640 1.00 0.00 H ATOM 1269 HH11 ARG A 300 5.296 7.959 78.351 1.00 0.00 H ATOM 1270 HH22 ARG A 300 7.303 10.870 78.260 1.00 0.00 H ATOM 1271 HH21 ARG A 300 8.487 10.261 79.473 1.00 0.00 H ATOM 1272 H ARG A 300 4.524 6.846 83.662 1.00 0.00 H ATOM 1273 N THR A 301 2.727 4.223 83.862 1.00 4.93 N ATOM 1274 CA THR A 301 1.969 3.062 84.325 1.00 5.39 C ATOM 1275 C THR A 301 0.544 3.383 84.806 1.00 8.09 C ATOM 1276 O THR A 301 -0.278 2.479 84.897 1.00 8.29 O ATOM 1277 CB THR A 301 2.722 2.178 85.391 1.00 6.96 C ATOM 1278 OG1 THR A 301 2.723 2.808 86.685 1.00 6.22 O ATOM 1279 CG2 THR A 301 4.117 1.895 84.927 1.00 5.12 C ATOM 1280 HG1 THR A 301 3.178 3.685 86.623 1.00 0.00 H ATOM 1281 H THR A 301 3.130 4.891 84.550 1.00 0.00 H ATOM 1282 N LYS A 302 0.233 4.656 85.095 1.00 4.78 N ATOM 1283 CA LYS A 302 -1.065 5.029 85.651 1.00 5.49 C ATOM 1284 C LYS A 302 -1.776 6.157 84.881 1.00 4.85 C ATOM 1285 O LYS A 302 -2.637 6.839 85.417 1.00 5.85 O ATOM 1286 CB LYS A 302 -0.916 5.457 87.117 1.00 5.19 C ATOM 1287 CG LYS A 302 -0.231 4.420 88.012 1.00 5.33 C ATOM 1288 CD LYS A 302 -0.996 3.116 88.030 1.00 8.04 C ATOM 1289 CE LYS A 302 -0.283 2.072 88.903 1.00 13.44 C ATOM 1290 NZ LYS A 302 -1.001 0.746 88.829 1.00 17.24 N ATOM 1291 HZ1 LYS A 302 -1.977 0.862 89.168 1.00 0.00 H ATOM 1292 HZ2 LYS A 302 -1.012 0.414 87.844 1.00 0.00 H ATOM 1293 HZ3 LYS A 302 -0.506 0.052 89.425 1.00 0.00 H ATOM 1294 H LYS A 302 0.938 5.400 84.918 1.00 0.00 H ATOM 1295 N ARG A 303 -1.426 6.348 83.621 1.00 6.83 N ATOM 1296 CA ARG A 303 -2.035 7.446 82.858 1.00 7.32 C ATOM 1297 C ARG A 303 -3.560 7.382 82.868 1.00 6.94 C ATOM 1298 O ARG A 303 -4.218 8.389 83.106 1.00 7.90 O ATOM 1299 CB ARG A 303 -1.536 7.495 81.418 1.00 7.37 C ATOM 1300 CG ARG A 303 -2.086 8.726 80.668 1.00 9.76 C ATOM 1301 CD ARG A 303 -1.612 8.827 79.242 1.00 9.92 C ATOM 1302 NE ARG A 303 -0.157 8.811 79.085 1.00 8.24 N ATOM 1303 CZ ARG A 303 0.626 9.890 79.063 1.00 7.19 C ATOM 1304 NH1 ARG A 303 0.117 11.116 79.234 1.00 10.40 N ATOM 1305 NH2 ARG A 303 1.923 9.750 78.870 1.00 8.11 N ATOM 1306 HE ARG A 303 0.303 7.884 78.982 1.00 0.00 H ATOM 1307 HH12 ARG A 303 0.743 11.946 79.214 1.00 0.00 H ATOM 1308 HH11 ARG A 303 -0.904 11.238 79.387 1.00 0.00 H ATOM 1309 HH22 ARG A 303 2.539 10.587 78.852 1.00 0.00 H ATOM 1310 HH21 ARG A 303 2.329 8.802 78.736 1.00 0.00 H ATOM 1311 H ARG A 303 -0.724 5.725 83.173 1.00 0.00 H ATOM 1312 N ASP A 304 -4.116 6.199 82.627 1.00 9.30 N ATOM 1313 CA ASP A 304 -5.558 6.051 82.571 1.00 9.32 C ATOM 1314 C ASP A 304 -6.232 6.527 83.867 1.00 10.42 C ATOM 1315 O ASP A 304 -7.210 7.274 83.835 1.00 8.09 O ATOM 1316 CB ASP A 304 -5.921 4.595 82.288 1.00 14.18 C ATOM 1317 CG ASP A 304 -7.393 4.404 82.074 1.00 31.43 C ATOM 1318 OD1 ASP A 304 -7.910 4.924 81.059 1.00 38.74 O ATOM 1319 OD2 ASP A 304 -8.027 3.731 82.917 1.00 34.33 O ATOM 1320 H ASP A 304 -3.509 5.368 82.477 1.00 0.00 H ATOM 1321 N TRP A 305 -5.700 6.099 85.007 1.00 7.72 N ATOM 1322 CA TRP A 305 -6.250 6.485 86.291 1.00 7.70 C ATOM 1323 C TRP A 305 -6.094 7.995 86.515 1.00 6.80 C ATOM 1324 O TRP A 305 -7.026 8.670 86.955 1.00 7.78 O ATOM 1325 CB TRP A 305 -5.527 5.730 87.413 1.00 7.60 C ATOM 1326 CG TRP A 305 -6.144 5.881 88.778 1.00 11.07 C ATOM 1327 CD1 TRP A 305 -7.069 5.059 89.349 1.00 11.01 C ATOM 1328 CD2 TRP A 305 -5.885 6.918 89.738 1.00 7.61 C ATOM 1329 NE1 TRP A 305 -7.401 5.507 90.605 1.00 12.09 N ATOM 1330 CE2 TRP A 305 -6.697 6.653 90.867 1.00 8.72 C ATOM 1331 CE3 TRP A 305 -5.061 8.040 89.756 1.00 7.60 C ATOM 1332 CZ2 TRP A 305 -6.700 7.467 91.979 1.00 8.44 C ATOM 1333 CZ3 TRP A 305 -5.070 8.849 90.871 1.00 5.21 C ATOM 1334 CH2 TRP A 305 -5.884 8.570 91.963 1.00 7.13 C ATOM 1335 HE1 TRP A 305 -8.076 5.051 91.251 1.00 0.00 H ATOM 1336 H TRP A 305 -4.870 5.473 84.977 1.00 0.00 H ATOM 1337 N LEU A 306 -4.900 8.508 86.219 1.00 5.57 N ATOM 1338 CA LEU A 306 -4.625 9.938 86.383 1.00 4.64 C ATOM 1339 C LEU A 306 -5.618 10.775 85.581 1.00 6.57 C ATOM 1340 O LEU A 306 -6.195 11.708 86.114 1.00 7.55 O ATOM 1341 CB LEU A 306 -3.177 10.263 85.984 1.00 5.51 C ATOM 1342 CG LEU A 306 -2.135 9.732 86.974 1.00 4.92 C ATOM 1343 CD1 LEU A 306 -0.749 9.693 86.322 1.00 7.67 C ATOM 1344 CD2 LEU A 306 -2.102 10.561 88.272 1.00 6.83 C ATOM 1345 H LEU A 306 -4.149 7.881 85.865 1.00 0.00 H ATOM 1346 N VAL A 307 -5.821 10.427 84.310 1.00 8.09 N ATOM 1347 CA VAL A 307 -6.746 11.175 83.454 1.00 8.91 C ATOM 1348 C VAL A 307 -8.170 11.130 84.032 1.00 8.62 C ATOM 1349 O VAL A 307 -8.858 12.159 84.137 1.00 8.49 O ATOM 1350 CB VAL A 307 -6.700 10.641 82.004 1.00 6.68 C ATOM 1351 CG1 VAL A 307 -7.881 11.216 81.178 1.00 11.26 C ATOM 1352 CG2 VAL A 307 -5.400 11.023 81.368 1.00 9.22 C ATOM 1353 H VAL A 307 -5.313 9.609 83.918 1.00 0.00 H ATOM 1354 N LYS A 308 -8.597 9.945 84.438 1.00 6.02 N ATOM 1355 CA LYS A 308 -9.942 9.744 84.991 1.00 8.48 C ATOM 1356 C LYS A 308 -10.157 10.537 86.288 1.00 8.22 C ATOM 1357 O LYS A 308 -11.296 10.948 86.614 1.00 8.18 O ATOM 1358 CB LYS A 308 -10.203 8.244 85.188 1.00 9.95 C ATOM 1359 CG LYS A 308 -10.517 7.536 83.877 1.00 19.56 C ATOM 1360 CD LYS A 308 -10.557 6.029 84.023 1.00 29.87 C ATOM 1361 CE LYS A 308 -10.740 5.360 82.660 1.00 36.22 C ATOM 1362 NZ LYS A 308 -10.671 3.874 82.753 1.00 44.50 N ATOM 1363 HZ1 LYS A 308 -9.743 3.594 83.131 1.00 0.00 H ATOM 1364 HZ2 LYS A 308 -11.422 3.532 83.386 1.00 0.00 H ATOM 1365 HZ3 LYS A 308 -10.800 3.462 81.807 1.00 0.00 H ATOM 1366 H LYS A 308 -7.958 9.128 84.363 1.00 0.00 H ATOM 1367 N GLN A 309 -9.066 10.760 87.032 1.00 6.99 N ATOM 1368 CA GLN A 309 -9.095 11.511 88.282 1.00 7.63 C ATOM 1369 C GLN A 309 -8.764 12.995 88.117 1.00 9.57 C ATOM 1370 O GLN A 309 -8.491 13.672 89.096 1.00 8.54 O ATOM 1371 CB GLN A 309 -8.134 10.892 89.313 1.00 10.63 C ATOM 1372 CG GLN A 309 -8.518 9.504 89.805 1.00 17.51 C ATOM 1373 CD GLN A 309 -9.938 9.383 90.300 1.00 22.39 C ATOM 1374 OE1 GLN A 309 -10.460 10.255 91.007 1.00 23.83 O ATOM 1375 NE2 GLN A 309 -10.584 8.288 89.926 1.00 22.80 N ATOM 1376 HE22 GLN A 309 -10.107 7.580 89.331 1.00 0.00 H ATOM 1377 HE21 GLN A 309 -11.568 8.136 90.227 1.00 0.00 H ATOM 1378 H GLN A 309 -8.156 10.380 86.703 1.00 0.00 H ATOM 1379 N ARG A 310 -8.774 13.485 86.874 1.00 7.60 N ATOM 1380 CA ARG A 310 -8.610 14.917 86.565 1.00 7.96 C ATOM 1381 C ARG A 310 -7.175 15.420 86.772 1.00 7.11 C ATOM 1382 O ARG A 310 -6.921 16.619 86.920 1.00 7.54 O ATOM 1383 CB ARG A 310 -9.641 15.784 87.321 1.00 9.52 C ATOM 1384 CG ARG A 310 -11.064 15.655 86.759 1.00 11.09 C ATOM 1385 CD ARG A 310 -12.112 16.464 87.548 1.00 14.06 C ATOM 1386 NE ARG A 310 -11.686 17.817 87.935 1.00 13.26 N ATOM 1387 CZ ARG A 310 -11.741 18.889 87.154 1.00 21.22 C ATOM 1388 NH1 ARG A 310 -12.174 18.800 85.896 1.00 19.60 N ATOM 1389 NH2 ARG A 310 -11.330 20.056 87.623 1.00 24.48 N ATOM 1390 HE ARG A 310 -11.312 17.944 88.897 1.00 0.00 H ATOM 1391 HH12 ARG A 310 -12.211 19.650 85.297 1.00 0.00 H ATOM 1392 HH11 ARG A 310 -12.475 17.881 85.513 1.00 0.00 H ATOM 1393 HH22 ARG A 310 -11.369 20.902 87.019 1.00 0.00 H ATOM 1394 HH21 ARG A 310 -10.968 20.127 88.595 1.00 0.00 H ATOM 1395 H ARG A 310 -8.904 12.822 86.084 1.00 0.00 H ATOM 1396 N GLY A 311 -6.218 14.496 86.721 1.00 6.47 N ATOM 1397 CA GLY A 311 -4.819 14.851 86.781 1.00 5.61 C ATOM 1398 C GLY A 311 -4.479 15.713 87.970 1.00 5.83 C ATOM 1399 O GLY A 311 -4.990 15.491 89.059 1.00 6.59 O ATOM 1400 H GLY A 311 -6.484 13.494 86.636 1.00 0.00 H ATOM 1401 N TRP A 312 -3.598 16.692 87.760 1.00 5.56 N ATOM 1402 CA TRP A 312 -3.108 17.505 88.868 1.00 4.65 C ATOM 1403 C TRP A 312 -4.150 18.468 89.410 1.00 9.07 C ATOM 1404 O TRP A 312 -4.104 18.835 90.602 1.00 7.20 O ATOM 1405 CB TRP A 312 -1.781 18.200 88.498 1.00 5.98 C ATOM 1406 CG TRP A 312 -0.677 17.229 88.379 1.00 5.89 C ATOM 1407 CD1 TRP A 312 -0.121 16.759 87.228 1.00 6.46 C ATOM 1408 CD2 TRP A 312 -0.025 16.529 89.450 1.00 6.47 C ATOM 1409 NE1 TRP A 312 0.850 15.832 87.507 1.00 6.71 N ATOM 1410 CE2 TRP A 312 0.922 15.669 88.866 1.00 7.27 C ATOM 1411 CE3 TRP A 312 -0.157 16.550 90.831 1.00 7.24 C ATOM 1412 CZ2 TRP A 312 1.755 14.859 89.619 1.00 8.90 C ATOM 1413 CZ3 TRP A 312 0.669 15.755 91.584 1.00 7.53 C ATOM 1414 CH2 TRP A 312 1.606 14.911 90.981 1.00 10.11 C ATOM 1415 HE1 TRP A 312 1.434 15.335 86.805 1.00 0.00 H ATOM 1416 H TRP A 312 -3.256 16.878 86.795 1.00 0.00 H ATOM 1417 N ASP A 313 -5.133 18.838 88.594 1.00 9.17 N ATOM 1418 CA ASP A 313 -6.257 19.600 89.132 1.00 7.39 C ATOM 1419 C ASP A 313 -7.012 18.730 90.113 1.00 7.04 C ATOM 1420 O ASP A 313 -7.441 19.211 91.160 1.00 9.67 O ATOM 1421 CB ASP A 313 -7.170 20.102 88.015 1.00 7.61 C ATOM 1422 CG ASP A 313 -6.556 21.276 87.258 1.00 20.89 C ATOM 1423 OD1 ASP A 313 -6.162 22.263 87.916 1.00 26.50 O ATOM 1424 OD2 ASP A 313 -6.435 21.190 86.027 1.00 31.19 O ATOM 1425 H ASP A 313 -5.102 18.588 87.585 1.00 0.00 H ATOM 1426 N GLY A 314 -7.151 17.451 89.797 1.00 6.72 N ATOM 1427 CA GLY A 314 -7.818 16.540 90.693 1.00 6.15 C ATOM 1428 C GLY A 314 -7.060 16.334 91.990 1.00 5.06 C ATOM 1429 O GLY A 314 -7.668 16.181 93.030 1.00 6.93 O ATOM 1430 H GLY A 314 -6.775 17.101 88.893 1.00 0.00 H ATOM 1431 N PHE A 315 -5.741 16.282 91.900 1.00 4.24 N ATOM 1432 CA PHE A 315 -4.882 16.114 93.071 1.00 5.67 C ATOM 1433 C PHE A 315 -5.112 17.273 94.023 1.00 6.96 C ATOM 1434 O PHE A 315 -5.303 17.084 95.226 1.00 6.45 O ATOM 1435 CB PHE A 315 -3.435 16.095 92.598 1.00 6.12 C ATOM 1436 CG PHE A 315 -2.410 16.103 93.684 1.00 5.64 C ATOM 1437 CD1 PHE A 315 -2.087 14.946 94.357 1.00 7.47 C ATOM 1438 CD2 PHE A 315 -1.720 17.263 93.991 1.00 5.08 C ATOM 1439 CE1 PHE A 315 -1.106 14.938 95.306 1.00 8.34 C ATOM 1440 CE2 PHE A 315 -0.733 17.259 94.952 1.00 7.63 C ATOM 1441 CZ PHE A 315 -0.433 16.099 95.613 1.00 8.16 C ATOM 1442 H PHE A 315 -5.299 16.364 90.962 1.00 0.00 H ATOM 1443 N VAL A 316 -5.042 18.476 93.467 1.00 5.81 N ATOM 1444 CA VAL A 316 -5.278 19.687 94.244 1.00 7.43 C ATOM 1445 C VAL A 316 -6.683 19.693 94.865 1.00 11.42 C ATOM 1446 O VAL A 316 -6.844 19.996 96.056 1.00 12.26 O ATOM 1447 CB VAL A 316 -5.069 20.949 93.394 1.00 8.71 C ATOM 1448 CG1 VAL A 316 -5.546 22.187 94.170 1.00 11.52 C ATOM 1449 CG2 VAL A 316 -3.626 21.107 93.007 1.00 10.59 C ATOM 1450 H VAL A 316 -4.814 18.557 92.456 1.00 0.00 H ATOM 1451 N GLU A 317 -7.700 19.351 94.081 1.00 7.61 N ATOM 1452 CA GLU A 317 -9.061 19.312 94.598 1.00 9.71 C ATOM 1453 C GLU A 317 -9.208 18.273 95.735 1.00 11.91 C ATOM 1454 O GLU A 317 -9.886 18.520 96.738 1.00 10.42 O ATOM 1455 CB GLU A 317 -10.055 19.029 93.455 1.00 12.28 C ATOM 1456 CG GLU A 317 -10.144 20.185 92.449 1.00 14.80 C ATOM 1457 CD GLU A 317 -10.771 19.803 91.102 1.00 24.13 C ATOM 1458 OE1 GLU A 317 -10.957 18.606 90.805 1.00 22.26 O ATOM 1459 OE2 GLU A 317 -11.057 20.726 90.312 1.00 29.93 O ATOM 1460 H GLU A 317 -7.522 19.108 93.086 1.00 0.00 H ATOM 1461 N PHE A 318 -8.587 17.111 95.570 1.00 9.12 N ATOM 1462 CA PHE A 318 -8.707 16.021 96.530 1.00 10.78 C ATOM 1463 C PHE A 318 -8.178 16.432 97.895 1.00 10.87 C ATOM 1464 O PHE A 318 -8.770 16.077 98.916 1.00 11.33 O ATOM 1465 CB PHE A 318 -7.930 14.790 96.023 1.00 9.18 C ATOM 1466 CG PHE A 318 -8.076 13.569 96.884 1.00 10.02 C ATOM 1467 CD1 PHE A 318 -9.211 12.794 96.823 1.00 11.98 C ATOM 1468 CD2 PHE A 318 -7.046 13.173 97.726 1.00 6.88 C ATOM 1469 CE1 PHE A 318 -9.342 11.670 97.600 1.00 14.31 C ATOM 1470 CE2 PHE A 318 -7.170 12.043 98.494 1.00 7.01 C ATOM 1471 CZ PHE A 318 -8.314 11.298 98.447 1.00 9.90 C ATOM 1472 H PHE A 318 -7.994 16.974 94.726 1.00 0.00 H ATOM 1473 N PHE A 319 -7.086 17.181 97.927 1.00 10.01 N ATOM 1474 CA PHE A 319 -6.413 17.517 99.198 1.00 7.51 C ATOM 1475 C PHE A 319 -6.776 18.909 99.718 1.00 14.30 C ATOM 1476 O PHE A 319 -6.285 19.347 100.763 1.00 16.17 O ATOM 1477 CB PHE A 319 -4.888 17.400 99.067 1.00 10.87 C ATOM 1478 CG PHE A 319 -4.391 15.975 99.015 1.00 7.73 C ATOM 1479 CD1 PHE A 319 -4.355 15.202 100.158 1.00 10.07 C ATOM 1480 CD2 PHE A 319 -3.963 15.411 97.832 1.00 10.28 C ATOM 1481 CE1 PHE A 319 -3.903 13.897 100.112 1.00 8.74 C ATOM 1482 CE2 PHE A 319 -3.503 14.105 97.780 1.00 8.94 C ATOM 1483 CZ PHE A 319 -3.491 13.346 98.925 1.00 9.42 C ATOM 1484 H PHE A 319 -6.693 17.542 97.034 1.00 0.00 H ATOM 1485 N HIS A 320 -7.651 19.597 99.000 1.00 12.45 N ATOM 1486 CA HIS A 320 -8.044 20.947 99.372 1.00 15.79 C ATOM 1487 C HIS A 320 -8.715 20.968 100.734 1.00 15.71 C ATOM 1488 O HIS A 320 -9.637 20.181 101.001 1.00 18.05 O ATOM 1489 CB HIS A 320 -9.039 21.481 98.349 1.00 17.36 C ATOM 1490 CG HIS A 320 -9.652 22.780 98.744 1.00 17.01 C ATOM 1491 ND1 HIS A 320 -8.965 23.968 98.672 1.00 21.98 N ATOM 1492 CD2 HIS A 320 -10.880 23.078 99.224 1.00 23.70 C ATOM 1493 CE1 HIS A 320 -9.747 24.949 99.088 1.00 24.09 C ATOM 1494 NE2 HIS A 320 -10.911 24.433 99.434 1.00 22.75 N ATOM 1495 H HIS A 320 -8.066 19.162 98.151 1.00 0.00 H ATOM 1496 N VAL A 321 -8.272 21.889 101.574 1.00 18.63 N ATOM 1497 CA VAL A 321 -8.896 22.086 102.885 1.00 24.73 C ATOM 1498 C VAL A 321 -9.529 23.473 102.953 1.00 19.71 C ATOM 1499 O VAL A 321 -8.876 24.462 102.680 1.00 24.42 O ATOM 1500 CB VAL A 321 -7.877 21.932 104.022 1.00 26.80 C ATOM 1501 CG1 VAL A 321 -8.555 22.181 105.369 1.00 26.63 C ATOM 1502 CG2 VAL A 321 -7.235 20.540 103.991 1.00 28.99 C ATOM 1503 H VAL A 321 -7.465 22.485 101.299 1.00 0.00 H ATOM 1504 N GLU A 322 -10.813 23.522 103.298 1.00 26.26 N ATOM 1505 CA GLU A 322 -11.518 24.792 103.457 1.00 33.76 C ATOM 1506 C GLU A 322 -11.043 25.510 104.713 1.00 32.18 C ATOM 1507 O GLU A 322 -10.733 24.879 105.718 1.00 25.45 O ATOM 1508 CB GLU A 322 -13.028 24.559 103.542 1.00 37.20 C ATOM 1509 CG GLU A 322 -13.712 24.387 102.191 1.00 44.97 C ATOM 1510 CD GLU A 322 -13.793 25.685 101.399 1.00 54.40 C ATOM 1511 OE1 GLU A 322 -13.232 26.704 101.857 1.00 55.12 O ATOM 1512 OE2 GLU A 322 -14.424 25.686 100.321 1.00 64.45 O ATOM 1513 H GLU A 322 -11.328 22.633 103.459 1.00 0.00 H ATOM 1514 N ASP A 323 -10.980 26.833 104.652 1.00 35.65 N ATOM 1515 CA ASP A 323 -10.615 27.622 105.821 1.00 37.71 C ATOM 1516 C ASP A 323 -11.649 27.418 106.920 1.00 29.65 C ATOM 1517 O ASP A 323 -12.821 27.160 106.647 1.00 29.35 O ATOM 1518 CB ASP A 323 -10.516 29.104 105.462 1.00 41.79 C ATOM 1519 CG ASP A 323 -9.527 29.366 104.344 1.00 52.31 C ATOM 1520 OD1 ASP A 323 -8.380 28.878 104.438 1.00 54.28 O ATOM 1521 OD2 ASP A 323 -9.902 30.051 103.368 1.00 57.19 O ATOM 1522 H ASP A 323 -11.194 27.315 103.756 1.00 0.00 H ATOM 1523 N LEU A 324 -11.197 27.504 108.167 1.00 34.14 N ATOM 1524 CA LEU A 324 -12.082 27.401 109.316 1.00 28.35 C ATOM 1525 C LEU A 324 -12.777 28.732 109.550 1.00 26.21 C ATOM 1526 O LEU A 324 -12.188 29.787 109.340 1.00 30.59 O ATOM 1527 CB LEU A 324 -11.279 27.039 110.568 1.00 28.42 C ATOM 1528 CG LEU A 324 -10.667 25.638 110.613 1.00 30.99 C ATOM 1529 CD1 LEU A 324 -9.666 25.543 111.747 1.00 39.70 C ATOM 1530 CD2 LEU A 324 -11.769 24.605 110.780 1.00 31.86 C ATOM 1531 H LEU A 324 -10.180 27.649 108.326 1.00 0.00 H ATOM 1532 N GLU A 325 -14.025 28.673 110.003 1.00 25.08 N ATOM 1533 CA GLU A 325 -14.742 29.876 110.396 1.00 34.12 C ATOM 1534 C GLU A 325 -14.111 30.412 111.673 1.00 35.02 C ATOM 1535 O GLU A 325 -13.570 29.648 112.472 1.00 29.82 O ATOM 1536 CB GLU A 325 -16.225 29.565 110.608 1.00 31.95 C ATOM 1537 CG GLU A 325 -16.889 28.936 109.386 1.00 41.59 C ATOM 1538 CD GLU A 325 -18.343 28.574 109.627 1.00 52.29 C ATOM 1539 OE1 GLU A 325 -18.951 29.155 110.554 1.00 54.98 O ATOM 1540 OE2 GLU A 325 -18.874 27.709 108.894 1.00 50.89 O ATOM 1541 H GLU A 325 -14.498 27.750 110.078 1.00 0.00 H ATOM 1542 N GLY A 326 -14.157 31.726 111.857 1.00 42.04 N ATOM 1543 CA GLY A 326 -13.565 32.346 113.030 1.00 37.35 C ATOM 1544 C GLY A 326 -12.050 32.244 113.043 1.00 41.46 C ATOM 1545 O GLY A 326 -11.444 31.621 112.167 1.00 49.25 O ATOM 1546 H GLY A 326 -14.626 32.324 111.147 1.00 0.00 H TER 1547 GLY A 326 HETATM 1548 O HOH 1 3.171 23.862 84.762 1.00 31.49 O HETATM 1549 O HOH 2 16.401 2.927 85.878 1.00 34.32 O HETATM 1550 O HOH 3 2.556 -1.836 97.842 1.00 30.02 O HETATM 1551 O HOH 4 -3.850 0.481 89.487 1.00 26.79 O HETATM 1552 O HOH 5 12.016 12.835 80.521 1.00 31.74 O HETATM 1553 O HOH 6 4.939 6.821 77.244 1.00 24.38 O HETATM 1554 O HOH 7 0.874 11.921 106.567 1.00 17.64 O HETATM 1555 O HOH 8 15.415 4.750 88.634 1.00 28.46 O HETATM 1556 O HOH 9 28.937 9.979 98.142 1.00 35.69 O HETATM 1557 O HOH 10 10.622 24.976 94.419 1.00 12.15 O HETATM 1558 O HOH 11 5.345 -0.722 106.127 1.00 32.16 O HETATM 1559 O HOH 12 8.819 7.470 114.420 1.00 16.36 O HETATM 1560 O HOH 13 -1.491 6.411 102.422 1.00 18.94 O HETATM 1561 O HOH 14 5.494 11.334 76.510 1.00 22.18 O HETATM 1562 O HOH 15 -5.284 18.909 85.558 1.00 19.84 O HETATM 1563 O HOH 16 16.313 -2.986 90.985 1.00 29.05 O HETATM 1564 O HOH 17 2.335 24.370 101.082 1.00 25.87 O HETATM 1565 O HOH 18 11.135 11.715 108.260 1.00 17.73 O HETATM 1566 O HOH 19 8.548 22.142 103.000 1.00 22.04 O HETATM 1567 O HOH 20 3.349 19.914 106.253 1.00 28.07 O HETATM 1568 O HOH 21 15.523 29.721 90.018 1.00 30.33 O HETATM 1569 O HOH 22 20.233 3.989 101.054 1.00 23.78 O HETATM 1570 O HOH 23 9.467 21.426 100.381 1.00 19.77 O HETATM 1571 O HOH 24 4.653 28.557 76.595 1.00 35.74 O HETATM 1572 O HOH 25 4.854 30.045 88.147 1.00 27.57 O HETATM 1573 O HOH 26 22.520 -0.842 96.495 1.00 42.19 O HETATM 1574 O HOH 27 2.506 -3.438 96.130 1.00 23.97 O HETATM 1575 O HOH 28 -4.910 20.993 97.791 1.00 13.32 O HETATM 1576 O HOH 29 20.116 16.312 102.670 1.00 31.69 O HETATM 1577 O HOH 30 9.851 -4.598 88.573 1.00 18.74 O HETATM 1578 O HOH 31 3.494 5.123 111.699 1.00 17.88 O HETATM 1579 O HOH 32 20.093 16.710 90.263 1.00 29.75 O HETATM 1580 O HOH 33 -0.155 4.473 81.423 1.00 13.03 O HETATM 1581 O HOH 34 4.327 3.276 108.496 1.00 13.31 O HETATM 1582 O HOH 35 0.969 8.892 101.578 1.00 9.45 O HETATM 1583 O HOH 36 26.678 14.325 92.475 1.00 34.82 O HETATM 1584 O HOH 37 -0.083 -0.458 100.594 1.00 32.85 O HETATM 1585 O HOH 38 -0.763 1.789 92.572 1.00 19.27 O HETATM 1586 O HOH 39 15.871 -2.458 106.542 1.00 39.78 O HETATM 1587 O HOH 40 -9.229 17.462 101.398 1.00 30.06 O HETATM 1588 O HOH 41 11.491 4.790 85.790 1.00 25.31 O HETATM 1589 O HOH 42 12.757 5.504 83.701 1.00 34.13 O HETATM 1590 O HOH 43 0.073 0.069 83.546 1.00 18.68 O HETATM 1591 O HOH 44 -1.850 -5.329 91.674 1.00 20.65 O HETATM 1592 O HOH 45 9.757 -0.174 105.142 1.00 21.20 O HETATM 1593 O HOH 46 13.619 2.266 110.959 1.00 20.03 O HETATM 1594 O HOH 47 18.226 18.277 102.823 1.00 30.36 O HETATM 1595 O HOH 48 2.959 29.590 84.131 1.00 30.92 O HETATM 1596 O HOH 49 12.609 23.333 93.509 1.00 12.81 O HETATM 1597 O HOH 50 14.873 24.233 94.747 1.00 17.25 O HETATM 1598 O HOH 51 13.909 20.316 103.205 1.00 37.26 O HETATM 1599 O HOH 52 5.110 21.644 105.148 1.00 24.67 O HETATM 1600 O HOH 53 -6.831 2.594 85.216 1.00 35.51 O HETATM 1601 O HOH 54 -3.040 2.880 101.081 1.00 15.90 O HETATM 1602 O HOH 55 11.935 5.841 113.721 1.00 29.70 O HETATM 1603 O HOH 56 15.253 15.547 83.862 1.00 30.71 O HETATM 1604 O HOH 57 -3.010 17.540 84.986 1.00 9.60 O HETATM 1605 O HOH 58 16.453 11.082 104.023 1.00 13.16 O HETATM 1606 O HOH 59 8.210 2.868 115.096 1.00 18.84 O HETATM 1607 O HOH 60 8.815 19.325 82.669 1.00 19.28 O HETATM 1608 O HOH 61 15.903 8.626 84.909 1.00 23.65 O HETATM 1609 O HOH 62 0.319 7.959 104.108 1.00 10.79 O HETATM 1610 O HOH 63 8.948 26.398 92.672 1.00 15.22 O HETATM 1611 O HOH 64 -9.173 13.120 91.837 1.00 16.28 O HETATM 1612 O HOH 65 4.193 -1.063 100.668 1.00 21.19 O HETATM 1613 O HOH 66 12.020 9.495 116.120 1.00 30.68 O HETATM 1614 O HOH 67 28.953 7.263 97.678 1.00 42.87 O HETATM 1615 O HOH 68 -10.385 15.219 93.096 1.00 21.99 O HETATM 1616 O HOH 69 -8.452 2.737 91.957 1.00 35.37 O HETATM 1617 O HOH 70 -7.629 8.496 95.523 1.00 13.05 O HETATM 1618 O HOH 71 6.997 12.321 77.115 1.00 33.37 O HETATM 1619 O HOH 72 0.000 16.945 106.049 1.00 27.59 O HETATM 1620 O HOH 73 26.262 17.045 95.772 1.00 34.83 O HETATM 1621 O HOH 74 6.124 8.256 113.112 1.00 7.68 O HETATM 1622 O HOH 75 21.351 16.442 87.586 1.00 34.18 O HETATM 1623 O HOH 76 20.329 18.469 92.310 1.00 40.47 O HETATM 1624 O HOH 77 9.233 16.039 106.634 1.00 22.43 O HETATM 1625 O HOH 78 14.810 5.387 84.616 1.00 32.97 O HETATM 1626 O HOH 79 -12.451 12.829 88.580 1.00 28.73 O HETATM 1627 O HOH 80 10.265 34.436 88.122 1.00 26.71 O HETATM 1628 O HOH 81 13.964 10.605 109.168 1.00 32.91 O HETATM 1629 O HOH 82 -0.899 14.544 78.246 1.00 16.16 O HETATM 1630 O HOH 83 15.535 -0.311 87.515 1.00 25.28 O HETATM 1631 O HOH 84 21.610 -0.530 87.834 1.00 35.07 O HETATM 1632 O HOH 85 10.251 17.600 104.665 1.00 32.99 O HETATM 1633 O HOH 86 -1.884 28.705 84.620 1.00 21.94 O HETATM 1634 O HOH 87 0.521 29.901 93.161 1.00 39.89 O HETATM 1635 O HOH 88 -7.032 23.949 85.068 1.00 34.25 O HETATM 1636 O HOH 89 7.171 5.779 112.062 1.00 13.21 O HETATM 1637 O HOH 90 -3.141 26.181 85.530 1.00 23.85 O HETATM 1638 O HOH 91 -5.664 17.359 102.904 1.00 18.48 O HETATM 1639 O HOH 92 -6.066 1.081 90.513 1.00 31.47 O HETATM 1640 O HOH 93 -2.567 12.490 79.197 1.00 14.96 O HETATM 1641 O HOH 94 -2.687 3.657 81.858 1.00 17.05 O HETATM 1642 O HOH 95 6.629 3.817 110.058 1.00 10.12 O HETATM 1643 O HOH 96 -3.323 0.569 86.878 1.00 31.45 O HETATM 1644 O HOH 97 21.094 7.542 88.172 1.00 35.31 O HETATM 1645 O HOH 98 -4.825 1.824 87.945 1.00 31.61 O HETATM 1646 O HOH 99 21.589 23.619 100.014 1.00 38.18 O HETATM 1647 O HOH 100 11.466 14.086 106.856 1.00 27.03 O HETATM 1648 O HOH 101 -1.395 16.546 76.366 1.00 31.33 O HETATM 1649 O HOH 102 30.483 12.782 96.353 1.00 34.02 O HETATM 1650 O HOH 103 -2.148 -2.242 97.041 1.00 24.19 O HETATM 1651 O HOH 104 -4.392 1.435 99.488 1.00 17.99 O HETATM 1652 O HOH 105 -3.385 21.485 85.004 1.00 18.62 O HETATM 1653 O HOH 106 -8.137 27.572 108.848 1.00 47.15 O HETATM 1654 O HOH 107 -4.032 3.424 85.033 1.00 15.95 O HETATM 1655 O HOH 108 17.540 -1.585 94.431 1.00 36.82 O HETATM 1656 O HOH 109 17.950 18.969 87.503 1.00 36.14 O HETATM 1657 O HOH 110 -10.531 5.660 88.064 1.00 31.58 O HETATM 1658 O HOH 111 -9.560 9.859 94.081 1.00 21.85 O HETATM 1659 O HOH 112 -5.594 26.177 89.407 1.00 35.90 O HETATM 1660 O HOH 113 27.713 11.226 104.077 1.00 28.76 O HETATM 1661 O HOH 114 27.574 4.275 89.496 1.00 39.35 O HETATM 1662 O HOH 115 -8.640 3.824 86.119 1.00 33.07 O HETATM 1663 O HOH 116 16.556 25.191 87.723 1.00 42.14 O HETATM 1664 O HOH 117 -11.331 14.591 90.707 1.00 36.33 O HETATM 1665 O HOH 118 0.000 14.498 106.049 1.00 26.99 O HETATM 1666 O HOH 119 19.081 12.316 104.512 1.00 21.36 O HETATM 1667 O HOH 120 11.953 -0.847 85.464 1.00 26.15 O HETATM 1668 O HOH 121 15.149 12.922 105.664 1.00 25.56 O HETATM 1669 O HOH 122 -5.478 23.710 97.788 1.00 31.19 O HETATM 1670 O HOH 123 17.989 14.370 84.449 1.00 21.62 O HETATM 1671 O HOH 124 0.000 9.755 106.049 1.00 27.19 O HETATM 1672 O HOH 125 7.197 1.088 110.978 1.00 25.83 O HETATM 1673 O HOH 126 16.296 26.610 93.478 1.00 36.24 O HETATM 1674 O HOH 127 9.065 -0.373 109.754 1.00 33.24 O HETATM 1675 O HOH 128 6.750 29.426 91.168 1.00 39.59 O HETATM 1676 O HOH 129 18.989 14.857 105.085 1.00 33.79 O HETATM 1677 O HOH 130 3.467 23.794 103.610 1.00 33.73 O HETATM 1678 O HOH 131 -11.936 15.203 95.358 1.00 27.94 O HETATM 1679 O HOH 132 23.961 8.880 105.431 1.00 36.77 O HETATM 1680 O HOH 133 -9.500 5.598 94.821 1.00 31.46 O HETATM 1681 O HOH 134 -2.868 -0.966 99.364 1.00 33.06 O HETATM 1682 O HOH 135 21.647 4.240 103.544 1.00 27.31 O HETATM 1683 O HOH 136 -7.255 0.151 98.768 1.00 36.79 O HETATM 1684 O HOH 137 3.394 -1.905 103.276 1.00 36.86 O HETATM 1685 O HOH 138 30.395 -0.102 99.473 1.00 27.15 O HETATM 1686 O HOH 139 17.762 30.560 88.794 1.00 22.37 O HETATM 1687 O HOH 140 6.442 27.505 92.825 1.00 36.11 O HETATM 1688 O HOH 141 10.389 -3.337 85.918 1.00 24.44 O HETATM 1689 O HOH 142 6.801 -0.616 109.212 1.00 35.46 O HETATM 1690 O HOH 143 11.560 15.089 79.399 1.00 34.61 O HETATM 1691 O HOH 144 9.761 18.941 80.496 1.00 31.02 O HETATM 1692 O HOH 145 26.050 9.457 105.745 1.00 25.14 O HETATM 1693 O HOH 146 31.041 1.045 96.986 1.00 33.22 O HETATM 1694 O HOH 147 -2.440 -1.266 103.480 1.00 32.72 O HETATM 1695 O HOH 148 -4.498 11.349 77.587 1.00 33.65 O HETATM 1696 O HOH 149 3.582 -3.531 99.559 1.00 33.11 O HETATM 1697 C01 N A 0 -0.666 1.831 103.965 1.00 -0.06 C HETATM 1698 C02 N A 0 0.206 3.062 103.916 1.00 -0.03 C HETATM 1699 C03 N A 0 1.292 2.935 102.805 1.00 0.10 C HETATM 1700 C04 N A 0 2.468 3.835 103.261 1.00 -0.02 C HETATM 1701 C05 N A 0 3.436 3.111 104.171 1.00 -0.03 C HETATM 1702 C06 N A 0 4.352 2.216 103.408 1.00 -0.10 C HETATM 1703 C07 N A 0 5.604 2.030 103.795 1.00 -0.07 C HETATM 1704 C08 N A 0 6.462 0.978 103.167 1.00 0.08 C HETATM 1705 O09 N A 0 6.867 0.150 104.276 1.00 -0.38 O HETATM 1706 H14 N A 0 6.097 -0.218 104.693 1.00 0.21 H HETATM 1707 C10 N A 0 7.686 1.520 102.440 1.00 -0.00 C HETATM 1708 C11 N A 0 8.427 2.735 103.027 1.00 -0.05 C HETATM 1709 C12 N A 0 8.626 3.268 101.582 1.00 -0.05 C HETATM 1710 C13 N A 0 7.450 2.361 101.157 1.00 -0.01 C HETATM 1711 C14 N A 0 7.595 1.506 99.901 1.00 0.03 C HETATM 1712 N15 N A 0 7.321 2.245 98.619 1.00 -0.32 N HETATM 1713 C16 N A 0 8.383 3.137 98.167 1.00 0.01 C HETATM 1714 C17 N A 0 8.796 2.764 96.726 1.00 0.00 C HETATM 1715 C18 N A 0 9.426 1.346 96.691 1.00 -0.07 C HETATM 1716 C19 N A 0 10.863 1.385 97.210 1.00 -0.05 C HETATM 1717 C20 N A 0 11.686 2.182 96.203 1.00 -0.00 C HETATM 1718 C21 N A 0 11.104 3.535 95.951 1.00 -0.02 C HETATM 1719 C22 N A 0 11.953 4.501 95.446 1.00 -0.02 C HETATM 1720 C23 N A 0 11.463 5.777 95.193 1.00 0.06 C HETATM 1721 CL24 N A 0 12.561 6.994 94.573 1.00 -0.04 CL HETATM 1722 C25 N A 0 10.153 6.113 95.405 1.00 -0.03 C HETATM 1723 C26 N A 0 9.301 5.135 95.929 1.00 -0.05 C HETATM 1724 C27 N A 0 9.761 3.825 96.190 1.00 -0.04 C HETATM 1725 H33 N A 0 8.268 5.387 96.139 1.00 0.08 H HETATM 1726 H32 N A 0 9.787 7.107 95.174 1.00 0.07 H HETATM 1727 H31 N A 0 12.993 4.266 95.249 1.00 0.06 H HETATM 1728 H29 N A 0 11.720 1.627 95.254 1.00 0.05 H HETATM 1729 H30 N A 0 12.707 2.302 96.594 1.00 0.05 H HETATM 1730 H27 N A 0 11.260 0.363 97.296 1.00 0.03 H HETATM 1731 H28 N A 0 10.895 1.875 98.194 1.00 0.03 H HETATM 1732 H25 N A 0 9.425 0.975 95.655 1.00 0.02 H HETATM 1733 H26 N A 0 8.831 0.670 97.323 1.00 0.02 H HETATM 1734 C28 N A 0 7.530 2.704 95.861 1.00 0.05 C HETATM 1735 O29 N A 0 6.614 3.761 96.242 1.00 -0.33 O HETATM 1736 C30 N A 0 5.674 3.380 97.173 1.00 0.11 C HETATM 1737 C31 N A 0 4.351 3.786 96.892 1.00 -0.04 C HETATM 1738 C32 N A 0 3.328 3.461 97.764 1.00 -0.06 C HETATM 1739 C33 N A 0 3.632 2.705 98.887 1.00 0.03 C HETATM 1740 C34 N A 0 4.907 2.290 99.183 1.00 -0.03 C HETATM 1741 C35 N A 0 5.987 2.625 98.327 1.00 0.08 C HETATM 1742 H38 N A 0 5.089 1.703 100.076 1.00 0.05 H HETATM 1743 C36 N A 0 2.605 2.315 99.855 1.00 0.21 C HETATM 1744 O37 N A 0 2.453 1.206 100.337 1.00 -0.39 O HETATM 1745 N38 N A 0 1.805 3.390 100.238 1.00 -0.16 N HETATM 1746 S39 N A 0 0.563 3.302 101.298 1.00 0.06 S HETATM 1747 O40 N A 0 -0.283 2.267 100.869 1.00 -0.15 O HETATM 1748 O41 N A 0 0.075 4.652 101.359 1.00 -0.15 O HETATM 1749 H39 N A 0 2.006 4.282 99.834 1.00 0.21 H HETATM 1750 H37 N A 0 2.312 3.789 97.575 1.00 0.05 H HETATM 1751 H36 N A 0 4.137 4.352 95.993 1.00 0.05 H HETATM 1752 H34 N A 0 7.039 1.730 96.002 1.00 0.05 H HETATM 1753 H35 N A 0 7.806 2.826 94.803 1.00 0.05 H HETATM 1754 H23 N A 0 9.252 3.038 98.834 1.00 0.04 H HETATM 1755 H24 N A 0 8.022 4.176 98.187 1.00 0.04 H HETATM 1756 H21 N A 0 6.889 0.665 99.972 1.00 0.05 H HETATM 1757 H22 N A 0 8.624 1.119 99.863 1.00 0.05 H HETATM 1758 H20 N A 0 6.487 2.891 101.120 1.00 0.03 H HETATM 1759 H18 N A 0 9.593 3.009 101.127 1.00 0.03 H HETATM 1760 H19 N A 0 8.441 4.346 101.461 1.00 0.03 H HETATM 1761 H16 N A 0 9.361 2.487 103.552 1.00 0.03 H HETATM 1762 H17 N A 0 7.807 3.379 103.667 1.00 0.03 H HETATM 1763 H15 N A 0 8.357 0.665 102.268 1.00 0.03 H HETATM 1764 H13 N A 0 5.864 0.395 102.451 1.00 0.07 H HETATM 1765 H12 N A 0 6.017 2.655 104.585 1.00 0.05 H HETATM 1766 H11 N A 0 3.985 1.707 102.518 1.00 0.05 H HETATM 1767 H9 N A 0 2.864 2.506 104.889 1.00 0.04 H HETATM 1768 H10 N A 0 4.037 3.855 104.715 1.00 0.04 H HETATM 1769 H7 N A 0 2.059 4.702 103.800 1.00 0.03 H HETATM 1770 H8 N A 0 3.013 4.181 102.370 1.00 0.03 H HETATM 1771 H6 N A 0 1.656 1.898 102.754 1.00 0.06 H HETATM 1772 H4 N A 0 0.701 3.191 104.890 1.00 0.03 H HETATM 1773 H5 N A 0 -0.423 3.940 103.706 1.00 0.03 H HETATM 1774 H1 N A 0 -1.421 1.948 104.756 1.00 0.02 H HETATM 1775 H2 N A 0 -0.044 0.949 104.180 1.00 0.02 H HETATM 1776 H3 N A 0 -1.168 1.698 102.995 1.00 0.02 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 1697 1698 1774 1775 1776 CONECT 1698 1697 1699 1772 1773 CONECT 1699 1698 1700 1746 1771 CONECT 1700 1699 1701 1769 1770 CONECT 1701 1700 1702 1767 1768 CONECT 1702 1701 1703 1766 CONECT 1703 1702 1704 1765 CONECT 1704 1703 1705 1707 1764 CONECT 1705 1704 1706 CONECT 1706 1705 CONECT 1707 1704 1708 1710 1763 CONECT 1708 1707 1709 1761 1762 CONECT 1709 1708 1710 1759 1760 CONECT 1710 1707 1709 1711 1758 CONECT 1711 1710 1712 1756 1757 CONECT 1712 1711 1713 1741 CONECT 1713 1712 1714 1754 1755 CONECT 1714 1713 1715 1724 1734 CONECT 1715 1714 1716 1732 1733 CONECT 1716 1715 1717 1730 1731 CONECT 1717 1716 1718 1728 1729 CONECT 1718 1717 1719 1724 CONECT 1719 1718 1720 1727 CONECT 1720 1719 1721 1722 CONECT 1721 1720 CONECT 1722 1720 1723 1726 CONECT 1723 1722 1724 1725 CONECT 1724 1714 1718 1723 CONECT 1725 1723 CONECT 1726 1722 CONECT 1727 1719 CONECT 1728 1717 CONECT 1729 1717 CONECT 1730 1716 CONECT 1731 1716 CONECT 1732 1715 CONECT 1733 1715 CONECT 1734 1714 1735 1752 1753 CONECT 1735 1734 1736 CONECT 1736 1735 1737 1741 CONECT 1737 1736 1738 1751 CONECT 1738 1737 1739 1750 CONECT 1739 1738 1740 1743 CONECT 1740 1739 1741 1742 CONECT 1741 1712 1736 1740 CONECT 1742 1740 CONECT 1743 1739 1744 1745 CONECT 1744 1743 CONECT 1745 1743 1746 1749 CONECT 1746 1699 1745 1747 1748 CONECT 1747 1746 CONECT 1748 1746 CONECT 1749 1745 CONECT 1750 1738 CONECT 1751 1737 CONECT 1752 1734 CONECT 1753 1734 CONECT 1754 1713 CONECT 1755 1713 CONECT 1756 1711 CONECT 1757 1711 CONECT 1758 1710 CONECT 1759 1709 CONECT 1760 1709 CONECT 1761 1708 CONECT 1762 1708 CONECT 1763 1707 CONECT 1764 1704 CONECT 1765 1703 CONECT 1766 1702 CONECT 1767 1701 CONECT 1768 1701 CONECT 1769 1700 CONECT 1770 1700 CONECT 1771 1699 CONECT 1772 1698 CONECT 1773 1698 CONECT 1774 1697 CONECT 1775 1697 CONECT 1776 1697 MASTER 0 0 0 0 0 0 0 0 1775 1 84 12 END
Display Options:
Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 6oqb
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3wix
RCSB PDB
PDBbind
161aa, >3WIX_1|Chains... at 90%
3wiy
RCSB PDB
PDBbind
161aa, >3WIY_1|Chains... at 90%
4hw2
RCSB PDB
PDBbind
153aa, >4HW2_1|Chains... at 96%
4hw3
RCSB PDB
PDBbind
153aa, >4HW3_1|Chains... at 96%
4oq6
RCSB PDB
PDBbind
157aa, >4OQ6_1|Chains... at 92%
4wgi
RCSB PDB
PDBbind
518aa, >4WGI_1|Chain... *
4wmu
RCSB PDB
PDBbind
518aa, >4WMU_1|Chain... at 100%
4wmv
RCSB PDB
PDBbind
518aa, >4WMV_1|Chain... at 100%
4wmx
RCSB PDB
PDBbind
518aa, >4WMX_1|Chain... at 100%
4zbf
RCSB PDB
PDBbind
157aa, >4ZBF_1|Chains... at 93%
4zbi
RCSB PDB
PDBbind
157aa, >4ZBI_1|Chains... at 93%
5fdo
RCSB PDB
PDBbind
150aa, >5FDO_1|Chains... at 97%
5fdr
RCSB PDB
PDBbind
158aa, >5FDR_1|Chains... at 92%
5iez
RCSB PDB
PDBbind
159aa, >5IEZ_1|Chains... at 91%
5if4
RCSB PDB
PDBbind
159aa, >5IF4_1|Chains... at 91%
5vkc
RCSB PDB
PDBbind
157aa, >5VKC_1|Chains... at 92%
6b4l
RCSB PDB
PDBbind
157aa, >6B4L_1|Chains... at 92%
6b4u
RCSB PDB
PDBbind
157aa, >6B4U_1|Chain... at 92%
6bw2
RCSB PDB
PDBbind
158aa, >6BW2_1|Chains... at 92%
6bw8
RCSB PDB
PDBbind
158aa, >6BW8_1|Chains... at 92%
6dm8
RCSB PDB
PDBbind
518aa, >6DM8_1|Chains... at 96%
6fs1
RCSB PDB
PDBbind
150aa, >6FS1_1|Chains... at 92%
6qz7
RCSB PDB
PDBbind
518aa, >6QZ7_1|Chain... at 99%
6qyo
RCSB PDB
PDBbind
518aa, >6QYO_1|Chain... at 99%
6qyn
RCSB PDB
PDBbind
518aa, >6QYN_1|Chain... at 99%
6qyl
RCSB PDB
PDBbind
518aa, >6QYL_1|Chain... at 99%
6qyk
RCSB PDB
PDBbind
518aa, >6QYK_1|Chain... at 99%
6qxj
RCSB PDB
PDBbind
518aa, >6QXJ_1|Chain... at 99%
6p3p
RCSB PDB
PDBbind
157aa, >6P3P_1|Chain... at 92%
6oqn
RCSB PDB
PDBbind
157aa, >6OQN_1|Chains... at 92%
6oqd
RCSB PDB
PDBbind
157aa, >6OQD_1|Chain... at 92%
6oqc
RCSB PDB
PDBbind
157aa, >6OQC_1|Chains... at 92%
6o6g
RCSB PDB
PDBbind
156aa, >6O6G_1|Chain... at 93%
6o6f
RCSB PDB
PDBbind
158aa, >6O6F_1|Chains... at 92%
6ne5
RCSB PDB
PDBbind
159aa, >6NE5_1|Chains... at 91%
6ud2
RCSB PDB
PDBbind
157aa, >6UD2_1|Chain... at 92%
6udi
RCSB PDB
PDBbind
157aa, >6UDI_1|Chain... at 92%
6udt
RCSB PDB
PDBbind
157aa, >6UDT_1|Chain... at 92%
6udu
RCSB PDB
PDBbind
157aa, >6UDU_1|Chain... at 92%
6udv
RCSB PDB
PDBbind
157aa, >6UDV_1|Chain... at 92%
6udx
RCSB PDB
PDBbind
157aa, >6UDX_1|Chains... at 92%
6udy
RCSB PDB
PDBbind
157aa, >6UDY_1|Chains... at 92%
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
6oqb
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Induced myeloid leukemia cell differentiation protein Mcl-1
Ligand Name
N0J
EC.Number
E.C.-.-.-.-
Resolution
1.6(Å)
Affinity (Kd/Ki/IC50)
Ki=0.05nM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) Cancer Discov Vol. 8: pp. 1582-1597
Ligand Properties
Formula
C
3
2
H
3
9
ClN
2
O
5
S
Molecular Weight
599.180
Exact Mass
598.227
No. of atoms
80
No. of bonds
85
Polar Surface Area
104.32
LOGP Value
6.32 (
Computed with XLOGP3
)
6.86 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 6
Canonical SMILES
CC[C@@H]1CC/C=C/[C@H](O)[C@@H]2CC[C@H]2CN2c3cc(C(=O)NS1(=O)=O)ccc3OC[C@@]1(C2)CCCc2c1ccc(c2)Cl
InChI String
InChI=1S/C32H39ClN2O5S/c1-2-25-7-3-4-8-29(36)26-12-9-23(26)18-35-19-32(15-5-6-21-16-24(33)11-13-27(21)32)20-40-30-14-10-22(17-28(30)35)31(37)34-41(25,38)39/h4,8,10-11,13-14,16-17,23,25-26,29,36H,2-3,5-7,9,12,15,18-20H2,1H3,(H,34,37)/b8-4+/t23-,25+,26+,29-,32-/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):
Q07820
Entrez Gene ID
NCBI Entrez Gene ID:
4170
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝e湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com