Browse entries in the PDBbind-CN Database
HEADER 3WP0_COMPLEX COMPND 3WP0_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 181 TYR ALA ARG PRO ILE ILE ILE LEU GLY PRO THR LYS ASP SEQRES 2 A 181 ARG ALA ASN ASP ASP LEU LEU SER GLU PHE PRO ASP LYS SEQRES 3 A 181 PHE GLY SER CYS VAL PRO HIS THR THR ARG PRO LYS ARG SEQRES 4 A 181 GLU TYR GLU ILE ASP GLY ARG ASP TYR HIS PHE VAL SER SEQRES 5 A 181 SER ARG GLU LYS MET GLU LYS ASP ILE GLN ALA HIS LYS SEQRES 6 A 181 PHE ILE GLU ALA GLY GLN TYR ASN SER HIS LEU TYR GLY SEQRES 7 A 181 THR SER VAL GLN SER VAL ARG GLU VAL ALA GLU GLN GLY SEQRES 8 A 181 LYS HIS CYS ILE LEU ASP VAL SER ALA ASN ALA VAL ARG SEQRES 9 A 181 ARG LEU GLN ALA ALA HIS LEU HIS PRO ILE ALA ILE PHE SEQRES 10 A 181 ILE ARG PRO ARG SER LEU GLU ASN VAL LEU GLU ILE ASN SEQRES 11 A 181 LYS ARG ILE THR GLU GLU GLN ALA ARG LYS ALA PHE ASP SEQRES 12 A 181 ARG ALA THR LYS LEU GLU GLN GLU PHE THR GLU CYS PHE SEQRES 13 A 181 SER ALA ILE VAL GLU GLY ASP SER PHE GLU GLU ILE TYR SEQRES 14 A 181 HIS LYS VAL LYS ARG VAL ILE GLU ASP LEU SER GLY HET LEU A 331 265 ATOM 1 N TYR A 533 21.811 -21.872 -14.601 1.00 79.02 N ATOM 2 CA TYR A 533 22.838 -22.311 -13.656 1.00 71.78 C ATOM 3 C TYR A 533 22.764 -21.556 -12.315 1.00 64.86 C ATOM 4 O TYR A 533 22.890 -20.322 -12.281 1.00 58.90 O ATOM 5 CB TYR A 533 24.229 -22.155 -14.276 1.00 62.56 C ATOM 6 CG TYR A 533 25.321 -22.494 -13.304 1.00 54.64 C ATOM 7 CD1 TYR A 533 25.845 -23.770 -13.261 1.00 48.62 C ATOM 8 CD2 TYR A 533 25.814 -21.538 -12.410 1.00 69.25 C ATOM 9 CE1 TYR A 533 26.834 -24.095 -12.366 1.00 65.32 C ATOM 10 CE2 TYR A 533 26.805 -21.852 -11.492 1.00 60.25 C ATOM 11 CZ TYR A 533 27.305 -23.136 -11.480 1.00 64.82 C ATOM 12 OH TYR A 533 28.286 -23.479 -10.591 1.00 67.70 O ATOM 13 HH TYR A 533 29.083 -22.912 -10.746 1.00 0.00 H ATOM 14 HN3 TYR A 533 21.932 -20.858 -14.796 1.00 0.00 H ATOM 15 HN2 TYR A 533 20.870 -22.038 -14.190 1.00 0.00 H ATOM 16 HN1 TYR A 533 21.904 -22.410 -15.486 1.00 0.00 H ATOM 17 N ALA A 534 22.600 -22.291 -11.210 1.00 40.55 N ATOM 18 CA ALA A 534 22.411 -21.654 -9.906 1.00 40.73 C ATOM 19 C ALA A 534 23.697 -21.739 -9.117 1.00 42.64 C ATOM 20 O ALA A 534 24.279 -22.821 -8.992 1.00 36.52 O ATOM 21 CB ALA A 534 21.278 -22.326 -9.130 1.00 38.28 C ATOM 22 H ALA A 534 22.607 -23.329 -11.278 1.00 0.00 H ATOM 23 N ARG A 535 24.139 -20.617 -8.561 1.00 37.47 N ATOM 24 CA ARG A 535 25.391 -20.624 -7.819 1.00 32.90 C ATOM 25 C ARG A 535 25.264 -21.402 -6.526 1.00 36.09 C ATOM 26 O ARG A 535 24.274 -21.238 -5.794 1.00 33.19 O ATOM 27 CB ARG A 535 25.861 -19.175 -7.564 1.00 29.45 C ATOM 28 CG ARG A 535 26.199 -18.432 -8.912 1.00 33.26 C ATOM 29 CD ARG A 535 26.665 -17.011 -8.612 1.00 37.81 C ATOM 30 NE ARG A 535 27.884 -17.003 -7.788 1.00 35.33 N ATOM 31 CZ ARG A 535 28.471 -15.891 -7.325 1.00 34.35 C ATOM 32 NH1 ARG A 535 27.929 -14.701 -7.589 1.00 33.33 N ATOM 33 NH2 ARG A 535 29.591 -15.965 -6.594 1.00 28.95 N ATOM 34 HE ARG A 535 28.317 -17.918 -7.550 1.00 0.00 H ATOM 35 HH12 ARG A 535 28.379 -13.834 -7.233 1.00 0.00 H ATOM 36 HH11 ARG A 535 27.056 -14.640 -8.151 1.00 0.00 H ATOM 37 HH22 ARG A 535 30.039 -15.096 -6.239 1.00 0.00 H ATOM 38 HH21 ARG A 535 30.013 -16.892 -6.381 1.00 0.00 H ATOM 39 H ARG A 535 23.593 -19.737 -8.655 1.00 0.00 H ATOM 40 N PRO A 536 26.266 -22.258 -6.230 1.00 30.61 N ATOM 41 CA PRO A 536 26.312 -22.997 -4.960 1.00 34.05 C ATOM 42 C PRO A 536 26.615 -22.050 -3.775 1.00 35.71 C ATOM 43 O PRO A 536 27.224 -20.982 -3.969 1.00 32.52 O ATOM 44 CB PRO A 536 27.451 -24.013 -5.172 1.00 31.15 C ATOM 45 CG PRO A 536 28.281 -23.453 -6.282 1.00 30.48 C ATOM 46 CD PRO A 536 27.366 -22.616 -7.146 1.00 33.03 C ATOM 47 N ILE A 537 26.186 -22.440 -2.581 1.00 30.76 N ATOM 48 CA ILE A 537 26.266 -21.578 -1.399 1.00 33.28 C ATOM 49 C ILE A 537 27.148 -22.198 -0.317 1.00 34.15 C ATOM 50 O ILE A 537 26.979 -23.380 0.032 1.00 32.38 O ATOM 51 CB ILE A 537 24.873 -21.384 -0.746 1.00 35.02 C ATOM 52 CG1 ILE A 537 23.807 -20.928 -1.762 1.00 41.19 C ATOM 53 CG2 ILE A 537 24.970 -20.441 0.462 1.00 32.59 C ATOM 54 CD1 ILE A 537 24.123 -19.679 -2.512 1.00 39.85 C ATOM 55 H ILE A 537 25.778 -23.392 -2.481 1.00 0.00 H ATOM 56 N ILE A 538 28.081 -21.416 0.231 1.00 30.96 N ATOM 57 CA ILE A 538 28.812 -21.856 1.422 1.00 30.48 C ATOM 58 C ILE A 538 28.700 -20.778 2.477 1.00 32.01 C ATOM 59 O ILE A 538 29.321 -19.722 2.343 1.00 33.78 O ATOM 60 CB ILE A 538 30.313 -22.080 1.088 1.00 28.07 C ATOM 61 CG1 ILE A 538 30.440 -23.139 -0.024 1.00 32.00 C ATOM 62 CG2 ILE A 538 31.083 -22.542 2.324 1.00 29.05 C ATOM 63 CD1 ILE A 538 31.861 -23.321 -0.571 1.00 38.85 C ATOM 64 H ILE A 538 28.290 -20.488 -0.190 1.00 0.00 H ATOM 65 N ILE A 539 27.953 -21.062 3.555 1.00 30.67 N ATOM 66 CA ILE A 539 27.814 -20.132 4.665 1.00 27.81 C ATOM 67 C ILE A 539 28.818 -20.568 5.741 1.00 38.39 C ATOM 68 O ILE A 539 28.943 -21.777 6.008 1.00 30.23 O ATOM 69 CB ILE A 539 26.354 -20.118 5.206 1.00 30.04 C ATOM 70 CG1 ILE A 539 25.364 -19.772 4.068 1.00 32.10 C ATOM 71 CG2 ILE A 539 26.213 -19.115 6.368 1.00 27.45 C ATOM 72 CD1 ILE A 539 23.916 -19.897 4.503 1.00 34.08 C ATOM 73 H ILE A 539 27.458 -21.976 3.598 1.00 0.00 H ATOM 74 N LEU A 540 29.526 -19.594 6.337 1.00 35.33 N ATOM 75 CA LEU A 540 30.565 -19.845 7.344 1.00 35.86 C ATOM 76 C LEU A 540 30.364 -18.937 8.539 1.00 36.85 C ATOM 77 O LEU A 540 29.732 -17.876 8.409 1.00 34.40 O ATOM 78 CB LEU A 540 31.956 -19.552 6.744 1.00 35.60 C ATOM 79 CG LEU A 540 32.257 -20.321 5.450 1.00 40.99 C ATOM 80 CD1 LEU A 540 33.295 -19.589 4.597 1.00 45.50 C ATOM 81 CD2 LEU A 540 32.686 -21.762 5.770 1.00 38.70 C ATOM 82 H LEU A 540 29.327 -18.609 6.071 1.00 0.00 H ATOM 83 N GLY A 541 30.933 -19.332 9.683 1.00 33.87 N ATOM 84 CA GLY A 541 30.872 -18.558 10.899 1.00 28.41 C ATOM 85 C GLY A 541 29.777 -19.086 11.820 1.00 37.99 C ATOM 86 O GLY A 541 29.053 -20.027 11.453 1.00 39.48 O ATOM 87 H GLY A 541 31.443 -20.238 9.697 1.00 0.00 H ATOM 88 N PRO A 542 29.630 -18.478 13.005 1.00 37.53 N ATOM 89 CA PRO A 542 28.659 -18.967 14.008 1.00 42.59 C ATOM 90 C PRO A 542 27.223 -18.941 13.444 1.00 43.00 C ATOM 91 O PRO A 542 26.934 -18.041 12.640 1.00 41.52 O ATOM 92 CB PRO A 542 28.841 -18.007 15.191 1.00 41.71 C ATOM 93 CG PRO A 542 29.568 -16.834 14.662 1.00 50.33 C ATOM 94 CD PRO A 542 30.341 -17.262 13.446 1.00 41.46 C ATOM 95 N THR A 543 26.385 -19.921 13.824 1.00 42.12 N ATOM 96 CA THR A 543 25.002 -20.103 13.294 1.00 42.10 C ATOM 97 C THR A 543 24.827 -20.600 11.851 1.00 42.53 C ATOM 98 O THR A 543 23.688 -20.710 11.372 1.00 39.51 O ATOM 99 CB THR A 543 24.023 -18.902 13.562 1.00 48.11 C ATOM 100 OG1 THR A 543 24.192 -17.886 12.562 1.00 45.07 O ATOM 101 CG2 THR A 543 24.185 -18.344 14.977 1.00 47.17 C ATOM 102 HG1 THR A 543 25.124 -17.554 12.585 1.00 0.00 H ATOM 103 H THR A 543 26.724 -20.599 14.536 1.00 0.00 H ATOM 104 N LYS A 544 25.927 -20.842 11.131 1.00 38.94 N ATOM 105 CA LYS A 544 25.823 -21.231 9.736 1.00 33.98 C ATOM 106 C LYS A 544 25.001 -22.519 9.541 1.00 36.55 C ATOM 107 O LYS A 544 24.307 -22.660 8.525 1.00 33.85 O ATOM 108 CB LYS A 544 27.211 -21.332 9.065 1.00 37.04 C ATOM 109 CG LYS A 544 28.118 -22.482 9.589 1.00 41.89 C ATOM 110 CD LYS A 544 27.989 -23.734 8.732 1.00 42.29 C ATOM 111 CE LYS A 544 29.094 -24.742 9.062 1.00 44.57 C ATOM 112 NZ LYS A 544 29.931 -25.017 7.856 1.00 47.63 N ATOM 113 HZ1 LYS A 544 29.332 -25.408 7.101 1.00 0.00 H ATOM 114 HZ2 LYS A 544 30.368 -24.132 7.530 1.00 0.00 H ATOM 115 HZ3 LYS A 544 30.674 -25.702 8.100 1.00 0.00 H ATOM 116 H LYS A 544 26.864 -20.751 11.573 1.00 0.00 H ATOM 117 N ASP A 545 25.087 -23.448 10.490 1.00 34.52 N ATOM 118 CA ASP A 545 24.365 -24.719 10.350 1.00 39.04 C ATOM 119 C ASP A 545 22.867 -24.465 10.406 1.00 38.68 C ATOM 120 O ASP A 545 22.103 -25.038 9.610 1.00 35.94 O ATOM 121 CB ASP A 545 24.766 -25.732 11.437 1.00 37.65 C ATOM 122 CG ASP A 545 26.184 -26.275 11.235 1.00 35.28 C ATOM 123 OD1 ASP A 545 26.542 -26.563 10.080 1.00 36.68 O ATOM 124 OD2 ASP A 545 26.949 -26.377 12.216 1.00 48.04 O ATOM 125 H ASP A 545 25.668 -23.273 11.335 1.00 0.00 H ATOM 126 N ARG A 546 22.458 -23.582 11.321 1.00 34.50 N ATOM 127 CA ARG A 546 21.049 -23.226 11.459 1.00 38.41 C ATOM 128 C ARG A 546 20.543 -22.499 10.209 1.00 40.78 C ATOM 129 O ARG A 546 19.403 -22.722 9.784 1.00 45.63 O ATOM 130 CB ARG A 546 20.821 -22.366 12.695 1.00 37.79 C ATOM 131 CG ARG A 546 19.332 -22.036 12.973 1.00 37.65 C ATOM 132 CD ARG A 546 19.177 -21.166 14.200 1.00 44.16 C ATOM 133 NE ARG A 546 17.777 -20.851 14.492 1.00 49.85 N ATOM 134 CZ ARG A 546 17.386 -19.993 15.435 1.00 51.83 C ATOM 135 NH1 ARG A 546 18.290 -19.366 16.181 1.00 48.01 N ATOM 136 NH2 ARG A 546 16.091 -19.759 15.633 1.00 54.13 N ATOM 137 HE ARG A 546 17.042 -21.326 13.929 1.00 0.00 H ATOM 138 HH12 ARG A 546 17.984 -18.697 16.916 1.00 0.00 H ATOM 139 HH11 ARG A 546 19.303 -19.544 16.030 1.00 0.00 H ATOM 140 HH22 ARG A 546 15.790 -19.089 16.369 1.00 0.00 H ATOM 141 HH21 ARG A 546 15.380 -20.246 15.051 1.00 0.00 H ATOM 142 H ARG A 546 23.159 -23.138 11.949 1.00 0.00 H ATOM 143 N ALA A 547 21.387 -21.638 9.628 1.00 35.06 N ATOM 144 CA ALA A 547 21.057 -20.934 8.396 1.00 43.18 C ATOM 145 C ALA A 547 20.932 -21.925 7.226 1.00 39.86 C ATOM 146 O ALA A 547 19.987 -21.841 6.417 1.00 35.35 O ATOM 147 CB ALA A 547 22.119 -19.859 8.078 1.00 42.40 C ATOM 148 H ALA A 547 22.312 -21.465 10.072 1.00 0.00 H ATOM 149 N ASN A 548 21.892 -22.846 7.128 1.00 29.85 N ATOM 150 CA ASN A 548 21.856 -23.886 6.095 1.00 36.05 C ATOM 151 C ASN A 548 20.538 -24.676 6.165 1.00 36.36 C ATOM 152 O ASN A 548 19.867 -24.897 5.134 1.00 30.39 O ATOM 153 CB ASN A 548 23.026 -24.858 6.278 1.00 28.88 C ATOM 154 CG ASN A 548 24.344 -24.304 5.777 1.00 29.46 C ATOM 155 OD1 ASN A 548 24.377 -23.311 5.039 1.00 31.59 O ATOM 156 ND2 ASN A 548 25.445 -24.988 6.128 1.00 31.63 N ATOM 157 HD22 ASN A 548 25.366 -25.817 6.751 1.00 0.00 H ATOM 158 HD21 ASN A 548 26.377 -24.689 5.777 1.00 0.00 H ATOM 159 H ASN A 548 22.685 -22.826 7.800 1.00 0.00 H ATOM 160 N ASP A 549 20.175 -25.083 7.379 1.00 32.67 N ATOM 161 CA ASP A 549 19.017 -25.946 7.590 1.00 38.92 C ATOM 162 C ASP A 549 17.733 -25.218 7.244 1.00 46.27 C ATOM 163 O ASP A 549 16.817 -25.791 6.632 1.00 39.29 O ATOM 164 CB ASP A 549 18.918 -26.372 9.052 1.00 41.17 C ATOM 165 CG ASP A 549 19.881 -27.486 9.402 1.00 44.31 C ATOM 166 OD1 ASP A 549 20.401 -28.136 8.470 1.00 45.87 O ATOM 167 OD2 ASP A 549 20.113 -27.698 10.610 1.00 58.17 O ATOM 168 H ASP A 549 20.733 -24.777 8.202 1.00 0.00 H ATOM 169 N ASP A 550 17.658 -23.963 7.678 1.00 34.58 N ATOM 170 CA ASP A 550 16.459 -23.166 7.467 1.00 41.21 C ATOM 171 C ASP A 550 16.213 -22.826 5.981 1.00 34.94 C ATOM 172 O ASP A 550 15.057 -22.809 5.532 1.00 41.88 O ATOM 173 CB ASP A 550 16.529 -21.899 8.314 1.00 44.39 C ATOM 174 CG ASP A 550 16.207 -22.164 9.789 1.00 56.53 C ATOM 175 OD1 ASP A 550 15.990 -23.342 10.192 1.00 52.98 O ATOM 176 OD2 ASP A 550 16.154 -21.181 10.553 1.00 50.64 O ATOM 177 H ASP A 550 18.469 -23.545 8.176 1.00 0.00 H ATOM 178 N LEU A 551 17.279 -22.532 5.240 1.00 36.32 N ATOM 179 CA LEU A 551 17.138 -22.241 3.820 1.00 40.73 C ATOM 180 C LEU A 551 16.571 -23.481 3.107 1.00 42.58 C ATOM 181 O LEU A 551 15.622 -23.383 2.314 1.00 39.50 O ATOM 182 CB LEU A 551 18.478 -21.816 3.212 1.00 34.97 C ATOM 183 CG LEU A 551 19.011 -20.429 3.624 1.00 34.46 C ATOM 184 CD1 LEU A 551 20.417 -20.193 3.059 1.00 34.75 C ATOM 185 CD2 LEU A 551 18.063 -19.310 3.161 1.00 38.46 C ATOM 186 H LEU A 551 18.221 -22.510 5.679 1.00 0.00 H ATOM 187 N LEU A 552 17.126 -24.650 3.437 1.00 34.28 N ATOM 188 CA LEU A 552 16.692 -25.929 2.845 1.00 42.15 C ATOM 189 C LEU A 552 15.232 -26.233 3.133 1.00 43.55 C ATOM 190 O LEU A 552 14.504 -26.733 2.259 1.00 42.43 O ATOM 191 CB LEU A 552 17.564 -27.087 3.356 1.00 35.74 C ATOM 192 CG LEU A 552 18.996 -27.079 2.819 1.00 37.42 C ATOM 193 CD1 LEU A 552 19.843 -28.135 3.535 1.00 36.86 C ATOM 194 CD2 LEU A 552 19.001 -27.321 1.295 1.00 41.49 C ATOM 195 H LEU A 552 17.894 -24.659 4.138 1.00 0.00 H ATOM 196 N SER A 553 14.804 -25.953 4.367 1.00 37.27 N ATOM 197 CA SER A 553 13.448 -26.271 4.791 1.00 42.17 C ATOM 198 C SER A 553 12.429 -25.223 4.290 1.00 41.38 C ATOM 199 O SER A 553 11.285 -25.551 3.951 1.00 42.97 O ATOM 200 CB SER A 553 13.402 -26.422 6.328 1.00 37.70 C ATOM 201 OG SER A 553 12.081 -26.641 6.767 1.00 58.02 O ATOM 202 HG SER A 553 11.730 -27.469 6.353 1.00 0.00 H ATOM 203 H SER A 553 15.454 -25.498 5.040 1.00 0.00 H ATOM 204 N GLU A 554 12.834 -23.958 4.256 1.00 37.67 N ATOM 205 CA GLU A 554 11.905 -22.894 3.862 1.00 49.60 C ATOM 206 C GLU A 554 11.679 -22.774 2.341 1.00 46.82 C ATOM 207 O GLU A 554 10.556 -22.514 1.910 1.00 43.46 O ATOM 208 CB GLU A 554 12.368 -21.554 4.426 1.00 51.30 C ATOM 209 CG GLU A 554 11.315 -20.477 4.352 1.00 59.64 C ATOM 210 CD GLU A 554 11.706 -19.243 5.139 1.00 69.40 C ATOM 211 OE1 GLU A 554 12.852 -19.204 5.645 1.00 67.83 O ATOM 212 OE2 GLU A 554 10.870 -18.318 5.249 1.00 73.19 O ATOM 213 H GLU A 554 13.814 -23.721 4.510 1.00 0.00 H ATOM 214 N PHE A 555 12.739 -22.976 1.554 1.00 43.61 N ATOM 215 CA PHE A 555 12.688 -22.813 0.090 1.00 46.06 C ATOM 216 C PHE A 555 13.196 -24.059 -0.648 1.00 39.70 C ATOM 217 O PHE A 555 14.261 -24.029 -1.280 1.00 37.75 O ATOM 218 CB PHE A 555 13.529 -21.591 -0.308 1.00 38.01 C ATOM 219 CG PHE A 555 13.193 -20.354 0.489 1.00 44.22 C ATOM 220 CD1 PHE A 555 13.985 -19.974 1.578 1.00 48.82 C ATOM 221 CD2 PHE A 555 12.057 -19.603 0.186 1.00 49.29 C ATOM 222 CE1 PHE A 555 13.668 -18.844 2.339 1.00 48.49 C ATOM 223 CE2 PHE A 555 11.732 -18.463 0.937 1.00 53.56 C ATOM 224 CZ PHE A 555 12.542 -18.088 2.017 1.00 54.04 C ATOM 225 H PHE A 555 13.638 -23.260 1.993 1.00 0.00 H ATOM 226 N PRO A 556 12.434 -25.166 -0.568 1.00 38.14 N ATOM 227 CA PRO A 556 12.859 -26.429 -1.201 1.00 46.07 C ATOM 228 C PRO A 556 12.979 -26.327 -2.733 1.00 44.41 C ATOM 229 O PRO A 556 13.735 -27.093 -3.337 1.00 47.55 O ATOM 230 CB PRO A 556 11.738 -27.418 -0.823 1.00 48.62 C ATOM 231 CG PRO A 556 10.535 -26.541 -0.531 1.00 55.70 C ATOM 232 CD PRO A 556 11.108 -25.277 0.077 1.00 37.94 C ATOM 233 N ASP A 557 12.245 -25.407 -3.349 1.00 45.96 N ATOM 234 CA ASP A 557 12.380 -25.186 -4.789 1.00 56.48 C ATOM 235 C ASP A 557 13.684 -24.452 -5.142 1.00 53.62 C ATOM 236 O ASP A 557 14.260 -24.690 -6.197 1.00 54.73 O ATOM 237 CB ASP A 557 11.176 -24.420 -5.346 1.00 58.19 C ATOM 238 CG ASP A 557 9.896 -25.257 -5.359 1.00 74.88 C ATOM 239 OD1 ASP A 557 8.810 -24.650 -5.493 1.00 78.24 O ATOM 240 OD2 ASP A 557 9.971 -26.508 -5.244 1.00 73.02 O ATOM 241 H ASP A 557 11.568 -24.838 -2.802 1.00 0.00 H ATOM 242 N LYS A 558 14.119 -23.528 -4.289 1.00 51.50 N ATOM 243 CA LYS A 558 15.363 -22.776 -4.526 1.00 45.18 C ATOM 244 C LYS A 558 16.684 -23.452 -4.115 1.00 49.90 C ATOM 245 O LYS A 558 17.720 -23.276 -4.786 1.00 38.35 O ATOM 246 CB LYS A 558 15.255 -21.365 -3.931 1.00 47.53 C ATOM 247 H LYS A 558 13.565 -23.331 -3.431 1.00 0.00 H ATOM 248 N PHE A 559 16.664 -24.208 -3.012 1.00 38.96 N ATOM 249 CA PHE A 559 17.908 -24.757 -2.450 1.00 34.83 C ATOM 250 C PHE A 559 17.854 -26.273 -2.333 1.00 43.07 C ATOM 251 O PHE A 559 16.797 -26.844 -2.052 1.00 41.39 O ATOM 252 CB PHE A 559 18.176 -24.189 -1.043 1.00 33.62 C ATOM 253 CG PHE A 559 18.230 -22.692 -0.993 1.00 36.21 C ATOM 254 CD1 PHE A 559 17.105 -21.954 -0.646 1.00 41.98 C ATOM 255 CD2 PHE A 559 19.413 -22.015 -1.301 1.00 38.65 C ATOM 256 CE1 PHE A 559 17.146 -20.548 -0.613 1.00 49.92 C ATOM 257 CE2 PHE A 559 19.461 -20.612 -1.279 1.00 41.28 C ATOM 258 CZ PHE A 559 18.321 -19.879 -0.937 1.00 40.70 C ATOM 259 H PHE A 559 15.757 -24.411 -2.545 1.00 0.00 H ATOM 260 N GLY A 560 18.998 -26.924 -2.488 1.00 39.25 N ATOM 261 CA GLY A 560 19.010 -28.371 -2.400 1.00 36.11 C ATOM 262 C GLY A 560 20.354 -28.811 -1.896 1.00 34.70 C ATOM 263 O GLY A 560 21.296 -28.004 -1.836 1.00 34.62 O ATOM 264 H GLY A 560 19.879 -26.402 -2.671 1.00 0.00 H ATOM 265 N SER A 561 20.445 -30.086 -1.522 1.00 34.95 N ATOM 266 CA SER A 561 21.693 -30.697 -1.062 1.00 33.69 C ATOM 267 C SER A 561 22.223 -31.588 -2.183 1.00 34.34 C ATOM 268 O SER A 561 21.430 -32.185 -2.933 1.00 34.32 O ATOM 269 CB SER A 561 21.405 -31.545 0.181 1.00 32.57 C ATOM 270 OG SER A 561 21.067 -30.703 1.247 1.00 40.05 O ATOM 271 HG SER A 561 21.820 -30.088 1.432 1.00 0.00 H ATOM 272 H SER A 561 19.589 -30.675 -1.559 1.00 0.00 H ATOM 273 N CYS A 562 23.542 -31.678 -2.324 1.00 32.01 N ATOM 274 CA CYS A 562 24.076 -32.566 -3.341 1.00 31.17 C ATOM 275 C CYS A 562 24.310 -33.964 -2.732 1.00 35.77 C ATOM 276 O CYS A 562 24.193 -34.157 -1.506 1.00 34.38 O ATOM 277 CB CYS A 562 25.386 -31.987 -3.907 1.00 31.38 C ATOM 278 SG CYS A 562 26.766 -31.993 -2.742 1.00 36.75 S ATOM 279 H CYS A 562 24.179 -31.123 -1.717 1.00 0.00 H ATOM 280 N VAL A 563 24.679 -34.929 -3.576 1.00 33.00 N ATOM 281 CA VAL A 563 24.830 -36.312 -3.129 1.00 33.62 C ATOM 282 C VAL A 563 26.323 -36.525 -2.852 1.00 34.29 C ATOM 283 O VAL A 563 27.147 -36.437 -3.763 1.00 30.97 O ATOM 284 CB VAL A 563 24.357 -37.309 -4.209 1.00 32.77 C ATOM 285 CG1 VAL A 563 24.586 -38.763 -3.751 1.00 30.23 C ATOM 286 CG2 VAL A 563 22.868 -37.077 -4.575 1.00 33.94 C ATOM 287 H VAL A 563 24.863 -34.692 -4.572 1.00 0.00 H ATOM 288 N PRO A 564 26.681 -36.808 -1.590 1.00 31.45 N ATOM 289 CA PRO A 564 28.076 -37.070 -1.203 1.00 31.02 C ATOM 290 C PRO A 564 28.592 -38.475 -1.613 1.00 35.21 C ATOM 291 O PRO A 564 27.793 -39.347 -2.007 1.00 32.72 O ATOM 292 CB PRO A 564 28.051 -36.875 0.318 1.00 28.06 C ATOM 293 CG PRO A 564 26.651 -37.301 0.714 1.00 30.97 C ATOM 294 CD PRO A 564 25.743 -36.981 -0.465 1.00 24.02 C ATOM 295 N HIS A 565 29.909 -38.684 -1.545 1.00 30.44 N ATOM 296 CA HIS A 565 30.484 -40.029 -1.756 1.00 36.39 C ATOM 297 C HIS A 565 30.904 -40.648 -0.417 1.00 36.88 C ATOM 298 O HIS A 565 31.285 -39.931 0.513 1.00 29.85 O ATOM 299 CB HIS A 565 31.740 -39.984 -2.642 1.00 32.68 C ATOM 300 CG HIS A 565 31.462 -39.730 -4.091 1.00 35.29 C ATOM 301 ND1 HIS A 565 30.992 -38.511 -4.558 1.00 33.72 N ATOM 302 CD2 HIS A 565 31.598 -40.525 -5.177 1.00 36.02 C ATOM 303 CE1 HIS A 565 30.851 -38.578 -5.872 1.00 37.69 C ATOM 304 NE2 HIS A 565 31.208 -39.787 -6.275 1.00 34.43 N ATOM 305 H HIS A 565 30.542 -37.885 -1.340 1.00 0.00 H ATOM 306 N THR A 566 30.831 -41.976 -0.316 1.00 27.61 N ATOM 307 CA THR A 566 31.478 -42.662 0.795 1.00 29.88 C ATOM 308 C THR A 566 31.995 -44.039 0.373 1.00 34.93 C ATOM 309 O THR A 566 31.485 -44.630 -0.610 1.00 32.20 O ATOM 310 CB THR A 566 30.545 -42.803 2.014 1.00 36.03 C ATOM 311 OG1 THR A 566 31.268 -43.413 3.104 1.00 32.05 O ATOM 312 CG2 THR A 566 29.313 -43.672 1.662 1.00 38.25 C ATOM 313 HG1 THR A 566 32.042 -42.845 3.344 1.00 0.00 H ATOM 314 H THR A 566 30.311 -42.523 -1.032 1.00 0.00 H ATOM 315 N THR A 567 33.015 -44.538 1.094 1.00 35.18 N ATOM 316 CA THR A 567 33.521 -45.885 0.820 1.00 37.01 C ATOM 317 C THR A 567 32.836 -46.896 1.721 1.00 40.12 C ATOM 318 O THR A 567 33.025 -48.111 1.557 1.00 38.51 O ATOM 319 CB THR A 567 35.055 -46.006 1.033 1.00 32.12 C ATOM 320 OG1 THR A 567 35.386 -45.556 2.351 1.00 34.72 O ATOM 321 CG2 THR A 567 35.840 -45.158 -0.001 1.00 34.21 C ATOM 322 HG1 THR A 567 36.363 -45.632 2.489 1.00 0.00 H ATOM 323 H THR A 567 33.446 -43.966 1.848 1.00 0.00 H ATOM 324 N ARG A 568 32.073 -46.422 2.706 1.00 33.21 N ATOM 325 CA ARG A 568 31.448 -47.394 3.605 1.00 35.18 C ATOM 326 C ARG A 568 30.374 -48.190 2.842 1.00 35.53 C ATOM 327 O ARG A 568 29.826 -47.716 1.833 1.00 37.31 O ATOM 328 CB ARG A 568 30.918 -46.758 4.895 1.00 36.69 C ATOM 329 CG ARG A 568 29.619 -46.025 4.787 1.00 45.36 C ATOM 330 CD ARG A 568 28.779 -46.198 6.076 1.00 37.39 C ATOM 331 NE ARG A 568 27.680 -45.224 6.059 1.00 34.95 N ATOM 332 CZ ARG A 568 26.528 -45.394 5.409 1.00 40.47 C ATOM 333 NH1 ARG A 568 25.600 -44.439 5.473 1.00 35.72 N ATOM 334 NH2 ARG A 568 26.295 -46.516 4.711 1.00 36.26 N ATOM 335 HE ARG A 568 27.809 -44.340 6.591 1.00 0.00 H ATOM 336 HH12 ARG A 568 24.697 -44.557 4.971 1.00 0.00 H ATOM 337 HH11 ARG A 568 25.779 -43.576 6.025 1.00 0.00 H ATOM 338 HH22 ARG A 568 25.393 -46.638 4.208 1.00 0.00 H ATOM 339 HH21 ARG A 568 27.017 -47.264 4.673 1.00 0.00 H ATOM 340 H ARG A 568 31.927 -45.400 2.831 1.00 0.00 H ATOM 341 N PRO A 569 30.114 -49.425 3.279 1.00 41.20 N ATOM 342 CA PRO A 569 29.135 -50.234 2.543 1.00 43.38 C ATOM 343 C PRO A 569 27.706 -49.684 2.693 1.00 38.55 C ATOM 344 O PRO A 569 27.365 -49.097 3.732 1.00 35.82 O ATOM 345 CB PRO A 569 29.256 -51.628 3.196 1.00 48.25 C ATOM 346 CG PRO A 569 30.549 -51.587 4.018 1.00 50.50 C ATOM 347 CD PRO A 569 30.694 -50.145 4.428 1.00 46.07 C ATOM 348 N LYS A 570 26.898 -49.857 1.648 1.00 38.42 N ATOM 349 CA LYS A 570 25.502 -49.417 1.629 1.00 38.82 C ATOM 350 C LYS A 570 24.688 -50.194 2.663 1.00 41.99 C ATOM 351 O LYS A 570 24.914 -51.398 2.867 1.00 45.55 O ATOM 352 CB LYS A 570 24.937 -49.647 0.219 1.00 37.87 C ATOM 353 CG LYS A 570 23.478 -49.306 -0.002 1.00 45.78 C ATOM 354 CD LYS A 570 23.170 -49.266 -1.511 1.00 47.69 C ATOM 355 CE LYS A 570 23.207 -50.652 -2.128 1.00 64.97 C ATOM 356 NZ LYS A 570 21.914 -51.380 -1.924 1.00 68.78 N ATOM 357 HZ1 LYS A 570 21.730 -51.478 -0.905 1.00 0.00 H ATOM 358 HZ2 LYS A 570 21.142 -50.843 -2.367 1.00 0.00 H ATOM 359 HZ3 LYS A 570 21.976 -52.323 -2.359 1.00 0.00 H ATOM 360 H LYS A 570 27.278 -50.329 0.803 1.00 0.00 H ATOM 361 N ARG A 571 23.726 -49.529 3.311 1.00 35.51 N ATOM 362 CA ARG A 571 22.906 -50.197 4.336 1.00 35.28 C ATOM 363 C ARG A 571 21.441 -50.256 3.873 1.00 35.35 C ATOM 364 O ARG A 571 21.108 -49.702 2.822 1.00 36.10 O ATOM 365 CB ARG A 571 23.033 -49.407 5.645 1.00 44.75 C ATOM 366 CG ARG A 571 23.919 -50.055 6.666 1.00 51.73 C ATOM 367 CD ARG A 571 25.289 -49.420 6.792 1.00 51.83 C ATOM 368 NE ARG A 571 25.283 -48.178 7.569 1.00 55.57 N ATOM 369 CZ ARG A 571 26.223 -47.806 8.449 1.00 50.14 C ATOM 370 NH1 ARG A 571 27.255 -48.591 8.712 1.00 60.60 N ATOM 371 NH2 ARG A 571 26.139 -46.629 9.069 1.00 38.80 N ATOM 372 HE ARG A 571 24.482 -47.530 7.426 1.00 0.00 H ATOM 373 HH12 ARG A 571 27.977 -48.289 9.397 1.00 0.00 H ATOM 374 HH11 ARG A 571 27.345 -49.510 8.233 1.00 0.00 H ATOM 375 HH22 ARG A 571 26.872 -46.347 9.751 1.00 0.00 H ATOM 376 HH21 ARG A 571 25.340 -45.993 8.871 1.00 0.00 H ATOM 377 H ARG A 571 23.555 -48.528 3.089 1.00 0.00 H ATOM 378 N GLU A 572 20.565 -50.888 4.651 1.00 38.83 N ATOM 379 CA GLU A 572 19.149 -51.000 4.275 1.00 41.62 C ATOM 380 C GLU A 572 18.538 -49.609 4.085 1.00 46.36 C ATOM 381 O GLU A 572 18.887 -48.671 4.828 1.00 35.64 O ATOM 382 CB GLU A 572 18.339 -51.791 5.309 1.00 37.45 C ATOM 383 CG GLU A 572 16.870 -52.044 4.862 1.00 37.39 C ATOM 384 CD GLU A 572 16.157 -53.097 5.681 1.00 40.14 C ATOM 385 OE1 GLU A 572 15.074 -53.576 5.245 1.00 46.25 O ATOM 386 OE2 GLU A 572 16.668 -53.474 6.766 1.00 43.37 O ATOM 387 H GLU A 572 20.890 -51.311 5.544 1.00 0.00 H ATOM 388 N TYR A 573 17.664 -49.479 3.074 1.00 46.41 N ATOM 389 CA TYR A 573 16.938 -48.224 2.787 1.00 37.57 C ATOM 390 C TYR A 573 17.812 -47.166 2.142 1.00 39.62 C ATOM 391 O TYR A 573 17.338 -46.050 1.904 1.00 52.08 O ATOM 392 CB TYR A 573 16.256 -47.620 4.020 1.00 36.87 C ATOM 393 CG TYR A 573 15.335 -48.569 4.750 1.00 38.91 C ATOM 394 CD1 TYR A 573 14.383 -49.334 4.058 1.00 39.31 C ATOM 395 CD2 TYR A 573 15.399 -48.700 6.137 1.00 39.45 C ATOM 396 CE1 TYR A 573 13.517 -50.210 4.746 1.00 41.97 C ATOM 397 CE2 TYR A 573 14.557 -49.560 6.819 1.00 39.97 C ATOM 398 CZ TYR A 573 13.622 -50.312 6.124 1.00 42.23 C ATOM 399 OH TYR A 573 12.794 -51.154 6.808 1.00 45.00 O ATOM 400 HH TYR A 573 12.192 -51.613 6.170 1.00 0.00 H ATOM 401 H TYR A 573 17.489 -50.302 2.463 1.00 0.00 H ATOM 402 N GLU A 574 19.096 -47.466 1.936 1.00 33.56 N ATOM 403 CA GLU A 574 19.981 -46.493 1.287 1.00 35.53 C ATOM 404 C GLU A 574 20.004 -46.791 -0.207 1.00 45.45 C ATOM 405 O GLU A 574 19.971 -47.957 -0.616 1.00 46.83 O ATOM 406 CB GLU A 574 21.396 -46.531 1.876 1.00 41.91 C ATOM 407 CG GLU A 574 21.466 -46.100 3.352 1.00 43.49 C ATOM 408 CD GLU A 574 22.897 -45.928 3.837 1.00 52.11 C ATOM 409 OE1 GLU A 574 23.182 -44.900 4.501 1.00 57.55 O ATOM 410 OE2 GLU A 574 23.732 -46.832 3.561 1.00 40.20 O ATOM 411 H GLU A 574 19.469 -48.389 2.236 1.00 0.00 H ATOM 412 N ILE A 575 20.027 -45.734 -1.015 1.00 38.32 N ATOM 413 CA ILE A 575 19.991 -45.864 -2.480 1.00 40.13 C ATOM 414 C ILE A 575 21.198 -45.179 -3.119 1.00 37.82 C ATOM 415 O ILE A 575 21.462 -43.964 -2.884 1.00 33.81 O ATOM 416 CB ILE A 575 18.668 -45.332 -3.052 1.00 45.01 C ATOM 417 CG1 ILE A 575 17.517 -46.173 -2.471 1.00 48.75 C ATOM 418 CG2 ILE A 575 18.698 -45.337 -4.602 1.00 40.70 C ATOM 419 CD1 ILE A 575 16.291 -46.211 -3.288 1.00 67.51 C ATOM 420 H ILE A 575 20.072 -44.783 -0.596 1.00 0.00 H ATOM 421 N ASP A 576 21.961 -45.967 -3.880 1.00 40.98 N ATOM 422 CA ASP A 576 23.160 -45.449 -4.554 1.00 40.58 C ATOM 423 C ASP A 576 22.737 -44.331 -5.510 1.00 45.91 C ATOM 424 O ASP A 576 21.854 -44.536 -6.353 1.00 41.04 O ATOM 425 CB ASP A 576 23.867 -46.593 -5.302 1.00 44.30 C ATOM 426 CG ASP A 576 25.276 -46.217 -5.798 1.00 56.07 C ATOM 427 OD1 ASP A 576 25.881 -45.222 -5.326 1.00 43.45 O ATOM 428 OD2 ASP A 576 25.798 -46.946 -6.664 1.00 63.54 O ATOM 429 H ASP A 576 21.702 -46.967 -3.998 1.00 0.00 H ATOM 430 N GLY A 577 23.357 -43.152 -5.388 1.00 43.81 N ATOM 431 CA GLY A 577 22.985 -42.016 -6.228 1.00 37.82 C ATOM 432 C GLY A 577 21.941 -41.106 -5.582 1.00 44.00 C ATOM 433 O GLY A 577 21.628 -40.024 -6.102 1.00 37.12 O ATOM 434 H GLY A 577 24.115 -43.042 -4.685 1.00 0.00 H ATOM 435 N ARG A 578 21.392 -41.531 -4.443 1.00 40.92 N ATOM 436 CA ARG A 578 20.450 -40.686 -3.709 1.00 38.81 C ATOM 437 C ARG A 578 21.006 -40.312 -2.327 1.00 40.21 C ATOM 438 O ARG A 578 21.278 -39.139 -2.035 1.00 41.80 O ATOM 439 CB ARG A 578 19.085 -41.387 -3.598 1.00 40.25 C ATOM 440 CG ARG A 578 17.982 -40.483 -3.021 1.00 53.48 C ATOM 441 CD ARG A 578 16.731 -41.284 -2.567 1.00 71.62 C ATOM 442 NE ARG A 578 17.031 -42.098 -1.385 1.00 69.28 N ATOM 443 CZ ARG A 578 16.129 -42.616 -0.553 1.00 63.91 C ATOM 444 NH1 ARG A 578 16.547 -43.349 0.476 1.00 51.80 N ATOM 445 NH2 ARG A 578 14.823 -42.410 -0.738 1.00 52.39 N ATOM 446 HE ARG A 578 18.033 -42.287 -1.179 1.00 0.00 H ATOM 447 HH12 ARG A 578 15.856 -43.761 1.135 1.00 0.00 H ATOM 448 HH11 ARG A 578 17.564 -43.510 0.621 1.00 0.00 H ATOM 449 HH22 ARG A 578 14.133 -42.822 -0.078 1.00 0.00 H ATOM 450 HH21 ARG A 578 14.496 -41.837 -1.542 1.00 0.00 H ATOM 451 H ARG A 578 21.636 -42.472 -4.073 1.00 0.00 H ATOM 452 N ASP A 579 21.165 -41.313 -1.463 1.00 32.77 N ATOM 453 CA ASP A 579 21.791 -41.085 -0.158 1.00 36.19 C ATOM 454 C ASP A 579 23.286 -40.815 -0.288 1.00 33.68 C ATOM 455 O ASP A 579 23.796 -39.807 0.220 1.00 34.22 O ATOM 456 CB ASP A 579 21.528 -42.295 0.739 1.00 33.52 C ATOM 457 CG ASP A 579 20.047 -42.546 0.940 1.00 36.89 C ATOM 458 OD1 ASP A 579 19.445 -41.852 1.798 1.00 38.70 O ATOM 459 OD2 ASP A 579 19.482 -43.422 0.238 1.00 38.63 O ATOM 460 H ASP A 579 20.841 -42.268 -1.718 1.00 0.00 H ATOM 461 N TYR A 580 23.995 -41.699 -0.995 1.00 31.89 N ATOM 462 CA TYR A 580 25.420 -41.468 -1.300 1.00 28.59 C ATOM 463 C TYR A 580 25.700 -42.038 -2.670 1.00 40.60 C ATOM 464 O TYR A 580 24.948 -42.887 -3.165 1.00 36.16 O ATOM 465 CB TYR A 580 26.341 -42.226 -0.316 1.00 26.40 C ATOM 466 CG TYR A 580 26.418 -41.688 1.113 1.00 33.26 C ATOM 467 CD1 TYR A 580 27.369 -40.736 1.480 1.00 29.61 C ATOM 468 CD2 TYR A 580 25.554 -42.158 2.096 1.00 30.34 C ATOM 469 CE1 TYR A 580 27.447 -40.263 2.797 1.00 30.15 C ATOM 470 CE2 TYR A 580 25.622 -41.682 3.397 1.00 32.17 C ATOM 471 CZ TYR A 580 26.571 -40.731 3.733 1.00 27.19 C ATOM 472 OH TYR A 580 26.644 -40.280 5.037 1.00 33.06 O ATOM 473 HH TYR A 580 26.836 -41.043 5.638 1.00 0.00 H ATOM 474 H TYR A 580 23.534 -42.566 -1.337 1.00 0.00 H ATOM 475 N HIS A 581 26.808 -41.611 -3.268 1.00 33.32 N ATOM 476 CA HIS A 581 27.390 -42.406 -4.330 1.00 33.75 C ATOM 477 C HIS A 581 28.332 -43.368 -3.597 1.00 37.16 C ATOM 478 O HIS A 581 29.313 -42.941 -2.980 1.00 36.04 O ATOM 479 CB HIS A 581 28.199 -41.494 -5.266 1.00 40.55 C ATOM 480 CG HIS A 581 27.355 -40.532 -6.061 1.00 38.09 C ATOM 481 ND1 HIS A 581 26.515 -40.943 -7.078 1.00 37.02 N ATOM 482 CD2 HIS A 581 27.225 -39.186 -5.986 1.00 32.92 C ATOM 483 CE1 HIS A 581 25.912 -39.889 -7.606 1.00 36.13 C ATOM 484 NE2 HIS A 581 26.328 -38.810 -6.967 1.00 32.47 N ATOM 485 H HIS A 581 27.252 -40.717 -2.977 1.00 0.00 H ATOM 486 N PHE A 582 28.032 -44.662 -3.625 1.00 38.16 N ATOM 487 CA PHE A 582 28.830 -45.619 -2.852 1.00 37.69 C ATOM 488 C PHE A 582 30.035 -46.124 -3.652 1.00 45.26 C ATOM 489 O PHE A 582 29.874 -46.761 -4.706 1.00 42.71 O ATOM 490 CB PHE A 582 27.969 -46.799 -2.396 1.00 41.41 C ATOM 491 CG PHE A 582 26.927 -46.424 -1.379 1.00 38.05 C ATOM 492 CD1 PHE A 582 25.609 -46.144 -1.774 1.00 34.19 C ATOM 493 CD2 PHE A 582 27.262 -46.323 -0.039 1.00 34.17 C ATOM 494 CE1 PHE A 582 24.635 -45.787 -0.828 1.00 35.29 C ATOM 495 CE2 PHE A 582 26.284 -45.957 0.925 1.00 35.61 C ATOM 496 CZ PHE A 582 24.977 -45.685 0.522 1.00 31.14 C ATOM 497 H PHE A 582 27.230 -44.997 -4.196 1.00 0.00 H ATOM 498 N VAL A 583 31.236 -45.874 -3.136 1.00 41.84 N ATOM 499 CA VAL A 583 32.466 -46.216 -3.862 1.00 50.32 C ATOM 500 C VAL A 583 32.988 -47.591 -3.410 1.00 54.99 C ATOM 501 O VAL A 583 33.260 -47.801 -2.235 1.00 42.21 O ATOM 502 CB VAL A 583 33.548 -45.132 -3.651 1.00 49.11 C ATOM 503 CG1 VAL A 583 34.792 -45.439 -4.506 1.00 42.85 C ATOM 504 CG2 VAL A 583 32.970 -43.741 -4.016 1.00 36.39 C ATOM 505 H VAL A 583 31.305 -45.427 -2.199 1.00 0.00 H ATOM 506 N SER A 584 33.115 -48.537 -4.334 1.00 58.34 N ATOM 507 CA SER A 584 33.506 -49.901 -3.952 1.00 60.72 C ATOM 508 C SER A 584 34.985 -50.003 -3.573 1.00 61.39 C ATOM 509 O SER A 584 35.394 -50.897 -2.829 1.00 63.85 O ATOM 510 CB SER A 584 33.191 -50.878 -5.082 1.00 60.79 C ATOM 511 OG SER A 584 33.561 -50.318 -6.330 1.00 67.07 O ATOM 512 HG SER A 584 33.352 -50.960 -7.054 1.00 0.00 H ATOM 513 H SER A 584 32.937 -48.311 -5.333 1.00 0.00 H ATOM 514 N SER A 585 35.784 -49.076 -4.083 1.00 65.59 N ATOM 515 CA SER A 585 37.226 -49.134 -3.888 1.00 69.46 C ATOM 516 C SER A 585 37.747 -47.920 -3.120 1.00 65.24 C ATOM 517 O SER A 585 37.648 -46.785 -3.596 1.00 69.41 O ATOM 518 CB SER A 585 37.928 -49.247 -5.250 1.00 64.88 C ATOM 519 OG SER A 585 39.301 -48.929 -5.144 1.00 62.87 O ATOM 520 HG SER A 585 39.399 -48.001 -4.813 1.00 0.00 H ATOM 521 H SER A 585 35.374 -48.294 -4.632 1.00 0.00 H ATOM 522 N ARG A 586 38.311 -48.151 -1.940 1.00 50.28 N ATOM 523 CA ARG A 586 38.937 -47.055 -1.208 1.00 55.47 C ATOM 524 C ARG A 586 40.105 -46.457 -2.019 1.00 54.60 C ATOM 525 O ARG A 586 40.343 -45.233 -1.990 1.00 47.36 O ATOM 526 CB ARG A 586 39.423 -47.518 0.175 1.00 44.14 C ATOM 527 CG ARG A 586 40.003 -46.384 1.021 1.00 60.21 C ATOM 528 CD ARG A 586 40.880 -46.861 2.185 1.00 78.62 C ATOM 529 NE ARG A 586 41.576 -45.734 2.813 1.00 83.15 N ATOM 530 CZ ARG A 586 41.182 -45.116 3.927 1.00 74.56 C ATOM 531 NH1 ARG A 586 40.098 -45.518 4.576 1.00 57.31 N ATOM 532 NH2 ARG A 586 41.889 -44.099 4.404 1.00 77.82 N ATOM 533 HE ARG A 586 42.444 -45.390 2.354 1.00 0.00 H ATOM 534 HH12 ARG A 586 39.800 -45.028 5.444 1.00 0.00 H ATOM 535 HH11 ARG A 586 39.546 -46.323 4.217 1.00 0.00 H ATOM 536 HH22 ARG A 586 41.584 -43.615 5.273 1.00 0.00 H ATOM 537 HH21 ARG A 586 42.748 -43.786 3.909 1.00 0.00 H ATOM 538 H ARG A 586 38.306 -49.110 -1.539 1.00 0.00 H ATOM 539 N GLU A 587 40.830 -47.322 -2.734 1.00 45.08 N ATOM 540 CA GLU A 587 41.971 -46.882 -3.537 1.00 49.71 C ATOM 541 C GLU A 587 41.515 -45.904 -4.625 1.00 52.83 C ATOM 542 O GLU A 587 42.194 -44.903 -4.893 1.00 51.48 O ATOM 543 CB GLU A 587 42.719 -48.078 -4.155 1.00 53.12 C ATOM 544 H GLU A 587 40.578 -48.331 -2.719 1.00 0.00 H ATOM 545 N LYS A 588 40.363 -46.200 -5.235 1.00 51.79 N ATOM 546 CA LYS A 588 39.719 -45.317 -6.218 1.00 55.86 C ATOM 547 C LYS A 588 39.418 -43.918 -5.633 1.00 50.42 C ATOM 548 O LYS A 588 39.765 -42.886 -6.226 1.00 49.20 O ATOM 549 CB LYS A 588 38.425 -45.981 -6.734 1.00 63.68 C ATOM 550 CG LYS A 588 37.449 -45.077 -7.497 1.00 66.96 C ATOM 551 CD LYS A 588 37.792 -44.974 -8.988 1.00 72.72 C ATOM 552 CE LYS A 588 36.640 -44.371 -9.821 1.00 72.42 C ATOM 553 NZ LYS A 588 36.494 -42.884 -9.702 1.00 70.07 N ATOM 554 HZ1 LYS A 588 36.312 -42.633 -8.709 1.00 0.00 H ATOM 555 HZ2 LYS A 588 37.370 -42.424 -10.022 1.00 0.00 H ATOM 556 HZ3 LYS A 588 35.699 -42.567 -10.293 1.00 0.00 H ATOM 557 H LYS A 588 39.899 -47.101 -5.002 1.00 0.00 H ATOM 558 N MET A 589 38.797 -43.877 -4.461 1.00 50.11 N ATOM 559 CA MET A 589 38.447 -42.588 -3.876 1.00 36.34 C ATOM 560 C MET A 589 39.679 -41.773 -3.458 1.00 36.03 C ATOM 561 O MET A 589 39.701 -40.544 -3.603 1.00 41.87 O ATOM 562 CB MET A 589 37.496 -42.779 -2.707 1.00 38.95 C ATOM 563 CG MET A 589 37.090 -41.447 -2.098 1.00 39.39 C ATOM 564 SD MET A 589 35.416 -41.526 -1.523 1.00 46.62 S ATOM 565 CE MET A 589 35.266 -39.938 -0.681 1.00 35.07 C ATOM 566 H MET A 589 38.561 -44.759 -3.963 1.00 0.00 H ATOM 567 N GLU A 590 40.720 -42.452 -2.976 1.00 43.42 N ATOM 568 CA GLU A 590 41.974 -41.765 -2.654 1.00 47.25 C ATOM 569 C GLU A 590 42.596 -41.122 -3.894 1.00 48.91 C ATOM 570 O GLU A 590 43.010 -39.953 -3.855 1.00 46.73 O ATOM 571 CB GLU A 590 42.964 -42.726 -1.982 1.00 46.44 C ATOM 572 CG GLU A 590 42.579 -43.068 -0.538 1.00 54.81 C ATOM 573 CD GLU A 590 43.426 -44.191 0.056 1.00 65.20 C ATOM 574 OE1 GLU A 590 44.320 -44.713 -0.650 1.00 65.59 O ATOM 575 OE2 GLU A 590 43.190 -44.554 1.231 1.00 71.95 O ATOM 576 H GLU A 590 40.642 -43.478 -2.827 1.00 0.00 H ATOM 577 N LYS A 591 42.665 -41.885 -4.988 1.00 45.03 N ATOM 578 CA LYS A 591 43.158 -41.357 -6.260 1.00 50.98 C ATOM 579 C LYS A 591 42.324 -40.129 -6.673 1.00 43.45 C ATOM 580 O LYS A 591 42.883 -39.090 -7.043 1.00 45.07 O ATOM 581 CB LYS A 591 43.146 -42.447 -7.349 1.00 48.93 C ATOM 582 H LYS A 591 42.361 -42.878 -4.934 1.00 0.00 H ATOM 583 N ASP A 592 40.998 -40.230 -6.562 1.00 45.98 N ATOM 584 CA ASP A 592 40.111 -39.113 -6.921 1.00 46.95 C ATOM 585 C ASP A 592 40.292 -37.873 -6.054 1.00 44.28 C ATOM 586 O ASP A 592 40.323 -36.750 -6.575 1.00 44.81 O ATOM 587 CB ASP A 592 38.650 -39.561 -6.932 1.00 46.60 C ATOM 588 CG ASP A 592 38.335 -40.479 -8.118 1.00 59.82 C ATOM 589 OD1 ASP A 592 39.180 -40.574 -9.046 1.00 55.78 O ATOM 590 OD2 ASP A 592 37.243 -41.096 -8.117 1.00 61.76 O ATOM 591 H ASP A 592 40.583 -41.118 -6.214 1.00 0.00 H ATOM 592 N ILE A 593 40.427 -38.073 -4.741 1.00 40.61 N ATOM 593 CA ILE A 593 40.817 -36.972 -3.858 1.00 40.74 C ATOM 594 C ILE A 593 42.114 -36.296 -4.353 1.00 41.05 C ATOM 595 O ILE A 593 42.179 -35.066 -4.483 1.00 42.55 O ATOM 596 CB ILE A 593 40.943 -37.450 -2.382 1.00 42.26 C ATOM 597 CG1 ILE A 593 39.551 -37.807 -1.810 1.00 41.43 C ATOM 598 CG2 ILE A 593 41.644 -36.388 -1.518 1.00 40.11 C ATOM 599 CD1 ILE A 593 39.599 -38.718 -0.553 1.00 32.85 C ATOM 600 H ILE A 593 40.254 -39.018 -4.342 1.00 0.00 H ATOM 601 N GLN A 594 43.128 -37.098 -4.672 1.00 48.97 N ATOM 602 CA GLN A 594 44.407 -36.562 -5.154 1.00 56.32 C ATOM 603 C GLN A 594 44.313 -35.863 -6.518 1.00 56.29 C ATOM 604 O GLN A 594 45.125 -34.993 -6.831 1.00 53.44 O ATOM 605 CB GLN A 594 45.473 -37.663 -5.192 1.00 56.62 C ATOM 606 CG GLN A 594 46.031 -38.008 -3.820 1.00 74.20 C ATOM 607 CD GLN A 594 46.987 -39.185 -3.865 1.00 94.17 C ATOM 608 OE1 GLN A 594 46.824 -40.096 -4.685 1.00 99.45 O ATOM 609 NE2 GLN A 594 47.995 -39.175 -2.986 1.00 95.41 N ATOM 610 HE22 GLN A 594 48.092 -38.387 -2.315 1.00 0.00 H ATOM 611 HE21 GLN A 594 48.682 -39.956 -2.974 1.00 0.00 H ATOM 612 H GLN A 594 43.011 -38.127 -4.578 1.00 0.00 H ATOM 613 N ALA A 595 43.301 -36.233 -7.300 1.00 56.88 N ATOM 614 CA ALA A 595 43.044 -35.658 -8.625 1.00 50.15 C ATOM 615 C ALA A 595 42.124 -34.429 -8.547 1.00 48.46 C ATOM 616 O ALA A 595 41.639 -33.945 -9.581 1.00 45.09 O ATOM 617 CB ALA A 595 42.462 -36.708 -9.563 1.00 61.72 C ATOM 618 H ALA A 595 42.656 -36.971 -6.952 1.00 0.00 H ATOM 619 N HIS A 596 41.833 -33.980 -7.315 1.00 45.36 N ATOM 620 CA HIS A 596 41.046 -32.762 -7.063 1.00 38.09 C ATOM 621 C HIS A 596 39.594 -32.886 -7.493 1.00 39.83 C ATOM 622 O HIS A 596 38.990 -31.880 -7.900 1.00 48.61 O ATOM 623 CB HIS A 596 41.651 -31.535 -7.771 1.00 43.26 C ATOM 624 CG HIS A 596 43.103 -31.330 -7.495 1.00 54.62 C ATOM 625 ND1 HIS A 596 44.093 -31.795 -8.337 1.00 69.34 N ATOM 626 CD2 HIS A 596 43.741 -30.695 -6.481 1.00 53.73 C ATOM 627 CE1 HIS A 596 45.276 -31.457 -7.855 1.00 64.01 C ATOM 628 NE2 HIS A 596 45.090 -30.790 -6.728 1.00 67.56 N ATOM 629 H HIS A 596 42.181 -34.520 -6.498 1.00 0.00 H ATOM 630 N LYS A 597 39.034 -34.095 -7.384 1.00 35.53 N ATOM 631 CA LYS A 597 37.632 -34.327 -7.725 1.00 38.21 C ATOM 632 C LYS A 597 36.724 -33.947 -6.578 1.00 40.37 C ATOM 633 O LYS A 597 35.501 -33.873 -6.762 1.00 37.97 O ATOM 634 CB LYS A 597 37.383 -35.801 -8.070 1.00 42.68 C ATOM 635 CG LYS A 597 38.350 -36.405 -9.081 1.00 54.09 C ATOM 636 CD LYS A 597 37.825 -36.339 -10.481 1.00 64.79 C ATOM 637 CE LYS A 597 38.566 -37.338 -11.373 1.00 83.50 C ATOM 638 NZ LYS A 597 38.126 -38.761 -11.168 1.00 84.45 N ATOM 639 HZ1 LYS A 597 38.297 -39.037 -10.180 1.00 0.00 H ATOM 640 HZ2 LYS A 597 37.111 -38.843 -11.381 1.00 0.00 H ATOM 641 HZ3 LYS A 597 38.666 -39.384 -11.801 1.00 0.00 H ATOM 642 H LYS A 597 39.612 -34.892 -7.048 1.00 0.00 H ATOM 643 N PHE A 598 37.303 -33.729 -5.390 1.00 32.70 N ATOM 644 CA PHE A 598 36.508 -33.393 -4.214 1.00 31.76 C ATOM 645 C PHE A 598 36.780 -31.979 -3.682 1.00 38.12 C ATOM 646 O PHE A 598 37.943 -31.556 -3.565 1.00 36.35 O ATOM 647 CB PHE A 598 36.704 -34.457 -3.112 1.00 34.04 C ATOM 648 CG PHE A 598 36.066 -35.785 -3.455 1.00 37.80 C ATOM 649 CD1 PHE A 598 36.757 -36.743 -4.191 1.00 39.04 C ATOM 650 CD2 PHE A 598 34.741 -36.041 -3.102 1.00 31.14 C ATOM 651 CE1 PHE A 598 36.154 -37.952 -4.542 1.00 42.79 C ATOM 652 CE2 PHE A 598 34.129 -37.247 -3.455 1.00 30.93 C ATOM 653 CZ PHE A 598 34.841 -38.208 -4.172 1.00 31.00 C ATOM 654 H PHE A 598 38.337 -33.801 -5.305 1.00 0.00 H ATOM 655 N ILE A 599 35.711 -31.231 -3.395 1.00 30.58 N ATOM 656 CA ILE A 599 35.887 -29.907 -2.758 1.00 29.31 C ATOM 657 C ILE A 599 36.096 -30.052 -1.253 1.00 34.26 C ATOM 658 O ILE A 599 36.664 -29.159 -0.600 1.00 33.12 O ATOM 659 CB ILE A 599 34.706 -28.945 -3.038 1.00 29.19 C ATOM 660 CG1 ILE A 599 33.432 -29.402 -2.340 1.00 31.68 C ATOM 661 CG2 ILE A 599 34.456 -28.849 -4.547 1.00 32.69 C ATOM 662 CD1 ILE A 599 32.301 -28.350 -2.379 1.00 38.74 C ATOM 663 H ILE A 599 34.757 -31.579 -3.619 1.00 0.00 H ATOM 664 N GLU A 600 35.586 -31.156 -0.696 1.00 34.27 N ATOM 665 CA GLU A 600 35.773 -31.462 0.714 1.00 34.15 C ATOM 666 C GLU A 600 35.887 -32.988 0.799 1.00 37.99 C ATOM 667 O GLU A 600 35.104 -33.704 0.166 1.00 33.12 O ATOM 668 CB GLU A 600 34.548 -30.949 1.469 1.00 33.13 C ATOM 669 CG GLU A 600 34.633 -30.965 2.990 1.00 41.78 C ATOM 670 CD GLU A 600 35.683 -30.009 3.591 1.00 47.34 C ATOM 671 OE1 GLU A 600 36.447 -30.473 4.462 1.00 62.87 O ATOM 672 OE2 GLU A 600 35.744 -28.807 3.231 1.00 45.51 O ATOM 673 H GLU A 600 35.040 -31.814 -1.288 1.00 0.00 H ATOM 674 N ALA A 601 36.857 -33.498 1.554 1.00 30.99 N ATOM 675 CA ALA A 601 36.959 -34.949 1.771 1.00 36.15 C ATOM 676 C ALA A 601 37.466 -35.237 3.193 1.00 39.67 C ATOM 677 O ALA A 601 38.265 -34.460 3.747 1.00 31.31 O ATOM 678 CB ALA A 601 37.889 -35.613 0.716 1.00 34.99 C ATOM 679 H ALA A 601 37.552 -32.863 1.996 1.00 0.00 H ATOM 680 N GLY A 602 37.011 -36.343 3.780 1.00 30.37 N ATOM 681 CA GLY A 602 37.421 -36.676 5.127 1.00 38.61 C ATOM 682 C GLY A 602 37.202 -38.137 5.441 1.00 35.64 C ATOM 683 O GLY A 602 36.891 -38.928 4.538 1.00 33.57 O ATOM 684 H GLY A 602 36.358 -36.970 3.268 1.00 0.00 H ATOM 685 N GLN A 603 37.402 -38.508 6.709 1.00 38.05 N ATOM 686 CA GLN A 603 37.174 -39.896 7.110 1.00 38.71 C ATOM 687 C GLN A 603 36.400 -39.969 8.425 1.00 38.79 C ATOM 688 O GLN A 603 36.476 -39.059 9.261 1.00 34.81 O ATOM 689 CB GLN A 603 38.498 -40.652 7.234 1.00 42.01 C ATOM 690 CG GLN A 603 39.490 -39.969 8.159 1.00 51.44 C ATOM 691 CD GLN A 603 40.843 -40.667 8.182 1.00 69.14 C ATOM 692 OE1 GLN A 603 41.096 -41.581 7.387 1.00 62.16 O ATOM 693 NE2 GLN A 603 41.719 -40.250 9.112 1.00 74.30 N ATOM 694 HE22 GLN A 603 41.462 -39.478 9.759 1.00 0.00 H ATOM 695 HE21 GLN A 603 42.654 -40.700 9.185 1.00 0.00 H ATOM 696 H GLN A 603 37.720 -37.810 7.411 1.00 0.00 H ATOM 697 N TYR A 604 35.604 -41.021 8.580 1.00 31.34 N ATOM 698 CA TYR A 604 35.011 -41.299 9.878 1.00 34.43 C ATOM 699 C TYR A 604 34.828 -42.801 10.024 1.00 35.28 C ATOM 700 O TYR A 604 34.381 -43.458 9.081 1.00 34.60 O ATOM 701 CB TYR A 604 33.662 -40.599 9.983 1.00 31.44 C ATOM 702 CG TYR A 604 32.969 -40.901 11.298 1.00 36.75 C ATOM 703 CD1 TYR A 604 33.529 -40.467 12.503 1.00 35.28 C ATOM 704 CD2 TYR A 604 31.772 -41.616 11.343 1.00 36.64 C ATOM 705 CE1 TYR A 604 32.924 -40.735 13.712 1.00 40.09 C ATOM 706 CE2 TYR A 604 31.148 -41.895 12.573 1.00 40.45 C ATOM 707 CZ TYR A 604 31.734 -41.443 13.750 1.00 38.52 C ATOM 708 OH TYR A 604 31.167 -41.682 14.991 1.00 41.53 O ATOM 709 HH TYR A 604 31.735 -41.280 15.695 1.00 0.00 H ATOM 710 H TYR A 604 35.405 -41.646 7.773 1.00 0.00 H ATOM 711 N ASN A 605 35.115 -43.325 11.209 1.00 38.19 N ATOM 712 CA ASN A 605 34.852 -44.727 11.526 1.00 37.41 C ATOM 713 C ASN A 605 35.371 -45.678 10.451 1.00 36.49 C ATOM 714 O ASN A 605 34.647 -46.600 10.009 1.00 39.91 O ATOM 715 CB ASN A 605 33.353 -44.953 11.794 1.00 39.66 C ATOM 716 CG ASN A 605 33.072 -46.293 12.477 1.00 47.15 C ATOM 717 OD1 ASN A 605 33.795 -46.706 13.382 1.00 43.48 O ATOM 718 ND2 ASN A 605 32.019 -46.974 12.037 1.00 45.05 N ATOM 719 HD22 ASN A 605 31.434 -46.588 11.269 1.00 0.00 H ATOM 720 HD21 ASN A 605 31.780 -47.893 12.461 1.00 0.00 H ATOM 721 H ASN A 605 35.542 -42.717 11.937 1.00 0.00 H ATOM 722 N SER A 606 36.610 -45.416 10.007 1.00 33.10 N ATOM 723 CA SER A 606 37.349 -46.284 9.073 1.00 40.77 C ATOM 724 C SER A 606 37.035 -46.079 7.603 1.00 47.78 C ATOM 725 O SER A 606 37.573 -46.793 6.741 1.00 42.82 O ATOM 726 CB SER A 606 37.262 -47.773 9.449 1.00 53.64 C ATOM 727 OG SER A 606 37.762 -47.955 10.770 1.00 56.99 O ATOM 728 HG SER A 606 37.220 -47.421 11.403 1.00 0.00 H ATOM 729 H SER A 606 37.076 -44.549 10.342 1.00 0.00 H ATOM 730 N HIS A 607 36.124 -45.161 7.307 1.00 38.27 N ATOM 731 CA HIS A 607 35.711 -45.000 5.915 1.00 35.93 C ATOM 732 C HIS A 607 35.874 -43.573 5.429 1.00 37.13 C ATOM 733 O HIS A 607 35.948 -42.639 6.238 1.00 35.50 O ATOM 734 CB HIS A 607 34.263 -45.471 5.759 1.00 33.93 C ATOM 735 CG HIS A 607 34.117 -46.952 5.875 1.00 38.15 C ATOM 736 ND1 HIS A 607 33.427 -47.559 6.903 1.00 49.26 N ATOM 737 CD2 HIS A 607 34.597 -47.956 5.096 1.00 44.07 C ATOM 738 CE1 HIS A 607 33.481 -48.872 6.749 1.00 47.50 C ATOM 739 NE2 HIS A 607 34.189 -49.136 5.661 1.00 42.63 N ATOM 740 H HIS A 607 35.711 -44.566 8.053 1.00 0.00 H ATOM 741 N LEU A 608 35.927 -43.409 4.108 1.00 35.32 N ATOM 742 CA LEU A 608 36.097 -42.097 3.488 1.00 34.14 C ATOM 743 C LEU A 608 34.741 -41.502 3.119 1.00 31.62 C ATOM 744 O LEU A 608 33.792 -42.245 2.794 1.00 31.20 O ATOM 745 CB LEU A 608 36.977 -42.195 2.227 1.00 35.59 C ATOM 746 CG LEU A 608 38.381 -42.762 2.440 1.00 45.75 C ATOM 747 CD1 LEU A 608 39.234 -42.664 1.148 1.00 44.11 C ATOM 748 CD2 LEU A 608 39.049 -42.040 3.608 1.00 45.59 C ATOM 749 H LEU A 608 35.844 -44.246 3.496 1.00 0.00 H ATOM 750 N TYR A 609 34.639 -40.176 3.218 1.00 30.76 N ATOM 751 CA TYR A 609 33.439 -39.438 2.817 1.00 31.74 C ATOM 752 C TYR A 609 33.935 -38.213 2.055 1.00 37.59 C ATOM 753 O TYR A 609 35.084 -37.793 2.237 1.00 34.71 O ATOM 754 CB TYR A 609 32.664 -38.944 4.043 1.00 29.72 C ATOM 755 CG TYR A 609 32.108 -40.018 4.937 1.00 33.09 C ATOM 756 CD1 TYR A 609 30.728 -40.275 4.971 1.00 25.79 C ATOM 757 CD2 TYR A 609 32.952 -40.752 5.792 1.00 27.54 C ATOM 758 CE1 TYR A 609 30.195 -41.257 5.815 1.00 28.23 C ATOM 759 CE2 TYR A 609 32.436 -41.736 6.626 1.00 28.62 C ATOM 760 CZ TYR A 609 31.063 -41.986 6.635 1.00 29.41 C ATOM 761 OH TYR A 609 30.575 -42.967 7.477 1.00 32.90 O ATOM 762 HH TYR A 609 29.592 -43.030 7.374 1.00 0.00 H ATOM 763 H TYR A 609 35.447 -39.642 3.597 1.00 0.00 H ATOM 764 N GLY A 610 33.082 -37.625 1.214 1.00 30.19 N ATOM 765 CA GLY A 610 33.470 -36.403 0.527 1.00 30.97 C ATOM 766 C GLY A 610 32.378 -35.789 -0.341 1.00 35.00 C ATOM 767 O GLY A 610 31.386 -36.444 -0.701 1.00 33.44 O ATOM 768 H GLY A 610 32.142 -38.039 1.050 1.00 0.00 H ATOM 769 N THR A 611 32.572 -34.517 -0.680 1.00 32.90 N ATOM 770 CA THR A 611 31.634 -33.792 -1.535 1.00 33.71 C ATOM 771 C THR A 611 32.339 -33.483 -2.856 1.00 33.69 C ATOM 772 O THR A 611 33.313 -32.694 -2.901 1.00 31.37 O ATOM 773 CB THR A 611 31.165 -32.505 -0.816 1.00 30.11 C ATOM 774 OG1 THR A 611 30.480 -32.885 0.397 1.00 35.83 O ATOM 775 CG2 THR A 611 30.245 -31.655 -1.715 1.00 32.71 C ATOM 776 HG1 THR A 611 31.099 -33.393 0.979 1.00 0.00 H ATOM 777 H THR A 611 33.416 -34.024 -0.326 1.00 0.00 H ATOM 778 N SER A 612 31.893 -34.142 -3.923 1.00 33.23 N ATOM 779 CA SER A 612 32.579 -34.059 -5.202 1.00 35.29 C ATOM 780 C SER A 612 32.178 -32.795 -5.937 1.00 35.83 C ATOM 781 O SER A 612 31.043 -32.317 -5.787 1.00 32.01 O ATOM 782 CB SER A 612 32.265 -35.280 -6.083 1.00 36.09 C ATOM 783 OG SER A 612 30.890 -35.291 -6.474 1.00 33.16 O ATOM 784 HG SER A 612 30.319 -35.327 -5.666 1.00 0.00 H ATOM 785 H SER A 612 31.037 -34.727 -3.840 1.00 0.00 H ATOM 786 N VAL A 613 33.097 -32.267 -6.746 1.00 30.62 N ATOM 787 CA VAL A 613 32.770 -31.188 -7.662 1.00 35.54 C ATOM 788 C VAL A 613 31.574 -31.549 -8.549 1.00 36.93 C ATOM 789 O VAL A 613 30.663 -30.728 -8.753 1.00 31.79 O ATOM 790 CB VAL A 613 33.962 -30.876 -8.597 1.00 36.11 C ATOM 791 CG1 VAL A 613 33.542 -29.887 -9.681 1.00 38.34 C ATOM 792 CG2 VAL A 613 35.164 -30.365 -7.798 1.00 36.61 C ATOM 793 H VAL A 613 34.069 -32.636 -6.721 1.00 0.00 H ATOM 794 N GLN A 614 31.576 -32.772 -9.088 1.00 34.03 N ATOM 795 CA GLN A 614 30.541 -33.165 -10.043 1.00 38.51 C ATOM 796 C GLN A 614 29.153 -33.200 -9.382 1.00 36.52 C ATOM 797 O GLN A 614 28.144 -32.862 -10.031 1.00 35.45 O ATOM 798 CB GLN A 614 30.872 -34.525 -10.678 1.00 34.89 C ATOM 799 CG GLN A 614 29.815 -35.051 -11.662 1.00 40.09 C ATOM 800 CD GLN A 614 29.645 -34.167 -12.897 1.00 60.73 C ATOM 801 OE1 GLN A 614 30.615 -33.580 -13.410 1.00 63.33 O ATOM 802 NE2 GLN A 614 28.406 -34.080 -13.394 1.00 57.30 N ATOM 803 HE22 GLN A 614 27.624 -34.588 -12.933 1.00 0.00 H ATOM 804 HE21 GLN A 614 28.225 -33.505 -14.241 1.00 0.00 H ATOM 805 H GLN A 614 32.320 -33.450 -8.826 1.00 0.00 H ATOM 806 N SER A 615 29.088 -33.611 -8.117 1.00 34.70 N ATOM 807 CA SER A 615 27.798 -33.660 -7.422 1.00 32.37 C ATOM 808 C SER A 615 27.226 -32.252 -7.238 1.00 35.74 C ATOM 809 O SER A 615 26.011 -32.044 -7.345 1.00 35.45 O ATOM 810 CB SER A 615 27.915 -34.347 -6.052 1.00 31.32 C ATOM 811 OG SER A 615 27.760 -35.752 -6.183 1.00 36.96 O ATOM 812 HG SER A 615 27.838 -36.176 -5.292 1.00 0.00 H ATOM 813 H SER A 615 29.955 -33.898 -7.620 1.00 0.00 H ATOM 814 N VAL A 616 28.094 -31.282 -6.970 1.00 29.17 N ATOM 815 CA VAL A 616 27.627 -29.905 -6.795 1.00 31.52 C ATOM 816 C VAL A 616 27.138 -29.413 -8.137 1.00 35.99 C ATOM 817 O VAL A 616 26.070 -28.784 -8.238 1.00 38.83 O ATOM 818 CB VAL A 616 28.764 -28.976 -6.282 1.00 34.33 C ATOM 819 CG1 VAL A 616 28.290 -27.524 -6.225 1.00 32.80 C ATOM 820 CG2 VAL A 616 29.264 -29.447 -4.895 1.00 32.20 C ATOM 821 H VAL A 616 29.107 -31.501 -6.884 1.00 0.00 H ATOM 822 N ARG A 617 27.913 -29.720 -9.179 1.00 33.97 N ATOM 823 CA ARG A 617 27.598 -29.244 -10.522 1.00 33.79 C ATOM 824 C ARG A 617 26.208 -29.741 -10.921 1.00 36.88 C ATOM 825 O ARG A 617 25.410 -29.005 -11.531 1.00 36.79 O ATOM 826 CB ARG A 617 28.674 -29.714 -11.518 1.00 29.94 C ATOM 827 CG ARG A 617 28.407 -29.303 -12.954 1.00 41.89 C ATOM 828 CD ARG A 617 29.474 -29.859 -13.941 1.00 63.37 C ATOM 829 NE ARG A 617 30.871 -29.803 -13.463 1.00 65.58 N ATOM 830 CZ ARG A 617 31.646 -28.714 -13.517 1.00 67.08 C ATOM 831 NH1 ARG A 617 32.910 -28.770 -13.091 1.00 57.13 N ATOM 832 NH2 ARG A 617 31.158 -27.560 -13.992 1.00 63.12 N ATOM 833 HE ARG A 617 31.279 -30.669 -13.057 1.00 0.00 H ATOM 834 HH12 ARG A 617 33.511 -27.922 -13.134 1.00 0.00 H ATOM 835 HH11 ARG A 617 33.294 -29.661 -12.716 1.00 0.00 H ATOM 836 HH22 ARG A 617 31.765 -26.716 -14.032 1.00 0.00 H ATOM 837 HH21 ARG A 617 30.173 -27.508 -14.321 1.00 0.00 H ATOM 838 H ARG A 617 28.757 -30.309 -9.031 1.00 0.00 H ATOM 839 N GLU A 618 25.914 -30.992 -10.572 1.00 41.69 N ATOM 840 CA GLU A 618 24.628 -31.597 -10.936 1.00 47.29 C ATOM 841 C GLU A 618 23.449 -30.859 -10.301 1.00 40.27 C ATOM 842 O GLU A 618 22.411 -30.686 -10.940 1.00 40.12 O ATOM 843 CB GLU A 618 24.622 -33.097 -10.604 1.00 40.02 C ATOM 844 CG GLU A 618 25.390 -33.876 -11.679 1.00 59.69 C ATOM 845 CD GLU A 618 25.612 -35.347 -11.363 1.00 62.80 C ATOM 846 OE1 GLU A 618 26.274 -36.013 -12.195 1.00 51.80 O ATOM 847 OE2 GLU A 618 25.142 -35.836 -10.306 1.00 69.25 O ATOM 848 H GLU A 618 26.607 -31.549 -10.033 1.00 0.00 H ATOM 849 N VAL A 619 23.626 -30.394 -9.063 1.00 34.82 N ATOM 850 CA VAL A 619 22.596 -29.582 -8.408 1.00 37.62 C ATOM 851 C VAL A 619 22.470 -28.195 -9.048 1.00 40.83 C ATOM 852 O VAL A 619 21.353 -27.745 -9.364 1.00 36.40 O ATOM 853 CB VAL A 619 22.867 -29.478 -6.890 1.00 38.84 C ATOM 854 CG1 VAL A 619 21.909 -28.478 -6.224 1.00 33.37 C ATOM 855 CG2 VAL A 619 22.732 -30.855 -6.269 1.00 38.23 C ATOM 856 H VAL A 619 24.507 -30.611 -8.555 1.00 0.00 H ATOM 857 N ALA A 620 23.614 -27.532 -9.257 1.00 35.35 N ATOM 858 CA ALA A 620 23.644 -26.206 -9.881 1.00 34.03 C ATOM 859 C ALA A 620 22.994 -26.224 -11.259 1.00 42.72 C ATOM 860 O ALA A 620 22.262 -25.301 -11.643 1.00 41.37 O ATOM 861 CB ALA A 620 25.086 -25.704 -9.978 1.00 30.94 C ATOM 862 H ALA A 620 24.511 -27.972 -8.967 1.00 0.00 H ATOM 863 N GLU A 621 23.251 -27.283 -12.020 1.00 44.35 N ATOM 864 CA GLU A 621 22.697 -27.359 -13.367 1.00 45.21 C ATOM 865 C GLU A 621 21.193 -27.656 -13.385 1.00 51.08 C ATOM 866 O GLU A 621 20.529 -27.456 -14.410 1.00 46.30 O ATOM 867 CB GLU A 621 23.498 -28.345 -14.227 1.00 45.87 C ATOM 868 CG GLU A 621 24.912 -27.797 -14.510 1.00 65.32 C ATOM 869 CD GLU A 621 25.758 -28.693 -15.407 1.00 76.11 C ATOM 870 OE1 GLU A 621 25.477 -29.917 -15.493 1.00 75.63 O ATOM 871 OE2 GLU A 621 26.716 -28.160 -16.019 1.00 71.02 O ATOM 872 H GLU A 621 23.845 -28.055 -11.656 1.00 0.00 H ATOM 873 N GLN A 622 20.648 -28.088 -12.247 1.00 58.61 N ATOM 874 CA GLN A 622 19.198 -28.309 -12.138 1.00 54.03 C ATOM 875 C GLN A 622 18.491 -27.021 -11.714 1.00 53.62 C ATOM 876 O GLN A 622 17.272 -26.995 -11.576 1.00 56.01 O ATOM 877 CB GLN A 622 18.888 -29.475 -11.181 1.00 46.62 C ATOM 878 CG GLN A 622 19.090 -30.833 -11.852 1.00 66.22 C ATOM 879 CD GLN A 622 19.544 -31.922 -10.889 1.00 91.35 C ATOM 880 OE1 GLN A 622 19.520 -31.747 -9.660 1.00 96.11 O ATOM 881 NE2 GLN A 622 19.971 -33.057 -11.446 1.00 91.26 N ATOM 882 HE22 GLN A 622 19.974 -33.160 -12.481 1.00 0.00 H ATOM 883 HE21 GLN A 622 20.301 -33.839 -10.845 1.00 0.00 H ATOM 884 H GLN A 622 21.257 -28.271 -11.424 1.00 0.00 H ATOM 885 N GLY A 623 19.272 -25.955 -11.511 1.00 48.64 N ATOM 886 CA GLY A 623 18.716 -24.642 -11.238 1.00 45.12 C ATOM 887 C GLY A 623 18.496 -24.379 -9.757 1.00 45.09 C ATOM 888 O GLY A 623 17.820 -23.408 -9.393 1.00 47.47 O ATOM 889 H GLY A 623 20.305 -26.069 -11.550 1.00 0.00 H ATOM 890 N LYS A 624 19.068 -25.224 -8.896 1.00 41.48 N ATOM 891 CA LYS A 624 18.949 -25.022 -7.451 1.00 37.92 C ATOM 892 C LYS A 624 20.280 -24.600 -6.869 1.00 35.00 C ATOM 893 O LYS A 624 21.325 -25.099 -7.294 1.00 39.01 O ATOM 894 CB LYS A 624 18.497 -26.313 -6.757 1.00 37.03 C ATOM 895 CG LYS A 624 17.068 -26.753 -7.089 1.00 46.17 C ATOM 896 CD LYS A 624 16.578 -27.775 -6.048 1.00 55.37 C ATOM 897 CE LYS A 624 15.098 -28.103 -6.260 1.00 61.46 C ATOM 898 NZ LYS A 624 14.565 -29.029 -5.216 1.00 68.27 N ATOM 899 HZ1 LYS A 624 15.099 -29.921 -5.240 1.00 0.00 H ATOM 900 HZ2 LYS A 624 14.666 -28.588 -4.279 1.00 0.00 H ATOM 901 HZ3 LYS A 624 13.560 -29.220 -5.404 1.00 0.00 H ATOM 902 H LYS A 624 19.606 -26.038 -9.257 1.00 0.00 H ATOM 903 N HIS A 625 20.247 -23.686 -5.900 1.00 33.41 N ATOM 904 CA HIS A 625 21.441 -23.355 -5.127 1.00 31.08 C ATOM 905 C HIS A 625 21.785 -24.520 -4.213 1.00 37.00 C ATOM 906 O HIS A 625 20.951 -24.980 -3.427 1.00 35.47 O ATOM 907 CB HIS A 625 21.215 -22.104 -4.276 1.00 34.10 C ATOM 908 CG HIS A 625 20.922 -20.883 -5.087 1.00 38.59 C ATOM 909 ND1 HIS A 625 21.896 -20.210 -5.792 1.00 34.63 N ATOM 910 CD2 HIS A 625 19.759 -20.227 -5.328 1.00 44.11 C ATOM 911 CE1 HIS A 625 21.350 -19.185 -6.429 1.00 42.17 C ATOM 912 NE2 HIS A 625 20.055 -19.174 -6.162 1.00 46.14 N ATOM 913 H HIS A 625 19.353 -23.198 -5.690 1.00 0.00 H ATOM 914 N CYS A 626 23.015 -25.007 -4.324 1.00 33.30 N ATOM 915 CA CYS A 626 23.425 -26.148 -3.535 1.00 32.36 C ATOM 916 C CYS A 626 23.896 -25.610 -2.188 1.00 38.07 C ATOM 917 O CYS A 626 24.844 -24.815 -2.128 1.00 34.23 O ATOM 918 CB CYS A 626 24.565 -26.892 -4.242 1.00 36.00 C ATOM 919 SG CYS A 626 25.047 -28.420 -3.413 1.00 38.39 S ATOM 920 H CYS A 626 23.688 -24.565 -4.982 1.00 0.00 H ATOM 921 N ILE A 627 23.234 -26.023 -1.107 1.00 32.57 N ATOM 922 CA ILE A 627 23.639 -25.576 0.221 1.00 33.66 C ATOM 923 C ILE A 627 24.744 -26.523 0.662 1.00 38.82 C ATOM 924 O ILE A 627 24.516 -27.740 0.792 1.00 31.50 O ATOM 925 CB ILE A 627 22.464 -25.658 1.212 1.00 33.37 C ATOM 926 CG1 ILE A 627 21.413 -24.584 0.880 1.00 35.04 C ATOM 927 CG2 ILE A 627 22.959 -25.513 2.673 1.00 26.84 C ATOM 928 CD1 ILE A 627 21.898 -23.149 1.176 1.00 34.78 C ATOM 929 H ILE A 627 22.424 -26.667 -1.211 1.00 0.00 H ATOM 930 N LEU A 628 25.936 -25.973 0.876 1.00 30.69 N ATOM 931 CA LEU A 628 27.114 -26.785 1.176 1.00 28.74 C ATOM 932 C LEU A 628 27.557 -26.625 2.618 1.00 27.58 C ATOM 933 O LEU A 628 27.884 -25.499 3.043 1.00 31.83 O ATOM 934 CB LEU A 628 28.268 -26.386 0.243 1.00 30.09 C ATOM 935 CG LEU A 628 28.050 -26.870 -1.197 1.00 34.19 C ATOM 936 CD1 LEU A 628 28.981 -26.166 -2.202 1.00 32.42 C ATOM 937 CD2 LEU A 628 28.196 -28.392 -1.278 1.00 34.24 C ATOM 938 H LEU A 628 26.032 -24.939 0.829 1.00 0.00 H ATOM 939 N ASP A 629 27.636 -27.752 3.353 1.00 30.77 N ATOM 940 CA ASP A 629 28.216 -27.745 4.691 1.00 34.36 C ATOM 941 C ASP A 629 29.638 -28.253 4.509 1.00 34.10 C ATOM 942 O ASP A 629 29.902 -29.464 4.576 1.00 30.48 O ATOM 943 CB ASP A 629 27.438 -28.783 5.520 1.00 32.43 C ATOM 944 CG ASP A 629 27.934 -28.907 6.974 1.00 39.81 C ATOM 945 OD1 ASP A 629 27.492 -29.858 7.680 1.00 35.47 O ATOM 946 OD2 ASP A 629 28.740 -28.057 7.437 1.00 37.72 O ATOM 947 H ASP A 629 27.276 -28.644 2.958 1.00 0.00 H ATOM 948 N VAL A 630 30.570 -27.306 4.454 1.00 33.06 N ATOM 949 CA VAL A 630 31.974 -27.571 4.078 1.00 36.67 C ATOM 950 C VAL A 630 32.849 -26.455 4.684 1.00 35.96 C ATOM 951 O VAL A 630 32.324 -25.423 5.122 1.00 34.70 O ATOM 952 CB VAL A 630 32.201 -27.640 2.545 1.00 35.49 C ATOM 953 CG1 VAL A 630 31.508 -28.848 1.910 1.00 31.50 C ATOM 954 CG2 VAL A 630 31.759 -26.325 1.857 1.00 32.12 C ATOM 955 H VAL A 630 30.297 -26.330 4.687 1.00 0.00 H ATOM 956 N SER A 631 34.162 -26.680 4.763 1.00 33.97 N ATOM 957 CA SER A 631 35.095 -25.685 5.293 1.00 36.79 C ATOM 958 C SER A 631 35.333 -24.586 4.262 1.00 38.81 C ATOM 959 O SER A 631 35.036 -24.772 3.084 1.00 34.94 O ATOM 960 CB SER A 631 36.440 -26.317 5.651 1.00 39.97 C ATOM 961 OG SER A 631 37.150 -26.630 4.452 1.00 38.81 O ATOM 962 HG SER A 631 36.618 -27.266 3.911 1.00 0.00 H ATOM 963 H SER A 631 34.535 -27.594 4.437 1.00 0.00 H ATOM 964 N ALA A 632 35.855 -23.447 4.708 1.00 42.13 N ATOM 965 CA ALA A 632 36.253 -22.374 3.797 1.00 42.52 C ATOM 966 C ALA A 632 37.260 -22.804 2.701 1.00 43.95 C ATOM 967 O ALA A 632 37.363 -22.130 1.667 1.00 40.56 O ATOM 968 CB ALA A 632 36.799 -21.192 4.595 1.00 42.85 C ATOM 969 H ALA A 632 35.984 -23.316 5.732 1.00 0.00 H ATOM 970 N ASN A 633 38.014 -23.890 2.923 1.00 46.23 N ATOM 971 CA ASN A 633 38.948 -24.390 1.896 1.00 41.51 C ATOM 972 C ASN A 633 38.218 -24.848 0.643 1.00 40.32 C ATOM 973 O ASN A 633 38.787 -24.858 -0.442 1.00 40.18 O ATOM 974 CB ASN A 633 39.791 -25.554 2.421 1.00 36.45 C ATOM 975 CG ASN A 633 40.639 -25.160 3.610 1.00 45.80 C ATOM 976 OD1 ASN A 633 41.604 -24.392 3.480 1.00 45.74 O ATOM 977 ND2 ASN A 633 40.280 -25.671 4.788 1.00 51.05 N ATOM 978 HD22 ASN A 633 39.463 -26.312 4.850 1.00 0.00 H ATOM 979 HD21 ASN A 633 40.817 -25.429 5.645 1.00 0.00 H ATOM 980 H ASN A 633 37.939 -24.388 3.833 1.00 0.00 H ATOM 981 N ALA A 634 36.952 -25.229 0.788 1.00 33.78 N ATOM 982 CA ALA A 634 36.168 -25.684 -0.358 1.00 31.14 C ATOM 983 C ALA A 634 35.801 -24.543 -1.320 1.00 42.59 C ATOM 984 O ALA A 634 35.490 -24.787 -2.497 1.00 37.01 O ATOM 985 CB ALA A 634 34.896 -26.435 0.121 1.00 34.65 C ATOM 986 H ALA A 634 36.514 -25.203 1.731 1.00 0.00 H ATOM 987 N VAL A 635 35.828 -23.299 -0.834 1.00 48.52 N ATOM 988 CA VAL A 635 35.540 -22.142 -1.701 1.00 38.82 C ATOM 989 C VAL A 635 36.527 -22.017 -2.853 1.00 41.27 C ATOM 990 O VAL A 635 36.122 -21.962 -4.020 1.00 43.79 O ATOM 991 CB VAL A 635 35.526 -20.819 -0.905 1.00 39.03 C ATOM 992 CG1 VAL A 635 35.193 -19.637 -1.814 1.00 43.65 C ATOM 993 CG2 VAL A 635 34.535 -20.924 0.245 1.00 39.07 C ATOM 994 H VAL A 635 36.055 -23.145 0.169 1.00 0.00 H ATOM 995 N ARG A 636 37.825 -21.966 -2.551 1.00 49.53 N ATOM 996 CA ARG A 636 38.811 -21.859 -3.626 1.00 47.30 C ATOM 997 C ARG A 636 38.734 -23.059 -4.566 1.00 37.74 C ATOM 998 O ARG A 636 39.058 -22.953 -5.752 1.00 44.39 O ATOM 999 CB ARG A 636 40.239 -21.727 -3.062 1.00 56.88 C ATOM 1000 H ARG A 636 38.134 -22.002 -1.559 1.00 0.00 H ATOM 1001 N ARG A 637 38.329 -24.211 -4.041 1.00 39.00 N ATOM 1002 CA ARG A 637 38.230 -25.419 -4.867 1.00 39.25 C ATOM 1003 C ARG A 637 37.067 -25.323 -5.855 1.00 32.52 C ATOM 1004 O ARG A 637 37.217 -25.698 -7.021 1.00 41.91 O ATOM 1005 CB ARG A 637 38.112 -26.679 -3.981 1.00 38.15 C ATOM 1006 CG ARG A 637 39.420 -26.994 -3.226 1.00 43.47 C ATOM 1007 CD ARG A 637 39.242 -28.071 -2.166 1.00 42.86 C ATOM 1008 NE ARG A 637 40.427 -28.157 -1.312 1.00 44.14 N ATOM 1009 CZ ARG A 637 40.405 -28.488 -0.019 1.00 53.30 C ATOM 1010 NH1 ARG A 637 39.247 -28.769 0.598 1.00 41.12 N ATOM 1011 NH2 ARG A 637 41.550 -28.535 0.660 1.00 46.88 N ATOM 1012 HE ARG A 637 41.350 -27.946 -1.742 1.00 0.00 H ATOM 1013 HH12 ARG A 637 39.244 -29.026 1.606 1.00 0.00 H ATOM 1014 HH11 ARG A 637 38.353 -28.730 0.068 1.00 0.00 H ATOM 1015 HH22 ARG A 637 41.547 -28.791 1.668 1.00 0.00 H ATOM 1016 HH21 ARG A 637 42.447 -28.315 0.182 1.00 0.00 H ATOM 1017 H ARG A 637 38.079 -24.256 -3.032 1.00 0.00 H ATOM 1018 N LEU A 638 35.917 -24.824 -5.387 1.00 40.09 N ATOM 1019 CA LEU A 638 34.766 -24.570 -6.273 1.00 38.08 C ATOM 1020 C LEU A 638 35.079 -23.506 -7.330 1.00 39.03 C ATOM 1021 O LEU A 638 34.735 -23.667 -8.515 1.00 41.49 O ATOM 1022 CB LEU A 638 33.538 -24.155 -5.463 1.00 36.29 C ATOM 1023 CG LEU A 638 32.698 -25.300 -4.883 1.00 38.54 C ATOM 1024 CD1 LEU A 638 31.493 -24.717 -4.129 1.00 40.79 C ATOM 1025 CD2 LEU A 638 32.245 -26.288 -5.972 1.00 36.56 C ATOM 1026 H LEU A 638 35.833 -24.610 -4.373 1.00 0.00 H ATOM 1027 N GLN A 639 35.741 -22.426 -6.918 1.00 42.67 N ATOM 1028 CA GLN A 639 36.193 -21.428 -7.897 1.00 45.68 C ATOM 1029 C GLN A 639 37.115 -22.051 -8.937 1.00 44.06 C ATOM 1030 O GLN A 639 36.941 -21.828 -10.151 1.00 47.77 O ATOM 1031 CB GLN A 639 36.851 -20.223 -7.214 1.00 48.77 C ATOM 1032 CG GLN A 639 37.520 -19.265 -8.213 1.00 61.34 C ATOM 1033 CD GLN A 639 38.068 -17.987 -7.572 1.00 71.01 C ATOM 1034 OE1 GLN A 639 37.542 -17.498 -6.559 1.00 75.34 O ATOM 1035 NE2 GLN A 639 39.123 -17.430 -8.179 1.00 76.76 N ATOM 1036 HE22 GLN A 639 39.531 -17.875 -9.026 1.00 0.00 H ATOM 1037 HE21 GLN A 639 39.535 -16.552 -7.804 1.00 0.00 H ATOM 1038 H GLN A 639 35.937 -22.290 -5.906 1.00 0.00 H ATOM 1039 N ALA A 640 38.073 -22.868 -8.494 1.00 50.59 N ATOM 1040 CA ALA A 640 39.002 -23.493 -9.446 1.00 47.61 C ATOM 1041 C ALA A 640 38.277 -24.467 -10.393 1.00 50.55 C ATOM 1042 O ALA A 640 38.767 -24.765 -11.481 1.00 49.75 O ATOM 1043 CB ALA A 640 40.161 -24.180 -8.715 1.00 50.81 C ATOM 1044 H ALA A 640 38.162 -23.062 -7.476 1.00 0.00 H ATOM 1045 N ALA A 641 37.106 -24.956 -9.980 1.00 46.46 N ATOM 1046 CA ALA A 641 36.297 -25.804 -10.859 1.00 46.27 C ATOM 1047 C ALA A 641 35.299 -24.985 -11.692 1.00 51.13 C ATOM 1048 O ALA A 641 34.503 -25.559 -12.452 1.00 52.90 O ATOM 1049 CB ALA A 641 35.570 -26.890 -10.037 1.00 43.89 C ATOM 1050 H ALA A 641 36.764 -24.733 -9.024 1.00 0.00 H ATOM 1051 N HIS A 642 35.360 -23.650 -11.540 1.00 48.04 N ATOM 1052 CA HIS A 642 34.493 -22.686 -12.245 1.00 42.44 C ATOM 1053 C HIS A 642 33.004 -22.874 -11.921 1.00 40.23 C ATOM 1054 O HIS A 642 32.132 -22.732 -12.785 1.00 47.71 O ATOM 1055 CB HIS A 642 34.766 -22.708 -13.747 1.00 50.08 C ATOM 1056 CG HIS A 642 36.227 -22.616 -14.077 1.00 61.97 C ATOM 1057 ND1 HIS A 642 36.887 -23.580 -14.809 1.00 70.27 N ATOM 1058 CD2 HIS A 642 37.162 -21.695 -13.739 1.00 61.13 C ATOM 1059 CE1 HIS A 642 38.160 -23.248 -14.924 1.00 78.30 C ATOM 1060 NE2 HIS A 642 38.355 -22.112 -14.278 1.00 71.90 N ATOM 1061 H HIS A 642 36.068 -23.270 -10.879 1.00 0.00 H ATOM 1062 N LEU A 643 32.740 -23.197 -10.662 1.00 34.55 N ATOM 1063 CA LEU A 643 31.377 -23.299 -10.147 1.00 37.00 C ATOM 1064 C LEU A 643 30.845 -22.034 -9.406 1.00 42.62 C ATOM 1065 O LEU A 643 29.699 -22.006 -8.997 1.00 52.26 O ATOM 1066 CB LEU A 643 31.205 -24.590 -9.320 1.00 36.64 C ATOM 1067 CG LEU A 643 31.217 -25.886 -10.167 1.00 46.77 C ATOM 1068 CD1 LEU A 643 31.043 -27.160 -9.351 1.00 47.32 C ATOM 1069 CD2 LEU A 643 30.148 -25.846 -11.245 1.00 54.79 C ATOM 1070 H LEU A 643 33.534 -23.385 -10.017 1.00 0.00 H ATOM 1071 N HIS A 644 31.658 -20.988 -9.267 1.00 39.23 N ATOM 1072 CA HIS A 644 31.185 -19.682 -8.758 1.00 35.06 C ATOM 1073 C HIS A 644 30.418 -19.743 -7.438 1.00 33.88 C ATOM 1074 O HIS A 644 29.216 -19.418 -7.402 1.00 29.78 O ATOM 1075 CB HIS A 644 30.281 -18.976 -9.787 1.00 45.81 C ATOM 1076 CG HIS A 644 30.773 -19.041 -11.203 1.00 50.10 C ATOM 1077 ND1 HIS A 644 32.117 -19.073 -11.537 1.00 49.69 N ATOM 1078 CD2 HIS A 644 30.096 -19.086 -12.375 1.00 59.08 C ATOM 1079 CE1 HIS A 644 32.240 -19.136 -12.850 1.00 57.20 C ATOM 1080 NE2 HIS A 644 31.030 -19.139 -13.385 1.00 57.60 N ATOM 1081 H HIS A 644 32.660 -21.093 -9.525 1.00 0.00 H ATOM 1082 N PRO A 645 31.092 -20.152 -6.339 1.00 35.61 N ATOM 1083 CA PRO A 645 30.358 -20.233 -5.076 1.00 32.03 C ATOM 1084 C PRO A 645 30.034 -18.831 -4.549 1.00 34.03 C ATOM 1085 O PRO A 645 30.772 -17.863 -4.816 1.00 34.70 O ATOM 1086 CB PRO A 645 31.364 -20.914 -4.123 1.00 28.74 C ATOM 1087 CG PRO A 645 32.723 -20.536 -4.687 1.00 39.17 C ATOM 1088 CD PRO A 645 32.527 -20.496 -6.190 1.00 42.61 C ATOM 1089 N ILE A 646 28.927 -18.730 -3.825 1.00 32.97 N ATOM 1090 CA ILE A 646 28.611 -17.518 -3.094 1.00 33.36 C ATOM 1091 C ILE A 646 29.019 -17.879 -1.664 1.00 38.14 C ATOM 1092 O ILE A 646 28.367 -18.714 -1.009 1.00 30.38 O ATOM 1093 CB ILE A 646 27.086 -17.239 -3.135 1.00 31.45 C ATOM 1094 CG1 ILE A 646 26.634 -16.779 -4.525 1.00 31.80 C ATOM 1095 CG2 ILE A 646 26.682 -16.193 -2.083 1.00 30.00 C ATOM 1096 CD1 ILE A 646 25.104 -16.573 -4.613 1.00 32.93 C ATOM 1097 H ILE A 646 28.272 -19.537 -3.781 1.00 0.00 H ATOM 1098 N ALA A 647 30.109 -17.274 -1.199 1.00 31.62 N ATOM 1099 CA ALA A 647 30.656 -17.569 0.122 1.00 37.17 C ATOM 1100 C ALA A 647 30.290 -16.438 1.091 1.00 29.87 C ATOM 1101 O ALA A 647 30.740 -15.291 0.926 1.00 33.64 O ATOM 1102 CB ALA A 647 32.189 -17.743 0.035 1.00 36.19 C ATOM 1103 H ALA A 647 30.586 -16.569 -1.796 1.00 0.00 H ATOM 1104 N ILE A 648 29.490 -16.770 2.097 1.00 35.04 N ATOM 1105 CA ILE A 648 28.991 -15.779 3.035 1.00 37.45 C ATOM 1106 C ILE A 648 29.515 -16.076 4.437 1.00 39.93 C ATOM 1107 O ILE A 648 29.282 -17.169 4.986 1.00 36.46 O ATOM 1108 CB ILE A 648 27.442 -15.782 3.054 1.00 37.50 C ATOM 1109 CG1 ILE A 648 26.883 -15.457 1.652 1.00 34.52 C ATOM 1110 CG2 ILE A 648 26.904 -14.793 4.080 1.00 33.89 C ATOM 1111 CD1 ILE A 648 25.407 -15.808 1.531 1.00 35.91 C ATOM 1112 H ILE A 648 29.213 -17.765 2.217 1.00 0.00 H ATOM 1113 N PHE A 649 30.191 -15.091 5.025 1.00 37.04 N ATOM 1114 CA PHE A 649 30.723 -15.237 6.370 1.00 32.27 C ATOM 1115 C PHE A 649 29.852 -14.466 7.362 1.00 39.51 C ATOM 1116 O PHE A 649 29.608 -13.260 7.188 1.00 38.11 O ATOM 1117 CB PHE A 649 32.185 -14.754 6.426 1.00 32.55 C ATOM 1118 CG PHE A 649 32.803 -14.768 7.832 1.00 36.67 C ATOM 1119 CD1 PHE A 649 32.887 -15.950 8.568 1.00 34.99 C ATOM 1120 CD2 PHE A 649 33.327 -13.610 8.383 1.00 37.59 C ATOM 1121 CE1 PHE A 649 33.475 -15.966 9.844 1.00 32.70 C ATOM 1122 CE2 PHE A 649 33.922 -13.617 9.663 1.00 42.85 C ATOM 1123 CZ PHE A 649 33.984 -14.792 10.389 1.00 36.74 C ATOM 1124 H PHE A 649 30.341 -14.199 4.512 1.00 0.00 H ATOM 1125 N ILE A 650 29.390 -15.161 8.401 1.00 37.76 N ATOM 1126 CA ILE A 650 28.634 -14.515 9.469 1.00 37.37 C ATOM 1127 C ILE A 650 29.643 -14.121 10.550 1.00 41.76 C ATOM 1128 O ILE A 650 30.225 -14.983 11.217 1.00 35.55 O ATOM 1129 CB ILE A 650 27.560 -15.479 10.061 1.00 33.17 C ATOM 1130 CG1 ILE A 650 26.588 -15.971 8.974 1.00 32.93 C ATOM 1131 CG2 ILE A 650 26.791 -14.808 11.225 1.00 39.56 C ATOM 1132 CD1 ILE A 650 25.747 -17.166 9.416 1.00 33.67 C ATOM 1133 H ILE A 650 29.572 -16.184 8.452 1.00 0.00 H ATOM 1134 N ARG A 651 29.859 -12.818 10.721 1.00 39.38 N ATOM 1135 CA ARG A 651 30.903 -12.351 11.623 1.00 44.36 C ATOM 1136 C ARG A 651 30.312 -11.909 12.966 1.00 45.98 C ATOM 1137 O ARG A 651 29.459 -11.006 13.002 1.00 44.79 O ATOM 1138 CB ARG A 651 31.692 -11.191 10.999 1.00 43.47 C ATOM 1139 CG ARG A 651 32.788 -10.618 11.932 1.00 52.84 C ATOM 1140 CD ARG A 651 33.693 -9.606 11.214 1.00 57.39 C ATOM 1141 NE ARG A 651 32.965 -8.426 10.766 1.00 55.07 N ATOM 1142 CZ ARG A 651 33.394 -7.572 9.835 1.00 66.43 C ATOM 1143 NH1 ARG A 651 32.650 -6.522 9.505 1.00 67.25 N ATOM 1144 NH2 ARG A 651 34.562 -7.755 9.228 1.00 65.85 N ATOM 1145 HE ARG A 651 32.042 -8.235 11.205 1.00 0.00 H ATOM 1146 HH12 ARG A 651 32.984 -5.856 8.779 1.00 0.00 H ATOM 1147 HH11 ARG A 651 31.734 -6.366 9.972 1.00 0.00 H ATOM 1148 HH22 ARG A 651 34.883 -7.081 8.504 1.00 0.00 H ATOM 1149 HH21 ARG A 651 35.155 -8.572 9.477 1.00 0.00 H ATOM 1150 H ARG A 651 29.277 -12.127 10.206 1.00 0.00 H ATOM 1151 N PRO A 652 30.755 -12.549 14.073 1.00 39.53 N ATOM 1152 CA PRO A 652 30.336 -12.061 15.390 1.00 42.00 C ATOM 1153 C PRO A 652 31.009 -10.735 15.662 1.00 48.85 C ATOM 1154 O PRO A 652 32.217 -10.622 15.394 1.00 49.60 O ATOM 1155 CB PRO A 652 30.871 -13.130 16.372 1.00 44.63 C ATOM 1156 CG PRO A 652 31.987 -13.824 15.653 1.00 41.97 C ATOM 1157 CD PRO A 652 31.591 -13.766 14.160 1.00 39.88 C ATOM 1158 N ARG A 653 30.255 -9.771 16.196 1.00 50.87 N ATOM 1159 CA ARG A 653 30.785 -8.458 16.515 1.00 54.25 C ATOM 1160 C ARG A 653 31.655 -8.543 17.764 1.00 64.92 C ATOM 1161 O ARG A 653 32.584 -7.737 17.950 1.00 66.29 O ATOM 1162 CB ARG A 653 29.643 -7.455 16.733 1.00 59.20 C ATOM 1163 CG ARG A 653 28.810 -7.185 15.482 1.00 62.32 C ATOM 1164 CD ARG A 653 27.487 -6.471 15.791 1.00 70.20 C ATOM 1165 NE ARG A 653 26.857 -5.972 14.564 1.00 66.87 N ATOM 1166 CZ ARG A 653 25.554 -5.760 14.412 1.00 58.85 C ATOM 1167 NH1 ARG A 653 25.089 -5.302 13.255 1.00 58.55 N ATOM 1168 NH2 ARG A 653 24.716 -6.010 15.412 1.00 68.43 N ATOM 1169 HE ARG A 653 27.476 -5.769 13.753 1.00 0.00 H ATOM 1170 HH12 ARG A 653 24.070 -5.135 13.134 1.00 0.00 H ATOM 1171 HH11 ARG A 653 25.744 -5.110 12.471 1.00 0.00 H ATOM 1172 HH22 ARG A 653 23.697 -5.843 15.290 1.00 0.00 H ATOM 1173 HH21 ARG A 653 25.079 -6.373 16.317 1.00 0.00 H ATOM 1174 H ARG A 653 29.252 -9.968 16.390 1.00 0.00 H ATOM 1175 N SER A 654 31.333 -9.509 18.624 1.00 56.99 N ATOM 1176 CA SER A 654 32.051 -9.708 19.876 1.00 57.62 C ATOM 1177 C SER A 654 31.647 -11.022 20.508 1.00 57.75 C ATOM 1178 O SER A 654 30.766 -11.725 20.000 1.00 56.69 O ATOM 1179 CB SER A 654 31.724 -8.579 20.857 1.00 67.03 C ATOM 1180 OG SER A 654 30.319 -8.418 20.997 1.00 59.62 O ATOM 1181 HG SER A 654 30.134 -7.684 21.635 1.00 0.00 H ATOM 1182 H SER A 654 30.541 -10.143 18.393 1.00 0.00 H ATOM 1183 N LEU A 655 32.281 -11.336 21.630 1.00 51.96 N ATOM 1184 CA LEU A 655 31.890 -12.475 22.448 1.00 58.26 C ATOM 1185 C LEU A 655 30.424 -12.325 22.841 1.00 58.77 C ATOM 1186 O LEU A 655 29.634 -13.239 22.626 1.00 57.87 O ATOM 1187 CB LEU A 655 32.771 -12.568 23.697 1.00 66.19 C ATOM 1188 CG LEU A 655 32.340 -13.613 24.729 1.00 72.75 C ATOM 1189 CD1 LEU A 655 32.215 -14.973 24.072 1.00 70.27 C ATOM 1190 CD2 LEU A 655 33.317 -13.667 25.893 1.00 80.71 C ATOM 1191 H LEU A 655 33.084 -10.749 21.935 1.00 0.00 H ATOM 1192 N GLU A 656 30.074 -11.157 23.382 1.00 61.79 N ATOM 1193 CA GLU A 656 28.694 -10.795 23.733 1.00 66.40 C ATOM 1194 C GLU A 656 27.718 -11.070 22.580 1.00 54.00 C ATOM 1195 O GLU A 656 26.625 -11.610 22.775 1.00 61.97 O ATOM 1196 CB GLU A 656 28.615 -9.297 24.088 1.00 74.02 C ATOM 1197 CG GLU A 656 29.275 -8.854 25.404 1.00 93.69 C ATOM 1198 CD GLU A 656 30.801 -9.012 25.444 1.00 91.57 C ATOM 1199 OE1 GLU A 656 31.482 -8.713 24.430 1.00 73.40 O ATOM 1200 OE2 GLU A 656 31.312 -9.430 26.516 1.00 92.50 O ATOM 1201 H GLU A 656 30.824 -10.460 23.567 1.00 0.00 H ATOM 1202 N ASN A 657 28.109 -10.693 21.376 1.00 57.14 N ATOM 1203 CA ASN A 657 27.235 -10.856 20.221 1.00 52.71 C ATOM 1204 C ASN A 657 26.976 -12.331 19.830 1.00 57.18 C ATOM 1205 O ASN A 657 25.910 -12.662 19.300 1.00 53.92 O ATOM 1206 CB ASN A 657 27.779 -10.045 19.038 1.00 48.74 C ATOM 1207 CG ASN A 657 26.898 -10.147 17.796 1.00 49.71 C ATOM 1208 OD1 ASN A 657 27.357 -10.553 16.737 1.00 53.94 O ATOM 1209 ND2 ASN A 657 25.626 -9.759 17.926 1.00 50.10 N ATOM 1210 HD22 ASN A 657 25.277 -9.420 18.845 1.00 0.00 H ATOM 1211 HD21 ASN A 657 24.985 -9.796 17.108 1.00 0.00 H ATOM 1212 H ASN A 657 29.053 -10.274 21.250 1.00 0.00 H ATOM 1213 N VAL A 658 27.949 -13.205 20.084 1.00 51.40 N ATOM 1214 CA VAL A 658 27.774 -14.643 19.864 1.00 54.31 C ATOM 1215 C VAL A 658 26.601 -15.198 20.700 1.00 56.13 C ATOM 1216 O VAL A 658 25.778 -15.983 20.208 1.00 57.22 O ATOM 1217 CB VAL A 658 29.060 -15.415 20.212 1.00 55.02 C ATOM 1218 CG1 VAL A 658 28.836 -16.911 20.078 1.00 51.49 C ATOM 1219 CG2 VAL A 658 30.204 -14.966 19.305 1.00 50.49 C ATOM 1220 H VAL A 658 28.859 -12.857 20.449 1.00 0.00 H ATOM 1221 N LEU A 659 26.519 -14.762 21.952 1.00 49.72 N ATOM 1222 CA LEU A 659 25.468 -15.205 22.865 1.00 51.39 C ATOM 1223 C LEU A 659 24.115 -14.566 22.530 1.00 57.50 C ATOM 1224 O LEU A 659 23.065 -14.988 23.039 1.00 64.13 O ATOM 1225 CB LEU A 659 25.872 -14.889 24.305 1.00 56.28 C ATOM 1226 CG LEU A 659 27.060 -15.700 24.839 1.00 62.92 C ATOM 1227 CD1 LEU A 659 27.654 -15.072 26.110 1.00 73.59 C ATOM 1228 CD2 LEU A 659 26.640 -17.141 25.113 1.00 65.69 C ATOM 1229 H LEU A 659 27.227 -14.082 22.294 1.00 0.00 H ATOM 1230 N GLU A 660 24.153 -13.524 21.707 1.00 63.04 N ATOM 1231 CA GLU A 660 22.940 -12.923 21.152 1.00 73.75 C ATOM 1232 C GLU A 660 22.392 -13.718 19.953 1.00 56.42 C ATOM 1233 O GLU A 660 21.183 -13.911 19.809 1.00 61.18 O ATOM 1234 CB GLU A 660 23.230 -11.479 20.720 1.00 69.40 C ATOM 1235 CG GLU A 660 23.702 -10.573 21.865 1.00 70.59 C ATOM 1236 CD GLU A 660 24.156 -9.200 21.378 1.00 86.57 C ATOM 1237 OE1 GLU A 660 23.901 -8.844 20.201 1.00 81.19 O ATOM 1238 OE2 GLU A 660 24.772 -8.469 22.180 1.00104.13 O ATOM 1239 H GLU A 660 25.076 -13.122 21.448 1.00 0.00 H ATOM 1240 N ILE A 661 23.287 -14.139 19.073 1.00 54.92 N ATOM 1241 CA ILE A 661 22.869 -14.852 17.874 1.00 56.53 C ATOM 1242 C ILE A 661 22.825 -16.381 18.038 1.00 56.50 C ATOM 1243 O ILE A 661 22.251 -17.084 17.203 1.00 56.51 O ATOM 1244 CB ILE A 661 23.743 -14.454 16.676 1.00 45.72 C ATOM 1245 CG1 ILE A 661 25.143 -15.055 16.816 1.00 42.39 C ATOM 1246 CG2 ILE A 661 23.784 -12.926 16.553 1.00 48.16 C ATOM 1247 CD1 ILE A 661 26.086 -14.686 15.659 1.00 46.40 C ATOM 1248 H ILE A 661 24.298 -13.959 19.239 1.00 0.00 H ATOM 1249 N ASN A 662 23.414 -16.892 19.116 1.00 56.97 N ATOM 1250 CA ASN A 662 23.263 -18.304 19.451 1.00 61.00 C ATOM 1251 C ASN A 662 22.876 -18.483 20.923 1.00 61.19 C ATOM 1252 O ASN A 662 23.697 -18.270 21.821 1.00 65.02 O ATOM 1253 CB ASN A 662 24.557 -19.053 19.113 1.00 58.95 C ATOM 1254 CG ASN A 662 24.428 -20.559 19.266 1.00 65.73 C ATOM 1255 OD1 ASN A 662 23.545 -21.060 19.967 1.00 62.41 O ATOM 1256 ND2 ASN A 662 25.331 -21.292 18.620 1.00 56.09 N ATOM 1257 HD22 ASN A 662 26.059 -20.828 18.040 1.00 0.00 H ATOM 1258 HD21 ASN A 662 25.309 -22.329 18.696 1.00 0.00 H ATOM 1259 H ASN A 662 23.989 -16.278 19.727 1.00 0.00 H ATOM 1260 N LYS A 663 21.651 -18.941 21.161 1.00 65.70 N ATOM 1261 CA LYS A 663 21.097 -19.009 22.511 1.00 66.88 C ATOM 1262 C LYS A 663 21.307 -20.379 23.135 1.00 67.79 C ATOM 1263 O LYS A 663 20.881 -20.629 24.272 1.00 72.87 O ATOM 1264 CB LYS A 663 19.602 -18.681 22.485 1.00 75.36 C ATOM 1265 CG LYS A 663 19.254 -17.349 21.828 1.00 80.04 C ATOM 1266 CD LYS A 663 19.634 -16.179 22.726 1.00 92.97 C ATOM 1267 CE LYS A 663 19.145 -14.858 22.145 1.00 95.71 C ATOM 1268 NZ LYS A 663 17.663 -14.832 21.992 1.00 98.03 N ATOM 1269 HZ1 LYS A 663 17.368 -15.598 21.353 1.00 0.00 H ATOM 1270 HZ2 LYS A 663 17.217 -14.964 22.922 1.00 0.00 H ATOM 1271 HZ3 LYS A 663 17.373 -13.916 21.594 1.00 0.00 H ATOM 1272 H LYS A 663 21.069 -19.261 20.361 1.00 0.00 H ATOM 1273 N ARG A 664 21.961 -21.265 22.387 1.00 66.78 N ATOM 1274 CA ARG A 664 22.128 -22.652 22.820 1.00 81.41 C ATOM 1275 C ARG A 664 23.431 -22.945 23.570 1.00 90.98 C ATOM 1276 O ARG A 664 23.615 -24.059 24.060 1.00104.99 O ATOM 1277 CB ARG A 664 21.991 -23.601 21.622 1.00 71.77 C ATOM 1278 H ARG A 664 22.362 -20.965 21.476 1.00 0.00 H ATOM 1279 N ILE A 665 24.315 -21.955 23.699 1.00 74.32 N ATOM 1280 CA ILE A 665 25.660 -22.221 24.229 1.00 73.93 C ATOM 1281 C ILE A 665 26.081 -21.356 25.429 1.00 74.40 C ATOM 1282 O ILE A 665 25.544 -20.268 25.629 1.00 84.88 O ATOM 1283 CB ILE A 665 26.735 -22.095 23.107 1.00 73.62 C ATOM 1284 CG1 ILE A 665 26.801 -20.668 22.553 1.00 59.52 C ATOM 1285 CG2 ILE A 665 26.447 -23.064 21.959 1.00 74.84 C ATOM 1286 CD1 ILE A 665 27.910 -20.498 21.532 1.00 55.02 C ATOM 1287 H ILE A 665 24.051 -20.988 23.423 1.00 0.00 H ATOM 1288 N THR A 666 27.040 -21.865 26.214 1.00 72.11 N ATOM 1289 CA THR A 666 27.684 -21.152 27.338 1.00 76.39 C ATOM 1290 C THR A 666 28.672 -20.055 26.918 1.00 70.99 C ATOM 1291 O THR A 666 29.120 -20.023 25.774 1.00 65.74 O ATOM 1292 CB THR A 666 28.484 -22.100 28.267 1.00 91.46 C ATOM 1293 OG1 THR A 666 29.702 -22.499 27.619 1.00 87.71 O ATOM 1294 CG2 THR A 666 27.664 -23.321 28.665 1.00 95.97 C ATOM 1295 HG1 THR A 666 29.487 -22.970 26.775 1.00 0.00 H ATOM 1296 H THR A 666 27.356 -22.836 26.018 1.00 0.00 H ATOM 1297 N GLU A 667 28.999 -19.160 27.853 1.00 84.46 N ATOM 1298 CA GLU A 667 29.980 -18.093 27.616 1.00 86.30 C ATOM 1299 C GLU A 667 31.352 -18.616 27.159 1.00 83.75 C ATOM 1300 O GLU A 667 31.984 -18.037 26.270 1.00 69.66 O ATOM 1301 CB GLU A 667 30.130 -17.192 28.857 1.00 84.29 C ATOM 1302 CG GLU A 667 31.155 -16.062 28.684 1.00 81.47 C ATOM 1303 CD GLU A 667 30.916 -14.871 29.606 1.00 97.02 C ATOM 1304 OE1 GLU A 667 31.785 -13.972 29.630 1.00103.76 O ATOM 1305 OE2 GLU A 667 29.871 -14.824 30.300 1.00 96.54 O ATOM 1306 H GLU A 667 28.542 -19.221 28.785 1.00 0.00 H ATOM 1307 N GLU A 668 31.806 -19.713 27.757 1.00 89.11 N ATOM 1308 CA GLU A 668 33.103 -20.284 27.395 1.00 90.50 C ATOM 1309 C GLU A 668 33.080 -20.994 26.020 1.00 81.32 C ATOM 1310 O GLU A 668 34.071 -20.959 25.277 1.00 77.01 O ATOM 1311 CB GLU A 668 33.645 -21.153 28.546 1.00 95.33 C ATOM 1312 CG GLU A 668 34.649 -22.211 28.155 1.00100.32 C ATOM 1313 CD GLU A 668 33.969 -23.490 27.716 1.00113.78 C ATOM 1314 OE1 GLU A 668 32.894 -23.806 28.278 1.00118.39 O ATOM 1315 OE2 GLU A 668 34.495 -24.166 26.803 1.00117.00 O ATOM 1316 H GLU A 668 31.231 -20.172 28.492 1.00 0.00 H ATOM 1317 N GLN A 669 31.946 -21.604 25.670 1.00 80.45 N ATOM 1318 CA GLN A 669 31.733 -22.109 24.305 1.00 69.52 C ATOM 1319 C GLN A 669 31.678 -20.963 23.306 1.00 70.24 C ATOM 1320 O GLN A 669 32.174 -21.078 22.177 1.00 64.90 O ATOM 1321 CB GLN A 669 30.408 -22.858 24.185 1.00 63.22 C ATOM 1322 CG GLN A 669 30.263 -24.123 25.002 1.00 71.72 C ATOM 1323 CD GLN A 669 28.843 -24.661 24.930 1.00 83.53 C ATOM 1324 OE1 GLN A 669 27.948 -24.175 25.623 1.00 90.00 O ATOM 1325 NE2 GLN A 669 28.625 -25.652 24.066 1.00 89.11 N ATOM 1326 HE22 GLN A 669 29.411 -26.032 23.501 1.00 0.00 H ATOM 1327 HE21 GLN A 669 27.669 -26.046 23.957 1.00 0.00 H ATOM 1328 H GLN A 669 31.195 -21.725 26.379 1.00 0.00 H ATOM 1329 N ALA A 670 31.032 -19.868 23.705 1.00 67.34 N ATOM 1330 CA ALA A 670 30.942 -18.704 22.827 1.00 66.62 C ATOM 1331 C ALA A 670 32.341 -18.121 22.601 1.00 61.23 C ATOM 1332 O ALA A 670 32.656 -17.693 21.495 1.00 57.81 O ATOM 1333 CB ALA A 670 29.986 -17.658 23.397 1.00 60.74 C ATOM 1334 H ALA A 670 30.590 -19.842 24.646 1.00 0.00 H ATOM 1335 N ARG A 671 33.175 -18.120 23.647 1.00 67.70 N ATOM 1336 CA ARG A 671 34.578 -17.700 23.527 1.00 67.34 C ATOM 1337 C ARG A 671 35.340 -18.506 22.460 1.00 68.19 C ATOM 1338 O ARG A 671 36.092 -17.938 21.670 1.00 65.92 O ATOM 1339 CB ARG A 671 35.303 -17.789 24.882 1.00 63.32 C ATOM 1340 H ARG A 671 32.819 -18.426 24.575 1.00 0.00 H ATOM 1341 N LYS A 672 35.138 -19.825 22.451 1.00 62.16 N ATOM 1342 CA LYS A 672 35.769 -20.720 21.480 1.00 53.72 C ATOM 1343 C LYS A 672 35.227 -20.490 20.080 1.00 59.72 C ATOM 1344 O LYS A 672 35.979 -20.506 19.098 1.00 68.69 O ATOM 1345 CB LYS A 672 35.525 -22.178 21.872 1.00 56.87 C ATOM 1346 CG LYS A 672 36.080 -22.564 23.249 1.00 76.66 C ATOM 1347 CD LYS A 672 37.597 -22.449 23.307 1.00 77.02 C ATOM 1348 CE LYS A 672 38.125 -22.968 24.635 1.00 80.70 C ATOM 1349 NZ LYS A 672 37.486 -24.266 24.959 1.00 89.85 N ATOM 1350 HZ1 LYS A 672 36.456 -24.137 25.025 1.00 0.00 H ATOM 1351 HZ2 LYS A 672 37.703 -24.954 24.210 1.00 0.00 H ATOM 1352 HZ3 LYS A 672 37.852 -24.614 25.868 1.00 0.00 H ATOM 1353 H LYS A 672 34.504 -20.235 23.166 1.00 0.00 H ATOM 1354 N ALA A 673 33.913 -20.300 19.983 1.00 56.59 N ATOM 1355 CA ALA A 673 33.295 -19.962 18.700 1.00 50.48 C ATOM 1356 C ALA A 673 33.788 -18.597 18.196 1.00 45.57 C ATOM 1357 O ALA A 673 33.973 -18.387 16.989 1.00 43.04 O ATOM 1358 CB ALA A 673 31.759 -19.972 18.818 1.00 52.89 C ATOM 1359 H ALA A 673 33.317 -20.393 20.830 1.00 0.00 H ATOM 1360 N PHE A 674 33.973 -17.657 19.115 1.00 46.50 N ATOM 1361 CA PHE A 674 34.476 -16.342 18.738 1.00 51.37 C ATOM 1362 C PHE A 674 35.916 -16.393 18.217 1.00 45.13 C ATOM 1363 O PHE A 674 36.227 -15.753 17.207 1.00 47.84 O ATOM 1364 CB PHE A 674 34.377 -15.342 19.902 1.00 52.03 C ATOM 1365 CG PHE A 674 34.770 -13.949 19.509 1.00 50.72 C ATOM 1366 CD1 PHE A 674 33.966 -13.209 18.650 1.00 51.28 C ATOM 1367 CD2 PHE A 674 35.956 -13.393 19.956 1.00 67.28 C ATOM 1368 CE1 PHE A 674 34.331 -11.919 18.257 1.00 52.81 C ATOM 1369 CE2 PHE A 674 36.323 -12.105 19.575 1.00 69.51 C ATOM 1370 CZ PHE A 674 35.511 -11.369 18.723 1.00 62.57 C ATOM 1371 H PHE A 674 33.757 -17.861 20.112 1.00 0.00 H ATOM 1372 N ASP A 675 36.790 -17.126 18.913 1.00 47.58 N ATOM 1373 CA ASP A 675 38.170 -17.312 18.461 1.00 48.42 C ATOM 1374 C ASP A 675 38.260 -18.005 17.089 1.00 44.51 C ATOM 1375 O ASP A 675 39.045 -17.575 16.214 1.00 47.80 O ATOM 1376 CB ASP A 675 38.993 -18.058 19.513 1.00 56.49 C ATOM 1377 CG ASP A 675 39.226 -17.221 20.761 1.00 80.22 C ATOM 1378 OD1 ASP A 675 39.057 -15.978 20.653 1.00 82.54 O ATOM 1379 OD2 ASP A 675 39.580 -17.799 21.830 1.00 78.10 O ATOM 1380 H ASP A 675 36.482 -17.576 19.799 1.00 0.00 H ATOM 1381 N ARG A 676 37.475 -19.065 16.897 1.00 49.63 N ATOM 1382 CA ARG A 676 37.342 -19.699 15.575 1.00 43.80 C ATOM 1383 C ARG A 676 36.941 -18.721 14.464 1.00 47.51 C ATOM 1384 O ARG A 676 37.516 -18.740 13.364 1.00 38.81 O ATOM 1385 CB ARG A 676 36.302 -20.822 15.614 1.00 51.42 C ATOM 1386 CG ARG A 676 36.869 -22.209 15.860 1.00 66.89 C ATOM 1387 CD ARG A 676 35.831 -23.280 15.498 1.00 78.04 C ATOM 1388 NE ARG A 676 34.873 -23.521 16.582 1.00 91.75 N ATOM 1389 CZ ARG A 676 33.634 -23.027 16.630 1.00 92.09 C ATOM 1390 NH1 ARG A 676 33.176 -22.251 15.649 1.00 96.65 N ATOM 1391 NH2 ARG A 676 32.850 -23.311 17.666 1.00 78.38 N ATOM 1392 HE ARG A 676 35.182 -24.122 17.373 1.00 0.00 H ATOM 1393 HH12 ARG A 676 32.209 -21.871 15.695 1.00 0.00 H ATOM 1394 HH11 ARG A 676 33.785 -22.025 14.837 1.00 0.00 H ATOM 1395 HH22 ARG A 676 31.884 -22.928 17.707 1.00 0.00 H ATOM 1396 HH21 ARG A 676 33.203 -23.916 18.435 1.00 0.00 H ATOM 1397 H ARG A 676 36.943 -19.454 17.701 1.00 0.00 H ATOM 1398 N ALA A 677 35.933 -17.895 14.735 1.00 41.29 N ATOM 1399 CA ALA A 677 35.457 -16.925 13.741 1.00 41.74 C ATOM 1400 C ALA A 677 36.529 -15.869 13.436 1.00 39.88 C ATOM 1401 O ALA A 677 36.683 -15.442 12.290 1.00 39.30 O ATOM 1402 CB ALA A 677 34.167 -16.261 14.217 1.00 42.77 C ATOM 1403 H ALA A 677 35.474 -17.938 15.667 1.00 0.00 H ATOM 1404 N THR A 678 37.262 -15.447 14.463 1.00 39.58 N ATOM 1405 CA THR A 678 38.379 -14.530 14.271 1.00 46.65 C ATOM 1406 C THR A 678 39.454 -15.122 13.352 1.00 48.41 C ATOM 1407 O THR A 678 39.914 -14.471 12.398 1.00 48.23 O ATOM 1408 CB THR A 678 39.028 -14.198 15.613 1.00 47.66 C ATOM 1409 OG1 THR A 678 38.086 -13.481 16.422 1.00 53.50 O ATOM 1410 CG2 THR A 678 40.284 -13.354 15.405 1.00 48.49 C ATOM 1411 HG1 THR A 678 37.284 -14.042 16.568 1.00 0.00 H ATOM 1412 H THR A 678 37.034 -15.778 15.422 1.00 0.00 H ATOM 1413 N LYS A 679 39.867 -16.353 13.650 1.00 45.71 N ATOM 1414 CA LYS A 679 40.872 -17.035 12.836 1.00 45.99 C ATOM 1415 C LYS A 679 40.360 -17.288 11.422 1.00 48.66 C ATOM 1416 O LYS A 679 41.124 -17.203 10.458 1.00 46.35 O ATOM 1417 CB LYS A 679 41.290 -18.347 13.501 1.00 53.80 C ATOM 1418 CG LYS A 679 42.408 -19.097 12.783 1.00 62.24 C ATOM 1419 CD LYS A 679 43.117 -20.058 13.749 1.00 78.01 C ATOM 1420 CE LYS A 679 44.276 -20.801 13.071 1.00 82.70 C ATOM 1421 NZ LYS A 679 43.830 -21.788 12.055 1.00 79.07 N ATOM 1422 HZ1 LYS A 679 43.224 -22.501 12.509 1.00 0.00 H ATOM 1423 HZ2 LYS A 679 43.294 -21.299 11.310 1.00 0.00 H ATOM 1424 HZ3 LYS A 679 44.661 -22.253 11.637 1.00 0.00 H ATOM 1425 H LYS A 679 39.467 -16.838 14.478 1.00 0.00 H ATOM 1426 N LEU A 680 39.072 -17.586 11.287 1.00 43.72 N ATOM 1427 CA LEU A 680 38.506 -17.842 9.961 1.00 42.21 C ATOM 1428 C LEU A 680 38.558 -16.572 9.112 1.00 40.31 C ATOM 1429 O LEU A 680 38.936 -16.622 7.937 1.00 39.69 O ATOM 1430 CB LEU A 680 37.070 -18.368 10.067 1.00 40.37 C ATOM 1431 CG LEU A 680 36.496 -19.171 8.892 1.00 49.36 C ATOM 1432 CD1 LEU A 680 35.265 -19.977 9.336 1.00 46.32 C ATOM 1433 CD2 LEU A 680 36.142 -18.265 7.737 1.00 48.31 C ATOM 1434 H LEU A 680 38.462 -17.638 12.128 1.00 0.00 H ATOM 1435 N GLU A 681 38.182 -15.438 9.696 1.00 43.31 N ATOM 1436 CA GLU A 681 38.220 -14.170 8.974 1.00 48.60 C ATOM 1437 C GLU A 681 39.646 -13.796 8.581 1.00 50.54 C ATOM 1438 O GLU A 681 39.903 -13.403 7.441 1.00 46.64 O ATOM 1439 CB GLU A 681 37.590 -13.042 9.799 1.00 52.19 C ATOM 1440 CG GLU A 681 37.528 -11.702 9.066 1.00 56.38 C ATOM 1441 CD GLU A 681 36.873 -10.608 9.889 1.00 59.00 C ATOM 1442 OE1 GLU A 681 36.539 -9.548 9.316 1.00 59.40 O ATOM 1443 OE2 GLU A 681 36.697 -10.805 11.110 1.00 60.76 O ATOM 1444 H GLU A 681 37.856 -15.455 10.683 1.00 0.00 H ATOM 1445 N GLN A 682 40.578 -13.915 9.525 1.00 43.84 N ATOM 1446 CA GLN A 682 41.978 -13.561 9.262 1.00 50.03 C ATOM 1447 C GLN A 682 42.512 -14.346 8.061 1.00 50.90 C ATOM 1448 O GLN A 682 43.267 -13.820 7.248 1.00 54.00 O ATOM 1449 CB GLN A 682 42.859 -13.820 10.495 1.00 62.71 C ATOM 1450 CG GLN A 682 42.653 -12.836 11.664 1.00 82.16 C ATOM 1451 CD GLN A 682 43.440 -13.210 12.936 1.00 91.22 C ATOM 1452 OE1 GLN A 682 43.952 -14.330 13.068 1.00 91.22 O ATOM 1453 NE2 GLN A 682 43.529 -12.267 13.876 1.00 84.75 N ATOM 1454 HE22 GLN A 682 43.084 -11.339 13.725 1.00 0.00 H ATOM 1455 HE21 GLN A 682 44.043 -12.460 14.759 1.00 0.00 H ATOM 1456 H GLN A 682 40.309 -14.265 10.466 1.00 0.00 H ATOM 1457 N GLU A 683 42.145 -15.621 7.984 1.00 43.59 N ATOM 1458 CA GLU A 683 42.625 -16.507 6.928 1.00 55.81 C ATOM 1459 C GLU A 683 41.888 -16.449 5.570 1.00 45.00 C ATOM 1460 O GLU A 683 42.497 -16.544 4.513 1.00 51.26 O ATOM 1461 CB GLU A 683 42.631 -17.942 7.460 1.00 60.80 C ATOM 1462 CG GLU A 683 43.300 -18.958 6.538 1.00 71.97 C ATOM 1463 CD GLU A 683 43.533 -20.309 7.208 1.00 81.18 C ATOM 1464 OE1 GLU A 683 43.882 -21.269 6.476 1.00 80.15 O ATOM 1465 OE2 GLU A 683 43.368 -20.402 8.457 1.00 81.40 O ATOM 1466 H GLU A 683 41.494 -16.000 8.701 1.00 0.00 H ATOM 1467 N PHE A 684 40.570 -16.419 5.629 1.00 38.79 N ATOM 1468 CA PHE A 684 39.709 -16.522 4.451 1.00 40.98 C ATOM 1469 C PHE A 684 39.043 -15.267 3.864 1.00 44.40 C ATOM 1470 O PHE A 684 38.181 -15.387 2.983 1.00 37.45 O ATOM 1471 CB PHE A 684 38.745 -17.713 4.589 1.00 39.78 C ATOM 1472 CG PHE A 684 39.464 -19.038 4.712 1.00 42.99 C ATOM 1473 CD1 PHE A 684 39.728 -19.588 5.965 1.00 38.02 C ATOM 1474 CD2 PHE A 684 39.895 -19.722 3.572 1.00 40.82 C ATOM 1475 CE1 PHE A 684 40.409 -20.812 6.086 1.00 40.04 C ATOM 1476 CE2 PHE A 684 40.583 -20.942 3.677 1.00 43.76 C ATOM 1477 CZ PHE A 684 40.838 -21.487 4.934 1.00 46.29 C ATOM 1478 H PHE A 684 40.120 -16.317 6.561 1.00 0.00 H ATOM 1479 N THR A 685 39.350 -14.098 4.422 1.00 43.53 N ATOM 1480 CA THR A 685 38.685 -12.856 4.012 1.00 50.02 C ATOM 1481 C THR A 685 38.621 -12.676 2.488 1.00 49.80 C ATOM 1482 O THR A 685 37.557 -12.388 1.944 1.00 41.97 O ATOM 1483 CB THR A 685 39.342 -11.606 4.674 1.00 52.34 C ATOM 1484 OG1 THR A 685 38.834 -11.475 6.002 1.00 61.42 O ATOM 1485 CG2 THR A 685 38.996 -10.354 3.924 1.00 58.73 C ATOM 1486 HG1 THR A 685 39.056 -12.288 6.521 1.00 0.00 H ATOM 1487 H THR A 685 40.077 -14.064 5.165 1.00 0.00 H ATOM 1488 N GLU A 686 39.733 -12.892 1.797 1.00 44.27 N ATOM 1489 CA GLU A 686 39.719 -12.757 0.344 1.00 51.90 C ATOM 1490 C GLU A 686 38.718 -13.652 -0.395 1.00 50.30 C ATOM 1491 O GLU A 686 38.273 -13.304 -1.497 1.00 50.35 O ATOM 1492 CB GLU A 686 41.126 -12.930 -0.219 1.00 65.02 C ATOM 1493 CG GLU A 686 42.054 -11.803 0.195 1.00 83.41 C ATOM 1494 CD GLU A 686 43.426 -11.936 -0.424 1.00102.39 C ATOM 1495 OE1 GLU A 686 43.754 -13.047 -0.894 1.00107.50 O ATOM 1496 OE2 GLU A 686 44.173 -10.933 -0.448 1.00110.90 O ATOM 1497 H GLU A 686 40.611 -13.156 2.289 1.00 0.00 H ATOM 1498 N CYS A 687 38.331 -14.783 0.190 1.00 42.26 N ATOM 1499 CA CYS A 687 37.430 -15.665 -0.545 1.00 46.95 C ATOM 1500 C CYS A 687 35.961 -15.323 -0.330 1.00 42.63 C ATOM 1501 O CYS A 687 35.102 -15.841 -1.045 1.00 44.43 O ATOM 1502 CB CYS A 687 37.693 -17.145 -0.232 1.00 42.36 C ATOM 1503 SG CYS A 687 36.771 -17.793 1.173 1.00 32.94 S ATOM 1504 H CYS A 687 38.661 -15.031 1.144 1.00 0.00 H ATOM 1505 N PHE A 688 35.654 -14.435 0.621 1.00 39.59 N ATOM 1506 CA PHE A 688 34.223 -14.170 0.901 1.00 36.88 C ATOM 1507 C PHE A 688 33.508 -13.340 -0.180 1.00 38.30 C ATOM 1508 O PHE A 688 34.005 -12.286 -0.593 1.00 40.98 O ATOM 1509 CB PHE A 688 34.014 -13.443 2.243 1.00 43.85 C ATOM 1510 CG PHE A 688 34.585 -14.154 3.443 1.00 41.33 C ATOM 1511 CD1 PHE A 688 35.049 -13.410 4.531 1.00 43.24 C ATOM 1512 CD2 PHE A 688 34.658 -15.539 3.501 1.00 35.47 C ATOM 1513 CE1 PHE A 688 35.580 -14.038 5.654 1.00 42.88 C ATOM 1514 CE2 PHE A 688 35.191 -16.171 4.649 1.00 33.87 C ATOM 1515 CZ PHE A 688 35.646 -15.413 5.703 1.00 36.63 C ATOM 1516 H PHE A 688 36.401 -13.942 1.151 1.00 0.00 H ATOM 1517 N SER A 689 32.320 -13.784 -0.596 1.00 35.64 N ATOM 1518 CA SER A 689 31.456 -12.942 -1.463 1.00 37.58 C ATOM 1519 C SER A 689 30.896 -11.773 -0.626 1.00 38.85 C ATOM 1520 O SER A 689 30.819 -10.635 -1.100 1.00 35.62 O ATOM 1521 CB SER A 689 30.277 -13.761 -2.010 1.00 36.49 C ATOM 1522 OG SER A 689 30.723 -14.780 -2.903 1.00 36.78 O ATOM 1523 HG SER A 689 29.942 -15.289 -3.238 1.00 0.00 H ATOM 1524 H SER A 689 31.996 -14.730 -0.310 1.00 0.00 H ATOM 1525 N ALA A 690 30.505 -12.075 0.619 1.00 39.49 N ATOM 1526 CA ALA A 690 30.013 -11.056 1.535 1.00 45.28 C ATOM 1527 C ALA A 690 30.195 -11.487 2.993 1.00 42.72 C ATOM 1528 O ALA A 690 30.327 -12.685 3.304 1.00 38.37 O ATOM 1529 CB ALA A 690 28.527 -10.729 1.246 1.00 36.89 C ATOM 1530 H ALA A 690 30.554 -13.063 0.940 1.00 0.00 H ATOM 1531 N ILE A 691 30.206 -10.487 3.869 1.00 37.20 N ATOM 1532 CA ILE A 691 30.195 -10.700 5.319 1.00 41.72 C ATOM 1533 C ILE A 691 28.883 -10.109 5.856 1.00 40.49 C ATOM 1534 O ILE A 691 28.520 -8.974 5.496 1.00 42.30 O ATOM 1535 CB ILE A 691 31.395 -9.970 5.990 1.00 41.81 C ATOM 1536 CG1 ILE A 691 32.732 -10.607 5.564 1.00 38.11 C ATOM 1537 CG2 ILE A 691 31.268 -10.004 7.526 1.00 37.16 C ATOM 1538 CD1 ILE A 691 33.971 -9.936 6.180 1.00 37.26 C ATOM 1539 H ILE A 691 30.223 -9.511 3.510 1.00 0.00 H ATOM 1540 N VAL A 692 28.170 -10.867 6.695 1.00 44.15 N ATOM 1541 CA VAL A 692 26.929 -10.379 7.308 1.00 37.96 C ATOM 1542 C VAL A 692 27.056 -10.344 8.846 1.00 40.03 C ATOM 1543 O VAL A 692 27.746 -11.185 9.444 1.00 41.43 O ATOM 1544 CB VAL A 692 25.702 -11.238 6.887 1.00 45.23 C ATOM 1545 CG1 VAL A 692 25.505 -11.240 5.335 1.00 39.48 C ATOM 1546 CG2 VAL A 692 25.838 -12.655 7.394 1.00 46.89 C ATOM 1547 H VAL A 692 28.503 -11.826 6.919 1.00 0.00 H ATOM 1548 N GLU A 693 26.403 -9.369 9.475 1.00 42.56 N ATOM 1549 CA GLU A 693 26.391 -9.241 10.934 1.00 48.13 C ATOM 1550 C GLU A 693 24.962 -8.979 11.408 1.00 54.56 C ATOM 1551 O GLU A 693 24.135 -8.455 10.639 1.00 49.68 O ATOM 1552 CB GLU A 693 27.231 -8.038 11.373 1.00 46.80 C ATOM 1553 CG GLU A 693 28.718 -8.153 11.141 1.00 51.20 C ATOM 1554 CD GLU A 693 29.454 -6.920 11.634 1.00 59.28 C ATOM 1555 OE1 GLU A 693 28.787 -5.885 11.871 1.00 62.06 O ATOM 1556 OE2 GLU A 693 30.693 -6.983 11.802 1.00 66.09 O ATOM 1557 H GLU A 693 25.881 -8.671 8.908 1.00 0.00 H ATOM 1558 N GLY A 694 24.678 -9.281 12.678 1.00 48.65 N ATOM 1559 CA GLY A 694 23.394 -8.909 13.257 1.00 47.13 C ATOM 1560 C GLY A 694 23.311 -9.081 14.761 1.00 51.07 C ATOM 1561 O GLY A 694 24.187 -9.700 15.386 1.00 56.18 O ATOM 1562 H GLY A 694 25.379 -9.785 13.258 1.00 0.00 H ATOM 1563 N ASP A 695 22.259 -8.525 15.352 1.00 46.47 N ATOM 1564 CA ASP A 695 22.044 -8.637 16.792 1.00 55.84 C ATOM 1565 C ASP A 695 21.188 -9.844 17.193 1.00 53.23 C ATOM 1566 O ASP A 695 20.902 -10.046 18.374 1.00 59.95 O ATOM 1567 CB ASP A 695 21.412 -7.355 17.316 1.00 71.34 C ATOM 1568 CG ASP A 695 22.378 -6.197 17.297 1.00 93.46 C ATOM 1569 OD1 ASP A 695 23.552 -6.404 17.685 1.00 96.88 O ATOM 1570 OD2 ASP A 695 21.973 -5.090 16.880 1.00104.24 O ATOM 1571 H ASP A 695 21.573 -7.998 14.776 1.00 0.00 H ATOM 1572 N SER A 696 20.770 -10.630 16.202 1.00 55.48 N ATOM 1573 CA SER A 696 19.944 -11.806 16.439 1.00 56.41 C ATOM 1574 C SER A 696 20.109 -12.728 15.246 1.00 53.58 C ATOM 1575 O SER A 696 20.556 -12.288 14.183 1.00 50.87 O ATOM 1576 CB SER A 696 18.472 -11.417 16.609 1.00 57.09 C ATOM 1577 OG SER A 696 17.899 -11.063 15.356 1.00 56.27 O ATOM 1578 HG SER A 696 18.392 -10.294 14.974 1.00 0.00 H ATOM 1579 H SER A 696 21.043 -10.396 15.226 1.00 0.00 H ATOM 1580 N PHE A 697 19.765 -14.003 15.409 1.00 51.36 N ATOM 1581 CA PHE A 697 19.843 -14.909 14.278 1.00 44.66 C ATOM 1582 C PHE A 697 18.843 -14.501 13.210 1.00 41.47 C ATOM 1583 O PHE A 697 19.142 -14.554 12.029 1.00 42.07 O ATOM 1584 CB PHE A 697 19.581 -16.357 14.674 1.00 43.52 C ATOM 1585 CG PHE A 697 19.554 -17.282 13.487 1.00 46.27 C ATOM 1586 CD1 PHE A 697 20.733 -17.597 12.821 1.00 40.76 C ATOM 1587 CD2 PHE A 697 18.346 -17.796 13.008 1.00 47.67 C ATOM 1588 CE1 PHE A 697 20.722 -18.445 11.698 1.00 36.11 C ATOM 1589 CE2 PHE A 697 18.309 -18.642 11.899 1.00 41.64 C ATOM 1590 CZ PHE A 697 19.501 -18.968 11.241 1.00 41.97 C ATOM 1591 H PHE A 697 19.444 -14.346 16.337 1.00 0.00 H ATOM 1592 N GLU A 698 17.649 -14.096 13.630 1.00 46.95 N ATOM 1593 CA GLU A 698 16.615 -13.657 12.693 1.00 49.75 C ATOM 1594 C GLU A 698 17.111 -12.573 11.697 1.00 50.30 C ATOM 1595 O GLU A 698 16.800 -12.627 10.489 1.00 45.43 O ATOM 1596 CB GLU A 698 15.382 -13.172 13.472 1.00 51.45 C ATOM 1597 CG GLU A 698 14.649 -14.258 14.308 1.00 65.77 C ATOM 1598 CD GLU A 698 15.391 -14.711 15.589 1.00 72.50 C ATOM 1599 OE1 GLU A 698 16.367 -14.047 16.014 1.00 63.99 O ATOM 1600 OE2 GLU A 698 14.985 -15.747 16.178 1.00 75.94 O ATOM 1601 H GLU A 698 17.445 -14.091 14.650 1.00 0.00 H ATOM 1602 N GLU A 699 17.878 -11.601 12.205 1.00 47.13 N ATOM 1603 CA GLU A 699 18.412 -10.504 11.390 1.00 49.56 C ATOM 1604 C GLU A 699 19.480 -10.998 10.429 1.00 48.39 C ATOM 1605 O GLU A 699 19.479 -10.648 9.242 1.00 57.26 O ATOM 1606 CB GLU A 699 19.006 -9.397 12.274 1.00 52.65 C ATOM 1607 CG GLU A 699 19.735 -8.300 11.464 1.00 53.62 C ATOM 1608 CD GLU A 699 20.374 -7.221 12.338 1.00 61.63 C ATOM 1609 OE1 GLU A 699 20.371 -7.359 13.585 1.00 61.24 O ATOM 1610 OE2 GLU A 699 20.880 -6.226 11.769 1.00 62.46 O ATOM 1611 H GLU A 699 18.105 -11.624 13.220 1.00 0.00 H ATOM 1612 N ILE A 700 20.399 -11.802 10.956 1.00 41.52 N ATOM 1613 CA ILE A 700 21.399 -12.474 10.144 1.00 39.28 C ATOM 1614 C ILE A 700 20.752 -13.324 9.027 1.00 41.44 C ATOM 1615 O ILE A 700 21.147 -13.222 7.866 1.00 39.20 O ATOM 1616 CB ILE A 700 22.281 -13.372 11.044 1.00 43.11 C ATOM 1617 CG1 ILE A 700 23.307 -12.523 11.807 1.00 40.07 C ATOM 1618 CG2 ILE A 700 22.975 -14.494 10.238 1.00 39.76 C ATOM 1619 CD1 ILE A 700 23.942 -13.302 12.983 1.00 41.48 C ATOM 1620 H ILE A 700 20.402 -11.955 11.985 1.00 0.00 H ATOM 1621 N TYR A 701 19.768 -14.162 9.366 1.00 41.22 N ATOM 1622 CA TYR A 701 19.092 -14.982 8.354 1.00 43.25 C ATOM 1623 C TYR A 701 18.501 -14.098 7.262 1.00 38.65 C ATOM 1624 O TYR A 701 18.597 -14.424 6.075 1.00 41.86 O ATOM 1625 CB TYR A 701 17.957 -15.795 8.982 1.00 43.66 C ATOM 1626 CG TYR A 701 17.308 -16.793 8.037 1.00 45.05 C ATOM 1627 CD1 TYR A 701 18.047 -17.857 7.501 1.00 38.43 C ATOM 1628 CD2 TYR A 701 15.951 -16.692 7.701 1.00 43.50 C ATOM 1629 CE1 TYR A 701 17.455 -18.799 6.657 1.00 35.32 C ATOM 1630 CE2 TYR A 701 15.345 -17.632 6.850 1.00 42.92 C ATOM 1631 CZ TYR A 701 16.103 -18.680 6.337 1.00 38.84 C ATOM 1632 OH TYR A 701 15.520 -19.613 5.512 1.00 47.57 O ATOM 1633 HH TYR A 701 14.783 -20.065 5.995 1.00 0.00 H ATOM 1634 H TYR A 701 19.477 -14.234 10.362 1.00 0.00 H ATOM 1635 N HIS A 702 17.895 -12.983 7.665 1.00 42.50 N ATOM 1636 CA HIS A 702 17.311 -12.031 6.720 1.00 46.09 C ATOM 1637 C HIS A 702 18.381 -11.502 5.752 1.00 50.91 C ATOM 1638 O HIS A 702 18.159 -11.442 4.527 1.00 48.56 O ATOM 1639 CB HIS A 702 16.640 -10.880 7.483 1.00 51.75 C ATOM 1640 CG HIS A 702 16.171 -9.756 6.611 1.00 74.89 C ATOM 1641 ND1 HIS A 702 14.954 -9.773 5.959 1.00 84.94 N ATOM 1642 CD2 HIS A 702 16.749 -8.572 6.297 1.00 82.39 C ATOM 1643 CE1 HIS A 702 14.806 -8.649 5.278 1.00 83.57 C ATOM 1644 NE2 HIS A 702 15.881 -7.904 5.464 1.00 85.13 N ATOM 1645 H HIS A 702 17.835 -12.783 8.684 1.00 0.00 H ATOM 1646 N LYS A 703 19.544 -11.137 6.300 1.00 49.73 N ATOM 1647 CA LYS A 703 20.645 -10.591 5.500 1.00 46.02 C ATOM 1648 C LYS A 703 21.235 -11.661 4.576 1.00 43.21 C ATOM 1649 O LYS A 703 21.592 -11.378 3.427 1.00 47.15 O ATOM 1650 CB LYS A 703 21.737 -10.017 6.416 1.00 45.84 C ATOM 1651 CG LYS A 703 21.320 -8.704 7.113 1.00 48.26 C ATOM 1652 CD LYS A 703 22.450 -8.129 7.987 1.00 46.19 C ATOM 1653 CE LYS A 703 22.119 -6.711 8.473 1.00 43.12 C ATOM 1654 NZ LYS A 703 23.124 -6.225 9.471 1.00 56.34 N ATOM 1655 HZ1 LYS A 703 23.131 -6.862 10.293 1.00 0.00 H ATOM 1656 HZ2 LYS A 703 24.067 -6.212 9.033 1.00 0.00 H ATOM 1657 HZ3 LYS A 703 22.870 -5.264 9.778 1.00 0.00 H ATOM 1658 H LYS A 703 19.672 -11.244 7.327 1.00 0.00 H ATOM 1659 N VAL A 704 21.338 -12.887 5.081 1.00 37.08 N ATOM 1660 CA VAL A 704 21.832 -14.004 4.283 1.00 40.19 C ATOM 1661 C VAL A 704 20.948 -14.205 3.052 1.00 45.99 C ATOM 1662 O VAL A 704 21.468 -14.340 1.919 1.00 38.82 O ATOM 1663 CB VAL A 704 21.900 -15.299 5.113 1.00 38.06 C ATOM 1664 CG1 VAL A 704 21.989 -16.541 4.196 1.00 35.17 C ATOM 1665 CG2 VAL A 704 23.090 -15.238 6.093 1.00 37.25 C ATOM 1666 H VAL A 704 21.060 -13.054 6.069 1.00 0.00 H ATOM 1667 N LYS A 705 19.623 -14.199 3.253 1.00 36.78 N ATOM 1668 CA LYS A 705 18.703 -14.406 2.128 1.00 44.92 C ATOM 1669 C LYS A 705 18.855 -13.290 1.096 1.00 41.02 C ATOM 1670 O LYS A 705 18.765 -13.527 -0.116 1.00 40.41 O ATOM 1671 CB LYS A 705 17.248 -14.498 2.602 1.00 40.29 C ATOM 1672 CG LYS A 705 16.938 -15.781 3.385 1.00 37.92 C ATOM 1673 CD LYS A 705 15.434 -16.046 3.463 1.00 56.18 C ATOM 1674 CE LYS A 705 14.652 -14.823 3.901 1.00 64.16 C ATOM 1675 NZ LYS A 705 14.959 -14.462 5.301 1.00 70.70 N ATOM 1676 HZ1 LYS A 705 14.710 -15.256 5.925 1.00 0.00 H ATOM 1677 HZ2 LYS A 705 15.974 -14.255 5.390 1.00 0.00 H ATOM 1678 HZ3 LYS A 705 14.408 -13.622 5.570 1.00 0.00 H ATOM 1679 H LYS A 705 19.245 -14.047 4.210 1.00 0.00 H ATOM 1680 N ARG A 706 19.075 -12.073 1.589 1.00 41.25 N ATOM 1681 CA ARG A 706 19.200 -10.891 0.738 1.00 44.05 C ATOM 1682 C ARG A 706 20.485 -10.946 -0.105 1.00 46.44 C ATOM 1683 O ARG A 706 20.484 -10.619 -1.310 1.00 46.51 O ATOM 1684 CB ARG A 706 19.152 -9.627 1.600 1.00 45.84 C ATOM 1685 CG ARG A 706 19.307 -8.323 0.832 1.00 63.36 C ATOM 1686 CD ARG A 706 18.339 -8.222 -0.346 1.00 77.89 C ATOM 1687 NE ARG A 706 18.290 -6.866 -0.884 1.00 90.36 N ATOM 1688 CZ ARG A 706 17.718 -6.540 -2.041 1.00103.28 C ATOM 1689 NH1 ARG A 706 17.152 -7.486 -2.786 1.00105.00 N ATOM 1690 NH2 ARG A 706 17.717 -5.274 -2.456 1.00101.15 N ATOM 1691 HE ARG A 706 18.730 -6.106 -0.328 1.00 0.00 H ATOM 1692 HH12 ARG A 706 16.704 -7.237 -3.691 1.00 0.00 H ATOM 1693 HH11 ARG A 706 17.158 -8.475 -2.464 1.00 0.00 H ATOM 1694 HH22 ARG A 706 17.269 -5.024 -3.361 1.00 0.00 H ATOM 1695 HH21 ARG A 706 18.164 -4.536 -1.875 1.00 0.00 H ATOM 1696 H ARG A 706 19.161 -11.959 2.619 1.00 0.00 H ATOM 1697 N VAL A 707 21.578 -11.370 0.520 1.00 44.18 N ATOM 1698 CA VAL A 707 22.836 -11.559 -0.207 1.00 41.33 C ATOM 1699 C VAL A 707 22.668 -12.570 -1.358 1.00 38.79 C ATOM 1700 O VAL A 707 23.080 -12.324 -2.490 1.00 38.77 O ATOM 1701 CB VAL A 707 23.974 -11.987 0.759 1.00 45.78 C ATOM 1702 CG1 VAL A 707 25.185 -12.483 -0.021 1.00 36.79 C ATOM 1703 CG2 VAL A 707 24.349 -10.808 1.687 1.00 44.70 C ATOM 1704 H VAL A 707 21.540 -11.571 1.540 1.00 0.00 H ATOM 1705 N ILE A 708 22.032 -13.701 -1.086 1.00 32.94 N ATOM 1706 CA ILE A 708 21.848 -14.714 -2.126 1.00 34.17 C ATOM 1707 C ILE A 708 20.981 -14.191 -3.259 1.00 36.20 C ATOM 1708 O ILE A 708 21.266 -14.442 -4.446 1.00 40.95 O ATOM 1709 CB ILE A 708 21.239 -15.995 -1.532 1.00 35.21 C ATOM 1710 CG1 ILE A 708 22.244 -16.608 -0.541 1.00 39.46 C ATOM 1711 CG2 ILE A 708 20.850 -16.985 -2.642 1.00 34.27 C ATOM 1712 CD1 ILE A 708 21.638 -17.675 0.341 1.00 38.95 C ATOM 1713 H ILE A 708 21.662 -13.869 -0.129 1.00 0.00 H ATOM 1714 N GLU A 709 19.933 -13.438 -2.928 1.00 37.74 N ATOM 1715 CA GLU A 709 19.116 -12.874 -4.001 1.00 50.65 C ATOM 1716 C GLU A 709 19.932 -11.913 -4.867 1.00 46.29 C ATOM 1717 O GLU A 709 19.786 -11.901 -6.085 1.00 42.40 O ATOM 1718 CB GLU A 709 17.894 -12.152 -3.445 1.00 57.55 C ATOM 1719 CG GLU A 709 16.933 -13.039 -2.690 1.00 79.95 C ATOM 1720 CD GLU A 709 15.744 -12.251 -2.176 1.00101.33 C ATOM 1721 OE1 GLU A 709 15.290 -12.528 -1.038 1.00 99.41 O ATOM 1722 OE2 GLU A 709 15.274 -11.348 -2.917 1.00108.18 O ATOM 1723 H GLU A 709 19.702 -13.256 -1.931 1.00 0.00 H ATOM 1724 N ASP A 710 20.788 -11.109 -4.234 1.00 44.24 N ATOM 1725 CA ASP A 710 21.526 -10.066 -4.953 1.00 49.22 C ATOM 1726 C ASP A 710 22.572 -10.680 -5.861 1.00 44.51 C ATOM 1727 O ASP A 710 22.847 -10.152 -6.926 1.00 52.81 O ATOM 1728 CB ASP A 710 22.242 -9.138 -3.966 1.00 55.00 C ATOM 1729 CG ASP A 710 21.309 -8.128 -3.320 1.00 58.05 C ATOM 1730 OD1 ASP A 710 20.194 -7.900 -3.841 1.00 59.49 O ATOM 1731 OD2 ASP A 710 21.706 -7.542 -2.295 1.00 59.14 O ATOM 1732 H ASP A 710 20.935 -11.224 -3.211 1.00 0.00 H ATOM 1733 N LEU A 711 23.171 -11.784 -5.409 1.00 41.69 N ATOM 1734 CA LEU A 711 24.305 -12.399 -6.109 1.00 45.43 C ATOM 1735 C LEU A 711 23.851 -13.474 -7.113 1.00 51.43 C ATOM 1736 O LEU A 711 24.675 -14.140 -7.752 1.00 58.27 O ATOM 1737 CB LEU A 711 25.336 -12.956 -5.109 1.00 39.69 C ATOM 1738 CG LEU A 711 26.018 -11.919 -4.203 1.00 46.19 C ATOM 1739 CD1 LEU A 711 27.257 -12.484 -3.532 1.00 45.46 C ATOM 1740 CD2 LEU A 711 26.373 -10.668 -4.989 1.00 51.60 C ATOM 1741 H LEU A 711 22.823 -12.222 -4.533 1.00 0.00 H ATOM 1742 N SER A 712 22.534 -13.624 -7.239 1.00 49.69 N ATOM 1743 CA SER A 712 21.930 -14.576 -8.160 1.00 58.02 C ATOM 1744 C SER A 712 21.661 -13.980 -9.535 1.00 69.06 C ATOM 1745 O SER A 712 21.059 -14.634 -10.386 1.00 72.75 O ATOM 1746 CB SER A 712 20.628 -15.125 -7.585 1.00 52.94 C ATOM 1747 OG SER A 712 20.912 -16.066 -6.582 1.00 56.61 O ATOM 1748 HG SER A 712 21.432 -15.631 -5.861 1.00 0.00 H ATOM 1749 H SER A 712 21.909 -13.035 -6.653 1.00 0.00 H ATOM 1750 N GLY A 713 22.075 -12.734 -9.742 1.00 69.12 N ATOM 1751 CA GLY A 713 21.998 -12.138 -11.059 1.00 73.72 C ATOM 1752 C GLY A 713 23.005 -12.761 -12.014 1.00 78.78 C ATOM 1753 O GLY A 713 23.357 -12.173 -13.043 1.00 82.72 O ATOM 1754 H GLY A 713 22.459 -12.181 -8.949 1.00 0.00 H TER 1755 GLY A 713 HETATM 1756 O HOH 1 29.819 -36.204 -4.024 1.00 28.96 O HETATM 1757 O HOH 2 24.143 -24.774 -6.829 1.00 29.47 O HETATM 1758 O HOH 3 28.542 -24.251 5.388 1.00 30.03 O HETATM 1759 O HOH 4 26.245 -23.139 3.107 1.00 30.92 O HETATM 1760 O HOH 5 33.947 -34.608 -9.050 1.00 31.82 O HETATM 1761 O HOH 6 30.602 -48.309 -0.647 1.00 42.44 O HETATM 1762 O HOH 7 24.961 -36.453 -7.808 1.00 36.48 O HETATM 1763 O HOH 8 31.887 -44.809 8.472 1.00 34.40 O HETATM 1764 O HOH 9 39.898 -33.801 -4.255 1.00 34.74 O HETATM 1765 O HOH 10 22.855 -18.149 -9.167 1.00 42.07 O HETATM 1766 O HOH 11 21.862 -42.705 4.597 1.00 38.35 O HETATM 1767 O HOH 12 35.831 -37.948 11.801 1.00 40.40 O HETATM 1768 O HOH 13 33.201 -16.814 -5.593 1.00 37.33 O HETATM 1769 O HOH 14 29.410 -32.012 4.156 1.00 33.55 O HETATM 1770 O HOH 15 34.250 -19.768 -10.062 1.00 41.73 O HETATM 1771 O HOH 16 24.355 -34.162 -6.436 1.00 31.33 O HETATM 1772 O HOH 17 26.553 -30.258 2.297 1.00 34.43 O HETATM 1773 O HOH 18 25.040 -30.338 -0.145 1.00 35.71 O HETATM 1774 O HOH 19 27.466 -32.211 6.275 1.00 32.31 O HETATM 1775 O HOH 20 26.787 -23.490 13.085 1.00 36.88 O HETATM 1776 O HOH 21 31.788 -33.278 2.906 1.00 30.17 O HETATM 1777 O HOH 22 28.165 -32.118 1.546 1.00 37.76 O HETATM 1778 O HOH 23 18.725 -53.338 8.404 1.00 40.78 O HETATM 1779 O HOH 24 25.639 -34.099 7.056 1.00 33.30 O HETATM 1780 O HOH 25 10.939 -22.838 -2.690 1.00 51.99 O HETATM 1781 O HOH 26 26.754 -7.977 3.342 1.00 44.41 O HETATM 1782 O HOH 27 24.214 -32.582 8.853 1.00 39.87 O HETATM 1783 O HOH 28 24.071 -23.294 14.146 1.00 36.05 O HETATM 1784 O HOH 29 29.884 -8.037 -0.357 1.00 40.84 O HETATM 1785 O HOH 30 18.421 -42.278 4.238 1.00 40.92 O HETATM 1786 O HOH 31 33.836 -19.973 12.450 1.00 35.39 O HETATM 1787 O HOH 32 32.609 -19.634 14.878 1.00 44.79 O HETATM 1788 O HOH 33 26.570 -43.686 -7.784 1.00 44.86 O HETATM 1789 O HOH 34 35.795 -12.769 12.708 1.00 50.11 O HETATM 1790 O HOH 35 19.314 -14.962 18.119 1.00 40.15 O HETATM 1791 O HOH 36 40.662 -20.624 9.760 1.00 49.46 O HETATM 1792 O HOH 37 29.292 -22.374 13.058 1.00 44.88 O HETATM 1793 O HOH 38 41.367 -16.669 1.035 1.00 47.57 O HETATM 1794 O HOH 39 36.423 -23.369 7.502 1.00 46.59 O HETATM 1795 O HOH 40 26.718 -10.432 13.975 1.00 46.02 O HETATM 1796 O HOH 41 21.741 -34.206 -7.040 1.00 47.15 O HETATM 1797 O HOH 42 37.947 -9.000 7.029 1.00 50.07 O HETATM 1798 O HOH 43 24.068 -10.592 -9.370 1.00 49.90 O HETATM 1799 O HOH 44 36.239 -10.658 -0.012 1.00 45.87 O HETATM 1800 O HOH 45 15.375 -28.190 0.168 1.00 51.17 O HETATM 1801 O HOH 46 25.620 -32.819 0.914 1.00 44.36 O HETATM 1802 O HOH 47 25.663 -6.791 7.725 1.00 50.72 O HETATM 1803 O HOH 48 38.913 -31.476 2.543 1.00 50.58 O HETATM 1804 O HOH 49 17.798 -31.371 -1.330 1.00 53.82 O HETATM 1805 O HOH 50 16.554 -28.471 6.708 1.00 48.19 O HETATM 1806 O HOH 51 35.509 -16.738 -3.655 1.00 55.80 O HETATM 1807 O HOH 52 21.272 -19.698 16.339 1.00 43.08 O HETATM 1808 O HOH 53 33.465 -37.241 -9.039 1.00 56.02 O HETATM 1809 O HOH 54 24.119 -31.524 -14.869 1.00 54.83 O HETATM 1810 O HOH 55 23.586 -18.727 24.573 1.00 60.33 O HETATM 1811 O HOH 56 29.695 -26.617 12.443 1.00 46.64 O HETATM 1812 O HOH 57 38.529 -21.156 12.182 1.00 48.07 O HETATM 1813 O HOH 58 17.549 -16.039 -1.112 1.00 48.13 O HETATM 1814 O HOH 59 35.430 -41.511 -6.015 1.00 50.63 O HETATM 1815 O HOH 60 24.678 -7.356 4.792 1.00 54.55 O HETATM 1816 O HOH 61 18.372 -8.129 15.582 1.00 54.48 O HETATM 1817 O HOH 62 33.369 -5.601 7.253 1.00 55.95 O HETATM 1818 O HOH 63 30.367 -46.230 10.113 1.00 44.38 O HETATM 1819 O HOH 64 38.356 -18.275 -3.762 1.00 57.20 O HETATM 1820 O HOH 65 23.062 -21.784 16.022 1.00 52.41 O HETATM 1821 O HOH 66 15.245 -25.887 9.721 1.00 48.50 O HETATM 1822 O HOH 67 26.352 -11.243 -9.479 1.00 51.98 O HETATM 1823 O HOH 68 45.410 -39.296 -8.758 1.00 56.89 O HETATM 1824 O HOH 69 32.188 -22.229 9.669 1.00 40.54 O HETATM 1825 O HOH 70 28.678 -36.984 -8.812 1.00 39.75 O HETATM 1826 O HOH 71 39.293 -21.451 -0.188 1.00 44.60 O HETATM 1827 O HOH 72 34.092 -23.516 8.900 1.00 47.04 O HETATM 1828 O HOH 73 34.847 -33.572 -11.425 1.00 44.80 O HETATM 1829 O HOH 74 41.696 -29.912 -4.564 1.00 60.14 O HETATM 1830 O HOH 75 39.270 -29.689 -5.456 1.00 51.83 O HETATM 1831 O HOH 76 38.919 -27.881 -7.507 1.00 59.47 O HETATM 1832 O HOH 77 30.453 -23.546 19.947 1.00 63.92 O HETATM 1833 O HOH 78 32.878 -32.200 -12.750 1.00 59.83 O HETATM 1834 O HOH 79 41.686 -28.803 3.535 1.00 59.48 O HETATM 1835 O HOH 80 34.371 -18.052 -7.834 1.00 40.86 O HETATM 1836 O HOH 81 19.812 -50.161 -2.720 1.00 43.46 O HETATM 1837 O HOH 82 15.363 -19.039 9.987 1.00 51.64 O HETATM 1838 O HOH 83 40.617 -9.202 8.035 1.00 66.49 O HETATM 1839 O HOH 84 25.381 -38.357 6.603 1.00 30.19 O HETATM 1840 O HOH 85 34.964 -45.018 15.146 1.00 35.47 O HETATM 1841 O HOH 86 22.966 -25.842 14.577 1.00 55.85 O HETATM 1842 O HOH 87 25.222 -31.555 4.713 1.00 39.60 O HETATM 1843 O HOH 88 22.995 -29.284 2.455 1.00 39.25 O HETATM 1844 O HOH 89 18.920 -26.019 12.742 1.00 52.19 O HETATM 1845 O HOH 90 35.507 -48.830 12.748 1.00 57.04 O HETATM 1846 O HOH 91 26.858 -38.471 -10.958 1.00 61.75 O HETATM 1847 O HOH 92 22.821 -38.807 -8.318 1.00 51.63 O HETATM 1848 O HOH 93 37.375 -32.149 -11.223 1.00 69.58 O HETATM 1849 O HOH 94 38.364 -29.824 -10.216 1.00 70.96 O HETATM 1850 O HOH 95 16.890 -24.702 12.391 1.00 49.71 O HETATM 1851 O HOH 96 19.043 -38.081 -6.320 1.00 62.01 O HETATM 1852 O HOH 97 42.055 -14.233 2.533 1.00 47.19 O HETATM 1853 O HOH 98 39.729 -44.066 7.473 1.00 62.79 O HETATM 1854 O HOH 99 28.086 -50.955 -0.817 1.00 48.63 O HETATM 1855 O HOH 100 11.721 -29.680 6.348 1.00 65.45 O HETATM 1856 O HOH 101 10.173 -28.520 3.230 1.00 64.77 O HETATM 1857 O HOH 102 12.757 -29.802 2.068 1.00 69.10 O HETATM 1858 O HOH 103 28.024 -26.244 -15.300 1.00 69.75 O HETATM 1859 O HOH 104 22.386 -4.655 13.768 1.00 64.89 O HETATM 1860 O HOH 105 28.507 -5.987 7.172 1.00 72.68 O HETATM 1861 O HOH 106 44.658 -40.730 9.371 1.00 52.58 O HETATM 1862 O HOH 107 45.511 -40.252 6.757 1.00 64.04 O HETATM 1863 O HOH 108 44.198 -42.911 10.430 1.00 59.23 O HETATM 1864 O HOH 109 43.340 -27.771 -2.730 1.00 63.36 O HETATM 1865 O HOH 110 41.856 -20.331 0.219 1.00 62.09 O HETATM 1866 O HOH 111 15.068 -16.652 -0.430 1.00 64.60 O HETATM 1867 O HOH 112 13.726 -12.464 7.300 1.00 58.70 O HETATM 1868 O HOH 113 34.442 -27.557 8.664 1.00 59.54 O HETATM 1869 O HOH 114 20.929 -48.622 -4.899 1.00 33.22 O HETATM 1870 O HOH 115 22.470 -16.510 25.512 1.00 72.77 O HETATM 1871 O HOH 116 26.169 -4.108 11.309 1.00 76.59 O HETATM 1872 O HOH 117 22.179 -8.381 3.220 1.00 54.17 O HETATM 1873 O HOH 118 19.554 -22.490 -13.946 1.00 74.07 O HETATM 1874 O HOH 119 38.616 -47.193 4.234 1.00 62.14 O HETATM 1875 O HOH 120 24.377 -43.197 -9.877 1.00 64.27 O HETATM 1876 O HOH 121 21.351 -37.102 -8.133 1.00 61.40 O HETATM 1877 O HOH 122 31.490 -27.242 8.926 1.00 67.94 O HETATM 1878 O HOH 123 36.681 -47.809 3.176 1.00 67.34 O HETATM 1879 O HOH 124 28.245 -20.501 17.387 1.00 43.87 O HETATM 1880 O HOH 125 24.046 -33.576 11.772 1.00 28.63 O HETATM 1881 O HOH 126 23.388 -41.793 6.729 1.00 32.27 O HETATM 1882 O HOH 127 18.977 -39.081 16.428 1.00 31.95 O HETATM 1883 O HOH 128 28.183 -44.759 10.106 1.00 42.87 O HETATM 1884 O HOH 129 24.477 -40.382 9.983 1.00 34.01 O HETATM 1885 O HOH 130 33.740 -34.784 4.067 1.00 34.08 O HETATM 1886 O HOH 131 22.675 -39.873 14.112 1.00 36.99 O HETATM 1887 O HOH 132 31.940 -31.593 11.980 1.00 41.08 O HETATM 1888 O HOH 133 40.482 -31.944 9.825 1.00 45.77 O HETATM 1889 O HOH 134 30.852 -34.041 15.942 1.00 42.48 O HETATM 1890 O HOH 135 35.925 -33.421 5.194 1.00 44.50 O HETATM 1891 O HOH 136 26.449 -40.702 13.053 1.00 44.26 O HETATM 1892 O HOH 137 30.334 -31.719 14.312 1.00 48.21 O HETATM 1893 O HOH 138 38.564 -30.364 10.345 1.00 53.71 O HETATM 1894 O HOH 139 31.735 -34.762 19.886 1.00 45.46 O HETATM 1895 O HOH 140 36.110 -29.781 7.236 1.00 50.79 O HETATM 1896 O HOH 141 24.679 -31.409 13.772 1.00 49.40 O HETATM 1897 O HOH 142 23.979 -33.412 3.378 1.00 48.49 O HETATM 1898 O HOH 143 29.603 -34.559 18.361 1.00 53.49 O HETATM 1899 O HOH 144 26.497 -43.054 11.773 1.00 50.49 O HETATM 1900 O HOH 145 26.859 -30.323 14.860 1.00 47.36 O HETATM 1901 O HOH 146 30.933 -29.103 11.210 1.00 49.85 O HETATM 1902 O HOH 147 19.946 -35.827 22.682 1.00 64.00 O HETATM 1903 O HOH 148 22.460 -32.931 15.509 1.00 62.43 O HETATM 1904 O HOH 149 34.288 -29.639 11.870 1.00 59.50 O HETATM 1905 N LEU A 150 24.302 -30.424 19.465 1.00 0.24 N HETATM 1906 CA LEU A 150 25.094 -31.325 18.632 1.00 0.06 C HETATM 1907 C LEU A 150 25.295 -32.691 19.295 1.00 0.23 C HETATM 1908 O LEU A 150 26.404 -33.034 19.741 1.00 -0.39 O HETATM 1909 N LEU A 150 24.211 -33.461 19.364 1.00 -0.26 N HETATM 1910 CA LEU A 150 24.306 -34.881 19.666 1.00 0.15 C HETATM 1911 C LEU A 150 23.810 -35.671 18.460 1.00 0.21 C HETATM 1912 O LEU A 150 22.942 -35.194 17.722 1.00 -0.39 O HETATM 1913 N LEU A 150 24.353 -36.869 18.266 1.00 -0.26 N HETATM 1914 CA LEU A 150 23.930 -37.732 17.167 1.00 0.13 C HETATM 1915 C LEU A 150 24.068 -37.016 15.831 1.00 0.20 C HETATM 1916 O LEU A 150 23.162 -37.035 14.984 1.00 -0.39 O HETATM 1917 N LEU A 150 25.233 -36.386 15.659 1.00 -0.26 N HETATM 1918 CA LEU A 150 25.604 -35.674 14.447 1.00 0.13 C HETATM 1919 C LEU A 150 25.720 -36.674 13.281 1.00 0.20 C HETATM 1920 O LEU A 150 26.243 -37.792 13.449 1.00 -0.39 O HETATM 1921 N LEU A 150 25.201 -36.306 12.113 1.00 -0.26 N HETATM 1922 CA LEU A 150 25.316 -37.176 10.940 1.00 0.13 C HETATM 1923 C LEU A 150 26.775 -37.509 10.638 1.00 0.20 C HETATM 1924 O LEU A 150 27.681 -36.697 10.878 1.00 -0.39 O HETATM 1925 N LEU A 150 26.996 -38.715 10.127 1.00 -0.26 N HETATM 1926 CA LEU A 150 28.337 -39.214 9.866 1.00 0.16 C HETATM 1927 CB LEU A 150 28.235 -40.673 9.393 1.00 0.12 C HETATM 1928 OG LEU A 150 27.477 -40.719 8.196 1.00 -0.27 O HETATM 1929 P LEU A 150 26.836 -42.202 7.993 1.00 0.20 P HETATM 1930 O1P LEU A 150 25.982 -42.151 6.643 1.00 -0.55 O HETATM 1931 O2P LEU A 150 27.981 -43.336 7.925 1.00 -0.55 O HETATM 1932 O3P LEU A 150 25.953 -42.610 9.283 1.00 -0.55 O HETATM 1933 H LEU A 150 27.739 -41.278 10.167 1.00 0.07 H HETATM 1934 H LEU A 150 29.243 -41.071 9.206 1.00 0.07 H HETATM 1935 C LEU A 150 29.089 -38.348 8.815 1.00 0.21 C HETATM 1936 O LEU A 150 30.302 -38.124 8.935 1.00 -0.39 O HETATM 1937 N LEU A 150 28.383 -37.861 7.800 1.00 -0.26 N HETATM 1938 CA LEU A 150 29.039 -37.005 6.815 1.00 0.13 C HETATM 1939 C LEU A 150 29.576 -35.754 7.497 1.00 0.20 C HETATM 1940 O LEU A 150 30.724 -35.314 7.232 1.00 -0.39 O HETATM 1941 N LEU A 150 28.753 -35.165 8.354 1.00 -0.26 N HETATM 1942 CA LEU A 150 29.184 -33.970 9.093 1.00 0.13 C HETATM 1943 C LEU A 150 30.339 -34.302 10.059 1.00 0.20 C HETATM 1944 O LEU A 150 31.293 -33.514 10.186 1.00 -0.39 O HETATM 1945 N LEU A 150 30.286 -35.470 10.706 1.00 -0.26 N HETATM 1946 CA LEU A 150 31.438 -35.906 11.531 1.00 0.13 C HETATM 1947 C LEU A 150 32.731 -36.038 10.712 1.00 0.20 C HETATM 1948 O LEU A 150 33.806 -35.751 11.240 1.00 -0.39 O HETATM 1949 N LEU A 150 32.633 -36.484 9.448 1.00 -0.26 N HETATM 1950 CA LEU A 150 33.816 -36.662 8.597 1.00 0.15 C HETATM 1951 C LEU A 150 34.577 -35.339 8.330 1.00 0.21 C HETATM 1952 O LEU A 150 35.771 -35.344 7.975 1.00 -0.39 O HETATM 1953 N LEU A 150 33.889 -34.215 8.536 1.00 -0.26 N HETATM 1954 CA LEU A 150 34.490 -32.888 8.381 1.00 0.13 C HETATM 1955 C LEU A 150 35.545 -32.679 9.466 1.00 0.20 C HETATM 1956 O LEU A 150 36.464 -31.869 9.293 1.00 -0.39 O HETATM 1957 N LEU A 150 35.441 -33.416 10.574 1.00 -0.26 N HETATM 1958 CA LEU A 150 36.422 -33.281 11.666 1.00 0.13 C HETATM 1959 C LEU A 150 37.792 -33.913 11.370 1.00 0.20 C HETATM 1960 O LEU A 150 38.787 -33.560 12.034 1.00 -0.39 O HETATM 1961 N LEU A 150 37.836 -34.907 10.469 1.00 -0.26 N HETATM 1962 CA LEU A 150 39.122 -35.341 9.931 1.00 0.13 C HETATM 1963 C LEU A 150 39.188 -35.165 8.416 1.00 0.20 C HETATM 1964 O LEU A 150 39.037 -36.131 7.673 1.00 -0.39 O HETATM 1965 N LEU A 150 39.667 -33.998 8.001 1.00 -0.26 N HETATM 1966 CA LEU A 150 39.644 -33.572 6.608 1.00 0.15 C HETATM 1967 C LEU A 150 41.033 -33.701 6.072 1.00 0.21 C HETATM 1968 O LEU A 150 42.001 -33.599 6.839 1.00 -0.39 O HETATM 1969 N LEU A 150 41.109 -33.944 4.766 1.00 -0.27 N HETATM 1970 CA LEU A 150 42.355 -34.004 4.017 1.00 0.13 C HETATM 1971 C LEU A 150 42.734 -32.636 3.452 1.00 0.22 C HETATM 1972 O LEU A 150 41.915 -31.710 3.454 1.00 -0.41 O HETATM 1973 O1 LEU A 150 43.888 -32.451 2.981 1.00 -0.41 O HETATM 1974 CB LEU A 150 42.208 -35.018 2.887 1.00 0.02 C HETATM 1975 CG LEU A 150 41.818 -36.372 3.365 1.00 -0.04 C HETATM 1976 CD1 LEU A 150 42.640 -37.068 4.248 1.00 -0.06 C HETATM 1977 CE1 LEU A 150 42.279 -38.328 4.720 1.00 -0.07 C HETATM 1978 CZ LEU A 150 41.076 -38.903 4.310 1.00 -0.07 C HETATM 1979 CE2 LEU A 150 40.249 -38.211 3.433 1.00 -0.07 C HETATM 1980 CD2 LEU A 150 40.624 -36.948 2.966 1.00 -0.06 C HETATM 1981 H LEU A 150 39.973 -36.414 2.284 1.00 0.06 H HETATM 1982 H LEU A 150 39.312 -38.651 3.111 1.00 0.06 H HETATM 1983 H LEU A 150 40.788 -39.883 4.673 1.00 0.06 H HETATM 1984 H LEU A 150 42.931 -38.860 5.404 1.00 0.06 H HETATM 1985 H LEU A 150 43.574 -36.623 4.572 1.00 0.06 H HETATM 1986 H LEU A 150 43.170 -35.097 2.360 1.00 0.05 H HETATM 1987 H LEU A 150 41.437 -34.657 2.191 1.00 0.05 H HETATM 1988 H LEU A 150 43.157 -34.336 4.693 1.00 0.08 H HETATM 1989 H LEU A 150 40.255 -34.095 4.268 1.00 0.19 H HETATM 1990 CB LEU A 150 39.220 -32.107 6.479 1.00 0.08 C HETATM 1991 OG LEU A 150 37.862 -31.938 6.823 1.00 -0.39 O HETATM 1992 H LEU A 150 37.322 -32.463 6.244 1.00 0.21 H HETATM 1993 H LEU A 150 39.370 -31.780 5.440 1.00 0.06 H HETATM 1994 H LEU A 150 39.839 -31.494 7.150 1.00 0.06 H HETATM 1995 H LEU A 150 38.952 -34.209 6.037 1.00 0.08 H HETATM 1996 H LEU A 150 40.064 -33.380 8.680 1.00 0.19 H HETATM 1997 CB LEU A 150 39.322 -36.817 10.291 1.00 0.00 C HETATM 1998 CG LEU A 150 39.133 -37.086 11.816 1.00 0.04 C HETATM 1999 CD LEU A 150 39.138 -38.562 12.175 1.00 0.17 C HETATM 2000 OE1 LEU A 150 39.907 -39.353 11.608 1.00 -0.40 O HETATM 2001 NE2 LEU A 150 38.297 -38.940 13.148 1.00 -0.30 N HETATM 2002 H LEU A 150 38.255 -39.899 13.428 1.00 0.18 H HETATM 2003 H LEU A 150 37.711 -38.263 13.594 1.00 0.18 H HETATM 2004 H LEU A 150 38.171 -36.655 12.129 1.00 0.05 H HETATM 2005 H LEU A 150 39.951 -36.592 12.361 1.00 0.05 H HETATM 2006 H LEU A 150 40.340 -37.117 10.003 1.00 0.03 H HETATM 2007 H LEU A 150 38.591 -37.419 9.732 1.00 0.03 H HETATM 2008 H LEU A 150 39.922 -34.742 10.390 1.00 0.08 H HETATM 2009 H LEU A 150 36.991 -35.349 10.167 1.00 0.19 H HETATM 2010 CB LEU A 150 35.871 -33.868 12.961 1.00 -0.01 C HETATM 2011 CG LEU A 150 34.504 -33.327 13.312 1.00 -0.02 C HETATM 2012 CD LEU A 150 33.980 -33.955 14.589 1.00 0.06 C HETATM 2013 NE LEU A 150 34.898 -33.661 15.687 1.00 -0.27 N HETATM 2014 CZ LEU A 150 34.606 -33.821 16.975 1.00 0.29 C HETATM 2015 NH1 LEU A 150 33.411 -34.284 17.332 1.00 -0.28 N HETATM 2016 H LEU A 150 33.184 -34.408 18.329 1.00 0.26 H HETATM 2017 H LEU A 150 32.713 -34.518 16.611 1.00 0.26 H HETATM 2018 NH2 LEU A 150 35.510 -33.519 17.902 1.00 -0.28 N HETATM 2019 H LEU A 150 36.434 -33.161 17.622 1.00 0.26 H HETATM 2020 H LEU A 150 35.286 -33.643 18.900 1.00 0.26 H HETATM 2021 H LEU A 150 35.835 -33.306 15.448 1.00 0.26 H HETATM 2022 H LEU A 150 33.903 -35.044 14.457 1.00 0.07 H HETATM 2023 H LEU A 150 32.987 -33.542 14.820 1.00 0.07 H HETATM 2024 H LEU A 150 33.808 -33.550 12.490 1.00 0.03 H HETATM 2025 H LEU A 150 34.573 -32.238 13.449 1.00 0.03 H HETATM 2026 H LEU A 150 36.565 -33.628 13.780 1.00 0.03 H HETATM 2027 H LEU A 150 35.799 -34.960 12.850 1.00 0.03 H HETATM 2028 H LEU A 150 36.585 -32.204 11.822 1.00 0.08 H HETATM 2029 H LEU A 150 34.688 -34.068 10.665 1.00 0.19 H HETATM 2030 CB LEU A 150 33.421 -31.775 8.460 1.00 -0.01 C HETATM 2031 CG LEU A 150 32.314 -31.729 7.382 1.00 -0.04 C HETATM 2032 CD1 LEU A 150 31.273 -30.637 7.706 1.00 -0.06 C HETATM 2033 H LEU A 150 30.498 -30.626 6.925 1.00 0.02 H HETATM 2034 H LEU A 150 31.770 -29.656 7.744 1.00 0.02 H HETATM 2035 H LEU A 150 30.809 -30.851 8.680 1.00 0.02 H HETATM 2036 CD2 LEU A 150 32.905 -31.467 5.989 1.00 -0.06 C HETATM 2037 H LEU A 150 33.648 -32.243 5.754 1.00 0.02 H HETATM 2038 H LEU A 150 33.390 -30.480 5.976 1.00 0.02 H HETATM 2039 H LEU A 150 32.101 -31.490 5.239 1.00 0.02 H HETATM 2040 H LEU A 150 31.806 -32.705 7.369 1.00 0.03 H HETATM 2041 H LEU A 150 33.952 -30.813 8.419 1.00 0.03 H HETATM 2042 H LEU A 150 32.920 -31.876 9.434 1.00 0.03 H HETATM 2043 H LEU A 150 34.977 -32.835 7.396 1.00 0.08 H HETATM 2044 H LEU A 150 32.928 -34.281 8.806 1.00 0.19 H HETATM 2045 CB LEU A 150 33.458 -37.361 7.276 1.00 0.08 C HETATM 2046 OG LEU A 150 32.876 -36.466 6.316 1.00 -0.39 O HETATM 2047 H LEU A 150 32.079 -36.094 6.674 1.00 0.21 H HETATM 2048 H LEU A 150 32.739 -38.166 7.487 1.00 0.06 H HETATM 2049 H LEU A 150 34.374 -37.791 6.846 1.00 0.06 H HETATM 2050 H LEU A 150 34.504 -37.325 9.142 1.00 0.08 H HETATM 2051 H LEU A 150 31.730 -36.700 9.077 1.00 0.19 H HETATM 2052 CB LEU A 150 31.181 -37.231 12.245 1.00 -0.01 C HETATM 2053 CG LEU A 150 30.164 -37.184 13.409 1.00 -0.04 C HETATM 2054 CD LEU A 150 30.373 -38.394 14.322 1.00 -0.01 C HETATM 2055 CE LEU A 150 29.109 -39.231 14.542 1.00 -0.04 C HETATM 2056 NZ LEU A 150 28.212 -38.656 15.595 1.00 0.22 N HETATM 2057 H LEU A 150 27.399 -39.242 15.700 1.00 0.20 H HETATM 2058 H LEU A 150 27.925 -37.729 15.322 1.00 0.20 H HETATM 2059 H LEU A 150 28.709 -38.610 16.471 1.00 0.20 H HETATM 2060 H LEU A 150 29.407 -40.245 14.848 1.00 0.08 H HETATM 2061 H LEU A 150 28.552 -39.283 13.595 1.00 0.08 H HETATM 2062 H LEU A 150 30.724 -38.033 15.300 1.00 0.03 H HETATM 2063 H LEU A 150 31.142 -39.039 13.871 1.00 0.03 H HETATM 2064 H LEU A 150 29.142 -37.204 13.003 1.00 0.03 H HETATM 2065 H LEU A 150 30.311 -36.260 13.987 1.00 0.03 H HETATM 2066 H LEU A 150 32.140 -37.588 12.649 1.00 0.03 H HETATM 2067 H LEU A 150 30.808 -37.949 11.500 1.00 0.03 H HETATM 2068 H LEU A 150 31.599 -35.134 12.297 1.00 0.08 H HETATM 2069 H LEU A 150 29.473 -36.047 10.634 1.00 0.19 H HETATM 2070 CB LEU A 150 28.016 -33.301 9.834 1.00 -0.01 C HETATM 2071 CG LEU A 150 28.370 -31.899 10.387 1.00 -0.04 C HETATM 2072 CD LEU A 150 27.141 -31.190 10.972 1.00 -0.01 C HETATM 2073 CE LEU A 150 27.464 -29.757 11.417 1.00 -0.04 C HETATM 2074 NZ LEU A 150 28.072 -28.944 10.289 1.00 0.22 N HETATM 2075 H LEU A 150 28.271 -28.012 10.616 1.00 0.20 H HETATM 2076 H LEU A 150 27.423 -28.899 9.519 1.00 0.20 H HETATM 2077 H LEU A 150 28.927 -29.382 9.982 1.00 0.20 H HETATM 2078 H LEU A 150 28.177 -29.795 12.254 1.00 0.08 H HETATM 2079 H LEU A 150 26.536 -29.269 11.749 1.00 0.08 H HETATM 2080 H LEU A 150 26.782 -31.760 11.842 1.00 0.03 H HETATM 2081 H LEU A 150 26.352 -31.155 10.206 1.00 0.03 H HETATM 2082 H LEU A 150 28.779 -31.287 9.570 1.00 0.03 H HETATM 2083 H LEU A 150 29.127 -32.009 11.177 1.00 0.03 H HETATM 2084 H LEU A 150 27.721 -33.945 10.676 1.00 0.03 H HETATM 2085 H LEU A 150 27.172 -33.199 9.136 1.00 0.03 H HETATM 2086 H LEU A 150 29.564 -33.247 8.357 1.00 0.08 H HETATM 2087 H LEU A 150 27.835 -35.535 8.498 1.00 0.19 H HETATM 2088 CB LEU A 150 28.088 -36.605 5.682 1.00 -0.01 C HETATM 2089 CG LEU A 150 28.688 -35.630 4.640 1.00 -0.04 C HETATM 2090 CD1 LEU A 150 29.747 -36.331 3.791 1.00 -0.06 C HETATM 2091 H LEU A 150 30.159 -35.621 3.059 1.00 0.02 H HETATM 2092 H LEU A 150 29.290 -37.180 3.261 1.00 0.02 H HETATM 2093 H LEU A 150 30.555 -36.697 4.441 1.00 0.02 H HETATM 2094 CD2 LEU A 150 27.591 -35.037 3.728 1.00 -0.06 C HETATM 2095 H LEU A 150 26.833 -34.534 4.346 1.00 0.02 H HETATM 2096 H LEU A 150 27.117 -35.845 3.151 1.00 0.02 H HETATM 2097 H LEU A 150 28.042 -34.309 3.037 1.00 0.02 H HETATM 2098 H LEU A 150 29.169 -34.803 5.183 1.00 0.03 H HETATM 2099 H LEU A 150 27.206 -36.125 6.130 1.00 0.03 H HETATM 2100 H LEU A 150 27.780 -37.520 5.155 1.00 0.03 H HETATM 2101 H LEU A 150 29.882 -37.561 6.380 1.00 0.08 H HETATM 2102 H LEU A 150 27.411 -38.079 7.711 1.00 0.19 H HETATM 2103 H LEU A 150 28.909 -39.185 10.805 1.00 0.08 H HETATM 2104 H LEU A 150 26.213 -39.300 9.914 1.00 0.19 H HETATM 2105 CB LEU A 150 24.626 -36.546 9.718 1.00 -0.01 C HETATM 2106 CG LEU A 150 23.093 -36.598 9.843 1.00 -0.04 C HETATM 2107 CD LEU A 150 22.399 -36.092 8.586 1.00 -0.01 C HETATM 2108 CE LEU A 150 20.880 -36.047 8.817 1.00 -0.04 C HETATM 2109 NZ LEU A 150 20.145 -35.730 7.533 1.00 0.22 N HETATM 2110 H LEU A 150 19.153 -35.706 7.711 1.00 0.20 H HETATM 2111 H LEU A 150 20.346 -36.440 6.846 1.00 0.20 H HETATM 2112 H LEU A 150 20.446 -34.833 7.186 1.00 0.20 H HETATM 2113 H LEU A 150 20.652 -35.271 9.563 1.00 0.08 H HETATM 2114 H LEU A 150 20.544 -37.025 9.192 1.00 0.08 H HETATM 2115 H LEU A 150 22.622 -36.768 7.748 1.00 0.03 H HETATM 2116 H LEU A 150 22.763 -35.081 8.349 1.00 0.03 H HETATM 2117 H LEU A 150 22.785 -35.973 10.694 1.00 0.03 H HETATM 2118 H LEU A 150 22.787 -37.639 10.023 1.00 0.03 H HETATM 2119 H LEU A 150 24.929 -37.095 8.814 1.00 0.03 H HETATM 2120 H LEU A 150 24.942 -35.496 9.632 1.00 0.03 H HETATM 2121 H LEU A 150 24.798 -38.119 11.169 1.00 0.08 H HETATM 2122 H LEU A 150 24.728 -35.428 12.035 1.00 0.19 H HETATM 2123 CB LEU A 150 26.948 -34.928 14.654 1.00 -0.01 C HETATM 2124 CG1 LEU A 150 27.400 -34.236 13.354 1.00 -0.06 C HETATM 2125 H LEU A 150 28.353 -33.716 13.528 1.00 0.02 H HETATM 2126 H LEU A 150 26.637 -33.508 13.041 1.00 0.02 H HETATM 2127 H LEU A 150 27.533 -34.990 12.564 1.00 0.02 H HETATM 2128 CG2 LEU A 150 26.831 -33.900 15.789 1.00 -0.06 C HETATM 2129 H LEU A 150 26.508 -34.406 16.710 1.00 0.02 H HETATM 2130 H LEU A 150 26.092 -33.133 15.514 1.00 0.02 H HETATM 2131 H LEU A 150 27.809 -33.425 15.956 1.00 0.02 H HETATM 2132 H LEU A 150 27.712 -35.668 14.935 1.00 0.03 H HETATM 2133 H LEU A 150 24.822 -34.938 14.210 1.00 0.08 H HETATM 2134 H LEU A 150 25.892 -36.405 16.411 1.00 0.19 H HETATM 2135 CB LEU A 150 22.511 -38.270 17.410 1.00 -0.01 C HETATM 2136 CG LEU A 150 22.475 -39.227 18.572 1.00 -0.02 C HETATM 2137 CD LEU A 150 21.053 -39.729 18.921 1.00 0.06 C HETATM 2138 NE LEU A 150 20.116 -38.642 19.192 1.00 -0.27 N HETATM 2139 CZ LEU A 150 20.053 -37.941 20.327 1.00 0.29 C HETATM 2140 NH1 LEU A 150 20.891 -38.180 21.348 1.00 -0.28 N HETATM 2141 H LEU A 150 20.821 -37.625 22.213 1.00 0.26 H HETATM 2142 H LEU A 150 21.604 -38.919 21.267 1.00 0.26 H HETATM 2143 NH2 LEU A 150 19.135 -36.983 20.450 1.00 -0.28 N HETATM 2144 H LEU A 150 18.486 -36.789 19.674 1.00 0.26 H HETATM 2145 H LEU A 150 19.075 -36.436 21.321 1.00 0.26 H HETATM 2146 H LEU A 150 19.449 -38.396 18.447 1.00 0.26 H HETATM 2147 H LEU A 150 21.116 -40.368 19.814 1.00 0.07 H HETATM 2148 H LEU A 150 20.671 -40.318 18.074 1.00 0.07 H HETATM 2149 H LEU A 150 22.890 -38.718 19.454 1.00 0.03 H HETATM 2150 H LEU A 150 23.099 -40.098 18.324 1.00 0.03 H HETATM 2151 H LEU A 150 22.167 -38.793 16.506 1.00 0.03 H HETATM 2152 H LEU A 150 21.840 -37.425 17.622 1.00 0.03 H HETATM 2153 H LEU A 150 24.608 -38.598 17.144 1.00 0.08 H HETATM 2154 H LEU A 150 25.069 -37.187 18.888 1.00 0.19 H HETATM 2155 CB LEU A 150 23.468 -35.237 20.884 1.00 0.08 C HETATM 2156 OG LEU A 150 24.116 -34.805 22.059 1.00 -0.39 O HETATM 2157 H LEU A 150 23.585 -35.032 22.814 1.00 0.21 H HETATM 2158 H LEU A 150 23.329 -36.328 20.925 1.00 0.06 H HETATM 2159 H LEU A 150 22.487 -34.745 20.807 1.00 0.06 H HETATM 2160 H LEU A 150 25.357 -35.138 19.866 1.00 0.08 H HETATM 2161 H LEU A 150 23.311 -33.054 19.205 1.00 0.19 H HETATM 2162 CB LEU A 150 26.449 -30.698 18.264 1.00 -0.00 C HETATM 2163 H LEU A 150 27.020 -31.400 17.638 1.00 0.03 H HETATM 2164 H LEU A 150 27.015 -30.482 19.182 1.00 0.03 H HETATM 2165 H LEU A 150 26.282 -29.764 17.708 1.00 0.03 H HETATM 2166 H LEU A 150 24.535 -31.488 17.698 1.00 0.11 H HETATM 2167 H LEU A 150 24.193 -29.539 18.994 1.00 0.20 H HETATM 2168 H LEU A 150 24.771 -30.280 20.345 1.00 0.20 H HETATM 2169 H LEU A 150 23.394 -30.830 19.631 1.00 0.20 H CONECT 1 2 14 15 16 CONECT 14 1 CONECT 15 1 CONECT 16 1 CONECT 1905 1906 2167 2168 2169 CONECT 1906 1905 1907 2162 2166 CONECT 1907 1906 1908 1909 CONECT 1908 1907 CONECT 1909 1907 1910 2161 CONECT 1910 1909 1911 2155 2160 CONECT 1911 1910 1912 1913 CONECT 1912 1911 CONECT 1913 1911 1914 2154 CONECT 1914 1913 1915 2135 2153 CONECT 1915 1914 1916 1917 CONECT 1916 1915 CONECT 1917 1915 1918 2134 CONECT 1918 1917 1919 2123 2133 CONECT 1919 1918 1920 1921 CONECT 1920 1919 CONECT 1921 1919 1922 2122 CONECT 1922 1921 1923 2105 2121 CONECT 1923 1922 1924 1925 CONECT 1924 1923 CONECT 1925 1923 1926 2104 CONECT 1926 1925 1927 1935 2103 CONECT 1927 1926 1928 1933 1934 CONECT 1928 1927 1929 CONECT 1929 1928 1930 1931 1932 CONECT 1930 1929 CONECT 1931 1929 CONECT 1932 1929 CONECT 1933 1927 CONECT 1934 1927 CONECT 1935 1926 1936 1937 CONECT 1936 1935 CONECT 1937 1935 1938 2102 CONECT 1938 1937 1939 2088 2101 CONECT 1939 1938 1940 1941 CONECT 1940 1939 CONECT 1941 1939 1942 2087 CONECT 1942 1941 1943 2070 2086 CONECT 1943 1942 1944 1945 CONECT 1944 1943 CONECT 1945 1943 1946 2069 CONECT 1946 1945 1947 2052 2068 CONECT 1947 1946 1948 1949 CONECT 1948 1947 CONECT 1949 1947 1950 2051 CONECT 1950 1949 1951 2045 2050 CONECT 1951 1950 1952 1953 CONECT 1952 1951 CONECT 1953 1951 1954 2044 CONECT 1954 1953 1955 2030 2043 CONECT 1955 1954 1956 1957 CONECT 1956 1955 CONECT 1957 1955 1958 2029 CONECT 1958 1957 1959 2010 2028 CONECT 1959 1958 1960 1961 CONECT 1960 1959 CONECT 1961 1959 1962 2009 CONECT 1962 1961 1963 1997 2008 CONECT 1963 1962 1964 1965 CONECT 1964 1963 CONECT 1965 1963 1966 1996 CONECT 1966 1965 1967 1990 1995 CONECT 1967 1966 1968 1969 CONECT 1968 1967 CONECT 1969 1967 1970 1989 CONECT 1970 1969 1971 1974 1988 CONECT 1971 1970 1972 1973 CONECT 1972 1971 CONECT 1973 1971 CONECT 1974 1970 1975 1986 1987 CONECT 1975 1974 1976 1980 CONECT 1976 1975 1977 1985 CONECT 1977 1976 1978 1984 CONECT 1978 1977 1979 1983 CONECT 1979 1978 1980 1982 CONECT 1980 1975 1979 1981 CONECT 1981 1980 CONECT 1982 1979 CONECT 1983 1978 CONECT 1984 1977 CONECT 1985 1976 CONECT 1986 1974 CONECT 1987 1974 CONECT 1988 1970 CONECT 1989 1969 CONECT 1990 1966 1991 1993 1994 CONECT 1991 1990 1992 CONECT 1992 1991 CONECT 1993 1990 CONECT 1994 1990 CONECT 1995 1966 CONECT 1996 1965 CONECT 1997 1962 1998 2006 2007 CONECT 1998 1997 1999 2004 2005 CONECT 1999 1998 2000 2001 CONECT 2000 1999 CONECT 2001 1999 2002 2003 CONECT 2002 2001 CONECT 2003 2001 CONECT 2004 1998 CONECT 2005 1998 CONECT 2006 1997 CONECT 2007 1997 CONECT 2008 1962 CONECT 2009 1961 CONECT 2010 1958 2011 2026 2027 CONECT 2011 2010 2012 2024 2025 CONECT 2012 2011 2013 2022 2023 CONECT 2013 2012 2014 2021 CONECT 2014 2013 2015 2018 CONECT 2015 2014 2016 2017 CONECT 2016 2015 CONECT 2017 2015 CONECT 2018 2014 2019 2020 CONECT 2019 2018 CONECT 2020 2018 CONECT 2021 2013 CONECT 2022 2012 CONECT 2023 2012 CONECT 2024 2011 CONECT 2025 2011 CONECT 2026 2010 CONECT 2027 2010 CONECT 2028 1958 CONECT 2029 1957 CONECT 2030 1954 2031 2041 2042 CONECT 2031 2030 2032 2036 2040 CONECT 2032 2031 2033 2034 2035 CONECT 2033 2032 CONECT 2034 2032 CONECT 2035 2032 CONECT 2036 2031 2037 2038 2039 CONECT 2037 2036 CONECT 2038 2036 CONECT 2039 2036 CONECT 2040 2031 CONECT 2041 2030 CONECT 2042 2030 CONECT 2043 1954 CONECT 2044 1953 CONECT 2045 1950 2046 2048 2049 CONECT 2046 2045 2047 CONECT 2047 2046 CONECT 2048 2045 CONECT 2049 2045 CONECT 2050 1950 CONECT 2051 1949 CONECT 2052 1946 2053 2066 2067 CONECT 2053 2052 2054 2064 2065 CONECT 2054 2053 2055 2062 2063 CONECT 2055 2054 2056 2060 2061 CONECT 2056 2055 2057 2058 2059 CONECT 2057 2056 CONECT 2058 2056 CONECT 2059 2056 CONECT 2060 2055 CONECT 2061 2055 CONECT 2062 2054 CONECT 2063 2054 CONECT 2064 2053 CONECT 2065 2053 CONECT 2066 2052 CONECT 2067 2052 CONECT 2068 1946 CONECT 2069 1945 CONECT 2070 1942 2071 2084 2085 CONECT 2071 2070 2072 2082 2083 CONECT 2072 2071 2073 2080 2081 CONECT 2073 2072 2074 2078 2079 CONECT 2074 2073 2075 2076 2077 CONECT 2075 2074 CONECT 2076 2074 CONECT 2077 2074 CONECT 2078 2073 CONECT 2079 2073 CONECT 2080 2072 CONECT 2081 2072 CONECT 2082 2071 CONECT 2083 2071 CONECT 2084 2070 CONECT 2085 2070 CONECT 2086 1942 CONECT 2087 1941 CONECT 2088 1938 2089 2099 2100 CONECT 2089 2088 2090 2094 2098 CONECT 2090 2089 2091 2092 2093 CONECT 2091 2090 CONECT 2092 2090 CONECT 2093 2090 CONECT 2094 2089 2095 2096 2097 CONECT 2095 2094 CONECT 2096 2094 CONECT 2097 2094 CONECT 2098 2089 CONECT 2099 2088 CONECT 2100 2088 CONECT 2101 1938 CONECT 2102 1937 CONECT 2103 1926 CONECT 2104 1925 CONECT 2105 1922 2106 2119 2120 CONECT 2106 2105 2107 2117 2118 CONECT 2107 2106 2108 2115 2116 CONECT 2108 2107 2109 2113 2114 CONECT 2109 2108 2110 2111 2112 CONECT 2110 2109 CONECT 2111 2109 CONECT 2112 2109 CONECT 2113 2108 CONECT 2114 2108 CONECT 2115 2107 CONECT 2116 2107 CONECT 2117 2106 CONECT 2118 2106 CONECT 2119 2105 CONECT 2120 2105 CONECT 2121 1922 CONECT 2122 1921 CONECT 2123 1918 2124 2128 2132 CONECT 2124 2123 2125 2126 2127 CONECT 2125 2124 CONECT 2126 2124 CONECT 2127 2124 CONECT 2128 2123 2129 2130 2131 CONECT 2129 2128 CONECT 2130 2128 CONECT 2131 2128 CONECT 2132 2123 CONECT 2133 1918 CONECT 2134 1917 CONECT 2135 1914 2136 2151 2152 CONECT 2136 2135 2137 2149 2150 CONECT 2137 2136 2138 2147 2148 CONECT 2138 2137 2139 2146 CONECT 2139 2138 2140 2143 CONECT 2140 2139 2141 2142 CONECT 2141 2140 CONECT 2142 2140 CONECT 2143 2139 2144 2145 CONECT 2144 2143 CONECT 2145 2143 CONECT 2146 2138 CONECT 2147 2137 CONECT 2148 2137 CONECT 2149 2136 CONECT 2150 2136 CONECT 2151 2135 CONECT 2152 2135 CONECT 2153 1914 CONECT 2154 1913 CONECT 2155 1910 2156 2158 2159 CONECT 2156 2155 2157 CONECT 2157 2156 CONECT 2158 2155 CONECT 2159 2155 CONECT 2160 1910 CONECT 2161 1909 CONECT 2162 1906 2163 2164 2165 CONECT 2163 2162 CONECT 2164 2162 CONECT 2165 2162 CONECT 2166 1906 CONECT 2167 1905 CONECT 2168 1905 CONECT 2169 1905 MASTER 0 0 0 0 0 0 0 0 2168 1 269 14 END
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PDBbind
15-mer
4xyn
RCSB PDB
PDBbind
15-mer
5cfa
RCSB PDB
PDBbind
15-mer
5cin
RCSB PDB
PDBbind
15-mer
5cqx
RCSB PDB
PDBbind
15-mer
5dif
RCSB PDB
PDBbind
15-mer
5epp
RCSB PDB
PDBbind
15-mer
5etf
RCSB PDB
PDBbind
15-mer
5fb0
RCSB PDB
PDBbind
15-mer
5fb1
RCSB PDB
PDBbind
15-mer
5h5q
RCSB PDB
PDBbind
15-mer
5h5r
RCSB PDB
PDBbind
15-mer
5ix1
RCSB PDB
PDBbind
15-mer
5izu
RCSB PDB
PDBbind
15-mer
5j19
RCSB PDB
PDBbind
15-mer
5j9k
RCSB PDB
PDBbind
15-mer
5jlz
RCSB PDB
PDBbind
15-mer
5ksu
RCSB PDB
PDBbind
15-mer
5ksv
RCSB PDB
PDBbind
15-mer
5kzp
RCSB PDB
PDBbind
15-mer
5lax
RCSB PDB
PDBbind
15-mer
5mlo
RCSB PDB
PDBbind
15-mer
5o45
RCSB PDB
PDBbind
15-mer
5svz
RCSB PDB
PDBbind
15-mer
5t1i
RCSB PDB
PDBbind
15-mer
5twg
RCSB PDB
PDBbind
15-mer
5u66
RCSB PDB
PDBbind
15-mer
5ul6
RCSB PDB
PDBbind
15-mer
5uwj
RCSB PDB
PDBbind
15-mer
5v4b
RCSB PDB
PDBbind
15-mer
5vb9
RCSB PDB
PDBbind
15-mer
5vzy
RCSB PDB
PDBbind
15-mer
5wir
RCSB PDB
PDBbind
15-mer
5ypo
RCSB PDB
PDBbind
15-mer
5znp
RCSB PDB
PDBbind
15-mer
5zuj
RCSB PDB
PDBbind
15-mer
6atv
RCSB PDB
PDBbind
15-mer
6b5m
RCSB PDB
PDBbind
15-mer
6b5o
RCSB PDB
PDBbind
15-mer
6b5r
RCSB PDB
PDBbind
15-mer
6b5t
RCSB PDB
PDBbind
15-mer
6biz
RCSB PDB
PDBbind
15-mer
6f0y
RCSB PDB
PDBbind
15-mer
6rmm
RCSB PDB
PDBbind
15-mer
6rml
RCSB PDB
PDBbind
15-mer
6q9t
RCSB PDB
PDBbind
15-mer
6hol
RCSB PDB
PDBbind
15-mer
6e5x
RCSB PDB
PDBbind
15-mer
6bnt
RCSB PDB
PDBbind
15-mer
5zk9
RCSB PDB
PDBbind
15-mer
5zjz
RCSB PDB
PDBbind
15-mer
5vtb
RCSB PDB
PDBbind
15-mer
6a5e
RCSB PDB
PDBbind
15-mer
Entry Information
PDB ID
3wp0
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Disks large homolog 4, Dlg GK
Ligand Name
15-mer
EC.Number
E.C.-.-.-.-
Resolution
2.04(Å)
Affinity (Kd/Ki/IC50)
Kd=10.2uM
Release Year
2014
Protein/NA Sequence
Check fasta file
Primary Reference
(2014) Cell Res. Vol. 24: pp. 451-463
Ligand Properties
Formula
C
7
6
H
1
4
3
N
2
5
O
2
4
P
Molecular Weight
1822.080
Exact Mass
1821.050
No. of atoms
269
No. of bonds
269
Polar Surface Area
874.57
LOGP Value
-8.26 (
Computed with XLOGP3
)
-8.13 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 22
No. of Hydrogen Bond Acceptors: 23
No. of Rotatable Bonds: 80
No. of Nitrogen and Oxygen Atoms: 49
No. of Rings: 1
Canonical SMILES
[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccccc1)CO)CCC(=O)N)CCC[NH+]=C(N)N)CC(C)C)CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CO)CCC[NH+]=C(N)N)CCCC[NH3+])COP(O)(O)O)CC(C)C)CCCC[NH3+]
InChI String
InChI=1S/C76H138N25O24P/c1-40(2)33-51(67(113)90-48(24-17-31-86-75(82)83)62(108)92-50(26-27-58(81)105)65(111)99-56(38-104)71(117)96-53(74(120)121)35-44-19-9-8-10-20-44)94-70(116)55(37-103)98-63(109)46(22-12-15-29-78)88-61(107)45(21-11-14-28-77)89-68(114)52(34-41(3)4)95-72(118)57(39-125-126(122,123)124)100-64(110)47(23-13-16-30-79)93-73(119)59(42(5)6)101-66(112)49(25-18-32-87-76(84)85)91-69(115)54(36-102)97-60(106)43(7)80/h8-10,19-20,40-43,45-57,59,102-104,122-124,126H,11-18,21-39,77-80H2,1-7H3,(H2,81,105)(H,88,107)(H,89,114)(H,90,113)(H,91,115)(H,92,108)(H,93,119)(H,94,116)(H,95,118)(H,96,117)(H,97,106)(H,98,109)(H,99,111)(H,100,110)(H,101,112)(H,120,121)(H4,82,83,86)(H4,84,85,87)/p+6/t43-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,59-/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):
Q6P1M3
P31016
Entrez Gene ID
NCBI Entrez Gene ID:
3993
29495
ASD
Information of known allosteric effects of PDB entries
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