Browse entries in the PDBbind-CN Database
HEADER 5DY7_COMPLEX COMPND 5DY7_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 113 GLU MET GLN LEU THR PRO PHE LEU ILE LEU LEU ARG LYS SEQRES 2 A 113 THR LEU GLU GLN LEU GLN GLU LYS ASP THR GLY ASN ILE SEQRES 3 A 113 PHE SER GLU PRO VAL PRO LEU SER GLU VAL PRO ASP TYR SEQRES 4 A 113 LEU ASP HIS ILE LYS LYS PRO MET ASP PHE PHE THR MET SEQRES 5 A 113 LYS GLN ASN LEU GLU ALA TYR ARG TYR LEU ASN PHE ASP SEQRES 6 A 113 ASP PHE GLU GLU ASP PHE ASN LEU ILE VAL SER ASN CYS SEQRES 7 A 113 LEU LYS TYR ASN ALA LYS ASP THR ILE PHE TYR ARG ALA SEQRES 8 A 113 ALA VAL ARG LEU ARG GLU GLN GLY GLY ALA VAL LEU ARG SEQRES 9 A 113 GLN ALA ARG ARG GLN ALA GLU LYS MET HET UNN A 256 22 ATOM 1 N GLU A 627 49.547 -4.133 -14.205 1.00 43.95 N ATOM 2 CA GLU A 627 50.964 -3.981 -13.861 1.00 50.68 C ATOM 3 C GLU A 627 51.208 -2.673 -13.106 1.00 57.96 C ATOM 4 O GLU A 627 52.186 -1.962 -13.363 1.00 63.19 O ATOM 5 CB GLU A 627 51.841 -4.034 -15.118 1.00 48.92 C ATOM 6 HN3 GLU A 627 49.251 -3.339 -14.808 1.00 0.00 H ATOM 7 HN2 GLU A 627 48.979 -4.139 -13.334 1.00 0.00 H ATOM 8 HN1 GLU A 627 49.410 -5.028 -14.716 1.00 0.00 H ATOM 9 N MET A 628 50.320 -2.371 -12.160 1.00 54.66 N ATOM 10 CA MET A 628 50.346 -1.116 -11.428 1.00 51.56 C ATOM 11 C MET A 628 50.341 -1.384 -9.925 1.00 40.42 C ATOM 12 O MET A 628 50.198 -2.523 -9.466 1.00 33.81 O ATOM 13 CB MET A 628 49.155 -0.234 -11.828 1.00 57.49 C ATOM 14 CG MET A 628 47.824 -0.980 -11.838 1.00 61.68 C ATOM 15 SD MET A 628 46.418 0.003 -12.404 1.00 65.33 S ATOM 16 CE MET A 628 46.423 -0.331 -14.169 1.00 66.16 C ATOM 17 H MET A 628 49.577 -3.063 -11.936 1.00 0.00 H ATOM 18 N GLN A 629 50.511 -0.312 -9.157 1.00 40.52 N ATOM 19 CA GLN A 629 50.469 -0.398 -7.706 1.00 33.95 C ATOM 20 C GLN A 629 49.029 -0.373 -7.209 1.00 31.79 C ATOM 21 O GLN A 629 48.163 0.293 -7.784 1.00 31.58 O ATOM 22 CB GLN A 629 51.242 0.756 -7.072 1.00 43.00 C ATOM 23 CG GLN A 629 52.720 0.528 -6.903 1.00 51.59 C ATOM 24 CD GLN A 629 53.334 1.587 -6.018 1.00 58.13 C ATOM 25 OE1 GLN A 629 52.696 2.601 -5.719 1.00 55.76 O ATOM 26 NE2 GLN A 629 54.569 1.357 -5.580 1.00 62.48 N ATOM 27 HE22 GLN A 629 55.066 0.487 -5.859 1.00 0.00 H ATOM 28 HE21 GLN A 629 55.037 2.047 -4.958 1.00 0.00 H ATOM 29 H GLN A 629 50.678 0.611 -9.605 1.00 0.00 H ATOM 30 N LEU A 630 48.792 -1.075 -6.097 1.00 32.50 N ATOM 31 CA LEU A 630 47.432 -1.272 -5.607 1.00 31.60 C ATOM 32 C LEU A 630 46.874 0.002 -4.983 1.00 31.13 C ATOM 33 O LEU A 630 45.748 0.406 -5.285 1.00 29.78 O ATOM 34 CB LEU A 630 47.400 -2.423 -4.598 1.00 33.00 C ATOM 35 CG LEU A 630 46.058 -2.677 -3.896 1.00 37.12 C ATOM 36 CD1 LEU A 630 44.985 -3.074 -4.885 1.00 37.81 C ATOM 37 CD2 LEU A 630 46.189 -3.740 -2.812 1.00 45.58 C ATOM 38 H LEU A 630 49.590 -1.488 -5.572 1.00 0.00 H ATOM 39 N THR A 631 47.646 0.647 -4.111 1.00 32.47 N ATOM 40 CA THR A 631 47.110 1.788 -3.368 1.00 32.55 C ATOM 41 C THR A 631 46.620 2.909 -4.275 1.00 31.20 C ATOM 42 O THR A 631 45.481 3.366 -4.079 1.00 30.48 O ATOM 43 CB THR A 631 48.146 2.290 -2.356 1.00 34.55 C ATOM 44 OG1 THR A 631 48.388 1.272 -1.381 1.00 43.05 O ATOM 45 CG2 THR A 631 47.644 3.562 -1.654 1.00 35.09 C ATOM 46 HG1 THR A 631 49.057 1.595 -0.727 1.00 0.00 H ATOM 47 H THR A 631 48.628 0.341 -3.958 1.00 0.00 H ATOM 48 N PRO A 632 47.382 3.393 -5.268 1.00 31.06 N ATOM 49 CA PRO A 632 46.829 4.452 -6.134 1.00 30.07 C ATOM 50 C PRO A 632 45.602 4.012 -6.903 1.00 28.35 C ATOM 51 O PRO A 632 44.692 4.819 -7.131 1.00 27.61 O ATOM 52 CB PRO A 632 47.988 4.788 -7.084 1.00 30.65 C ATOM 53 CG PRO A 632 48.973 3.669 -6.931 1.00 36.19 C ATOM 54 CD PRO A 632 48.809 3.148 -5.551 1.00 35.61 C ATOM 55 N PHE A 633 45.549 2.744 -7.309 1.00 27.90 N ATOM 56 CA PHE A 633 44.369 2.255 -8.006 1.00 26.47 C ATOM 57 C PHE A 633 43.137 2.324 -7.112 1.00 26.05 C ATOM 58 O PHE A 633 42.055 2.728 -7.560 1.00 24.97 O ATOM 59 CB PHE A 633 44.607 0.822 -8.487 1.00 26.55 C ATOM 60 CG PHE A 633 43.433 0.240 -9.198 1.00 25.36 C ATOM 61 CD1 PHE A 633 43.094 0.681 -10.464 1.00 24.51 C ATOM 62 CD2 PHE A 633 42.661 -0.750 -8.603 1.00 25.34 C ATOM 63 CE1 PHE A 633 41.986 0.153 -11.129 1.00 23.95 C ATOM 64 CE2 PHE A 633 41.558 -1.271 -9.264 1.00 24.39 C ATOM 65 CZ PHE A 633 41.229 -0.818 -10.524 1.00 23.46 C ATOM 66 H PHE A 633 46.349 2.105 -7.128 1.00 0.00 H ATOM 67 N LEU A 634 43.266 1.912 -5.847 1.00 27.13 N ATOM 68 CA LEU A 634 42.110 1.987 -4.963 1.00 27.13 C ATOM 69 C LEU A 634 41.726 3.429 -4.684 1.00 27.21 C ATOM 70 O LEU A 634 40.538 3.731 -4.544 1.00 26.70 O ATOM 71 CB LEU A 634 42.371 1.259 -3.650 1.00 28.73 C ATOM 72 CG LEU A 634 42.508 -0.256 -3.822 1.00 28.97 C ATOM 73 CD1 LEU A 634 42.557 -0.902 -2.471 1.00 33.86 C ATOM 74 CD2 LEU A 634 41.345 -0.811 -4.629 1.00 27.58 C ATOM 75 H LEU A 634 44.175 1.545 -5.500 1.00 0.00 H ATOM 76 N ILE A 635 42.715 4.318 -4.580 1.00 28.10 N ATOM 77 CA ILE A 635 42.411 5.737 -4.421 1.00 28.49 C ATOM 78 C ILE A 635 41.593 6.224 -5.606 1.00 27.04 C ATOM 79 O ILE A 635 40.620 6.970 -5.442 1.00 28.53 O ATOM 80 CB ILE A 635 43.705 6.552 -4.251 1.00 29.89 C ATOM 81 CG1 ILE A 635 44.288 6.327 -2.861 1.00 31.69 C ATOM 82 CG2 ILE A 635 43.430 8.056 -4.495 1.00 30.31 C ATOM 83 CD1 ILE A 635 45.726 6.801 -2.708 1.00 33.93 C ATOM 84 H ILE A 635 43.705 4.000 -4.612 1.00 0.00 H ATOM 85 N LEU A 636 41.968 5.798 -6.813 1.00 26.12 N ATOM 86 CA LEU A 636 41.228 6.198 -8.006 1.00 24.98 C ATOM 87 C LEU A 636 39.819 5.623 -7.999 1.00 24.55 C ATOM 88 O LEU A 636 38.859 6.312 -8.363 1.00 23.39 O ATOM 89 CB LEU A 636 41.991 5.760 -9.251 1.00 24.66 C ATOM 90 CG LEU A 636 41.293 5.893 -10.597 1.00 23.69 C ATOM 91 CD1 LEU A 636 41.034 7.362 -10.906 1.00 24.16 C ATOM 92 CD2 LEU A 636 42.148 5.273 -11.675 1.00 31.91 C ATOM 93 H LEU A 636 42.796 5.175 -6.905 1.00 0.00 H ATOM 94 N LEU A 637 39.662 4.355 -7.608 1.00 23.65 N ATOM 95 CA LEU A 637 38.307 3.817 -7.547 1.00 22.86 C ATOM 96 C LEU A 637 37.470 4.545 -6.506 1.00 23.47 C ATOM 97 O LEU A 637 36.270 4.759 -6.711 1.00 22.87 O ATOM 98 CB LEU A 637 38.319 2.321 -7.248 1.00 22.96 C ATOM 99 CG LEU A 637 38.876 1.435 -8.350 1.00 22.51 C ATOM 100 CD1 LEU A 637 38.539 0.018 -7.959 1.00 22.86 C ATOM 101 CD2 LEU A 637 38.237 1.786 -9.673 1.00 21.38 C ATOM 102 H LEU A 637 40.482 3.768 -7.354 1.00 0.00 H ATOM 103 N ARG A 638 38.076 4.937 -5.380 1.00 24.90 N ATOM 104 CA ARG A 638 37.311 5.652 -4.360 1.00 25.92 C ATOM 105 C ARG A 638 36.820 6.977 -4.907 1.00 25.74 C ATOM 106 O ARG A 638 35.649 7.336 -4.738 1.00 25.75 O ATOM 107 CB ARG A 638 38.154 5.898 -3.104 1.00 27.84 C ATOM 108 CG ARG A 638 38.467 4.629 -2.332 1.00 28.55 C ATOM 109 CD ARG A 638 39.266 4.931 -1.060 1.00 36.99 C ATOM 110 NE ARG A 638 39.645 3.710 -0.353 1.00 35.42 N ATOM 111 CZ ARG A 638 40.874 3.206 -0.344 1.00 38.85 C ATOM 112 NH1 ARG A 638 41.849 3.824 -0.993 1.00 40.94 N ATOM 113 NH2 ARG A 638 41.131 2.086 0.321 1.00 43.84 N ATOM 114 HE ARG A 638 38.907 3.204 0.176 1.00 0.00 H ATOM 115 HH12 ARG A 638 42.811 3.429 -0.985 1.00 0.00 H ATOM 116 HH11 ARG A 638 41.653 4.705 -1.510 1.00 0.00 H ATOM 117 HH22 ARG A 638 42.094 1.694 0.326 1.00 0.00 H ATOM 118 HH21 ARG A 638 40.369 1.601 0.837 1.00 0.00 H ATOM 119 H ARG A 638 39.085 4.734 -5.231 1.00 0.00 H ATOM 120 N LYS A 639 37.715 7.712 -5.569 1.00 25.84 N ATOM 121 CA LYS A 639 37.339 8.983 -6.176 1.00 26.00 C ATOM 122 C LYS A 639 36.257 8.782 -7.222 1.00 24.53 C ATOM 123 O LYS A 639 35.279 9.540 -7.272 1.00 24.75 O ATOM 124 CB LYS A 639 38.568 9.642 -6.801 1.00 28.65 C ATOM 125 CG LYS A 639 38.285 10.955 -7.540 1.00 30.36 C ATOM 126 CD LYS A 639 39.493 11.366 -8.363 1.00 35.72 C ATOM 127 CE LYS A 639 39.236 12.649 -9.130 1.00 45.10 C ATOM 128 NZ LYS A 639 40.493 13.195 -9.723 1.00 51.90 N ATOM 129 HZ1 LYS A 639 41.174 13.396 -8.963 1.00 0.00 H ATOM 130 HZ2 LYS A 639 40.898 12.496 -10.377 1.00 0.00 H ATOM 131 HZ3 LYS A 639 40.279 14.072 -10.240 1.00 0.00 H ATOM 132 H LYS A 639 38.695 7.374 -5.653 1.00 0.00 H ATOM 133 N THR A 640 36.418 7.758 -8.063 1.00 23.23 N ATOM 134 CA THR A 640 35.452 7.503 -9.125 1.00 21.99 C ATOM 135 C THR A 640 34.087 7.155 -8.554 1.00 21.71 C ATOM 136 O THR A 640 33.054 7.633 -9.046 1.00 21.38 O ATOM 137 CB THR A 640 35.970 6.372 -10.014 1.00 21.09 C ATOM 138 OG1 THR A 640 37.264 6.730 -10.511 1.00 21.64 O ATOM 139 CG2 THR A 640 35.011 6.122 -11.177 1.00 20.06 C ATOM 140 HG1 THR A 640 37.882 6.868 -9.750 1.00 0.00 H ATOM 141 H THR A 640 37.243 7.134 -7.959 1.00 0.00 H ATOM 142 N LEU A 641 34.060 6.304 -7.523 1.00 22.05 N ATOM 143 CA LEU A 641 32.798 5.958 -6.887 1.00 22.17 C ATOM 144 C LEU A 641 32.128 7.203 -6.312 1.00 23.24 C ATOM 145 O LEU A 641 30.910 7.368 -6.431 1.00 23.09 O ATOM 146 CB LEU A 641 33.034 4.895 -5.804 1.00 22.90 C ATOM 147 CG LEU A 641 31.808 4.412 -5.045 1.00 23.45 C ATOM 148 CD1 LEU A 641 30.796 3.823 -6.001 1.00 22.17 C ATOM 149 CD2 LEU A 641 32.221 3.383 -4.002 1.00 24.59 C ATOM 150 H LEU A 641 34.946 5.887 -7.174 1.00 0.00 H ATOM 151 N GLU A 642 32.912 8.109 -5.725 1.00 24.54 N ATOM 152 CA GLU A 642 32.328 9.350 -5.222 1.00 25.94 C ATOM 153 C GLU A 642 31.747 10.179 -6.355 1.00 25.38 C ATOM 154 O GLU A 642 30.668 10.766 -6.208 1.00 26.00 O ATOM 155 CB GLU A 642 33.368 10.159 -4.453 1.00 27.68 C ATOM 156 CG GLU A 642 33.674 9.586 -3.075 1.00 46.23 C ATOM 157 CD GLU A 642 34.772 10.346 -2.348 1.00 58.50 C ATOM 158 OE1 GLU A 642 35.157 11.440 -2.816 1.00 61.40 O ATOM 159 OE2 GLU A 642 35.256 9.842 -1.308 1.00 64.76 O ATOM 160 H GLU A 642 33.932 7.933 -5.626 1.00 0.00 H ATOM 161 N GLN A 643 32.441 10.240 -7.495 1.00 24.47 N ATOM 162 CA GLN A 643 31.912 11.011 -8.621 1.00 24.24 C ATOM 163 C GLN A 643 30.637 10.385 -9.159 1.00 23.04 C ATOM 164 O GLN A 643 29.715 11.096 -9.572 1.00 23.38 O ATOM 165 CB GLN A 643 32.952 11.129 -9.731 1.00 23.85 C ATOM 166 CG GLN A 643 34.193 11.874 -9.315 1.00 26.15 C ATOM 167 CD GLN A 643 35.307 11.776 -10.339 1.00 27.50 C ATOM 168 OE1 GLN A 643 35.518 10.735 -10.944 1.00 27.38 O ATOM 169 NE2 GLN A 643 36.034 12.870 -10.527 1.00 34.43 N ATOM 170 HE22 GLN A 643 35.820 13.735 -9.991 1.00 0.00 H ATOM 171 HE21 GLN A 643 36.818 12.862 -11.211 1.00 0.00 H ATOM 172 H GLN A 643 33.351 9.743 -7.582 1.00 0.00 H ATOM 173 N LEU A 644 30.567 9.049 -9.176 1.00 21.85 N ATOM 174 CA LEU A 644 29.340 8.395 -9.608 1.00 20.94 C ATOM 175 C LEU A 644 28.201 8.671 -8.641 1.00 21.86 C ATOM 176 O LEU A 644 27.079 8.967 -9.065 1.00 21.80 O ATOM 177 CB LEU A 644 29.572 6.883 -9.759 1.00 19.89 C ATOM 178 CG LEU A 644 30.556 6.480 -10.850 1.00 19.15 C ATOM 179 CD1 LEU A 644 30.825 4.983 -10.708 1.00 18.97 C ATOM 180 CD2 LEU A 644 30.034 6.796 -12.249 1.00 18.61 C ATOM 181 H LEU A 644 31.386 8.480 -8.882 1.00 0.00 H ATOM 182 N GLN A 645 28.466 8.607 -7.336 1.00 22.97 N ATOM 183 CA GLN A 645 27.409 8.911 -6.382 1.00 24.27 C ATOM 184 C GLN A 645 26.939 10.344 -6.529 1.00 25.41 C ATOM 185 O GLN A 645 25.752 10.627 -6.339 1.00 26.96 O ATOM 186 CB GLN A 645 27.875 8.672 -4.948 1.00 26.52 C ATOM 187 CG GLN A 645 28.181 7.223 -4.676 1.00 28.68 C ATOM 188 CD GLN A 645 27.825 6.805 -3.269 1.00 43.13 C ATOM 189 OE1 GLN A 645 26.674 6.934 -2.838 1.00 50.26 O ATOM 190 NE2 GLN A 645 28.810 6.300 -2.541 1.00 42.43 N ATOM 191 HE22 GLN A 645 29.763 6.211 -2.947 1.00 0.00 H ATOM 192 HE21 GLN A 645 28.630 5.993 -1.564 1.00 0.00 H ATOM 193 H GLN A 645 29.416 8.343 -7.004 1.00 0.00 H ATOM 194 N GLU A 646 27.854 11.258 -6.862 1.00 25.87 N ATOM 195 CA GLU A 646 27.464 12.656 -7.057 1.00 27.29 C ATOM 196 C GLU A 646 26.467 12.815 -8.193 1.00 26.51 C ATOM 197 O GLU A 646 25.678 13.770 -8.188 1.00 28.55 O ATOM 198 CB GLU A 646 28.692 13.521 -7.327 1.00 35.01 C ATOM 199 CG GLU A 646 29.543 13.795 -6.103 1.00 46.75 C ATOM 200 CD GLU A 646 30.856 14.492 -6.445 1.00 59.36 C ATOM 201 OE1 GLU A 646 30.983 15.011 -7.578 1.00 60.73 O ATOM 202 OE2 GLU A 646 31.763 14.509 -5.580 1.00 64.32 O ATOM 203 H GLU A 646 28.848 10.976 -6.983 1.00 0.00 H ATOM 204 N LYS A 647 26.494 11.919 -9.185 1.00 24.61 N ATOM 205 CA LYS A 647 25.512 11.997 -10.267 1.00 24.02 C ATOM 206 C LYS A 647 24.143 11.477 -9.849 1.00 28.24 C ATOM 207 O LYS A 647 23.145 11.774 -10.515 1.00 29.96 O ATOM 208 CB LYS A 647 26.002 11.217 -11.494 1.00 24.75 C ATOM 209 CG LYS A 647 27.332 11.706 -12.042 1.00 22.57 C ATOM 210 CD LYS A 647 27.311 13.173 -12.373 1.00 27.07 C ATOM 211 CE LYS A 647 28.575 13.554 -13.115 1.00 32.10 C ATOM 212 NZ LYS A 647 28.567 14.989 -13.453 1.00 37.36 N ATOM 213 HZ1 LYS A 647 27.746 15.197 -14.057 1.00 0.00 H ATOM 214 HZ2 LYS A 647 28.507 15.549 -12.579 1.00 0.00 H ATOM 215 HZ3 LYS A 647 29.442 15.229 -13.961 1.00 0.00 H ATOM 216 H LYS A 647 27.212 11.167 -9.188 1.00 0.00 H ATOM 217 N ASP A 648 24.071 10.727 -8.754 1.00 24.26 N ATOM 218 CA ASP A 648 22.812 10.182 -8.253 1.00 26.79 C ATOM 219 C ASP A 648 22.278 11.181 -7.238 1.00 26.65 C ATOM 220 O ASP A 648 22.375 11.008 -6.026 1.00 27.87 O ATOM 221 CB ASP A 648 23.042 8.794 -7.651 1.00 23.78 C ATOM 222 CG ASP A 648 21.814 8.234 -6.945 1.00 31.69 C ATOM 223 OD1 ASP A 648 20.679 8.650 -7.279 1.00 25.45 O ATOM 224 OD2 ASP A 648 21.992 7.365 -6.059 1.00 27.96 O ATOM 225 H ASP A 648 24.947 10.520 -8.233 1.00 0.00 H ATOM 226 N THR A 649 21.731 12.284 -7.754 1.00 27.53 N ATOM 227 CA THR A 649 21.395 13.382 -6.857 1.00 30.04 C ATOM 228 C THR A 649 20.228 13.034 -5.947 1.00 31.26 C ATOM 229 O THR A 649 20.150 13.542 -4.819 1.00 33.51 O ATOM 230 CB THR A 649 21.064 14.632 -7.663 1.00 31.01 C ATOM 231 OG1 THR A 649 19.948 14.349 -8.512 1.00 30.22 O ATOM 232 CG2 THR A 649 22.251 15.034 -8.512 1.00 30.28 C ATOM 233 HG1 THR A 649 19.724 15.155 -9.041 1.00 0.00 H ATOM 234 H THR A 649 21.548 12.358 -8.775 1.00 0.00 H ATOM 235 N GLY A 650 19.304 12.201 -6.427 1.00 30.12 N ATOM 236 CA GLY A 650 18.212 11.721 -5.607 1.00 31.31 C ATOM 237 C GLY A 650 18.614 10.693 -4.577 1.00 33.54 C ATOM 238 O GLY A 650 17.786 10.336 -3.735 1.00 32.97 O ATOM 239 H GLY A 650 19.370 11.888 -7.417 1.00 0.00 H ATOM 240 N ASN A 651 19.862 10.209 -4.628 1.00 30.18 N ATOM 241 CA ASN A 651 20.343 9.156 -3.734 1.00 30.36 C ATOM 242 C ASN A 651 19.453 7.920 -3.816 1.00 29.83 C ATOM 243 O ASN A 651 19.215 7.236 -2.820 1.00 38.95 O ATOM 244 CB ASN A 651 20.468 9.640 -2.288 1.00 33.45 C ATOM 245 CG ASN A 651 21.745 10.416 -2.041 1.00 34.18 C ATOM 246 OD1 ASN A 651 21.952 10.968 -0.965 1.00 46.87 O ATOM 247 ND2 ASN A 651 22.612 10.456 -3.039 1.00 38.56 N ATOM 248 HD22 ASN A 651 22.396 9.974 -3.935 1.00 0.00 H ATOM 249 HD21 ASN A 651 23.509 10.970 -2.928 1.00 0.00 H ATOM 250 H ASN A 651 20.518 10.599 -5.334 1.00 0.00 H ATOM 251 N ILE A 652 18.961 7.616 -5.018 1.00 28.10 N ATOM 252 CA ILE A 652 18.105 6.444 -5.155 1.00 28.66 C ATOM 253 C ILE A 652 18.920 5.185 -5.362 1.00 26.44 C ATOM 254 O ILE A 652 18.359 4.079 -5.311 1.00 28.15 O ATOM 255 CB ILE A 652 17.094 6.598 -6.303 1.00 33.81 C ATOM 256 CG1 ILE A 652 17.810 6.750 -7.627 1.00 34.84 C ATOM 257 CG2 ILE A 652 16.183 7.795 -6.047 1.00 32.91 C ATOM 258 CD1 ILE A 652 16.862 6.807 -8.792 1.00 43.98 C ATOM 259 H ILE A 652 19.185 8.206 -5.845 1.00 0.00 H ATOM 260 N PHE A 653 20.225 5.321 -5.571 1.00 25.48 N ATOM 261 CA PHE A 653 21.129 4.200 -5.779 1.00 24.43 C ATOM 262 C PHE A 653 22.178 4.097 -4.682 1.00 25.45 C ATOM 263 O PHE A 653 23.113 3.295 -4.801 1.00 24.77 O ATOM 264 CB PHE A 653 21.806 4.338 -7.137 1.00 23.22 C ATOM 265 CG PHE A 653 20.837 4.397 -8.284 1.00 23.35 C ATOM 266 CD1 PHE A 653 19.996 3.321 -8.553 1.00 22.24 C ATOM 267 CD2 PHE A 653 20.766 5.517 -9.082 1.00 22.84 C ATOM 268 CE1 PHE A 653 19.098 3.371 -9.618 1.00 20.90 C ATOM 269 CE2 PHE A 653 19.869 5.577 -10.145 1.00 25.66 C ATOM 270 CZ PHE A 653 19.044 4.495 -10.416 1.00 20.47 C ATOM 271 H PHE A 653 20.622 6.282 -5.587 1.00 0.00 H ATOM 272 N SER A 654 22.035 4.873 -3.610 1.00 27.32 N ATOM 273 CA SER A 654 23.054 4.919 -2.567 1.00 28.56 C ATOM 274 C SER A 654 23.001 3.708 -1.648 1.00 30.38 C ATOM 275 O SER A 654 24.021 3.345 -1.064 1.00 30.43 O ATOM 276 CB SER A 654 22.896 6.191 -1.731 1.00 32.69 C ATOM 277 OG SER A 654 22.984 7.360 -2.527 1.00 34.01 O ATOM 278 HG SER A 654 23.868 7.389 -2.973 1.00 0.00 H ATOM 279 H SER A 654 21.180 5.458 -3.514 1.00 0.00 H ATOM 280 N GLU A 655 21.837 3.093 -1.499 1.00 30.62 N ATOM 281 CA GLU A 655 21.611 1.964 -0.611 1.00 32.38 C ATOM 282 C GLU A 655 20.810 0.907 -1.350 1.00 31.54 C ATOM 283 O GLU A 655 20.181 1.198 -2.374 1.00 30.01 O ATOM 284 CB GLU A 655 20.861 2.422 0.651 1.00 35.34 C ATOM 285 CG GLU A 655 21.611 3.471 1.453 1.00 42.50 C ATOM 286 CD GLU A 655 20.951 3.778 2.785 1.00 52.44 C ATOM 287 OE1 GLU A 655 19.705 3.844 2.837 1.00 53.19 O ATOM 288 OE2 GLU A 655 21.683 3.947 3.783 1.00 58.29 O ATOM 289 H GLU A 655 21.030 3.441 -2.055 1.00 0.00 H ATOM 290 N PRO A 656 20.811 -0.336 -0.864 1.00 32.76 N ATOM 291 CA PRO A 656 20.009 -1.378 -1.517 1.00 32.38 C ATOM 292 C PRO A 656 18.548 -0.970 -1.650 1.00 33.98 C ATOM 293 O PRO A 656 17.988 -0.308 -0.772 1.00 35.05 O ATOM 294 CB PRO A 656 20.171 -2.583 -0.583 1.00 35.04 C ATOM 295 CG PRO A 656 21.496 -2.363 0.082 1.00 36.85 C ATOM 296 CD PRO A 656 21.661 -0.878 0.218 1.00 34.60 C ATOM 297 N VAL A 657 17.932 -1.364 -2.763 1.00 31.64 N ATOM 298 CA VAL A 657 16.490 -1.126 -2.901 1.00 36.22 C ATOM 299 C VAL A 657 15.785 -1.745 -1.702 1.00 39.67 C ATOM 300 O VAL A 657 16.008 -2.934 -1.403 1.00 37.37 O ATOM 301 CB VAL A 657 15.963 -1.718 -4.219 1.00 35.63 C ATOM 302 CG1 VAL A 657 14.456 -1.539 -4.322 1.00 37.12 C ATOM 303 CG2 VAL A 657 16.662 -1.072 -5.401 1.00 30.25 C ATOM 304 H VAL A 657 18.465 -1.833 -3.523 1.00 0.00 H ATOM 305 N PRO A 658 14.971 -0.994 -0.958 1.00 42.28 N ATOM 306 CA PRO A 658 14.395 -1.546 0.275 1.00 45.24 C ATOM 307 C PRO A 658 13.320 -2.582 -0.010 1.00 48.16 C ATOM 308 O PRO A 658 12.243 -2.253 -0.522 1.00 44.15 O ATOM 309 CB PRO A 658 13.821 -0.308 0.973 1.00 46.49 C ATOM 310 CG PRO A 658 13.451 0.599 -0.141 1.00 43.91 C ATOM 311 CD PRO A 658 14.501 0.377 -1.223 1.00 40.40 C ATOM 312 N LEU A 659 13.609 -3.843 0.315 1.00 44.78 N ATOM 313 CA LEU A 659 12.638 -4.906 0.088 1.00 46.33 C ATOM 314 C LEU A 659 11.372 -4.707 0.910 1.00 49.87 C ATOM 315 O LEU A 659 10.331 -5.273 0.564 1.00 53.07 O ATOM 316 CB LEU A 659 13.270 -6.264 0.393 1.00 49.45 C ATOM 317 CG LEU A 659 14.563 -6.548 -0.382 1.00 51.79 C ATOM 318 CD1 LEU A 659 15.164 -7.887 0.015 1.00 54.56 C ATOM 319 CD2 LEU A 659 14.324 -6.502 -1.882 1.00 49.69 C ATOM 320 H LEU A 659 14.534 -4.069 0.733 1.00 0.00 H ATOM 321 N SER A 660 11.434 -3.913 1.982 1.00 48.93 N ATOM 322 CA SER A 660 10.228 -3.614 2.747 1.00 55.96 C ATOM 323 C SER A 660 9.212 -2.878 1.888 1.00 55.48 C ATOM 324 O SER A 660 8.004 -3.126 1.989 1.00 56.28 O ATOM 325 CB SER A 660 10.574 -2.783 3.984 1.00 58.42 C ATOM 326 OG SER A 660 11.028 -1.487 3.618 1.00 57.00 O ATOM 327 HG SER A 660 11.244 -0.972 4.435 1.00 0.00 H ATOM 328 H SER A 660 12.346 -3.506 2.273 1.00 0.00 H ATOM 329 N GLU A 661 9.686 -1.968 1.037 1.00 49.91 N ATOM 330 CA GLU A 661 8.819 -1.183 0.172 1.00 52.34 C ATOM 331 C GLU A 661 8.670 -1.779 -1.219 1.00 51.51 C ATOM 332 O GLU A 661 7.726 -1.423 -1.933 1.00 48.61 O ATOM 333 CB GLU A 661 9.351 0.247 0.061 1.00 54.33 C ATOM 334 CG GLU A 661 9.488 0.944 1.404 1.00 67.10 C ATOM 335 CD GLU A 661 10.293 2.227 1.315 1.00 77.12 C ATOM 336 OE1 GLU A 661 9.916 3.120 0.523 1.00 79.66 O ATOM 337 OE2 GLU A 661 11.310 2.337 2.034 1.00 81.19 O ATOM 338 H GLU A 661 10.713 -1.814 0.990 1.00 0.00 H ATOM 339 N VAL A 662 9.578 -2.664 -1.620 1.00 55.35 N ATOM 340 CA VAL A 662 9.519 -3.327 -2.921 1.00 48.77 C ATOM 341 C VAL A 662 9.628 -4.831 -2.689 1.00 46.89 C ATOM 342 O VAL A 662 10.644 -5.440 -3.052 1.00 41.45 O ATOM 343 CB VAL A 662 10.635 -2.820 -3.851 1.00 43.99 C ATOM 344 CG1 VAL A 662 10.398 -3.282 -5.270 1.00 42.09 C ATOM 345 CG2 VAL A 662 10.739 -1.305 -3.801 1.00 40.29 C ATOM 346 H VAL A 662 10.364 -2.894 -0.980 1.00 0.00 H ATOM 347 N PRO A 663 8.616 -5.475 -2.095 1.00 47.89 N ATOM 348 CA PRO A 663 8.801 -6.860 -1.622 1.00 46.64 C ATOM 349 C PRO A 663 8.956 -7.897 -2.727 1.00 45.10 C ATOM 350 O PRO A 663 9.388 -9.017 -2.427 1.00 48.17 O ATOM 351 CB PRO A 663 7.538 -7.119 -0.788 1.00 50.05 C ATOM 352 CG PRO A 663 6.531 -6.177 -1.331 1.00 49.18 C ATOM 353 CD PRO A 663 7.282 -4.949 -1.756 1.00 49.27 C ATOM 354 N ASP A 664 8.633 -7.581 -3.979 1.00 43.47 N ATOM 355 CA ASP A 664 8.806 -8.527 -5.077 1.00 43.57 C ATOM 356 C ASP A 664 10.081 -8.276 -5.870 1.00 43.32 C ATOM 357 O ASP A 664 10.297 -8.913 -6.907 1.00 44.58 O ATOM 358 CB ASP A 664 7.593 -8.483 -6.009 1.00 45.92 C ATOM 359 CG ASP A 664 7.556 -7.238 -6.877 1.00 49.02 C ATOM 360 OD1 ASP A 664 8.177 -6.211 -6.517 1.00 44.30 O ATOM 361 OD2 ASP A 664 6.888 -7.292 -7.930 1.00 51.45 O ATOM 362 H ASP A 664 8.248 -6.636 -4.180 1.00 0.00 H ATOM 363 N TYR A 665 10.929 -7.365 -5.394 1.00 39.64 N ATOM 364 CA TYR A 665 12.093 -6.931 -6.160 1.00 34.73 C ATOM 365 C TYR A 665 12.987 -8.099 -6.562 1.00 38.52 C ATOM 366 O TYR A 665 13.525 -8.124 -7.674 1.00 38.03 O ATOM 367 CB TYR A 665 12.873 -5.909 -5.343 1.00 34.26 C ATOM 368 CG TYR A 665 14.007 -5.262 -6.098 1.00 33.56 C ATOM 369 CD1 TYR A 665 13.760 -4.290 -7.057 1.00 31.86 C ATOM 370 CD2 TYR A 665 15.328 -5.623 -5.848 1.00 34.81 C ATOM 371 CE1 TYR A 665 14.804 -3.692 -7.752 1.00 29.55 C ATOM 372 CE2 TYR A 665 16.375 -5.028 -6.531 1.00 31.19 C ATOM 373 CZ TYR A 665 16.104 -4.067 -7.484 1.00 28.86 C ATOM 374 OH TYR A 665 17.131 -3.460 -8.174 1.00 25.62 O ATOM 375 HH TYR A 665 16.755 -2.803 -8.812 1.00 0.00 H ATOM 376 H TYR A 665 10.757 -6.954 -4.454 1.00 0.00 H ATOM 377 N LEU A 666 13.143 -9.088 -5.686 1.00 41.20 N ATOM 378 CA LEU A 666 14.053 -10.190 -5.970 1.00 42.19 C ATOM 379 C LEU A 666 13.453 -11.252 -6.884 1.00 46.08 C ATOM 380 O LEU A 666 14.116 -12.262 -7.141 1.00 42.31 O ATOM 381 CB LEU A 666 14.517 -10.839 -4.662 1.00 40.09 C ATOM 382 CG LEU A 666 15.622 -10.069 -3.943 1.00 48.25 C ATOM 383 CD1 LEU A 666 15.836 -10.597 -2.531 1.00 54.67 C ATOM 384 CD2 LEU A 666 16.902 -10.172 -4.746 1.00 49.63 C ATOM 385 H LEU A 666 12.612 -9.075 -4.792 1.00 0.00 H ATOM 386 N ASP A 667 12.230 -11.055 -7.383 1.00 46.31 N ATOM 387 CA ASP A 667 11.611 -12.071 -8.232 1.00 44.03 C ATOM 388 C ASP A 667 12.392 -12.265 -9.523 1.00 43.02 C ATOM 389 O ASP A 667 12.581 -13.399 -9.979 1.00 44.20 O ATOM 390 CB ASP A 667 10.167 -11.687 -8.546 1.00 53.76 C ATOM 391 CG ASP A 667 9.200 -12.131 -7.474 1.00 62.63 C ATOM 392 OD1 ASP A 667 9.662 -12.526 -6.380 1.00 66.68 O ATOM 393 OD2 ASP A 667 7.975 -12.082 -7.731 1.00 64.50 O ATOM 394 H ASP A 667 11.717 -10.177 -7.167 1.00 0.00 H ATOM 395 N HIS A 668 12.852 -11.169 -10.129 1.00 37.63 N ATOM 396 CA HIS A 668 13.633 -11.230 -11.356 1.00 42.58 C ATOM 397 C HIS A 668 14.924 -10.428 -11.296 1.00 39.73 C ATOM 398 O HIS A 668 15.629 -10.352 -12.310 1.00 45.12 O ATOM 399 CB HIS A 668 12.800 -10.745 -12.557 1.00 46.21 C ATOM 400 CG HIS A 668 11.689 -11.673 -12.933 1.00 57.31 C ATOM 401 ND1 HIS A 668 10.441 -11.613 -12.350 1.00 61.95 N ATOM 402 CD2 HIS A 668 11.641 -12.694 -13.822 1.00 59.51 C ATOM 403 CE1 HIS A 668 9.669 -12.553 -12.869 1.00 62.45 C ATOM 404 NE2 HIS A 668 10.373 -13.222 -13.765 1.00 63.07 N ATOM 405 H HIS A 668 12.646 -10.240 -9.711 1.00 0.00 H ATOM 406 N ILE A 669 15.247 -9.815 -10.162 1.00 40.07 N ATOM 407 CA ILE A 669 16.534 -9.153 -9.972 1.00 35.08 C ATOM 408 C ILE A 669 17.415 -10.139 -9.220 1.00 37.15 C ATOM 409 O ILE A 669 17.274 -10.316 -8.008 1.00 38.36 O ATOM 410 CB ILE A 669 16.409 -7.828 -9.217 1.00 33.28 C ATOM 411 CG1 ILE A 669 15.452 -6.883 -9.943 1.00 34.64 C ATOM 412 CG2 ILE A 669 17.789 -7.195 -9.064 1.00 28.95 C ATOM 413 CD1 ILE A 669 15.794 -6.672 -11.397 1.00 32.93 C ATOM 414 H ILE A 669 14.559 -9.807 -9.382 1.00 0.00 H ATOM 415 N LYS A 670 18.331 -10.780 -9.935 1.00 33.43 N ATOM 416 CA LYS A 670 19.094 -11.862 -9.325 1.00 38.16 C ATOM 417 C LYS A 670 20.318 -11.372 -8.566 1.00 36.78 C ATOM 418 O LYS A 670 20.792 -12.071 -7.661 1.00 39.72 O ATOM 419 CB LYS A 670 19.518 -12.885 -10.388 1.00 44.13 C ATOM 420 CG LYS A 670 20.371 -12.314 -11.508 1.00 42.45 C ATOM 421 H LYS A 670 18.504 -10.512 -10.925 1.00 0.00 H ATOM 422 N LYS A 671 20.851 -10.197 -8.905 1.00 34.70 N ATOM 423 CA LYS A 671 21.974 -9.622 -8.169 1.00 32.88 C ATOM 424 C LYS A 671 21.719 -8.142 -7.930 1.00 27.59 C ATOM 425 O LYS A 671 22.134 -7.299 -8.729 1.00 25.63 O ATOM 426 CB LYS A 671 23.298 -9.810 -8.899 1.00 30.87 C ATOM 427 CG LYS A 671 24.483 -9.364 -8.044 1.00 37.35 C ATOM 428 CD LYS A 671 25.833 -9.693 -8.674 1.00 41.60 C ATOM 429 CE LYS A 671 26.975 -9.148 -7.820 1.00 48.09 C ATOM 430 NZ LYS A 671 28.300 -9.199 -8.512 1.00 50.71 N ATOM 431 HZ1 LYS A 671 28.527 -10.185 -8.751 1.00 0.00 H ATOM 432 HZ2 LYS A 671 28.257 -8.631 -9.382 1.00 0.00 H ATOM 433 HZ3 LYS A 671 29.034 -8.816 -7.882 1.00 0.00 H ATOM 434 H LYS A 671 20.457 -9.677 -9.715 1.00 0.00 H ATOM 435 N PRO A 672 21.066 -7.795 -6.826 1.00 29.36 N ATOM 436 CA PRO A 672 20.915 -6.382 -6.481 1.00 27.69 C ATOM 437 C PRO A 672 22.276 -5.731 -6.310 1.00 26.72 C ATOM 438 O PRO A 672 23.258 -6.381 -5.943 1.00 29.09 O ATOM 439 CB PRO A 672 20.140 -6.418 -5.157 1.00 34.43 C ATOM 440 CG PRO A 672 19.587 -7.806 -5.055 1.00 38.98 C ATOM 441 CD PRO A 672 20.545 -8.686 -5.781 1.00 31.42 C ATOM 442 N MET A 673 22.333 -4.429 -6.599 1.00 25.23 N ATOM 443 CA MET A 673 23.569 -3.678 -6.432 1.00 24.47 C ATOM 444 C MET A 673 23.223 -2.223 -6.145 1.00 24.05 C ATOM 445 O MET A 673 22.152 -1.736 -6.522 1.00 23.73 O ATOM 446 CB MET A 673 24.476 -3.797 -7.666 1.00 22.90 C ATOM 447 CG MET A 673 25.887 -3.245 -7.503 1.00 22.43 C ATOM 448 SD MET A 673 26.788 -3.789 -6.033 1.00 24.30 S ATOM 449 CE MET A 673 26.621 -5.575 -6.176 1.00 25.61 C ATOM 450 H MET A 673 21.482 -3.944 -6.949 1.00 0.00 H ATOM 451 N ASP A 674 24.139 -1.556 -5.450 1.00 24.33 N ATOM 452 CA ASP A 674 23.984 -0.184 -4.991 1.00 25.76 C ATOM 453 C ASP A 674 25.362 0.346 -4.622 1.00 24.47 C ATOM 454 O ASP A 674 26.314 -0.412 -4.456 1.00 24.69 O ATOM 455 CB ASP A 674 23.055 -0.110 -3.784 1.00 26.56 C ATOM 456 CG ASP A 674 23.650 -0.789 -2.588 1.00 28.45 C ATOM 457 OD1 ASP A 674 23.459 -2.017 -2.438 1.00 29.31 O ATOM 458 OD2 ASP A 674 24.355 -0.109 -1.821 1.00 29.48 O ATOM 459 H ASP A 674 25.026 -2.048 -5.219 1.00 0.00 H ATOM 460 N PHE A 675 25.448 1.666 -4.443 1.00 24.50 N ATOM 461 CA PHE A 675 26.751 2.287 -4.212 1.00 25.14 C ATOM 462 C PHE A 675 27.323 1.962 -2.840 1.00 26.42 C ATOM 463 O PHE A 675 28.550 1.954 -2.676 1.00 26.47 O ATOM 464 CB PHE A 675 26.649 3.801 -4.358 1.00 24.46 C ATOM 465 CG PHE A 675 26.502 4.268 -5.777 1.00 22.75 C ATOM 466 CD1 PHE A 675 27.329 3.788 -6.767 1.00 21.40 C ATOM 467 CD2 PHE A 675 25.539 5.205 -6.119 1.00 22.80 C ATOM 468 CE1 PHE A 675 27.207 4.235 -8.084 1.00 20.25 C ATOM 469 CE2 PHE A 675 25.409 5.641 -7.421 1.00 21.54 C ATOM 470 CZ PHE A 675 26.237 5.168 -8.407 1.00 20.27 C ATOM 471 H PHE A 675 24.589 2.252 -4.468 1.00 0.00 H ATOM 472 N PHE A 676 26.469 1.750 -1.837 1.00 28.23 N ATOM 473 CA PHE A 676 26.988 1.354 -0.532 1.00 30.42 C ATOM 474 C PHE A 676 27.623 -0.022 -0.606 1.00 30.41 C ATOM 475 O PHE A 676 28.717 -0.232 -0.075 1.00 31.22 O ATOM 476 CB PHE A 676 25.882 1.373 0.524 1.00 32.74 C ATOM 477 CG PHE A 676 26.351 1.003 1.898 1.00 37.26 C ATOM 478 CD1 PHE A 676 27.026 1.924 2.686 1.00 39.12 C ATOM 479 CD2 PHE A 676 26.114 -0.265 2.406 1.00 39.59 C ATOM 480 CE1 PHE A 676 27.458 1.587 3.961 1.00 44.59 C ATOM 481 CE2 PHE A 676 26.548 -0.611 3.682 1.00 40.35 C ATOM 482 CZ PHE A 676 27.220 0.320 4.457 1.00 43.01 C ATOM 483 H PHE A 676 25.446 1.866 -1.984 1.00 0.00 H ATOM 484 N THR A 677 26.959 -0.968 -1.272 1.00 29.71 N ATOM 485 CA THR A 677 27.573 -2.279 -1.477 1.00 29.83 C ATOM 486 C THR A 677 28.871 -2.155 -2.271 1.00 28.25 C ATOM 487 O THR A 677 29.865 -2.818 -1.956 1.00 29.04 O ATOM 488 CB THR A 677 26.588 -3.219 -2.176 1.00 29.44 C ATOM 489 OG1 THR A 677 25.412 -3.362 -1.367 1.00 31.25 O ATOM 490 CG2 THR A 677 27.211 -4.604 -2.387 1.00 29.97 C ATOM 491 HG1 THR A 677 25.662 -3.739 -0.487 1.00 0.00 H ATOM 492 H THR A 677 26.008 -0.774 -1.644 1.00 0.00 H ATOM 493 N MET A 678 28.895 -1.288 -3.291 1.00 26.28 N ATOM 494 CA MET A 678 30.126 -1.112 -4.059 1.00 25.07 C ATOM 495 C MET A 678 31.254 -0.593 -3.180 1.00 26.10 C ATOM 496 O MET A 678 32.406 -1.019 -3.315 1.00 26.14 O ATOM 497 CB MET A 678 29.896 -0.164 -5.239 1.00 23.23 C ATOM 498 CG MET A 678 29.058 -0.755 -6.346 1.00 22.15 C ATOM 499 SD MET A 678 29.085 0.283 -7.820 1.00 20.36 S ATOM 500 CE MET A 678 30.810 0.150 -8.282 1.00 20.10 C ATOM 501 H MET A 678 28.043 -0.743 -3.535 1.00 0.00 H ATOM 502 N LYS A 679 30.945 0.338 -2.279 1.00 27.15 N ATOM 503 CA LYS A 679 31.966 0.845 -1.371 1.00 28.48 C ATOM 504 C LYS A 679 32.500 -0.273 -0.483 1.00 30.25 C ATOM 505 O LYS A 679 33.716 -0.394 -0.282 1.00 30.71 O ATOM 506 CB LYS A 679 31.397 1.983 -0.527 1.00 29.75 C ATOM 507 CG LYS A 679 32.370 2.555 0.483 1.00 31.76 C ATOM 508 CD LYS A 679 33.547 3.237 -0.184 1.00 35.28 C ATOM 509 CE LYS A 679 34.407 3.934 0.860 1.00 48.05 C ATOM 510 NZ LYS A 679 35.454 4.796 0.246 1.00 53.94 N ATOM 511 HZ1 LYS A 679 36.077 4.213 -0.348 1.00 0.00 H ATOM 512 HZ2 LYS A 679 35.001 5.527 -0.339 1.00 0.00 H ATOM 513 HZ3 LYS A 679 36.013 5.249 0.997 1.00 0.00 H ATOM 514 H LYS A 679 29.973 0.704 -2.223 1.00 0.00 H ATOM 515 N GLN A 680 31.609 -1.119 0.040 1.00 31.47 N ATOM 516 CA GLN A 680 32.068 -2.234 0.860 1.00 33.51 C ATOM 517 C GLN A 680 32.905 -3.208 0.039 1.00 32.62 C ATOM 518 O GLN A 680 33.905 -3.744 0.533 1.00 33.94 O ATOM 519 CB GLN A 680 30.884 -2.956 1.505 1.00 35.24 C ATOM 520 CG GLN A 680 29.790 -2.052 2.076 1.00 36.01 C ATOM 521 CD GLN A 680 30.319 -0.898 2.915 1.00 37.16 C ATOM 522 OE1 GLN A 680 29.992 0.267 2.663 1.00 37.62 O ATOM 523 NE2 GLN A 680 31.121 -1.215 3.921 1.00 39.40 N ATOM 524 HE22 GLN A 680 31.369 -2.210 4.095 1.00 0.00 H ATOM 525 HE21 GLN A 680 31.503 -0.469 4.537 1.00 0.00 H ATOM 526 H GLN A 680 30.593 -0.983 -0.137 1.00 0.00 H ATOM 527 N ASN A 681 32.518 -3.448 -1.219 1.00 30.62 N ATOM 528 CA ASN A 681 33.311 -4.329 -2.070 1.00 30.00 C ATOM 529 C ASN A 681 34.681 -3.730 -2.346 1.00 29.36 C ATOM 530 O ASN A 681 35.697 -4.433 -2.289 1.00 30.20 O ATOM 531 CB ASN A 681 32.579 -4.610 -3.383 1.00 28.24 C ATOM 532 CG ASN A 681 31.370 -5.503 -3.199 1.00 29.75 C ATOM 533 OD1 ASN A 681 31.246 -6.206 -2.192 1.00 35.00 O ATOM 534 ND2 ASN A 681 30.474 -5.490 -4.174 1.00 27.80 N ATOM 535 HD22 ASN A 681 30.619 -4.882 -5.005 1.00 0.00 H ATOM 536 HD21 ASN A 681 29.626 -6.088 -4.109 1.00 0.00 H ATOM 537 H ASN A 681 31.652 -3.007 -1.590 1.00 0.00 H ATOM 538 N LEU A 682 34.726 -2.424 -2.629 1.00 28.12 N ATOM 539 CA LEU A 682 35.995 -1.746 -2.869 1.00 27.74 C ATOM 540 C LEU A 682 36.950 -1.940 -1.697 1.00 29.77 C ATOM 541 O LEU A 682 38.090 -2.389 -1.875 1.00 30.14 O ATOM 542 CB LEU A 682 35.737 -0.254 -3.124 1.00 26.73 C ATOM 543 CG LEU A 682 36.811 0.647 -3.740 1.00 26.03 C ATOM 544 CD1 LEU A 682 36.190 1.976 -4.175 1.00 25.14 C ATOM 545 CD2 LEU A 682 37.935 0.936 -2.780 1.00 27.88 C ATOM 546 H LEU A 682 33.840 -1.882 -2.679 1.00 0.00 H ATOM 547 N GLU A 683 36.499 -1.608 -0.488 1.00 31.35 N ATOM 548 CA GLU A 683 37.387 -1.675 0.666 1.00 33.56 C ATOM 549 C GLU A 683 37.736 -3.105 1.038 1.00 35.13 C ATOM 550 O GLU A 683 38.721 -3.327 1.755 1.00 36.88 O ATOM 551 CB GLU A 683 36.756 -0.958 1.855 1.00 37.82 C ATOM 552 CG GLU A 683 36.445 0.502 1.585 1.00 38.82 C ATOM 553 CD GLU A 683 37.681 1.316 1.235 1.00 41.56 C ATOM 554 OE1 GLU A 683 38.804 0.890 1.589 1.00 41.14 O ATOM 555 OE2 GLU A 683 37.533 2.381 0.600 1.00 38.06 O ATOM 556 H GLU A 683 35.513 -1.301 -0.368 1.00 0.00 H ATOM 557 N ALA A 684 36.950 -4.072 0.579 1.00 34.80 N ATOM 558 CA ALA A 684 37.255 -5.482 0.771 1.00 36.42 C ATOM 559 C ALA A 684 38.180 -6.026 -0.307 1.00 35.41 C ATOM 560 O ALA A 684 38.386 -7.245 -0.372 1.00 36.68 O ATOM 561 CB ALA A 684 35.965 -6.301 0.808 1.00 36.99 C ATOM 562 H ALA A 684 36.085 -3.812 0.064 1.00 0.00 H ATOM 563 N TYR A 685 38.734 -5.151 -1.151 1.00 33.46 N ATOM 564 CA TYR A 685 39.661 -5.546 -2.210 1.00 32.70 C ATOM 565 C TYR A 685 38.997 -6.473 -3.219 1.00 33.45 C ATOM 566 O TYR A 685 39.635 -7.385 -3.754 1.00 39.74 O ATOM 567 CB TYR A 685 40.924 -6.200 -1.625 1.00 34.77 C ATOM 568 CG TYR A 685 41.682 -5.279 -0.707 1.00 42.45 C ATOM 569 CD1 TYR A 685 42.569 -4.345 -1.219 1.00 44.91 C ATOM 570 CD2 TYR A 685 41.500 -5.325 0.672 1.00 52.22 C ATOM 571 CE1 TYR A 685 43.262 -3.487 -0.391 1.00 51.66 C ATOM 572 CE2 TYR A 685 42.192 -4.462 1.513 1.00 56.03 C ATOM 573 CZ TYR A 685 43.071 -3.542 0.969 1.00 56.61 C ATOM 574 OH TYR A 685 43.774 -2.672 1.772 1.00 60.88 O ATOM 575 HH TYR A 685 44.347 -2.095 1.208 1.00 0.00 H ATOM 576 H TYR A 685 38.495 -4.144 -1.050 1.00 0.00 H ATOM 577 N ARG A 686 37.710 -6.271 -3.471 1.00 30.92 N ATOM 578 CA ARG A 686 37.012 -7.076 -4.458 1.00 30.32 C ATOM 579 C ARG A 686 37.091 -6.504 -5.859 1.00 28.45 C ATOM 580 O ARG A 686 36.676 -7.184 -6.801 1.00 31.25 O ATOM 581 CB ARG A 686 35.542 -7.247 -4.083 1.00 32.48 C ATOM 582 CG ARG A 686 35.338 -7.924 -2.767 1.00 40.25 C ATOM 583 CD ARG A 686 34.118 -8.810 -2.820 1.00 52.25 C ATOM 584 NE ARG A 686 34.128 -9.745 -1.707 1.00 65.22 N ATOM 585 CZ ARG A 686 33.751 -9.428 -0.476 1.00 68.35 C ATOM 586 NH1 ARG A 686 33.327 -8.196 -0.214 1.00 65.08 N ATOM 587 NH2 ARG A 686 33.797 -10.341 0.487 1.00 72.47 N ATOM 588 HE ARG A 686 34.449 -10.718 -1.886 1.00 0.00 H ATOM 589 HH12 ARG A 686 33.030 -7.942 0.750 1.00 0.00 H ATOM 590 HH11 ARG A 686 33.292 -7.486 -0.973 1.00 0.00 H ATOM 591 HH22 ARG A 686 33.502 -10.093 1.453 1.00 0.00 H ATOM 592 HH21 ARG A 686 34.129 -11.304 0.275 1.00 0.00 H ATOM 593 H ARG A 686 37.195 -5.528 -2.956 1.00 0.00 H ATOM 594 N TYR A 687 37.565 -5.261 -6.014 1.00 27.07 N ATOM 595 CA TYR A 687 37.733 -4.617 -7.314 1.00 25.45 C ATOM 596 C TYR A 687 39.225 -4.426 -7.531 1.00 25.89 C ATOM 597 O TYR A 687 39.815 -3.469 -7.020 1.00 25.91 O ATOM 598 CB TYR A 687 37.022 -3.261 -7.380 1.00 24.08 C ATOM 599 CG TYR A 687 35.536 -3.300 -7.156 1.00 23.71 C ATOM 600 CD1 TYR A 687 34.745 -4.271 -7.748 1.00 24.66 C ATOM 601 CD2 TYR A 687 34.918 -2.348 -6.344 1.00 23.90 C ATOM 602 CE1 TYR A 687 33.378 -4.298 -7.546 1.00 23.44 C ATOM 603 CE2 TYR A 687 33.565 -2.369 -6.129 1.00 23.57 C ATOM 604 CZ TYR A 687 32.797 -3.339 -6.731 1.00 23.39 C ATOM 605 OH TYR A 687 31.450 -3.364 -6.513 1.00 23.42 O ATOM 606 HH TYR A 687 31.050 -4.117 -7.015 1.00 0.00 H ATOM 607 H TYR A 687 37.828 -4.725 -5.162 1.00 0.00 H ATOM 608 N LEU A 688 39.839 -5.347 -8.274 1.00 26.50 N ATOM 609 CA LEU A 688 41.256 -5.268 -8.594 1.00 27.15 C ATOM 610 C LEU A 688 41.493 -4.914 -10.053 1.00 26.35 C ATOM 611 O LEU A 688 42.637 -4.916 -10.509 1.00 27.01 O ATOM 612 CB LEU A 688 41.939 -6.592 -8.242 1.00 29.12 C ATOM 613 CG LEU A 688 41.699 -6.988 -6.791 1.00 30.40 C ATOM 614 CD1 LEU A 688 42.307 -8.366 -6.499 1.00 32.67 C ATOM 615 CD2 LEU A 688 42.268 -5.928 -5.853 1.00 34.15 C ATOM 616 H LEU A 688 39.286 -6.149 -8.637 1.00 0.00 H ATOM 617 N ASN A 689 40.437 -4.613 -10.801 1.00 25.01 N ATOM 618 CA ASN A 689 40.593 -4.099 -12.146 1.00 24.38 C ATOM 619 C ASN A 689 39.401 -3.210 -12.419 1.00 22.89 C ATOM 620 O ASN A 689 38.381 -3.262 -11.721 1.00 22.42 O ATOM 621 CB ASN A 689 40.698 -5.211 -13.204 1.00 25.23 C ATOM 622 CG ASN A 689 39.600 -6.222 -13.087 1.00 25.37 C ATOM 623 OD1 ASN A 689 38.451 -5.935 -13.407 1.00 24.29 O ATOM 624 ND2 ASN A 689 39.943 -7.432 -12.638 1.00 26.95 N ATOM 625 HD22 ASN A 689 40.930 -7.630 -12.378 1.00 0.00 H ATOM 626 HD21 ASN A 689 39.223 -8.177 -12.548 1.00 0.00 H ATOM 627 H ASN A 689 39.481 -4.749 -10.414 1.00 0.00 H ATOM 628 N PHE A 690 39.549 -2.367 -13.431 1.00 22.38 N ATOM 629 CA PHE A 690 38.494 -1.412 -13.703 1.00 21.21 C ATOM 630 C PHE A 690 37.208 -2.103 -14.134 1.00 20.72 C ATOM 631 O PHE A 690 36.114 -1.673 -13.763 1.00 20.64 O ATOM 632 CB PHE A 690 38.948 -0.416 -14.757 1.00 25.91 C ATOM 633 CG PHE A 690 38.222 0.877 -14.670 1.00 21.65 C ATOM 634 CD1 PHE A 690 38.648 1.855 -13.795 1.00 22.02 C ATOM 635 CD2 PHE A 690 37.073 1.086 -15.414 1.00 28.73 C ATOM 636 CE1 PHE A 690 37.967 3.046 -13.684 1.00 29.02 C ATOM 637 CE2 PHE A 690 36.385 2.270 -15.313 1.00 29.25 C ATOM 638 CZ PHE A 690 36.831 3.249 -14.444 1.00 26.17 C ATOM 639 H PHE A 690 40.407 -2.391 -14.019 1.00 0.00 H ATOM 640 N ASP A 691 37.308 -3.175 -14.918 1.00 21.40 N ATOM 641 CA ASP A 691 36.097 -3.774 -15.458 1.00 21.13 C ATOM 642 C ASP A 691 35.212 -4.356 -14.362 1.00 21.04 C ATOM 643 O ASP A 691 33.980 -4.305 -14.466 1.00 21.71 O ATOM 644 CB ASP A 691 36.463 -4.831 -16.496 1.00 22.31 C ATOM 645 CG ASP A 691 36.907 -4.224 -17.804 1.00 30.54 C ATOM 646 OD1 ASP A 691 36.196 -3.337 -18.310 1.00 34.24 O ATOM 647 OD2 ASP A 691 37.947 -4.657 -18.340 1.00 46.43 O ATOM 648 H ASP A 691 38.240 -3.579 -15.141 1.00 0.00 H ATOM 649 N ASP A 692 35.804 -4.907 -13.297 1.00 21.88 N ATOM 650 CA ASP A 692 34.956 -5.457 -12.246 1.00 22.19 C ATOM 651 C ASP A 692 34.203 -4.361 -11.514 1.00 21.37 C ATOM 652 O ASP A 692 33.055 -4.560 -11.106 1.00 22.00 O ATOM 653 CB ASP A 692 35.771 -6.269 -11.263 1.00 23.65 C ATOM 654 CG ASP A 692 36.107 -7.618 -11.811 1.00 25.06 C ATOM 655 OD1 ASP A 692 35.472 -8.027 -12.818 1.00 26.28 O ATOM 656 OD2 ASP A 692 36.994 -8.249 -11.224 1.00 26.46 O ATOM 657 H ASP A 692 36.841 -4.942 -13.220 1.00 0.00 H ATOM 658 N PHE A 693 34.844 -3.209 -11.333 1.00 20.74 N ATOM 659 CA PHE A 693 34.180 -2.060 -10.725 1.00 20.11 C ATOM 660 C PHE A 693 33.055 -1.569 -11.624 1.00 20.12 C ATOM 661 O PHE A 693 31.908 -1.399 -11.186 1.00 18.91 O ATOM 662 CB PHE A 693 35.230 -0.971 -10.505 1.00 20.14 C ATOM 663 CG PHE A 693 34.700 0.343 -9.989 1.00 19.81 C ATOM 664 CD1 PHE A 693 34.557 0.565 -8.629 1.00 20.57 C ATOM 665 CD2 PHE A 693 34.434 1.368 -10.871 1.00 19.11 C ATOM 666 CE1 PHE A 693 34.106 1.804 -8.155 1.00 20.62 C ATOM 667 CE2 PHE A 693 33.966 2.609 -10.407 1.00 19.56 C ATOM 668 CZ PHE A 693 33.821 2.819 -9.060 1.00 19.89 C ATOM 669 H PHE A 693 35.837 -3.126 -11.630 1.00 0.00 H ATOM 670 N GLU A 694 33.367 -1.382 -12.906 1.00 18.92 N ATOM 671 CA GLU A 694 32.377 -0.892 -13.856 1.00 19.70 C ATOM 672 C GLU A 694 31.219 -1.876 -14.028 1.00 21.12 C ATOM 673 O GLU A 694 30.068 -1.455 -14.219 1.00 20.25 O ATOM 674 CB GLU A 694 33.075 -0.588 -15.185 1.00 18.07 C ATOM 675 CG GLU A 694 32.168 -0.138 -16.319 1.00 25.81 C ATOM 676 CD GLU A 694 32.956 0.344 -17.527 1.00 39.02 C ATOM 677 OE1 GLU A 694 33.896 1.143 -17.349 1.00 37.75 O ATOM 678 OE2 GLU A 694 32.646 -0.088 -18.654 1.00 50.82 O ATOM 679 H GLU A 694 34.332 -1.589 -13.233 1.00 0.00 H ATOM 680 N GLU A 695 31.485 -3.181 -13.929 1.00 18.84 N ATOM 681 CA GLU A 695 30.411 -4.160 -14.060 1.00 19.20 C ATOM 682 C GLU A 695 29.351 -3.973 -12.971 1.00 22.04 C ATOM 683 O GLU A 695 28.148 -4.085 -13.245 1.00 21.07 O ATOM 684 CB GLU A 695 31.007 -5.570 -14.043 1.00 23.88 C ATOM 685 CG GLU A 695 30.028 -6.708 -13.849 1.00 32.61 C ATOM 686 CD GLU A 695 30.738 -8.065 -13.806 1.00 43.43 C ATOM 687 OE1 GLU A 695 31.170 -8.546 -14.878 1.00 46.39 O ATOM 688 OE2 GLU A 695 30.879 -8.634 -12.698 1.00 43.55 O ATOM 689 H GLU A 695 32.460 -3.500 -13.758 1.00 0.00 H ATOM 690 N ASP A 696 29.773 -3.660 -11.735 1.00 19.48 N ATOM 691 CA ASP A 696 28.796 -3.500 -10.660 1.00 21.02 C ATOM 692 C ASP A 696 28.047 -2.191 -10.801 1.00 20.05 C ATOM 693 O ASP A 696 26.861 -2.125 -10.462 1.00 19.15 O ATOM 694 CB ASP A 696 29.463 -3.591 -9.283 1.00 21.96 C ATOM 695 CG ASP A 696 29.501 -5.018 -8.749 1.00 26.23 C ATOM 696 OD1 ASP A 696 28.796 -5.876 -9.317 1.00 24.53 O ATOM 697 OD2 ASP A 696 30.210 -5.276 -7.757 1.00 26.51 O ATOM 698 H ASP A 696 30.787 -3.532 -11.544 1.00 0.00 H ATOM 699 N PHE A 697 28.709 -1.151 -11.311 1.00 18.24 N ATOM 700 CA PHE A 697 27.986 0.071 -11.660 1.00 17.64 C ATOM 701 C PHE A 697 26.930 -0.217 -12.719 1.00 17.94 C ATOM 702 O PHE A 697 25.781 0.213 -12.604 1.00 17.18 O ATOM 703 CB PHE A 697 28.940 1.146 -12.172 1.00 17.28 C ATOM 704 CG PHE A 697 28.223 2.314 -12.802 1.00 16.92 C ATOM 705 CD1 PHE A 697 27.595 3.251 -12.005 1.00 18.95 C ATOM 706 CD2 PHE A 697 28.130 2.426 -14.174 1.00 16.53 C ATOM 707 CE1 PHE A 697 26.909 4.308 -12.580 1.00 19.99 C ATOM 708 CE2 PHE A 697 27.444 3.480 -14.757 1.00 16.49 C ATOM 709 CZ PHE A 697 26.842 4.416 -13.951 1.00 16.82 C ATOM 710 H PHE A 697 29.737 -1.209 -11.460 1.00 0.00 H ATOM 711 N ASN A 698 27.312 -0.940 -13.773 1.00 18.12 N ATOM 712 CA ASN A 698 26.345 -1.289 -14.809 1.00 17.75 C ATOM 713 C ASN A 698 25.171 -2.079 -14.251 1.00 20.80 C ATOM 714 O ASN A 698 24.060 -1.983 -14.781 1.00 19.32 O ATOM 715 CB ASN A 698 27.026 -2.095 -15.920 1.00 19.23 C ATOM 716 CG ASN A 698 27.986 -1.248 -16.742 1.00 19.18 C ATOM 717 OD1 ASN A 698 27.888 -0.028 -16.764 1.00 20.34 O ATOM 718 ND2 ASN A 698 28.920 -1.911 -17.439 1.00 21.83 N ATOM 719 HD22 ASN A 698 28.966 -2.949 -17.390 1.00 0.00 H ATOM 720 HD21 ASN A 698 29.598 -1.387 -18.028 1.00 0.00 H ATOM 721 H ASN A 698 28.300 -1.255 -13.857 1.00 0.00 H ATOM 722 N LEU A 699 25.402 -2.880 -13.204 1.00 18.19 N ATOM 723 CA LEU A 699 24.320 -3.623 -12.567 1.00 19.03 C ATOM 724 C LEU A 699 23.329 -2.681 -11.903 1.00 20.26 C ATOM 725 O LEU A 699 22.117 -2.923 -11.945 1.00 21.48 O ATOM 726 CB LEU A 699 24.882 -4.581 -11.525 1.00 24.31 C ATOM 727 CG LEU A 699 24.868 -6.078 -11.764 1.00 32.65 C ATOM 728 CD1 LEU A 699 25.341 -6.731 -10.470 1.00 26.14 C ATOM 729 CD2 LEU A 699 23.476 -6.557 -12.161 1.00 26.44 C ATOM 730 H LEU A 699 26.371 -2.975 -12.838 1.00 0.00 H ATOM 731 N ILE A 700 23.829 -1.629 -11.245 1.00 18.76 N ATOM 732 CA ILE A 700 22.933 -0.636 -10.658 1.00 18.98 C ATOM 733 C ILE A 700 21.990 -0.114 -11.724 1.00 18.35 C ATOM 734 O ILE A 700 20.771 -0.039 -11.525 1.00 20.81 O ATOM 735 CB ILE A 700 23.734 0.508 -10.017 1.00 18.98 C ATOM 736 CG1 ILE A 700 24.527 0.016 -8.809 1.00 19.95 C ATOM 737 CG2 ILE A 700 22.813 1.653 -9.566 1.00 19.45 C ATOM 738 CD1 ILE A 700 25.390 1.118 -8.199 1.00 20.15 C ATOM 739 H ILE A 700 24.859 -1.518 -11.151 1.00 0.00 H ATOM 740 N VAL A 701 22.549 0.231 -12.883 1.00 17.49 N ATOM 741 CA VAL A 701 21.752 0.759 -13.985 1.00 17.50 C ATOM 742 C VAL A 701 20.810 -0.305 -14.537 1.00 17.70 C ATOM 743 O VAL A 701 19.601 -0.080 -14.664 1.00 17.67 O ATOM 744 CB VAL A 701 22.687 1.313 -15.073 1.00 16.55 C ATOM 745 CG1 VAL A 701 21.919 1.651 -16.325 1.00 16.95 C ATOM 746 CG2 VAL A 701 23.394 2.582 -14.550 1.00 16.55 C ATOM 747 H VAL A 701 23.576 0.122 -13.005 1.00 0.00 H ATOM 748 N SER A 702 21.339 -1.488 -14.866 1.00 17.71 N ATOM 749 CA SER A 702 20.512 -2.471 -15.562 1.00 20.66 C ATOM 750 C SER A 702 19.406 -3.018 -14.665 1.00 19.94 C ATOM 751 O SER A 702 18.299 -3.286 -15.149 1.00 19.90 O ATOM 752 CB SER A 702 21.373 -3.607 -16.107 1.00 21.60 C ATOM 753 OG SER A 702 21.991 -4.320 -15.059 1.00 19.95 O ATOM 754 HG SER A 702 22.542 -5.050 -15.438 1.00 0.00 H ATOM 755 H SER A 702 22.328 -1.706 -14.629 1.00 0.00 H ATOM 756 N ASN A 703 19.678 -3.199 -13.365 1.00 19.51 N ATOM 757 CA ASN A 703 18.618 -3.665 -12.469 1.00 20.73 C ATOM 758 C ASN A 703 17.460 -2.688 -12.459 1.00 20.69 C ATOM 759 O ASN A 703 16.293 -3.092 -12.398 1.00 21.58 O ATOM 760 CB ASN A 703 19.114 -3.811 -11.037 1.00 21.62 C ATOM 761 CG ASN A 703 19.992 -5.009 -10.831 1.00 22.32 C ATOM 762 OD1 ASN A 703 20.018 -5.936 -11.646 1.00 22.72 O ATOM 763 ND2 ASN A 703 20.698 -5.016 -9.704 1.00 23.18 N ATOM 764 HD22 ASN A 703 20.641 -4.210 -9.050 1.00 0.00 H ATOM 765 HD21 ASN A 703 21.307 -5.828 -9.477 1.00 0.00 H ATOM 766 H ASN A 703 20.632 -3.010 -12.997 1.00 0.00 H ATOM 767 N CYS A 704 17.777 -1.393 -12.472 1.00 19.91 N ATOM 768 CA CYS A 704 16.745 -0.364 -12.395 1.00 20.14 C ATOM 769 C CYS A 704 15.962 -0.287 -13.697 1.00 19.77 C ATOM 770 O CYS A 704 14.733 -0.174 -13.678 1.00 20.48 O ATOM 771 CB CYS A 704 17.389 0.976 -12.058 1.00 19.76 C ATOM 772 SG CYS A 704 16.229 2.304 -11.689 1.00 20.60 S ATOM 773 H CYS A 704 18.776 -1.112 -12.538 1.00 0.00 H ATOM 774 N LEU A 705 16.653 -0.351 -14.841 1.00 18.90 N ATOM 775 CA LEU A 705 15.940 -0.410 -16.112 1.00 18.88 C ATOM 776 C LEU A 705 15.059 -1.656 -16.181 1.00 19.75 C ATOM 777 O LEU A 705 13.948 -1.613 -16.725 1.00 20.23 O ATOM 778 CB LEU A 705 16.925 -0.392 -17.282 1.00 18.22 C ATOM 779 CG LEU A 705 17.857 0.815 -17.419 1.00 17.60 C ATOM 780 CD1 LEU A 705 18.855 0.550 -18.540 1.00 17.33 C ATOM 781 CD2 LEU A 705 17.076 2.109 -17.688 1.00 17.83 C ATOM 782 H LEU A 705 17.693 -0.359 -14.824 1.00 0.00 H ATOM 783 N LYS A 706 15.533 -2.773 -15.627 1.00 20.20 N ATOM 784 CA LYS A 706 14.757 -4.010 -15.698 1.00 21.37 C ATOM 785 C LYS A 706 13.506 -3.940 -14.829 1.00 23.48 C ATOM 786 O LYS A 706 12.400 -4.284 -15.280 1.00 23.39 O ATOM 787 CB LYS A 706 15.623 -5.199 -15.278 1.00 21.95 C ATOM 788 CG LYS A 706 14.861 -6.508 -15.333 1.00 23.54 C ATOM 789 CD LYS A 706 15.798 -7.704 -15.212 1.00 31.44 C ATOM 790 CE LYS A 706 15.017 -9.016 -15.328 1.00 36.79 C ATOM 791 NZ LYS A 706 15.915 -10.185 -15.207 1.00 42.44 N ATOM 792 HZ1 LYS A 706 16.627 -10.154 -15.965 1.00 0.00 H ATOM 793 HZ2 LYS A 706 16.390 -10.161 -14.282 1.00 0.00 H ATOM 794 HZ3 LYS A 706 15.357 -11.059 -15.290 1.00 0.00 H ATOM 795 H LYS A 706 16.454 -2.764 -15.145 1.00 0.00 H ATOM 796 N TYR A 707 13.660 -3.505 -13.573 1.00 22.72 N ATOM 797 CA TYR A 707 12.558 -3.609 -12.617 1.00 24.22 C ATOM 798 C TYR A 707 11.447 -2.611 -12.906 1.00 25.72 C ATOM 799 O TYR A 707 10.263 -2.939 -12.760 1.00 27.80 O ATOM 800 CB TYR A 707 13.052 -3.415 -11.185 1.00 24.89 C ATOM 801 CG TYR A 707 11.913 -3.592 -10.218 1.00 26.85 C ATOM 802 CD1 TYR A 707 11.422 -4.866 -9.934 1.00 28.51 C ATOM 803 CD2 TYR A 707 11.286 -2.499 -9.637 1.00 27.37 C ATOM 804 CE1 TYR A 707 10.351 -5.047 -9.082 1.00 34.14 C ATOM 805 CE2 TYR A 707 10.204 -2.678 -8.775 1.00 29.52 C ATOM 806 CZ TYR A 707 9.750 -3.954 -8.507 1.00 35.06 C ATOM 807 OH TYR A 707 8.683 -4.153 -7.663 1.00 35.70 O ATOM 808 HH TYR A 707 8.499 -5.123 -7.589 1.00 0.00 H ATOM 809 H TYR A 707 14.567 -3.091 -13.275 1.00 0.00 H ATOM 810 N ASN A 708 11.801 -1.391 -13.298 1.00 23.16 N ATOM 811 CA ASN A 708 10.859 -0.276 -13.323 1.00 23.55 C ATOM 812 C ASN A 708 10.329 -0.026 -14.724 1.00 23.08 C ATOM 813 O ASN A 708 11.052 -0.184 -15.710 1.00 22.07 O ATOM 814 CB ASN A 708 11.533 0.986 -12.795 1.00 23.13 C ATOM 815 CG ASN A 708 11.946 0.843 -11.358 1.00 23.97 C ATOM 816 OD1 ASN A 708 11.119 0.967 -10.464 1.00 25.51 O ATOM 817 ND2 ASN A 708 13.220 0.555 -11.125 1.00 23.21 N ATOM 818 HD22 ASN A 708 13.885 0.460 -11.919 1.00 0.00 H ATOM 819 HD21 ASN A 708 13.553 0.424 -10.149 1.00 0.00 H ATOM 820 H ASN A 708 12.783 -1.225 -13.597 1.00 0.00 H ATOM 821 N ALA A 709 9.063 0.387 -14.806 1.00 24.05 N ATOM 822 CA ALA A 709 8.474 0.667 -16.099 1.00 23.91 C ATOM 823 C ALA A 709 9.125 1.902 -16.712 1.00 23.03 C ATOM 824 O ALA A 709 9.685 2.755 -16.014 1.00 22.85 O ATOM 825 CB ALA A 709 6.961 0.857 -15.969 1.00 25.38 C ATOM 826 H ALA A 709 8.499 0.508 -13.941 1.00 0.00 H ATOM 827 N LYS A 710 9.051 1.993 -18.040 1.00 22.77 N ATOM 828 CA LYS A 710 9.785 3.045 -18.735 1.00 24.73 C ATOM 829 C LYS A 710 9.269 4.424 -18.375 1.00 27.86 C ATOM 830 O LYS A 710 10.025 5.399 -18.443 1.00 27.87 O ATOM 831 CB LYS A 710 9.713 2.858 -20.252 1.00 22.25 C ATOM 832 CG LYS A 710 10.539 1.710 -20.790 1.00 26.23 C ATOM 833 CD LYS A 710 10.441 1.616 -22.310 1.00 26.94 C ATOM 834 CE LYS A 710 11.495 2.490 -22.998 1.00 23.01 C ATOM 835 NZ LYS A 710 11.290 2.562 -24.471 1.00 22.74 N ATOM 836 HZ1 LYS A 710 11.348 1.605 -24.875 1.00 0.00 H ATOM 837 HZ2 LYS A 710 10.353 2.967 -24.670 1.00 0.00 H ATOM 838 HZ3 LYS A 710 12.026 3.163 -24.893 1.00 0.00 H ATOM 839 H LYS A 710 8.472 1.317 -18.578 1.00 0.00 H ATOM 840 N ASP A 711 7.996 4.536 -17.993 1.00 24.13 N ATOM 841 CA ASP A 711 7.403 5.842 -17.743 1.00 25.77 C ATOM 842 C ASP A 711 7.584 6.310 -16.304 1.00 26.29 C ATOM 843 O ASP A 711 6.801 7.136 -15.835 1.00 31.26 O ATOM 844 CB ASP A 711 5.915 5.826 -18.113 1.00 30.55 C ATOM 845 CG ASP A 711 5.077 4.925 -17.202 1.00 37.19 C ATOM 846 OD1 ASP A 711 5.641 4.192 -16.360 1.00 36.97 O ATOM 847 OD2 ASP A 711 3.832 4.944 -17.338 1.00 43.69 O ATOM 848 H ASP A 711 7.419 3.679 -17.872 1.00 0.00 H ATOM 849 N THR A 712 8.574 5.791 -15.587 1.00 24.87 N ATOM 850 CA THR A 712 8.780 6.139 -14.189 1.00 25.59 C ATOM 851 C THR A 712 10.007 7.020 -14.036 1.00 27.67 C ATOM 852 O THR A 712 10.930 6.983 -14.856 1.00 25.52 O ATOM 853 CB THR A 712 8.960 4.901 -13.300 1.00 25.49 C ATOM 854 OG1 THR A 712 10.156 4.191 -13.688 1.00 23.92 O ATOM 855 CG2 THR A 712 7.735 3.983 -13.379 1.00 26.35 C ATOM 856 HG1 THR A 712 10.078 3.908 -14.633 1.00 0.00 H ATOM 857 H THR A 712 9.222 5.115 -16.039 1.00 0.00 H ATOM 858 N ILE A 713 10.007 7.823 -12.968 1.00 26.28 N ATOM 859 CA ILE A 713 11.219 8.551 -12.604 1.00 26.02 C ATOM 860 C ILE A 713 12.404 7.596 -12.462 1.00 24.48 C ATOM 861 O ILE A 713 13.503 7.876 -12.952 1.00 23.51 O ATOM 862 CB ILE A 713 10.993 9.351 -11.311 1.00 27.92 C ATOM 863 CG1 ILE A 713 9.981 10.465 -11.551 1.00 37.71 C ATOM 864 CG2 ILE A 713 12.303 9.916 -10.827 1.00 30.43 C ATOM 865 CD1 ILE A 713 10.505 11.532 -12.431 1.00 38.57 C ATOM 866 H ILE A 713 9.145 7.929 -12.397 1.00 0.00 H ATOM 867 N PHE A 714 12.203 6.459 -11.791 1.00 24.48 N ATOM 868 CA PHE A 714 13.315 5.535 -11.551 1.00 23.38 C ATOM 869 C PHE A 714 13.975 5.111 -12.851 1.00 21.78 C ATOM 870 O PHE A 714 15.207 5.087 -12.960 1.00 20.90 O ATOM 871 CB PHE A 714 12.832 4.298 -10.798 1.00 23.99 C ATOM 872 CG PHE A 714 12.539 4.543 -9.343 1.00 28.79 C ATOM 873 CD1 PHE A 714 13.305 5.430 -8.606 1.00 30.79 C ATOM 874 CD2 PHE A 714 11.495 3.885 -8.715 1.00 33.91 C ATOM 875 CE1 PHE A 714 13.041 5.649 -7.262 1.00 36.09 C ATOM 876 CE2 PHE A 714 11.223 4.103 -7.373 1.00 38.10 C ATOM 877 CZ PHE A 714 11.997 4.988 -6.649 1.00 37.07 C ATOM 878 H PHE A 714 11.253 6.228 -11.437 1.00 0.00 H ATOM 879 N TYR A 715 13.170 4.714 -13.836 1.00 21.61 N ATOM 880 CA TYR A 715 13.750 4.274 -15.100 1.00 22.47 C ATOM 881 C TYR A 715 14.537 5.404 -15.748 1.00 20.14 C ATOM 882 O TYR A 715 15.671 5.208 -16.200 1.00 19.31 O ATOM 883 CB TYR A 715 12.643 3.774 -16.033 1.00 20.84 C ATOM 884 CG TYR A 715 13.155 3.159 -17.319 1.00 19.99 C ATOM 885 CD1 TYR A 715 13.516 3.949 -18.404 1.00 19.84 C ATOM 886 CD2 TYR A 715 13.237 1.776 -17.457 1.00 19.82 C ATOM 887 CE1 TYR A 715 13.990 3.376 -19.586 1.00 19.51 C ATOM 888 CE2 TYR A 715 13.706 1.203 -18.622 1.00 19.48 C ATOM 889 CZ TYR A 715 14.072 1.994 -19.680 1.00 19.33 C ATOM 890 OH TYR A 715 14.527 1.419 -20.834 1.00 19.35 O ATOM 891 HH TYR A 715 14.746 2.127 -21.490 1.00 0.00 H ATOM 892 H TYR A 715 12.138 4.718 -13.705 1.00 0.00 H ATOM 893 N ARG A 716 13.969 6.614 -15.769 1.00 21.06 N ATOM 894 CA ARG A 716 14.670 7.704 -16.430 1.00 21.14 C ATOM 895 C ARG A 716 15.931 8.078 -15.677 1.00 20.90 C ATOM 896 O ARG A 716 16.922 8.478 -16.297 1.00 20.57 O ATOM 897 CB ARG A 716 13.765 8.927 -16.559 1.00 22.57 C ATOM 898 CG ARG A 716 14.243 9.901 -17.632 1.00 45.95 C ATOM 899 CD ARG A 716 14.469 9.149 -18.946 1.00 47.06 C ATOM 900 NE ARG A 716 14.984 9.981 -20.031 1.00 49.05 N ATOM 901 CZ ARG A 716 16.223 10.465 -20.090 1.00 54.63 C ATOM 902 NH1 ARG A 716 17.084 10.225 -19.109 1.00 53.20 N ATOM 903 NH2 ARG A 716 16.600 11.204 -21.128 1.00 57.54 N ATOM 904 HE ARG A 716 14.337 10.211 -20.812 1.00 0.00 H ATOM 905 HH12 ARG A 716 18.050 10.606 -19.161 1.00 0.00 H ATOM 906 HH11 ARG A 716 16.792 9.656 -18.289 1.00 0.00 H ATOM 907 HH22 ARG A 716 17.568 11.582 -21.173 1.00 0.00 H ATOM 908 HH21 ARG A 716 15.927 11.405 -21.895 1.00 0.00 H ATOM 909 H ARG A 716 13.044 6.773 -15.321 1.00 0.00 H ATOM 910 N ALA A 717 15.912 7.943 -14.348 1.00 21.28 N ATOM 911 CA ALA A 717 17.099 8.259 -13.562 1.00 22.36 C ATOM 912 C ALA A 717 18.216 7.284 -13.875 1.00 19.91 C ATOM 913 O ALA A 717 19.395 7.653 -13.867 1.00 21.53 O ATOM 914 CB ALA A 717 16.780 8.240 -12.067 1.00 23.31 C ATOM 915 H ALA A 717 15.048 7.612 -13.873 1.00 0.00 H ATOM 916 N ALA A 718 17.863 6.024 -14.126 1.00 19.27 N ATOM 917 CA ALA A 718 18.889 5.054 -14.509 1.00 18.29 C ATOM 918 C ALA A 718 19.479 5.379 -15.882 1.00 17.83 C ATOM 919 O ALA A 718 20.691 5.236 -16.095 1.00 17.39 O ATOM 920 CB ALA A 718 18.293 3.648 -14.479 1.00 18.15 C ATOM 921 H ALA A 718 16.867 5.733 -14.050 1.00 0.00 H ATOM 922 N VAL A 719 18.644 5.816 -16.829 1.00 18.18 N ATOM 923 CA VAL A 719 19.152 6.258 -18.126 1.00 18.22 C ATOM 924 C VAL A 719 20.124 7.408 -17.944 1.00 18.61 C ATOM 925 O VAL A 719 21.211 7.425 -18.532 1.00 18.46 O ATOM 926 CB VAL A 719 17.997 6.669 -19.055 1.00 18.92 C ATOM 927 CG1 VAL A 719 18.560 7.279 -20.318 1.00 19.41 C ATOM 928 CG2 VAL A 719 17.126 5.456 -19.381 1.00 18.68 C ATOM 929 H VAL A 719 17.621 5.842 -16.641 1.00 0.00 H ATOM 930 N ARG A 720 19.736 8.389 -17.131 1.00 19.37 N ATOM 931 CA ARG A 720 20.600 9.542 -16.909 1.00 20.10 C ATOM 932 C ARG A 720 21.900 9.128 -16.235 1.00 19.49 C ATOM 933 O ARG A 720 22.979 9.616 -16.595 1.00 19.72 O ATOM 934 CB ARG A 720 19.873 10.593 -16.071 1.00 23.10 C ATOM 935 CG ARG A 720 20.735 11.796 -15.789 1.00 26.89 C ATOM 936 CD ARG A 720 20.024 12.807 -14.923 1.00 27.93 C ATOM 937 NE ARG A 720 19.840 12.359 -13.544 1.00 28.96 N ATOM 938 CZ ARG A 720 19.355 13.147 -12.592 1.00 28.20 C ATOM 939 NH1 ARG A 720 19.024 14.382 -12.906 1.00 27.35 N ATOM 940 NH2 ARG A 720 19.196 12.714 -11.351 1.00 26.83 N ATOM 941 HE ARG A 720 20.100 11.382 -13.298 1.00 0.00 H ATOM 942 HH12 ARG A 720 18.642 15.019 -12.178 1.00 0.00 H ATOM 943 HH11 ARG A 720 19.145 14.721 -13.882 1.00 0.00 H ATOM 944 HH22 ARG A 720 18.814 13.351 -10.623 1.00 0.00 H ATOM 945 HH21 ARG A 720 19.453 11.737 -11.104 1.00 0.00 H ATOM 946 H ARG A 720 18.814 8.332 -16.653 1.00 0.00 H ATOM 947 N LEU A 721 21.815 8.220 -15.261 1.00 18.92 N ATOM 948 CA LEU A 721 23.017 7.744 -14.582 1.00 18.51 C ATOM 949 C LEU A 721 23.915 6.989 -15.542 1.00 17.74 C ATOM 950 O LEU A 721 25.141 7.110 -15.478 1.00 17.74 O ATOM 951 CB LEU A 721 22.644 6.856 -13.397 1.00 18.41 C ATOM 952 CG LEU A 721 23.840 6.361 -12.566 1.00 18.28 C ATOM 953 CD1 LEU A 721 24.526 7.561 -11.906 1.00 20.35 C ATOM 954 CD2 LEU A 721 23.410 5.361 -11.514 1.00 22.71 C ATOM 955 H LEU A 721 20.884 7.848 -14.983 1.00 0.00 H ATOM 956 N ARG A 722 23.322 6.208 -16.448 1.00 17.31 N ATOM 957 CA ARG A 722 24.128 5.503 -17.438 1.00 16.97 C ATOM 958 C ARG A 722 24.919 6.484 -18.292 1.00 17.56 C ATOM 959 O ARG A 722 26.112 6.277 -18.561 1.00 19.56 O ATOM 960 CB ARG A 722 23.219 4.646 -18.315 1.00 16.83 C ATOM 961 CG ARG A 722 23.955 3.896 -19.394 1.00 20.52 C ATOM 962 CD ARG A 722 22.980 3.101 -20.232 1.00 20.93 C ATOM 963 NE ARG A 722 22.189 3.984 -21.079 1.00 17.63 N ATOM 964 CZ ARG A 722 20.967 3.709 -21.523 1.00 19.35 C ATOM 965 NH1 ARG A 722 20.381 2.554 -21.210 1.00 19.60 N ATOM 966 NH2 ARG A 722 20.327 4.599 -22.274 1.00 20.09 N ATOM 967 HE ARG A 722 22.610 4.894 -21.356 1.00 0.00 H ATOM 968 HH12 ARG A 722 19.425 2.344 -21.560 1.00 0.00 H ATOM 969 HH11 ARG A 722 20.880 1.862 -20.615 1.00 0.00 H ATOM 970 HH22 ARG A 722 19.370 4.391 -22.625 1.00 0.00 H ATOM 971 HH21 ARG A 722 20.783 5.503 -22.511 1.00 0.00 H ATOM 972 H ARG A 722 22.287 6.103 -16.448 1.00 0.00 H ATOM 973 N GLU A 723 24.266 7.567 -18.704 1.00 18.31 N ATOM 974 CA GLU A 723 24.911 8.590 -19.522 1.00 19.32 C ATOM 975 C GLU A 723 25.968 9.339 -18.725 1.00 24.03 C ATOM 976 O GLU A 723 27.140 9.398 -19.124 1.00 22.16 O ATOM 977 CB GLU A 723 23.861 9.562 -20.055 1.00 21.93 C ATOM 978 CG GLU A 723 22.802 8.903 -20.923 1.00 28.28 C ATOM 979 CD GLU A 723 21.677 9.858 -21.334 1.00 37.91 C ATOM 980 OE1 GLU A 723 21.583 10.966 -20.754 1.00 37.16 O ATOM 981 OE2 GLU A 723 20.889 9.493 -22.238 1.00 37.95 O ATOM 982 H GLU A 723 23.268 7.688 -18.436 1.00 0.00 H ATOM 983 N GLN A 724 25.582 9.889 -17.576 1.00 19.93 N ATOM 984 CA GLN A 724 26.531 10.696 -16.818 1.00 20.66 C ATOM 985 C GLN A 724 27.635 9.841 -16.224 1.00 23.58 C ATOM 986 O GLN A 724 28.803 10.254 -16.190 1.00 24.33 O ATOM 987 CB GLN A 724 25.794 11.465 -15.732 1.00 21.42 C ATOM 988 CG GLN A 724 24.901 12.534 -16.283 1.00 24.29 C ATOM 989 CD GLN A 724 24.446 13.462 -15.194 1.00 33.05 C ATOM 990 OE1 GLN A 724 23.822 13.030 -14.233 1.00 28.61 O ATOM 991 NE2 GLN A 724 24.780 14.743 -15.318 1.00 42.24 N ATOM 992 HE22 GLN A 724 25.311 15.064 -16.153 1.00 0.00 H ATOM 993 HE21 GLN A 724 24.510 15.424 -14.580 1.00 0.00 H ATOM 994 H GLN A 724 24.614 9.745 -17.223 1.00 0.00 H ATOM 995 N GLY A 725 27.285 8.656 -15.734 1.00 18.85 N ATOM 996 CA GLY A 725 28.293 7.779 -15.166 1.00 19.52 C ATOM 997 C GLY A 725 29.235 7.221 -16.208 1.00 22.96 C ATOM 998 O GLY A 725 30.405 6.963 -15.914 1.00 23.05 O ATOM 999 H GLY A 725 26.289 8.357 -15.757 1.00 0.00 H ATOM 1000 N GLY A 726 28.743 7.019 -17.432 1.00 22.63 N ATOM 1001 CA GLY A 726 29.614 6.538 -18.495 1.00 25.46 C ATOM 1002 C GLY A 726 30.770 7.482 -18.773 1.00 26.46 C ATOM 1003 O GLY A 726 31.909 7.046 -18.975 1.00 24.00 O ATOM 1004 H GLY A 726 27.738 7.205 -17.626 1.00 0.00 H ATOM 1005 N ALA A 727 30.496 8.789 -18.777 1.00 23.12 N ATOM 1006 CA ALA A 727 31.561 9.764 -18.970 1.00 21.49 C ATOM 1007 C ALA A 727 32.538 9.757 -17.799 1.00 21.40 C ATOM 1008 O ALA A 727 33.751 9.906 -17.993 1.00 22.50 O ATOM 1009 CB ALA A 727 30.965 11.157 -19.157 1.00 26.65 C ATOM 1010 H ALA A 727 29.517 9.113 -18.642 1.00 0.00 H ATOM 1011 N VAL A 728 32.026 9.608 -16.575 1.00 20.75 N ATOM 1012 CA VAL A 728 32.905 9.527 -15.409 1.00 20.85 C ATOM 1013 C VAL A 728 33.823 8.324 -15.533 1.00 20.26 C ATOM 1014 O VAL A 728 35.028 8.410 -15.277 1.00 20.85 O ATOM 1015 CB VAL A 728 32.079 9.463 -14.113 1.00 20.52 C ATOM 1016 CG1 VAL A 728 32.955 9.054 -12.923 1.00 20.65 C ATOM 1017 CG2 VAL A 728 31.420 10.819 -13.860 1.00 21.96 C ATOM 1018 H VAL A 728 30.995 9.549 -16.450 1.00 0.00 H ATOM 1019 N LEU A 729 33.263 7.189 -15.947 1.00 19.32 N ATOM 1020 CA LEU A 729 34.056 5.966 -16.014 1.00 19.03 C ATOM 1021 C LEU A 729 35.092 6.034 -17.126 1.00 19.84 C ATOM 1022 O LEU A 729 36.214 5.542 -16.962 1.00 21.15 O ATOM 1023 CB LEU A 729 33.133 4.764 -16.206 1.00 18.64 C ATOM 1024 CG LEU A 729 32.341 4.456 -14.941 1.00 21.11 C ATOM 1025 CD1 LEU A 729 31.175 3.533 -15.250 1.00 29.72 C ATOM 1026 CD2 LEU A 729 33.270 3.835 -13.897 1.00 22.58 C ATOM 1027 H LEU A 729 32.260 7.174 -16.223 1.00 0.00 H ATOM 1028 N ARG A 730 34.747 6.632 -18.272 1.00 20.57 N ATOM 1029 CA ARG A 730 35.725 6.713 -19.351 1.00 21.74 C ATOM 1030 C ARG A 730 36.935 7.530 -18.926 1.00 22.76 C ATOM 1031 O ARG A 730 38.080 7.141 -19.186 1.00 23.48 O ATOM 1032 CB ARG A 730 35.107 7.311 -20.615 1.00 22.54 C ATOM 1033 CG ARG A 730 36.147 7.495 -21.721 1.00 24.22 C ATOM 1034 CD ARG A 730 35.524 7.906 -23.047 1.00 25.32 C ATOM 1035 NE ARG A 730 36.527 7.982 -24.101 1.00 27.25 N ATOM 1036 CZ ARG A 730 36.249 8.090 -25.398 1.00 29.49 C ATOM 1037 NH1 ARG A 730 34.989 8.125 -25.812 1.00 32.42 N ATOM 1038 NH2 ARG A 730 37.238 8.146 -26.278 1.00 30.77 N ATOM 1039 HE ARG A 730 37.528 7.950 -23.821 1.00 0.00 H ATOM 1040 HH12 ARG A 730 34.777 8.209 -26.827 1.00 0.00 H ATOM 1041 HH11 ARG A 730 34.213 8.068 -25.122 1.00 0.00 H ATOM 1042 HH22 ARG A 730 37.027 8.230 -27.293 1.00 0.00 H ATOM 1043 HH21 ARG A 730 38.225 8.106 -25.954 1.00 0.00 H ATOM 1044 H ARG A 730 33.795 7.033 -18.392 1.00 0.00 H ATOM 1045 N GLN A 731 36.705 8.667 -18.262 1.00 22.88 N ATOM 1046 CA GLN A 731 37.834 9.474 -17.816 1.00 24.27 C ATOM 1047 C GLN A 731 38.632 8.755 -16.737 1.00 23.61 C ATOM 1048 O GLN A 731 39.865 8.823 -16.722 1.00 26.44 O ATOM 1049 CB GLN A 731 37.345 10.832 -17.310 1.00 24.82 C ATOM 1050 CG GLN A 731 38.454 11.706 -16.748 1.00 38.15 C ATOM 1051 H GLN A 731 35.731 8.973 -18.066 1.00 0.00 H ATOM 1052 N ALA A 732 37.950 8.064 -15.821 1.00 22.37 N ATOM 1053 CA ALA A 732 38.678 7.365 -14.770 1.00 22.95 C ATOM 1054 C ALA A 732 39.507 6.238 -15.359 1.00 23.39 C ATOM 1055 O ALA A 732 40.641 5.999 -14.930 1.00 25.98 O ATOM 1056 CB ALA A 732 37.713 6.829 -13.714 1.00 22.18 C ATOM 1057 H ALA A 732 36.911 8.025 -15.857 1.00 0.00 H ATOM 1058 N ARG A 733 38.967 5.543 -16.360 1.00 22.07 N ATOM 1059 CA ARG A 733 39.735 4.457 -16.961 1.00 22.25 C ATOM 1060 C ARG A 733 40.967 4.996 -17.676 1.00 27.24 C ATOM 1061 O ARG A 733 42.032 4.371 -17.640 1.00 33.40 O ATOM 1062 CB ARG A 733 38.855 3.651 -17.916 1.00 22.57 C ATOM 1063 CG ARG A 733 39.522 2.378 -18.421 1.00 29.44 C ATOM 1064 CD ARG A 733 38.789 1.791 -19.616 1.00 29.53 C ATOM 1065 NE ARG A 733 37.518 1.163 -19.260 1.00 33.36 N ATOM 1066 CZ ARG A 733 37.400 -0.108 -18.882 1.00 33.11 C ATOM 1067 NH1 ARG A 733 38.483 -0.867 -18.787 1.00 27.93 N ATOM 1068 NH2 ARG A 733 36.208 -0.617 -18.593 1.00 32.40 N ATOM 1069 HE ARG A 733 36.656 1.743 -19.305 1.00 0.00 H ATOM 1070 HH12 ARG A 733 38.397 -1.861 -18.492 1.00 0.00 H ATOM 1071 HH11 ARG A 733 39.418 -0.469 -19.007 1.00 0.00 H ATOM 1072 HH22 ARG A 733 36.125 -1.611 -18.298 1.00 0.00 H ATOM 1073 HH21 ARG A 733 35.358 -0.022 -18.661 1.00 0.00 H ATOM 1074 H ARG A 733 38.014 5.771 -16.707 1.00 0.00 H ATOM 1075 N ARG A 734 40.843 6.153 -18.327 1.00 24.47 N ATOM 1076 CA ARG A 734 42.017 6.784 -18.924 1.00 27.09 C ATOM 1077 C ARG A 734 43.109 6.988 -17.881 1.00 30.03 C ATOM 1078 O ARG A 734 44.289 6.725 -18.146 1.00 35.74 O ATOM 1079 CB ARG A 734 41.645 8.128 -19.560 1.00 29.52 C ATOM 1080 CG ARG A 734 40.922 8.067 -20.895 1.00 39.44 C ATOM 1081 CD ARG A 734 40.700 9.495 -21.457 1.00 51.55 C ATOM 1082 NE ARG A 734 39.281 9.837 -21.634 1.00 55.20 N ATOM 1083 CZ ARG A 734 38.628 10.773 -20.940 1.00 51.37 C ATOM 1084 NH1 ARG A 734 39.261 11.492 -20.013 1.00 48.43 N ATOM 1085 NH2 ARG A 734 37.336 10.995 -21.181 1.00 46.39 N ATOM 1086 HE ARG A 734 38.746 9.311 -22.354 1.00 0.00 H ATOM 1087 HH12 ARG A 734 38.745 12.219 -19.477 1.00 0.00 H ATOM 1088 HH11 ARG A 734 40.270 11.326 -19.826 1.00 0.00 H ATOM 1089 HH22 ARG A 734 36.824 11.723 -20.643 1.00 0.00 H ATOM 1090 HH21 ARG A 734 36.840 10.440 -21.907 1.00 0.00 H ATOM 1091 H ARG A 734 39.910 6.606 -18.410 1.00 0.00 H ATOM 1092 N GLN A 735 42.732 7.453 -16.685 1.00 30.08 N ATOM 1093 CA GLN A 735 43.714 7.677 -15.628 1.00 33.14 C ATOM 1094 C GLN A 735 44.328 6.366 -15.152 1.00 30.74 C ATOM 1095 O GLN A 735 45.537 6.294 -14.902 1.00 36.30 O ATOM 1096 CB GLN A 735 43.068 8.417 -14.458 1.00 38.50 C ATOM 1097 CG GLN A 735 42.382 9.724 -14.831 1.00 47.75 C ATOM 1098 CD GLN A 735 43.327 10.737 -15.450 1.00 61.30 C ATOM 1099 OE1 GLN A 735 44.520 10.764 -15.139 1.00 65.47 O ATOM 1100 NE2 GLN A 735 42.796 11.581 -16.333 1.00 65.74 N ATOM 1101 HE22 GLN A 735 41.784 11.522 -16.565 1.00 0.00 H ATOM 1102 HE21 GLN A 735 43.393 12.299 -16.790 1.00 0.00 H ATOM 1103 H GLN A 735 41.728 7.657 -16.506 1.00 0.00 H ATOM 1104 N ALA A 736 43.511 5.321 -15.006 1.00 29.79 N ATOM 1105 CA ALA A 736 44.035 4.027 -14.581 1.00 33.32 C ATOM 1106 C ALA A 736 45.007 3.465 -15.606 1.00 43.98 C ATOM 1107 O ALA A 736 46.025 2.861 -15.244 1.00 43.93 O ATOM 1108 CB ALA A 736 42.887 3.046 -14.343 1.00 35.85 C ATOM 1109 H ALA A 736 42.494 5.429 -15.196 1.00 0.00 H ATOM 1110 N GLU A 737 44.708 3.650 -16.894 1.00 36.75 N ATOM 1111 CA GLU A 737 45.615 3.175 -17.933 1.00 43.33 C ATOM 1112 C GLU A 737 46.941 3.930 -17.917 1.00 46.09 C ATOM 1113 O GLU A 737 47.966 3.377 -18.332 1.00 50.79 O ATOM 1114 CB GLU A 737 44.933 3.269 -19.299 1.00 47.04 C ATOM 1115 CG GLU A 737 43.802 2.252 -19.459 1.00 49.95 C ATOM 1116 CD GLU A 737 42.945 2.494 -20.696 1.00 53.76 C ATOM 1117 OE1 GLU A 737 43.146 3.524 -21.376 1.00 57.63 O ATOM 1118 OE2 GLU A 737 42.066 1.652 -20.984 1.00 51.99 O ATOM 1119 H GLU A 737 43.826 4.134 -17.157 1.00 0.00 H ATOM 1120 N LYS A 738 46.953 5.176 -17.428 1.00 46.18 N ATOM 1121 CA LYS A 738 48.218 5.892 -17.272 1.00 47.60 C ATOM 1122 C LYS A 738 49.111 5.231 -16.228 1.00 53.34 C ATOM 1123 O LYS A 738 50.341 5.354 -16.296 1.00 56.92 O ATOM 1124 CB LYS A 738 47.967 7.351 -16.887 1.00 41.85 C ATOM 1125 CG LYS A 738 47.370 8.215 -17.985 1.00 44.86 C ATOM 1126 CD LYS A 738 47.252 9.668 -17.538 1.00 46.75 C ATOM 1127 H LYS A 738 46.060 5.636 -17.158 1.00 0.00 H ATOM 1128 N MET A 739 48.519 4.536 -15.260 1.00 54.50 N ATOM 1129 CA MET A 739 49.279 3.880 -14.202 1.00 55.45 C ATOM 1130 C MET A 739 50.049 2.683 -14.744 1.00 55.87 C ATOM 1131 O MET A 739 50.776 2.022 -14.005 1.00 59.44 O ATOM 1132 CB MET A 739 48.348 3.432 -13.070 1.00 53.04 C ATOM 1133 CG MET A 739 47.528 4.553 -12.445 1.00 47.31 C ATOM 1134 SD MET A 739 46.249 3.976 -11.289 1.00 41.68 S ATOM 1135 CE MET A 739 45.719 5.551 -10.614 1.00 35.44 C ATOM 1136 H MET A 739 47.482 4.458 -15.258 1.00 0.00 H TER 1137 MET A 739 HETATM 1138 O HOH 1 24.093 10.782 -4.548 1.00 28.96 O HETATM 1139 O HOH 2 32.631 -7.602 -16.240 1.00 39.47 O HETATM 1140 O HOH 3 23.755 -1.617 -17.909 1.00 32.12 O HETATM 1141 O HOH 4 20.272 13.815 -18.832 1.00 45.11 O HETATM 1142 O HOH 5 13.760 10.182 -21.967 1.00 46.51 O HETATM 1143 O HOH 6 24.024 8.032 -4.469 1.00 32.15 O HETATM 1144 O HOH 7 51.877 3.163 -3.588 1.00 51.25 O HETATM 1145 O HOH 8 38.822 -5.336 -20.467 1.00 35.73 O HETATM 1146 O HOH 9 11.065 7.589 -18.117 1.00 35.44 O HETATM 1147 O HOH 10 2.888 6.166 -19.290 1.00 38.15 O HETATM 1148 O HOH 11 28.860 4.294 -1.057 1.00 38.05 O HETATM 1149 O HOH 12 38.961 7.953 -23.538 1.00 38.55 O HETATM 1150 O HOH 13 38.265 -7.632 -9.162 1.00 33.51 O HETATM 1151 O HOH 14 21.165 7.215 -23.309 1.00 29.00 O HETATM 1152 O HOH 15 14.331 5.742 -22.430 1.00 30.29 O HETATM 1153 O HOH 16 46.898 7.967 -13.537 1.00 46.04 O HETATM 1154 O HOH 17 16.756 -1.143 -9.260 1.00 23.05 O HETATM 1155 O HOH 18 22.860 10.843 -13.239 1.00 30.92 O HETATM 1156 O HOH 19 28.612 -7.707 -11.137 1.00 38.73 O HETATM 1157 O HOH 20 35.790 -3.497 -20.869 1.00 34.39 O HETATM 1158 O HOH 21 8.588 1.598 -10.309 1.00 28.83 O HETATM 1159 O HOH 22 19.456 11.821 -19.499 1.00 39.86 O HETATM 1160 O HOH 23 34.171 0.000 -20.794 1.00 43.68 O HETATM 1161 O HOH 24 19.647 -3.143 -7.461 1.00 24.45 O HETATM 1162 O HOH 25 19.062 1.388 -4.752 1.00 26.77 O HETATM 1163 O HOH 26 20.472 0.286 -6.778 1.00 23.43 O HETATM 1164 O HOH 27 23.886 -8.332 -4.264 1.00 42.15 O HETATM 1165 O HOH 28 30.210 -7.850 -7.117 1.00 32.47 O HETATM 1166 O HOH 29 11.302 0.354 -7.723 1.00 32.41 O HETATM 1167 O HOH 30 23.117 14.408 -12.074 1.00 34.13 O HETATM 1168 O HOH 31 11.682 -6.539 -16.494 1.00 40.89 O HETATM 1169 O HOH 32 37.664 9.419 -2.357 1.00 45.76 O HETATM 1170 O HOH 33 19.322 10.250 -8.936 1.00 39.00 O HETATM 1171 O HOH 34 26.940 -5.636 -15.060 1.00 23.22 O HETATM 1172 O HOH 35 25.505 -4.025 1.248 1.00 45.42 O HETATM 1173 O HOH 36 18.130 -0.235 1.926 1.00 40.45 O HETATM 1174 O HOH 37 31.371 7.177 -2.498 1.00 42.25 O HETATM 1175 O HOH 38 44.381 2.853 -1.045 1.00 39.66 O HETATM 1176 O HOH 39 20.750 7.516 1.055 1.00 50.64 O HETATM 1177 O HOH 40 32.065 -7.060 -10.716 1.00 32.56 O HETATM 1178 O HOH 41 28.334 8.304 -21.798 1.00 38.13 O HETATM 1179 O HOH 42 37.857 9.342 -11.021 1.00 26.56 O HETATM 1180 O HOH 43 17.692 -4.539 -2.820 1.00 35.57 O HETATM 1181 O HOH 44 34.157 -4.047 3.233 1.00 39.48 O HETATM 1182 O HOH 45 29.973 11.586 -3.700 1.00 40.44 O HETATM 1183 O HOH 46 21.761 -3.922 -3.419 1.00 31.42 O HETATM 1184 O HOH 47 48.444 2.144 -9.782 1.00 43.79 O HETATM 1185 O HOH 48 29.410 12.924 -16.196 1.00 29.49 O HETATM 1186 O HOH 49 39.802 -3.873 -16.482 1.00 29.34 O HETATM 1187 O HOH 50 24.370 -5.162 -16.132 1.00 26.74 O HETATM 1188 O HOH 51 25.018 16.870 -13.603 1.00 43.64 O HETATM 1189 O HOH 52 45.156 7.507 -7.429 1.00 35.44 O HETATM 1190 O HOH 53 9.436 -5.558 -12.708 1.00 33.48 O HETATM 1191 O HOH 54 25.719 1.511 -17.485 1.00 26.67 O HETATM 1192 O HOH 55 38.656 -3.294 -4.422 1.00 27.68 O HETATM 1193 O HOH 56 6.006 8.971 -17.737 1.00 39.56 O HETATM 1194 O HOH 57 17.277 2.283 -1.438 1.00 39.40 O HETATM 1195 O HOH 58 42.026 6.284 0.266 1.00 43.71 O HETATM 1196 O HOH 59 27.405 3.819 -18.677 1.00 27.77 O HETATM 1197 O HOH 60 26.178 5.014 -0.515 1.00 34.15 O HETATM 1198 O HOH 61 11.789 -8.605 -10.371 1.00 38.46 O HETATM 1199 O HOH 62 34.647 11.167 -20.459 1.00 36.86 O HETATM 1200 O HOH 63 30.458 13.658 -10.395 1.00 31.70 O HETATM 1201 O HOH 64 7.713 -2.384 -11.768 1.00 35.20 O HETATM 1202 O HOH 65 32.239 4.722 -20.507 1.00 35.29 O HETATM 1203 O HOH 66 20.282 -6.484 -14.449 1.00 25.34 O HETATM 1204 O HOH 67 22.123 15.023 -3.438 1.00 43.11 O HETATM 1205 O HOH 68 33.518 -10.022 -13.284 1.00 36.06 O HETATM 1206 O HOH 69 20.441 9.726 -12.230 1.00 24.43 O HETATM 1207 O HOH 70 42.029 -2.188 -14.815 1.00 36.47 O HETATM 1208 O HOH 71 19.456 -0.644 -9.066 1.00 24.62 O HETATM 1209 O HOH 72 20.509 -8.744 -11.368 1.00 30.73 O HETATM 1210 O HOH 73 34.354 6.268 -2.417 1.00 36.45 O HETATM 1211 O HOH 74 7.330 0.139 -19.401 1.00 24.48 O HETATM 1212 O HOH 75 40.313 8.918 -3.345 1.00 30.71 O HETATM 1213 O HOH 76 29.132 2.131 -18.207 1.00 34.58 O HETATM 1214 O HOH 77 19.474 -3.166 -4.399 1.00 28.73 O HETATM 1215 O HOH 78 29.071 -7.228 -0.584 1.00 44.68 O HETATM 1216 O HOH 79 36.238 10.620 -13.850 1.00 26.42 O HETATM 1217 O HOH 80 25.434 15.829 -10.238 1.00 35.25 O HETATM 1218 O HOH 81 21.779 0.000 -20.794 1.00 20.58 O HETATM 1219 O HOH 82 19.231 4.367 -2.150 1.00 35.67 O HETATM 1220 O HOH 83 7.351 0.383 -12.398 1.00 27.42 O HETATM 1221 O HOH 84 8.449 3.014 -25.211 1.00 28.65 O HETATM 1222 O HOH 85 28.671 -7.850 -4.353 1.00 34.00 O HETATM 1223 O HOH 86 23.723 6.175 -22.406 1.00 30.62 O HETATM 1224 O HOH 87 18.864 6.558 -24.753 1.00 30.20 O HETATM 1225 O HOH 88 28.597 -4.924 -17.466 1.00 30.26 O HETATM 1226 O HOH 89 33.202 -3.339 -17.835 1.00 35.01 O HETATM 1227 O HOH 90 50.255 -5.305 -10.698 1.00 34.99 O HETATM 1228 O HOH 91 35.351 15.481 -9.112 1.00 48.08 O HETATM 1229 O HOH 92 28.717 16.084 -10.584 1.00 46.37 O HETATM 1230 O HOH 93 5.903 2.509 -19.178 1.00 28.25 O HETATM 1231 O HOH 94 9.228 -8.788 -9.883 1.00 47.12 O HETATM 1232 O HOH 95 44.142 -2.983 -12.618 1.00 37.18 O HETATM 1233 O HOH 96 24.685 4.237 -23.228 1.00 35.26 O HETATM 1234 O HOH 97 18.780 -9.874 -13.298 1.00 44.41 O HETATM 1235 O HOH 98 22.942 -7.329 -16.169 1.00 39.55 O HETATM 1236 O HOH 99 25.998 10.509 -2.848 1.00 41.78 O HETATM 1237 O HOH 100 19.879 -11.759 -4.392 1.00 48.44 O HETATM 1238 O HOH 101 30.429 9.305 -2.131 1.00 45.25 O HETATM 1239 O HOH 102 40.303 10.667 -12.156 1.00 40.25 O HETATM 1240 O HOH 103 3.743 8.203 -18.700 1.00 43.21 O HETATM 1241 O HOH 104 44.445 5.071 1.102 1.00 45.45 O HETATM 1242 O HOH 105 40.345 -6.702 -16.484 1.00 37.28 O HETATM 1243 O HOH 106 34.191 16.043 -10.959 1.00 48.10 O HETATM 1244 O HOH 107 42.972 9.159 -8.025 1.00 37.16 O HETATM 1245 O HOH 108 11.617 -7.252 -13.017 1.00 39.08 O HETATM 1246 O HOH 109 32.732 14.116 -12.165 1.00 36.81 O HETATM 1247 O HOH 110 26.807 12.586 -3.072 1.00 42.98 O HETATM 1248 O HOH 111 25.238 4.964 2.373 1.00 50.99 O HETATM 1249 O HOH 112 32.319 13.590 -16.311 1.00 42.44 O HETATM 1250 O HOH 113 22.929 -11.146 -4.371 1.00 44.67 O HETATM 1251 O HOH 114 34.435 12.925 -14.254 1.00 35.80 O HETATM 1252 O HOH 115 6.017 3.936 -21.484 1.00 33.49 O HETATM 1253 O HOH 116 33.242 -11.665 -11.357 1.00 44.93 O HETATM 1254 O HOH 117 27.193 3.702 -21.725 1.00 40.27 O HETATM 1255 O HOH 118 22.385 -10.070 -12.848 1.00 35.17 O HETATM 1256 O HOH 119 26.747 -8.242 -13.785 1.00 42.65 O HETATM 1257 O HOH 120 24.097 0.274 -19.007 1.00 30.69 O HETATM 1258 O HOH 121 28.019 13.870 -18.463 1.00 39.46 O HETATM 1259 O HOH 122 26.213 -8.746 -3.779 1.00 42.08 O HETATM 1260 O HOH 123 19.849 -0.462 3.505 1.00 49.94 O HETATM 1261 O HOH 124 26.115 0.000 -20.794 1.00 36.48 O HETATM 1262 O HOH 125 41.239 11.164 -4.189 1.00 45.10 O HETATM 1263 O HOH 126 8.069 4.370 -9.786 1.00 39.81 O HETATM 1264 O HOH 127 8.585 0.719 -6.745 1.00 38.35 O HETATM 1265 O HOH 128 21.552 -8.848 -15.213 1.00 43.33 O HETATM 1266 O HOH 129 3.877 5.235 -21.898 1.00 40.54 O HETATM 1267 O HOH 130 34.403 -2.854 -22.507 1.00 40.81 O HETATM 1268 O HOH 131 34.428 -11.713 -15.625 1.00 39.25 O HETATM 1269 O HOH 132 4.907 1.185 -12.850 1.00 35.78 O HETATM 1270 O HOH 133 42.961 11.298 -6.203 1.00 39.36 O HETATM 1271 O HOH 134 6.642 -2.196 -18.218 1.00 29.44 O HETATM 1272 O HOH 135 19.288 -6.561 -1.391 1.00 43.82 O HETATM 1273 O HOH 136 19.683 -10.242 -2.318 1.00 49.17 O HETATM 1274 O HOH 137 4.227 -1.573 -17.052 1.00 36.12 O HETATM 1275 O HOH 138 17.518 -8.485 2.736 1.00 52.29 O HETATM 1276 O HOH 139 35.334 -14.121 -15.395 1.00 41.36 O HETATM 1277 O HOH 140 45.425 11.726 -5.407 1.00 50.89 O HETATM 1278 O HOH 141 18.042 -10.176 0.850 1.00 46.90 O HETATM 1279 O HOH 142 17.046 -12.299 0.859 1.00 51.07 O HETATM 1280 FAB UNN A 143 11.609 2.912 -1.526 1.00 -0.24 F HETATM 1281 CAO UNN A 143 11.280 2.835 -2.801 1.00 0.35 C HETATM 1282 FAC UNN A 143 10.631 3.935 -3.141 1.00 -0.24 F HETATM 1283 FAD UNN A 143 10.504 1.799 -2.971 1.00 -0.24 F HETATM 1284 CAL UNN A 143 12.432 2.720 -3.589 1.00 0.01 C HETATM 1285 CAG UNN A 143 12.423 2.000 -4.787 1.00 -0.03 C HETATM 1286 CAN UNN A 143 13.586 1.920 -5.551 1.00 0.12 C HETATM 1287 NAJ UNN A 143 13.626 1.194 -6.755 1.00 -0.23 N HETATM 1288 C UNN A 143 14.754 1.239 -7.583 1.00 0.23 C HETATM 1289 O UNN A 143 14.773 0.558 -8.612 1.00 -0.38 O HETATM 1290 CA UNN A 143 15.842 2.067 -7.288 1.00 0.13 C HETATM 1291 N UNN A 143 15.919 2.456 -5.866 1.00 -0.28 N HETATM 1292 CAM UNN A 143 14.749 2.538 -5.101 1.00 0.11 C HETATM 1293 CAF UNN A 143 14.757 3.256 -3.910 1.00 -0.01 C HETATM 1294 CAE UNN A 143 13.596 3.347 -3.156 1.00 -0.05 C HETATM 1295 H7 UNN A 143 13.596 3.908 -2.228 1.00 0.07 H HETATM 1296 H6 UNN A 143 15.665 3.742 -3.573 1.00 0.06 H HETATM 1297 H5 UNN A 143 16.832 2.667 -5.437 1.00 0.19 H HETATM 1298 H3 UNN A 143 15.758 2.981 -7.895 1.00 0.08 H HETATM 1299 H4 UNN A 143 16.767 1.534 -7.553 1.00 0.08 H HETATM 1300 H2 UNN A 143 12.839 0.639 -7.023 1.00 0.22 H HETATM 1301 H1 UNN A 143 11.517 1.507 -5.120 1.00 0.06 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 1280 1281 CONECT 1281 1280 1282 1283 1284 CONECT 1282 1281 CONECT 1283 1281 CONECT 1284 1281 1285 1294 CONECT 1285 1284 1286 1301 CONECT 1286 1285 1287 1292 CONECT 1287 1286 1288 1300 CONECT 1288 1287 1289 1290 CONECT 1289 1288 CONECT 1290 1288 1291 1298 1299 CONECT 1291 1290 1292 1297 CONECT 1292 1286 1291 1293 CONECT 1293 1292 1294 1296 CONECT 1294 1284 1293 1295 CONECT 1295 1294 CONECT 1296 1293 CONECT 1297 1291 CONECT 1298 1290 CONECT 1299 1290 CONECT 1300 1287 CONECT 1301 1285 MASTER 0 0 0 0 0 0 0 0 1300 1 26 9 END
Display Options:
Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 5dy7
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4uye
RCSB PDB
PDBbind
118aa, >4UYE_1|Chains... *
5c7n
RCSB PDB
PDBbind
116aa, >5C7N_1|Chain... at 97%
5c85
RCSB PDB
PDBbind
116aa, >5C85_1|Chain... at 97%
5c87
RCSB PDB
PDBbind
116aa, >5C87_1|Chain... at 97%
5d7x
RCSB PDB
PDBbind
116aa, >5D7X_1|Chain... at 97%
5dya
RCSB PDB
PDBbind
116aa, >5DYA_1|Chain... at 97%
5e3d
RCSB PDB
PDBbind
116aa, >5E3D_1|Chain... at 97%
5e3g
RCSB PDB
PDBbind
116aa, >5E3G_1|Chain... at 97%
5em3
RCSB PDB
PDBbind
116aa, >5EM3_1|Chain... at 97%
5epr
RCSB PDB
PDBbind
116aa, >5EPR_1|Chain... at 97%
5eps
RCSB PDB
PDBbind
116aa, >5EPS_1|Chain... at 97%
5eq1
RCSB PDB
PDBbind
116aa, >5EQ1_1|Chain... at 97%
5etb
RCSB PDB
PDBbind
116aa, >5ETB_1|Chain... at 97%
5eva
RCSB PDB
PDBbind
116aa, >5EVA_1|Chain... at 97%
5ewd
RCSB PDB
PDBbind
116aa, >5EWD_1|Chain... at 97%
5ewh
RCSB PDB
PDBbind
116aa, >5EWH_1|Chain... at 97%
5mwg
RCSB PDB
PDBbind
116aa, >5MWG_1|Chains... at 97%
5mwh
RCSB PDB
PDBbind
116aa, >5MWH_1|Chains... at 97%
5mwz
RCSB PDB
PDBbind
116aa, >5MWZ_1|Chain... at 97%
5myg
RCSB PDB
PDBbind
116aa, >5MYG_1|Chains... at 97%
5o4s
RCSB PDB
PDBbind
116aa, >5O4S_1|Chains... at 97%
5o4t
RCSB PDB
PDBbind
116aa, >5O4T_1|Chain... at 97%
5o55
RCSB PDB
PDBbind
116aa, >5O55_1|Chain... at 97%
5o5a
RCSB PDB
PDBbind
116aa, >5O5A_1|Chain... at 97%
5o5f
RCSB PDB
PDBbind
116aa, >5O5F_1|Chain... at 97%
5o5h
RCSB PDB
PDBbind
116aa, >5O5H_1|Chain... at 97%
5ov8
RCSB PDB
PDBbind
116aa, >5OV8_1|Chains... at 97%
5owa
RCSB PDB
PDBbind
116aa, >5OWA_1|Chains... at 97%
5t4u
RCSB PDB
PDBbind
116aa, >5T4U_1|Chain... at 97%
5t4v
RCSB PDB
PDBbind
116aa, >5T4V_1|Chain... at 97%
6ekq
RCSB PDB
PDBbind
116aa, >6EKQ_1|Chains... at 97%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5dy7
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
human BRPF1 bromodomain
Ligand Name
5GT
EC.Number
E.C.-.-.-.-
Resolution
1.69(Å)
Affinity (Kd/Ki/IC50)
Kd>200uM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) J.Med.Chem. Vol. 59: pp. 5555-5561
Ligand Properties
Formula
C
9
H
7
F
3
N
2
O
Molecular Weight
216.160
Exact Mass
216.051
No. of atoms
22
No. of bonds
23
Polar Surface Area
41.13
LOGP Value
1.77 (
Computed with XLOGP3
)
2.35 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 1
No. of Rotatable Bonds: 0
No. of Nitrogen and Oxygen Atoms: 3
No. of Rings: 2
Canonical SMILES
O=C1CNc2c(N1)cc(cc2)C(F)(F)F
InChI String
InChI=1S/C9H7F3N2O/c10-9(11,12)5-1-2-6-7(3-5)14-8(15)4-13-6/h1-3,13H,4H2,(H,14,15)
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):
P55201
Entrez Gene ID
NCBI Entrez Gene ID:
7862
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝ｅ湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com
times since Nov 2007. 
娌叕缃戝畨澶囷細姝ｅ湪鐢宠涓