Browse entries in the PDBbind-CN Database
HEADER 5T4V_COMPLEX COMPND 5T4V_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 112 MET GLN LEU THR PRO PHE LEU ILE LEU LEU ARG LYS THR SEQRES 2 A 112 LEU GLU GLN LEU GLN GLU LYS ASP THR GLY ASN ILE PHE SEQRES 3 A 112 SER GLU PRO VAL PRO LEU SER GLU VAL PRO ASP TYR LEU SEQRES 4 A 112 ASP HIS ILE LYS LYS PRO MET ASP PHE PHE THR MET LYS SEQRES 5 A 112 GLN ASN LEU GLU ALA TYR ARG TYR LEU ASN PHE ASP ASP SEQRES 6 A 112 PHE GLU GLU ASP PHE ASN LEU ILE VAL SER ASN CYS LEU SEQRES 7 A 112 LYS TYR ASN ALA LYS ASP THR ILE PHE TYR ARG ALA ALA SEQRES 8 A 112 VAL ARG LEU ARG GLU GLN GLY GLY ALA VAL LEU ARG GLN SEQRES 9 A 112 ALA ARG ARG GLN ALA GLU LYS MET HET N A 48 44 ATOM 1 N MET A 628 -3.899 15.264 -0.994 1.00 66.44 N ATOM 2 CA MET A 628 -3.839 15.921 -2.339 1.00 64.69 C ATOM 3 C MET A 628 -3.579 14.915 -3.477 1.00 61.79 C ATOM 4 O MET A 628 -2.591 15.019 -4.217 1.00 57.26 O ATOM 5 CB MET A 628 -2.801 17.050 -2.357 1.00 68.36 C ATOM 6 CG MET A 628 -2.858 17.936 -3.596 1.00 71.89 C ATOM 7 SD MET A 628 -4.241 19.096 -3.633 1.00 78.52 S ATOM 8 CE MET A 628 -3.397 20.645 -3.296 1.00 72.98 C ATOM 9 HN3 MET A 628 -2.994 14.789 -0.801 1.00 0.00 H ATOM 10 HN2 MET A 628 -4.668 14.564 -0.985 1.00 0.00 H ATOM 11 HN1 MET A 628 -4.076 15.985 -0.265 1.00 0.00 H ATOM 12 N GLN A 629 -4.493 13.953 -3.619 1.00 58.63 N ATOM 13 CA GLN A 629 -4.628 13.201 -4.873 1.00 55.71 C ATOM 14 C GLN A 629 -5.259 14.099 -5.947 1.00 50.46 C ATOM 15 O GLN A 629 -5.468 13.672 -7.077 1.00 46.94 O ATOM 16 CB GLN A 629 -5.475 11.930 -4.675 1.00 56.87 C ATOM 17 CG GLN A 629 -6.797 12.156 -3.953 1.00 58.49 C ATOM 18 H GLN A 629 -5.124 13.731 -2.823 1.00 0.00 H ATOM 19 N LEU A 630 -5.551 15.347 -5.577 1.00 51.57 N ATOM 20 CA LEU A 630 -6.208 16.317 -6.450 1.00 45.98 C ATOM 21 C LEU A 630 -5.214 17.175 -7.247 1.00 42.53 C ATOM 22 O LEU A 630 -5.210 18.389 -7.139 1.00 42.93 O ATOM 23 CB LEU A 630 -7.174 17.175 -5.598 1.00 48.87 C ATOM 24 CG LEU A 630 -8.597 16.628 -5.407 1.00 53.40 C ATOM 25 CD1 LEU A 630 -8.666 15.120 -5.208 1.00 56.29 C ATOM 26 CD2 LEU A 630 -9.298 17.339 -4.247 1.00 56.17 C ATOM 27 H LEU A 630 -5.297 15.646 -4.614 1.00 0.00 H ATOM 28 N THR A 631 -4.378 16.536 -8.073 1.00 38.80 N ATOM 29 CA THR A 631 -3.527 17.232 -9.053 1.00 35.26 C ATOM 30 C THR A 631 -3.827 16.621 -10.413 1.00 31.52 C ATOM 31 O THR A 631 -4.216 15.455 -10.461 1.00 30.59 O ATOM 32 CB THR A 631 -2.026 17.070 -8.771 1.00 39.70 C ATOM 33 OG1 THR A 631 -1.577 15.732 -9.114 1.00 39.17 O ATOM 34 CG2 THR A 631 -1.728 17.358 -7.298 1.00 41.38 C ATOM 35 HG1 THR A 631 -1.741 15.567 -10.076 1.00 0.00 H ATOM 36 H THR A 631 -4.327 15.499 -8.021 1.00 0.00 H ATOM 37 N PRO A 632 -3.677 17.378 -11.510 1.00 32.57 N ATOM 38 CA PRO A 632 -4.186 16.747 -12.718 1.00 29.57 C ATOM 39 C PRO A 632 -3.391 15.477 -13.111 1.00 29.92 C ATOM 40 O PRO A 632 -3.965 14.530 -13.634 1.00 29.87 O ATOM 41 CB PRO A 632 -4.016 17.817 -13.784 1.00 32.08 C ATOM 42 CG PRO A 632 -4.117 19.106 -13.017 1.00 33.25 C ATOM 43 CD PRO A 632 -3.418 18.826 -11.728 1.00 32.25 C ATOM 44 N PHE A 633 -2.091 15.474 -12.859 1.00 32.87 N ATOM 45 CA PHE A 633 -1.301 14.238 -13.115 1.00 32.50 C ATOM 46 C PHE A 633 -1.831 13.044 -12.330 1.00 30.92 C ATOM 47 O PHE A 633 -1.989 11.933 -12.863 1.00 30.65 O ATOM 48 CB PHE A 633 0.170 14.461 -12.767 1.00 35.07 C ATOM 49 CG PHE A 633 1.009 13.194 -12.859 1.00 35.39 C ATOM 50 CD1 PHE A 633 1.224 12.579 -14.085 1.00 37.50 C ATOM 51 CD2 PHE A 633 1.552 12.635 -11.717 1.00 37.87 C ATOM 52 CE1 PHE A 633 1.964 11.391 -14.157 1.00 32.36 C ATOM 53 CE2 PHE A 633 2.307 11.463 -11.791 1.00 37.92 C ATOM 54 CZ PHE A 633 2.517 10.871 -13.011 1.00 35.56 C ATOM 55 H PHE A 633 -1.626 16.326 -12.486 1.00 0.00 H ATOM 56 N LEU A 634 -2.071 13.224 -11.041 1.00 30.80 N ATOM 57 CA LEU A 634 -2.507 12.116 -10.223 1.00 29.51 C ATOM 58 C LEU A 634 -3.948 11.708 -10.582 1.00 28.07 C ATOM 59 O LEU A 634 -4.256 10.539 -10.545 1.00 26.34 O ATOM 60 CB LEU A 634 -2.327 12.428 -8.737 1.00 34.59 C ATOM 61 CG LEU A 634 -0.864 12.468 -8.232 1.00 36.67 C ATOM 62 CD1 LEU A 634 -0.804 12.907 -6.777 1.00 41.50 C ATOM 63 CD2 LEU A 634 -0.175 11.112 -8.431 1.00 37.97 C ATOM 64 H LEU A 634 -1.945 14.165 -10.616 1.00 0.00 H ATOM 65 N ILE A 635 -4.821 12.652 -10.953 1.00 26.63 N ATOM 66 CA ILE A 635 -6.161 12.266 -11.411 1.00 26.60 C ATOM 67 C ILE A 635 -6.080 11.494 -12.736 1.00 24.45 C ATOM 68 O ILE A 635 -6.727 10.479 -12.902 1.00 22.90 O ATOM 69 CB ILE A 635 -7.084 13.474 -11.523 1.00 27.27 C ATOM 70 CG1 ILE A 635 -7.460 13.881 -10.091 1.00 32.95 C ATOM 71 CG2 ILE A 635 -8.339 13.123 -12.293 1.00 28.41 C ATOM 72 CD1 ILE A 635 -7.946 15.296 -10.034 1.00 38.50 C ATOM 73 H ILE A 635 -4.551 13.656 -10.917 1.00 0.00 H ATOM 74 N LEU A 636 -5.158 11.907 -13.605 1.00 25.76 N ATOM 75 CA LEU A 636 -4.913 11.163 -14.852 1.00 24.15 C ATOM 76 C LEU A 636 -4.467 9.706 -14.595 1.00 21.68 C ATOM 77 O LEU A 636 -5.011 8.762 -15.192 1.00 22.13 O ATOM 78 CB LEU A 636 -3.833 11.849 -15.686 1.00 24.03 C ATOM 79 CG LEU A 636 -3.397 11.057 -16.938 1.00 24.12 C ATOM 80 CD1 LEU A 636 -4.527 10.817 -17.920 1.00 22.28 C ATOM 81 CD2 LEU A 636 -2.285 11.881 -17.579 1.00 26.86 C ATOM 82 H LEU A 636 -4.606 12.764 -13.400 1.00 0.00 H ATOM 83 N LEU A 637 -3.574 9.523 -13.644 1.00 24.00 N ATOM 84 CA LEU A 637 -3.113 8.157 -13.317 1.00 24.05 C ATOM 85 C LEU A 637 -4.277 7.350 -12.733 1.00 21.90 C ATOM 86 O LEU A 637 -4.455 6.191 -13.028 1.00 21.17 O ATOM 87 CB LEU A 637 -1.957 8.151 -12.341 1.00 25.45 C ATOM 88 CG LEU A 637 -0.645 8.681 -12.938 1.00 28.56 C ATOM 89 CD1 LEU A 637 0.501 8.246 -12.064 1.00 30.39 C ATOM 90 CD2 LEU A 637 -0.401 8.271 -14.390 1.00 29.06 C ATOM 91 H LEU A 637 -3.194 10.339 -13.124 1.00 0.00 H ATOM 92 N ARG A 638 -5.117 7.975 -11.915 1.00 20.40 N ATOM 93 CA ARG A 638 -6.181 7.227 -11.309 1.00 21.21 C ATOM 94 C ARG A 638 -7.193 6.776 -12.366 1.00 18.84 C ATOM 95 O ARG A 638 -7.648 5.636 -12.354 1.00 19.51 O ATOM 96 CB ARG A 638 -6.824 8.073 -10.194 1.00 24.72 C ATOM 97 CG ARG A 638 -7.955 7.366 -9.475 1.00 28.89 C ATOM 98 CD ARG A 638 -8.579 8.272 -8.406 1.00 34.96 C ATOM 99 NE ARG A 638 -7.576 8.696 -7.440 1.00 40.39 N ATOM 100 CZ ARG A 638 -7.254 8.044 -6.322 1.00 47.68 C ATOM 101 NH1 ARG A 638 -7.888 6.925 -5.976 1.00 54.68 N ATOM 102 NH2 ARG A 638 -6.300 8.544 -5.530 1.00 51.14 N ATOM 103 HE ARG A 638 -7.068 9.582 -7.638 1.00 0.00 H ATOM 104 HH12 ARG A 638 -7.625 6.428 -5.101 1.00 0.00 H ATOM 105 HH11 ARG A 638 -8.646 6.548 -6.581 1.00 0.00 H ATOM 106 HH22 ARG A 638 -6.038 8.047 -4.655 1.00 0.00 H ATOM 107 HH21 ARG A 638 -5.820 9.430 -5.789 1.00 0.00 H ATOM 108 H ARG A 638 -5.005 8.990 -11.717 1.00 0.00 H ATOM 109 N LYS A 639 -7.536 7.711 -13.242 1.00 19.79 N ATOM 110 CA LYS A 639 -8.417 7.461 -14.405 1.00 19.89 C ATOM 111 C LYS A 639 -7.853 6.341 -15.255 1.00 18.65 C ATOM 112 O LYS A 639 -8.563 5.388 -15.597 1.00 19.56 O ATOM 113 CB LYS A 639 -8.606 8.682 -15.250 1.00 19.41 C ATOM 114 CG LYS A 639 -9.538 8.500 -16.438 1.00 21.23 C ATOM 115 CD LYS A 639 -9.633 9.751 -17.285 1.00 24.86 C ATOM 116 CE LYS A 639 -10.472 9.453 -18.507 1.00 30.68 C ATOM 117 NZ LYS A 639 -10.734 10.695 -19.309 1.00 34.30 N ATOM 118 HZ1 LYS A 639 -11.242 11.386 -18.720 1.00 0.00 H ATOM 119 HZ2 LYS A 639 -9.829 11.102 -19.621 1.00 0.00 H ATOM 120 HZ3 LYS A 639 -11.312 10.454 -20.140 1.00 0.00 H ATOM 121 H LYS A 639 -7.166 8.673 -13.104 1.00 0.00 H ATOM 122 N THR A 640 -6.567 6.472 -15.562 1.00 19.18 N ATOM 123 CA THR A 640 -5.947 5.499 -16.437 1.00 20.14 C ATOM 124 C THR A 640 -5.914 4.106 -15.820 1.00 20.53 C ATOM 125 O THR A 640 -6.202 3.135 -16.477 1.00 20.54 O ATOM 126 CB THR A 640 -4.554 5.989 -16.827 1.00 19.13 C ATOM 127 OG1 THR A 640 -4.601 7.321 -17.344 1.00 20.97 O ATOM 128 CG2 THR A 640 -3.889 5.054 -17.779 1.00 19.65 C ATOM 129 HG1 THR A 640 -4.969 7.929 -16.654 1.00 0.00 H ATOM 130 H THR A 640 -6.012 7.264 -15.179 1.00 0.00 H ATOM 131 N LEU A 641 -5.585 4.028 -14.548 1.00 19.39 N ATOM 132 CA LEU A 641 -5.599 2.762 -13.835 1.00 19.97 C ATOM 133 C LEU A 641 -7.011 2.093 -13.882 1.00 21.14 C ATOM 134 O LEU A 641 -7.145 0.936 -14.185 1.00 20.63 O ATOM 135 CB LEU A 641 -5.076 2.941 -12.405 1.00 21.49 C ATOM 136 CG LEU A 641 -4.919 1.681 -11.577 1.00 24.58 C ATOM 137 CD1 LEU A 641 -4.099 0.616 -12.274 1.00 26.34 C ATOM 138 CD2 LEU A 641 -4.295 2.015 -10.228 1.00 26.16 C ATOM 139 H LEU A 641 -5.308 4.893 -14.041 1.00 0.00 H ATOM 140 N GLU A 642 -8.045 2.872 -13.615 1.00 22.34 N ATOM 141 CA GLU A 642 -9.412 2.390 -13.783 1.00 24.36 C ATOM 142 C GLU A 642 -9.712 1.822 -15.165 1.00 21.28 C ATOM 143 O GLU A 642 -10.332 0.746 -15.298 1.00 23.53 O ATOM 144 CB GLU A 642 -10.416 3.528 -13.485 1.00 27.27 C ATOM 145 CG GLU A 642 -10.492 3.947 -12.042 1.00 33.10 C ATOM 146 CD GLU A 642 -11.607 4.975 -11.770 1.00 37.21 C ATOM 147 OE1 GLU A 642 -12.316 5.454 -12.715 1.00 37.96 O ATOM 148 OE2 GLU A 642 -11.746 5.299 -10.580 1.00 43.38 O ATOM 149 H GLU A 642 -7.882 3.843 -13.280 1.00 0.00 H ATOM 150 N GLN A 643 -9.268 2.523 -16.191 1.00 21.83 N ATOM 151 CA GLN A 643 -9.482 2.115 -17.600 1.00 21.46 C ATOM 152 C GLN A 643 -8.723 0.825 -17.893 1.00 21.79 C ATOM 153 O GLN A 643 -9.247 -0.071 -18.536 1.00 24.76 O ATOM 154 CB GLN A 643 -9.002 3.194 -18.570 1.00 23.20 C ATOM 155 CG GLN A 643 -9.913 4.409 -18.596 1.00 26.23 C ATOM 156 CD GLN A 643 -9.419 5.489 -19.512 1.00 27.52 C ATOM 157 OE1 GLN A 643 -8.242 5.825 -19.514 1.00 29.24 O ATOM 158 NE2 GLN A 643 -10.359 6.117 -20.261 1.00 32.32 N ATOM 159 HE22 GLN A 643 -11.348 5.798 -20.229 1.00 0.00 H ATOM 160 HE21 GLN A 643 -10.091 6.918 -20.868 1.00 0.00 H ATOM 161 H GLN A 643 -8.744 3.401 -16.003 1.00 0.00 H ATOM 162 N LEU A 644 -7.513 0.698 -17.358 1.00 21.39 N ATOM 163 CA LEU A 644 -6.751 -0.544 -17.537 1.00 22.35 C ATOM 164 C LEU A 644 -7.424 -1.707 -16.799 1.00 22.08 C ATOM 165 O LEU A 644 -7.520 -2.773 -17.336 1.00 22.49 O ATOM 166 CB LEU A 644 -5.266 -0.437 -17.120 1.00 21.22 C ATOM 167 CG LEU A 644 -4.442 0.602 -17.891 1.00 21.82 C ATOM 168 CD1 LEU A 644 -3.191 0.955 -17.084 1.00 24.78 C ATOM 169 CD2 LEU A 644 -4.168 0.044 -19.285 1.00 22.17 C ATOM 170 H LEU A 644 -7.104 1.482 -16.810 1.00 0.00 H ATOM 171 N GLN A 645 -7.875 -1.501 -15.566 1.00 21.77 N ATOM 172 CA GLN A 645 -8.592 -2.581 -14.852 1.00 23.39 C ATOM 173 C GLN A 645 -9.866 -3.003 -15.547 1.00 25.41 C ATOM 174 O GLN A 645 -10.221 -4.177 -15.563 1.00 25.17 O ATOM 175 CB GLN A 645 -8.883 -2.180 -13.405 1.00 25.92 C ATOM 176 CG GLN A 645 -7.630 -2.029 -12.576 1.00 25.71 C ATOM 177 CD GLN A 645 -7.885 -2.370 -11.119 1.00 31.48 C ATOM 178 OE1 GLN A 645 -7.799 -1.505 -10.272 1.00 37.14 O ATOM 179 NE2 GLN A 645 -8.173 -3.668 -10.832 1.00 36.16 N ATOM 180 HE22 GLN A 645 -8.234 -4.369 -11.598 1.00 0.00 H ATOM 181 HE21 GLN A 645 -8.332 -3.960 -9.846 1.00 0.00 H ATOM 182 H GLN A 645 -7.724 -0.582 -15.103 1.00 0.00 H ATOM 183 N GLU A 646 -10.544 -2.059 -16.187 1.00 25.68 N ATOM 184 CA GLU A 646 -11.733 -2.350 -16.974 1.00 30.76 C ATOM 185 C GLU A 646 -11.455 -3.264 -18.135 1.00 30.60 C ATOM 186 O GLU A 646 -12.267 -4.109 -18.449 1.00 31.95 O ATOM 187 CB GLU A 646 -12.450 -1.073 -17.410 1.00 31.67 C ATOM 188 CG GLU A 646 -12.852 -0.248 -16.219 1.00 39.78 C ATOM 189 CD GLU A 646 -13.750 0.924 -16.575 1.00 44.22 C ATOM 190 OE1 GLU A 646 -13.863 1.206 -17.794 1.00 45.64 O ATOM 191 OE2 GLU A 646 -14.310 1.556 -15.633 1.00 50.64 O ATOM 192 H GLU A 646 -10.214 -1.075 -16.124 1.00 0.00 H ATOM 193 N LYS A 647 -10.254 -3.191 -18.712 1.00 25.86 N ATOM 194 CA LYS A 647 -9.889 -4.094 -19.768 1.00 26.82 C ATOM 195 C LYS A 647 -9.608 -5.508 -19.263 1.00 26.84 C ATOM 196 O LYS A 647 -9.672 -6.452 -20.023 1.00 31.23 O ATOM 197 CB LYS A 647 -8.691 -3.587 -20.546 1.00 27.50 C ATOM 198 CG LYS A 647 -8.862 -2.173 -21.077 1.00 26.97 C ATOM 199 CD LYS A 647 -9.999 -2.086 -22.078 1.00 28.39 C ATOM 200 CE LYS A 647 -9.885 -0.826 -22.919 1.00 31.35 C ATOM 201 NZ LYS A 647 -11.124 -0.763 -23.755 1.00 34.79 N ATOM 202 HZ1 LYS A 647 -11.178 -1.610 -24.357 1.00 0.00 H ATOM 203 HZ2 LYS A 647 -11.958 -0.723 -23.135 1.00 0.00 H ATOM 204 HZ3 LYS A 647 -11.094 0.087 -24.353 1.00 0.00 H ATOM 205 H LYS A 647 -9.574 -2.472 -18.393 1.00 0.00 H ATOM 206 N ASP A 648 -9.240 -5.632 -17.994 1.00 26.12 N ATOM 207 CA ASP A 648 -9.045 -6.949 -17.387 1.00 26.06 C ATOM 208 C ASP A 648 -10.422 -7.467 -16.898 1.00 25.44 C ATOM 209 O ASP A 648 -10.746 -7.391 -15.737 1.00 27.97 O ATOM 210 CB ASP A 648 -8.013 -6.850 -16.272 1.00 23.66 C ATOM 211 CG ASP A 648 -7.845 -8.136 -15.477 1.00 23.26 C ATOM 212 OD1 ASP A 648 -8.184 -9.262 -15.968 1.00 23.56 O ATOM 213 OD2 ASP A 648 -7.380 -7.932 -14.324 1.00 24.36 O ATOM 214 H ASP A 648 -9.087 -4.778 -17.421 1.00 0.00 H ATOM 215 N THR A 649 -11.204 -7.992 -17.834 1.00 28.49 N ATOM 216 CA THR A 649 -12.617 -8.256 -17.537 1.00 27.30 C ATOM 217 C THR A 649 -12.742 -9.432 -16.607 1.00 26.53 C ATOM 218 O THR A 649 -13.725 -9.536 -15.893 1.00 29.10 O ATOM 219 CB THR A 649 -13.410 -8.571 -18.814 1.00 30.30 C ATOM 220 OG1 THR A 649 -12.757 -9.633 -19.503 1.00 30.73 O ATOM 221 CG2 THR A 649 -13.452 -7.335 -19.727 1.00 34.00 C ATOM 222 HG1 THR A 649 -13.259 -9.846 -20.329 1.00 0.00 H ATOM 223 H THR A 649 -10.817 -8.215 -18.773 1.00 0.00 H ATOM 224 N GLY A 650 -11.733 -10.296 -16.591 1.00 28.19 N ATOM 225 CA GLY A 650 -11.770 -11.478 -15.680 1.00 28.60 C ATOM 226 C GLY A 650 -11.181 -11.221 -14.332 1.00 26.28 C ATOM 227 O GLY A 650 -11.108 -12.137 -13.498 1.00 29.26 O ATOM 228 H GLY A 650 -10.914 -10.148 -17.215 1.00 0.00 H ATOM 229 N ASN A 651 -10.698 -10.006 -14.095 1.00 24.65 N ATOM 230 CA ASN A 651 -10.006 -9.663 -12.854 1.00 24.68 C ATOM 231 C ASN A 651 -8.813 -10.568 -12.538 1.00 25.13 C ATOM 232 O ASN A 651 -8.409 -10.739 -11.383 1.00 27.28 O ATOM 233 CB ASN A 651 -10.994 -9.603 -11.663 1.00 27.39 C ATOM 234 CG ASN A 651 -11.919 -8.409 -11.750 1.00 32.12 C ATOM 235 OD1 ASN A 651 -11.616 -7.409 -12.406 1.00 33.01 O ATOM 236 ND2 ASN A 651 -13.060 -8.499 -11.075 1.00 34.54 N ATOM 237 HD22 ASN A 651 -13.278 -9.360 -10.534 1.00 0.00 H ATOM 238 HD21 ASN A 651 -13.735 -7.708 -11.088 1.00 0.00 H ATOM 239 H ASN A 651 -10.817 -9.271 -14.821 1.00 0.00 H ATOM 240 N ILE A 652 -8.194 -11.077 -13.581 1.00 25.57 N ATOM 241 CA ILE A 652 -7.016 -11.934 -13.474 1.00 26.03 C ATOM 242 C ILE A 652 -5.810 -11.201 -12.859 1.00 23.28 C ATOM 243 O ILE A 652 -4.995 -11.816 -12.145 1.00 27.59 O ATOM 244 CB ILE A 652 -6.691 -12.533 -14.894 1.00 25.40 C ATOM 245 CG1 ILE A 652 -7.803 -13.496 -15.289 1.00 29.87 C ATOM 246 CG2 ILE A 652 -5.375 -13.258 -14.918 1.00 26.55 C ATOM 247 CD1 ILE A 652 -7.875 -13.936 -16.729 1.00 30.62 C ATOM 248 H ILE A 652 -8.562 -10.858 -14.529 1.00 0.00 H ATOM 249 N PHE A 653 -5.715 -9.885 -13.067 1.00 21.01 N ATOM 250 CA PHE A 653 -4.543 -9.127 -12.707 1.00 22.91 C ATOM 251 C PHE A 653 -4.843 -8.128 -11.579 1.00 23.95 C ATOM 252 O PHE A 653 -4.007 -7.297 -11.306 1.00 23.89 O ATOM 253 CB PHE A 653 -3.990 -8.417 -13.945 1.00 22.19 C ATOM 254 CG PHE A 653 -3.681 -9.363 -15.078 1.00 22.71 C ATOM 255 CD1 PHE A 653 -2.606 -10.248 -15.006 1.00 22.68 C ATOM 256 CD2 PHE A 653 -4.519 -9.418 -16.184 1.00 22.79 C ATOM 257 CE1 PHE A 653 -2.337 -11.139 -16.025 1.00 23.21 C ATOM 258 CE2 PHE A 653 -4.263 -10.334 -17.171 1.00 24.31 C ATOM 259 CZ PHE A 653 -3.186 -11.207 -17.104 1.00 21.25 C ATOM 260 H PHE A 653 -6.517 -9.389 -13.505 1.00 0.00 H ATOM 261 N SER A 654 -6.031 -8.273 -10.946 1.00 28.36 N ATOM 262 CA SER A 654 -6.526 -7.359 -9.909 1.00 29.51 C ATOM 263 C SER A 654 -5.689 -7.461 -8.629 1.00 31.87 C ATOM 264 O SER A 654 -5.550 -6.488 -7.883 1.00 34.50 O ATOM 265 CB SER A 654 -8.002 -7.672 -9.558 1.00 30.60 C ATOM 266 OG SER A 654 -8.928 -7.286 -10.565 1.00 31.38 O ATOM 267 HG SER A 654 -8.863 -6.310 -10.715 1.00 0.00 H ATOM 268 H SER A 654 -6.630 -9.081 -11.210 1.00 0.00 H ATOM 269 N GLU A 655 -5.145 -8.645 -8.377 1.00 27.03 N ATOM 270 CA GLU A 655 -4.457 -8.918 -7.127 1.00 28.85 C ATOM 271 C GLU A 655 -3.209 -9.709 -7.408 1.00 27.87 C ATOM 272 O GLU A 655 -3.117 -10.400 -8.457 1.00 26.37 O ATOM 273 CB GLU A 655 -5.366 -9.737 -6.210 1.00 37.01 C ATOM 274 CG GLU A 655 -6.615 -9.005 -5.754 1.00 41.91 C ATOM 275 CD GLU A 655 -7.368 -9.818 -4.701 1.00 49.68 C ATOM 276 OE1 GLU A 655 -7.618 -11.025 -4.966 1.00 53.32 O ATOM 277 OE2 GLU A 655 -7.697 -9.263 -3.618 1.00 53.10 O ATOM 278 H GLU A 655 -5.213 -9.397 -9.093 1.00 0.00 H ATOM 279 N PRO A 656 -2.259 -9.694 -6.452 1.00 27.70 N ATOM 280 CA PRO A 656 -1.056 -10.452 -6.645 1.00 26.69 C ATOM 281 C PRO A 656 -1.268 -11.936 -6.936 1.00 28.42 C ATOM 282 O PRO A 656 -2.184 -12.585 -6.416 1.00 31.29 O ATOM 283 CB PRO A 656 -0.310 -10.272 -5.284 1.00 31.36 C ATOM 284 CG PRO A 656 -0.843 -8.993 -4.758 1.00 30.49 C ATOM 285 CD PRO A 656 -2.281 -9.022 -5.131 1.00 29.38 C ATOM 286 N VAL A 657 -0.407 -12.499 -7.795 1.00 29.60 N ATOM 287 CA VAL A 657 -0.450 -13.934 -8.024 1.00 27.94 C ATOM 288 C VAL A 657 -0.219 -14.637 -6.686 1.00 30.46 C ATOM 289 O VAL A 657 0.727 -14.301 -5.994 1.00 31.40 O ATOM 290 CB VAL A 657 0.606 -14.349 -9.027 1.00 28.67 C ATOM 291 CG1 VAL A 657 0.700 -15.856 -9.126 1.00 31.23 C ATOM 292 CG2 VAL A 657 0.247 -13.739 -10.374 1.00 28.62 C ATOM 293 H VAL A 657 0.290 -11.911 -8.296 1.00 0.00 H ATOM 294 N PRO A 658 -1.092 -15.585 -6.347 1.00 31.13 N ATOM 295 CA PRO A 658 -1.006 -16.148 -4.989 1.00 35.71 C ATOM 296 C PRO A 658 0.001 -17.274 -4.876 1.00 38.73 C ATOM 297 O PRO A 658 -0.093 -18.283 -5.576 1.00 36.76 O ATOM 298 CB PRO A 658 -2.404 -16.656 -4.764 1.00 35.35 C ATOM 299 CG PRO A 658 -2.863 -17.058 -6.124 1.00 36.36 C ATOM 300 CD PRO A 658 -2.332 -15.974 -7.005 1.00 33.31 C ATOM 301 N LEU A 659 0.943 -17.110 -3.963 1.00 44.77 N ATOM 302 CA LEU A 659 2.017 -18.090 -3.819 1.00 50.15 C ATOM 303 C LEU A 659 1.537 -19.415 -3.216 1.00 52.15 C ATOM 304 O LEU A 659 2.183 -20.445 -3.394 1.00 51.14 O ATOM 305 CB LEU A 659 3.185 -17.482 -3.043 1.00 53.24 C ATOM 306 CG LEU A 659 3.797 -16.213 -3.663 1.00 55.56 C ATOM 307 CD1 LEU A 659 5.155 -15.922 -3.038 1.00 56.89 C ATOM 308 CD2 LEU A 659 3.930 -16.304 -5.181 1.00 57.50 C ATOM 309 H LEU A 659 0.919 -16.276 -3.342 1.00 0.00 H ATOM 310 N SER A 660 0.381 -19.392 -2.550 1.00 55.22 N ATOM 311 CA SER A 660 -0.249 -20.612 -2.065 1.00 55.09 C ATOM 312 C SER A 660 -0.614 -21.504 -3.252 1.00 58.09 C ATOM 313 O SER A 660 -0.251 -22.689 -3.286 1.00 53.27 O ATOM 314 CB SER A 660 -1.482 -20.293 -1.206 1.00 57.25 C ATOM 315 OG SER A 660 -2.503 -19.628 -1.945 1.00 58.78 O ATOM 316 HG SER A 660 -3.273 -19.445 -1.350 1.00 0.00 H ATOM 317 H SER A 660 -0.083 -18.478 -2.372 1.00 0.00 H ATOM 318 N GLU A 661 -1.287 -20.910 -4.243 1.00 54.91 N ATOM 319 CA GLU A 661 -1.708 -21.629 -5.442 1.00 53.09 C ATOM 320 C GLU A 661 -0.567 -21.801 -6.445 1.00 44.30 C ATOM 321 O GLU A 661 -0.599 -22.737 -7.238 1.00 47.68 O ATOM 322 CB GLU A 661 -2.897 -20.928 -6.117 1.00 53.14 C ATOM 323 CG GLU A 661 -4.136 -20.811 -5.249 1.00 56.84 C ATOM 324 CD GLU A 661 -4.756 -22.161 -4.936 1.00 59.84 C ATOM 325 OE1 GLU A 661 -5.235 -22.849 -5.861 1.00 61.75 O ATOM 326 OE2 GLU A 661 -4.753 -22.536 -3.752 1.00 64.80 O ATOM 327 H GLU A 661 -1.519 -19.900 -4.157 1.00 0.00 H ATOM 328 N VAL A 662 0.439 -20.922 -6.376 1.00 41.78 N ATOM 329 CA VAL A 662 1.544 -20.876 -7.358 1.00 39.49 C ATOM 330 C VAL A 662 2.921 -20.812 -6.690 1.00 42.47 C ATOM 331 O VAL A 662 3.600 -19.785 -6.706 1.00 37.69 O ATOM 332 CB VAL A 662 1.358 -19.669 -8.324 1.00 37.65 C ATOM 333 CG1 VAL A 662 2.283 -19.798 -9.521 1.00 37.96 C ATOM 334 CG2 VAL A 662 -0.101 -19.543 -8.743 1.00 36.50 C ATOM 335 H VAL A 662 0.444 -20.237 -5.593 1.00 0.00 H ATOM 336 N PRO A 663 3.363 -21.947 -6.098 1.00 44.29 N ATOM 337 CA PRO A 663 4.576 -21.909 -5.274 1.00 44.85 C ATOM 338 C PRO A 663 5.911 -21.570 -5.956 1.00 42.56 C ATOM 339 O PRO A 663 6.800 -21.049 -5.290 1.00 42.53 O ATOM 340 CB PRO A 663 4.629 -23.326 -4.696 1.00 46.70 C ATOM 341 CG PRO A 663 3.200 -23.772 -4.663 1.00 47.52 C ATOM 342 CD PRO A 663 2.623 -23.212 -5.931 1.00 47.69 C ATOM 343 N ASP A 664 6.072 -21.863 -7.248 1.00 39.66 N ATOM 344 CA ASP A 664 7.326 -21.542 -7.949 1.00 42.34 C ATOM 345 C ASP A 664 7.419 -20.133 -8.634 1.00 37.94 C ATOM 346 O ASP A 664 8.358 -19.852 -9.380 1.00 38.62 O ATOM 347 CB ASP A 664 7.600 -22.626 -9.000 1.00 40.69 C ATOM 348 CG ASP A 664 6.588 -22.600 -10.171 1.00 44.01 C ATOM 349 OD1 ASP A 664 5.457 -22.108 -9.991 1.00 39.59 O ATOM 350 OD2 ASP A 664 6.919 -23.105 -11.259 1.00 41.93 O ATOM 351 H ASP A 664 5.299 -22.326 -7.768 1.00 0.00 H ATOM 352 N TYR A 665 6.453 -19.264 -8.383 1.00 38.74 N ATOM 353 CA TYR A 665 6.298 -18.047 -9.201 1.00 35.00 C ATOM 354 C TYR A 665 7.538 -17.182 -9.106 1.00 35.16 C ATOM 355 O TYR A 665 8.006 -16.642 -10.092 1.00 37.53 O ATOM 356 CB TYR A 665 5.044 -17.280 -8.751 1.00 32.07 C ATOM 357 CG TYR A 665 4.681 -16.148 -9.686 1.00 30.00 C ATOM 358 CD1 TYR A 665 4.134 -16.408 -10.943 1.00 30.22 C ATOM 359 CD2 TYR A 665 4.894 -14.820 -9.320 1.00 32.28 C ATOM 360 CE1 TYR A 665 3.799 -15.349 -11.788 1.00 27.10 C ATOM 361 CE2 TYR A 665 4.551 -13.757 -10.168 1.00 31.72 C ATOM 362 CZ TYR A 665 4.017 -14.051 -11.418 1.00 28.38 C ATOM 363 OH TYR A 665 3.665 -12.997 -12.276 1.00 26.12 O ATOM 364 HH TYR A 665 3.303 -13.367 -13.120 1.00 0.00 H ATOM 365 H TYR A 665 5.794 -19.442 -7.598 1.00 0.00 H ATOM 366 N LEU A 666 8.124 -17.097 -7.899 1.00 39.21 N ATOM 367 CA LEU A 666 9.273 -16.221 -7.670 1.00 41.95 C ATOM 368 C LEU A 666 10.601 -16.797 -8.173 1.00 41.50 C ATOM 369 O LEU A 666 11.575 -16.062 -8.313 1.00 44.87 O ATOM 370 CB LEU A 666 9.350 -15.852 -6.178 1.00 42.58 C ATOM 371 CG LEU A 666 8.099 -15.096 -5.730 1.00 41.88 C ATOM 372 CD1 LEU A 666 8.083 -14.950 -4.208 1.00 46.32 C ATOM 373 CD2 LEU A 666 8.046 -13.740 -6.416 1.00 43.42 C ATOM 374 H LEU A 666 7.753 -17.666 -7.112 1.00 0.00 H ATOM 375 N ASP A 667 10.632 -18.098 -8.468 1.00 45.74 N ATOM 376 CA ASP A 667 11.777 -18.686 -9.163 1.00 49.42 C ATOM 377 C ASP A 667 11.931 -18.064 -10.554 1.00 52.14 C ATOM 378 O ASP A 667 13.047 -17.963 -11.104 1.00 45.25 O ATOM 379 CB ASP A 667 11.616 -20.209 -9.321 1.00 53.99 C ATOM 380 CG ASP A 667 11.510 -20.934 -7.997 1.00 57.19 C ATOM 381 OD1 ASP A 667 12.015 -20.399 -6.983 1.00 56.00 O ATOM 382 OD2 ASP A 667 10.926 -22.043 -7.985 1.00 62.61 O ATOM 383 H ASP A 667 9.830 -18.703 -8.200 1.00 0.00 H ATOM 384 N HIS A 668 10.808 -17.641 -11.132 1.00 46.85 N ATOM 385 CA HIS A 668 10.821 -17.144 -12.501 1.00 46.02 C ATOM 386 C HIS A 668 10.673 -15.642 -12.589 1.00 40.33 C ATOM 387 O HIS A 668 11.334 -14.997 -13.387 1.00 42.48 O ATOM 388 CB HIS A 668 9.735 -17.831 -13.288 1.00 47.57 C ATOM 389 CG HIS A 668 9.867 -19.320 -13.289 1.00 55.36 C ATOM 390 ND1 HIS A 668 9.221 -20.126 -12.373 1.00 55.91 N ATOM 391 CD2 HIS A 668 10.598 -20.146 -14.072 1.00 58.13 C ATOM 392 CE1 HIS A 668 9.539 -21.387 -12.603 1.00 60.43 C ATOM 393 NE2 HIS A 668 10.374 -21.425 -13.627 1.00 60.95 N ATOM 394 H HIS A 668 9.914 -17.666 -10.601 1.00 0.00 H ATOM 395 N ILE A 669 9.821 -15.099 -11.733 1.00 39.00 N ATOM 396 CA ILE A 669 9.453 -13.706 -11.785 1.00 34.79 C ATOM 397 C ILE A 669 10.108 -12.926 -10.651 1.00 34.89 C ATOM 398 O ILE A 669 9.767 -13.108 -9.498 1.00 36.47 O ATOM 399 CB ILE A 669 7.930 -13.580 -11.657 1.00 33.06 C ATOM 400 CG1 ILE A 669 7.203 -14.328 -12.803 1.00 32.91 C ATOM 401 CG2 ILE A 669 7.521 -12.122 -11.621 1.00 33.97 C ATOM 402 CD1 ILE A 669 7.697 -14.000 -14.177 1.00 34.55 C ATOM 403 H ILE A 669 9.401 -15.700 -10.995 1.00 0.00 H ATOM 404 N LYS A 670 11.003 -12.029 -11.016 1.00 34.35 N ATOM 405 CA LYS A 670 11.757 -11.242 -10.065 1.00 41.79 C ATOM 406 C LYS A 670 10.923 -10.119 -9.457 1.00 39.06 C ATOM 407 O LYS A 670 11.025 -9.850 -8.260 1.00 39.74 O ATOM 408 CB LYS A 670 12.980 -10.658 -10.756 1.00 46.12 C ATOM 409 CG LYS A 670 13.913 -9.906 -9.820 1.00 55.49 C ATOM 410 H LYS A 670 11.174 -11.881 -12.031 1.00 0.00 H ATOM 411 N LYS A 671 10.083 -9.475 -10.265 1.00 33.83 N ATOM 412 CA LYS A 671 9.264 -8.395 -9.738 1.00 35.55 C ATOM 413 C LYS A 671 7.758 -8.550 -10.072 1.00 31.12 C ATOM 414 O LYS A 671 7.294 -8.010 -11.088 1.00 30.11 O ATOM 415 CB LYS A 671 9.774 -7.058 -10.228 1.00 39.78 C ATOM 416 CG LYS A 671 8.980 -5.898 -9.634 1.00 43.66 C ATOM 417 CD LYS A 671 9.676 -4.561 -9.698 1.00 45.52 C ATOM 418 CE LYS A 671 8.722 -3.475 -9.225 1.00 47.28 C ATOM 419 NZ LYS A 671 9.325 -2.123 -9.389 1.00 50.66 N ATOM 420 HZ1 LYS A 671 10.200 -2.065 -8.830 1.00 0.00 H ATOM 421 HZ2 LYS A 671 9.543 -1.961 -10.393 1.00 0.00 H ATOM 422 HZ3 LYS A 671 8.652 -1.402 -9.058 1.00 0.00 H ATOM 423 H LYS A 671 10.013 -9.743 -11.267 1.00 0.00 H ATOM 424 N PRO A 672 7.007 -9.257 -9.204 1.00 30.83 N ATOM 425 CA PRO A 672 5.589 -9.380 -9.422 1.00 29.82 C ATOM 426 C PRO A 672 4.913 -8.014 -9.405 1.00 30.59 C ATOM 427 O PRO A 672 5.406 -7.059 -8.799 1.00 30.05 O ATOM 428 CB PRO A 672 5.104 -10.239 -8.257 1.00 31.55 C ATOM 429 CG PRO A 672 6.304 -10.917 -7.746 1.00 33.01 C ATOM 430 CD PRO A 672 7.404 -9.948 -7.969 1.00 31.62 C ATOM 431 N MET A 673 3.823 -7.934 -10.153 1.00 25.18 N ATOM 432 CA MET A 673 3.050 -6.707 -10.240 1.00 24.67 C ATOM 433 C MET A 673 1.593 -7.118 -10.541 1.00 24.19 C ATOM 434 O MET A 673 1.274 -8.194 -11.093 1.00 23.87 O ATOM 435 CB MET A 673 3.645 -5.762 -11.315 1.00 24.40 C ATOM 436 CG MET A 673 3.051 -4.353 -11.367 1.00 26.16 C ATOM 437 SD MET A 673 2.990 -3.527 -9.771 1.00 30.04 S ATOM 438 CE MET A 673 4.731 -3.673 -9.304 1.00 31.54 C ATOM 439 H MET A 673 3.513 -8.769 -10.690 1.00 0.00 H ATOM 440 N ASP A 674 0.677 -6.224 -10.137 1.00 24.82 N ATOM 441 CA ASP A 674 -0.758 -6.485 -10.202 1.00 25.10 C ATOM 442 C ASP A 674 -1.403 -5.115 -9.949 1.00 21.79 C ATOM 443 O ASP A 674 -0.732 -4.212 -9.533 1.00 24.37 O ATOM 444 CB ASP A 674 -1.260 -7.481 -9.190 1.00 26.07 C ATOM 445 CG ASP A 674 -1.106 -6.971 -7.784 1.00 32.52 C ATOM 446 OD1 ASP A 674 0.032 -7.023 -7.329 1.00 31.75 O ATOM 447 OD2 ASP A 674 -2.106 -6.481 -7.220 1.00 33.32 O ATOM 448 H ASP A 674 1.002 -5.310 -9.763 1.00 0.00 H ATOM 449 N PHE A 675 -2.679 -4.970 -10.288 1.00 24.62 N ATOM 450 CA PHE A 675 -3.332 -3.671 -10.231 1.00 22.53 C ATOM 451 C PHE A 675 -3.570 -3.165 -8.794 1.00 23.94 C ATOM 452 O PHE A 675 -3.607 -1.940 -8.580 1.00 26.23 O ATOM 453 CB PHE A 675 -4.647 -3.696 -10.971 1.00 23.17 C ATOM 454 CG PHE A 675 -4.524 -3.772 -12.455 1.00 22.19 C ATOM 455 CD1 PHE A 675 -3.813 -2.802 -13.136 1.00 22.22 C ATOM 456 CD2 PHE A 675 -5.196 -4.749 -13.167 1.00 22.49 C ATOM 457 CE1 PHE A 675 -3.741 -2.824 -14.515 1.00 23.94 C ATOM 458 CE2 PHE A 675 -5.183 -4.756 -14.549 1.00 23.91 C ATOM 459 CZ PHE A 675 -4.422 -3.802 -15.216 1.00 21.97 C ATOM 460 H PHE A 675 -3.222 -5.801 -10.600 1.00 0.00 H ATOM 461 N PHE A 676 -3.651 -4.088 -7.839 1.00 27.12 N ATOM 462 CA PHE A 676 -3.819 -3.679 -6.409 1.00 29.18 C ATOM 463 C PHE A 676 -2.542 -3.021 -5.926 1.00 28.47 C ATOM 464 O PHE A 676 -2.574 -1.965 -5.279 1.00 28.95 O ATOM 465 CB PHE A 676 -4.174 -4.892 -5.558 1.00 30.94 C ATOM 466 CG PHE A 676 -4.506 -4.569 -4.121 1.00 39.20 C ATOM 467 CD1 PHE A 676 -5.773 -4.143 -3.768 1.00 44.09 C ATOM 468 CD2 PHE A 676 -3.550 -4.725 -3.139 1.00 45.92 C ATOM 469 CE1 PHE A 676 -6.089 -3.868 -2.445 1.00 47.35 C ATOM 470 CE2 PHE A 676 -3.844 -4.449 -1.800 1.00 48.86 C ATOM 471 CZ PHE A 676 -5.117 -4.024 -1.459 1.00 46.23 C ATOM 472 H PHE A 676 -3.597 -5.097 -8.087 1.00 0.00 H ATOM 473 N THR A 677 -1.397 -3.620 -6.238 1.00 28.22 N ATOM 474 CA THR A 677 -0.105 -2.986 -6.029 1.00 28.10 C ATOM 475 C THR A 677 0.085 -1.629 -6.710 1.00 29.01 C ATOM 476 O THR A 677 0.621 -0.700 -6.154 1.00 28.52 O ATOM 477 CB THR A 677 1.009 -3.986 -6.418 1.00 30.06 C ATOM 478 OG1 THR A 677 0.840 -5.172 -5.614 1.00 33.08 O ATOM 479 CG2 THR A 677 2.348 -3.406 -6.259 1.00 32.33 C ATOM 480 HG1 THR A 677 -0.051 -5.565 -5.791 1.00 0.00 H ATOM 481 H THR A 677 -1.426 -4.576 -6.646 1.00 0.00 H ATOM 482 N MET A 678 -0.358 -1.506 -7.967 1.00 25.15 N ATOM 483 CA MET A 678 -0.306 -0.250 -8.627 1.00 25.87 C ATOM 484 C MET A 678 -1.173 0.775 -7.889 1.00 24.75 C ATOM 485 O MET A 678 -0.770 1.933 -7.800 1.00 28.78 O ATOM 486 CB MET A 678 -0.772 -0.374 -10.096 1.00 26.04 C ATOM 487 CG MET A 678 0.238 -1.133 -10.964 1.00 24.92 C ATOM 488 SD MET A 678 -0.114 -1.077 -12.727 1.00 23.85 S ATOM 489 CE MET A 678 0.177 0.630 -13.128 1.00 26.03 C ATOM 490 H MET A 678 -0.743 -2.335 -8.463 1.00 0.00 H ATOM 491 N LYS A 679 -2.353 0.361 -7.414 1.00 25.45 N ATOM 492 CA LYS A 679 -3.263 1.307 -6.782 1.00 26.63 C ATOM 493 C LYS A 679 -2.606 1.766 -5.492 1.00 28.53 C ATOM 494 O LYS A 679 -2.591 2.955 -5.193 1.00 29.69 O ATOM 495 CB LYS A 679 -4.589 0.680 -6.486 1.00 29.53 C ATOM 496 CG LYS A 679 -5.618 1.682 -5.969 1.00 35.85 C ATOM 497 CD LYS A 679 -6.793 0.969 -5.313 1.00 40.73 C ATOM 498 CE LYS A 679 -7.850 1.940 -4.802 1.00 46.92 C ATOM 499 NZ LYS A 679 -8.604 1.377 -3.638 1.00 49.94 N ATOM 500 HZ1 LYS A 679 -9.079 0.498 -3.927 1.00 0.00 H ATOM 501 HZ2 LYS A 679 -7.942 1.176 -2.862 1.00 0.00 H ATOM 502 HZ3 LYS A 679 -9.314 2.067 -3.319 1.00 0.00 H ATOM 503 H LYS A 679 -2.622 -0.640 -7.496 1.00 0.00 H ATOM 504 N GLN A 680 -2.062 0.788 -4.769 1.00 30.79 N ATOM 505 CA GLN A 680 -1.225 1.094 -3.550 1.00 35.26 C ATOM 506 C GLN A 680 -0.117 2.108 -3.813 1.00 34.30 C ATOM 507 O GLN A 680 0.064 3.063 -3.041 1.00 36.51 O ATOM 508 CB GLN A 680 -0.601 -0.171 -2.966 1.00 36.50 C ATOM 509 CG GLN A 680 -1.494 -1.376 -2.645 1.00 42.65 C ATOM 510 CD GLN A 680 -2.859 -1.052 -2.080 1.00 44.63 C ATOM 511 OE1 GLN A 680 -3.805 -0.742 -2.828 1.00 46.49 O ATOM 512 NE2 GLN A 680 -2.993 -1.178 -0.743 1.00 51.88 N ATOM 513 HE22 GLN A 680 -2.172 -1.439 -0.160 1.00 0.00 H ATOM 514 HE21 GLN A 680 -3.917 -1.014 -0.295 1.00 0.00 H ATOM 515 H GLN A 680 -2.216 -0.202 -5.049 1.00 0.00 H ATOM 516 N ASN A 681 0.645 1.926 -4.894 1.00 32.09 N ATOM 517 CA ASN A 681 1.672 2.818 -5.305 1.00 32.18 C ATOM 518 C ASN A 681 1.154 4.213 -5.618 1.00 36.69 C ATOM 519 O ASN A 681 1.814 5.199 -5.320 1.00 35.81 O ATOM 520 CB ASN A 681 2.449 2.278 -6.518 1.00 34.67 C ATOM 521 CG ASN A 681 3.336 1.087 -6.165 1.00 37.58 C ATOM 522 OD1 ASN A 681 3.619 0.840 -4.972 1.00 39.11 O ATOM 523 ND2 ASN A 681 3.783 0.336 -7.191 1.00 33.65 N ATOM 524 HD22 ASN A 681 3.521 0.581 -8.167 1.00 0.00 H ATOM 525 HD21 ASN A 681 4.390 -0.488 -7.006 1.00 0.00 H ATOM 526 H ASN A 681 0.476 1.078 -5.472 1.00 0.00 H ATOM 527 N LEU A 682 -0.003 4.278 -6.280 1.00 31.81 N ATOM 528 CA LEU A 682 -0.546 5.552 -6.709 1.00 34.22 C ATOM 529 C LEU A 682 -0.880 6.407 -5.508 1.00 34.16 C ATOM 530 O LEU A 682 -0.567 7.591 -5.453 1.00 39.16 O ATOM 531 CB LEU A 682 -1.820 5.299 -7.552 1.00 34.06 C ATOM 532 CG LEU A 682 -2.562 6.553 -8.011 1.00 36.38 C ATOM 533 CD1 LEU A 682 -1.619 7.423 -8.816 1.00 36.44 C ATOM 534 CD2 LEU A 682 -3.774 6.148 -8.846 1.00 39.96 C ATOM 535 H LEU A 682 -0.523 3.402 -6.491 1.00 0.00 H ATOM 536 N GLU A 683 -1.489 5.781 -4.546 1.00 35.19 N ATOM 537 CA GLU A 683 -2.003 6.478 -3.382 1.00 39.73 C ATOM 538 C GLU A 683 -0.911 6.865 -2.405 1.00 43.14 C ATOM 539 O GLU A 683 -1.079 7.810 -1.633 1.00 40.41 O ATOM 540 CB GLU A 683 -3.033 5.611 -2.745 1.00 39.42 C ATOM 541 CG GLU A 683 -4.224 5.561 -3.695 1.00 44.26 C ATOM 542 CD GLU A 683 -5.415 4.864 -3.153 1.00 47.78 C ATOM 543 OE1 GLU A 683 -5.242 4.023 -2.241 1.00 50.58 O ATOM 544 OE2 GLU A 683 -6.519 5.162 -3.690 1.00 50.10 O ATOM 545 H GLU A 683 -1.612 4.750 -4.612 1.00 0.00 H ATOM 546 N ALA A 684 0.217 6.163 -2.490 1.00 42.18 N ATOM 547 CA ALA A 684 1.437 6.530 -1.760 1.00 44.44 C ATOM 548 C ALA A 684 2.332 7.471 -2.560 1.00 48.50 C ATOM 549 O ALA A 684 3.527 7.572 -2.295 1.00 51.66 O ATOM 550 CB ALA A 684 2.219 5.262 -1.412 1.00 45.42 C ATOM 551 H ALA A 684 0.235 5.320 -3.099 1.00 0.00 H ATOM 552 N TYR A 685 1.785 8.122 -3.584 1.00 45.50 N ATOM 553 CA TYR A 685 2.540 9.067 -4.395 1.00 51.07 C ATOM 554 C TYR A 685 3.861 8.505 -4.919 1.00 50.78 C ATOM 555 O TYR A 685 4.771 9.272 -5.235 1.00 52.28 O ATOM 556 CB TYR A 685 2.744 10.366 -3.601 1.00 54.97 C ATOM 557 CG TYR A 685 1.417 10.920 -3.144 1.00 57.82 C ATOM 558 CD1 TYR A 685 0.742 10.359 -2.066 1.00 59.28 C ATOM 559 CD2 TYR A 685 0.811 11.975 -3.821 1.00 62.11 C ATOM 560 CE1 TYR A 685 -0.491 10.843 -1.661 1.00 62.31 C ATOM 561 CE2 TYR A 685 -0.420 12.466 -3.425 1.00 62.10 C ATOM 562 CZ TYR A 685 -1.067 11.895 -2.346 1.00 61.42 C ATOM 563 OH TYR A 685 -2.286 12.376 -1.940 1.00 64.11 O ATOM 564 HH TYR A 685 -2.602 11.855 -1.160 1.00 0.00 H ATOM 565 H TYR A 685 0.785 7.950 -3.813 1.00 0.00 H ATOM 566 N ARG A 686 3.952 7.175 -5.049 1.00 49.05 N ATOM 567 CA ARG A 686 5.174 6.543 -5.559 1.00 48.24 C ATOM 568 C ARG A 686 5.384 6.767 -7.068 1.00 50.81 C ATOM 569 O ARG A 686 6.532 6.692 -7.525 1.00 54.79 O ATOM 570 CB ARG A 686 5.220 5.046 -5.195 1.00 49.67 C ATOM 571 CG ARG A 686 5.228 4.761 -3.693 1.00 51.40 C ATOM 572 CD ARG A 686 5.239 3.266 -3.329 1.00 52.09 C ATOM 573 NE ARG A 686 4.923 3.044 -1.906 1.00 49.71 N ATOM 574 CZ ARG A 686 3.910 2.326 -1.408 1.00 48.71 C ATOM 575 NH1 ARG A 686 3.048 1.664 -2.188 1.00 51.08 N ATOM 576 NH2 ARG A 686 3.748 2.250 -0.093 1.00 48.70 N ATOM 577 HE ARG A 686 5.556 3.494 -1.215 1.00 0.00 H ATOM 578 HH12 ARG A 686 2.274 1.117 -1.760 1.00 0.00 H ATOM 579 HH11 ARG A 686 3.152 1.696 -3.222 1.00 0.00 H ATOM 580 HH22 ARG A 686 2.963 1.694 0.303 1.00 0.00 H ATOM 581 HH21 ARG A 686 4.406 2.746 0.542 1.00 0.00 H ATOM 582 H ARG A 686 3.142 6.579 -4.784 1.00 0.00 H ATOM 583 N TYR A 687 4.314 7.046 -7.846 1.00 42.18 N ATOM 584 CA TYR A 687 4.454 7.396 -9.290 1.00 39.55 C ATOM 585 C TYR A 687 4.748 8.864 -9.631 1.00 46.65 C ATOM 586 O TYR A 687 3.837 9.675 -9.863 1.00 45.16 O ATOM 587 CB TYR A 687 3.239 6.931 -10.143 1.00 37.01 C ATOM 588 CG TYR A 687 3.061 5.448 -10.134 1.00 32.39 C ATOM 589 CD1 TYR A 687 4.060 4.605 -10.637 1.00 34.32 C ATOM 590 CD2 TYR A 687 1.902 4.858 -9.625 1.00 30.36 C ATOM 591 CE1 TYR A 687 3.924 3.229 -10.591 1.00 35.03 C ATOM 592 CE2 TYR A 687 1.741 3.484 -9.594 1.00 30.28 C ATOM 593 CZ TYR A 687 2.747 2.673 -10.082 1.00 32.25 C ATOM 594 OH TYR A 687 2.569 1.332 -10.028 1.00 34.44 O ATOM 595 HH TYR A 687 3.363 0.879 -10.409 1.00 0.00 H ATOM 596 H TYR A 687 3.364 7.016 -7.425 1.00 0.00 H ATOM 597 N LEU A 688 6.035 9.164 -9.761 1.00 50.09 N ATOM 598 CA LEU A 688 6.504 10.521 -10.003 1.00 51.84 C ATOM 599 C LEU A 688 6.303 10.980 -11.441 1.00 48.49 C ATOM 600 O LEU A 688 6.268 12.191 -11.698 1.00 49.73 O ATOM 601 CB LEU A 688 7.981 10.660 -9.586 1.00 56.21 C ATOM 602 CG LEU A 688 8.258 10.842 -8.071 1.00 58.30 C ATOM 603 CD1 LEU A 688 7.365 9.988 -7.173 1.00 56.37 C ATOM 604 CD2 LEU A 688 9.732 10.583 -7.752 1.00 61.76 C ATOM 605 H LEU A 688 6.736 8.399 -9.687 1.00 0.00 H ATOM 606 N ASN A 689 6.162 10.034 -12.378 1.00 38.15 N ATOM 607 CA ASN A 689 6.011 10.376 -13.780 1.00 32.30 C ATOM 608 C ASN A 689 5.267 9.248 -14.491 1.00 30.95 C ATOM 609 O ASN A 689 5.093 8.174 -13.895 1.00 34.25 O ATOM 610 CB ASN A 689 7.386 10.535 -14.433 1.00 35.22 C ATOM 611 CG ASN A 689 8.227 9.296 -14.251 1.00 36.15 C ATOM 612 OD1 ASN A 689 7.880 8.235 -14.778 1.00 39.63 O ATOM 613 ND2 ASN A 689 9.274 9.386 -13.449 1.00 36.78 N ATOM 614 HD22 ASN A 689 9.529 10.302 -13.027 1.00 0.00 H ATOM 615 HD21 ASN A 689 9.843 8.541 -13.240 1.00 0.00 H ATOM 616 H ASN A 689 6.161 9.033 -12.095 1.00 0.00 H ATOM 617 N PHE A 690 4.786 9.540 -15.701 1.00 31.68 N ATOM 618 CA PHE A 690 3.950 8.596 -16.464 1.00 32.22 C ATOM 619 C PHE A 690 4.770 7.362 -16.854 1.00 32.35 C ATOM 620 O PHE A 690 4.264 6.238 -16.845 1.00 30.14 O ATOM 621 CB PHE A 690 3.390 9.234 -17.715 1.00 34.18 C ATOM 622 CG PHE A 690 2.294 8.414 -18.380 1.00 38.45 C ATOM 623 CD1 PHE A 690 2.588 7.433 -19.326 1.00 38.31 C ATOM 624 CD2 PHE A 690 0.957 8.607 -18.040 1.00 39.03 C ATOM 625 CE1 PHE A 690 1.568 6.684 -19.924 1.00 37.55 C ATOM 626 CE2 PHE A 690 -0.052 7.856 -18.631 1.00 40.69 C ATOM 627 CZ PHE A 690 0.251 6.896 -19.570 1.00 38.77 C ATOM 628 H PHE A 690 5.009 10.465 -16.120 1.00 0.00 H ATOM 629 N ASP A 691 6.049 7.564 -17.203 1.00 29.80 N ATOM 630 CA ASP A 691 6.898 6.382 -17.539 1.00 32.10 C ATOM 631 C ASP A 691 6.880 5.216 -16.551 1.00 31.50 C ATOM 632 O ASP A 691 6.750 4.031 -16.948 1.00 32.07 O ATOM 633 CB ASP A 691 8.362 6.870 -17.728 1.00 36.94 C ATOM 634 CG ASP A 691 8.579 7.621 -19.054 1.00 39.47 C ATOM 635 OD1 ASP A 691 7.732 7.580 -19.993 1.00 40.48 O ATOM 636 OD2 ASP A 691 9.650 8.256 -19.183 1.00 45.89 O ATOM 637 H ASP A 691 6.442 8.526 -17.239 1.00 0.00 H ATOM 638 N ASP A 692 7.050 5.534 -15.269 1.00 28.48 N ATOM 639 CA ASP A 692 7.144 4.596 -14.222 1.00 32.37 C ATOM 640 C ASP A 692 5.800 3.864 -13.994 1.00 29.91 C ATOM 641 O ASP A 692 5.772 2.677 -13.788 1.00 28.91 O ATOM 642 CB ASP A 692 7.588 5.307 -12.939 1.00 33.37 C ATOM 643 CG ASP A 692 9.074 5.790 -12.999 1.00 38.78 C ATOM 644 OD1 ASP A 692 9.782 5.551 -14.006 1.00 39.26 O ATOM 645 OD2 ASP A 692 9.493 6.421 -12.016 1.00 39.13 O ATOM 646 H ASP A 692 7.118 6.543 -15.024 1.00 0.00 H ATOM 647 N PHE A 693 4.706 4.619 -14.041 1.00 29.06 N ATOM 648 CA PHE A 693 3.369 4.007 -14.100 1.00 25.62 C ATOM 649 C PHE A 693 3.208 2.998 -15.272 1.00 25.18 C ATOM 650 O PHE A 693 2.831 1.838 -15.055 1.00 27.87 O ATOM 651 CB PHE A 693 2.331 5.147 -14.185 1.00 25.64 C ATOM 652 CG PHE A 693 0.903 4.670 -14.282 1.00 24.09 C ATOM 653 CD1 PHE A 693 0.185 4.404 -13.122 1.00 26.13 C ATOM 654 CD2 PHE A 693 0.295 4.499 -15.485 1.00 24.83 C ATOM 655 CE1 PHE A 693 -1.119 3.976 -13.188 1.00 24.85 C ATOM 656 CE2 PHE A 693 -1.039 4.066 -15.570 1.00 28.00 C ATOM 657 CZ PHE A 693 -1.739 3.802 -14.401 1.00 24.03 C ATOM 658 H PHE A 693 4.797 5.655 -14.036 1.00 0.00 H ATOM 659 N GLU A 694 3.602 3.399 -16.472 1.00 26.23 N ATOM 660 CA GLU A 694 3.471 2.551 -17.653 1.00 28.74 C ATOM 661 C GLU A 694 4.366 1.319 -17.488 1.00 25.37 C ATOM 662 O GLU A 694 4.010 0.223 -17.926 1.00 25.84 O ATOM 663 CB GLU A 694 3.880 3.297 -18.906 1.00 30.69 C ATOM 664 CG GLU A 694 3.731 2.466 -20.159 1.00 33.55 C ATOM 665 CD GLU A 694 3.956 3.279 -21.424 1.00 45.61 C ATOM 666 OE1 GLU A 694 4.371 4.447 -21.290 1.00 46.76 O ATOM 667 OE2 GLU A 694 3.716 2.744 -22.537 1.00 50.10 O ATOM 668 H GLU A 694 4.017 4.347 -16.576 1.00 0.00 H ATOM 669 N GLU A 695 5.540 1.498 -16.890 1.00 28.65 N ATOM 670 CA GLU A 695 6.450 0.337 -16.700 1.00 32.22 C ATOM 671 C GLU A 695 5.865 -0.729 -15.780 1.00 28.05 C ATOM 672 O GLU A 695 5.966 -1.961 -16.032 1.00 26.71 O ATOM 673 CB GLU A 695 7.785 0.829 -16.152 1.00 37.35 C ATOM 674 CG GLU A 695 8.824 -0.253 -15.975 1.00 43.65 C ATOM 675 CD GLU A 695 10.149 0.339 -15.524 1.00 51.65 C ATOM 676 OE1 GLU A 695 10.622 1.266 -16.218 1.00 53.10 O ATOM 677 OE2 GLU A 695 10.687 -0.098 -14.472 1.00 57.59 O ATOM 678 H GLU A 695 5.820 2.443 -16.558 1.00 0.00 H ATOM 679 N ASP A 696 5.222 -0.285 -14.715 1.00 26.71 N ATOM 680 CA ASP A 696 4.518 -1.202 -13.845 1.00 27.39 C ATOM 681 C ASP A 696 3.393 -1.958 -14.569 1.00 22.77 C ATOM 682 O ASP A 696 3.249 -3.162 -14.355 1.00 23.20 O ATOM 683 CB ASP A 696 4.022 -0.513 -12.569 1.00 29.45 C ATOM 684 CG ASP A 696 5.071 -0.512 -11.441 1.00 34.63 C ATOM 685 OD1 ASP A 696 6.168 -1.103 -11.607 1.00 35.80 O ATOM 686 OD2 ASP A 696 4.779 0.068 -10.400 1.00 36.82 O ATOM 687 H ASP A 696 5.222 0.733 -14.500 1.00 0.00 H ATOM 688 N PHE A 697 2.589 -1.308 -15.421 1.00 23.04 N ATOM 689 CA PHE A 697 1.594 -2.044 -16.227 1.00 22.26 C ATOM 690 C PHE A 697 2.211 -3.074 -17.156 1.00 21.35 C ATOM 691 O PHE A 697 1.722 -4.179 -17.312 1.00 22.36 O ATOM 692 CB PHE A 697 0.753 -1.086 -17.078 1.00 21.37 C ATOM 693 CG PHE A 697 -0.114 -1.760 -18.093 1.00 22.62 C ATOM 694 CD1 PHE A 697 -1.278 -2.416 -17.698 1.00 23.06 C ATOM 695 CD2 PHE A 697 0.230 -1.806 -19.440 1.00 24.28 C ATOM 696 CE1 PHE A 697 -2.080 -3.027 -18.614 1.00 24.51 C ATOM 697 CE2 PHE A 697 -0.555 -2.464 -20.351 1.00 27.17 C ATOM 698 CZ PHE A 697 -1.728 -3.074 -19.945 1.00 26.13 C ATOM 699 H PHE A 697 2.666 -0.275 -15.516 1.00 0.00 H ATOM 700 N ASN A 698 3.301 -2.643 -17.804 1.00 23.43 N ATOM 701 CA ASN A 698 3.999 -3.572 -18.691 1.00 23.41 C ATOM 702 C ASN A 698 4.496 -4.767 -17.962 1.00 22.63 C ATOM 703 O ASN A 698 4.516 -5.864 -18.556 1.00 24.59 O ATOM 704 CB ASN A 698 5.104 -2.861 -19.492 1.00 26.13 C ATOM 705 CG ASN A 698 4.576 -1.935 -20.566 1.00 28.58 C ATOM 706 OD1 ASN A 698 3.533 -2.136 -21.191 1.00 34.25 O ATOM 707 ND2 ASN A 698 5.401 -0.954 -20.891 1.00 35.49 N ATOM 708 HD22 ASN A 698 6.275 -0.807 -20.346 1.00 0.00 H ATOM 709 HD21 ASN A 698 5.176 -0.329 -21.692 1.00 0.00 H ATOM 710 H ASN A 698 3.643 -1.669 -17.679 1.00 0.00 H ATOM 711 N LEU A 699 4.913 -4.610 -16.712 1.00 23.59 N ATOM 712 CA LEU A 699 5.331 -5.761 -15.875 1.00 27.39 C ATOM 713 C LEU A 699 4.195 -6.755 -15.631 1.00 23.08 C ATOM 714 O LEU A 699 4.392 -7.943 -15.715 1.00 21.17 O ATOM 715 CB LEU A 699 5.895 -5.366 -14.509 1.00 29.62 C ATOM 716 CG LEU A 699 7.327 -4.936 -14.239 1.00 33.11 C ATOM 717 CD1 LEU A 699 7.421 -4.746 -12.736 1.00 32.60 C ATOM 718 CD2 LEU A 699 8.310 -6.006 -14.730 1.00 35.27 C ATOM 719 H LEU A 699 4.948 -3.652 -16.308 1.00 0.00 H ATOM 720 N ILE A 700 2.972 -6.295 -15.354 1.00 21.84 N ATOM 721 CA ILE A 700 1.804 -7.215 -15.229 1.00 21.35 C ATOM 722 C ILE A 700 1.727 -8.154 -16.436 1.00 22.33 C ATOM 723 O ILE A 700 1.635 -9.372 -16.302 1.00 20.46 O ATOM 724 CB ILE A 700 0.477 -6.436 -15.082 1.00 21.63 C ATOM 725 CG1 ILE A 700 0.536 -5.565 -13.827 1.00 20.42 C ATOM 726 CG2 ILE A 700 -0.729 -7.368 -15.059 1.00 22.68 C ATOM 727 CD1 ILE A 700 -0.655 -4.625 -13.617 1.00 19.99 C ATOM 728 H ILE A 700 2.831 -5.273 -15.223 1.00 0.00 H ATOM 729 N VAL A 701 1.822 -7.566 -17.623 1.00 23.79 N ATOM 730 CA VAL A 701 1.717 -8.316 -18.863 1.00 21.51 C ATOM 731 C VAL A 701 2.927 -9.209 -19.133 1.00 20.09 C ATOM 732 O VAL A 701 2.782 -10.427 -19.389 1.00 21.27 O ATOM 733 CB VAL A 701 1.529 -7.398 -20.063 1.00 22.82 C ATOM 734 CG1 VAL A 701 1.544 -8.211 -21.343 1.00 24.53 C ATOM 735 CG2 VAL A 701 0.236 -6.586 -19.933 1.00 23.46 C ATOM 736 H VAL A 701 1.976 -6.538 -17.666 1.00 0.00 H ATOM 737 N SER A 702 4.104 -8.618 -18.996 1.00 20.72 N ATOM 738 CA SER A 702 5.347 -9.352 -19.401 1.00 22.78 C ATOM 739 C SER A 702 5.614 -10.503 -18.444 1.00 21.44 C ATOM 740 O SER A 702 6.047 -11.579 -18.865 1.00 23.22 O ATOM 741 CB SER A 702 6.559 -8.426 -19.502 1.00 27.04 C ATOM 742 OG SER A 702 6.972 -7.833 -18.285 1.00 29.49 O ATOM 743 HG SER A 702 7.214 -8.543 -17.639 1.00 0.00 H ATOM 744 H SER A 702 4.166 -7.654 -18.611 1.00 0.00 H ATOM 745 N ASN A 703 5.322 -10.303 -17.160 1.00 23.71 N ATOM 746 CA ASN A 703 5.409 -11.384 -16.187 1.00 24.11 C ATOM 747 C ASN A 703 4.520 -12.544 -16.557 1.00 21.49 C ATOM 748 O ASN A 703 4.961 -13.689 -16.489 1.00 23.75 O ATOM 749 CB ASN A 703 5.069 -10.907 -14.738 1.00 24.00 C ATOM 750 CG ASN A 703 6.131 -9.999 -14.107 1.00 26.79 C ATOM 751 OD1 ASN A 703 7.261 -9.922 -14.558 1.00 29.61 O ATOM 752 ND2 ASN A 703 5.733 -9.273 -13.051 1.00 25.25 N ATOM 753 HD22 ASN A 703 4.761 -9.365 -12.693 1.00 0.00 H ATOM 754 HD21 ASN A 703 6.397 -8.618 -12.590 1.00 0.00 H ATOM 755 H ASN A 703 5.026 -9.357 -16.846 1.00 0.00 H ATOM 756 N CYS A 704 3.288 -12.263 -16.993 1.00 21.25 N ATOM 757 CA CYS A 704 2.293 -13.257 -17.260 1.00 21.19 C ATOM 758 C CYS A 704 2.680 -14.032 -18.510 1.00 21.62 C ATOM 759 O CYS A 704 2.674 -15.257 -18.528 1.00 22.44 O ATOM 760 CB CYS A 704 0.931 -12.595 -17.388 1.00 22.27 C ATOM 761 SG CYS A 704 -0.393 -13.742 -17.623 1.00 23.98 S ATOM 762 H CYS A 704 3.038 -11.265 -17.147 1.00 0.00 H ATOM 763 N LEU A 705 3.098 -13.322 -19.550 1.00 20.11 N ATOM 764 CA LEU A 705 3.564 -14.013 -20.770 1.00 20.98 C ATOM 765 C LEU A 705 4.809 -14.853 -20.520 1.00 24.33 C ATOM 766 O LEU A 705 4.937 -15.949 -21.091 1.00 23.92 O ATOM 767 CB LEU A 705 3.879 -12.975 -21.844 1.00 20.68 C ATOM 768 CG LEU A 705 2.681 -12.152 -22.328 1.00 20.85 C ATOM 769 CD1 LEU A 705 3.062 -11.112 -23.418 1.00 23.23 C ATOM 770 CD2 LEU A 705 1.506 -12.949 -22.836 1.00 22.79 C ATOM 771 H LEU A 705 3.098 -12.283 -19.507 1.00 0.00 H ATOM 772 N LYS A 706 5.689 -14.376 -19.648 1.00 22.91 N ATOM 773 CA LYS A 706 6.926 -15.115 -19.277 1.00 24.49 C ATOM 774 C LYS A 706 6.591 -16.412 -18.530 1.00 24.60 C ATOM 775 O LYS A 706 7.078 -17.492 -18.888 1.00 26.79 O ATOM 776 CB LYS A 706 7.845 -14.277 -18.416 1.00 28.66 C ATOM 777 CG LYS A 706 9.183 -14.936 -18.107 1.00 30.46 C ATOM 778 CD LYS A 706 10.062 -14.139 -17.162 1.00 34.30 C ATOM 779 CE LYS A 706 11.339 -14.913 -16.833 1.00 40.25 C ATOM 780 NZ LYS A 706 12.171 -14.238 -15.789 1.00 43.55 N ATOM 781 HZ1 LYS A 706 12.448 -13.294 -16.125 1.00 0.00 H ATOM 782 HZ2 LYS A 706 11.618 -14.147 -14.913 1.00 0.00 H ATOM 783 HZ3 LYS A 706 13.023 -14.806 -15.606 1.00 0.00 H ATOM 784 H LYS A 706 5.507 -13.451 -19.208 1.00 0.00 H ATOM 785 N TYR A 707 5.777 -16.286 -17.485 1.00 24.09 N ATOM 786 CA TYR A 707 5.466 -17.439 -16.596 1.00 25.61 C ATOM 787 C TYR A 707 4.632 -18.535 -17.224 1.00 29.50 C ATOM 788 O TYR A 707 4.943 -19.760 -17.067 1.00 28.25 O ATOM 789 CB TYR A 707 4.830 -16.930 -15.290 1.00 26.56 C ATOM 790 CG TYR A 707 4.593 -18.071 -14.338 1.00 28.79 C ATOM 791 CD1 TYR A 707 5.663 -18.617 -13.623 1.00 33.33 C ATOM 792 CD2 TYR A 707 3.354 -18.645 -14.234 1.00 28.33 C ATOM 793 CE1 TYR A 707 5.473 -19.687 -12.777 1.00 34.13 C ATOM 794 CE2 TYR A 707 3.157 -19.751 -13.403 1.00 34.25 C ATOM 795 CZ TYR A 707 4.230 -20.241 -12.678 1.00 31.62 C ATOM 796 OH TYR A 707 4.037 -21.322 -11.852 1.00 38.16 O ATOM 797 HH TYR A 707 4.891 -21.552 -11.406 1.00 0.00 H ATOM 798 H TYR A 707 5.348 -15.360 -17.284 1.00 0.00 H ATOM 799 N ASN A 708 3.597 -18.138 -17.952 1.00 25.54 N ATOM 800 CA ASN A 708 2.587 -19.072 -18.430 1.00 26.63 C ATOM 801 C ASN A 708 2.797 -19.650 -19.800 1.00 30.36 C ATOM 802 O ASN A 708 3.235 -18.937 -20.698 1.00 23.97 O ATOM 803 CB ASN A 708 1.205 -18.438 -18.403 1.00 26.84 C ATOM 804 CG ASN A 708 0.804 -18.041 -17.007 1.00 27.76 C ATOM 805 OD1 ASN A 708 0.392 -18.910 -16.223 1.00 29.64 O ATOM 806 ND2 ASN A 708 0.941 -16.744 -16.669 1.00 24.66 N ATOM 807 HD22 ASN A 708 1.292 -16.059 -17.368 1.00 0.00 H ATOM 808 HD21 ASN A 708 0.696 -16.428 -15.709 1.00 0.00 H ATOM 809 H ASN A 708 3.504 -17.130 -18.189 1.00 0.00 H ATOM 810 N ALA A 709 2.427 -20.925 -19.970 1.00 28.28 N ATOM 811 CA ALA A 709 2.414 -21.498 -21.294 1.00 28.39 C ATOM 812 C ALA A 709 1.448 -20.736 -22.193 1.00 24.91 C ATOM 813 O ALA A 709 0.431 -20.187 -21.759 1.00 24.82 O ATOM 814 CB ALA A 709 2.009 -22.948 -21.241 1.00 26.44 C ATOM 815 H ALA A 709 2.150 -21.501 -19.150 1.00 0.00 H ATOM 816 N LYS A 710 1.757 -20.725 -23.481 1.00 26.75 N ATOM 817 CA LYS A 710 0.864 -20.118 -24.451 1.00 27.41 C ATOM 818 C LYS A 710 -0.584 -20.567 -24.382 1.00 33.03 C ATOM 819 O LYS A 710 -1.473 -19.734 -24.449 1.00 28.89 O ATOM 820 CB LYS A 710 1.390 -20.239 -25.878 1.00 27.57 C ATOM 821 CG LYS A 710 2.780 -19.662 -26.056 1.00 27.83 C ATOM 822 CD LYS A 710 3.144 -19.597 -27.564 1.00 27.14 C ATOM 823 CE LYS A 710 2.607 -18.418 -28.314 1.00 26.68 C ATOM 824 NZ LYS A 710 2.850 -18.529 -29.792 1.00 27.14 N ATOM 825 HZ1 LYS A 710 3.873 -18.588 -29.970 1.00 0.00 H ATOM 826 HZ2 LYS A 710 2.383 -19.384 -30.156 1.00 0.00 H ATOM 827 HZ3 LYS A 710 2.461 -17.691 -30.270 1.00 0.00 H ATOM 828 H LYS A 710 2.648 -21.156 -23.800 1.00 0.00 H ATOM 829 N ASP A 711 -0.844 -21.876 -24.237 1.00 31.03 N ATOM 830 CA ASP A 711 -2.229 -22.345 -24.168 1.00 34.20 C ATOM 831 C ASP A 711 -2.749 -22.307 -22.740 1.00 35.26 C ATOM 832 O ASP A 711 -2.996 -23.363 -22.137 1.00 41.15 O ATOM 833 CB ASP A 711 -2.321 -23.771 -24.735 1.00 35.20 C ATOM 834 CG ASP A 711 -3.761 -24.188 -25.125 1.00 42.80 C ATOM 835 OD1 ASP A 711 -4.722 -23.382 -25.068 1.00 42.30 O ATOM 836 OD2 ASP A 711 -3.935 -25.376 -25.481 1.00 47.73 O ATOM 837 H ASP A 711 -0.061 -22.557 -24.174 1.00 0.00 H ATOM 838 N THR A 712 -2.900 -21.107 -22.193 1.00 28.78 N ATOM 839 CA THR A 712 -3.472 -20.926 -20.866 1.00 31.24 C ATOM 840 C THR A 712 -4.340 -19.718 -20.944 1.00 29.72 C ATOM 841 O THR A 712 -4.068 -18.776 -21.715 1.00 27.79 O ATOM 842 CB THR A 712 -2.433 -20.694 -19.738 1.00 30.61 C ATOM 843 OG1 THR A 712 -1.627 -19.508 -20.000 1.00 27.35 O ATOM 844 CG2 THR A 712 -1.502 -21.895 -19.559 1.00 32.13 C ATOM 845 HG1 THR A 712 -1.144 -19.621 -20.857 1.00 0.00 H ATOM 846 H THR A 712 -2.600 -20.268 -22.730 1.00 0.00 H ATOM 847 N ILE A 713 -5.375 -19.709 -20.120 1.00 28.15 N ATOM 848 CA ILE A 713 -6.220 -18.541 -19.963 1.00 29.70 C ATOM 849 C ILE A 713 -5.390 -17.292 -19.623 1.00 26.20 C ATOM 850 O ILE A 713 -5.710 -16.186 -20.063 1.00 26.96 O ATOM 851 CB ILE A 713 -7.326 -18.784 -18.905 1.00 28.07 C ATOM 852 CG1 ILE A 713 -8.441 -17.760 -19.034 1.00 37.55 C ATOM 853 CG2 ILE A 713 -6.759 -18.850 -17.476 1.00 30.80 C ATOM 854 CD1 ILE A 713 -9.676 -18.180 -18.268 1.00 40.96 C ATOM 855 H ILE A 713 -5.589 -20.565 -19.569 1.00 0.00 H ATOM 856 N PHE A 714 -4.373 -17.468 -18.790 1.00 24.20 N ATOM 857 CA PHE A 714 -3.584 -16.367 -18.251 1.00 25.07 C ATOM 858 C PHE A 714 -2.836 -15.710 -19.410 1.00 22.50 C ATOM 859 O PHE A 714 -2.920 -14.482 -19.578 1.00 23.26 O ATOM 860 CB PHE A 714 -2.639 -16.832 -17.181 1.00 25.54 C ATOM 861 CG PHE A 714 -3.347 -17.480 -16.001 1.00 25.63 C ATOM 862 CD1 PHE A 714 -4.115 -16.687 -15.153 1.00 27.52 C ATOM 863 CD2 PHE A 714 -3.241 -18.827 -15.793 1.00 26.36 C ATOM 864 CE1 PHE A 714 -4.770 -17.254 -14.067 1.00 26.54 C ATOM 865 CE2 PHE A 714 -3.911 -19.399 -14.693 1.00 27.14 C ATOM 866 CZ PHE A 714 -4.667 -18.589 -13.882 1.00 25.63 C ATOM 867 H PHE A 714 -4.127 -18.438 -18.508 1.00 0.00 H ATOM 868 N TYR A 715 -2.146 -16.527 -20.203 1.00 23.81 N ATOM 869 CA TYR A 715 -1.342 -15.976 -21.323 1.00 21.90 C ATOM 870 C TYR A 715 -2.251 -15.271 -22.314 1.00 23.90 C ATOM 871 O TYR A 715 -1.942 -14.145 -22.758 1.00 25.67 O ATOM 872 CB TYR A 715 -0.585 -17.119 -22.018 1.00 22.28 C ATOM 873 CG TYR A 715 0.428 -16.673 -23.047 1.00 19.58 C ATOM 874 CD1 TYR A 715 -0.001 -16.344 -24.331 1.00 21.55 C ATOM 875 CD2 TYR A 715 1.755 -16.667 -22.780 1.00 21.17 C ATOM 876 CE1 TYR A 715 0.925 -15.963 -25.299 1.00 21.83 C ATOM 877 CE2 TYR A 715 2.699 -16.276 -23.732 1.00 21.64 C ATOM 878 CZ TYR A 715 2.256 -15.947 -24.994 1.00 21.03 C ATOM 879 OH TYR A 715 3.144 -15.536 -25.961 1.00 23.81 O ATOM 880 HH TYR A 715 2.652 -15.343 -26.798 1.00 0.00 H ATOM 881 H TYR A 715 -2.170 -17.553 -20.038 1.00 0.00 H ATOM 882 N ARG A 716 -3.364 -15.899 -22.677 1.00 25.32 N ATOM 883 CA ARG A 716 -4.319 -15.312 -23.628 1.00 26.94 C ATOM 884 C ARG A 716 -4.866 -13.985 -23.100 1.00 26.24 C ATOM 885 O ARG A 716 -4.971 -13.000 -23.838 1.00 27.98 O ATOM 886 CB ARG A 716 -5.430 -16.308 -23.927 1.00 33.35 C ATOM 887 CG ARG A 716 -4.979 -17.422 -24.881 1.00 35.60 C ATOM 888 CD ARG A 716 -6.200 -18.219 -25.367 1.00 38.01 C ATOM 889 NE ARG A 716 -6.675 -19.122 -24.326 1.00 42.44 N ATOM 890 CZ ARG A 716 -6.206 -20.357 -24.102 1.00 45.76 C ATOM 891 NH1 ARG A 716 -6.718 -21.094 -23.104 1.00 44.44 N ATOM 892 NH2 ARG A 716 -5.223 -20.860 -24.858 1.00 48.00 N ATOM 893 HE ARG A 716 -7.439 -18.781 -23.708 1.00 0.00 H ATOM 894 HH12 ARG A 716 -6.356 -22.053 -22.927 1.00 0.00 H ATOM 895 HH11 ARG A 716 -7.476 -20.706 -22.507 1.00 0.00 H ATOM 896 HH22 ARG A 716 -4.866 -21.820 -24.676 1.00 0.00 H ATOM 897 HH21 ARG A 716 -4.816 -20.291 -25.628 1.00 0.00 H ATOM 898 H ARG A 716 -3.566 -16.837 -22.275 1.00 0.00 H ATOM 899 N ALA A 717 -5.212 -13.960 -21.814 1.00 24.63 N ATOM 900 CA ALA A 717 -5.646 -12.717 -21.143 1.00 24.72 C ATOM 901 C ALA A 717 -4.613 -11.620 -21.205 1.00 22.83 C ATOM 902 O ALA A 717 -4.954 -10.428 -21.424 1.00 26.10 O ATOM 903 CB ALA A 717 -6.046 -12.966 -19.698 1.00 26.91 C ATOM 904 H ALA A 717 -5.176 -14.843 -21.265 1.00 0.00 H ATOM 905 N ALA A 718 -3.350 -11.986 -21.042 1.00 23.13 N ATOM 906 CA ALA A 718 -2.279 -10.966 -21.048 1.00 20.11 C ATOM 907 C ALA A 718 -2.074 -10.408 -22.445 1.00 20.49 C ATOM 908 O ALA A 718 -1.747 -9.221 -22.591 1.00 22.01 O ATOM 909 CB ALA A 718 -0.985 -11.496 -20.497 1.00 19.90 C ATOM 910 H ALA A 718 -3.112 -12.990 -20.910 1.00 0.00 H ATOM 911 N VAL A 719 -2.180 -11.263 -23.453 1.00 21.05 N ATOM 912 CA VAL A 719 -2.051 -10.775 -24.834 1.00 24.21 C ATOM 913 C VAL A 719 -3.145 -9.752 -25.115 1.00 24.66 C ATOM 914 O VAL A 719 -2.873 -8.698 -25.711 1.00 27.07 O ATOM 915 CB VAL A 719 -2.147 -11.935 -25.816 1.00 23.78 C ATOM 916 CG1 VAL A 719 -2.355 -11.409 -27.220 1.00 26.53 C ATOM 917 CG2 VAL A 719 -0.908 -12.800 -25.728 1.00 22.04 C ATOM 918 H VAL A 719 -2.353 -12.272 -23.268 1.00 0.00 H ATOM 919 N ARG A 720 -4.359 -10.054 -24.691 1.00 24.47 N ATOM 920 CA ARG A 720 -5.514 -9.154 -24.937 1.00 29.10 C ATOM 921 C ARG A 720 -5.359 -7.867 -24.129 1.00 26.68 C ATOM 922 O ARG A 720 -5.626 -6.761 -24.620 1.00 29.12 O ATOM 923 CB ARG A 720 -6.822 -9.858 -24.606 1.00 35.97 C ATOM 924 CG ARG A 720 -8.057 -9.205 -25.213 1.00 46.44 C ATOM 925 CD ARG A 720 -9.330 -9.934 -24.783 1.00 50.23 C ATOM 926 NE ARG A 720 -9.533 -9.808 -23.337 1.00 59.44 N ATOM 927 CZ ARG A 720 -10.584 -9.249 -22.732 1.00 61.29 C ATOM 928 NH1 ARG A 720 -11.620 -8.758 -23.419 1.00 61.50 N ATOM 929 NH2 ARG A 720 -10.604 -9.207 -21.403 1.00 64.52 N ATOM 930 HE ARG A 720 -8.786 -10.191 -22.723 1.00 0.00 H ATOM 931 HH12 ARG A 720 -12.422 -8.329 -22.915 1.00 0.00 H ATOM 932 HH11 ARG A 720 -11.624 -8.805 -24.458 1.00 0.00 H ATOM 933 HH22 ARG A 720 -11.411 -8.777 -20.908 1.00 0.00 H ATOM 934 HH21 ARG A 720 -9.812 -9.604 -20.858 1.00 0.00 H ATOM 935 H ARG A 720 -4.509 -10.943 -24.173 1.00 0.00 H ATOM 936 N LEU A 721 -4.859 -7.985 -22.903 1.00 23.88 N ATOM 937 CA LEU A 721 -4.652 -6.811 -22.072 1.00 23.32 C ATOM 938 C LEU A 721 -3.542 -5.919 -22.644 1.00 21.53 C ATOM 939 O LEU A 721 -3.605 -4.690 -22.593 1.00 24.15 O ATOM 940 CB LEU A 721 -4.289 -7.239 -20.623 1.00 25.42 C ATOM 941 CG LEU A 721 -4.076 -6.108 -19.633 1.00 24.92 C ATOM 942 CD1 LEU A 721 -5.301 -5.198 -19.551 1.00 24.72 C ATOM 943 CD2 LEU A 721 -3.734 -6.611 -18.239 1.00 24.20 C ATOM 944 H LEU A 721 -4.614 -8.926 -22.535 1.00 0.00 H ATOM 945 N ARG A 722 -2.527 -6.528 -23.241 1.00 21.63 N ATOM 946 CA ARG A 722 -1.454 -5.739 -23.850 1.00 24.86 C ATOM 947 C ARG A 722 -2.018 -4.928 -24.988 1.00 24.46 C ATOM 948 O ARG A 722 -1.694 -3.740 -25.119 1.00 26.50 O ATOM 949 CB ARG A 722 -0.375 -6.657 -24.413 1.00 27.83 C ATOM 950 CG ARG A 722 0.713 -5.997 -25.234 1.00 30.94 C ATOM 951 CD ARG A 722 1.542 -7.052 -25.976 1.00 36.32 C ATOM 952 NE ARG A 722 0.827 -7.755 -27.080 1.00 44.05 N ATOM 953 CZ ARG A 722 1.156 -8.963 -27.575 1.00 45.64 C ATOM 954 NH1 ARG A 722 2.152 -9.675 -27.067 1.00 39.76 N ATOM 955 NH2 ARG A 722 0.450 -9.488 -28.566 1.00 47.19 N ATOM 956 HE ARG A 722 0.008 -7.273 -27.502 1.00 0.00 H ATOM 957 HH12 ARG A 722 2.384 -10.605 -27.469 1.00 0.00 H ATOM 958 HH11 ARG A 722 2.701 -9.303 -26.266 1.00 0.00 H ATOM 959 HH22 ARG A 722 0.704 -10.421 -28.948 1.00 0.00 H ATOM 960 HH21 ARG A 722 -0.358 -8.967 -28.962 1.00 0.00 H ATOM 961 H ARG A 722 -2.493 -7.567 -23.277 1.00 0.00 H ATOM 962 N GLU A 723 -2.881 -5.577 -25.765 1.00 26.56 N ATOM 963 CA GLU A 723 -3.479 -4.929 -26.937 1.00 30.34 C ATOM 964 C GLU A 723 -4.430 -3.823 -26.551 1.00 29.58 C ATOM 965 O GLU A 723 -4.271 -2.683 -26.981 1.00 33.76 O ATOM 966 CB GLU A 723 -4.115 -5.955 -27.852 1.00 34.74 C ATOM 967 CG GLU A 723 -3.055 -6.728 -28.641 1.00 43.84 C ATOM 968 CD GLU A 723 -1.994 -5.810 -29.294 1.00 52.26 C ATOM 969 OE1 GLU A 723 -2.330 -5.067 -30.261 1.00 58.92 O ATOM 970 OE2 GLU A 723 -0.817 -5.807 -28.831 1.00 47.63 O ATOM 971 H GLU A 723 -3.136 -6.559 -25.538 1.00 0.00 H ATOM 972 N GLN A 724 -5.343 -4.124 -25.656 1.00 28.81 N ATOM 973 CA GLN A 724 -6.294 -3.123 -25.223 1.00 30.37 C ATOM 974 C GLN A 724 -5.675 -2.032 -24.318 1.00 29.03 C ATOM 975 O GLN A 724 -6.069 -0.859 -24.361 1.00 30.15 O ATOM 976 CB GLN A 724 -7.459 -3.799 -24.538 1.00 31.28 C ATOM 977 CG GLN A 724 -8.225 -4.753 -25.421 1.00 36.82 C ATOM 978 CD GLN A 724 -9.420 -5.327 -24.687 1.00 41.84 C ATOM 979 OE1 GLN A 724 -9.266 -6.135 -23.778 1.00 46.19 O ATOM 980 NE2 GLN A 724 -10.611 -4.890 -25.058 1.00 52.48 N ATOM 981 HE22 GLN A 724 -10.694 -4.204 -25.835 1.00 0.00 H ATOM 982 HE21 GLN A 724 -11.465 -5.232 -24.573 1.00 0.00 H ATOM 983 H GLN A 724 -5.383 -5.084 -25.258 1.00 0.00 H ATOM 984 N GLY A 725 -4.741 -2.398 -23.442 1.00 27.50 N ATOM 985 CA GLY A 725 -4.136 -1.461 -22.511 1.00 28.59 C ATOM 986 C GLY A 725 -3.133 -0.555 -23.168 1.00 31.93 C ATOM 987 O GLY A 725 -3.052 0.627 -22.870 1.00 30.25 O ATOM 988 H GLY A 725 -4.433 -3.391 -23.424 1.00 0.00 H ATOM 989 N GLY A 726 -2.377 -1.086 -24.137 1.00 34.84 N ATOM 990 CA GLY A 726 -1.531 -0.220 -24.962 1.00 33.19 C ATOM 991 C GLY A 726 -2.243 1.001 -25.568 1.00 32.81 C ATOM 992 O GLY A 726 -1.698 2.123 -25.607 1.00 34.28 O ATOM 993 H GLY A 726 -2.390 -2.112 -24.304 1.00 0.00 H ATOM 994 N ALA A 727 -3.464 0.782 -26.025 1.00 32.69 N ATOM 995 CA ALA A 727 -4.294 1.857 -26.549 1.00 31.72 C ATOM 996 C ALA A 727 -4.723 2.891 -25.485 1.00 30.17 C ATOM 997 O ALA A 727 -4.648 4.117 -25.675 1.00 28.34 O ATOM 998 CB ALA A 727 -5.510 1.276 -27.206 1.00 34.14 C ATOM 999 H ALA A 727 -3.843 -0.187 -26.010 1.00 0.00 H ATOM 1000 N VAL A 728 -5.205 2.391 -24.359 1.00 29.50 N ATOM 1001 CA VAL A 728 -5.409 3.256 -23.204 1.00 26.26 C ATOM 1002 C VAL A 728 -4.183 4.114 -22.822 1.00 25.08 C ATOM 1003 O VAL A 728 -4.259 5.319 -22.570 1.00 25.08 O ATOM 1004 CB VAL A 728 -5.865 2.401 -21.968 1.00 25.88 C ATOM 1005 CG1 VAL A 728 -5.810 3.239 -20.687 1.00 27.45 C ATOM 1006 CG2 VAL A 728 -7.234 1.747 -22.209 1.00 27.03 C ATOM 1007 H VAL A 728 -5.439 1.379 -24.298 1.00 0.00 H ATOM 1008 N LEU A 729 -3.025 3.510 -22.753 1.00 26.17 N ATOM 1009 CA LEU A 729 -1.841 4.196 -22.381 1.00 25.38 C ATOM 1010 C LEU A 729 -1.436 5.204 -23.469 1.00 24.97 C ATOM 1011 O LEU A 729 -0.915 6.234 -23.172 1.00 27.75 O ATOM 1012 CB LEU A 729 -0.695 3.185 -22.183 1.00 27.42 C ATOM 1013 CG LEU A 729 -0.822 2.319 -20.922 1.00 31.48 C ATOM 1014 CD1 LEU A 729 0.124 1.134 -21.045 1.00 35.23 C ATOM 1015 CD2 LEU A 729 -0.527 3.118 -19.678 1.00 31.34 C ATOM 1016 H LEU A 729 -2.971 2.496 -22.978 1.00 0.00 H ATOM 1017 N ARG A 730 -1.699 4.861 -24.725 1.00 27.74 N ATOM 1018 CA ARG A 730 -1.346 5.766 -25.820 1.00 31.02 C ATOM 1019 C ARG A 730 -2.009 7.136 -25.573 1.00 31.39 C ATOM 1020 O ARG A 730 -1.359 8.203 -25.603 1.00 29.08 O ATOM 1021 CB ARG A 730 -1.822 5.183 -27.135 1.00 35.67 C ATOM 1022 CG ARG A 730 -1.618 6.107 -28.327 1.00 43.21 C ATOM 1023 CD ARG A 730 -1.774 5.317 -29.621 1.00 47.22 C ATOM 1024 NE ARG A 730 -0.506 4.711 -30.026 1.00 52.76 N ATOM 1025 CZ ARG A 730 -0.287 4.128 -31.206 1.00 55.23 C ATOM 1026 NH1 ARG A 730 -1.274 4.064 -32.104 1.00 49.88 N ATOM 1027 NH2 ARG A 730 0.925 3.606 -31.490 1.00 51.12 N ATOM 1028 HE ARG A 730 0.281 4.736 -29.346 1.00 0.00 H ATOM 1029 HH12 ARG A 730 -1.110 3.611 -33.026 1.00 0.00 H ATOM 1030 HH11 ARG A 730 -2.206 4.467 -31.881 1.00 0.00 H ATOM 1031 HH22 ARG A 730 1.093 3.152 -32.411 1.00 0.00 H ATOM 1032 HH21 ARG A 730 1.691 3.658 -30.788 1.00 0.00 H ATOM 1033 H ARG A 730 -2.156 3.949 -24.930 1.00 0.00 H ATOM 1034 N GLN A 731 -3.314 7.054 -25.349 1.00 32.45 N ATOM 1035 CA GLN A 731 -4.178 8.201 -25.146 1.00 37.46 C ATOM 1036 C GLN A 731 -3.794 8.941 -23.883 1.00 36.09 C ATOM 1037 O GLN A 731 -3.597 10.170 -23.892 1.00 32.18 O ATOM 1038 CB GLN A 731 -5.626 7.701 -25.106 1.00 40.72 C ATOM 1039 CG GLN A 731 -6.733 8.735 -25.072 1.00 53.66 C ATOM 1040 CD GLN A 731 -8.103 8.103 -25.345 1.00 63.46 C ATOM 1041 OE1 GLN A 731 -8.282 7.385 -26.342 1.00 72.83 O ATOM 1042 NE2 GLN A 731 -9.077 8.365 -24.464 1.00 69.55 N ATOM 1043 HE22 GLN A 731 -8.885 8.972 -23.642 1.00 0.00 H ATOM 1044 HE21 GLN A 731 -10.026 7.962 -24.602 1.00 0.00 H ATOM 1045 H GLN A 731 -3.744 6.108 -25.317 1.00 0.00 H ATOM 1046 N ALA A 732 -3.636 8.204 -22.782 1.00 29.61 N ATOM 1047 CA ALA A 732 -3.227 8.841 -21.529 1.00 28.37 C ATOM 1048 C ALA A 732 -1.851 9.495 -21.532 1.00 32.33 C ATOM 1049 O ALA A 732 -1.605 10.467 -20.820 1.00 34.32 O ATOM 1050 CB ALA A 732 -3.288 7.852 -20.391 1.00 27.12 C ATOM 1051 H ALA A 732 -3.803 7.178 -22.814 1.00 0.00 H ATOM 1052 N ARG A 733 -0.923 8.967 -22.333 1.00 30.50 N ATOM 1053 CA ARG A 733 0.386 9.608 -22.443 1.00 37.93 C ATOM 1054 C ARG A 733 0.235 10.958 -23.114 1.00 34.91 C ATOM 1055 O ARG A 733 0.843 11.929 -22.664 1.00 45.71 O ATOM 1056 CB ARG A 733 1.395 8.746 -23.215 1.00 38.74 C ATOM 1057 CG ARG A 733 2.476 8.159 -22.317 1.00 44.07 C ATOM 1058 CD ARG A 733 3.749 7.776 -23.060 1.00 46.05 C ATOM 1059 NE ARG A 733 3.333 7.276 -24.354 1.00 47.28 N ATOM 1060 CZ ARG A 733 2.804 6.071 -24.592 1.00 49.39 C ATOM 1061 NH1 ARG A 733 2.642 5.178 -23.625 1.00 57.20 N ATOM 1062 NH2 ARG A 733 2.446 5.754 -25.825 1.00 45.30 N ATOM 1063 HE ARG A 733 3.456 7.909 -25.170 1.00 0.00 H ATOM 1064 HH12 ARG A 733 2.228 4.249 -23.840 1.00 0.00 H ATOM 1065 HH11 ARG A 733 2.929 5.407 -22.652 1.00 0.00 H ATOM 1066 HH22 ARG A 733 2.033 4.820 -26.023 1.00 0.00 H ATOM 1067 HH21 ARG A 733 2.577 6.439 -26.597 1.00 0.00 H ATOM 1068 H ARG A 733 -1.130 8.104 -22.876 1.00 0.00 H ATOM 1069 N ARG A 734 -0.588 11.041 -24.149 1.00 40.10 N ATOM 1070 CA ARG A 734 -0.861 12.324 -24.820 1.00 46.02 C ATOM 1071 C ARG A 734 -1.205 13.405 -23.795 1.00 46.37 C ATOM 1072 O ARG A 734 -0.773 14.551 -23.925 1.00 49.26 O ATOM 1073 CB ARG A 734 -2.019 12.213 -25.828 1.00 46.57 C ATOM 1074 CG ARG A 734 -1.663 11.476 -27.114 1.00 54.75 C ATOM 1075 CD ARG A 734 -2.895 11.089 -27.913 1.00 61.99 C ATOM 1076 NE ARG A 734 -2.540 10.214 -29.035 1.00 69.10 N ATOM 1077 CZ ARG A 734 -3.259 9.173 -29.465 1.00 74.75 C ATOM 1078 NH1 ARG A 734 -2.821 8.460 -30.504 1.00 78.66 N ATOM 1079 NH2 ARG A 734 -4.406 8.825 -28.869 1.00 76.36 N ATOM 1080 HE ARG A 734 -1.654 10.421 -29.539 1.00 0.00 H ATOM 1081 HH12 ARG A 734 -3.373 7.648 -30.847 1.00 0.00 H ATOM 1082 HH11 ARG A 734 -1.928 8.716 -30.971 1.00 0.00 H ATOM 1083 HH22 ARG A 734 -4.949 8.011 -29.221 1.00 0.00 H ATOM 1084 HH21 ARG A 734 -4.754 9.369 -28.054 1.00 0.00 H ATOM 1085 H ARG A 734 -1.053 10.178 -24.497 1.00 0.00 H ATOM 1086 N GLN A 735 -1.958 13.032 -22.758 1.00 46.39 N ATOM 1087 CA GLN A 735 -2.410 14.011 -21.771 1.00 41.42 C ATOM 1088 C GLN A 735 -1.317 14.292 -20.752 1.00 42.95 C ATOM 1089 O GLN A 735 -1.243 15.406 -20.220 1.00 45.71 O ATOM 1090 CB GLN A 735 -3.717 13.542 -21.105 1.00 44.20 C ATOM 1091 CG GLN A 735 -4.848 13.164 -22.071 1.00 45.79 C ATOM 1092 CD GLN A 735 -5.365 14.335 -22.916 1.00 51.74 C ATOM 1093 OE1 GLN A 735 -5.812 15.349 -22.378 1.00 53.77 O ATOM 1094 NE2 GLN A 735 -5.324 14.191 -24.244 1.00 47.84 N ATOM 1095 HE22 GLN A 735 -4.939 13.319 -24.661 1.00 0.00 H ATOM 1096 HE21 GLN A 735 -5.677 14.950 -24.861 1.00 0.00 H ATOM 1097 H GLN A 735 -2.226 12.033 -22.651 1.00 0.00 H ATOM 1098 N ALA A 736 -0.466 13.304 -20.465 1.00 38.20 N ATOM 1099 CA ALA A 736 0.612 13.481 -19.512 1.00 41.33 C ATOM 1100 C ALA A 736 1.709 14.408 -20.059 1.00 49.96 C ATOM 1101 O ALA A 736 2.499 14.946 -19.272 1.00 48.34 O ATOM 1102 CB ALA A 736 1.213 12.148 -19.121 1.00 42.39 C ATOM 1103 H ALA A 736 -0.579 12.384 -20.937 1.00 0.00 H ATOM 1104 N GLU A 737 1.752 14.562 -21.389 1.00 57.83 N ATOM 1105 CA GLU A 737 2.664 15.503 -22.086 1.00 65.12 C ATOM 1106 C GLU A 737 2.232 16.954 -21.863 1.00 71.14 C ATOM 1107 O GLU A 737 3.056 17.816 -21.516 1.00 78.47 O ATOM 1108 CB GLU A 737 2.689 15.253 -23.612 1.00 66.95 C ATOM 1109 CG GLU A 737 2.977 13.829 -24.072 1.00 69.54 C ATOM 1110 CD GLU A 737 4.102 13.178 -23.294 1.00 70.98 C ATOM 1111 OE1 GLU A 737 5.227 13.711 -23.336 1.00 76.35 O ATOM 1112 OE2 GLU A 737 3.864 12.138 -22.640 1.00 76.20 O ATOM 1113 H GLU A 737 1.107 13.987 -21.968 1.00 0.00 H ATOM 1114 N LYS A 738 0.932 17.199 -22.067 1.00 69.57 N ATOM 1115 CA LYS A 738 0.296 18.517 -21.891 1.00 67.17 C ATOM 1116 C LYS A 738 0.461 19.137 -20.494 1.00 65.23 C ATOM 1117 O LYS A 738 0.059 20.284 -20.284 1.00 63.68 O ATOM 1118 CB LYS A 738 -1.213 18.419 -22.212 1.00 66.71 C ATOM 1119 CG LYS A 738 -1.559 18.120 -23.668 1.00 66.74 C ATOM 1120 CD LYS A 738 -3.064 17.965 -23.905 1.00 68.79 C ATOM 1121 CE LYS A 738 -3.859 19.258 -23.717 1.00 70.34 C ATOM 1122 NZ LYS A 738 -3.672 20.253 -24.818 1.00 69.37 N ATOM 1123 HZ1 LYS A 738 -2.668 20.516 -24.879 1.00 0.00 H ATOM 1124 HZ2 LYS A 738 -3.977 19.833 -25.719 1.00 0.00 H ATOM 1125 HZ3 LYS A 738 -4.242 21.100 -24.619 1.00 0.00 H ATOM 1126 H LYS A 738 0.331 16.406 -22.370 1.00 0.00 H ATOM 1127 N MET A 739 1.033 18.388 -19.548 1.00 61.67 N ATOM 1128 CA MET A 739 1.205 18.855 -18.178 1.00 59.46 C ATOM 1129 C MET A 739 2.614 19.429 -17.989 1.00 62.56 C ATOM 1130 O MET A 739 3.491 18.808 -17.382 1.00 66.63 O ATOM 1131 CB MET A 739 0.893 17.714 -17.185 1.00 56.36 C ATOM 1132 CG MET A 739 -0.509 17.130 -17.369 1.00 52.48 C ATOM 1133 SD MET A 739 -1.076 15.788 -16.265 1.00 44.96 S ATOM 1134 CE MET A 739 -2.693 15.568 -16.961 1.00 41.82 C ATOM 1135 H MET A 739 1.368 17.436 -19.798 1.00 0.00 H TER 1136 MET A 739 HETATM 1137 O HOH 1 -5.088 1.719 -1.989 1.00 47.24 O HETATM 1138 O HOH 2 -10.980 -5.770 -13.958 1.00 24.04 O HETATM 1139 O HOH 3 8.162 7.454 -10.381 1.00 48.48 O HETATM 1140 O HOH 4 -1.224 -8.838 -30.081 1.00 37.24 O HETATM 1141 O HOH 5 2.040 4.185 -27.644 1.00 39.67 O HETATM 1142 O HOH 6 2.060 -8.580 -7.345 1.00 34.77 O HETATM 1143 O HOH 7 -7.283 -4.602 -7.752 1.00 42.68 O HETATM 1144 O HOH 8 1.826 -13.335 -14.063 1.00 21.16 O HETATM 1145 O HOH 9 7.748 13.613 -23.954 1.00 47.73 O HETATM 1146 O HOH 10 3.131 -10.521 -11.664 1.00 26.11 O HETATM 1147 O HOH 11 -10.569 -13.836 -11.592 1.00 40.33 O HETATM 1148 O HOH 12 -0.380 -21.424 -16.153 1.00 34.87 O HETATM 1149 O HOH 13 -2.598 -11.427 -10.824 1.00 25.21 O HETATM 1150 O HOH 14 -2.069 -18.306 -26.597 1.00 45.20 O HETATM 1151 O HOH 15 8.579 -9.454 -16.926 1.00 34.74 O HETATM 1152 O HOH 16 -6.247 -23.740 -8.150 1.00 45.69 O HETATM 1153 O HOH 17 8.027 -5.422 -18.846 1.00 31.44 O HETATM 1154 O HOH 18 -1.286 4.131 -34.794 1.00 48.45 O HETATM 1155 O HOH 19 6.741 -0.318 -8.567 1.00 46.54 O HETATM 1156 O HOH 20 -11.791 -12.850 -10.966 1.00 37.39 O HETATM 1157 O HOH 21 -9.235 -10.596 -18.101 1.00 34.17 O HETATM 1158 O HOH 22 -3.643 -12.905 -4.131 1.00 37.67 O HETATM 1159 O HOH 23 -8.671 -5.950 -12.934 1.00 28.53 O HETATM 1160 O HOH 24 9.619 -9.556 -13.212 1.00 32.27 O HETATM 1161 O HOH 25 1.211 -10.670 -13.925 1.00 22.41 O HETATM 1162 O HOH 26 -0.677 -9.793 -12.226 1.00 25.78 O HETATM 1163 O HOH 27 -11.899 7.659 -9.139 1.00 50.69 O HETATM 1164 O HOH 28 -6.791 8.138 -19.031 1.00 27.04 O HETATM 1165 O HOH 29 8.180 -3.063 -17.332 1.00 33.84 O HETATM 1166 O HOH 30 -6.122 14.898 -15.377 1.00 34.78 O HETATM 1167 O HOH 31 9.102 -17.683 -20.813 1.00 34.92 O HETATM 1168 O HOH 32 -11.309 0.678 -20.276 1.00 36.00 O HETATM 1169 O HOH 33 1.412 -11.816 -29.851 1.00 34.85 O HETATM 1170 O HOH 34 1.831 8.345 -7.453 1.00 36.24 O HETATM 1171 O HOH 35 1.832 -14.200 -28.089 1.00 30.41 O HETATM 1172 O HOH 36 -12.119 -0.036 -13.223 1.00 39.97 O HETATM 1173 O HOH 37 4.675 -5.710 -21.407 1.00 33.62 O HETATM 1174 O HOH 38 5.824 -1.565 -6.510 1.00 42.92 O HETATM 1175 O HOH 39 -6.876 6.368 -22.023 1.00 34.80 O HETATM 1176 O HOH 40 -7.503 -9.386 -20.598 1.00 35.61 O HETATM 1177 O HOH 41 -5.569 -22.166 -18.639 1.00 35.45 O HETATM 1178 O HOH 42 3.773 -22.585 -24.388 1.00 26.25 O HETATM 1179 O HOH 43 1.620 -22.575 -17.729 1.00 31.00 O HETATM 1180 O HOH 44 4.049 -22.394 -16.210 1.00 54.24 O HETATM 1181 O HOH 45 -6.755 15.576 -1.494 1.00 52.38 O HETATM 1182 O HOH 46 -2.204 -1.609 -28.750 1.00 38.26 O HETATM 1183 O HOH 47 -5.072 -13.666 -26.685 1.00 41.85 O HETATM 1184 O HOH 48 11.477 -11.715 -13.897 1.00 39.54 O HETATM 1185 O HOH 49 -0.321 17.758 -12.270 1.00 42.13 O HETATM 1186 O HOH 50 -7.387 -16.941 -7.828 1.00 37.95 O HETATM 1187 O HOH 51 1.491 -23.723 -1.122 1.00 50.79 O HETATM 1188 O HOH 52 -14.375 -4.927 -16.527 1.00 37.11 O HETATM 1189 O HOH 53 4.432 -8.454 -25.593 1.00 27.61 O HETATM 1190 O HOH 54 1.270 -23.919 -24.744 1.00 32.12 O HETATM 1191 O HOH 55 1.759 -10.756 -8.944 1.00 32.48 O HETATM 1192 O HOH 56 5.392 -23.425 -22.589 1.00 41.00 O HETATM 1193 O HOH 57 -7.965 3.733 -9.996 1.00 36.06 O HETATM 1194 O HOH 58 -2.450 -24.825 -3.116 1.00 53.65 O HETATM 1195 O HOH 59 9.915 -19.641 -22.093 1.00 49.69 O HETATM 1196 O HOH 60 -13.039 -11.004 -9.082 1.00 43.81 O HETATM 1197 O HOH 61 6.311 -22.429 -15.549 1.00 56.28 O HETATM 1198 O HOH 62 -10.944 3.092 -21.998 1.00 39.96 O HETATM 1199 O HOH 63 6.919 3.056 -8.096 1.00 57.28 O HETATM 1200 O HOH 64 -12.640 12.251 -22.186 1.00 55.33 O HETATM 1201 O HOH 65 -7.710 12.851 -16.276 1.00 33.80 O HETATM 1202 O HOH 66 -7.073 10.323 -20.422 1.00 34.10 O HETATM 1203 O HOH 67 -8.850 -16.306 -9.886 1.00 39.43 O HETATM 1204 O HOH 68 3.268 -8.702 -5.119 1.00 42.70 O HETATM 1205 O HOH 69 -16.215 7.155 -12.358 1.00 50.82 O HETATM 1206 O HOH 70 1.080 -23.898 -27.478 1.00 38.23 O HETATM 1207 O HOH 71 0.441 -25.864 -23.370 1.00 40.55 O HETATM 1208 O HOH 72 9.378 -15.217 -22.214 1.00 33.02 O HETATM 1209 O HOH 73 -2.389 -15.616 -27.161 1.00 36.47 O HETATM 1210 O HOH 74 0.634 -24.982 -18.713 1.00 39.96 O HETATM 1211 O3 N A 48 -0.075 -15.278 -14.484 1.00 -0.42 O HETATM 1212 C14 N A 48 -0.720 -15.891 -13.646 1.00 0.19 C HETATM 1213 C13 N A 48 -0.597 -17.270 -13.398 1.00 -0.01 C HETATM 1214 C12 N A 48 -1.339 -17.986 -12.542 1.00 -0.04 C HETATM 1215 C18 N A 48 -1.168 -19.473 -12.424 1.00 -0.03 C HETATM 1216 H2 N A 48 -0.386 -19.808 -13.120 1.00 0.04 H HETATM 1217 H3 N A 48 -2.117 -19.972 -12.671 1.00 0.04 H HETATM 1218 H4 N A 48 -0.876 -19.728 -11.395 1.00 0.04 H HETATM 1219 C11 N A 48 -2.309 -17.296 -11.731 1.00 -0.01 C HETATM 1220 C16 N A 48 -2.487 -15.916 -11.932 1.00 0.07 C HETATM 1221 N2 N A 48 -1.698 -15.241 -12.906 1.00 -0.23 N HETATM 1222 C15 N A 48 -1.908 -13.822 -13.180 1.00 0.05 C HETATM 1223 H5 N A 48 -1.204 -13.491 -13.958 1.00 0.06 H HETATM 1224 H6 N A 48 -1.738 -13.242 -12.261 1.00 0.06 H HETATM 1225 H7 N A 48 -2.940 -13.664 -13.527 1.00 0.06 H HETATM 1226 C17 N A 48 -3.407 -15.203 -11.173 1.00 -0.01 C HETATM 1227 C1 N A 48 -4.142 -15.865 -10.195 1.00 0.11 C HETATM 1228 O N A 48 -5.024 -15.241 -9.357 1.00 -0.33 O HETATM 1229 C N A 48 -4.772 -13.869 -9.055 1.00 0.06 C HETATM 1230 H9 N A 48 -5.552 -13.494 -8.376 1.00 0.06 H HETATM 1231 H10 N A 48 -4.782 -13.281 -9.985 1.00 0.06 H HETATM 1232 H11 N A 48 -3.788 -13.775 -8.572 1.00 0.06 H HETATM 1233 C2 N A 48 -3.965 -17.234 -9.967 1.00 0.09 C HETATM 1234 C10 N A 48 -3.048 -17.936 -10.731 1.00 -0.05 C HETATM 1235 H12 N A 48 -2.901 -18.995 -10.552 1.00 0.04 H HETATM 1236 N N A 48 -4.719 -17.929 -8.941 1.00 -0.19 N HETATM 1237 S N A 48 -5.211 -19.493 -8.984 1.00 0.09 S HETATM 1238 O1 N A 48 -4.101 -20.384 -9.122 1.00 -0.14 O HETATM 1239 O2 N A 48 -6.035 -19.573 -7.814 1.00 -0.14 O HETATM 1240 C3 N A 48 -6.241 -19.729 -10.401 1.00 0.12 C HETATM 1241 C8 N A 48 -7.051 -18.700 -10.837 1.00 -0.02 C HETATM 1242 C7 N A 48 -7.841 -18.881 -11.956 1.00 -0.03 C HETATM 1243 C6 N A 48 -7.836 -20.096 -12.633 1.00 0.10 C HETATM 1244 C9 N A 48 -8.632 -20.255 -13.816 1.00 0.10 C HETATM 1245 N1 N A 48 -9.266 -20.336 -14.759 1.00 -0.33 N HETATM 1246 C5 N A 48 -7.018 -21.114 -12.200 1.00 -0.03 C HETATM 1247 C4 N A 48 -6.210 -20.936 -11.086 1.00 -0.02 C HETATM 1248 H17 N A 48 -5.558 -21.735 -10.752 1.00 0.07 H HETATM 1249 H16 N A 48 -7.005 -22.059 -12.731 1.00 0.07 H HETATM 1250 H15 N A 48 -8.469 -18.071 -12.309 1.00 0.07 H HETATM 1251 H14 N A 48 -7.067 -17.756 -10.305 1.00 0.07 H HETATM 1252 H13 N A 48 -4.963 -17.402 -8.127 1.00 0.21 H HETATM 1253 H8 N A 48 -3.550 -14.142 -11.341 1.00 0.04 H HETATM 1254 H1 N A 48 0.172 -17.805 -13.953 1.00 0.04 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 1211 1212 CONECT 1212 1211 1213 1221 CONECT 1213 1212 1214 1254 CONECT 1214 1213 1215 1219 CONECT 1215 1214 1216 1217 1218 CONECT 1216 1215 CONECT 1217 1215 CONECT 1218 1215 CONECT 1219 1214 1220 1234 CONECT 1220 1219 1221 1226 CONECT 1221 1212 1220 1222 CONECT 1222 1221 1223 1224 1225 CONECT 1223 1222 CONECT 1224 1222 CONECT 1225 1222 CONECT 1226 1220 1227 1253 CONECT 1227 1226 1228 1233 CONECT 1228 1227 1229 CONECT 1229 1228 1230 1231 1232 CONECT 1230 1229 CONECT 1231 1229 CONECT 1232 1229 CONECT 1233 1227 1234 1236 CONECT 1234 1219 1233 1235 CONECT 1235 1234 CONECT 1236 1233 1237 1252 CONECT 1237 1236 1238 1239 1240 CONECT 1238 1237 CONECT 1239 1237 CONECT 1240 1237 1241 1247 CONECT 1241 1240 1242 1251 CONECT 1242 1241 1243 1250 CONECT 1243 1242 1244 1246 CONECT 1244 1243 1245 CONECT 1245 1244 CONECT 1246 1243 1247 1249 CONECT 1247 1240 1246 1248 CONECT 1248 1247 CONECT 1249 1246 CONECT 1250 1242 CONECT 1251 1241 CONECT 1252 1236 CONECT 1253 1226 CONECT 1254 1213 MASTER 0 0 0 0 0 0 0 0 1253 1 48 9 END
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Related entries of code: 5t4v
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%
5dy7
RCSB PDB
PDBbind
116aa, >5DY7_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%
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
5t4v
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Bromodomain and PHD Finger-Containing Proteins I
Ligand Name
N48
EC.Number
E.C.-.-.-.-
Resolution
1.65(Å)
Affinity (Kd/Ki/IC50)
IC50=60nM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) J. Med. Chem. Vol. 60: pp. 668-680
Ligand Properties
Formula
C
1
9
H
1
7
N
3
O
4
S
Molecular Weight
383.421
Exact Mass
383.094
No. of atoms
44
No. of bonds
46
Polar Surface Area
109.57
LOGP Value
1.65 (
Computed with XLOGP3
)
3.68 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 3
Canonical SMILES
COc1cc2c(cc1NS(=O)(=O)c1ccc(cc1)C#N)c(C)cc(=O)n2C
InChI String
InChI=1S/C19H17N3O4S/c1-12-8-19(23)22(2)17-10-18(26-3)16(9-15(12)17)21-27(24,25)14-6-4-13(11-20)5-7-14/h4-10,21H,1-3H3
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
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