Browse entries in the PDBbind-CN Database
HEADER 5DYA_COMPLEX COMPND 5DYA_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 UNN A 228 27 ATOM 1 N MET A 628 52.908 -1.542 -10.805 1.00 59.00 N ATOM 2 CA MET A 628 51.564 -0.974 -10.737 1.00 65.70 C ATOM 3 C MET A 628 50.939 -1.255 -9.370 1.00 58.55 C ATOM 4 O MET A 628 50.508 -2.381 -9.086 1.00 49.98 O ATOM 5 CB MET A 628 50.691 -1.535 -11.854 1.00 74.84 C ATOM 6 CG MET A 628 49.523 -0.645 -12.220 1.00 84.98 C ATOM 7 SD MET A 628 48.774 -1.181 -13.765 1.00 96.06 S ATOM 8 CE MET A 628 50.229 -1.331 -14.802 1.00102.13 C ATOM 9 HN3 MET A 628 52.856 -2.570 -10.659 1.00 0.00 H ATOM 10 HN2 MET A 628 53.501 -1.115 -10.065 1.00 0.00 H ATOM 11 HN1 MET A 628 53.320 -1.343 -11.739 1.00 0.00 H ATOM 12 N GLN A 629 50.885 -0.219 -8.536 1.00 53.27 N ATOM 13 CA GLN A 629 50.659 -0.373 -7.106 1.00 46.60 C ATOM 14 C GLN A 629 49.177 -0.338 -6.757 1.00 39.23 C ATOM 15 O GLN A 629 48.374 0.357 -7.393 1.00 39.75 O ATOM 16 CB GLN A 629 51.398 0.717 -6.323 1.00 47.31 C ATOM 17 CG GLN A 629 52.915 0.646 -6.414 1.00 53.34 C ATOM 18 CD GLN A 629 53.583 1.841 -5.757 1.00 60.24 C ATOM 19 OE1 GLN A 629 52.908 2.734 -5.241 1.00 59.77 O ATOM 20 NE2 GLN A 629 54.913 1.867 -5.778 1.00 66.04 N ATOM 21 HE22 GLN A 629 55.441 1.091 -6.225 1.00 0.00 H ATOM 22 HE21 GLN A 629 55.424 2.664 -5.347 1.00 0.00 H ATOM 23 H GLN A 629 51.009 0.739 -8.921 1.00 0.00 H ATOM 24 N LEU A 630 48.826 -1.076 -5.702 1.00 39.55 N ATOM 25 CA LEU A 630 47.424 -1.218 -5.330 1.00 37.87 C ATOM 26 C LEU A 630 46.887 0.041 -4.667 1.00 37.39 C ATOM 27 O LEU A 630 45.753 0.437 -4.934 1.00 36.12 O ATOM 28 CB LEU A 630 47.231 -2.419 -4.403 1.00 39.18 C ATOM 29 CG LEU A 630 45.794 -2.682 -3.951 1.00 37.66 C ATOM 30 CD1 LEU A 630 44.876 -2.913 -5.151 1.00 43.10 C ATOM 31 CD2 LEU A 630 45.730 -3.848 -2.989 1.00 45.51 C ATOM 32 H LEU A 630 49.559 -1.554 -5.140 1.00 0.00 H ATOM 33 N THR A 631 47.685 0.680 -3.807 1.00 39.77 N ATOM 34 CA THR A 631 47.171 1.838 -3.074 1.00 39.27 C ATOM 35 C THR A 631 46.706 2.963 -3.992 1.00 37.82 C ATOM 36 O THR A 631 45.562 3.424 -3.824 1.00 37.32 O ATOM 37 CB THR A 631 48.214 2.314 -2.056 1.00 41.91 C ATOM 38 OG1 THR A 631 48.385 1.315 -1.051 1.00 49.37 O ATOM 39 CG2 THR A 631 47.742 3.589 -1.383 1.00 49.06 C ATOM 40 HG1 THR A 631 49.058 1.622 -0.393 1.00 0.00 H ATOM 41 H THR A 631 48.663 0.358 -3.660 1.00 0.00 H ATOM 42 N PRO A 632 47.492 3.450 -4.964 1.00 38.08 N ATOM 43 CA PRO A 632 46.949 4.493 -5.855 1.00 36.94 C ATOM 44 C PRO A 632 45.742 4.037 -6.645 1.00 34.59 C ATOM 45 O PRO A 632 44.834 4.833 -6.909 1.00 33.53 O ATOM 46 CB PRO A 632 48.128 4.832 -6.781 1.00 38.17 C ATOM 47 CG PRO A 632 49.115 3.716 -6.597 1.00 43.29 C ATOM 48 CD PRO A 632 48.931 3.237 -5.201 1.00 42.04 C ATOM 49 N PHE A 633 45.703 2.762 -7.035 1.00 34.00 N ATOM 50 CA PHE A 633 44.541 2.254 -7.746 1.00 32.05 C ATOM 51 C PHE A 633 43.275 2.377 -6.903 1.00 31.64 C ATOM 52 O PHE A 633 42.226 2.794 -7.407 1.00 31.25 O ATOM 53 CB PHE A 633 44.792 0.795 -8.156 1.00 32.17 C ATOM 54 CG PHE A 633 43.639 0.180 -8.898 1.00 30.52 C ATOM 55 CD1 PHE A 633 43.331 0.597 -10.184 1.00 32.06 C ATOM 56 CD2 PHE A 633 42.848 -0.784 -8.302 1.00 30.95 C ATOM 57 CE1 PHE A 633 42.260 0.057 -10.867 1.00 33.00 C ATOM 58 CE2 PHE A 633 41.781 -1.339 -8.981 1.00 29.54 C ATOM 59 CZ PHE A 633 41.486 -0.919 -10.268 1.00 31.90 C ATOM 60 H PHE A 633 46.504 2.131 -6.830 1.00 0.00 H ATOM 61 N LEU A 634 43.342 2.013 -5.619 1.00 32.16 N ATOM 62 CA LEU A 634 42.153 2.096 -4.774 1.00 31.75 C ATOM 63 C LEU A 634 41.775 3.548 -4.508 1.00 34.34 C ATOM 64 O LEU A 634 40.588 3.883 -4.420 1.00 31.86 O ATOM 65 CB LEU A 634 42.375 1.352 -3.460 1.00 33.42 C ATOM 66 CG LEU A 634 42.563 -0.159 -3.604 1.00 33.65 C ATOM 67 CD1 LEU A 634 42.836 -0.795 -2.251 1.00 39.42 C ATOM 68 CD2 LEU A 634 41.341 -0.791 -4.272 1.00 34.45 C ATOM 69 H LEU A 634 44.240 1.671 -5.221 1.00 0.00 H ATOM 70 N ILE A 635 42.771 4.421 -4.371 1.00 34.58 N ATOM 71 CA ILE A 635 42.477 5.850 -4.268 1.00 34.53 C ATOM 72 C ILE A 635 41.696 6.311 -5.488 1.00 33.24 C ATOM 73 O ILE A 635 40.700 7.030 -5.364 1.00 32.33 O ATOM 74 CB ILE A 635 43.780 6.646 -4.080 1.00 35.98 C ATOM 75 CG1 ILE A 635 44.399 6.317 -2.728 1.00 37.72 C ATOM 76 CG2 ILE A 635 43.524 8.153 -4.171 1.00 36.33 C ATOM 77 CD1 ILE A 635 45.749 6.942 -2.517 1.00 39.96 C ATOM 78 H ILE A 635 43.756 4.088 -4.337 1.00 0.00 H ATOM 79 N LEU A 636 42.119 5.885 -6.681 1.00 32.44 N ATOM 80 CA LEU A 636 41.405 6.263 -7.897 1.00 30.81 C ATOM 81 C LEU A 636 39.982 5.710 -7.906 1.00 32.47 C ATOM 82 O LEU A 636 39.040 6.417 -8.275 1.00 28.78 O ATOM 83 CB LEU A 636 42.190 5.796 -9.124 1.00 32.26 C ATOM 84 CG LEU A 636 41.471 5.948 -10.465 1.00 33.25 C ATOM 85 CD1 LEU A 636 41.089 7.401 -10.718 1.00 33.61 C ATOM 86 CD2 LEU A 636 42.302 5.409 -11.603 1.00 39.44 C ATOM 87 H LEU A 636 42.963 5.280 -6.744 1.00 0.00 H ATOM 88 N LEU A 637 39.796 4.453 -7.498 1.00 28.97 N ATOM 89 CA LEU A 637 38.442 3.907 -7.452 1.00 26.43 C ATOM 90 C LEU A 637 37.579 4.660 -6.447 1.00 28.06 C ATOM 91 O LEU A 637 36.384 4.862 -6.683 1.00 28.73 O ATOM 92 CB LEU A 637 38.466 2.416 -7.107 1.00 29.18 C ATOM 93 CG LEU A 637 39.000 1.443 -8.161 1.00 31.34 C ATOM 94 CD1 LEU A 637 38.737 0.021 -7.694 1.00 31.52 C ATOM 95 CD2 LEU A 637 38.361 1.703 -9.532 1.00 28.15 C ATOM 96 H LEU A 637 40.608 3.868 -7.215 1.00 0.00 H ATOM 97 N ARG A 638 38.160 5.050 -5.307 1.00 31.05 N ATOM 98 CA ARG A 638 37.401 5.797 -4.306 1.00 29.48 C ATOM 99 C ARG A 638 36.953 7.138 -4.868 1.00 29.27 C ATOM 100 O ARG A 638 35.794 7.536 -4.704 1.00 32.87 O ATOM 101 CB ARG A 638 38.224 6.014 -3.033 1.00 35.22 C ATOM 102 CG ARG A 638 38.470 4.745 -2.224 1.00 37.70 C ATOM 103 CD ARG A 638 39.060 5.039 -0.847 1.00 44.66 C ATOM 104 NE ARG A 638 39.496 3.802 -0.204 1.00 42.69 N ATOM 105 CZ ARG A 638 40.745 3.349 -0.227 1.00 47.13 C ATOM 106 NH1 ARG A 638 41.698 4.044 -0.835 1.00 47.60 N ATOM 107 NH2 ARG A 638 41.044 2.202 0.368 1.00 47.55 N ATOM 108 HE ARG A 638 38.784 3.240 0.304 1.00 0.00 H ATOM 109 HH12 ARG A 638 42.674 3.685 -0.850 1.00 0.00 H ATOM 110 HH11 ARG A 638 41.469 4.948 -1.296 1.00 0.00 H ATOM 111 HH22 ARG A 638 42.021 1.846 0.351 1.00 0.00 H ATOM 112 HH21 ARG A 638 40.301 1.658 0.852 1.00 0.00 H ATOM 113 H ARG A 638 39.159 4.820 -5.132 1.00 0.00 H ATOM 114 N LYS A 639 37.867 7.844 -5.541 1.00 31.41 N ATOM 115 CA LYS A 639 37.520 9.119 -6.169 1.00 30.19 C ATOM 116 C LYS A 639 36.463 8.929 -7.249 1.00 30.27 C ATOM 117 O LYS A 639 35.482 9.690 -7.321 1.00 30.61 O ATOM 118 CB LYS A 639 38.779 9.761 -6.758 1.00 35.58 C ATOM 119 CG LYS A 639 38.544 11.004 -7.620 1.00 37.79 C ATOM 120 CD LYS A 639 39.839 11.474 -8.278 1.00 41.84 C ATOM 121 CE LYS A 639 39.629 12.799 -9.011 1.00 49.42 C ATOM 122 NZ LYS A 639 40.874 13.315 -9.642 1.00 54.23 N ATOM 123 HZ1 LYS A 639 41.595 13.469 -8.908 1.00 0.00 H ATOM 124 HZ2 LYS A 639 41.224 12.622 -10.334 1.00 0.00 H ATOM 125 HZ3 LYS A 639 40.670 14.214 -10.123 1.00 0.00 H ATOM 126 H LYS A 639 38.839 7.482 -5.619 1.00 0.00 H ATOM 127 N THR A 640 36.651 7.916 -8.099 1.00 28.97 N ATOM 128 CA THR A 640 35.673 7.624 -9.139 1.00 25.05 C ATOM 129 C THR A 640 34.311 7.317 -8.538 1.00 30.66 C ATOM 130 O THR A 640 33.287 7.797 -9.031 1.00 27.70 O ATOM 131 CB THR A 640 36.157 6.453 -9.996 1.00 27.58 C ATOM 132 OG1 THR A 640 37.486 6.732 -10.472 1.00 29.00 O ATOM 133 CG2 THR A 640 35.207 6.233 -11.180 1.00 25.75 C ATOM 134 HG1 THR A 640 38.093 6.852 -9.700 1.00 0.00 H ATOM 135 H THR A 640 37.505 7.329 -8.018 1.00 0.00 H ATOM 136 N LEU A 641 34.275 6.499 -7.481 1.00 28.34 N ATOM 137 CA LEU A 641 33.001 6.180 -6.846 1.00 25.84 C ATOM 138 C LEU A 641 32.337 7.441 -6.292 1.00 30.43 C ATOM 139 O LEU A 641 31.118 7.609 -6.418 1.00 31.31 O ATOM 140 CB LEU A 641 33.216 5.126 -5.751 1.00 29.45 C ATOM 141 CG LEU A 641 31.983 4.638 -4.992 1.00 33.88 C ATOM 142 CD1 LEU A 641 30.975 3.999 -5.942 1.00 31.40 C ATOM 143 CD2 LEU A 641 32.391 3.652 -3.902 1.00 32.98 C ATOM 144 H LEU A 641 35.157 6.090 -7.111 1.00 0.00 H ATOM 145 N GLU A 642 33.125 8.345 -5.695 1.00 28.48 N ATOM 146 CA GLU A 642 32.577 9.614 -5.221 1.00 31.71 C ATOM 147 C GLU A 642 32.005 10.420 -6.376 1.00 30.83 C ATOM 148 O GLU A 642 30.948 11.046 -6.236 1.00 33.14 O ATOM 149 CB GLU A 642 33.648 10.424 -4.496 1.00 33.34 C ATOM 150 CG GLU A 642 33.805 10.074 -3.028 1.00 51.39 C ATOM 151 CD GLU A 642 34.955 10.817 -2.376 1.00 70.87 C ATOM 152 OE1 GLU A 642 35.698 10.193 -1.590 1.00 79.62 O ATOM 153 OE2 GLU A 642 35.122 12.023 -2.657 1.00 76.88 O ATOM 154 H GLU A 642 34.137 8.142 -5.568 1.00 0.00 H ATOM 155 N GLN A 643 32.683 10.409 -7.529 1.00 30.56 N ATOM 156 CA GLN A 643 32.193 11.178 -8.675 1.00 30.44 C ATOM 157 C GLN A 643 30.905 10.578 -9.222 1.00 25.38 C ATOM 158 O GLN A 643 30.006 11.305 -9.658 1.00 31.39 O ATOM 159 CB GLN A 643 33.257 11.238 -9.775 1.00 31.52 C ATOM 160 CG GLN A 643 34.518 11.990 -9.404 1.00 34.10 C ATOM 161 CD GLN A 643 35.608 11.869 -10.457 1.00 35.35 C ATOM 162 OE1 GLN A 643 35.800 10.810 -11.044 1.00 35.29 O ATOM 163 NE2 GLN A 643 36.335 12.955 -10.690 1.00 41.01 N ATOM 164 HE22 GLN A 643 36.139 13.834 -10.169 1.00 0.00 H ATOM 165 HE21 GLN A 643 37.101 12.927 -11.393 1.00 0.00 H ATOM 166 H GLN A 643 33.559 9.854 -7.612 1.00 0.00 H ATOM 167 N LEU A 644 30.808 9.244 -9.216 1.00 26.34 N ATOM 168 CA LEU A 644 29.577 8.589 -9.631 1.00 24.59 C ATOM 169 C LEU A 644 28.432 8.913 -8.680 1.00 27.73 C ATOM 170 O LEU A 644 27.313 9.188 -9.126 1.00 28.50 O ATOM 171 CB LEU A 644 29.796 7.074 -9.707 1.00 24.00 C ATOM 172 CG LEU A 644 30.690 6.616 -10.848 1.00 23.36 C ATOM 173 CD1 LEU A 644 30.996 5.131 -10.671 1.00 25.77 C ATOM 174 CD2 LEU A 644 30.048 6.877 -12.203 1.00 27.78 C ATOM 175 H LEU A 644 31.620 8.670 -8.912 1.00 0.00 H ATOM 176 N GLN A 645 28.681 8.850 -7.371 1.00 29.35 N ATOM 177 CA GLN A 645 27.635 9.188 -6.409 1.00 28.47 C ATOM 178 C GLN A 645 27.170 10.625 -6.575 1.00 32.37 C ATOM 179 O GLN A 645 25.999 10.923 -6.329 1.00 36.35 O ATOM 180 CB GLN A 645 28.123 8.976 -4.978 1.00 38.48 C ATOM 181 CG GLN A 645 28.403 7.533 -4.632 1.00 39.83 C ATOM 182 CD GLN A 645 28.250 7.257 -3.152 1.00 53.30 C ATOM 183 OE1 GLN A 645 27.167 7.431 -2.586 1.00 64.10 O ATOM 184 NE2 GLN A 645 29.332 6.832 -2.514 1.00 57.64 N ATOM 185 HE22 GLN A 645 30.223 6.700 -3.033 1.00 0.00 H ATOM 186 HE21 GLN A 645 29.289 6.631 -1.495 1.00 0.00 H ATOM 187 H GLN A 645 29.621 8.560 -7.035 1.00 0.00 H ATOM 188 N GLU A 646 28.067 11.521 -6.992 1.00 30.38 N ATOM 189 CA GLU A 646 27.690 12.917 -7.206 1.00 32.12 C ATOM 190 C GLU A 646 26.646 13.063 -8.300 1.00 33.02 C ATOM 191 O GLU A 646 25.822 13.990 -8.249 1.00 33.85 O ATOM 192 CB GLU A 646 28.921 13.744 -7.556 1.00 38.71 C ATOM 193 CG GLU A 646 29.795 14.084 -6.375 1.00 54.77 C ATOM 194 CD GLU A 646 31.102 14.714 -6.804 1.00 75.41 C ATOM 195 OE1 GLU A 646 31.183 15.172 -7.965 1.00 75.90 O ATOM 196 OE2 GLU A 646 32.049 14.738 -5.988 1.00 87.22 O ATOM 197 H GLU A 646 29.048 11.222 -7.167 1.00 0.00 H ATOM 198 N LYS A 647 26.676 12.187 -9.305 1.00 30.05 N ATOM 199 CA LYS A 647 25.671 12.187 -10.363 1.00 31.73 C ATOM 200 C LYS A 647 24.320 11.677 -9.889 1.00 40.77 C ATOM 201 O LYS A 647 23.327 11.861 -10.600 1.00 45.31 O ATOM 202 CB LYS A 647 26.140 11.354 -11.554 1.00 32.02 C ATOM 203 CG LYS A 647 27.495 11.752 -12.107 1.00 32.29 C ATOM 204 CD LYS A 647 27.543 13.216 -12.490 1.00 35.21 C ATOM 205 CE LYS A 647 28.836 13.544 -13.221 1.00 39.01 C ATOM 206 NZ LYS A 647 28.857 14.950 -13.679 1.00 41.25 N ATOM 207 HZ1 LYS A 647 28.061 15.114 -14.327 1.00 0.00 H ATOM 208 HZ2 LYS A 647 28.773 15.582 -12.858 1.00 0.00 H ATOM 209 HZ3 LYS A 647 29.752 15.139 -14.173 1.00 0.00 H ATOM 210 H LYS A 647 27.440 11.482 -9.336 1.00 0.00 H ATOM 211 N ASP A 648 24.256 11.065 -8.710 1.00 33.48 N ATOM 212 CA ASP A 648 23.001 10.590 -8.129 1.00 37.73 C ATOM 213 C ASP A 648 22.529 11.643 -7.132 1.00 32.73 C ATOM 214 O ASP A 648 22.654 11.506 -5.920 1.00 36.28 O ATOM 215 CB ASP A 648 23.213 9.210 -7.495 1.00 35.34 C ATOM 216 CG ASP A 648 22.011 8.719 -6.700 1.00 43.27 C ATOM 217 OD1 ASP A 648 20.858 9.143 -6.981 1.00 35.15 O ATOM 218 OD2 ASP A 648 22.227 7.895 -5.783 1.00 37.74 O ATOM 219 H ASP A 648 25.137 10.918 -8.178 1.00 0.00 H ATOM 220 N THR A 649 21.977 12.737 -7.671 1.00 35.46 N ATOM 221 CA THR A 649 21.643 13.871 -6.814 1.00 35.06 C ATOM 222 C THR A 649 20.496 13.547 -5.867 1.00 38.09 C ATOM 223 O THR A 649 20.437 14.101 -4.762 1.00 43.04 O ATOM 224 CB THR A 649 21.282 15.099 -7.653 1.00 36.42 C ATOM 225 OG1 THR A 649 20.204 14.764 -8.526 1.00 36.28 O ATOM 226 CG2 THR A 649 22.468 15.558 -8.483 1.00 40.45 C ATOM 227 HG1 THR A 649 19.965 15.555 -9.072 1.00 0.00 H ATOM 228 H THR A 649 21.787 12.779 -8.693 1.00 0.00 H ATOM 229 N GLY A 650 19.563 12.683 -6.290 1.00 33.41 N ATOM 230 CA GLY A 650 18.492 12.245 -5.414 1.00 40.03 C ATOM 231 C GLY A 650 18.861 11.153 -4.439 1.00 39.65 C ATOM 232 O GLY A 650 18.039 10.772 -3.601 1.00 42.15 O ATOM 233 H GLY A 650 19.607 12.320 -7.264 1.00 0.00 H ATOM 234 N ASN A 651 20.093 10.657 -4.529 1.00 35.54 N ATOM 235 CA ASN A 651 20.604 9.575 -3.680 1.00 40.13 C ATOM 236 C ASN A 651 19.698 8.347 -3.706 1.00 43.22 C ATOM 237 O ASN A 651 19.519 7.661 -2.698 1.00 56.67 O ATOM 238 CB ASN A 651 20.833 10.065 -2.253 1.00 49.85 C ATOM 239 CG ASN A 651 22.077 10.908 -2.140 1.00 53.81 C ATOM 240 OD1 ASN A 651 23.115 10.582 -2.721 1.00 64.10 O ATOM 241 ND2 ASN A 651 21.982 12.003 -1.419 1.00 58.07 N ATOM 242 HD22 ASN A 651 21.086 12.238 -0.946 1.00 0.00 H ATOM 243 HD21 ASN A 651 22.803 12.634 -1.321 1.00 0.00 H ATOM 244 H ASN A 651 20.732 11.061 -5.244 1.00 0.00 H ATOM 245 N ILE A 652 19.134 8.051 -4.880 1.00 34.31 N ATOM 246 CA ILE A 652 18.276 6.879 -5.013 1.00 34.50 C ATOM 247 C ILE A 652 19.082 5.624 -5.303 1.00 33.26 C ATOM 248 O ILE A 652 18.531 4.515 -5.232 1.00 35.45 O ATOM 249 CB ILE A 652 17.221 7.071 -6.117 1.00 32.89 C ATOM 250 CG1 ILE A 652 17.907 7.326 -7.464 1.00 37.52 C ATOM 251 CG2 ILE A 652 16.242 8.182 -5.726 1.00 37.37 C ATOM 252 CD1 ILE A 652 16.936 7.616 -8.597 1.00 38.79 C ATOM 253 H ILE A 652 19.308 8.660 -5.705 1.00 0.00 H ATOM 254 N PHE A 653 20.361 5.770 -5.640 1.00 30.49 N ATOM 255 CA PHE A 653 21.260 4.662 -5.935 1.00 30.74 C ATOM 256 C PHE A 653 22.322 4.458 -4.866 1.00 32.34 C ATOM 257 O PHE A 653 23.185 3.592 -5.031 1.00 32.18 O ATOM 258 CB PHE A 653 21.971 4.895 -7.278 1.00 28.78 C ATOM 259 CG PHE A 653 21.041 5.073 -8.447 1.00 30.04 C ATOM 260 CD1 PHE A 653 20.269 4.017 -8.900 1.00 30.63 C ATOM 261 CD2 PHE A 653 20.952 6.293 -9.102 1.00 35.21 C ATOM 262 CE1 PHE A 653 19.421 4.172 -9.984 1.00 28.63 C ATOM 263 CE2 PHE A 653 20.093 6.459 -10.184 1.00 36.82 C ATOM 264 CZ PHE A 653 19.333 5.389 -10.625 1.00 36.30 C ATOM 265 H PHE A 653 20.743 6.736 -5.696 1.00 0.00 H ATOM 266 N SER A 654 22.312 5.238 -3.792 1.00 34.08 N ATOM 267 CA SER A 654 23.446 5.219 -2.881 1.00 37.94 C ATOM 268 C SER A 654 23.285 4.234 -1.728 1.00 41.40 C ATOM 269 O SER A 654 24.253 4.009 -0.996 1.00 41.03 O ATOM 270 CB SER A 654 23.710 6.632 -2.353 1.00 44.53 C ATOM 271 OG SER A 654 24.109 7.484 -3.423 1.00 44.46 O ATOM 272 HG SER A 654 23.389 7.518 -4.102 1.00 0.00 H ATOM 273 H SER A 654 21.499 5.858 -3.603 1.00 0.00 H ATOM 274 N GLU A 655 22.120 3.625 -1.565 1.00 40.55 N ATOM 275 CA GLU A 655 21.887 2.626 -0.535 1.00 39.26 C ATOM 276 C GLU A 655 21.080 1.486 -1.143 1.00 37.85 C ATOM 277 O GLU A 655 20.431 1.664 -2.177 1.00 38.39 O ATOM 278 CB GLU A 655 21.153 3.223 0.676 1.00 43.94 C ATOM 279 CG GLU A 655 22.015 4.131 1.530 1.00 51.12 C ATOM 280 CD GLU A 655 21.436 4.336 2.916 1.00 78.82 C ATOM 281 OE1 GLU A 655 20.238 4.035 3.110 1.00 85.01 O ATOM 282 OE2 GLU A 655 22.178 4.787 3.815 1.00 91.35 O ATOM 283 H GLU A 655 21.337 3.873 -2.203 1.00 0.00 H ATOM 284 N PRO A 656 21.116 0.302 -0.532 1.00 40.83 N ATOM 285 CA PRO A 656 20.330 -0.812 -1.076 1.00 42.96 C ATOM 286 C PRO A 656 18.857 -0.440 -1.179 1.00 43.46 C ATOM 287 O PRO A 656 18.327 0.291 -0.342 1.00 45.92 O ATOM 288 CB PRO A 656 20.561 -1.936 -0.060 1.00 49.27 C ATOM 289 CG PRO A 656 21.879 -1.608 0.565 1.00 47.62 C ATOM 290 CD PRO A 656 21.940 -0.112 0.618 1.00 43.78 C ATOM 291 N VAL A 657 18.208 -0.928 -2.233 1.00 45.75 N ATOM 292 CA VAL A 657 16.778 -0.691 -2.431 1.00 50.86 C ATOM 293 C VAL A 657 16.056 -1.155 -1.173 1.00 59.99 C ATOM 294 O VAL A 657 16.092 -2.351 -0.843 1.00 52.57 O ATOM 295 CB VAL A 657 16.246 -1.412 -3.681 1.00 49.73 C ATOM 296 CG1 VAL A 657 14.756 -1.138 -3.862 1.00 44.87 C ATOM 297 CG2 VAL A 657 17.019 -0.978 -4.914 1.00 45.75 C ATOM 298 H VAL A 657 18.730 -1.492 -2.934 1.00 0.00 H ATOM 299 N PRO A 658 15.422 -0.250 -0.428 1.00 60.36 N ATOM 300 CA PRO A 658 14.786 -0.651 0.832 1.00 66.38 C ATOM 301 C PRO A 658 13.670 -1.652 0.596 1.00 66.15 C ATOM 302 O PRO A 658 12.576 -1.294 0.148 1.00 60.27 O ATOM 303 CB PRO A 658 14.264 0.674 1.405 1.00 71.59 C ATOM 304 CG PRO A 658 14.135 1.578 0.223 1.00 71.60 C ATOM 305 CD PRO A 658 15.230 1.181 -0.723 1.00 65.88 C ATOM 306 N LEU A 659 13.962 -2.922 0.885 1.00 65.81 N ATOM 307 CA LEU A 659 13.005 -3.999 0.665 1.00 69.37 C ATOM 308 C LEU A 659 11.680 -3.749 1.377 1.00 72.98 C ATOM 309 O LEU A 659 10.654 -4.308 0.970 1.00 73.55 O ATOM 310 CB LEU A 659 13.631 -5.323 1.116 1.00 72.58 C ATOM 311 CG LEU A 659 12.999 -6.662 0.729 1.00 72.92 C ATOM 312 CD1 LEU A 659 11.879 -7.025 1.680 1.00 76.58 C ATOM 313 CD2 LEU A 659 12.506 -6.637 -0.707 1.00 68.73 C ATOM 314 H LEU A 659 14.898 -3.149 1.278 1.00 0.00 H ATOM 315 N SER A 660 11.675 -2.919 2.423 1.00 75.44 N ATOM 316 CA SER A 660 10.421 -2.534 3.059 1.00 78.36 C ATOM 317 C SER A 660 9.460 -1.936 2.041 1.00 79.37 C ATOM 318 O SER A 660 8.285 -2.314 1.977 1.00 83.35 O ATOM 319 CB SER A 660 10.685 -1.536 4.190 1.00 77.92 C ATOM 320 OG SER A 660 10.761 -0.208 3.694 1.00 72.20 O ATOM 321 HG SER A 660 10.932 0.414 4.445 1.00 0.00 H ATOM 322 H SER A 660 12.574 -2.544 2.787 1.00 0.00 H ATOM 323 N GLU A 661 9.951 -1.003 1.224 1.00 73.43 N ATOM 324 CA GLU A 661 9.094 -0.329 0.258 1.00 73.74 C ATOM 325 C GLU A 661 8.837 -1.178 -0.979 1.00 68.27 C ATOM 326 O GLU A 661 7.755 -1.092 -1.570 1.00 69.71 O ATOM 327 CB GLU A 661 9.717 1.006 -0.155 1.00 78.29 C ATOM 328 CG GLU A 661 10.196 1.850 1.010 1.00 89.13 C ATOM 329 CD GLU A 661 10.181 3.330 0.691 1.00 96.99 C ATOM 330 OE1 GLU A 661 9.362 3.745 -0.158 1.00 97.48 O ATOM 331 OE2 GLU A 661 10.985 4.077 1.289 1.00101.67 O ATOM 332 H GLU A 661 10.959 -0.753 1.277 1.00 0.00 H ATOM 333 N VAL A 662 9.805 -1.993 -1.383 1.00 70.48 N ATOM 334 CA VAL A 662 9.710 -2.740 -2.633 1.00 61.45 C ATOM 335 C VAL A 662 9.795 -4.234 -2.338 1.00 62.38 C ATOM 336 O VAL A 662 10.806 -4.871 -2.661 1.00 62.47 O ATOM 337 CB VAL A 662 10.809 -2.297 -3.610 1.00 58.81 C ATOM 338 CG1 VAL A 662 10.471 -2.735 -5.000 1.00 57.27 C ATOM 339 CG2 VAL A 662 10.994 -0.783 -3.554 1.00 54.00 C ATOM 340 H VAL A 662 10.654 -2.102 -0.792 1.00 0.00 H ATOM 341 N PRO A 663 8.752 -4.839 -1.758 1.00 63.31 N ATOM 342 CA PRO A 663 8.883 -6.226 -1.275 1.00 61.97 C ATOM 343 C PRO A 663 9.128 -7.249 -2.371 1.00 62.36 C ATOM 344 O PRO A 663 9.723 -8.298 -2.097 1.00 70.50 O ATOM 345 CB PRO A 663 7.542 -6.473 -0.568 1.00 64.42 C ATOM 346 CG PRO A 663 6.594 -5.537 -1.235 1.00 63.54 C ATOM 347 CD PRO A 663 7.393 -4.308 -1.565 1.00 68.78 C ATOM 348 N ASP A 664 8.699 -6.985 -3.602 1.00 59.17 N ATOM 349 CA ASP A 664 8.894 -7.933 -4.691 1.00 64.60 C ATOM 350 C ASP A 664 10.204 -7.719 -5.440 1.00 58.06 C ATOM 351 O ASP A 664 10.418 -8.358 -6.476 1.00 56.99 O ATOM 352 CB ASP A 664 7.727 -7.853 -5.675 1.00 66.66 C ATOM 353 CG ASP A 664 7.759 -6.593 -6.514 1.00 66.34 C ATOM 354 OD1 ASP A 664 8.189 -5.540 -5.996 1.00 63.06 O ATOM 355 OD2 ASP A 664 7.357 -6.657 -7.695 1.00 69.57 O ATOM 356 H ASP A 664 8.215 -6.084 -3.791 1.00 0.00 H ATOM 357 N TYR A 665 11.086 -6.855 -4.930 1.00 59.62 N ATOM 358 CA TYR A 665 12.239 -6.409 -5.711 1.00 54.56 C ATOM 359 C TYR A 665 13.156 -7.567 -6.095 1.00 57.26 C ATOM 360 O TYR A 665 13.690 -7.598 -7.210 1.00 59.82 O ATOM 361 CB TYR A 665 13.012 -5.347 -4.933 1.00 47.52 C ATOM 362 CG TYR A 665 14.148 -4.722 -5.719 1.00 44.67 C ATOM 363 CD1 TYR A 665 13.910 -3.715 -6.651 1.00 43.64 C ATOM 364 CD2 TYR A 665 15.457 -5.139 -5.526 1.00 46.79 C ATOM 365 CE1 TYR A 665 14.963 -3.141 -7.377 1.00 40.31 C ATOM 366 CE2 TYR A 665 16.507 -4.575 -6.237 1.00 41.78 C ATOM 367 CZ TYR A 665 16.257 -3.581 -7.163 1.00 40.14 C ATOM 368 OH TYR A 665 17.310 -3.027 -7.866 1.00 34.68 O ATOM 369 HH TYR A 665 16.965 -2.335 -8.484 1.00 0.00 H ATOM 370 H TYR A 665 10.951 -6.494 -3.964 1.00 0.00 H ATOM 371 N LEU A 666 13.352 -8.530 -5.194 1.00 59.96 N ATOM 372 CA LEU A 666 14.241 -9.653 -5.479 1.00 60.51 C ATOM 373 C LEU A 666 13.594 -10.739 -6.331 1.00 59.94 C ATOM 374 O LEU A 666 14.250 -11.749 -6.609 1.00 58.81 O ATOM 375 CB LEU A 666 14.754 -10.270 -4.173 1.00 59.26 C ATOM 376 CG LEU A 666 16.238 -10.052 -3.852 1.00 60.85 C ATOM 377 CD1 LEU A 666 17.150 -11.009 -4.632 1.00 52.73 C ATOM 378 CD2 LEU A 666 16.639 -8.604 -4.107 1.00 55.55 C ATOM 379 H LEU A 666 12.865 -8.481 -4.276 1.00 0.00 H ATOM 380 N ASP A 667 12.337 -10.566 -6.751 1.00 60.48 N ATOM 381 CA ASP A 667 11.683 -11.602 -7.546 1.00 59.53 C ATOM 382 C ASP A 667 12.337 -11.758 -8.913 1.00 60.31 C ATOM 383 O ASP A 667 12.367 -12.864 -9.465 1.00 61.15 O ATOM 384 CB ASP A 667 10.193 -11.290 -7.698 1.00 64.91 C ATOM 385 H ASP A 667 11.824 -9.693 -6.512 1.00 0.00 H ATOM 386 N HIS A 668 12.867 -10.670 -9.477 1.00 57.07 N ATOM 387 CA HIS A 668 13.557 -10.730 -10.756 1.00 59.83 C ATOM 388 C HIS A 668 14.866 -9.952 -10.772 1.00 54.64 C ATOM 389 O HIS A 668 15.526 -9.920 -11.816 1.00 58.02 O ATOM 390 CB HIS A 668 12.653 -10.220 -11.893 1.00 59.96 C ATOM 391 CG HIS A 668 11.619 -11.209 -12.336 1.00 67.85 C ATOM 392 ND1 HIS A 668 10.266 -10.996 -12.175 1.00 70.51 N ATOM 393 CD2 HIS A 668 11.741 -12.422 -12.927 1.00 71.06 C ATOM 394 CE1 HIS A 668 9.599 -12.034 -12.649 1.00 72.31 C ATOM 395 NE2 HIS A 668 10.470 -12.913 -13.112 1.00 73.66 N ATOM 396 H HIS A 668 12.784 -9.755 -8.989 1.00 0.00 H ATOM 397 N ILE A 669 15.260 -9.329 -9.663 1.00 56.14 N ATOM 398 CA ILE A 669 16.565 -8.684 -9.532 1.00 49.14 C ATOM 399 C ILE A 669 17.469 -9.665 -8.790 1.00 48.54 C ATOM 400 O ILE A 669 17.411 -9.770 -7.562 1.00 51.61 O ATOM 401 CB ILE A 669 16.473 -7.341 -8.801 1.00 47.34 C ATOM 402 CG1 ILE A 669 15.557 -6.370 -9.555 1.00 44.59 C ATOM 403 CG2 ILE A 669 17.858 -6.742 -8.619 1.00 40.85 C ATOM 404 CD1 ILE A 669 15.988 -6.095 -10.983 1.00 43.19 C ATOM 405 H ILE A 669 14.609 -9.300 -8.853 1.00 0.00 H ATOM 406 N LYS A 670 18.320 -10.379 -9.531 1.00 44.39 N ATOM 407 CA LYS A 670 19.089 -11.460 -8.920 1.00 50.59 C ATOM 408 C LYS A 670 20.308 -10.955 -8.156 1.00 48.15 C ATOM 409 O LYS A 670 20.720 -11.589 -7.178 1.00 51.86 O ATOM 410 CB LYS A 670 19.517 -12.480 -9.981 1.00 57.89 C ATOM 411 CG LYS A 670 20.214 -11.872 -11.191 1.00 60.87 C ATOM 412 CD LYS A 670 20.869 -12.943 -12.059 1.00 62.54 C ATOM 413 CE LYS A 670 21.390 -12.365 -13.370 1.00 56.96 C ATOM 414 H LYS A 670 18.435 -10.166 -10.542 1.00 0.00 H ATOM 415 N LYS A 671 20.904 -9.836 -8.568 1.00 44.15 N ATOM 416 CA LYS A 671 22.038 -9.262 -7.846 1.00 38.74 C ATOM 417 C LYS A 671 21.798 -7.773 -7.649 1.00 37.88 C ATOM 418 O LYS A 671 22.215 -6.947 -8.470 1.00 33.49 O ATOM 419 CB LYS A 671 23.364 -9.514 -8.564 1.00 45.03 C ATOM 420 CG LYS A 671 24.573 -9.104 -7.712 1.00 48.51 C ATOM 421 CD LYS A 671 25.924 -9.446 -8.353 1.00 46.88 C ATOM 422 CE LYS A 671 27.052 -8.742 -7.610 1.00 56.53 C ATOM 423 NZ LYS A 671 28.344 -8.754 -8.353 1.00 57.41 N ATOM 424 HZ1 LYS A 671 28.640 -9.738 -8.515 1.00 0.00 H ATOM 425 HZ2 LYS A 671 28.221 -8.273 -9.267 1.00 0.00 H ATOM 426 HZ3 LYS A 671 29.069 -8.260 -7.794 1.00 0.00 H ATOM 427 H LYS A 671 20.554 -9.360 -9.424 1.00 0.00 H ATOM 428 N PRO A 672 21.124 -7.399 -6.565 1.00 38.47 N ATOM 429 CA PRO A 672 20.996 -5.977 -6.232 1.00 37.63 C ATOM 430 C PRO A 672 22.360 -5.329 -6.051 1.00 30.86 C ATOM 431 O PRO A 672 23.333 -5.968 -5.648 1.00 37.35 O ATOM 432 CB PRO A 672 20.201 -5.989 -4.919 1.00 43.96 C ATOM 433 CG PRO A 672 20.355 -7.387 -4.386 1.00 48.96 C ATOM 434 CD PRO A 672 20.442 -8.262 -5.590 1.00 43.03 C ATOM 435 N MET A 673 22.428 -4.035 -6.365 1.00 29.87 N ATOM 436 CA MET A 673 23.677 -3.306 -6.219 1.00 29.61 C ATOM 437 C MET A 673 23.349 -1.840 -5.987 1.00 29.43 C ATOM 438 O MET A 673 22.284 -1.358 -6.388 1.00 31.19 O ATOM 439 CB MET A 673 24.578 -3.491 -7.449 1.00 32.04 C ATOM 440 CG MET A 673 25.985 -2.926 -7.334 1.00 32.78 C ATOM 441 SD MET A 673 26.921 -3.431 -5.867 1.00 30.54 S ATOM 442 CE MET A 673 26.808 -5.230 -5.964 1.00 32.78 C ATOM 443 H MET A 673 21.581 -3.544 -6.717 1.00 0.00 H ATOM 444 N ASP A 674 24.267 -1.154 -5.311 1.00 31.16 N ATOM 445 CA ASP A 674 24.119 0.243 -4.929 1.00 30.40 C ATOM 446 C ASP A 674 25.497 0.771 -4.563 1.00 34.24 C ATOM 447 O ASP A 674 26.441 0.004 -4.359 1.00 31.11 O ATOM 448 CB ASP A 674 23.171 0.397 -3.745 1.00 29.95 C ATOM 449 CG ASP A 674 23.726 -0.248 -2.503 1.00 34.92 C ATOM 450 OD1 ASP A 674 23.516 -1.467 -2.334 1.00 38.77 O ATOM 451 OD2 ASP A 674 24.404 0.446 -1.718 1.00 39.00 O ATOM 452 H ASP A 674 25.143 -1.645 -5.039 1.00 0.00 H ATOM 453 N PHE A 675 25.594 2.095 -4.434 1.00 34.16 N ATOM 454 CA PHE A 675 26.897 2.702 -4.188 1.00 33.05 C ATOM 455 C PHE A 675 27.450 2.382 -2.804 1.00 33.79 C ATOM 456 O PHE A 675 28.669 2.366 -2.630 1.00 34.92 O ATOM 457 CB PHE A 675 26.823 4.212 -4.382 1.00 32.66 C ATOM 458 CG PHE A 675 26.656 4.633 -5.815 1.00 30.66 C ATOM 459 CD1 PHE A 675 27.444 4.088 -6.813 1.00 29.38 C ATOM 460 CD2 PHE A 675 25.704 5.577 -6.167 1.00 31.48 C ATOM 461 CE1 PHE A 675 27.307 4.477 -8.136 1.00 28.98 C ATOM 462 CE2 PHE A 675 25.560 5.956 -7.486 1.00 26.19 C ATOM 463 CZ PHE A 675 26.366 5.404 -8.474 1.00 28.55 C ATOM 464 H PHE A 675 24.745 2.691 -4.508 1.00 0.00 H ATOM 465 N PHE A 676 26.594 2.177 -1.798 1.00 31.38 N ATOM 466 CA PHE A 676 27.128 1.829 -0.488 1.00 34.46 C ATOM 467 C PHE A 676 27.745 0.441 -0.529 1.00 37.90 C ATOM 468 O PHE A 676 28.836 0.220 0.008 1.00 37.79 O ATOM 469 CB PHE A 676 26.040 1.907 0.585 1.00 39.84 C ATOM 470 CG PHE A 676 26.504 1.460 1.937 1.00 45.19 C ATOM 471 CD1 PHE A 676 27.230 2.315 2.749 1.00 46.82 C ATOM 472 CD2 PHE A 676 26.235 0.178 2.387 1.00 47.01 C ATOM 473 CE1 PHE A 676 27.669 1.905 3.994 1.00 51.80 C ATOM 474 CE2 PHE A 676 26.672 -0.241 3.629 1.00 47.93 C ATOM 475 CZ PHE A 676 27.390 0.624 4.435 1.00 52.54 C ATOM 476 H PHE A 676 25.568 2.264 -1.947 1.00 0.00 H ATOM 477 N THR A 677 27.070 -0.495 -1.198 1.00 32.98 N ATOM 478 CA THR A 677 27.620 -1.840 -1.343 1.00 35.38 C ATOM 479 C THR A 677 28.913 -1.818 -2.153 1.00 31.85 C ATOM 480 O THR A 677 29.870 -2.531 -1.827 1.00 33.33 O ATOM 481 CB THR A 677 26.571 -2.752 -1.978 1.00 35.24 C ATOM 482 OG1 THR A 677 25.464 -2.883 -1.073 1.00 37.60 O ATOM 483 CG2 THR A 677 27.140 -4.151 -2.263 1.00 34.42 C ATOM 484 HG1 THR A 677 25.073 -1.990 -0.900 1.00 0.00 H ATOM 485 H THR A 677 26.147 -0.266 -1.619 1.00 0.00 H ATOM 486 N MET A 678 28.979 -0.979 -3.192 1.00 32.46 N ATOM 487 CA MET A 678 30.215 -0.870 -3.961 1.00 30.11 C ATOM 488 C MET A 678 31.360 -0.367 -3.091 1.00 30.65 C ATOM 489 O MET A 678 32.497 -0.838 -3.214 1.00 30.80 O ATOM 490 CB MET A 678 30.017 0.054 -5.162 1.00 29.85 C ATOM 491 CG MET A 678 29.149 -0.505 -6.288 1.00 25.74 C ATOM 492 SD MET A 678 29.246 0.551 -7.757 1.00 27.82 S ATOM 493 CE MET A 678 30.991 0.354 -8.180 1.00 27.87 C ATOM 494 H MET A 678 28.151 -0.405 -3.452 1.00 0.00 H ATOM 495 N LYS A 679 31.078 0.585 -2.200 1.00 31.07 N ATOM 496 CA LYS A 679 32.103 1.074 -1.283 1.00 33.50 C ATOM 497 C LYS A 679 32.598 -0.044 -0.381 1.00 35.03 C ATOM 498 O LYS A 679 33.804 -0.166 -0.128 1.00 37.23 O ATOM 499 CB LYS A 679 31.548 2.230 -0.449 1.00 33.54 C ATOM 500 CG LYS A 679 32.513 2.767 0.582 1.00 36.82 C ATOM 501 CD LYS A 679 33.693 3.466 -0.061 1.00 40.83 C ATOM 502 CE LYS A 679 34.587 4.096 1.003 1.00 53.67 C ATOM 503 NZ LYS A 679 35.567 5.046 0.410 1.00 59.60 N ATOM 504 HZ1 LYS A 679 36.172 4.540 -0.268 1.00 0.00 H ATOM 505 HZ2 LYS A 679 35.056 5.808 -0.081 1.00 0.00 H ATOM 506 HZ3 LYS A 679 36.155 5.452 1.166 1.00 0.00 H ATOM 507 H LYS A 679 30.118 0.983 -2.158 1.00 0.00 H ATOM 508 N GLN A 680 31.686 -0.889 0.104 1.00 36.56 N ATOM 509 CA GLN A 680 32.095 -2.000 0.954 1.00 37.59 C ATOM 510 C GLN A 680 32.902 -3.024 0.166 1.00 36.05 C ATOM 511 O GLN A 680 33.881 -3.574 0.680 1.00 37.78 O ATOM 512 CB GLN A 680 30.871 -2.647 1.599 1.00 40.08 C ATOM 513 CG GLN A 680 29.952 -1.662 2.315 1.00 42.84 C ATOM 514 CD GLN A 680 30.642 -0.907 3.440 1.00 46.88 C ATOM 515 OE1 GLN A 680 31.330 0.089 3.211 1.00 52.96 O ATOM 516 NE2 GLN A 680 30.447 -1.371 4.664 1.00 46.57 N ATOM 517 HE22 GLN A 680 29.858 -2.216 4.812 1.00 0.00 H ATOM 518 HE21 GLN A 680 30.882 -0.891 5.478 1.00 0.00 H ATOM 519 H GLN A 680 30.681 -0.754 -0.125 1.00 0.00 H ATOM 520 N ASN A 681 32.509 -3.288 -1.084 1.00 34.03 N ATOM 521 CA ASN A 681 33.300 -4.175 -1.932 1.00 34.61 C ATOM 522 C ASN A 681 34.683 -3.593 -2.187 1.00 32.71 C ATOM 523 O ASN A 681 35.689 -4.310 -2.115 1.00 35.67 O ATOM 524 CB ASN A 681 32.576 -4.430 -3.255 1.00 31.37 C ATOM 525 CG ASN A 681 31.319 -5.265 -3.082 1.00 32.60 C ATOM 526 OD1 ASN A 681 31.159 -5.955 -2.081 1.00 36.94 O ATOM 527 ND2 ASN A 681 30.423 -5.206 -4.065 1.00 32.19 N ATOM 528 HD22 ASN A 681 30.601 -4.606 -4.896 1.00 0.00 H ATOM 529 HD21 ASN A 681 29.545 -5.759 -4.002 1.00 0.00 H ATOM 530 H ASN A 681 31.636 -2.860 -1.454 1.00 0.00 H ATOM 531 N LEU A 682 34.751 -2.288 -2.480 1.00 35.07 N ATOM 532 CA LEU A 682 36.034 -1.630 -2.712 1.00 33.22 C ATOM 533 C LEU A 682 36.980 -1.833 -1.533 1.00 37.45 C ATOM 534 O LEU A 682 38.131 -2.250 -1.708 1.00 37.61 O ATOM 535 CB LEU A 682 35.810 -0.136 -2.980 1.00 30.90 C ATOM 536 CG LEU A 682 36.912 0.719 -3.624 1.00 31.53 C ATOM 537 CD1 LEU A 682 36.328 2.022 -4.158 1.00 34.44 C ATOM 538 CD2 LEU A 682 38.016 1.038 -2.650 1.00 36.46 C ATOM 539 H LEU A 682 33.874 -1.733 -2.544 1.00 0.00 H ATOM 540 N GLU A 683 36.513 -1.536 -0.317 1.00 36.81 N ATOM 541 CA GLU A 683 37.392 -1.636 0.845 1.00 38.99 C ATOM 542 C GLU A 683 37.712 -3.078 1.202 1.00 40.19 C ATOM 543 O GLU A 683 38.735 -3.332 1.845 1.00 45.73 O ATOM 544 CB GLU A 683 36.766 -0.926 2.044 1.00 45.35 C ATOM 545 CG GLU A 683 36.413 0.533 1.781 1.00 44.68 C ATOM 546 CD GLU A 683 37.624 1.394 1.450 1.00 46.98 C ATOM 547 OE1 GLU A 683 38.765 0.990 1.765 1.00 49.21 O ATOM 548 OE2 GLU A 683 37.432 2.483 0.870 1.00 46.93 O ATOM 549 H GLU A 683 35.525 -1.234 -0.198 1.00 0.00 H ATOM 550 N ALA A 684 36.870 -4.022 0.795 1.00 40.03 N ATOM 551 CA ALA A 684 37.147 -5.437 0.995 1.00 40.40 C ATOM 552 C ALA A 684 38.100 -6.003 -0.055 1.00 40.84 C ATOM 553 O ALA A 684 38.282 -7.228 -0.105 1.00 42.92 O ATOM 554 CB ALA A 684 35.840 -6.230 0.992 1.00 44.86 C ATOM 555 H ALA A 684 35.988 -3.742 0.320 1.00 0.00 H ATOM 556 N TYR A 685 38.696 -5.139 -0.883 1.00 40.04 N ATOM 557 CA TYR A 685 39.629 -5.532 -1.940 1.00 36.66 C ATOM 558 C TYR A 685 38.979 -6.470 -2.953 1.00 36.54 C ATOM 559 O TYR A 685 39.612 -7.405 -3.456 1.00 40.80 O ATOM 560 CB TYR A 685 40.895 -6.168 -1.355 1.00 38.98 C ATOM 561 CG TYR A 685 41.672 -5.265 -0.422 1.00 47.99 C ATOM 562 CD1 TYR A 685 42.559 -4.317 -0.919 1.00 49.86 C ATOM 563 CD2 TYR A 685 41.531 -5.367 0.956 1.00 57.03 C ATOM 564 CE1 TYR A 685 43.280 -3.490 -0.068 1.00 53.61 C ATOM 565 CE2 TYR A 685 42.247 -4.545 1.814 1.00 60.66 C ATOM 566 CZ TYR A 685 43.119 -3.606 1.294 1.00 59.85 C ATOM 567 OH TYR A 685 43.835 -2.785 2.140 1.00 62.95 O ATOM 568 HH TYR A 685 44.405 -2.178 1.605 1.00 0.00 H ATOM 569 H TYR A 685 38.484 -4.127 -0.769 1.00 0.00 H ATOM 570 N ARG A 686 37.707 -6.236 -3.251 1.00 37.21 N ATOM 571 CA ARG A 686 37.010 -7.036 -4.245 1.00 34.01 C ATOM 572 C ARG A 686 37.083 -6.450 -5.646 1.00 34.31 C ATOM 573 O ARG A 686 36.661 -7.116 -6.598 1.00 36.29 O ATOM 574 CB ARG A 686 35.551 -7.229 -3.837 1.00 36.43 C ATOM 575 CG ARG A 686 35.398 -8.253 -2.743 1.00 44.10 C ATOM 576 CD ARG A 686 34.016 -8.233 -2.159 1.00 53.78 C ATOM 577 NE ARG A 686 33.976 -8.925 -0.879 1.00 58.00 N ATOM 578 CZ ARG A 686 33.231 -8.534 0.148 1.00 66.61 C ATOM 579 NH1 ARG A 686 32.474 -7.447 0.041 1.00 60.18 N ATOM 580 NH2 ARG A 686 33.250 -9.218 1.285 1.00 71.56 N ATOM 581 HE ARG A 686 34.565 -9.774 -0.762 1.00 0.00 H ATOM 582 HH12 ARG A 686 31.890 -7.139 0.844 1.00 0.00 H ATOM 583 HH11 ARG A 686 32.466 -6.904 -0.846 1.00 0.00 H ATOM 584 HH22 ARG A 686 32.665 -8.909 2.088 1.00 0.00 H ATOM 585 HH21 ARG A 686 33.850 -10.063 1.374 1.00 0.00 H ATOM 586 H ARG A 686 37.201 -5.468 -2.766 1.00 0.00 H ATOM 587 N TYR A 687 37.601 -5.227 -5.798 1.00 32.99 N ATOM 588 CA TYR A 687 37.832 -4.594 -7.098 1.00 28.83 C ATOM 589 C TYR A 687 39.335 -4.442 -7.269 1.00 32.28 C ATOM 590 O TYR A 687 39.930 -3.486 -6.761 1.00 32.63 O ATOM 591 CB TYR A 687 37.161 -3.221 -7.208 1.00 27.31 C ATOM 592 CG TYR A 687 35.673 -3.206 -6.999 1.00 28.89 C ATOM 593 CD1 TYR A 687 34.846 -4.128 -7.619 1.00 28.78 C ATOM 594 CD2 TYR A 687 35.095 -2.253 -6.170 1.00 32.42 C ATOM 595 CE1 TYR A 687 33.468 -4.093 -7.421 1.00 28.90 C ATOM 596 CE2 TYR A 687 33.741 -2.216 -5.964 1.00 31.10 C ATOM 597 CZ TYR A 687 32.931 -3.140 -6.582 1.00 29.13 C ATOM 598 OH TYR A 687 31.568 -3.081 -6.358 1.00 31.19 O ATOM 599 HH TYR A 687 31.120 -3.803 -6.865 1.00 0.00 H ATOM 600 H TYR A 687 37.855 -4.694 -4.942 1.00 0.00 H ATOM 601 N LEU A 688 39.949 -5.387 -7.978 1.00 30.50 N ATOM 602 CA LEU A 688 41.373 -5.331 -8.279 1.00 31.54 C ATOM 603 C LEU A 688 41.643 -5.025 -9.746 1.00 35.11 C ATOM 604 O LEU A 688 42.797 -5.061 -10.181 1.00 38.36 O ATOM 605 CB LEU A 688 42.043 -6.641 -7.871 1.00 33.53 C ATOM 606 CG LEU A 688 41.871 -6.999 -6.396 1.00 36.86 C ATOM 607 CD1 LEU A 688 42.545 -8.324 -6.081 1.00 37.23 C ATOM 608 CD2 LEU A 688 42.424 -5.892 -5.504 1.00 38.68 C ATOM 609 H LEU A 688 39.393 -6.193 -8.329 1.00 0.00 H ATOM 610 N ASN A 689 40.602 -4.738 -10.524 1.00 31.37 N ATOM 611 CA ASN A 689 40.781 -4.229 -11.871 1.00 30.48 C ATOM 612 C ASN A 689 39.627 -3.291 -12.161 1.00 28.56 C ATOM 613 O ASN A 689 38.608 -3.295 -11.465 1.00 26.90 O ATOM 614 CB ASN A 689 40.854 -5.339 -12.924 1.00 30.33 C ATOM 615 CG ASN A 689 39.725 -6.317 -12.819 1.00 29.71 C ATOM 616 OD1 ASN A 689 38.583 -5.981 -13.097 1.00 28.86 O ATOM 617 ND2 ASN A 689 40.040 -7.557 -12.430 1.00 32.13 N ATOM 618 HD22 ASN A 689 41.027 -7.796 -12.204 1.00 0.00 H ATOM 619 HD21 ASN A 689 39.298 -8.282 -12.354 1.00 0.00 H ATOM 620 H ASN A 689 39.639 -4.882 -10.158 1.00 0.00 H ATOM 621 N PHE A 690 39.800 -2.473 -13.191 1.00 26.88 N ATOM 622 CA PHE A 690 38.795 -1.452 -13.435 1.00 26.72 C ATOM 623 C PHE A 690 37.476 -2.075 -13.866 1.00 26.08 C ATOM 624 O PHE A 690 36.404 -1.594 -13.483 1.00 26.46 O ATOM 625 CB PHE A 690 39.289 -0.459 -14.483 1.00 29.50 C ATOM 626 CG PHE A 690 38.485 0.804 -14.523 1.00 30.08 C ATOM 627 CD1 PHE A 690 38.778 1.844 -13.661 1.00 31.38 C ATOM 628 CD2 PHE A 690 37.424 0.938 -15.399 1.00 32.78 C ATOM 629 CE1 PHE A 690 38.040 3.019 -13.673 1.00 32.07 C ATOM 630 CE2 PHE A 690 36.678 2.108 -15.420 1.00 31.08 C ATOM 631 CZ PHE A 690 36.986 3.151 -14.548 1.00 30.36 C ATOM 632 H PHE A 690 40.633 -2.560 -13.808 1.00 0.00 H ATOM 633 N ASP A 691 37.532 -3.148 -14.652 1.00 26.36 N ATOM 634 CA ASP A 691 36.295 -3.658 -15.226 1.00 26.57 C ATOM 635 C ASP A 691 35.384 -4.276 -14.167 1.00 27.45 C ATOM 636 O ASP A 691 34.162 -4.179 -14.290 1.00 26.36 O ATOM 637 CB ASP A 691 36.606 -4.614 -16.368 1.00 33.89 C ATOM 638 CG ASP A 691 36.898 -3.872 -17.666 1.00 32.59 C ATOM 639 OD1 ASP A 691 35.943 -3.372 -18.293 1.00 40.28 O ATOM 640 OD2 ASP A 691 38.076 -3.766 -18.048 1.00 37.44 O ATOM 641 H ASP A 691 38.441 -3.612 -14.852 1.00 0.00 H ATOM 642 N ASP A 692 35.939 -4.854 -13.094 1.00 28.65 N ATOM 643 CA ASP A 692 35.061 -5.386 -12.050 1.00 29.24 C ATOM 644 C ASP A 692 34.325 -4.268 -11.311 1.00 28.78 C ATOM 645 O ASP A 692 33.167 -4.435 -10.912 1.00 28.70 O ATOM 646 CB ASP A 692 35.858 -6.239 -11.070 1.00 29.12 C ATOM 647 CG ASP A 692 36.226 -7.611 -11.639 1.00 30.65 C ATOM 648 OD1 ASP A 692 35.711 -8.021 -12.707 1.00 30.92 O ATOM 649 OD2 ASP A 692 37.013 -8.298 -10.980 1.00 31.96 O ATOM 650 H ASP A 692 36.973 -4.924 -13.004 1.00 0.00 H ATOM 651 N PHE A 693 34.984 -3.122 -11.122 1.00 25.22 N ATOM 652 CA PHE A 693 34.332 -1.948 -10.546 1.00 24.15 C ATOM 653 C PHE A 693 33.229 -1.447 -11.469 1.00 24.06 C ATOM 654 O PHE A 693 32.089 -1.217 -11.042 1.00 25.80 O ATOM 655 CB PHE A 693 35.394 -0.871 -10.317 1.00 25.91 C ATOM 656 CG PHE A 693 34.867 0.446 -9.797 1.00 23.01 C ATOM 657 CD1 PHE A 693 34.686 0.655 -8.440 1.00 26.44 C ATOM 658 CD2 PHE A 693 34.632 1.505 -10.670 1.00 24.38 C ATOM 659 CE1 PHE A 693 34.235 1.887 -7.961 1.00 26.34 C ATOM 660 CE2 PHE A 693 34.168 2.745 -10.200 1.00 25.94 C ATOM 661 CZ PHE A 693 33.973 2.935 -8.846 1.00 27.65 C ATOM 662 H PHE A 693 35.987 -3.064 -11.392 1.00 0.00 H ATOM 663 N GLU A 694 33.558 -1.299 -12.753 1.00 23.68 N ATOM 664 CA GLU A 694 32.595 -0.790 -13.725 1.00 26.42 C ATOM 665 C GLU A 694 31.394 -1.724 -13.864 1.00 24.87 C ATOM 666 O GLU A 694 30.254 -1.257 -14.021 1.00 27.25 O ATOM 667 CB GLU A 694 33.296 -0.573 -15.062 1.00 25.49 C ATOM 668 CG GLU A 694 32.426 0.026 -16.157 1.00 32.51 C ATOM 669 CD GLU A 694 33.241 0.356 -17.392 1.00 47.20 C ATOM 670 OE1 GLU A 694 33.373 -0.515 -18.274 1.00 58.36 O ATOM 671 OE2 GLU A 694 33.780 1.477 -17.470 1.00 45.84 O ATOM 672 H GLU A 694 34.517 -1.551 -13.067 1.00 0.00 H ATOM 673 N GLU A 695 31.619 -3.042 -13.771 1.00 23.77 N ATOM 674 CA GLU A 695 30.522 -4.002 -13.867 1.00 26.27 C ATOM 675 C GLU A 695 29.482 -3.775 -12.775 1.00 27.50 C ATOM 676 O GLU A 695 28.277 -3.871 -13.038 1.00 27.13 O ATOM 677 CB GLU A 695 31.055 -5.433 -13.813 1.00 36.61 C ATOM 678 CG GLU A 695 31.561 -5.931 -15.146 1.00 45.28 C ATOM 679 CD GLU A 695 32.053 -7.372 -15.093 1.00 50.86 C ATOM 680 OE1 GLU A 695 32.667 -7.805 -16.089 1.00 56.34 O ATOM 681 OE2 GLU A 695 31.828 -8.060 -14.067 1.00 39.67 O ATOM 682 H GLU A 695 32.590 -3.387 -13.628 1.00 0.00 H ATOM 683 N ASP A 696 29.916 -3.468 -11.545 1.00 24.54 N ATOM 684 CA ASP A 696 28.929 -3.250 -10.489 1.00 27.85 C ATOM 685 C ASP A 696 28.188 -1.938 -10.691 1.00 28.83 C ATOM 686 O ASP A 696 26.986 -1.851 -10.404 1.00 26.60 O ATOM 687 CB ASP A 696 29.579 -3.304 -9.104 1.00 26.99 C ATOM 688 CG ASP A 696 29.630 -4.717 -8.553 1.00 32.52 C ATOM 689 OD1 ASP A 696 28.979 -5.596 -9.155 1.00 35.38 O ATOM 690 OD2 ASP A 696 30.323 -4.959 -7.539 1.00 34.31 O ATOM 691 H ASP A 696 30.934 -3.387 -11.346 1.00 0.00 H ATOM 692 N PHE A 697 28.862 -0.916 -11.212 1.00 24.22 N ATOM 693 CA PHE A 697 28.134 0.298 -11.571 1.00 23.92 C ATOM 694 C PHE A 697 27.071 -0.002 -12.621 1.00 25.75 C ATOM 695 O PHE A 697 25.925 0.448 -12.510 1.00 24.62 O ATOM 696 CB PHE A 697 29.075 1.378 -12.093 1.00 22.69 C ATOM 697 CG PHE A 697 28.335 2.516 -12.729 1.00 23.34 C ATOM 698 CD1 PHE A 697 27.672 3.441 -11.938 1.00 27.91 C ATOM 699 CD2 PHE A 697 28.247 2.618 -14.115 1.00 22.17 C ATOM 700 CE1 PHE A 697 26.959 4.483 -12.521 1.00 27.81 C ATOM 701 CE2 PHE A 697 27.530 3.645 -14.704 1.00 24.01 C ATOM 702 CZ PHE A 697 26.895 4.583 -13.898 1.00 25.32 C ATOM 703 H PHE A 697 29.889 -0.981 -11.361 1.00 0.00 H ATOM 704 N ASN A 698 27.441 -0.761 -13.658 1.00 23.73 N ATOM 705 CA ASN A 698 26.477 -1.115 -14.699 1.00 21.32 C ATOM 706 C ASN A 698 25.297 -1.896 -14.130 1.00 26.08 C ATOM 707 O ASN A 698 24.174 -1.776 -14.638 1.00 25.88 O ATOM 708 CB ASN A 698 27.164 -1.935 -15.796 1.00 24.73 C ATOM 709 CG ASN A 698 28.137 -1.109 -16.625 1.00 23.90 C ATOM 710 OD1 ASN A 698 28.059 0.113 -16.656 1.00 28.01 O ATOM 711 ND2 ASN A 698 29.055 -1.798 -17.321 1.00 29.96 N ATOM 712 HD22 ASN A 698 29.081 -2.836 -17.262 1.00 0.00 H ATOM 713 HD21 ASN A 698 29.740 -1.294 -17.919 1.00 0.00 H ATOM 714 H ASN A 698 28.421 -1.102 -13.725 1.00 0.00 H ATOM 715 N LEU A 699 25.531 -2.671 -13.067 1.00 25.12 N ATOM 716 CA LEU A 699 24.454 -3.400 -12.402 1.00 27.85 C ATOM 717 C LEU A 699 23.455 -2.443 -11.765 1.00 26.45 C ATOM 718 O LEU A 699 22.243 -2.672 -11.838 1.00 29.21 O ATOM 719 CB LEU A 699 25.019 -4.336 -11.333 1.00 31.15 C ATOM 720 CG LEU A 699 24.884 -5.842 -11.474 1.00 40.74 C ATOM 721 CD1 LEU A 699 25.432 -6.479 -10.204 1.00 34.23 C ATOM 722 CD2 LEU A 699 23.440 -6.251 -11.711 1.00 34.99 C ATOM 723 H LEU A 699 26.502 -2.757 -12.705 1.00 0.00 H ATOM 724 N ILE A 700 23.945 -1.386 -11.107 1.00 26.58 N ATOM 725 CA ILE A 700 23.041 -0.380 -10.550 1.00 24.63 C ATOM 726 C ILE A 700 22.122 0.130 -11.643 1.00 26.62 C ATOM 727 O ILE A 700 20.894 0.205 -11.478 1.00 28.07 O ATOM 728 CB ILE A 700 23.837 0.778 -9.920 1.00 23.28 C ATOM 729 CG1 ILE A 700 24.654 0.289 -8.716 1.00 27.12 C ATOM 730 CG2 ILE A 700 22.893 1.945 -9.532 1.00 23.52 C ATOM 731 CD1 ILE A 700 25.532 1.388 -8.102 1.00 30.21 C ATOM 732 H ILE A 700 24.973 -1.279 -10.991 1.00 0.00 H ATOM 733 N VAL A 701 22.714 0.474 -12.784 1.00 24.98 N ATOM 734 CA VAL A 701 21.953 0.993 -13.914 1.00 27.67 C ATOM 735 C VAL A 701 20.986 -0.060 -14.452 1.00 27.18 C ATOM 736 O VAL A 701 19.782 0.189 -14.591 1.00 23.74 O ATOM 737 CB VAL A 701 22.914 1.482 -15.012 1.00 23.14 C ATOM 738 CG1 VAL A 701 22.141 1.785 -16.288 1.00 24.36 C ATOM 739 CG2 VAL A 701 23.675 2.715 -14.550 1.00 23.09 C ATOM 740 H VAL A 701 23.745 0.370 -12.872 1.00 0.00 H ATOM 741 N SER A 702 21.489 -1.261 -14.755 1.00 24.12 N ATOM 742 CA SER A 702 20.636 -2.246 -15.412 1.00 25.33 C ATOM 743 C SER A 702 19.539 -2.752 -14.489 1.00 28.62 C ATOM 744 O SER A 702 18.427 -3.035 -14.956 1.00 27.31 O ATOM 745 CB SER A 702 21.469 -3.416 -15.950 1.00 27.24 C ATOM 746 OG SER A 702 22.087 -4.177 -14.924 1.00 26.83 O ATOM 747 HG SER A 702 21.391 -4.552 -14.328 1.00 0.00 H ATOM 748 H SER A 702 22.477 -1.491 -14.525 1.00 0.00 H ATOM 749 N ASN A 703 19.823 -2.878 -13.187 1.00 25.63 N ATOM 750 CA ASN A 703 18.779 -3.271 -12.245 1.00 28.31 C ATOM 751 C ASN A 703 17.623 -2.284 -12.281 1.00 26.87 C ATOM 752 O ASN A 703 16.453 -2.681 -12.252 1.00 28.01 O ATOM 753 CB ASN A 703 19.326 -3.353 -10.823 1.00 27.51 C ATOM 754 CG ASN A 703 20.144 -4.609 -10.578 1.00 27.04 C ATOM 755 OD1 ASN A 703 20.079 -5.575 -11.343 1.00 30.33 O ATOM 756 ND2 ASN A 703 20.896 -4.609 -9.483 1.00 32.85 N ATOM 757 HD22 ASN A 703 20.919 -3.771 -8.868 1.00 0.00 H ATOM 758 HD21 ASN A 703 21.462 -5.447 -9.241 1.00 0.00 H ATOM 759 H ASN A 703 20.788 -2.696 -12.846 1.00 0.00 H ATOM 760 N CYS A 704 17.945 -0.992 -12.362 1.00 24.80 N ATOM 761 CA CYS A 704 16.922 0.046 -12.322 1.00 24.59 C ATOM 762 C CYS A 704 16.093 0.059 -13.601 1.00 27.47 C ATOM 763 O CYS A 704 14.870 0.216 -13.554 1.00 28.29 O ATOM 764 CB CYS A 704 17.599 1.395 -12.095 1.00 23.71 C ATOM 765 SG CYS A 704 16.429 2.757 -11.824 1.00 27.47 S ATOM 766 H CYS A 704 18.944 -0.720 -12.455 1.00 0.00 H ATOM 767 N LEU A 705 16.744 -0.093 -14.756 1.00 25.36 N ATOM 768 CA LEU A 705 16.017 -0.185 -16.018 1.00 25.77 C ATOM 769 C LEU A 705 15.125 -1.419 -16.042 1.00 25.77 C ATOM 770 O LEU A 705 14.013 -1.393 -16.588 1.00 27.89 O ATOM 771 CB LEU A 705 17.012 -0.232 -17.176 1.00 24.59 C ATOM 772 CG LEU A 705 17.935 0.975 -17.354 1.00 23.53 C ATOM 773 CD1 LEU A 705 18.960 0.602 -18.413 1.00 25.90 C ATOM 774 CD2 LEU A 705 17.142 2.200 -17.777 1.00 25.23 C ATOM 775 H LEU A 705 17.783 -0.147 -14.757 1.00 0.00 H ATOM 776 N LYS A 706 15.594 -2.510 -15.448 1.00 27.06 N ATOM 777 CA LYS A 706 14.824 -3.747 -15.467 1.00 27.59 C ATOM 778 C LYS A 706 13.606 -3.653 -14.562 1.00 32.16 C ATOM 779 O LYS A 706 12.495 -4.031 -14.964 1.00 32.15 O ATOM 780 CB LYS A 706 15.714 -4.922 -15.055 1.00 28.03 C ATOM 781 CG LYS A 706 14.996 -6.249 -15.084 1.00 31.22 C ATOM 782 CD LYS A 706 15.944 -7.384 -14.799 1.00 37.43 C ATOM 783 CE LYS A 706 15.174 -8.688 -14.685 1.00 46.31 C ATOM 784 NZ LYS A 706 16.059 -9.839 -14.341 1.00 53.59 N ATOM 785 HZ1 LYS A 706 16.780 -9.953 -15.081 1.00 0.00 H ATOM 786 HZ2 LYS A 706 16.523 -9.657 -13.428 1.00 0.00 H ATOM 787 HZ3 LYS A 706 15.488 -10.706 -14.274 1.00 0.00 H ATOM 788 H LYS A 706 16.516 -2.482 -14.967 1.00 0.00 H ATOM 789 N TYR A 707 13.779 -3.121 -13.349 1.00 29.68 N ATOM 790 CA TYR A 707 12.684 -3.187 -12.390 1.00 33.30 C ATOM 791 C TYR A 707 11.601 -2.152 -12.670 1.00 31.41 C ATOM 792 O TYR A 707 10.414 -2.440 -12.485 1.00 37.93 O ATOM 793 CB TYR A 707 13.191 -3.017 -10.960 1.00 34.91 C ATOM 794 CG TYR A 707 12.056 -3.188 -9.980 1.00 39.09 C ATOM 795 CD1 TYR A 707 11.545 -4.453 -9.706 1.00 43.48 C ATOM 796 CD2 TYR A 707 11.469 -2.096 -9.368 1.00 43.85 C ATOM 797 CE1 TYR A 707 10.491 -4.629 -8.831 1.00 48.53 C ATOM 798 CE2 TYR A 707 10.404 -2.259 -8.494 1.00 46.99 C ATOM 799 CZ TYR A 707 9.926 -3.531 -8.229 1.00 46.04 C ATOM 800 OH TYR A 707 8.870 -3.702 -7.363 1.00 51.17 O ATOM 801 HH TYR A 707 8.659 -4.666 -7.289 1.00 0.00 H ATOM 802 H TYR A 707 14.679 -2.668 -13.094 1.00 0.00 H ATOM 803 N ASN A 708 11.973 -0.946 -13.084 1.00 29.82 N ATOM 804 CA ASN A 708 11.024 0.160 -13.171 1.00 30.39 C ATOM 805 C ASN A 708 10.482 0.313 -14.587 1.00 30.15 C ATOM 806 O ASN A 708 11.203 0.103 -15.564 1.00 28.88 O ATOM 807 CB ASN A 708 11.684 1.462 -12.720 1.00 31.73 C ATOM 808 CG ASN A 708 12.147 1.404 -11.279 1.00 32.42 C ATOM 809 OD1 ASN A 708 11.340 1.507 -10.356 1.00 34.08 O ATOM 810 ND2 ASN A 708 13.444 1.227 -11.079 1.00 28.93 N ATOM 811 HD22 ASN A 708 14.089 1.145 -11.891 1.00 0.00 H ATOM 812 HD21 ASN A 708 13.818 1.170 -10.110 1.00 0.00 H ATOM 813 H ASN A 708 12.965 -0.786 -13.353 1.00 0.00 H ATOM 814 N ALA A 709 9.211 0.707 -14.696 1.00 31.66 N ATOM 815 CA ALA A 709 8.620 0.909 -16.009 1.00 31.79 C ATOM 816 C ALA A 709 9.265 2.103 -16.709 1.00 30.28 C ATOM 817 O ALA A 709 9.837 2.997 -16.074 1.00 29.55 O ATOM 818 CB ALA A 709 7.107 1.113 -15.902 1.00 34.00 C ATOM 819 H ALA A 709 8.643 0.870 -13.840 1.00 0.00 H ATOM 820 N LYS A 710 9.146 2.118 -18.041 1.00 30.19 N ATOM 821 CA LYS A 710 9.865 3.105 -18.840 1.00 30.98 C ATOM 822 C LYS A 710 9.367 4.511 -18.579 1.00 33.73 C ATOM 823 O LYS A 710 10.111 5.473 -18.794 1.00 35.45 O ATOM 824 CB LYS A 710 9.746 2.795 -20.332 1.00 30.89 C ATOM 825 CG LYS A 710 10.632 1.665 -20.811 1.00 31.27 C ATOM 826 CD LYS A 710 10.550 1.466 -22.325 1.00 38.40 C ATOM 827 CE LYS A 710 11.477 2.434 -23.060 1.00 35.77 C ATOM 828 NZ LYS A 710 11.397 2.246 -24.525 1.00 31.73 N ATOM 829 HZ1 LYS A 710 11.676 1.273 -24.764 1.00 0.00 H ATOM 830 HZ2 LYS A 710 10.421 2.416 -24.842 1.00 0.00 H ATOM 831 HZ3 LYS A 710 12.037 2.917 -24.995 1.00 0.00 H ATOM 832 H LYS A 710 8.535 1.420 -18.512 1.00 0.00 H ATOM 833 N ASP A 711 8.121 4.655 -18.145 1.00 31.32 N ATOM 834 CA ASP A 711 7.525 5.972 -17.970 1.00 32.35 C ATOM 835 C ASP A 711 7.768 6.542 -16.581 1.00 35.71 C ATOM 836 O ASP A 711 7.174 7.562 -16.234 1.00 35.40 O ATOM 837 CB ASP A 711 6.026 5.921 -18.286 1.00 34.49 C ATOM 838 CG ASP A 711 5.216 5.134 -17.265 1.00 38.83 C ATOM 839 OD1 ASP A 711 5.795 4.496 -16.357 1.00 38.40 O ATOM 840 OD2 ASP A 711 3.973 5.145 -17.390 1.00 43.23 O ATOM 841 H ASP A 711 7.558 3.809 -17.925 1.00 0.00 H ATOM 842 N THR A 712 8.634 5.919 -15.788 1.00 33.97 N ATOM 843 CA THR A 712 8.867 6.381 -14.428 1.00 34.27 C ATOM 844 C THR A 712 10.055 7.325 -14.367 1.00 32.92 C ATOM 845 O THR A 712 10.962 7.285 -15.200 1.00 30.33 O ATOM 846 CB THR A 712 9.126 5.210 -13.484 1.00 34.82 C ATOM 847 OG1 THR A 712 10.282 4.487 -13.932 1.00 30.84 O ATOM 848 CG2 THR A 712 7.911 4.285 -13.439 1.00 35.74 C ATOM 849 HG1 THR A 712 10.122 4.146 -14.848 1.00 0.00 H ATOM 850 H THR A 712 9.152 5.090 -16.144 1.00 0.00 H ATOM 851 N ILE A 713 10.050 8.169 -13.334 1.00 32.25 N ATOM 852 CA ILE A 713 11.240 8.962 -13.033 1.00 31.00 C ATOM 853 C ILE A 713 12.461 8.063 -12.824 1.00 35.18 C ATOM 854 O ILE A 713 13.552 8.354 -13.330 1.00 30.14 O ATOM 855 CB ILE A 713 10.969 9.865 -11.814 1.00 32.82 C ATOM 856 CG1 ILE A 713 9.874 10.888 -12.135 1.00 34.77 C ATOM 857 CG2 ILE A 713 12.238 10.570 -11.378 1.00 39.07 C ATOM 858 CD1 ILE A 713 9.254 11.507 -10.902 1.00 48.07 C ATOM 859 H ILE A 713 9.199 8.263 -12.743 1.00 0.00 H ATOM 860 N PHE A 714 12.296 6.949 -12.094 1.00 31.11 N ATOM 861 CA PHE A 714 13.424 6.067 -11.789 1.00 28.66 C ATOM 862 C PHE A 714 14.093 5.557 -13.057 1.00 28.16 C ATOM 863 O PHE A 714 15.328 5.507 -13.150 1.00 27.06 O ATOM 864 CB PHE A 714 12.957 4.878 -10.953 1.00 34.29 C ATOM 865 CG PHE A 714 12.692 5.207 -9.519 1.00 39.16 C ATOM 866 CD1 PHE A 714 13.317 6.279 -8.912 1.00 43.73 C ATOM 867 CD2 PHE A 714 11.827 4.428 -8.772 1.00 42.54 C ATOM 868 CE1 PHE A 714 13.079 6.574 -7.583 1.00 48.82 C ATOM 869 CE2 PHE A 714 11.581 4.722 -7.444 1.00 51.05 C ATOM 870 CZ PHE A 714 12.209 5.793 -6.850 1.00 49.49 C ATOM 871 H PHE A 714 11.349 6.708 -11.738 1.00 0.00 H ATOM 872 N TYR A 715 13.291 5.129 -14.031 1.00 28.61 N ATOM 873 CA TYR A 715 13.862 4.611 -15.267 1.00 28.56 C ATOM 874 C TYR A 715 14.693 5.680 -15.967 1.00 28.54 C ATOM 875 O TYR A 715 15.841 5.427 -16.370 1.00 25.32 O ATOM 876 CB TYR A 715 12.748 4.084 -16.175 1.00 29.49 C ATOM 877 CG TYR A 715 13.246 3.363 -17.404 1.00 26.87 C ATOM 878 CD1 TYR A 715 13.594 4.071 -18.550 1.00 25.55 C ATOM 879 CD2 TYR A 715 13.354 1.971 -17.429 1.00 26.36 C ATOM 880 CE1 TYR A 715 14.062 3.425 -19.680 1.00 26.82 C ATOM 881 CE2 TYR A 715 13.817 1.310 -18.566 1.00 25.16 C ATOM 882 CZ TYR A 715 14.164 2.046 -19.690 1.00 26.79 C ATOM 883 OH TYR A 715 14.626 1.426 -20.830 1.00 26.22 O ATOM 884 HH TYR A 715 14.820 2.109 -21.520 1.00 0.00 H ATOM 885 H TYR A 715 12.259 5.165 -13.909 1.00 0.00 H ATOM 886 N ARG A 716 14.143 6.899 -16.077 1.00 26.75 N ATOM 887 CA ARG A 716 14.872 7.993 -16.713 1.00 26.25 C ATOM 888 C ARG A 716 16.119 8.353 -15.916 1.00 26.21 C ATOM 889 O ARG A 716 17.143 8.723 -16.504 1.00 26.81 O ATOM 890 CB ARG A 716 13.964 9.214 -16.875 1.00 29.15 C ATOM 891 CG ARG A 716 14.578 10.312 -17.733 1.00 37.09 C ATOM 892 CD ARG A 716 14.677 9.877 -19.192 1.00 46.59 C ATOM 893 NE ARG A 716 15.647 10.676 -19.932 1.00 55.77 N ATOM 894 CZ ARG A 716 15.804 10.626 -21.249 1.00 67.66 C ATOM 895 NH1 ARG A 716 15.051 9.817 -21.980 1.00 74.63 N ATOM 896 NH2 ARG A 716 16.715 11.390 -21.836 1.00 72.07 N ATOM 897 HE ARG A 716 16.254 11.326 -19.394 1.00 0.00 H ATOM 898 HH12 ARG A 716 15.177 9.780 -23.012 1.00 0.00 H ATOM 899 HH11 ARG A 716 14.334 9.219 -21.522 1.00 0.00 H ATOM 900 HH22 ARG A 716 16.839 11.352 -22.868 1.00 0.00 H ATOM 901 HH21 ARG A 716 17.305 12.027 -21.265 1.00 0.00 H ATOM 902 H ARG A 716 13.186 7.067 -15.705 1.00 0.00 H ATOM 903 N ALA A 717 16.048 8.243 -14.584 1.00 27.11 N ATOM 904 CA ALA A 717 17.215 8.493 -13.744 1.00 28.31 C ATOM 905 C ALA A 717 18.341 7.524 -14.064 1.00 25.83 C ATOM 906 O ALA A 717 19.512 7.910 -14.077 1.00 27.35 O ATOM 907 CB ALA A 717 16.834 8.387 -12.270 1.00 31.77 C ATOM 908 H ALA A 717 15.146 7.975 -14.140 1.00 0.00 H ATOM 909 N ALA A 718 18.001 6.260 -14.318 1.00 22.65 N ATOM 910 CA ALA A 718 19.023 5.277 -14.668 1.00 21.39 C ATOM 911 C ALA A 718 19.621 5.574 -16.034 1.00 23.80 C ATOM 912 O ALA A 718 20.827 5.399 -16.242 1.00 24.32 O ATOM 913 CB ALA A 718 18.427 3.874 -14.639 1.00 24.01 C ATOM 914 H ALA A 718 17.003 5.973 -14.267 1.00 0.00 H ATOM 915 N VAL A 719 18.792 6.015 -16.985 1.00 24.40 N ATOM 916 CA VAL A 719 19.307 6.436 -18.284 1.00 24.34 C ATOM 917 C VAL A 719 20.295 7.583 -18.112 1.00 23.92 C ATOM 918 O VAL A 719 21.388 7.573 -18.692 1.00 25.08 O ATOM 919 CB VAL A 719 18.155 6.836 -19.224 1.00 25.66 C ATOM 920 CG1 VAL A 719 18.714 7.502 -20.458 1.00 27.32 C ATOM 921 CG2 VAL A 719 17.307 5.603 -19.597 1.00 24.89 C ATOM 922 H VAL A 719 17.770 6.059 -16.798 1.00 0.00 H ATOM 923 N ARG A 720 19.941 8.570 -17.286 1.00 23.13 N ATOM 924 CA ARG A 720 20.829 9.716 -17.081 1.00 22.90 C ATOM 925 C ARG A 720 22.110 9.285 -16.378 1.00 25.18 C ATOM 926 O ARG A 720 23.209 9.704 -16.766 1.00 24.67 O ATOM 927 CB ARG A 720 20.104 10.820 -16.298 1.00 28.93 C ATOM 928 CG ARG A 720 20.933 12.078 -16.054 1.00 32.82 C ATOM 929 CD ARG A 720 20.017 13.209 -15.608 1.00 43.70 C ATOM 930 NE ARG A 720 20.718 14.333 -14.995 1.00 58.59 N ATOM 931 CZ ARG A 720 21.396 15.251 -15.673 1.00 62.71 C ATOM 932 NH1 ARG A 720 21.481 15.172 -16.996 1.00 66.50 N ATOM 933 NH2 ARG A 720 21.996 16.243 -15.027 1.00 58.08 N ATOM 934 HE ARG A 720 20.684 14.420 -13.959 1.00 0.00 H ATOM 935 HH12 ARG A 720 22.012 15.891 -17.527 1.00 0.00 H ATOM 936 HH11 ARG A 720 21.016 14.391 -17.501 1.00 0.00 H ATOM 937 HH22 ARG A 720 22.527 16.963 -15.557 1.00 0.00 H ATOM 938 HH21 ARG A 720 21.935 16.301 -13.990 1.00 0.00 H ATOM 939 H ARG A 720 19.030 8.525 -16.786 1.00 0.00 H ATOM 940 N LEU A 721 21.994 8.416 -15.370 1.00 25.64 N ATOM 941 CA LEU A 721 23.180 7.914 -14.680 1.00 23.88 C ATOM 942 C LEU A 721 24.080 7.131 -15.625 1.00 24.02 C ATOM 943 O LEU A 721 25.309 7.232 -15.547 1.00 24.45 O ATOM 944 CB LEU A 721 22.773 7.035 -13.497 1.00 25.09 C ATOM 945 CG LEU A 721 23.950 6.509 -12.675 1.00 24.33 C ATOM 946 CD1 LEU A 721 24.607 7.639 -11.941 1.00 28.30 C ATOM 947 CD2 LEU A 721 23.483 5.430 -11.704 1.00 31.97 C ATOM 948 H LEU A 721 21.051 8.094 -15.074 1.00 0.00 H ATOM 949 N ARG A 722 23.488 6.335 -16.521 1.00 20.25 N ATOM 950 CA ARG A 722 24.286 5.604 -17.504 1.00 20.96 C ATOM 951 C ARG A 722 25.092 6.568 -18.364 1.00 23.93 C ATOM 952 O ARG A 722 26.286 6.351 -18.603 1.00 26.26 O ATOM 953 CB ARG A 722 23.372 4.747 -18.378 1.00 24.56 C ATOM 954 CG ARG A 722 24.105 3.951 -19.446 1.00 27.35 C ATOM 955 CD ARG A 722 23.112 3.117 -20.254 1.00 26.22 C ATOM 956 NE ARG A 722 22.302 3.981 -21.106 1.00 24.28 N ATOM 957 CZ ARG A 722 21.101 3.666 -21.577 1.00 26.13 C ATOM 958 NH1 ARG A 722 20.553 2.483 -21.288 1.00 26.58 N ATOM 959 NH2 ARG A 722 20.446 4.535 -22.338 1.00 28.92 N ATOM 960 HE ARG A 722 22.693 4.910 -21.363 1.00 0.00 H ATOM 961 HH12 ARG A 722 19.612 2.241 -21.659 1.00 0.00 H ATOM 962 HH11 ARG A 722 21.067 1.804 -20.692 1.00 0.00 H ATOM 963 HH22 ARG A 722 19.505 4.295 -22.710 1.00 0.00 H ATOM 964 HH21 ARG A 722 20.874 5.456 -22.562 1.00 0.00 H ATOM 965 H ARG A 722 22.453 6.235 -16.519 1.00 0.00 H ATOM 966 N GLU A 723 24.461 7.658 -18.802 1.00 24.02 N ATOM 967 CA GLU A 723 25.149 8.639 -19.626 1.00 26.69 C ATOM 968 C GLU A 723 26.230 9.352 -18.829 1.00 28.74 C ATOM 969 O GLU A 723 27.405 9.357 -19.224 1.00 26.79 O ATOM 970 CB GLU A 723 24.148 9.653 -20.182 1.00 28.47 C ATOM 971 CG GLU A 723 23.078 9.032 -21.081 1.00 39.39 C ATOM 972 CD GLU A 723 22.005 10.025 -21.529 1.00 51.67 C ATOM 973 OE1 GLU A 723 21.956 11.153 -20.988 1.00 49.10 O ATOM 974 OE2 GLU A 723 21.205 9.672 -22.421 1.00 57.40 O ATOM 975 H GLU A 723 23.463 7.809 -18.551 1.00 0.00 H ATOM 976 N GLN A 724 25.852 9.956 -17.697 1.00 26.02 N ATOM 977 CA GLN A 724 26.816 10.765 -16.953 1.00 27.16 C ATOM 978 C GLN A 724 27.886 9.898 -16.309 1.00 26.79 C ATOM 979 O GLN A 724 29.059 10.285 -16.254 1.00 29.24 O ATOM 980 CB GLN A 724 26.104 11.597 -15.892 1.00 29.23 C ATOM 981 CG GLN A 724 25.120 12.586 -16.452 1.00 29.14 C ATOM 982 CD GLN A 724 24.767 13.643 -15.434 1.00 37.63 C ATOM 983 OE1 GLN A 724 25.119 14.813 -15.584 1.00 56.89 O ATOM 984 NE2 GLN A 724 24.089 13.234 -14.377 1.00 34.51 N ATOM 985 HE22 GLN A 724 23.812 12.235 -14.291 1.00 0.00 H ATOM 986 HE21 GLN A 724 23.832 13.911 -13.630 1.00 0.00 H ATOM 987 H GLN A 724 24.878 9.851 -17.348 1.00 0.00 H ATOM 988 N GLY A 725 27.505 8.724 -15.804 1.00 24.70 N ATOM 989 CA GLY A 725 28.491 7.839 -15.200 1.00 28.41 C ATOM 990 C GLY A 725 29.434 7.248 -16.226 1.00 26.55 C ATOM 991 O GLY A 725 30.628 7.064 -15.956 1.00 27.18 O ATOM 992 H GLY A 725 26.505 8.441 -15.842 1.00 0.00 H ATOM 993 N GLY A 726 28.915 6.961 -17.420 1.00 28.18 N ATOM 994 CA GLY A 726 29.764 6.502 -18.507 1.00 32.32 C ATOM 995 C GLY A 726 30.913 7.449 -18.798 1.00 28.60 C ATOM 996 O GLY A 726 32.051 7.016 -18.995 1.00 27.99 O ATOM 997 H GLY A 726 27.892 7.067 -17.575 1.00 0.00 H ATOM 998 N ALA A 727 30.636 8.752 -18.809 1.00 29.81 N ATOM 999 CA ALA A 727 31.699 9.724 -19.030 1.00 25.52 C ATOM 1000 C ALA A 727 32.690 9.724 -17.872 1.00 25.82 C ATOM 1001 O ALA A 727 33.903 9.843 -18.085 1.00 28.72 O ATOM 1002 CB ALA A 727 31.109 11.123 -19.214 1.00 29.59 C ATOM 1003 H ALA A 727 29.659 9.076 -18.660 1.00 0.00 H ATOM 1004 N VAL A 728 32.182 9.630 -16.637 1.00 25.55 N ATOM 1005 CA VAL A 728 33.047 9.576 -15.462 1.00 24.50 C ATOM 1006 C VAL A 728 33.967 8.375 -15.557 1.00 25.12 C ATOM 1007 O VAL A 728 35.168 8.463 -15.273 1.00 26.11 O ATOM 1008 CB VAL A 728 32.204 9.518 -14.175 1.00 27.15 C ATOM 1009 CG1 VAL A 728 33.074 9.091 -12.981 1.00 28.66 C ATOM 1010 CG2 VAL A 728 31.549 10.880 -13.916 1.00 28.12 C ATOM 1011 H VAL A 728 31.150 9.595 -16.512 1.00 0.00 H ATOM 1012 N LEU A 729 33.414 7.235 -15.962 1.00 22.77 N ATOM 1013 CA LEU A 729 34.207 6.016 -16.006 1.00 23.10 C ATOM 1014 C LEU A 729 35.244 6.068 -17.113 1.00 23.85 C ATOM 1015 O LEU A 729 36.362 5.588 -16.922 1.00 26.43 O ATOM 1016 CB LEU A 729 33.303 4.801 -16.170 1.00 22.14 C ATOM 1017 CG LEU A 729 32.491 4.518 -14.908 1.00 27.00 C ATOM 1018 CD1 LEU A 729 31.337 3.586 -15.217 1.00 34.94 C ATOM 1019 CD2 LEU A 729 33.401 3.922 -13.839 1.00 31.02 C ATOM 1020 H LEU A 729 32.414 7.215 -16.247 1.00 0.00 H ATOM 1021 N ARG A 730 34.899 6.633 -18.278 1.00 24.06 N ATOM 1022 CA ARG A 730 35.886 6.716 -19.353 1.00 25.71 C ATOM 1023 C ARG A 730 37.092 7.523 -18.920 1.00 26.98 C ATOM 1024 O ARG A 730 38.237 7.119 -19.157 1.00 28.29 O ATOM 1025 CB ARG A 730 35.286 7.319 -20.625 1.00 26.65 C ATOM 1026 CG ARG A 730 36.321 7.431 -21.747 1.00 28.89 C ATOM 1027 CD ARG A 730 35.717 7.793 -23.101 1.00 30.58 C ATOM 1028 NE ARG A 730 36.759 7.856 -24.125 1.00 32.76 N ATOM 1029 CZ ARG A 730 36.528 7.947 -25.431 1.00 35.30 C ATOM 1030 NH1 ARG A 730 35.278 7.981 -25.884 1.00 39.90 N ATOM 1031 NH2 ARG A 730 37.550 7.997 -26.282 1.00 37.33 N ATOM 1032 HE ARG A 730 37.750 7.828 -23.810 1.00 0.00 H ATOM 1033 HH12 ARG A 730 35.097 8.052 -26.906 1.00 0.00 H ATOM 1034 HH11 ARG A 730 34.482 7.936 -25.217 1.00 0.00 H ATOM 1035 HH22 ARG A 730 37.372 8.068 -27.304 1.00 0.00 H ATOM 1036 HH21 ARG A 730 38.526 7.965 -25.925 1.00 0.00 H ATOM 1037 H ARG A 730 33.939 7.009 -18.416 1.00 0.00 H ATOM 1038 N GLN A 731 36.858 8.676 -18.286 1.00 27.12 N ATOM 1039 CA GLN A 731 37.969 9.493 -17.819 1.00 28.62 C ATOM 1040 C GLN A 731 38.776 8.767 -16.752 1.00 28.22 C ATOM 1041 O GLN A 731 40.010 8.823 -16.755 1.00 29.65 O ATOM 1042 CB GLN A 731 37.443 10.841 -17.305 1.00 29.10 C ATOM 1043 H GLN A 731 35.880 8.990 -18.126 1.00 0.00 H ATOM 1044 N ALA A 732 38.097 8.059 -15.846 1.00 26.56 N ATOM 1045 CA ALA A 732 38.806 7.368 -14.779 1.00 26.44 C ATOM 1046 C ALA A 732 39.651 6.239 -15.337 1.00 26.84 C ATOM 1047 O ALA A 732 40.763 6.005 -14.858 1.00 29.54 O ATOM 1048 CB ALA A 732 37.819 6.837 -13.740 1.00 29.12 C ATOM 1049 H ALA A 732 37.060 8.001 -15.903 1.00 0.00 H ATOM 1050 N ARG A 733 39.148 5.539 -16.362 1.00 26.90 N ATOM 1051 CA ARG A 733 39.929 4.446 -16.944 1.00 27.68 C ATOM 1052 C ARG A 733 41.183 4.985 -17.613 1.00 29.79 C ATOM 1053 O ARG A 733 42.263 4.396 -17.488 1.00 34.60 O ATOM 1054 CB ARG A 733 39.092 3.663 -17.953 1.00 28.40 C ATOM 1055 CG ARG A 733 39.782 2.381 -18.418 1.00 31.40 C ATOM 1056 CD ARG A 733 39.101 1.747 -19.621 1.00 35.14 C ATOM 1057 NE ARG A 733 37.816 1.142 -19.290 1.00 34.45 N ATOM 1058 CZ ARG A 733 37.674 -0.110 -18.857 1.00 32.50 C ATOM 1059 NH1 ARG A 733 38.738 -0.877 -18.675 1.00 32.01 N ATOM 1060 NH2 ARG A 733 36.469 -0.589 -18.584 1.00 35.13 N ATOM 1061 HE ARG A 733 36.960 1.722 -19.398 1.00 0.00 H ATOM 1062 HH12 ARG A 733 38.623 -1.854 -18.337 1.00 0.00 H ATOM 1063 HH11 ARG A 733 39.688 -0.503 -18.870 1.00 0.00 H ATOM 1064 HH22 ARG A 733 36.362 -1.567 -18.246 1.00 0.00 H ATOM 1065 HH21 ARG A 733 35.630 0.013 -18.708 1.00 0.00 H ATOM 1066 H ARG A 733 38.208 5.771 -16.742 1.00 0.00 H ATOM 1067 N ARG A 734 41.054 6.108 -18.329 1.00 32.36 N ATOM 1068 CA ARG A 734 42.223 6.775 -18.903 1.00 32.60 C ATOM 1069 C ARG A 734 43.265 7.033 -17.835 1.00 33.32 C ATOM 1070 O ARG A 734 44.457 6.767 -18.027 1.00 37.07 O ATOM 1071 CB ARG A 734 41.831 8.109 -19.552 1.00 33.59 C ATOM 1072 CG ARG A 734 40.815 8.059 -20.673 1.00 45.21 C ATOM 1073 CD ARG A 734 40.577 9.478 -21.247 1.00 56.64 C ATOM 1074 NE ARG A 734 39.152 9.773 -21.453 1.00 58.46 N ATOM 1075 CZ ARG A 734 38.476 10.733 -20.816 1.00 54.41 C ATOM 1076 NH1 ARG A 734 37.180 10.917 -21.064 1.00 41.89 N ATOM 1077 NH2 ARG A 734 39.100 11.524 -19.939 1.00 53.54 N ATOM 1078 HE ARG A 734 38.633 9.193 -22.143 1.00 0.00 H ATOM 1079 HH12 ARG A 734 36.656 11.665 -20.566 1.00 0.00 H ATOM 1080 HH11 ARG A 734 36.692 10.312 -21.755 1.00 0.00 H ATOM 1081 HH22 ARG A 734 38.571 12.271 -19.444 1.00 0.00 H ATOM 1082 HH21 ARG A 734 40.114 11.393 -19.751 1.00 0.00 H ATOM 1083 H ARG A 734 40.108 6.513 -18.480 1.00 0.00 H ATOM 1084 N GLN A 735 42.832 7.567 -16.693 1.00 32.83 N ATOM 1085 CA GLN A 735 43.787 7.923 -15.647 1.00 38.78 C ATOM 1086 C GLN A 735 44.429 6.681 -15.048 1.00 37.50 C ATOM 1087 O GLN A 735 45.612 6.700 -14.688 1.00 43.34 O ATOM 1088 CB GLN A 735 43.100 8.752 -14.560 1.00 41.21 C ATOM 1089 CG GLN A 735 42.594 10.100 -15.040 1.00 50.35 C ATOM 1090 CD GLN A 735 43.721 11.060 -15.378 1.00 60.93 C ATOM 1091 OE1 GLN A 735 44.856 10.880 -14.940 1.00 65.39 O ATOM 1092 NE2 GLN A 735 43.410 12.084 -16.166 1.00 64.86 N ATOM 1093 HE22 GLN A 735 42.436 12.196 -16.513 1.00 0.00 H ATOM 1094 HE21 GLN A 735 44.141 12.773 -16.436 1.00 0.00 H ATOM 1095 H GLN A 735 41.815 7.730 -16.547 1.00 0.00 H ATOM 1096 N ALA A 736 43.669 5.590 -14.942 1.00 36.49 N ATOM 1097 CA ALA A 736 44.231 4.335 -14.453 1.00 43.31 C ATOM 1098 C ALA A 736 45.341 3.839 -15.366 1.00 51.68 C ATOM 1099 O ALA A 736 46.362 3.323 -14.894 1.00 49.95 O ATOM 1100 CB ALA A 736 43.130 3.280 -14.330 1.00 44.15 C ATOM 1101 H ALA A 736 42.665 5.634 -15.211 1.00 0.00 H ATOM 1102 N GLU A 737 45.164 3.993 -16.681 1.00 43.53 N ATOM 1103 CA GLU A 737 46.170 3.511 -17.622 1.00 48.84 C ATOM 1104 C GLU A 737 47.457 4.328 -17.551 1.00 50.45 C ATOM 1105 O GLU A 737 48.529 3.819 -17.897 1.00 53.39 O ATOM 1106 CB GLU A 737 45.595 3.510 -19.038 1.00 48.30 C ATOM 1107 CG GLU A 737 44.463 2.514 -19.211 1.00 57.10 C ATOM 1108 CD GLU A 737 43.740 2.668 -20.533 1.00 67.24 C ATOM 1109 OE1 GLU A 737 42.772 1.911 -20.774 1.00 64.55 O ATOM 1110 OE2 GLU A 737 44.140 3.549 -21.327 1.00 74.80 O ATOM 1111 H GLU A 737 44.305 4.459 -17.036 1.00 0.00 H ATOM 1112 N LYS A 738 47.377 5.585 -17.102 1.00 53.69 N ATOM 1113 CA LYS A 738 48.589 6.372 -16.889 1.00 58.75 C ATOM 1114 C LYS A 738 49.476 5.757 -15.813 1.00 68.26 C ATOM 1115 O LYS A 738 50.698 5.949 -15.829 1.00 74.63 O ATOM 1116 CB LYS A 738 48.230 7.808 -16.504 1.00 56.81 C ATOM 1117 CG LYS A 738 47.723 8.692 -17.639 1.00 56.87 C ATOM 1118 CD LYS A 738 47.433 10.105 -17.125 1.00 58.05 C ATOM 1119 CE LYS A 738 46.791 10.994 -18.190 1.00 60.23 C ATOM 1120 NZ LYS A 738 47.793 11.632 -19.097 1.00 63.79 N ATOM 1121 HZ1 LYS A 738 48.439 12.224 -18.537 1.00 0.00 H ATOM 1122 HZ2 LYS A 738 48.336 10.892 -19.587 1.00 0.00 H ATOM 1123 HZ3 LYS A 738 47.299 12.222 -19.797 1.00 0.00 H ATOM 1124 H LYS A 738 46.446 6.005 -16.903 1.00 0.00 H ATOM 1125 N MET A 739 48.883 5.026 -14.873 1.00 65.32 N ATOM 1126 CA MET A 739 49.617 4.425 -13.764 1.00 68.44 C ATOM 1127 C MET A 739 50.502 3.273 -14.234 1.00 70.68 C ATOM 1128 O MET A 739 50.004 2.263 -14.734 1.00 70.38 O ATOM 1129 CB MET A 739 48.639 3.933 -12.692 1.00 66.63 C ATOM 1130 CG MET A 739 47.738 5.024 -12.122 1.00 63.74 C ATOM 1131 SD MET A 739 46.468 4.416 -10.981 1.00 58.99 S ATOM 1132 CE MET A 739 45.863 5.973 -10.333 1.00 51.20 C ATOM 1133 H MET A 739 47.855 4.877 -14.931 1.00 0.00 H TER 1134 MET A 739 HETATM 1135 O HOH 1 37.740 9.683 -2.327 1.00 50.70 O HETATM 1136 O HOH 2 19.848 5.579 -1.920 1.00 43.50 O HETATM 1137 O HOH 3 24.762 11.774 -4.576 1.00 41.63 O HETATM 1138 O HOH 4 29.182 4.782 -1.397 1.00 47.26 O HETATM 1139 O HOH 5 2.877 6.357 -19.177 1.00 44.12 O HETATM 1140 O HOH 6 23.089 12.891 -19.724 1.00 45.51 O HETATM 1141 O HOH 7 24.082 -7.933 -4.430 1.00 46.95 O HETATM 1142 O HOH 8 34.738 2.898 -19.268 1.00 42.91 O HETATM 1143 O HOH 9 34.736 11.213 -20.665 1.00 40.32 O HETATM 1144 O HOH 10 26.265 5.453 -0.480 1.00 42.88 O HETATM 1145 O HOH 11 23.075 11.061 -13.545 1.00 37.51 O HETATM 1146 O HOH 12 10.700 7.831 -18.042 1.00 41.50 O HETATM 1147 O HOH 13 18.553 0.543 2.181 1.00 57.19 O HETATM 1148 O HOH 14 8.082 -1.885 -11.544 1.00 48.68 O HETATM 1149 O HOH 15 30.267 -7.570 -7.071 1.00 43.36 O HETATM 1150 O HOH 16 19.783 -2.671 -7.151 1.00 32.63 O HETATM 1151 O HOH 17 4.340 3.274 -14.581 1.00 49.18 O HETATM 1152 O HOH 18 16.963 -0.813 -9.199 1.00 32.32 O HETATM 1153 O HOH 19 33.404 -9.865 -12.983 1.00 43.06 O HETATM 1154 O HOH 20 32.215 -6.843 -10.432 1.00 41.54 O HETATM 1155 O HOH 21 39.932 -3.977 -16.185 1.00 35.20 O HETATM 1156 O HOH 22 23.403 14.510 -12.164 1.00 39.03 O HETATM 1157 O HOH 23 33.930 -3.912 3.320 1.00 49.51 O HETATM 1158 O HOH 24 30.124 11.975 -3.876 1.00 48.37 O HETATM 1159 O HOH 25 38.304 -7.560 -8.764 1.00 37.49 O HETATM 1160 O HOH 26 34.314 0.000 -20.718 1.00 51.73 O HETATM 1161 O HOH 27 20.405 0.528 -6.732 1.00 31.47 O HETATM 1162 O HOH 28 21.300 7.139 -23.330 1.00 36.30 O HETATM 1163 O HOH 29 19.397 10.811 -8.509 1.00 36.56 O HETATM 1164 O HOH 30 11.894 -8.017 -9.186 1.00 57.84 O HETATM 1165 O HOH 31 38.114 9.405 -11.002 1.00 33.72 O HETATM 1166 O HOH 32 39.355 7.627 -23.345 1.00 41.50 O HETATM 1167 O HOH 33 29.426 2.160 -17.831 1.00 41.17 O HETATM 1168 O HOH 34 45.405 7.500 -7.099 1.00 43.87 O HETATM 1169 O HOH 35 19.274 1.889 -4.645 1.00 34.49 O HETATM 1170 O HOH 36 32.553 4.660 -20.299 1.00 39.01 O HETATM 1171 O HOH 37 11.105 0.835 -7.563 1.00 50.73 O HETATM 1172 O HOH 38 20.446 -8.259 -10.854 1.00 38.87 O HETATM 1173 O HOH 39 42.381 -2.420 -14.149 1.00 39.84 O HETATM 1174 O HOH 40 24.530 -5.012 -15.884 1.00 31.72 O HETATM 1175 O HOH 41 20.377 -6.153 -14.050 1.00 35.02 O HETATM 1176 O HOH 42 29.562 12.989 -16.482 1.00 36.77 O HETATM 1177 O HOH 43 27.494 3.868 -18.636 1.00 30.37 O HETATM 1178 O HOH 44 25.823 1.608 -17.303 1.00 33.39 O HETATM 1179 O HOH 45 38.811 -3.305 -4.208 1.00 33.25 O HETATM 1180 O HOH 46 19.377 0.118 -9.157 1.00 35.73 O HETATM 1181 O HOH 47 20.490 9.978 -12.507 1.00 35.53 O HETATM 1182 O HOH 48 22.315 15.466 -3.206 1.00 47.94 O HETATM 1183 O HOH 49 41.577 0.667 -22.978 1.00 43.08 O HETATM 1184 O HOH 50 30.797 13.853 -10.512 1.00 38.82 O HETATM 1185 O HOH 51 19.548 -2.710 -3.943 1.00 41.17 O HETATM 1186 O HOH 52 21.893 -3.587 -3.212 1.00 40.87 O HETATM 1187 O HOH 53 44.029 -4.014 -12.486 1.00 44.17 O HETATM 1188 O HOH 54 35.623 12.278 -6.210 1.00 45.00 O HETATM 1189 O HOH 55 28.922 -4.615 -17.330 1.00 35.11 O HETATM 1190 O HOH 56 26.980 -5.529 -14.921 1.00 31.31 O HETATM 1191 O HOH 57 38.936 -5.399 -20.192 1.00 40.74 O HETATM 1192 O HOH 58 5.819 9.363 -17.970 1.00 44.29 O HETATM 1193 O HOH 59 28.932 -7.281 -11.448 1.00 47.69 O HETATM 1194 O HOH 60 33.251 -3.603 -17.393 1.00 45.36 O HETATM 1195 O HOH 61 7.498 0.175 -19.315 1.00 33.58 O HETATM 1196 O HOH 62 8.674 2.645 -25.293 1.00 38.09 O HETATM 1197 O HOH 63 41.407 4.426 -21.403 1.00 44.46 O HETATM 1198 O HOH 64 36.453 10.634 -13.900 1.00 31.99 O HETATM 1199 O HOH 65 40.373 9.011 -3.307 1.00 41.47 O HETATM 1200 O HOH 66 25.548 16.048 -10.253 1.00 46.98 O HETATM 1201 O HOH 67 9.501 -5.176 -12.358 1.00 45.94 O HETATM 1202 O HOH 68 17.946 3.008 -1.519 1.00 50.60 O HETATM 1203 O HOH 69 28.866 -7.218 -0.823 1.00 54.18 O HETATM 1204 O HOH 70 36.540 3.368 -20.660 1.00 40.22 O HETATM 1205 O HOH 71 44.065 -7.592 -10.896 1.00 46.11 O HETATM 1206 O HOH 72 7.599 0.778 -12.257 1.00 38.00 O HETATM 1207 O HOH 73 21.993 0.000 -20.718 1.00 28.06 O HETATM 1208 O HOH 74 18.926 6.353 -24.859 1.00 38.27 O HETATM 1209 O HOH 75 34.103 6.596 -2.481 1.00 46.21 O HETATM 1210 O HOH 76 28.613 -7.629 -4.251 1.00 43.83 O HETATM 1211 O HOH 77 28.440 8.382 -21.914 1.00 49.04 O HETATM 1212 O HOH 78 50.633 -5.160 -10.389 1.00 48.23 O HETATM 1213 O HOH 79 18.014 -4.217 -2.461 1.00 48.49 O HETATM 1214 O HOH 80 24.183 6.085 -22.522 1.00 39.46 O HETATM 1215 O HOH 81 6.032 2.514 -19.212 1.00 34.63 O HETATM 1216 O HOH 82 35.373 -10.145 -8.826 1.00 51.06 O HETATM 1217 O HOH 83 9.726 -8.499 -9.753 1.00 60.71 O HETATM 1218 O HOH 84 29.183 -9.082 -15.940 1.00 54.58 O HETATM 1219 O HOH 85 27.006 12.510 -3.376 1.00 53.30 O HETATM 1220 O HOH 86 7.123 -2.283 -13.779 1.00 50.82 O HETATM 1221 O HOH 87 16.778 11.657 -8.287 1.00 43.72 O HETATM 1222 O HOH 88 40.309 -6.732 -16.194 1.00 39.11 O HETATM 1223 O HOH 89 43.326 9.262 -7.795 1.00 44.46 O HETATM 1224 O HOH 90 22.451 -9.758 -12.095 1.00 45.49 O HETATM 1225 O HOH 91 3.642 8.707 -18.916 1.00 46.87 O HETATM 1226 O HOH 92 32.992 14.196 -12.333 1.00 44.42 O HETATM 1227 O HOH 93 6.224 3.949 -21.587 1.00 38.68 O HETATM 1228 O HOH 94 40.428 10.357 -12.372 1.00 50.18 O HETATM 1229 O HOH 95 32.204 13.706 -16.229 1.00 49.84 O HETATM 1230 O HOH 96 34.737 13.050 -14.652 1.00 39.73 O HETATM 1231 O HOH 97 24.322 0.234 -18.987 1.00 39.24 O HETATM 1232 O HOH 98 21.775 -8.557 -14.621 1.00 48.75 O HETATM 1233 O HOH 99 42.310 -2.961 -16.818 1.00 48.27 O HETATM 1234 O HOH 100 27.027 -8.112 -13.480 1.00 45.40 O HETATM 1235 O HOH 101 26.539 -8.115 -3.398 1.00 53.62 O HETATM 1236 O HOH 102 28.280 13.947 -18.715 1.00 47.35 O HETATM 1237 O HOH 103 48.851 -4.585 -12.619 1.00 56.64 O HETATM 1238 O HOH 104 26.123 0.000 -20.718 1.00 49.07 O HETATM 1239 O HOH 105 3.807 5.314 -21.902 1.00 49.63 O HETATM 1240 O HOH 106 5.072 1.654 -12.824 1.00 44.11 O HETATM 1241 O HOH 107 23.627 17.455 -5.308 1.00 52.46 O HETATM 1242 O HOH 108 42.913 11.403 -5.889 1.00 44.18 O HETATM 1243 O HOH 109 6.700 -1.998 -18.072 1.00 35.80 O HETATM 1244 O HOH 110 14.700 -5.829 -18.825 1.00 45.26 O HETATM 1245 O HOH 111 19.332 -6.018 -0.813 1.00 49.66 O HETATM 1246 O HOH 112 4.296 -1.354 -17.110 1.00 48.41 O HETATM 1247 O HOH 113 19.538 -8.851 -0.972 1.00 52.90 O HETATM 1248 O HOH 114 43.952 10.725 -1.619 1.00 55.14 O HETATM 1249 O HOH 115 45.957 10.930 -3.205 1.00 55.47 O HETATM 1250 O UNN A 116 14.733 0.808 -8.624 1.00 -0.38 O HETATM 1251 C UNN A 116 14.809 1.399 -7.550 1.00 0.23 C HETATM 1252 NAI UNN A 116 13.619 1.697 -6.876 1.00 -0.24 N HETATM 1253 CAO UNN A 116 13.625 2.373 -5.652 1.00 0.09 C HETATM 1254 CAG UNN A 116 12.436 2.628 -4.981 1.00 -0.04 C HETATM 1255 CAM UNN A 116 12.466 3.306 -3.766 1.00 -0.02 C HETATM 1256 CAK UNN A 116 11.286 3.577 -3.083 1.00 0.05 C HETATM 1257 OAD UNN A 116 11.323 4.244 -2.025 1.00 -0.56 O HETATM 1258 OAB UNN A 116 10.191 3.178 -3.536 1.00 -0.56 O HETATM 1259 CAE UNN A 116 13.677 3.725 -3.225 1.00 -0.07 C HETATM 1260 CAF UNN A 116 14.866 3.468 -3.898 1.00 -0.05 C HETATM 1261 CAN UNN A 116 14.832 2.788 -5.109 1.00 0.07 C HETATM 1262 N UNN A 116 16.022 2.535 -5.791 1.00 -0.31 N HETATM 1263 CA UNN A 116 16.069 1.724 -7.030 1.00 0.13 C HETATM 1264 CB UNN A 116 16.879 2.461 -8.096 1.00 -0.02 C HETATM 1265 CAA UNN A 116 16.223 3.820 -8.348 1.00 -0.06 C HETATM 1266 H9 UNN A 116 16.793 4.366 -9.114 1.00 0.02 H HETATM 1267 H10 UNN A 116 16.213 4.401 -7.414 1.00 0.02 H HETATM 1268 H11 UNN A 116 15.191 3.670 -8.697 1.00 0.02 H HETATM 1269 H7 UNN A 116 16.888 1.875 -9.027 1.00 0.03 H HETATM 1270 H8 UNN A 116 17.911 2.606 -7.744 1.00 0.03 H HETATM 1271 H6 UNN A 116 16.583 0.782 -6.790 1.00 0.08 H HETATM 1272 H5 UNN A 116 16.900 2.926 -5.420 1.00 0.18 H HETATM 1273 H4 UNN A 116 15.812 3.795 -3.481 1.00 0.05 H HETATM 1274 H3 UNN A 116 13.694 4.252 -2.278 1.00 0.05 H HETATM 1275 H2 UNN A 116 11.491 2.301 -5.401 1.00 0.05 H HETATM 1276 H1 UNN A 116 12.746 1.421 -7.278 1.00 0.22 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 1250 1251 CONECT 1251 1250 1252 1263 CONECT 1252 1251 1253 1276 CONECT 1253 1252 1254 1261 CONECT 1254 1253 1255 1275 CONECT 1255 1254 1256 1259 CONECT 1256 1255 1257 1258 CONECT 1257 1256 CONECT 1258 1256 CONECT 1259 1255 1260 1274 CONECT 1260 1259 1261 1273 CONECT 1261 1253 1260 1262 CONECT 1262 1261 1263 1272 CONECT 1263 1251 1262 1264 1271 CONECT 1264 1263 1265 1269 1270 CONECT 1265 1264 1266 1267 1268 CONECT 1266 1265 CONECT 1267 1265 CONECT 1268 1265 CONECT 1269 1264 CONECT 1270 1264 CONECT 1271 1263 CONECT 1272 1262 CONECT 1273 1260 CONECT 1274 1259 CONECT 1275 1254 CONECT 1276 1252 MASTER 0 0 0 0 0 0 0 0 1275 1 31 9 END
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Related entries of code: 5dya
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%
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
5dya
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
human BRPF1 bromodomain
Ligand Name
5GV
EC.Number
E.C.-.-.-.-
Resolution
1.65(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
1
1
H
1
2
N
2
O
3
Molecular Weight
220.225
Exact Mass
220.085
No. of atoms
28
No. of bonds
29
Polar Surface Area
78.43
LOGP Value
2.43 (
Computed with XLOGP3
)
1.80 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 1
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 2
Canonical SMILES
CC[C@H]1Nc2ccc(cc2NC1=O)C(=O)O
InChI String
InChI=1S/C11H12N2O3/c1-2-7-10(14)13-9-5-6(11(15)16)3-4-8(9)12-7/h3-5,7,12H,2H2,1H3,(H,13,14)(H,15,16)/t7-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P55201
Entrez Gene ID
NCBI Entrez Gene ID:
7862
ASD
Information of known allosteric effects of PDB entries
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