Browse entries in the PDBbind-CN Database
HEADER 6BU0_COMPLEX COMPND 6BU0_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 B 126 ALA ILE GLY GLY ALA VAL LYS LEU SER ILE SER TYR ARG SEQRES 2 B 126 ASN GLY THR LEU PHE ILE MET VAL MET HIS ILE LYS ASP SEQRES 3 B 126 LEU VAL THR GLU ASP GLY ALA ASP PRO ASN PRO TYR VAL SEQRES 4 B 126 LYS THR TYR LEU LEU PRO ASP ASN HIS LYS THR SER LYS SEQRES 5 B 126 ARG LYS THR LYS ILE SER ARG LYS THR ARG ASN PRO THR SEQRES 6 B 126 PHE ASN GLU MET LEU VAL TYR SER GLY TYR SER LYS GLU SEQRES 7 B 126 THR LEU ARG GLN ARG GLU LEU GLN LEU SER VAL LEU SER SEQRES 8 B 126 ALA GLU SER LEU ARG GLY ASN PHE PHE LEU GLY GLY VAL SEQRES 9 B 126 THR LEU PRO LEU LYS ASP PHE ASN LEU SER LYS GLU THR SEQRES 10 B 126 VAL LYS TRP TYR GLN LEU THR ALA ALA HET IHP A 134 42 ATOM 1 N ALA B1558 -26.330 -13.337 4.013 1.00 82.82 N ATOM 2 CA ALA B1558 -27.303 -12.566 4.788 1.00 82.40 C ATOM 3 C ALA B1558 -28.621 -12.370 4.008 1.00 80.92 C ATOM 4 O ALA B1558 -28.609 -12.240 2.789 1.00 72.75 O ATOM 5 CB ALA B1558 -26.706 -11.222 5.189 1.00 77.30 C ATOM 6 HN3 ALA B1558 -26.117 -12.834 3.128 1.00 0.00 H ATOM 7 HN2 ALA B1558 -26.726 -14.273 3.795 1.00 0.00 H ATOM 8 HN1 ALA B1558 -25.457 -13.449 4.568 1.00 0.00 H ATOM 9 N ILE B1559 -29.747 -12.338 4.731 1.00 81.52 N ATOM 10 CA ILE B1559 -31.087 -12.469 4.152 1.00 78.99 C ATOM 11 C ILE B1559 -31.608 -11.099 3.708 1.00 78.77 C ATOM 12 O ILE B1559 -31.548 -10.122 4.469 1.00 80.32 O ATOM 13 CB ILE B1559 -32.033 -13.129 5.174 1.00 79.01 C ATOM 14 CG1 ILE B1559 -31.947 -14.655 5.068 1.00 76.60 C ATOM 15 CG2 ILE B1559 -33.465 -12.578 5.085 1.00 81.11 C ATOM 16 CD1 ILE B1559 -32.505 -15.206 3.829 1.00 82.06 C ATOM 17 H ILE B1559 -29.667 -12.213 5.760 1.00 0.00 H ATOM 18 N GLY B1560 -32.146 -11.026 2.485 1.00 71.30 N ATOM 19 CA GLY B1560 -32.481 -9.729 1.920 1.00 64.35 C ATOM 20 C GLY B1560 -33.911 -9.419 1.513 1.00 65.41 C ATOM 21 O GLY B1560 -34.165 -8.299 1.058 1.00 64.99 O ATOM 22 H GLY B1560 -32.324 -11.894 1.941 1.00 0.00 H ATOM 23 N GLY B1561 -34.851 -10.356 1.684 1.00 65.17 N ATOM 24 CA GLY B1561 -36.195 -10.255 1.134 1.00 52.70 C ATOM 25 C GLY B1561 -36.413 -11.270 0.022 1.00 46.78 C ATOM 26 O GLY B1561 -35.592 -12.156 -0.213 1.00 52.30 O ATOM 27 H GLY B1561 -34.608 -11.201 2.239 1.00 0.00 H ATOM 28 N ALA B1562 -37.551 -11.141 -0.667 1.00 49.24 N ATOM 29 CA ALA B1562 -37.839 -11.970 -1.840 1.00 48.83 C ATOM 30 C ALA B1562 -38.496 -11.144 -2.938 1.00 46.13 C ATOM 31 O ALA B1562 -39.189 -10.161 -2.663 1.00 46.57 O ATOM 32 CB ALA B1562 -38.753 -13.150 -1.506 1.00 52.55 C ATOM 33 H ALA B1562 -38.250 -10.434 -0.363 1.00 0.00 H ATOM 34 N VAL B1563 -38.293 -11.569 -4.190 1.00 45.68 N ATOM 35 CA VAL B1563 -38.829 -10.874 -5.356 1.00 48.70 C ATOM 36 C VAL B1563 -39.586 -11.863 -6.236 1.00 49.50 C ATOM 37 O VAL B1563 -39.121 -12.985 -6.465 1.00 49.55 O ATOM 38 CB VAL B1563 -37.712 -10.185 -6.167 1.00 49.55 C ATOM 39 CG1 VAL B1563 -36.621 -11.195 -6.540 1.00 46.06 C ATOM 40 CG2 VAL B1563 -38.296 -9.501 -7.420 1.00 47.93 C ATOM 41 H VAL B1563 -37.730 -12.431 -4.339 1.00 0.00 H ATOM 42 N LYS B1564 -40.752 -11.446 -6.730 1.00 50.23 N ATOM 43 CA LYS B1564 -41.552 -12.252 -7.649 1.00 51.76 C ATOM 44 C LYS B1564 -41.320 -11.797 -9.084 1.00 49.11 C ATOM 45 O LYS B1564 -41.510 -10.622 -9.414 1.00 47.46 O ATOM 46 CB LYS B1564 -43.042 -12.166 -7.303 1.00 55.65 C ATOM 47 CG LYS B1564 -43.927 -13.191 -8.027 1.00 53.97 C ATOM 48 CD LYS B1564 -45.401 -12.914 -7.779 1.00 61.66 C ATOM 49 CE LYS B1564 -46.269 -14.162 -7.925 1.00 77.39 C ATOM 50 NZ LYS B1564 -47.714 -13.839 -7.725 1.00 98.98 N ATOM 51 HZ1 LYS B1564 -47.852 -13.447 -6.772 1.00 0.00 H ATOM 52 HZ2 LYS B1564 -48.013 -13.140 -8.435 1.00 0.00 H ATOM 53 HZ3 LYS B1564 -48.279 -14.706 -7.830 1.00 0.00 H ATOM 54 H LYS B1564 -41.106 -10.509 -6.450 1.00 0.00 H ATOM 55 N LEU B1565 -40.977 -12.742 -9.942 1.00 52.40 N ATOM 56 CA LEU B1565 -40.585 -12.456 -11.305 1.00 46.13 C ATOM 57 C LEU B1565 -41.347 -13.366 -12.243 1.00 51.69 C ATOM 58 O LEU B1565 -41.690 -14.493 -11.881 1.00 50.25 O ATOM 59 CB LEU B1565 -39.097 -12.686 -11.525 1.00 43.99 C ATOM 60 CG LEU B1565 -38.084 -11.777 -10.871 1.00 47.91 C ATOM 61 CD1 LEU B1565 -36.719 -12.266 -11.290 1.00 47.80 C ATOM 62 CD2 LEU B1565 -38.331 -10.349 -11.322 1.00 50.47 C ATOM 63 H LEU B1565 -40.989 -13.732 -9.624 1.00 0.00 H ATOM 64 N SER B1566 -41.612 -12.856 -13.446 1.00 51.35 N ATOM 65 CA SER B1566 -42.105 -13.640 -14.568 1.00 53.99 C ATOM 66 C SER B1566 -41.086 -13.576 -15.693 1.00 55.42 C ATOM 67 O SER B1566 -40.632 -12.490 -16.069 1.00 54.15 O ATOM 68 CB SER B1566 -43.451 -13.119 -15.067 1.00 58.66 C ATOM 69 OG SER B1566 -43.859 -13.823 -16.229 1.00 62.26 O ATOM 70 HG SER B1566 -44.732 -13.472 -16.537 1.00 0.00 H ATOM 71 H SER B1566 -41.457 -11.838 -13.591 1.00 0.00 H ATOM 72 N ILE B1567 -40.751 -14.729 -16.254 1.00 57.48 N ATOM 73 CA ILE B1567 -39.716 -14.812 -17.270 1.00 54.47 C ATOM 74 C ILE B1567 -40.276 -15.599 -18.434 1.00 59.61 C ATOM 75 O ILE B1567 -40.832 -16.686 -18.245 1.00 62.21 O ATOM 76 CB ILE B1567 -38.431 -15.457 -16.723 1.00 53.02 C ATOM 77 CG1 ILE B1567 -37.856 -14.574 -15.615 1.00 52.57 C ATOM 78 CG2 ILE B1567 -37.413 -15.587 -17.802 1.00 47.86 C ATOM 79 CD1 ILE B1567 -36.708 -15.177 -14.909 1.00 55.63 C ATOM 80 H ILE B1567 -41.242 -15.597 -15.959 1.00 0.00 H ATOM 81 N SER B1568 -40.130 -15.049 -19.634 1.00 59.02 N ATOM 82 CA SER B1568 -40.662 -15.662 -20.835 1.00 55.61 C ATOM 83 C SER B1568 -39.861 -15.141 -22.013 1.00 58.70 C ATOM 84 O SER B1568 -39.119 -14.157 -21.903 1.00 59.88 O ATOM 85 CB SER B1568 -42.152 -15.366 -21.017 1.00 56.22 C ATOM 86 OG SER B1568 -42.368 -13.981 -21.229 1.00 58.48 O ATOM 87 HG SER B1568 -43.337 -13.813 -21.344 1.00 0.00 H ATOM 88 H SER B1568 -39.617 -14.148 -19.715 1.00 0.00 H ATOM 89 N TYR B1569 -40.016 -15.831 -23.138 1.00 58.07 N ATOM 90 CA TYR B1569 -39.252 -15.556 -24.343 1.00 58.37 C ATOM 91 C TYR B1569 -40.177 -15.761 -25.526 1.00 58.90 C ATOM 92 O TYR B1569 -40.722 -16.853 -25.704 1.00 60.30 O ATOM 93 CB TYR B1569 -38.025 -16.468 -24.444 1.00 59.22 C ATOM 94 CG TYR B1569 -37.202 -16.267 -25.704 1.00 60.47 C ATOM 95 CD1 TYR B1569 -37.491 -16.964 -26.866 1.00 62.41 C ATOM 96 CD2 TYR B1569 -36.129 -15.377 -25.725 1.00 60.49 C ATOM 97 CE1 TYR B1569 -36.745 -16.779 -28.021 1.00 64.36 C ATOM 98 CE2 TYR B1569 -35.380 -15.184 -26.873 1.00 60.02 C ATOM 99 CZ TYR B1569 -35.688 -15.894 -28.016 1.00 63.19 C ATOM 100 OH TYR B1569 -34.944 -15.717 -29.158 1.00 61.68 O ATOM 101 HH TYR B1569 -34.000 -15.954 -28.976 1.00 0.00 H ATOM 102 H TYR B1569 -40.714 -16.601 -23.157 1.00 0.00 H ATOM 103 N ARG B1570 -40.357 -14.709 -26.319 1.00 56.60 N ATOM 104 CA ARG B1570 -41.211 -14.725 -27.496 1.00 64.96 C ATOM 105 C ARG B1570 -40.581 -13.816 -28.543 1.00 60.77 C ATOM 106 O ARG B1570 -40.089 -12.736 -28.210 1.00 61.03 O ATOM 107 CB ARG B1570 -42.637 -14.233 -27.174 1.00 65.79 C ATOM 108 CG ARG B1570 -43.324 -14.928 -26.004 1.00 63.28 C ATOM 109 CD ARG B1570 -44.568 -14.173 -25.552 1.00 67.82 C ATOM 110 NE ARG B1570 -44.348 -13.449 -24.296 1.00 71.09 N ATOM 111 CZ ARG B1570 -44.468 -12.130 -24.152 1.00 64.81 C ATOM 112 NH1 ARG B1570 -44.812 -11.365 -25.185 1.00 65.06 N ATOM 113 NH2 ARG B1570 -44.254 -11.577 -22.967 1.00 64.00 N ATOM 114 HE ARG B1570 -44.079 -14.004 -23.459 1.00 0.00 H ATOM 115 HH12 ARG B1570 -44.903 -10.336 -25.063 1.00 0.00 H ATOM 116 HH11 ARG B1570 -44.990 -11.796 -26.115 1.00 0.00 H ATOM 117 HH22 ARG B1570 -44.346 -10.548 -22.849 1.00 0.00 H ATOM 118 HH21 ARG B1570 -43.994 -12.172 -22.155 1.00 0.00 H ATOM 119 H ARG B1570 -39.860 -13.826 -26.085 1.00 0.00 H ATOM 120 N ASN B1571 -40.618 -14.249 -29.802 1.00 63.34 N ATOM 121 CA ASN B1571 -40.247 -13.404 -30.945 1.00 69.73 C ATOM 122 C ASN B1571 -38.868 -12.785 -30.770 1.00 61.08 C ATOM 123 O ASN B1571 -38.670 -11.597 -31.024 1.00 63.33 O ATOM 124 CB ASN B1571 -41.281 -12.302 -31.172 1.00 68.02 C ATOM 125 CG ASN B1571 -42.565 -12.822 -31.759 1.00 73.37 C ATOM 126 OD1 ASN B1571 -43.615 -12.761 -31.117 1.00 73.79 O ATOM 127 ND2 ASN B1571 -42.499 -13.321 -32.998 1.00 74.07 N ATOM 128 HD22 ASN B1571 -41.588 -13.351 -33.499 1.00 0.00 H ATOM 129 HD21 ASN B1571 -43.359 -13.679 -33.461 1.00 0.00 H ATOM 130 H ASN B1571 -40.922 -15.227 -29.984 1.00 0.00 H ATOM 131 N GLY B1572 -37.922 -13.572 -30.273 1.00 57.94 N ATOM 132 CA GLY B1572 -36.550 -13.121 -30.166 1.00 55.11 C ATOM 133 C GLY B1572 -36.270 -12.242 -28.970 1.00 59.97 C ATOM 134 O GLY B1572 -35.143 -11.740 -28.837 1.00 64.27 O ATOM 135 H GLY B1572 -38.171 -14.530 -29.954 1.00 0.00 H ATOM 136 N THR B1573 -37.257 -12.026 -28.107 1.00 55.00 N ATOM 137 CA THR B1573 -37.111 -11.179 -26.939 1.00 56.95 C ATOM 138 C THR B1573 -37.242 -11.991 -25.657 1.00 53.58 C ATOM 139 O THR B1573 -38.125 -12.842 -25.539 1.00 51.62 O ATOM 140 CB THR B1573 -38.158 -10.083 -26.946 1.00 55.80 C ATOM 141 OG1 THR B1573 -37.911 -9.208 -28.042 1.00 53.93 O ATOM 142 CG2 THR B1573 -38.112 -9.298 -25.636 1.00 55.74 C ATOM 143 HG1 THR B1573 -37.010 -8.808 -27.947 1.00 0.00 H ATOM 144 H THR B1573 -38.175 -12.485 -28.277 1.00 0.00 H ATOM 145 N LEU B1574 -36.359 -11.720 -24.704 1.00 49.99 N ATOM 146 CA LEU B1574 -36.525 -12.162 -23.330 1.00 52.17 C ATOM 147 C LEU B1574 -37.346 -11.128 -22.576 1.00 50.96 C ATOM 148 O LEU B1574 -37.021 -9.938 -22.615 1.00 50.27 O ATOM 149 CB LEU B1574 -35.164 -12.328 -22.664 1.00 46.34 C ATOM 150 CG LEU B1574 -35.264 -12.847 -21.248 1.00 45.12 C ATOM 151 CD1 LEU B1574 -35.806 -14.258 -21.289 1.00 49.87 C ATOM 152 CD2 LEU B1574 -33.934 -12.767 -20.505 1.00 42.82 C ATOM 153 H LEU B1574 -35.513 -11.168 -24.951 1.00 0.00 H ATOM 154 N PHE B1575 -38.375 -11.578 -21.862 1.00 49.52 N ATOM 155 CA PHE B1575 -39.249 -10.688 -21.100 1.00 48.61 C ATOM 156 C PHE B1575 -39.103 -10.963 -19.608 1.00 54.52 C ATOM 157 O PHE B1575 -39.376 -12.081 -19.158 1.00 56.42 O ATOM 158 CB PHE B1575 -40.705 -10.873 -21.522 1.00 50.89 C ATOM 159 CG PHE B1575 -41.032 -10.275 -22.854 1.00 52.11 C ATOM 160 CD1 PHE B1575 -41.364 -8.944 -22.958 1.00 51.96 C ATOM 161 CD2 PHE B1575 -41.019 -11.045 -23.994 1.00 51.98 C ATOM 162 CE1 PHE B1575 -41.665 -8.388 -24.169 1.00 52.38 C ATOM 163 CE2 PHE B1575 -41.325 -10.495 -25.210 1.00 55.59 C ATOM 164 CZ PHE B1575 -41.649 -9.166 -25.302 1.00 54.79 C ATOM 165 H PHE B1575 -38.564 -12.601 -21.846 1.00 0.00 H ATOM 166 N ILE B1576 -38.714 -9.941 -18.836 1.00 48.36 N ATOM 167 CA ILE B1576 -38.544 -10.060 -17.386 1.00 50.28 C ATOM 168 C ILE B1576 -39.569 -9.146 -16.713 1.00 53.60 C ATOM 169 O ILE B1576 -39.329 -7.944 -16.539 1.00 53.11 O ATOM 170 CB ILE B1576 -37.116 -9.709 -16.927 1.00 57.71 C ATOM 171 CG1 ILE B1576 -36.024 -10.390 -17.778 1.00 43.87 C ATOM 172 CG2 ILE B1576 -36.951 -10.031 -15.463 1.00 43.00 C ATOM 173 CD1 ILE B1576 -36.202 -11.875 -17.894 1.00 50.07 C ATOM 174 H ILE B1576 -38.524 -9.022 -19.285 1.00 0.00 H ATOM 175 N MET B1577 -40.695 -9.710 -16.284 1.00 52.23 N ATOM 176 CA MET B1577 -41.742 -8.956 -15.589 1.00 52.88 C ATOM 177 C MET B1577 -41.441 -8.925 -14.088 1.00 47.32 C ATOM 178 O MET B1577 -41.671 -9.905 -13.381 1.00 52.00 O ATOM 179 CB MET B1577 -43.106 -9.582 -15.883 1.00 58.76 C ATOM 180 CG MET B1577 -44.252 -9.095 -15.012 1.00 55.86 C ATOM 181 SD MET B1577 -44.850 -7.479 -15.531 1.00 70.50 S ATOM 182 CE MET B1577 -46.401 -7.399 -14.619 1.00 66.73 C ATOM 183 H MET B1577 -40.838 -10.727 -16.448 1.00 0.00 H ATOM 184 N VAL B1578 -40.916 -7.802 -13.595 1.00 47.04 N ATOM 185 CA VAL B1578 -40.685 -7.615 -12.162 1.00 49.81 C ATOM 186 C VAL B1578 -42.002 -7.220 -11.517 1.00 50.70 C ATOM 187 O VAL B1578 -42.573 -6.177 -11.847 1.00 54.61 O ATOM 188 CB VAL B1578 -39.616 -6.540 -11.894 1.00 48.26 C ATOM 189 CG1 VAL B1578 -39.387 -6.388 -10.411 1.00 46.94 C ATOM 190 CG2 VAL B1578 -38.333 -6.893 -12.552 1.00 51.25 C ATOM 191 H VAL B1578 -40.663 -7.035 -14.250 1.00 0.00 H ATOM 192 N MET B1579 -42.462 -8.017 -10.564 1.00 49.18 N ATOM 193 CA MET B1579 -43.802 -7.804 -10.032 1.00 50.28 C ATOM 194 C MET B1579 -43.746 -7.064 -8.703 1.00 52.02 C ATOM 195 O MET B1579 -43.914 -5.839 -8.682 1.00 55.59 O ATOM 196 CB MET B1579 -44.527 -9.139 -9.926 1.00 49.14 C ATOM 197 CG MET B1579 -44.843 -9.706 -11.297 1.00 47.47 C ATOM 198 SD MET B1579 -45.737 -11.260 -11.279 1.00 59.73 S ATOM 199 CE MET B1579 -44.470 -12.432 -11.664 1.00 58.33 C ATOM 200 H MET B1579 -41.870 -8.790 -10.198 1.00 0.00 H ATOM 201 N HIS B1580 -43.462 -7.756 -7.601 1.00 49.33 N ATOM 202 CA HIS B1580 -43.275 -7.038 -6.344 1.00 55.32 C ATOM 203 C HIS B1580 -42.310 -7.791 -5.439 1.00 49.45 C ATOM 204 O HIS B1580 -41.973 -8.952 -5.673 1.00 48.98 O ATOM 205 CB HIS B1580 -44.612 -6.755 -5.632 1.00 54.24 C ATOM 206 CG HIS B1580 -45.339 -7.974 -5.153 1.00 58.92 C ATOM 207 ND1 HIS B1580 -45.883 -8.909 -6.009 1.00 60.93 N ATOM 208 CD2 HIS B1580 -45.670 -8.374 -3.901 1.00 63.69 C ATOM 209 CE1 HIS B1580 -46.491 -9.847 -5.306 1.00 67.30 C ATOM 210 NE2 HIS B1580 -46.375 -9.546 -4.024 1.00 69.40 N ATOM 211 H HIS B1580 -43.375 -8.792 -7.636 1.00 0.00 H ATOM 212 N ILE B1581 -41.842 -7.084 -4.416 1.00 49.27 N ATOM 213 CA ILE B1581 -40.792 -7.544 -3.524 1.00 50.24 C ATOM 214 C ILE B1581 -41.340 -7.524 -2.113 1.00 48.98 C ATOM 215 O ILE B1581 -42.138 -6.647 -1.774 1.00 53.49 O ATOM 216 CB ILE B1581 -39.537 -6.647 -3.624 1.00 49.40 C ATOM 217 CG1 ILE B1581 -38.900 -6.731 -5.013 1.00 46.72 C ATOM 218 CG2 ILE B1581 -38.531 -6.986 -2.550 1.00 45.55 C ATOM 219 CD1 ILE B1581 -37.630 -5.893 -5.105 1.00 44.78 C ATOM 220 H ILE B1581 -42.252 -6.144 -4.243 1.00 0.00 H ATOM 221 N LYS B1582 -40.886 -8.478 -1.276 1.00 51.39 N ATOM 222 CA LYS B1582 -41.268 -8.558 0.136 1.00 55.77 C ATOM 223 C LYS B1582 -40.050 -8.493 1.050 1.00 56.68 C ATOM 224 O LYS B1582 -39.031 -9.139 0.785 1.00 56.18 O ATOM 225 CB LYS B1582 -42.004 -9.865 0.428 1.00 57.77 C ATOM 226 CG LYS B1582 -43.433 -9.911 -0.089 1.00 58.88 C ATOM 227 CD LYS B1582 -44.086 -11.246 0.217 1.00 63.76 C ATOM 228 CE LYS B1582 -45.539 -11.070 0.603 1.00 69.94 C ATOM 229 NZ LYS B1582 -46.306 -12.344 0.482 1.00 75.35 N ATOM 230 HZ1 LYS B1582 -46.268 -12.678 -0.502 1.00 0.00 H ATOM 231 HZ2 LYS B1582 -45.887 -13.060 1.109 1.00 0.00 H ATOM 232 HZ3 LYS B1582 -47.296 -12.179 0.756 1.00 0.00 H ATOM 233 H LYS B1582 -40.231 -9.194 -1.652 1.00 0.00 H ATOM 234 N ASP B1583 -40.188 -7.750 2.155 1.00 60.25 N ATOM 235 CA ASP B1583 -39.262 -7.798 3.305 1.00 57.08 C ATOM 236 C ASP B1583 -37.832 -7.371 2.978 1.00 62.12 C ATOM 237 O ASP B1583 -36.872 -8.011 3.405 1.00 61.97 O ATOM 238 CB ASP B1583 -39.242 -9.196 3.922 1.00 57.12 C ATOM 239 CG ASP B1583 -40.630 -9.738 4.185 1.00 64.88 C ATOM 240 OD1 ASP B1583 -41.498 -8.973 4.678 1.00 59.50 O ATOM 241 OD2 ASP B1583 -40.836 -10.940 3.883 1.00 63.32 O ATOM 242 H ASP B1583 -40.997 -7.099 2.207 1.00 0.00 H ATOM 243 N LEU B1584 -37.669 -6.284 2.224 1.00 65.71 N ATOM 244 CA LEU B1584 -36.335 -5.706 2.080 1.00 60.97 C ATOM 245 C LEU B1584 -35.887 -5.201 3.445 1.00 58.38 C ATOM 246 O LEU B1584 -36.716 -4.817 4.263 1.00 57.78 O ATOM 247 CB LEU B1584 -36.340 -4.578 1.038 1.00 52.94 C ATOM 248 CG LEU B1584 -36.576 -4.933 -0.439 1.00 50.52 C ATOM 249 CD1 LEU B1584 -36.815 -3.673 -1.259 1.00 48.64 C ATOM 250 CD2 LEU B1584 -35.454 -5.743 -1.058 1.00 43.97 C ATOM 251 H LEU B1584 -38.483 -5.852 1.743 1.00 0.00 H ATOM 252 N VAL B1585 -34.577 -5.261 3.722 1.00 63.50 N ATOM 253 CA VAL B1585 -34.040 -4.860 5.021 1.00 55.50 C ATOM 254 C VAL B1585 -33.007 -3.754 4.848 1.00 52.89 C ATOM 255 O VAL B1585 -32.242 -3.755 3.880 1.00 57.85 O ATOM 256 CB VAL B1585 -33.442 -6.061 5.792 1.00 57.24 C ATOM 257 CG1 VAL B1585 -34.526 -6.853 6.388 1.00 57.00 C ATOM 258 CG2 VAL B1585 -32.635 -6.958 4.906 1.00 56.39 C ATOM 259 H VAL B1585 -33.922 -5.603 2.990 1.00 0.00 H ATOM 260 N THR B1586 -32.962 -2.830 5.813 1.00 65.72 N ATOM 261 CA THR B1586 -31.992 -1.738 5.840 1.00 70.61 C ATOM 262 C THR B1586 -31.310 -1.644 7.199 1.00 72.78 C ATOM 263 O THR B1586 -31.925 -1.902 8.241 1.00 71.06 O ATOM 264 CB THR B1586 -32.625 -0.368 5.527 1.00 69.83 C ATOM 265 OG1 THR B1586 -33.723 -0.122 6.411 1.00 70.45 O ATOM 266 CG2 THR B1586 -33.095 -0.312 4.110 1.00 61.40 C ATOM 267 HG1 THR B1586 -34.122 0.759 6.202 1.00 0.00 H ATOM 268 H THR B1586 -33.655 -2.892 6.586 1.00 0.00 H ATOM 269 N GLU B1587 -30.041 -1.211 7.161 1.00 81.38 N ATOM 270 CA GLU B1587 -29.177 -1.171 8.343 1.00 75.72 C ATOM 271 C GLU B1587 -29.651 -0.148 9.383 1.00 76.89 C ATOM 272 O GLU B1587 -29.655 -0.432 10.586 1.00 80.27 O ATOM 273 CB GLU B1587 -27.746 -0.842 7.906 1.00 73.74 C ATOM 274 CG GLU B1587 -27.328 -1.533 6.615 1.00 77.90 C ATOM 275 CD GLU B1587 -26.226 -2.565 6.811 1.00 79.59 C ATOM 276 OE1 GLU B1587 -26.036 -3.025 7.954 1.00 79.75 O ATOM 277 OE2 GLU B1587 -25.570 -2.908 5.809 1.00 80.21 O ATOM 278 H GLU B1587 -29.653 -0.889 6.251 1.00 0.00 H ATOM 279 N ASP B1588 -30.042 1.053 8.944 1.00 78.66 N ATOM 280 CA ASP B1588 -30.461 2.126 9.845 1.00 75.78 C ATOM 281 C ASP B1588 -31.928 2.059 10.249 1.00 74.71 C ATOM 282 O ASP B1588 -32.379 2.929 10.999 1.00 80.22 O ATOM 283 CB ASP B1588 -30.168 3.493 9.205 1.00 83.21 C ATOM 284 CG ASP B1588 -30.878 3.698 7.853 1.00 88.03 C ATOM 285 OD1 ASP B1588 -31.941 3.086 7.603 1.00 86.01 O ATOM 286 OD2 ASP B1588 -30.359 4.484 7.028 1.00 93.03 O ATOM 287 H ASP B1588 -30.048 1.231 7.919 1.00 0.00 H ATOM 288 N GLY B1589 -32.702 1.130 9.690 1.00 73.62 N ATOM 289 CA GLY B1589 -34.107 0.982 10.007 1.00 67.71 C ATOM 290 C GLY B1589 -35.034 1.911 9.250 1.00 75.21 C ATOM 291 O GLY B1589 -36.258 1.786 9.390 1.00 73.47 O ATOM 292 H GLY B1589 -32.278 0.482 8.995 1.00 0.00 H ATOM 293 N ALA B1590 -34.494 2.842 8.459 1.00 78.87 N ATOM 294 CA ALA B1590 -35.314 3.730 7.646 1.00 72.09 C ATOM 295 C ALA B1590 -35.803 3.016 6.394 1.00 65.29 C ATOM 296 O ALA B1590 -35.133 2.135 5.858 1.00 66.26 O ATOM 297 CB ALA B1590 -34.537 4.990 7.270 1.00 65.28 C ATOM 298 H ALA B1590 -33.459 2.936 8.423 1.00 0.00 H ATOM 299 N ASP B1591 -36.971 3.427 5.917 1.00 67.29 N ATOM 300 CA ASP B1591 -37.522 2.845 4.701 1.00 67.51 C ATOM 301 C ASP B1591 -36.691 3.248 3.483 1.00 64.59 C ATOM 302 O ASP B1591 -36.262 4.400 3.376 1.00 63.35 O ATOM 303 CB ASP B1591 -38.972 3.284 4.509 1.00 67.17 C ATOM 304 CG ASP B1591 -39.949 2.436 5.315 1.00 74.43 C ATOM 305 OD1 ASP B1591 -39.505 1.733 6.252 1.00 75.77 O ATOM 306 OD2 ASP B1591 -41.161 2.474 5.008 1.00 78.64 O ATOM 307 H ASP B1591 -37.498 4.172 6.416 1.00 0.00 H ATOM 308 N PRO B1592 -36.446 2.316 2.550 1.00 62.28 N ATOM 309 CA PRO B1592 -35.647 2.642 1.359 1.00 61.68 C ATOM 310 C PRO B1592 -36.521 3.048 0.184 1.00 55.34 C ATOM 311 O PRO B1592 -37.749 3.030 0.294 1.00 54.39 O ATOM 312 CB PRO B1592 -34.911 1.327 1.076 1.00 59.85 C ATOM 313 CG PRO B1592 -35.929 0.257 1.501 1.00 58.60 C ATOM 314 CD PRO B1592 -36.827 0.892 2.578 1.00 60.44 C ATOM 315 N ASN B1593 -35.903 3.323 -0.966 1.00 56.40 N ATOM 316 CA ASN B1593 -36.607 3.723 -2.189 1.00 50.71 C ATOM 317 C ASN B1593 -36.159 2.775 -3.292 1.00 49.29 C ATOM 318 O ASN B1593 -35.402 3.161 -4.186 1.00 53.07 O ATOM 319 CB ASN B1593 -36.289 5.169 -2.590 1.00 56.87 C ATOM 320 CG ASN B1593 -36.456 6.171 -1.454 1.00 54.82 C ATOM 321 OD1 ASN B1593 -37.564 6.600 -1.143 1.00 58.93 O ATOM 322 ND2 ASN B1593 -35.340 6.584 -0.866 1.00 54.67 N ATOM 323 HD22 ASN B1593 -34.422 6.194 -1.161 1.00 0.00 H ATOM 324 HD21 ASN B1593 -35.384 7.298 -0.111 1.00 0.00 H ATOM 325 H ASN B1593 -34.866 3.250 -0.997 1.00 0.00 H ATOM 326 N PRO B1594 -36.597 1.511 -3.233 1.00 51.01 N ATOM 327 CA PRO B1594 -35.999 0.470 -4.086 1.00 42.51 C ATOM 328 C PRO B1594 -36.238 0.635 -5.583 1.00 44.84 C ATOM 329 O PRO B1594 -37.291 1.093 -6.030 1.00 43.49 O ATOM 330 CB PRO B1594 -36.620 -0.822 -3.553 1.00 49.72 C ATOM 331 CG PRO B1594 -37.861 -0.379 -2.784 1.00 48.68 C ATOM 332 CD PRO B1594 -37.591 0.972 -2.284 1.00 48.88 C ATOM 333 N TYR B1595 -35.240 0.202 -6.355 1.00 45.31 N ATOM 334 CA TYR B1595 -35.379 -0.073 -7.776 1.00 41.18 C ATOM 335 C TYR B1595 -34.604 -1.337 -8.097 1.00 42.52 C ATOM 336 O TYR B1595 -33.650 -1.709 -7.403 1.00 42.12 O ATOM 337 CB TYR B1595 -34.896 1.073 -8.707 1.00 43.07 C ATOM 338 CG TYR B1595 -33.418 1.442 -8.673 1.00 40.25 C ATOM 339 CD1 TYR B1595 -32.933 2.315 -7.717 1.00 45.95 C ATOM 340 CD2 TYR B1595 -32.527 0.966 -9.635 1.00 42.96 C ATOM 341 CE1 TYR B1595 -31.597 2.692 -7.689 1.00 46.39 C ATOM 342 CE2 TYR B1595 -31.179 1.336 -9.616 1.00 44.68 C ATOM 343 CZ TYR B1595 -30.728 2.206 -8.632 1.00 45.38 C ATOM 344 OH TYR B1595 -29.415 2.601 -8.566 1.00 43.73 O ATOM 345 HH TYR B1595 -29.168 3.064 -9.406 1.00 0.00 H ATOM 346 H TYR B1595 -34.309 0.053 -5.915 1.00 0.00 H ATOM 347 N VAL B1596 -35.059 -2.012 -9.138 1.00 41.22 N ATOM 348 CA VAL B1596 -34.493 -3.274 -9.576 1.00 44.85 C ATOM 349 C VAL B1596 -33.699 -3.007 -10.844 1.00 41.88 C ATOM 350 O VAL B1596 -34.159 -2.286 -11.731 1.00 44.97 O ATOM 351 CB VAL B1596 -35.611 -4.317 -9.793 1.00 40.10 C ATOM 352 CG1 VAL B1596 -35.054 -5.626 -10.340 1.00 41.41 C ATOM 353 CG2 VAL B1596 -36.358 -4.542 -8.487 1.00 39.93 C ATOM 354 H VAL B1596 -35.862 -1.619 -9.669 1.00 0.00 H ATOM 355 N LYS B1597 -32.516 -3.602 -10.925 1.00 36.17 N ATOM 356 CA LYS B1597 -31.562 -3.399 -11.998 1.00 37.35 C ATOM 357 C LYS B1597 -31.043 -4.764 -12.403 1.00 41.69 C ATOM 358 O LYS B1597 -30.629 -5.545 -11.543 1.00 39.84 O ATOM 359 CB LYS B1597 -30.391 -2.522 -11.559 1.00 41.67 C ATOM 360 CG LYS B1597 -29.303 -2.421 -12.614 1.00 43.49 C ATOM 361 CD LYS B1597 -28.393 -1.244 -12.366 1.00 44.93 C ATOM 362 CE LYS B1597 -27.566 -1.439 -11.116 1.00 42.40 C ATOM 363 NZ LYS B1597 -26.886 -0.162 -10.775 1.00 41.12 N ATOM 364 HZ1 LYS B1597 -26.268 0.121 -11.562 1.00 0.00 H ATOM 365 HZ2 LYS B1597 -27.600 0.576 -10.610 1.00 0.00 H ATOM 366 HZ3 LYS B1597 -26.316 -0.293 -9.915 1.00 0.00 H ATOM 367 H LYS B1597 -32.254 -4.261 -10.164 1.00 0.00 H ATOM 368 N THR B1598 -31.082 -5.061 -13.695 1.00 43.80 N ATOM 369 CA THR B1598 -30.621 -6.344 -14.187 1.00 46.25 C ATOM 370 C THR B1598 -29.442 -6.163 -15.123 1.00 46.44 C ATOM 371 O THR B1598 -29.338 -5.154 -15.822 1.00 47.11 O ATOM 372 CB THR B1598 -31.730 -7.102 -14.916 1.00 48.19 C ATOM 373 OG1 THR B1598 -32.247 -6.292 -15.974 1.00 45.64 O ATOM 374 CG2 THR B1598 -32.839 -7.466 -13.940 1.00 43.84 C ATOM 375 HG1 THR B1598 -31.519 -6.079 -16.611 1.00 0.00 H ATOM 376 H THR B1598 -31.451 -4.359 -14.368 1.00 0.00 H ATOM 377 N TYR B1599 -28.574 -7.175 -15.135 1.00 48.87 N ATOM 378 CA TYR B1599 -27.517 -7.336 -16.123 1.00 50.45 C ATOM 379 C TYR B1599 -27.496 -8.781 -16.620 1.00 49.41 C ATOM 380 O TYR B1599 -27.735 -9.713 -15.848 1.00 49.80 O ATOM 381 CB TYR B1599 -26.156 -6.963 -15.521 1.00 45.47 C ATOM 382 CG TYR B1599 -25.865 -5.476 -15.456 1.00 46.21 C ATOM 383 CD1 TYR B1599 -25.309 -4.797 -16.546 1.00 48.25 C ATOM 384 CD2 TYR B1599 -26.115 -4.754 -14.302 1.00 40.47 C ATOM 385 CE1 TYR B1599 -25.026 -3.427 -16.478 1.00 49.36 C ATOM 386 CE2 TYR B1599 -25.839 -3.395 -14.223 1.00 42.86 C ATOM 387 CZ TYR B1599 -25.296 -2.733 -15.311 1.00 51.63 C ATOM 388 OH TYR B1599 -25.032 -1.385 -15.217 1.00 50.56 O ATOM 389 HH TYR B1599 -24.385 -1.227 -14.485 1.00 0.00 H ATOM 390 H TYR B1599 -28.657 -7.896 -14.390 1.00 0.00 H ATOM 391 N LEU B1600 -27.222 -8.966 -17.913 1.00 52.13 N ATOM 392 CA LEU B1600 -27.045 -10.292 -18.517 1.00 53.24 C ATOM 393 C LEU B1600 -25.555 -10.639 -18.543 1.00 53.36 C ATOM 394 O LEU B1600 -24.842 -10.311 -19.491 1.00 62.14 O ATOM 395 CB LEU B1600 -27.627 -10.333 -19.928 1.00 52.27 C ATOM 396 CG LEU B1600 -29.139 -10.401 -20.158 1.00 53.41 C ATOM 397 CD1 LEU B1600 -29.392 -10.760 -21.622 1.00 55.76 C ATOM 398 CD2 LEU B1600 -29.812 -11.400 -19.244 1.00 51.44 C ATOM 399 H LEU B1600 -27.129 -8.129 -18.523 1.00 0.00 H ATOM 400 N LEU B1601 -25.081 -11.314 -17.506 1.00 52.48 N ATOM 401 CA LEU B1601 -23.677 -11.730 -17.435 1.00 54.67 C ATOM 402 C LEU B1601 -23.361 -12.881 -18.384 1.00 60.77 C ATOM 403 O LEU B1601 -24.243 -13.676 -18.687 1.00 62.02 O ATOM 404 CB LEU B1601 -23.317 -12.138 -16.017 1.00 55.40 C ATOM 405 CG LEU B1601 -23.714 -11.166 -14.919 1.00 50.48 C ATOM 406 CD1 LEU B1601 -23.217 -11.713 -13.611 1.00 41.05 C ATOM 407 CD2 LEU B1601 -23.148 -9.788 -15.187 1.00 53.13 C ATOM 408 H LEU B1601 -25.721 -11.555 -16.723 1.00 0.00 H ATOM 409 N PRO B1602 -22.098 -12.990 -18.855 1.00 64.75 N ATOM 410 CA PRO B1602 -20.948 -12.090 -18.680 1.00 61.53 C ATOM 411 C PRO B1602 -21.166 -10.728 -19.310 1.00 57.23 C ATOM 412 O PRO B1602 -21.769 -10.638 -20.385 1.00 58.52 O ATOM 413 CB PRO B1602 -19.794 -12.822 -19.384 1.00 62.12 C ATOM 414 CG PRO B1602 -20.325 -14.150 -19.786 1.00 61.77 C ATOM 415 CD PRO B1602 -21.802 -14.029 -19.857 1.00 62.47 C ATOM 416 N ASP B1603 -20.625 -9.694 -18.674 1.00 59.06 N ATOM 417 CA ASP B1603 -20.846 -8.322 -19.100 1.00 61.79 C ATOM 418 C ASP B1603 -19.847 -7.367 -18.459 1.00 69.59 C ATOM 419 O ASP B1603 -20.210 -6.576 -17.582 1.00 71.49 O ATOM 420 CB ASP B1603 -22.270 -7.908 -18.744 1.00 61.08 C ATOM 421 CG ASP B1603 -22.835 -6.946 -19.723 1.00 63.58 C ATOM 422 OD1 ASP B1603 -22.289 -6.868 -20.843 1.00 67.92 O ATOM 423 OD2 ASP B1603 -23.820 -6.267 -19.385 1.00 66.08 O ATOM 424 H ASP B1603 -20.024 -9.872 -17.844 1.00 0.00 H ATOM 425 N ASN B1604 -18.581 -7.441 -18.856 1.00 70.02 N ATOM 426 CA ASN B1604 -17.588 -6.596 -18.199 1.00 77.74 C ATOM 427 C ASN B1604 -17.733 -5.119 -18.538 1.00 73.25 C ATOM 428 O ASN B1604 -17.259 -4.283 -17.769 1.00 77.11 O ATOM 429 CB ASN B1604 -16.184 -7.077 -18.539 1.00 80.46 C ATOM 430 CG ASN B1604 -15.868 -8.397 -17.882 1.00 84.55 C ATOM 431 OD1 ASN B1604 -16.363 -8.687 -16.791 1.00 76.04 O ATOM 432 ND2 ASN B1604 -15.063 -9.218 -18.549 1.00 88.76 N ATOM 433 HD22 ASN B1604 -14.669 -8.928 -19.467 1.00 0.00 H ATOM 434 HD21 ASN B1604 -14.827 -10.150 -18.153 1.00 0.00 H ATOM 435 H ASN B1604 -18.303 -8.089 -19.621 1.00 0.00 H ATOM 436 N HIS B1605 -18.357 -4.772 -19.660 1.00 72.66 N ATOM 437 CA HIS B1605 -18.431 -3.379 -20.105 1.00 73.93 C ATOM 438 C HIS B1605 -19.796 -2.752 -19.849 1.00 68.43 C ATOM 439 O HIS B1605 -20.241 -1.898 -20.616 1.00 66.41 O ATOM 440 CB HIS B1605 -18.060 -3.281 -21.580 1.00 72.72 C ATOM 441 CG HIS B1605 -16.592 -3.423 -21.836 1.00 82.15 C ATOM 442 ND1 HIS B1605 -16.070 -4.389 -22.668 1.00 86.78 N ATOM 443 CD2 HIS B1605 -15.533 -2.728 -21.356 1.00 83.75 C ATOM 444 CE1 HIS B1605 -14.754 -4.281 -22.694 1.00 89.55 C ATOM 445 NE2 HIS B1605 -14.402 -3.280 -21.907 1.00 88.89 N ATOM 446 H HIS B1605 -18.805 -5.511 -20.238 1.00 0.00 H ATOM 447 N LYS B1606 -20.450 -3.123 -18.742 1.00 70.99 N ATOM 448 CA LYS B1606 -21.879 -2.886 -18.554 1.00 65.18 C ATOM 449 C LYS B1606 -22.523 -3.350 -19.844 1.00 66.84 C ATOM 450 O LYS B1606 -22.148 -4.417 -20.315 1.00 72.07 O ATOM 451 CB LYS B1606 -22.197 -1.424 -18.233 1.00 65.37 C ATOM 452 CG LYS B1606 -22.022 -1.053 -16.737 1.00 63.23 C ATOM 453 CD LYS B1606 -21.166 -2.033 -15.965 1.00 58.44 C ATOM 454 CE LYS B1606 -21.235 -1.788 -14.462 1.00 63.78 C ATOM 455 NZ LYS B1606 -20.926 -0.392 -14.047 1.00 63.63 N ATOM 456 HZ1 LYS B1606 -19.961 -0.147 -14.349 1.00 0.00 H ATOM 457 HZ2 LYS B1606 -21.605 0.259 -14.491 1.00 0.00 H ATOM 458 HZ3 LYS B1606 -20.996 -0.316 -13.012 1.00 0.00 H ATOM 459 H LYS B1606 -19.919 -3.599 -17.985 1.00 0.00 H ATOM 460 N THR B1607 -23.364 -2.501 -20.415 1.00 60.49 N ATOM 461 CA THR B1607 -23.886 -2.754 -21.736 1.00 60.70 C ATOM 462 C THR B1607 -25.104 -3.628 -21.908 1.00 60.96 C ATOM 463 O THR B1607 -25.520 -3.885 -23.012 1.00 59.62 O ATOM 464 CB THR B1607 -22.839 -3.545 -22.495 1.00 66.50 C ATOM 465 OG1 THR B1607 -22.956 -3.296 -23.883 1.00 77.12 O ATOM 466 CG2 THR B1607 -23.062 -4.992 -22.246 1.00 64.03 C ATOM 467 HG1 THR B1607 -23.857 -3.568 -24.191 1.00 0.00 H ATOM 468 H THR B1607 -23.652 -1.642 -19.905 1.00 0.00 H ATOM 469 N SER B1608 -25.795 -3.929 -20.858 1.00 59.87 N ATOM 470 CA SER B1608 -26.973 -4.797 -20.926 1.00 53.84 C ATOM 471 C SER B1608 -27.756 -4.454 -19.656 1.00 56.23 C ATOM 472 O SER B1608 -28.411 -5.310 -19.052 1.00 52.21 O ATOM 473 CB SER B1608 -26.842 -6.307 -21.083 1.00 52.63 C ATOM 474 OG SER B1608 -26.201 -6.864 -19.941 1.00 55.00 O ATOM 475 HG SER B1608 -25.299 -6.468 -19.844 1.00 0.00 H ATOM 476 H SER B1608 -25.506 -3.543 -19.937 1.00 0.00 H ATOM 477 N LYS B1609 -27.650 -3.211 -19.193 1.00 56.28 N ATOM 478 CA LYS B1609 -28.426 -2.773 -18.041 1.00 44.72 C ATOM 479 C LYS B1609 -29.894 -2.592 -18.404 1.00 44.33 C ATOM 480 O LYS B1609 -30.232 -2.175 -19.512 1.00 50.38 O ATOM 481 CB LYS B1609 -27.863 -1.459 -17.492 1.00 43.50 C ATOM 482 CG LYS B1609 -28.468 -0.988 -16.180 1.00 44.86 C ATOM 483 CD LYS B1609 -27.793 0.268 -15.728 1.00 45.72 C ATOM 484 CE LYS B1609 -28.635 1.470 -16.019 1.00 48.82 C ATOM 485 NZ LYS B1609 -27.842 2.709 -15.819 1.00 49.92 N ATOM 486 HZ1 LYS B1609 -27.512 2.753 -14.834 1.00 0.00 H ATOM 487 HZ2 LYS B1609 -27.023 2.702 -16.460 1.00 0.00 H ATOM 488 HZ3 LYS B1609 -28.437 3.537 -16.024 1.00 0.00 H ATOM 489 H LYS B1609 -27.004 -2.543 -19.660 1.00 0.00 H ATOM 490 N ARG B1610 -30.767 -2.898 -17.443 1.00 46.03 N ATOM 491 CA ARG B1610 -32.173 -2.508 -17.449 1.00 44.30 C ATOM 492 C ARG B1610 -32.549 -2.187 -16.007 1.00 45.57 C ATOM 493 O ARG B1610 -31.964 -2.733 -15.071 1.00 47.31 O ATOM 494 CB ARG B1610 -33.093 -3.605 -18.011 1.00 42.01 C ATOM 495 CG ARG B1610 -32.676 -4.169 -19.380 1.00 44.95 C ATOM 496 CD ARG B1610 -33.101 -3.259 -20.538 1.00 46.66 C ATOM 497 NE ARG B1610 -32.897 -3.867 -21.849 1.00 46.40 N ATOM 498 CZ ARG B1610 -31.714 -3.941 -22.466 1.00 49.31 C ATOM 499 NH1 ARG B1610 -30.615 -3.471 -21.881 1.00 45.25 N ATOM 500 NH2 ARG B1610 -31.627 -4.508 -23.661 1.00 42.23 N ATOM 501 HE ARG B1610 -33.725 -4.268 -22.334 1.00 0.00 H ATOM 502 HH12 ARG B1610 -29.699 -3.533 -22.369 1.00 0.00 H ATOM 503 HH11 ARG B1610 -30.672 -3.042 -20.936 1.00 0.00 H ATOM 504 HH22 ARG B1610 -30.707 -4.567 -24.143 1.00 0.00 H ATOM 505 HH21 ARG B1610 -32.478 -4.894 -24.117 1.00 0.00 H ATOM 506 H ARG B1610 -30.422 -3.453 -16.634 1.00 0.00 H ATOM 507 N LYS B1611 -33.511 -1.281 -15.836 1.00 44.37 N ATOM 508 CA LYS B1611 -33.897 -0.745 -14.539 1.00 41.13 C ATOM 509 C LYS B1611 -35.394 -0.501 -14.519 1.00 44.04 C ATOM 510 O LYS B1611 -35.995 -0.165 -15.537 1.00 47.61 O ATOM 511 CB LYS B1611 -33.221 0.595 -14.217 1.00 45.49 C ATOM 512 CG LYS B1611 -31.735 0.550 -14.102 1.00 51.37 C ATOM 513 CD LYS B1611 -31.208 1.795 -13.420 1.00 52.32 C ATOM 514 CE LYS B1611 -31.684 3.074 -14.080 1.00 49.64 C ATOM 515 NZ LYS B1611 -30.923 4.221 -13.452 1.00 52.34 N ATOM 516 HZ1 LYS B1611 -31.116 4.245 -12.430 1.00 0.00 H ATOM 517 HZ2 LYS B1611 -29.904 4.087 -13.611 1.00 0.00 H ATOM 518 HZ3 LYS B1611 -31.228 5.116 -13.885 1.00 0.00 H ATOM 519 H LYS B1611 -34.015 -0.937 -16.678 1.00 0.00 H ATOM 520 N THR B1612 -35.984 -0.676 -13.349 1.00 40.10 N ATOM 521 CA THR B1612 -37.336 -0.240 -13.085 1.00 44.50 C ATOM 522 C THR B1612 -37.346 1.233 -12.667 1.00 46.09 C ATOM 523 O THR B1612 -36.303 1.871 -12.464 1.00 45.74 O ATOM 524 CB THR B1612 -37.970 -1.099 -11.990 1.00 47.10 C ATOM 525 OG1 THR B1612 -37.305 -0.849 -10.747 1.00 40.08 O ATOM 526 CG2 THR B1612 -37.845 -2.572 -12.329 1.00 43.37 C ATOM 527 HG1 THR B1612 -37.396 0.108 -10.512 1.00 0.00 H ATOM 528 H THR B1612 -35.454 -1.146 -12.588 1.00 0.00 H ATOM 529 N LYS B1613 -38.551 1.776 -12.553 1.00 41.21 N ATOM 530 CA LYS B1613 -38.759 3.046 -11.874 1.00 43.91 C ATOM 531 C LYS B1613 -38.560 2.885 -10.361 1.00 46.99 C ATOM 532 O LYS B1613 -38.529 1.775 -9.822 1.00 47.54 O ATOM 533 CB LYS B1613 -40.146 3.598 -12.187 1.00 49.86 C ATOM 534 CG LYS B1613 -40.465 3.599 -13.685 1.00 59.15 C ATOM 535 CD LYS B1613 -41.656 4.497 -14.013 1.00 66.81 C ATOM 536 CE LYS B1613 -42.285 4.120 -15.340 1.00 62.06 C ATOM 537 NZ LYS B1613 -41.511 4.661 -16.487 1.00 61.99 N ATOM 538 HZ1 LYS B1613 -41.477 5.698 -16.422 1.00 0.00 H ATOM 539 HZ2 LYS B1613 -40.544 4.279 -16.462 1.00 0.00 H ATOM 540 HZ3 LYS B1613 -41.972 4.383 -17.377 1.00 0.00 H ATOM 541 H LYS B1613 -39.370 1.280 -12.960 1.00 0.00 H ATOM 542 N ILE B1614 -38.281 3.999 -9.690 1.00 49.68 N ATOM 543 CA ILE B1614 -38.221 3.977 -8.232 1.00 49.37 C ATOM 544 C ILE B1614 -39.612 3.786 -7.629 1.00 50.13 C ATOM 545 O ILE B1614 -40.622 4.302 -8.136 1.00 52.68 O ATOM 546 CB ILE B1614 -37.548 5.257 -7.719 1.00 49.05 C ATOM 547 CG1 ILE B1614 -36.156 5.345 -8.347 1.00 53.80 C ATOM 548 CG2 ILE B1614 -37.448 5.220 -6.220 1.00 54.15 C ATOM 549 CD1 ILE B1614 -35.592 6.730 -8.421 1.00 57.31 C ATOM 550 H ILE B1614 -38.106 4.886 -10.204 1.00 0.00 H ATOM 551 N SER B1615 -39.671 3.018 -6.543 1.00 49.27 N ATOM 552 CA SER B1615 -40.853 2.899 -5.692 1.00 51.55 C ATOM 553 C SER B1615 -40.449 3.416 -4.318 1.00 52.16 C ATOM 554 O SER B1615 -39.568 2.831 -3.677 1.00 54.02 O ATOM 555 CB SER B1615 -41.334 1.451 -5.638 1.00 49.39 C ATOM 556 OG SER B1615 -42.354 1.314 -4.676 1.00 59.65 O ATOM 557 HG SER B1615 -42.657 0.372 -4.650 1.00 0.00 H ATOM 558 H SER B1615 -38.825 2.470 -6.285 1.00 0.00 H ATOM 559 N ARG B1616 -41.023 4.545 -3.891 1.00 50.69 N ATOM 560 CA ARG B1616 -40.379 5.286 -2.811 1.00 61.69 C ATOM 561 C ARG B1616 -40.885 4.871 -1.430 1.00 56.16 C ATOM 562 O ARG B1616 -42.018 4.413 -1.268 1.00 54.99 O ATOM 563 CB ARG B1616 -40.516 6.792 -3.035 1.00 66.21 C ATOM 564 CG ARG B1616 -40.512 7.165 -4.530 1.00 74.73 C ATOM 565 CD ARG B1616 -39.718 8.460 -4.819 1.00 83.96 C ATOM 566 NE ARG B1616 -38.430 8.413 -4.141 1.00 86.50 N ATOM 567 CZ ARG B1616 -37.624 9.458 -3.996 1.00 96.19 C ATOM 568 NH1 ARG B1616 -37.963 10.638 -4.509 1.00118.28 N ATOM 569 NH2 ARG B1616 -36.464 9.325 -3.360 1.00 89.37 N ATOM 570 HE ARG B1616 -38.122 7.502 -3.745 1.00 0.00 H ATOM 571 HH12 ARG B1616 -37.331 11.456 -4.395 1.00 0.00 H ATOM 572 HH11 ARG B1616 -38.860 10.743 -5.024 1.00 0.00 H ATOM 573 HH22 ARG B1616 -35.835 10.146 -3.248 1.00 0.00 H ATOM 574 HH21 ARG B1616 -36.186 8.400 -2.974 1.00 0.00 H ATOM 575 H ARG B1616 -41.907 4.887 -4.318 1.00 0.00 H ATOM 576 N LYS B1617 -39.987 4.993 -0.442 1.00 56.02 N ATOM 577 CA LYS B1617 -40.197 4.705 0.984 1.00 61.14 C ATOM 578 C LYS B1617 -41.109 3.514 1.233 1.00 57.80 C ATOM 579 O LYS B1617 -42.258 3.676 1.660 1.00 59.73 O ATOM 580 CB LYS B1617 -40.757 5.909 1.739 1.00 63.29 C ATOM 581 CG LYS B1617 -40.009 7.186 1.539 1.00 64.49 C ATOM 582 CD LYS B1617 -40.967 8.212 1.036 1.00 72.01 C ATOM 583 CE LYS B1617 -40.354 9.572 1.041 1.00 84.27 C ATOM 584 NZ LYS B1617 -41.016 10.384 0.002 1.00 93.97 N ATOM 585 HZ1 LYS B1617 -40.880 9.935 -0.926 1.00 0.00 H ATOM 586 HZ2 LYS B1617 -42.033 10.450 0.211 1.00 0.00 H ATOM 587 HZ3 LYS B1617 -40.600 11.337 -0.009 1.00 0.00 H ATOM 588 H LYS B1617 -39.040 5.327 -0.714 1.00 0.00 H ATOM 589 N THR B1618 -40.610 2.324 0.936 1.00 56.31 N ATOM 590 CA THR B1618 -41.302 1.082 1.225 1.00 54.01 C ATOM 591 C THR B1618 -40.257 -0.021 1.221 1.00 58.58 C ATOM 592 O THR B1618 -39.234 0.081 0.538 1.00 56.50 O ATOM 593 CB THR B1618 -42.412 0.795 0.206 1.00 52.47 C ATOM 594 OG1 THR B1618 -42.835 -0.563 0.330 1.00 56.01 O ATOM 595 CG2 THR B1618 -41.917 1.036 -1.208 1.00 54.43 C ATOM 596 HG1 THR B1618 -43.551 -0.746 -0.329 1.00 0.00 H ATOM 597 H THR B1618 -39.679 2.278 0.474 1.00 0.00 H ATOM 598 N ARG B1619 -40.491 -1.046 2.033 1.00 59.12 N ATOM 599 CA ARG B1619 -39.685 -2.253 1.966 1.00 56.22 C ATOM 600 C ARG B1619 -40.413 -3.372 1.243 1.00 48.03 C ATOM 601 O ARG B1619 -39.913 -4.493 1.192 1.00 45.54 O ATOM 602 CB ARG B1619 -39.232 -2.661 3.386 1.00 60.33 C ATOM 603 CG ARG B1619 -39.095 -1.438 4.312 1.00 64.56 C ATOM 604 CD ARG B1619 -38.552 -1.724 5.746 1.00 64.69 C ATOM 605 NE ARG B1619 -38.936 -3.029 6.251 1.00 64.10 N ATOM 606 CZ ARG B1619 -38.075 -4.016 6.472 1.00 63.36 C ATOM 607 NH1 ARG B1619 -36.773 -3.815 6.304 1.00 62.35 N ATOM 608 NH2 ARG B1619 -38.500 -5.196 6.905 1.00 63.13 N ATOM 609 HE ARG B1619 -39.942 -3.201 6.451 1.00 0.00 H ATOM 610 HH12 ARG B1619 -36.101 -4.589 6.478 1.00 0.00 H ATOM 611 HH11 ARG B1619 -36.426 -2.883 5.999 1.00 0.00 H ATOM 612 HH22 ARG B1619 -37.819 -5.963 7.075 1.00 0.00 H ATOM 613 HH21 ARG B1619 -39.514 -5.354 7.074 1.00 0.00 H ATOM 614 H ARG B1619 -41.263 -0.984 2.727 1.00 0.00 H ATOM 615 N ASN B1620 -41.582 -3.082 0.684 1.00 48.13 N ATOM 616 CA ASN B1620 -42.328 -4.021 -0.146 1.00 48.20 C ATOM 617 C ASN B1620 -42.801 -3.327 -1.420 1.00 52.35 C ATOM 618 O ASN B1620 -44.004 -3.138 -1.628 1.00 56.92 O ATOM 619 CB ASN B1620 -43.511 -4.587 0.644 1.00 51.77 C ATOM 620 CG ASN B1620 -43.078 -5.232 1.965 1.00 52.29 C ATOM 621 OD1 ASN B1620 -42.679 -6.398 1.998 1.00 58.39 O ATOM 622 ND2 ASN B1620 -43.150 -4.473 3.049 1.00 43.85 N ATOM 623 HD22 ASN B1620 -43.493 -3.494 2.976 1.00 0.00 H ATOM 624 HD21 ASN B1620 -42.864 -4.857 3.972 1.00 0.00 H ATOM 625 H ASN B1620 -41.986 -2.138 0.846 1.00 0.00 H ATOM 626 N PRO B1621 -41.881 -2.938 -2.298 1.00 52.11 N ATOM 627 CA PRO B1621 -42.294 -2.270 -3.539 1.00 48.22 C ATOM 628 C PRO B1621 -43.132 -3.162 -4.449 1.00 49.55 C ATOM 629 O PRO B1621 -42.846 -4.347 -4.624 1.00 47.00 O ATOM 630 CB PRO B1621 -40.962 -1.908 -4.190 1.00 46.58 C ATOM 631 CG PRO B1621 -40.050 -3.002 -3.749 1.00 48.37 C ATOM 632 CD PRO B1621 -40.430 -3.198 -2.281 1.00 49.99 C ATOM 633 N THR B1622 -44.118 -2.554 -5.104 1.00 46.67 N ATOM 634 CA THR B1622 -44.774 -3.146 -6.265 1.00 52.92 C ATOM 635 C THR B1622 -44.271 -2.427 -7.512 1.00 55.51 C ATOM 636 O THR B1622 -44.266 -1.191 -7.556 1.00 56.78 O ATOM 637 CB THR B1622 -46.298 -3.045 -6.157 1.00 52.86 C ATOM 638 OG1 THR B1622 -46.781 -4.091 -5.309 1.00 53.21 O ATOM 639 CG2 THR B1622 -46.931 -3.205 -7.496 1.00 53.03 C ATOM 640 HG1 THR B1622 -47.766 -4.028 -5.238 1.00 0.00 H ATOM 641 H THR B1622 -44.434 -1.619 -4.775 1.00 0.00 H ATOM 642 N PHE B1623 -43.820 -3.188 -8.507 1.00 51.67 N ATOM 643 CA PHE B1623 -43.337 -2.588 -9.743 1.00 51.79 C ATOM 644 C PHE B1623 -44.238 -2.906 -10.922 1.00 53.01 C ATOM 645 O PHE B1623 -44.600 -2.003 -11.681 1.00 55.80 O ATOM 646 CB PHE B1623 -41.890 -3.038 -10.053 1.00 50.33 C ATOM 647 CG PHE B1623 -40.889 -2.597 -9.024 1.00 47.69 C ATOM 648 CD1 PHE B1623 -40.421 -1.293 -9.007 1.00 42.18 C ATOM 649 CD2 PHE B1623 -40.439 -3.483 -8.054 1.00 47.76 C ATOM 650 CE1 PHE B1623 -39.519 -0.876 -8.041 1.00 48.13 C ATOM 651 CE2 PHE B1623 -39.532 -3.080 -7.088 1.00 43.36 C ATOM 652 CZ PHE B1623 -39.074 -1.772 -7.071 1.00 44.26 C ATOM 653 H PHE B1623 -43.813 -4.222 -8.400 1.00 0.00 H ATOM 654 N ASN B1624 -44.593 -4.178 -11.101 1.00 56.04 N ATOM 655 CA ASN B1624 -45.342 -4.621 -12.279 1.00 59.47 C ATOM 656 C ASN B1624 -44.733 -4.058 -13.555 1.00 54.83 C ATOM 657 O ASN B1624 -45.440 -3.580 -14.440 1.00 61.21 O ATOM 658 CB ASN B1624 -46.816 -4.246 -12.169 1.00 62.69 C ATOM 659 CG ASN B1624 -47.531 -5.044 -11.112 1.00 59.78 C ATOM 660 OD1 ASN B1624 -47.396 -6.269 -11.039 1.00 62.89 O ATOM 661 ND2 ASN B1624 -48.278 -4.354 -10.265 1.00 61.07 N ATOM 662 HD22 ASN B1624 -48.361 -3.322 -10.367 1.00 0.00 H ATOM 663 HD21 ASN B1624 -48.782 -4.843 -9.498 1.00 0.00 H ATOM 664 H ASN B1624 -44.329 -4.880 -10.380 1.00 0.00 H ATOM 665 N GLU B1625 -43.403 -4.086 -13.639 1.00 50.96 N ATOM 666 CA GLU B1625 -42.681 -3.461 -14.737 1.00 53.36 C ATOM 667 C GLU B1625 -41.938 -4.496 -15.575 1.00 54.49 C ATOM 668 O GLU B1625 -41.334 -5.431 -15.042 1.00 57.37 O ATOM 669 CB GLU B1625 -41.698 -2.412 -14.219 1.00 53.01 C ATOM 670 CG GLU B1625 -41.229 -1.492 -15.307 1.00 52.77 C ATOM 671 CD GLU B1625 -40.561 -0.232 -14.799 1.00 55.02 C ATOM 672 OE1 GLU B1625 -39.780 0.367 -15.573 1.00 60.08 O ATOM 673 OE2 GLU B1625 -40.803 0.163 -13.639 1.00 58.75 O ATOM 674 H GLU B1625 -42.863 -4.571 -12.894 1.00 0.00 H ATOM 675 N MET B1626 -41.970 -4.311 -16.892 1.00 57.30 N ATOM 676 CA MET B1626 -41.293 -5.202 -17.827 1.00 55.68 C ATOM 677 C MET B1626 -39.888 -4.691 -18.152 1.00 52.33 C ATOM 678 O MET B1626 -39.720 -3.536 -18.549 1.00 49.94 O ATOM 679 CB MET B1626 -42.116 -5.322 -19.105 1.00 50.26 C ATOM 680 CG MET B1626 -41.756 -6.505 -19.968 1.00 60.04 C ATOM 681 SD MET B1626 -42.185 -8.071 -19.181 1.00 71.11 S ATOM 682 CE MET B1626 -43.923 -8.202 -19.611 1.00 67.27 C ATOM 683 H MET B1626 -42.499 -3.499 -17.270 1.00 0.00 H ATOM 684 N LEU B1627 -38.882 -5.542 -17.962 1.00 54.53 N ATOM 685 CA LEU B1627 -37.562 -5.336 -18.538 1.00 53.33 C ATOM 686 C LEU B1627 -37.412 -6.251 -19.745 1.00 48.83 C ATOM 687 O LEU B1627 -37.630 -7.460 -19.631 1.00 52.48 O ATOM 688 CB LEU B1627 -36.430 -5.614 -17.542 1.00 49.67 C ATOM 689 CG LEU B1627 -36.176 -4.950 -16.204 1.00 56.62 C ATOM 690 CD1 LEU B1627 -36.380 -3.502 -16.165 1.00 53.51 C ATOM 691 CD2 LEU B1627 -36.807 -5.540 -15.079 1.00 60.42 C ATOM 692 H LEU B1627 -39.046 -6.387 -17.379 1.00 0.00 H ATOM 693 N VAL B1628 -36.964 -5.698 -20.870 1.00 45.65 N ATOM 694 CA VAL B1628 -36.994 -6.388 -22.159 1.00 49.52 C ATOM 695 C VAL B1628 -35.590 -6.448 -22.768 1.00 46.22 C ATOM 696 O VAL B1628 -34.897 -5.432 -22.857 1.00 48.92 O ATOM 697 CB VAL B1628 -37.974 -5.693 -23.118 1.00 48.33 C ATOM 698 CG1 VAL B1628 -37.612 -5.985 -24.529 1.00 54.97 C ATOM 699 CG2 VAL B1628 -39.382 -6.132 -22.834 1.00 54.15 C ATOM 700 H VAL B1628 -36.576 -4.734 -20.830 1.00 0.00 H ATOM 701 N TYR B1629 -35.186 -7.635 -23.203 1.00 50.19 N ATOM 702 CA TYR B1629 -33.918 -7.858 -23.891 1.00 47.64 C ATOM 703 C TYR B1629 -34.228 -8.430 -25.266 1.00 50.19 C ATOM 704 O TYR B1629 -34.648 -9.585 -25.374 1.00 52.09 O ATOM 705 CB TYR B1629 -33.027 -8.824 -23.118 1.00 47.80 C ATOM 706 CG TYR B1629 -32.450 -8.279 -21.844 1.00 50.77 C ATOM 707 CD1 TYR B1629 -31.292 -7.506 -21.856 1.00 51.65 C ATOM 708 CD2 TYR B1629 -33.046 -8.547 -20.624 1.00 44.38 C ATOM 709 CE1 TYR B1629 -30.760 -7.012 -20.690 1.00 48.00 C ATOM 710 CE2 TYR B1629 -32.520 -8.054 -19.458 1.00 40.20 C ATOM 711 CZ TYR B1629 -31.380 -7.296 -19.491 1.00 42.94 C ATOM 712 OH TYR B1629 -30.865 -6.804 -18.315 1.00 44.88 O ATOM 713 HH TYR B1629 -30.047 -6.281 -18.508 1.00 0.00 H ATOM 714 H TYR B1629 -35.808 -8.453 -23.045 1.00 0.00 H ATOM 715 N SER B1630 -34.030 -7.632 -26.308 1.00 54.13 N ATOM 716 CA SER B1630 -34.223 -8.064 -27.685 1.00 51.63 C ATOM 717 C SER B1630 -32.900 -8.436 -28.338 1.00 50.65 C ATOM 718 O SER B1630 -31.833 -8.005 -27.911 1.00 53.94 O ATOM 719 CB SER B1630 -34.925 -6.972 -28.492 1.00 49.16 C ATOM 720 OG SER B1630 -36.212 -6.724 -27.944 1.00 60.20 O ATOM 721 HG SER B1630 -36.749 -7.555 -27.978 1.00 0.00 H ATOM 722 H SER B1630 -33.723 -6.654 -26.133 1.00 0.00 H ATOM 723 N GLY B1631 -32.986 -9.236 -29.399 1.00 56.62 N ATOM 724 CA GLY B1631 -31.835 -9.564 -30.218 1.00 57.22 C ATOM 725 C GLY B1631 -30.986 -10.748 -29.783 1.00 64.57 C ATOM 726 O GLY B1631 -29.951 -10.998 -30.413 1.00 68.60 O ATOM 727 H GLY B1631 -33.911 -9.640 -29.649 1.00 0.00 H ATOM 728 N TYR B1632 -31.355 -11.460 -28.715 1.00 59.16 N ATOM 729 CA TYR B1632 -30.692 -12.702 -28.339 1.00 56.94 C ATOM 730 C TYR B1632 -31.470 -13.928 -28.821 1.00 60.30 C ATOM 731 O TYR B1632 -32.697 -13.984 -28.712 1.00 64.04 O ATOM 732 CB TYR B1632 -30.516 -12.786 -26.820 1.00 54.32 C ATOM 733 CG TYR B1632 -29.840 -11.589 -26.190 1.00 57.14 C ATOM 734 CD1 TYR B1632 -30.570 -10.459 -25.833 1.00 55.32 C ATOM 735 CD2 TYR B1632 -28.473 -11.595 -25.935 1.00 58.12 C ATOM 736 CE1 TYR B1632 -29.953 -9.366 -25.258 1.00 57.96 C ATOM 737 CE2 TYR B1632 -27.844 -10.506 -25.348 1.00 57.75 C ATOM 738 CZ TYR B1632 -28.585 -9.397 -25.014 1.00 58.93 C ATOM 739 OH TYR B1632 -27.962 -8.311 -24.432 1.00 60.36 O ATOM 740 HH TYR B1632 -28.631 -7.603 -24.256 1.00 0.00 H ATOM 741 H TYR B1632 -32.144 -11.116 -28.131 1.00 0.00 H ATOM 742 N SER B1633 -30.742 -14.924 -29.319 1.00 58.43 N ATOM 743 CA SER B1633 -31.252 -16.268 -29.553 1.00 55.39 C ATOM 744 C SER B1633 -31.382 -17.054 -28.251 1.00 57.24 C ATOM 745 O SER B1633 -30.699 -16.787 -27.258 1.00 54.62 O ATOM 746 CB SER B1633 -30.323 -17.033 -30.484 1.00 60.99 C ATOM 747 OG SER B1633 -29.210 -17.502 -29.747 1.00 60.01 O ATOM 748 HG SER B1633 -28.728 -16.732 -29.354 1.00 0.00 H ATOM 749 H SER B1633 -29.748 -14.731 -29.556 1.00 0.00 H ATOM 750 N LYS B1634 -32.250 -18.069 -28.274 1.00 64.37 N ATOM 751 CA LYS B1634 -32.356 -18.947 -27.110 1.00 60.01 C ATOM 752 C LYS B1634 -31.021 -19.608 -26.802 1.00 58.73 C ATOM 753 O LYS B1634 -30.717 -19.862 -25.631 1.00 58.23 O ATOM 754 CB LYS B1634 -33.384 -20.056 -27.344 1.00 63.10 C ATOM 755 CG LYS B1634 -34.842 -19.773 -27.060 1.00 66.08 C ATOM 756 CD LYS B1634 -35.614 -21.117 -27.177 1.00 72.75 C ATOM 757 CE LYS B1634 -37.096 -20.959 -27.483 1.00 65.69 C ATOM 758 NZ LYS B1634 -37.379 -21.222 -28.915 1.00 76.18 N ATOM 759 HZ1 LYS B1634 -36.845 -20.550 -29.502 1.00 0.00 H ATOM 760 HZ2 LYS B1634 -37.093 -22.194 -29.151 1.00 0.00 H ATOM 761 HZ3 LYS B1634 -38.397 -21.107 -29.093 1.00 0.00 H ATOM 762 H LYS B1634 -32.844 -18.233 -29.112 1.00 0.00 H ATOM 763 N GLU B1635 -30.215 -19.898 -27.839 1.00 61.00 N ATOM 764 CA GLU B1635 -28.903 -20.511 -27.627 1.00 59.71 C ATOM 765 C GLU B1635 -27.957 -19.565 -26.896 1.00 61.41 C ATOM 766 O GLU B1635 -27.238 -19.978 -25.976 1.00 62.30 O ATOM 767 CB GLU B1635 -28.289 -20.919 -28.966 1.00 60.41 C ATOM 768 CG GLU B1635 -29.226 -21.650 -29.925 1.00 69.23 C ATOM 769 CD GLU B1635 -28.682 -21.694 -31.339 1.00 66.26 C ATOM 770 OE1 GLU B1635 -29.192 -20.939 -32.194 1.00 67.01 O ATOM 771 OE2 GLU B1635 -27.742 -22.476 -31.597 1.00 66.58 O ATOM 772 H GLU B1635 -30.529 -19.683 -28.807 1.00 0.00 H ATOM 773 N THR B1636 -27.954 -18.289 -27.277 1.00 57.97 N ATOM 774 CA THR B1636 -27.100 -17.323 -26.601 1.00 54.85 C ATOM 775 C THR B1636 -27.509 -17.149 -25.149 1.00 57.62 C ATOM 776 O THR B1636 -26.651 -17.041 -24.264 1.00 59.42 O ATOM 777 CB THR B1636 -27.183 -15.974 -27.318 1.00 56.81 C ATOM 778 OG1 THR B1636 -26.805 -16.131 -28.687 1.00 60.71 O ATOM 779 CG2 THR B1636 -26.291 -14.947 -26.646 1.00 61.38 C ATOM 780 HG1 THR B1636 -27.417 -16.774 -29.125 1.00 0.00 H ATOM 781 H THR B1636 -28.564 -17.981 -28.061 1.00 0.00 H ATOM 782 N LEU B1637 -28.825 -17.142 -24.890 1.00 57.02 N ATOM 783 CA LEU B1637 -29.337 -16.853 -23.557 1.00 54.87 C ATOM 784 C LEU B1637 -28.979 -17.935 -22.553 1.00 53.97 C ATOM 785 O LEU B1637 -28.820 -17.642 -21.366 1.00 57.53 O ATOM 786 CB LEU B1637 -30.854 -16.652 -23.612 1.00 53.97 C ATOM 787 CG LEU B1637 -31.268 -15.292 -24.180 1.00 53.20 C ATOM 788 CD1 LEU B1637 -32.771 -15.189 -24.274 1.00 53.51 C ATOM 789 CD2 LEU B1637 -30.689 -14.130 -23.349 1.00 50.24 C ATOM 790 H LEU B1637 -29.495 -17.348 -25.658 1.00 0.00 H ATOM 791 N ARG B1638 -28.825 -19.180 -23.000 1.00 59.05 N ATOM 792 CA ARG B1638 -28.480 -20.249 -22.074 1.00 59.50 C ATOM 793 C ARG B1638 -27.024 -20.174 -21.623 1.00 59.49 C ATOM 794 O ARG B1638 -26.665 -20.810 -20.628 1.00 59.46 O ATOM 795 CB ARG B1638 -28.803 -21.598 -22.716 1.00 61.22 C ATOM 796 CG ARG B1638 -30.295 -21.730 -23.024 1.00 60.71 C ATOM 797 CD ARG B1638 -30.728 -23.162 -23.259 1.00 60.14 C ATOM 798 NE ARG B1638 -31.992 -23.222 -23.986 1.00 63.03 N ATOM 799 CZ ARG B1638 -32.093 -23.342 -25.306 1.00 64.69 C ATOM 800 NH1 ARG B1638 -31.003 -23.422 -26.060 1.00 63.50 N ATOM 801 NH2 ARG B1638 -33.291 -23.386 -25.873 1.00 68.83 N ATOM 802 HE ARG B1638 -32.872 -23.167 -23.435 1.00 0.00 H ATOM 803 HH12 ARG B1638 -31.090 -23.516 -27.092 1.00 0.00 H ATOM 804 HH11 ARG B1638 -30.062 -23.391 -25.619 1.00 0.00 H ATOM 805 HH22 ARG B1638 -33.375 -23.480 -26.905 1.00 0.00 H ATOM 806 HH21 ARG B1638 -34.147 -23.327 -25.285 1.00 0.00 H ATOM 807 H ARG B1638 -28.951 -19.389 -24.011 1.00 0.00 H ATOM 808 N GLN B1639 -26.190 -19.401 -22.328 1.00 60.06 N ATOM 809 CA GLN B1639 -24.829 -19.070 -21.913 1.00 60.36 C ATOM 810 C GLN B1639 -24.783 -17.897 -20.933 1.00 61.26 C ATOM 811 O GLN B1639 -23.691 -17.510 -20.504 1.00 62.26 O ATOM 812 CB GLN B1639 -23.952 -18.746 -23.135 1.00 57.92 C ATOM 813 CG GLN B1639 -24.117 -19.697 -24.326 1.00 58.97 C ATOM 814 CD GLN B1639 -23.267 -19.300 -25.546 1.00 73.01 C ATOM 815 OE1 GLN B1639 -22.628 -18.241 -25.568 1.00 70.64 O ATOM 816 NE2 GLN B1639 -23.264 -20.157 -26.567 1.00 69.23 N ATOM 817 HE22 GLN B1639 -23.815 -21.037 -26.509 1.00 0.00 H ATOM 818 HE21 GLN B1639 -22.711 -19.946 -27.422 1.00 0.00 H ATOM 819 H GLN B1639 -26.533 -19.011 -23.229 1.00 0.00 H ATOM 820 N ARG B1640 -25.924 -17.297 -20.606 1.00 58.11 N ATOM 821 CA ARG B1640 -25.964 -16.083 -19.810 1.00 57.10 C ATOM 822 C ARG B1640 -26.651 -16.327 -18.473 1.00 59.69 C ATOM 823 O ARG B1640 -27.442 -17.261 -18.309 1.00 59.95 O ATOM 824 CB ARG B1640 -26.680 -14.958 -20.564 1.00 58.17 C ATOM 825 CG ARG B1640 -26.238 -14.827 -22.017 1.00 58.31 C ATOM 826 CD ARG B1640 -24.763 -14.474 -22.100 1.00 60.65 C ATOM 827 NE ARG B1640 -24.526 -13.088 -21.717 1.00 59.70 N ATOM 828 CZ ARG B1640 -24.140 -12.144 -22.566 1.00 60.57 C ATOM 829 NH1 ARG B1640 -23.932 -12.454 -23.839 1.00 61.86 N ATOM 830 NH2 ARG B1640 -23.951 -10.899 -22.140 1.00 59.71 N ATOM 831 HE ARG B1640 -24.668 -12.824 -20.721 1.00 0.00 H ATOM 832 HH12 ARG B1640 -23.629 -11.720 -24.510 1.00 0.00 H ATOM 833 HH11 ARG B1640 -24.072 -13.431 -24.166 1.00 0.00 H ATOM 834 HH22 ARG B1640 -23.648 -10.161 -22.808 1.00 0.00 H ATOM 835 HH21 ARG B1640 -24.106 -10.663 -21.139 1.00 0.00 H ATOM 836 H ARG B1640 -26.820 -17.712 -20.932 1.00 0.00 H ATOM 837 N GLU B1641 -26.313 -15.483 -17.508 1.00 53.47 N ATOM 838 CA GLU B1641 -26.987 -15.436 -16.229 1.00 55.47 C ATOM 839 C GLU B1641 -27.689 -14.093 -16.106 1.00 59.01 C ATOM 840 O GLU B1641 -27.138 -13.058 -16.495 1.00 57.70 O ATOM 841 CB GLU B1641 -26.012 -15.605 -15.076 1.00 56.62 C ATOM 842 CG GLU B1641 -24.922 -16.606 -15.337 1.00 67.36 C ATOM 843 CD GLU B1641 -24.126 -16.891 -14.087 1.00 74.65 C ATOM 844 OE1 GLU B1641 -23.419 -15.974 -13.609 1.00 69.45 O ATOM 845 OE2 GLU B1641 -24.243 -18.023 -13.567 1.00 72.39 O ATOM 846 H GLU B1641 -25.527 -14.824 -17.679 1.00 0.00 H ATOM 847 N LEU B1642 -28.906 -14.111 -15.574 1.00 54.95 N ATOM 848 CA LEU B1642 -29.618 -12.883 -15.265 1.00 53.04 C ATOM 849 C LEU B1642 -29.213 -12.462 -13.862 1.00 53.42 C ATOM 850 O LEU B1642 -29.555 -13.133 -12.879 1.00 55.25 O ATOM 851 CB LEU B1642 -31.124 -13.079 -15.356 1.00 55.41 C ATOM 852 CG LEU B1642 -31.881 -11.842 -14.900 1.00 49.24 C ATOM 853 CD1 LEU B1642 -31.583 -10.677 -15.855 1.00 55.30 C ATOM 854 CD2 LEU B1642 -33.349 -12.155 -14.852 1.00 50.60 C ATOM 855 H LEU B1642 -29.360 -15.025 -15.374 1.00 0.00 H ATOM 856 N GLN B1643 -28.455 -11.379 -13.759 1.00 48.72 N ATOM 857 CA GLN B1643 -28.075 -10.858 -12.458 1.00 51.27 C ATOM 858 C GLN B1643 -29.053 -9.753 -12.088 1.00 47.29 C ATOM 859 O GLN B1643 -29.264 -8.821 -12.869 1.00 45.33 O ATOM 860 CB GLN B1643 -26.634 -10.344 -12.462 1.00 41.68 C ATOM 861 CG GLN B1643 -26.254 -9.747 -11.126 1.00 47.44 C ATOM 862 CD GLN B1643 -25.037 -8.856 -11.206 1.00 56.57 C ATOM 863 OE1 GLN B1643 -23.992 -9.169 -10.636 1.00 57.84 O ATOM 864 NE2 GLN B1643 -25.164 -7.736 -11.908 1.00 56.29 N ATOM 865 HE22 GLN B1643 -26.067 -7.513 -12.373 1.00 0.00 H ATOM 866 HE21 GLN B1643 -24.360 -7.082 -11.993 1.00 0.00 H ATOM 867 H GLN B1643 -28.129 -10.897 -14.621 1.00 0.00 H ATOM 868 N LEU B1644 -29.632 -9.846 -10.899 1.00 45.33 N ATOM 869 CA LEU B1644 -30.687 -8.929 -10.490 1.00 43.32 C ATOM 870 C LEU B1644 -30.326 -8.324 -9.140 1.00 47.17 C ATOM 871 O LEU B1644 -29.967 -9.050 -8.208 1.00 44.76 O ATOM 872 CB LEU B1644 -32.033 -9.656 -10.421 1.00 40.19 C ATOM 873 CG LEU B1644 -33.277 -8.859 -10.015 1.00 45.73 C ATOM 874 CD1 LEU B1644 -34.515 -9.389 -10.724 1.00 46.08 C ATOM 875 CD2 LEU B1644 -33.495 -8.893 -8.517 1.00 42.63 C ATOM 876 H LEU B1644 -29.325 -10.592 -10.242 1.00 0.00 H ATOM 877 N SER B1645 -30.471 -7.004 -9.026 1.00 43.92 N ATOM 878 CA SER B1645 -30.038 -6.260 -7.858 1.00 39.92 C ATOM 879 C SER B1645 -31.125 -5.288 -7.453 1.00 42.78 C ATOM 880 O SER B1645 -31.735 -4.627 -8.297 1.00 41.50 O ATOM 881 CB SER B1645 -28.746 -5.460 -8.125 1.00 39.95 C ATOM 882 OG SER B1645 -27.642 -6.307 -8.339 1.00 46.23 O ATOM 883 HG SER B1645 -26.835 -5.759 -8.506 1.00 0.00 H ATOM 884 H SER B1645 -30.915 -6.484 -9.810 1.00 0.00 H ATOM 885 N VAL B1646 -31.332 -5.166 -6.156 1.00 36.16 N ATOM 886 CA VAL B1646 -32.262 -4.201 -5.618 1.00 38.17 C ATOM 887 C VAL B1646 -31.439 -3.141 -4.914 1.00 41.62 C ATOM 888 O VAL B1646 -30.610 -3.457 -4.051 1.00 48.71 O ATOM 889 CB VAL B1646 -33.269 -4.874 -4.673 1.00 43.08 C ATOM 890 CG1 VAL B1646 -34.232 -3.842 -4.094 1.00 37.16 C ATOM 891 CG2 VAL B1646 -33.999 -6.007 -5.413 1.00 36.77 C ATOM 892 H VAL B1646 -30.810 -5.783 -5.501 1.00 0.00 H ATOM 893 N LEU B1647 -31.685 -1.889 -5.251 1.00 41.00 N ATOM 894 CA LEU B1647 -30.878 -0.792 -4.760 1.00 41.46 C ATOM 895 C LEU B1647 -31.818 0.285 -4.269 1.00 41.23 C ATOM 896 O LEU B1647 -32.948 0.405 -4.744 1.00 43.00 O ATOM 897 CB LEU B1647 -29.940 -0.225 -5.849 1.00 43.35 C ATOM 898 CG LEU B1647 -28.733 -1.090 -6.243 1.00 47.70 C ATOM 899 CD1 LEU B1647 -28.975 -1.782 -7.551 1.00 45.64 C ATOM 900 CD2 LEU B1647 -27.457 -0.273 -6.307 1.00 44.81 C ATOM 901 H LEU B1647 -32.482 -1.685 -5.888 1.00 0.00 H ATOM 902 N SER B1648 -31.363 1.045 -3.295 1.00 39.05 N ATOM 903 CA SER B1648 -32.134 2.186 -2.854 1.00 46.95 C ATOM 904 C SER B1648 -31.662 3.410 -3.620 1.00 51.23 C ATOM 905 O SER B1648 -30.459 3.700 -3.650 1.00 48.99 O ATOM 906 CB SER B1648 -31.983 2.398 -1.352 1.00 43.69 C ATOM 907 OG SER B1648 -32.799 3.483 -0.969 1.00 49.55 O ATOM 908 HG SER B1648 -32.711 3.633 0.006 1.00 0.00 H ATOM 909 H SER B1648 -30.452 0.825 -2.844 1.00 0.00 H ATOM 910 N ALA B1649 -32.607 4.135 -4.217 1.00 50.60 N ATOM 911 CA ALA B1649 -32.290 5.360 -4.947 1.00 48.99 C ATOM 912 C ALA B1649 -32.206 6.482 -3.933 1.00 57.02 C ATOM 913 O ALA B1649 -33.227 6.988 -3.454 1.00 61.91 O ATOM 914 CB ALA B1649 -33.333 5.659 -6.013 1.00 52.04 C ATOM 915 H ALA B1649 -33.597 3.820 -4.162 1.00 0.00 H ATOM 916 N GLU B1650 -30.980 6.842 -3.580 1.00 55.69 N ATOM 917 CA GLU B1650 -30.696 7.807 -2.532 1.00 55.76 C ATOM 918 C GLU B1650 -30.233 9.119 -3.157 1.00 58.67 C ATOM 919 O GLU B1650 -29.361 9.116 -4.029 1.00 60.44 O ATOM 920 CB GLU B1650 -29.630 7.237 -1.593 1.00 53.28 C ATOM 921 CG GLU B1650 -30.136 6.083 -0.754 1.00 57.77 C ATOM 922 CD GLU B1650 -31.163 6.541 0.263 1.00 60.23 C ATOM 923 OE1 GLU B1650 -30.893 7.545 0.958 1.00 63.38 O ATOM 924 OE2 GLU B1650 -32.249 5.933 0.340 1.00 56.48 O ATOM 925 H GLU B1650 -30.177 6.410 -4.081 1.00 0.00 H ATOM 926 N SER B1651 -30.800 10.240 -2.703 1.00 61.02 N ATOM 927 CA SER B1651 -30.439 11.531 -3.271 1.00 59.12 C ATOM 928 C SER B1651 -29.299 12.233 -2.535 1.00 61.81 C ATOM 929 O SER B1651 -28.645 13.101 -3.134 1.00 62.14 O ATOM 930 CB SER B1651 -31.669 12.444 -3.331 1.00 64.52 C ATOM 931 OG SER B1651 -32.051 12.888 -2.054 1.00 62.84 O ATOM 932 HG SER B1651 -32.846 13.473 -2.133 1.00 0.00 H ATOM 933 H SER B1651 -31.504 10.190 -1.939 1.00 0.00 H ATOM 934 N LEU B1652 -29.043 11.894 -1.266 1.00 60.06 N ATOM 935 CA LEU B1652 -27.989 12.534 -0.478 1.00 55.43 C ATOM 936 C LEU B1652 -26.888 11.574 -0.032 1.00 50.61 C ATOM 937 O LEU B1652 -25.992 11.979 0.715 1.00 57.86 O ATOM 938 CB LEU B1652 -28.583 13.248 0.743 1.00 57.95 C ATOM 939 CG LEU B1652 -29.241 14.637 0.588 1.00 56.00 C ATOM 940 CD1 LEU B1652 -30.290 14.731 -0.492 1.00 58.02 C ATOM 941 CD2 LEU B1652 -29.824 15.083 1.927 1.00 56.88 C ATOM 942 H LEU B1652 -29.615 11.147 -0.823 1.00 0.00 H ATOM 943 N ARG B1653 -26.910 10.324 -0.480 1.00 55.26 N ATOM 944 CA ARG B1653 -25.838 9.370 -0.206 1.00 55.66 C ATOM 945 C ARG B1653 -25.841 8.343 -1.330 1.00 51.49 C ATOM 946 O ARG B1653 -26.760 8.301 -2.147 1.00 52.80 O ATOM 947 CB ARG B1653 -25.987 8.714 1.175 1.00 56.58 C ATOM 948 CG ARG B1653 -27.096 7.685 1.315 1.00 56.99 C ATOM 949 CD ARG B1653 -27.000 6.968 2.663 1.00 62.94 C ATOM 950 NE ARG B1653 -28.170 6.139 2.957 1.00 66.37 N ATOM 951 CZ ARG B1653 -29.197 6.516 3.712 1.00 63.80 C ATOM 952 NH1 ARG B1653 -30.209 5.682 3.917 1.00 64.24 N ATOM 953 NH2 ARG B1653 -29.208 7.717 4.273 1.00 65.35 N ATOM 954 HE ARG B1653 -28.200 5.185 2.545 1.00 0.00 H ATOM 955 HH12 ARG B1653 -31.013 5.975 4.507 1.00 0.00 H ATOM 956 HH11 ARG B1653 -30.198 4.735 3.487 1.00 0.00 H ATOM 957 HH22 ARG B1653 -30.014 8.008 4.863 1.00 0.00 H ATOM 958 HH21 ARG B1653 -28.411 8.368 4.123 1.00 0.00 H ATOM 959 H ARG B1653 -27.723 10.012 -1.049 1.00 0.00 H ATOM 960 N GLY B1654 -24.823 7.489 -1.355 1.00 50.56 N ATOM 961 CA GLY B1654 -24.719 6.531 -2.437 1.00 53.83 C ATOM 962 C GLY B1654 -25.885 5.560 -2.452 1.00 54.17 C ATOM 963 O GLY B1654 -26.526 5.304 -1.427 1.00 55.24 O ATOM 964 H GLY B1654 -24.105 7.508 -0.602 1.00 0.00 H ATOM 965 N ASN B1655 -26.183 5.040 -3.648 1.00 52.00 N ATOM 966 CA ASN B1655 -27.314 4.132 -3.863 1.00 53.87 C ATOM 967 C ASN B1655 -26.922 2.752 -3.360 1.00 54.75 C ATOM 968 O ASN B1655 -26.274 1.988 -4.076 1.00 54.37 O ATOM 969 CB ASN B1655 -27.693 4.077 -5.339 1.00 51.59 C ATOM 970 CG ASN B1655 -28.460 5.297 -5.785 1.00 55.78 C ATOM 971 OD1 ASN B1655 -28.647 6.241 -5.007 1.00 55.21 O ATOM 972 ND2 ASN B1655 -28.913 5.294 -7.035 1.00 48.47 N ATOM 973 HD22 ASN B1655 -28.731 4.477 -7.652 1.00 0.00 H ATOM 974 HD21 ASN B1655 -29.450 6.109 -7.396 1.00 0.00 H ATOM 975 H ASN B1655 -25.586 5.291 -4.462 1.00 0.00 H ATOM 976 N PHE B1656 -27.282 2.434 -2.117 1.00 50.31 N ATOM 977 CA PHE B1656 -26.767 1.210 -1.523 1.00 52.09 C ATOM 978 C PHE B1656 -27.517 -0.030 -2.004 1.00 48.63 C ATOM 979 O PHE B1656 -28.695 0.014 -2.379 1.00 46.72 O ATOM 980 CB PHE B1656 -26.746 1.283 0.014 1.00 50.95 C ATOM 981 CG PHE B1656 -28.028 1.707 0.657 1.00 46.23 C ATOM 982 CD1 PHE B1656 -28.333 3.052 0.806 1.00 51.44 C ATOM 983 CD2 PHE B1656 -28.892 0.764 1.208 1.00 50.68 C ATOM 984 CE1 PHE B1656 -29.514 3.457 1.446 1.00 51.24 C ATOM 985 CE2 PHE B1656 -30.077 1.161 1.855 1.00 46.02 C ATOM 986 CZ PHE B1656 -30.383 2.507 1.973 1.00 43.53 C ATOM 987 H PHE B1656 -27.922 3.052 -1.579 1.00 0.00 H ATOM 988 N PHE B1657 -26.772 -1.130 -2.041 1.00 46.83 N ATOM 989 CA PHE B1657 -27.290 -2.450 -2.364 1.00 44.97 C ATOM 990 C PHE B1657 -28.199 -2.965 -1.248 1.00 51.34 C ATOM 991 O PHE B1657 -27.867 -2.877 -0.057 1.00 54.03 O ATOM 992 CB PHE B1657 -26.090 -3.372 -2.566 1.00 40.41 C ATOM 993 CG PHE B1657 -26.415 -4.704 -3.132 1.00 46.86 C ATOM 994 CD1 PHE B1657 -26.675 -4.853 -4.487 1.00 39.26 C ATOM 995 CD2 PHE B1657 -26.417 -5.829 -2.312 1.00 44.15 C ATOM 996 CE1 PHE B1657 -26.956 -6.108 -5.016 1.00 42.37 C ATOM 997 CE2 PHE B1657 -26.684 -7.075 -2.821 1.00 43.18 C ATOM 998 CZ PHE B1657 -26.959 -7.222 -4.174 1.00 42.60 C ATOM 999 H PHE B1657 -25.758 -1.042 -1.826 1.00 0.00 H ATOM 1000 N LEU B1658 -29.330 -3.561 -1.627 1.00 51.85 N ATOM 1001 CA LEU B1658 -30.260 -4.141 -0.647 1.00 48.57 C ATOM 1002 C LEU B1658 -30.304 -5.657 -0.695 1.00 49.21 C ATOM 1003 O LEU B1658 -30.423 -6.301 0.348 1.00 47.90 O ATOM 1004 CB LEU B1658 -31.679 -3.606 -0.863 1.00 46.40 C ATOM 1005 CG LEU B1658 -31.907 -2.140 -0.504 1.00 50.74 C ATOM 1006 CD1 LEU B1658 -33.236 -1.641 -1.070 1.00 44.59 C ATOM 1007 CD2 LEU B1658 -31.848 -1.971 0.996 1.00 47.42 C ATOM 1008 H LEU B1658 -29.560 -3.617 -2.640 1.00 0.00 H ATOM 1009 N GLY B1659 -30.217 -6.227 -1.893 1.00 44.00 N ATOM 1010 CA GLY B1659 -30.079 -7.654 -2.050 1.00 40.87 C ATOM 1011 C GLY B1659 -30.168 -7.988 -3.510 1.00 43.75 C ATOM 1012 O GLY B1659 -30.577 -7.173 -4.335 1.00 46.42 O ATOM 1013 H GLY B1659 -30.249 -5.626 -2.741 1.00 0.00 H ATOM 1014 N GLY B1660 -29.800 -9.219 -3.826 1.00 45.95 N ATOM 1015 CA GLY B1660 -29.905 -9.604 -5.215 1.00 43.27 C ATOM 1016 C GLY B1660 -29.930 -11.103 -5.365 1.00 43.74 C ATOM 1017 O GLY B1660 -29.921 -11.856 -4.390 1.00 50.94 O ATOM 1018 H GLY B1660 -29.450 -9.882 -3.105 1.00 0.00 H ATOM 1019 N VAL B1661 -29.983 -11.523 -6.619 1.00 42.99 N ATOM 1020 CA VAL B1661 -30.051 -12.930 -6.963 1.00 48.66 C ATOM 1021 C VAL B1661 -29.588 -13.053 -8.401 1.00 44.74 C ATOM 1022 O VAL B1661 -29.847 -12.171 -9.220 1.00 44.87 O ATOM 1023 CB VAL B1661 -31.485 -13.479 -6.746 1.00 49.36 C ATOM 1024 CG1 VAL B1661 -32.482 -12.790 -7.672 1.00 50.34 C ATOM 1025 CG2 VAL B1661 -31.522 -14.973 -6.938 1.00 50.88 C ATOM 1026 H VAL B1661 -29.976 -10.819 -7.385 1.00 0.00 H ATOM 1027 N THR B1662 -28.872 -14.135 -8.699 1.00 45.07 N ATOM 1028 CA THR B1662 -28.378 -14.406 -10.041 1.00 48.39 C ATOM 1029 C THR B1662 -29.036 -15.677 -10.544 1.00 49.56 C ATOM 1030 O THR B1662 -29.010 -16.698 -9.859 1.00 51.46 O ATOM 1031 CB THR B1662 -26.849 -14.558 -10.057 1.00 50.51 C ATOM 1032 OG1 THR B1662 -26.245 -13.525 -9.257 1.00 50.77 O ATOM 1033 CG2 THR B1662 -26.333 -14.452 -11.496 1.00 49.63 C ATOM 1034 HG1 THR B1662 -25.261 -13.630 -9.273 1.00 0.00 H ATOM 1035 H THR B1662 -28.657 -14.815 -7.942 1.00 0.00 H ATOM 1036 N LEU B1663 -29.646 -15.611 -11.718 1.00 56.09 N ATOM 1037 CA LEU B1663 -30.409 -16.739 -12.255 1.00 53.79 C ATOM 1038 C LEU B1663 -29.840 -17.221 -13.577 1.00 53.27 C ATOM 1039 O LEU B1663 -29.964 -16.508 -14.592 1.00 51.41 O ATOM 1040 CB LEU B1663 -31.877 -16.351 -12.409 1.00 50.05 C ATOM 1041 CG LEU B1663 -32.416 -15.745 -11.113 1.00 52.04 C ATOM 1042 CD1 LEU B1663 -33.722 -14.997 -11.304 1.00 54.23 C ATOM 1043 CD2 LEU B1663 -32.567 -16.850 -10.073 1.00 53.16 C ATOM 1044 H LEU B1663 -29.581 -14.734 -12.273 1.00 0.00 H ATOM 1045 N PRO B1664 -29.213 -18.403 -13.628 1.00 57.86 N ATOM 1046 CA PRO B1664 -28.793 -18.943 -14.927 1.00 56.64 C ATOM 1047 C PRO B1664 -30.001 -19.157 -15.815 1.00 60.10 C ATOM 1048 O PRO B1664 -31.006 -19.730 -15.396 1.00 60.88 O ATOM 1049 CB PRO B1664 -28.140 -20.273 -14.561 1.00 57.52 C ATOM 1050 CG PRO B1664 -27.767 -20.136 -13.119 1.00 59.66 C ATOM 1051 CD PRO B1664 -28.775 -19.231 -12.498 1.00 55.69 C ATOM 1052 N LEU B1665 -29.863 -18.784 -17.080 1.00 59.55 N ATOM 1053 CA LEU B1665 -31.012 -18.880 -17.962 1.00 60.25 C ATOM 1054 C LEU B1665 -31.158 -20.256 -18.587 1.00 62.31 C ATOM 1055 O LEU B1665 -32.189 -20.533 -19.208 1.00 61.68 O ATOM 1056 CB LEU B1665 -30.956 -17.790 -19.041 1.00 57.39 C ATOM 1057 CG LEU B1665 -31.213 -16.407 -18.428 1.00 59.84 C ATOM 1058 CD1 LEU B1665 -30.998 -15.296 -19.434 1.00 61.34 C ATOM 1059 CD2 LEU B1665 -32.602 -16.341 -17.844 1.00 57.08 C ATOM 1060 H LEU B1665 -28.951 -18.430 -17.433 1.00 0.00 H ATOM 1061 N LYS B1666 -30.182 -21.140 -18.399 1.00 61.98 N ATOM 1062 CA LYS B1666 -30.369 -22.511 -18.845 1.00 64.81 C ATOM 1063 C LYS B1666 -31.418 -23.238 -18.011 1.00 63.42 C ATOM 1064 O LYS B1666 -31.927 -24.275 -18.441 1.00 62.43 O ATOM 1065 CB LYS B1666 -29.041 -23.263 -18.826 1.00 67.08 C ATOM 1066 CG LYS B1666 -28.375 -23.388 -17.480 1.00 67.06 C ATOM 1067 CD LYS B1666 -26.933 -23.831 -17.687 1.00 75.41 C ATOM 1068 CE LYS B1666 -26.313 -24.381 -16.424 1.00 93.96 C ATOM 1069 NZ LYS B1666 -26.333 -25.872 -16.415 1.00112.85 N ATOM 1070 HZ1 LYS B1666 -27.317 -26.205 -16.473 1.00 0.00 H ATOM 1071 HZ2 LYS B1666 -25.796 -26.230 -17.231 1.00 0.00 H ATOM 1072 HZ3 LYS B1666 -25.900 -26.218 -15.535 1.00 0.00 H ATOM 1073 H LYS B1666 -29.295 -20.854 -17.938 1.00 0.00 H ATOM 1074 N ASP B1667 -31.771 -22.713 -16.842 1.00 62.27 N ATOM 1075 CA ASP B1667 -32.730 -23.388 -15.979 1.00 65.64 C ATOM 1076 C ASP B1667 -34.183 -23.156 -16.383 1.00 70.31 C ATOM 1077 O ASP B1667 -35.073 -23.762 -15.774 1.00 71.67 O ATOM 1078 CB ASP B1667 -32.511 -22.959 -14.536 1.00 61.46 C ATOM 1079 CG ASP B1667 -31.114 -23.267 -14.068 1.00 66.31 C ATOM 1080 OD1 ASP B1667 -30.483 -24.159 -14.677 1.00 68.08 O ATOM 1081 OD2 ASP B1667 -30.635 -22.608 -13.121 1.00 67.86 O ATOM 1082 H ASP B1667 -31.357 -21.808 -16.540 1.00 0.00 H ATOM 1083 N PHE B1668 -34.452 -22.296 -17.365 1.00 66.13 N ATOM 1084 CA PHE B1668 -35.815 -21.970 -17.756 1.00 61.96 C ATOM 1085 C PHE B1668 -36.199 -22.654 -19.059 1.00 63.16 C ATOM 1086 O PHE B1668 -35.392 -22.761 -19.988 1.00 63.25 O ATOM 1087 CB PHE B1668 -35.986 -20.460 -17.877 1.00 54.60 C ATOM 1088 CG PHE B1668 -35.698 -19.740 -16.601 1.00 56.79 C ATOM 1089 CD1 PHE B1668 -34.402 -19.469 -16.218 1.00 56.98 C ATOM 1090 CD2 PHE B1668 -36.723 -19.380 -15.752 1.00 61.69 C ATOM 1091 CE1 PHE B1668 -34.136 -18.824 -15.034 1.00 54.09 C ATOM 1092 CE2 PHE B1668 -36.459 -18.733 -14.557 1.00 57.16 C ATOM 1093 CZ PHE B1668 -35.163 -18.451 -14.205 1.00 54.54 C ATOM 1094 H PHE B1668 -33.662 -21.843 -17.868 1.00 0.00 H ATOM 1095 N ASN B1669 -37.434 -23.125 -19.117 1.00 62.38 N ATOM 1096 CA ASN B1669 -38.019 -23.507 -20.390 1.00 71.50 C ATOM 1097 C ASN B1669 -38.545 -22.236 -21.040 1.00 71.51 C ATOM 1098 O ASN B1669 -39.555 -21.670 -20.608 1.00 66.88 O ATOM 1099 CB ASN B1669 -39.109 -24.557 -20.205 1.00 77.95 C ATOM 1100 CG ASN B1669 -40.024 -24.658 -21.403 1.00 86.10 C ATOM 1101 OD1 ASN B1669 -39.580 -24.700 -22.533 1.00 82.31 O ATOM 1102 ND2 ASN B1669 -41.310 -24.730 -21.153 1.00 87.32 N ATOM 1103 HD22 ASN B1669 -41.652 -24.691 -20.172 1.00 0.00 H ATOM 1104 HD21 ASN B1669 -41.987 -24.827 -21.936 1.00 0.00 H ATOM 1105 H ASN B1669 -37.990 -23.222 -18.244 1.00 0.00 H ATOM 1106 N LEU B1670 -37.834 -21.768 -22.058 1.00 74.25 N ATOM 1107 CA LEU B1670 -38.092 -20.465 -22.643 1.00 70.28 C ATOM 1108 C LEU B1670 -39.307 -20.473 -23.556 1.00 67.74 C ATOM 1109 O LEU B1670 -39.777 -19.401 -23.954 1.00 67.33 O ATOM 1110 CB LEU B1670 -36.848 -19.999 -23.389 1.00 66.19 C ATOM 1111 CG LEU B1670 -35.610 -19.940 -22.478 1.00 63.91 C ATOM 1112 CD1 LEU B1670 -34.364 -19.740 -23.302 1.00 67.72 C ATOM 1113 CD2 LEU B1670 -35.723 -18.862 -21.411 1.00 57.85 C ATOM 1114 H LEU B1670 -37.068 -22.353 -22.449 1.00 0.00 H ATOM 1115 N SER B1671 -39.831 -21.646 -23.891 1.00 70.51 N ATOM 1116 CA SER B1671 -41.102 -21.719 -24.610 1.00 76.27 C ATOM 1117 C SER B1671 -42.302 -21.732 -23.656 1.00 77.15 C ATOM 1118 O SER B1671 -43.364 -22.272 -23.985 1.00 78.73 O ATOM 1119 CB SER B1671 -41.097 -22.929 -25.553 1.00 80.07 C ATOM 1120 OG SER B1671 -41.553 -24.141 -24.954 1.00 90.08 O ATOM 1121 HG SER B1671 -42.484 -24.022 -24.639 1.00 0.00 H ATOM 1122 H SER B1671 -39.332 -22.523 -23.639 1.00 0.00 H ATOM 1123 N LYS B1672 -42.159 -21.104 -22.481 1.00 76.65 N ATOM 1124 CA LYS B1672 -43.224 -20.991 -21.491 1.00 70.23 C ATOM 1125 C LYS B1672 -42.911 -19.809 -20.580 1.00 69.98 C ATOM 1126 O LYS B1672 -41.751 -19.412 -20.437 1.00 72.98 O ATOM 1127 CB LYS B1672 -43.362 -22.278 -20.663 1.00 70.12 C ATOM 1128 CG LYS B1672 -44.646 -22.358 -19.848 1.00 77.67 C ATOM 1129 CD LYS B1672 -44.564 -23.363 -18.708 1.00 80.79 C ATOM 1130 CE LYS B1672 -43.523 -24.431 -18.958 1.00 78.73 C ATOM 1131 NZ LYS B1672 -43.730 -25.605 -18.070 1.00 76.33 N ATOM 1132 HZ1 LYS B1672 -43.663 -25.303 -17.077 1.00 0.00 H ATOM 1133 HZ2 LYS B1672 -44.671 -26.011 -18.248 1.00 0.00 H ATOM 1134 HZ3 LYS B1672 -43.000 -26.319 -18.266 1.00 0.00 H ATOM 1135 H LYS B1672 -41.238 -20.673 -22.263 1.00 0.00 H ATOM 1136 N GLU B1673 -43.953 -19.212 -19.997 1.00 67.34 N ATOM 1137 CA GLU B1673 -43.749 -18.260 -18.911 1.00 68.70 C ATOM 1138 C GLU B1673 -43.470 -19.016 -17.611 1.00 68.80 C ATOM 1139 O GLU B1673 -44.015 -20.096 -17.376 1.00 70.44 O ATOM 1140 CB GLU B1673 -44.954 -17.319 -18.768 1.00 62.56 C ATOM 1141 CG GLU B1673 -44.952 -16.470 -17.501 1.00 72.84 C ATOM 1142 CD GLU B1673 -46.131 -15.521 -17.412 1.00 76.92 C ATOM 1143 OE1 GLU B1673 -45.970 -14.430 -16.829 1.00 77.89 O ATOM 1144 OE2 GLU B1673 -47.204 -15.882 -17.907 1.00 82.35 O ATOM 1145 H GLU B1673 -44.918 -19.427 -20.320 1.00 0.00 H ATOM 1146 N THR B1674 -42.643 -18.418 -16.750 1.00 61.55 N ATOM 1147 CA THR B1674 -42.229 -19.025 -15.488 1.00 58.03 C ATOM 1148 C THR B1674 -42.405 -17.986 -14.398 1.00 58.85 C ATOM 1149 O THR B1674 -41.761 -16.935 -14.433 1.00 66.51 O ATOM 1150 CB THR B1674 -40.772 -19.498 -15.526 1.00 59.81 C ATOM 1151 OG1 THR B1674 -40.592 -20.467 -16.570 1.00 70.09 O ATOM 1152 CG2 THR B1674 -40.368 -20.110 -14.203 1.00 54.67 C ATOM 1153 HG1 THR B1674 -39.648 -20.764 -16.584 1.00 0.00 H ATOM 1154 H THR B1674 -42.276 -17.475 -16.990 1.00 0.00 H ATOM 1155 N VAL B1675 -43.282 -18.260 -13.446 1.00 52.07 N ATOM 1156 CA VAL B1675 -43.581 -17.317 -12.382 1.00 53.29 C ATOM 1157 C VAL B1675 -43.209 -17.979 -11.068 1.00 56.38 C ATOM 1158 O VAL B1675 -43.745 -19.040 -10.730 1.00 53.33 O ATOM 1159 CB VAL B1675 -45.056 -16.888 -12.386 1.00 54.13 C ATOM 1160 CG1 VAL B1675 -45.319 -15.912 -11.249 1.00 55.09 C ATOM 1161 CG2 VAL B1675 -45.413 -16.273 -13.717 1.00 58.54 C ATOM 1162 H VAL B1675 -43.772 -19.177 -13.460 1.00 0.00 H ATOM 1163 N LYS B1676 -42.265 -17.378 -10.350 1.00 51.26 N ATOM 1164 CA LYS B1676 -41.912 -17.895 -9.044 1.00 53.02 C ATOM 1165 C LYS B1676 -41.223 -16.803 -8.242 1.00 56.85 C ATOM 1166 O LYS B1676 -40.882 -15.739 -8.765 1.00 50.18 O ATOM 1167 CB LYS B1676 -41.044 -19.157 -9.140 1.00 59.99 C ATOM 1168 CG LYS B1676 -39.790 -19.061 -9.969 1.00 59.13 C ATOM 1169 CD LYS B1676 -38.979 -20.368 -9.885 1.00 53.76 C ATOM 1170 CE LYS B1676 -38.437 -20.591 -8.486 1.00 61.34 C ATOM 1171 NZ LYS B1676 -37.484 -21.750 -8.369 1.00 68.02 N ATOM 1172 HZ1 LYS B1676 -37.969 -22.626 -8.652 1.00 0.00 H ATOM 1173 HZ2 LYS B1676 -36.666 -21.589 -8.991 1.00 0.00 H ATOM 1174 HZ3 LYS B1676 -37.161 -21.833 -7.384 1.00 0.00 H ATOM 1175 H LYS B1676 -41.781 -16.538 -10.726 1.00 0.00 H ATOM 1176 N TRP B1677 -41.123 -17.051 -6.939 1.00 53.44 N ATOM 1177 CA TRP B1677 -40.397 -16.209 -6.005 1.00 51.17 C ATOM 1178 C TRP B1677 -38.936 -16.638 -5.905 1.00 56.76 C ATOM 1179 O TRP B1677 -38.576 -17.791 -6.157 1.00 57.60 O ATOM 1180 CB TRP B1677 -41.053 -16.237 -4.624 1.00 56.12 C ATOM 1181 CG TRP B1677 -42.342 -15.480 -4.515 1.00 54.75 C ATOM 1182 CD1 TRP B1677 -43.592 -15.946 -4.816 1.00 53.79 C ATOM 1183 CD2 TRP B1677 -42.513 -14.121 -4.070 1.00 57.59 C ATOM 1184 NE1 TRP B1677 -44.526 -14.960 -4.587 1.00 65.31 N ATOM 1185 CE2 TRP B1677 -43.893 -13.836 -4.123 1.00 58.10 C ATOM 1186 CE3 TRP B1677 -41.633 -13.125 -3.619 1.00 58.72 C ATOM 1187 CZ2 TRP B1677 -44.418 -12.594 -3.751 1.00 58.93 C ATOM 1188 CZ3 TRP B1677 -42.161 -11.883 -3.245 1.00 52.46 C ATOM 1189 CH2 TRP B1677 -43.541 -11.633 -3.319 1.00 54.91 C ATOM 1190 HE1 TRP B1677 -45.550 -15.053 -4.742 1.00 0.00 H ATOM 1191 H TRP B1677 -41.594 -17.900 -6.566 1.00 0.00 H ATOM 1192 N TYR B1678 -38.092 -15.683 -5.522 1.00 57.40 N ATOM 1193 CA TYR B1678 -36.664 -15.905 -5.359 1.00 53.86 C ATOM 1194 C TYR B1678 -36.172 -15.155 -4.131 1.00 57.35 C ATOM 1195 O TYR B1678 -36.599 -14.025 -3.881 1.00 59.39 O ATOM 1196 CB TYR B1678 -35.908 -15.421 -6.579 1.00 48.59 C ATOM 1197 CG TYR B1678 -36.276 -16.124 -7.858 1.00 50.34 C ATOM 1198 CD1 TYR B1678 -35.637 -17.302 -8.218 1.00 51.25 C ATOM 1199 CD2 TYR B1678 -37.229 -15.603 -8.723 1.00 50.34 C ATOM 1200 CE1 TYR B1678 -35.934 -17.950 -9.377 1.00 47.63 C ATOM 1201 CE2 TYR B1678 -37.541 -16.261 -9.915 1.00 50.60 C ATOM 1202 CZ TYR B1678 -36.877 -17.437 -10.225 1.00 50.95 C ATOM 1203 OH TYR B1678 -37.139 -18.131 -11.379 1.00 54.27 O ATOM 1204 HH TYR B1678 -36.565 -18.937 -11.415 1.00 0.00 H ATOM 1205 H TYR B1678 -38.471 -14.734 -5.330 1.00 0.00 H ATOM 1206 N GLN B1679 -35.316 -15.803 -3.342 1.00 55.22 N ATOM 1207 CA GLN B1679 -34.715 -15.139 -2.193 1.00 60.88 C ATOM 1208 C GLN B1679 -33.661 -14.138 -2.652 1.00 55.81 C ATOM 1209 O GLN B1679 -32.930 -14.380 -3.610 1.00 56.21 O ATOM 1210 CB GLN B1679 -34.103 -16.174 -1.246 1.00 61.85 C ATOM 1211 CG GLN B1679 -33.723 -15.672 0.108 1.00 67.73 C ATOM 1212 CD GLN B1679 -34.784 -15.771 1.110 1.00 82.77 C ATOM 1213 OE1 GLN B1679 -35.098 -14.877 1.742 1.00 85.89 O ATOM 1214 NE2 GLN B1679 -35.359 -16.858 1.254 1.00 83.51 N ATOM 1215 HE22 GLN B1679 -35.075 -17.677 0.679 1.00 0.00 H ATOM 1216 HE21 GLN B1679 -36.126 -16.952 1.950 1.00 0.00 H ATOM 1217 H GLN B1679 -35.074 -16.793 -3.549 1.00 0.00 H ATOM 1218 N LEU B1680 -33.585 -13.012 -1.949 1.00 55.41 N ATOM 1219 CA LEU B1680 -32.587 -11.981 -2.186 1.00 55.47 C ATOM 1220 C LEU B1680 -31.477 -12.084 -1.139 1.00 61.46 C ATOM 1221 O LEU B1680 -31.753 -12.142 0.065 1.00 65.76 O ATOM 1222 CB LEU B1680 -33.239 -10.598 -2.138 1.00 54.26 C ATOM 1223 CG LEU B1680 -34.312 -10.218 -3.169 1.00 48.37 C ATOM 1224 CD1 LEU B1680 -35.038 -8.963 -2.701 1.00 48.01 C ATOM 1225 CD2 LEU B1680 -33.690 -9.989 -4.534 1.00 47.99 C ATOM 1226 H LEU B1680 -34.277 -12.860 -1.188 1.00 0.00 H ATOM 1227 N THR B1681 -30.231 -12.069 -1.599 1.00 58.82 N ATOM 1228 CA THR B1681 -29.051 -12.183 -0.753 1.00 57.77 C ATOM 1229 C THR B1681 -28.326 -10.850 -0.698 1.00 56.17 C ATOM 1230 O THR B1681 -27.985 -10.290 -1.742 1.00 58.21 O ATOM 1231 CB THR B1681 -28.101 -13.249 -1.299 1.00 67.31 C ATOM 1232 OG1 THR B1681 -28.773 -14.519 -1.320 1.00 74.83 O ATOM 1233 CG2 THR B1681 -26.839 -13.339 -0.439 1.00 71.03 C ATOM 1234 HG1 THR B1681 -28.159 -15.210 -1.673 1.00 0.00 H ATOM 1235 H THR B1681 -30.090 -11.970 -2.625 1.00 0.00 H ATOM 1236 N ALA B1682 -28.049 -10.372 0.507 1.00 65.69 N ATOM 1237 CA ALA B1682 -27.394 -9.090 0.726 1.00 66.51 C ATOM 1238 C ALA B1682 -25.908 -9.298 1.032 1.00 72.93 C ATOM 1239 O ALA B1682 -25.331 -10.344 0.708 1.00 76.40 O ATOM 1240 CB ALA B1682 -28.121 -8.332 1.841 1.00 68.71 C ATOM 1241 H ALA B1682 -28.312 -10.941 1.337 1.00 0.00 H ATOM 1242 N ALA B1683 -25.276 -8.294 1.638 1.00 80.41 N ATOM 1243 CA ALA B1683 -23.868 -8.372 2.032 1.00 85.82 C ATOM 1244 C ALA B1683 -23.642 -9.430 3.118 1.00 87.59 C ATOM 1245 O ALA B1683 -23.821 -9.173 4.314 1.00 84.09 O ATOM 1246 CB ALA B1683 -23.374 -7.004 2.511 1.00 89.18 C ATOM 1247 H ALA B1683 -25.803 -7.421 1.839 1.00 0.00 H TER 1248 ALA B1683 HETATM 1249 O HOH 1 -41.824 12.140 -0.834 1.00111.78 O HETATM 1250 O HOH 2 -36.565 -2.833 -20.866 1.00 58.39 O HETATM 1251 O HOH 3 -22.597 -5.754 -12.926 1.00 53.24 O HETATM 1252 O HOH 4 -22.171 -10.804 6.953 1.00 80.41 O HETATM 1253 O HOH 5 -27.202 -9.265 -28.641 1.00 70.53 O HETATM 1254 O HOH 6 -24.265 -4.462 -7.760 1.00 30.00 O HETATM 1255 O HOH 7 -11.508 -6.245 -22.813 1.00 83.11 O HETATM 1256 C1 IHP A 8 -22.973 3.514 -9.020 1.00 0.16 C HETATM 1257 C2 IHP A 8 -23.964 4.563 -8.533 1.00 0.16 C HETATM 1258 C3 IHP A 8 -24.825 5.227 -9.605 1.00 0.16 C HETATM 1259 C4 IHP A 8 -25.166 4.386 -10.866 1.00 0.16 C HETATM 1260 C5 IHP A 8 -24.441 3.016 -10.984 1.00 0.16 C HETATM 1261 C6 IHP A 8 -23.778 2.450 -9.744 1.00 0.16 C HETATM 1262 O16 IHP A 8 -22.843 1.625 -10.343 1.00 -0.27 O HETATM 1263 P6 IHP A 8 -22.575 0.181 -9.638 1.00 0.20 P HETATM 1264 O26 IHP A 8 -23.517 0.085 -8.455 1.00 -0.55 O HETATM 1265 O36 IHP A 8 -22.862 -0.949 -10.617 1.00 -0.55 O HETATM 1266 O46 IHP A 8 -21.105 0.316 -9.329 1.00 -0.55 O HETATM 1267 H6 IHP A 8 -24.480 1.933 -9.073 1.00 0.07 H HETATM 1268 O15 IHP A 8 -25.128 1.996 -11.651 1.00 -0.27 O HETATM 1269 P5 IHP A 8 -24.460 1.299 -13.000 1.00 0.20 P HETATM 1270 O25 IHP A 8 -25.347 1.673 -14.146 1.00 -0.55 O HETATM 1271 O35 IHP A 8 -23.040 1.721 -13.338 1.00 -0.55 O HETATM 1272 O45 IHP A 8 -24.471 -0.197 -12.774 1.00 -0.55 O HETATM 1273 H5 IHP A 8 -23.597 3.251 -11.650 1.00 0.07 H HETATM 1274 O14 IHP A 8 -26.549 4.538 -11.172 1.00 -0.27 O HETATM 1275 P4 IHP A 8 -27.705 3.487 -11.682 1.00 0.20 P HETATM 1276 O24 IHP A 8 -28.994 4.284 -11.730 1.00 -0.55 O HETATM 1277 O34 IHP A 8 -27.429 2.937 -13.066 1.00 -0.55 O HETATM 1278 O44 IHP A 8 -27.792 2.344 -10.696 1.00 -0.55 O HETATM 1279 H4 IHP A 8 -24.686 4.946 -11.682 1.00 0.07 H HETATM 1280 O13 IHP A 8 -26.017 5.715 -9.035 1.00 -0.27 O HETATM 1281 P3 IHP A 8 -26.285 7.344 -9.055 1.00 0.20 P HETATM 1282 O23 IHP A 8 -26.301 7.902 -7.641 1.00 -0.55 O HETATM 1283 O33 IHP A 8 -25.119 7.958 -9.792 1.00 -0.55 O HETATM 1284 O43 IHP A 8 -27.632 7.657 -9.664 1.00 -0.55 O HETATM 1285 H3 IHP A 8 -24.249 6.093 -9.962 1.00 0.07 H HETATM 1286 O12 IHP A 8 -23.208 5.613 -8.050 1.00 -0.27 O HETATM 1287 P2 IHP A 8 -23.284 5.928 -6.446 1.00 0.20 P HETATM 1288 O22 IHP A 8 -22.854 4.682 -5.698 1.00 -0.55 O HETATM 1289 O32 IHP A 8 -22.332 7.071 -6.185 1.00 -0.55 O HETATM 1290 O42 IHP A 8 -24.704 6.314 -6.087 1.00 -0.55 O HETATM 1291 H2 IHP A 8 -24.606 4.124 -7.755 1.00 0.07 H HETATM 1292 O11 IHP A 8 -22.149 4.094 -9.996 1.00 -0.27 O HETATM 1293 P1 IHP A 8 -20.522 4.363 -9.858 1.00 0.20 P HETATM 1294 O21 IHP A 8 -20.345 5.861 -10.066 1.00 -0.55 O HETATM 1295 O31 IHP A 8 -19.763 3.673 -10.963 1.00 -0.55 O HETATM 1296 O41 IHP A 8 -20.006 3.783 -8.562 1.00 -0.55 O HETATM 1297 H1 IHP A 8 -22.387 3.096 -8.188 1.00 0.07 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 1256 1257 1261 1292 1297 CONECT 1257 1256 1258 1286 1291 CONECT 1258 1257 1259 1280 1285 CONECT 1259 1258 1260 1274 1279 CONECT 1260 1259 1261 1268 1273 CONECT 1261 1256 1260 1262 1267 CONECT 1262 1261 1263 CONECT 1263 1262 1264 1265 1266 CONECT 1264 1263 CONECT 1265 1263 CONECT 1266 1263 CONECT 1267 1261 CONECT 1268 1260 1269 CONECT 1269 1268 1270 1271 1272 CONECT 1270 1269 CONECT 1271 1269 CONECT 1272 1269 CONECT 1273 1260 CONECT 1274 1259 1275 CONECT 1275 1274 1276 1277 1278 CONECT 1276 1275 CONECT 1277 1275 CONECT 1278 1275 CONECT 1279 1259 CONECT 1280 1258 1281 CONECT 1281 1280 1282 1283 1284 CONECT 1282 1281 CONECT 1283 1281 CONECT 1284 1281 CONECT 1285 1258 CONECT 1286 1257 1287 CONECT 1287 1286 1288 1289 1290 CONECT 1288 1287 CONECT 1289 1287 CONECT 1290 1287 CONECT 1291 1257 CONECT 1292 1256 1293 CONECT 1293 1292 1294 1295 1296 CONECT 1294 1293 CONECT 1295 1293 CONECT 1296 1293 CONECT 1297 1256 MASTER 0 0 0 0 0 0 0 0 1296 1 46 10 END
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Structure:
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Related entries of code: 6bu0
Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
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Complexes with the same small molecule ligand
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Ligand Name
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RCSB PDB
PDBbind
IHP
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PDBbind
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RCSB PDB
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RCSB PDB
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Entry Information
PDB ID
6bu0
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
PI3KC2alpha C2 domain
Ligand Name
IHP
EC.Number
E.C.2.7.1.154
Resolution
2.43(Å)
Affinity (Kd/Ki/IC50)
Kd=1.1uM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) Structure Vol. 26: pp. 1612-
Ligand Properties
Formula
C
6
H
2
4
O
2
4
P
6
Molecular Weight
666.083
Exact Mass
665.908
No. of atoms
60
No. of bonds
60
Polar Surface Area
501.06
LOGP Value
-11.25 (
Computed with XLOGP3
)
-5.76 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 18
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 24
No. of Rings: 1
Canonical SMILES
OP(O[C@@H]1[C@H](OP(O)(O)O)[C@H](OP(O)(O)O)[C@H]([C@H]([C@H]1OP(O)(O)O)OP(O)(O)O)OP(O)(O)O)(O)O
InChI String
InChI=1S/C6H30O24P6/c7-31(8,9)25-1-2(26-32(10,11)12)4(28-34(16,17)18)6(30-36(22,23)24)5(29-35(19,20)21)3(1)27-33(13,14)15/h1-24,31-36H/t1-,2-,3-,4-,5-,6-
Links to External Databases
RCSB PDB
The mother database
PDBsum
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Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
O00443
Entrez Gene ID
NCBI Entrez Gene ID:
5286
ASD
Information of known allosteric effects of PDB entries
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