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*** 20250218a-ElNemo ***elNémo ID: 2502181842392296656Job options:ID = 2502181842392296656 JOBID = 20250218a-ElNemo USERID = 20250218a-ElNemo-MM11 PRIVAT = 0 NMODES = 5 DQMIN = -100 DQMAX = 100 DQSTEP = 20 DOGRAPHS = on DOPROJMODS = 0 DORMSD = 0 NRBL = 0 CUTOFF = 0 CAONLY = 0 Input data for this run:HEADER 20250218a-ElNemo REMARK Number: 1 REMARK Ligand: lig_62544c8592c85.pdb REMARK Contact: 0 0 0 REMARK Score: -531.21 REMARK RMSD: 0.38 HELIX 1 1 ASP E 339 PHE E 342 1 4 HELIX 2 2 VAL E 350 ALA E 352 1 3 HELIX 3 3 SER E 366 ASN E 370 1 5 HELIX 4 4 PRO E 384 LYS E 386 1 3 HELIX 5 5 GLY E 404 GLU E 406 1 3 HELIX 6 6 ASN E 417 TYR E 421 1 5 HELIX 7 7 ASN E 439 ASP E 442 1 4 HELIX 8 8 ASP 62 VAL 64 1 3 HELIX 9 9 PRO 88 ASP 90 1 3 SHEET 1 1 1 ASN E 354 ILE E 358 0 SHEET 2 2 1 THR E 376 TYR E 380 0 SHEET 3 3 1 ASN E 394 ARG E 403 0 SHEET 4 4 1 GLY E 431 ASN E 437 0 SHEET 5 5 1 LEU E 452 ARG E 454 0 SHEET 6 6 1 LEU E 492 SER E 494 0 SHEET 7 7 1 PRO E 507 GLU E 516 0 SHEET 8 8 1 GLN 3 SER 7 0 SHEET 9 9 1 GLY 10 GLN 13 0 SHEET 10 10 1 LEU 18 SER 25 0 SHEET 11 11 1 TRP 33 GLN 39 0 SHEET 12 12 1 ARG 45 TYR 52 0 SHEET 13 13 1 THR 58 TYR 60 0 SHEET 14 14 1 PHE 68 ASP 73 0 SHEET 15 15 1 THR 78 MET 83 0 SHEET 16 16 1 ALA 92 TRP 99 0 SHEET 17 17 1 ASP 109 TRP 111 0 SHEET 18 18 1 THR 115 SER 120 0 TER 1560 GLY E 526 ATOM 1561 N GLN 1 48.466 -5.019 8.139 0.00 0.00 N ATOM 1562 CA GLN 1 48.233 -6.165 7.234 0.00 0.00 C ATOM 1563 CB GLN 1 49.467 -6.461 6.353 0.00 0.00 C ATOM 1564 CG GLN 1 50.248 -7.770 6.586 0.00 0.00 C ATOM 1565 CD GLN 1 49.783 -8.931 5.705 0.00 0.00 C ATOM 1566 OE1 GLN 1 48.675 -8.964 5.185 0.00 0.00 O ATOM 1567 NE2 GLN 1 50.622 -9.919 5.497 0.00 0.00 N ATOM 1568 C GLN 1 47.702 -7.322 8.072 0.00 0.00 C ATOM 1569 O GLN 1 47.958 -7.311 9.272 0.00 0.00 O ATOM 1570 N VAL 2 46.974 -8.271 7.470 0.00 0.00 N ATOM 1571 CA VAL 2 46.208 -9.321 8.171 0.00 0.00 C ATOM 1572 CB VAL 2 45.702 -10.392 7.184 0.00 0.00 C ATOM 1573 CG1 VAL 2 44.984 -11.554 7.882 0.00 0.00 C ATOM 1574 CG2 VAL 2 44.716 -9.807 6.166 0.00 0.00 C ATOM 1575 C VAL 2 47.023 -9.964 9.289 0.00 0.00 C ATOM 1576 O VAL 2 48.120 -10.477 9.067 0.00 0.00 O ATOM 1577 N GLN 3 46.474 -9.910 10.495 0.00 0.00 N ATOM 1578 CA GLN 3 47.149 -10.308 11.717 0.00 0.00 C ATOM 1579 CB GLN 3 47.922 -9.096 12.250 0.00 0.00 C ATOM 1580 CG GLN 3 48.505 -9.230 13.671 0.00 0.00 C ATOM 1581 CD GLN 3 48.512 -7.911 14.443 0.00 0.00 C ATOM 1582 OE1 GLN 3 48.122 -6.853 13.964 0.00 0.00 O ATOM 1583 NE2 GLN 3 48.928 -7.945 15.690 0.00 0.00 N ATOM 1584 C GLN 3 46.091 -10.786 12.699 0.00 0.00 C ATOM 1585 O GLN 3 45.078 -10.118 12.911 0.00 0.00 O ATOM 1586 N LEU 4 46.355 -11.946 13.282 0.00 0.00 N ATOM 1587 CA LEU 4 45.593 -12.536 14.368 0.00 0.00 C ATOM 1588 CB LEU 4 45.050 -13.907 13.935 0.00 0.00 C ATOM 1589 CG LEU 4 43.874 -13.857 12.941 0.00 0.00 C ATOM 1590 CD1 LEU 4 44.264 -13.542 11.493 0.00 0.00 C ATOM 1591 CD2 LEU 4 43.226 -15.239 12.901 0.00 0.00 C ATOM 1592 C LEU 4 46.529 -12.656 15.569 0.00 0.00 C ATOM 1593 O LEU 4 47.718 -12.931 15.393 0.00 0.00 O ATOM 1594 N VAL 5 46.000 -12.461 16.774 0.00 0.00 N ATOM 1595 CA VAL 5 46.740 -12.637 18.030 0.00 0.00 C ATOM 1596 CB VAL 5 47.269 -11.300 18.605 0.00 0.00 C ATOM 1597 CG1 VAL 5 48.194 -10.576 17.616 0.00 0.00 C ATOM 1598 CG2 VAL 5 46.187 -10.287 19.007 0.00 0.00 C ATOM 1599 C VAL 5 45.875 -13.411 19.018 0.00 0.00 C ATOM 1600 O VAL 5 44.811 -12.951 19.440 0.00 0.00 O ATOM 1601 N GLU 6 46.287 -14.632 19.345 0.00 0.00 N ATOM 1602 CA GLU 6 45.642 -15.438 20.375 0.00 0.00 C ATOM 1603 CB GLU 6 46.003 -16.929 20.258 0.00 0.00 C ATOM 1604 CG GLU 6 45.536 -17.589 18.954 0.00 0.00 C ATOM 1605 CD GLU 6 46.516 -17.437 17.789 0.00 0.00 C ATOM 1606 OE1 GLU 6 47.522 -16.696 17.914 0.00 0.00 O ATOM 1607 OE2 GLU 6 46.271 -18.102 16.755 0.00 0.00 O ATOM 1608 C GLU 6 45.977 -14.929 21.780 0.00 0.00 C ATOM 1609 O GLU 6 47.037 -14.364 22.052 0.00 0.00 O ATOM 1610 N SER 7 45.063 -15.184 22.708 0.00 0.00 N ATOM 1611 CA SER 7 45.248 -14.931 24.132 0.00 0.00 C ATOM 1612 CB SER 7 44.894 -13.475 24.464 0.00 0.00 C ATOM 1613 OG SER 7 43.509 -13.257 24.319 0.00 0.00 O ATOM 1614 C SER 7 44.422 -15.922 24.951 0.00 0.00 C ATOM 1615 O SER 7 43.503 -16.572 24.441 0.00 0.00 O ATOM 1616 N GLY 8 44.757 -16.053 26.234 0.00 0.00 N ATOM 1617 CA GLY 8 44.228 -17.103 27.103 0.00 0.00 C ATOM 1618 C GLY 8 45.012 -18.410 26.973 0.00 0.00 C ATOM 1619 O GLY 8 46.133 -18.428 26.469 0.00 0.00 O ATOM 1620 N GLY 9 44.427 -19.499 27.470 0.00 0.00 N ATOM 1621 CA GLY 9 45.102 -20.797 27.572 0.00 0.00 C ATOM 1622 C GLY 9 45.770 -20.977 28.935 0.00 0.00 C ATOM 1623 O GLY 9 45.211 -20.538 29.938 0.00 0.00 O ATOM 1624 N GLY 10 46.944 -21.613 28.969 0.00 0.00 N ATOM 1625 CA GLY 10 47.639 -21.970 30.211 0.00 0.00 C ATOM 1626 C GLY 10 47.300 -23.373 30.731 0.00 0.00 C ATOM 1627 O GLY 10 46.936 -24.263 29.962 0.00 0.00 O ATOM 1628 N LEU 11 47.471 -23.576 32.042 0.00 0.00 N ATOM 1629 CA LEU 11 47.358 -24.872 32.721 0.00 0.00 C ATOM 1630 CB LEU 11 48.699 -25.166 33.424 0.00 0.00 C ATOM 1631 CG LEU 11 48.739 -26.417 34.323 0.00 0.00 C ATOM 1632 CD1 LEU 11 48.506 -27.724 33.565 0.00 0.00 C ATOM 1633 CD2 LEU 11 50.119 -26.515 34.976 0.00 0.00 C ATOM 1634 C LEU 11 46.160 -24.923 33.686 0.00 0.00 C ATOM 1635 O LEU 11 46.003 -24.036 34.519 0.00 0.00 O ATOM 1636 N VAL 12 45.361 -25.992 33.629 0.00 0.00 N ATOM 1637 CA VAL 12 44.297 -26.306 34.606 0.00 0.00 C ATOM 1638 CB VAL 12 42.970 -25.598 34.224 0.00 0.00 C ATOM 1639 CG1 VAL 12 42.286 -26.178 32.985 0.00 0.00 C ATOM 1640 CG2 VAL 12 41.936 -25.586 35.357 0.00 0.00 C ATOM 1641 C VAL 12 44.186 -27.830 34.789 0.00 0.00 C ATOM 1642 O VAL 12 44.782 -28.591 34.030 0.00 0.00 O ATOM 1643 N GLN 13 43.483 -28.311 35.816 0.00 0.00 N ATOM 1644 CA GLN 13 43.178 -29.743 35.960 0.00 0.00 C ATOM 1645 CB GLN 13 42.778 -30.053 37.412 0.00 0.00 C ATOM 1646 CG GLN 13 43.916 -29.818 38.431 0.00 0.00 C ATOM 1647 CD GLN 13 43.616 -28.721 39.455 0.00 0.00 C ATOM 1648 OE1 GLN 13 43.067 -27.676 39.143 0.00 0.00 O ATOM 1649 NE2 GLN 13 43.971 -28.905 40.712 0.00 0.00 N ATOM 1650 C GLN 13 42.083 -30.215 34.978 0.00 0.00 C ATOM 1651 O GLN 13 41.269 -29.422 34.493 0.00 0.00 O ATOM 1652 N ALA 14 42.025 -31.522 34.716 0.00 0.00 N ATOM 1653 CA ALA 14 40.940 -32.162 33.974 0.00 0.00 C ATOM 1654 CB ALA 14 41.191 -33.675 33.937 0.00 0.00 C ATOM 1655 C ALA 14 39.559 -31.828 34.575 0.00 0.00 C ATOM 1656 O ALA 14 39.400 -31.651 35.783 0.00 0.00 O ATOM 1657 N GLY 15 38.542 -31.706 33.721 0.00 0.00 N ATOM 1658 CA GLY 15 37.205 -31.214 34.080 0.00 0.00 C ATOM 1659 C GLY 15 37.079 -29.685 34.195 0.00 0.00 C ATOM 1660 O GLY 15 35.959 -29.179 34.218 0.00 0.00 O ATOM 1661 N GLY 16 38.192 -28.940 34.206 0.00 0.00 N ATOM 1662 CA GLY 16 38.195 -27.478 34.248 0.00 0.00 C ATOM 1663 C GLY 16 37.721 -26.818 32.948 0.00 0.00 C ATOM 1664 O GLY 16 37.402 -27.484 31.957 0.00 0.00 O ATOM 1665 N SER 17 37.701 -25.482 32.952 0.00 0.00 N ATOM 1666 CA SER 17 37.367 -24.658 31.788 0.00 0.00 C ATOM 1667 CB SER 17 35.911 -24.177 31.852 0.00 0.00 C ATOM 1668 OG SER 17 35.700 -23.225 32.876 0.00 0.00 O ATOM 1669 C SER 17 38.339 -23.487 31.616 0.00 0.00 C ATOM 1670 O SER 17 38.860 -22.942 32.589 0.00 0.00 O ATOM 1671 N LEU 18 38.589 -23.116 30.362 0.00 0.00 N ATOM 1672 CA LEU 18 39.445 -22.006 29.945 0.00 0.00 C ATOM 1673 CB LEU 18 40.875 -22.496 29.602 0.00 0.00 C ATOM 1674 CG LEU 18 41.698 -23.104 30.759 0.00 0.00 C ATOM 1675 CD1 LEU 18 42.991 -23.734 30.232 0.00 0.00 C ATOM 1676 CD2 LEU 18 42.078 -22.058 31.809 0.00 0.00 C ATOM 1677 C LEU 18 38.800 -21.371 28.712 0.00 0.00 C ATOM 1678 O LEU 18 38.309 -22.090 27.845 0.00 0.00 O ATOM 1679 N ARG 19 38.847 -20.039 28.590 0.00 0.00 N ATOM 1680 CA ARG 19 38.467 -19.357 27.339 0.00 0.00 C ATOM 1681 CB ARG 19 37.237 -18.449 27.491 0.00 0.00 C ATOM 1682 CG ARG 19 37.391 -17.216 28.387 0.00 0.00 C ATOM 1683 CD ARG 19 37.809 -15.974 27.586 0.00 0.00 C ATOM 1684 NE ARG 19 38.167 -14.858 28.475 0.00 0.00 N ATOM 1685 CZ ARG 19 39.267 -14.758 29.206 0.00 0.00 C ATOM 1686 NH1 ARG 19 40.223 -15.654 29.201 0.00 0.00 N ATOM 1687 NH2 ARG 19 39.430 -13.713 29.967 0.00 0.00 N ATOM 1688 C ARG 19 39.652 -18.703 26.666 0.00 0.00 C ATOM 1689 O ARG 19 40.358 -17.901 27.290 0.00 0.00 O ATOM 1690 N LEU 20 39.832 -19.033 25.392 0.00 0.00 N ATOM 1691 CA LEU 20 40.720 -18.346 24.466 0.00 0.00 C ATOM 1692 CB LEU 20 41.180 -19.301 23.343 0.00 0.00 C ATOM 1693 CG LEU 20 41.741 -20.654 23.817 0.00 0.00 C ATOM 1694 CD1 LEU 20 42.236 -21.473 22.631 0.00 0.00 C ATOM 1695 CD2 LEU 20 42.915 -20.487 24.782 0.00 0.00 C ATOM 1696 C LEU 20 40.009 -17.117 23.889 0.00 0.00 C ATOM 1697 O LEU 20 38.776 -17.046 23.874 0.00 0.00 O ATOM 1698 N SER 21 40.799 -16.161 23.399 0.00 0.00 N ATOM 1699 CA SER 21 40.312 -14.980 22.677 0.00 0.00 C ATOM 1700 CB SER 21 40.011 -13.848 23.665 0.00 0.00 C ATOM 1701 OG SER 21 39.360 -12.770 23.023 0.00 0.00 O ATOM 1702 C SER 21 41.321 -14.536 21.618 0.00 0.00 C ATOM 1703 O SER 21 42.413 -14.083 21.959 0.00 0.00 O ATOM 1704 N CYS 22 40.968 -14.698 20.343 0.00 0.00 N ATOM 1705 CA CYS 22 41.733 -14.233 19.191 0.00 0.00 C ATOM 1706 CB CYS 22 41.579 -15.234 18.040 0.00 0.00 C ATOM 1707 SG CYS 22 42.266 -14.509 16.520 0.00 0.00 S ATOM 1708 C CYS 22 41.277 -12.833 18.765 0.00 0.00 C ATOM 1709 O CYS 22 40.246 -12.702 18.099 0.00 0.00 O ATOM 1710 N ALA 23 42.074 -11.814 19.079 0.00 0.00 N ATOM 1711 CA ALA 23 41.912 -10.484 18.495 0.00 0.00 C ATOM 1712 CB ALA 23 42.501 -9.434 19.444 0.00 0.00 C ATOM 1713 C ALA 23 42.507 -10.422 17.072 0.00 0.00 C ATOM 1714 O ALA 23 43.294 -11.280 16.663 0.00 0.00 O ATOM 1715 N ALA 24 42.113 -9.402 16.310 0.00 0.00 N ATOM 1716 CA ALA 24 42.328 -9.313 14.866 0.00 0.00 C ATOM 1717 CB ALA 24 41.034 -9.774 14.196 0.00 0.00 C ATOM 1718 C ALA 24 42.699 -7.894 14.398 0.00 0.00 C ATOM 1719 O ALA 24 42.252 -6.905 14.981 0.00 0.00 O ATOM 1720 N SER 25 43.456 -7.785 13.301 0.00 0.00 N ATOM 1721 CA SER 25 43.632 -6.524 12.565 0.00 0.00 C ATOM 1722 CB SER 25 44.879 -5.765 13.046 0.00 0.00 C ATOM 1723 OG SER 25 46.025 -6.099 12.289 0.00 0.00 O ATOM 1724 C SER 25 43.599 -6.736 11.041 0.00 0.00 C ATOM 1725 O SER 25 43.660 -7.866 10.556 0.00 0.00 O ATOM 1726 N GLU 26 43.455 -5.650 10.274 0.00 0.00 N ATOM 1727 CA GLU 26 43.167 -5.620 8.820 0.00 0.00 C ATOM 1728 CB GLU 26 44.304 -6.290 8.024 0.00 0.00 C ATOM 1729 CG GLU 26 44.542 -5.722 6.618 0.00 0.00 C ATOM 1730 CD GLU 26 45.074 -4.294 6.684 0.00 0.00 C ATOM 1731 OE1 GLU 26 46.133 -4.111 7.323 0.00 0.00 O ATOM 1732 OE2 GLU 26 44.432 -3.388 6.105 0.00 0.00 O ATOM 1733 C GLU 26 41.791 -6.168 8.379 0.00 0.00 C ATOM 1734 O GLU 26 41.452 -6.103 7.195 0.00 0.00 O ATOM 1735 N PHE 27 40.970 -6.668 9.301 0.00 0.00 N ATOM 1736 CA PHE 27 39.599 -7.094 9.031 0.00 0.00 C ATOM 1737 CB PHE 27 39.589 -8.570 8.600 0.00 0.00 C ATOM 1738 CG PHE 27 40.087 -9.557 9.637 0.00 0.00 C ATOM 1739 CD1 PHE 27 41.454 -9.873 9.712 0.00 0.00 C ATOM 1740 CE1 PHE 27 41.912 -10.823 10.639 0.00 0.00 C ATOM 1741 CZ PHE 27 40.994 -11.496 11.464 0.00 0.00 C ATOM 1742 CE2 PHE 27 39.633 -11.150 11.422 0.00 0.00 C ATOM 1743 CD2 PHE 27 39.182 -10.177 10.515 0.00 0.00 C ATOM 1744 C PHE 27 38.714 -6.862 10.257 0.00 0.00 C ATOM 1745 O PHE 27 39.220 -6.792 11.380 0.00 0.00 O ATOM 1746 N PHE 28 37.395 -6.783 10.045 0.00 0.00 N ATOM 1747 CA PHE 28 36.401 -6.871 11.124 0.00 0.00 C ATOM 1748 CB PHE 28 35.353 -5.753 11.020 0.00 0.00 C ATOM 1749 CG PHE 28 34.230 -6.022 10.041 0.00 0.00 C ATOM 1750 CD1 PHE 28 34.464 -5.905 8.663 0.00 0.00 C ATOM 1751 CE1 PHE 28 33.458 -6.242 7.746 0.00 0.00 C ATOM 1752 CZ PHE 28 32.207 -6.688 8.199 0.00 0.00 C ATOM 1753 CE2 PHE 28 31.950 -6.751 9.578 0.00 0.00 C ATOM 1754 CD2 PHE 28 32.962 -6.429 10.500 0.00 0.00 C ATOM 1755 C PHE 28 35.774 -8.277 11.234 0.00 0.00 C ATOM 1756 O PHE 28 35.502 -8.937 10.234 0.00 0.00 O ATOM 1757 N VAL 29 35.538 -8.752 12.460 0.00 0.00 N ATOM 1758 CA VAL 29 35.265 -10.165 12.831 0.00 0.00 C ATOM 1759 CB VAL 29 35.588 -10.306 14.340 0.00 0.00 C ATOM 1760 CG1 VAL 29 34.538 -9.612 15.206 0.00 0.00 C ATOM 1761 CG2 VAL 29 35.789 -11.730 14.854 0.00 0.00 C ATOM 1762 C VAL 29 33.900 -10.781 12.396 0.00 0.00 C ATOM 1763 O VAL 29 33.487 -11.819 12.920 0.00 0.00 O ATOM 1764 N TYR 30 33.182 -10.195 11.431 0.00 0.00 N ATOM 1765 CA TYR 30 31.995 -10.809 10.809 0.00 0.00 C ATOM 1766 CB TYR 30 30.696 -10.063 11.163 0.00 0.00 C ATOM 1767 CG TYR 30 29.484 -10.541 10.365 0.00 0.00 C ATOM 1768 CD1 TYR 30 28.685 -11.607 10.832 0.00 0.00 C ATOM 1769 CE1 TYR 30 27.623 -12.105 10.045 0.00 0.00 C ATOM 1770 CZ TYR 30 27.375 -11.545 8.773 0.00 0.00 C ATOM 1771 OH TYR 30 26.412 -12.041 7.952 0.00 0.00 O ATOM 1772 CE2 TYR 30 28.179 -10.494 8.306 0.00 0.00 C ATOM 1773 CD2 TYR 30 29.207 -9.969 9.107 0.00 0.00 C ATOM 1774 C TYR 30 32.204 -10.963 9.298 0.00 0.00 C ATOM 1775 O TYR 30 32.139 -10.001 8.532 0.00 0.00 O ATOM 1776 N PHE 31 32.487 -12.200 8.886 0.00 0.00 N ATOM 1777 CA PHE 31 32.761 -12.604 7.508 0.00 0.00 C ATOM 1778 CB PHE 31 34.097 -12.019 7.034 0.00 0.00 C ATOM 1779 CG PHE 31 35.376 -12.377 7.759 0.00 0.00 C ATOM 1780 CD1 PHE 31 35.582 -11.982 9.093 0.00 0.00 C ATOM 1781 CE1 PHE 31 36.800 -12.243 9.728 0.00 0.00 C ATOM 1782 CZ PHE 31 37.848 -12.844 9.017 0.00 0.00 C ATOM 1783 CE2 PHE 31 37.665 -13.196 7.669 0.00 0.00 C ATOM 1784 CD2 PHE 31 36.430 -12.970 7.048 0.00 0.00 C ATOM 1785 C PHE 31 32.677 -14.133 7.364 0.00 0.00 C ATOM 1786 O PHE 31 32.319 -14.819 8.324 0.00 0.00 O ATOM 1787 N ASP 32 32.905 -14.625 6.142 0.00 0.00 N ATOM 1788 CA ASP 32 32.630 -15.994 5.673 0.00 0.00 C ATOM 1789 CB ASP 32 33.432 -16.322 4.402 0.00 0.00 C ATOM 1790 CG ASP 32 34.951 -16.113 4.467 0.00 0.00 C ATOM 1791 OD1 ASP 32 35.464 -15.475 5.403 0.00 0.00 O ATOM 1792 OD2 ASP 32 35.625 -16.497 3.490 0.00 0.00 O ATOM 1793 C ASP 32 32.872 -17.094 6.702 0.00 0.00 C ATOM 1794 O ASP 32 31.935 -17.836 6.996 0.00 0.00 O ATOM 1795 N TRP 33 34.091 -17.186 7.236 0.00 0.00 N ATOM 1796 CA TRP 33 34.462 -18.163 8.253 0.00 0.00 C ATOM 1797 CB TRP 33 34.702 -19.551 7.620 0.00 0.00 C ATOM 1798 CG TRP 33 35.918 -19.805 6.765 0.00 0.00 C ATOM 1799 CD1 TRP 33 36.637 -18.890 6.072 0.00 0.00 C ATOM 1800 NE1 TRP 33 37.692 -19.503 5.432 0.00 0.00 N ATOM 1801 CE2 TRP 33 37.689 -20.865 5.641 0.00 0.00 C ATOM 1802 CZ2 TRP 33 38.526 -21.903 5.211 0.00 0.00 C ATOM 1803 CH2 TRP 33 38.277 -23.214 5.655 0.00 0.00 C ATOM 1804 CZ3 TRP 33 37.188 -23.469 6.507 0.00 0.00 C ATOM 1805 CE3 TRP 33 36.339 -22.419 6.918 0.00 0.00 C ATOM 1806 CD2 TRP 33 36.566 -21.089 6.494 0.00 0.00 C ATOM 1807 C TRP 33 35.677 -17.730 9.080 0.00 0.00 C ATOM 1808 O TRP 33 36.667 -17.231 8.550 0.00 0.00 O ATOM 1809 N MET 34 35.625 -18.003 10.383 0.00 0.00 N ATOM 1810 CA MET 34 36.804 -18.032 11.248 0.00 0.00 C ATOM 1811 CB MET 34 36.866 -16.807 12.163 0.00 0.00 C ATOM 1812 CG MET 34 37.068 -15.510 11.374 0.00 0.00 C ATOM 1813 SD MET 34 37.569 -14.118 12.414 0.00 0.00 S ATOM 1814 CE MET 34 39.315 -14.526 12.685 0.00 0.00 C ATOM 1815 C MET 34 36.804 -19.332 12.041 0.00 0.00 C ATOM 1816 O MET 34 35.747 -19.816 12.449 0.00 0.00 O ATOM 1817 N ALA 35 37.975 -19.919 12.249 0.00 0.00 N ATOM 1818 CA ALA 35 38.127 -21.248 12.819 0.00 0.00 C ATOM 1819 CB ALA 35 38.480 -22.222 11.689 0.00 0.00 C ATOM 1820 C ALA 35 39.152 -21.271 13.953 0.00 0.00 C ATOM 1821 O ALA 35 40.126 -20.530 13.940 0.00 0.00 O ATOM 1822 N TRP 36 38.950 -22.149 14.930 0.00 0.00 N ATOM 1823 CA TRP 36 39.995 -22.565 15.861 0.00 0.00 C ATOM 1824 CB TRP 36 39.492 -22.490 17.305 0.00 0.00 C ATOM 1825 CG TRP 36 39.536 -21.121 17.905 0.00 0.00 C ATOM 1826 CD1 TRP 36 38.525 -20.225 17.906 0.00 0.00 C ATOM 1827 NE1 TRP 36 38.922 -19.071 18.550 0.00 0.00 N ATOM 1828 CE2 TRP 36 40.221 -19.162 18.996 0.00 0.00 C ATOM 1829 CZ2 TRP 36 41.048 -18.281 19.703 0.00 0.00 C ATOM 1830 CH2 TRP 36 42.370 -18.664 19.985 0.00 0.00 C ATOM 1831 CZ3 TRP 36 42.838 -19.923 19.567 0.00 0.00 C ATOM 1832 CE3 TRP 36 41.987 -20.809 18.879 0.00 0.00 C ATOM 1833 CD2 TRP 36 40.655 -20.454 18.572 0.00 0.00 C ATOM 1834 C TRP 36 40.486 -23.967 15.495 0.00 0.00 C ATOM 1835 O TRP 36 39.715 -24.833 15.073 0.00 0.00 O ATOM 1836 N TYR 37 41.785 -24.168 15.690 0.00 0.00 N ATOM 1837 CA TYR 37 42.524 -25.418 15.550 0.00 0.00 C ATOM 1838 CB TYR 37 43.523 -25.308 14.384 0.00 0.00 C ATOM 1839 CG TYR 37 42.935 -25.427 12.996 0.00 0.00 C ATOM 1840 CD1 TYR 37 42.114 -24.405 12.491 0.00 0.00 C ATOM 1841 CE1 TYR 37 41.577 -24.514 11.199 0.00 0.00 C ATOM 1842 CZ TYR 37 41.876 -25.630 10.392 0.00 0.00 C ATOM 1843 OH TYR 37 41.363 -25.708 9.137 0.00 0.00 O ATOM 1844 CE2 TYR 37 42.705 -26.653 10.894 0.00 0.00 C ATOM 1845 CD2 TYR 37 43.238 -26.549 12.193 0.00 0.00 C ATOM 1846 C TYR 37 43.305 -25.697 16.835 0.00 0.00 C ATOM 1847 O TYR 37 43.482 -24.813 17.675 0.00 0.00 O ATOM 1848 N ARG 38 43.870 -26.901 16.916 0.00 0.00 N ATOM 1849 CA ARG 38 44.981 -27.244 17.799 0.00 0.00 C ATOM 1850 CB ARG 38 44.473 -28.099 18.969 0.00 0.00 C ATOM 1851 CG ARG 38 44.046 -29.525 18.577 0.00 0.00 C ATOM 1852 CD ARG 38 43.937 -30.473 19.774 0.00 0.00 C ATOM 1853 NE ARG 38 42.820 -30.134 20.672 0.00 0.00 N ATOM 1854 CZ ARG 38 41.801 -30.909 21.004 0.00 0.00 C ATOM 1855 NH1 ARG 38 41.506 -32.014 20.378 0.00 0.00 N ATOM 1856 NH2 ARG 38 41.053 -30.546 22.005 0.00 0.00 N ATOM 1857 C ARG 38 46.114 -27.912 17.026 0.00 0.00 C ATOM 1858 O ARG 38 45.880 -28.478 15.969 0.00 0.00 O ATOM 1859 N GLN 39 47.309 -27.927 17.602 0.00 0.00 N ATOM 1860 CA GLN 39 48.370 -28.882 17.298 0.00 0.00 C ATOM 1861 CB GLN 39 49.419 -28.227 16.385 0.00 0.00 C ATOM 1862 CG GLN 39 50.405 -29.246 15.790 0.00 0.00 C ATOM 1863 CD GLN 39 50.963 -28.843 14.423 0.00 0.00 C ATOM 1864 OE1 GLN 39 50.818 -27.729 13.934 0.00 0.00 O ATOM 1865 NE2 GLN 39 51.613 -29.749 13.742 0.00 0.00 N ATOM 1866 C GLN 39 48.936 -29.424 18.620 0.00 0.00 C ATOM 1867 O GLN 39 49.534 -28.692 19.415 0.00 0.00 O ATOM 1868 N ALA 40 48.660 -30.703 18.884 0.00 0.00 N ATOM 1869 CA ALA 40 49.186 -31.421 20.043 0.00 0.00 C ATOM 1870 CB ALA 40 48.286 -32.629 20.331 0.00 0.00 C ATOM 1871 C ALA 40 50.657 -31.832 19.806 0.00 0.00 C ATOM 1872 O ALA 40 51.073 -31.960 18.649 0.00 0.00 O ATOM 1873 N PRO 41 51.452 -32.076 20.865 0.00 0.00 N ATOM 1874 CD PRO 41 51.143 -31.849 22.270 0.00 0.00 C ATOM 1875 CG PRO 41 52.495 -31.759 22.973 0.00 0.00 C ATOM 1876 CB PRO 41 53.364 -32.710 22.149 0.00 0.00 C ATOM 1877 CA PRO 41 52.835 -32.526 20.719 0.00 0.00 C ATOM 1878 C PRO 41 52.937 -33.809 19.882 0.00 0.00 C ATOM 1879 O PRO 41 52.404 -34.851 20.259 0.00 0.00 O ATOM 1880 N GLY 42 53.630 -33.730 18.741 0.00 0.00 N ATOM 1881 CA GLY 42 53.840 -34.866 17.833 0.00 0.00 C ATOM 1882 C GLY 42 52.696 -35.185 16.857 0.00 0.00 C ATOM 1883 O GLY 42 52.735 -36.253 16.253 0.00 0.00 O ATOM 1884 N LYS 43 51.700 -34.302 16.693 0.00 0.00 N ATOM 1885 CA LYS 43 50.617 -34.441 15.696 0.00 0.00 C ATOM 1886 CB LYS 43 49.245 -34.331 16.370 0.00 0.00 C ATOM 1887 CG LYS 43 48.931 -35.397 17.424 0.00 0.00 C ATOM 1888 CD LYS 43 47.416 -35.341 17.651 0.00 0.00 C ATOM 1889 CE LYS 43 46.957 -36.048 18.923 0.00 0.00 C ATOM 1890 NZ LYS 43 45.485 -35.923 19.043 0.00 0.00 N ATOM 1891 C LYS 43 50.671 -33.392 14.584 0.00 0.00 C ATOM 1892 O LYS 43 51.290 -32.338 14.735 0.00 0.00 O ATOM 1893 N GLU 44 49.908 -33.635 13.524 0.00 0.00 N ATOM 1894 CA GLU 44 49.346 -32.619 12.629 0.00 0.00 C ATOM 1895 CB GLU 44 48.547 -33.308 11.503 0.00 0.00 C ATOM 1896 CG GLU 44 49.360 -34.258 10.600 0.00 0.00 C ATOM 1897 CD GLU 44 49.769 -35.602 11.235 0.00 0.00 C ATOM 1898 OE1 GLU 44 49.168 -35.984 12.272 0.00 0.00 O ATOM 1899 OE2 GLU 44 50.697 -36.225 10.677 0.00 0.00 O ATOM 1900 C GLU 44 48.434 -31.619 13.386 0.00 0.00 C ATOM 1901 O GLU 44 48.146 -31.784 14.576 0.00 0.00 O ATOM 1902 N ARG 45 47.970 -30.548 12.718 0.00 0.00 N ATOM 1903 CA ARG 45 47.030 -29.574 13.309 0.00 0.00 C ATOM 1904 CB ARG 45 47.408 -28.118 12.967 0.00 0.00 C ATOM 1905 CG ARG 45 47.381 -27.707 11.485 0.00 0.00 C ATOM 1906 CD ARG 45 48.402 -26.596 11.167 0.00 0.00 C ATOM 1907 NE ARG 45 48.080 -25.284 11.770 0.00 0.00 N ATOM 1908 CZ ARG 45 48.681 -24.689 12.789 0.00 0.00 C ATOM 1909 NH1 ARG 45 49.576 -25.246 13.551 0.00 0.00 N ATOM 1910 NH2 ARG 45 48.392 -23.460 13.081 0.00 0.00 N ATOM 1911 C ARG 45 45.559 -29.937 13.056 0.00 0.00 C ATOM 1912 O ARG 45 45.069 -29.792 11.941 0.00 0.00 O ATOM 1913 N GLU 46 44.861 -30.376 14.104 0.00 0.00 N ATOM 1914 CA GLU 46 43.424 -30.679 14.124 0.00 0.00 C ATOM 1915 CB GLU 46 43.025 -31.398 15.440 0.00 0.00 C ATOM 1916 CG GLU 46 43.739 -32.729 15.740 0.00 0.00 C ATOM 1917 CD GLU 46 43.673 -33.162 17.225 0.00 0.00 C ATOM 1918 OE1 GLU 46 44.695 -33.699 17.712 0.00 0.00 O ATOM 1919 OE2 GLU 46 42.639 -32.973 17.914 0.00 0.00 O ATOM 1920 C GLU 46 42.600 -29.386 14.025 0.00 0.00 C ATOM 1921 O GLU 46 42.831 -28.447 14.790 0.00 0.00 O ATOM 1922 N TRP 47 41.595 -29.350 13.148 0.00 0.00 N ATOM 1923 CA TRP 47 40.496 -28.380 13.241 0.00 0.00 C ATOM 1924 CB TRP 47 39.677 -28.391 11.940 0.00 0.00 C ATOM 1925 CG TRP 47 38.450 -27.538 11.984 0.00 0.00 C ATOM 1926 CD1 TRP 47 38.412 -26.200 11.816 0.00 0.00 C ATOM 1927 NE1 TRP 47 37.134 -25.738 12.062 0.00 0.00 N ATOM 1928 CE2 TRP 47 36.279 -26.763 12.396 0.00 0.00 C ATOM 1929 CZ2 TRP 47 34.925 -26.808 12.747 0.00 0.00 C ATOM 1930 CH2 TRP 47 34.357 -28.046 13.092 0.00 0.00 C ATOM 1931 CZ3 TRP 47 35.143 -29.205 13.082 0.00 0.00 C ATOM 1932 CE3 TRP 47 36.496 -29.150 12.713 0.00 0.00 C ATOM 1933 CD2 TRP 47 37.100 -27.928 12.362 0.00 0.00 C ATOM 1934 C TRP 47 39.623 -28.656 14.483 0.00 0.00 C ATOM 1935 O TRP 47 39.343 -29.811 14.799 0.00 0.00 O ATOM 1936 N VAL 48 39.191 -27.608 15.197 0.00 0.00 N ATOM 1937 CA VAL 48 38.504 -27.726 16.504 0.00 0.00 C ATOM 1938 CB VAL 48 39.391 -27.139 17.627 0.00 0.00 C ATOM 1939 CG1 VAL 48 38.711 -27.087 19.003 0.00 0.00 C ATOM 1940 CG2 VAL 48 40.677 -27.952 17.828 0.00 0.00 C ATOM 1941 C VAL 48 37.113 -27.085 16.505 0.00 0.00 C ATOM 1942 O VAL 48 36.163 -27.656 17.050 0.00 0.00 O ATOM 1943 N ALA 49 36.972 -25.894 15.930 0.00 0.00 N ATOM 1944 CA ALA 49 35.705 -25.170 15.863 0.00 0.00 C ATOM 1945 CB ALA 49 35.439 -24.498 17.220 0.00 0.00 C ATOM 1946 C ALA 49 35.731 -24.144 14.727 0.00 0.00 C ATOM 1947 O ALA 49 36.801 -23.749 14.267 0.00 0.00 O ATOM 1948 N ALA 50 34.564 -23.694 14.273 0.00 0.00 N ATOM 1949 CA ALA 50 34.432 -22.583 13.337 0.00 0.00 C ATOM 1950 CB ALA 50 34.687 -23.066 11.908 0.00 0.00 C ATOM 1951 C ALA 50 33.082 -21.873 13.450 0.00 0.00 C ATOM 1952 O ALA 50 32.069 -22.481 13.817 0.00 0.00 O ATOM 1953 N ILE 51 33.103 -20.584 13.120 0.00 0.00 N ATOM 1954 CA ILE 51 31.983 -19.657 13.188 0.00 0.00 C ATOM 1955 CB ILE 51 32.100 -18.777 14.456 0.00 0.00 C ATOM 1956 CG2 ILE 51 33.192 -17.695 14.333 0.00 0.00 C ATOM 1957 CG1 ILE 51 30.721 -18.192 14.819 0.00 0.00 C ATOM 1958 CD1 ILE 51 30.716 -17.337 16.089 0.00 0.00 C ATOM 1959 C ILE 51 31.887 -18.882 11.863 0.00 0.00 C ATOM 1960 O ILE 51 32.904 -18.467 11.307 0.00 0.00 O ATOM 1961 N TYR 52 30.667 -18.700 11.355 0.00 0.00 N ATOM 1962 CA TYR 52 30.404 -18.294 9.966 0.00 0.00 C ATOM 1963 CB TYR 52 29.773 -19.482 9.223 0.00 0.00 C ATOM 1964 CG TYR 52 30.647 -20.720 9.216 0.00 0.00 C ATOM 1965 CD1 TYR 52 31.530 -20.929 8.146 0.00 0.00 C ATOM 1966 CE1 TYR 52 32.408 -22.024 8.152 0.00 0.00 C ATOM 1967 CZ TYR 52 32.388 -22.934 9.224 0.00 0.00 C ATOM 1968 OH TYR 52 33.204 -24.023 9.205 0.00 0.00 O ATOM 1969 CE2 TYR 52 31.506 -22.720 10.307 0.00 0.00 C ATOM 1970 CD2 TYR 52 30.627 -21.625 10.295 0.00 0.00 C ATOM 1971 C TYR 52 29.516 -17.047 9.865 0.00 0.00 C ATOM 1972 O TYR 52 28.719 -16.769 10.770 0.00 0.00 O ATOM 1973 N SER 53 29.634 -16.279 8.777 0.00 0.00 N ATOM 1974 CA SER 53 28.670 -15.208 8.470 0.00 0.00 C ATOM 1975 CB SER 53 29.287 -14.134 7.568 0.00 0.00 C ATOM 1976 OG SER 53 29.710 -14.665 6.333 0.00 0.00 O ATOM 1977 C SER 53 27.374 -15.739 7.847 0.00 0.00 C ATOM 1978 O SER 53 26.349 -15.061 7.949 0.00 0.00 O ATOM 1979 N ALA 54 27.408 -16.942 7.254 0.00 0.00 N ATOM 1980 CA ALA 54 26.276 -17.608 6.611 0.00 0.00 C ATOM 1981 CB ALA 54 26.251 -17.223 5.129 0.00 0.00 C ATOM 1982 C ALA 54 26.305 -19.141 6.777 0.00 0.00 C ATOM 1983 O ALA 54 27.363 -19.741 6.982 0.00 0.00 O ATOM 1984 N GLY 55 25.116 -19.743 6.658 0.00 0.00 N ATOM 1985 CA GLY 55 24.827 -21.143 6.977 0.00 0.00 C ATOM 1986 C GLY 55 24.400 -21.345 8.425 0.00 0.00 C ATOM 1987 O GLY 55 24.003 -20.394 9.108 0.00 0.00 O ATOM 1988 N TYR 56 24.505 -22.579 8.925 0.00 0.00 N ATOM 1989 CA TYR 56 24.446 -22.784 10.372 0.00 0.00 C ATOM 1990 CB TYR 56 24.235 -24.259 10.728 0.00 0.00 C ATOM 1991 CG TYR 56 23.968 -24.420 12.210 0.00 0.00 C ATOM 1992 CD1 TYR 56 25.051 -24.506 13.098 0.00 0.00 C ATOM 1993 CE1 TYR 56 24.834 -24.497 14.488 0.00 0.00 C ATOM 1994 CZ TYR 56 23.524 -24.421 14.994 0.00 0.00 C ATOM 1995 OH TYR 56 23.340 -24.360 16.336 0.00 0.00 O ATOM 1996 CE2 TYR 56 22.427 -24.384 14.104 0.00 0.00 C ATOM 1997 CD2 TYR 56 22.652 -24.373 12.712 0.00 0.00 C ATOM 1998 C TYR 56 25.701 -22.173 11.024 0.00 0.00 C ATOM 1999 O TYR 56 26.823 -22.584 10.708 0.00 0.00 O ATOM 2000 N GLN 57 25.501 -21.195 11.924 0.00 0.00 N ATOM 2001 CA GLN 57 26.548 -20.257 12.371 0.00 0.00 C ATOM 2002 CB GLN 57 25.965 -19.206 13.349 0.00 0.00 C ATOM 2003 CG GLN 57 25.561 -17.867 12.696 0.00 0.00 C ATOM 2004 CD GLN 57 25.697 -16.672 13.653 0.00 0.00 C ATOM 2005 OE1 GLN 57 26.747 -16.387 14.214 0.00 0.00 O ATOM 2006 NE2 GLN 57 24.661 -15.888 13.881 0.00 0.00 N ATOM 2007 C GLN 57 27.776 -20.911 13.021 0.00 0.00 C ATOM 2008 O GLN 57 28.827 -20.279 13.008 0.00 0.00 O ATOM 2009 N THR 58 27.678 -22.136 13.551 0.00 0.00 N ATOM 2010 CA THR 58 28.724 -22.737 14.396 0.00 0.00 C ATOM 2011 CB THR 58 28.412 -22.499 15.885 0.00 0.00 C ATOM 2012 CG2 THR 58 29.454 -23.133 16.800 0.00 0.00 C ATOM 2013 OG1 THR 58 28.382 -21.121 16.173 0.00 0.00 O ATOM 2014 C THR 58 28.885 -24.237 14.157 0.00 0.00 C ATOM 2015 O THR 58 27.909 -24.983 14.197 0.00 0.00 O ATOM 2016 N ARG 59 30.118 -24.727 14.011 0.00 0.00 N ATOM 2017 CA ARG 59 30.393 -26.173 14.046 0.00 0.00 C ATOM 2018 CB ARG 59 30.313 -26.790 12.639 0.00 0.00 C ATOM 2019 CG ARG 59 31.414 -26.285 11.697 0.00 0.00 C ATOM 2020 CD ARG 59 31.032 -26.353 10.219 0.00 0.00 C ATOM 2021 NE ARG 59 29.841 -25.542 9.893 0.00 0.00 N ATOM 2022 CZ ARG 59 28.742 -25.981 9.305 0.00 0.00 C ATOM 2023 NH1 ARG 59 28.525 -27.229 9.020 0.00 0.00 N ATOM 2024 NH2 ARG 59 27.794 -25.167 8.959 0.00 0.00 N ATOM 2025 C ARG 59 31.673 -26.479 14.810 0.00 0.00 C ATOM 2026 O ARG 59 32.594 -25.665 14.850 0.00 0.00 O ATOM 2027 N TYR 60 31.687 -27.661 15.420 0.00 0.00 N ATOM 2028 CA TYR 60 32.727 -28.157 16.325 0.00 0.00 C ATOM 2029 CB TYR 60 32.183 -28.287 17.758 0.00 0.00 C ATOM 2030 CG TYR 60 31.296 -27.172 18.276 0.00 0.00 C ATOM 2031 CD1 TYR 60 31.860 -25.939 18.650 0.00 0.00 C ATOM 2032 CE1 TYR 60 31.052 -24.947 19.234 0.00 0.00 C ATOM 2033 CZ TYR 60 29.674 -25.184 19.450 0.00 0.00 C ATOM 2034 OH TYR 60 28.879 -24.248 20.038 0.00 0.00 O ATOM 2035 CE2 TYR 60 29.105 -26.401 19.020 0.00 0.00 C ATOM 2036 CD2 TYR 60 29.915 -27.397 18.444 0.00 0.00 C ATOM 2037 C TYR 60 33.225 -29.538 15.891 0.00 0.00 C ATOM 2038 O TYR 60 32.435 -30.343 15.396 0.00 0.00 O ATOM 2039 N ALA 61 34.501 -29.815 16.143 0.00 0.00 N ATOM 2040 CA ALA 61 35.089 -31.138 16.012 0.00 0.00 C ATOM 2041 CB ALA 61 36.610 -31.006 16.085 0.00 0.00 C ATOM 2042 C ALA 61 34.551 -32.105 17.070 0.00 0.00 C ATOM 2043 O ALA 61 34.249 -31.727 18.201 0.00 0.00 O ATOM 2044 N ASP 62 34.457 -33.369 16.679 0.00 0.00 N ATOM 2045 CA ASP 62 33.777 -34.438 17.410 0.00 0.00 C ATOM 2046 CB ASP 62 33.842 -35.711 16.556 0.00 0.00 C ATOM 2047 CG ASP 62 33.118 -35.523 15.215 0.00 0.00 C ATOM 2048 OD1 ASP 62 32.051 -36.152 15.058 0.00 0.00 O ATOM 2049 OD2 ASP 62 33.502 -34.646 14.403 0.00 0.00 O ATOM 2050 C ASP 62 34.267 -34.658 18.850 0.00 0.00 C ATOM 2051 O ASP 62 33.442 -34.773 19.755 0.00 0.00 O ATOM 2052 N SER 63 35.578 -34.612 19.109 0.00 0.00 N ATOM 2053 CA SER 63 36.149 -34.720 20.470 0.00 0.00 C ATOM 2054 CB SER 63 37.683 -34.676 20.402 0.00 0.00 C ATOM 2055 OG SER 63 38.184 -35.500 19.365 0.00 0.00 O ATOM 2056 C SER 63 35.682 -33.615 21.439 0.00 0.00 C ATOM 2057 O SER 63 35.825 -33.741 22.662 0.00 0.00 O ATOM 2058 N VAL 64 35.152 -32.513 20.893 0.00 0.00 N ATOM 2059 CA VAL 64 34.763 -31.295 21.618 0.00 0.00 C ATOM 2060 CB VAL 64 35.775 -30.149 21.387 0.00 0.00 C ATOM 2061 CG1 VAL 64 37.227 -30.595 21.625 0.00 0.00 C ATOM 2062 CG2 VAL 64 35.698 -29.528 19.989 0.00 0.00 C ATOM 2063 C VAL 64 33.318 -30.857 21.329 0.00 0.00 C ATOM 2064 O VAL 64 32.887 -29.836 21.869 0.00 0.00 O ATOM 2065 N LYS 65 32.541 -31.617 20.532 0.00 0.00 N ATOM 2066 CA LYS 65 31.104 -31.374 20.292 0.00 0.00 C ATOM 2067 CB LYS 65 30.503 -32.424 19.311 0.00 0.00 C ATOM 2068 CG LYS 65 30.774 -32.146 17.809 0.00 0.00 C ATOM 2069 CD LYS 65 30.251 -33.234 16.836 0.00 0.00 C ATOM 2070 CE LYS 65 30.739 -32.999 15.385 0.00 0.00 C ATOM 2071 NZ LYS 65 30.400 -34.115 14.453 0.00 0.00 N ATOM 2072 C LYS 65 30.373 -31.338 21.649 0.00 0.00 C ATOM 2073 O LYS 65 30.463 -32.268 22.444 0.00 0.00 O ATOM 2074 N GLY 66 29.706 -30.218 21.935 0.00 0.00 N ATOM 2075 CA GLY 66 29.044 -29.941 23.219 0.00 0.00 C ATOM 2076 C GLY 66 29.969 -29.519 24.373 0.00 0.00 C ATOM 2077 O GLY 66 29.487 -28.918 25.331 0.00 0.00 O ATOM 2078 N ARG 67 31.288 -29.763 24.290 0.00 0.00 N ATOM 2079 CA ARG 67 32.264 -29.354 25.323 0.00 0.00 C ATOM 2080 CB ARG 67 33.468 -30.314 25.385 0.00 0.00 C ATOM 2081 CG ARG 67 33.062 -31.766 25.689 0.00 0.00 C ATOM 2082 CD ARG 67 34.205 -32.588 26.306 0.00 0.00 C ATOM 2083 NE ARG 67 35.356 -32.762 25.398 0.00 0.00 N ATOM 2084 CZ ARG 67 36.597 -32.345 25.593 0.00 0.00 C ATOM 2085 NH1 ARG 67 36.994 -31.652 26.614 0.00 0.00 N ATOM 2086 NH2 ARG 67 37.518 -32.653 24.736 0.00 0.00 N ATOM 2087 C ARG 67 32.752 -27.920 25.140 0.00 0.00 C ATOM 2088 O ARG 67 32.954 -27.227 26.135 0.00 0.00 O ATOM 2089 N PHE 68 32.990 -27.474 23.908 0.00 0.00 N ATOM 2090 CA PHE 68 33.476 -26.115 23.638 0.00 0.00 C ATOM 2091 CB PHE 68 34.732 -26.148 22.747 0.00 0.00 C ATOM 2092 CG PHE 68 35.981 -26.880 23.234 0.00 0.00 C ATOM 2093 CD1 PHE 68 36.075 -27.498 24.501 0.00 0.00 C ATOM 2094 CE1 PHE 68 37.232 -28.203 24.873 0.00 0.00 C ATOM 2095 CZ PHE 68 38.336 -28.248 24.009 0.00 0.00 C ATOM 2096 CE2 PHE 68 38.271 -27.594 22.767 0.00 0.00 C ATOM 2097 CD2 PHE 68 37.094 -26.934 22.372 0.00 0.00 C ATOM 2098 C PHE 68 32.370 -25.254 23.015 0.00 0.00 C ATOM 2099 O PHE 68 31.454 -25.777 22.382 0.00 0.00 O ATOM 2100 N THR 69 32.488 -23.929 23.134 0.00 0.00 N ATOM 2101 CA THR 69 31.657 -22.960 22.416 0.00 0.00 C ATOM 2102 CB THR 69 30.408 -22.542 23.208 0.00 0.00 C ATOM 2103 CG2 THR 69 30.666 -21.616 24.395 0.00 0.00 C ATOM 2104 OG1 THR 69 29.520 -21.898 22.323 0.00 0.00 O ATOM 2105 C THR 69 32.494 -21.791 21.888 0.00 0.00 C ATOM 2106 O THR 69 33.365 -21.248 22.567 0.00 0.00 O ATOM 2107 N ILE 70 32.242 -21.429 20.633 0.00 0.00 N ATOM 2108 CA ILE 70 32.941 -20.393 19.862 0.00 0.00 C ATOM 2109 CB ILE 70 33.510 -20.982 18.544 0.00 0.00 C ATOM 2110 CG2 ILE 70 32.400 -21.541 17.637 0.00 0.00 C ATOM 2111 CG1 ILE 70 34.379 -19.963 17.772 0.00 0.00 C ATOM 2112 CD1 ILE 70 35.035 -20.517 16.499 0.00 0.00 C ATOM 2113 C ILE 70 32.001 -19.203 19.647 0.00 0.00 C ATOM 2114 O ILE 70 30.810 -19.388 19.383 0.00 0.00 O ATOM 2115 N SER 71 32.528 -17.984 19.760 0.00 0.00 N ATOM 2116 CA SER 71 31.741 -16.754 19.606 0.00 0.00 C ATOM 2117 CB SER 71 31.072 -16.387 20.938 0.00 0.00 C ATOM 2118 OG SER 71 32.040 -15.989 21.885 0.00 0.00 O ATOM 2119 C SER 71 32.590 -15.599 19.068 0.00 0.00 C ATOM 2120 O SER 71 33.819 -15.671 19.039 0.00 0.00 O ATOM 2121 N ARG 72 31.919 -14.530 18.615 0.00 0.00 N ATOM 2122 CA ARG 72 32.540 -13.272 18.180 0.00 0.00 C ATOM 2123 CB ARG 72 32.345 -13.031 16.665 0.00 0.00 C ATOM 2124 CG ARG 72 30.901 -12.677 16.249 0.00 0.00 C ATOM 2125 CD ARG 72 30.744 -12.349 14.759 0.00 0.00 C ATOM 2126 NE ARG 72 30.863 -13.532 13.890 0.00 0.00 N ATOM 2127 CZ ARG 72 29.907 -14.392 13.580 0.00 0.00 C ATOM 2128 NH1 ARG 72 28.708 -14.345 14.095 0.00 0.00 N ATOM 2129 NH2 ARG 72 30.153 -15.319 12.712 0.00 0.00 N ATOM 2130 C ARG 72 32.021 -12.110 19.023 0.00 0.00 C ATOM 2131 O ARG 72 30.819 -12.042 19.266 0.00 0.00 O ATOM 2132 N ASP 73 32.884 -11.173 19.403 0.00 0.00 N ATOM 2133 CA ASP 73 32.468 -9.818 19.786 0.00 0.00 C ATOM 2134 CB ASP 73 32.933 -9.463 21.209 0.00 0.00 C ATOM 2135 CG ASP 73 32.566 -8.044 21.678 0.00 0.00 C ATOM 2136 OD1 ASP 73 32.472 -7.116 20.845 0.00 0.00 O ATOM 2137 OD2 ASP 73 32.438 -7.857 22.910 0.00 0.00 O ATOM 2138 C ASP 73 32.963 -8.852 18.711 0.00 0.00 C ATOM 2139 O ASP 73 34.165 -8.690 18.507 0.00 0.00 O ATOM 2140 N ASN 74 32.016 -8.230 18.006 0.00 0.00 N ATOM 2141 CA ASN 74 32.292 -7.323 16.891 0.00 0.00 C ATOM 2142 CB ASN 74 30.989 -7.044 16.123 0.00 0.00 C ATOM 2143 CG ASN 74 30.203 -8.304 15.826 0.00 0.00 C ATOM 2144 OD1 ASN 74 30.561 -9.135 15.013 0.00 0.00 O ATOM 2145 ND2 ASN 74 29.112 -8.509 16.522 0.00 0.00 N ATOM 2146 C ASN 74 32.953 -6.008 17.329 0.00 0.00 C ATOM 2147 O ASN 74 33.758 -5.455 16.591 0.00 0.00 O ATOM 2148 N ALA 75 32.611 -5.498 18.515 0.00 0.00 N ATOM 2149 CA ALA 75 33.092 -4.214 19.027 0.00 0.00 C ATOM 2150 CB ALA 75 32.074 -3.690 20.047 0.00 0.00 C ATOM 2151 C ALA 75 34.494 -4.329 19.648 0.00 0.00 C ATOM 2152 O ALA 75 35.282 -3.389 19.589 0.00 0.00 O ATOM 2153 N LYS 76 34.814 -5.498 20.218 0.00 0.00 N ATOM 2154 CA LYS 76 36.172 -5.888 20.641 0.00 0.00 C ATOM 2155 CB LYS 76 36.080 -6.813 21.864 0.00 0.00 C ATOM 2156 CG LYS 76 35.440 -6.138 23.086 0.00 0.00 C ATOM 2157 CD LYS 76 35.321 -7.148 24.238 0.00 0.00 C ATOM 2158 CE LYS 76 34.483 -6.633 25.415 0.00 0.00 C ATOM 2159 NZ LYS 76 33.084 -6.358 25.004 0.00 0.00 N ATOM 2160 C LYS 76 36.988 -6.547 19.514 0.00 0.00 C ATOM 2161 O LYS 76 38.130 -6.923 19.749 0.00 0.00 O ATOM 2162 N ASN 77 36.402 -6.730 18.329 0.00 0.00 N ATOM 2163 CA ASN 77 36.991 -7.347 17.135 0.00 0.00 C ATOM 2164 CB ASN 77 37.846 -6.322 16.364 0.00 0.00 C ATOM 2165 CG ASN 77 38.007 -6.758 14.921 0.00 0.00 C ATOM 2166 OD1 ASN 77 37.043 -7.177 14.301 0.00 0.00 O ATOM 2167 ND2 ASN 77 39.180 -6.675 14.332 0.00 0.00 N ATOM 2168 C ASN 77 37.722 -8.678 17.395 0.00 0.00 C ATOM 2169 O ASN 77 38.903 -8.830 17.073 0.00 0.00 O ATOM 2170 N THR 78 37.039 -9.629 18.034 0.00 0.00 N ATOM 2171 CA THR 78 37.704 -10.809 18.594 0.00 0.00 C ATOM 2172 CB THR 78 38.228 -10.468 19.997 0.00 0.00 C ATOM 2173 CG2 THR 78 37.118 -10.269 21.024 0.00 0.00 C ATOM 2174 OG1 THR 78 39.025 -11.500 20.504 0.00 0.00 O ATOM 2175 C THR 78 36.832 -12.063 18.561 0.00 0.00 C ATOM 2176 O THR 78 35.609 -11.980 18.687 0.00 0.00 O ATOM 2177 N VAL 79 37.470 -13.227 18.385 0.00 0.00 N ATOM 2178 CA VAL 79 36.859 -14.570 18.374 0.00 0.00 C ATOM 2179 CB VAL 79 37.288 -15.414 17.153 0.00 0.00 C ATOM 2180 CG1 VAL 79 36.569 -16.772 17.098 0.00 0.00 C ATOM 2181 CG2 VAL 79 37.011 -14.704 15.830 0.00 0.00 C ATOM 2182 C VAL 79 37.233 -15.330 19.644 0.00 0.00 C ATOM 2183 O VAL 79 38.394 -15.710 19.832 0.00 0.00 O ATOM 2184 N TYR 80 36.256 -15.596 20.503 0.00 0.00 N ATOM 2185 CA TYR 80 36.443 -16.430 21.684 0.00 0.00 C ATOM 2186 CB TYR 80 35.452 -16.064 22.789 0.00 0.00 C ATOM 2187 CG TYR 80 35.503 -14.614 23.207 0.00 0.00 C ATOM 2188 CD1 TYR 80 34.685 -13.670 22.562 0.00 0.00 C ATOM 2189 CE1 TYR 80 34.767 -12.314 22.921 0.00 0.00 C ATOM 2190 CZ TYR 80 35.666 -11.906 23.928 0.00 0.00 C ATOM 2191 OH TYR 80 35.764 -10.586 24.234 0.00 0.00 O ATOM 2192 CE2 TYR 80 36.478 -12.857 24.583 0.00 0.00 C ATOM 2193 CD2 TYR 80 36.399 -14.214 24.215 0.00 0.00 C ATOM 2194 C TYR 80 36.287 -17.907 21.352 0.00 0.00 C ATOM 2195 O TYR 80 35.489 -18.278 20.490 0.00 0.00 O ATOM 2196 N LEU 81 36.970 -18.754 22.118 0.00 0.00 N ATOM 2197 CA LEU 81 36.621 -20.165 22.281 0.00 0.00 C ATOM 2198 CB LEU 81 37.596 -21.049 21.483 0.00 0.00 C ATOM 2199 CG LEU 81 37.284 -22.559 21.539 0.00 0.00 C ATOM 2200 CD1 LEU 81 36.054 -22.916 20.707 0.00 0.00 C ATOM 2201 CD2 LEU 81 38.472 -23.349 20.988 0.00 0.00 C ATOM 2202 C LEU 81 36.599 -20.477 23.778 0.00 0.00 C ATOM 2203 O LEU 81 37.655 -20.605 24.399 0.00 0.00 O ATOM 2204 N GLN 82 35.406 -20.542 24.368 0.00 0.00 N ATOM 2205 CA GLN 82 35.194 -21.023 25.727 0.00 0.00 C ATOM 2206 CB GLN 82 33.901 -20.425 26.308 0.00 0.00 C ATOM 2207 CG GLN 82 33.486 -21.019 27.665 0.00 0.00 C ATOM 2208 CD GLN 82 34.466 -20.696 28.789 0.00 0.00 C ATOM 2209 OE1 GLN 82 34.545 -19.584 29.274 0.00 0.00 O ATOM 2210 NE2 GLN 82 35.266 -21.629 29.248 0.00 0.00 N ATOM 2211 C GLN 82 35.200 -22.548 25.688 0.00 0.00 C ATOM 2212 O GLN 82 34.321 -23.183 25.108 0.00 0.00 O ATOM 2213 N MET 83 36.218 -23.138 26.297 0.00 0.00 N ATOM 2214 CA MET 83 36.461 -24.574 26.337 0.00 0.00 C ATOM 2215 CB MET 83 37.944 -24.847 26.017 0.00 0.00 C ATOM 2216 CG MET 83 38.409 -24.259 24.675 0.00 0.00 C ATOM 2217 SD MET 83 40.191 -23.979 24.499 0.00 0.00 S ATOM 2218 CE MET 83 40.850 -25.661 24.538 0.00 0.00 C ATOM 2219 C MET 83 36.084 -25.076 27.731 0.00 0.00 C ATOM 2220 O MET 83 36.668 -24.622 28.715 0.00 0.00 O ATOM 2221 N ASN 84 35.092 -25.962 27.844 0.00 0.00 N ATOM 2222 CA ASN 84 34.641 -26.516 29.124 0.00 0.00 C ATOM 2223 CB ASN 84 33.134 -26.256 29.319 0.00 0.00 C ATOM 2224 CG ASN 84 32.722 -24.809 29.112 0.00 0.00 C ATOM 2225 OD1 ASN 84 33.454 -23.874 29.395 0.00 0.00 O ATOM 2226 ND2 ASN 84 31.520 -24.576 28.634 0.00 0.00 N ATOM 2227 C ASN 84 34.967 -28.007 29.224 0.00 0.00 C ATOM 2228 O ASN 84 35.234 -28.660 28.212 0.00 0.00 O ATOM 2229 N SER 85 34.887 -28.557 30.442 0.00 0.00 N ATOM 2230 CA SER 85 34.980 -30.002 30.688 0.00 0.00 C ATOM 2231 CB SER 85 33.681 -30.702 30.258 0.00 0.00 C ATOM 2232 OG SER 85 32.545 -30.080 30.835 0.00 0.00 O ATOM 2233 C SER 85 36.226 -30.610 30.022 0.00 0.00 C ATOM 2234 O SER 85 36.134 -31.619 29.316 0.00 0.00 O ATOM 2235 N LEU 86 37.363 -29.916 30.159 0.00 0.00 N ATOM 2236 CA LEU 86 38.634 -30.221 29.499 0.00 0.00 C ATOM 2237 CB LEU 86 39.655 -29.130 29.863 0.00 0.00 C ATOM 2238 CG LEU 86 39.361 -27.738 29.269 0.00 0.00 C ATOM 2239 CD1 LEU 86 40.152 -26.651 30.002 0.00 0.00 C ATOM 2240 CD2 LEU 86 39.759 -27.700 27.792 0.00 0.00 C ATOM 2241 C LEU 86 39.176 -31.608 29.885 0.00 0.00 C ATOM 2242 O LEU 86 38.925 -32.089 30.988 0.00 0.00 O ATOM 2243 N LYS 87 39.963 -32.235 29.011 0.00 0.00 N ATOM 2244 CA LYS 87 40.617 -33.535 29.236 0.00 0.00 C ATOM 2245 CB LYS 87 39.823 -34.639 28.511 0.00 0.00 C ATOM 2246 CG LYS 87 38.456 -34.934 29.160 0.00 0.00 C ATOM 2247 CD LYS 87 37.744 -36.122 28.489 0.00 0.00 C ATOM 2248 CE LYS 87 37.176 -35.746 27.112 0.00 0.00 C ATOM 2249 NZ LYS 87 37.161 -36.903 26.188 0.00 0.00 N ATOM 2250 C LYS 87 42.071 -33.482 28.750 0.00 0.00 C ATOM 2251 O LYS 87 42.370 -32.654 27.897 0.00 0.00 O ATOM 2252 N PRO 88 42.980 -34.370 29.197 0.00 0.00 N ATOM 2253 CD PRO 88 42.832 -35.278 30.326 0.00 0.00 C ATOM 2254 CG PRO 88 44.255 -35.552 30.807 0.00 0.00 C ATOM 2255 CB PRO 88 45.063 -35.502 29.514 0.00 0.00 C ATOM 2256 CA PRO 88 44.385 -34.358 28.757 0.00 0.00 C ATOM 2257 C PRO 88 44.601 -34.471 27.239 0.00 0.00 C ATOM 2258 O PRO 88 45.589 -33.955 26.715 0.00 0.00 O ATOM 2259 N GLU 89 43.635 -35.055 26.520 0.00 0.00 N ATOM 2260 CA GLU 89 43.571 -35.048 25.041 0.00 0.00 C ATOM 2261 CB GLU 89 42.359 -35.884 24.577 0.00 0.00 C ATOM 2262 CG GLU 89 41.012 -35.136 24.678 0.00 0.00 C ATOM 2263 CD GLU 89 39.820 -36.058 24.932 0.00 0.00 C ATOM 2264 OE1 GLU 89 39.847 -36.816 25.930 0.00 0.00 O ATOM 2265 OE2 GLU 89 38.780 -35.954 24.240 0.00 0.00 O ATOM 2266 C GLU 89 43.497 -33.636 24.423 0.00 0.00 C ATOM 2267 O GLU 89 43.845 -33.447 23.258 0.00 0.00 O ATOM 2268 N ASP 90 43.050 -32.642 25.196 0.00 0.00 N ATOM 2269 CA ASP 90 42.985 -31.234 24.818 0.00 0.00 C ATOM 2270 CB ASP 90 41.838 -30.532 25.570 0.00 0.00 C ATOM 2271 CG ASP 90 40.473 -31.214 25.440 0.00 0.00 C ATOM 2272 OD1 ASP 90 40.096 -31.641 24.325 0.00 0.00 O ATOM 2273 OD2 ASP 90 39.699 -31.233 26.420 0.00 0.00 O ATOM 2274 C ASP 90 44.309 -30.479 25.022 0.00 0.00 C ATOM 2275 O ASP 90 44.397 -29.322 24.605 0.00 0.00 O ATOM 2276 N THR 91 45.335 -31.095 25.627 0.00 0.00 N ATOM 2277 CA THR 91 46.678 -30.500 25.771 0.00 0.00 C ATOM 2278 CB THR 91 47.613 -31.376 26.621 0.00 0.00 C ATOM 2279 CG2 THR 91 49.066 -30.886 26.641 0.00 0.00 C ATOM 2280 OG1 THR 91 47.188 -31.356 27.961 0.00 0.00 O ATOM 2281 C THR 91 47.317 -30.272 24.405 0.00 0.00 C ATOM 2282 O THR 91 47.775 -31.217 23.756 0.00 0.00 O ATOM 2283 N ALA 92 47.370 -29.015 23.965 0.00 0.00 N ATOM 2284 CA ALA 92 47.857 -28.633 22.649 0.00 0.00 C ATOM 2285 CB ALA 92 46.820 -29.090 21.622 0.00 0.00 C ATOM 2286 C ALA 92 48.075 -27.120 22.532 0.00 0.00 C ATOM 2287 O ALA 92 47.544 -26.338 23.321 0.00 0.00 O ATOM 2288 N VAL 93 48.820 -26.718 21.495 0.00 0.00 N ATOM 2289 CA VAL 93 48.914 -25.318 21.060 0.00 0.00 C ATOM 2290 CB VAL 93 50.259 -24.994 20.383 0.00 0.00 C ATOM 2291 CG1 VAL 93 50.344 -23.493 20.080 0.00 0.00 C ATOM 2292 CG2 VAL 93 51.462 -25.367 21.258 0.00 0.00 C ATOM 2293 C VAL 93 47.745 -25.019 20.131 0.00 0.00 C ATOM 2294 O VAL 93 47.645 -25.581 19.041 0.00 0.00 O ATOM 2295 N TYR 94 46.831 -24.166 20.573 0.00 0.00 N ATOM 2296 CA TYR 94 45.658 -23.739 19.811 0.00 0.00 C ATOM 2297 CB TYR 94 44.478 -23.433 20.740 0.00 0.00 C ATOM 2298 CG TYR 94 43.912 -24.690 21.364 0.00 0.00 C ATOM 2299 CD1 TYR 94 44.648 -25.334 22.368 0.00 0.00 C ATOM 2300 CE1 TYR 94 44.212 -26.559 22.886 0.00 0.00 C ATOM 2301 CZ TYR 94 43.004 -27.122 22.438 0.00 0.00 C ATOM 2302 OH TYR 94 42.597 -28.308 22.952 0.00 0.00 O ATOM 2303 CE2 TYR 94 42.250 -26.477 21.435 0.00 0.00 C ATOM 2304 CD2 TYR 94 42.716 -25.265 20.886 0.00 0.00 C ATOM 2305 C TYR 94 45.996 -22.552 18.927 0.00 0.00 C ATOM 2306 O TYR 94 46.811 -21.722 19.307 0.00 0.00 O ATOM 2307 N TYR 95 45.369 -22.477 17.756 0.00 0.00 N ATOM 2308 CA TYR 95 45.548 -21.400 16.786 0.00 0.00 C ATOM 2309 CB TYR 95 46.451 -21.833 15.626 0.00 0.00 C ATOM 2310 CG TYR 95 47.850 -22.294 15.970 0.00 0.00 C ATOM 2311 CD1 TYR 95 48.075 -23.615 16.406 0.00 0.00 C ATOM 2312 CE1 TYR 95 49.384 -24.055 16.669 0.00 0.00 C ATOM 2313 CZ TYR 95 50.477 -23.183 16.474 0.00 0.00 C ATOM 2314 OH TYR 95 51.743 -23.625 16.673 0.00 0.00 O ATOM 2315 CE2 TYR 95 50.250 -21.872 16.012 0.00 0.00 C ATOM 2316 CD2 TYR 95 48.939 -21.424 15.774 0.00 0.00 C ATOM 2317 C TYR 95 44.196 -21.008 16.206 0.00 0.00 C ATOM 2318 O TYR 95 43.393 -21.886 15.881 0.00 0.00 O ATOM 2319 N CYS 96 43.969 -19.713 16.031 0.00 0.00 N ATOM 2320 CA CYS 96 42.879 -19.210 15.206 0.00 0.00 C ATOM 2321 CB CYS 96 42.451 -17.843 15.744 0.00 0.00 C ATOM 2322 SG CYS 96 40.882 -17.335 14.978 0.00 0.00 S ATOM 2323 C CYS 96 43.308 -19.224 13.724 0.00 0.00 C ATOM 2324 O CYS 96 44.501 -19.114 13.424 0.00 0.00 O ATOM 2325 N ASN 97 42.361 -19.421 12.808 0.00 0.00 N ATOM 2326 CA ASN 97 42.597 -19.661 11.390 0.00 0.00 C ATOM 2327 CB ASN 97 42.702 -21.170 11.156 0.00 0.00 C ATOM 2328 CG ASN 97 42.895 -21.570 9.697 0.00 0.00 C ATOM 2329 OD1 ASN 97 42.135 -22.370 9.178 0.00 0.00 O ATOM 2330 ND2 ASN 97 43.826 -20.973 8.989 0.00 0.00 N ATOM 2331 C ASN 97 41.486 -19.071 10.522 0.00 0.00 C ATOM 2332 O ASN 97 40.312 -19.039 10.901 0.00 0.00 O ATOM 2333 N VAL 98 41.882 -18.608 9.348 0.00 0.00 N ATOM 2334 CA VAL 98 41.036 -17.881 8.420 0.00 0.00 C ATOM 2335 CB VAL 98 40.736 -16.498 9.006 0.00 0.00 C ATOM 2336 CG1 VAL 98 41.997 -15.726 9.407 0.00 0.00 C ATOM 2337 CG2 VAL 98 39.902 -15.667 8.050 0.00 0.00 C ATOM 2338 C VAL 98 41.737 -17.806 7.068 0.00 0.00 C ATOM 2339 O VAL 98 42.961 -17.799 6.990 0.00 0.00 O ATOM 2340 N TRP 99 40.960 -17.752 5.989 0.00 0.00 N ATOM 2341 CA TRP 99 41.456 -17.979 4.635 0.00 0.00 C ATOM 2342 CB TRP 99 41.139 -19.439 4.277 0.00 0.00 C ATOM 2343 CG TRP 99 41.984 -20.109 3.245 0.00 0.00 C ATOM 2344 CD1 TRP 99 42.601 -19.516 2.200 0.00 0.00 C ATOM 2345 NE1 TRP 99 43.332 -20.461 1.510 0.00 0.00 N ATOM 2346 CE2 TRP 99 43.169 -21.723 2.025 0.00 0.00 C ATOM 2347 CZ2 TRP 99 43.684 -22.975 1.661 0.00 0.00 C ATOM 2348 CH2 TRP 99 43.384 -24.096 2.455 0.00 0.00 C ATOM 2349 CZ3 TRP 99 42.590 -23.937 3.605 0.00 0.00 C ATOM 2350 CE3 TRP 99 42.086 -22.669 3.960 0.00 0.00 C ATOM 2351 CD2 TRP 99 42.339 -21.529 3.165 0.00 0.00 C ATOM 2352 C TRP 99 40.846 -16.953 3.678 0.00 0.00 C ATOM 2353 O TRP 99 39.627 -16.887 3.534 0.00 0.00 O ATOM 2354 N TYR 100 41.693 -16.140 3.046 0.00 0.00 N ATOM 2355 CA TYR 100 41.299 -14.946 2.287 0.00 0.00 C ATOM 2356 CB TYR 100 42.176 -13.778 2.768 0.00 0.00 C ATOM 2357 CG TYR 100 41.962 -13.449 4.228 0.00 0.00 C ATOM 2358 CD1 TYR 100 40.881 -12.631 4.611 0.00 0.00 C ATOM 2359 CE1 TYR 100 40.667 -12.336 5.972 0.00 0.00 C ATOM 2360 CZ TYR 100 41.532 -12.873 6.945 0.00 0.00 C ATOM 2361 OH TYR 100 41.316 -12.649 8.262 0.00 0.00 O ATOM 2362 CE2 TYR 100 42.608 -13.690 6.555 0.00 0.00 C ATOM 2363 CD2 TYR 100 42.822 -13.987 5.201 0.00 0.00 C ATOM 2364 C TYR 100 41.334 -15.156 0.758 0.00 0.00 C ATOM 2365 O TYR 100 41.304 -16.285 0.266 0.00 0.00 O ATOM 2366 N GLN 101 41.330 -14.050 -0.000 0.00 0.00 N ATOM 2367 CA GLN 101 41.350 -13.963 -1.465 0.00 0.00 C ATOM 2368 CB GLN 101 39.922 -14.228 -1.989 0.00 0.00 C ATOM 2369 CG GLN 101 39.728 -13.999 -3.503 0.00 0.00 C ATOM 2370 CD GLN 101 38.292 -14.283 -3.950 0.00 0.00 C ATOM 2371 OE1 GLN 101 37.537 -14.980 -3.298 0.00 0.00 O ATOM 2372 NE2 GLN 101 37.878 -13.823 -5.109 0.00 0.00 N ATOM 2373 C GLN 101 41.840 -12.564 -1.890 0.00 0.00 C ATOM 2374 O GLN 101 41.125 -11.577 -1.679 0.00 0.00 O ATOM 2375 N TYR 102 43.019 -12.493 -2.511 0.00 0.00 N ATOM 2376 CA TYR 102 43.695 -11.259 -2.937 0.00 0.00 C ATOM 2377 CB TYR 102 45.159 -11.337 -2.455 0.00 0.00 C ATOM 2378 CG TYR 102 45.359 -11.158 -0.960 0.00 0.00 C ATOM 2379 CD1 TYR 102 45.900 -9.954 -0.470 0.00 0.00 C ATOM 2380 CE1 TYR 102 46.147 -9.799 0.907 0.00 0.00 C ATOM 2381 CZ TYR 102 45.842 -10.850 1.797 0.00 0.00 C ATOM 2382 OH TYR 102 46.117 -10.723 3.117 0.00 0.00 O ATOM 2383 CE2 TYR 102 45.275 -12.045 1.313 0.00 0.00 C ATOM 2384 CD2 TYR 102 45.048 -12.203 -0.067 0.00 0.00 C ATOM 2385 C TYR 102 43.529 -10.984 -4.457 0.00 0.00 C ATOM 2386 O TYR 102 42.635 -11.527 -5.120 0.00 0.00 O ATOM 2387 N HIS 103 44.332 -10.051 -4.990 0.00 0.00 N ATOM 2388 CA HIS 103 44.268 -9.482 -6.341 0.00 0.00 C ATOM 2389 CB HIS 103 45.482 -8.559 -6.559 0.00 0.00 C ATOM 2390 CG HIS 103 45.617 -7.419 -5.576 0.00 0.00 C ATOM 2391 ND1 HIS 103 45.838 -7.557 -4.205 0.00 0.00 N ATOM 2392 CE1 HIS 103 46.026 -6.322 -3.723 0.00 0.00 C ATOM 2393 NE2 HIS 103 45.925 -5.416 -4.711 0.00 0.00 N ATOM 2394 CD2 HIS 103 45.667 -6.090 -5.889 0.00 0.00 C ATOM 2395 C HIS 103 44.226 -10.532 -7.455 0.00 0.00 C ATOM 2396 O HIS 103 43.326 -10.462 -8.290 0.00 0.00 O ATOM 2397 N HIS 104 45.127 -11.511 -7.459 0.00 0.00 N ATOM 2398 CA HIS 104 45.224 -12.576 -8.466 0.00 0.00 C ATOM 2399 CB HIS 104 46.692 -12.782 -8.869 0.00 0.00 C ATOM 2400 CG HIS 104 47.387 -11.517 -9.302 0.00 0.00 C ATOM 2401 ND1 HIS 104 47.111 -10.791 -10.464 0.00 0.00 N ATOM 2402 CE1 HIS 104 47.967 -9.759 -10.460 0.00 0.00 C ATOM 2403 NE2 HIS 104 48.751 -9.797 -9.369 0.00 0.00 N ATOM 2404 CD2 HIS 104 48.400 -10.901 -8.628 0.00 0.00 C ATOM 2405 C HIS 104 44.554 -13.884 -8.016 0.00 0.00 C ATOM 2406 O HIS 104 44.880 -14.956 -8.518 0.00 0.00 O ATOM 2407 N TYR 105 43.613 -13.812 -7.068 0.00 0.00 N ATOM 2408 CA TYR 105 42.998 -14.984 -6.426 0.00 0.00 C ATOM 2409 CB TYR 105 42.159 -15.826 -7.405 0.00 0.00 C ATOM 2410 CG TYR 105 41.115 -15.025 -8.139 0.00 0.00 C ATOM 2411 CD1 TYR 105 39.791 -15.016 -7.669 0.00 0.00 C ATOM 2412 CE1 TYR 105 38.835 -14.229 -8.326 0.00 0.00 C ATOM 2413 CZ TYR 105 39.208 -13.429 -9.429 0.00 0.00 C ATOM 2414 OH TYR 105 38.292 -12.657 -10.053 0.00 0.00 O ATOM 2415 CE2 TYR 105 40.535 -13.441 -9.899 0.00 0.00 C ATOM 2416 CD2 TYR 105 41.480 -14.263 -9.267 0.00 0.00 C ATOM 2417 C TYR 105 43.993 -15.827 -5.619 0.00 0.00 C ATOM 2418 O TYR 105 43.811 -17.031 -5.446 0.00 0.00 O ATOM 2419 N GLU 106 45.019 -15.190 -5.058 0.00 0.00 N ATOM 2420 CA GLU 106 45.848 -15.778 -4.017 0.00 0.00 C ATOM 2421 CB GLU 106 47.061 -14.904 -3.634 0.00 0.00 C ATOM 2422 CG GLU 106 47.822 -14.249 -4.797 0.00 0.00 C ATOM 2423 CD GLU 106 47.260 -12.866 -5.180 0.00 0.00 C ATOM 2424 OE1 GLU 106 46.022 -12.666 -5.136 0.00 0.00 O ATOM 2425 OE2 GLU 106 48.055 -11.992 -5.576 0.00 0.00 O ATOM 2426 C GLU 106 44.958 -16.050 -2.798 0.00 0.00 C ATOM 2427 O GLU 106 44.631 -15.164 -1.999 0.00 0.00 O ATOM 2428 N TYR 107 44.527 -17.302 -2.667 0.00 0.00 N ATOM 2429 CA TYR 107 43.815 -17.782 -1.493 0.00 0.00 C ATOM 2430 CB TYR 107 42.957 -19.008 -1.857 0.00 0.00 C ATOM 2431 CG TYR 107 41.968 -18.788 -2.996 0.00 0.00 C ATOM 2432 CD1 TYR 107 42.183 -19.394 -4.250 0.00 0.00 C ATOM 2433 CE1 TYR 107 41.278 -19.181 -5.309 0.00 0.00 C ATOM 2434 CZ TYR 107 40.136 -18.377 -5.108 0.00 0.00 C ATOM 2435 OH TYR 107 39.259 -18.162 -6.123 0.00 0.00 O ATOM 2436 CE2 TYR 107 39.914 -17.771 -3.854 0.00 0.00 C ATOM 2437 CD2 TYR 107 40.830 -17.975 -2.803 0.00 0.00 C ATOM 2438 C TYR 107 44.826 -18.021 -0.362 0.00 0.00 C ATOM 2439 O TYR 107 45.202 -19.158 -0.080 0.00 0.00 O ATOM 2440 N TYR 108 45.308 -16.946 0.264 0.00 0.00 N ATOM 2441 CA TYR 108 46.226 -17.040 1.397 0.00 0.00 C ATOM 2442 CB TYR 108 47.026 -15.740 1.563 0.00 0.00 C ATOM 2443 CG TYR 108 48.024 -15.407 0.460 0.00 0.00 C ATOM 2444 CD1 TYR 108 48.871 -16.402 -0.077 0.00 0.00 C ATOM 2445 CE1 TYR 108 49.865 -16.063 -1.016 0.00 0.00 C ATOM 2446 CZ TYR 108 50.029 -14.720 -1.419 0.00 0.00 C ATOM 2447 OH TYR 108 51.015 -14.384 -2.290 0.00 0.00 O ATOM 2448 CE2 TYR 108 49.172 -13.729 -0.903 0.00 0.00 C ATOM 2449 CD2 TYR 108 48.179 -14.070 0.036 0.00 0.00 C ATOM 2450 C TYR 108 45.503 -17.446 2.689 0.00 0.00 C ATOM 2451 O TYR 108 44.514 -16.833 3.106 0.00 0.00 O ATOM 2452 N ASP 109 46.045 -18.492 3.303 0.00 0.00 N ATOM 2453 CA ASP 109 45.667 -19.070 4.587 0.00 0.00 C ATOM 2454 CB ASP 109 45.969 -20.572 4.507 0.00 0.00 C ATOM 2455 CG ASP 109 45.564 -21.302 5.779 0.00 0.00 C ATOM 2456 OD1 ASP 109 44.500 -20.954 6.330 0.00 0.00 O ATOM 2457 OD2 ASP 109 46.348 -22.163 6.236 0.00 0.00 O ATOM 2458 C ASP 109 46.456 -18.399 5.724 0.00 0.00 C ATOM 2459 O ASP 109 47.681 -18.281 5.644 0.00 0.00 O ATOM 2460 N TYR 110 45.764 -17.954 6.771 0.00 0.00 N ATOM 2461 CA TYR 110 46.315 -17.119 7.838 0.00 0.00 C ATOM 2462 CB TYR 110 45.760 -15.692 7.734 0.00 0.00 C ATOM 2463 CG TYR 110 46.577 -14.745 6.871 0.00 0.00 C ATOM 2464 CD1 TYR 110 47.470 -13.842 7.482 0.00 0.00 C ATOM 2465 CE1 TYR 110 48.169 -12.898 6.705 0.00 0.00 C ATOM 2466 CZ TYR 110 47.970 -12.847 5.309 0.00 0.00 C ATOM 2467 OH TYR 110 48.571 -11.878 4.566 0.00 0.00 O ATOM 2468 CE2 TYR 110 47.099 -13.772 4.695 0.00 0.00 C ATOM 2469 CD2 TYR 110 46.417 -14.731 5.471 0.00 0.00 C ATOM 2470 C TYR 110 46.069 -17.717 9.225 0.00 0.00 C ATOM 2471 O TYR 110 45.092 -18.425 9.483 0.00 0.00 O ATOM 2472 N TRP 111 46.984 -17.385 10.131 0.00 0.00 N ATOM 2473 CA TRP 111 47.111 -17.961 11.465 0.00 0.00 C ATOM 2474 CB TRP 111 48.102 -19.135 11.399 0.00 0.00 C ATOM 2475 CG TRP 111 47.724 -20.270 10.489 0.00 0.00 C ATOM 2476 CD1 TRP 111 48.026 -20.379 9.172 0.00 0.00 C ATOM 2477 NE1 TRP 111 47.473 -21.540 8.664 0.00 0.00 N ATOM 2478 CE2 TRP 111 46.821 -22.260 9.631 0.00 0.00 C ATOM 2479 CZ2 TRP 111 46.122 -23.477 9.610 0.00 0.00 C ATOM 2480 CH2 TRP 111 45.450 -23.902 10.766 0.00 0.00 C ATOM 2481 CZ3 TRP 111 45.495 -23.103 11.922 0.00 0.00 C ATOM 2482 CE3 TRP 111 46.187 -21.874 11.925 0.00 0.00 C ATOM 2483 CD2 TRP 111 46.897 -21.436 10.790 0.00 0.00 C ATOM 2484 C TRP 111 47.601 -16.880 12.432 0.00 0.00 C ATOM 2485 O TRP 111 48.184 -15.886 11.991 0.00 0.00 O ATOM 2486 N GLY 112 47.384 -17.058 13.735 0.00 0.00 N ATOM 2487 CA GLY 112 48.052 -16.250 14.755 0.00 0.00 C ATOM 2488 C GLY 112 49.423 -16.809 15.153 0.00 0.00 C ATOM 2489 O GLY 112 50.151 -17.356 14.325 0.00 0.00 O ATOM 2490 N GLN 113 49.801 -16.662 16.418 0.00 0.00 N ATOM 2491 CA GLN 113 51.062 -17.154 16.984 0.00 0.00 C ATOM 2492 CB GLN 113 51.695 -16.062 17.866 0.00 0.00 C ATOM 2493 CG GLN 113 52.009 -14.763 17.093 0.00 0.00 C ATOM 2494 CD GLN 113 50.788 -13.860 16.915 0.00 0.00 C ATOM 2495 OE1 GLN 113 50.120 -13.488 17.864 0.00 0.00 O ATOM 2496 NE2 GLN 113 50.446 -13.473 15.706 0.00 0.00 N ATOM 2497 C GLN 113 50.859 -18.468 17.756 0.00 0.00 C ATOM 2498 O GLN 113 51.762 -19.298 17.800 0.00 0.00 O ATOM 2499 N GLY 114 49.650 -18.686 18.278 0.00 0.00 N ATOM 2500 CA GLY 114 49.207 -19.918 18.922 0.00 0.00 C ATOM 2501 C GLY 114 49.458 -19.997 20.433 0.00 0.00 C ATOM 2502 O GLY 114 50.551 -19.713 20.918 0.00 0.00 O ATOM 2503 N THR 115 48.445 -20.406 21.196 0.00 0.00 N ATOM 2504 CA THR 115 48.456 -20.485 22.663 0.00 0.00 C ATOM 2505 CB THR 115 47.247 -19.748 23.265 0.00 0.00 C ATOM 2506 CG2 THR 115 47.452 -18.237 23.288 0.00 0.00 C ATOM 2507 OG1 THR 115 46.066 -20.002 22.540 0.00 0.00 O ATOM 2508 C THR 115 48.474 -21.934 23.141 0.00 0.00 C ATOM 2509 O THR 115 47.561 -22.715 22.874 0.00 0.00 O ATOM 2510 N GLN 116 49.504 -22.322 23.903 0.00 0.00 N ATOM 2511 CA GLN 116 49.511 -23.607 24.603 0.00 0.00 C ATOM 2512 CB GLN 116 50.913 -23.881 25.182 0.00 0.00 C ATOM 2513 CG GLN 116 51.070 -25.250 25.872 0.00 0.00 C ATOM 2514 CD GLN 116 51.271 -26.414 24.905 0.00 0.00 C ATOM 2515 OE1 GLN 116 52.273 -26.536 24.221 0.00 0.00 O ATOM 2516 NE2 GLN 116 50.340 -27.338 24.835 0.00 0.00 N ATOM 2517 C GLN 116 48.419 -23.603 25.683 0.00 0.00 C ATOM 2518 O GLN 116 48.430 -22.750 26.576 0.00 0.00 O ATOM 2519 N VAL 117 47.517 -24.584 25.632 0.00 0.00 N ATOM 2520 CA VAL 117 46.854 -25.089 26.839 0.00 0.00 C ATOM 2521 CB VAL 117 45.302 -25.028 26.851 0.00 0.00 C ATOM 2522 CG1 VAL 117 44.718 -24.028 25.851 0.00 0.00 C ATOM 2523 CG2 VAL 117 44.597 -26.381 26.668 0.00 0.00 C ATOM 2524 C VAL 117 47.409 -26.466 27.173 0.00 0.00 C ATOM 2525 O VAL 117 47.780 -27.242 26.286 0.00 0.00 O ATOM 2526 N THR 118 47.418 -26.773 28.461 0.00 0.00 N ATOM 2527 CA THR 118 47.829 -28.058 29.030 0.00 0.00 C ATOM 2528 CB THR 118 49.292 -28.014 29.501 0.00 0.00 C ATOM 2529 CG2 THR 118 49.782 -29.314 30.144 0.00 0.00 C ATOM 2530 OG1 THR 118 50.139 -27.795 28.397 0.00 0.00 O ATOM 2531 C THR 118 46.875 -28.417 30.161 0.00 0.00 C ATOM 2532 O THR 118 46.448 -27.544 30.914 0.00 0.00 O ATOM 2533 N VAL 119 46.508 -29.689 30.263 0.00 0.00 N ATOM 2534 CA VAL 119 45.497 -30.184 31.201 0.00 0.00 C ATOM 2535 CB VAL 119 44.076 -30.150 30.598 0.00 0.00 C ATOM 2536 CG1 VAL 119 43.388 -28.829 30.944 0.00 0.00 C ATOM 2537 CG2 VAL 119 44.016 -30.301 29.071 0.00 0.00 C ATOM 2538 C VAL 119 45.850 -31.582 31.690 0.00 0.00 C ATOM 2539 O VAL 119 46.150 -32.456 30.878 0.00 0.00 O ATOM 2540 N SER 120 45.833 -31.758 33.015 0.00 0.00 N ATOM 2541 CA SER 120 46.168 -32.990 33.756 0.00 0.00 C ATOM 2542 CB SER 120 47.189 -32.656 34.851 0.00 0.00 C ATOM 2543 OG SER 120 46.571 -31.762 35.753 0.00 0.00 O ATOM 2544 C SER 120 44.934 -33.652 34.376 0.00 0.00 C ATOM 2545 O SER 120 44.321 -32.976 35.240 0.00 0.00 O ATOM 2546 OXT SER 120 44.632 -34.797 33.989 0.00 0.00 O END If you find results from this site helpful for your research, please cite one of our papers:
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