==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 09-FEB-10 3LQH . COMPND 2 MOLECULE: HISTONE-LYSINE N-METHYLTRANSFERASE MLL; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Z.WANG,D.J.PATEL . 174 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10734.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 116 66.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 3.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 7 4.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 17 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 80 46.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 1 0 0 1 0 2 0 0 0 0 0 0 0 0 1 0 0 1 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1566 A G 0 0 85 0, 0.0 2,-0.6 0, 0.0 9,-0.0 0.000 360.0 360.0 360.0 131.7 53.4 27.9 28.0 2 1567 A N - 0 0 53 26,-0.0 9,-2.5 2,-0.0 10,-0.5 -0.857 360.0-173.8 -98.3 117.9 50.3 27.4 25.9 3 1568 A F B -A 10 0A 107 -2,-0.6 7,-0.3 7,-0.3 26,-0.1 -0.889 29.9-117.5-116.7 142.2 48.8 30.7 24.7 4 1569 A C >> - 0 0 0 5,-2.6 4,-2.0 -2,-0.4 3,-1.3 -0.621 25.2-142.0 -72.6 125.3 45.6 31.6 22.8 5 1570 A P T 34 S+ 0 0 33 0, 0.0 -1,-0.1 0, 0.0 25,-0.1 0.620 93.7 57.3 -67.6 -8.0 46.8 33.2 19.5 6 1571 A L T 34 S+ 0 0 59 3,-0.1 24,-0.1 1,-0.1 -2,-0.0 0.406 123.9 14.6-105.3 1.5 44.1 35.7 19.5 7 1572 A C T <4 S- 0 0 46 -3,-1.3 3,-0.1 2,-0.1 -1,-0.1 0.289 92.4-129.3-144.6 -7.7 44.6 37.4 22.8 8 1573 A D < + 0 0 119 -4,-2.0 2,-0.4 1,-0.2 -5,-0.0 0.701 60.1 139.4 59.1 21.4 48.0 36.2 23.6 9 1574 A K - 0 0 136 -5,-0.4 -5,-2.6 2,-0.0 -1,-0.2 -0.811 57.7-115.3 -97.2 138.1 47.0 35.1 27.0 10 1575 A C B -A 3 0A 47 -2,-0.4 -7,-0.3 -7,-0.3 3,-0.2 -0.518 23.8-168.9 -70.6 135.0 48.2 31.9 28.6 11 1576 A Y > + 0 0 26 -9,-2.5 3,-1.7 -2,-0.2 -8,-0.1 0.291 57.6 104.9-110.5 10.7 45.4 29.4 29.1 12 1577 A D T 3 S+ 0 0 80 -10,-0.5 -1,-0.1 1,-0.3 -9,-0.1 0.855 89.7 40.4 -57.4 -37.3 47.2 26.8 31.2 13 1578 A D T 3 S+ 0 0 155 -3,-0.2 -1,-0.3 2,-0.0 2,-0.2 0.260 85.7 131.9 -96.3 10.8 45.5 28.1 34.4 14 1579 A D < - 0 0 61 -3,-1.7 -3,-0.1 1,-0.1 2,-0.0 -0.438 54.7-128.0 -65.5 132.8 42.1 28.6 32.6 15 1580 A D > - 0 0 98 -2,-0.2 3,-1.9 1,-0.1 -1,-0.1 -0.213 29.6 -92.9 -76.1 171.0 39.3 27.1 34.7 16 1581 A Y T 3 S+ 0 0 210 1,-0.3 -1,-0.1 3,-0.0 -2,-0.1 0.821 120.7 65.5 -51.3 -39.5 36.7 24.6 33.3 17 1582 A E T 3 S+ 0 0 131 2,-0.1 2,-1.0 1,-0.0 -1,-0.3 0.626 73.6 105.9 -62.4 -15.9 34.3 27.4 32.5 18 1583 A S < - 0 0 31 -3,-1.9 2,-0.4 -7,-0.1 -1,-0.0 -0.556 66.1-147.6 -72.0 102.7 36.6 28.8 29.8 19 1584 A K + 0 0 62 -2,-1.0 13,-2.4 12,-0.0 14,-0.4 -0.584 31.6 155.9 -76.1 124.4 35.0 27.8 26.5 20 1585 A M E -B 31 0B 22 -2,-0.4 2,-0.4 11,-0.2 11,-0.2 -0.898 32.1-139.8-141.0 167.3 37.6 27.1 23.8 21 1586 A M E -B 30 0B 4 9,-2.1 9,-2.3 -2,-0.3 2,-0.4 -0.981 22.0-124.1-132.1 146.0 38.0 25.2 20.6 22 1587 A Q E -B 29 0B 84 -2,-0.4 2,-0.4 7,-0.2 7,-0.2 -0.724 16.7-124.2 -96.5 137.7 41.0 23.2 19.4 23 1588 A C > - 0 0 0 5,-3.0 4,-1.8 -2,-0.4 32,-0.2 -0.652 15.6-148.1 -76.4 126.6 42.9 23.7 16.2 24 1589 A G T 4 S+ 0 0 61 30,-2.5 -1,-0.1 -2,-0.4 31,-0.1 0.624 92.4 49.7 -72.3 -13.3 42.9 20.4 14.3 25 1590 A K T 4 S+ 0 0 143 29,-0.3 -1,-0.2 3,-0.1 30,-0.1 0.842 128.5 13.8 -94.2 -37.5 46.3 21.1 12.7 26 1591 A C T 4 S- 0 0 49 2,-0.2 -2,-0.2 0, 0.0 3,-0.1 0.411 90.1-126.9-119.4 0.9 48.4 22.2 15.7 27 1592 A D < + 0 0 103 -4,-1.8 2,-0.1 1,-0.2 -3,-0.1 0.531 61.4 139.6 64.7 8.0 46.4 21.1 18.7 28 1593 A R - 0 0 120 -6,-0.1 -5,-3.0 -5,-0.1 2,-0.3 -0.461 48.3-124.7 -78.3 156.9 46.5 24.6 20.2 29 1594 A W E -B 22 0B 97 -7,-0.2 2,-0.4 -2,-0.1 -7,-0.2 -0.776 19.2-162.1-107.5 150.1 43.4 26.0 21.8 30 1595 A V E -B 21 0B 0 -9,-2.3 -9,-2.1 -2,-0.3 2,-0.1 -0.993 24.5-113.1-131.5 134.2 41.5 29.3 21.1 31 1596 A H E >> -B 20 0B 23 -2,-0.4 3,-0.7 -11,-0.2 4,-0.5 -0.424 14.5-139.9 -64.0 137.9 39.0 31.2 23.2 32 1597 A S G >4 S+ 0 0 5 -13,-2.4 3,-1.4 1,-0.3 5,-0.3 0.922 105.2 56.9 -63.2 -41.2 35.5 31.3 21.8 33 1598 A K G 34 S+ 0 0 195 -14,-0.4 -1,-0.3 1,-0.3 4,-0.1 0.728 103.3 54.0 -60.1 -25.6 35.4 34.9 23.0 34 1599 A C G <4 S+ 0 0 45 -3,-0.7 -1,-0.3 2,-0.1 2,-0.2 0.581 102.9 70.1 -87.8 -7.9 38.5 35.8 21.0 35 1600 A E S << S- 0 0 33 -3,-1.4 2,-1.5 -4,-0.5 -5,-0.0 -0.651 94.8-102.0-108.1 162.7 37.0 34.5 17.8 36 1601 A N S S+ 0 0 130 -2,-0.2 2,-0.3 2,-0.0 -3,-0.1 -0.635 79.7 117.2 -83.1 79.5 34.2 35.6 15.5 37 1602 A L - 0 0 30 -2,-1.5 -2,-0.1 -5,-0.3 2,-0.1 -0.969 56.5-135.7-152.4 134.6 31.7 33.1 16.7 38 1603 A S > - 0 0 63 -2,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.347 36.1-103.5 -87.9 170.2 28.3 33.3 18.5 39 1604 A D H > S+ 0 0 123 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.904 123.0 50.6 -59.9 -41.1 27.4 31.1 21.4 40 1605 A E H > S+ 0 0 34 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.934 109.2 48.4 -61.8 -48.9 25.2 29.0 19.1 41 1606 A M H > S+ 0 0 30 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.858 108.3 55.9 -63.6 -35.7 28.0 28.5 16.5 42 1607 A Y H X S+ 0 0 27 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.930 109.5 46.2 -57.4 -45.2 30.4 27.5 19.3 43 1608 A E H X S+ 0 0 70 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.856 110.7 52.2 -69.8 -33.5 28.0 24.8 20.5 44 1609 A I H X S+ 0 0 5 -4,-1.8 4,-1.2 2,-0.2 -1,-0.2 0.920 113.8 44.6 -66.2 -42.5 27.4 23.6 16.9 45 1610 A L H < S+ 0 0 6 -4,-2.2 3,-0.4 1,-0.2 -2,-0.2 0.934 114.4 48.4 -65.8 -46.6 31.2 23.3 16.4 46 1611 A S H < S+ 0 0 48 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.753 105.1 59.3 -67.8 -25.9 31.7 21.7 19.8 47 1612 A N H < S+ 0 0 85 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.849 130.0 7.7 -71.5 -35.0 28.9 19.1 19.2 48 1613 A L S >X S+ 0 0 72 -4,-1.2 3,-1.5 -3,-0.4 4,-0.5 -0.496 72.8 172.4-147.8 70.5 30.6 17.7 16.1 49 1614 A P H >> S+ 0 0 64 0, 0.0 4,-2.6 0, 0.0 3,-1.1 0.794 73.1 62.9 -51.3 -35.6 34.1 19.3 15.8 50 1615 A E H 34 S+ 0 0 140 1,-0.3 -5,-0.0 2,-0.2 -2,-0.0 0.745 94.4 61.5 -69.6 -17.0 35.3 17.2 12.9 51 1616 A S H <4 S+ 0 0 59 -3,-1.5 -1,-0.3 -6,-0.2 23,-0.1 0.749 114.7 33.0 -77.6 -26.2 32.6 18.5 10.6 52 1617 A V H << S- 0 0 0 -3,-1.1 18,-0.2 -4,-0.5 -2,-0.2 0.780 86.0-156.4 -97.6 -36.0 34.0 22.0 10.9 53 1618 A A < - 0 0 44 -4,-2.6 14,-0.2 -8,-0.1 -3,-0.1 0.964 19.8-147.2 54.4 58.1 37.7 21.2 11.3 54 1619 A Y - 0 0 7 -5,-0.4 -30,-2.5 -32,-0.2 2,-0.4 -0.206 15.7-166.5 -55.3 142.3 38.5 24.5 13.0 55 1620 A T - 0 0 4 -32,-0.2 12,-0.1 -31,-0.1 -32,-0.1 -0.998 15.7-126.1-133.6 137.5 42.0 25.9 12.3 56 1621 A C >> - 0 0 0 -2,-0.4 3,-1.5 1,-0.1 4,-1.1 -0.208 36.2 -93.5 -76.8 172.7 43.7 28.7 14.2 57 1622 A V T 34 S+ 0 0 78 1,-0.3 3,-0.2 2,-0.2 -1,-0.1 0.816 125.4 53.9 -55.9 -33.5 45.1 31.9 12.7 58 1623 A N T 34 S+ 0 0 129 1,-0.2 -1,-0.3 3,-0.0 -2,-0.0 0.664 115.3 38.9 -77.2 -16.0 48.5 30.3 12.5 59 1624 A C T <4 S+ 0 0 33 -3,-1.5 2,-0.7 0, 0.0 -2,-0.2 0.427 88.4 110.2-113.8 1.5 47.2 27.3 10.5 60 1625 A T < - 0 0 21 -4,-1.1 5,-0.1 -3,-0.2 -6,-0.0 -0.728 39.6-179.3 -93.4 122.8 44.7 29.0 8.3 61 1626 A E + 0 0 97 -2,-0.7 2,-0.3 3,-0.0 -1,-0.1 0.876 57.8 33.0 -78.6 -56.2 45.6 29.1 4.8 62 1627 A R S S- 0 0 184 2,-0.1 4,-0.2 0, 0.0 -1,-0.0 -0.729 78.8-101.0-114.2 158.5 42.8 30.9 2.9 63 1628 A H S S+ 0 0 155 -2,-0.3 2,-0.1 1,-0.2 3,-0.0 -0.997 106.3 37.4-132.6 128.5 40.4 33.7 3.6 64 1629 A P S S- 0 0 82 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.428 110.8-112.6 -78.4 155.5 37.7 33.3 4.3 65 1630 A A >> - 0 0 3 1,-0.1 4,-1.5 -2,-0.1 3,-0.8 -0.226 8.4-130.8 -60.7 141.0 38.7 30.3 6.3 66 1631 A E H 3> S+ 0 0 70 1,-0.3 4,-2.2 2,-0.2 5,-0.2 0.846 106.9 55.8 -58.7 -38.7 37.6 26.9 5.3 67 1632 A W H 3> S+ 0 0 5 2,-0.2 4,-2.3 1,-0.2 -1,-0.3 0.857 104.5 53.9 -64.2 -33.5 36.3 26.0 8.8 68 1633 A R H <> S+ 0 0 63 -3,-0.8 4,-2.0 2,-0.2 5,-0.2 0.933 109.7 46.3 -66.3 -41.3 34.0 29.1 8.7 69 1634 A L H X S+ 0 0 93 -4,-1.5 4,-2.0 1,-0.2 -2,-0.2 0.904 112.8 51.4 -67.4 -39.4 32.5 28.0 5.4 70 1635 A A H X S+ 0 0 21 -4,-2.2 4,-2.2 -18,-0.2 -2,-0.2 0.885 110.5 47.4 -65.5 -41.2 32.1 24.4 6.8 71 1636 A L H X S+ 0 0 3 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.887 111.3 50.7 -69.2 -39.1 30.3 25.6 10.0 72 1637 A E H X S+ 0 0 93 -4,-2.0 4,-1.7 1,-0.2 -2,-0.2 0.904 112.1 48.6 -63.5 -40.8 28.0 27.9 8.0 73 1638 A K H X S+ 0 0 140 -4,-2.0 4,-2.5 -5,-0.2 5,-0.2 0.912 106.6 55.4 -68.0 -41.8 27.2 25.0 5.8 74 1639 A E H X S+ 0 0 30 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.871 105.1 52.8 -58.4 -41.1 26.6 22.7 8.7 75 1640 A L H X S+ 0 0 5 -4,-1.8 4,-2.5 2,-0.2 -1,-0.2 0.934 110.4 47.9 -59.9 -48.2 24.0 25.0 10.2 76 1641 A Q H X S+ 0 0 59 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.898 112.1 48.1 -61.6 -42.9 22.1 25.1 6.9 77 1642 A I H X S+ 0 0 98 -4,-2.5 4,-1.8 2,-0.2 -1,-0.2 0.890 112.7 50.0 -65.1 -38.9 22.1 21.3 6.4 78 1643 A S H X S+ 0 0 11 -4,-2.0 4,-1.7 -5,-0.2 -2,-0.2 0.914 109.9 48.9 -66.4 -44.4 21.0 20.9 10.0 79 1644 A L H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 5,-0.2 0.939 112.1 50.4 -61.1 -43.4 18.1 23.3 9.7 80 1645 A K H X S+ 0 0 98 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.837 103.9 57.9 -64.1 -37.1 17.0 21.6 6.5 81 1646 A Q H X S+ 0 0 83 -4,-1.8 4,-1.7 2,-0.2 -1,-0.2 0.916 109.5 45.3 -60.3 -41.2 17.1 18.2 8.2 82 1647 A V H X S+ 0 0 0 -4,-1.7 4,-1.8 -3,-0.2 -2,-0.2 0.952 115.0 45.6 -68.3 -49.3 14.6 19.4 10.8 83 1648 A L H X S+ 0 0 1 -4,-2.4 4,-2.7 1,-0.2 5,-0.2 0.911 111.3 53.1 -61.7 -42.3 12.3 21.1 8.3 84 1649 A T H X S+ 0 0 54 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.906 107.4 52.0 -59.7 -41.8 12.4 18.1 5.9 85 1650 A A H < S+ 0 0 25 -4,-1.7 4,-0.3 -5,-0.2 -1,-0.2 0.886 111.5 46.9 -62.3 -39.3 11.4 15.7 8.7 86 1651 A L H >< S+ 0 0 1 -4,-1.8 3,-1.3 1,-0.2 7,-0.4 0.928 112.8 48.3 -68.7 -45.5 8.4 17.9 9.6 87 1652 A L H 3< S+ 0 0 19 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.744 103.2 62.5 -68.1 -23.9 7.3 18.3 6.0 88 1653 A N T 3< S+ 0 0 129 -4,-1.7 2,-0.5 -5,-0.2 -1,-0.2 0.589 86.1 87.5 -81.1 -3.4 7.6 14.6 5.4 89 1654 A S <> - 0 0 32 -3,-1.3 4,-3.3 -4,-0.3 5,-0.3 -0.820 68.5-154.0 -94.9 119.2 4.9 14.0 8.0 90 1655 A R H > S+ 0 0 212 -2,-0.5 4,-2.2 1,-0.2 5,-0.2 0.876 93.6 45.0 -58.9 -48.6 1.5 14.1 6.5 91 1656 A T H > S+ 0 0 81 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.902 116.7 44.5 -63.0 -43.6 -0.3 15.0 9.6 92 1657 A T H > S+ 0 0 5 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.941 117.0 46.5 -65.6 -46.5 2.3 17.7 10.6 93 1658 A S H X>S+ 0 0 23 -4,-3.3 4,-2.9 -7,-0.4 5,-0.5 0.940 110.5 54.2 -61.7 -47.3 2.4 19.0 7.0 94 1659 A H H <5S+ 0 0 159 -4,-2.2 4,-0.2 -5,-0.3 -1,-0.2 0.901 116.6 37.3 -48.6 -44.9 -1.5 19.0 6.9 95 1660 A L H <5S+ 0 0 42 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.849 133.6 18.7 -82.5 -32.7 -1.7 21.0 9.9 96 1661 A L H <5S+ 0 0 6 -4,-2.8 9,-2.1 -5,-0.2 10,-0.3 0.665 98.8 78.6-117.8 -18.6 1.2 23.4 9.4 97 1662 A R T <5S+ 0 0 55 -4,-2.9 9,-2.3 -5,-0.3 2,-0.5 0.929 103.0 27.6 -61.7 -46.8 2.5 23.6 5.9 98 1663 A Y < 0 0 147 -5,-0.5 -1,-0.2 -4,-0.2 6,-0.1 -0.967 360.0 360.0-122.6 124.9 -0.1 26.0 4.4 99 1664 A R 0 0 220 -2,-0.5 5,-0.1 -3,-0.1 -3,-0.1 -0.161 360.0 360.0 -74.9 360.0 -2.1 28.5 6.5 100 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 101 1704 A Q 0 0 134 0, 0.0 7,-0.1 0, 0.0 6,-0.0 0.000 360.0 360.0 360.0 114.9 7.9 36.4 9.3 102 1705 A P - 0 0 14 0, 0.0 3,-0.1 0, 0.0 28,-0.0 -0.238 360.0-166.9 -67.6 142.9 6.7 33.1 8.0 103 1706 A L + 0 0 102 1,-0.1 2,-0.3 -6,-0.1 -5,-0.0 0.531 69.9 13.8-107.8 -8.7 3.3 32.1 8.7 104 1707 A D S >> S- 0 0 25 -5,-0.1 4,-1.5 -7,-0.1 3,-0.6 -0.915 88.0 -90.5-154.1 171.3 3.5 28.5 7.8 105 1708 A L H 3> S+ 0 0 0 -9,-2.1 4,-2.3 -2,-0.3 -8,-0.2 0.729 122.9 59.0 -61.9 -32.5 6.0 25.9 7.1 106 1709 A E H 3> S+ 0 0 33 -9,-2.3 4,-2.1 -10,-0.3 -1,-0.3 0.890 105.4 50.5 -60.4 -38.3 5.9 26.8 3.4 107 1710 A G H <> S+ 0 0 10 -3,-0.6 4,-2.1 -10,-0.3 -2,-0.2 0.880 110.6 49.0 -65.0 -38.5 7.0 30.2 4.4 108 1711 A V H X S+ 0 0 0 -4,-1.5 4,-2.8 2,-0.2 -2,-0.2 0.904 109.6 53.1 -66.3 -40.7 9.8 28.8 6.5 109 1712 A K H X S+ 0 0 65 -4,-2.3 4,-3.2 2,-0.2 5,-0.2 0.927 110.2 46.1 -60.8 -46.8 10.8 26.6 3.6 110 1713 A R H X S+ 0 0 130 -4,-2.1 4,-1.2 1,-0.2 -1,-0.2 0.908 114.7 47.7 -63.4 -41.5 11.1 29.5 1.2 111 1714 A K H <>S+ 0 0 41 -4,-2.1 5,-2.3 2,-0.2 6,-0.3 0.907 116.4 44.4 -65.2 -41.7 13.0 31.6 3.8 112 1715 A M H ><5S+ 0 0 9 -4,-2.8 3,-2.6 1,-0.2 5,-0.2 0.935 108.5 54.4 -69.3 -48.8 15.3 28.7 4.5 113 1716 A D H 3<5S+ 0 0 81 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.781 105.9 55.2 -57.9 -26.7 15.9 27.6 0.9 114 1717 A Q T 3<5S- 0 0 133 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.444 117.5-117.2 -85.1 0.3 17.0 31.2 0.2 115 1718 A G T < 5S+ 0 0 40 -3,-2.6 -3,-0.2 -5,-0.1 -2,-0.1 0.789 71.8 136.9 70.1 29.7 19.5 30.9 3.0 116 1719 A N < + 0 0 85 -5,-2.3 2,-0.5 -6,-0.2 -4,-0.2 0.552 39.4 94.2 -85.5 -9.2 17.9 33.6 5.1 117 1720 A Y + 0 0 1 -6,-0.3 3,-0.1 -5,-0.2 -38,-0.1 -0.754 41.0 169.2 -87.0 124.9 18.1 31.8 8.4 118 1721 A T + 0 0 110 -2,-0.5 2,-0.3 1,-0.2 -1,-0.1 0.413 61.0 37.3-113.2 -1.8 21.2 32.8 10.4 119 1722 A S > - 0 0 32 1,-0.1 4,-1.6 -44,-0.0 -1,-0.2 -0.998 66.7-130.8-150.6 153.2 20.5 31.2 13.8 120 1723 A V H > S+ 0 0 0 -2,-0.3 4,-3.2 1,-0.2 5,-0.2 0.895 109.3 55.8 -67.8 -40.0 18.9 28.2 15.3 121 1724 A L H > S+ 0 0 81 1,-0.2 4,-3.2 2,-0.2 5,-0.3 0.894 106.2 50.5 -60.4 -41.1 16.8 30.3 17.7 122 1725 A E H > S+ 0 0 60 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.937 114.4 43.6 -61.6 -47.6 15.3 32.3 14.8 123 1726 A F H X S+ 0 0 0 -4,-1.6 4,-1.8 2,-0.2 -2,-0.2 0.931 116.5 47.5 -62.2 -48.8 14.3 29.1 12.9 124 1727 A S H X S+ 0 0 0 -4,-3.2 4,-3.0 1,-0.2 5,-0.2 0.933 111.9 48.3 -61.3 -49.4 13.0 27.5 16.1 125 1728 A D H X S+ 0 0 24 -4,-3.2 4,-2.7 1,-0.2 5,-0.2 0.890 107.6 56.3 -60.0 -40.7 10.9 30.5 17.2 126 1729 A D H X S+ 0 0 8 -4,-2.0 4,-1.4 -5,-0.3 -1,-0.2 0.918 113.9 40.4 -57.0 -43.3 9.4 30.8 13.8 127 1730 A I H X S+ 0 0 0 -4,-1.8 4,-2.9 2,-0.2 -2,-0.2 0.883 111.6 54.3 -74.9 -39.9 8.2 27.2 14.0 128 1731 A V H X S+ 0 0 0 -4,-3.0 4,-3.0 1,-0.2 5,-0.3 0.931 108.9 51.2 -59.3 -43.1 7.1 27.4 17.6 129 1732 A K H X S+ 0 0 75 -4,-2.7 4,-2.1 -5,-0.2 -1,-0.2 0.897 111.2 47.8 -59.9 -43.2 5.0 30.4 16.7 130 1733 A I H X S+ 0 0 12 -4,-1.4 4,-1.6 -5,-0.2 -2,-0.2 0.924 114.2 45.7 -63.5 -44.5 3.4 28.5 13.9 131 1734 A I H X S+ 0 0 2 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.951 114.8 46.4 -65.2 -48.7 2.7 25.4 16.0 132 1735 A Q H X S+ 0 0 10 -4,-3.0 4,-2.5 1,-0.2 -1,-0.2 0.876 110.2 53.9 -63.1 -37.5 1.3 27.4 18.9 133 1736 A A H X S+ 0 0 52 -4,-2.1 4,-1.2 -5,-0.3 -1,-0.2 0.914 110.7 46.9 -62.6 -42.2 -0.9 29.5 16.6 134 1737 A A H >X S+ 0 0 16 -4,-1.6 4,-2.3 2,-0.2 3,-0.5 0.928 111.6 50.0 -64.8 -46.9 -2.3 26.3 15.1 135 1738 A I H 3< S+ 0 0 38 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.899 111.3 50.5 -58.2 -40.9 -2.9 24.8 18.5 136 1739 A N H 3< S+ 0 0 92 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.745 123.4 29.5 -69.2 -23.8 -4.6 28.0 19.6 137 1740 A S H << S+ 0 0 94 -4,-1.2 -2,-0.2 -3,-0.5 -1,-0.2 0.500 91.5 87.0-119.1 -3.1 -6.9 28.0 16.5 138 1741 A D S < S- 0 0 34 -4,-2.3 3,-0.3 1,-0.2 -3,-0.1 0.394 85.2-128.0 -83.6 8.3 -7.6 24.4 15.3 139 1742 A G - 0 0 40 -4,-0.2 -1,-0.2 1,-0.2 -2,-0.0 -0.290 25.7 -65.9 89.3-169.3 -10.6 23.8 17.6 140 1743 A G + 0 0 57 -2,-0.1 -1,-0.2 4,-0.1 -2,-0.0 0.165 68.7 135.8-117.3 18.7 -11.7 21.2 20.0 141 1744 A Q > - 0 0 141 -3,-0.3 4,-2.1 1,-0.1 3,-0.5 -0.489 60.4-124.1 -63.5 140.4 -12.3 18.0 18.0 142 1745 A P H > S+ 0 0 90 0, 0.0 4,-1.9 0, 0.0 5,-0.2 0.863 109.7 49.5 -57.3 -45.5 -10.7 15.1 20.0 143 1746 A E H > S+ 0 0 129 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.815 111.5 50.9 -63.6 -30.8 -8.5 13.9 17.2 144 1747 A I H > S+ 0 0 51 -3,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.918 109.2 50.1 -70.8 -43.7 -7.3 17.5 16.7 145 1748 A K H X S+ 0 0 113 -4,-2.1 4,-1.1 1,-0.2 -2,-0.2 0.899 112.8 46.9 -61.3 -41.2 -6.5 17.9 20.5 146 1749 A K H X S+ 0 0 122 -4,-1.9 4,-1.6 1,-0.2 3,-0.3 0.921 111.8 50.6 -67.1 -42.7 -4.5 14.6 20.4 147 1750 A A H X S+ 0 0 22 -4,-2.1 4,-2.9 1,-0.2 5,-0.3 0.828 99.8 65.9 -63.7 -34.2 -2.7 15.6 17.3 148 1751 A N H X S+ 0 0 7 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.914 106.8 40.1 -55.4 -46.4 -1.7 19.0 18.8 149 1752 A S H X S+ 0 0 79 -4,-1.1 4,-2.5 -3,-0.3 -1,-0.2 0.867 113.8 54.8 -71.3 -36.5 0.5 17.3 21.4 150 1753 A M H X S+ 0 0 137 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.893 110.1 46.4 -63.0 -41.0 1.8 14.8 18.9 151 1754 A V H X S+ 0 0 5 -4,-2.9 4,-2.2 2,-0.2 -2,-0.2 0.914 112.0 49.8 -68.7 -44.1 2.9 17.6 16.6 152 1755 A K H X S+ 0 0 66 -4,-1.9 4,-2.2 -5,-0.3 -2,-0.2 0.934 114.4 45.4 -60.0 -46.8 4.6 19.6 19.4 153 1756 A S H X S+ 0 0 55 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.873 109.2 54.9 -65.2 -38.4 6.4 16.6 20.6 154 1757 A F H X S+ 0 0 48 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.919 110.1 47.5 -61.6 -43.7 7.5 15.5 17.1 155 1758 A F H X S+ 0 0 1 -4,-2.2 4,-2.4 2,-0.2 5,-0.2 0.936 111.1 50.1 -62.8 -47.4 9.0 18.9 16.6 156 1759 A I H X S+ 0 0 23 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.915 110.0 51.3 -59.6 -41.8 10.8 18.9 19.9 157 1760 A R H X S+ 0 0 132 -4,-2.6 4,-1.6 1,-0.2 -1,-0.2 0.885 109.5 49.7 -63.2 -38.9 12.3 15.5 19.2 158 1761 A Q H X S+ 0 0 27 -4,-1.9 4,-2.0 1,-0.2 5,-0.2 0.913 112.0 47.9 -66.2 -41.8 13.6 16.6 15.8 159 1762 A M H X S+ 0 0 1 -4,-2.4 4,-3.0 1,-0.2 7,-0.2 0.874 110.7 51.1 -66.3 -37.2 15.2 19.7 17.3 160 1763 A E H < S+ 0 0 86 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.832 108.8 52.6 -70.2 -30.6 16.8 17.6 20.1 161 1764 A R H < S+ 0 0 181 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.942 121.9 28.8 -68.3 -47.9 18.2 15.1 17.6 162 1765 A V H < S+ 0 0 18 -4,-2.0 -2,-0.2 1,-0.2 -3,-0.2 0.841 135.2 27.6 -83.5 -36.4 19.9 17.8 15.4 163 1766 A F >< + 0 0 1 -4,-3.0 3,-2.0 -5,-0.2 -1,-0.2 -0.589 64.3 164.6-127.0 75.0 20.6 20.5 18.1 164 1767 A P T 3 S+ 0 0 72 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.726 77.3 56.0 -67.4 -23.7 21.0 18.7 21.4 165 1768 A W T 3 S+ 0 0 61 -3,-0.1 2,-0.4 -122,-0.1 -5,-0.1 0.488 90.3 96.8 -81.9 -9.4 22.6 21.7 23.0 166 1769 A F S < S- 0 0 28 -3,-2.0 2,-1.7 -7,-0.2 3,-0.2 -0.729 72.4-136.3 -93.2 130.6 19.6 23.9 22.1 167 1770 A S > + 0 0 70 -2,-0.4 3,-0.9 1,-0.2 4,-0.1 -0.472 39.5 155.7 -83.9 69.5 16.8 24.7 24.6 168 1771 A V G > S+ 0 0 3 -2,-1.7 3,-1.5 1,-0.2 -1,-0.2 0.844 70.1 61.1 -62.8 -35.0 13.8 24.2 22.4 169 1772 A K G 3 S+ 0 0 148 1,-0.3 -1,-0.2 -3,-0.2 -2,-0.1 0.757 98.5 58.7 -64.8 -23.9 11.5 23.4 25.3 170 1773 A K G < S+ 0 0 171 -3,-0.9 -1,-0.3 3,-0.0 -2,-0.2 0.319 72.3 142.5 -90.4 8.8 12.2 26.9 26.8 171 1774 A S X - 0 0 16 -3,-1.5 3,-1.5 1,-0.2 -3,-0.1 -0.212 52.1-137.9 -51.5 135.7 10.9 28.9 23.9 172 1775 A R T 3 S+ 0 0 208 1,-0.3 -1,-0.2 3,-0.0 -3,-0.0 0.640 99.1 65.7 -70.4 -10.4 9.1 32.0 25.0 173 1776 A F T 3 S+ 0 0 55 2,-0.0 -1,-0.3 0, 0.0 2,-0.3 0.403 74.7 101.0 -96.1 2.4 6.5 31.4 22.5 174 1777 A W < 0 0 30 -3,-1.5 -45,-0.1 -5,-0.1 -46,-0.0 -0.621 360.0 360.0 -81.3 144.8 5.1 28.1 23.9 175 1778 A E 0 0 168 -2,-0.3 -3,-0.0 0, 0.0 -2,-0.0 -0.711 360.0 360.0-124.1 360.0 1.8 28.6 25.8