==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 23-NOV-11 3USP . COMPND 2 MOLECULE: TRANSPORTER; . SOURCE 2 ORGANISM_SCIENTIFIC: AQUIFEX AEOLICUS; . AUTHOR H.WANG,J.ELFERICH,E.GOUAUX . 504 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20148.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 403 80.0 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 . 5 1.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 1 0.2 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 . 6 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 51 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 306 60.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 29 5.8 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 2 0 2 2 4 2 1 0 1 1 1 1 3 1 1 0 0 1 0 0 1 0 0 0 1 0 2 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 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 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 5 A R 0 0 99 0, 0.0 262,-0.0 0, 0.0 65,-0.0 0.000 360.0 360.0 360.0 141.7 32.2 56.1 22.5 2 6 A E - 0 0 53 1,-0.0 2,-0.3 262,-0.0 179,-0.0 -0.225 360.0-166.6 -60.8 153.5 32.8 53.9 19.5 3 7 A H - 0 0 57 262,-0.0 2,-0.2 261,-0.0 261,-0.2 -0.988 31.5 -92.9-142.2 150.5 29.9 53.4 17.0 4 8 A W - 0 0 5 259,-1.3 261,-0.2 -2,-0.3 179,-0.1 -0.461 33.4-145.1 -62.1 127.4 29.2 51.1 14.1 5 9 A A S S+ 0 0 74 -2,-0.2 2,-0.2 1,-0.0 -1,-0.1 0.962 73.8 16.4 -60.8 -56.6 30.3 52.8 11.0 6 10 A T > - 0 0 57 1,-0.1 4,-1.6 177,-0.1 5,-0.1 -0.735 69.1-122.1-119.6 165.4 27.6 51.5 8.6 7 11 A R H > S+ 0 0 78 -2,-0.2 4,-2.7 2,-0.2 5,-0.2 0.940 114.8 49.7 -67.4 -49.6 24.2 49.9 8.8 8 12 A L H > S+ 0 0 103 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.895 109.1 53.0 -56.6 -43.2 25.3 46.9 6.8 9 13 A G H > S+ 0 0 0 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.896 109.8 48.6 -59.8 -42.6 28.4 46.5 9.1 10 14 A L H X S+ 0 0 0 -4,-1.6 4,-2.7 2,-0.2 5,-0.3 0.957 112.5 47.7 -59.8 -53.2 26.2 46.5 12.1 11 15 A I H X S+ 0 0 17 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.908 115.0 44.6 -56.2 -47.2 23.8 43.9 10.7 12 16 A L H X S+ 0 0 30 -4,-2.8 4,-1.9 2,-0.2 -1,-0.2 0.779 111.5 54.3 -71.4 -27.5 26.6 41.6 9.6 13 17 A A H X S+ 0 0 3 -4,-1.8 4,-1.2 -5,-0.2 -2,-0.2 0.926 112.2 42.8 -70.5 -46.4 28.4 42.1 13.0 14 18 A M H X S+ 0 0 2 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.904 113.7 52.3 -63.5 -43.2 25.3 41.0 14.9 15 19 A A H X S+ 0 0 1 -4,-2.5 4,-3.6 -5,-0.3 -2,-0.2 0.883 109.0 49.9 -60.4 -39.7 24.7 38.2 12.4 16 20 A G H < S+ 0 0 2 -4,-1.9 -1,-0.3 2,-0.2 -2,-0.2 0.769 107.4 56.1 -68.8 -26.7 28.3 37.1 13.0 17 21 A N H < S+ 0 0 0 -4,-1.2 -2,-0.2 -5,-0.1 -1,-0.2 0.921 118.9 31.1 -67.6 -44.8 27.5 37.3 16.7 18 22 A A H < S+ 0 0 3 -4,-2.3 2,-0.8 489,-0.1 4,-0.2 0.952 104.8 75.5 -78.5 -54.2 24.6 34.9 16.3 19 23 A V S < S+ 0 0 3 -4,-3.6 2,-0.2 -5,-0.2 -1,-0.1 -0.472 73.1 108.4 -69.2 103.7 25.8 32.7 13.4 20 24 A G S >> S- 0 0 0 -2,-0.8 3,-1.6 229,-0.1 4,-1.1 -0.572 84.1 -40.2-147.8-151.8 28.3 30.3 14.9 21 25 A L H 3>>S+ 0 0 9 486,-0.3 4,-2.6 1,-0.3 5,-1.4 0.747 123.9 68.7 -59.7 -24.2 29.1 26.8 16.0 22 26 A G H 34>S+ 0 0 0 485,-2.9 5,-2.3 -4,-0.2 -1,-0.3 0.801 99.7 48.5 -65.7 -29.1 25.6 26.6 17.4 23 27 A N H <45S+ 0 0 0 -3,-1.6 -1,-0.2 484,-0.3 -2,-0.2 0.878 124.0 26.4 -77.3 -41.2 24.2 26.7 13.8 24 28 A F H <5S+ 0 0 1 -4,-1.1 -2,-0.2 3,-0.1 269,-0.2 0.626 135.7 24.0-102.3 -17.0 26.4 24.0 12.3 25 29 A L T X5S+ 0 0 15 -4,-2.6 4,-1.0 -5,-0.2 -3,-0.2 0.776 125.3 36.6-113.4 -51.8 27.3 21.8 15.3 26 30 A R H > S+ 0 0 0 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.933 114.6 44.6 -54.3 -47.3 21.9 19.3 13.9 29 33 A V H X S+ 0 0 7 -4,-1.0 4,-2.6 2,-0.2 -2,-0.2 0.927 114.1 48.4 -62.6 -48.3 22.5 17.3 17.1 30 34 A Q H X S+ 0 0 35 -4,-2.8 4,-1.2 1,-0.2 -1,-0.2 0.909 115.1 44.8 -59.8 -44.4 19.6 18.9 19.0 31 35 A A H <>S+ 0 0 0 -4,-2.9 5,-2.9 -5,-0.2 8,-0.2 0.881 114.7 48.4 -68.6 -39.0 17.2 18.4 16.1 32 36 A A H ><5S+ 0 0 1 -4,-2.3 3,-1.0 -5,-0.3 -2,-0.2 0.878 109.8 51.6 -70.1 -38.5 18.3 14.8 15.5 33 37 A E H 3<5S+ 0 0 57 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.791 109.9 50.9 -67.8 -28.3 18.1 13.8 19.1 34 38 A N T 3<5S- 0 0 35 -4,-1.2 -1,-0.2 -5,-0.2 -2,-0.2 0.067 127.9 -86.2-105.3 25.0 14.5 15.1 19.5 35 39 A G T X 5 - 0 0 39 -3,-1.0 3,-1.5 3,-0.1 2,-0.7 0.666 52.4-112.9 86.6 18.5 12.9 13.4 16.5 36 40 A G T >>> S+ 0 0 2 187,-1.6 4,-1.3 -2,-0.7 3,-0.9 0.858 115.1 62.8 -55.0 -39.3 10.4 17.4 12.7 38 42 A A H <4 S+ 0 0 3 -3,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.746 104.7 50.0 -59.6 -22.2 9.0 16.9 16.2 39 43 A F H <> S+ 0 0 0 -3,-1.5 4,-1.7 -8,-0.2 -1,-0.3 0.714 100.8 64.4 -86.6 -24.7 11.7 19.3 17.4 40 44 A M H S+ 0 0 0 0, 0.0 4,-3.9 0, 0.0 5,-0.3 0.934 115.4 56.8 -50.8 -48.5 8.4 23.9 19.4 43 47 A Y H X S+ 0 0 5 -4,-1.7 4,-2.0 1,-0.2 -2,-0.2 0.937 108.1 45.4 -43.6 -60.1 11.5 25.4 18.0 44 48 A I H X S+ 0 0 77 -4,-3.7 4,-1.6 1,-0.2 3,-0.3 0.923 114.7 48.2 -53.0 -49.5 9.5 27.7 15.7 45 49 A I H X S+ 0 0 53 -4,-2.7 4,-2.9 -5,-0.3 3,-0.5 0.930 108.9 53.6 -56.4 -47.1 7.2 28.6 18.6 46 50 A A H X>S+ 0 0 0 -4,-3.9 5,-2.2 1,-0.3 4,-1.3 0.821 106.9 53.7 -58.3 -31.4 10.2 29.3 20.8 47 51 A F H <>S+ 0 0 33 -4,-2.0 5,-2.3 -3,-0.3 -1,-0.3 0.860 114.0 40.5 -72.0 -35.0 11.5 31.6 18.1 48 52 A L H <5S+ 0 0 82 -4,-1.6 -2,-0.2 -3,-0.5 -1,-0.2 0.882 124.3 34.4 -80.7 -41.3 8.3 33.6 18.0 49 53 A L H <5S+ 0 0 50 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.583 138.0 10.9 -93.7 -12.0 7.5 33.8 21.7 50 54 A V T X5S+ 0 0 0 -4,-1.3 4,-2.2 -5,-0.4 5,-0.3 0.646 119.6 52.6-129.8 -57.9 11.1 34.0 23.1 51 55 A G H > S+ 0 0 0 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.910 115.4 46.7 -58.4 -45.0 11.1 39.5 21.8 54 58 A L H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.856 110.5 54.1 -64.9 -36.6 14.3 38.9 23.8 55 59 A M H X S+ 0 0 4 -4,-2.2 4,-2.5 -5,-0.3 5,-0.2 0.971 111.2 44.4 -58.3 -55.3 16.4 39.9 20.9 56 60 A W H X S+ 0 0 8 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.913 113.3 52.0 -54.5 -46.0 14.5 43.2 20.6 57 61 A I H X S+ 0 0 0 -4,-2.6 4,-2.8 -5,-0.2 -1,-0.2 0.907 110.5 46.7 -59.4 -45.0 14.7 43.7 24.4 58 62 A E H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.870 111.1 52.1 -68.6 -37.8 18.5 43.2 24.5 59 63 A W H X S+ 0 0 0 -4,-2.5 4,-2.8 -5,-0.2 5,-0.2 0.940 112.0 47.6 -57.7 -47.4 19.0 45.5 21.5 60 64 A A H X S+ 0 0 0 -4,-2.6 4,-2.9 2,-0.2 -2,-0.2 0.943 112.7 46.2 -61.0 -52.0 17.0 48.1 23.4 61 65 A M H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 5,-0.2 0.896 113.1 52.7 -58.0 -41.5 18.8 47.7 26.7 62 66 A G H X S+ 0 0 0 -4,-2.4 4,-2.7 -5,-0.2 -2,-0.2 0.961 112.5 41.4 -58.9 -56.0 22.1 47.8 24.8 63 67 A R H X S+ 0 0 1 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.933 114.7 52.9 -58.9 -47.6 21.4 51.0 23.0 64 68 A Y H X S+ 0 0 48 -4,-2.9 4,-0.5 -5,-0.2 -1,-0.2 0.922 113.1 42.9 -53.0 -51.0 19.9 52.6 26.1 65 69 A G H ><>S+ 0 0 0 -4,-2.7 5,-2.2 1,-0.2 3,-1.5 0.911 111.0 55.6 -63.1 -43.6 23.0 51.8 28.2 66 70 A G H ><5S+ 0 0 10 -4,-2.7 3,-1.6 1,-0.3 -1,-0.2 0.820 95.9 65.8 -59.5 -33.2 25.3 52.9 25.4 67 71 A A H 3<5S+ 0 0 52 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.767 108.1 40.9 -60.8 -24.5 23.6 56.3 25.3 68 72 A Q T <<5S- 0 0 92 -3,-1.5 -1,-0.3 -4,-0.5 -2,-0.2 0.238 127.8 -95.8-108.9 11.2 25.0 56.8 28.8 69 73 A G T < 5S+ 0 0 31 -3,-1.6 2,-0.4 1,-0.2 -3,-0.2 0.774 87.6 117.5 82.9 28.5 28.4 55.3 28.2 70 74 A H < + 0 0 44 -5,-2.2 -1,-0.2 -8,-0.1 -2,-0.2 -0.994 29.2 168.6-130.8 135.4 27.7 51.8 29.5 71 75 A G + 0 0 0 -2,-0.4 2,-0.3 289,-0.2 191,-0.2 0.478 58.0 71.8-121.7 -7.9 27.7 48.5 27.6 72 76 A T S >> S- 0 0 3 288,-0.2 4,-2.1 -7,-0.1 3,-0.8 -0.800 80.1-117.0-116.3 158.4 27.5 45.8 30.2 73 77 A T H 3> S+ 0 0 2 -2,-0.3 4,-2.4 17,-0.2 5,-0.4 0.719 102.7 71.5 -67.5 -26.9 24.7 44.7 32.5 74 78 A P H 34 S+ 0 0 6 0, 0.0 4,-0.4 0, 0.0 -1,-0.2 0.921 115.3 26.7 -54.7 -41.7 26.3 45.6 35.9 75 79 A A H <> S+ 0 0 16 -3,-0.8 4,-1.7 2,-0.2 -2,-0.2 0.852 121.9 53.3 -86.9 -40.1 25.7 49.2 35.1 76 80 A I H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 5,-0.2 0.927 106.8 51.4 -63.7 -47.6 22.8 48.9 32.7 77 81 A F H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.852 110.8 51.1 -54.6 -35.8 20.7 46.9 35.2 78 82 A Y H 4 S+ 0 0 41 -4,-0.4 -1,-0.2 -5,-0.4 -2,-0.2 0.822 107.3 52.3 -74.2 -31.7 21.5 49.6 37.7 79 83 A L H < S+ 0 0 20 -4,-1.7 3,-0.2 1,-0.2 -2,-0.2 0.879 116.2 40.1 -67.3 -39.1 20.3 52.3 35.2 80 84 A L H < S+ 0 0 11 -4,-2.3 2,-0.3 1,-0.3 -2,-0.2 0.788 132.3 24.7 -79.9 -29.0 17.0 50.4 34.8 81 85 A W S < S- 0 0 68 -4,-2.0 2,-2.3 -5,-0.2 -1,-0.3 -0.864 74.2-144.9-142.4 101.7 16.7 49.5 38.5 82 86 A R + 0 0 146 -2,-0.3 2,-0.3 -3,-0.2 -4,-0.1 -0.431 62.9 108.8 -69.2 80.6 18.5 51.7 41.1 83 87 A N S >> S- 0 0 69 -2,-2.3 3,-1.6 1,-0.1 4,-0.9 -0.968 72.4-130.0-157.7 139.6 19.4 48.9 43.4 84 88 A R H >> S+ 0 0 120 -2,-0.3 4,-2.6 1,-0.3 3,-0.6 0.866 110.5 62.8 -59.7 -36.8 22.6 47.2 44.4 85 89 A F H 3> S+ 0 0 106 1,-0.3 4,-2.6 2,-0.2 -1,-0.3 0.755 96.7 60.5 -59.2 -24.3 21.0 43.8 43.8 86 90 A A H <> S+ 0 0 0 -3,-1.6 4,-1.3 2,-0.2 -1,-0.3 0.876 106.0 44.9 -70.8 -39.0 20.7 45.0 40.2 87 91 A K H < S+ 0 0 79 -4,-2.6 3,-0.9 1,-0.3 4,-0.5 0.933 113.2 44.3 -51.3 -52.6 24.9 42.0 41.6 89 93 A L H >< S+ 0 0 23 -4,-2.6 3,-1.0 1,-0.2 4,-0.3 0.823 107.6 63.0 -60.5 -30.6 22.5 40.3 39.1 90 94 A G H >< S+ 0 0 0 -4,-1.3 3,-2.1 1,-0.2 4,-0.3 0.785 83.3 76.4 -66.2 -29.1 24.3 42.3 36.4 91 95 A V T XX S+ 0 0 1 -4,-1.4 4,-2.6 -3,-0.9 3,-2.3 0.830 82.6 67.2 -50.8 -35.8 27.5 40.4 37.1 92 96 A F H <> S+ 0 0 47 -3,-1.0 4,-2.6 -4,-0.5 -1,-0.3 0.790 86.1 70.2 -56.9 -28.0 26.1 37.4 35.3 93 97 A G H <4 S+ 0 0 2 -3,-2.1 -1,-0.3 -4,-0.3 -2,-0.2 0.625 112.0 29.7 -67.0 -13.4 26.3 39.6 32.1 94 98 A L H <> S+ 0 0 0 -3,-2.3 4,-2.4 -4,-0.3 -2,-0.2 0.713 118.2 55.6-107.2 -44.5 30.0 39.3 32.3 95 99 A W H X S+ 0 0 20 -4,-2.6 4,-2.8 2,-0.2 5,-0.3 0.930 107.3 49.1 -55.3 -52.0 30.3 35.9 34.0 96 100 A I H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 5,-0.2 0.951 114.0 43.0 -57.0 -55.8 28.2 34.0 31.4 97 101 A P H > S+ 0 0 1 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.867 115.4 51.5 -62.1 -36.2 30.0 35.3 28.3 98 102 A L H X S+ 0 0 5 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.986 112.9 42.9 -60.0 -59.8 33.4 34.8 30.0 99 103 A V H X S+ 0 0 0 -4,-2.8 4,-0.8 1,-0.2 5,-0.2 0.891 115.6 49.8 -54.5 -44.4 32.8 31.2 31.0 100 104 A V H >X S+ 0 0 0 -4,-2.7 4,-2.7 -5,-0.3 3,-0.8 0.921 109.3 51.4 -62.4 -44.7 31.3 30.4 27.6 101 105 A A H 3X S+ 0 0 0 -4,-2.4 4,-2.6 253,-0.3 5,-0.4 0.895 97.2 70.9 -56.6 -41.5 34.2 32.0 25.8 102 106 A I H 3< S+ 0 0 0 -4,-2.3 -1,-0.2 1,-0.2 4,-0.2 0.804 116.9 18.1 -48.7 -39.3 36.6 29.9 27.9 103 107 A Y H S+ 0 0 2 -5,-0.4 4,-2.0 2,-0.2 -2,-0.2 0.943 108.5 47.1 -66.4 -48.0 38.9 26.1 22.5 107 111 A I H X S+ 0 0 12 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.917 110.7 54.4 -58.1 -42.6 36.4 24.3 20.2 108 112 A E H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.930 104.8 52.7 -54.2 -47.6 37.0 27.0 17.7 109 113 A S H X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 -1,-0.2 0.874 105.2 57.1 -58.4 -36.5 40.8 26.3 17.9 110 114 A W H X S+ 0 0 11 -4,-2.0 4,-2.8 1,-0.2 5,-0.3 0.979 105.8 48.4 -53.7 -58.0 39.8 22.7 17.2 111 115 A T H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.874 111.8 50.7 -52.3 -41.1 38.1 23.7 14.0 112 116 A L H X S+ 0 0 20 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.963 110.4 47.8 -61.6 -52.9 41.2 25.8 13.0 113 117 A G H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 5,-0.2 0.918 112.5 49.1 -53.6 -48.8 43.6 22.9 13.6 114 118 A F H X S+ 0 0 1 -4,-2.8 4,-2.5 2,-0.2 5,-0.3 0.897 108.5 54.2 -59.4 -42.0 41.4 20.5 11.6 115 119 A A H X S+ 0 0 2 -4,-2.3 4,-2.2 -5,-0.3 -2,-0.2 0.954 111.4 45.8 -55.0 -51.0 41.2 23.0 8.8 116 120 A I H X S+ 0 0 65 -4,-2.6 4,-2.2 1,-0.2 6,-0.2 0.952 114.1 45.5 -56.8 -55.6 45.0 23.2 8.7 117 121 A K H <>S+ 0 0 49 -4,-2.8 5,-2.1 1,-0.2 4,-0.5 0.842 114.8 48.7 -61.9 -34.5 45.6 19.4 8.9 118 122 A F H <5S+ 0 0 5 -4,-2.5 -1,-0.2 -5,-0.2 219,-0.2 0.848 109.2 53.3 -73.7 -33.9 42.9 18.7 6.2 119 123 A L H <5S+ 0 0 96 -4,-2.2 -2,-0.2 -5,-0.3 -1,-0.2 0.909 112.4 43.3 -65.1 -43.0 44.4 21.4 3.9 120 124 A V T <5S- 0 0 99 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.550 115.0-117.8 -82.3 -6.9 47.9 19.9 4.1 121 125 A G T 5 + 0 0 41 -4,-0.5 2,-1.9 -5,-0.2 -3,-0.2 0.639 66.9 142.8 80.9 15.2 46.4 16.4 3.7 122 126 A L < + 0 0 115 -5,-2.1 -1,-0.2 -6,-0.2 -3,-0.1 -0.470 35.9 126.4 -85.5 67.6 47.6 15.2 7.0 123 127 A V - 0 0 30 -2,-1.9 16,-0.1 -5,-0.1 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112.1 47.2 -54.5 -49.6 13.3 22.6 26.9 241 246 A A H X S+ 0 0 17 -4,-2.7 4,-2.6 -5,-0.2 -2,-0.2 0.932 112.1 50.3 -58.4 -48.2 15.7 21.5 24.1 242 247 A A H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.945 113.3 44.0 -56.5 -53.5 14.1 23.8 21.6 243 248 A V H X S+ 0 0 1 -4,-2.9 4,-2.8 1,-0.2 -1,-0.2 0.919 112.4 52.9 -60.2 -45.8 14.2 26.9 23.9 244 249 A G H X S+ 0 0 17 -4,-2.7 4,-2.8 -5,-0.3 -1,-0.2 0.928 109.8 48.9 -53.6 -47.5 17.7 26.1 24.9 245 250 A Q H X S+ 0 0 0 -4,-2.6 4,-2.8 2,-0.2 5,-0.3 0.887 110.0 52.0 -61.1 -41.5 18.8 25.9 21.3 246 251 A I H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 6,-0.3 0.967 111.2 46.7 -57.4 -55.2 17.0 29.3 20.6 247 252 A F H <>S+ 0 0 0 -4,-2.8 5,-2.2 1,-0.2 4,-0.3 0.937 116.2 44.5 -51.2 -53.9 18.8 31.0 23.5 248 253 A F H ><5S+ 0 0 11 -4,-2.8 3,-0.9 1,-0.2 -1,-0.2 0.917 116.0 45.2 -61.0 -46.7 22.2 29.6 22.4 249 254 A T H 3<5S+ 0 0 0 -4,-2.8 -1,-0.2 258,-0.3 -2,-0.2 0.855 114.5 46.8 -70.8 -35.8 21.9 30.3 18.7 250 255 A L T 3<5S- 0 0 0 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.370 108.6-122.3 -87.1 6.3 20.5 33.8 19.1 251 256 A S T X 5 + 0 0 0 -3,-0.9 3,-0.8 -4,-0.3 6,-0.7 0.823 55.4 163.6 56.9 32.6 23.2 34.6 21.6 252 257 A L T 3 < + 0 0 0 -5,-2.2 -1,-0.2 -6,-0.3 159,-0.1 -0.675 57.8 16.5 -87.3 134.4 20.4 35.5 24.1 253 258 A G T 3 S+ 0 0 0 -2,-0.4 -1,-0.2 157,-0.1 157,-0.1 0.545 98.8 99.0 84.5 8.2 21.3 35.8 27.7 254 259 A F S < S- 0 0 0 -3,-0.8 -2,-0.1 -7,-0.1 -154,-0.1 0.534 88.1-126.8-100.4 -10.8 25.0 36.0 27.0 255 260 A G S > S+ 0 0 2 -4,-0.2 4,-1.7 -159,-0.1 5,-0.1 0.476 84.4 108.2 76.7 1.8 25.2 39.8 27.3 256 261 A A H > S+ 0 0 0 -5,-0.4 4,-2.8 2,-0.2 5,-0.2 0.929 74.2 49.1 -75.3 -48.2 26.8 39.9 23.9 257 262 A I H > S+ 0 0 2 -6,-0.7 4,-2.3 1,-0.2 -1,-0.2 0.889 112.5 50.1 -57.8 -41.6 23.8 41.3 22.0 258 263 A I H > S+ 0 0 0 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.947 111.5 46.9 -62.3 -50.0 23.5 44.1 24.7 259 264 A T H < S+ 0 0 2 -4,-1.7 3,-0.4 1,-0.2 -2,-0.2 0.913 114.0 47.7 -60.5 -45.3 27.2 45.0 24.5 260 265 A Y H >< S+ 0 0 1 -4,-2.8 3,-1.4 1,-0.2 -1,-0.2 0.904 111.8 50.7 -60.0 -42.4 27.2 45.1 20.7 261 266 A A H >< S+ 0 0 0 -4,-2.3 3,-1.9 1,-0.3 -1,-0.2 0.702 92.7 75.3 -70.9 -19.9 24.0 47.2 20.8 262 267 A S T 3< S+ 0 0 1 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.585 92.3 56.3 -68.9 -8.3 25.6 49.6 23.2 263 268 A Y T < S+ 0 0 4 -3,-1.4 -259,-1.3 -4,-0.2 2,-0.4 0.358 82.4 105.4-103.9 2.8 27.6 50.9 20.2 264 269 A V S < S- 0 0 3 -3,-1.9 -198,-0.1 -261,-0.2 6,-0.0 -0.705 84.8-102.8 -81.8 131.9 24.4 51.7 18.2 265 270 A R > - 0 0 128 -2,-0.4 3,-1.4 -261,-0.2 -1,-0.1 -0.220 29.8-112.8 -58.2 143.6 23.8 55.4 18.1 266 271 A K T 3 S+ 0 0 116 1,-0.3 -1,-0.1 -200,-0.1 -199,-0.1 0.773 116.7 40.5 -47.9 -33.6 21.0 56.6 20.4 267 272 A D T 3 S+ 0 0 107 2,-0.1 -1,-0.3 -204,-0.0 -2,-0.1 0.666 90.6 110.1 -91.7 -19.0 18.8 57.5 17.5 268 273 A Q S < S- 0 0 33 -3,-1.4 167,-0.1 1,-0.1 -4,-0.1 -0.283 74.7-103.4 -69.0 141.4 19.5 54.5 15.2 269 274 A D + 0 0 5 165,-0.2 166,-0.2 1,-0.1 -1,-0.1 -0.188 36.0 172.6 -60.4 150.5 16.8 51.8 14.6 270 275 A I > + 0 0 1 161,-0.3 4,-2.0 163,-0.1 5,-0.3 0.420 66.7 71.9-133.4 -14.0 17.1 48.5 16.4 271 276 A V H > S+ 0 0 0 160,-0.2 4,-2.7 2,-0.2 5,-0.2 0.995 107.3 30.9 -68.4 -64.9 13.7 46.9 15.5 272 277 A L H > S+ 0 0 57 2,-0.2 4,-2.1 1,-0.2 -1,-0.1 0.860 122.5 52.5 -63.9 -37.1 14.4 46.1 11.8 273 278 A S H > S+ 0 0 1 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.963 112.2 43.0 -63.1 -54.3 18.1 45.6 12.5 274 279 A G H X S+ 0 0 0 -4,-2.0 4,-2.8 1,-0.2 5,-0.2 0.930 114.8 50.5 -57.2 -48.5 17.5 43.1 15.3 275 280 A L H X S+ 0 0 51 -4,-2.7 4,-2.6 -5,-0.3 -1,-0.2 0.883 111.2 49.7 -56.8 -40.0 14.8 41.4 13.3 276 281 A T H X S+ 0 0 51 -4,-2.1 4,-2.5 -5,-0.2 -2,-0.2 0.907 111.4 47.5 -68.4 -43.3 17.1 41.1 10.3 277 282 A A H X S+ 0 0 3 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.952 114.1 47.2 -61.1 -51.0 20.0 39.7 12.3 278 283 A A H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.938 112.8 49.0 -55.2 -50.5 17.8 37.2 14.0 279 284 A T H X S+ 0 0 45 -4,-2.6 4,-2.5 -5,-0.2 -1,-0.2 0.904 109.9 52.0 -57.8 -44.3 16.2 36.2 10.7 280 285 A L H X S+ 0 0 61 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.923 109.9 49.2 -57.2 -46.7 19.7 35.8 9.1 281 286 A N H X S+ 0 0 0 -4,-2.5 4,-1.3 1,-0.2 -2,-0.2 0.906 111.0 49.5 -60.0 -43.2 20.8 33.5 11.9 282 287 A E H X>S+ 0 0 18 -4,-2.5 4,-2.8 2,-0.2 5,-0.5 0.891 111.0 49.1 -64.6 -40.6 17.6 31.4 11.6 283 288 A K H X>S+ 0 0 112 -4,-2.5 4,-1.3 1,-0.2 5,-1.2 0.904 111.6 49.3 -64.3 -41.4 18.2 31.1 7.8 284 289 A A H <>S+ 0 0 10 -4,-2.5 5,-2.1 -5,-0.2 -1,-0.2 0.749 117.8 43.7 -67.8 -23.1 21.8 30.1 8.4 285 290 A E H <>S+ 0 0 0 -4,-1.3 5,-1.1 3,-0.2 -2,-0.2 0.953 122.3 27.5 -87.6 -60.5 20.6 27.6 11.0 286 291 A V H <5S+ 0 0 21 -4,-2.8 -3,-0.2 3,-0.2 -2,-0.1 0.820 132.2 34.7 -76.5 -31.7 17.6 25.7 9.6 287 292 A I T < > S+ 0 0 0 -3,-0.6 4,-1.8 -4,-0.2 5,-0.2 0.776 112.9 25.5-108.9 -75.8 24.6 19.6 5.7 293 298 A S H X S+ 0 0 1 -4,-0.6 4,-2.9 2,-0.2 5,-0.2 0.945 124.0 45.2 -61.4 -56.2 25.4 17.2 8.6 294 299 A I H > S+ 0 0 5 -5,-0.4 4,-2.7 1,-0.2 5,-0.3 0.935 113.7 48.0 -57.3 -52.5 22.0 15.6 9.0 295 300 A P H > S+ 0 0 0 0, 0.0 4,-2.0 0, 0.0 -74,-0.3 0.872 115.1 46.9 -59.0 -37.7 21.3 15.0 5.2 296 301 A A H X S+ 0 0 0 -4,-1.8 4,-2.3 2,-0.2 5,-0.3 0.963 113.0 46.9 -66.7 -53.0 24.8 13.5 4.8 297 302 A A H X>S+ 0 0 1 -4,-2.9 4,-2.3 1,-0.2 5,-0.6 0.868 116.4 45.5 -56.7 -40.1 24.6 11.2 7.8 298 303 A V H X5S+ 0 0 2 -4,-2.7 4,-1.3 -5,-0.2 -1,-0.2 0.876 110.9 53.5 -71.1 -38.4 21.1 10.1 6.8 299 304 A A H <5S+ 0 0 0 -4,-2.0 -86,-0.4 -5,-0.3 -84,-0.4 0.863 119.4 33.8 -63.8 -36.6 22.2 9.6 3.2 300 305 A F H <5S+ 0 0 44 -4,-2.3 -2,-0.2 -85,-0.1 -1,-0.2 0.786 137.7 15.3 -91.4 -31.1 25.1 7.4 4.2 301 306 A F H <5S- 0 0 36 -4,-2.3 4,-0.4 -5,-0.3 -3,-0.2 0.627 101.9-116.1-118.9 -22.4 23.7 5.6 7.2 302 307 A G X< - 0 0 13 -4,-1.3 4,-1.8 -5,-0.6 -1,-0.2 -0.270 40.4 -67.9 98.1 168.3 20.0 6.0 7.2 303 308 A V H > S+ 0 0 60 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.960 127.4 47.7 -60.3 -58.2 17.7 7.8 9.7 304 309 A A H > S+ 0 0 77 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.933 115.2 44.3 -50.4 -58.1 18.0 5.5 12.7 305 310 A N H > S+ 0 0 95 -4,-0.4 4,-2.4 1,-0.2 -1,-0.2 0.838 111.9 54.9 -57.5 -35.2 21.8 5.2 12.5 306 311 A A H X S+ 0 0 4 -4,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.927 108.6 47.2 -64.5 -46.1 22.0 9.0 12.0 307 312 A V H X S+ 0 0 30 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.907 110.9 52.8 -60.4 -43.4 19.9 9.6 15.1 308 313 A A H X S+ 0 0 57 -4,-2.5 4,-1.4 -5,-0.2 -2,-0.2 0.926 109.5 48.7 -57.2 -46.8 22.1 7.2 17.0 309 314 A I H X S+ 0 0 28 -4,-2.4 4,-0.9 1,-0.2 -1,-0.2 0.894 110.1 51.6 -60.2 -42.1 25.2 9.1 15.9 310 315 A A H < S+ 0 0 1 -4,-2.4 3,-0.4 1,-0.2 -1,-0.2 0.891 111.2 47.1 -62.7 -40.3 23.7 12.4 16.9 311 316 A K H < S+ 0 0 115 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.721 95.1 79.3 -73.1 -22.0 22.9 10.9 20.4 312 317 A A H < S- 0 0 65 -4,-1.4 2,-0.2 -5,-0.2 -1,-0.2 0.922 112.0 -50.6 -51.9 -51.0 26.5 9.6 20.6 313 318 A G < - 0 0 23 -4,-0.9 4,-0.2 -3,-0.4 -1,-0.1 -0.870 49.3 -92.5-164.9-163.2 27.9 13.0 21.5 314 319 A A S S+ 0 0 59 -2,-0.2 4,-0.2 2,-0.1 -285,-0.1 0.604 120.2 33.2-104.9 -18.2 28.1 16.7 20.7 315 320 A F S >>S+ 0 0 45 2,-0.1 4,-2.4 3,-0.1 5,-0.5 0.470 94.6 88.7-115.7 -6.7 31.2 16.5 18.6 316 321 A N H >>S+ 0 0 33 1,-0.2 5,-2.8 2,-0.2 4,-1.5 0.929 90.7 44.1 -57.0 -50.8 30.8 13.1 16.9 317 322 A L H 4>S+ 0 0 6 -8,-0.2 5,-2.0 3,-0.2 -1,-0.2 0.865 121.6 36.6 -66.2 -39.4 28.8 14.3 14.0 318 323 A G H 45S+ 0 0 3 -4,-0.2 -2,-0.2 3,-0.2 -1,-0.2 0.832 126.8 30.0 -87.0 -36.0 30.9 17.3 13.1 319 324 A F H <5S+ 0 0 1 -4,-2.4 -3,-0.2 3,-0.1 -2,-0.2 0.603 135.1 17.6-102.3 -14.8 34.4 16.2 13.8 320 325 A I T X S+ 0 0 2 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.882 112.5 54.4 -61.7 -36.1 34.8 14.2 7.5 324 329 A A H < S+ 0 0 3 -4,-1.6 4,-0.4 2,-0.2 -2,-0.2 0.905 109.2 47.5 -60.8 -43.5 34.6 10.4 7.4 325 330 A I H >< S+ 0 0 3 -4,-2.3 3,-1.3 1,-0.2 -1,-0.2 0.914 111.3 51.0 -62.8 -44.0 31.7 10.6 5.0 326 331 A F H >< S+ 0 0 2 -4,-2.5 3,-2.3 1,-0.3 -2,-0.2 0.846 97.8 66.8 -62.6 -35.5 33.5 13.2 2.8 327 332 A S T 3< S+ 0 0 35 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.675 91.7 63.9 -62.2 -16.6 36.6 10.9 2.6 328 333 A Q T < S+ 0 0 92 -3,-1.3 2,-0.3 -4,-0.4 -1,-0.3 0.411 97.7 70.0 -88.0 1.6 34.6 8.5 0.6 329 334 A T S X S- 0 0 25 -3,-2.3 3,-1.8 -4,-0.1 2,-0.2 -0.827 97.1 -89.0-118.6 158.1 34.2 11.1 -2.2 330 335 A A T 3 S+ 0 0 98 -2,-0.3 -2,-0.1 1,-0.3 -3,-0.0 -0.466 116.5 9.2 -65.6 128.3 36.6 12.6 -4.7 331 336 A G T 3> S+ 0 0 56 -2,-0.2 4,-1.7 -4,-0.1 -1,-0.3 0.748 87.5 143.5 71.1 24.8 38.2 15.7 -3.3 332 337 A G H <> + 0 0 3 -3,-1.8 4,-2.2 1,-0.2 -5,-0.2 0.805 63.3 56.8 -66.9 -31.9 36.7 14.7 0.1 333 338 A T H > S+ 0 0 54 2,-0.2 4,-2.2 -4,-0.2 -1,-0.2 0.937 108.9 44.9 -65.0 -48.0 39.7 15.9 2.1 334 339 A F H > S+ 0 0 115 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.850 110.4 56.4 -64.2 -34.2 39.5 19.4 0.6 335 340 A L H X S+ 0 0 9 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.917 106.3 49.5 -61.8 -44.0 35.8 19.3 1.2 336 341 A G H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 5,-0.3 0.905 107.4 55.6 -59.5 -42.9 36.5 18.6 4.9 337 342 A F H X S+ 0 0 28 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.921 107.7 48.1 -53.8 -47.3 38.9 21.5 4.8 338 343 A L H X S+ 0 0 21 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.906 110.5 52.9 -61.9 -42.4 36.1 23.8 3.6 339 344 A W H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.954 112.8 42.0 -55.0 -54.6 33.8 22.4 6.3 340 345 A F H X S+ 0 0 0 -4,-2.8 4,-2.0 2,-0.2 -225,-0.2 0.778 112.6 54.4 -69.1 -26.9 36.3 23.1 9.1 341 346 A F H X S+ 0 0 61 -4,-2.0 4,-2.5 -5,-0.3 -1,-0.2 0.937 109.1 48.1 -70.2 -47.9 37.1 26.5 7.6 342 347 A L H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 5,-0.3 0.967 112.1 49.5 -49.1 -58.3 33.5 27.5 7.6 343 348 A L H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.885 109.8 53.0 -49.9 -42.8 33.2 26.3 11.2 344 349 A F H X S+ 0 0 10 -4,-2.0 4,-2.9 -233,-0.2 -1,-0.2 0.914 109.4 45.9 -64.4 -45.6 36.3 28.3 12.1 345 350 A F H X S+ 0 0 28 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.940 114.1 48.3 -63.6 -46.7 34.9 31.6 10.7 346 351 A A H X S+ 0 0 0 -4,-2.6 4,-1.6 -5,-0.2 -2,-0.2 0.962 113.7 48.4 -54.8 -52.6 31.5 31.1 12.4 347 352 A G H >X S+ 0 0 0 -4,-2.7 4,-2.8 -5,-0.3 3,-0.9 0.952 112.3 47.4 -50.7 -59.6 33.3 30.3 15.6 348 353 A L H 3X S+ 0 0 1 -4,-2.9 4,-2.6 1,-0.3 5,-0.4 0.932 108.9 53.2 -48.3 -56.6 35.6 33.3 15.5 349 354 A T H 3< S+ 0 0 4 -4,-2.7 4,-0.5 1,-0.2 -1,-0.3 0.751 115.4 42.6 -58.3 -25.9 32.8 35.8 14.6 350 355 A S H X S+ 0 0 0 -4,-2.8 4,-1.0 1,-0.2 3,-0.6 0.924 104.8 52.7 -60.0 -49.6 33.9 34.4 20.1 352 357 A I H >X S+ 0 0 3 -4,-2.6 4,-2.0 1,-0.3 3,-0.9 0.911 109.1 54.1 -51.7 -39.6 35.0 38.0 19.5 353 358 A A H 34 S+ 0 0 0 -4,-0.5 -1,-0.3 -5,-0.4 -2,-0.2 0.833 107.5 48.7 -63.6 -35.6 31.4 38.8 20.3 354 359 A I H << S+ 0 0 1 -4,-1.5 4,-0.3 -3,-0.6 -253,-0.3 0.499 113.4 46.0 -88.3 -2.5 31.5 36.9 23.6 355 360 A M H S+ 0 0 0 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.978 108.4 40.6 -60.0 -55.7 31.5 42.2 26.9 358 363 A M H > S+ 0 0 5 -4,-0.3 4,-2.6 1,-0.2 3,-0.3 0.941 115.3 52.5 -56.4 -49.1 34.4 41.8 29.3 359 364 A I H X S+ 0 0 1 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.922 110.0 49.0 -50.9 -45.6 36.5 44.1 27.1 360 365 A A H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 5,-0.3 0.784 108.8 52.3 -70.0 -30.3 33.7 46.7 27.3 361 366 A F H X>S+ 0 0 2 -4,-1.9 4,-2.2 -3,-0.3 5,-1.1 0.926 110.3 48.2 -68.5 -45.9 33.4 46.4 31.1 362 367 A L H <5S+ 0 0 9 -4,-2.6 6,-2.6 3,-0.2 4,-0.3 0.862 118.2 42.3 -61.6 -35.6 37.1 47.0 31.5 363 368 A E H <5S+ 0 0 34 -4,-2.0 4,-0.5 -5,-0.2 -2,-0.2 0.951 122.3 34.9 -74.8 -52.4 36.9 50.0 29.1 364 369 A D H <5S+ 0 0 22 -4,-2.7 -3,-0.2 2,-0.1 -2,-0.2 0.919 130.1 26.7 -71.5 -47.1 33.7 51.6 30.4 365 370 A E T <5S+ 0 0 15 -4,-2.2 -3,-0.2 -5,-0.3 133,-0.2 0.817 131.3 32.1 -94.4 -35.2 33.9 51.0 34.1 366 371 A L S - 0 0 57 -2,-0.2 4,-2.7 1,-0.1 5,-0.2 -0.322 31.9-109.2 -67.7 159.8 42.6 51.4 27.3 370 375 A R H > S+ 0 0 97 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.913 118.6 53.0 -58.5 -43.8 41.4 49.1 24.5 371 376 A K H > S+ 0 0 123 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.958 113.2 41.0 -55.0 -56.7 44.8 47.5 24.3 372 377 A H H > S+ 0 0 98 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.883 115.2 51.5 -62.9 -41.8 45.0 46.7 28.0 373 378 A A H X S+ 0 0 0 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.952 113.2 44.4 -59.8 -51.3 41.4 45.6 28.2 374 379 A V H X S+ 0 0 2 -4,-2.8 4,-2.6 -5,-0.2 -2,-0.2 0.910 114.8 49.2 -59.6 -44.7 41.7 43.2 25.3 375 380 A L H X S+ 0 0 77 -4,-2.6 4,-1.6 -5,-0.3 -1,-0.2 0.896 113.3 45.1 -65.3 -42.2 45.0 41.8 26.5 376 381 A W H X S+ 0 0 157 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.889 113.1 50.7 -69.6 -40.1 43.8 41.2 30.0 377 382 A T H X S+ 0 0 1 -4,-2.5 4,-2.8 -5,-0.2 5,-0.2 0.948 111.9 47.6 -58.9 -49.3 40.6 39.6 28.8 378 383 A A H X S+ 0 0 12 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.819 110.8 53.4 -61.6 -32.5 42.6 37.4 26.5 379 384 A A H X S+ 0 0 43 -4,-1.6 4,-2.8 2,-0.2 5,-0.3 0.933 110.0 45.9 -67.5 -47.2 44.8 36.6 29.4 380 385 A I H X S+ 0 0 31 -4,-2.6 4,-2.7 2,-0.2 5,-0.2 0.938 116.2 45.4 -61.2 -49.1 41.9 35.5 31.6 381 386 A V H X S+ 0 0 0 -4,-2.8 4,-1.8 2,-0.2 -2,-0.2 0.941 114.2 49.0 -58.8 -49.5 40.3 33.5 28.9 382 387 A F H X S+ 0 0 55 -4,-2.5 4,-0.6 -5,-0.2 -2,-0.2 0.931 115.5 42.4 -58.1 -50.8 43.7 31.8 27.9 383 388 A F H >< S+ 0 0 135 -4,-2.8 3,-1.5 1,-0.2 4,-0.4 0.952 114.9 49.3 -62.0 -50.8 44.6 30.9 31.5 384 389 A S H >X S+ 0 0 1 -4,-2.7 3,-1.2 -5,-0.3 4,-0.6 0.781 99.3 69.8 -59.5 -27.8 41.1 29.7 32.4 385 390 A A H 3X S+ 0 0 0 -4,-1.8 4,-2.1 1,-0.3 3,-0.5 0.736 80.3 74.5 -66.4 -23.8 41.0 27.6 29.2 386 391 A H H S+ 0 0 37 -3,-1.2 4,-1.7 -4,-0.4 -1,-0.2 0.893 109.4 43.3 -64.1 -40.0 40.9 23.7 32.8 388 393 A V H < S+ 0 0 3 -4,-0.6 7,-0.3 -3,-0.5 -2,-0.2 0.819 115.0 51.3 -72.4 -31.7 38.9 22.9 29.8 389 394 A M H < S+ 0 0 0 -4,-2.1 -2,-0.2 1,-0.1 -1,-0.2 0.809 122.9 25.6 -76.6 -31.0 41.9 21.6 28.0 390 395 A F H < S+ 0 0 89 -4,-2.1 -233,-2.2 -5,-0.2 2,-0.6 0.585 107.2 74.1-113.6 -14.7 43.2 19.2 30.7 391 396 A L B >< S-A 156 0A 16 -4,-1.7 3,-1.6 -5,-0.3 4,-0.5 -0.908 79.0-126.5-109.3 119.3 40.2 18.2 32.7 392 397 A N T 3 S+ 0 0 41 -237,-2.2 -3,-0.1 -2,-0.6 -2,-0.0 -0.380 90.2 5.5 -64.6 129.2 37.7 15.8 31.2 393 398 A K T 3> S+ 0 0 117 -5,-0.2 4,-1.7 -2,-0.1 -1,-0.3 0.510 91.5 116.0 76.9 6.5 34.1 17.0 31.1 394 399 A S H <> S+ 0 0 2 -3,-1.6 4,-2.8 -7,-0.2 5,-0.2 0.914 75.1 55.8 -66.1 -43.1 35.0 20.4 32.4 395 400 A L H > S+ 0 0 19 -4,-0.5 4,-2.5 -7,-0.3 -1,-0.2 0.888 105.9 51.8 -53.4 -42.9 33.7 21.9 29.1 396 401 A D H > S+ 0 0 83 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.916 109.5 48.5 -62.5 -45.7 30.4 20.1 29.7 397 402 A E H X S+ 0 0 16 -4,-1.7 4,-2.7 2,-0.2 5,-0.3 0.957 113.0 46.9 -60.3 -52.6 30.0 21.6 33.2 398 403 A M H X>S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 5,-1.0 0.909 112.2 51.1 -54.6 -45.0 30.8 25.1 32.0 399 404 A D H <5S+ 0 0 41 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.820 112.8 47.0 -64.5 -32.0 28.4 24.7 29.1 400 405 A F H X>S+ 0 0 72 -4,-1.9 5,-2.6 -3,-0.3 4,-0.7 0.959 117.5 37.7 -74.4 -53.3 25.7 23.5 31.5 401 406 A W H <>S+ 0 0 89 -4,-2.7 5,-1.9 3,-0.2 -2,-0.2 0.861 135.4 18.6 -70.2 -37.1 26.0 26.2 34.2 402 407 A A T <>S+ 0 0 0 -4,-2.4 5,-0.6 -5,-0.3 -3,-0.2 0.865 129.1 42.2-100.4 -49.8 26.7 29.2 31.9 403 408 A G T 4>S+ 0 0 52 -4,-2.5 5,-2.0 1,-0.2 4,-1.6 0.923 114.8 46.1 -63.0 -45.6 11.7 41.2 34.4 417 422 A I H <>S+ 0 0 4 -4,-2.7 5,-2.2 3,-0.2 -1,-0.2 0.868 120.2 38.9 -65.1 -38.2 14.0 44.1 35.0 418 423 A F H <5S+ 0 0 0 -4,-2.4 -2,-0.2 -5,-0.2 9,-0.2 0.867 127.5 28.1 -84.3 -38.1 13.3 45.8 31.7 419 424 A F H <5S+ 0 0 1 -4,-2.6 5,-0.2 -5,-0.2 -3,-0.2 0.589 132.0 28.2-104.2 -14.0 9.6 45.2 31.2 420 425 A W T <5S+ 0 0 131 -4,-1.6 4,-0.3 -5,-0.4 -3,-0.2 0.788 128.8 27.8-110.2 -61.5 8.3 45.0 34.8 421 426 A I T - 0 0 18 -6,-0.1 4,-2.5 3,-0.1 -3,-0.2 0.166 18.1-126.5 118.2 124.7 8.2 49.9 33.3 424 429 A A H > S+ 0 0 9 -4,-0.3 4,-2.5 2,-0.2 5,-0.1 0.926 112.2 43.6 -62.3 -48.3 6.4 48.1 30.5 425 430 A D H > S+ 0 0 115 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.909 114.7 49.6 -65.1 -43.8 5.3 51.2 28.7 426 431 A K H > S+ 0 0 120 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.884 112.3 48.7 -62.0 -40.1 8.8 52.8 29.1 427 432 A A H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.921 111.3 49.2 -66.1 -45.2 10.4 49.6 27.8 428 433 A W H X S+ 0 0 51 -4,-2.5 4,-2.7 2,-0.2 5,-0.3 0.951 112.6 48.0 -57.2 -52.0 8.0 49.5 24.8 429 434 A E H X S+ 0 0 129 -4,-2.8 4,-1.7 1,-0.2 -2,-0.2 0.910 111.4 50.5 -53.5 -47.3 8.7 53.2 24.1 430 435 A E H < S+ 0 0 24 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.855 112.3 47.8 -63.2 -35.7 12.5 52.6 24.4 431 436 A I H < S+ 0 0 0 -4,-2.2 -161,-0.3 1,-0.2 -2,-0.2 0.936 116.0 41.1 -70.9 -47.8 12.3 49.7 22.0 432 437 A N H >< S+ 0 0 17 -4,-2.7 3,-2.3 -5,-0.2 -2,-0.2 0.678 85.1 118.0 -77.2 -17.8 10.2 51.4 19.3 433 438 A R T 3< S- 0 0 73 -4,-1.7 -163,-0.1 1,-0.3 -162,-0.1 -0.299 90.3 -0.4 -58.5 120.8 12.0 54.7 19.4 434 439 A G T 3 S+ 0 0 48 1,-0.2 2,-0.3 -2,-0.1 -1,-0.3 0.585 93.8 158.0 79.0 11.3 13.7 55.5 16.1 435 440 A G < - 0 0 25 -3,-2.3 -1,-0.2 -166,-0.2 -3,-0.1 -0.517 45.3-148.1 -75.6 129.5 12.4 52.2 14.6 436 441 A I S S+ 0 0 107 -2,-0.3 2,-0.3 1,-0.1 -1,-0.2 0.851 94.9 20.1 -59.1 -34.6 12.2 52.0 10.8 437 442 A I S S- 0 0 66 -3,-0.0 2,-0.3 -5,-0.0 -165,-0.2 -0.924 88.1-117.6-129.9 159.6 9.3 49.7 11.6 438 443 A K - 0 0 173 -2,-0.3 3,-0.1 -167,-0.1 -6,-0.0 -0.755 28.2-110.8 -98.3 143.7 7.2 49.3 14.7 439 444 A V - 0 0 7 -2,-0.3 5,-0.1 -11,-0.1 -7,-0.1 -0.577 48.8 -97.1 -68.6 127.4 6.9 46.1 16.8 440 445 A P > - 0 0 67 0, 0.0 3,-1.4 0, 0.0 4,-0.4 -0.117 30.5-119.3 -46.7 140.8 3.4 44.6 16.3 441 446 A R T >> S+ 0 0 187 1,-0.3 3,-2.1 2,-0.2 4,-0.7 0.858 110.2 62.3 -52.6 -42.6 1.0 45.6 19.2 442 447 A I H >> S+ 0 0 110 1,-0.3 4,-1.8 2,-0.2 3,-0.6 0.808 90.3 68.8 -56.8 -30.6 0.5 42.0 20.2 443 448 A Y H <> S+ 0 0 35 -3,-1.4 4,-2.3 1,-0.3 -1,-0.3 0.663 88.6 65.2 -67.9 -16.1 4.2 41.7 21.1 444 449 A Y H <> S+ 0 0 27 -3,-2.1 4,-2.4 -4,-0.4 -1,-0.3 0.945 107.7 39.5 -63.3 -50.2 3.6 44.1 24.0 445 450 A Y H S+ 0 0 95 -4,-0.7 4,-1.7 -3,-0.6 5,-1.5 0.788 114.5 55.5 -71.9 -28.0 1.4 41.5 25.6 446 451 A V H <>S+ 0 0 13 -4,-1.8 5,-3.4 3,-0.2 -1,-0.2 0.924 112.8 41.0 -67.6 -45.2 3.8 38.8 24.5 447 452 A M H <5S+ 0 0 0 -4,-2.3 -2,-0.2 3,-0.2 -1,-0.2 0.885 119.7 43.3 -70.1 -39.9 6.7 40.5 26.2 448 453 A R H <5S+ 0 0 83 -4,-2.4 -2,-0.2 -5,-0.1 -1,-0.2 0.813 135.8 2.6 -79.3 -32.1 4.9 41.5 29.4 449 454 A Y T X5S+ 0 0 118 -4,-1.7 4,-1.7 -5,-0.2 5,-0.2 0.750 125.6 47.7-121.7 -55.9 2.9 38.3 30.1 450 455 A I H > S+ 0 0 5 0, 0.0 4,-2.8 0, 0.0 -1,-0.2 0.910 115.8 44.7 -61.1 -43.8 8.0 35.6 31.3 453 458 A A H X S+ 0 0 53 -4,-1.7 4,-2.8 2,-0.2 5,-0.3 0.922 112.1 53.0 -65.2 -45.9 5.5 33.0 32.2 454 459 A F H X S+ 0 0 53 -4,-2.7 4,-2.3 -5,-0.2 -1,-0.2 0.957 114.8 41.1 -52.0 -56.1 6.7 30.6 29.5 455 460 A L H X S+ 0 0 0 -4,-2.8 4,-2.6 2,-0.2 5,-0.3 0.976 113.1 52.2 -56.9 -61.4 10.2 30.9 30.7 456 461 A A H X S+ 0 0 37 -4,-2.8 4,-2.7 1,-0.3 5,-0.2 0.903 112.8 45.7 -40.5 -56.7 9.4 30.7 34.4 457 462 A V H X S+ 0 0 89 -4,-2.8 4,-2.7 2,-0.2 -1,-0.3 0.897 112.5 53.2 -55.7 -42.7 7.4 27.5 33.8 458 463 A L H X S+ 0 0 19 -4,-2.3 4,-2.8 -5,-0.3 5,-0.3 0.982 111.3 42.9 -56.7 -62.6 10.2 26.2 31.6 459 464 A L H X S+ 0 0 34 -4,-2.6 4,-2.3 1,-0.2 5,-0.2 0.861 115.3 50.7 -52.5 -41.4 12.9 26.7 34.3 460 465 A V H X S+ 0 0 73 -4,-2.7 4,-2.2 -5,-0.3 -1,-0.2 0.950 112.9 44.2 -66.0 -49.3 10.7 25.3 37.1 461 466 A V H X S+ 0 0 48 -4,-2.7 4,-2.4 -5,-0.2 -2,-0.2 0.922 116.4 47.3 -57.9 -46.9 9.7 22.2 35.2 462 467 A W H X S+ 0 0 37 -4,-2.8 4,-0.8 -5,-0.3 -1,-0.2 0.869 113.4 47.4 -65.4 -39.0 13.3 21.5 34.0 463 468 A A H < S+ 0 0 77 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.861 114.7 47.0 -72.1 -34.9 14.7 22.1 37.5 464 469 A R H < S+ 0 0 186 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.862 121.4 34.9 -74.5 -38.8 12.1 19.8 39.1 465 470 A E H < 0 0 120 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.437 360.0 360.0 -96.2 -1.7 12.5 17.0 36.6 466 471 A Y < 0 0 150 -4,-0.8 -1,-0.2 -5,-0.2 -2,-0.2 -0.154 360.0 360.0-145.5 360.0 16.2 17.5 36.1 467 ! 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 0.0 468 478 A E 0 0 244 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 21.8 24.8 11.6 39.5 469 479 A T - 0 0 88 1,-0.1 2,-0.2 2,-0.0 0, 0.0 -0.605 360.0 -90.6-110.5 169.7 28.1 13.2 38.3 470 480 A H > - 0 0 95 -2,-0.2 3,-1.9 1,-0.1 4,-0.3 -0.507 37.4-116.9 -76.9 149.8 31.8 12.5 38.9 471 481 A W T > S+ 0 0 169 1,-0.3 3,-2.1 -2,-0.2 4,-0.3 0.806 106.9 76.3 -59.2 -30.9 33.4 14.4 41.8 472 482 A T T >> S+ 0 0 7 1,-0.3 3,-1.4 2,-0.2 4,-0.9 0.684 76.7 77.0 -56.5 -19.5 35.8 16.3 39.4 473 483 A V H X> S+ 0 0 13 -3,-1.9 4,-2.2 1,-0.3 3,-0.8 0.898 84.4 63.3 -56.4 -39.6 32.8 18.4 38.4 474 484 A W H <> S+ 0 0 161 -3,-2.1 4,-1.8 -4,-0.3 -1,-0.3 0.720 93.0 64.5 -59.9 -21.1 33.3 20.3 41.7 475 485 A I H <> S+ 0 0 61 -3,-1.4 4,-1.8 -4,-0.3 -1,-0.3 0.934 108.4 38.3 -65.3 -46.4 36.7 21.3 40.3 476 486 A T H < S+ 0 0 61 -4,-2.8 3,-1.9 -5,-0.3 -2,-0.2 0.922 107.5 53.4 -68.3 -44.8 32.5 62.0 41.6 503 513 A A H 3< S+ 0 0 94 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.798 108.9 51.6 -60.2 -28.5 34.1 63.5 44.7 504 514 A G T 3< 0 0 68 -4,-1.0 -1,-0.3 -5,-0.2 -2,-0.2 0.423 360.0 360.0 -88.5 0.2 36.8 65.0 42.5 505 515 A T < 0 0 147 -3,-1.9 -2,-0.2 -4,-0.1 -3,-0.2 0.638 360.0 360.0-124.0 360.0 34.2 66.5 40.2 506 ! 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 0.0 507 604 A L 0 0 0 0, 0.0 -485,-2.9 0, 0.0 -486,-0.3 0.000 360.0 360.0 360.0 360.0 26.4 31.6 19.0