==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 08-OCT-01 1GNT . COMPND 2 MOLECULE: HYBRID CLUSTER PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: DESULFOVIBRIO VULGARIS; . AUTHOR S.MACEDO,E.P.MITCHELL,C.V.ROMAO,S.J.COOPER,R.COELHO,M.Y.LIU, . 553 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21129.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 390 70.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 45 8.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 2.2 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 . 1 0.2 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 . 28 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 72 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 209 37.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.3 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 1 1 1 1 2 2 2 1 1 1 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 2 RESIDUES PER ALPHA HELIX . 3 0 7 2 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 . 2 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 ANTIPARALLEL BRIDGES PER LADDER . 2 0 2 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 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 1 A M 0 0 31 0, 0.0 2,-0.3 0, 0.0 24,-0.1 0.000 360.0 360.0 360.0 169.6 37.0 13.1 6.7 2 2 A F + 0 0 30 23,-0.1 134,-0.4 15,-0.1 2,-0.3 -0.829 360.0 149.5-146.7 122.3 36.1 16.7 7.4 3 3 A C B +A 15 0A 19 12,-1.5 12,-3.0 -2,-0.3 25,-0.0 -0.988 7.5 157.8-147.9 134.4 38.5 19.4 8.7 4 4 A F + 0 0 12 -2,-0.3 516,-0.4 10,-0.2 517,-0.4 0.119 38.6 115.9-141.8 22.7 38.3 23.2 8.0 5 5 A Q + 0 0 10 515,-0.1 2,-0.3 514,-0.1 66,-0.1 0.557 65.1 59.3 -82.3 -10.3 40.3 24.7 10.9 6 6 A C S > S- 0 0 13 488,-0.1 3,-1.5 1,-0.1 514,-0.3 -0.775 85.7-111.3-118.5 167.3 43.2 26.3 8.9 7 7 A Q T 3 S+ 0 0 2 486,-2.3 487,-0.1 1,-0.3 486,-0.1 0.771 111.8 60.6 -63.9 -28.5 43.5 28.9 6.2 8 8 A E T 3 S+ 0 0 10 485,-0.2 -1,-0.3 3,-0.1 3,-0.2 0.286 72.1 142.8 -86.2 8.6 44.6 26.4 3.6 9 9 A T X - 0 0 5 -3,-1.5 3,-2.2 1,-0.1 -5,-0.1 -0.187 65.9 -81.6 -54.2 144.2 41.5 24.2 3.8 10 10 A A G >> S- 0 0 25 1,-0.3 3,-2.8 2,-0.2 4,-2.4 -0.204 106.6 -13.6 -55.7 126.4 40.4 22.8 0.4 11 11 A K G 34 S- 0 0 194 1,-0.3 -1,-0.3 2,-0.2 -2,-0.1 0.594 113.5 -81.8 59.3 15.2 38.4 25.2 -1.8 12 12 A N G <4 S+ 0 0 56 -3,-2.2 -1,-0.3 -4,-0.1 -2,-0.2 0.793 126.7 82.9 52.8 31.9 38.1 27.3 1.4 13 13 A T T <4 S- 0 0 94 -3,-2.8 -2,-0.2 1,-0.1 2,-0.2 0.551 101.0 -63.3-126.0 -32.9 35.2 25.0 2.4 14 14 A G < - 0 0 4 -4,-2.4 2,-0.4 -6,-0.1 -10,-0.2 -0.505 39.4 -97.7 150.0 141.2 36.9 22.0 4.0 15 15 A C B +A 3 0A 11 -12,-3.0 -12,-1.5 -2,-0.2 4,-0.1 -0.713 39.0 167.2 -80.6 129.9 39.2 19.0 3.4 16 16 A T S S+ 0 0 81 -2,-0.4 -1,-0.1 2,-0.3 3,-0.1 0.569 70.5 22.9-123.3 -13.3 37.3 15.8 2.8 17 17 A V S S- 0 0 114 1,-0.4 8,-0.5 7,-0.0 2,-0.3 0.721 132.1 -11.6-121.1 -55.2 39.7 13.2 1.5 18 18 A K B S-B 24 0B 134 6,-0.2 -1,-0.4 7,-0.1 -2,-0.3 -0.970 80.7-103.0-147.5 141.3 43.2 14.1 2.6 19 19 A G > - 0 0 8 4,-3.1 3,-1.7 -2,-0.3 -10,-0.1 -0.280 18.5-125.8 -66.8 152.4 44.2 17.5 4.1 20 20 A M T 3 S+ 0 0 113 1,-0.3 -1,-0.1 2,-0.1 -11,-0.1 0.756 117.0 57.1 -64.1 -22.6 46.0 20.1 2.1 21 21 A C T 3 S- 0 0 19 2,-0.1 -1,-0.3 293,-0.0 -2,-0.1 0.590 129.3-100.5 -78.2 -14.6 48.5 19.9 5.0 22 22 A G < + 0 0 20 -3,-1.7 -2,-0.1 1,-0.3 292,-0.0 0.294 69.9 152.9 108.6 -3.5 49.0 16.2 4.3 23 23 A K - 0 0 15 -5,-0.1 -4,-3.1 1,-0.1 -1,-0.3 -0.411 37.2-138.5 -68.8 118.2 46.7 14.9 7.1 24 24 A P B > -B 18 0B 46 0, 0.0 4,-2.8 0, 0.0 3,-0.3 -0.307 21.3-107.0 -73.4 159.1 45.3 11.5 6.2 25 25 A E H > S+ 0 0 57 -8,-0.5 4,-2.6 1,-0.2 5,-0.2 0.879 118.2 52.8 -49.3 -45.8 41.7 10.5 6.8 26 26 A E H > S+ 0 0 116 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.900 112.2 44.3 -64.5 -40.9 42.7 8.1 9.6 27 27 A T H > S+ 0 0 4 -3,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.921 113.0 51.3 -66.9 -46.1 44.6 10.8 11.5 28 28 A A H X S+ 0 0 2 -4,-2.8 4,-1.9 1,-0.2 -2,-0.2 0.918 111.4 47.8 -56.9 -44.8 41.9 13.4 10.9 29 29 A N H X S+ 0 0 10 -4,-2.6 4,-2.1 -5,-0.2 -1,-0.2 0.897 108.6 53.2 -68.3 -37.8 39.3 11.1 12.3 30 30 A L H X S+ 0 0 9 -4,-1.9 4,-2.5 -5,-0.2 -1,-0.2 0.888 106.2 54.0 -65.2 -36.3 41.3 10.1 15.3 31 31 A Q H X S+ 0 0 9 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.928 108.0 50.7 -61.4 -43.0 41.7 13.8 16.2 32 32 A D H X S+ 0 0 24 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.890 109.5 50.4 -58.8 -42.0 37.9 14.1 16.0 33 33 A L H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.897 108.2 52.4 -67.7 -39.6 37.5 11.2 18.4 34 34 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.930 109.1 49.0 -58.2 -49.1 40.0 12.7 20.8 35 35 A I H X S+ 0 0 11 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.913 108.4 55.4 -60.4 -36.5 38.0 15.9 20.9 36 36 A F H X S+ 0 0 14 -4,-2.1 4,-1.5 1,-0.2 -1,-0.2 0.932 109.2 46.5 -57.2 -47.9 34.8 13.9 21.4 37 37 A V H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.889 108.7 55.0 -64.0 -40.0 36.4 12.2 24.5 38 38 A L H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.887 104.2 54.7 -60.1 -37.3 37.6 15.6 25.8 39 39 A R H X S+ 0 0 31 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.880 107.1 51.8 -61.8 -38.3 34.0 16.8 25.6 40 40 A G H X S+ 0 0 0 -4,-1.5 4,-1.6 77,-0.3 5,-0.2 0.918 108.8 48.7 -64.1 -44.8 33.0 13.8 27.8 41 41 A I H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 5,-0.2 0.920 111.7 51.7 -56.4 -45.1 35.7 14.8 30.4 42 42 A A H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 5,-0.3 0.866 101.9 58.7 -63.0 -40.6 34.4 18.3 30.3 43 43 A I H X S+ 0 0 9 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.960 115.8 34.6 -54.0 -52.9 30.7 17.3 30.9 44 44 A Y H X S+ 0 0 0 -4,-1.6 4,-2.5 2,-0.2 -2,-0.2 0.883 116.3 54.6 -71.1 -39.5 31.6 15.7 34.2 45 45 A G H X S+ 0 0 1 -4,-2.7 4,-1.5 -5,-0.2 10,-0.3 0.867 109.5 48.3 -64.1 -34.7 34.3 18.1 35.1 46 46 A E H X S+ 0 0 28 -4,-2.6 4,-2.3 -5,-0.2 -1,-0.2 0.925 111.3 49.9 -69.6 -44.3 32.0 21.0 34.7 47 47 A K H X S+ 0 0 46 -4,-1.8 4,-1.8 -5,-0.3 -2,-0.2 0.889 108.0 53.1 -63.3 -37.3 29.3 19.3 36.8 48 48 A L H <>S+ 0 0 4 -4,-2.5 5,-2.6 2,-0.2 -1,-0.2 0.908 109.3 49.1 -65.1 -40.2 31.7 18.5 39.6 49 49 A K H ><5S+ 0 0 97 -4,-1.5 3,-1.8 1,-0.2 -2,-0.2 0.942 109.8 51.9 -61.0 -46.4 32.7 22.2 39.8 50 50 A E H 3<5S+ 0 0 123 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.807 106.6 54.4 -58.9 -32.4 29.0 23.2 39.9 51 51 A L T 3<5S- 0 0 49 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.415 122.1-106.9 -82.4 -0.5 28.4 20.7 42.8 52 52 A G T < 5S+ 0 0 59 -3,-1.8 -3,-0.2 -4,-0.2 -2,-0.1 0.617 97.7 96.8 85.1 14.4 31.2 22.4 44.8 53 53 A Q < - 0 0 97 -5,-2.6 -4,-0.2 -6,-0.2 -3,-0.1 -0.466 56.4-174.2-131.0 62.5 33.8 19.6 44.3 54 54 A P - 0 0 72 0, 0.0 2,-0.5 0, 0.0 -8,-0.1 -0.225 11.6-154.6 -62.7 145.8 36.0 20.6 41.4 55 55 A D + 0 0 37 -10,-0.3 3,-0.3 1,-0.1 -6,-0.1 -0.990 16.9 174.7-124.3 115.7 38.6 18.1 40.1 56 56 A R > + 0 0 62 -2,-0.5 3,-1.6 1,-0.1 4,-0.3 0.158 48.2 110.7-104.1 14.4 41.6 19.7 38.3 57 57 A S T 3 S+ 0 0 74 1,-0.3 4,-0.2 2,-0.1 3,-0.2 0.637 77.8 50.7 -69.0 -15.5 43.5 16.4 37.9 58 58 A N T 3> S+ 0 0 11 -3,-0.3 4,-2.4 1,-0.1 -1,-0.3 0.305 75.0 109.4-103.3 9.0 43.0 16.5 34.1 59 59 A D H <> S+ 0 0 21 -3,-1.6 4,-2.1 1,-0.2 5,-0.2 0.913 84.3 39.1 -52.9 -54.5 44.2 20.1 33.5 60 60 A D H > S+ 0 0 74 -4,-0.3 4,-2.6 1,-0.2 5,-0.2 0.906 113.6 55.6 -66.0 -40.2 47.4 19.2 31.6 61 61 A F H > S+ 0 0 16 -4,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.899 108.9 48.0 -57.0 -42.7 45.8 16.3 29.8 62 62 A V H X S+ 0 0 4 -4,-2.4 4,-2.2 2,-0.2 5,-0.2 0.933 111.9 47.8 -67.8 -44.6 43.2 18.6 28.3 63 63 A L H X S+ 0 0 0 -4,-2.1 4,-2.5 -5,-0.2 -2,-0.2 0.941 115.3 45.4 -61.1 -44.6 45.6 21.3 27.2 64 64 A Q H X S+ 0 0 58 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.863 110.8 52.9 -71.6 -32.9 47.9 18.8 25.6 65 65 A G H X S+ 0 0 0 -4,-2.1 4,-0.6 -5,-0.2 -1,-0.2 0.913 111.9 44.9 -66.5 -44.6 45.1 16.9 23.9 66 66 A L H >< S+ 0 0 0 -4,-2.2 3,-1.4 1,-0.2 -2,-0.2 0.947 113.3 51.0 -60.9 -48.6 43.7 20.1 22.3 67 67 A F H >< S+ 0 0 3 -4,-2.5 3,-2.0 1,-0.3 -2,-0.2 0.876 101.3 62.1 -59.5 -40.9 47.2 21.2 21.3 68 68 A A H 3< S+ 0 0 2 -4,-2.3 6,-0.5 1,-0.3 -1,-0.3 0.721 101.1 54.9 -59.5 -21.8 47.9 17.8 19.6 69 69 A T T << S+ 0 0 0 -3,-1.4 -1,-0.3 -4,-0.6 -2,-0.2 0.382 81.5 113.2 -93.8 3.1 45.0 18.5 17.2 70 70 A I S X> S- 0 0 2 -3,-2.0 3,-1.9 -4,-0.2 4,-0.5 -0.407 86.0 -78.6 -70.7 151.3 46.4 21.9 16.0 71 71 A T T 34 S+ 0 0 9 1,-0.3 -1,-0.1 2,-0.1 423,-0.1 -0.227 114.3 2.2 -53.6 131.4 47.4 22.1 12.3 72 72 A N T 34 S+ 0 0 5 240,-0.1 241,-2.6 2,-0.1 240,-0.4 0.658 103.1 108.7 65.5 20.7 50.9 20.5 11.8 73 73 A A T <4 S+ 0 0 1 -3,-1.9 260,-1.0 1,-0.3 2,-0.4 0.908 79.5 10.3 -92.1 -51.8 51.3 19.4 15.4 74 74 A N B < +c 333 0C 3 -6,-0.5 -1,-0.3 -4,-0.5 260,-0.2 -0.984 45.8 167.5-145.1 125.5 51.0 15.6 15.6 75 75 A W + 0 0 28 258,-2.5 2,-0.9 -2,-0.4 260,-0.2 0.236 48.1 109.4-113.7 -0.2 50.9 13.1 12.8 76 76 A D >> - 0 0 39 1,-0.2 4,-1.6 257,-0.1 3,-1.1 -0.762 48.8-164.5 -94.2 103.5 51.4 9.9 14.9 77 77 A D H 3> S+ 0 0 52 -2,-0.9 4,-2.4 1,-0.3 5,-0.2 0.825 89.0 59.9 -55.6 -33.8 48.2 7.8 15.0 78 78 A A H 3> S+ 0 0 58 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.829 101.5 54.2 -62.8 -34.8 49.6 5.8 17.9 79 79 A R H <> S+ 0 0 56 -3,-1.1 4,-2.2 2,-0.2 -1,-0.2 0.912 110.1 47.1 -65.0 -43.5 49.9 8.9 20.0 80 80 A F H X S+ 0 0 0 -4,-1.6 4,-2.6 2,-0.2 -2,-0.2 0.916 110.3 51.2 -64.8 -42.6 46.2 9.7 19.3 81 81 A E H X S+ 0 0 76 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.918 111.3 49.5 -60.4 -42.5 45.1 6.2 20.1 82 82 A A H X S+ 0 0 58 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.892 111.9 47.5 -62.3 -43.8 47.0 6.4 23.4 83 83 A M H X S+ 0 0 30 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.874 110.6 51.7 -67.4 -38.4 45.4 9.7 24.3 84 84 A I H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.934 111.8 46.8 -62.5 -46.8 41.9 8.5 23.4 85 85 A S H X S+ 0 0 55 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.927 115.2 45.7 -60.7 -46.3 42.4 5.4 25.7 86 86 A E H X S+ 0 0 89 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.907 111.0 53.7 -63.3 -40.0 43.8 7.5 28.5 87 87 A G H X S+ 0 0 0 -4,-2.7 4,-2.8 1,-0.2 -1,-0.2 0.878 105.5 53.3 -62.0 -40.0 41.0 10.1 28.1 88 88 A L H X S+ 0 0 9 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.914 110.7 47.4 -61.8 -41.2 38.3 7.4 28.4 89 89 A A H X S+ 0 0 64 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.920 112.9 48.0 -66.9 -43.0 39.9 6.3 31.7 90 90 A R H X S+ 0 0 73 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.922 111.5 51.1 -62.0 -43.1 40.1 9.8 33.0 91 91 A R H X S+ 0 0 3 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.906 108.0 51.3 -59.7 -45.6 36.5 10.5 31.9 92 92 A D H X S+ 0 0 59 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.869 106.5 54.7 -65.9 -34.5 35.2 7.4 33.7 93 93 A K H X S+ 0 0 130 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.932 110.5 46.1 -60.6 -45.9 37.0 8.4 36.9 94 94 A L H X S+ 0 0 2 -4,-1.9 4,-2.7 2,-0.2 -2,-0.2 0.912 110.9 53.4 -62.8 -44.7 35.2 11.8 36.8 95 95 A R H X S+ 0 0 79 -4,-2.6 4,-2.8 2,-0.2 5,-0.2 0.927 108.6 48.5 -55.9 -46.5 31.9 10.1 36.0 96 96 A N H X S+ 0 0 106 -4,-2.6 4,-1.6 1,-0.2 -1,-0.2 0.922 113.2 47.7 -64.9 -38.0 32.2 7.8 39.0 97 97 A A H X S+ 0 0 34 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.937 113.0 49.3 -65.2 -44.4 33.0 10.7 41.3 98 98 A F H X S+ 0 0 3 -4,-2.7 4,-3.0 1,-0.2 5,-0.3 0.901 106.1 54.9 -60.0 -47.2 30.1 12.7 39.8 99 99 A L H X S+ 0 0 45 -4,-2.8 4,-2.0 1,-0.2 11,-0.2 0.901 110.9 46.4 -57.4 -40.2 27.6 9.9 40.3 100 100 A A H X S+ 0 0 61 -4,-1.6 4,-2.0 -5,-0.2 -1,-0.2 0.890 114.2 45.7 -69.8 -42.9 28.4 9.7 44.0 101 101 A V H X S+ 0 0 15 -4,-2.1 4,-2.3 2,-0.2 5,-0.2 0.921 112.6 50.9 -66.8 -43.5 28.3 13.4 44.7 102 102 A Y H X S+ 0 0 24 -4,-3.0 4,-2.0 1,-0.2 6,-0.3 0.931 110.4 50.0 -59.8 -43.8 25.1 13.8 42.7 103 103 A K H X S+ 0 0 113 -4,-2.0 4,-2.1 -5,-0.3 5,-0.4 0.905 111.2 48.7 -63.7 -42.0 23.5 11.0 44.7 104 104 A A H < S+ 0 0 83 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.879 116.1 42.8 -64.3 -38.2 24.6 12.5 48.0 105 105 A K H < S+ 0 0 123 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.735 125.9 30.9 -81.5 -24.0 23.3 16.0 47.1 106 106 A N H < S- 0 0 78 -4,-2.0 -2,-0.2 2,-0.3 -3,-0.2 0.538 94.3-126.9-114.0 -13.5 20.0 14.9 45.5 107 107 A G S < S+ 0 0 69 -4,-2.1 2,-0.3 -5,-0.2 -3,-0.1 0.728 82.6 71.0 70.2 24.6 19.0 11.7 47.4 108 108 A K S S- 0 0 121 -5,-0.4 -2,-0.3 -6,-0.3 -1,-0.2 -0.979 90.4 -85.2-161.9 160.1 18.6 9.8 44.2 109 109 A D - 0 0 107 -2,-0.3 2,-0.2 1,-0.1 -9,-0.1 -0.408 51.7-101.8 -66.7 144.7 20.6 8.2 41.3 110 110 A F + 0 0 28 -11,-0.2 -1,-0.1 1,-0.1 -7,-0.0 -0.512 50.3 163.4 -62.4 130.0 21.5 10.5 38.5 111 111 A S + 0 0 98 -2,-0.2 -1,-0.1 2,-0.1 3,-0.1 0.357 23.3 122.2-136.5 7.2 19.1 9.8 35.6 112 112 A E - 0 0 108 1,-0.1 2,-0.0 0, 0.0 -2,-0.0 -0.488 69.1-104.2 -74.1 139.9 19.2 12.6 33.1 113 113 A P - 0 0 130 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.376 40.0-159.2 -61.7 140.2 20.1 11.7 29.5 114 114 A L - 0 0 40 -3,-0.1 5,-0.1 1,-0.0 0, 0.0 -0.900 23.9 -94.7-120.1 153.7 23.7 12.6 28.5 115 115 A P > - 0 0 45 0, 0.0 3,-2.0 0, 0.0 4,-0.4 -0.266 41.2-108.7 -59.3 153.8 25.4 13.2 25.2 116 116 A E G >> S+ 0 0 91 1,-0.3 4,-2.7 2,-0.2 3,-1.4 0.787 114.5 71.8 -58.4 -28.9 27.2 10.2 23.8 117 117 A A G 34 S+ 0 0 4 1,-0.3 -1,-0.3 2,-0.2 -77,-0.3 0.820 97.2 52.1 -56.5 -29.4 30.6 11.9 24.5 118 118 A A G <4 S+ 0 0 0 -3,-2.0 -1,-0.3 1,-0.1 -2,-0.2 0.654 124.1 21.1 -80.1 -16.8 29.9 11.2 28.2 119 119 A T T <4 S+ 0 0 73 -3,-1.4 -2,-0.2 -4,-0.4 -3,-0.1 0.655 86.0 108.2-129.0 -26.5 29.2 7.5 27.9 120 120 A W < + 0 0 41 -4,-2.7 2,-0.3 1,-0.0 -80,-0.0 -0.293 40.8 170.2 -63.0 142.1 30.6 5.8 24.7 121 121 A T + 0 0 85 5,-0.0 2,-0.3 2,-0.0 -2,-0.0 -0.980 8.5 147.0-147.5 160.6 33.5 3.5 25.2 122 122 A G - 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0 0 3 -2,-1.2 4,-2.4 78,-0.1 5,-0.3 -0.172 66.0 -80.4 -78.7-178.5 58.6 43.4 22.7 378 378 A H H > S+ 0 0 38 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.874 127.1 49.6 -63.7 -39.3 56.6 45.6 25.1 379 379 A H H > S+ 0 0 101 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.936 114.4 45.9 -62.8 -43.1 59.3 46.3 27.6 380 380 A Q H > S+ 0 0 31 -156,-0.3 4,-0.7 2,-0.2 -2,-0.2 0.894 115.2 45.7 -66.1 -41.0 61.8 47.3 25.0 381 381 A V H >< S+ 0 0 13 -4,-2.4 3,-1.1 1,-0.2 7,-0.2 0.936 112.6 50.0 -71.9 -42.3 59.4 49.5 23.0 382 382 A L H >< S+ 0 0 62 -4,-2.9 3,-1.5 -5,-0.3 4,-0.3 0.834 103.9 60.4 -65.4 -27.4 58.1 51.2 26.2 383 383 A A H 3< S+ 0 0 69 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.763 111.1 41.4 -67.3 -22.9 61.8 51.8 27.2 384 384 A L T S+ 0 0 19 -3,-1.5 4,-3.4 1,-0.2 5,-0.3 0.887 71.6 52.0 -55.1 -44.9 58.5 55.5 24.4 386 386 A D H > S+ 0 0 148 -4,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.931 112.7 46.3 -57.5 -46.2 59.8 59.0 24.4 387 387 A K H > S+ 0 0 88 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.907 116.3 44.4 -63.6 -44.0 61.7 58.5 21.2 388 388 A V H X S+ 0 0 11 -4,-2.6 4,-2.0 -7,-0.2 -2,-0.2 0.946 113.8 49.3 -65.9 -47.4 58.7 56.7 19.5 389 389 A V H X S+ 0 0 14 -4,-3.4 4,-2.6 -5,-0.2 -2,-0.2 0.914 110.3 51.3 -60.4 -41.7 56.2 59.3 20.7 390 390 A E H X S+ 0 0 89 -4,-2.5 4,-2.4 -5,-0.3 6,-0.2 0.883 108.6 52.0 -63.2 -37.2 58.5 62.2 19.5 391 391 A A H X>S+ 0 0 3 -4,-1.8 6,-1.9 2,-0.2 5,-1.0 0.862 110.1 48.4 -67.5 -36.4 58.7 60.6 16.0 392 392 A V H ><5S+ 0 0 26 -4,-2.0 3,-0.6 4,-0.2 -2,-0.2 0.947 113.1 47.9 -66.5 -45.8 55.0 60.3 15.8 393 393 A K H 3<5S+ 0 0 154 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.866 111.6 49.2 -64.1 -37.1 54.6 63.9 16.9 394 394 A S H 3<5S- 0 0 81 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.679 113.3-117.6 -74.8 -19.0 57.2 65.2 14.4 395 395 A G T <<5S+ 0 0 41 -4,-0.9 -3,-0.2 -3,-0.6 3,-0.2 0.413 82.6 121.8 94.1 -0.3 55.5 63.3 11.6 396 396 A A S - 0 0 69 1,-0.1 3,-2.2 2,-0.1 -2,-0.2 -0.278 65.2-133.0 -60.7 136.6 49.6 30.0 -0.9 411 411 A K G > S+ 0 0 191 1,-0.3 3,-2.1 2,-0.2 4,-0.2 0.742 99.6 77.0 -63.3 -24.7 51.0 32.4 -3.6 412 412 A S G > S+ 0 0 49 1,-0.3 3,-2.0 2,-0.2 -1,-0.3 0.724 76.6 78.3 -55.8 -21.2 48.3 35.0 -2.8 413 413 A R G X> + 0 0 0 -3,-2.2 3,-1.5 1,-0.3 4,-0.9 0.582 64.9 87.5 -69.9 -7.6 50.5 35.8 0.3 414 414 A S H <> S+ 0 0 47 -3,-2.1 4,-2.7 1,-0.3 -1,-0.3 0.772 73.3 77.9 -56.2 -24.5 52.8 37.7 -2.0 415 415 A Y H <> S+ 0 0 13 -3,-2.0 4,-2.7 1,-0.2 -1,-0.3 0.877 90.2 50.9 -48.3 -44.3 50.3 40.5 -1.1 416 416 A Y H <> S+ 0 0 4 -3,-1.5 4,-2.2 2,-0.2 -1,-0.2 0.900 110.3 47.3 -69.2 -39.4 52.0 40.9 2.3 417 417 A T H X S+ 0 0 31 -4,-0.9 4,-2.2 2,-0.2 -2,-0.2 0.912 114.0 48.9 -62.6 -44.4 55.4 41.2 0.8 418 418 A E H X S+ 0 0 80 -4,-2.7 4,-1.8 2,-0.2 -2,-0.2 0.881 109.1 51.0 -68.1 -38.4 54.1 43.8 -1.7 419 419 A V H X S+ 0 0 0 -4,-2.7 4,-1.7 -5,-0.2 3,-0.4 0.967 111.6 48.8 -60.1 -48.8 52.3 45.8 1.0 420 420 A A H < S+ 0 0 0 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.896 113.3 46.9 -57.8 -42.3 55.5 46.0 3.0 421 421 A E H < S+ 0 0 104 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.782 119.0 39.9 -70.4 -28.1 57.5 47.0 -0.1 422 422 A N H < S+ 0 0 103 -4,-1.8 -2,-0.2 -3,-0.4 -1,-0.2 0.478 82.3 113.2-106.5 -4.7 55.0 49.7 -1.2 423 423 A L S < S- 0 0 6 -4,-1.7 4,-0.1 -3,-0.2 123,-0.0 -0.381 83.6 -89.8 -60.6 145.7 53.9 51.2 2.1 424 424 A P > - 0 0 46 0, 0.0 3,-1.2 0, 0.0 -1,-0.1 -0.253 35.6-113.1 -57.2 153.6 55.1 54.9 2.3 425 425 A K T 3 S+ 0 0 176 1,-0.3 -2,-0.1 -3,-0.1 -3,-0.0 0.498 111.3 65.3 -71.9 -4.8 58.6 55.3 3.8 426 426 A D T 3 S+ 0 0 58 -29,-0.1 -28,-3.2 2,-0.0 -27,-0.9 -0.051 86.9 92.7-105.6 28.6 57.3 57.1 6.9 427 427 A T E < -j 399 0F 0 -3,-1.2 2,-0.4 -30,-0.2 -27,-0.2 -0.895 61.7-147.4-118.0 154.9 55.4 54.1 8.1 428 428 A V E -j 400 0F 0 -29,-2.0 -27,-2.4 -2,-0.3 2,-0.5 -0.983 9.8-140.1-122.0 131.0 56.5 51.4 10.6 429 429 A I E -jl 401 453F 0 23,-3.4 25,-3.0 -2,-0.4 2,-0.5 -0.793 11.5-157.6 -90.3 130.4 55.5 47.7 10.4 430 430 A L E +jl 402 454F 14 -29,-2.3 -27,-2.7 -2,-0.5 -26,-0.4 -0.931 23.5 174.2-105.6 129.1 54.7 46.0 13.7 431 431 A T E + l 0 455F 0 23,-2.7 25,-2.8 -2,-0.5 26,-0.3 -0.891 23.3 163.1-139.8 164.5 55.0 42.2 13.6 432 432 A A + 0 0 0 -2,-0.3 -27,-2.6 23,-0.2 3,-0.3 -0.849 54.5 35.0-171.6 145.5 55.0 39.0 15.6 433 433 A G S > S- 0 0 0 24,-2.2 3,-2.1 -2,-0.3 -1,-0.2 -0.032 104.7 -58.6 83.4 168.4 54.5 35.4 14.5 434 434 A C G > S+ 0 0 9 1,-0.3 3,-2.0 2,-0.2 -28,-0.3 0.606 116.2 86.8 -67.7 -10.3 55.8 33.7 11.3 435 435 A A G > S+ 0 0 4 -30,-2.4 3,-1.8 -3,-0.3 -1,-0.3 0.811 75.9 76.1 -51.3 -28.9 53.8 36.2 9.1 436 436 A K G X> S+ 0 0 0 -3,-2.1 3,-2.1 -31,-0.4 4,-1.3 0.739 74.7 75.1 -51.7 -30.3 57.1 38.2 9.6 437 437 A Y G <4 S+ 0 0 27 -3,-2.0 -1,-0.3 1,-0.3 4,-0.2 0.667 82.1 68.1 -68.5 -13.0 58.9 36.0 7.1 438 438 A R G <4 S+ 0 0 37 -3,-1.8 -1,-0.3 -4,-0.2 -2,-0.2 0.644 123.8 8.5 -74.5 -13.5 57.1 37.7 4.2 439 439 A Y T X4 S+ 0 0 3 -3,-2.1 3,-0.7 -4,-0.2 -2,-0.2 0.340 97.7 96.7-152.3 12.8 59.0 41.0 4.8 440 440 A N T 3< S+ 0 0 21 -4,-1.3 -67,-0.2 1,-0.2 -3,-0.1 0.416 85.9 53.1 -92.7 4.0 61.7 40.6 7.5 441 441 A K T 3 S+ 0 0 77 -4,-0.2 -1,-0.2 -69,-0.1 2,-0.1 0.010 87.1 105.3-121.5 27.7 64.6 40.1 4.9 442 442 A L S < S- 0 0 61 -3,-0.7 2,-0.3 3,-0.0 3,-0.2 -0.288 76.6-118.0 -92.5-179.4 63.8 43.3 2.9 443 443 A N + 0 0 158 1,-0.1 -3,-0.1 -2,-0.1 -2,-0.0 -0.553 56.8 141.0-122.1 66.9 65.9 46.5 3.1 444 444 A L - 0 0 39 -2,-0.3 -1,-0.1 1,-0.2 -3,-0.0 0.603 41.4-160.4 -85.6 -11.7 63.4 49.0 4.4 445 445 A G - 0 0 45 -3,-0.2 7,-2.5 6,-0.1 8,-0.3 -0.268 21.0 -68.9 70.3-152.3 65.9 50.7 6.7 446 446 A D E -P 451 0H 97 5,-0.3 2,-0.5 6,-0.1 -18,-0.0 -0.886 21.7-127.5-139.9 166.4 64.9 52.9 9.7 447 447 A I E > S-P 450 0H 21 3,-3.0 3,-2.3 -2,-0.3 -56,-0.1 -0.966 92.6 -30.3-118.2 106.7 63.3 56.2 10.6 448 448 A G T 3 S- 0 0 62 -2,-0.5 -1,-0.1 1,-0.3 -57,-0.0 0.822 128.5 -43.4 54.1 36.1 65.6 58.2 12.9 449 449 A G T 3 S+ 0 0 50 1,-0.2 -1,-0.3 0, 0.0 -4,-0.0 0.242 115.9 113.9 95.2 -15.0 67.1 55.0 14.3 450 450 A I E < S-P 447 0H 11 -3,-2.3 -3,-3.0 -63,-0.1 -1,-0.2 -0.826 70.6-123.6 -90.3 114.5 63.7 53.2 14.7 451 451 A P E -P 446 0H 31 0, 0.0 -5,-0.3 0, 0.0 -6,-0.1 -0.223 9.8-129.1 -56.8 146.2 63.6 50.2 12.3 452 452 A R S S+ 0 0 11 -7,-2.5 -23,-3.4 1,-0.2 2,-0.4 0.580 100.8 51.2 -75.3 -10.4 60.8 50.2 9.8 453 453 A V E S-l 429 0F 27 -8,-0.3 2,-0.6 -25,-0.2 -23,-0.2 -0.986 71.9-169.6-125.0 117.6 60.0 46.6 10.8 454 454 A L E -l 430 0F 8 -25,-3.0 -23,-2.7 -2,-0.4 2,-0.8 -0.921 6.4-160.1-110.0 107.0 59.7 46.0 14.6 455 455 A D E -l 431 0F 5 -2,-0.6 -79,-2.0 -82,-0.3 -80,-2.0 -0.786 12.6-178.3 -91.5 109.6 59.5 42.3 15.5 456 456 A A - 0 0 1 -25,-2.8 2,-0.4 -2,-0.8 -24,-0.2 0.623 48.2-111.4 -80.2 -16.9 58.0 41.7 19.0 457 457 A G + 0 0 0 -26,-0.3 -24,-2.2 -24,-0.1 -1,-0.2 -0.976 65.5 12.9 135.6-134.7 58.5 38.0 18.7 458 458 A Q S > S- 0 0 3 -2,-0.4 3,-1.5 -26,-0.3 4,-0.2 -0.205 83.4 -91.6 -77.8 173.0 56.4 34.8 18.4 459 459 A C G > S+ 0 0 2 1,-0.3 3,-2.0 -27,-0.2 4,-0.2 0.884 129.7 59.0 -57.4 -36.4 52.7 34.9 17.5 460 460 A N G > S+ 0 0 4 1,-0.3 3,-1.9 2,-0.2 -1,-0.3 0.747 90.6 71.5 -59.3 -28.7 51.9 35.0 21.3 461 461 A D G X> + 0 0 3 -3,-1.5 4,-0.9 1,-0.3 3,-0.9 0.431 66.1 91.8 -73.2 3.1 54.0 38.2 21.4 462 462 A S H <> S+ 0 0 9 -3,-2.0 4,-1.9 1,-0.2 -1,-0.3 0.787 75.0 73.2 -56.7 -25.3 51.1 39.9 19.6 463 463 A Y H <> S+ 0 0 55 -3,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.913 90.8 53.1 -53.2 -45.8 50.4 40.5 23.3 464 464 A S H <> S+ 0 0 0 -3,-0.9 4,-2.6 1,-0.2 -1,-0.2 0.874 104.1 55.5 -58.7 -38.0 53.2 43.1 23.3 465 465 A L H X S+ 0 0 17 -4,-0.9 4,-2.3 1,-0.2 -1,-0.2 0.901 108.4 47.9 -65.2 -39.8 51.6 44.8 20.3 466 466 A A H X S+ 0 0 12 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.895 111.0 50.9 -65.0 -41.4 48.4 45.2 22.3 467 467 A V H X S+ 0 0 29 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.916 110.9 49.2 -60.6 -44.4 50.3 46.5 25.3 468 468 A I H X S+ 0 0 11 -4,-2.6 4,-2.8 2,-0.2 -2,-0.2 0.933 111.1 49.1 -61.0 -46.1 52.0 49.1 23.1 469 469 A A H X S+ 0 0 7 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.924 110.9 49.9 -61.2 -44.7 48.7 50.2 21.6 470 470 A L H X S+ 0 0 79 -4,-2.6 4,-1.6 2,-0.2 -1,-0.2 0.873 111.0 50.2 -62.2 -37.6 47.2 50.6 25.0 471 471 A K H X S+ 0 0 75 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.938 111.7 47.3 -62.1 -50.3 50.2 52.6 26.2 472 472 A L H X S+ 0 0 16 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.858 107.0 57.5 -61.9 -36.6 49.9 54.9 23.1 473 473 A K H <>S+ 0 0 58 -4,-2.5 5,-2.3 -5,-0.2 4,-0.3 0.928 111.4 43.4 -57.7 -45.3 46.2 55.3 23.7 474 474 A E H ><5S+ 0 0 146 -4,-1.6 3,-1.2 3,-0.2 -2,-0.2 0.930 111.9 51.7 -68.6 -46.2 47.0 56.6 27.2 475 475 A V H 3<5S+ 0 0 64 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.922 114.6 42.9 -58.1 -43.7 49.8 58.8 26.1 476 476 A F T 3<5S- 0 0 66 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.421 108.7-124.7 -86.7 2.8 47.7 60.5 23.4 477 477 A G T < 5 + 0 0 59 -3,-1.2 2,-0.3 -4,-0.3 -3,-0.2 0.850 50.4 162.8 60.5 39.7 44.7 60.8 25.6 478 478 A L < - 0 0 49 -5,-2.3 -1,-0.2 -6,-0.2 3,-0.1 -0.692 39.1-151.4 -94.9 144.1 42.3 59.0 23.3 479 479 A D S S+ 0 0 161 -2,-0.3 2,-0.4 1,-0.2 -1,-0.1 0.752 85.4 45.7 -79.5 -24.8 39.0 57.5 24.3 480 480 A D > - 0 0 72 1,-0.1 3,-2.2 -7,-0.1 4,-0.2 -0.981 69.7-145.1-130.4 123.4 39.0 54.8 21.7 481 481 A I G > S+ 0 0 15 -2,-0.4 3,-1.5 1,-0.3 -1,-0.1 0.807 98.6 66.4 -54.3 -31.3 42.0 52.5 20.9 482 482 A N G 3 S+ 0 0 45 1,-0.3 -1,-0.3 26,-0.2 4,-0.2 0.633 86.4 70.0 -69.4 -13.0 40.9 52.5 17.2 483 483 A D G < S+ 0 0 117 -3,-2.2 -1,-0.3 2,-0.1 -2,-0.2 0.495 74.4 104.5 -88.2 -1.8 41.7 56.2 16.9 484 484 A L S < S- 0 0 5 -3,-1.5 2,-2.2 -4,-0.2 -11,-0.0 -0.347 92.9 -99.8 -63.8 158.6 45.4 55.7 17.1 485 485 A P S S+ 0 0 37 0, 0.0 -85,-2.3 0, 0.0 2,-0.4 -0.444 86.4 118.1 -79.9 66.6 47.4 56.0 13.8 486 486 A V E -k 400 0F 18 -2,-2.2 2,-0.3 -4,-0.2 -85,-0.2 -0.999 44.4-167.5-137.0 131.0 47.5 52.2 13.5 487 487 A S E -k 401 0F 9 -87,-2.3 -85,-3.2 -2,-0.4 2,-0.5 -0.872 14.9-139.9-114.6 157.1 46.1 49.8 10.9 488 488 A Y E +k 402 0F 23 -2,-0.3 25,-2.3 23,-0.3 2,-0.3 -0.969 26.8 164.3-123.2 116.4 45.7 46.1 11.2 489 489 A D E - n 0 513G 0 -87,-3.2 2,-0.3 -2,-0.5 25,-0.2 -0.764 24.1-178.6-132.9 78.8 46.5 43.8 8.2 490 490 A I E - n 0 514G 12 23,-2.2 25,-1.9 -2,-0.3 2,-0.4 -0.670 19.9-151.8 -94.4 136.9 46.8 40.4 9.8 491 491 A A E -mn 405 515G 3 -87,-1.3 -85,-1.9 -2,-0.3 2,-0.3 -0.831 17.7-168.6-101.8 140.8 47.7 37.1 8.1 492 492 A W + 0 0 3 23,-2.1 25,-0.2 -2,-0.4 3,-0.1 -0.920 24.3 157.2-128.8 158.5 46.4 33.9 9.7 493 493 A Y + 0 0 0 1,-0.4 -486,-2.3 -2,-0.3 -485,-0.2 0.411 63.6 11.5-138.6 -59.3 47.1 30.2 9.2 494 494 A E S > S- 0 0 7 -488,-0.2 4,-0.9 -487,-0.1 -1,-0.4 -0.218 88.6 -72.5-120.7-158.0 46.2 28.1 12.2 495 495 A Q H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 -338,-0.3 0.773 117.9 60.2 -80.0 -30.1 44.4 28.1 15.5 496 496 A K H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.916 104.9 53.2 -59.5 -41.8 46.8 30.2 17.6 497 497 A A H > S+ 0 0 8 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.853 105.9 53.3 -61.3 -36.7 46.2 33.0 15.1 498 498 A V H X S+ 0 0 6 -4,-0.9 4,-2.5 2,-0.2 -1,-0.2 0.890 107.3 50.9 -65.4 -42.2 42.5 32.7 15.6 499 499 A A H X S+ 0 0 0 -4,-2.1 4,-2.2 -346,-0.2 -2,-0.2 0.918 109.5 50.8 -59.2 -42.0 43.0 33.0 19.4 500 500 A V H X S+ 0 0 11 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.929 110.0 50.5 -61.1 -44.2 45.0 36.2 18.7 501 501 A L H X S+ 0 0 20 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.934 109.8 49.0 -56.5 -47.6 42.2 37.5 16.6 502 502 A L H X S+ 0 0 8 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.879 109.1 53.6 -64.3 -37.1 39.6 36.8 19.3 503 503 A A H X S+ 0 0 4 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.932 109.2 48.7 -60.8 -46.2 41.8 38.6 21.8 504 504 A L H <>S+ 0 0 18 -4,-2.4 5,-2.4 1,-0.2 -2,-0.2 0.884 111.4 49.2 -61.9 -39.5 42.0 41.6 19.6 505 505 A L H ><5S+ 0 0 5 -4,-2.4 3,-1.3 3,-0.2 -1,-0.2 0.900 109.7 51.3 -65.5 -41.0 38.2 41.6 19.1 506 506 A F H 3<5S+ 0 0 104 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.880 106.8 55.3 -60.8 -38.5 37.8 41.3 22.9 507 507 A L T 3<5S- 0 0 54 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.455 123.3-107.9 -74.6 -0.5 40.1 44.3 23.3 508 508 A G T < 5 + 0 0 20 -3,-1.3 2,-0.4 1,-0.2 -3,-0.2 0.612 61.2 157.5 87.5 14.9 37.8 46.3 21.0 509 509 A V < - 0 0 3 -5,-2.4 2,-0.3 -28,-0.1 -1,-0.2 -0.573 18.9-173.0 -77.3 126.7 39.9 46.5 17.8 510 510 A K + 0 0 85 -2,-0.4 25,-0.2 1,-0.1 -22,-0.1 -0.821 54.7 36.6-116.6 157.1 37.6 47.1 14.8 511 511 A G S S+ 0 0 16 23,-2.2 -23,-0.3 -2,-0.3 25,-0.2 0.643 70.4 168.0 80.8 16.3 38.3 47.2 11.1 512 512 A I - 0 0 0 22,-0.5 25,-2.8 -3,-0.2 2,-0.5 -0.435 30.3-140.3 -66.6 131.9 40.9 44.4 11.0 513 513 A R E -no 489 537G 18 -25,-2.3 -23,-2.2 23,-0.2 2,-0.4 -0.857 22.2-168.7 -90.2 125.8 41.8 43.1 7.6 514 514 A L E -n 490 0G 5 23,-2.6 25,-0.5 -2,-0.5 -23,-0.2 -0.974 26.3 -27.5-120.7 127.9 42.2 39.3 7.8 515 515 A G E -n 491 0G 0 -25,-1.9 -23,-2.1 -2,-0.4 -508,-0.1 -0.902 53.4 -90.9-157.7-173.9 43.7 37.2 5.0 516 516 A P S S- 0 0 13 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.984 122.8 -9.0 -77.8 -9.9 44.7 36.0 2.6 517 517 A T S S- 0 0 41 -25,-0.2 -25,-0.2 21,-0.1 3,-0.0 -0.868 76.6-105.9-131.6 170.7 41.3 34.5 2.8 518 518 A L - 0 0 61 -2,-0.3 4,-0.1 1,-0.1 -3,-0.0 -0.724 52.3 -81.7 -95.6 149.0 38.5 34.4 5.5 519 519 A P > - 0 0 13 0, 0.0 3,-1.2 0, 0.0 -1,-0.1 -0.159 22.2-141.7 -55.7 141.9 37.9 31.3 7.5 520 520 A A T 3 S+ 0 0 22 -516,-0.4 -515,-0.1 -514,-0.3 -513,-0.0 0.720 98.0 70.8 -70.1 -21.8 35.8 28.4 6.1 521 521 A F T 3 S+ 0 0 4 -517,-0.4 2,-0.7 -372,-0.1 -371,-0.3 0.289 76.4 91.1 -84.5 7.8 34.4 27.9 9.6 522 522 A L < - 0 0 34 -3,-1.2 -379,-0.1 -373,-0.1 -4,-0.0 -0.927 69.8-150.1-100.8 111.7 32.4 31.2 9.4 523 523 A S > - 0 0 6 -2,-0.7 4,-3.2 -381,-0.2 5,-0.3 -0.307 33.0 -99.0 -69.9 162.4 28.9 30.5 8.1 524 524 A P H > S+ 0 0 89 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.921 124.7 45.3 -51.0 -44.9 27.2 33.3 6.1 525 525 A N H > S+ 0 0 95 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.868 115.1 46.8 -69.8 -36.1 25.2 34.4 9.1 526 526 A V H > S+ 0 0 9 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.926 110.4 52.1 -71.3 -41.1 28.1 34.2 11.5 527 527 A A H X S+ 0 0 31 -4,-3.2 4,-2.3 1,-0.2 -2,-0.2 0.905 108.6 52.6 -58.8 -40.9 30.4 36.1 9.1 528 528 A K H X S+ 0 0 116 -4,-2.0 4,-3.0 -5,-0.3 -1,-0.2 0.915 107.2 51.5 -62.1 -43.1 27.6 38.8 8.9 529 529 A V H X S+ 0 0 50 -4,-1.8 4,-2.8 1,-0.2 5,-0.3 0.920 111.3 47.8 -58.4 -45.9 27.5 39.1 12.8 530 530 A L H X S+ 0 0 24 -4,-2.3 4,-2.6 2,-0.2 6,-0.6 0.886 112.6 48.4 -65.6 -38.9 31.3 39.5 12.9 531 531 A V H X S+ 0 0 74 -4,-2.3 4,-2.0 4,-0.2 -2,-0.2 0.944 115.0 44.9 -65.3 -46.6 31.2 42.2 10.1 532 532 A E H < S+ 0 0 124 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.897 122.6 36.2 -66.8 -39.0 28.3 44.1 11.8 533 533 A N H < S+ 0 0 83 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.879 136.5 14.7 -80.1 -37.2 29.9 43.9 15.3 534 534 A F H < S- 0 0 19 -4,-2.6 -23,-2.2 -5,-0.3 -22,-0.5 0.442 86.5-126.2-126.0 -2.3 33.6 44.3 14.4 535 535 A N < - 0 0 78 -4,-2.0 -4,-0.2 -5,-0.4 2,-0.2 0.867 39.4-178.9 54.2 40.8 34.0 45.5 10.8 536 536 A I - 0 0 17 -6,-0.6 -23,-0.2 -25,-0.2 -1,-0.2 -0.523 6.8-165.3 -69.0 139.3 36.3 42.6 9.9 537 537 A K B -o 513 0G 43 -25,-2.8 -23,-2.6 -2,-0.2 2,-0.1 -0.921 17.8-126.5-128.3 150.0 37.4 42.9 6.2 538 538 A P - 0 0 79 0, 0.0 -23,-0.2 0, 0.0 2,-0.1 -0.471 43.3 -91.7 -82.4 164.9 39.0 40.7 3.6 539 539 A I - 0 0 37 -25,-0.5 2,-0.1 -2,-0.1 3,-0.1 -0.406 42.5-173.7 -72.1 154.4 42.1 41.8 1.8 540 540 A G - 0 0 39 1,-0.3 2,-0.1 -2,-0.1 -1,-0.1 -0.286 46.5 -37.2-119.8-149.6 41.8 43.7 -1.5 541 541 A T > - 0 0 78 -2,-0.1 4,-2.6 1,-0.1 -1,-0.3 -0.429 56.4-115.0 -75.0 158.0 44.5 44.8 -3.9 542 542 A V H > S+ 0 0 24 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.944 116.7 48.0 -55.0 -48.5 47.9 46.0 -2.6 543 543 A Q H > S+ 0 0 157 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.919 113.7 45.1 -60.9 -48.6 47.2 49.5 -4.0 544 544 A D H > S+ 0 0 100 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.896 114.1 47.7 -65.2 -42.6 43.6 49.8 -2.6 545 545 A D H X S+ 0 0 10 -4,-2.6 4,-2.9 2,-0.2 5,-0.2 0.906 111.2 50.2 -70.3 -38.6 44.4 48.5 0.9 546 546 A I H X S+ 0 0 19 -4,-2.3 4,-2.6 -5,-0.3 5,-0.2 0.958 112.6 47.7 -61.5 -47.5 47.5 50.7 1.3 547 547 A A H X S+ 0 0 63 -4,-2.1 4,-0.8 -5,-0.2 -2,-0.2 0.883 114.3 46.7 -60.8 -42.1 45.4 53.8 0.3 548 548 A A H ><>S+ 0 0 25 -4,-2.2 5,-3.0 2,-0.2 3,-0.7 0.928 112.6 49.0 -64.6 -48.4 42.6 52.8 2.6 549 549 A M H ><5S+ 0 0 0 -4,-2.9 3,-1.9 1,-0.2 -2,-0.2 0.895 106.5 55.3 -60.2 -41.5 44.9 52.1 5.6 550 550 A M H 3<5S+ 0 0 31 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.757 107.5 51.7 -64.4 -22.7 46.7 55.4 5.1 551 551 A A T <<5S- 0 0 70 -4,-0.8 -1,-0.3 -3,-0.7 -2,-0.2 0.341 123.3-108.7 -90.1 3.5 43.3 57.1 5.4 552 552 A G T < 5 0 0 43 -3,-1.9 -3,-0.2 1,-0.2 -2,-0.1 0.720 360.0 360.0 75.7 22.5 42.6 55.2 8.6 553 553 A K < 0 0 162 -5,-3.0 -1,-0.2 -6,-0.1 -5,-0.0 -0.330 360.0 360.0-130.7 360.0 40.1 52.9 6.9