==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 26-NOV-99 1QPB . COMPND 2 MOLECULE: PYRUVATE DECARBOXYLASE (FORM B); . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR G.LU,D.DOBRITZSCH,G.SCHNEIDER . 1110 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 38942.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 805 72.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 147 13.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 33 3.0 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 . 5 0.5 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 . 102 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 164 14.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 312 28.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 1.4 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 5 3 3 8 2 4 0 5 1 1 0 4 3 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 4 5 8 4 7 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 4 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 ANTIPARALLEL BRIDGES PER LADDER . 4 0 0 1 3 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 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 2 A S 0 0 142 0, 0.0 176,-1.2 0, 0.0 177,-0.5 0.000 360.0 360.0 360.0 162.8 116.7 36.3 -21.3 2 3 A E E -A 176 0A 132 174,-0.2 2,-0.3 175,-0.1 172,-0.1 -0.648 360.0-160.7-126.2-179.3 113.9 35.7 -18.8 3 4 A I E -A 175 0A 18 172,-1.2 172,-2.5 -2,-0.2 2,-0.1 -0.937 30.7-104.1-162.9 140.1 112.7 36.6 -15.3 4 5 A T E >> -A 174 0A 24 -2,-0.3 4,-2.7 170,-0.2 3,-0.7 -0.424 27.6-123.1 -69.9 143.0 110.2 35.1 -12.9 5 6 A L H 3> S+ 0 0 0 168,-1.7 4,-2.4 165,-0.4 5,-0.2 0.921 113.5 59.1 -48.5 -47.0 106.8 36.8 -12.5 6 7 A G H 3> S+ 0 0 0 165,-1.7 4,-1.2 1,-0.3 -1,-0.3 0.871 110.1 39.9 -50.6 -44.6 107.6 37.0 -8.8 7 8 A K H <> S+ 0 0 63 -3,-0.7 4,-1.8 164,-0.4 -1,-0.3 0.845 110.7 60.0 -75.1 -33.1 110.7 39.0 -9.5 8 9 A Y H X S+ 0 0 0 -4,-2.7 4,-1.7 1,-0.2 -2,-0.2 0.858 101.8 54.3 -61.6 -37.1 109.0 41.0 -12.2 9 10 A L H X S+ 0 0 1 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.942 112.1 41.7 -62.2 -49.5 106.5 42.3 -9.7 10 11 A F H X S+ 0 0 0 -4,-1.2 4,-1.3 1,-0.2 -1,-0.2 0.751 112.2 55.6 -70.8 -23.4 109.1 43.6 -7.3 11 12 A E H X S+ 0 0 55 -4,-1.8 4,-1.6 2,-0.2 -1,-0.2 0.840 110.8 45.5 -76.1 -32.3 111.1 45.0 -10.3 12 13 A R H X S+ 0 0 7 -4,-1.7 4,-1.3 2,-0.2 -2,-0.2 0.915 109.8 53.2 -75.8 -43.0 108.0 46.9 -11.3 13 14 A L H <>S+ 0 0 0 -4,-2.5 5,-3.0 1,-0.2 -2,-0.2 0.828 107.2 54.6 -61.0 -31.0 107.3 48.1 -7.8 14 15 A K H ><5S+ 0 0 50 -4,-1.3 3,-2.5 3,-0.2 -1,-0.2 0.955 101.4 57.3 -66.9 -50.4 110.9 49.4 -7.7 15 16 A Q H 3<5S+ 0 0 80 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.786 109.0 44.5 -52.2 -35.0 110.4 51.5 -10.9 16 17 A V T 3<5S- 0 0 37 -4,-1.3 -1,-0.3 2,-0.1 -2,-0.2 0.319 122.3-109.5 -93.6 9.7 107.5 53.4 -9.4 17 18 A N T < 5 + 0 0 92 -3,-2.5 2,-1.6 1,-0.2 -3,-0.2 0.725 68.1 146.1 72.6 27.5 109.5 53.8 -6.2 18 19 A V < + 0 0 0 -5,-3.0 -1,-0.2 1,-0.2 -2,-0.1 -0.736 18.4 166.5 -90.8 85.0 107.6 51.5 -3.8 19 20 A N + 0 0 18 -2,-1.6 24,-1.8 -3,-0.1 2,-0.4 0.735 54.8 55.3 -75.3 -24.4 110.8 50.6 -2.1 20 21 A T E -b 43 0B 0 22,-0.2 48,-0.5 -3,-0.2 2,-0.4 -0.889 66.9-158.6-113.8 143.3 109.2 49.0 1.0 21 22 A V E -bc 44 68B 0 22,-1.9 24,-2.1 -2,-0.4 25,-0.3 -0.965 11.8-151.8-120.7 138.5 106.7 46.1 1.0 22 23 A F E + c 0 69B 0 46,-2.5 48,-3.9 -2,-0.4 2,-0.3 -0.644 41.5 60.7-109.9 163.2 104.3 45.4 3.9 23 24 A G E - c 0 70B 0 46,-0.3 24,-0.9 -2,-0.2 23,-0.4 -0.830 69.8 -74.6 125.4-166.3 102.6 42.4 5.4 24 25 A L - 0 0 4 46,-1.1 24,-0.1 -2,-0.3 52,-0.0 -0.983 41.4-101.2-137.8 150.2 103.4 39.0 6.9 25 26 A P + 0 0 18 0, 0.0 2,-0.3 0, 0.0 47,-0.2 -0.320 46.1 172.9 -68.2 149.9 104.7 35.6 5.5 26 27 A G >> - 0 0 5 45,-0.1 4,-1.3 1006,-0.0 3,-1.1 -0.928 48.9 -81.4-151.2 176.1 102.2 32.8 5.0 27 28 A D T 34 S+ 0 0 70 -2,-0.3 45,-0.0 1,-0.2 73,-0.0 0.363 124.3 34.6 -65.3 9.3 101.5 29.4 3.7 28 29 A F T 34 S+ 0 0 43 71,-0.1 -1,-0.2 73,-0.1 72,-0.2 0.436 115.5 45.3-144.0 2.0 101.1 30.8 0.2 29 30 A N T <> S+ 0 0 1 -3,-1.1 4,-2.7 70,-0.2 3,-0.4 0.425 76.0 106.3-123.0 -8.9 103.4 33.8 -0.5 30 31 A L H X S+ 0 0 11 -4,-1.3 4,-0.6 1,-0.2 -3,-0.1 0.836 84.4 44.3 -40.8 -46.0 106.6 32.3 1.0 31 32 A S H >> S+ 0 0 30 2,-0.2 3,-0.8 1,-0.2 4,-0.7 0.899 111.6 52.0 -71.4 -39.8 108.1 31.8 -2.5 32 33 A L H >> S+ 0 0 2 -3,-0.4 3,-1.9 1,-0.2 4,-0.7 0.956 102.2 61.0 -59.8 -49.3 107.1 35.2 -3.8 33 34 A L H 3X S+ 0 0 0 -4,-2.7 4,-0.7 1,-0.3 3,-0.3 0.712 93.2 65.6 -53.1 -22.7 108.6 36.9 -0.8 34 35 A D H << S+ 0 0 45 -3,-0.8 3,-0.5 -4,-0.6 4,-0.3 0.861 93.6 60.1 -68.9 -33.5 112.1 35.5 -1.8 35 36 A K H X< S+ 0 0 15 -3,-1.9 3,-1.7 -4,-0.7 -1,-0.2 0.797 91.1 66.7 -65.4 -30.2 112.1 37.6 -5.0 36 37 A I H >< S+ 0 0 0 -4,-0.7 3,-1.7 -3,-0.3 6,-0.2 0.924 99.3 53.4 -55.6 -42.6 111.8 40.9 -3.1 37 38 A Y T 3< S+ 0 0 89 -4,-0.7 -1,-0.3 -3,-0.5 -2,-0.2 0.620 97.4 67.4 -66.7 -13.9 115.3 40.1 -1.7 38 39 A E T < S+ 0 0 101 -3,-1.7 2,-0.5 -4,-0.3 -1,-0.3 0.355 89.9 76.3 -89.0 8.5 116.5 39.7 -5.3 39 40 A V S X S- 0 0 8 -3,-1.7 3,-1.5 -4,-0.1 2,-0.1 -0.972 84.6-119.8-127.7 123.0 116.0 43.3 -6.1 40 41 A E T 3 S+ 0 0 192 -2,-0.5 3,-0.1 1,-0.2 -2,-0.1 -0.360 95.6 19.1 -58.8 133.0 118.4 46.1 -4.9 41 42 A G T 3 S+ 0 0 47 1,-0.3 2,-0.3 -2,-0.1 -1,-0.2 0.325 95.8 120.6 91.0 -4.0 116.8 48.8 -2.7 42 43 A M < - 0 0 19 -3,-1.5 -1,-0.3 -6,-0.2 2,-0.3 -0.737 37.5-179.4-101.2 139.5 113.9 46.7 -1.7 43 44 A R E -b 20 0B 35 -24,-1.8 -22,-1.9 -2,-0.3 2,-0.6 -0.922 27.3-126.9-134.1 165.2 113.0 45.7 1.8 44 45 A W E -b 21 0B 4 -2,-0.3 -22,-0.2 -24,-0.2 -24,-0.1 -0.903 16.5-146.9-114.6 104.9 110.4 43.7 3.9 45 46 A A - 0 0 0 -24,-2.1 -1,-0.2 -2,-0.6 -23,-0.1 0.827 22.0-143.9 -32.6 -57.1 108.8 45.7 6.7 46 47 A G - 0 0 12 -23,-0.4 1000,-0.1 -25,-0.3 -1,-0.1 0.867 24.5-160.9 85.9 43.0 108.5 42.6 8.9 47 48 A N - 0 0 3 -24,-0.9 3,-0.1 1,-0.1 957,-0.1 -0.015 24.1-145.4 -57.4 158.0 105.2 43.6 10.5 48 49 A A S S+ 0 0 1 1,-0.3 2,-0.2 955,-0.1 -1,-0.1 0.234 85.6 25.1-107.4 12.2 103.8 42.2 13.7 49 50 A N > - 0 0 5 -26,-0.1 4,-2.9 1,-0.1 -1,-0.3 -0.847 65.7-135.9-175.9 131.4 100.2 42.3 12.5 50 51 A E H > S+ 0 0 14 -2,-0.2 4,-2.4 2,-0.2 5,-0.1 0.899 109.4 49.6 -61.6 -41.9 98.4 42.3 9.1 51 52 A L H > S+ 0 0 8 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.975 114.0 45.1 -60.3 -55.3 96.0 45.1 10.2 52 53 A N H > S+ 0 0 0 1,-0.3 4,-3.6 2,-0.2 -2,-0.2 0.895 110.4 55.8 -55.5 -40.4 99.0 47.2 11.4 53 54 A A H X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.2 -1,-0.3 0.929 109.7 46.0 -57.4 -42.5 100.7 46.2 8.1 54 55 A A H X S+ 0 0 2 -4,-2.4 4,-1.4 2,-0.2 -2,-0.2 0.879 112.0 49.2 -67.8 -40.6 97.7 47.7 6.3 55 56 A Y H X S+ 0 0 3 -4,-2.7 4,-2.4 1,-0.2 3,-0.4 0.952 112.7 50.2 -61.5 -48.2 97.7 50.8 8.4 56 57 A A H X S+ 0 0 0 -4,-3.6 4,-2.3 1,-0.3 -2,-0.2 0.869 105.8 53.9 -56.9 -40.8 101.4 51.1 7.6 57 58 A A H X S+ 0 0 0 -4,-2.3 4,-1.6 -5,-0.2 -1,-0.3 0.842 109.6 51.4 -65.3 -29.5 100.8 50.6 3.9 58 59 A D H X S+ 0 0 1 -4,-1.4 4,-1.7 -3,-0.4 3,-0.3 0.983 109.4 46.4 -68.5 -58.1 98.4 53.5 4.1 59 60 A G H X S+ 0 0 0 -4,-2.4 4,-1.4 1,-0.3 -2,-0.2 0.854 114.0 50.1 -52.2 -40.6 100.8 55.9 5.9 60 61 A Y H X S+ 0 0 0 -4,-2.3 4,-3.0 1,-0.2 5,-0.4 0.875 107.5 52.1 -67.8 -38.7 103.5 55.0 3.5 61 62 A A H X S+ 0 0 1 -4,-1.6 4,-1.0 -3,-0.3 -1,-0.2 0.764 106.1 56.9 -69.6 -25.0 101.3 55.6 0.4 62 63 A R H < S+ 0 0 17 -4,-1.7 -1,-0.2 2,-0.1 -2,-0.2 0.898 118.4 29.8 -72.1 -39.5 100.5 59.0 1.9 63 64 A I H < S+ 0 0 28 -4,-1.4 -2,-0.2 -5,-0.2 -3,-0.1 0.772 130.1 34.8 -90.0 -31.8 104.1 60.1 2.1 64 65 A K H < S- 0 0 43 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.1 0.780 108.9-103.2 -99.2 -29.5 105.6 58.1 -0.8 65 66 A G S < S- 0 0 21 -4,-1.0 28,-0.3 -5,-0.4 2,-0.3 -0.212 85.3 -8.7 138.4 -50.6 103.0 58.0 -3.5 66 67 A M - 0 0 4 -6,-0.2 2,-0.3 -49,-0.1 28,-0.2 -0.911 66.1-156.1-164.1 172.6 101.5 54.5 -3.4 67 68 A S E - d 0 94B 0 26,-1.8 28,-2.7 -2,-0.3 2,-0.4 -0.926 8.2-132.6-152.6 176.3 102.4 51.3 -1.5 68 69 A C E -cd 21 95B 0 -48,-0.5 -46,-2.5 -2,-0.3 2,-0.4 -0.999 13.0-174.4-143.3 137.0 102.1 47.6 -1.5 69 70 A I E -cd 22 96B 0 26,-2.5 28,-2.3 -2,-0.4 2,-0.5 -0.993 9.3-155.9-131.6 139.1 101.2 45.0 1.2 70 71 A I E +cd 23 97B 0 -48,-3.9 -46,-1.1 -2,-0.4 2,-0.2 -0.958 17.2 168.6-118.8 127.9 101.3 41.2 0.9 71 72 A T E - d 0 98B 0 26,-1.6 28,-1.6 -2,-0.5 2,-0.4 -0.716 32.5-104.5-125.8 177.6 99.2 38.9 3.0 72 73 A T E >> - d 0 99B 5 -2,-0.2 5,-1.8 26,-0.2 4,-1.1 -0.859 51.3 -71.8-111.1 147.1 98.4 35.1 2.9 73 74 A F T >45S- 0 0 4 26,-1.6 2,-1.7 -2,-0.4 3,-0.7 0.188 100.3 -23.2 -29.8 138.1 95.2 33.4 1.8 74 75 A G T 3>5S+ 0 0 0 1,-0.2 4,-2.3 2,-0.1 5,-0.2 -0.321 136.8 48.1 57.6 -83.0 92.2 33.8 4.0 75 76 A V H 3>5S+ 0 0 13 -2,-1.7 4,-0.5 892,-0.2 -1,-0.2 0.925 118.4 35.9 -55.0 -56.4 93.9 34.4 7.4 76 77 A G H XX5S+ 0 0 0 -4,-1.1 4,-0.7 -3,-0.7 3,-0.5 0.917 119.0 47.9 -68.8 -43.7 96.3 37.2 6.4 77 78 A E H >4 S+ 0 0 0 -3,-0.4 4,-2.7 553,-0.2 5,-0.2 0.848 77.0 54.4 -64.7 -34.6 90.3 44.6 5.7 82 83 A N H > S+ 0 0 1 552,-0.3 4,-2.2 -3,-0.3 5,-0.2 0.981 111.4 46.7 -61.9 -51.7 89.8 47.5 8.1 83 84 A G H > S+ 0 0 3 -4,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.940 113.1 49.2 -52.0 -52.5 93.0 49.1 6.9 84 85 A I H X S+ 0 0 3 -4,-2.4 4,-2.0 1,-0.2 3,-0.2 0.943 108.5 51.6 -53.1 -54.5 92.2 48.6 3.3 85 86 A A H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.3 -1,-0.2 0.909 108.4 52.6 -51.7 -46.2 88.7 50.0 3.5 86 87 A G H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.3 -1,-0.3 0.890 108.0 50.2 -58.2 -41.0 90.1 53.1 5.2 87 88 A S H <>S+ 0 0 0 -4,-2.0 5,-3.3 -3,-0.2 -1,-0.3 0.858 110.5 52.1 -66.7 -29.5 92.5 53.6 2.4 88 89 A Y H ><5S+ 0 0 31 -4,-2.0 3,-0.5 3,-0.2 -2,-0.2 0.841 110.7 46.8 -72.7 -35.0 89.5 53.2 0.0 89 90 A A H 3<5S+ 0 0 2 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.908 117.7 38.5 -75.3 -42.9 87.5 55.9 1.8 90 91 A E T 3<5S- 0 0 1 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.035 115.9-110.7 -99.3 27.0 90.2 58.6 2.1 91 92 A H T < 5 + 0 0 25 -3,-0.5 2,-0.4 1,-0.2 -3,-0.2 0.887 56.0 161.2 46.1 64.8 91.6 57.8 -1.4 92 93 A V < - 0 0 0 -5,-3.3 2,-1.3 -6,-0.1 -1,-0.2 -0.897 42.0-122.6-111.5 140.4 95.0 56.2 -0.7 93 94 A G + 0 0 0 -2,-0.4 -26,-1.8 -28,-0.3 2,-0.5 -0.661 45.1 160.1 -85.4 92.8 96.8 54.2 -3.3 94 95 A V E -d 67 0B 1 -2,-1.3 68,-1.8 -28,-0.2 2,-0.5 -0.954 28.0-152.5-119.3 123.3 97.4 50.8 -1.7 95 96 A L E -de 68 162B 0 -28,-2.7 -26,-2.5 -2,-0.5 2,-0.6 -0.795 8.8-160.8 -92.6 128.6 98.1 47.6 -3.7 96 97 A H E -de 69 163B 3 66,-2.9 68,-2.7 -2,-0.5 2,-0.4 -0.919 9.9-177.0-115.2 106.1 97.0 44.5 -1.9 97 98 A V E -de 70 164B 0 -28,-2.3 -26,-1.6 -2,-0.6 2,-0.4 -0.854 5.1-166.9-101.7 136.2 98.7 41.3 -3.3 98 99 A V E -de 71 165B 0 66,-2.1 68,-2.6 -2,-0.4 2,-0.4 -0.979 21.0-130.0-132.4 127.6 97.7 38.0 -1.9 99 100 A G E -de 72 166B 2 -28,-1.6 -26,-1.6 -2,-0.4 -70,-0.2 -0.576 34.3-173.3 -71.6 123.0 99.4 34.6 -2.3 100 101 A V E - e 0 167B 9 66,-3.0 68,-2.7 -2,-0.4 3,-0.2 -0.914 30.0 -93.9-121.6 145.9 96.7 32.1 -3.3 101 102 A P - 0 0 9 0, 0.0 2,-0.5 0, 0.0 4,-0.1 -0.223 64.9 -71.7 -57.7 148.9 96.9 28.3 -3.7 102 103 A S > - 0 0 44 1,-0.2 3,-0.5 65,-0.2 64,-0.0 -0.176 45.7-172.7 -46.2 94.0 97.7 27.0 -7.2 103 104 A I T 3 S+ 0 0 88 -2,-0.5 2,-0.9 1,-0.3 -1,-0.2 0.774 78.8 73.5 -61.5 -25.8 94.6 27.7 -9.2 104 105 A S T 3 S+ 0 0 69 2,-0.0 -1,-0.3 -3,-0.0 2,-0.2 -0.149 76.6 122.2 -83.3 41.8 96.1 25.8 -12.1 105 106 A A < - 0 0 60 -2,-0.9 -2,-0.0 -3,-0.5 3,-0.0 -0.653 61.0-145.1-103.2 160.8 95.6 22.5 -10.2 106 107 A Q S S+ 0 0 204 -2,-0.2 2,-0.5 2,-0.0 -1,-0.1 0.490 81.3 79.3-100.1 -7.4 93.7 19.4 -11.4 107 108 A A + 0 0 41 1,-0.2 -2,-0.1 3,-0.1 -1,-0.0 -0.896 44.7 163.6-106.2 128.2 92.4 18.6 -7.8 108 109 A K S S+ 0 0 124 -2,-0.5 3,-0.2 1,-0.0 -1,-0.2 0.817 79.4 38.4-106.2 -52.7 89.5 20.5 -6.4 109 110 A Q S S+ 0 0 170 1,-0.2 2,-0.5 3,-0.0 737,-0.1 0.428 102.9 79.8 -80.8 1.3 88.2 18.6 -3.4 110 111 A L S S+ 0 0 84 1,-0.1 739,-0.3 737,-0.1 -1,-0.2 -0.502 77.5 73.3-108.1 62.2 91.8 17.7 -2.5 111 112 A L + 0 0 32 -2,-0.5 2,-0.4 -3,-0.2 -1,-0.1 -0.588 48.1 160.2-173.3 103.2 92.8 21.0 -0.8 112 113 A L + 0 0 37 -2,-0.2 2,-0.1 737,-0.1 -3,-0.0 -0.882 27.8 98.7-139.7 107.1 91.7 22.0 2.7 113 114 A H S S+ 0 0 54 -2,-0.4 854,-0.2 734,-0.0 3,-0.1 -0.495 82.1 14.8 174.2 113.2 93.4 24.6 4.9 114 115 A H S S+ 0 0 2 852,-1.7 2,-0.3 1,-0.3 853,-0.2 0.833 100.2 108.9 84.0 38.9 92.6 28.3 5.5 115 116 A T S S- 0 0 4 851,-0.3 -1,-0.3 -41,-0.1 6,-0.1 -0.919 85.8-105.8-140.3 165.1 89.2 28.1 4.0 116 117 A L - 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0 0 61 1,-0.1 18,-0.1 -2,-0.1 17,-0.0 -0.467 50.5 -79.3 -67.2 123.4 101.0 82.2 21.0 355 356 A N - 0 0 52 -2,-0.3 2,-0.5 1,-0.1 -1,-0.1 0.368 48.3-110.9 -17.7 143.5 100.3 81.7 24.7 356 357 A A - 0 0 83 1,-0.1 -1,-0.1 -3,-0.1 0, 0.0 -0.767 51.3 -75.8 -92.9 127.2 101.6 84.3 27.2 357 358 A A - 0 0 113 -2,-0.5 -1,-0.1 1,-0.1 -2,-0.0 0.220 57.7-167.1 -20.7 107.2 104.4 83.2 29.5 358 359 A V - 0 0 55 -3,-0.1 4,-0.1 1,-0.1 -1,-0.1 -0.900 33.8 -84.8-111.2 136.7 102.8 81.1 32.2 359 360 A P > - 0 0 88 0, 0.0 3,-2.6 0, 0.0 156,-0.2 -0.053 39.5-120.7 -41.4 123.5 104.5 80.0 35.4 360 361 A A T 3 S+ 0 0 66 1,-0.3 155,-2.6 154,-0.2 156,-0.5 0.651 108.3 58.4 -40.5 -27.5 106.6 76.9 34.9 361 362 A S T 3 S+ 0 0 95 153,-0.2 -1,-0.3 154,-0.1 0, 0.0 0.288 73.7 121.2 -94.5 12.9 104.6 74.9 37.5 362 363 A T S < S- 0 0 41 -3,-2.6 152,-4.0 -4,-0.1 153,-0.3 -0.608 70.7-107.2 -77.7 135.2 101.2 75.2 35.9 363 364 A P B -N 513 0E 96 0, 0.0 150,-0.2 0, 0.0 -1,-0.1 -0.395 38.7-101.6 -65.0 128.9 99.5 71.9 35.0 364 365 A L - 0 0 5 148,-2.6 2,-0.3 174,-0.2 3,-0.1 -0.212 40.9-176.6 -56.6 134.4 99.4 70.9 31.3 365 366 A K > - 0 0 112 174,-0.1 4,-1.7 1,-0.1 3,-0.2 -0.964 31.6-121.0-130.8 146.4 96.0 71.4 29.6 366 367 A Q H > S+ 0 0 0 -2,-0.3 4,-2.8 1,-0.2 5,-0.3 0.914 106.7 55.3 -55.0 -53.5 95.2 70.5 26.0 367 368 A E H > S+ 0 0 57 177,-0.3 4,-1.3 1,-0.3 -1,-0.2 0.887 111.8 46.1 -48.1 -45.6 94.2 73.9 24.6 368 369 A W H > S+ 0 0 32 -3,-0.2 4,-2.5 1,-0.2 -1,-0.3 0.868 112.7 51.3 -66.4 -38.3 97.5 75.3 25.8 369 370 A M H X S+ 0 0 0 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.930 106.8 49.8 -68.4 -47.1 99.4 72.4 24.3 370 371 A W H X S+ 0 0 0 -4,-2.8 4,-0.8 1,-0.2 -1,-0.2 0.859 116.8 44.6 -60.2 -32.5 97.9 72.5 20.8 371 372 A N H < S+ 0 0 22 -4,-1.3 3,-0.4 -5,-0.3 27,-0.3 0.900 113.9 47.9 -76.9 -42.7 98.7 76.2 20.7 372 373 A Q H >X S+ 0 0 25 -4,-2.5 3,-1.7 1,-0.2 4,-0.7 0.745 97.1 72.7 -70.6 -25.0 102.2 75.8 22.1 373 374 A L H >X S+ 0 0 1 -4,-2.3 4,-1.4 1,-0.3 3,-1.3 0.950 77.3 78.6 -54.5 -48.5 102.9 72.9 19.7 374 375 A G H 3< S+ 0 0 19 -4,-0.8 -1,-0.3 -3,-0.4 -2,-0.2 0.689 94.1 50.7 -30.7 -33.1 103.1 75.5 16.9 375 376 A N H <4 S+ 0 0 117 -3,-1.7 -1,-0.3 -4,-0.2 -2,-0.2 0.898 102.8 53.4 -79.1 -44.3 106.6 76.4 18.2 376 377 A F H << S+ 0 0 11 -3,-1.3 -2,-0.2 -4,-0.7 -1,-0.2 0.822 90.8 96.9 -61.6 -30.6 108.3 72.9 18.4 377 378 A L < - 0 0 11 -4,-1.4 2,-0.3 4,-0.0 26,-0.0 -0.298 56.3-167.8 -64.1 140.8 107.3 72.2 14.8 378 379 A Q > - 0 0 84 22,-0.1 3,-1.7 24,-0.0 2,-0.2 -0.890 35.9 -79.5-126.9 158.1 109.9 72.8 12.1 379 380 A E T 3 S+ 0 0 137 -2,-0.3 23,-0.2 1,-0.2 24,-0.1 -0.382 114.9 31.6 -62.0 123.6 109.7 73.0 8.3 380 381 A G T 3 S+ 0 0 13 22,-0.9 -1,-0.2 1,-0.3 24,-0.2 -0.008 84.5 138.9 120.8 -26.1 109.5 69.5 6.8 381 382 A D < - 0 0 1 -3,-1.7 23,-1.9 22,-0.1 2,-0.5 0.045 45.7-144.0 -51.2 153.2 107.8 67.7 9.6 382 383 A V E -op 404 437F 2 54,-1.4 56,-2.2 21,-0.2 2,-0.5 -0.987 19.1-161.2-120.8 113.0 105.0 65.1 9.1 383 384 A V E -op 405 438F 3 21,-3.4 23,-2.2 -2,-0.5 2,-0.4 -0.870 6.2-170.1-102.9 130.6 102.4 65.5 11.9 384 385 A I E -op 406 439F 0 54,-2.2 56,-2.3 -2,-0.5 2,-0.4 -0.976 1.0-168.7-121.8 128.8 100.1 62.6 12.6 385 386 A A E -op 407 440F 2 21,-1.9 23,-0.5 -2,-0.4 2,-0.3 -0.946 15.9-131.6-121.3 139.3 97.1 62.8 14.9 386 387 A E > - 0 0 1 54,-1.6 5,-2.4 -2,-0.4 6,-0.2 -0.623 34.4 -95.1 -90.3 145.0 94.9 60.0 16.2 387 388 A T T 5S+ 0 0 32 -2,-0.3 2,-0.3 3,-0.2 55,-0.3 -0.267 96.0 51.1 -53.5 136.2 91.2 60.0 16.2 388 389 A G T >5S- 0 0 12 1,-0.2 4,-1.5 87,-0.1 5,-0.2 -0.943 122.3 -19.2 130.0-151.8 89.9 61.3 19.5 389 390 A T H >5S+ 0 0 7 -2,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.854 134.9 57.2 -58.9 -35.6 91.0 64.5 21.3 390 391 A S H >>5S+ 0 0 1 2,-0.2 4,-2.1 1,-0.2 3,-0.7 0.976 103.0 50.3 -59.4 -58.6 94.1 64.7 19.2 391 392 A A H 34< S+ 0 0 5 -4,-2.1 3,-0.7 1,-0.2 -1,-0.2 0.615 86.7 68.7 -71.5 -8.2 95.6 69.4 15.8 395 396 A N G 3 S+ 0 0 20 -3,-0.4 -134,-0.3 1,-0.2 -1,-0.2 0.686 91.1 59.4 -81.4 -17.9 93.5 71.9 13.8 396 397 A Q G < S+ 0 0 30 -3,-1.3 2,-0.5 -4,-0.1 -1,-0.2 0.266 86.1 100.3 -92.8 11.8 94.2 74.7 16.3 397 398 A T S < S- 0 0 2 -3,-0.7 2,-0.7 -24,-0.1 -26,-0.1 -0.848 72.7-132.4-102.0 133.6 97.9 74.4 15.6 398 399 A T - 0 0 44 -2,-0.5 -2,-0.1 -27,-0.3 -3,-0.0 -0.738 25.8-139.9 -85.6 116.9 99.6 76.9 13.3 399 400 A F - 0 0 4 -2,-0.7 3,-0.1 1,-0.1 -146,-0.1 -0.615 7.9-128.2 -84.2 133.5 101.8 75.0 10.9 400 401 A P > - 0 0 22 0, 0.0 3,-0.6 0, 0.0 -147,-0.4 -0.125 55.8 -63.4 -64.5 175.9 105.2 76.2 9.8 401 402 A N T 3 S+ 0 0 51 1,-0.2 -21,-0.2 -149,-0.1 -149,-0.1 -0.450 120.0 9.8 -68.6 127.5 105.7 76.4 6.1 402 403 A N T 3 S+ 0 0 115 -2,-0.2 -22,-0.9 1,-0.2 2,-0.5 0.937 82.6 150.7 74.0 50.3 105.6 73.0 4.3 403 404 A T < - 0 0 6 -3,-0.6 2,-0.3 -152,-0.2 -1,-0.2 -0.957 30.8-151.1-117.1 123.0 104.3 70.8 7.1 404 405 A Y E -o 382 0F 45 -23,-1.9 -21,-3.4 -2,-0.5 2,-0.3 -0.707 9.0-161.1 -96.9 145.2 102.2 67.7 6.2 405 406 A G E -o 383 0F 14 -157,-0.4 2,-0.4 -2,-0.3 -21,-0.2 -0.901 11.2-157.5-124.8 152.0 99.5 66.2 8.4 406 407 A I E +o 384 0F 0 -23,-2.2 -21,-1.9 -2,-0.3 2,-0.4 -0.941 23.4 159.6-128.6 107.7 97.8 62.8 8.5 407 408 A S E -o 385 0F 22 -2,-0.4 2,-3.9 -23,-0.2 3,-0.3 -0.953 38.0-141.0-130.2 113.4 94.4 62.7 10.2 408 409 A Q > + 0 0 4 -23,-0.5 4,-1.1 -2,-0.4 -162,-0.1 -0.218 42.7 157.9 -71.2 62.3 92.0 59.9 9.4 409 410 A V T 4 + 0 0 28 -2,-3.9 -1,-0.2 2,-0.1 -163,-0.1 0.868 66.3 31.6 -52.0 -49.1 89.1 62.3 9.5 410 411 A L T 4 S+ 0 0 6 -3,-0.3 260,-2.1 259,-0.1 261,-0.3 0.971 127.1 32.6 -83.3 -57.8 86.6 60.4 7.4 411 412 A W T 4 S- 0 0 0 258,-0.2 220,-0.2 -325,-0.2 -2,-0.1 0.936 84.5-171.6 -66.5 -42.3 87.2 56.7 8.0 412 413 A G < + 0 0 2 -4,-1.1 2,-0.7 1,-0.2 219,-0.1 0.899 12.5 168.1 51.8 56.7 88.2 57.4 11.6 413 414 A S > - 0 0 3 -331,-0.1 3,-1.7 -330,-0.1 4,-0.2 -0.863 31.3-132.6-100.4 109.0 89.5 54.0 12.8 414 415 A I T 3 S+ 0 0 54 -2,-0.7 -26,-0.1 1,-0.2 -28,-0.0 -0.301 91.5 37.1 -61.3 140.8 91.4 54.3 16.2 415 416 A G T >> S+ 0 0 0 -28,-0.1 4,-0.9 34,-0.0 3,-0.8 -0.108 84.2 108.2 109.4 -33.1 94.7 52.5 16.2 416 417 A F H <> S+ 0 0 0 -3,-1.7 4,-2.5 1,-0.2 3,-0.4 0.797 70.2 59.9 -44.3 -41.2 95.4 53.4 12.6 417 418 A T H 3> S+ 0 0 0 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.885 92.9 59.8 -64.0 -42.8 98.2 55.9 13.5 418 419 A T H <> S+ 0 0 5 -3,-0.8 4,-1.1 1,-0.2 -1,-0.2 0.878 116.2 39.1 -53.9 -34.6 100.6 53.6 15.3 419 420 A G H X S+ 0 0 0 -4,-0.9 4,-2.1 -3,-0.4 -2,-0.2 0.910 114.0 50.1 -79.9 -46.5 100.7 51.7 12.0 420 421 A A H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 5,-0.2 0.817 106.0 61.7 -60.6 -31.7 100.7 54.7 9.6 421 422 A T H X S+ 0 0 0 -4,-3.2 4,-3.4 2,-0.2 5,-0.3 0.946 104.7 45.1 -58.7 -52.8 103.5 56.1 11.8 422 423 A L H X S+ 0 0 0 -4,-1.1 4,-1.4 -5,-0.2 -2,-0.2 0.937 116.4 45.5 -60.1 -47.4 105.8 53.2 10.9 423 424 A G H X S+ 0 0 0 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.857 116.5 46.3 -64.9 -33.3 104.9 53.3 7.2 424 425 A A H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.902 109.4 51.4 -75.0 -43.7 105.3 57.1 7.2 425 426 A A H X S+ 0 0 10 -4,-3.4 4,-1.8 1,-0.2 -1,-0.2 0.795 110.4 55.0 -64.7 -24.7 108.6 57.2 9.0 426 427 A F H X S+ 0 0 0 -4,-1.4 4,-2.0 -5,-0.3 -2,-0.2 0.942 110.1 40.5 -70.9 -54.5 109.8 54.6 6.5 427 428 A A H X S+ 0 0 0 -4,-1.8 4,-1.7 2,-0.2 5,-0.2 0.898 113.2 55.5 -63.7 -41.8 109.0 56.6 3.3 428 429 A A H >X S+ 0 0 1 -4,-2.5 4,-3.3 1,-0.2 3,-1.8 0.986 106.0 52.7 -52.0 -61.3 110.2 59.8 4.9 429 430 A E H 3< S+ 0 0 64 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.871 108.5 48.7 -38.8 -56.9 113.5 58.1 5.6 430 431 A E H 3< S+ 0 0 60 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.785 118.2 42.6 -58.8 -28.0 113.9 57.0 2.0 431 432 A I H << S- 0 0 93 -3,-1.8 -2,-0.2 -4,-1.7 -1,-0.2 0.863 138.5 -12.9 -86.3 -42.1 113.1 60.5 0.9 432 433 A D >< - 0 0 69 -4,-3.3 3,-1.4 -5,-0.2 -1,-0.3 -0.803 53.0-149.8-164.5 116.6 115.2 62.4 3.4 433 434 A P T 3 S+ 0 0 88 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 0.746 98.1 53.8 -62.5 -23.1 116.8 61.0 6.6 434 435 A K T 3 S+ 0 0 119 -6,-0.1 2,-0.4 -5,-0.1 95,-0.2 0.459 78.3 111.6 -93.1 0.3 116.5 64.3 8.5 435 436 A K < - 0 0 56 -3,-1.4 2,-0.2 -7,-0.1 -3,-0.1 -0.618 63.5-139.5 -75.7 123.2 112.7 64.7 7.9 436 437 A R - 0 0 1 -2,-0.4 -54,-1.4 -58,-0.1 2,-0.4 -0.548 12.0-157.0 -87.7 152.6 111.0 64.3 11.3 437 438 A V E -p 382 0F 7 25,-0.3 27,-2.1 -2,-0.2 2,-0.4 -0.978 11.5-171.7-130.9 116.8 107.8 62.4 12.0 438 439 A I E -pq 383 464F 1 -56,-2.2 -54,-2.2 -2,-0.4 2,-0.4 -0.883 1.2-166.9-110.8 141.6 105.8 63.4 15.1 439 440 A L E -pq 384 465F 2 25,-2.6 27,-3.1 -2,-0.4 2,-0.5 -0.991 9.1-167.8-134.1 130.5 102.7 61.5 16.4 440 441 A F E +pq 385 466F 2 -56,-2.3 -54,-1.6 -2,-0.4 2,-0.3 -0.965 22.7 161.0-113.6 128.9 100.1 62.4 19.0 441 442 A I E - q 0 467F 2 25,-2.1 27,-2.4 -2,-0.5 -53,-0.1 -0.983 36.1-112.5-152.5 138.4 97.9 59.6 20.2 442 443 A G E > - q 0 468F 13 -2,-0.3 4,-1.1 -55,-0.3 27,-0.2 -0.149 31.3-112.5 -64.8 163.8 95.6 59.0 23.2 443 444 A D H > S+ 0 0 7 25,-1.8 4,-0.8 29,-0.2 26,-0.1 0.820 114.2 55.0 -66.3 -30.7 96.4 56.3 25.8 444 445 A G H >> S+ 0 0 3 28,-0.3 3,-0.7 24,-0.3 4,-0.5 0.950 103.6 48.1 -69.3 -53.0 93.3 54.4 24.6 445 446 A S H >> S+ 0 0 12 1,-0.2 3,-1.0 2,-0.2 4,-0.7 0.799 100.6 68.2 -61.8 -26.9 94.0 54.0 20.9 446 447 A L H >X S+ 0 0 4 -4,-1.1 4,-1.9 1,-0.3 3,-1.3 0.927 89.7 63.7 -58.5 -42.8 97.6 52.8 21.6 447 448 A Q H << S+ 0 0 7 -4,-0.8 -1,-0.3 -3,-0.7 4,-0.2 0.784 94.3 62.1 -51.8 -31.5 96.3 49.6 23.1 448 449 A L H << S+ 0 0 5 -3,-1.0 -1,-0.3 -4,-0.5 -2,-0.2 0.822 127.9 4.3 -67.9 -32.5 94.7 48.5 19.8 449 450 A T H X< S+ 0 0 1 -3,-1.3 3,-2.2 -4,-0.7 -2,-0.2 0.170 81.8 135.1-140.0 18.1 98.0 48.4 17.8 450 451 A V G >< + 0 0 0 -4,-1.9 3,-1.8 1,-0.3 4,-0.2 0.759 62.7 71.8 -38.3 -43.0 100.8 49.0 20.3 451 452 A Q G > S+ 0 0 0 1,-0.3 3,-0.9 -4,-0.2 4,-0.5 0.519 76.1 79.5 -60.5 -4.5 103.0 46.2 19.1 452 453 A E G <> S+ 0 0 0 -3,-2.2 4,-1.0 1,-0.2 -1,-0.3 0.613 75.1 74.5 -79.7 -7.5 103.8 48.0 15.8 453 454 A I H <> S+ 0 0 2 -3,-1.8 4,-2.5 1,-0.2 -1,-0.2 0.801 86.8 68.3 -66.9 -27.2 106.4 50.1 17.7 454 455 A S H <> S+ 0 0 2 -3,-0.9 4,-2.2 1,-0.2 -1,-0.2 0.943 97.6 46.4 -53.8 -56.1 108.3 46.7 17.5 455 456 A T H > S+ 0 0 0 -4,-0.5 4,-1.0 1,-0.2 -1,-0.2 0.773 109.8 57.6 -61.4 -26.3 108.7 47.0 13.7 456 457 A M H ><>S+ 0 0 0 -4,-1.0 5,-1.6 2,-0.2 3,-0.6 0.957 107.1 46.1 -68.3 -50.3 109.9 50.6 14.4 457 458 A I H ><5S+ 0 0 21 -4,-2.5 3,-2.2 1,-0.2 -2,-0.2 0.931 106.4 58.0 -58.7 -48.2 112.7 49.6 16.7 458 459 A R H 3<5S+ 0 0 71 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.799 109.5 45.5 -56.3 -28.9 113.9 46.8 14.4 459 460 A W T <<5S- 0 0 70 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.428 108.2-123.8 -96.2 4.5 114.5 49.3 11.6 460 461 A G T < 5 + 0 0 40 -3,-2.2 -3,-0.2 -4,-0.4 -2,-0.1 0.732 49.8 167.3 63.5 22.5 116.1 51.9 13.9 461 462 A L < - 0 0 4 -5,-1.6 71,-0.4 -6,-0.2 -1,-0.2 -0.261 29.9-143.9 -64.1 156.8 113.6 54.5 12.9 462 463 A K + 0 0 82 69,-0.2 -25,-0.3 -37,-0.1 69,-0.2 -0.427 36.5 151.0-126.8 60.9 113.6 57.7 15.0 463 464 A P - 0 0 1 0, 0.0 70,-2.2 0, 0.0 2,-0.6 -0.314 44.9-115.8 -86.7 171.4 110.0 59.0 15.4 464 465 A Y E -qr 438 533F 0 -27,-2.1 -25,-2.6 68,-0.2 2,-0.9 -0.919 23.3-165.9-110.9 109.1 108.4 61.0 18.2 465 466 A L E -qr 439 534F 7 68,-3.0 70,-2.2 -2,-0.6 2,-0.8 -0.780 4.5-174.4 -99.3 97.2 105.6 59.2 20.1 466 467 A F E -qr 440 535F 0 -27,-3.1 -25,-2.1 -2,-0.9 2,-0.6 -0.812 9.4-164.7 -89.3 113.4 103.6 61.7 22.2 467 468 A V E -qr 441 536F 2 68,-2.7 70,-2.1 -2,-0.8 2,-1.0 -0.895 10.9-145.7-105.7 123.1 101.2 59.6 24.2 468 469 A L E -qr 442 537F 0 -27,-2.4 -25,-1.8 -2,-0.6 2,-1.0 -0.733 12.0-165.2 -90.4 97.6 98.3 61.5 25.8 469 470 A N E + r 0 538F 31 -2,-1.0 70,-2.4 68,-0.8 -27,-0.1 -0.720 31.5 145.3 -85.5 101.0 97.5 59.8 29.1 470 471 A N - 0 0 4 -2,-1.0 -1,-0.2 2,-0.2 73,-0.1 -0.067 67.9-107.3-124.5 27.0 94.1 61.1 30.2 471 472 A D S S- 0 0 86 2,-0.1 2,-0.2 17,-0.0 -2,-0.1 0.900 79.4 -6.0 49.6 66.3 93.0 57.9 31.8 472 473 A G S S- 0 0 1 16,-0.1 2,-1.7 18,-0.1 -28,-0.3 -0.597 106.2 -39.1 119.2 178.3 90.4 56.4 29.4 473 474 A Y > + 0 0 30 14,-2.5 4,-2.4 1,-0.2 3,-0.3 -0.542 59.1 169.3 -82.6 79.4 88.4 57.3 26.3 474 475 A T H > S+ 0 0 4 -2,-1.7 4,-1.6 1,-0.2 -1,-0.2 0.895 71.6 58.1 -61.6 -42.3 87.7 61.0 27.0 475 476 A I H 4 S+ 0 0 28 1,-0.2 4,-0.5 2,-0.2 3,-0.3 0.927 112.9 43.8 -53.4 -41.7 86.4 61.9 23.6 476 477 A E H >> S+ 0 0 35 -3,-0.3 4,-2.2 1,-0.2 3,-2.2 0.951 107.4 56.2 -67.1 -51.4 83.8 59.2 24.2 477 478 A K H 3< S+ 0 0 4 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.712 103.2 61.0 -52.7 -22.4 83.0 60.2 27.8 478 479 A L T 3< S+ 0 0 33 -4,-1.6 -1,-0.3 -3,-0.3 -2,-0.2 0.695 111.5 33.7 -81.4 -22.4 82.3 63.6 26.4 479 480 A I T <4 S- 0 0 55 -3,-2.2 2,-0.2 -4,-0.5 -2,-0.2 0.612 135.3 -11.0-105.6 -16.6 79.4 62.5 24.2 480 481 A H S < S+ 0 0 75 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.1 -0.845 113.6 25.5 179.5 142.3 78.2 59.7 26.5 481 482 A G > - 0 0 11 -2,-0.2 3,-1.0 -3,-0.1 6,-0.1 0.988 51.8-174.0 66.2 61.0 78.9 57.7 29.6 482 483 A P T 3 S+ 0 0 66 0, 0.0 -5,-0.1 0, 0.0 -4,-0.1 0.846 90.4 20.9 -53.7 -38.0 81.3 60.0 31.5 483 484 A K T 3 S+ 0 0 153 -6,-0.1 2,-0.1 5,-0.0 -2,-0.1 0.135 92.7 140.2-116.8 15.4 81.9 57.4 34.2 484 485 A A X - 0 0 15 -3,-1.0 3,-2.0 1,-0.1 4,-0.1 -0.417 55.0-134.9 -64.6 133.2 80.9 54.4 32.0 485 486 A Q G > S+ 0 0 89 1,-0.3 3,-1.8 2,-0.2 -1,-0.1 0.792 102.9 64.9 -59.4 -31.2 83.2 51.4 32.6 486 487 A Y G 3 S+ 0 0 5 1,-0.3 -1,-0.3 100,-0.1 -2,-0.1 0.582 98.7 55.3 -71.9 -6.7 83.4 50.8 28.8 487 488 A N G < S+ 0 0 0 -3,-2.0 -14,-2.5 -6,-0.1 -1,-0.3 0.325 96.9 84.1-103.3 5.0 85.2 54.2 28.6 488 489 A E < - 0 0 61 -3,-1.8 2,-0.3 -16,-0.2 -16,-0.1 -0.713 62.1-161.0-105.1 157.6 87.8 53.1 31.1 489 490 A I - 0 0 21 -2,-0.3 2,-0.4 -18,-0.0 -2,-0.1 -0.840 27.1 -86.3-136.0 172.0 91.0 51.2 30.5 490 491 A Q - 0 0 34 -2,-0.3 2,-0.2 1,-0.1 -18,-0.1 -0.634 50.9-109.7 -79.1 130.3 93.7 49.0 32.1 491 492 A G - 0 0 50 -2,-0.4 2,-0.3 567,-0.1 -1,-0.1 -0.398 38.6-164.7 -63.6 128.9 96.6 51.1 33.5 492 493 A W - 0 0 22 -2,-0.2 2,-1.7 566,-0.1 565,-0.2 -0.883 29.1-126.3-117.1 148.4 99.8 50.6 31.4 493 494 A D - 0 0 79 563,-3.0 3,-0.2 -2,-0.3 4,-0.1 -0.665 37.5-177.0 -88.6 80.2 103.5 51.5 32.2 494 495 A H S > S+ 0 0 6 -2,-1.7 3,-1.4 1,-0.2 4,-0.3 0.849 70.0 52.8 -48.9 -48.4 103.7 53.5 29.0 495 496 A L T > S+ 0 0 21 1,-0.3 3,-1.4 -3,-0.2 -1,-0.2 0.941 101.2 57.3 -60.4 -48.3 107.4 54.4 29.2 496 497 A S T 3> S+ 0 0 32 1,-0.3 4,-1.6 -3,-0.2 -1,-0.3 0.376 84.5 92.6 -66.5 11.4 108.8 50.9 29.7 497 498 A L H <> S+ 0 0 2 -3,-1.4 4,-1.3 2,-0.2 -1,-0.3 0.896 79.9 52.4 -71.6 -41.7 107.1 50.1 26.4 498 499 A L H X4>S+ 0 0 0 -3,-1.4 5,-2.1 -4,-0.3 3,-0.6 0.963 111.6 44.6 -60.3 -53.6 110.1 50.8 24.3 499 500 A P H >45S+ 0 0 34 0, 0.0 3,-2.4 0, 0.0 550,-0.2 0.885 105.4 62.0 -59.3 -41.2 112.5 48.6 26.3 500 501 A T H 3<5S+ 0 0 4 -4,-1.6 549,-3.1 1,-0.3 -2,-0.2 0.866 102.9 50.2 -55.6 -36.3 110.1 45.7 26.5 501 502 A F T <<5S- 0 0 0 -4,-1.3 -1,-0.3 -3,-0.6 -3,-0.1 0.172 132.2 -94.0 -89.5 22.1 110.1 45.4 22.7 502 503 A G T < 5 + 0 0 28 -3,-2.4 2,-0.2 1,-0.2 -2,-0.2 0.641 63.6 167.4 81.1 16.5 113.9 45.4 22.8 503 504 A A < + 0 0 10 -5,-2.1 -1,-0.2 -6,-0.2 3,-0.2 -0.458 5.7 172.1 -63.8 129.7 114.7 49.1 22.3 504 505 A K S S+ 0 0 203 1,-0.2 2,-0.7 -2,-0.2 -1,-0.2 0.780 71.2 37.6-106.6 -42.8 118.3 49.6 23.1 505 506 A D S S+ 0 0 99 2,-0.0 27,-0.5 -6,-0.0 -1,-0.2 -0.798 89.5 116.2-113.7 86.9 119.0 53.2 22.1 506 507 A Y - 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