==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 04-JAN-07 2JCY . COMPND 2 MOLECULE: 1-DEOXY-D-XYLULOSE 5-PHOSPHATE REDUCTOISOMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR L.M.HENRIKSSON,T.UNGE,T.A.JONES,S.L.MOWBRAY . 758 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 29810.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 551 72.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 70 9.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 44 5.8 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 . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 44 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 90 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 268 35.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.2 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 6 0 0 3 2 7 1 5 3 0 2 0 0 2 0 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 4 4 2 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 PARALLEL BRIDGES PER LADDER . 1 1 0 1 5 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 2 0 0 1 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 11 A G 0 0 114 0, 0.0 2,-0.5 0, 0.0 26,-0.0 0.000 360.0 360.0 360.0 -26.5 14.5 27.7 11.6 2 12 A R - 0 0 132 27,-0.0 2,-0.4 2,-0.0 27,-0.2 -0.886 360.0-134.2-101.6 122.9 12.6 26.6 8.5 3 13 A L E -a 29 0A 42 25,-3.0 27,-2.2 -2,-0.5 2,-0.5 -0.647 8.4-138.1 -85.4 126.1 14.6 24.3 6.2 4 14 A R E -a 30 0A 73 -2,-0.4 84,-2.7 25,-0.2 85,-2.3 -0.725 26.5-162.6 -82.5 123.8 14.6 25.0 2.4 5 15 A V E -ab 31 89A 0 25,-3.0 27,-2.6 -2,-0.5 28,-0.8 -0.925 18.6-159.9-119.9 126.1 14.3 21.7 0.5 6 16 A V E -ab 33 90A 1 83,-2.3 85,-3.0 -2,-0.5 2,-0.7 -0.908 16.5-154.3 -95.9 128.6 15.0 20.8 -3.1 7 17 A V E -ab 34 91A 0 26,-2.8 28,-1.9 -2,-0.5 2,-0.5 -0.904 7.8-168.3-108.8 109.9 13.2 17.6 -4.1 8 18 A L E S+ab 35 92A 0 83,-3.1 85,-2.4 -2,-0.7 28,-0.2 -0.864 78.7 21.1 -99.6 128.5 14.9 15.6 -6.9 9 19 A G S > S+ 0 0 10 26,-2.6 3,-0.9 -2,-0.5 6,-0.7 0.893 78.7 167.0 77.9 49.7 12.7 12.8 -8.3 10 20 A S T 3 + 0 0 0 25,-1.9 9,-0.2 -3,-0.5 26,-0.1 0.734 64.0 57.1 -71.9 -26.9 9.6 14.5 -6.9 11 21 A T T 3 S+ 0 0 23 24,-0.2 -1,-0.2 4,-0.2 25,-0.1 0.522 91.1 91.6 -86.3 -7.8 7.0 12.4 -8.8 12 22 A G S <> S- 0 0 33 -3,-0.9 4,-2.4 1,-0.1 5,-0.2 -0.166 97.3 -93.2 -78.3 178.8 8.3 9.1 -7.5 13 23 A S H > S+ 0 0 29 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.906 126.5 43.1 -59.1 -45.1 7.1 7.2 -4.4 14 24 A I H > S+ 0 0 19 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.904 114.2 50.0 -69.3 -46.1 9.8 8.8 -2.2 15 25 A G H > S+ 0 0 0 -6,-0.7 4,-1.9 2,-0.2 -2,-0.2 0.878 111.7 47.6 -59.7 -43.3 9.4 12.3 -3.7 16 26 A T H X S+ 0 0 41 -4,-2.4 4,-1.6 2,-0.2 -2,-0.2 0.912 113.3 47.2 -67.0 -46.0 5.6 12.3 -3.2 17 27 A Q H X S+ 0 0 34 -4,-1.8 4,-2.1 -5,-0.2 -2,-0.2 0.876 110.6 54.1 -61.3 -39.9 5.8 11.1 0.4 18 28 A A H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.904 107.2 49.8 -59.4 -44.0 8.5 13.7 1.1 19 29 A L H X S+ 0 0 21 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.833 108.1 54.2 -65.2 -34.0 6.2 16.5 -0.2 20 30 A Q H X S+ 0 0 98 -4,-1.6 4,-2.5 2,-0.2 -2,-0.2 0.916 109.3 47.5 -63.3 -45.4 3.4 15.1 2.1 21 31 A V H X S+ 0 0 3 -4,-2.1 4,-1.2 2,-0.2 -2,-0.2 0.911 113.8 47.7 -58.2 -46.9 5.8 15.4 5.1 22 32 A I H < S+ 0 0 10 -4,-2.4 7,-0.3 2,-0.2 -2,-0.2 0.885 112.6 48.8 -64.0 -40.0 6.8 18.9 4.0 23 33 A A H < S+ 0 0 71 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.882 111.6 49.2 -65.1 -42.3 3.1 19.9 3.6 24 34 A D H < S+ 0 0 111 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.721 117.6 43.1 -66.7 -23.5 2.2 18.4 7.0 25 35 A N >X + 0 0 34 -4,-1.2 4,-2.2 -5,-0.2 3,-1.8 -0.424 61.8 154.4-127.0 59.2 5.1 20.3 8.6 26 36 A P T 34 S+ 0 0 72 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.706 74.9 58.5 -62.5 -23.4 5.1 23.9 7.1 27 37 A D T 34 S+ 0 0 148 -3,-0.1 3,-0.1 1,-0.1 -2,-0.1 0.620 115.5 35.3 -78.9 -14.7 6.9 25.4 10.2 28 38 A R T <4 S+ 0 0 31 -3,-1.8 -25,-3.0 1,-0.2 2,-0.3 0.731 123.4 26.4-103.7 -38.9 9.8 22.9 9.8 29 39 A F E < -a 3 0A 2 -4,-2.2 2,-0.3 -7,-0.3 -1,-0.2 -0.924 49.3-174.0-131.2 151.6 10.2 22.7 6.0 30 40 A E E -a 4 0A 74 -27,-2.2 -25,-3.0 -2,-0.3 2,-0.4 -0.975 27.1-126.4-138.7 139.0 9.5 24.5 2.7 31 41 A V E +a 5 0A 20 -2,-0.3 -25,-0.2 -27,-0.2 3,-0.1 -0.687 31.8 165.9 -77.7 128.5 9.9 23.3 -0.9 32 42 A V E + 0 0 28 -27,-2.6 2,-0.3 -2,-0.4 -26,-0.2 0.297 63.3 21.8-122.8 5.3 12.1 25.6 -3.0 33 43 A G E -a 6 0A 0 -28,-0.8 -26,-2.8 20,-0.1 2,-0.3 -0.920 54.4-165.9-174.1 142.7 12.8 23.3 -6.0 34 44 A L E -ac 7 56A 0 21,-1.8 23,-2.2 -2,-0.3 2,-0.4 -0.993 3.5-173.5-135.7 140.9 11.5 20.2 -7.9 35 45 A A E +ac 8 57A 1 -28,-1.9 -26,-2.6 -2,-0.3 -25,-1.9 -0.999 11.3 170.4-136.6 135.4 13.1 17.9 -10.5 36 46 A A E - c 0 58A 5 21,-2.4 23,-1.7 -2,-0.4 42,-0.1 -0.933 38.0-126.6-142.1 159.6 11.4 15.2 -12.4 37 47 A G - 0 0 41 -2,-0.3 23,-1.8 21,-0.2 26,-0.2 0.876 50.4-111.6 -76.1 -41.0 12.1 12.8 -15.4 38 48 A G S S+ 0 0 19 21,-0.2 3,-0.3 25,-0.1 20,-0.0 0.488 88.6 106.0 117.7 11.8 9.0 13.6 -17.4 39 49 A A S S+ 0 0 84 1,-0.2 2,-0.3 2,-0.1 3,-0.2 0.729 84.8 40.5 -90.0 -26.3 7.1 10.3 -17.2 40 50 A H > + 0 0 96 1,-0.1 4,-1.7 2,-0.1 3,-0.5 -0.569 63.4 154.8-124.2 66.5 4.4 11.6 -14.7 41 51 A L H > + 0 0 24 -3,-0.3 4,-2.2 -2,-0.3 5,-0.2 0.778 69.9 65.8 -66.0 -28.7 3.6 15.0 -16.0 42 52 A D H > S+ 0 0 103 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.918 106.0 42.5 -55.9 -46.6 0.1 14.8 -14.4 43 53 A T H > S+ 0 0 16 -3,-0.5 4,-2.5 2,-0.2 -2,-0.2 0.906 111.1 54.3 -67.9 -45.0 1.7 14.7 -10.9 44 54 A L H X S+ 0 0 2 -4,-1.7 4,-2.6 1,-0.2 -2,-0.2 0.912 106.7 51.5 -59.3 -45.9 4.3 17.4 -11.6 45 55 A L H X S+ 0 0 79 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.899 111.7 47.5 -55.4 -44.8 1.7 19.9 -12.7 46 56 A R H X S+ 0 0 119 -4,-1.4 4,-2.7 2,-0.2 -2,-0.2 0.884 110.4 52.5 -63.9 -40.4 -0.3 19.3 -9.5 47 57 A Q H X S+ 0 0 8 -4,-2.5 4,-2.6 2,-0.2 6,-0.4 0.892 108.3 50.5 -63.6 -42.6 2.9 19.7 -7.4 48 58 A R H X S+ 0 0 45 -4,-2.6 4,-2.1 1,-0.2 5,-0.2 0.937 114.1 45.1 -58.4 -47.4 3.6 23.0 -9.1 49 59 A A H < S+ 0 0 84 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.886 117.1 43.7 -64.9 -41.8 0.1 24.2 -8.3 50 60 A Q H < S+ 0 0 148 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.893 124.5 31.7 -75.2 -41.1 0.1 22.9 -4.7 51 61 A T H < S- 0 0 55 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.745 95.0-133.2 -86.9 -28.3 3.6 24.1 -3.6 52 62 A G < + 0 0 54 -4,-2.1 2,-0.6 -5,-0.4 -3,-0.1 0.576 54.7 148.4 80.7 10.4 3.7 27.2 -5.8 53 63 A V + 0 0 11 -6,-0.4 -1,-0.3 -5,-0.2 -2,-0.1 -0.701 20.9 166.8 -82.8 117.6 7.2 26.2 -6.9 54 64 A T + 0 0 84 -2,-0.6 2,-1.9 -3,-0.1 -1,-0.2 0.558 54.1 99.0-101.5 -15.6 8.0 27.3 -10.4 55 65 A N + 0 0 40 15,-0.1 -21,-1.8 16,-0.1 2,-0.3 -0.534 60.3 150.4 -71.3 79.2 11.7 26.5 -9.9 56 66 A I E -c 34 0A 0 -2,-1.9 16,-1.1 -23,-0.2 2,-0.4 -0.863 38.6-152.7-123.3 148.4 11.5 23.1 -11.7 57 67 A A E -cd 35 72A 2 -23,-2.2 -21,-2.4 -2,-0.3 2,-0.4 -0.976 9.3-170.3-119.7 135.7 13.8 20.9 -13.7 58 68 A V E -cd 36 73A 0 14,-2.8 16,-1.6 -2,-0.4 -21,-0.2 -0.991 12.6-155.9-128.6 124.6 12.6 18.4 -16.4 59 69 A A S S+ 0 0 41 -23,-1.7 15,-0.4 -2,-0.4 2,-0.3 0.957 76.8 66.8 -63.1 -56.6 15.0 15.8 -18.0 60 70 A D S > S- 0 0 86 -23,-1.8 4,-2.1 1,-0.1 5,-0.1 -0.536 70.5-149.5 -73.5 129.0 13.2 15.1 -21.3 61 71 A E H > S+ 0 0 102 -2,-0.3 4,-0.9 2,-0.2 -1,-0.1 0.752 98.9 53.7 -68.0 -27.9 13.1 18.1 -23.6 62 72 A H H >> S+ 0 0 105 2,-0.2 4,-1.8 1,-0.1 3,-0.7 0.961 109.9 45.6 -66.5 -55.8 9.7 16.9 -25.0 63 73 A A H 3> S+ 0 0 2 1,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.842 110.2 54.9 -58.7 -37.3 8.1 16.8 -21.5 64 74 A A H 3X S+ 0 0 8 -4,-2.1 4,-1.6 2,-0.2 6,-0.4 0.794 105.2 54.1 -66.5 -29.6 9.6 20.2 -20.6 65 75 A Q H << S+ 0 0 140 -4,-0.9 -2,-0.2 -3,-0.7 -1,-0.2 0.933 110.5 45.6 -69.2 -46.5 7.9 21.6 -23.7 66 76 A R H < S+ 0 0 159 -4,-1.8 -2,-0.2 1,-0.2 -3,-0.1 0.946 110.5 52.3 -60.7 -53.0 4.5 20.3 -22.7 67 77 A V H < S- 0 0 15 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.911 103.5-142.8 -53.4 -48.8 4.7 21.4 -19.1 68 78 A G < + 0 0 25 -4,-1.6 -2,-0.1 -5,-0.2 -3,-0.1 0.241 64.0 28.3 90.2 148.6 5.6 25.0 -20.0 69 79 A D + 0 0 132 1,-0.2 -4,-0.1 -4,-0.1 -5,-0.0 0.767 69.8 164.5 24.5 50.6 7.9 27.7 -18.6 70 80 A I - 0 0 14 -6,-0.4 -1,-0.2 1,-0.1 -15,-0.1 -0.795 29.0-154.9 -83.8 112.7 10.3 25.1 -17.1 71 81 A P S S+ 0 0 63 0, 0.0 2,-0.4 0, 0.0 -14,-0.1 0.653 79.2 43.9 -68.1 -15.6 13.5 27.0 -16.3 72 82 A Y E +d 57 0A 25 -16,-1.1 -14,-2.8 -8,-0.0 2,-0.3 -0.956 67.0 162.7-136.1 119.4 15.7 23.8 -16.6 73 83 A H E +d 58 0A 81 -2,-0.4 -14,-0.2 -16,-0.2 2,-0.2 -0.988 36.1 44.3-140.3 142.6 15.4 21.2 -19.3 74 84 A G S > S- 0 0 8 -16,-1.6 3,-1.0 -15,-0.4 4,-0.3 -0.621 99.1 -56.5 114.1 179.9 17.7 18.5 -20.6 75 85 A S T 3 S+ 0 0 124 1,-0.2 4,-0.2 -2,-0.2 3,-0.1 0.641 134.9 48.1 -76.8 -13.6 19.9 15.8 -19.0 76 86 A D T 3> S+ 0 0 79 -3,-0.2 4,-2.6 -17,-0.1 -1,-0.2 0.351 82.8 101.1-102.1 4.0 21.9 18.4 -16.9 77 87 A A H <> S+ 0 0 1 -3,-1.0 4,-2.6 2,-0.2 5,-0.2 0.892 81.1 47.0 -54.8 -49.6 18.7 20.2 -15.7 78 88 A A H > S+ 0 0 18 -4,-0.3 4,-1.8 1,-0.2 -1,-0.2 0.909 113.5 49.2 -62.5 -43.7 18.6 18.6 -12.2 79 89 A T H > S+ 0 0 20 -4,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.899 113.7 46.0 -60.6 -44.0 22.3 19.3 -11.7 80 90 A R H X S+ 0 0 65 -4,-2.6 4,-1.0 2,-0.2 -2,-0.2 0.846 108.4 56.1 -70.3 -37.0 21.9 22.9 -12.8 81 91 A L H X S+ 0 0 0 -4,-2.6 4,-1.1 -5,-0.2 3,-0.3 0.884 110.0 46.3 -57.6 -42.3 18.8 23.4 -10.6 82 92 A V H < S+ 0 0 2 -4,-1.8 3,-0.5 1,-0.2 -2,-0.2 0.927 108.8 54.4 -68.7 -46.4 20.9 22.3 -7.6 83 93 A E H < S+ 0 0 112 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.722 117.9 36.8 -56.7 -24.0 23.9 24.5 -8.4 84 94 A Q H < S+ 0 0 124 -4,-1.0 2,-0.6 -3,-0.3 -1,-0.2 0.525 95.7 87.3-115.9 -8.2 21.6 27.6 -8.6 85 95 A T S < S- 0 0 22 -4,-1.1 2,-0.4 -3,-0.5 -79,-0.1 -0.857 71.0-134.0 -98.1 120.3 19.0 27.1 -5.8 86 96 A E + 0 0 152 -2,-0.6 2,-0.3 -54,-0.1 -3,-0.1 -0.598 47.4 152.6 -65.6 122.1 19.8 28.4 -2.3 87 97 A A - 0 0 21 -2,-0.4 -82,-0.2 22,-0.1 3,-0.1 -0.968 49.8-147.9-152.8 159.7 18.7 25.5 -0.1 88 98 A D S S+ 0 0 57 -84,-2.7 24,-2.6 1,-0.3 2,-0.4 0.735 89.2 25.2-100.5 -31.5 19.4 23.8 3.3 89 99 A V E -be 5 112A 1 -85,-2.3 -83,-2.3 22,-0.2 2,-0.5 -0.995 61.2-159.4-139.1 134.5 18.6 20.2 2.3 90 100 A V E -be 6 113A 3 22,-2.9 24,-2.1 -2,-0.4 2,-0.8 -0.974 9.0-156.2-115.9 115.2 18.7 18.4 -1.1 91 101 A L E -be 7 114A 0 -85,-3.0 -83,-3.1 -2,-0.5 2,-1.0 -0.822 7.2-163.4 -89.0 109.2 16.6 15.2 -1.3 92 102 A N E +be 8 115A 0 22,-2.2 24,-2.4 -2,-0.8 25,-2.0 -0.818 29.6 149.6 -97.0 99.5 18.1 13.1 -4.1 93 103 A A + 0 0 16 -85,-2.4 -78,-0.2 -2,-1.0 -79,-0.2 -0.009 28.1 134.1-115.5 24.7 15.5 10.5 -5.0 94 104 A L - 0 0 22 5,-0.1 2,-0.4 1,-0.1 5,-0.1 -0.327 55.6-114.4 -70.9 158.7 16.5 10.2 -8.6 95 105 A V > - 0 0 115 22,-0.1 3,-0.9 23,-0.1 4,-0.1 -0.790 60.7 -29.9-101.4 137.5 16.8 6.7 -10.2 96 106 A G G > S- 0 0 18 -2,-0.4 3,-1.7 1,-0.2 4,-0.2 -0.138 116.5 -12.7 67.5-150.6 20.0 5.1 -11.4 97 107 A A G > S+ 0 0 45 1,-0.3 3,-0.9 2,-0.2 4,-0.4 0.583 119.0 78.1 -69.1 -13.3 23.1 6.9 -12.9 98 108 A L G < S+ 0 0 118 -3,-0.9 -1,-0.3 1,-0.2 -2,-0.2 0.688 86.0 63.4 -63.1 -23.2 21.1 10.2 -13.3 99 109 A G G <> S+ 0 0 0 -3,-1.7 4,-2.0 1,-0.2 -1,-0.2 0.681 83.1 77.8 -79.2 -18.8 21.6 10.8 -9.5 100 110 A L H <> S+ 0 0 4 -3,-0.9 4,-1.9 2,-0.2 -1,-0.2 0.911 94.2 41.4 -64.1 -53.6 25.4 11.0 -9.5 101 111 A R H > S+ 0 0 125 -4,-0.4 4,-3.0 2,-0.2 5,-0.2 0.919 115.2 50.8 -66.3 -44.1 26.1 14.6 -10.8 102 112 A P H > S+ 0 0 3 0, 0.0 4,-2.9 0, 0.0 -1,-0.2 0.899 108.6 54.6 -57.3 -38.6 23.2 16.1 -8.8 103 113 A T H X S+ 0 0 0 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.921 112.2 42.4 -56.3 -46.1 24.6 14.4 -5.7 104 114 A L H X S+ 0 0 11 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.873 113.3 52.2 -72.4 -38.6 28.0 16.0 -6.3 105 115 A A H X S+ 0 0 8 -4,-3.0 4,-0.6 2,-0.2 -2,-0.2 0.947 109.9 50.2 -54.9 -51.1 26.4 19.4 -7.2 106 116 A A H ><>S+ 0 0 0 -4,-2.9 5,-0.8 1,-0.2 3,-0.8 0.878 110.5 48.0 -58.2 -44.4 24.5 19.2 -3.9 107 117 A L H ><5S+ 0 0 5 -4,-1.9 3,-1.1 1,-0.2 -1,-0.2 0.854 106.4 57.2 -66.5 -36.8 27.6 18.4 -1.8 108 118 A K H 3<5S+ 0 0 155 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.613 102.6 57.8 -68.5 -12.8 29.6 21.3 -3.4 109 119 A T T <<5S- 0 0 69 -3,-0.8 -1,-0.2 -4,-0.6 -2,-0.2 0.571 109.8-121.4 -91.6 -12.8 26.8 23.7 -2.2 110 120 A G T < 5 + 0 0 31 -3,-1.1 -3,-0.1 -4,-0.4 -2,-0.1 0.299 66.4 135.3 88.0 -9.0 27.2 22.8 1.5 111 121 A A < - 0 0 7 -5,-0.8 -1,-0.3 1,-0.1 -22,-0.2 -0.269 66.2 -96.2 -65.9 155.6 23.6 21.6 1.8 112 122 A R E -e 89 0A 49 -24,-2.6 -22,-2.9 -3,-0.1 2,-0.7 -0.538 36.3-141.0 -63.4 137.0 22.6 18.5 3.7 113 123 A L E -ef 90 137A 0 23,-2.6 25,-2.7 -2,-0.2 2,-0.9 -0.922 9.1-161.4-106.7 105.9 22.2 15.7 1.2 114 124 A A E -ef 91 138A 0 -24,-2.1 -22,-2.2 -2,-0.7 2,-0.7 -0.802 25.3-149.8 -82.4 106.9 19.2 13.5 2.1 115 125 A L E +ef 92 139A 6 23,-2.2 25,-2.2 -2,-0.9 26,-0.6 -0.762 46.9 142.7-102.0 112.5 20.2 10.4 -0.0 116 126 A A + 0 0 16 -24,-2.4 2,-0.5 -2,-0.7 -23,-0.2 0.694 55.7 93.9-101.9 -37.1 17.8 8.0 -1.6 117 127 A N - 0 0 4 -25,-2.0 4,-0.5 1,-0.2 3,-0.2 -0.447 54.3-172.2 -58.9 108.3 19.8 7.4 -4.8 118 128 A K S >> S+ 0 0 36 -2,-0.5 4,-2.8 1,-0.2 3,-1.3 0.899 76.5 66.1 -72.0 -42.8 22.0 4.3 -4.1 119 129 A E H 3>>S+ 0 0 7 1,-0.3 4,-2.5 2,-0.2 5,-1.1 0.814 91.6 61.2 -46.3 -43.4 24.0 4.7 -7.3 120 130 A S H 345S+ 0 0 0 3,-0.2 -1,-0.3 -3,-0.2 8,-0.2 0.794 116.4 31.3 -67.0 -26.8 25.6 7.9 -6.3 121 131 A L H <>5S+ 0 0 1 -3,-1.3 4,-2.8 -4,-0.5 -2,-0.2 0.882 123.6 45.5 -87.6 -48.7 27.3 6.2 -3.3 122 132 A V H <5S+ 0 0 0 -4,-2.8 -3,-0.2 2,-0.2 191,-0.2 0.938 129.1 26.1 -61.0 -51.3 27.7 2.7 -4.7 123 133 A A T <5S+ 0 0 0 -4,-2.5 191,-0.3 -5,-0.2 -3,-0.2 0.896 124.9 50.7 -76.2 -43.5 29.1 3.9 -8.0 124 134 A G T >>X S+ 0 0 3 -4,-2.8 4,-1.9 1,-0.3 3,-0.7 -0.116 70.0 0.2 51.5-131.8 32.4 5.7 -3.8 126 136 A S H 3> S+ 0 0 24 184,-0.3 4,-2.5 1,-0.2 -1,-0.3 0.701 127.1 66.7 -64.7 -22.4 35.4 7.8 -2.5 127 137 A L H <> S+ 0 0 19 -3,-1.7 4,-0.7 2,-0.2 -1,-0.2 0.919 108.1 38.9 -63.2 -44.1 34.7 10.5 -5.2 128 138 A V H XX S+ 0 0 0 -3,-0.7 4,-0.6 -4,-0.5 3,-0.5 0.906 115.1 54.3 -68.8 -42.2 31.4 11.3 -3.4 129 139 A L H >< S+ 0 0 70 -4,-1.9 3,-0.9 1,-0.2 -2,-0.2 0.856 104.3 53.3 -62.3 -40.0 32.9 10.8 0.1 130 140 A R H 3< S+ 0 0 148 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.761 107.0 53.8 -65.8 -26.9 35.8 13.4 -0.6 131 141 A A H << S+ 0 0 30 -4,-0.7 2,-0.3 -3,-0.5 -1,-0.2 0.580 99.5 79.9 -81.9 -12.9 33.1 16.0 -1.6 132 142 A A << - 0 0 25 -3,-0.9 3,-0.1 -4,-0.6 -24,-0.0 -0.730 69.8-138.4-102.1 144.0 31.2 15.6 1.7 133 143 A R > - 0 0 126 -2,-0.3 3,-2.3 1,-0.1 4,-0.5 -0.569 53.1 -70.0 -85.3 160.4 31.8 17.0 5.1 134 144 A P T 3 S+ 0 0 132 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.325 122.7 5.0 -51.6 125.3 31.2 14.8 8.2 135 145 A G T 3 S+ 0 0 64 84,-0.2 84,-0.0 2,-0.1 -3,-0.0 0.589 93.6 117.9 73.2 13.5 27.5 14.1 8.6 136 146 A Q < + 0 0 4 -3,-2.3 -23,-2.6 1,-0.1 2,-0.7 0.880 64.5 65.8 -76.2 -39.5 26.5 15.9 5.3 137 147 A I E -f 113 0A 23 -4,-0.5 -23,-0.2 -25,-0.2 -2,-0.1 -0.777 68.2-175.2 -85.3 116.3 25.1 12.8 3.8 138 148 A V E -f 114 0A 8 -25,-2.7 -23,-2.2 -2,-0.7 2,-0.1 -0.968 24.0-123.4-115.3 121.0 22.0 11.6 5.7 139 149 A P E -f 115 0A 15 0, 0.0 -23,-0.2 0, 0.0 -25,-0.1 -0.363 20.1-170.3 -73.9 141.9 20.4 8.3 4.6 140 150 A V + 0 0 0 -25,-2.2 -24,-0.2 -2,-0.1 124,-0.1 0.752 56.1 99.6 -99.0 -32.4 16.8 7.9 3.5 141 151 A N S > S- 0 0 21 -26,-0.6 4,-2.2 1,-0.1 5,-0.2 -0.249 80.2-120.0 -55.4 144.5 16.5 4.1 3.3 142 152 A S H > S+ 0 0 6 1,-0.2 4,-1.8 2,-0.2 96,-0.1 0.828 109.3 51.5 -52.4 -40.9 14.8 2.4 6.2 143 153 A E H > S+ 0 0 9 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.911 112.6 41.8 -69.7 -46.3 17.9 0.3 7.0 144 154 A H H > S+ 0 0 1 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.836 112.7 54.5 -73.6 -33.8 20.5 3.1 7.1 145 155 A S H X S+ 0 0 5 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.884 108.6 50.0 -63.8 -41.2 18.1 5.3 9.0 146 156 A A H X S+ 0 0 0 -4,-1.8 4,-2.8 -5,-0.2 -2,-0.2 0.902 110.2 50.3 -62.0 -43.7 17.7 2.6 11.7 147 157 A L H X S+ 0 0 0 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.908 107.9 52.3 -61.7 -46.1 21.5 2.2 11.9 148 158 A A H < S+ 0 0 16 -4,-2.3 4,-0.3 2,-0.2 -1,-0.2 0.885 113.8 44.2 -56.2 -43.8 22.0 6.0 12.4 149 159 A Q H >< S+ 0 0 1 -4,-1.8 3,-1.4 1,-0.2 -2,-0.2 0.934 113.8 49.4 -67.0 -47.9 19.5 5.9 15.2 150 160 A C H >< S+ 0 0 0 -4,-2.8 3,-2.3 1,-0.3 -2,-0.2 0.811 97.7 68.1 -63.5 -33.2 20.9 2.7 16.8 151 161 A L G >< S+ 0 0 43 -4,-2.5 3,-1.2 1,-0.3 -1,-0.3 0.658 84.1 73.7 -61.3 -16.1 24.4 4.1 16.7 152 162 A R G < S+ 0 0 66 -3,-1.4 -1,-0.3 -4,-0.3 -2,-0.2 0.639 75.5 83.7 -69.7 -14.7 23.3 6.6 19.4 153 163 A G G < S- 0 0 2 -3,-2.3 2,-0.3 -4,-0.2 -1,-0.2 0.597 106.9 -11.6 -64.2 -14.8 23.4 3.6 21.8 154 164 A G S < S- 0 0 19 -3,-1.2 495,-0.1 -4,-0.1 5,-0.0 -0.966 82.7 -70.9-165.1-178.1 27.1 4.2 22.3 155 165 A T > - 0 0 65 -2,-0.3 3,-2.0 1,-0.1 4,-0.3 -0.490 54.1-102.8 -80.2 158.2 30.4 5.9 21.3 156 166 A P G > S+ 0 0 117 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.836 120.9 57.0 -50.7 -40.2 32.1 4.8 18.0 157 167 A D G 3 S+ 0 0 116 1,-0.3 87,-0.0 87,-0.0 -2,-0.0 0.574 99.5 63.1 -68.0 -9.2 34.7 2.7 19.7 158 168 A E G < S+ 0 0 4 -3,-2.0 86,-2.4 85,-0.1 2,-0.5 0.469 76.9 109.5 -95.1 -3.7 31.9 0.7 21.3 159 169 A V E < +G 243 0B 10 -3,-1.5 84,-0.2 -4,-0.3 3,-0.1 -0.630 31.7 164.5 -79.4 121.3 30.6 -0.6 18.0 160 170 A A E - 0 0 28 82,-2.3 2,-0.3 -2,-0.5 83,-0.2 0.848 65.8 -3.8 -93.2 -55.8 31.1 -4.3 17.4 161 171 A K E -G 242 0B 67 81,-1.8 81,-3.1 66,-0.0 2,-0.4 -1.000 50.7-143.4-145.4 139.2 28.7 -5.1 14.5 162 172 A L E -Gh 241 227B 0 64,-2.4 66,-3.1 -2,-0.3 2,-0.6 -0.891 23.4-155.8 -95.0 133.5 26.1 -3.4 12.4 163 173 A V E -Gh 240 228B 4 77,-3.3 77,-2.4 -2,-0.4 2,-0.4 -0.926 4.6-163.0-117.1 107.9 23.2 -5.8 11.5 164 174 A L E -Gh 239 229B 0 64,-3.1 66,-2.4 -2,-0.6 2,-0.3 -0.751 13.6-138.8 -88.6 134.5 21.2 -5.1 8.4 165 175 A T E - 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s 0 438D 4 21,-2.3 23,-2.0 -2,-0.4 24,-0.2 -0.928 38.0-119.9-140.1 165.3 26.6 -7.1 54.4 417 47 B G - 0 0 39 -2,-0.3 23,-0.6 21,-0.2 26,-0.2 0.785 51.4-107.6 -76.5 -32.4 23.7 -7.9 56.7 418 48 B G S > S+ 0 0 12 21,-0.2 3,-1.0 25,-0.1 4,-0.1 0.042 97.7 92.5 124.8 -28.6 25.2 -10.6 58.9 419 49 B A T 3 S+ 0 0 93 1,-0.3 3,-0.2 2,-0.1 -3,-0.0 0.773 96.7 37.3 -70.8 -28.1 23.5 -13.8 57.8 420 50 B H T 3> S+ 0 0 110 1,-0.1 4,-1.9 2,-0.1 3,-0.4 -0.291 74.9 141.2-118.4 47.5 26.3 -14.6 55.3 421 51 B L H <> + 0 0 9 -3,-1.0 4,-2.2 1,-0.2 5,-0.2 0.812 68.5 57.2 -57.5 -36.7 29.2 -13.3 57.5 422 52 B D H > S+ 0 0 104 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.876 106.2 49.8 -68.2 -38.3 31.5 -16.1 56.5 423 53 B T H > S+ 0 0 60 -3,-0.4 4,-2.3 2,-0.2 -2,-0.2 0.920 110.1 51.5 -58.6 -47.6 31.1 -15.1 52.8 424 54 B L H X S+ 0 0 0 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.888 110.1 48.2 -58.9 -42.1 31.9 -11.5 53.7 425 55 B L H X S+ 0 0 46 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.799 110.2 51.5 -70.6 -31.2 35.1 -12.5 55.6 426 56 B R H X S+ 0 0 162 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.860 108.8 52.2 -69.0 -37.0 36.1 -14.7 52.6 427 57 B Q H X S+ 0 0 11 -4,-2.3 4,-2.4 2,-0.2 6,-0.5 0.874 108.2 50.5 -64.2 -40.5 35.5 -11.6 50.4 428 58 B R H X S+ 0 0 44 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.935 112.0 48.2 -58.2 -46.6 37.8 -9.6 52.8 429 59 B A H < S+ 0 0 84 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.880 117.3 41.3 -61.9 -39.8 40.4 -12.3 52.5 430 60 B Q H < S+ 0 0 149 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.853 122.6 34.5 -79.3 -42.5 40.2 -12.4 48.6 431 61 B T H < S- 0 0 61 -4,-2.4 -2,-0.2 -5,-0.1 -3,-0.2 0.695 96.4-129.8 -87.8 -24.0 40.0 -8.8 47.7 432 62 B G < + 0 0 58 -4,-1.8 2,-0.7 -5,-0.4 -4,-0.1 0.548 57.6 146.8 79.0 9.4 42.2 -7.4 50.5 433 63 B V + 0 0 18 -6,-0.5 -1,-0.3 -5,-0.2 -2,-0.1 -0.714 22.1 172.8 -83.5 113.3 39.5 -4.9 51.3 434 64 B T + 0 0 104 -2,-0.7 2,-1.8 -3,-0.1 -1,-0.2 0.546 56.3 95.8 -93.9 -14.6 39.5 -4.3 55.1 435 65 B N + 0 0 34 15,-0.1 -21,-1.8 -23,-0.1 2,-0.3 -0.582 60.5 144.7 -81.1 80.7 36.9 -1.5 54.8 436 66 B I E -s 414 0D 0 -2,-1.8 16,-1.4 -23,-0.2 2,-0.4 -0.872 36.5-152.5-125.6 153.2 33.9 -3.6 55.6 437 67 B A E -st 415 452D 0 -23,-2.6 -21,-2.3 -2,-0.3 2,-0.4 -0.978 3.7-167.6-127.4 140.2 30.5 -3.2 57.4 438 68 B V E -st 416 453D 0 14,-2.2 16,-1.9 -2,-0.4 -21,-0.2 -0.986 7.8-161.0-124.8 118.3 28.2 -5.7 59.2 439 69 B A S S+ 0 0 42 -23,-2.0 2,-0.9 -2,-0.4 -21,-0.2 0.767 74.2 78.4 -68.5 -26.9 24.7 -4.5 60.1 440 70 B D > - 0 0 75 -23,-0.6 4,-2.2 -24,-0.2 5,-0.2 -0.755 58.2-170.7 -95.0 102.9 24.1 -7.2 62.7 441 71 B E H > S+ 0 0 84 -2,-0.9 4,-0.8 1,-0.2 -1,-0.2 0.842 90.4 54.3 -55.1 -38.6 25.9 -6.4 65.9 442 72 B H H 4 S+ 0 0 145 1,-0.2 3,-0.5 2,-0.2 -1,-0.2 0.890 111.1 44.1 -64.1 -42.5 25.1 -9.9 67.2 443 73 B A H >4 S+ 0 0 11 1,-0.2 3,-1.4 -26,-0.2 -2,-0.2 0.805 107.0 62.1 -67.6 -32.2 26.7 -11.4 64.1 444 74 B A H >X S+ 0 0 9 -4,-2.2 3,-1.6 1,-0.3 4,-1.2 0.682 83.6 77.7 -69.3 -20.3 29.6 -8.9 64.5 445 75 B Q T 3< S+ 0 0 137 -4,-0.8 -1,-0.3 -3,-0.5 -2,-0.2 0.690 87.1 64.1 -56.0 -20.6 30.4 -10.5 68.0 446 76 B R T <4 S+ 0 0 193 -3,-1.4 -1,-0.2 -4,-0.1 -2,-0.2 0.584 106.0 37.4 -82.5 -11.7 32.1 -13.3 65.9 447 77 B V T <4 - 0 0 31 -3,-1.6 -2,-0.2 -4,-0.1 -1,-0.1 0.817 67.5-161.7-118.0 -43.4 34.8 -11.2 64.3 448 78 B G S < S+ 0 0 79 -4,-1.2 -3,-0.1 1,-0.1 -4,-0.0 0.271 77.6 67.7 77.4 -14.1 36.4 -8.5 66.5 449 79 B D + 0 0 99 -5,-0.1 -1,-0.1 3,-0.0 3,-0.1 0.013 59.0 126.4-129.3 33.4 38.0 -6.5 63.7 450 80 B I - 0 0 12 -6,-0.2 3,-0.1 1,-0.1 -13,-0.1 -0.810 46.6-154.5 -89.9 119.6 35.1 -4.9 61.7 451 81 B P S S+ 0 0 67 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.875 85.0 35.4 -62.0 -36.4 35.5 -1.1 61.4 452 82 B Y E S+t 437 0D 30 -16,-1.4 -14,-2.2 -3,-0.1 2,-0.3 -0.969 74.5 153.3-123.2 119.9 31.7 -0.7 61.0 453 83 B H E +t 438 0D 71 -2,-0.5 -14,-0.2 -16,-0.2 2,-0.2 -0.990 34.6 33.3-143.8 152.4 29.1 -2.8 62.9 454 84 B G S > S- 0 0 3 -16,-1.9 3,-1.7 -2,-0.3 4,-0.3 -0.490 99.8 -13.3 101.7-174.1 25.6 -2.6 64.1 455 85 B S T 3 S+ 0 0 103 1,-0.3 -2,-0.1 -2,-0.2 -15,-0.1 -0.422 134.9 14.2 -65.9 132.9 22.5 -0.7 62.9 456 86 B D T 3> S+ 0 0 65 -2,-0.1 4,-2.1 22,-0.1 -1,-0.3 0.695 81.8 133.7 68.2 24.4 23.5 1.8 60.2 457 87 B A H <> S+ 0 0 0 -3,-1.7 4,-2.2 2,-0.2 5,-0.1 0.891 74.5 50.2 -62.6 -43.3 27.0 0.3 59.7 458 88 B A H > S+ 0 0 13 -4,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.874 109.7 50.8 -63.8 -40.5 26.5 0.4 55.9 459 89 B T H > S+ 0 0 12 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.922 111.1 48.1 -62.0 -45.5 25.4 4.1 56.1 460 90 B R H X S+ 0 0 83 -4,-2.1 4,-1.5 2,-0.2 -2,-0.2 0.868 110.2 51.8 -65.0 -37.8 28.5 5.0 58.2 461 91 B L H X S+ 0 0 0 -4,-2.2 4,-1.0 2,-0.2 3,-0.3 0.943 110.9 47.9 -62.3 -47.1 30.7 3.1 55.7 462 92 B V H >< S+ 0 0 3 -4,-2.3 3,-0.6 1,-0.2 -2,-0.2 0.919 111.7 51.2 -56.5 -45.5 29.2 5.1 52.9 463 93 B E H 3< S+ 0 0 116 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.788 117.8 37.4 -61.1 -32.2 29.6 8.4 54.8 464 94 B Q H 3< S+ 0 0 125 -4,-1.5 2,-0.5 -3,-0.3 -1,-0.2 0.383 98.3 86.5-109.4 2.1 33.3 7.7 55.5 465 95 B T << - 0 0 22 -4,-1.0 2,-0.5 -3,-0.6 -79,-0.1 -0.907 69.2-133.1-112.1 128.6 34.6 6.1 52.3 466 96 B E + 0 0 152 -2,-0.5 2,-0.3 -54,-0.1 -3,-0.0 -0.679 46.9 147.7 -74.2 122.1 35.9 8.0 49.3 467 97 B A - 0 0 21 -2,-0.5 -82,-0.2 -5,-0.1 3,-0.1 -0.942 50.3-146.4-149.8 166.4 34.3 6.4 46.2 468 98 B D S S+ 0 0 50 -84,-2.8 24,-2.7 1,-0.3 2,-0.4 0.690 90.1 28.3-103.0 -33.9 33.1 7.2 42.7 469 99 B V E -ru 385 492D 4 -85,-2.4 -83,-2.6 22,-0.2 2,-0.6 -0.997 60.2-159.1-133.5 133.6 30.2 4.7 42.7 470 100 B V E -ru 386 493D 3 22,-3.0 24,-1.7 -2,-0.4 2,-0.9 -0.963 11.1-157.1-108.2 113.8 28.0 3.2 45.4 471 101 B L E -ru 387 494D 0 -85,-3.3 -83,-3.2 -2,-0.6 2,-1.0 -0.834 6.9-163.5 -88.1 108.9 26.3 -0.1 44.4 472 102 B N E +ru 388 495D 0 22,-2.3 24,-2.6 -2,-0.9 25,-1.7 -0.812 30.3 148.7 -94.5 97.3 23.3 -0.4 46.7 473 103 B A + 0 0 19 -85,-2.8 -78,-0.2 -2,-1.0 -79,-0.2 0.018 27.8 132.4-115.3 24.0 22.2 -4.1 46.4 474 104 B L - 0 0 14 5,-0.1 2,-0.4 1,-0.1 5,-0.1 -0.368 56.2-117.1 -70.0 154.8 20.9 -4.3 50.0 475 105 B V > - 0 0 124 22,-0.1 3,-0.7 -2,-0.1 22,-0.1 -0.811 59.1 -28.0-103.1 135.3 17.4 -5.9 50.4 476 106 B G G > S- 0 0 26 -2,-0.4 3,-1.7 1,-0.2 4,-0.3 -0.223 113.7 -10.2 73.0-150.2 14.3 -4.2 51.8 477 107 B A G > S+ 0 0 48 1,-0.3 3,-1.2 2,-0.2 4,-0.5 0.707 121.3 68.9 -62.5 -28.7 14.0 -1.3 54.2 478 108 B L G < S+ 0 0 101 -3,-0.7 -1,-0.3 1,-0.2 -2,-0.1 0.489 89.9 65.9 -74.8 -2.9 17.7 -1.2 55.2 479 109 B G G <> S+ 0 0 0 -3,-1.7 4,-1.6 2,-0.1 -1,-0.2 0.706 85.8 73.4 -83.9 -23.0 18.6 -0.0 51.7 480 110 B L H <> S+ 0 0 4 -3,-1.2 4,-1.9 -4,-0.3 -2,-0.1 0.898 94.6 44.2 -65.1 -51.3 16.9 3.4 52.1 481 111 B R H > S+ 0 0 111 -4,-0.5 4,-2.5 1,-0.2 5,-0.2 0.925 113.0 52.0 -62.4 -47.3 19.2 5.3 54.5 482 112 B P H > S+ 0 0 5 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.829 107.2 54.1 -56.8 -34.4 22.4 4.1 52.6 483 113 B T H X S+ 0 0 0 -4,-1.6 4,-2.6 2,-0.2 -2,-0.2 0.962 110.8 46.1 -59.8 -50.7 20.8 5.4 49.4 484 114 B L H X S+ 0 0 39 -4,-1.9 4,-1.8 1,-0.2 -1,-0.2 0.886 114.3 46.8 -58.6 -43.5 20.3 8.8 51.0 485 115 B A H X S+ 0 0 10 -4,-2.5 4,-1.3 2,-0.2 -1,-0.2 0.862 111.6 52.0 -67.7 -38.4 23.8 8.9 52.5 486 116 B A H X>S+ 0 0 0 -4,-2.2 5,-0.9 -5,-0.2 4,-0.7 0.916 108.2 50.0 -64.1 -46.2 25.3 7.9 49.1 487 117 B L H ><5S+ 0 0 4 -4,-2.6 3,-1.0 1,-0.2 -2,-0.2 0.899 107.4 56.5 -59.0 -39.6 23.4 10.6 47.2 488 118 B K H 3<5S+ 0 0 192 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.820 99.8 57.3 -63.2 -33.2 24.7 13.1 49.8 489 119 B T H 3<5S- 0 0 71 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.2 0.730 110.5-123.5 -67.7 -21.4 28.4 12.2 49.1 490 120 B G T <<5 + 0 0 32 -3,-1.0 -3,-0.1 -4,-0.7 -2,-0.1 0.448 64.3 138.6 87.9 2.9 27.8 13.1 45.5 491 121 B A < - 0 0 10 -5,-0.9 2,-0.3 1,-0.1 -1,-0.3 -0.265 64.7 -92.4 -69.1 161.6 28.9 9.7 44.2 492 122 B R E -u 469 0D 84 -24,-2.7 -22,-3.0 -3,-0.1 2,-0.7 -0.619 38.9-144.2 -68.3 135.7 27.1 7.8 41.4 493 123 B L E -uv 470 517D 0 23,-3.1 25,-2.6 -2,-0.3 2,-0.9 -0.903 9.6-163.4-111.0 103.6 24.5 5.5 42.9 494 124 B A E -uv 471 518D 0 -24,-1.7 -22,-2.3 -2,-0.7 2,-0.6 -0.777 25.5-152.0 -80.5 106.5 24.1 2.2 41.0 495 125 B L E +uv 472 519D 12 23,-2.1 25,-2.0 -2,-0.9 26,-0.5 -0.761 44.0 146.0-100.9 117.4 20.7 1.2 42.5 496 126 B A + 0 0 30 -24,-2.6 2,-0.4 -2,-0.6 -23,-0.2 0.631 50.7 100.8-110.2 -27.3 19.5 -2.3 42.9 497 127 B N - 0 0 5 -25,-1.7 4,-0.4 1,-0.2 3,-0.4 -0.459 55.4-163.8 -64.0 114.6 17.5 -1.8 46.1 498 128 B K S >> S+ 0 0 52 -2,-0.4 4,-2.4 1,-0.2 3,-0.9 0.836 81.4 64.6 -70.6 -36.9 13.8 -1.5 45.1 499 129 B E H 3>>S+ 0 0 18 1,-0.2 5,-2.5 3,-0.2 4,-1.7 0.777 87.9 71.6 -59.1 -29.8 12.6 0.1 48.4 500 130 B S H 345S+ 0 0 0 -3,-0.4 8,-0.3 3,-0.2 -1,-0.2 0.887 116.8 18.1 -56.5 -42.0 14.7 3.2 47.8 501 131 B L H <>5S+ 0 0 2 -3,-0.9 4,-1.1 -4,-0.4 -2,-0.2 0.863 127.6 49.7 -96.5 -44.5 12.3 4.4 45.0 502 132 B V H <5S+ 0 0 0 -4,-2.4 -3,-0.2 2,-0.1 -2,-0.2 0.890 132.6 15.2 -64.4 -43.0 9.2 2.3 45.6 503 133 B A T <5S+ 0 0 1 -4,-1.7 191,-0.3 -5,-0.3 -3,-0.2 0.864 130.5 48.2 -95.3 -48.3 8.9 3.2 49.3 504 134 B G T >> S+ 0 0 24 184,-0.3 4,-2.4 1,-0.2 -1,-0.3 0.734 122.0 63.9 -73.9 -25.5 10.1 11.8 46.9 507 137 B L H <> S+ 0 0 15 -3,-2.0 4,-0.6 2,-0.2 -1,-0.2 0.902 111.3 38.8 -57.2 -42.3 12.5 11.6 49.8 508 138 B V H X S+ 0 0 0 -4,-0.5 4,-1.2 -3,-0.4 3,-0.5 0.916 116.0 49.7 -77.6 -45.5 15.0 9.9 47.4 509 139 B L H < S+ 0 0 71 -4,-2.2 3,-0.4 1,-0.2 -2,-0.2 0.883 108.4 52.8 -62.8 -41.2 14.2 12.1 44.3 510 140 B R H < S+ 0 0 152 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.764 113.2 46.1 -63.5 -26.4 14.5 15.4 46.3 511 141 B A H < S+ 0 0 46 -4,-0.6 2,-0.3 -3,-0.5 -1,-0.2 0.649 100.2 83.6 -89.2 -19.9 17.9 14.2 47.4 512 142 B A < - 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0 0 110 -44,-0.2 2,-0.2 -43,-0.1 -1,-0.1 -0.535 37.2-114.5 -73.6 136.2 4.5 13.3 50.9 735 365 B P - 0 0 3 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.488 26.1-174.3 -73.8 141.1 7.0 11.8 53.3 736 366 B A S S+ 0 0 66 1,-0.2 2,-0.3 -2,-0.2 -2,-0.0 0.717 71.3 17.5 -98.5 -32.4 9.2 14.3 55.2 737 367 B T S > S- 0 0 71 1,-0.1 4,-1.2 0, 0.0 3,-0.5 -0.863 81.7-103.4-135.5 166.0 11.3 11.7 56.9 738 368 B V H > S+ 0 0 12 -2,-0.3 4,-2.1 1,-0.2 5,-0.1 0.840 119.0 60.8 -55.0 -37.1 12.3 8.0 56.7 739 369 B D H > S+ 0 0 85 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.838 96.2 58.3 -64.6 -37.0 9.9 7.4 59.7 740 370 B D H > S+ 0 0 52 -3,-0.5 4,-1.9 2,-0.2 -1,-0.2 0.937 108.9 46.0 -53.3 -50.2 6.9 8.6 57.7 741 371 B V H X S+ 0 0 0 -4,-1.2 4,-1.8 1,-0.2 -2,-0.2 0.905 112.6 50.2 -59.5 -44.3 7.6 5.9 55.1 742 372 B L H X S+ 0 0 47 -4,-2.1 4,-1.6 1,-0.2 -2,-0.2 0.836 107.9 54.1 -64.8 -35.5 8.1 3.3 57.9 743 373 B D H X S+ 0 0 65 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.881 107.8 49.7 -63.4 -41.9 4.8 4.4 59.4 744 374 B A H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.894 110.8 48.6 -65.1 -43.3 2.9 3.8 56.1 745 375 B Q H X S+ 0 0 8 -4,-1.8 4,-2.5 2,-0.2 -1,-0.2 0.859 110.0 53.1 -64.2 -37.8 4.4 0.3 55.6 746 376 B R H X S+ 0 0 124 -4,-1.6 4,-1.8 2,-0.2 -2,-0.2 0.904 110.7 45.9 -64.4 -45.5 3.5 -0.6 59.2 747 377 B W H X S+ 0 0 44 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.917 113.4 50.2 -62.2 -46.9 -0.2 0.5 58.6 748 378 B A H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.883 108.7 52.3 -60.6 -43.4 -0.3 -1.4 55.3 749 379 B R H X S+ 0 0 101 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.934 113.5 41.9 -58.6 -50.2 1.1 -4.6 56.8 750 380 B E H X S+ 0 0 76 -4,-1.8 4,-1.7 2,-0.2 -2,-0.2 0.822 113.0 53.4 -74.2 -29.5 -1.4 -4.8 59.6 751 381 B R H X S+ 0 0 111 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.905 112.2 45.5 -63.5 -44.6 -4.3 -3.8 57.3 752 382 B A H X S+ 0 0 0 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.876 109.6 56.2 -64.5 -38.5 -3.3 -6.6 55.0 753 383 B Q H X S+ 0 0 85 -4,-2.2 4,-2.2 2,-0.2 6,-0.3 0.875 107.0 48.7 -60.5 -39.5 -3.0 -8.9 58.0 754 384 B R H X>S+ 0 0 129 -4,-1.7 4,-2.3 2,-0.2 5,-1.2 0.911 109.8 51.5 -66.7 -44.2 -6.6 -8.1 59.0 755 385 B A H <5S+ 0 0 48 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.819 111.8 48.3 -62.7 -33.0 -7.8 -8.8 55.5 756 386 B V H <5S+ 0 0 24 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.936 118.6 37.0 -72.4 -49.0 -6.0 -12.2 55.5 757 387 B S H <5S- 0 0 75 -4,-2.2 -2,-0.2 -5,-0.1 -1,-0.2 0.712 104.5-123.9 -76.4 -23.2 -7.3 -13.4 58.9 758 388 B G T <5 0 0 71 -4,-2.3 -3,-0.2 -5,-0.2 -4,-0.1 0.637 360.0 360.0 83.1 17.9 -10.8 -11.8 58.5 759 389 B M < 0 0 157 -5,-1.2 -4,-0.2 -6,-0.3 -5,-0.1 0.400 360.0 360.0-100.2 360.0 -10.4 -9.9 61.7