==== 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 2JD1 . 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) . 29506.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 550 72.6 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 . 43 5.7 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 . 46 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 89 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 270 35.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 0.9 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 0 1 3 3 6 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 . 2 0 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 0 139 0, 0.0 2,-0.2 0, 0.0 26,-0.0 0.000 360.0 360.0 360.0 46.2 13.4 29.2 10.3 2 12 A R - 0 0 122 24,-0.1 2,-0.4 1,-0.1 27,-0.2 -0.527 360.0-104.2 -94.7 159.9 12.1 26.4 8.0 3 13 A L E -a 29 0A 48 25,-3.2 27,-2.5 -2,-0.2 2,-0.5 -0.705 21.7-137.8 -91.9 127.5 14.1 24.1 5.7 4 14 A R E -a 30 0A 74 -2,-0.4 84,-2.6 25,-0.2 85,-2.5 -0.714 25.4-161.5 -82.0 121.3 14.1 24.6 1.9 5 15 A V E -ab 31 89A 0 25,-3.6 27,-2.9 -2,-0.5 28,-1.0 -0.907 16.4-160.3-114.3 124.1 13.9 21.2 0.2 6 16 A V E -ab 33 90A 0 83,-2.7 85,-3.4 -2,-0.5 2,-0.6 -0.901 17.7-155.1 -93.6 127.0 14.8 20.3 -3.4 7 17 A V E > -ab 34 91A 0 26,-2.8 28,-2.2 -2,-0.5 3,-0.5 -0.911 7.0-166.7-109.7 111.6 13.0 17.0 -4.3 8 18 A L E 3 S+ab 35 92A 0 83,-3.3 85,-2.3 -2,-0.6 28,-0.2 -0.835 79.3 19.9 -98.1 129.3 14.7 14.9 -7.0 9 19 A G T > S+ 0 0 10 26,-1.9 3,-1.0 -2,-0.5 6,-0.7 0.899 78.0 166.3 76.5 46.3 12.5 12.1 -8.4 10 20 A S T < + 0 0 0 25,-2.2 9,-0.2 -3,-0.5 26,-0.1 0.695 65.4 56.0 -70.3 -22.7 9.3 13.8 -7.0 11 21 A T T 3 S+ 0 0 28 24,-0.3 -1,-0.2 4,-0.2 25,-0.1 0.556 93.4 85.0 -90.1 -11.0 6.8 11.7 -9.0 12 22 A G S <> S- 0 0 34 -3,-1.0 4,-2.4 81,-0.1 5,-0.2 -0.129 99.7 -84.5 -82.2-176.7 8.1 8.3 -7.7 13 23 A S H > S+ 0 0 47 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.926 127.8 38.0 -55.6 -52.9 7.2 6.5 -4.5 14 24 A I H > S+ 0 0 33 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.907 114.3 55.1 -68.8 -44.4 9.7 8.3 -2.2 15 25 A G H > S+ 0 0 0 -6,-0.7 4,-2.0 78,-0.2 -2,-0.2 0.904 111.0 44.6 -54.2 -45.9 9.2 11.7 -3.9 16 26 A T H X S+ 0 0 44 -4,-2.4 4,-1.7 2,-0.2 -1,-0.2 0.887 113.3 48.8 -69.8 -40.5 5.4 11.6 -3.3 17 27 A Q H X S+ 0 0 38 -4,-1.8 4,-2.1 -5,-0.2 -2,-0.2 0.884 111.3 52.8 -66.0 -36.6 5.7 10.4 0.3 18 28 A A H X S+ 0 0 0 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.897 106.8 51.2 -60.8 -45.2 8.3 13.2 0.9 19 29 A L H X S+ 0 0 20 -4,-2.0 4,-2.7 2,-0.2 -1,-0.2 0.853 109.1 51.6 -61.6 -35.6 5.9 15.8 -0.5 20 30 A Q H X S+ 0 0 99 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.907 108.6 50.0 -67.7 -42.6 3.2 14.6 1.8 21 31 A V H < S+ 0 0 5 -4,-2.1 4,-0.5 2,-0.2 -2,-0.2 0.910 113.9 46.3 -58.8 -43.8 5.6 14.8 4.8 22 32 A I H >< S+ 0 0 9 -4,-2.2 3,-0.9 2,-0.2 7,-0.3 0.911 111.5 50.5 -66.8 -44.0 6.4 18.4 3.7 23 33 A A H 3< S+ 0 0 71 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.874 110.5 50.3 -59.7 -40.2 2.8 19.3 3.2 24 34 A D T 3< S+ 0 0 115 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.586 117.3 42.1 -73.0 -11.7 1.9 18.0 6.7 25 35 A N X> + 0 0 23 -3,-0.9 4,-2.4 -4,-0.5 3,-1.7 -0.329 57.8 152.5-135.3 55.9 4.8 20.1 8.2 26 36 A P T 34 S+ 0 0 67 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.740 76.5 64.6 -60.8 -23.1 4.8 23.6 6.6 27 37 A D T 34 S+ 0 0 103 1,-0.1 3,-0.1 -3,-0.1 -2,-0.1 0.831 115.1 25.5 -59.5 -40.7 6.4 24.7 9.9 28 38 A R T <4 S+ 0 0 29 -3,-1.7 -25,-3.2 -6,-0.2 2,-0.3 0.763 123.5 37.8 -99.2 -35.7 9.5 22.7 9.4 29 39 A F E < -a 3 0A 1 -4,-2.4 2,-0.3 -7,-0.3 -25,-0.2 -0.904 47.8-173.9-131.2 151.8 9.8 22.2 5.6 30 40 A E E -a 4 0A 80 -27,-2.5 -25,-3.6 -2,-0.3 2,-0.4 -0.970 25.6-130.9-143.4 123.7 9.3 24.0 2.2 31 41 A V E +a 5 0A 18 -2,-0.3 -25,-0.2 -27,-0.2 3,-0.1 -0.629 31.7 165.4 -71.1 126.3 9.6 22.5 -1.3 32 42 A V E + 0 0 26 -27,-2.9 2,-0.3 -2,-0.4 -26,-0.2 0.356 61.7 22.0-121.1 0.9 11.8 24.8 -3.5 33 43 A G E -a 6 0A 0 -28,-1.0 -26,-2.8 20,-0.1 2,-0.4 -0.956 54.6-163.3-167.8 147.5 12.5 22.4 -6.4 34 44 A L E -ac 7 56A 0 21,-1.8 23,-2.6 -2,-0.3 2,-0.4 -1.000 6.1-173.6-135.7 134.0 11.2 19.4 -8.2 35 45 A A E +ac 8 57A 2 -28,-2.2 -25,-2.2 -2,-0.4 -26,-1.9 -0.995 12.9 160.0-126.8 138.6 12.9 17.0 -10.6 36 46 A A E - c 0 58A 8 21,-2.5 23,-2.1 -2,-0.4 24,-0.1 -0.939 45.0-118.4-144.1 169.2 11.4 14.2 -12.6 37 47 A G - 0 0 43 -2,-0.3 23,-2.7 21,-0.2 26,-0.2 0.846 50.5-115.2 -75.3 -37.8 12.1 12.1 -15.7 38 48 A G S S+ 0 0 14 21,-0.2 3,-0.4 20,-0.1 20,-0.1 0.390 85.8 110.2 114.1 0.9 8.9 13.1 -17.6 39 49 A A S S+ 0 0 88 1,-0.2 2,-0.2 2,-0.1 3,-0.1 0.659 82.9 42.5 -79.8 -18.3 7.1 9.7 -17.8 40 50 A H > + 0 0 109 1,-0.1 4,-1.8 2,-0.1 -1,-0.2 -0.599 62.8 157.9-129.2 71.0 4.4 10.8 -15.4 41 51 A L H > S+ 0 0 42 -3,-0.4 4,-2.5 -2,-0.2 5,-0.2 0.800 71.8 62.8 -65.8 -31.2 3.4 14.4 -16.4 42 52 A D H > S+ 0 0 106 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.948 107.6 42.8 -56.2 -51.8 -0.0 14.1 -14.8 43 53 A T H > S+ 0 0 19 1,-0.2 4,-2.8 2,-0.2 -2,-0.2 0.915 113.5 52.0 -59.8 -46.8 1.6 13.7 -11.4 44 54 A L H X S+ 0 0 3 -4,-1.8 4,-2.5 1,-0.2 -2,-0.2 0.875 109.8 47.7 -63.1 -41.0 4.2 16.4 -12.0 45 55 A L H X S+ 0 0 72 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.877 111.3 52.1 -66.3 -38.1 1.6 19.0 -13.0 46 56 A R H X S+ 0 0 133 -4,-1.8 4,-2.9 -5,-0.2 -2,-0.2 0.953 111.1 47.6 -60.3 -48.4 -0.4 18.1 -10.0 47 57 A Q H X S+ 0 0 10 -4,-2.8 4,-2.6 1,-0.2 6,-0.4 0.892 109.4 53.0 -60.3 -42.1 2.7 18.6 -7.8 48 58 A R H X S+ 0 0 59 -4,-2.5 4,-2.0 1,-0.2 5,-0.5 0.938 114.8 41.4 -57.4 -48.6 3.5 22.0 -9.5 49 59 A A H < S+ 0 0 83 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.914 116.6 47.2 -65.0 -47.0 -0.1 23.2 -8.8 50 60 A Q H < S+ 0 0 149 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.880 124.1 31.3 -68.1 -39.5 -0.3 21.8 -5.2 51 61 A T H < S- 0 0 51 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.695 96.4-133.4 -88.3 -24.8 3.2 23.1 -4.1 52 62 A G < + 0 0 59 -4,-2.0 2,-0.6 -5,-0.4 -3,-0.2 0.661 57.0 142.4 74.8 16.3 3.3 26.3 -6.3 53 63 A V + 0 0 16 -5,-0.5 -1,-0.3 -6,-0.4 -2,-0.1 -0.820 24.9 170.1 -94.3 121.2 6.8 25.4 -7.3 54 64 A T + 0 0 100 -2,-0.6 2,-1.7 -3,-0.1 -1,-0.1 0.552 53.3 103.6-100.9 -14.6 7.6 26.2 -11.0 55 65 A N + 0 0 37 15,-0.1 -21,-1.8 -23,-0.1 2,-0.4 -0.531 58.2 154.3 -67.9 84.2 11.3 25.6 -10.4 56 66 A I E -c 34 0A 1 -2,-1.7 16,-1.5 -23,-0.2 2,-0.4 -0.929 39.2-154.2-128.3 140.9 11.3 22.2 -12.1 57 67 A A E -cd 35 72A 2 -23,-2.6 -21,-2.5 -2,-0.4 2,-0.4 -0.954 10.7-174.3-109.4 132.5 13.6 19.8 -14.0 58 68 A V E -cd 36 73A 0 14,-2.3 16,-1.6 -2,-0.4 -21,-0.2 -0.987 11.6-159.4-125.6 120.9 12.3 17.3 -16.5 59 69 A A S S+ 0 0 44 -23,-2.1 2,-0.5 -2,-0.4 15,-0.2 0.918 73.5 75.2 -66.5 -47.1 14.9 14.9 -18.0 60 70 A D > - 0 0 80 -23,-2.7 4,-2.5 1,-0.2 5,-0.2 -0.572 68.0-155.8 -74.3 117.8 13.0 13.9 -21.2 61 71 A E H > S+ 0 0 103 -2,-0.5 4,-2.1 2,-0.2 -1,-0.2 0.889 94.0 49.4 -60.4 -44.5 13.2 16.8 -23.7 62 72 A H H > S+ 0 0 134 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.918 113.4 46.6 -61.5 -43.9 10.1 15.8 -25.6 63 73 A A H > S+ 0 0 10 2,-0.2 4,-1.3 1,-0.2 -2,-0.2 0.873 111.7 50.5 -68.1 -38.0 8.1 15.5 -22.3 64 74 A A H X S+ 0 0 6 -4,-2.5 4,-2.4 2,-0.2 6,-0.5 0.849 109.9 51.9 -65.0 -37.6 9.5 18.9 -21.0 65 75 A Q H < S+ 0 0 150 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.921 105.6 54.4 -64.2 -45.6 8.4 20.4 -24.4 66 76 A R H < S+ 0 0 181 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.787 112.3 44.0 -60.7 -32.5 4.9 19.0 -24.0 67 77 A V H < S- 0 0 31 -4,-1.3 -1,-0.2 -5,-0.1 -2,-0.2 0.923 103.7-150.1 -73.3 -48.6 4.5 20.7 -20.6 68 78 A G < + 0 0 24 -4,-2.4 -3,-0.1 -5,-0.1 -2,-0.1 0.321 64.0 39.6 83.1 142.5 6.1 24.0 -21.8 69 79 A D + 0 0 141 1,-0.2 -4,-0.1 -4,-0.1 -5,-0.0 0.633 65.3 157.5 58.0 23.8 8.1 26.6 -19.8 70 80 A I - 0 0 12 -6,-0.5 -1,-0.2 1,-0.1 -15,-0.1 -0.656 36.5-147.3 -69.1 120.8 10.1 24.0 -17.7 71 81 A P S S+ 0 0 62 0, 0.0 2,-0.4 0, 0.0 -14,-0.1 0.766 82.6 36.6 -67.2 -25.3 13.3 26.0 -16.6 72 82 A Y E S+d 57 0A 26 -16,-1.5 -14,-2.3 -8,-0.0 2,-0.3 -0.984 70.8 159.7-133.0 121.6 15.5 22.9 -16.8 73 83 A H E +d 58 0A 82 -2,-0.4 -14,-0.2 -16,-0.2 3,-0.2 -0.993 32.9 48.2-144.0 148.6 15.2 20.1 -19.4 74 84 A G S > S- 0 0 4 -16,-1.6 3,-2.4 -2,-0.3 4,-0.3 -0.441 99.6 -52.1 107.7 173.6 17.5 17.4 -20.7 75 85 A S T 3 S+ 0 0 124 1,-0.3 4,-0.2 -2,-0.2 3,-0.2 0.737 136.7 46.2 -60.5 -26.8 19.8 14.8 -19.2 76 86 A D T 3> S+ 0 0 77 -3,-0.2 4,-2.6 1,-0.2 -1,-0.3 0.328 82.8 105.2 -95.4 6.4 21.6 17.3 -17.0 77 87 A A H <> S+ 0 0 0 -3,-2.4 4,-2.5 1,-0.2 5,-0.2 0.906 78.9 46.5 -55.0 -53.5 18.4 19.0 -15.8 78 88 A A H > S+ 0 0 17 -4,-0.3 4,-1.8 -3,-0.2 -1,-0.2 0.906 113.6 50.8 -57.6 -43.7 18.3 17.6 -12.3 79 89 A T H > S+ 0 0 17 -4,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.932 111.7 45.7 -58.1 -50.4 22.0 18.5 -11.8 80 90 A R H X S+ 0 0 60 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.848 108.4 57.5 -66.3 -35.3 21.6 22.1 -13.0 81 91 A L H X S+ 0 0 0 -4,-2.5 4,-1.0 -5,-0.2 -1,-0.2 0.907 110.5 44.3 -54.8 -45.1 18.4 22.5 -10.8 82 92 A V H >< S+ 0 0 2 -4,-1.8 3,-0.5 1,-0.2 -2,-0.2 0.933 112.7 50.9 -68.0 -46.9 20.6 21.5 -7.8 83 93 A E H 3< S+ 0 0 116 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.827 119.1 36.7 -56.7 -34.3 23.5 23.8 -8.8 84 94 A Q H 3< S+ 0 0 120 -4,-1.9 2,-0.5 -5,-0.2 -1,-0.2 0.473 98.5 85.6-107.1 -3.4 21.2 26.8 -9.2 85 95 A T S << S- 0 0 22 -4,-1.0 2,-0.5 -3,-0.5 -79,-0.1 -0.888 72.2-132.1-106.9 123.3 18.6 26.5 -6.4 86 96 A E + 0 0 156 -2,-0.5 2,-0.3 -54,-0.1 -2,-0.1 -0.598 46.6 154.6 -69.5 121.3 19.3 27.8 -2.9 87 97 A A - 0 0 21 -2,-0.5 -82,-0.2 22,-0.1 3,-0.1 -0.941 49.2-151.6-145.3 163.3 18.4 25.0 -0.6 88 98 A D S S+ 0 0 54 -84,-2.6 24,-2.4 1,-0.3 2,-0.4 0.647 90.9 27.7-102.2 -32.7 19.0 23.5 2.9 89 99 A V E -be 5 112A 0 -85,-2.5 -83,-2.7 22,-0.2 2,-0.6 -0.997 61.2-159.7-135.1 130.4 18.2 19.9 2.0 90 100 A V E -be 6 113A 2 22,-3.4 24,-2.2 -2,-0.4 2,-0.9 -0.949 11.1-158.0-105.9 114.9 18.5 18.0 -1.3 91 101 A L E -be 7 114A 0 -85,-3.4 -83,-3.3 -2,-0.6 2,-1.0 -0.842 5.8-163.1 -88.8 107.2 16.3 14.9 -1.3 92 102 A N E +be 8 115A 0 22,-2.2 25,-2.3 -2,-0.9 24,-2.2 -0.801 29.0 151.3 -93.3 97.2 17.8 12.6 -4.0 93 103 A A + 0 0 19 -85,-2.3 -78,-0.2 -2,-1.0 -79,-0.2 -0.021 28.8 131.3-112.3 25.9 15.1 10.0 -4.8 94 104 A L - 0 0 25 5,-0.1 2,-0.4 1,-0.1 5,-0.1 -0.311 56.2-119.1 -65.8 162.6 16.2 9.5 -8.4 95 105 A V + 0 0 91 22,-0.1 3,-0.4 23,-0.1 22,-0.1 -0.868 62.4 2.2-113.2 141.1 16.6 5.8 -9.4 96 106 A G S > S- 0 0 8 -2,-0.4 3,-1.8 1,-0.2 24,-0.2 -0.017 104.4 -49.7 81.2 176.6 19.8 4.1 -10.6 97 107 A A G > S+ 0 0 4 1,-0.3 3,-1.5 2,-0.1 -1,-0.2 0.614 118.5 84.6 -67.0 -9.6 23.4 5.2 -11.0 98 108 A L G 3 S+ 0 0 123 -3,-0.4 3,-0.3 1,-0.3 -1,-0.3 0.572 73.4 73.5 -65.8 -12.1 22.1 8.2 -13.0 99 109 A G G <> S+ 0 0 0 -3,-1.8 4,-1.9 1,-0.2 -1,-0.3 0.458 73.0 95.1 -77.0 1.4 21.6 10.0 -9.6 100 110 A L H <> S+ 0 0 3 -3,-1.5 4,-2.5 2,-0.2 -1,-0.2 0.914 81.4 43.1 -63.0 -54.7 25.4 10.3 -9.4 101 111 A R H > S+ 0 0 117 -3,-0.3 4,-3.0 2,-0.2 -1,-0.2 0.899 114.9 49.7 -62.1 -44.9 25.9 13.9 -10.8 102 112 A P H > S+ 0 0 4 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.868 111.2 51.2 -60.4 -34.9 22.9 15.3 -8.8 103 113 A T H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.929 113.2 44.6 -63.7 -45.7 24.4 13.7 -5.7 104 114 A L H X S+ 0 0 13 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.924 113.9 49.7 -66.2 -44.0 27.8 15.2 -6.3 105 115 A A H X S+ 0 0 6 -4,-3.0 4,-1.1 2,-0.2 -1,-0.2 0.895 109.4 52.6 -59.4 -43.0 26.2 18.6 -7.2 106 116 A A H ><>S+ 0 0 0 -4,-2.3 3,-0.8 1,-0.2 5,-0.8 0.936 109.3 47.7 -59.5 -50.7 24.2 18.6 -4.0 107 117 A L H ><5S+ 0 0 4 -4,-2.1 3,-1.5 1,-0.2 -1,-0.2 0.893 107.1 57.8 -57.6 -42.1 27.2 17.9 -1.7 108 118 A K H 3<5S+ 0 0 154 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.750 99.9 58.3 -60.3 -26.1 29.1 20.7 -3.5 109 119 A T T <<5S- 0 0 69 -4,-1.1 -1,-0.3 -3,-0.8 -2,-0.2 0.591 110.1-122.9 -79.0 -14.5 26.4 23.2 -2.5 110 120 A G T < 5 + 0 0 32 -3,-1.5 -3,-0.1 -4,-0.5 -2,-0.1 0.343 67.5 132.8 87.4 -7.2 26.9 22.4 1.2 111 121 A A < - 0 0 6 -5,-0.8 -1,-0.3 1,-0.1 -22,-0.2 -0.294 68.3 -90.8 -70.2 159.1 23.3 21.4 1.7 112 122 A R E -e 89 0A 44 -24,-2.4 -22,-3.4 -3,-0.1 2,-0.8 -0.500 35.8-142.5 -63.0 134.5 22.2 18.2 3.5 113 123 A L E -ef 90 137A 0 23,-2.8 25,-2.6 -24,-0.2 2,-1.0 -0.895 8.3-161.7-104.2 102.3 21.8 15.3 1.1 114 124 A A E -ef 91 138A 0 -24,-2.2 -22,-2.2 -2,-0.8 2,-0.7 -0.789 23.6-152.9 -79.3 107.2 18.9 13.2 2.2 115 125 A L E +ef 92 139A 1 23,-2.4 25,-2.7 -2,-1.0 26,-0.8 -0.786 46.0 144.6-100.5 110.3 19.9 10.2 0.2 116 126 A A + 0 0 22 -24,-2.2 2,-2.2 -2,-0.7 -23,-0.2 0.719 64.8 83.2 -96.9 -34.4 17.3 7.6 -1.1 117 127 A N >> + 0 0 1 -25,-2.3 3,-1.1 -3,-0.2 4,-0.7 -0.440 55.8 172.4 -71.0 75.1 19.3 7.0 -4.3 118 128 A K H 3> + 0 0 6 -2,-2.2 4,-2.7 1,-0.2 3,-0.5 0.809 67.7 70.8 -58.0 -31.0 21.7 4.5 -2.7 119 129 A E H 3> S+ 0 0 17 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.817 91.3 57.0 -57.3 -37.9 23.1 3.7 -6.2 120 130 A S H <> S+ 0 0 0 -3,-1.1 4,-2.6 -24,-0.2 -1,-0.2 0.883 112.6 40.9 -63.1 -39.4 24.9 7.1 -6.5 121 131 A L H X S+ 0 0 0 -4,-0.7 4,-2.4 -3,-0.5 -2,-0.2 0.902 115.3 50.5 -73.5 -43.2 26.8 6.4 -3.2 122 132 A V H < S+ 0 0 0 -4,-2.7 -2,-0.2 2,-0.2 -3,-0.2 0.931 120.3 36.5 -57.8 -46.2 27.5 2.8 -4.1 123 133 A A H < S+ 0 0 1 -4,-3.0 191,-0.4 -5,-0.2 -2,-0.2 0.924 119.0 47.4 -73.8 -46.8 28.8 3.9 -7.5 124 134 A G H >< S+ 0 0 0 -4,-2.6 3,-2.0 -5,-0.3 4,-0.3 0.818 80.7 160.8 -65.9 -33.3 30.5 7.1 -6.5 125 135 A G T >X S+ 0 0 2 -4,-2.4 4,-2.1 1,-0.3 3,-0.5 -0.183 70.7 2.3 50.4-128.7 32.2 5.4 -3.5 126 136 A S H 3> S+ 0 0 25 184,-0.3 4,-2.3 1,-0.2 -1,-0.3 0.730 129.7 63.4 -62.8 -23.7 35.2 7.4 -2.3 127 137 A L H <> S+ 0 0 20 -3,-2.0 4,-1.0 2,-0.2 -1,-0.2 0.925 108.1 40.9 -64.8 -46.3 34.5 10.2 -4.8 128 138 A V H <> S+ 0 0 0 -3,-0.5 4,-0.7 -4,-0.3 3,-0.4 0.907 114.0 54.2 -64.8 -42.8 31.2 10.9 -3.2 129 139 A L H >< S+ 0 0 64 -4,-2.1 3,-0.9 1,-0.2 -2,-0.2 0.892 105.3 52.8 -61.9 -39.4 32.7 10.6 0.3 130 140 A R H 3< S+ 0 0 144 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.796 105.7 55.3 -64.9 -30.4 35.4 13.1 -0.5 131 141 A A H 3< S+ 0 0 32 -4,-1.0 2,-0.3 -3,-0.4 -1,-0.2 0.626 99.7 80.2 -76.9 -14.1 32.8 15.7 -1.6 132 142 A A << - 0 0 26 -3,-0.9 3,-0.1 -4,-0.7 -24,-0.1 -0.736 67.9-142.4-102.9 141.3 30.9 15.4 1.7 133 143 A R > - 0 0 124 -2,-0.3 3,-1.9 1,-0.1 4,-0.4 -0.482 56.1 -67.3 -79.3 165.1 31.5 16.9 5.2 134 144 A P T 3 S+ 0 0 126 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.359 122.2 4.4 -58.2 129.0 30.8 14.7 8.2 135 145 A G T 3 S+ 0 0 63 84,-0.2 84,-0.0 2,-0.1 -3,-0.0 0.521 92.8 119.8 73.0 7.1 27.0 13.9 8.5 136 146 A Q < + 0 0 4 -3,-1.9 -23,-2.8 1,-0.1 2,-0.7 0.850 64.2 65.8 -71.1 -34.1 26.2 15.7 5.3 137 147 A I E -f 113 0A 21 -4,-0.4 -23,-0.2 -25,-0.2 -2,-0.1 -0.827 69.4-175.4 -91.9 114.9 24.8 12.5 3.8 138 148 A V E -f 114 0A 8 -25,-2.6 -23,-2.4 -2,-0.7 2,-0.1 -0.957 23.7-124.2-115.4 120.9 21.7 11.5 5.7 139 149 A P E -f 115 0A 10 0, 0.0 -23,-0.2 0, 0.0 125,-0.1 -0.374 24.5-176.9 -74.2 137.1 20.1 8.1 4.7 140 150 A V + 0 0 0 -25,-2.7 -24,-0.2 -2,-0.1 123,-0.1 0.672 56.4 109.7 -93.3 -26.4 16.5 7.8 3.7 141 151 A D S > S- 0 0 15 -26,-0.8 4,-2.6 1,-0.1 5,-0.3 -0.216 76.8-128.0 -52.5 134.7 16.8 4.1 3.3 142 152 A S H > S+ 0 0 8 1,-0.2 4,-1.9 2,-0.2 -1,-0.1 0.890 106.0 46.7 -57.8 -42.5 14.9 2.3 6.1 143 153 A E H > S+ 0 0 13 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.934 114.5 44.8 -64.2 -47.8 17.9 0.2 7.2 144 154 A H H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.882 111.5 53.0 -71.6 -33.9 20.4 3.0 7.3 145 155 A S H X S+ 0 0 3 -4,-2.6 4,-1.8 2,-0.2 -1,-0.2 0.912 110.7 48.7 -60.7 -44.4 18.0 5.4 9.1 146 156 A A H X S+ 0 0 0 -4,-1.9 4,-2.7 -5,-0.3 -2,-0.2 0.925 110.6 50.7 -61.6 -48.3 17.5 2.6 11.7 147 157 A L H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.916 108.0 52.3 -55.5 -47.1 21.3 2.2 12.0 148 158 A A H < S+ 0 0 15 -4,-2.6 4,-0.4 1,-0.2 -1,-0.2 0.879 112.8 45.3 -60.5 -38.1 21.9 5.9 12.5 149 159 A Q H >< S+ 0 0 1 -4,-1.8 3,-1.3 1,-0.2 -2,-0.2 0.923 113.0 49.5 -68.4 -45.5 19.3 6.0 15.3 150 160 A C H >< S+ 0 0 0 -4,-2.7 3,-1.9 1,-0.3 -2,-0.2 0.780 98.2 68.3 -67.3 -28.7 20.6 2.8 17.0 151 161 A L G >< S+ 0 0 43 -4,-2.2 3,-1.4 1,-0.3 -1,-0.3 0.717 84.0 72.7 -63.1 -20.6 24.2 4.3 16.9 152 162 A R G < S+ 0 0 63 -3,-1.3 -1,-0.3 -4,-0.4 -2,-0.2 0.683 77.8 81.6 -65.1 -16.6 23.0 6.8 19.4 153 163 A G G < S- 0 0 2 -3,-1.9 2,-0.3 -4,-0.2 -1,-0.2 0.536 107.4 -8.3 -67.5 -9.5 23.0 3.9 21.9 154 164 A G S < S- 0 0 18 -3,-1.4 495,-0.1 378,-0.1 5,-0.0 -0.972 83.1 -73.0-167.1-177.6 26.8 4.3 22.4 155 165 A T > - 0 0 60 -2,-0.3 3,-1.7 1,-0.1 4,-0.4 -0.460 52.0-103.5 -82.7 159.6 30.1 5.9 21.4 156 166 A P G > S+ 0 0 120 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.871 121.3 55.8 -51.0 -40.8 31.8 4.9 18.1 157 167 A D G 3 S+ 0 0 109 1,-0.3 87,-0.0 86,-0.0 0, 0.0 0.584 100.3 62.4 -70.1 -9.0 34.4 2.8 19.9 158 168 A E G < S+ 0 0 2 -3,-1.7 86,-2.6 85,-0.1 2,-0.4 0.522 77.4 108.3 -93.8 -6.7 31.6 0.8 21.6 159 169 A V E < +G 243 0B 9 -3,-1.5 84,-0.2 -4,-0.4 3,-0.1 -0.590 33.5 167.4 -76.0 124.9 30.2 -0.5 18.3 160 170 A A E - 0 0 28 82,-3.0 2,-0.3 -2,-0.4 83,-0.2 0.843 64.6 -2.1 -94.7 -55.4 30.8 -4.3 17.7 161 171 A K E -G 242 0B 79 81,-2.0 81,-2.7 66,-0.0 2,-0.5 -0.977 52.0-140.0-140.2 148.9 28.5 -5.0 14.7 162 172 A L E -Gh 241 227B 0 64,-2.8 66,-3.3 -2,-0.3 2,-0.6 -0.953 23.9-157.4-105.6 129.8 26.0 -3.4 12.5 163 173 A V E -Gh 240 228B 1 77,-3.3 77,-2.6 -2,-0.5 2,-0.4 -0.903 4.6-164.9-116.6 104.5 23.0 -5.8 11.8 164 174 A L E -Gh 239 229B 0 64,-2.8 66,-2.7 -2,-0.6 2,-0.3 -0.713 12.1-143.3 -83.2 133.0 21.0 -5.1 8.7 165 175 A T E - 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s 0 438D 6 21,-2.5 23,-2.0 -2,-0.4 24,-0.2 -0.926 42.0-113.9-145.6 170.7 26.2 -7.0 54.3 417 47 B G - 0 0 37 -2,-0.3 23,-2.2 21,-0.2 26,-0.2 0.910 49.0-116.3 -72.1 -46.9 23.4 -8.1 56.6 418 48 B G S > S+ 0 0 10 21,-0.2 3,-1.3 20,-0.1 4,-0.2 0.092 93.4 96.6 126.1 -23.2 25.1 -10.7 58.6 419 49 B A T 3 S+ 0 0 96 1,-0.3 3,-0.2 2,-0.1 -3,-0.0 0.802 98.2 37.2 -63.9 -30.5 23.2 -13.9 57.7 420 50 B H T 3> S+ 0 0 107 1,-0.2 4,-1.9 2,-0.1 -1,-0.3 -0.342 77.6 139.3-114.8 49.8 25.9 -14.5 55.2 421 51 B L H <> + 0 0 9 -3,-1.3 4,-2.5 1,-0.2 5,-0.2 0.864 67.6 58.8 -60.7 -40.5 28.8 -13.3 57.4 422 52 B D H > S+ 0 0 104 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.898 105.8 49.1 -57.5 -44.1 31.1 -16.1 56.3 423 53 B T H > S+ 0 0 57 -3,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.934 110.3 50.5 -59.6 -50.0 30.7 -15.0 52.6 424 54 B L H X S+ 0 0 0 -4,-1.9 4,-2.5 1,-0.2 -2,-0.2 0.895 110.1 50.5 -54.4 -42.6 31.5 -11.4 53.6 425 55 B L H X S+ 0 0 44 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.883 109.8 49.5 -66.2 -38.9 34.6 -12.5 55.5 426 56 B R H X S+ 0 0 163 -4,-2.0 4,-2.8 2,-0.2 -1,-0.2 0.885 109.5 53.6 -62.2 -40.7 35.8 -14.5 52.5 427 57 B Q H X S+ 0 0 10 -4,-2.5 4,-3.0 2,-0.2 6,-0.4 0.897 107.1 49.7 -61.4 -44.2 35.2 -11.4 50.4 428 58 B R H X S+ 0 0 41 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.941 113.8 47.3 -56.0 -46.7 37.4 -9.3 52.7 429 59 B A H < S+ 0 0 84 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.896 117.0 42.3 -62.3 -44.0 40.0 -12.1 52.4 430 60 B Q H < S+ 0 0 149 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.892 124.6 32.6 -70.3 -46.9 39.7 -12.3 48.6 431 61 B T H < S- 0 0 60 -4,-3.0 -2,-0.2 -5,-0.2 -3,-0.2 0.712 95.3-131.3 -84.2 -23.4 39.5 -8.5 47.8 432 62 B G < + 0 0 57 -4,-2.0 2,-0.7 -5,-0.4 -4,-0.1 0.495 58.1 146.2 76.0 3.3 41.8 -7.3 50.6 433 63 B V + 0 0 17 -6,-0.4 -1,-0.3 1,-0.2 -2,-0.1 -0.656 22.1 172.5 -75.8 112.9 39.0 -4.8 51.4 434 64 B T + 0 0 101 -2,-0.7 2,-1.8 -3,-0.1 -1,-0.2 0.541 54.5 97.5 -96.2 -12.2 38.9 -4.2 55.2 435 65 B N + 0 0 37 15,-0.1 -21,-1.9 16,-0.1 2,-0.3 -0.589 60.9 146.8 -78.9 82.8 36.4 -1.4 54.9 436 66 B I E -s 414 0D 0 -2,-1.8 16,-1.3 -23,-0.2 2,-0.4 -0.873 36.3-154.5-128.6 156.2 33.4 -3.5 55.6 437 67 B A E -st 415 452D 2 -23,-1.8 -21,-2.5 -2,-0.3 2,-0.4 -0.986 4.2-170.7-133.3 138.3 30.0 -3.2 57.4 438 68 B V E -st 416 453D 0 14,-2.2 16,-1.7 -2,-0.4 -21,-0.2 -0.989 8.8-161.7-130.1 119.8 27.7 -5.8 59.0 439 69 B A S S+ 0 0 40 -23,-2.0 2,-0.6 -2,-0.4 -21,-0.2 0.884 73.2 79.0 -65.9 -41.8 24.2 -4.7 60.1 440 70 B D > - 0 0 78 -23,-2.2 4,-2.4 -24,-0.2 5,-0.1 -0.608 62.5-163.4 -79.5 112.7 23.6 -7.6 62.5 441 71 B E H > S+ 0 0 82 -2,-0.6 4,-1.3 2,-0.2 -1,-0.2 0.868 90.9 55.2 -63.3 -39.2 25.4 -6.9 65.8 442 72 B H H 4 S+ 0 0 151 2,-0.2 3,-0.4 1,-0.2 4,-0.3 0.931 110.5 44.8 -54.5 -52.1 25.1 -10.6 66.9 443 73 B A H >4 S+ 0 0 7 1,-0.2 3,-1.8 2,-0.2 -2,-0.2 0.913 110.0 55.7 -58.3 -44.4 26.9 -11.6 63.6 444 74 B A H >X S+ 0 0 8 -4,-2.4 3,-1.6 1,-0.3 4,-1.3 0.759 93.5 70.3 -61.4 -25.7 29.4 -8.9 64.2 445 75 B Q T 3< S+ 0 0 136 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.656 88.9 65.4 -62.9 -20.2 30.2 -10.4 67.6 446 76 B R T <4 S+ 0 0 201 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.2 0.532 107.9 35.7 -78.9 -8.5 31.8 -13.3 65.8 447 77 B V T <4 - 0 0 35 -3,-1.6 -2,-0.2 -4,-0.1 -3,-0.1 0.822 69.5-159.3-120.3 -52.2 34.6 -11.2 64.3 448 78 B G S < S+ 0 0 77 -4,-1.3 -3,-0.1 1,-0.1 -4,-0.1 0.318 78.6 69.2 84.9 -10.9 36.1 -8.4 66.4 449 79 B D + 0 0 95 -5,-0.1 -1,-0.1 0, 0.0 -5,-0.0 0.012 58.6 125.6-129.9 29.5 37.6 -6.4 63.6 450 80 B I - 0 0 12 -6,-0.2 3,-0.1 1,-0.1 -13,-0.1 -0.818 47.0-155.4 -89.4 119.0 34.6 -5.0 61.7 451 81 B P S S+ 0 0 64 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.799 82.8 38.3 -63.4 -30.8 34.9 -1.2 61.4 452 82 B Y E S+t 437 0D 27 -16,-1.3 -14,-2.2 2,-0.0 2,-0.3 -0.963 73.3 152.7-128.8 114.1 31.2 -0.7 61.0 453 83 B H E +t 438 0D 76 -2,-0.5 -14,-0.2 -16,-0.2 2,-0.2 -0.991 34.6 34.2-141.8 150.3 28.6 -2.8 62.9 454 84 B G S > S- 0 0 9 -16,-1.7 3,-1.7 -2,-0.3 4,-0.3 -0.509 99.6 -15.2 103.6-174.9 25.1 -2.5 64.1 455 85 B S T 3 S+ 0 0 100 1,-0.3 -2,-0.1 -2,-0.2 -15,-0.0 -0.371 134.6 13.4 -65.0 138.0 22.0 -0.7 62.8 456 86 B D T 3> S+ 0 0 72 3,-0.1 4,-2.4 1,-0.1 -1,-0.3 0.688 81.5 134.7 66.5 21.0 22.9 1.8 60.0 457 87 B A H <> S+ 0 0 0 -3,-1.7 4,-2.5 2,-0.2 5,-0.2 0.916 73.9 52.2 -58.8 -44.5 26.4 0.4 59.7 458 88 B A H > S+ 0 0 16 -4,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.899 108.9 50.3 -60.4 -42.4 25.9 0.5 55.9 459 89 B T H > S+ 0 0 14 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.945 110.9 47.9 -59.1 -50.9 24.9 4.2 56.1 460 90 B R H X S+ 0 0 79 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.879 109.2 53.9 -58.6 -40.5 28.0 5.0 58.2 461 91 B L H X S+ 0 0 0 -4,-2.5 4,-0.5 1,-0.2 -1,-0.2 0.919 110.5 47.1 -59.5 -43.9 30.3 3.2 55.8 462 92 B V H >< S+ 0 0 3 -4,-2.0 3,-0.8 1,-0.2 -2,-0.2 0.901 111.3 50.8 -63.3 -43.8 28.8 5.3 52.9 463 93 B E H 3< S+ 0 0 116 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.842 117.7 38.8 -62.1 -33.8 29.2 8.5 54.9 464 94 B Q H 3< S+ 0 0 122 -4,-1.8 2,-0.5 -5,-0.2 -1,-0.2 0.295 98.8 86.1-106.9 7.1 32.9 7.8 55.7 465 95 B T << - 0 0 20 -3,-0.8 2,-0.4 -4,-0.5 -79,-0.1 -0.945 69.3-136.3-117.6 122.6 34.1 6.3 52.5 466 96 B E + 0 0 155 -2,-0.5 2,-0.3 -54,-0.1 -2,-0.1 -0.606 45.5 149.5 -71.3 123.1 35.4 8.2 49.5 467 97 B A - 0 0 21 -2,-0.4 -82,-0.2 1,-0.1 3,-0.1 -0.982 50.2-146.5-152.8 160.5 33.9 6.6 46.4 468 98 B D S S+ 0 0 50 -84,-2.0 24,-2.7 -2,-0.3 2,-0.4 0.754 90.0 27.1 -95.9 -35.6 32.7 7.4 42.8 469 99 B V E -ru 385 492D 3 -85,-2.6 -83,-2.4 22,-0.2 2,-0.5 -0.990 60.4-160.7-131.4 134.7 29.9 4.8 42.7 470 100 B V E -ru 386 493D 2 22,-2.9 24,-2.4 -2,-0.4 2,-0.8 -0.979 11.1-155.4-111.2 119.5 27.7 3.3 45.4 471 101 B L E -ru 387 494D 0 -85,-3.2 -83,-2.8 -2,-0.5 2,-1.0 -0.851 6.2-161.7 -91.0 111.1 26.0 0.1 44.4 472 102 B N E +ru 388 495D 0 22,-2.5 24,-2.5 -2,-0.8 25,-2.5 -0.791 31.2 149.0 -96.3 96.0 22.9 -0.2 46.5 473 103 B A + 0 0 19 -85,-2.2 -78,-0.3 -2,-1.0 -79,-0.2 -0.103 28.6 132.6-113.1 29.0 21.9 -3.9 46.3 474 104 B L - 0 0 12 5,-0.1 2,-0.4 2,-0.1 24,-0.2 -0.429 55.5-120.2 -74.0 156.4 20.4 -4.0 49.8 475 105 B V > - 0 0 118 22,-0.1 3,-0.7 -2,-0.1 22,-0.1 -0.855 58.4 -28.6-105.2 137.5 17.0 -5.7 50.2 476 106 B G G > S- 0 0 15 -2,-0.4 3,-2.3 1,-0.2 4,-0.3 -0.092 115.1 -10.8 67.5-156.8 13.9 -3.9 51.6 477 107 B A G >> S+ 0 0 58 1,-0.3 3,-1.2 2,-0.2 4,-0.5 0.702 121.3 71.0 -52.3 -28.8 13.7 -1.1 54.1 478 108 B L G <4 S+ 0 0 99 -3,-0.7 -1,-0.3 1,-0.2 -2,-0.2 0.572 90.8 63.5 -73.8 -2.4 17.4 -1.3 55.0 479 109 B G G <> S+ 0 0 0 -3,-2.3 4,-2.0 2,-0.1 -1,-0.2 0.726 86.0 72.9 -84.0 -24.6 18.2 0.2 51.6 480 110 B L H <> S+ 0 0 9 -3,-1.2 4,-2.2 -4,-0.3 5,-0.2 0.928 95.6 44.6 -63.9 -52.4 16.5 3.6 52.0 481 111 B R H X S+ 0 0 103 -4,-0.5 4,-2.6 1,-0.2 -1,-0.2 0.899 113.4 50.3 -62.0 -45.8 18.9 5.3 54.5 482 112 B P H > S+ 0 0 3 0, 0.0 4,-3.1 0, 0.0 -1,-0.2 0.890 108.7 53.9 -57.4 -40.8 22.1 4.2 52.6 483 113 B T H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.946 110.9 45.8 -54.7 -49.6 20.5 5.5 49.4 484 114 B L H X S+ 0 0 40 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.918 114.6 47.8 -61.9 -41.5 19.9 8.9 51.1 485 115 B A H X S+ 0 0 9 -4,-2.6 4,-1.5 1,-0.2 -1,-0.2 0.896 111.0 51.0 -65.9 -41.6 23.5 8.9 52.5 486 116 B A H X>S+ 0 0 0 -4,-3.1 5,-1.0 1,-0.2 4,-0.8 0.904 108.5 51.4 -63.2 -42.1 25.0 7.9 49.1 487 117 B L H ><5S+ 0 0 4 -4,-2.4 3,-0.9 1,-0.2 -1,-0.2 0.905 107.5 53.0 -62.8 -41.9 23.1 10.8 47.3 488 118 B K H 3<5S+ 0 0 197 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.824 101.3 59.8 -62.5 -34.5 24.4 13.3 49.9 489 119 B T H 3<5S- 0 0 69 -4,-1.5 -1,-0.2 -3,-0.1 -2,-0.2 0.754 110.4-123.7 -65.0 -24.2 28.1 12.2 49.3 490 120 B G T <<5 + 0 0 38 -3,-0.9 -3,-0.1 -4,-0.8 -2,-0.1 0.473 64.1 138.5 90.4 4.1 27.6 13.2 45.6 491 121 B A < - 0 0 6 -5,-1.0 -1,-0.3 1,-0.1 2,-0.3 -0.349 64.8 -96.4 -71.3 158.4 28.6 9.8 44.3 492 122 B R E -u 469 0D 80 -24,-2.7 -22,-2.9 -3,-0.1 2,-0.7 -0.596 38.2-140.2 -68.7 136.9 26.8 8.1 41.5 493 123 B L E -uv 470 517D 0 23,-2.8 25,-3.0 -2,-0.3 2,-1.0 -0.907 10.1-161.7-106.4 106.9 24.1 5.7 42.9 494 124 B A E -uv 471 518D 0 -24,-2.4 -22,-2.5 -2,-0.7 2,-0.6 -0.794 26.9-154.5 -82.2 104.5 23.9 2.4 41.0 495 125 B L E +uv 472 519D 10 23,-2.4 25,-2.4 -2,-1.0 26,-0.5 -0.756 44.3 143.1-102.5 116.6 20.5 1.5 42.4 496 126 B A + 0 0 25 -24,-2.5 -23,-0.2 -2,-0.6 -1,-0.2 0.692 48.7 101.5-107.3 -38.7 19.1 -2.0 42.7 497 127 B N - 0 0 3 -25,-2.5 4,-0.5 1,-0.2 3,-0.3 -0.267 56.5-162.6 -51.9 112.5 17.2 -1.6 46.0 498 128 B K S >> S+ 0 0 38 1,-0.2 4,-2.6 -24,-0.2 3,-1.1 0.874 82.0 64.9 -69.3 -37.6 13.6 -1.3 44.9 499 129 B E H 3>>S+ 0 0 22 1,-0.3 5,-2.1 2,-0.2 4,-2.0 0.814 87.1 70.8 -58.3 -32.7 12.4 0.2 48.2 500 130 B S H 345S+ 0 0 0 -3,-0.3 8,-0.3 3,-0.2 -1,-0.3 0.888 117.0 20.3 -51.3 -43.9 14.5 3.3 47.7 501 131 B L H <>5S+ 0 0 2 -3,-1.1 4,-1.1 -4,-0.5 -2,-0.2 0.853 126.1 49.3 -93.6 -42.8 12.2 4.5 44.9 502 132 B V H <5S+ 0 0 0 -4,-2.6 -3,-0.2 2,-0.1 195,-0.2 0.895 131.9 17.5 -69.9 -39.6 8.9 2.6 45.5 503 133 B A T <5S+ 0 0 3 -4,-2.0 191,-0.3 -5,-0.3 -3,-0.2 0.851 129.1 48.1 -95.6 -46.3 8.8 3.5 49.2 504 134 B G T >>X S+ 0 0 4 -4,-1.1 4,-2.4 -6,-0.3 3,-0.6 0.059 70.2 12.4 41.5-118.5 9.6 8.2 46.5 506 136 B S H 3> S+ 0 0 25 184,-0.3 4,-2.4 1,-0.2 -1,-0.3 0.751 123.1 65.0 -63.7 -25.9 9.9 12.0 46.7 507 137 B L H <> S+ 0 0 17 -3,-2.1 4,-0.8 2,-0.2 -1,-0.2 0.928 111.2 36.7 -59.0 -44.7 12.3 11.7 49.7 508 138 B V H - 0 0 158 -2,-0.2 3,-2.5 1,-0.1 4,-0.5 -0.665 46.3 -70.2 -98.7 157.4 20.5 15.3 41.3 514 144 B P T 3 S+ 0 0 138 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.207 120.3 3.7 -50.1 128.9 19.9 14.8 37.6 515 145 B G T 3 S+ 0 0 49 2,-0.1 -3,-0.0 1,-0.1 0, 0.0 0.380 96.7 114.1 80.7 -4.6 21.6 11.6 36.4 516 146 B Q < + 0 0 14 -3,-2.5 -23,-2.8 -24,-0.1 2,-0.5 0.880 65.8 64.0 -68.0 -38.2 22.9 10.7 39.8 517 147 B I E -v 493 0D 25 -4,-0.5 -23,-0.2 -25,-0.2 -2,-0.1 -0.768 64.2-174.4 -91.9 123.3 20.7 7.6 40.0 518 148 B V E -v 494 0D 6 -25,-3.0 -23,-2.4 -2,-0.5 2,-0.1 -0.986 24.1-128.1-117.0 121.7 21.5 4.8 37.5 519 149 B P E -v 495 0D 14 0, 0.0 -23,-0.2 0, 0.0 9,-0.1 -0.425 15.0-164.3 -73.3 142.1 19.1 1.9 37.6 520 150 B V + 0 0 2 -25,-2.4 -24,-0.2 -2,-0.1 124,-0.1 0.716 57.0 97.8 -95.2 -26.2 20.5 -1.7 37.8 521 151 B D S > S- 0 0 34 -26,-0.5 4,-2.6 1,-0.1 5,-0.2 -0.340 80.2-116.8 -75.3 151.8 17.5 -3.8 36.8 522 152 B S H > S+ 0 0 21 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.835 110.2 47.2 -55.8 -43.0 17.2 -5.1 33.2 523 153 B E H > S+ 0 0 21 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.942 116.0 43.5 -65.6 -47.6 14.0 -3.2 32.2 524 154 B H H > S+ 0 0 3 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.859 113.5 51.6 -67.7 -36.3 15.2 0.2 33.6 525 155 B S H X S+ 0 0 6 -4,-2.6 4,-1.8 2,-0.2 -1,-0.2 0.898 109.3 51.5 -63.7 -44.1 18.6 -0.3 32.1 526 156 B A H X S+ 0 0 0 -4,-2.2 4,-2.6 -5,-0.2 -2,-0.2 0.944 110.7 48.2 -55.0 -51.3 17.0 -1.0 28.7 527 157 B L H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.887 108.2 53.7 -59.1 -42.5 14.9 2.2 28.9 528 158 B A H < S+ 0 0 13 -4,-2.1 4,-0.3 1,-0.2 -1,-0.2 0.877 113.1 44.3 -60.6 -39.9 18.0 4.3 29.9 529 159 B Q H >< S+ 0 0 1 -4,-1.8 3,-1.1 1,-0.2 -2,-0.2 0.894 113.3 49.6 -68.7 -44.4 19.8 3.0 26.8 530 160 B C H >< S+ 0 0 0 -4,-2.6 3,-2.0 1,-0.2 -2,-0.2 0.789 98.4 67.7 -68.6 -28.1 16.7 3.4 24.5 531 161 B L G >< S+ 0 0 38 -4,-2.1 3,-1.3 1,-0.3 -1,-0.2 0.680 83.3 75.2 -66.0 -17.2 16.2 7.0 25.7 532 162 B R G < S+ 0 0 60 -3,-1.1 -1,-0.3 -4,-0.3 -2,-0.2 0.676 75.5 82.7 -63.8 -16.8 19.5 7.8 23.9 533 163 B G G < S- 0 0 3 -3,-2.0 2,-0.3 -4,-0.1 -1,-0.2 0.543 107.6 -16.2 -67.5 -9.6 17.4 7.6 20.7 534 164 B G S < S- 0 0 17 -3,-1.3 -265,-0.1 -382,-0.1 5,-0.0 -0.963 84.7 -63.7-171.1-177.1 16.1 11.1 21.1 535 165 B T > - 0 0 71 -2,-0.3 3,-1.3 1,-0.1 4,-0.3 -0.413 52.1-106.1 -75.9 163.5 15.7 14.2 23.3 536 166 B P G > S+ 0 0 113 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 0.867 122.8 58.5 -53.6 -38.5 13.4 14.0 26.4 537 167 B D G 3 S+ 0 0 145 1,-0.2 87,-0.0 87,-0.0 0, 0.0 0.647 98.8 60.3 -64.9 -18.9 10.9 16.1 24.5 538 168 B E G < S+ 0 0 15 -3,-1.3 86,-2.3 85,-0.1 2,-0.4 0.516 77.9 110.3 -91.2 -3.7 10.8 13.4 21.7 539 169 B V E < +L 623 0B 11 -3,-1.3 84,-0.2 -4,-0.3 3,-0.1 -0.578 31.8 167.3 -76.8 125.9 9.5 10.6 24.0 540 170 B A E + 0 0 28 82,-2.8 2,-0.3 -2,-0.4 83,-0.2 0.830 65.3 0.1 -95.1 -54.9 6.0 9.5 23.4 541 171 B K E -L 622 0B 74 81,-2.1 81,-2.8 66,-0.0 2,-0.5 -0.985 50.6-143.5-140.0 145.2 5.8 6.2 25.4 542 172 B L E -Lm 621 607B 0 64,-2.8 66,-3.2 -2,-0.3 2,-0.6 -0.949 22.7-164.3-101.4 129.1 7.9 3.9 27.6 543 173 B V E -Lm 620 608B 2 77,-2.9 77,-2.3 -2,-0.5 2,-0.3 -0.927 0.7-162.4-120.0 107.2 7.1 0.3 27.0 544 174 B L E - m 0 609B 0 64,-3.0 66,-2.5 -2,-0.6 2,-0.3 -0.695 14.4-137.0 -83.2 136.9 8.3 -2.2 29.6 545 175 B T E - 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0 0 37 -2,-0.3 3,-0.6 1,-0.1 4,-0.4 -0.441 40.2 -99.9 -86.2 169.5 -5.4 -18.0 47.5 714 344 B F T >> S+ 0 0 10 -152,-0.5 3,-1.7 -155,-0.3 4,-0.5 0.895 119.1 52.8 -55.0 -51.3 -3.3 -16.5 44.6 715 345 B P H 3> S+ 0 0 44 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.763 99.5 66.4 -62.1 -22.8 -6.0 -14.1 43.2 716 346 B A H <> S+ 0 0 34 -3,-0.6 4,-2.9 1,-0.2 5,-0.2 0.655 84.0 74.5 -71.2 -18.3 -6.4 -12.7 46.7 717 347 B I H <> S+ 0 0 1 -3,-1.7 4,-2.1 -4,-0.4 -1,-0.2 0.984 107.1 31.1 -57.5 -57.1 -2.9 -11.2 46.7 718 348 B V H X S+ 0 0 15 -4,-0.5 4,-2.6 1,-0.2 -1,-0.2 0.821 116.2 62.2 -75.1 -29.1 -3.8 -8.4 44.3 719 349 B G H X S+ 0 0 33 -4,-1.3 4,-2.0 2,-0.2 -1,-0.2 0.920 107.3 43.0 -55.4 -47.7 -7.3 -8.4 45.8 720 350 B I H X S+ 0 0 11 -4,-2.9 4,-2.6 2,-0.2 5,-0.3 0.895 109.8 56.2 -71.0 -39.8 -5.9 -7.4 49.2 721 351 B I H X S+ 0 0 0 -4,-2.1 4,-2.7 -5,-0.2 5,-0.2 0.955 109.8 47.4 -52.0 -50.4 -3.5 -4.9 47.6 722 352 B A H X S+ 0 0 16 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.918 111.7 49.5 -57.3 -46.9 -6.6 -3.2 46.0 723 353 B D H X S+ 0 0 105 -4,-2.0 4,-0.8 1,-0.2 -1,-0.2 0.872 113.5 45.4 -65.1 -38.9 -8.6 -3.2 49.3 724 354 B V H >< S+ 0 0 1 -4,-2.6 3,-0.7 2,-0.2 4,-0.2 0.936 113.8 49.1 -68.2 -48.8 -5.7 -1.7 51.3 725 355 B L H >< S+ 0 0 6 -4,-2.7 3,-2.0 -5,-0.3 -2,-0.2 0.900 106.4 56.0 -54.9 -44.6 -5.0 1.0 48.7 726 356 B H H 3< S+ 0 0 117 -4,-2.5 3,-0.3 1,-0.3 -1,-0.2 0.775 112.1 43.7 -65.4 -23.6 -8.6 2.0 48.4 727 357 B A T << S+ 0 0 33 -4,-0.8 3,-0.3 -3,-0.7 -1,-0.3 0.358 99.3 80.6 -93.0 3.2 -8.6 2.6 52.2 728 358 B A X + 0 0 0 -3,-2.0 3,-2.6 -4,-0.2 -1,-0.2 0.237 43.1 121.0-104.9 13.0 -5.3 4.4 52.2 729 359 B D G > + 0 0 119 1,-0.3 3,-1.7 -3,-0.3 -1,-0.2 0.670 65.8 70.8 -58.3 -23.2 -5.9 8.0 51.0 730 360 B Q G > S+ 0 0 119 -3,-0.3 3,-0.6 1,-0.3 -1,-0.3 0.700 93.2 61.9 -60.3 -19.5 -4.4 9.6 54.2 731 361 B W G < S+ 0 0 43 -3,-2.6 -40,-2.9 1,-0.2 -39,-0.3 0.333 72.4 93.3 -92.8 6.4 -1.1 8.4 52.9 732 362 B A G < + 0 0 38 -3,-1.7 -1,-0.2 -42,-0.2 -2,-0.1 0.636 63.5 104.6 -71.9 -12.5 -1.2 10.5 49.7 733 363 B V S < S- 0 0 110 -3,-0.6 -42,-0.5 -4,-0.2 -41,-0.0 -0.434 84.2-105.7 -67.3 140.7 0.7 13.2 51.6 734 364 B E - 0 0 109 -44,-0.2 2,-0.2 -2,-0.1 -1,-0.1 -0.467 36.0-114.9 -65.6 136.0 4.4 13.5 50.7 735 365 B P - 0 0 6 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.511 24.3-170.7 -74.3 141.2 6.8 12.1 53.3 736 366 B A S S+ 0 0 71 -2,-0.2 2,-0.3 1,-0.2 -2,-0.0 0.724 72.3 18.3 -94.8 -30.6 9.1 14.6 55.1 737 367 B T S > S- 0 0 65 1,-0.1 4,-1.2 0, 0.0 3,-0.5 -0.851 81.5-104.4-135.9 167.0 11.2 11.9 56.8 738 368 B V H > S+ 0 0 15 -2,-0.3 4,-2.4 1,-0.2 5,-0.1 0.858 119.6 62.1 -59.1 -36.5 12.1 8.2 56.6 739 369 B D H > S+ 0 0 88 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.849 97.1 56.7 -61.2 -34.9 9.8 7.7 59.6 740 370 B D H > S+ 0 0 53 -3,-0.5 4,-1.8 2,-0.2 -1,-0.2 0.917 108.5 47.2 -60.2 -45.6 6.8 9.0 57.6 741 371 B V H X S+ 0 0 0 -4,-1.2 4,-2.3 2,-0.2 -2,-0.2 0.933 111.9 50.5 -58.5 -46.4 7.6 6.2 55.0 742 372 B L H X S+ 0 0 47 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.875 107.7 53.1 -61.9 -40.4 7.9 3.6 57.8 743 373 B D H X S+ 0 0 66 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.885 108.9 49.8 -59.5 -42.1 4.5 4.7 59.3 744 374 B A H X S+ 0 0 0 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.928 111.7 47.5 -64.5 -44.8 2.8 4.2 56.0 745 375 B Q H X S+ 0 0 19 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.876 110.7 53.0 -62.1 -40.9 4.3 0.7 55.6 746 376 B R H X S+ 0 0 122 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.935 111.5 45.3 -59.0 -49.7 3.3 -0.1 59.2 747 377 B W H X S+ 0 0 44 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.913 113.3 49.9 -60.2 -46.3 -0.3 1.0 58.5 748 378 B A H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.867 111.2 48.8 -64.5 -40.3 -0.4 -1.0 55.2 749 379 B R H X S+ 0 0 96 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.930 113.8 45.8 -60.1 -52.8 1.0 -4.2 56.8 750 380 B E H X S+ 0 0 78 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.907 113.4 51.2 -56.9 -44.0 -1.6 -4.0 59.6 751 381 B R H X S+ 0 0 112 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.916 111.2 46.1 -62.5 -47.2 -4.3 -3.3 57.1 752 382 B A H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.844 109.2 57.0 -63.0 -36.0 -3.4 -6.3 54.9 753 383 B Q H X S+ 0 0 84 -4,-2.2 4,-2.4 2,-0.2 6,-0.3 0.926 107.9 46.5 -61.6 -44.4 -3.2 -8.5 58.0 754 384 B R H X>S+ 0 0 133 -4,-2.1 4,-2.2 1,-0.2 5,-1.1 0.894 111.3 52.3 -63.7 -42.1 -6.8 -7.6 58.9 755 385 B A H <5S+ 0 0 47 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.889 113.1 44.8 -59.2 -42.6 -7.9 -8.2 55.3 756 386 B V H <5S+ 0 0 25 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.891 119.1 40.1 -68.6 -42.9 -6.2 -11.7 55.4 757 387 B S H <5S- 0 0 73 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.738 107.2-118.5 -80.7 -26.7 -7.5 -12.7 58.8 758 388 B G T <5 0 0 71 -4,-2.2 -3,-0.2 -5,-0.2 -4,-0.1 0.543 360.0 360.0 94.0 13.5 -11.0 -11.3 58.4 759 389 B M < 0 0 163 -5,-1.1 -4,-0.2 -6,-0.3 -5,-0.2 0.575 360.0 360.0-106.5 360.0 -10.6 -8.9 61.4