==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 01-SEP-09 3IVS . COMPND 2 MOLECULE: HOMOCITRATE SYNTHASE, MITOCHONDRIAL; . SOURCE 2 ORGANISM_SCIENTIFIC: SCHIZOSACCHAROMYCES POMBE; . AUTHOR S.L.BULFER,E.M.SCOTT,J.-F.COUTURE,L.PILLUS,R.C.TRIEVEL . 723 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25517.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 504 69.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 94 13.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.6 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 . 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 . 34 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 98 13.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 229 31.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 2.2 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 0 0 2 2 1 2 4 6 0 0 8 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 4 4 4 2 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 PARALLEL BRIDGES PER LADDER . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 0 0 0 0 2 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 24 A N >> 0 0 155 0, 0.0 3,-1.1 0, 0.0 4,-0.5 0.000 360.0 360.0 360.0 -48.6 68.5 10.7 -4.7 2 25 A P G >4 + 0 0 121 0, 0.0 3,-1.6 0, 0.0 4,-0.3 0.894 360.0 60.9 -51.4 -36.4 70.0 9.4 -7.9 3 26 A S G >> S+ 0 0 36 1,-0.3 3,-1.7 2,-0.2 4,-0.5 0.768 88.9 70.7 -57.0 -34.0 67.0 6.9 -7.9 4 27 A D G X4 S+ 0 0 107 -3,-1.1 3,-0.7 1,-0.3 -1,-0.3 0.733 85.1 68.8 -54.7 -28.5 64.6 9.8 -8.0 5 28 A F G << S+ 0 0 189 -3,-1.6 -1,-0.3 -4,-0.5 -2,-0.2 0.788 100.6 46.9 -62.9 -27.3 65.7 10.4 -11.7 6 29 A L G <4 S+ 0 0 62 -3,-1.7 -1,-0.2 -4,-0.3 -2,-0.2 0.615 86.0 115.8 -89.2 -13.2 64.0 7.2 -12.7 7 30 A S << - 0 0 30 -3,-0.7 199,-0.3 -4,-0.5 3,-0.2 -0.314 44.1-169.8 -65.3 135.4 60.7 7.9 -10.9 8 31 A R > + 0 0 71 197,-3.3 3,-2.0 201,-0.2 198,-0.2 0.075 46.7 123.2-108.7 23.5 57.6 8.3 -13.0 9 32 A V T 3 S+ 0 0 17 1,-0.3 3,-0.2 196,-0.3 -1,-0.1 0.776 87.0 30.0 -60.9 -24.3 55.3 9.6 -10.3 10 33 A N T 3 S+ 0 0 79 -3,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.021 122.1 50.9-121.7 32.5 54.6 12.7 -12.3 11 34 A N S < S+ 0 0 85 -3,-2.0 2,-0.3 2,-0.0 -1,-0.2 -0.425 78.9 112.5-162.5 75.8 54.9 11.4 -15.8 12 35 A F - 0 0 2 -3,-0.2 2,-0.4 200,-0.0 199,-0.2 -0.901 51.6-123.3-145.6 170.0 52.9 8.2 -16.4 13 36 A S E -a 211 0A 23 197,-2.6 199,-2.3 -2,-0.3 2,-0.5 -0.919 16.0-137.3-121.1 144.5 50.0 6.8 -18.4 14 37 A I E -a 212 0A 0 -2,-0.4 35,-1.4 197,-0.2 2,-0.8 -0.884 6.1-156.3 -99.3 130.9 46.9 5.1 -17.2 15 38 A I E -ab 213 49A 0 197,-2.6 199,-1.7 -2,-0.5 2,-0.4 -0.933 21.0-144.6-101.6 104.3 45.7 2.1 -19.1 16 39 A E E +ab 214 50A 1 33,-2.9 35,-3.0 -2,-0.8 3,-0.2 -0.604 22.5 178.7 -79.9 126.9 42.0 2.0 -18.2 17 40 A S >>> + 0 0 0 197,-3.2 5,-2.5 -2,-0.4 3,-1.8 0.121 43.9 114.2-122.0 18.4 40.8 -1.5 -17.9 18 41 A T T 345S+ 0 0 0 1,-0.3 -1,-0.2 3,-0.2 197,-0.1 0.836 85.8 50.4 -54.1 -30.8 37.2 -1.2 -16.8 19 42 A L T 345S+ 0 0 3 32,-0.4 34,-1.8 -3,-0.2 -1,-0.3 0.261 126.1 23.1 -98.9 11.5 36.4 -2.8 -20.3 20 43 A R T X45S+ 0 0 21 -3,-1.8 3,-0.7 32,-0.3 4,-0.5 0.377 137.0 24.8-126.7 -73.5 38.9 -5.7 -19.8 21 44 A E G ><5S+ 0 0 2 -4,-0.6 3,-2.1 1,-0.2 4,-0.2 0.912 120.7 60.4 -54.1 -48.0 39.5 -6.4 -16.1 22 45 A G G > - 0 0 90 -2,-0.1 4,-2.4 1,-0.1 3,-0.4 -0.507 36.6 -93.1 -90.7 172.7 26.4 -4.6 -23.7 32 55 A T H > S+ 0 0 40 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.863 126.2 52.2 -52.0 -43.4 27.9 -2.7 -26.7 33 56 A E H > S+ 0 0 137 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.892 110.5 46.7 -63.4 -42.6 26.0 0.5 -25.9 34 57 A K H > S+ 0 0 51 -3,-0.4 4,-2.3 2,-0.2 -2,-0.2 0.898 111.2 51.6 -68.9 -42.3 27.3 0.6 -22.3 35 58 A K H X S+ 0 0 15 -4,-2.4 4,-3.0 2,-0.2 -1,-0.2 0.870 109.7 50.8 -57.2 -42.3 30.9 -0.1 -23.3 36 59 A I H X S+ 0 0 36 -4,-2.0 4,-2.5 -5,-0.2 -2,-0.2 0.899 109.8 49.2 -66.5 -41.4 30.6 2.7 -25.8 37 60 A Q H X S+ 0 0 77 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.886 114.4 46.5 -60.3 -42.3 29.3 5.1 -23.1 38 61 A I H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.940 112.1 49.2 -69.0 -45.2 32.1 4.0 -20.8 39 62 A A H X S+ 0 0 0 -4,-3.0 4,-2.2 1,-0.2 -2,-0.2 0.917 112.8 47.8 -59.0 -48.2 34.8 4.3 -23.5 40 63 A K H X S+ 0 0 114 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.891 112.9 47.7 -58.2 -44.6 33.6 7.8 -24.4 41 64 A A H X S+ 0 0 30 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.876 111.3 51.3 -68.2 -35.9 33.5 9.0 -20.8 42 65 A L H X>S+ 0 0 0 -4,-2.5 5,-1.4 2,-0.2 4,-1.4 0.893 110.1 49.9 -65.4 -40.6 37.0 7.6 -20.1 43 66 A D H <5S+ 0 0 36 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.901 111.9 47.0 -64.4 -45.6 38.3 9.5 -23.2 44 67 A N H <5S+ 0 0 77 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.906 106.8 58.6 -62.1 -40.4 36.7 12.7 -22.0 45 68 A F H <5S- 0 0 1 -4,-2.3 203,-2.3 -5,-0.2 -1,-0.2 0.819 118.9-113.3 -59.2 -36.2 38.1 12.1 -18.5 46 69 A G T <5 + 0 0 22 -4,-1.4 -3,-0.2 1,-0.3 -2,-0.1 0.541 56.9 155.2 117.9 11.0 41.6 12.0 -20.1 47 70 A V < - 0 0 3 -5,-1.4 -1,-0.3 1,-0.1 28,-0.1 -0.400 39.7-139.8 -62.9 142.4 43.1 8.5 -19.8 48 71 A D S S+ 0 0 55 -34,-0.4 28,-2.8 1,-0.2 2,-0.3 0.768 78.9 20.8 -76.9 -26.4 45.7 7.8 -22.4 49 72 A Y E -bc 15 76A 26 -35,-1.4 -33,-2.9 26,-0.3 2,-0.4 -0.991 55.4-161.5-140.8 148.9 44.6 4.2 -23.1 50 73 A I E -bc 16 77A 0 26,-2.2 28,-3.2 -2,-0.3 2,-0.4 -0.991 17.3-149.1-124.1 139.4 41.7 1.9 -22.7 51 74 A E E - c 0 78A 0 -35,-3.0 -32,-0.4 -2,-0.4 2,-0.3 -0.907 10.6-159.0-110.1 140.8 42.1 -1.8 -22.9 52 75 A L E - c 0 79A 6 26,-2.3 28,-0.6 -2,-0.4 -32,-0.3 -0.876 30.1 -91.3-116.8 147.6 39.5 -4.2 -24.1 53 76 A T - 0 0 3 -34,-1.8 12,-0.1 -2,-0.3 604,-0.1 -0.253 65.0 -81.2 -46.5 131.0 38.8 -7.9 -23.6 54 77 A S > - 0 0 6 602,-0.2 3,-1.7 1,-0.2 4,-0.3 -0.111 31.2-133.7 -38.0 130.1 40.5 -9.9 -26.3 55 78 A P T 3 S+ 0 0 4 0, 0.0 7,-0.5 0, 0.0 3,-0.4 0.645 106.8 65.9 -65.6 -14.0 38.4 -10.0 -29.6 56 79 A V T 3 S+ 0 0 52 1,-0.2 3,-0.1 5,-0.1 -2,-0.1 0.704 79.1 82.8 -77.1 -22.3 39.1 -13.7 -29.5 57 80 A A S < S- 0 0 19 -3,-1.7 2,-0.3 1,-0.1 -1,-0.2 0.849 110.5 -33.3 -51.9 -41.3 37.0 -14.2 -26.3 58 81 A S > - 0 0 36 -3,-0.4 4,-2.1 -4,-0.3 -1,-0.1 -0.960 63.3 -91.2-170.7 168.8 33.7 -14.3 -28.3 59 82 A E H > S+ 0 0 104 -2,-0.3 4,-2.2 1,-0.2 5,-0.1 0.863 124.5 49.0 -58.1 -44.1 31.9 -13.0 -31.3 60 83 A Q H > S+ 0 0 91 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.861 108.1 54.1 -69.0 -37.3 30.4 -10.0 -29.4 61 84 A S H > S+ 0 0 4 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.912 108.8 49.6 -58.9 -43.1 33.9 -9.2 -28.0 62 85 A R H X S+ 0 0 71 -4,-2.1 4,-2.1 -7,-0.5 -2,-0.2 0.946 113.5 46.6 -59.4 -48.5 35.3 -9.1 -31.6 63 86 A Q H X S+ 0 0 86 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.830 111.9 49.0 -62.1 -38.2 32.4 -6.8 -32.6 64 87 A D H X S+ 0 0 4 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.864 108.6 53.5 -75.4 -38.3 32.7 -4.4 -29.7 65 88 A C H X S+ 0 0 1 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.938 111.8 45.9 -56.0 -51.6 36.4 -4.1 -30.2 66 89 A E H X S+ 0 0 52 -4,-2.1 4,-0.8 1,-0.2 -2,-0.2 0.911 113.6 48.9 -57.3 -47.2 35.8 -3.1 -33.8 67 90 A A H < S+ 0 0 24 -4,-2.2 3,-0.5 1,-0.2 -2,-0.2 0.869 110.0 50.6 -63.4 -40.6 33.0 -0.6 -32.8 68 91 A I H >< S+ 0 0 2 -4,-2.6 3,-1.3 1,-0.2 5,-0.4 0.887 107.6 53.9 -68.9 -37.3 35.1 1.0 -30.1 69 92 A C H 3< S+ 0 0 33 -4,-2.0 3,-0.5 1,-0.2 -1,-0.2 0.689 103.1 58.0 -66.6 -20.7 38.0 1.6 -32.6 70 93 A K T 3< S+ 0 0 155 -4,-0.8 -1,-0.2 -3,-0.5 -2,-0.2 0.460 83.5 86.9 -88.0 -0.3 35.6 3.3 -35.0 71 94 A L S < S- 0 0 54 -3,-1.3 -1,-0.2 -4,-0.2 -2,-0.1 0.669 91.3-128.8 -73.5 -18.3 34.7 6.0 -32.4 72 95 A G + 0 0 72 -3,-0.5 -3,-0.1 -4,-0.2 -2,-0.1 0.780 44.6 172.2 70.4 28.5 37.5 8.4 -33.2 73 96 A L - 0 0 32 -5,-0.4 -1,-0.1 1,-0.1 4,-0.1 -0.261 37.5-134.7 -64.5 157.1 38.5 8.6 -29.5 74 97 A K S S+ 0 0 91 2,-0.1 -1,-0.1 -25,-0.0 -2,-0.0 0.881 84.5 79.1 -78.9 -43.7 41.7 10.4 -28.6 75 98 A C S S- 0 0 7 1,-0.1 -26,-0.3 -28,-0.1 2,-0.2 -0.260 92.5-106.8 -59.8 152.1 43.0 7.7 -26.2 76 99 A K E -c 49 0A 89 -28,-2.8 -26,-2.2 21,-0.0 2,-0.5 -0.582 27.2-131.1 -80.4 146.7 44.6 4.7 -27.8 77 100 A I E -c 50 0A 6 -2,-0.2 20,-2.0 -28,-0.2 21,-1.2 -0.898 28.8-175.0-102.2 124.0 42.6 1.4 -27.8 78 101 A L E +cd 51 98A 0 -28,-3.2 -26,-2.3 -2,-0.5 2,-0.3 -0.810 8.8 177.0-114.1 154.4 44.5 -1.6 -26.6 79 102 A T E -cd 52 99A 0 19,-2.0 21,-2.3 -2,-0.3 2,-0.3 -0.889 17.6-132.4-141.6-177.7 43.7 -5.3 -26.5 80 103 A H E - d 0 100A 7 -28,-0.6 2,-0.3 -2,-0.3 21,-0.2 -0.902 17.6-176.6-133.7 159.4 45.5 -8.5 -25.4 81 104 A I E - d 0 101A 2 19,-3.2 21,-2.2 -2,-0.3 2,-0.2 -0.919 32.0 -95.9-143.9 172.0 46.0 -12.0 -26.9 82 105 A R E - d 0 102A 130 -2,-0.3 2,-2.6 19,-0.2 6,-0.2 -0.495 55.1 -93.0 -77.9 161.4 47.6 -15.4 -26.2 83 106 A C S S+ 0 0 30 19,-0.8 2,-0.3 -2,-0.2 -1,-0.1 -0.486 91.5 114.5 -77.2 71.4 51.0 -16.0 -27.6 84 107 A H > - 0 0 87 -2,-2.6 4,-1.9 1,-0.1 5,-0.1 -0.995 69.2-133.4-147.7 138.7 49.4 -17.5 -30.7 85 108 A X H > S+ 0 0 21 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.840 104.3 56.0 -58.4 -43.4 49.3 -16.5 -34.4 86 109 A D H > S+ 0 0 99 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.913 109.0 48.5 -59.0 -45.0 45.6 -17.0 -34.9 87 110 A D H > S+ 0 0 4 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.941 111.0 50.9 -57.1 -49.0 44.8 -14.7 -32.0 88 111 A A H X S+ 0 0 0 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.899 107.0 53.3 -60.2 -43.2 47.3 -12.1 -33.5 89 112 A R H X S+ 0 0 116 -4,-2.7 4,-1.3 2,-0.2 -1,-0.2 0.939 112.3 45.1 -56.4 -48.6 45.6 -12.3 -36.9 90 113 A V H >X S+ 0 0 45 -4,-2.1 4,-0.8 1,-0.2 3,-0.6 0.975 113.1 50.0 -58.4 -56.4 42.2 -11.6 -35.4 91 114 A A H ><>S+ 0 0 0 -4,-2.7 3,-1.1 1,-0.2 5,-0.6 0.872 107.3 53.0 -52.1 -47.0 43.5 -8.7 -33.1 92 115 A V H ><5S+ 0 0 25 -4,-2.6 3,-0.9 1,-0.2 -1,-0.2 0.858 104.9 55.4 -60.5 -36.9 45.3 -6.8 -35.9 93 116 A E H <<5S+ 0 0 157 -4,-1.3 -1,-0.2 -3,-0.6 -2,-0.2 0.688 92.5 74.4 -66.7 -22.3 42.2 -6.7 -38.2 94 117 A T T <<5S- 0 0 9 -3,-1.1 -1,-0.2 -4,-0.8 -25,-0.2 0.667 106.8-112.4 -72.8 -20.2 40.1 -5.0 -35.5 95 118 A G T < 5 + 0 0 47 -3,-0.9 -18,-0.2 -4,-0.4 -3,-0.1 0.471 60.0 156.0 101.0 4.6 41.6 -1.6 -35.7 96 119 A V < - 0 0 5 -5,-0.6 -1,-0.2 1,-0.1 -18,-0.2 -0.266 44.1-140.8 -65.8 149.9 43.3 -1.5 -32.3 97 120 A D S S+ 0 0 65 -20,-2.0 29,-2.0 1,-0.2 2,-0.3 0.694 82.4 21.4 -80.6 -20.2 46.3 0.7 -31.7 98 121 A G E -de 78 126A 0 -21,-1.2 -19,-2.0 27,-0.2 2,-0.4 -0.998 57.9-156.6-155.8 144.4 48.1 -1.9 -29.6 99 122 A V E -de 79 127A 0 27,-2.9 29,-2.3 -2,-0.3 2,-0.6 -0.985 10.6-151.1-127.2 125.5 48.3 -5.6 -28.8 100 123 A D E -de 80 128A 5 -21,-2.3 -19,-3.2 -2,-0.4 2,-0.7 -0.864 7.5-153.0 -94.6 118.3 49.6 -7.3 -25.6 101 124 A V E -de 81 129A 0 27,-3.2 29,-2.7 -2,-0.6 2,-0.4 -0.832 20.8-162.2 -88.2 112.8 51.1 -10.8 -26.1 102 125 A V E +de 82 130A 8 -21,-2.2 -19,-0.8 -2,-0.7 2,-0.3 -0.853 14.3 175.7-108.6 131.8 50.6 -12.5 -22.7 103 126 A I E - e 0 131A 15 27,-2.6 29,-2.2 -2,-0.4 2,-0.4 -0.881 17.6-143.5-123.6 161.9 52.5 -15.6 -21.5 104 127 A G E e 0 132A 48 -2,-0.3 29,-0.1 27,-0.2 27,-0.1 -0.990 360.0 360.0-128.4 124.9 52.3 -17.5 -18.1 105 128 A T 0 0 75 27,-0.6 31,-0.1 -2,-0.4 -2,-0.0 -0.812 360.0 360.0-108.5 360.0 55.3 -19.1 -16.4 106 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 107 142 A T > 0 0 142 0, 0.0 4,-1.0 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 -42.0 63.2 -21.4 -25.6 108 143 A Y H > + 0 0 74 2,-0.2 4,-2.0 3,-0.1 5,-0.2 0.643 360.0 59.6 -86.9 -21.5 59.9 -22.4 -27.5 109 144 A I H > S+ 0 0 64 2,-0.2 4,-3.1 3,-0.2 5,-0.2 0.957 105.6 46.9 -62.4 -52.0 58.4 -19.3 -25.7 110 145 A I H > S+ 0 0 56 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.867 113.2 48.5 -61.9 -40.2 61.0 -17.1 -27.4 111 146 A D H X S+ 0 0 114 -4,-1.0 4,-1.8 2,-0.2 -1,-0.2 0.942 116.6 40.9 -63.9 -51.6 60.5 -18.7 -30.9 112 147 A S H X S+ 0 0 40 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.938 116.2 50.6 -60.5 -49.7 56.6 -18.4 -30.7 113 148 A A H X S+ 0 0 0 -4,-3.1 4,-3.0 -5,-0.2 5,-0.2 0.865 106.6 56.0 -56.9 -40.3 56.8 -15.0 -29.2 114 149 A T H X S+ 0 0 39 -4,-2.1 4,-2.6 -5,-0.2 5,-0.3 0.942 108.0 47.1 -59.1 -50.0 59.2 -13.8 -31.9 115 150 A E H X S+ 0 0 117 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.950 116.1 44.0 -56.7 -52.2 56.8 -14.8 -34.7 116 151 A V H X S+ 0 0 2 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.930 114.7 48.7 -61.4 -45.8 53.8 -13.1 -33.0 117 152 A I H X S+ 0 0 0 -4,-3.0 4,-2.7 1,-0.2 5,-0.2 0.944 113.2 46.5 -59.9 -50.4 55.7 -9.9 -32.1 118 153 A N H X S+ 0 0 73 -4,-2.6 4,-2.0 -5,-0.2 -1,-0.2 0.826 110.7 53.7 -64.6 -33.9 57.2 -9.5 -35.6 119 154 A F H < S+ 0 0 55 -4,-2.1 4,-0.4 -5,-0.3 -1,-0.2 0.941 111.0 44.9 -60.8 -49.7 53.8 -10.1 -37.2 120 155 A V H ><>S+ 0 0 0 -4,-2.3 3,-1.7 1,-0.2 5,-1.5 0.949 113.4 49.8 -63.4 -48.9 52.1 -7.4 -35.0 121 156 A K H ><5S+ 0 0 74 -4,-2.7 3,-2.0 1,-0.3 -1,-0.2 0.877 103.8 60.5 -54.7 -41.3 55.0 -4.9 -35.6 122 157 A S T 3<5S+ 0 0 99 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.603 100.7 56.1 -64.9 -9.7 54.7 -5.6 -39.4 123 158 A K T < 5S- 0 0 53 -3,-1.7 -1,-0.3 -4,-0.4 -2,-0.2 0.432 118.2-111.1-100.7 1.1 51.1 -4.3 -39.3 124 159 A G T < 5S+ 0 0 75 -3,-2.0 2,-0.4 1,-0.3 -3,-0.2 0.593 75.1 135.8 81.6 14.4 52.2 -0.9 -37.8 125 160 A I < - 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0 0 0 -5,-2.6 -1,-0.3 -6,-0.1 -22,-0.2 -0.322 27.4-165.2 -61.7 150.4 57.1 -1.9 14.5 578 245 B T + 0 0 1 -24,-2.4 -197,-2.7 1,-0.2 2,-0.4 0.635 64.2 47.2-116.7 -21.4 55.4 -4.1 17.1 579 246 B H E -ls 381 555E 5 -25,-2.1 -23,-2.2 -199,-0.2 2,-0.4 -0.990 59.3-168.2-132.4 130.1 51.9 -2.6 17.4 580 247 B I E -ls 382 556E 0 -199,-2.3 -197,-2.9 -2,-0.4 2,-0.3 -0.981 17.7-135.3-120.1 129.2 49.4 -1.5 14.7 581 248 B D E +l 383 0E 5 -25,-2.6 -23,-0.3 -2,-0.4 13,-0.3 -0.654 31.6 173.3 -73.0 132.9 46.2 0.5 15.1 582 249 B T E -l 384 0E 0 -199,-1.8 -197,-3.2 -2,-0.3 2,-0.3 -0.866 18.5-154.7-130.5 170.4 43.2 -0.8 13.2 583 250 B S B > -u 595 0G 0 11,-1.4 3,-2.4 -2,-0.3 13,-2.2 -0.991 35.4 -97.6-143.0 144.4 39.6 -0.0 13.1 584 251 B I G > S- 0 0 1 -2,-0.3 3,-1.6 1,-0.3 10,-0.0 -0.492 113.5 -4.0 -64.6 124.8 36.6 -2.2 12.1 585 252 B L G 3 S- 0 0 2 -2,-0.3 -1,-0.3 1,-0.3 -315,-0.1 0.609 119.4 -84.1 61.6 14.8 35.9 -1.5 8.5 586 253 B G G < S+ 0 0 3 -3,-2.4 7,-1.8 8,-0.2 -1,-0.3 0.507 76.1 172.2 71.3 6.9 38.6 1.2 8.8 587 254 B I < + 0 0 2 -3,-1.6 2,-0.3 5,-0.2 -1,-0.2 -0.109 21.3 95.5 -58.9 140.2 36.0 3.6 10.2 588 255 B G S S- 0 0 0 2,-0.4 -194,-0.5 -196,-0.2 -198,-0.1 -0.970 73.6 -10.4 174.2-162.1 37.4 6.9 11.5 589 256 B E S > S- 0 0 3 -2,-0.3 3,-2.5 -196,-0.2 -196,-0.1 -0.369 119.9 -21.6 -59.0 137.6 38.2 10.5 10.7 590 257 B R T 3 S- 0 0 1 -310,-1.0 -2,-0.4 -198,-0.3 -196,-0.3 -0.318 141.1 -16.6 55.1-130.8 37.7 11.1 6.9 591 258 B N T 3 S- 0 0 11 -313,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.268 105.7-134.7 -86.5 13.2 38.0 7.7 5.1 592 259 B G < - 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0 0 67 -2,-0.7 3,-1.1 4,-0.1 2,-0.1 -0.922 39.8 -13.9-121.1 145.7 18.8 -12.6 -9.7 687 354 B G T >> S- 0 0 49 -2,-0.4 4,-1.3 1,-0.2 3,-0.6 -0.429 125.2 -11.5 78.0-140.4 16.1 -13.2 -7.1 688 355 B W H 3> S+ 0 0 110 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.667 128.7 70.2 -72.7 -16.2 16.4 -16.1 -4.6 689 356 B N H <> S+ 0 0 107 -3,-1.1 4,-1.7 2,-0.2 -1,-0.2 0.884 102.0 44.7 -62.4 -41.6 19.2 -17.5 -6.7 690 357 B A H <> S+ 0 0 14 -3,-0.6 4,-2.1 2,-0.2 5,-0.2 0.922 115.3 47.3 -65.7 -46.5 21.4 -14.5 -5.5 691 358 B I H X S+ 0 0 3 -4,-1.3 4,-3.1 1,-0.2 5,-0.2 0.940 113.4 47.1 -61.6 -52.4 20.2 -14.9 -1.9 692 359 B K H X S+ 0 0 83 -4,-2.8 4,-2.3 2,-0.2 5,-0.2 0.876 110.7 52.1 -57.6 -44.8 20.8 -18.7 -1.8 693 360 B S H X S+ 0 0 28 -4,-1.7 4,-1.8 -5,-0.2 -1,-0.2 0.943 115.7 39.8 -61.2 -48.4 24.2 -18.5 -3.4 694 361 B R H X S+ 0 0 7 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.927 113.8 53.5 -68.1 -45.4 25.5 -15.9 -0.9 695 362 B A H <>S+ 0 0 2 -4,-3.1 5,-2.7 1,-0.2 -2,-0.2 0.880 111.9 46.3 -55.3 -41.4 23.7 -17.5 2.2 696 363 B E H ><5S+ 0 0 81 -4,-2.3 3,-1.0 3,-0.2 -1,-0.2 0.850 109.0 53.7 -71.1 -37.7 25.4 -20.9 1.3 697 364 B Q H 3<5S+ 0 0 3 -4,-1.8 -21,-2.1 1,-0.2 -20,-0.3 0.867 110.5 48.6 -61.6 -36.7 28.8 -19.2 0.8 698 365 B L T 3<5S- 0 0 4 -4,-2.1 -1,-0.2 -23,-0.2 -2,-0.2 0.383 112.6-121.0 -83.7 2.6 28.4 -17.7 4.3 699 366 B N T < 5 + 0 0 53 -3,-1.0 2,-0.4 1,-0.2 -3,-0.2 0.828 56.7 157.0 57.6 34.8 27.4 -21.1 5.8 700 367 B L < - 0 0 9 -5,-2.7 2,-0.8 30,-0.2 -1,-0.2 -0.733 35.7-143.9 -85.0 136.8 24.1 -19.7 7.0 701 368 B H 0 0 157 28,-0.6 28,-0.1 -2,-0.4 -5,-0.0 -0.887 360.0 360.0-111.2 107.2 21.6 -22.5 7.5 702 369 B L 0 0 72 -2,-0.8 -2,-0.0 2,-0.1 -6,-0.0 -0.848 360.0 360.0-141.1 360.0 18.1 -21.3 6.5 703 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 704 373 B Q 0 0 129 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 0.000 360.0 360.0 360.0 -46.5 13.6 -18.0 7.2 705 374 B A >> + 0 0 33 1,-0.2 4,-0.8 2,-0.1 3,-0.6 0.669 360.0 69.8 -60.5 -17.8 14.2 -18.5 3.4 706 375 B K H >> S+ 0 0 74 1,-0.2 2,-1.0 2,-0.1 4,-1.0 0.986 96.8 39.7 -69.0 -67.0 10.6 -17.3 2.7 707 376 B E H 34 S+ 0 0 102 1,-0.2 -1,-0.2 2,-0.2 -2,-0.1 -0.253 104.5 68.7 -87.8 48.5 10.6 -13.5 3.5 708 377 B L H <> S+ 0 0 0 -2,-1.0 4,-2.5 -3,-0.6 -1,-0.2 0.540 104.1 39.3-118.6 -44.9 14.0 -12.8 2.1 709 378 B T H < S+ 0 0 36 -4,-2.5 3,-0.7 1,-0.2 -2,-0.2 0.788 101.8 56.9 -63.3 -33.6 14.4 -8.5 -2.2 713 382 B K H 3< S+ 0 0 90 -4,-1.0 2,-0.5 1,-0.3 -1,-0.2 0.864 104.5 51.7 -65.8 -39.9 11.8 -8.2 -5.0 714 383 B K T 3< 0 0 123 -4,-0.6 -1,-0.3 -3,-0.4 -2,-0.1 -0.247 360.0 360.0 -90.0 45.9 10.2 -5.1 -3.5 715 384 B L < 0 0 91 -3,-0.7 -3,-0.1 -2,-0.5 -2,-0.1 -0.442 360.0 360.0-161.1 360.0 13.7 -3.5 -3.3 716 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 717 391 B A 0 0 57 0, 0.0 -452,-0.2 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 163.2 20.8 -3.7 -6.3 718 392 B X > + 0 0 30 -454,-1.7 3,-1.1 2,-0.1 4,-0.4 0.819 360.0 53.2-100.7 -40.1 23.8 -6.1 -5.5 719 393 B D T 3> S+ 0 0 6 -455,-0.3 4,-1.9 1,-0.2 -84,-0.2 0.597 91.9 79.7 -76.3 -8.3 24.9 -5.1 -2.0 720 394 B D H 3> S+ 0 0 22 2,-0.2 4,-3.2 1,-0.2 -1,-0.2 0.792 82.0 66.0 -62.2 -32.1 21.2 -5.5 -0.9 721 395 B V H <> S+ 0 0 19 -3,-1.1 4,-1.2 2,-0.2 -1,-0.2 0.936 108.0 36.8 -56.6 -51.6 21.9 -9.3 -0.8 722 396 B D H > S+ 0 0 18 -4,-0.4 4,-0.7 2,-0.2 -2,-0.2 0.882 115.7 55.8 -67.4 -39.4 24.4 -8.8 2.1 723 397 B R H >< S+ 0 0 72 -4,-1.9 3,-1.0 1,-0.2 4,-0.3 0.940 110.6 44.3 -54.7 -50.6 22.2 -6.1 3.7 724 398 B V H 3< S+ 0 0 3 -4,-3.2 3,-0.3 1,-0.2 -1,-0.2 0.767 114.9 49.2 -70.3 -28.1 19.2 -8.4 3.7 725 399 B L H >< S+ 0 0 0 -4,-1.2 3,-1.0 -5,-0.2 -1,-0.2 0.465 80.0 101.8 -88.9 -2.8 21.3 -11.3 5.1 726 400 B R T << S+ 0 0 22 -3,-1.0 -1,-0.2 -4,-0.7 -2,-0.1 0.824 74.2 58.1 -55.1 -40.7 22.9 -9.3 7.9 727 401 B E T 3 S+ 0 0 94 -3,-0.3 -1,-0.3 -4,-0.3 -2,-0.1 0.860 89.3 92.8 -54.0 -41.0 20.7 -10.7 10.7 728 402 B Y < - 0 0 33 -3,-1.0 2,-0.3 1,-0.1 -26,-0.0 -0.280 59.9-153.7 -76.8 139.5 21.6 -14.3 10.1 729 403 B H 0 0 130 -28,-0.1 -28,-0.6 -2,-0.1 -1,-0.1 -0.794 360.0 360.0-108.9 150.8 24.5 -16.2 11.8 730 404 B A 0 0 93 -2,-0.3 -30,-0.2 -30,-0.2 -31,-0.1 -0.373 360.0 360.0 -77.8 360.0 26.5 -19.2 10.6