==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/ANTIBIOTIC/INHIBITOR 27-SEP-11 3TZF . COMPND 2 MOLECULE: 7,8-DIHYDROPTEROATE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: YERSINIA PESTIS; . AUTHOR Y.WU . 549 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21301.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 400 72.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 69 12.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 1.8 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 40 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 68 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 188 34.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.6 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 0 2 2 2 2 0 0 3 1 2 1 0 3 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 4 5 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 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 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 1 A M 0 0 165 0, 0.0 11,-2.4 0, 0.0 12,-0.4 0.000 360.0 360.0 360.0-141.2 29.6 29.8 27.2 2 2 A H E -A 11 0A 96 9,-0.2 2,-0.3 10,-0.1 9,-0.2 -0.948 360.0-134.4-137.9 144.3 30.0 28.6 30.8 3 3 A L E -A 10 0A 9 7,-1.9 7,-1.8 -2,-0.3 2,-0.3 -0.739 35.2-156.7 -87.6 146.8 28.4 28.6 34.3 4 4 A T E +A 9 0A 90 -2,-0.3 2,-0.2 5,-0.2 5,-0.2 -0.954 25.6 163.9-132.6 146.6 30.9 29.4 37.1 5 5 A A E > S-A 8 0A 7 3,-1.4 3,-1.9 -2,-0.3 129,-0.1 -0.803 75.8 -21.6-159.0 117.8 31.3 28.8 40.8 6 6 A R T 3 S- 0 0 140 1,-0.3 3,-0.1 -2,-0.2 128,-0.0 0.804 127.8 -43.8 56.3 39.6 34.5 29.2 42.8 7 7 A G T 3 S+ 0 0 78 1,-0.4 -1,-0.3 0, 0.0 2,-0.3 0.380 113.1 118.4 88.2 -5.3 36.9 28.9 39.9 8 8 A L E < -A 5 0A 30 -3,-1.9 -3,-1.4 83,-0.0 -1,-0.4 -0.666 46.5-160.0 -87.5 150.2 35.0 25.9 38.4 9 9 A T E -A 4 0A 91 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.960 7.1-158.0-128.5 153.0 33.5 26.2 34.9 10 10 A L E -A 3 0A 5 -7,-1.8 -7,-1.9 -2,-0.3 2,-0.7 -0.989 21.6-127.8-132.4 123.4 30.7 24.2 33.2 11 11 A D E > -A 2 0A 61 -2,-0.4 3,-0.8 -9,-0.2 -9,-0.2 -0.576 22.0-175.9 -75.8 109.8 30.4 24.0 29.4 12 12 A L T 3 S+ 0 0 22 -11,-2.4 -1,-0.2 -2,-0.7 -10,-0.1 0.411 73.4 75.4 -88.0 1.3 26.8 24.9 28.6 13 13 A S T 3 S+ 0 0 83 -12,-0.4 -1,-0.2 2,-0.1 -11,-0.1 0.402 99.8 47.8 -90.9 -0.4 27.2 24.3 24.8 14 14 A R S < S- 0 0 24 -3,-0.8 2,-0.2 238,-0.1 252,-0.0 -0.982 100.6 -96.2-136.0 146.1 27.1 20.5 25.5 15 15 A P - 0 0 19 0, 0.0 2,-0.4 0, 0.0 238,-0.2 -0.450 39.9-152.5 -64.0 130.7 24.7 18.5 27.6 16 16 A Q E -b 253 0B 24 236,-3.4 238,-3.0 -2,-0.2 2,-0.6 -0.888 5.6-136.9-106.6 138.8 26.1 18.0 31.2 17 17 A V E -b 254 0B 5 -2,-0.4 36,-2.0 34,-0.4 37,-1.3 -0.828 9.8-158.4-100.6 122.9 25.1 15.0 33.3 18 18 A M E -bc 255 54B 0 236,-3.3 238,-2.8 -2,-0.6 2,-0.4 -0.897 15.1-142.6 -97.8 119.1 24.4 15.5 37.0 19 19 A G E -bc 256 55B 0 35,-3.1 37,-3.2 -2,-0.6 2,-0.5 -0.683 13.3-128.8 -87.3 130.4 24.8 12.3 39.0 20 20 A I E - c 0 56B 0 236,-2.4 2,-0.5 -2,-0.4 37,-0.2 -0.675 24.1-178.2 -82.6 121.7 22.3 11.6 41.8 21 21 A L E - c 0 57B 0 35,-3.2 37,-2.1 -2,-0.5 2,-0.5 -0.866 8.8-167.6-119.0 93.8 23.7 10.8 45.1 22 22 A N E - c 0 58B 14 -2,-0.5 12,-0.4 35,-0.2 37,-0.2 -0.698 10.7-174.3 -80.2 126.4 20.9 10.2 47.6 23 23 A V + 0 0 5 35,-3.1 -1,-0.1 -2,-0.5 12,-0.1 -0.461 52.6 96.8-115.6 56.5 22.0 10.0 51.2 24 24 A T S S- 0 0 1 6,-0.2 8,-2.4 -2,-0.1 10,-0.3 -0.827 73.3-128.8-132.3 168.1 18.7 9.0 52.7 25 25 A P S S+ 0 0 69 0, 0.0 6,-0.1 0, 0.0 10,-0.1 0.673 104.0 39.0 -88.2 -17.2 17.0 5.8 53.8 26 26 A D + 0 0 53 5,-0.1 5,-0.1 4,-0.1 41,-0.1 0.157 66.9 145.2-130.0 16.7 13.8 6.4 51.8 27 27 A S > - 0 0 11 1,-0.1 4,-1.5 3,-0.1 34,-0.1 -0.306 59.7-114.2 -53.2 143.2 14.5 8.0 48.4 28 28 A F T 4 S+ 0 0 81 1,-0.2 -1,-0.1 2,-0.2 33,-0.0 0.737 104.5 18.9 -63.2 -29.1 12.0 6.6 45.9 29 29 A S T 4 S+ 0 0 20 203,-0.1 -1,-0.2 202,-0.1 204,-0.1 0.706 139.5 18.2-111.5 -31.1 14.4 4.6 43.6 30 30 A D T >> S+ 0 0 10 202,-0.0 3,-1.5 4,-0.0 4,-0.5 -0.053 72.2 157.2-140.4 37.2 17.6 4.1 45.7 31 31 A G T 3< S+ 0 0 28 -4,-1.5 -5,-0.1 1,-0.2 -8,-0.0 -0.433 75.4 12.8 -67.0 134.6 16.9 4.7 49.5 32 32 A G T 34 S+ 0 0 40 -8,-2.4 -1,-0.2 -2,-0.1 3,-0.2 0.471 100.5 102.8 78.9 2.1 19.4 2.9 51.8 33 33 A C T <4 S+ 0 0 67 -3,-1.5 3,-0.1 -9,-0.2 -2,-0.1 0.860 93.8 20.4 -81.8 -39.7 21.8 2.3 48.9 34 34 A H S < S+ 0 0 25 -4,-0.5 -1,-0.2 -12,-0.4 6,-0.1 -0.160 84.9 128.1-124.5 39.3 24.3 5.0 49.6 35 35 A N + 0 0 75 -3,-0.2 2,-0.2 4,-0.1 -1,-0.1 0.786 58.3 60.3 -71.9 -34.4 23.6 5.7 53.3 36 36 A N S > S- 0 0 80 -3,-0.1 4,-2.5 -4,-0.1 3,-0.2 -0.650 88.0-113.7 -98.6 157.8 27.1 5.4 54.8 37 37 A L H > S+ 0 0 75 1,-0.2 4,-2.4 -2,-0.2 5,-0.2 0.869 112.0 50.7 -57.9 -46.9 30.1 7.6 53.9 38 38 A D H > S+ 0 0 116 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.877 113.6 45.7 -60.2 -41.5 32.3 4.9 52.3 39 39 A Q H > S+ 0 0 94 -3,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.916 110.9 53.0 -68.8 -43.6 29.5 3.7 50.0 40 40 A A H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.924 109.9 48.8 -54.0 -47.4 28.5 7.3 49.1 41 41 A L H X S+ 0 0 21 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.852 110.7 49.4 -66.0 -37.9 32.2 8.0 48.1 42 42 A Q H X S+ 0 0 103 -4,-1.6 4,-2.6 2,-0.2 -1,-0.2 0.918 112.0 49.0 -67.0 -42.7 32.4 4.8 46.0 43 43 A H H X S+ 0 0 15 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.904 110.7 50.4 -63.5 -41.4 29.2 5.7 44.2 44 44 A A H X S+ 0 0 0 -4,-2.5 4,-3.0 2,-0.2 5,-0.2 0.943 111.3 47.9 -60.7 -48.6 30.3 9.3 43.5 45 45 A Q H X S+ 0 0 113 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.909 110.2 52.8 -60.0 -42.5 33.6 8.0 42.1 46 46 A R H X S+ 0 0 160 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.928 111.8 45.7 -55.3 -46.7 31.7 5.5 39.9 47 47 A M H <>S+ 0 0 5 -4,-2.4 5,-2.3 2,-0.2 4,-0.5 0.908 112.5 50.3 -66.3 -42.5 29.5 8.3 38.6 48 48 A L H ><5S+ 0 0 39 -4,-3.0 3,-1.2 3,-0.2 -2,-0.2 0.916 110.9 49.7 -56.8 -46.5 32.5 10.6 38.0 49 49 A S H 3<5S+ 0 0 109 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.873 106.2 56.6 -59.9 -39.3 34.2 7.7 36.1 50 50 A A T 3<5S- 0 0 25 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.545 129.8 -94.0 -73.2 -10.0 31.0 7.2 34.0 51 51 A G T < 5 + 0 0 34 -3,-1.2 -34,-0.4 -4,-0.5 -3,-0.2 0.540 68.8 152.6 112.3 9.0 31.3 10.9 32.9 52 52 A A < - 0 0 7 -5,-2.3 -1,-0.3 1,-0.1 -34,-0.2 -0.460 25.2-168.2 -67.2 140.6 29.1 13.0 35.3 53 53 A T S S+ 0 0 48 -36,-2.0 39,-1.5 1,-0.2 2,-0.3 0.431 74.0 40.2-110.4 -3.7 30.3 16.6 35.6 54 54 A L E -cd 18 92B 0 -37,-1.3 -35,-3.1 37,-0.2 2,-0.5 -0.992 66.0-153.3-137.7 144.7 28.1 17.4 38.7 55 55 A I E -cd 19 93B 0 37,-2.7 39,-3.4 -2,-0.3 2,-0.7 -0.990 11.8-152.9-114.2 124.5 27.2 15.3 41.7 56 56 A D E -cd 20 94B 1 -37,-3.2 -35,-3.2 -2,-0.5 2,-0.6 -0.874 8.9-161.2-100.8 113.8 23.9 16.1 43.4 57 57 A I E +cd 21 95B 0 37,-3.4 39,-2.6 -2,-0.7 2,-0.4 -0.853 13.9 176.0-102.7 119.1 23.9 15.3 47.1 58 58 A G E +cd 22 96B 1 -37,-2.1 -35,-3.1 -2,-0.6 39,-0.1 -0.982 22.6 173.5-132.6 123.5 20.4 15.0 48.7 59 59 A G + 0 0 0 37,-0.5 2,-0.4 -2,-0.4 38,-0.1 0.201 68.8 69.4-109.1 11.2 19.5 14.0 52.2 60 60 A E S S- 0 0 12 36,-0.4 2,-0.3 -36,-0.1 -1,-0.1 -0.960 72.1-142.0-131.2 117.6 15.7 14.7 52.0 61 61 A S - 0 0 8 -2,-0.4 -34,-0.1 6,-0.1 8,-0.0 -0.598 16.8-178.4 -72.3 131.6 13.4 12.5 49.9 62 62 A T + 0 0 14 -2,-0.3 3,-0.1 3,-0.0 -1,-0.1 0.033 32.9 134.7-120.5 24.1 10.7 14.8 48.3 63 63 A R S > S- 0 0 71 1,-0.2 3,-1.6 2,-0.1 2,-0.1 -0.198 76.1 -66.9 -61.4 162.4 8.8 12.0 46.5 64 64 A P T 3 S+ 0 0 73 0, 0.0 82,-0.2 0, 0.0 -1,-0.2 -0.397 125.9 11.6 -55.1 124.3 5.0 12.2 46.8 65 65 A G T 3 S+ 0 0 55 80,-2.4 81,-0.2 1,-0.2 2,-0.1 0.684 90.5 167.1 81.5 22.5 4.0 11.6 50.5 66 66 A A < - 0 0 22 -3,-1.6 -1,-0.2 79,-0.2 2,-0.1 -0.386 34.6-112.9 -74.1 145.7 7.6 11.9 51.9 67 67 A A - 0 0 61 1,-0.1 2,-0.2 -2,-0.1 -6,-0.1 -0.348 33.8 -99.8 -72.7 153.2 8.3 12.2 55.6 68 68 A E - 0 0 166 -2,-0.1 2,-0.4 -8,-0.1 -1,-0.1 -0.485 31.8-148.4 -70.8 141.9 9.8 15.4 57.2 69 69 A V - 0 0 13 -2,-0.2 -10,-0.0 -8,-0.0 -9,-0.0 -0.965 18.0-120.5-114.2 130.4 13.6 15.4 57.9 70 70 A S > - 0 0 72 -2,-0.4 4,-2.4 1,-0.1 5,-0.2 -0.276 22.5-115.5 -66.1 155.6 14.9 17.3 60.9 71 71 A E H > S+ 0 0 100 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.927 115.4 45.1 -58.3 -48.7 17.5 20.1 60.3 72 72 A Q H > S+ 0 0 117 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.882 111.2 53.0 -64.6 -41.1 20.3 18.3 62.2 73 73 A E H > S+ 0 0 80 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.923 110.5 46.9 -60.7 -45.6 19.5 14.9 60.6 74 74 A E H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 5,-0.3 0.925 112.0 51.5 -63.3 -43.9 19.8 16.4 57.1 75 75 A L H X S+ 0 0 19 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.927 109.7 49.4 -53.9 -49.3 23.0 18.2 58.1 76 76 A D H < S+ 0 0 93 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.804 115.1 45.0 -62.7 -32.2 24.5 14.9 59.4 77 77 A R H < S+ 0 0 49 -4,-1.7 4,-0.3 -5,-0.2 -1,-0.2 0.902 124.8 27.9 -75.5 -43.3 23.5 13.1 56.1 78 78 A V H >X S+ 0 0 0 -4,-2.6 4,-2.3 -5,-0.2 3,-0.6 0.919 108.5 59.5 -93.7 -50.4 24.7 15.8 53.7 79 79 A V H 3X S+ 0 0 29 -4,-2.0 4,-2.7 -5,-0.3 5,-0.2 0.863 103.5 49.7 -60.2 -42.9 27.6 17.8 55.1 80 80 A P H 3> S+ 0 0 52 0, 0.0 4,-2.0 0, 0.0 -1,-0.3 0.834 112.6 50.6 -65.0 -28.7 30.2 15.1 55.7 81 81 A V H <> S+ 0 0 6 -3,-0.6 4,-2.5 -4,-0.3 5,-0.3 0.939 110.9 47.3 -70.2 -48.0 29.6 13.8 52.1 82 82 A V H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 5,-0.2 0.933 114.0 48.9 -53.9 -49.0 30.1 17.3 50.7 83 83 A E H X S+ 0 0 100 -4,-2.7 4,-1.5 1,-0.2 -1,-0.2 0.915 112.7 46.1 -58.5 -47.5 33.2 17.8 52.8 84 84 A A H X S+ 0 0 6 -4,-2.0 4,-0.7 1,-0.2 -1,-0.2 0.875 115.9 45.1 -68.6 -39.4 34.7 14.4 51.7 85 85 A L H >X S+ 0 0 1 -4,-2.5 4,-2.8 2,-0.2 3,-0.5 0.880 109.6 55.1 -70.0 -40.5 34.0 14.8 48.0 86 86 A A H 3< S+ 0 0 40 -4,-2.7 -2,-0.2 -5,-0.3 -1,-0.2 0.816 109.5 48.4 -62.4 -32.9 35.2 18.5 48.0 87 87 A Q H 3< S+ 0 0 146 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.686 120.7 35.2 -78.8 -21.5 38.6 17.2 49.4 88 88 A R H << S+ 0 0 146 -4,-0.7 2,-0.3 -3,-0.5 -2,-0.2 0.804 109.2 49.8-103.2 -38.1 38.9 14.4 46.9 89 89 A F < - 0 0 43 -4,-2.8 2,-1.1 -5,-0.1 -1,-0.1 -0.827 59.3-135.7-123.8 150.6 37.5 15.4 43.5 90 90 A D + 0 0 153 -2,-0.3 2,-0.3 -3,-0.1 -4,-0.1 -0.792 69.0 108.6 -91.9 89.5 37.5 18.1 40.8 91 91 A V S S- 0 0 11 -2,-1.1 2,-0.3 -6,-0.1 -37,-0.2 -0.986 75.3 -89.6-163.1 150.8 33.8 18.3 40.2 92 92 A W E -d 54 0B 7 -39,-1.5 -37,-2.7 -2,-0.3 2,-0.6 -0.518 37.4-153.2 -65.6 128.5 30.7 20.4 40.7 93 93 A L E -d 55 0B 2 -2,-0.3 19,-3.0 17,-0.2 20,-1.8 -0.947 12.3-172.6-108.9 114.5 29.0 19.6 44.0 94 94 A S E -de 56 113B 1 -39,-3.4 -37,-3.4 -2,-0.6 2,-0.5 -0.849 11.3-149.9-103.3 141.8 25.2 20.3 44.0 95 95 A V E -de 57 114B 2 18,-2.3 20,-2.5 -2,-0.4 2,-1.4 -0.959 4.1-151.4-118.1 116.2 23.2 20.1 47.2 96 96 A D E +de 58 115B 10 -39,-2.6 -37,-0.5 -2,-0.5 -36,-0.4 -0.698 52.1 121.7 -85.2 88.0 19.5 19.1 46.9 97 97 A T - 0 0 0 -2,-1.4 21,-0.2 18,-1.1 -2,-0.1 -0.962 50.6-163.7-147.7 161.0 18.1 20.9 49.9 98 98 A S + 0 0 3 -2,-0.3 2,-0.4 18,-0.1 24,-0.3 0.417 61.9 106.1-121.6 -7.7 15.6 23.5 51.0 99 99 A K > - 0 0 28 1,-0.1 4,-2.4 -28,-0.1 3,-0.2 -0.628 64.2-142.1 -86.9 130.8 16.9 24.2 54.5 100 100 A A H > S+ 0 0 19 23,-0.5 4,-2.3 -2,-0.4 5,-0.2 0.885 103.1 50.4 -51.7 -45.6 18.8 27.5 55.3 101 101 A A H > S+ 0 0 24 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.868 110.5 48.0 -66.7 -38.8 21.2 25.7 57.6 102 102 A V H > S+ 0 0 0 2,-0.2 4,-2.0 -3,-0.2 5,-0.2 0.871 110.5 53.2 -68.8 -38.1 22.0 23.0 55.1 103 103 A I H X S+ 0 0 2 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.938 114.7 40.9 -57.6 -49.5 22.6 25.6 52.4 104 104 A T H X S+ 0 0 61 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.926 117.6 44.4 -69.7 -48.3 25.1 27.5 54.6 105 105 A E H X S+ 0 0 93 -4,-2.6 4,-1.2 2,-0.2 -1,-0.2 0.841 113.5 51.5 -68.8 -33.3 27.0 24.6 56.1 106 106 A S H <>S+ 0 0 0 -4,-2.0 5,-2.2 -5,-0.2 4,-0.4 0.908 109.4 50.1 -67.2 -45.2 27.2 22.9 52.7 107 107 A A H ><5S+ 0 0 13 -4,-1.9 3,-1.7 -5,-0.2 -2,-0.2 0.934 109.6 51.7 -53.6 -48.3 28.6 26.1 51.2 108 108 A H H 3<5S+ 0 0 158 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.795 107.1 54.8 -59.1 -30.2 31.1 26.1 54.1 109 109 A A T 3<5S- 0 0 15 -4,-1.2 -1,-0.3 -3,-0.2 -23,-0.2 0.430 130.4 -90.4 -87.1 -2.3 32.0 22.5 53.2 110 110 A G T < 5 + 0 0 16 -3,-1.7 -3,-0.2 -4,-0.4 -17,-0.2 0.542 68.5 157.8 109.4 11.0 32.8 23.4 49.6 111 111 A A < - 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