==== 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 19-JUL-07 2QNX . COMPND 2 MOLECULE: 3-OXOACYL-[ACYL-CARRIER-PROTEIN] SYNTHASE 3; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR S.SACHDEVA,F.MUSAYEV,M.ALHAMADSHEH,J.N.SCARSDALE,H.T.WRIGHT, . 666 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23250.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 490 73.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 44 6.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 93 14.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 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 . 4 0.6 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 . 50 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 72 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 172 25.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 2.0 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 2 1 1 1 2 1 0 3 1 0 0 3 1 0 0 0 0 0 1 1 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 0 3 2 1 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 4 3 0 0 0 4 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 0 0 0 2 0 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 -10 A M 0 0 166 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -35.1 -12.9 28.0 18.2 2 -9 A T - 0 0 32 579,-0.0 2,-0.4 583,-0.0 579,-0.1 -0.922 360.0-137.9-134.3 159.9 -9.3 26.9 17.5 3 -8 A E - 0 0 79 -2,-0.3 2,-0.5 577,-0.2 514,-0.1 -0.975 8.5-138.1-130.1 127.8 -6.7 24.9 19.4 4 -7 A I - 0 0 10 512,-0.5 512,-0.2 -2,-0.4 576,-0.2 -0.688 33.9-119.6 -79.7 122.2 -3.0 25.4 19.8 5 -6 A A - 0 0 35 574,-2.5 2,-0.4 -2,-0.5 -1,-0.1 -0.165 22.6-146.2 -60.3 153.3 -1.1 22.1 19.6 6 -5 A T - 0 0 93 513,-0.1 2,-0.2 341,-0.0 513,-0.1 -0.980 10.5-159.2-126.9 137.2 1.0 20.8 22.4 7 -4 A T - 0 0 62 -2,-0.4 2,-0.3 131,-0.2 133,-0.1 -0.657 4.8-167.6-110.5 166.5 4.2 18.8 22.2 8 -3 A S - 0 0 106 -2,-0.2 130,-0.3 131,-0.2 131,-0.2 -0.979 4.0-176.4-152.9 148.1 6.1 16.5 24.5 9 -2 A G - 0 0 37 128,-3.4 128,-0.2 -2,-0.3 133,-0.1 -0.345 47.2 -19.2-122.1-155.6 9.5 14.9 24.6 10 -1 A A - 0 0 17 126,-0.5 -1,-0.3 -2,-0.1 129,-0.1 -0.094 42.9-149.2 -54.8 145.9 11.6 12.5 26.7 11 1 A R S S+ 0 0 185 1,-0.2 2,-0.4 168,-0.1 -1,-0.1 0.924 84.6 39.9 -80.7 -51.4 10.6 11.8 30.3 12 2 A S + 0 0 16 167,-0.3 167,-1.5 170,-0.1 2,-0.3 -0.865 68.8 173.1-105.6 134.3 14.1 11.2 31.7 13 3 A V E +A 178 0A 0 -2,-0.4 170,-1.5 165,-0.3 171,-0.7 -0.945 5.7 167.5-136.4 156.3 17.1 13.2 30.6 14 4 A G E -A 177 0A 1 163,-2.1 163,-1.5 -2,-0.3 2,-1.3 -0.960 45.7 -72.9-162.7 172.5 20.7 13.3 31.8 15 5 A L E -A 176 0A 11 316,-0.5 161,-0.2 168,-0.3 319,-0.1 -0.657 39.7-179.4 -80.9 92.7 24.3 14.3 31.5 16 6 A L E - 0 0 56 159,-2.4 2,-0.3 -2,-1.3 -1,-0.2 0.821 65.4 -17.4 -63.3 -31.1 25.4 12.1 28.7 17 7 A S E -A 175 0A 0 158,-0.7 158,-1.3 316,-0.2 2,-0.3 -0.974 52.9-136.5-162.1 169.1 29.0 13.5 28.9 18 8 A V E -A 174 0A 2 -2,-0.3 2,-0.4 156,-0.2 156,-0.2 -0.994 15.2-169.2-135.0 142.2 31.3 16.3 30.2 19 9 A G E -A 173 0A 1 154,-2.7 154,-2.9 -2,-0.3 2,-0.4 -0.975 7.7-161.5-135.3 123.0 34.1 18.0 28.2 20 10 A A E -A 172 0A 21 -2,-0.4 2,-0.4 152,-0.3 152,-0.3 -0.854 8.4-168.2-111.7 137.2 36.6 20.3 29.7 21 11 A Y E +A 171 0A 37 150,-3.6 150,-2.1 -2,-0.4 47,-0.1 -0.985 8.2 178.3-118.1 126.1 39.0 22.9 28.2 22 12 A R - 0 0 56 -2,-0.4 148,-0.1 148,-0.2 32,-0.1 -0.991 29.8-116.4-127.2 128.7 41.8 24.5 30.3 23 13 A P - 0 0 0 0, 0.0 31,-0.1 0, 0.0 32,-0.1 -0.107 22.3-117.2 -63.0 157.1 44.2 27.0 28.8 24 14 A E S S+ 0 0 89 29,-0.1 2,-0.3 2,-0.1 31,-0.1 0.917 86.3 90.1 -60.6 -47.2 48.0 26.3 28.5 25 15 A R E -J 54 0B 152 29,-0.7 29,-2.6 1,-0.1 2,-0.7 -0.339 58.5-162.7 -68.7 117.5 49.3 29.1 30.8 26 16 A V E -J 53 0B 59 -2,-0.3 2,-0.7 27,-0.2 27,-0.2 -0.880 4.4-163.6 -99.0 109.4 49.6 28.0 34.5 27 17 A V E -J 52 0B 4 25,-2.7 25,-2.0 -2,-0.7 2,-0.0 -0.850 11.3-149.5 -98.4 114.4 49.9 31.1 36.8 28 18 A T E -J 51 0B 45 -2,-0.7 23,-0.2 23,-0.2 3,-0.1 -0.283 26.2-111.0 -77.3 162.2 51.2 30.2 40.3 29 19 A N S >> S+ 0 0 0 21,-1.3 3,-1.6 1,-0.2 4,-1.0 0.923 121.0 55.4 -54.8 -45.9 50.3 32.0 43.6 30 20 A D G >4 S+ 0 0 110 1,-0.3 3,-0.7 2,-0.2 -1,-0.2 0.859 96.2 63.9 -53.3 -44.5 53.9 33.2 43.6 31 21 A E G 34 S+ 0 0 115 1,-0.2 -1,-0.3 2,-0.2 -2,-0.2 0.286 107.1 43.4 -71.9 10.0 53.6 34.8 40.1 32 22 A I G X> S+ 0 0 15 -3,-1.6 4,-1.0 2,-0.1 3,-0.6 0.460 87.5 85.9-122.8 -18.1 50.9 37.2 41.5 33 23 A C T << S+ 0 0 28 -4,-1.0 5,-0.2 -3,-0.7 -2,-0.2 0.510 78.1 78.8 -57.0 -4.9 52.8 38.1 44.7 34 24 A Q T 34 S+ 0 0 92 -4,-0.2 -1,-0.2 1,-0.1 -2,-0.1 0.992 101.9 26.0 -63.4 -66.8 54.4 40.6 42.4 35 25 A H T <4 S+ 0 0 42 -3,-0.6 2,-0.2 -4,-0.1 -2,-0.2 0.520 122.8 56.6 -83.6 -8.3 51.7 43.3 42.3 36 26 A I S < S- 0 0 25 -4,-1.0 2,-0.6 2,-0.1 124,-0.1 -0.725 83.1-118.3-115.1 167.5 50.2 42.4 45.8 37 27 A D S S+ 0 0 108 -2,-0.2 2,-0.3 2,-0.0 -4,-0.1 -0.718 73.8 78.4-109.5 79.7 51.7 42.2 49.3 38 28 A S - 0 0 44 -2,-0.6 2,-0.1 -5,-0.2 -2,-0.1 -0.957 65.4-103.9-163.2-177.3 51.3 38.5 50.4 39 29 A S > - 0 0 48 -2,-0.3 4,-1.6 1,-0.1 5,-0.1 -0.450 30.8-110.7-107.8 176.9 52.6 34.9 50.2 40 30 A D H > S+ 0 0 68 2,-0.2 4,-2.4 -2,-0.1 5,-0.2 0.881 122.0 55.4 -69.8 -43.4 51.6 31.6 48.6 41 31 A E H > S+ 0 0 68 1,-0.2 4,-2.0 2,-0.2 -1,-0.1 0.922 108.1 47.7 -50.7 -51.2 50.8 30.4 52.1 42 32 A W H > S+ 0 0 105 1,-0.2 4,-1.4 2,-0.2 5,-0.2 0.938 113.0 45.2 -61.4 -53.1 48.4 33.3 52.6 43 33 A I H X S+ 0 0 3 -4,-1.6 4,-1.4 1,-0.2 5,-0.4 0.900 114.2 49.3 -58.8 -45.4 46.5 33.0 49.3 44 34 A Y H X S+ 0 0 84 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.888 106.3 55.5 -63.2 -43.2 46.1 29.2 49.6 45 35 A T H < S+ 0 0 82 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.884 115.4 35.7 -59.3 -43.2 44.8 29.2 53.2 46 36 A R H < S+ 0 0 127 -4,-1.4 217,-0.4 1,-0.1 -1,-0.2 0.670 133.4 23.9 -88.5 -19.5 41.9 31.6 52.6 47 37 A T H < S- 0 0 4 -4,-1.4 215,-3.1 -5,-0.2 -3,-0.2 0.755 88.5-127.4-115.7 -39.8 40.9 30.4 49.1 48 38 A G < + 0 0 1 -4,-2.0 2,-0.3 -5,-0.4 -4,-0.2 0.274 64.7 134.7 100.1 -5.4 42.1 26.9 48.6 49 39 A I + 0 0 0 -6,-0.4 -1,-0.4 1,-0.2 236,-0.2 -0.545 25.4 164.0 -82.9 136.5 43.9 27.9 45.4 50 40 A K S S- 0 0 65 235,-2.9 -21,-1.3 1,-0.5 2,-0.3 0.699 72.2 -4.8-109.9 -53.5 47.4 26.9 44.5 51 41 A T E -J 28 0B 25 234,-1.9 -1,-0.5 -23,-0.2 2,-0.3 -0.925 62.9-155.3-139.0 162.6 47.5 27.7 40.7 52 42 A R E -J 27 0B 2 -25,-2.0 -25,-2.7 -2,-0.3 2,-0.5 -0.914 19.6-111.5-139.1 166.6 45.2 28.9 38.0 53 43 A R E -J 26 0B 69 234,-0.9 116,-2.9 -2,-0.3 2,-0.5 -0.868 23.4-164.7-107.6 125.1 44.7 28.9 34.3 54 44 A F E -J 25 0B 18 -29,-2.6 -29,-0.7 -2,-0.5 2,-0.1 -0.926 13.4-139.5-112.6 125.2 45.1 31.9 32.1 55 45 A A - 0 0 14 -2,-0.5 2,-0.1 -32,-0.1 96,-0.0 -0.331 26.4-105.5 -75.9 159.7 43.8 32.0 28.5 56 46 A A > - 0 0 45 1,-0.1 3,-1.0 4,-0.1 -1,-0.1 -0.424 30.8-101.5 -87.5 165.0 45.8 33.7 25.6 57 47 A D T 3 S+ 0 0 157 1,-0.3 -1,-0.1 -2,-0.1 -2,-0.1 0.819 122.9 43.8 -52.4 -41.0 45.0 37.0 23.9 58 48 A D T 3 S+ 0 0 145 2,-0.1 -1,-0.3 5,-0.0 2,-0.1 0.639 98.3 90.9 -83.0 -17.7 43.5 35.4 20.9 59 49 A E < + 0 0 36 -3,-1.0 2,-0.3 4,-0.1 -4,-0.0 -0.485 58.8 179.3 -74.1 150.8 41.5 32.9 23.0 60 50 A S > - 0 0 49 -2,-0.1 4,-2.3 1,-0.1 5,-0.2 -0.869 46.4 -93.5-142.6 175.2 38.0 34.0 24.1 61 51 A A H > S+ 0 0 5 31,-0.4 4,-1.3 -2,-0.3 32,-0.1 0.835 126.2 44.9 -57.9 -35.0 34.9 32.9 26.0 62 52 A A H > S+ 0 0 18 2,-0.2 4,-2.0 3,-0.1 -1,-0.2 0.868 112.2 48.8 -80.6 -39.3 33.4 31.6 22.7 63 53 A S H > S+ 0 0 48 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.915 114.1 47.2 -64.3 -43.9 36.6 29.8 21.4 64 54 A M H X S+ 0 0 0 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.857 110.6 52.4 -65.8 -38.8 37.0 28.1 24.8 65 55 A A H X S+ 0 0 0 -4,-1.3 4,-3.1 -5,-0.2 -1,-0.2 0.892 108.0 52.4 -62.4 -40.9 33.3 27.1 24.8 66 56 A T H X S+ 0 0 5 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.945 109.0 47.6 -62.0 -47.8 33.7 25.6 21.3 67 57 A E H X S+ 0 0 55 -4,-2.0 4,-1.5 2,-0.2 -1,-0.2 0.853 114.2 47.9 -66.0 -34.4 36.7 23.4 22.3 68 58 A A H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 105,-0.3 0.958 112.1 48.8 -64.8 -52.1 34.8 22.3 25.4 69 59 A C H X S+ 0 0 0 -4,-3.1 4,-2.0 1,-0.2 -2,-0.2 0.864 108.5 55.4 -54.3 -38.7 31.7 21.5 23.4 70 60 A R H X S+ 0 0 112 -4,-2.7 4,-1.2 1,-0.2 -1,-0.2 0.909 110.3 44.8 -62.2 -42.7 33.8 19.6 20.9 71 61 A R H X S+ 0 0 101 -4,-1.5 4,-2.3 -3,-0.3 -2,-0.2 0.849 107.6 58.4 -70.1 -37.8 35.2 17.4 23.7 72 62 A A H X S+ 0 0 0 -4,-2.4 4,-1.8 -53,-0.2 -2,-0.2 0.935 106.0 48.5 -57.1 -50.2 31.7 16.9 25.2 73 63 A L H X>S+ 0 0 11 -4,-2.0 5,-3.4 2,-0.2 4,-0.5 0.840 109.3 53.7 -59.1 -38.8 30.4 15.4 22.0 74 64 A S H ><5S+ 0 0 88 -4,-1.2 3,-0.9 3,-0.2 -1,-0.2 0.944 110.8 45.6 -61.8 -49.0 33.4 13.1 21.7 75 65 A N H 3<5S+ 0 0 68 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.754 113.9 49.0 -65.6 -27.5 32.8 11.8 25.2 76 66 A A H 3<5S- 0 0 26 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.517 113.5-121.8 -85.4 -7.9 29.1 11.4 24.5 77 67 A G T <<5S+ 0 0 65 -3,-0.9 2,-0.3 -4,-0.5 -3,-0.2 0.872 70.9 122.1 66.5 40.5 30.0 9.6 21.3 78 68 A L < - 0 0 51 -5,-3.4 -1,-0.3 -6,-0.1 2,-0.2 -0.929 54.4-136.9-132.7 154.5 28.1 12.1 19.1 79 69 A S > - 0 0 65 -2,-0.3 3,-1.7 -3,-0.1 4,-0.4 -0.589 39.3 -99.3 -99.4 168.9 28.8 14.5 16.3 80 70 A A G > S+ 0 0 17 1,-0.3 3,-1.8 28,-0.3 29,-0.1 0.846 119.2 68.4 -55.2 -37.0 27.5 18.0 16.0 81 71 A A G 3 S+ 0 0 92 1,-0.3 -1,-0.3 3,-0.0 28,-0.0 0.652 93.7 58.3 -61.2 -16.5 24.8 16.8 13.6 82 72 A D G < S+ 0 0 71 -3,-1.7 2,-0.3 60,-0.0 -1,-0.3 0.640 88.2 94.1 -83.3 -18.1 23.2 14.9 16.6 83 73 A I < - 0 0 5 -3,-1.8 61,-0.2 -4,-0.4 3,-0.1 -0.616 50.6-173.6 -83.2 133.5 22.8 18.2 18.6 84 74 A D - 0 0 69 59,-2.7 30,-1.2 -2,-0.3 2,-0.3 0.589 67.7 -4.9 -98.9 -16.6 19.5 20.1 18.4 85 75 A G E -bc 114 144A 0 58,-0.7 60,-2.2 28,-0.2 2,-0.4 -0.893 54.3-143.1-177.2 147.4 20.6 23.2 20.4 86 76 A V E -bc 115 145A 0 28,-2.3 30,-0.8 -2,-0.3 2,-0.5 -0.955 6.7-163.7-121.7 135.7 23.3 24.9 22.4 87 77 A I E -bc 116 146A 0 58,-2.3 60,-2.4 -2,-0.4 2,-0.6 -0.973 9.4-158.7-116.5 120.1 23.1 27.2 25.5 88 78 A V E -bc 117 147A 0 28,-2.1 30,-2.7 -2,-0.5 2,-0.5 -0.849 2.9-165.4 -97.9 124.2 26.1 29.2 26.5 89 79 A T E +bc 118 148A 0 58,-2.4 60,-2.1 -2,-0.6 2,-0.3 -0.957 29.0 140.6-108.1 126.1 26.3 30.4 30.1 90 80 A T E - c 0 149A 4 28,-0.9 31,-0.2 -2,-0.5 60,-0.1 -0.979 46.1-163.3-155.2 160.9 28.9 33.1 30.6 91 81 A N S S+ 0 0 13 58,-0.5 59,-0.1 -2,-0.3 -1,-0.1 0.302 91.1 60.8-123.0 -3.7 29.8 36.4 32.3 92 82 A T + 0 0 4 57,-0.5 2,-0.7 2,-0.0 -31,-0.4 -0.138 58.8 123.8-124.4 39.2 32.7 37.3 30.1 93 83 A H - 0 0 31 337,-0.1 2,-0.1 -32,-0.1 -3,-0.1 -0.909 48.6-157.7 -90.9 113.7 31.3 37.6 26.6 94 84 A F + 0 0 23 -2,-0.7 445,-2.3 2,-0.0 2,-0.4 -0.031 60.9 82.2 -95.4 32.6 32.4 41.1 25.8 95 85 A L - 0 0 47 443,-0.2 443,-0.1 3,-0.1 5,-0.1 -1.000 64.5-148.9-134.3 131.5 29.9 42.0 23.2 96 86 A Q S S+ 0 0 31 -2,-0.4 331,-0.1 1,-0.3 -1,-0.1 0.804 85.2 41.2 -66.2 -28.5 26.3 43.3 23.8 97 87 A T S S+ 0 0 16 1,-0.1 438,-1.5 2,-0.1 -1,-0.3 -0.906 85.7 48.8-165.7 151.0 25.6 41.5 20.5 98 88 A P S S- 0 0 12 0, 0.0 -3,-0.1 0, 0.0 -1,-0.1 0.576 80.2-126.4 -68.4 162.6 25.9 39.1 18.7 99 89 A P > - 0 0 5 0, 0.0 4,-0.5 0, 0.0 355,-0.1 -0.298 11.6-125.8 -68.1 168.4 25.3 36.3 21.2 100 90 A A H > S+ 0 0 2 353,-0.2 4,-2.5 2,-0.1 3,-0.3 0.865 95.0 74.2 -83.5 -42.6 28.0 33.6 21.6 101 91 A A H > S+ 0 0 0 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.864 96.8 45.7 -39.5 -60.7 25.8 30.5 21.0 102 92 A P H > S+ 0 0 1 0, 0.0 4,-2.6 0, 0.0 425,-0.3 0.902 112.8 51.0 -56.9 -43.0 25.3 30.9 17.2 103 93 A M H X S+ 0 0 31 -4,-0.5 4,-2.5 -3,-0.3 -2,-0.2 0.946 112.8 46.8 -55.3 -49.2 29.1 31.6 16.7 104 94 A V H X S+ 0 0 1 -4,-2.5 4,-2.1 2,-0.2 5,-0.2 0.939 110.2 51.7 -56.9 -53.4 29.8 28.4 18.7 105 95 A A H <>S+ 0 0 0 -4,-3.0 5,-2.9 1,-0.2 4,-0.5 0.900 112.5 46.9 -50.5 -47.0 27.3 26.3 16.8 106 96 A A H ><5S+ 0 0 14 -4,-2.6 3,-0.9 5,-0.3 5,-0.3 0.878 107.6 56.1 -62.4 -41.3 28.9 27.5 13.6 107 97 A S H 3<5S+ 0 0 68 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.884 110.0 45.9 -57.8 -41.5 32.4 26.8 14.9 108 98 A L T 3<5S- 0 0 23 -4,-2.1 -28,-0.3 -5,-0.1 -1,-0.3 0.493 121.2-108.2 -79.8 -9.7 31.4 23.2 15.6 109 99 A G T < 5S+ 0 0 62 -3,-0.9 -3,-0.2 -4,-0.5 3,-0.1 0.705 93.9 109.3 85.5 19.9 29.7 22.8 12.1 110 100 A A > < + 0 0 11 -5,-2.9 3,-1.4 -6,-0.2 -4,-0.2 -0.530 40.5 161.9-115.0 60.1 26.1 22.8 13.4 111 101 A K T 3 + 0 0 100 -5,-0.3 416,-1.5 1,-0.3 -5,-0.3 0.735 64.5 44.7 -55.6 -35.6 25.5 26.3 12.0 112 102 A G T 3 S+ 0 0 40 414,-0.2 413,-1.3 -7,-0.2 -1,-0.3 0.412 82.7 118.6 -95.2 1.0 21.7 26.3 12.0 113 103 A I < - 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