==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 19-JUN-02 1M1M . COMPND 2 MOLECULE: 3-OXOACYL-[ACYL-CARRIER-PROTEIN] SYNTHASE III; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR J.C.SACCHETTINI,S.SRIDHARAN,TB STRUCTURAL GENOMICS . 661 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22937.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 483 73.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 48 7.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 91 13.8 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 . 1 0.2 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 . 43 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 76 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 170 25.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 2.3 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 2 1 0 2 1 0 3 1 0 1 2 1 0 0 0 0 0 0 2 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 2 0 2 4 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 . 2 0 3 4 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 ANTIPARALLEL BRIDGES PER LADDER . 4 0 0 0 2 0 0 0 0 1 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 2 A M 0 0 245 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 6.9 33.7 -49.4 127.3 2 3 A T - 0 0 47 2,-0.0 2,-0.6 579,-0.0 575,-0.1 -0.623 360.0-160.2 -81.9 131.5 34.6 -45.7 128.1 3 4 A E - 0 0 169 -2,-0.3 2,-0.9 573,-0.2 -1,-0.0 -0.914 0.7-161.8-116.7 106.8 31.7 -43.2 128.1 4 5 A I - 0 0 10 -2,-0.6 572,-0.2 508,-0.3 510,-0.2 -0.780 31.8-114.8 -91.3 108.3 32.8 -39.6 127.7 5 6 A A - 0 0 38 570,-2.6 2,-0.4 -2,-0.9 509,-0.1 0.016 18.8-139.4 -45.1 135.8 29.9 -37.4 128.9 6 7 A T - 0 0 68 509,-0.1 2,-0.3 506,-0.0 -1,-0.1 -0.771 19.7-155.6 -95.9 142.5 27.9 -35.1 126.6 7 8 A T + 0 0 46 -2,-0.4 2,-0.3 131,-0.1 133,-0.1 -0.851 21.5 149.9-119.5 155.8 27.0 -31.7 128.0 8 9 A S + 0 0 88 -2,-0.3 130,-0.2 131,-0.2 2,-0.2 -0.982 7.9 160.5-171.5 168.5 24.2 -29.3 127.0 9 10 A G B +a 138 0A 31 128,-1.8 130,-0.7 -2,-0.3 132,-0.2 -0.509 51.1 21.5 161.9 129.7 21.9 -26.7 128.2 10 11 A A - 0 0 35 -2,-0.2 129,-0.2 128,-0.1 -1,-0.1 0.951 39.9-172.4 69.1 97.1 19.6 -23.8 127.0 11 12 A R S S+ 0 0 197 1,-0.1 2,-0.6 127,-0.1 126,-0.1 0.857 72.8 70.5 -83.0 -37.7 18.5 -24.0 123.4 12 13 A S + 0 0 15 167,-0.1 167,-1.6 170,-0.1 2,-0.3 -0.717 63.4 154.4 -88.5 118.8 17.0 -20.6 123.5 13 14 A V E +B 178 0B 0 -2,-0.6 170,-3.3 165,-0.3 171,-0.9 -0.944 7.7 155.9-139.4 158.7 19.4 -17.7 123.7 14 15 A G E -B 177 0B 3 163,-2.6 163,-2.0 -2,-0.3 2,-0.8 -0.987 48.3 -60.3-169.4 177.7 19.4 -14.0 122.7 15 16 A L E -B 176 0B 21 316,-0.5 161,-0.2 -2,-0.3 3,-0.1 -0.629 37.2-178.7 -75.6 108.7 20.7 -10.5 123.1 16 17 A L E - 0 0 76 159,-3.0 2,-0.3 -2,-0.8 -1,-0.2 0.819 66.2 -26.9 -77.0 -30.3 19.9 -9.4 126.7 17 18 A S E -B 175 0B 15 158,-1.0 158,-1.7 -3,-0.1 2,-0.3 -0.991 52.4-126.2-172.9 169.0 21.4 -6.0 126.0 18 19 A V E -B 174 0B 16 -2,-0.3 2,-0.3 156,-0.2 156,-0.2 -0.924 16.8-171.8-126.2 151.8 23.7 -3.7 124.1 19 20 A G E -B 173 0B 1 154,-2.0 154,-3.3 -2,-0.3 2,-0.3 -0.944 7.9-171.7-148.4 122.0 26.4 -1.3 125.4 20 21 A A E -B 172 0B 18 -2,-0.3 2,-0.3 152,-0.3 152,-0.3 -0.790 11.6-172.1-117.0 159.8 28.3 1.1 123.3 21 22 A Y E -B 171 0B 37 150,-2.8 150,-1.7 -2,-0.3 47,-0.1 -0.870 4.8-175.0-150.6 110.3 31.2 3.4 123.9 22 23 A R - 0 0 61 -2,-0.3 148,-0.1 148,-0.2 32,-0.1 -0.949 32.6-108.7-114.0 126.0 32.4 5.9 121.3 23 24 A P - 0 0 0 0, 0.0 32,-0.1 0, 0.0 -1,-0.1 0.087 23.3-120.9 -42.9 155.4 35.6 8.0 122.0 24 25 A E S S+ 0 0 181 29,-0.1 2,-0.4 2,-0.1 31,-0.1 0.878 82.8 90.3 -72.3 -42.6 35.3 11.7 122.7 25 26 A R E -L 54 0C 132 29,-0.7 29,-2.4 1,-0.1 2,-0.7 -0.441 61.5-155.1 -69.7 119.7 37.4 13.2 119.9 26 27 A V E -L 53 0C 71 -2,-0.4 2,-0.6 27,-0.2 27,-0.2 -0.830 8.7-166.4 -95.0 110.9 35.4 14.1 116.8 27 28 A V E -L 52 0C 3 25,-2.8 25,-2.2 -2,-0.7 2,-0.1 -0.888 10.7-152.4-102.3 123.7 37.6 14.1 113.7 28 29 A T E >> -L 51 0C 43 -2,-0.6 4,-1.4 23,-0.2 3,-0.5 -0.437 27.7-111.6 -92.6 166.9 36.0 15.7 110.6 29 30 A N H 3> S+ 0 0 6 21,-1.1 4,-0.9 1,-0.2 5,-0.1 0.908 119.1 57.3 -60.8 -40.8 36.5 15.1 106.9 30 31 A D H 34 S+ 0 0 94 2,-0.2 -1,-0.2 1,-0.2 10,-0.0 0.783 100.0 59.6 -61.9 -28.4 38.1 18.6 106.7 31 32 A E H X4 S+ 0 0 73 -3,-0.5 3,-1.3 1,-0.2 -2,-0.2 0.995 109.0 39.7 -63.3 -62.2 40.7 17.6 109.4 32 33 A I H >< S+ 0 0 3 -4,-1.4 3,-1.1 1,-0.3 4,-0.3 0.630 104.0 72.6 -62.2 -11.2 42.1 14.7 107.4 33 34 A C T 3< S+ 0 0 28 -4,-0.9 -1,-0.3 1,-0.2 -2,-0.2 0.061 77.5 80.7 -88.9 22.6 41.7 17.0 104.4 34 35 A Q T < S+ 0 0 149 -3,-1.3 -1,-0.2 -5,-0.1 -2,-0.2 0.538 106.5 25.4 -99.2 -17.8 44.7 18.8 106.0 35 36 A H S < S+ 0 0 63 -3,-1.1 2,-0.4 123,-0.2 -2,-0.2 0.314 119.7 66.5-125.9 0.7 47.0 16.3 104.4 36 37 A I - 0 0 16 -4,-0.3 -1,-0.1 2,-0.1 124,-0.1 -0.989 59.8-153.9-131.9 134.7 44.8 15.3 101.4 37 38 A D + 0 0 166 -2,-0.4 2,-0.1 -3,-0.1 -4,-0.1 0.147 57.6 127.3 -88.4 19.5 43.6 17.2 98.4 38 39 A S S S- 0 0 15 1,-0.1 2,-0.4 2,-0.0 -2,-0.1 -0.417 72.8 -91.8 -74.9 153.5 40.6 15.0 98.0 39 40 A S > - 0 0 79 1,-0.1 4,-1.4 -2,-0.1 -1,-0.1 -0.531 27.6-147.9 -72.8 121.9 37.2 16.7 97.8 40 41 A D H >> S+ 0 0 61 -2,-0.4 3,-2.1 1,-0.2 4,-1.1 0.964 100.9 41.4 -48.5 -69.1 35.5 17.1 101.2 41 42 A E H 3> S+ 0 0 156 1,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.849 107.4 65.8 -49.4 -37.3 31.9 16.7 100.0 42 43 A W H 3> S+ 0 0 97 1,-0.2 4,-3.1 2,-0.2 -1,-0.3 0.843 98.0 55.2 -54.4 -35.6 33.2 13.9 97.8 43 44 A I H S+ 0 0 0 -3,-2.1 4,-1.5 -4,-1.4 5,-0.8 0.965 108.7 43.4 -65.1 -53.5 34.0 12.0 101.0 44 45 A Y H X5S+ 0 0 101 -4,-1.1 4,-0.9 4,-0.2 -2,-0.2 0.856 118.5 48.1 -61.4 -33.2 30.4 12.2 102.4 45 46 A T H <5S+ 0 0 79 -4,-2.4 218,-0.2 -5,-0.2 -2,-0.2 0.978 114.7 40.7 -71.2 -56.6 29.1 11.3 99.0 46 47 A R H <5S+ 0 0 130 -4,-3.1 -2,-0.2 -5,-0.2 -1,-0.2 0.610 138.5 13.2 -68.9 -12.5 31.3 8.4 98.1 47 48 A T H <5S- 0 0 9 -4,-1.5 215,-2.6 -5,-0.2 -3,-0.2 0.616 90.5-124.1-132.7 -33.5 31.1 6.9 101.6 48 49 A G << + 0 0 4 -4,-0.9 2,-0.5 -5,-0.8 -4,-0.2 0.610 63.3 137.5 91.4 15.4 28.3 8.7 103.6 49 50 A I + 0 0 0 -6,-0.6 -1,-0.3 1,-0.2 236,-0.2 -0.833 23.9 165.9-101.4 125.6 30.7 9.7 106.4 50 51 A K S S- 0 0 85 235,-2.9 -21,-1.1 -2,-0.5 2,-0.3 0.850 71.7 -8.6 -97.6 -51.5 30.5 13.2 107.9 51 52 A T E -L 28 0C 26 234,-2.0 -1,-0.4 -23,-0.2 237,-0.3 -0.953 57.6-160.7-145.1 161.9 32.6 12.6 111.0 52 53 A R E -L 27 0C 0 -25,-2.2 -25,-2.8 -2,-0.3 2,-0.4 -0.883 22.9-113.3-137.6 166.3 34.3 9.8 113.0 53 54 A R E -L 26 0C 67 234,-0.5 116,-2.4 116,-0.3 2,-0.5 -0.885 19.7-163.1-110.2 138.6 35.6 9.3 116.5 54 55 A F E -L 25 0C 18 -29,-2.4 -29,-0.7 -2,-0.4 2,-0.1 -0.980 18.0-133.7-119.8 125.4 39.3 8.9 117.5 55 56 A A - 0 0 11 -2,-0.5 -33,-0.0 1,-0.1 115,-0.0 -0.349 31.9 -95.4 -74.5 159.1 40.2 7.5 120.9 56 57 A A > - 0 0 43 1,-0.1 3,-1.2 4,-0.1 -1,-0.1 -0.061 31.7-105.9 -68.1 171.5 42.9 9.1 123.0 57 58 A D T 3 S+ 0 0 150 1,-0.3 -1,-0.1 3,-0.0 -2,-0.1 0.802 121.5 54.0 -69.2 -30.7 46.5 8.1 123.2 58 59 A D T 3 S+ 0 0 143 2,-0.0 2,-0.3 5,-0.0 -1,-0.3 0.257 96.9 88.9 -89.4 14.3 46.0 6.6 126.6 59 60 A E < - 0 0 33 -3,-1.2 2,-0.3 4,-0.0 3,-0.0 -0.827 53.7-178.6-111.6 152.5 43.1 4.5 125.3 60 61 A S > - 0 0 50 -2,-0.3 4,-2.7 1,-0.1 5,-0.3 -0.880 46.9 -98.6-140.6 170.4 43.3 1.0 123.8 61 62 A A H > S+ 0 0 2 31,-0.6 4,-2.1 -2,-0.3 5,-0.1 0.914 126.7 50.4 -57.0 -37.9 41.0 -1.6 122.2 62 63 A A H > S+ 0 0 8 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.926 109.0 47.5 -66.3 -48.0 41.1 -3.2 125.7 63 64 A S H > S+ 0 0 44 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.917 115.0 46.4 -62.8 -41.4 40.3 -0.1 127.7 64 65 A M H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.897 108.4 57.1 -66.3 -41.0 37.3 0.7 125.4 65 66 A A H X S+ 0 0 0 -4,-2.1 4,-2.9 -5,-0.3 5,-0.2 0.934 106.8 47.2 -56.4 -49.6 36.1 -2.9 125.4 66 67 A T H X S+ 0 0 14 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.903 110.5 53.0 -63.1 -37.6 35.8 -2.9 129.2 67 68 A E H X S+ 0 0 58 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.904 111.2 47.2 -61.6 -41.1 34.0 0.4 129.1 68 69 A A H X S+ 0 0 0 -4,-2.5 4,-3.8 1,-0.2 105,-0.3 0.955 111.1 50.6 -63.7 -51.7 31.5 -1.0 126.6 69 70 A C H X S+ 0 0 0 -4,-2.9 4,-3.4 1,-0.2 5,-0.2 0.859 106.3 55.8 -55.4 -39.1 31.0 -4.2 128.7 70 71 A R H X S+ 0 0 125 -4,-2.4 4,-3.1 -5,-0.2 -1,-0.2 0.950 114.7 39.2 -60.3 -45.0 30.3 -2.1 131.8 71 72 A R H X S+ 0 0 100 -4,-1.8 4,-3.0 2,-0.2 5,-0.3 0.960 115.4 50.3 -68.2 -50.7 27.6 -0.4 129.9 72 73 A A H X S+ 0 0 0 -4,-3.8 4,-1.0 1,-0.2 -2,-0.2 0.920 116.6 45.3 -50.1 -45.3 26.3 -3.5 128.1 73 74 A L H ><>S+ 0 0 11 -4,-3.4 5,-2.2 -5,-0.3 3,-0.6 0.913 111.1 50.5 -66.0 -47.9 26.3 -5.1 131.6 74 75 A S H ><5S+ 0 0 80 -4,-3.1 3,-3.3 -5,-0.2 -2,-0.2 0.985 108.5 53.6 -53.9 -58.6 24.6 -2.2 133.3 75 76 A N H 3<5S+ 0 0 106 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.690 106.4 51.3 -49.0 -28.6 21.9 -2.1 130.6 76 77 A A T <<5S- 0 0 25 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.376 112.2-121.5 -92.0 4.9 21.1 -5.8 131.1 77 78 A G T < 5S+ 0 0 68 -3,-3.3 -3,-0.2 -4,-0.2 2,-0.2 0.799 73.5 122.3 60.6 29.3 20.8 -5.1 134.8 78 79 A L < - 0 0 55 -5,-2.2 2,-0.3 -6,-0.2 -1,-0.2 -0.579 50.9-142.2-116.4 178.9 23.5 -7.7 135.4 79 80 A S >> - 0 0 66 -2,-0.2 3,-3.6 -3,-0.1 4,-0.5 -0.922 37.6 -99.2-138.0 160.9 27.0 -7.9 137.0 80 81 A A G >4 S+ 0 0 9 28,-0.4 3,-0.9 1,-0.3 29,-0.1 0.767 120.5 70.5 -51.6 -25.9 30.2 -9.7 136.1 81 82 A A G 34 S+ 0 0 89 1,-0.2 -1,-0.3 3,-0.0 28,-0.0 0.742 98.4 49.9 -63.6 -21.1 29.0 -12.3 138.7 82 83 A D G <4 S+ 0 0 73 -3,-3.6 2,-0.4 60,-0.0 -1,-0.2 0.566 94.3 85.8 -93.3 -14.4 26.4 -13.2 136.1 83 84 A I << - 0 0 6 -3,-0.9 61,-0.2 -4,-0.5 3,-0.1 -0.725 49.9-173.7 -92.2 139.1 28.7 -13.6 133.1 84 85 A D S S+ 0 0 62 59,-2.5 30,-1.2 -2,-0.4 2,-0.3 0.699 70.1 1.9-101.4 -25.2 30.4 -17.0 132.5 85 86 A G E -cd 114 144B 0 58,-0.9 60,-1.9 28,-0.2 2,-0.3 -0.989 56.4-151.2-158.6 161.0 32.6 -15.9 129.7 86 87 A V E -cd 115 145B 0 28,-1.8 30,-0.8 -2,-0.3 2,-0.4 -0.996 5.8-159.7-138.7 139.9 33.6 -13.0 127.5 87 88 A I E -cd 116 146B 0 58,-3.1 60,-2.8 -2,-0.3 2,-0.6 -0.984 7.2-156.1-121.4 129.1 34.9 -12.9 123.9 88 89 A V E -cd 117 147B 1 28,-2.4 30,-2.5 -2,-0.4 2,-0.5 -0.913 6.3-165.8-107.7 121.7 36.8 -9.9 122.5 89 90 A T E +cd 118 148B 0 58,-3.4 60,-1.9 -2,-0.6 2,-0.3 -0.928 31.0 125.5-106.4 128.6 36.7 -9.3 118.8 90 91 A T - 0 0 9 28,-0.8 31,-0.2 -2,-0.5 60,-0.1 -0.967 49.3-154.9-167.0 173.1 39.2 -6.9 117.4 91 92 A N S S+ 0 0 8 58,-0.5 59,-0.1 -2,-0.3 28,-0.1 0.072 89.2 69.4-140.5 8.5 42.0 -6.3 114.8 92 93 A T + 0 0 1 57,-0.4 2,-0.7 2,-0.0 -31,-0.6 -0.304 52.5 119.3-131.7 51.3 43.6 -3.6 116.8 93 94 A H - 0 0 26 -32,-0.1 2,-2.6 333,-0.1 -3,-0.1 -0.903 52.0-154.4-113.9 94.7 45.2 -5.1 120.0 94 95 A F + 0 0 20 -2,-0.7 441,-1.0 440,-0.1 2,-0.3 -0.236 64.1 87.4 -71.8 53.5 48.8 -4.2 119.4 95 96 A L - 0 0 42 -2,-2.6 -2,-0.1 439,-0.2 5,-0.1 -0.948 67.7-146.1-149.0 123.6 50.3 -7.0 121.4 96 97 A Q S S+ 0 0 22 -2,-0.3 327,-0.1 1,-0.3 -1,-0.1 0.789 82.4 33.9 -63.0 -22.1 51.0 -10.4 120.0 97 98 A T S S+ 0 0 9 1,-0.2 434,-1.4 2,-0.1 -1,-0.3 -0.866 83.1 53.8-179.7 152.2 50.1 -11.7 123.4 98 99 A P S S- 0 0 1 0, 0.0 -1,-0.2 0, 0.0 554,-0.1 0.540 79.8-122.0 -72.1 162.1 48.6 -11.6 126.0 99 100 A P - 0 0 5 0, 0.0 4,-0.5 0, 0.0 351,-0.1 -0.214 14.8-124.0 -64.8 163.6 45.1 -11.6 124.6 100 101 A A S > S+ 0 0 0 1,-0.1 4,-2.6 -12,-0.1 5,-0.3 0.821 93.3 81.1 -81.2 -27.8 42.9 -8.7 125.6 101 102 A A H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.870 91.9 38.6 -45.0 -67.4 40.2 -11.0 127.0 102 103 A P H > S+ 0 0 2 0, 0.0 4,-3.6 0, 0.0 421,-0.5 0.925 116.8 56.8 -55.4 -39.4 41.3 -12.0 130.5 103 104 A M H > S+ 0 0 53 -4,-0.5 4,-2.3 2,-0.2 -2,-0.2 0.938 111.0 39.9 -53.0 -55.4 42.6 -8.5 130.9 104 105 A V H < S+ 0 0 1 -4,-2.6 -1,-0.2 1,-0.2 4,-0.2 0.857 115.5 53.8 -66.5 -34.2 39.3 -6.8 130.2 105 106 A A H >X>S+ 0 0 0 -4,-2.8 3,-1.8 -5,-0.3 5,-1.7 0.920 107.2 49.1 -66.4 -43.9 37.5 -9.5 132.2 106 107 A A H ><5S+ 0 0 15 -4,-3.6 3,-2.6 1,-0.3 5,-0.4 0.966 104.8 62.3 -56.4 -48.2 39.8 -8.9 135.3 107 108 A S T 3<5S+ 0 0 43 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.545 104.1 47.9 -52.4 -13.3 38.8 -5.2 134.7 108 109 A L T <45S- 0 0 28 -3,-1.8 -28,-0.4 -4,-0.2 -1,-0.3 0.452 123.3 -97.5-110.1 -4.6 35.2 -6.0 135.4 109 110 A G T <<5S+ 0 0 66 -3,-2.6 -3,-0.2 -4,-0.5 -2,-0.1 0.805 103.4 94.4 91.8 32.8 35.6 -8.1 138.5 110 111 A A > < + 0 0 14 -5,-1.7 3,-2.1 -4,-0.2 -4,-0.2 -0.122 37.0 153.9-145.4 38.3 35.5 -11.5 136.9 111 112 A K T 3 S+ 0 0 94 -5,-0.4 412,-0.6 1,-0.3 -5,-0.2 0.685 70.5 56.7 -43.8 -27.2 39.2 -12.2 136.4 112 113 A G T 3 S+ 0 0 41 410,-0.2 409,-1.9 -7,-0.1 -1,-0.3 0.729 81.4 107.6 -83.8 -20.2 38.6 -16.0 136.6 113 114 A I S < S- 0 0 29 -3,-2.1 -28,-0.2 407,-0.2 407,-0.2 -0.075 75.1-101.2 -61.0 156.2 36.1 -16.4 133.8 114 115 A L E +c 85 0B 22 -30,-1.2 -28,-1.8 405,-0.3 2,-0.3 -0.398 54.5 142.9 -75.0 153.6 36.9 -17.9 130.4 115 116 A G E -c 86 0B 1 405,-0.3 2,-0.3 -30,-0.2 -28,-0.2 -0.890 20.5-176.3 176.2 152.4 37.6 -15.7 127.4 116 117 A F E -c 87 0B 0 -30,-0.8 -28,-2.4 -2,-0.3 2,-0.4 -0.939 31.1-102.8-152.0 171.6 39.6 -15.3 124.3 117 118 A D E -cE 88 449B 11 332,-2.3 332,-3.6 -2,-0.3 2,-0.4 -0.852 31.6-166.9-102.3 135.8 40.3 -12.9 121.4 118 119 A L E -cE 89 448B 2 -30,-2.5 -28,-0.8 -2,-0.4 2,-0.5 -0.990 3.2-169.1-128.4 125.3 38.8 -13.7 118.0 119 120 A S E + E 0 447B 20 328,-2.3 328,-3.0 -2,-0.4 -28,-0.1 -0.968 24.9 150.1-117.6 124.4 39.8 -12.0 114.8 120 121 A A > - 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