==== 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-JUL-04 1TX0 . COMPND 2 MOLECULE: DHPS, DIHYDROPTEROATE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS ANTHRACIS; . AUTHOR K.BABAOGLU,J.QI,R.E.LEE,S.W.WHITE . 526 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23633.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 381 72.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 64 12.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 1.9 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 . 42 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 50 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 195 37.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 2.7 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 0 4 2 0 0 2 0 2 0 2 4 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 6 6 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 PARALLEL BRIDGES PER LADDER . 1 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 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 2 A K 0 0 186 0, 0.0 2,-0.5 0, 0.0 15,-0.1 0.000 360.0 360.0 360.0 -56.3 -89.3 69.1 75.9 2 3 A W - 0 0 31 1,-0.1 13,-0.1 2,-0.0 14,-0.1 -0.844 360.0-156.9 -84.7 128.8 -85.8 68.7 77.4 3 4 A D S S+ 0 0 152 -2,-0.5 2,-0.3 12,-0.1 -1,-0.1 0.228 70.9 45.6 -96.3 18.3 -84.4 65.4 75.9 4 5 A Y S S- 0 0 34 167,-0.0 11,-0.4 3,-0.0 2,-0.3 -0.958 75.5-123.5-144.0 165.1 -82.0 64.9 78.8 5 6 A D - 0 0 69 -2,-0.3 2,-0.7 9,-0.1 9,-0.2 -0.696 35.4-102.0-100.5 160.6 -81.8 65.0 82.6 6 7 A L E -A 13 0A 2 7,-2.9 7,-2.7 -2,-0.3 2,-0.7 -0.759 37.1-148.3 -85.9 116.0 -79.4 67.1 84.7 7 8 A R E +A 12 0A 112 -2,-0.7 2,-0.3 164,-0.2 5,-0.2 -0.789 25.6 168.3 -94.3 113.3 -76.7 64.8 85.9 8 9 A C E > -A 11 0A 2 3,-2.4 3,-2.8 -2,-0.7 2,-0.2 -0.694 54.8 -97.7-120.9 78.9 -75.2 65.7 89.3 9 10 A G T 3 S+ 0 0 56 -2,-0.3 -1,-0.2 1,-0.3 100,-0.0 -0.258 110.7 8.0 48.7-108.9 -73.1 62.6 90.4 10 11 A E T 3 S+ 0 0 137 -2,-0.2 2,-0.3 -3,-0.1 -1,-0.3 0.635 127.6 65.1 -74.2 -15.4 -75.4 60.6 92.7 11 12 A Y E < -A 8 0A 33 -3,-2.8 -3,-2.4 2,-0.0 2,-0.4 -0.861 63.8-156.1-113.6 146.1 -78.5 62.8 92.0 12 13 A T E -A 7 0A 77 -2,-0.3 2,-0.6 -5,-0.2 -5,-0.2 -0.977 4.6-156.6-116.5 133.9 -80.5 63.3 88.8 13 14 A L E -A 6 0A 14 -7,-2.7 -7,-2.9 -2,-0.4 2,-0.3 -0.934 9.3-150.3-109.8 111.0 -82.7 66.4 88.2 14 15 A N - 0 0 56 -2,-0.6 4,-0.4 -9,-0.2 -9,-0.1 -0.640 5.7-164.2 -74.5 136.2 -85.5 65.8 85.7 15 16 A L S S+ 0 0 3 -11,-0.4 -1,-0.1 -2,-0.3 -10,-0.1 0.454 80.0 53.3-101.5 -3.8 -86.3 69.1 83.8 16 17 A N S S+ 0 0 54 -14,-0.1 -1,-0.1 -15,-0.1 3,-0.1 0.629 98.1 60.8-102.6 -16.7 -89.6 68.2 82.4 17 18 A E S S- 0 0 112 1,-0.3 2,-0.3 0, 0.0 -2,-0.1 0.906 113.4 -17.5 -91.5 -44.9 -91.5 67.1 85.5 18 19 A K S S- 0 0 78 -4,-0.4 -1,-0.3 248,-0.1 2,-0.3 -0.982 72.0 -86.7-155.0 158.8 -91.6 70.2 87.7 19 20 A T - 0 0 2 -2,-0.3 2,-0.4 238,-0.2 225,-0.2 -0.553 50.5-127.2 -61.9 133.9 -89.9 73.5 88.3 20 21 A L E -b 244 0B 4 223,-2.8 225,-2.4 -2,-0.3 2,-0.6 -0.742 13.0-142.7-102.2 133.9 -86.9 72.9 90.5 21 22 A I E -b 245 0B 3 -2,-0.4 36,-3.5 34,-0.4 37,-1.6 -0.796 7.3-162.4 -99.3 116.9 -86.4 74.9 93.7 22 23 A M E -bc 246 58B 1 223,-3.4 225,-2.3 -2,-0.6 2,-0.3 -0.895 16.9-147.3 -97.0 117.8 -82.9 76.0 94.6 23 24 A G E -bc 247 59B 0 35,-3.3 37,-3.2 -2,-0.6 2,-1.0 -0.689 11.5-128.5 -88.7 140.7 -82.9 76.9 98.3 24 25 A I E - c 0 60B 16 223,-1.7 2,-0.2 -2,-0.3 37,-0.1 -0.757 22.2-142.8 -95.9 100.2 -80.5 79.6 99.4 25 26 A L - 0 0 7 35,-2.3 37,-0.5 -2,-1.0 2,-0.3 -0.408 14.9-133.4 -64.2 127.4 -78.5 78.2 102.4 26 27 A N - 0 0 83 -2,-0.2 2,-0.3 18,-0.1 21,-0.1 -0.646 17.1-164.3 -90.8 139.8 -77.9 80.9 104.9 27 28 A V + 0 0 39 -2,-0.3 13,-0.1 16,-0.0 14,-0.1 -0.597 11.0 176.1-131.5 66.1 -74.3 81.2 106.2 28 29 A T - 0 0 99 -2,-0.3 16,-0.2 12,-0.1 15,-0.1 -0.659 27.4-142.9 -68.9 116.1 -74.1 83.3 109.4 29 30 A P - 0 0 65 0, 0.0 2,-0.5 0, 0.0 7,-0.1 -0.465 13.8-110.6 -83.3 153.9 -70.4 83.0 110.4 30 31 A D - 0 0 37 5,-0.2 3,-0.3 1,-0.1 7,-0.1 -0.752 22.8-140.0 -78.4 129.1 -69.0 82.8 113.9 31 32 A S S S+ 0 0 124 -2,-0.5 -1,-0.1 1,-0.2 0, 0.0 0.771 98.8 49.2 -61.9 -24.9 -67.2 86.0 114.7 32 33 A F S S+ 0 0 214 2,-0.0 -1,-0.2 -3,-0.0 2,-0.2 0.783 105.4 58.0 -93.6 -27.3 -64.4 84.1 116.4 33 34 A S - 0 0 22 -3,-0.3 268,-0.0 1,-0.1 269,-0.0 -0.585 42.6-173.3 -93.6 160.3 -63.6 81.4 113.9 34 35 A D S S+ 0 0 93 -2,-0.2 -1,-0.1 -5,-0.0 -3,-0.0 0.322 79.9 80.7-103.2 -15.9 -62.4 81.5 110.3 35 36 A G S S- 0 0 24 1,-0.1 2,-0.5 -3,-0.1 -5,-0.2 0.497 105.7 -79.5 -74.7-156.1 -62.9 77.8 110.6 36 37 A G - 0 0 18 41,-0.1 267,-2.4 -7,-0.1 268,-0.3 -0.623 62.5-176.3-109.8 68.0 -65.8 75.3 110.5 37 38 A S B > -J 302 0C 24 -2,-0.5 4,-1.9 265,-0.3 265,-0.3 -0.120 34.9-111.4 -62.9 162.5 -66.9 76.0 114.0 38 39 A Y H > S+ 0 0 9 263,-2.3 4,-1.8 2,-0.2 5,-0.2 0.868 110.6 51.3 -67.2 -44.3 -69.8 74.1 115.7 39 40 A N H > S+ 0 0 97 262,-0.3 4,-1.4 2,-0.2 -1,-0.2 0.912 117.4 37.5 -61.3 -46.0 -72.4 77.0 115.9 40 41 A E H > S+ 0 0 6 2,-0.2 4,-2.4 3,-0.2 -2,-0.2 0.914 116.9 49.1 -73.3 -45.1 -72.2 78.0 112.2 41 42 A V H X S+ 0 0 2 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.930 115.9 45.1 -65.0 -40.6 -71.8 74.6 110.7 42 43 A D H X S+ 0 0 21 -4,-1.8 4,-2.3 -5,-0.2 -1,-0.2 0.829 108.5 55.6 -68.7 -35.0 -74.7 73.4 112.7 43 44 A A H X S+ 0 0 32 -4,-1.4 4,-2.2 -5,-0.2 -2,-0.2 0.967 112.0 45.6 -62.7 -48.3 -76.9 76.5 111.9 44 45 A A H X S+ 0 0 1 -4,-2.4 4,-2.9 2,-0.2 -2,-0.2 0.926 111.3 49.9 -52.3 -57.4 -76.3 75.7 108.2 45 46 A V H X S+ 0 0 2 -4,-2.4 4,-2.2 2,-0.2 5,-0.2 0.922 111.9 48.7 -53.0 -49.0 -77.0 72.0 108.4 46 47 A R H X S+ 0 0 151 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.914 112.1 49.5 -59.5 -42.9 -80.3 72.7 110.3 47 48 A H H X S+ 0 0 34 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.902 109.2 52.4 -63.3 -39.8 -81.3 75.3 107.7 48 49 A A H X S+ 0 0 0 -4,-2.9 4,-1.9 1,-0.2 -1,-0.2 0.884 109.7 48.3 -63.1 -40.7 -80.5 72.8 104.9 49 50 A K H X S+ 0 0 81 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.874 109.6 53.1 -66.7 -41.1 -82.7 70.1 106.5 50 51 A E H X S+ 0 0 114 -4,-2.2 4,-1.5 2,-0.2 -2,-0.2 0.977 110.2 47.1 -57.5 -51.9 -85.5 72.7 106.9 51 52 A M H X>S+ 0 0 4 -4,-2.6 5,-2.8 1,-0.2 4,-0.6 0.860 111.5 51.6 -62.1 -34.5 -85.4 73.6 103.2 52 53 A R H ><5S+ 0 0 89 -4,-1.9 3,-1.0 1,-0.2 -1,-0.2 0.922 109.7 47.6 -66.4 -47.5 -85.3 70.0 102.2 53 54 A D H 3<5S+ 0 0 113 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.745 111.0 55.7 -65.3 -20.3 -88.4 69.2 104.3 54 55 A E H 3<5S- 0 0 61 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.577 129.0 -90.1 -85.6 -15.0 -90.0 72.4 102.6 55 56 A G T <<5 + 0 0 27 -3,-1.0 -34,-0.4 -4,-0.6 -3,-0.2 0.527 69.5 152.7 115.8 10.7 -89.5 71.2 99.0 56 57 A A < - 0 0 5 -5,-2.8 -1,-0.2 -6,-0.1 -34,-0.2 -0.396 24.7-168.5 -67.9 148.9 -86.0 72.4 97.9 57 58 A H S S+ 0 0 29 -36,-3.5 2,-0.3 1,-0.4 -35,-0.2 0.586 73.8 26.8-113.3 -16.8 -84.3 70.3 95.2 58 59 A I E S-c 22 0B 1 -37,-1.6 -35,-3.3 30,-0.1 2,-0.5 -0.980 70.8-140.5-141.6 145.4 -80.9 71.9 95.4 59 60 A I E -cd 23 90B 0 30,-2.4 32,-2.3 -2,-0.3 2,-0.6 -0.962 15.9-152.0-108.7 126.7 -79.1 73.6 98.2 60 61 A D E -cd 24 91B 2 -37,-3.2 -35,-2.3 -2,-0.5 2,-0.4 -0.857 12.8-169.4-102.4 123.3 -77.2 76.7 97.2 61 62 A I E - d 0 92B 0 30,-2.5 32,-2.9 -2,-0.6 2,-0.4 -0.940 2.8-171.9-118.6 130.0 -74.1 77.5 99.4 62 63 A G E d 0 93B 27 -37,-0.5 32,-0.1 -2,-0.4 30,-0.0 -0.964 360.0 360.0-127.8 135.2 -72.1 80.7 99.3 63 64 A G 0 0 48 30,-0.5 -1,-0.1 -2,-0.4 9,-0.1 0.622 360.0 360.0-117.3 360.0 -68.9 81.9 100.9 64 ! 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 65 73 A K 0 0 260 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 116.9 -64.3 91.4 99.7 66 74 A V - 0 0 62 3,-0.0 2,-0.1 5,-0.0 5,-0.0 -0.995 360.0-104.5-158.5 151.4 -62.4 88.2 100.7 67 75 A S > - 0 0 54 -2,-0.3 4,-1.8 1,-0.1 5,-0.2 -0.397 29.7-117.3 -77.2 154.7 -59.4 86.0 99.9 68 76 A V H > S+ 0 0 55 2,-0.2 4,-2.1 1,-0.2 3,-0.4 0.942 115.5 46.2 -50.1 -57.1 -59.5 82.6 98.2 69 77 A E H > S+ 0 0 130 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.897 113.9 50.1 -61.5 -39.1 -58.0 80.7 101.2 70 78 A E H > S+ 0 0 109 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.763 110.4 48.5 -65.1 -32.8 -60.5 82.5 103.5 71 79 A E H X S+ 0 0 11 -4,-1.8 4,-2.0 -3,-0.4 -1,-0.2 0.827 112.3 50.3 -77.0 -32.5 -63.5 81.7 101.4 72 80 A I H X S+ 0 0 16 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.900 106.3 54.0 -72.2 -41.6 -62.5 78.1 101.2 73 81 A K H < S+ 0 0 80 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.903 114.6 42.1 -57.6 -43.7 -62.0 77.7 105.0 74 82 A R H X S+ 0 0 44 -4,-1.1 4,-0.6 1,-0.1 -2,-0.2 0.879 121.6 37.6 -69.7 -43.1 -65.6 79.0 105.5 75 83 A V H X S+ 0 0 0 -4,-2.0 4,-2.6 2,-0.2 5,-0.2 0.820 102.4 64.6 -90.8 -34.4 -67.3 77.1 102.7 76 84 A V H X S+ 0 0 26 -4,-2.5 4,-2.8 2,-0.2 5,-0.2 0.934 102.7 48.8 -56.9 -49.7 -65.7 73.6 102.6 77 85 A P H > S+ 0 0 25 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.870 111.9 52.2 -62.6 -33.2 -66.8 72.5 106.1 78 86 A M H X S+ 0 0 3 -4,-0.6 4,-2.5 2,-0.2 5,-0.3 0.958 109.7 46.0 -66.5 -49.8 -70.3 73.6 105.2 79 87 A I H X S+ 0 0 0 -4,-2.6 4,-3.2 2,-0.2 5,-0.3 0.936 114.4 50.3 -54.7 -46.8 -70.4 71.6 102.0 80 88 A Q H X S+ 0 0 95 -4,-2.8 4,-1.9 1,-0.2 5,-0.2 0.958 114.2 42.0 -56.0 -56.6 -69.0 68.6 103.8 81 89 A A H X S+ 0 0 8 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.880 119.3 44.4 -60.8 -39.3 -71.5 68.7 106.7 82 90 A V H X S+ 0 0 1 -4,-2.5 4,-3.0 -5,-0.2 -2,-0.2 0.920 111.6 51.4 -74.9 -41.9 -74.5 69.4 104.4 83 91 A S H < S+ 0 0 25 -4,-3.2 -1,-0.2 -5,-0.3 -2,-0.2 0.867 116.3 42.1 -64.7 -37.0 -73.6 66.9 101.7 84 92 A K H < S+ 0 0 165 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.885 123.4 36.4 -71.6 -43.2 -73.3 64.1 104.3 85 93 A E H < S+ 0 0 51 -4,-2.0 2,-0.4 -5,-0.2 -2,-0.2 0.673 116.0 52.3 -91.6 -18.3 -76.4 65.1 106.3 86 94 A V S < S- 0 0 1 -4,-3.0 2,-1.8 -5,-0.1 -1,-0.2 -0.971 70.4-143.9-126.6 121.4 -78.7 66.3 103.5 87 95 A K + 0 0 119 -2,-0.4 -4,-0.1 -3,-0.1 -3,-0.1 -0.414 65.6 94.4 -84.2 66.8 -79.6 64.1 100.4 88 96 A L S S- 0 0 26 -2,-1.8 -30,-0.1 -6,-0.2 -2,-0.1 -0.981 81.3 -91.7-146.2 152.3 -79.8 66.8 97.7 89 97 A P - 0 0 2 0, 0.0 -30,-2.4 0, 0.0 2,-0.4 -0.268 39.6-139.3 -63.2 148.7 -77.3 68.2 95.2 90 98 A I E -d 59 0B 0 17,-0.3 19,-2.4 -32,-0.2 20,-1.8 -0.927 8.3-156.1-113.1 134.5 -75.3 71.1 96.3 91 99 A S E -de 60 110B 0 -32,-2.3 -30,-2.5 -2,-0.4 2,-0.7 -0.899 14.4-139.0-102.2 142.7 -74.4 74.1 94.2 92 100 A I E -de 61 111B 0 18,-2.6 20,-2.8 -2,-0.4 2,-1.6 -0.909 9.0-147.8-104.6 116.7 -71.4 76.2 95.1 93 101 A D E +de 62 112B 32 -32,-2.9 -30,-0.5 -2,-0.7 2,-0.3 -0.590 51.5 115.9 -87.0 80.8 -72.0 79.9 94.7 94 102 A T - 0 0 3 -2,-1.6 21,-0.2 18,-0.6 -2,-0.1 -0.957 54.6-153.5-140.2 159.6 -68.6 81.3 93.7 95 103 A Y S S+ 0 0 83 -2,-0.3 2,-0.5 18,-0.2 25,-0.3 0.158 71.4 98.2-111.5 18.5 -66.9 83.0 90.8 96 104 A K > - 0 0 20 1,-0.1 4,-2.6 23,-0.1 5,-0.2 -0.911 65.2-146.5-116.7 126.6 -63.4 81.6 91.7 97 105 A A H > S+ 0 0 12 -2,-0.5 4,-2.4 1,-0.2 -1,-0.1 0.882 100.7 48.5 -60.9 -36.2 -61.8 78.6 90.1 98 106 A E H > S+ 0 0 82 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.934 111.1 49.0 -71.1 -44.8 -60.0 77.5 93.2 99 107 A V H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.940 112.0 51.4 -54.9 -48.3 -63.1 77.8 95.5 100 108 A A H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.921 109.2 48.9 -58.1 -50.0 -65.0 75.8 92.9 101 109 A K H X S+ 0 0 85 -4,-2.4 4,-2.5 1,-0.2 5,-0.3 0.977 113.2 46.5 -48.9 -62.9 -62.4 73.0 92.8 102 110 A Q H X S+ 0 0 73 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.845 112.6 51.1 -51.4 -41.1 -62.3 72.7 96.6 103 111 A A H X>S+ 0 0 0 -4,-2.6 5,-3.2 2,-0.2 4,-0.5 0.899 109.9 47.4 -67.4 -45.4 -66.1 72.7 96.9 104 112 A I H ><5S+ 0 0 18 -4,-2.3 3,-1.0 -3,-0.3 -2,-0.2 0.925 114.2 48.0 -59.6 -45.5 -66.6 70.0 94.3 105 113 A E H 3<5S+ 0 0 136 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.858 109.5 54.7 -60.0 -37.8 -63.9 67.9 96.1 106 114 A A H 3<5S- 0 0 15 -4,-2.2 -1,-0.3 -5,-0.3 -2,-0.2 0.549 138.1 -83.5 -77.4 -9.6 -65.7 68.7 99.3 107 115 A G T <<5S+ 0 0 21 -3,-1.0 -17,-0.3 -4,-0.5 -3,-0.2 0.329 78.5 145.2 128.3 -9.3 -68.9 67.3 97.9 108 116 A A < - 0 0 5 -5,-3.2 -1,-0.3 -6,-0.1 -17,-0.2 -0.320 26.9-167.7 -58.4 136.8 -70.5 70.2 95.8 109 117 A H + 0 0 14 -19,-2.4 2,-0.4 1,-0.2 -18,-0.2 0.585 63.4 39.7-102.5 -20.2 -72.4 69.1 92.7 110 118 A I E -e 91 0B 2 -20,-1.8 -18,-2.6 22,-0.2 2,-0.5 -0.998 68.8-134.0-134.7 136.8 -73.1 72.3 90.6 111 119 A I E -ef 92 134B 0 22,-3.4 24,-2.8 -2,-0.4 2,-0.6 -0.831 17.6-165.6 -89.5 134.4 -71.0 75.3 90.0 112 120 A N E -ef 93 135B 4 -20,-2.8 2,-0.7 -2,-0.5 -18,-0.6 -0.877 10.8-176.4-122.2 96.3 -73.0 78.6 90.4 113 121 A D E > - f 0 136B 0 22,-2.1 24,-2.2 -2,-0.6 3,-1.5 -0.832 21.4-170.7-108.3 108.9 -71.1 81.5 88.9 114 122 A I T 3 S+ 0 0 37 -2,-0.7 -1,-0.1 1,-0.3 -19,-0.1 0.519 92.6 50.2 -72.7 -6.1 -72.3 85.1 89.1 115 123 A W T > S- 0 0 74 -21,-0.2 3,-1.7 5,-0.0 -1,-0.3 0.378 105.8-127.3-112.0 5.9 -69.7 86.3 86.7 116 124 A G T < - 0 0 0 -3,-1.5 47,-0.2 1,-0.3 46,-0.2 0.848 67.4 -55.8 55.4 39.7 -70.5 83.6 84.1 117 125 A A T 3 S+ 0 0 0 3,-0.1 -1,-0.3 45,-0.1 7,-0.2 0.576 120.2 105.2 74.5 11.5 -66.9 82.4 83.8 118 126 A K S < S+ 0 0 67 -3,-1.7 -2,-0.1 2,-0.1 -1,-0.1 0.733 73.0 51.2 -93.8 -26.2 -65.7 85.9 82.9 119 127 A A S S+ 0 0 49 1,-0.2 -1,-0.1 2,-0.1 -23,-0.1 0.936 134.0 9.2 -73.7 -48.7 -64.1 86.8 86.2 120 128 A E > - 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