==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 23-MAR-13 4JTL . COMPND 2 MOLECULE: 2-DEHYDRO-3-DEOXYPHOSPHOOCTONATE ALDOLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: NEISSERIA MENINGITIDIS; . AUTHOR T.M.ALLISON,F.C.COCHRANE,G.B.JAMESON,E.J.PARKER . 1012 12 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 35835.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 724 71.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 152 15.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 28 2.8 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 . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 0.5 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 . 66 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 110 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 329 32.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 1.4 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 1 3 0 1 4 4 4 2 0 1 1 4 2 2 4 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 4 12 10 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 PARALLEL BRIDGES PER LADDER . 0 4 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 8 0 0 0 0 0 0 4 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 94 0, 0.0 11,-0.3 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 125.7 15.9 35.9 52.1 2 2 A D - 0 0 89 9,-0.1 2,-0.4 189,-0.1 9,-0.2 -0.556 360.0-150.4 -89.1 156.7 12.3 35.9 51.0 3 3 A I E -A 10 0A 8 7,-2.4 7,-2.9 -2,-0.2 2,-0.5 -1.000 9.4-139.7-126.9 134.1 11.1 34.7 47.6 4 4 A K E -A 9 0A 116 -2,-0.4 2,-0.5 5,-0.2 5,-0.2 -0.783 16.4-176.9 -91.5 128.0 7.9 36.1 45.9 5 5 A I E > -A 8 0A 5 3,-2.8 3,-2.3 -2,-0.5 2,-0.2 -0.897 67.3 -62.9-124.6 98.4 5.8 33.5 44.1 6 6 A N T 3 S- 0 0 91 -2,-0.5 -1,-0.1 1,-0.3 81,-0.1 -0.446 120.8 -15.6 51.9-120.0 3.0 35.6 42.6 7 7 A D T 3 S+ 0 0 159 -2,-0.2 2,-0.4 -3,-0.1 -1,-0.3 0.440 119.7 99.6 -85.4 -1.5 1.2 37.1 45.6 8 8 A I E < -A 5 0A 22 -3,-2.3 -3,-2.8 41,-0.0 2,-0.6 -0.700 60.0-152.7 -90.5 135.0 2.8 34.6 48.0 9 9 A T E -A 4 0A 56 -2,-0.4 2,-0.5 -5,-0.2 -5,-0.2 -0.942 13.3-165.8-102.3 115.6 5.8 35.6 50.2 10 10 A L E +A 3 0A 0 -7,-2.9 -7,-2.4 -2,-0.6 2,-0.3 -0.869 29.4 127.7-104.0 125.4 7.9 32.5 51.0 11 11 A G > - 0 0 0 -2,-0.5 3,-2.3 211,-0.3 -9,-0.1 -0.944 66.7-106.2-176.9 150.4 10.4 33.0 53.8 12 12 A N T 3 S+ 0 0 6 178,-0.4 4,-0.1 1,-0.3 -10,-0.1 0.620 120.7 42.4 -68.2 -11.2 11.6 31.6 57.1 13 13 A N T 3 S+ 0 0 82 2,-0.1 -1,-0.3 209,-0.0 209,-0.1 0.068 102.4 85.1-116.5 28.7 10.1 34.4 59.0 14 14 A S S < S- 0 0 16 -3,-2.3 -3,-0.1 1,-0.1 3,-0.1 -0.778 95.6 -72.8-117.9 164.2 6.8 34.5 57.1 15 15 A P - 0 0 82 0, 0.0 -4,-0.3 0, 0.0 -1,-0.1 -0.266 67.8 -92.8 -54.9 142.5 3.6 32.5 57.6 16 16 A F - 0 0 4 223,-0.1 2,-0.4 224,-0.1 207,-0.3 -0.274 33.7-141.4 -66.7 145.4 4.2 28.9 56.4 17 17 A V E -b 223 0B 0 205,-1.8 207,-2.2 30,-0.1 2,-0.5 -0.892 11.5-137.6-104.3 131.5 3.3 27.9 52.8 18 18 A L E -bc 224 49B 0 30,-2.6 32,-2.6 -2,-0.4 2,-0.6 -0.809 12.4-166.9 -89.4 126.6 1.8 24.5 52.1 19 19 A F E +bc 225 50B 1 205,-2.8 207,-2.7 -2,-0.5 2,-0.3 -0.976 33.3 147.8-109.6 115.8 3.1 22.7 49.1 20 20 A G E +bc 226 51B 0 30,-2.0 32,-1.5 -2,-0.6 2,-0.3 -0.999 1.1 96.3-154.5 143.8 0.6 19.9 48.6 21 21 A G E - c 0 52B 2 205,-1.0 2,-0.2 -2,-0.3 32,-0.2 -0.909 62.0 -31.8-178.6-131.1 -1.0 17.7 46.0 22 22 A I E - 0 0 32 30,-1.3 32,-0.2 -2,-0.3 3,-0.1 -0.648 41.4-122.4-115.6 163.5 -0.7 14.3 44.4 23 23 A N E S+ 0 0 80 1,-0.3 31,-1.3 -2,-0.2 2,-0.4 0.979 90.8 6.4 -68.6 -59.5 2.1 12.0 43.5 24 24 A V E S- c 0 54B 11 29,-0.2 2,-0.4 31,-0.1 -1,-0.3 -0.972 76.2-113.0-135.9 134.7 1.6 11.6 39.9 25 25 A L + 0 0 0 29,-3.5 44,-1.9 -2,-0.4 45,-0.2 -0.592 40.2 161.8 -69.2 123.8 -0.8 13.2 37.4 26 26 A E - 0 0 105 -2,-0.4 2,-0.3 1,-0.4 -1,-0.2 0.738 61.8 -10.6-107.3 -41.1 -3.3 10.6 36.0 27 27 A S > - 0 0 45 1,-0.1 4,-1.8 47,-0.0 -1,-0.4 -0.981 58.5-114.5-159.0 159.0 -6.2 12.7 34.5 28 28 A L H > S+ 0 0 54 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.937 112.4 51.1 -64.1 -45.6 -7.5 16.2 34.4 29 29 A D H > S+ 0 0 131 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.917 112.0 43.3 -62.9 -47.4 -10.7 15.4 36.3 30 30 A S H > S+ 0 0 51 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.931 114.0 52.7 -73.4 -32.6 -9.1 13.7 39.3 31 31 A T H X S+ 0 0 0 -4,-1.8 4,-2.8 1,-0.2 5,-0.2 0.931 110.1 46.9 -58.1 -49.0 -6.3 16.4 39.5 32 32 A L H X S+ 0 0 29 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.865 111.4 52.8 -62.9 -36.5 -8.8 19.3 39.5 33 33 A Q H X S+ 0 0 145 -4,-1.8 4,-1.5 -5,-0.2 -1,-0.2 0.934 112.1 43.2 -66.0 -48.2 -10.9 17.5 42.2 34 34 A T H X S+ 0 0 41 -4,-2.2 4,-2.1 2,-0.2 3,-0.3 0.941 114.1 51.1 -63.5 -45.4 -7.9 17.0 44.5 35 35 A C H X S+ 0 0 0 -4,-2.8 4,-2.9 1,-0.2 -2,-0.2 0.906 105.8 55.7 -57.7 -41.8 -6.6 20.5 43.9 36 36 A A H X S+ 0 0 38 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.866 105.7 52.7 -60.1 -37.1 -10.1 21.9 44.7 37 37 A H H X S+ 0 0 97 -4,-1.5 4,-2.4 -3,-0.3 5,-0.2 0.958 111.7 44.7 -63.7 -51.4 -10.0 20.1 48.1 38 38 A Y H X S+ 0 0 18 -4,-2.1 4,-2.7 1,-0.2 5,-0.3 0.928 114.7 49.3 -55.7 -49.4 -6.7 21.6 49.0 39 39 A V H X S+ 0 0 12 -4,-2.9 4,-2.5 1,-0.2 5,-0.2 0.915 111.4 48.0 -59.5 -45.3 -7.7 25.0 47.8 40 40 A E H X S+ 0 0 90 -4,-2.5 4,-1.7 -5,-0.2 -1,-0.2 0.933 115.8 44.4 -64.2 -42.6 -11.0 25.0 49.8 41 41 A V H X S+ 0 0 2 -4,-2.4 4,-1.4 -5,-0.2 -2,-0.2 0.934 116.4 45.3 -68.0 -46.1 -9.3 23.8 53.0 42 42 A T H X>S+ 0 0 5 -4,-2.7 5,-2.3 -5,-0.2 4,-0.9 0.910 112.1 51.0 -67.1 -42.2 -6.3 26.2 52.8 43 43 A R H ><5S+ 0 0 183 -4,-2.5 3,-0.5 -5,-0.3 -1,-0.2 0.897 108.9 50.9 -59.3 -44.3 -8.4 29.2 51.9 44 44 A K H 3<5S+ 0 0 114 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.809 115.7 41.8 -69.0 -23.4 -10.7 28.6 54.8 45 45 A L H 3<5S- 0 0 35 -4,-1.4 -1,-0.2 -3,-0.2 -2,-0.2 0.484 112.6-119.8 -93.7 -4.6 -7.8 28.4 57.2 46 46 A G T <<5 + 0 0 59 -4,-0.9 -3,-0.2 -3,-0.5 -4,-0.1 0.821 61.5 147.7 69.2 36.0 -6.0 31.3 55.5 47 47 A I < - 0 0 11 -5,-2.3 -1,-0.2 -6,-0.1 -2,-0.1 -0.861 50.8-118.1-105.2 128.7 -2.9 29.3 54.5 48 48 A P - 0 0 43 0, 0.0 -30,-2.6 0, 0.0 2,-0.4 -0.325 37.9-158.0 -66.3 147.0 -1.0 30.1 51.3 49 49 A Y E -c 18 0B 9 -32,-0.2 2,-0.4 -30,-0.1 -30,-0.2 -0.985 24.4-174.4-140.1 134.2 -1.0 27.2 48.9 50 50 A I E -c 19 0B 0 -32,-2.6 -30,-2.0 -2,-0.4 2,-0.3 -0.993 27.8-131.4-126.6 125.1 1.1 25.8 46.0 51 51 A F E -cd 20 89B 0 37,-1.8 39,-2.3 -2,-0.4 2,-0.4 -0.580 24.3-162.8 -83.1 135.5 -0.2 22.7 44.1 52 52 A K E +cd 21 90B 5 -32,-1.5 -30,-1.3 -2,-0.3 2,-0.3 -0.923 21.3 139.7-122.6 137.5 2.2 19.9 43.5 53 53 A A E - 0 0 0 37,-1.6 2,-0.4 -2,-0.4 39,-0.3 -0.962 39.0-122.9-164.0 157.1 2.3 16.9 41.2 54 54 A S E -c 24 0B 11 -31,-1.3 -29,-3.5 -2,-0.3 3,-0.1 -0.895 4.7-161.4-100.7 139.5 4.7 14.9 38.9 55 55 A F S S+ 0 0 2 -2,-0.4 15,-2.3 37,-0.3 2,-0.4 0.574 84.2 40.8 -86.9 -15.4 3.9 14.5 35.2 56 56 A D - 0 0 12 36,-0.1 2,-1.0 13,-0.1 -1,-0.2 -0.965 67.5-147.6-142.1 126.0 6.3 11.5 35.2 57 57 A K - 0 0 62 10,-2.7 3,-0.2 -2,-0.4 573,-0.1 -0.777 21.0-175.8 -86.9 100.7 7.0 8.7 37.7 58 58 A A S S+ 0 0 13 -2,-1.0 572,-1.8 1,-0.2 2,-0.5 0.776 71.6 46.8 -80.6 -25.8 10.8 8.2 37.1 59 59 A N S S+ 0 0 75 570,-0.2 2,-0.3 571,-0.1 -1,-0.2 -0.905 76.1 178.9-117.6 103.3 11.2 5.2 39.4 60 60 A R - 0 0 11 -2,-0.5 7,-0.1 568,-0.2 4,-0.0 -0.773 37.4-125.8-112.0 143.5 8.5 2.6 38.8 61 61 A S S S+ 0 0 96 -2,-0.3 2,-0.3 2,-0.1 -1,-0.1 0.814 98.0 17.5 -54.0 -34.3 8.0 -0.8 40.5 62 62 A S S > S- 0 0 25 1,-0.1 3,-0.7 4,-0.1 600,-0.1 -0.905 76.1-120.5-135.6 153.5 7.9 -2.5 37.1 63 63 A I T 3 S+ 0 0 28 -2,-0.3 -1,-0.1 1,-0.2 -2,-0.1 0.877 120.3 49.1 -60.8 -32.7 9.0 -1.5 33.6 64 64 A H T 3 S+ 0 0 150 -3,-0.1 -1,-0.2 2,-0.1 3,-0.1 0.503 85.7 117.2 -86.3 -2.7 5.3 -2.1 32.8 65 65 A S S < S- 0 0 30 -3,-0.7 2,-0.1 1,-0.1 -5,-0.1 -0.280 80.6 -86.6 -66.7 153.0 3.8 -0.0 35.7 66 66 A Y - 0 0 119 1,-0.1 -1,-0.1 -6,-0.0 -4,-0.1 -0.393 41.8-167.3 -59.7 135.1 1.7 3.0 34.9 67 67 A R - 0 0 93 1,-0.3 -10,-2.7 -2,-0.1 3,-0.2 0.501 34.9 -98.6-106.1 -19.3 4.0 6.1 34.5 68 68 A G - 0 0 12 -12,-0.2 -1,-0.3 1,-0.1 -42,-0.2 -0.368 48.2 -67.2 113.8 172.1 1.8 9.2 34.5 69 69 A V S S- 0 0 42 -44,-1.9 4,-0.4 1,-0.1 -1,-0.1 0.711 73.3-129.9 -73.1 -20.5 0.4 11.4 31.8 70 70 A G > - 0 0 21 -15,-2.3 4,-2.9 -45,-0.2 5,-0.2 -0.120 33.0 -59.2 92.4 170.0 3.8 12.8 30.5 71 71 A L H > S+ 0 0 48 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.902 126.3 45.4 -58.7 -51.6 5.3 16.2 29.8 72 72 A E H > S+ 0 0 147 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.937 121.9 34.8 -61.6 -54.3 2.9 17.4 27.1 73 73 A E H > S+ 0 0 95 -4,-0.4 4,-2.4 2,-0.2 -1,-0.2 0.900 116.1 58.0 -69.8 -38.3 -0.4 16.4 28.7 74 74 A G H X S+ 0 0 0 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.914 105.4 48.6 -58.6 -46.0 1.0 17.2 32.2 75 75 A L H X S+ 0 0 17 -4,-2.8 4,-2.3 -5,-0.2 -1,-0.2 0.892 108.7 54.8 -65.1 -35.9 1.7 20.8 31.3 76 76 A K H X S+ 0 0 94 -4,-1.5 4,-1.9 -5,-0.2 -2,-0.2 0.937 108.4 48.9 -56.1 -47.9 -1.8 21.1 29.8 77 77 A I H X S+ 0 0 10 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.923 109.9 51.0 -61.1 -42.3 -3.2 19.9 33.1 78 78 A F H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.861 107.3 53.9 -63.3 -37.7 -1.0 22.4 35.1 79 79 A E H X S+ 0 0 103 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.903 109.7 48.2 -63.2 -39.2 -2.2 25.3 32.8 80 80 A K H X S+ 0 0 120 -4,-1.9 4,-3.0 2,-0.2 5,-0.3 0.911 109.3 52.4 -69.1 -39.4 -5.8 24.3 33.6 81 81 A V H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 5,-0.5 0.951 112.5 45.7 -58.3 -48.8 -5.0 24.2 37.4 82 82 A K H X S+ 0 0 58 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.901 114.8 47.6 -62.2 -41.3 -3.5 27.7 37.2 83 83 A A H < S+ 0 0 87 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.939 117.0 41.7 -68.1 -46.8 -6.4 29.1 35.1 84 84 A E H < S+ 0 0 123 -4,-3.0 -2,-0.2 -5,-0.2 -1,-0.2 0.880 130.5 22.0 -67.9 -43.1 -9.1 27.6 37.3 85 85 A F H < S- 0 0 38 -4,-2.6 -3,-0.2 -5,-0.3 -2,-0.2 0.658 88.1-134.2-105.6 -14.2 -7.7 28.3 40.8 86 86 A G < + 0 0 65 -4,-2.0 -4,-0.2 -5,-0.5 -3,-0.1 0.841 61.7 129.0 62.5 36.4 -5.2 31.2 40.2 87 87 A I - 0 0 22 -6,-0.3 -1,-0.2 -5,-0.1 -2,-0.1 -0.844 61.8-105.3-118.2 157.3 -2.5 29.5 42.3 88 88 A P - 0 0 5 0, 0.0 -37,-1.8 0, 0.0 2,-0.3 -0.387 35.0-152.2 -74.3 160.8 1.2 28.6 41.7 89 89 A V E -d 51 0B 0 -39,-0.2 19,-2.1 16,-0.2 18,-0.4 -0.909 6.6-155.2-134.0 162.8 2.2 25.1 40.9 90 90 A I E +de 52 108B 0 -39,-2.3 -37,-1.6 -2,-0.3 2,-0.3 -0.983 15.6 166.3-140.5 138.8 5.3 23.0 41.4 91 91 A T E - e 0 109B 0 17,-1.4 19,-2.3 -2,-0.3 2,-0.2 -0.984 31.4-110.8-150.0 156.5 6.6 19.9 39.6 92 92 A D E - e 0 110B 17 -2,-0.3 2,-0.4 -39,-0.3 -37,-0.3 -0.527 22.1-155.6 -85.8 148.4 9.9 17.9 39.3 93 93 A V - 0 0 0 17,-1.9 32,-0.0 -2,-0.2 6,-0.0 -0.967 13.1-179.7-121.8 144.1 12.1 17.7 36.2 94 94 A H + 0 0 10 -2,-0.4 -1,-0.1 1,-0.2 27,-0.1 0.588 66.3 51.4-117.7 -15.7 14.5 14.8 35.4 95 95 A E S >> S- 0 0 31 1,-0.1 3,-1.4 26,-0.1 4,-0.5 -0.970 73.1-131.2-130.4 138.7 16.1 15.8 32.1 96 96 A P G >4 S+ 0 0 31 0, 0.0 3,-1.6 0, 0.0 4,-0.5 0.879 107.9 58.0 -50.6 -47.7 17.9 19.1 31.1 97 97 A H G 34 S+ 0 0 145 1,-0.3 3,-0.2 2,-0.1 24,-0.0 0.706 101.2 58.8 -59.2 -22.5 15.9 19.4 27.9 98 98 A Q G <> S+ 0 0 20 -3,-1.4 4,-2.2 1,-0.2 -1,-0.3 0.700 86.1 81.3 -78.3 -18.7 12.7 19.4 29.9 99 99 A C H S+ 0 0 86 -4,-0.5 4,-1.6 1,-0.2 -1,-0.2 0.964 115.5 43.8 -65.0 -52.0 12.6 25.2 29.7 101 101 A P H 4 S+ 0 0 53 0, 0.0 4,-0.5 0, 0.0 -1,-0.2 0.873 116.7 48.0 -64.0 -32.6 9.3 23.9 28.5 102 102 A V H >X S+ 0 0 0 -4,-2.2 4,-3.2 1,-0.2 3,-1.4 0.925 109.9 52.8 -67.4 -43.8 8.3 23.0 32.1 103 103 A A H 3< S+ 0 0 8 -4,-2.7 -1,-0.2 1,-0.3 -3,-0.2 0.750 95.7 68.2 -65.4 -23.8 9.4 26.4 33.4 104 104 A E T 3< S+ 0 0 143 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.812 119.9 19.0 -60.8 -30.9 7.3 28.2 30.9 105 105 A V T <4 S+ 0 0 18 -3,-1.4 2,-0.5 -4,-0.5 -2,-0.2 0.779 111.5 73.4-108.3 -46.5 4.2 26.8 32.8 106 106 A C < - 0 0 1 -4,-3.2 -16,-0.1 1,-0.1 -1,-0.1 -0.669 60.2-153.4 -88.0 126.2 5.3 25.8 36.3 107 107 A D S S+ 0 0 30 -2,-0.5 24,-0.9 -18,-0.4 2,-0.4 0.910 86.3 30.1 -60.6 -44.0 6.1 28.5 38.8 108 108 A V E S-ef 90 131B 0 -19,-2.1 -17,-1.4 22,-0.1 2,-0.4 -0.953 70.6-161.9-121.5 133.4 8.5 26.3 40.8 109 109 A I E -ef 91 132B 0 22,-2.1 24,-2.2 -2,-0.4 2,-0.4 -0.940 15.2-140.7-113.5 143.7 10.5 23.5 39.4 110 110 A Q E -ef 92 133B 7 -19,-2.3 -17,-1.9 -2,-0.4 24,-0.2 -0.856 5.7-145.3-114.3 134.8 12.0 20.9 41.6 111 111 A L E - f 0 134B 0 22,-2.7 24,-1.7 -2,-0.4 5,-0.1 -0.813 31.8-128.3 -91.1 109.1 15.4 19.1 41.5 112 112 A P > - 0 0 19 0, 0.0 3,-1.2 0, 0.0 4,-0.4 -0.272 15.3-118.1 -65.9 153.3 14.8 15.6 42.7 113 113 A A G > S+ 0 0 13 1,-0.3 3,-1.3 2,-0.2 4,-0.2 0.883 111.3 52.9 -58.7 -40.1 17.0 14.3 45.5 114 114 A F G 3 S+ 0 0 74 1,-0.3 -1,-0.3 2,-0.1 3,-0.3 0.723 114.6 42.7 -67.7 -23.1 18.7 11.5 43.5 115 115 A L G X S+ 0 0 0 -3,-1.2 3,-2.7 1,-0.2 -1,-0.3 0.302 78.7 111.1-104.2 8.7 19.7 14.0 40.7 116 116 A A T < S+ 0 0 4 -3,-1.3 -1,-0.2 -4,-0.4 -2,-0.1 0.659 82.2 44.9 -65.5 -21.2 20.8 16.8 43.0 117 117 A R T 3 S+ 0 0 47 -3,-0.3 2,-1.2 -4,-0.2 -1,-0.3 0.183 79.4 115.0-101.8 11.3 24.5 16.3 42.0 118 118 A Q <> - 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