==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 07-NOV-07 3BAF . COMPND 2 MOLECULE: SHIKIMATE KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR L.M.FAIM,M.V.B.DIAS,I.G.VASCONCELOS,L.A.BASSO,D.S.SANTOS, . 165 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9230.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 114 69.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 10.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 0 0.0 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 . 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 . 5 3.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 73 44.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.8 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 0 0 1 1 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 3 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 0 0 PARALLEL BRIDGES PER LADDER . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 A 0 0 75 0, 0.0 68,-0.1 0, 0.0 67,-0.1 0.000 360.0 360.0 360.0 140.7 -28.0 10.8 54.7 2 3 A P - 0 0 13 0, 0.0 93,-0.4 0, 0.0 72,-0.2 -0.334 360.0-134.3 -61.1 148.2 -26.1 13.1 52.2 3 4 A K S S- 0 0 117 70,-1.8 2,-0.3 69,-0.4 71,-0.2 0.821 92.2 -4.0 -61.4 -37.5 -26.1 16.9 52.4 4 5 A A E -a 74 0A 2 69,-0.8 71,-1.9 2,-0.0 2,-0.4 -0.939 59.3-150.4-153.8 149.0 -26.7 16.8 48.5 5 6 A V E -ab 75 96A 1 90,-1.7 92,-2.0 -2,-0.3 2,-0.4 -0.982 19.4-149.6-118.7 126.4 -26.9 14.2 45.5 6 7 A L E +ab 76 97A 0 69,-1.8 71,-1.8 -2,-0.4 2,-0.3 -0.816 20.5 169.0-104.7 129.9 -25.8 15.4 41.8 7 8 A V E + b 0 98A 4 90,-1.9 92,-1.8 -2,-0.4 2,-0.2 -0.887 16.9 97.0-133.9 159.4 -27.4 14.0 38.5 8 9 A G - 0 0 1 -2,-0.3 92,-0.1 70,-0.2 3,-0.1 -0.823 64.4 -43.7 145.7 177.4 -27.3 14.8 34.6 9 10 A L S > S- 0 0 16 90,-0.3 3,-1.9 -2,-0.2 5,-0.3 -0.273 73.0 -77.2 -66.6 156.7 -25.7 14.1 31.1 10 11 A P T 3 S+ 0 0 21 0, 0.0 100,-0.1 0, 0.0 -1,-0.1 -0.294 122.1 26.3 -51.4 133.5 -21.8 13.6 30.5 11 12 A G T 3 S+ 0 0 18 98,-0.1 -2,-0.1 -3,-0.1 98,-0.1 0.349 83.9 109.8 82.3 -6.2 -20.3 17.2 30.5 12 13 A S S < S- 0 0 2 -3,-1.9 -3,-0.0 87,-0.1 -5,-0.0 0.629 95.6-102.2 -65.6 -20.3 -23.0 19.0 32.8 13 14 A G >> + 0 0 21 -4,-0.2 4,-2.6 -5,-0.1 5,-0.5 0.574 68.9 146.7 106.6 13.4 -20.2 19.2 35.7 14 15 A K H >5S+ 0 0 28 -5,-0.3 4,-1.4 1,-0.2 5,-0.1 0.896 81.0 36.9 -45.4 -53.4 -21.1 16.4 38.3 15 16 A S H >5S+ 0 0 66 2,-0.2 4,-1.6 3,-0.1 -1,-0.2 0.879 121.2 46.1 -70.3 -34.4 -17.3 15.7 39.3 16 17 A T H >5S+ 0 0 66 2,-0.2 4,-1.5 1,-0.1 -2,-0.2 0.926 116.3 42.1 -73.4 -54.9 -16.2 19.5 39.1 17 18 A I H X5S+ 0 0 10 -4,-2.6 4,-2.2 2,-0.2 5,-0.2 0.857 113.7 56.0 -62.5 -38.3 -19.1 21.0 41.0 18 19 A G H XS+ 0 0 4 -4,-1.9 5,-2.0 -5,-0.2 4,-0.7 0.881 105.9 54.0 -59.4 -45.7 -17.5 19.6 49.5 23 24 A K H <5S+ 0 0 154 -4,-1.7 3,-0.3 1,-0.2 -1,-0.2 0.851 110.0 49.5 -50.2 -45.8 -14.4 22.0 50.2 24 25 A A H <5S+ 0 0 64 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.656 113.1 43.2 -67.6 -32.5 -16.8 24.8 51.1 25 26 A L H <5S- 0 0 73 -4,-1.2 -1,-0.2 -3,-0.3 -2,-0.2 0.512 110.7-117.0 -86.8 -10.5 -19.0 22.8 53.5 26 27 A G T <5S+ 0 0 70 -4,-0.7 -3,-0.2 -3,-0.3 2,-0.2 0.663 74.6 108.8 78.1 27.1 -16.0 21.1 55.3 27 28 A V < - 0 0 54 -5,-2.0 -1,-0.2 -6,-0.1 2,-0.2 -0.585 66.5 -89.9-130.5 173.4 -16.9 17.4 54.3 28 29 A G - 0 0 44 -2,-0.2 46,-1.8 -5,-0.0 2,-0.4 -0.505 28.5-130.8 -87.2 159.2 -15.7 14.5 52.0 29 30 A L E -c 74 0A 70 44,-0.2 2,-0.4 -2,-0.2 46,-0.2 -0.942 14.4-167.5-104.8 131.4 -16.6 13.6 48.3 30 31 A L E -c 75 0A 51 44,-1.9 46,-2.2 -2,-0.4 2,-0.6 -0.981 2.5-168.3-115.9 122.2 -17.7 10.1 47.1 31 32 A D E >> -c 76 0A 30 -2,-0.4 4,-2.0 44,-0.2 3,-0.6 -0.938 13.3-151.5-111.2 105.5 -17.8 9.4 43.2 32 33 A T H 3> S+ 0 0 1 44,-1.9 4,-1.9 -2,-0.6 45,-0.1 0.772 93.7 57.1 -51.7 -32.3 -19.6 6.1 42.3 33 34 A D H 3> S+ 0 0 60 43,-0.3 4,-1.1 2,-0.2 -1,-0.2 0.895 110.0 45.7 -64.1 -45.1 -17.6 5.6 39.0 34 35 A V H <> S+ 0 0 72 -3,-0.6 4,-1.7 2,-0.2 -2,-0.2 0.870 109.5 55.1 -58.2 -47.2 -14.3 5.7 41.0 35 36 A A H X S+ 0 0 15 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.917 104.2 55.1 -54.4 -46.3 -15.7 3.3 43.7 36 37 A I H X S+ 0 0 3 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.886 107.2 48.0 -53.1 -46.2 -16.5 0.7 41.0 37 38 A E H < S+ 0 0 81 -4,-1.1 -1,-0.2 1,-0.2 -2,-0.2 0.897 111.5 51.7 -66.3 -40.8 -12.9 0.5 39.6 38 39 A Q H < S+ 0 0 137 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.878 110.8 46.9 -60.4 -42.2 -11.5 0.2 43.1 39 40 A R H < S+ 0 0 199 -4,-1.9 -2,-0.2 3,-0.1 -1,-0.2 0.924 116.9 39.6 -76.0 -45.2 -13.8 -2.8 44.1 40 41 A T S < S- 0 0 49 -4,-2.0 0, 0.0 2,-0.2 0, 0.0 -0.211 94.8-107.0 -81.4-175.1 -13.3 -4.9 40.9 41 42 A G S S+ 0 0 83 -2,-0.1 -4,-0.1 2,-0.1 2,-0.1 0.800 83.4 53.2 -79.0 -24.4 -10.0 -5.3 39.2 42 43 A R S S- 0 0 89 1,-0.2 -2,-0.2 -6,-0.1 2,-0.1 -0.188 75.0 -83.6-121.8-177.2 -10.6 -3.2 36.1 43 44 A S > - 0 0 59 1,-0.1 4,-1.3 -2,-0.1 -1,-0.2 -0.328 40.1-115.3 -78.3 165.6 -11.6 -0.2 34.0 44 45 A I H > S+ 0 0 33 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.897 118.7 50.1 -70.5 -44.5 -15.1 0.9 32.9 45 46 A A H > S+ 0 0 43 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.852 107.9 55.7 -62.4 -33.4 -14.3 0.3 29.2 46 47 A D H > S+ 0 0 88 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.867 108.2 46.1 -62.4 -43.8 -13.0 -3.3 30.2 47 48 A I H X>S+ 0 0 10 -4,-1.3 4,-2.1 2,-0.2 5,-1.0 0.890 111.5 51.9 -64.8 -46.2 -16.2 -4.4 31.9 48 49 A F H X5S+ 0 0 40 -4,-1.9 4,-0.7 3,-0.2 -2,-0.2 0.895 114.7 44.7 -55.3 -43.6 -18.4 -3.0 29.0 49 50 A A H <5S+ 0 0 91 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.879 122.6 31.5 -74.3 -42.9 -16.2 -5.1 26.5 50 51 A T H <5S+ 0 0 112 -4,-2.1 -3,-0.2 -5,-0.1 -2,-0.2 0.875 136.3 17.3 -77.9 -40.8 -15.9 -8.5 28.3 51 52 A D H <5S- 0 0 75 -4,-2.1 -3,-0.2 -5,-0.2 4,-0.2 0.687 97.8-119.7-113.4 -27.3 -19.3 -8.6 30.1 52 53 A G >X< - 0 0 27 -5,-1.0 4,-1.1 -4,-0.7 3,-0.5 -0.002 31.0 -78.2 96.8 156.4 -21.9 -6.1 28.6 53 54 A E H 3> S+ 0 0 80 1,-0.2 4,-2.3 2,-0.2 -1,-0.1 0.802 122.1 61.9 -56.1 -40.3 -23.9 -3.0 29.9 54 55 A Q H 3> S+ 0 0 158 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.825 106.2 46.1 -63.3 -31.5 -26.6 -5.1 31.7 55 56 A E H <> S+ 0 0 71 -3,-0.5 4,-1.2 -4,-0.2 -1,-0.2 0.772 108.4 56.0 -78.4 -30.6 -23.9 -6.5 34.0 56 57 A F H X S+ 0 0 10 -4,-1.1 4,-2.0 2,-0.2 -2,-0.2 0.918 105.7 54.0 -53.2 -48.8 -22.4 -3.0 34.6 57 58 A R H X S+ 0 0 21 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.804 104.1 53.0 -61.7 -36.2 -25.9 -1.9 35.8 58 59 A R H X S+ 0 0 144 -4,-0.9 4,-1.4 2,-0.2 -1,-0.2 0.919 111.2 45.6 -66.6 -46.3 -26.3 -4.7 38.4 59 60 A I H X S+ 0 0 41 -4,-1.2 4,-1.7 2,-0.2 -2,-0.2 0.898 111.8 53.6 -55.9 -45.3 -22.9 -3.8 40.1 60 61 A E H X S+ 0 0 2 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.906 105.1 53.7 -59.3 -50.1 -23.8 0.0 40.0 61 62 A E H X S+ 0 0 48 -4,-2.0 4,-2.1 2,-0.2 5,-0.2 0.891 108.1 48.5 -50.5 -47.3 -27.2 -0.5 41.8 62 63 A D H X S+ 0 0 122 -4,-1.4 4,-1.4 2,-0.2 -1,-0.2 0.914 111.8 49.7 -64.7 -46.1 -25.6 -2.4 44.8 63 64 A V H X S+ 0 0 35 -4,-1.7 4,-1.6 1,-0.2 -2,-0.2 0.907 111.7 50.0 -50.5 -48.4 -22.9 0.4 45.3 64 65 A V H X S+ 0 0 1 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.898 106.2 51.8 -62.6 -53.8 -25.6 3.2 45.2 65 66 A R H X S+ 0 0 127 -4,-2.1 4,-0.8 1,-0.2 -1,-0.2 0.875 112.7 47.6 -53.6 -44.5 -28.0 1.7 47.9 66 67 A A H X S+ 0 0 51 -4,-1.4 4,-2.0 -5,-0.2 -1,-0.2 0.857 109.3 52.7 -63.1 -39.5 -25.1 1.3 50.3 67 68 A A H X S+ 0 0 9 -4,-1.6 4,-2.0 1,-0.2 -2,-0.2 0.909 105.0 55.4 -63.3 -44.8 -23.7 5.0 49.7 68 69 A L H < S+ 0 0 12 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.741 115.6 39.3 -60.4 -27.0 -27.2 6.6 50.4 69 70 A A H < S+ 0 0 73 -4,-0.8 -2,-0.2 -3,-0.2 -1,-0.2 0.861 124.6 32.3 -86.9 -40.8 -27.2 4.8 53.9 70 71 A D H < S+ 0 0 142 -4,-2.0 2,-0.5 1,-0.0 -2,-0.2 0.589 99.2 81.9 -96.4 -16.5 -23.5 5.1 55.1 71 72 A H < + 0 0 36 -4,-2.0 4,-0.1 -5,-0.2 -41,-0.0 -0.857 41.1 179.9-107.4 119.2 -22.2 8.6 53.6 72 73 A D + 0 0 102 -2,-0.5 -69,-0.4 -70,-0.1 -1,-0.1 0.329 65.6 66.1 -98.3 6.6 -22.9 12.1 55.3 73 74 A G S S- 0 0 4 -71,-0.2 -70,-1.8 1,-0.1 -69,-0.8 0.360 102.4 -45.2 -93.4-130.5 -21.0 14.3 52.7 74 75 A V E -ac 4 29A 0 -46,-1.8 -44,-1.9 -71,-0.2 2,-0.4 -0.901 52.0-157.1-104.4 132.1 -21.6 15.2 48.9 75 76 A L E -ac 5 30A 0 -71,-1.9 -69,-1.8 -2,-0.4 2,-0.5 -0.973 4.4-163.3-116.0 124.0 -22.5 12.2 46.5 76 77 A S E -ac 6 31A 2 -46,-2.2 -44,-1.9 -2,-0.4 -43,-0.3 -0.952 12.4-153.8-107.2 119.7 -21.9 12.2 42.6 77 78 A L - 0 0 5 -71,-1.8 -69,-0.1 -2,-0.5 -63,-0.1 -0.548 23.1-100.7 -86.5 142.9 -23.7 9.5 40.4 78 79 A G > - 0 0 5 -2,-0.2 3,-1.4 1,-0.1 4,-0.3 -0.250 42.2-106.3 -52.5 152.4 -22.7 8.0 36.9 79 80 A G T 3 S+ 0 0 22 1,-0.3 3,-0.2 2,-0.1 -71,-0.2 0.771 113.8 38.7 -61.6 -29.4 -24.6 9.5 33.9 80 81 A G T > S+ 0 0 6 1,-0.1 3,-1.5 2,-0.1 4,-0.3 0.197 80.3 108.4-104.8 15.3 -27.0 6.6 33.1 81 82 A A G X + 0 0 1 -3,-1.4 3,-1.4 1,-0.2 6,-0.2 0.853 69.1 67.0 -61.5 -32.5 -27.8 5.5 36.7 82 83 A V G 3 S+ 0 0 4 -4,-0.3 -1,-0.2 -3,-0.2 6,-0.1 0.567 82.7 75.8 -63.0 -11.6 -31.4 6.9 36.5 83 84 A T G < S+ 0 0 49 -3,-1.5 -1,-0.2 4,-0.1 -2,-0.1 0.658 78.2 85.5 -76.7 -17.8 -32.4 4.2 33.8 84 85 A S S X> S- 0 0 12 -3,-1.4 4,-1.7 -4,-0.3 3,-0.7 -0.754 71.1-150.4 -81.4 121.8 -32.6 1.5 36.6 85 86 A P H 3> S+ 0 0 96 0, 0.0 4,-1.4 0, 0.0 -1,-0.1 0.825 98.4 58.4 -61.4 -29.6 -36.1 1.4 38.4 86 87 A G H 3> S+ 0 0 19 2,-0.2 4,-1.5 1,-0.2 -2,-0.0 0.759 104.7 51.7 -65.7 -29.5 -34.4 0.1 41.7 87 88 A V H <> S+ 0 0 2 -3,-0.7 4,-1.2 -6,-0.2 -1,-0.2 0.922 107.2 52.4 -67.8 -47.2 -32.2 3.4 41.6 88 89 A R H X S+ 0 0 80 -4,-1.7 4,-0.6 1,-0.2 -2,-0.2 0.839 109.9 48.4 -60.3 -37.6 -35.3 5.7 41.2 89 90 A A H >< S+ 0 0 77 -4,-1.4 3,-0.6 1,-0.2 -1,-0.2 0.897 107.5 53.8 -74.2 -38.3 -37.1 4.1 44.3 90 91 A A H 3< S+ 0 0 30 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.781 104.2 59.1 -58.8 -26.4 -34.0 4.3 46.7 91 92 A L H >< S+ 0 0 6 -4,-1.2 3,-2.0 -3,-0.1 -1,-0.2 0.740 74.5 115.8 -80.7 -23.6 -33.8 8.2 45.8 92 93 A A T << S+ 0 0 85 -4,-0.6 3,-0.1 -3,-0.6 50,-0.0 -0.176 81.6 18.0 -57.4 132.1 -37.4 9.1 47.1 93 94 A G T 3 S+ 0 0 92 1,-0.3 -1,-0.2 0, 0.0 -2,-0.1 0.034 100.6 113.0 92.5 -27.5 -37.1 11.5 50.2 94 95 A H S < S- 0 0 48 -3,-2.0 2,-0.7 -4,-0.1 -1,-0.3 -0.153 78.7-100.3 -73.6 160.1 -33.5 12.6 49.5 95 96 A T - 0 0 64 -93,-0.4 -90,-1.7 -3,-0.1 2,-0.5 -0.839 48.8-175.5 -83.2 110.0 -32.1 16.2 48.5 96 97 A V E -b 5 0A 2 -2,-0.7 48,-2.0 -92,-0.2 49,-1.3 -0.936 14.4-161.8-120.6 114.6 -31.5 15.8 44.6 97 98 A V E -bd 6 145A 0 -92,-2.0 -90,-1.9 -2,-0.5 2,-0.6 -0.853 5.2-158.2-101.5 115.7 -29.9 18.6 42.3 98 99 A Y E -bd 7 146A 23 47,-2.0 49,-2.1 -2,-0.5 2,-0.6 -0.900 7.8-153.1 -87.0 109.6 -30.4 18.3 38.4 99 100 A L E - d 0 147A 2 -92,-1.8 -90,-0.3 -2,-0.6 2,-0.3 -0.811 13.9-152.4 -84.0 113.8 -27.7 20.3 36.3 100 101 A E E + d 0 148A 72 47,-1.9 49,-2.2 -2,-0.6 2,-0.3 -0.705 19.7 167.9 -92.1 139.8 -29.1 21.4 32.8 101 102 A I - 0 0 20 -2,-0.3 -92,-0.1 47,-0.1 -89,-0.1 -0.987 32.6-114.4-146.6 138.6 -27.0 22.1 29.5 102 103 A S > - 0 0 52 -2,-0.3 4,-1.9 1,-0.1 5,-0.2 -0.250 32.3-114.4 -63.8 158.0 -27.7 22.6 25.7 103 104 A A H > S+ 0 0 18 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.844 111.2 51.9 -66.4 -37.5 -26.6 19.9 23.1 104 105 A A H > S+ 0 0 60 2,-0.2 4,-1.0 1,-0.1 -1,-0.2 0.867 115.3 39.9 -67.0 -41.4 -24.0 22.2 21.3 105 106 A E H > S+ 0 0 81 2,-0.2 4,-2.2 3,-0.1 -2,-0.2 0.900 114.1 56.2 -69.7 -42.5 -22.1 23.4 24.5 106 107 A G H X S+ 0 0 0 -4,-1.9 4,-1.3 1,-0.2 -2,-0.2 0.907 107.3 46.5 -57.7 -47.1 -22.3 19.8 26.0 107 108 A V H < S+ 0 0 17 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.867 110.8 52.6 -64.5 -37.6 -20.6 18.1 23.1 108 109 A R H >< S+ 0 0 180 -4,-1.0 3,-0.9 1,-0.2 -2,-0.2 0.843 106.5 54.8 -64.1 -36.8 -17.8 20.8 23.0 109 110 A R H 3< S+ 0 0 106 -4,-2.2 3,-0.4 1,-0.2 -2,-0.2 0.834 107.4 49.4 -64.3 -33.8 -17.1 20.1 26.8 110 111 A T T 3< S+ 0 0 10 -4,-1.3 3,-0.5 1,-0.2 4,-0.3 0.385 82.9 112.0 -81.4 3.7 -16.6 16.3 26.2 111 112 A G < + 0 0 52 -3,-0.9 2,-0.3 1,-0.2 -1,-0.2 0.598 57.0 65.1 -62.8 -25.6 -14.1 16.9 23.3 112 113 A G S S- 0 0 82 -3,-0.4 -1,-0.2 -4,-0.1 -4,-0.0 -0.210 105.8-109.3 -94.8 45.2 -10.7 15.7 24.7 113 114 A N + 0 0 119 -3,-0.5 -2,-0.1 -2,-0.3 3,-0.1 0.828 43.6 173.6 26.4 99.0 -11.7 12.0 24.9 114 115 A T - 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