==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/DNA 11-JAN-09 3FSQ . COMPND 2 MOLECULE: A/G-SPECIFIC ADENINE GLYCOSYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: GEOBACILLUS STEAROTHERMOPHILUS; . AUTHOR V.L.O'SHEA,M.P.HORVATH,S.S.DAVID . 348 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17463.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 222 63.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 3.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 23 6.6 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 21 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 119 34.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.9 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 1 0 1 0 0 2 2 1 0 4 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 1 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 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 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 8 A F 0 0 108 0, 0.0 2,-2.4 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 123.2 15.1 -12.2 -15.7 2 9 A P > + 0 0 64 0, 0.0 2,-1.8 0, 0.0 4,-1.0 -0.356 360.0 173.8 -68.4 73.0 11.6 -10.7 -16.6 3 10 A A T 4 S+ 0 0 28 -2,-2.4 168,-0.0 1,-0.2 0, 0.0 -0.597 73.3 44.2 -84.5 77.3 12.0 -7.2 -15.2 4 11 A R T 4 S+ 0 0 141 -2,-1.8 4,-0.2 168,-0.0 -1,-0.2 -0.116 108.5 53.0-172.5 -47.2 8.7 -5.8 -16.5 5 12 A E T > S+ 0 0 125 -3,-0.2 4,-0.9 2,-0.2 -2,-0.2 0.668 116.1 46.2 -67.9 -20.8 6.4 -8.6 -15.6 6 13 A F H X S+ 0 0 0 -4,-1.0 4,-1.7 2,-0.2 5,-0.3 0.914 103.8 57.5 -86.8 -57.3 7.9 -8.2 -12.2 7 14 A Q H 4 S+ 0 0 8 1,-0.2 4,-0.4 2,-0.2 -2,-0.2 0.483 115.0 40.8 -58.6 -1.1 7.7 -4.5 -11.8 8 15 A R H > S+ 0 0 128 -4,-0.2 4,-1.4 2,-0.1 -1,-0.2 0.692 108.2 54.3-116.6 -31.4 4.0 -4.8 -12.4 9 16 A D H X S+ 0 0 82 -4,-0.9 4,-0.7 -3,-0.3 -2,-0.2 0.625 118.0 43.6 -70.3 -13.3 3.0 -7.9 -10.4 10 17 A L H X S+ 0 0 0 -4,-1.7 4,-2.6 2,-0.2 -3,-0.2 0.895 110.6 48.3 -92.0 -60.5 4.7 -6.0 -7.6 11 18 A L H > S+ 0 0 23 -4,-0.4 4,-2.5 -5,-0.3 -2,-0.2 0.734 113.4 53.4 -54.5 -25.6 3.4 -2.5 -8.0 12 19 A D H X S+ 0 0 77 -4,-1.4 4,-1.9 2,-0.2 5,-0.3 0.987 107.3 45.9 -69.2 -67.9 -0.1 -4.1 -8.3 13 20 A W H X S+ 0 0 11 -4,-0.7 4,-2.6 1,-0.2 -2,-0.2 0.836 115.9 52.1 -41.8 -37.4 0.1 -6.0 -5.1 14 21 A F H X S+ 0 0 11 -4,-2.6 4,-3.0 2,-0.2 -1,-0.2 0.985 104.3 51.0 -65.5 -60.7 1.4 -2.8 -3.6 15 22 A A H < S+ 0 0 76 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.753 121.0 39.2 -47.3 -27.0 -1.4 -0.5 -4.9 16 23 A R H < S+ 0 0 156 -4,-1.9 -1,-0.2 -5,-0.1 -2,-0.2 0.792 125.3 30.8 -96.9 -34.2 -3.8 -3.0 -3.3 17 24 A E H < S+ 0 0 98 -4,-2.6 -3,-0.2 -5,-0.3 -2,-0.2 0.549 82.2 126.3-105.3 -9.6 -2.0 -4.1 -0.1 18 25 A R < - 0 0 76 -4,-3.0 2,-0.2 -5,-0.2 164,-0.0 -0.106 58.7-120.6 -54.1 146.4 -0.1 -1.0 1.0 19 26 A R - 0 0 75 1,-0.1 2,-1.2 0, 0.0 -1,-0.1 -0.518 16.9-118.0 -86.3 156.7 -0.8 0.3 4.5 20 27 A D + 0 0 146 -2,-0.2 -1,-0.1 3,-0.0 5,-0.1 -0.596 45.3 175.6 -95.2 74.4 -2.1 3.8 5.2 21 28 A L > - 0 0 12 -2,-1.2 3,-2.0 1,-0.1 4,-0.2 -0.467 41.6-115.9 -81.6 151.4 0.9 5.1 7.2 22 29 A P G > S+ 0 0 19 0, 0.0 3,-0.8 0, 0.0 -1,-0.1 0.792 114.7 52.3 -58.8 -30.2 0.9 8.7 8.4 23 30 A W G 3 S+ 0 0 10 1,-0.2 3,-0.3 2,-0.1 5,-0.1 0.418 97.6 64.5 -89.9 -0.1 3.9 9.5 6.2 24 31 A R G < S+ 0 0 26 -3,-2.0 -1,-0.2 1,-0.2 3,-0.0 0.271 71.6 97.5-102.3 9.9 2.4 8.1 3.0 25 32 A K S < S- 0 0 162 -3,-0.8 2,-0.3 -4,-0.2 -1,-0.2 0.700 102.0 -10.5 -64.8 -21.1 -0.3 10.9 3.2 26 33 A D - 0 0 62 -3,-0.3 -1,-0.0 2,-0.1 102,-0.0 -0.912 66.5-106.9-159.6-172.1 2.0 12.7 0.7 27 34 A R + 0 0 96 -2,-0.3 -3,-0.1 101,-0.1 -4,-0.0 -0.031 57.6 149.3-117.1 27.8 5.4 12.8 -1.0 28 35 A D > - 0 0 51 1,-0.1 4,-2.7 -5,-0.1 5,-0.3 -0.530 44.9-141.2 -70.9 117.3 6.8 15.8 0.9 29 36 A P H > S+ 0 0 21 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.861 97.7 52.2 -37.8 -58.2 10.6 15.5 1.3 30 37 A Y H > S+ 0 0 9 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.926 115.2 40.0 -53.3 -50.6 10.7 16.8 4.9 31 38 A K H > S+ 0 0 52 -3,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.861 115.2 51.1 -71.5 -37.0 8.1 14.4 6.2 32 39 A V H X S+ 0 0 2 -4,-2.7 4,-1.8 2,-0.2 -1,-0.2 0.916 112.0 50.0 -60.9 -41.0 9.4 11.4 4.2 33 40 A W H X S+ 0 0 2 -4,-2.7 4,-1.5 -5,-0.3 -2,-0.2 0.896 109.3 48.5 -68.9 -44.4 12.9 12.3 5.5 34 41 A V H X S+ 0 0 0 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.922 113.9 47.2 -61.5 -43.8 11.9 12.4 9.2 35 42 A S H X S+ 0 0 1 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.846 109.2 54.4 -67.9 -32.8 10.0 9.1 8.9 36 43 A E H < S+ 0 0 7 -4,-1.8 4,-0.5 2,-0.2 -1,-0.2 0.818 109.7 46.4 -73.6 -30.1 12.9 7.4 7.2 37 44 A V H >< S+ 0 0 5 -4,-1.5 3,-1.1 2,-0.2 -2,-0.2 0.926 113.3 49.1 -74.5 -45.7 15.3 8.4 9.9 38 45 A M H 3< S+ 0 0 0 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.837 107.0 57.6 -57.5 -37.0 12.8 7.2 12.6 39 46 A L T >< S+ 0 0 31 -4,-2.0 3,-1.9 -5,-0.2 2,-0.5 0.638 76.2 115.2 -75.1 -15.7 12.4 3.9 10.7 40 47 A Q T < S- 0 0 48 -3,-1.1 3,-0.1 -4,-0.5 44,-0.1 -0.409 102.1 -17.6 -59.1 111.5 16.1 3.1 10.8 41 48 A Q T 3 S+ 0 0 166 -2,-0.5 2,-0.3 1,-0.2 -1,-0.3 0.861 122.2 102.8 60.5 34.5 16.4 -0.1 13.0 42 49 A T S < S- 0 0 25 -3,-1.9 -1,-0.2 38,-0.0 5,-0.1 -0.937 74.6-112.9-152.8 125.9 12.9 0.6 14.3 43 50 A R > - 0 0 210 -2,-0.3 4,-2.2 1,-0.1 3,-0.4 -0.210 22.4-121.9 -63.8 146.2 9.6 -1.0 13.5 44 51 A V H > S+ 0 0 31 1,-0.2 4,-2.1 2,-0.2 -1,-0.1 0.873 112.3 53.3 -47.9 -45.1 6.8 0.9 11.7 45 52 A E H 4 S+ 0 0 145 1,-0.2 -1,-0.2 2,-0.2 -2,-0.0 0.864 109.2 48.3 -68.5 -37.1 4.4 0.3 14.6 46 53 A T H > S+ 0 0 58 -3,-0.4 4,-0.6 1,-0.2 -1,-0.2 0.922 113.4 49.0 -60.3 -45.9 6.8 1.7 17.1 47 54 A V H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 3,-0.3 0.813 87.8 83.6 -70.1 -34.0 7.4 4.8 15.0 48 55 A I H X S+ 0 0 51 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.824 95.5 39.5 -42.5 -56.6 3.8 5.7 14.2 49 56 A P H > S+ 0 0 65 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.885 115.3 52.7 -62.9 -42.7 3.1 7.7 17.4 50 57 A Y H X S+ 0 0 57 -4,-0.6 4,-2.9 -3,-0.3 -2,-0.2 0.892 108.0 52.5 -58.8 -40.8 6.5 9.3 17.5 51 58 A F H X S+ 0 0 7 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.911 110.7 46.3 -62.7 -42.8 6.1 10.5 13.9 52 59 A E H X S+ 0 0 104 -4,-1.6 4,-1.0 -5,-0.3 -2,-0.2 0.864 115.4 45.1 -73.1 -36.2 2.8 12.2 14.7 53 60 A Q H X S+ 0 0 123 -4,-2.3 4,-2.0 2,-0.2 5,-0.2 0.961 115.0 49.7 -64.1 -49.7 4.0 13.9 17.8 54 61 A F H X S+ 0 0 0 -4,-2.9 4,-2.0 1,-0.3 -2,-0.2 0.881 113.3 42.6 -60.1 -47.5 7.2 15.0 16.1 55 62 A I H < S+ 0 0 21 -4,-2.5 -1,-0.3 2,-0.2 -2,-0.2 0.738 108.9 61.6 -73.8 -22.8 5.5 16.4 13.0 56 63 A D H < S+ 0 0 131 -4,-1.0 -2,-0.2 -5,-0.2 -1,-0.2 0.947 114.8 32.8 -63.4 -47.2 2.9 18.0 15.3 57 64 A R H < S+ 0 0 116 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.726 130.9 35.0 -82.2 -26.4 5.7 20.0 17.0 58 65 A F < + 0 0 2 -4,-2.0 -1,-0.2 -5,-0.2 6,-0.1 -0.642 65.4 166.0-131.5 73.9 7.9 20.4 14.0 59 66 A P + 0 0 66 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.689 66.0 31.4 -64.4 -21.8 5.5 20.8 11.0 60 67 A T S > S- 0 0 61 -3,-0.1 4,-2.0 1,-0.1 5,-0.2 -0.841 83.8-108.1-134.9 167.4 8.3 22.0 8.7 61 68 A L H > S+ 0 0 8 -2,-0.3 4,-2.5 1,-0.2 5,-0.1 0.877 122.7 50.5 -61.6 -35.3 12.0 21.8 8.0 62 69 A E H > S+ 0 0 67 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.892 105.0 54.3 -70.1 -42.8 12.3 25.3 9.4 63 70 A A H 4 S+ 0 0 30 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.923 114.0 42.9 -58.3 -44.4 10.3 24.5 12.6 64 71 A L H >< S+ 0 0 0 -4,-2.0 3,-1.3 1,-0.2 -2,-0.2 0.914 114.0 50.5 -67.0 -44.6 12.8 21.7 13.3 65 72 A A H 3< S+ 0 0 2 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.888 110.2 50.7 -58.6 -39.9 15.8 23.8 12.3 66 73 A D T 3< S+ 0 0 125 -4,-2.9 2,-0.3 -5,-0.1 -1,-0.2 0.275 92.2 101.0 -87.7 11.9 14.7 26.7 14.6 67 74 A A S < S- 0 0 7 -3,-1.3 2,-0.1 -5,-0.1 -3,-0.0 -0.708 76.2-110.6-100.4 148.7 14.2 24.5 17.7 68 75 A D >> - 0 0 103 -2,-0.3 4,-1.4 1,-0.1 3,-0.6 -0.432 30.3-115.0 -72.5 151.2 16.5 24.0 20.6 69 76 A E H 3> S+ 0 0 45 1,-0.2 4,-2.7 2,-0.2 3,-0.4 0.889 112.9 59.1 -52.4 -49.5 18.2 20.7 21.0 70 77 A D H 3> S+ 0 0 52 1,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.886 105.5 52.1 -49.0 -41.8 16.5 19.8 24.3 71 78 A E H <> S+ 0 0 76 -3,-0.6 4,-1.3 1,-0.2 -1,-0.3 0.882 111.6 43.8 -65.1 -42.4 13.2 20.1 22.4 72 79 A V H X S+ 0 0 3 -4,-1.4 4,-0.6 -3,-0.4 -1,-0.2 0.836 115.0 48.8 -75.6 -31.6 14.1 17.8 19.6 73 80 A L H >< S+ 0 0 6 -4,-2.7 3,-0.7 2,-0.2 4,-0.3 0.878 108.2 54.1 -74.0 -39.0 15.7 15.2 21.9 74 81 A K H >< S+ 0 0 60 -4,-2.5 3,-1.1 -5,-0.3 -1,-0.2 0.870 105.7 53.7 -59.7 -37.6 12.7 15.2 24.1 75 82 A A H 3< S+ 0 0 10 -4,-1.3 -1,-0.2 1,-0.3 -2,-0.2 0.707 110.0 47.8 -70.0 -20.2 10.5 14.5 21.1 76 83 A W T XX S+ 0 0 0 -3,-0.7 3,-2.3 -4,-0.6 4,-0.5 0.359 81.3 140.8 -98.2 0.0 12.8 11.5 20.4 77 84 A E T <4 S+ 0 0 36 -3,-1.1 -3,-0.1 -4,-0.3 -4,-0.0 -0.248 72.7 9.5 -57.3 113.0 12.6 10.2 24.0 78 85 A G T 34 S+ 0 0 24 -2,-0.2 -1,-0.3 255,-0.1 -2,-0.1 0.225 98.1 99.7 107.5 -14.1 12.3 6.5 24.0 79 86 A L T <4 S- 0 0 16 -3,-2.3 -2,-0.1 1,-0.1 2,-0.1 0.832 76.4-140.5 -71.2 -34.8 13.0 5.7 20.3 80 87 A G S < S+ 0 0 22 -4,-0.5 -1,-0.1 -38,-0.0 4,-0.1 -0.265 73.6 71.5 93.2 175.9 16.7 4.8 20.8 81 88 A Y > - 0 0 114 1,-0.1 3,-1.7 2,-0.1 4,-0.3 0.939 60.7-174.1 35.7 69.6 19.8 5.5 18.7 82 89 A Y T >> S+ 0 0 18 1,-0.3 4,-1.2 2,-0.2 3,-1.1 0.691 70.4 74.9 -71.8 -18.5 19.6 9.1 19.8 83 90 A S H 3> S+ 0 0 53 1,-0.2 4,-2.7 2,-0.2 -1,-0.3 0.785 83.1 69.8 -60.3 -27.3 22.4 10.2 17.5 84 91 A R H <> S+ 0 0 14 -3,-1.7 4,-1.4 1,-0.2 -1,-0.2 0.843 102.7 43.5 -57.8 -34.8 19.9 9.8 14.6 85 92 A V H <> S+ 0 0 3 -3,-1.1 4,-1.8 -4,-0.3 -1,-0.2 0.774 110.9 52.8 -87.3 -28.4 18.1 12.9 15.9 86 93 A R H X S+ 0 0 75 -4,-1.2 4,-1.3 2,-0.2 -2,-0.2 0.906 112.6 47.2 -67.0 -40.9 21.3 14.9 16.6 87 94 A N H X S+ 0 0 40 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.863 114.2 45.5 -66.7 -38.9 22.3 14.2 13.0 88 95 A L H X S+ 0 0 2 -4,-1.4 4,-1.4 2,-0.2 5,-0.2 0.862 107.7 56.4 -74.9 -37.1 18.9 15.2 11.5 89 96 A H H X S+ 0 0 20 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.869 115.5 40.0 -59.0 -38.3 18.6 18.3 13.6 90 97 A A H X S+ 0 0 39 -4,-1.3 4,-2.2 2,-0.2 -2,-0.2 0.889 110.9 55.0 -78.5 -44.1 22.0 19.3 12.1 91 98 A A H X S+ 0 0 2 -4,-2.6 4,-1.4 1,-0.2 -2,-0.2 0.714 114.5 44.1 -62.9 -19.5 21.2 18.1 8.6 92 99 A V H X S+ 0 0 0 -4,-1.4 4,-1.5 2,-0.2 -2,-0.2 0.889 108.0 53.8 -89.4 -49.0 18.1 20.3 8.7 93 100 A K H X S+ 0 0 93 -4,-2.1 4,-2.5 -5,-0.2 5,-0.2 0.847 113.9 48.1 -48.1 -36.1 19.8 23.4 10.3 94 101 A E H X>S+ 0 0 73 -4,-2.2 4,-3.8 2,-0.2 5,-0.9 0.974 103.6 54.4 -72.7 -58.9 22.2 23.0 7.3 95 102 A V H <5S+ 0 0 0 -4,-1.4 6,-2.3 3,-0.2 7,-0.4 0.721 118.0 43.3 -48.7 -20.8 19.6 22.6 4.5 96 103 A K H X5S+ 0 0 32 -4,-1.5 4,-2.8 4,-0.3 -2,-0.2 0.919 117.8 37.3 -86.3 -74.1 18.3 25.9 5.9 97 104 A T H <5S+ 0 0 131 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.814 134.7 29.4 -46.2 -37.2 21.4 28.0 6.6 98 105 A R T <5S+ 0 0 129 -4,-3.8 -3,-0.2 -5,-0.2 -1,-0.2 0.885 134.4 25.3 -94.1 -48.0 22.9 26.7 3.5 99 106 A Y T >4> S- 0 0 93 1,-0.2 4,-2.3 25,-0.0 3,-0.6 -0.821 72.3-139.7 -86.0 118.5 20.9 15.4 -6.1 107 114 A P H 3> S+ 0 0 30 0, 0.0 4,-3.1 0, 0.0 5,-0.2 0.867 101.5 49.2 -40.3 -54.6 22.0 12.1 -4.5 108 115 A D H 34 S+ 0 0 126 1,-0.2 4,-0.1 2,-0.2 13,-0.0 0.859 113.5 45.4 -61.6 -37.8 25.5 13.3 -3.9 109 116 A E H <4 S+ 0 0 24 -3,-0.6 3,-0.3 2,-0.1 -1,-0.2 0.799 117.1 45.4 -75.5 -28.9 24.4 16.6 -2.3 110 117 A F H >< S+ 0 0 0 -4,-2.3 3,-2.2 1,-0.2 -2,-0.2 0.939 105.7 57.2 -78.8 -49.0 21.8 14.9 -0.1 111 118 A S T 3< S+ 0 0 54 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.1 0.430 95.2 72.0 -61.9 2.7 24.0 11.9 1.1 112 119 A R T 3 S+ 0 0 167 -3,-0.3 2,-0.3 -5,-0.2 -1,-0.3 0.541 76.1 91.0-100.8 -8.5 26.4 14.5 2.4 113 120 A L S X S- 0 0 7 -3,-2.2 3,-1.7 1,-0.1 -25,-0.1 -0.648 93.6 -90.5 -82.7 145.5 24.2 15.6 5.3 114 121 A K T 3 S+ 0 0 136 -2,-0.3 -23,-0.2 1,-0.2 -1,-0.1 -0.225 110.5 22.8 -56.6 140.6 24.7 13.8 8.6 115 122 A G T 3 S+ 0 0 32 1,-0.2 2,-1.1 -4,-0.1 -1,-0.2 0.191 92.3 118.1 88.3 -16.2 22.6 10.7 9.2 116 123 A V < + 0 0 10 -3,-1.7 -1,-0.2 -6,-0.2 -79,-0.0 -0.743 34.9 160.4 -89.5 99.4 22.1 10.3 5.4 117 124 A G > - 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