==== 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 HYDROLASE 26-NOV-01 1KG3 . COMPND 2 MOLECULE: A/G-SPECIFIC ADENINE GLYCOSYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR R.GILBOA,A.KILSHTEIN,D.O.ZHARKOV,J.H.KYCIA,S.E.GERCHMAN,A.P. . 224 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11296.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 149 66.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 7 3.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 107 47.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.3 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 0 2 1 0 1 0 1 1 1 0 3 1 1 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 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 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 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 42 0, 0.0 206,-0.0 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 139.9 -11.6 -2.5 -0.1 2 2 A Q > - 0 0 132 1,-0.1 4,-2.0 4,-0.1 3,-0.4 -0.327 360.0-125.8 -60.6 141.8 -11.4 -6.0 -1.8 3 3 A A H > S+ 0 0 31 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.868 105.8 54.6 -57.1 -40.9 -13.8 -8.5 -0.2 4 4 A S H > S+ 0 0 96 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.879 109.6 48.1 -68.0 -32.0 -11.2 -11.2 0.5 5 5 A Q H > S+ 0 0 70 -3,-0.4 4,-2.4 2,-0.2 5,-0.3 0.911 109.4 54.9 -67.8 -42.7 -9.0 -8.7 2.5 6 6 A F H X S+ 0 0 0 -4,-2.0 4,-2.1 1,-0.2 5,-0.2 0.950 110.7 43.3 -53.0 -56.4 -12.1 -7.5 4.4 7 7 A S H X S+ 0 0 14 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.899 113.1 51.2 -65.4 -36.9 -13.0 -11.0 5.6 8 8 A A H X S+ 0 0 48 -4,-1.7 4,-2.4 -5,-0.2 -1,-0.2 0.894 110.7 48.3 -68.5 -36.7 -9.5 -12.0 6.5 9 9 A Q H X S+ 0 0 37 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.898 112.3 49.2 -69.6 -35.5 -8.9 -8.9 8.6 10 10 A V H X S+ 0 0 0 -4,-2.1 4,-2.6 -5,-0.3 -2,-0.2 0.941 112.3 48.5 -67.3 -44.2 -12.2 -9.3 10.5 11 11 A L H X S+ 0 0 28 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.914 110.4 49.3 -62.1 -42.2 -11.4 -13.0 11.2 12 12 A D H X S+ 0 0 114 -4,-2.4 4,-1.2 2,-0.2 -1,-0.2 0.872 111.9 51.0 -64.6 -36.5 -7.8 -12.3 12.5 13 13 A W H X S+ 0 0 28 -4,-1.9 4,-2.5 1,-0.2 3,-0.4 0.932 109.2 50.0 -62.8 -46.8 -9.3 -9.5 14.7 14 14 A Y H X S+ 0 0 11 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.880 104.2 59.5 -62.4 -35.6 -11.9 -11.9 16.1 15 15 A D H < S+ 0 0 99 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.906 116.5 31.9 -56.8 -40.9 -9.2 -14.5 16.9 16 16 A K H < S+ 0 0 163 -4,-1.2 -2,-0.2 -3,-0.4 -1,-0.2 0.782 137.9 13.7 -94.5 -29.0 -7.4 -12.1 19.2 17 17 A Y H < S+ 0 0 171 -4,-2.5 -3,-0.2 -5,-0.1 -2,-0.2 0.399 88.9 128.5-126.1 -0.2 -10.1 -10.0 20.7 18 18 A G < - 0 0 17 -4,-2.1 2,-0.7 -5,-0.4 165,-0.1 -0.137 63.2-106.4 -74.6 155.3 -13.6 -11.5 20.1 19 19 A R + 0 0 68 1,-0.2 -1,-0.1 163,-0.1 167,-0.1 -0.657 50.6 153.3 -75.4 113.7 -16.5 -12.4 22.3 20 20 A K + 0 0 103 -2,-0.7 -1,-0.2 1,-0.1 -2,-0.0 0.533 55.9 60.3-120.6 -8.1 -16.4 -16.2 22.6 21 21 A T + 0 0 122 4,-0.1 -1,-0.1 5,-0.0 -2,-0.1 0.032 59.3 134.5-117.5 25.5 -18.1 -17.0 26.0 22 22 A L >> - 0 0 20 1,-0.1 3,-1.4 -3,-0.1 4,-1.1 -0.441 69.7-109.7 -63.6 150.8 -21.6 -15.6 25.9 23 23 A P T 34 S+ 0 0 24 0, 0.0 3,-0.5 0, 0.0 -1,-0.1 0.869 116.5 57.4 -57.1 -34.4 -24.1 -18.3 27.2 24 24 A W T 34 S+ 0 0 12 1,-0.2 5,-0.3 8,-0.1 9,-0.1 0.742 101.3 56.3 -76.1 -13.3 -25.5 -18.9 23.8 25 25 A Q T X4 S+ 0 0 46 -3,-1.4 3,-0.9 3,-0.1 2,-0.3 0.758 85.5 90.7 -84.1 -23.2 -22.1 -19.9 22.3 26 26 A I T 3< S- 0 0 89 -4,-1.1 -5,-0.0 -3,-0.5 -6,-0.0 -0.649 116.0 -13.4 -66.8 131.0 -21.5 -22.6 24.9 27 27 A D T 3 S- 0 0 132 -2,-0.3 -1,-0.3 1,-0.1 5,-0.1 0.850 96.8-149.1 42.4 56.9 -23.0 -25.8 23.3 28 28 A K < + 0 0 89 -3,-0.9 -1,-0.1 100,-0.1 -3,-0.1 -0.119 25.0 171.2 -56.9 146.3 -24.8 -23.8 20.6 29 29 A T > - 0 0 55 -5,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.957 47.3-107.5-144.4 160.1 -28.1 -25.0 19.1 30 30 A P H > S+ 0 0 20 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.916 120.7 53.8 -55.3 -41.8 -30.6 -23.4 16.7 31 31 A Y H > S+ 0 0 17 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.941 110.3 45.8 -57.2 -50.2 -33.0 -23.0 19.7 32 32 A K H > S+ 0 0 39 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.890 114.3 47.3 -64.1 -40.8 -30.4 -21.2 21.8 33 33 A V H X S+ 0 0 7 -4,-2.4 4,-2.5 2,-0.2 5,-0.2 0.934 111.6 50.9 -68.1 -45.3 -29.4 -18.8 19.0 34 34 A W H X S+ 0 0 2 -4,-2.9 4,-2.3 -5,-0.2 5,-0.2 0.943 110.6 48.4 -55.4 -49.8 -33.0 -18.0 18.0 35 35 A L H X S+ 0 0 0 -4,-2.3 4,-2.1 -5,-0.2 -1,-0.2 0.931 113.3 47.5 -58.3 -43.2 -33.9 -17.1 21.7 36 36 A S H X S+ 0 0 1 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.893 109.8 52.6 -65.5 -39.4 -30.8 -14.9 22.0 37 37 A E H X S+ 0 0 17 -4,-2.5 4,-0.8 1,-0.2 -1,-0.2 0.905 110.7 47.5 -65.9 -39.6 -31.4 -13.1 18.6 38 38 A V H >< S+ 0 0 6 -4,-2.3 3,-0.8 -5,-0.2 4,-0.4 0.937 113.5 46.8 -68.5 -42.4 -35.0 -12.2 19.6 39 39 A M H >< S+ 0 0 0 -4,-2.1 3,-0.6 1,-0.2 4,-0.4 0.885 112.6 51.1 -65.8 -35.9 -33.9 -10.9 23.1 40 40 A L H 3< S+ 0 0 39 -4,-2.3 3,-0.3 1,-0.2 -1,-0.2 0.640 85.7 88.8 -77.1 -13.3 -31.1 -8.9 21.6 41 41 A Q T << S+ 0 0 91 -4,-0.8 -1,-0.2 -3,-0.8 -2,-0.1 0.887 113.0 3.9 -53.1 -45.1 -33.3 -7.2 19.0 42 42 A Q S < S+ 0 0 101 -3,-0.6 2,-0.3 -4,-0.4 -1,-0.2 0.179 123.0 73.0-132.3 18.5 -34.3 -4.2 21.2 43 43 A T S S- 0 0 23 -4,-0.4 2,-0.1 -3,-0.3 37,-0.0 -0.989 76.4-115.1-137.3 140.6 -32.2 -4.9 24.4 44 44 A Q >> - 0 0 131 -2,-0.3 4,-1.9 1,-0.1 3,-0.9 -0.458 31.5-112.1 -77.0 149.8 -28.5 -4.6 25.2 45 45 A V H 3> S+ 0 0 38 1,-0.2 4,-2.0 2,-0.2 -1,-0.1 0.826 110.8 58.9 -46.7 -47.8 -26.4 -7.7 26.1 46 46 A A H 34 S+ 0 0 67 1,-0.2 -1,-0.2 2,-0.2 -2,-0.0 0.888 112.3 41.2 -59.3 -37.4 -25.8 -6.9 29.8 47 47 A T H <> S+ 0 0 64 -3,-0.9 4,-0.7 1,-0.1 -1,-0.2 0.870 112.4 56.5 -70.8 -40.1 -29.5 -6.8 30.5 48 48 A V H >X S+ 0 0 0 -4,-1.9 4,-2.5 1,-0.2 3,-0.5 0.850 89.5 72.8 -65.0 -37.8 -30.3 -9.9 28.3 49 49 A I H 3X S+ 0 0 57 -4,-2.0 4,-2.2 1,-0.3 -1,-0.2 0.862 96.8 45.7 -55.3 -48.8 -27.9 -12.5 29.9 50 50 A P H 3> S+ 0 0 56 0, 0.0 4,-2.1 0, 0.0 -1,-0.3 0.880 114.8 49.4 -59.5 -38.5 -29.9 -13.1 33.2 51 51 A Y H S- 0 0 65 1,-0.1 4,-1.5 -30,-0.0 3,-0.4 -0.916 85.4-110.7-130.1 159.7 -36.4 -27.4 24.8 62 62 A V H > S+ 0 0 6 -2,-0.3 4,-2.6 40,-0.3 5,-0.2 0.824 117.4 58.9 -60.4 -32.8 -38.8 -25.6 22.3 63 63 A T H > S+ 0 0 49 39,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.897 102.3 53.3 -63.6 -36.9 -41.6 -28.1 23.2 64 64 A D H > S+ 0 0 67 -3,-0.4 4,-1.0 1,-0.2 -1,-0.2 0.930 111.3 46.3 -63.3 -42.1 -41.4 -27.0 26.9 65 65 A L H >< S+ 0 0 0 -4,-1.5 3,-0.5 2,-0.2 -2,-0.2 0.939 112.2 50.7 -63.4 -45.3 -41.8 -23.4 25.7 66 66 A A H 3< S+ 0 0 5 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.912 111.0 47.9 -58.3 -43.5 -44.7 -24.3 23.4 67 67 A N H 3< S+ 0 0 132 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.664 92.8 95.8 -77.4 -16.6 -46.6 -26.2 26.1 68 68 A A S << S- 0 0 8 -4,-1.0 2,-0.1 -3,-0.5 -9,-0.0 -0.435 87.6 -96.3 -73.6 152.9 -46.3 -23.5 28.8 69 69 A P >> - 0 0 85 0, 0.0 4,-1.3 0, 0.0 3,-1.2 -0.456 27.3-124.9 -66.2 140.0 -49.1 -21.0 29.3 70 70 A L H 3> S+ 0 0 65 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.862 109.9 60.6 -52.5 -36.9 -48.6 -17.6 27.5 71 71 A D H 3> S+ 0 0 129 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.837 100.5 52.7 -66.1 -29.4 -49.0 -15.8 30.8 72 72 A E H <> S+ 0 0 65 -3,-1.2 4,-2.0 2,-0.2 -1,-0.2 0.850 109.5 49.9 -72.4 -33.4 -46.0 -17.6 32.3 73 73 A V H X S+ 0 0 0 -4,-1.3 4,-1.6 -3,-0.2 -2,-0.2 0.912 110.8 48.9 -64.1 -46.8 -43.9 -16.5 29.3 74 74 A L H X S+ 0 0 41 -4,-2.4 4,-0.8 2,-0.2 -2,-0.2 0.888 109.8 53.2 -64.0 -35.9 -45.1 -12.8 29.7 75 75 A H H >< S+ 0 0 123 -4,-2.0 3,-1.0 -5,-0.2 -2,-0.2 0.951 109.8 46.2 -65.0 -44.1 -44.2 -13.0 33.4 76 76 A L H 3< S+ 0 0 31 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.813 109.5 56.5 -69.6 -23.8 -40.7 -14.2 32.7 77 77 A W H >< S+ 0 0 0 -4,-1.6 3,-2.5 -5,-0.1 4,-0.3 0.615 76.7 130.0 -75.2 -15.8 -40.3 -11.5 30.0 78 78 A T T << S+ 0 0 78 -3,-1.0 -3,-0.1 -4,-0.8 -4,-0.0 -0.145 71.1 24.6 -50.9 122.1 -41.2 -8.6 32.4 79 79 A G T 3 S+ 0 0 54 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.201 98.6 90.1 108.7 -16.1 -38.5 -5.9 32.2 80 80 A L S < S- 0 0 8 -3,-2.5 -2,-0.1 1,-0.1 -38,-0.1 0.678 77.9-150.2 -87.0 -17.0 -37.4 -6.6 28.6 81 81 A G + 0 0 26 -4,-0.3 4,-0.1 -38,-0.0 -1,-0.1 -0.010 65.4 72.9 75.7 169.3 -39.9 -4.3 26.9 82 82 A Y > - 0 0 148 1,-0.1 3,-1.8 2,-0.1 4,-0.3 0.891 57.2-172.9 53.9 59.1 -41.4 -4.7 23.4 83 83 A Y T >> S+ 0 0 86 1,-0.3 4,-2.1 2,-0.2 3,-0.6 0.567 70.5 80.4 -70.4 -15.0 -43.7 -7.6 24.4 84 84 A A H 3> S+ 0 0 48 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.868 89.5 60.8 -54.7 -32.2 -44.8 -8.3 20.8 85 85 A R H <> S+ 0 0 12 -3,-1.8 4,-1.7 2,-0.2 -1,-0.2 0.866 105.2 45.9 -57.9 -40.9 -41.5 -10.2 20.6 86 86 A A H <> S+ 0 0 0 -3,-0.6 4,-2.1 -4,-0.3 -2,-0.2 0.889 110.9 50.9 -73.3 -39.1 -42.7 -12.5 23.5 87 87 A R H X S+ 0 0 125 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.928 113.9 45.2 -65.0 -42.8 -46.1 -13.1 21.9 88 88 A N H X S+ 0 0 53 -4,-2.5 4,-2.5 -5,-0.2 5,-0.2 0.858 108.8 58.3 -67.3 -33.8 -44.4 -14.0 18.6 89 89 A L H X S+ 0 0 3 -4,-1.7 4,-2.0 -5,-0.2 -2,-0.2 0.935 107.5 45.8 -61.2 -44.8 -41.9 -16.2 20.4 90 90 A H H X S+ 0 0 12 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.892 112.8 49.0 -66.1 -42.7 -44.6 -18.3 22.0 91 91 A K H X S+ 0 0 125 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.894 110.0 52.6 -63.2 -39.0 -46.5 -18.7 18.7 92 92 A A H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.929 107.2 51.9 -63.4 -42.7 -43.3 -19.7 16.9 93 93 A A H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 -27,-0.2 0.920 109.5 50.1 -58.7 -43.3 -42.5 -22.4 19.5 94 94 A Q H X S+ 0 0 84 -4,-2.1 4,-2.7 1,-0.2 5,-0.2 0.869 108.4 52.9 -62.6 -37.4 -46.0 -23.8 19.0 95 95 A Q H X S+ 0 0 52 -4,-2.3 4,-3.0 2,-0.2 5,-0.5 0.921 110.2 47.3 -63.5 -42.0 -45.4 -23.9 15.2 96 96 A V H X S+ 0 0 0 -4,-2.2 6,-1.9 2,-0.2 4,-1.5 0.900 114.4 46.5 -67.3 -40.7 -42.2 -25.8 15.6 97 97 A A H < S+ 0 0 30 -4,-2.3 4,-0.4 4,-0.2 -2,-0.2 0.887 120.5 39.7 -62.1 -44.9 -43.9 -28.3 18.0 98 98 A T H < S+ 0 0 115 -4,-2.7 -2,-0.2 -5,-0.2 -3,-0.2 0.908 128.4 25.2 -76.7 -47.6 -46.9 -28.7 15.7 99 99 A L H < S+ 0 0 117 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.2 0.704 128.0 36.2 -89.7 -25.8 -45.3 -28.7 12.2 100 100 A H S >< S- 0 0 49 -4,-1.5 3,-1.9 -5,-0.5 -1,-0.1 0.074 104.5-105.8-126.2 20.7 -41.7 -30.0 12.8 101 101 A G T 3 S- 0 0 75 -4,-0.4 -4,-0.2 1,-0.3 -3,-0.1 0.723 75.2 -62.2 67.9 17.3 -42.0 -32.6 15.6 102 102 A G T 3 S+ 0 0 18 -6,-1.9 2,-0.6 1,-0.3 -39,-0.3 0.524 108.0 121.8 84.1 1.1 -40.4 -30.3 18.2 103 103 A K S < S- 0 0 131 -3,-1.9 -1,-0.3 -7,-0.4 3,-0.1 -0.883 71.2-113.1-101.7 123.9 -37.1 -30.0 16.2 104 104 A F - 0 0 14 -2,-0.6 7,-0.1 -3,-0.1 -73,-0.1 -0.262 41.1-107.4 -54.3 127.6 -36.1 -26.5 15.2 105 105 A P - 0 0 6 0, 0.0 -1,-0.1 0, 0.0 -9,-0.0 -0.232 25.6-162.0 -61.9 151.9 -36.2 -26.2 11.4 106 106 A E + 0 0 67 -3,-0.1 2,-0.4 24,-0.0 3,-0.1 0.185 60.1 87.2-123.1 10.2 -32.9 -26.1 9.5 107 107 A T S > S- 0 0 62 1,-0.1 4,-2.1 0, 0.0 5,-0.2 -0.905 77.0-125.1-113.8 143.9 -33.9 -24.7 6.1 108 108 A F H > S+ 0 0 62 -2,-0.4 4,-2.7 1,-0.2 5,-0.2 0.888 106.5 49.1 -54.9 -48.4 -34.1 -21.0 5.4 109 109 A E H > S+ 0 0 165 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.888 113.0 48.1 -63.8 -36.2 -37.7 -20.8 4.1 110 110 A E H 4 S+ 0 0 81 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.859 113.4 47.3 -73.3 -31.4 -39.0 -22.8 7.2 111 111 A V H >< S+ 0 0 0 -4,-2.1 3,-1.5 1,-0.2 -2,-0.2 0.927 111.7 48.4 -72.3 -44.5 -37.1 -20.6 9.6 112 112 A A H 3< S+ 0 0 34 -4,-2.7 5,-0.2 1,-0.3 -1,-0.2 0.702 100.0 69.1 -71.9 -14.6 -38.1 -17.3 8.1 113 113 A A T 3< S+ 0 0 61 -4,-1.0 -1,-0.3 -5,-0.2 -2,-0.2 0.641 78.5 101.3 -74.5 -15.5 -41.8 -18.5 8.1 114 114 A L S X S- 0 0 4 -3,-1.5 3,-1.8 -4,-0.3 -22,-0.1 -0.433 86.5-104.5 -69.1 140.5 -41.8 -18.3 11.9 115 115 A P T 3 S+ 0 0 40 0, 0.0 -23,-0.2 0, 0.0 -1,-0.1 -0.372 105.9 23.3 -62.5 143.9 -43.5 -15.3 13.3 116 116 A G T 3 S+ 0 0 36 1,-0.2 2,-0.5 -4,-0.1 -27,-0.1 0.384 101.4 103.5 83.7 -2.2 -41.1 -12.7 14.7 117 117 A V < + 0 0 9 -3,-1.8 -1,-0.2 -5,-0.2 2,-0.1 -0.938 46.4 176.8-119.1 115.0 -38.2 -14.0 12.5 118 118 A G > - 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0 0 16 -5,-2.0 70,-0.3 -6,-0.2 -1,-0.2 -0.767 7.5-176.9 -90.5 94.9 -23.1 3.8 1.1 152 152 A S + 0 0 79 -2,-1.1 67,-0.1 68,-0.2 2,-0.1 -0.268 34.9 76.8 -81.0-178.0 -25.2 6.9 1.6 153 153 A G S S- 0 0 32 65,-0.3 68,-2.0 -2,-0.1 70,-0.1 -0.004 87.6 -69.3 94.9 155.6 -29.0 7.0 1.4 154 154 A W > - 0 0 64 66,-0.2 3,-2.2 68,-0.1 6,-0.3 -0.677 32.3-143.2 -80.4 123.0 -31.7 5.8 3.9 155 155 A P T 3 S+ 0 0 20 0, 0.0 6,-0.3 0, 0.0 -1,-0.1 0.576 94.6 80.2 -65.6 -4.0 -31.9 2.0 4.3 156 156 A G T 3 S+ 0 0 41 4,-0.1 2,-0.5 5,-0.1 3,-0.0 0.621 79.6 82.8 -71.8 -14.3 -35.7 2.5 4.6 157 157 A K S X> S- 0 0 98 -3,-2.2 4,-2.2 1,-0.1 3,-1.1 -0.810 85.4-134.2 -92.0 134.3 -35.6 2.7 0.8 158 158 A K H 3> S+ 0 0 159 -2,-0.5 4,-2.7 1,-0.3 5,-0.2 0.841 101.9 55.9 -56.1 -42.6 -35.6 -0.6 -0.9 159 159 A E H 3> S+ 0 0 148 2,-0.2 4,-1.2 1,-0.2 -1,-0.3 0.829 110.8 46.2 -61.9 -30.3 -32.8 0.2 -3.4 160 160 A V H <> S+ 0 0 18 -3,-1.1 4,-2.2 -6,-0.3 -2,-0.2 0.930 111.7 49.0 -80.7 -48.2 -30.5 1.1 -0.5 161 161 A E H X S+ 0 0 41 -4,-2.2 4,-2.5 -7,-0.3 5,-0.2 0.900 110.0 53.5 -57.2 -40.4 -31.3 -1.9 1.6 162 162 A N H X S+ 0 0 69 -4,-2.7 4,-2.0 -5,-0.2 -1,-0.2 0.884 106.1 52.0 -66.2 -33.9 -30.7 -4.1 -1.4 163 163 A K H X S+ 0 0 129 -4,-1.2 4,-2.1 2,-0.2 -1,-0.2 0.903 110.3 50.0 -65.1 -40.2 -27.2 -2.6 -2.0 164 164 A L H X S+ 0 0 1 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.906 108.8 50.6 -66.6 -41.0 -26.4 -3.3 1.6 165 165 A W H X S+ 0 0 22 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.903 109.7 51.9 -61.7 -39.7 -27.5 -7.0 1.3 166 166 A S H X S+ 0 0 59 -4,-2.0 4,-2.2 -5,-0.2 -2,-0.2 0.923 110.1 47.8 -64.3 -42.3 -25.4 -7.4 -1.8 167 167 A L H X S+ 0 0 24 -4,-2.1 4,-1.9 2,-0.2 5,-0.2 0.913 110.8 51.8 -63.4 -41.1 -22.3 -6.0 0.1 168 168 A S H X S+ 0 0 4 -4,-2.5 4,-1.7 1,-0.2 -2,-0.2 0.947 109.7 49.4 -64.9 -42.0 -22.9 -8.3 3.0 169 169 A E H < S+ 0 0 136 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.939 110.5 52.5 -56.3 -45.0 -23.1 -11.3 0.7 170 170 A Q H < S+ 0 0 117 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.866 115.0 36.9 -62.1 -39.4 -19.9 -10.3 -0.9 171 171 A V H < S+ 0 0 2 -4,-1.9 -1,-0.2 -5,-0.1 -2,-0.2 0.642 93.4 96.9 -93.5 -11.4 -17.7 -9.9 2.2 172 172 A T < - 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