==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-FEB-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 18-DEC-10 3Q1X . COMPND 2 MOLECULE: SERINE ACETYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTAMOEBA HISTOLYTICA; . AUTHOR S.KUMAR,S.GOURINATH . 267 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12604.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 200 74.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 36 13.5 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 . 24 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 103 38.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 1 0 0 1 0 0 1 0 0 1 0 0 0 2 0 0 0 1 0 0 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 1 10 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 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 3 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 59 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -33.3 -24.3 -19.1 -39.1 2 2 A D H > + 0 0 108 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.847 360.0 51.1 -63.6 -33.6 -25.0 -16.2 -41.6 3 3 A N H > S+ 0 0 145 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.870 110.6 48.3 -71.5 -36.7 -28.8 -16.5 -41.0 4 4 A Y H > S+ 0 0 74 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.876 110.1 53.3 -67.4 -38.7 -28.3 -16.4 -37.2 5 5 A I H X S+ 0 0 2 -4,-2.4 4,-3.2 1,-0.2 5,-0.3 0.941 107.0 51.5 -59.8 -48.7 -26.0 -13.3 -37.7 6 6 A Y H X S+ 0 0 132 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.895 111.8 46.9 -53.9 -44.5 -28.8 -11.6 -39.7 7 7 A S H X S+ 0 0 48 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.884 114.4 46.0 -67.8 -40.6 -31.3 -12.3 -36.9 8 8 A I H X S+ 0 0 7 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.906 112.7 50.0 -69.3 -42.5 -28.9 -11.1 -34.2 9 9 A A H X S+ 0 0 0 -4,-3.2 4,-2.0 1,-0.2 -2,-0.2 0.847 109.0 53.8 -63.8 -34.9 -28.0 -7.9 -36.2 10 10 A H H X S+ 0 0 74 -4,-2.0 4,-2.1 -5,-0.3 -1,-0.2 0.930 110.7 45.4 -61.8 -47.5 -31.7 -7.2 -36.7 11 11 A Q H X S+ 0 0 79 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.934 113.5 48.9 -62.0 -49.5 -32.3 -7.4 -32.9 12 12 A L H X S+ 0 0 5 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.861 111.0 51.8 -57.7 -38.6 -29.3 -5.2 -32.1 13 13 A Y H X S+ 0 0 44 -4,-2.0 4,-2.4 -5,-0.2 -1,-0.2 0.913 109.1 48.7 -65.7 -43.7 -30.4 -2.7 -34.8 14 14 A E H X S+ 0 0 68 -4,-2.1 4,-1.2 2,-0.2 -2,-0.2 0.853 111.1 51.1 -63.6 -37.7 -33.9 -2.5 -33.3 15 15 A M H X S+ 0 0 25 -4,-2.2 4,-0.9 2,-0.2 3,-0.4 0.923 108.2 52.5 -63.5 -45.4 -32.4 -2.0 -29.8 16 16 A Y H >< S+ 0 0 33 -4,-2.4 3,-0.9 1,-0.2 -2,-0.2 0.928 108.1 51.2 -54.4 -48.0 -30.2 0.8 -31.3 17 17 A L H 3< S+ 0 0 91 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.793 113.9 44.6 -59.0 -29.7 -33.3 2.5 -32.7 18 18 A Q H 3< S+ 0 0 139 -4,-1.2 -1,-0.2 -3,-0.4 -2,-0.2 0.459 86.6 118.1 -99.5 -4.7 -35.0 2.3 -29.3 19 19 A D S << S- 0 0 16 -3,-0.9 -3,-0.0 -4,-0.9 5,-0.0 -0.343 74.3-101.5 -61.6 143.2 -32.1 3.5 -27.2 20 20 A E > - 0 0 110 1,-0.1 3,-2.1 2,-0.0 -1,-0.1 -0.201 38.9-101.2 -58.9 157.4 -32.5 6.7 -25.3 21 21 A D G > S+ 0 0 144 1,-0.3 3,-2.2 2,-0.2 -1,-0.1 0.769 117.6 69.3 -60.6 -29.9 -30.8 9.8 -26.9 22 22 A A G 3 S+ 0 0 60 1,-0.3 -1,-0.3 98,-0.0 99,-0.1 0.698 98.0 52.9 -59.3 -21.5 -27.8 9.7 -24.5 23 23 A F G < S+ 0 0 13 -3,-2.1 2,-0.3 -7,-0.1 -1,-0.3 0.253 106.5 70.7 -97.8 9.8 -26.8 6.5 -26.4 24 24 A H < - 0 0 49 -3,-2.2 2,-0.3 24,-0.1 97,-0.1 -0.847 54.6-179.7-124.8 160.0 -27.0 8.3 -29.7 25 25 A S - 0 0 24 -2,-0.3 -3,-0.0 2,-0.1 -2,-0.0 -0.960 27.0-157.6-156.1 144.8 -25.1 11.0 -31.6 26 26 A K + 0 0 207 -2,-0.3 27,-0.2 2,-0.1 2,-0.1 0.406 68.4 109.3 -92.4 -3.9 -25.4 12.9 -35.0 27 27 A R - 0 0 178 25,-0.1 2,-0.8 1,-0.1 -2,-0.1 -0.430 68.0-136.4 -75.7 147.0 -21.6 13.7 -34.7 28 28 A D - 0 0 100 -2,-0.1 24,-0.1 24,-0.1 21,-0.1 -0.904 30.3-152.8-102.9 103.7 -19.0 12.1 -37.0 29 29 A Y - 0 0 55 -2,-0.8 3,-0.1 19,-0.3 20,-0.0 -0.342 27.1 -82.8 -79.5 154.6 -16.2 11.3 -34.6 30 30 A P - 0 0 89 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.315 52.5-108.8 -57.0 134.8 -12.5 11.1 -35.5 31 31 A H - 0 0 144 -3,-0.1 2,-0.3 2,-0.0 19,-0.1 -0.504 39.7-172.1 -73.1 128.0 -11.6 7.6 -36.9 32 32 A K - 0 0 108 -2,-0.3 2,-0.5 18,-0.1 -3,-0.0 -0.850 15.9-148.9-116.6 154.2 -9.6 5.4 -34.6 33 33 A K + 0 0 88 -2,-0.3 2,-0.2 0, 0.0 3,-0.1 -0.964 29.2 156.4-125.7 112.9 -7.9 2.1 -35.2 34 34 A V - 0 0 26 -2,-0.5 5,-0.1 1,-0.2 -2,-0.0 -0.737 53.3 -50.3-123.0 175.0 -7.6 -0.3 -32.2 35 35 A F > - 0 0 44 -2,-0.2 4,-2.7 122,-0.1 3,-0.5 -0.084 63.4-104.8 -50.6 149.6 -7.2 -4.1 -31.8 36 36 A T H > S+ 0 0 52 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.806 113.4 49.9 -52.9 -50.6 -9.7 -6.1 -33.9 37 37 A E H > S+ 0 0 6 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.893 117.6 40.8 -59.5 -45.3 -12.1 -7.3 -31.2 38 38 A L H > S+ 0 0 0 -3,-0.5 4,-2.6 2,-0.2 -1,-0.2 0.919 113.0 54.7 -66.9 -45.6 -12.6 -3.8 -29.7 39 39 A Q H X S+ 0 0 28 -4,-2.7 4,-1.3 1,-0.2 -2,-0.2 0.924 115.5 39.5 -52.2 -49.7 -12.7 -2.1 -33.1 40 40 A K H X S+ 0 0 32 -4,-2.8 4,-2.1 -5,-0.2 -2,-0.2 0.920 115.5 48.9 -69.6 -47.0 -15.5 -4.4 -34.3 41 41 A L H X S+ 0 0 0 -4,-2.3 4,-2.6 -5,-0.3 5,-0.4 0.837 106.4 58.1 -67.6 -32.9 -17.5 -4.5 -31.0 42 42 A R H X S+ 0 0 5 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.924 110.6 43.2 -57.2 -45.7 -17.4 -0.7 -30.7 43 43 A K H < S+ 0 0 30 -4,-1.3 -2,-0.2 -5,-0.2 -1,-0.2 0.885 115.4 49.0 -68.4 -41.2 -19.1 -0.4 -34.1 44 44 A I H < S+ 0 0 5 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.915 121.4 31.5 -66.2 -48.5 -21.6 -3.2 -33.4 45 45 A F H < S+ 0 0 3 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.2 0.826 136.7 20.1 -82.8 -35.8 -22.7 -1.9 -30.0 46 46 A F >X + 0 0 4 -4,-2.1 3,-1.8 -5,-0.4 4,-0.6 -0.480 66.0 162.1-135.2 64.5 -22.3 1.9 -30.4 47 47 A P H >> + 0 0 0 0, 0.0 4,-2.1 0, 0.0 3,-0.8 0.767 69.8 67.2 -58.7 -30.7 -22.3 2.6 -34.2 48 48 A D H 34 S+ 0 0 11 -25,-0.2 -19,-0.3 1,-0.2 5,-0.1 0.724 106.5 42.3 -60.0 -22.9 -23.1 6.4 -33.8 49 49 A F H <4 S+ 0 0 2 -3,-1.8 -1,-0.2 -7,-0.2 -6,-0.1 0.567 125.0 30.9-104.1 -11.2 -19.7 6.9 -32.1 50 50 A F H << S+ 0 0 27 -3,-0.8 2,-0.3 -4,-0.6 -2,-0.2 0.370 112.1 59.6-132.6 -0.3 -17.6 4.8 -34.4 51 51 A M S < S- 0 0 17 -4,-2.1 2,-0.3 -5,-0.2 -22,-0.3 -0.957 86.8-101.9-126.3 151.7 -19.2 5.0 -37.8 52 52 A K > - 0 0 34 -2,-0.3 3,-2.5 1,-0.1 4,-0.3 -0.558 37.7-124.7 -63.3 129.4 -20.1 7.8 -40.2 53 53 A H G > S+ 0 0 37 1,-0.3 3,-1.2 -2,-0.3 -1,-0.1 0.791 108.1 66.2 -50.4 -36.0 -23.9 8.5 -39.7 54 54 A Q G 3 S+ 0 0 178 1,-0.2 -1,-0.3 3,-0.0 -2,-0.1 0.499 102.0 52.2 -64.8 -1.5 -24.5 8.0 -43.5 55 55 A K G < S+ 0 0 117 -3,-2.5 2,-0.7 5,-0.0 -1,-0.2 0.507 74.7 104.5-116.4 -8.7 -23.5 4.3 -43.0 56 56 A I < + 0 0 20 -3,-1.2 -8,-0.0 -4,-0.3 -3,-0.0 -0.699 36.7 128.8 -86.4 113.1 -25.6 3.0 -40.0 57 57 A T S S- 0 0 74 -2,-0.7 2,-0.3 0, 0.0 -1,-0.1 0.543 75.4-103.0-141.3 -14.1 -28.4 0.7 -41.6 58 58 A E S > S+ 0 0 29 -45,-0.0 4,-3.0 -46,-0.0 5,-0.2 -0.502 120.7 67.9 93.7 -54.0 -28.7 -2.8 -40.0 59 59 A S H > S+ 0 0 92 -2,-0.3 4,-2.2 2,-0.2 5,-0.1 0.879 101.2 46.8 -58.8 -38.7 -26.9 -4.2 -43.1 60 60 A H H > S+ 0 0 51 2,-0.2 4,-2.4 -5,-0.2 -1,-0.2 0.874 110.7 50.7 -74.0 -36.6 -23.8 -2.4 -41.9 61 61 A I H > S+ 0 0 1 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.935 112.7 47.9 -60.4 -46.8 -24.2 -3.7 -38.4 62 62 A A H X S+ 0 0 18 -4,-3.0 4,-2.3 2,-0.2 -2,-0.2 0.894 109.6 53.8 -57.3 -45.0 -24.6 -7.2 -39.9 63 63 A S H X S+ 0 0 45 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.927 112.6 42.1 -55.7 -50.5 -21.5 -6.6 -42.0 64 64 A E H X S+ 0 0 9 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.889 112.4 54.3 -66.1 -38.8 -19.4 -5.7 -39.0 65 65 A L H X S+ 0 0 0 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.888 107.9 50.8 -62.4 -39.4 -20.9 -8.6 -37.0 66 66 A T H X S+ 0 0 35 -4,-2.3 4,-2.9 2,-0.2 5,-0.2 0.904 108.6 51.0 -62.1 -45.7 -19.9 -11.0 -39.8 67 67 A K H X S+ 0 0 105 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.917 113.8 45.2 -59.8 -44.4 -16.3 -9.6 -39.8 68 68 A L H X S+ 0 0 3 -4,-2.4 4,-2.7 2,-0.2 5,-0.3 0.922 113.2 49.5 -62.4 -48.8 -16.1 -10.1 -36.0 69 69 A V H X S+ 0 0 7 -4,-2.8 4,-2.7 1,-0.2 5,-0.2 0.920 111.5 49.0 -57.8 -46.3 -17.7 -13.6 -36.2 70 70 A D H X S+ 0 0 64 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.901 113.0 48.1 -62.5 -38.9 -15.3 -14.7 -38.9 71 71 A Y H X S+ 0 0 93 -4,-1.9 4,-2.2 -5,-0.2 -2,-0.2 0.931 114.8 43.0 -67.8 -47.8 -12.3 -13.4 -37.0 72 72 A I H X S+ 0 0 2 -4,-2.7 4,-3.2 2,-0.2 5,-0.3 0.904 113.3 52.6 -66.6 -43.6 -13.2 -15.0 -33.6 73 73 A K H X S+ 0 0 51 -4,-2.7 4,-2.6 -5,-0.3 -1,-0.2 0.942 110.0 49.2 -55.4 -47.7 -14.2 -18.3 -35.3 74 74 A D H X S+ 0 0 105 -4,-2.1 4,-1.9 -5,-0.2 -2,-0.2 0.914 114.5 44.2 -59.5 -44.1 -10.8 -18.4 -37.1 75 75 A S H X S+ 0 0 22 -4,-2.2 4,-1.5 2,-0.2 -2,-0.2 0.892 113.3 49.3 -70.0 -41.6 -8.9 -17.7 -33.8 76 76 A V H X S+ 0 0 0 -4,-3.2 4,-1.7 1,-0.2 -2,-0.2 0.918 110.8 51.9 -63.8 -40.8 -10.9 -20.2 -31.7 77 77 A T H < S+ 0 0 31 -4,-2.6 -2,-0.2 -5,-0.3 -1,-0.2 0.905 104.6 56.6 -60.0 -43.2 -10.4 -22.8 -34.5 78 78 A A H < S+ 0 0 87 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.890 116.7 34.4 -55.8 -42.3 -6.6 -22.3 -34.4 79 79 A Y H < S+ 0 0 96 -4,-1.5 -1,-0.2 -3,-0.1 -2,-0.2 0.658 139.9 3.3 -87.1 -19.7 -6.4 -23.0 -30.6 80 80 A N S < S- 0 0 55 -4,-1.7 2,-0.3 -5,-0.2 -3,-0.2 0.215 101.2 -65.1-130.7-113.3 -9.1 -25.7 -30.6 81 81 A D > - 0 0 72 -5,-0.1 4,-2.5 1,-0.1 5,-0.2 -0.967 37.2-101.8-150.1 168.8 -11.1 -27.1 -33.5 82 82 A E H > S+ 0 0 139 -2,-0.3 4,-2.1 1,-0.2 5,-0.1 0.876 118.0 45.6 -56.9 -47.3 -13.7 -26.1 -36.2 83 83 A L H > S+ 0 0 110 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.924 113.0 49.2 -67.0 -45.8 -16.7 -27.6 -34.4 84 84 A F H > S+ 0 0 41 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.896 110.9 52.3 -59.1 -42.7 -15.9 -26.2 -31.0 85 85 A A H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.915 107.1 51.5 -57.3 -48.9 -15.3 -22.8 -32.7 86 86 A H H X S+ 0 0 84 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.921 112.3 46.2 -55.4 -48.4 -18.8 -22.9 -34.4 87 87 A Q H X S+ 0 0 101 -4,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.869 113.1 49.1 -63.1 -41.1 -20.5 -23.7 -31.0 88 88 A C H X S+ 0 0 0 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.883 112.8 46.6 -67.5 -39.6 -18.6 -21.0 -29.1 89 89 A V H X S+ 0 0 2 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.819 108.8 54.4 -75.8 -32.4 -19.4 -18.3 -31.7 90 90 A M H X S+ 0 0 53 -4,-2.0 4,-2.6 -5,-0.2 -1,-0.2 0.897 108.7 51.4 -62.6 -38.5 -23.0 -19.3 -31.9 91 91 A A H X S+ 0 0 18 -4,-1.7 4,-1.6 2,-0.2 -2,-0.2 0.868 109.3 48.7 -64.5 -42.2 -23.0 -18.8 -28.0 92 92 A I H X S+ 0 0 6 -4,-1.8 4,-1.0 2,-0.2 3,-0.4 0.972 111.8 49.0 -58.6 -54.8 -21.4 -15.3 -28.4 93 93 A L H >< S+ 0 0 0 -4,-2.6 3,-1.2 1,-0.2 -2,-0.2 0.921 108.6 54.5 -50.6 -49.4 -24.0 -14.4 -31.0 94 94 A E H 3< S+ 0 0 110 -4,-2.6 4,-0.3 1,-0.2 -1,-0.2 0.865 112.4 43.1 -48.9 -45.0 -26.8 -15.6 -28.8 95 95 A K H 3X S+ 0 0 76 -4,-1.6 4,-2.6 -3,-0.4 -1,-0.2 0.511 85.6 95.6 -84.4 -8.1 -25.7 -13.4 -25.9 96 96 A L H S+ 0 0 5 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.941 113.6 45.9 -61.7 -43.2 -28.4 -8.6 -27.2 98 98 A S H > S+ 0 0 42 -4,-0.3 4,-2.3 1,-0.2 -2,-0.2 0.891 112.3 51.3 -67.0 -39.0 -28.1 -9.2 -23.4 99 99 A I H X S+ 0 0 10 -4,-2.6 4,-3.1 2,-0.2 5,-0.2 0.914 106.6 55.0 -59.6 -44.2 -24.5 -8.0 -23.4 100 100 A K H X S+ 0 0 2 -4,-2.4 4,-1.7 -5,-0.2 -2,-0.2 0.928 109.2 47.3 -54.6 -47.8 -25.7 -4.8 -25.2 101 101 A R H X S+ 0 0 129 -4,-2.0 4,-1.5 1,-0.2 -1,-0.2 0.923 113.5 48.1 -59.4 -43.7 -28.3 -4.2 -22.4 102 102 A T H X S+ 0 0 40 -4,-2.3 4,-2.2 1,-0.2 73,-0.6 0.899 107.1 55.4 -66.1 -40.5 -25.6 -4.8 -19.7 103 103 A L H X S+ 0 0 0 -4,-3.1 4,-1.8 1,-0.2 -1,-0.2 0.847 103.2 56.6 -63.2 -33.1 -23.1 -2.5 -21.4 104 104 A K H X S+ 0 0 33 -4,-1.7 4,-2.2 -5,-0.2 -1,-0.2 0.926 107.4 48.2 -60.6 -45.0 -25.7 0.3 -21.2 105 105 A T H X S+ 0 0 30 -4,-1.5 4,-2.6 1,-0.2 -2,-0.2 0.880 107.4 55.5 -64.3 -39.3 -25.9 -0.2 -17.5 106 106 A D H X S+ 0 0 2 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.886 108.2 49.5 -57.6 -39.9 -22.1 -0.1 -17.2 107 107 A L H X S+ 0 0 0 -4,-1.8 4,-2.7 2,-0.2 5,-0.3 0.935 108.8 51.2 -65.2 -46.5 -22.2 3.3 -19.0 108 108 A I H X S+ 0 0 76 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.922 112.0 48.2 -52.7 -46.6 -24.9 4.5 -16.6 109 109 A A H X S+ 0 0 2 -4,-2.6 4,-1.7 2,-0.2 -1,-0.2 0.875 110.0 52.3 -63.1 -40.9 -22.6 3.4 -13.7 110 110 A A H X S+ 0 0 1 -4,-2.2 4,-0.6 66,-0.2 3,-0.2 0.949 113.7 41.7 -61.5 -50.9 -19.6 5.1 -15.2 111 111 A Y H >< S+ 0 0 115 -4,-2.7 3,-1.0 1,-0.2 6,-0.2 0.932 115.5 50.7 -64.0 -43.5 -21.3 8.4 -15.6 112 112 A A H 3< S+ 0 0 64 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.2 0.755 114.6 44.1 -64.7 -27.0 -22.9 8.2 -12.2 113 113 A G H 3< S+ 0 0 6 -4,-1.7 -1,-0.2 -3,-0.2 -2,-0.2 0.403 104.9 67.5 -99.2 0.2 -19.6 7.4 -10.5 114 114 A D X< - 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