==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 14-APR-97 1BPZ . COMPND 2 MOLECULE: DNA (5'- . SOURCE 2 SYNTHETIC: YES; . AUTHOR M.R.SAWAYA,R.PRASAD,S.H.WILSON,J.KRAUT,H.PELLETIER . 331 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17799.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 241 72.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 2.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 23 6.9 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 . 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 . 1 0.3 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 . 22 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 48 14.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 125 37.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 2.7 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 2 0 1 2 3 0 0 1 2 0 0 1 0 1 0 0 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 1 1 1 0 1 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 . 1 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 5 A K 0 0 205 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 125.8 13.2 -13.8 1.0 2 6 A A + 0 0 53 1,-0.1 42,-0.1 43,-0.1 43,-0.1 -0.929 360.0 155.7-146.6 117.0 15.5 -13.6 4.2 3 7 A P + 0 0 62 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.928 24.7 137.8 -85.1 -82.7 17.1 -16.6 6.3 4 8 A Q >> + 0 0 66 39,-0.2 4,-1.3 40,-0.1 5,-1.1 -0.247 21.8 101.8 47.3 -5.6 20.1 -15.3 8.2 5 9 A E H >5S+ 0 0 164 -2,-0.6 4,-1.4 1,-0.2 5,-0.3 0.974 96.6 20.7 -73.9 -76.4 20.8 -16.4 11.9 6 10 A T H 45S+ 0 0 151 1,-0.2 -1,-0.2 2,-0.1 -2,-0.0 0.518 124.7 70.4 -60.9 -1.7 23.5 -19.1 12.3 7 11 A L H 45S- 0 0 48 36,-0.1 -2,-0.2 41,-0.1 -1,-0.2 0.965 123.6 -21.1 -78.0 -87.2 24.4 -17.8 8.9 8 12 A N H >X5S+ 0 0 4 -4,-1.3 4,-1.9 35,-0.1 3,-1.2 0.526 93.4 115.2-112.9 -5.4 25.9 -14.3 9.1 9 13 A G H 3X S+ 0 0 42 -5,-0.3 4,-2.4 2,-0.2 3,-0.4 0.952 113.2 38.8 -52.4 -53.6 28.2 -12.7 13.9 11 15 A I H <> S+ 0 0 6 -3,-1.2 4,-1.8 1,-0.2 -2,-0.2 0.926 114.5 54.2 -58.7 -55.0 29.3 -10.4 11.1 12 16 A T H X S+ 0 0 17 -4,-1.9 4,-1.2 1,-0.2 -1,-0.2 0.646 111.8 45.8 -58.3 -20.9 26.0 -8.5 11.0 13 17 A D H X S+ 0 0 95 -4,-1.4 4,-1.9 -3,-0.4 -1,-0.2 0.884 106.6 52.3 -93.1 -43.6 26.3 -7.8 14.6 14 18 A M H X S+ 0 0 8 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.844 112.2 54.9 -56.3 -30.9 29.9 -6.7 14.9 15 19 A L H X S+ 0 0 0 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.958 106.0 45.6 -65.6 -56.1 28.8 -4.4 12.1 16 20 A T H X S+ 0 0 60 -4,-1.2 4,-1.9 1,-0.3 5,-0.2 0.737 110.0 56.8 -62.0 -23.0 25.9 -2.9 13.9 17 21 A E H X S+ 0 0 58 -4,-1.9 4,-2.6 2,-0.2 -1,-0.3 0.976 107.2 49.1 -65.7 -51.4 28.1 -2.5 16.8 18 22 A L H X S+ 0 0 1 -4,-2.0 4,-1.4 1,-0.2 -2,-0.2 0.814 110.6 50.1 -49.5 -45.7 30.3 -0.5 14.5 19 23 A A H X S+ 0 0 1 -4,-2.0 4,-2.8 2,-0.2 3,-0.3 0.929 108.7 49.3 -61.5 -55.3 27.4 1.7 13.3 20 24 A N H X S+ 0 0 58 -4,-1.9 4,-1.8 1,-0.2 5,-0.5 0.936 109.8 53.8 -55.4 -49.0 26.1 2.7 16.6 21 25 A F H X>S+ 0 0 22 -4,-2.6 4,-1.9 -5,-0.2 5,-0.6 0.828 108.8 47.0 -53.0 -42.6 29.5 3.6 17.7 22 26 A E H X>S+ 0 0 13 -4,-1.4 5,-2.3 -3,-0.3 6,-2.2 0.864 117.7 43.8 -65.6 -46.2 30.0 5.9 14.7 23 27 A K H X5S+ 0 0 71 -4,-2.8 4,-1.6 4,-0.2 -2,-0.2 0.985 123.5 31.7 -56.0 -81.1 26.7 7.5 15.2 24 28 A N H <5S+ 0 0 8 -4,-1.8 -3,-0.2 1,-0.2 -2,-0.2 0.778 136.0 19.6 -46.1 -54.8 26.7 8.0 19.0 25 29 A V H <5S+ 0 0 18 -4,-1.9 -1,-0.2 -5,-0.5 -3,-0.2 0.562 132.5 35.1-106.1 -9.9 30.3 8.5 19.7 26 30 A S H < + 0 0 21 -6,-2.2 4,-2.5 1,-0.2 5,-0.2 -0.761 19.5 169.9-104.2 79.7 29.3 10.0 11.6 29 33 A I H > S+ 0 0 91 -2,-0.8 4,-2.5 2,-0.2 -1,-0.2 0.836 81.6 47.9 -62.6 -28.3 25.8 9.5 10.5 30 34 A H H > S+ 0 0 161 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.965 113.5 44.4 -76.0 -50.3 26.9 8.7 7.1 31 35 A K H > S+ 0 0 122 1,-0.2 4,-1.5 2,-0.2 5,-0.2 0.847 114.5 52.8 -59.9 -32.6 29.5 6.3 8.1 32 36 A Y H X S+ 0 0 23 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.977 108.2 49.2 -65.9 -51.0 27.0 5.0 10.5 33 37 A N H X S+ 0 0 74 -4,-2.5 4,-2.5 -5,-0.2 -2,-0.2 0.748 106.3 58.3 -60.5 -27.8 24.5 4.5 7.7 34 38 A A H >X S+ 0 0 31 -4,-1.8 4,-2.5 2,-0.2 3,-0.5 0.997 106.0 45.7 -61.1 -71.2 27.0 2.7 5.6 35 39 A Y H 3X S+ 0 0 20 -4,-1.5 4,-1.9 1,-0.3 5,-0.3 0.807 111.2 57.0 -40.4 -37.6 27.7 -0.0 8.2 36 40 A R H 3X S+ 0 0 131 -4,-1.8 4,-2.5 -5,-0.2 -1,-0.3 0.988 108.4 42.3 -64.3 -54.7 24.1 -0.2 8.4 37 41 A K H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 3,-0.8 0.966 111.3 43.1 -50.7 -78.7 26.4 -3.3 4.7 39 43 A A H 3X S+ 0 0 4 -4,-1.9 4,-2.0 1,-0.3 -1,-0.2 0.806 115.4 52.3 -39.4 -42.7 25.2 -5.4 7.7 40 44 A S H 3X S+ 0 0 59 -4,-2.5 4,-1.5 -5,-0.3 -1,-0.3 0.972 108.7 47.1 -65.1 -48.6 21.8 -5.3 6.2 41 45 A V H XX S+ 0 0 34 -4,-3.6 4,-1.6 -3,-0.8 3,-0.9 0.952 114.1 48.1 -56.4 -49.4 22.9 -6.5 2.7 42 46 A I H 3< S+ 0 0 1 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.818 103.1 64.2 -61.0 -29.1 24.9 -9.3 4.4 43 47 A A H 3< S+ 0 0 20 -4,-2.0 -1,-0.3 -5,-0.4 -2,-0.2 0.883 107.7 42.1 -61.5 -32.2 21.8 -10.0 6.5 44 48 A K H << S+ 0 0 81 -4,-1.5 -1,-0.2 -3,-0.9 -2,-0.2 0.869 85.4 108.6 -81.9 -35.5 20.0 -11.0 3.4 45 49 A Y < - 0 0 30 -4,-1.6 2,-2.8 1,-0.1 4,-0.1 -0.278 65.5-137.5 -53.2 105.2 22.7 -13.0 1.5 46 50 A P S S+ 0 0 70 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.178 71.4 62.1 -58.5 47.1 21.9 -16.7 1.5 47 51 A H S S- 0 0 110 -2,-2.8 2,-0.7 -43,-0.0 -43,-0.1 -0.946 86.7 -95.3-159.0 176.3 25.3 -18.2 2.3 48 52 A K - 0 0 141 -2,-0.3 2,-0.2 -40,-0.0 -40,-0.1 -0.878 43.0-122.9-104.2 121.4 27.9 -18.3 4.8 49 53 A I + 0 0 3 -2,-0.7 3,-0.1 1,-0.2 -38,-0.1 -0.472 30.5 177.9 -64.8 129.6 30.5 -15.7 4.1 50 54 A K + 0 0 170 1,-0.2 2,-0.3 -2,-0.2 -1,-0.2 0.568 64.5 19.8-103.8 -19.4 33.9 -17.4 3.8 51 55 A S > - 0 0 42 1,-0.1 4,-1.4 22,-0.0 -1,-0.2 -0.976 67.4-120.9-149.8 162.3 36.0 -14.4 2.9 52 56 A G H >> S+ 0 0 0 -2,-0.3 4,-3.2 1,-0.2 3,-0.7 0.950 119.0 52.8 -62.8 -49.2 36.1 -10.5 3.1 53 57 A A H 3> S+ 0 0 72 1,-0.3 4,-1.4 2,-0.2 -1,-0.2 0.823 102.9 59.8 -55.1 -34.2 36.4 -10.6 -0.7 54 58 A E H 34 S+ 0 0 40 1,-0.2 -1,-0.3 2,-0.2 -2,-0.2 0.927 111.1 36.9 -62.6 -43.0 33.4 -12.7 -0.8 55 59 A A H X< S+ 0 0 0 -4,-1.4 3,-4.5 -3,-0.7 6,-0.3 0.852 104.2 71.8 -73.0 -39.6 31.3 -10.1 0.9 56 60 A K H 3< S+ 0 0 98 -4,-3.2 4,-0.3 1,-0.3 5,-0.2 0.837 82.9 72.1 -41.9 -39.7 33.1 -7.3 -1.0 57 61 A K T 3< S+ 0 0 146 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.649 87.0 97.5 -53.1 -16.3 31.2 -8.7 -3.9 58 62 A L S X S- 0 0 22 -3,-4.5 2,-1.6 -5,-0.1 3,-1.0 -0.484 88.9-109.0 -86.8 152.4 28.3 -7.1 -2.2 59 63 A P T 3 S+ 0 0 101 0, 0.0 3,-0.1 0, 0.0 -18,-0.1 -0.616 113.0 24.2 -79.9 82.4 26.7 -3.7 -2.7 60 64 A G T 3 S+ 0 0 22 -2,-1.6 2,-0.2 1,-0.6 -22,-0.2 -0.168 100.4 107.2 144.7 -18.9 27.9 -1.8 0.3 61 65 A V < + 0 0 14 -3,-1.0 -1,-0.6 -6,-0.3 2,-0.3 -0.630 41.2 154.6 -86.7 152.8 30.9 -3.9 1.0 62 66 A G > - 0 0 21 -2,-0.2 4,-2.7 -3,-0.1 5,-0.2 -0.880 54.8 -68.0-156.5-178.6 34.2 -2.5 0.4 63 67 A T H > S+ 0 0 83 -2,-0.3 4,-3.3 1,-0.2 5,-0.3 0.922 121.4 48.6 -48.1 -64.0 37.7 -2.8 1.4 64 68 A K H > S+ 0 0 149 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.899 120.6 36.5 -49.2 -48.0 37.7 -1.5 4.9 65 69 A I H > S+ 0 0 17 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.823 113.6 58.2 -74.7 -29.7 34.7 -3.7 6.0 66 70 A A H X S+ 0 0 8 -4,-2.7 4,-1.3 1,-0.2 -2,-0.2 0.974 105.9 49.2 -62.0 -48.8 35.9 -6.5 3.9 67 71 A E H X S+ 0 0 112 -4,-3.3 4,-1.8 -5,-0.2 -1,-0.2 0.842 107.1 56.9 -57.9 -34.0 39.1 -6.3 5.9 68 72 A K H >X S+ 0 0 38 -4,-1.3 4,-2.8 -5,-0.3 3,-0.7 0.990 102.0 53.7 -59.4 -56.4 37.0 -6.3 9.1 69 73 A I H 3X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.3 -1,-0.2 0.758 106.5 54.1 -47.2 -34.1 35.3 -9.6 8.1 70 74 A D H 3X S+ 0 0 83 -4,-1.3 4,-2.2 2,-0.2 5,-0.3 0.919 109.2 46.4 -70.5 -43.0 38.7 -11.2 7.7 71 75 A E H S+ 0 0 66 -4,-1.8 4,-1.8 -3,-0.7 5,-0.7 0.879 117.6 45.8 -64.9 -38.8 39.8 -10.2 11.2 72 76 A F H X5S+ 0 0 40 -4,-2.8 4,-3.0 3,-0.2 -2,-0.2 0.989 113.6 45.4 -66.0 -59.5 36.5 -11.5 12.4 73 77 A L H <5S+ 0 0 71 -4,-2.8 -2,-0.2 2,-0.2 -3,-0.2 0.934 122.7 37.3 -46.6 -57.9 36.4 -14.8 10.5 74 78 A A H <5S+ 0 0 88 -4,-2.2 -2,-0.2 -5,-0.2 -3,-0.2 0.975 131.3 26.0 -59.5 -67.2 39.9 -15.6 11.4 75 79 A T H <5S- 0 0 96 -4,-1.8 -3,-0.2 -5,-0.3 -2,-0.2 0.813 96.7-126.2 -70.9 -40.1 40.2 -14.3 15.0 76 80 A G S < - 0 0 4 -2,-0.2 4,-1.8 1,-0.1 3,-0.3 -0.885 13.7-149.9-147.5 108.7 37.6 -7.4 16.2 79 83 A R H > S+ 0 0 172 -2,-0.3 4,-2.0 1,-0.3 3,-0.4 0.866 102.1 53.8 -42.9 -50.6 40.5 -5.7 18.1 80 84 A K H > S+ 0 0 74 1,-0.3 4,-2.0 2,-0.2 -1,-0.3 0.925 108.3 49.8 -49.3 -54.7 39.1 -2.4 17.4 81 85 A L H > S+ 0 0 2 -3,-0.3 4,-2.4 1,-0.2 -1,-0.3 0.771 105.9 57.3 -60.1 -28.8 35.8 -3.5 18.9 82 86 A E H X S+ 0 0 97 -4,-1.8 4,-1.9 -3,-0.4 -1,-0.2 0.965 106.5 45.5 -72.5 -42.3 37.4 -4.8 21.9 83 87 A K H X S+ 0 0 118 -4,-2.0 4,-2.8 2,-0.2 3,-0.5 0.977 114.7 49.6 -58.8 -54.0 39.1 -1.5 22.9 84 88 A I H < S+ 0 0 12 -4,-2.0 7,-0.2 1,-0.3 -1,-0.2 0.918 109.8 49.4 -50.3 -50.4 35.9 0.4 22.3 85 89 A R H < S+ 0 0 118 -4,-2.4 -1,-0.3 1,-0.2 -2,-0.2 0.837 115.5 45.7 -60.1 -30.6 33.8 -2.0 24.3 86 90 A Q H < S+ 0 0 124 -4,-1.9 -2,-0.3 -3,-0.5 -1,-0.2 0.796 91.2 106.7 -79.1 -30.4 36.4 -1.6 27.0 87 91 A D X - 0 0 30 -4,-2.8 4,-1.9 -5,-0.2 5,-0.1 -0.266 59.5-153.5 -55.5 118.9 36.5 2.2 26.6 88 92 A D H > S+ 0 0 119 2,-0.2 4,-3.2 3,-0.2 5,-0.3 0.963 90.7 41.9 -52.1 -64.4 34.7 4.0 29.5 89 93 A T H > S+ 0 0 65 2,-0.2 4,-4.4 1,-0.2 5,-0.3 0.927 112.8 50.6 -49.4 -64.8 33.7 7.1 27.6 90 94 A S H > S+ 0 0 4 1,-0.2 4,-3.6 2,-0.2 -1,-0.2 0.853 114.1 49.4 -48.1 -40.7 32.5 5.5 24.5 91 95 A S H X S+ 0 0 40 -4,-1.9 4,-2.9 2,-0.3 -1,-0.2 0.981 112.3 41.0 -65.1 -57.2 30.5 3.2 26.5 92 96 A S H X S+ 0 0 15 -4,-3.2 4,-2.6 1,-0.3 -2,-0.2 0.892 119.8 50.5 -56.3 -36.7 28.8 5.7 28.8 93 97 A I H X S+ 0 0 10 -4,-4.4 4,-0.8 -5,-0.3 -1,-0.3 0.901 110.2 48.1 -66.1 -41.6 28.5 7.7 25.7 94 98 A N H >< S+ 0 0 38 -4,-3.6 3,-1.6 -5,-0.3 4,-0.3 0.991 116.2 42.3 -58.1 -63.9 27.1 4.7 23.9 95 99 A F H >< S+ 0 0 56 -4,-2.9 3,-4.0 1,-0.3 4,-0.4 0.859 102.7 66.0 -43.6 -58.4 24.5 3.8 26.6 96 100 A L H >< S+ 0 0 0 -4,-2.6 3,-1.1 1,-0.3 -1,-0.3 0.691 95.5 57.9 -41.8 -33.5 23.3 7.3 27.4 97 101 A T T << S+ 0 0 23 -3,-1.6 -1,-0.3 -4,-0.8 5,-0.2 0.608 83.3 80.9 -80.1 -8.6 21.8 7.7 23.9 98 102 A R T < S+ 0 0 123 -3,-4.0 2,-0.3 -4,-0.3 -1,-0.3 0.791 78.4 89.0 -63.4 -19.8 19.7 4.8 24.6 99 103 A V S X S- 0 0 2 -3,-1.1 3,-1.8 -4,-0.4 2,-0.4 -0.598 92.7-110.9 -77.1 132.9 17.6 7.4 26.4 100 104 A S T 3 S+ 0 0 38 -2,-0.3 35,-0.4 35,-0.3 3,-0.1 -0.526 103.3 24.2 -71.6 123.0 15.0 9.2 24.2 101 105 A G T 3 S+ 0 0 33 1,-0.4 2,-0.5 -2,-0.4 -1,-0.3 0.156 100.1 107.5 106.9 -7.5 15.9 12.8 23.6 102 106 A I < + 0 0 13 -3,-1.8 -1,-0.4 -5,-0.2 0, 0.0 -0.870 41.2 166.8-104.7 137.8 19.5 12.2 24.1 103 107 A G > - 0 0 24 -2,-0.5 4,-2.8 -3,-0.1 5,-0.2 -0.505 53.4 -77.5-125.4-167.0 21.7 12.2 21.2 104 108 A P H > S+ 0 0 32 0, 0.0 4,-1.5 0, 0.0 5,-0.2 0.638 124.6 54.7 -75.0 -23.4 25.4 12.3 20.9 105 109 A S H > S+ 0 0 89 2,-0.2 4,-2.7 3,-0.2 3,-0.1 0.986 116.8 37.0 -72.7 -58.6 25.8 16.0 21.6 106 110 A A H > S+ 0 0 11 1,-0.3 4,-2.5 2,-0.2 3,-0.4 0.951 118.6 52.0 -46.1 -62.4 24.0 15.7 24.9 107 111 A A H X S+ 0 0 0 -4,-2.8 4,-1.4 1,-0.3 -1,-0.3 0.876 114.1 41.7 -48.0 -41.0 25.5 12.3 25.5 108 112 A R H X S+ 0 0 100 -4,-1.5 4,-1.0 -5,-0.2 -1,-0.3 0.850 115.6 54.2 -78.2 -25.0 28.9 13.6 24.9 109 113 A K H >X S+ 0 0 100 -4,-2.7 3,-1.8 -3,-0.4 4,-1.5 0.997 110.2 41.4 -62.1 -68.8 28.0 16.6 26.8 110 114 A F H 3<>S+ 0 0 0 -4,-2.5 5,-1.9 1,-0.3 3,-0.4 0.889 110.6 57.9 -41.2 -64.1 26.8 14.9 30.0 111 115 A V H ><5S+ 0 0 6 -4,-1.4 3,-1.0 -5,-0.3 -1,-0.3 0.724 102.7 54.3 -42.1 -34.5 29.5 12.5 30.0 112 116 A D H <<5S+ 0 0 119 -3,-1.8 -1,-0.2 -4,-1.0 -2,-0.2 0.963 102.8 54.6 -68.5 -51.6 32.1 15.3 30.0 113 117 A E T 3<5S- 0 0 110 -4,-1.5 -1,-0.3 -3,-0.4 -2,-0.2 0.271 129.6-100.9 -68.0 21.8 30.6 16.9 33.1 114 118 A G T < 5S+ 0 0 43 -3,-1.0 2,-0.3 1,-0.3 -3,-0.2 0.487 82.7 135.2 73.2 1.9 31.1 13.4 34.6 115 119 A I < + 0 0 7 -5,-1.9 -1,-0.3 -6,-0.2 -2,-0.1 -0.655 14.4 137.2 -78.5 136.0 27.4 12.5 34.2 116 120 A K + 0 0 78 -2,-0.3 2,-0.2 -3,-0.1 -20,-0.2 0.442 43.3 58.0-163.6 12.1 27.2 9.0 32.8 117 121 A T S > S- 0 0 42 1,-0.1 4,-1.1 -22,-0.1 5,-0.0 -0.712 82.8 -99.5-135.1-171.2 24.7 6.8 34.3 118 122 A L H > S+ 0 0 20 -2,-0.2 4,-3.2 2,-0.2 5,-0.1 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