==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-JAN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE, LYASE/DNA 15-APR-11 3RJF . COMPND 2 MOLECULE: DNA POLYMERASE BETA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR V.K.BATRA,W.A.BEARD,S.H.WILSON . 326 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17288.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 223 68.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 1.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 32 9.8 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 . 3 0.9 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 . 12 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 122 37.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.1 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 2 2 0 1 2 2 1 1 0 2 0 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 1 2 1 1 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 . 3 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 10 A T 0 0 181 0, 0.0 4,-0.1 0, 0.0 37,-0.1 0.000 360.0 360.0 360.0 59.3 9.4 -14.8 12.4 2 11 A L + 0 0 96 36,-0.2 3,-0.1 1,-0.2 36,-0.1 0.800 360.0 17.6 -86.5 -35.4 10.7 -17.2 9.8 3 12 A N S >> S+ 0 0 17 35,-0.1 4,-2.4 1,-0.1 3,-0.5 -0.232 84.7 143.9-125.8 37.1 14.2 -15.7 10.1 4 13 A G H 3> + 0 0 17 1,-0.2 4,-1.5 2,-0.2 5,-0.2 0.816 69.3 55.5 -48.3 -37.4 13.5 -14.0 13.5 5 14 A G H 3> S+ 0 0 33 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.927 110.6 42.9 -64.8 -45.5 17.1 -14.7 14.6 6 15 A I H <> S+ 0 0 4 -3,-0.5 4,-2.3 1,-0.2 5,-0.2 0.942 114.1 48.9 -67.4 -48.0 18.7 -13.0 11.6 7 16 A T H X S+ 0 0 21 -4,-2.4 4,-1.4 1,-0.2 -1,-0.2 0.785 111.1 52.3 -64.2 -26.2 16.4 -10.0 11.5 8 17 A D H X S+ 0 0 102 -4,-1.5 4,-2.3 -5,-0.3 -1,-0.2 0.906 107.6 51.7 -73.7 -41.4 16.9 -9.5 15.3 9 18 A M H X S+ 0 0 6 -4,-1.8 4,-2.5 1,-0.2 -2,-0.2 0.944 112.1 45.2 -58.6 -49.3 20.7 -9.6 14.8 10 19 A L H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.841 111.4 53.3 -64.8 -34.2 20.6 -6.9 12.1 11 20 A T H X S+ 0 0 61 -4,-1.4 4,-2.6 -5,-0.2 -1,-0.2 0.877 109.8 48.1 -68.7 -36.8 18.2 -4.8 14.2 12 21 A E H X S+ 0 0 65 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.917 111.8 50.3 -68.3 -42.3 20.6 -5.0 17.2 13 22 A L H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.872 111.2 49.0 -62.7 -38.0 23.4 -4.0 14.8 14 23 A A H X S+ 0 0 1 -4,-2.2 4,-2.2 2,-0.2 5,-0.2 0.953 110.0 49.5 -66.4 -51.6 21.3 -1.1 13.5 15 24 A N H X S+ 0 0 73 -4,-2.6 4,-2.7 1,-0.2 5,-0.4 0.866 111.6 51.5 -55.6 -36.7 20.4 0.2 17.0 16 25 A F H X>S+ 0 0 23 -4,-2.1 4,-1.9 1,-0.2 5,-1.7 0.931 108.7 48.9 -67.2 -45.6 24.1 -0.0 17.9 17 26 A E H <5S+ 0 0 8 -4,-2.1 6,-2.9 3,-0.2 5,-0.2 0.845 118.6 40.6 -63.2 -33.9 25.3 2.0 14.9 18 27 A K H <5S+ 0 0 70 -4,-2.2 -2,-0.2 4,-0.2 -1,-0.2 0.929 123.3 34.0 -80.9 -50.6 22.7 4.7 15.5 19 28 A N H <5S+ 0 0 14 -4,-2.7 84,-0.2 -5,-0.2 -3,-0.2 0.942 134.8 20.7 -73.9 -46.5 22.8 5.0 19.3 20 29 A V T <5S+ 0 0 15 -4,-1.9 -3,-0.2 -5,-0.4 -4,-0.1 0.940 132.1 33.8 -89.5 -56.0 26.6 4.3 19.8 21 30 A S S + 0 0 28 -6,-2.9 4,-1.6 1,-0.1 3,-0.5 -0.766 27.4 175.6-126.2 82.5 26.3 6.4 12.0 24 33 A I H > S+ 0 0 80 -2,-0.4 4,-3.5 1,-0.2 5,-0.2 0.696 75.9 63.8 -64.2 -20.4 22.8 6.5 10.6 25 34 A H H > S+ 0 0 147 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.939 107.2 42.2 -70.3 -41.5 23.9 5.4 7.2 26 35 A K H > S+ 0 0 114 -3,-0.5 4,-2.4 2,-0.2 -2,-0.2 0.853 114.1 56.0 -67.9 -31.5 25.0 2.0 8.7 27 36 A Y H X S+ 0 0 39 -4,-1.6 4,-2.6 2,-0.2 -2,-0.2 0.982 109.1 42.9 -61.9 -57.9 21.7 2.3 10.6 28 37 A N H X S+ 0 0 47 -4,-3.5 4,-3.0 1,-0.2 -2,-0.2 0.899 112.0 56.3 -55.8 -43.3 19.5 2.6 7.5 29 38 A A H X S+ 0 0 50 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.941 111.0 42.0 -54.0 -53.2 21.6 -0.1 5.8 30 39 A Y H X S+ 0 0 21 -4,-2.4 4,-2.9 2,-0.2 5,-0.3 0.910 113.1 53.2 -62.6 -43.5 20.9 -2.6 8.5 31 40 A R H X S+ 0 0 64 -4,-2.6 4,-2.4 -5,-0.2 -2,-0.2 0.947 109.6 49.3 -57.5 -47.2 17.3 -1.6 8.9 32 41 A K H X S+ 0 0 85 -4,-3.0 4,-3.0 1,-0.2 5,-0.3 0.939 112.1 47.1 -57.3 -50.1 16.8 -2.1 5.1 33 42 A A H X S+ 0 0 0 -4,-2.3 4,-2.5 22,-0.3 5,-0.2 0.909 111.5 50.7 -59.2 -44.6 18.4 -5.6 5.2 34 43 A A H X S+ 0 0 9 -4,-2.9 4,-1.7 2,-0.2 -1,-0.2 0.904 112.7 49.3 -59.5 -40.7 16.3 -6.6 8.2 35 44 A S H X S+ 0 0 12 -4,-2.4 4,-1.4 -5,-0.3 3,-0.3 0.969 111.8 44.1 -62.9 -56.5 13.3 -5.4 6.4 36 45 A V H < S+ 0 0 18 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.841 116.0 49.4 -60.2 -34.3 13.9 -7.2 3.1 37 46 A I H >< S+ 0 0 0 -4,-2.5 3,-0.8 -5,-0.3 -1,-0.2 0.806 104.6 59.3 -75.5 -29.2 14.9 -10.4 5.0 38 47 A A H 3< S+ 0 0 70 -4,-1.7 -36,-0.2 -3,-0.3 -2,-0.2 0.838 107.4 45.4 -69.0 -31.0 11.7 -10.2 7.1 39 48 A K T 3< S+ 0 0 144 -4,-1.4 -1,-0.2 -5,-0.1 -2,-0.2 0.437 84.9 116.8 -91.7 2.1 9.5 -10.4 4.1 40 49 A Y < - 0 0 45 -3,-0.8 -38,-0.1 -4,-0.2 4,-0.1 -0.594 60.4-147.5 -73.6 121.2 11.5 -13.2 2.6 41 50 A P S S+ 0 0 97 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.265 71.1 71.5 -73.8 10.7 9.2 -16.3 2.4 42 51 A H S S- 0 0 105 -39,-0.0 2,-1.1 0, 0.0 -2,-0.1 -0.860 87.1-108.5-127.3 163.3 12.0 -18.8 3.0 43 52 A K - 0 0 136 -2,-0.3 -40,-0.1 -40,-0.0 0, 0.0 -0.773 48.0-120.6 -90.1 96.3 14.2 -20.0 5.9 44 53 A I - 0 0 6 -2,-1.1 3,-0.1 1,-0.1 -38,-0.0 -0.025 29.2-173.2 -40.0 133.7 17.6 -18.5 4.9 45 54 A K - 0 0 144 1,-0.3 2,-0.3 2,-0.0 -1,-0.1 0.529 62.1 -2.4-109.2 -12.8 20.2 -21.3 4.6 46 55 A S > - 0 0 36 1,-0.1 4,-1.6 22,-0.0 -1,-0.3 -0.989 68.3-101.9-168.3 168.7 23.3 -19.1 4.0 47 56 A G H > S+ 0 0 0 -2,-0.3 4,-2.5 1,-0.2 5,-0.1 0.873 119.6 57.6 -66.6 -35.9 24.8 -15.7 3.6 48 57 A A H > S+ 0 0 65 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.902 104.5 49.5 -60.5 -44.7 25.0 -16.3 -0.1 49 58 A E H >4 S+ 0 0 33 1,-0.2 3,-0.5 2,-0.2 4,-0.3 0.898 114.4 46.5 -61.7 -39.9 21.2 -16.9 -0.4 50 59 A A H >< S+ 0 0 0 -4,-1.6 3,-1.8 1,-0.2 6,-0.3 0.833 100.8 65.8 -71.7 -33.6 20.6 -13.7 1.6 51 60 A K H 3< S+ 0 0 105 -4,-2.5 -1,-0.2 1,-0.3 5,-0.2 0.783 89.1 68.1 -60.2 -26.0 23.1 -11.8 -0.5 52 61 A K T << S+ 0 0 175 -4,-0.9 -1,-0.3 -3,-0.5 -2,-0.2 0.749 84.9 86.4 -65.3 -24.0 20.7 -12.3 -3.5 53 62 A L S X S- 0 0 27 -3,-1.8 3,-1.5 -4,-0.3 2,-0.4 -0.578 94.4-107.5 -78.0 139.9 18.2 -10.0 -1.7 54 63 A P T 3 S+ 0 0 99 0, 0.0 -18,-0.1 0, 0.0 3,-0.1 -0.549 105.2 33.0 -72.0 123.1 18.7 -6.3 -2.4 55 64 A G T 3 S+ 0 0 38 -2,-0.4 2,-0.8 -4,-0.2 -22,-0.3 0.111 93.0 99.7 118.4 -18.9 20.2 -4.5 0.7 56 65 A V < + 0 0 5 -3,-1.5 -1,-0.1 -6,-0.3 -3,-0.0 -0.861 51.6 171.3-103.2 102.4 22.3 -7.5 1.8 57 66 A G > - 0 0 36 -2,-0.8 4,-1.1 -3,-0.1 -4,-0.1 0.199 50.6 -71.3 -88.1-148.9 25.8 -7.0 0.7 58 67 A T H > S+ 0 0 85 2,-0.2 4,-2.5 3,-0.1 5,-0.2 0.959 125.6 52.6 -74.3 -54.6 29.0 -8.9 1.5 59 68 A K H > S+ 0 0 137 1,-0.2 4,-1.9 2,-0.2 -1,-0.1 0.894 114.1 42.2 -49.0 -49.6 29.5 -7.7 5.1 60 69 A I H > S+ 0 0 14 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.864 110.0 58.3 -69.8 -33.6 26.0 -8.8 6.1 61 70 A A H X S+ 0 0 9 -4,-1.1 4,-1.7 1,-0.2 -2,-0.2 0.922 107.8 47.0 -60.2 -45.0 26.3 -12.0 4.2 62 71 A E H X S+ 0 0 117 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.922 110.3 52.5 -63.0 -44.0 29.3 -13.0 6.2 63 72 A K H X S+ 0 0 33 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.847 107.0 53.1 -61.9 -33.4 27.5 -12.0 9.5 64 73 A I H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.886 105.4 54.2 -70.2 -36.9 24.6 -14.2 8.5 65 74 A D H X S+ 0 0 80 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.946 110.1 47.2 -61.1 -47.4 26.9 -17.2 7.9 66 75 A E H X>S+ 0 0 37 -4,-2.1 4,-2.5 1,-0.2 5,-0.5 0.952 111.3 50.3 -58.8 -51.0 28.4 -16.8 11.4 67 76 A F H X5S+ 0 0 45 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.892 111.6 48.3 -54.3 -44.8 24.9 -16.5 13.0 68 77 A L H <5S+ 0 0 70 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.908 114.7 44.9 -63.4 -43.4 23.7 -19.6 11.3 69 78 A A H <5S+ 0 0 89 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.806 133.7 15.6 -72.7 -32.7 26.8 -21.7 12.2 70 79 A T H <5S- 0 0 79 -4,-2.5 -3,-0.2 2,-0.3 -2,-0.2 0.525 95.8-121.3-118.7 -13.0 27.0 -20.6 15.9 71 80 A G S < - 0 0 4 -2,-0.3 4,-2.1 1,-0.1 3,-0.2 -0.988 8.0-154.6-133.1 123.5 27.5 -12.9 16.5 74 83 A R H > S+ 0 0 150 -2,-0.4 4,-2.6 1,-0.2 5,-0.3 0.895 96.2 59.9 -61.4 -42.0 30.9 -12.2 18.2 75 84 A K H > S+ 0 0 78 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.893 111.2 40.8 -54.4 -41.3 30.7 -8.5 17.2 76 85 A L H > S+ 0 0 5 -3,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.850 109.4 59.7 -75.5 -35.4 27.4 -8.2 19.1 77 86 A E H X S+ 0 0 76 -4,-2.1 4,-1.3 1,-0.2 -2,-0.2 0.926 108.9 44.3 -57.3 -45.3 28.7 -10.3 22.0 78 87 A K H X S+ 0 0 144 -4,-2.6 4,-2.5 1,-0.2 3,-0.2 0.900 110.9 54.0 -65.6 -43.3 31.6 -7.8 22.5 79 88 A I H < S+ 0 0 19 -4,-1.6 7,-0.3 -5,-0.3 -2,-0.2 0.889 106.7 51.8 -60.1 -37.2 29.2 -4.9 22.2 80 89 A R H < S+ 0 0 106 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.833 109.9 51.3 -67.2 -31.1 27.0 -6.4 24.9 81 90 A Q H < S+ 0 0 140 -4,-1.3 -2,-0.2 -3,-0.2 -1,-0.2 0.964 87.6 91.8 -67.6 -56.4 30.1 -6.7 27.1 82 91 A D X - 0 0 73 -4,-2.5 4,-2.0 1,-0.1 5,-0.2 -0.148 65.5-153.6 -45.5 123.6 31.3 -3.1 26.7 83 92 A D H > S+ 0 0 121 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.893 92.1 50.3 -71.3 -42.6 29.8 -1.0 29.5 84 93 A T H > S+ 0 0 59 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.972 112.6 47.8 -60.5 -51.1 29.8 2.3 27.7 85 94 A S H > S+ 0 0 11 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.924 115.3 44.0 -53.3 -51.8 28.0 0.7 24.7 86 95 A S H X S+ 0 0 46 -4,-2.0 4,-2.3 -7,-0.3 -1,-0.2 0.844 114.0 51.0 -64.9 -34.9 25.4 -1.0 26.8 87 96 A S H X S+ 0 0 16 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.954 113.4 43.5 -68.1 -49.3 24.9 2.1 29.0 88 97 A I H X S+ 0 0 0 -4,-3.1 4,-2.0 2,-0.2 -2,-0.2 0.977 113.8 50.9 -59.3 -55.9 24.3 4.4 26.0 89 98 A N H < S+ 0 0 37 -4,-2.8 4,-0.4 -5,-0.3 3,-0.3 0.917 111.3 50.0 -47.0 -50.3 22.1 1.9 24.2 90 99 A F H >< S+ 0 0 48 -4,-2.3 3,-1.8 1,-0.2 -1,-0.2 0.916 107.4 50.9 -57.4 -49.3 20.0 1.5 27.4 91 100 A L H >< S+ 0 0 0 -4,-2.5 3,-2.2 1,-0.3 -1,-0.2 0.837 98.6 66.2 -60.9 -31.9 19.5 5.3 28.0 92 101 A T T 3< S+ 0 0 27 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.664 87.9 71.3 -65.1 -11.6 18.3 5.8 24.4 93 102 A R T < S+ 0 0 127 -3,-1.8 2,-0.5 -4,-0.4 -1,-0.3 0.647 77.6 91.4 -77.6 -14.0 15.3 3.6 25.4 94 103 A V S X S- 0 0 1 -3,-2.2 3,-2.2 -4,-0.2 37,-0.1 -0.701 93.9-110.2 -81.5 126.8 14.1 6.5 27.5 95 104 A S T 3 S+ 0 0 34 -2,-0.5 35,-0.4 35,-0.3 36,-0.2 -0.376 104.1 23.9 -60.0 128.9 11.8 8.6 25.4 96 105 A G T 3 S+ 0 0 33 1,-0.3 2,-0.6 -4,-0.2 -1,-0.3 0.267 98.2 105.5 99.8 -12.2 13.4 12.0 24.6 97 106 A I < + 0 0 8 -3,-2.2 -1,-0.3 -6,-0.2 -3,-0.1 -0.911 47.5 176.8-104.2 122.0 16.9 10.7 25.1 98 107 A G > - 0 0 27 -2,-0.6 4,-2.7 -3,-0.1 5,-0.2 -0.453 49.5 -77.8-111.6-172.4 18.9 10.2 21.9 99 108 A P H > S+ 0 0 25 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.900 128.8 49.4 -52.3 -47.1 22.5 9.1 21.1 100 109 A S H > S+ 0 0 87 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.964 115.2 40.4 -59.0 -58.0 23.8 12.6 22.0 101 110 A A H > S+ 0 0 21 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.834 114.8 55.0 -62.0 -33.4 22.1 12.9 25.4 102 111 A A H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 5,-0.2 0.965 109.9 43.8 -65.0 -51.8 22.8 9.3 26.1 103 112 A R H X S+ 0 0 83 -4,-2.6 4,-1.0 1,-0.2 -1,-0.2 0.809 112.1 55.8 -63.1 -30.4 26.6 9.6 25.6 104 113 A K H X S+ 0 0 123 -4,-1.9 4,-0.9 -5,-0.2 3,-0.3 0.948 108.3 46.2 -68.0 -48.1 26.6 12.9 27.5 105 114 A F H >X>S+ 0 0 10 -4,-2.3 5,-2.8 1,-0.3 3,-0.8 0.899 110.8 51.5 -61.5 -43.6 25.0 11.3 30.6 106 115 A V H 3<5S+ 0 0 14 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.778 108.3 54.0 -64.9 -23.9 27.3 8.3 30.5 107 116 A D H 3<5S+ 0 0 125 -4,-1.0 -1,-0.3 -3,-0.3 -2,-0.2 0.708 110.5 46.7 -79.5 -21.4 30.1 10.9 30.4 108 117 A E H <<5S- 0 0 77 -4,-0.9 -2,-0.2 -3,-0.8 -1,-0.2 0.434 125.4 -99.9 -98.1 -3.4 28.6 12.5 33.5 109 118 A G T <5S+ 0 0 50 -4,-0.7 2,-0.8 1,-0.2 -3,-0.2 0.473 82.8 127.6 99.2 2.6 28.3 9.2 35.4 110 119 A I < + 0 0 5 -5,-2.8 -1,-0.2 -6,-0.1 -2,-0.2 -0.834 17.2 136.2 -95.6 107.2 24.6 8.6 34.8 111 120 A K + 0 0 76 -2,-0.8 2,-0.3 -3,-0.1 -1,-0.1 0.257 50.1 55.6-139.1 17.3 24.1 5.1 33.3 112 121 A T S > S- 0 0 55 1,-0.1 4,-1.7 -22,-0.0 5,-0.2 -0.919 83.3-104.8-143.5 171.0 21.1 3.4 35.0 113 122 A L H > S+ 0 0 42 -2,-0.3 4,-1.6 1,-0.2 5,-0.1 0.839 123.5 52.6 -64.3 -32.7 17.5 3.8 35.7 114 123 A E H > S+ 0 0 53 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.914 106.3 52.3 -68.9 -43.2 18.4 4.6 39.3 115 124 A D H 4 S+ 0 0 30 1,-0.2 -2,-0.2 2,-0.2 -1,-0.2 0.823 108.3 51.5 -63.4 -31.7 20.9 7.3 38.1 116 125 A L H >< S+ 0 0 1 -4,-1.7 3,-1.4 1,-0.2 -1,-0.2 0.887 107.1 52.9 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