==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE, LYASE/DNA 07-MAY-13 4KLT . COMPND 2 MOLECULE: DNA POLYMERASE BETA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR B.D.FREUDENTHAL,W.A.BEARD,D.D.SHOCK,S.H.WILSON . 314 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16870.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 215 68.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 1.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 27 8.6 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 14 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 121 38.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.9 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 0 3 0 1 3 2 0 2 0 1 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 . 0 2 0 0 2 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 . 2 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 0 171 0, 0.0 3,-1.6 0, 0.0 4,-0.3 0.000 360.0 360.0 360.0 78.4 -0.4 18.0 16.2 2 11 A L T 3 + 0 0 91 1,-0.3 3,-0.1 36,-0.1 42,-0.1 0.782 360.0 21.3 -49.1 -37.5 -3.5 19.6 17.8 3 12 A N T 3> S+ 0 0 14 1,-0.1 4,-2.5 40,-0.1 -1,-0.3 -0.123 78.3 130.1-128.3 39.8 -3.8 16.9 20.5 4 13 A G H <> S+ 0 0 11 -3,-1.6 4,-2.9 1,-0.2 5,-0.3 0.836 70.8 61.2 -63.0 -35.8 -0.4 15.4 20.8 5 14 A G H > S+ 0 0 37 -4,-0.3 4,-1.6 1,-0.2 -1,-0.2 0.961 111.9 39.6 -54.6 -50.5 -0.3 15.8 24.5 6 15 A I H > S+ 0 0 3 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.923 114.6 49.7 -67.7 -44.9 -3.3 13.6 24.8 7 16 A T H X S+ 0 0 18 -4,-2.5 4,-2.5 1,-0.2 5,-0.2 0.911 110.7 52.2 -67.1 -35.7 -2.3 11.0 22.1 8 17 A D H X S+ 0 0 110 -4,-2.9 4,-2.4 2,-0.2 -1,-0.2 0.880 109.8 48.8 -59.1 -40.7 1.2 10.7 23.7 9 18 A M H X S+ 0 0 7 -4,-1.6 4,-2.0 -5,-0.3 -2,-0.2 0.934 113.5 47.1 -66.9 -41.4 -0.4 10.0 27.1 10 19 A L H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.886 112.5 48.8 -69.1 -36.7 -2.7 7.4 25.5 11 20 A T H X S+ 0 0 53 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.877 109.1 51.4 -72.2 -40.3 0.2 5.8 23.6 12 21 A E H X S+ 0 0 60 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.893 111.2 50.7 -61.9 -34.8 2.4 5.6 26.7 13 22 A L H X S+ 0 0 0 -4,-2.0 4,-2.1 -5,-0.2 -2,-0.2 0.932 109.9 49.4 -66.0 -44.9 -0.6 4.0 28.5 14 23 A A H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.919 108.9 51.9 -58.6 -46.0 -1.0 1.5 25.6 15 24 A N H X S+ 0 0 65 -4,-2.5 4,-3.3 1,-0.2 5,-0.4 0.921 109.5 50.5 -58.4 -43.7 2.7 0.6 25.7 16 25 A F H X>S+ 0 0 21 -4,-2.0 4,-2.0 2,-0.2 5,-1.9 0.902 109.8 49.4 -60.3 -41.8 2.4 -0.1 29.4 17 26 A E H <>S+ 0 0 7 -4,-2.1 6,-2.7 3,-0.2 5,-0.7 0.925 118.2 40.3 -66.2 -41.6 -0.6 -2.4 29.0 18 27 A K H <5S+ 0 0 77 -4,-2.6 -2,-0.2 4,-0.2 4,-0.2 0.965 124.2 35.2 -69.4 -51.9 1.1 -4.3 26.2 19 28 A N H <5S+ 0 0 13 -4,-3.3 -3,-0.2 -5,-0.2 -2,-0.2 0.890 133.7 16.2 -76.1 -45.4 4.6 -4.5 27.8 20 29 A V T <5S+ 0 0 15 -4,-2.0 -3,-0.2 -5,-0.4 -4,-0.1 0.901 132.1 36.2 -95.3 -57.0 4.0 -4.8 31.5 21 30 A S T + 0 0 26 -6,-2.7 4,-2.5 1,-0.1 3,-0.3 -0.799 24.1 178.5-117.8 87.7 -3.3 -6.9 28.3 24 33 A I H > S+ 0 0 76 -2,-0.6 4,-2.8 1,-0.2 -1,-0.1 0.776 76.9 55.5 -68.8 -25.9 -3.3 -6.8 24.5 25 34 A H H > S+ 0 0 155 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.895 110.4 43.9 -73.6 -42.4 -6.9 -5.8 24.3 26 35 A K H > S+ 0 0 119 -3,-0.3 4,-3.2 2,-0.2 5,-0.3 0.892 111.1 56.1 -62.5 -44.1 -6.4 -2.7 26.5 27 36 A Y H X S+ 0 0 29 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.981 112.5 42.2 -52.6 -57.2 -3.2 -2.0 24.6 28 37 A N H X S+ 0 0 70 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.889 111.2 55.2 -54.8 -42.6 -5.4 -2.0 21.4 29 38 A A H X S+ 0 0 49 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.961 109.5 47.4 -58.4 -47.8 -8.2 -0.0 23.1 30 39 A Y H X S+ 0 0 23 -4,-3.2 4,-2.5 1,-0.2 -1,-0.2 0.918 111.8 49.6 -60.7 -41.7 -5.7 2.7 24.0 31 40 A R H X S+ 0 0 95 -4,-2.3 4,-1.7 -5,-0.3 -1,-0.2 0.870 107.7 54.9 -65.3 -32.8 -4.3 2.8 20.5 32 41 A K H X S+ 0 0 122 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.942 110.1 46.2 -64.8 -44.7 -7.8 3.0 19.1 33 42 A A H X S+ 0 0 0 -4,-2.3 4,-2.3 22,-0.3 5,-0.3 0.936 109.6 54.1 -59.3 -48.9 -8.5 6.1 21.2 34 43 A A H X S+ 0 0 9 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.868 110.4 47.8 -54.8 -37.0 -5.2 7.7 20.3 35 44 A S H X S+ 0 0 33 -4,-1.7 4,-1.4 2,-0.2 -1,-0.2 0.865 109.4 49.5 -77.2 -37.0 -6.0 7.3 16.6 36 45 A V H < S+ 0 0 39 -4,-1.9 4,-0.2 1,-0.2 -1,-0.2 0.850 115.6 46.0 -71.3 -31.3 -9.5 8.7 16.8 37 46 A I H >< S+ 0 0 1 -4,-2.3 3,-1.0 -5,-0.2 -2,-0.2 0.867 109.2 53.9 -76.9 -35.4 -8.2 11.7 18.7 38 47 A A H 3< S+ 0 0 74 -4,-2.1 -2,-0.2 -5,-0.3 -1,-0.2 0.801 110.8 47.4 -67.7 -26.2 -5.2 12.1 16.3 39 48 A K T 3< S+ 0 0 90 -4,-1.4 -1,-0.2 -5,-0.1 -2,-0.2 0.505 87.9 108.4 -89.4 -3.8 -7.7 12.3 13.4 40 49 A Y < - 0 0 40 -3,-1.0 4,-0.1 -4,-0.2 -37,-0.1 -0.658 62.6-148.0 -84.3 122.7 -9.9 14.8 15.2 41 50 A P S S+ 0 0 92 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.225 70.8 70.5 -80.7 12.3 -9.7 18.3 13.7 42 51 A H S S- 0 0 104 -39,-0.0 2,-0.6 0, 0.0 -2,-0.1 -0.871 86.8-107.8-124.7 159.7 -10.3 20.3 16.8 43 52 A K - 0 0 121 -2,-0.3 2,-0.3 1,-0.0 -40,-0.1 -0.786 43.5-122.6 -84.0 123.9 -8.3 21.0 20.0 44 53 A I - 0 0 4 -2,-0.6 3,-0.1 1,-0.1 -38,-0.1 -0.524 30.1-178.6 -75.6 130.8 -10.0 19.0 22.7 45 54 A K + 0 0 160 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.540 64.6 7.0-104.3 -9.7 -11.1 21.1 25.6 46 55 A S S > S- 0 0 41 1,-0.1 4,-1.5 22,-0.0 -1,-0.2 -0.975 70.3-108.7-163.8 160.8 -12.6 18.4 27.9 47 56 A G H > S+ 0 0 0 -2,-0.3 4,-3.2 1,-0.2 5,-0.2 0.888 116.8 61.4 -63.9 -40.9 -13.0 14.7 28.3 48 57 A A H > S+ 0 0 74 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.861 103.1 51.8 -57.4 -34.4 -16.7 15.0 27.5 49 58 A E H >4 S+ 0 0 34 1,-0.2 3,-0.9 2,-0.2 4,-0.3 0.946 112.5 43.4 -66.5 -47.8 -15.7 16.4 24.1 50 59 A A H >< S+ 0 0 0 -4,-1.5 3,-2.9 1,-0.2 6,-0.2 0.880 102.7 69.4 -60.1 -37.2 -13.4 13.4 23.5 51 60 A K H 3< S+ 0 0 97 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.767 85.2 68.7 -58.9 -25.0 -16.1 11.1 24.8 52 61 A K T << S+ 0 0 164 -3,-0.9 -1,-0.3 -4,-0.7 -2,-0.2 0.754 86.6 89.7 -58.8 -24.8 -18.1 11.9 21.7 53 62 A L S X S- 0 0 23 -3,-2.9 3,-1.5 -4,-0.3 2,-0.2 -0.544 87.0-115.2 -82.1 140.7 -15.5 9.9 19.8 54 63 A P T 3 S+ 0 0 91 0, 0.0 3,-0.1 0, 0.0 -18,-0.1 -0.538 105.5 33.0 -72.6 135.0 -15.9 6.1 19.2 55 64 A G T 3 S+ 0 0 31 -2,-0.2 2,-0.6 1,-0.2 -22,-0.3 0.098 99.3 97.9 100.1 -22.0 -13.0 4.3 21.0 56 65 A V < + 0 0 9 -3,-1.5 -1,-0.2 -6,-0.2 2,-0.1 -0.903 53.4 165.7-102.0 120.9 -13.0 6.9 23.7 57 66 A G > - 0 0 29 -2,-0.6 4,-2.2 -3,-0.1 5,-0.2 -0.251 49.4 -64.3-117.6-158.2 -15.0 5.9 26.8 58 67 A T H > S+ 0 0 102 2,-0.2 4,-1.8 1,-0.2 5,-0.2 0.944 125.6 43.7 -56.6 -55.9 -15.6 6.7 30.5 59 68 A K H > S+ 0 0 136 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.918 114.9 48.0 -65.4 -44.3 -12.1 6.0 31.8 60 69 A I H > S+ 0 0 17 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.884 107.8 55.8 -65.4 -37.1 -10.3 7.7 29.0 61 70 A A H X S+ 0 0 12 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.913 108.9 48.5 -58.7 -41.7 -12.5 10.8 29.3 62 71 A E H X S+ 0 0 130 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.868 109.7 50.2 -67.9 -40.5 -11.6 11.1 32.9 63 72 A K H X S+ 0 0 29 -4,-2.1 4,-2.8 2,-0.2 -1,-0.2 0.863 109.6 53.7 -63.8 -35.2 -7.9 10.7 32.3 64 73 A I H X S+ 0 0 0 -4,-2.2 4,-2.9 2,-0.2 5,-0.3 0.916 106.0 51.0 -68.1 -40.2 -8.3 13.4 29.6 65 74 A D H X S+ 0 0 79 -4,-2.1 4,-1.5 2,-0.2 -1,-0.2 0.916 112.0 48.4 -60.4 -41.7 -9.9 15.8 32.2 66 75 A E H X S+ 0 0 37 -4,-2.0 4,-2.8 2,-0.2 6,-0.5 0.949 113.5 46.1 -64.8 -48.1 -6.9 15.1 34.5 67 76 A F H X S+ 0 0 46 -4,-2.8 4,-3.1 1,-0.2 -2,-0.2 0.937 112.7 48.0 -60.8 -49.0 -4.3 15.7 31.8 68 77 A L H < S+ 0 0 72 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.838 118.5 43.8 -61.1 -28.9 -5.9 18.9 30.4 69 78 A A H < S+ 0 0 86 -4,-1.5 -2,-0.2 -5,-0.3 -1,-0.2 0.848 131.8 17.0 -86.5 -35.8 -6.2 20.2 34.0 70 79 A T H < S- 0 0 77 -4,-2.8 -3,-0.2 2,-0.3 -2,-0.2 0.559 90.3-126.2-112.1 -17.1 -2.8 19.2 35.4 71 80 A G S < S+ 0 0 50 -4,-3.1 2,-0.3 -5,-0.4 -4,-0.2 0.450 86.7 67.2 77.0 -0.6 -0.7 18.6 32.3 72 81 A K S S- 0 0 101 -6,-0.5 2,-0.4 -5,-0.1 -2,-0.3 -0.843 74.0-130.7-137.0 175.4 0.1 15.2 33.8 73 82 A L > - 0 0 4 -2,-0.3 4,-2.5 1,-0.1 3,-0.2 -0.978 11.1-148.8-132.6 121.8 -1.5 11.8 34.7 74 83 A R H > S+ 0 0 141 -2,-0.4 4,-3.1 1,-0.2 5,-0.2 0.843 96.8 56.5 -57.7 -37.0 -0.9 10.4 38.2 75 84 A K H > S+ 0 0 72 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.927 110.3 42.7 -62.1 -49.1 -1.1 6.8 37.0 76 85 A L H > S+ 0 0 6 2,-0.2 4,-2.9 -3,-0.2 5,-0.2 0.886 112.7 54.6 -64.5 -40.9 1.6 7.3 34.4 77 86 A E H X S+ 0 0 84 -4,-2.5 4,-0.9 2,-0.2 -2,-0.2 0.967 112.2 44.2 -53.4 -52.6 3.7 9.2 36.9 78 87 A K H >X S+ 0 0 124 -4,-3.1 4,-1.4 2,-0.2 3,-0.9 0.947 113.8 49.7 -57.5 -52.4 3.4 6.2 39.3 79 88 A I H >< S+ 0 0 16 -4,-3.0 3,-1.1 1,-0.3 7,-0.5 0.949 110.8 47.9 -52.1 -56.7 4.1 3.7 36.6 80 89 A R H 3< S+ 0 0 126 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.682 108.6 59.5 -59.8 -16.7 7.2 5.5 35.4 81 90 A Q H << S+ 0 0 133 -3,-0.9 -1,-0.3 -4,-0.9 -2,-0.2 0.810 87.0 88.6 -81.5 -32.5 8.2 5.7 39.1 82 91 A D S+ 0 0 90 2,-0.2 4,-2.3 3,-0.2 5,-0.2 0.909 95.4 46.6 -70.2 -43.9 11.5 0.1 38.8 84 93 A T H > S+ 0 0 56 2,-0.2 4,-3.2 1,-0.2 5,-0.3 0.964 115.4 43.2 -68.2 -54.6 10.0 -3.1 37.5 85 94 A S H > S+ 0 0 15 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.939 117.1 47.0 -53.0 -52.5 7.4 -1.5 35.1 86 95 A S H X S+ 0 0 37 -4,-1.5 4,-2.2 -7,-0.5 -1,-0.2 0.884 115.2 46.2 -62.4 -40.7 9.9 1.1 33.9 87 96 A S H X S+ 0 0 15 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.926 113.6 47.3 -69.5 -43.8 12.6 -1.5 33.3 88 97 A I H X S+ 0 0 0 -4,-3.2 4,-1.7 1,-0.2 -2,-0.2 0.962 113.0 50.9 -60.8 -48.6 10.3 -4.0 31.6 89 98 A N H < S+ 0 0 32 -4,-3.2 4,-0.4 -5,-0.3 -2,-0.2 0.914 111.5 47.8 -52.0 -49.5 8.9 -1.2 29.4 90 99 A F H >< S+ 0 0 54 -4,-2.2 3,-2.2 -5,-0.2 4,-0.3 0.929 106.6 54.0 -60.5 -49.8 12.4 -0.1 28.4 91 100 A L H >< S+ 0 0 0 -4,-2.5 3,-2.3 1,-0.3 -1,-0.2 0.834 95.5 68.1 -60.8 -32.4 13.8 -3.5 27.5 92 101 A T T 3< S+ 0 0 27 -4,-1.7 -1,-0.3 1,-0.3 5,-0.2 0.698 82.6 77.0 -61.3 -14.4 10.9 -4.2 25.1 93 102 A R T < S+ 0 0 125 -3,-2.2 2,-0.5 -4,-0.4 -1,-0.3 0.727 76.5 89.8 -66.2 -21.5 12.5 -1.4 23.0 94 103 A V S X S- 0 0 2 -3,-2.3 3,-2.3 -4,-0.3 37,-0.1 -0.670 92.2-115.7 -72.2 122.5 15.1 -4.0 22.0 95 104 A S T 3 S+ 0 0 41 -2,-0.5 35,-0.4 35,-0.3 36,-0.2 -0.412 103.9 27.0 -57.1 127.5 13.9 -5.8 18.8 96 105 A G T 3 S+ 0 0 33 1,-0.2 2,-0.7 -4,-0.2 -1,-0.3 0.183 96.3 104.0 101.1 -15.6 13.4 -9.5 19.8 97 106 A I < + 0 0 7 -3,-2.3 -1,-0.2 -6,-0.2 -3,-0.1 -0.888 50.0 178.1 -97.5 112.1 12.7 -8.7 23.5 98 107 A G > - 0 0 29 -2,-0.7 4,-3.3 -3,-0.1 5,-0.3 -0.335 49.1 -82.2 -98.6-174.8 8.9 -9.0 24.1 99 108 A P H > S+ 0 0 32 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.858 129.3 49.7 -57.7 -38.1 6.9 -8.6 27.3 100 109 A S H > S+ 0 0 88 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.959 115.8 39.4 -68.2 -52.3 7.7 -12.2 28.3 101 110 A A H > S+ 0 0 25 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.909 115.2 54.3 -62.6 -39.2 11.5 -11.9 27.8 102 111 A A H X S+ 0 0 0 -4,-3.3 4,-2.5 1,-0.2 -1,-0.2 0.923 111.1 45.4 -59.2 -44.7 11.6 -8.4 29.2 103 112 A R H X S+ 0 0 79 -4,-1.9 4,-2.0 -5,-0.3 -1,-0.2 0.855 111.5 52.4 -69.9 -34.6 9.9 -9.6 32.4 104 113 A K H X S+ 0 0 122 -4,-2.1 4,-1.1 2,-0.2 -2,-0.2 0.959 111.8 46.3 -65.0 -51.0 12.2 -12.6 32.6 105 114 A F H ><>S+ 0 0 8 -4,-2.9 5,-2.5 2,-0.2 3,-1.2 0.946 111.0 50.5 -53.4 -55.7 15.3 -10.5 32.4 106 115 A V H ><5S+ 0 0 12 -4,-2.5 3,-2.4 1,-0.3 -1,-0.2 0.932 107.7 53.6 -53.8 -48.6 14.1 -7.8 34.9 107 116 A D H 3<5S+ 0 0 117 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.763 107.1 54.2 -55.1 -26.1 13.3 -10.6 37.4 108 117 A E T <<5S- 0 0 85 -3,-1.2 -1,-0.3 -4,-1.1 -2,-0.2 0.470 126.1-102.7 -83.5 -4.9 16.9 -11.8 36.9 109 118 A G T < 5S+ 0 0 44 -3,-2.4 2,-0.8 -4,-0.4 -3,-0.2 0.575 84.4 129.4 89.2 10.8 18.3 -8.3 37.7 110 119 A I < + 0 0 9 -5,-2.5 -1,-0.2 -6,-0.2 -2,-0.2 -0.865 17.4 140.4-101.4 106.3 18.9 -7.5 34.0 111 120 A K + 0 0 69 -2,-0.8 2,-0.3 -3,-0.1 -1,-0.1 0.418 48.8 51.1-130.0 -1.6 17.3 -4.1 33.4 112 121 A T S > S- 0 0 40 1,-0.1 4,-2.3 -22,-0.1 5,-0.1 -0.885 81.4-106.0-139.0 166.5 19.4 -2.0 31.1 113 122 A L H > S+ 0 0 29 -2,-0.3 4,-3.1 2,-0.2 5,-0.2 0.890 122.8 53.5 -58.5 -40.3 21.2 -2.0 27.8 114 123 A E H > S+ 0 0 123 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.961 107.1 49.9 -58.3 -53.4 24.5 -2.3 29.7 115 124 A D H 4 S+ 0 0 26 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.886 112.1 48.9 -51.1 -43.3 23.1 -5.3 31.6 116 125 A L H >< S+ 0 0 2 -4,-2.3 3,-1.7 1,-0.2 -1,-0.2 0.957 109.4 50.6 -63.3 -49.1 22.2 -6.8 28.3 117 126 A R H 3< S+ 0 0 137 -4,-3.1 3,-0.4 1,-0.3 -1,-0.2 0.723 108.6 55.6 -59.8 -21.3 25.6 -6.1 26.8 118 127 A K T 3< S+ 0 0 135 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 -0.075 110.4 44.1-102.4 32.1 27.0 -7.8 29.9 119 128 A N X + 0 0 29 -3,-1.7 3,-2.5 -5,-0.1 -1,-0.2 -0.023 57.6 151.1-164.0 41.0 25.0 -11.0 29.3 120 129 A E G > S+ 0 0 77 -3,-0.4 3,-2.1 1,-0.3 8,-0.1 0.839 71.8 67.5 -48.3 -36.7 25.3 -11.9 25.6 121 130 A D G 3 S+ 0 0 120 1,-0.3 -1,-0.3 0, 0.0 -3,-0.0 0.699 96.6 52.4 -60.1 -24.6 24.9 -15.6 26.6 122 131 A K G < S+ 0 0 91 -3,-2.5 2,-0.4 -6,-0.2 -1,-0.3 0.264 96.7 85.9 -98.7 13.0 21.3 -15.0 27.7 123 132 A L S < S- 0 0 7 -3,-2.1 2,-0.1 -4,-0.2 -7,-0.0 -0.896 70.6-137.6-110.8 141.1 20.4 -13.4 24.4 124 133 A N > - 0 0 85 -2,-0.4 4,-2.5 -28,-0.1 5,-0.2 -0.368 39.8 -89.9 -87.5 176.7 19.3 -15.3 21.2 125 134 A H H > S+ 0 0 111 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.893 126.6 48.2 -55.9 -44.2 20.5 -14.3 17.8 126 135 A H H > S+ 0 0 43 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.921 112.0 48.4 -65.9 -42.8 17.6 -11.8 17.2 127 136 A Q H > S+ 0 0 14 -31,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.882 107.3 55.6 -67.0 -37.3 18.0 -10.1 20.5 128 137 A R H X S+ 0 0 95 -4,-2.5 4,-2.8 2,-0.2 -1,-0.2 0.924 110.6 47.0 -58.0 -42.2 21.8 -9.7 20.0 129 138 A I H X S+ 0 0 10 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.939 109.5 51.0 -67.2 -49.0 21.0 -8.0 16.8 130 139 A G H < S+ 0 0 1 -4,-2.6 -35,-0.3 -35,-0.4 -1,-0.2 0.830 114.1 47.1 -56.2 -32.8 18.4 -5.7 18.2 131 140 A L H >< S+ 0 0 0 -4,-2.0 3,-2.1 -5,-0.2 4,-0.3 0.961 108.1 53.9 -71.6 -52.7 20.9 -4.7 20.9 132 141 A K H 3< S+ 0 0 125 -4,-2.8 -2,-0.2 1,-0.3 3,-0.2 0.868 122.4 30.0 -48.5 -43.4 23.7 -4.2 18.5 133 142 A Y T 3X S+ 0 0 10 -4,-2.4 4,-3.4 1,-0.2 5,-0.3 0.018 80.2 129.9-109.7 25.2 21.6 -1.7 16.5 134 143 A F H <> S+ 0 0 21 -3,-2.1 4,-0.9 1,-0.2 -1,-0.2 0.917 79.6 37.5 -43.1 -59.8 19.4 -0.4 19.3 135 144 A G H >> S+ 0 0 44 -4,-0.3 3,-1.0 1,-0.2 4,-1.0 0.947 116.7 52.8 -61.1 -47.0 19.9 3.3 18.6 136 145 A D H >4 S+ 0 0 38 1,-0.3 3,-1.2 2,-0.2 -2,-0.2 0.915 106.1 52.5 -54.8 -48.7 19.9 2.8 14.8 137 146 A F H 3< S+ 0 0 46 -4,-3.4 -1,-0.3 1,-0.3 -2,-0.2 0.688 106.1 55.3 -66.8 -17.6 16.6 0.9 14.9 138 147 A E H << S+ 0 0 95 -3,-1.0 -1,-0.3 -4,-0.9 -2,-0.2 0.693 91.0 95.2 -87.3 -13.9 15.0 3.8 16.8 139 148 A K S << S- 0 0 116 -3,-1.2 2,-0.1 -4,-1.0 -3,-0.0 -0.404 76.2-119.9 -75.0 148.8 16.1 6.4 14.2 140 149 A R - 0 0 146 -2,-0.1 40,-0.2 38,-0.0 -1,-0.1 -0.439 22.8-123.0 -79.0 161.1 13.8 7.5 11.3 141 150 A I E -A 179 0A 1 38,-2.4 38,-2.0 -2,-0.1 5,-0.1 -0.926 22.1-129.0-112.9 112.1 14.7 7.0 7.7 142 151 A P E >> -A 178 0A 51 0, 0.0 4,-1.7 0, 0.0 3,-1.0 -0.292 17.9-124.6 -57.9 137.1 14.9 10.1 5.5 143 152 A R H 3> S+ 0 0 37 34,-2.9 4,-2.8 1,-0.3 5,-0.3 0.885 111.0 62.7 -50.7 -42.7 12.9 9.8 2.3 144 153 A E H 3> S+ 0 0 165 33,-0.3 4,-1.1 1,-0.3 -1,-0.3 0.879 107.4 44.2 -49.9 -43.4 16.0 10.7 0.3 145 154 A E H <> S+ 0 0 28 -3,-1.0 4,-2.4 2,-0.2 -1,-0.3 0.819 109.0 56.2 -70.3 -35.8 17.6 7.6 1.7 146 155 A M H X S+ 0 0 1 -4,-1.7 4,-3.3 2,-0.2 5,-0.2 0.949 105.5 51.9 -61.3 -47.5 14.5 5.4 1.1 147 156 A L H X S+ 0 0 82 -4,-2.8 4,-1.4 1,-0.2 -1,-0.2 0.886 111.3 48.4 -54.8 -38.4 14.6 6.4 -2.6 148 157 A Q H X S+ 0 0 74 -4,-1.1 4,-1.5 -5,-0.3 -1,-0.2 0.870 112.0 47.7 -71.6 -37.3 18.3 5.3 -2.6 149 158 A M H X S+ 0 0 2 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.939 108.6 54.8 -66.9 -47.2 17.5 1.9 -0.8 150 159 A Q H X S+ 0 0 47 -4,-3.3 4,-2.7 1,-0.2 5,-0.3 0.863 103.9 57.3 -48.9 -41.4 14.6 1.3 -3.2 151 160 A D H X S+ 0 0 113 -4,-1.4 4,-2.4 -5,-0.2 -1,-0.2 0.959 108.3 44.1 -57.9 -54.3 17.1 1.7 -6.1 152 161 A I H X S+ 0 0 26 -4,-1.5 4,-2.6 1,-0.2 5,-0.3 0.918 114.4 49.9 -58.5 -46.3 19.4 -1.0 -4.9 153 162 A V H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.941 113.2 44.1 -62.7 -48.7 16.5 -3.4 -4.1 154 163 A L H X S+ 0 0 69 -4,-2.7 4,-2.5 -5,-0.2 -1,-0.2 0.921 116.5 48.0 -61.1 -42.4 14.8 -3.1 -7.5 155 164 A N H X S+ 0 0 62 -4,-2.4 4,-2.2 -5,-0.3 -2,-0.2 0.950 112.8 44.4 -65.8 -51.4 18.1 -3.3 -9.4 156 165 A E H X S+ 0 0 17 -4,-2.6 4,-1.1 2,-0.2 -1,-0.2 0.855 111.9 55.1 -65.3 -34.6 19.6 -6.3 -7.6 157 166 A V H >X S+ 0 0 4 -4,-1.9 4,-1.9 -5,-0.3 3,-1.3 0.970 106.8 50.5 -59.4 -52.6 16.2 -8.0 -7.9 158 167 A K H 3< S+ 0 0 136 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.906 104.4 59.4 -49.7 -44.1 16.2 -7.4 -11.7 159 168 A K H 3< S+ 0 0 115 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.771 105.8 47.3 -61.1 -28.4 19.7 -9.0 -11.8 160 169 A V H << S- 0 0 39 -3,-1.3 2,-0.3 -4,-1.1 -1,-0.2 0.897 136.5 -11.5 -75.7 -39.4 18.4 -12.2 -10.4 161 170 A D >< - 0 0 50 -4,-1.9 3,-0.9 -5,-0.1 -1,-0.3 -0.868 53.6-138.3-170.8 131.0 15.5 -12.4 -12.8 162 171 A S T 3 S+ 0 0 98 -2,-0.3 -4,-0.1 1,-0.3 -3,-0.1 0.266 102.1 55.6 -75.1 -0.4 13.9 -9.8 -15.2 163 172 A E T 3 S+ 0 0 108 -6,-0.2 -1,-0.3 -5,-0.1 -5,-0.1 0.646 74.4 109.6-112.0 -24.6 10.4 -10.9 -14.2 164 173 A Y < - 0 0 19 -3,-0.9 2,-0.5 -7,-0.2 24,-0.2 -0.236 57.8-146.9 -53.3 142.1 10.4 -10.4 -10.4 165 174 A I E -B 187 0B 60 22,-2.1 22,-1.9 2,-0.0 2,-0.5 -0.973 16.6-175.0-109.8 121.2 8.2 -7.5 -9.4 166 175 A A E +B 186 0B 20 -2,-0.5 2,-0.4 20,-0.2 20,-0.2 -0.969 3.0 179.5-113.3 132.6 9.4 -5.7 -6.3 167 176 A T E -B 185 0B 24 18,-2.4 18,-2.7 -2,-0.5 2,-0.6 -0.996 21.7-142.0-129.2 128.9 7.4 -2.9 -4.7 168 177 A V E +B 184 0B 3 -2,-0.4 16,-0.2 16,-0.2 2,-0.1 -0.807 34.1 166.8 -88.5 122.2 8.3 -0.8 -1.6 169 178 A C E > +B 183 0B 1 14,-2.5 3,-0.7 -2,-0.6 14,-0.6 -0.138 28.1 75.4-115.0-153.1 5.2 -0.2 0.4 170 179 A G G >> S- 0 0 5 89,-1.4 4,-0.8 86,-0.3 3,-0.7 -0.412 112.9 -23.9 77.1-158.4 4.6 1.1 3.9 171 180 A S G >4>S+ 0 0 16 1,-0.2 5,-1.6 2,-0.2 3,-0.6 0.818 133.7 66.9 -56.1 -34.6 5.0 4.8 4.7 172 181 A F G X45S+ 0 0 8 -3,-0.7 3,-1.6 9,-0.2 -1,-0.2 0.908 96.7 50.7 -54.8 -48.3 7.3 5.2 1.8 173 182 A R G <45S+ 0 0 59 -3,-0.7 140,-0.3 1,-0.3 -1,-0.2 0.745 101.0 64.9 -71.4 -16.0 4.7 4.5 -0.9 174 183 A R G <<5S- 0 0 56 -4,-0.8 -1,-0.3 -3,-0.6 -2,-0.2 0.367 120.3-104.7 -85.3 3.3 2.4 7.1 0.7 175 184 A G T < 5 + 0 0 17 -3,-1.6 -3,-0.2 1,-0.2 -2,-0.1 0.444 62.3 169.1 88.0 1.1 4.8 9.8 -0.1 176 185 A A < - 0 0 30 -5,-1.6 -1,-0.2 1,-0.1 3,-0.1 -0.096 38.9-133.5 -52.5 143.2 5.9 10.0 3.5 177 186 A E S S+ 0 0 153 1,-0.1 -34,-2.9 -35,-0.1 -33,-0.3 0.609 86.6 12.3 -76.9 -15.6 9.0 12.2 4.2 178 187 A S E -A 142 0A 34 -36,-0.3 2,-0.3 -35,-0.1 -1,-0.1 -0.977 69.5-147.3-157.4 157.8 10.6 9.5 6.5 179 188 A S E -A 141 0A 1 -38,-2.0 -38,-2.4 -2,-0.3 3,-0.1 -0.919 20.5-140.1-130.8 152.6 10.0 5.9 7.3 180 189 A G S S- 0 0 40 -2,-0.3 61,-0.4 -40,-0.2 2,-0.3 0.804 88.2 -28.6 -75.4 -31.2 10.4 3.6 10.4 181 190 A D S S- 0 0 39 59,-0.1 2,-0.5 -40,-0.1 -9,-0.2 -0.916 71.9 -84.0-163.9-172.7 11.7 0.9 8.0 182 191 A M E - c 0 242B 0 59,-2.3 61,-2.2 -2,-0.3 2,-0.5 -0.953 31.7-165.6-115.3 127.3 11.6 -0.5 4.5 183 192 A D E -Bc 169 243B 28 -14,-0.6 -14,-2.5 -2,-0.5 2,-0.5 -0.958 7.8-170.0-115.1 121.2 8.8 -2.9 3.5 184 193 A V E -Bc 168 244B 3 59,-3.0 61,-3.4 -2,-0.5 2,-0.4 -0.934 9.1-163.9-118.4 124.9 9.3 -4.9 0.3 185 194 A L E -Bc 167 245B 2 -18,-2.7 -18,-2.4 -2,-0.5 2,-0.4 -0.899 13.6-168.2-101.9 138.8 6.7 -7.0 -1.5 186 195 A L E +Bc 166 246B 1 59,-4.2 61,-2.4 -2,-0.4 2,-0.3 -0.968 10.8 169.4-130.0 138.6 7.9 -9.4 -4.1 187 196 A T E -B 165 0B 0 -22,-1.9 -22,-2.1 -2,-0.4 5,-0.1 -0.902 10.6-166.2-137.3 172.6 6.1 -11.5 -6.7 188 197 A H > - 0 0 19 3,-0.5 3,-2.2 59,-0.3 61,-0.4 -0.952 33.0-118.8-162.3 138.9 7.1 -13.6 -9.7 189 198 A P T 3 S+ 0 0 45 0, 0.0 -1,-0.1 0, 0.0 60,-0.0 0.799 110.8 60.9 -55.5 -27.9 5.1 -15.0 -12.6 190 199 A S T 3 S+ 0 0 58 1,-0.1 2,-0.6 -3,-0.1 -3,-0.0 0.619 95.4 67.5 -76.0 -12.6 6.0 -18.6 -11.6 191 200 A F < 0 0 28 -3,-2.2 58,-2.4 56,-0.1 -3,-0.5 -0.921 360.0 360.0-117.9 108.2 4.4 -18.4 -8.1 192 201 A T 0 0 108 -2,-0.6 -2,-0.0 56,-0.3 0, 0.0 -0.518 360.0 360.0-134.8 360.0 0.6 -18.0 -7.9 193 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 194 205 A T 0 0 175 0, 0.0 2,-0.3 0, 0.0 -2,-0.2 0.000 360.0 360.0 360.0-128.9 3.2 -25.7 -8.0 195 206 A K - 0 0 68 -4,-0.1 -4,-0.0 2,-0.0 -5,-0.0 -0.937 360.0-162.5-141.2 158.4 5.7 -24.4 -5.6 196 207 A Q > - 0 0 122 -2,-0.3 3,-0.7 25,-0.1 2,-0.1 -0.903 12.0-141.0-147.9 131.5 9.4 -23.6 -5.9 197 208 A P T 3 S+ 0 0 78 0, 0.0 24,-0.0 0, 0.0 -2,-0.0 -0.305 82.9 37.3 -74.9 162.5 12.0 -23.1 -3.1 198 209 A K T 3> S+ 0 0 137 1,-0.1 4,-2.5 -2,-0.1 5,-0.2 0.409 75.9 118.2 77.2 -0.4 14.7 -20.4 -3.4 199 210 A L H <> S+ 0 0 12 -3,-0.7 4,-0.7 2,-0.2 -1,-0.1 0.933 92.0 24.8 -64.1 -44.5 12.5 -17.9 -5.0 200 211 A L H > S+ 0 0 1 21,-0.3 4,-2.5 2,-0.2 5,-0.2 0.830 117.8 64.0 -82.0 -37.6 12.9 -15.5 -2.1 201 212 A H H > S+ 0 0 46 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.853 98.0 56.8 -56.0 -38.0 16.2 -17.0 -1.1 202 213 A Q H X S+ 0 0 74 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.950 108.8 44.3 -56.8 -52.9 17.7 -15.8 -4.5 203 214 A V H X S+ 0 0 2 -4,-0.7 4,-2.3 2,-0.2 5,-0.2 0.945 115.2 48.7 -60.0 -48.3 16.8 -12.2 -3.9 204 215 A V H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.938 110.8 50.2 -57.2 -49.3 18.0 -12.3 -0.3 205 216 A E H X S+ 0 0 109 -4,-3.0 4,-2.4 -5,-0.2 -1,-0.2 0.894 110.1 51.3 -57.7 -40.4 21.3 -14.0 -1.3 206 217 A Q H X S+ 0 0 25 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.969 108.7 48.9 -62.3 -53.2 21.9 -11.3 -4.0 207 218 A L H <>S+ 0 0 1 -4,-2.3 5,-2.0 1,-0.3 6,-1.3 0.776 112.9 49.9 -59.0 -30.4 21.3 -8.4 -1.6 208 219 A Q H ><5S+ 0 0 71 -4,-1.9 3,-2.0 -5,-0.2 -1,-0.3 0.887 105.2 56.9 -70.1 -40.4 23.7 -10.1 0.8 209 220 A K H 3<5S+ 0 0 131 -4,-2.4 -2,-0.2 1,-0.3 -3,-0.1 0.901 109.3 44.7 -61.1 -39.5 26.3 -10.5 -2.0 210 221 A V T 3<5S- 0 0 52 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.226 117.6-116.7 -89.1 14.1 26.4 -6.8 -2.7 211 222 A H T < 5S+ 0 0 150 -3,-2.0 -3,-0.2 -5,-0.2 18,-0.2 0.614 82.4 119.0 63.8 18.2 26.5 -6.2 1.1 212 223 A F S - 0 0 19 0, 0.0 3,-3.0 0, 0.0 -56,-0.3 -0.341 35.7-124.6 -59.9 137.8 1.3 -15.0 -5.0 249 262 A K G > S+ 0 0 72 -58,-2.4 3,-1.0 -61,-0.4 4,-0.2 0.798 113.5 56.7 -54.1 -30.6 1.1 -12.9 -8.1 250 263 A D G 3 S+ 0 0 101 1,-0.3 -1,-0.3 -59,-0.2 45,-0.2 0.437 104.7 51.6 -83.4 -0.7 -2.7 -13.3 -7.9 251 264 A Q G <> S+ 0 0 47 -3,-3.0 4,-1.2 1,-0.1 -1,-0.3 -0.047 83.1 113.5-112.8 28.2 -2.7 -11.9 -4.4 252 265 A Y H <> S+ 0 0 42 -3,-1.0 4,-3.0 2,-0.2 3,-0.2 0.979 72.8 36.9 -68.4 -64.2 -0.7 -8.8 -5.5 253 266 A Y H > S+ 0 0 71 1,-0.2 4,-3.3 42,-0.2 5,-0.3 0.844 116.0 53.4 -63.5 -36.9 -3.0 -5.8 -5.2 254 267 A C H > S+ 0 0 4 29,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.891 113.9 45.3 -61.7 -36.4 -4.6 -7.0 -2.0 255 268 A G H X S+ 0 0 1 -4,-1.2 4,-2.4 -3,-0.2 -2,-0.2 0.913 115.7 44.9 -72.9 -45.3 -1.1 -7.4 -0.6 256 269 A V H X S+ 0 0 1 -4,-3.0 4,-1.7 2,-0.2 -86,-0.3 0.923 113.8 49.2 -64.3 -46.3 0.1 -4.0 -1.9 257 270 A L H < S+ 0 0 6 -4,-3.3 4,-0.4 1,-0.2 -2,-0.2 0.920 115.2 45.5 -58.5 -45.9 -3.0 -2.2 -0.7 258 271 A Y H < S+ 0 0 71 -4,-1.9 3,-0.5 -5,-0.3 -1,-0.2 0.865 118.6 39.7 -69.2 -38.7 -2.7 -3.8 2.7 259 272 A F H < S+ 0 0 34 -4,-2.4 -89,-1.4 1,-0.2 -1,-0.2 0.599 88.9 91.4 -89.3 -10.5 1.0 -3.2 3.1 260 273 A T S < S- 0 0 1 -4,-1.7 -86,-0.3 -91,-0.3 2,-0.3 0.816 93.8-126.0 -51.5 -32.6 1.0 0.3 1.6 261 274 A G S S+ 0 0 16 -3,-0.5 5,-0.2 -4,-0.4 -1,-0.2 -0.776 75.7 117.2 118.3-157.9 0.4 1.6 5.1 262 275 A S > - 0 0 5 -2,-0.3 4,-2.3 3,-0.1 5,-0.2 0.988 41.2-167.5 42.3 61.3 -2.1 3.8 6.8 263 276 A D H > S+ 0 0 99 1,-0.2 4,-1.7 2,-0.2 -1,-0.1 0.759 88.8 59.3 -35.9 -35.1 -3.1 1.0 9.0 264 277 A I H >> S+ 0 0 49 2,-0.2 4,-1.7 1,-0.2 3,-0.9 0.993 101.3 49.9 -57.9 -68.2 -5.9 3.4 9.7 265 278 A F H 3> S+ 0 0 4 1,-0.3 4,-1.6 50,-0.3 5,-0.2 0.834 110.2 53.7 -37.6 -44.3 -6.9 3.6 6.1 266 279 A N H 3X S+ 0 0 13 -4,-2.3 4,-1.7 -5,-0.2 -1,-0.3 0.919 104.0 54.9 -57.3 -48.1 -6.9 -0.2 6.2 267 280 A K H <>S+ 0 0 1 -4,-0.5 2,-2.2 1,-0.3 5,-2.0 0.982 95.4 50.5 -60.5 -59.7 -16.1 -3.5 3.1 274 287 A L T 3<5S+ 0 0 75 -4,-1.5 -1,-0.3 3,-0.3 5,-0.1 -0.526 98.4 70.7 -78.9 70.0 -18.7 -5.1 5.3 275 288 A E T 345S+ 0 0 73 -2,-2.2 -1,-0.2 -3,-0.4 -2,-0.2 0.220 105.7 34.0-142.2 -55.4 -21.4 -2.6 4.2 276 289 A K T <<5S- 0 0 44 -4,-0.9 -2,-0.2 -3,-0.6 -3,-0.1 0.005 133.5 -97.2 -85.5 24.7 -21.9 -3.8 0.7 277 290 A G T 5S+ 0 0 49 1,-0.2 2,-0.3 10,-0.1 -3,-0.3 0.952 78.7 137.2 61.6 57.2 -21.2 -7.1 2.4 278 291 A F < - 0 0 38 -5,-2.0 2,-0.3 9,-0.2 -1,-0.2 -0.889 39.3-155.2-125.9 162.6 -17.5 -7.6 1.6 279 292 A T E -F 286 0C 69 7,-1.8 7,-1.3 -2,-0.3 2,-0.5 -0.888 14.9-171.8-141.2 106.2 -14.5 -8.9 3.7 280 293 A I E +F 285 0C 10 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.855 11.5 161.7-104.0 129.2 -11.0 -7.8 2.8 281 294 A N - 0 0 60 3,-2.3 -23,-0.1 -2,-0.5 -2,-0.0 -0.534 58.1 -81.3-121.4-160.1 -7.8 -9.1 4.2 282 295 A E S S+ 0 0 45 -2,-0.2 -24,-0.2 1,-0.2 -23,-0.1 0.704 126.2 40.7 -80.5 -16.4 -4.2 -8.9 2.9 283 296 A Y S S- 0 0 113 1,-0.2 2,-0.3 -29,-0.1 -29,-0.2 0.785 120.5 -5.8 -97.5 -36.6 -4.7 -11.9 0.6 284 297 A T - 0 0 13 -30,-0.2 -3,-2.3 -31,-0.1 2,-0.5 -0.978 47.8-125.0-156.1 160.4 -8.1 -11.4 -0.9 285 298 A I E -F 280 0C 5 8,-0.4 8,-2.1 -2,-0.3 -5,-0.2 -0.983 35.2-171.6-111.3 132.3 -11.4 -9.7 -1.2 286 299 A R E F 279 0C 79 -7,-1.3 -7,-1.8 -2,-0.5 -2,-0.0 -0.958 360.0 360.0-127.6 143.7 -14.5 -11.9 -0.8 287 300 A P 0 0 68 0, 0.0 3,-1.6 0, 0.0 -9,-0.2 -0.209 360.0 360.0 -66.9 360.0 -18.2 -11.4 -1.3 288 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 289 307 A A 0 0 105 0, 0.0 -11,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-176.9 -17.5 -16.0 2.6 290 308 A G - 0 0 27 -3,-1.6 3,-0.0 1,-0.2 -4,-0.0 0.341 360.0 -71.7 -65.3-164.3 -17.4 -16.4 -1.2 291 309 A E S S- 0 0 155 1,-0.1 2,-0.2 -5,-0.0 -1,-0.2 -0.666 70.7 -74.5 -87.5 153.6 -14.5 -17.2 -3.5 292 310 A P - 0 0 56 0, 0.0 -6,-0.2 0, 0.0 3,-0.1 -0.293 49.5-128.0 -57.3 113.8 -11.9 -14.5 -4.1 293 311 A L - 0 0 52 -8,-2.1 -8,-0.4 -2,-0.2 8,-0.0 -0.284 39.9 -87.2 -57.0 144.4 -13.4 -11.8 -6.4 294 312 A P - 0 0 116 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.302 46.7-166.9 -58.6 135.6 -11.1 -11.0 -9.4 295 313 A V + 0 0 28 -45,-0.2 -42,-0.2 -3,-0.1 -43,-0.2 -0.939 30.3 146.7-132.5 111.6 -8.4 -8.3 -8.6 296 314 A D S S+ 0 0 122 -2,-0.4 2,-0.2 1,-0.2 3,-0.1 -0.071 72.5 16.9-129.9 32.9 -6.4 -6.6 -11.3 297 315 A S S > S- 0 0 42 1,-0.1 4,-1.1 2,-0.0 -1,-0.2 -0.880 71.7-111.9 175.8 160.4 -6.0 -3.2 -9.7 298 316 A E H > S+ 0 0 7 -2,-0.2 4,-1.3 2,-0.2 12,-0.1 0.886 118.4 58.0 -69.3 -40.6 -6.2 -1.2 -6.4 299 317 A K H >> S+ 0 0 111 1,-0.2 4,-3.4 2,-0.2 3,-0.7 0.926 98.0 63.2 -51.1 -47.6 -9.2 0.6 -7.9 300 318 A D H 3> S+ 0 0 52 1,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.925 97.7 52.8 -40.9 -62.3 -10.9 -2.8 -8.3 301 319 A I H 3X S+ 0 0 3 -4,-1.1 4,-0.9 1,-0.2 -1,-0.3 0.844 114.5 44.5 -48.1 -37.7 -10.9 -3.4 -4.6 302 320 A F H << S+ 0 0 0 -4,-1.3 3,-0.4 -3,-0.7 -2,-0.2 0.981 101.9 64.3 -67.5 -58.5 -12.6 -0.1 -4.3 303 321 A D H >< S+ 0 0 88 -4,-3.4 3,-1.4 1,-0.2 -2,-0.2 0.795 97.2 62.8 -30.9 -42.7 -15.0 -0.8 -7.2 304 322 A Y H 3< S+ 0 0 25 -4,-2.0 2,-1.0 1,-0.3 -1,-0.2 0.977 112.4 30.1 -48.5 -70.9 -16.3 -3.5 -5.0 305 323 A I T 3< S- 0 0 3 -4,-0.9 -1,-0.3 -3,-0.4 2,-0.2 -0.226 114.4-114.5 -86.2 48.1 -17.6 -1.2 -2.2 306 324 A Q < + 0 0 141 -3,-1.4 -1,-0.2 -2,-1.0 0, 0.0 -0.441 66.2 139.5 54.4-124.7 -18.3 1.6 -4.6 307 325 A W - 0 0 90 -2,-0.2 3,-0.2 -3,-0.1 -1,-0.1 0.971 58.8-100.8 68.5 88.4 -15.7 4.1 -3.4 308 326 A K - 0 0 190 1,-0.2 2,-0.3 -6,-0.1 -1,-0.1 0.033 51.1 -92.7 -38.7 132.2 -13.5 6.4 -5.6 309 327 A Y - 0 0 68 1,-0.1 2,-0.4 -9,-0.0 -1,-0.2 -0.291 37.3-148.1 -58.1 112.1 -9.9 5.1 -6.0 310 328 A R - 0 0 56 -2,-0.3 -1,-0.1 -3,-0.2 5,-0.1 -0.677 13.1-134.3 -78.9 128.5 -7.6 6.6 -3.3 311 329 A E >> - 0 0 117 -2,-0.4 3,-2.2 1,-0.1 4,-0.7 -0.548 25.6-109.2 -78.3 152.2 -4.1 7.1 -4.6 312 330 A P G >4 S+ 0 0 20 0, 0.0 3,-2.4 0, 0.0 -138,-0.2 0.931 117.0 56.3 -46.3 -60.5 -1.3 5.9 -2.1 313 331 A K G 34 S+ 0 0 128 -140,-0.3 -139,-0.1 1,-0.3 3,-0.1 0.334 110.6 47.6 -62.2 11.5 -0.1 9.4 -1.2 314 332 A D G <4 S+ 0 0 111 -3,-2.2 2,-1.0 1,-0.1 -1,-0.3 0.477 86.1 89.3-120.3 -11.1 -3.7 10.3 -0.1 315 333 A R << + 0 0 2 -3,-2.4 -50,-0.3 -4,-0.7 -49,-0.1 -0.402 39.0 115.0 -97.1 57.6 -4.7 7.3 2.0 316 334 A S 0 0 76 -2,-1.0 -1,-0.2 -52,-0.1 -54,-0.1 0.150 360.0 360.0 -95.6 18.9 -3.6 8.3 5.5 317 335 A E 0 0 97 -3,-0.1 -2,-0.2 -53,-0.1 -49,-0.1 0.245 360.0 360.0-177.0 360.0 -7.2 8.2 6.4