==== 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 APOPTOSIS 04-OCT-06 2IMS . COMPND 2 MOLECULE: APOPTOSIS REGULATOR BAK; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR T.MOLDOVEANU,Q.LIU,A.TOCILJ,M.WATSON,G.C.SHORE,K.B.GEHRING . 163 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8391.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 122 74.8 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 . 2 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 96 58.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.8 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 0 1 0 0 1 1 1 0 0 0 1 0 0 0 0 0 0 1 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 19 A L 0 0 218 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 146.8 -12.1 -27.2 16.5 2 20 A P - 0 0 127 0, 0.0 2,-0.1 0, 0.0 3,-0.1 -0.355 360.0-152.3 -65.3 134.1 -9.9 -25.1 14.1 3 21 A S - 0 0 77 1,-0.2 155,-0.1 151,-0.1 151,-0.0 -0.377 50.6 -43.4 -89.6-176.8 -8.8 -21.7 15.4 4 22 A A - 0 0 29 153,-0.4 -1,-0.2 -2,-0.1 153,-0.2 -0.148 59.6-131.7 -55.9 135.4 -8.2 -18.8 13.0 5 23 A S > - 0 0 51 -3,-0.1 4,-2.7 1,-0.1 5,-0.2 -0.288 28.4-102.7 -72.5 165.4 -6.2 -19.5 9.8 6 24 A E H > S+ 0 0 68 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.880 125.4 50.8 -51.7 -43.7 -3.2 -17.4 8.7 7 25 A E H > S+ 0 0 107 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.929 109.0 48.2 -67.3 -43.5 -5.6 -15.8 6.2 8 26 A Q H > S+ 0 0 99 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.944 112.8 49.8 -60.6 -44.8 -8.3 -15.0 8.7 9 27 A V H X S+ 0 0 0 -4,-2.7 4,-1.1 1,-0.2 -2,-0.2 0.906 108.4 53.0 -60.9 -40.9 -5.6 -13.5 11.1 10 28 A A H < S+ 0 0 4 -4,-2.1 3,-0.4 1,-0.2 4,-0.4 0.897 111.0 45.8 -64.9 -38.4 -4.2 -11.4 8.3 11 29 A Q H >< S+ 0 0 126 -4,-1.9 3,-1.3 1,-0.2 4,-0.5 0.922 107.9 57.9 -68.2 -42.0 -7.6 -10.0 7.5 12 30 A D H 3X S+ 0 0 46 -4,-2.6 4,-2.4 1,-0.3 -1,-0.2 0.668 86.7 79.7 -59.3 -25.7 -8.3 -9.3 11.2 13 31 A T H 3X S+ 0 0 1 -4,-1.1 4,-2.9 -3,-0.4 5,-0.3 0.839 84.1 61.5 -56.5 -36.2 -5.2 -7.1 11.4 14 32 A E H <> S+ 0 0 84 -3,-1.3 4,-2.5 -4,-0.4 -1,-0.2 0.963 110.1 39.1 -55.1 -52.7 -7.1 -4.1 9.9 15 33 A E H > S+ 0 0 52 -4,-0.5 4,-2.4 1,-0.2 5,-0.2 0.887 114.6 53.7 -69.5 -38.0 -9.6 -4.0 12.7 16 34 A V H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 -1,-0.2 0.932 112.7 44.2 -60.0 -45.3 -7.0 -4.8 15.4 17 35 A F H X S+ 0 0 0 -4,-2.9 4,-3.0 2,-0.2 5,-0.2 0.931 113.1 49.6 -70.0 -42.5 -4.8 -1.9 14.2 18 36 A R H X S+ 0 0 67 -4,-2.5 4,-2.4 -5,-0.3 -1,-0.2 0.915 114.4 46.1 -59.8 -42.2 -7.7 0.6 13.8 19 37 A S H X S+ 0 0 1 -4,-2.4 4,-2.7 2,-0.2 5,-0.4 0.924 111.7 51.3 -69.7 -44.9 -8.9 -0.3 17.3 20 38 A Y H X S+ 0 0 2 -4,-2.7 4,-3.0 -5,-0.2 5,-0.3 0.941 111.9 47.8 -52.1 -50.4 -5.4 -0.0 18.7 21 39 A V H X S+ 0 0 0 -4,-3.0 4,-2.5 1,-0.2 5,-0.2 0.926 112.6 48.3 -60.4 -46.4 -5.0 3.4 17.1 22 40 A F H X S+ 0 0 34 -4,-2.4 4,-2.2 -5,-0.2 -1,-0.2 0.954 118.1 38.6 -59.4 -53.4 -8.4 4.6 18.4 23 41 A Y H X S+ 0 0 28 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.880 115.0 53.0 -73.7 -33.4 -7.9 3.4 22.0 24 42 A R H X S+ 0 0 17 -4,-3.0 4,-2.2 -5,-0.4 -1,-0.2 0.921 110.9 47.6 -64.3 -41.5 -4.2 4.4 22.1 25 43 A H H X S+ 0 0 2 -4,-2.5 4,-2.2 -5,-0.3 -2,-0.2 0.896 111.2 51.3 -64.8 -41.0 -5.2 7.9 20.9 26 44 A Q H X S+ 0 0 76 -4,-2.2 4,-2.1 -5,-0.2 -2,-0.2 0.924 110.5 49.1 -60.5 -44.4 -7.9 8.0 23.6 27 45 A Q H X S+ 0 0 36 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.885 108.4 53.1 -62.9 -38.0 -5.4 7.0 26.2 28 46 A E H X S+ 0 0 17 -4,-2.2 4,-2.6 2,-0.2 5,-0.4 0.906 108.8 49.9 -65.4 -38.5 -3.0 9.7 25.0 29 47 A Q H X S+ 0 0 88 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.893 111.8 49.2 -63.9 -37.4 -5.7 12.3 25.4 30 48 A E H < S+ 0 0 149 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.874 118.2 38.8 -72.5 -35.9 -6.4 11.0 28.9 31 49 A A H < S+ 0 0 80 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.797 129.6 27.2 -84.3 -33.4 -2.8 11.1 29.9 32 50 A E H >< S- 0 0 81 -4,-2.6 3,-2.2 1,-0.2 -3,-0.2 0.568 80.1-172.8-108.5 -18.2 -1.7 14.3 28.2 33 51 A G G >< S- 0 0 44 -4,-2.0 3,-2.3 -5,-0.4 -1,-0.2 -0.292 77.1 -1.2 56.4-131.4 -5.0 16.4 28.1 34 52 A V G 3 S+ 0 0 160 1,-0.3 -1,-0.3 4,-0.0 4,-0.1 0.626 130.6 66.1 -71.1 -8.7 -4.4 19.5 26.0 35 53 A A G < S+ 0 0 77 -3,-2.2 -1,-0.3 -6,-0.1 -2,-0.2 0.584 76.5 110.7 -78.1 -11.1 -0.8 18.5 25.5 36 54 A A S < S- 0 0 20 -3,-2.3 2,-0.1 -7,-0.2 -7,-0.1 -0.404 80.6-107.5 -67.1 138.3 -1.9 15.5 23.4 37 55 A P - 0 0 26 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.453 37.5-117.9 -65.6 136.3 -1.0 15.8 19.7 38 56 A A + 0 0 74 -2,-0.1 -4,-0.0 -4,-0.1 -3,-0.0 -0.598 45.7 152.5 -82.4 132.5 -4.1 16.4 17.6 39 57 A D > - 0 0 3 -2,-0.3 3,-1.7 86,-0.0 4,-0.3 -0.557 16.7-176.5-155.5 88.8 -5.2 13.9 14.9 40 58 A P T >> S+ 0 0 69 0, 0.0 4,-1.6 0, 0.0 3,-1.5 0.770 81.1 71.0 -57.1 -26.2 -9.0 13.9 14.3 41 59 A E H 3> S+ 0 0 42 1,-0.3 4,-0.6 2,-0.2 89,-0.0 0.803 94.5 55.0 -59.7 -30.4 -8.5 11.0 11.8 42 60 A X H <4 S+ 0 0 0 -3,-1.7 -1,-0.3 1,-0.2 -17,-0.2 0.486 107.9 48.5 -83.1 -4.8 -7.8 8.8 14.8 43 61 A V H <4 S+ 0 0 67 -3,-1.5 -2,-0.2 -4,-0.3 -1,-0.2 0.772 114.7 42.5 -97.0 -33.7 -11.1 9.7 16.5 44 62 A T H < S+ 0 0 114 -4,-1.6 -2,-0.2 2,-0.0 -3,-0.1 0.387 82.2 118.9 -99.0 0.8 -13.3 9.2 13.4 45 63 A L S < S- 0 0 21 -4,-0.6 -3,-0.0 -5,-0.1 2,-0.0 -0.203 79.9 -75.7 -66.8 162.6 -12.0 5.9 11.9 46 64 A P + 0 0 75 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.351 60.9 175.4 -61.0 133.8 -14.3 2.8 11.6 47 65 A L - 0 0 59 -3,-0.1 -32,-0.0 -25,-0.0 7,-0.0 -1.000 30.6-173.8-145.4 139.9 -14.7 1.1 15.0 48 66 A Q > - 0 0 109 -2,-0.3 3,-1.5 -33,-0.1 6,-0.3 -0.784 14.5-172.2-131.9 85.5 -16.7 -1.8 16.5 49 67 A P T 3 S+ 0 0 76 0, 0.0 -1,-0.1 0, 0.0 9,-0.1 0.741 78.8 47.5 -55.3 -29.3 -16.0 -1.6 20.2 50 68 A S T 3 S+ 0 0 94 4,-0.1 -2,-0.0 5,-0.1 0, 0.0 0.557 87.0 104.1 -94.7 -7.6 -17.7 -4.9 21.2 51 69 A S S <> S- 0 0 16 -3,-1.5 4,-2.5 1,-0.1 5,-0.2 -0.249 82.3-114.0 -69.8 161.6 -16.2 -7.1 18.5 52 70 A T H > S+ 0 0 67 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.918 119.2 46.7 -63.4 -43.6 -13.4 -9.6 19.4 53 71 A X H > S+ 0 0 20 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.856 110.9 52.7 -69.2 -34.6 -10.9 -7.7 17.3 54 72 A G H > S+ 0 0 0 -6,-0.3 4,-2.0 1,-0.2 -2,-0.2 0.934 111.7 46.7 -61.6 -40.3 -12.1 -4.4 18.8 55 73 A Q H X S+ 0 0 88 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.879 112.2 50.9 -68.1 -39.3 -11.5 -5.8 22.2 56 74 A V H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 5,-0.2 0.947 109.8 47.6 -66.9 -48.7 -8.1 -7.2 21.2 57 75 A G H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.905 112.0 51.7 -63.0 -38.1 -6.8 -3.9 19.8 58 76 A R H X S+ 0 0 113 -4,-2.0 4,-2.1 -5,-0.2 -1,-0.2 0.928 109.7 48.5 -58.1 -48.8 -8.0 -2.1 22.9 59 77 A Q H X S+ 0 0 59 -4,-2.3 4,-2.9 1,-0.2 5,-0.3 0.897 110.4 51.5 -62.1 -38.2 -6.2 -4.6 25.2 60 78 A L H X S+ 0 0 3 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.875 108.5 52.1 -66.5 -35.6 -3.0 -4.2 23.1 61 79 A A H X S+ 0 0 2 -4,-2.1 4,-1.2 -5,-0.2 -1,-0.2 0.891 112.1 47.2 -63.5 -39.5 -3.4 -0.4 23.5 62 80 A I H >X S+ 0 0 59 -4,-2.1 4,-0.6 2,-0.2 3,-0.5 0.955 116.9 39.4 -69.5 -49.8 -3.7 -0.8 27.3 63 81 A I H >X S+ 0 0 71 -4,-2.9 4,-1.6 1,-0.2 3,-1.0 0.861 110.3 62.7 -71.4 -29.8 -0.8 -3.1 27.8 64 82 A G H 3X S+ 0 0 6 -4,-2.1 4,-2.1 -5,-0.3 -1,-0.2 0.828 89.8 68.3 -59.2 -33.5 1.2 -1.1 25.2 65 83 A D H << S+ 0 0 84 -4,-1.2 -1,-0.2 -3,-0.5 -2,-0.2 0.840 111.8 31.3 -54.8 -37.0 1.0 1.9 27.5 66 84 A D H << S+ 0 0 115 -3,-1.0 -1,-0.2 -4,-0.6 -2,-0.2 0.707 127.2 36.9 -94.0 -28.0 3.3 0.2 30.0 67 85 A I H < S+ 0 0 74 -4,-1.6 4,-0.3 1,-0.1 3,-0.2 0.558 109.9 57.3-104.6 -10.7 5.6 -2.1 27.8 68 86 A N X + 0 0 5 -4,-2.1 4,-3.2 -5,-0.2 5,-0.2 0.431 70.0 103.2-106.7 0.4 6.1 0.1 24.7 69 87 A R H > S+ 0 0 158 -5,-0.2 4,-2.2 1,-0.2 5,-0.2 0.837 84.3 48.5 -54.6 -36.6 7.6 3.2 26.3 70 88 A R H > S+ 0 0 162 -3,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.975 114.9 41.8 -66.1 -57.6 11.1 2.2 25.2 71 89 A Y H > S+ 0 0 40 -4,-0.3 4,-1.8 1,-0.2 -2,-0.2 0.911 118.2 51.6 -55.7 -39.9 10.2 1.5 21.5 72 90 A D H X S+ 0 0 20 -4,-3.2 4,-2.4 2,-0.2 5,-0.2 0.907 100.9 53.8 -68.6 -52.1 8.0 4.7 21.6 73 91 A S H X S+ 0 0 74 -4,-2.2 4,-1.4 1,-0.2 -1,-0.2 0.897 114.4 44.9 -52.9 -41.6 10.3 7.4 22.9 74 92 A E H X S+ 0 0 115 -4,-1.3 4,-3.4 -5,-0.2 -1,-0.2 0.893 107.2 57.7 -68.0 -44.0 12.8 6.5 20.2 75 93 A F H X S+ 0 0 6 -4,-1.8 4,-1.0 1,-0.2 -2,-0.2 0.907 106.1 51.7 -52.2 -46.1 10.1 6.3 17.4 76 94 A Q H X S+ 0 0 92 -4,-2.4 4,-0.8 1,-0.2 3,-0.3 0.900 115.4 39.7 -61.3 -45.4 9.1 9.9 18.2 77 95 A T H < S+ 0 0 96 -4,-1.4 3,-0.5 -5,-0.2 4,-0.3 0.899 115.8 50.3 -70.2 -42.0 12.7 11.2 17.9 78 96 A X H < S+ 0 0 84 -4,-3.4 -2,-0.2 1,-0.2 -1,-0.2 0.516 108.9 53.4 -81.1 -4.7 13.6 9.0 14.9 79 97 A L H >< S+ 0 0 5 -4,-1.0 3,-2.6 -3,-0.3 -1,-0.2 0.646 82.0 86.0 -97.3 -20.6 10.4 10.1 13.0 80 98 A Q T 3< S+ 0 0 141 -4,-0.8 -2,-0.1 -3,-0.5 -1,-0.1 0.800 91.0 53.0 -48.7 -28.7 11.1 13.9 13.3 81 99 A H T 3 S+ 0 0 147 -4,-0.3 2,-0.3 -3,-0.1 -1,-0.3 0.413 82.9 110.1 -88.8 -2.5 13.2 13.5 10.2 82 100 A L < - 0 0 2 -3,-2.6 7,-0.1 1,-0.0 -3,-0.0 -0.609 62.7-133.0 -80.3 134.3 10.7 11.8 7.9 83 101 A Q - 0 0 115 -2,-0.3 2,-2.2 1,-0.1 6,-0.2 -0.612 23.8-111.4 -84.2 142.4 9.2 13.7 4.9 84 102 A P S S+ 0 0 43 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.301 75.6 110.5 -75.9 60.7 5.4 13.7 4.2 85 103 A T S > S- 0 0 66 -2,-2.2 4,-2.5 1,-0.1 5,-0.2 -0.938 75.3-118.6-122.2 160.3 5.2 11.7 1.0 86 104 A A H > S+ 0 0 51 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.876 112.4 51.8 -60.6 -40.7 3.9 8.2 0.5 87 105 A E H > S+ 0 0 118 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.910 110.1 45.2 -67.3 -46.2 7.3 6.9 -0.7 88 106 A N H > S+ 0 0 47 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.906 113.3 52.3 -62.6 -42.1 9.3 8.2 2.2 89 107 A A H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.914 112.0 46.5 -58.4 -44.4 6.6 6.9 4.6 90 108 A Y H X S+ 0 0 111 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.916 112.3 49.0 -65.5 -45.0 6.8 3.4 3.0 91 109 A E H X S+ 0 0 99 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.930 115.4 43.3 -63.9 -45.7 10.6 3.3 3.0 92 110 A Y H X S+ 0 0 44 -4,-2.6 4,-2.5 2,-0.2 5,-0.3 0.903 114.2 51.1 -61.0 -48.3 10.8 4.3 6.6 93 111 A F H X S+ 0 0 2 -4,-2.6 4,-2.8 -5,-0.3 5,-0.3 0.942 112.2 46.7 -55.6 -47.2 8.0 2.0 7.6 94 112 A T H X S+ 0 0 34 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.894 111.9 49.6 -70.9 -40.1 9.6 -1.0 5.8 95 113 A K H X S+ 0 0 113 -4,-2.2 4,-1.9 -5,-0.2 -1,-0.2 0.949 116.9 40.3 -64.9 -45.6 13.1 -0.4 7.3 96 114 A I H X S+ 0 0 21 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.900 115.3 49.8 -71.0 -46.6 11.9 -0.1 10.8 97 115 A A H X S+ 0 0 0 -4,-2.8 4,-1.1 -5,-0.3 -1,-0.2 0.925 111.7 50.4 -57.9 -42.5 9.3 -2.9 10.7 98 116 A T H >< S+ 0 0 62 -4,-2.2 3,-0.6 -5,-0.3 4,-0.4 0.916 109.8 50.3 -61.2 -43.7 12.0 -5.2 9.1 99 117 A S H >< S+ 0 0 63 -4,-1.9 3,-0.8 1,-0.2 4,-0.3 0.864 104.4 58.5 -65.3 -37.2 14.4 -4.2 11.9 100 118 A L H 3< S+ 0 0 19 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.804 115.8 33.6 -61.4 -31.3 11.8 -5.0 14.6 101 119 A F T X< S+ 0 0 21 -4,-1.1 3,-1.8 -3,-0.6 -1,-0.2 0.258 82.4 108.3-111.3 8.4 11.4 -8.7 13.4 102 120 A E T < S+ 0 0 171 -3,-0.8 -1,-0.1 -4,-0.4 -2,-0.1 0.845 89.0 39.4 -55.4 -38.7 15.0 -9.4 12.2 103 121 A S T 3 S- 0 0 94 1,-0.4 -1,-0.3 -4,-0.3 2,-0.1 0.076 128.0 -81.1-103.7 25.0 15.6 -11.7 15.2 104 122 A G < - 0 0 32 -3,-1.8 2,-0.4 2,-0.0 -1,-0.4 -0.446 52.9 -61.4 111.5-177.0 12.1 -13.3 15.2 105 123 A I + 0 0 41 -2,-0.1 2,-0.3 -3,-0.1 -4,-0.1 -0.847 45.3 155.1-114.2 134.3 8.5 -12.6 16.4 106 124 A N >> - 0 0 61 -2,-0.4 4,-2.1 1,-0.1 3,-0.6 -0.963 52.1-104.3-145.9 168.0 7.1 -12.1 19.8 107 125 A W H 3> S+ 0 0 63 -2,-0.3 4,-2.6 1,-0.3 5,-0.2 0.863 118.4 55.9 -65.1 -35.0 4.0 -10.3 21.1 108 126 A G H 3> S+ 0 0 26 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.874 108.9 47.8 -63.6 -36.2 5.9 -7.3 22.4 109 127 A R H <> S+ 0 0 54 -3,-0.6 4,-2.2 2,-0.2 -2,-0.2 0.848 108.4 54.3 -72.0 -38.9 7.3 -6.8 18.9 110 128 A V H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.939 111.1 46.2 -56.4 -47.3 3.8 -7.1 17.4 111 129 A V H X S+ 0 0 1 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.910 109.6 54.8 -64.1 -39.9 2.7 -4.4 19.8 112 130 A A H X S+ 0 0 0 -4,-1.9 4,-2.2 -5,-0.2 -1,-0.2 0.898 106.9 51.1 -55.7 -40.1 5.8 -2.4 18.9 113 131 A L H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.910 110.1 48.1 -67.0 -48.4 4.8 -2.6 15.2 114 132 A L H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.930 113.3 49.1 -56.1 -44.6 1.3 -1.4 16.0 115 133 A G H X S+ 0 0 0 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.859 108.9 51.7 -64.1 -35.3 2.8 1.5 18.0 116 134 A F H X S+ 0 0 2 -4,-2.2 4,-2.9 2,-0.2 5,-0.2 0.934 109.1 50.9 -67.4 -44.1 5.2 2.4 15.2 117 135 A G H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 5,-0.2 0.919 110.3 51.2 -52.8 -47.7 2.3 2.5 12.8 118 136 A Y H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.946 112.9 43.7 -54.5 -52.1 0.5 4.8 15.3 119 137 A R H X S+ 0 0 19 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.888 113.6 50.4 -66.5 -38.9 3.5 7.2 15.5 120 138 A L H X S+ 0 0 0 -4,-2.9 4,-2.6 2,-0.2 5,-0.3 0.927 111.7 48.2 -62.9 -50.1 4.2 7.2 11.8 121 139 A A H X S+ 0 0 4 -4,-2.6 4,-2.0 -5,-0.2 -2,-0.2 0.926 113.7 47.5 -56.4 -45.1 0.5 8.0 11.0 122 140 A L H X S+ 0 0 4 -4,-2.3 4,-2.7 -5,-0.2 -2,-0.2 0.944 111.2 51.3 -63.6 -45.0 0.5 10.7 13.6 123 141 A H H X S+ 0 0 12 -4,-2.8 4,-1.6 1,-0.2 -2,-0.2 0.932 110.7 46.0 -59.0 -47.8 3.7 12.2 12.3 124 142 A V H <>S+ 0 0 1 -4,-2.6 5,-2.8 1,-0.2 -1,-0.2 0.910 112.9 51.1 -69.9 -35.0 2.7 12.4 8.7 125 143 A Y H ><5S+ 0 0 63 -4,-2.0 3,-2.1 -5,-0.3 -1,-0.2 0.947 108.0 51.7 -60.9 -46.9 -0.6 13.9 9.7 126 144 A Q H 3<5S+ 0 0 111 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.785 108.6 53.3 -61.2 -26.1 1.1 16.6 11.8 127 145 A H T 3<5S- 0 0 97 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.157 130.1 -94.0 -96.9 16.2 3.3 17.4 8.8 128 146 A G T < 5S+ 0 0 57 -3,-2.1 2,-1.1 1,-0.2 -3,-0.2 0.467 82.0 132.7 94.0 2.4 0.2 17.9 6.6 129 147 A L < - 0 0 38 -5,-2.8 3,-0.4 -6,-0.2 -1,-0.2 -0.773 35.6-178.6 -89.3 94.4 -0.3 14.5 4.9 130 148 A T + 0 0 92 -2,-1.1 -4,-0.0 1,-0.2 -5,-0.0 -0.495 57.4 33.0 -87.5 161.5 -4.0 13.9 5.4 131 149 A G S S+ 0 0 64 -2,-0.2 -1,-0.2 1,-0.1 4,-0.2 0.803 86.3 109.9 67.0 26.1 -6.0 10.9 4.3 132 150 A F > + 0 0 17 -3,-0.4 4,-2.2 2,-0.1 5,-0.2 0.388 43.2 89.7-112.0 -5.5 -3.0 8.6 5.0 133 151 A L H > S+ 0 0 15 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.913 88.8 52.0 -66.1 -38.6 -4.1 6.6 8.0 134 152 A G H > S+ 0 0 26 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.890 107.8 54.4 -58.8 -37.9 -5.7 3.9 5.9 135 153 A Q H > S+ 0 0 59 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.921 107.4 47.3 -63.2 -43.1 -2.4 3.7 4.0 136 154 A V H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.916 110.6 54.6 -64.5 -37.0 -0.5 3.1 7.2 137 155 A T H X S+ 0 0 5 -4,-2.3 4,-3.0 1,-0.2 -2,-0.2 0.945 109.2 46.6 -56.9 -47.3 -3.1 0.5 8.1 138 156 A R H X S+ 0 0 130 -4,-2.6 4,-2.7 2,-0.2 5,-0.3 0.880 108.6 55.4 -65.8 -39.5 -2.5 -1.3 4.8 139 157 A F H X S+ 0 0 21 -4,-2.5 4,-2.3 2,-0.2 5,-0.2 0.950 112.9 43.2 -53.4 -46.8 1.3 -1.1 5.4 140 158 A V H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.949 114.9 47.8 -67.7 -50.1 0.8 -2.9 8.7 141 159 A V H X S+ 0 0 31 -4,-3.0 4,-1.8 1,-0.2 -2,-0.2 0.945 117.1 42.7 -56.5 -48.1 -1.7 -5.5 7.4 142 160 A D H X S+ 0 0 87 -4,-2.7 4,-2.7 -5,-0.2 5,-0.3 0.902 111.8 52.3 -73.8 -34.7 0.4 -6.3 4.4 143 161 A F H X S+ 0 0 11 -4,-2.3 4,-2.2 -5,-0.3 6,-0.4 0.952 110.0 49.5 -63.5 -46.2 3.7 -6.4 6.2 144 162 A X H <>S+ 0 0 0 -4,-2.5 6,-2.4 -5,-0.2 5,-1.4 0.877 112.9 48.2 -65.6 -32.2 2.3 -8.8 8.8 145 163 A L H ><5S+ 0 0 38 -4,-1.8 3,-1.4 -5,-0.2 6,-0.3 0.987 118.1 37.1 -67.0 -55.6 0.9 -11.1 6.1 146 164 A H H 3<5S+ 0 0 124 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.687 113.8 55.1 -80.6 -17.8 4.1 -11.3 4.0 147 165 A H T 3<5S- 0 0 86 -4,-2.2 -1,-0.3 -5,-0.3 -2,-0.1 0.171 114.1-113.1 -98.4 16.3 6.6 -11.3 6.8 148 166 A C T <>5S+ 0 0 38 -3,-1.4 4,-2.0 1,-0.1 -3,-0.2 0.629 82.4 123.5 66.9 20.1 4.8 -14.3 8.4 149 167 A I H > S+ 0 0 0 -6,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.913 109.8 51.2 -59.8 -38.4 0.0 -13.4 10.7 151 169 A R H > S+ 0 0 119 -7,-0.4 4,-2.2 -6,-0.3 -2,-0.2 0.942 109.9 49.3 -64.6 -46.9 1.2 -17.0 10.4 152 170 A W H X S+ 0 0 51 -4,-2.0 4,-1.4 1,-0.2 -1,-0.2 0.912 110.8 49.6 -57.9 -45.2 2.9 -16.8 13.8 153 171 A I H ><>S+ 0 0 0 -4,-2.5 5,-2.7 1,-0.2 3,-0.6 0.936 108.4 52.9 -63.9 -41.9 -0.1 -15.3 15.4 154 172 A A H ><5S+ 0 0 16 -4,-2.5 3,-1.3 1,-0.2 -1,-0.2 0.893 107.2 53.3 -56.7 -39.5 -2.3 -18.1 13.9 155 173 A Q H 3<5S+ 0 0 138 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.770 105.2 54.0 -67.1 -29.2 0.1 -20.6 15.5 156 174 A R T <<5S- 0 0 157 -4,-1.4 -1,-0.3 -3,-0.6 -2,-0.2 0.459 135.7 -85.7 -79.1 -5.2 -0.3 -19.0 18.9 157 175 A G T < 5S- 0 0 24 -3,-1.3 -153,-0.4 -4,-0.4 3,-0.2 0.442 73.3 -78.9 109.9 7.8 -4.1 -19.4 18.7 158 176 A G S > S+ 0 0 2 1,-0.3 3,-2.3 2,-0.2 4,-0.3 0.832 129.0 69.1 -56.5 -32.1 -5.4 -12.6 17.7 160 178 A V G > S+ 0 0 69 1,-0.3 3,-1.7 -3,-0.2 -1,-0.3 0.791 83.6 72.0 -58.1 -28.2 -7.6 -13.7 20.6 161 179 A A G < S+ 0 0 47 -3,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.705 88.6 63.5 -58.8 -18.7 -4.6 -15.2 22.2 162 180 A A G < 0 0 21 -3,-2.3 -1,-0.3 -4,-0.2 -2,-0.2 0.642 360.0 360.0 -80.3 -18.8 -3.5 -11.6 22.9 163 181 A L < 0 0 101 -3,-1.7 -107,-0.1 -4,-0.3 -106,-0.0 -0.324 360.0 360.0 -65.1 360.0 -6.5 -11.0 25.2