==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER APOPTOSIS 04-OCT-12 4BD2 . COMPND 2 MOLECULE: APOPTOSIS REGULATOR BAX; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.E.CZABOTAR,D.WESTPHAL,J.M.ADAMS,P.M.COLMAN . 177 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12396.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 141 79.7 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 . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 117 66.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 2.3 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 0 2 0 0 1 0 0 1 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 0 0 1 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 10 A G 0 0 137 0, 0.0 2,-0.2 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 74.3 43.1 7.0 62.3 2 11 A G - 0 0 42 1,-0.1 0, 0.0 2,-0.0 0, 0.0 -0.506 360.0-125.6 -88.1 156.9 43.0 8.0 58.6 3 12 A G > - 0 0 39 -2,-0.2 3,-1.3 1,-0.0 6,-0.4 -0.018 49.4 -67.5 -85.5-165.6 40.7 10.5 57.0 4 13 A P T 3 S+ 0 0 110 0, 0.0 9,-0.1 0, 0.0 -2,-0.0 0.716 129.9 59.0 -59.2 -25.0 38.4 10.2 53.9 5 14 A T T 3 S+ 0 0 131 4,-0.1 -3,-0.0 5,-0.0 5,-0.0 0.701 82.3 103.0 -82.4 -21.6 41.4 9.7 51.5 6 15 A S S <> S- 0 0 27 -3,-1.3 4,-2.3 1,-0.1 5,-0.1 -0.306 77.4-128.8 -60.6 143.9 42.7 6.6 53.4 7 16 A S H > S+ 0 0 75 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.826 108.1 57.9 -64.1 -32.0 42.0 3.3 51.7 8 17 A E H > S+ 0 0 135 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.900 109.1 42.8 -64.7 -45.3 40.6 2.0 55.0 9 18 A Q H > S+ 0 0 63 -6,-0.4 4,-2.7 2,-0.2 5,-0.4 0.869 113.0 55.1 -68.0 -35.6 38.0 4.7 55.2 10 19 A I H X S+ 0 0 90 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.945 112.3 41.1 -64.3 -45.1 37.3 4.2 51.5 11 20 A M H X S+ 0 0 138 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.901 117.0 49.4 -67.5 -40.8 36.6 0.5 51.9 12 21 A K H X S+ 0 0 143 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.964 116.7 39.1 -61.8 -56.3 34.6 1.0 55.1 13 22 A T H X S+ 0 0 41 -4,-2.7 4,-2.8 1,-0.2 5,-0.2 0.854 113.8 57.8 -62.7 -37.2 32.4 3.8 53.8 14 23 A G H X S+ 0 0 24 -4,-1.9 4,-2.4 -5,-0.4 -2,-0.2 0.923 107.3 46.1 -59.5 -46.4 32.2 2.0 50.5 15 24 A A H X S+ 0 0 62 -4,-2.3 4,-3.0 2,-0.2 5,-0.3 0.921 113.7 50.0 -61.6 -45.3 30.7 -1.2 52.1 16 25 A L H X S+ 0 0 45 -4,-2.1 4,-2.7 1,-0.2 5,-0.2 0.950 113.5 43.8 -59.7 -52.5 28.3 0.9 54.2 17 26 A L H X S+ 0 0 21 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.887 116.2 47.7 -59.2 -44.1 27.0 2.8 51.2 18 27 A L H X S+ 0 0 52 -4,-2.4 4,-3.2 -5,-0.2 5,-0.2 0.935 113.4 46.5 -66.5 -46.7 26.8 -0.2 49.0 19 28 A Q H X S+ 0 0 99 -4,-3.0 4,-2.9 2,-0.2 5,-0.3 0.930 113.5 48.4 -62.6 -45.9 25.0 -2.3 51.6 20 29 A G H X S+ 0 0 16 -4,-2.7 4,-2.4 -5,-0.3 -1,-0.2 0.932 114.3 48.0 -57.5 -44.2 22.5 0.4 52.4 21 30 A F H X S+ 0 0 8 -4,-2.2 4,-1.7 -5,-0.2 -2,-0.2 0.946 114.9 42.5 -65.9 -48.7 21.9 0.9 48.7 22 31 A I H X S+ 0 0 34 -4,-3.2 4,-1.8 2,-0.2 -1,-0.2 0.921 114.7 50.2 -64.6 -43.7 21.4 -2.7 47.9 23 32 A Q H X S+ 0 0 79 -4,-2.9 4,-2.2 -5,-0.2 -2,-0.2 0.915 106.6 56.1 -63.3 -44.5 19.3 -3.5 51.0 24 33 A D H X S+ 0 0 58 -4,-2.4 4,-0.8 -5,-0.3 -1,-0.2 0.934 113.1 40.6 -47.7 -52.1 17.0 -0.5 50.2 25 34 A R H < S+ 0 0 7 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.732 112.9 55.2 -74.7 -23.1 16.3 -1.9 46.8 26 35 A A H < S+ 0 0 52 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.797 96.9 63.6 -78.8 -30.0 16.0 -5.5 48.0 27 36 A G H < 0 0 72 -4,-2.2 -1,-0.2 -3,-0.2 -2,-0.2 0.856 360.0 360.0 -60.0 -34.7 13.3 -4.5 50.6 28 37 A R < 0 0 133 -4,-0.8 -1,-0.1 -5,-0.2 -4,-0.0 -0.481 360.0 360.0 -64.7 360.0 11.2 -3.6 47.6 29 ! 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 30 49 A P 0 0 164 0, 0.0 -10,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 128.1 17.9 -0.9 57.6 31 50 A V - 0 0 28 -15,-0.1 2,-0.1 -11,-0.1 -11,-0.0 -0.918 360.0-122.2-114.1 114.7 21.7 -0.3 58.0 32 51 A P + 0 0 119 0, 0.0 2,-0.3 0, 0.0 -12,-0.0 -0.329 44.3 160.8 -59.2 123.9 22.9 2.1 60.7 33 52 A Q - 0 0 60 -2,-0.1 5,-0.0 -13,-0.0 -2,-0.0 -0.980 36.0-104.5-146.6 156.4 25.0 5.0 59.3 34 53 A D > - 0 0 86 -2,-0.3 4,-1.8 1,-0.1 5,-0.1 -0.131 44.1 -93.0 -76.1 175.2 26.2 8.5 60.1 35 54 A A H > S+ 0 0 72 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.893 120.4 42.4 -62.0 -51.0 24.9 11.8 58.7 36 55 A S H > S+ 0 0 74 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.907 115.4 51.7 -65.5 -38.1 27.2 12.5 55.7 37 56 A T H > S+ 0 0 6 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.842 108.1 53.8 -63.4 -30.2 26.9 8.8 54.8 38 57 A K H X S+ 0 0 120 -4,-1.8 4,-1.6 2,-0.2 -2,-0.2 0.904 104.9 53.0 -71.0 -41.6 23.1 9.3 55.0 39 58 A K H X S+ 0 0 143 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.900 110.8 46.8 -56.3 -45.4 23.3 12.2 52.6 40 59 A L H X S+ 0 0 89 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.890 109.1 54.8 -63.0 -41.3 25.1 10.1 50.0 41 60 A S H X S+ 0 0 20 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.830 106.1 53.4 -62.7 -32.0 22.7 7.3 50.5 42 61 A E H X S+ 0 0 106 -4,-1.6 4,-1.7 2,-0.2 -1,-0.2 0.954 109.6 45.4 -69.5 -49.6 19.9 9.6 49.7 43 62 A S H X S+ 0 0 55 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.906 113.2 51.9 -59.0 -41.7 21.4 10.8 46.4 44 63 A L H X S+ 0 0 20 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.899 106.6 54.3 -59.9 -42.2 22.2 7.2 45.5 45 64 A K H X S+ 0 0 84 -4,-1.9 4,-1.8 1,-0.2 -1,-0.2 0.872 108.5 47.1 -63.4 -39.0 18.6 6.1 46.2 46 65 A R H X S+ 0 0 71 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.843 110.6 51.5 -77.5 -29.6 17.1 8.7 43.8 47 66 A I H X S+ 0 0 7 -4,-1.8 4,-2.4 2,-0.2 5,-0.2 0.912 107.9 52.3 -68.4 -42.7 19.5 7.9 41.0 48 67 A G H X S+ 0 0 1 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.915 107.8 53.3 -55.8 -43.4 18.7 4.2 41.3 49 68 A D H X S+ 0 0 63 -4,-1.8 4,-0.7 1,-0.2 -2,-0.2 0.926 108.4 49.2 -55.5 -46.6 15.0 5.4 41.0 50 69 A E H >X S+ 0 0 52 -4,-2.0 4,-0.7 1,-0.2 3,-0.5 0.866 111.8 48.2 -62.6 -37.7 15.9 7.2 37.8 51 70 A L H >< S+ 0 0 0 -4,-2.4 3,-0.5 1,-0.2 -1,-0.2 0.840 102.8 62.3 -72.8 -33.1 17.6 4.2 36.4 52 71 A D H 3< S+ 0 0 56 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.730 105.6 48.2 -60.0 -22.8 14.7 2.0 37.3 53 72 A S H << S+ 0 0 81 -4,-0.7 2,-1.2 -3,-0.5 -1,-0.2 0.618 81.8 101.3 -96.6 -17.2 12.6 4.1 35.0 54 73 A N S+ 0 0 103 -2,-1.2 4,-1.9 1,-0.2 -1,-0.2 0.760 76.2 55.4 -74.1 -28.5 13.2 1.2 30.3 56 75 A E H > S+ 0 0 103 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.922 108.9 49.7 -68.5 -43.8 15.8 0.2 27.7 57 76 A L H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.885 108.7 53.2 -59.1 -41.6 18.3 -0.5 30.4 58 77 A Q H X S+ 0 0 38 -4,-1.6 4,-2.8 2,-0.2 -1,-0.2 0.914 109.4 47.3 -62.6 -44.9 15.7 -2.6 32.3 59 78 A R H X S+ 0 0 167 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.890 112.0 51.7 -63.1 -40.9 15.0 -4.8 29.2 60 79 A M H X S+ 0 0 37 -4,-2.2 4,-1.1 2,-0.2 3,-0.3 0.951 113.6 42.5 -59.4 -50.5 18.7 -5.2 28.7 61 80 A I H < S+ 0 0 6 -4,-2.7 3,-0.4 1,-0.2 -2,-0.2 0.888 111.0 56.4 -67.1 -37.1 19.3 -6.3 32.2 62 81 A A H < S+ 0 0 67 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.869 108.5 49.0 -58.2 -35.6 16.2 -8.5 32.2 63 82 A A H < S+ 0 0 54 -4,-1.7 -1,-0.2 -3,-0.3 -2,-0.2 0.673 84.0 99.9 -82.7 -23.4 17.6 -10.4 29.1 64 83 A V S < S- 0 0 2 -4,-1.1 2,-0.4 -3,-0.4 89,-0.0 -0.492 77.2-123.8 -69.4 134.1 21.1 -11.1 30.3 65 84 A D - 0 0 76 -2,-0.2 3,-0.2 1,-0.1 -2,-0.1 -0.682 24.9-169.4 -84.4 135.6 21.4 -14.7 31.5 66 85 A T + 0 0 5 -2,-0.4 42,-0.1 1,-0.2 -1,-0.1 -0.361 49.2 113.3-129.8 46.6 22.6 -14.9 35.1 67 86 A D S S+ 0 0 120 1,-0.3 -1,-0.2 2,-0.1 3,-0.1 0.703 93.6 38.2 -86.9 -23.2 23.4 -18.5 35.9 68 87 A S S > S+ 0 0 50 -3,-0.2 4,-1.6 1,-0.1 3,-0.3 -0.644 78.3 163.8-116.7 69.1 27.1 -17.5 36.1 69 88 A P H > + 0 0 51 0, 0.0 4,-2.5 0, 0.0 5,-0.1 0.773 67.5 58.4 -69.1 -25.0 26.5 -14.1 37.8 70 89 A R H > S+ 0 0 179 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.930 106.5 48.4 -67.6 -45.4 30.1 -13.6 39.0 71 90 A E H > S+ 0 0 121 -3,-0.3 4,-2.1 1,-0.2 5,-0.2 0.899 112.8 50.6 -53.7 -43.3 31.4 -13.9 35.4 72 91 A V H X S+ 0 0 8 -4,-1.6 4,-2.5 1,-0.2 5,-0.2 0.936 109.2 49.7 -64.8 -45.4 28.7 -11.4 34.4 73 92 A F H X S+ 0 0 54 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.938 113.8 44.1 -60.2 -47.4 29.6 -8.9 37.1 74 93 A F H X S+ 0 0 103 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.852 113.2 51.0 -71.4 -30.6 33.3 -8.9 36.3 75 94 A R H X S+ 0 0 113 -4,-2.1 4,-2.2 -5,-0.2 -1,-0.2 0.911 113.1 45.0 -71.7 -41.7 32.8 -8.7 32.6 76 95 A V H X S+ 0 0 0 -4,-2.5 4,-2.8 -5,-0.2 -2,-0.2 0.932 114.1 49.8 -65.4 -43.8 30.4 -5.8 32.9 77 96 A A H X S+ 0 0 16 -4,-2.5 4,-1.2 -5,-0.2 -2,-0.2 0.938 112.3 46.0 -62.4 -50.7 32.7 -4.0 35.4 78 97 A A H >< S+ 0 0 65 -4,-2.4 3,-0.6 1,-0.2 -1,-0.2 0.942 114.3 49.6 -54.9 -48.9 35.9 -4.4 33.2 79 98 A D H >< S+ 0 0 55 -4,-2.2 3,-1.4 1,-0.2 4,-0.3 0.908 105.5 55.9 -60.3 -44.7 33.9 -3.2 30.1 80 99 A M H 3< S+ 0 0 2 -4,-2.8 -1,-0.2 1,-0.3 3,-0.2 0.796 119.6 32.4 -55.3 -32.8 32.5 -0.2 31.9 81 100 A F T X< S+ 0 0 44 -4,-1.2 3,-1.2 -3,-0.6 -1,-0.3 0.093 84.9 109.4-113.3 21.9 36.0 1.0 32.7 82 101 A S T < + 0 0 91 -3,-1.4 -1,-0.1 1,-0.3 -2,-0.1 0.774 69.8 63.6 -74.5 -23.2 38.0 -0.3 29.7 83 102 A D T 3 S- 0 0 84 -4,-0.3 -1,-0.3 -3,-0.2 3,-0.1 0.501 110.7-116.9 -79.3 -3.1 38.6 3.1 28.2 84 103 A G S < S+ 0 0 49 -3,-1.2 2,-0.3 1,-0.3 -2,-0.1 0.577 73.2 127.0 79.7 10.2 40.7 4.1 31.3 85 104 A N - 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