==== 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 17-FEB-08 2VOH . COMPND 2 MOLECULE: BCL-2-RELATED PROTEIN A1; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR C.SMITS,P.E.CZABOTAR,M.G.HINDS,C.L.DAY . 179 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9479.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 136 76.0 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 . 3 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 116 64.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 2.8 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 2 1 0 0 0 0 0 0 0 0 0 1 0 0 0 1 1 0 2 0 0 1 0 0 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 -4 A G > 0 0 81 0, 0.0 3,-0.7 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0-126.3 -24.4 7.5 30.7 2 -3 A P T 3 + 0 0 132 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.812 360.0 33.5 -59.5 -39.1 -22.8 10.9 30.1 3 -2 A L T 3 S- 0 0 95 1,-0.2 4,-0.4 2,-0.0 3,-0.1 0.546 114.8-112.1 -92.3 -12.1 -22.1 10.6 26.3 4 -1 A G <> - 0 0 32 -3,-0.7 4,-2.5 1,-0.1 5,-0.2 0.079 37.9 -74.0 84.8 155.8 -25.2 8.5 25.6 5 0 A S H > S+ 0 0 91 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.854 126.7 47.7 -55.2 -45.7 -25.2 4.8 24.5 6 1 A M H > S+ 0 0 116 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.946 114.9 43.2 -65.7 -50.6 -24.0 5.3 20.9 7 2 A A H > S+ 0 0 17 -4,-0.4 4,-2.7 2,-0.2 -1,-0.2 0.893 114.2 52.3 -63.9 -39.9 -21.1 7.6 21.6 8 3 A E H X S+ 0 0 52 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.937 109.8 48.3 -59.8 -48.4 -20.0 5.5 24.6 9 4 A S H X S+ 0 0 70 -4,-2.5 4,-2.6 -5,-0.2 -2,-0.2 0.897 112.2 50.6 -57.2 -42.9 -20.0 2.3 22.4 10 5 A E H X S+ 0 0 42 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.924 111.5 46.5 -61.2 -46.5 -18.0 4.2 19.8 11 6 A L H X S+ 0 0 38 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.914 112.5 50.2 -63.7 -44.2 -15.4 5.4 22.4 12 7 A M H X S+ 0 0 137 -4,-2.7 4,-2.7 2,-0.2 -2,-0.2 0.918 110.4 50.7 -60.3 -44.6 -15.2 1.9 23.9 13 8 A H H X S+ 0 0 74 -4,-2.6 4,-3.0 2,-0.2 -2,-0.2 0.944 111.2 47.3 -57.4 -52.3 -14.6 0.3 20.5 14 9 A I H X S+ 0 0 2 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.906 112.8 49.4 -58.6 -43.7 -11.9 2.8 19.6 15 10 A H H X S+ 0 0 45 -4,-2.6 4,-3.0 2,-0.2 5,-0.3 0.928 111.9 48.5 -59.2 -44.9 -10.2 2.2 23.0 16 11 A S H X S+ 0 0 36 -4,-2.7 4,-2.6 2,-0.2 5,-0.2 0.931 112.2 48.7 -61.0 -46.8 -10.4 -1.6 22.5 17 12 A L H X S+ 0 0 1 -4,-3.0 4,-2.5 2,-0.2 -1,-0.2 0.916 113.4 47.8 -57.9 -46.0 -8.9 -1.2 19.0 18 13 A A H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 5,-0.2 0.928 113.6 44.3 -65.1 -49.6 -6.1 1.0 20.2 19 14 A E H X S+ 0 0 36 -4,-3.0 4,-2.3 1,-0.2 -2,-0.2 0.916 115.2 50.0 -66.7 -36.1 -5.1 -1.2 23.2 20 15 A H H X S+ 0 0 64 -4,-2.6 4,-1.9 -5,-0.3 -2,-0.2 0.914 112.8 46.4 -64.4 -44.0 -5.4 -4.4 21.0 21 16 A Y H X S+ 0 0 0 -4,-2.5 4,-2.7 -5,-0.2 -2,-0.2 0.954 114.1 47.1 -62.7 -47.9 -3.2 -2.8 18.3 22 17 A L H X S+ 0 0 3 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.867 110.7 52.0 -64.6 -37.0 -0.6 -1.5 20.8 23 18 A Q H X>S+ 0 0 35 -4,-2.3 5,-2.8 -5,-0.2 4,-0.9 0.879 110.8 49.1 -64.3 -38.0 -0.4 -4.9 22.6 24 19 A Y H ><5S+ 0 0 107 -4,-1.9 3,-0.7 3,-0.2 -2,-0.2 0.945 110.7 49.8 -62.5 -53.3 0.1 -6.5 19.2 25 20 A V H 3<5S+ 0 0 13 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.913 115.7 42.8 -46.5 -53.2 2.9 -4.0 18.3 26 21 A L H 3<5S- 0 0 32 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.626 110.4-121.9 -73.8 -16.4 4.6 -4.6 21.6 27 22 A Q T <<5 + 0 0 168 -4,-0.9 -3,-0.2 -3,-0.7 -4,-0.1 0.927 42.3 177.0 65.9 47.8 4.2 -8.4 21.6 28 23 A V < - 0 0 40 -5,-2.8 -1,-0.2 -6,-0.1 2,-0.1 -0.752 44.8 -93.8 -74.3 125.8 2.2 -8.5 24.8 29 24 A P - 0 0 105 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.207 42.0-149.0 -47.0 114.8 1.2 -12.3 25.3 30 25 A A - 0 0 73 -2,-0.1 2,-0.1 -6,-0.1 0, 0.0 -0.376 7.6-135.7 -85.3 171.7 -2.3 -13.0 23.9 31 26 A F - 0 0 138 -2,-0.1 -1,-0.0 0, 0.0 0, 0.0 -0.487 58.8 -74.9-136.2 54.9 -4.5 -15.7 25.4 32 27 A E S S+ 0 0 187 -2,-0.1 2,-0.0 1,-0.1 -2,-0.0 0.807 82.0 166.3 47.4 36.8 -6.1 -17.7 22.5 33 28 A S - 0 0 72 1,-0.1 -1,-0.1 0, 0.0 -3,-0.0 -0.255 37.3-135.3 -75.0 165.2 -8.4 -14.7 21.9 34 29 A A - 0 0 97 -2,-0.0 -1,-0.1 0, 0.0 6,-0.0 -0.829 21.8-150.6-124.7 87.7 -10.4 -14.2 18.8 35 30 A P - 0 0 59 0, 0.0 2,-0.0 0, 0.0 0, 0.0 -0.177 22.2-107.5 -55.8 150.6 -10.1 -10.6 17.5 36 31 A S > - 0 0 55 1,-0.1 4,-2.6 4,-0.0 5,-0.2 -0.286 34.3-103.1 -64.9 163.6 -13.0 -9.1 15.6 37 32 A Q H > S+ 0 0 88 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.927 126.0 53.7 -54.3 -43.6 -12.6 -8.6 11.9 38 33 A A H > S+ 0 0 5 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.912 109.7 46.9 -57.9 -44.6 -12.0 -4.9 12.6 39 34 A C H > S+ 0 0 5 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.933 114.5 45.8 -63.4 -46.6 -9.2 -5.8 15.1 40 35 A R H X S+ 0 0 102 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.926 115.8 45.8 -63.7 -45.2 -7.5 -8.2 12.8 41 36 A V H X S+ 0 0 2 -4,-2.9 4,-2.6 -5,-0.2 5,-0.3 0.912 113.7 48.4 -66.8 -44.8 -7.7 -5.9 9.8 42 37 A L H X S+ 0 0 1 -4,-2.7 4,-3.3 -5,-0.3 5,-0.4 0.946 111.4 51.5 -57.8 -50.0 -6.5 -2.8 11.8 43 38 A Q H X S+ 0 0 34 -4,-2.8 4,-1.3 -5,-0.2 -2,-0.2 0.892 112.5 45.5 -53.7 -44.9 -3.7 -4.9 13.2 44 39 A R H X S+ 0 0 179 -4,-2.3 4,-1.5 2,-0.2 -2,-0.2 0.954 121.0 36.8 -65.7 -49.3 -2.6 -6.0 9.7 45 40 A V H X S+ 0 0 6 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.915 117.1 49.0 -74.8 -44.7 -2.8 -2.6 8.0 46 41 A A H X S+ 0 0 0 -4,-3.3 4,-2.7 -5,-0.3 -1,-0.2 0.818 109.0 54.6 -65.9 -32.9 -1.5 -0.4 10.9 47 42 A F H X S+ 0 0 64 -4,-1.3 4,-2.0 -5,-0.4 -1,-0.2 0.942 109.8 45.7 -65.9 -45.8 1.5 -2.7 11.5 48 43 A S H X S+ 0 0 49 -4,-1.5 4,-1.6 1,-0.2 -2,-0.2 0.848 114.3 49.5 -66.0 -34.4 2.5 -2.4 7.8 49 44 A V H X S+ 0 0 0 -4,-2.0 4,-3.0 2,-0.2 -2,-0.2 0.923 106.2 55.8 -68.4 -45.0 2.0 1.4 8.0 50 45 A Q H X S+ 0 0 1 -4,-2.7 4,-2.9 1,-0.2 -2,-0.2 0.903 107.5 49.2 -53.2 -43.7 4.0 1.6 11.2 51 46 A K H X S+ 0 0 114 -4,-2.0 4,-2.7 2,-0.2 -1,-0.2 0.900 110.4 50.5 -64.3 -40.4 7.0 -0.0 9.4 52 47 A E H X S+ 0 0 46 -4,-1.6 4,-2.7 2,-0.2 5,-0.2 0.905 112.2 47.9 -61.3 -43.2 6.6 2.4 6.5 53 48 A V H X S+ 0 0 0 -4,-3.0 4,-2.4 2,-0.2 -2,-0.2 0.940 112.9 48.3 -58.5 -48.8 6.6 5.3 9.1 54 49 A E H < S+ 0 0 44 -4,-2.9 -2,-0.2 -5,-0.2 4,-0.2 0.890 116.9 41.7 -64.9 -39.8 9.6 3.9 10.8 55 50 A K H >< S+ 0 0 172 -4,-2.7 3,-1.1 -5,-0.2 4,-0.2 0.968 118.4 44.4 -67.3 -54.3 11.5 3.4 7.5 56 51 A N H 3< S+ 0 0 68 -4,-2.7 3,-0.2 1,-0.2 -2,-0.2 0.788 123.0 34.6 -64.3 -34.0 10.5 6.7 6.0 57 52 A L T >X S+ 0 0 0 -4,-2.4 4,-2.9 -5,-0.2 3,-1.0 0.129 78.4 122.8-109.8 18.7 11.0 8.9 9.1 58 53 A K H <> S+ 0 0 119 -3,-1.1 4,-2.6 1,-0.3 5,-0.2 0.845 72.3 54.6 -51.1 -43.8 14.1 7.1 10.5 59 54 A S H 34 S+ 0 0 86 -4,-0.2 -1,-0.3 -3,-0.2 4,-0.3 0.845 115.1 40.5 -63.7 -33.2 16.3 10.2 10.5 60 55 A Y H X4 S+ 0 0 54 -3,-1.0 3,-1.7 2,-0.2 -2,-0.2 0.934 115.6 49.3 -74.7 -49.9 13.7 12.1 12.6 61 56 A L H >< S+ 0 0 9 -4,-2.9 3,-1.5 1,-0.3 -2,-0.2 0.809 99.7 65.2 -66.8 -29.2 12.8 9.2 14.9 62 57 A D T 3< S+ 0 0 86 -4,-2.6 -1,-0.3 -5,-0.3 -2,-0.2 0.739 105.2 47.9 -60.8 -22.5 16.4 8.4 15.7 63 58 A D T < S+ 0 0 116 -3,-1.7 -1,-0.3 -4,-0.3 2,-0.2 0.310 85.8 113.8-102.6 4.7 16.4 11.9 17.3 64 59 A F < - 0 0 12 -3,-1.5 2,-0.5 -4,-0.2 -3,-0.0 -0.539 51.4-158.0 -70.6 140.9 13.2 11.4 19.4 65 60 A H + 0 0 128 -2,-0.2 2,-1.2 6,-0.1 3,-0.2 -0.775 18.2 170.3-121.5 85.1 13.6 11.3 23.1 66 61 A V + 0 0 0 -2,-0.5 45,-0.3 1,-0.2 -2,-0.0 -0.670 15.5 150.5 -96.5 78.1 10.5 9.5 24.5 67 62 A E + 0 0 104 -2,-1.2 2,-0.3 44,-0.1 -1,-0.2 0.603 60.7 18.7 -90.6 -13.9 11.7 9.1 28.1 68 63 A S S > S- 0 0 28 -3,-0.2 4,-2.2 1,-0.1 5,-0.1 -0.963 77.2-106.3-151.3 163.8 8.3 9.2 29.8 69 64 A I H > S+ 0 0 26 -2,-0.3 4,-2.2 2,-0.2 5,-0.2 0.905 120.0 53.9 -59.3 -41.2 4.6 8.7 29.2 70 65 A D H > S+ 0 0 112 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.916 108.0 48.6 -65.1 -40.1 4.1 12.5 29.5 71 66 A T H > S+ 0 0 33 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.919 109.9 52.8 -63.2 -41.4 6.7 13.2 26.8 72 67 A A H X S+ 0 0 1 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.895 110.0 48.8 -57.9 -41.9 5.0 10.6 24.6 73 68 A R H X S+ 0 0 126 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.906 111.5 48.4 -65.9 -44.6 1.7 12.5 25.0 74 69 A I H X S+ 0 0 93 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.929 114.8 45.0 -60.4 -49.0 3.2 15.8 24.3 75 70 A I H X S+ 0 0 19 -4,-2.7 4,-2.7 2,-0.2 5,-0.2 0.928 112.2 52.8 -62.6 -46.5 5.0 14.5 21.1 76 71 A F H X S+ 0 0 1 -4,-2.7 4,-2.9 -5,-0.2 5,-0.2 0.963 111.8 45.0 -52.7 -53.9 1.8 12.7 20.0 77 72 A N H X S+ 0 0 64 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.893 113.5 48.8 -62.4 -41.4 -0.4 15.8 20.3 78 73 A Q H X S+ 0 0 92 -4,-2.3 4,-1.6 2,-0.2 -1,-0.2 0.916 114.4 45.9 -65.7 -41.7 2.1 18.1 18.6 79 74 A V H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 -2,-0.2 0.937 111.2 51.9 -66.3 -46.0 2.5 15.7 15.7 80 75 A M H X S+ 0 0 1 -4,-2.9 4,-2.6 -5,-0.2 -2,-0.2 0.901 107.7 53.5 -55.3 -44.3 -1.2 15.1 15.3 81 76 A E H < S+ 0 0 132 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.904 112.2 44.2 -55.3 -45.9 -1.8 18.9 15.2 82 77 A K H >< S+ 0 0 69 -4,-1.6 3,-0.7 1,-0.2 4,-0.2 0.874 114.0 50.7 -69.4 -37.7 0.7 19.1 12.3 83 78 A E H 3< S+ 0 0 2 -4,-2.7 3,-0.4 1,-0.2 -2,-0.2 0.913 117.2 37.2 -64.9 -45.8 -0.7 16.1 10.5 84 79 A F T >< S+ 0 0 32 -4,-2.6 3,-2.0 1,-0.2 -1,-0.2 0.202 80.6 115.7 -98.9 17.7 -4.3 17.2 10.6 85 80 A E T < S+ 0 0 138 -3,-0.7 -1,-0.2 1,-0.3 -2,-0.1 0.790 76.0 53.3 -51.9 -38.7 -3.5 20.9 10.0 86 81 A D T 3 S- 0 0 88 -3,-0.4 -1,-0.3 -4,-0.2 -2,-0.1 0.478 109.9-121.9 -83.0 -5.4 -5.3 20.8 6.7 87 82 A G < + 0 0 60 -3,-2.0 2,-0.4 1,-0.2 -2,-0.1 0.515 61.7 143.1 81.4 6.1 -8.6 19.4 8.2 88 83 A I - 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