==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER APOPTOSIS 26-SEP-03 1R2H . COMPND 2 MOLECULE: APOPTOSIS REGULATOR BCL-X; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.W.O'NEILL,M.K.MANION,C.D.GIEDT,K.M.KIM,K.Y.ZHANG, . 142 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7416.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 113 79.6 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 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 14.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 86 60.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 3.5 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 1 1 2 0 0 0 0 0 0 0 1 0 2 0 1 0 0 0 0 0 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 1 A M > 0 0 129 0, 0.0 4,-3.2 0, 0.0 5,-0.3 0.000 360.0 360.0 360.0 171.8 36.5 -4.3 74.3 2 2 A S H > + 0 0 77 1,-0.2 4,-1.3 2,-0.2 120,-0.1 0.874 360.0 39.5 -62.5 -36.6 36.0 -0.6 75.2 3 3 A Q H > S+ 0 0 125 2,-0.2 4,-2.2 3,-0.1 -1,-0.2 0.875 115.3 51.2 -79.1 -41.4 37.4 0.3 71.8 4 4 A S H > S+ 0 0 43 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.921 114.2 44.1 -61.7 -45.5 35.6 -2.5 69.9 5 5 A N H X S+ 0 0 1 -4,-3.2 4,-2.5 2,-0.2 -1,-0.2 0.858 110.3 54.7 -68.7 -36.1 32.3 -1.5 71.4 6 6 A R H X S+ 0 0 133 -4,-1.3 4,-2.3 -5,-0.3 -1,-0.2 0.913 110.3 47.0 -63.3 -41.7 32.9 2.2 70.8 7 7 A E H X S+ 0 0 75 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.859 110.4 52.8 -67.2 -37.6 33.5 1.4 67.2 8 8 A L H X S+ 0 0 3 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.920 109.9 48.2 -64.5 -45.0 30.4 -0.7 67.0 9 9 A V H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 5,-0.3 0.946 112.0 48.2 -61.6 -49.9 28.3 2.1 68.5 10 10 A V H X S+ 0 0 20 -4,-2.3 4,-2.7 1,-0.2 5,-0.2 0.894 111.7 50.7 -60.5 -39.6 29.6 4.7 66.1 11 11 A D H X S+ 0 0 25 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.960 112.4 45.5 -63.3 -49.7 29.1 2.4 63.1 12 12 A F H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.920 116.5 45.0 -60.5 -45.5 25.5 1.6 64.0 13 13 A L H X S+ 0 0 0 -4,-2.8 4,-2.4 2,-0.2 5,-0.2 0.929 113.9 49.1 -64.9 -43.7 24.7 5.3 64.7 14 14 A S H X S+ 0 0 23 -4,-2.7 4,-2.3 -5,-0.3 -2,-0.2 0.881 111.2 51.3 -61.9 -39.8 26.4 6.5 61.6 15 15 A Y H X S+ 0 0 50 -4,-2.6 4,-2.8 -5,-0.2 -1,-0.2 0.926 111.5 46.2 -62.6 -46.8 24.5 3.8 59.6 16 16 A K H X S+ 0 0 2 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.869 112.6 49.3 -66.4 -38.6 21.1 4.9 60.9 17 17 A L H <>S+ 0 0 1 -4,-2.4 5,-3.2 2,-0.2 -1,-0.2 0.930 114.1 46.3 -66.8 -44.5 21.8 8.6 60.4 18 18 A S H ><5S+ 0 0 62 -4,-2.3 3,-2.3 -5,-0.2 -2,-0.2 0.970 110.3 52.5 -59.2 -56.3 22.9 8.0 56.8 19 19 A Q H 3<5S+ 0 0 87 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.839 111.3 48.4 -47.9 -39.4 20.0 5.7 56.1 20 20 A K T 3<5S- 0 0 98 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.241 123.0 -98.6 -92.4 13.0 17.5 8.4 57.3 21 21 A G T < 5S+ 0 0 70 -3,-2.3 -3,-0.2 1,-0.3 2,-0.2 0.601 82.0 124.5 84.7 12.3 19.0 11.3 55.4 22 22 A Y < - 0 0 61 -5,-3.2 -1,-0.3 -6,-0.2 2,-0.2 -0.566 63.3-100.6-103.7 167.9 21.1 12.8 58.2 23 23 A S - 0 0 71 -2,-0.2 3,-0.1 1,-0.1 -1,-0.1 -0.572 19.4-169.9 -84.5 149.0 24.8 13.7 58.5 24 24 A W > + 0 0 135 -2,-0.2 3,-1.5 1,-0.1 -1,-0.1 0.185 60.1 107.4-119.2 9.3 27.2 11.4 60.4 25 25 A S T 3 + 0 0 91 1,-0.3 -1,-0.1 2,-0.2 -11,-0.0 0.676 56.1 82.2 -63.0 -21.2 30.0 13.9 60.3 26 26 A Q T 3 0 0 87 1,-0.1 -1,-0.3 -3,-0.1 85,-0.1 0.591 360.0 360.0 -63.0 -8.7 29.6 14.6 64.0 27 27 A F < 0 0 71 -3,-1.5 -2,-0.2 -17,-0.1 -1,-0.1 0.842 360.0 360.0 -99.6 360.0 31.7 11.5 64.6 28 ! 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 29 82 A P >> 0 0 115 0, 0.0 4,-1.7 0, 0.0 3,-1.3 0.000 360.0 360.0 360.0 94.5 35.2 -10.3 62.7 30 83 A M H 3> + 0 0 59 1,-0.3 4,-2.7 2,-0.2 5,-0.2 0.841 360.0 55.1 -42.9 -47.1 34.2 -6.7 63.4 31 84 A A H 3> S+ 0 0 79 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.873 107.8 50.1 -58.2 -38.2 32.8 -6.2 59.9 32 85 A A H <> S+ 0 0 39 -3,-1.3 4,-2.0 2,-0.2 -1,-0.2 0.856 111.3 47.7 -69.4 -36.9 30.6 -9.2 60.4 33 86 A V H X S+ 0 0 10 -4,-1.7 4,-2.9 2,-0.2 5,-0.2 0.953 112.2 49.1 -69.1 -49.4 29.3 -8.0 63.8 34 87 A K H X S+ 0 0 42 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.932 112.8 47.4 -54.7 -50.4 28.6 -4.5 62.4 35 88 A Q H X S+ 0 0 95 -4,-2.2 4,-2.3 -5,-0.2 -1,-0.2 0.917 112.8 48.9 -59.1 -45.2 26.7 -5.8 59.4 36 89 A A H X S+ 0 0 1 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.924 112.8 47.8 -60.7 -45.4 24.6 -8.2 61.6 37 90 A L H X S+ 0 0 2 -4,-2.9 4,-2.8 2,-0.2 -2,-0.2 0.920 109.1 53.7 -62.6 -44.9 23.8 -5.4 64.0 38 91 A R H X S+ 0 0 71 -4,-2.8 4,-2.0 -5,-0.2 -1,-0.2 0.935 113.1 43.0 -54.5 -49.4 22.8 -3.1 61.1 39 92 A E H X S+ 0 0 99 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.866 111.3 54.3 -66.7 -37.4 20.4 -5.7 59.8 40 93 A A H X S+ 0 0 5 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.933 108.9 50.0 -61.9 -44.5 19.1 -6.5 63.2 41 94 A G H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.916 112.5 45.4 -60.2 -45.8 18.3 -2.9 63.7 42 95 A D H X S+ 0 0 41 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.911 110.4 54.6 -63.9 -43.7 16.4 -2.5 60.4 43 96 A E H X S+ 0 0 85 -4,-2.6 4,-1.0 1,-0.2 3,-0.3 0.946 112.1 43.9 -55.5 -51.6 14.5 -5.7 61.0 44 97 A F H >X S+ 0 0 16 -4,-2.5 4,-2.4 1,-0.2 3,-1.0 0.933 113.1 49.9 -60.5 -48.1 13.3 -4.5 64.3 45 98 A E H 3< S+ 0 0 24 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.749 101.1 65.9 -63.9 -22.6 12.4 -1.0 63.0 46 99 A L H 3< S+ 0 0 107 -4,-1.8 -1,-0.3 -3,-0.3 -2,-0.2 0.860 111.0 35.0 -66.3 -35.1 10.5 -2.6 60.2 47 100 A R H << S+ 0 0 154 -3,-1.0 2,-0.6 -4,-1.0 -2,-0.2 0.863 125.7 38.5 -86.4 -41.9 8.0 -4.0 62.7 48 101 A Y >< + 0 0 130 -4,-2.4 3,-0.5 1,-0.1 -1,-0.3 -0.894 61.0 177.1-116.9 101.6 8.0 -1.1 65.2 49 102 A R T 3 S+ 0 0 169 -2,-0.6 -1,-0.1 1,-0.2 3,-0.1 0.791 85.3 14.0 -72.9 -30.5 8.2 2.3 63.4 50 103 A R T > S+ 0 0 194 1,-0.1 3,-0.5 2,-0.0 -1,-0.2 -0.417 77.2 139.0-144.8 63.3 7.9 4.4 66.6 51 104 A A T < S+ 0 0 46 -3,-0.5 4,-0.2 1,-0.2 3,-0.2 0.587 70.8 51.9 -85.8 -11.4 8.5 2.1 69.6 52 105 A F T 3> + 0 0 21 1,-0.1 4,-3.2 2,-0.1 5,-0.4 0.256 70.0 110.7-110.1 13.2 10.6 4.5 71.7 53 106 A S H <> S+ 0 0 49 -3,-0.5 4,-1.6 1,-0.2 -1,-0.1 0.905 85.7 42.0 -51.2 -48.9 8.4 7.5 71.7 54 107 A D H > S+ 0 0 126 2,-0.2 4,-1.9 -3,-0.2 -1,-0.2 0.883 115.5 50.3 -67.8 -39.6 7.7 7.1 75.4 55 108 A L H > S+ 0 0 19 2,-0.2 4,-1.1 1,-0.2 -2,-0.2 0.938 113.0 43.0 -66.5 -49.0 11.2 6.3 76.3 56 109 A T H X S+ 0 0 12 -4,-3.2 4,-2.8 1,-0.2 5,-0.4 0.858 113.4 55.6 -65.3 -32.2 12.9 9.2 74.5 57 110 A S H < S+ 0 0 82 -4,-1.6 -1,-0.2 -5,-0.4 -2,-0.2 0.879 102.3 55.0 -66.4 -38.6 10.1 11.4 75.9 58 111 A Q H < S+ 0 0 102 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.782 116.3 38.9 -65.0 -27.2 11.0 10.2 79.4 59 112 A L H < S- 0 0 6 -4,-1.1 -2,-0.2 -3,-0.2 -1,-0.2 0.812 78.0-173.3 -92.3 -33.2 14.5 11.4 78.8 60 113 A H < - 0 0 125 -4,-2.8 -3,-0.1 1,-0.1 -4,-0.1 0.896 29.3-144.1 31.6 65.8 13.8 14.6 76.8 61 114 A I + 0 0 0 -5,-0.4 -1,-0.1 2,-0.1 48,-0.1 -0.243 32.5 161.8 -62.7 139.5 17.5 15.0 76.1 62 115 A T > - 0 0 57 -3,-0.1 3,-2.3 47,-0.0 39,-0.0 -0.879 59.1 -87.4-144.9 170.5 19.3 18.4 76.0 63 116 A P T 3 S+ 0 0 70 0, 0.0 -2,-0.1 0, 0.0 43,-0.0 0.657 127.3 59.3 -60.2 -12.0 22.9 19.4 76.3 64 117 A G T 3 S+ 0 0 67 2,-0.1 2,-0.2 0, 0.0 -3,-0.0 0.482 76.9 116.5 -95.0 -3.3 22.4 19.5 80.0 65 118 A T < - 0 0 20 -3,-2.3 2,-0.2 1,-0.1 -4,-0.0 -0.455 57.2-141.4 -68.6 134.1 21.3 15.8 80.4 66 119 A A >> - 0 0 59 -2,-0.2 4,-1.3 1,-0.1 3,-1.2 -0.613 20.3-113.4 -94.7 157.7 23.7 13.7 82.5 67 120 A Y H 3> S+ 0 0 53 1,-0.3 4,-3.1 -2,-0.2 5,-0.2 0.888 113.0 64.1 -54.6 -44.1 24.7 10.1 81.8 68 121 A Q H 3> S+ 0 0 145 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.804 101.8 50.3 -52.8 -32.9 22.9 8.9 84.9 69 122 A S H <> S+ 0 0 50 -3,-1.2 4,-1.9 2,-0.2 -1,-0.2 0.915 111.1 47.5 -72.4 -43.3 19.5 10.0 83.4 70 123 A F H X S+ 0 0 0 -4,-1.3 4,-2.9 1,-0.2 5,-0.3 0.956 112.9 50.3 -58.7 -50.9 20.3 8.2 80.1 71 124 A E H X S+ 0 0 41 -4,-3.1 4,-2.2 1,-0.2 -1,-0.2 0.883 108.1 51.9 -55.2 -45.0 21.3 5.1 82.1 72 125 A Q H < S+ 0 0 127 -4,-2.0 4,-0.5 -5,-0.2 -1,-0.2 0.887 113.4 44.5 -62.4 -40.2 18.1 5.1 84.2 73 126 A V H >< S+ 0 0 12 -4,-1.9 3,-1.3 1,-0.2 4,-0.3 0.920 112.6 49.4 -71.6 -44.6 15.9 5.3 81.1 74 127 A V H >X S+ 0 0 0 -4,-2.9 3,-2.3 1,-0.3 4,-0.6 0.862 98.3 69.2 -63.1 -33.8 17.8 2.6 79.1 75 128 A N G >< S+ 0 0 52 -4,-2.2 3,-1.2 1,-0.3 -1,-0.3 0.808 85.7 72.1 -53.5 -27.3 17.6 0.4 82.2 76 129 A E G X4 S+ 0 0 74 -3,-1.3 3,-1.0 -4,-0.5 -1,-0.3 0.810 90.6 55.9 -58.1 -32.5 13.9 0.3 81.3 77 130 A L G <4 S+ 0 0 27 -3,-2.3 3,-0.3 -4,-0.3 -1,-0.3 0.742 109.6 48.2 -72.3 -21.6 14.7 -1.9 78.3 78 131 A F G X< + 0 0 22 -3,-1.2 3,-2.1 -4,-0.6 -1,-0.2 -0.063 66.4 125.3-111.9 32.8 16.4 -4.4 80.7 79 132 A R T < S+ 0 0 156 -3,-1.0 -1,-0.2 1,-0.3 -2,-0.1 0.812 87.7 36.8 -59.2 -32.0 13.8 -4.7 83.4 80 133 A D T 3 S- 0 0 141 1,-0.5 -1,-0.3 -3,-0.3 -2,-0.1 0.001 126.0-101.2-108.4 25.3 13.8 -8.5 82.9 81 134 A G < - 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