==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER APOPTOSIS 08-FEB-05 1YSG . COMPND 2 MOLECULE: APOPTOSIS REGULATOR BCL-X; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR T.OLTERSDORF,S.W.ELMORE,A.R.SHOEMAKER,R.C.ARMSTRONG, . 181 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13718.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 113 62.4 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 . 1 0.6 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 . 11 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 79 43.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 2.2 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 0 2 0 0 0 1 0 1 0 2 0 0 0 0 0 1 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 0 206 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-162.7 3.6 17.5 19.7 2 2 A S - 0 0 104 2,-0.0 0, 0.0 0, 0.0 0, 0.0 0.706 360.0-170.7-106.2 -27.0 3.4 15.9 16.2 3 3 A M - 0 0 103 2,-0.1 3,-0.5 1,-0.1 0, 0.0 0.863 19.7-173.7 34.6 55.7 1.0 12.9 17.1 4 4 A A + 0 0 61 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 -0.125 61.8 39.4 -68.3 174.0 1.7 11.4 13.7 5 5 A M S S+ 0 0 49 1,-0.1 -1,-0.2 3,-0.0 -2,-0.1 0.837 77.3 132.0 54.7 28.7 -0.3 8.3 12.5 6 6 A S S S- 0 0 90 -3,-0.5 -2,-0.1 1,-0.1 -1,-0.1 0.847 92.6 -21.9 -80.4 -32.8 -3.3 10.0 14.2 7 7 A Q S > S+ 0 0 152 2,-0.0 4,-0.5 3,-0.0 -1,-0.1 0.100 101.4 113.3-166.0 32.3 -5.6 9.4 11.2 8 8 A S T 4 S+ 0 0 34 1,-0.1 -3,-0.0 2,-0.1 -2,-0.0 -0.017 73.5 61.5-100.9 31.7 -3.4 8.9 8.1 9 9 A N T >> S+ 0 0 6 3,-0.1 3,-1.4 2,-0.1 4,-1.2 0.694 96.9 47.5-120.0 -53.0 -4.5 5.3 7.7 10 10 A R H 3> S+ 0 0 181 1,-0.3 4,-0.7 2,-0.2 3,-0.2 0.939 123.4 37.3 -58.8 -44.2 -8.3 5.1 7.1 11 11 A E H 3X S+ 0 0 114 -4,-0.5 4,-1.2 1,-0.2 -1,-0.3 0.323 102.1 79.0 -90.1 11.3 -7.9 7.9 4.5 12 12 A L H <> S+ 0 0 8 -3,-1.4 4,-1.8 2,-0.2 5,-0.2 0.902 97.5 40.4 -83.6 -41.9 -4.6 6.5 3.2 13 13 A V H X S+ 0 0 3 -4,-1.2 4,-1.9 -3,-0.2 -2,-0.2 0.830 116.9 50.9 -74.6 -29.8 -6.2 3.7 1.2 14 14 A V H X S+ 0 0 24 -4,-0.7 4,-2.8 -5,-0.2 5,-0.3 0.882 107.4 53.3 -75.6 -35.5 -8.9 6.1 0.0 15 15 A D H X S+ 0 0 53 -4,-1.2 4,-1.6 2,-0.2 -2,-0.2 0.981 116.8 36.6 -63.4 -53.2 -6.4 8.8 -1.1 16 16 A F H X S+ 0 0 5 -4,-1.8 4,-1.5 2,-0.2 5,-0.2 0.898 115.1 58.6 -66.7 -36.4 -4.4 6.3 -3.3 17 17 A L H >X S+ 0 0 0 -4,-1.9 4,-2.8 -5,-0.2 3,-1.2 0.982 105.9 46.1 -56.7 -58.1 -7.7 4.6 -4.3 18 18 A S H 3X S+ 0 0 42 -4,-2.8 4,-3.1 1,-0.3 5,-0.3 0.890 106.5 61.0 -53.9 -37.5 -9.2 7.8 -5.7 19 19 A Y H 3< S+ 0 0 69 -4,-1.6 4,-0.4 -5,-0.3 -1,-0.3 0.875 113.4 36.3 -59.6 -33.2 -5.9 8.5 -7.5 20 20 A K H X>S+ 0 0 1 -4,-2.8 4,-2.5 -5,-0.2 3,-1.9 0.951 103.2 56.9 -71.8 -47.4 -10.2 5.5 -9.7 22 22 A S H 3<5S+ 0 0 81 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.1 0.828 99.2 63.7 -54.1 -27.3 -10.1 9.0 -11.2 23 23 A Q H 345S+ 0 0 140 -4,-0.4 -1,-0.3 -5,-0.3 -2,-0.2 0.851 110.7 36.1 -67.0 -30.4 -7.9 7.5 -13.9 24 24 A K H <<5S- 0 0 130 -3,-1.9 -2,-0.2 -4,-0.6 -1,-0.2 0.773 117.9-110.3 -92.0 -28.6 -10.8 5.3 -15.0 25 25 A G T <5S+ 0 0 65 -4,-2.5 -3,-0.2 2,-0.0 -2,-0.1 0.766 84.9 114.5 103.3 35.1 -13.5 7.9 -14.3 26 26 A Y < - 0 0 63 -5,-1.4 4,-0.2 -8,-0.1 -4,-0.2 0.683 50.5-168.5-107.2 -25.6 -15.3 6.3 -11.3 27 27 A S - 0 0 68 -9,-0.2 -1,-0.1 -6,-0.2 -3,-0.1 -0.270 22.8-118.8 66.7-158.7 -14.4 9.0 -8.7 28 28 A W S >> S+ 0 0 55 -7,-0.1 3,-2.3 5,-0.0 4,-0.6 0.428 97.1 69.0-147.8 -45.1 -15.1 8.0 -5.0 29 29 A S T 34 S+ 0 0 69 1,-0.3 4,-0.1 2,-0.2 -2,-0.1 0.849 103.3 52.9 -54.0 -30.7 -17.7 10.4 -3.5 30 30 A Q T 34 S+ 0 0 146 -4,-0.2 -1,-0.3 2,-0.1 3,-0.2 0.636 90.2 82.7 -81.0 -11.3 -20.3 8.8 -5.8 31 31 A F T <4 S+ 0 0 16 -3,-2.3 -2,-0.2 1,-0.2 -1,-0.1 0.986 117.3 2.5 -55.6 -73.9 -19.3 5.3 -4.6 32 32 A S S < S- 0 0 65 -4,-0.6 2,-1.7 1,-0.2 -1,-0.2 0.054 95.5-133.3-102.2 27.5 -21.5 5.2 -1.4 33 33 A D + 0 0 109 -5,-0.2 -1,-0.2 -3,-0.2 -2,-0.2 -0.356 38.2 175.9 60.4 -88.1 -23.0 8.7 -2.1 34 34 A V - 0 0 76 -2,-1.7 -1,-0.1 -3,-0.1 -3,-0.0 0.555 48.3 -63.3 60.7 141.7 -22.5 10.0 1.5 35 35 A E - 0 0 180 1,-0.1 2,-1.0 2,-0.0 -2,-0.0 -0.289 52.3-139.4 -54.1 128.9 -23.4 13.6 2.4 36 36 A E - 0 0 130 1,-0.2 -1,-0.1 2,-0.0 -2,-0.1 -0.767 21.5-178.0 -97.8 98.5 -21.1 15.9 0.3 37 37 A N - 0 0 118 -2,-1.0 -1,-0.2 1,-0.1 -2,-0.0 0.982 37.4-117.2 -57.0 -78.7 -20.0 18.7 2.6 38 38 A R - 0 0 197 2,-0.0 -1,-0.1 1,-0.0 -2,-0.0 -0.296 25.0-164.5 173.8 -78.5 -17.9 20.8 0.2 39 39 A T + 0 0 99 2,-0.0 -2,-0.0 -3,-0.0 -1,-0.0 0.999 23.3 161.4 65.8 70.8 -14.2 21.3 0.8 40 40 A E S S- 0 0 157 1,-0.1 3,-0.1 2,-0.0 -2,-0.0 0.943 75.5 -20.0 -86.6 -65.4 -13.4 24.2 -1.5 41 41 A A S S+ 0 0 92 1,-0.1 3,-0.1 3,-0.0 -1,-0.1 -0.373 75.3 147.5-144.8 62.2 -10.2 25.6 -0.2 42 42 A P - 0 0 87 0, 0.0 2,-1.7 0, 0.0 -1,-0.1 0.515 35.6-161.2 -74.5 -7.2 -9.8 24.5 3.4 43 43 A E + 0 0 163 1,-0.1 2,-1.8 -3,-0.1 3,-0.3 -0.347 20.0 169.4 59.7 -88.2 -6.0 24.4 3.0 44 44 A G - 0 0 60 -2,-1.7 -1,-0.1 1,-0.2 -3,-0.0 -0.533 64.0 -73.9 83.5 -80.2 -5.3 22.1 6.0 45 45 A T - 0 0 93 -2,-1.8 -1,-0.2 3,-0.0 -2,-0.1 0.158 45.7-163.7 177.2 -35.1 -1.6 21.3 5.3 46 46 A E + 0 0 160 -3,-0.3 -2,-0.1 1,-0.2 -3,-0.0 0.815 45.3 133.9 32.1 46.6 -1.5 18.8 2.3 47 47 A S + 0 0 98 2,-0.0 2,-0.3 0, 0.0 -1,-0.2 -0.023 24.7 130.3-110.0 30.5 2.2 18.1 3.3 48 48 A E + 0 0 92 1,-0.1 4,-0.3 2,-0.0 -3,-0.0 -0.636 30.2 178.2 -85.4 141.5 1.8 14.3 3.0 49 89 A A > + 0 0 37 -2,-0.3 4,-2.9 2,-0.1 5,-0.3 0.661 69.1 76.0-113.5 -26.6 4.5 12.4 1.0 50 90 A V H > S+ 0 0 15 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.892 95.3 55.2 -54.3 -36.7 3.4 8.8 1.4 51 91 A K H > S+ 0 0 60 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.973 110.8 42.3 -62.4 -52.2 0.7 9.5 -1.1 52 92 A Q H >> S+ 0 0 138 -4,-0.3 4,-1.7 2,-0.2 3,-0.6 0.967 116.7 48.1 -60.2 -50.7 3.1 10.8 -3.8 53 93 A A H 3X S+ 0 0 3 -4,-2.9 4,-2.6 1,-0.3 5,-0.5 0.960 107.8 54.6 -55.7 -50.5 5.6 8.0 -3.1 54 94 A L H 3X S+ 0 0 0 -4,-3.0 4,-1.1 -5,-0.3 -1,-0.3 0.838 106.0 57.4 -53.9 -28.9 2.9 5.3 -3.2 55 95 A R H X S+ 0 0 38 -4,-2.1 2,-3.1 1,-0.2 4,-1.6 0.887 100.5 77.7 -53.5 -36.2 6.2 -3.0 -8.2 62 102 A E H 3< S+ 0 0 129 -4,-1.3 -1,-0.2 -5,-0.3 4,-0.1 -0.329 97.8 41.5 -72.8 67.3 4.0 -3.5 -11.3 63 103 A L H 34 S+ 0 0 141 -2,-3.1 3,-0.3 0, 0.0 -1,-0.2 0.177 114.7 39.5-175.4 -39.9 7.1 -4.5 -13.4 64 104 A R H << S+ 0 0 214 -3,-0.7 2,-1.1 -4,-0.7 3,-0.4 0.793 111.3 56.0 -96.7 -33.7 9.4 -6.7 -11.4 65 105 A Y X + 0 0 116 -4,-1.6 4,-0.8 1,-0.2 -1,-0.2 -0.479 62.5 135.6 -96.8 66.3 6.8 -8.8 -9.6 66 106 A R T 4 S+ 0 0 214 -2,-1.1 -1,-0.2 -3,-0.3 -2,-0.1 0.851 78.8 38.6 -80.9 -33.5 5.0 -10.1 -12.8 67 107 A R T >> S+ 0 0 229 -3,-0.4 3,-1.1 1,-0.2 4,-0.6 0.835 113.5 55.0 -84.7 -33.0 4.7 -13.7 -11.5 68 108 A A T 34 S+ 0 0 46 1,-0.3 3,-0.3 2,-0.2 -2,-0.2 0.790 104.5 56.0 -70.7 -23.9 4.0 -12.7 -7.9 69 109 A F T 3< S+ 0 0 65 -4,-0.8 -1,-0.3 1,-0.2 -2,-0.1 -0.026 93.8 72.7 -96.9 33.6 1.0 -10.6 -9.1 70 110 A S T <> S+ 0 0 81 -3,-1.1 4,-0.5 2,-0.1 -1,-0.2 0.703 99.7 36.9-113.9 -34.8 -0.6 -13.6 -10.9 71 111 A D T < S+ 0 0 112 -4,-0.6 -2,-0.1 -3,-0.3 -3,-0.1 -0.006 100.3 80.1-107.2 30.3 -1.9 -15.7 -8.0 72 112 A L T 4 S+ 0 0 14 2,-0.1 -1,-0.1 4,-0.0 -3,-0.1 0.746 103.7 26.2-104.2 -32.3 -2.9 -12.7 -5.8 73 113 A T T >4 S+ 0 0 57 -3,-0.1 3,-2.4 2,-0.1 -2,-0.1 0.747 108.8 70.6-100.9 -30.0 -6.2 -11.8 -7.4 74 114 A S T 3< S+ 0 0 87 -4,-0.5 3,-0.4 1,-0.3 -3,-0.1 0.853 102.8 47.6 -56.5 -30.6 -7.1 -15.3 -8.8 75 115 A Q T 3 S+ 0 0 121 1,-0.2 -1,-0.3 -4,-0.0 -2,-0.1 0.081 104.3 64.8 -97.7 25.9 -7.7 -16.3 -5.2 76 116 A L < + 0 0 10 -3,-2.4 -1,-0.2 2,-0.0 -2,-0.1 -0.137 64.4 172.9-137.9 41.2 -9.8 -13.3 -4.4 77 117 A H - 0 0 150 -3,-0.4 2,-0.3 1,-0.1 5,-0.2 -0.312 36.4-124.2 -54.1 119.4 -12.9 -13.7 -6.6 78 118 A I + 0 0 52 -2,-0.1 -1,-0.1 2,-0.1 5,-0.1 -0.506 54.5 134.0 -69.3 127.0 -15.2 -10.8 -5.5 79 119 A T - 0 0 81 -2,-0.3 2,-2.6 3,-0.3 3,-0.0 -0.986 68.8 -83.0-167.0 163.8 -18.6 -12.3 -4.5 80 120 A P S S+ 0 0 139 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 -0.405 111.7 53.5 -72.7 67.8 -21.3 -12.2 -1.8 81 121 A G S S+ 0 0 73 -2,-2.6 -3,-0.1 1,-0.7 2,-0.1 0.057 99.4 32.4-159.5 -79.1 -19.5 -14.6 0.5 82 122 A T + 0 0 51 -5,-0.2 -1,-0.7 1,-0.1 -3,-0.3 -0.264 53.5 143.6 -85.7 179.4 -15.9 -14.0 1.6 83 123 A A S > S+ 0 0 31 -3,-0.1 4,-0.7 -5,-0.1 -1,-0.1 -0.140 75.4 17.4-175.3 -77.4 -14.4 -10.5 2.1 84 124 A Y H > S+ 0 0 119 3,-0.2 4,-2.8 2,-0.1 5,-0.3 0.797 120.3 60.7 -87.5 -29.3 -11.8 -9.9 4.9 85 125 A Q H > S+ 0 0 137 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.995 114.7 29.7 -60.6 -73.1 -11.0 -13.6 5.5 86 126 A S H > S+ 0 0 35 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.912 120.8 57.7 -54.8 -40.6 -9.7 -14.5 2.0 87 127 A F H >X S+ 0 0 4 -4,-0.7 4,-2.7 1,-0.2 3,-0.8 0.982 107.9 43.4 -55.1 -59.7 -8.4 -10.9 1.7 88 128 A E H 3X S+ 0 0 64 -4,-2.8 4,-1.7 1,-0.3 -1,-0.2 0.858 110.2 59.5 -56.1 -31.5 -6.3 -11.0 4.8 89 129 A Q H 3< S+ 0 0 131 -4,-2.1 4,-0.4 -5,-0.3 -1,-0.3 0.893 111.6 39.0 -66.1 -36.1 -5.1 -14.5 3.6 90 130 A V H XX S+ 0 0 11 -4,-2.0 3,-2.1 -3,-0.8 4,-0.6 0.954 114.6 50.3 -79.0 -52.1 -3.8 -12.9 0.4 91 131 A V H >X S+ 0 0 2 -4,-2.7 4,-1.7 1,-0.3 3,-0.8 0.847 99.7 69.2 -55.6 -29.8 -2.3 -9.7 1.9 92 132 A N H 3< S+ 0 0 63 -4,-1.7 -1,-0.3 -5,-0.4 -2,-0.2 0.829 84.0 72.2 -59.8 -27.7 -0.6 -12.0 4.5 93 133 A E H X> S+ 0 0 102 -3,-2.1 4,-0.5 -4,-0.4 3,-0.5 0.945 105.8 35.1 -54.2 -47.7 1.6 -13.2 1.6 94 134 A L H << S+ 0 0 29 -3,-0.8 2,-0.7 -4,-0.6 4,-0.3 0.821 119.2 53.6 -77.5 -28.3 3.5 -9.9 1.5 95 135 A F T 3< S+ 0 0 13 -4,-1.7 -1,-0.2 1,-0.1 4,-0.2 -0.414 95.6 72.1-102.2 59.9 3.2 -9.5 5.3 96 136 A R T <4 S+ 0 0 204 -2,-0.7 3,-0.2 -3,-0.5 -2,-0.1 0.539 84.8 52.0-133.4 -60.7 4.7 -12.9 6.3 97 137 A D S < S- 0 0 136 -4,-0.5 2,-0.1 1,-0.2 -2,-0.1 0.818 132.7 -53.9 -54.2 -26.5 8.5 -13.1 5.8 98 138 A G - 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