==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER REGULATORY PROTEIN 21-MAR-97 1AF3 . COMPND 2 MOLECULE: APOPTOSIS REGULATOR BCL-X; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR M.ARITOMI,N.KUNISHIMA,N.INOHARA,Y.ISHIBASHI,S.OHTA, . 145 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7881.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 116 80.0 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 . 1 0.7 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 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 15.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 85 58.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 3.4 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 1 1 0 0 0 0 0 0 2 1 0 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 2 A S 0 0 95 0, 0.0 4,-0.4 0, 0.0 124,-0.1 0.000 360.0 360.0 360.0 -56.1 34.6 -3.8 35.4 2 3 A Q > + 0 0 139 2,-0.2 4,-1.7 1,-0.1 3,-0.2 0.719 360.0 63.5-100.7 -23.7 32.3 -5.0 38.1 3 4 A S H > S+ 0 0 47 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.876 97.9 63.6 -53.6 -35.2 34.5 -3.9 40.8 4 5 A N H > S+ 0 0 1 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.881 100.3 45.4 -57.6 -44.1 33.6 -0.6 39.2 5 6 A R H > S+ 0 0 66 -4,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.858 109.7 59.7 -68.5 -29.7 29.9 -1.0 40.0 6 7 A E H X S+ 0 0 104 -4,-1.7 4,-1.5 1,-0.2 -2,-0.2 0.852 108.9 41.9 -54.3 -44.1 31.2 -1.9 43.5 7 8 A L H X S+ 0 0 1 -4,-1.9 4,-1.8 1,-0.2 -1,-0.2 0.778 111.2 55.0 -82.5 -28.0 32.9 1.5 43.8 8 9 A V H X S+ 0 0 0 -4,-1.5 4,-2.1 2,-0.2 -1,-0.2 0.847 109.7 46.6 -66.5 -46.1 30.0 3.5 42.3 9 10 A V H X S+ 0 0 19 -4,-2.1 4,-2.5 2,-0.2 5,-0.2 0.900 111.1 52.7 -68.8 -35.5 27.5 2.1 44.9 10 11 A D H X S+ 0 0 27 -4,-1.5 4,-3.0 1,-0.2 -2,-0.2 0.979 111.7 45.1 -59.8 -55.1 29.9 2.7 47.7 11 12 A F H X S+ 0 0 2 -4,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.828 116.1 44.6 -57.8 -45.9 30.4 6.3 46.8 12 13 A L H X S+ 0 0 1 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.883 113.4 50.6 -72.4 -39.0 26.8 7.0 46.2 13 14 A S H X S+ 0 0 24 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.943 111.1 50.1 -57.9 -48.5 25.7 5.2 49.4 14 15 A Y H X S+ 0 0 59 -4,-3.0 4,-2.8 -5,-0.2 -2,-0.2 0.908 111.5 47.3 -57.5 -47.3 28.2 7.1 51.4 15 16 A K H X S+ 0 0 3 -4,-2.0 4,-0.9 1,-0.2 -1,-0.2 0.792 110.8 50.9 -67.7 -38.5 27.1 10.5 50.0 16 17 A L H <>S+ 0 0 4 -4,-2.2 5,-3.1 2,-0.2 3,-0.5 0.923 112.9 47.0 -66.0 -41.5 23.4 9.7 50.6 17 18 A S H ><5S+ 0 0 58 -4,-2.7 3,-2.4 1,-0.2 -2,-0.2 0.969 106.4 58.5 -57.5 -52.3 24.2 8.8 54.3 18 19 A Q H 3<5S+ 0 0 85 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.794 110.7 42.7 -42.9 -36.4 26.3 11.8 54.8 19 20 A K T 3<5S- 0 0 91 -4,-0.9 -1,-0.3 -3,-0.5 -2,-0.2 0.340 119.3 -98.4-102.5 4.7 23.3 14.0 53.9 20 21 A G T < 5S+ 0 0 68 -3,-2.4 2,-0.2 -4,-0.3 -3,-0.2 0.740 79.9 127.9 86.7 22.7 20.5 12.4 55.7 21 22 A Y < - 0 0 60 -5,-3.1 -1,-0.3 -6,-0.1 2,-0.2 -0.730 63.5 -99.0-108.6 167.1 19.0 10.4 52.9 22 23 A S - 0 0 78 -2,-0.2 3,-0.1 1,-0.1 -1,-0.0 -0.492 21.6-166.2 -76.6 150.3 18.2 6.8 52.6 23 24 A W > + 0 0 151 -2,-0.2 3,-1.5 1,-0.1 -1,-0.1 0.217 59.9 106.9-116.6 8.4 20.7 4.4 50.8 24 25 A S T 3 + 0 0 74 1,-0.3 -1,-0.1 -11,-0.0 -11,-0.0 0.730 57.2 79.5 -72.5 -20.2 18.2 1.5 50.5 25 26 A Q T > S+ 0 0 52 -3,-0.1 3,-0.8 2,-0.1 2,-0.4 0.697 77.9 90.6 -53.4 -20.7 17.7 2.0 46.8 26 27 A F T < S+ 0 0 17 -3,-1.5 3,-0.1 1,-0.2 -3,-0.1 -0.705 96.9 5.1 -92.9 141.5 21.0 0.2 46.1 27 28 A S T 3 S+ 0 0 102 -2,-0.4 2,-0.8 1,-0.2 -1,-0.2 0.844 87.8 144.2 60.6 36.4 21.3 -3.5 45.7 28 29 A D < 0 0 105 -3,-0.8 -1,-0.2 0, 0.0 86,-0.0 -0.712 360.0 360.0-107.2 68.1 17.5 -3.5 45.8 29 30 A V 0 0 191 -2,-0.8 -3,-0.0 -3,-0.1 -4,-0.0 -0.907 360.0 360.0-139.4 360.0 16.7 -6.2 43.3 30 ! 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 31 81 A I >> 0 0 175 0, 0.0 4,-0.6 0, 0.0 3,-0.5 0.000 360.0 360.0 360.0 -43.3 38.8 -5.4 51.1 32 82 A P T 34 + 0 0 121 0, 0.0 3,-0.4 0, 0.0 4,-0.3 0.946 360.0 33.7 -63.7 -44.7 41.1 -5.3 48.0 33 83 A M T 3> S+ 0 0 21 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.278 91.3 100.2 -96.1 17.2 39.2 -2.1 47.0 34 84 A A H <> S+ 0 0 46 -3,-0.5 4,-2.2 1,-0.2 -1,-0.2 0.935 85.7 47.1 -64.7 -44.6 38.7 -1.1 50.6 35 85 A A H X S+ 0 0 53 -4,-0.6 4,-2.5 -3,-0.4 -1,-0.2 0.882 113.1 49.0 -61.7 -39.0 41.6 1.4 50.2 36 86 A V H > S+ 0 0 9 -4,-0.3 4,-3.5 2,-0.2 5,-0.2 0.952 110.0 51.0 -66.0 -53.0 40.2 2.6 46.9 37 87 A K H X S+ 0 0 39 -4,-2.9 4,-2.7 1,-0.2 -2,-0.2 0.910 113.9 43.3 -51.6 -47.1 36.8 3.1 48.4 38 88 A Q H X S+ 0 0 95 -4,-2.2 4,-3.3 2,-0.2 -1,-0.2 0.918 112.9 52.1 -67.7 -44.7 38.1 5.2 51.3 39 89 A A H X S+ 0 0 2 -4,-2.5 4,-3.2 2,-0.2 5,-0.2 0.962 111.2 48.5 -55.6 -48.2 40.4 7.1 49.1 40 90 A L H X S+ 0 0 3 -4,-3.5 4,-2.8 2,-0.2 5,-0.3 0.954 109.5 51.3 -54.3 -53.9 37.5 8.0 46.9 41 91 A R H X S+ 0 0 55 -4,-2.7 4,-2.0 -5,-0.2 -2,-0.2 0.963 113.5 45.5 -48.0 -51.4 35.3 9.0 49.8 42 92 A E H X S+ 0 0 105 -4,-3.3 4,-2.9 1,-0.2 3,-0.4 0.979 112.5 50.1 -58.3 -52.6 38.0 11.3 51.1 43 93 A A H X S+ 0 0 8 -4,-3.2 4,-2.7 1,-0.3 -2,-0.2 0.874 110.6 50.1 -53.9 -38.5 38.7 12.7 47.6 44 94 A G H X S+ 0 0 0 -4,-2.8 4,-2.7 -5,-0.2 -1,-0.3 0.899 110.3 49.5 -70.9 -35.7 35.1 13.4 47.0 45 95 A D H X S+ 0 0 45 -4,-2.0 4,-1.7 -3,-0.4 -2,-0.2 0.940 112.3 47.3 -66.8 -46.6 34.7 15.2 50.3 46 96 A E H X S+ 0 0 116 -4,-2.9 4,-1.8 1,-0.2 3,-0.5 0.968 111.9 52.1 -60.8 -41.6 37.8 17.4 49.7 47 97 A F H >X S+ 0 0 20 -4,-2.7 4,-1.3 1,-0.3 3,-0.6 0.941 110.4 46.3 -58.7 -53.2 36.5 18.2 46.2 48 98 A E H 3< S+ 0 0 48 -4,-2.7 -1,-0.3 1,-0.2 -2,-0.2 0.742 109.6 54.1 -63.9 -25.5 33.1 19.3 47.4 49 99 A L H 3< S+ 0 0 135 -4,-1.7 -1,-0.2 -3,-0.5 3,-0.2 0.849 112.4 45.4 -67.3 -39.9 34.5 21.4 50.2 50 100 A R H << S+ 0 0 138 -4,-1.8 2,-0.3 -3,-0.6 -2,-0.2 0.579 124.2 31.8 -86.7 -16.4 36.6 23.2 47.7 51 101 A Y < + 0 0 114 -4,-1.3 3,-0.5 -5,-0.2 -1,-0.3 -0.869 66.9 174.1-139.2 104.0 33.8 23.6 45.1 52 102 A R S S+ 0 0 239 -2,-0.3 2,-1.8 1,-0.3 3,-0.3 0.960 79.8 22.2 -73.6 -79.7 30.4 24.1 46.6 53 103 A R S S+ 0 0 205 1,-0.2 -1,-0.3 2,-0.1 3,-0.1 -0.542 82.9 135.3 -86.0 77.3 28.0 24.8 43.7 54 104 A A + 0 0 38 -2,-1.8 -1,-0.2 -3,-0.5 4,-0.2 0.553 67.7 41.8-101.9 -9.5 30.3 23.3 41.0 55 105 A F S > S+ 0 0 26 -3,-0.3 4,-3.5 2,-0.1 5,-0.3 0.147 73.3 113.8-126.9 21.2 27.7 21.3 39.0 56 106 A S H > S+ 0 0 32 2,-0.2 4,-2.4 1,-0.2 5,-0.1 0.892 85.4 39.9 -55.2 -52.0 24.7 23.7 38.8 57 107 A D H > S+ 0 0 111 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.962 116.0 50.9 -63.0 -56.3 25.0 24.2 35.1 58 108 A L H > S+ 0 0 20 2,-0.2 4,-2.1 1,-0.2 3,-0.2 0.933 113.6 43.9 -54.3 -48.4 25.8 20.6 34.4 59 109 A T H X S+ 0 0 14 -4,-3.5 4,-3.4 1,-0.2 -1,-0.2 0.968 112.4 53.5 -64.1 -45.0 22.9 19.3 36.4 60 110 A S H < S+ 0 0 90 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.805 107.0 53.0 -54.3 -35.5 20.6 22.0 34.8 61 111 A Q H < S+ 0 0 112 -4,-2.5 -1,-0.2 -3,-0.2 -2,-0.2 0.954 115.7 39.1 -63.7 -51.7 21.7 20.8 31.4 62 112 A L H < S- 0 0 13 -4,-2.1 -2,-0.2 -5,-0.2 -3,-0.2 0.973 76.6-178.4 -66.1 -59.3 20.8 17.2 32.2 63 113 A H < - 0 0 116 -4,-3.4 -3,-0.1 -5,-0.2 -4,-0.1 0.971 27.3-142.1 59.4 53.4 17.5 17.8 34.2 64 114 A I + 0 0 2 -5,-0.2 -1,-0.1 2,-0.1 48,-0.0 -0.054 33.6 159.6 -53.5 144.6 16.9 14.1 34.9 65 115 A T > - 0 0 51 47,-0.0 3,-2.3 44,-0.0 39,-0.0 -0.943 60.7 -89.4-150.2 168.0 13.5 12.5 34.9 66 116 A P T 3 S+ 0 0 69 0, 0.0 -2,-0.1 0, 0.0 43,-0.0 0.481 126.3 60.6 -65.1 -1.0 12.5 8.8 34.5 67 117 A G T 3 S+ 0 0 68 2,-0.1 2,-0.1 0, 0.0 -3,-0.1 0.490 77.9 110.8-100.0 -11.4 12.4 9.4 30.8 68 118 A T < - 0 0 22 -3,-2.3 2,-0.3 1,-0.1 -4,-0.0 -0.423 58.0-144.8 -62.6 138.4 16.1 10.5 30.4 69 119 A A >> - 0 0 44 -2,-0.1 3,-1.6 1,-0.1 4,-1.5 -0.765 24.7-105.2-108.2 161.2 18.3 8.1 28.6 70 120 A Y H 3> S+ 0 0 32 -2,-0.3 4,-3.2 1,-0.3 5,-0.2 0.790 114.1 63.7 -45.3 -43.7 21.9 7.2 29.0 71 121 A Q H 3> S+ 0 0 119 2,-0.2 4,-2.4 1,-0.2 -1,-0.3 0.796 101.2 49.0 -56.9 -40.0 23.0 9.2 26.0 72 122 A S H <> S+ 0 0 52 -3,-1.6 4,-2.3 2,-0.2 -1,-0.2 0.892 113.4 48.7 -69.9 -34.9 21.9 12.5 27.5 73 123 A F H X S+ 0 0 0 -4,-1.5 4,-3.6 2,-0.2 3,-0.3 0.997 113.2 46.7 -60.5 -57.8 23.8 11.6 30.6 74 124 A E H X S+ 0 0 46 -4,-3.2 4,-2.6 1,-0.3 -2,-0.2 0.910 111.0 52.8 -50.6 -47.0 26.9 10.6 28.6 75 125 A Q H < S+ 0 0 142 -4,-2.4 4,-0.4 1,-0.2 -1,-0.3 0.905 113.6 41.4 -58.5 -49.2 26.8 13.7 26.6 76 126 A V H >< S+ 0 0 12 -4,-2.3 3,-1.6 -3,-0.3 4,-0.4 0.911 113.0 53.4 -70.8 -39.2 26.7 16.0 29.7 77 127 A V H >X S+ 0 0 0 -4,-3.6 3,-2.5 1,-0.3 4,-0.5 0.881 96.3 68.7 -58.3 -34.9 29.3 14.0 31.5 78 128 A N G >< S+ 0 0 62 -4,-2.6 3,-0.9 -5,-0.3 -1,-0.3 0.734 84.1 72.3 -55.1 -24.9 31.6 14.3 28.6 79 129 A E G X4 S+ 0 0 47 -3,-1.6 3,-0.8 -4,-0.4 -1,-0.3 0.766 91.2 57.2 -56.3 -31.6 31.8 18.0 29.4 80 130 A L G <4 S+ 0 0 29 -3,-2.5 -1,-0.3 -4,-0.4 3,-0.2 0.742 110.1 45.0 -68.3 -28.9 34.0 17.1 32.4 81 131 A F G X< + 0 0 21 -3,-0.9 3,-3.1 -4,-0.5 -1,-0.2 0.194 69.3 126.2-105.1 24.4 36.4 15.4 30.0 82 132 A R T < S+ 0 0 191 -3,-0.8 -1,-0.2 1,-0.3 -2,-0.1 0.720 86.2 36.2 -55.4 -24.3 36.6 18.0 27.3 83 133 A D T 3 S- 0 0 136 1,-0.5 -1,-0.3 -3,-0.2 -2,-0.1 0.012 126.5 -93.5-116.9 26.8 40.5 18.0 27.6 84 134 A G < - 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