==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION REGULATOR/ANTIBIOTIC 15-NOV-09 3KP5 . COMPND 2 MOLECULE: TRANSCRIPTIONAL REGULATOR TCAR; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS EPIDERMIDIS RP62A; . AUTHOR Y.M.CHANG,C.K.CHEN,A.H.WANG . 273 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15561.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 226 82.8 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 . 4 1.5 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 . 1 0.4 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 0.4 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 . 4 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 173 63.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.8 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 0 1 2 0 1 1 1 0 1 0 0 0 0 0 0 1 1 0 0 2 0 0 0 1 0 1 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 1 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 . 1 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 R > 0 0 219 0, 0.0 4,-1.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -61.1 -7.3 -22.6 -16.4 2 5 A I H > + 0 0 35 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.780 360.0 68.1 -88.2 -31.1 -10.9 -22.6 -15.4 3 6 A E H > S+ 0 0 104 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.879 104.8 48.3 -55.4 -32.9 -11.3 -26.3 -15.5 4 7 A D H >> S+ 0 0 63 2,-0.2 4,-2.4 1,-0.2 3,-0.5 0.948 106.6 51.6 -71.6 -51.1 -8.9 -26.2 -12.6 5 8 A H H 3X S+ 0 0 47 -4,-1.0 4,-2.3 1,-0.3 -2,-0.2 0.802 109.3 54.5 -56.3 -29.3 -10.8 -23.6 -10.6 6 9 A I H 3X S+ 0 0 21 -4,-2.3 4,-1.6 2,-0.2 -1,-0.3 0.856 107.6 47.9 -72.0 -38.4 -13.9 -25.7 -11.1 7 10 A S H X S+ 0 0 4 -4,-2.7 4,-1.4 -5,-0.2 3,-0.6 0.978 111.6 48.9 -57.6 -54.9 -17.4 -33.3 4.8 19 22 A L H 3X S+ 0 0 17 -4,-2.8 4,-2.2 1,-0.3 -1,-0.2 0.802 110.1 47.8 -55.0 -39.9 -16.4 -31.1 7.7 20 23 A T H 3X S+ 0 0 28 -4,-2.1 4,-0.5 1,-0.2 -1,-0.3 0.830 107.9 60.2 -72.9 -26.2 -19.9 -30.0 8.7 21 24 A A H X S+ 0 0 47 -4,-1.4 3,-0.9 1,-0.2 4,-0.5 0.925 113.4 54.5 -79.4 -45.9 -18.4 -34.6 11.1 23 26 A L H 3< S+ 0 0 27 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.518 116.1 40.1 -66.2 -7.5 -18.8 -31.6 13.4 24 27 A L H 3X S+ 0 0 2 -4,-0.5 4,-2.6 -5,-0.1 5,-0.3 0.487 85.7 90.9-122.0 -3.6 -22.6 -32.1 13.5 25 28 A K H S+ 0 0 10 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.884 112.8 44.1 -71.5 -42.1 -25.6 -33.1 17.6 28 31 A Q H <>S+ 0 0 17 -4,-2.6 5,-3.4 2,-0.2 -2,-0.2 0.881 114.0 52.2 -70.6 -36.1 -28.0 -34.5 15.0 29 32 A T H ><5S+ 0 0 87 -4,-3.1 3,-1.6 -5,-0.3 -2,-0.2 0.963 110.1 51.5 -60.0 -48.9 -27.7 -37.8 16.8 30 33 A E H 3<5S+ 0 0 123 -4,-2.5 -2,-0.2 -5,-0.3 -1,-0.2 0.940 113.3 39.9 -53.4 -57.6 -28.5 -35.8 20.0 31 34 A Y T 3<5S- 0 0 46 -4,-2.7 -1,-0.3 2,-0.1 -2,-0.2 0.323 116.5-120.8 -76.1 10.4 -31.7 -34.1 18.6 32 35 A G T < 5 + 0 0 62 -3,-1.6 2,-0.3 1,-0.2 -3,-0.2 0.805 66.4 132.0 55.5 38.2 -32.3 -37.5 17.0 33 36 A I < - 0 0 14 -5,-3.4 -1,-0.2 -6,-0.1 2,-0.1 -0.821 55.1-118.7-119.9 161.0 -32.4 -36.2 13.4 34 37 A S > - 0 0 36 -2,-0.3 4,-1.8 1,-0.1 163,-0.1 -0.406 34.2-107.8 -85.0 169.2 -30.8 -37.4 10.2 35 38 A A H > S+ 0 0 24 161,-0.3 4,-2.7 2,-0.2 5,-0.2 0.913 121.9 52.6 -64.0 -44.7 -28.4 -35.1 8.3 36 39 A E H > S+ 0 0 45 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.875 108.0 52.5 -59.5 -37.1 -31.0 -34.5 5.6 37 40 A Q H > S+ 0 0 22 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.896 107.8 52.0 -66.2 -38.3 -33.4 -33.5 8.4 38 41 A S H >X S+ 0 0 5 -4,-1.8 4,-1.6 1,-0.2 3,-1.3 0.973 106.3 51.6 -60.6 -55.7 -30.8 -31.0 9.7 39 42 A H H 3X S+ 0 0 66 -4,-2.7 4,-1.2 1,-0.3 3,-0.4 0.875 106.1 56.8 -49.1 -40.7 -30.3 -29.4 6.3 40 43 A V H 3X S+ 0 0 2 -4,-1.7 4,-0.9 1,-0.3 -1,-0.3 0.837 105.8 50.2 -61.2 -33.7 -34.1 -28.9 6.2 41 44 A L H << S+ 0 0 0 -3,-1.3 -1,-0.3 -4,-1.3 -2,-0.2 0.785 105.0 59.3 -74.8 -27.3 -34.0 -27.0 9.5 42 45 A N H X S+ 0 0 14 -4,-1.6 4,-0.7 -3,-0.4 -2,-0.2 0.773 102.5 48.4 -75.5 -27.2 -31.2 -24.8 8.2 43 46 A M H X S+ 0 0 7 -4,-1.2 4,-2.1 1,-0.2 3,-0.3 0.829 113.6 49.2 -78.2 -32.5 -33.0 -23.3 5.2 44 47 A L H < S+ 0 0 13 -4,-0.9 -1,-0.2 1,-0.2 -2,-0.2 0.436 97.6 69.8 -82.6 -2.3 -36.0 -22.6 7.6 45 48 A S H 4 S+ 0 0 50 -3,-0.1 -1,-0.2 2,-0.1 -2,-0.2 0.824 109.8 35.0 -80.1 -34.8 -33.5 -21.1 9.9 46 49 A I H < S- 0 0 123 -4,-0.7 2,-0.3 1,-0.3 -2,-0.2 0.976 137.2 -18.6 -76.2 -68.0 -33.3 -18.3 7.3 47 50 A E < - 0 0 126 -4,-2.1 2,-0.4 37,-0.1 -1,-0.3 -0.951 65.6-108.7-142.9 158.9 -37.0 -18.2 6.0 48 51 A A + 0 0 55 -2,-0.3 2,-0.3 -3,-0.1 36,-0.2 -0.718 37.8 169.4 -98.9 135.6 -40.0 -20.4 6.1 49 52 A L - 0 0 25 34,-0.7 -5,-0.0 -2,-0.4 -6,-0.0 -0.983 28.9-116.3-141.1 159.2 -41.4 -22.1 2.9 50 53 A T > - 0 0 69 -2,-0.3 4,-1.1 1,-0.1 3,-0.2 -0.088 43.0 -92.7 -78.4-177.2 -43.9 -24.7 1.9 51 54 A V H > S+ 0 0 51 1,-0.2 4,-1.5 2,-0.2 5,-0.3 0.927 114.4 67.5 -64.8 -50.4 -43.2 -28.1 0.3 52 55 A G H > S+ 0 0 57 1,-0.3 4,-0.6 2,-0.2 3,-0.2 0.837 113.5 29.4 -39.2 -50.7 -43.5 -26.9 -3.3 53 56 A Q H > S+ 0 0 90 -3,-0.2 4,-1.5 1,-0.2 -1,-0.3 0.705 107.1 75.4 -86.2 -21.4 -40.4 -24.7 -3.2 54 57 A I H X S+ 0 0 2 -4,-1.1 4,-0.9 -3,-0.3 -2,-0.2 0.787 103.4 38.4 -61.8 -29.1 -38.7 -26.9 -0.6 55 58 A T H X S+ 0 0 43 -4,-1.5 4,-1.1 -3,-0.2 -1,-0.2 0.755 106.1 65.8 -91.4 -28.0 -37.9 -29.5 -3.2 56 59 A E H < S+ 0 0 99 -4,-0.6 -2,-0.2 -5,-0.3 -1,-0.1 0.822 107.3 41.6 -64.2 -32.4 -37.1 -27.0 -6.0 57 60 A K H < S+ 0 0 50 -4,-1.5 -1,-0.2 3,-0.1 -2,-0.2 0.944 119.1 46.4 -77.0 -51.7 -34.1 -25.8 -4.1 58 61 A Q H < S- 0 0 42 -4,-0.9 -2,-0.2 -5,-0.2 -3,-0.1 0.968 84.4-146.8 -51.2 -87.7 -33.0 -29.2 -3.0 59 62 A G < + 0 0 29 -4,-1.1 2,-0.6 1,-0.5 113,-0.1 0.076 56.2 125.0 132.7 -19.6 -33.1 -31.4 -6.1 60 63 A V - 0 0 47 1,-0.1 -1,-0.5 -5,-0.1 5,-0.3 -0.633 59.4-136.7 -71.0 119.1 -34.1 -34.6 -4.4 61 64 A N >> + 0 0 103 -2,-0.6 4,-0.6 1,-0.1 3,-0.6 0.719 51.6 19.6 -58.0-143.3 -37.3 -35.5 -6.3 62 65 A K T 34 S- 0 0 197 1,-0.2 -1,-0.1 2,-0.1 2,-0.0 -0.045 116.4 -39.5 -44.7 114.8 -40.8 -36.8 -5.6 63 66 A A T 3> S+ 0 0 68 1,-0.2 4,-1.5 -3,-0.1 -1,-0.2 0.284 100.7 115.6 54.3 -6.7 -42.3 -36.5 -2.1 64 67 A A H <> S+ 0 0 19 -3,-0.6 4,-0.7 1,-0.2 -1,-0.2 0.859 78.7 48.0 -55.7 -35.7 -39.0 -37.4 -0.5 65 68 A V H >X S+ 0 0 4 -4,-0.6 4,-2.3 -5,-0.3 3,-1.3 0.927 103.9 55.2 -72.3 -49.3 -38.9 -33.9 1.0 66 69 A S H 3> S+ 0 0 36 1,-0.3 4,-2.1 2,-0.2 5,-0.2 0.811 105.1 58.7 -55.0 -27.9 -42.5 -33.8 2.4 67 70 A R H 3X S+ 0 0 138 -4,-1.5 4,-1.0 2,-0.2 -1,-0.3 0.820 105.2 46.9 -72.1 -30.7 -41.4 -37.0 4.2 68 71 A R H S+ 0 0 0 -4,-2.2 5,-2.0 1,-0.2 6,-1.1 0.740 108.6 59.1 -75.6 -27.7 -39.4 -33.1 11.6 73 76 A L H ><5S+ 0 0 43 -4,-1.6 3,-1.4 1,-0.2 -1,-0.2 0.878 100.3 59.2 -67.2 -38.1 -43.0 -32.0 12.6 74 77 A N T 3<5S+ 0 0 143 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.667 102.3 50.0 -65.9 -21.3 -43.1 -35.1 14.7 75 78 A A T 3 5S- 0 0 30 -3,-0.5 -1,-0.3 -4,-0.4 -2,-0.2 0.411 115.5-114.2 -96.6 1.4 -40.2 -34.1 16.9 76 79 A E T < 5S+ 0 0 133 -3,-1.4 12,-0.5 2,-0.2 13,-0.3 0.752 86.3 121.0 71.6 24.9 -41.8 -30.7 17.4 77 80 A L < + 0 0 1 -5,-2.0 9,-1.8 1,-0.2 2,-0.4 0.720 69.5 41.4 -89.7 -24.6 -38.9 -29.2 15.5 78 81 A V - 0 0 6 -6,-1.1 2,-0.3 7,-0.2 -1,-0.2 -0.986 68.1-156.6-131.8 132.7 -41.0 -27.7 12.8 79 82 A K 0 0 99 -2,-0.4 5,-3.5 -3,-0.1 -6,-0.0 -0.785 360.0 360.0-104.2 146.8 -44.3 -25.9 13.0 80 83 A L 0 0 117 -2,-0.3 -30,-0.0 3,-0.3 -1,-0.0 -0.308 360.0 360.0 -69.7 360.0 -46.9 -25.6 10.2 81 ! 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 82 96 A I 0 0 135 0, 0.0 -2,-0.1 0, 0.0 -3,-0.0 0.000 360.0 360.0 360.0 -85.6 -46.8 -23.0 5.4 83 97 A I + 0 0 7 -35,-0.1 -34,-0.7 -33,-0.1 -3,-0.3 0.930 360.0 156.7 49.7 108.3 -44.2 -24.9 7.5 84 98 A K - 0 0 100 -5,-3.5 2,-0.3 -36,-0.2 -35,-0.1 0.290 41.7 -62.3-119.3-119.0 -41.6 -22.8 9.4 85 99 A L - 0 0 29 -7,-0.2 -7,-0.2 -40,-0.1 2,-0.1 -0.995 37.5-138.0-147.0 146.0 -39.4 -23.4 12.5 86 100 A S > - 0 0 6 -9,-1.8 4,-1.4 -2,-0.3 -9,-0.1 -0.263 31.0-107.2 -95.7-175.6 -40.1 -24.1 16.2 87 101 A N H > S+ 0 0 122 2,-0.2 4,-1.3 1,-0.2 -10,-0.1 0.783 126.0 54.4 -78.9 -31.1 -38.6 -22.8 19.4 88 102 A K H > S+ 0 0 92 -12,-0.5 4,-1.1 1,-0.2 -1,-0.2 0.819 107.5 51.3 -69.9 -31.1 -37.1 -26.3 19.7 89 103 A G H > S+ 0 0 0 -13,-0.3 4,-2.0 -12,-0.2 -2,-0.2 0.863 100.7 60.4 -74.6 -37.4 -35.7 -25.7 16.2 90 104 A K H X S+ 0 0 135 -4,-1.4 4,-2.6 1,-0.2 -2,-0.2 0.903 102.1 54.0 -56.3 -43.5 -34.1 -22.4 17.2 91 105 A K H X S+ 0 0 122 -4,-1.3 4,-3.4 2,-0.2 5,-0.2 0.934 106.8 50.9 -56.2 -51.7 -32.0 -24.1 19.8 92 106 A Y H X S+ 0 0 0 -4,-1.1 4,-4.1 2,-0.2 -2,-0.2 0.964 111.6 46.1 -50.9 -61.6 -30.5 -26.6 17.4 93 107 A I H X S+ 0 0 24 -4,-2.0 4,-4.2 2,-0.2 5,-0.3 0.907 112.9 50.9 -49.6 -48.5 -29.5 -23.9 14.8 94 108 A K H X S+ 0 0 128 -4,-2.6 4,-2.8 2,-0.2 -1,-0.2 0.968 113.7 43.8 -54.0 -54.5 -28.0 -21.9 17.6 95 109 A E H X S+ 0 0 73 -4,-3.4 4,-1.6 1,-0.2 -2,-0.2 0.915 115.1 51.1 -57.8 -41.5 -26.1 -24.9 18.8 96 110 A R H X S+ 0 0 20 -4,-4.1 4,-2.4 -5,-0.2 3,-0.3 0.958 110.8 47.1 -59.3 -52.5 -25.2 -25.6 15.2 97 111 A K H X S+ 0 0 37 -4,-4.2 4,-3.0 1,-0.2 5,-0.3 0.875 105.8 59.2 -57.9 -40.5 -24.0 -22.1 14.6 98 112 A A H X S+ 0 0 56 -4,-2.8 4,-2.0 -5,-0.3 -1,-0.2 0.909 111.0 41.9 -54.9 -44.3 -21.9 -22.1 17.7 99 113 A I H X S+ 0 0 47 -4,-1.6 4,-1.7 -3,-0.3 5,-0.2 0.943 115.2 48.2 -69.7 -49.5 -20.0 -25.1 16.4 100 114 A M H X S+ 0 0 15 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.899 116.1 44.6 -58.3 -43.5 -19.6 -23.8 12.9 101 115 A S H X S+ 0 0 20 -4,-3.0 4,-2.9 2,-0.2 5,-0.3 0.938 107.5 53.6 -69.3 -53.4 -18.5 -20.4 13.9 102 116 A H H X S+ 0 0 134 -4,-2.0 4,-2.5 -5,-0.3 -1,-0.2 0.923 116.8 40.6 -48.0 -49.1 -16.0 -21.3 16.6 103 117 A I H < S+ 0 0 29 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.864 114.9 50.7 -68.2 -40.2 -14.1 -23.6 14.2 104 118 A A H < S+ 0 0 26 -4,-1.8 4,-0.3 -5,-0.2 -1,-0.2 0.793 113.9 45.9 -69.2 -32.8 -14.5 -21.2 11.2 105 119 A S H >X S+ 0 0 57 -4,-2.9 3,-2.8 2,-0.2 4,-2.7 0.973 109.6 51.6 -72.4 -59.7 -13.1 -18.4 13.2 106 120 A D T 3< S+ 0 0 114 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.535 113.9 50.0 -54.7 -3.8 -10.2 -20.4 14.7 107 121 A M T 34 S+ 0 0 24 -4,-0.2 -1,-0.3 -5,-0.1 -2,-0.2 0.495 118.7 32.9-112.9 -11.0 -9.5 -21.3 11.1 108 122 A T T X4 S+ 0 0 42 -3,-2.8 3,-2.1 -4,-0.3 -2,-0.2 0.548 87.2 102.6-121.4 -10.9 -9.6 -17.8 9.6 109 123 A S T 3< S+ 0 0 89 -4,-2.7 -3,-0.1 1,-0.3 -1,-0.1 0.489 76.7 54.7 -54.5 -12.8 -8.2 -15.8 12.5 110 124 A D T 3 S+ 0 0 98 -3,-0.1 -1,-0.3 2,-0.1 2,-0.1 0.474 90.1 98.7-100.6 -3.2 -4.6 -15.3 11.2 111 125 A F S < S- 0 0 32 -3,-2.1 2,-0.6 1,-0.1 -3,-0.1 -0.343 81.1-107.8 -81.3 163.5 -5.8 -13.8 7.9 112 126 A D >> - 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