==== 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 TRANSCRIPTION 30-JAN-08 3C57 . COMPND 2 MOLECULE: TWO COMPONENT TRANSCRIPTIONAL REGULATORY PROTEIN . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR G.WISEDCHAISRI,M.WU,D.R.SHERMAN,W.G.J.HOL . 100 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7021.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 66 66.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 5 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 56 56.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 4.0 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 0 2 0 0 2 0 0 0 2 0 0 0 0 0 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 1 149 A G 0 0 81 0, 0.0 64,-0.2 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0-170.0 37.0 -1.2 27.7 2 150 A L - 0 0 26 62,-2.0 2,-0.1 1,-0.1 62,-0.0 -0.486 360.0-116.0 -87.1 157.1 40.0 1.0 28.2 3 151 A T > - 0 0 76 -2,-0.1 4,-2.6 1,-0.1 5,-0.2 -0.390 36.4 -98.9 -79.7 169.1 42.9 0.4 30.6 4 152 A D H > S+ 0 0 78 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.905 122.7 48.2 -55.4 -48.8 43.6 2.7 33.6 5 153 A Q H > S+ 0 0 74 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.914 112.9 48.8 -62.6 -42.6 46.4 4.7 31.8 6 154 A E H > S+ 0 0 17 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.902 109.9 52.2 -60.9 -43.6 44.3 5.1 28.7 7 155 A R H X S+ 0 0 110 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.905 108.6 50.6 -61.1 -42.3 41.4 6.3 30.8 8 156 A T H X S+ 0 0 87 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.940 111.7 47.1 -59.8 -47.9 43.7 8.9 32.5 9 157 A L H X S+ 0 0 13 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.922 110.4 52.6 -59.6 -44.5 44.8 10.2 29.1 10 158 A L H X S+ 0 0 10 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.894 106.8 54.5 -60.9 -37.8 41.2 10.3 27.9 11 159 A G H X S+ 0 0 27 -4,-2.4 4,-1.3 1,-0.2 -1,-0.2 0.918 108.8 47.3 -57.9 -46.9 40.4 12.4 31.0 12 160 A L H <>S+ 0 0 11 -4,-2.0 5,-1.9 1,-0.2 4,-0.5 0.879 112.0 49.6 -66.4 -38.8 43.1 14.9 30.1 13 161 A L H ><5S+ 0 0 19 -4,-2.3 3,-1.3 1,-0.2 -1,-0.2 0.907 108.3 54.1 -63.2 -39.2 41.9 15.1 26.5 14 162 A S H 3<5S+ 0 0 57 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.802 104.5 55.0 -66.7 -27.7 38.3 15.6 27.7 15 163 A E T 3<5S- 0 0 122 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.572 118.2-114.6 -80.1 -14.1 39.6 18.5 29.8 16 164 A G T < 5 + 0 0 31 -3,-1.3 82,-0.4 -4,-0.5 -3,-0.2 0.626 56.5 160.7 90.9 14.3 41.0 20.1 26.7 17 165 A L < - 0 0 25 -5,-1.9 -1,-0.2 1,-0.1 -2,-0.0 -0.447 38.4-120.7 -68.8 142.2 44.7 19.9 27.6 18 166 A T > - 0 0 21 -2,-0.1 4,-2.6 1,-0.1 5,-0.2 -0.313 26.8-105.1 -72.0 165.1 47.2 20.2 24.7 19 167 A N H > S+ 0 0 25 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.888 124.5 52.2 -56.0 -40.2 49.7 17.4 23.9 20 168 A K H > S+ 0 0 62 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.913 109.2 48.0 -62.4 -44.5 52.4 19.7 25.4 21 169 A Q H > S+ 0 0 74 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.900 113.3 48.3 -63.1 -39.9 50.4 20.2 28.6 22 170 A I H X S+ 0 0 0 -4,-2.6 4,-1.8 2,-0.2 -2,-0.2 0.925 110.3 51.6 -66.2 -42.0 49.8 16.5 28.9 23 171 A A H X>S+ 0 0 1 -4,-2.7 5,-2.2 1,-0.2 4,-1.0 0.895 110.0 49.9 -61.7 -40.7 53.5 15.7 28.3 24 172 A D H <5S+ 0 0 108 -4,-2.3 3,-0.4 1,-0.2 -1,-0.2 0.901 111.0 48.1 -66.2 -37.6 54.4 18.1 31.0 25 173 A R H <5S+ 0 0 146 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.769 119.6 39.9 -70.6 -27.8 52.0 16.6 33.5 26 174 A M H <5S- 0 0 58 -4,-1.8 -1,-0.2 2,-0.1 -2,-0.2 0.414 105.1-122.2-103.8 -0.2 53.3 13.1 32.6 27 175 A F T <5S+ 0 0 187 -4,-1.0 2,-0.3 -3,-0.4 -3,-0.2 0.915 70.8 128.4 57.0 43.6 57.0 13.8 32.3 28 176 A L < - 0 0 68 -5,-2.2 -1,-0.2 -6,-0.1 2,-0.1 -0.843 67.6 -94.2-122.3 161.1 57.0 12.5 28.7 29 177 A A > - 0 0 57 -2,-0.3 4,-2.0 1,-0.1 3,-0.2 -0.476 33.5-122.8 -67.3 145.0 58.1 13.9 25.4 30 178 A E H > S+ 0 0 87 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.892 113.9 54.9 -56.7 -39.0 55.4 15.7 23.4 31 179 A K H > S+ 0 0 139 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.880 105.2 52.8 -64.3 -35.8 56.0 13.2 20.5 32 180 A T H > S+ 0 0 55 -3,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.932 110.1 48.1 -61.8 -45.8 55.4 10.3 22.9 33 181 A V H X S+ 0 0 2 -4,-2.0 4,-2.9 1,-0.2 5,-0.3 0.933 108.0 55.1 -61.7 -42.8 52.1 11.8 23.9 34 182 A K H X S+ 0 0 107 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.921 110.1 46.4 -57.2 -44.4 51.2 12.4 20.3 35 183 A N H X S+ 0 0 95 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.910 112.0 49.6 -66.3 -42.8 51.7 8.7 19.6 36 184 A Y H X S+ 0 0 107 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.903 112.4 48.6 -59.0 -42.3 49.7 7.6 22.7 37 185 A V H X S+ 0 0 12 -4,-2.9 4,-3.0 1,-0.2 5,-0.3 0.912 109.9 51.9 -66.9 -41.6 46.8 9.9 21.7 38 186 A S H X S+ 0 0 66 -4,-2.6 4,-2.0 -5,-0.3 -1,-0.2 0.907 112.0 45.8 -60.5 -43.0 46.9 8.6 18.1 39 187 A R H X S+ 0 0 135 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.923 113.9 49.6 -65.8 -43.7 46.7 5.0 19.4 40 188 A L H X S+ 0 0 2 -4,-2.6 4,-2.5 2,-0.2 5,-0.2 0.945 111.4 47.0 -62.0 -49.0 43.9 5.8 21.9 41 189 A L H X S+ 0 0 30 -4,-3.0 4,-1.5 1,-0.2 -1,-0.2 0.898 110.7 53.4 -63.7 -36.3 41.8 7.7 19.3 42 190 A A H < S+ 0 0 61 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.921 109.5 48.6 -60.1 -42.5 42.3 4.8 16.9 43 191 A K H >< S+ 0 0 102 -4,-2.3 3,-1.5 1,-0.2 -2,-0.2 0.900 110.2 50.2 -63.0 -45.3 41.0 2.3 19.6 44 192 A L H 3< S+ 0 0 11 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.788 104.2 61.9 -61.8 -28.5 38.0 4.5 20.3 45 193 A G T 3< S+ 0 0 48 -4,-1.5 2,-0.3 -5,-0.2 -1,-0.3 0.460 100.1 65.5 -77.4 -4.5 37.3 4.6 16.6 46 194 A M < - 0 0 145 -3,-1.5 2,-0.3 -4,-0.2 0, 0.0 -0.836 62.1-168.0-117.8 157.3 36.8 0.8 16.5 47 195 A E - 0 0 87 -2,-0.3 2,-0.1 21,-0.0 21,-0.1 -0.951 36.0 -85.4-139.3 160.0 34.2 -1.5 18.0 48 196 A R - 0 0 121 18,-0.4 18,-0.0 -2,-0.3 0, 0.0 -0.389 30.1-167.7 -63.7 139.0 33.9 -5.3 18.5 49 197 A R + 0 0 238 -2,-0.1 2,-0.2 19,-0.1 -1,-0.1 0.487 63.4 60.9-101.2 -3.0 32.4 -7.1 15.5 50 198 A T 0 0 115 1,-0.2 -2,-0.0 0, 0.0 0, 0.0 -0.663 360.0 360.0-124.2 175.8 31.8 -10.4 17.2 51 199 A Q 0 0 170 -2,-0.2 -1,-0.2 0, 0.0 -3,-0.0 0.988 360.0 360.0 -71.2 360.0 29.8 -11.9 20.1 52 !* 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 53 151 B T > 0 0 89 0, 0.0 4,-2.5 0, 0.0 3,-0.5 0.000 360.0 360.0 360.0 125.7 30.0 19.3 26.4 54 152 B D H > + 0 0 129 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.807 360.0 53.8 -63.7 -31.6 28.2 17.0 28.8 55 153 B Q H > S+ 0 0 68 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.860 113.0 44.9 -69.4 -33.8 26.3 15.0 26.0 56 154 B E H > S+ 0 0 22 -3,-0.5 4,-2.6 2,-0.2 -2,-0.2 0.882 111.4 52.8 -74.1 -37.7 29.7 14.3 24.4 57 155 B R H X S+ 0 0 104 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.879 108.3 52.1 -61.7 -36.6 31.1 13.5 27.8 58 156 B T H X S+ 0 0 77 -4,-2.2 4,-1.6 2,-0.2 -2,-0.2 0.944 111.0 46.1 -64.0 -48.2 28.3 11.0 28.2 59 157 B L H X S+ 0 0 7 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.912 109.8 54.4 -59.1 -44.9 29.0 9.4 24.9 60 158 B L H X S+ 0 0 15 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.887 104.1 56.2 -59.8 -38.8 32.7 9.2 25.6 61 159 B G H X S+ 0 0 31 -4,-1.9 4,-0.8 1,-0.2 -1,-0.2 0.910 108.8 45.9 -56.3 -46.2 32.0 7.4 28.9 62 160 B L H <>S+ 0 0 27 -4,-1.6 5,-1.6 1,-0.2 3,-0.4 0.878 111.4 51.9 -69.1 -37.9 30.1 4.7 27.1 63 161 B L H ><5S+ 0 0 18 -4,-2.4 3,-1.8 1,-0.2 -1,-0.2 0.903 105.1 56.2 -61.1 -41.1 32.8 4.3 24.4 64 162 B S H 3<5S+ 0 0 7 -4,-2.3 -62,-2.0 1,-0.3 -1,-0.2 0.759 101.6 57.5 -65.4 -24.3 35.4 3.9 27.1 65 163 B E T 3<5S- 0 0 105 -4,-0.8 -1,-0.3 -3,-0.4 -2,-0.2 0.520 117.8-114.2 -81.7 -7.3 33.4 1.0 28.4 66 164 B G T < 5 + 0 0 21 -3,-1.8 -18,-0.4 -4,-0.3 -3,-0.2 0.600 57.4 160.3 86.7 10.7 33.7 -0.7 25.1 67 165 B L < - 0 0 20 -5,-1.6 -1,-0.2 1,-0.1 -2,-0.0 -0.416 38.6-122.3 -63.4 141.6 30.0 -0.6 24.1 68 166 B T > - 0 0 22 1,-0.1 4,-2.5 -2,-0.1 5,-0.2 -0.319 28.0-103.4 -74.0 166.3 29.4 -1.0 20.4 69 167 B N H > S+ 0 0 24 1,-0.2 4,-2.7 2,-0.2 5,-0.1 0.876 124.3 53.0 -57.0 -37.9 27.4 1.6 18.5 70 168 B K H > S+ 0 0 47 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.888 108.9 47.9 -65.2 -40.4 24.3 -0.7 18.6 71 169 B Q H > S+ 0 0 74 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.869 113.6 48.3 -67.5 -37.3 24.6 -1.1 22.4 72 170 B I H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.923 110.7 50.7 -67.6 -44.1 24.9 2.7 22.7 73 171 B A H X>S+ 0 0 4 -4,-2.7 5,-2.1 -5,-0.2 4,-0.9 0.912 111.3 49.1 -57.9 -43.7 21.9 3.2 20.4 74 172 B D H ><5S+ 0 0 128 -4,-2.3 3,-0.6 1,-0.2 -1,-0.2 0.936 111.8 48.0 -60.1 -47.6 19.9 0.8 22.5 75 173 B R H 3<5S+ 0 0 165 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.859 121.4 36.3 -61.8 -37.8 20.9 2.5 25.8 76 174 B M H 3<5S- 0 0 65 -4,-2.4 -1,-0.2 -5,-0.1 -2,-0.2 0.427 104.9-124.7 -96.9 -0.8 20.1 6.0 24.4 77 175 B F T <<5 + 0 0 193 -4,-0.9 2,-0.3 -3,-0.6 -3,-0.2 0.938 67.0 133.0 47.6 53.9 17.1 4.9 22.3 78 176 B L < - 0 0 59 -5,-2.1 -1,-0.2 -6,-0.1 -2,-0.1 -0.873 65.6 -95.3-122.6 156.1 18.7 6.4 19.2 79 177 B A > - 0 0 62 -2,-0.3 4,-1.9 1,-0.1 3,-0.4 -0.447 35.0-120.6 -64.9 146.0 19.1 5.0 15.6 80 178 B E H > S+ 0 0 94 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.892 114.2 57.8 -57.9 -35.2 22.5 3.4 15.1 81 179 B K H > S+ 0 0 95 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.885 103.6 52.5 -65.2 -34.6 23.2 5.8 12.3 82 180 B T H > S+ 0 0 46 -3,-0.4 4,-2.7 2,-0.2 -1,-0.2 0.936 109.1 49.2 -63.0 -47.5 22.7 8.7 14.7 83 181 B V H X S+ 0 0 1 -4,-1.9 4,-2.9 2,-0.2 5,-0.3 0.928 108.7 53.6 -56.6 -45.7 25.2 7.2 17.2 84 182 B K H X S+ 0 0 82 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.925 110.4 47.1 -56.1 -45.9 27.7 6.8 14.3 85 183 B N H X S+ 0 0 76 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.926 113.5 47.7 -61.8 -44.6 27.4 10.5 13.4 86 184 B Y H X S+ 0 0 86 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.906 112.5 48.6 -64.0 -42.5 27.8 11.5 17.1 87 185 B V H X S+ 0 0 11 -4,-2.9 4,-2.7 -5,-0.2 5,-0.3 0.920 109.5 53.3 -63.1 -40.9 30.8 9.3 17.6 88 186 B S H X S+ 0 0 69 -4,-2.3 4,-1.9 -5,-0.3 -2,-0.2 0.932 111.3 45.3 -61.5 -46.6 32.4 10.7 14.4 89 187 B R H X S+ 0 0 123 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.871 113.4 50.3 -62.9 -39.5 31.9 14.3 15.6 90 188 B L H X S+ 0 0 9 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.917 110.8 47.7 -65.6 -45.7 33.3 13.4 19.1 91 189 B L H X S+ 0 0 29 -4,-2.7 4,-1.6 1,-0.2 -1,-0.2 0.895 109.8 53.6 -68.3 -34.9 36.4 11.7 17.9 92 190 B A H < S+ 0 0 64 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.928 110.2 48.2 -62.1 -41.1 37.1 14.6 15.5 93 191 B K H >< S+ 0 0 120 -4,-1.9 3,-1.5 1,-0.2 -2,-0.2 0.909 109.9 50.6 -66.8 -43.2 36.9 17.0 18.4 94 192 B L H 3< S+ 0 0 21 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.802 104.1 61.1 -64.0 -27.8 39.2 14.9 20.6 95 193 B G T 3< S+ 0 0 50 -4,-1.6 2,-0.3 -5,-0.2 -1,-0.3 0.406 98.2 70.9 -80.7 1.7 41.7 14.8 17.7 96 194 B M < - 0 0 141 -3,-1.5 2,-0.3 -4,-0.1 0, 0.0 -0.840 61.7-169.8-114.4 153.3 42.1 18.6 17.8 97 195 B E - 0 0 87 -2,-0.3 2,-0.1 -79,-0.0 -79,-0.1 -0.950 35.9 -84.8-137.2 160.1 43.8 20.8 20.4 98 196 B R - 0 0 117 -82,-0.4 -82,-0.0 -2,-0.3 -80,-0.0 -0.388 29.7-167.9 -61.4 136.9 44.0 24.5 21.0 99 197 B R + 0 0 238 -2,-0.1 2,-0.2 -81,-0.1 -1,-0.1 0.512 62.0 71.4 -93.9 -13.7 46.6 26.4 19.0 100 198 B T 0 0 108 1,-0.2 -2,-0.0 0, 0.0 0, 0.0 -0.581 360.0 360.0-115.8 172.4 46.5 29.6 20.9 101 199 B Q 0 0 165 -2,-0.2 -1,-0.2 0, 0.0 -3,-0.0 0.677 360.0 360.0 -75.6 360.0 47.4 31.1 24.2