==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 12-DEC-11 4ABZ . COMPND 2 MOLECULE: TETRACYCLINE REPRESSOR CLASS D; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR G.VOLKERS,W.HINRICHS . 196 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12499.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 137 69.9 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 . 2 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 17 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 116 59.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.0 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 1 0 1 1 0 1 0 0 1 0 0 1 1 0 1 1 0 0 1 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 99 0, 0.0 2,-0.1 0, 0.0 32,-0.1 0.000 360.0 360.0 360.0-174.2 11.1 20.6 6.8 2 3 A R - 0 0 167 1,-0.1 0, 0.0 5,-0.0 0, 0.0 -0.466 360.0-162.9 -74.4 145.3 8.8 22.5 9.1 3 4 A L + 0 0 24 -2,-0.1 -1,-0.1 4,-0.1 30,-0.0 -0.034 37.0 133.8-124.2 28.1 10.0 26.1 9.9 4 5 A N S > S- 0 0 52 1,-0.1 4,-2.3 4,-0.0 3,-0.2 -0.337 75.4 -95.2 -64.1 166.5 8.0 27.1 13.0 5 6 A R H > S+ 0 0 146 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.881 123.6 51.8 -51.6 -43.5 10.2 28.8 15.6 6 7 A E H > S+ 0 0 119 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.895 111.1 46.1 -69.3 -40.7 10.7 25.6 17.6 7 8 A S H > S+ 0 0 33 2,-0.2 4,-2.6 -3,-0.2 -1,-0.2 0.874 110.9 52.4 -69.4 -36.8 11.8 23.5 14.6 8 9 A V H X S+ 0 0 9 -4,-2.3 4,-2.9 2,-0.2 5,-0.2 0.979 112.6 45.7 -64.2 -49.3 14.2 26.2 13.4 9 10 A I H X S+ 0 0 6 -4,-2.6 4,-2.6 1,-0.2 5,-0.2 0.896 111.1 53.4 -58.5 -41.2 15.8 26.4 16.9 10 11 A D H X S+ 0 0 62 -4,-2.3 4,-2.0 -5,-0.2 -1,-0.2 0.943 111.3 45.0 -58.5 -51.5 15.9 22.6 17.0 11 12 A A H X S+ 0 0 9 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.913 113.3 51.1 -59.5 -48.1 17.8 22.5 13.7 12 13 A A H X S+ 0 0 0 -4,-2.9 4,-2.3 2,-0.2 -1,-0.2 0.859 109.7 48.5 -60.0 -36.9 20.1 25.3 14.8 13 14 A L H X S+ 0 0 4 -4,-2.6 4,-1.9 -5,-0.2 -1,-0.2 0.910 111.6 50.4 -71.1 -36.9 21.1 23.7 18.1 14 15 A E H X S+ 0 0 107 -4,-2.0 4,-1.1 -5,-0.2 -2,-0.2 0.918 112.8 46.3 -65.1 -43.1 21.8 20.4 16.3 15 16 A L H X S+ 0 0 6 -4,-2.4 4,-2.9 2,-0.2 5,-0.4 0.889 107.4 58.1 -64.4 -44.2 24.0 22.3 13.8 16 17 A L H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.922 105.8 48.9 -48.4 -48.0 25.7 24.1 16.7 17 18 A N H < S+ 0 0 76 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.834 115.5 47.0 -63.3 -29.9 26.7 20.7 18.1 18 19 A E H < S+ 0 0 108 -4,-1.1 -2,-0.2 -3,-0.2 -1,-0.2 0.851 129.9 13.6 -75.7 -43.1 28.0 19.8 14.6 19 20 A T H X S- 0 0 32 -4,-2.9 4,-0.5 1,-0.2 -3,-0.2 0.722 93.4-123.8-114.5 -27.6 30.0 22.9 13.7 20 21 A G H X - 0 0 1 -4,-2.3 4,-0.8 -5,-0.4 -1,-0.2 -0.245 42.7 -72.2 86.8 168.5 30.6 25.1 16.7 21 22 A I H 4 S+ 0 0 19 2,-0.2 3,-0.5 1,-0.2 -1,-0.1 0.896 131.4 53.3 -67.3 -40.9 29.7 28.8 17.0 22 23 A D H 4 S+ 0 0 131 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.1 0.943 115.7 39.0 -64.6 -42.5 32.3 30.0 14.6 23 24 A G H < S+ 0 0 20 -4,-0.5 2,-0.4 -7,-0.1 -1,-0.2 0.472 87.3 109.8 -89.4 -4.4 31.2 27.5 11.8 24 25 A L < + 0 0 0 -4,-0.8 2,-0.3 -3,-0.5 3,-0.1 -0.620 47.0 167.4 -67.2 123.3 27.5 27.9 12.4 25 26 A T > - 0 0 51 -2,-0.4 4,-1.9 1,-0.1 5,-0.1 -0.966 49.6-122.2-135.6 157.8 26.1 29.8 9.4 26 27 A T H > S+ 0 0 43 -2,-0.3 4,-3.0 1,-0.2 5,-0.2 0.899 114.5 59.4 -65.4 -35.2 22.7 30.5 8.0 27 28 A R H > S+ 0 0 148 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.938 108.8 43.0 -54.8 -45.8 23.8 28.8 4.8 28 29 A K H > S+ 0 0 81 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.827 111.9 55.1 -74.7 -24.1 24.5 25.6 6.7 29 30 A L H X S+ 0 0 0 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.949 106.7 50.1 -70.4 -40.7 21.2 26.1 8.6 30 31 A A H X>S+ 0 0 2 -4,-3.0 5,-2.5 1,-0.2 4,-0.5 0.926 110.5 50.6 -62.2 -45.5 19.3 26.3 5.3 31 32 A Q H ><5S+ 0 0 139 -4,-2.0 3,-1.4 -5,-0.2 -1,-0.2 0.927 109.1 50.1 -56.0 -46.9 21.0 23.1 4.0 32 33 A K H 3<5S+ 0 0 67 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.857 112.4 48.0 -64.5 -35.4 20.1 21.2 7.2 33 34 A L H 3<5S- 0 0 8 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.419 113.1-120.6 -82.4 -6.3 16.5 22.3 7.0 34 35 A G T <<5S+ 0 0 67 -3,-1.4 2,-0.3 -4,-0.5 -3,-0.2 0.805 72.9 116.6 72.5 35.4 16.4 21.3 3.3 35 36 A I < - 0 0 30 -5,-2.5 -1,-0.3 -6,-0.1 2,-0.2 -0.861 68.3-101.8-130.7 161.6 15.5 24.8 2.2 36 37 A E >> - 0 0 147 -2,-0.3 4,-1.8 -3,-0.1 3,-0.8 -0.530 38.0-111.8 -76.1 149.9 16.9 27.7 0.1 37 38 A Q H 3> S+ 0 0 86 1,-0.3 4,-2.1 2,-0.2 -1,-0.1 0.858 114.1 53.9 -55.1 -42.0 18.6 30.7 1.9 38 39 A P H 3> S+ 0 0 100 0, 0.0 4,-1.2 0, 0.0 -1,-0.3 0.868 106.0 54.4 -68.5 -24.7 15.9 33.3 1.0 39 40 A T H X> S+ 0 0 65 -3,-0.8 4,-0.8 1,-0.2 3,-0.6 0.961 109.1 48.2 -62.1 -50.7 13.2 31.0 2.6 40 41 A L H >X S+ 0 0 4 -4,-1.8 4,-2.4 1,-0.2 3,-1.2 0.878 103.3 62.8 -51.7 -43.0 15.3 30.9 5.8 41 42 A Y H 3< S+ 0 0 143 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.815 95.4 59.0 -58.0 -37.0 15.7 34.7 5.7 42 43 A W H << S+ 0 0 190 -4,-1.2 -1,-0.3 -3,-0.6 -2,-0.2 0.858 117.1 34.2 -53.3 -38.7 11.9 35.1 6.0 43 44 A H H << S+ 0 0 74 -3,-1.2 2,-0.4 -4,-0.8 -2,-0.2 0.794 131.9 19.5 -91.0 -33.4 12.2 33.1 9.3 44 45 A V < - 0 0 18 -4,-2.4 -1,-0.3 1,-0.1 3,-0.1 -0.963 64.6-155.2-147.4 115.0 15.6 34.2 10.8 45 46 A K - 0 0 103 -2,-0.4 2,-0.3 -3,-0.2 -1,-0.1 0.848 63.8 -34.4 -71.4 -36.0 17.2 37.4 9.6 46 47 A N > - 0 0 79 1,-0.1 4,-2.0 -20,-0.0 -1,-0.1 -0.952 69.6 -74.9-168.0-176.4 20.9 36.7 10.3 47 48 A K H > S+ 0 0 66 -2,-0.3 4,-2.8 1,-0.2 5,-0.3 0.900 121.7 54.6 -65.5 -43.0 23.4 35.0 12.6 48 49 A R H > S+ 0 0 196 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.946 109.7 46.4 -56.8 -48.5 23.2 37.5 15.4 49 50 A A H > S+ 0 0 45 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.918 113.5 51.2 -65.8 -37.4 19.4 37.1 15.6 50 51 A L H X S+ 0 0 6 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.958 111.7 44.8 -56.3 -54.9 19.8 33.4 15.6 51 52 A L H X S+ 0 0 30 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.851 110.3 55.0 -62.8 -37.0 22.4 33.3 18.4 52 53 A D H X S+ 0 0 80 -4,-2.5 4,-1.3 -5,-0.3 -1,-0.2 0.893 111.2 46.0 -61.6 -41.9 20.4 35.7 20.5 53 54 A A H X S+ 0 0 23 -4,-1.8 4,-2.5 -5,-0.2 -2,-0.2 0.908 111.6 50.1 -69.1 -44.6 17.4 33.3 20.2 54 55 A L H X S+ 0 0 0 -4,-2.7 4,-3.6 1,-0.2 5,-0.3 0.926 105.5 57.3 -55.0 -51.5 19.5 30.2 21.0 55 56 A A H X S+ 0 0 5 -4,-2.4 4,-1.0 43,-0.2 -1,-0.2 0.873 112.0 42.6 -47.1 -44.2 21.0 31.8 24.1 56 57 A V H X S+ 0 0 11 -4,-1.3 4,-2.5 2,-0.2 -1,-0.2 0.895 115.9 46.7 -72.3 -41.9 17.4 32.4 25.4 57 58 A E H X S+ 0 0 40 -4,-2.5 4,-3.1 2,-0.2 5,-0.3 0.832 104.4 59.3 -74.9 -33.9 16.1 29.0 24.4 58 59 A I H X S+ 0 0 7 -4,-3.6 4,-2.6 2,-0.2 5,-0.4 0.952 113.5 40.7 -56.3 -44.1 19.0 26.9 25.8 59 60 A L H X S+ 0 0 22 -4,-1.0 4,-2.1 -5,-0.3 -2,-0.2 0.936 115.3 50.4 -71.1 -41.7 18.2 28.5 29.2 60 61 A A H < S+ 0 0 74 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.894 119.8 37.2 -60.5 -39.7 14.4 28.2 28.7 61 62 A R H < S+ 0 0 91 -4,-3.1 -2,-0.2 -5,-0.1 -1,-0.2 0.871 134.6 15.6 -77.3 -37.3 14.8 24.5 27.8 62 63 A H H < S+ 0 0 37 -4,-2.6 2,-1.1 -5,-0.3 -3,-0.2 0.508 97.3 85.9-128.9 -8.3 17.6 23.4 30.1 63 64 A H < + 0 0 17 -4,-2.1 3,-0.4 -5,-0.4 22,-0.1 -0.809 48.1 165.5 -95.2 94.0 18.3 25.8 33.0 64 65 A D + 0 0 120 -2,-1.1 3,-0.2 1,-0.2 -1,-0.1 0.328 58.3 64.9-100.2 15.3 15.8 24.5 35.3 65 66 A Y + 0 0 59 16,-0.2 -1,-0.2 1,-0.1 20,-0.2 -0.310 55.4 126.0-125.4 50.2 16.9 26.2 38.6 66 67 A S S S+ 0 0 30 -3,-0.4 -1,-0.1 -7,-0.1 49,-0.1 0.704 72.2 47.7 -71.3 -26.5 16.2 29.8 37.7 67 68 A L S S- 0 0 84 -3,-0.2 45,-0.0 47,-0.0 44,-0.0 -0.915 87.8-109.1-123.9 147.4 14.1 30.2 40.8 68 69 A P - 0 0 32 0, 0.0 2,-0.1 0, 0.0 3,-0.1 -0.355 33.9-114.3 -72.7 152.0 14.4 29.3 44.5 69 70 A A > - 0 0 53 1,-0.2 3,-2.1 4,-0.1 8,-0.1 -0.455 51.9 -74.7 -72.4 159.8 12.4 26.6 46.1 70 71 A A T 3 S+ 0 0 110 1,-0.3 -1,-0.2 -2,-0.1 0, 0.0 -0.329 120.4 4.7 -53.1 130.0 9.8 27.6 48.8 71 72 A G T 3 S+ 0 0 89 1,-0.2 -1,-0.3 -3,-0.1 2,-0.2 0.549 92.7 153.0 72.6 9.3 11.8 28.4 51.9 72 73 A E < - 0 0 25 -3,-2.1 -1,-0.2 1,-0.1 2,-0.0 -0.501 45.6-116.5 -75.9 140.8 15.2 27.9 50.4 73 74 A S > - 0 0 54 -2,-0.2 4,-2.3 1,-0.1 5,-0.1 -0.268 21.4-118.9 -62.4 155.5 18.2 29.9 51.8 74 75 A W H > S+ 0 0 13 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.888 114.1 54.2 -64.5 -34.4 19.9 32.4 49.6 75 76 A Q H > S+ 0 0 40 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.949 111.0 44.7 -60.4 -49.2 23.2 30.4 49.8 76 77 A S H > S+ 0 0 31 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.917 112.4 52.3 -66.6 -42.1 21.5 27.2 48.6 77 78 A F H X S+ 0 0 0 -4,-2.3 4,-3.0 1,-0.2 5,-0.3 0.951 109.0 47.8 -61.3 -50.2 19.7 29.0 45.9 78 79 A L H X S+ 0 0 1 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.882 113.8 50.2 -58.0 -39.2 22.8 30.7 44.5 79 80 A R H X S+ 0 0 72 -4,-2.1 4,-2.3 -5,-0.2 5,-0.2 0.968 115.2 40.9 -60.4 -52.0 24.5 27.3 44.6 80 81 A N H X S+ 0 0 42 -4,-3.1 4,-2.1 1,-0.2 -2,-0.2 0.902 115.4 51.2 -64.1 -39.8 21.7 25.4 42.8 81 82 A N H X S+ 0 0 16 -4,-3.0 4,-3.0 -5,-0.3 -1,-0.2 0.938 110.8 49.0 -66.4 -43.2 21.2 28.2 40.3 82 83 A A H X S+ 0 0 0 -4,-2.4 4,-2.9 -5,-0.3 5,-0.2 0.917 111.2 47.8 -63.0 -48.7 24.9 28.3 39.5 83 84 A M H X S+ 0 0 61 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.878 114.3 49.0 -59.5 -36.7 25.2 24.6 38.9 84 85 A S H X S+ 0 0 0 -4,-2.1 4,-2.5 -5,-0.2 -2,-0.2 0.940 110.7 48.7 -70.0 -46.6 22.0 24.8 36.8 85 86 A F H X S+ 0 0 15 -4,-3.0 4,-2.2 2,-0.2 -2,-0.2 0.937 113.3 48.9 -54.4 -50.3 23.4 27.7 34.8 86 87 A R H X S+ 0 0 16 -4,-2.9 4,-2.7 2,-0.2 -2,-0.2 0.937 111.1 48.9 -57.5 -49.2 26.7 25.7 34.3 87 88 A R H X S+ 0 0 129 -4,-2.5 4,-0.9 1,-0.2 -1,-0.2 0.961 111.2 49.1 -55.0 -52.7 25.0 22.6 33.1 88 89 A A H >< S+ 0 0 1 -4,-2.5 3,-0.5 1,-0.2 4,-0.4 0.868 111.9 49.1 -59.7 -40.0 22.8 24.4 30.7 89 90 A L H >< S+ 0 0 3 -4,-2.2 3,-0.8 1,-0.2 6,-0.3 0.896 111.1 50.2 -62.9 -44.1 25.9 26.2 29.2 90 91 A L H 3< S+ 0 0 46 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.580 89.7 82.9 -68.2 -13.4 27.8 23.0 28.9 91 92 A R T << S+ 0 0 142 -4,-0.9 2,-0.4 -3,-0.5 -1,-0.2 0.796 93.0 43.5 -71.1 -26.4 25.0 21.2 27.1 92 93 A Y S X S- 0 0 20 -3,-0.8 3,-2.3 -4,-0.4 4,-0.2 -0.941 96.1 -98.7-121.3 146.0 25.9 22.6 23.7 93 94 A R T 3 S+ 0 0 116 -2,-0.4 -73,-0.1 1,-0.3 -74,-0.1 -0.291 113.0 5.1 -55.6 133.1 29.2 23.0 22.0 94 95 A D T 3> S+ 0 0 23 54,-0.1 4,-1.8 -74,-0.1 -1,-0.3 0.732 88.7 150.5 58.3 27.6 30.4 26.6 22.4 95 96 A G H <> + 0 0 4 -3,-2.3 4,-1.4 -6,-0.3 -5,-0.2 0.857 67.0 48.6 -61.0 -37.4 27.3 27.1 24.6 96 97 A A H > S+ 0 0 0 -4,-0.2 4,-2.6 1,-0.2 -1,-0.3 0.864 107.8 53.5 -72.1 -37.5 29.0 29.8 26.8 97 98 A K H 4 S+ 0 0 60 -3,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.826 107.7 53.0 -63.6 -32.6 30.2 31.7 23.8 98 99 A V H < S+ 0 0 5 -4,-1.8 -43,-0.2 1,-0.2 -2,-0.2 0.847 113.0 44.1 -66.9 -36.4 26.5 31.7 22.6 99 100 A H H >< S+ 0 0 30 -4,-1.4 3,-2.2 -5,-0.2 -2,-0.2 0.881 91.1 103.0 -75.4 -39.8 25.4 33.1 25.9 100 101 A L T 3< S+ 0 0 101 -4,-2.6 3,-0.1 1,-0.3 -45,-0.1 -0.091 87.6 15.7 -51.4 127.1 28.2 35.7 26.2 101 102 A G T 3 S+ 0 0 77 1,-0.3 -1,-0.3 0, 0.0 -2,-0.1 0.183 94.3 124.5 98.9 -18.0 27.1 39.2 25.4 102 103 A T < - 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