==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DNA BINDING PROTEIN 10-DEC-12 4ICG . COMPND 2 MOLECULE: GLOBAL DNA-BINDING TRANSCRIPTIONAL DUAL REGULATOR . SOURCE 2 ORGANISM_SCIENTIFIC: SALMONELLA ENTERICA SUBSP. ENTERICA SE . AUTHOR S.S.ALI,J.C.WHITNEY,J.STEVENSON,H.ROBINSON,P.L.HOWELL,W.W.NA . 223 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12099.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 163 73.1 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 . 8 3.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 122 54.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 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 0 0 0 2 2 0 1 0 1 0 0 2 0 0 0 0 1 1 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 3 B E 0 0 69 0, 0.0 3,-0.4 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0-106.3 -54.1 6.3 51.6 2 4 B A + 0 0 67 1,-0.2 3,-0.4 2,-0.1 4,-0.2 0.391 360.0 74.1 -88.2 0.2 -54.3 10.1 51.9 3 5 B L S > S+ 0 0 7 125,-0.2 3,-1.9 1,-0.2 4,-0.3 0.795 81.8 71.0 -74.5 -31.6 -57.1 9.9 54.5 4 6 B K G > S+ 0 0 33 -3,-0.4 3,-1.0 1,-0.3 -1,-0.2 0.652 80.5 73.4 -62.4 -19.5 -54.4 8.8 57.0 5 7 B I G 3 S+ 0 0 55 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.788 85.2 67.3 -65.2 -26.6 -53.0 12.3 57.1 6 8 B L G < S+ 0 0 27 -3,-1.9 2,-2.8 1,-0.2 -1,-0.2 0.706 71.9 92.0 -69.9 -20.3 -56.0 13.4 59.1 7 9 B N < + 0 0 8 -3,-1.0 2,-0.4 -4,-0.3 -1,-0.2 -0.148 63.1 100.7 -71.6 48.1 -55.1 11.3 62.1 8 10 B N > - 0 0 2 -2,-2.8 4,-2.7 1,-0.1 5,-0.2 -0.903 59.8-158.3-139.2 108.2 -53.2 14.3 63.6 9 11 B I H > S+ 0 0 0 -2,-0.4 4,-1.8 1,-0.3 -1,-0.1 0.796 94.2 47.2 -60.5 -35.4 -55.0 16.2 66.3 10 12 B R H > S+ 0 0 122 2,-0.2 4,-1.9 1,-0.2 -1,-0.3 0.914 117.0 43.2 -70.0 -44.6 -53.0 19.4 65.8 11 13 B T H > S+ 0 0 63 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.740 108.6 60.1 -74.0 -23.7 -53.4 19.3 62.0 12 14 B L H X S+ 0 0 8 -4,-2.7 4,-1.1 2,-0.2 -1,-0.2 0.960 107.4 45.0 -67.4 -46.8 -57.0 18.4 62.5 13 15 B R H X S+ 0 0 52 -4,-1.8 4,-1.2 2,-0.2 -2,-0.2 0.899 112.2 53.5 -60.1 -44.7 -57.5 21.7 64.4 14 16 B A H >X S+ 0 0 55 -4,-1.9 3,-1.8 1,-0.2 4,-0.7 0.987 112.2 40.0 -55.4 -65.2 -55.6 23.6 61.8 15 17 B Q H 3< S+ 0 0 10 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.683 111.8 63.6 -59.8 -16.6 -57.5 22.5 58.7 16 18 B A H >< S+ 0 0 5 -4,-1.1 3,-1.1 -5,-0.2 -1,-0.3 0.763 86.4 69.0 -80.0 -28.1 -60.6 22.8 60.9 17 19 B R H << S+ 0 0 122 -3,-1.8 -1,-0.2 -4,-1.2 -2,-0.2 0.908 99.4 49.6 -58.1 -41.9 -60.3 26.5 61.4 18 20 B E T 3< S+ 0 0 106 -4,-0.7 2,-0.4 -3,-0.1 -1,-0.3 0.511 99.8 78.7 -80.0 -5.9 -61.1 27.2 57.7 19 21 B C S < S- 0 0 16 -3,-1.1 2,-0.0 -4,-0.2 0, 0.0 -0.849 82.1-122.3-101.2 145.1 -64.2 25.0 57.7 20 22 B T > - 0 0 76 -2,-0.4 4,-1.7 1,-0.1 3,-0.3 -0.301 24.9-110.4 -76.7 168.3 -67.5 26.2 59.2 21 23 B L H > S+ 0 0 24 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.870 112.2 57.2 -70.1 -38.1 -69.2 24.2 61.9 22 24 B E H > S+ 0 0 135 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.791 109.0 46.7 -68.7 -27.0 -72.2 22.9 59.9 23 25 B T H > S+ 0 0 24 -3,-0.3 4,-2.5 2,-0.2 3,-0.5 0.905 106.6 58.9 -76.5 -43.0 -69.9 21.2 57.5 24 26 B L H X S+ 0 0 0 -4,-1.7 4,-2.5 1,-0.3 -2,-0.2 0.872 103.2 52.3 -51.8 -43.3 -67.8 19.8 60.3 25 27 B E H X S+ 0 0 55 -4,-2.0 4,-2.6 2,-0.2 -1,-0.3 0.865 109.6 50.0 -61.1 -38.3 -70.9 18.0 61.6 26 28 B E H X S+ 0 0 46 -4,-0.8 4,-2.7 -3,-0.5 -2,-0.2 0.923 110.8 47.9 -65.7 -47.4 -71.5 16.5 58.2 27 29 B X H X S+ 0 0 5 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.908 114.3 47.7 -58.4 -45.0 -67.9 15.3 57.9 28 30 B L H X S+ 0 0 5 -4,-2.5 4,-2.9 -5,-0.2 5,-0.3 0.921 112.5 47.5 -63.3 -46.2 -68.1 13.8 61.4 29 31 B E H X S+ 0 0 39 -4,-2.6 4,-1.6 2,-0.2 -2,-0.2 0.871 111.4 52.6 -65.9 -32.0 -71.4 12.2 60.6 30 32 B K H X S+ 0 0 1 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.958 112.6 46.3 -62.2 -49.5 -69.9 10.9 57.4 31 33 B L H X S+ 0 0 3 -4,-2.6 4,-2.6 2,-0.2 5,-0.3 0.899 109.1 49.4 -63.3 -48.2 -67.0 9.4 59.3 32 34 B E H X S+ 0 0 63 -4,-2.9 4,-2.7 1,-0.2 5,-0.2 0.912 109.6 55.0 -63.7 -37.7 -68.9 7.7 62.1 33 35 B V H X S+ 0 0 12 -4,-1.6 4,-1.0 -5,-0.3 -1,-0.2 0.924 109.5 48.3 -56.1 -43.3 -71.1 6.1 59.5 34 36 B V H X S+ 0 0 3 -4,-1.8 4,-0.8 1,-0.2 3,-0.4 0.928 113.8 43.5 -65.3 -46.2 -67.9 4.8 57.9 35 37 B V H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 3,-0.3 0.827 109.8 57.0 -71.8 -30.2 -66.3 3.4 61.0 36 38 B N H X S+ 0 0 70 -4,-2.7 4,-1.3 -5,-0.3 -1,-0.2 0.755 102.6 56.9 -67.0 -23.9 -69.6 1.9 62.2 37 39 B E H X S+ 0 0 48 -4,-1.0 4,-1.1 -3,-0.4 -1,-0.2 0.757 113.2 39.3 -76.0 -27.0 -69.6 0.1 58.9 38 40 B R H X>S+ 0 0 16 -4,-0.8 4,-1.9 -3,-0.3 5,-0.9 0.745 105.7 63.5 -94.2 -26.5 -66.3 -1.4 59.8 39 41 B R H <>S+ 0 0 100 -4,-2.4 5,-1.2 1,-0.2 -2,-0.2 0.903 113.1 38.6 -60.8 -41.5 -67.1 -2.0 63.5 40 42 B E H <5S+ 0 0 147 -4,-1.3 4,-0.2 3,-0.2 -2,-0.2 0.936 123.0 43.5 -70.7 -47.0 -69.7 -4.4 62.3 41 43 B E H <5S+ 0 0 103 -4,-1.1 -2,-0.2 -5,-0.1 -3,-0.2 0.993 126.7 20.6 -63.1 -72.4 -67.5 -5.7 59.5 42 44 B E T <5S+ 0 0 92 -4,-1.9 -3,-0.2 2,-0.2 -2,-0.1 0.980 132.3 36.1 -64.6 -65.8 -64.1 -6.2 61.0 43 45 B S T < 0 0 81 -5,-0.9 -3,-0.2 1,-0.3 -1,-0.2 0.876 360.0 360.0 -58.8 -43.2 -64.7 -6.4 64.7 44 46 B A < 0 0 118 -5,-1.2 -1,-0.3 -6,-0.3 -2,-0.2 -0.144 360.0 360.0-108.7 360.0 -68.0 -8.3 64.4 45 !* 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 46 6 C L 0 0 152 0, 0.0 2,-0.2 0, 0.0 36,-0.1 0.000 360.0 360.0 360.0 145.2 -42.8 0.7 59.8 47 7 C T > - 0 0 50 1,-0.1 4,-1.6 36,-0.0 3,-0.4 -0.633 360.0-115.7-103.4 162.7 -45.6 0.5 62.4 48 8 C K H > S+ 0 0 46 1,-0.3 4,-3.1 2,-0.2 5,-0.2 0.854 115.2 56.5 -63.9 -37.5 -46.9 3.1 64.8 49 9 C T H > S+ 0 0 79 2,-0.2 4,-2.8 1,-0.2 -1,-0.3 0.873 103.3 57.3 -61.7 -33.9 -45.9 1.1 67.9 50 10 C D H > S+ 0 0 67 -3,-0.4 4,-1.6 2,-0.2 -2,-0.2 0.953 111.0 40.4 -64.0 -49.0 -42.4 1.2 66.5 51 11 C Y H X S+ 0 0 38 -4,-1.6 4,-2.9 1,-0.2 5,-0.2 0.898 113.9 55.4 -63.8 -38.1 -42.4 5.0 66.4 52 12 C L H X S+ 0 0 7 -4,-3.1 4,-1.4 1,-0.2 -2,-0.2 0.862 102.6 56.0 -66.2 -35.2 -44.2 4.9 69.8 53 13 C X H < S+ 0 0 103 -4,-2.8 4,-0.5 2,-0.2 -1,-0.2 0.945 112.3 42.3 -57.3 -48.6 -41.4 2.8 71.2 54 14 C R H >< S+ 0 0 41 -4,-1.6 3,-1.3 1,-0.2 4,-0.3 0.925 115.9 47.5 -66.5 -43.6 -38.8 5.4 70.2 55 15 C L H >< S+ 0 0 9 -4,-2.9 3,-1.1 1,-0.3 -1,-0.2 0.682 97.4 73.3 -73.0 -16.4 -41.0 8.3 71.3 56 16 C R T 3< S+ 0 0 55 -4,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.738 90.0 59.6 -67.3 -24.6 -41.6 6.5 74.6 57 17 C R T < S+ 0 0 202 -3,-1.3 -1,-0.3 -4,-0.5 2,-0.2 0.683 86.1 101.8 -75.0 -17.8 -38.1 7.3 75.5 58 18 C C < - 0 0 22 -3,-1.1 2,-0.3 -4,-0.3 3,-0.1 -0.462 54.6-170.1 -78.6 136.8 -38.9 11.0 75.2 59 19 C Q > + 0 0 121 -2,-0.2 4,-0.7 1,-0.1 5,-0.3 -0.831 53.8 24.0-125.3 160.3 -39.5 13.0 78.4 60 20 C T T 4 S- 0 0 78 -2,-0.3 2,-5.8 1,-0.2 -1,-0.1 0.678 88.8-113.2 63.6 24.5 -40.8 16.4 79.4 61 21 C I T > S+ 0 0 39 1,-0.3 4,-3.5 -3,-0.1 5,-0.2 -0.004 111.3 76.3 50.2 -48.5 -42.8 17.1 76.2 62 22 C D H > S+ 0 0 51 -2,-5.8 4,-1.8 1,-0.2 -1,-0.3 0.906 95.9 48.1 -56.3 -42.0 -40.5 19.9 75.2 63 23 C T H X S+ 0 0 38 -4,-0.7 4,-2.3 2,-0.2 -1,-0.2 0.891 112.6 49.2 -64.5 -39.2 -37.9 17.2 74.1 64 24 C L H > S+ 0 0 6 -5,-0.3 4,-3.5 2,-0.2 5,-0.3 0.920 107.2 53.4 -65.5 -44.6 -40.7 15.5 72.2 65 25 C E H X S+ 0 0 56 -4,-3.5 4,-2.4 1,-0.2 -1,-0.2 0.888 110.8 50.2 -55.8 -37.6 -41.8 18.7 70.5 66 26 C R H X S+ 0 0 176 -4,-1.8 4,-2.2 -5,-0.2 -2,-0.2 0.913 112.4 43.2 -69.0 -45.2 -38.2 19.0 69.5 67 27 C V H X S+ 0 0 52 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.920 115.5 50.2 -69.4 -39.6 -37.9 15.5 68.1 68 28 C I H X S+ 0 0 22 -4,-3.5 4,-1.8 1,-0.2 -2,-0.2 0.905 110.8 50.5 -61.2 -41.6 -41.3 15.8 66.4 69 29 C E H X S+ 0 0 112 -4,-2.4 4,-0.8 -5,-0.3 -1,-0.2 0.881 111.0 47.9 -63.1 -41.1 -40.2 19.1 64.9 70 30 C K H X S+ 0 0 46 -4,-2.2 4,-0.5 1,-0.2 3,-0.3 0.873 111.0 52.3 -68.6 -36.4 -37.0 17.6 63.6 71 31 C N H >X S+ 0 0 30 -4,-2.4 4,-2.4 1,-0.2 3,-1.0 0.849 94.9 69.6 -65.5 -39.4 -38.9 14.7 62.1 72 32 C K H 3< S+ 0 0 28 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.875 106.6 37.7 -48.4 -47.0 -41.4 16.9 60.2 73 33 C Y H 3< S+ 0 0 187 -4,-0.8 -1,-0.3 -3,-0.3 -2,-0.2 0.553 121.6 43.7 -83.9 -8.9 -38.7 18.0 57.8 74 34 C E H << S+ 0 0 143 -3,-1.0 -2,-0.2 -4,-0.5 -1,-0.2 0.664 89.9 104.3-107.2 -21.0 -36.9 14.7 57.4 75 35 C L S < S- 0 0 46 -4,-2.4 3,-0.1 1,-0.1 -4,-0.0 -0.199 79.1-111.0 -77.7 158.3 -39.6 12.2 57.1 76 36 C S - 0 0 82 1,-0.2 2,-4.0 2,-0.0 -1,-0.1 0.354 36.2-144.2 -61.2 -4.2 -41.0 10.2 54.2 77 37 C D S > S+ 0 0 126 1,-0.3 4,-1.1 -5,-0.1 -1,-0.2 -0.215 100.5 54.2 68.9 -59.8 -44.3 12.2 54.2 78 38 C N T 4 S+ 0 0 77 -2,-4.0 4,-0.3 1,-0.2 -1,-0.3 0.899 118.9 34.9 -66.5 -42.1 -46.1 9.0 53.2 79 39 C E T >> S+ 0 0 33 1,-0.2 3,-1.1 2,-0.1 4,-1.1 0.793 106.3 72.8 -76.1 -30.5 -44.4 7.4 56.2 80 40 C L H 3> S+ 0 0 20 1,-0.3 4,-1.9 2,-0.2 3,-0.3 0.826 85.2 65.9 -55.4 -35.6 -44.6 10.6 58.3 81 41 C A H 3X S+ 0 0 19 -4,-1.1 4,-0.8 1,-0.3 -1,-0.3 0.852 100.2 49.0 -58.5 -38.5 -48.4 10.2 58.8 82 42 C V H <> S+ 0 0 51 -3,-1.1 4,-1.5 -4,-0.3 3,-0.4 0.851 106.9 56.4 -71.5 -32.4 -48.0 7.1 60.8 83 43 C F H X S+ 0 0 4 -4,-1.1 4,-2.9 -3,-0.3 -2,-0.2 0.882 101.1 58.3 -62.9 -38.8 -45.3 8.8 63.0 84 44 C Y H X S+ 0 0 59 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.802 101.4 56.1 -61.8 -29.7 -47.9 11.5 63.7 85 45 C S H X S+ 0 0 5 -4,-0.8 4,-1.9 -3,-0.4 -1,-0.2 0.931 112.4 40.1 -66.5 -44.4 -50.1 8.7 65.1 86 46 C A H X S+ 0 0 0 -4,-1.5 4,-2.8 2,-0.2 -2,-0.2 0.833 112.3 58.1 -72.9 -34.8 -47.4 7.7 67.6 87 47 C A H X S+ 0 0 9 -4,-2.9 4,-2.6 2,-0.2 5,-0.2 0.918 107.6 45.3 -60.6 -48.2 -46.5 11.3 68.2 88 48 C D H X S+ 0 0 2 -4,-2.1 4,-2.9 2,-0.2 5,-0.2 0.935 112.7 52.8 -62.0 -46.0 -50.0 12.1 69.4 89 49 C H H X S+ 0 0 0 -4,-1.9 4,-3.0 2,-0.2 -2,-0.2 0.945 112.3 43.2 -53.3 -53.9 -50.1 9.0 71.5 90 50 C R H X S+ 0 0 5 -4,-2.8 4,-0.6 1,-0.2 5,-0.2 0.922 114.0 50.2 -61.0 -46.6 -46.9 9.9 73.3 91 51 C L H X S+ 0 0 25 -4,-2.6 4,-2.4 2,-0.2 3,-0.5 0.887 112.9 48.3 -59.3 -39.6 -47.8 13.5 73.7 92 52 C A H X S+ 0 0 1 -4,-2.9 4,-1.5 1,-0.2 -2,-0.2 0.977 113.6 45.2 -62.8 -51.2 -51.1 12.4 75.2 93 53 C E H <>S+ 0 0 1 -4,-3.0 5,-0.7 1,-0.3 -1,-0.2 0.478 116.6 47.6 -77.8 1.2 -49.5 9.9 77.5 94 54 C L H <5S+ 0 0 26 -4,-0.6 -1,-0.3 -3,-0.5 -2,-0.2 0.665 105.6 57.8-104.1 -31.7 -46.9 12.5 78.4 95 55 C T H <5S+ 0 0 62 -4,-2.4 -2,-0.2 -3,-0.2 -3,-0.2 0.806 119.8 30.6 -63.8 -31.0 -49.6 15.2 79.0 96 56 C X T <5S- 0 0 76 -4,-1.5 -1,-0.2 2,-0.2 -3,-0.1 0.410 102.5-126.3-111.7 -4.4 -51.2 13.0 81.6 97 57 C N T 5S+ 0 0 144 -5,-0.2 2,-0.3 1,-0.2 -3,-0.2 0.877 73.6 111.5 56.8 39.4 -48.1 11.1 82.9 98 58 C K < - 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