==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JUN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 29-DEC-11 3VA9 . COMPND 2 MOLECULE: SENSOR HISTIDINE KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: RHODOPSEUDOMONAS PALUSTRIS; . AUTHOR Z.ZHANG,Q.LIU,W.A.HENDRICKSON . 127 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7698.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 113 89.0 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 . 1 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 101 79.5 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+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 0 0 0 1 0 0 0 0 0 0 0 0 0 0 1 0 1 0 0 2 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 49 A T > 0 0 42 0, 0.0 4,-2.0 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -42.1 11.1 12.3 14.9 2 50 A N H > + 0 0 111 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.845 360.0 51.7 -65.2 -33.2 12.2 15.8 15.7 3 51 A K H > S+ 0 0 156 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.831 108.8 52.0 -68.3 -33.2 13.9 14.4 18.8 4 52 A A H > S+ 0 0 1 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.850 105.6 52.8 -73.6 -36.3 15.7 11.9 16.6 5 53 A L H X S+ 0 0 45 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.856 108.2 51.2 -69.1 -36.6 17.0 14.5 14.1 6 54 A L H X S+ 0 0 130 -4,-1.4 4,-2.2 1,-0.2 -2,-0.2 0.951 110.3 49.9 -59.5 -50.1 18.5 16.5 17.0 7 55 A A H X S+ 0 0 25 -4,-1.7 4,-1.0 1,-0.2 -2,-0.2 0.835 109.1 51.7 -59.0 -36.6 20.2 13.3 18.2 8 56 A I H X S+ 0 0 4 -4,-1.8 4,-1.7 2,-0.2 -1,-0.2 0.869 110.4 47.7 -69.4 -38.4 21.6 12.5 14.8 9 57 A S H X S+ 0 0 62 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.834 107.8 56.0 -71.5 -34.1 23.1 16.0 14.4 10 58 A A H X S+ 0 0 23 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.767 105.7 52.9 -68.5 -25.6 24.6 15.7 17.9 11 59 A I H X S+ 0 0 0 -4,-1.0 4,-2.1 2,-0.2 -2,-0.2 0.912 107.5 49.2 -75.5 -45.2 26.3 12.5 16.7 12 60 A Q H X S+ 0 0 77 -4,-1.7 4,-2.1 2,-0.2 5,-0.2 0.942 111.4 52.1 -52.8 -50.6 27.9 14.1 13.7 13 61 A Q H X S+ 0 0 108 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.929 108.4 49.1 -51.1 -53.1 29.1 16.9 16.0 14 62 A A H X S+ 0 0 2 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.850 109.2 52.3 -61.3 -38.3 30.7 14.5 18.4 15 63 A V H X S+ 0 0 5 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.921 112.8 44.8 -63.3 -44.4 32.5 12.7 15.6 16 64 A L H X S+ 0 0 81 -4,-2.1 4,-3.2 1,-0.2 5,-0.3 0.909 111.9 53.1 -64.4 -42.9 34.0 16.0 14.3 17 65 A E H X S+ 0 0 83 -4,-2.8 4,-2.0 -5,-0.2 -2,-0.2 0.859 108.0 50.3 -62.4 -36.8 34.9 17.1 17.8 18 66 A A H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.924 114.6 44.4 -66.5 -44.8 36.8 13.8 18.4 19 67 A E H X S+ 0 0 26 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.960 115.2 45.6 -63.6 -52.8 38.7 14.3 15.2 20 68 A T H X S+ 0 0 80 -4,-3.2 4,-2.4 1,-0.2 -1,-0.2 0.882 113.8 50.7 -62.0 -35.7 39.5 18.0 15.6 21 69 A S H X S+ 0 0 4 -4,-2.0 4,-2.1 -5,-0.3 -1,-0.2 0.917 109.2 50.1 -69.0 -42.2 40.5 17.4 19.2 22 70 A E H X S+ 0 0 1 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.921 112.0 48.5 -60.4 -44.6 42.9 14.6 18.3 23 71 A R H X S+ 0 0 106 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.909 109.7 52.3 -61.4 -42.3 44.4 16.8 15.6 24 72 A G H X S+ 0 0 9 -4,-2.4 4,-2.1 -5,-0.2 6,-0.4 0.872 109.3 50.3 -60.6 -37.7 44.8 19.6 18.1 25 73 A F H X S+ 0 0 16 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.906 110.1 48.7 -67.6 -45.0 46.6 17.3 20.5 26 74 A L H < S+ 0 0 8 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.878 115.7 46.1 -59.3 -39.6 49.0 16.1 17.9 27 75 A L H < S+ 0 0 144 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.882 129.1 18.0 -70.9 -41.3 49.7 19.7 16.9 28 76 A T H < S- 0 0 65 -4,-2.1 -3,-0.2 -5,-0.2 -2,-0.2 0.689 80.2-136.2-111.1 -26.2 50.2 21.2 20.4 29 77 A G < + 0 0 38 -4,-2.4 2,-0.6 -5,-0.3 -4,-0.1 0.613 55.1 146.0 71.9 11.3 50.8 18.5 22.9 30 78 A I >> - 0 0 90 -6,-0.4 3,-2.4 1,-0.1 4,-0.8 -0.745 48.5-144.9 -88.6 118.3 48.4 20.3 25.2 31 79 A E H 3> S+ 0 0 80 -2,-0.6 4,-2.9 1,-0.3 5,-0.2 0.706 92.6 74.9 -58.6 -23.8 46.4 17.8 27.3 32 80 A T H 3> S+ 0 0 90 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.828 95.0 50.9 -56.4 -33.5 43.3 19.9 27.1 33 81 A Y H <> S+ 0 0 97 -3,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.886 108.5 51.0 -74.8 -37.8 42.9 18.8 23.5 34 82 A R H X S+ 0 0 73 -4,-0.8 4,-2.8 2,-0.2 -2,-0.2 0.928 107.9 52.8 -60.0 -46.2 43.2 15.2 24.6 35 83 A D H X S+ 0 0 83 -4,-2.9 4,-3.1 1,-0.2 -2,-0.2 0.924 108.4 51.2 -54.3 -45.0 40.6 15.7 27.2 36 84 A S H X S+ 0 0 42 -4,-1.8 4,-2.7 2,-0.2 -1,-0.2 0.870 108.3 51.1 -61.2 -38.9 38.3 17.1 24.5 37 85 A Y H X S+ 0 0 8 -4,-2.0 4,-2.9 2,-0.2 -2,-0.2 0.956 112.0 47.3 -61.5 -49.3 38.9 14.0 22.4 38 86 A I H X S+ 0 0 39 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.918 112.9 49.3 -56.8 -45.8 38.0 11.8 25.4 39 87 A R H X S+ 0 0 196 -4,-3.1 4,-2.9 2,-0.2 -1,-0.2 0.928 112.9 45.8 -60.2 -47.9 34.9 13.9 26.1 40 88 A A H X S+ 0 0 6 -4,-2.7 4,-2.7 2,-0.2 -2,-0.2 0.913 113.3 50.4 -63.6 -42.2 33.8 13.7 22.4 41 89 A R H X S+ 0 0 97 -4,-2.9 4,-1.9 -5,-0.2 -2,-0.2 0.919 114.0 44.4 -60.2 -44.9 34.5 10.0 22.4 42 90 A D H X S+ 0 0 84 -4,-2.7 4,-2.3 -5,-0.2 -2,-0.2 0.912 114.2 49.7 -65.8 -41.6 32.5 9.5 25.6 43 91 A A H X S+ 0 0 22 -4,-2.9 4,-2.9 -5,-0.2 5,-0.2 0.885 108.3 53.8 -66.3 -38.9 29.7 11.7 24.4 44 92 A L H X S+ 0 0 2 -4,-2.7 4,-2.8 2,-0.2 5,-0.2 0.948 109.1 47.6 -58.2 -51.5 29.5 9.9 21.1 45 93 A A H X S+ 0 0 34 -4,-1.9 4,-2.5 1,-0.2 -2,-0.2 0.942 114.7 46.5 -55.9 -48.5 29.1 6.5 22.8 46 94 A A H X S+ 0 0 59 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.889 113.6 48.1 -62.7 -41.1 26.4 8.0 25.1 47 95 A R H X S+ 0 0 90 -4,-2.9 4,-2.2 2,-0.2 -1,-0.2 0.845 111.8 49.8 -70.0 -34.9 24.5 9.7 22.2 48 96 A L H X S+ 0 0 2 -4,-2.8 4,-2.0 -5,-0.2 -2,-0.2 0.909 109.8 51.2 -65.9 -44.0 24.7 6.5 20.1 49 97 A D H X S+ 0 0 90 -4,-2.5 4,-0.7 -5,-0.2 -2,-0.2 0.889 115.2 43.3 -58.5 -41.6 23.3 4.5 23.1 50 98 A G H X S+ 0 0 35 -4,-1.9 4,-1.2 2,-0.2 -2,-0.2 0.837 109.1 53.9 -76.5 -37.5 20.4 7.0 23.4 51 99 A L H >X S+ 0 0 1 -4,-2.2 4,-1.8 1,-0.2 3,-0.6 0.912 106.4 55.9 -60.2 -40.7 19.6 7.3 19.7 52 100 A R H 3< S+ 0 0 113 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.800 104.0 53.6 -61.9 -29.7 19.3 3.6 19.7 53 101 A A H >< S+ 0 0 73 -4,-0.7 3,-0.5 1,-0.2 -1,-0.3 0.781 107.2 51.0 -75.5 -28.2 16.7 3.9 22.5 54 102 A V H << S+ 0 0 61 -4,-1.2 3,-0.4 -3,-0.6 -2,-0.2 0.821 113.7 44.1 -75.2 -32.2 14.7 6.3 20.4 55 103 A L T >< S+ 0 0 6 -4,-1.8 3,-1.8 1,-0.2 7,-0.3 0.218 77.1 118.1 -98.8 14.7 14.7 4.0 17.4 56 104 A A T < S+ 0 0 60 -3,-0.5 -1,-0.2 1,-0.3 -2,-0.1 0.758 75.3 48.8 -54.5 -30.0 13.9 0.9 19.5 57 105 A D T 3 S+ 0 0 163 -3,-0.4 -1,-0.3 1,-0.1 -2,-0.1 -0.003 97.2 76.0-103.8 28.8 10.6 0.3 17.6 58 106 A N X> - 0 0 35 -3,-1.8 4,-2.9 1,-0.1 3,-0.9 -0.744 55.4-170.4-143.4 90.1 11.9 0.6 14.1 59 107 A P H 3> S+ 0 0 92 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.791 89.3 52.8 -51.9 -37.6 13.9 -2.4 12.7 60 108 A E H 3> S+ 0 0 124 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.855 114.4 42.5 -68.8 -35.7 15.0 -0.5 9.6 61 109 A Q H <> S+ 0 0 3 -3,-0.9 4,-2.6 2,-0.2 5,-0.2 0.882 110.8 54.8 -74.9 -42.0 16.3 2.3 11.7 62 110 A I H X S+ 0 0 30 -4,-2.9 4,-2.6 -7,-0.3 -2,-0.2 0.893 109.3 49.4 -56.6 -41.0 17.9 -0.0 14.3 63 111 A A H X S+ 0 0 34 -4,-2.0 4,-2.3 -5,-0.2 -1,-0.2 0.914 110.6 49.4 -64.7 -43.7 19.7 -1.7 11.4 64 112 A H H X S+ 0 0 56 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.848 112.1 48.2 -64.5 -35.2 20.9 1.7 10.1 65 113 A I H X S+ 0 0 5 -4,-2.6 4,-2.9 2,-0.2 -2,-0.2 0.906 108.3 54.2 -72.3 -40.2 22.1 2.7 13.6 66 114 A D H X S+ 0 0 78 -4,-2.6 4,-1.9 -5,-0.2 -2,-0.2 0.937 110.9 47.7 -52.9 -47.3 23.9 -0.7 13.9 67 115 A E H X S+ 0 0 103 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.929 110.7 48.9 -62.4 -48.8 25.6 0.2 10.7 68 116 A L H X S+ 0 0 0 -4,-2.3 4,-3.0 1,-0.2 5,-0.2 0.931 110.0 53.9 -53.3 -47.5 26.6 3.7 11.7 69 117 A R H X S+ 0 0 69 -4,-2.9 4,-2.6 1,-0.2 -1,-0.2 0.848 104.9 52.6 -59.7 -40.7 27.9 2.3 15.0 70 118 A L H X S+ 0 0 110 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.938 113.2 45.5 -55.7 -48.6 30.2 -0.2 13.2 71 119 A L H X S+ 0 0 21 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.902 113.8 47.4 -65.3 -43.2 31.6 2.7 11.2 72 120 A T H X S+ 0 0 1 -4,-3.0 4,-2.9 2,-0.2 -1,-0.2 0.861 110.1 53.8 -70.3 -34.1 32.0 5.0 14.3 73 121 A D H X S+ 0 0 89 -4,-2.6 4,-1.9 -5,-0.2 -2,-0.2 0.915 110.7 45.9 -62.5 -44.4 33.7 2.2 16.2 74 122 A M H X S+ 0 0 75 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.902 114.7 48.6 -63.9 -40.0 36.2 1.7 13.4 75 123 A R H X S+ 0 0 20 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.944 110.4 49.7 -66.9 -48.4 36.8 5.4 13.2 76 124 A M H X S+ 0 0 22 -4,-2.9 4,-2.6 1,-0.2 -1,-0.2 0.859 108.3 54.1 -57.6 -36.8 37.2 5.9 16.9 77 125 A A H X S+ 0 0 69 -4,-1.9 4,-1.3 -5,-0.2 -1,-0.2 0.872 108.6 50.6 -66.6 -35.7 39.8 3.0 17.0 78 126 A Q H X S+ 0 0 30 -4,-1.6 4,-1.7 2,-0.2 3,-0.3 0.965 114.0 41.8 -62.0 -55.4 41.7 4.9 14.2 79 127 A L H X S+ 0 0 2 -4,-2.4 4,-2.8 1,-0.2 5,-0.2 0.888 111.5 56.3 -58.9 -43.4 41.8 8.2 16.1 80 128 A G H X S+ 0 0 18 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.829 106.2 50.9 -60.9 -33.7 42.5 6.5 19.5 81 129 A R H X S+ 0 0 138 -4,-1.3 4,-2.3 -3,-0.3 -1,-0.2 0.905 111.6 46.8 -70.7 -41.7 45.6 4.9 17.9 82 130 A V H X S+ 0 0 2 -4,-1.7 4,-2.9 2,-0.2 -2,-0.2 0.897 112.5 49.9 -64.0 -43.4 46.8 8.2 16.6 83 131 A V H < S+ 0 0 7 -4,-2.8 -1,-0.2 2,-0.2 -2,-0.2 0.857 109.7 53.2 -62.2 -36.6 46.2 9.8 20.0 84 132 A E H < S+ 0 0 97 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.919 110.1 44.6 -66.8 -46.5 48.1 7.0 21.6 85 133 A L H < S+ 0 0 21 -4,-2.3 4,-0.3 -5,-0.1 -2,-0.2 0.946 101.6 169.1 -62.1 -48.6 51.1 7.5 19.4 86 134 A G >< - 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