==== 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 SIGNALING PROTEIN 01-APR-10 3MF4 . COMPND 2 MOLECULE: TWO-COMPONENT SYSTEM RESPONSE REGULATOR/GGDEF DOM . SOURCE 2 ORGANISM_SCIENTIFIC: AEROMONAS SALMONICIDA; . AUTHOR V.N.MALASHKEVICH,R.TORO,J.M.SAUDER,S.K.BURLEY,S.C.ALMO,NEW Y . 491 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21224.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 362 73.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 91 18.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.8 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 . 2 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 . 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 . 28 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 48 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 171 34.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 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 1 0 1 2 2 3 2 0 3 0 1 1 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 8 8 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 . 2 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 4 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 K 0 0 112 0, 0.0 45,-0.1 0, 0.0 119,-0.1 0.000 360.0 360.0 360.0 138.6 -8.8 28.5 -25.8 2 3 A Q + 0 0 126 43,-0.4 26,-2.0 25,-0.0 2,-0.4 0.156 360.0 90.8-126.5 14.8 -5.4 28.0 -24.2 3 4 A K E -ab 28 46A 39 42,-0.7 44,-2.4 24,-0.2 45,-0.6 -0.935 51.8-154.4-127.0 141.6 -5.8 28.8 -20.5 4 5 A I E -ab 29 48A 0 24,-2.5 26,-2.4 -2,-0.4 2,-0.4 -0.894 12.3-147.3-111.4 137.5 -6.7 26.8 -17.4 5 6 A L E -ab 30 49A 0 43,-2.2 45,-3.0 -2,-0.4 2,-0.4 -0.886 13.5-173.2-101.0 135.8 -8.3 28.3 -14.4 6 7 A I E -ab 31 50A 0 24,-2.3 26,-2.6 -2,-0.4 2,-0.5 -0.999 8.3-178.8-128.1 128.2 -7.5 27.0 -10.9 7 8 A V E +ab 32 51A 0 43,-2.6 45,-2.4 -2,-0.4 2,-0.3 -0.937 31.3 132.7-126.5 103.4 -9.3 28.2 -7.8 8 9 A E - 0 0 0 24,-2.3 26,-0.1 -2,-0.5 47,-0.1 -0.924 43.7-155.7-159.6 122.4 -7.8 26.3 -4.8 9 10 A D + 0 0 60 -2,-0.3 2,-0.7 45,-0.2 24,-0.1 0.684 66.4 101.4 -83.5 -20.3 -6.7 27.8 -1.5 10 11 A S > - 0 0 35 1,-0.2 4,-2.9 2,-0.1 5,-0.3 -0.572 61.3-155.3 -62.4 112.5 -4.2 25.0 -0.6 11 12 A X H > S+ 0 0 104 -2,-0.7 4,-2.5 1,-0.2 5,-0.2 0.922 94.0 49.5 -53.3 -47.4 -0.7 26.5 -1.4 12 13 A T H > S+ 0 0 86 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.912 114.3 42.3 -59.5 -48.6 0.7 23.0 -1.8 13 14 A I H > S+ 0 0 29 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.937 114.0 50.9 -68.2 -44.8 -2.1 21.7 -4.1 14 15 A R H X S+ 0 0 33 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.965 114.1 45.3 -56.3 -49.9 -2.2 24.9 -6.2 15 16 A R H X S+ 0 0 149 -4,-2.5 4,-2.6 -5,-0.3 5,-0.2 0.875 109.9 53.1 -62.6 -42.8 1.6 24.7 -6.6 16 17 A X H X S+ 0 0 69 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.937 113.3 45.7 -52.8 -48.5 1.6 21.0 -7.5 17 18 A L H X S+ 0 0 2 -4,-2.5 4,-2.5 2,-0.2 5,-0.3 0.874 112.8 47.7 -66.1 -43.5 -1.0 21.7 -10.2 18 19 A I H X S+ 0 0 58 -4,-2.4 4,-2.7 -5,-0.2 5,-0.2 0.954 114.4 47.2 -62.8 -49.5 0.7 24.8 -11.7 19 20 A Q H X S+ 0 0 87 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.919 116.9 43.3 -56.7 -46.9 4.1 23.0 -11.8 20 21 A A H X S+ 0 0 0 -4,-2.4 4,-2.8 -5,-0.2 5,-0.3 0.922 116.9 43.0 -70.5 -48.5 2.6 19.8 -13.4 21 22 A I H X>S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 5,-1.1 0.913 115.8 51.2 -62.8 -43.2 0.3 21.4 -15.9 22 23 A A H X5S+ 0 0 49 -4,-2.7 4,-0.8 -5,-0.3 -2,-0.2 0.926 117.6 37.7 -57.8 -48.3 3.1 24.0 -16.8 23 24 A Q H <5S+ 0 0 146 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.889 124.9 36.0 -73.6 -43.7 5.7 21.3 -17.4 24 25 A Q H <5S+ 0 0 89 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.782 132.8 19.7 -86.8 -27.0 3.6 18.5 -19.0 25 26 A T H <5S- 0 0 25 -4,-2.1 -3,-0.2 -5,-0.3 -2,-0.1 0.666 78.7-140.3-119.3 -26.6 1.2 20.6 -21.1 26 27 A G << + 0 0 66 -5,-1.1 -4,-0.2 -4,-0.8 2,-0.1 0.570 50.8 149.5 70.5 7.6 2.7 24.1 -21.7 27 28 A L - 0 0 16 -6,-0.6 -1,-0.2 1,-0.1 -24,-0.2 -0.381 52.9-102.9 -70.0 149.9 -0.8 25.6 -21.2 28 29 A E E -a 3 0A 106 -26,-2.0 -24,-2.5 -3,-0.1 2,-0.4 -0.377 41.0-160.4 -67.8 146.7 -1.5 29.0 -19.8 29 30 A I E -a 4 0A 38 -26,-0.2 2,-0.4 -2,-0.1 -24,-0.2 -0.985 22.0-172.0-140.1 129.5 -2.7 29.1 -16.2 30 31 A D E -a 5 0A 54 -26,-2.4 -24,-2.3 -2,-0.4 2,-0.4 -0.990 19.6-175.8-107.9 128.5 -4.5 31.6 -13.9 31 32 A A E +a 6 0A 34 -2,-0.4 2,-0.3 -26,-0.2 -24,-0.2 -0.988 4.7 179.8-130.2 130.7 -4.6 30.4 -10.2 32 33 A F E -a 7 0A 57 -26,-2.6 -24,-2.3 -2,-0.4 -2,-0.0 -0.939 28.7-146.5-129.4 149.8 -6.4 32.1 -7.3 33 34 A D S S+ 0 0 85 -2,-0.3 2,-0.3 -26,-0.2 -26,-0.1 0.425 86.8 40.7 -93.3 -3.0 -6.7 31.2 -3.7 34 35 A T S > S- 0 0 32 21,-0.1 4,-0.8 -26,-0.1 3,-0.4 -0.963 78.9-122.3-138.2 158.0 -10.2 32.7 -3.4 35 36 A L T >4 S+ 0 0 23 -2,-0.3 3,-0.7 1,-0.2 -1,-0.1 0.870 114.1 63.1 -63.4 -34.9 -13.4 32.8 -5.6 36 37 A E G >4 S+ 0 0 103 1,-0.2 3,-1.4 2,-0.2 -1,-0.2 0.826 94.9 59.1 -61.4 -31.9 -13.1 36.6 -5.4 37 38 A G G 34 S+ 0 0 18 -3,-0.4 3,-0.5 1,-0.3 -1,-0.2 0.868 103.4 53.0 -62.7 -34.7 -9.7 36.3 -7.3 38 39 A A G X< S+ 0 0 0 -4,-0.8 3,-1.0 -3,-0.7 -1,-0.3 0.153 76.0 112.3 -86.8 17.6 -11.5 34.6 -10.2 39 40 A R T < S+ 0 0 140 -3,-1.4 -1,-0.2 1,-0.2 -2,-0.1 0.849 74.9 48.7 -62.9 -40.5 -14.1 37.4 -10.5 40 41 A H T 3 S+ 0 0 152 -3,-0.5 -1,-0.2 -4,-0.2 2,-0.2 0.590 85.7 119.5 -74.5 -10.7 -13.0 38.7 -13.9 41 42 A C < - 0 0 6 -3,-1.0 2,-0.3 -4,-0.1 31,-0.1 -0.368 43.0-171.7 -67.8 124.6 -12.9 35.2 -15.4 42 43 A Q >> - 0 0 102 -2,-0.2 3,-1.2 1,-0.1 4,-0.8 -0.807 32.9-115.4-112.8 159.4 -15.2 34.6 -18.4 43 44 A G T 34 S+ 0 0 8 27,-1.6 3,-0.4 -2,-0.3 28,-0.1 0.814 106.7 64.2 -58.2 -34.7 -16.1 31.3 -20.2 44 45 A D T 34 S+ 0 0 105 1,-0.2 -1,-0.2 28,-0.1 27,-0.1 0.586 101.7 48.9 -74.2 -10.9 -14.6 32.3 -23.5 45 46 A E T <4 S+ 0 0 47 -3,-1.2 -42,-0.7 -44,-0.1 -43,-0.4 0.761 101.7 64.5 -99.0 -26.5 -11.0 32.5 -22.2 46 47 A Y E < -b 3 0A 6 -4,-0.8 -42,-0.2 -3,-0.4 3,-0.1 -0.813 57.4-155.0-109.6 136.5 -10.6 29.2 -20.3 47 48 A V E S- 0 0 1 -44,-2.4 2,-0.3 -2,-0.4 -43,-0.2 0.926 84.3 -24.0 -58.6 -47.4 -10.7 25.6 -21.5 48 49 A V E -b 4 0A 0 -45,-0.6 -43,-2.2 24,-0.1 2,-0.4 -0.977 58.3-124.7-166.7 153.4 -11.8 24.5 -18.0 49 50 A A E -bc 5 74A 0 24,-2.5 26,-3.1 -2,-0.3 2,-0.6 -0.961 12.5-149.2-112.5 128.6 -11.8 25.5 -14.4 50 51 A L E -bc 6 75A 0 -45,-3.0 -43,-2.6 -2,-0.4 2,-0.5 -0.891 29.3-165.3 -93.3 119.2 -10.4 23.3 -11.6 51 52 A V E -bc 7 76A 0 24,-2.8 26,-3.1 -2,-0.6 2,-0.2 -0.931 17.7-146.4-127.0 120.7 -12.5 24.2 -8.6 52 53 A D E - c 0 77A 3 -45,-2.4 11,-0.3 -2,-0.5 3,-0.2 -0.555 7.2-150.5 -75.9 142.0 -12.0 23.5 -4.9 53 54 A L S S+ 0 0 31 24,-0.9 8,-2.0 -2,-0.2 2,-0.5 0.575 89.1 64.6 -86.0 -14.3 -15.2 23.0 -2.8 54 55 A T + 0 0 80 6,-0.2 -45,-0.2 7,-0.1 -1,-0.2 -0.555 68.5 151.9-107.7 66.5 -13.4 24.4 0.3 55 56 A L B > -E 58 0B 2 3,-2.1 3,-1.4 -2,-0.5 -21,-0.1 -0.671 52.9-122.8 -94.0 152.8 -12.7 28.1 -0.5 56 57 A P T 3 S+ 0 0 86 0, 0.0 -22,-0.1 0, 0.0 -1,-0.1 0.791 116.5 32.6 -61.3 -32.6 -12.4 30.8 2.1 57 58 A D T 3 S+ 0 0 71 1,-0.2 -23,-0.1 2,-0.0 -3,-0.0 0.041 134.3 32.4-107.7 14.8 -15.2 32.9 0.4 58 59 A A B X +E 55 0B 1 -3,-1.4 -3,-2.1 4,-0.1 3,-0.8 -0.315 68.3 163.9-167.3 71.8 -17.0 29.7 -0.8 59 60 A P T 3 S+ 0 0 74 0, 0.0 -6,-0.1 0, 0.0 -2,-0.0 0.444 71.1 48.7 -79.9 -6.7 -16.5 27.0 1.8 60 61 A S T 3 S- 0 0 101 -6,-0.1 -6,-0.2 -5,-0.0 -7,-0.1 -0.178 127.6 -77.1-129.1 43.4 -19.3 24.6 0.6 61 62 A G S X> S+ 0 0 16 -8,-2.0 3,-1.8 -3,-0.8 4,-0.6 0.492 84.3 137.8 86.6 3.2 -18.8 24.3 -3.1 62 63 A E H 3> + 0 0 91 1,-0.3 4,-1.6 -9,-0.3 3,-0.2 0.753 63.1 66.8 -55.3 -29.4 -20.4 27.7 -4.0 63 64 A A H 3> S+ 0 0 0 -5,-0.4 4,-2.3 -11,-0.3 -1,-0.3 0.799 91.0 65.5 -63.4 -28.2 -17.6 28.5 -6.6 64 65 A V H <> S+ 0 0 14 -3,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.945 106.0 37.8 -59.6 -57.3 -18.9 25.6 -8.8 65 66 A K H X S+ 0 0 126 -4,-0.6 4,-2.1 1,-0.2 -1,-0.2 0.876 114.8 56.8 -63.0 -39.9 -22.3 27.1 -9.6 66 67 A V H X S+ 0 0 52 -4,-1.6 4,-0.6 1,-0.2 -2,-0.2 0.919 113.4 38.7 -59.5 -44.4 -20.8 30.6 -9.8 67 68 A L H ><>S+ 0 0 0 -4,-2.3 5,-2.3 2,-0.2 3,-0.7 0.891 112.0 55.7 -79.4 -39.8 -18.3 29.6 -12.5 68 69 A L H ><5S+ 0 0 42 -4,-2.4 3,-1.1 -5,-0.2 -1,-0.2 0.870 106.6 53.3 -53.7 -38.9 -20.7 27.2 -14.4 69 70 A E H 3<5S+ 0 0 135 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.651 102.7 56.3 -76.1 -17.5 -23.1 30.2 -14.8 70 71 A R T <<5S- 0 0 75 -3,-0.7 -27,-1.6 -4,-0.6 -1,-0.3 0.381 127.1-101.3 -86.8 -0.2 -20.3 32.4 -16.3 71 72 A G T < 5S+ 0 0 46 -3,-1.1 -3,-0.2 1,-0.3 -2,-0.1 0.633 76.4 139.7 91.5 17.2 -19.9 29.7 -18.9 72 73 A L < - 0 0 2 -5,-2.3 -1,-0.3 -31,-0.1 2,-0.1 -0.820 52.9-128.3 -93.9 126.0 -16.8 27.9 -17.6 73 74 A P - 0 0 22 0, 0.0 -24,-2.5 0, 0.0 2,-0.4 -0.496 33.4-146.4 -62.4 143.3 -16.7 24.2 -17.7 74 75 A V E -c 49 0A 0 19,-0.4 21,-2.3 -26,-0.2 22,-0.8 -0.957 23.5-171.1-125.1 133.1 -15.9 23.0 -14.2 75 76 A V E -cd 50 96A 0 -26,-3.1 -24,-2.8 -2,-0.4 2,-0.3 -0.995 28.9-133.7-112.9 122.7 -13.9 20.0 -12.8 76 77 A I E -cd 51 97A 0 20,-2.0 22,-2.6 -2,-0.5 2,-0.6 -0.542 5.6-146.1 -80.6 133.2 -14.2 19.7 -9.1 77 78 A L E +cd 52 98A 1 -26,-3.1 -24,-0.9 -2,-0.3 2,-0.4 -0.907 31.3 176.6 -95.0 122.6 -11.2 19.1 -6.8 78 79 A T E - d 0 99A 10 20,-2.5 22,-2.5 -2,-0.6 23,-0.3 -0.979 40.5-162.2-138.3 139.5 -12.3 16.9 -3.9 79 80 A A S S+ 0 0 53 -2,-0.4 2,-0.3 20,-0.2 -1,-0.1 0.693 87.4 35.1 -83.0 -21.4 -10.7 15.2 -0.9 80 81 A D - 0 0 125 20,-0.0 2,-0.3 2,-0.0 -1,-0.1 -0.897 64.7-165.2-132.9 155.8 -13.7 12.8 -0.6 81 82 A I + 0 0 64 -2,-0.3 2,-0.3 -3,-0.0 3,-0.1 -0.976 10.0 167.0-139.5 154.1 -16.2 11.0 -2.8 82 83 A S > - 0 0 53 -2,-0.3 4,-2.9 1,-0.1 5,-0.2 -0.964 47.8-106.6-155.6 163.0 -19.5 9.2 -2.5 83 84 A E H > S+ 0 0 105 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.936 122.0 48.2 -55.7 -47.3 -22.3 7.9 -4.8 84 85 A D H > S+ 0 0 129 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.858 112.2 48.1 -61.3 -40.5 -24.5 10.8 -3.7 85 86 A K H > S+ 0 0 108 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.909 110.7 51.2 -69.8 -42.1 -21.8 13.4 -4.2 86 87 A R H X S+ 0 0 34 -4,-2.9 4,-2.3 2,-0.2 -2,-0.2 0.933 112.7 45.8 -57.9 -47.1 -20.9 12.1 -7.7 87 88 A E H X S+ 0 0 100 -4,-2.2 4,-2.2 -5,-0.2 -2,-0.2 0.926 111.9 51.0 -65.8 -45.5 -24.6 12.2 -8.8 88 89 A A H X S+ 0 0 44 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.921 112.5 45.9 -55.4 -48.6 -25.2 15.7 -7.4 89 90 A W H <>S+ 0 0 34 -4,-2.3 5,-2.0 1,-0.2 4,-0.4 0.932 112.9 48.4 -64.3 -47.7 -22.2 17.1 -9.1 90 91 A L H ><5S+ 0 0 42 -4,-2.3 3,-0.6 1,-0.2 -1,-0.2 0.813 109.7 54.3 -63.5 -32.3 -22.9 15.5 -12.5 91 92 A E H 3<5S+ 0 0 157 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.844 103.3 55.6 -67.1 -38.5 -26.5 16.7 -12.3 92 93 A A T 3<5S- 0 0 65 -4,-1.7 -1,-0.2 -3,-0.2 -2,-0.2 0.517 126.1-101.5 -73.4 -6.9 -25.4 20.3 -11.8 93 94 A G T < 5 + 0 0 31 -3,-0.6 -19,-0.4 -4,-0.4 2,-0.2 0.610 65.1 158.1 96.7 14.9 -23.4 20.0 -15.0 94 95 A V < - 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