==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 27-MAR-09 3GT7 . COMPND 2 MOLECULE: SENSOR PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SYNTROPHUS ACIDITROPHICUS SB; . AUTHOR Y.PATSKOVSKY,R.TORO,C.MORANO,J.FREEMAN,S.HU,J.M.SAUDER, . 132 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8029.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 89 67.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 21 15.9 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 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 9 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 46 34.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.8 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 1 0 2 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 3 1 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 1 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 11 A A 0 0 137 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 127.5 1.4 -22.9 -14.3 2 12 A G - 0 0 13 24,-0.1 25,-2.9 46,-0.0 2,-0.7 0.354 360.0-157.6 123.5 88.6 4.7 -23.2 -12.4 3 13 A E E -a 27 0A 41 23,-0.2 44,-3.7 42,-0.1 45,-1.3 -0.852 17.9-173.8 -97.3 113.2 4.6 -22.4 -8.7 4 14 A I E -ab 28 48A 0 23,-2.8 25,-2.3 -2,-0.7 2,-0.7 -0.908 18.2-147.3-117.7 128.9 8.2 -21.5 -7.5 5 15 A L E -ab 29 49A 0 43,-2.8 45,-2.7 -2,-0.4 2,-0.5 -0.835 13.6-158.3 -95.5 116.5 9.5 -20.9 -4.0 6 16 A I E -ab 30 50A 2 23,-3.4 25,-2.3 -2,-0.7 2,-0.7 -0.821 3.6-164.5 -94.8 124.3 12.4 -18.4 -3.8 7 17 A V E +ab 31 51A 1 43,-3.4 45,-2.3 -2,-0.5 2,-0.3 -0.895 32.6 140.9-109.9 102.9 14.6 -18.5 -0.7 8 18 A E - 0 0 7 23,-2.6 25,-0.1 -2,-0.7 47,-0.1 -0.970 41.7-161.7-153.6 123.4 16.6 -15.3 -0.5 9 19 A D S S+ 0 0 52 45,-0.4 -1,-0.1 -2,-0.3 46,-0.1 0.838 77.0 81.3 -79.2 -34.0 17.6 -13.0 2.3 10 20 A S > - 0 0 25 1,-0.1 4,-2.4 2,-0.0 5,-0.2 -0.658 68.9-155.0 -75.5 116.4 18.3 -9.9 0.1 11 21 A P H > S+ 0 0 84 0, 0.0 4,-1.5 0, 0.0 -1,-0.1 0.817 91.8 47.4 -64.0 -33.4 15.0 -8.2 -0.6 12 22 A T H > S+ 0 0 111 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.862 112.4 47.5 -77.6 -39.1 16.2 -6.6 -3.9 13 23 A Q H > S+ 0 0 79 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.886 111.0 53.2 -66.9 -39.9 17.8 -9.8 -5.3 14 24 A A H X S+ 0 0 6 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.897 108.0 51.3 -57.5 -43.4 14.6 -11.6 -4.3 15 25 A E H X S+ 0 0 84 -4,-1.5 4,-2.8 2,-0.2 -2,-0.2 0.889 106.6 52.8 -62.8 -42.5 12.7 -9.0 -6.3 16 26 A H H X S+ 0 0 83 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.894 110.7 47.7 -60.1 -40.8 14.9 -9.5 -9.4 17 27 A L H X S+ 0 0 10 -4,-2.0 4,-1.4 2,-0.2 -1,-0.2 0.874 111.1 51.9 -66.1 -38.1 14.2 -13.2 -9.2 18 28 A K H X S+ 0 0 65 -4,-2.1 4,-1.9 2,-0.2 5,-0.2 0.931 110.4 49.1 -61.8 -46.6 10.5 -12.4 -8.9 19 29 A H H X S+ 0 0 84 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.961 113.5 41.7 -58.9 -57.6 10.6 -10.1 -11.9 20 30 A I H < S+ 0 0 22 -4,-2.1 4,-0.5 1,-0.2 -1,-0.2 0.712 116.6 47.9 -71.2 -23.6 12.3 -12.5 -14.4 21 31 A L H <>S+ 0 0 1 -4,-1.4 5,-2.6 -5,-0.2 -1,-0.2 0.831 112.9 46.3 -84.9 -35.7 10.4 -15.6 -13.4 22 32 A E H ><5S+ 0 0 74 -4,-1.9 3,-0.7 3,-0.2 -2,-0.2 0.835 107.4 59.5 -72.5 -32.6 6.9 -14.1 -13.5 23 33 A E T 3<5S+ 0 0 147 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.762 106.1 47.3 -65.5 -28.0 7.8 -12.5 -16.9 24 34 A T T 3 5S- 0 0 89 -4,-0.5 -1,-0.3 -5,-0.2 -2,-0.2 0.469 132.5 -95.2 -92.4 -5.3 8.4 -16.0 -18.3 25 35 A G T < 5S+ 0 0 45 -3,-0.7 -3,-0.2 1,-0.3 2,-0.2 0.451 77.6 130.8 115.4 3.7 5.1 -17.1 -16.7 26 36 A Y < - 0 0 43 -5,-2.6 2,-0.4 -23,-0.0 -1,-0.3 -0.499 51.3-131.3 -85.0 153.9 5.7 -18.6 -13.3 27 37 A Q E -a 3 0A 98 -25,-2.9 -23,-2.8 -2,-0.2 2,-0.3 -0.872 34.5-164.7 -96.5 138.8 3.9 -17.8 -10.1 28 38 A T E -a 4 0A 3 -2,-0.4 2,-0.3 -25,-0.2 -23,-0.2 -0.904 19.1-161.9-128.5 154.9 6.4 -17.2 -7.3 29 39 A E E -a 5 0A 71 -25,-2.3 -23,-3.4 -2,-0.3 2,-0.4 -0.962 16.7-141.0-130.0 153.8 6.6 -17.0 -3.5 30 40 A H E +a 6 0A 79 -2,-0.3 2,-0.3 -25,-0.2 -23,-0.2 -0.924 19.5 172.3-123.3 140.3 9.3 -15.5 -1.4 31 41 A V E -a 7 0A 14 -25,-2.3 -23,-2.6 -2,-0.4 3,-0.1 -0.952 26.7-138.9-140.8 154.2 10.9 -16.5 1.9 32 42 A R S S- 0 0 114 -2,-0.3 2,-0.3 -25,-0.2 -25,-0.1 0.769 74.5 -0.2 -94.3 -27.2 13.9 -15.0 3.7 33 43 A N S > S- 0 0 7 22,-0.1 4,-1.5 -25,-0.1 3,-0.2 -0.896 78.9 -89.9-150.3-179.8 15.8 -18.1 5.1 34 44 A G H > S+ 0 0 0 24,-2.0 4,-2.4 22,-0.4 25,-0.1 0.854 120.0 56.7 -66.3 -37.2 15.7 -21.9 5.2 35 45 A R H > S+ 0 0 100 21,-0.4 4,-1.6 1,-0.2 -1,-0.2 0.832 107.8 48.0 -66.1 -33.8 13.7 -22.0 8.5 36 46 A E H > S+ 0 0 45 -3,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.847 108.2 55.8 -71.7 -35.1 11.0 -19.9 6.9 37 47 A A H X S+ 0 0 0 -4,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.907 104.5 53.2 -62.7 -43.1 11.1 -22.2 3.9 38 48 A V H X S+ 0 0 20 -4,-2.4 4,-0.8 1,-0.2 -2,-0.2 0.948 110.2 47.6 -52.9 -51.4 10.5 -25.2 6.3 39 49 A R H < S+ 0 0 155 -4,-1.6 4,-0.5 1,-0.2 3,-0.3 0.825 111.9 50.4 -61.0 -36.8 7.4 -23.3 7.7 40 50 A F H >X S+ 0 0 39 -4,-2.1 4,-2.8 1,-0.2 3,-1.1 0.905 107.6 53.2 -63.6 -43.0 6.2 -22.6 4.1 41 51 A L H 3< S+ 0 0 14 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.562 93.4 71.7 -79.4 -9.1 6.6 -26.2 3.1 42 52 A S T 3< S+ 0 0 107 -4,-0.8 -1,-0.3 -3,-0.3 -2,-0.2 0.796 118.4 17.7 -67.2 -33.9 4.4 -27.4 6.0 43 53 A L T <4 S+ 0 0 157 -3,-1.1 2,-0.4 -4,-0.5 -2,-0.2 0.778 124.6 50.0-104.2 -39.2 1.4 -26.0 4.3 44 54 A T < - 0 0 46 -4,-2.8 -1,-0.2 -5,-0.1 0, 0.0 -0.849 55.7-154.4-119.9 140.8 2.3 -25.5 0.6 45 55 A R - 0 0 125 -2,-0.4 2,-0.1 -3,-0.1 -42,-0.1 -0.946 17.6-165.6-104.2 108.5 4.0 -27.6 -2.1 46 56 A P - 0 0 3 0, 0.0 -42,-0.2 0, 0.0 3,-0.1 -0.426 25.5-128.3 -83.7 168.0 5.8 -25.6 -4.8 47 57 A D S S+ 0 0 79 -44,-3.7 2,-0.3 1,-0.3 -43,-0.2 0.790 90.4 9.8 -81.7 -31.9 6.9 -27.1 -8.2 48 58 A L E -b 4 0A 0 -45,-1.3 -43,-2.8 28,-0.2 2,-0.4 -0.984 64.9-146.7-146.7 151.5 10.4 -25.8 -7.8 49 59 A I E -bc 5 78A 0 28,-2.6 30,-2.5 -2,-0.3 2,-0.5 -0.981 6.2-167.9-121.2 134.9 12.6 -24.2 -5.1 50 60 A I E +bc 6 79A 1 -45,-2.7 -43,-3.4 -2,-0.4 2,-0.4 -0.994 17.0 179.9-116.4 123.8 15.4 -21.7 -5.7 51 61 A S E -bc 7 80A 0 28,-2.9 30,-3.1 -2,-0.5 -43,-0.2 -0.980 20.5-147.0-127.3 140.1 17.7 -21.1 -2.7 52 62 A D E - c 0 81A 6 -45,-2.3 30,-0.2 -2,-0.4 8,-0.1 -0.352 21.2-129.2 -82.8 176.1 20.6 -18.9 -2.1 53 63 A V S S+ 0 0 12 28,-0.5 7,-2.1 7,-0.1 2,-0.4 0.924 83.1 67.5 -94.5 -58.5 23.3 -20.1 0.3 54 64 A L + 0 0 136 5,-0.2 -45,-0.4 6,-0.1 -1,-0.1 -0.534 65.6 128.0 -80.3 121.6 24.0 -17.3 2.9 55 65 A M - 0 0 22 -2,-0.4 -22,-0.1 -47,-0.1 2,-0.1 -0.963 55.9 -98.3-167.4 150.3 21.0 -16.8 5.1 56 66 A P S S+ 0 0 62 0, 0.0 2,-2.5 0, 0.0 -22,-0.4 -0.402 94.5 7.1 -76.9 159.1 20.3 -16.7 8.9 57 67 A E S S+ 0 0 143 -24,-0.1 2,-0.4 -23,-0.1 -24,-0.0 -0.409 136.1 19.8 76.0 -71.8 19.0 -19.6 10.9 58 68 A M S S- 0 0 15 -2,-2.5 -24,-2.0 3,-0.0 -23,-0.2 -0.973 79.2-147.6-137.5 114.1 19.2 -22.2 8.2 59 69 A D > - 0 0 51 -2,-0.4 4,-2.0 -26,-0.1 -5,-0.2 -0.289 32.0 -99.0 -80.1 170.0 21.5 -21.7 5.2 60 70 A G H > S+ 0 0 0 -7,-2.1 4,-1.7 1,-0.2 -7,-0.1 0.734 121.8 53.8 -62.0 -27.7 20.8 -23.1 1.7 61 71 A Y H > S+ 0 0 2 -8,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.931 111.0 46.2 -67.7 -47.5 23.1 -26.1 2.1 62 72 A A H > S+ 0 0 19 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.813 111.2 52.3 -65.2 -34.4 21.2 -27.1 5.3 63 73 A L H X S+ 0 0 1 -4,-2.0 4,-3.0 2,-0.2 -1,-0.2 0.910 109.6 49.4 -68.5 -42.8 17.8 -26.6 3.6 64 74 A C H X S+ 0 0 0 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.925 111.1 48.4 -61.3 -48.2 18.9 -28.8 0.7 65 75 A R H X S+ 0 0 122 -4,-2.3 4,-0.6 1,-0.2 -1,-0.2 0.919 114.4 47.7 -56.7 -46.0 20.1 -31.6 3.0 66 76 A W H >X S+ 0 0 67 -4,-2.2 3,-1.1 1,-0.2 4,-1.1 0.928 110.3 50.8 -59.0 -50.7 16.8 -31.3 4.9 67 77 A L H >< S+ 0 0 0 -4,-3.0 3,-0.5 1,-0.3 -2,-0.2 0.872 108.5 51.6 -56.7 -41.5 14.6 -31.3 1.8 68 78 A K H 3< S+ 0 0 40 -4,-2.3 -1,-0.3 28,-0.2 -2,-0.2 0.632 105.5 58.2 -74.9 -12.4 16.3 -34.4 0.5 69 79 A G H << S+ 0 0 44 -3,-1.1 -1,-0.2 -4,-0.6 -2,-0.2 0.764 87.1 88.4 -81.7 -29.0 15.6 -36.1 3.8 70 80 A Q S 4 S+ 0 0 8 -3,-0.2 3,-1.6 -6,-0.2 -5,-0.1 0.664 86.4 83.8-101.6 -20.2 9.6 -33.2 -0.5 74 84 A R T 3< S+ 0 0 133 -4,-2.2 -1,-0.1 1,-0.3 -2,-0.1 0.703 85.4 63.3 -54.7 -24.0 12.8 -34.9 -1.9 75 85 A T T 3 S+ 0 0 103 -3,-0.2 -1,-0.3 -4,-0.1 -2,-0.1 0.694 77.1 97.0 -80.1 -23.1 11.1 -34.9 -5.4 76 86 A I S < S- 0 0 10 -3,-1.6 -28,-0.2 -9,-0.1 2,-0.1 -0.586 82.6-118.5 -69.9 121.3 10.8 -31.1 -5.7 77 87 A P - 0 0 6 0, 0.0 -28,-2.6 0, 0.0 2,-0.4 -0.420 29.2-157.8 -62.4 133.3 13.8 -29.8 -7.8 78 88 A V E -c 49 0A 0 -30,-0.2 22,-1.3 -2,-0.1 21,-1.2 -0.962 7.7-157.8-117.8 130.4 16.1 -27.4 -5.9 79 89 A I E -cd 50 100A 0 -30,-2.5 -28,-2.9 -2,-0.4 2,-0.6 -0.946 11.5-152.0-104.2 121.9 18.4 -24.9 -7.5 80 90 A L E -cd 51 101A 0 20,-3.1 22,-2.5 -2,-0.6 2,-0.7 -0.868 0.6-156.4 -93.6 119.9 21.3 -23.8 -5.3 81 91 A L E +cd 52 102A 8 -30,-3.1 -28,-0.5 -2,-0.6 2,-0.3 -0.898 34.4 166.3 -91.5 117.1 22.6 -20.3 -6.0 82 92 A T E - d 0 103A 1 20,-2.5 22,-2.3 -2,-0.7 2,-0.5 -0.878 39.9-139.3-136.8 154.4 26.1 -20.5 -4.7 83 93 A I - 0 0 90 -2,-0.3 2,-0.9 20,-0.2 3,-0.2 -0.990 14.2-159.2-117.5 124.3 29.4 -18.7 -4.6 84 94 A L + 0 0 86 -2,-0.5 19,-0.0 1,-0.2 -2,-0.0 -0.753 37.7 138.8-103.4 87.1 32.5 -21.0 -4.9 85 95 A S + 0 0 92 -2,-0.9 -1,-0.2 1,-0.2 3,-0.0 0.634 68.2 18.3-108.3 -17.4 35.4 -18.9 -3.5 86 96 A D S >> S- 0 0 63 -3,-0.2 3,-1.7 1,-0.0 4,-1.1 -0.964 86.9 -96.1-146.4 160.8 37.3 -21.5 -1.4 87 97 A P H 3> S+ 0 0 102 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.755 119.3 61.3 -47.0 -33.9 37.4 -25.4 -1.2 88 98 A R H 3> S+ 0 0 153 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.810 100.6 54.5 -63.9 -32.0 34.9 -25.5 1.7 89 99 A D H <> S+ 0 0 22 -3,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.900 109.5 47.7 -64.2 -43.1 32.3 -23.9 -0.6 90 100 A V H X S+ 0 0 64 -4,-1.1 4,-2.3 2,-0.2 -2,-0.2 0.920 113.6 46.9 -63.9 -46.0 32.9 -26.7 -3.1 91 101 A V H X S+ 0 0 72 -4,-2.3 4,-1.5 2,-0.2 -2,-0.2 0.912 111.8 49.8 -63.5 -45.2 32.7 -29.4 -0.4 92 102 A R H X S+ 0 0 98 -4,-2.5 4,-0.8 1,-0.2 -1,-0.2 0.868 112.9 47.8 -63.5 -37.2 29.5 -28.0 1.1 93 103 A S H >X S+ 0 0 8 -4,-1.9 3,-0.7 1,-0.2 4,-0.7 0.916 110.0 51.6 -66.8 -45.0 27.9 -27.8 -2.3 94 104 A L H 3< S+ 0 0 140 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.769 114.6 44.0 -65.5 -26.1 28.9 -31.4 -3.2 95 105 A E H 3< S+ 0 0 136 -4,-1.5 -1,-0.2 -5,-0.1 -2,-0.2 0.576 96.1 74.2 -93.2 -13.3 27.4 -32.7 0.0 96 106 A C H << S- 0 0 2 -4,-0.8 -28,-0.2 -3,-0.7 -2,-0.1 0.757 88.1-137.0 -82.3 -24.2 24.1 -30.8 0.1 97 107 A G < + 0 0 39 -4,-0.7 -19,-0.1 1,-0.2 -3,-0.1 0.794 38.0 164.7 76.6 30.2 22.4 -32.8 -2.7 98 108 A A - 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