==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 10-FEB-10 3LR4 . COMPND 2 MOLECULE: SENSOR PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BURKHOLDERIA PSEUDOMALLEI; . AUTHOR SEATTLE STRUCTURAL GENOMICS CENTER FOR INFECTIOUS DISEASE (S . 104 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6623.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 75 72.1 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 . 22 21.2 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 1.9 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 . 5 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 9 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 38 36.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 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 0 0 0 0 0 0 0 2 0 0 0 0 0 0 1 0 0 0 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 1 0 2 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 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 40 A A > 0 0 52 0, 0.0 4,-2.1 0, 0.0 5,-0.3 0.000 360.0 360.0 360.0 -74.8 0.5 7.5 9.3 2 41 A Q H > + 0 0 52 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.897 360.0 51.3 -47.6 -53.4 4.3 7.8 9.5 3 42 A R H > S+ 0 0 77 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.861 111.9 42.4 -60.3 -47.9 5.0 7.9 5.7 4 43 A V H > S+ 0 0 77 -3,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.939 116.6 49.9 -63.3 -44.6 2.5 10.7 4.7 5 44 A A H X S+ 0 0 0 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.885 107.8 54.3 -62.8 -39.4 3.6 12.7 7.7 6 45 A L H X S+ 0 0 83 -4,-2.7 4,-2.5 -5,-0.3 -1,-0.2 0.915 109.8 46.5 -62.5 -42.8 7.2 12.3 6.9 7 46 A Q H X S+ 0 0 54 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.911 113.5 47.6 -65.1 -45.2 6.8 13.6 3.4 8 47 A L H X S+ 0 0 36 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.891 112.0 51.0 -63.6 -40.0 4.7 16.6 4.5 9 48 A V H X S+ 0 0 9 -4,-2.6 4,-3.0 -5,-0.2 5,-0.2 0.952 109.1 51.3 -59.9 -45.5 7.3 17.3 7.2 10 49 A A H X S+ 0 0 42 -4,-2.5 4,-2.7 1,-0.2 5,-0.3 0.925 111.0 48.2 -60.3 -45.6 10.1 17.2 4.6 11 50 A I H X S+ 0 0 63 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.928 113.9 45.4 -59.3 -49.0 8.2 19.6 2.4 12 51 A V H X S+ 0 0 2 -4,-2.5 4,-3.0 1,-0.2 5,-0.2 0.928 114.9 48.0 -63.2 -46.4 7.6 22.1 5.2 13 52 A K H X S+ 0 0 113 -4,-3.0 4,-2.5 2,-0.2 -2,-0.2 0.912 113.7 45.8 -61.4 -45.9 11.1 21.9 6.5 14 53 A L H X S+ 0 0 120 -4,-2.7 4,-2.4 -5,-0.2 -1,-0.2 0.884 114.6 49.3 -64.6 -38.3 12.7 22.3 3.1 15 54 A T H X S+ 0 0 6 -4,-2.5 4,-2.2 -5,-0.3 -2,-0.2 0.946 112.3 46.1 -65.0 -48.6 10.4 25.2 2.3 16 55 A R H X S+ 0 0 83 -4,-3.0 4,-3.3 1,-0.2 -2,-0.2 0.924 113.2 52.1 -58.9 -43.0 11.1 27.0 5.6 17 56 A T H X S+ 0 0 61 -4,-2.5 4,-2.5 -5,-0.2 -1,-0.2 0.911 106.4 51.9 -59.2 -46.8 14.8 26.4 5.0 18 57 A A H < S+ 0 0 37 -4,-2.4 4,-0.3 1,-0.2 -1,-0.2 0.932 115.2 42.8 -56.6 -46.6 14.7 27.9 1.5 19 58 A L H >< S+ 0 0 8 -4,-2.2 3,-1.1 1,-0.2 -2,-0.2 0.918 111.8 54.7 -64.9 -44.8 13.0 31.0 3.0 20 59 A L H 3< S+ 0 0 66 -4,-3.3 -2,-0.2 1,-0.2 -1,-0.2 0.875 117.2 33.9 -56.8 -46.6 15.3 31.1 6.1 21 60 A Y T 3< S+ 0 0 187 -4,-2.5 -1,-0.2 -5,-0.1 -2,-0.2 0.296 93.1 130.0 -94.3 7.4 18.6 31.2 4.0 22 61 A S S < S- 0 0 20 -3,-1.1 5,-0.1 -4,-0.3 -3,-0.1 -0.247 70.0-106.2 -69.1 147.5 17.1 33.2 1.1 23 62 A D >> - 0 0 88 1,-0.2 3,-1.7 3,-0.1 4,-0.6 -0.606 31.9-134.4 -65.7 121.3 18.8 36.3 -0.3 24 63 A P G >4 S+ 0 0 97 0, 0.0 3,-0.8 0, 0.0 4,-0.3 0.842 104.6 55.7 -53.5 -31.8 16.5 39.0 1.0 25 64 A D G 34 S+ 0 0 142 1,-0.2 4,-0.2 2,-0.1 3,-0.2 0.729 112.6 42.1 -70.4 -22.3 16.4 40.7 -2.4 26 65 A L G <> S+ 0 0 91 -3,-1.7 4,-2.9 1,-0.1 -1,-0.2 0.332 82.9 103.6-105.2 5.9 15.2 37.5 -4.0 27 66 A R H S+ 0 0 180 -4,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.909 113.4 50.6 -67.0 -40.8 9.6 37.5 -3.3 29 68 A A H > S+ 0 0 60 -4,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.895 108.3 54.0 -61.3 -42.1 11.0 35.7 -6.5 30 69 A L H X S+ 0 0 41 -4,-2.9 4,-2.8 1,-0.2 5,-0.2 0.925 104.5 53.5 -57.6 -46.5 11.6 32.6 -4.3 31 70 A L H X S+ 0 0 26 -4,-2.0 4,-2.1 1,-0.2 11,-0.2 0.874 108.4 50.6 -57.5 -39.5 8.0 32.6 -3.2 32 71 A Q H X S+ 0 0 109 -4,-1.7 4,-2.8 2,-0.2 5,-0.3 0.915 110.7 48.9 -63.0 -43.5 6.9 32.7 -6.9 33 72 A D H X>S+ 0 0 73 -4,-2.2 4,-3.0 2,-0.2 5,-1.2 0.941 110.4 50.2 -61.1 -48.6 9.2 29.7 -7.7 34 73 A L H X5S+ 0 0 12 -4,-2.8 6,-2.9 3,-0.2 4,-0.8 0.921 116.0 42.9 -57.6 -46.9 7.9 27.6 -4.8 35 74 A E H X5S+ 0 0 83 -4,-2.1 4,-0.6 4,-0.3 -2,-0.2 0.954 124.5 31.8 -63.5 -52.6 4.3 28.2 -5.8 36 75 A S H <5S+ 0 0 90 -4,-2.8 -2,-0.2 -5,-0.2 -3,-0.2 0.902 131.9 28.1 -76.7 -43.6 4.7 27.8 -9.6 37 76 A N H <5S+ 0 0 111 -4,-3.0 -3,-0.2 -5,-0.3 -2,-0.1 0.762 133.2 29.1 -94.4 -32.5 7.5 25.2 -9.8 38 77 A E H < - 0 0 104 -2,-0.6 3,-2.2 1,-0.1 52,-0.0 -0.716 25.1-119.6 -95.5 150.4 -2.0 36.5 10.5 47 86 A K T 3 S+ 0 0 109 -2,-0.3 -1,-0.1 1,-0.3 -2,-0.0 0.825 115.3 50.6 -59.7 -28.5 -3.1 36.0 14.1 48 87 A T T 3 S+ 0 0 109 2,-0.1 2,-0.4 -3,-0.0 -1,-0.3 0.283 76.1 125.1 -93.4 6.9 -6.7 36.4 12.8 49 88 A D < - 0 0 24 -3,-2.2 2,-0.2 32,-0.0 -4,-0.0 -0.585 55.3-140.8 -63.2 127.2 -6.5 33.9 10.0 50 89 A K - 0 0 150 -2,-0.4 32,-2.5 2,-0.0 2,-0.3 -0.535 21.6-172.9 -89.0 154.2 -9.3 31.4 10.5 51 90 A F E -B 81 0A 82 30,-0.2 2,-0.4 -2,-0.2 30,-0.2 -0.990 18.5-147.3-147.9 158.3 -8.9 27.7 9.9 52 91 A K E -B 80 0A 108 28,-2.0 27,-2.8 -2,-0.3 28,-1.2 -0.988 27.7-120.0-126.8 132.9 -10.8 24.4 9.8 53 92 A L - 0 0 82 -2,-0.4 25,-0.2 25,-0.3 3,-0.1 -0.228 28.3-103.3 -67.4 154.2 -9.4 21.1 10.8 54 93 A Q - 0 0 31 23,-0.4 -1,-0.1 1,-0.1 23,-0.1 -0.504 54.7 -93.6 -63.7 147.9 -9.1 18.1 8.5 55 94 A P - 0 0 47 0, 0.0 2,-1.9 0, 0.0 5,-0.1 -0.253 31.1-108.6 -66.7 156.2 -11.9 15.6 9.4 56 95 A D S S+ 0 0 122 4,-0.1 2,-0.3 -3,-0.1 -3,-0.0 -0.635 76.9 126.9 -81.0 78.2 -11.2 12.8 11.9 57 96 A E > - 0 0 123 -2,-1.9 3,-2.1 0, 0.0 4,-0.2 -0.946 66.9 -18.5-129.1 155.6 -11.3 10.2 9.1 58 97 A S T 3 S- 0 0 115 -2,-0.3 3,-0.1 1,-0.2 4,-0.1 -0.259 123.6 -31.5 55.0-118.7 -8.9 7.5 8.1 59 98 A V T 3> S+ 0 0 55 1,-0.1 4,-3.1 2,-0.1 -1,-0.2 0.155 97.7 120.3-121.6 15.8 -5.4 8.3 9.6 60 99 A N H <> S+ 0 0 33 -3,-2.1 4,-3.1 1,-0.2 5,-0.2 0.880 77.1 46.6 -48.1 -50.6 -5.6 12.1 9.6 61 100 A R H > S+ 0 0 86 -4,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.860 113.7 48.6 -68.3 -35.7 -5.2 12.6 13.3 62 101 A L H > S+ 0 0 103 2,-0.2 4,-2.2 -3,-0.2 -1,-0.2 0.914 111.9 49.1 -65.6 -44.7 -2.3 10.1 13.4 63 102 A I H X S+ 0 0 15 -4,-3.1 4,-2.5 1,-0.2 -2,-0.2 0.964 112.6 48.8 -56.1 -49.9 -0.7 11.9 10.5 64 103 A E H X S+ 0 0 3 -4,-3.1 4,-2.5 1,-0.2 5,-0.2 0.877 108.2 53.8 -58.4 -41.3 -1.2 15.2 12.3 65 104 A H H X S+ 0 0 119 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.923 111.2 45.6 -57.8 -46.5 0.3 13.8 15.5 66 105 A D H X S+ 0 0 33 -4,-2.2 4,-1.3 2,-0.2 -2,-0.2 0.858 110.7 53.8 -67.7 -38.1 3.5 12.7 13.7 67 106 A I H >X S+ 0 0 0 -4,-2.5 4,-3.2 -5,-0.2 3,-0.5 0.960 110.6 45.6 -60.3 -50.5 3.7 16.1 11.9 68 107 A R H 3X S+ 0 0 73 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.898 107.3 58.2 -62.0 -39.6 3.5 18.0 15.2 69 108 A S H 3< S+ 0 0 68 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.862 118.1 33.4 -58.1 -31.8 6.1 15.7 16.8 70 109 A R H << S+ 0 0 123 -4,-1.3 -2,-0.2 -3,-0.5 -1,-0.2 0.826 129.5 32.4 -93.4 -34.8 8.5 16.7 14.1 71 110 A L H < S- 0 0 47 -4,-3.2 -3,-0.2 1,-0.2 -2,-0.2 0.731 123.1 -70.0 -96.0 -25.9 7.6 20.3 13.4 72 111 A G >< - 0 0 27 -4,-2.6 3,-2.1 -5,-0.4 -1,-0.2 -0.304 34.2-103.5 134.4 136.2 6.5 21.5 16.8 73 112 A D T 3 S+ 0 0 136 1,-0.3 -5,-0.1 -4,-0.1 -4,-0.1 0.739 117.8 57.4 -55.2 -27.8 3.6 21.0 19.2 74 113 A D T 3 S+ 0 0 147 -6,-0.1 -1,-0.3 -3,-0.1 2,-0.1 0.443 76.8 128.5 -90.8 1.6 2.1 24.4 18.2 75 114 A T < - 0 0 12 -3,-2.1 2,-0.4 -7,-0.1 -7,-0.1 -0.380 51.4-143.7 -59.0 129.5 1.8 23.5 14.5 76 115 A V - 0 0 17 -2,-0.1 14,-2.5 -8,-0.0 2,-0.4 -0.823 14.8-171.8 -92.8 132.1 -1.6 24.1 12.9 77 116 A I E + C 0 89A 1 -2,-0.4 -23,-0.4 12,-0.2 2,-0.3 -1.000 18.6 165.3-123.5 127.4 -2.7 21.5 10.3 78 117 A A E - C 0 88A 0 10,-2.4 10,-2.8 -2,-0.4 -25,-0.3 -0.921 47.0-140.5-144.6 157.8 -5.9 22.4 8.5 79 118 A Q E S+ 0 0 90 -27,-2.8 7,-2.1 -2,-0.3 2,-0.3 0.491 94.9 16.7 -97.8 -11.0 -8.0 21.6 5.5 80 119 A S E -BC 52 85A 12 -28,-1.2 -28,-2.0 5,-0.2 2,-0.4 -0.964 56.7-161.9-156.1 149.1 -8.8 25.3 5.0 81 120 A V E > S-BC 51 84A 2 3,-1.6 3,-2.1 -2,-0.3 -30,-0.2 -0.999 88.8 -8.7-129.6 130.6 -7.5 28.7 6.0 82 121 A N T 3 S- 0 0 70 -32,-2.5 -31,-0.1 -2,-0.4 -1,-0.1 0.849 131.4 -57.4 44.3 43.0 -9.8 31.7 5.5 83 122 A D T 3 S+ 0 0 126 1,-0.2 -1,-0.3 -33,-0.1 -32,-0.1 0.563 107.0 129.7 73.5 10.2 -12.2 29.3 3.6 84 123 A I E < -C 81 0A 79 -3,-2.1 -3,-1.6 2,-0.0 -1,-0.2 -0.882 56.1-131.0 -98.7 118.0 -9.5 28.4 1.1 85 124 A P E +C 80 0A 103 0, 0.0 2,-0.3 0, 0.0 -5,-0.2 -0.315 53.5 93.9 -69.3 149.6 -9.2 24.6 0.7 86 125 A G E S- 0 0 7 -7,-2.1 2,-0.7 17,-0.1 17,-0.2 -0.964 81.4 -66.0 164.8-173.6 -5.9 22.8 0.8 87 126 A V E - D 0 102A 18 15,-2.8 15,-2.5 -2,-0.3 2,-0.5 -0.950 58.7-170.1-102.4 109.9 -3.5 21.0 3.0 88 127 A W E +CD 78 101A 5 -10,-2.8 -10,-2.4 -2,-0.7 2,-0.4 -0.892 13.6 174.7-108.2 130.3 -2.4 23.8 5.3 89 128 A I E -CD 77 100A 0 11,-2.4 11,-2.3 -2,-0.5 -12,-0.2 -0.998 21.0-139.3-136.0 126.9 0.5 23.6 7.7 90 129 A S E + D 0 99A 6 -14,-2.5 2,-0.3 -2,-0.4 9,-0.2 -0.481 24.2 170.6 -82.7 155.7 1.8 26.5 9.8 91 130 A F E - D 0 98A 13 7,-2.2 7,-3.3 -2,-0.1 2,-0.3 -0.949 17.0-140.6-152.7 172.8 5.5 27.2 10.5 92 131 A K E - D 0 97A 90 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.969 11.4-163.0-136.6 146.0 7.6 30.0 12.0 93 132 A I E > S- D 0 96A 16 3,-2.6 3,-2.4 -2,-0.3 2,-0.1 -0.932 73.4 -59.3-125.5 110.2 10.8 31.8 11.4 94 133 A D T 3 S- 0 0 127 -2,-0.4 -1,-0.0 1,-0.3 0, 0.0 -0.351 122.6 -12.0 55.9-123.7 11.6 33.6 14.6 95 134 A D T 3 S+ 0 0 125 -3,-0.1 2,-0.4 -2,-0.1 -1,-0.3 0.506 118.8 96.3 -82.3 -7.4 8.8 36.0 15.4 96 135 A D E < - D 0 93A 77 -3,-2.4 -3,-2.6 -52,-0.0 2,-0.4 -0.743 61.1-153.1 -94.3 130.8 7.2 35.6 11.9 97 136 A D E + D 0 92A 56 -2,-0.4 -52,-2.8 -52,-0.4 2,-0.3 -0.834 17.4 179.3-103.6 142.7 4.4 33.1 11.4 98 137 A Y E -AD 44 91A 45 -7,-3.3 -7,-2.2 -2,-0.4 2,-0.4 -0.895 21.1-141.0-135.8 158.9 3.7 31.4 8.0 99 138 A W E -AD 43 90A 2 -56,-2.9 -56,-2.3 -2,-0.3 2,-0.5 -0.953 5.9-157.6-112.0 146.3 1.4 29.0 6.2 100 139 A V E -AD 42 89A 0 -11,-2.3 -11,-2.4 -2,-0.4 2,-0.5 -0.997 15.1-164.4-109.2 128.6 2.4 26.5 3.7 101 140 A A E +AD 41 88A 0 -60,-3.2 -60,-2.6 -2,-0.5 2,-0.3 -0.966 9.6 178.0-115.5 127.5 -0.6 25.5 1.5 102 141 A L E - D 0 87A 23 -15,-2.5 -15,-2.8 -2,-0.5 2,-0.3 -0.801 37.9 -94.9-115.3 161.6 -0.4 22.3 -0.7 103 142 A D 0 0 128 -64,-0.4 -17,-0.1 -2,-0.3 0, 0.0 -0.632 360.0 360.0 -72.6 139.3 -3.1 20.8 -2.9 104 143 A R 0 0 128 -2,-0.3 -1,-0.1 -25,-0.1 -17,-0.1 0.173 360.0 360.0 -57.7 360.0 -5.1 18.0 -1.2