==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-AUG-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 13-SEP-10 3OTT . COMPND 2 MOLECULE: TWO-COMPONENT SYSTEM SENSOR HISTIDINE KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTEROIDES THETAIOTAOMICRON; . AUTHOR Z.ZHANG,Q.LIU,W.A.HENDRICKSON . 1476 12 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 64309.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 940 63.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 1.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 579 39.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 20 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 26 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 32 2.2 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 . 6 0.4 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 . 154 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 102 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 42 2.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 0.9 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 4 0 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 RESIDUES PER ALPHA HELIX . 0 1 1 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 PARALLEL BRIDGES PER LADDER . 7 5 15 16 38 17 4 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 2 30 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 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 36 A Y 0 0 69 0, 0.0 267,-0.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 35.8 30.1 63.5 220.0 2 37 A Q + 0 0 175 1,-0.2 2,-0.3 265,-0.1 266,-0.1 0.737 360.0 35.0 -95.1 -23.7 30.6 60.4 222.1 3 38 A Q - 0 0 127 293,-0.1 2,-0.3 264,-0.1 -1,-0.2 -0.983 64.3-168.9-136.9 142.7 34.1 59.5 220.9 4 39 A F - 0 0 11 262,-2.1 2,-0.7 -2,-0.3 291,-0.2 -0.929 24.4-131.8-130.8 147.2 37.1 61.6 219.9 5 40 A D E -A 294 0A 57 289,-2.7 289,-2.3 -2,-0.3 2,-0.3 -0.934 35.8-148.0 -96.6 112.9 40.4 60.9 218.2 6 41 A N E -A 293 0A 31 -2,-0.7 2,-0.4 259,-0.2 287,-0.2 -0.689 13.9-166.9 -96.9 137.8 42.8 62.7 220.4 7 42 A I E -A 292 0A 12 285,-2.8 285,-2.4 -2,-0.3 2,-0.4 -0.974 1.5-164.6-132.5 135.5 46.1 64.3 219.1 8 43 A Y - 0 0 105 -2,-0.4 35,-0.2 283,-0.2 3,-0.1 -0.930 14.9-161.4-128.7 141.8 49.2 65.6 221.0 9 44 A L - 0 0 13 4,-0.5 4,-0.3 1,-0.5 3,-0.2 0.263 62.1 -75.1-104.4 9.3 52.0 67.8 219.8 10 45 A G - 0 0 46 1,-0.1 -1,-0.5 2,-0.1 281,-0.1 -0.384 55.1 -72.4 112.0 166.1 54.5 67.0 222.6 11 46 A A S S+ 0 0 102 1,-0.2 3,-0.4 -2,-0.1 -1,-0.1 0.769 127.4 48.5 -68.9 -32.6 54.9 67.9 226.2 12 47 A E S S+ 0 0 88 1,-0.2 2,-1.2 -3,-0.2 3,-0.3 0.951 109.7 51.4 -74.9 -47.1 55.9 71.6 225.5 13 48 A A + 0 0 0 -4,-0.3 -4,-0.5 1,-0.2 -1,-0.2 -0.492 65.3 132.0 -94.8 61.8 53.1 72.4 223.0 14 49 A S + 0 0 26 -2,-1.2 277,-2.5 -3,-0.4 2,-0.5 0.615 52.3 78.5 -85.8 -15.0 50.1 71.3 224.9 15 50 A V - 0 0 16 -3,-0.3 17,-1.4 275,-0.2 2,-0.5 -0.871 59.8-168.3-108.8 124.6 48.0 74.4 224.4 16 51 A V E +D 31 0B 0 272,-2.3 258,-0.3 -2,-0.5 259,-0.2 -0.931 14.5 168.5-116.4 122.5 46.2 74.8 221.0 17 52 A S E + 0 0 10 13,-2.0 2,-0.3 -2,-0.5 14,-0.1 0.588 60.1 10.2-109.3 -20.2 44.7 78.2 220.1 18 53 A C E -D 30 0B 12 12,-1.1 12,-2.6 41,-0.1 2,-0.3 -0.992 48.9-153.6-158.8 163.9 43.9 77.9 216.4 19 54 A F E -D 29 0B 9 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.958 9.4-176.2-132.0 144.5 43.5 75.8 213.3 20 55 A L E -D 28 0B 29 8,-2.0 8,-3.5 -2,-0.3 2,-0.5 -0.983 12.3-153.9-134.8 149.4 43.8 76.6 209.5 21 56 A Q E -D 27 0B 19 -2,-0.3 6,-0.2 6,-0.2 41,-0.1 -0.992 19.2-137.9-119.4 121.6 43.2 74.4 206.5 22 57 A D > - 0 0 0 4,-2.1 3,-2.4 -2,-0.5 46,-0.0 -0.228 33.8 -97.1 -71.5 168.1 45.0 75.4 203.4 23 58 A S T 3 S+ 0 0 80 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.636 123.9 55.4 -70.4 -10.6 43.2 75.2 200.1 24 59 A E T 3 S- 0 0 71 2,-0.1 -1,-0.3 0, 0.0 -2,-0.1 0.321 122.9-101.0-102.2 10.5 44.6 71.7 199.3 25 60 A G S < S+ 0 0 14 -3,-2.4 2,-0.2 1,-0.3 -2,-0.1 0.367 71.3 141.6 97.1 -9.1 43.3 70.3 202.5 26 61 A L - 0 0 12 1,-0.1 -4,-2.1 -5,-0.1 2,-0.5 -0.547 46.1-131.0 -74.5 135.1 46.4 70.2 204.9 27 62 A I E -DE 21 38B 0 11,-1.0 11,-2.3 -2,-0.2 2,-0.3 -0.750 18.9-161.7 -89.0 131.5 45.6 71.1 208.5 28 63 A W E -DE 20 37B 9 -8,-3.5 -8,-2.0 -2,-0.5 2,-0.4 -0.849 2.4-156.1-113.9 145.1 47.7 73.6 210.4 29 64 A I E -DE 19 36B 0 7,-3.2 7,-2.9 -2,-0.3 2,-0.7 -0.971 7.9-154.0-131.1 122.4 47.9 74.1 214.2 30 65 A G E +DE 18 35B 3 -12,-2.6 -13,-2.0 -2,-0.4 -12,-1.1 -0.869 28.6 176.3 -96.8 116.2 48.9 77.1 216.1 31 66 A S E -D 16 0B 0 3,-2.0 26,-2.6 -2,-0.7 3,-0.5 -0.546 47.9 -94.7-111.7 179.0 50.2 76.0 219.5 32 67 A N S S+ 0 0 39 -17,-1.4 24,-0.1 24,-0.3 -16,-0.1 0.547 125.4 40.0 -71.6 -4.7 51.8 77.7 222.5 33 68 A K S S- 0 0 68 1,-0.4 2,-0.3 -18,-0.2 22,-0.2 0.441 124.7 -69.8-121.6 -1.6 55.3 77.0 221.1 34 69 A G - 0 0 0 -3,-0.5 -3,-2.0 20,-0.3 -1,-0.4 -0.866 69.9 -32.4 140.4-173.6 54.8 77.6 217.3 35 70 A L E +E 30 0B 3 18,-0.3 11,-2.3 -2,-0.3 2,-0.3 -0.585 49.4 177.4 -83.1 140.1 53.2 76.3 214.2 36 71 A F E -EF 29 45B 4 -7,-2.9 -7,-3.2 -2,-0.3 2,-0.3 -0.854 15.0-149.8-125.9 165.5 52.6 72.6 213.5 37 72 A S E -EF 28 44B 8 7,-2.1 7,-2.5 -2,-0.3 2,-0.4 -0.951 5.1-156.9-127.2 159.5 50.9 70.7 210.7 38 73 A Y E -EF 27 43B 20 -11,-2.3 -11,-1.0 -2,-0.3 5,-0.2 -0.992 8.6-172.0-141.2 125.2 49.2 67.4 210.9 39 74 A D - 0 0 6 3,-1.5 627,-0.5 -2,-0.4 4,-0.1 0.335 60.2 -92.4-102.8 5.9 48.8 65.1 207.9 40 75 A G S S+ 0 0 4 2,-0.2 3,-0.1 626,-0.2 -2,-0.0 0.279 121.2 51.8 102.6 -8.5 46.4 62.5 209.5 41 76 A Y S S- 0 0 39 1,-0.4 2,-0.3 654,-0.0 623,-0.0 0.643 117.2 -2.7-120.7 -49.6 49.3 60.2 210.6 42 77 A S - 0 0 40 -35,-0.0 -3,-1.5 2,-0.0 -1,-0.4 -0.962 65.8-112.5-147.9 158.2 51.8 62.4 212.5 43 78 A T E -F 38 0B 47 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.653 25.8-160.1 -90.4 154.0 52.4 66.0 213.5 44 79 A Q E -F 37 0B 29 -7,-2.5 -7,-2.1 -2,-0.2 2,-0.2 -0.999 9.8-135.3-131.3 138.7 55.2 68.1 212.2 45 80 A Q E -F 36 0B 84 -2,-0.4 -9,-0.2 -9,-0.2 -11,-0.0 -0.609 9.9-168.1 -87.9 150.5 56.8 71.3 213.6 46 81 A H + 0 0 7 -11,-2.3 2,-0.3 -2,-0.2 -11,-0.2 -0.181 62.8 68.6-130.6 43.5 57.7 74.4 211.7 47 82 A F S S- 0 0 2 -13,-0.1 2,-0.4 -12,-0.1 -2,-0.1 -0.933 72.6-123.9-148.1 163.9 59.8 76.4 214.0 48 83 A T > - 0 0 50 -2,-0.3 3,-2.0 589,-0.0 6,-0.3 -0.961 38.2 -98.5-113.2 133.6 63.3 76.0 215.5 49 84 A Y T 3 S+ 0 0 200 -2,-0.4 3,-0.1 1,-0.2 -16,-0.0 -0.279 107.9 16.1 -43.6 120.3 63.9 75.9 219.3 50 85 A G T 3 S+ 0 0 64 1,-0.4 -1,-0.2 4,-0.1 2,-0.0 0.086 97.8 115.5 107.5 -20.0 65.1 79.4 220.3 51 86 A E S X S- 0 0 96 -3,-2.0 3,-1.5 1,-0.1 -1,-0.4 -0.305 82.8-103.1 -86.6 163.3 64.1 81.4 217.4 52 87 A N T 3 S+ 0 0 111 1,-0.2 22,-0.1 -3,-0.1 -1,-0.1 0.645 122.1 58.9 -52.8 -19.6 61.5 84.2 217.1 53 88 A N T 3 S+ 0 0 4 -5,-0.2 2,-1.7 1,-0.1 -18,-0.3 0.622 81.2 86.3 -90.3 -17.1 59.1 81.6 215.5 54 89 A N S < S+ 0 0 22 -3,-1.5 2,-0.3 -6,-0.3 -20,-0.3 -0.648 76.9 107.0 -76.2 80.1 59.3 79.3 218.6 55 90 A T S S- 0 0 20 -2,-1.7 -24,-0.2 -22,-0.2 2,-0.2 -0.981 79.1 -72.3-160.1 165.1 56.5 81.3 220.3 56 91 A R - 0 0 74 -2,-0.3 2,-0.5 -23,-0.2 17,-0.5 -0.444 40.7-152.4 -71.1 127.4 52.8 81.2 221.3 57 92 A I E +G 72 0C 0 -26,-2.6 -40,-0.3 -23,-0.2 15,-0.2 -0.933 16.8 177.0 -96.7 125.1 50.4 81.5 218.3 58 93 A Y E - 0 0 37 13,-2.9 2,-0.3 -2,-0.5 14,-0.1 0.731 63.1 -7.9 -96.3 -30.4 47.1 83.1 219.2 59 94 A C E -G 71 0C 15 12,-0.7 12,-2.0 38,-0.2 2,-0.3 -0.966 59.4-160.7-156.6 169.3 45.3 83.3 215.8 60 95 A G E -G 70 0C 19 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.993 7.8-173.2-156.7 157.3 45.9 82.8 212.1 61 96 A V E -G 69 0C 24 8,-2.0 8,-3.3 -2,-0.3 2,-0.5 -0.976 27.3-122.8-146.9 146.2 44.6 83.6 208.6 62 97 A I E -G 68 0C 42 -2,-0.3 2,-0.4 6,-0.2 6,-0.2 -0.824 29.5-163.9 -92.8 126.4 45.7 82.4 205.2 63 98 A I E >> -G 67 0C 2 4,-2.4 4,-2.4 -2,-0.5 3,-2.3 -0.894 62.1 -8.3-113.1 140.1 46.7 85.1 202.8 64 99 A D T 34 S- 0 0 25 -2,-0.4 1046,-0.5 1,-0.3 -1,-0.1 0.688 111.5 -78.6 57.0 20.6 47.2 85.0 198.9 65 100 A N T 34 S+ 0 0 41 2,-0.2 -1,-0.3 1,-0.1 3,-0.1 0.815 131.2 60.1 57.1 33.2 46.7 81.2 198.9 66 101 A T T <4 S+ 0 0 10 -3,-2.3 15,-1.2 1,-0.3 16,-0.8 0.458 85.3 72.4-161.5 -6.6 50.3 80.8 200.1 67 102 A Y E < -GH 63 80C 12 -4,-2.4 -4,-2.4 13,-0.2 2,-0.7 -0.956 54.1-150.4-121.4 139.9 51.0 82.6 203.5 68 103 A L E -GH 62 79C 0 11,-4.6 11,-2.8 -2,-0.4 2,-0.6 -0.928 15.3-162.4 -98.5 114.9 50.0 81.8 207.0 69 104 A Y E -GH 61 78C 17 -8,-3.3 -8,-2.0 -2,-0.7 2,-0.4 -0.881 14.9-172.1 -92.3 123.4 49.7 85.1 209.0 70 105 A M E -GH 60 77C 2 7,-2.9 7,-2.2 -2,-0.6 2,-0.3 -0.955 21.4-126.6-125.8 131.7 49.8 84.2 212.7 71 106 A G E +GH 59 76C 0 -12,-2.0 -13,-2.9 -2,-0.4 -12,-0.7 -0.602 38.2 171.2 -80.3 136.1 49.2 86.5 215.6 72 107 A T E > -GH 57 75C 4 3,-2.8 25,-1.8 -2,-0.3 3,-1.1 -0.834 50.9-101.6-136.7 166.9 52.0 86.6 218.2 73 108 A D T 3 S+ 0 0 55 -17,-0.5 23,-1.4 -2,-0.3 -16,-0.1 0.868 125.6 43.2 -53.9 -36.1 53.3 88.3 221.4 74 109 A N T 3 S- 0 0 129 21,-0.2 2,-0.4 -22,-0.1 -1,-0.2 0.377 126.3 -89.0-100.1 4.4 55.7 90.1 219.1 75 110 A G E < S-H 72 0C 1 -3,-1.1 -3,-2.8 22,-0.1 22,-0.5 -0.955 77.6 -16.8 132.2-115.7 53.4 91.0 216.2 76 111 A I E -H 71 0C 9 -2,-0.4 2,-0.5 -5,-0.2 -5,-0.2 -0.993 45.2-151.0-142.4 118.1 52.7 88.8 213.2 77 112 A L E -H 70 0C 7 -7,-2.2 -7,-2.9 -2,-0.4 2,-0.6 -0.837 14.4-156.3 -84.4 130.2 54.7 85.8 211.9 78 113 A V E -H 69 0C 1 -2,-0.5 9,-2.5 -9,-0.2 2,-0.5 -0.948 12.1-174.3-112.2 112.2 54.3 85.4 208.2 79 114 A Y E -HI 68 86C 2 -11,-2.8 -11,-4.6 -2,-0.6 2,-0.8 -0.930 17.6-152.1-113.6 117.3 54.9 81.8 207.0 80 115 A N E >> -HI 67 85C 14 5,-3.0 5,-1.6 -2,-0.5 4,-1.3 -0.827 12.3-170.7 -85.4 105.0 54.9 81.0 203.3 81 116 A Y T 45S+ 0 0 2 -15,-1.2 -1,-0.1 -2,-0.8 -14,-0.1 0.638 80.5 54.0 -80.6 -13.1 53.8 77.3 203.4 82 117 A R T 45S+ 0 0 26 -16,-0.8 564,-0.2 1,-0.1 561,-0.2 0.917 120.4 30.5 -84.3 -48.2 54.6 76.7 199.7 83 118 A A T 45S- 0 0 37 -17,-0.3 -2,-0.2 2,-0.2 -1,-0.1 0.720 103.9-135.2 -75.9 -19.1 58.2 77.8 199.9 84 119 A D T <5 + 0 0 6 -4,-1.3 2,-0.3 1,-0.3 -3,-0.2 0.977 63.4 117.4 56.8 56.9 58.3 76.7 203.5 85 120 A R E -J 106 0D 33 3,-2.6 3,-1.6 -2,-0.3 2,-0.6 -0.822 67.8 -58.0-130.5 98.6 37.7 92.1 204.6 104 139 A G T 3 S- 0 0 55 -2,-0.3 958,-0.1 1,-0.2 956,-0.0 -0.596 119.2 -23.5 68.1-109.9 38.5 92.1 200.8 105 140 A D T 3 S+ 0 0 10 -2,-0.6 15,-2.5 -3,-0.1 2,-0.5 0.082 121.2 92.1-122.7 21.9 42.1 93.0 200.7 106 141 A T E < -JK 103 119D 33 -3,-1.6 -3,-2.6 13,-0.2 2,-0.6 -0.970 64.6-148.2-112.9 128.1 42.4 94.8 204.1 107 142 A L E -JK 102 118D 0 11,-3.4 11,-1.9 -2,-0.5 2,-0.4 -0.886 8.2-146.8 -98.7 119.2 43.3 92.7 207.1 108 143 A W E -JK 101 117D 2 -7,-2.8 -7,-1.9 -2,-0.6 2,-0.5 -0.711 14.6-160.3 -78.1 132.1 41.8 93.8 210.4 109 144 A L E -JK 100 116D 0 7,-3.1 7,-2.7 -2,-0.4 2,-0.6 -0.974 6.5-163.5-118.2 125.6 44.1 93.2 213.4 110 145 A G E +JK 99 115D 0 -11,-3.2 -12,-3.0 -2,-0.5 -11,-2.2 -0.956 21.7 170.5-108.3 118.8 42.9 93.1 217.0 111 146 A A E > -JK 97 114D 1 3,-3.2 29,-2.4 -2,-0.6 3,-1.2 -0.746 49.9-101.6-122.1 171.5 45.6 93.4 219.6 112 147 A L T 3 S+ 0 0 55 -16,-1.9 -16,-0.1 1,-0.3 -15,-0.1 0.809 122.9 31.0 -61.2 -28.5 46.0 93.9 223.3 113 148 A N T 3 S- 0 0 126 -18,-0.4 2,-0.3 1,-0.2 -1,-0.3 -0.019 125.1 -9.8-122.5 27.5 46.7 97.7 222.8 114 149 A G E < -K 111 0D 3 -3,-1.2 -3,-3.2 24,-0.6 2,-0.4 -0.873 54.1-104.0 163.5 170.9 44.7 98.5 219.7 115 150 A L E +KL 110 128D 0 13,-1.3 13,-2.6 -2,-0.3 2,-0.3 -0.970 42.3 173.9-115.7 135.6 42.6 97.9 216.7 116 151 A Y E -KL 109 127D 44 -7,-2.7 -7,-3.1 -2,-0.4 2,-0.4 -0.945 27.6-144.9-138.8 155.0 44.2 98.2 213.2 117 152 A T E -KL 108 126D 17 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