==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER BIOSYNTHETIC PROTEIN 09-APR-03 1UC9 . COMPND 2 MOLECULE: LYSINE BIOSYNTHESIS ENZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR H.SAKAI,M.N.VASSYLYEVA,T.MATSUURA,S.SEKINE,M.NISHIYAMA, . 509 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21451.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 369 72.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 5.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 92 18.1 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 . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 1.2 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 . 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 . 50 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 148 29.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.6 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 2 0 1 2 1 4 2 0 6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 0 2 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 PARALLEL BRIDGES PER LADDER . 5 2 2 4 0 4 2 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 2 2 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 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 1 A M 0 0 79 0, 0.0 49,-2.4 0, 0.0 50,-1.0 0.000 360.0 360.0 360.0 159.6 0.6 -35.9 24.4 2 2 A L E -ab 27 51A 0 24,-3.0 26,-1.3 47,-0.2 2,-0.5 -0.505 360.0-155.1 -80.5 145.8 0.3 -32.1 24.8 3 3 A A E -ab 28 52A 0 48,-1.9 50,-3.0 24,-0.2 2,-0.8 -0.985 2.6-155.6-125.4 124.1 -0.2 -29.8 21.8 4 4 A I E -ab 29 53A 0 24,-2.0 26,-1.9 -2,-0.5 2,-0.4 -0.853 13.8-153.6-100.8 105.1 0.8 -26.1 21.9 5 5 A L E +ab 30 54A 0 48,-2.1 50,-2.2 -2,-0.8 2,-0.3 -0.637 28.7 152.6 -80.7 127.7 -1.2 -24.2 19.3 6 6 A Y E -a 31 0A 34 24,-2.0 26,-2.0 -2,-0.4 50,-0.2 -0.948 35.6-174.5-149.3 167.9 0.5 -21.0 18.0 7 7 A D S S+ 0 0 15 1,-0.5 2,-0.4 48,-0.4 -1,-0.1 0.565 82.5 26.9-126.8 -60.8 0.8 -18.5 15.1 8 8 A R S S- 0 0 153 23,-0.0 2,-0.8 50,-0.0 -1,-0.5 -0.919 80.4-128.6-109.0 133.0 3.6 -16.0 15.9 9 9 A I + 0 0 64 -2,-0.4 47,-0.0 -3,-0.1 -3,-0.0 -0.719 32.4 175.9 -88.4 110.5 6.4 -17.1 18.3 10 10 A R >> - 0 0 30 -2,-0.8 4,-2.3 1,-0.1 3,-0.9 -0.622 49.8 -96.3-103.4 164.7 6.9 -14.6 21.2 11 11 A P H 3> S+ 0 0 66 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.853 125.4 60.5 -49.8 -34.6 9.4 -14.9 24.1 12 12 A D H 3> S+ 0 0 0 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.912 107.5 42.5 -60.0 -43.7 6.4 -16.3 26.1 13 13 A E H <> S+ 0 0 0 -3,-0.9 4,-2.2 2,-0.2 -1,-0.2 0.865 112.0 55.2 -70.6 -36.2 5.9 -19.2 23.7 14 14 A R H X S+ 0 0 118 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.933 107.9 48.7 -60.2 -47.5 9.7 -19.7 23.6 15 15 A M H X S+ 0 0 50 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.846 108.2 55.3 -62.4 -35.1 9.8 -20.0 27.3 16 16 A L H X S+ 0 0 0 -4,-1.5 4,-2.0 -5,-0.2 -1,-0.2 0.928 107.3 49.1 -64.5 -44.7 6.8 -22.5 27.2 17 17 A F H X S+ 0 0 6 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.940 111.8 49.3 -59.2 -49.0 8.8 -24.8 24.8 18 18 A E H X S+ 0 0 113 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.870 110.4 48.9 -60.2 -42.2 11.9 -24.7 27.0 19 19 A R H X S+ 0 0 73 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.886 108.8 52.7 -68.2 -37.8 10.0 -25.6 30.2 20 20 A A H X>S+ 0 0 0 -4,-2.0 5,-2.2 1,-0.2 4,-0.8 0.876 109.6 50.7 -63.9 -37.2 8.2 -28.5 28.6 21 21 A E H <5S+ 0 0 120 -4,-1.7 3,-0.3 2,-0.2 -1,-0.2 0.887 113.3 43.9 -66.5 -41.5 11.5 -29.9 27.4 22 22 A A H <5S+ 0 0 73 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.841 111.8 54.0 -73.2 -34.4 13.0 -29.6 30.9 23 23 A L H <5S- 0 0 58 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.638 106.4-126.3 -75.3 -14.1 9.9 -31.0 32.6 24 24 A G T <5 + 0 0 65 -4,-0.8 -3,-0.2 -3,-0.3 -4,-0.1 0.938 54.8 155.2 66.4 45.1 10.0 -34.1 30.4 25 25 A L < - 0 0 16 -5,-2.2 -1,-0.2 -6,-0.1 2,-0.1 -0.934 46.0-120.6-109.9 114.0 6.4 -33.5 29.4 26 26 A P + 0 0 65 0, 0.0 -24,-3.0 0, 0.0 2,-0.3 -0.297 53.5 136.9 -57.2 122.6 5.5 -35.0 25.9 27 27 A Y E -a 2 0A 43 -26,-0.2 2,-0.3 -2,-0.1 -24,-0.2 -0.938 36.2-148.8-156.1 177.4 4.3 -32.4 23.5 28 28 A K E -a 3 0A 65 -26,-1.3 -24,-2.0 -2,-0.3 2,-0.3 -0.983 25.2-113.5-154.4 148.9 4.5 -31.1 19.9 29 29 A K E -a 4 0A 92 -2,-0.3 2,-0.5 -26,-0.2 -24,-0.2 -0.685 27.0-163.5 -86.4 138.5 4.3 -27.6 18.2 30 30 A V E -a 5 0A 4 -26,-1.9 -24,-2.0 -2,-0.3 2,-1.0 -0.931 11.2-149.2-129.3 110.7 1.2 -27.0 16.0 31 31 A Y E > -a 6 0A 116 -2,-0.5 3,-0.9 -26,-0.2 -24,-0.2 -0.644 12.8-164.1 -78.5 101.6 1.2 -24.1 13.5 32 32 A V G > S+ 0 0 2 -26,-2.0 3,-2.9 -2,-1.0 338,-0.2 0.882 77.0 66.8 -56.7 -48.6 -2.4 -23.1 13.3 33 33 A P G 3 S+ 0 0 5 0, 0.0 337,-0.4 0, 0.0 -1,-0.2 0.823 111.1 38.8 -44.8 -33.9 -2.5 -20.9 10.1 34 34 A A G < S+ 0 0 38 -3,-0.9 -2,-0.2 336,-0.1 -3,-0.1 0.301 88.8 115.2-101.7 9.2 -1.7 -24.1 8.1 35 35 A L < - 0 0 5 -3,-2.9 2,-0.6 -4,-0.1 335,-0.2 -0.692 63.9-134.1 -84.9 122.2 -3.9 -26.5 10.1 36 36 A P - 0 0 36 0, 0.0 2,-0.8 0, 0.0 333,-0.1 -0.653 19.8-166.7 -76.4 115.5 -6.8 -28.0 8.0 37 37 A M E +D 368 0B 2 331,-0.7 331,-1.9 -2,-0.6 2,-0.6 -0.756 19.3 160.5-108.7 86.8 -9.9 -27.8 10.2 38 38 A V E > -DE 367 41B 7 -2,-0.8 3,-2.0 3,-0.5 329,-0.2 -0.925 41.1-121.9-107.8 119.1 -12.5 -30.0 8.6 39 39 A L T 3 S+ 0 0 18 327,-2.3 327,-0.3 -2,-0.6 33,-0.0 -0.304 96.9 25.8 -59.0 138.4 -15.4 -31.2 10.8 40 40 A G T 3 S+ 0 0 81 325,-0.1 2,-0.3 31,-0.1 -1,-0.3 0.332 110.3 76.6 91.8 -11.3 -15.6 -34.9 11.0 41 41 A E B < S-E 38 0B 109 -3,-2.0 -3,-0.5 0, 0.0 31,-0.1 -0.835 71.1-138.5-142.9 108.8 -11.9 -35.6 10.2 42 42 A R - 0 0 116 -2,-0.3 -5,-0.1 -5,-0.1 5,-0.0 -0.389 28.7-121.1 -63.0 126.2 -8.9 -35.3 12.5 43 43 A P > - 0 0 9 0, 0.0 3,-0.8 0, 0.0 4,-0.1 -0.162 16.8-116.6 -63.8 157.3 -5.8 -33.7 10.9 44 44 A K G > S+ 0 0 152 1,-0.2 3,-2.0 2,-0.2 -2,-0.1 0.895 113.2 60.9 -62.7 -42.5 -2.4 -35.5 10.7 45 45 A E G 3 S+ 0 0 74 1,-0.3 -1,-0.2 3,-0.0 -10,-0.0 0.707 102.9 52.0 -60.4 -20.3 -0.8 -32.9 12.9 46 46 A L G X S+ 0 0 0 -3,-0.8 3,-2.0 2,-0.1 -1,-0.3 0.344 75.6 131.0 -99.3 5.7 -3.2 -33.7 15.8 47 47 A E T < S+ 0 0 112 -3,-2.0 -3,-0.1 1,-0.3 0, 0.0 -0.433 80.5 10.1 -61.4 124.3 -2.5 -37.4 15.7 48 48 A G T 3 S+ 0 0 49 1,-0.3 2,-0.5 -2,-0.2 -1,-0.3 0.525 90.0 142.2 85.2 7.0 -1.8 -38.5 19.3 49 49 A V < + 0 0 3 -3,-2.0 -1,-0.3 1,-0.1 -47,-0.2 -0.716 20.3 170.9 -87.3 126.6 -2.9 -35.2 21.0 50 50 A T + 0 0 43 -49,-2.4 209,-2.2 -2,-0.5 2,-0.3 0.496 68.5 10.2-110.3 -9.3 -4.7 -35.6 24.3 51 51 A V E -b 2 0A 1 -50,-1.0 -48,-1.9 207,-0.2 2,-0.4 -0.949 66.9-147.3-165.6 148.4 -4.8 -32.0 25.5 52 52 A A E -bc 3 76A 0 23,-2.0 25,-3.5 -2,-0.3 2,-0.6 -0.949 9.6-150.2-130.9 148.3 -4.1 -28.6 24.0 53 53 A L E -bc 4 77A 7 -50,-3.0 -48,-2.1 -2,-0.4 2,-1.1 -0.949 23.1-142.5-112.6 112.5 -2.8 -25.2 25.1 54 54 A E E +b 5 0A 9 23,-1.0 -48,-0.1 -2,-0.6 -50,-0.1 -0.639 35.1 156.9 -81.9 98.7 -4.2 -22.4 23.0 55 55 A R + 0 0 8 -50,-2.2 -48,-0.4 -2,-1.1 2,-0.2 -0.091 13.9 140.6-115.7 35.5 -1.5 -19.8 22.4 56 56 A C - 0 0 6 -50,-0.2 -50,-0.1 1,-0.1 6,-0.1 -0.519 47.0-143.7 -80.2 145.2 -2.3 -17.8 19.3 57 57 A V S S+ 0 0 58 -2,-0.2 2,-0.5 -49,-0.1 -1,-0.1 0.877 86.2 76.5 -71.7 -36.8 -1.7 -14.0 19.1 58 58 A S > - 0 0 29 1,-0.2 4,-2.7 2,-0.0 5,-0.2 -0.644 69.2-157.5 -78.5 121.8 -4.8 -13.5 17.0 59 59 A Q H > S+ 0 0 58 -2,-0.5 4,-2.6 2,-0.2 5,-0.2 0.931 92.2 49.9 -63.2 -49.4 -8.0 -13.8 19.1 60 60 A S H > S+ 0 0 5 349,-0.3 4,-1.8 1,-0.2 -1,-0.2 0.902 115.0 45.4 -57.8 -42.2 -10.3 -14.6 16.2 61 61 A R H > S+ 0 0 38 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.938 112.6 49.4 -66.4 -48.5 -7.9 -17.4 15.1 62 62 A G H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.858 112.3 48.3 -60.6 -37.0 -7.4 -18.8 18.7 63 63 A L H X S+ 0 0 4 -4,-2.6 4,-1.8 2,-0.2 -1,-0.2 0.882 110.2 51.3 -71.8 -38.8 -11.1 -18.9 19.3 64 64 A A H X S+ 0 0 3 -4,-1.8 4,-1.8 -5,-0.2 -2,-0.2 0.918 113.0 45.9 -63.8 -44.0 -11.9 -20.6 16.0 65 65 A A H X S+ 0 0 1 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.918 109.3 54.4 -65.0 -44.5 -9.2 -23.3 16.7 66 66 A A H X S+ 0 0 0 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.864 108.6 50.4 -57.9 -37.5 -10.4 -23.8 20.3 67 67 A R H X S+ 0 0 24 -4,-1.8 4,-1.2 2,-0.2 -1,-0.2 0.908 107.9 52.2 -67.1 -42.5 -13.9 -24.5 19.0 68 68 A Y H >X S+ 0 0 0 -4,-1.8 4,-1.6 1,-0.2 3,-0.8 0.936 106.6 53.9 -58.9 -47.5 -12.6 -27.0 16.5 69 69 A L H 3<>S+ 0 0 0 -4,-2.5 5,-2.3 1,-0.3 3,-0.4 0.905 104.7 53.5 -56.0 -43.4 -10.8 -28.9 19.2 70 70 A T H ><5S+ 0 0 35 -4,-1.7 3,-0.5 1,-0.2 -1,-0.3 0.814 106.6 54.3 -62.7 -27.5 -14.0 -29.2 21.3 71 71 A A H <<5S+ 0 0 25 -4,-1.2 -1,-0.2 -3,-0.8 -2,-0.2 0.837 106.9 49.4 -73.3 -32.6 -15.6 -30.7 18.2 72 72 A L T 3<5S- 0 0 35 -4,-1.6 -1,-0.2 -3,-0.4 -2,-0.2 0.410 118.5-115.9 -83.0 1.0 -12.8 -33.4 18.0 73 73 A G T < 5 + 0 0 57 -3,-0.5 -3,-0.2 -4,-0.4 -2,-0.1 0.711 69.7 139.3 72.1 21.3 -13.4 -34.1 21.7 74 74 A I < - 0 0 3 -5,-2.3 -1,-0.2 -6,-0.2 -2,-0.1 -0.864 55.9-120.7-100.0 123.3 -9.9 -32.9 22.7 75 75 A P - 0 0 38 0, 0.0 -23,-2.0 0, 0.0 2,-0.4 -0.348 28.6-159.6 -63.3 138.7 -9.8 -30.8 25.9 76 76 A V E -c 52 0A 12 -25,-0.2 2,-1.0 -10,-0.1 -23,-0.2 -0.975 22.0-118.1-125.3 126.9 -8.4 -27.3 25.4 77 77 A V E S+c 53 0A 7 -25,-3.5 -23,-1.0 -2,-0.4 177,-0.1 -0.538 103.1 24.1 -73.5 107.3 -6.9 -25.1 28.1 78 78 A N S S- 0 0 12 -2,-1.0 -1,-0.1 -25,-0.1 133,-0.1 0.692 94.4-133.5 96.4 95.7 -9.1 -22.1 28.0 79 79 A R >> - 0 0 111 131,-0.2 4,-2.3 130,-0.1 3,-0.8 -0.276 24.6-101.3 -67.9 158.1 -12.4 -23.3 26.6 80 80 A P H 3> S+ 0 0 8 0, 0.0 4,-2.5 0, 0.0 5,-0.3 0.919 122.8 56.3 -47.5 -50.0 -14.2 -21.3 23.8 81 81 A E H 3> S+ 0 0 87 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.846 109.4 45.5 -53.0 -38.7 -16.6 -19.9 26.4 82 82 A V H <> S+ 0 0 0 -3,-0.8 4,-1.3 2,-0.2 -1,-0.2 0.901 110.5 52.9 -74.0 -42.7 -13.7 -18.6 28.5 83 83 A I H X S+ 0 0 1 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.899 116.6 37.9 -60.2 -43.2 -11.8 -17.1 25.6 84 84 A E H X S+ 0 0 29 -4,-2.5 4,-0.7 2,-0.2 -1,-0.2 0.852 111.3 58.4 -78.9 -33.3 -14.9 -15.1 24.3 85 85 A A H < S+ 0 0 18 -4,-1.8 -1,-0.2 -5,-0.3 -2,-0.2 0.762 113.9 41.8 -65.4 -22.3 -16.1 -14.2 27.8 86 86 A C H < S+ 0 0 8 -4,-1.3 143,-0.3 1,-0.1 -2,-0.2 0.887 107.9 53.9 -91.1 -45.8 -12.7 -12.6 28.3 87 87 A G H < S+ 0 0 12 -4,-2.1 2,-0.6 -5,-0.2 46,-0.5 0.506 100.2 71.8 -69.7 -2.6 -12.1 -10.8 25.0 88 88 A D B X -I 132 0C 6 -4,-0.7 4,-3.0 1,-0.1 3,-0.5 -0.904 66.7-161.5-118.6 103.5 -15.4 -9.0 25.3 89 89 A K H > S+ 0 0 25 42,-2.2 4,-2.3 -2,-0.6 5,-0.1 0.787 93.5 49.0 -53.2 -33.3 -15.5 -6.3 28.1 90 90 A W H > S+ 0 0 4 2,-0.2 4,-1.6 41,-0.2 -1,-0.3 0.844 111.4 49.7 -76.1 -34.8 -19.3 -6.3 28.3 91 91 A A H > S+ 0 0 10 -3,-0.5 4,-1.8 2,-0.2 -2,-0.2 0.950 113.2 47.3 -67.3 -45.9 -19.4 -10.0 28.5 92 92 A T H X S+ 0 0 3 -4,-3.0 4,-2.1 1,-0.2 -2,-0.2 0.923 110.7 49.2 -62.9 -44.8 -16.8 -10.0 31.3 93 93 A S H X S+ 0 0 1 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.853 109.6 53.8 -63.2 -34.5 -18.5 -7.2 33.4 94 94 A V H X S+ 0 0 8 -4,-1.6 4,-2.3 2,-0.2 -1,-0.2 0.909 108.5 49.1 -65.0 -42.1 -21.8 -9.1 33.1 95 95 A A H X S+ 0 0 15 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.901 110.4 50.2 -65.0 -41.7 -20.1 -12.2 34.5 96 96 A L H <>S+ 0 0 1 -4,-2.1 5,-2.8 1,-0.2 -1,-0.2 0.887 111.0 50.3 -64.6 -37.0 -18.6 -10.3 37.4 97 97 A A H ><5S+ 0 0 36 -4,-1.9 3,-1.6 3,-0.2 -2,-0.2 0.917 108.9 49.7 -66.5 -44.8 -22.0 -8.8 38.2 98 98 A K H 3<5S+ 0 0 129 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.828 110.5 51.8 -63.8 -31.5 -23.7 -12.1 38.2 99 99 A A T 3<5S- 0 0 49 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.364 115.2-119.1 -85.5 5.0 -21.0 -13.5 40.5 100 100 A G T < 5 + 0 0 65 -3,-1.6 -3,-0.2 1,-0.2 -2,-0.1 0.871 59.1 154.9 60.3 40.1 -21.6 -10.5 42.9 101 101 A L < - 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