==== 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 TRANSFERASE 23-MAR-06 2GFW . COMPND 2 MOLECULE: 3-OXOACYL-[ACYL-CARRIER-PROTEIN] SYNTHASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR S.M.SOISSON,G.PARTHASARATHY . 411 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16118.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 288 70.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 6.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 52 12.7 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 . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 1 0.2 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 . 23 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 44 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 118 28.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.5 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 3 2 0 0 0 3 0 0 0 0 2 3 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 1 1 1 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 PARALLEL BRIDGES PER LADDER . 1 1 2 0 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 ANTIPARALLEL BRIDGES PER LADDER . 1 1 0 0 0 0 0 0 0 1 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 0 234 0, 0.0 2,-0.3 0, 0.0 177,-0.1 0.000 360.0 360.0 360.0 74.8 75.2 6.9 50.1 2 3 A R - 0 0 72 175,-0.5 2,-0.3 174,-0.1 175,-0.1 -0.529 360.0-152.0 -71.5 124.4 72.3 9.1 49.2 3 4 A R - 0 0 90 -2,-0.3 239,-2.7 173,-0.1 2,-0.5 -0.728 4.5-142.7 -97.4 147.6 70.7 11.0 52.2 4 5 A V E +AB 241 256A 7 252,-0.6 252,-1.7 -2,-0.3 2,-0.3 -0.942 20.9 174.0-118.1 129.6 67.1 12.0 52.3 5 6 A V E -AB 240 255A 0 235,-2.9 235,-2.2 -2,-0.5 2,-0.5 -0.797 31.1-112.1-124.8 167.5 65.8 15.3 53.9 6 7 A V E +AB 239 254A 0 248,-3.2 247,-2.0 -2,-0.3 248,-1.0 -0.901 37.5 158.7-109.6 129.6 62.4 17.0 54.1 7 8 A T E + 0 0 0 231,-2.2 2,-0.3 -2,-0.5 244,-0.2 0.100 58.7 45.9-136.7 17.2 61.8 20.2 52.2 8 9 A G E -A 238 0A 0 230,-0.6 230,-2.0 80,-0.1 2,-0.3 -0.943 55.9-171.7-163.2 142.5 58.0 20.6 51.7 9 10 A L E +A 237 0A 3 73,-0.3 2,-0.3 -2,-0.3 77,-0.3 -0.990 7.4 169.1-142.4 147.5 54.9 20.1 53.9 10 11 A G E +A 236 0A 0 226,-1.6 226,-2.2 -2,-0.3 2,-0.3 -0.978 10.8 164.8-154.4 148.6 51.2 20.1 53.3 11 12 A M E -A 235 0A 0 -2,-0.3 2,-0.4 224,-0.2 224,-0.2 -0.915 27.9-168.7-173.0 147.8 48.3 19.2 55.5 12 13 A L E +A 234 0A 3 222,-2.0 222,-2.4 -2,-0.3 5,-0.2 -0.990 32.9 158.5-133.9 127.3 44.5 19.2 56.2 13 14 A S B > -K 16 0B 0 3,-2.7 3,-1.6 -2,-0.4 40,-0.4 -0.919 57.0 -96.0-146.3 169.4 43.5 18.0 59.7 14 15 A P T 3 S+ 0 0 3 0, 0.0 37,-0.2 0, 0.0 3,-0.1 0.640 124.4 46.0 -64.9 -14.2 40.7 18.3 62.1 15 16 A V T 3 S- 0 0 17 1,-0.3 10,-0.3 35,-0.1 2,-0.2 0.178 125.3 -4.6-115.6 20.1 42.5 21.2 63.9 16 17 A G B < -K 13 0B 15 -3,-1.6 -3,-2.7 9,-0.1 -1,-0.3 -0.725 48.2-129.8 160.7 148.2 43.6 23.2 60.8 17 18 A N S S+ 0 0 46 -5,-0.2 2,-0.3 -2,-0.2 -6,-0.2 0.177 93.4 45.1 -99.0 16.9 43.7 23.5 57.0 18 19 A T S > S- 0 0 65 1,-0.1 4,-1.8 -8,-0.1 5,-0.2 -0.919 88.6-108.1-145.3 171.3 47.4 24.3 56.8 19 20 A V H > S+ 0 0 12 -2,-0.3 4,-2.7 2,-0.2 5,-0.1 0.952 115.5 42.4 -67.3 -55.2 50.6 22.9 58.4 20 21 A E H > S+ 0 0 85 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.896 114.7 49.6 -63.8 -41.3 51.2 25.9 60.8 21 22 A S H > S+ 0 0 47 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.978 114.4 45.6 -61.1 -51.8 47.6 26.3 61.8 22 23 A T H X S+ 0 0 0 -4,-1.8 4,-1.8 1,-0.2 -2,-0.2 0.927 114.4 48.7 -53.2 -51.7 47.3 22.6 62.6 23 24 A W H X S+ 0 0 5 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.852 110.8 49.8 -57.4 -43.0 50.6 22.6 64.4 24 25 A K H X S+ 0 0 160 -4,-2.8 4,-1.8 1,-0.2 -2,-0.2 0.951 109.6 51.6 -63.5 -48.1 49.7 25.7 66.5 25 26 A A H <>S+ 0 0 5 -4,-2.9 5,-2.5 -10,-0.3 -2,-0.2 0.852 110.0 49.9 -56.8 -38.0 46.4 24.2 67.5 26 27 A L H ><5S+ 0 0 0 -4,-1.8 3,-1.7 -5,-0.2 -1,-0.2 0.883 107.5 50.2 -71.5 -41.9 48.1 21.0 68.7 27 28 A L H 3<5S+ 0 0 41 -4,-2.0 356,-0.7 1,-0.3 -1,-0.2 0.852 111.2 53.2 -65.9 -25.3 50.7 22.7 70.8 28 29 A A T 3<5S- 0 0 62 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.317 115.0-122.3 -84.7 3.5 47.7 24.6 72.4 29 30 A G T < 5 + 0 0 19 -3,-1.7 -3,-0.2 1,-0.2 2,-0.1 0.705 51.1 165.0 62.7 20.8 46.0 21.3 73.1 30 31 A Q < - 0 0 107 -5,-2.5 2,-0.3 -6,-0.2 -1,-0.2 -0.457 31.9-133.2 -70.5 143.0 42.9 22.1 71.0 31 32 A S - 0 0 34 -2,-0.1 306,-0.2 1,-0.1 305,-0.1 -0.743 11.9-163.3 -95.0 143.4 40.6 19.1 70.1 32 33 A G + 0 0 4 304,-3.3 19,-0.6 -2,-0.3 2,-0.3 0.420 54.9 116.1-104.1 -2.3 39.4 18.8 66.5 33 34 A I E +L 50 0C 6 303,-0.4 2,-0.3 17,-0.2 17,-0.2 -0.504 34.5 151.4 -75.1 127.3 36.6 16.3 67.5 34 35 A S E -L 49 0C 43 15,-2.5 15,-2.7 -2,-0.3 2,-0.2 -0.915 50.2 -74.8-145.2 171.3 33.0 17.4 67.0 35 36 A L E -L 48 0C 100 -2,-0.3 13,-0.3 13,-0.3 2,-0.2 -0.522 51.0-115.4 -73.5 139.4 29.6 15.8 66.3 36 37 A I + 0 0 10 11,-2.6 5,-0.2 -2,-0.2 -1,-0.1 -0.483 38.6 168.4 -71.7 142.6 29.1 14.6 62.7 37 38 A D + 0 0 136 -2,-0.2 -1,-0.1 3,-0.1 -2,-0.0 0.418 54.5 83.5-137.9 0.8 26.4 16.4 60.8 38 39 A H S S+ 0 0 96 1,-0.1 2,-0.3 2,-0.0 -2,-0.0 0.536 101.7 27.5 -86.1 -7.2 26.7 15.4 57.1 39 40 A F S S- 0 0 35 155,-0.1 2,-0.7 156,-0.0 -1,-0.1 -0.977 97.8 -90.3-147.4 154.5 24.6 12.2 57.6 40 41 A D - 0 0 122 -2,-0.3 3,-0.4 1,-0.1 -3,-0.1 -0.582 37.4-176.9 -69.9 110.4 21.9 11.2 60.1 41 42 A T > + 0 0 22 -2,-0.7 3,-0.5 -5,-0.2 -1,-0.1 0.142 46.5 113.2 -95.4 18.9 23.7 9.6 63.1 42 43 A S T 3 S+ 0 0 85 1,-0.2 -1,-0.2 5,-0.0 5,-0.0 0.875 84.4 37.7 -56.5 -45.0 20.5 8.6 65.1 43 44 A A T 3 S+ 0 0 99 -3,-0.4 2,-0.3 3,-0.0 -1,-0.2 0.538 98.8 104.3 -84.0 -11.1 21.1 4.8 64.7 44 45 A Y < - 0 0 57 -3,-0.5 155,-0.1 1,-0.1 -3,-0.0 -0.583 62.0-152.2 -80.9 133.1 24.8 5.2 65.1 45 46 A A S S+ 0 0 60 -2,-0.3 2,-0.5 1,-0.1 166,-0.2 0.807 92.7 48.6 -71.0 -30.1 26.5 4.3 68.3 46 47 A T + 0 0 9 1,-0.1 -1,-0.1 152,-0.1 163,-0.1 -0.953 61.5 171.0-111.5 127.0 29.2 6.8 67.5 47 48 A K + 0 0 59 -2,-0.5 -11,-2.6 -4,-0.0 2,-0.3 0.363 55.5 66.6-117.4 4.3 28.0 10.2 66.5 48 49 A F E +L 35 0C 2 -13,-0.3 182,-0.4 -11,-0.0 2,-0.3 -0.836 50.0 161.7-124.3 162.8 31.2 12.3 66.5 49 50 A A E -L 34 0C 0 -15,-2.7 -15,-2.5 -2,-0.3 2,-1.0 -0.961 47.2 -90.0-164.3 173.3 34.5 12.4 64.5 50 51 A G E -Lm 33 231C 0 180,-3.4 182,-3.1 -2,-0.3 -17,-0.2 -0.829 54.9-177.0 -97.0 96.4 37.5 14.6 63.6 51 52 A L - 0 0 20 -2,-1.0 2,-0.6 -19,-0.6 -38,-0.1 -0.527 32.4-115.1 -95.5 160.0 36.3 16.5 60.5 52 53 A V > - 0 0 15 -2,-0.2 3,-0.5 -37,-0.1 2,-0.3 -0.857 38.0-139.4 -91.7 119.2 38.1 18.9 58.3 53 54 A K T 3 - 0 0 75 -2,-0.6 -40,-0.1 -40,-0.4 -36,-0.0 -0.672 69.7 -8.1 -88.1 135.1 36.2 22.3 58.7 54 55 A D T 3 S- 0 0 149 -2,-0.3 -1,-0.2 1,-0.2 2,-0.2 0.852 78.8-166.2 54.7 44.2 35.5 24.6 55.7 55 56 A F < - 0 0 49 -3,-0.5 2,-0.4 2,-0.0 -1,-0.2 -0.395 7.7-175.7 -62.4 130.0 37.5 22.6 53.2 56 57 A N + 0 0 89 -2,-0.2 -1,-0.0 1,-0.1 3,-0.0 -0.987 29.4 154.6-132.9 131.5 38.0 24.6 50.1 57 58 A C >> + 0 0 4 -2,-0.4 4,-3.8 4,-0.1 3,-1.0 0.161 40.1 121.1-134.5 14.5 39.7 23.6 46.9 58 59 A E T 34 S+ 0 0 93 1,-0.3 5,-0.2 2,-0.2 -1,-0.0 0.871 82.6 37.9 -44.3 -52.4 37.9 26.1 44.6 59 60 A D T 34 S+ 0 0 130 1,-0.1 -1,-0.3 3,-0.1 3,-0.1 0.628 123.8 44.3 -78.8 -13.9 41.0 27.7 43.4 60 61 A I T <4 S+ 0 0 49 -3,-1.0 2,-0.4 1,-0.3 -2,-0.2 0.796 116.2 33.9 -97.9 -40.2 42.9 24.4 43.3 61 62 A I S < S- 0 0 8 -4,-3.8 -1,-0.3 4,-0.0 2,-0.3 -0.986 80.4-124.1-126.1 123.3 40.5 21.9 41.7 62 63 A S >> - 0 0 62 -2,-0.4 3,-4.6 1,-0.2 4,-2.0 -0.476 23.0-126.0 -64.7 124.4 38.0 22.8 39.0 63 64 A R H 3> S+ 0 0 180 1,-0.3 4,-0.9 -2,-0.3 -1,-0.2 0.678 113.2 67.1 -46.3 -14.1 34.5 21.8 40.1 64 65 A K H 34 S+ 0 0 177 2,-0.2 -1,-0.3 1,-0.1 -2,-0.1 0.718 107.8 36.4 -77.0 -25.3 34.5 20.0 36.7 65 66 A E H X4 S+ 0 0 64 -3,-4.6 3,-2.6 2,-0.1 -2,-0.2 0.764 104.0 70.3 -96.5 -34.1 37.2 17.7 38.1 66 67 A Q H >< S+ 0 0 47 -4,-2.0 3,-1.8 1,-0.3 -2,-0.2 0.839 91.2 62.1 -50.6 -36.8 35.9 17.6 41.7 67 68 A R T 3< S+ 0 0 147 -4,-0.9 -1,-0.3 1,-0.3 -2,-0.1 0.688 99.8 55.8 -64.2 -21.5 33.0 15.5 40.3 68 69 A K T < S+ 0 0 61 -3,-2.6 2,-0.4 1,-0.1 -1,-0.3 0.233 104.0 64.4 -93.5 10.3 35.5 12.9 39.3 69 70 A M S < S- 0 0 6 -3,-1.8 66,-0.1 -4,-0.1 67,-0.1 -0.943 72.4-127.4-146.4 129.9 37.0 12.5 42.8 70 71 A D >> - 0 0 4 65,-2.2 4,-1.9 -2,-0.4 3,-1.0 -0.161 43.0-100.5 -59.9 158.2 36.0 11.3 46.3 71 72 A A H 3> S+ 0 0 29 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.761 122.0 58.1 -49.6 -34.7 36.7 13.6 49.2 72 73 A F H 3> S+ 0 0 0 119,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.867 107.0 48.1 -70.2 -31.3 39.9 11.7 50.2 73 74 A I H <> S+ 0 0 0 -3,-1.0 4,-2.3 62,-0.3 -2,-0.2 0.896 111.0 50.2 -73.1 -38.7 41.3 12.4 46.8 74 75 A Q H X S+ 0 0 28 -4,-1.9 4,-2.3 2,-0.2 5,-0.2 0.937 111.2 48.8 -65.1 -45.3 40.4 16.1 47.0 75 76 A Y H X S+ 0 0 20 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.902 112.9 49.2 -58.6 -43.3 42.0 16.3 50.5 76 77 A G H X S+ 0 0 0 -4,-1.9 4,-1.4 2,-0.2 -1,-0.2 0.893 109.2 49.7 -65.9 -41.8 45.1 14.6 49.1 77 78 A I H X S+ 0 0 0 -4,-2.3 4,-3.0 2,-0.2 3,-0.4 0.978 112.8 48.1 -62.5 -50.1 45.5 16.8 46.1 78 79 A V H X S+ 0 0 10 -4,-2.3 4,-2.6 1,-0.3 5,-0.2 0.943 113.2 45.0 -56.0 -54.4 45.2 20.0 48.1 79 80 A A H X S+ 0 0 0 -4,-2.5 4,-1.5 -5,-0.2 -1,-0.3 0.802 113.3 54.7 -61.1 -24.1 47.7 18.9 50.8 80 81 A G H X S+ 0 0 0 -4,-1.4 4,-2.2 -3,-0.4 -2,-0.2 0.926 107.1 48.5 -73.4 -45.2 49.9 17.8 47.8 81 82 A V H X S+ 0 0 7 -4,-3.0 4,-2.8 1,-0.2 5,-0.3 0.936 110.0 51.9 -60.2 -46.9 49.7 21.2 46.2 82 83 A Q H X S+ 0 0 46 -4,-2.6 4,-2.9 1,-0.2 -73,-0.3 0.902 110.6 49.4 -55.8 -42.8 50.6 22.8 49.6 83 84 A A H X S+ 0 0 0 -4,-1.5 4,-0.6 -5,-0.2 -1,-0.2 0.872 112.2 46.1 -64.7 -40.1 53.6 20.6 49.9 84 85 A M H X S+ 0 0 6 -4,-2.2 4,-1.0 2,-0.2 5,-0.5 0.892 115.4 46.6 -69.8 -44.2 54.8 21.3 46.3 85 86 A Q H >< S+ 0 0 136 -4,-2.8 3,-1.3 1,-0.2 -2,-0.2 0.978 111.1 51.1 -62.2 -55.4 54.4 25.0 46.7 86 87 A D H 3< S+ 0 0 45 -4,-2.9 -1,-0.2 -5,-0.3 165,-0.2 0.713 106.1 59.2 -54.4 -22.7 56.1 25.1 50.1 87 88 A S H 3< S- 0 0 9 -4,-0.6 -1,-0.3 -5,-0.2 -2,-0.2 0.815 92.5-144.1 -80.2 -29.5 58.9 23.2 48.6 88 89 A G << + 0 0 53 -3,-1.3 -3,-0.1 -4,-1.0 -2,-0.1 0.323 43.3 156.6 81.7 -6.8 59.8 25.8 45.9 89 90 A L - 0 0 17 -5,-0.5 2,-0.5 1,-0.1 -1,-0.3 -0.230 31.4-152.9 -56.1 130.4 60.6 22.9 43.5 90 91 A E - 0 0 138 -3,-0.1 2,-0.7 5,-0.0 -1,-0.1 -0.927 9.7-140.1-109.0 124.3 60.4 23.8 39.8 91 92 A I - 0 0 50 -2,-0.5 2,-0.2 4,-0.1 60,-0.0 -0.772 26.2-179.4 -88.9 115.4 59.6 20.9 37.5 92 93 A T >> - 0 0 67 -2,-0.7 4,-2.9 1,-0.1 3,-0.8 -0.572 44.0-103.7-104.8 170.7 61.6 21.0 34.3 93 94 A E T 34 S+ 0 0 158 1,-0.3 4,-0.5 2,-0.2 -1,-0.1 0.883 128.8 42.8 -62.5 -35.7 61.7 18.7 31.2 94 95 A E T 34 S+ 0 0 183 1,-0.1 -1,-0.3 2,-0.1 4,-0.1 0.504 116.9 52.1 -87.0 -3.1 65.0 17.3 32.5 95 96 A N T X4 S+ 0 0 20 -3,-0.8 3,-3.0 2,-0.1 4,-0.3 0.895 89.3 72.4 -92.5 -57.2 63.5 17.3 36.0 96 97 A A G >< S+ 0 0 9 -4,-2.9 3,-3.4 1,-0.3 56,-0.8 0.812 89.3 59.8 -24.2 -75.4 60.2 15.4 35.6 97 98 A T G 3 S+ 0 0 70 -4,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.593 107.5 47.6 -32.9 -27.4 61.7 11.9 35.1 98 99 A R G < S+ 0 0 75 -3,-3.0 84,-3.5 55,-0.1 85,-1.8 0.327 97.1 80.0-104.4 5.0 63.4 12.1 38.6 99 100 A I E < +c 183 0A 0 -3,-3.4 54,-2.4 -4,-0.3 53,-0.6 -0.968 58.4 153.2-119.0 123.0 60.5 13.3 40.7 100 101 A G E -c 184 0A 0 83,-3.0 85,-2.3 -2,-0.5 2,-0.3 -0.530 31.9-108.1-133.0-161.7 57.7 11.0 41.9 101 102 A A E -cd 185 155A 0 53,-1.7 55,-3.1 83,-0.3 2,-0.3 -0.999 13.7-179.7-144.3 138.2 55.0 10.1 44.4 102 103 A A E +cd 186 156A 0 83,-2.4 85,-1.9 -2,-0.3 2,-0.4 -0.791 35.0 149.0-134.1 85.8 54.3 7.5 47.2 103 104 A I E +c 187 0A 0 53,-1.8 39,-0.4 -2,-0.3 85,-0.2 -0.979 13.4 162.6-129.4 127.7 50.8 8.4 48.4 104 105 A G E -c 188 0A 0 83,-2.0 85,-1.9 -2,-0.4 2,-0.3 -0.610 23.5-149.9-130.0-170.1 48.2 6.0 49.9 105 106 A S - 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