==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-MAR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 01-JUN-09 3HNZ . 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) . 15711.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 295 71.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 7.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 54 13.1 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 . 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 . 2 0.5 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 . 29 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 47 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 112 27.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 2.2 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 2 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 . 5 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 . 2 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 0 219 0, 0.0 2,-0.4 0, 0.0 177,-0.1 0.000 360.0 360.0 360.0 75.8 68.9 -3.1 22.9 2 3 A R - 0 0 71 175,-0.5 2,-0.3 174,-0.1 175,-0.1 -0.626 360.0-152.7 -87.4 131.0 65.4 -1.6 23.2 3 4 A R - 0 0 92 -2,-0.4 239,-2.1 173,-0.1 2,-0.4 -0.743 9.6-143.2 -96.5 144.7 62.9 -1.0 20.3 4 5 A V E -AB 241 256A 8 252,-0.7 252,-2.8 -2,-0.3 2,-0.3 -0.923 21.0-179.4-110.6 130.5 60.2 1.7 20.4 5 6 A V E -AB 240 255A 0 235,-3.9 235,-2.6 -2,-0.4 2,-0.5 -0.836 29.2-114.3-124.9 162.2 56.8 1.0 18.9 6 7 A V E +AB 239 254A 0 248,-2.6 247,-2.4 -2,-0.3 248,-0.8 -0.880 35.4 165.0-102.4 123.6 53.6 3.2 18.6 7 8 A T E + 0 0 0 231,-2.4 244,-0.3 -2,-0.5 2,-0.3 0.133 60.6 32.4-122.8 19.7 50.6 1.9 20.6 8 9 A G E -A 238 0A 0 230,-0.7 230,-2.2 242,-0.1 2,-0.3 -0.890 54.2-171.6-173.2 141.0 48.3 4.9 20.5 9 10 A L E +A 237 0A 3 -2,-0.3 77,-0.3 228,-0.2 2,-0.3 -0.900 9.8 162.7-134.6 164.5 47.3 7.8 18.4 10 11 A G E +A 236 0A 0 226,-1.0 226,-2.6 -2,-0.3 2,-0.3 -0.858 10.1 161.0-175.7 144.5 45.1 10.9 18.9 11 12 A M E -A 235 0A 0 -2,-0.3 2,-0.4 224,-0.2 224,-0.2 -0.984 29.3-150.4-171.1 160.1 44.8 14.2 17.1 12 13 A L E +A 234 0A 3 222,-2.3 222,-2.0 -2,-0.3 5,-0.2 -0.993 33.5 167.4-135.6 124.8 42.7 17.3 16.4 13 14 A S B > -K 16 0B 0 3,-3.6 3,-1.8 -2,-0.4 40,-0.4 -0.928 53.3-102.6-141.1 165.9 43.2 18.8 12.9 14 15 A P T 3 S+ 0 0 2 0, 0.0 37,-0.2 0, 0.0 3,-0.1 0.694 125.5 42.6 -62.6 -11.7 41.6 21.4 10.6 15 16 A V T 3 S+ 0 0 15 1,-0.3 2,-0.2 35,-0.1 10,-0.2 0.288 126.3 0.6-115.4 10.2 40.2 18.3 8.7 16 17 A G B < -K 13 0B 12 -3,-1.8 -3,-3.6 8,-0.1 -1,-0.3 -0.839 46.6-135.7 171.4 150.5 39.0 16.2 11.6 17 18 A N S S+ 0 0 50 -5,-0.2 2,-0.3 -2,-0.2 -6,-0.2 0.229 91.0 46.6-105.9 16.3 38.7 15.7 15.4 18 19 A T S > S- 0 0 67 1,-0.1 4,-1.8 -8,-0.1 5,-0.1 -0.919 87.6-110.7-142.7 168.4 39.9 12.1 15.5 19 20 A V H > S+ 0 0 11 -2,-0.3 4,-2.2 2,-0.2 5,-0.2 0.978 118.1 44.9 -65.1 -53.0 42.8 10.2 14.1 20 21 A E H > S+ 0 0 87 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.874 113.1 47.7 -59.7 -44.0 40.5 8.2 11.7 21 22 A S H > S+ 0 0 46 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.897 113.3 50.6 -65.7 -38.4 38.3 11.2 10.6 22 23 A T H X S+ 0 0 0 -4,-1.8 4,-1.3 2,-0.2 -2,-0.2 0.880 112.0 46.1 -65.4 -42.7 41.5 13.2 9.9 23 24 A W H X S+ 0 0 5 -4,-2.2 4,-2.8 2,-0.2 5,-0.3 0.917 110.9 53.1 -65.8 -46.5 43.1 10.3 7.9 24 25 A K H X S+ 0 0 161 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.936 110.8 46.6 -55.7 -48.2 39.9 9.8 5.9 25 26 A A H <>S+ 0 0 2 -4,-2.2 5,-2.9 -10,-0.2 -1,-0.2 0.805 112.5 50.1 -63.2 -34.4 39.7 13.5 4.9 26 27 A L H ><5S+ 0 0 0 -4,-1.3 3,-1.5 3,-0.2 -2,-0.2 0.903 111.2 46.6 -73.3 -44.8 43.4 13.6 3.9 27 28 A L H 3<5S+ 0 0 42 -4,-2.8 356,-0.7 1,-0.3 -2,-0.2 0.873 109.9 57.5 -64.3 -33.0 43.2 10.5 1.7 28 29 A A T 3<5S- 0 0 65 -4,-2.0 -1,-0.3 -5,-0.3 -2,-0.2 0.146 115.1-118.0 -84.7 19.3 40.1 12.2 0.3 29 30 A G T < 5 + 0 0 26 -3,-1.5 -3,-0.2 1,-0.2 2,-0.1 0.650 56.5 165.0 51.5 25.7 42.0 15.3 -0.7 30 31 A Q < - 0 0 97 -5,-2.9 2,-0.2 -6,-0.2 -1,-0.2 -0.425 29.7-140.9 -70.5 140.1 39.9 17.4 1.6 31 32 A S - 0 0 26 -2,-0.1 306,-0.2 1,-0.1 305,-0.1 -0.634 13.6-170.5 -96.0 160.7 41.1 20.9 2.5 32 33 A G + 0 0 3 304,-2.0 19,-0.7 -2,-0.2 305,-0.1 0.396 48.6 120.4-125.1 -9.1 40.6 22.2 6.1 33 34 A I E +L 50 0C 2 303,-0.5 2,-0.3 17,-0.2 17,-0.2 -0.351 37.6 161.5 -63.7 133.6 41.6 25.8 5.3 34 35 A S E -L 49 0C 35 15,-2.0 15,-3.1 180,-0.1 2,-0.1 -0.966 43.6 -80.7-150.5 166.0 38.9 28.3 6.0 35 36 A L E -L 48 0C 103 -2,-0.3 2,-0.4 13,-0.3 13,-0.3 -0.407 50.7-113.9 -69.6 142.1 38.2 32.0 6.5 36 37 A I + 0 0 13 11,-2.6 5,-0.3 1,-0.1 -1,-0.1 -0.683 38.8 167.9 -83.2 128.6 39.0 33.2 10.0 37 38 A D + 0 0 134 -2,-0.4 -1,-0.1 1,-0.1 4,-0.1 0.742 58.4 80.1-108.8 -30.4 35.9 34.4 12.0 38 39 A H S S+ 0 0 86 2,-0.1 2,-0.3 1,-0.0 -1,-0.1 0.370 102.5 20.2 -62.1 0.3 37.2 34.7 15.6 39 40 A F S S- 0 0 32 -3,-0.1 2,-0.7 155,-0.1 -1,-0.0 -0.964 94.8 -82.0-166.4 150.4 38.8 38.1 15.1 40 41 A D + 0 0 123 -2,-0.3 3,-0.3 1,-0.2 4,-0.1 -0.410 40.2 175.4 -61.8 104.7 38.7 41.1 12.7 41 42 A T + 0 0 21 -2,-0.7 -1,-0.2 -5,-0.3 -5,-0.0 0.142 51.3 104.6 -95.0 17.3 40.8 40.1 9.8 42 43 A S S S+ 0 0 74 1,-0.2 -1,-0.2 5,-0.0 -2,-0.0 0.952 86.9 38.3 -61.2 -52.1 40.0 43.3 7.9 43 44 A A S S+ 0 0 98 -3,-0.3 2,-0.3 3,-0.0 -1,-0.2 0.604 101.5 102.7 -71.9 -16.3 43.4 44.9 8.6 44 45 A Y - 0 0 58 -4,-0.1 155,-0.1 1,-0.1 -3,-0.0 -0.533 64.3-150.7 -77.8 133.5 45.0 41.5 8.1 45 46 A A S S+ 0 0 66 -2,-0.3 2,-0.5 1,-0.1 166,-0.2 0.802 93.9 44.2 -67.3 -31.3 46.8 40.6 4.9 46 47 A T + 0 0 10 1,-0.1 -1,-0.1 152,-0.1 163,-0.1 -0.981 64.8 177.0-117.0 125.8 45.9 36.9 5.4 47 48 A K + 0 0 61 -2,-0.5 -11,-2.6 162,-0.1 2,-0.3 0.160 55.9 60.9-116.9 18.1 42.3 36.3 6.4 48 49 A F E +L 35 0C 3 -13,-0.3 182,-0.3 150,-0.0 2,-0.3 -0.881 48.1 164.9-139.3 168.6 42.2 32.5 6.5 49 50 A A E -L 34 0C 0 -15,-3.1 -15,-2.0 -2,-0.3 2,-1.1 -0.942 49.0 -88.4-173.0 162.5 43.8 29.5 8.4 50 51 A G E -Lm 33 231C 0 180,-3.9 182,-2.8 -2,-0.3 2,-0.2 -0.753 57.5-171.1 -85.6 100.3 43.2 25.7 9.0 51 52 A L - 0 0 17 -2,-1.1 2,-0.7 -19,-0.7 -38,-0.1 -0.603 29.7-109.3 -94.9 156.0 41.0 25.9 12.1 52 53 A V - 0 0 15 -2,-0.2 3,-0.5 -37,-0.1 2,-0.3 -0.731 41.4-132.7 -85.6 112.5 39.8 23.2 14.5 53 54 A K - 0 0 74 -2,-0.7 -40,-0.1 -40,-0.4 -1,-0.0 -0.505 68.7 -19.8 -76.7 128.2 36.1 22.9 13.8 54 55 A D S S- 0 0 154 -2,-0.3 2,-0.4 1,-0.2 -1,-0.2 0.935 78.6-162.8 41.6 71.3 33.6 22.8 16.7 55 56 A F - 0 0 49 -3,-0.5 2,-0.4 -43,-0.0 -1,-0.2 -0.687 9.8-176.3 -81.6 135.4 36.2 21.8 19.4 56 57 A N + 0 0 88 -2,-0.4 4,-0.1 1,-0.1 3,-0.1 -0.956 22.4 158.9-137.1 120.2 34.5 20.4 22.6 57 58 A C >> + 0 0 2 -2,-0.4 4,-4.1 2,-0.1 3,-1.4 0.419 42.4 112.6-118.6 2.6 36.4 19.4 25.7 58 59 A E T 34 S+ 0 0 76 1,-0.3 5,-0.1 2,-0.2 -1,-0.1 0.825 80.6 52.0 -41.3 -43.3 33.6 19.6 28.3 59 60 A D T 34 S+ 0 0 126 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.881 124.1 27.7 -63.8 -38.2 33.8 15.9 28.7 60 61 A I T <4 S+ 0 0 56 -3,-1.4 2,-0.5 1,-0.2 -2,-0.2 0.792 122.0 44.0 -95.1 -38.1 37.5 16.0 29.4 61 62 A I S < S- 0 0 8 -4,-4.1 2,-0.6 3,-0.0 -1,-0.2 -0.962 76.1-129.7-119.8 125.7 38.2 19.5 30.8 62 63 A S >> - 0 0 62 -2,-0.5 3,-5.2 1,-0.2 4,-1.7 -0.556 22.7-132.1 -66.3 113.0 36.1 21.1 33.5 63 64 A R H 3> S+ 0 0 167 -2,-0.6 4,-0.7 1,-0.3 -1,-0.2 0.642 112.1 62.2 -42.9 -14.4 35.4 24.6 32.1 64 65 A K H 34 S+ 0 0 175 2,-0.2 -1,-0.3 1,-0.1 -2,-0.1 0.754 109.0 40.1 -79.8 -30.3 36.5 25.7 35.6 65 66 A E H X4 S+ 0 0 64 -3,-5.2 3,-1.3 1,-0.1 -2,-0.3 0.684 105.0 66.9 -88.6 -24.0 39.8 24.2 34.7 66 67 A Q H >< S+ 0 0 37 -4,-1.7 3,-1.8 1,-0.3 -2,-0.2 0.794 86.3 70.1 -67.3 -31.9 39.7 25.5 31.1 67 68 A R T 3< S+ 0 0 130 -4,-0.7 -1,-0.3 1,-0.3 -2,-0.1 0.723 95.4 57.8 -57.8 -20.1 40.0 29.0 32.5 68 69 A K T < S+ 0 0 56 -3,-1.3 2,-0.3 1,-0.1 -1,-0.3 0.069 102.0 59.8-101.5 26.3 43.6 28.0 33.3 69 70 A M S < S- 0 0 5 -3,-1.8 66,-0.1 67,-0.1 67,-0.1 -0.961 72.2-122.3-159.6 137.8 44.7 27.1 29.9 70 71 A D >> - 0 0 7 65,-2.4 4,-2.6 -2,-0.3 3,-0.7 -0.305 42.7-104.9 -68.4 159.9 45.3 28.4 26.4 71 72 A A H 3> S+ 0 0 27 1,-0.3 4,-4.0 2,-0.2 5,-0.2 0.846 121.7 61.3 -52.6 -38.8 43.5 26.6 23.5 72 73 A F H 3> S+ 0 0 0 2,-0.2 4,-2.6 119,-0.2 -1,-0.3 0.917 107.7 43.9 -59.1 -38.6 46.8 25.1 22.5 73 74 A I H <> S+ 0 0 0 -3,-0.7 4,-2.7 62,-0.3 5,-0.3 0.942 114.5 49.8 -68.6 -47.1 46.9 23.4 25.9 74 75 A Q H X S+ 0 0 29 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.959 111.8 48.1 -53.8 -54.4 43.3 22.5 25.6 75 76 A Y H X S+ 0 0 15 -4,-4.0 4,-2.0 1,-0.2 5,-0.2 0.929 113.1 48.9 -50.0 -55.0 43.9 21.0 22.1 76 77 A G H X S+ 0 0 0 -4,-2.6 4,-1.6 -5,-0.2 -1,-0.2 0.853 110.0 48.8 -56.4 -44.3 46.9 19.0 23.3 77 78 A I H X S+ 0 0 1 -4,-2.7 4,-2.7 2,-0.2 -1,-0.2 0.927 111.0 51.4 -64.1 -43.0 45.2 17.5 26.4 78 79 A V H X S+ 0 0 9 -4,-2.3 4,-1.9 -5,-0.3 -2,-0.2 0.894 113.8 43.5 -59.8 -43.1 42.2 16.4 24.4 79 80 A A H X S+ 0 0 0 -4,-2.0 4,-1.7 -5,-0.2 -1,-0.2 0.754 111.5 56.3 -75.6 -24.6 44.4 14.7 21.8 80 81 A G H X S+ 0 0 0 -4,-1.6 4,-2.5 -5,-0.2 -2,-0.2 0.904 106.7 46.8 -73.2 -43.1 46.5 13.3 24.6 81 82 A V H X S+ 0 0 5 -4,-2.7 4,-3.6 2,-0.2 3,-0.4 0.987 108.2 57.9 -59.8 -56.2 43.5 11.5 26.2 82 83 A Q H X S+ 0 0 39 -4,-1.9 4,-2.9 1,-0.3 -73,-0.2 0.860 112.7 39.8 -37.2 -51.2 42.5 10.2 22.8 83 84 A A H X S+ 0 0 0 -4,-1.7 4,-0.9 2,-0.2 -1,-0.3 0.845 113.0 53.9 -71.5 -36.1 45.9 8.6 22.6 84 85 A M H X S+ 0 0 4 -4,-2.5 4,-1.2 -3,-0.4 5,-0.5 0.923 114.6 43.1 -64.1 -42.3 46.0 7.5 26.2 85 86 A Q H >< S+ 0 0 134 -4,-3.6 3,-1.3 1,-0.2 -2,-0.2 0.989 111.5 52.1 -65.7 -59.7 42.6 5.8 25.7 86 87 A D H 3< S+ 0 0 50 -4,-2.9 -1,-0.2 -77,-0.3 165,-0.2 0.622 105.3 58.4 -51.6 -17.3 43.5 4.3 22.3 87 88 A S H 3< S- 0 0 6 -4,-0.9 164,-0.4 -3,-0.3 -1,-0.3 0.885 94.2-145.5 -79.9 -38.5 46.6 2.8 23.9 88 89 A G << + 0 0 49 -3,-1.3 -3,-0.1 -4,-1.2 -2,-0.1 0.355 43.6 155.1 85.8 0.8 44.5 0.9 26.4 89 90 A L - 0 0 19 -5,-0.5 2,-0.5 1,-0.1 -1,-0.3 -0.271 33.2-155.2 -59.6 140.5 47.3 1.5 28.9 90 91 A E - 0 0 157 -3,-0.1 2,-0.3 2,-0.0 -1,-0.1 -0.961 12.9-140.4-124.3 108.3 46.4 1.4 32.6 91 92 A I - 0 0 45 -2,-0.5 2,-0.3 58,-0.1 60,-0.0 -0.548 26.2-177.2 -72.1 127.1 48.7 3.4 34.8 92 93 A T >> - 0 0 64 -2,-0.3 3,-3.8 1,-0.0 4,-1.9 -0.907 44.8-105.0-126.5 154.6 49.4 1.7 38.0 93 94 A E T 34 S+ 0 0 191 1,-0.3 4,-0.3 -2,-0.3 -2,-0.0 0.748 129.4 51.6 -48.1 -21.6 51.5 2.7 41.1 94 95 A E T 34 S+ 0 0 182 2,-0.1 -1,-0.3 1,-0.1 -3,-0.1 0.677 118.6 37.6 -86.3 -20.0 53.8 0.1 39.7 95 96 A N T X4 S+ 0 0 25 -3,-3.8 3,-4.0 2,-0.1 4,-0.3 0.904 90.4 79.9 -92.3 -64.1 53.7 1.9 36.3 96 97 A A G >< S+ 0 0 9 -4,-1.9 56,-3.1 1,-0.3 3,-1.4 0.660 89.0 60.4 -18.7 -49.4 53.6 5.6 36.7 97 98 A T G 3 S+ 0 0 71 -4,-0.3 -1,-0.3 55,-0.3 -2,-0.1 0.669 108.9 43.1 -61.1 -21.6 57.3 6.0 37.3 98 99 A R G < S+ 0 0 108 -3,-4.0 84,-3.9 55,-0.2 85,-1.7 0.204 100.0 79.0-112.4 10.4 58.1 4.5 33.9 99 100 A I E < +c 183 0A 0 -3,-1.4 54,-2.8 -4,-0.3 53,-0.7 -0.994 58.2 152.2-124.1 121.2 55.5 6.4 31.8 100 101 A G E -c 184 0A 0 83,-2.2 85,-1.7 -2,-0.5 2,-0.3 -0.470 32.2-116.8-131.0-160.2 56.3 9.9 30.9 101 102 A A E -cd 185 155A 0 53,-2.2 55,-2.1 83,-0.3 2,-0.4 -0.992 12.3-170.5-152.8 145.0 55.7 12.6 28.3 102 103 A A E +cd 186 156A 0 83,-2.5 85,-1.3 -2,-0.3 2,-0.4 -0.854 35.0 147.6-137.9 92.7 57.6 14.6 25.6 103 104 A I E +c 187 0A 0 53,-1.7 39,-0.5 -2,-0.4 85,-0.2 -0.934 11.1 155.7-138.3 114.8 55.1 17.3 24.3 104 105 A G E -c 188 0A 0 83,-1.4 85,-1.6 -2,-0.4 2,-0.3 -0.365 23.8-144.5-120.7-160.6 55.9 20.8 23.1 105 106 A S - 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