==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 23-OCT-08 3EZO . COMPND 2 MOLECULE: MALONYL COA-ACYL CARRIER PROTEIN TRANSACYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BURKHOLDERIA PSEUDOMALLEI 1710B; . AUTHOR SSGCID,SEATTLE STRUCTURAL GENOMICS CENTER FOR INFECTIOUS . 307 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12243.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 236 76.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 21 6.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 24 7.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 22 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 118 38.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 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 1 0 0 1 0 3 1 3 0 1 1 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 0 2 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 PARALLEL BRIDGES PER LADDER . 1 0 0 1 0 1 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 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 0 A M 0 0 119 0, 0.0 2,-0.3 0, 0.0 266,-0.1 0.000 360.0 360.0 360.0 145.2 -49.3 17.5 -20.6 2 1 A K - 0 0 95 264,-0.4 267,-1.0 81,-0.1 266,-0.8 -0.585 360.0-166.5 -82.6 143.5 -46.9 16.1 -18.0 3 2 A F E -a 269 0A 28 -2,-0.3 81,-3.0 79,-0.2 82,-0.8 -0.945 11.1-146.4-131.2 158.8 -43.6 17.7 -17.3 4 3 A A E -ab 270 85A 0 265,-2.7 267,-3.0 -2,-0.3 2,-0.5 -0.887 7.1-147.9-111.4 146.8 -40.4 17.0 -15.5 5 4 A F E -ab 271 86A 0 80,-1.5 82,-1.4 -2,-0.3 2,-0.4 -0.973 12.0-166.5-109.2 131.3 -38.1 19.2 -13.6 6 5 A V E -ab 272 87A 0 265,-2.3 267,-2.7 -2,-0.5 82,-0.3 -0.968 9.8-148.5-115.5 137.1 -34.3 18.4 -13.6 7 6 A F E - b 0 88A 0 80,-2.0 82,-2.0 -2,-0.4 85,-0.2 -0.881 11.3-130.7-113.0 129.9 -32.0 20.2 -11.2 8 7 A P - 0 0 0 0, 0.0 87,-0.2 0, 0.0 2,-0.1 -0.217 19.0-161.8 -74.8 161.0 -28.3 21.0 -11.8 9 8 A G > - 0 0 5 1,-0.3 3,-1.2 82,-0.1 81,-0.1 -0.345 46.8 -19.8-119.3-151.3 -25.3 20.3 -9.6 10 9 A Q T 3 S+ 0 0 65 1,-0.2 -1,-0.3 79,-0.2 82,-0.1 -0.211 118.2 41.6 -58.2 144.9 -21.7 21.5 -9.2 11 10 A G T 3 S+ 0 0 57 -3,-0.1 -1,-0.2 49,-0.0 44,-0.0 0.308 91.9 86.3 100.7 -9.2 -20.2 23.2 -12.3 12 11 A S < + 0 0 9 -3,-1.2 -2,-0.1 265,-0.0 2,-0.1 0.411 67.0 105.9-100.5 1.0 -23.3 25.2 -13.2 13 12 A Q + 0 0 36 -4,-0.1 2,-0.3 41,-0.1 51,-0.0 -0.380 38.7 167.9 -84.2 157.0 -22.6 28.2 -10.9 14 13 A S > - 0 0 61 -2,-0.1 3,-1.8 32,-0.1 2,-0.1 -0.941 43.7 -91.2-160.7 154.7 -21.3 31.7 -11.9 15 14 A V T 3 S+ 0 0 62 1,-0.3 32,-0.2 -2,-0.3 31,-0.1 -0.465 114.2 17.7 -69.6 130.2 -20.9 35.0 -10.1 16 15 A G T > S+ 0 0 17 30,-2.7 3,-2.1 -2,-0.1 4,-0.3 0.436 80.8 137.3 89.8 3.5 -24.1 37.1 -10.7 17 16 A M T < S+ 0 0 23 -3,-1.8 3,-0.2 29,-0.4 -2,-0.1 0.688 74.4 40.9 -62.8 -23.7 -26.2 34.1 -11.7 18 17 A L T > S+ 0 0 10 25,-0.1 3,-1.4 1,-0.1 -1,-0.3 0.218 82.0 107.3-101.9 13.5 -29.3 35.2 -9.6 19 18 A N G X S+ 0 0 93 -3,-2.1 3,-2.0 1,-0.3 4,-0.2 0.899 74.5 57.4 -59.0 -39.5 -29.0 38.9 -10.4 20 19 A A G 3 S+ 0 0 60 -4,-0.3 3,-0.3 1,-0.3 -1,-0.3 0.702 107.7 48.6 -67.5 -19.0 -32.0 38.8 -12.7 21 20 A F G X S+ 0 0 2 -3,-1.4 3,-2.2 1,-0.2 -1,-0.3 0.208 75.7 115.6 -98.6 9.0 -34.1 37.5 -9.8 22 21 A A T < S+ 0 0 52 -3,-2.0 -1,-0.2 1,-0.3 -2,-0.1 0.738 80.3 42.7 -54.9 -27.6 -32.9 40.2 -7.3 23 22 A D T 3 S+ 0 0 132 -3,-0.3 2,-0.6 -4,-0.2 -1,-0.3 0.090 83.5 108.1-111.5 24.6 -36.4 41.7 -7.0 24 23 A V X> - 0 0 31 -3,-2.2 4,-2.2 1,-0.2 3,-0.9 -0.914 65.0-143.5-102.0 118.2 -38.4 38.4 -6.7 25 24 A A H 3> S+ 0 0 53 -2,-0.6 4,-2.2 1,-0.3 5,-0.2 0.866 96.0 50.3 -54.5 -44.7 -39.6 38.3 -3.1 26 25 A V H 3> S+ 0 0 25 2,-0.2 4,-1.9 1,-0.2 -1,-0.3 0.810 108.3 53.4 -67.6 -28.6 -39.3 34.4 -2.8 27 26 A V H <> S+ 0 0 1 -3,-0.9 4,-2.5 2,-0.2 5,-0.3 0.948 109.5 49.1 -68.4 -45.7 -35.7 34.5 -4.2 28 27 A R H X S+ 0 0 135 -4,-2.2 4,-1.9 -7,-0.3 -2,-0.2 0.897 112.1 48.0 -55.4 -42.5 -34.8 37.0 -1.6 29 28 A E H X S+ 0 0 123 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.844 110.3 52.1 -71.1 -33.7 -36.4 34.9 1.2 30 29 A T H X S+ 0 0 0 -4,-1.9 4,-2.7 2,-0.2 -2,-0.2 0.901 110.1 47.7 -67.9 -41.3 -34.6 31.8 -0.0 31 30 A L H X S+ 0 0 29 -4,-2.5 4,-2.3 2,-0.2 11,-0.4 0.873 112.5 51.1 -65.7 -35.9 -31.2 33.5 0.0 32 31 A D H X S+ 0 0 108 -4,-1.9 4,-2.6 -5,-0.3 -2,-0.2 0.922 110.1 48.2 -66.1 -43.9 -32.1 34.8 3.5 33 32 A E H X S+ 0 0 51 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.926 111.6 50.0 -62.2 -45.4 -33.0 31.3 4.6 34 33 A A H X S+ 0 0 0 -4,-2.7 4,-2.8 2,-0.2 6,-0.3 0.924 111.5 48.4 -58.3 -44.6 -29.7 29.9 3.2 35 34 A S H X S+ 0 0 22 -4,-2.3 4,-2.7 1,-0.2 5,-0.2 0.916 111.4 50.5 -64.1 -42.7 -27.6 32.7 4.9 36 35 A D H < S+ 0 0 122 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.936 114.5 43.8 -61.7 -43.9 -29.4 32.0 8.2 37 36 A A H < S+ 0 0 14 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.894 123.7 34.7 -66.9 -38.1 -28.7 28.2 7.9 38 37 A L H < S- 0 0 22 -4,-2.8 -2,-0.2 2,-0.2 -3,-0.2 0.645 100.1-123.9-100.0 -15.4 -25.0 28.6 6.7 39 38 A G S < S+ 0 0 71 -4,-2.7 2,-0.3 -5,-0.2 -3,-0.1 0.485 78.7 83.6 86.7 2.7 -23.8 31.7 8.7 40 39 A Q S S- 0 0 86 -6,-0.3 2,-1.3 -5,-0.2 -1,-0.2 -0.960 91.2 -91.8-133.0 162.1 -22.7 33.7 5.7 41 40 A D > + 0 0 87 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 -0.468 41.1 177.3 -70.4 94.1 -24.3 36.0 3.2 42 41 A I H > S+ 0 0 2 -2,-1.3 4,-2.8 -11,-0.4 5,-0.3 0.895 77.2 57.7 -70.9 -39.4 -25.2 33.6 0.3 43 42 A G H > S+ 0 0 17 -12,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.925 112.4 39.4 -49.7 -51.0 -26.8 36.3 -1.7 44 43 A K H >>S+ 0 0 128 2,-0.2 4,-3.4 3,-0.2 5,-0.8 0.899 111.5 58.1 -73.9 -35.7 -23.6 38.4 -1.8 45 44 A L H X5S+ 0 0 10 -4,-2.8 4,-1.8 1,-0.2 -2,-0.2 0.946 115.0 38.3 -53.7 -48.6 -21.4 35.3 -2.2 46 45 A I H <5S+ 0 0 3 -4,-2.8 -30,-2.7 2,-0.2 -29,-0.4 0.912 120.6 44.5 -67.9 -44.8 -23.3 34.5 -5.4 47 46 A A H <5S+ 0 0 27 -4,-2.4 -2,-0.2 -5,-0.3 -3,-0.2 0.883 132.8 15.9 -71.6 -38.2 -23.7 38.1 -6.6 48 47 A D H <5S+ 0 0 108 -4,-3.4 -3,-0.2 1,-0.2 -2,-0.2 0.584 86.7 155.2-116.0 -15.8 -20.2 39.3 -5.9 49 48 A G << - 0 0 14 -4,-1.8 -1,-0.2 -5,-0.8 2,-0.2 -0.475 52.1-129.1 65.3-129.4 -18.0 36.1 -5.4 50 49 A P >> - 0 0 80 0, 0.0 4,-2.1 0, 0.0 3,-0.8 0.546 30.7-124.1 -60.2 166.8 -15.1 36.3 -6.0 51 50 A A H 3> S+ 0 0 51 1,-0.2 4,-2.7 2,-0.2 5,-0.1 0.836 109.0 62.5 -55.6 -34.1 -15.2 33.3 -8.2 52 51 A D H 34 S+ 0 0 106 1,-0.2 -1,-0.2 2,-0.2 4,-0.1 0.873 109.4 41.1 -65.2 -34.0 -12.5 31.6 -6.1 53 52 A E H X4 S+ 0 0 86 -3,-0.8 3,-1.3 2,-0.2 -1,-0.2 0.905 114.4 51.2 -71.7 -45.2 -14.9 31.6 -3.1 54 53 A L H 3< S+ 0 0 1 -4,-2.1 -2,-0.2 1,-0.3 -3,-0.2 0.845 109.3 52.9 -64.8 -34.1 -17.9 30.7 -5.1 55 54 A N T 3< S+ 0 0 82 -4,-2.7 2,-0.4 -5,-0.2 -1,-0.3 0.382 74.7 112.4 -86.6 2.4 -16.0 27.7 -6.6 56 55 A L S X> S- 0 0 82 -3,-1.3 4,-3.1 1,-0.1 3,-2.6 -0.682 73.3-132.0 -69.1 128.7 -14.9 26.2 -3.3 57 56 A T H 3> S+ 0 0 27 -2,-0.4 4,-2.5 1,-0.3 -1,-0.1 0.824 105.5 61.2 -58.1 -35.6 -16.9 22.9 -3.3 58 57 A T H 34 S+ 0 0 54 1,-0.2 -1,-0.3 2,-0.2 59,-0.1 0.674 117.7 32.7 -61.7 -21.0 -18.1 23.5 0.3 59 58 A N H <> S+ 0 0 22 -3,-2.6 4,-2.7 -6,-0.2 -2,-0.2 0.757 113.7 59.3 -95.4 -44.1 -19.7 26.6 -1.1 60 59 A T H X S+ 0 0 3 -4,-3.1 4,-2.6 2,-0.2 5,-0.2 0.898 103.4 51.9 -55.8 -43.5 -20.6 25.4 -4.5 61 60 A Q H X S+ 0 0 0 -4,-2.5 4,-1.9 2,-0.2 5,-0.2 0.974 116.4 37.3 -65.9 -52.3 -22.8 22.5 -3.3 62 61 A P H > S+ 0 0 3 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.868 116.2 56.1 -65.0 -31.4 -25.0 24.7 -1.0 63 62 A V H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 -2,-0.2 0.904 109.4 44.8 -61.1 -42.8 -24.9 27.5 -3.5 64 63 A M H X S+ 0 0 0 -4,-2.6 4,-1.8 -5,-0.2 5,-0.2 0.822 112.9 50.5 -76.3 -30.4 -26.2 25.3 -6.3 65 64 A L H X S+ 0 0 0 -4,-1.9 4,-2.5 -5,-0.2 5,-0.2 0.933 115.3 44.5 -64.1 -49.9 -28.9 23.8 -4.0 66 65 A T H X S+ 0 0 0 -4,-2.5 4,-3.1 -5,-0.2 -2,-0.2 0.936 114.9 46.4 -60.3 -49.1 -30.0 27.4 -3.0 67 66 A A H X S+ 0 0 0 -4,-2.7 4,-1.5 2,-0.2 -1,-0.2 0.919 117.1 42.3 -66.8 -46.2 -29.9 28.8 -6.5 68 67 A A H X S+ 0 0 0 -4,-1.8 4,-1.5 2,-0.2 -1,-0.2 0.911 116.5 48.5 -67.8 -40.7 -31.8 26.0 -8.2 69 68 A Y H X S+ 0 0 27 -4,-2.5 4,-2.8 -5,-0.2 5,-0.2 0.907 106.8 56.7 -66.8 -38.4 -34.3 25.8 -5.3 70 69 A A H X S+ 0 0 0 -4,-3.1 4,-2.1 1,-0.2 -1,-0.2 0.895 106.7 51.1 -51.6 -43.4 -34.8 29.6 -5.4 71 70 A C H X S+ 0 0 0 -4,-1.5 4,-1.8 2,-0.2 -1,-0.2 0.858 108.7 50.3 -67.9 -34.6 -35.7 29.1 -9.0 72 71 A Y H X S+ 0 0 2 -4,-1.5 4,-2.0 2,-0.2 -2,-0.2 0.912 109.5 49.9 -67.5 -46.0 -38.2 26.4 -8.0 73 72 A R H X S+ 0 0 53 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.871 110.0 51.9 -62.1 -37.1 -39.8 28.6 -5.4 74 73 A A H X S+ 0 0 4 -4,-2.1 4,-1.9 -5,-0.2 -1,-0.2 0.869 105.8 55.3 -64.0 -40.0 -40.1 31.4 -8.1 75 74 A W H <>S+ 0 0 7 -4,-1.8 5,-2.7 2,-0.2 -2,-0.2 0.952 111.9 43.2 -56.7 -47.5 -41.8 29.0 -10.4 76 75 A Q H ><5S+ 0 0 86 -4,-2.0 3,-2.1 3,-0.2 -2,-0.2 0.900 110.0 54.5 -63.5 -48.5 -44.4 28.3 -7.7 77 76 A Q H 3<5S+ 0 0 112 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.791 107.6 53.5 -53.9 -34.7 -44.8 32.0 -6.7 78 77 A A T 3<5S- 0 0 51 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.394 126.6-103.6 -80.0 -1.6 -45.6 32.6 -10.4 79 78 A G T < 5 + 0 0 62 -3,-2.1 -3,-0.2 1,-0.2 -2,-0.1 0.634 63.1 162.1 86.8 15.7 -48.3 29.9 -10.3 80 79 A G < - 0 0 11 -5,-2.7 -1,-0.2 -6,-0.2 225,-0.0 -0.412 38.7-114.0 -70.2 142.9 -46.4 27.1 -12.0 81 80 A A - 0 0 62 1,-0.1 -1,-0.1 -2,-0.1 -6,-0.0 -0.269 32.8 -94.6 -72.8 161.0 -47.7 23.6 -11.6 82 81 A Q - 0 0 98 1,-0.1 -79,-0.2 2,-0.0 -1,-0.1 -0.558 43.8-116.8 -70.0 133.3 -45.9 20.8 -9.7 83 82 A P - 0 0 2 0, 0.0 -79,-0.2 0, 0.0 3,-0.1 -0.329 13.2-132.0 -64.5 160.3 -43.9 18.6 -12.1 84 83 A S S S+ 0 0 48 -81,-3.0 141,-0.8 1,-0.3 2,-0.3 0.667 87.3 12.3 -87.9 -18.1 -45.0 15.0 -12.3 85 84 A I E -bc 4 225A 7 -82,-0.8 -80,-1.5 139,-0.1 2,-0.3 -0.974 68.2-167.7-157.2 143.2 -41.4 13.7 -11.9 86 85 A V E +bc 5 226A 0 139,-2.5 141,-2.0 -2,-0.3 2,-0.3 -0.897 10.2 165.6-131.5 162.4 -38.1 15.2 -10.9 87 86 A A E -b 6 0A 0 -82,-1.4 -80,-2.0 -2,-0.3 2,-0.3 -0.938 13.5-157.2-160.7 163.3 -34.4 14.3 -10.9 88 87 A G E -b 7 0A 0 139,-0.4 2,-0.8 -2,-0.3 5,-0.3 -0.992 27.2-106.1-150.1 156.4 -31.1 16.1 -10.4 89 88 A H S > S- 0 0 24 -82,-2.0 3,-2.0 -2,-0.3 2,-0.5 -0.723 74.2 -60.3 -92.2 105.6 -27.5 15.5 -11.4 90 89 A S T >> S+ 0 0 14 -2,-0.8 3,-2.0 1,-0.3 4,-0.5 -0.434 140.8 22.1 61.7-105.9 -25.3 14.5 -8.3 91 90 A L H >> S+ 0 0 0 -2,-0.5 3,-1.8 1,-0.3 4,-0.8 0.893 119.7 66.6 -52.2 -38.8 -25.8 17.5 -6.0 92 91 A G H <> S+ 0 0 0 -3,-2.0 4,-2.1 1,-0.3 -1,-0.3 0.651 83.5 72.1 -59.7 -17.8 -29.0 18.3 -7.9 93 92 A E H <> S+ 0 0 5 -3,-2.0 4,-2.1 -5,-0.3 -1,-0.3 0.828 95.2 54.5 -66.1 -32.4 -30.6 15.1 -6.6 94 93 A Y H S+ 0 0 4 -4,-2.1 5,-2.6 2,-0.2 6,-1.1 0.835 111.0 49.0 -62.4 -33.5 -35.7 15.8 -3.0 98 97 A V H ><5S+ 0 0 5 -4,-1.7 3,-1.7 4,-0.2 -2,-0.2 0.949 110.6 48.0 -70.1 -50.3 -36.4 19.2 -1.5 99 98 A A H 3<5S+ 0 0 2 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.866 110.8 54.3 -54.3 -38.0 -38.8 20.2 -4.3 100 99 A A T 3<5S- 0 0 0 -4,-2.3 123,-2.9 -5,-0.2 124,-0.5 0.421 116.0-115.9 -79.5 0.2 -40.5 16.7 -3.8 101 100 A G T < 5S+ 0 0 32 -3,-1.7 -3,-0.2 2,-0.2 119,-0.1 0.631 85.0 117.1 78.0 9.6 -41.0 17.4 -0.1 102 101 A A S > - 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