==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE (ACYLTRANSFERASE) 02-SEP-92 1LAB . COMPND 2 MOLECULE: DIHYDROLIPOAMIDE ACETYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: GEOBACILLUS STEAROTHERMOPHILUS; . AUTHOR F.DARDEL,A.L.DAVIS,E.D.LAUE,R.N.PERHAM . 80 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5346.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 37 46.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 22 27.5 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 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 . 3 3.8 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 . 8 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 1 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+4), 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 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 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 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 3 2 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 A 0 0 129 0, 0.0 2,-0.3 0, 0.0 75,-0.2 0.000 360.0 360.0 360.0-177.1 1.9 -13.1 0.5 2 2 A F B -A 75 0A 78 73,-2.0 73,-0.7 1,-0.0 2,-0.1 -0.813 360.0-153.7-120.5 159.5 1.1 -9.8 2.3 3 3 A E - 0 0 73 -2,-0.3 3,-0.1 71,-0.2 68,-0.1 -0.318 19.5-127.4-117.8-161.0 -1.9 -7.6 1.5 4 4 A F S S+ 0 0 42 1,-0.4 2,-0.4 66,-0.2 67,-0.1 0.471 89.9 40.5-127.0 -21.9 -2.7 -3.9 1.8 5 5 A K S S- 0 0 39 65,-0.1 -1,-0.4 11,-0.0 64,-0.1 -0.987 72.1-142.1-132.5 145.2 -6.0 -4.1 3.6 6 6 A L - 0 0 123 -2,-0.4 2,-1.6 1,-0.1 3,-0.5 -0.360 57.6 -57.5 -89.4 173.3 -7.0 -6.3 6.5 7 7 A P S S+ 0 0 138 0, 0.0 -1,-0.1 0, 0.0 61,-0.0 -0.421 98.6 114.1 -42.5 80.9 -10.5 -7.9 6.9 8 8 A D + 0 0 48 -2,-1.6 6,-0.1 6,-0.1 4,-0.1 0.576 20.0 150.1-121.7 -72.6 -12.3 -4.4 7.0 9 9 A I S S+ 0 0 116 -3,-0.5 5,-0.1 1,-0.2 6,-0.0 0.781 82.0 29.6 37.4 40.6 -14.5 -4.3 3.8 10 10 A G S S+ 0 0 52 1,-0.2 -1,-0.2 5,-0.0 2,-0.1 0.410 95.8 92.6 167.7 -14.3 -16.9 -2.0 5.7 11 11 A E S > S- 0 0 143 2,-0.1 3,-0.9 4,-0.0 -1,-0.2 -0.361 88.9 -49.0-101.2-177.9 -15.4 0.2 8.4 12 12 A G T 3 S+ 0 0 67 1,-0.3 2,-0.4 -2,-0.1 3,-0.0 0.505 133.3 14.1 -4.5 -66.7 -14.0 3.7 8.9 13 13 A I T 3 S+ 0 0 82 1,-0.1 -1,-0.3 27,-0.1 -4,-0.1 -0.692 72.2 157.3-127.3 76.4 -11.6 3.7 5.9 14 14 A H < + 0 0 70 -3,-0.9 54,-0.5 -2,-0.4 2,-0.2 0.366 64.4 49.5 -82.0 4.3 -12.7 0.7 3.9 15 15 A E S S- 0 0 95 52,-0.2 2,-0.3 -4,-0.1 52,-0.3 -0.708 73.0-132.0-132.4-176.7 -11.1 2.2 0.8 16 16 A G E -B 66 0B 2 50,-2.7 50,-2.4 -2,-0.2 2,-0.7 -0.905 7.5-168.1-146.8 116.3 -7.9 3.8 -0.4 17 17 A E E -BC 65 39B 79 22,-0.9 22,-2.7 -2,-0.3 2,-0.5 -0.927 19.8-161.0-103.0 109.9 -7.4 7.0 -2.3 18 18 A I E + C 0 38B 5 46,-1.2 45,-1.7 -2,-0.7 20,-0.3 -0.860 17.5 174.3 -99.2 126.7 -3.8 6.9 -3.5 19 19 A V E + 0 0 76 18,-3.1 2,-0.3 -2,-0.5 44,-0.2 0.908 64.4 5.1 -93.9 -61.8 -2.3 10.3 -4.5 20 20 A K E - C 0 37B 86 17,-0.8 17,-1.8 42,-0.1 -1,-0.3 -0.950 58.0-163.2-130.4 151.0 1.3 9.6 -5.2 21 21 A W - 0 0 29 -2,-0.3 14,-0.0 15,-0.2 41,-0.0 -0.678 11.0-157.0-119.6 173.5 3.6 6.5 -5.3 22 22 A F + 0 0 66 -2,-0.2 2,-0.1 12,-0.1 -1,-0.1 0.362 62.1 91.5-133.3 -1.3 7.3 6.2 -5.2 23 23 A V - 0 0 21 1,-0.0 3,-0.3 3,-0.0 -2,-0.1 -0.430 52.6-161.9 -98.6 170.8 7.9 2.9 -6.9 24 24 A K S S- 0 0 172 1,-2.4 2,-0.1 -2,-0.1 -1,-0.0 -0.278 107.3 -46.2-139.2 48.0 8.6 1.6 -10.4 25 25 A P S S- 0 0 60 0, 0.0 -1,-2.4 0, 0.0 3,-0.2 0.608 71.6-114.4 -8.6 174.8 7.6 -1.2 -8.8 26 26 A G - 0 0 15 -3,-0.3 30,-0.1 1,-0.3 31,-0.1 0.041 48.1-177.6 -92.1 28.4 9.6 -1.0 -5.6 27 27 A D + 0 0 85 28,-0.4 28,-2.2 27,-0.1 2,-0.7 0.312 65.8 20.3 8.8 -85.2 11.2 -4.1 -7.0 28 28 A E E S-E 54 0C 144 26,-0.2 2,-0.3 -3,-0.2 26,-0.2 -0.915 86.5-169.2-104.2 115.5 13.6 -4.9 -4.1 29 29 A V E -E 53 0C 17 24,-2.1 24,-1.2 -2,-0.7 2,-0.1 -0.689 11.8-144.7-108.7 161.6 12.5 -3.2 -0.9 30 30 A N - 0 0 54 -2,-0.3 2,-0.4 22,-0.2 -1,-0.1 -0.080 37.6 -93.8 -98.1-164.2 14.0 -2.6 2.4 31 31 A E S S+ 0 0 84 21,-0.1 21,-0.2 -2,-0.1 -2,-0.0 -0.707 119.6 36.6-122.3 69.7 12.6 -2.6 5.9 32 32 A D S S+ 0 0 97 -2,-0.4 17,-1.4 19,-0.2 -1,-0.0 -0.047 80.1 135.1-177.3 -55.2 12.1 1.3 5.9 33 33 A D - 0 0 56 15,-0.2 2,-0.3 16,-0.1 -2,-0.1 0.411 55.4 -32.0 18.1-137.7 11.1 2.4 2.3 34 34 A V - 0 0 31 14,-0.1 2,-0.7 13,-0.1 -2,-0.1 -0.711 38.7-126.6-114.9 167.4 8.3 4.9 1.6 35 35 A L - 0 0 53 -2,-0.3 2,-0.1 13,-0.1 14,-0.1 -0.913 31.2-135.4-108.6 120.2 5.1 6.0 2.8 36 36 A C E - D 0 47B 9 11,-1.0 11,-1.2 -2,-0.7 2,-0.8 -0.467 22.1-118.9 -73.6 151.8 2.7 5.8 0.1 37 37 A E E +CD 20 46B 67 -17,-1.8 -18,-3.1 9,-0.2 -17,-0.8 -0.866 42.9 166.8-104.5 102.9 0.6 8.9 0.0 38 38 A V E -CD 18 45B 14 7,-1.6 7,-2.9 -2,-0.8 2,-0.3 -0.880 22.0-146.4-114.6 146.2 -3.0 7.9 0.6 39 39 A Q E +CD 17 44B 84 -22,-2.7 -22,-0.9 -2,-0.4 2,-0.3 -0.840 19.0 175.7-115.1 152.4 -5.7 10.5 1.4 40 40 A N - 0 0 32 3,-3.0 -27,-0.1 -2,-0.3 -24,-0.0 -0.786 52.9 -38.7-141.1-178.1 -8.7 10.0 3.6 41 41 A D S S- 0 0 114 -2,-0.3 3,-0.0 1,-0.2 -2,-0.0 0.581 124.8 -29.6 -7.6 -72.4 -11.6 12.0 5.1 42 42 A K S S+ 0 0 198 2,-0.0 -1,-0.2 0, 0.0 2,-0.2 0.355 129.1 64.9-136.8 -11.6 -9.8 15.3 5.7 43 43 A A - 0 0 46 0, 0.0 -3,-3.0 0, 0.0 2,-0.3 -0.545 68.0-133.8-111.6 178.7 -6.3 14.0 6.4 44 44 A V E -D 39 0B 82 -5,-0.3 2,-0.3 -2,-0.2 -5,-0.3 -0.957 20.4-146.9-130.9 147.5 -3.5 12.2 4.4 45 45 A V E -D 38 0B 72 -7,-2.9 -7,-1.6 -2,-0.3 2,-0.4 -0.803 6.5-143.4-120.4 161.8 -1.5 9.1 5.6 46 46 A E E -D 37 0B 135 -2,-0.3 -9,-0.2 -9,-0.2 -11,-0.1 -0.988 8.9-168.6-122.2 122.8 2.0 7.8 5.2 47 47 A I E +D 36 0B 55 -11,-1.2 -11,-1.0 -2,-0.4 -13,-0.1 -0.767 13.6 179.4-115.0 83.2 2.5 4.0 4.9 48 48 A P - 0 0 59 0, 0.0 -15,-0.2 0, 0.0 -14,-0.1 0.142 44.3 -78.6 -62.9-167.1 6.4 3.3 5.2 49 49 A S - 0 0 14 -17,-1.4 -16,-0.1 1,-0.2 -14,-0.1 -0.734 35.5-176.0-108.7 86.5 7.6 -0.4 5.1 50 50 A P S S+ 0 0 97 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.865 80.0 20.1 -32.2 -49.2 7.2 -2.5 8.3 51 51 A V S S- 0 0 2 -21,-0.1 -19,-0.2 -19,-0.0 2,-0.2 -0.896 73.9-130.6-132.5 164.8 9.0 -5.3 6.4 52 52 A K + 0 0 93 -2,-0.3 2,-0.3 -21,-0.2 -22,-0.2 -0.446 48.1 105.6-102.5 173.3 11.2 -5.9 3.4 53 53 A G E S-E 29 0C 22 -24,-1.2 -24,-2.1 -2,-0.2 2,-0.2 -0.969 75.3 -37.8 149.2-136.9 11.1 -8.3 0.6 54 54 A K E -EF 28 76C 53 22,-0.6 22,-0.7 -2,-0.3 2,-0.4 -0.623 39.1-132.1-112.7 173.3 10.1 -7.5 -3.1 55 55 A V + 0 0 8 -28,-2.2 -28,-0.4 -2,-0.2 -29,-0.2 -0.712 35.4 179.8-127.4 70.1 7.5 -5.2 -4.4 56 56 A L - 0 0 87 -2,-0.4 2,-0.3 18,-0.2 -1,-0.2 0.914 51.0 -26.6 -38.1 -79.2 6.1 -7.7 -6.8 57 57 A E - 0 0 111 17,-0.3 17,-1.1 -3,-0.1 2,-0.4 -0.920 44.0-145.6-143.0 167.5 3.3 -5.8 -8.5 58 58 A I B -G 73 0D 34 -2,-0.3 15,-0.2 15,-0.2 -3,-0.0 -0.963 12.1-173.2-131.1 141.2 0.8 -3.0 -8.0 59 59 A L S S+ 0 0 91 13,-3.0 -1,-0.1 -2,-0.4 14,-0.1 0.832 82.9 18.5-103.7 -58.8 -2.6 -3.3 -9.5 60 60 A V S S+ 0 0 30 12,-0.6 -1,-0.2 1,-0.2 -42,-0.1 -0.704 82.1 178.8-113.6 75.9 -4.4 0.0 -9.1 61 61 A P - 0 0 49 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 0.913 48.9 -37.6 -49.8 -83.5 -1.3 2.2 -8.3 62 62 A E S S+ 0 0 80 -43,-0.1 2,-1.4 3,-0.1 -43,-0.2 -0.732 113.5 49.6-134.9-179.9 -2.3 5.8 -7.8 63 63 A G S S+ 0 0 65 -45,-1.7 2,-0.2 -2,-0.2 -44,-0.1 -0.047 102.4 68.7 76.8 -38.6 -4.9 8.1 -9.3 64 64 A T S S- 0 0 86 -2,-1.4 -46,-1.2 -4,-0.0 2,-0.3 -0.500 83.9-117.2-103.3 177.1 -7.7 5.6 -8.9 65 65 A V E -B 17 0B 74 -48,-0.2 2,-0.3 -2,-0.2 -48,-0.2 -0.889 22.8-161.1-117.7 149.0 -9.2 4.4 -5.6 66 66 A A E -B 16 0B 5 -50,-2.4 -50,-2.7 -2,-0.3 2,-0.1 -0.767 3.7-151.5-121.8 166.7 -9.1 0.8 -4.2 67 67 A T - 0 0 56 -52,-0.3 2,-0.3 4,-0.3 -52,-0.2 -0.270 29.6 -92.0-117.9-155.5 -11.3 -0.9 -1.6 68 68 A V S S+ 0 0 10 -54,-0.5 3,-0.2 -2,-0.1 -62,-0.1 -0.866 110.4 49.1-120.4 151.5 -10.6 -3.7 0.9 69 69 A G S S+ 0 0 72 1,-0.7 2,-0.2 -2,-0.3 -1,-0.1 -0.188 110.8 69.8 104.6 -38.7 -11.5 -7.2 -0.3 70 70 A Q S S- 0 0 94 1,-0.1 -1,-0.7 -66,-0.0 -66,-0.2 -0.572 87.7-130.0-100.1 164.5 -9.6 -6.1 -3.3 71 71 A T - 0 0 56 -2,-0.2 -4,-0.3 -3,-0.2 3,-0.1 -0.452 17.3-169.0-108.0-175.5 -5.8 -5.6 -3.0 72 72 A L S S- 0 0 0 1,-0.9 -13,-3.0 -2,-0.2 -12,-0.6 0.384 74.2 -11.3-135.2 -67.2 -3.7 -2.7 -4.1 73 73 A I B -G 58 0D 22 -15,-0.2 -1,-0.9 -14,-0.1 2,-0.3 -0.836 66.1-148.1-135.0 165.0 -0.1 -3.9 -3.9 74 74 A T - 0 0 21 -17,-1.1 2,-0.3 -2,-0.3 -17,-0.3 -0.912 4.7-155.0-137.2 161.4 1.2 -7.0 -2.3 75 75 A L B -A 2 0A 34 -73,-0.7 -73,-2.0 -2,-0.3 2,-0.5 -0.958 10.1-140.4-137.8 152.3 4.5 -7.8 -0.6 76 76 A D B +F 54 0C 42 -22,-0.7 -22,-0.6 -2,-0.3 -2,-0.0 -0.953 23.0 168.6-116.9 131.6 6.4 -11.0 -0.1 77 77 A A - 0 0 26 -2,-0.5 2,-2.5 -24,-0.2 3,-0.1 -0.490 18.7-164.1-140.5 60.2 8.0 -11.5 3.3 78 78 A P S S+ 0 0 119 0, 0.0 -2,-0.0 0, 0.0 -25,-0.0 -0.208 77.5 23.8 -53.1 68.3 9.0 -15.2 3.1 79 79 A G 0 0 73 -2,-2.5 -3,-0.0 1,-0.0 0, 0.0 0.490 360.0 360.0 132.7 68.7 9.6 -15.8 6.8 80 80 A Y 0 0 226 -3,-0.1 -3,-0.0 -29,-0.0 -29,-0.0 -0.425 360.0 360.0-138.7 360.0 7.8 -13.4 9.0