==== 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 12-SEP-06 2IBW . COMPND 2 MOLECULE: ACETYL-COA ACETYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.M.HAAPALAINEN,R.K.WIERENGA . 1568 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 54258.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1146 73.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 88 5.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 260 16.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.3 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-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 . 4 0.3 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 . 86 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 185 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 432 27.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 45 2.9 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 4 4 4 0 4 0 0 4 5 4 4 3 4 0 0 0 3 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 9 0 0 5 7 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 . 11 11 11 1 0 0 4 4 8 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 . 6 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 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 37 A P 0 0 126 0, 0.0 394,-2.1 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 130.8 -37.0 34.3 29.0 2 38 A T B -A 394 0A 92 392,-0.2 392,-0.3 1,-0.1 2,-0.1 -0.678 360.0 -91.9 -92.7 146.7 -39.4 37.2 29.4 3 39 A L - 0 0 36 390,-2.7 103,-0.2 -2,-0.3 2,-0.2 -0.341 41.3-128.6 -63.6 135.6 -39.6 39.4 32.6 4 40 A K - 0 0 84 101,-1.9 2,-0.3 100,-0.2 -1,-0.1 -0.484 16.4-115.8 -86.4 151.5 -42.2 38.3 35.2 5 41 A E - 0 0 104 -2,-0.2 257,-1.7 99,-0.1 2,-0.4 -0.639 28.5-142.1 -84.0 142.3 -44.8 40.5 36.8 6 42 A V E -B 261 0B 6 270,-0.5 270,-2.8 -2,-0.3 2,-0.3 -0.921 17.0-174.3-114.8 133.1 -44.5 41.1 40.5 7 43 A V E -BC 260 275B 3 253,-2.9 253,-2.2 -2,-0.4 2,-0.6 -0.885 24.4-129.3-123.4 150.7 -47.4 41.4 43.0 8 44 A I E +BC 259 274B 0 266,-3.2 265,-2.4 -2,-0.3 266,-1.5 -0.903 24.2 177.5 -96.1 120.7 -47.6 42.2 46.8 9 45 A V E - 0 0 8 249,-2.6 2,-0.3 -2,-0.6 250,-0.1 0.776 65.2 -1.7 -94.6 -33.4 -49.7 39.5 48.5 10 46 A S E -B 258 0B 3 248,-1.0 248,-1.6 262,-0.1 -1,-0.3 -0.982 53.0-165.8-153.6 162.7 -49.4 40.8 52.1 11 47 A A E +B 257 0B 2 -2,-0.3 2,-0.3 246,-0.2 246,-0.2 -0.915 18.8 167.7-155.5 118.7 -47.8 43.6 54.1 12 48 A T E -B 256 0B 4 244,-2.6 244,-2.6 -2,-0.3 2,-0.3 -0.955 7.9-177.9-137.9 152.1 -47.5 43.6 57.9 13 49 A R E -Bd 255 199B 2 185,-2.1 187,-2.6 -2,-0.3 242,-0.2 -0.987 26.9-117.8-145.5 156.3 -45.7 45.5 60.7 14 50 A T - 0 0 0 240,-2.4 201,-0.1 -2,-0.3 203,-0.1 -0.413 51.4 -90.7 -69.7 165.5 -45.1 45.7 64.4 15 51 A P - 0 0 0 0, 0.0 2,-0.6 0, 0.0 239,-0.3 -0.373 48.2-106.5 -63.6 162.8 -46.2 48.9 66.1 16 52 A I - 0 0 0 237,-0.1 202,-2.4 331,-0.1 203,-0.5 -0.883 35.6-151.1 -96.4 124.1 -43.4 51.4 66.3 17 53 A G E -E 252 0B 0 235,-2.5 235,-1.8 -2,-0.6 3,-0.1 -0.624 15.5-113.3 -93.4 152.0 -41.9 51.8 69.8 18 54 A S E > -E 251 0B 0 -2,-0.2 3,-2.4 233,-0.2 5,-0.4 -0.374 50.7 -73.6 -78.2 162.9 -40.3 55.0 71.2 19 55 A F T 3 S- 0 0 49 231,-0.9 -1,-0.1 1,-0.3 232,-0.1 -0.425 122.1 -2.5 -60.0 121.4 -36.6 55.2 72.0 20 56 A L T 3 S+ 0 0 104 -2,-0.2 -1,-0.3 1,-0.1 -2,-0.1 0.715 120.8 113.5 63.1 26.3 -36.0 53.1 75.2 21 57 A G S X S- 0 0 18 -3,-2.4 3,-1.7 3,-0.0 4,-0.3 0.206 78.1 -29.9-105.5-140.8 -39.8 52.6 75.2 22 58 A S T 3 S+ 0 0 41 1,-0.3 3,-0.2 2,-0.1 -3,-0.1 0.663 135.3 31.9 -60.9 -24.7 -42.4 49.8 74.9 23 59 A L T > S+ 0 0 0 -5,-0.4 3,-2.1 1,-0.1 -1,-0.3 0.305 84.6 108.9-113.1 7.5 -40.4 47.6 72.5 24 60 A S T < + 0 0 28 -3,-1.7 -2,-0.1 1,-0.3 -1,-0.1 0.663 70.0 63.8 -66.3 -18.3 -36.9 48.3 73.7 25 61 A L T 3 S+ 0 0 122 -4,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.669 91.2 78.7 -76.7 -15.5 -36.4 44.9 75.3 26 62 A L S < S- 0 0 27 -3,-2.1 96,-0.1 2,-0.0 -3,-0.0 -0.796 80.2-127.5 -99.6 131.0 -36.7 43.1 71.9 27 63 A P >> - 0 0 65 0, 0.0 4,-2.0 0, 0.0 3,-0.7 -0.342 29.0-107.3 -67.3 158.6 -33.7 43.0 69.5 28 64 A A H 3> S+ 0 0 2 1,-0.2 4,-2.4 2,-0.2 90,-0.2 0.863 120.1 55.8 -49.7 -42.7 -34.3 44.1 65.9 29 65 A T H 3> S+ 0 0 16 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.819 105.2 51.7 -65.5 -34.5 -34.1 40.5 64.7 30 66 A K H <> S+ 0 0 100 -3,-0.7 4,-1.9 2,-0.2 -1,-0.2 0.912 109.3 49.3 -69.2 -43.4 -37.0 39.5 67.0 31 67 A L H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.921 110.1 53.4 -55.3 -44.3 -39.1 42.3 65.7 32 68 A G H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.906 106.6 51.4 -57.4 -44.6 -38.2 41.0 62.2 33 69 A S H X S+ 0 0 6 -4,-2.1 4,-2.8 2,-0.2 5,-0.2 0.898 109.7 50.1 -57.9 -41.7 -39.4 37.5 63.1 34 70 A I H X S+ 0 0 32 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.940 113.3 45.1 -64.5 -49.0 -42.7 38.8 64.3 35 71 A A H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 221,-0.2 0.904 114.9 47.7 -58.3 -48.6 -43.3 40.9 61.2 36 72 A I H X S+ 0 0 0 -4,-2.6 4,-2.0 2,-0.2 5,-0.2 0.933 111.7 49.5 -62.0 -49.0 -42.3 38.0 58.9 37 73 A Q H X S+ 0 0 65 -4,-2.8 4,-2.1 -5,-0.2 -1,-0.2 0.913 112.8 49.0 -55.7 -43.3 -44.5 35.4 60.7 38 74 A G H X S+ 0 0 6 -4,-2.2 4,-2.6 -5,-0.2 -2,-0.2 0.902 108.5 51.9 -65.6 -42.1 -47.4 37.9 60.5 39 75 A A H X S+ 0 0 0 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.882 110.7 47.6 -60.4 -41.5 -47.0 38.5 56.7 40 76 A I H X>S+ 0 0 4 -4,-2.0 4,-1.2 2,-0.2 5,-1.2 0.923 111.8 50.8 -67.9 -43.3 -46.9 34.8 55.9 41 77 A E H <5S+ 0 0 133 -4,-2.1 3,-0.4 1,-0.2 -2,-0.2 0.916 111.9 47.0 -58.4 -46.0 -50.0 34.2 58.1 42 78 A K H <5S+ 0 0 102 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.840 107.8 56.1 -63.4 -37.1 -51.9 37.1 56.3 43 79 A A H <5S- 0 0 11 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.753 103.5-135.3 -66.4 -26.5 -50.8 35.8 52.9 44 80 A G T <5 + 0 0 65 -4,-1.2 -3,-0.2 -3,-0.4 -2,-0.1 0.828 59.8 124.4 74.1 36.1 -52.4 32.4 53.8 45 81 A I < - 0 0 16 -5,-1.2 -1,-0.3 225,-0.0 2,-0.1 -0.845 68.1 -95.8-123.9 156.0 -49.5 30.3 52.4 46 82 A P > - 0 0 68 0, 0.0 3,-1.7 0, 0.0 4,-0.4 -0.466 32.2-122.7 -68.5 147.6 -47.3 27.6 54.0 47 83 A K G > S+ 0 0 55 1,-0.3 3,-1.3 2,-0.2 30,-0.0 0.800 110.0 68.1 -56.8 -31.0 -44.0 28.9 55.4 48 84 A E G 3 S+ 0 0 130 1,-0.3 -1,-0.3 29,-0.1 29,-0.0 0.683 85.8 68.0 -65.6 -21.3 -42.3 26.4 53.0 49 85 A E G < S+ 0 0 39 -3,-1.7 2,-0.5 61,-0.0 -1,-0.3 0.771 76.6 94.8 -69.7 -24.7 -43.4 28.4 50.0 50 86 A V < - 0 0 3 -3,-1.3 62,-0.2 -4,-0.4 3,-0.1 -0.578 54.1-177.4 -73.3 120.3 -41.1 31.3 50.9 51 87 A K - 0 0 61 60,-2.3 2,-0.3 -2,-0.5 61,-0.2 0.787 58.0 -0.9 -93.3 -34.0 -37.9 30.7 48.9 52 88 A E E -f 112 0B 4 59,-0.6 61,-1.9 29,-0.2 2,-0.4 -0.973 61.4-144.9-156.0 158.0 -35.5 33.6 49.9 53 89 A A E -fg 113 83B 0 29,-2.0 31,-1.7 -2,-0.3 2,-0.4 -0.996 9.4-174.6-137.5 136.8 -35.5 36.6 52.2 54 90 A Y E -fg 114 84B 0 59,-1.9 61,-1.5 -2,-0.4 2,-0.4 -1.000 10.6-176.0-125.3 129.4 -34.0 40.2 52.2 55 91 A M E -fg 115 85B 1 29,-1.7 31,-2.7 -2,-0.4 61,-0.3 -0.990 21.8-133.2-127.0 132.4 -34.3 42.6 55.1 56 92 A G E +fg 116 86B 0 59,-2.9 61,-2.5 -2,-0.4 2,-0.2 -0.574 34.4 160.0 -73.6 144.7 -33.1 46.2 55.4 57 93 A N - 0 0 0 29,-2.1 3,-0.2 -2,-0.2 61,-0.1 -0.787 17.7-174.6-170.7 112.3 -31.2 46.9 58.7 58 94 A V S S+ 0 0 9 59,-0.3 2,-0.9 -2,-0.2 60,-0.1 0.875 78.1 46.0 -86.2 -40.2 -28.9 50.0 59.0 59 95 A L + 0 0 7 1,-0.2 60,-0.2 2,-0.0 -1,-0.2 -0.776 61.2 157.8-114.1 83.8 -27.2 49.6 62.4 60 96 A Q > + 0 0 14 -2,-0.9 3,-2.0 -3,-0.2 4,-0.3 0.524 26.7 128.3 -89.9 -8.5 -26.2 45.9 62.5 61 97 A G T 3 S+ 0 0 10 1,-0.3 -2,-0.0 2,-0.1 390,-0.0 -0.262 81.6 1.9 -57.0 122.4 -23.4 46.3 65.2 62 98 A G T 3 S+ 0 0 24 61,-0.1 -1,-0.3 472,-0.1 3,-0.1 0.452 95.6 112.3 83.4 1.1 -23.8 43.8 68.0 63 99 A E S < S- 0 0 35 -3,-2.0 -2,-0.1 1,-0.2 -34,-0.1 0.601 80.0-118.8 -79.5 -11.3 -26.9 42.1 66.6 64 100 A G - 0 0 8 -4,-0.3 -1,-0.2 470,-0.1 474,-0.2 -0.252 52.0 -26.4 92.0 173.8 -24.9 38.9 66.0 65 101 A Q S S- 0 0 3 472,-0.6 5,-0.2 476,-0.5 474,-0.1 -0.270 119.5 -4.9 -65.9 138.8 -24.1 37.0 62.8 66 102 A A > - 0 0 13 472,-0.4 4,-2.1 3,-0.1 3,-0.4 0.917 65.8-162.8 50.9 67.5 -26.4 37.3 59.8 67 103 A P H > S+ 0 0 1 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.861 87.1 50.7 -52.1 -44.4 -29.3 39.4 61.1 68 104 A T H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.906 108.5 52.5 -61.5 -41.2 -31.8 38.5 58.3 69 105 A R H > S+ 0 0 11 -3,-0.4 4,-2.8 1,-0.2 5,-0.3 0.911 108.8 51.0 -58.7 -42.7 -31.0 34.7 58.8 70 106 A Q H X S+ 0 0 28 -4,-2.1 4,-2.3 -5,-0.2 -2,-0.2 0.915 110.9 47.9 -59.0 -46.5 -31.8 35.2 62.6 71 107 A A H X S+ 0 0 0 -4,-2.2 4,-0.7 2,-0.2 -2,-0.2 0.895 114.9 46.5 -58.7 -41.3 -35.2 36.9 61.7 72 108 A V H ><>S+ 0 0 0 -4,-2.4 5,-1.9 2,-0.2 3,-0.8 0.955 115.9 41.4 -73.0 -50.3 -36.0 34.1 59.2 73 109 A L H ><5S+ 0 0 31 -4,-2.8 3,-1.8 1,-0.2 -2,-0.2 0.889 111.0 59.3 -64.7 -38.0 -35.2 31.1 61.4 74 110 A G H 3<5S+ 0 0 45 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.715 102.2 53.7 -59.9 -22.7 -36.8 32.9 64.4 75 111 A A T <<5S- 0 0 1 -3,-0.8 -1,-0.3 -4,-0.7 -2,-0.2 0.334 122.1-108.2 -92.1 3.7 -40.1 33.0 62.5 76 112 A G T < 5 + 0 0 45 -3,-1.8 -3,-0.2 1,-0.2 -2,-0.1 0.679 65.2 153.4 77.5 20.4 -39.9 29.2 61.9 77 113 A L < - 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