==== 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 28-SEP-06 2IIK . COMPND 2 MOLECULE: 3-KETOACYL-COA THIOLASE, PEROXISOMAL; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR E.PAPAGRIGORIOU,C.JOHANSSON,C.SMEE,K.KAVANAGH,A.C.W.PIKE,M.S . 784 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26806.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 571 72.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 43 5.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 115 14.7 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 . 4 0.5 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 . 2 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 . 42 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 101 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 226 28.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 2.3 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 1 1 2 0 0 3 3 0 2 2 0 3 0 0 1 0 2 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 0 3 3 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 4 1 0 0 1 3 2 4 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 . 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 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 33 A A 0 0 108 0, 0.0 2,-0.2 0, 0.0 266,-0.0 0.000 360.0 360.0 360.0 66.1 8.9 -32.9 -23.8 2 34 A S > - 0 0 59 1,-0.1 3,-1.9 2,-0.0 252,-0.2 -0.483 360.0-121.7 -85.2 151.4 7.9 -33.3 -27.6 3 35 A A T 3 S+ 0 0 53 1,-0.3 252,-2.0 -2,-0.2 253,-0.3 0.787 114.5 56.7 -59.6 -27.8 10.0 -32.5 -30.6 4 36 A A T 3 S+ 0 0 26 250,-0.2 -1,-0.3 249,-0.1 -2,-0.0 0.491 79.7 121.7 -81.6 -7.5 7.2 -30.0 -31.6 5 37 A D < - 0 0 16 -3,-1.9 249,-2.3 248,-0.1 2,-0.7 -0.235 64.7-125.7 -58.8 143.3 7.3 -28.0 -28.4 6 38 A V E -A 253 0A 1 262,-0.4 262,-2.3 247,-0.2 2,-0.3 -0.828 35.2-170.6 -91.1 116.5 8.0 -24.2 -28.6 7 39 A V E -AB 252 267A 0 245,-3.1 245,-2.4 -2,-0.7 2,-0.6 -0.744 25.3-125.3-110.7 151.1 10.9 -23.5 -26.4 8 40 A V E -AB 251 266A 2 258,-3.3 257,-2.7 -2,-0.3 258,-1.8 -0.867 24.6-175.5 -91.6 123.9 12.4 -20.2 -25.2 9 41 A V E - 0 0 2 241,-3.3 2,-0.3 -2,-0.6 -1,-0.2 0.920 57.8 -35.4 -86.2 -51.0 16.1 -20.3 -26.1 10 42 A H E -A 250 0A 41 240,-0.9 240,-3.0 254,-0.1 -1,-0.4 -0.973 52.8-159.3-166.8 161.1 17.3 -17.0 -24.5 11 43 A G E -A 249 0A 2 -2,-0.3 2,-0.3 238,-0.2 238,-0.2 -0.988 4.0-173.2-150.3 151.1 16.3 -13.4 -23.9 12 44 A R E -A 248 0A 29 236,-2.4 236,-3.2 -2,-0.3 2,-0.3 -0.977 5.5-172.9-140.3 157.9 17.8 -10.0 -23.1 13 45 A R E -Ac 247 187A 1 173,-2.5 175,-2.7 -2,-0.3 234,-0.3 -0.943 24.3-114.2-140.6 159.3 16.4 -6.6 -22.2 14 46 A T - 0 0 1 232,-2.6 2,-0.1 -2,-0.3 193,-0.1 -0.439 46.5 -91.2 -77.4 163.5 17.5 -3.1 -21.7 15 47 A A - 0 0 0 173,-0.5 2,-0.5 191,-0.3 231,-0.3 -0.412 47.9-115.5 -58.8 155.5 17.4 -1.4 -18.4 16 48 A I - 0 0 3 229,-0.1 194,-1.9 -2,-0.1 195,-0.5 -0.911 34.8-165.6-104.1 127.0 14.1 0.3 -18.0 17 49 A C E -D 244 0A 2 227,-2.2 227,-2.6 -2,-0.5 2,-0.1 -0.859 27.2 -99.5-117.0 152.6 14.3 4.1 -17.7 18 50 A R E > -D 243 0A 61 -2,-0.3 4,-1.8 225,-0.2 6,-0.3 -0.437 46.7-111.8 -67.8 135.3 11.8 6.8 -16.6 19 51 A A T 4 S+ 0 0 22 223,-2.6 2,-1.1 1,-0.2 -1,-0.1 -0.378 91.2 6.4 -69.5 144.3 10.2 8.5 -19.5 20 52 A G T 4 S+ 0 0 46 1,-0.2 -1,-0.2 2,-0.1 223,-0.1 -0.122 136.0 40.2 82.8 -41.6 11.0 12.2 -20.2 21 53 A R T 4 S+ 0 0 109 -2,-1.1 -1,-0.2 -3,-0.2 -2,-0.2 0.516 96.9 87.3-118.7 -10.5 13.8 12.5 -17.5 22 54 A G S >< S- 0 0 6 -4,-1.8 3,-1.6 -5,-0.1 4,-0.2 -0.107 92.6 -83.0 -89.8-174.1 15.7 9.2 -17.7 23 55 A G T 3 S+ 0 0 5 1,-0.3 3,-0.3 2,-0.1 181,-0.1 0.653 125.5 47.0 -65.9 -21.7 18.7 7.9 -19.6 24 56 A F T > S+ 0 0 0 -6,-0.3 3,-1.7 1,-0.2 -1,-0.3 0.239 75.9 109.0-102.5 12.2 16.7 6.9 -22.7 25 57 A K T < S+ 0 0 67 -3,-1.6 -1,-0.2 1,-0.3 -2,-0.1 0.693 89.7 35.7 -63.5 -20.2 14.7 10.1 -22.9 26 58 A D T 3 S+ 0 0 55 -3,-0.3 2,-0.6 167,-0.3 -1,-0.3 0.226 97.6 101.2-113.9 12.8 16.6 11.1 -26.1 27 59 A T < - 0 0 3 -3,-1.7 96,-0.1 165,-0.1 95,-0.1 -0.884 68.7-131.8-107.8 121.7 17.0 7.5 -27.5 28 60 A T >> - 0 0 22 -2,-0.6 4,-1.3 1,-0.1 3,-1.1 -0.326 22.3-116.1 -68.0 149.6 14.6 6.4 -30.3 29 61 A P H 3> S+ 0 0 0 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.766 111.8 63.7 -60.2 -31.8 12.9 3.0 -29.9 30 62 A D H 3> S+ 0 0 0 497,-0.5 4,-2.2 2,-0.2 5,-0.1 0.844 103.3 50.6 -59.9 -33.9 14.6 1.5 -33.0 31 63 A E H <> S+ 0 0 48 -3,-1.1 4,-2.1 2,-0.2 -1,-0.2 0.910 110.7 47.7 -71.4 -40.7 17.9 1.9 -31.1 32 64 A L H X S+ 0 0 0 -4,-1.3 4,-1.3 2,-0.2 -2,-0.2 0.938 115.0 45.4 -61.5 -47.7 16.5 0.2 -27.9 33 65 A L H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 5,-0.2 0.890 110.2 54.7 -65.7 -39.5 15.1 -2.6 -30.0 34 66 A S H X S+ 0 0 6 -4,-2.2 4,-2.9 -5,-0.2 5,-0.3 0.936 103.7 55.5 -60.6 -44.7 18.4 -2.9 -32.0 35 67 A A H X S+ 0 0 28 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.873 113.0 41.2 -55.3 -40.0 20.5 -3.3 -28.8 36 68 A V H X S+ 0 0 0 -4,-1.3 4,-2.3 2,-0.2 -1,-0.2 0.864 113.6 50.5 -84.3 -36.2 18.4 -6.3 -27.6 37 69 A M H X S+ 0 0 0 -4,-2.4 4,-1.9 2,-0.2 5,-0.2 0.954 113.8 47.3 -60.1 -49.0 18.1 -8.0 -30.9 38 70 A T H X S+ 0 0 55 -4,-2.9 4,-2.3 -5,-0.2 -2,-0.2 0.923 112.2 49.5 -57.8 -45.1 21.8 -7.7 -31.4 39 71 A A H X S+ 0 0 9 -4,-1.8 4,-2.7 -5,-0.3 -1,-0.2 0.909 108.8 51.3 -66.0 -42.7 22.6 -9.0 -27.8 40 72 A V H X S+ 0 0 0 -4,-2.3 4,-1.6 2,-0.2 -1,-0.2 0.921 112.3 45.9 -63.4 -43.7 20.3 -12.1 -28.1 41 73 A L H X>S+ 0 0 10 -4,-1.9 5,-1.9 1,-0.2 4,-1.0 0.927 115.9 45.5 -64.1 -47.4 21.8 -13.2 -31.4 42 74 A K H <5S+ 0 0 80 -4,-2.3 -2,-0.2 3,-0.2 -1,-0.2 0.888 108.0 57.8 -61.0 -44.4 25.4 -12.7 -30.2 43 75 A D H <5S+ 0 0 76 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.867 119.9 28.6 -59.0 -41.5 24.7 -14.4 -26.8 44 76 A V H <5S- 0 0 23 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.463 106.0-127.6 -97.1 -2.4 23.6 -17.7 -28.4 45 77 A N T <5 + 0 0 145 -4,-1.0 2,-0.5 1,-0.2 -3,-0.2 0.913 46.7 166.2 57.0 46.8 25.8 -17.2 -31.5 46 78 A L < - 0 0 13 -5,-1.9 -1,-0.2 -6,-0.2 -2,-0.1 -0.807 43.7-115.7 -91.0 130.2 22.9 -17.7 -34.0 47 79 A R > - 0 0 164 -2,-0.5 3,-2.1 1,-0.1 4,-0.3 -0.510 26.0-131.5 -57.3 127.3 23.5 -16.7 -37.5 48 80 A P G > S+ 0 0 38 0, 0.0 3,-2.2 0, 0.0 -1,-0.1 0.886 104.3 61.6 -53.2 -40.9 21.0 -13.8 -38.1 49 81 A E G 3 S+ 0 0 95 1,-0.3 -2,-0.1 33,-0.0 29,-0.0 0.580 86.9 74.6 -66.8 -9.2 19.7 -15.3 -41.3 50 82 A Q G < S+ 0 0 69 -3,-2.1 2,-0.3 32,-0.0 -1,-0.3 0.630 73.3 105.2 -70.5 -18.0 18.6 -18.4 -39.4 51 83 A L < - 0 0 6 -3,-2.2 62,-0.2 -4,-0.3 3,-0.1 -0.528 55.7-165.3 -66.4 125.2 15.7 -16.3 -38.0 52 84 A G - 0 0 19 60,-2.4 2,-0.3 -2,-0.3 61,-0.2 0.735 69.2 -14.1 -79.2 -26.2 12.4 -17.2 -39.7 53 85 A D - 0 0 0 59,-0.4 61,-2.2 29,-0.1 2,-0.4 -0.974 53.6-138.3-168.6 157.2 10.6 -14.1 -38.5 54 86 A I E -ef 84 114A 0 29,-1.3 31,-2.2 -2,-0.3 2,-0.5 -1.000 17.6-170.0-126.1 130.6 10.8 -11.2 -36.1 55 87 A C E -ef 85 115A 0 59,-2.8 61,-3.4 -2,-0.4 2,-0.5 -0.979 4.6-164.9-123.7 123.0 7.7 -10.0 -34.2 56 88 A V E -ef 86 116A 0 29,-2.5 31,-2.2 -2,-0.5 2,-0.3 -0.906 10.9-145.8-115.3 122.8 7.7 -6.8 -32.3 57 89 A G E +ef 87 117A 0 59,-3.2 61,-1.9 -2,-0.5 2,-0.3 -0.680 33.8 153.4 -80.0 136.4 5.2 -5.8 -29.7 58 90 A N - 0 0 0 29,-2.0 32,-0.2 -2,-0.3 61,-0.1 -0.895 25.3-177.6-166.5 141.7 4.5 -2.0 -29.6 59 91 A V S S+ 0 0 8 59,-0.3 5,-0.2 -2,-0.3 406,-0.1 0.820 76.4 39.3-108.8 -43.9 1.6 0.2 -28.6 60 92 A L S S+ 0 0 66 4,-0.1 65,-0.4 3,-0.1 3,-0.1 0.611 85.6 93.6 -99.2 -14.5 2.3 4.0 -29.3 61 93 A Q S > S- 0 0 2 1,-0.1 3,-1.9 400,-0.1 401,-1.7 -0.442 90.4 -87.4 -74.1 155.9 4.2 4.3 -32.6 62 94 A P B > S+X 461 0B 56 0, 0.0 3,-1.6 0, 0.0 5,-0.3 -0.391 116.6 5.6 -59.4 134.9 2.3 4.9 -35.8 63 95 A G G > S- 0 0 3 397,-2.0 3,-0.9 1,-0.3 426,-0.2 0.753 131.0 -70.5 61.5 24.2 1.2 1.5 -37.3 64 96 A A G < S- 0 0 0 -3,-1.9 -1,-0.3 1,-0.2 23,-0.2 0.817 87.3 -66.1 57.3 32.0 2.6 -0.1 -34.1 65 97 A G G <> S+ 0 0 2 -3,-1.6 4,-3.2 21,-0.1 5,-0.3 0.630 85.4 145.8 78.8 19.1 6.1 0.6 -35.2 66 98 A A H <> S+ 0 0 5 -3,-0.9 4,-1.6 -4,-0.3 5,-0.1 0.878 78.6 40.1 -58.8 -42.0 6.4 -1.6 -38.3 67 99 A I H > S+ 0 0 37 -5,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.943 117.6 49.1 -70.8 -48.8 8.8 0.9 -40.1 68 100 A M H > S+ 0 0 1 457,-0.3 4,-1.9 1,-0.2 -2,-0.2 0.880 112.1 48.4 -54.9 -45.5 10.7 1.6 -36.9 69 101 A A H X S+ 0 0 0 -4,-3.2 4,-1.8 2,-0.2 -1,-0.2 0.860 110.5 50.2 -66.2 -40.8 11.2 -2.1 -36.1 70 102 A R H X S+ 0 0 2 -4,-1.6 4,-1.8 -5,-0.3 -2,-0.2 0.907 109.2 52.3 -65.1 -42.8 12.3 -2.9 -39.6 71 103 A I H X S+ 0 0 0 -4,-2.6 4,-1.6 1,-0.2 -2,-0.2 0.888 107.0 53.6 -58.1 -40.2 14.9 -0.1 -39.4 72 104 A A H X S+ 0 0 0 -4,-1.9 4,-1.6 2,-0.2 -1,-0.2 0.891 103.7 56.3 -59.1 -44.7 16.1 -1.5 -36.0 73 105 A Q H <>S+ 0 0 0 -4,-1.8 5,-2.5 1,-0.3 3,-0.3 0.919 109.2 45.6 -53.6 -46.8 16.7 -4.9 -37.7 74 106 A F H ><5S+ 0 0 9 -4,-1.8 3,-1.2 1,-0.2 -1,-0.3 0.793 106.4 58.8 -71.1 -27.8 18.9 -3.2 -40.2 75 107 A L H 3<5S+ 0 0 7 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.763 106.7 49.7 -67.1 -27.2 20.7 -1.3 -37.4 76 108 A S T 3<5S- 0 0 15 -4,-1.6 -1,-0.2 -3,-0.3 -2,-0.2 0.354 116.4-119.1 -89.4 6.3 21.5 -4.8 -36.0 77 109 A D T < 5 + 0 0 112 -3,-1.2 -3,-0.2 1,-0.3 -2,-0.1 0.788 59.3 156.0 56.8 28.4 22.8 -5.9 -39.5 78 110 A I < - 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