==== 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 OXIDOREDUCTASE 28-JAN-00 1EDO . COMPND 2 MOLECULE: BETA-KETO ACYL CARRIER PROTEIN REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BRASSICA NAPUS; . AUTHOR M.FISHER,J.T.KROON,W.MARTINDALE,A.R.STUITJE,A.R.SLABAS,J.B.R . 244 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11151.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 193 79.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 35 14.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 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 . 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 . 19 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 99 40.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 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 2 0 0 0 1 0 0 1 1 1 2 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 1 3 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 PARALLEL BRIDGES PER LADDER . 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 17 A S 0 0 96 0, 0.0 25,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 112.5 -26.8 21.1 39.3 2 18 A P - 0 0 44 0, 0.0 25,-2.6 0, 0.0 2,-0.6 -0.410 360.0-129.6 -73.1 144.2 -29.2 24.1 39.1 3 19 A V E -a 27 0A 3 23,-0.2 78,-2.6 -2,-0.1 79,-2.4 -0.837 29.7-171.1 -94.2 120.1 -32.9 23.6 38.3 4 20 A V E -ab 28 82A 0 23,-3.3 25,-2.4 -2,-0.6 2,-0.6 -0.963 14.9-158.3-117.5 130.9 -33.9 26.0 35.5 5 21 A V E -ab 29 83A 0 77,-2.8 79,-3.1 -2,-0.5 2,-0.5 -0.904 12.4-173.1-105.8 119.1 -37.4 26.6 34.3 6 22 A V E > -ab 30 84A 0 23,-2.1 25,-2.0 -2,-0.6 3,-0.6 -0.945 12.0-148.7-114.8 115.5 -37.5 28.1 30.7 7 23 A T T 3 S+ 0 0 3 77,-2.2 79,-0.3 -2,-0.5 25,-0.1 -0.595 82.2 15.3 -82.8 142.9 -40.9 29.2 29.3 8 24 A G T 3 S+ 0 0 20 -2,-0.2 3,-0.4 78,-0.2 6,-0.4 0.931 79.6 151.3 61.8 48.0 -41.4 29.0 25.6 9 25 A A < + 0 0 0 22,-2.0 23,-0.2 -3,-0.6 10,-0.1 0.417 45.7 83.5 -92.0 3.8 -38.4 26.7 25.2 10 26 A S S S+ 0 0 10 21,-0.6 2,-0.3 8,-0.0 -1,-0.2 0.755 97.9 19.8 -78.2 -25.8 -39.6 24.7 22.2 11 27 A R S >> S- 0 0 135 -3,-0.4 4,-1.5 31,-0.0 3,-0.6 -0.902 105.5 -15.2-137.8 173.6 -38.4 27.3 19.6 12 28 A G H 3> S- 0 0 23 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.010 118.9 -0.4 38.1-129.3 -36.1 30.2 18.9 13 29 A I H 3> S+ 0 0 30 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.883 132.1 53.3 -59.3 -45.9 -34.5 32.0 21.8 14 30 A G H <> S+ 0 0 0 -3,-0.6 4,-2.5 -6,-0.4 -1,-0.2 0.865 111.2 48.8 -60.4 -34.7 -36.1 29.9 24.6 15 31 A K H X S+ 0 0 68 -4,-1.5 4,-3.0 -7,-0.3 5,-0.3 0.942 109.4 49.4 -71.9 -45.8 -34.8 26.8 22.9 16 32 A A H X S+ 0 0 10 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.928 113.5 49.5 -58.8 -41.8 -31.2 28.2 22.4 17 33 A I H X S+ 0 0 0 -4,-2.8 4,-2.4 2,-0.2 5,-0.3 0.949 110.6 48.8 -60.5 -49.7 -31.4 29.1 26.1 18 34 A A H X S+ 0 0 0 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.933 112.6 47.6 -57.8 -47.1 -32.6 25.6 27.1 19 35 A L H X S+ 0 0 30 -4,-3.0 4,-2.9 1,-0.2 -1,-0.2 0.909 112.1 50.0 -61.9 -43.4 -29.9 23.8 25.1 20 36 A S H X S+ 0 0 28 -4,-2.5 4,-0.8 -5,-0.3 -1,-0.2 0.903 111.4 45.9 -68.1 -36.9 -27.2 26.0 26.4 21 37 A L H <>S+ 0 0 0 -4,-2.4 5,-2.5 -5,-0.2 -1,-0.2 0.774 113.7 52.0 -73.7 -23.8 -28.1 25.6 30.1 22 38 A G H ><5S+ 0 0 0 -4,-1.6 3,-3.1 -5,-0.3 -2,-0.2 0.933 103.8 54.9 -74.4 -48.0 -28.4 21.9 29.4 23 39 A K H 3<5S+ 0 0 57 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.738 105.5 55.0 -57.8 -20.0 -25.0 21.6 27.9 24 40 A A T 3<5S- 0 0 55 -4,-0.8 -1,-0.3 -5,-0.2 -2,-0.2 0.302 126.5-105.8 -94.2 5.4 -23.7 23.2 31.1 25 41 A G T < 5 + 0 0 20 -3,-3.1 -3,-0.2 1,-0.2 -2,-0.2 0.710 67.1 148.3 79.9 27.7 -25.4 20.4 32.9 26 42 A C < - 0 0 1 -5,-2.5 26,-1.8 -25,-0.1 2,-0.7 -0.437 54.8-110.6 -85.3 168.0 -28.5 22.0 34.5 27 43 A K E -ac 3 52A 45 -25,-2.6 -23,-3.3 24,-0.2 2,-0.5 -0.885 44.4-161.0 -95.6 116.5 -31.8 20.3 35.1 28 44 A V E -ac 4 53A 0 24,-3.5 26,-1.5 -2,-0.7 2,-0.8 -0.910 22.4-157.9-115.3 122.1 -34.1 22.0 32.6 29 45 A L E -ac 5 54A 0 -25,-2.4 -23,-2.1 -2,-0.5 2,-0.9 -0.781 19.4-157.3 -88.5 108.3 -37.9 22.2 32.5 30 46 A V E -ac 6 55A 0 24,-2.4 26,-2.0 -2,-0.8 2,-0.2 -0.808 9.3-162.0 -93.4 106.5 -38.7 22.9 28.8 31 47 A N E + c 0 56A 4 -25,-2.0 -22,-2.0 -2,-0.9 -21,-0.6 -0.565 14.2 169.7 -86.4 148.6 -42.1 24.5 28.6 32 48 A Y E - c 0 57A 48 24,-2.1 26,-2.7 -2,-0.2 4,-0.1 -0.950 25.8-157.8-149.7 165.5 -44.1 24.6 25.4 33 49 A A S S- 0 0 77 -2,-0.3 -1,-0.1 24,-0.2 3,-0.1 0.743 88.4 -9.7-112.6 -55.4 -47.6 25.5 24.3 34 50 A R S S+ 0 0 90 1,-0.1 2,-1.3 24,-0.1 3,-0.3 0.581 113.7 82.8-121.2 -21.0 -48.3 23.8 21.1 35 51 A S > + 0 0 40 1,-0.2 4,-2.3 2,-0.1 5,-0.2 -0.385 44.1 153.0 -91.7 63.5 -44.9 22.4 19.9 36 52 A A H > S+ 0 0 46 -2,-1.3 4,-2.1 1,-0.2 -1,-0.2 0.884 73.1 48.6 -53.4 -49.0 -44.8 19.2 21.8 37 53 A K H > S+ 0 0 71 -3,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.926 110.8 50.1 -62.6 -41.6 -42.6 17.4 19.3 38 54 A A H > S+ 0 0 24 1,-0.2 4,-1.4 2,-0.2 -2,-0.2 0.912 109.6 51.4 -68.6 -34.2 -40.1 20.2 19.1 39 55 A A H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.918 106.9 54.4 -65.3 -42.0 -39.8 20.4 22.9 40 56 A E H X S+ 0 0 50 -4,-2.1 4,-2.5 1,-0.3 -1,-0.2 0.920 106.0 51.5 -58.8 -44.4 -39.2 16.7 23.1 41 57 A E H X S+ 0 0 121 -4,-2.0 4,-2.0 1,-0.2 -1,-0.3 0.827 109.3 51.4 -61.4 -32.7 -36.3 17.0 20.7 42 58 A V H X S+ 0 0 1 -4,-1.4 4,-2.5 -3,-0.2 -2,-0.2 0.940 108.9 50.5 -69.8 -44.2 -34.9 19.7 22.9 43 59 A S H X S+ 0 0 10 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.888 110.3 50.1 -57.9 -42.4 -35.2 17.5 25.9 44 60 A K H X S+ 0 0 54 -4,-2.5 4,-2.7 2,-0.2 -1,-0.2 0.924 109.9 49.7 -65.7 -42.9 -33.4 14.7 24.1 45 61 A Q H X S+ 0 0 85 -4,-2.0 4,-1.4 2,-0.2 -2,-0.2 0.925 108.4 52.6 -60.5 -47.1 -30.5 17.0 23.0 46 62 A I H X>S+ 0 0 0 -4,-2.5 5,-2.6 1,-0.2 4,-0.6 0.913 112.4 47.6 -55.7 -41.3 -30.1 18.3 26.5 47 63 A E H ><5S+ 0 0 106 -4,-1.9 3,-1.3 1,-0.2 -2,-0.2 0.911 103.9 56.5 -67.3 -45.1 -29.8 14.7 27.6 48 64 A A H 3<5S+ 0 0 94 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.813 110.0 52.0 -55.8 -26.1 -27.3 13.6 25.0 49 65 A Y H 3<5S- 0 0 127 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.643 123.4-103.5 -83.2 -26.3 -25.3 16.4 26.5 50 66 A G T <<5S+ 0 0 60 -3,-1.3 -3,-0.2 -4,-0.6 2,-0.1 0.517 83.8 115.5 110.9 5.6 -25.5 15.3 30.0 51 67 A G < - 0 0 5 -5,-2.6 -1,-0.4 -6,-0.2 2,-0.3 -0.399 64.2-117.6 -93.0 179.9 -28.1 17.8 31.4 52 68 A Q E -c 27 0A 104 -26,-1.8 -24,-3.5 -2,-0.1 2,-0.3 -0.920 31.8-173.6-121.1 146.7 -31.5 16.6 32.6 53 69 A A E -c 28 0A 14 -2,-0.3 2,-0.4 -26,-0.2 -24,-0.2 -0.996 19.3-176.8-147.1 142.2 -34.8 17.6 31.0 54 70 A I E -c 29 0A 55 -26,-1.5 -24,-2.4 -2,-0.3 2,-0.3 -0.989 24.2-138.5-131.2 126.9 -38.6 17.3 31.5 55 71 A T E -c 30 0A 46 -2,-0.4 2,-0.3 -26,-0.2 -24,-0.2 -0.675 18.3-172.2 -88.5 148.2 -41.0 18.7 28.9 56 72 A F E -c 31 0A 35 -26,-2.0 -24,-2.1 -2,-0.3 2,-0.6 -0.877 12.7-153.9-147.0 114.0 -44.2 20.5 30.1 57 73 A G E +c 32 0A 35 -2,-0.3 2,-0.3 -26,-0.2 -24,-0.2 -0.799 40.8 130.3 -89.9 120.4 -47.0 21.7 27.9 58 74 A G - 0 0 7 -26,-2.7 2,-0.8 -2,-0.6 -2,-0.1 -0.945 58.3-116.4-169.2 148.6 -48.8 24.6 29.4 59 75 A D > - 0 0 55 -2,-0.3 3,-1.9 1,-0.1 6,-0.3 -0.830 23.0-155.0 -91.5 110.2 -50.0 28.1 28.5 60 76 A V T 3 S+ 0 0 8 -2,-0.8 57,-0.3 1,-0.3 56,-0.1 0.479 87.4 70.3 -71.0 4.0 -48.1 30.6 30.8 61 77 A S T 3 S+ 0 0 39 55,-0.1 2,-0.5 53,-0.0 -1,-0.3 0.460 88.8 79.2 -93.3 -1.4 -50.8 33.2 30.6 62 78 A K S <> S- 0 0 108 -3,-1.9 4,-2.0 1,-0.1 5,-0.2 -0.915 73.2-145.8-110.1 126.1 -53.0 30.9 32.8 63 79 A E H > S+ 0 0 85 -2,-0.5 4,-2.7 1,-0.2 5,-0.3 0.914 99.1 54.1 -53.7 -45.9 -52.5 30.7 36.5 64 80 A A H > S+ 0 0 70 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.916 109.5 47.0 -53.7 -50.1 -53.4 27.1 36.7 65 81 A D H > S+ 0 0 45 -6,-0.3 4,-2.6 1,-0.2 -1,-0.2 0.851 112.6 51.2 -62.0 -34.9 -50.8 26.1 34.1 66 82 A V H X S+ 0 0 0 -4,-2.0 4,-2.2 -7,-0.2 -2,-0.2 0.905 109.4 47.3 -69.7 -44.1 -48.2 28.1 35.8 67 83 A E H X S+ 0 0 103 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.889 114.4 49.9 -65.9 -34.0 -48.7 26.6 39.2 68 84 A A H X S+ 0 0 38 -4,-2.2 4,-2.7 -5,-0.3 -2,-0.2 0.917 107.2 53.2 -68.0 -45.8 -48.7 23.2 37.5 69 85 A M H X S+ 0 0 0 -4,-2.6 4,-1.4 1,-0.2 -2,-0.2 0.922 111.5 45.9 -58.2 -43.3 -45.4 24.0 35.7 70 86 A M H X S+ 0 0 6 -4,-2.2 4,-2.5 1,-0.2 3,-0.4 0.948 110.5 54.2 -64.8 -45.4 -43.7 25.0 38.9 71 87 A K H X S+ 0 0 135 -4,-2.3 4,-3.1 1,-0.2 5,-0.3 0.926 104.0 56.0 -54.7 -47.2 -45.1 21.9 40.7 72 88 A T H X S+ 0 0 34 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.885 109.5 44.3 -57.2 -36.4 -43.7 19.6 38.0 73 89 A A H X S+ 0 0 0 -4,-1.4 4,-2.9 -3,-0.4 6,-0.3 0.917 114.8 49.6 -73.6 -40.3 -40.1 20.9 38.5 74 90 A I H < S+ 0 0 58 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.861 111.3 48.4 -67.0 -32.3 -40.5 20.7 42.3 75 91 A D H < S+ 0 0 110 -4,-3.1 -1,-0.2 -5,-0.2 -2,-0.2 0.918 117.5 43.1 -73.3 -37.8 -41.8 17.2 42.2 76 92 A A H < S+ 0 0 46 -4,-1.9 2,-0.2 -5,-0.3 -2,-0.2 0.953 130.9 11.3 -70.8 -55.0 -39.0 16.1 39.9 77 93 A W S < S- 0 0 26 -4,-2.9 3,-0.0 2,-0.2 0, 0.0 -0.560 90.8-104.4-115.1 175.0 -36.1 17.9 41.5 78 94 A G S S- 0 0 73 -2,-0.2 2,-0.3 -3,-0.0 -4,-0.1 0.623 85.0 -14.0 -86.4 -6.2 -36.3 19.5 44.9 79 95 A T - 0 0 44 -6,-0.3 2,-0.4 49,-0.0 -2,-0.2 -0.890 65.0 -98.1-166.2-169.7 -36.5 23.1 44.0 80 96 A I + 0 0 2 -2,-0.3 -76,-0.2 1,-0.1 3,-0.1 -0.998 25.8 174.2-136.5 128.6 -36.0 25.8 41.4 81 97 A D S S+ 0 0 56 -78,-2.6 51,-2.1 -2,-0.4 2,-0.4 0.764 70.5 23.6-101.9 -39.6 -32.9 27.9 41.2 82 98 A V E -bd 4 132A 4 -79,-2.4 -77,-2.8 49,-0.2 2,-0.4 -0.992 56.2-169.8-134.9 140.8 -33.5 29.9 38.0 83 99 A V E -bd 5 133A 0 49,-2.1 51,-2.6 -2,-0.4 2,-0.6 -0.997 5.6-165.4-129.2 126.9 -36.6 30.9 36.0 84 100 A V E -bd 6 134A 0 -79,-3.1 -77,-2.2 -2,-0.4 2,-1.3 -0.950 8.9-154.8-115.4 110.3 -36.3 32.4 32.6 85 101 A N E + d 0 135A 4 49,-2.1 51,-2.3 -2,-0.6 -79,-0.1 -0.696 40.8 139.6 -88.4 89.9 -39.5 34.1 31.5 86 102 A N + 0 0 23 -2,-1.3 -1,-0.2 -79,-0.3 -78,-0.2 0.747 22.4 112.9-104.6 -31.8 -39.1 33.9 27.7 87 103 A A + 0 0 19 -3,-0.3 2,-0.3 26,-0.1 -79,-0.1 -0.146 41.5 138.4 -48.2 135.9 -42.5 33.0 26.2 88 104 A G - 0 0 34 -80,-0.1 2,-0.3 25,-0.0 18,-0.1 -0.972 29.9-162.3-173.6 161.5 -44.0 35.8 24.1 89 105 A I - 0 0 47 -2,-0.3 2,-0.3 17,-0.2 21,-0.1 -0.901 14.5-132.3-142.3 170.9 -45.8 36.7 20.9 90 106 A T - 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