==== 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 BIOSYNTHETIC PROTEIN 18-JUN-04 1VKU . COMPND 2 MOLECULE: ACYL CARRIER PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOTOGA MARITIMA; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 85 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5654.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 64 75.3 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 . 2 2.4 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 . 7 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 7 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 42 49.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 3.5 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 0 0 0 0 0 0 0 1 2 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 . 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 0 0 ANTIPARALLEL 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 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 -2 A H 0 0 218 0, 0.0 2,-1.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 119.9 33.9 27.6 22.5 2 -1 A H > - 0 0 91 2,-0.0 3,-0.8 0, 0.0 0, 0.0 -0.737 360.0-159.7 -92.8 85.7 31.6 25.1 20.8 3 0 A H T 3 + 0 0 138 -2,-1.2 0, 0.0 1,-0.2 0, 0.0 -0.228 64.1 17.7 -66.3 152.7 33.9 22.1 21.1 4 1 A X T 3> S+ 0 0 118 1,-0.1 4,-2.2 3,-0.1 -1,-0.2 0.756 73.7 147.1 61.6 27.8 33.5 19.0 19.0 5 2 A E H <> S+ 0 0 73 -3,-0.8 4,-1.9 2,-0.2 5,-0.1 0.881 72.0 45.5 -63.7 -38.3 31.5 20.8 16.3 6 3 A R H > S+ 0 0 71 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.946 112.3 50.0 -72.1 -47.6 32.9 18.7 13.4 7 4 A K H > S+ 0 0 141 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.877 112.2 50.3 -52.5 -43.5 32.5 15.3 15.2 8 5 A K H X S+ 0 0 133 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.909 111.2 45.9 -66.1 -44.9 28.9 16.3 16.0 9 6 A L H X S+ 0 0 11 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.849 112.2 51.3 -69.4 -33.1 28.0 17.2 12.4 10 7 A I H X S+ 0 0 32 -4,-2.7 4,-2.7 2,-0.2 -1,-0.2 0.924 110.5 49.9 -64.6 -41.2 29.6 14.1 11.1 11 8 A A H X S+ 0 0 59 -4,-2.1 4,-2.0 -5,-0.2 -2,-0.2 0.878 111.1 48.7 -64.3 -37.4 27.6 12.1 13.6 12 9 A K H X S+ 0 0 34 -4,-2.0 4,-2.9 2,-0.2 5,-0.3 0.928 109.1 52.8 -66.5 -45.8 24.5 13.9 12.4 13 10 A F H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 5,-0.2 0.943 111.0 47.5 -50.7 -50.3 25.3 13.2 8.8 14 11 A V H X S+ 0 0 33 -4,-2.7 4,-2.2 1,-0.2 11,-0.2 0.902 112.9 48.6 -61.1 -40.6 25.7 9.4 9.7 15 12 A E H X S+ 0 0 74 -4,-2.0 4,-3.5 2,-0.2 5,-0.3 0.915 113.3 45.8 -67.9 -44.9 22.4 9.5 11.6 16 13 A I H X>S+ 0 0 3 -4,-2.9 4,-2.3 2,-0.2 5,-1.3 0.927 111.8 52.0 -63.7 -46.0 20.5 11.2 8.8 17 14 A A H <5S+ 0 0 0 -4,-2.7 6,-2.4 -5,-0.3 4,-0.4 0.924 118.7 38.3 -55.9 -41.8 22.0 8.9 6.2 18 15 A S H X5S+ 0 0 58 -4,-2.2 4,-0.7 4,-0.2 -2,-0.2 0.920 125.0 34.7 -75.7 -48.3 20.9 5.9 8.3 19 16 A E H <5S+ 0 0 138 -4,-3.5 -3,-0.2 -5,-0.2 -2,-0.2 0.883 131.0 25.6 -81.6 -41.7 17.5 7.0 9.5 20 17 A K T <5S+ 0 0 116 -4,-2.3 -3,-0.2 -5,-0.3 -2,-0.1 0.795 133.3 31.2 -91.2 -28.8 16.2 9.1 6.6 21 18 A X T 4 - 0 0 86 -2,-0.3 3,-1.9 1,-0.1 41,-0.3 -0.932 20.8-136.4 -99.4 129.5 36.1 10.3 7.1 30 27 A E T 3 S+ 0 0 34 -2,-0.5 41,-3.1 1,-0.3 42,-0.3 0.698 102.3 64.6 -48.2 -28.1 35.5 13.9 6.2 31 28 A E T 3 S+ 0 0 94 39,-0.2 -1,-0.3 38,-0.1 2,-0.1 0.590 78.9 105.7 -79.9 -14.3 37.9 13.5 3.3 32 29 A N S < S- 0 0 34 -3,-1.9 38,-2.6 37,-0.1 39,-0.3 -0.430 72.5-124.8 -62.4 139.4 35.6 11.0 1.5 33 30 A T B > -A 69 0A 44 36,-0.3 4,-1.4 -2,-0.1 36,-0.3 -0.510 15.6-125.2 -77.2 153.3 33.8 12.2 -1.5 34 31 A F T 4>S+ 0 0 6 34,-2.6 5,-2.9 1,-0.2 4,-0.2 0.878 112.2 60.5 -63.5 -34.2 30.0 11.7 -1.4 35 32 A K T >45S+ 0 0 178 33,-0.5 3,-1.7 1,-0.2 -1,-0.2 0.925 103.7 47.5 -58.7 -50.1 30.4 9.9 -4.6 36 33 A E T 345S+ 0 0 116 1,-0.3 -1,-0.2 2,-0.1 -2,-0.2 0.813 106.9 57.2 -65.6 -26.8 32.6 7.3 -3.1 37 34 A L T 3<5S- 0 0 30 -4,-1.4 -1,-0.3 2,-0.1 -2,-0.2 0.482 125.1-104.7 -77.1 0.2 30.2 6.9 -0.2 38 35 A G T < 5S+ 0 0 44 -3,-1.7 2,-0.6 1,-0.3 -3,-0.2 0.715 75.9 138.3 81.8 24.5 27.5 6.1 -2.8 39 36 A F < - 0 0 9 -5,-2.9 -1,-0.3 -6,-0.1 -2,-0.1 -0.903 34.9-161.3-100.2 125.0 25.6 9.4 -2.8 40 37 A D > - 0 0 81 -2,-0.6 4,-2.1 -3,-0.1 5,-0.1 -0.281 41.1 -85.6 -91.2-173.8 24.6 10.7 -6.1 41 38 A S H > S+ 0 0 92 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.850 130.2 49.7 -64.5 -35.2 23.7 14.3 -7.0 42 39 A I H > S+ 0 0 102 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.847 108.7 52.9 -71.0 -37.9 20.0 13.7 -5.9 43 40 A D H > S+ 0 0 50 2,-0.2 4,-3.0 1,-0.2 -2,-0.2 0.870 106.3 53.2 -65.0 -40.1 21.2 12.2 -2.6 44 41 A V H X S+ 0 0 13 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.915 108.6 50.0 -60.1 -44.9 23.3 15.3 -1.9 45 42 A I H X S+ 0 0 75 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.913 112.8 46.4 -57.5 -46.1 20.2 17.5 -2.5 46 43 A D H X S+ 0 0 67 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.946 112.8 49.9 -63.3 -49.3 18.1 15.3 -0.1 47 44 A L H X S+ 0 0 0 -4,-3.0 4,-2.2 2,-0.2 -2,-0.2 0.910 111.6 48.8 -51.2 -45.8 20.9 15.3 2.5 48 45 A V H X S+ 0 0 0 -4,-2.5 4,-2.9 1,-0.2 -2,-0.2 0.928 110.2 50.2 -65.0 -44.6 21.2 19.1 2.2 49 46 A X H X S+ 0 0 115 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.836 109.7 52.1 -65.3 -31.8 17.4 19.6 2.6 50 47 A F H X S+ 0 0 56 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.917 111.6 45.4 -69.3 -44.5 17.5 17.4 5.7 51 48 A F H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 6,-0.2 0.901 110.7 55.5 -61.0 -42.3 20.4 19.4 7.3 52 49 A E H X>S+ 0 0 39 -4,-2.9 5,-1.9 1,-0.2 4,-0.8 0.899 112.0 41.9 -54.6 -44.7 18.5 22.6 6.3 53 50 A D H <5S+ 0 0 132 -4,-1.7 3,-0.3 3,-0.2 -1,-0.2 0.902 114.3 51.2 -74.4 -39.3 15.4 21.4 8.2 54 51 A E H <5S+ 0 0 90 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.821 123.5 29.0 -65.7 -35.9 17.3 20.1 11.2 55 52 A F H <5S- 0 0 60 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.344 104.1-118.3-112.3 6.9 19.3 23.3 11.7 56 53 A A T <5 + 0 0 91 -4,-0.8 2,-0.2 -3,-0.3 -3,-0.2 0.942 68.9 140.1 52.3 51.2 16.8 25.9 10.3 57 54 A L < - 0 0 19 -5,-1.9 2,-0.4 -6,-0.2 -1,-0.2 -0.687 48.7-141.3-114.3 165.5 19.4 26.8 7.6 58 55 A R - 0 0 86 -2,-0.2 2,-0.5 -3,-0.1 -9,-0.0 -0.994 12.9-167.5-127.1 128.8 19.2 27.7 3.9 59 56 A I - 0 0 6 -2,-0.4 -7,-0.1 -11,-0.0 5,-0.0 -0.985 23.8-126.1-116.6 119.3 21.9 26.4 1.6 60 57 A E > - 0 0 102 -2,-0.5 4,-1.7 1,-0.1 3,-0.4 -0.234 16.9-118.8 -65.3 151.9 21.9 28.1 -1.9 61 58 A D H > S+ 0 0 133 1,-0.3 4,-2.0 2,-0.2 5,-0.1 0.840 112.9 58.0 -62.9 -36.5 21.7 25.9 -5.0 62 59 A E H 4 S+ 0 0 82 1,-0.2 4,-0.4 2,-0.2 -1,-0.3 0.885 107.2 47.7 -60.7 -40.9 25.1 27.1 -6.2 63 60 A E H >4 S+ 0 0 50 -3,-0.4 3,-0.9 1,-0.2 4,-0.4 0.859 107.9 55.6 -68.4 -39.1 26.7 26.0 -3.0 64 61 A I H >< S+ 0 0 19 -4,-1.7 3,-1.7 1,-0.2 -2,-0.2 0.934 103.4 55.6 -57.3 -45.8 25.1 22.5 -3.2 65 62 A S T 3< S+ 0 0 75 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.620 104.2 53.9 -65.0 -15.0 26.5 22.0 -6.7 66 63 A K T < S+ 0 0 110 -3,-0.9 2,-0.3 -4,-0.4 -1,-0.3 0.469 79.4 115.3 -98.0 -8.2 30.0 22.5 -5.4 67 64 A I < + 0 0 10 -3,-1.7 3,-0.1 -4,-0.4 -23,-0.1 -0.528 23.9 146.7 -70.1 124.9 29.9 19.9 -2.7 68 65 A R + 0 0 163 1,-0.4 -34,-2.6 -2,-0.3 -33,-0.5 0.638 58.3 39.6-122.9 -48.7 32.3 17.0 -3.3 69 66 A K B >> S-A 33 0A 72 -36,-0.3 3,-1.1 -35,-0.1 4,-1.0 -0.743 80.0-115.4-110.0 152.4 33.5 15.8 -0.0 70 67 A V H >> S+ 0 0 0 -38,-2.6 4,-2.2 -41,-0.3 3,-1.1 0.934 117.7 62.7 -43.4 -51.7 31.9 15.3 3.3 71 68 A K H 3> S+ 0 0 31 -41,-3.1 4,-2.6 1,-0.3 -1,-0.2 0.806 97.0 59.4 -44.6 -36.5 34.2 18.0 4.6 72 69 A D H <> S+ 0 0 48 -3,-1.1 4,-1.9 -42,-0.3 -1,-0.3 0.871 107.6 43.0 -67.9 -40.2 32.4 20.4 2.2 73 70 A L H