==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER BIOSYNTHETIC PROTEIN 29-AUG-05 2AVA . COMPND 2 MOLECULE: ACYL CARRIER PROTEIN I, CHLOROPLAST; . SOURCE 2 ORGANISM_SCIENTIFIC: SPINACIA OLERACEA; . AUTHOR G.A.ZORNETZER,B.G.FOX,J.L.MARKLEY . 82 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5684.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 51 62.2 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 . 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 . 3 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 13.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 34 41.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 2.4 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 1 0 0 2 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 . 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 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 46 0, 0.0 71,-0.2 0, 0.0 70,-0.1 0.000 360.0 360.0 360.0 133.8 -8.2 -3.4 6.5 2 2 A K >> - 0 0 130 69,-0.2 4,-2.2 1,-0.1 3,-1.1 -0.334 360.0-121.8 -64.5 143.3 -9.7 -6.3 4.6 3 3 A K H 3> S+ 0 0 170 1,-0.3 4,-2.6 2,-0.2 5,-0.3 0.847 112.7 63.3 -53.4 -35.9 -7.2 -9.1 3.8 4 4 A E H 3> S+ 0 0 110 1,-0.2 4,-1.3 2,-0.2 -1,-0.3 0.885 108.4 40.3 -57.1 -40.7 -8.2 -8.6 0.1 5 5 A T H <> S+ 0 0 0 -3,-1.1 4,-2.6 2,-0.2 5,-0.3 0.864 112.1 55.6 -76.8 -37.9 -6.8 -5.1 0.2 6 6 A I H X S+ 0 0 28 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.886 109.7 46.5 -61.8 -40.3 -3.8 -6.1 2.3 7 7 A D H X S+ 0 0 105 -4,-2.6 4,-0.9 -5,-0.2 -1,-0.2 0.869 112.6 50.8 -69.9 -37.9 -2.8 -8.7 -0.3 8 8 A K H >X S+ 0 0 77 -4,-1.3 4,-1.7 -5,-0.3 3,-1.0 0.975 111.8 44.7 -64.0 -57.1 -3.3 -6.3 -3.1 9 9 A V H 3X S+ 0 0 4 -4,-2.6 4,-1.3 1,-0.3 3,-0.2 0.924 109.8 55.6 -53.3 -49.3 -1.2 -3.5 -1.7 10 10 A S H 3X S+ 0 0 4 -4,-1.9 4,-1.2 -5,-0.3 -1,-0.3 0.771 106.2 54.8 -55.8 -26.0 1.6 -5.9 -0.7 11 11 A D H <>S+ 0 0 26 -4,-1.2 3,-1.3 1,-0.2 5,-0.8 0.900 103.4 58.6 -62.8 -42.0 6.6 -6.7 -5.0 15 15 A E H ><5S+ 0 0 105 -4,-2.6 3,-0.7 3,-0.3 -1,-0.2 0.794 90.4 74.4 -58.4 -28.3 6.0 -5.7 -8.6 16 16 A K H 3<5S+ 0 0 71 -4,-0.7 -1,-0.3 -3,-0.5 -2,-0.2 0.890 120.5 10.9 -52.0 -42.9 8.5 -2.8 -7.9 17 17 A L T <<5S- 0 0 109 -3,-1.3 -1,-0.3 -4,-0.6 -2,-0.2 0.044 117.6 -98.5-124.9 23.2 11.3 -5.3 -8.0 18 18 A A T < 5S+ 0 0 86 -3,-0.7 -3,-0.3 -4,-0.3 2,-0.2 0.990 70.2 150.2 56.4 77.5 9.4 -8.3 -9.4 19 19 A L < + 0 0 63 -5,-0.8 -1,-0.1 -8,-0.2 -5,-0.1 -0.650 24.2 89.3-126.9-176.2 8.7 -10.3 -6.2 20 20 A G S S+ 0 0 52 -2,-0.2 -1,-0.1 -6,-0.1 5,-0.1 0.584 72.7 91.6 99.2 13.3 6.1 -12.7 -4.8 21 21 A A S S- 0 0 94 -3,-0.1 -2,-0.1 3,-0.1 -3,-0.0 0.856 106.6 -1.9-100.7 -65.8 7.7 -15.9 -6.1 22 22 A D S S+ 0 0 165 2,-0.1 2,-0.3 0, 0.0 -3,-0.0 0.026 113.3 97.6-117.0 24.3 10.0 -17.2 -3.4 23 23 A V S S- 0 0 75 0, 0.0 2,-0.4 0, 0.0 -4,-0.0 -0.855 72.4-118.6-115.6 150.7 9.5 -14.4 -0.9 24 24 A V - 0 0 119 -2,-0.3 2,-0.4 1,-0.0 -2,-0.1 -0.722 24.0-143.6 -90.0 133.1 7.1 -14.2 2.1 25 25 A V + 0 0 66 -2,-0.4 2,-0.3 -5,-0.1 -14,-0.0 -0.794 22.3 175.0 -98.7 136.3 4.4 -11.6 2.2 26 26 A T - 0 0 73 -2,-0.4 3,-0.4 3,-0.1 41,-0.2 -0.992 35.8-142.4-140.8 147.5 3.5 -9.8 5.4 27 27 A A S S+ 0 0 24 -2,-0.3 41,-2.2 1,-0.2 42,-0.2 0.676 107.0 53.4 -79.6 -18.4 1.1 -6.9 6.3 28 28 A D S S+ 0 0 110 39,-0.2 2,-1.5 38,-0.1 -1,-0.2 0.508 76.0 117.5 -92.3 -6.9 3.6 -5.7 8.9 29 29 A S - 0 0 51 -3,-0.4 38,-0.4 1,-0.1 2,-0.1 -0.450 69.3-134.6 -65.6 90.9 6.4 -5.6 6.4 30 30 A E - 0 0 130 -2,-1.5 36,-0.1 1,-0.2 -1,-0.1 -0.271 18.6-166.9 -51.3 114.6 7.2 -1.9 6.5 31 31 A F S S+ 0 0 40 34,-0.1 2,-0.7 1,-0.1 -1,-0.2 0.812 74.2 66.2 -75.0 -31.2 7.4 -0.8 2.8 32 32 A S + 0 0 65 32,-0.2 -1,-0.1 1,-0.0 2,-0.1 -0.834 59.4 131.6 -98.1 110.8 9.0 2.5 3.8 33 33 A K + 0 0 158 -2,-0.7 2,-0.3 -3,-0.0 3,-0.0 -0.561 18.2 130.1-160.8 87.8 12.4 2.1 5.4 34 34 A L > - 0 0 75 -2,-0.1 3,-1.1 1,-0.1 -2,-0.0 -0.935 43.4-152.7-147.6 119.9 15.3 4.3 4.2 35 35 A G T 3 S+ 0 0 87 -2,-0.3 -1,-0.1 1,-0.3 0, 0.0 0.705 108.0 37.5 -62.4 -18.7 17.7 6.4 6.2 36 36 A A T 3 S- 0 0 68 -3,-0.0 -1,-0.3 0, 0.0 -2,-0.0 0.384 105.7-128.1-111.0 -1.4 18.1 8.6 3.2 37 37 A D < + 0 0 134 -3,-1.1 -2,-0.1 1,-0.1 -5,-0.0 0.909 59.2 145.0 53.6 45.9 14.5 8.4 2.0 38 38 A S + 0 0 95 2,-0.1 -1,-0.1 0, 0.0 -3,-0.0 0.741 31.6 110.7 -83.6 -25.4 15.6 7.4 -1.5 39 39 A L S S- 0 0 90 1,-0.1 2,-0.9 2,-0.0 -5,-0.1 -0.193 74.2-122.5 -51.8 137.7 12.6 5.1 -1.9 40 40 A D > + 0 0 75 1,-0.2 4,-0.7 2,-0.1 -1,-0.1 -0.765 34.0 172.5 -90.4 106.6 10.1 6.4 -4.5 41 41 A T H > S+ 0 0 50 -2,-0.9 4,-3.1 2,-0.2 3,-0.4 0.843 73.4 67.8 -80.0 -35.9 6.7 6.8 -2.9 42 42 A V H > S+ 0 0 98 1,-0.3 4,-1.4 2,-0.2 -1,-0.2 0.850 101.2 50.1 -51.9 -37.1 5.1 8.5 -5.9 43 43 A E H > S+ 0 0 97 2,-0.2 4,-1.6 1,-0.1 -1,-0.3 0.856 113.4 45.4 -71.0 -35.9 5.5 5.3 -7.8 44 44 A I H X S+ 0 0 11 -4,-0.7 4,-2.3 -3,-0.4 5,-0.3 0.955 112.2 48.5 -72.1 -52.6 3.9 3.3 -5.0 45 45 A V H X S+ 0 0 20 -4,-3.1 4,-2.4 1,-0.2 5,-0.2 0.840 111.9 52.7 -56.6 -34.5 1.0 5.7 -4.4 46 46 A M H X S+ 0 0 92 -4,-1.4 4,-2.0 -5,-0.4 -1,-0.2 0.913 107.4 50.5 -68.6 -44.0 0.3 5.7 -8.1 47 47 A N H X S+ 0 0 42 -4,-1.6 4,-3.3 2,-0.2 5,-0.3 0.960 116.6 39.5 -58.7 -54.7 0.2 1.9 -8.4 48 48 A L H X S+ 0 0 17 -4,-2.3 4,-2.6 1,-0.2 5,-0.5 0.954 117.0 49.0 -60.7 -52.4 -2.3 1.5 -5.5 49 49 A E H <>S+ 0 0 47 -4,-2.4 5,-1.5 -5,-0.3 -1,-0.2 0.804 117.8 44.5 -58.0 -29.4 -4.3 4.6 -6.5 50 50 A E H <5S+ 0 0 137 -4,-2.0 -2,-0.2 3,-0.2 -3,-0.2 0.971 116.6 40.2 -78.8 -62.4 -4.3 3.2 -10.1 51 51 A E H <5S+ 0 0 100 -4,-3.3 -3,-0.2 1,-0.3 -2,-0.2 0.945 124.2 39.8 -51.8 -55.3 -5.1 -0.5 -9.5 52 52 A F T <5S- 0 0 21 -4,-2.6 -1,-0.3 -5,-0.3 -3,-0.2 0.725 105.2-137.1 -68.0 -21.3 -7.7 0.3 -6.8 53 53 A G T 5 + 0 0 27 -5,-0.5 -3,-0.2 -4,-0.2 2,-0.2 0.943 52.5 139.1 63.5 49.5 -8.8 3.2 -8.9 54 54 A I < - 0 0 8 -5,-1.5 2,-0.5 -6,-0.2 -1,-0.2 -0.521 57.4-113.8-114.2-177.0 -9.2 5.6 -6.0 55 55 A N + 0 0 53 22,-0.3 2,-0.3 -2,-0.2 27,-0.1 -0.793 44.7 159.9-124.6 88.5 -8.3 9.3 -5.4 56 56 A V - 0 0 22 -2,-0.5 2,-0.3 -11,-0.1 -7,-0.0 -0.792 29.3-134.3-109.6 152.4 -5.6 9.7 -2.9 57 57 A D >> - 0 0 97 -2,-0.3 3,-1.4 1,-0.1 4,-0.9 -0.716 23.2-116.3-104.1 155.4 -3.3 12.7 -2.2 58 58 A E G >4 S+ 0 0 103 1,-0.3 3,-1.0 -2,-0.3 5,-0.2 0.886 117.6 57.9 -54.0 -41.9 0.5 12.7 -1.7 59 59 A D G 34 S+ 0 0 91 1,-0.3 4,-0.5 2,-0.2 3,-0.4 0.777 109.4 45.6 -60.4 -26.3 -0.1 14.1 1.8 60 60 A K G <4 S+ 0 0 119 -3,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.561 117.8 43.5 -92.5 -11.2 -2.2 11.0 2.4 61 61 A A S << S+ 0 0 15 -3,-1.0 -16,-0.2 -4,-0.9 -2,-0.2 -0.089 100.9 70.1-123.5 32.8 0.4 8.7 0.8 62 62 A Q S S+ 0 0 110 -3,-0.4 -3,-0.1 -5,-0.1 -2,-0.1 0.676 104.0 33.5-116.2 -36.3 3.6 10.2 2.4 63 63 A D S S+ 0 0 145 -4,-0.5 2,-0.4 -5,-0.2 -2,-0.1 -0.261 82.6 144.1-116.6 44.0 3.3 9.2 6.0 64 64 A I - 0 0 25 1,-0.1 -32,-0.2 5,-0.0 6,-0.1 -0.714 42.0-135.4 -88.4 131.1 1.6 5.8 5.6 65 65 A S - 0 0 64 -2,-0.4 5,-0.2 1,-0.1 -34,-0.1 0.119 47.9 -48.4 -68.6-170.3 2.6 3.0 8.0 66 66 A T S >> S- 0 0 15 3,-0.1 4,-2.7 1,-0.1 3,-0.7 0.156 77.2 -76.3 -51.7 178.1 3.3 -0.6 7.0 67 67 A I H 3> S+ 0 0 5 -38,-0.4 4,-3.1 1,-0.2 5,-0.3 0.818 130.7 68.0 -49.2 -33.1 0.9 -2.5 4.7 68 68 A Q H 3> S+ 0 0 89 -41,-2.2 4,-1.2 1,-0.2 -1,-0.2 0.951 110.8 29.7 -52.5 -56.5 -1.3 -2.8 7.8 69 69 A Q H <> S+ 0 0 92 -3,-0.7 4,-2.2 -42,-0.2 -1,-0.2 0.855 117.3 60.8 -73.1 -36.2 -2.1 0.9 7.9 70 70 A A H X S+ 0 0 4 -4,-2.7 4,-2.2 -5,-0.2 5,-0.3 0.953 104.8 46.7 -55.3 -54.9 -1.8 1.2 4.1 71 71 A A H X S+ 0 0 0 -4,-3.1 4,-2.1 1,-0.2 -1,-0.2 0.892 110.7 53.8 -55.4 -42.5 -4.5 -1.2 3.3 72 72 A D H X S+ 0 0 89 -4,-1.2 4,-1.4 -5,-0.3 -1,-0.2 0.884 108.1 50.8 -60.4 -40.0 -6.8 0.5 5.9 73 73 A V H >X S+ 0 0 26 -4,-2.2 4,-1.4 -3,-0.2 3,-0.6 0.973 110.0 46.5 -62.4 -57.1 -6.2 3.8 4.2 74 74 A I H 3X S+ 0 0 11 -4,-2.2 4,-1.2 1,-0.2 -1,-0.2 0.857 104.4 65.5 -54.1 -37.4 -7.1 2.7 0.7 75 75 A E H >X S+ 0 0 46 -4,-2.1 3,-1.0 -5,-0.3 4,-0.6 0.928 102.4 45.8 -51.4 -51.2 -10.2 1.0 2.2 76 76 A G H XX S+ 0 0 34 -4,-1.4 4,-0.7 -3,-0.6 3,-0.6 0.833 111.0 53.1 -62.9 -32.6 -11.7 4.3 3.1 77 77 A L H 3X S+ 0 0 24 -4,-1.4 4,-0.6 1,-0.2 -22,-0.3 0.634 105.8 55.3 -77.1 -14.0 -10.8 5.7 -0.3 78 78 A L H << S+ 0 0 66 -4,-1.2 -1,-0.2 -3,-1.0 -2,-0.2 0.547 91.1 74.7 -93.4 -10.2 -12.6 2.8 -1.9 79 79 A E H << S- 0 0 156 -3,-0.6 -2,-0.2 -4,-0.6 -1,-0.1 0.941 126.2 -3.4 -66.8 -49.2 -15.8 3.5 0.0 80 80 A K H < S- 0 0 132 -4,-0.7 -2,-0.2 2,-0.1 -3,-0.1 0.581 80.6-151.5-116.8 -22.3 -16.8 6.5 -2.1 81 81 A K < 0 0 104 -4,-0.6 -3,-0.1 -5,-0.3 -4,-0.1 0.893 360.0 360.0 47.7 46.4 -13.7 6.7 -4.4 82 82 A A 0 0 92 -27,-0.1 -1,-0.2 -5,-0.1 -27,-0.1 -0.958 360.0 360.0-133.9 360.0 -14.3 10.5 -4.7