==== 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 SIGNALING PROTEIN 19-JUL-07 2QNW . COMPND 2 MOLECULE: ACYL CARRIER PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: TOXOPLASMA GONDII; . AUTHOR V.V.LUNIN,A.WERNIMONT,J.LEW,W.QIU,L.LIN,A.HASSANALI,I.KOZIER . 80 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5261.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 55 68.8 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 2.5 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 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 7 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 39 48.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 2.5 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 2 0 0 0 0 0 0 1 0 0 0 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 3 A S 0 0 176 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -26.0 -3.8 30.3 11.8 2 4 A D - 0 0 99 0, 0.0 4,-0.3 0, 0.0 0, 0.0 -0.947 360.0-125.3-132.6 161.5 -6.9 28.2 12.2 3 5 A D S > S+ 0 0 63 -2,-0.3 4,-3.0 1,-0.2 5,-0.2 0.324 78.7 104.6 -86.5 7.0 -7.5 24.6 10.9 4 6 A R H > S+ 0 0 193 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.897 78.5 45.4 -63.3 -46.4 -10.7 25.4 8.9 5 7 A P H > S+ 0 0 80 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.917 117.4 44.7 -64.7 -39.8 -9.3 25.3 5.3 6 8 A L H > S+ 0 0 58 -4,-0.3 4,-2.4 2,-0.2 5,-0.2 0.905 110.6 54.0 -74.9 -33.3 -7.3 22.2 5.8 7 9 A L H X S+ 0 0 32 -4,-3.0 4,-2.7 1,-0.2 -1,-0.2 0.932 108.5 51.2 -57.1 -46.5 -10.2 20.5 7.6 8 10 A E H X S+ 0 0 84 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.913 112.8 45.4 -53.7 -45.1 -12.4 21.3 4.5 9 11 A R H X S+ 0 0 128 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.840 110.8 51.9 -75.2 -33.7 -9.8 19.8 2.2 10 12 A V H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 3,-0.2 0.951 109.9 49.6 -64.8 -46.8 -9.2 16.7 4.4 11 13 A K H X S+ 0 0 47 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.878 106.1 58.7 -60.9 -37.2 -13.0 16.0 4.4 12 14 A D H X S+ 0 0 37 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.910 108.1 44.4 -52.9 -47.6 -12.9 16.4 0.6 13 15 A V H X S+ 0 0 5 -4,-1.8 4,-2.6 -3,-0.2 5,-0.3 0.913 112.8 51.5 -65.0 -45.4 -10.4 13.5 0.3 14 16 A V H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 5,-0.5 0.912 113.2 45.4 -57.1 -45.2 -12.4 11.4 2.8 15 17 A A H X S+ 0 0 22 -4,-2.7 4,-1.7 3,-0.2 -2,-0.2 0.896 114.9 47.4 -65.9 -39.4 -15.6 12.0 0.7 16 18 A D H < S+ 0 0 115 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.861 118.9 39.6 -70.2 -37.9 -13.9 11.3 -2.6 17 19 A Q H < S+ 0 0 85 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.888 130.3 25.6 -78.7 -45.0 -12.2 8.1 -1.4 18 20 A L H < S- 0 0 38 -4,-2.6 -3,-0.2 -5,-0.3 -2,-0.2 0.663 90.6-138.9 -96.8 -21.0 -15.0 6.7 0.7 19 21 A G < + 0 0 62 -4,-1.7 -4,-0.2 -5,-0.5 -3,-0.1 0.453 47.7 149.8 77.1 2.0 -18.0 8.3 -1.0 20 22 A V - 0 0 25 -6,-0.4 -1,-0.2 1,-0.1 2,-0.1 -0.276 60.2 -82.8 -69.8 152.7 -19.9 9.0 2.3 21 23 A D > - 0 0 109 1,-0.1 3,-2.0 2,-0.1 4,-0.3 -0.385 36.4-135.0 -49.8 122.1 -22.3 12.0 2.8 22 24 A R G > S+ 0 0 81 1,-0.3 3,-1.9 2,-0.2 -1,-0.1 0.818 102.9 68.7 -54.4 -36.2 -20.1 15.0 3.7 23 25 A A G 3 S+ 0 0 88 1,-0.3 -1,-0.3 3,-0.0 -2,-0.1 0.752 95.5 55.5 -54.7 -26.5 -22.5 15.8 6.5 24 26 A R G < S+ 0 0 124 -3,-2.0 2,-0.6 2,-0.0 -1,-0.3 0.598 87.8 93.7 -80.9 -13.3 -21.3 12.7 8.3 25 27 A I < + 0 0 4 -3,-1.9 -14,-0.1 -4,-0.3 -10,-0.0 -0.714 46.7 148.5 -94.0 119.1 -17.6 13.7 8.2 26 28 A N > - 0 0 70 -2,-0.6 3,-1.9 1,-0.0 42,-0.4 -0.916 61.8 -91.2-137.9 172.3 -16.3 15.5 11.3 27 29 A P T 3 S+ 0 0 42 0, 0.0 42,-2.5 0, 0.0 43,-0.3 0.821 125.0 50.1 -56.8 -32.8 -13.0 15.7 13.1 28 30 A E T 3 S+ 0 0 167 40,-0.2 2,-0.1 39,-0.1 -3,-0.0 0.546 79.4 124.2 -83.3 -5.8 -13.9 12.8 15.4 29 31 A S < - 0 0 4 -3,-1.9 39,-1.6 38,-0.1 2,-0.5 -0.360 52.5-149.4 -55.8 124.4 -15.0 10.4 12.5 30 32 A N B >> -A 67 0A 26 37,-0.2 4,-2.8 1,-0.1 5,-1.1 -0.871 6.1-144.3 -98.7 122.2 -13.1 7.2 12.8 31 33 A F H >5S+ 0 0 7 35,-2.2 6,-2.1 -2,-0.5 4,-0.8 0.909 95.5 35.0 -58.1 -49.7 -12.6 5.8 9.3 32 34 A I H 45S+ 0 0 108 34,-0.4 4,-0.5 4,-0.2 -1,-0.2 0.902 126.1 37.4 -67.1 -46.3 -12.8 2.0 10.3 33 35 A K H 45S+ 0 0 176 2,-0.1 -2,-0.2 3,-0.1 -1,-0.1 0.869 131.0 24.0 -81.4 -35.9 -15.5 2.3 13.1 34 36 A D H <5S+ 0 0 83 -4,-2.8 -3,-0.2 1,-0.1 -2,-0.1 0.777 130.9 34.6-100.4 -32.7 -17.7 5.0 11.7 35 37 A L S < - 0 0 84 -2,-0.4 4,-2.2 1,-0.0 5,-0.1 -0.332 37.3 -88.4 -90.3-178.8 -11.7 -1.9 5.2 39 41 A S H > S+ 0 0 103 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.898 129.5 45.7 -62.7 -44.0 -7.9 -2.5 4.9 40 42 A L H > S+ 0 0 118 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.930 111.7 52.2 -60.4 -47.9 -7.8 -1.7 1.2 41 43 A D H > S+ 0 0 47 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.894 110.7 50.8 -53.3 -45.4 -10.0 1.5 1.7 42 44 A S H X S+ 0 0 30 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.880 109.0 47.1 -65.8 -45.1 -7.5 2.5 4.4 43 45 A V H X S+ 0 0 83 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.943 115.1 47.2 -60.1 -46.9 -4.3 2.1 2.3 44 46 A E H X S+ 0 0 90 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.849 111.1 51.8 -64.9 -34.4 -5.9 4.0 -0.6 45 47 A L H X S+ 0 0 3 -4,-2.0 4,-2.2 -5,-0.2 -1,-0.2 0.923 109.7 49.2 -69.2 -44.0 -7.1 6.7 1.7 46 48 A V H X S+ 0 0 20 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.936 110.8 50.0 -56.6 -48.9 -3.6 7.2 3.2 47 49 A M H X S+ 0 0 80 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.868 108.7 53.4 -61.2 -36.1 -2.1 7.3 -0.3 48 50 A A H X S+ 0 0 9 -4,-1.9 4,-3.1 2,-0.2 -1,-0.2 0.886 107.0 50.2 -67.7 -40.1 -4.7 10.0 -1.3 49 51 A F H X S+ 0 0 1 -4,-2.2 4,-2.0 2,-0.2 6,-0.3 0.934 111.1 51.1 -58.9 -44.5 -3.7 12.1 1.7 50 52 A E H X>S+ 0 0 50 -4,-2.4 5,-1.4 1,-0.2 4,-1.2 0.943 117.2 37.8 -59.3 -48.3 -0.1 11.8 0.6 51 53 A E H <5S+ 0 0 159 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.917 117.9 48.9 -67.4 -48.3 -0.8 12.8 -3.0 52 54 A K H <5S+ 0 0 113 -4,-3.1 -1,-0.2 -5,-0.2 -2,-0.2 0.749 125.3 27.6 -65.0 -28.7 -3.4 15.5 -2.2 53 55 A F H <5S- 0 0 18 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.438 101.6-120.9-115.6 -2.1 -1.3 17.2 0.5 54 56 A G T <5 + 0 0 70 -4,-1.2 2,-0.3 1,-0.2 -3,-0.2 0.935 68.3 130.5 58.5 51.7 2.2 16.4 -0.7 55 57 A V < - 0 0 14 -5,-1.4 2,-0.4 -6,-0.3 -1,-0.2 -0.872 56.2-123.5-128.9 160.7 3.2 14.7 2.5 56 58 A S - 0 0 96 -2,-0.3 -9,-0.0 -3,-0.1 22,-0.0 -0.921 20.6-176.2-109.2 132.5 4.7 11.3 3.3 57 59 A I - 0 0 9 -2,-0.4 -7,-0.1 4,-0.0 5,-0.1 -0.779 12.4-161.0-128.6 85.0 2.9 8.8 5.5 58 60 A P >> - 0 0 55 0, 0.0 4,-2.8 0, 0.0 3,-1.0 -0.185 36.6 -99.5 -66.3 163.5 5.1 5.7 6.1 59 61 A D H 3> S+ 0 0 127 1,-0.3 4,-1.6 2,-0.2 5,-0.1 0.810 121.9 58.5 -60.1 -29.9 3.4 2.5 7.3 60 62 A E H 34 S+ 0 0 118 1,-0.2 -1,-0.3 2,-0.2 4,-0.2 0.871 114.9 35.9 -67.4 -36.0 4.3 3.1 10.9 61 63 A E H X4 S+ 0 0 62 -3,-1.0 3,-1.7 2,-0.1 4,-0.3 0.852 109.0 66.4 -81.3 -34.4 2.6 6.5 10.9 62 64 A A H >< S+ 0 0 24 -4,-2.8 3,-1.6 1,-0.3 -2,-0.2 0.854 94.2 58.4 -54.4 -38.2 -0.3 5.2 8.6 63 65 A S T 3< S+ 0 0 98 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.1 0.769 103.6 53.6 -65.5 -21.3 -1.6 2.8 11.3 64 66 A K T < S+ 0 0 128 -3,-1.7 2,-1.5 -4,-0.2 3,-0.3 0.430 79.4 95.7 -95.7 -0.8 -2.1 5.8 13.7 65 67 A I < + 0 0 17 -3,-1.6 -1,-0.1 -4,-0.3 -34,-0.1 -0.684 44.1 143.2 -90.5 82.4 -4.2 7.8 11.2 66 68 A A + 0 0 36 -2,-1.5 -35,-2.2 -35,-0.1 -34,-0.4 0.744 56.7 32.9 -90.9 -32.8 -7.5 6.6 12.7 67 69 A T B > S-A 30 0A 25 -3,-0.3 4,-1.9 -37,-0.3 -37,-0.2 -0.763 82.1-105.9-125.8 167.0 -9.7 9.7 12.5 68 70 A V H > S+ 0 0 0 -39,-1.6 4,-2.4 -42,-0.4 -40,-0.2 0.910 122.4 52.6 -54.7 -47.7 -10.3 12.8 10.4 69 71 A Q H > S+ 0 0 70 -42,-2.5 4,-3.2 1,-0.2 5,-0.3 0.881 104.8 54.6 -58.1 -42.2 -8.5 14.9 13.1 70 72 A D H > S+ 0 0 56 -43,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.934 110.1 46.3 -58.0 -47.8 -5.4 12.5 13.1 71 73 A A H X S+ 0 0 2 -4,-1.9 4,-2.4 2,-0.2 5,-0.2 0.945 114.1 47.7 -60.2 -49.5 -5.0 13.1 9.3 72 74 A L H X S+ 0 0 3 -4,-2.4 4,-2.9 2,-0.2 -2,-0.2 0.924 114.1 46.6 -55.0 -52.0 -5.5 17.0 9.7 73 75 A S H X S+ 0 0 51 -4,-3.2 4,-2.5 1,-0.2 -1,-0.2 0.904 112.2 50.8 -61.2 -43.0 -3.0 17.2 12.6 74 76 A Y H X S+ 0 0 51 -4,-2.6 4,-2.7 -5,-0.3 -1,-0.2 0.914 112.9 45.0 -59.6 -45.7 -0.4 15.0 10.8 75 77 A I H X S+ 0 0 1 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.940 112.2 51.8 -65.5 -47.7 -0.6 17.1 7.6 76 78 A E H < S+ 0 0 87 -4,-2.9 4,-0.2 1,-0.2 -2,-0.2 0.922 112.7 45.3 -53.3 -48.1 -0.4 20.4 9.6 77 79 A K H >< S+ 0 0 159 -4,-2.5 3,-1.3 1,-0.2 -2,-0.2 0.893 109.5 55.6 -63.0 -43.2 2.7 19.1 11.4 78 80 A A H 3< S+ 0 0 53 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.851 110.5 45.6 -56.2 -35.9 4.2 17.9 8.1 79 81 A K T 3< 0 0 118 -4,-2.1 -1,-0.2 -5,-0.1 -2,-0.2 0.398 360.0 360.0 -90.0 2.4 3.8 21.4 6.6 80 82 A S < 0 0 132 -3,-1.3 -3,-0.1 -4,-0.2 -4,-0.0 -0.316 360.0 360.0 -91.6 360.0 5.2 23.2 9.7