==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-OCT-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER BIOSYNTHETIC PROTEIN 12-JAN-10 2X2B . COMPND 2 MOLECULE: ACYL CARRIER PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR M.BELLINZONI,M.A.MARTINEZ,D.DEMENDOZA,P.M.ALZARI . 76 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5218.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 52 68.4 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 2.6 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 . 2 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 8 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 36 47.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 2.6 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 1 0 0 0 0 1 1 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 1 A M > 0 0 148 0, 0.0 4,-1.3 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 141.8 76.4 9.3 32.6 2 2 A A H > + 0 0 79 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.793 360.0 61.0 -69.8 -35.2 74.1 11.0 35.1 3 3 A D H > S+ 0 0 70 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.866 102.7 51.8 -62.1 -38.0 72.2 12.8 32.3 4 4 A T H > S+ 0 0 15 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.924 112.1 44.6 -64.2 -45.7 71.2 9.5 30.8 5 5 A L H X S+ 0 0 67 -4,-1.3 4,-2.6 2,-0.2 -2,-0.2 0.851 111.1 53.7 -71.1 -32.6 69.8 8.2 34.1 6 6 A E H X S+ 0 0 144 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.921 111.4 47.3 -63.0 -42.5 68.1 11.5 34.9 7 7 A R H X S+ 0 0 75 -4,-2.0 4,-1.4 2,-0.2 -2,-0.2 0.902 114.1 45.5 -67.9 -42.9 66.4 11.2 31.5 8 8 A V H X S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.910 114.5 49.0 -62.9 -44.9 65.3 7.6 32.0 9 9 A T H X S+ 0 0 12 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.856 105.7 56.6 -67.1 -38.5 64.1 8.3 35.5 10 10 A K H X S+ 0 0 131 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.913 109.1 47.4 -58.2 -42.5 62.0 11.3 34.4 11 11 A I H X S+ 0 0 7 -4,-1.4 4,-2.7 2,-0.2 5,-0.2 0.910 110.8 49.6 -69.0 -44.1 60.2 9.1 31.9 12 12 A I H X S+ 0 0 0 -4,-2.0 4,-3.1 1,-0.2 5,-0.4 0.940 113.3 47.3 -61.6 -46.5 59.5 6.3 34.4 13 13 A V H X S+ 0 0 47 -4,-2.5 4,-1.4 1,-0.2 -2,-0.2 0.902 112.5 51.1 -58.8 -44.1 58.2 8.9 36.9 14 14 A D H < S+ 0 0 82 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.931 120.9 31.4 -58.8 -47.5 56.1 10.5 34.1 15 15 A R H < S+ 0 0 127 -4,-2.7 -2,-0.2 1,-0.1 -3,-0.2 0.890 127.2 35.0 -83.7 -42.2 54.4 7.2 33.0 16 16 A L H < S- 0 0 30 -4,-3.1 -3,-0.2 -5,-0.2 -2,-0.1 0.536 90.9-134.9 -95.9 -10.9 54.2 5.1 36.2 17 17 A G < + 0 0 64 -4,-1.4 -4,-0.2 -5,-0.4 2,-0.1 0.725 53.9 142.3 66.4 24.9 53.5 7.9 38.8 18 18 A V - 0 0 28 -6,-0.4 -1,-0.2 1,-0.1 2,-0.1 -0.487 58.1 -93.2 -93.5 164.2 56.0 6.5 41.3 19 19 A D > - 0 0 114 -2,-0.1 3,-1.5 1,-0.1 4,-0.4 -0.493 31.0-121.9 -69.0 147.0 58.4 8.5 43.6 20 20 A E G > S+ 0 0 147 1,-0.3 3,-2.2 2,-0.2 -1,-0.1 0.904 112.8 64.7 -54.1 -40.8 61.9 9.2 42.2 21 21 A A G 3 S+ 0 0 77 1,-0.3 -1,-0.3 2,-0.0 3,-0.0 0.716 97.7 55.5 -55.4 -23.8 63.2 7.4 45.4 22 22 A D G < S+ 0 0 81 -3,-1.5 2,-1.7 1,-0.2 -1,-0.3 0.564 82.3 91.3 -87.0 -10.0 61.6 4.2 44.1 23 23 A V < + 0 0 16 -3,-2.2 2,-0.2 -4,-0.4 -1,-0.2 -0.501 56.7 154.7 -87.7 67.8 63.3 4.2 40.8 24 24 A K > - 0 0 138 -2,-1.7 3,-1.4 1,-0.1 42,-0.4 -0.586 56.6-111.6 -89.2 156.3 66.3 2.1 41.8 25 25 A L T 3 S+ 0 0 100 1,-0.3 42,-3.0 -2,-0.2 43,-0.4 0.876 117.5 49.9 -54.5 -41.4 68.4 0.1 39.2 26 26 A E T 3 S+ 0 0 175 40,-0.2 2,-0.3 39,-0.1 -1,-0.3 0.549 84.7 112.4 -76.6 -9.3 67.2 -3.2 40.7 27 27 A A < - 0 0 10 -3,-1.4 39,-2.1 38,-0.1 2,-0.4 -0.509 61.8-141.8 -70.7 123.6 63.5 -2.2 40.6 28 28 A S B >> -A 65 0A 7 -2,-0.3 4,-2.2 37,-0.2 5,-1.7 -0.705 9.9-133.7 -87.5 138.0 61.4 -4.2 38.1 29 29 A F T 45S+ 0 0 5 35,-2.3 6,-2.6 -2,-0.4 4,-0.2 0.879 102.1 34.0 -56.7 -43.1 58.8 -2.3 36.2 30 30 A K T >5S+ 0 0 114 34,-0.4 4,-0.6 4,-0.2 -1,-0.2 0.956 125.5 35.3 -79.5 -54.7 56.1 -4.9 36.7 31 31 A E T 45S+ 0 0 174 33,-0.1 -2,-0.2 1,-0.1 -1,-0.1 0.852 134.4 19.9 -74.6 -32.5 56.8 -6.4 40.1 32 32 A D T <5S+ 0 0 103 -4,-2.2 -3,-0.2 1,-0.1 -1,-0.1 0.768 126.0 42.1-106.5 -34.1 58.0 -3.2 41.9 33 33 A L T 4 - 0 0 88 -2,-0.1 4,-2.2 1,-0.0 3,-0.2 -0.620 39.8 -85.5-103.7-179.3 51.5 -3.8 33.3 37 37 A S H > S+ 0 0 69 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.805 127.9 51.4 -57.5 -36.8 52.5 -5.1 29.8 38 38 A L H > S+ 0 0 144 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.925 110.7 50.4 -64.8 -43.6 50.9 -2.2 27.9 39 39 A D H > S+ 0 0 61 1,-0.2 4,-2.8 2,-0.2 -2,-0.2 0.910 108.5 52.2 -57.5 -44.1 52.8 0.3 30.1 40 40 A V H X S+ 0 0 25 -4,-2.2 4,-2.4 2,-0.2 5,-0.2 0.917 108.5 48.7 -64.6 -44.7 56.1 -1.5 29.5 41 41 A V H X S+ 0 0 83 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.939 113.0 50.5 -56.2 -45.6 55.8 -1.4 25.7 42 42 A E H X S+ 0 0 73 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.896 108.9 50.8 -60.4 -44.4 54.9 2.2 26.0 43 43 A L H X S+ 0 0 2 -4,-2.8 4,-2.6 1,-0.2 -1,-0.2 0.921 110.6 48.3 -59.0 -46.0 57.9 2.9 28.2 44 44 A V H X S+ 0 0 14 -4,-2.4 4,-2.9 2,-0.2 -2,-0.2 0.921 110.7 51.4 -64.4 -40.6 60.3 1.3 25.8 45 45 A M H X S+ 0 0 110 -4,-2.4 4,-1.5 1,-0.2 -1,-0.2 0.944 112.3 47.4 -59.0 -45.1 58.8 3.2 22.9 46 46 A E H X S+ 0 0 54 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.879 112.2 48.1 -66.6 -39.6 59.3 6.4 24.8 47 47 A L H X S+ 0 0 4 -4,-2.6 4,-1.7 1,-0.2 -1,-0.2 0.884 107.9 56.3 -67.7 -40.7 62.9 5.5 25.8 48 48 A E H <>S+ 0 0 21 -4,-2.9 5,-2.5 -5,-0.2 -1,-0.2 0.869 111.5 43.4 -53.1 -41.0 63.7 4.6 22.2 49 49 A D H ><5S+ 0 0 121 -4,-1.5 3,-0.8 3,-0.2 -2,-0.2 0.873 108.5 56.3 -81.8 -37.6 62.6 8.0 21.1 50 50 A E H 3<5S+ 0 0 73 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.831 118.0 35.1 -58.4 -35.5 64.3 10.0 23.9 51 51 A F T 3<5S- 0 0 31 -4,-1.7 -1,-0.2 2,-0.2 -2,-0.2 0.232 106.5-122.2-109.4 12.2 67.7 8.4 22.9 52 52 A D T < 5S+ 0 0 154 -3,-0.8 2,-0.3 1,-0.2 -3,-0.2 0.889 70.4 121.8 53.1 48.0 67.2 8.3 19.1 53 53 A M < - 0 0 30 -5,-2.5 2,-0.5 -6,-0.1 -1,-0.2 -0.959 58.8-131.3-139.5 153.7 67.7 4.5 19.0 54 54 A E - 0 0 163 -2,-0.3 2,-0.4 -3,-0.1 -9,-0.0 -0.934 18.2-157.3-106.9 129.0 65.8 1.5 17.8 55 55 A I - 0 0 14 -2,-0.5 2,-0.1 -11,-0.1 -7,-0.0 -0.900 18.2-127.3-101.7 133.5 65.5 -1.6 20.2 56 56 A S > - 0 0 57 -2,-0.4 4,-2.5 1,-0.1 5,-0.2 -0.371 21.7-112.2 -73.2 159.6 64.8 -5.0 18.6 57 57 A D H > S+ 0 0 136 1,-0.2 4,-1.6 2,-0.2 -1,-0.1 0.946 118.2 53.2 -49.7 -54.5 62.0 -7.3 19.9 58 58 A E H 4 S+ 0 0 136 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.870 113.2 41.6 -51.7 -47.0 64.5 -9.8 21.2 59 59 A D H >4 S+ 0 0 59 1,-0.2 3,-1.2 2,-0.2 4,-0.3 0.874 109.6 57.1 -72.0 -39.4 66.4 -7.1 23.3 60 60 A A H >< S+ 0 0 27 -4,-2.5 3,-1.1 1,-0.3 -1,-0.2 0.823 99.4 60.8 -61.8 -31.6 63.3 -5.3 24.6 61 61 A E T 3< S+ 0 0 158 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.697 97.4 59.3 -67.6 -20.6 62.1 -8.5 26.1 62 62 A K T < S+ 0 0 151 -3,-1.2 2,-1.5 -4,-0.3 3,-0.3 0.564 81.0 99.5 -84.8 -8.8 65.2 -8.7 28.3 63 63 A I < + 0 0 14 -3,-1.1 -1,-0.1 -4,-0.3 -34,-0.1 -0.563 32.1 138.1 -84.0 75.8 64.3 -5.4 29.9 64 64 A A + 0 0 56 -2,-1.5 -35,-2.3 -36,-0.1 -34,-0.4 0.853 63.8 41.3 -77.7 -39.6 62.7 -6.2 33.3 65 65 A T B > S-A 28 0A 29 -3,-0.3 4,-1.7 -37,-0.3 3,-0.2 -0.652 82.9-110.3-116.4 162.3 64.4 -3.5 35.5 66 66 A V H > S+ 0 0 0 -39,-2.1 4,-2.3 -42,-0.4 5,-0.2 0.928 121.3 52.7 -51.2 -46.9 65.4 0.1 35.4 67 67 A G H > S+ 0 0 10 -42,-3.0 4,-2.6 -43,-0.2 -1,-0.2 0.848 103.4 56.8 -59.9 -35.3 69.0 -1.0 35.3 68 68 A D H > S+ 0 0 57 -43,-0.4 4,-1.8 -3,-0.2 -1,-0.2 0.903 108.2 47.8 -63.0 -41.2 68.3 -3.3 32.3 69 69 A A H X S+ 0 0 2 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.941 112.4 47.3 -66.2 -47.5 67.0 -0.2 30.4 70 70 A V H X S+ 0 0 11 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.892 109.4 55.8 -60.9 -40.9 70.0 1.9 31.3 71 71 A N H X S+ 0 0 84 -4,-2.6 4,-1.2 -5,-0.2 -1,-0.2 0.906 107.5 47.9 -57.0 -43.8 72.4 -0.9 30.3 72 72 A Y H >< S+ 0 0 33 -4,-1.8 3,-0.6 2,-0.2 4,-0.3 0.955 112.8 47.7 -63.8 -49.9 70.9 -1.1 26.9 73 73 A I H >< S+ 0 0 18 -4,-2.1 3,-1.6 1,-0.2 -2,-0.2 0.922 111.4 52.1 -52.0 -47.6 71.1 2.6 26.3 74 74 A Q H 3< S+ 0 0 109 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.700 105.6 54.6 -67.6 -23.1 74.7 2.6 27.6 75 75 A N T << 0 0 128 -4,-1.2 -1,-0.3 -3,-0.6 -2,-0.2 0.390 360.0 360.0 -89.2 2.6 75.7 -0.2 25.1 76 76 A Q < 0 0 142 -3,-1.6 -23,-0.0 -4,-0.3 -3,-0.0 -0.522 360.0 360.0-108.5 360.0 74.4 1.8 22.0