==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-DEC-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN TRANSPORT 24-OCT-11 4A56 . COMPND 2 MOLECULE: PULLULANASE SECRETION PROTEIN PULS; . SOURCE 2 ORGANISM_SCIENTIFIC: KLEBSIELLA OXYTOCA; . AUTHOR T.TOSI,N.N.NICKERSON,L.MOLLICA,M.RINGKJOBINGJENSEN,M.BLACKLE . 93 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5647.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 70 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 . 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 . 2 2.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 4 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 61 65.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 2.2 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 1 0 0 0 1 0 0 0 1 0 1 0 0 0 1 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 30 A V 0 0 118 0, 0.0 5,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 117.1 5.5 10.7 5.2 2 31 A S > - 0 0 66 1,-0.1 4,-2.4 4,-0.0 5,-0.2 -0.234 360.0-114.9 -67.1 158.3 6.2 7.3 6.9 3 32 A G H > S+ 0 0 49 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.880 119.2 55.5 -55.2 -39.8 3.4 4.8 7.5 4 33 A Q H > S+ 0 0 162 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.923 109.3 45.2 -59.8 -46.1 4.0 5.4 11.2 5 34 A A H > S+ 0 0 30 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.850 110.6 54.4 -67.2 -36.7 3.5 9.1 10.9 6 35 A Q H X S+ 0 0 25 -4,-2.4 4,-2.5 2,-0.2 5,-0.3 0.951 111.0 44.8 -59.9 -50.7 0.4 8.6 8.7 7 36 A L H X S+ 0 0 43 -4,-2.5 4,-2.8 1,-0.2 5,-0.2 0.919 114.1 50.3 -60.9 -42.2 -1.2 6.4 11.4 8 37 A E H X S+ 0 0 63 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.912 111.3 47.5 -65.5 -42.7 -0.2 8.8 14.1 9 38 A Q H X S+ 0 0 85 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.929 115.9 43.3 -64.7 -46.5 -1.6 11.9 12.3 10 39 A L H X S+ 0 0 2 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.904 114.5 50.0 -67.3 -38.2 -5.0 10.2 11.5 11 40 A A H X S+ 0 0 0 -4,-2.8 4,-2.7 -5,-0.3 -1,-0.2 0.852 109.1 54.0 -67.2 -34.4 -5.2 8.7 15.0 12 41 A S H X S+ 0 0 56 -4,-2.1 4,-2.6 -5,-0.2 -1,-0.2 0.916 110.6 43.8 -65.3 -47.9 -4.5 12.1 16.6 13 42 A V H X S+ 0 0 37 -4,-2.0 4,-2.4 2,-0.2 5,-0.2 0.899 115.3 49.4 -66.7 -39.1 -7.3 13.8 14.7 14 43 A A H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.934 113.6 45.9 -62.8 -46.9 -9.7 11.0 15.4 15 44 A A H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.917 113.9 48.6 -61.3 -45.3 -8.9 10.9 19.1 16 45 A G H X S+ 0 0 4 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.896 111.3 49.3 -64.6 -40.1 -9.2 14.7 19.3 17 46 A A H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.913 111.1 49.8 -67.5 -40.8 -12.5 14.8 17.5 18 47 A R H X S+ 0 0 28 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.898 110.4 51.0 -60.8 -41.0 -13.9 12.1 19.8 19 48 A Y H X>S+ 0 0 1 -4,-2.3 4,-3.0 2,-0.2 5,-0.6 0.936 110.6 48.7 -62.4 -44.1 -12.6 14.1 22.8 20 49 A L H X5S+ 0 0 0 -4,-2.5 6,-2.0 1,-0.2 4,-1.7 0.928 113.5 47.5 -58.7 -46.7 -14.4 17.2 21.5 21 50 A K H <5S+ 0 0 46 -4,-2.5 -1,-0.2 4,-0.2 -2,-0.2 0.893 122.6 32.9 -60.3 -45.6 -17.6 15.2 20.9 22 51 A N H <5S+ 0 0 82 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.847 134.1 20.1 -84.7 -35.5 -17.6 13.6 24.3 23 52 A K H <5S+ 0 0 90 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.2 0.500 120.7 50.7-119.2 -8.8 -16.0 16.2 26.6 24 53 A a S < + 0 0 53 -6,-2.0 3,-1.9 1,-0.2 -1,-0.2 -0.422 5.0 156.8 -84.2 66.7 -19.4 19.1 20.3 27 56 A S T 3 + 0 0 112 -2,-2.0 -1,-0.2 1,-0.3 -6,-0.1 0.507 61.4 73.8 -72.5 -6.5 -22.7 17.3 19.7 28 57 A D T 3 S+ 0 0 72 -3,-0.2 -1,-0.3 2,-0.0 -2,-0.1 0.520 80.1 91.9 -76.8 -12.8 -22.6 18.4 16.0 29 58 A L S < S- 0 0 10 -3,-1.9 3,-0.1 1,-0.1 6,-0.0 -0.545 80.1-117.1 -83.1 153.7 -19.9 15.7 15.5 30 59 A P - 0 0 46 0, 0.0 -1,-0.1 0, 0.0 -9,-0.1 -0.171 41.9 -66.9 -86.2-178.8 -20.9 12.2 14.4 31 60 A A >> - 0 0 57 1,-0.1 4,-2.2 3,-0.1 3,-0.7 -0.137 52.0 -99.2 -66.8 161.8 -20.4 8.9 16.2 32 61 A D H 3> S+ 0 0 72 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.855 122.2 53.0 -49.9 -43.2 -17.0 7.4 16.9 33 62 A E H 3> S+ 0 0 113 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.885 110.5 47.8 -65.1 -35.5 -17.3 5.0 13.9 34 63 A A H <> S+ 0 0 17 -3,-0.7 4,-2.4 2,-0.2 -1,-0.2 0.847 108.8 53.3 -73.0 -34.5 -18.0 7.9 11.5 35 64 A I H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.922 109.3 50.4 -62.5 -43.8 -15.1 9.9 13.0 36 65 A N H X S+ 0 0 23 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.945 110.8 48.4 -59.8 -48.0 -12.9 6.9 12.2 37 66 A R H X S+ 0 0 129 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.891 109.7 52.7 -58.9 -41.5 -14.2 6.7 8.6 38 67 A A H X S+ 0 0 10 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.883 108.5 49.6 -63.9 -39.2 -13.7 10.5 8.2 39 68 A A H X S+ 0 0 0 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.927 110.0 50.9 -66.0 -43.6 -10.0 10.1 9.3 40 69 A I H X S+ 0 0 24 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.915 108.2 54.2 -54.3 -43.1 -9.6 7.2 6.8 41 70 A N H X S+ 0 0 75 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.859 102.8 55.8 -64.6 -34.9 -11.0 9.5 4.1 42 71 A V H X S+ 0 0 20 -4,-1.8 4,-1.4 2,-0.2 -1,-0.2 0.952 110.1 46.7 -58.5 -47.6 -8.5 12.2 4.9 43 72 A G H X>S+ 0 0 2 -4,-1.9 5,-2.2 1,-0.2 4,-0.6 0.929 110.4 51.6 -60.2 -46.2 -5.8 9.7 4.3 44 73 A K H ><5S+ 0 0 115 -4,-2.6 3,-1.4 1,-0.2 -1,-0.2 0.910 106.7 54.2 -59.6 -40.5 -7.4 8.4 1.0 45 74 A K H 3<5S+ 0 0 158 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.827 106.1 52.5 -63.1 -31.9 -7.6 12.0 -0.3 46 75 A R H 3<5S- 0 0 146 -4,-1.4 -1,-0.3 -3,-0.4 -2,-0.2 0.518 118.2-114.0 -79.9 -9.0 -3.9 12.4 0.3 47 76 A G T <<5 + 0 0 64 -3,-1.4 -3,-0.2 -4,-0.6 -2,-0.1 0.634 59.6 163.3 85.4 15.4 -3.2 9.2 -1.7 48 77 A W < - 0 0 39 -5,-2.2 -1,-0.2 -6,-0.2 3,-0.1 -0.309 47.2 -91.6 -68.2 150.7 -1.9 7.5 1.3 49 78 A A - 0 0 76 1,-0.2 -1,-0.1 0, 0.0 -2,-0.0 -0.257 64.0 -75.1 -53.7 145.4 -1.6 3.7 1.4 50 79 A N - 0 0 144 -3,-0.1 2,-0.5 1,-0.1 -1,-0.2 -0.253 50.0-148.7 -50.7 121.9 -4.7 2.0 2.8 51 80 A I - 0 0 32 -3,-0.1 2,-0.3 -11,-0.1 -1,-0.1 -0.868 19.4-117.9 -95.9 127.2 -4.8 2.5 6.5 52 81 A D > - 0 0 86 -2,-0.5 4,-2.3 1,-0.1 5,-0.2 -0.533 16.4-144.8 -67.9 126.2 -6.4 -0.4 8.4 53 82 A A H > S+ 0 0 35 -2,-0.3 4,-2.1 1,-0.2 -1,-0.1 0.804 97.9 51.4 -65.3 -33.5 -9.5 1.0 10.3 54 83 A N H > S+ 0 0 123 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.888 109.3 48.8 -74.2 -38.1 -9.0 -1.3 13.3 55 84 A L H > S+ 0 0 107 2,-0.2 4,-2.5 1,-0.2 5,-0.3 0.924 112.1 50.6 -61.1 -43.2 -5.3 -0.3 13.7 56 85 A L H X S+ 0 0 0 -4,-2.3 4,-3.0 1,-0.2 -2,-0.2 0.931 110.4 50.2 -57.8 -46.0 -6.5 3.3 13.5 57 86 A S H X S+ 0 0 58 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.898 110.6 48.5 -59.6 -44.4 -9.1 2.5 16.1 58 87 A Q H X S+ 0 0 144 -4,-2.4 4,-1.5 2,-0.2 -1,-0.2 0.931 115.8 42.6 -64.6 -45.6 -6.6 0.9 18.5 59 88 A R H X S+ 0 0 78 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.916 112.3 54.4 -68.0 -40.6 -4.1 3.8 18.2 60 89 A S H X S+ 0 0 1 -4,-3.0 4,-2.7 -5,-0.3 -1,-0.2 0.885 105.9 53.2 -57.6 -43.3 -6.9 6.4 18.4 61 90 A A H X S+ 0 0 46 -4,-2.1 4,-1.9 -5,-0.2 -1,-0.2 0.894 108.3 49.9 -64.0 -37.5 -8.0 4.9 21.7 62 91 A Q H X S+ 0 0 94 -4,-1.5 4,-2.0 2,-0.2 -2,-0.2 0.942 112.6 46.6 -64.4 -46.4 -4.5 5.1 23.1 63 92 A L H X S+ 0 0 15 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.881 109.0 55.1 -64.2 -36.7 -4.3 8.8 22.1 64 93 A Y H X S+ 0 0 29 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.909 106.6 50.8 -61.1 -44.2 -7.7 9.5 23.6 65 94 A Q H X S+ 0 0 82 -4,-1.9 4,-2.8 1,-0.2 5,-0.2 0.922 108.5 53.1 -58.8 -41.5 -6.6 8.1 26.9 66 95 A Q H X S+ 0 0 93 -4,-2.0 4,-1.7 1,-0.2 -2,-0.2 0.916 109.9 47.1 -59.1 -44.0 -3.6 10.4 26.8 67 96 A L H < S+ 0 0 42 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.897 114.5 47.8 -67.8 -36.9 -5.8 13.4 26.2 68 97 A Q H < S+ 0 0 60 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.921 113.0 45.6 -66.9 -47.0 -8.1 12.3 29.1 69 98 A Q H < S+ 0 0 115 -4,-2.8 -1,-0.2 -5,-0.1 -2,-0.2 0.740 86.0 107.9 -75.9 -22.7 -5.3 11.7 31.6 70 99 A D < - 0 0 80 -4,-1.7 -3,-0.0 -5,-0.2 -4,-0.0 -0.273 68.6-139.7 -57.6 136.2 -3.4 14.9 30.9 71 100 A S + 0 0 115 2,-0.0 -1,-0.1 3,-0.0 3,-0.1 0.457 59.3 125.2 -85.5 -0.4 -3.9 17.3 33.7 72 101 A T S S- 0 0 54 1,-0.1 5,-0.1 2,-0.1 0, 0.0 -0.317 78.0 -91.2 -51.0 138.0 -4.3 20.5 31.6 73 102 A P > - 0 0 89 0, 0.0 4,-2.1 0, 0.0 3,-0.4 -0.209 33.6-120.9 -53.8 145.7 -7.6 22.2 32.6 74 103 A E H > S+ 0 0 84 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.858 110.2 56.8 -60.5 -39.1 -10.5 21.0 30.5 75 104 A A H > S+ 0 0 79 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.898 108.4 48.3 -60.5 -38.7 -11.4 24.5 29.2 76 105 A T H > S+ 0 0 75 -3,-0.4 4,-2.5 2,-0.2 -2,-0.2 0.921 112.2 48.9 -67.0 -43.6 -7.8 24.8 27.8 77 106 A K H X S+ 0 0 5 -4,-2.1 4,-2.9 2,-0.2 5,-0.3 0.952 113.0 46.9 -56.4 -52.0 -8.0 21.4 26.2 78 107 A a H X S+ 0 0 21 -4,-3.0 4,-2.5 1,-0.2 5,-0.2 0.921 112.4 49.5 -62.7 -42.5 -11.3 22.1 24.6 79 108 A S H X S+ 0 0 64 -4,-2.4 4,-1.8 -5,-0.2 -1,-0.2 0.934 113.9 45.7 -60.2 -47.9 -10.2 25.5 23.3 80 109 A Q H X S+ 0 0 81 -4,-2.5 4,-2.9 1,-0.2 -2,-0.2 0.937 115.4 45.6 -62.1 -46.5 -7.0 24.1 21.8 81 110 A F H X S+ 0 0 17 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.878 108.2 55.9 -70.4 -37.8 -8.7 21.1 20.2 82 111 A N H < S+ 0 0 52 -4,-2.5 4,-0.4 -5,-0.3 -1,-0.2 0.910 114.8 41.2 -59.3 -40.9 -11.6 23.2 18.7 83 112 A R H >< S+ 0 0 164 -4,-1.8 3,-1.0 -5,-0.2 -2,-0.2 0.955 116.9 45.9 -69.0 -49.5 -9.0 25.4 17.0 84 113 A Q H 3< S+ 0 0 116 -4,-2.9 4,-0.3 1,-0.2 -2,-0.2 0.820 116.3 45.0 -66.5 -33.1 -6.6 22.6 15.9 85 114 A L T 3X S+ 0 0 13 -4,-2.5 4,-2.9 -5,-0.2 5,-0.3 0.415 79.4 101.4 -93.5 -2.0 -9.4 20.3 14.5 86 115 A A H <> S+ 0 0 43 -3,-1.0 4,-2.1 -4,-0.4 -1,-0.2 0.908 84.4 47.7 -52.1 -43.9 -11.4 22.9 12.6 87 116 A P H > S+ 0 0 93 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.940 113.0 48.2 -62.9 -43.6 -9.9 21.8 9.2 88 117 A F H > S+ 0 0 16 -4,-0.3 4,-2.2 1,-0.2 3,-0.2 0.927 110.6 51.6 -59.0 -46.5 -10.6 18.1 9.9 89 118 A I H X S+ 0 0 7 -4,-2.9 4,-1.4 1,-0.2 -1,-0.2 0.898 106.0 54.7 -62.7 -36.7 -14.1 18.9 11.0 90 119 A D H < S+ 0 0 123 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.874 110.1 47.8 -61.9 -34.4 -14.7 20.9 7.8 91 120 A S H < S+ 0 0 44 -4,-1.6 -2,-0.2 -3,-0.2 -1,-0.2 0.858 107.5 53.4 -72.3 -39.8 -13.6 17.7 5.8 92 121 A L H < 0 0 40 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.783 360.0 360.0 -69.7 -24.3 -15.8 15.3 7.8 93 122 A R < 0 0 202 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.637 360.0 360.0 -92.5 360.0 -18.8 17.6 7.0