==== 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 UNKNOWN FUNCTION 29-SEP-09 3K29 . COMPND 2 MOLECULE: PUTATIVE UNCHARACTERIZED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: CHLAMYDIA TRACHOMATIS; . AUTHOR R.LAM,A.SINGER,T.SKARINA,O.ONOPRIYENKO,A.BOCHKAREV,J.S.BRUNZ . 162 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13020.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 153 94.4 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 . 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 . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 6 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 146 90.1 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+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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 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 X 0 0 181 0, 0.0 2,-1.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 97.2 15.3 -7.8 79.1 2 2 A V - 0 0 137 133,-0.0 2,-0.2 3,-0.0 133,-0.0 -0.665 360.0-179.3 -74.6 101.6 14.7 -3.9 79.2 3 3 A R - 0 0 176 -2,-1.0 4,-0.0 1,-0.1 0, 0.0 -0.523 42.3 -67.9 -96.4 168.9 14.7 -2.9 75.6 4 4 A Y > - 0 0 18 -2,-0.2 3,-1.9 1,-0.2 -1,-0.1 -0.362 41.1-139.1 -60.4 127.0 14.2 0.7 74.2 5 5 A P T 3 S+ 0 0 88 0, 0.0 -1,-0.2 0, 0.0 4,-0.1 0.782 102.6 46.4 -61.9 -26.9 10.7 1.9 75.0 6 6 A L T >> S+ 0 0 88 1,-0.2 4,-2.3 2,-0.1 3,-0.7 0.075 72.7 120.5-106.5 25.3 10.4 3.5 71.5 7 7 A E H <> S+ 0 0 66 -3,-1.9 4,-2.9 1,-0.2 5,-0.2 0.901 72.8 57.4 -51.3 -44.2 11.7 0.5 69.6 8 8 A P H 3> S+ 0 0 85 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.850 106.9 47.9 -59.8 -34.0 8.4 0.3 67.7 9 9 A V H <> S+ 0 0 53 -3,-0.7 4,-2.4 2,-0.2 -2,-0.2 0.929 112.6 48.5 -70.1 -45.1 8.8 3.9 66.4 10 10 A L H X S+ 0 0 2 -4,-2.3 4,-2.3 2,-0.2 5,-0.2 0.948 110.0 51.8 -59.5 -47.6 12.5 3.2 65.4 11 11 A S H X S+ 0 0 64 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.941 112.3 47.1 -51.7 -50.3 11.5 -0.0 63.6 12 12 A I H X S+ 0 0 96 -4,-1.9 4,-1.8 -5,-0.2 -1,-0.2 0.878 109.2 52.8 -58.9 -41.1 8.8 2.0 61.7 13 13 A K H X S+ 0 0 46 -4,-2.4 4,-1.5 2,-0.2 -1,-0.2 0.813 106.9 52.7 -71.3 -31.4 11.2 4.8 60.8 14 14 A K H X S+ 0 0 104 -4,-2.3 4,-2.3 -3,-0.2 3,-0.3 0.931 109.4 50.3 -63.8 -45.9 13.6 2.4 59.3 15 15 A D H X S+ 0 0 76 -4,-2.0 4,-2.7 1,-0.2 -2,-0.2 0.852 106.4 54.9 -58.8 -37.4 10.8 1.0 57.2 16 16 A R H X S+ 0 0 95 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.812 107.3 49.6 -69.6 -36.7 9.9 4.5 56.1 17 17 A V H X S+ 0 0 16 -4,-1.5 4,-2.4 -3,-0.3 5,-0.2 0.922 110.2 51.0 -61.1 -49.8 13.4 5.1 54.8 18 18 A D H X S+ 0 0 93 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.944 112.4 47.3 -50.2 -52.2 13.2 1.7 53.0 19 19 A R H X S+ 0 0 144 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.861 111.4 49.7 -60.0 -40.6 9.9 2.8 51.4 20 20 A A H X S+ 0 0 13 -4,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.807 108.3 53.0 -71.7 -34.2 11.3 6.2 50.4 21 21 A E H X S+ 0 0 83 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.910 110.8 47.5 -61.7 -46.6 14.4 4.8 48.8 22 22 A K H X S+ 0 0 164 -4,-2.0 4,-1.9 -5,-0.2 -2,-0.2 0.880 110.8 52.3 -62.1 -39.7 12.1 2.5 46.7 23 23 A V H X S+ 0 0 69 -4,-2.0 4,-2.9 2,-0.2 -2,-0.2 0.936 107.4 51.1 -64.6 -43.9 10.0 5.5 45.8 24 24 A V H X S+ 0 0 9 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.915 111.7 48.7 -55.2 -46.7 13.1 7.6 44.6 25 25 A K H X S+ 0 0 160 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.841 110.3 50.3 -62.8 -38.5 14.1 4.6 42.4 26 26 A E H X S+ 0 0 74 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.940 110.0 50.5 -69.6 -41.8 10.5 4.4 41.1 27 27 A K H X S+ 0 0 50 -4,-2.9 4,-2.3 2,-0.2 -2,-0.2 0.877 106.5 55.2 -62.4 -37.3 10.5 8.1 40.3 28 28 A R H X S+ 0 0 131 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.948 111.0 45.8 -53.3 -50.0 13.9 7.7 38.5 29 29 A R H X S+ 0 0 112 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.863 110.7 51.4 -63.3 -41.0 12.3 5.1 36.3 30 30 A L H X S+ 0 0 55 -4,-2.5 4,-1.8 2,-0.2 -1,-0.2 0.899 111.4 47.9 -65.4 -38.3 9.2 7.1 35.7 31 31 A L H X S+ 0 0 23 -4,-2.3 4,-2.9 72,-0.2 -2,-0.2 0.888 109.0 54.9 -67.3 -40.1 11.3 10.1 34.6 32 32 A E H X S+ 0 0 97 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.919 104.9 52.9 -61.0 -44.7 13.3 7.7 32.4 33 33 A L H X S+ 0 0 78 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.929 112.2 45.2 -51.1 -49.8 10.1 6.6 30.6 34 34 A E H X S+ 0 0 37 -4,-1.8 4,-2.7 2,-0.2 -2,-0.2 0.919 111.2 52.6 -65.0 -42.2 9.2 10.2 29.9 35 35 A Q H X S+ 0 0 65 -4,-2.9 4,-2.0 1,-0.2 -2,-0.2 0.907 110.2 49.2 -56.8 -42.6 12.8 11.0 28.7 36 36 A E H X S+ 0 0 86 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.881 110.4 49.8 -63.4 -41.0 12.5 8.0 26.4 37 37 A K H X S+ 0 0 82 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.880 108.1 54.8 -67.4 -36.3 9.1 9.3 25.0 38 38 A L H X S+ 0 0 15 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.902 106.8 50.4 -59.6 -43.8 10.7 12.7 24.5 39 39 A R H X S+ 0 0 124 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.896 109.6 50.6 -61.8 -41.4 13.4 11.1 22.4 40 40 A E H X S+ 0 0 99 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.923 111.7 47.6 -60.9 -45.7 10.7 9.3 20.3 41 41 A R H X S+ 0 0 68 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.906 112.6 48.8 -58.7 -45.0 8.9 12.6 19.8 42 42 A E H X S+ 0 0 46 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.842 110.5 52.2 -66.9 -29.6 12.1 14.4 18.8 43 43 A S H X S+ 0 0 52 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.955 110.9 45.8 -70.6 -47.7 12.9 11.5 16.4 44 44 A E H X S+ 0 0 68 -4,-2.6 4,-1.6 1,-0.2 -2,-0.2 0.888 113.1 51.0 -63.6 -37.0 9.6 11.8 14.7 45 45 A R H X S+ 0 0 38 -4,-2.4 4,-3.0 1,-0.2 -1,-0.2 0.914 106.8 54.8 -65.4 -43.6 10.0 15.6 14.6 46 46 A D H X S+ 0 0 66 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.874 104.3 53.5 -62.1 -36.3 13.5 15.2 13.0 47 47 A K H X S+ 0 0 106 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.936 112.6 43.4 -66.4 -39.2 12.2 13.0 10.2 48 48 A V H X S+ 0 0 17 -4,-1.6 4,-2.0 2,-0.2 -2,-0.2 0.930 113.9 51.8 -65.0 -43.7 9.5 15.7 9.2 49 49 A K H X S+ 0 0 88 -4,-3.0 4,-2.4 1,-0.2 -2,-0.2 0.890 111.9 46.8 -60.3 -38.7 12.2 18.4 9.7 50 50 A N H X S+ 0 0 86 -4,-2.6 4,-2.9 1,-0.2 -1,-0.2 0.903 109.1 52.9 -70.6 -37.9 14.5 16.5 7.4 51 51 A H H X S+ 0 0 76 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.884 110.5 49.6 -61.1 -35.7 11.8 15.9 4.8 52 52 A Y H X S+ 0 0 61 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.951 110.6 48.9 -70.9 -47.4 11.2 19.7 4.9 53 53 A X H X S+ 0 0 80 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.926 109.4 52.2 -57.7 -47.2 14.8 20.4 4.4 54 54 A Q H X S+ 0 0 104 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.906 110.8 48.4 -55.2 -46.0 15.1 18.0 1.5 55 55 A K H X S+ 0 0 52 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.897 111.8 48.5 -61.7 -44.8 12.1 19.7 -0.2 56 56 A I H X S+ 0 0 69 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.934 114.0 46.5 -62.3 -43.8 13.5 23.2 0.3 57 57 A R H X S+ 0 0 130 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.889 109.5 54.3 -68.0 -36.2 17.0 22.0 -1.1 58 58 A Q H X S+ 0 0 66 -4,-2.3 4,-1.5 -5,-0.2 -1,-0.2 0.908 112.0 43.8 -64.8 -42.4 15.3 20.3 -4.0 59 59 A L H X S+ 0 0 17 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.907 110.6 55.4 -65.8 -42.1 13.5 23.6 -4.9 60 60 A R H X S+ 0 0 131 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.898 107.6 50.0 -58.4 -40.8 16.7 25.6 -4.4 61 61 A E H X S+ 0 0 105 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.889 110.0 50.2 -62.7 -39.2 18.5 23.3 -6.9 62 62 A Q H X S+ 0 0 78 -4,-1.5 4,-1.0 2,-0.2 -2,-0.2 0.916 109.4 51.3 -67.2 -40.1 15.7 23.9 -9.4 63 63 A L H >< S+ 0 0 79 -4,-2.6 3,-0.8 1,-0.2 -2,-0.2 0.928 109.9 49.3 -60.4 -44.2 16.0 27.6 -8.9 64 64 A D H 3< S+ 0 0 122 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.879 112.8 48.5 -64.1 -38.8 19.8 27.5 -9.5 65 65 A D H 3< S- 0 0 126 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.2 0.630 122.4-103.3 -70.6 -19.6 19.2 25.4 -12.7 66 66 A G << + 0 0 55 -4,-1.0 2,-0.2 -3,-0.8 -2,-0.1 0.365 49.5 178.2 89.9 125.8 16.5 27.8 -14.0 67 67 A T - 0 0 51 -4,-0.2 2,-0.3 -3,-0.0 -4,-0.0 -0.499 25.6 -94.6-141.2-156.2 12.9 26.8 -13.8 68 68 A T > - 0 0 85 -2,-0.2 4,-1.8 1,-0.1 5,-0.2 -0.909 31.1-110.5-133.9 157.9 9.4 28.1 -14.6 69 69 A S H > S+ 0 0 86 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.856 116.1 53.9 -56.5 -39.8 6.8 30.0 -12.5 70 70 A D H > S+ 0 0 129 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.921 108.1 47.7 -62.6 -43.6 4.4 26.9 -12.5 71 71 A A H > S+ 0 0 41 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.868 111.6 51.7 -68.8 -34.9 7.0 24.5 -11.1 72 72 A I H X S+ 0 0 50 -4,-1.8 4,-2.9 2,-0.2 5,-0.3 0.961 110.0 49.3 -62.8 -48.0 8.0 27.0 -8.4 73 73 A L H X S+ 0 0 111 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.943 112.1 48.3 -60.1 -44.4 4.3 27.4 -7.4 74 74 A K H X S+ 0 0 130 -4,-2.6 4,-1.7 2,-0.2 -1,-0.2 0.918 113.1 45.4 -62.9 -43.7 3.8 23.7 -7.2 75 75 A X H X S+ 0 0 48 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.918 113.1 51.5 -66.2 -40.5 7.0 23.0 -5.1 76 76 A K H X S+ 0 0 88 -4,-2.9 4,-2.5 2,-0.2 -2,-0.2 0.853 105.5 56.2 -63.8 -32.9 6.2 25.9 -2.8 77 77 A A H X S+ 0 0 58 -4,-2.1 4,-1.4 -5,-0.3 -1,-0.2 0.953 110.3 44.0 -66.6 -44.4 2.6 24.5 -2.3 78 78 A Y H X S+ 0 0 134 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.886 109.9 56.8 -62.1 -44.5 4.0 21.2 -1.1 79 79 A I H X S+ 0 0 21 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.929 104.1 53.3 -56.6 -43.4 6.6 23.0 1.1 80 80 A K H X S+ 0 0 126 -4,-2.5 4,-1.4 1,-0.2 -1,-0.2 0.879 106.9 52.4 -58.1 -39.5 3.8 24.8 2.9 81 81 A V H X S+ 0 0 85 -4,-1.4 4,-1.8 1,-0.2 3,-0.3 0.930 111.0 45.9 -61.0 -45.7 2.1 21.6 3.7 82 82 A V H X S+ 0 0 7 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.857 105.4 61.1 -67.7 -38.5 5.3 20.1 5.2 83 83 A A H X S+ 0 0 28 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.874 106.1 46.8 -55.1 -40.1 5.9 23.3 7.2 84 84 A I H X S+ 0 0 98 -4,-1.4 4,-2.1 -3,-0.3 -1,-0.2 0.898 109.3 53.4 -72.3 -40.2 2.6 22.8 9.0 85 85 A Q H X S+ 0 0 74 -4,-1.8 4,-1.9 1,-0.2 -2,-0.2 0.917 109.1 51.1 -57.9 -42.1 3.3 19.1 9.6 86 86 A L H X S+ 0 0 20 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.937 108.2 49.2 -60.6 -50.3 6.6 20.3 11.2 87 87 A S H X S+ 0 0 66 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.868 109.9 53.8 -56.6 -34.1 4.9 22.8 13.5 88 88 A E H X S+ 0 0 114 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.904 108.9 48.0 -70.0 -36.8 2.5 20.0 14.6 89 89 A E H X S+ 0 0 22 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.899 108.3 54.3 -67.5 -41.6 5.5 17.8 15.5 90 90 A E H X S+ 0 0 59 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.835 107.0 52.2 -59.0 -38.2 7.2 20.6 17.4 91 91 A E H X S+ 0 0 85 -4,-1.7 4,-2.6 2,-0.2 5,-0.2 0.950 108.0 50.5 -60.1 -49.5 3.9 20.9 19.4 92 92 A K H X S+ 0 0 95 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.858 110.8 50.1 -53.1 -41.3 4.0 17.1 20.2 93 93 A V H X S+ 0 0 1 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.901 110.0 50.4 -62.7 -46.2 7.7 17.6 21.3 94 94 A N H X S+ 0 0 78 -4,-2.3 4,-1.2 2,-0.2 -2,-0.2 0.856 108.3 51.6 -65.4 -37.6 6.7 20.5 23.6 95 95 A K H >X S+ 0 0 109 -4,-2.6 4,-1.4 2,-0.2 3,-0.6 0.935 109.8 50.0 -56.3 -49.7 3.8 18.5 25.2 96 96 A Q H 3X S+ 0 0 10 -4,-1.9 4,-2.3 1,-0.3 3,-0.2 0.884 103.5 59.7 -63.9 -35.3 6.2 15.7 26.0 97 97 A K H 3X S+ 0 0 100 -4,-2.1 4,-2.5 1,-0.2 -1,-0.3 0.864 101.2 55.7 -53.1 -38.9 8.6 18.2 27.5 98 98 A E H < S+ 0 0 122 -4,-1.3 3,-0.7 2,-0.2 -2,-0.2 0.703 109.2 52.8 -77.6 -25.8 29.5 -9.4 112.2 159 159 A K H >< S+ 0 0 127 -4,-1.5 3,-1.4 1,-0.2 -2,-0.2 0.909 101.2 60.7 -70.1 -44.6 28.9 -6.7 114.9 160 160 A Q T 3< S+ 0 0 153 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.337 74.5 102.0 -64.4 8.0 26.0 -8.9 116.2 161 161 A K T < 0 0 151 -3,-0.7 -1,-0.3 -5,-0.0 -2,-0.1 0.667 360.0 360.0 -64.4 -20.3 28.8 -11.5 116.8 162 162 A Q < 0 0 198 -3,-1.4 -2,-0.1 -4,-0.0 -3,-0.1 -0.028 360.0 360.0-160.0 360.0 28.6 -10.5 120.5