==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 28-OCT-04 1WAZ . COMPND 2 MOLECULE: MERF; . SOURCE 2 ORGANISM_SCIENTIFIC: MORGANELLA MORGANII; . AUTHOR S.C.HOWELL,M.F.MESLEH,S.J.OPELLA . 46 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 4532.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 31 67.4 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 . 3 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 1 2.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 27 58.7 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 1 0 0 1 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 24 A T >> 0 0 148 0, 0.0 3,-0.8 0, 0.0 4,-0.6 0.000 360.0 360.0 360.0 91.2 -16.7 -5.3 4.8 2 25 A P H 3> + 0 0 63 0, 0.0 4,-1.0 0, 0.0 3,-0.3 0.736 360.0 69.3 -66.7 -22.2 -13.5 -3.5 5.9 3 26 A V H 3> S+ 0 0 92 1,-0.2 4,-1.7 2,-0.2 3,-0.3 0.877 88.9 62.7 -65.6 -34.6 -11.7 -6.8 5.8 4 27 A L H <> S+ 0 0 96 -3,-0.8 4,-2.0 1,-0.2 -1,-0.2 0.891 96.3 59.6 -58.8 -36.8 -12.0 -6.9 2.0 5 28 A V H X S+ 0 0 39 -4,-0.6 4,-1.8 -3,-0.3 -1,-0.2 0.924 104.4 48.8 -59.8 -42.7 -9.9 -3.7 1.8 6 29 A I H X S+ 0 0 57 -4,-1.0 4,-2.3 -3,-0.3 -1,-0.2 0.899 107.2 56.2 -65.3 -37.7 -6.9 -5.5 3.5 7 30 A L H X S+ 0 0 89 -4,-1.7 4,-1.8 1,-0.2 -1,-0.2 0.931 106.6 49.2 -61.8 -43.5 -7.2 -8.5 1.2 8 31 A L H X S+ 0 0 129 -4,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.932 111.7 48.5 -63.1 -43.0 -6.8 -6.2 -1.9 9 32 A G H X S+ 0 0 18 -4,-1.8 4,-1.8 1,-0.2 -1,-0.2 0.909 106.5 58.1 -64.7 -38.5 -3.7 -4.5 -0.4 10 33 A V H X S+ 0 0 84 -4,-2.3 4,-1.4 1,-0.2 -1,-0.2 0.935 104.1 51.2 -58.4 -45.3 -2.2 -7.9 0.5 11 34 A V H X S+ 0 0 99 -4,-1.8 4,-1.5 1,-0.2 -1,-0.2 0.913 105.3 56.2 -60.1 -41.0 -2.3 -9.0 -3.2 12 35 A G H X S+ 0 0 42 -4,-1.6 4,-1.2 1,-0.2 -1,-0.2 0.919 102.6 56.0 -59.5 -40.6 -0.6 -5.8 -4.3 13 36 A L H < S+ 0 0 119 -4,-1.8 3,-0.3 1,-0.2 -1,-0.2 0.903 100.9 58.8 -59.7 -38.5 2.4 -6.5 -2.0 14 37 A S H < S+ 0 0 92 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.947 100.4 54.4 -58.1 -47.9 2.9 -9.9 -3.6 15 38 A A H < S+ 0 0 94 -4,-1.5 2,-0.7 1,-0.2 -1,-0.2 0.871 110.8 52.6 -54.6 -33.9 3.4 -8.4 -7.1 16 39 A L < + 0 0 64 -4,-1.2 -1,-0.2 -3,-0.3 3,-0.0 -0.866 61.7 132.8-108.1 106.7 6.2 -6.3 -5.4 17 40 A T + 0 0 134 -2,-0.7 2,-0.4 2,-0.1 -1,-0.1 -0.056 44.9 90.3-142.5 37.4 8.7 -8.3 -3.5 18 41 A G S S- 0 0 53 2,-0.0 0, 0.0 1,-0.0 0, 0.0 -0.992 70.8-115.5-137.2 143.8 12.2 -7.1 -4.5 19 42 A Y - 0 0 214 -2,-0.4 2,-0.2 -3,-0.0 -2,-0.1 -0.113 32.8-177.6 -67.6 173.9 14.5 -4.3 -3.1 20 43 A L - 0 0 118 2,-0.0 -2,-0.0 0, 0.0 -1,-0.0 -0.807 23.2-123.3-175.0 129.5 15.3 -1.2 -5.2 21 44 A D - 0 0 125 -2,-0.2 2,-0.5 1,-0.1 0, 0.0 -0.018 42.5 -92.2 -67.1-178.2 17.5 1.9 -4.7 22 45 A Y - 0 0 192 1,-0.1 -1,-0.1 4,-0.0 2,-0.0 -0.858 44.1-178.5-103.5 127.1 16.0 5.4 -5.0 23 46 A V - 0 0 110 -2,-0.5 -1,-0.1 2,-0.1 0, 0.0 0.084 59.4 -47.7 -99.1-145.6 16.1 7.1 -8.3 24 47 A L S S+ 0 0 159 1,-0.2 -2,-0.0 2,-0.0 0, 0.0 0.897 131.4 6.6 -57.9 -38.0 14.9 10.7 -9.3 25 48 A L - 0 0 135 0, 0.0 2,-3.1 0, 0.0 3,-0.3 -0.901 67.0-136.2-151.9 120.6 11.6 10.0 -7.5 26 49 A P > + 0 0 51 0, 0.0 4,-2.0 0, 0.0 5,-0.2 -0.330 39.3 160.5 -71.2 65.0 10.6 7.0 -5.3 27 50 A A H > S+ 0 0 71 -2,-3.1 4,-2.4 1,-0.2 5,-0.1 0.860 72.3 55.6 -58.1 -32.3 7.2 6.8 -6.9 28 51 A L H > S+ 0 0 71 -3,-0.3 4,-2.3 2,-0.2 5,-0.2 0.961 104.6 50.1 -67.2 -49.4 6.9 3.2 -5.6 29 52 A A H > S+ 0 0 53 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.929 113.9 46.5 -55.7 -44.0 7.5 4.2 -2.0 30 53 A I H X S+ 0 0 111 -4,-2.0 4,-2.5 2,-0.2 5,-0.3 0.936 107.8 56.4 -65.4 -44.1 4.8 6.9 -2.2 31 54 A F H X S+ 0 0 139 -4,-2.4 4,-2.2 -5,-0.2 -2,-0.2 0.933 109.0 46.8 -54.6 -45.5 2.4 4.5 -4.0 32 55 A I H X S+ 0 0 54 -4,-2.3 4,-3.5 2,-0.2 5,-0.4 0.934 108.4 55.7 -63.8 -43.7 2.6 2.1 -1.1 33 56 A G H X S+ 0 0 25 -4,-2.0 4,-2.8 -5,-0.2 5,-0.3 0.957 111.9 42.6 -54.8 -50.5 2.2 4.8 1.5 34 57 A L H X S+ 0 0 114 -4,-2.5 4,-2.5 2,-0.2 5,-0.3 0.899 114.9 52.2 -63.1 -37.7 -1.1 5.9 -0.1 35 58 A T H X S+ 0 0 43 -4,-2.2 4,-2.1 -5,-0.3 -2,-0.2 0.960 114.9 39.7 -64.9 -49.8 -2.1 2.2 -0.5 36 59 A I H X S+ 0 0 91 -4,-3.5 4,-2.6 2,-0.2 5,-0.3 0.928 116.0 51.5 -66.5 -42.8 -1.5 1.4 3.2 37 60 A Y H X S+ 0 0 167 -4,-2.8 4,-2.3 -5,-0.4 5,-0.2 0.961 112.0 46.4 -60.1 -49.1 -2.9 4.7 4.5 38 61 A A H X S+ 0 0 26 -4,-2.5 4,-2.7 -5,-0.3 5,-0.3 0.919 112.7 50.6 -59.9 -42.2 -6.1 4.2 2.4 39 62 A I H X S+ 0 0 34 -4,-2.1 4,-2.8 -5,-0.3 5,-0.3 0.942 110.9 47.5 -64.0 -45.3 -6.5 0.6 3.6 40 63 A Q H X S+ 0 0 127 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.927 114.7 47.0 -62.9 -41.7 -6.1 1.5 7.3 41 64 A R H < S+ 0 0 147 -4,-2.3 -2,-0.2 -5,-0.3 -1,-0.2 0.972 114.6 45.1 -65.8 -51.7 -8.6 4.3 7.0 42 65 A K H < S+ 0 0 129 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.954 112.8 51.5 -57.2 -48.0 -11.2 2.2 5.1 43 66 A R H < S- 0 0 121 -4,-2.8 2,-0.3 -5,-0.3 -1,-0.2 0.915 135.6 -10.3 -56.1 -39.8 -10.7 -0.7 7.5 44 67 A Q < - 0 0 118 -4,-2.1 -1,-0.2 -5,-0.3 0, 0.0 -0.982 49.5-157.8-159.4 145.8 -11.3 1.8 10.4 45 68 A A 0 0 86 -2,-0.3 -4,-0.1 -3,-0.2 -3,-0.1 -0.045 360.0 360.0-117.0 33.3 -11.6 5.6 10.8 46 69 A D 0 0 189 -5,-0.1 -5,-0.0 0, 0.0 -2,-0.0 0.951 360.0 360.0 60.5 360.0 -10.7 5.9 14.5