==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ANTIBIOTIC 09-AUG-00 1E68 . COMPND 2 MOLECULE: AS-48 PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROCOCCUS FAECALIS; . AUTHOR C.GONZALEZ,G.LANGDON,M.BRUIX,A.GALVEZ,E.VALDIVIA,M.MAQUEDA,M . 70 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 4012.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 60 85.7 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 10 14.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 41 58.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 5.7 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 1 0 0 2 0 0 1 1 0 0 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 . 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 M >> 0 0 0 0, 0.0 4,-1.6 0, 0.0 5,-0.8 0.000 360.0 360.0 360.0 -42.3 -3.4 5.6 3.5 2 2 A A H >> + 0 0 35 66,-1.3 5,-1.3 65,-0.4 4,-1.0 0.945 360.0 32.3 -55.2 -50.7 -3.9 9.4 3.3 3 3 A K H 45S+ 0 0 183 66,-2.2 -1,-0.2 3,-0.2 67,-0.2 0.926 122.1 40.6 -73.3 -59.9 -5.4 9.6 6.7 4 4 A E H 45S+ 0 0 128 66,-2.8 -1,-0.2 65,-0.2 -2,-0.1 0.825 127.5 25.1 -67.9 -42.5 -3.8 6.8 8.9 5 5 A F H <5S- 0 0 37 -4,-1.6 36,-0.2 65,-0.4 -1,-0.2 0.661 108.2-104.2-100.3 -18.7 -0.2 7.0 7.8 6 6 A G T << + 0 0 44 -4,-1.0 32,-0.6 -5,-0.8 -4,-0.2 0.893 68.2 146.4 83.3 57.8 0.2 10.6 6.5 7 7 A I < - 0 0 13 -5,-1.3 2,-0.4 -6,-0.6 -1,-0.2 -0.828 46.2-129.4-115.7 150.2 0.2 10.0 2.8 8 8 A P >> - 0 0 60 0, 0.0 4,-1.4 0, 0.0 3,-1.3 -0.858 33.9-111.7 -88.4 152.0 -1.1 12.0 -0.2 9 9 A A H 3> S+ 0 0 53 -2,-0.4 4,-2.4 1,-0.2 5,-0.2 0.783 111.8 78.1 -51.2 -27.0 -3.3 10.1 -2.7 10 10 A A H 3> S+ 0 0 70 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.904 104.1 29.7 -41.9 -56.2 -0.3 10.5 -5.1 11 11 A V H <> S+ 0 0 7 -3,-1.3 4,-1.8 1,-0.2 -1,-0.2 0.820 114.4 59.5 -88.9 -29.5 1.7 7.7 -3.4 12 12 A A H X S+ 0 0 0 -4,-1.4 4,-1.3 1,-0.2 -1,-0.2 0.838 103.5 55.1 -64.9 -32.2 -1.3 5.5 -2.2 13 13 A G H X S+ 0 0 29 -4,-2.4 4,-1.5 2,-0.2 -1,-0.2 0.866 103.5 54.2 -66.0 -40.4 -2.3 5.2 -5.9 14 14 A T H X S+ 0 0 40 -4,-0.9 4,-1.4 -5,-0.2 -2,-0.2 0.914 104.3 55.6 -60.8 -40.6 1.1 3.9 -6.8 15 15 A V H X S+ 0 0 0 -4,-1.8 4,-1.4 1,-0.2 -1,-0.2 0.884 102.9 56.0 -54.7 -43.3 0.6 1.2 -4.1 16 16 A L H X S+ 0 0 16 -4,-1.3 4,-2.7 2,-0.2 -1,-0.2 0.882 99.5 59.3 -60.3 -38.7 -2.6 0.2 -5.9 17 17 A N H X S+ 0 0 94 -4,-1.5 4,-2.4 1,-0.2 5,-0.3 0.942 102.5 54.2 -51.9 -48.6 -0.6 -0.4 -9.1 18 18 A V H X>S+ 0 0 0 -4,-1.4 4,-1.9 2,-0.2 5,-1.3 0.887 112.2 43.0 -49.4 -49.4 1.4 -3.0 -7.2 19 19 A V H <5S+ 0 0 7 -4,-1.4 3,-0.2 1,-0.2 -2,-0.2 0.970 115.1 48.2 -66.2 -51.3 -1.8 -4.8 -6.2 20 20 A E H <5S+ 0 0 137 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.747 125.5 26.8 -60.5 -38.9 -3.5 -4.6 -9.6 21 21 A A H <5S- 0 0 76 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.593 100.9-116.0-103.7 -16.2 -0.4 -5.8 -11.6 22 22 A G T <5 + 0 0 47 -4,-1.9 -3,-0.2 -5,-0.3 -4,-0.1 0.809 64.3 165.8 69.2 46.7 1.6 -8.0 -9.2 23 23 A G < - 0 0 16 -5,-1.3 2,-0.4 -6,-0.3 -1,-0.2 -0.302 43.1 -71.7-102.7 167.8 4.4 -5.4 -9.5 24 24 A W >> - 0 0 173 1,-0.2 4,-1.0 -2,-0.1 3,-0.5 -0.311 28.4-164.9 -62.7 106.5 7.6 -4.4 -7.7 25 25 A V H 3> S+ 0 0 23 -2,-0.4 4,-3.4 1,-0.2 5,-0.2 0.789 82.7 79.0 -57.5 -23.7 6.9 -2.7 -4.4 26 26 A T H 3> S+ 0 0 95 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.895 95.6 43.2 -55.4 -43.8 10.6 -1.5 -4.6 27 27 A T H <> S+ 0 0 84 -3,-0.5 4,-1.4 2,-0.2 -1,-0.2 0.903 115.1 49.9 -65.5 -45.1 9.6 1.3 -7.0 28 28 A I H X S+ 0 0 9 -4,-1.0 4,-2.5 1,-0.2 3,-0.2 0.935 103.6 60.1 -59.8 -44.9 6.5 2.1 -5.0 29 29 A V H X S+ 0 0 40 -4,-3.4 4,-2.7 1,-0.2 5,-0.2 0.864 103.4 51.0 -53.8 -43.8 8.6 2.3 -1.7 30 30 A S H X S+ 0 0 65 -4,-1.4 4,-2.1 2,-0.2 -1,-0.2 0.929 111.0 47.5 -59.6 -43.1 10.8 5.1 -3.2 31 31 A I H < S+ 0 0 78 -4,-1.4 4,-0.4 -3,-0.2 -2,-0.2 0.910 114.2 48.4 -68.7 -38.8 7.6 7.1 -4.1 32 32 A L H >< S+ 0 0 0 -4,-2.5 3,-0.9 1,-0.2 7,-0.8 0.888 113.5 44.6 -63.9 -51.8 6.2 6.5 -0.6 33 33 A T H >< S+ 0 0 53 -4,-2.7 3,-0.9 1,-0.2 -1,-0.2 0.760 97.5 73.1 -70.2 -28.9 9.4 7.5 1.3 34 34 A A T 3< S+ 0 0 90 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.668 95.5 55.0 -52.6 -27.6 9.8 10.6 -1.0 35 35 A V T < S- 0 0 61 -3,-0.9 2,-0.4 -4,-0.4 -1,-0.3 0.746 110.9-135.8 -68.4 -38.7 6.8 12.0 1.1 36 36 A G S X> S+ 0 0 29 -3,-0.9 3,-1.2 -4,-0.4 4,-1.1 -0.925 72.7 14.5 118.7-123.5 8.8 11.3 4.3 37 37 A S H 3> S+ 0 0 92 -2,-0.4 4,-2.7 1,-0.3 5,-0.2 0.772 116.0 67.7 -59.3 -38.6 7.2 9.7 7.4 38 38 A G H 3> S+ 0 0 0 -32,-0.6 4,-1.7 2,-0.2 -1,-0.3 0.847 102.1 47.8 -50.1 -43.1 4.0 8.4 5.5 39 39 A G H <> S+ 0 0 0 -3,-1.2 4,-2.4 -7,-0.8 -6,-0.2 0.979 113.1 47.4 -62.7 -49.8 6.2 5.9 3.5 40 40 A L H X S+ 0 0 110 -4,-1.1 4,-1.9 1,-0.2 -2,-0.2 0.853 109.0 52.6 -62.8 -44.2 8.0 4.6 6.6 41 41 A S H X S+ 0 0 40 -4,-2.7 4,-1.3 -36,-0.2 -1,-0.2 0.917 110.8 48.2 -61.5 -39.8 4.8 4.1 8.7 42 42 A L H >X S+ 0 0 1 -4,-1.7 3,-0.7 -5,-0.2 4,-0.6 0.952 109.8 53.1 -62.2 -47.8 3.3 2.1 5.8 43 43 A L H 3< S+ 0 0 41 -4,-2.4 3,-0.3 1,-0.2 4,-0.3 0.810 105.4 54.3 -60.5 -32.6 6.5 0.0 5.6 44 44 A A H >< S+ 0 0 79 -4,-1.9 3,-1.0 1,-0.2 4,-0.2 0.887 90.2 79.3 -66.5 -31.2 6.3 -0.8 9.4 45 45 A A H << S- 0 0 49 -4,-1.3 -1,-0.2 -3,-0.7 -2,-0.2 0.755 122.3 -7.5 -53.5 -48.5 2.8 -2.2 9.1 46 46 A A T 3< S+ 0 0 18 -4,-0.6 4,-0.3 -3,-0.3 -1,-0.3 -0.131 82.2 146.5-144.5 50.2 3.8 -5.6 7.7 47 47 A G S X S+ 0 0 45 -3,-1.0 3,-1.4 -4,-0.3 4,-0.3 0.885 75.1 48.2 -51.4 -50.4 7.5 -5.3 7.1 48 48 A R T 3 S+ 0 0 259 1,-0.3 -1,-0.2 -4,-0.2 -2,-0.1 0.886 109.9 49.6 -58.8 -49.0 8.2 -9.0 7.9 49 49 A E T 3 S- 0 0 96 1,-0.1 -1,-0.3 -3,-0.1 5,-0.2 0.378 126.5-100.6 -80.0 18.9 5.4 -10.5 5.8 50 50 A S <> - 0 0 48 -3,-1.4 4,-2.5 -4,-0.3 -2,-0.1 0.731 16.1-123.1 53.1 124.9 6.7 -8.3 2.9 51 51 A I H > S+ 0 0 16 -4,-0.3 4,-2.6 2,-0.2 5,-0.3 0.873 112.0 63.6 -52.4 -31.2 4.9 -5.1 2.2 52 52 A K H > S+ 0 0 54 2,-0.2 4,-2.4 1,-0.2 -1,-0.1 0.969 109.1 33.9 -57.1 -65.0 4.5 -6.6 -1.4 53 53 A A H > S+ 0 0 40 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.863 116.3 61.1 -62.7 -35.2 2.4 -9.6 -0.3 54 54 A Y H X S+ 0 0 32 -4,-2.5 4,-3.2 -8,-0.2 -2,-0.2 0.946 110.8 35.1 -51.2 -67.7 0.7 -7.4 2.4 55 55 A L H X>S+ 0 0 0 -4,-2.6 4,-2.9 2,-0.2 5,-0.5 0.895 114.3 60.1 -62.0 -38.2 -0.8 -4.8 0.0 56 56 A K H X5S+ 0 0 46 -4,-2.4 4,-1.5 -5,-0.3 -2,-0.2 0.928 117.7 28.5 -54.9 -52.3 -1.5 -7.4 -2.7 57 57 A K H X5S+ 0 0 116 -4,-2.6 4,-1.5 2,-0.2 5,-0.2 0.946 120.5 54.7 -75.0 -45.2 -3.7 -9.5 -0.4 58 58 A E H >X5S+ 0 0 47 -4,-3.2 4,-2.5 -5,-0.3 3,-0.9 0.931 114.8 37.8 -58.7 -49.9 -5.0 -6.6 1.8 59 59 A I H 3X5S+ 0 0 0 -4,-2.9 4,-2.0 1,-0.3 5,-0.3 0.829 108.5 64.1 -76.3 -27.4 -6.2 -4.4 -1.1 60 60 A K H 3<X - 0 0 34 -4,-2.0 3,-1.6 -5,-0.1 4,-0.8 0.558 17.5-112.5 104.1 110.2 -11.1 -2.4 -2.4 64 64 A K H 3> S+ 0 0 65 -5,-0.3 4,-1.6 1,-0.3 3,-0.2 0.579 108.1 62.4 -36.8 -43.4 -8.8 0.3 -3.9 65 65 A R H 3> S+ 0 0 205 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.914 104.7 47.6 -56.6 -47.1 -11.0 3.4 -3.4 66 66 A A H <> S+ 0 0 39 -3,-1.6 4,-3.4 1,-0.2 -1,-0.2 0.824 104.6 62.0 -64.6 -26.1 -11.0 3.0 0.4 67 67 A V H < S+ 0 0 0 -4,-0.8 -65,-0.4 1,-0.2 -2,-0.2 0.887 96.8 57.9 -72.1 -36.9 -7.2 2.6 0.3 68 68 A I H < S+ 0 0 62 -4,-1.6 -66,-1.3 -3,-0.2 -1,-0.2 0.935 115.0 38.0 -51.8 -46.8 -7.0 6.1 -1.2 69 69 A A H < 0 0 57 -4,-1.2 -66,-2.2 -68,-0.2 -65,-0.2 0.987 360.0 360.0 -70.0 -49.5 -8.8 7.3 2.0 70 70 A W < 0 0 36 -4,-3.4 -66,-2.8 -69,-0.2 -65,-0.4 0.877 360.0 360.0 -52.4 360.0 -7.0 4.8 4.4