==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 29-DEC-09 3L7W . COMPND 2 MOLECULE: PUTATIVE UNCHARACTERIZED PROTEIN SMU.1704; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS MUTANS; . AUTHOR X.-D.SU,X.LIU,T.M.FU . 106 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7460.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 80 75.5 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 . 12 11.3 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 . 1 0.9 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 . 5 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 7 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 52 49.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.9 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 1 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 1 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 1 0 0 0 0 0 1 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 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 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 0 118 0, 0.0 36,-0.1 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 -69.5 1.1 -20.3 -19.1 2 2 A Y + 0 0 197 2,-0.1 33,-0.0 0, 0.0 0, 0.0 0.974 360.0 51.4 -55.8 -70.3 2.1 -23.0 -21.7 3 3 A Y S S- 0 0 177 1,-0.1 2,-0.1 33,-0.0 0, 0.0 -0.458 90.1-119.1 -72.9 141.8 3.3 -25.8 -19.5 4 4 A P - 0 0 120 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 -0.351 17.3-129.1 -73.6 162.0 1.0 -26.9 -16.7 5 5 A V - 0 0 27 32,-0.1 32,-0.1 -4,-0.1 5,-0.1 -0.964 23.3-134.6-114.2 116.8 2.1 -26.7 -13.0 6 6 A S > - 0 0 69 -2,-0.5 4,-2.3 1,-0.1 3,-0.3 -0.225 23.0-110.9 -67.8 158.7 1.6 -30.0 -11.1 7 7 A A H > S+ 0 0 55 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.900 121.2 55.8 -54.8 -41.0 -0.0 -30.0 -7.7 8 8 A L H > S+ 0 0 120 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.886 107.5 47.6 -60.2 -39.5 3.4 -31.0 -6.3 9 9 A L H > S+ 0 0 35 -3,-0.3 4,-2.9 1,-0.2 -1,-0.2 0.862 107.2 57.1 -70.4 -35.6 4.9 -27.9 -7.9 10 10 A I H X S+ 0 0 2 -4,-2.3 4,-3.2 2,-0.2 -2,-0.2 0.893 105.4 51.5 -58.2 -41.2 2.0 -25.8 -6.5 11 11 A E H X S+ 0 0 9 -4,-2.1 4,-3.1 2,-0.2 5,-0.3 0.956 108.4 50.9 -61.4 -50.6 3.0 -27.0 -3.1 12 12 A Y H X S+ 0 0 33 -4,-2.0 4,-2.9 1,-0.2 -2,-0.2 0.951 112.7 46.8 -47.5 -53.3 6.6 -26.0 -3.8 13 13 A L H X S+ 0 0 43 -4,-2.9 4,-3.1 2,-0.2 5,-0.2 0.922 112.2 49.4 -59.8 -46.3 5.3 -22.5 -4.8 14 14 A I H X S+ 0 0 0 -4,-3.2 4,-3.2 2,-0.2 5,-0.3 0.970 114.6 43.4 -58.5 -54.6 3.1 -22.2 -1.8 15 15 A L H X S+ 0 0 0 -4,-3.1 4,-1.8 1,-0.2 -1,-0.2 0.905 115.3 50.4 -57.7 -40.5 5.8 -23.1 0.6 16 16 A A H X S+ 0 0 33 -4,-2.9 4,-0.8 -5,-0.3 -1,-0.2 0.929 113.5 45.1 -64.6 -43.3 8.2 -20.9 -1.2 17 17 A I H >X S+ 0 0 32 -4,-3.1 4,-1.2 1,-0.2 3,-1.1 0.937 113.4 49.0 -65.2 -46.9 5.9 -18.0 -1.2 18 18 A V H 3< S+ 0 0 2 -4,-3.2 55,-0.5 1,-0.3 -1,-0.2 0.786 101.8 65.5 -66.1 -25.3 5.0 -18.5 2.4 19 19 A S H 3< S+ 0 0 59 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.2 0.811 96.5 55.6 -67.7 -28.6 8.7 -18.7 3.3 20 20 A K H << S- 0 0 176 -3,-1.1 2,-0.3 -4,-0.8 -2,-0.2 0.990 133.0 -28.3 -66.1 -58.7 9.1 -15.0 2.2 21 21 A H S < S- 0 0 95 -4,-1.2 -1,-0.3 50,-0.0 50,-0.1 -0.983 76.4 -83.9-149.4 154.4 6.5 -13.9 4.7 22 22 A D - 0 0 43 -2,-0.3 2,-0.3 -3,-0.2 50,-0.2 -0.300 58.6-178.1 -45.5 137.8 3.3 -15.3 6.3 23 23 A S E -A 71 0A 0 48,-1.5 48,-2.3 -3,-0.0 2,-0.1 -0.999 27.2-118.2-148.0 153.5 0.5 -14.8 3.8 24 24 A Y E > -A 70 0A 27 -2,-0.3 4,-1.8 46,-0.2 3,-0.5 -0.462 40.5-101.8 -86.1 164.3 -3.2 -15.3 3.4 25 25 A G H > S+ 0 0 5 44,-0.7 4,-3.4 1,-0.2 5,-0.2 0.858 117.0 54.8 -55.7 -46.7 -4.6 -17.6 0.7 26 26 A Y H > S+ 0 0 114 1,-0.3 4,-3.0 2,-0.2 -1,-0.2 0.900 108.9 50.8 -59.4 -38.7 -5.7 -14.9 -1.8 27 27 A D H > S+ 0 0 48 -3,-0.5 4,-1.5 2,-0.2 -1,-0.3 0.920 113.2 44.1 -62.7 -45.7 -2.2 -13.5 -1.8 28 28 A I H X S+ 0 0 0 -4,-1.8 4,-2.4 2,-0.2 3,-0.2 0.945 114.6 50.2 -64.8 -45.4 -0.7 -16.9 -2.4 29 29 A S H X S+ 0 0 0 -4,-3.4 4,-2.8 1,-0.2 5,-0.2 0.932 107.4 52.9 -60.8 -49.1 -3.3 -17.7 -5.1 30 30 A Q H < S+ 0 0 70 -4,-3.0 4,-0.3 1,-0.2 -1,-0.2 0.846 112.8 44.5 -55.7 -35.8 -2.8 -14.5 -7.0 31 31 A T H >< S+ 0 0 65 -4,-1.5 3,-0.8 -3,-0.2 4,-0.3 0.862 113.7 49.5 -80.4 -34.0 1.0 -15.1 -7.2 32 32 A I H >X S+ 0 0 2 -4,-2.4 4,-2.9 1,-0.2 3,-1.9 0.844 100.2 64.5 -71.2 -32.4 0.5 -18.7 -8.2 33 33 A K T 3< S+ 0 0 80 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.647 86.8 76.6 -64.1 -14.6 -2.0 -17.7 -10.9 34 34 A L T <4 S+ 0 0 141 -3,-0.8 -1,-0.3 -4,-0.3 -2,-0.2 0.802 117.8 9.4 -64.0 -31.3 1.0 -15.9 -12.4 35 35 A I T <4 S+ 0 0 92 -3,-1.9 2,-0.3 -4,-0.3 -2,-0.2 0.582 125.5 61.0-122.0 -19.1 2.3 -19.3 -13.6 36 36 A A < - 0 0 8 -4,-2.9 2,-0.9 -5,-0.1 -1,-0.1 -0.855 61.3-144.1-119.9 146.0 -0.5 -21.7 -12.9 37 37 A S + 0 0 134 -2,-0.3 2,-0.4 -36,-0.1 -32,-0.1 -0.888 50.0 144.7-100.5 97.2 -4.1 -22.2 -14.0 38 38 A I - 0 0 19 -2,-0.9 2,-0.2 -9,-0.1 -2,-0.1 -0.996 44.4-129.4-138.5 137.3 -5.5 -23.5 -10.8 39 39 A K >> - 0 0 145 -2,-0.4 4,-2.6 1,-0.1 3,-2.0 -0.573 23.9-119.7 -84.5 153.6 -8.9 -22.9 -9.2 40 40 A E H 3> S+ 0 0 80 1,-0.3 4,-2.9 2,-0.2 -1,-0.1 0.896 117.6 63.1 -53.4 -38.8 -9.3 -21.8 -5.6 41 41 A S H 34 S+ 0 0 87 1,-0.2 -1,-0.3 2,-0.2 -3,-0.0 0.655 111.5 36.4 -65.1 -13.7 -11.2 -25.1 -5.2 42 42 A T H <> S+ 0 0 64 -3,-2.0 4,-1.0 2,-0.1 -1,-0.2 0.721 118.3 50.3-100.4 -34.5 -7.9 -26.8 -6.1 43 43 A L H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 3,-0.5 0.955 105.7 52.3 -72.2 -51.3 -5.5 -24.4 -4.3 44 44 A Y H X S+ 0 0 79 -4,-2.9 4,-3.0 1,-0.3 -1,-0.2 0.878 106.3 52.8 -62.1 -39.6 -7.1 -24.3 -0.9 45 45 A P H > S+ 0 0 71 0, 0.0 4,-3.3 0, 0.0 -1,-0.3 0.886 109.4 52.2 -58.5 -35.0 -7.3 -28.0 -0.4 46 46 A I H X S+ 0 0 11 -4,-1.0 4,-2.7 -3,-0.5 5,-0.2 0.963 108.8 48.2 -66.3 -49.0 -3.6 -27.9 -1.2 47 47 A L H X S+ 0 0 0 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.924 113.5 49.2 -49.5 -46.2 -3.0 -25.3 1.4 48 48 A K H X S+ 0 0 135 -4,-3.0 4,-3.4 1,-0.2 5,-0.2 0.947 109.0 51.5 -63.0 -47.7 -5.0 -27.4 3.8 49 49 A K H X S+ 0 0 104 -4,-3.3 4,-2.6 1,-0.2 -1,-0.2 0.910 110.2 49.3 -51.3 -46.3 -3.0 -30.5 2.9 50 50 A L H <>S+ 0 0 0 -4,-2.7 5,-1.9 2,-0.2 6,-1.4 0.840 112.3 48.5 -68.5 -34.0 0.2 -28.6 3.6 51 51 A E H ><5S+ 0 0 58 -4,-2.0 3,-2.4 -5,-0.2 -2,-0.2 0.971 111.1 48.6 -67.7 -51.7 -1.1 -27.5 6.9 52 52 A K H 3<5S+ 0 0 181 -4,-3.4 -2,-0.2 1,-0.3 -1,-0.2 0.883 108.6 54.7 -53.8 -40.7 -2.3 -31.0 7.9 53 53 A A T 3<5S- 0 0 51 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.535 119.1-115.8 -74.0 -8.6 1.1 -32.3 6.9 54 54 A G T < 5S+ 0 0 30 -3,-2.4 23,-0.4 2,-0.3 22,-0.3 0.427 87.0 112.6 93.5 1.4 2.6 -29.7 9.3 55 55 A Y S S-B 66 0A 54 3,-2.5 3,-0.8 -2,-0.2 -2,-0.0 -0.904 70.9 -16.7-142.4 114.2 -5.8 -7.2 7.3 64 64 A Q T 3 S- 0 0 177 -2,-0.3 3,-0.1 1,-0.2 -2,-0.0 0.902 131.0 -49.3 56.7 41.9 -7.5 -4.1 5.8 65 65 A G T 3 S+ 0 0 74 1,-0.1 2,-0.4 0, 0.0 -1,-0.2 0.613 122.2 90.7 77.3 13.8 -10.4 -4.5 8.3 66 66 A R E < S- B 0 63A 150 -3,-0.8 -3,-2.5 -5,-0.1 2,-0.4 -0.997 79.8-113.9-137.0 138.8 -11.2 -8.2 7.7 67 67 A R E - B 0 62A 154 -2,-0.4 2,-0.3 -5,-0.3 -5,-0.3 -0.575 38.7-165.6 -68.9 124.8 -9.7 -11.2 9.6 68 68 A R E - B 0 61A 41 -7,-3.3 -7,-1.7 -2,-0.4 2,-0.8 -0.828 23.5-119.2-108.8 151.4 -7.6 -13.2 7.2 69 69 A K E - B 0 60A 101 -2,-0.3 -44,-0.7 -9,-0.2 2,-0.3 -0.809 35.3-159.2 -86.6 113.4 -6.3 -16.7 7.5 70 70 A Y E -AB 24 59A 15 -11,-3.7 -11,-1.8 -2,-0.8 2,-0.4 -0.738 5.4-146.3 -94.1 144.7 -2.5 -16.4 7.4 71 71 A Y E -AB 23 58A 5 -48,-2.3 -48,-1.5 -2,-0.3 2,-0.4 -0.866 13.4-167.4-106.9 145.7 -0.2 -19.3 6.5 72 72 A H E - B 0 57A 72 -15,-2.8 -15,-2.9 -2,-0.4 2,-0.6 -0.999 24.6-119.3-137.4 132.8 3.2 -19.6 8.1 73 73 A L E - B 0 56A 5 -55,-0.5 -17,-0.2 -2,-0.4 -18,-0.1 -0.614 31.4-148.3 -74.3 115.1 6.0 -21.8 7.1 74 74 A T > - 0 0 28 -19,-2.3 4,-3.2 -2,-0.6 5,-0.1 -0.303 29.6-105.4 -73.7 166.4 6.8 -24.1 10.0 75 75 A D H > S+ 0 0 134 1,-0.3 4,-2.9 2,-0.2 5,-0.2 0.899 129.6 53.7 -55.2 -41.0 10.4 -25.4 10.6 76 76 A S H > S+ 0 0 63 -22,-0.3 4,-1.9 1,-0.2 -1,-0.3 0.873 109.4 48.0 -58.2 -37.9 9.0 -28.6 9.3 77 77 A G H > S+ 0 0 0 -23,-0.4 4,-3.0 -22,-0.3 -2,-0.2 0.914 109.1 52.9 -70.4 -43.6 7.9 -26.6 6.3 78 78 A E H X S+ 0 0 105 -4,-3.2 4,-1.7 2,-0.2 -2,-0.2 0.939 110.1 46.9 -59.1 -49.8 11.3 -25.0 5.9 79 79 A K H X S+ 0 0 176 -4,-2.9 4,-1.5 1,-0.2 -1,-0.2 0.921 115.0 47.8 -56.0 -44.2 13.1 -28.3 5.9 80 80 A H H X S+ 0 0 37 -4,-1.9 4,-2.7 -5,-0.2 -2,-0.2 0.876 105.9 57.0 -66.2 -39.2 10.5 -29.6 3.4 81 81 A L H X S+ 0 0 20 -4,-3.0 4,-2.9 1,-0.2 -1,-0.2 0.860 103.6 54.9 -60.5 -36.2 10.8 -26.5 1.2 82 82 A V H X S+ 0 0 92 -4,-1.7 4,-2.8 2,-0.2 -1,-0.2 0.915 108.6 48.2 -62.3 -45.8 14.6 -27.2 0.9 83 83 A Y H X S+ 0 0 118 -4,-1.5 4,-3.2 2,-0.2 5,-0.2 0.952 113.4 46.6 -58.2 -51.6 13.8 -30.6 -0.3 84 84 A L H X S+ 0 0 23 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.877 113.1 49.4 -60.6 -39.9 11.3 -29.3 -2.9 85 85 A T H X S+ 0 0 58 -4,-2.9 4,-2.6 2,-0.2 -1,-0.2 0.953 112.8 47.8 -61.9 -49.2 13.7 -26.6 -4.0 86 86 A K H X S+ 0 0 119 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.924 112.9 47.3 -55.6 -50.6 16.4 -29.2 -4.4 87 87 A E H X S+ 0 0 81 -4,-3.2 4,-2.7 1,-0.2 -1,-0.2 0.831 111.1 52.8 -63.2 -32.6 14.1 -31.6 -6.3 88 88 A W H X S+ 0 0 75 -4,-2.0 4,-2.9 -5,-0.2 -1,-0.2 0.910 107.9 50.7 -68.1 -40.8 13.1 -28.6 -8.5 89 89 A S H X S+ 0 0 67 -4,-2.6 4,-3.0 2,-0.2 5,-0.3 0.960 112.7 46.2 -60.8 -50.7 16.7 -27.9 -9.2 90 90 A V H X S+ 0 0 68 -4,-2.7 4,-2.8 2,-0.2 5,-0.2 0.911 111.2 52.2 -55.7 -48.1 17.2 -31.5 -10.2 91 91 A Y H X S+ 0 0 136 -4,-2.7 4,-2.7 1,-0.2 5,-0.2 0.954 112.9 45.3 -52.9 -53.3 14.1 -31.5 -12.3 92 92 A K H X S+ 0 0 91 -4,-2.9 4,-3.2 1,-0.2 5,-0.3 0.934 114.9 45.8 -58.0 -52.6 15.3 -28.4 -14.1 93 93 A X H X S+ 0 0 115 -4,-3.0 4,-3.1 1,-0.2 -1,-0.2 0.874 113.7 50.6 -58.3 -41.3 18.8 -29.7 -14.6 94 94 A T H X S+ 0 0 55 -4,-2.8 4,-2.6 -5,-0.3 -1,-0.2 0.940 113.3 43.6 -69.1 -45.1 17.6 -33.0 -15.8 95 95 A I H X S+ 0 0 72 -4,-2.7 4,-3.7 -5,-0.2 5,-0.2 0.961 118.7 44.0 -59.9 -51.8 15.2 -31.5 -18.3 96 96 A D H X S+ 0 0 75 -4,-3.2 4,-2.9 1,-0.2 6,-0.2 0.876 113.2 53.1 -62.7 -36.8 17.7 -29.0 -19.5 97 97 A G H X>S+ 0 0 0 -4,-3.1 6,-2.0 -5,-0.3 5,-0.9 0.906 113.9 41.4 -63.6 -43.6 20.3 -31.8 -19.5 98 98 A I H ><5S+ 0 0 84 -4,-2.6 3,-1.1 4,-0.2 -2,-0.2 0.967 116.3 49.8 -67.3 -50.9 18.1 -34.0 -21.6 99 99 A V H 3<5S+ 0 0 105 -4,-3.7 -2,-0.2 1,-0.3 -3,-0.2 0.856 113.1 45.9 -56.0 -39.6 17.1 -31.0 -23.8 100 100 A E H 3<5S- 0 0 118 -4,-2.9 -1,-0.3 -5,-0.2 -2,-0.2 0.546 116.7-111.7 -86.4 -7.4 20.7 -29.9 -24.4 101 101 A G T <<5S+ 0 0 35 -3,-1.1 -3,-0.2 -4,-0.7 -4,-0.1 0.253 90.4 103.9 104.6 -13.2 21.9 -33.4 -25.1 102 102 A R S