==== 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 UNKNOWN FUNCTION 08-JAN-10 3LBE . COMPND 2 MOLECULE: PUTATIVE UNCHARACTERIZED PROTEIN SMU.793; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS MUTANS; . AUTHOR X.-D.SU,Q.M.HOU,X.X.FAN,J.NAN,X.LIU . 491 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20089.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 384 78.2 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 . 223 45.4 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 . 8 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 1.6 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 . 46 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 64 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.8 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 3 1 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 . 5 0 0 0 6 0 4 3 5 0 4 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 2 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 5 A H > 0 0 102 0, 0.0 3,-0.9 0, 0.0 4,-0.2 0.000 360.0 360.0 360.0 29.8 63.2 22.3 -9.2 2 6 A L T 3 + 0 0 110 1,-0.2 10,-0.0 2,-0.1 0, 0.0 -0.257 360.0 52.0 -68.2 174.4 63.5 25.8 -10.4 3 7 A H T 3 S+ 0 0 171 2,-0.3 -1,-0.2 1,-0.1 3,-0.1 0.429 78.4 98.7 77.9 -7.8 60.3 26.3 -12.4 4 8 A E S < S+ 0 0 47 -3,-0.9 2,-0.3 1,-0.2 -2,-0.1 0.849 90.0 17.0 -80.9 -40.4 57.9 25.2 -9.8 5 9 A I S S- 0 0 32 -4,-0.2 2,-0.4 152,-0.0 -2,-0.3 -0.898 85.0 -96.9-134.8 158.9 57.0 28.7 -8.5 6 10 A R - 0 0 61 -2,-0.3 2,-0.7 -3,-0.1 152,-0.1 -0.647 43.3-134.5 -74.9 133.7 57.3 32.3 -9.6 7 11 A V + 0 0 64 -2,-0.4 3,-0.2 1,-0.2 -1,-0.0 -0.837 34.8 165.3 -99.0 117.9 60.4 33.7 -8.0 8 12 A F S S+ 0 0 42 -2,-0.7 2,-0.4 1,-0.3 -1,-0.2 0.763 77.8 32.8 -98.8 -32.8 60.0 37.2 -6.4 9 13 A E S S- 0 0 24 36,-0.1 -1,-0.3 33,-0.0 40,-0.0 -0.994 96.5-115.0-124.6 125.9 63.2 37.1 -4.4 10 14 A N + 0 0 111 -2,-0.4 2,-0.3 -3,-0.2 16,-0.1 -0.130 41.6 160.7 -61.9 148.2 66.2 35.2 -5.9 11 15 A F - 0 0 33 14,-0.1 2,-0.5 12,-0.0 14,-0.2 -0.979 35.1-123.6-159.7 157.3 67.6 32.1 -4.4 12 16 A D E -A 24 0A 104 12,-3.1 12,-2.4 -2,-0.3 2,-0.3 -0.918 33.5-117.8-105.3 133.4 69.8 29.1 -5.3 13 17 A M E +A 23 0A 48 -2,-0.5 10,-0.3 10,-0.2 3,-0.1 -0.532 33.0 174.1 -70.2 126.3 68.4 25.6 -4.7 14 18 A V E - 0 0 80 8,-2.7 2,-0.3 1,-0.3 9,-0.2 0.836 66.5 -14.6 -96.4 -48.9 70.5 23.6 -2.2 15 19 A S E -A 22 0A 34 7,-2.2 7,-2.7 2,-0.1 2,-0.4 -0.976 51.2-161.0-158.0 146.5 68.3 20.5 -1.8 16 20 A F E +A 21 0A 42 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.937 26.4 149.9-134.3 108.2 64.7 19.4 -2.6 17 21 A E E > -A 20 0A 110 3,-2.5 3,-2.2 -2,-0.4 2,-0.3 -0.889 58.0 -71.9-130.3 163.9 63.2 16.4 -0.9 18 22 A K T 3 S- 0 0 163 -2,-0.3 40,-0.2 1,-0.3 36,-0.1 -0.402 120.9 -3.6 -56.7 115.7 59.7 15.3 0.1 19 23 A G T 3 S+ 0 0 12 35,-0.5 68,-2.8 -2,-0.3 2,-0.3 0.494 125.1 78.8 82.3 5.5 58.7 17.6 2.9 20 24 A H E < +AB 17 86A 26 -3,-2.2 -3,-2.5 66,-0.2 2,-0.4 -0.849 49.1 169.8-154.9 109.4 62.1 19.3 3.1 21 25 A V E -AB 16 85A 0 64,-2.2 64,-3.2 -2,-0.3 2,-0.4 -0.959 8.9-169.8-124.7 139.7 63.5 22.1 0.9 22 26 A I E +AB 15 84A 25 -7,-2.7 -8,-2.7 -2,-0.4 -7,-2.2 -0.997 10.3 168.8-130.5 129.0 66.6 24.2 1.4 23 27 A V E -AB 13 83A 3 60,-2.5 60,-3.1 -2,-0.4 2,-0.3 -0.884 15.2-151.1-131.9 165.6 67.7 27.2 -0.6 24 28 A T E +AB 12 82A 26 -12,-2.4 -12,-3.1 -2,-0.3 2,-0.3 -0.956 15.3 168.9-136.7 153.1 70.4 29.9 -0.1 25 29 A T E - B 0 81A 15 56,-2.2 56,-3.2 -2,-0.3 2,-0.4 -0.980 28.0-119.0-156.5 171.9 70.8 33.5 -1.0 26 30 A E E - B 0 80A 82 -2,-0.3 2,-0.6 54,-0.2 54,-0.2 -0.942 28.1-121.7-117.0 134.7 72.9 36.6 -0.6 27 31 A V - 0 0 2 52,-2.7 51,-2.6 -2,-0.4 2,-0.2 -0.658 37.3-176.6 -75.8 119.8 71.7 39.9 0.9 28 32 A V > - 0 0 78 -2,-0.6 3,-1.9 49,-0.2 4,-0.2 -0.705 40.3 -96.8-114.7 169.7 72.2 42.7 -1.7 29 33 A D G > S+ 0 0 92 1,-0.3 3,-2.1 -2,-0.2 7,-0.1 0.789 113.0 70.8 -61.9 -29.4 71.6 46.4 -1.4 30 34 A K G 3 S+ 0 0 125 1,-0.3 -1,-0.3 8,-0.0 -3,-0.0 0.711 98.6 51.2 -63.2 -17.1 68.2 46.3 -3.1 31 35 A S G < S+ 0 0 3 -3,-1.9 8,-2.7 2,-0.0 2,-0.4 0.436 86.9 108.7 -97.3 0.0 66.7 44.6 -0.0 32 36 A L B < -L 38 0B 15 -3,-2.1 6,-0.2 6,-0.2 44,-0.1 -0.636 55.1-150.0 -87.1 130.0 68.0 47.0 2.6 33 37 A N > - 0 0 41 4,-2.8 3,-2.1 -2,-0.4 -1,-0.1 -0.184 43.4 -84.6 -80.5-177.8 65.7 49.4 4.4 34 38 A Y T 3 S+ 0 0 137 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.658 129.6 60.0 -66.8 -13.4 66.8 52.9 5.7 35 39 A Y T 3 S- 0 0 74 2,-0.2 -1,-0.3 0, 0.0 3,-0.1 0.458 119.0-110.2 -90.1 -1.9 68.2 51.2 8.8 36 40 A G S < S+ 0 0 34 -3,-2.1 41,-0.5 1,-0.3 2,-0.3 0.678 78.8 123.1 82.2 19.0 70.6 49.1 6.8 37 41 A F S S- 0 0 48 39,-0.1 -4,-2.8 -6,-0.0 -1,-0.3 -0.870 75.3 -99.6-114.0 146.1 68.7 45.8 7.4 38 42 A A B -L 32 0B 7 37,-2.7 37,-0.4 -2,-0.3 -6,-0.2 -0.475 58.3-108.9 -56.8 123.1 67.2 43.3 5.0 39 43 A H >> - 0 0 9 -8,-2.7 4,-1.9 -2,-0.2 3,-0.9 -0.173 16.6-115.5 -68.9 152.4 63.6 44.4 5.1 40 44 A G H 3> S+ 0 0 9 1,-0.3 4,-2.6 2,-0.2 5,-0.1 0.827 114.1 53.2 -54.2 -37.8 60.9 42.2 6.8 41 45 A G H 3> S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.794 105.6 54.3 -70.9 -29.5 59.0 41.6 3.6 42 46 A Y H <> S+ 0 0 6 -3,-0.9 4,-2.1 2,-0.2 -2,-0.2 0.959 112.5 42.4 -67.4 -51.0 62.1 40.4 1.8 43 47 A I H X S+ 0 0 5 -4,-1.9 4,-1.9 1,-0.2 -2,-0.2 0.941 114.8 51.6 -59.2 -47.0 62.9 37.8 4.5 44 48 A F H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.902 107.4 52.8 -56.7 -43.6 59.2 36.9 4.7 45 49 A T H X S+ 0 0 2 -4,-2.2 4,-3.1 1,-0.2 5,-0.3 0.919 105.3 53.6 -63.7 -42.0 59.0 36.3 1.0 46 50 A L H X S+ 0 0 1 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.925 113.6 44.8 -53.8 -42.9 62.0 34.0 1.0 47 51 A C H X S+ 0 0 0 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.861 112.3 50.2 -69.8 -38.0 60.1 32.0 3.7 48 52 A D H X S+ 0 0 16 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.911 110.8 50.5 -69.1 -41.1 56.8 32.1 1.8 49 53 A Q H X S+ 0 0 10 -4,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.928 110.6 47.7 -61.1 -47.5 58.4 30.9 -1.4 50 54 A I H X S+ 0 0 3 -4,-2.1 4,-2.7 -5,-0.3 -1,-0.2 0.864 108.0 56.5 -67.5 -28.7 60.1 28.0 0.3 51 55 A S H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.885 106.9 49.6 -66.9 -37.4 56.8 27.1 2.0 52 56 A G H X S+ 0 0 17 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.926 111.2 49.2 -60.6 -46.7 55.2 26.9 -1.5 53 57 A L H X S+ 0 0 2 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.904 109.8 51.8 -59.5 -41.4 58.1 24.7 -2.6 54 58 A V H X S+ 0 0 0 -4,-2.7 4,-1.1 2,-0.2 -35,-0.5 0.924 109.2 49.3 -64.8 -41.2 57.6 22.5 0.5 55 59 A S H ><>S+ 0 0 2 -4,-2.2 5,-1.9 1,-0.2 3,-0.8 0.929 111.4 49.4 -62.7 -43.0 53.9 22.0 -0.2 56 60 A I H ><5S+ 0 0 12 -4,-2.4 3,-1.6 1,-0.2 -1,-0.2 0.898 104.8 59.4 -61.8 -38.1 54.7 21.1 -3.8 57 61 A S H 3<5S+ 0 0 16 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.772 101.8 54.0 -63.2 -24.6 57.3 18.6 -2.6 58 62 A T T <<5S- 0 0 11 -4,-1.1 -1,-0.3 -3,-0.8 -2,-0.2 0.564 127.9 -98.3 -85.6 -9.3 54.5 16.8 -0.7 59 63 A G T < 5S+ 0 0 31 -3,-1.6 63,-2.7 -4,-0.5 2,-0.4 0.534 85.1 104.1 109.6 12.3 52.5 16.5 -3.9 60 64 A F E < -C 121 0A 45 -5,-1.9 2,-0.3 61,-0.3 -1,-0.3 -0.944 61.9-133.0-136.4 145.5 50.1 19.4 -3.5 61 65 A D E +C 120 0A 29 59,-2.9 58,-2.5 -2,-0.4 59,-1.3 -0.712 40.2 168.6 -82.2 142.6 49.2 22.9 -4.7 62 66 A A E -C 118 0A 6 -2,-0.3 2,-0.3 56,-0.3 56,-0.2 -0.988 29.4-139.1-152.5 155.8 48.4 25.2 -1.8 63 67 A V E -C 117 0A 36 54,-2.3 54,-3.3 -2,-0.3 2,-0.3 -0.907 38.6 -99.5-113.5 150.3 47.8 28.8 -0.9 64 68 A T E +C 116 0A 21 -2,-0.3 52,-0.2 52,-0.2 3,-0.1 -0.528 40.4 174.4 -70.1 127.5 49.1 30.5 2.2 65 69 A L E - 0 0 13 50,-3.1 130,-2.5 1,-0.4 2,-0.3 0.786 64.8 -8.1-100.0 -41.2 46.4 30.8 4.8 66 70 A Q E -CD 115 194A 0 49,-1.6 49,-3.4 128,-0.2 -1,-0.4 -0.987 60.7-171.9-157.2 147.7 48.2 32.1 7.7 67 71 A S E -CD 114 193A 1 126,-2.3 126,-2.8 -2,-0.3 2,-0.4 -0.988 7.9-166.7-148.4 143.0 51.8 32.9 8.7 68 72 A S E -CD 113 192A 4 45,-2.3 45,-2.7 -2,-0.3 2,-0.4 -0.985 14.2-176.9-124.0 138.4 53.8 33.9 11.8 69 73 A I E -CD 112 191A 0 122,-2.6 122,-2.5 -2,-0.4 2,-0.5 -0.997 13.9-158.2-137.7 138.9 57.4 35.1 11.6 70 74 A N E -CD 111 190A 2 41,-3.1 41,-1.9 -2,-0.4 2,-0.8 -0.982 11.4-148.4-113.3 130.5 60.0 36.2 14.2 71 75 A Y E +C 110 0A 28 118,-2.6 39,-0.2 -2,-0.5 3,-0.1 -0.865 25.5 168.1 -98.8 105.8 62.9 38.4 13.3 72 76 A L + 0 0 13 37,-1.7 2,-0.3 -2,-0.8 38,-0.2 0.849 64.4 6.6 -90.4 -41.4 65.7 37.3 15.6 73 77 A K S S- 0 0 85 36,-1.9 -1,-0.3 34,-0.1 2,-0.1 -0.991 84.4-103.2-145.4 142.9 68.7 38.9 14.2 74 78 A S - 0 0 45 -2,-0.3 2,-0.5 -3,-0.1 -35,-0.1 -0.388 25.0-128.3 -72.0 146.7 69.0 41.4 11.3 75 79 A G - 0 0 0 -37,-0.4 -37,-2.7 -2,-0.1 2,-0.3 -0.812 32.5-162.2 -87.6 131.2 70.2 40.5 7.8 76 80 A K > - 0 0 114 -2,-0.5 3,-2.5 -39,-0.2 -49,-0.3 -0.773 32.3 -71.0-116.6 162.2 73.0 42.8 6.7 77 81 A L T 3 S+ 0 0 102 -41,-0.5 -49,-0.2 -2,-0.3 -1,-0.1 -0.221 120.2 13.9 -50.0 126.6 74.5 43.6 3.4 78 82 A G T 3 S+ 0 0 53 -51,-2.6 -1,-0.3 1,-0.3 -50,-0.1 0.293 88.8 142.0 91.3 -11.0 76.6 40.7 2.1 79 83 A D < - 0 0 42 -3,-2.5 -52,-2.7 -53,-0.1 2,-0.6 -0.315 48.0-134.6 -58.3 143.6 75.2 38.1 4.5 80 84 A T E -B 26 0A 26 -54,-0.2 2,-0.5 -56,-0.0 24,-0.4 -0.936 21.9-155.8 -99.5 123.8 74.6 34.6 3.1 81 85 A L E -B 25 0A 0 -56,-3.2 -56,-2.2 -2,-0.6 2,-0.6 -0.860 8.9-159.4-104.8 131.9 71.2 33.3 4.2 82 86 A L E -BE 24 102A 69 20,-3.0 20,-2.5 -2,-0.5 2,-0.6 -0.954 11.2-163.2-106.2 121.8 70.3 29.6 4.4 83 87 A I E -BE 23 101A 0 -60,-3.1 -60,-2.5 -2,-0.6 2,-0.5 -0.934 6.3-173.3-113.0 116.2 66.6 29.0 4.3 84 88 A D E -BE 22 100A 41 16,-2.8 16,-2.5 -2,-0.6 2,-0.5 -0.944 2.3-169.6-116.6 121.6 65.3 25.6 5.5 85 89 A G E -BE 21 99A 0 -64,-3.2 -64,-2.2 -2,-0.5 2,-0.4 -0.943 5.6-179.0-116.5 124.6 61.7 24.6 5.1 86 90 A R E -BE 20 98A 122 12,-2.8 12,-3.1 -2,-0.5 2,-0.6 -0.976 26.7-130.7-127.3 127.1 60.3 21.5 6.8 87 91 A C E + E 0 97A 24 -68,-2.8 10,-0.3 -2,-0.4 3,-0.2 -0.633 25.9 174.9 -73.4 118.8 56.8 20.1 6.6 88 92 A V E S+ 0 0 21 8,-2.6 2,-0.3 -2,-0.6 268,-0.3 0.462 74.6 32.4-102.2 -5.8 55.7 19.4 10.2 89 93 A H E - 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