==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL ADHESION 14-SEP-12 4H40 . COMPND 2 MOLECULE: PUTATIVE CELL ADHESION PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTEROIDES FRAGILIS; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 604 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27978.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 387 64.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 50 8.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 192 31.8 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 . 10 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 76 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 0 RESIDUES PER ALPHA HELIX . 4 4 0 0 2 0 0 2 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 . 6 8 3 3 8 1 4 0 1 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 3 1 1 0 0 0 0 3 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 34 A R 0 0 105 0, 0.0 2,-0.3 0, 0.0 96,-0.2 0.000 360.0 360.0 360.0 131.2 -50.8 32.1 16.3 2 35 A V E -A 96 0A 14 94,-2.8 94,-2.6 145,-0.0 2,-0.4 -0.680 360.0-116.4 -88.5 140.4 -48.9 31.5 13.0 3 36 A R E -Ab 95 147A 104 143,-1.8 145,-2.8 -2,-0.3 2,-0.6 -0.675 26.8-139.7 -78.9 128.2 -48.4 27.9 11.5 4 37 A I E -Ab 94 148A 10 90,-3.5 90,-0.7 -2,-0.4 145,-0.2 -0.829 18.0-174.5 -93.7 119.8 -44.6 27.0 11.4 5 38 A D E - b 0 149A 77 143,-2.4 145,-2.2 -2,-0.6 2,-0.2 -0.909 15.9-155.8-111.3 93.2 -43.6 25.1 8.2 6 39 A P E - b 0 150A 6 0, 0.0 2,-0.5 0, 0.0 69,-0.4 -0.570 1.8-153.4 -79.3 140.8 -39.9 24.1 8.7 7 40 A V E - b 0 151A 52 143,-2.9 145,-2.7 -2,-0.2 67,-0.1 -0.968 23.3-115.7-116.0 120.2 -37.7 23.5 5.6 8 41 A A - 0 0 23 -2,-0.5 65,-0.1 65,-0.5 67,-0.0 -0.216 19.9-166.1 -55.0 137.9 -34.7 21.1 6.0 9 42 A G - 0 0 25 144,-0.4 -1,-0.1 1,-0.3 2,-0.1 0.339 35.7-131.2-108.4 1.3 -31.2 22.7 5.5 10 43 A G - 0 0 6 144,-0.1 145,-1.8 143,-0.1 -1,-0.3 -0.301 22.7 -87.5 81.2-165.5 -29.3 19.4 5.3 11 44 A Y E -Cd 35 155B 33 24,-2.3 24,-2.8 143,-0.3 145,-0.2 -0.987 15.5-122.9-145.7 156.0 -26.2 18.3 7.1 12 45 A Y E - d 0 156B 12 143,-2.6 145,-0.6 -2,-0.3 22,-0.1 -0.899 40.8-137.2 -94.0 113.3 -22.4 18.4 6.8 13 46 A P - 0 0 18 0, 0.0 2,-0.0 0, 0.0 143,-0.0 -0.341 27.8 -84.4 -72.0 162.2 -21.2 14.8 6.9 14 47 A S - 0 0 30 259,-0.1 2,-0.3 -2,-0.0 259,-0.2 -0.357 51.7-174.3 -62.4 137.7 -18.2 13.5 8.9 15 48 A I B -l 273 0C 63 257,-1.8 259,-2.3 -3,-0.1 3,-0.1 -0.837 31.4 -84.4-129.6 170.1 -14.8 13.9 7.1 16 49 A S - 0 0 68 -2,-0.3 259,-0.1 257,-0.2 257,-0.0 -0.474 58.5 -89.9 -74.2 146.0 -11.1 12.9 7.8 17 50 A P 0 0 65 0, 0.0 -1,-0.1 0, 0.0 252,-0.0 -0.164 360.0 360.0 -58.0 148.1 -9.1 15.3 10.0 18 51 A S 0 0 164 -3,-0.1 -3,-0.0 0, 0.0 0, 0.0 -0.722 360.0 360.0-150.0 360.0 -7.1 18.1 8.3 19 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 20 55 A R 0 0 111 0, 0.0 2,-0.5 0, 0.0 8,-0.1 0.000 360.0 360.0 360.0-158.1 -7.8 27.0 13.1 21 56 A G + 0 0 83 1,-0.1 111,-0.0 2,-0.1 0, 0.0 -0.771 360.0 125.3 -91.1 120.4 -9.6 29.0 15.9 22 57 A A - 0 0 84 -2,-0.5 4,-0.2 110,-0.2 -1,-0.1 -0.303 67.7-115.6-164.9 53.7 -11.2 32.4 15.1 23 58 A T S S+ 0 0 93 2,-0.1 110,-0.1 1,-0.1 109,-0.1 -0.211 99.4 35.3 -56.3 126.6 -14.8 31.7 16.4 24 59 A P S S- 0 0 75 0, 0.0 2,-0.5 0, 0.0 109,-0.2 0.445 90.0-154.0 -80.8 145.0 -17.2 31.7 14.6 25 60 A D B +m 133 0D 22 107,-2.4 109,-1.7 1,-0.1 110,-0.4 -0.723 21.7 174.3 -85.9 118.1 -15.2 30.1 11.8 26 61 A G S S+ 0 0 24 -2,-0.5 -1,-0.1 107,-0.2 4,-0.1 0.424 74.4 59.2-103.7 -1.5 -16.6 30.8 8.3 27 62 A E S S+ 0 0 129 2,-0.1 4,-0.4 1,-0.1 3,-0.2 0.692 85.9 69.7-101.8 -26.4 -13.8 29.1 6.4 28 63 A T S S+ 0 0 64 1,-0.2 3,-0.2 -8,-0.1 -2,-0.1 0.892 113.3 28.3 -62.2 -41.1 -13.8 25.5 7.6 29 64 A L S > S+ 0 0 1 -4,-0.2 3,-1.9 1,-0.1 -1,-0.2 0.397 87.8 105.3-102.9 0.2 -17.1 24.6 5.8 30 65 A K T 3 S+ 0 0 116 1,-0.3 -1,-0.1 -3,-0.2 -2,-0.1 0.899 95.1 28.4 -51.4 -48.1 -17.0 27.0 2.9 31 66 A D T 3 S+ 0 0 140 -4,-0.4 -1,-0.3 -3,-0.2 -2,-0.1 0.053 96.1 116.6-101.0 21.5 -16.1 24.3 0.3 32 67 A R < - 0 0 38 -3,-1.9 2,-0.2 1,-0.0 -3,-0.1 -0.778 65.0-125.1 -90.4 132.0 -17.8 21.4 2.2 33 68 A P - 0 0 83 0, 0.0 2,-0.5 0, 0.0 -2,-0.1 -0.511 16.5-134.0 -77.2 149.5 -20.8 19.7 0.5 34 69 A I - 0 0 83 -2,-0.2 -22,-0.2 -22,-0.1 2,-0.2 -0.892 16.9-155.0-102.6 128.4 -24.2 19.5 2.2 35 70 A F B -C 11 0B 98 -24,-2.8 -24,-2.3 -2,-0.5 2,-0.2 -0.610 26.5-101.1 -96.0 158.8 -26.0 16.1 2.2 36 71 A L - 0 0 88 -26,-0.2 3,-0.1 -2,-0.2 -1,-0.1 -0.585 48.0 -93.7 -76.4 147.6 -29.8 15.7 2.5 37 72 A L - 0 0 6 -2,-0.2 -1,-0.1 1,-0.1 3,-0.1 -0.341 55.9 -96.1 -58.3 135.8 -31.0 14.7 6.0 38 73 A E > - 0 0 110 1,-0.1 3,-1.9 4,-0.1 26,-0.2 -0.357 41.9-102.8 -63.7 134.5 -31.3 10.9 5.9 39 74 A D T 3 S+ 0 0 103 1,-0.2 26,-0.2 -3,-0.1 -1,-0.1 -0.369 107.1 21.2 -56.6 129.6 -34.8 9.5 5.1 40 75 A G T 3 S+ 0 0 44 24,-2.9 -1,-0.2 1,-0.3 25,-0.1 0.224 94.2 123.9 92.9 -11.0 -36.5 8.2 8.3 41 76 A S < - 0 0 33 -3,-1.9 23,-2.6 22,-0.1 -1,-0.3 -0.313 54.3-131.8 -74.1 161.8 -34.3 10.3 10.7 42 77 A T E -E 63 0B 8 21,-0.2 2,-0.4 -3,-0.1 21,-0.2 -0.895 13.2-160.0-118.3 150.3 -35.9 12.7 13.2 43 78 A I E -E 62 0B 0 19,-1.8 19,-2.8 -2,-0.3 2,-0.5 -0.973 8.9-146.7-125.6 141.4 -35.1 16.3 14.0 44 79 A R E -EF 61 106B 33 62,-2.8 62,-1.4 -2,-0.4 2,-0.5 -0.950 8.6-146.2-109.7 130.6 -36.0 18.2 17.2 45 80 A L E -EF 60 105B 1 15,-3.6 15,-1.5 -2,-0.5 2,-0.5 -0.858 12.0-164.1 -93.0 121.7 -36.8 21.9 17.0 46 81 A V E - F 0 104B 0 58,-2.7 58,-2.3 -2,-0.5 2,-0.4 -0.967 8.2-159.4-111.3 118.4 -35.7 23.8 20.2 47 82 A V E + F 0 103B 3 -2,-0.5 8,-2.7 8,-0.3 2,-0.3 -0.839 11.4 179.7-105.9 138.9 -37.3 27.3 20.6 48 83 A Y E -GF 54 102B 10 54,-2.5 54,-1.5 -2,-0.4 6,-0.2 -0.916 27.0-116.0-127.5 154.6 -36.0 30.2 22.7 49 84 A D > - 0 0 43 4,-2.2 3,-1.9 -2,-0.3 53,-0.4 -0.170 47.4 -85.0 -80.2-176.1 -37.3 33.7 23.3 50 85 A D T 3 S+ 0 0 112 50,-0.5 51,-0.1 1,-0.3 -1,-0.1 0.712 132.9 55.5 -63.4 -20.8 -35.4 36.9 22.2 51 86 A A T 3 S- 0 0 62 2,-0.1 -1,-0.3 51,-0.0 50,-0.1 0.232 122.4-108.2 -95.0 11.2 -33.5 36.7 25.6 52 87 A K < + 0 0 63 -3,-1.9 2,-0.4 1,-0.2 -2,-0.1 0.737 69.3 148.2 65.5 34.0 -32.4 33.1 24.8 53 88 A N - 0 0 89 1,-0.1 -4,-2.2 147,-0.0 -1,-0.2 -0.813 54.0-100.7 -99.1 135.6 -34.7 31.5 27.4 54 89 A L B -G 48 0B 63 -2,-0.4 2,-0.5 -6,-0.2 -6,-0.2 -0.241 25.0-159.9 -58.8 133.0 -36.2 28.0 26.7 55 90 A L > - 0 0 27 -8,-2.7 3,-1.9 1,-0.1 -8,-0.3 -0.757 10.4-179.8-117.7 79.2 -39.8 27.8 25.4 56 91 A E G > S+ 0 0 157 -2,-0.5 3,-1.4 1,-0.3 -1,-0.1 0.756 77.9 64.9 -46.5 -36.1 -40.8 24.2 26.2 57 92 A E G 3 S+ 0 0 141 1,-0.3 -1,-0.3 -3,-0.1 -3,-0.0 0.794 102.1 47.5 -63.7 -30.6 -44.3 24.8 24.7 58 93 A Y G < S+ 0 0 28 -3,-1.9 2,-0.3 -11,-0.1 -1,-0.3 0.283 81.3 125.9 -97.2 12.7 -42.8 25.4 21.2 59 94 A S < + 0 0 34 -3,-1.4 2,-0.3 -4,-0.2 -13,-0.2 -0.575 38.0 174.6 -73.3 124.0 -40.6 22.2 21.4 60 95 A K E -E 45 0B 26 -15,-1.5 -15,-3.6 -2,-0.3 2,-0.3 -0.997 24.4-150.5-139.3 144.2 -41.4 20.0 18.3 61 96 A A E -EH 44 78B 6 17,-0.6 17,-2.3 -2,-0.3 2,-0.3 -0.855 16.2-164.8-110.4 143.4 -40.1 16.8 16.7 62 97 A Y E -EH 43 77B 2 -19,-2.8 -19,-1.8 -2,-0.3 2,-0.4 -0.950 15.5-135.5-131.1 150.1 -40.2 16.0 12.9 63 98 A L E -EH 42 76B 14 13,-2.7 13,-2.7 -2,-0.3 2,-0.4 -0.886 24.1-133.5-104.2 133.5 -39.8 12.9 10.7 64 99 A V E + H 0 75B 0 -23,-2.6 -24,-2.9 -2,-0.4 2,-0.3 -0.754 28.0 169.5 -91.4 133.3 -37.7 13.2 7.6 65 100 A R E - H 0 74B 102 9,-1.8 9,-2.7 -2,-0.4 2,-2.5 -0.940 30.8-142.8-141.3 111.1 -38.9 11.9 4.2 66 101 A N + 0 0 49 -2,-0.3 7,-0.3 7,-0.3 -27,-0.1 -0.451 67.0 119.0 -75.8 66.0 -36.9 12.9 1.1 67 102 A A + 0 0 63 -2,-2.5 -1,-0.2 5,-0.1 6,-0.2 0.353 33.4 144.4-112.6 -4.0 -40.1 13.1 -0.9 68 103 A G > - 0 0 7 4,-3.2 3,-1.5 -3,-0.4 6,-0.1 -0.022 66.5-111.5 -44.6 142.0 -39.8 16.9 -1.8 69 104 A T T 3 S+ 0 0 163 1,-0.3 -1,-0.1 2,-0.2 0, 0.0 0.592 123.6 43.8 -55.1 -9.7 -41.1 18.0 -5.3 70 105 A S T 3 S- 0 0 102 3,-0.0 -1,-0.3 0, 0.0 -2,-0.1 0.639 133.6 -88.5-104.1 -27.6 -37.4 18.6 -6.1 71 106 A G S < S+ 0 0 45 -3,-1.5 -3,-0.2 1,-0.2 -2,-0.2 0.113 90.0 142.3 124.1 -1.6 -36.0 15.3 -4.5 72 107 A S - 0 0 48 -5,-0.2 -4,-3.2 1,-0.1 2,-0.4 0.080 57.9 -90.6 -62.8 164.5 -35.8 17.4 -1.3 73 108 A S - 0 0 14 -7,-0.3 -65,-0.5 -6,-0.2 2,-0.4 -0.658 34.2-158.2 -85.3 133.7 -36.4 16.6 2.4 74 109 A L E -H 65 0B 66 -9,-2.7 -9,-1.8 -2,-0.4 2,-0.6 -0.924 9.3-141.6-112.8 137.3 -39.9 17.1 3.8 75 110 A L E -H 64 0B 19 -69,-0.4 -11,-0.2 -2,-0.4 -33,-0.0 -0.898 15.5-168.8-107.5 116.8 -40.5 17.5 7.6 76 111 A Y E -H 63 0B 76 -13,-2.7 -13,-2.7 -2,-0.6 -2,-0.0 -0.904 28.6-113.7-108.2 123.2 -43.6 15.8 9.1 77 112 A P E +H 62 0B 20 0, 0.0 2,-0.3 0, 0.0 -15,-0.2 -0.203 50.2 165.9 -52.9 132.9 -44.7 16.6 12.7 78 113 A C E -H 61 0B 1 -17,-2.3 -17,-0.6 13,-0.1 2,-0.4 -0.876 37.9-116.5-143.5 174.3 -44.3 13.4 14.8 79 114 A E E -N 88 0E 82 9,-2.8 8,-2.4 -2,-0.3 9,-1.3 -0.970 36.6-174.4-117.4 130.2 -44.2 12.2 18.4 80 115 A V E -N 86 0E 18 -2,-0.4 6,-0.2 6,-0.3 2,-0.1 -0.845 24.4-117.2-126.1 165.4 -40.9 10.6 19.6 81 116 A D > - 0 0 53 4,-2.1 3,-1.9 -2,-0.3 6,-0.0 -0.289 52.8 -86.6 -83.9 178.9 -39.5 8.8 22.7 82 117 A D T 3 S+ 0 0 126 1,-0.3 29,-2.5 28,-0.1 -1,-0.0 0.733 130.8 55.4 -65.8 -16.3 -36.6 10.3 24.7 83 118 A N T 3 S- 0 0 106 27,-0.2 27,-0.3 2,-0.1 -1,-0.3 0.433 120.8-107.1 -93.3 -1.5 -34.1 8.7 22.2 84 119 A G S < S+ 0 0 4 -3,-1.9 25,-0.6 25,-0.4 2,-0.3 0.548 72.3 139.4 87.5 11.2 -35.8 10.4 19.2 85 120 A A - 0 0 51 23,-0.1 -4,-2.1 1,-0.1 -1,-0.3 -0.701 61.7-104.9 -85.4 138.4 -37.5 7.3 17.7 86 121 A V E +N 80 0E 66 -2,-0.3 -6,-0.3 -6,-0.2 3,-0.1 -0.420 38.4 173.1 -66.6 132.8 -41.0 7.8 16.4 87 122 A I E S+ 0 0 120 -8,-2.4 2,-0.2 1,-0.5 -7,-0.2 0.524 79.7 4.6-110.3 -15.2 -43.7 6.3 18.8 88 123 A S E -N 79 0E 48 -9,-1.3 -9,-2.8 2,-0.0 -1,-0.5 -0.900 53.8-153.6-167.3 136.8 -46.5 7.9 16.6 89 124 A S + 0 0 48 -2,-0.2 2,-0.8 -11,-0.2 -26,-0.1 0.082 49.7 139.8-102.0 21.1 -46.4 9.8 13.3 90 125 A S - 0 0 69 1,-0.1 2,-0.5 -11,-0.1 -2,-0.0 -0.571 51.1-137.9 -69.4 100.5 -49.8 11.5 14.3 91 126 A S + 0 0 60 -2,-0.8 -13,-0.1 -13,-0.0 -1,-0.1 -0.573 31.1 174.0 -74.2 115.7 -48.9 15.1 13.0 92 127 A T - 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