==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-APR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL ADHESION 29-DEC-11 3VAC . COMPND 2 MOLECULE: CFA/I FIMBRIAL SUBUNIT E; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR Y.LIU,L.ESSER,D.XIA . 712 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33659.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 433 60.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 36 5.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 260 36.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 0.7 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 . 74 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 5.1 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 . 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 0 2 0 0 0 0 2 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 . 11 8 4 4 2 6 4 4 0 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 2 0 2 0 2 0 0 0 0 0 2 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 23 A A 0 0 109 0, 0.0 2,-0.3 0, 0.0 34,-0.0 0.000 360.0 360.0 360.0 -21.5 51.5 -12.4 71.9 2 24 A D + 0 0 93 35,-0.1 2,-0.4 33,-0.1 35,-0.2 -0.558 360.0 174.2 -68.4 129.9 54.5 -10.6 70.4 3 25 A K B -A 36 0A 46 33,-2.7 33,-2.9 -2,-0.3 31,-0.0 -0.972 26.3-147.8-144.2 133.9 53.5 -9.3 67.0 4 26 A N - 0 0 115 -2,-0.4 2,-0.2 31,-0.2 31,-0.1 -0.853 28.8-122.0 -98.7 127.3 55.3 -7.1 64.5 5 27 A P + 0 0 14 0, 0.0 2,-0.2 0, 0.0 30,-0.1 -0.462 50.5 127.1 -72.3 131.6 53.0 -4.9 62.4 6 28 A G - 0 0 19 -2,-0.2 160,-0.3 28,-0.2 159,-0.1 -0.850 58.7 -42.2-155.9-161.8 53.1 -5.1 58.6 7 29 A S + 0 0 81 158,-0.4 2,-0.3 -2,-0.2 161,-0.2 -0.404 53.9 177.5 -73.7 145.3 50.8 -5.6 55.6 8 30 A E E -b 168 0A 41 159,-1.8 161,-2.6 -2,-0.1 2,-0.4 -0.991 19.5-147.4-146.3 153.5 48.0 -8.2 55.6 9 31 A N E +b 169 0A 124 -2,-0.3 2,-0.3 159,-0.2 161,-0.2 -0.971 24.4 168.7-120.9 137.6 45.3 -9.4 53.3 10 32 A M E -b 170 0A 46 159,-2.9 161,-2.5 -2,-0.4 2,-0.4 -0.968 21.7-147.0-143.5 160.7 42.0 -10.6 54.6 11 33 A T E -b 171 0A 107 -2,-0.3 2,-0.4 159,-0.2 161,-0.2 -0.967 10.4-171.0-127.4 153.0 38.6 -11.5 53.3 12 34 A N E -b 172 0A 37 159,-2.7 161,-2.3 -2,-0.4 2,-0.5 -0.993 5.8-161.5-145.7 126.6 35.4 -11.1 55.0 13 35 A T E -b 173 0A 97 -2,-0.4 2,-0.3 159,-0.2 161,-0.2 -0.961 10.4-168.0-115.3 120.8 32.0 -12.5 53.9 14 36 A I E -b 174 0A 5 159,-3.1 161,-2.1 -2,-0.5 3,-0.2 -0.783 34.7 -40.7-108.7 144.0 28.8 -11.0 55.3 15 37 A G E - 0 0 34 -2,-0.3 2,-0.2 1,-0.3 161,-0.1 -0.404 21.6-133.8 87.5-164.8 25.2 -12.4 55.0 16 38 A P E + 0 0 69 0, 0.0 2,-0.5 0, 0.0 -1,-0.3 0.262 55.3 178.2 -64.2 124.1 23.2 -13.7 53.2 17 39 A H E -b 176 0A 20 158,-2.4 160,-3.0 -3,-0.2 2,-0.4 -0.961 20.3-142.8-106.4 126.2 21.1 -11.1 54.7 18 40 A D E > -b 177 0A 48 -2,-0.5 3,-1.4 158,-0.2 160,-0.2 -0.719 15.2-129.6 -85.3 138.6 17.6 -10.9 53.4 19 41 A R T 3 S+ 0 0 29 158,-3.1 159,-0.1 -2,-0.4 -1,-0.1 0.649 90.8 96.6 -62.3 -11.3 16.0 -7.5 53.0 20 42 A G T 3 S+ 0 0 69 157,-0.2 -1,-0.3 2,-0.0 2,-0.3 0.867 90.6 29.9 -49.7 -35.5 13.1 -8.8 55.0 21 43 A G S < S- 0 0 39 -3,-1.4 117,-0.0 1,-0.1 -1,-0.0 -0.801 94.6 -86.9-127.2 162.4 14.6 -7.3 58.2 22 44 A S - 0 0 91 -2,-0.3 -1,-0.1 1,-0.1 -4,-0.1 -0.272 58.7-101.1 -61.4 147.6 16.8 -4.4 59.4 23 45 A S - 0 0 3 113,-0.1 115,-2.7 -6,-0.1 116,-0.2 -0.586 30.0-133.9 -85.0 134.7 20.4 -5.3 59.2 24 46 A P - 0 0 65 0, 0.0 2,-0.2 0, 0.0 116,-0.2 -0.291 37.5 -87.1 -62.3 158.7 22.3 -6.3 62.3 25 47 A I - 0 0 95 112,-0.2 2,-0.5 113,-0.1 112,-0.0 -0.554 46.5-153.9 -57.1 132.4 25.8 -4.9 63.1 26 48 A Y E - C 0 135A 40 109,-1.8 109,-2.7 -2,-0.2 2,-0.3 -0.984 7.6-133.1-117.0 131.2 28.4 -7.1 61.4 27 49 A N E + C 0 134A 97 -2,-0.5 107,-0.2 107,-0.2 3,-0.1 -0.609 26.9 171.1 -78.2 134.0 31.9 -7.4 62.7 28 50 A I E S+ 0 0 10 105,-3.0 2,-0.3 1,-0.5 106,-0.2 0.693 80.7 4.2-104.4 -41.1 34.8 -7.1 60.3 29 51 A L E - C 0 133A 12 104,-2.4 104,-2.3 3,-0.0 2,-0.6 -0.959 64.5-162.5-142.7 133.1 37.5 -7.0 62.9 30 52 A N E S- 0 0 112 -2,-0.3 102,-0.2 102,-0.2 3,-0.1 -0.914 75.1 -41.1-117.0 103.8 37.0 -7.4 66.6 31 53 A S E S- 0 0 51 -2,-0.6 101,-0.2 1,-0.2 2,-0.2 0.872 81.6-171.4 43.0 42.2 40.0 -6.1 68.6 32 54 A Y E - C 0 131A 64 99,-2.6 99,-2.6 1,-0.1 2,-0.5 -0.466 24.9-115.7 -65.1 133.3 42.3 -7.6 66.2 33 55 A L E + C 0 130A 52 97,-0.2 97,-0.2 -2,-0.2 3,-0.1 -0.556 39.9 168.3 -75.4 122.1 45.9 -7.5 67.3 34 56 A T E - 0 0 0 95,-2.6 2,-0.3 -2,-0.5 -28,-0.2 0.741 64.2 -4.5-104.4 -27.6 48.0 -5.3 65.1 35 57 A A E + C 0 129A 0 94,-1.1 94,-1.8 -31,-0.1 -1,-0.4 -0.927 60.3 164.7-164.7 139.9 51.2 -4.9 67.0 36 58 A Y E +AC 3 128A 43 -33,-2.9 -33,-2.7 -2,-0.3 2,-0.4 -0.921 6.5 180.0-161.1 136.2 52.6 -5.8 70.4 37 59 A N - 0 0 17 90,-2.5 6,-0.1 -2,-0.3 -35,-0.1 -0.996 18.5-154.8-135.8 138.6 56.0 -6.0 72.1 38 60 A G S S+ 0 0 28 -2,-0.4 -1,-0.1 1,-0.1 66,-0.1 0.831 92.3 29.3 -73.2 -33.6 56.9 -7.1 75.7 39 61 A S S S+ 0 0 98 88,-0.1 2,-0.1 0, 0.0 -1,-0.1 0.907 113.5 44.2 -94.9 -55.1 60.1 -5.2 76.0 40 62 A H - 0 0 64 87,-0.1 3,-0.2 1,-0.1 -3,-0.2 -0.378 63.2-135.8-101.1 177.9 60.1 -2.0 74.0 41 63 A H > + 0 0 53 1,-0.1 3,-1.4 -2,-0.1 4,-0.2 -0.038 63.2 118.6-121.3 30.7 57.7 0.7 73.3 42 64 A L T 3 S+ 0 0 95 1,-0.3 3,-0.5 2,-0.1 -1,-0.1 0.830 79.1 52.8 -69.6 -29.1 57.9 1.2 69.6 43 65 A Y T 3 S+ 0 0 23 -3,-0.2 3,-0.4 1,-0.2 -1,-0.3 -0.152 74.9 113.2 -95.4 29.9 54.3 0.2 69.2 44 66 A D S < S+ 0 0 8 -3,-1.4 75,-0.3 1,-0.2 2,-0.3 0.835 82.8 32.3 -66.1 -39.7 53.2 2.8 71.7 45 67 A R S S+ 0 0 67 -3,-0.5 115,-2.9 -4,-0.2 -1,-0.2 -0.582 73.4 172.7-129.2 72.3 51.3 4.9 69.2 46 68 A M E +D 159 0A 0 -3,-0.4 2,-0.3 -2,-0.3 113,-0.2 -0.523 8.2 179.8 -70.6 138.3 49.8 2.9 66.4 47 69 A S E -D 158 0A 0 111,-2.2 111,-2.2 -2,-0.2 2,-0.4 -0.963 18.1-146.1-136.4 164.0 47.5 4.7 64.0 48 70 A F E -D 157 0A 0 66,-1.4 2,-0.3 -2,-0.3 109,-0.2 -0.988 17.6-170.5-133.2 135.1 45.6 3.7 60.9 49 71 A L E -D 156 0A 13 107,-2.2 107,-3.9 -2,-0.4 14,-0.2 -0.946 20.8-126.4-132.9 145.1 45.0 5.9 57.9 50 72 A a E -D 155 0A 2 12,-2.0 105,-0.1 -2,-0.3 3,-0.1 -0.509 27.8-120.9 -82.4 159.4 42.9 5.8 54.8 51 73 A L S S+ 0 0 90 103,-0.6 2,-0.3 8,-0.4 -1,-0.1 0.787 96.2 11.1 -68.7 -25.8 44.7 6.2 51.5 52 74 A S B -e 60 0A 32 7,-0.7 9,-1.4 3,-0.2 -1,-0.2 -0.999 54.4-148.3-152.4 146.6 42.5 9.2 50.9 53 75 A S S S+ 0 0 66 -2,-0.3 7,-0.1 7,-0.2 3,-0.1 0.522 104.4 29.6 -93.3 0.4 40.1 11.4 52.8 54 76 A Q S S+ 0 0 167 1,-0.1 2,-0.5 5,-0.1 6,-0.1 0.680 100.6 78.0-123.8 -42.3 38.0 12.1 49.6 55 77 A N - 0 0 93 1,-0.1 3,-0.4 4,-0.1 -3,-0.2 -0.659 54.3-170.0 -82.1 122.8 38.3 9.0 47.3 56 78 A T > + 0 0 15 -2,-0.5 25,-2.0 1,-0.2 3,-0.6 0.328 57.0 106.1 -98.0 5.2 36.0 6.3 48.6 57 79 A L T 3 S+ 0 0 90 1,-0.3 95,-0.6 23,-0.2 -1,-0.2 0.890 102.9 13.0 -54.0 -41.5 37.3 3.6 46.3 58 80 A N T 3 S- 0 0 33 -3,-0.4 96,-2.4 1,-0.2 -1,-0.3 0.125 137.2 -65.0-122.6 18.1 39.2 1.9 49.1 59 81 A G < - 0 0 1 -3,-0.6 -7,-0.7 94,-0.2 2,-0.5 0.337 47.6-127.8 107.6 131.5 37.6 3.8 51.9 60 82 A A B +eF 52 79A 9 19,-2.1 19,-1.9 -4,-0.2 -7,-0.2 -0.925 48.9 116.5-115.0 125.0 37.7 7.5 52.8 61 83 A a S S- 0 0 8 -9,-1.4 -11,-0.2 -2,-0.5 17,-0.1 -0.964 72.9 -34.7-168.2-177.1 38.7 8.8 56.2 62 84 A P - 0 0 56 0, 0.0 -12,-2.0 0, 0.0 -10,-0.1 -0.177 48.9-172.7 -56.8 141.4 41.3 10.8 57.8 63 85 A S + 0 0 42 -14,-0.2 2,-0.3 -12,-0.1 -14,-0.1 0.032 60.6 61.3-124.4 23.2 44.5 10.1 56.0 64 86 A S S S- 0 0 80 -16,-0.1 -16,-0.1 -11,-0.0 -14,-0.1 -0.987 93.5 -89.9-141.8 158.3 46.9 12.0 58.3 65 87 A D - 0 0 11 -2,-0.3 51,-0.2 1,-0.1 -2,-0.1 -0.300 55.5 -99.4 -59.9 141.1 47.9 11.8 61.9 66 88 A A - 0 0 4 49,-2.4 -1,-0.1 1,-0.2 6,-0.0 -0.477 30.0-143.9 -62.5 134.7 45.6 13.9 63.9 67 89 A P S S+ 0 0 111 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.848 72.4 87.6 -72.5 -30.1 47.6 17.2 64.5 68 90 A G S S- 0 0 41 1,-0.1 49,-0.2 2,-0.1 4,-0.1 -0.144 70.9-141.4 -62.3 158.8 46.3 17.8 68.1 69 91 A T S S+ 0 0 129 2,-0.1 2,-0.2 48,-0.1 -1,-0.1 0.755 79.9 87.0 -95.0 -24.0 48.1 16.2 71.1 70 92 A A S S- 0 0 77 1,-0.1 47,-0.4 49,-0.0 -2,-0.1 -0.479 91.1-104.5 -66.2 140.9 44.9 15.5 72.9 71 93 A T - 0 0 47 -2,-0.2 2,-0.6 45,-0.1 -1,-0.1 -0.183 19.0-130.9 -63.0 156.1 43.4 12.1 72.0 72 94 A I - 0 0 78 45,-0.3 41,-3.6 41,-0.2 44,-0.2 -0.950 30.7-154.6-107.5 108.3 40.4 11.8 69.7 73 95 A D B +G 112 0A 111 -2,-0.6 2,-0.4 39,-0.3 39,-0.3 -0.509 48.8 26.5 -84.1 144.3 38.0 9.4 71.5 74 96 A G S S- 0 0 22 37,-2.6 2,-0.3 -2,-0.2 25,-0.3 -0.869 92.8 -30.8 116.4-140.2 35.4 7.3 69.9 75 97 A E - 0 0 56 -2,-0.4 2,-0.4 23,-0.1 23,-0.2 -0.839 44.2-124.6-126.5 154.8 35.1 5.8 66.4 76 98 A T E - H 0 97A 11 21,-4.7 21,-2.3 -2,-0.3 2,-0.7 -0.808 19.5-135.0 -97.1 145.3 36.2 6.7 62.9 77 99 A N E - H 0 96A 80 -2,-0.4 2,-0.5 19,-0.2 19,-0.2 -0.855 21.6-170.4 -97.2 114.5 33.7 7.0 60.0 78 100 A I E - H 0 95A 0 17,-3.9 17,-3.0 -2,-0.7 2,-0.6 -0.929 11.1-152.9-107.4 123.6 34.9 5.3 56.8 79 101 A T E -FH 60 94A 31 -19,-1.9 -19,-2.1 -2,-0.5 2,-0.4 -0.866 22.3-177.4 -92.1 122.1 33.0 5.8 53.6 80 102 A L E - H 0 93A 0 13,-3.4 13,-3.0 -2,-0.6 2,-0.5 -0.960 22.5-131.2-128.5 137.7 33.6 2.8 51.4 81 103 A Q E - H 0 92A 39 -25,-2.0 71,-0.3 -2,-0.4 2,-0.3 -0.698 19.6-162.6 -87.5 125.9 32.3 2.1 47.9 82 104 A F E - H 0 91A 0 9,-3.7 9,-2.1 -2,-0.5 2,-0.4 -0.817 3.8-154.1-103.5 148.3 30.7 -1.3 47.2 83 105 A T E -IH 150 90A 40 67,-2.9 67,-2.7 -2,-0.3 2,-0.4 -0.977 14.6-130.9-123.0 133.1 30.2 -2.6 43.6 84 106 A E E > -I 149 0A 0 5,-2.9 4,-1.8 -2,-0.4 65,-0.2 -0.681 17.7-138.7 -91.4 135.3 27.5 -5.1 42.7 85 107 A K T 4 S+ 0 0 106 63,-2.5 -1,-0.1 -2,-0.4 64,-0.1 0.822 90.3 31.2 -67.2 -40.0 28.8 -8.0 40.8 86 108 A R T 4 S+ 0 0 115 62,-0.1 -1,-0.2 1,-0.1 199,-0.1 0.817 132.6 29.0 -90.1 -31.7 26.3 -8.7 38.0 87 109 A S T 4 S- 0 0 20 2,-0.1 -2,-0.2 216,-0.0 -1,-0.1 0.583 92.0-136.8-103.4 -17.4 25.0 -5.2 37.4 88 110 A L < + 0 0 119 -4,-1.8 -3,-0.1 1,-0.2 2,-0.0 0.658 44.3 160.7 65.9 14.8 28.1 -3.3 38.4 89 111 A I - 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