==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-SEP-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL PROTEIN 09-AUG-07 2JTY . COMPND 2 MOLECULE: TYPE-1 FIMBRIAL PROTEIN, A CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR D.ERILOV,G.WIDER,R.GLOCKSHUBER,C.PUORGER,M.VETSCH . 184 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9124.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 119 64.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 6.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 49 26.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 1.1 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 . 1 0.5 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 . 25 13.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 4 2.2 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 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 RESIDUES PER ALPHA HELIX . 1 0 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 PARALLEL BRIDGES PER LADDER . 2 2 0 0 0 0 2 1 0 1 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 1 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 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 A 0 0 131 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 121.1 15.1 23.7 0.8 2 2 A A - 0 0 96 1,-0.1 58,-0.0 2,-0.0 0, 0.0 0.780 360.0-168.6 -42.5 -42.8 11.6 22.6 -0.0 3 3 A T + 0 0 131 1,-0.2 2,-0.3 2,-0.0 -1,-0.1 0.959 38.2 121.4 47.7 65.4 12.7 21.6 -3.6 4 4 A T + 0 0 80 1,-0.1 -1,-0.2 20,-0.0 -2,-0.0 -0.941 30.7 48.0-146.1 168.5 9.2 21.1 -5.0 5 5 A V - 0 0 95 -2,-0.3 4,-0.1 2,-0.1 -1,-0.1 0.482 69.5-108.6 70.2 147.2 6.8 22.3 -7.7 6 6 A N S S- 0 0 150 2,-0.2 3,-0.1 1,-0.1 -1,-0.1 0.930 74.3 -68.8 -71.9 -45.1 7.5 22.7 -11.4 7 7 A G S S+ 0 0 54 1,-0.6 2,-0.2 0, 0.0 -1,-0.1 0.105 102.5 36.3 143.1 84.8 7.5 26.5 -11.5 8 8 A G S S- 0 0 41 2,-0.1 2,-1.6 -2,-0.0 -1,-0.6 -0.446 100.2 -63.9 139.8 165.8 4.2 28.3 -11.0 9 9 A T S S- 0 0 140 1,-0.2 3,-0.1 -2,-0.2 -4,-0.0 -0.713 98.5 -60.7 -79.4 91.8 1.1 27.8 -8.9 10 10 A V - 0 0 95 -2,-1.6 2,-1.9 1,-0.2 -1,-0.2 0.729 58.0-157.5 45.4 71.0 -0.1 24.6 -10.4 11 11 A H + 0 0 101 -3,-0.2 2,-0.3 -4,-0.1 -1,-0.2 -0.288 69.3 78.6 -85.5 51.0 -0.6 25.7 -14.1 12 12 A F + 0 0 159 -2,-1.9 3,-0.1 -3,-0.1 0, 0.0 -0.859 44.4 165.9-156.7 118.1 -3.0 22.8 -14.8 13 13 A K + 0 0 176 -2,-0.3 -2,-0.0 1,-0.1 4,-0.0 -0.396 25.4 134.7-135.4 54.7 -6.6 22.9 -13.6 14 14 A G S S- 0 0 79 2,-0.1 -1,-0.1 0, 0.0 2,-0.1 0.945 75.8 -7.5 -65.9 -47.2 -8.3 20.1 -15.6 15 15 A E S S- 0 0 148 -3,-0.1 2,-2.3 1,-0.0 -3,-0.0 -0.130 117.3 -21.2-129.9-154.6 -10.3 18.6 -12.6 16 16 A V + 0 0 79 1,-0.1 2,-2.1 -2,-0.1 155,-0.1 -0.453 59.3 178.1 -65.6 70.6 -10.7 18.8 -8.8 17 17 A V + 0 0 66 -2,-2.3 2,-0.3 1,-0.1 -1,-0.1 -0.389 39.6 116.7 -76.1 58.1 -7.3 20.5 -8.3 18 18 A N + 0 0 103 -2,-2.1 2,-0.4 3,-0.0 140,-0.2 -0.821 23.0 140.7-129.9 95.6 -8.0 20.8 -4.5 19 19 A A - 0 0 52 -2,-0.3 150,-0.0 1,-0.1 138,-0.0 -0.955 43.4-147.0-133.7 114.7 -5.6 18.7 -2.4 20 20 A A S S+ 0 0 10 -2,-0.4 42,-0.5 41,-0.1 2,-0.3 0.737 92.2 35.2 -49.3 -34.9 -4.4 20.5 0.9 21 21 A a S S- 0 0 1 40,-0.2 39,-0.2 105,-0.1 40,-0.2 -0.956 80.4-137.0-125.8 146.5 -1.1 18.7 0.5 22 22 A A - 0 0 65 37,-2.1 38,-0.1 -2,-0.3 36,-0.1 0.387 39.2-123.5 -94.9 1.8 0.6 18.0 -2.9 23 23 A V - 0 0 33 36,-0.4 35,-0.2 33,-0.1 5,-0.1 0.931 25.9-102.1 49.5 113.4 1.8 14.4 -2.1 24 24 A D >> - 0 0 58 33,-2.0 4,-2.5 1,-0.1 3,-1.9 -0.240 20.6-123.3 -53.0 141.8 5.5 13.7 -2.5 25 25 A A H 3> S+ 0 0 78 1,-0.3 4,-1.2 2,-0.2 -1,-0.1 0.887 115.7 63.3 -51.1 -39.1 6.7 11.9 -5.7 26 26 A G H 34 S+ 0 0 65 1,-0.2 -1,-0.3 2,-0.1 -2,-0.1 0.209 116.1 28.3 -71.2 13.8 8.1 9.3 -3.3 27 27 A S H <4 S+ 0 0 1 -3,-1.9 3,-0.5 -4,-0.1 -2,-0.2 0.465 107.7 65.6-144.6 -36.7 4.5 8.6 -2.1 28 28 A V H < S+ 0 0 47 -4,-2.5 146,-1.4 1,-0.3 2,-0.7 0.950 118.0 26.3 -58.1 -49.9 2.1 9.3 -5.0 29 29 A D E < S+a 174 0A 84 -4,-1.2 2,-0.4 144,-0.2 -1,-0.3 -0.744 90.1 165.0-121.9 75.5 3.6 6.4 -7.1 30 30 A Q E -a 175 0A 25 144,-1.7 146,-2.4 -2,-0.7 2,-0.7 -0.804 33.1-149.1-105.7 138.2 4.9 4.0 -4.5 31 31 A T E -a 176 0A 72 -2,-0.4 2,-0.9 144,-0.2 146,-0.2 -0.921 14.5-159.1-106.9 99.9 6.0 0.4 -5.0 32 32 A V E -a 177 0A 10 144,-1.2 146,-2.7 -2,-0.7 2,-1.0 -0.800 7.8-156.5 -86.3 101.2 5.2 -1.3 -1.6 33 33 A Q E +a 178 0A 135 -2,-0.9 146,-0.2 144,-0.2 3,-0.1 -0.772 17.9 178.5 -92.1 98.4 7.5 -4.4 -1.8 34 34 A L E - 0 0 16 144,-3.0 145,-0.2 -2,-1.0 -1,-0.2 0.480 34.4-149.1 -75.9 -7.3 5.9 -6.9 0.6 35 35 A G E - 0 0 32 143,-0.3 145,-1.8 113,-0.0 2,-0.3 -0.048 39.1 -29.7 66.5-172.6 8.7 -9.3 -0.4 36 36 A Q E -a 180 0A 120 143,-0.2 2,-0.3 -3,-0.1 145,-0.2 -0.644 61.5-162.0 -77.7 142.4 8.4 -13.1 -0.6 37 37 A V E -a 181 0A 14 143,-1.6 145,-3.1 -2,-0.3 2,-0.4 -0.841 20.3-112.6-124.0 150.8 6.0 -14.8 1.9 38 38 A R E > -a 182 0A 162 -2,-0.3 3,-1.2 143,-0.2 145,-0.2 -0.723 14.2-135.6 -84.9 137.7 5.8 -18.4 3.0 39 39 A T G > S+ 0 0 19 143,-1.9 3,-1.8 -2,-0.4 104,-0.2 0.740 102.0 76.4 -60.4 -21.8 2.8 -20.4 1.9 40 40 A A G 3 S+ 0 0 69 1,-0.3 -1,-0.2 3,-0.1 3,-0.2 0.917 95.3 46.3 -49.5 -48.8 2.8 -21.6 5.6 41 41 A S G < S+ 0 0 53 -3,-1.2 -1,-0.3 1,-0.2 98,-0.2 0.314 111.2 56.8 -79.2 5.9 1.3 -18.3 6.6 42 42 A L < + 0 0 1 -3,-1.8 101,-1.1 5,-0.1 -1,-0.2 -0.701 69.7 107.5-142.7 72.1 -1.3 -18.5 3.7 43 43 A A S S+ 0 0 48 1,-0.3 2,-0.3 99,-0.2 99,-0.1 0.471 73.8 31.9-137.7 -7.2 -3.2 -21.7 4.2 44 44 A Q S > S- 0 0 112 97,-0.3 3,-2.2 -3,-0.1 97,-0.6 -0.953 95.7 -77.9-145.5 162.8 -6.8 -20.8 5.4 45 45 A E E 3 S+F 140 0B 129 95,-0.5 95,-0.3 -2,-0.3 3,-0.1 -0.517 122.7 26.4 -62.7 117.8 -9.2 -18.0 5.0 46 46 A G E 3 S+ 0 0 38 93,-2.8 -1,-0.3 1,-0.4 94,-0.1 0.214 86.9 133.5 106.6 -10.3 -7.9 -15.2 7.2 47 47 A A E < - 0 0 11 -3,-2.2 92,-3.0 92,-0.3 -1,-0.4 -0.410 36.5-169.1 -64.3 147.7 -4.2 -16.3 7.1 48 48 A T E -F 138 0B 42 90,-0.2 90,-0.2 -7,-0.1 -5,-0.0 -0.965 21.9-110.1-143.7 155.6 -1.9 -13.4 6.5 49 49 A S - 0 0 12 88,-1.9 -1,-0.1 -2,-0.3 -12,-0.1 0.005 54.5 -84.7 -66.7-177.7 1.7 -12.6 5.7 50 50 A S S S- 0 0 128 -16,-0.1 -1,-0.1 1,-0.1 86,-0.1 0.802 71.8-137.6 -59.6 -22.3 4.1 -10.9 8.2 51 51 A A - 0 0 34 -17,-0.1 2,-0.3 1,-0.1 85,-0.2 0.070 13.6-133.5 74.1 164.8 2.6 -7.6 7.0 52 52 A V E -G 135 0B 53 83,-2.3 83,-2.7 -3,-0.1 2,-0.5 -0.981 9.7-126.9-149.2 142.6 4.4 -4.3 6.3 53 53 A G E +G 134 0B 52 -2,-0.3 2,-0.3 81,-0.2 81,-0.2 -0.864 29.5 177.3 -95.2 125.3 3.7 -0.7 7.2 54 54 A F E -G 133 0B 10 79,-0.7 79,-2.7 -2,-0.5 2,-0.2 -0.872 9.4-160.4-115.6 158.5 3.6 1.7 4.3 55 55 A N E -G 132 0B 78 -2,-0.3 2,-0.5 77,-0.3 75,-0.0 -0.811 19.6-123.0-131.1 173.9 2.8 5.5 4.6 56 56 A I E -G 131 0B 0 75,-2.2 75,-1.5 -2,-0.2 2,-0.7 -0.968 22.5-150.0-121.6 109.8 1.6 8.5 2.5 57 57 A Q E -G 130 0B 43 -2,-0.5 -33,-2.0 73,-0.2 2,-0.7 -0.738 13.2-167.4 -83.4 109.4 4.0 11.4 2.6 58 58 A L E -G 129 0B 0 71,-3.0 71,-2.3 -2,-0.7 3,-0.4 -0.906 6.4-160.6-106.7 106.6 1.9 14.7 2.1 59 59 A N E + 0 0 36 -2,-0.7 -37,-2.1 1,-0.2 -36,-0.4 -0.544 64.2 11.1 -87.1 158.5 4.1 17.7 1.4 60 60 A D E S- 0 0 123 -39,-0.2 -1,-0.2 -2,-0.2 68,-0.2 0.849 79.6-172.7 33.0 57.7 3.1 21.4 1.8 61 61 A a E -G 127 0B 4 66,-2.9 66,-2.2 -3,-0.4 2,-0.4 -0.484 11.0-154.2 -64.4 142.3 -0.1 20.7 3.7 62 62 A D > - 0 0 53 -42,-0.5 4,-0.9 64,-0.2 62,-0.1 -0.978 8.0-160.1-120.3 132.5 -2.5 23.7 4.5 63 63 A T T 4 S+ 0 0 34 -2,-0.4 4,-0.1 2,-0.2 -1,-0.1 0.542 84.6 69.5 -92.7 -9.4 -4.8 23.5 7.5 64 64 A N T 4 S+ 0 0 128 2,-0.2 3,-0.2 1,-0.1 -1,-0.2 0.933 106.0 39.8 -67.3 -47.7 -7.2 26.2 6.2 65 65 A V T 4 S- 0 0 56 1,-0.3 2,-0.3 -45,-0.1 -2,-0.2 0.916 140.6 -7.4 -65.1 -49.1 -8.5 24.0 3.4 66 66 A A < - 0 0 0 -4,-0.9 -1,-0.3 95,-0.1 94,-0.3 -0.892 44.6-166.2-158.7 114.0 -8.5 20.8 5.6 67 67 A S S S+ 0 0 51 93,-1.7 57,-2.3 -2,-0.3 2,-0.3 0.444 84.6 44.2 -76.7 -2.2 -7.2 20.2 9.1 68 68 A K E -BC 123 159A 53 91,-2.5 91,-1.7 55,-0.3 2,-0.3 -0.927 61.6-162.3-137.6 164.7 -7.6 16.4 8.3 69 69 A A E -BC 122 158A 0 53,-1.9 53,-2.7 -2,-0.3 2,-0.3 -0.985 5.9-179.9-146.0 140.4 -7.0 13.8 5.7 70 70 A A E - C 0 157A 0 87,-2.1 87,-1.7 -2,-0.3 2,-0.3 -0.865 15.5-147.5-119.6 166.1 -8.3 10.3 5.1 71 71 A V E - C 0 156A 1 -2,-0.3 48,-0.7 85,-0.3 2,-0.3 -0.879 7.4-165.0-125.7 157.9 -7.4 7.9 2.3 72 72 A A E - C 0 155A 2 83,-1.1 83,-2.6 -2,-0.3 2,-0.3 -0.914 11.8-142.6-132.6 167.6 -9.4 5.3 0.5 73 73 A F E -dC 113 154A 0 39,-0.6 42,-2.4 44,-0.3 41,-0.6 -0.897 10.8-168.5-130.8 155.9 -8.2 2.4 -1.8 74 74 A L E + C 0 153A 68 79,-2.1 79,-2.0 -2,-0.3 2,-0.3 -0.981 22.1 126.7-150.8 134.0 -9.4 0.8 -5.0 75 75 A G - 0 0 23 -2,-0.3 2,-0.2 38,-0.3 77,-0.1 -0.961 62.7 -56.9-167.6 172.7 -8.5 -2.3 -7.0 76 76 A T - 0 0 100 -2,-0.3 11,-1.8 75,-0.2 2,-0.3 -0.439 58.2-124.3 -55.4 125.8 -9.8 -5.6 -8.6 77 77 A A B -J 86 0C 38 9,-0.2 9,-0.2 -2,-0.2 6,-0.2 -0.625 9.1-133.1 -74.6 139.8 -11.5 -7.6 -5.8 78 78 A I S S- 0 0 38 7,-2.5 2,-0.3 4,-0.8 -1,-0.1 0.864 81.8 -24.5 -57.1 -39.4 -10.1 -11.1 -5.5 79 79 A D S > S- 0 0 109 3,-0.4 3,-1.1 6,-0.3 6,-0.2 -0.917 72.3 -90.5-160.6 177.7 -13.6 -12.5 -5.4 80 80 A A G > S+ 0 0 83 -2,-0.3 3,-0.7 1,-0.3 -2,-0.1 0.885 124.9 52.3 -68.9 -37.8 -17.2 -11.4 -4.5 81 81 A G G 3 S+ 0 0 62 1,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.301 112.1 50.8 -78.1 5.3 -16.8 -12.5 -0.9 82 82 A H G X + 0 0 28 -3,-1.1 3,-2.1 3,-0.1 -4,-0.8 -0.254 53.6 144.7-146.9 50.5 -13.6 -10.4 -0.6 83 83 A T T < S+ 0 0 69 -3,-0.7 30,-1.7 1,-0.3 -2,-0.1 0.610 78.3 62.1 -67.0 -8.9 -14.4 -6.9 -1.9 84 84 A N T 3 S+ 0 0 48 28,-0.2 19,-0.4 -3,-0.1 2,-0.4 0.563 97.5 69.6 -81.8 -11.9 -11.9 -5.9 0.8 85 85 A V S < S- 0 0 1 -3,-2.1 -7,-2.5 -6,-0.2 -6,-0.3 -0.911 80.6-119.1-125.8 136.3 -9.0 -7.8 -0.8 86 86 A L B -J 77 0C 1 15,-2.6 15,-0.5 -2,-0.4 -9,-0.2 -0.424 13.6-135.8 -77.9 156.0 -7.0 -7.2 -4.1 87 87 A A - 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