==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CONTRACTILE PROTEIN 13-DEC-00 1HPW . COMPND 2 MOLECULE: FIMBRIAL PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR D.W.KEIZER,C.M.SLUPSKY,A.P.CAMPBELL,R.T.IRVIN,B.D.SYKES . 129 1 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9526.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 62 48.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 3 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 19 14.7 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.8 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 . 10 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 5 3.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 21 16.3 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 1 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 2 0 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 22 A A 0 0 155 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 136.5 -13.8 -25.9 18.4 2 23 A L - 0 0 178 2,-0.0 2,-0.3 0, 0.0 0, 0.0 -0.639 360.0-151.4-102.5 161.8 -11.7 -25.5 15.3 3 24 A E + 0 0 195 -2,-0.2 2,-0.3 2,-0.0 0, 0.0 -0.891 27.4 127.0-130.5 161.3 -11.1 -22.4 13.2 4 25 A G - 0 0 76 -2,-0.3 2,-0.2 0, 0.0 -2,-0.0 -0.931 46.8 -89.1 167.8 171.4 -10.2 -21.6 9.6 5 26 A T - 0 0 106 -2,-0.3 -2,-0.0 1,-0.1 0, 0.0 -0.512 21.7-177.7 -99.7 170.5 -11.2 -19.7 6.4 6 27 A E S S+ 0 0 174 -2,-0.2 3,-0.2 0, 0.0 -1,-0.1 0.570 78.2 42.6-131.6 -53.3 -13.5 -20.7 3.6 7 28 A F + 0 0 183 1,-0.2 2,-2.4 3,-0.0 -2,-0.1 0.999 61.6 157.0 -62.3 -71.8 -13.5 -17.9 0.9 8 29 A A + 0 0 78 1,-0.1 2,-1.7 2,-0.1 -1,-0.2 -0.345 63.6 71.4 77.6 -59.6 -9.8 -17.1 0.8 9 30 A R + 0 0 173 -2,-2.4 2,-2.9 -3,-0.2 3,-0.3 -0.372 61.8 165.6 -85.6 58.8 -10.1 -15.7 -2.8 10 31 A A > + 0 0 53 -2,-1.7 4,-2.2 1,-0.2 5,-0.2 -0.364 8.0 155.2 -75.1 65.6 -12.0 -12.6 -1.6 11 32 A Q H > + 0 0 51 -2,-2.9 4,-2.4 1,-0.2 -1,-0.2 0.798 65.6 65.7 -63.3 -28.1 -11.5 -10.8 -4.9 12 33 A L H > S+ 0 0 137 -3,-0.3 4,-1.7 2,-0.2 5,-0.2 0.951 107.4 37.6 -59.2 -51.5 -14.6 -8.8 -4.1 13 34 A S H > S+ 0 0 75 -3,-0.2 4,-2.6 1,-0.2 5,-0.2 0.955 119.5 47.0 -65.6 -51.1 -13.0 -7.0 -1.1 14 35 A E H X S+ 0 0 90 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.811 107.1 62.6 -60.6 -29.7 -9.6 -6.8 -2.7 15 36 A A H X S+ 0 0 52 -4,-2.4 4,-1.7 -5,-0.2 -2,-0.2 0.985 111.2 32.9 -59.4 -62.1 -11.3 -5.5 -5.9 16 37 A M H X S+ 0 0 141 -4,-1.7 4,-1.8 1,-0.2 5,-0.3 0.902 119.2 54.6 -61.8 -41.4 -12.8 -2.3 -4.3 17 38 A T H X S+ 0 0 91 -4,-2.6 4,-1.5 1,-0.2 -1,-0.2 0.852 109.1 48.3 -60.9 -35.1 -9.7 -2.1 -2.0 18 39 A L H X S+ 0 0 84 -4,-2.4 4,-1.7 -5,-0.2 -1,-0.2 0.811 106.1 59.6 -75.1 -30.8 -7.5 -2.1 -5.1 19 40 A A H >X S+ 0 0 56 -4,-1.7 4,-1.4 2,-0.2 3,-0.6 0.990 113.0 33.5 -60.4 -64.0 -9.6 0.5 -6.8 20 41 A S H 3X S+ 0 0 81 -4,-1.8 4,-1.6 1,-0.2 -1,-0.2 0.865 117.0 57.9 -61.1 -36.5 -9.2 3.3 -4.3 21 42 A G H 3X S+ 0 0 32 -4,-1.5 4,-1.6 -5,-0.3 -1,-0.2 0.822 103.4 53.6 -63.7 -31.0 -5.7 2.0 -3.5 22 43 A L H X S+ 0 0 137 -4,-1.6 4,-1.5 1,-0.2 3,-0.7 0.939 115.2 47.2 -64.6 -47.6 -0.6 5.3 -6.0 26 47 A V H 3X S+ 0 0 7 -4,-3.0 4,-1.4 1,-0.3 5,-0.3 0.876 104.7 62.0 -61.8 -36.3 -1.4 6.9 -9.4 27 48 A S H 3X S+ 0 0 29 -4,-2.4 4,-0.8 -5,-0.3 -1,-0.3 0.837 104.2 49.3 -58.2 -31.5 -1.9 10.2 -7.6 28 49 A D H X S+ 0 0 7 -4,-1.5 3,-1.8 1,-0.3 4,-0.6 0.943 105.3 38.6 -46.1 -63.0 2.8 9.2 -10.2 30 51 A F H 3X S+ 0 0 14 -4,-1.4 4,-0.5 1,-0.3 5,-0.3 0.838 115.7 55.9 -59.1 -30.0 2.0 12.7 -11.5 31 52 A S H 3< S+ 0 0 80 -4,-0.8 -1,-0.3 -5,-0.3 -2,-0.3 0.672 93.4 77.3 -74.8 -16.7 3.5 13.8 -8.2 32 53 A Q H << S+ 0 0 32 -3,-1.8 -2,-0.2 -4,-1.3 -1,-0.1 0.982 118.7 1.1 -55.7 -82.4 6.7 11.9 -9.0 33 54 A D H < S- 0 0 78 -4,-0.6 -1,-0.2 2,-0.2 -2,-0.1 0.235 98.5-115.1 -93.0 13.0 8.4 14.2 -11.5 34 55 A G S < S+ 0 0 38 -4,-0.5 2,-0.2 -5,-0.3 -3,-0.2 0.802 94.5 67.8 58.2 26.3 5.7 16.8 -11.3 35 56 A S S S- 0 0 33 -5,-0.3 32,-0.3 -6,-0.3 -1,-0.3 -0.726 92.1-100.4-150.5-162.1 5.1 15.9 -15.0 36 57 A a + 0 0 10 30,-1.3 37,-0.1 -2,-0.2 28,-0.1 -0.507 53.4 149.3-137.1 69.7 3.8 13.0 -17.1 37 58 A P - 0 0 30 0, 0.0 2,-0.1 0, 0.0 -4,-0.0 -0.004 49.3-114.0 -85.1-165.2 6.8 11.1 -18.7 38 59 A A - 0 0 58 25,-0.1 25,-0.1 23,-0.1 4,-0.1 -0.553 65.9 -73.3-135.8 69.9 7.1 7.4 -19.6 39 60 A N S > S+ 0 0 33 1,-0.1 3,-0.5 -2,-0.1 24,-0.0 0.781 94.4 133.0 47.0 29.0 9.7 5.9 -17.3 40 61 A T T 3 S+ 0 0 115 1,-0.2 -1,-0.1 3,-0.0 0, 0.0 0.810 80.2 27.0 -76.7 -30.7 12.2 7.8 -19.4 41 62 A A T 3 S+ 0 0 53 8,-0.0 4,-0.3 3,-0.0 3,-0.2 -0.109 108.9 96.5-121.8 34.0 14.1 9.0 -16.3 42 63 A A < + 0 0 5 -3,-0.5 5,-0.0 1,-0.2 -4,-0.0 -0.428 62.3 41.3-111.3-172.7 13.2 6.2 -14.0 43 64 A T S S+ 0 0 105 1,-0.2 -1,-0.2 -2,-0.1 4,-0.1 0.767 105.8 76.0 41.6 32.1 14.8 2.9 -12.8 44 65 A A S S- 0 0 94 -3,-0.2 -1,-0.2 0, 0.0 -2,-0.1 0.569 117.0 -8.6-131.6 -47.6 18.0 4.9 -12.6 45 66 A G S S+ 0 0 72 -4,-0.3 2,-0.3 0, 0.0 -3,-0.1 -0.020 116.5 75.9-148.2 32.5 17.9 7.1 -9.5 46 67 A I - 0 0 54 2,-0.0 -3,-0.0 4,-0.0 -4,-0.0 -0.914 53.4-155.7-141.2 167.1 14.3 6.7 -8.3 47 68 A E S S+ 0 0 183 -2,-0.3 -5,-0.0 -4,-0.1 -1,-0.0 -0.109 90.7 38.4-137.1 36.3 12.2 4.2 -6.4 48 69 A K S S+ 0 0 107 -19,-0.0 3,-0.2 -20,-0.0 -6,-0.1 0.399 99.9 63.0-148.7 -47.2 8.7 5.1 -7.5 49 70 A D S S+ 0 0 1 1,-0.3 2,-0.9 -8,-0.1 13,-0.3 0.822 103.5 57.4 -58.9 -30.4 8.6 6.1 -11.2 50 71 A T + 0 0 40 1,-0.1 -1,-0.3 -9,-0.1 11,-0.1 -0.667 69.7 145.1-103.6 77.5 9.8 2.5 -12.0 51 72 A D + 0 0 46 -2,-0.9 -1,-0.1 -3,-0.2 10,-0.1 0.892 8.4 133.7 -76.2 -96.3 7.0 0.4 -10.5 52 73 A I - 0 0 65 8,-0.2 4,-0.2 1,-0.1 2,-0.1 0.933 42.7-175.8 42.5 63.5 6.2 -2.8 -12.5 53 74 A N + 0 0 93 4,-0.1 4,-0.3 2,-0.1 -1,-0.1 -0.426 34.0 44.4 -86.6 164.5 6.2 -5.0 -9.4 54 75 A G S S- 0 0 57 2,-0.1 2,-1.7 1,-0.1 4,-0.2 -0.173 104.6 -58.0 92.2 171.8 5.8 -8.8 -9.3 55 76 A K S S- 0 0 182 1,-0.2 -1,-0.1 2,-0.1 -2,-0.1 -0.480 108.6 -52.0 -88.9 65.3 7.4 -11.5 -11.5 56 77 A Y S S+ 0 0 188 -2,-1.7 -1,-0.2 -4,-0.2 23,-0.1 0.787 116.5 113.5 71.4 29.5 6.1 -10.0 -14.7 57 78 A V S S+ 0 0 37 -4,-0.3 2,-0.2 1,-0.2 25,-0.2 0.124 70.1 48.6-115.3 19.1 2.6 -9.9 -13.3 58 79 A A - 0 0 23 20,-0.2 2,-0.9 -4,-0.2 20,-0.3 -0.698 56.6-174.4-161.9 103.3 2.2 -6.1 -13.2 59 80 A K + 0 0 102 18,-0.3 2,-0.4 -2,-0.2 19,-0.1 -0.784 25.2 158.6-102.9 91.8 3.0 -3.8 -16.1 60 81 A V + 0 0 30 -2,-0.9 2,-0.3 16,-0.3 16,-0.2 -0.918 4.7 155.0-117.5 141.4 2.6 -0.3 -14.7 61 82 A T B -A 75 0A 36 14,-1.2 14,-1.6 -2,-0.4 2,-0.2 -0.985 38.4-103.6-157.3 160.6 4.1 2.9 -16.1 62 83 A T + 0 0 5 -13,-0.3 2,-0.3 -2,-0.3 12,-0.1 -0.537 45.0 149.2 -89.1 156.5 3.6 6.7 -16.2 63 84 A G + 0 0 15 -2,-0.2 10,-1.2 -28,-0.1 2,-0.3 -0.975 13.2 87.7-169.6 176.1 2.2 8.6 -19.1 64 85 A G B S-B 72 0A 29 8,-0.3 8,-0.2 -2,-0.3 2,-0.2 -0.814 70.1 -78.2 120.4-161.3 0.2 11.6 -20.3 65 86 A T S S+ 0 0 139 6,-2.5 2,-0.3 -2,-0.3 5,-0.2 -0.701 73.9 104.0-148.3 89.6 1.0 15.2 -21.1 66 87 A A + 0 0 15 -2,-0.2 -30,-1.3 3,-0.1 -2,-0.0 -0.965 18.7 157.7-158.3 169.9 1.5 17.5 -18.2 67 88 A A S S+ 0 0 62 -32,-0.3 -32,-0.2 -2,-0.3 -1,-0.0 0.163 87.9 22.9 166.9 45.3 4.0 19.4 -16.1 68 89 A A S S+ 0 0 68 -33,-0.0 -33,-0.1 0, 0.0 -2,-0.0 0.133 129.7 24.1 171.7 -30.9 2.3 22.3 -14.4 69 90 A S S S- 0 0 59 31,-0.0 31,-0.6 32,-0.0 30,-0.2 0.674 107.2 -80.0-116.1 -75.3 -1.4 21.5 -14.3 70 91 A G + 0 0 18 29,-0.3 -4,-0.0 28,-0.2 -34,-0.0 -0.266 59.7 138.9 159.1 109.3 -2.3 17.8 -14.4 71 92 A G + 0 0 17 -2,-0.1 -6,-2.5 26,-0.1 2,-0.7 -0.220 21.7 149.4-161.0 56.5 -2.5 15.4 -17.3 72 93 A a E -BC 64 96A 0 24,-0.8 2,-1.0 -8,-0.2 24,-0.7 -0.866 22.8-171.2-103.2 113.2 -1.0 12.0 -16.3 73 94 A T E - C 0 95A 58 -10,-1.2 2,-0.2 -2,-0.7 22,-0.2 -0.755 13.3-171.1-103.2 85.9 -2.5 9.0 -18.0 74 95 A I E - C 0 94A 4 20,-1.0 20,-2.8 -2,-1.0 2,-0.5 -0.562 5.8-157.5 -79.6 140.1 -1.0 6.1 -16.1 75 96 A V E -AC 61 93A 56 -14,-1.6 -14,-1.2 18,-0.2 18,-0.3 -0.967 8.5-171.3-123.9 119.0 -1.6 2.6 -17.5 76 97 A A E - C 0 92A 12 16,-2.1 16,-3.7 -2,-0.5 2,-0.3 -0.671 5.5-174.1-104.7 160.9 -1.3 -0.5 -15.3 77 98 A T E - C 0 91A 20 14,-0.3 2,-0.3 -2,-0.2 -18,-0.3 -0.934 20.7-148.4-148.0 170.6 -1.4 -4.1 -16.4 78 99 A M E - C 0 90A 43 12,-1.2 12,-1.4 -2,-0.3 11,-0.8 -0.842 19.0-179.8-147.0 102.1 -1.4 -7.7 -15.1 79 100 A K S S- 0 0 106 -2,-0.3 -21,-0.1 1,-0.2 9,-0.1 -0.922 72.6 -13.8-113.2 123.3 0.3 -10.4 -17.2 80 101 A A S S+ 0 0 67 -2,-0.5 -1,-0.2 -23,-0.1 8,-0.1 0.780 101.8 132.8 62.9 26.8 0.3 -14.1 -16.1 81 102 A S - 0 0 37 -3,-0.1 -23,-0.1 2,-0.1 -3,-0.0 0.344 60.8-124.7 -82.9-142.1 -0.8 -12.9 -12.7 82 103 A D + 0 0 123 -25,-0.2 2,-0.4 1,-0.0 3,-0.1 0.077 69.1 100.6-162.5 32.5 -3.6 -14.6 -10.7 83 104 A V S S- 0 0 38 1,-0.2 -2,-0.1 -5,-0.0 -1,-0.0 -0.990 80.3 -12.4-130.3 129.6 -6.1 -11.8 -9.8 84 105 A A S S+ 0 0 51 -2,-0.4 -1,-0.2 -3,-0.0 6,-0.1 0.399 106.1 43.8 62.4 152.8 -9.4 -11.1 -11.6 85 106 A T S S- 0 0 42 1,-0.1 4,-0.1 4,-0.1 5,-0.0 0.400 85.0-106.3 58.6 155.2 -10.4 -12.6 -14.9 86 107 A P S S+ 0 0 128 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.799 112.3 24.7 -83.5 -30.4 -9.8 -16.4 -15.7 87 108 A L S S- 0 0 138 1,-0.4 2,-0.3 -5,-0.0 -7,-0.1 0.875 129.6 -19.3 -95.8 -75.1 -6.8 -15.8 -18.0 88 109 A R - 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