==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-APR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 18-DEC-09 3L48 . COMPND 2 MOLECULE: OUTER MEMBRANE USHER PROTEIN PAPC; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR B.A.FORD,S.J.HULTGREN . 406 5 5 5 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18377.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 306 75.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 37 9.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 133 32.8 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 . 15 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 1.2 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 . 55 13.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 44 10.8 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+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 . 0 0 0 1 0 0 4 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 . 9 0 10 2 4 4 0 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 1 4 5 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 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 1 728 A G 0 0 24 0, 0.0 3,-0.1 0, 0.0 67,-0.1 0.000 360.0 360.0 360.0 131.9 14.2 9.1 -27.8 2 729 A K + 0 0 139 1,-0.2 42,-3.1 43,-0.1 2,-0.6 0.763 360.0 67.3-120.9 -35.8 15.9 8.0 -31.1 3 730 A R - 0 0 6 39,-0.2 68,-2.7 40,-0.2 69,-0.8 -0.833 64.1-175.8 -92.8 122.3 19.5 7.0 -30.7 4 731 A L E -Ab 41 72A 0 37,-2.2 37,-2.9 -2,-0.6 2,-0.9 -0.911 29.6-144.7-119.4 140.7 19.9 3.8 -28.6 5 732 A F E -Ab 40 73A 1 67,-2.4 69,-1.9 -2,-0.4 2,-0.5 -0.853 35.7-162.0 -96.5 95.9 23.0 2.0 -27.4 6 733 A A E -Ab 39 74A 0 33,-2.3 33,-2.7 -2,-0.9 2,-0.8 -0.696 20.4-159.4 -94.1 125.6 21.5 -1.5 -27.7 7 734 A I E -Ab 38 75A 26 67,-2.6 69,-2.7 -2,-0.5 2,-0.5 -0.883 24.2-159.1 -96.6 104.9 23.0 -4.6 -26.0 8 735 A L E + b 0 76A 1 29,-2.8 2,-0.3 -2,-0.8 67,-0.1 -0.740 21.6 159.8 -94.7 128.0 21.6 -7.5 -28.1 9 736 A R E - b 0 77A 31 67,-1.2 69,-3.3 -2,-0.5 6,-0.2 -0.990 33.3-124.8-142.7 139.3 21.3 -11.0 -26.9 10 737 A L E > - b 0 78A 21 4,-2.7 3,-1.9 -2,-0.3 69,-0.2 -0.283 35.1-102.5 -73.4 164.8 19.1 -13.9 -28.2 11 738 A A T 3 S+ 0 0 48 67,-1.3 314,-2.6 1,-0.3 68,-0.1 0.804 124.7 55.3 -56.6 -30.6 16.7 -15.8 -25.9 12 739 A D T 3 S- 0 0 77 312,-0.3 -1,-0.3 2,-0.0 67,-0.0 0.504 122.8-106.5 -84.5 -3.6 19.3 -18.6 -25.8 13 740 A G S < S+ 0 0 1 -3,-1.9 -2,-0.1 1,-0.3 311,-0.1 0.310 78.0 126.6 100.0 -7.7 22.0 -16.2 -24.6 14 741 A S - 0 0 44 -5,-0.1 -4,-2.7 1,-0.1 -1,-0.3 -0.204 56.3-116.8 -78.8 172.9 24.0 -16.0 -27.8 15 742 A Q - 0 0 64 -6,-0.2 -6,-0.1 23,-0.0 22,-0.1 -0.919 22.9-112.6-114.3 135.4 25.0 -12.8 -29.6 16 743 A P - 0 0 3 0, 0.0 21,-0.4 0, 0.0 3,-0.1 -0.382 53.8 -94.3 -57.4 145.0 24.0 -11.7 -33.1 17 744 A P > - 0 0 51 0, 0.0 3,-2.1 0, 0.0 16,-0.2 -0.268 39.8 -89.5 -72.2 149.2 27.2 -11.8 -35.2 18 745 A F T 3 S+ 0 0 45 1,-0.3 16,-0.2 162,-0.1 17,-0.1 -0.346 116.6 28.5 -47.1 117.2 29.5 -8.9 -36.0 19 746 A G T 3 S+ 0 0 25 14,-2.9 -1,-0.3 1,-0.3 15,-0.1 0.404 82.9 140.2 104.7 -2.1 28.1 -7.2 -39.1 20 747 A A < - 0 0 2 -3,-2.1 13,-2.9 13,-0.2 -1,-0.3 -0.387 47.3-127.4 -66.2 151.6 24.5 -8.1 -38.7 21 748 A S E -DE 32 53B 21 32,-2.3 32,-3.3 11,-0.2 2,-0.5 -0.792 10.0-148.4-105.0 149.7 22.0 -5.4 -39.7 22 749 A V E -DE 31 52B 1 9,-2.6 8,-2.0 -2,-0.3 9,-1.1 -0.971 20.6-173.9-117.7 124.0 19.2 -3.9 -37.6 23 750 A T E -DE 29 51B 17 28,-2.7 28,-2.5 -2,-0.5 6,-0.2 -0.897 18.9-124.5-124.7 148.0 16.1 -2.7 -39.4 24 751 A S > - 0 0 10 4,-2.6 3,-1.4 -2,-0.3 26,-0.1 -0.256 38.3 -98.7 -79.0 169.6 12.9 -0.9 -38.4 25 752 A E T 3 S+ 0 0 128 1,-0.3 -1,-0.1 2,-0.1 25,-0.1 0.902 128.4 56.7 -51.5 -41.6 9.3 -2.1 -39.1 26 753 A K T 3 S- 0 0 109 1,-0.1 -1,-0.3 2,-0.1 -3,-0.0 0.698 123.0-109.5 -66.5 -20.4 9.4 0.3 -42.0 27 754 A G < + 0 0 45 -3,-1.4 2,-0.2 1,-0.3 -2,-0.1 0.447 69.4 143.7 104.6 3.9 12.5 -1.5 -43.3 28 755 A R - 0 0 34 1,-0.1 -4,-2.6 -5,-0.0 2,-0.9 -0.547 54.3-121.2 -79.6 138.5 15.0 1.2 -42.6 29 756 A E E +D 23 0B 55 -2,-0.2 206,-1.2 -6,-0.2 207,-0.7 -0.704 33.0 174.9 -82.7 108.4 18.5 0.3 -41.5 30 757 A L E - 0 0 2 -8,-2.0 12,-3.2 -2,-0.9 2,-0.3 0.608 59.8 -34.3 -91.0 -15.1 19.0 1.9 -38.1 31 758 A G E -D 22 0B 0 -9,-1.1 -9,-2.6 10,-0.2 2,-0.3 -0.973 53.7-106.4 172.7 175.2 22.4 0.4 -37.3 32 759 A M E -D 21 0B 22 8,-0.4 8,-0.5 212,-0.4 2,-0.4 -0.950 34.5-110.5-127.3 145.0 24.8 -2.5 -37.6 33 760 A V B -C 39 0A 0 -13,-2.9 -14,-2.9 -2,-0.3 6,-0.2 -0.594 37.1-177.3 -76.9 128.4 25.9 -5.0 -34.9 34 761 A A > - 0 0 3 4,-3.5 3,-0.6 -2,-0.4 -14,-0.2 0.168 45.2 -29.6 -95.1-139.7 29.5 -4.5 -33.8 35 762 A D G > S+ 0 0 56 1,-0.2 3,-2.3 2,-0.1 -1,-0.3 -0.359 122.7 13.5 -75.5 154.7 31.5 -6.6 -31.3 36 763 A E G 3 S- 0 0 120 1,-0.3 -1,-0.2 -3,-0.1 3,-0.1 0.785 127.9 -65.8 51.9 34.7 29.9 -8.4 -28.3 37 764 A G G < S+ 0 0 1 -3,-0.6 -29,-2.8 -21,-0.4 2,-0.4 0.616 93.5 147.1 67.0 12.7 26.3 -7.9 -29.6 38 765 A L E < +A 7 0A 24 -3,-2.3 -4,-3.5 -31,-0.2 2,-0.4 -0.663 21.4 178.4 -83.8 133.0 26.5 -4.2 -29.3 39 766 A A E -AC 6 33A 0 -33,-2.7 -33,-2.3 -2,-0.4 2,-0.6 -0.926 21.4-150.1-139.0 115.6 24.5 -2.1 -31.8 40 767 A W E -A 5 0A 9 -8,-0.5 2,-0.5 204,-0.4 -8,-0.4 -0.727 24.2-159.2 -79.1 119.1 24.2 1.7 -31.9 41 768 A L E -A 4 0A 0 -37,-2.9 -37,-2.2 -2,-0.6 2,-0.4 -0.877 5.3-155.5-109.7 130.5 20.8 2.5 -33.5 42 769 A S S S+ 0 0 2 -12,-3.2 -39,-0.2 -2,-0.5 195,-0.1 -0.808 72.0 6.8-101.6 142.1 19.9 5.8 -35.1 43 770 A G S S+ 0 0 31 -2,-0.4 2,-0.2 1,-0.2 -1,-0.2 0.822 79.8 172.1 63.5 36.5 16.3 7.1 -35.5 44 771 A V - 0 0 1 -42,-3.1 -1,-0.2 -3,-0.3 26,-0.0 -0.550 26.7-138.7 -78.0 140.5 14.6 4.4 -33.4 45 772 A T > - 0 0 82 -2,-0.2 3,-2.0 4,-0.0 19,-0.2 -0.890 24.4-116.1-100.3 122.5 11.0 4.8 -32.5 46 773 A P T 3 S+ 0 0 36 0, 0.0 20,-0.3 0, 0.0 3,-0.1 -0.343 99.8 20.3 -55.8 128.7 10.0 3.8 -29.0 47 774 A G T 3 S+ 0 0 29 17,-1.1 19,-0.2 18,-0.6 2,-0.0 0.244 94.8 125.3 98.5 -12.3 7.7 0.9 -29.0 48 775 A E < - 0 0 11 -3,-2.0 16,-2.6 17,-0.2 2,-0.6 -0.269 61.3-116.5 -79.2 166.1 8.5 -0.4 -32.5 49 776 A T E - F 0 63B 37 14,-0.2 2,-0.3 -3,-0.1 14,-0.2 -0.915 28.5-163.3-104.9 122.0 9.6 -3.9 -33.5 50 777 A L E - F 0 62B 0 12,-2.2 12,-2.4 -2,-0.6 2,-0.4 -0.770 7.1-145.2-102.1 149.1 13.1 -4.2 -35.0 51 778 A S E -EF 23 61B 10 -28,-2.5 -28,-2.7 -2,-0.3 2,-0.6 -0.927 6.0-145.7-112.3 140.4 14.4 -7.1 -36.9 52 779 A V E -EF 22 60B 0 8,-3.1 7,-2.5 -2,-0.4 8,-1.2 -0.921 22.6-161.8-106.2 121.7 18.1 -8.3 -36.8 53 780 A N E +EF 21 58B 27 -32,-3.3 -32,-2.3 -2,-0.6 2,-0.3 -0.853 23.3 142.4-114.0 136.7 19.3 -9.7 -40.0 54 781 A W + 0 0 49 3,-2.0 3,-0.5 -2,-0.4 -34,-0.1 -0.956 63.0 30.9-157.9 161.4 22.3 -11.9 -41.1 55 782 A D S S- 0 0 142 -2,-0.3 -1,-0.1 1,-0.2 3,-0.1 0.918 130.2 -62.9 55.0 45.7 22.9 -14.7 -43.6 56 783 A G S S+ 0 0 90 1,-0.1 2,-0.3 -3,-0.1 -1,-0.2 0.817 117.9 93.0 53.2 39.5 20.3 -13.1 -45.9 57 784 A K S S- 0 0 119 -3,-0.5 -3,-2.0 -5,-0.0 2,-0.7 -0.993 83.9-106.3-160.6 143.5 17.6 -13.6 -43.4 58 785 A I E +F 53 0B 60 -2,-0.3 -5,-0.2 -5,-0.2 23,-0.1 -0.687 39.3 178.0 -68.8 115.9 15.6 -12.1 -40.5 59 786 A Q E - 0 0 51 -7,-2.5 2,-0.3 -2,-0.7 22,-0.2 0.846 56.4 -17.5 -93.3 -40.6 17.1 -14.1 -37.6 60 787 A a E -F 52 0B 0 -8,-1.2 -8,-3.1 20,-0.2 -1,-0.3 -0.976 57.5-130.5-159.5 168.5 15.2 -12.5 -34.7 61 788 A Q E -FG 51 79B 59 18,-2.6 18,-2.5 -2,-0.3 2,-0.3 -0.932 10.9-157.1-129.9 151.8 13.2 -9.5 -33.5 62 789 A V E -F 50 0B 0 -12,-2.4 -12,-2.2 -2,-0.3 2,-0.7 -0.927 14.9-135.1-125.4 150.2 13.3 -7.1 -30.6 63 790 A N E -F 49 0B 112 14,-0.4 -14,-0.2 -2,-0.3 -15,-0.1 -0.920 20.2-140.3-106.1 110.4 10.6 -4.9 -29.0 64 791 A V - 0 0 3 -16,-2.6 -17,-1.1 -2,-0.7 12,-0.1 -0.575 30.2-112.2 -70.0 119.6 11.9 -1.4 -28.3 65 792 A P > - 0 0 47 0, 0.0 3,-1.6 0, 0.0 -18,-0.6 -0.150 14.5-126.4 -51.9 145.2 10.5 -0.4 -24.9 66 793 A E T 3 S+ 0 0 142 1,-0.3 -2,-0.1 -20,-0.3 -18,-0.0 0.717 110.6 59.0 -65.2 -20.1 7.9 2.5 -25.1 67 794 A T T 3 S+ 0 0 108 2,-0.0 -1,-0.3 -20,-0.0 2,-0.2 0.301 75.0 130.9 -94.8 8.3 10.1 4.2 -22.5 68 795 A A < - 0 0 3 -3,-1.6 2,-0.3 -67,-0.1 -64,-0.0 -0.419 33.6-178.5 -64.7 131.2 13.2 4.3 -24.7 69 796 A I > - 0 0 11 -2,-0.2 3,-1.2 1,-0.1 -2,-0.0 -0.851 35.5 -68.8-128.3 169.3 14.9 7.7 -24.8 70 797 A S T 3 S+ 0 0 20 275,-0.4 275,-2.6 -2,-0.3 -66,-0.2 -0.207 113.9 11.7 -65.7 142.8 17.9 9.1 -26.6 71 798 A D T 3 S+ 0 0 2 -68,-2.7 2,-0.5 1,-0.2 -1,-0.2 0.730 91.2 145.3 62.6 26.0 21.4 8.0 -25.5 72 799 A Q E < -b 4 0A 32 -3,-1.2 -67,-2.4 -69,-0.8 2,-0.5 -0.810 42.9-146.1 -93.2 129.6 19.9 5.2 -23.4 73 800 A Q E +b 5 0A 14 -2,-0.5 2,-0.3 269,-0.3 -67,-0.2 -0.838 33.0 163.2 -88.0 128.5 21.8 1.9 -23.2 74 801 A L E -b 6 0A 4 -69,-1.9 -67,-2.6 -2,-0.5 2,-0.3 -1.000 41.4-111.0-148.8 149.5 19.4 -1.0 -22.9 75 802 A L E -b 7 0A 9 186,-2.5 -67,-0.2 -2,-0.3 188,-0.1 -0.606 27.0-165.4 -71.7 129.5 19.2 -4.8 -23.2 76 803 A L E -b 8 0A 2 -69,-2.7 -67,-1.2 -2,-0.3 2,-0.3 -0.866 12.0-147.0-118.9 96.3 17.2 -5.9 -26.2 77 804 A P E -b 9 0A 48 0, 0.0 2,-0.7 0, 0.0 -14,-0.4 -0.462 14.7-144.9 -59.9 120.9 16.3 -9.6 -26.0 78 805 A a E -b 10 0A 0 -69,-3.3 -67,-1.3 -2,-0.3 -16,-0.2 -0.816 18.2-171.5 -97.3 111.6 16.3 -10.9 -29.6 79 806 A T B -G 61 0B 67 -18,-2.5 -18,-2.6 -2,-0.7 -69,-0.0 -0.885 27.1-114.8-108.7 125.9 13.6 -13.6 -30.1 80 807 A P 0 0 84 0, 0.0 -20,-0.2 0, 0.0 -21,-0.1 -0.275 360.0 360.0 -50.2 137.5 13.3 -15.6 -33.2 81 808 A Q 0 0 148 -22,-0.2 -21,-0.1 -23,-0.1 -22,-0.0 0.220 360.0 360.0 -48.6 360.0 10.0 -14.9 -35.0 82 !* 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 83 728 B G 0 0 92 0, 0.0 2,-0.3 0, 0.0 44,-0.2 0.000 360.0 360.0 360.0 153.2 37.4 -4.2 -11.9 84 729 B K E -H 126 0C 45 42,-2.9 42,-2.8 40,-0.1 2,-0.4 -0.794 360.0-129.5-110.8 151.2 34.3 -3.2 -13.9 85 730 B R E - 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