==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL INVASION 12-JUL-12 4G2S . COMPND 2 MOLECULE: PROTEIN PRGH; . SOURCE 2 ORGANISM_SCIENTIFIC: SALMONELLA ENTERICA SUBSP. ENTERICA SE . AUTHOR L.J.WORRALL,M.VUCKOVIC,N.C.J.STRYNADKA . 636 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 29893.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 412 64.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 36 5.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 204 32.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.9 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 . 12 1.9 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 . 58 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 66 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 30 4.7 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 6 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 0 6 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 . 0 0 8 4 17 6 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 6 6 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 14 A P 0 0 110 0, 0.0 101,-2.2 0, 0.0 102,-0.3 0.000 360.0 360.0 360.0-174.4 -14.9 23.4 -26.3 2 15 A Y E -A 101 0A 38 16,-0.5 16,-2.5 99,-0.2 2,-0.4 -0.752 360.0-151.4-127.7 157.9 -11.2 23.1 -26.3 3 16 A I E -AB 100 17A 19 97,-2.6 97,-2.3 -2,-0.3 2,-0.6 -0.969 12.8-138.6-128.8 141.5 -8.4 20.7 -27.1 4 17 A V E -AB 99 16A 0 12,-3.5 12,-3.6 -2,-0.4 2,-0.4 -0.944 22.0-167.0 -99.0 125.3 -4.9 20.3 -25.7 5 18 A R E -AB 98 15A 14 93,-2.9 93,-2.1 -2,-0.6 2,-0.3 -0.908 16.3-134.0-108.0 132.7 -2.4 19.6 -28.4 6 19 A L E -A 97 0A 0 8,-2.5 7,-2.2 -2,-0.4 91,-0.2 -0.648 16.9-174.4 -81.6 134.7 1.1 18.4 -27.5 7 20 A L S S+ 0 0 5 89,-3.4 177,-1.2 -2,-0.3 2,-0.2 0.415 71.0 13.1-113.2 -2.6 3.8 20.3 -29.5 8 21 A N S S+ 0 0 45 88,-0.8 3,-0.2 175,-0.1 5,-0.2 -0.805 84.6 77.5-148.5-163.6 6.7 18.1 -28.3 9 22 A S S > S- 0 0 28 -2,-0.2 3,-1.6 1,-0.2 42,-0.1 -0.071 97.1 -67.7 75.7 170.5 7.3 14.8 -26.4 10 23 A S T 3 S+ 0 0 30 40,-0.5 -1,-0.2 1,-0.3 124,-0.1 0.665 138.2 57.2 -65.8 -16.5 7.1 11.3 -28.1 11 24 A L T > S+ 0 0 0 39,-0.3 3,-2.7 -3,-0.2 -5,-0.3 0.093 77.2 158.2-101.4 18.1 3.3 12.0 -28.3 12 25 A N T < + 0 0 18 -3,-1.6 -5,-0.2 1,-0.3 169,-0.1 -0.192 67.8 25.2 -42.4 122.6 3.9 15.2 -30.4 13 26 A G T 3 S+ 0 0 0 -7,-2.2 -1,-0.3 1,-0.3 -6,-0.1 0.138 86.2 137.2 103.0 -15.6 0.7 16.0 -32.3 14 27 A C < - 0 0 0 -3,-2.7 -8,-2.5 -9,-0.1 2,-0.5 -0.387 40.0-154.0 -63.3 139.8 -1.7 14.1 -29.8 15 28 A E E -B 5 0A 35 -10,-0.2 -10,-0.3 -3,-0.1 -1,-0.0 -0.970 8.2-166.6-125.7 121.5 -4.8 16.1 -29.1 16 29 A F E -B 4 0A 1 -12,-3.6 -12,-3.5 -2,-0.5 2,-0.2 -0.926 19.5-128.4-114.1 129.7 -6.8 15.6 -25.9 17 30 A P E -B 3 0A 74 0, 0.0 2,-0.5 0, 0.0 -14,-0.2 -0.517 21.6-140.6 -75.0 141.9 -10.3 17.0 -25.5 18 31 A L - 0 0 9 -16,-2.5 -16,-0.5 -2,-0.2 2,-0.2 -0.838 8.8-145.9-102.0 134.5 -10.9 19.1 -22.4 19 32 A L - 0 0 99 -2,-0.5 43,-0.3 25,-0.2 2,-0.1 -0.597 36.3 -88.2 -87.8 156.5 -14.0 18.9 -20.4 20 33 A T S S+ 0 0 91 -2,-0.2 2,-0.4 41,-0.1 43,-0.2 -0.475 104.3 22.2 -55.9 136.8 -15.6 21.8 -18.6 21 34 A G E S-D 62 0B 28 41,-2.5 41,-2.3 -2,-0.1 2,-0.5 -0.843 115.2 -10.4 103.5-143.9 -13.9 21.9 -15.2 22 35 A R E -D 61 0B 62 -2,-0.4 2,-0.4 39,-0.2 39,-0.2 -0.859 49.5-173.7-107.1 125.4 -10.6 20.4 -14.3 23 36 A T E -D 60 0B 1 37,-2.5 37,-2.6 -2,-0.5 2,-0.4 -0.990 15.7-145.4-116.7 127.2 -8.5 18.0 -16.4 24 37 A L E -De 59 46B 0 21,-2.9 23,-2.6 -2,-0.4 2,-0.5 -0.770 9.0-166.1 -90.1 133.1 -5.3 16.4 -15.0 25 38 A F E -De 58 47B 0 33,-2.8 33,-2.1 -2,-0.4 2,-0.5 -0.977 4.7-161.6-116.7 115.8 -2.2 15.7 -17.0 26 39 A V E - e 0 48B 0 21,-3.0 23,-3.0 -2,-0.5 2,-0.5 -0.900 13.8-172.1-100.4 124.8 0.4 13.4 -15.3 27 40 A V E + e 0 49B 6 -2,-0.5 2,-0.3 21,-0.2 30,-0.1 -0.977 33.0 68.5-129.1 116.5 3.7 13.9 -17.1 28 41 A G E - e 0 50B 11 21,-2.0 23,-1.7 -2,-0.5 25,-0.1 -0.975 69.8 -35.7 170.1-159.9 6.7 11.7 -16.4 29 42 A Q S >> S- 0 0 123 -2,-0.3 4,-1.2 21,-0.2 3,-0.9 -0.023 71.3 -69.1 -88.9-170.2 8.4 8.3 -16.6 30 43 A S H 3> S+ 0 0 94 1,-0.2 4,-1.6 2,-0.2 5,-0.3 0.776 119.1 66.3 -50.5 -42.9 7.3 4.6 -16.3 31 44 A D H 3> S+ 0 0 68 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.891 104.9 44.8 -53.7 -42.7 6.4 4.6 -12.6 32 45 A A H <> S+ 0 0 0 -3,-0.9 4,-1.7 1,-0.1 -1,-0.2 0.921 108.4 56.3 -69.3 -47.5 3.5 7.0 -13.2 33 46 A L H >X S+ 0 0 24 -4,-1.2 4,-0.8 1,-0.2 3,-0.8 0.945 106.9 44.9 -51.2 -59.2 2.0 5.3 -16.3 34 47 A T H 3< S+ 0 0 76 -4,-1.6 3,-0.4 1,-0.3 -1,-0.2 0.853 117.7 47.0 -62.4 -30.5 1.4 1.8 -15.0 35 48 A A H >< S+ 0 0 0 -4,-0.9 3,-2.0 -5,-0.3 -1,-0.3 0.713 93.7 74.6 -81.9 -19.8 -0.1 3.2 -11.9 36 49 A S H X< S+ 0 0 10 -4,-1.7 3,-1.9 -3,-0.8 -1,-0.2 0.764 77.6 78.6 -67.5 -22.5 -2.3 5.7 -13.6 37 50 A G T 3< S+ 0 0 63 -4,-0.8 -1,-0.3 -3,-0.4 -2,-0.1 0.607 73.8 81.9 -54.6 -15.5 -4.5 2.7 -14.5 38 51 A Q T < S+ 0 0 62 -3,-2.0 -1,-0.3 545,-0.1 -2,-0.2 0.810 73.6 85.8 -57.1 -36.8 -5.8 3.0 -10.9 39 52 A L S < S- 0 0 34 -3,-1.9 512,-0.1 -4,-0.2 7,-0.0 -0.463 90.5-106.7 -73.2 140.8 -8.1 5.8 -12.0 40 53 A P - 0 0 83 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.055 24.0-108.7 -64.9 168.7 -11.5 4.5 -13.4 41 54 A D S S+ 0 0 164 3,-0.1 3,-0.2 -4,-0.0 -2,-0.0 0.151 71.4 137.9 -84.6 19.5 -12.6 4.5 -17.0 42 55 A I S S- 0 0 85 1,-0.2 3,-0.2 3,-0.0 -3,-0.0 -0.121 79.7 -53.3 -55.0 160.9 -15.1 7.4 -16.3 43 56 A P S S- 0 0 116 0, 0.0 -1,-0.2 0, 0.0 2,-0.1 -0.201 84.1 -93.4 -44.8 120.5 -15.2 10.1 -18.9 44 57 A A + 0 0 45 -3,-0.2 -25,-0.2 1,-0.2 -3,-0.1 -0.168 61.8 155.4 -57.0 110.8 -11.5 11.0 -19.0 45 58 A D + 0 0 55 -3,-0.2 -21,-2.9 -2,-0.1 2,-0.3 0.210 68.8 58.4-109.2 11.6 -10.6 13.8 -16.6 46 59 A S E -e 24 0B 17 -23,-0.2 2,-0.3 99,-0.1 -21,-0.2 -0.998 60.1-177.7-141.1 138.6 -7.0 12.5 -16.5 47 60 A F E -e 25 0B 4 -23,-2.6 -21,-3.0 -2,-0.3 2,-0.5 -0.986 17.4-142.1-136.6 144.9 -4.2 11.8 -19.1 48 61 A F E -e 26 0B 4 -2,-0.3 -21,-0.2 94,-0.2 97,-0.2 -0.936 16.0-173.4-106.3 130.1 -0.7 10.4 -18.9 49 62 A I E -e 27 0B 0 -23,-3.0 -21,-2.0 -2,-0.5 2,-0.2 -0.989 20.7-132.4-119.2 125.9 2.0 11.9 -21.1 50 63 A P E +e 28 0B 7 0, 0.0 -40,-0.5 0, 0.0 -39,-0.3 -0.558 33.7 161.4 -78.3 133.2 5.4 10.2 -21.2 51 64 A L - 0 0 18 -23,-1.7 4,-0.3 -2,-0.2 3,-0.1 -0.888 30.4-152.4-151.7 124.6 8.4 12.5 -20.8 52 65 A D S S+ 0 0 121 -2,-0.3 2,-0.3 1,-0.2 -23,-0.1 0.856 80.0 19.6 -72.3 -30.4 11.9 11.2 -19.8 53 66 A H S S+ 0 0 128 -25,-0.1 -1,-0.2 1,-0.1 41,-0.1 -0.996 118.2 13.2-143.5 139.4 13.0 14.5 -18.1 54 67 A G S S+ 0 0 32 -2,-0.3 40,-2.5 1,-0.2 41,-0.4 0.678 71.9 162.4 81.1 16.8 11.5 17.7 -16.7 55 68 A G - 0 0 31 -4,-0.3 2,-0.4 38,-0.2 -1,-0.2 -0.497 14.4-175.7 -74.3 135.1 7.9 16.5 -16.5 56 69 A V - 0 0 39 36,-0.4 2,-0.1 -2,-0.2 19,-0.1 -1.000 23.6-124.8-129.2 134.0 5.6 18.4 -14.3 57 70 A N + 0 0 9 -2,-0.4 17,-2.5 17,-0.3 2,-0.3 -0.421 37.0 176.7 -74.8 149.2 1.9 17.4 -13.6 58 71 A F E -DF 25 73B 0 -33,-2.1 -33,-2.8 15,-0.2 2,-0.4 -0.987 24.9-138.4-150.1 159.4 -0.6 20.1 -14.3 59 72 A E E -DF 24 72B 14 13,-2.7 13,-3.4 -2,-0.3 2,-0.5 -0.970 9.9-151.3-117.2 139.3 -4.4 20.8 -14.4 60 73 A I E -DF 23 71B 0 -37,-2.6 -37,-2.5 -2,-0.4 2,-0.5 -0.918 12.6-161.9-103.3 127.9 -6.3 22.7 -17.0 61 74 A Q E -DF 22 70B 83 9,-2.8 9,-2.1 -2,-0.5 2,-0.6 -0.965 7.8-172.7-115.0 124.5 -9.4 24.5 -15.7 62 75 A V E -DF 21 69B 8 -41,-2.3 -41,-2.5 -2,-0.5 7,-0.2 -0.970 27.1-130.0-118.3 110.4 -12.1 25.6 -18.2 63 76 A D > - 0 0 38 5,-1.5 3,-2.1 -2,-0.6 -42,-0.0 -0.155 27.7-103.3 -63.7 162.7 -14.7 27.7 -16.4 64 77 A T T 3 S+ 0 0 131 1,-0.3 -1,-0.1 2,-0.1 -44,-0.1 0.858 124.2 51.2 -59.1 -36.5 -18.3 26.8 -17.0 65 78 A D T 3 S- 0 0 116 1,-0.0 -1,-0.3 3,-0.0 -2,-0.1 0.618 102.7-132.4 -70.7 -18.8 -18.7 29.8 -19.3 66 79 A A S < S+ 0 0 36 -3,-2.1 -2,-0.1 2,-0.2 3,-0.1 0.752 76.4 112.6 63.6 28.4 -15.6 28.8 -21.4 67 80 A T S S+ 0 0 106 1,-0.2 2,-0.4 0, 0.0 -3,-0.1 0.627 70.1 42.0-102.9 -19.9 -14.4 32.5 -21.1 68 81 A E - 0 0 100 2,-0.0 -5,-1.5 -5,-0.0 2,-0.5 -0.996 64.0-158.3-130.7 139.8 -11.2 32.0 -18.9 69 82 A I E -F 62 0B 12 -2,-0.4 15,-2.6 15,-0.3 2,-0.4 -0.967 10.6-174.1-121.1 122.7 -8.5 29.3 -19.0 70 83 A I E -FG 61 83B 24 -9,-2.1 -9,-2.8 -2,-0.5 2,-0.5 -0.918 10.9-157.9-119.1 128.0 -6.3 28.6 -16.0 71 84 A L E -FG 60 82B 0 11,-3.0 11,-2.3 -2,-0.4 2,-0.7 -0.926 7.0-159.2-104.5 126.5 -3.4 26.2 -15.9 72 85 A H E -FG 59 81B 30 -13,-3.4 -13,-2.7 -2,-0.5 2,-0.6 -0.952 5.9-155.0-103.2 111.8 -2.4 24.9 -12.4 73 86 A E E -FG 58 80B 22 7,-2.9 7,-2.0 -2,-0.7 2,-0.5 -0.808 17.6-133.4 -82.5 125.5 1.2 23.7 -12.3 74 87 A L E + G 0 79B 10 -17,-2.5 -17,-0.3 -2,-0.6 5,-0.2 -0.666 33.3 165.7 -90.3 116.2 1.5 21.1 -9.5 75 88 A K E > - 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