==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER MEMBRANE PROTEIN 17-JAN-01 1HXT . COMPND 2 MOLECULE: OUTER MEMBRANE PROTEIN F; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR P.S.PHALE,A.PHILIPPSEN,C.WIDMER,V.P.PHALE,J.P.ROSENBUSCH,T.S . 340 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16763.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 265 77.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 188 55.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 1.5 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 . 28 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 11 3.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 2 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 RESIDUES PER ALPHA HELIX . 2 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 PARALLEL BRIDGES PER LADDER . 1 1 0 2 0 1 2 3 1 4 3 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 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 41 0, 0.0 12,-2.5 0, 0.0 2,-0.8 0.000 360.0 360.0 360.0 135.9 -1.9 59.5 16.9 2 2 A E E +A 12 0A 103 10,-0.3 10,-0.2 1,-0.2 3,-0.1 -0.658 360.0 161.8 -77.5 109.1 1.0 60.4 14.6 3 3 A I E + 0 0 108 8,-1.5 2,-0.3 -2,-0.8 -1,-0.2 0.458 63.1 35.6-105.1 -7.9 1.1 64.1 14.5 4 4 A Y E +A 11 0A 96 7,-1.3 7,-2.6 2,-0.0 -1,-0.2 -0.959 50.7 152.9-154.2 131.0 4.7 64.6 13.3 5 5 A N E +A 10 0A 92 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.639 30.7 121.2-159.4 87.4 6.8 62.7 10.9 6 6 A K E > +A 9 0A 113 3,-1.8 3,-1.9 -2,-0.2 -2,-0.0 -0.987 65.2 11.7-151.6 150.4 9.6 64.6 9.0 7 7 A D T 3 S- 0 0 152 -2,-0.3 -1,-0.1 1,-0.3 3,-0.1 0.894 129.1 -52.1 49.5 48.6 13.3 64.5 8.7 8 8 A G T 3 S+ 0 0 32 1,-0.2 42,-2.2 41,-0.1 2,-0.3 0.165 116.3 103.9 79.5 -18.4 13.8 61.1 10.3 9 9 A N E < -AB 6 49A 52 -3,-1.9 -3,-1.8 40,-0.2 2,-0.4 -0.756 45.1-174.2-102.5 145.1 11.8 61.9 13.5 10 10 A K E -AB 5 48A 77 38,-2.5 38,-2.5 -2,-0.3 2,-0.4 -1.000 4.6-165.6-137.8 134.6 8.3 60.8 14.3 11 11 A V E -AB 4 47A 35 -7,-2.6 -8,-1.5 -2,-0.4 -7,-1.3 -0.971 3.9-163.5-120.7 129.9 6.1 61.7 17.2 12 12 A D E -AB 2 46A 44 34,-2.6 34,-2.0 -2,-0.4 2,-0.6 -0.963 6.3-165.0-113.7 112.5 2.9 59.9 18.3 13 13 A L E + B 0 45A 58 -12,-2.5 2,-0.3 -2,-0.6 32,-0.2 -0.892 22.7 172.4 -97.4 119.0 0.8 61.9 20.7 14 14 A Y E + B 0 44A 34 30,-2.0 30,-2.1 -2,-0.6 2,-0.3 -0.850 10.1 128.9-128.9 168.5 -1.8 59.6 22.3 15 15 A G E - B 0 43A 5 325,-2.3 325,-2.4 -2,-0.3 2,-0.3 -0.986 25.8-141.2 170.4-178.0 -4.4 59.5 24.9 16 16 A K E -CB 339 42A 49 26,-1.6 26,-1.9 -2,-0.3 2,-0.5 -0.987 13.0-137.7-165.7 161.6 -7.9 58.8 26.0 17 17 A A E -CB 338 41A 59 321,-2.0 321,-2.1 -2,-0.3 2,-0.5 -0.998 24.8-166.8-127.4 117.6 -10.9 59.9 28.1 18 18 A V E -CB 337 40A 2 22,-2.9 22,-1.7 -2,-0.5 2,-0.4 -0.921 11.6-157.1-114.3 108.9 -12.6 57.0 29.9 19 19 A G E +C 336 0A 29 317,-2.1 317,-2.0 -2,-0.5 2,-0.4 -0.665 31.6 173.8 -79.5 124.6 -16.0 57.5 31.5 20 20 A L E +C 335 0A 2 -2,-0.4 18,-3.0 315,-0.2 19,-0.7 -1.000 20.2 179.3-146.3 134.0 -16.0 54.7 34.1 21 21 A H E -CD 334 37A 69 313,-1.7 313,-2.1 -2,-0.4 2,-0.4 -0.998 13.7-151.9-141.5 131.5 -18.3 53.7 36.9 22 22 A Y E -CD 333 36A 23 14,-2.1 14,-2.2 -2,-0.4 2,-0.6 -0.933 8.7-155.4-104.0 134.2 -18.1 50.8 39.4 23 23 A F E +C 332 0A 107 309,-2.8 309,-1.5 -2,-0.4 2,-0.2 -0.943 35.2 128.2-115.4 110.8 -21.2 49.3 40.9 24 24 A S - 0 0 24 -2,-0.6 2,-0.3 307,-0.2 307,-0.1 -0.760 47.2-105.7-137.6-166.0 -20.9 47.5 44.3 25 25 A K + 0 0 170 305,-0.3 3,-0.5 -2,-0.2 5,-0.4 -0.811 64.4 25.1-129.7 164.9 -22.8 47.8 47.6 26 26 A G S S- 0 0 69 -2,-0.3 -2,-0.1 1,-0.2 0, 0.0 -0.467 111.8 -36.0 94.3-154.9 -22.4 49.1 51.1 27 27 A N S S- 0 0 145 -2,-0.2 -1,-0.2 1,-0.0 8,-0.1 0.356 89.5-106.7 -86.9 1.4 -20.1 51.9 52.4 28 28 A G S > S+ 0 0 25 -3,-0.5 3,-1.5 6,-0.1 -2,-0.1 0.073 94.2 112.1 95.6 -19.7 -17.7 50.6 49.8 29 29 A E T 3 S+ 0 0 156 1,-0.2 -3,-0.1 5,-0.0 298,-0.1 0.508 75.5 44.2 -63.8 -5.5 -15.3 49.0 52.3 30 30 A N T 3 S+ 0 0 57 -5,-0.4 299,-2.7 297,-0.1 298,-1.3 0.268 87.6 100.7-126.4 22.3 -16.0 45.3 51.3 31 31 A S B < S-s 329 0B 13 -3,-1.5 296,-0.4 296,-0.2 299,-0.2 -0.432 71.6-119.4-105.1-175.0 -16.0 45.1 47.5 32 32 A Y S S+ 0 0 57 297,-0.9 295,-0.1 2,-0.1 -1,-0.1 0.957 106.8 8.6 -72.0 -55.8 -13.4 43.9 45.0 33 33 A G S S- 0 0 24 1,-0.3 2,-0.2 281,-0.1 -1,-0.1 0.561 103.8-118.1-105.8 -15.3 -13.1 47.2 43.0 34 34 A G - 0 0 17 -6,-0.1 -1,-0.3 -9,-0.1 2,-0.3 -0.711 31.1 -81.3 111.4-160.7 -15.0 49.8 45.0 35 35 A N S S+ 0 0 74 -2,-0.2 -12,-0.2 -12,-0.1 2,-0.1 -0.978 71.2 18.8-147.9 154.2 -18.0 51.9 44.1 36 36 A G E S+D 22 0A 17 -14,-2.2 -14,-2.1 -2,-0.3 2,-0.1 -0.288 95.5 1.3 84.6-170.9 -18.9 55.1 42.2 37 37 A D E +D 21 0A 70 -16,-0.2 -16,-0.2 1,-0.1 -2,-0.1 -0.292 46.5 167.0 -59.4 131.0 -17.1 57.2 39.5 38 38 A M + 0 0 47 -18,-3.0 -17,-0.2 29,-0.1 -1,-0.1 0.094 21.3 154.8-133.3 17.8 -13.7 56.0 38.3 39 39 A T + 0 0 39 -19,-0.7 28,-3.1 28,-0.2 29,-0.5 -0.078 12.8 163.7 -47.4 142.5 -13.3 58.2 35.3 40 40 A Y E -BE 18 66A 47 -22,-1.7 -22,-2.9 26,-0.3 2,-0.3 -0.982 22.1-154.9-163.1 157.8 -9.8 58.9 34.2 41 41 A A E -BE 17 65A 32 24,-2.1 24,-2.1 -2,-0.3 2,-0.3 -0.897 8.7-153.0-132.1 168.5 -7.9 60.2 31.2 42 42 A A E -BE 16 64A 13 -26,-1.9 -26,-1.6 -2,-0.3 2,-0.3 -0.987 8.4-174.7-146.3 151.1 -4.3 59.7 29.9 43 43 A L E +BE 15 63A 65 20,-1.9 20,-3.0 -2,-0.3 2,-0.3 -0.987 19.4 139.8-148.1 136.8 -1.8 61.6 27.8 44 44 A G E -BE 14 62A 0 -30,-2.1 -30,-2.0 -2,-0.3 2,-0.3 -0.946 33.9-132.6-158.9 177.5 1.6 60.6 26.5 45 45 A F E -BE 13 61A 83 16,-2.3 16,-2.0 -2,-0.3 2,-0.4 -0.971 6.1-160.6-138.0 151.9 3.9 60.8 23.6 46 46 A K E -BE 12 60A 103 -34,-2.0 -34,-2.6 -2,-0.3 2,-0.3 -0.972 20.2-174.7-134.6 110.5 6.0 58.1 21.9 47 47 A G E +BE 11 59A 16 12,-3.0 12,-2.0 -2,-0.4 2,-0.3 -0.871 9.4 178.1-113.0 151.2 8.8 59.5 19.8 48 48 A E E -BE 10 58A 72 -38,-2.5 -38,-2.5 -2,-0.3 2,-0.4 -0.980 6.9-167.4-154.2 132.4 11.3 57.8 17.5 49 49 A T E -BE 9 57A 52 8,-2.4 8,-2.2 -2,-0.3 2,-1.2 -0.975 22.4-133.7-125.8 133.3 14.1 59.1 15.4 50 50 A Q E - E 0 56A 125 -42,-2.2 6,-0.2 -2,-0.4 3,-0.1 -0.722 23.4-179.5 -82.9 92.3 16.0 57.2 12.7 51 51 A I E - 0 0 84 4,-1.4 2,-0.3 -2,-1.2 -1,-0.2 0.904 68.3 -36.9 -62.4 -43.7 19.6 58.1 13.5 52 52 A N E > S- E 0 55A 80 3,-1.7 3,-0.9 -3,-0.2 -1,-0.2 -0.912 85.0 -62.1-160.3-173.7 20.8 56.0 10.6 53 53 A S T 3 S+ 0 0 118 -2,-0.3 3,-0.1 1,-0.3 -2,-0.0 0.721 133.5 22.8 -47.9 -42.1 19.9 52.7 8.8 54 54 A D T 3 S+ 0 0 87 1,-0.1 37,-3.3 36,-0.1 2,-0.5 0.394 111.8 77.4-104.6 -11.0 20.6 50.6 11.9 55 55 A L E < +EF 52 90A 42 -3,-0.9 -3,-1.7 35,-0.2 -4,-1.4 -0.947 48.7 175.8-121.8 124.0 20.3 53.0 14.8 56 56 A T E -EF 50 89A 29 33,-2.7 33,-2.7 -2,-0.5 2,-0.3 -0.969 13.9-157.1-122.7 135.7 17.1 54.4 16.3 57 57 A G E -EF 49 88A 8 -8,-2.2 -8,-2.4 -2,-0.4 2,-0.3 -0.817 20.2-177.8-104.6 150.1 16.6 56.6 19.3 58 58 A Y E -EF 48 87A 47 29,-2.5 29,-2.5 -2,-0.3 2,-0.3 -0.983 13.8-175.1-149.3 156.2 13.3 56.6 21.2 59 59 A G E -EF 47 86A 20 -12,-2.0 -12,-3.0 -2,-0.3 2,-0.3 -0.981 4.0-174.1-150.7 148.3 11.5 58.3 24.1 60 60 A Q E +EF 46 85A 44 25,-2.3 25,-2.0 -2,-0.3 2,-0.3 -0.997 6.4 174.4-150.6 141.8 8.2 57.8 25.8 61 61 A W E +EF 45 84A 70 -16,-2.0 -16,-2.3 -2,-0.3 2,-0.3 -0.979 5.6 178.7-150.1 137.2 6.2 59.6 28.5 62 62 A E E -EF 44 83A 44 21,-2.2 20,-2.8 -2,-0.3 21,-1.5 -0.986 6.5-165.4-147.9 135.7 2.7 58.9 29.8 63 63 A Y E -EF 43 81A 48 -20,-3.0 -20,-1.9 -2,-0.3 2,-0.5 -0.950 12.8-142.8-124.6 146.7 0.6 60.5 32.5 64 64 A N E -EF 42 80A 25 16,-3.2 16,-1.6 -2,-0.3 2,-0.6 -0.946 13.9-170.9-113.2 118.9 -2.5 59.4 34.2 65 65 A F E -E 41 0A 85 -24,-2.1 -24,-2.1 -2,-0.5 14,-0.1 -0.941 19.0-138.9-108.9 103.4 -5.0 62.2 35.1 66 66 A Q E -E 40 0A 47 -2,-0.6 -26,-0.3 11,-0.2 3,-0.2 -0.300 9.7-162.4 -59.6 149.7 -7.9 61.0 37.3 67 67 A G S S+ 0 0 40 -28,-3.1 -27,-0.2 -49,-0.1 -28,-0.2 0.220 77.9 71.4-116.2 14.3 -11.3 62.4 36.3 68 68 A N S S+ 0 0 50 -29,-0.5 2,-0.3 9,-0.2 -1,-0.1 -0.059 75.1 96.8-120.0 27.6 -13.1 61.6 39.6 69 69 A N S S- 0 0 39 -3,-0.2 6,-0.1 6,-0.1 2,-0.1 -0.866 71.2-122.4-109.4 154.9 -11.4 64.2 41.8 70 70 A S - 0 0 65 -2,-0.3 -2,-0.1 1,-0.1 -1,-0.0 -0.352 29.4-108.4 -82.5 176.5 -12.9 67.6 42.6 71 71 A E S S+ 0 0 200 -2,-0.1 -1,-0.1 3,-0.1 4,-0.0 0.345 97.6 85.5 -88.7 8.7 -11.0 70.8 41.9 72 72 A G S > S- 0 0 40 3,-0.0 3,-2.0 2,-0.0 -3,-0.0 0.154 109.2 -48.1 -86.4-153.9 -10.4 71.1 45.6 73 73 A A T 3 S+ 0 0 117 1,-0.3 3,-0.4 2,-0.1 -2,-0.1 0.673 132.8 58.7 -58.6 -23.1 -7.7 69.6 47.9 74 74 A D T > S+ 0 0 65 1,-0.2 3,-1.8 2,-0.1 -1,-0.3 0.274 72.1 119.1 -90.5 14.0 -8.1 66.1 46.4 75 75 A A T < S+ 0 0 30 -3,-2.0 -1,-0.2 1,-0.3 -6,-0.1 0.757 75.4 39.4 -50.6 -41.4 -7.3 67.4 42.9 76 76 A Q T > S+ 0 0 133 -3,-0.4 3,-2.4 -11,-0.1 -1,-0.3 0.282 78.3 140.6 -96.6 10.0 -4.1 65.2 42.4 77 77 A T T < S+ 0 0 87 -3,-1.8 -11,-0.2 1,-0.3 -9,-0.2 -0.328 81.7 0.3 -57.7 126.8 -5.4 62.0 43.9 78 78 A G T 3 S+ 0 0 36 1,-0.2 2,-0.4 -13,-0.1 -1,-0.3 0.536 97.7 136.6 73.6 3.5 -4.2 59.1 41.8 79 79 A N < + 0 0 31 -3,-2.4 2,-0.3 -14,-0.1 -1,-0.2 -0.693 24.0 135.3 -84.2 139.1 -2.3 61.3 39.3 80 80 A K E -F 64 0A 104 -16,-1.6 -16,-3.2 -2,-0.4 2,-0.5 -0.990 60.1 -92.5-173.0 161.5 1.1 60.3 38.1 81 81 A T E -F 63 0A 50 -2,-0.3 -18,-0.3 -18,-0.2 3,-0.1 -0.761 34.8-171.7 -80.1 119.0 3.6 59.8 35.4 82 82 A A E + 0 0 22 -20,-2.8 2,-0.3 -2,-0.5 -19,-0.2 0.856 68.5 13.6 -80.0 -44.2 3.1 56.2 34.4 83 83 A L E +F 62 0A 4 -21,-1.5 -21,-2.2 -3,-0.1 -1,-0.3 -0.999 55.7 162.0-137.3 141.0 6.1 56.0 32.0 84 84 A A E +FG 61 100A 38 16,-2.1 16,-2.9 -2,-0.3 2,-0.3 -0.738 28.9 125.4-160.2 100.4 9.2 58.1 31.4 85 85 A F E -FG 60 99A 24 -25,-2.0 -25,-2.3 14,-0.3 2,-0.3 -0.981 32.0-161.1-153.3 161.5 12.2 56.6 29.6 86 86 A A E +FG 59 98A 61 12,-1.6 12,-2.0 -2,-0.3 2,-0.3 -0.959 22.7 149.6-142.0 156.4 14.5 57.0 26.6 87 87 A G E -FG 58 97A 14 -29,-2.5 -29,-2.5 -2,-0.3 2,-0.3 -0.957 34.8-106.4-168.9-173.7 16.8 54.6 24.7 88 88 A L E -FG 57 96A 98 8,-1.8 8,-2.1 -2,-0.3 2,-0.4 -0.965 15.7-160.5-132.0 145.7 18.6 53.4 21.6 89 89 A K E -FG 56 95A 103 -33,-2.7 -33,-2.7 -2,-0.3 2,-0.5 -0.997 8.6-165.0-129.7 127.8 18.1 50.4 19.4 90 90 A Y E >> -FG 55 94A 119 4,-2.7 3,-2.5 -2,-0.4 4,-0.9 -0.914 43.9 -79.3-124.9 110.7 20.8 49.1 17.1 91 91 A A T 34 S- 0 0 45 -37,-3.3 3,-0.3 -2,-0.5 -1,-0.1 -0.122 101.8 -31.2 40.6-124.4 20.1 46.7 14.3 92 92 A D T 34 S+ 0 0 102 53,-0.2 -1,-0.3 1,-0.2 55,-0.1 0.248 121.6 91.7-106.6 14.7 19.8 43.2 15.7 93 93 A V T <4 S- 0 0 74 -3,-2.5 2,-0.2 1,-0.3 -2,-0.2 0.765 93.9-105.2 -77.3 -29.5 22.2 43.9 18.6 94 94 A G E < -G 90 0A 13 -4,-0.9 -4,-2.7 -3,-0.3 2,-0.3 -0.754 23.5 -88.0 134.0 179.1 19.5 45.1 20.9 95 95 A S E -GH 89 140A 14 45,-2.1 45,-2.0 -6,-0.2 2,-0.4 -0.922 25.9-167.2-127.0 156.7 17.8 48.0 22.6 96 96 A F E +GH 88 139A 103 -8,-2.1 -8,-1.8 -2,-0.3 2,-0.3 -0.978 11.8 169.8-148.8 124.3 18.6 49.7 25.9 97 97 A D E -GH 87 138A 7 41,-1.7 41,-2.7 -2,-0.4 2,-0.3 -0.963 12.3-161.9-135.8 157.9 16.4 52.1 27.8 98 98 A Y E +GH 86 137A 138 -12,-2.0 -12,-1.6 -2,-0.3 2,-0.3 -0.993 45.0 56.5-139.6 146.0 16.5 53.7 31.2 99 99 A G E S-GH 85 136A 14 37,-1.1 37,-2.0 -2,-0.3 2,-0.6 -0.961 95.9 -15.5 136.3-157.2 13.8 55.5 33.3 100 100 A R E S+G 84 0A 46 -16,-2.9 -16,-2.1 -2,-0.3 2,-0.3 -0.798 83.3 133.5 -87.2 116.6 10.4 54.6 34.6 101 101 A N E - 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