==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER MEMBRANE PROTEIN 09-JUL-99 1QD5 . COMPND 2 MOLECULE: OUTER MEMBRANE PHOSPHOLIPASE A; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR H.J.SNIJDER,I.UBARRETXENA-BELANDIA,M.BLAAUW,K.H.KALK, . 257 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12552.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 187 72.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 129 50.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.6 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 0.4 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 . 24 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 9 3.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 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 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 1 1 1 0 2 1 2 1 1 2 0 2 1 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 0 0 0 0 0 0 0 0 0 0 1 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 13 A A 0 0 122 0, 0.0 4,-0.2 0, 0.0 11,-0.1 0.000 360.0 360.0 360.0 -39.7 24.2 12.0 45.4 2 14 A V > - 0 0 55 2,-0.1 3,-1.8 6,-0.1 7,-0.1 0.935 360.0-102.1 63.9 97.6 28.0 12.2 45.1 3 15 A R T 3 S- 0 0 108 1,-0.3 254,-0.1 254,-0.1 3,-0.1 -0.157 95.4 -4.9 -50.2 130.1 29.4 13.6 48.3 4 16 A G T 3 S+ 0 0 24 1,-0.2 2,-1.2 251,-0.1 -1,-0.3 0.493 85.5 142.8 64.0 6.0 30.5 17.2 48.2 5 17 A S <> - 0 0 5 -3,-1.8 4,-1.5 -4,-0.2 -1,-0.2 -0.686 25.6-177.7 -81.8 98.9 29.8 17.6 44.4 6 18 A I H > S+ 0 0 18 -2,-1.2 4,-1.8 2,-0.2 -1,-0.2 0.947 78.0 45.4 -62.3 -50.5 28.4 21.2 44.3 7 19 A I H > S+ 0 0 0 1,-0.2 4,-1.3 2,-0.2 104,-0.2 0.889 112.6 49.3 -63.0 -44.4 27.6 21.3 40.6 8 20 A A H > S+ 0 0 28 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.855 110.1 53.8 -63.9 -33.2 26.0 17.8 40.5 9 21 A N H < S+ 0 0 48 -4,-1.5 3,-0.5 1,-0.2 -1,-0.2 0.882 105.5 52.6 -67.7 -38.9 23.9 18.9 43.5 10 22 A M H < S+ 0 0 0 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.760 103.9 57.0 -67.8 -28.3 22.7 22.0 41.7 11 23 A L H < S+ 0 0 39 -4,-1.3 2,-0.7 -5,-0.1 -1,-0.2 0.742 84.6 92.3 -74.0 -26.1 21.6 20.0 38.6 12 24 A Q S < S- 0 0 121 -4,-0.8 2,-0.2 -3,-0.5 -4,-0.0 -0.626 83.3-132.4 -72.0 110.5 19.3 17.9 40.9 13 25 A E - 0 0 151 -2,-0.7 2,-0.4 1,-0.0 -2,-0.1 -0.445 12.5-142.2 -72.4 136.8 16.0 19.8 40.7 14 26 A H - 0 0 57 -2,-0.2 -1,-0.0 -4,-0.1 5,-0.0 -0.808 6.3-145.1 -99.1 139.6 14.1 20.7 43.8 15 27 A D S S+ 0 0 168 -2,-0.4 -1,-0.1 1,-0.1 -2,-0.0 0.893 90.3 61.0 -69.5 -40.5 10.3 20.6 43.9 16 28 A N S > S- 0 0 83 1,-0.1 3,-2.3 4,-0.0 -1,-0.1 -0.808 76.3-149.5 -92.1 116.7 10.0 23.5 46.3 17 29 A P T 3 S+ 0 0 113 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.648 96.4 60.6 -58.2 -16.7 11.6 26.7 44.7 18 30 A F T 3 S+ 0 0 186 2,-0.1 2,-1.0 1,-0.0 -3,-0.0 0.414 77.4 97.3 -92.3 -1.2 12.5 27.9 48.2 19 31 A T < - 0 0 69 -3,-2.3 -5,-0.1 -5,-0.0 -1,-0.0 -0.811 66.0-163.4 -89.8 102.2 14.7 24.8 48.9 20 32 A L - 0 0 69 -2,-1.0 43,-0.1 1,-0.1 -2,-0.1 -0.160 14.5-111.3 -80.4 178.3 18.2 26.3 48.1 21 33 A Y E -A 62 0A 12 41,-1.3 41,-2.8 -11,-0.0 2,-0.3 -0.879 24.3-121.4-114.2 142.1 21.5 24.5 47.4 22 34 A P E +A 61 0A 48 0, 0.0 39,-0.2 0, 0.0 3,-0.1 -0.631 29.8 172.5 -82.5 139.1 24.5 24.6 49.7 23 35 A Y + 0 0 15 37,-1.1 38,-0.1 1,-0.4 3,-0.1 0.661 68.3 2.5-104.6 -82.2 27.8 26.0 48.1 24 36 A D S S- 0 0 23 1,-0.2 -1,-0.4 56,-0.2 36,-0.2 -0.146 105.2 -62.0 -90.0-168.0 30.4 26.2 50.9 25 37 A T - 0 0 11 -3,-0.1 2,-0.5 34,-0.1 -1,-0.2 -0.353 40.9-142.5 -80.0 158.0 29.8 25.1 54.5 26 38 A N + 0 0 14 228,-1.1 227,-3.0 33,-0.1 2,-0.3 -0.980 37.7 140.3-124.4 116.5 27.2 26.6 56.8 27 39 A Y E -BC 58 252A 13 31,-1.6 31,-2.4 -2,-0.5 2,-0.3 -0.959 39.0-153.1-151.7 168.4 28.1 27.0 60.5 28 40 A L E +BC 57 251A 71 223,-2.4 223,-1.9 -2,-0.3 2,-0.3 -0.878 28.1 173.5-148.0 103.5 27.9 29.1 63.6 29 41 A I E -BC 56 250A 0 27,-3.0 27,-2.9 -2,-0.3 2,-0.6 -0.894 33.6-126.7-120.1 148.3 30.7 28.7 66.2 30 42 A Y E -BC 55 249A 158 219,-2.6 219,-2.1 -2,-0.3 25,-0.2 -0.832 43.8-170.6 -88.9 121.3 31.7 30.5 69.4 31 43 A T E -BC 54 248A 10 23,-3.1 23,-0.7 -2,-0.6 2,-0.3 -0.637 28.6-157.9-115.1 174.9 35.3 31.5 69.0 32 44 A Q E -BC 53 247A 97 215,-1.8 215,-2.2 21,-0.2 2,-0.3 -0.943 17.8-154.6-151.1 116.3 38.4 32.9 70.8 33 45 A T E - C 0 246A 4 19,-3.0 213,-0.2 -2,-0.3 3,-0.2 -0.677 17.2-136.0 -96.4 153.6 41.2 34.6 68.9 34 46 A S S S+ 0 0 64 211,-1.7 2,-0.3 1,-0.3 -1,-0.1 0.853 92.0 11.7 -73.3 -37.7 44.8 34.9 70.0 35 47 A D S S- 0 0 76 210,-0.1 2,-0.5 17,-0.1 -1,-0.3 -0.993 70.9-143.5-145.4 133.8 45.1 38.5 69.0 36 48 A L - 0 0 9 -2,-0.3 2,-1.4 -3,-0.2 3,-0.2 -0.882 20.2-128.0-103.2 125.7 42.4 41.0 68.0 37 49 A N > + 0 0 11 -2,-0.5 4,-0.7 1,-0.2 205,-0.0 -0.554 45.2 152.9 -74.1 91.3 43.2 43.6 65.3 38 50 A K T 4 + 0 0 72 -2,-1.4 4,-0.2 2,-0.2 -1,-0.2 0.743 64.9 70.7 -87.4 -28.3 42.2 46.9 67.0 39 51 A E T >4 S+ 0 0 169 -3,-0.2 3,-0.5 1,-0.2 -1,-0.1 0.861 102.7 41.9 -55.5 -41.1 44.7 48.8 64.9 40 52 A A T 34 S+ 0 0 26 1,-0.2 3,-0.4 2,-0.1 -1,-0.2 0.842 120.3 41.6 -77.4 -36.1 42.6 48.3 61.8 41 53 A I T >< S+ 0 0 0 -4,-0.7 3,-2.0 1,-0.2 6,-0.2 0.126 77.3 118.1 -98.7 21.6 39.2 49.0 63.5 42 54 A A T < + 0 0 61 -3,-0.5 -1,-0.2 1,-0.3 5,-0.1 0.766 65.3 67.8 -57.4 -28.6 40.6 51.9 65.5 43 55 A S T 3 S+ 0 0 70 -3,-0.4 -1,-0.3 -4,-0.1 2,-0.2 0.672 82.2 93.4 -66.8 -19.7 38.1 54.2 63.8 44 56 A Y S X S- 0 0 31 -3,-2.0 3,-1.0 1,-0.1 4,-0.2 -0.524 78.9-133.1 -77.0 144.2 35.2 52.5 65.5 45 57 A D T 3 S+ 0 0 152 1,-0.2 3,-0.2 -2,-0.2 -1,-0.1 0.675 108.0 46.6 -70.1 -18.7 33.9 53.9 68.8 46 58 A W T > S+ 0 0 18 1,-0.1 3,-0.9 -5,-0.1 -1,-0.2 0.398 80.3 109.4-102.6 1.3 33.9 50.5 70.5 47 59 A A G X S+ 0 0 3 -3,-1.0 3,-1.0 1,-0.3 -1,-0.1 0.780 75.8 49.9 -46.3 -43.6 37.4 49.6 69.2 48 60 A E G 3 S+ 0 0 138 -4,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.831 108.6 51.9 -70.1 -32.2 39.1 49.8 72.6 49 61 A N G < S+ 0 0 88 -3,-0.9 2,-0.4 -4,-0.1 -1,-0.2 0.123 79.9 141.5 -91.2 21.6 36.6 47.6 74.3 50 62 A A < - 0 0 9 -3,-1.0 2,-0.2 -14,-0.1 -14,-0.1 -0.512 42.7-144.4 -71.0 121.3 36.9 44.9 71.7 51 63 A R - 0 0 114 -2,-0.4 39,-0.1 2,-0.2 -1,-0.0 -0.585 12.1-134.9 -85.6 147.9 36.8 41.4 73.2 52 64 A K S S+ 0 0 88 -2,-0.2 -19,-3.0 -16,-0.1 2,-0.5 0.494 86.5 82.3 -80.1 -3.3 38.9 38.5 71.8 53 65 A D E +B 32 0A 36 -21,-0.2 2,-0.3 2,-0.0 36,-0.3 -0.905 60.3 166.3-107.1 122.9 35.9 36.2 72.0 54 66 A E E -B 31 0A 5 -23,-0.7 -23,-3.1 -2,-0.5 2,-0.7 -0.964 40.9-118.9-138.5 153.4 33.5 36.3 69.1 55 67 A V E -BD 30 86A 8 31,-3.0 31,-2.2 -2,-0.3 2,-0.4 -0.820 38.2-166.4 -88.5 115.7 30.5 34.4 67.5 56 68 A K E +BD 29 85A 2 -27,-2.9 -27,-3.0 -2,-0.7 2,-0.3 -0.899 10.3 173.5-108.8 134.6 31.7 33.5 64.0 57 69 A F E -BD 28 84A 45 27,-2.0 27,-2.3 -2,-0.4 2,-0.4 -0.974 19.3-157.4-141.9 156.2 29.4 32.3 61.3 58 70 A Q E -BD 27 83A 6 -31,-2.4 -31,-1.6 -2,-0.3 2,-0.4 -0.998 4.6-171.6-134.8 128.8 29.3 31.3 57.6 59 71 A L E + D 0 82A 63 23,-2.2 23,-2.7 -2,-0.4 2,-0.3 -0.966 12.4 176.3-115.4 133.3 26.2 31.2 55.3 60 72 A S E + D 0 81A 0 -2,-0.4 -37,-1.1 21,-0.2 2,-0.3 -0.893 3.1 166.6-148.3 117.4 26.7 29.8 51.9 61 73 A L E -AD 22 80A 41 19,-2.4 19,-2.7 -2,-0.3 2,-0.4 -0.933 19.7-151.2-130.4 153.1 24.2 29.2 49.1 62 74 A A E -AD 21 79A 0 -41,-2.8 -41,-1.3 -2,-0.3 17,-0.3 -0.948 6.9-161.1-123.2 141.4 24.2 28.4 45.4 63 75 A F E - D 0 78A 70 15,-3.4 15,-1.4 -2,-0.4 2,-0.7 -0.955 14.5-141.2-127.4 109.2 21.4 29.4 43.0 64 76 A P E + D 0 77A 30 0, 0.0 13,-0.2 0, 0.0 3,-0.2 -0.605 23.4 176.8 -71.0 112.6 21.1 27.5 39.6 65 77 A L E S+ 0 0 98 11,-2.2 2,-0.2 -2,-0.7 12,-0.2 0.758 70.6 4.9 -87.6 -28.0 20.3 30.4 37.2 66 78 A W E > - D 0 76A 156 10,-1.5 10,-2.0 0, 0.0 3,-0.9 -0.700 69.4-152.9-163.4 102.4 20.2 28.3 34.0 67 79 A R E 3 S+ D 0 75A 83 1,-0.2 8,-0.2 8,-0.2 4,-0.1 -0.489 81.1 14.5 -77.6 146.8 20.7 24.5 33.8 68 80 A G T > S+ 0 0 37 6,-2.8 3,-1.3 -2,-0.2 -1,-0.2 0.679 76.7 144.6 64.5 20.5 22.1 22.9 30.6 69 81 A I T < S+ 0 0 48 -3,-0.9 -2,-0.1 1,-0.3 2,-0.1 0.851 81.1 27.1 -57.4 -38.6 23.4 26.3 29.3 70 82 A L T 3 S- 0 0 98 1,-0.5 -1,-0.3 0, 0.0 -2,-0.1 -0.485 135.6 -66.1-121.7 57.6 26.5 24.7 27.8 71 83 A G S X S- 0 0 35 -3,-1.3 3,-0.9 -4,-0.1 -1,-0.5 -0.170 87.4 -28.7 86.2 176.7 25.1 21.2 27.2 72 84 A P T 3 S+ 0 0 116 0, 0.0 3,-0.1 0, 0.0 -5,-0.0 -0.278 127.3 26.3 -64.1 152.1 24.0 18.5 29.7 73 85 A N T 3 S+ 0 0 99 1,-0.2 38,-2.5 37,-0.1 2,-0.3 0.714 101.3 108.3 67.2 22.9 25.6 18.5 33.1 74 86 A S E < - 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