==== 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 09-JUL-99 1QD6 . COMPND 2 MOLECULE: OUTER MEMBRANE PHOSPHOLIPASE (OMPLA); . SOURCE 2 SYNTHETIC: YES; . AUTHOR H.J.SNIJDER,I.UBARRETXENA-BELANDIA,M.BLAAUW,K.H.KALK,H.M.VER . 505 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20979.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 373 73.9 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 . 269 53.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 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 0.2 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 . 32 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 51 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 18 3.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 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 2 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 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 . 3 2 0 2 2 2 6 1 2 5 0 4 2 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 2 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 0 108 0, 0.0 11,-0.1 0, 0.0 2,-0.0 0.000 360.0 360.0 360.0 154.4 -20.7 9.1 36.0 2 14 A V - 0 0 63 6,-0.0 2,-0.7 2,-0.0 3,-0.1 0.336 360.0-112.0 98.1 131.8 -18.3 9.7 38.9 3 15 A R S S+ 0 0 108 1,-0.2 3,-0.1 265,-0.1 265,-0.0 -0.811 95.3 3.8 -99.7 112.0 -15.5 12.3 39.2 4 16 A G S S+ 0 0 21 -2,-0.7 2,-0.8 1,-0.2 -1,-0.2 0.175 87.1 134.7 104.6 -16.9 -11.9 11.0 39.2 5 17 A S > - 0 0 7 1,-0.2 4,-1.5 -3,-0.1 -1,-0.2 -0.581 32.1-174.5 -73.9 108.4 -12.8 7.3 38.6 6 18 A I H > S+ 0 0 20 -2,-0.8 4,-2.1 2,-0.2 -1,-0.2 0.926 86.8 47.4 -62.9 -46.3 -10.4 5.9 36.0 7 19 A I H > S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.922 108.5 52.2 -66.0 -45.1 -12.3 2.5 36.0 8 20 A A H > S+ 0 0 13 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.886 110.6 50.4 -58.8 -36.9 -15.8 4.0 35.8 9 21 A N H >< S+ 0 0 59 -4,-1.5 3,-1.1 1,-0.2 -1,-0.2 0.934 108.2 51.6 -66.9 -44.8 -14.7 6.0 32.8 10 22 A M H 3< S+ 0 0 1 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.797 104.7 57.1 -60.7 -32.6 -13.2 2.9 31.1 11 23 A L H 3< S+ 0 0 36 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.725 95.3 88.6 -70.3 -22.1 -16.6 1.1 31.6 12 24 A Q << 0 0 106 -3,-1.1 -3,-0.0 -4,-0.7 0, 0.0 -0.252 360.0 360.0 -73.6 161.2 -18.3 3.9 29.7 13 25 A E 0 0 146 -2,-0.0 -3,-0.0 0, 0.0 -2,-0.0 -0.823 360.0 360.0-158.9 360.0 -18.7 4.0 25.9 14 !* 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 15 13 B A 0 0 114 0, 0.0 2,-0.2 0, 0.0 11,-0.0 0.000 360.0 360.0 360.0 121.5 -20.4 12.7 12.8 16 14 B V - 0 0 59 6,-0.0 2,-0.4 7,-0.0 357,-0.0 -0.665 360.0-117.9 149.6 164.0 -17.8 11.6 10.2 17 15 B R S S+ 0 0 89 -2,-0.2 3,-0.1 491,-0.1 490,-0.0 -0.895 94.9 0.0-133.4 102.0 -15.4 8.7 9.7 18 16 B G S S+ 0 0 24 -2,-0.4 2,-0.9 1,-0.2 3,-0.1 0.167 88.1 133.0 108.5 -16.9 -11.7 9.6 9.5 19 17 B S > - 0 0 5 1,-0.2 4,-1.6 2,-0.1 -1,-0.2 -0.586 32.0-175.4 -74.4 106.6 -12.1 13.3 10.1 20 18 B I H > S+ 0 0 21 -2,-0.9 4,-2.2 2,-0.2 -1,-0.2 0.922 86.1 47.1 -62.7 -45.1 -9.6 14.4 12.7 21 19 B I H > S+ 0 0 0 2,-0.2 4,-1.5 1,-0.2 5,-0.2 0.928 108.6 51.9 -67.0 -47.6 -11.0 17.9 12.7 22 20 B A H > S+ 0 0 18 1,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.873 112.0 48.9 -56.6 -37.2 -14.7 17.0 12.9 23 21 B N H >< S+ 0 0 40 -4,-1.6 3,-1.3 1,-0.2 -1,-0.2 0.928 107.7 54.1 -67.4 -45.4 -13.8 14.8 15.9 24 22 B M H 3< S+ 0 0 0 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.729 102.5 57.7 -59.2 -28.5 -11.9 17.7 17.5 25 23 B L H 3< S+ 0 0 44 -4,-1.5 2,-0.3 -3,-0.2 -1,-0.3 0.664 84.4 102.8 -76.1 -20.1 -14.9 20.0 17.2 26 24 B Q << 0 0 97 -3,-1.3 -3,-0.0 -4,-0.5 -4,-0.0 -0.528 360.0 360.0 -68.0 125.3 -17.0 17.5 19.3 27 25 B E 0 0 187 -2,-0.3 -1,-0.1 2,-0.0 -4,-0.0 0.992 360.0 360.0 -65.7 360.0 -17.4 18.7 22.9 28 !* 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 29 30 C F 0 0 101 0, 0.0 243,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 134.5 -15.0 10.1 22.4 30 31 C T + 0 0 37 241,-0.7 2,-0.4 1,-0.3 242,-0.2 0.843 360.0 40.1-117.0 -52.7 -12.0 7.9 21.2 31 32 C L B -A 271 0A 8 240,-2.0 240,-0.8 43,-0.0 -1,-0.3 -0.866 64.1-140.2-113.0 145.2 -9.1 7.6 23.7 32 33 C Y E -B 73 0B 7 41,-0.7 41,-2.6 -2,-0.4 2,-0.3 -0.788 12.1-138.7-102.5 136.5 -9.1 7.1 27.5 33 34 C P E -B 72 0B 12 0, 0.0 39,-0.3 0, 0.0 3,-0.1 -0.674 16.3-177.8 -90.3 150.8 -6.7 8.8 29.9 34 35 C Y + 0 0 17 37,-1.3 38,-0.1 -2,-0.3 39,-0.1 0.673 69.8 4.1-103.1 -82.1 -5.2 7.0 32.9 35 36 C D S S- 0 0 22 1,-0.2 -1,-0.2 56,-0.1 36,-0.2 0.023 106.2 -56.4 -86.7-163.3 -3.0 9.4 34.9 36 37 C T - 0 0 10 34,-0.1 2,-0.5 -3,-0.1 -1,-0.2 -0.400 42.1-145.1 -80.3 155.2 -2.6 13.1 34.1 37 38 C N + 0 0 3 228,-1.0 227,-3.0 33,-0.1 228,-0.4 -0.987 36.3 145.7-122.2 118.5 -1.5 14.5 30.8 38 39 C Y E -CD 69 263B 9 31,-1.6 31,-2.2 -2,-0.5 2,-0.4 -0.979 38.2-153.8-151.2 162.2 0.6 17.7 30.9 39 40 C L E +CD 68 262B 86 223,-2.4 223,-2.7 -2,-0.3 2,-0.3 -0.972 29.4 166.4-138.9 116.2 3.4 19.7 29.4 40 41 C I E -CD 67 261B 3 27,-3.2 27,-2.4 -2,-0.4 2,-0.5 -0.890 34.7-126.6-130.1 160.3 5.3 22.1 31.7 41 42 C Y E -CD 66 260B 103 219,-3.2 219,-2.1 -2,-0.3 2,-0.3 -0.952 40.4-172.6-105.5 131.4 8.5 24.1 31.7 42 43 C T E -CD 65 259B 4 23,-3.1 23,-1.6 -2,-0.5 2,-0.4 -0.782 29.1-156.5-128.4 166.2 10.7 23.5 34.7 43 44 C Q E -CD 64 258B 98 215,-2.2 215,-1.9 -2,-0.3 2,-0.3 -0.975 19.0-155.1-140.7 118.4 13.8 24.4 36.7 44 45 C T E - D 0 257B 3 19,-2.6 213,-0.2 -2,-0.4 3,-0.2 -0.668 21.0-129.1 -94.0 154.3 15.5 21.9 39.0 45 46 C S S S+ 0 0 67 211,-2.0 2,-0.3 1,-0.3 -1,-0.1 0.874 93.3 0.8 -65.7 -38.9 17.6 22.9 42.0 46 47 C D S S- 0 0 78 210,-0.1 2,-0.4 17,-0.1 -1,-0.3 -0.974 70.2-133.6-154.7 135.5 20.4 20.6 40.9 47 48 C L - 0 0 8 -2,-0.3 2,-2.0 -3,-0.2 3,-0.2 -0.796 23.3-125.0 -96.6 133.6 20.9 18.3 37.9 48 49 C N > + 0 0 13 -2,-0.4 4,-0.7 1,-0.2 3,-0.1 -0.480 44.1 158.5 -77.4 75.1 22.2 14.8 38.4 49 50 C K T 4 + 0 0 88 -2,-2.0 3,-0.2 1,-0.2 -1,-0.2 0.797 65.4 66.4 -69.4 -28.9 25.2 14.9 36.1 50 51 C E T >4 S+ 0 0 168 1,-0.2 3,-1.9 -3,-0.2 4,-0.2 0.951 99.3 47.5 -56.2 -55.2 26.9 12.1 37.9 51 52 C A T 34 S+ 0 0 24 1,-0.3 3,-0.3 2,-0.1 -1,-0.2 0.779 118.9 42.7 -59.9 -25.6 24.4 9.4 37.0 52 53 C I T >< S+ 0 0 3 -4,-0.7 3,-1.8 -3,-0.2 -1,-0.3 0.083 72.3 121.3-113.3 22.8 24.5 10.5 33.4 53 54 C A T < + 0 0 72 -3,-1.9 6,-0.2 1,-0.3 -1,-0.2 0.776 64.8 72.7 -59.7 -24.2 28.3 11.0 33.0 54 55 C S T 3 S+ 0 0 70 -3,-0.3 2,-0.4 -4,-0.2 -1,-0.3 0.755 79.5 82.5 -61.4 -32.9 28.2 8.4 30.2 55 56 C Y S X S- 0 0 28 -3,-1.8 3,-1.4 1,-0.1 4,-0.3 -0.665 80.4-138.3 -77.9 132.7 26.5 10.9 27.8 56 57 C D G > S+ 0 0 91 -2,-0.4 3,-0.5 1,-0.3 -1,-0.1 0.819 101.7 51.1 -60.6 -34.8 29.1 13.2 26.2 57 58 C W G > S+ 0 0 8 1,-0.2 3,-1.7 2,-0.1 -1,-0.3 0.512 82.9 95.6 -81.5 -6.8 26.9 16.3 26.6 58 59 C A G X S+ 0 0 3 -3,-1.4 3,-2.2 -6,-0.3 -1,-0.2 0.829 72.9 63.3 -57.1 -39.6 26.2 15.6 30.3 59 60 C E G < S+ 0 0 141 -3,-0.5 -1,-0.3 -4,-0.3 -2,-0.1 0.755 108.8 43.6 -57.3 -23.4 29.0 18.0 31.5 60 61 C N G < S+ 0 0 68 -3,-1.7 -1,-0.3 -4,-0.1 -2,-0.2 0.122 83.7 141.8-109.6 18.7 27.1 20.8 29.9 61 62 C A < - 0 0 13 -3,-2.2 2,-0.2 1,-0.1 -14,-0.1 -0.318 41.3-140.0 -61.7 139.9 23.6 19.8 31.1 62 63 C R - 0 0 111 2,-0.2 39,-0.1 1,-0.1 -1,-0.1 -0.654 12.6-129.1-103.0 161.5 21.3 22.7 32.2 63 64 C K S S+ 0 0 91 -2,-0.2 -19,-2.6 -16,-0.1 2,-0.5 0.619 86.2 82.1 -84.6 -16.1 18.9 22.9 35.1 64 65 C D E +C 43 0B 24 -21,-0.2 36,-0.4 34,-0.0 2,-0.3 -0.822 58.6 162.1 -97.0 128.3 15.9 24.1 33.0 65 66 C E E -C 42 0B 0 -23,-1.6 -23,-3.1 -2,-0.5 2,-0.5 -0.973 41.5-117.0-142.5 150.7 14.0 21.4 31.2 66 67 C V E -CE 41 97B 9 31,-2.7 31,-2.9 -2,-0.3 2,-0.4 -0.793 34.2-166.2 -83.8 128.4 10.6 20.7 29.6 67 68 C K E +CE 40 96B 1 -27,-2.4 -27,-3.2 -2,-0.5 2,-0.3 -0.969 12.5 167.9-117.1 133.6 8.8 18.0 31.5 68 69 C F E -CE 39 95B 17 27,-1.6 27,-2.4 -2,-0.4 2,-0.4 -0.997 17.9-159.6-146.0 151.4 5.8 16.2 30.0 69 70 C Q E -CE 38 94B 0 -31,-2.2 -31,-1.6 -2,-0.3 2,-0.4 -0.991 1.5-169.1-131.3 135.8 3.7 13.2 30.8 70 71 C L E + E 0 93B 20 23,-2.1 23,-3.1 -2,-0.4 2,-0.4 -0.988 11.9 179.0-120.5 133.9 1.4 11.2 28.6 71 72 C S E + E 0 92B 0 -2,-0.4 -37,-1.3 21,-0.2 2,-0.3 -0.915 1.1 175.9-143.7 113.9 -0.9 8.7 30.2 72 73 C L E -BE 33 91B 8 19,-2.5 19,-2.3 -2,-0.4 2,-0.4 -0.871 16.3-152.2-117.9 150.7 -3.4 6.5 28.4 73 74 C A E -BE 32 90B 2 -41,-2.6 -41,-0.7 -2,-0.3 17,-0.3 -0.952 7.8-162.0-118.8 141.3 -5.8 3.7 29.5 74 75 C F E - 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