==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER MEMBRANE PROTEIN 08-AUG-12 4B61 . COMPND 2 MOLECULE: ALGINATE PRODUCTION PROTEIN ALGE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA PAO1; . AUTHOR J.TAN,V.E.PYE,D.ARAGAO,M.CAFFREY . 868 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 38530.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 630 72.6 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 . 456 52.5 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 . 6 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 12 1.4 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 0.1 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 . 66 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 54 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 9 1.0 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 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 . 4 4 0 2 2 2 2 0 6 5 10 5 0 2 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 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 39 A P 0 0 136 0, 0.0 2,-0.3 0, 0.0 41,-0.1 0.000 360.0 360.0 360.0 117.8 -53.9 -14.6 -58.5 2 40 A K - 0 0 110 1,-0.1 3,-0.1 39,-0.1 0, 0.0 -0.531 360.0-163.1 -78.2 125.9 -55.1 -17.3 -56.2 3 41 A N + 0 0 85 -2,-0.3 37,-2.8 1,-0.2 2,-0.3 0.658 65.7 8.6 -91.2 -15.0 -57.9 -16.0 -54.0 4 42 A F E +A 39 0A 145 35,-0.3 2,-0.3 2,-0.0 35,-0.2 -0.984 61.0 159.7-159.6 157.4 -58.0 -18.6 -51.2 5 43 A G E -A 38 0A 17 33,-1.8 33,-2.1 -2,-0.3 2,-0.3 -0.925 28.1-125.4-161.9-175.4 -56.1 -21.6 -50.0 6 44 A L E -A 37 0A 61 425,-1.9 425,-2.5 -2,-0.3 2,-0.5 -0.950 11.7-156.2-147.5 123.4 -55.5 -23.9 -47.0 7 45 A D E -AB 36 430A 26 29,-2.3 29,-3.2 -2,-0.3 2,-0.5 -0.899 12.8-166.0 -99.4 128.6 -52.1 -24.7 -45.5 8 46 A V E -AB 35 429A 22 421,-2.6 421,-2.5 -2,-0.5 2,-0.4 -0.961 7.5-178.4-118.2 124.9 -52.1 -28.0 -43.6 9 47 A K E -AB 34 428A 24 25,-2.7 25,-3.1 -2,-0.5 2,-0.5 -0.984 13.9-167.1-127.4 131.9 -49.3 -28.8 -41.2 10 48 A I E -AB 33 427A 68 417,-2.4 417,-2.5 -2,-0.4 2,-0.4 -0.978 18.4-174.9-110.5 126.8 -48.6 -31.9 -39.1 11 49 A T E -AB 32 426A 0 21,-2.5 21,-2.6 -2,-0.5 2,-0.4 -0.965 16.0-168.8-125.3 136.4 -45.9 -31.4 -36.5 12 50 A G E -AB 31 425A 24 413,-2.2 413,-1.8 -2,-0.4 2,-0.4 -0.970 12.8-166.1-112.4 141.3 -44.3 -33.8 -34.1 13 51 A E E -AB 30 424A 10 17,-2.6 17,-2.2 -2,-0.4 2,-0.5 -0.991 10.6-171.8-128.8 131.9 -42.0 -32.4 -31.3 14 52 A S E +AB 29 423A 32 409,-2.9 409,-2.8 -2,-0.4 2,-0.4 -0.982 14.3 169.3-118.1 120.8 -39.6 -34.2 -29.1 15 53 A E E -AB 28 422A 7 13,-2.1 13,-3.2 -2,-0.5 407,-0.2 -0.998 9.9-170.0-134.3 131.1 -38.1 -32.2 -26.2 16 54 A N E - B 0 421A 79 405,-2.5 405,-2.6 -2,-0.4 11,-0.1 -0.714 65.0 -13.1-170.9 110.6 -36.0 -33.6 -23.3 17 55 A D > + 0 0 18 403,-0.3 3,-2.6 -2,-0.2 10,-0.2 0.420 49.8 174.1-130.5 125.9 -35.3 -32.0 -21.1 18 56 A R T 3 S+ 0 0 63 8,-2.0 351,-2.2 1,-0.3 8,-0.1 0.784 95.9 42.4 -53.9 -32.9 -35.7 -28.2 -21.2 19 57 A D T > S- 0 0 11 6,-0.3 3,-2.1 349,-0.2 -1,-0.3 0.235 112.8-116.4-100.8 13.5 -34.8 -27.9 -17.5 20 58 A L T < S- 0 0 0 -3,-2.6 397,-2.5 1,-0.3 -2,-0.1 0.730 71.7 -60.5 61.1 24.8 -31.9 -30.4 -17.8 21 59 A G T 3 S+ 0 0 38 4,-0.2 -1,-0.3 395,-0.2 -3,-0.1 0.435 115.3 111.2 86.6 4.0 -33.8 -32.6 -15.3 22 60 A T S < S+ 0 0 83 -3,-2.1 -2,-0.1 -5,-0.1 348,-0.1 0.839 75.8 33.3 -80.9 -32.6 -33.9 -30.1 -12.5 23 61 A A S S- 0 0 50 2,-0.2 -4,-0.2 346,-0.1 -2,-0.2 -0.729 95.5 -85.6-117.9 169.6 -37.6 -29.2 -12.4 24 62 A P S S- 0 0 130 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.402 90.2 -8.6 -75.3 154.8 -40.7 -31.2 -13.1 25 63 A G + 0 0 50 1,-0.1 -6,-0.3 -2,-0.1 -4,-0.2 -0.123 63.1 135.9 58.7-156.2 -42.0 -31.5 -16.7 26 64 A G + 0 0 32 1,-0.4 -8,-2.0 -8,-0.1 2,-0.3 0.560 52.0 107.9 86.3 8.6 -40.4 -29.5 -19.4 27 65 A T - 0 0 62 -10,-0.2 -1,-0.4 -11,-0.1 2,-0.3 -0.832 50.1-156.8-115.3 166.7 -40.3 -32.3 -21.8 28 66 A L E +A 15 0A 20 -13,-3.2 -13,-2.1 -2,-0.3 2,-0.1 -0.992 26.9 158.8-136.9 140.0 -42.2 -33.2 -25.0 29 67 A N E +A 14 0A 132 -2,-0.3 2,-0.3 -15,-0.2 -15,-0.2 -0.485 48.0 119.7-154.4 83.3 -43.1 -36.2 -27.0 30 68 A D E -A 13 0A 40 -17,-2.2 -17,-2.6 -2,-0.1 2,-0.3 -0.859 46.8-141.2-151.4 167.9 -46.2 -35.2 -29.0 31 69 A I E +A 12 0A 96 -2,-0.3 27,-2.4 -19,-0.3 2,-0.3 -0.950 20.1 171.4-139.7 150.5 -47.9 -34.5 -32.3 32 70 A G E -AC 11 57A 8 -21,-2.6 -21,-2.5 -2,-0.3 2,-0.4 -0.986 25.1-128.9-155.4 166.2 -50.3 -31.9 -33.7 33 71 A I E -AC 10 56A 65 23,-2.8 23,-2.1 -2,-0.3 2,-0.4 -0.942 15.8-165.6-119.9 145.6 -52.1 -30.6 -36.7 34 72 A D E -AC 9 55A 1 -25,-3.1 -25,-2.7 -2,-0.4 2,-0.5 -0.978 4.3-167.2-135.5 117.3 -52.2 -26.9 -37.7 35 73 A L E -AC 8 54A 61 19,-3.9 19,-2.8 -2,-0.4 -27,-0.2 -0.921 4.1-175.3-112.9 127.0 -54.7 -25.7 -40.3 36 74 A R E -A 7 0A 35 -29,-3.2 -29,-2.3 -2,-0.5 2,-0.2 -0.796 2.9-170.6-126.3 88.8 -54.3 -22.3 -41.9 37 75 A P E -A 6 0A 63 0, 0.0 15,-2.3 0, 0.0 2,-0.3 -0.554 16.4-170.6 -69.3 141.7 -57.1 -21.1 -44.2 38 76 A W E -AD 5 51A 26 -33,-2.1 -33,-1.8 13,-0.2 2,-0.4 -0.961 17.0-161.8-137.4 159.2 -56.2 -18.0 -46.1 39 77 A A E -AD 4 50A 29 11,-2.5 11,-2.2 -2,-0.3 2,-0.4 -0.992 9.7-178.2-138.1 140.0 -57.9 -15.4 -48.3 40 78 A F E - D 0 49A 49 -37,-2.8 2,-0.3 -2,-0.4 9,-0.2 -0.998 2.7-179.2-143.6 137.5 -56.3 -12.9 -50.7 41 79 A G E - D 0 48A 12 7,-2.1 7,-2.0 -2,-0.4 2,-0.4 -0.973 5.5-166.2-132.3 151.2 -57.7 -10.2 -53.0 42 80 A Q E + D 0 47A 106 -2,-0.3 2,-0.3 5,-0.2 5,-0.3 -0.993 10.8 172.6-142.3 131.8 -56.1 -7.8 -55.3 43 81 A W E > - D 0 46A 163 3,-2.8 3,-2.1 -2,-0.4 2,-0.1 -0.886 65.6 -60.2-141.5 102.9 -57.5 -4.7 -57.0 44 82 A G T 3 S- 0 0 68 -2,-0.3 -1,-0.1 1,-0.3 45,-0.0 -0.380 121.9 -9.7 53.3-123.9 -55.0 -2.6 -58.9 45 83 A D T 3 S+ 0 0 85 -2,-0.1 44,-2.7 -3,-0.1 2,-0.3 0.544 125.4 84.3 -80.7 -7.0 -52.3 -1.3 -56.5 46 84 A W E < +DE 43 88A 134 -3,-2.1 -3,-2.8 42,-0.2 2,-0.3 -0.699 49.4 163.4 -99.0 150.1 -54.3 -2.6 -53.5 47 85 A S E -DE 42 87A 8 40,-1.9 40,-3.2 -2,-0.3 2,-0.3 -0.965 14.8-160.4-152.3 166.4 -54.5 -6.0 -51.9 48 86 A A E -DE 41 86A 24 -7,-2.0 -7,-2.1 -2,-0.3 2,-0.3 -0.989 6.4-168.4-151.1 151.3 -55.6 -7.5 -48.7 49 87 A Y E -DE 40 85A 39 36,-2.2 36,-2.2 -2,-0.3 2,-0.4 -0.998 8.0-174.6-147.7 144.3 -55.0 -10.8 -46.9 50 88 A F E +DE 39 84A 97 -11,-2.2 -11,-2.5 -2,-0.3 2,-0.4 -0.996 3.4 180.0-136.0 134.9 -56.3 -12.8 -44.0 51 89 A M E -DE 38 83A 9 32,-2.6 31,-2.0 -2,-0.4 32,-1.6 -0.987 6.2-175.6-131.3 130.8 -54.9 -16.0 -42.6 52 90 A G E - E 0 81A 6 -15,-2.3 2,-0.3 -2,-0.4 29,-0.2 -0.458 11.2-144.2-107.3-174.3 -56.5 -17.8 -39.7 53 91 A Q E - E 0 80A 14 27,-1.9 27,-2.6 -17,-0.2 2,-0.4 -0.968 13.6-172.1-158.4 132.4 -55.2 -20.8 -37.8 54 92 A A E -CE 35 79A 29 -19,-2.8 -19,-3.9 -2,-0.3 2,-0.4 -0.999 15.8-176.4-128.7 132.0 -56.7 -23.9 -36.1 55 93 A V E +CE 34 78A 10 23,-2.2 23,-1.3 -2,-0.4 2,-0.4 -0.972 13.6 178.3-130.9 137.2 -54.5 -26.2 -34.1 56 94 A A E +CE 33 77A 46 -23,-2.1 -23,-2.8 -2,-0.4 2,-0.3 -0.968 19.2 160.5-136.5 126.3 -55.1 -29.5 -32.3 57 95 A A E -C 32 0A 17 19,-1.0 -25,-0.2 -2,-0.4 3,-0.1 -0.936 50.7-119.2-142.2 162.7 -52.3 -31.2 -30.5 58 96 A T S S- 0 0 74 -27,-2.4 2,-0.3 -2,-0.3 -26,-0.1 0.645 100.7 -3.6 -76.4 -16.4 -51.6 -33.9 -27.8 59 97 A D S S- 0 0 52 -28,-0.3 2,-2.2 17,-0.2 -1,-0.1 -0.938 99.1 -67.5-161.0-178.4 -49.8 -31.2 -25.8 60 98 A T S S+ 0 0 69 -2,-0.3 2,-0.1 14,-0.1 16,-0.1 -0.468 70.2 162.9 -83.5 76.7 -48.7 -27.6 -26.1 61 99 A I - 0 0 21 -2,-2.2 2,-0.8 15,-0.2 3,-0.1 -0.404 46.0-101.4 -92.5 167.7 -46.2 -28.0 -28.9 62 100 A E + 0 0 30 1,-0.2 3,-0.1 -2,-0.1 -1,-0.1 -0.805 46.0 158.9 -90.9 107.3 -44.6 -25.4 -31.1 63 101 A T + 0 0 5 -2,-0.8 2,-0.4 1,-0.2 -1,-0.2 0.488 69.3 49.8-101.4 -5.3 -46.3 -25.5 -34.5 64 102 A D > - 0 0 16 -3,-0.1 3,-1.9 1,-0.1 -1,-0.2 -0.953 66.5-156.1-136.8 111.8 -45.3 -22.0 -35.5 65 103 A T T 3 S+ 0 0 37 -2,-0.4 -1,-0.1 1,-0.3 241,-0.0 0.695 97.1 55.3 -58.9 -21.2 -41.6 -21.0 -35.2 66 104 A L T 3 0 0 11 -3,-0.0 51,-0.4 50,-0.0 -1,-0.3 0.371 360.0 360.0 -95.1 9.5 -42.7 -17.3 -34.9 67 105 A Q < 0 0 152 -3,-1.9 -2,-0.1 49,-0.1 -5,-0.0 0.906 360.0 360.0 61.3 360.0 -45.1 -18.0 -32.0 68 ! 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 69 116 A N > 0 0 74 0, 0.0 3,-1.7 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 133.0 -51.5 -16.5 -15.1 70 117 A D G > + 0 0 126 1,-0.3 3,-1.4 2,-0.2 78,-0.2 0.911 360.0 60.5 -53.7 -47.3 -54.8 -17.9 -16.4 71 118 A G G 3 S+ 0 0 3 1,-0.2 78,-1.2 76,-0.1 77,-0.4 0.606 108.6 41.3 -56.0 -20.4 -54.5 -15.4 -19.1 72 119 A R G < S+ 0 0 81 -3,-1.7 -1,-0.2 75,-0.1 -2,-0.2 0.022 81.3 105.2-123.0 28.5 -51.3 -16.8 -20.4 73 120 A E < - 0 0 106 -3,-1.4 2,-0.0 73,-0.3 0, 0.0 -0.968 63.6-142.3-100.0 115.4 -51.6 -20.6 -20.2 74 121 A P - 0 0 62 0, 0.0 2,-0.2 0, 0.0 -14,-0.1 -0.347 10.6-127.2 -72.8 156.5 -52.1 -21.9 -23.8 75 122 A D - 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