==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 27-JUN-12 4FT6 . COMPND 2 MOLECULE: PROBABLE PORIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR E.EREN,B.VAN DEN BERG . 387 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18404.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 282 72.9 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 . 221 57.1 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 . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 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 . 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 . 27 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 3 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 2 0 1 0 0 0 2 3 4 3 1 2 2 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 0 1 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 E 0 0 104 0, 0.0 48,-0.2 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 65.3 -39.6 -2.8 -4.8 2 2 A G + 0 0 19 46,-0.1 2,-5.4 1,-0.1 46,-0.1 -0.573 360.0 63.9 97.8-171.3 -40.5 -0.9 -7.9 3 3 A F S S+ 0 0 87 44,-0.9 43,-3.2 1,-0.3 45,-0.1 -0.096 116.8 40.7 53.5 -56.6 -41.7 -2.4 -11.2 4 4 A I S S+ 0 0 114 -2,-5.4 -1,-0.3 41,-0.2 44,-0.0 0.476 113.5 57.8 -91.3 -6.7 -44.7 -3.7 -9.3 5 5 A E S S+ 0 0 68 1,-0.1 -1,-0.1 3,-0.0 -2,-0.1 0.763 110.5 36.6 -98.0 -30.3 -45.0 -0.4 -7.3 6 6 A D S S+ 0 0 117 41,-0.1 2,-0.2 2,-0.0 -1,-0.1 0.205 93.4 120.9-103.9 11.4 -45.5 2.1 -10.2 7 7 A A - 0 0 46 -5,-0.1 2,-0.3 36,-0.0 38,-0.2 -0.485 40.1-175.8 -75.3 145.3 -47.5 -0.4 -12.2 8 8 A S E -A 44 0A 60 36,-2.2 36,-3.1 -2,-0.2 2,-0.4 -0.995 15.8-167.3-139.6 149.9 -51.0 0.5 -13.2 9 9 A V E +A 43 0A 52 378,-0.5 378,-3.2 -2,-0.3 2,-0.3 -0.991 14.3 176.5-131.8 127.1 -53.9 -1.2 -15.0 10 10 A S E -AB 42 386A 32 32,-2.4 32,-2.5 -2,-0.4 2,-0.5 -0.959 20.4-151.7-128.3 149.9 -57.0 0.7 -16.2 11 11 A L E -AB 41 385A 41 374,-3.3 374,-3.2 -2,-0.3 2,-0.5 -0.952 16.1-156.0-119.5 107.9 -60.1 -0.4 -18.2 12 12 A G E -AB 40 384A 18 28,-3.0 28,-2.6 -2,-0.5 2,-0.5 -0.723 6.1-161.6 -88.4 130.2 -61.5 2.4 -20.3 13 13 A L E +AB 39 383A 43 370,-3.0 370,-1.6 -2,-0.5 2,-0.4 -0.940 11.0 177.1-114.2 127.6 -65.2 2.2 -21.2 14 14 A R E -AB 38 382A 57 24,-2.1 24,-3.3 -2,-0.5 2,-0.6 -0.939 10.3-170.7-133.7 112.5 -66.7 4.1 -24.0 15 15 A N E -AB 37 381A 37 366,-2.2 366,-2.9 -2,-0.4 2,-0.5 -0.907 21.1-171.9 -97.4 123.5 -70.4 3.8 -25.1 16 16 A L E -AB 36 380A 5 20,-3.2 20,-2.5 -2,-0.6 2,-0.5 -0.965 23.7-173.6-130.9 125.8 -70.8 5.7 -28.3 17 17 A Y E -AB 35 379A 67 362,-2.6 362,-2.3 -2,-0.5 2,-0.4 -0.977 18.2-174.9-110.5 125.4 -73.9 6.6 -30.4 18 18 A F E +AB 34 378A 0 16,-2.9 16,-2.0 -2,-0.5 2,-0.3 -0.976 10.8 173.4-126.7 132.5 -72.9 8.3 -33.7 19 19 A N E +AB 33 377A 27 358,-2.5 358,-2.2 -2,-0.4 2,-0.7 -0.820 4.3 179.8-145.1 96.4 -75.2 9.7 -36.3 20 20 A R E -AB 32 376A 40 12,-2.8 12,-2.6 -2,-0.3 2,-0.6 -0.894 15.2-160.9 -97.6 116.1 -74.0 11.6 -39.3 21 21 A D E -AB 31 375A 57 354,-3.5 354,-1.9 -2,-0.7 2,-0.5 -0.870 7.3-148.8-104.2 116.4 -76.9 12.8 -41.4 22 22 A F E - B 0 374A 40 8,-1.5 352,-0.2 -2,-0.6 5,-0.1 -0.724 9.4-167.2 -83.3 126.2 -76.2 13.7 -45.0 23 23 A R + 0 0 62 350,-1.9 -1,-0.2 -2,-0.5 351,-0.1 0.898 58.2 84.1 -84.5 -44.0 -78.7 16.5 -46.1 24 24 A Q S S- 0 0 88 349,-0.5 2,-0.3 2,-0.1 3,-0.1 -0.381 78.8-114.0 -63.8 130.1 -78.3 16.6 -49.9 25 25 A P S S+ 0 0 126 0, 0.0 -2,-0.0 0, 0.0 5,-0.0 -0.887 95.2 34.5-105.9 151.4 -80.4 14.1 -51.9 26 26 A G + 0 0 81 -2,-0.3 3,-0.1 0, 0.0 -2,-0.1 0.454 68.3 155.4 -84.4 129.7 -79.7 11.9 -53.5 27 27 A A - 0 0 40 1,-0.2 2,-3.7 -5,-0.1 -3,-0.1 0.212 46.3-138.2 -95.4 14.9 -76.8 11.1 -51.2 28 28 A A S S+ 0 0 116 2,-0.1 2,-0.6 0, 0.0 -1,-0.2 -0.317 97.5 46.2 53.7 -68.0 -76.8 7.4 -52.3 29 29 A Q S S- 0 0 45 -2,-3.7 3,-0.1 1,-0.1 -7,-0.1 -0.897 75.0-168.8 -96.5 122.1 -76.2 6.8 -48.5 30 30 A S + 0 0 79 -2,-0.6 -8,-1.5 41,-0.3 2,-0.3 0.737 61.8 2.7 -79.6 -23.3 -78.6 8.9 -46.4 31 31 A K E -A 21 0A 70 40,-0.5 2,-0.5 -10,-0.2 43,-0.2 -0.998 44.7-143.0-165.5 143.1 -77.0 8.4 -43.0 32 32 A Q E +A 20 0A 26 -12,-2.6 -12,-2.8 -2,-0.3 2,-0.4 -0.959 38.6 161.3-111.8 108.0 -74.3 6.9 -40.9 33 33 A E E +A 19 0A 39 39,-1.8 36,-0.3 -2,-0.5 2,-0.3 -0.883 7.0 147.9-132.6 105.4 -76.0 5.8 -37.7 34 34 A E E -A 18 0A 1 -16,-2.0 -16,-2.9 -2,-0.4 2,-0.4 -0.892 29.4-154.2-133.5 162.6 -74.3 3.3 -35.4 35 35 A W E +AC 17 67A 103 32,-2.0 31,-2.7 -2,-0.3 32,-2.1 -0.987 24.7 162.4-140.1 128.4 -74.0 2.5 -31.7 36 36 A A E -AC 16 65A 0 -20,-2.5 -20,-3.2 -2,-0.4 2,-0.5 -0.958 31.2-136.3-148.0 156.6 -71.1 0.6 -30.1 37 37 A Q E -AC 15 64A 29 27,-2.1 27,-2.4 -2,-0.3 2,-0.3 -0.979 23.6-163.0-120.1 126.9 -69.4 -0.2 -26.8 38 38 A G E -AC 14 63A 1 -24,-3.3 -24,-2.1 -2,-0.5 2,-0.4 -0.829 7.6-159.9-112.8 148.3 -65.6 0.0 -26.6 39 39 A F E -AC 13 62A 57 23,-2.7 23,-1.7 -2,-0.3 2,-0.5 -0.994 4.2-166.8-124.6 131.2 -63.1 -1.4 -24.0 40 40 A L E -AC 12 61A 35 -28,-2.6 -28,-3.0 -2,-0.4 2,-0.6 -0.903 2.9-167.1-124.3 105.2 -59.6 -0.1 -23.6 41 41 A L E +AC 11 60A 62 19,-3.0 19,-3.5 -2,-0.5 2,-0.5 -0.784 9.7 175.7 -93.9 121.4 -57.2 -2.1 -21.6 42 42 A Q E +AC 10 59A 49 -32,-2.5 -32,-2.4 -2,-0.6 2,-0.5 -0.956 0.7 174.5-130.1 114.2 -54.0 -0.4 -20.6 43 43 A A E +AC 9 58A 23 15,-2.1 15,-2.3 -2,-0.5 2,-0.4 -0.976 2.8 179.3-122.8 123.1 -51.5 -2.1 -18.3 44 44 A K E -AC 8 57A 74 -36,-3.1 -36,-2.2 -2,-0.5 13,-0.2 -0.978 13.5-154.5-122.8 134.6 -48.1 -0.7 -17.5 45 45 A S - 0 0 14 11,-2.0 -41,-0.2 -2,-0.4 -42,-0.1 -0.542 24.6-119.2 -84.6 167.9 -45.4 -2.1 -15.3 46 46 A G - 0 0 3 -43,-3.2 10,-0.4 -2,-0.2 2,-0.3 -0.071 43.4 -78.0 -82.1-160.5 -43.0 0.2 -13.6 47 47 A Y - 0 0 44 8,-0.1 -44,-0.9 -2,-0.1 8,-0.2 -0.821 37.9-112.6-110.0 144.1 -39.2 -0.1 -14.2 48 48 A T - 0 0 52 6,-2.2 -46,-0.1 -2,-0.3 -45,-0.0 -0.421 43.9 -99.3 -67.8 147.0 -36.7 -2.6 -12.9 49 49 A Q S S+ 0 0 147 -48,-0.2 5,-0.2 4,-0.1 3,-0.1 -0.131 80.1 76.7 -58.7 165.5 -34.1 -1.2 -10.5 50 50 A G S S- 0 0 65 1,-0.1 3,-0.1 3,-0.1 -3,-0.0 -0.336 96.4 -73.8 109.4 162.5 -30.7 -0.4 -12.0 51 51 A T S S+ 0 0 124 1,-0.2 51,-0.8 -2,-0.1 2,-0.6 0.814 128.1 46.5 -64.0 -33.2 -29.2 2.3 -14.2 52 52 A L E S- D 0 101A 88 49,-0.2 2,-0.3 -3,-0.1 -1,-0.2 -0.910 85.4-159.9-112.9 103.0 -31.0 0.8 -17.2 53 53 A G E - D 0 100A 5 47,-2.4 47,-1.8 -2,-0.6 2,-0.3 -0.642 1.8-155.3 -87.3 136.2 -34.6 0.1 -16.2 54 54 A L E + D 0 99A 78 -2,-0.3 -6,-2.2 45,-0.2 2,-0.3 -0.832 21.4 157.6-105.6 148.0 -36.8 -2.4 -18.1 55 55 A G E - D 0 98A 8 43,-2.0 43,-2.7 -2,-0.3 2,-0.4 -0.973 23.9-142.4-155.8 169.3 -40.6 -2.3 -18.2 56 56 A V E - D 0 97A 61 -10,-0.4 -11,-2.0 -2,-0.3 2,-0.3 -1.000 8.4-165.7-144.9 142.9 -43.5 -3.5 -20.3 57 57 A E E -CD 44 96A 25 39,-1.9 39,-2.7 -2,-0.4 2,-0.4 -0.836 5.7-155.0-122.1 159.8 -46.8 -2.1 -21.3 58 58 A L E -CD 43 95A 59 -15,-2.3 -15,-2.1 -2,-0.3 2,-0.5 -1.000 3.1-164.6-138.4 133.4 -49.9 -3.6 -22.9 59 59 A I E -CD 42 94A 10 35,-3.0 35,-2.6 -2,-0.4 2,-0.4 -0.979 12.7-176.0-119.4 121.1 -52.7 -2.1 -24.9 60 60 A G E -CD 41 93A 7 -19,-3.5 -19,-3.0 -2,-0.5 2,-0.4 -0.947 1.8-170.1-118.9 136.4 -55.9 -4.1 -25.4 61 61 A Q E +CD 40 92A 10 31,-3.5 31,-2.1 -2,-0.4 2,-0.3 -0.958 11.1 171.3-126.9 144.3 -58.9 -3.1 -27.5 62 62 A L E -CD 39 91A 60 -23,-1.7 -23,-2.7 -2,-0.4 2,-0.4 -0.899 6.4-174.8-150.2 118.3 -62.4 -4.5 -27.9 63 63 A G E -CD 38 90A 0 27,-2.9 27,-1.7 -2,-0.3 2,-0.4 -0.943 8.7-162.4-111.5 138.6 -65.3 -2.9 -29.8 64 64 A L E -CD 37 89A 59 -27,-2.4 -27,-2.1 -2,-0.4 2,-0.4 -0.980 18.9-126.3-124.4 131.5 -68.8 -4.3 -29.8 65 65 A K E +C 36 0A 58 23,-2.8 -29,-0.2 -2,-0.4 3,-0.1 -0.611 31.5 168.0 -70.4 123.0 -71.6 -3.7 -32.2 66 66 A L E S- 0 0 71 -31,-2.7 2,-0.3 -2,-0.4 -30,-0.2 0.749 70.2 -0.1-103.5 -38.4 -74.7 -2.6 -30.3 67 67 A D E S+C 35 0A 76 -32,-2.1 -32,-2.0 2,-0.0 -1,-0.3 -0.926 74.0 135.6-157.0 128.9 -76.8 -1.4 -33.2 68 68 A S - 0 0 22 -2,-0.3 -34,-0.1 -34,-0.2 5,-0.1 -0.958 25.9-161.3-166.9 153.0 -76.2 -1.1 -37.0 69 69 A S > - 0 0 38 -36,-0.3 3,-2.5 -2,-0.3 -36,-0.2 -0.986 33.8-119.6-138.6 140.7 -77.9 -1.8 -40.3 70 70 A P G > S+ 0 0 66 0, 0.0 3,-1.1 0, 0.0 4,-0.2 0.805 109.7 65.3 -55.7 -31.7 -75.8 -2.1 -43.6 71 71 A D G 3 S+ 0 0 109 1,-0.3 -40,-0.5 2,-0.1 -41,-0.3 0.593 116.6 27.4 -64.6 -8.3 -77.6 0.9 -45.2 72 72 A R G < S+ 0 0 38 -3,-2.5 -39,-1.8 12,-0.1 -1,-0.3 -0.052 88.8 113.1-145.6 40.9 -76.1 3.1 -42.5 73 73 A A < + 0 0 0 -3,-1.1 3,-0.5 11,-0.2 2,-0.4 0.470 39.8 90.3-107.8 -6.8 -72.8 1.5 -41.4 74 74 A G + 0 0 29 -43,-0.2 -1,-0.2 1,-0.2 -42,-0.1 0.105 49.1 124.1 -81.4 32.1 -69.6 3.5 -42.4 75 75 A S S S- 0 0 1 -2,-0.4 -1,-0.2 -3,-0.2 -43,-0.1 0.687 77.2-118.3 -68.7 -20.6 -69.6 5.5 -39.2 76 76 A G S S+ 0 0 7 -3,-0.5 49,-0.5 2,-0.5 -1,-0.1 0.457 93.1 99.2 92.5 2.9 -66.1 4.6 -38.1 77 77 A L S S+ 0 0 0 1,-0.2 -3,-0.1 -4,-0.2 47,-0.1 0.708 91.4 23.8 -84.2 -24.7 -67.2 2.9 -34.9 78 78 A L S S- 0 0 1 -5,-0.3 -2,-0.5 47,-0.0 -1,-0.2 -0.971 85.6-102.3-141.7 148.7 -66.9 -0.5 -36.5 79 79 A P - 0 0 28 0, 0.0 8,-2.4 0, 0.0 2,-0.4 -0.341 39.2-142.8 -63.7 158.8 -65.2 -2.3 -39.4 80 80 A R B -T 86 0B 100 6,-0.3 6,-0.2 77,-0.1 5,-0.1 -0.988 4.1-137.7-138.2 123.7 -67.4 -2.8 -42.4 81 81 A H > - 0 0 109 4,-3.0 3,-0.9 -2,-0.4 6,-0.0 -0.086 32.1-102.8 -71.7 175.2 -67.5 -5.8 -44.7 82 82 A A T 3 S+ 0 0 113 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.819 121.0 62.2 -69.6 -31.5 -67.8 -5.7 -48.5 83 83 A D T 3 S- 0 0 121 2,-0.1 -1,-0.2 1,-0.1 3,-0.1 0.663 121.3-109.0 -65.4 -15.7 -71.5 -6.7 -48.2 84 84 A G S < S+ 0 0 13 -3,-0.9 2,-0.3 1,-0.3 -11,-0.2 0.340 76.7 133.1 100.9 -4.2 -71.9 -3.4 -46.3 85 85 A R - 0 0 28 1,-0.1 -4,-3.0 -5,-0.1 -1,-0.3 -0.646 56.6-122.2 -83.3 134.1 -72.5 -5.1 -43.0 86 86 A A B -T 80 0B 9 -2,-0.3 -6,-0.3 -6,-0.2 2,-0.1 -0.350 32.7-105.5 -59.1 148.0 -70.8 -3.9 -39.9 87 87 A A - 0 0 10 -8,-2.4 3,-0.1 1,-0.1 -1,-0.1 -0.446 20.0-132.1 -68.3 154.3 -68.6 -6.4 -38.0 88 88 A D S S- 0 0 118 1,-0.3 -23,-2.8 -2,-0.1 2,-0.3 0.734 81.5 -17.9 -79.7 -21.8 -70.3 -7.6 -34.8 89 89 A D E -D 64 0A 92 -25,-0.2 2,-0.3 2,-0.0 -1,-0.3 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