==== 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 26-JUN-12 4FRX . COMPND 2 MOLECULE: ANAEROBICALLY-INDUCED OUTER MEMBRANE PORIN OPRE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR E.EREN,B.VAN DEN BERG . 799 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36730.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 591 74.0 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 . 442 55.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 9 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 13 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 . 58 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 50 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 12 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 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 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 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 . 8 4 2 0 0 2 0 4 10 4 7 5 1 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 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 0 118 0, 0.0 2,-0.3 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 145.9 49.0 2.5 66.8 2 2 A G > - 0 0 13 1,-0.1 4,-1.9 41,-0.1 41,-0.2 -0.929 360.0 -76.9 165.9 170.6 45.9 4.4 68.2 3 3 A F T 4 S+ 0 0 68 38,-0.3 38,-2.4 -2,-0.3 -1,-0.1 0.917 127.3 30.6 -55.9 -48.7 42.4 5.8 67.7 4 4 A I T >4 S+ 0 0 127 2,-0.2 3,-1.5 1,-0.2 -1,-0.2 0.947 117.7 51.8 -77.6 -52.9 43.7 8.8 65.7 5 5 A E T 34 S+ 0 0 102 1,-0.3 -2,-0.2 -4,-0.0 -1,-0.2 0.787 116.0 41.3 -60.8 -31.2 46.8 7.4 63.9 6 6 A D T 3< S+ 0 0 85 -4,-1.9 -1,-0.3 36,-0.1 -2,-0.2 0.364 86.9 125.1 -99.8 2.8 45.0 4.4 62.5 7 7 A S < + 0 0 17 -3,-1.5 2,-0.3 -4,-0.1 33,-0.3 -0.377 35.9 179.9 -60.6 137.6 41.8 6.3 61.5 8 8 A K B -A 39 0A 49 31,-3.3 31,-3.7 -2,-0.1 2,-0.1 -0.953 10.5-174.8-135.5 155.5 40.8 6.0 57.9 9 9 A A - 0 0 23 -2,-0.3 29,-0.2 29,-0.3 393,-0.1 -0.175 4.9-168.3-116.9-144.5 37.9 7.4 55.8 10 10 A S - 0 0 26 -2,-0.1 27,-2.6 391,-0.1 2,-0.5 -0.292 12.2-153.0 155.6 137.5 36.8 6.8 52.2 11 11 A L E -BC 36 399A 40 388,-2.1 388,-2.6 25,-0.2 2,-0.4 -0.984 9.8-170.5-123.0 122.4 34.4 8.3 49.6 12 12 A T E -BC 35 398A 21 23,-2.9 23,-2.5 -2,-0.5 2,-0.5 -0.924 7.9-157.4-107.7 134.5 32.9 6.2 46.8 13 13 A L E -BC 34 397A 55 384,-3.0 384,-2.0 -2,-0.4 2,-0.5 -0.956 12.6-173.9-111.4 126.3 31.0 8.0 44.1 14 14 A R E -BC 33 396A 34 19,-2.2 19,-2.9 -2,-0.5 2,-0.7 -0.951 14.8-167.2-128.7 114.7 28.5 5.9 42.2 15 15 A N E -BC 32 395A 35 380,-3.4 380,-2.4 -2,-0.5 2,-0.5 -0.894 21.5-171.7 -99.4 117.1 26.6 6.9 39.2 16 16 A F E +BC 31 394A 5 15,-2.5 15,-2.4 -2,-0.7 2,-0.4 -0.935 13.7 177.3-123.3 118.5 23.9 4.3 38.7 17 17 A Y E +BC 30 393A 41 376,-2.8 376,-2.3 -2,-0.5 2,-0.4 -0.952 6.0 178.9-117.2 133.6 21.5 3.9 35.8 18 18 A I E -BC 29 392A 3 11,-2.9 11,-2.7 -2,-0.4 2,-0.4 -0.997 7.5-179.3-135.4 136.0 18.9 1.1 35.4 19 19 A N E -BC 28 391A 47 372,-2.4 372,-2.5 -2,-0.4 2,-0.4 -0.999 7.0-170.9-129.5 139.4 16.3 0.3 32.8 20 20 A T E -BC 27 390A 25 7,-2.6 7,-2.5 -2,-0.4 2,-0.5 -0.968 10.1-161.4-128.8 143.2 13.9 -2.6 32.8 21 21 A D E -BC 26 389A 84 368,-2.9 368,-2.3 -2,-0.4 2,-0.3 -0.991 15.7-172.2-123.5 118.7 11.6 -3.9 30.2 22 22 A N E C 0 388A 62 3,-3.4 366,-0.2 -2,-0.5 -2,-0.0 -0.834 360.0 360.0-108.9 151.9 8.7 -6.2 31.4 23 23 A R 0 0 138 364,-2.0 -2,-0.0 -2,-0.3 3,-0.0 -0.987 360.0 360.0-141.0 360.0 6.2 -8.3 29.4 24 ! 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 25 30 A S 0 0 113 0, 0.0 -3,-3.4 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 130.7 6.3 -2.0 31.6 26 31 A K E +B 21 0A 89 -5,-0.2 2,-0.3 2,-0.0 -5,-0.2 -0.998 360.0 178.4-114.6 127.4 9.3 0.1 30.6 27 32 A Q E -B 20 0A 58 -7,-2.5 -7,-2.6 -2,-0.5 2,-0.4 -0.976 11.1-174.3-135.3 146.6 11.0 1.6 33.6 28 33 A E E +B 19 0A 132 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.999 3.5 177.6-145.1 132.2 14.1 3.8 34.1 29 34 A E E -B 18 0A 25 -11,-2.7 -11,-2.9 -2,-0.4 2,-0.4 -0.995 2.3-177.0-137.7 145.0 15.9 5.1 37.1 30 35 A W E +B 17 0A 117 -2,-0.3 31,-3.1 31,-0.3 2,-0.3 -0.983 11.0 163.8-145.8 127.1 19.1 7.2 37.4 31 36 A G E -BD 16 60A 0 -15,-2.4 -15,-2.5 -2,-0.4 2,-0.5 -0.968 33.3-134.7-143.2 158.6 20.9 8.4 40.5 32 37 A Q E -BD 15 59A 42 27,-2.5 27,-2.5 -2,-0.3 2,-0.3 -0.970 31.5-163.3-109.6 127.3 24.2 9.8 41.9 33 38 A G E -BD 14 58A 0 -19,-2.9 -19,-2.2 -2,-0.5 2,-0.4 -0.838 13.0-162.9-115.9 149.9 25.3 8.1 45.1 34 39 A F E -BD 13 57A 74 23,-2.6 23,-2.3 -2,-0.3 2,-0.5 -0.997 5.9-174.4-132.1 124.1 27.8 9.1 47.7 35 40 A I E -BD 12 56A 14 -23,-2.5 -23,-2.9 -2,-0.4 2,-0.6 -0.949 4.4-175.5-125.3 107.7 29.2 6.5 50.1 36 41 A L E -BD 11 55A 77 19,-2.8 19,-3.0 -2,-0.5 2,-0.4 -0.917 2.0-172.4-111.4 114.0 31.4 7.8 52.9 37 42 A N E - D 0 54A 46 -27,-2.6 2,-0.4 -2,-0.6 17,-0.2 -0.864 3.4-173.5-104.7 138.7 33.1 5.4 55.2 38 43 A Y E - D 0 53A 75 15,-2.6 15,-2.3 -2,-0.4 2,-0.4 -0.996 1.4-176.5-128.0 136.5 35.0 6.4 58.3 39 44 A Q E -AD 8 52A 100 -31,-3.7 -31,-3.3 -2,-0.4 13,-0.2 -0.944 11.1-154.4-133.8 111.9 36.9 3.8 60.4 40 45 A S - 0 0 5 11,-1.8 -36,-0.2 -2,-0.4 -37,-0.1 -0.254 18.3-117.8 -74.6 170.3 38.7 4.9 63.6 41 46 A G - 0 0 3 -38,-2.4 2,-0.4 1,-0.0 10,-0.3 -0.196 40.8 -89.1 -85.8-169.1 41.7 3.1 65.1 42 47 A F - 0 0 47 -40,-0.2 8,-0.2 8,-0.1 -39,-0.1 -0.892 33.4-114.5-111.3 138.3 41.5 1.5 68.5 43 48 A T - 0 0 36 6,-2.2 -41,-0.1 -2,-0.4 -1,-0.0 -0.201 47.9 -88.4 -58.3 158.6 42.3 3.2 71.9 44 49 A Q S S+ 0 0 67 4,-0.1 2,-0.2 -43,-0.1 3,-0.1 -0.309 81.8 67.9 -76.0 155.9 45.3 1.8 73.7 45 50 A G S S- 0 0 24 1,-0.1 748,-0.1 -3,-0.1 3,-0.1 -0.415 97.0 -69.9 120.6 163.1 45.1 -1.1 76.1 46 51 A T S S+ 0 0 36 1,-0.2 2,-0.7 -2,-0.2 44,-0.4 0.909 130.7 45.4 -53.4 -43.8 44.4 -4.9 75.9 47 52 A V S S- 0 0 10 -3,-0.1 2,-0.3 42,-0.1 42,-0.2 -0.906 84.2-167.4-104.1 109.1 40.8 -4.0 75.1 48 53 A G E - E 0 88A 3 40,-2.8 40,-2.1 -2,-0.7 2,-0.4 -0.665 4.9-150.3 -94.7 151.1 40.7 -1.2 72.5 49 54 A F E + E 0 87A 53 -2,-0.3 -6,-2.2 38,-0.2 2,-0.3 -0.934 22.2 156.0-121.0 148.6 37.6 0.8 71.6 50 55 A G E - E 0 86A 12 36,-2.8 36,-2.4 -2,-0.4 2,-0.3 -0.875 26.5-135.3-152.2-177.2 36.7 2.4 68.3 51 56 A V E - E 0 85A 51 -10,-0.3 -11,-1.8 -2,-0.3 2,-0.3 -0.978 9.8-162.7-150.4 135.2 33.8 3.7 66.2 52 57 A D E -DE 39 84A 9 32,-3.1 32,-2.9 -2,-0.3 2,-0.4 -0.874 7.0-161.5-113.0 155.6 33.0 3.4 62.5 53 58 A A E -DE 38 83A 25 -15,-2.3 -15,-2.6 -2,-0.3 2,-0.5 -0.999 6.7-164.6-138.0 138.4 30.5 5.5 60.5 54 59 A L E -DE 37 82A 13 28,-2.1 28,-2.7 -2,-0.4 2,-0.5 -0.953 8.9-169.8-125.4 109.6 28.8 4.8 57.2 55 60 A G E -DE 36 81A 21 -19,-3.0 -19,-2.8 -2,-0.5 2,-0.4 -0.877 5.3-172.6-101.7 129.6 27.2 7.8 55.5 56 61 A L E +DE 35 80A 5 24,-2.8 24,-2.1 -2,-0.5 2,-0.4 -0.983 7.4 173.8-126.4 130.8 25.0 7.1 52.4 57 62 A L E -DE 34 79A 60 -23,-2.3 -23,-2.6 -2,-0.4 2,-0.4 -0.996 6.2-174.3-138.8 131.4 23.4 9.7 50.1 58 63 A G E -DE 33 78A 0 20,-2.9 20,-2.2 -2,-0.4 2,-0.4 -0.993 3.8-167.8-126.5 132.3 21.4 9.2 46.9 59 64 A V E -DE 32 77A 36 -27,-2.5 -27,-2.5 -2,-0.4 18,-0.2 -0.980 22.4-125.6-122.8 127.2 20.3 12.0 44.6 60 65 A R E D 31 0A 104 16,-2.6 -29,-0.2 -2,-0.4 -31,-0.0 -0.505 360.0 360.0 -75.4 135.1 17.7 11.4 41.8 61 66 A L 0 0 91 -31,-3.1 -31,-0.3 -2,-0.2 -1,-0.0 -0.732 360.0 360.0-107.8 360.0 18.8 12.5 38.3 62 ! 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 63 82 A G 0 0 56 0, 0.0 5,-0.1 0, 0.0 82,-0.1 0.000 360.0 360.0 360.0 14.6 11.0 1.7 42.1 64 83 A T + 0 0 37 3,-0.1 80,-0.0 80,-0.1 -35,-0.0 0.467 360.0 47.8-114.6 -7.6 14.1 -0.2 43.3 65 84 A V S S+ 0 0 0 1,-0.2 49,-0.2 47,-0.1 48,-0.2 0.875 112.3 32.6 -97.3 -49.0 16.5 2.6 43.5 66 85 A F S S- 0 0 2 47,-0.1 -1,-0.2 1,-0.0 79,-0.1 -0.866 75.7-118.9-115.3 143.3 14.7 5.5 45.4 67 86 A P - 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