==== 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 OXIDOREDUCTASE 06-SEP-00 1FQT . COMPND 2 MOLECULE: RIESKE-TYPE FERREDOXIN OF BIPHENYL DIOXYGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BURKHOLDERIA XENOVORANS; . AUTHOR C.L.COLBERT,M.M.-J.COUTURE,L.D.ELTIS,J.T.BOLIN . 218 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11603.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 131 60.1 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 . 87 39.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 2.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 3.7 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 . 22 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 19 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 5 2.3 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 . 5 4 2 5 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 2 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 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 M 0 0 219 0, 0.0 2,-0.3 0, 0.0 100,-0.0 0.000 360.0 360.0 360.0 -31.6 35.8 -19.0 23.3 2 2 A K - 0 0 131 2,-0.0 101,-0.4 0, 0.0 100,-0.4 -0.629 360.0-177.5-137.8 86.2 37.7 -16.3 25.2 3 3 A F - 0 0 83 -2,-0.3 2,-0.4 98,-0.2 98,-0.2 -0.615 8.2-160.3 -87.8 136.1 37.3 -16.0 29.0 4 4 A T E -A 100 0A 55 96,-2.7 96,-2.5 -2,-0.3 2,-0.5 -0.925 22.8-123.1-113.0 130.4 39.0 -13.2 31.0 5 5 A R E +A 99 0A 126 -2,-0.4 94,-0.3 94,-0.2 3,-0.1 -0.624 38.5 167.9 -74.7 121.8 39.6 -13.5 34.8 6 6 A V E - 0 0 31 92,-2.7 2,-0.3 -2,-0.5 -1,-0.2 0.701 49.9 -28.7-110.8 -24.5 37.9 -10.5 36.3 7 7 A C E -A 98 0A 4 91,-1.0 91,-2.6 13,-0.1 2,-0.4 -0.966 66.9 -78.8-173.8-179.8 37.6 -10.9 40.1 8 8 A D E > -A 97 0A 26 -2,-0.3 3,-2.2 89,-0.2 89,-0.2 -0.790 40.7-122.5 -96.1 144.5 37.2 -13.3 43.0 9 9 A R G > S+ 0 0 97 87,-2.7 3,-1.4 -2,-0.4 -1,-0.1 0.820 113.0 61.9 -57.0 -29.6 33.7 -14.7 43.5 10 10 A R G 3 S+ 0 0 145 86,-0.3 -1,-0.3 1,-0.3 87,-0.1 0.588 85.9 75.7 -74.6 -6.4 33.8 -13.3 47.1 11 11 A D G < S+ 0 0 87 -3,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.541 92.2 56.7 -78.8 -9.8 34.2 -9.7 45.6 12 12 A V S < S- 0 0 1 -3,-1.4 -1,-0.2 -4,-0.2 3,-0.1 -0.813 81.7-161.5-125.7 88.1 30.5 -9.8 44.7 13 13 A P > - 0 0 71 0, 0.0 3,-2.3 0, 0.0 18,-0.4 -0.250 39.7 -73.8 -67.2 157.3 28.5 -10.4 47.9 14 14 A E T 3 S+ 0 0 132 1,-0.3 18,-0.2 16,-0.1 3,-0.1 -0.246 122.1 16.4 -53.5 131.5 24.9 -11.6 47.8 15 15 A G T 3 S+ 0 0 41 16,-2.6 -1,-0.3 1,-0.3 41,-0.2 0.471 109.8 101.7 83.0 2.6 22.6 -8.8 46.7 16 16 A E < - 0 0 112 -3,-2.3 15,-2.3 15,-0.2 2,-0.3 -0.668 57.1-141.8-115.6 171.5 25.4 -6.6 45.4 17 17 A A E -C 30 0B 33 -2,-0.2 2,-0.4 13,-0.2 13,-0.2 -0.909 6.6-162.3-130.9 157.4 26.9 -5.7 42.0 18 18 A L E -C 29 0B 52 11,-2.2 11,-2.5 -2,-0.3 2,-0.4 -0.993 14.9-137.5-142.2 132.0 30.4 -5.2 40.7 19 19 A K E +C 28 0B 74 -2,-0.4 2,-0.4 9,-0.2 9,-0.2 -0.757 24.8 178.9 -89.6 132.5 31.6 -3.4 37.6 20 20 A V E -C 27 0B 13 7,-2.9 7,-3.1 -2,-0.4 2,-0.3 -0.976 5.2-168.2-129.7 146.5 34.4 -5.1 35.6 21 21 A E E +C 26 0B 124 -2,-0.4 2,-0.3 5,-0.2 5,-0.2 -0.983 14.8 167.2-141.7 152.5 35.9 -4.0 32.4 22 22 A S E > S-C 25 0B 46 3,-2.0 3,-1.9 -2,-0.3 -2,-0.0 -0.926 71.7 -0.7-159.4 133.6 38.2 -5.1 29.6 23 23 A G T 3 S- 0 0 83 -2,-0.3 3,-0.1 1,-0.3 -2,-0.0 0.750 129.4 -55.2 59.5 24.2 39.1 -3.7 26.1 24 24 A G T 3 S+ 0 0 62 1,-0.3 2,-0.5 0, 0.0 -1,-0.3 0.545 111.4 122.1 86.3 6.6 36.6 -0.9 26.6 25 25 A T E < -C 22 0B 51 -3,-1.9 -3,-2.0 15,-0.0 2,-0.5 -0.914 48.3-155.3-106.2 126.1 33.7 -3.2 27.4 26 26 A S E -C 21 0B 9 -2,-0.5 15,-2.1 -5,-0.2 2,-0.4 -0.881 11.5-175.0-105.5 130.6 32.0 -2.7 30.7 27 27 A V E -CD 20 40B 0 -7,-3.1 -7,-2.9 -2,-0.5 2,-0.5 -0.965 16.4-145.0-126.2 137.5 30.1 -5.6 32.4 28 28 A A E -CD 19 39B 0 11,-2.9 11,-2.3 -2,-0.4 2,-0.5 -0.874 12.6-159.0-100.3 132.2 28.0 -5.6 35.6 29 29 A I E -CD 18 38B 0 -11,-2.5 -11,-2.2 -2,-0.5 2,-0.4 -0.969 9.6-168.2-112.5 127.1 28.2 -8.8 37.7 30 30 A F E -CD 17 37B 1 7,-2.8 7,-2.3 -2,-0.5 2,-0.7 -0.932 15.9-143.4-116.4 139.4 25.3 -9.3 40.1 31 31 A N E - D 0 36B 16 -15,-2.3 -16,-2.6 -18,-0.4 2,-0.6 -0.902 19.9-178.0-103.8 109.9 25.1 -11.9 42.9 32 32 A V E > S- D 0 35B 5 3,-2.7 3,-1.8 -2,-0.7 27,-0.1 -0.936 72.6 -32.8-109.7 109.1 21.5 -13.2 43.2 33 33 A D T 3 S- 0 0 121 -2,-0.6 -1,-0.1 1,-0.3 3,-0.1 0.826 126.2 -42.5 51.5 39.2 21.2 -15.7 46.0 34 34 A G T 3 S+ 0 0 50 1,-0.3 2,-0.4 0, 0.0 -1,-0.3 0.380 119.1 99.3 94.3 -7.0 24.8 -17.1 45.6 35 35 A E E < -D 32 0B 121 -3,-1.8 -3,-2.7 2,-0.0 2,-0.3 -0.905 65.6-130.5-115.2 145.4 24.9 -17.3 41.8 36 36 A L E -D 31 0B 19 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.2 -0.759 19.6-173.4-100.1 142.7 26.5 -14.7 39.6 37 37 A F E -D 30 0B 40 -7,-2.3 -7,-2.8 -2,-0.3 2,-0.4 -0.989 9.5-151.2-133.2 138.5 25.0 -13.1 36.5 38 38 A A E +D 29 0B 5 51,-0.5 51,-1.7 -2,-0.4 2,-0.3 -0.920 20.5 160.6-117.6 136.1 26.6 -10.8 34.0 39 39 A T E -DE 28 88B 0 -11,-2.3 -11,-2.9 -2,-0.4 49,-0.2 -0.893 52.4 -75.7-138.6 168.4 25.1 -8.0 31.9 40 40 A Q E -D 27 0B 46 47,-2.3 -13,-0.3 -2,-0.3 10,-0.1 -0.409 46.0-131.3 -60.0 146.3 26.3 -5.0 30.0 41 41 A D S S+ 0 0 3 -15,-2.1 9,-3.2 -21,-0.1 10,-0.4 0.848 80.0 78.8 -74.7 -32.4 27.0 -2.3 32.6 42 42 A R B S-G 49 0C 102 -16,-0.3 7,-0.2 7,-0.2 5,-0.1 -0.564 85.4-114.5 -84.2 141.2 25.1 0.5 31.0 43 43 A C > - 0 0 6 5,-2.5 3,-1.1 -2,-0.3 5,-0.3 -0.338 26.0-127.0 -58.4 147.9 21.4 1.0 31.1 44 44 A T T 3 S+ 0 0 36 40,-0.3 -1,-0.1 1,-0.2 89,-0.1 0.655 107.2 59.1 -77.0 -8.8 20.0 0.6 27.6 45 45 A H T 3 S- 0 0 88 1,-0.2 2,-0.3 3,-0.1 -1,-0.2 0.423 119.7 -10.7 -97.9 0.9 18.3 4.0 28.0 46 46 A G S < S- 0 0 30 -3,-1.1 2,-2.2 2,-0.2 -3,-0.2 -0.956 80.1 -78.3 175.8 164.5 21.4 6.1 28.7 47 47 A D S S+ 0 0 132 -2,-0.3 2,-0.4 -5,-0.1 -3,-0.1 -0.550 82.2 126.4 -79.4 80.2 25.2 6.2 29.5 48 48 A W - 0 0 96 -2,-2.2 -5,-2.5 -5,-0.3 2,-0.3 -0.985 61.7-118.0-143.9 127.3 24.5 5.3 33.1 49 49 A S B -G 42 0C 19 -2,-0.4 4,-0.3 -7,-0.2 15,-0.3 -0.478 13.8-164.9 -73.1 126.8 26.0 2.5 35.2 50 50 A L S S+ 0 0 3 -9,-3.2 4,-0.4 -2,-0.3 5,-0.4 0.763 93.1 46.8 -77.4 -26.1 23.7 -0.2 36.6 51 51 A S S > S+ 0 0 13 -10,-0.4 3,-0.9 1,-0.2 -34,-0.2 0.920 108.8 52.5 -81.5 -44.0 26.4 -1.4 39.0 52 52 A D T 3 S+ 0 0 122 1,-0.2 -1,-0.2 -11,-0.1 -2,-0.2 0.517 98.7 68.9 -68.1 -6.9 27.5 2.0 40.3 53 53 A G T 3 S- 0 0 20 -4,-0.3 -1,-0.2 -3,-0.1 -2,-0.1 0.793 90.7-142.7 -83.1 -31.2 23.9 2.9 41.1 54 54 A G < + 0 0 65 -3,-0.9 2,-0.6 -4,-0.4 -3,-0.1 0.713 54.6 126.9 77.5 23.2 23.4 0.4 44.0 55 55 A Y + 0 0 131 -5,-0.4 7,-2.8 7,-0.4 2,-0.4 -0.807 19.5 142.7-118.1 92.2 19.8 -0.6 43.4 56 56 A L E -H 61 0D 28 -2,-0.6 2,-0.5 -41,-0.2 5,-0.2 -0.997 20.3-178.1-128.3 128.0 19.3 -4.4 43.1 57 57 A E E > -H 60 0D 163 3,-2.7 3,-2.1 -2,-0.4 2,-0.4 -0.935 66.9 -49.9-128.3 106.0 16.3 -6.2 44.6 58 58 A G T 3 S- 0 0 50 -2,-0.5 -43,-0.1 1,-0.3 -25,-0.1 -0.543 122.7 -24.0 66.8-124.2 16.3 -9.9 44.2 59 59 A D T 3 S+ 0 0 51 -2,-0.4 13,-2.9 -3,-0.1 2,-0.5 0.211 119.7 94.3-106.4 18.6 17.1 -10.4 40.5 60 60 A V E < -HI 57 71D 35 -3,-2.1 -3,-2.7 11,-0.2 2,-0.4 -0.929 57.1-159.5-113.7 123.0 15.8 -7.0 39.3 61 61 A V E -HI 56 70D 1 9,-2.7 9,-2.2 -2,-0.5 2,-0.5 -0.832 7.3-149.3-100.7 139.4 18.2 -4.1 38.9 62 62 A E E - I 0 69D 52 -7,-2.8 2,-0.4 -2,-0.4 -7,-0.4 -0.928 13.3-130.9-110.8 128.5 16.9 -0.5 38.9 63 63 A C > - 0 0 3 5,-3.0 4,-1.7 -2,-0.5 5,-0.1 -0.641 14.2-149.1 -73.0 125.5 18.6 2.3 36.9 64 64 A S T 4 S+ 0 0 37 -2,-0.4 -1,-0.1 -15,-0.3 -14,-0.1 0.539 87.1 65.0 -78.3 -3.8 19.0 5.2 39.3 65 65 A L T 4 S- 0 0 68 3,-0.1 -1,-0.2 1,-0.1 -2,-0.0 0.961 129.3 -6.0 -82.2 -56.8 18.7 7.8 36.6 66 66 A H T 4 S- 0 0 86 2,-0.1 -2,-0.2 0, 0.0 -1,-0.1 0.214 95.8-109.6-124.4 16.5 15.1 7.2 35.4 67 67 A M < + 0 0 94 -4,-1.7 -3,-0.1 1,-0.2 2,-0.0 0.646 58.8 157.5 69.6 17.7 14.1 4.2 37.4 68 68 A G - 0 0 0 -5,-0.1 -5,-3.0 -6,-0.1 2,-0.4 -0.333 27.5-147.8 -66.4 158.5 14.0 1.7 34.5 69 69 A K E -IJ 62 79D 73 10,-1.8 9,-3.1 -7,-0.2 10,-1.6 -0.976 16.2-174.7-135.3 147.7 14.3 -1.9 35.6 70 70 A F E -IJ 61 77D 0 -9,-2.2 -9,-2.7 -2,-0.4 2,-0.5 -0.988 31.1-117.0-137.8 149.4 15.8 -5.1 34.1 71 71 A C E > -I 60 0D 10 5,-2.9 4,-2.6 -2,-0.3 3,-0.2 -0.742 23.3-153.4 -81.1 124.4 16.0 -8.8 35.1 72 72 A V T 4 S+ 0 0 1 -13,-2.9 -1,-0.1 -2,-0.5 -42,-0.1 0.717 89.9 59.4 -75.1 -17.3 19.7 -9.5 35.6 73 73 A R T 4 S+ 0 0 97 -14,-0.5 -1,-0.2 1,-0.1 -35,-0.1 0.843 126.8 13.1 -76.4 -32.6 19.3 -13.2 34.8 74 74 A T T 4 S- 0 0 45 -3,-0.2 34,-0.6 2,-0.1 -2,-0.2 0.545 92.9-125.6-118.8 -13.9 18.0 -12.5 31.3 75 75 A G < + 0 0 0 -4,-2.6 11,-2.9 1,-0.2 -3,-0.1 0.357 60.0 148.9 79.5 -1.7 18.7 -8.8 30.7 76 76 A K - 0 0 68 9,-0.2 -5,-2.9 -5,-0.2 -1,-0.2 -0.268 53.8-102.3 -72.3 148.8 15.0 -8.3 29.9 77 77 A V E +J 70 0D 50 -7,-0.2 -7,-0.3 1,-0.2 -1,-0.1 -0.490 36.0 173.3 -69.9 130.7 13.2 -5.1 30.6 78 78 A K E S+ 0 0 129 -9,-3.1 -8,-0.2 1,-0.4 -1,-0.2 0.588 71.4 12.7-107.8 -20.8 10.9 -5.1 33.7 79 79 A S E S-J 69 0D 39 -10,-1.6 -10,-1.8 3,-0.0 -1,-0.4 -0.972 84.3 -97.9-156.1 141.8 10.0 -1.4 33.7 80 80 A P S S+ 0 0 101 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 -0.239 85.1 80.1 -73.4 175.1 10.3 1.5 31.3 81 81 A P S S+ 0 0 57 0, 0.0 -14,-0.1 0, 0.0 -13,-0.0 -0.930 101.5 70.6 -54.9 -33.5 11.7 4.0 30.3 82 82 A P + 0 0 5 0, 0.0 -13,-0.1 0, 0.0 3,-0.1 -0.233 50.5 175.4 -56.0 146.6 13.9 1.4 28.7 83 83 A C + 0 0 117 -3,-0.1 2,-0.4 -39,-0.1 -6,-0.1 0.355 59.8 76.0-125.9 -4.5 12.4 -0.6 25.8 84 84 A E S S- 0 0 41 -8,-0.1 -40,-0.3 48,-0.0 48,-0.1 -0.921 77.8-122.8-115.8 135.2 15.6 -2.6 24.9 85 85 A A - 0 0 29 -2,-0.4 -9,-0.2 1,-0.1 2,-0.2 -0.333 30.2-109.9 -69.5 151.2 16.9 -5.6 26.8 86 86 A L - 0 0 0 -11,-2.9 22,-0.4 -15,-0.2 2,-0.2 -0.505 30.6-111.8 -74.7 148.4 20.5 -5.6 28.1 87 87 A K - 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