==== 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 19-JUL-02 1H1M . COMPND 2 MOLECULE: QUERCETIN 2,3-DIOXYGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ASPERGILLUS JAPONICUS; . AUTHOR R.A.STEINER,B.W.DIJKSTRA . 1374 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 46536.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 824 60.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 9 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 473 34.4 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 0.6 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 . 4 0.3 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 . 75 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 121 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 61 4.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 0.6 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 12 0 4 3 1 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 . 3 1 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 . 12 12 24 8 9 13 10 4 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 0 4 0 0 4 4 4 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 3 A S 0 0 131 0, 0.0 2,-0.1 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 -22.0 65.3 40.5 70.9 2 4 A S - 0 0 89 2,-0.1 283,-0.0 1,-0.1 0, 0.0 -0.368 360.0-119.3 -64.6 154.1 66.9 39.4 67.5 3 5 A L S S+ 0 0 11 12,-0.1 13,-2.3 -2,-0.1 2,-0.4 0.889 94.5 68.2 -68.2 -42.6 65.4 36.5 65.7 4 6 A I B -a 16 0A 76 11,-0.2 2,-0.3 13,-0.1 13,-0.2 -0.671 66.6-178.7 -85.6 132.2 68.4 34.2 65.7 5 7 A V - 0 0 26 11,-2.5 13,-0.5 -2,-0.4 3,-0.1 -0.853 32.0-145.4-127.9 160.3 69.5 32.9 69.1 6 8 A E S S+ 0 0 58 -2,-0.3 17,-2.8 1,-0.2 2,-0.3 0.643 93.9 27.3-100.2 -20.8 72.4 30.7 70.3 7 9 A D S S- 0 0 60 15,-0.2 -1,-0.2 16,-0.2 29,-0.1 -0.967 101.8 -92.8-133.7 149.5 70.2 29.0 73.0 8 10 A A - 0 0 9 27,-0.6 29,-0.1 -2,-0.3 -2,-0.1 -0.301 54.1 -99.7 -60.4 142.0 66.5 28.5 73.0 9 11 A P - 0 0 17 0, 0.0 29,-0.2 0, 0.0 -1,-0.1 -0.168 19.0-123.8 -61.5 161.8 64.7 31.4 74.7 10 12 A D S S+ 0 0 119 -3,-0.1 2,-0.3 31,-0.1 31,-0.1 0.247 93.4 28.8 -89.6 13.1 63.4 31.2 78.2 11 13 A H S S- 0 0 101 30,-0.1 2,-0.5 2,-0.0 30,-0.0 -0.942 103.3 -69.3-162.7 170.8 59.9 32.1 77.2 12 14 A V + 0 0 67 -2,-0.3 30,-0.1 30,-0.1 29,-0.1 -0.587 69.5 126.2 -80.1 122.5 57.6 31.8 74.1 13 15 A R - 0 0 30 28,-0.6 2,-0.1 -2,-0.5 -2,-0.0 -0.960 64.2 -86.2-160.6 160.3 58.7 34.0 71.2 14 16 A P + 0 0 18 0, 0.0 2,-0.3 0, 0.0 284,-0.2 -0.515 59.6 155.4 -66.8 144.1 59.5 33.4 67.5 15 17 A Y E - B 0 297A 0 282,-1.8 282,-3.2 -2,-0.1 2,-0.4 -0.980 37.4-140.9-164.4 161.9 63.1 32.5 66.9 16 18 A V E -aB 4 296A 0 -13,-2.3 -11,-2.5 -2,-0.3 2,-0.4 -0.963 15.5-169.4-123.6 137.8 65.6 30.8 64.6 17 19 A I E - B 0 295A 0 278,-2.5 278,-3.0 -2,-0.4 -11,-0.1 -0.990 20.2-130.4-132.1 124.4 68.5 28.7 66.0 18 20 A R > - 0 0 39 -13,-0.5 3,-2.0 -2,-0.4 276,-0.1 -0.396 37.9 -84.0 -72.9 146.5 71.3 27.5 63.6 19 21 A H T 3 S+ 0 0 4 273,-0.3 983,-0.6 1,-0.3 984,-0.1 -0.231 115.1 12.9 -42.7 133.8 72.4 23.8 63.4 20 22 A Y T 3 S+ 0 0 1 1,-0.2 -1,-0.3 273,-0.2 -2,-0.1 0.620 86.3 153.1 62.5 15.5 75.1 23.1 66.2 21 23 A S < - 0 0 1 -3,-2.0 -1,-0.2 1,-0.1 -15,-0.1 -0.324 64.9 -97.2 -53.9 158.7 74.4 26.3 68.1 22 24 A H > + 0 0 53 1,-0.1 3,-1.2 2,-0.1 -15,-0.2 0.919 54.2 174.4 -45.4 -56.3 75.2 25.9 71.8 23 25 A A T 3 S- 0 0 0 -17,-2.8 12,-3.2 1,-0.3 -16,-0.2 0.836 75.7 -58.4 47.8 47.4 71.6 25.2 72.6 24 26 A R T 3 S- 0 0 103 10,-0.2 -1,-0.3 1,-0.1 -2,-0.1 0.858 82.3-157.0 53.8 43.9 72.2 24.4 76.3 25 27 A A < + 0 0 3 -3,-1.2 116,-2.0 116,-0.2 2,-0.3 -0.107 19.9 173.5 -56.0 142.3 74.6 21.6 75.2 26 28 A V E -IJ 33 140B 9 7,-1.4 7,-2.5 114,-0.3 2,-0.4 -0.968 20.8-137.1-138.4 155.5 75.3 18.7 77.6 27 29 A T E -IJ 32 139B 30 112,-2.5 112,-2.7 -2,-0.3 2,-0.4 -0.920 8.9-167.1-108.9 151.2 77.2 15.5 77.1 28 30 A V E > S-I 31 0B 14 3,-2.5 3,-2.3 -2,-0.4 2,-0.1 -0.927 71.9 -60.8-127.2 105.2 76.3 12.1 78.3 29 31 A D T 3 S- 0 0 111 -2,-0.4 110,-0.1 1,-0.3 -1,-0.1 -0.406 123.4 -11.7 49.2-119.0 79.5 10.1 77.8 30 32 A T T 3 S+ 0 0 54 -3,-0.1 2,-0.3 -2,-0.1 -1,-0.3 0.572 118.5 94.2 -82.8 -7.8 80.2 10.3 74.1 31 33 A Q E < -I 28 0B 3 -3,-2.3 -3,-2.5 22,-0.1 2,-0.5 -0.670 58.7-156.1 -92.1 139.6 76.8 11.8 73.1 32 34 A L E -IK 27 52B 0 20,-2.7 20,-2.9 -2,-0.3 2,-0.3 -0.976 9.8-162.0-121.1 123.8 76.2 15.5 72.7 33 35 A Y E -IK 26 51B 11 -7,-2.5 -7,-1.4 -2,-0.5 2,-0.4 -0.790 5.7-171.2-103.7 139.7 72.7 16.8 73.1 34 36 A R E - K 0 50B 2 16,-2.4 16,-2.4 -2,-0.3 2,-0.8 -0.999 15.0-146.2-133.5 138.8 71.4 20.2 72.0 35 37 A F E + K 0 49B 1 -12,-3.2 -27,-0.6 -2,-0.4 14,-0.2 -0.783 25.9 164.8-110.9 91.6 68.0 21.6 72.8 36 38 A Y E S+ 0 0 0 12,-1.0 2,-0.4 -2,-0.8 13,-0.2 0.861 79.1 23.6 -78.3 -37.9 66.8 23.7 69.8 37 39 A V E S+ K 0 48B 0 11,-2.3 11,-1.8 -3,-0.2 -1,-0.3 -0.999 80.5 177.2-127.0 133.0 63.2 23.8 71.2 38 40 A T > - 0 0 4 -2,-0.4 4,-1.6 9,-0.2 8,-0.3 -0.692 44.7 -95.6-122.5 175.6 62.5 23.3 74.9 39 41 A G H >>>S+ 0 0 0 -2,-0.2 5,-2.6 2,-0.2 4,-0.8 0.979 123.8 44.1 -53.4 -62.0 59.6 23.3 77.2 40 42 A P H >45S+ 0 0 37 0, 0.0 3,-0.7 0, 0.0 -1,-0.2 0.913 115.0 50.5 -51.5 -39.5 60.0 26.9 78.3 41 43 A S H 345S+ 0 0 0 1,-0.2 -28,-0.6 -29,-0.1 -2,-0.2 0.769 119.3 34.6 -76.1 -22.8 60.6 28.0 74.6 42 44 A S H X<5S- 0 0 6 -4,-1.6 3,-0.8 -3,-0.6 -1,-0.2 0.274 112.1-110.5-108.9 8.8 57.6 26.3 73.2 43 45 A G T <<5S- 0 0 44 -4,-0.8 -4,-0.1 -3,-0.7 -2,-0.1 0.876 77.6 -56.8 53.6 37.7 55.3 26.8 76.3 44 46 A Y T 3 - S 0 108C 20 4,-0.3 3,-2.6 -2,-0.3 22,-0.1 -0.926 55.5 -61.0-116.4 131.7 54.4 -2.5 73.3 87 89 A G T 3 S- 0 0 62 20,-0.5 22,-0.1 -2,-0.4 20,-0.0 -0.023 116.8 -15.1 42.6-123.6 52.6 -4.6 75.8 88 90 A N T 3 S+ 0 0 174 -3,-0.0 -1,-0.3 2,-0.0 3,-0.1 0.313 105.8 118.3 -87.2 -2.3 52.4 -8.2 74.5 89 91 A E S < S- 0 0 90 -3,-2.6 3,-0.1 1,-0.1 0, 0.0 -0.308 77.5 -84.9 -72.6 153.9 53.3 -7.4 70.9 90 92 A T - 0 0 84 1,-0.1 -4,-0.3 -5,-0.1 2,-0.2 -0.242 50.0-106.7 -49.5 135.7 56.4 -8.8 69.1 91 93 A Q - 0 0 23 -6,-0.1 2,-0.3 -3,-0.1 -6,-0.2 -0.576 39.9-158.9 -71.5 137.4 59.5 -6.8 69.8 92 94 A Q E +R 84 0C 43 -8,-2.5 -8,-2.7 -2,-0.2 2,-0.3 -0.898 13.1 179.2-118.9 140.8 60.6 -4.7 66.7 93 95 A T E +RT 83 189C 0 96,-2.7 96,-1.9 -2,-0.3 2,-0.3 -0.997 1.8 178.5-144.2 149.4 63.9 -3.2 65.7 94 96 A R E -RT 82 188C 20 -12,-2.0 -12,-2.6 -2,-0.3 2,-0.8 -0.993 30.0-128.8-142.1 146.8 65.2 -1.2 62.7 95 97 A V E -R 81 0C 20 92,-2.7 2,-0.4 -2,-0.3 -14,-0.3 -0.895 31.8-152.2 -92.9 111.6 68.5 0.4 61.7 96 98 A L E +R 80 0C 0 -16,-2.6 -16,-1.7 -2,-0.8 2,-0.2 -0.679 17.2 178.8 -83.5 127.4 67.5 4.0 60.8 97 99 A S E > -R 79 0C 23 -2,-0.4 3,-2.4 -18,-0.2 -22,-0.3 -0.556 52.6 -32.1-112.3-168.3 69.8 5.8 58.2 98 100 A S T 3 S+ 0 0 33 -20,-0.5 672,-0.2 1,-0.3 -22,-0.2 -0.179 132.1 7.3 -58.1 127.6 69.3 9.3 56.9 99 101 A G T 3 S+ 0 0 3 -24,-3.4 -1,-0.3 1,-0.3 116,-0.2 0.327 95.4 132.8 87.6 -1.2 65.7 10.4 56.7 100 102 A D < - 0 0 0 -3,-2.4 -25,-2.4 -25,-0.2 2,-0.3 -0.449 40.1-151.7 -83.2 156.1 64.3 7.3 58.5 101 103 A Y E -NO 74 212B 0 111,-2.7 111,-2.6 -27,-0.2 2,-0.4 -0.942 14.3-171.3-137.2 139.5 61.8 7.7 61.3 102 104 A G E -NO 73 211B 0 -29,-2.7 -29,-3.2 -2,-0.3 2,-0.5 -0.986 12.2-152.3-134.7 129.4 60.8 5.7 64.4 103 105 A S E -NO 72 210B 0 107,-3.0 107,-1.2 -2,-0.4 -31,-0.2 -0.861 10.3-176.1-103.9 126.8 57.7 6.5 66.5 104 106 A V E -N 71 0B 1 -33,-3.1 -33,-2.4 -2,-0.5 4,-0.1 -0.814 11.7-164.4-124.7 86.9 57.7 5.5 70.2 105 107 A P > - 0 0 7 0, 0.0 3,-1.1 0, 0.0 -39,-0.2 -0.075 41.3 -66.1 -56.1 166.3 54.4 6.2 71.9 106 108 A R T 3 S+ 0 0 72 1,-0.2 -39,-0.2 -39,-0.1 -36,-0.1 -0.260 121.0 21.9 -50.9 141.8 53.9 6.4 75.7 107 109 A N T 3 S+ 0 0 91 -41,-2.5 -20,-0.5 1,-0.2 2,-0.5 0.702 88.6 128.9 64.4 29.4 54.5 3.0 77.5 108 110 A V E < - S 0 86C 0 -3,-1.1 -42,-0.3 -42,-0.3 2,-0.3 -0.960 58.3-130.2-110.0 125.5 56.6 1.5 74.8 109 111 A T E + S 0 85C 18 -24,-2.2 -24,-1.8 -2,-0.5 2,-0.3 -0.552 41.7 161.3 -72.6 135.5 59.9 0.0 75.9 110 112 A H E +PS 64 84C 1 -46,-2.2 -46,-1.7 -2,-0.3 2,-0.3 -0.991 22.8 170.6-152.6 159.2 62.8 1.2 73.8 111 113 A T E - 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