==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 07-AUG-12 4GHE . COMPND 2 MOLECULE: HOMOPROTOCATECHUATE 2,3-DIOXYGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BREVIBACTERIUM FUSCUM; . AUTHOR E.G.KOVALEVA,J.D.LIPSCOMB . 1426 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 44712.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 935 65.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 116 8.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 339 23.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 18 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.3 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 . 90 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 119 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 176 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 28 2.0 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 6 2 0 4 0 4 0 2 6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 8 0 4 12 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 0 PARALLEL BRIDGES PER LADDER . 13 7 1 20 4 8 4 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 . 5 0 0 0 0 0 0 4 4 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 4 A E 0 0 178 0, 0.0 161,-0.1 0, 0.0 162,-0.1 0.000 360.0 360.0 360.0 140.9 0.4 67.3 -8.4 2 5 A I - 0 0 8 160,-0.3 92,-0.0 1,-0.0 2,-0.0 -0.803 360.0-130.7 -93.7 121.3 3.8 66.0 -9.6 3 6 A P - 0 0 84 0, 0.0 -1,-0.0 0, 0.0 166,-0.0 -0.311 17.2-111.6 -76.2 154.3 3.8 65.3 -13.3 4 7 A K - 0 0 143 1,-0.1 162,-0.0 2,-0.0 166,-0.0 -0.720 38.6-124.2 -80.1 120.9 5.1 62.1 -15.0 5 8 A P - 0 0 10 0, 0.0 4,-0.1 0, 0.0 85,-0.1 -0.265 3.6-136.8 -62.8 153.4 8.3 62.8 -16.9 6 9 A V S S+ 0 0 134 2,-0.1 3,-0.1 84,-0.1 84,-0.1 0.889 86.9 89.1 -66.0 -43.1 8.8 62.0 -20.5 7 10 A A S S- 0 0 20 82,-0.2 2,-0.1 1,-0.1 79,-0.0 -0.231 93.6-102.5 -58.8 141.6 12.2 60.7 -19.5 8 11 A P - 0 0 79 0, 0.0 82,-0.2 0, 0.0 -1,-0.1 -0.389 35.7-113.0 -68.2 139.2 12.2 56.9 -18.6 9 12 A A - 0 0 31 160,-0.2 78,-0.1 -4,-0.1 2,-0.1 -0.385 34.9-103.8 -65.4 148.3 12.4 56.1 -14.8 10 13 A P - 0 0 4 0, 0.0 2,-0.9 0, 0.0 -1,-0.1 -0.457 33.8-111.2 -63.9 149.0 15.5 54.4 -13.5 11 14 A D - 0 0 47 -2,-0.1 68,-2.4 69,-0.1 2,-0.4 -0.776 39.0-160.8 -83.2 105.2 15.2 50.7 -12.9 12 15 A I E -A 78 0A 1 -2,-0.9 66,-0.3 158,-0.3 3,-0.1 -0.742 14.1-170.5 -95.9 128.4 15.5 50.6 -9.0 13 16 A L E - 0 0 9 64,-2.8 2,-0.3 -2,-0.4 65,-0.2 0.888 55.8 -52.6 -80.6 -47.8 16.4 47.3 -7.4 14 17 A R E -A 77 0A 10 63,-1.1 63,-1.8 178,-0.1 -1,-0.3 -0.965 64.4 -64.7-179.3 162.1 15.8 48.0 -3.7 15 18 A C E +A 76 0A 0 136,-0.3 61,-0.3 -2,-0.3 135,-0.1 -0.544 50.2 176.4 -64.5 138.7 16.6 50.2 -0.8 16 19 A A E - 0 0 0 59,-3.0 2,-0.3 1,-0.4 60,-0.2 0.709 47.4 -20.0-120.3 -44.1 20.3 49.8 -0.2 17 20 A Y E -A 75 0A 0 58,-1.6 58,-2.9 34,-0.0 2,-0.4 -0.984 44.7-136.5-162.8 160.5 21.6 52.2 2.7 18 21 A A E -Ab 74 61A 0 42,-1.4 44,-2.8 -2,-0.3 2,-0.6 -0.974 11.6-146.7-121.2 141.4 20.9 55.2 4.8 19 22 A E E -Ab 73 62A 6 54,-3.0 53,-2.9 -2,-0.4 54,-1.5 -0.958 22.8-171.1-101.6 115.3 23.3 58.0 5.8 20 23 A L E -Ab 71 63A 0 42,-3.2 44,-2.7 -2,-0.6 2,-0.4 -0.935 18.1-139.5-109.0 130.0 22.4 59.3 9.2 21 24 A V E -Ab 70 64A 9 49,-3.1 49,-1.1 -2,-0.5 2,-0.3 -0.747 27.9-176.6 -82.6 130.0 24.0 62.3 10.8 22 25 A V E - b 0 65A 0 42,-2.3 44,-2.2 -2,-0.4 3,-0.2 -0.878 26.6-142.1-127.5 157.4 24.6 61.7 14.5 23 26 A T S S+ 0 0 62 -2,-0.3 2,-0.5 1,-0.3 -1,-0.1 0.768 91.4 35.3 -95.4 -31.9 26.0 64.0 17.2 24 27 A D > - 0 0 65 1,-0.1 4,-2.4 41,-0.0 -1,-0.3 -0.914 64.9-167.4-125.9 102.8 28.2 61.6 19.3 25 28 A L H > S+ 0 0 17 -2,-0.5 4,-2.6 1,-0.2 -1,-0.1 0.874 87.3 52.9 -61.1 -38.5 29.9 59.0 17.1 26 29 A A H > S+ 0 0 71 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.879 110.5 45.1 -63.4 -44.3 31.0 56.9 20.1 27 30 A K H > S+ 0 0 132 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.919 114.4 49.3 -68.4 -39.8 27.5 56.7 21.7 28 31 A S H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 5,-0.3 0.915 109.2 53.1 -64.5 -40.7 26.0 55.9 18.3 29 32 A R H X>S+ 0 0 72 -4,-2.6 4,-2.9 -5,-0.2 5,-1.1 0.920 106.2 53.5 -59.6 -43.9 28.7 53.2 17.7 30 33 A N H <>S+ 0 0 84 -4,-2.0 5,-2.6 3,-0.2 -1,-0.2 0.898 112.6 44.1 -56.9 -44.0 27.7 51.7 21.1 31 34 A F H <>S+ 0 0 13 -4,-1.7 5,-2.8 3,-0.2 -2,-0.2 0.957 121.6 35.5 -67.0 -52.2 24.1 51.4 20.1 32 35 A Y H <5S+ 0 0 0 -4,-2.7 6,-2.4 3,-0.2 -2,-0.2 0.843 132.6 24.7 -78.4 -35.4 24.5 50.1 16.6 33 36 A V T X5S+ 0 0 26 -4,-2.9 4,-1.0 -5,-0.3 -3,-0.2 0.889 130.6 33.6 -92.8 -57.4 27.6 47.9 17.1 34 37 A D T 4 - 0 0 0 -2,-0.3 3,-1.0 -14,-0.2 83,-0.3 -0.232 41.8 -95.0 -82.6 171.4 23.8 43.6 8.1 53 56 A F T 3 S+ 0 0 0 94,-2.2 82,-0.4 1,-0.2 85,-0.2 0.826 120.3 37.1 -60.2 -35.7 24.7 39.8 8.3 54 57 A E T 3 S+ 0 0 2 94,-2.2 -1,-0.2 81,-0.2 2,-0.2 0.400 89.6 116.9-103.6 7.7 23.7 38.9 4.7 55 58 A E < + 0 0 7 -3,-1.0 80,-0.6 93,-0.1 81,-0.1 -0.476 34.3 178.6 -82.1 144.7 24.9 42.0 2.9 56 59 A F + 0 0 1 -2,-0.2 76,-2.4 78,-0.2 -1,-0.1 0.568 59.6 88.3-114.6 -16.9 27.6 42.0 0.2 57 60 A I S S- 0 0 0 74,-0.2 74,-0.2 1,-0.1 52,-0.1 -0.340 99.1 -94.1 -74.4 167.7 27.5 45.7 -0.8 58 61 A H S S- 0 0 18 50,-0.5 2,-0.3 72,-0.3 -1,-0.1 0.859 91.4 -19.3 -56.7 -39.2 29.8 47.9 1.3 59 62 A H - 0 0 0 49,-0.1 -8,-0.3 1,-0.1 -1,-0.1 -0.991 31.3-154.0-163.4 158.1 27.2 49.0 3.8 60 63 A N S S+ 0 0 0 -10,-2.9 -42,-1.4 -2,-0.3 2,-0.3 0.405 90.3 33.1-110.8 -12.1 23.6 49.4 4.7 61 64 A L E -bD 18 50A 0 -11,-2.0 -11,-3.0 -44,-0.2 2,-0.5 -0.975 58.6-166.6-149.4 132.3 24.1 52.3 7.2 62 65 A V E -bD 19 49A 0 -44,-2.8 -42,-3.2 -2,-0.3 2,-0.6 -0.986 7.8-159.6-119.3 122.8 26.5 55.2 7.4 63 66 A L E -bD 20 48A 0 -15,-2.6 -15,-2.0 -2,-0.5 2,-0.5 -0.913 14.1-171.4 -97.4 119.1 26.8 57.2 10.6 64 67 A T E -bD 21 47A 17 -44,-2.7 -42,-2.3 -2,-0.6 -17,-0.2 -0.961 22.7-124.7-117.6 123.7 28.3 60.6 9.9 65 68 A K E +b 22 0A 104 -19,-3.2 -42,-0.2 -2,-0.5 -44,-0.1 -0.456 49.4 141.1 -65.4 135.8 29.3 62.8 12.7 66 69 A G - 0 0 17 -44,-2.2 3,-0.1 -2,-0.2 -41,-0.0 -0.965 59.7-102.7-166.9 171.7 27.7 66.3 12.5 67 70 A P S S+ 0 0 125 0, 0.0 2,-0.5 0, 0.0 -44,-0.1 0.752 104.5 44.7 -78.4 -28.3 26.0 69.1 14.5 68 71 A V S S- 0 0 56 -46,-0.1 2,-0.1 2,-0.0 -47,-0.1 -0.968 83.3-129.7-125.3 113.5 22.4 68.3 13.8 69 72 A A + 0 0 20 -2,-0.5 238,-0.4 -3,-0.1 2,-0.3 -0.411 54.6 126.3 -58.9 127.4 21.1 64.7 13.9 70 73 A A E -A 21 0A 0 -49,-1.1 -49,-3.1 -2,-0.1 2,-0.5 -0.982 66.3 -81.2-171.5 162.7 19.2 64.1 10.6 71 74 A L E +Ae 20 308A 0 236,-2.9 238,-2.6 -2,-0.3 -51,-0.2 -0.776 39.1 177.4 -75.2 124.7 18.7 61.9 7.5 72 75 A K E - 0 0 72 -53,-2.9 2,-0.3 -2,-0.5 -52,-0.2 0.740 65.5 -2.4 -96.0 -31.7 21.4 63.0 5.0 73 76 A A E -A 19 0A 0 -54,-1.5 -54,-3.0 41,-0.0 2,-0.5 -0.917 47.4-158.4-163.5 131.8 20.6 60.4 2.3 74 77 A M E -Af 18 123A 0 48,-2.8 50,-2.1 -2,-0.3 2,-0.4 -0.979 32.1-155.6-111.6 115.5 18.3 57.5 1.7 75 78 A A E -Af 17 124A 0 -58,-2.9 -59,-3.0 -2,-0.5 -58,-1.6 -0.812 17.0-170.9-107.6 132.0 19.9 55.4 -1.1 76 79 A F E -Af 15 125A 0 48,-2.9 50,-1.3 -2,-0.4 2,-0.3 -0.952 22.3-131.2-111.6 136.9 18.4 53.0 -3.6 77 80 A R E -Af 14 126A 0 -63,-1.8 -64,-2.8 -2,-0.4 -63,-1.1 -0.707 21.5-149.6 -88.9 137.5 20.6 50.7 -5.8 78 81 A V E -A 12 0A 0 48,-2.9 -66,-0.2 -2,-0.3 6,-0.1 -0.657 21.1-112.7-108.4 162.6 19.7 50.8 -9.5 79 82 A R S S+ 0 0 102 -68,-2.4 -67,-0.1 -2,-0.2 -1,-0.1 0.828 88.5 9.9 -72.7 -36.2 20.2 47.9 -12.0 80 83 A T S >> S- 0 0 33 -69,-0.2 3,-1.0 1,-0.1 4,-0.5 -0.917 75.1-105.9-138.4 162.9 22.9 49.2 -14.3 81 84 A P H >> S+ 0 0 66 0, 0.0 3,-1.5 0, 0.0 4,-0.8 0.888 119.5 59.6 -52.5 -40.5 25.4 52.1 -14.5 82 85 A E H 3> S+ 0 0 105 1,-0.3 4,-1.9 2,-0.2 5,-0.1 0.731 92.1 68.0 -64.1 -23.6 23.1 53.6 -17.2 83 86 A D H <> S+ 0 0 4 -3,-1.0 4,-2.2 2,-0.2 -1,-0.3 0.733 91.7 59.6 -68.7 -22.9 20.2 53.7 -14.7 84 87 A V H S+ 0 0 0 -4,-2.4 5,-2.6 2,-0.2 -2,-0.2 0.782 111.8 56.8 -75.4 -25.2 14.8 64.3 -11.7 92 95 A Q H ><5S+ 0 0 103 -4,-1.8 3,-1.8 -5,-0.3 -1,-0.2 0.937 106.9 48.2 -65.0 -47.5 16.0 67.1 -14.0 93 96 A E H 3<5S+ 0 0 91 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.836 107.5 57.3 -62.8 -31.6 12.8 66.9 -15.9 94 97 A L T 3<5S- 0 0 29 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.560 117.0-118.6 -71.4 -9.2 11.0 67.0 -12.5 95 98 A G T < 5 + 0 0 71 -3,-1.8 2,-0.2 1,-0.3 -3,-0.2 0.660 63.5 147.8 79.3 17.6 12.8 70.3 -11.8 96 99 A C < - 0 0 18 -5,-2.6 -1,-0.3 1,-0.1 2,-0.2 -0.597 54.5-107.6 -89.5 145.9 14.6 68.9 -8.8 97 100 A R - 0 0 103 19,-0.4 19,-2.2 -2,-0.2 2,-0.3 -0.495 44.9-177.3 -65.1 134.6 18.0 69.9 -7.5 98 101 A T E -G 115 0A 29 17,-0.2 2,-0.3 -2,-0.2 17,-0.2 -0.949 19.2-167.6-134.9 154.4 20.6 67.1 -8.2 99 102 A E E -G 114 0A 56 15,-2.7 15,-3.4 -2,-0.3 2,-0.4 -0.967 9.5-165.9-141.7 128.7 24.3 66.5 -7.6 100 103 A R E -G 113 0A 68 -2,-0.3 2,-0.4 13,-0.2 13,-0.2 -0.971 6.3-175.6-121.5 135.0 26.3 63.7 -9.2 101 104 A R E > -G 112 0A 112 11,-2.3 3,-2.0 -2,-0.4 11,-1.7 -0.972 19.0-153.8-130.5 118.2 29.8 62.4 -8.2 102 105 A K T 3 S+ 0 0 157 -2,-0.4 9,-0.6 1,-0.3 -1,-0.1 0.686 101.0 42.4 -64.0 -19.4 31.6 59.8 -10.3 103 106 A D T 3 S- 0 0 134 7,-0.2 -1,-0.3 1,-0.2 6,-0.2 0.171 115.7-111.8-113.9 11.1 33.4 58.6 -7.1 104 107 A G < - 0 0 12 -3,-2.0 -1,-0.2 8,-0.2 7,-0.1 0.163 10.5-103.8 88.2 161.0 30.5 58.7 -4.6 105 108 A F S S+ 0 0 41 5,-0.2 2,-0.3 1,-0.1 -1,-0.1 0.678 103.6 30.5 -90.6 -30.1 29.5 60.8 -1.6 106 109 A V S > S- 0 0 7 4,-0.2 3,-1.3 3,-0.1 -1,-0.1 -0.908 100.1 -84.0-128.3 155.1 30.5 58.1 1.0 107 110 A K T 3 S+ 0 0 91 -2,-0.3 3,-0.1 1,-0.2 -2,-0.1 -0.278 111.0 30.1 -57.0 142.5 33.2 55.4 1.0 108 111 A G T 3 S+ 0 0 13 1,-0.2 22,-2.1 -50,-0.1 -50,-0.5 0.429 99.8 93.3 88.2 -1.4 32.2 52.1 -0.8 109 112 A I B < -I 129 0B 7 -3,-1.3 20,-0.3 20,-0.2 -1,-0.2 -0.982 53.0-170.5-121.0 135.3 29.9 53.7 -3.3 110 113 A G + 0 0 15 18,-2.4 -7,-0.2 -2,-0.4 -5,-0.2 0.238 62.5 12.2 -92.3-134.4 31.1 54.8 -6.8 111 114 A D S S+ 0 0 22 -9,-0.6 16,-0.8 -8,-0.2 17,-0.4 -0.135 79.3 168.7 -51.6 122.2 29.1 56.9 -9.3 112 115 A A E -GH 101 126A 0 -11,-1.7 -11,-2.3 14,-0.2 2,-0.5 -0.995 29.7-150.5-145.0 140.7 26.1 58.3 -7.4 113 116 A L E -GH 100 125A 0 12,-2.7 12,-2.5 -2,-0.3 2,-0.4 -0.966 13.3-166.7-111.4 123.9 23.3 60.8 -8.0 114 117 A R E -GH 99 124A 9 -15,-3.4 -15,-2.7 -2,-0.5 2,-0.3 -0.918 12.3-179.7-107.3 144.4 21.8 62.6 -5.0 115 118 A V E -GH 98 123A 0 8,-2.5 8,-1.5 -2,-0.4 2,-0.9 -0.979 36.8-130.4-137.6 151.1 18.6 64.6 -5.4 116 119 A E E - 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