==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 02-JUN-05 1ZVF . COMPND 2 MOLECULE: 3-HYDROXYANTHRANILATE 3,4-DIOXYGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR X.LI,M.GUO,M.TENG,L.NIU . 348 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17921.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 229 65.8 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 . 118 33.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 1.1 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 . 0 0.0 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 . 45 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 17 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 40 11.5 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 1 0 0 0 2 0 0 2 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 2 2 4 4 4 2 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 0 0 0 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 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 0 A A 0 0 64 0, 0.0 4,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 81.7 51.1 35.9 35.4 2 1 A M + 0 0 159 2,-0.1 2,-0.3 3,-0.0 246,-0.0 0.172 360.0 50.2 -97.0 6.8 53.1 32.9 34.0 3 2 A F S S- 0 0 38 267,-0.0 2,-0.3 0, 0.0 266,-0.1 -0.833 114.9 -76.5-126.9 167.3 51.3 34.1 31.0 4 3 A N + 0 0 74 -2,-0.3 -2,-0.1 264,-0.2 264,-0.0 -0.508 40.4 170.7 -70.0 129.4 51.0 37.7 29.6 5 4 A T + 0 0 35 -2,-0.3 -1,-0.1 -4,-0.1 264,-0.1 0.098 55.0 99.2-113.7 14.7 48.7 40.0 31.4 6 5 A T - 0 0 90 253,-0.1 255,-0.1 255,-0.0 -2,-0.1 -0.885 61.5-152.7-114.0 104.1 50.0 43.0 29.4 7 6 A P - 0 0 24 0, 0.0 2,-0.5 0, 0.0 260,-0.2 -0.219 15.1-127.2 -66.3 160.4 47.9 44.2 26.4 8 7 A I E -A 266 0A 48 258,-3.0 258,-3.4 256,-0.0 2,-0.7 -0.961 6.2-140.5-115.8 123.3 49.6 46.0 23.5 9 8 A N E > -A 265 0A 46 -2,-0.5 4,-2.5 256,-0.3 256,-0.2 -0.766 13.1-158.6 -78.0 118.7 48.5 49.3 22.2 10 9 A I H > S+ 0 0 0 254,-2.1 4,-3.1 -2,-0.7 -1,-0.2 0.926 88.4 52.9 -70.3 -44.0 48.8 48.9 18.5 11 10 A D H > S+ 0 0 78 253,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.899 115.2 41.6 -54.7 -46.0 48.9 52.7 17.8 12 11 A K H > S+ 0 0 132 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.869 113.5 52.5 -70.7 -39.0 51.8 53.1 20.3 13 12 A W H X S+ 0 0 16 -4,-2.5 4,-3.2 2,-0.2 -2,-0.2 0.904 109.0 52.8 -60.1 -39.5 53.4 50.0 19.1 14 13 A L H X S+ 0 0 25 -4,-3.1 4,-1.4 2,-0.2 -2,-0.2 0.937 107.2 48.5 -63.3 -51.5 53.2 51.4 15.5 15 14 A K H < S+ 0 0 195 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.874 120.1 41.5 -50.9 -40.2 54.9 54.7 16.4 16 15 A E H < S+ 0 0 119 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.893 131.2 20.2 -75.6 -42.6 57.6 52.7 18.1 17 16 A N H >X S+ 0 0 51 -4,-3.2 3,-2.0 -5,-0.2 4,-0.5 0.011 72.0 130.5-127.7 25.8 58.1 49.8 15.6 18 17 A E G >< S+ 0 0 137 -4,-1.4 3,-1.5 1,-0.3 -1,-0.1 0.836 74.5 59.8 -48.8 -41.2 56.7 51.0 12.2 19 18 A G G >4 S+ 0 0 42 1,-0.3 3,-1.1 2,-0.2 -1,-0.3 0.657 88.3 71.2 -66.0 -20.7 59.9 49.9 10.5 20 19 A L G <4 S+ 0 0 79 -3,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.811 94.1 58.5 -61.4 -26.6 59.4 46.3 11.6 21 20 A L G << S+ 0 0 10 -3,-1.5 20,-0.4 -4,-0.5 -1,-0.2 0.502 83.9 107.1 -87.8 -4.3 56.6 46.2 9.1 22 21 A K S < S- 0 0 140 -3,-1.1 3,-0.4 -4,-0.1 5,-0.1 -0.332 73.2 -58.1 -67.9 149.7 58.8 47.1 6.1 23 22 A P S S+ 0 0 67 0, 0.0 -1,-0.1 0, 0.0 21,-0.1 -0.265 110.3 35.8 -53.5 154.1 59.7 44.5 3.4 24 23 A P S S+ 0 0 121 0, 0.0 2,-1.0 0, 0.0 3,-0.1 -0.966 131.9 28.5 -84.7 -20.7 61.1 41.9 3.2 25 24 A V S S+ 0 0 97 -3,-0.4 -3,-0.1 1,-0.1 19,-0.0 -0.789 71.3 165.0 -99.9 90.7 59.7 40.6 6.6 26 25 A N + 0 0 9 -2,-1.0 15,-2.3 15,-0.1 2,-0.5 0.387 47.8 80.1 -91.6 1.8 56.5 42.7 6.7 27 26 A N E -F 40 0B 73 13,-0.2 2,-0.4 -5,-0.1 13,-0.2 -0.942 55.3-168.1-118.7 125.7 54.7 40.7 9.5 28 27 A Y E -F 39 0B 97 11,-3.1 11,-3.0 -2,-0.5 2,-0.9 -0.926 21.4-130.2-112.5 141.2 55.3 41.1 13.2 29 28 A C E +F 38 0B 44 -2,-0.4 9,-0.2 9,-0.2 3,-0.1 -0.759 26.3 174.8-100.0 103.7 54.0 38.7 15.7 30 29 A L E + 0 0 15 7,-1.6 2,-0.3 -2,-0.9 8,-0.2 0.833 69.9 13.5 -75.4 -38.3 52.1 40.4 18.6 31 30 A H E -F 37 0B 15 6,-1.5 6,-2.6 236,-0.1 2,-0.3 -0.996 64.2-174.5-143.6 137.1 50.9 37.3 20.4 32 31 A K + 0 0 160 -2,-0.3 4,-0.2 4,-0.2 236,-0.1 -0.964 40.8 77.8-128.5 151.4 51.6 33.5 20.2 33 32 A G S S- 0 0 44 -2,-0.3 2,-1.0 2,-0.2 -1,-0.1 0.623 108.9 -8.2 118.8 95.9 50.3 30.4 21.7 34 33 A G S S+ 0 0 19 236,-0.1 80,-2.3 198,-0.1 2,-0.4 -0.507 138.7 42.5 88.1 -61.5 47.0 28.8 20.5 35 34 A F E S- G 0 113B 0 -2,-1.0 2,-0.6 78,-0.2 78,-0.3 -0.933 74.6-147.7-110.2 140.6 46.4 31.8 18.3 36 35 A T E - G 0 112B 27 76,-3.1 76,-2.1 -2,-0.4 2,-0.6 -0.955 17.7-168.1-103.8 114.5 49.1 33.5 16.2 37 36 A V E -FG 31 111B 0 -6,-2.6 -7,-1.6 -2,-0.6 -6,-1.5 -0.930 10.4-176.2-107.9 114.2 48.2 37.2 16.1 38 37 A M E -FG 29 110B 30 72,-3.0 72,-2.1 -2,-0.6 2,-0.4 -0.789 23.1-148.7-112.9 151.8 50.2 39.2 13.5 39 38 A I E -FG 28 109B 0 -11,-3.0 -11,-3.1 -2,-0.3 2,-0.4 -0.983 27.6-169.8-117.3 131.3 50.4 42.9 12.5 40 39 A V E +FG 27 108B 7 68,-2.6 68,-2.5 -2,-0.4 -13,-0.2 -0.981 15.2 177.0-138.3 126.8 51.3 43.3 8.9 41 40 A G + 0 0 3 -15,-2.3 66,-0.1 -2,-0.4 -15,-0.1 -0.209 25.3 72.1-104.7-159.3 52.3 46.1 6.6 42 41 A G S S- 0 0 12 64,-0.3 63,-0.5 1,-0.1 61,-0.2 -0.873 76.1 -82.4-158.8-174.9 53.3 46.3 2.9 43 42 A P S S+ 0 0 70 0, 0.0 2,-0.3 0, 0.0 60,-0.3 0.477 71.1 146.1 -74.8 145.4 53.9 46.4 0.1 44 43 A N B +K 102 0C 34 58,-2.1 58,-2.4 -2,-0.1 2,-0.3 -0.857 9.8 148.3-150.7 118.5 54.1 42.7 -0.0 45 44 A E + 0 0 90 -2,-0.3 2,-0.3 56,-0.2 56,-0.1 -0.993 13.0 177.6-141.0 160.1 53.1 40.2 -2.7 46 45 A R - 0 0 72 -2,-0.3 128,-0.3 54,-0.3 127,-0.1 -0.958 38.1-120.9-146.4 156.1 54.2 36.8 -4.0 47 46 A T S S+ 0 0 42 126,-1.4 79,-0.5 -2,-0.3 127,-0.1 0.655 82.1 103.0 -70.5 -14.5 52.7 34.7 -6.8 48 47 A D - 0 0 7 125,-0.5 2,-0.4 77,-0.1 -2,-0.2 -0.322 60.2-147.1 -80.4 149.7 52.0 31.8 -4.4 49 48 A Y E -L 124 0C 22 75,-3.4 75,-2.7 50,-0.1 2,-0.3 -0.955 15.1-142.0-111.0 136.9 48.7 30.8 -2.8 50 49 A H E -LM 123 98C 35 48,-3.4 48,-1.9 -2,-0.4 2,-0.5 -0.662 4.5-153.7 -94.7 147.1 48.7 29.4 0.7 51 50 A I E -L 122 0C 3 71,-2.3 71,-1.8 -2,-0.3 43,-0.1 -0.930 11.9-173.3-128.1 109.9 46.4 26.6 1.8 52 51 A N - 0 0 1 -2,-0.5 43,-3.5 44,-0.4 44,-0.4 -0.899 23.0-150.0-102.3 120.6 45.6 26.5 5.5 53 52 A P S S+ 0 0 23 0, 0.0 41,-0.2 0, 0.0 -1,-0.1 0.550 89.5 52.6 -63.9 -7.1 43.6 23.5 6.9 54 53 A T S S- 0 0 11 39,-0.1 41,-0.3 59,-0.1 -2,-0.2 -0.755 99.1 -88.8-124.2 167.6 42.4 26.1 9.4 55 54 A P - 0 0 9 0, 0.0 58,-0.6 0, 0.0 2,-0.4 -0.414 27.1-150.3 -79.9 158.3 40.8 29.6 9.0 56 55 A E E -HI 92 112B 6 36,-1.9 36,-2.9 56,-0.1 2,-0.5 -0.997 7.2-152.3-124.9 130.9 42.5 32.9 8.8 57 56 A W E -HI 91 111B 0 54,-2.7 54,-2.4 -2,-0.4 2,-0.4 -0.904 11.4-163.8-105.7 130.3 40.9 36.2 10.1 58 57 A F E +HI 90 110B 2 32,-2.4 32,-2.1 -2,-0.5 2,-0.3 -0.877 10.8 177.0-113.6 141.4 41.8 39.5 8.5 59 58 A Y E -HI 89 109B 10 50,-2.2 50,-3.0 -2,-0.4 2,-0.9 -0.958 19.9-144.6-142.8 126.9 41.3 43.0 9.8 60 59 A Q E + I 0 108B 0 28,-1.6 27,-3.6 25,-0.4 48,-0.2 -0.787 20.4 172.7 -97.9 107.4 42.5 46.2 8.2 61 60 A K E S+ 0 0 41 46,-1.4 2,-0.4 -2,-0.9 -1,-0.2 0.947 76.8 16.4 -72.2 -50.7 43.5 48.8 10.7 62 61 A K E S- I 0 107B 92 45,-2.0 45,-2.9 24,-0.1 -1,-0.3 -0.980 118.5 -18.9-131.5 125.5 44.8 51.2 8.0 63 62 A G S S- 0 0 18 -2,-0.4 2,-0.2 43,-0.2 24,-0.2 0.013 82.4 -67.8 74.9 177.1 44.2 51.1 4.3 64 63 A S - 0 0 39 21,-0.1 39,-0.5 22,-0.1 2,-0.3 -0.607 36.8-156.9-106.4 164.5 43.0 48.3 2.2 65 64 A M E -NO 84 102C 1 19,-2.1 19,-2.3 -2,-0.2 2,-0.6 -0.899 17.1-126.7-131.9 162.7 44.4 45.0 1.1 66 65 A L E -NO 83 101C 26 35,-3.3 35,-3.9 -2,-0.3 2,-0.7 -0.953 20.1-170.5-111.4 115.6 43.8 42.5 -1.8 67 66 A L E -NO 82 100C 0 15,-3.2 15,-3.1 -2,-0.6 2,-0.4 -0.904 8.9-160.0-107.5 104.9 43.0 38.9 -0.8 68 67 A K E +NO 81 99C 60 31,-2.2 31,-2.7 -2,-0.7 2,-0.3 -0.718 16.7 178.7 -82.8 128.3 43.1 36.7 -3.8 69 68 A V E -NO 80 98C 1 11,-3.2 11,-2.4 -2,-0.4 2,-0.5 -0.926 25.5-139.4-129.2 153.9 41.2 33.4 -3.3 70 69 A V E -N 79 0C 2 27,-2.4 2,-0.6 -2,-0.3 9,-0.2 -0.971 11.9-154.3-111.0 126.2 40.3 30.4 -5.4 71 70 A D E +N 78 0C 12 7,-3.1 7,-1.7 -2,-0.5 3,-0.2 -0.907 16.1 175.5 -96.3 118.3 36.9 28.9 -5.0 72 71 A E + 0 0 92 -2,-0.6 -1,-0.1 5,-0.2 107,-0.0 0.134 43.4 113.5-109.6 14.8 37.1 25.2 -5.9 73 72 A T S S+ 0 0 51 5,-0.1 -1,-0.2 107,-0.0 2,-0.1 0.834 76.7 32.9 -58.9 -39.1 33.5 24.4 -5.0 74 73 A D S S- 0 0 102 2,-0.4 4,-0.1 -3,-0.2 0, 0.0 -0.243 102.3 -78.4-109.8-166.6 32.4 23.5 -8.6 75 74 A A S S+ 0 0 94 -2,-0.1 -1,-0.0 2,-0.1 0, 0.0 0.977 114.7 42.6 -62.4 -59.6 33.9 22.1 -11.8 76 75 A E S S- 0 0 142 1,-0.1 -2,-0.4 -3,-0.0 -3,-0.0 -0.687 93.2-114.1 -88.5 142.6 35.8 25.1 -12.9 77 76 A P - 0 0 55 0, 0.0 2,-0.5 0, 0.0 -5,-0.2 -0.271 19.5-142.4 -68.3 159.4 37.7 27.2 -10.4 78 77 A K E -N 71 0C 74 -7,-1.7 -7,-3.1 -4,-0.1 2,-0.8 -0.997 5.2-154.1-126.3 121.4 36.7 30.8 -9.6 79 78 A F E -N 70 0C 52 -2,-0.5 2,-0.4 -9,-0.2 -9,-0.2 -0.889 22.4-176.9 -99.3 105.1 39.5 33.3 -9.0 80 79 A I E -N 69 0C 44 -11,-2.4 -11,-3.2 -2,-0.8 2,-0.7 -0.887 22.1-148.8-110.0 132.1 38.1 36.0 -6.8 81 80 A D E -N 68 0C 90 -2,-0.4 2,-0.7 -13,-0.2 -13,-0.2 -0.915 14.2-160.2 -92.8 116.1 39.8 39.1 -5.6 82 81 A I E -N 67 0C 4 -15,-3.1 -15,-3.2 -2,-0.7 2,-0.6 -0.887 5.7-152.6 -95.3 117.2 38.4 40.0 -2.2 83 82 A I E -N 66 0C 98 -2,-0.7 2,-0.8 -17,-0.2 -17,-0.2 -0.817 6.0-162.8 -89.5 121.5 39.1 43.7 -1.4 84 83 A I E -N 65 0C 0 -19,-2.3 -19,-2.1 -2,-0.6 3,-0.1 -0.900 14.1-158.6-111.2 100.5 39.3 44.2 2.3 85 84 A N > - 0 0 83 -2,-0.8 3,-2.2 -21,-0.2 -25,-0.4 -0.172 36.8 -67.6 -75.0 167.4 38.9 47.9 2.9 86 85 A E T 3 S+ 0 0 114 1,-0.3 -25,-0.2 -27,-0.1 -1,-0.2 -0.287 125.9 17.8 -53.3 139.6 40.1 49.9 6.0 87 86 A G T 3 S+ 0 0 4 -27,-3.6 100,-2.3 1,-0.2 101,-0.3 0.480 96.0 137.9 73.8 3.4 38.0 48.8 9.0 88 87 A D E < - 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