==== 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 05-APR-06 2GM6 . COMPND 2 MOLECULE: CYSTEINE DIOXYGENASE TYPE I; . SOURCE 2 ORGANISM_SCIENTIFIC: RALSTONIA EUTROPHA; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 192 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9612.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 118 61.5 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 . 56 29.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 15 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 29 15.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 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 0 0 0 0 0 0 0 0 0 0 1 0 1 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 . 4 0 2 2 1 2 1 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 . 1 0 0 1 0 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 11 A S 0 0 122 0, 0.0 4,-0.1 0, 0.0 40,-0.1 0.000 360.0 360.0 360.0 -50.4 21.1 14.2 50.4 2 12 A L >> + 0 0 35 1,-0.1 4,-1.8 184,-0.1 3,-0.7 0.356 360.0 102.8 -81.2 0.3 24.7 15.6 50.4 3 13 A A H 3> + 0 0 21 1,-0.3 4,-3.0 2,-0.2 5,-0.2 0.832 69.9 58.9 -56.8 -40.5 25.6 11.9 51.0 4 14 A P H 3> S+ 0 0 37 0, 0.0 4,-1.9 0, 0.0 -1,-0.3 0.904 107.9 48.3 -55.0 -38.7 26.7 11.4 47.4 5 15 A L H <> S+ 0 0 1 -3,-0.7 4,-2.4 2,-0.2 -2,-0.2 0.932 111.7 47.5 -67.1 -46.0 29.2 14.2 47.9 6 16 A R H X S+ 0 0 32 -4,-1.8 4,-2.6 1,-0.2 5,-0.3 0.917 111.7 52.3 -57.0 -45.3 30.5 12.6 51.2 7 17 A E H X S+ 0 0 122 -4,-3.0 4,-2.3 1,-0.2 -2,-0.2 0.868 109.1 48.9 -62.1 -38.4 30.7 9.2 49.5 8 18 A F H X S+ 0 0 6 -4,-1.9 4,-3.0 -5,-0.2 5,-0.3 0.946 111.6 49.3 -62.5 -51.4 32.8 10.7 46.7 9 19 A I H X S+ 0 0 6 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.912 116.4 41.4 -53.7 -48.7 35.2 12.4 49.1 10 20 A T H X S+ 0 0 71 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.864 115.7 49.9 -75.7 -35.7 35.7 9.3 51.2 11 21 A G H X S+ 0 0 25 -4,-2.3 4,-1.8 -5,-0.3 -2,-0.2 0.884 113.5 45.9 -65.2 -42.0 36.0 7.0 48.2 12 22 A L H X S+ 0 0 1 -4,-3.0 4,-2.7 2,-0.2 -2,-0.2 0.903 110.9 53.6 -68.8 -38.3 38.5 9.3 46.5 13 23 A S H X S+ 0 0 31 -4,-2.1 4,-1.9 -5,-0.3 -2,-0.2 0.925 108.7 49.4 -60.5 -42.5 40.4 9.6 49.7 14 24 A A H X S+ 0 0 49 -4,-2.0 4,-0.5 2,-0.2 -1,-0.2 0.861 110.8 49.6 -66.1 -38.5 40.6 5.8 50.0 15 25 A L H >< S+ 0 0 10 -4,-1.8 3,-1.4 1,-0.2 -2,-0.2 0.946 112.5 47.3 -60.8 -51.1 41.9 5.5 46.4 16 26 A L H >< S+ 0 0 14 -4,-2.7 3,-2.0 1,-0.3 -2,-0.2 0.796 98.2 69.7 -67.0 -26.7 44.5 8.1 47.0 17 27 A D H 3< S+ 0 0 101 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.745 92.2 61.9 -59.0 -23.2 45.6 6.4 50.3 18 28 A E T << S- 0 0 114 -3,-1.4 -1,-0.3 -4,-0.5 -2,-0.2 0.420 108.5-126.8 -82.0 -1.1 47.0 3.6 48.0 19 29 A Q < - 0 0 167 -3,-2.0 -3,-0.1 1,-0.1 -2,-0.1 0.925 40.8-172.1 53.1 51.4 49.4 6.0 46.4 20 30 A P - 0 0 20 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.281 24.9-105.1 -69.0 155.7 48.2 5.1 42.8 21 31 A G > - 0 0 51 1,-0.1 4,-2.0 4,-0.0 3,-0.2 -0.336 39.1-101.1 -67.5 163.0 49.9 6.4 39.7 22 32 A E H > S+ 0 0 53 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.854 119.2 60.0 -56.8 -38.0 48.1 9.1 37.7 23 33 A A H > S+ 0 0 69 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.938 109.3 43.7 -61.5 -43.1 46.7 6.7 35.1 24 34 A R H >>S+ 0 0 62 -3,-0.2 4,-2.6 1,-0.2 5,-0.7 0.883 111.3 54.2 -68.2 -39.7 44.8 4.8 37.8 25 35 A I H X5S+ 0 0 13 -4,-2.0 4,-1.6 3,-0.2 5,-0.4 0.930 111.2 46.0 -53.7 -48.0 43.7 8.1 39.5 26 36 A L H X5S+ 0 0 22 -4,-2.7 4,-0.9 3,-0.2 -2,-0.2 0.915 120.3 38.4 -67.4 -40.3 42.2 9.3 36.3 27 37 A R H X5S+ 0 0 158 -4,-2.1 4,-1.9 -5,-0.2 -2,-0.2 0.960 126.6 32.9 -73.4 -58.3 40.5 6.0 35.5 28 38 A E H X5S+ 0 0 75 -4,-2.6 4,-1.7 2,-0.2 -3,-0.2 0.881 122.9 47.7 -72.5 -37.7 39.3 4.9 38.9 29 39 A G H X< S+ 0 0 8 -4,-1.8 3,-0.5 1,-0.2 -2,-0.2 0.916 118.3 39.2 -61.3 -45.7 28.6 11.5 41.7 37 47 A V H 3< S+ 0 0 3 -4,-2.5 87,-0.2 1,-0.2 -1,-0.2 0.462 93.6 85.9 -90.9 2.1 27.4 13.3 38.5 38 48 A A H 3< S+ 0 0 70 -4,-0.9 2,-0.4 -3,-0.4 -1,-0.2 0.817 97.9 36.4 -66.9 -35.2 25.2 10.4 37.2 39 49 A R S << S- 0 0 75 -4,-0.5 2,-1.1 -3,-0.5 3,-0.2 -0.994 73.8-151.0-125.0 129.0 22.3 11.7 39.3 40 50 A D + 0 0 68 -2,-0.4 -3,-0.1 1,-0.2 -4,-0.0 -0.575 64.7 105.2-100.4 66.6 21.7 15.4 39.9 41 51 A D + 0 0 108 -2,-1.1 -1,-0.2 -40,-0.1 -4,-0.0 0.133 69.3 53.6-130.6 20.1 20.1 15.2 43.3 42 52 A W S S+ 0 0 8 -3,-0.2 -2,-0.1 -6,-0.1 -37,-0.1 0.584 72.0 100.9-133.1 -23.6 22.8 16.4 45.8 43 53 A L - 0 0 11 1,-0.0 2,-0.1 2,-0.0 -41,-0.0 -0.617 68.7-132.2 -74.6 118.3 24.1 19.8 44.6 44 54 A P > - 0 0 45 0, 0.0 3,-2.0 0, 0.0 4,-0.1 -0.368 16.6-119.2 -66.9 147.2 22.5 22.6 46.7 45 55 A D G > S+ 0 0 115 1,-0.3 3,-2.1 2,-0.2 4,-0.3 0.825 111.4 67.4 -55.8 -34.6 21.1 25.6 44.8 46 56 A A G 3 S+ 0 0 67 1,-0.3 3,-0.3 2,-0.2 -1,-0.3 0.753 102.4 47.1 -59.2 -25.6 23.5 27.9 46.6 47 57 A F G < S+ 0 0 17 -3,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.210 109.5 55.6 -99.2 18.0 26.4 26.2 44.7 48 58 A A S < S+ 0 0 6 -3,-2.1 -2,-0.2 -4,-0.1 -1,-0.2 0.222 73.6 118.5-132.7 8.2 24.7 26.4 41.3 49 59 A Q - 0 0 107 -3,-0.3 25,-0.1 -4,-0.3 2,-0.1 -0.673 54.3-139.5 -86.8 129.0 24.0 30.1 40.9 50 60 A P - 0 0 53 0, 0.0 5,-0.1 0, 0.0 25,-0.1 -0.393 6.1-131.7 -82.6 164.3 25.6 31.8 38.0 51 61 A H - 0 0 64 3,-0.7 25,-0.2 23,-0.3 5,-0.1 -0.920 18.6-127.4-110.3 141.0 27.2 35.3 37.9 52 62 A P S S+ 0 0 107 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.798 103.9 22.5 -61.4 -28.0 26.3 37.6 35.1 53 63 A E S S+ 0 0 130 1,-0.2 2,-0.4 26,-0.0 23,-0.0 0.770 122.9 39.5-105.4 -37.7 29.9 38.3 34.1 54 64 A Y S S- 0 0 153 25,-0.1 -3,-0.7 21,-0.0 -1,-0.2 -0.938 74.9-117.8-124.8 140.5 32.0 35.5 35.4 55 65 A Y - 0 0 41 -2,-0.4 2,-0.4 25,-0.2 20,-0.2 -0.440 42.5-119.7 -63.6 146.8 31.7 31.8 35.6 56 66 A Q E -A 74 0A 34 18,-1.9 18,-2.3 -2,-0.1 2,-0.6 -0.801 21.0-165.0-102.3 135.2 31.8 30.7 39.2 57 67 A Q E -A 73 0A 22 -2,-0.4 123,-2.9 16,-0.2 2,-0.6 -0.937 17.4-177.2-118.4 101.6 34.3 28.4 40.8 58 68 A X E -A 72 0A 23 14,-2.7 14,-2.8 -2,-0.6 2,-0.2 -0.894 22.4-133.3-108.9 114.9 32.9 27.4 44.1 59 69 A L E +A 71 0A 17 -2,-0.6 12,-0.3 12,-0.2 3,-0.1 -0.516 24.5 176.8 -65.0 130.1 35.0 25.2 46.4 60 70 A L E - 0 0 4 10,-3.3 2,-0.3 1,-0.4 11,-0.2 0.696 66.7 -9.5-100.1 -33.4 33.0 22.3 47.8 61 71 A H E -A 70 0A 29 9,-1.4 9,-2.8 123,-0.1 2,-0.4 -0.930 52.9-160.3-166.8 138.2 35.8 20.5 49.7 62 72 A C E -A 69 0A 39 -2,-0.3 7,-0.2 7,-0.2 2,-0.2 -1.000 27.6-120.3-127.3 133.7 39.5 20.5 50.1 63 73 A D > - 0 0 17 5,-2.6 3,-2.1 -2,-0.4 5,-0.1 -0.463 17.8-130.9 -65.4 133.2 41.6 17.7 51.4 64 74 A S T 3 S+ 0 0 125 1,-0.3 -1,-0.1 -2,-0.2 0, 0.0 0.840 112.4 46.0 -50.9 -40.5 43.7 18.5 54.6 65 75 A A T 3 S- 0 0 70 3,-0.1 -1,-0.3 91,-0.0 -2,-0.1 0.315 113.9-121.5 -89.0 6.3 46.8 17.0 53.0 66 76 A E S < S+ 0 0 117 -3,-2.1 91,-0.2 2,-0.2 -2,-0.1 0.774 70.9 135.3 51.2 36.9 46.0 18.9 49.7 67 77 A R S S- 0 0 66 1,-0.3 2,-0.3 89,-0.1 -1,-0.1 0.731 75.7 -7.2 -77.5 -27.9 45.8 15.7 47.7 68 78 A F - 0 0 0 87,-0.2 -5,-2.6 -5,-0.1 2,-0.3 -0.978 55.6-156.5-162.6 158.7 42.7 17.0 46.0 69 79 A S E -AB 62 154A 0 85,-1.6 85,-2.1 -2,-0.3 2,-0.4 -0.981 13.1-144.8-138.5 151.5 40.0 19.7 45.9 70 80 A I E -AB 61 153A 0 -9,-2.8 -10,-3.3 -2,-0.3 -9,-1.4 -0.977 19.3-178.2-122.7 131.1 36.5 19.6 44.5 71 81 A V E -AB 59 152A 0 81,-2.7 81,-2.9 -2,-0.4 2,-0.6 -0.971 25.6-137.9-134.4 138.6 34.8 22.6 42.8 72 82 A S E -AB 58 151A 0 -14,-2.8 -14,-2.7 -2,-0.4 2,-0.7 -0.883 21.9-157.7 -92.6 116.1 31.4 23.4 41.3 73 83 A F E -AB 57 150A 9 77,-3.2 77,-2.0 -2,-0.6 2,-0.7 -0.920 5.8-160.6 -96.2 113.7 32.0 25.3 38.0 74 84 A V E -AB 56 149A 0 -18,-2.3 -18,-1.9 -2,-0.7 2,-0.7 -0.878 0.5-160.2-105.5 112.3 28.8 27.2 37.2 75 85 A W E - B 0 148A 1 73,-3.1 73,-2.0 -2,-0.7 3,-0.1 -0.810 5.9-154.0 -89.7 111.3 28.6 28.3 33.6 76 86 A G > - 0 0 1 -2,-0.7 3,-2.3 71,-0.2 65,-0.2 -0.400 54.1 -54.6 -70.8 165.2 26.2 31.2 33.0 77 87 A P T 3 S- 0 0 67 0, 0.0 67,-0.3 0, 0.0 -1,-0.2 -0.141 123.8 -9.1 -43.9 124.1 24.7 31.3 29.4 78 88 A G T 3 S+ 0 0 33 65,-3.0 66,-0.1 68,-0.4 69,-0.1 0.509 93.3 153.9 65.7 11.0 27.4 31.3 26.8 79 89 A Q < - 0 0 22 -3,-2.3 62,-2.5 64,-0.2 2,-0.3 -0.312 18.4-176.0 -75.3 151.6 30.3 31.8 29.3 80 90 A R B -E 140 0B 124 60,-0.2 60,-0.2 -25,-0.0 -25,-0.2 -0.972 21.0-120.7-144.1 159.7 33.9 30.6 28.5 81 91 A T - 0 0 7 58,-2.9 2,-0.1 -2,-0.3 3,-0.0 -0.551 29.2-114.1 -86.8 159.8 37.4 30.2 30.0 82 92 A P - 0 0 44 0, 0.0 2,-0.4 0, 0.0 57,-0.3 -0.399 52.1 -80.7 -72.7 171.4 40.5 31.7 28.7 83 93 A I S S+ 0 0 12 83,-0.4 83,-2.7 55,-0.1 2,-0.3 -0.650 72.6 152.4 -70.0 132.1 43.1 29.2 27.4 84 94 A H B -FG 137 165B 13 53,-2.2 53,-2.1 -2,-0.4 81,-0.2 -0.968 37.4-131.8-155.8 167.1 44.9 27.9 30.4 85 95 A D - 0 0 10 79,-2.1 51,-0.1 -2,-0.3 78,-0.1 -0.414 5.2-151.5-115.3-173.5 46.8 25.0 31.9 86 96 A H - 0 0 0 -2,-0.1 -1,-0.1 77,-0.1 3,-0.1 0.577 12.7-151.5-128.3 -41.3 46.5 23.1 35.3 87 97 A T S S+ 0 0 61 1,-0.2 2,-0.3 48,-0.1 75,-0.0 0.312 77.6 58.4 73.8 -3.9 50.0 21.7 36.2 88 98 A V S S- 0 0 30 47,-0.1 -1,-0.2 68,-0.0 68,-0.1 -0.897 101.5 -77.0-141.0 166.4 48.2 18.8 38.1 89 99 A W - 0 0 24 -2,-0.3 66,-2.4 66,-0.2 2,-0.3 -0.342 49.9-175.9 -64.0 147.6 45.7 16.1 37.3 90 100 A G E -CD 129 154A 0 39,-2.4 39,-2.3 64,-0.2 2,-0.4 -0.989 16.9-160.1-144.8 146.9 42.1 17.1 36.9 91 101 A L E -CD 128 153A 4 62,-2.6 62,-2.7 -2,-0.3 2,-0.5 -0.991 8.0-160.1-123.3 135.3 38.8 15.4 36.3 92 102 A I E -CD 127 152A 1 35,-2.8 35,-2.2 -2,-0.4 2,-0.5 -0.985 5.5-169.6-120.4 122.0 35.7 17.2 35.0 93 103 A G E -CD 126 151A 0 58,-2.7 58,-3.0 -2,-0.5 2,-0.4 -0.952 19.3-134.2-115.5 120.8 32.3 15.6 35.5 94 104 A X E + D 0 150A 0 31,-2.4 30,-2.9 -2,-0.5 56,-0.2 -0.624 29.4 168.9 -75.8 128.5 29.3 17.1 33.7 95 105 A L E + 0 0 6 54,-2.7 2,-0.3 1,-0.4 55,-0.2 0.828 64.0 0.9-106.1 -51.9 26.3 17.5 36.0 96 106 A R E S- D 0 149A 70 53,-2.1 53,-3.0 27,-0.1 -1,-0.4 -0.993 116.7 -1.2-145.3 148.7 23.8 19.6 34.1 97 107 A G S S- 0 0 20 -2,-0.3 2,-0.3 51,-0.3 51,-0.1 -0.516 86.2 -99.1 70.7-139.7 23.8 21.2 30.6 98 108 A A - 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