==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 13-DEC-12 4IEW . COMPND 2 MOLECULE: CYSTEINE DIOXYGENASE TYPE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR C.M.DRIGGERS,R.B.COOLEY,P.A.KARPLUS . 187 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9476.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 125 66.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 3 1.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 59 31.6 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 1.1 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 . 21 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 22 11.8 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 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 2 0 1 3 1 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 0 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 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 5 A E 0 0 210 0, 0.0 2,-0.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 113.5 -24.3 21.4 -34.2 2 6 A L - 0 0 68 16,-0.0 2,-0.3 3,-0.0 27,-0.0 -0.735 360.0-178.1 -90.2 119.2 -23.7 20.3 -37.8 3 7 A L - 0 0 102 -2,-0.6 32,-0.1 1,-0.0 11,-0.0 -0.815 36.8 -92.5-113.3 155.6 -22.0 22.8 -40.0 4 8 A K - 0 0 110 -2,-0.3 2,-0.3 1,-0.1 28,-0.1 -0.480 42.4-121.2 -62.8 122.1 -21.1 22.7 -43.7 5 9 A P - 0 0 1 0, 0.0 32,-0.5 0, 0.0 -1,-0.1 -0.527 18.1-157.8 -65.1 131.5 -17.6 21.4 -44.2 6 10 A R S S- 0 0 191 -2,-0.3 2,-0.3 1,-0.1 3,-0.0 0.719 71.3 -2.8 -81.8 -24.3 -15.6 24.1 -46.1 7 11 A T S > S- 0 0 47 1,-0.1 4,-2.6 35,-0.0 5,-0.2 -0.930 81.8 -91.9-157.9 169.4 -13.0 21.7 -47.3 8 12 A L H > S+ 0 0 6 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.897 126.1 52.6 -59.9 -42.6 -11.9 18.1 -47.0 9 13 A A H > S+ 0 0 70 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.909 110.0 48.6 -60.5 -38.9 -9.7 19.0 -44.1 10 14 A D H > S+ 0 0 16 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.913 108.6 53.4 -68.0 -42.3 -12.6 20.7 -42.4 11 15 A L H X S+ 0 0 0 -4,-2.6 4,-2.8 2,-0.2 -2,-0.2 0.928 108.0 51.1 -55.4 -45.4 -14.8 17.6 -43.1 12 16 A I H X S+ 0 0 25 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.937 108.7 50.5 -62.1 -45.3 -12.2 15.4 -41.4 13 17 A R H X S+ 0 0 97 -4,-2.2 4,-1.3 1,-0.2 -1,-0.2 0.934 111.2 49.4 -55.5 -44.2 -12.1 17.7 -38.4 14 18 A I H X S+ 0 0 7 -4,-2.6 4,-2.5 1,-0.2 3,-0.3 0.910 107.3 54.1 -65.3 -40.5 -15.9 17.5 -38.2 15 19 A L H X S+ 0 0 0 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.908 102.3 57.5 -61.6 -39.2 -15.8 13.7 -38.4 16 20 A H H < S+ 0 0 64 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.891 109.9 45.8 -60.6 -32.9 -13.5 13.5 -35.5 17 21 A E H >< S+ 0 0 108 -4,-1.3 3,-1.6 -3,-0.3 4,-0.3 0.916 110.6 51.9 -71.5 -42.8 -16.1 15.4 -33.5 18 22 A L H 3< S+ 0 0 36 -4,-2.5 7,-0.3 1,-0.3 3,-0.3 0.785 115.4 41.7 -68.5 -26.8 -19.0 13.2 -34.7 19 23 A F T 3< S+ 0 0 2 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.159 82.0 105.9-103.4 17.4 -17.2 10.1 -33.8 20 24 A A S < S+ 0 0 67 -3,-1.6 -1,-0.2 -5,-0.1 -2,-0.1 0.789 79.1 52.9 -65.6 -26.2 -15.9 11.5 -30.4 21 25 A G S S- 0 0 38 -3,-0.3 44,-0.0 -4,-0.3 -3,-0.0 -0.168 98.3 -99.2 -98.3-167.3 -18.4 9.3 -28.6 22 26 A D S S+ 0 0 144 -2,-0.1 2,-0.2 2,-0.0 -3,-0.1 0.521 97.3 55.9 -95.4 -9.8 -19.3 5.6 -28.7 23 27 A E S S- 0 0 166 2,-0.0 2,-0.5 0, 0.0 -2,-0.3 -0.672 74.5-128.1-120.3 174.4 -22.3 5.7 -31.0 24 28 A V - 0 0 29 -2,-0.2 2,-1.1 130,-0.0 3,-0.1 -0.986 1.7-149.7-131.0 121.4 -22.8 7.0 -34.5 25 29 A N > - 0 0 66 -2,-0.5 4,-2.5 -7,-0.3 3,-0.3 -0.783 19.5-170.6 -87.9 96.6 -25.6 9.3 -35.6 26 30 A V H > S+ 0 0 20 -2,-1.1 4,-2.8 1,-0.3 5,-0.2 0.870 80.0 50.0 -62.3 -40.7 -25.9 8.0 -39.2 27 31 A E H > S+ 0 0 140 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.868 112.5 48.3 -70.4 -32.9 -28.2 10.7 -40.5 28 32 A E H > S+ 0 0 77 -3,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.920 113.4 46.4 -69.8 -45.3 -25.9 13.4 -39.1 29 33 A V H X S+ 0 0 1 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.920 113.9 48.9 -64.6 -42.5 -22.7 11.8 -40.6 30 34 A Q H X S+ 0 0 56 -4,-2.8 4,-2.7 -5,-0.2 -1,-0.2 0.929 111.2 50.0 -61.6 -42.9 -24.5 11.3 -43.9 31 35 A A H X S+ 0 0 53 -4,-2.0 4,-2.0 -5,-0.2 -2,-0.2 0.916 111.6 48.4 -64.8 -38.8 -25.7 14.9 -44.0 32 36 A V H X S+ 0 0 3 -4,-2.3 4,-1.0 2,-0.2 -1,-0.2 0.931 112.4 47.7 -68.6 -44.2 -22.2 16.2 -43.2 33 37 A L H >< S+ 0 0 1 -4,-2.7 3,-0.7 1,-0.2 -2,-0.2 0.917 112.4 49.8 -60.9 -41.7 -20.6 14.1 -45.9 34 38 A E H 3< S+ 0 0 92 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.871 105.4 58.4 -66.3 -33.8 -23.2 15.2 -48.4 35 39 A A H 3< S+ 0 0 33 -4,-2.0 2,-0.5 -5,-0.2 -1,-0.2 0.719 81.8 95.3 -71.4 -23.9 -22.7 18.8 -47.5 36 40 A Y S << S- 0 0 2 -4,-1.0 2,-0.7 -3,-0.7 -30,-0.1 -0.596 74.9-139.8 -69.1 119.9 -19.0 18.8 -48.4 37 41 A E - 0 0 133 -32,-0.5 -29,-0.1 -2,-0.5 -2,-0.1 -0.748 26.1-113.7 -85.3 115.7 -18.8 20.0 -51.9 38 42 A S - 0 0 23 -2,-0.7 3,-0.1 55,-0.2 -1,-0.1 -0.171 33.0-172.1 -54.3 127.6 -16.2 17.9 -53.7 39 43 A N >> - 0 0 68 1,-0.1 3,-1.9 0, 0.0 4,-0.7 -0.915 13.3-154.6-123.3 102.7 -13.1 20.0 -54.6 40 44 A P H >> S+ 0 0 69 0, 0.0 4,-1.2 0, 0.0 3,-0.9 0.789 90.7 60.8 -48.7 -36.3 -10.8 17.9 -56.8 41 45 A A H 34 S+ 0 0 82 1,-0.3 4,-0.4 2,-0.2 3,-0.2 0.841 101.1 55.7 -62.4 -30.9 -7.7 19.9 -55.8 42 46 A E H <4 S+ 0 0 57 -3,-1.9 -1,-0.3 1,-0.2 3,-0.1 0.737 119.0 29.1 -74.5 -23.4 -8.2 18.9 -52.2 43 47 A W H XX S+ 0 0 8 -3,-0.9 3,-1.6 -4,-0.7 4,-1.0 0.365 84.4 105.1-119.6 6.1 -8.2 15.2 -52.8 44 48 A A G >< S+ 0 0 60 -4,-1.2 3,-0.9 1,-0.3 -2,-0.1 0.872 76.6 63.7 -54.6 -38.3 -6.0 14.8 -55.9 45 49 A L G 34 S+ 0 0 96 -4,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.831 108.8 39.3 -53.1 -35.3 -3.3 13.5 -53.6 46 50 A Y G <4 S+ 0 0 40 -3,-1.6 2,-2.0 1,-0.1 -1,-0.2 0.574 89.5 96.0 -93.9 -10.7 -5.4 10.5 -52.7 47 51 A A << + 0 0 24 -4,-1.0 2,-0.7 -3,-0.9 -1,-0.1 -0.461 47.8 155.5 -87.3 70.5 -6.9 9.9 -56.2 48 52 A K - 0 0 57 -2,-2.0 24,-0.2 22,-0.2 2,-0.2 -0.880 25.1-159.2-104.8 113.3 -4.5 7.2 -57.4 49 53 A F - 0 0 79 -2,-0.7 2,-0.4 22,-0.1 5,-0.1 -0.527 10.4-151.2 -91.2 156.9 -5.9 5.0 -60.1 50 54 A D - 0 0 48 3,-0.6 24,-0.3 22,-0.3 5,-0.1 -0.939 20.0-131.9-120.1 146.2 -5.0 1.6 -61.2 51 55 A Q S S+ 0 0 149 -2,-0.4 -1,-0.1 1,-0.2 3,-0.1 0.811 100.9 37.5 -66.6 -28.0 -5.7 0.6 -64.8 52 56 A Y S S+ 0 0 175 1,-0.2 2,-0.3 2,-0.0 -1,-0.2 0.726 120.1 6.2-105.1 -28.9 -7.2 -2.7 -63.9 53 57 A R S S- 0 0 123 24,-0.1 -3,-0.6 19,-0.1 -1,-0.2 -0.963 81.4 -79.0-152.0 166.5 -9.3 -2.3 -60.7 54 58 A Y - 0 0 18 24,-0.3 2,-0.3 -2,-0.3 19,-0.2 -0.393 45.2-142.7 -70.1 150.9 -10.6 0.2 -58.2 55 59 A T E -A 72 0A 5 17,-1.8 17,-1.6 -7,-0.1 2,-0.5 -0.832 3.4-142.2-114.3 152.7 -8.1 1.4 -55.6 56 60 A R E -A 71 0A 8 -2,-0.3 122,-2.5 15,-0.2 123,-1.2 -0.972 18.1-171.0-117.0 123.8 -8.6 2.2 -51.9 57 61 A N E -Ab 70 179A 0 13,-2.5 13,-3.0 -2,-0.5 123,-0.2 -0.944 18.8-134.0-125.0 109.9 -6.6 5.2 -50.7 58 62 A L E +Ab 69 180A 0 121,-2.5 123,-2.4 -2,-0.5 124,-0.5 -0.443 28.4 169.9 -69.2 131.3 -6.5 5.9 -46.9 59 63 A V E + 0 0 6 9,-2.8 2,-0.4 1,-0.4 10,-0.2 0.774 66.0 10.1-106.7 -45.1 -7.1 9.5 -46.1 60 64 A D E -A 68 0A 38 8,-2.1 8,-2.6 1,-0.1 -1,-0.4 -0.994 51.9-150.2-146.2 135.5 -7.5 9.6 -42.4 61 65 A Q > - 0 0 95 -2,-0.4 3,-0.7 1,-0.2 5,-0.3 0.513 42.0-147.8 -82.1 -7.8 -7.0 7.0 -39.7 62 66 A G T 3 - 0 0 17 1,-0.2 -1,-0.2 3,-0.1 5,-0.1 -0.256 35.2 -62.3 71.7-157.7 -9.7 8.5 -37.5 63 67 A N T 3 S- 0 0 57 -3,-0.1 -1,-0.2 -44,-0.1 4,-0.1 0.070 86.7 -74.8-119.0 23.3 -9.7 8.4 -33.8 64 68 A G S < S+ 0 0 65 -3,-0.7 -2,-0.1 2,-0.5 3,-0.1 -0.020 130.0 71.4 101.3 -23.6 -9.8 4.7 -33.2 65 69 A K S S+ 0 0 60 1,-0.1 2,-0.3 90,-0.1 -3,-0.1 0.525 101.2 15.8-107.1 -7.1 -13.5 4.6 -34.2 66 70 A F - 0 0 0 -5,-0.3 -2,-0.5 88,-0.2 2,-0.3 -0.991 52.6-145.7-161.3 163.3 -13.4 5.2 -37.9 67 71 A N E - C 0 153A 11 86,-2.0 86,-2.1 -2,-0.3 2,-0.4 -0.964 11.1-156.2-132.2 147.9 -11.4 5.3 -41.2 68 72 A L E +AC 60 152A 1 -8,-2.6 -9,-2.8 -2,-0.3 -8,-2.1 -0.994 22.6 161.3-129.6 132.1 -11.8 7.6 -44.1 69 73 A M E -AC 58 151A 2 82,-2.7 82,-3.4 -2,-0.4 2,-0.5 -0.953 33.1-125.3-148.1 164.9 -10.6 6.7 -47.6 70 74 A I E -AC 57 150A 0 -13,-3.0 -13,-2.5 -2,-0.3 2,-0.4 -0.960 18.7-158.2-118.8 129.4 -10.9 7.5 -51.3 71 75 A L E -AC 56 149A 0 78,-2.9 78,-2.8 -2,-0.5 2,-0.5 -0.896 4.1-157.1-108.6 134.9 -11.8 4.9 -53.8 72 76 A C E -AC 55 148A 0 -17,-1.6 -17,-1.8 -2,-0.4 2,-0.6 -0.965 6.6-166.7-119.8 122.0 -10.9 5.5 -57.5 73 77 A W E - C 0 147A 0 74,-3.0 74,-2.8 -2,-0.5 3,-0.1 -0.914 8.3-149.9-116.9 107.1 -12.8 3.6 -60.1 74 78 A G > - 0 0 6 -2,-0.6 3,-2.4 -24,-0.3 66,-0.2 -0.160 51.1 -63.9 -59.5 167.0 -11.6 3.4 -63.7 75 79 A E T 3 S+ 0 0 87 1,-0.3 -1,-0.2 68,-0.1 68,-0.2 -0.366 127.5 8.8 -55.0 127.0 -14.1 3.1 -66.5 76 80 A G T 3 S+ 0 0 56 64,-1.3 2,-0.3 66,-0.8 -1,-0.3 0.433 95.0 138.7 82.4 -1.5 -15.9 -0.2 -66.1 77 81 A H < + 0 0 23 -3,-2.4 63,-3.6 65,-0.2 2,-0.3 -0.577 22.8 159.4 -78.4 139.9 -14.4 -0.9 -62.7 78 82 A G B -G 139 0B 34 61,-0.3 -24,-0.3 -2,-0.3 61,-0.3 -0.923 31.1-112.4-150.3 175.2 -16.6 -2.4 -60.0 79 83 A S - 0 0 14 59,-2.9 2,-0.1 -2,-0.3 3,-0.0 -0.449 32.1 -99.4 -99.5 174.5 -16.6 -4.4 -56.8 80 84 A S - 0 0 47 -2,-0.1 2,-0.6 1,-0.1 58,-0.4 -0.329 51.6 -87.7 -71.4 170.7 -17.8 -7.8 -55.8 81 85 A I E S+H 163 0B 0 82,-0.6 82,-2.8 56,-0.2 2,-0.3 -0.794 73.7 162.1 -74.9 124.9 -21.1 -8.3 -54.1 82 86 A H E -HI 162 136B 3 54,-2.7 54,-2.2 -2,-0.6 80,-0.2 -0.929 39.6-129.9-149.1 165.2 -20.0 -7.7 -50.5 83 87 A D - 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0 0 69 48,-0.2 2,-0.3 25,-0.2 45,-0.3 -0.970 35.0-159.7-136.4 147.8 -21.3 8.3 -61.0 98 102 A L E -J 121 0B 2 23,-2.1 23,-3.6 -2,-0.3 2,-0.5 -0.969 15.0-136.1-127.7 147.8 -21.5 4.9 -59.5 99 103 A K E -JK 120 139B 52 40,-3.4 40,-2.3 -2,-0.3 2,-0.5 -0.891 18.9-162.5 -97.5 127.1 -24.2 2.2 -59.8 100 104 A E E -JK 119 138B 3 19,-2.9 19,-2.2 -2,-0.5 2,-0.5 -0.962 3.2-168.3-110.0 125.0 -25.1 0.5 -56.5 101 105 A T E -JK 118 137B 7 36,-3.0 36,-2.1 -2,-0.5 2,-0.3 -0.960 10.8-148.5-113.1 126.4 -26.9 -2.7 -56.7 102 106 A L E -JK 117 136B 26 15,-2.6 14,-2.9 -2,-0.5 15,-1.2 -0.765 15.3-177.4 -95.7 143.6 -28.4 -4.1 -53.4 103 107 A F E -JK 115 135B 2 32,-2.3 32,-2.8 -2,-0.3 12,-0.1 -0.965 24.6-118.4-133.5 148.4 -28.8 -7.7 -52.6 104 108 A D - 0 0 100 10,-0.6 30,-0.1 -2,-0.3 3,-0.1 -0.469 43.7 -89.2 -77.5 157.0 -30.3 -9.5 -49.7 105 109 A W - 0 0 98 26,-0.1 -1,-0.1 -2,-0.1 -22,-0.0 -0.495 55.0-113.1 -57.4 134.4 -28.2 -11.8 -47.5 106 110 A P - 0 0 45 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.234 22.0-117.6 -68.6 160.4 -28.4 -15.2 -49.1 107 111 A D - 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