==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-FEB-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 09-MAR-11 3R18 . COMPND 2 MOLECULE: SULFITE OXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR J.A.QIU,H.L.WILSON,K.V.RAJAGOPALAN . 373 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16200.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 226 60.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 2.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 97 26.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 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 . 1 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 . 32 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 29 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 . 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 3 0 1 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 . 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 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 3 4 2 0 3 4 0 1 1 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 1 1 2 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 94 A Q 0 0 226 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 117.7 -43.5 -17.9 38.3 2 95 A D > - 0 0 65 1,-0.1 3,-1.8 2,-0.0 4,-0.2 -0.629 360.0-148.4 -78.8 119.5 -40.9 -15.5 37.1 3 96 A P T 3 S+ 0 0 91 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 0.646 98.3 51.0 -59.9 -16.3 -37.8 -15.2 39.5 4 97 A F T > S+ 0 0 38 1,-0.2 3,-2.1 45,-0.1 46,-0.1 0.350 74.5 104.7-103.9 2.6 -37.4 -11.5 38.4 5 98 A A T < S+ 0 0 70 -3,-1.8 -1,-0.2 1,-0.3 -3,-0.0 0.799 81.8 51.5 -52.7 -32.0 -41.0 -10.4 39.0 6 99 A G T 3 S+ 0 0 53 -3,-0.2 -1,-0.3 -4,-0.2 -2,-0.1 0.326 80.6 125.9 -92.0 6.2 -39.9 -8.6 42.2 7 100 A D < - 0 0 26 -3,-2.1 -3,-0.0 1,-0.1 45,-0.0 -0.299 67.7-101.8 -62.7 148.6 -37.1 -6.6 40.6 8 101 A P - 0 0 17 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.351 35.3-106.5 -69.9 152.1 -37.1 -2.8 41.1 9 102 A P - 0 0 128 0, 0.0 2,-0.3 0, 0.0 0, 0.0 -0.469 39.5-147.5 -72.9 154.3 -38.3 -0.5 38.3 10 103 A R - 0 0 51 -2,-0.1 31,-0.1 1,-0.0 30,-0.1 -0.830 24.5 -82.9-122.9 161.3 -35.5 1.5 36.6 11 104 A H > - 0 0 87 29,-0.4 3,-1.0 -2,-0.3 -1,-0.0 -0.400 41.8-129.8 -54.9 130.2 -35.0 4.9 34.9 12 105 A P T 3 S+ 0 0 125 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.705 95.0 65.8 -58.0 -29.4 -36.3 4.7 31.3 13 106 A G T 3 S+ 0 0 30 2,-0.1 -2,-0.0 14,-0.0 28,-0.0 0.490 72.4 122.9 -82.2 0.2 -33.2 6.2 29.5 14 107 A L < - 0 0 21 -3,-1.0 2,-1.2 1,-0.1 27,-0.0 -0.238 66.8-124.0 -67.7 144.0 -30.7 3.4 30.3 15 108 A R E -A 25 0A 129 10,-2.6 10,-2.0 2,-0.0 2,-0.5 -0.771 38.1-161.9 -81.4 95.5 -28.7 1.4 27.7 16 109 A V E +A 24 0A 67 -2,-1.2 8,-0.3 8,-0.2 3,-0.1 -0.719 25.4 173.9 -86.5 126.2 -29.9 -2.0 28.8 17 110 A N E S+ 0 0 43 6,-2.4 2,-0.3 -2,-0.5 7,-0.2 0.555 76.3 19.3-102.4 -12.2 -27.8 -5.1 27.6 18 111 A S E > -A 23 0A 27 5,-1.6 5,-2.7 1,-0.1 -1,-0.3 -0.942 51.5-172.2-155.7 132.4 -29.8 -7.6 29.7 19 112 A Q T 5S+ 0 0 111 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 0.868 77.8 59.7 -87.8 -44.5 -33.2 -7.5 31.3 20 113 A K T 5S+ 0 0 119 1,-0.4 -1,-0.3 2,-0.1 2,-0.2 -0.883 121.0 19.4-132.8 100.8 -33.0 -10.7 33.3 21 114 A P T 5S- 0 0 31 0, 0.0 2,-0.5 0, 0.0 -1,-0.4 0.539 114.5-116.8 -77.4 162.5 -30.7 -10.4 35.2 22 115 A F T 5 + 0 0 4 26,-0.3 24,-1.2 -2,-0.2 2,-0.4 -0.533 43.4 162.5 -78.4 119.3 -30.6 -6.6 34.9 23 116 A N E < +AB 18 45A 0 -5,-2.7 -6,-2.4 -2,-0.5 -5,-1.6 -0.977 12.0 147.0-134.7 122.2 -27.5 -5.1 33.4 24 117 A A E -AB 16 44A 1 20,-2.2 20,-2.3 -2,-0.4 -8,-0.2 -0.990 28.3-152.4-151.4 153.3 -27.5 -1.5 32.1 25 118 A E E -A 15 0A 11 -10,-2.0 -10,-2.6 -2,-0.3 90,-0.1 -0.916 32.8-102.0-124.1 154.9 -25.2 1.5 31.7 26 119 A P - 0 0 1 0, 0.0 -12,-0.1 0, 0.0 5,-0.1 -0.382 52.1 -87.5 -65.8 154.4 -26.1 5.2 31.6 27 120 A P >> - 0 0 10 0, 0.0 4,-1.7 0, 0.0 3,-1.6 -0.365 38.3-119.9 -58.1 147.6 -26.1 6.9 28.1 28 121 A A H 3> S+ 0 0 6 1,-0.3 4,-0.7 2,-0.2 5,-0.0 0.793 111.3 62.8 -65.1 -27.0 -22.6 8.1 27.3 29 122 A E H 34 S+ 0 0 101 1,-0.2 -1,-0.3 2,-0.1 230,-0.1 0.660 114.9 32.5 -71.0 -14.4 -23.9 11.7 27.0 30 123 A L H X> S+ 0 0 61 -3,-1.6 3,-1.4 2,-0.1 4,-0.6 0.617 97.7 87.0-111.4 -19.9 -24.9 11.6 30.7 31 124 A L H 3< S+ 0 0 1 -4,-1.7 3,-0.3 1,-0.3 -2,-0.1 0.877 104.7 22.9 -47.7 -53.6 -22.2 9.3 32.0 32 125 A A T 3< S+ 0 0 15 -4,-0.7 -1,-0.3 1,-0.2 244,-0.1 0.107 92.2 104.7-106.4 19.5 -19.5 12.0 32.6 33 126 A E T <4 S+ 0 0 127 -3,-1.4 2,-0.4 1,-0.2 -1,-0.2 0.897 89.1 29.3 -64.6 -41.4 -21.9 15.0 33.0 34 127 A R S < S- 0 0 158 -4,-0.6 -1,-0.2 -3,-0.3 -4,-0.0 -0.943 73.4-132.7-123.9 145.0 -21.5 15.0 36.7 35 128 A F S S+ 0 0 89 -2,-0.4 2,-0.6 1,-0.1 282,-0.2 0.910 104.2 50.1 -54.4 -48.1 -18.6 14.0 38.9 36 129 A L S S- 0 0 61 -3,-0.1 83,-0.2 81,-0.1 -1,-0.1 -0.884 92.0-132.8 -98.0 120.5 -21.1 12.0 41.1 37 130 A T - 0 0 2 81,-2.7 5,-0.1 -2,-0.6 -6,-0.1 -0.591 27.3-113.5 -72.3 120.5 -23.3 9.8 39.0 38 131 A P >> - 0 0 31 0, 0.0 3,-2.0 0, 0.0 4,-1.5 -0.289 26.1-117.2 -52.1 139.6 -27.0 10.2 40.1 39 132 A N T 34 S+ 0 0 16 1,-0.3 -2,-0.1 2,-0.2 143,-0.0 0.757 114.6 57.4 -50.6 -31.6 -28.2 7.0 41.8 40 133 A E T 34 S+ 0 0 117 1,-0.2 -29,-0.4 -30,-0.1 -1,-0.3 0.703 114.1 37.2 -76.7 -21.2 -30.8 6.5 39.0 41 134 A L T <4 S+ 0 0 18 -3,-2.0 -2,-0.2 -31,-0.1 -1,-0.2 0.528 83.8 120.8-105.7 -13.5 -28.1 6.5 36.3 42 135 A F S < S- 0 0 3 -4,-1.5 75,-0.1 -5,-0.1 -18,-0.1 -0.305 77.3-100.1 -55.0 130.5 -25.4 4.6 38.1 43 136 A F - 0 0 15 73,-0.2 2,-0.5 71,-0.2 -18,-0.2 -0.177 37.3-145.4 -56.9 145.9 -24.5 1.5 36.1 44 137 A T E +B 24 0A 4 -20,-2.3 -20,-2.2 -3,-0.1 2,-0.5 -0.977 19.2 179.1-122.6 126.0 -26.2 -1.7 37.3 45 138 A R E +B 23 0A 65 -2,-0.5 2,-0.4 144,-0.2 -22,-0.2 -0.958 11.3 168.3-125.8 107.6 -24.6 -5.1 37.1 46 139 A N - 0 0 1 -24,-1.2 4,-0.1 -2,-0.5 -2,-0.0 -0.970 23.8-172.3-119.1 136.4 -26.7 -8.0 38.6 47 140 A H S S+ 0 0 39 -2,-0.4 -1,-0.1 2,-0.1 3,-0.1 0.675 77.5 16.4 -89.8 -19.7 -26.0 -11.8 38.2 48 141 A L S S- 0 0 15 1,-0.2 -26,-0.3 -26,-0.1 105,-0.1 -0.759 101.3 -56.3-143.7 173.5 -29.3 -12.7 39.8 49 142 A P - 0 0 37 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 -0.234 64.7-102.4 -52.6 152.2 -32.8 -11.5 40.9 50 143 A V - 0 0 8 -46,-0.1 139,-0.1 -4,-0.1 -44,-0.1 -0.694 38.8-115.2 -81.1 125.2 -32.6 -8.5 43.2 51 144 A P - 0 0 20 0, 0.0 2,-0.6 0, 0.0 140,-0.1 -0.313 16.5-139.7 -59.3 140.6 -33.2 -9.5 46.9 52 145 A A - 0 0 89 -45,-0.0 2,-0.5 2,-0.0 -45,-0.0 -0.937 28.6-168.8 -97.8 115.2 -36.3 -8.1 48.6 53 146 A V - 0 0 25 -2,-0.6 3,-0.1 139,-0.1 156,-0.0 -0.933 24.5-146.7-120.1 121.6 -35.2 -7.2 52.1 54 147 A E >> - 0 0 103 -2,-0.5 4,-0.9 1,-0.1 3,-0.5 -0.793 23.1-144.0 -78.3 117.5 -37.3 -6.2 55.1 55 148 A P T 34 S+ 0 0 55 0, 0.0 19,-0.5 0, 0.0 3,-0.4 0.831 89.7 51.4 -55.2 -40.9 -35.0 -3.7 56.8 56 149 A S T 34 S+ 0 0 86 1,-0.2 19,-0.1 17,-0.1 18,-0.0 0.768 112.2 42.9 -78.2 -27.9 -35.9 -4.6 60.4 57 150 A S T <4 S+ 0 0 84 -3,-0.5 -1,-0.2 16,-0.1 2,-0.1 0.504 87.2 119.1 -94.0 -5.9 -35.4 -8.4 60.3 58 151 A Y < - 0 0 10 -4,-0.9 16,-0.6 -3,-0.4 2,-0.4 -0.363 42.1-174.1 -58.5 131.0 -32.1 -8.0 58.2 59 152 A R E -C 73 0B 122 14,-0.2 2,-0.6 -2,-0.1 14,-0.2 -0.988 18.3-148.5-132.7 125.6 -29.0 -9.5 59.9 60 153 A L E -C 72 0B 1 12,-3.8 12,-3.3 -2,-0.4 2,-0.5 -0.825 20.3-144.1 -86.0 123.7 -25.5 -9.3 58.7 61 154 A R E -Cd 71 212B 114 150,-2.9 152,-2.2 -2,-0.6 2,-0.5 -0.804 18.5-176.7 -91.9 123.0 -23.6 -12.3 59.9 62 155 A V E -Cd 70 213B 0 8,-3.5 8,-3.3 -2,-0.5 2,-0.4 -0.963 18.0-142.7-120.5 113.5 -19.9 -11.8 60.9 63 156 A D E -C 69 0B 23 150,-2.2 6,-0.2 -2,-0.5 152,-0.2 -0.601 20.2-138.4 -74.8 130.2 -17.9 -14.9 61.8 64 157 A G > - 0 0 15 4,-2.9 3,-1.2 -2,-0.4 151,-0.1 -0.277 27.3 -94.4 -82.7 174.7 -15.5 -14.2 64.7 65 158 A P T 3 S+ 0 0 82 0, 0.0 69,-0.1 0, 0.0 -1,-0.1 0.792 120.3 43.5 -60.4 -34.4 -11.8 -15.4 65.0 66 159 A G T 3 S- 0 0 83 2,-0.0 3,-0.1 0, 0.0 -3,-0.0 0.360 125.2 -87.1 -98.2 3.4 -12.7 -18.5 67.1 67 160 A G S < S+ 0 0 62 -3,-1.2 -4,-0.0 1,-0.4 0, 0.0 0.114 87.6 121.8 112.9 -23.6 -15.7 -19.8 65.2 68 161 A G - 0 0 51 -5,-0.1 -4,-2.9 1,-0.1 2,-0.5 -0.144 56.3-124.4 -65.6 166.0 -18.5 -17.9 66.9 69 162 A T E -C 63 0B 67 -6,-0.2 2,-0.4 -3,-0.1 -6,-0.2 -0.960 10.8-155.9-125.2 123.6 -20.9 -15.7 65.0 70 163 A L E -C 62 0B 48 -8,-3.3 -8,-3.5 -2,-0.5 2,-0.5 -0.768 14.0-156.4 -86.8 137.0 -21.7 -12.0 65.5 71 164 A S E -C 61 0B 59 -2,-0.4 2,-0.5 -10,-0.2 -10,-0.2 -0.970 9.3-166.4-120.0 117.8 -25.1 -11.0 64.1 72 165 A L E -C 60 0B 0 -12,-3.3 -12,-3.8 -2,-0.5 2,-0.1 -0.905 8.4-151.7-114.4 128.1 -25.7 -7.3 63.2 73 166 A S E > -C 59 0B 22 -2,-0.5 4,-2.2 -14,-0.2 -14,-0.2 -0.450 34.0-108.7 -78.9 163.7 -28.9 -5.6 62.5 74 167 A L H > S+ 0 0 20 -16,-0.6 4,-2.2 -19,-0.5 5,-0.1 0.879 120.3 53.7 -57.6 -40.7 -29.0 -2.5 60.2 75 168 A A H > S+ 0 0 67 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.919 109.4 47.8 -63.2 -43.5 -29.6 -0.2 63.2 76 169 A E H > S+ 0 0 60 2,-0.2 4,-2.9 1,-0.2 5,-0.5 0.890 109.7 52.4 -62.7 -43.4 -26.6 -1.6 65.0 77 170 A L H X S+ 0 0 1 -4,-2.2 4,-0.6 1,-0.2 -1,-0.2 0.889 114.1 44.9 -59.6 -40.2 -24.5 -1.2 61.9 78 171 A R H < S+ 0 0 94 -4,-2.2 -2,-0.2 -5,-0.1 -1,-0.2 0.896 124.2 31.2 -68.1 -41.9 -25.7 2.5 61.7 79 172 A S H < S+ 0 0 101 -4,-2.5 -3,-0.2 -5,-0.1 -2,-0.2 0.823 112.7 54.7 -93.7 -35.2 -25.2 3.3 65.5 80 173 A R H < S+ 0 0 131 -4,-2.9 -3,-0.2 -5,-0.2 -1,-0.1 0.810 105.9 50.8 -75.0 -29.4 -22.2 1.2 66.7 81 174 A F S < S- 0 0 10 -4,-0.6 2,-0.1 -5,-0.5 -1,-0.1 -0.917 91.9-107.3-115.7 135.0 -19.6 2.3 64.2 82 175 A P - 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0 0 11 23,-2.5 3,-2.2 -2,-0.4 23,-0.1 -0.606 17.4-128.3 -76.3 140.5 -16.8 -3.5 36.0 93 186 A A T 3 S+ 0 0 4 1,-0.3 267,-1.5 -2,-0.3 268,-0.5 0.810 111.1 61.3 -54.6 -27.8 -14.0 -5.7 34.6 94 187 A G T > S+ 0 0 0 265,-0.2 3,-1.9 266,-0.1 17,-0.3 0.398 73.5 134.3 -83.0 2.6 -16.3 -6.1 31.6 95 188 A N T < S+ 0 0 1 -3,-2.2 266,-0.7 1,-0.3 18,-0.2 -0.276 78.6 8.1 -57.3 134.3 -16.2 -2.3 30.8 96 189 A R T >> S+ 0 0 0 16,-2.5 3,-1.2 264,-0.1 4,-0.6 0.699 82.1 144.4 64.5 23.2 -15.7 -1.7 27.1 97 190 A R H X> + 0 0 20 -3,-1.9 3,-1.5 15,-0.3 4,-1.3 0.870 60.2 69.4 -55.2 -37.5 -16.1 -5.4 26.3 98 191 A S H 3> S+ 0 0 23 13,-2.5 4,-0.7 1,-0.3 -1,-0.2 0.768 91.9 57.5 -57.0 -28.9 -17.8 -4.6 23.0 99 192 A E H <4 S+ 0 0 18 -3,-1.2 4,-0.4 12,-0.3 -1,-0.3 0.791 103.5 54.7 -72.4 -25.5 -14.6 -3.2 21.5 100 193 A M H XX S+ 0 0 0 -3,-1.5 4,-1.5 -4,-0.6 3,-1.1 0.862 101.0 56.9 -75.1 -37.4 -13.0 -6.6 22.1 101 194 A S H 3< S+ 0 0 46 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.702 94.6 68.9 -62.4 -25.3 -15.7 -8.4 20.2 102 195 A R T 3< S+ 0 0 188 -4,-0.7 -1,-0.2 1,-0.2 -2,-0.2 0.769 103.9 42.6 -66.4 -25.3 -14.9 -6.3 17.2 103 196 A V T <4 S- 0 0 67 -3,-1.1 -2,-0.2 -4,-0.4 -1,-0.2 0.908 143.5 -22.9 -80.2 -46.4 -11.5 -8.1 17.0 104 197 A R S < S- 0 0 113 -4,-1.5 -1,-0.4 247,-0.0 -2,-0.1 -0.879 84.5 -90.8-168.8 127.3 -13.0 -11.6 17.6 105 198 A P - 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