==== 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 24-AUG-01 1JUE . COMPND 2 MOLECULE: DIHYDROOROTATE DEHYDROGENASE A; . SOURCE 2 ORGANISM_SCIENTIFIC: LACTOCOCCUS LACTIS; . AUTHOR S.NORAGER,S.ARENT,O.BJORNBERG,M.OTTOSEN,L.LO LEGGIO,K.F.JENS . 622 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22948.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 417 67.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 68 10.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 46 7.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 4 0.6 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 . 35 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 56 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 181 29.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 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 0 0 2 0 0 2 2 2 4 2 2 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 6 0 4 8 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 6 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 ANTIPARALLEL BRIDGES PER LADDER . 2 2 2 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 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 1 A M 0 0 61 0, 0.0 300,-0.8 0, 0.0 12,-0.1 0.000 360.0 360.0 360.0 -21.8 -15.4 51.2 37.8 2 2 A L + 0 0 4 10,-0.2 298,-0.1 298,-0.2 9,-0.1 0.320 360.0 144.2 -93.1 8.2 -12.4 51.1 35.5 3 3 A N - 0 0 110 10,-0.1 2,-0.4 1,-0.1 298,-0.3 -0.212 32.0-166.7 -49.3 131.8 -10.3 53.7 37.3 4 4 A T E -A 11 0A 13 7,-2.8 7,-3.0 9,-0.1 2,-0.5 -0.970 23.0-153.1-132.6 142.7 -6.6 52.6 37.1 5 5 A T E +A 10 0A 75 -2,-0.4 2,-0.3 5,-0.2 5,-0.2 -0.963 29.1 160.1-112.9 124.1 -3.3 53.6 38.7 6 6 A F E > -A 9 0A 0 3,-2.4 3,-2.1 -2,-0.5 -2,-0.0 -0.993 64.3 -0.2-147.6 136.3 -0.3 52.9 36.5 7 7 A A T 3 S- 0 0 21 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 0.873 128.9 -61.0 51.7 38.4 3.3 54.3 36.6 8 8 A N T 3 S+ 0 0 168 1,-0.2 2,-0.3 -3,-0.0 -1,-0.3 0.677 117.0 111.6 63.7 19.6 2.1 56.3 39.6 9 9 A A E < -A 6 0A 18 -3,-2.1 -3,-2.4 84,-0.0 2,-0.4 -0.860 66.5-120.5-122.6 157.4 -0.4 58.1 37.4 10 10 A K E -A 5 0A 133 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.837 26.7-177.8-102.3 133.0 -4.2 58.0 37.3 11 11 A F E -A 4 0A 2 -7,-3.0 -7,-2.8 -2,-0.4 83,-0.1 -0.959 31.5-133.0-127.0 144.8 -6.2 56.9 34.3 12 12 A A S S- 0 0 51 26,-0.4 -10,-0.2 -2,-0.4 -1,-0.1 0.807 91.1 -8.8 -65.2 -31.8 -10.0 56.8 33.8 13 13 A N S S- 0 0 10 2,-0.2 -1,-0.2 -10,-0.1 -10,-0.1 -0.961 71.5-109.4-157.3 165.4 -9.8 53.3 32.4 14 14 A P S S+ 0 0 0 0, 0.0 254,-3.0 0, 0.0 2,-0.1 0.597 75.6 114.5 -80.8 -8.5 -7.0 50.9 31.2 15 15 A F E +b 268 0B 0 252,-0.2 24,-1.7 21,-0.2 23,-1.4 -0.386 32.4 155.3 -73.1 137.3 -7.7 51.0 27.5 16 16 A M E -b 269 0B 0 252,-2.0 254,-2.1 22,-0.2 24,-0.2 -0.901 44.9 -98.5-144.9 169.5 -5.2 52.5 25.0 17 17 A N E -b 270 0B 0 22,-0.4 2,-0.4 -2,-0.3 254,-0.2 -0.551 43.3-113.3 -85.1 161.2 -4.4 52.1 21.3 18 18 A A > - 0 0 6 252,-2.0 3,-2.1 -2,-0.2 23,-0.0 -0.779 43.5 -92.1 -93.0 142.8 -1.4 49.8 20.6 19 19 A S T 3 S+ 0 0 16 -2,-0.4 24,-0.2 1,-0.2 23,-0.1 -0.242 114.4 33.7 -53.8 141.6 1.6 51.6 19.1 20 20 A G T 3 S+ 0 0 31 21,-0.2 2,-0.5 1,-0.1 -1,-0.2 0.129 99.0 96.2 98.3 -20.3 1.4 51.7 15.3 21 21 A V S < S- 0 0 19 -3,-2.1 -1,-0.1 1,-0.2 249,-0.1 -0.918 102.4 -21.4-113.0 120.4 -2.4 51.8 15.2 22 22 A H S S+ 0 0 45 -2,-0.5 10,-0.2 1,-0.1 -1,-0.2 0.854 113.8 92.3 56.2 42.5 -4.2 55.1 14.7 23 23 A C + 0 0 0 -3,-0.2 20,-1.8 8,-0.1 -2,-0.1 0.096 43.2 105.3-151.8 28.0 -1.3 57.2 16.0 24 24 A M S S+ 0 0 49 18,-0.2 50,-0.4 -4,-0.1 2,-0.2 0.898 81.6 32.4 -79.4 -44.1 0.8 58.3 13.0 25 25 A T S > S- 0 0 42 1,-0.1 4,-2.5 48,-0.1 5,-0.2 -0.663 84.0-108.7-113.6 168.3 -0.2 61.9 12.8 26 26 A I H > S+ 0 0 58 1,-0.2 4,-2.5 -2,-0.2 5,-0.2 0.890 122.2 56.0 -60.5 -37.8 -1.2 64.7 15.1 27 27 A E H > S+ 0 0 129 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.908 106.9 48.2 -61.3 -42.5 -4.7 64.3 13.7 28 28 A D H > S+ 0 0 36 1,-0.2 4,-1.7 2,-0.2 3,-0.2 0.941 112.5 49.3 -61.7 -48.2 -4.7 60.6 14.6 29 29 A L H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.863 108.6 51.5 -60.4 -39.6 -3.5 61.4 18.1 30 30 A E H X S+ 0 0 105 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.806 106.9 55.1 -68.7 -29.0 -6.1 64.1 18.7 31 31 A E H X S+ 0 0 81 -4,-1.4 4,-1.0 -3,-0.2 -1,-0.2 0.870 108.6 47.6 -71.1 -35.8 -8.7 61.6 17.6 32 32 A L H < S+ 0 0 1 -4,-1.7 5,-0.4 2,-0.2 3,-0.2 0.884 109.7 53.0 -71.5 -36.7 -7.5 59.2 20.3 33 33 A K H < S+ 0 0 56 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.894 109.9 48.8 -62.8 -39.6 -7.5 62.0 22.9 34 34 A A H < S+ 0 0 80 -4,-1.9 -1,-0.2 -5,-0.1 -2,-0.2 0.717 101.7 81.7 -73.2 -21.9 -11.1 62.8 22.0 35 35 A S S < S- 0 0 22 -4,-1.0 245,-0.1 -3,-0.2 -3,-0.1 -0.059 97.5-100.9 -74.8-178.7 -12.1 59.1 22.3 36 36 A Q S S+ 0 0 108 243,-0.4 -21,-0.2 -24,-0.0 -1,-0.1 0.345 75.6 132.5 -86.5 5.8 -12.9 57.2 25.5 37 37 A A - 0 0 17 -5,-0.4 -21,-0.2 1,-0.2 -25,-0.1 -0.339 58.7-138.6 -58.6 136.8 -9.4 55.6 25.6 38 38 A G S S- 0 0 9 -23,-1.4 -26,-0.4 1,-0.2 2,-0.3 0.813 80.5 -13.9 -67.3 -30.1 -7.9 55.9 29.0 39 39 A A - 0 0 3 -24,-1.7 -22,-0.4 -28,-0.1 2,-0.3 -0.960 66.0-145.5-160.6 169.1 -4.5 56.8 27.5 40 40 A Y - 0 0 6 55,-0.3 57,-2.3 -2,-0.3 2,-0.3 -0.976 3.3-146.9-145.8 161.2 -2.8 56.7 24.1 41 41 A I B -c 97 0B 0 -2,-0.3 57,-0.2 55,-0.2 -21,-0.2 -0.953 21.0-116.7-131.2 146.9 0.7 56.1 22.7 42 42 A T - 0 0 0 55,-1.8 57,-0.2 -2,-0.3 -18,-0.2 -0.339 41.9 -87.8 -78.4 161.4 2.5 57.5 19.7 43 43 A K - 0 0 16 -20,-1.8 56,-0.2 -24,-0.2 -1,-0.1 -0.426 58.7 -91.7 -64.0 140.8 3.7 55.5 16.6 44 44 A S - 0 0 5 56,-0.1 56,-0.3 -2,-0.1 2,-0.3 -0.354 54.9-151.7 -56.0 128.8 7.2 54.1 17.3 45 45 A S B -d 100 0B 0 54,-1.7 56,-2.6 -3,-0.1 2,-0.3 -0.716 16.5-156.6-111.9 160.6 9.6 56.7 15.9 46 46 A T - 0 0 2 -2,-0.3 30,-2.2 2,-0.3 56,-0.1 -0.757 41.5 -97.7-119.8 167.3 13.0 56.7 14.5 47 47 A L S S+ 0 0 52 -2,-0.3 30,-0.5 28,-0.2 2,-0.3 0.907 109.0 35.8 -56.2 -43.0 15.5 59.6 14.4 48 48 A E S S- 0 0 142 27,-0.2 27,-0.3 28,-0.1 -2,-0.3 -0.812 101.2 -89.3-113.5 155.9 14.5 60.5 10.8 49 49 A K - 0 0 151 25,-0.3 2,-0.4 -2,-0.3 25,-0.2 -0.249 43.6-155.3 -56.3 143.8 11.2 60.3 9.0 50 50 A R B -J 73 0C 70 23,-2.7 23,-1.5 1,-0.1 25,-0.1 -0.989 22.2-159.0-130.2 136.6 10.5 57.0 7.4 51 51 A E - 0 0 180 -2,-0.4 2,-0.1 1,-0.2 -1,-0.1 0.759 42.3-147.4 -81.0 -25.4 8.2 56.1 4.4 52 52 A G - 0 0 21 18,-0.2 18,-0.3 19,-0.2 -1,-0.2 -0.426 34.9 -29.0 90.1-168.8 8.1 52.5 5.5 53 53 A N S S- 0 0 18 16,-3.1 4,-0.1 15,-0.2 15,-0.0 -0.334 74.0 -83.7 -83.3 165.1 7.8 49.4 3.3 54 54 A P - 0 0 75 0, 0.0 157,-0.2 0, 0.0 -1,-0.1 -0.257 65.1 -69.8 -64.3 153.1 6.1 49.1 -0.2 55 55 A L S S+ 0 0 126 156,-0.1 2,-0.1 155,-0.1 155,-0.1 -0.619 107.5 52.3 -93.6 154.7 2.3 48.5 -0.4 56 56 A P + 0 0 60 0, 0.0 155,-3.0 0, 0.0 3,-0.1 0.484 68.9 142.4 -73.8 141.5 0.3 46.5 0.1 57 57 A R + 0 0 46 1,-0.3 11,-2.5 153,-0.2 2,-0.3 0.358 58.1 47.6-129.6 1.0 1.7 46.1 3.6 58 58 A Y E +K 67 0D 46 9,-0.2 2,-0.4 151,-0.2 -1,-0.3 -0.979 58.4 177.0-145.8 132.6 -1.4 45.6 5.8 59 59 A V E -K 66 0D 37 7,-2.2 7,-1.7 -2,-0.3 2,-0.3 -0.996 26.5-129.4-140.4 131.4 -4.3 43.2 5.3 60 60 A D E -K 65 0D 83 -2,-0.4 2,-0.3 5,-0.2 5,-0.2 -0.624 29.4-165.5 -77.9 134.8 -7.4 42.5 7.4 61 61 A L E > -K 64 0D 11 3,-2.9 3,-1.5 -2,-0.3 139,-0.0 -0.843 33.1-113.6-120.5 157.0 -7.9 38.8 8.0 62 62 A E T 3 S+ 0 0 184 -2,-0.3 160,-0.1 1,-0.3 -1,-0.1 0.891 120.5 33.9 -54.9 -40.4 -10.9 36.9 9.3 63 63 A L T 3 S- 0 0 28 158,-0.1 160,-1.8 471,-0.1 2,-0.3 0.211 136.1 -60.5-102.0 15.2 -9.0 36.0 12.4 64 64 A G E < S-K 61 0D 3 -3,-1.5 -3,-2.9 157,-0.2 2,-0.3 -0.934 70.1 -63.8 152.6-126.0 -6.9 39.1 12.8 65 65 A S E -KL 60 220D 4 155,-1.8 155,-2.1 -2,-0.3 2,-0.3 -0.981 21.9-148.8-159.7 164.2 -4.4 40.9 10.6 66 66 A I E +KL 59 219D 0 -7,-1.7 -7,-2.2 -2,-0.3 2,-0.3 -0.990 27.0 163.4-138.1 141.7 -1.0 40.6 9.0 67 67 A N E -KL 58 218D 22 151,-1.3 151,-2.6 -2,-0.3 -9,-0.2 -0.997 34.8-172.6-158.4 158.8 1.4 43.5 8.3 68 68 A S + 0 0 0 -11,-2.5 -15,-0.2 -2,-0.3 -10,-0.1 -0.478 25.2 162.3-148.5 63.5 4.9 44.6 7.4 69 69 A M - 0 0 43 -17,-0.1 -16,-3.1 1,-0.1 -11,-0.1 0.869 40.0-138.5 -56.3 -41.8 4.6 48.4 7.7 70 70 A G - 0 0 0 -18,-0.3 -18,-0.2 1,-0.1 -1,-0.1 0.790 55.1 -70.3 84.7 29.8 8.3 48.9 8.0 71 71 A L - 0 0 5 1,-0.2 2,-0.3 -19,-0.1 -19,-0.2 0.914 65.6-172.6 54.0 51.6 8.2 51.5 10.8 72 72 A P + 0 0 7 0, 0.0 2,-0.3 0, 0.0 -21,-0.2 -0.612 22.7 146.2 -73.5 133.1 6.7 54.4 8.7 73 73 A N B -J 50 0C 3 -23,-1.5 -23,-2.7 -2,-0.3 3,-0.1 -0.984 58.8-114.4-162.8 160.8 6.7 57.5 11.0 74 74 A L S S- 0 0 60 -50,-0.4 -25,-0.3 -2,-0.3 4,-0.3 0.335 70.4 -94.1 -85.9 9.3 7.1 61.2 10.9 75 75 A G >> - 0 0 4 -27,-0.3 4,-1.5 2,-0.1 3,-0.6 0.171 33.6 -82.7 94.9 147.9 10.3 61.3 12.9 76 76 A F H 3> S+ 0 0 0 -30,-2.2 4,-2.7 1,-0.2 5,-0.3 0.894 123.6 54.0 -50.4 -50.6 11.4 61.7 16.5 77 77 A D H 3> S+ 0 0 84 -30,-0.5 4,-2.5 1,-0.2 -1,-0.2 0.849 104.4 56.0 -57.2 -36.5 11.3 65.5 16.5 78 78 A Y H <> S+ 0 0 69 -3,-0.6 4,-1.7 -4,-0.3 -1,-0.2 0.950 113.4 39.0 -61.6 -50.1 7.7 65.5 15.1 79 79 A Y H X S+ 0 0 0 -4,-1.5 4,-2.6 2,-0.2 5,-0.2 0.902 115.9 50.9 -69.3 -41.5 6.4 63.4 18.0 80 80 A L H X S+ 0 0 15 -4,-2.7 4,-2.3 1,-0.2 5,-0.2 0.950 109.9 50.4 -61.9 -47.7 8.5 65.0 20.7 81 81 A D H X S+ 0 0 84 -4,-2.5 4,-1.6 -5,-0.3 -1,-0.2 0.899 112.7 48.8 -56.7 -40.6 7.4 68.5 19.6 82 82 A Y H X S+ 0 0 11 -4,-1.7 4,-2.2 -5,-0.2 5,-0.2 0.934 111.8 45.2 -65.9 -50.2 3.8 67.3 19.8 83 83 A V H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.858 111.3 54.9 -64.7 -33.7 3.8 65.7 23.2 84 84 A L H X S+ 0 0 39 -4,-2.3 4,-1.1 -5,-0.2 -1,-0.2 0.892 110.5 44.8 -66.5 -40.3 5.7 68.7 24.7 85 85 A K H X S+ 0 0 142 -4,-1.6 4,-0.5 -5,-0.2 -2,-0.2 0.894 114.7 46.9 -71.3 -42.2 3.1 71.2 23.5 86 86 A N H >X>S+ 0 0 17 -4,-2.2 3,-1.4 1,-0.2 4,-0.9 0.881 104.4 62.5 -66.8 -37.4 0.1 69.1 24.6 87 87 A Q H ><5S+ 0 0 50 -4,-2.2 3,-0.9 1,-0.3 -1,-0.2 0.894 99.9 55.5 -52.6 -41.9 1.8 68.5 28.0 88 88 A K H 3<5S+ 0 0 169 -4,-1.1 -1,-0.3 1,-0.2 -2,-0.2 0.683 101.1 58.2 -66.6 -20.3 1.6 72.3 28.5 89 89 A E H <<5S- 0 0 125 -3,-1.4 -1,-0.2 -4,-0.5 -2,-0.2 0.698 85.6-150.6 -85.1 -19.3 -2.2 72.4 28.0 90 90 A N T <<5 + 0 0 143 -3,-0.9 -3,-0.1 -4,-0.9 -2,-0.1 0.924 45.2 145.6 46.4 50.1 -3.1 69.9 30.7 91 91 A A < + 0 0 55 -5,-0.5 2,-0.3 1,-0.0 -1,-0.1 0.058 52.1 49.7-104.0 22.2 -6.1 69.0 28.6 92 92 A Q S S- 0 0 56 -5,-0.1 2,-0.6 -6,-0.1 4,-0.1 -0.975 78.0-116.9-161.0 145.7 -6.1 65.3 29.6 93 93 A E S S+ 0 0 116 -2,-0.3 -81,-0.3 2,-0.0 -84,-0.0 -0.744 87.3 20.3 -85.6 117.5 -6.1 63.0 32.6 94 94 A G S S- 0 0 20 -2,-0.6 -83,-0.1 -83,-0.1 28,-0.1 0.231 93.4 -79.2 100.1 136.9 -3.0 60.8 32.5 95 95 A P - 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