==== 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 HYDROXYLASE 19-SEP-96 1HQI . COMPND 2 MOLECULE: PHENOL HYDROXYLASE P2 PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS SP.; . AUTHOR H.QIAN,I.SETHON . 90 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7386.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 52 57.8 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 . 14 15.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 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 . 2 2.2 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 . 2 2.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 8 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 21 23.3 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 0 0 1 0 0 1 0 0 1 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 . 1 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 0 212 0, 0.0 3,-0.1 0, 0.0 43,-0.1 0.000 360.0 360.0 360.0 47.3 2.4 20.4 -0.2 2 2 A S + 0 0 77 1,-0.2 42,-0.2 41,-0.1 0, 0.0 0.222 360.0 105.4-162.2 -54.2 2.0 18.3 2.9 3 3 A S + 0 0 45 40,-0.2 2,-0.3 85,-0.0 -1,-0.2 -0.176 52.4 169.5 -44.3 110.1 -0.9 15.8 2.7 4 4 A L - 0 0 40 39,-0.4 39,-0.3 -3,-0.1 2,-0.1 -0.925 20.3-166.2-130.0 155.6 1.1 12.5 2.2 5 5 A V - 0 0 6 -2,-0.3 37,-0.9 40,-0.1 2,-0.2 -0.202 7.4-151.9-116.7-150.2 0.2 8.8 2.2 6 6 A Y - 0 0 59 35,-0.3 2,-0.4 -2,-0.1 35,-0.3 -0.769 7.2-164.8 172.8 139.8 2.2 5.6 2.3 7 7 A I - 0 0 64 66,-0.3 33,-0.4 -2,-0.2 66,-0.3 -0.998 12.7-174.8-136.6 139.4 2.0 2.0 1.2 8 8 A A E +A 72 0A 1 64,-0.6 64,-1.6 -2,-0.4 2,-0.3 -0.903 6.0 180.0-134.2 164.8 4.2 -0.9 2.4 9 9 A F E -AB 71 38A 100 29,-1.4 29,-1.9 -2,-0.3 2,-0.4 -0.989 17.4-151.9-158.8 151.6 4.7 -4.6 1.6 10 10 A Q E +A 70 0A 46 60,-1.7 60,-0.6 -2,-0.3 27,-0.1 -0.797 29.2 158.2-131.8 93.0 6.8 -7.5 2.8 11 11 A D - 0 0 80 -2,-0.4 59,-0.1 58,-0.2 60,-0.0 0.415 55.4 -61.0 -87.0-132.3 7.5 -10.2 0.1 12 12 A N S S- 0 0 101 57,-0.1 -1,-0.0 1,-0.0 0, 0.0 0.661 70.1 -81.4 -86.4-111.9 10.4 -12.6 0.1 13 13 A D S > S+ 0 0 91 -3,-0.1 4,-0.5 3,-0.0 -2,-0.0 0.541 118.0 31.1-132.6 -24.5 14.0 -11.2 0.1 14 14 A N H > S+ 0 0 113 2,-0.1 4,-2.2 3,-0.1 -3,-0.0 0.842 108.5 60.5-103.0 -54.4 14.7 -10.4 -3.6 15 15 A A H > S+ 0 0 42 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.837 104.5 58.6 -44.3 -31.2 11.3 -9.5 -5.2 16 16 A R H > S+ 0 0 34 2,-0.2 4,-1.6 1,-0.2 3,-0.3 0.998 102.8 46.5 -64.8 -63.6 11.4 -6.7 -2.6 17 17 A Y H X S+ 0 0 128 -4,-0.5 4,-1.8 1,-0.2 5,-0.2 0.881 107.7 62.7 -47.5 -36.6 14.6 -5.0 -3.7 18 18 A V H >X S+ 0 0 84 -4,-2.2 4,-1.5 1,-0.3 3,-1.1 0.982 103.0 45.1 -54.7 -58.6 13.3 -5.3 -7.2 19 19 A V H 3X S+ 0 0 74 -4,-1.8 4,-2.3 -3,-0.3 -1,-0.3 0.802 107.6 63.7 -56.7 -22.8 10.3 -3.0 -6.5 20 20 A E H 3X S+ 0 0 17 -4,-1.6 4,-1.9 1,-0.2 -1,-0.3 0.904 99.6 49.9 -69.5 -38.4 12.9 -0.8 -4.8 21 21 A A H > - 0 0 162 -2,-0.3 3,-0.9 34,-0.2 4,-0.9 -0.433 35.4 -99.8 -97.3 176.4 -14.4 2.5 -6.2 50 50 A R H 3> S+ 0 0 131 1,-0.2 4,-1.7 2,-0.2 5,-0.2 0.801 113.0 80.1 -67.1 -24.4 -16.5 -0.5 -5.0 51 51 A E H 3> S+ 0 0 126 1,-0.2 4,-1.5 2,-0.2 3,-0.3 0.912 93.1 49.3 -49.5 -40.9 -15.2 -2.4 -8.1 52 52 A T H X> S+ 0 0 59 -3,-0.9 4,-2.3 1,-0.2 3,-0.6 0.959 104.6 55.9 -65.6 -46.4 -12.0 -3.0 -6.1 53 53 A V H 3X S+ 0 0 67 -4,-0.9 4,-1.3 1,-0.3 -1,-0.2 0.812 104.9 57.0 -56.1 -23.0 -14.0 -4.3 -3.1 54 54 A E H 3X S+ 0 0 122 -4,-1.7 4,-1.8 -3,-0.3 -1,-0.3 0.897 106.0 47.7 -75.6 -38.2 -15.5 -6.7 -5.7 55 55 A E H < S+ 0 0 130 -4,-1.3 3,-1.4 -5,-0.4 -1,-0.2 0.982 109.2 37.9 -58.2 -55.8 -14.3 -10.2 -2.4 58 58 A G H 3< S+ 0 0 72 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.620 124.8 44.6 -71.3 -7.5 -13.5 -13.0 -4.9 59 59 A R T >< S+ 0 0 146 -4,-1.1 3,-1.3 -3,-0.2 -1,-0.3 0.255 78.7 103.3-117.0 10.2 -9.9 -12.9 -3.5 60 60 A A G X + 0 0 54 -3,-1.4 3,-0.8 -4,-0.4 -2,-0.1 0.614 69.2 73.3 -69.3 -6.9 -10.8 -12.7 0.2 61 61 A W G 3 S+ 0 0 236 1,-0.2 -1,-0.3 -4,-0.2 3,-0.1 0.198 80.1 74.5 -91.4 19.8 -9.8 -16.4 0.3 62 62 A D G X> + 0 0 39 -3,-1.3 4,-2.0 -6,-0.2 3,-0.5 0.263 55.5 112.5-111.8 10.2 -6.1 -15.4 0.0 63 63 A V H <> S+ 0 0 71 -3,-0.8 4,-1.5 1,-0.2 3,-0.3 0.925 74.4 58.5 -49.5 -46.2 -5.8 -14.1 3.6 64 64 A Q H >> S+ 0 0 139 1,-0.3 4,-1.2 2,-0.2 3,-0.7 0.936 107.9 45.5 -51.6 -45.9 -3.4 -17.0 4.3 65 65 A E H <> S+ 0 0 128 -3,-0.5 4,-1.1 1,-0.2 -1,-0.3 0.832 108.6 57.4 -68.3 -27.9 -1.1 -15.8 1.5 66 66 A M H 3< S+ 0 0 70 -4,-2.0 -1,-0.2 -3,-0.3 -2,-0.2 0.726 98.4 63.9 -74.8 -17.9 -1.5 -12.3 2.9 67 67 A L H << S+ 0 0 130 -4,-1.5 -2,-0.2 -3,-0.7 -1,-0.2 0.986 99.7 48.2 -69.8 -57.5 -0.1 -13.5 6.2 68 68 A V H < S+ 0 0 124 -4,-1.2 -2,-0.2 2,-0.0 2,-0.2 0.964 117.9 41.6 -47.0 -64.9 3.4 -14.5 5.0 69 69 A D S < S- 0 0 34 -4,-1.1 -58,-0.2 1,-0.1 2,-0.2 -0.505 88.8-129.3 -82.9 154.8 3.9 -11.2 3.2 70 70 A V E -A 10 0A 59 -60,-0.6 -60,-1.7 -2,-0.2 2,-0.3 -0.587 20.2-161.2 -99.5 165.7 2.8 -7.9 4.8 71 71 A I E +A 9 0A 67 -62,-0.2 2,-0.3 -2,-0.2 -62,-0.3 -0.996 15.2 161.1-146.1 151.8 0.7 -5.2 3.2 72 72 A T E -A 8 0A 35 -64,-1.6 -64,-0.6 -2,-0.3 2,-0.3 -0.975 9.6-172.7-165.4 151.9 -0.0 -1.5 3.8 73 73 A I - 0 0 69 -66,-0.3 2,-1.2 -2,-0.3 -66,-0.3 -0.999 56.4 -26.9-154.6 152.0 -1.4 1.5 1.8 74 74 A G S S- 0 0 1 -2,-0.3 -32,-0.2 1,-0.2 3,-0.1 -0.154 91.2 -95.1 46.8 -85.1 -2.0 5.3 2.1 75 75 A G S S+ 0 0 40 -2,-1.2 -1,-0.2 1,-0.5 14,-0.1 -0.013 92.4 18.1 171.4 -47.8 -2.2 5.4 5.8 76 76 A N - 0 0 87 11,-0.7 -1,-0.5 12,-0.3 -3,-0.1 -0.135 68.1-130.3-120.3-141.7 -5.8 5.3 7.0 77 77 A V - 0 0 79 -3,-0.1 2,-0.5 -2,-0.1 9,-0.2 -0.402 14.2-171.3 178.9 98.5 -9.1 4.2 5.3 78 78 A D E -D 85 0B 40 7,-1.9 7,-2.4 -2,-0.1 2,-0.4 -0.840 11.4-175.2-100.4 129.9 -12.4 6.1 5.2 79 79 A E E -D 84 0B 153 -2,-0.5 5,-0.2 5,-0.2 -2,-0.0 -0.967 10.5-176.1-125.6 140.0 -15.4 4.2 3.8 80 80 A D - 0 0 125 3,-0.8 -1,-0.1 -2,-0.4 4,-0.1 0.720 66.3 -43.0 -97.6 -96.4 -18.9 5.6 3.1 81 81 A D S S- 0 0 159 0, 0.0 -2,-0.0 0, 0.0 3,-0.0 0.831 119.4 -27.3-104.0 -61.0 -21.5 3.1 1.9 82 82 A D S S+ 0 0 93 2,-0.0 -29,-0.1 0, 0.0 0, 0.0 0.581 116.7 84.9-127.9 -30.8 -19.9 0.8 -0.7 83 83 A R - 0 0 100 -33,-0.1 -3,-0.8 -31,-0.0 2,-0.4 -0.190 65.6-146.2 -68.6 168.2 -17.1 3.0 -2.2 84 84 A F E +CD 48 79B 49 -36,-1.7 -36,-2.0 -5,-0.2 2,-0.3 -0.979 21.2 168.7-141.8 127.1 -13.7 3.2 -0.4 85 85 A V E +CD 47 78B 14 -7,-2.4 -7,-1.9 -2,-0.4 2,-0.3 -0.984 5.0 173.2-138.6 150.7 -11.4 6.1 -0.2 86 86 A L E +C 46 0B 0 -40,-1.2 -40,-1.2 -2,-0.3 2,-0.1 -0.955 1.8 173.0-157.2 135.8 -8.2 7.0 1.8 87 87 A E E -C 45 0B 42 -2,-0.3 -11,-0.7 -42,-0.3 -42,-0.2 -0.306 60.2 -50.8-121.5-151.8 -5.8 9.9 1.6 88 88 A W S S+ 0 0 94 -44,-0.9 -12,-0.3 -2,-0.1 -43,-0.1 0.966 70.4 162.1 -50.8 -78.4 -2.8 11.0 3.8 89 89 A K 0 0 91 -14,-0.1 -3,-0.0 1,-0.1 -44,-0.0 0.799 360.0 360.0 58.9 112.8 -4.7 10.8 7.1 90 90 A N 0 0 186 -15,-0.0 -1,-0.1 -14,-0.0 -15,-0.1 -0.777 360.0 360.0 -96.6 360.0 -2.2 10.7 10.1