==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 07-APR-10 3MGU . COMPND 2 MOLECULE: PKHD-TYPE HYDROXYLASE TPA1; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR J.HENRI,D.RISPAL,E.BAYART,H.VAN TILBEURGH,B.SERAPHIN,M.GRAIL . 533 6 1 0 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24026.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 369 69.2 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 . 126 23.6 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 . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 45 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 56 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 124 23.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 2 0 0 1 1 1 3 1 0 1 2 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 . 8 5 5 3 2 0 2 3 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 0 1 0 0 0 1 0 0 0 1 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 26 A I 0 0 199 0, 0.0 3,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 3.6 -42.6 15.7 4.8 2 27 A K + 0 0 51 1,-0.1 2,-1.6 76,-0.0 79,-0.1 0.053 360.0 124.5-105.8 17.7 -41.6 15.0 1.2 3 28 A G + 0 0 52 1,-0.2 -1,-0.1 2,-0.0 7,-0.1 -0.064 30.6 119.1 -74.0 39.3 -40.6 11.5 2.0 4 29 A M + 0 0 60 -2,-1.6 34,-1.5 2,-0.1 -1,-0.2 -0.199 50.8 88.8 -97.5 37.2 -43.0 10.3 -0.7 5 30 A F B S-A 37 0A 8 32,-0.2 32,-0.3 1,-0.1 34,-0.1 -0.027 106.1 -45.7 -98.5-148.6 -40.2 8.6 -2.8 6 31 A N > - 0 0 33 30,-1.7 3,-1.8 1,-0.2 4,-0.4 -0.831 57.8-133.9 -80.7 121.4 -39.1 5.1 -2.4 7 32 A P G > S+ 0 0 99 0, 0.0 3,-1.5 0, 0.0 4,-0.4 0.830 101.7 62.8 -45.1 -36.1 -38.8 4.8 1.4 8 33 A K G > S+ 0 0 71 1,-0.3 3,-1.3 2,-0.2 6,-0.3 0.783 82.9 72.5 -65.6 -32.6 -35.4 3.1 0.9 9 34 A I G < S+ 0 0 0 -3,-1.8 -1,-0.3 1,-0.3 27,-0.0 0.698 102.0 48.1 -58.0 -13.8 -33.7 6.1 -0.8 10 35 A W G < S+ 0 0 75 -3,-1.5 2,-0.4 -4,-0.4 -1,-0.3 0.620 85.4 101.2-100.0 -19.7 -33.7 7.6 2.6 11 36 A D S X> S- 0 0 74 -3,-1.3 4,-2.2 -4,-0.4 3,-1.1 -0.573 70.4-144.3 -65.2 121.2 -32.3 4.5 4.4 12 37 A K H 3> S+ 0 0 127 -2,-0.4 4,-2.5 1,-0.3 5,-0.2 0.763 95.5 59.5 -68.8 -27.5 -28.6 5.4 4.9 13 38 A T H 3> S+ 0 0 110 2,-0.2 4,-1.0 1,-0.2 -1,-0.3 0.713 109.8 44.7 -72.7 -21.3 -27.3 1.9 4.3 14 39 A F H <> S+ 0 0 51 -3,-1.1 4,-1.3 -6,-0.3 -2,-0.2 0.869 111.8 52.6 -80.1 -45.6 -28.9 2.0 0.8 15 40 A Q H X S+ 0 0 30 -4,-2.2 4,-1.8 -7,-0.3 -2,-0.2 0.910 111.6 46.7 -51.9 -46.2 -27.5 5.5 0.3 16 41 A D H X S+ 0 0 55 -4,-2.5 4,-1.1 1,-0.3 -1,-0.2 0.860 109.2 51.7 -71.2 -39.4 -24.0 4.3 1.2 17 42 A G H < S+ 0 0 44 -4,-1.0 -1,-0.3 1,-0.2 4,-0.2 0.739 110.3 55.1 -61.7 -22.2 -24.2 1.2 -1.0 18 43 A L H >X S+ 0 0 4 -4,-1.3 4,-2.4 2,-0.2 3,-0.9 0.885 102.0 50.7 -83.3 -41.2 -25.2 3.7 -3.7 19 44 A K H 3X S+ 0 0 61 -4,-1.8 4,-1.1 1,-0.2 -1,-0.2 0.798 111.8 52.0 -65.6 -24.9 -22.3 6.1 -3.5 20 45 A K H 3X S+ 0 0 121 -4,-1.1 4,-0.8 2,-0.2 -1,-0.2 0.518 107.8 50.8 -90.6 -8.3 -20.0 3.0 -3.8 21 46 A E H <> S+ 0 0 119 -3,-0.9 4,-1.0 -4,-0.2 -2,-0.2 0.859 110.2 48.1 -85.8 -49.9 -21.9 1.8 -6.9 22 47 A I H < S+ 0 0 8 -4,-2.4 8,-0.3 1,-0.2 3,-0.2 0.849 111.4 53.5 -55.0 -37.0 -21.5 5.1 -8.6 23 48 A E H < S+ 0 0 72 -4,-1.1 -1,-0.2 1,-0.2 -2,-0.2 0.922 113.5 39.8 -66.2 -45.8 -17.8 5.0 -7.6 24 49 A D H < S+ 0 0 108 -4,-0.8 -1,-0.2 2,-0.0 -2,-0.2 0.523 92.6 124.3 -79.0 -7.0 -17.2 1.6 -9.2 25 50 A S < - 0 0 23 -4,-1.0 6,-0.1 -3,-0.2 -3,-0.1 -0.219 55.1-106.9 -66.1 145.6 -19.4 2.4 -12.2 26 51 A Q S S+ 0 0 98 1,-0.1 124,-0.1 3,-0.1 -2,-0.0 -0.916 79.6 2.9-126.8 150.2 -18.0 2.1 -15.7 27 52 A P S S- 0 0 41 0, 0.0 2,-0.3 0, 0.0 126,-0.2 -0.987 134.3 -11.9 -86.2 -19.9 -17.0 3.5 -18.2 28 53 A Y S S- 0 0 10 124,-0.1 2,-0.5 157,-0.1 122,-0.0 -0.830 95.6 -67.8-128.7 176.4 -17.5 6.8 -16.3 29 54 A N S S+ 0 0 53 -2,-0.3 149,-0.4 149,-0.1 2,-0.3 -0.519 71.7 134.0 -75.9 114.9 -19.3 7.5 -13.0 30 55 A W - 0 0 48 -2,-0.5 2,-0.3 -8,-0.3 147,-0.2 -0.965 27.9-165.9-151.0 159.7 -23.1 7.0 -13.3 31 56 A G E -B 176 0B 4 145,-2.3 145,-2.0 -2,-0.3 2,-0.3 -0.947 7.9-150.8-147.2 167.3 -25.9 5.3 -11.3 32 57 A T E -B 175 0B 24 -2,-0.3 2,-0.4 143,-0.2 143,-0.2 -0.995 4.9-154.5-143.6 135.9 -29.5 4.1 -11.5 33 58 A I E > -B 174 0B 1 141,-1.2 141,-2.4 -2,-0.3 3,-0.5 -0.945 16.4-144.6-105.9 133.0 -32.3 3.8 -8.9 34 59 A H T 3 S+ 0 0 116 -2,-0.4 136,-0.1 1,-0.2 -1,-0.1 0.784 87.0 11.2 -75.8 -31.5 -34.9 1.2 -9.7 35 60 A E T 3 S+ 0 0 111 1,-0.1 -1,-0.2 138,-0.1 138,-0.2 -0.430 72.0 172.2-143.6 70.2 -38.1 2.7 -8.4 36 61 A L < + 0 0 0 136,-1.5 -30,-1.7 -3,-0.5 2,-0.2 0.832 55.8 36.5 -49.8 -54.7 -37.4 6.3 -7.5 37 62 A V B S-A 5 0A 4 -32,-0.3 2,-0.4 135,-0.1 -32,-0.2 -0.563 98.5 -74.6-107.6 165.0 -40.9 7.7 -6.7 38 63 A N >> - 0 0 62 -34,-1.5 3,-1.9 -2,-0.2 4,-1.3 -0.414 47.5-132.8 -50.7 110.3 -44.1 6.7 -5.1 39 64 A D H 3> S+ 0 0 61 -2,-0.4 4,-2.0 1,-0.3 5,-0.2 0.787 104.6 55.5 -40.5 -40.0 -45.6 4.5 -7.8 40 65 A D H 3> S+ 0 0 110 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.863 102.9 55.0 -65.4 -36.9 -48.9 6.3 -7.5 41 66 A L H <> S+ 0 0 9 -3,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.820 109.2 46.8 -68.4 -32.5 -47.3 9.7 -8.2 42 67 A L H X S+ 0 0 0 -4,-1.3 4,-3.3 2,-0.2 5,-0.3 0.964 108.6 53.1 -72.7 -51.8 -45.7 8.6 -11.4 43 68 A R H X S+ 0 0 75 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.866 113.5 47.2 -50.4 -36.1 -48.9 7.0 -12.8 44 69 A A H X S+ 0 0 34 -4,-1.6 4,-2.4 2,-0.2 -1,-0.2 0.942 113.2 44.7 -70.8 -48.7 -50.5 10.3 -12.1 45 70 A V H X S+ 0 0 0 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.765 116.9 47.2 -72.1 -25.8 -47.9 12.5 -13.7 46 71 A R H X S+ 0 0 36 -4,-3.3 4,-3.3 2,-0.2 5,-0.2 0.954 111.3 49.7 -71.6 -56.8 -47.7 10.2 -16.7 47 72 A K H X S+ 0 0 86 -4,-2.3 4,-1.3 -5,-0.3 -2,-0.2 0.877 110.5 53.5 -47.0 -44.1 -51.5 10.0 -17.1 48 73 A E H >X S+ 0 0 27 -4,-2.4 3,-1.0 2,-0.2 4,-0.9 0.967 111.1 42.4 -58.8 -57.3 -51.5 13.8 -16.9 49 74 A I H >X S+ 0 0 0 -4,-1.6 4,-2.7 1,-0.3 3,-1.3 0.933 109.9 59.7 -50.9 -52.9 -48.9 14.3 -19.7 50 75 A E H 3< S+ 0 0 118 -4,-3.3 -1,-0.3 1,-0.3 -2,-0.2 0.790 117.3 31.3 -46.4 -33.7 -50.6 11.6 -21.7 51 76 A T H << S+ 0 0 94 -4,-1.3 -1,-0.3 -3,-1.0 -2,-0.2 0.408 130.6 30.2-110.8 2.1 -53.9 13.6 -21.6 52 77 A E H << S+ 0 0 132 -3,-1.3 2,-0.4 -4,-0.9 -3,-0.2 0.603 98.1 81.5-132.1 -23.7 -52.6 17.2 -21.5 53 78 A I < - 0 0 47 -4,-2.7 2,-0.5 -5,-0.3 -1,-0.1 -0.747 59.2-145.4-104.7 135.9 -49.3 17.5 -23.4 54 79 A H - 0 0 164 -2,-0.4 2,-0.6 14,-0.1 -4,-0.0 -0.845 12.2-163.8 -98.0 125.6 -48.6 17.7 -27.1 55 80 A F - 0 0 55 -2,-0.5 2,-0.4 13,-0.1 13,-0.2 -0.922 6.3-169.6-110.7 115.0 -45.5 16.0 -28.4 56 81 A T - 0 0 94 -2,-0.6 11,-2.7 11,-0.4 2,-0.1 -0.846 25.8-112.2-106.8 140.0 -44.3 17.0 -31.9 57 82 A K E -C 66 0B 112 -2,-0.4 2,-0.3 9,-0.3 9,-0.2 -0.414 34.4-174.8 -68.2 135.6 -41.6 15.2 -33.9 58 83 A K E -C 65 0B 103 7,-1.4 7,-1.8 -2,-0.1 2,-0.4 -0.974 3.6-165.9-129.7 147.3 -38.3 17.1 -34.4 59 84 A E E +C 64 0B 53 -2,-0.3 2,-0.2 5,-0.2 5,-0.2 -0.986 18.0 148.5-140.4 128.9 -35.3 16.0 -36.5 60 85 A T - 0 0 42 3,-2.5 -2,-0.0 -2,-0.4 3,-0.0 -0.704 62.9 -82.7-131.3-169.1 -31.7 17.2 -36.8 61 86 A D S S+ 0 0 27 -2,-0.2 456,-0.6 1,-0.2 376,-0.1 0.891 127.0 42.8 -63.2 -41.9 -28.5 15.5 -37.6 62 87 A I S S+ 0 0 58 1,-0.1 54,-2.3 454,-0.1 2,-0.3 0.650 121.2 5.1 -81.9 -20.7 -28.0 14.2 -34.0 63 88 A Y E - D 0 115B 49 52,-0.2 -3,-2.5 2,-0.1 2,-0.3 -0.985 39.3-149.7-155.4 164.7 -31.5 13.1 -33.2 64 89 A R E +CD 59 114B 12 50,-2.6 50,-2.4 -2,-0.3 2,-0.3 -0.932 44.4 141.0-133.4 121.7 -35.1 12.4 -34.0 65 90 A V E -C 58 0B 6 -7,-1.8 -7,-1.4 -2,-0.3 2,-0.5 -0.973 51.2-115.8-159.9 143.5 -37.4 12.8 -31.0 66 91 A N E -CE 57 108B 18 42,-1.7 42,-1.6 -2,-0.3 -9,-0.3 -0.758 45.4-174.3 -88.3 123.4 -40.9 14.2 -30.2 67 92 A Q 0 0 64 -11,-2.7 -11,-0.4 -2,-0.5 41,-0.1 0.104 360.0 360.0-105.2-156.0 -40.6 17.3 -27.9 68 93 A S 0 0 97 -13,-0.2 39,-0.1 39,-0.1 -1,-0.1 -0.046 360.0 360.0 162.3 360.0 -42.6 19.9 -25.9 69 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 70 111 A P > 0 0 118 0, 0.0 3,-2.8 0, 0.0 4,-0.5 0.000 360.0 360.0 360.0-163.4 -51.0 19.9 -12.1 71 112 A N T 3> + 0 0 51 1,-0.3 4,-1.2 2,-0.2 -26,-0.2 0.534 360.0 73.9 -61.2 -5.0 -49.3 17.1 -10.0 72 113 A L H >> S+ 0 0 27 2,-0.2 4,-1.6 1,-0.2 3,-0.6 0.928 91.1 59.9 -61.2 -44.3 -46.5 16.9 -12.5 73 114 A F H <> S+ 0 0 116 -3,-2.8 4,-1.3 1,-0.3 -2,-0.2 0.854 98.5 58.4 -45.4 -40.4 -45.6 20.2 -10.8 74 115 A K H 3> S+ 0 0 93 -4,-0.5 4,-2.2 1,-0.2 3,-0.4 0.911 102.3 51.3 -59.1 -46.4 -45.3 18.1 -7.6 75 116 A L H > S- 0 0 15 1,-0.1 4,-3.1 -79,-0.1 3,-1.0 -0.573 74.0-125.0 -78.3 147.5 -36.3 19.7 -2.9 82 123 A K H 3> S+ 0 0 81 1,-0.3 4,-2.5 2,-0.2 5,-0.4 0.886 109.8 64.2 -65.1 -38.1 -33.3 20.0 -0.6 83 124 A Q H 3> S+ 0 0 77 1,-0.2 4,-0.8 2,-0.2 -1,-0.3 0.843 116.3 31.4 -48.3 -34.8 -34.2 16.6 1.0 84 125 A Y H <> S+ 0 0 0 -3,-1.0 4,-3.5 2,-0.2 -2,-0.2 0.876 114.7 55.1 -95.4 -48.3 -33.4 15.2 -2.4 85 126 A R H X S+ 0 0 34 -4,-3.1 4,-3.4 2,-0.2 5,-0.2 0.946 109.8 51.1 -46.6 -53.2 -30.7 17.5 -3.8 86 127 A D H < S+ 0 0 64 -4,-2.5 4,-0.4 1,-0.2 -1,-0.2 0.940 113.6 43.1 -50.7 -57.2 -28.7 16.8 -0.6 87 128 A F H >X S+ 0 0 10 -4,-0.8 4,-2.2 -5,-0.4 3,-0.6 0.884 116.1 49.1 -55.2 -43.8 -29.0 13.0 -1.0 88 129 A F H 3X S+ 0 0 0 -4,-3.5 4,-1.6 1,-0.2 5,-0.2 0.954 109.9 48.9 -64.1 -51.7 -28.4 13.2 -4.8 89 130 A G H 3<>S+ 0 0 6 -4,-3.4 6,-1.6 -5,-0.2 5,-0.5 0.506 113.3 52.9 -68.3 -4.0 -25.2 15.4 -4.5 90 131 A Y H X45S+ 0 0 85 -3,-0.6 3,-0.8 -4,-0.4 -2,-0.2 0.892 110.4 39.1 -91.5 -64.3 -24.0 13.0 -1.8 91 132 A V H 3<5S+ 0 0 0 -4,-2.2 -69,-0.2 1,-0.3 -2,-0.2 0.725 124.2 45.1 -58.1 -20.4 -24.3 9.6 -3.6 92 133 A T T 3<5S- 0 0 4 -4,-1.6 -1,-0.3 -5,-0.3 -3,-0.2 0.633 101.8-133.6-102.0 -19.1 -23.0 11.3 -6.7 93 134 A K T < 5 + 0 0 87 -3,-0.8 -3,-0.2 -5,-0.2 -4,-0.1 0.831 67.5 123.6 71.0 34.4 -20.2 13.3 -5.2 94 135 A A < - 0 0 12 -5,-0.5 2,-0.3 1,-0.3 -4,-0.1 0.523 57.7-148.5 -99.6 -7.9 -21.1 16.6 -6.9 95 136 A G + 0 0 39 -6,-1.6 -1,-0.3 -9,-0.1 2,-0.2 -0.580 58.0 12.3 74.8-135.0 -21.5 18.6 -3.8 96 137 A K - 0 0 73 -2,-0.3 2,-0.3 117,-0.2 117,-0.1 -0.479 62.8-174.1 -84.1 146.9 -24.1 21.4 -3.8 97 138 A L - 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