==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 09-DEC-11 3V1N . COMPND 2 MOLECULE: 2-HYDROXY-6-OXO-6-PHENYLHEXA-2,4-DIENOATE HYDROLA . SOURCE 2 ORGANISM_SCIENTIFIC: BURKHOLDERIA XENOVORANS; . AUTHOR S.GHOSH,J.T.BOLIN . 283 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11867.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 196 69.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 31 11.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 14 4.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 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 0.7 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 . 17 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 95 33.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 1 1 0 0 1 0 2 1 2 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 2 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 PARALLEL BRIDGES PER LADDER . 0 0 0 1 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 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 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 4 A L 0 0 114 0, 0.0 2,-0.3 0, 0.0 53,-0.1 0.000 360.0 360.0 360.0 138.3 -19.3 30.7 -22.0 2 5 A T > - 0 0 77 1,-0.1 4,-1.4 5,-0.0 5,-0.1 -0.899 360.0-112.9-130.7 163.0 -17.2 29.7 -25.0 3 6 A E H > S+ 0 0 52 -2,-0.3 4,-1.0 1,-0.2 3,-0.3 0.922 117.6 49.0 -58.5 -44.8 -13.4 29.4 -25.7 4 7 A S H 4 S+ 0 0 98 1,-0.2 3,-0.5 2,-0.2 -1,-0.2 0.905 109.6 48.8 -64.5 -45.0 -13.6 32.4 -28.0 5 8 A S H 4 S+ 0 0 85 1,-0.2 -1,-0.2 20,-0.0 -2,-0.2 0.748 118.7 40.2 -69.7 -22.8 -15.5 34.7 -25.8 6 9 A T H < S+ 0 0 5 -4,-1.4 20,-2.4 -3,-0.3 -1,-0.2 0.510 86.4 122.2-101.9 -8.1 -13.2 34.0 -22.8 7 10 A S E < +A 25 0A 35 -4,-1.0 2,-0.3 -3,-0.5 18,-0.2 -0.329 32.1 162.6 -67.0 131.4 -9.9 34.0 -24.7 8 11 A K E -A 24 0A 89 16,-2.9 16,-2.5 -2,-0.1 2,-0.3 -0.961 24.1-149.1-143.5 159.3 -7.1 36.4 -23.6 9 12 A F E -A 23 0A 106 -2,-0.3 2,-0.3 14,-0.2 14,-0.2 -0.979 12.2-179.4-128.8 144.7 -3.4 36.9 -24.0 10 13 A V E -A 22 0A 21 12,-2.4 12,-2.9 -2,-0.3 2,-0.4 -0.993 23.7-133.2-142.8 136.4 -0.9 38.5 -21.6 11 14 A K E -A 21 0A 113 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.785 29.5-153.3 -86.5 132.1 2.9 39.0 -22.0 12 15 A I E -A 20 0A 1 8,-3.0 8,-2.3 -2,-0.4 2,-0.4 -0.835 19.9-171.3-113.3 152.1 4.8 38.0 -18.9 13 16 A N E + 0 0 91 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.922 32.0 132.9-135.7 103.9 8.2 39.0 -17.4 14 17 A E E > S-A 17 0A 35 3,-0.8 3,-2.7 -2,-0.4 79,-0.1 -0.919 74.3 -45.6-155.2 128.2 9.3 36.9 -14.4 15 18 A K T 3 S+ 0 0 155 -2,-0.3 -1,-0.1 1,-0.3 0, 0.0 -0.226 133.8 2.6 46.6-119.7 12.8 35.4 -13.9 16 19 A G T 3 S+ 0 0 75 -3,-0.1 2,-0.4 2,-0.0 -1,-0.3 0.685 111.6 100.1 -68.2 -15.4 13.8 33.9 -17.3 17 20 A F E < -A 14 0A 20 -3,-2.7 -3,-0.8 3,-0.0 2,-0.4 -0.552 47.4-179.5 -82.9 127.8 10.6 35.0 -19.1 18 21 A S E S- 0 0 95 -2,-0.4 -5,-0.2 -5,-0.2 3,-0.1 -0.972 73.4 -28.8-130.2 114.6 10.9 38.1 -21.2 19 22 A D E S+ 0 0 101 -2,-0.4 2,-0.5 1,-0.2 -6,-0.2 0.900 88.0 175.1 41.4 52.7 7.7 39.3 -23.0 20 23 A F E -A 12 0A 22 -8,-2.3 -8,-3.0 55,-0.0 2,-0.5 -0.764 29.3-124.9 -92.5 126.9 6.5 35.8 -23.1 21 24 A N E -A 11 0A 29 -2,-0.5 54,-2.8 -10,-0.2 2,-0.5 -0.602 26.9-173.9 -80.0 122.5 3.0 35.3 -24.4 22 25 A I E -A 10 0A 0 -12,-2.9 -12,-2.4 -2,-0.5 2,-0.4 -0.965 9.1-154.6-115.2 127.5 0.6 33.4 -22.1 23 26 A H E +A 9 0A 0 -2,-0.5 44,-2.6 44,-0.2 2,-0.3 -0.789 22.5 163.3 -94.3 142.2 -2.9 32.5 -23.4 24 27 A Y E -AB 8 66A 10 -16,-2.5 -16,-2.9 -2,-0.4 2,-0.5 -0.978 34.1-130.1-151.4 161.1 -5.7 32.0 -20.9 25 28 A N E -AB 7 65A 2 40,-2.1 40,-3.1 -2,-0.3 2,-0.4 -0.976 29.0-170.3-114.6 126.9 -9.5 31.8 -20.7 26 29 A E E + B 0 64A 32 -20,-2.4 2,-0.3 -2,-0.5 38,-0.2 -0.942 13.5 160.9-124.1 135.4 -11.2 34.0 -18.1 27 30 A A E + B 0 63A 8 36,-2.0 36,-2.7 -2,-0.4 -2,-0.0 -0.983 45.7 25.2-146.1 156.3 -14.8 34.2 -16.9 28 31 A G - 0 0 31 -2,-0.3 34,-0.3 34,-0.2 29,-0.1 -0.071 61.2-124.9 77.8 174.8 -16.4 35.6 -13.8 29 32 A N + 0 0 156 32,-0.2 33,-0.2 28,-0.2 -1,-0.1 0.407 69.2 89.0-145.7 5.7 -15.2 38.4 -11.5 30 33 A G S S- 0 0 30 1,-0.3 31,-0.2 27,-0.1 32,-0.1 0.257 91.6 -17.5 -84.1-150.2 -15.0 37.2 -7.9 31 34 A E E S-c 61 0A 121 29,-0.6 31,-2.2 1,-0.1 2,-0.3 -0.324 82.3-108.4 -54.7 138.2 -12.1 35.6 -6.0 32 35 A T E -c 62 0A 13 70,-0.4 72,-2.2 29,-0.2 2,-0.5 -0.507 33.6-177.0 -82.5 132.0 -9.6 34.3 -8.5 33 36 A V E -cd 63 104A 0 29,-2.8 31,-2.6 -2,-0.3 2,-0.5 -0.998 11.4-158.3-121.8 118.7 -9.1 30.6 -9.1 34 37 A I E -cd 64 105A 0 70,-2.8 72,-2.4 -2,-0.5 2,-0.4 -0.896 7.5-157.2 -99.1 122.7 -6.3 29.7 -11.6 35 38 A M E -cd 65 106A 0 29,-2.8 31,-2.1 -2,-0.5 2,-0.4 -0.891 4.9-159.1-108.5 133.0 -6.7 26.2 -13.1 36 39 A L E -cd 66 107A 0 70,-3.0 72,-2.0 -2,-0.4 75,-0.2 -0.910 9.7-139.7-122.8 128.2 -3.7 24.5 -14.5 37 40 A H - 0 0 0 29,-0.6 74,-0.3 -2,-0.4 8,-0.1 -0.233 18.9 -94.5 -91.0 174.7 -3.7 21.7 -17.0 38 41 A G - 0 0 7 72,-0.2 -1,-0.1 6,-0.2 71,-0.1 -0.057 30.9-111.1 -78.6-176.2 -1.9 18.4 -17.6 39 42 A G + 0 0 8 3,-0.1 3,-0.1 2,-0.0 70,-0.1 0.300 67.9 118.6-108.7 9.6 1.1 17.6 -19.8 40 43 A G S > S- 0 0 2 1,-0.1 3,-2.2 2,-0.1 114,-0.1 -0.348 78.9 -78.0 -76.1 157.7 -0.1 15.4 -22.6 41 44 A P T 3 S+ 0 0 0 0, 0.0 150,-0.2 0, 0.0 -1,-0.1 -0.318 119.1 16.2 -54.2 129.5 0.1 16.5 -26.3 42 45 A G T 3 S+ 0 0 11 1,-0.3 148,-0.1 148,-0.2 149,-0.1 0.447 89.1 151.2 87.5 3.4 -2.6 19.0 -27.1 43 46 A A < + 0 0 5 -3,-2.2 29,-0.3 29,-0.1 2,-0.3 -0.292 12.2 154.7 -63.9 151.1 -3.4 19.9 -23.5 44 47 A G > - 0 0 0 1,-0.1 4,-1.7 27,-0.1 -6,-0.2 -0.981 51.6 -98.1-166.9 171.2 -4.7 23.3 -22.6 45 48 A G H > S+ 0 0 0 -2,-0.3 4,-1.8 20,-0.2 21,-0.2 0.928 113.6 47.5 -64.7 -49.9 -6.8 25.1 -20.1 46 49 A W H > S+ 0 0 35 19,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.939 114.9 44.0 -58.9 -50.5 -10.2 25.3 -21.8 47 50 A S H 4 S+ 0 0 53 1,-0.2 3,-0.4 2,-0.2 -1,-0.2 0.868 114.2 50.9 -67.1 -34.4 -10.3 21.6 -22.8 48 51 A N H < S+ 0 0 8 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.854 123.7 27.5 -70.9 -30.8 -9.1 20.4 -19.4 49 52 A Y H >X S+ 0 0 0 -4,-1.8 4,-2.0 -3,-0.2 3,-2.0 0.124 77.8 122.1-124.0 20.2 -11.7 22.5 -17.4 50 53 A Y T 3< S+ 0 0 123 -4,-0.7 4,-0.5 -3,-0.4 -1,-0.1 0.799 80.8 46.0 -53.7 -36.7 -14.6 22.8 -19.8 51 54 A R T 34 S+ 0 0 107 -4,-0.2 -1,-0.3 -3,-0.2 222,-0.1 0.435 117.1 45.5 -88.8 -0.0 -17.0 21.2 -17.4 52 55 A N T <> S+ 0 0 0 -3,-2.0 4,-2.1 2,-0.1 5,-0.2 0.690 91.3 72.7-114.5 -30.8 -15.8 23.2 -14.4 53 56 A V H X S+ 0 0 5 -4,-2.0 4,-2.1 1,-0.2 5,-0.2 0.912 98.7 49.7 -61.5 -43.9 -15.5 26.8 -15.5 54 57 A G H > S+ 0 0 20 -4,-0.5 4,-2.8 1,-0.2 5,-0.2 0.961 112.1 44.7 -60.8 -55.4 -19.3 27.4 -15.6 55 58 A P H > S+ 0 0 48 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.866 113.5 50.7 -60.2 -36.3 -20.1 26.0 -12.2 56 59 A F H <>S+ 0 0 0 -4,-2.1 5,-2.2 2,-0.2 4,-0.2 0.882 111.5 47.5 -68.2 -41.0 -17.2 27.9 -10.5 57 60 A V H ><5S+ 0 0 33 -4,-2.1 3,-1.7 -5,-0.2 -28,-0.2 0.916 109.9 53.6 -62.8 -42.6 -18.2 31.2 -12.1 58 61 A D H 3<5S+ 0 0 139 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.820 104.5 56.6 -59.3 -33.7 -21.8 30.5 -11.0 59 62 A A T 3<5S- 0 0 22 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.494 129.1 -96.9 -76.2 -8.5 -20.5 30.0 -7.5 60 63 A G T < 5S+ 0 0 41 -3,-1.7 -29,-0.6 1,-0.3 2,-0.3 0.544 79.7 127.8 106.9 9.1 -18.9 33.5 -7.6 61 64 A Y E < - c 0 31A 12 -5,-2.2 2,-0.7 -31,-0.2 -1,-0.3 -0.648 58.1-127.8 -95.1 154.9 -15.3 32.9 -8.6 62 65 A R E - c 0 32A 46 -31,-2.2 -29,-2.8 -34,-0.3 2,-0.5 -0.921 33.0-153.8 -94.4 117.9 -13.3 34.5 -11.3 63 66 A V E -Bc 27 33A 0 -36,-2.7 -36,-2.0 -2,-0.7 2,-0.5 -0.835 14.8-171.1-101.3 129.0 -11.9 31.5 -13.2 64 67 A I E -Bc 26 34A 0 -31,-2.6 -29,-2.8 -2,-0.5 2,-0.8 -0.978 6.7-162.7-118.5 112.9 -8.6 31.7 -15.2 65 68 A L E -Bc 25 35A 1 -40,-3.1 -40,-2.1 -2,-0.5 2,-0.4 -0.870 23.0-157.1 -95.9 102.4 -7.9 28.6 -17.3 66 69 A K E -Bc 24 36A 0 -31,-2.1 -29,-0.6 -2,-0.8 2,-0.6 -0.718 16.1-142.7 -93.9 133.3 -4.2 29.1 -18.0 67 70 A D - 0 0 0 -44,-2.6 -44,-0.2 -2,-0.4 3,-0.1 -0.817 27.1-135.9 -85.2 120.7 -2.2 27.6 -20.8 68 71 A S > - 0 0 0 -2,-0.6 3,-1.5 1,-0.2 6,-0.3 -0.419 37.5 -76.8 -71.8 157.4 1.3 26.7 -19.5 69 72 A P T 3 S+ 0 0 0 0, 0.0 7,-0.2 0, 0.0 -1,-0.2 -0.184 120.8 24.0 -53.2 139.1 4.4 27.6 -21.5 70 73 A G T 3 S+ 0 0 2 5,-2.8 2,-0.3 1,-0.2 6,-0.2 0.674 106.8 99.2 74.3 17.4 4.9 25.2 -24.4 71 74 A F S X S- 0 0 4 -3,-1.5 3,-2.1 4,-0.3 -1,-0.2 -0.991 86.0 -38.9-136.0 146.0 1.2 24.3 -24.5 72 75 A N T 3 S- 0 0 24 -29,-0.3 -28,-0.1 -2,-0.3 125,-0.1 -0.095 122.4 -9.3 46.8-123.3 -1.8 25.3 -26.7 73 76 A K T 3 S+ 0 0 56 -50,-0.0 -1,-0.3 -4,-0.0 2,-0.2 0.386 109.3 100.3 -93.8 4.8 -1.8 29.0 -27.4 74 77 A S S < S- 0 0 1 -3,-2.1 -52,-0.2 -6,-0.3 -6,-0.1 -0.503 88.4 -76.8 -78.3 162.9 1.0 30.1 -25.1 75 78 A D - 0 0 62 -54,-2.8 -5,-2.8 -2,-0.2 -4,-0.3 -0.155 48.7-106.1 -60.5 149.4 4.5 30.7 -26.5 76 79 A A + 0 0 30 -7,-0.2 2,-0.3 -6,-0.2 -1,-0.1 -0.423 46.4 171.7 -70.4 147.9 6.7 27.7 -27.5 77 80 A V - 0 0 31 -2,-0.1 2,-0.5 -8,-0.1 127,-0.2 -0.977 32.9-142.2-160.1 144.1 9.6 27.1 -25.1 78 81 A V - 0 0 57 -2,-0.3 2,-0.4 125,-0.1 123,-0.1 -0.981 28.7-152.5-106.4 126.5 12.4 24.5 -24.4 79 82 A M - 0 0 6 -2,-0.5 128,-0.3 121,-0.4 129,-0.2 -0.852 23.6-177.3-104.9 136.6 12.9 24.1 -20.7 80 83 A D S S+ 0 0 114 -2,-0.4 2,-0.3 127,-0.1 -1,-0.1 0.388 72.9 63.1-106.8 -2.7 16.1 23.1 -19.1 81 84 A E S S- 0 0 80 1,-0.1 127,-0.1 127,-0.1 126,-0.1 -0.814 107.1 -71.6-113.5 163.5 14.7 23.1 -15.6 82 85 A Q >> - 0 0 24 -2,-0.3 4,-1.6 130,-0.2 3,-0.6 -0.235 45.5-127.4 -51.6 136.2 11.9 21.0 -14.1 83 86 A R H 3> S+ 0 0 10 125,-0.3 4,-2.8 1,-0.2 5,-0.2 0.785 101.0 63.8 -65.6 -31.2 8.5 22.0 -15.6 84 87 A G H 3> S+ 0 0 0 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.912 107.5 41.4 -59.8 -42.4 6.7 22.5 -12.3 85 88 A L H <> S+ 0 0 19 -3,-0.6 4,-2.2 2,-0.2 -1,-0.2 0.925 115.8 48.5 -70.0 -46.0 9.0 25.4 -11.2 86 89 A V H X S+ 0 0 17 -4,-1.6 4,-2.1 1,-0.2 -2,-0.2 0.945 113.7 48.3 -61.2 -45.9 9.1 27.0 -14.7 87 90 A N H X S+ 0 0 0 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.875 108.4 54.3 -61.2 -38.8 5.3 26.8 -14.9 88 91 A A H X S+ 0 0 0 -4,-1.7 4,-2.2 -5,-0.2 -1,-0.2 0.893 105.5 52.7 -64.0 -39.7 5.0 28.3 -11.4 89 92 A R H X S+ 0 0 38 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.920 107.7 52.7 -60.3 -42.2 7.1 31.3 -12.4 90 93 A A H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.882 107.0 51.5 -62.3 -39.3 4.7 31.8 -15.4 91 94 A V H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 -1,-0.2 0.943 110.4 48.9 -60.6 -45.0 1.7 31.8 -13.0 92 95 A K H X S+ 0 0 37 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.939 110.2 51.8 -58.0 -46.1 3.4 34.4 -10.9 93 96 A G H X S+ 0 0 4 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.899 110.9 47.2 -57.5 -45.3 4.1 36.4 -14.0 94 97 A L H X S+ 0 0 0 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.921 111.6 50.5 -62.6 -43.6 0.5 36.3 -15.0 95 98 A M H X>S+ 0 0 0 -4,-2.6 5,-2.5 2,-0.2 4,-0.5 0.907 111.2 48.1 -63.9 -40.7 -0.7 37.2 -11.6 96 99 A D H ><5S+ 0 0 62 -4,-2.6 3,-1.1 1,-0.2 -1,-0.2 0.945 111.1 50.8 -64.0 -48.1 1.6 40.2 -11.4 97 100 A A H 3<5S+ 0 0 51 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.828 116.3 41.3 -57.1 -35.9 0.5 41.4 -14.9 98 101 A L H 3<5S- 0 0 39 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.386 110.5-116.5 -97.1 3.6 -3.2 41.2 -13.9 99 102 A D T <<5 + 0 0 153 -3,-1.1 2,-0.6 -4,-0.5 -3,-0.2 0.915 57.8 155.6 59.9 45.6 -2.9 42.6 -10.4 100 103 A I < - 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