==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 15-NOV-11 4A7Y . COMPND 2 MOLECULE: ALDOS-2-ULOSE DEHYDRATASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PHANEROCHAETE CHRYSOSPORIUM; . AUTHOR M.CLAESSON,Y.LINDQVIST,S.MADRID,T.SANDALOVA,R.FISKESUND,S.YU . 880 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37161.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 534 60.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 327 37.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 10 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 87 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 62 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 10 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 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 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 14 7 6 8 12 7 6 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 . 1 1 6 2 1 0 1 1 0 1 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 15 A Q 0 0 118 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 122.6 -25.7 -39.5 28.1 2 16 A P - 0 0 122 0, 0.0 2,-0.3 0, 0.0 359,-0.0 -0.118 360.0-111.8 -45.2 135.5 -24.9 -41.9 31.0 3 17 A A - 0 0 11 1,-0.0 2,-0.2 438,-0.0 437,-0.2 -0.592 27.7-139.0 -74.2 130.7 -23.0 -40.0 33.7 4 18 A A - 0 0 39 435,-2.8 437,-0.3 -2,-0.3 -1,-0.0 -0.590 26.0-101.7 -81.7 149.5 -19.3 -41.1 34.3 5 19 A L - 0 0 54 -2,-0.2 326,-0.1 435,-0.1 -1,-0.1 -0.469 41.4-126.6 -62.0 141.3 -17.8 -41.4 37.7 6 20 A P - 0 0 8 0, 0.0 414,-0.2 0, 0.0 2,-0.1 -0.282 28.2 -94.2 -78.1 178.9 -15.7 -38.4 38.4 7 21 A L E -A 419 0A 29 412,-2.4 412,-1.7 -2,-0.0 2,-0.4 -0.409 30.0-140.2 -88.4 169.6 -12.0 -38.7 39.5 8 22 A F E -A 418 0A 37 410,-0.2 410,-0.2 -2,-0.1 414,-0.0 -0.928 8.6-164.4-141.0 108.6 -10.7 -38.7 43.1 9 23 A Q E -A 417 0A 29 408,-2.2 408,-2.8 -2,-0.4 2,-0.2 -0.851 27.4-142.4 -87.9 115.8 -7.6 -36.9 44.4 10 24 A P E -A 416 0A 68 0, 0.0 2,-0.4 0, 0.0 406,-0.2 -0.524 19.8-174.7 -79.6 148.5 -7.0 -38.6 47.8 11 25 A Q E -A 415 0A 25 404,-2.5 404,-2.5 -2,-0.2 2,-0.7 -0.977 26.0-124.3-146.9 137.2 -5.7 -36.6 50.7 12 26 A L E +A 414 0A 94 -2,-0.4 57,-0.3 402,-0.2 402,-0.3 -0.684 25.3 177.9 -82.1 110.9 -4.6 -37.6 54.2 13 27 A V E S- 0 0 8 400,-1.7 56,-0.4 -2,-0.7 2,-0.3 0.866 72.6 -5.7 -82.7 -41.5 -6.7 -35.7 56.7 14 28 A Q E S-A 413 0A 28 399,-2.2 399,-3.1 54,-0.1 -1,-0.3 -0.915 72.8-165.9-157.8 132.5 -5.1 -37.3 59.8 15 29 A G + 0 0 37 -2,-0.3 397,-0.1 397,-0.2 395,-0.1 -0.609 58.0 24.6-118.8 173.4 -2.6 -40.2 60.2 16 30 A G S S+ 0 0 59 394,-0.3 396,-0.2 -2,-0.2 -1,-0.1 0.628 73.4 172.4 47.1 22.9 -1.1 -42.7 62.6 17 31 A R - 0 0 13 394,-1.5 -1,-0.2 393,-0.2 393,-0.1 -0.245 41.0-124.0 -54.3 145.1 -4.1 -42.4 64.9 18 32 A P S S- 0 0 78 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.868 83.5 -23.8 -56.3 -41.0 -4.2 -44.9 67.8 19 33 A D - 0 0 7 392,-0.1 2,-0.2 391,-0.1 383,-0.2 -0.780 62.8-146.7-155.5-172.5 -7.6 -46.2 66.7 20 34 A G B +D 401 0B 1 381,-2.3 381,-2.9 -2,-0.2 22,-0.3 -0.791 30.8 141.4-177.7 137.2 -10.7 -45.3 64.7 21 35 A Y + 0 0 9 20,-2.6 2,-0.4 1,-0.3 21,-0.2 0.520 63.9 46.2-135.7 -49.6 -14.5 -45.8 64.5 22 36 A W E +F 41 0C 3 19,-2.3 19,-1.9 375,-0.1 2,-0.3 -0.868 43.2 172.0-122.4 140.3 -16.4 -42.6 63.6 23 37 A V E +F 40 0C 1 -2,-0.4 2,-0.3 17,-0.2 17,-0.2 -0.993 10.5 172.2-143.7 143.7 -16.2 -39.9 61.0 24 38 A E E -F 39 0C 26 15,-2.3 15,-2.5 -2,-0.3 2,-0.6 -0.991 34.7-117.4-149.0 147.2 -18.8 -37.2 60.3 25 39 A A E -F 38 0C 12 -2,-0.3 13,-0.3 13,-0.2 358,-0.1 -0.803 32.8-164.7 -90.7 121.0 -19.0 -34.1 58.1 26 40 A F E -F 37 0C 0 11,-2.8 11,-2.9 -2,-0.6 2,-0.5 -0.858 10.9-157.8-116.9 100.0 -19.5 -31.1 60.5 27 41 A P - 0 0 11 0, 0.0 67,-0.3 0, 0.0 8,-0.1 -0.650 12.5-150.5 -65.8 116.8 -20.7 -27.7 59.0 28 42 A F S S+ 0 0 36 -2,-0.5 66,-3.2 65,-0.1 2,-0.2 0.985 84.3 43.6 -58.5 -61.5 -19.5 -25.2 61.6 29 43 A R B S-I 93 0D 129 64,-0.3 64,-0.3 1,-0.1 63,-0.1 -0.534 78.1-144.8 -78.2 149.4 -22.4 -22.8 60.8 30 44 A S S S+ 0 0 47 62,-2.6 63,-0.2 -2,-0.2 -1,-0.1 0.500 91.9 66.9 -93.0 -7.6 -25.8 -24.4 60.5 31 45 A D S S+ 0 0 106 61,-0.8 2,-0.2 1,-0.1 -1,-0.1 0.971 106.6 32.4 -72.0 -55.8 -27.0 -21.9 57.8 32 46 A S - 0 0 65 2,-0.1 -1,-0.1 1,-0.1 -3,-0.0 -0.667 57.3-168.1-103.9 154.2 -24.6 -23.1 55.0 33 47 A S + 0 0 80 -2,-0.2 2,-0.4 3,-0.1 352,-0.3 0.017 46.4 114.3-136.1 31.2 -23.1 -26.5 54.3 34 48 A K S S+ 0 0 74 1,-0.2 352,-0.1 350,-0.1 355,-0.1 -0.831 84.1 7.1 -97.0 146.4 -20.3 -26.1 51.8 35 49 A C S S+ 0 0 11 350,-1.7 -1,-0.2 353,-0.4 22,-0.2 0.860 87.3 180.0 51.8 48.3 -16.7 -26.9 52.8 36 50 A P - 0 0 5 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.053 25.9-108.3 -64.0 171.4 -17.7 -28.4 56.2 37 51 A N E -F 26 0C 11 -11,-2.9 -11,-2.8 19,-0.1 2,-0.4 -0.398 26.0-120.2 -86.8 178.6 -15.2 -29.7 58.7 38 52 A I E -FG 25 55C 0 17,-1.7 17,-2.8 -13,-0.3 2,-0.4 -0.972 18.9-164.1-115.6 134.1 -14.7 -33.3 59.6 39 53 A I E +FG 24 54C 0 -15,-2.5 -15,-2.3 -2,-0.4 2,-0.3 -0.975 22.6 160.6-112.2 137.6 -15.1 -34.7 63.1 40 54 A G E +FG 23 53C 0 13,-1.9 13,-1.4 -2,-0.4 2,-0.3 -0.991 6.3 144.8-153.2 158.6 -13.7 -38.1 63.9 41 55 A Y E -F 22 0C 0 -19,-1.9 -20,-2.6 -2,-0.3 -19,-2.3 -0.974 33.1-109.6-172.7 177.6 -12.5 -40.4 66.7 42 56 A G - 0 0 0 -22,-0.3 360,-0.1 -2,-0.3 8,-0.1 -0.724 38.2-100.1-117.8 175.5 -12.3 -43.9 68.0 43 57 A L - 0 0 27 358,-0.3 36,-0.2 -2,-0.2 7,-0.2 0.549 57.6-148.0 -71.9 -6.5 -14.0 -45.8 70.8 44 58 A G - 0 0 10 35,-0.2 2,-0.3 5,-0.1 5,-0.2 -0.084 9.9-109.4 64.3-171.9 -10.9 -45.3 73.1 45 59 A T - 0 0 33 3,-2.5 34,-0.3 1,-0.0 5,-0.1 -0.830 29.0 -91.2-142.8-179.3 -9.8 -47.8 75.8 46 60 A Y S S+ 0 0 135 -2,-0.3 3,-0.1 1,-0.2 -1,-0.0 0.808 124.7 46.6 -68.9 -26.8 -9.7 -48.2 79.5 47 61 A D S S+ 0 0 155 1,-0.2 2,-0.4 2,-0.0 -1,-0.2 0.874 118.7 32.0 -81.6 -38.6 -6.2 -46.6 79.5 48 62 A M S S- 0 0 86 0, 0.0 -3,-2.5 0, 0.0 -1,-0.2 -0.975 72.4-131.7-131.4 131.6 -6.8 -43.6 77.4 49 63 A K - 0 0 109 -2,-0.4 2,-0.5 -5,-0.2 29,-0.2 -0.422 35.6-109.4 -66.8 153.3 -9.8 -41.4 76.8 50 64 A S E - H 0 77C 6 27,-1.8 27,-2.1 -7,-0.2 2,-0.7 -0.790 20.8-137.1 -93.8 126.9 -10.8 -40.7 73.1 51 65 A D E - H 0 76C 57 -2,-0.5 2,-1.4 25,-0.2 25,-0.2 -0.737 8.1-147.0 -82.0 117.4 -10.2 -37.2 71.7 52 66 A I E - H 0 75C 1 23,-2.3 22,-2.3 -2,-0.7 23,-0.7 -0.744 29.2-164.9 -78.6 91.3 -13.2 -36.2 69.7 53 67 A Q E -GH 40 73C 32 -13,-1.4 -13,-1.9 -2,-1.4 2,-0.7 -0.758 15.5-154.5 -94.2 123.5 -11.0 -34.2 67.3 54 68 A M E -GH 39 72C 0 18,-3.2 18,-3.0 -2,-0.5 2,-0.5 -0.886 15.2-150.6 -92.8 115.6 -12.6 -31.7 64.9 55 69 A L E -GH 38 71C 1 -17,-2.8 -17,-1.7 -2,-0.7 2,-0.2 -0.772 13.2-126.5 -92.0 121.1 -10.4 -31.3 62.0 56 70 A V - 0 0 33 14,-3.3 14,-0.4 -2,-0.5 -19,-0.1 -0.491 16.8-126.6 -68.6 133.5 -10.5 -27.9 60.2 57 71 A N > - 0 0 2 -2,-0.2 3,-0.7 -22,-0.2 4,-0.3 -0.710 16.8-163.4 -78.8 115.7 -11.1 -27.8 56.5 58 72 A P G > S+ 0 0 10 0, 0.0 3,-1.0 0, 0.0 8,-0.2 0.848 90.4 55.6 -73.4 -30.3 -8.3 -25.8 55.0 59 73 A Y G 3 S+ 0 0 15 327,-0.3 5,-0.1 1,-0.2 -2,-0.1 0.511 82.1 93.2 -77.2 -3.5 -10.2 -25.4 51.7 60 74 A A G < S+ 0 0 42 -3,-0.7 2,-0.5 1,-0.1 -1,-0.2 0.854 85.7 51.5 -58.4 -35.1 -13.0 -23.9 53.8 61 75 A T S < S- 0 0 93 -3,-1.0 3,-0.3 -4,-0.3 -1,-0.1 -0.903 90.4-130.7-102.3 128.1 -11.5 -20.5 53.1 62 76 A T S S+ 0 0 125 -2,-0.5 3,-0.1 1,-0.2 -2,-0.0 -0.217 92.8 53.1 -65.3 170.6 -10.8 -19.6 49.5 63 77 A N S S+ 0 0 163 1,-0.2 -1,-0.2 -4,-0.0 2,-0.1 0.715 87.7 177.9 61.9 26.2 -7.2 -18.2 48.7 64 78 A N + 0 0 34 -3,-0.3 486,-0.5 1,-0.1 -1,-0.2 -0.289 30.8 169.5 -65.3 136.0 -6.1 -21.4 50.4 65 79 A Q + 0 0 165 -7,-0.1 2,-0.3 -3,-0.1 -1,-0.1 0.392 56.0 83.2-118.7 -7.1 -2.4 -22.3 50.7 66 80 A S + 0 0 52 -8,-0.2 484,-0.1 1,-0.1 485,-0.1 -0.770 38.7 176.6-107.9 149.5 -2.8 -25.3 53.1 67 81 A S + 0 0 28 -2,-0.3 2,-0.2 -9,-0.1 -1,-0.1 0.440 58.7 107.6-111.8 -14.3 -3.6 -28.9 52.7 68 82 A S - 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