==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-OCT-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 08-MAY-12 3VSR . COMPND 2 MOLECULE: BETA-FRUCTOFURANOSIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ARTHROBACTER; . AUTHOR T.TONOZUKA,A.TAMAKI,G.YOKOI,T.MIYAZAKI,M.ICHIKAWA,A.NISHIKAW . 493 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18913.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 295 59.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 2.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 148 30.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 1.4 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 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 57 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 17 3.4 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 3 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 RESIDUES PER ALPHA HELIX . 1 2 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 0 PARALLEL BRIDGES PER LADDER . 6 5 3 2 0 3 2 2 1 2 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 0 1 4 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 40 A L 0 0 146 0, 0.0 35,-0.2 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 123.6 28.8 -10.9 -5.0 2 41 A Q - 0 0 91 33,-2.2 33,-0.1 35,-0.2 2,-0.0 -0.454 360.0 -84.2 -72.4 158.3 27.1 -9.8 -8.2 3 42 A D S S+ 0 0 128 -2,-0.1 -1,-0.1 0, 0.0 0, 0.0 -0.389 76.4 121.7 -67.2 146.5 28.9 -7.0 -10.0 4 43 A G - 0 0 12 -3,-0.1 282,-0.1 -2,-0.0 28,-0.1 -0.947 62.4 -42.4 178.7-175.6 28.0 -3.6 -8.7 5 44 A P - 0 0 2 0, 0.0 30,-0.1 0, 0.0 275,-0.0 -0.296 59.5-108.8 -67.1 156.3 29.5 -0.5 -7.1 6 45 A E - 0 0 83 1,-0.1 275,-0.2 275,-0.1 25,-0.1 -0.505 41.5 -98.1 -76.4 153.0 32.2 -0.8 -4.4 7 46 A P - 0 0 24 0, 0.0 22,-0.1 0, 0.0 -1,-0.1 -0.423 43.9 -95.1 -71.6 153.0 31.2 0.1 -0.8 8 47 A T - 0 0 25 377,-0.2 2,-0.7 1,-0.1 272,-0.1 -0.335 42.9-110.4 -57.4 143.4 32.0 3.6 0.5 9 48 A I - 0 0 121 270,-0.2 2,-0.4 -3,-0.1 -1,-0.1 -0.766 38.2-170.9 -83.7 118.9 35.3 3.7 2.4 10 49 A H - 0 0 16 -2,-0.7 370,-0.1 1,-0.1 369,-0.1 -0.944 15.4-161.3-111.4 133.2 34.5 4.2 6.1 11 50 A T - 0 0 81 -2,-0.4 3,-0.1 2,-0.1 368,-0.1 0.714 22.0-140.3 -86.7 -23.5 37.4 4.9 8.6 12 51 A Q + 0 0 27 366,-1.8 361,-2.1 1,-0.2 362,-0.1 0.480 44.1 162.5 71.8 5.9 35.6 4.1 11.9 13 52 A Q - 0 0 107 365,-0.2 365,-1.3 359,-0.2 -1,-0.2 -0.309 35.4-123.8 -61.8 129.7 37.4 7.1 13.4 14 53 A A E -A 377 0A 46 363,-0.2 2,-0.3 359,-0.1 363,-0.3 -0.348 27.3-174.0 -71.6 152.1 35.9 8.4 16.6 15 54 A Y E -A 376 0A 70 361,-2.7 361,-0.5 6,-0.1 360,-0.1 -0.888 35.1 -84.0-132.8 170.3 34.7 12.0 17.2 16 55 A A > - 0 0 35 -2,-0.3 3,-1.1 1,-0.1 5,-0.3 -0.500 37.3-119.7 -71.7 144.8 33.5 14.0 20.2 17 56 A P T 3 S+ 0 0 0 0, 0.0 -1,-0.1 0, 0.0 290,-0.0 0.792 114.5 50.9 -53.0 -30.6 29.8 13.7 21.0 18 57 A E T 3 S+ 0 0 87 303,-0.1 -2,-0.0 358,-0.1 0, 0.0 0.661 87.7 102.1 -87.7 -19.5 29.4 17.4 20.5 19 58 A D S < S- 0 0 70 -3,-1.1 -4,-0.1 1,-0.1 0, 0.0 -0.135 74.9-129.6 -55.0 155.3 31.1 17.5 17.1 20 59 A D + 0 0 127 301,-0.1 2,-0.5 2,-0.1 -1,-0.1 -0.078 60.3 132.8-107.4 38.0 28.9 17.7 14.1 21 60 A F - 0 0 56 -5,-0.3 2,-0.5 301,-0.1 -6,-0.1 -0.748 36.4-169.2 -74.0 130.2 30.4 14.9 12.2 22 61 A T - 0 0 22 -2,-0.5 303,-0.2 354,-0.1 302,-0.2 -0.968 16.5-133.9-126.1 113.3 27.5 12.7 10.9 23 62 A A E -b 325 0B 1 301,-1.1 303,-1.9 -2,-0.5 2,-0.5 -0.265 20.5-138.4 -59.1 148.5 28.3 9.3 9.5 24 63 A K E -b 326 0B 67 301,-0.2 2,-0.7 355,-0.2 303,-0.2 -0.955 10.4-152.5-114.8 129.4 26.6 8.5 6.2 25 64 A W - 0 0 2 301,-2.6 2,-0.1 -2,-0.5 355,-0.0 -0.930 41.5-149.8 -90.4 113.3 25.0 5.2 5.2 26 65 A T > - 0 0 2 -2,-0.7 4,-3.0 1,-0.1 252,-0.2 -0.398 28.8-119.1 -97.5 164.1 25.5 5.7 1.5 27 66 A R H > S+ 0 0 2 250,-1.7 4,-2.5 2,-0.2 5,-0.2 0.930 120.4 56.0 -60.6 -41.4 23.7 4.6 -1.7 28 67 A A H 4 S+ 0 0 0 250,-2.4 4,-0.5 2,-0.2 -1,-0.2 0.923 110.8 43.4 -48.8 -51.6 27.1 2.9 -2.5 29 68 A D H >4 S+ 0 0 0 1,-0.2 3,-1.6 2,-0.2 4,-0.4 0.947 113.5 50.0 -60.9 -51.9 26.9 1.0 0.8 30 69 A A H >< S+ 0 0 0 -4,-3.0 3,-1.6 1,-0.3 4,-0.4 0.823 100.7 64.4 -62.5 -30.8 23.1 0.1 0.5 31 70 A R T >X S+ 0 0 47 -4,-2.5 4,-1.4 1,-0.3 3,-0.6 0.694 85.0 74.1 -68.4 -16.1 23.7 -1.2 -3.0 32 71 A Q H <> S+ 0 0 5 -3,-1.6 4,-1.6 -4,-0.5 -1,-0.3 0.790 85.4 66.8 -60.6 -29.4 25.9 -4.0 -1.6 33 72 A L H <4 S+ 0 0 0 -3,-1.6 4,-0.5 -4,-0.4 -1,-0.2 0.869 101.9 45.5 -58.9 -38.8 22.6 -5.5 -0.4 34 73 A Q H X4 S+ 0 0 66 -3,-0.6 3,-0.6 -4,-0.4 -1,-0.2 0.868 109.4 56.0 -72.8 -37.6 21.6 -6.2 -4.0 35 74 A R H 3< S+ 0 0 28 -4,-1.4 -33,-2.2 1,-0.2 -2,-0.2 0.780 106.1 50.7 -62.2 -32.0 25.1 -7.5 -4.7 36 75 A M T 3< S+ 0 0 36 -4,-1.6 -1,-0.2 -35,-0.2 2,-0.2 0.589 92.2 97.1 -83.0 -15.5 24.8 -10.1 -1.9 37 76 A S S < S- 0 0 6 -3,-0.6 11,-0.2 -4,-0.5 -35,-0.2 -0.558 78.9-123.9 -77.0 142.8 21.4 -11.3 -3.3 38 77 A D > - 0 0 71 9,-2.2 3,-1.9 -2,-0.2 359,-0.2 -0.777 15.0-156.3 -91.3 110.7 21.3 -14.4 -5.5 39 78 A P T 3 S+ 0 0 59 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.729 89.4 55.5 -60.2 -25.3 19.7 -13.5 -8.8 40 79 A T T 3 S+ 0 0 118 7,-0.1 -2,-0.0 2,-0.0 7,-0.0 0.460 72.6 133.4 -88.3 -3.4 18.6 -17.1 -9.6 41 80 A A < - 0 0 5 -3,-1.9 3,-0.1 6,-0.1 356,-0.1 -0.283 54.0-130.3 -55.7 121.6 16.7 -17.6 -6.4 42 81 A P > - 0 0 63 0, 0.0 3,-2.0 0, 0.0 -1,-0.1 -0.194 40.0 -60.1 -72.0 165.4 13.3 -19.2 -7.3 43 82 A S T 3 S+ 0 0 55 1,-0.3 367,-0.2 354,-0.1 3,-0.1 -0.098 121.0 7.6 -46.6 134.3 9.9 -18.0 -6.1 44 83 A R T 3 S+ 0 0 91 365,-2.7 2,-0.4 1,-0.2 -1,-0.3 0.414 102.2 116.9 72.0 3.6 9.3 -18.0 -2.3 45 84 A E S < S- 0 0 111 -3,-2.0 -1,-0.2 364,-0.2 366,-0.2 -0.812 73.2-105.8-101.9 142.3 13.0 -18.8 -1.6 46 85 A N - 0 0 43 -2,-0.4 349,-0.3 1,-0.1 4,-0.1 -0.374 27.6-172.4 -61.9 136.2 15.3 -16.6 0.4 47 86 A S + 0 0 5 347,-3.5 -9,-2.2 -6,-0.1 348,-0.2 0.500 57.8 91.4-107.7 -7.7 17.9 -14.8 -1.9 48 87 A M S S- 0 0 7 346,-0.7 -11,-0.1 -11,-0.2 5,-0.1 -0.507 93.6 -84.5 -90.0 153.5 19.9 -13.3 0.9 49 88 A P > - 0 0 43 0, 0.0 3,-2.2 0, 0.0 -1,-0.1 -0.381 33.3-130.7 -62.8 132.7 22.9 -15.0 2.5 50 89 A A G > S+ 0 0 58 1,-0.3 3,-1.8 2,-0.2 416,-0.1 0.831 104.3 66.1 -47.4 -38.8 21.9 -17.4 5.2 51 90 A S G 3 S+ 0 0 54 1,-0.3 415,-1.5 414,-0.1 -1,-0.3 0.648 110.0 36.3 -62.9 -16.3 24.5 -15.9 7.6 52 91 A V G < S+ 0 0 2 -3,-2.2 339,-3.4 413,-0.2 2,-0.5 0.101 101.0 94.4-120.7 20.5 22.5 -12.5 7.6 53 92 A T B < S-f 391 0C 3 -3,-1.8 339,-0.2 337,-0.2 3,-0.1 -0.959 76.4-121.5-121.3 120.6 19.0 -14.0 7.5 54 93 A M - 0 0 0 337,-2.6 3,-0.1 -2,-0.5 -2,-0.1 -0.343 42.3 -98.9 -54.9 131.8 16.9 -14.7 10.5 55 94 A P - 0 0 2 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.180 51.8 -87.9 -48.5 150.2 15.9 -18.4 10.8 56 95 A T - 0 0 65 -3,-0.1 419,-0.1 336,-0.1 336,-0.0 -0.499 38.8-137.4 -75.3 126.0 12.4 -19.1 9.5 57 96 A V - 0 0 3 -2,-0.3 4,-0.1 -3,-0.1 -1,-0.1 -0.666 24.4-110.9 -82.9 131.3 9.6 -18.7 12.0 58 97 A P - 0 0 55 0, 0.0 -1,-0.1 0, 0.0 377,-0.0 -0.354 13.1-137.9 -61.8 135.1 6.8 -21.4 12.0 59 98 A Q S S+ 0 0 67 1,-0.2 2,-1.4 -2,-0.1 376,-0.1 0.767 98.7 72.0 -62.5 -25.8 3.4 -20.2 10.8 60 99 A D S S+ 0 0 151 0, 0.0 -1,-0.2 0, 0.0 0, 0.0 -0.646 76.6 163.0 -90.7 75.5 1.9 -22.2 13.7 61 100 A F - 0 0 38 -2,-1.4 2,-0.1 -4,-0.1 69,-0.1 -0.674 37.0-122.0 -99.0 149.3 3.1 -19.9 16.4 62 101 A P - 0 0 21 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 -0.455 26.1-119.9 -78.5 164.7 1.9 -19.7 20.0 63 102 A D > - 0 0 17 -2,-0.1 3,-1.2 1,-0.1 67,-0.1 -0.938 11.1-150.1-109.7 128.7 0.6 -16.4 21.4 64 103 A M T 3 S+ 0 0 2 -2,-0.5 69,-0.3 1,-0.3 -1,-0.1 0.693 97.2 36.2 -71.7 -25.8 2.4 -14.9 24.4 65 104 A S T > S- 0 0 3 4,-0.2 3,-1.5 69,-0.1 -1,-0.3 0.146 110.8-112.9-107.6 13.2 -0.6 -13.1 26.0 66 105 A N T < S- 0 0 122 -3,-1.2 -2,-0.1 1,-0.3 64,-0.0 0.818 74.4 -61.5 49.0 32.4 -3.1 -15.9 25.1 67 106 A E T 3 S+ 0 0 125 2,-0.2 -1,-0.3 378,-0.1 3,-0.1 0.689 103.9 129.3 73.5 22.9 -4.7 -13.3 22.9 68 107 A Q S < S- 0 0 117 -3,-1.5 32,-0.7 1,-0.2 2,-0.3 0.888 81.4 -2.4 -66.5 -39.6 -5.6 -10.9 25.6 69 108 A V E S-K 99 0D 13 30,-0.2 2,-0.4 376,-0.1 -2,-0.2 -0.946 76.8 -99.5-144.0 159.5 -3.9 -8.1 23.6 70 109 A W E -K 98 0D 30 28,-2.7 28,-1.4 -2,-0.3 2,-0.4 -0.734 45.4-163.2 -73.7 134.2 -1.9 -7.4 20.5 71 110 A V E +K 97 0D 0 374,-2.4 26,-0.2 -2,-0.4 3,-0.1 -0.979 23.4 139.8-121.2 137.6 1.8 -7.2 21.5 72 111 A W E + 0 0 8 24,-2.6 360,-0.1 -2,-0.4 25,-0.0 -0.202 48.3 41.2-137.1-121.9 4.7 -5.7 19.5 73 112 A D E - 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