==== 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 HYDROLASE 20-JUL-05 2ADE . COMPND 2 MOLECULE: FRUCTAN 1-EXOHYDROLASE IIA; . SOURCE 2 ORGANISM_SCIENTIFIC: CICHORIUM INTYBUS; . AUTHOR M.VERHAEST,K.LE ROY,C.J.DE RANTER,A.VAN LAERE,W.VAN DEN ENDE . 537 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20287.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 348 64.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 2.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 196 36.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 0.9 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 . 54 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 15 2.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 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 0 0 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 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 . 3 6 4 2 5 4 4 3 2 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 1 3 0 3 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 2 A Q 0 0 166 0, 0.0 2,-0.4 0, 0.0 501,-0.1 0.000 360.0 360.0 360.0 144.7 41.3 65.8 -13.1 2 3 A I - 0 0 92 499,-0.5 2,-0.6 498,-0.0 0, 0.0 -0.961 360.0-125.6-120.3 137.6 37.9 64.2 -13.3 3 4 A E S S- 0 0 158 -2,-0.4 498,-0.0 1,-0.3 0, 0.0 -0.726 88.1 -10.9 -86.4 120.5 34.8 65.8 -14.9 4 5 A Q S > S- 0 0 91 -2,-0.6 3,-1.5 1,-0.1 -1,-0.3 0.972 71.2-176.2 57.3 60.7 31.8 66.0 -12.6 5 6 A P T 3 S+ 0 0 15 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.522 76.4 61.6 -64.7 -7.3 33.2 63.7 -9.8 6 7 A Y T 3 S+ 0 0 19 471,-0.1 472,-0.7 472,-0.1 2,-0.1 0.612 76.0 104.2 -97.4 -14.0 29.9 64.0 -7.9 7 8 A R S < S- 0 0 51 -3,-1.5 472,-0.1 470,-0.1 2,-0.1 -0.446 74.2-117.8 -68.6 140.6 27.7 62.4 -10.5 8 9 A T - 0 0 17 -2,-0.1 469,-0.1 469,-0.1 -1,-0.1 -0.313 8.8-146.2 -77.0 161.9 26.6 58.8 -9.7 9 10 A G S S+ 0 0 9 520,-0.1 521,-2.7 -2,-0.1 -1,-0.1 0.672 93.6 12.7-101.2 -22.6 27.5 55.8 -11.7 10 11 A Y S S+ 0 0 3 519,-0.2 2,-0.3 466,-0.1 521,-0.1 0.152 100.2 98.9-143.2 23.3 24.3 53.7 -11.1 11 12 A H S S- 0 0 0 519,-0.1 2,-0.3 301,-0.1 300,-0.1 -0.853 78.2-103.2-108.6 148.7 21.7 55.9 -9.5 12 13 A F + 0 0 6 -2,-0.3 298,-1.4 298,-0.2 -2,-0.1 -0.538 57.3 137.8 -76.0 135.6 19.0 57.5 -11.6 13 14 A Q - 0 0 8 -2,-0.3 296,-0.1 296,-0.2 295,-0.1 -0.929 51.5 -99.0-167.1 149.6 19.4 61.2 -12.4 14 15 A P - 0 0 3 0, 0.0 3,-0.1 0, 0.0 5,-0.1 -0.243 44.0 -96.7 -72.3 165.7 18.8 63.2 -15.6 15 16 A P S S- 0 0 58 0, 0.0 2,-0.3 0, 0.0 519,-0.0 0.849 97.8 -34.4 -49.7 -34.3 21.6 64.2 -18.0 16 17 A S S S+ 0 0 46 2,-0.1 290,-0.2 291,-0.1 289,-0.1 -0.972 96.3 53.3-171.0-178.7 21.6 67.5 -16.1 17 18 A N E S-a 306 0A 34 288,-2.3 290,-2.3 -2,-0.3 2,-0.3 -0.172 86.0 -25.2 74.6-166.5 19.7 70.3 -14.2 18 19 A W E +aB 307 39A 43 24,-2.3 21,-2.1 21,-0.7 2,-0.4 -0.647 53.2 171.4 -89.0 135.4 17.3 70.0 -11.3 19 20 A M E + B 0 38A 0 288,-2.3 19,-0.2 -2,-0.3 290,-0.1 -0.999 7.1 152.7-139.7 132.9 15.2 67.0 -10.3 20 21 A N E + 0 0 11 17,-2.2 272,-0.1 -2,-0.4 253,-0.0 -0.007 48.4 35.6-125.5-121.8 13.1 66.4 -7.2 21 22 A D E S- 0 0 14 15,-0.1 16,-2.6 1,-0.1 -1,-0.3 0.072 71.5-123.1 -39.4 130.8 10.0 64.2 -6.5 22 23 A P E - B 0 36A 2 0, 0.0 2,-0.3 0, 0.0 14,-0.3 -0.568 36.0-152.6 -75.6 141.1 9.7 60.8 -8.2 23 24 A N E - B 0 35A 0 12,-3.5 12,-1.5 -2,-0.2 61,-0.2 -0.912 48.0 -17.9-125.7 150.4 6.5 60.7 -10.2 24 25 A G E - 0 0 0 59,-2.0 60,-0.2 -2,-0.3 -1,-0.1 0.692 69.2-171.8 33.6 43.5 4.0 58.1 -11.5 25 26 A P E + 0 0 3 0, 0.0 60,-0.4 0, 0.0 2,-0.3 -0.290 21.2 139.5 -60.0 145.4 6.3 55.0 -11.1 26 27 A M E - B 0 33A 7 7,-1.6 7,-2.8 252,-0.1 2,-0.5 -0.982 51.6-117.3-175.0 169.1 4.8 51.9 -12.6 27 28 A L E + B 0 32A 14 252,-0.4 2,-0.4 -2,-0.3 5,-0.2 -0.993 36.3 173.3-122.0 118.7 5.3 48.8 -14.7 28 29 A Y E > - B 0 31A 9 3,-2.9 3,-2.1 -2,-0.5 -2,-0.1 -0.989 64.1 -18.5-133.8 127.3 3.3 48.7 -17.9 29 30 A Q T 3 S- 0 0 125 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.897 127.9 -49.8 47.2 48.6 3.5 46.1 -20.7 30 31 A G T 3 S+ 0 0 54 1,-0.2 2,-0.4 -3,-0.0 -1,-0.3 0.568 117.4 111.1 71.3 8.9 6.9 44.9 -19.4 31 32 A V E < -B 28 0A 4 -3,-2.1 -3,-2.9 88,-0.1 2,-0.6 -0.956 62.5-138.1-120.1 133.9 8.4 48.3 -19.3 32 33 A Y E -BC 27 56A 12 24,-3.6 24,-2.1 -2,-0.4 2,-0.4 -0.788 22.2-158.7 -89.4 123.2 9.3 50.2 -16.1 33 34 A H E -BC 26 55A 2 -7,-2.8 -7,-1.6 -2,-0.6 2,-0.4 -0.870 10.2-175.8-105.5 135.3 8.2 53.8 -16.3 34 35 A F E + C 0 54A 0 20,-2.7 20,-2.4 -2,-0.4 2,-0.3 -0.997 3.2 177.4-131.3 135.0 9.8 56.5 -14.2 35 36 A F E -BC 23 53A 0 -12,-1.5 -12,-3.5 -2,-0.4 2,-0.3 -0.857 5.9-178.4-128.6 164.5 8.8 60.2 -14.1 36 37 A Y E -BC 22 52A 5 16,-1.1 16,-3.4 -14,-0.3 2,-0.3 -0.971 38.3 -90.3-166.7 149.3 10.1 63.0 -11.9 37 38 A Q E - C 0 51A 3 -16,-2.6 -17,-2.2 -2,-0.3 2,-0.4 -0.453 56.5-179.3 -61.2 122.6 9.7 66.7 -11.1 38 39 A Y E -BC 19 50A 38 12,-2.9 12,-3.0 -2,-0.3 -19,-0.2 -0.978 31.7-152.7-135.8 142.9 12.1 68.4 -13.4 39 40 A N E > -B 18 0A 5 -21,-2.1 -21,-0.7 -2,-0.4 3,-0.6 -0.943 8.0-169.5-111.4 110.2 13.3 72.0 -14.2 40 41 A P T 3 S+ 0 0 38 0, 0.0 -1,-0.1 0, 0.0 9,-0.1 0.633 83.7 51.1 -73.7 -10.5 14.4 72.2 -17.8 41 42 A Y T 3 S+ 0 0 175 7,-0.3 2,-0.3 1,-0.1 -24,-0.1 0.533 112.4 8.5-107.7 -6.7 15.9 75.6 -17.2 42 43 A A < - 0 0 31 -3,-0.6 -24,-2.3 2,-0.2 -3,-0.2 -0.991 61.8-111.1-164.6 170.6 18.2 75.4 -14.1 43 44 A A S S+ 0 0 6 -26,-0.3 2,-0.3 -2,-0.3 263,-0.1 -0.094 101.4 62.2 -96.8 30.1 19.9 73.3 -11.5 44 45 A T S S- 0 0 26 -26,-0.1 -26,-0.3 257,-0.1 -2,-0.2 -0.917 101.8 -78.9-144.8 167.3 17.6 74.8 -8.9 45 46 A F - 0 0 98 -2,-0.3 2,-0.3 -26,-0.1 -2,-0.1 -0.294 57.8-178.3 -65.7 159.7 13.8 74.7 -8.4 46 47 A G - 0 0 19 -4,-0.1 3,-0.1 -28,-0.0 -1,-0.0 -0.917 44.2 -94.2-152.2 178.2 11.9 77.1 -10.7 47 48 A D S S+ 0 0 153 -2,-0.3 2,-0.6 1,-0.2 -2,-0.0 0.685 112.6 57.2 -71.3 -19.6 8.6 78.6 -11.7 48 49 A V + 0 0 54 31,-0.1 2,-0.4 2,-0.0 -7,-0.3 -0.912 66.4 167.9-119.7 105.5 8.3 76.0 -14.4 49 50 A I + 0 0 0 -2,-0.6 31,-2.7 29,-0.3 2,-0.3 -0.951 7.7 176.6-116.7 134.4 8.4 72.3 -13.3 50 51 A I E -C 38 0A 13 -12,-3.0 -12,-2.9 -2,-0.4 2,-0.7 -0.856 36.6 -91.1-133.3 168.4 7.6 69.4 -15.5 51 52 A W E -CD 37 69A 0 18,-2.8 17,-1.5 -2,-0.3 18,-0.6 -0.712 35.5-153.5 -84.1 109.4 7.5 65.6 -15.5 52 53 A G E -C 36 0A 2 -16,-3.4 -16,-1.1 -2,-0.7 2,-0.4 -0.375 14.8-150.6 -72.5 163.2 10.7 64.1 -16.8 53 54 A H E +C 35 0A 0 12,-0.4 12,-2.9 -18,-0.2 2,-0.3 -0.990 23.9 159.6-146.5 132.3 10.3 60.6 -18.3 54 55 A A E -CE 34 64A 0 -20,-2.4 -20,-2.7 -2,-0.4 2,-0.3 -0.979 19.1-150.5-146.0 152.1 12.6 57.6 -18.6 55 56 A V E +CE 33 63A 2 8,-2.0 8,-2.0 -2,-0.3 2,-0.3 -0.887 12.7 178.0-127.6 159.0 12.0 53.9 -19.1 56 57 A S E -CE 32 62A 3 -24,-2.1 -24,-3.6 -2,-0.3 6,-0.1 -0.997 31.2-152.0-156.5 155.6 13.7 50.7 -18.2 57 58 A Y S S+ 0 0 142 4,-0.5 5,-0.1 -2,-0.3 -1,-0.1 0.545 105.2 23.2-102.7 -11.5 13.4 46.9 -18.5 58 59 A D S S- 0 0 48 3,-0.5 274,-0.1 -26,-0.1 4,-0.1 0.349 98.6-115.6-136.1 4.3 15.3 46.3 -15.2 59 60 A L S S+ 0 0 1 2,-0.3 3,-0.1 1,-0.1 271,-0.1 0.561 106.4 71.2 68.1 7.3 15.1 49.4 -13.1 60 61 A V S S+ 0 0 5 1,-0.3 2,-0.5 252,-0.1 -1,-0.1 0.736 89.3 48.2-115.6 -54.6 18.8 49.7 -13.5 61 62 A N S S- 0 0 45 469,-0.1 -4,-0.5 471,-0.0 -3,-0.5 -0.815 76.2-165.3 -96.0 127.1 19.6 50.8 -17.1 62 63 A W E -Ef 56 532A 6 469,-2.1 471,-2.4 -2,-0.5 2,-0.5 -0.781 23.5-149.1-119.1 158.8 17.5 53.7 -18.3 63 64 A I E -Ef 55 533A 39 -8,-2.0 -8,-2.0 -2,-0.3 2,-0.4 -0.987 24.3-138.6-121.7 117.6 16.5 55.4 -21.5 64 65 A H E -Ef 54 534A 4 469,-3.2 471,-2.8 -2,-0.5 -10,-0.2 -0.643 26.9-179.0 -79.2 128.6 15.8 59.2 -21.2 65 66 A L - 0 0 2 -12,-2.9 -12,-0.4 -2,-0.4 471,-0.2 -0.465 36.3 -75.8-113.9-173.2 12.8 60.4 -23.1 66 67 A D - 0 0 62 469,-0.3 -1,-0.1 -2,-0.2 470,-0.0 -0.536 67.6 -77.4 -82.8 154.9 11.2 63.7 -23.6 67 68 A P - 0 0 43 0, 0.0 -15,-0.2 0, 0.0 -1,-0.1 -0.233 40.6-157.4 -53.5 139.8 9.1 65.1 -20.7 68 69 A A S S+ 0 0 6 -17,-1.5 2,-0.5 1,-0.2 56,-0.4 0.877 74.0 35.6 -87.6 -45.4 5.7 63.4 -20.6 69 70 A I B +D 51 0A 1 -18,-0.6 -18,-2.8 11,-0.1 -1,-0.2 -0.962 68.4 148.1-120.2 121.2 3.6 65.9 -18.7 70 71 A Y - 0 0 98 -2,-0.5 -20,-0.1 -20,-0.2 7,-0.1 -0.986 57.9 -68.3-147.2 149.6 4.1 69.7 -19.1 71 72 A P + 0 0 41 0, 0.0 6,-0.2 0, 0.0 3,-0.1 -0.117 64.6 139.5 -44.1 121.8 1.7 72.7 -18.9 72 73 A T + 0 0 89 1,-0.2 2,-0.3 0, 0.0 5,-0.1 0.380 61.4 42.7-140.0 -15.3 -0.7 72.6 -21.9 73 74 A Q S > S- 0 0 45 1,-0.1 3,-2.1 0, 0.0 4,-0.3 -0.888 87.3-102.7-134.5 166.3 -4.0 73.7 -20.3 74 75 A E G > S+ 0 0 92 -2,-0.3 3,-1.0 1,-0.3 28,-1.0 0.861 115.4 67.0 -54.2 -37.2 -5.3 76.3 -17.9 75 76 A A G 3 S+ 0 0 1 1,-0.3 -1,-0.3 55,-0.2 32,-0.3 0.550 123.0 13.5 -63.8 -7.8 -5.6 73.6 -15.2 76 77 A D G X S+ 0 0 0 -3,-2.1 3,-0.5 23,-0.2 -1,-0.3 0.089 83.9 129.5-156.4 29.7 -1.8 73.3 -15.2 77 78 A S T < S+ 0 0 52 -3,-1.0 24,-0.2 -4,-0.3 -3,-0.1 0.746 78.0 44.9 -61.6 -28.5 -0.5 76.3 -17.0 78 79 A K T 3 S- 0 0 94 22,-3.0 -29,-0.3 1,-0.3 2,-0.2 0.669 127.7 -33.2 -93.1 -17.0 2.0 77.4 -14.3 79 80 A S E < -G 100 0B 0 21,-0.7 21,-2.2 -3,-0.5 2,-0.6 -0.862 44.3-121.6 169.1 157.8 3.5 74.0 -13.6 80 81 A C E -G 99 0B 0 -31,-2.7 19,-0.2 -2,-0.2 3,-0.1 -0.892 40.2-176.1-119.0 97.0 2.9 70.2 -13.4 81 82 A W E - 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