==== 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 2ADD . 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) . 20499.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 346 64.4 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 . 194 36.1 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 . 4 0.7 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 . 55 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 16 3.0 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 . 2 6 3 2 4 4 4 3 3 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 3 1 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 0 180 0, 0.0 2,-0.5 0, 0.0 501,-0.2 0.000 360.0 360.0 360.0 127.6 41.4 66.5 -12.6 2 3 A I - 0 0 78 499,-2.1 2,-0.3 501,-0.0 501,-0.1 -0.940 360.0-122.2-114.9 128.9 38.3 64.3 -12.7 3 4 A E S S- 0 0 157 -2,-0.5 0, 0.0 1,-0.2 0, 0.0 -0.490 83.7 -14.9 -72.3 130.0 35.2 65.4 -14.6 4 5 A Q S > S+ 0 0 58 -2,-0.3 3,-1.4 1,-0.1 -1,-0.2 0.897 70.8 179.6 43.5 59.3 31.9 65.5 -12.6 5 6 A P T 3 S+ 0 0 15 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.648 74.5 56.7 -62.5 -16.0 33.2 63.5 -9.6 6 7 A Y T 3 S+ 0 0 18 471,-0.1 472,-0.7 472,-0.1 2,-0.1 0.557 79.1 102.8 -95.4 -9.5 29.9 63.8 -7.8 7 8 A R S < S- 0 0 61 -3,-1.4 2,-0.1 470,-0.1 6,-0.0 -0.491 74.2-120.4 -71.6 145.3 27.6 62.3 -10.5 8 9 A T - 0 0 16 -2,-0.1 469,-0.1 469,-0.1 -1,-0.1 -0.454 8.1-146.9 -85.9 161.1 26.6 58.7 -9.7 9 10 A G S S+ 0 0 10 -2,-0.1 521,-3.0 520,-0.1 -1,-0.1 0.676 93.9 15.4 -99.2 -22.0 27.3 55.7 -11.8 10 11 A Y S S+ 0 0 3 519,-0.2 2,-0.3 2,-0.1 521,-0.1 0.204 99.8 96.9-140.1 20.1 24.2 53.6 -11.1 11 12 A H S S- 0 0 0 519,-0.1 2,-0.3 301,-0.1 -3,-0.1 -0.840 79.1-102.3-107.6 148.7 21.6 55.9 -9.5 12 13 A F + 0 0 6 -2,-0.3 298,-1.5 298,-0.3 -2,-0.1 -0.521 57.4 139.2 -74.6 135.1 18.9 57.5 -11.5 13 14 A Q - 0 0 7 -2,-0.3 296,-0.1 296,-0.2 295,-0.1 -0.934 50.9-100.0-166.7 148.7 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 -0.244 43.0 -99.1 -71.0 165.2 18.7 63.3 -15.5 15 16 A P S S- 0 0 60 0, 0.0 2,-0.3 0, 0.0 519,-0.0 0.875 97.6 -31.3 -51.5 -36.5 21.5 64.2 -17.9 16 17 A S S S+ 0 0 48 2,-0.1 290,-0.2 291,-0.0 289,-0.1 -0.959 97.5 52.0-166.8-179.3 21.5 67.5 -16.1 17 18 A N E S-a 306 0A 33 288,-2.7 290,-2.1 -2,-0.3 26,-0.3 -0.107 85.4 -27.5 74.4-171.0 19.6 70.2 -14.2 18 19 A W E +aB 307 39A 42 24,-2.3 21,-2.1 21,-0.7 2,-0.3 -0.601 52.5 170.9 -86.9 138.2 17.2 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 -0.995 7.0 152.7-142.8 132.6 15.1 67.0 -10.3 20 21 A N E + 0 0 14 17,-1.9 272,-0.1 -2,-0.3 253,-0.0 0.072 48.4 37.6-125.0-115.7 13.1 66.4 -7.1 21 22 A D E - 0 0 16 15,-0.1 16,-2.5 1,-0.1 -1,-0.3 -0.006 69.8-123.8 -48.6 130.5 10.0 64.2 -6.5 22 23 A P E - B 0 36A 1 0, 0.0 2,-0.3 0, 0.0 14,-0.3 -0.535 35.7-159.5 -72.2 138.9 9.6 60.8 -8.2 23 24 A N E - B 0 35A 0 12,-3.1 12,-1.6 -2,-0.2 61,-0.2 -0.929 48.0 -14.7-128.0 150.8 6.3 60.7 -10.1 24 25 A G E - 0 0 0 59,-2.0 60,-0.2 -2,-0.3 -1,-0.1 0.669 68.7-176.3 36.1 38.7 3.9 58.1 -11.5 25 26 A P E + 0 0 2 0, 0.0 60,-0.4 0, 0.0 2,-0.3 -0.318 18.8 139.9 -61.9 148.3 6.2 55.1 -11.2 26 27 A M E - B 0 33A 7 7,-1.6 7,-3.0 252,-0.1 2,-0.5 -0.977 51.3-114.8-174.7 168.0 4.6 51.9 -12.6 27 28 A L E + B 0 32A 16 252,-0.4 2,-0.4 -2,-0.3 5,-0.2 -0.987 37.1 173.0-118.4 120.9 5.1 48.7 -14.6 28 29 A Y E > - B 0 31A 9 3,-3.0 3,-2.1 -2,-0.5 -2,-0.0 -0.980 63.4 -20.2-136.5 124.0 3.2 48.6 -17.9 29 30 A Q T 3 S- 0 0 132 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.898 127.6 -47.9 48.6 50.2 3.4 46.0 -20.6 30 31 A G T 3 S+ 0 0 55 1,-0.2 2,-0.5 -3,-0.0 -1,-0.3 0.408 118.4 108.8 76.4 -2.7 6.8 44.8 -19.5 31 32 A V E < -B 28 0A 5 -3,-2.1 -3,-3.0 88,-0.1 2,-0.5 -0.915 61.7-141.1-113.8 131.7 8.2 48.3 -19.2 32 33 A Y E -BC 27 56A 12 24,-3.5 24,-2.0 -2,-0.5 2,-0.4 -0.773 22.0-157.8 -87.0 125.8 9.1 50.1 -16.0 33 34 A H E -BC 26 55A 2 -7,-3.0 -7,-1.6 -2,-0.5 2,-0.4 -0.867 10.3-173.9-107.5 139.8 8.2 53.8 -16.3 34 35 A F E + C 0 54A 0 20,-2.6 20,-2.3 -2,-0.4 2,-0.3 -0.999 3.6 178.1-134.1 133.0 9.7 56.6 -14.1 35 36 A F E -BC 23 53A 0 -12,-1.6 -12,-3.1 -2,-0.4 2,-0.3 -0.837 6.4-179.2-125.6 163.4 8.7 60.2 -14.0 36 37 A Y E -BC 22 52A 7 16,-1.1 16,-3.4 -14,-0.3 2,-0.2 -0.971 38.6 -90.6-166.3 149.2 10.0 63.0 -11.9 37 38 A Q E - C 0 51A 3 -16,-2.5 -17,-1.9 -2,-0.3 2,-0.4 -0.449 55.9-179.3 -61.5 124.9 9.7 66.7 -11.1 38 39 A Y E -BC 19 50A 33 12,-2.8 12,-3.0 -2,-0.2 -19,-0.2 -0.989 31.5-152.4-137.5 140.3 12.1 68.4 -13.4 39 40 A N E > -B 18 0A 7 -21,-2.1 -21,-0.7 -2,-0.4 3,-0.6 -0.927 9.5-169.0-108.3 107.8 13.2 72.0 -14.2 40 41 A P T 3 S+ 0 0 37 0, 0.0 -1,-0.1 0, 0.0 9,-0.1 0.511 82.3 50.9 -76.1 1.1 14.3 72.1 -17.8 41 42 A Y T 3 S+ 0 0 177 7,-0.3 2,-0.3 1,-0.2 -24,-0.1 0.536 113.3 5.2-115.4 -8.3 15.9 75.6 -17.3 42 43 A A < - 0 0 33 -3,-0.6 -24,-2.3 2,-0.2 -3,-0.2 -0.986 64.2-106.5-164.9 173.0 18.2 75.3 -14.3 43 44 A A S S+ 0 0 6 -26,-0.3 2,-0.3 -2,-0.3 263,-0.1 -0.092 99.9 61.0 -98.2 30.9 19.8 73.3 -11.6 44 45 A T S S- 0 0 26 -26,-0.1 -26,-0.3 257,-0.1 -2,-0.2 -0.864 101.5 -74.7-143.4 174.0 17.5 74.8 -8.9 45 46 A F - 0 0 100 -2,-0.3 2,-0.3 -26,-0.1 -2,-0.1 -0.329 60.3-179.4 -69.0 161.4 13.8 74.8 -8.3 46 47 A G - 0 0 19 1,-0.1 3,-0.1 -4,-0.1 -1,-0.0 -0.964 45.0 -93.5-157.4 174.7 11.8 77.1 -10.7 47 48 A D S S+ 0 0 157 -2,-0.3 2,-0.6 1,-0.2 -1,-0.1 0.757 113.1 53.3 -62.8 -27.9 8.6 78.7 -11.9 48 49 A V + 0 0 53 31,-0.1 2,-0.4 2,-0.0 -7,-0.3 -0.902 66.3 168.3-118.2 104.7 8.3 75.9 -14.5 49 50 A I + 0 0 0 -2,-0.6 31,-2.7 29,-0.3 2,-0.3 -0.949 9.1 175.7-114.6 132.3 8.4 72.3 -13.3 50 51 A I E -C 38 0A 14 -12,-3.0 -12,-2.8 -2,-0.4 2,-0.7 -0.806 37.2 -89.9-130.5 171.7 7.5 69.5 -15.5 51 52 A W E -CD 37 69A 0 18,-2.8 17,-1.8 -2,-0.3 18,-0.7 -0.750 35.7-153.9 -87.9 110.8 7.4 65.7 -15.5 52 53 A G E -C 36 0A 2 -16,-3.4 -16,-1.1 -2,-0.7 2,-0.4 -0.403 15.4-149.6 -73.5 162.5 10.7 64.1 -16.8 53 54 A H E +C 35 0A 0 12,-0.5 12,-2.8 -18,-0.2 2,-0.3 -0.997 23.8 161.0-144.4 134.9 10.3 60.6 -18.3 54 55 A A E -CE 34 64A 0 -20,-2.3 -20,-2.6 -2,-0.4 2,-0.3 -0.978 17.9-151.7-146.9 153.5 12.5 57.6 -18.5 55 56 A V E +CE 33 63A 1 8,-2.0 8,-1.9 -2,-0.3 2,-0.3 -0.913 13.1 175.6-129.5 158.0 11.9 53.9 -19.2 56 57 A S E -C 32 0A 3 -24,-2.0 -24,-3.5 -2,-0.3 6,-0.1 -0.992 31.7-150.2-157.9 155.0 13.6 50.6 -18.2 57 58 A Y S S+ 0 0 147 4,-0.4 5,-0.1 -2,-0.3 -1,-0.1 0.517 105.0 22.5-102.3 -10.5 13.3 46.8 -18.4 58 59 A D S S- 0 0 47 3,-0.5 274,-0.1 -26,-0.1 4,-0.1 0.377 98.5-115.6-137.3 1.9 15.2 46.2 -15.2 59 60 A L S S+ 0 0 2 2,-0.3 3,-0.1 -27,-0.1 271,-0.1 0.488 105.4 70.9 71.9 3.2 15.0 49.4 -13.0 60 61 A V S S+ 0 0 4 1,-0.3 2,-0.5 252,-0.1 -1,-0.1 0.763 90.2 48.5-112.0 -52.5 18.8 49.7 -13.4 61 62 A N S S- 0 0 48 469,-0.1 -3,-0.5 471,-0.0 -4,-0.4 -0.815 76.4-166.5 -96.1 131.0 19.5 50.7 -17.0 62 63 A W E - f 0 532A 6 469,-2.6 471,-2.6 -2,-0.5 2,-0.5 -0.809 25.1-149.4-124.1 161.9 17.5 53.6 -18.4 63 64 A I E -Ef 55 533A 40 -8,-1.9 -8,-2.0 -2,-0.3 2,-0.4 -0.991 24.4-139.2-125.8 117.1 16.5 55.4 -21.5 64 65 A H E -Ef 54 534A 4 469,-2.7 471,-2.6 -2,-0.5 -10,-0.2 -0.656 26.0-177.2 -79.6 129.1 15.7 59.1 -21.1 65 66 A L - 0 0 2 -12,-2.8 -12,-0.5 -2,-0.4 471,-0.2 -0.485 35.5 -75.0-113.4-175.6 12.7 60.3 -23.1 66 67 A D - 0 0 56 469,-0.3 -1,-0.1 -2,-0.2 470,-0.0 -0.485 68.3 -75.9 -79.5 155.0 11.1 63.7 -23.6 67 68 A P - 0 0 38 0, 0.0 -15,-0.2 0, 0.0 -1,-0.2 -0.197 42.3-159.5 -50.6 140.8 9.0 65.2 -20.8 68 69 A A S S+ 0 0 6 -17,-1.8 2,-0.5 1,-0.3 56,-0.3 0.843 72.3 35.2 -93.5 -41.0 5.7 63.5 -20.6 69 70 A I B S+D 51 0A 0 -18,-0.7 -18,-2.8 11,-0.1 -1,-0.3 -0.969 70.1 145.4-124.0 120.9 3.5 65.9 -18.7 70 71 A Y - 0 0 101 -2,-0.5 -20,-0.1 -20,-0.2 7,-0.1 -0.967 56.7 -62.1-147.8 159.3 3.9 69.7 -19.0 71 72 A P + 0 0 39 0, 0.0 6,-0.2 0, 0.0 3,-0.1 -0.178 66.2 133.3 -47.8 120.4 1.7 72.8 -19.0 72 73 A T + 0 0 85 1,-0.2 2,-0.2 -3,-0.0 5,-0.1 0.366 61.4 49.1-144.5 -12.9 -0.9 72.8 -21.8 73 74 A Q S > S- 0 0 48 1,-0.1 3,-1.0 0, 0.0 4,-0.4 -0.762 85.1-109.1-125.7 173.8 -4.2 73.7 -20.1 74 75 A E G > S+ 0 0 87 -2,-0.2 28,-1.1 1,-0.2 3,-0.7 0.858 116.8 66.4 -69.3 -32.9 -5.4 76.4 -17.8 75 76 A A G 3 S+ 0 0 1 1,-0.2 32,-0.3 55,-0.2 -1,-0.2 0.563 122.0 13.7 -65.7 -11.5 -5.6 73.6 -15.1 76 77 A D G X S+ 0 0 0 -3,-1.0 3,-0.8 23,-0.2 -1,-0.2 0.136 84.7 128.9-150.8 24.3 -1.8 73.3 -15.2 77 78 A S T < S+ 0 0 51 -3,-0.7 24,-0.2 -4,-0.4 -2,-0.1 0.735 77.9 43.5 -55.4 -30.4 -0.5 76.4 -17.0 78 79 A K T 3 S- 0 0 94 22,-2.8 -29,-0.3 1,-0.3 2,-0.2 0.666 128.1 -33.1 -93.4 -18.2 2.0 77.4 -14.3 79 80 A S E < -G 100 0B 0 -3,-0.8 21,-2.1 21,-0.6 2,-0.6 -0.874 45.4-120.7 170.4 158.7 3.5 73.9 -13.6 80 81 A C E -G 99 0B 0 -31,-2.7 19,-0.2 -2,-0.2 3,-0.1 -0.891 40.1-177.0-119.9 97.0 2.9 70.2 -13.4 81 82 A W E - 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