==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-OCT-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 07-JUN-11 3SC7 . COMPND 2 MOLECULE: INULINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ASPERGILLUS FICUUM; . AUTHOR I.HOUSEN,J.POUYEZ,G.ROUSSEL,A.MAYARD,A.M.VANDAMME,J.WOUTERS, . 493 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18171.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 314 63.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 5 1.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 190 38.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 1 0.2 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 . 49 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 7 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.6 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 . 1 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 0 PARALLEL BRIDGES PER LADDER . 5 3 2 1 3 8 3 2 2 1 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 1 2 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 24 X Q 0 0 87 0, 0.0 2,-2.3 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 67.4 40.8 -16.2 11.1 2 25 X S + 0 0 118 1,-0.1 0, 0.0 2,-0.1 0, 0.0 -0.540 360.0 27.9 59.3 -55.4 42.3 -16.5 14.3 3 26 X N S > S- 0 0 78 -2,-2.3 3,-1.9 3,-0.0 -1,-0.1 0.094 111.3-106.1-120.5 29.2 43.7 -19.7 12.6 4 27 X D T 3 - 0 0 25 1,-0.3 304,-0.1 2,-0.0 303,-0.1 0.786 68.4 -76.4 58.4 29.8 43.9 -18.9 8.9 5 28 X Y T 3 S+ 0 0 20 1,-0.2 -1,-0.3 -4,-0.1 440,-0.1 0.707 75.5 179.2 56.5 24.2 40.9 -21.2 8.4 6 29 X R < - 0 0 56 -3,-1.9 -1,-0.2 438,-0.1 438,-0.2 -0.356 29.5-121.8 -60.0 125.7 43.2 -24.3 8.7 7 30 X P - 0 0 12 0, 0.0 5,-0.1 0, 0.0 -1,-0.1 -0.387 14.5-149.4 -59.5 144.1 41.2 -27.5 8.5 8 31 X S S S+ 0 0 53 357,-0.1 484,-0.4 1,-0.1 358,-0.1 0.715 89.3 16.7 -93.7 -18.1 41.5 -29.6 11.6 9 32 X Y S S+ 0 0 3 482,-0.1 2,-0.3 2,-0.1 -1,-0.1 0.341 107.0 83.1-137.4 10.5 41.1 -33.1 9.9 10 33 X H S S- 0 0 12 304,-0.1 2,-0.2 1,-0.0 303,-0.1 -0.871 84.6-100.4-106.4 150.0 41.7 -32.6 6.2 11 34 X F + 0 0 9 -2,-0.3 301,-2.7 302,-0.3 -2,-0.1 -0.452 43.5 168.0 -68.8 134.8 45.1 -32.5 4.6 12 35 X T - 0 0 12 299,-0.2 299,-0.1 -2,-0.2 298,-0.1 -0.967 43.8 -92.2-134.8 156.6 46.6 -29.2 3.7 13 36 X P - 0 0 0 0, 0.0 3,-0.1 0, 0.0 5,-0.1 -0.292 35.3-116.0 -62.5 154.2 50.3 -28.5 2.7 14 37 X D S S- 0 0 79 1,-0.2 2,-0.3 294,-0.0 48,-0.0 0.902 97.4 -7.4 -58.5 -38.6 52.6 -27.6 5.6 15 38 X Q S S+ 0 0 93 294,-0.1 -1,-0.2 2,-0.0 293,-0.2 -0.982 112.5 9.4-148.8 155.2 52.9 -24.3 3.8 16 39 X Y E S-a 308 0A 86 291,-2.3 293,-1.8 -2,-0.3 2,-0.4 -0.261 89.5 -21.9 80.0-156.7 51.9 -22.7 0.5 17 40 X W E -aB 309 38A 33 21,-1.7 21,-2.8 291,-0.2 2,-0.4 -0.747 44.1-170.6-110.3 134.3 49.6 -23.8 -2.3 18 41 X M E + B 0 37A 2 291,-3.0 19,-0.2 -2,-0.4 2,-0.1 -0.943 5.0 177.5-116.7 141.6 48.3 -27.2 -3.4 19 42 X N E - 0 0 65 17,-2.5 277,-0.1 -2,-0.4 256,-0.0 -0.019 57.1 -15.3-105.4-139.5 46.4 -28.2 -6.5 20 43 X E E S- 0 0 42 15,-0.1 16,-2.6 1,-0.1 -1,-0.3 -0.157 73.3-102.0 -68.5 154.2 45.4 -31.7 -7.4 21 44 X P E - B 0 35A 0 0, 0.0 14,-0.3 0, 0.0 2,-0.3 -0.311 39.1-163.0 -65.7 158.1 46.8 -34.9 -5.8 22 45 X N E + B 0 34A 0 12,-2.2 12,-1.4 28,-0.1 57,-0.2 -0.963 54.9 8.0-138.3 153.1 49.4 -36.9 -7.7 23 46 X G E - 0 0 0 55,-2.3 2,-0.3 -2,-0.3 56,-0.2 0.720 67.6-169.4 55.0 34.3 50.9 -40.4 -7.6 24 47 X L E + 0 0 4 255,-0.1 257,-1.9 10,-0.1 56,-0.3 -0.414 21.4 151.5 -65.1 120.8 48.5 -41.9 -5.0 25 48 X I E -cB 281 32A 0 7,-1.2 7,-2.7 -2,-0.3 2,-0.5 -0.992 42.6-135.0-151.3 141.0 50.0 -45.2 -4.0 26 49 X K E - B 0 31A 27 255,-2.5 2,-0.5 -2,-0.3 5,-0.2 -0.865 22.0-174.2 -95.4 132.0 50.0 -47.6 -1.0 27 50 X I E > - B 0 30A 10 3,-3.2 3,-2.2 -2,-0.5 2,-0.2 -0.944 59.6 -51.8-129.3 107.8 53.4 -49.0 -0.2 28 51 X G T 3 S- 0 0 61 -2,-0.5 94,-0.0 1,-0.3 0, 0.0 -0.465 123.1 -19.2 60.8-126.5 53.5 -51.6 2.6 29 52 X S T 3 S+ 0 0 85 -2,-0.2 2,-0.5 -3,-0.1 -1,-0.3 0.370 121.5 95.5 -90.6 5.9 51.6 -50.0 5.6 30 53 X T E < -B 27 0A 37 -3,-2.2 -3,-3.2 26,-0.1 2,-0.5 -0.875 61.1-151.3-111.5 122.9 52.1 -46.5 4.2 31 54 X W E -BD 26 54A 5 23,-3.0 23,-1.9 -2,-0.5 2,-0.5 -0.767 21.3-149.3 -81.3 124.5 49.6 -44.5 2.2 32 55 X H E -BD 25 53A 8 -7,-2.7 -7,-1.2 -2,-0.5 2,-0.5 -0.861 12.9-170.9-100.7 132.3 51.5 -42.0 -0.0 33 56 X L E + D 0 52A 0 19,-2.8 19,-2.5 -2,-0.5 2,-0.3 -0.986 8.1 172.9-119.4 120.2 50.1 -38.7 -1.0 34 57 X F E +BD 22 51A 1 -12,-1.4 -12,-2.2 -2,-0.5 2,-0.3 -0.804 9.5 174.9-114.4 168.7 51.8 -36.5 -3.6 35 58 X F E -BD 21 50A 3 15,-1.2 15,-2.9 -14,-0.3 2,-0.5 -0.983 42.6 -83.4-165.6 156.9 50.3 -33.3 -5.0 36 59 X Q E - D 0 49A 8 -16,-2.6 -17,-2.5 -2,-0.3 2,-0.4 -0.576 54.3-169.0 -65.2 115.7 50.9 -30.3 -7.2 37 60 X H E -BD 18 48A 14 11,-3.0 11,-2.3 -2,-0.5 -19,-0.2 -0.942 22.0-169.6-121.0 134.9 52.7 -27.9 -4.9 38 61 X N E > +B 17 0A 8 -21,-2.8 -21,-1.7 -2,-0.4 3,-1.1 -0.848 8.4 175.3-121.8 84.4 53.5 -24.2 -5.4 39 62 X P T 3 S+ 0 0 45 0, 0.0 -1,-0.1 0, 0.0 8,-0.1 0.643 75.8 68.8 -65.4 -16.8 56.0 -23.1 -2.7 40 63 X T T 3 S- 0 0 81 6,-0.3 3,-0.1 2,-0.1 4,-0.1 0.715 94.6-145.8 -72.6 -23.7 56.3 -19.6 -4.2 41 64 X A < + 0 0 32 -3,-1.1 2,-0.3 1,-0.2 -25,-0.1 0.890 62.2 91.1 56.1 43.0 52.7 -19.0 -3.2 42 65 X N S > S- 0 0 71 -25,-0.1 3,-2.2 -4,-0.0 -1,-0.2 -0.942 91.1 -99.0-149.9 167.7 51.7 -16.8 -6.1 43 66 X V T 3 S+ 0 0 96 1,-0.3 -2,-0.1 -2,-0.3 -3,-0.0 0.680 119.8 55.0 -62.5 -17.7 50.1 -17.7 -9.5 44 67 X W T 3 S+ 0 0 220 -4,-0.1 -1,-0.3 2,-0.1 2,-0.0 0.375 81.7 125.4 -96.1 2.8 53.5 -17.5 -11.3 45 68 X G < - 0 0 7 -3,-2.2 2,-0.2 1,-0.1 -7,-0.0 -0.298 66.3-109.8 -64.6 144.6 55.2 -20.1 -9.0 46 69 X N - 0 0 54 1,-0.1 -6,-0.3 23,-0.0 2,-0.3 -0.552 33.9-126.1 -72.1 138.4 56.9 -23.2 -10.4 47 70 X I + 0 0 14 -2,-0.2 28,-2.3 -9,-0.1 2,-0.3 -0.665 33.2 166.3 -91.7 139.6 55.1 -26.5 -9.6 48 71 X C E -D 37 0A 2 -11,-2.3 -11,-3.0 -2,-0.3 2,-0.8 -0.844 43.5 -93.3-132.8 170.9 56.7 -29.5 -8.0 49 72 X W E -DE 36 67A 2 18,-2.8 17,-2.6 -2,-0.3 18,-1.1 -0.842 39.1-159.8 -87.9 115.6 55.4 -32.7 -6.4 50 73 X G E -D 35 0A 2 -15,-2.9 -15,-1.2 -2,-0.8 2,-0.3 -0.340 10.7-149.7 -80.5 174.2 54.9 -32.3 -2.7 51 74 X H E +DE 34 63A 6 12,-0.5 12,-2.6 -17,-0.2 2,-0.3 -0.997 22.8 165.7-153.6 136.3 54.6 -35.4 -0.5 52 75 X A E -DE 33 62A 0 -19,-2.5 -19,-2.8 -2,-0.3 2,-0.3 -0.973 16.0-154.5-145.0 157.2 53.1 -36.6 2.7 53 76 X T E +DE 32 61A 20 8,-2.1 8,-3.2 -2,-0.3 2,-0.3 -0.941 13.6 168.9-132.1 155.9 52.6 -40.1 4.3 54 77 X S E -D 31 0A 6 -23,-1.9 -23,-3.0 -2,-0.3 6,-0.1 -0.978 34.0-143.1-152.8 163.1 50.2 -41.8 6.7 55 78 X T S S+ 0 0 102 4,-0.4 5,-0.1 -2,-0.3 -1,-0.1 0.538 105.3 31.2 -99.6 -10.1 49.2 -45.2 8.0 56 79 X D S S- 0 0 34 3,-0.2 4,-0.1 -25,-0.1 -26,-0.1 0.224 103.8-111.1-134.6 12.7 45.5 -44.3 8.2 57 80 X L S S+ 0 0 1 2,-0.2 3,-0.1 1,-0.1 277,-0.1 0.616 108.3 63.7 64.1 15.4 44.7 -41.8 5.4 58 81 X M S S+ 0 0 3 1,-0.2 2,-1.0 256,-0.1 -1,-0.1 0.636 83.3 62.1-135.9 -43.6 44.2 -39.2 8.2 59 82 X H S S- 0 0 61 -48,-0.0 2,-0.4 433,-0.0 -4,-0.4 -0.802 74.1-165.8 -97.7 97.4 47.3 -38.4 10.2 60 83 X W - 0 0 40 -2,-1.0 2,-0.6 -6,-0.1 -6,-0.2 -0.710 14.5-154.6 -95.6 131.6 49.7 -37.0 7.6 61 84 X A E -E 53 0A 42 -8,-3.2 -8,-2.1 -2,-0.4 2,-0.2 -0.904 24.4-127.1-100.9 120.6 53.4 -36.6 8.0 62 85 X H E -E 52 0A 78 -2,-0.6 -10,-0.2 -10,-0.2 -12,-0.0 -0.483 29.1-170.9 -69.6 135.5 54.8 -33.9 5.8 63 86 X K E -E 51 0A 92 -12,-2.6 -12,-0.5 -2,-0.2 3,-0.1 -0.728 28.3 -88.3-120.2 166.0 57.8 -34.9 3.7 64 87 X P E - 0 0 104 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.204 66.9 -64.5 -65.0 168.0 60.2 -32.9 1.5 65 88 X T E - 0 0 69 1,-0.1 -15,-0.2 -15,-0.1 3,-0.2 -0.328 46.8-161.0 -48.8 130.7 59.5 -32.2 -2.2 66 89 X A E S+ 0 0 14 -17,-2.6 2,-0.4 1,-0.3 60,-0.4 0.861 78.0 19.1 -85.5 -44.6 59.4 -35.6 -4.0 67 90 X I E S-E 49 0A 4 -18,-1.1 -18,-2.8 8,-0.1 -1,-0.3 -0.961 83.5-150.0-134.3 112.9 59.9 -34.3 -7.6 68 91 X A - 0 0 40 -2,-0.4 2,-0.3 -20,-0.2 -20,-0.1 -0.465 19.8-113.5 -86.9 151.2 61.4 -30.9 -8.1 69 92 X D + 0 0 55 -2,-0.2 2,-0.3 -23,-0.1 5,-0.2 -0.651 50.8 171.9 -67.2 139.3 61.0 -28.3 -10.8 70 93 X E B > +F 73 0B 105 3,-2.1 3,-2.1 -2,-0.3 0, 0.0 -0.962 48.2 7.3-159.4 131.4 64.4 -28.1 -12.4 71 94 X N T 3 S- 0 0 145 1,-0.3 -1,-0.1 -2,-0.3 3,-0.1 0.845 129.5 -62.2 61.1 52.3 66.0 -26.5 -15.4 72 95 X G T 3 S+ 0 0 41 1,-0.1 35,-1.4 34,-0.1 2,-0.5 0.369 107.7 125.2 -80.5 91.9 63.1 -24.9 -15.7 73 96 X V E < -FG 70 106B 22 -3,-2.1 -3,-2.1 33,-0.2 33,-0.2 -0.988 50.6-144.3-110.4 120.3 60.8 -27.9 -16.3 74 97 X E E - 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