==== 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 TRANSFERASE 02-NOV-11 3UGF . COMPND 2 MOLECULE: SUCROSE:(SUCROSE/FRUCTAN) 6-FRUCTOSYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PACHYSANDRA TERMINALIS; . AUTHOR W.LAMMENS,A.RABIJNS,A.VAN LAERE,S.V.STRELKOV,W.VAN DEN ENDE . 1054 5 2 1 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 39465.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 625 59.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 1.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 379 36.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 11 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 7 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 0.8 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 . 63 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 81 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 32 3.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 0.9 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 1 1 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 . 0 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 0 0 0 PARALLEL BRIDGES PER LADDER . 9 9 4 5 8 11 7 5 5 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 6 7 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 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 7 A P 0 0 139 0, 0.0 438,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 140.8 9.1 3.0 49.3 2 8 A Y - 0 0 71 1,-0.1 2,-1.8 439,-0.0 437,-0.1 -0.591 360.0-123.8 -81.1 138.1 10.9 1.5 46.2 3 9 A P - 0 0 110 0, 0.0 -1,-0.1 0, 0.0 436,-0.0 -0.512 36.0-158.7 -82.6 74.8 10.8 3.5 42.9 4 10 A W - 0 0 35 -2,-1.8 2,-0.2 1,-0.1 484,-0.0 -0.220 3.4-140.7 -57.7 133.1 9.3 0.7 40.8 5 11 A S > - 0 0 51 1,-0.1 4,-2.2 0, 0.0 5,-0.2 -0.494 23.6-111.4 -87.6 163.8 9.8 0.9 37.0 6 12 A N H > S+ 0 0 119 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.878 119.7 52.2 -59.8 -38.7 7.2 -0.0 34.4 7 13 A A H > S+ 0 0 48 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.864 108.9 48.5 -67.7 -39.2 9.4 -3.0 33.4 8 14 A Q H > S+ 0 0 22 2,-0.2 4,-0.5 1,-0.2 -2,-0.2 0.914 116.7 43.4 -65.3 -42.8 9.7 -4.3 36.9 9 15 A L H >< S+ 0 0 8 -4,-2.2 3,-1.1 1,-0.2 4,-0.4 0.900 109.7 54.4 -71.2 -42.8 5.9 -4.0 37.5 10 16 A S H >< S+ 0 0 69 -4,-2.8 3,-1.1 1,-0.2 -1,-0.2 0.862 101.4 61.0 -60.2 -36.3 4.9 -5.5 34.1 11 17 A W H 3< S+ 0 0 6 -4,-1.4 -1,-0.2 1,-0.2 457,-0.2 0.757 89.3 72.3 -60.8 -27.3 7.0 -8.6 34.8 12 18 A Q T << S+ 0 0 1 -3,-1.1 456,-1.0 -4,-0.5 -1,-0.2 0.745 71.4 101.0 -66.5 -25.7 4.9 -9.4 37.9 13 19 A R S < S- 0 0 36 -3,-1.1 2,-0.1 -4,-0.4 6,-0.0 -0.373 78.2-117.0 -61.4 137.0 1.8 -10.5 35.9 14 20 A T - 0 0 18 1,-0.1 453,-0.1 453,-0.1 -1,-0.1 -0.377 11.6-150.0 -81.3 155.2 1.6 -14.3 35.8 15 21 A A S S+ 0 0 6 -2,-0.1 505,-2.3 504,-0.1 506,-0.5 0.753 92.5 12.4 -88.3 -32.4 1.8 -16.5 32.6 16 22 A F S S+ 0 0 3 503,-0.2 2,-0.3 504,-0.1 502,-0.0 0.292 99.9 95.6-138.3 12.7 -0.4 -19.4 33.7 17 23 A H S S- 0 0 2 449,-0.1 2,-0.4 300,-0.1 505,-0.1 -0.774 79.9 -98.8-100.2 150.4 -2.3 -18.6 36.9 18 24 A F + 0 0 5 -2,-0.3 297,-2.0 297,-0.2 -2,-0.1 -0.558 58.2 141.0 -70.4 125.2 -5.8 -17.3 37.0 19 25 A Q - 0 0 6 -2,-0.4 295,-0.1 295,-0.2 294,-0.1 -0.953 48.2-107.0-152.7 151.3 -6.2 -13.5 37.4 20 26 A P - 0 0 8 0, 0.0 3,-0.1 0, 0.0 5,-0.1 -0.149 40.5 -96.8 -71.6 174.0 -8.6 -11.0 35.7 21 27 A E S S- 0 0 54 1,-0.1 2,-0.3 290,-0.0 501,-0.0 0.887 98.7 -20.6 -56.9 -40.5 -7.6 -8.5 33.0 22 28 A R S S+ 0 0 124 2,-0.1 289,-0.2 290,-0.0 -1,-0.1 -0.934 99.0 36.3-154.5 173.0 -7.2 -5.8 35.7 23 29 A S E S-a 311 0A 5 287,-2.4 289,-2.0 -2,-0.3 2,-0.3 -0.050 87.2 -23.8 79.4-170.2 -8.1 -4.7 39.3 24 30 A W E +aB 312 45A 18 24,-0.9 21,-1.9 21,-0.7 2,-0.3 -0.638 51.4 174.0 -84.4 132.4 -8.7 -6.6 42.6 25 31 A M E + B 0 44A 0 287,-1.7 19,-0.2 -2,-0.3 2,-0.1 -0.990 12.5 145.0-127.9 141.4 -9.7 -10.2 42.9 26 32 A S E + 0 0 2 17,-1.9 271,-0.1 -2,-0.3 252,-0.0 -0.128 39.4 41.0-138.0-115.6 -10.0 -12.3 46.1 27 33 A D E S- 0 0 29 15,-0.2 16,-2.0 1,-0.1 -1,-0.3 -0.008 70.1-116.4 -52.9 133.6 -12.2 -15.1 47.6 28 34 A P E - B 0 42A 0 0, 0.0 2,-0.4 0, 0.0 14,-0.3 -0.359 34.0-160.1 -55.4 141.1 -13.3 -18.1 45.5 29 35 A D E - B 0 41A 0 12,-2.8 12,-1.6 58,-0.1 60,-0.2 -0.999 50.8 -25.9-132.2 136.0 -17.1 -18.3 45.0 30 36 A G E - 0 0 0 58,-2.3 59,-0.2 -2,-0.4 2,-0.1 0.670 66.6-167.0 40.4 46.6 -19.3 -21.2 44.0 31 37 A P E + 0 0 11 0, 0.0 2,-0.3 0, 0.0 59,-0.2 -0.387 19.6 153.8 -65.4 136.3 -17.0 -23.5 42.0 32 38 A I E - B 0 39A 11 7,-1.5 7,-3.2 251,-0.1 2,-0.5 -0.959 43.7-123.9-149.6 163.4 -18.8 -26.3 40.1 33 39 A F E + B 0 38A 45 251,-0.3 2,-0.3 -2,-0.3 5,-0.2 -0.984 39.2 169.1-108.5 131.4 -18.5 -28.6 37.0 34 40 A Y E > - B 0 37A 37 3,-2.9 3,-1.9 -2,-0.5 -2,-0.1 -0.948 55.9 -23.2-150.7 123.6 -21.5 -28.2 34.7 35 41 A K T 3 S- 0 0 122 -2,-0.3 3,-0.1 1,-0.3 -1,-0.0 0.849 127.7 -40.0 46.7 48.5 -22.3 -29.4 31.2 36 42 A G T 3 S+ 0 0 29 1,-0.2 2,-0.4 26,-0.0 -1,-0.3 0.373 120.0 98.5 89.4 -3.6 -18.6 -29.9 30.1 37 43 A W E < -B 34 0A 22 -3,-1.9 -3,-2.9 87,-0.2 2,-0.5 -0.948 65.0-137.9-120.6 136.9 -17.2 -26.7 31.7 38 44 A Y E -BC 33 61A 0 23,-3.1 23,-1.7 -2,-0.4 2,-0.4 -0.818 29.8-153.7 -81.3 126.9 -15.4 -26.0 35.0 39 45 A H E -BC 32 60A 1 -7,-3.2 -7,-1.5 -2,-0.5 2,-0.4 -0.888 14.9-177.8-107.5 134.9 -17.0 -22.8 36.5 40 46 A F E - C 0 59A 0 19,-2.4 19,-2.3 -2,-0.4 2,-0.3 -1.000 2.2-174.8-131.9 130.5 -15.2 -20.4 38.8 41 47 A F E -BC 29 58A 1 -12,-1.6 -12,-2.8 -2,-0.4 2,-0.3 -0.855 11.3-178.9-116.9 160.3 -16.6 -17.3 40.4 42 48 A Y E -BC 28 57A 13 15,-1.3 15,-2.5 -2,-0.3 -15,-0.2 -0.998 35.6 -91.2-159.8 150.2 -14.6 -14.7 42.5 43 49 A Q E - C 0 56A 1 -16,-2.0 -17,-1.9 -2,-0.3 2,-0.4 -0.439 51.1-178.9 -62.2 135.3 -14.8 -11.5 44.6 44 50 A Y E -BC 25 55A 39 11,-2.0 11,-1.9 -19,-0.2 -19,-0.2 -0.995 28.9-154.6-146.8 130.3 -14.0 -8.6 42.3 45 51 A N E -B 24 0A 4 -21,-1.9 -21,-0.7 -2,-0.4 8,-0.1 -0.939 9.7-167.0-101.0 111.6 -13.7 -4.8 42.7 46 52 A P S S+ 0 0 56 0, 0.0 -1,-0.1 0, 0.0 7,-0.1 0.716 81.3 45.5 -68.2 -18.0 -14.5 -3.2 39.3 47 53 A D S S+ 0 0 100 1,-0.2 -24,-0.1 5,-0.1 6,-0.1 0.800 115.4 9.2-101.3 -36.3 -13.1 0.2 40.3 48 54 A N - 0 0 67 2,-0.3 2,-1.2 4,-0.1 -24,-0.9 -0.986 68.3-109.6-149.0 152.5 -9.7 -0.1 42.1 49 55 A P S S+ 0 0 13 0, 0.0 2,-0.3 0, 0.0 262,-0.1 -0.179 93.3 83.5 -80.3 44.9 -7.0 -2.7 42.9 50 56 A V S S- 0 0 26 -2,-1.2 -2,-0.3 -26,-0.1 -26,-0.2 -0.902 94.8 -76.5-134.2 165.2 -8.0 -2.7 46.6 51 57 A W S S+ 0 0 151 -2,-0.3 2,-0.2 -26,-0.0 -26,-0.0 -0.358 83.0 71.6 -61.6 139.4 -10.8 -4.5 48.5 52 58 A G + 0 0 10 3,-0.1 3,-0.2 -2,-0.0 -5,-0.1 -0.788 53.7 63.3 144.5 176.4 -14.3 -3.1 48.1 53 59 A N S S- 0 0 99 -2,-0.2 23,-0.2 1,-0.2 31,-0.1 0.841 80.0-146.3 40.6 50.0 -17.4 -2.6 45.9 54 60 A N + 0 0 0 29,-0.4 31,-1.8 -9,-0.1 2,-0.2 -0.191 34.7 151.0 -67.3 124.3 -17.7 -6.3 45.9 55 61 A T E -C 44 0A 10 -11,-1.9 -11,-2.0 -3,-0.2 2,-0.6 -0.774 43.6-102.5-132.1 175.7 -19.1 -8.2 42.9 56 62 A W E -CD 43 74A 2 18,-2.4 17,-2.2 -2,-0.2 18,-1.0 -0.935 25.7-159.7-110.9 116.5 -18.7 -11.7 41.4 57 63 A G E -C 42 0A 3 -15,-2.5 -15,-1.3 -2,-0.6 2,-0.3 -0.390 13.0-150.1 -75.1 167.2 -16.5 -12.3 38.3 58 64 A H E +C 41 0A 2 12,-0.5 12,-2.3 -17,-0.2 2,-0.3 -0.991 19.1 168.7-149.0 131.7 -17.0 -15.5 36.3 59 65 A T E -CE 40 69A 0 -19,-2.3 -19,-2.4 -2,-0.3 2,-0.3 -0.976 12.1-158.7-141.8 152.2 -14.7 -17.6 34.2 60 66 A V E +CE 39 68A 0 8,-1.9 8,-2.0 -2,-0.3 2,-0.3 -0.938 9.8 174.7-129.8 155.8 -14.9 -21.1 32.5 61 67 A S E -C 38 0A 0 -23,-1.7 -23,-3.1 -2,-0.3 6,-0.1 -0.985 33.8-137.4-152.8 157.6 -12.5 -23.7 31.2 62 68 A R S S+ 0 0 106 4,-0.4 5,-0.1 -2,-0.3 -1,-0.1 0.659 106.9 21.4 -80.5 -17.3 -12.5 -27.2 29.8 63 69 A D S S- 0 0 31 3,-0.1 275,-0.2 -25,-0.1 -1,-0.1 0.197 104.4-103.4-144.6 13.1 -9.5 -28.3 31.9 64 70 A L S S+ 0 0 1 1,-0.1 3,-0.1 2,-0.1 272,-0.1 0.566 113.0 60.6 66.2 12.2 -9.1 -26.1 35.1 65 71 A I S S+ 0 0 3 1,-0.1 2,-1.6 252,-0.1 -1,-0.1 0.626 84.2 64.7-131.0 -50.5 -6.1 -24.3 33.3 66 72 A H S S- 0 0 65 456,-0.1 -4,-0.4 455,-0.0 -2,-0.1 -0.572 75.3-169.9 -89.5 77.9 -7.2 -22.6 30.0 67 73 A W - 0 0 6 -2,-1.6 456,-1.2 -6,-0.1 2,-0.4 -0.341 13.1-161.5 -76.6 146.4 -9.6 -20.0 31.5 68 74 A L E -Ef 60 523A 39 -8,-2.0 -8,-1.9 454,-0.2 2,-0.2 -0.997 22.2-120.9-128.6 128.2 -11.9 -17.7 29.4 69 75 A Y E -Ef 59 524A 42 454,-2.4 456,-2.5 -2,-0.4 -10,-0.2 -0.487 30.3-174.2 -71.4 132.5 -13.4 -14.5 30.8 70 76 A L - 0 0 24 -12,-2.3 -12,-0.5 -2,-0.2 3,-0.1 -0.698 36.3 -75.9-114.0 171.2 -17.2 -14.3 30.9 71 77 A P - 0 0 75 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.284 66.0 -75.6 -64.9 157.3 -19.5 -11.3 31.9 72 78 A L - 0 0 81 1,-0.1 -15,-0.2 -15,-0.1 3,-0.1 -0.254 42.0-157.4 -50.2 132.8 -19.9 -10.3 35.5 73 79 A A + 0 0 11 -17,-2.2 56,-0.4 1,-0.3 2,-0.4 0.891 69.0 15.5 -86.4 -45.4 -22.3 -12.8 37.3 74 80 A L B -D 56 0A 7 -18,-1.0 -18,-2.4 54,-0.1 -1,-0.3 -0.999 64.6-166.4-137.6 134.7 -23.6 -10.9 40.3 75 81 A A - 0 0 33 -2,-0.4 2,-1.3 -20,-0.2 3,-0.2 -0.777 35.2-107.0-115.7 160.3 -23.6 -7.1 41.1 76 82 A A S S+ 0 0 31 -2,-0.3 6,-0.1 1,-0.2 -21,-0.1 -0.717 71.6 128.5 -85.0 91.7 -24.3 -5.1 44.2 77 83 A D + 0 0 81 -2,-1.3 2,-0.3 7,-0.0 -1,-0.2 0.304 43.2 69.3-138.8 7.7 -27.7 -3.8 43.1 78 84 A Q S >> S- 0 0 93 -3,-0.2 3,-1.7 1,-0.1 4,-0.7 -0.900 83.9-109.9-126.2 159.3 -30.4 -4.4 45.7 79 85 A W G >4 S+ 0 0 161 -2,-0.3 3,-0.6 1,-0.3 28,-0.4 0.869 118.2 54.4 -54.1 -37.2 -30.9 -2.8 49.1 80 86 A Y G 34 S+ 0 0 9 1,-0.2 32,-0.3 26,-0.1 -1,-0.3 0.514 123.1 25.2 -80.7 -7.1 -30.0 -6.1 50.8 81 87 A D G X4 S+ 0 0 0 -3,-1.7 3,-2.1 23,-0.2 -1,-0.2 0.181 81.8 118.8-137.2 21.9 -26.6 -6.4 49.0 82 88 A M T << S+ 0 0 97 -4,-0.7 24,-0.2 -3,-0.6 3,-0.1 0.775 78.7 51.3 -62.6 -30.3 -25.8 -2.8 48.1 83 89 A Q T 3 S- 0 0 95 22,-2.7 -29,-0.4 1,-0.3 -1,-0.3 0.272 128.9 -52.1 -91.5 10.0 -22.5 -2.9 50.2 84 90 A G < - 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