==== 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 3UGG . 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 . 1048 6 2 0 2 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 38265.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 650 62.0 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 . 391 37.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 10 1.0 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 . 84 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 77 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 31 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 . 8 9 7 4 5 13 8 6 4 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 0 142 0, 0.0 441,-0.0 0, 0.0 438,-0.0 0.000 360.0 360.0 360.0 121.6 59.6 -31.2 -4.5 2 8 A Y - 0 0 70 1,-0.1 2,-2.4 439,-0.0 437,-0.1 -0.691 360.0-124.1 -93.5 134.8 58.0 -32.2 -7.8 3 9 A P - 0 0 107 0, 0.0 -1,-0.1 0, 0.0 436,-0.0 -0.468 39.5-159.3 -74.4 74.8 59.9 -32.4 -11.1 4 10 A W - 0 0 25 -2,-2.4 2,-0.2 1,-0.1 484,-0.0 -0.263 3.3-139.8 -59.3 137.4 57.5 -30.0 -12.9 5 11 A S > - 0 0 50 1,-0.1 4,-2.6 483,-0.1 5,-0.2 -0.652 20.7-113.9 -99.5 157.6 57.6 -30.2 -16.7 6 12 A N H > S+ 0 0 110 1,-0.2 4,-2.4 -2,-0.2 5,-0.2 0.865 120.3 49.5 -54.4 -39.6 57.4 -27.3 -19.2 7 13 A A H > S+ 0 0 53 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.880 111.4 48.6 -69.0 -39.5 54.0 -28.6 -20.3 8 14 A Q H 4 S+ 0 0 16 1,-0.2 4,-0.3 2,-0.2 -2,-0.2 0.873 115.5 44.7 -64.7 -38.5 52.8 -28.9 -16.7 9 15 A L H >< S+ 0 0 7 -4,-2.6 3,-1.2 1,-0.2 4,-0.4 0.881 109.0 52.2 -77.9 -41.4 54.0 -25.3 -15.9 10 16 A S H >< S+ 0 0 69 -4,-2.4 3,-1.1 1,-0.3 -1,-0.2 0.817 100.5 65.5 -65.6 -28.7 52.7 -23.5 -19.0 11 17 A W T 3< S+ 0 0 7 -4,-1.1 457,-0.3 1,-0.2 -1,-0.3 0.729 87.4 70.9 -63.1 -23.0 49.3 -24.9 -18.4 12 18 A Q T < S+ 0 0 1 -3,-1.2 456,-0.9 -4,-0.3 -1,-0.2 0.761 72.5 103.7 -70.9 -26.4 49.0 -22.9 -15.2 13 19 A R S < S- 0 0 43 -3,-1.1 2,-0.2 -4,-0.4 455,-0.1 -0.278 76.9-116.8 -54.5 140.1 48.7 -19.6 -17.0 14 20 A T - 0 0 12 1,-0.1 453,-0.1 453,-0.1 -1,-0.1 -0.527 12.4-152.1 -86.9 149.1 45.1 -18.3 -17.0 15 21 A A S S+ 0 0 3 -2,-0.2 505,-2.4 1,-0.1 506,-0.5 0.808 92.4 11.3 -85.4 -35.6 43.0 -17.8 -20.1 16 22 A F S S+ 0 0 3 503,-0.3 2,-0.3 504,-0.1 -1,-0.1 0.249 100.9 96.3-135.8 14.9 40.7 -15.0 -18.8 17 23 A H S S- 0 0 2 300,-0.1 2,-0.2 449,-0.1 299,-0.1 -0.809 82.9 -97.1 -99.0 148.9 42.1 -13.7 -15.5 18 24 A F + 0 0 5 -2,-0.3 297,-2.0 297,-0.2 -2,-0.1 -0.488 57.7 151.0 -68.8 136.3 44.3 -10.6 -15.5 19 25 A Q - 0 0 3 -2,-0.2 295,-0.1 295,-0.2 294,-0.1 -0.957 42.5-115.0-165.0 131.4 47.9 -11.5 -15.3 20 26 A P - 0 0 5 0, 0.0 3,-0.1 0, 0.0 5,-0.1 -0.271 39.2 -98.2 -71.7 169.3 51.0 -9.6 -16.6 21 27 A E S S- 0 0 73 1,-0.1 2,-0.3 290,-0.0 1029,-0.0 0.897 98.6 -19.3 -50.7 -43.5 53.1 -11.0 -19.5 22 28 A R S S+ 0 0 72 2,-0.1 289,-0.3 290,-0.0 -1,-0.1 -0.905 99.3 30.5-150.0 173.6 55.6 -12.2 -16.8 23 29 A S E S-a 311 0A 1 287,-2.5 289,-1.8 -2,-0.3 2,-0.2 0.137 85.1 -18.0 74.8-173.2 56.8 -11.9 -13.3 24 30 A W E +aB 312 45A 15 24,-1.0 21,-1.5 21,-0.5 2,-0.3 -0.440 50.1 178.4 -78.4 139.9 55.3 -11.0 -9.9 25 31 A M E + B 0 44A 0 287,-1.0 19,-0.2 19,-0.2 2,-0.1 -0.993 10.0 153.4-138.7 143.7 52.0 -9.2 -9.4 26 32 A S E + 0 0 2 17,-2.1 271,-0.1 1,-0.3 252,-0.0 -0.100 41.4 26.3-133.5-131.5 50.2 -8.2 -6.1 27 33 A D E S- 0 0 27 15,-0.1 16,-2.1 1,-0.1 -1,-0.3 -0.026 70.5-112.5 -49.0 137.1 47.8 -5.6 -4.7 28 34 A P E - B 0 42A 0 0, 0.0 2,-0.4 0, 0.0 14,-0.3 -0.510 38.0-154.1 -61.9 136.7 45.3 -3.8 -6.8 29 35 A D E - B 0 41A 0 12,-3.2 12,-1.6 -2,-0.2 60,-0.2 -0.974 51.7 -25.4-125.6 138.4 46.3 -0.1 -7.0 30 36 A G E - 0 0 0 58,-2.7 2,-0.2 -2,-0.4 59,-0.1 0.745 68.4-163.7 29.6 61.4 44.1 2.9 -7.6 31 37 A P E + 0 0 2 0, 0.0 2,-0.3 0, 0.0 59,-0.3 -0.510 21.1 155.4 -68.9 133.1 41.2 1.4 -9.6 32 38 A I E - B 0 39A 11 7,-1.4 7,-3.3 -2,-0.2 2,-0.5 -0.973 42.9-129.8-148.3 159.5 39.1 4.0 -11.4 33 39 A F E + B 0 38A 38 251,-0.3 2,-0.4 -2,-0.3 5,-0.2 -0.987 38.4 169.8-108.6 122.4 36.8 4.4 -14.4 34 40 A Y E > - B 0 37A 31 3,-2.5 3,-1.9 -2,-0.5 -2,-0.1 -0.995 56.2 -20.2-140.3 128.0 37.9 7.4 -16.5 35 41 A K T 3 S- 0 0 116 -2,-0.4 3,-0.1 1,-0.3 -1,-0.1 0.801 127.1 -42.7 46.8 46.2 36.8 8.6 -19.9 36 42 A G T 3 S+ 0 0 25 1,-0.2 2,-0.4 26,-0.0 -1,-0.3 0.470 119.3 100.6 86.3 3.5 35.3 5.3 -21.1 37 43 A W E < -B 34 0A 20 -3,-1.9 -3,-2.5 87,-0.1 2,-0.6 -0.958 67.0-134.2-123.5 138.1 38.1 3.1 -19.8 38 44 A Y E -BC 33 61A 0 23,-3.3 23,-1.3 -2,-0.4 2,-0.5 -0.818 29.0-152.9 -84.3 123.3 38.4 0.9 -16.7 39 45 A H E -BC 32 60A 2 -7,-3.3 -7,-1.4 -2,-0.6 2,-0.4 -0.847 15.6-179.7-103.1 132.4 41.8 1.6 -15.2 40 46 A F E - C 0 59A 0 19,-2.4 19,-2.4 -2,-0.5 2,-0.3 -0.996 4.1-176.5-133.1 129.1 43.7 -1.0 -13.1 41 47 A F E -BC 29 58A 1 -12,-1.6 -12,-3.2 -2,-0.4 2,-0.3 -0.818 9.9-177.4-115.7 161.3 47.1 -0.6 -11.4 42 48 A Y E -BC 28 57A 12 15,-1.3 15,-2.8 -2,-0.3 -15,-0.1 -0.986 36.3 -93.1-160.9 145.9 49.0 -3.3 -9.5 43 49 A Q E - C 0 56A 4 -16,-2.1 -17,-2.1 -2,-0.3 2,-0.4 -0.427 53.0-178.3 -58.7 128.9 52.1 -4.0 -7.5 44 50 A Y E -BC 25 55A 36 11,-2.3 11,-1.7 -19,-0.2 -19,-0.2 -0.994 29.1-152.4-145.0 129.2 54.7 -5.4 -10.0 45 51 A N E -B 24 0A 3 -21,-1.5 -21,-0.5 -2,-0.4 8,-0.1 -0.900 8.1-167.5 -99.4 109.4 58.2 -6.7 -9.8 46 52 A P S S+ 0 0 43 0, 0.0 -1,-0.1 0, 0.0 7,-0.1 0.820 83.4 44.7 -63.0 -27.2 60.0 -6.0 -13.1 47 53 A D S S+ 0 0 88 1,-0.2 -24,-0.1 5,-0.1 6,-0.1 0.902 115.4 9.2 -90.9 -46.0 62.9 -8.2 -12.2 48 54 A N - 0 0 66 2,-0.3 -24,-1.0 4,-0.1 2,-0.7 -0.951 65.9-110.0-142.0 154.5 61.6 -11.5 -10.6 49 55 A P S S+ 0 0 6 0, 0.0 2,-0.3 0, 0.0 262,-0.1 -0.070 94.5 84.9 -73.7 35.2 58.5 -13.6 -9.9 50 56 A V S S- 0 0 28 -2,-0.7 -2,-0.3 -26,-0.1 -26,-0.3 -0.891 94.4 -82.7-126.4 163.1 58.9 -12.8 -6.2 51 57 A W S S+ 0 0 137 -2,-0.3 2,-0.2 -26,-0.1 -26,-0.0 -0.410 82.3 73.7 -60.7 139.3 57.8 -9.8 -4.1 52 58 A G + 0 0 11 -2,-0.1 3,-0.2 3,-0.1 -4,-0.1 -0.788 55.2 61.6 145.8 177.5 60.1 -6.8 -4.3 53 59 A N S S- 0 0 86 -2,-0.2 23,-0.2 30,-0.2 31,-0.2 0.782 81.0-146.3 43.6 41.3 61.4 -3.9 -6.3 54 60 A N + 0 0 1 29,-0.5 31,-2.3 -9,-0.1 2,-0.3 -0.005 32.0 160.0 -57.3 127.8 57.8 -2.6 -6.3 55 61 A T E -C 44 0A 6 -11,-1.7 -11,-2.3 -3,-0.2 2,-0.7 -0.877 41.4-107.6-132.6 166.3 56.4 -0.7 -9.2 56 62 A W E -CD 43 74A 1 18,-2.4 17,-2.8 -2,-0.3 18,-0.9 -0.875 29.5-159.0-101.5 106.4 52.9 0.1 -10.4 57 63 A G E -C 42 0A 1 -15,-2.8 -15,-1.3 -2,-0.7 2,-0.4 -0.401 11.6-148.3 -71.8 160.7 51.8 -1.8 -13.5 58 64 A H E +CD 41 70A 0 12,-0.6 12,-2.2 -17,-0.2 2,-0.3 -0.998 20.8 166.8-140.3 134.6 49.0 -0.3 -15.6 59 65 A T E -CD 40 69A 0 -19,-2.4 -19,-2.4 -2,-0.4 2,-0.3 -0.985 13.1-156.3-145.3 156.7 46.2 -1.9 -17.7 60 66 A V E +CD 39 68A 0 8,-2.0 8,-2.0 -2,-0.3 2,-0.3 -0.934 10.8 172.7-135.4 155.4 43.0 -0.8 -19.3 61 67 A S E -C 38 0A 0 -23,-1.3 -23,-3.3 -2,-0.3 6,-0.1 -0.970 33.3-139.4-159.1 148.3 39.7 -2.4 -20.6 62 68 A R S S+ 0 0 124 4,-0.4 5,-0.1 -2,-0.3 -1,-0.1 0.687 107.5 22.7 -74.4 -21.3 36.3 -1.3 -21.9 63 69 A D S S- 0 0 31 3,-0.2 275,-0.2 -25,-0.1 -1,-0.1 0.212 106.1-103.9-139.2 12.2 34.5 -4.0 -19.9 64 70 A L S S+ 0 0 0 2,-0.1 272,-0.1 1,-0.1 3,-0.1 0.635 112.3 60.5 68.4 15.2 36.7 -5.1 -16.9 65 71 A I S S+ 0 0 3 1,-0.1 2,-1.8 252,-0.1 -1,-0.1 0.569 83.7 65.3-133.5 -54.2 37.6 -8.3 -18.7 66 72 A H S S- 0 0 67 456,-0.1 -4,-0.4 -48,-0.0 -3,-0.2 -0.566 75.3-171.7 -84.3 81.7 39.4 -7.6 -22.0 67 73 A W - 0 0 6 -2,-1.8 456,-1.0 -6,-0.1 2,-0.4 -0.380 14.0-161.6 -78.9 149.8 42.6 -6.1 -20.6 68 74 A L E -De 60 523A 22 -8,-2.0 -8,-2.0 454,-0.2 2,-0.1 -0.997 22.2-120.1-133.9 126.0 45.3 -4.4 -22.5 69 75 A Y E -De 59 524A 28 454,-2.5 456,-2.4 -2,-0.4 -10,-0.2 -0.402 28.9-175.1 -69.0 138.3 48.8 -3.8 -21.2 70 76 A L E -D 58 0A 23 -12,-2.2 -12,-0.6 454,-0.2 3,-0.1 -0.813 37.1 -78.4-122.2 165.1 50.2 -0.2 -20.9 71 77 A P E - 0 0 77 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.237 67.2 -70.9 -60.4 154.7 53.7 1.0 -19.9 72 78 A L E - 0 0 75 1,-0.1 -15,-0.2 -15,-0.1 3,-0.1 -0.109 40.9-157.4 -38.5 132.5 54.6 1.1 -16.2 73 79 A A E S+ 0 0 14 -17,-2.8 2,-0.4 1,-0.3 56,-0.4 0.945 74.0 17.9 -81.0 -59.0 52.8 3.9 -14.4 74 80 A L E -D 56 0A 5 -18,-0.9 -18,-2.4 11,-0.1 -1,-0.3 -0.965 68.0-167.4-124.9 132.2 55.1 4.4 -11.4 75 81 A A - 0 0 28 -2,-0.4 2,-1.6 -20,-0.2 3,-0.2 -0.696 36.4-107.1-111.1 163.9 58.8 3.4 -11.0 76 82 A A S S+ 0 0 27 -2,-0.2 6,-0.1 -23,-0.2 -21,-0.1 -0.581 77.1 122.4 -87.8 72.9 61.1 3.2 -8.0 77 83 A D + 0 0 92 -2,-1.6 2,-0.4 6,-0.0 -1,-0.2 0.252 46.1 76.7-124.7 9.2 63.1 6.3 -9.2 78 84 A Q S >> S- 0 0 80 -3,-0.2 3,-2.6 1,-0.1 4,-0.6 -0.948 81.6-119.1-122.0 146.9 62.9 8.9 -6.4 79 85 A W G >4 S+ 0 0 164 -2,-0.4 3,-0.5 1,-0.3 28,-0.5 0.824 116.1 54.2 -50.1 -33.3 64.9 8.8 -3.1 80 86 A Y G 34 S+ 0 0 6 1,-0.2 32,-0.3 26,-0.1 -1,-0.3 0.527 122.4 26.4 -83.6 -8.1 61.5 8.7 -1.2 81 87 A D G X4 S+ 0 0 0 -3,-2.6 3,-0.9 23,-0.2 -1,-0.2 0.103 82.6 117.1-137.0 23.9 60.3 5.6 -3.1 82 88 A M T << S+ 0 0 107 -4,-0.6 24,-0.2 -3,-0.5 3,-0.1 0.789 78.9 50.8 -64.9 -31.1 63.6 4.0 -4.1 83 89 A Q T 3 S- 0 0 88 22,-2.8 -29,-0.5 1,-0.3 -1,-0.3 0.600 130.0 -45.4 -82.9 -13.4 62.8 0.8 -2.1 84 90 A G E < -F 105 0B 0 -3,-0.9 21,-2.1 21,-0.7 2,-1.0 -0.575 39.2-113.7 155.1 147.2 59.4 0.5 -3.7 85 91 A V E -F 104 0B 0 -31,-2.3 19,-0.2 19,-0.2 3,-0.1 -0.843 47.8-164.4 -96.4 93.9 56.2 2.1 -4.9 86 92 A F E - 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