==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR BINDING PROTEIN 06-FEB-12 4AHA . COMPND 2 MOLECULE: FUCOSE-SPECIFIC LECTIN FLEA; . SOURCE 2 ORGANISM_SCIENTIFIC: ASPERGILLUS FUMIGATUS; . AUTHOR J.HOUSER,J.KOMAREK,N.KOSTLANOVA,M.LAHMANN,G.CIOCI,A.VARROT,A . 628 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23548.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 382 60.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 265 42.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 19 3.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 31 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 56 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 17 2.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 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 0 0 PARALLEL BRIDGES PER LADDER . 4 3 6 4 7 14 4 2 0 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 8 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 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 S 0 0 139 0, 0.0 447,-0.0 0, 0.0 288,-0.0 0.000 360.0 360.0 360.0 133.4 16.2 -12.7 32.6 2 3 A T > + 0 0 32 1,-0.1 4,-1.9 287,-0.1 312,-0.0 -0.808 360.0 175.3-132.9 82.1 15.8 -12.0 28.9 3 4 A P T 4 S+ 0 0 72 0, 0.0 4,-0.5 0, 0.0 -1,-0.1 0.795 81.7 57.3 -66.8 -33.8 18.6 -9.7 27.5 4 5 A G T >4 S+ 0 0 13 2,-0.2 3,-1.7 309,-0.2 4,-0.4 0.959 107.9 45.9 -53.2 -55.0 17.3 -10.1 23.9 5 6 A A G >4 S+ 0 0 0 1,-0.3 3,-2.0 308,-0.2 -1,-0.2 0.902 106.5 60.3 -59.4 -38.8 13.9 -8.8 24.8 6 7 A Q G 3< S+ 0 0 23 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.648 94.6 65.6 -60.9 -20.5 15.5 -5.9 26.8 7 8 A Q G < S+ 0 0 55 -3,-1.7 23,-1.9 -4,-0.5 2,-0.4 0.665 83.3 90.1 -76.7 -15.3 17.1 -4.8 23.5 8 9 A V B < S-A 29 0A 2 -3,-2.0 21,-0.2 -4,-0.4 2,-0.2 -0.702 87.2-114.8 -87.2 128.9 13.7 -4.0 22.0 9 10 A L > - 0 0 33 19,-1.9 3,-2.2 -2,-0.4 2,-0.2 -0.406 28.5-113.7 -63.5 127.7 12.6 -0.4 22.6 10 11 A F T 3 S+ 0 0 26 1,-0.3 -1,-0.1 -2,-0.2 281,-0.1 -0.482 105.7 10.5 -60.1 125.2 9.5 -0.1 24.8 11 12 A R T 3 S+ 0 0 52 -2,-0.2 -1,-0.3 1,-0.2 3,-0.1 0.697 94.1 173.8 67.9 26.6 6.8 1.3 22.5 12 13 A T < - 0 0 1 -3,-2.2 252,-0.4 16,-0.1 -1,-0.2 -0.280 38.6-105.5 -53.8 141.3 8.9 0.8 19.4 13 14 A G - 0 0 7 46,-0.6 15,-0.7 250,-0.1 2,-0.4 -0.453 39.6-156.9 -59.0 142.8 7.4 1.4 16.1 14 15 A I E +B 27 0B 10 47,-0.3 2,-0.3 251,-0.2 13,-0.2 -0.997 16.5 173.9-130.6 134.3 6.7 -1.9 14.3 15 16 A A E -B 26 0B 5 11,-2.0 11,-2.7 -2,-0.4 2,-0.3 -0.904 8.9-166.8-127.8 158.6 6.3 -2.5 10.6 16 17 A A E -B 25 0B 13 47,-0.3 2,-0.3 -2,-0.3 9,-0.2 -0.984 9.0-179.0-148.1 150.7 5.8 -5.9 8.7 17 18 A V E +B 24 0B 5 7,-2.4 7,-2.5 -2,-0.3 2,-0.3 -0.881 10.6 172.1-138.8 161.5 6.0 -7.3 5.2 18 19 A N E -B 23 0B 25 -2,-0.3 2,-0.4 5,-0.2 49,-0.3 -0.992 35.3-142.7-159.5 161.3 5.4 -10.7 3.7 19 20 A S E > S-B 22 0B 27 3,-2.1 3,-2.0 -2,-0.3 251,-0.1 -0.937 83.6 -58.4-130.1 112.8 5.1 -12.9 0.7 20 21 A T T 3 S- 0 0 67 -2,-0.4 -1,-0.2 1,-0.2 249,-0.0 -0.250 123.5 -13.0 38.5-125.1 2.4 -15.4 1.8 21 22 A N T 3 S+ 0 0 83 -3,-0.1 2,-0.6 2,-0.1 20,-0.4 0.057 112.3 102.1 -87.4 20.6 3.8 -17.1 5.0 22 23 A H E < -B 19 0B 75 -3,-2.0 -3,-2.1 18,-0.1 2,-0.3 -0.962 62.6-170.7-103.7 114.2 7.4 -15.7 4.4 23 24 A L E -BC 18 39B 4 16,-1.6 16,-2.7 -2,-0.6 2,-0.3 -0.844 28.0-174.0-125.8 146.6 7.6 -12.9 6.9 24 25 A R E -BC 17 38B 38 -7,-2.5 -7,-2.4 -2,-0.3 2,-0.4 -0.996 8.9-167.4-135.5 136.7 9.8 -9.9 7.9 25 26 A V E -BC 16 37B 1 12,-2.2 12,-2.6 -2,-0.3 2,-0.4 -0.981 6.0-156.6-129.3 128.2 9.2 -7.6 11.0 26 27 A Y E +BC 15 36B 0 -11,-2.7 -11,-2.0 -2,-0.4 2,-0.3 -0.905 21.5 156.7-112.4 136.8 11.0 -4.3 11.6 27 28 A F E -BC 14 35B 4 8,-1.6 8,-2.7 -2,-0.4 2,-0.4 -0.956 37.9-108.1-150.1 162.1 11.4 -2.6 15.0 28 29 A Q E - C 0 34B 0 -15,-0.7 -19,-1.9 -2,-0.3 6,-0.2 -0.821 27.5-143.5 -97.7 141.3 13.7 -0.1 16.7 29 30 A D B > -A 8 0A 3 4,-3.0 3,-2.0 -2,-0.4 -21,-0.2 -0.395 35.9 -93.1 -89.9 175.6 16.3 -1.2 19.4 30 31 A V T 3 S+ 0 0 9 -23,-1.9 -22,-0.1 1,-0.3 -23,-0.1 0.652 126.2 54.1 -67.3 -13.3 17.2 0.8 22.5 31 32 A Y T 3 S- 0 0 145 -24,-0.3 -1,-0.3 2,-0.1 26,-0.1 0.450 121.7-105.3 -95.6 -0.7 20.1 2.4 20.7 32 33 A G S < S+ 0 0 2 -3,-2.0 23,-2.1 1,-0.3 2,-0.2 0.455 74.6 139.2 92.9 -0.9 17.8 3.7 17.9 33 34 A S E - D 0 54B 19 21,-0.2 -4,-3.0 1,-0.0 2,-0.6 -0.510 52.5-127.3 -73.9 145.3 18.9 1.1 15.3 34 35 A I E -CD 28 53B 0 19,-2.9 18,-2.8 -6,-0.2 19,-0.7 -0.876 31.2-167.2 -96.9 119.3 16.3 -0.5 13.1 35 36 A R E -CD 27 51B 3 -8,-2.7 -8,-1.6 -2,-0.6 2,-0.5 -0.759 12.8-137.9-110.7 156.2 16.5 -4.3 13.1 36 37 A E E -C 26 0B 23 14,-2.0 10,-2.5 -2,-0.3 2,-0.3 -0.948 11.9-170.7-115.3 126.8 14.9 -7.1 11.0 37 38 A S E -CE 25 45B 0 -12,-2.6 -12,-2.2 -2,-0.5 2,-0.3 -0.809 16.1-157.0-105.5 158.6 13.4 -10.3 12.3 38 39 A L E -CE 24 44B 31 6,-2.5 6,-2.3 -2,-0.3 2,-0.4 -0.933 18.8-156.3-140.0 146.7 12.5 -13.0 9.9 39 40 A Y E +CE 23 43B 66 -16,-2.7 -16,-1.6 -2,-0.3 2,-0.3 -0.913 26.6 151.8-126.6 108.3 10.2 -16.0 9.5 40 41 A E S S- 0 0 81 2,-2.2 -18,-0.1 -2,-0.4 3,-0.0 -0.711 94.0 -37.1-130.3 79.6 11.3 -18.7 6.9 41 42 A G S S+ 0 0 65 -20,-0.4 2,-0.3 -2,-0.3 -19,-0.0 0.078 141.8 14.4 84.3 -25.9 9.8 -22.0 8.3 42 43 A S S S- 0 0 74 2,-0.0 -2,-2.2 0, 0.0 2,-0.3 -0.966 96.4 -76.7-166.0 177.3 10.7 -20.6 11.7 43 44 A W E +E 39 0B 29 -2,-0.3 2,-0.3 -4,-0.2 -4,-0.2 -0.616 52.1 156.6 -94.1 143.6 11.7 -17.4 13.5 44 45 A A E +E 38 0B 30 -6,-2.3 -6,-2.5 -2,-0.3 2,-0.2 -0.983 31.9 11.8-157.6 156.0 15.2 -16.0 13.3 45 46 A N E +E 37 0B 61 -2,-0.3 -8,-0.2 -8,-0.2 3,-0.1 -0.427 36.0 140.9 82.9-137.6 17.3 -12.9 13.6 46 47 A G + 0 0 0 -10,-2.5 -9,-0.2 1,-0.2 -1,-0.1 0.671 51.2 132.8 59.5 17.5 16.4 -9.4 15.0 47 48 A T S > S- 0 0 56 -11,-0.3 3,-1.9 1,-0.1 -11,-0.3 -0.289 79.2 -92.2 -86.6 179.3 19.9 -9.3 16.6 48 49 A E T 3 S+ 0 0 134 1,-0.3 3,-0.4 2,-0.1 -1,-0.1 0.632 126.5 61.4 -69.9 -12.1 22.4 -6.5 16.6 49 50 A K T 3 S+ 0 0 180 1,-0.2 -1,-0.3 -4,-0.0 -3,-0.0 0.570 94.5 66.1 -84.2 -8.5 23.9 -8.1 13.5 50 51 A N < + 0 0 36 -3,-1.9 -14,-2.0 -5,-0.0 2,-0.4 -0.211 69.3 138.8-109.9 42.1 20.6 -7.6 11.7 51 52 A V E -D 35 0B 55 -3,-0.4 -16,-0.2 -16,-0.2 3,-0.1 -0.760 29.1-178.2 -89.7 130.8 20.6 -3.8 11.6 52 53 A I E - 0 0 27 -18,-2.8 2,-0.3 -2,-0.4 -17,-0.1 0.471 63.4 -45.5-107.2 -3.8 19.4 -2.1 8.4 53 54 A G E -D 34 0B 13 -19,-0.7 -19,-2.9 32,-0.1 -1,-0.3 -0.943 57.6 -92.4 160.1 178.5 19.9 1.5 9.5 54 55 A N E +D 33 0B 99 -2,-0.3 2,-0.3 -21,-0.3 -21,-0.2 -0.923 31.4 172.1-122.9 152.7 19.5 4.1 12.2 55 56 A A - 0 0 12 -23,-2.1 22,-0.2 -2,-0.3 3,-0.1 -0.937 46.5 -65.7-148.5 171.7 16.8 6.7 13.1 56 57 A K > - 0 0 20 20,-1.7 3,-2.0 -2,-0.3 20,-0.2 -0.269 67.4 -93.0 -57.6 138.7 15.8 9.1 15.9 57 58 A L T 3 S+ 0 0 41 1,-0.3 -1,-0.1 -26,-0.1 -27,-0.1 -0.324 115.9 21.9 -54.3 137.6 14.9 7.3 19.1 58 59 A G T 3 S+ 0 0 55 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.527 91.6 161.9 78.4 7.2 11.2 6.7 19.2 59 60 A S < - 0 0 1 -3,-2.0 -46,-0.6 17,-0.1 -1,-0.2 -0.211 45.1-106.4 -51.6 141.7 10.9 7.1 15.4 60 61 A P - 0 0 23 0, 0.0 16,-0.4 0, 0.0 2,-0.4 -0.346 32.8-149.5 -60.1 152.7 7.9 5.8 13.6 61 62 A V + 0 0 13 -47,-0.2 2,-0.3 50,-0.2 -47,-0.3 -0.956 21.7 168.2-133.0 114.0 8.5 2.7 11.6 62 63 A A E -F 74 0C 7 12,-2.4 12,-3.0 -2,-0.4 2,-0.3 -0.915 6.8-177.0-121.2 151.5 6.6 1.9 8.4 63 64 A A E +F 73 0C 19 -2,-0.3 -47,-0.3 10,-0.2 2,-0.3 -0.997 8.4 175.2-146.5 148.7 7.3 -0.7 5.7 64 65 A T E +F 72 0C 19 8,-2.0 8,-2.6 -2,-0.3 2,-0.3 -0.962 11.1 179.2-144.2 160.8 5.9 -1.9 2.4 65 66 A S E -F 71 0C 25 -2,-0.3 2,-0.6 6,-0.2 50,-0.2 -0.990 37.7-126.3-152.7 159.3 6.9 -4.5 -0.2 66 67 A K E >> S-F 70 0C 41 4,-2.0 3,-1.9 -2,-0.3 4,-1.3 -0.932 87.0 -62.1-104.3 102.0 6.3 -6.3 -3.5 67 68 A E T 34 S- 0 0 113 -2,-0.6 -49,-0.2 1,-0.3 3,-0.1 -0.364 96.7 -53.1 46.5-135.3 6.4 -9.9 -2.1 68 69 A L T 34 S+ 0 0 30 -3,-0.1 -1,-0.3 1,-0.1 3,-0.2 0.141 126.6 88.7-112.9 21.8 10.0 -10.1 -0.7 69 70 A K T <4 S+ 0 0 128 -3,-1.9 20,-2.3 1,-0.3 2,-0.4 0.802 99.7 22.8 -82.5 -35.3 11.6 -9.0 -4.0 70 71 A H E < S+FG 66 88C 32 -4,-1.3 -4,-2.0 18,-0.2 2,-0.4 -0.960 70.7 176.4-135.0 119.3 11.4 -5.3 -3.0 71 72 A I E -FG 65 87C 4 16,-2.2 16,-3.0 -2,-0.4 2,-0.4 -0.951 6.7-171.0-120.6 146.3 11.1 -4.0 0.5 72 73 A R E -FG 64 86C 16 -8,-2.6 -8,-2.0 -2,-0.4 2,-0.5 -0.996 2.5-167.2-135.2 129.7 11.1 -0.3 1.7 73 74 A V E -FG 63 85C 0 12,-2.6 12,-2.5 -2,-0.4 2,-0.4 -0.968 7.8-159.0-122.6 124.2 11.3 0.8 5.4 74 75 A Y E +FG 62 84C 1 -12,-3.0 -12,-2.4 -2,-0.5 2,-0.2 -0.890 21.7 149.2-114.5 134.7 10.6 4.4 6.4 75 76 A T E - 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