==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-APR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR BINDING PROTEIN 28-NOV-12 4I4P . COMPND 2 MOLECULE: BEL-BETA TREFOIL; . SOURCE 2 ORGANISM_SCIENTIFIC: BOLETUS EDULIS; . AUTHOR M.BOVI,L.CENCI,M.PERDUCA,S.CAPALDI,M.E.CARRIZO,L.CIVIERO, . 292 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13312.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 158 54.1 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 . 96 32.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 22 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 6 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 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 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 . 12 2 0 6 6 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 2 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 1 A V 0 0 55 0, 0.0 98,-2.5 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 131.0 2.4 27.9 9.1 2 2 A N B -A 98 0A 19 96,-0.2 96,-0.3 260,-0.1 4,-0.0 -0.419 360.0 -94.4 -66.4 142.2 1.8 25.4 11.9 3 3 A F - 0 0 20 94,-2.8 3,-0.3 105,-0.2 -1,-0.1 -0.370 33.9-143.4 -57.6 129.6 -0.2 22.4 10.9 4 4 A P S S+ 0 0 82 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.590 86.8 55.3 -79.5 -8.8 -3.8 23.3 11.9 5 5 A N + 0 0 114 2,-0.0 138,-0.2 3,-0.0 -2,-0.1 -0.585 64.1 158.0-125.2 68.8 -4.9 19.8 13.1 6 6 A I - 0 0 27 -3,-0.3 3,-0.1 -2,-0.3 -4,-0.0 -0.789 50.0-103.3 -91.0 129.5 -2.4 18.7 15.8 7 7 A P - 0 0 11 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.201 40.8-101.3 -55.4 142.8 -3.9 16.0 18.1 8 8 A A > - 0 0 58 1,-0.2 3,-2.2 2,-0.1 41,-0.3 -0.239 54.9 -76.7 -60.8 152.9 -5.0 17.2 21.5 9 9 A E T 3 S+ 0 0 116 1,-0.3 -1,-0.2 39,-0.1 41,-0.1 -0.320 120.4 16.9 -58.1 122.6 -2.6 16.4 24.3 10 10 A G T 3 S+ 0 0 49 39,-0.7 -1,-0.3 1,-0.4 2,-0.2 0.197 89.7 128.2 98.8 -15.2 -2.9 12.7 25.3 11 11 A V < - 0 0 58 -3,-2.2 -1,-0.4 38,-0.1 38,-0.4 -0.560 57.2-127.4 -70.5 136.8 -4.7 11.6 22.2 12 12 A Q + 0 0 69 -2,-0.2 134,-1.9 36,-0.1 2,-0.3 -0.583 37.7 154.4 -88.4 150.7 -2.9 8.6 20.6 13 13 A F E -BC 47 145A 0 34,-1.8 34,-2.5 132,-0.2 2,-0.3 -0.983 36.9-122.2-160.3 161.8 -1.8 8.5 16.9 14 14 A R E - C 0 144A 26 130,-2.5 130,-3.1 -2,-0.3 2,-0.7 -0.788 25.8-129.2 -99.2 156.8 0.7 6.9 14.5 15 15 A L E - C 0 143A 0 30,-0.4 9,-1.8 9,-0.3 2,-0.5 -0.944 31.8-173.9-106.4 109.5 3.0 9.1 12.4 16 16 A R E -DC 23 142A 77 126,-2.0 126,-2.3 -2,-0.7 7,-0.2 -0.907 24.2-123.3-111.9 131.5 2.6 7.9 8.8 17 17 A A E > - C 0 141A 3 5,-3.0 4,-1.4 -2,-0.5 124,-0.3 -0.520 16.6-137.6 -72.9 134.0 4.6 9.2 5.9 18 18 A R T 4 S+ 0 0 72 122,-2.6 -1,-0.1 -2,-0.2 123,-0.1 0.918 96.2 30.3 -56.8 -49.7 2.5 10.6 3.1 19 19 A D T 4 S+ 0 0 84 121,-0.5 -1,-0.1 118,-0.4 119,-0.1 0.952 127.6 34.1 -83.4 -52.2 4.4 9.1 0.2 20 20 A T T 4 S- 0 0 30 100,-0.3 -2,-0.1 2,-0.1 -1,-0.1 0.796 89.1-139.0 -74.3 -28.1 5.9 5.8 1.5 21 21 A G < + 0 0 23 -4,-1.4 2,-0.1 1,-0.3 -3,-0.1 0.558 55.9 138.0 76.0 8.4 2.9 5.0 3.8 22 22 A Y - 0 0 48 16,-0.1 -5,-3.0 -6,-0.1 2,-0.3 -0.446 43.9-139.3 -80.2 159.6 5.4 3.7 6.4 23 23 A V E -DE 16 37A 3 14,-2.6 14,-2.1 -7,-0.2 2,-0.3 -0.859 14.5-112.9-117.0 157.3 5.0 4.5 10.1 24 24 A I E - E 0 36A 0 -9,-1.8 -9,-0.3 -2,-0.3 2,-0.3 -0.632 28.9-165.9 -82.1 141.2 7.5 5.5 12.8 25 25 A Y E - E 0 35A 16 10,-2.5 10,-1.3 -2,-0.3 2,-0.4 -0.924 7.5-164.1-119.9 159.5 8.2 3.1 15.6 26 26 A S E + E 0 34A 0 18,-2.4 2,-0.2 -2,-0.3 8,-0.2 -0.936 21.4 162.0-143.8 112.6 10.0 3.9 18.9 27 27 A R - 0 0 74 6,-2.7 56,-0.1 -2,-0.4 3,-0.0 -0.736 41.2-127.4-130.6 175.0 11.2 1.0 21.0 28 28 A T S S+ 0 0 61 -2,-0.2 2,-0.3 1,-0.1 5,-0.1 0.595 83.6 44.6-105.1 -12.9 13.7 0.3 23.8 29 29 A E S S+ 0 0 137 1,-0.2 -1,-0.1 4,-0.1 -2,-0.0 -0.960 90.1 33.3-136.6 154.3 15.8 -2.6 22.5 30 30 A N S S- 0 0 112 -2,-0.3 -1,-0.2 -3,-0.0 -3,-0.1 0.971 91.4 -82.6 71.5 90.5 17.5 -3.7 19.2 31 31 A P S S+ 0 0 115 0, 0.0 2,-0.1 0, 0.0 4,-0.0 -0.312 111.8 60.6 -58.4 145.0 18.9 -0.7 17.3 32 32 A P - 0 0 57 0, 0.0 -3,-0.1 0, 0.0 3,-0.1 0.355 66.2-179.4 -77.1 131.5 17.7 1.2 15.4 33 33 A L S S+ 0 0 43 1,-0.2 -6,-2.7 48,-0.1 2,-0.4 0.764 75.9 37.2 -72.4 -26.4 15.4 2.1 18.3 34 34 A V E S+E 26 0A 3 47,-0.4 2,-0.3 -8,-0.2 -8,-0.2 -0.997 83.1 121.9-125.4 126.4 13.5 4.7 16.1 35 35 A W E -E 25 0A 80 -10,-1.3 -10,-2.5 -2,-0.4 2,-0.3 -0.899 56.7 -80.4-161.4-173.7 12.9 3.8 12.5 36 36 A Q E -E 24 0A 16 -2,-0.3 2,-0.3 -12,-0.2 -12,-0.2 -0.735 37.2-164.5-104.7 157.6 10.2 3.3 9.9 37 37 A Y E -E 23 0A 76 -14,-2.1 -14,-2.6 -2,-0.3 2,-0.6 -0.999 18.4-162.1-147.7 138.1 8.0 0.2 9.4 38 38 A N + 0 0 117 -2,-0.3 -16,-0.1 -16,-0.2 -2,-0.0 -0.931 62.7 60.4-118.1 100.6 5.8 -1.2 6.8 39 39 A G S S- 0 0 42 -2,-0.6 3,-0.1 1,-0.0 -2,-0.1 -0.972 84.6 -11.4 173.3-161.2 3.5 -3.8 8.4 40 40 A P S S- 0 0 63 0, 0.0 2,-0.3 0, 0.0 -1,-0.0 -0.099 74.4 -89.8 -61.3 157.9 0.9 -4.6 11.0 41 41 A P + 0 0 95 0, 0.0 2,-0.3 0, 0.0 3,-0.0 -0.540 50.6 176.9 -67.9 131.6 -0.1 -2.1 13.7 42 42 A Y > - 0 0 122 -2,-0.3 3,-1.8 -3,-0.1 4,-0.1 -0.950 40.6-114.7-133.4 155.4 2.0 -2.5 16.9 43 43 A D G > S+ 0 0 109 -2,-0.3 3,-2.1 1,-0.3 22,-0.3 0.777 109.5 69.0 -62.6 -29.0 2.0 -0.5 20.1 44 44 A D G 3 S+ 0 0 44 1,-0.3 -18,-2.4 21,-0.1 -1,-0.3 0.517 92.7 61.6 -70.9 -1.2 5.5 0.8 19.6 45 45 A Q G < S+ 0 0 3 -3,-1.8 2,-0.4 -20,-0.2 -30,-0.4 0.385 85.8 101.3 -95.5 -1.2 4.1 2.8 16.7 46 46 A L < + 0 0 11 -3,-2.1 19,-2.6 -32,-0.1 2,-0.3 -0.734 47.1 169.0 -95.2 133.6 1.8 4.7 19.1 47 47 A F E -BF 13 64A 0 -34,-2.5 -34,-1.8 -2,-0.4 2,-0.3 -0.903 19.1-164.1-132.5 159.7 2.6 8.2 20.3 48 48 A T E - F 0 63A 27 15,-2.1 15,-2.8 -2,-0.3 2,-0.4 -0.878 26.2-115.2-130.0 171.5 1.1 11.1 22.1 49 49 A L E - F 0 62A 3 -38,-0.4 -39,-0.7 -41,-0.3 2,-0.6 -0.872 6.3-150.2-107.9 139.9 2.2 14.7 22.4 50 50 A I E - F 0 61A 35 11,-2.3 11,-2.1 -2,-0.4 2,-0.5 -0.960 31.0-130.9 -96.6 122.7 3.4 16.7 25.3 51 51 A Y E - F 0 60A 72 -2,-0.6 9,-0.2 9,-0.2 2,-0.1 -0.645 15.0-134.9 -79.1 123.3 2.4 20.3 24.6 52 52 A G - 0 0 12 7,-2.7 6,-0.5 -2,-0.5 2,-0.3 -0.483 25.1-170.1 -70.5 147.5 5.2 22.9 25.0 53 53 A T > + 0 0 111 4,-0.2 3,-2.5 -2,-0.1 4,-0.1 -0.875 50.1 2.2-132.1 167.5 4.3 26.0 26.8 54 54 A G G > S+ 0 0 27 1,-0.3 3,-2.0 -2,-0.3 -2,-0.0 -0.387 140.5 8.5 60.3-121.5 6.0 29.4 27.4 55 55 A P G 3 S+ 0 0 55 0, 0.0 -1,-0.3 0, 0.0 -3,-0.1 0.775 137.1 52.6 -60.8 -24.3 9.3 29.3 25.6 56 56 A R G X S+ 0 0 47 -3,-2.5 3,-2.4 -5,-0.1 -4,-0.3 0.212 74.9 142.3-100.2 15.6 8.2 26.0 24.0 57 57 A K T < S+ 0 0 102 -3,-2.0 -4,-0.2 1,-0.3 3,-0.1 -0.360 74.3 20.2 -54.1 131.1 4.8 27.3 22.7 58 58 A N T 3 S+ 0 0 33 -6,-0.5 39,-0.4 1,-0.3 2,-0.3 0.455 108.5 100.3 77.0 8.7 4.2 25.7 19.3 59 59 A L < - 0 0 4 -3,-2.4 -7,-2.7 37,-0.1 -1,-0.3 -0.831 51.7-168.9-116.0 161.1 6.6 22.9 20.1 60 60 A Y E -FG 51 95A 20 35,-1.9 35,-2.9 -2,-0.3 2,-0.4 -0.994 20.9-131.3-147.7 145.1 5.8 19.4 21.2 61 61 A A E -F 50 0A 0 -11,-2.1 -11,-2.3 -2,-0.3 2,-0.7 -0.844 23.0-138.2 -96.9 141.5 7.5 16.3 22.6 62 62 A I E -F 49 0A 0 31,-0.4 9,-2.0 -2,-0.4 2,-0.5 -0.884 26.5-167.6-107.0 106.3 6.6 13.1 20.8 63 63 A K E -FH 48 70A 45 -15,-2.8 -15,-2.1 -2,-0.7 7,-0.2 -0.827 19.5-121.9-110.8 128.1 6.2 10.4 23.5 64 64 A S E > -F 47 0A 3 5,-3.1 4,-1.5 -2,-0.5 -17,-0.3 -0.432 12.4-147.2 -65.0 132.8 5.9 6.7 23.1 65 65 A V T 4 S+ 0 0 55 -19,-2.6 -1,-0.1 -22,-0.3 -18,-0.1 0.974 94.6 37.6 -62.9 -57.1 2.8 5.1 24.5 66 66 A P T 4 S+ 0 0 69 0, 0.0 -1,-0.2 0, 0.0 -22,-0.1 0.832 133.1 21.3 -70.2 -29.5 4.3 1.7 25.5 67 67 A N T 4 S- 0 0 47 -41,-0.2 -2,-0.2 2,-0.1 3,-0.1 0.543 87.6-132.4-121.1 -8.9 7.7 2.9 26.8 68 68 A G < + 0 0 21 -4,-1.5 18,-0.2 1,-0.2 2,-0.1 0.392 56.9 136.4 79.0 -4.4 7.4 6.6 27.6 69 69 A R - 0 0 71 16,-0.1 -5,-3.1 -6,-0.1 2,-0.3 -0.434 46.1-136.0 -75.5 153.1 10.5 7.7 25.8 70 70 A V E -HI 63 84A 0 14,-3.0 14,-1.9 -7,-0.2 -7,-0.2 -0.783 20.4-108.2-106.5 153.7 10.4 10.9 23.7 71 71 A L E - I 0 83A 1 -9,-2.0 2,-0.3 -2,-0.3 -9,-0.3 -0.413 30.1-168.3 -73.6 152.9 11.9 11.3 20.2 72 72 A F E - I 0 82A 20 10,-2.3 10,-1.8 -2,-0.1 2,-0.4 -0.966 8.2-163.6-134.8 157.4 15.0 13.4 19.5 73 73 A S E + I 0 81A 0 19,-1.4 41,-0.3 -2,-0.3 2,-0.3 -0.950 24.5 152.2-142.3 117.8 16.6 14.6 16.2 74 74 A R - 0 0 60 6,-2.8 56,-0.1 -2,-0.4 40,-0.1 -0.866 40.1-149.5-139.7 169.7 20.2 15.8 16.1 75 75 A T S S+ 0 0 83 -2,-0.3 5,-0.1 3,-0.0 3,-0.1 0.418 81.3 80.7-120.2 -0.3 23.1 16.1 13.7 76 76 A S S S- 0 0 104 1,-0.2 2,-0.3 4,-0.1 4,-0.1 0.688 101.2 -2.0 -85.3 -21.5 26.0 15.8 16.2 77 77 A A S S- 0 0 41 2,-0.1 -3,-0.2 3,-0.1 -1,-0.2 -0.987 85.1 -55.9-163.9 162.6 26.1 12.0 16.6 78 78 A S S S+ 0 0 87 -2,-0.3 2,-0.1 2,-0.1 -3,-0.0 -0.778 107.3 47.8 -95.9 140.8 24.6 8.7 15.7 79 79 A P S S- 0 0 78 0, 0.0 -2,-0.1 0, 0.0 3,-0.1 0.470 71.7-170.9 -74.2 145.5 21.9 7.7 16.0 80 80 A Y S S+ 0 0 113 1,-0.2 -6,-2.8 -2,-0.1 2,-0.5 0.874 79.8 33.7 -71.6 -39.9 20.7 11.0 14.4 81 81 A V E S+I 73 0A 13 -8,-0.2 -47,-0.4 -47,-0.2 2,-0.2 -0.977 86.9 123.0-117.0 127.7 17.1 10.2 15.3 82 82 A G E -I 72 0A 3 -10,-1.8 -10,-2.3 -2,-0.5 2,-0.3 -0.816 48.6 -95.8-158.0-162.2 16.4 8.3 18.4 83 83 A N E -I 71 0A 15 -12,-0.3 2,-0.3 -2,-0.2 -12,-0.2 -0.912 23.5-175.6-136.0 163.6 14.6 8.2 21.8 84 84 A I E -I 70 0A 54 -14,-1.9 -14,-3.0 -2,-0.3 4,-0.1 -0.988 30.7-102.5-156.0 146.0 15.4 9.1 25.4 85 85 A A S S+ 0 0 64 -2,-0.3 4,-0.3 -16,-0.3 2,-0.2 -0.234 75.9 53.8 -68.8 164.5 13.5 8.8 28.7 86 86 A G S S- 0 0 30 -18,-0.2 -2,-0.1 1,-0.1 0, 0.0 -0.631 94.4 -74.0 110.2-168.9 11.9 11.8 30.3 87 87 A D S S- 0 0 101 -2,-0.2 -1,-0.1 -18,-0.1 -26,-0.1 -0.112 99.9 -50.7-120.0 32.1 9.3 14.4 29.2 88 88 A G S S+ 0 0 6 -3,-0.2 5,-0.1 -4,-0.1 -2,-0.1 0.839 71.8 165.6 99.8 46.5 11.6 16.5 27.0 89 89 A T + 0 0 92 -4,-0.3 2,-0.3 3,-0.1 -3,-0.1 0.801 62.3 55.6 -58.3 -35.5 14.7 17.2 29.1 90 90 A Y S > S- 0 0 128 1,-0.1 3,-2.1 111,-0.0 4,-0.1 -0.755 84.6-121.5-110.8 151.5 16.8 18.3 26.1 91 91 A N G > S+ 0 0 49 -2,-0.3 3,-1.3 1,-0.3 22,-0.4 0.815 110.7 61.0 -61.7 -30.1 16.2 21.0 23.5 92 92 A D G 3 S+ 0 0 29 1,-0.3 -19,-1.4 21,-0.1 -1,-0.3 0.360 87.9 75.2 -81.4 10.0 16.4 18.5 20.6 93 93 A N G < S+ 0 0 1 -3,-2.1 2,-0.5 -21,-0.2 -31,-0.4 0.320 81.8 89.0 -90.3 3.2 13.4 16.6 22.2 94 94 A W < - 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