==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR BINDING PROTEIN 23-NOV-04 1Y2X . COMPND 2 MOLECULE: LECTIN; . SOURCE 2 ORGANISM_SCIENTIFIC: AGARICUS BISPORUS; . AUTHOR M.E.CARRIZO,S.CAPALDI,M.PERDUCA,F.J.IRAZOQUI,G.A.NORES,H.L.M . 572 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22189.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 420 73.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 36 6.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 220 38.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 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 . 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 . 66 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 48 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 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 0 0 4 4 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 4 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 0 0 0 8 12 0 8 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 2 0 0 0 2 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 T 0 0 109 0, 0.0 2,-0.4 0, 0.0 44,-0.2 0.000 360.0 360.0 360.0 129.1 60.9 -0.5 12.0 2 3 A Y E -A 44 0A 29 42,-2.5 42,-3.1 44,-0.1 2,-0.4 -0.925 360.0-169.0-111.0 142.7 57.4 -1.0 13.5 3 4 A T E -Ab 43 134A 23 130,-2.5 132,-3.0 -2,-0.4 2,-0.4 -0.982 6.8-165.9-124.1 148.2 54.0 -1.1 11.6 4 5 A I E -Ab 42 135A 0 38,-2.0 38,-2.5 -2,-0.4 2,-0.6 -0.977 10.4-158.4-128.5 114.8 50.5 -1.0 13.1 5 6 A S E -Ab 41 136A 24 130,-2.7 132,-2.6 -2,-0.4 2,-0.5 -0.860 10.7-157.7-100.7 121.6 47.8 -2.0 10.7 6 7 A I E -Ab 40 137A 0 34,-3.9 34,-2.2 -2,-0.6 2,-0.5 -0.873 10.8-164.2-110.7 123.5 44.3 -0.7 11.6 7 8 A R E - b 0 138A 34 130,-2.5 132,-3.2 -2,-0.5 2,-0.5 -0.921 17.4-146.3 -99.6 124.4 40.9 -2.1 10.6 8 9 A V E - b 0 139A 30 -2,-0.5 2,-0.5 30,-0.4 132,-0.2 -0.818 13.9-171.9 -97.3 127.4 38.0 0.3 11.1 9 10 A Y E - b 0 140A 2 130,-3.1 132,-3.4 -2,-0.5 2,-0.6 -0.979 8.4-168.3-118.2 118.4 34.6 -1.1 12.1 10 11 A Q E - b 0 141A 15 -2,-0.5 286,-0.3 286,-0.2 132,-0.2 -0.947 10.9-174.6-104.4 111.3 31.6 1.2 12.2 11 12 A T + 0 0 33 130,-2.5 131,-0.1 -2,-0.6 286,-0.1 0.605 55.6 45.3 -89.9 -19.6 29.0 -0.9 13.9 12 13 A T - 0 0 38 129,-0.4 2,-0.6 2,-0.1 -1,-0.1 -0.993 67.7-134.4-134.9 133.9 25.7 1.1 13.9 13 14 A P S S+ 0 0 56 0, 0.0 2,-0.7 0, 0.0 3,-0.0 0.038 73.9 110.9 -73.6 29.7 24.0 3.1 11.1 14 15 A K S S- 0 0 150 -2,-0.6 -2,-0.1 46,-0.0 46,-0.1 -0.924 88.5 -18.6-104.7 109.6 23.3 6.0 13.5 15 16 A G S S- 0 0 11 -2,-0.7 2,-0.3 1,-0.1 42,-0.0 -0.093 77.0-107.3 78.4 172.5 25.6 8.8 12.3 16 17 A F - 0 0 16 -3,-0.0 2,-0.5 2,-0.0 42,-0.4 -0.890 18.7-155.3-146.0 114.4 28.6 8.5 10.1 17 18 A F - 0 0 3 -2,-0.3 40,-0.3 40,-0.2 46,-0.1 -0.752 17.2-174.4 -89.7 126.5 32.3 8.8 11.1 18 19 A R E -L 56 0B 29 38,-2.3 38,-2.0 -2,-0.5 2,-0.3 -0.896 31.4-104.0-119.2 149.5 34.6 9.8 8.3 19 20 A P E +L 55 0B 34 0, 0.0 36,-0.2 0, 0.0 3,-0.1 -0.582 44.9 160.5 -71.6 132.9 38.4 10.1 8.4 20 21 A V E + 0 0 1 34,-2.5 156,-2.0 1,-0.4 2,-0.3 0.514 56.8 18.7-128.1 -13.7 39.5 13.8 8.6 21 22 A E E -L 54 0B 2 33,-1.0 33,-2.0 154,-0.1 -1,-0.4 -0.981 45.2-173.3-163.8 142.9 43.2 13.8 9.8 22 23 A R E -LM 53 165B 10 143,-2.5 143,-2.3 -2,-0.3 2,-0.3 -0.923 17.8-176.2-146.7 121.2 46.3 11.6 10.3 23 24 A T E -L 52 0B 0 29,-2.1 29,-0.9 -2,-0.3 2,-0.4 -0.756 16.8-148.3-119.2 159.2 49.4 12.8 12.1 24 25 A N E -L 51 0B 1 -2,-0.3 209,-0.4 27,-0.2 210,-0.3 -0.990 17.6-135.2-128.5 123.9 52.9 11.5 12.9 25 26 A W - 0 0 15 25,-2.5 25,-0.1 -2,-0.4 207,-0.1 -0.424 21.7-123.9 -72.7 155.8 54.8 12.4 16.1 26 27 A K S S+ 0 0 77 4,-0.1 3,-0.4 -2,-0.1 4,-0.4 0.530 71.7 104.0 -85.2 -10.6 58.4 13.4 15.6 27 28 A Y S > S+ 0 0 108 1,-0.2 3,-1.9 2,-0.2 18,-0.2 -0.147 76.3 23.0 -71.3 168.6 60.3 10.9 17.9 28 29 A A T 3 S- 0 0 35 1,-0.3 17,-0.5 20,-0.1 18,-0.3 0.820 138.4 -51.8 42.1 48.8 62.2 7.8 16.7 29 30 A N T 3 S- 0 0 92 -3,-0.4 -1,-0.3 16,-0.1 -2,-0.2 0.687 91.0-100.0 64.9 24.2 62.8 9.2 13.2 30 31 A G < - 0 0 1 -3,-1.9 15,-1.6 -4,-0.4 16,-0.3 -0.305 42.4-133.1 70.1-148.2 59.1 10.0 12.7 31 32 A G E -C 44 0A 11 13,-0.2 2,-0.3 197,-0.1 13,-0.2 -0.959 7.7-118.6 172.9-179.7 56.8 7.7 10.7 32 33 A T E -C 43 0A 18 11,-2.0 11,-2.4 -2,-0.3 2,-0.4 -0.940 10.5-128.6-141.4 159.9 54.1 7.7 8.0 33 34 A W E +C 42 0A 1 130,-2.4 2,-0.4 -2,-0.3 9,-0.2 -0.946 29.0 179.4-108.6 134.1 50.5 6.8 7.3 34 35 A D E -C 41 0A 4 7,-2.3 7,-3.0 -2,-0.4 2,-0.6 -0.980 28.4-133.6-130.9 147.0 49.5 4.6 4.4 35 36 A E E +C 40 0A 43 -2,-0.4 431,-2.2 5,-0.2 432,-0.5 -0.900 34.0 173.4 -93.9 123.3 46.3 3.2 3.0 36 37 A V E > -CD 39 465A 18 3,-2.5 3,-1.9 -2,-0.6 429,-0.2 -0.964 64.4 -27.1-138.6 113.7 46.9 -0.5 2.3 37 38 A R T 3 S- 0 0 131 427,-1.5 428,-0.1 -2,-0.4 3,-0.1 0.829 125.6 -47.1 49.9 43.4 44.1 -2.9 1.2 38 39 A G T 3 S+ 0 0 42 426,-0.5 -30,-0.4 1,-0.3 2,-0.3 0.558 120.3 107.7 79.0 8.4 41.4 -0.8 3.0 39 40 A E E < S- C 0 36A 27 -3,-1.9 -3,-2.5 -32,-0.1 2,-0.5 -0.828 70.5-122.4-116.1 154.0 43.4 -0.5 6.2 40 41 A Y E -AC 6 35A 34 -34,-2.2 -34,-3.9 -2,-0.3 2,-0.5 -0.861 29.5-163.6 -94.9 128.6 45.3 2.3 7.8 41 42 A V E -AC 5 34A 14 -7,-3.0 -7,-2.3 -2,-0.5 2,-0.6 -0.961 8.4-162.6-122.0 117.9 49.0 1.5 8.3 42 43 A L E -AC 4 33A 0 -38,-2.5 -38,-2.0 -2,-0.5 2,-0.4 -0.873 8.8-166.7 -96.7 118.6 51.3 3.5 10.6 43 44 A T E -AC 3 32A 31 -11,-2.4 -11,-2.0 -2,-0.6 2,-0.4 -0.912 6.6-172.0-106.6 133.3 55.0 2.9 10.0 44 45 A M E -AC 2 31A 2 -42,-3.1 -42,-2.5 -2,-0.4 -13,-0.2 -0.978 31.1-131.2-130.2 140.6 57.5 4.1 12.6 45 46 A G S S- 0 0 38 -15,-1.6 2,-0.3 -17,-0.5 -16,-0.1 0.728 80.6 -47.7 -58.8 -25.8 61.3 4.2 12.5 46 47 A G S > S- 0 0 17 -16,-0.3 3,-0.5 -18,-0.3 24,-0.2 -0.964 86.0 -31.2 176.2-171.2 61.5 2.5 15.9 47 48 A S T 3 S+ 0 0 30 -2,-0.3 24,-0.2 1,-0.2 -19,-0.1 -0.392 103.3 50.4 -67.2 138.4 60.2 2.5 19.5 48 49 A G T 3 S+ 0 0 15 22,-2.4 2,-0.2 1,-0.4 -1,-0.2 0.530 87.7 81.6 116.2 10.2 59.0 5.7 21.1 49 50 A T < - 0 0 2 -3,-0.5 21,-2.0 21,-0.4 -1,-0.4 -0.742 47.0-172.1-134.1-174.6 56.7 7.4 18.7 50 51 A S E - N 0 69B 1 19,-0.2 -25,-2.5 -2,-0.2 2,-0.3 -0.946 13.6-135.7-163.4 174.7 53.0 7.3 17.6 51 52 A G E -LN 24 68B 0 17,-2.7 17,-2.7 -2,-0.3 2,-0.3 -0.990 14.5-144.1-149.2 150.4 50.4 8.5 15.2 52 53 A S E -LN 23 67B 0 -29,-0.9 -29,-2.1 -2,-0.3 2,-0.4 -0.895 3.5-160.5-119.9 144.2 46.8 9.8 15.5 53 54 A L E -LN 22 66B 3 13,-2.7 13,-2.9 -2,-0.3 2,-0.4 -0.983 10.8-157.1-117.8 133.9 43.6 9.4 13.4 54 55 A R E -LN 21 65B 23 -33,-2.0 -34,-2.5 -2,-0.4 -33,-1.0 -0.933 7.7-170.5-112.3 135.8 40.7 11.8 13.8 55 56 A F E -LN 19 64B 5 9,-2.3 9,-1.9 -2,-0.4 2,-0.4 -0.969 1.8-164.9-124.8 142.4 37.2 10.9 12.8 56 57 A V E -LN 18 63B 24 -38,-2.0 -38,-2.3 -2,-0.4 2,-0.6 -0.990 14.9-164.6-129.6 131.0 34.1 13.2 12.6 57 58 A S E >>> + N 0 62B 0 5,-3.2 5,-2.3 -2,-0.4 3,-0.6 -0.915 12.3 178.5-107.5 98.0 30.4 12.4 12.4 58 59 A S T 345S+ 0 0 86 -2,-0.6 3,-0.2 -42,-0.4 -1,-0.1 0.769 75.2 67.2 -73.4 -25.9 29.0 15.8 11.3 59 60 A D T 345S+ 0 0 99 -43,-0.3 -1,-0.2 1,-0.2 -44,-0.1 0.834 118.5 22.2 -53.2 -39.4 25.5 14.3 11.2 60 61 A T T <45S- 0 0 42 -3,-0.6 -1,-0.2 2,-0.1 -2,-0.2 0.273 106.5-115.5-119.7 6.2 25.5 13.9 15.0 61 62 A D T <5 + 0 0 139 -4,-0.6 2,-0.3 1,-0.2 -3,-0.2 0.881 69.9 137.1 57.7 42.4 28.2 16.5 16.0 62 63 A E E < +N 57 0B 11 -5,-2.3 -5,-3.2 20,-0.0 2,-0.3 -0.850 22.6 159.9-118.3 156.2 30.5 13.7 17.3 63 64 A S E -N 56 0B 27 -2,-0.3 19,-0.5 -7,-0.2 20,-0.3 -0.976 11.4-174.6-162.7 164.0 34.3 13.1 17.0 64 65 A F E -NO 55 81B 0 -9,-1.9 -9,-2.3 -2,-0.3 2,-0.5 -0.972 19.2-137.1-160.4 157.8 37.3 11.3 18.4 65 66 A V E -NO 54 80B 0 15,-2.8 15,-2.6 -2,-0.3 2,-0.5 -0.991 17.4-163.6-117.8 125.8 41.0 11.0 18.1 66 67 A A E -NO 53 79B 0 -13,-2.9 -13,-2.7 -2,-0.5 2,-0.4 -0.943 8.5-161.7-108.1 128.9 42.6 7.5 18.3 67 68 A T E -NO 52 78B 0 11,-3.0 11,-1.8 -2,-0.5 2,-0.4 -0.909 8.0-175.3-117.7 140.0 46.3 7.3 18.9 68 69 A F E +NO 51 77B 0 -17,-2.7 -17,-2.7 -2,-0.4 2,-0.3 -0.986 19.6 128.0-133.7 139.9 48.6 4.3 18.2 69 70 A G E -NO 50 76B 0 7,-1.8 7,-2.3 -2,-0.4 2,-0.4 -0.946 49.4 -97.6-166.2-171.9 52.3 3.9 19.0 70 71 A V E - O 0 75B 1 -21,-2.0 -22,-2.4 -2,-0.3 2,-0.5 -0.996 29.0-173.7-128.7 125.0 55.1 1.9 20.5 71 72 A H E > S- O 0 74B 15 3,-3.2 3,-1.3 -2,-0.4 -24,-0.0 -0.984 73.5 -16.5-121.8 123.3 56.4 2.7 24.0 72 73 A N T 3 S- 0 0 61 -2,-0.5 -1,-0.2 1,-0.2 3,-0.1 0.889 129.2 -51.4 46.3 48.2 59.5 0.9 25.3 73 74 A Y T 3 S+ 0 0 177 1,-0.2 2,-0.4 -3,-0.1 -1,-0.2 0.563 121.7 99.0 72.2 13.1 59.2 -1.9 22.7 74 75 A K E < S-O 71 0B 104 -3,-1.3 -3,-3.2 57,-0.1 -1,-0.2 -0.982 75.3-109.9-129.3 142.6 55.5 -2.6 23.5 75 76 A R E -O 70 0B 20 55,-0.5 2,-0.3 -2,-0.4 -5,-0.3 -0.292 34.7-175.4 -67.5 150.9 52.4 -1.3 21.6 76 77 A W E -O 69 0B 0 -7,-2.3 -7,-1.8 33,-0.2 2,-0.3 -0.934 6.3-175.7-141.3 166.3 50.0 1.3 23.1 77 78 A C E +O 68 0B 0 28,-0.4 33,-0.3 -2,-0.3 2,-0.3 -0.981 3.0 177.4-159.2 153.3 46.7 3.0 22.2 78 79 A D E -O 67 0B 12 -11,-1.8 -11,-3.0 -2,-0.3 2,-0.4 -0.982 15.0-147.4-155.7 155.2 44.4 5.6 23.5 79 80 A I E -O 66 0B 6 -2,-0.3 2,-0.4 -13,-0.2 -13,-0.2 -0.989 8.8-169.2-124.7 137.0 41.1 7.4 22.5 80 81 A V E +O 65 0B 14 -15,-2.6 -15,-2.8 -2,-0.4 2,-0.2 -0.996 17.7 160.7-122.6 130.3 40.1 11.0 23.2 81 82 A T E +O 64 0B 17 -2,-0.4 -17,-0.2 -17,-0.2 3,-0.1 -0.593 46.4 66.6-133.1-163.6 36.6 12.2 22.6 82 83 A N S S- 0 0 101 -19,-0.5 -1,-0.1 -2,-0.2 -18,-0.1 0.906 79.9-169.5 45.9 44.5 34.3 15.1 23.7 83 84 A L - 0 0 27 -20,-0.3 -1,-0.2 -3,-0.1 2,-0.1 -0.365 20.0-132.5 -69.0 138.5 36.7 17.1 21.7 84 85 A T > - 0 0 74 -3,-0.1 3,-1.8 -2,-0.1 -1,-0.1 -0.388 34.4-103.0 -73.2 165.5 36.8 20.9 21.7 85 86 A N T 3 S+ 0 0 104 1,-0.3 89,-0.1 -2,-0.1 -1,-0.1 0.764 124.4 56.9 -61.2 -24.8 37.0 22.7 18.3 86 87 A E T 3 S+ 0 0 86 1,-0.2 2,-1.2 87,-0.1 -1,-0.3 0.482 83.8 91.8 -83.5 -7.3 40.6 23.3 19.1 87 88 A Q < + 0 0 40 -3,-1.8 -1,-0.2 4,-0.1 2,-0.1 -0.572 51.1 159.3 -98.0 74.1 41.5 19.6 19.6 88 89 A T > - 0 0 1 -2,-1.2 4,-2.4 79,-0.2 5,-0.2 -0.311 59.5-100.8 -77.1 171.6 42.6 18.4 16.2 89 90 A A H > S+ 0 0 0 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.891 124.6 62.4 -62.0 -36.9 44.7 15.2 15.9 90 91 A L H > S+ 0 0 0 77,-0.3 4,-1.0 1,-0.2 -1,-0.2 0.923 109.7 39.2 -47.2 -51.6 47.7 17.6 15.5 91 92 A V H > S+ 0 0 20 76,-0.3 4,-1.0 2,-0.2 3,-0.3 0.943 117.9 47.0 -67.1 -51.5 47.1 18.9 19.0 92 93 A I H >X S+ 0 0 0 -4,-2.4 3,-0.8 1,-0.2 4,-0.6 0.903 104.9 58.8 -61.4 -47.6 46.2 15.6 20.7 93 94 A N H >< S+ 0 0 0 -4,-2.9 3,-0.8 1,-0.3 -1,-0.2 0.844 106.6 49.2 -50.7 -42.8 49.1 13.6 19.3 94 95 A Q H >< S+ 0 0 46 -4,-1.0 3,-1.9 -3,-0.3 -1,-0.3 0.777 94.9 71.9 -67.9 -32.7 51.6 15.9 20.9 95 96 A E H XX S+ 0 0 47 -4,-1.0 4,-2.0 -3,-0.8 3,-0.7 0.691 81.8 73.3 -64.3 -17.6 50.0 15.8 24.3 96 97 A Y T << S+ 0 0 0 -3,-0.8 -1,-0.3 -4,-0.6 -2,-0.1 0.455 94.6 54.6 -74.9 -1.4 51.2 12.2 24.8 97 98 A Y T <4 S+ 0 0 42 -3,-1.9 -1,-0.3 9,-0.0 -2,-0.1 -0.355 127.3 6.4-128.0 53.0 54.7 13.6 25.3 98 99 A G T <4 S+ 0 0 54 -3,-0.7 -2,-0.2 1,-0.3 -3,-0.1 0.101 99.7 92.8 168.0 -37.6 54.2 16.1 28.1 99 100 A V X - 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