==== 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 1Y2V . 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 . 286 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12851.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 204 71.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 6.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 108 37.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 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 . 31 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 25 8.7 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 2 2 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 2 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 . 1 0 0 0 4 6 0 4 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 2 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 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 0 118 0, 0.0 2,-0.3 0, 0.0 44,-0.2 0.000 360.0 360.0 360.0 121.8 41.8 44.3 31.9 2 3 A Y E -A 44 0A 35 42,-2.1 42,-2.7 44,-0.2 2,-0.4 -0.881 360.0-163.9-109.0 144.9 45.2 42.5 32.0 3 4 A T E -Ab 43 134A 25 130,-3.1 132,-2.4 -2,-0.3 2,-0.5 -0.984 3.1-165.5-118.7 144.3 46.8 40.0 29.6 4 5 A I E -Ab 42 135A 0 38,-2.5 38,-2.8 -2,-0.4 2,-0.5 -0.974 11.4-160.6-122.1 113.5 49.7 37.7 30.5 5 6 A S E -Ab 41 136A 18 130,-2.6 132,-2.7 -2,-0.5 2,-0.5 -0.857 9.3-159.9 -99.6 124.4 51.2 36.2 27.3 6 7 A I E -Ab 40 137A 0 34,-3.1 34,-2.4 -2,-0.5 2,-0.5 -0.899 12.1-164.2-118.0 127.8 53.3 33.1 27.9 7 8 A R E - b 0 138A 114 130,-2.3 132,-3.3 -2,-0.5 2,-0.5 -0.925 17.9-143.7-105.6 127.9 55.9 31.5 25.7 8 9 A V E - b 0 139A 47 -2,-0.5 2,-0.5 30,-0.4 132,-0.2 -0.815 13.8-170.4-100.0 128.2 56.9 27.9 26.5 9 10 A Y E - b 0 140A 104 130,-3.2 132,-3.6 -2,-0.5 2,-0.7 -0.975 7.8-168.2-117.5 120.9 60.5 26.8 26.2 10 11 A Q E - b 0 141A 64 -2,-0.5 132,-0.1 130,-0.2 130,-0.1 -0.946 11.4-174.5-108.1 109.6 61.3 23.1 26.5 11 12 A T + 0 0 82 130,-2.6 131,-0.1 -2,-0.7 -1,-0.1 0.614 57.3 45.2 -93.6 -17.1 65.1 23.1 26.7 12 13 A T - 0 0 42 129,-0.3 -1,-0.1 2,-0.2 129,-0.0 -0.996 69.0-135.2-129.3 135.5 66.2 19.5 26.7 13 14 A P S S+ 0 0 136 0, 0.0 2,-0.7 0, 0.0 -2,-0.0 0.140 76.1 112.5 -70.4 23.3 65.0 16.6 24.4 14 15 A K S S- 0 0 159 46,-0.0 -2,-0.2 45,-0.0 46,-0.1 -0.882 86.3 -16.6-102.1 108.5 64.7 14.5 27.6 15 16 A G S S- 0 0 18 -2,-0.7 2,-0.3 1,-0.1 -3,-0.0 -0.126 77.0-112.3 79.8 170.4 61.1 13.8 28.2 16 17 A F - 0 0 128 -2,-0.0 2,-0.4 2,-0.0 42,-0.4 -0.879 19.1-157.1-147.0 113.5 58.2 15.7 26.6 17 18 A F - 0 0 4 -2,-0.3 40,-0.3 40,-0.2 46,-0.1 -0.772 15.2-174.2 -91.4 129.9 55.9 18.0 28.5 18 19 A R E -F 56 0B 57 38,-2.3 38,-2.3 -2,-0.4 2,-0.2 -0.914 31.9-100.0-123.0 149.2 52.5 18.6 26.8 19 20 A P E +F 55 0B 48 0, 0.0 36,-0.2 0, 0.0 3,-0.1 -0.485 44.7 161.9 -68.4 137.5 49.7 20.9 27.8 20 21 A V E + 0 0 0 34,-2.5 156,-2.0 1,-0.4 2,-0.3 0.476 57.0 13.8-132.7 -10.6 46.8 19.2 29.7 21 22 A E E -F 54 0B 4 33,-1.0 33,-2.2 154,-0.1 -1,-0.4 -0.961 46.1-170.6-169.1 143.1 44.8 21.8 31.5 22 23 A R E -FG 53 165B 10 143,-2.4 143,-2.3 -2,-0.3 2,-0.3 -0.930 18.0-174.7-146.6 122.6 44.2 25.5 31.8 23 24 A T E -F 52 0B 0 29,-2.1 29,-1.3 -2,-0.3 2,-0.4 -0.789 15.6-147.5-122.3 157.5 42.1 27.1 34.5 24 25 A N E -F 51 0B 1 -2,-0.3 209,-0.4 27,-0.2 210,-0.3 -0.993 17.0-133.8-126.5 126.6 40.7 30.5 35.5 25 26 A W - 0 0 13 25,-2.7 207,-0.1 -2,-0.4 24,-0.0 -0.408 19.4-127.3 -73.4 156.4 40.2 31.8 39.1 26 27 A K S S+ 0 0 79 4,-0.1 3,-0.4 -2,-0.1 4,-0.4 0.578 71.3 101.2 -89.9 -14.3 36.8 33.5 39.8 27 28 A Y S > S+ 0 0 109 1,-0.2 3,-1.6 2,-0.2 18,-0.3 -0.191 77.4 25.2 -68.9 164.1 37.9 36.8 41.4 28 29 A A T 3 S- 0 0 32 1,-0.3 17,-0.4 20,-0.1 -1,-0.2 0.828 139.5 -51.8 51.1 42.5 38.0 40.2 39.5 29 30 A N T 3 S- 0 0 90 -3,-0.4 -1,-0.3 16,-0.1 -2,-0.2 0.690 92.2-102.0 67.1 22.5 35.4 39.1 37.0 30 31 A G < - 0 0 0 -3,-1.6 15,-1.9 -4,-0.4 16,-0.3 -0.276 41.9-124.4 72.0-149.6 37.3 35.9 36.1 31 32 A G E -C 44 0A 12 13,-0.2 2,-0.3 197,-0.2 13,-0.2 -0.973 8.3-123.3-179.9 178.4 39.4 35.5 33.1 32 33 A T E -C 43 0A 19 11,-2.2 11,-2.7 -2,-0.3 2,-0.4 -0.930 11.2-132.7-138.2 159.2 40.0 33.4 29.9 33 34 A W E +C 42 0A 0 130,-2.0 2,-0.3 -2,-0.3 9,-0.2 -0.981 28.0 176.9-111.0 130.8 42.8 31.4 28.2 34 35 A D E -C 41 0A 31 7,-2.5 7,-3.8 -2,-0.4 2,-0.6 -0.972 28.8-132.5-126.4 148.2 43.5 32.0 24.5 35 36 A E E +C 40 0A 104 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.892 33.5 175.5 -92.8 123.8 46.1 30.6 22.2 36 37 A V E > -C 39 0A 45 3,-2.4 3,-2.0 -2,-0.6 -2,-0.0 -0.958 63.0 -27.2-137.0 114.4 47.5 33.5 20.2 37 38 A R T 3 S- 0 0 230 -2,-0.4 3,-0.1 1,-0.3 -1,-0.1 0.851 126.5 -46.3 50.7 42.9 50.4 33.2 17.7 38 39 A G T 3 S+ 0 0 77 1,-0.3 -30,-0.4 -31,-0.0 -1,-0.3 0.457 119.3 106.0 84.1 2.7 51.8 30.2 19.5 39 40 A E E < S- C 0 36A 35 -3,-2.0 -3,-2.4 -32,-0.1 2,-0.6 -0.772 71.4-120.6-114.0 155.1 51.5 31.7 23.0 40 41 A Y E -AC 6 35A 33 -34,-2.4 -34,-3.1 -2,-0.3 2,-0.6 -0.869 31.0-161.4 -93.9 123.7 49.2 31.0 25.9 41 42 A V E -AC 5 34A 13 -7,-3.8 -7,-2.5 -2,-0.6 2,-0.6 -0.922 7.7-163.6-115.3 116.2 47.3 34.2 26.7 42 43 A L E -AC 4 33A 0 -38,-2.8 -38,-2.5 -2,-0.6 2,-0.4 -0.864 9.0-166.6 -95.2 122.1 45.6 34.7 30.1 43 44 A T E -AC 3 32A 33 -11,-2.7 -11,-2.2 -2,-0.6 2,-0.4 -0.941 5.9-171.7-111.4 131.8 43.1 37.6 30.1 44 45 A M E -AC 2 31A 2 -42,-2.7 -42,-2.1 -2,-0.4 -13,-0.2 -0.959 29.7-132.6-129.7 143.9 41.7 38.8 33.4 45 46 A G S S- 0 0 34 -15,-1.9 2,-0.3 -17,-0.4 -16,-0.1 0.512 80.7 -40.4 -72.5 -6.2 39.0 41.3 34.3 46 47 A G S S- 0 0 17 -16,-0.3 3,-0.5 -19,-0.1 2,-0.2 -0.970 85.8 -41.3 171.8-170.7 41.1 43.2 36.8 47 48 A S S S+ 0 0 26 -2,-0.3 24,-0.2 1,-0.2 -19,-0.1 -0.567 103.5 52.7 -77.3 141.2 43.7 42.8 39.5 48 49 A G S S+ 0 0 16 22,-2.5 2,-0.2 1,-0.4 -1,-0.2 0.541 88.5 80.9 113.8 10.8 43.3 40.0 42.1 49 50 A T - 0 0 1 -3,-0.5 21,-1.8 21,-0.4 -1,-0.4 -0.702 48.4-171.8-133.4-171.7 42.9 36.8 40.0 50 51 A S E - H 0 69B 1 19,-0.2 -25,-2.7 -2,-0.2 2,-0.3 -0.952 13.4-137.6-166.5 172.8 45.0 34.3 38.2 51 52 A G E -FH 24 68B 0 17,-2.2 17,-2.3 -2,-0.3 2,-0.3 -0.979 16.0-143.4-147.7 154.2 45.0 31.3 35.9 52 53 A S E -FH 23 67B 0 -29,-1.3 -29,-2.1 -2,-0.3 2,-0.4 -0.896 4.2-158.6-123.0 148.3 47.0 28.0 35.8 53 54 A L E -FH 22 66B 3 13,-2.7 13,-2.9 -2,-0.3 2,-0.4 -0.987 9.7-157.8-119.5 134.5 48.5 25.8 33.2 54 55 A R E -FH 21 65B 22 -33,-2.2 -34,-2.5 -2,-0.4 -33,-1.0 -0.931 8.2-172.1-109.5 138.7 49.4 22.1 33.8 55 56 A F E -FH 19 64B 5 9,-2.2 9,-1.8 -2,-0.4 2,-0.4 -0.980 3.7-163.1-127.0 141.4 51.9 20.2 31.7 56 57 A V E -FH 18 63B 24 -38,-2.3 -38,-2.3 -2,-0.4 2,-0.6 -0.988 15.6-162.1-128.9 134.6 52.6 16.5 31.8 57 58 A S E >>> + H 0 62B 0 5,-3.2 5,-2.0 -2,-0.4 4,-0.6 -0.896 11.8 178.1-107.7 95.9 55.5 14.4 30.6 58 59 A S T 345S+ 0 0 88 -2,-0.6 3,-0.3 -42,-0.4 -1,-0.1 0.785 77.1 66.2 -67.8 -28.7 54.1 10.9 30.5 59 60 A D T 345S+ 0 0 133 -43,-0.4 -1,-0.2 1,-0.2 -44,-0.1 0.859 119.8 19.8 -54.9 -40.8 57.5 9.6 29.2 60 61 A T T <45S- 0 0 42 -3,-0.6 -1,-0.2 2,-0.1 -2,-0.2 0.229 105.1-116.1-119.7 9.2 59.2 10.5 32.5 61 62 A D T <5 + 0 0 128 -4,-0.6 2,-0.3 -3,-0.3 -3,-0.2 0.895 69.1 137.3 47.5 50.2 56.2 10.7 34.9 62 63 A E E < +H 57 0B 10 -5,-2.0 -5,-3.2 20,-0.0 2,-0.3 -0.893 22.9 162.8-119.5 152.9 56.8 14.4 35.5 63 64 A S E -H 56 0B 25 -2,-0.3 19,-0.6 -7,-0.2 20,-0.4 -0.980 10.2-176.0-159.8 162.5 54.3 17.2 35.8 64 65 A F E -HI 55 81B 0 -9,-1.8 -9,-2.2 -2,-0.3 2,-0.5 -0.976 19.7-137.3-158.8 154.5 53.9 20.8 37.0 65 66 A V E -HI 54 80B 0 15,-2.9 15,-2.5 -2,-0.3 2,-0.5 -0.981 17.3-162.4-114.2 126.3 51.4 23.6 37.4 66 67 A A E -HI 53 79B 0 -13,-2.9 -13,-2.7 -2,-0.5 2,-0.4 -0.946 8.7-164.8-107.5 128.9 52.4 27.1 36.5 67 68 A T E -HI 52 78B 0 11,-2.9 11,-2.0 -2,-0.5 2,-0.3 -0.937 8.0-178.1-120.7 138.4 50.2 29.9 37.9 68 69 A F E +HI 51 77B 0 -17,-2.3 -17,-2.2 -2,-0.4 2,-0.3 -0.986 18.9 130.1-133.2 141.4 50.2 33.6 36.7 69 70 A G E -HI 50 76B 0 7,-1.9 7,-2.6 -2,-0.3 2,-0.4 -0.943 49.7 -98.1-169.2-173.8 48.1 36.5 38.1 70 71 A V E - I 0 75B 1 -21,-1.8 -22,-2.5 -2,-0.3 2,-0.5 -0.998 29.2-173.0-127.6 124.3 48.0 40.0 39.3 71 72 A H E > S- I 0 74B 13 3,-3.4 3,-1.7 -2,-0.4 -2,-0.0 -0.987 75.1 -15.7-119.9 124.8 47.9 40.7 43.1 72 73 A N T 3 S- 0 0 74 -2,-0.5 -1,-0.2 1,-0.3 3,-0.1 0.899 130.0 -52.3 44.8 48.8 47.4 44.3 44.3 73 74 A Y T 3 S+ 0 0 184 1,-0.2 2,-0.4 -3,-0.1 -1,-0.3 0.578 121.1 101.9 67.0 15.5 48.2 45.6 40.8 74 75 A K E < S-I 71 0B 102 -3,-1.7 -3,-3.4 57,-0.1 -1,-0.2 -0.993 74.4-113.7-126.6 138.9 51.5 43.7 40.5 75 76 A R E -I 70 0B 29 55,-0.4 2,-0.3 -2,-0.4 -5,-0.3 -0.239 34.8-175.2 -64.7 151.9 52.1 40.4 38.6 76 77 A W E -I 69 0B 0 -7,-2.6 -7,-1.9 33,-0.2 2,-0.3 -0.949 6.3-174.7-140.5 164.7 52.8 37.2 40.4 77 78 A C E +I 68 0B 1 28,-0.3 33,-0.3 -2,-0.3 2,-0.3 -0.989 4.6 177.3-153.2 160.5 53.7 33.7 39.5 78 79 A D E -I 67 0B 10 -11,-2.0 -11,-2.9 -2,-0.3 2,-0.4 -0.976 14.1-150.2-154.8 159.4 54.4 30.3 41.1 79 80 A I E -I 66 0B 3 -2,-0.3 2,-0.4 -13,-0.2 -13,-0.2 -0.999 7.6-167.6-129.9 136.2 55.1 26.7 40.0 80 81 A V E +I 65 0B 15 -15,-2.5 -15,-2.9 -2,-0.4 2,-0.2 -0.994 17.0 164.4-118.4 129.7 54.1 23.6 41.9 81 82 A T E +I 64 0B 13 -2,-0.4 -17,-0.2 -17,-0.2 3,-0.1 -0.568 48.2 68.3-125.9-164.0 55.7 20.3 40.9 82 83 A N S S- 0 0 94 -19,-0.6 -1,-0.1 -2,-0.2 -18,-0.1 0.884 79.3-170.9 53.2 38.8 56.0 16.8 42.5 83 84 A L - 0 0 24 -20,-0.4 2,-0.2 -3,-0.1 -1,-0.2 -0.298 21.1-139.7 -66.8 140.0 52.2 16.7 41.8 84 85 A T > - 0 0 70 -3,-0.1 3,-1.7 1,-0.1 -1,-0.1 -0.515 34.7-104.7 -80.4 164.1 50.0 14.0 43.2 85 86 A N T 3 S+ 0 0 93 1,-0.3 89,-0.2 -2,-0.2 103,-0.1 0.744 123.8 58.9 -61.7 -22.8 47.3 12.7 40.8 86 87 A E T 3 S+ 0 0 84 1,-0.2 2,-1.0 87,-0.1 -1,-0.3 0.475 85.6 86.3 -83.7 -4.6 44.8 14.7 42.9 87 88 A Q < + 0 0 42 -3,-1.7 -1,-0.2 4,-0.1 2,-0.1 -0.577 56.2 158.4-101.1 72.0 46.7 17.9 42.2 88 89 A T > - 0 0 1 -2,-1.0 4,-2.5 79,-0.1 5,-0.2 -0.330 59.4-101.2 -77.6 171.4 45.2 19.1 38.9 89 90 A A H > S+ 0 0 0 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.842 124.0 62.3 -64.1 -33.0 45.4 22.8 37.9 90 91 A L H > S+ 0 0 0 77,-0.4 4,-1.0 2,-0.2 -1,-0.2 0.929 110.2 39.6 -53.5 -48.3 41.8 23.2 39.1 91 92 A V H > S+ 0 0 16 76,-0.3 4,-1.0 2,-0.2 3,-0.4 0.961 118.2 46.1 -66.7 -53.1 42.9 22.2 42.6 92 93 A I H >X S+ 0 0 0 -4,-2.5 4,-0.6 1,-0.2 3,-0.5 0.866 106.3 57.9 -64.1 -43.8 46.2 24.2 42.6 93 94 A N H >< S+ 0 0 0 -4,-3.0 3,-0.8 1,-0.2 -1,-0.2 0.886 107.9 48.1 -50.2 -44.8 44.8 27.4 41.1 94 95 A Q H >< S+ 0 0 38 -4,-1.0 3,-1.9 -3,-0.4 -1,-0.2 0.744 95.5 72.1 -71.5 -27.0 42.3 27.7 44.0 95 96 A E H XX S+ 0 0 47 -4,-1.0 4,-2.1 -3,-0.5 3,-0.6 0.742 82.5 71.4 -66.2 -20.6 44.9 27.0 46.7 96 97 A Y T << S+ 0 0 0 -3,-0.8 -1,-0.3 -4,-0.6 -2,-0.1 0.442 96.5 55.3 -73.3 1.4 46.4 30.5 46.1 97 98 A Y T <4 S+ 0 0 37 -3,-1.9 -1,-0.3 9,-0.0 -2,-0.1 -0.440 126.6 5.0-131.3 58.8 43.2 31.9 47.8 98 99 A G T <4 S+ 0 0 54 -3,-0.6 -2,-0.2 1,-0.3 -3,-0.1 0.168 98.7 95.5 156.5 -29.3 43.2 30.2 51.2 99 100 A V >X - 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