==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-FEB-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR BINDING PROTEIN 28-JUL-11 3ZW0 . COMPND 2 MOLECULE: BAMBL LECTIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BURKHOLDERIA AMBIFARIA; . AUTHOR A.AUDFRAY,J.CLAUDINON,S.ABOUNIT,N.RUVOEN-CLOUET,G.LARSON,M.W . 261 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11555.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 157 60.2 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 . 135 51.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 1.1 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 . 13 5.0 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 . 19 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 9 3.4 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+4), SAME NUMBER PER 100 RESIDUES . 3 1.1 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 . 0 2 3 0 1 1 9 0 3 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 5 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 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 M 0 0 58 0, 0.0 2,-0.3 0, 0.0 19,-0.2 0.000 360.0 360.0 360.0 150.7 -11.7 -11.1 -19.2 2 2 A Q E -A 19 0A 21 17,-2.1 17,-3.6 219,-0.1 2,-0.3 -0.999 360.0-159.9-150.6 148.0 -11.2 -7.5 -17.8 3 3 A T E -A 18 0A 4 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.842 12.1-157.8-131.8 163.5 -13.1 -5.1 -15.7 4 4 A A E -A 17 0A 8 13,-2.0 13,-2.8 -2,-0.3 2,-0.4 -0.981 17.5-159.2-133.4 140.8 -13.5 -1.5 -14.7 5 5 A A E +A 16 0A 15 -2,-0.3 2,-0.3 219,-0.3 219,-0.2 -0.984 12.6 172.7-128.4 136.1 -15.1 -0.4 -11.5 6 6 A I E -A 15 0A 8 9,-2.4 9,-2.4 -2,-0.4 2,-0.3 -0.938 3.4-179.4-132.3 160.4 -16.7 3.0 -10.4 7 7 A S E -A 14 0A 21 -2,-0.3 2,-0.3 7,-0.2 7,-0.2 -0.983 2.0-178.8-155.5 156.6 -18.6 4.2 -7.4 8 8 A W E > +A 13 0A 35 5,-1.9 5,-2.5 -2,-0.3 3,-0.2 -0.986 43.6 24.9-153.3 159.3 -20.3 7.3 -6.1 9 9 A G T 5S- 0 0 41 -2,-0.3 219,-0.2 3,-0.2 43,-0.0 -0.246 86.2 -78.7 80.3-172.4 -22.1 8.6 -3.1 10 10 A T T 5S+ 0 0 117 2,-0.1 -1,-0.2 217,-0.1 217,-0.1 0.580 124.4 46.0-106.7 -16.6 -22.1 7.4 0.4 11 11 A T T 5S- 0 0 94 -3,-0.2 -2,-0.1 19,-0.0 2,-0.1 0.935 115.8-127.8 -63.5 -50.0 -24.3 4.3 0.1 12 12 A P T 5 - 0 0 3 0, 0.0 2,-0.4 0, 0.0 -3,-0.2 0.707 30.3-150.2-102.0 177.1 -22.6 3.8 -2.4 13 13 A S E < -A 8 0A 20 -5,-2.5 -5,-1.9 17,-0.1 2,-0.4 -0.855 25.0-170.2 -87.2 144.5 -23.7 3.1 -5.9 14 14 A I E -AB 7 29A 2 15,-2.6 15,-2.5 -2,-0.4 2,-0.4 -0.992 11.9-168.0-134.0 142.3 -21.2 0.8 -7.7 15 15 A R E -AB 6 28A 26 -9,-2.4 -9,-2.4 -2,-0.4 2,-0.5 -0.999 2.6-166.2-129.9 136.7 -20.9 -0.1 -11.4 16 16 A V E -AB 5 27A 0 11,-2.7 11,-2.4 -2,-0.4 2,-0.5 -0.987 5.3-161.0-122.6 119.7 -18.7 -2.9 -12.7 17 17 A Y E -AB 4 26A 0 -13,-2.8 -13,-2.0 -2,-0.5 2,-0.5 -0.879 8.5-163.6-100.7 129.5 -18.0 -3.1 -16.5 18 18 A T E -AB 3 25A 11 7,-2.7 7,-2.2 -2,-0.5 2,-0.7 -0.974 11.2-158.6-122.1 123.3 -16.8 -6.5 -17.7 19 19 A A E +AB 2 24A 3 -17,-3.6 -17,-2.1 -2,-0.5 2,-0.4 -0.915 30.1 156.9 -98.0 117.5 -15.1 -7.0 -21.1 20 20 A N E > - B 0 23A 91 3,-2.9 3,-1.2 -2,-0.7 23,-0.1 -0.974 64.0 -6.3-145.9 121.1 -15.5 -10.7 -21.9 21 21 A G T 3 S- 0 0 68 -2,-0.4 23,-0.1 1,-0.3 3,-0.1 0.886 129.7 -52.7 64.4 36.7 -15.4 -12.3 -25.4 22 22 A N T 3 S+ 0 0 114 1,-0.2 21,-1.9 21,-0.1 2,-0.4 0.573 119.7 102.5 71.6 12.7 -15.4 -8.9 -27.2 23 23 A K E < -BC 20 42A 135 -3,-1.2 -3,-2.9 19,-0.3 2,-0.5 -0.977 58.2-149.8-124.1 143.7 -18.4 -7.6 -25.3 24 24 A I E +BC 19 41A 0 17,-3.1 17,-1.6 -2,-0.4 2,-0.3 -0.949 21.9 174.1-111.6 128.4 -18.7 -5.2 -22.4 25 25 A T E -BC 18 40A 29 -7,-2.2 -7,-2.7 -2,-0.5 2,-0.4 -0.770 19.6-129.6-126.0 172.2 -21.6 -5.6 -20.0 26 26 A E E -B 17 0A 8 13,-0.6 11,-2.5 11,-0.3 2,-0.4 -0.982 11.6-167.0-135.2 135.1 -22.5 -3.9 -16.7 27 27 A R E -BC 16 36A 26 -11,-2.4 -11,-2.7 -2,-0.4 2,-0.4 -0.942 19.6-156.6-121.3 147.8 -23.5 -5.0 -13.2 28 28 A C E -BC 15 35A 2 7,-2.6 7,-2.6 -2,-0.4 2,-0.4 -0.939 18.2-175.8-136.7 140.5 -24.9 -2.6 -10.8 29 29 A Y E +BC 14 34A 55 -15,-2.5 -15,-2.6 -2,-0.4 5,-0.1 -0.997 11.7 164.8-135.8 131.1 -25.3 -2.0 -7.1 30 30 A D S S- 0 0 64 3,-0.5 -17,-0.1 -2,-0.4 4,-0.1 0.098 80.5 -57.0-129.7 20.5 -27.2 0.8 -5.4 31 31 A G S S+ 0 0 37 1,-0.1 3,-0.1 2,-0.1 -18,-0.1 0.237 121.9 33.2 130.5 -17.3 -27.6 -0.5 -1.9 32 32 A S S S+ 0 0 94 1,-0.5 2,-0.2 0, 0.0 -1,-0.1 0.320 106.9 11.2-127.9 -96.4 -29.3 -3.9 -2.0 33 33 A N - 0 0 98 -3,-0.1 -3,-0.5 1,-0.0 -1,-0.5 -0.546 67.4-115.9 -92.1 152.9 -29.0 -6.5 -4.8 34 34 A W E +C 29 0A 28 -2,-0.2 2,-0.3 225,-0.2 -5,-0.2 -0.699 43.2 178.6 -75.7 136.4 -26.6 -6.6 -7.7 35 35 A Y E -C 28 0A 81 -7,-2.6 -7,-2.6 -2,-0.3 2,-0.4 -0.938 31.8 -93.3-138.7 166.4 -28.5 -6.3 -11.0 36 36 A T E -C 27 0A 76 -2,-0.3 -9,-0.2 -9,-0.2 2,-0.1 -0.667 38.9-143.6 -87.9 129.3 -27.8 -6.1 -14.8 37 37 A G E - 0 0 17 -11,-2.5 -11,-0.3 -2,-0.4 -1,-0.1 -0.313 20.4-115.6 -82.4 168.4 -27.4 -2.8 -16.3 38 38 A A E S+ 0 0 68 -2,-0.1 2,-0.3 -13,-0.1 41,-0.1 0.563 77.6 114.7 -78.7 -13.1 -28.4 -1.5 -19.7 39 39 A F E + 0 0 2 39,-0.0 -13,-0.6 33,-0.0 2,-0.3 -0.453 32.7 152.8 -66.2 124.3 -24.8 -0.9 -20.9 40 40 A N E +C 25 0A 108 -2,-0.3 2,-0.3 -15,-0.2 -15,-0.2 -0.832 9.0 134.4-155.5 114.8 -23.9 -3.2 -23.7 41 41 A Q E -C 24 0A 61 -17,-1.6 -17,-3.1 -2,-0.3 2,-0.1 -0.972 53.3 -83.7-151.1 165.3 -21.3 -2.5 -26.4 42 42 A A E +C 23 0A 60 -2,-0.3 -19,-0.3 -19,-0.2 2,-0.2 -0.371 61.5 122.7 -72.2 150.9 -18.4 -4.1 -28.1 43 43 A G - 0 0 0 -21,-1.9 22,-0.3 20,-0.1 -23,-0.2 -0.665 48.0-154.7 162.4 144.4 -14.9 -4.1 -26.6 44 44 A D S S+ 0 0 66 20,-2.8 2,-0.3 1,-0.2 21,-0.2 0.490 93.2 36.7-102.9 -11.5 -12.0 -6.2 -25.4 45 45 A N E -D 64 0B 11 19,-1.6 19,-2.8 -23,-0.1 2,-0.3 -0.990 69.1-172.3-139.4 148.1 -10.8 -3.6 -22.9 46 46 A V E +D 63 0B 1 -2,-0.3 2,-0.3 17,-0.2 17,-0.2 -0.998 11.9 171.9-144.5 139.3 -12.8 -1.1 -20.7 47 47 A S E -D 62 0B 8 15,-1.5 15,-3.0 -2,-0.3 2,-0.3 -0.934 15.1-174.0-132.8 160.7 -12.2 1.8 -18.4 48 48 A A E -D 61 0B 13 -2,-0.3 45,-0.3 45,-0.2 2,-0.3 -0.997 11.8-178.4-152.0 157.5 -14.7 4.1 -16.8 49 49 A T E -D 60 0B 15 11,-2.3 11,-2.8 -2,-0.3 2,-0.3 -0.966 9.2-171.5-147.8 163.7 -15.2 7.2 -14.7 50 50 A C E -D 59 0B 23 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.986 7.4-173.0-154.6 162.5 -18.1 9.1 -13.3 51 51 A W E -D 58 0B 23 7,-2.2 7,-2.8 -2,-0.3 2,-0.5 -0.951 24.4-116.3-150.6 164.9 -19.2 12.3 -11.5 52 52 A L E -D 57 0B 65 -2,-0.3 2,-0.6 5,-0.2 5,-0.2 -0.932 11.0-165.6-108.8 132.6 -22.2 13.8 -9.9 53 53 A S E > S-D 56 0B 52 3,-3.0 3,-2.0 -2,-0.5 2,-0.5 -0.936 79.6 -49.7-109.9 99.5 -24.0 16.9 -11.1 54 54 A G T 3 S- 0 0 74 -2,-0.6 -2,-0.0 1,-0.3 0, 0.0 -0.616 122.9 -27.3 64.3-121.4 -26.1 17.7 -8.1 55 55 A S T 3 S+ 0 0 125 -2,-0.5 2,-0.5 -3,-0.1 -1,-0.3 0.440 119.0 101.2-100.3 -0.3 -27.7 14.2 -7.4 56 56 A A E < -D 53 0B 51 -3,-2.0 -3,-3.0 19,-0.0 2,-0.2 -0.737 65.2-140.1 -95.5 124.6 -27.5 13.1 -11.1 57 57 A V E -D 52 0B 22 -2,-0.5 2,-0.4 -5,-0.2 -5,-0.2 -0.573 11.6-163.9 -84.4 142.5 -24.7 10.7 -12.0 58 58 A H E -D 51 0B 33 -7,-2.8 -7,-2.2 -2,-0.2 2,-0.4 -0.999 10.2-169.3-121.4 131.9 -22.8 11.0 -15.3 59 59 A I E -DE 50 74B 4 15,-2.3 15,-2.7 -2,-0.4 2,-0.4 -0.949 11.7-165.3-124.0 141.4 -20.7 8.1 -16.5 60 60 A R E -DE 49 73B 33 -11,-2.8 -11,-2.3 -2,-0.4 2,-0.4 -0.998 6.9-169.7-121.3 129.4 -18.2 7.7 -19.2 61 61 A V E -DE 48 72B 0 11,-2.6 11,-2.7 -2,-0.4 2,-0.7 -0.976 10.2-153.1-119.3 127.7 -17.1 4.2 -20.4 62 62 A Y E -DE 47 71B 0 -15,-3.0 -15,-1.5 -2,-0.4 2,-0.5 -0.912 14.5-168.6-107.4 107.1 -14.1 3.9 -22.8 63 63 A A E -DE 46 70B 1 7,-2.9 7,-3.0 -2,-0.7 2,-0.5 -0.895 1.5-162.8-103.7 122.4 -14.5 0.7 -24.8 64 64 A T E +DE 45 69B 0 -19,-2.8 -20,-2.8 -2,-0.5 -19,-1.6 -0.921 11.5 179.3-110.7 130.2 -11.5 -0.4 -26.8 65 65 A S E > - 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