==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR BINDING PROTEIN 29-JUN-10 3AJZ . COMPND 2 MOLECULE: ANCESTRAL CONGERIN CON-ANC; . SOURCE 2 SYNTHETIC: YES; . AUTHOR A.KONNO,A.KITAGAWA,M.WATANABE,T.OGAWA,T.SHIRAI . 132 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6932.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 96 72.7 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 . 66 50.0 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 . 1 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 2.3 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 . 17 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 8 6.1 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 . 0 0.0 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 1 1 1 2 3 1 1 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 1 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 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 G 0 0 99 0, 0.0 120,-0.1 0, 0.0 124,-0.1 0.000 360.0 360.0 360.0 170.4 6.1 -31.0 -19.6 2 2 A V - 0 0 69 117,-0.1 118,-2.2 1,-0.0 2,-0.4 -0.318 360.0-161.2 -60.0 132.4 4.3 -34.0 -18.3 3 3 A E E -A 119 0A 93 116,-0.2 2,-0.6 -2,-0.0 116,-0.2 -0.985 6.5-160.7-114.9 131.8 1.0 -34.9 -20.0 4 4 A V E -A 118 0A 35 114,-3.3 114,-2.2 -2,-0.4 3,-0.3 -0.958 24.6-177.7-110.4 113.3 -1.5 -37.2 -18.3 5 5 A K E +A 117 0A 111 -2,-0.6 112,-0.2 112,-0.2 -2,-0.0 -0.712 50.3 31.0-116.5 160.1 -3.9 -38.5 -21.0 6 6 A N E S+ 0 0 139 110,-1.0 111,-0.2 -2,-0.2 -1,-0.2 0.790 77.6 153.0 60.9 30.1 -7.1 -40.7 -21.2 7 7 A I E - 0 0 21 109,-1.9 2,-0.5 -3,-0.3 -1,-0.2 -0.464 44.3-141.0 -77.8 156.6 -8.1 -39.6 -17.7 8 8 A T E + 0 0 103 -2,-0.1 2,-0.9 123,-0.1 108,-0.2 -0.801 28.5 172.0-119.3 85.6 -11.8 -39.7 -16.8 9 9 A F E -A 115 0A 0 106,-2.4 106,-2.1 -2,-0.5 2,-0.2 -0.846 17.1-175.7-101.2 98.9 -12.2 -36.5 -14.8 10 10 A K E > -A 114 0A 127 -2,-0.9 3,-2.5 104,-0.2 104,-0.2 -0.492 35.2 -68.7-102.1 162.7 -15.9 -36.1 -14.3 11 11 A L T 3 S+ 0 0 68 102,-1.9 -1,-0.2 1,-0.3 79,-0.2 -0.202 121.3 16.7 -46.4 124.7 -18.3 -33.6 -12.7 12 12 A G T 3 S+ 0 0 51 77,-1.3 -1,-0.3 1,-0.3 78,-0.1 0.196 97.8 115.4 96.1 -18.5 -17.8 -33.6 -9.0 13 13 A M < - 0 0 41 -3,-2.5 2,-0.4 76,-0.1 76,-0.4 -0.264 61.2-123.2 -76.3 171.5 -14.4 -35.4 -8.9 14 14 A Y - 0 0 130 74,-0.1 118,-1.9 -3,-0.1 2,-0.5 -0.977 16.2-164.4-123.8 128.9 -11.1 -33.8 -7.7 15 15 A L E -GH 87 131B 0 72,-2.4 72,-2.7 -2,-0.4 2,-0.5 -0.960 9.6-169.3-112.0 118.8 -7.9 -33.4 -9.7 16 16 A T E -GH 86 130B 12 114,-2.7 114,-2.2 -2,-0.5 2,-0.4 -0.929 2.1-171.1-109.8 135.2 -4.8 -32.6 -7.6 17 17 A V E -GH 85 129B 1 68,-2.6 68,-2.5 -2,-0.5 2,-0.3 -0.995 5.9-179.0-128.3 126.9 -1.5 -31.6 -9.3 18 18 A G E +GH 84 128B 1 110,-2.8 109,-2.7 -2,-0.4 110,-2.0 -0.906 15.7 128.0-122.4 152.5 1.7 -31.2 -7.4 19 19 A G E -GH 83 126B 1 64,-2.2 64,-2.4 -2,-0.3 2,-0.4 -0.957 49.7 -86.8-173.6-166.6 5.2 -30.2 -8.5 20 20 A V E -GH 82 125B 17 105,-2.3 105,-2.3 -2,-0.3 62,-0.3 -0.996 32.1-130.9-127.6 127.9 8.2 -28.0 -7.9 21 21 A V E - H 0 124B 2 60,-2.7 59,-0.4 -2,-0.4 103,-0.3 -0.560 36.4-105.1 -73.6 137.2 8.6 -24.6 -9.5 22 22 A N > - 0 0 72 101,-2.6 58,-0.9 -2,-0.3 3,-0.5 -0.312 26.4-117.7 -57.8 149.7 12.0 -24.1 -11.2 23 23 A S T 3 S+ 0 0 85 1,-0.3 2,-0.5 56,-0.3 -1,-0.1 0.821 111.9 37.3 -57.6 -33.8 14.5 -22.0 -9.2 24 24 A N T 3 S+ 0 0 154 56,-0.0 2,-0.4 55,-0.0 -1,-0.3 -0.711 88.9 162.8-124.3 77.6 14.6 -19.4 -12.0 25 25 A A < - 0 0 15 -3,-0.5 3,-0.1 -2,-0.5 54,-0.1 -0.786 34.7-179.8-104.5 140.5 11.1 -19.3 -13.3 26 26 A N S S- 0 0 97 1,-0.4 22,-2.3 -2,-0.4 21,-1.6 0.793 75.9 -39.3 -88.5 -48.5 9.2 -16.8 -15.4 27 27 A R E -B 46 0A 74 19,-0.2 96,-2.9 20,-0.2 -1,-0.4 -0.985 47.6-157.7-167.6 158.8 5.9 -18.8 -15.4 28 28 A F E -BC 45 122A 0 17,-1.4 17,-3.2 -2,-0.3 2,-0.3 -0.984 15.3-149.7-144.1 154.3 4.4 -22.3 -15.5 29 29 A S E -BC 44 121A 7 92,-2.7 92,-2.1 -2,-0.3 2,-0.4 -0.904 13.1-147.9-126.1 151.3 0.9 -23.5 -16.4 30 30 A I E -BC 43 120A 1 13,-1.9 13,-2.7 -2,-0.3 2,-0.5 -0.946 23.5-167.5-106.2 134.9 -1.6 -26.2 -15.7 31 31 A N E -BC 42 119A 2 88,-2.0 88,-2.5 -2,-0.4 2,-0.4 -0.972 7.6-178.6-134.6 114.3 -3.8 -27.1 -18.7 32 32 A V E +BC 41 118A 0 9,-2.7 9,-2.0 -2,-0.5 8,-1.4 -0.903 20.9 135.1-114.1 138.7 -6.9 -29.2 -18.5 33 33 A G E - C 0 117A 0 84,-2.2 83,-1.9 -2,-0.4 84,-1.8 -0.955 48.1-135.5-168.1-173.3 -9.0 -30.2 -21.5 34 34 A E S S+ 0 0 58 -2,-0.3 2,-0.3 1,-0.2 5,-0.1 0.419 80.0 49.7-141.0 -2.2 -11.0 -32.7 -23.5 35 35 A S S > S- 0 0 46 3,-0.3 3,-1.6 82,-0.1 -1,-0.2 -0.989 81.8-107.7-144.8 156.7 -10.0 -32.2 -27.2 36 36 A T T 3 S+ 0 0 132 -2,-0.3 -1,-0.1 1,-0.3 -3,-0.0 0.743 110.6 31.6 -60.6 -36.2 -6.8 -32.0 -29.1 37 37 A D T 3 S+ 0 0 79 26,-0.0 27,-3.0 2,-0.0 2,-0.3 0.150 111.2 75.9-108.8 27.9 -6.5 -28.3 -30.1 38 38 A S < - 0 0 20 -3,-1.6 2,-0.4 25,-0.2 -3,-0.3 -0.901 55.2-160.1-134.5 156.0 -8.3 -26.9 -27.1 39 39 A I E - D 0 61A 6 22,-2.3 22,-2.8 -2,-0.3 -6,-0.2 -0.965 3.0-167.1-137.5 117.6 -7.6 -26.2 -23.5 40 40 A A E S+ 0 0 14 -8,-1.4 2,-0.4 -2,-0.4 69,-0.4 0.857 82.2 21.2 -72.6 -37.9 -10.7 -25.8 -21.3 41 41 A L E +B 32 0A 0 -9,-2.0 -9,-2.7 67,-0.1 2,-0.5 -0.952 64.8 179.3-140.8 114.0 -8.8 -24.4 -18.3 42 42 A H E -BD 31 59A 12 17,-2.7 17,-2.1 -2,-0.4 2,-0.6 -0.982 5.8-171.8-112.9 121.5 -5.3 -22.8 -18.6 43 43 A I E -BD 30 58A 0 -13,-2.7 -13,-1.9 -2,-0.5 2,-0.7 -0.948 5.7-167.9-118.1 106.4 -3.9 -21.5 -15.3 44 44 A D E -BD 29 57A 1 13,-3.1 13,-2.7 -2,-0.6 2,-1.0 -0.870 8.6-157.1-103.1 114.9 -0.7 -19.5 -16.0 45 45 A H E -BD 28 56A 0 -17,-3.2 -17,-1.4 -2,-0.7 2,-0.9 -0.778 15.8-165.5 -94.3 98.8 1.2 -18.8 -12.9 46 46 A R E +BD 27 55A 18 9,-2.5 9,-2.2 -2,-1.0 -19,-0.2 -0.768 26.7 167.9 -96.9 101.1 3.3 -15.7 -13.9 47 47 A F E S- 0 0 21 -21,-1.6 7,-1.8 -2,-0.9 2,-0.3 0.946 89.8 -15.4 -63.9 -51.8 6.2 -14.8 -11.6 48 48 A S E S+ D 0 53A 56 -22,-2.3 -1,-0.3 5,-0.2 2,-0.3 -0.830 86.9 134.5-156.1 115.3 7.3 -12.5 -14.4 49 49 A Y E > - D 0 52A 99 3,-2.4 3,-2.3 -2,-0.3 -3,-0.1 -0.892 69.8 -30.2-160.5 131.1 6.0 -12.6 -17.9 50 50 A G T 3 S- 0 0 74 -2,-0.3 -1,-0.1 1,-0.3 0, 0.0 -0.359 125.6 -25.2 59.7-133.5 4.8 -9.8 -20.2 51 51 A A T 3 S+ 0 0 108 -3,-0.1 2,-0.5 2,-0.0 -1,-0.3 0.334 118.6 102.5 -92.5 9.5 3.3 -7.0 -18.1 52 52 A D E < +D 49 0A 16 -3,-2.3 -3,-2.4 3,-0.1 2,-0.4 -0.806 44.1 179.7-103.4 129.6 2.5 -9.4 -15.3 53 53 A Q E S-D 48 0A 136 -2,-0.5 -5,-0.2 -5,-0.2 -6,-0.2 -0.996 76.3 -14.0-124.2 132.0 4.3 -9.9 -12.0 54 54 A N E S+ 0 0 84 -7,-1.8 2,-0.4 -2,-0.4 -7,-0.2 0.899 101.9 134.2 43.7 56.7 3.1 -12.4 -9.5 55 55 A T E -D 46 0A 1 -9,-2.2 -9,-2.5 -3,-0.1 2,-0.6 -0.986 55.0-135.2-134.1 141.0 -0.2 -12.8 -11.2 56 56 A I E -DE 45 72A 1 16,-2.9 16,-2.3 -2,-0.4 2,-0.5 -0.868 20.5-162.7 -92.3 127.1 -2.3 -15.8 -12.2 57 57 A V E -DE 44 71A 1 -13,-2.7 -13,-3.1 -2,-0.6 2,-0.4 -0.959 7.0-165.8-109.3 122.9 -3.6 -15.4 -15.7 58 58 A L E +DE 43 70A 2 12,-3.1 12,-2.2 -2,-0.5 2,-0.3 -0.867 21.0 139.3-108.5 140.2 -6.5 -17.7 -16.5 59 59 A N E -D 42 0A 3 -17,-2.1 -17,-2.7 -2,-0.4 2,-0.3 -0.943 36.5-128.5-159.6 179.6 -7.8 -18.5 -20.0 60 60 A S E - 0 0 3 -2,-0.3 7,-2.3 -19,-0.2 2,-0.4 -0.934 15.8-141.9-133.3 160.0 -9.2 -21.1 -22.4 61 61 A M E -DF 39 66A 24 -22,-2.8 -22,-2.3 -2,-0.3 2,-0.5 -0.995 9.6-168.7-129.7 130.8 -8.1 -22.1 -25.9 62 62 A V E > S- F 0 65A 69 3,-2.5 3,-2.2 -2,-0.4 -24,-0.2 -0.981 77.1 -20.1-121.7 122.5 -10.5 -23.1 -28.7 63 63 A D T 3 S- 0 0 126 -2,-0.5 -25,-0.2 1,-0.3 -1,-0.2 0.897 130.4 -47.4 43.7 55.0 -8.9 -24.6 -31.8 64 64 A D T 3 S+ 0 0 106 -27,-3.0 2,-0.5 1,-0.1 -1,-0.3 0.466 115.9 113.4 68.2 7.4 -5.5 -23.1 -31.0 65 65 A G E < -F 62 0A 33 -3,-2.2 -3,-2.5 -28,-0.2 -1,-0.1 -0.937 63.2-128.8-112.5 130.1 -6.9 -19.6 -30.2 66 66 A W E -F 61 0A 126 -2,-0.5 -5,-0.2 -5,-0.2 3,-0.1 -0.378 21.9-154.3 -69.5 145.4 -6.8 -17.9 -26.8 67 67 A Q - 0 0 88 -7,-2.3 2,-0.4 1,-0.2 -1,-0.1 0.041 47.0 -37.1-100.0-151.7 -10.1 -16.5 -25.4 68 68 A Q - 0 0 155 1,-0.1 -1,-0.2 -2,-0.1 2,-0.1 -0.621 62.5-129.3 -82.8 127.8 -10.6 -13.7 -22.9 69 69 A E - 0 0 85 -2,-0.4 2,-0.3 -10,-0.1 -10,-0.2 -0.355 18.6-166.8 -71.0 146.4 -8.1 -13.5 -20.0 70 70 A Q E -E 58 0A 76 -12,-2.2 -12,-3.1 -2,-0.1 2,-0.4 -0.941 11.6-151.6-126.3 152.6 -9.0 -13.3 -16.4 71 71 A R E -E 57 0A 117 -2,-0.3 2,-0.4 -14,-0.2 -14,-0.2 -0.942 14.2-169.7-128.4 148.4 -6.5 -12.4 -13.7 72 72 A S E -E 56 0A 19 -16,-2.3 -16,-2.9 -2,-0.4 32,-0.0 -0.998 12.9-159.9-129.5 138.9 -6.0 -13.0 -10.0 73 73 A K + 0 0 148 -2,-0.4 2,-0.8 -18,-0.2 -16,-0.0 0.342 65.2 108.3 -94.3 2.4 -3.4 -11.2 -7.8 74 74 A N + 0 0 62 -18,-0.1 -18,-0.1 1,-0.1 -2,-0.1 -0.762 44.9 168.6 -77.2 114.9 -3.5 -14.1 -5.3 75 75 A F + 0 0 31 -2,-0.8 2,-1.9 -20,-0.1 -1,-0.1 -0.564 14.5 168.7-137.4 67.8 -0.1 -15.6 -5.9 76 76 A P + 0 0 37 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 -0.380 45.5 106.0 -84.1 62.7 0.9 -18.2 -3.2 77 77 A F - 0 0 17 -2,-1.9 2,-0.4 6,-0.1 6,-0.1 -0.971 48.0-161.4-138.4 150.6 3.9 -19.6 -5.1 78 78 A T > - 0 0 93 -2,-0.3 3,-2.0 4,-0.2 -57,-0.3 -0.999 30.0-108.5-135.9 133.7 7.7 -19.3 -4.8 79 79 A A T 3 S+ 0 0 35 -2,-0.4 -56,-0.3 1,-0.3 -57,-0.1 -0.341 105.6 20.2 -57.7 135.6 10.3 -20.1 -7.4 80 80 A G T 3 S+ 0 0 19 -58,-0.9 2,-0.3 -59,-0.4 -1,-0.3 0.298 108.4 103.6 87.1 -4.2 12.3 -23.2 -6.5 81 81 A E S < S- 0 0 109 -3,-2.0 -60,-2.7 -59,-0.2 -1,-0.3 -0.709 73.4 -96.6-118.6 159.8 9.6 -24.5 -4.2 82 82 A H E -G 20 0B 139 -2,-0.3 2,-0.3 -62,-0.3 -62,-0.3 -0.325 37.2-178.5 -66.2 148.3 6.8 -27.1 -4.2 83 83 A F E -G 19 0B 12 -64,-2.4 -64,-2.2 -6,-0.1 2,-0.3 -0.971 11.3-166.1-139.3 161.2 3.2 -26.3 -4.9 84 84 A Q E -G 18 0B 88 -2,-0.3 2,-0.3 -66,-0.2 -66,-0.2 -0.983 7.1-179.1-146.2 136.2 -0.1 -28.2 -5.0 85 85 A I E -G 17 0B 0 -68,-2.5 -68,-2.6 -2,-0.3 2,-0.4 -0.979 11.6-153.3-130.3 148.7 -3.4 -27.1 -6.6 86 86 A T E -GI 16 97B 28 11,-1.8 11,-3.6 -2,-0.3 2,-0.4 -0.981 9.0-162.5-125.2 139.1 -6.7 -28.9 -6.7 87 87 A I E +GI 15 96B 0 -72,-2.7 -72,-2.4 -2,-0.4 2,-0.3 -0.953 14.3 164.6-122.0 135.9 -9.4 -28.4 -9.4 88 88 A T E - 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