==== 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 3AJY . COMPND 2 MOLECULE: ANCESTRAL CONGERIN CON-ANC; . SOURCE 2 SYNTHETIC: YES; . AUTHOR A.KONNO,A.KITAGAWA,M.WATANABE,T.OGAWA,T.SHIRAI . 266 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12479.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 205 77.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 142 53.4 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 . 4 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 3.0 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 . 37 13.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 17 6.4 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 . 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 2 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 4 4 0 4 4 2 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 . 2 0 0 0 0 0 0 0 1 0 0 0 1 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 G 0 0 102 0, 0.0 142,-0.1 0, 0.0 141,-0.1 0.000 360.0 360.0 360.0-168.0 -5.4 4.7 40.4 2 3 A G - 0 0 15 140,-0.1 138,-0.2 138,-0.1 141,-0.2 0.571 360.0 -71.4 70.8 129.4 -7.4 1.4 40.5 3 4 A L E -A 139 0A 2 139,-1.6 136,-2.8 136,-0.8 2,-0.9 -0.253 40.2-144.3 -59.6 124.2 -5.9 -1.5 42.4 4 5 A E E -Ab 138 252A 89 247,-2.8 249,-2.7 134,-0.2 2,-0.9 -0.796 13.4-165.7 -86.9 105.8 -2.9 -3.1 40.8 5 6 A V E > -Ab 137 253A 0 132,-2.8 132,-1.6 -2,-0.9 3,-1.2 -0.824 0.7-166.0 -98.8 104.3 -3.2 -6.9 41.6 6 7 A K T 3 S+ 0 0 92 247,-2.2 130,-0.4 -2,-0.9 -1,-0.2 0.855 80.4 52.3 -57.9 -45.6 0.2 -8.2 40.8 7 8 A N T 3 S+ 0 0 55 246,-0.3 2,-1.4 128,-0.1 -1,-0.3 0.633 80.9 101.6 -69.5 -18.1 -0.6 -12.0 40.7 8 9 A F < + 0 0 0 -3,-1.2 2,-0.9 129,-0.1 128,-0.3 -0.579 44.7 173.6 -79.3 95.7 -3.5 -11.6 38.3 9 10 A D - 0 0 49 -2,-1.4 2,-1.7 126,-0.2 108,-0.1 -0.839 13.6-165.4-101.1 90.6 -2.0 -12.8 35.1 10 11 A F E +N 116 0B 1 -2,-0.9 106,-2.6 106,-0.6 2,-0.2 -0.623 35.1 143.7 -82.1 86.8 -5.1 -12.8 32.8 11 12 A K E > -N 115 0B 92 -2,-1.7 3,-2.4 104,-0.2 79,-0.3 -0.666 59.3 -53.9-121.1 172.2 -3.5 -14.8 30.0 12 13 A V T 3 S+ 0 0 53 102,-1.8 79,-0.2 1,-0.3 -1,-0.1 -0.236 126.7 22.0 -49.8 130.7 -4.7 -17.5 27.6 13 14 A G T 3 S+ 0 0 46 77,-1.1 2,-0.3 1,-0.4 -1,-0.3 0.281 96.9 115.1 90.8 -10.9 -6.4 -20.4 29.6 14 15 A K < - 0 0 77 -3,-2.4 2,-0.5 76,-0.2 76,-0.4 -0.673 59.0-138.0 -89.5 150.3 -7.1 -18.3 32.7 15 16 A F - 0 0 102 -2,-0.3 118,-1.5 74,-0.1 2,-0.6 -0.945 10.8-160.3-114.7 118.9 -10.7 -17.6 33.7 16 17 A L E -OP 88 132C 0 72,-3.1 72,-2.9 -2,-0.5 2,-0.5 -0.893 8.5-173.1-101.0 118.2 -11.8 -14.2 34.8 17 18 A T E -OP 87 131C 17 114,-2.7 114,-3.1 -2,-0.6 2,-0.4 -0.954 0.6-173.2-109.4 124.5 -15.0 -14.0 36.9 18 19 A V E -OP 86 130C 0 68,-2.5 68,-2.5 -2,-0.5 2,-0.3 -0.941 4.6-178.6-113.2 141.8 -16.5 -10.6 37.8 19 20 A G E +OP 85 129C 0 110,-1.8 109,-2.7 -2,-0.4 110,-1.8 -0.938 16.8 123.3-133.6 157.4 -19.4 -10.2 40.1 20 21 A G E -OP 84 127C 0 64,-1.7 64,-2.6 -2,-0.3 2,-0.4 -0.956 52.0 -78.3 177.2-165.2 -21.4 -7.2 41.4 21 22 A V E -OP 83 126C 34 105,-1.4 105,-2.1 -2,-0.3 2,-0.3 -0.993 32.3-130.0-130.5 129.3 -24.8 -5.6 41.7 22 23 A I E - P 0 125C 2 60,-2.4 103,-0.3 -2,-0.4 59,-0.2 -0.587 40.1 -99.9 -75.8 136.4 -26.7 -3.7 39.0 23 24 A N - 0 0 65 101,-2.3 58,-1.7 -2,-0.3 59,-0.2 -0.122 31.8-106.3 -53.7 153.4 -28.0 -0.3 40.1 24 25 A N S S+ 0 0 138 56,-0.2 2,-0.4 57,-0.2 -1,-0.1 0.803 114.9 29.1 -51.1 -34.0 -31.7 -0.0 41.1 25 26 A Y S S+ 0 0 209 55,-0.1 2,-0.3 56,-0.0 -2,-0.1 -0.989 83.2 172.4-127.1 141.4 -32.2 1.8 37.8 26 27 A A + 0 0 23 -2,-0.4 54,-0.1 1,-0.1 3,-0.1 -0.987 32.4 179.6-153.9 134.2 -30.0 1.1 34.9 27 28 A K S S- 0 0 105 1,-0.4 22,-2.3 -2,-0.3 21,-1.5 0.784 80.2 -27.6 -93.5 -43.7 -29.6 1.9 31.3 28 29 A R E -C 47 0A 66 19,-0.3 96,-2.8 20,-0.2 -1,-0.4 -0.974 49.7-160.4-162.2 156.3 -26.5 -0.2 30.7 29 30 A F E -CD 46 123A 0 17,-1.4 17,-3.5 -2,-0.3 2,-0.3 -0.967 15.7-157.1-145.1 150.8 -23.4 -1.6 32.3 30 31 A S E -CD 45 122A 5 92,-2.8 92,-1.8 -2,-0.3 2,-0.4 -0.906 15.9-150.6-128.8 149.3 -20.2 -2.9 30.8 31 32 A I E -CD 44 121A 2 13,-1.7 13,-3.3 -2,-0.3 2,-0.4 -0.977 25.6-168.7-110.5 132.3 -17.3 -5.1 31.5 32 33 A N E +CD 43 120A 9 88,-2.7 88,-1.9 -2,-0.4 2,-0.4 -0.988 10.9 176.8-129.7 127.7 -14.1 -4.0 29.7 33 34 A V E +CD 42 119A 1 9,-2.7 9,-2.2 -2,-0.4 8,-1.7 -0.996 34.5 79.4-132.5 135.5 -10.8 -5.8 29.3 34 35 A G E S-CD 40 118A 1 84,-2.1 84,-1.8 -2,-0.4 83,-1.3 -0.795 89.7 -46.6 177.3-129.6 -7.7 -4.8 27.4 35 36 A E E S- 0 0 111 4,-3.3 2,-0.3 1,-0.4 5,-0.2 0.690 106.3 -25.1-105.4 -32.8 -4.7 -2.5 27.9 36 37 A S E > S-C 39 0A 41 3,-1.5 3,-2.1 82,-0.2 -1,-0.4 -0.957 80.1 -69.2-169.8 173.7 -6.4 0.7 29.3 37 38 A T T 3 S+ 0 0 61 1,-0.3 3,-0.1 -2,-0.3 83,-0.0 0.805 133.2 34.2 -43.7 -39.4 -9.6 2.7 29.4 38 39 A N T 3 S+ 0 0 86 1,-0.2 2,-0.3 24,-0.0 -1,-0.3 0.164 112.6 61.9-109.8 16.8 -9.2 3.6 25.7 39 40 A S E < +C 36 0A 16 -3,-2.1 -4,-3.3 24,-0.1 -3,-1.5 -0.756 67.6 163.9-146.4 92.6 -7.6 0.3 24.4 40 41 A L E -CE 34 62A 4 22,-1.1 22,-2.7 -2,-0.3 -6,-0.3 -0.925 35.7-168.1-125.2 133.7 -9.9 -2.7 24.8 41 42 A S E S+ 0 0 3 -8,-1.7 2,-0.4 -2,-0.4 69,-0.3 0.753 89.8 22.8 -79.8 -32.6 -10.0 -6.1 23.4 42 43 A L E +C 33 0A 1 -9,-2.2 -9,-2.7 67,-0.1 2,-0.5 -0.957 57.3 178.8-143.7 120.6 -13.5 -6.8 24.8 43 44 A H E -CE 32 60A 12 17,-2.3 17,-1.4 -2,-0.4 2,-0.7 -0.990 12.4-168.6-117.1 115.9 -16.2 -4.3 25.8 44 45 A L E -CE 31 59A 0 -13,-3.3 -13,-1.7 -2,-0.5 2,-0.6 -0.868 6.9-173.8-110.9 98.1 -19.2 -6.2 26.9 45 46 A D E -CE 30 58A 1 13,-3.2 13,-3.0 -2,-0.7 2,-0.9 -0.837 11.6-160.3-103.3 116.3 -22.1 -3.7 27.2 46 47 A H E -CE 29 57A 0 -17,-3.5 -17,-1.4 -2,-0.6 2,-0.8 -0.837 14.5-166.2 -98.4 103.4 -25.4 -4.9 28.7 47 48 A R E +CE 28 56A 17 9,-2.7 9,-2.2 -2,-0.9 -19,-0.3 -0.814 24.3 172.0-103.2 105.4 -28.0 -2.5 27.6 48 49 A F E S- 0 0 21 -21,-1.5 7,-1.5 -2,-0.8 2,-0.3 0.920 89.5 -5.8 -65.1 -46.7 -31.3 -2.6 29.3 49 50 A N E S+ E 0 54A 82 -22,-2.3 2,-0.3 5,-0.2 -1,-0.3 -0.793 80.3 141.3-157.4 98.6 -32.3 0.5 27.4 50 51 A Y E > S- E 0 53A 83 3,-2.5 3,-2.1 -2,-0.3 -3,-0.1 -0.866 74.8 -55.9-147.2 107.1 -29.8 2.4 25.3 51 52 A G T 3 S- 0 0 67 -2,-0.3 -1,-0.2 1,-0.3 0, 0.0 -0.311 121.3 -15.9 53.6-134.3 -31.1 3.9 22.0 52 53 A A T 3 S+ 0 0 101 -3,-0.1 2,-0.8 2,-0.0 -1,-0.3 0.572 117.1 102.4 -73.0 -10.4 -32.7 1.2 19.9 53 54 A D E < +E 50 0A 17 -3,-2.1 -3,-2.5 3,-0.1 2,-0.4 -0.681 45.8 172.1 -81.7 106.8 -31.0 -1.4 22.0 54 55 A Q E S-E 49 0A 90 -2,-0.8 -5,-0.2 -5,-0.2 -6,-0.2 -0.967 73.8 -15.6-114.6 131.0 -33.4 -3.0 24.5 55 56 A N E S+ 0 0 87 -7,-1.5 2,-0.4 -2,-0.4 -7,-0.2 0.883 104.4 137.9 39.3 53.5 -32.2 -6.0 26.6 56 57 A T E -E 47 0A 1 -9,-2.2 -9,-2.7 -3,-0.2 2,-0.4 -0.974 51.0-139.4-129.0 138.6 -29.3 -6.3 24.1 57 58 A I E -EF 46 73A 0 16,-3.0 16,-2.0 -2,-0.4 2,-0.5 -0.822 16.8-159.6 -93.9 134.2 -25.6 -7.1 24.7 58 59 A V E -EF 45 72A 0 -13,-3.0 -13,-3.2 -2,-0.4 2,-0.4 -0.981 6.4-168.2-114.8 129.8 -23.3 -5.1 22.6 59 60 A L E +EF 44 71A 4 12,-3.2 12,-2.5 -2,-0.5 2,-0.3 -0.926 21.0 139.9-115.7 143.1 -19.7 -6.4 22.1 60 61 A N E -E 43 0A 2 -17,-1.4 -17,-2.3 -2,-0.4 2,-0.3 -0.975 38.4-125.8-166.5 169.3 -16.9 -4.4 20.6 61 62 A S E - 0 0 0 -2,-0.3 7,-2.4 -19,-0.2 2,-0.4 -0.819 23.3-146.7-121.4 166.3 -13.3 -3.6 20.8 62 63 A M E -EG 40 67A 19 -22,-2.7 -22,-1.1 -2,-0.3 2,-0.3 -0.991 12.4-171.2-139.9 145.2 -11.6 -0.2 21.0 63 64 A V E > - G 0 66A 57 3,-1.9 3,-1.8 -2,-0.4 -24,-0.1 -0.781 48.6 -96.1-122.2 164.0 -8.5 1.5 19.8 64 65 A N T 3 S+ 0 0 132 1,-0.3 3,-0.1 -2,-0.3 -25,-0.1 0.907 125.1 55.2 -49.4 -38.8 -7.3 5.0 20.9 65 66 A S T 3 S- 0 0 123 1,-0.2 -1,-0.3 -3,-0.0 2,-0.2 0.644 122.2 -72.0 -71.9 -21.3 -8.9 6.4 17.7 66 67 A G E < -G 63 0A 28 -3,-1.8 -3,-1.9 -28,-0.2 -1,-0.2 -0.846 62.3 -40.1 150.3 174.8 -12.3 4.9 18.4 67 68 A W E -G 62 0A 125 -2,-0.2 -5,-0.2 -5,-0.2 3,-0.1 -0.277 48.3-145.3 -67.8 151.2 -14.7 2.0 18.6 68 69 A E - 0 0 89 -7,-2.4 2,-0.5 1,-0.2 -1,-0.1 0.057 49.5 -37.4 -99.8-149.0 -14.6 -0.9 16.1 69 70 A T - 0 0 105 1,-0.0 -1,-0.2 -2,-0.0 -8,-0.1 -0.667 63.2-135.0 -84.5 123.2 -17.4 -3.0 14.6 70 71 A E - 0 0 84 -2,-0.5 2,-0.3 -10,-0.1 -10,-0.2 -0.342 14.1-161.1 -72.0 150.5 -20.1 -3.9 17.1 71 72 A Q E -F 59 0A 77 -12,-2.5 -12,-3.2 -2,-0.1 2,-0.3 -0.946 12.6-151.7-125.5 151.6 -21.7 -7.4 17.6 72 73 A R E -F 58 0A 108 -2,-0.3 2,-0.3 -14,-0.2 -14,-0.2 -0.930 13.7-173.6-130.2 150.4 -25.0 -7.9 19.3 73 74 A S E -F 57 0A 20 -16,-2.0 -16,-3.0 -2,-0.3 32,-0.0 -0.999 19.9-155.9-140.9 141.1 -26.8 -10.6 21.2 74 75 A K + 0 0 145 -2,-0.3 2,-0.9 -18,-0.2 -1,-0.1 0.409 63.2 114.7 -94.6 0.4 -30.3 -10.9 22.5 75 76 A N + 0 0 54 -18,-0.1 -2,-0.1 29,-0.1 -18,-0.0 -0.630 41.3 164.2 -65.7 105.7 -29.3 -13.3 25.3 76 77 A F + 0 0 32 -2,-0.9 -1,-0.1 1,-0.1 -2,-0.0 -0.762 19.7 161.0-138.4 89.5 -30.1 -11.1 28.3 77 78 A P + 0 0 45 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.406 48.2 105.6 -88.2 5.6 -30.3 -12.6 31.8 78 79 A F - 0 0 11 6,-0.0 2,-0.3 4,-0.0 6,-0.1 -0.536 43.2-175.0 -96.1 151.5 -29.8 -9.4 33.7 79 80 A S > - 0 0 53 4,-0.2 3,-1.8 -2,-0.2 -57,-0.3 -0.997 37.1 -92.1-139.0 145.4 -32.3 -7.2 35.6 80 81 A A T 3 S+ 0 0 49 -2,-0.3 -56,-0.2 1,-0.2 -57,-0.1 -0.183 110.5 16.3 -49.8 140.1 -32.0 -3.8 37.4 81 82 A G T 3 S+ 0 0 31 -58,-1.7 -1,-0.2 -59,-0.2 2,-0.2 0.401 103.7 113.8 76.2 -0.9 -31.1 -4.1 41.1 82 83 A E S < S- 0 0 116 -3,-1.8 -60,-2.4 -59,-0.2 -1,-0.2 -0.671 72.8 -92.3-105.8 157.3 -29.9 -7.8 40.8 83 84 A Y E -O 21 0C 103 -62,-0.2 2,-0.3 -2,-0.2 -62,-0.2 -0.300 40.4-162.3 -54.8 138.6 -26.6 -9.7 41.2 84 85 A F E -O 20 0C 0 -64,-2.6 -64,-1.7 -6,-0.1 2,-0.3 -0.955 9.7-177.1-122.5 152.5 -24.6 -10.2 38.0 85 86 A E E +O 19 0C 50 -2,-0.3 15,-0.8 -66,-0.2 2,-0.4 -0.962 2.5 177.0-149.3 135.2 -21.9 -12.6 37.3 86 87 A I E -OQ 18 99C 0 -68,-2.5 -68,-2.5 -2,-0.3 2,-0.4 -0.999 11.5-160.7-138.3 136.1 -19.7 -13.1 34.2 87 88 A T E -OQ 17 98C 25 11,-2.3 11,-3.0 -2,-0.4 2,-0.4 -0.981 12.6-174.6-120.2 133.6 -16.8 -15.4 33.4 88 89 A I E +OQ 16 97C 1 -72,-2.9 -72,-3.1 -2,-0.4 2,-0.3 -0.969 10.9 160.5-128.6 136.2 -14.4 -14.7 30.5 89 90 A T E - 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