==== 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 12-NOV-01 1IS3 . COMPND 2 MOLECULE: CONGERIN II; . SOURCE 2 ORGANISM_SCIENTIFIC: CONGER MYRIASTER; . AUTHOR T.SHIRAI,Y.MATSUI,C.SHIONYU-MITSUYAMA,T.YAMANE,H.KAMIYA,C.IS . 134 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6935.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 91 67.9 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 . 70 52.2 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 . 3 2.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 2.2 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 . 10 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 8 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 1 0.7 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 . 1 1 1 1 1 4 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 2 A D 0 0 187 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-136.0 21.6 33.5 37.0 2 3 A R - 0 0 93 1,-0.1 2,-0.6 125,-0.0 121,-0.1 -0.435 360.0-109.9 -85.3 164.7 21.2 30.2 34.9 3 4 A A E +A 122 0A 35 119,-0.9 119,-2.1 -2,-0.1 2,-0.3 -0.779 51.1 166.8 -91.3 126.6 19.6 27.2 36.2 4 5 A E E -A 121 0A 70 -2,-0.6 2,-0.5 117,-0.2 117,-0.2 -0.985 38.3-153.7-146.0 154.6 22.1 24.4 36.8 5 6 A V E -A 120 0A 27 115,-2.4 115,-2.1 -2,-0.3 2,-0.4 -0.998 33.1-172.9-122.6 119.1 22.7 21.1 38.4 6 7 A R E +A 119 0A 112 -2,-0.5 113,-0.2 113,-0.2 112,-0.1 -0.962 52.8 1.1-129.6 134.2 26.4 20.8 39.2 7 8 A N E S+ 0 0 108 111,-2.8 -1,-0.1 -2,-0.4 112,-0.1 0.701 86.1 115.2 63.9 29.6 28.6 17.9 40.5 8 9 A I E S- 0 0 99 110,-0.3 -1,-0.2 -3,-0.1 109,-0.1 -0.926 76.0-123.3-116.7 99.1 25.8 15.4 40.7 9 10 A P E - 0 0 57 0, 0.0 2,-0.9 0, 0.0 109,-0.2 -0.180 15.0-150.7 -54.9 125.1 27.3 13.0 38.1 10 11 A F E -A 117 0A 0 107,-2.9 107,-1.5 4,-0.0 2,-0.2 -0.872 34.8-175.5 -93.7 102.4 24.9 12.2 35.1 11 12 A K E > -A 116 0A 109 -2,-0.9 3,-2.5 105,-0.2 105,-0.2 -0.621 33.6 -70.6-104.7 160.0 26.2 8.8 34.3 12 13 A L T 3 S+ 0 0 79 103,-2.0 -1,-0.1 1,-0.3 80,-0.1 -0.199 121.1 19.9 -43.9 119.8 25.6 6.1 31.7 13 14 A G T 3 S+ 0 0 54 78,-1.1 -1,-0.3 1,-0.4 2,-0.2 0.352 96.2 114.5 97.1 -10.1 22.2 4.6 32.3 14 15 A M < - 0 0 37 -3,-2.5 77,-0.4 77,-0.1 2,-0.4 -0.538 58.2-134.4 -84.4 163.5 20.7 7.4 34.4 15 16 A Y - 0 0 142 -2,-0.2 119,-2.0 75,-0.1 2,-0.5 -0.954 10.1-158.8-121.4 138.9 17.8 9.5 33.2 16 17 A L E -GH 89 133B 0 73,-2.5 73,-2.6 -2,-0.4 2,-0.5 -0.980 10.7-178.3-113.7 120.5 17.5 13.3 33.3 17 18 A T E -GH 88 132B 8 115,-2.9 115,-2.5 -2,-0.5 2,-0.4 -0.991 4.0-179.9-120.6 125.5 14.0 14.8 33.1 18 19 A V E -GH 87 131B 3 69,-2.5 69,-2.4 -2,-0.5 2,-0.3 -0.942 6.3-167.1-121.3 145.1 13.7 18.6 33.2 19 20 A G E +GH 86 130B 0 111,-2.0 110,-2.9 -2,-0.4 111,-1.4 -0.953 21.5 136.9-127.3 151.5 10.5 20.6 33.1 20 21 A G E -GH 85 128B 1 65,-2.1 65,-2.1 -2,-0.3 2,-0.4 -0.930 43.2 -96.6-170.1-167.4 10.1 24.3 32.5 21 22 A V E -GH 84 127B 9 106,-2.2 106,-2.0 -2,-0.3 2,-0.3 -0.999 26.4-131.4-136.3 131.7 8.4 27.2 30.8 22 23 A V E - H 0 126B 1 61,-2.7 60,-1.4 -2,-0.4 104,-0.3 -0.664 33.7-111.9 -81.1 136.0 9.3 29.1 27.7 23 24 A N > - 0 0 61 102,-2.3 3,-1.4 -2,-0.3 59,-0.3 -0.336 28.6-109.2 -63.9 151.9 9.3 32.9 28.0 24 25 A S T 3 S+ 0 0 86 1,-0.3 -1,-0.1 57,-0.2 58,-0.0 -0.543 112.7 23.1 -73.4 147.9 6.6 34.9 26.1 25 26 A N T 3 S+ 0 0 145 -2,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.661 90.1 169.2 64.1 19.0 8.7 36.6 23.4 26 27 A A < - 0 0 4 -3,-1.4 -1,-0.2 1,-0.2 3,-0.1 -0.279 26.9-169.0 -61.1 140.6 11.5 34.0 23.6 27 28 A T - 0 0 71 1,-0.4 21,-2.3 21,-0.1 22,-2.2 0.838 68.8 -41.1 -89.9 -52.7 14.2 34.2 20.9 28 29 A R E -B 47 0A 68 19,-0.2 97,-2.6 20,-0.2 -1,-0.4 -0.976 51.4-165.0-167.6 157.5 15.8 30.8 21.9 29 30 A F E -BC 46 124A 1 17,-1.4 17,-3.0 -2,-0.3 2,-0.3 -0.981 13.3-151.3-146.5 156.9 16.8 28.8 24.9 30 31 A S E -BC 45 123A 9 93,-2.4 93,-2.0 -2,-0.3 2,-0.4 -0.951 13.6-145.0-131.0 156.2 19.1 25.8 25.3 31 32 A I E -BC 44 122A 4 13,-1.9 13,-2.5 -2,-0.3 2,-0.4 -0.957 28.5-167.0-111.3 134.9 19.6 22.7 27.5 32 33 A N E -BC 43 121A 1 89,-2.6 89,-2.2 -2,-0.4 2,-0.4 -0.977 15.4-173.0-132.1 132.2 23.3 21.8 27.9 33 34 A V E +BC 42 120A 0 9,-2.2 9,-2.1 -2,-0.4 8,-1.6 -0.996 44.1 83.5-124.2 124.6 25.0 18.7 29.3 34 35 A G E S-BC 40 119A 3 85,-2.6 85,-1.8 -2,-0.4 84,-0.6 -0.844 84.1 -67.4-177.7-140.2 28.8 18.8 29.7 35 36 A E E S- 0 0 117 4,-2.7 2,-0.3 1,-0.4 5,-0.2 0.651 99.7 -14.3-116.0 -31.1 31.6 19.8 32.0 36 37 A S E > S-B 39 0A 42 3,-1.7 3,-1.5 83,-0.1 -1,-0.4 -0.939 79.6 -82.5-161.4 177.0 31.5 23.7 32.0 37 38 A T T 3 S+ 0 0 69 -2,-0.3 3,-0.1 1,-0.3 84,-0.0 0.525 132.2 43.6 -71.4 -3.1 30.0 26.6 30.1 38 39 A D T 3 S+ 0 0 60 1,-0.2 2,-0.3 24,-0.0 -1,-0.3 0.169 111.0 55.2-120.1 12.1 32.9 26.1 27.6 39 40 A S E < +B 36 0A 15 -3,-1.5 -4,-2.7 24,-0.2 -3,-1.7 -0.816 66.9 163.4-146.6 95.0 32.9 22.3 27.4 40 41 A I E -BD 34 62A 5 22,-2.1 22,-2.6 -2,-0.3 -6,-0.3 -0.977 23.4-172.2-127.2 119.9 29.5 21.0 26.3 41 42 A A E S+ 0 0 6 -8,-1.6 2,-0.4 -2,-0.5 70,-0.3 0.817 84.9 22.2 -79.1 -32.1 28.9 17.5 25.0 42 43 A M E +B 33 0A 0 -9,-2.1 -9,-2.2 68,-0.1 2,-0.5 -0.922 65.2 178.3-141.6 107.8 25.3 18.0 24.0 43 44 A H E -BD 32 60A 12 17,-2.6 17,-1.8 -2,-0.4 2,-0.6 -0.976 7.1-171.6-101.7 123.6 23.9 21.5 23.4 44 45 A M E -BD 31 59A 0 -13,-2.5 -13,-1.9 -2,-0.5 2,-0.4 -0.937 7.4-167.2-121.2 105.2 20.2 21.5 22.3 45 46 A D E -BD 30 58A 2 13,-3.2 13,-2.2 -2,-0.6 2,-0.7 -0.795 11.1-154.1 -99.9 135.4 19.1 24.9 21.2 46 47 A H E -BD 29 57A 0 -17,-3.0 -17,-1.4 -2,-0.4 2,-0.7 -0.926 16.2-163.4-110.6 105.4 15.4 25.7 20.7 47 48 A R E +BD 28 56A 16 9,-2.8 9,-1.7 -2,-0.7 8,-1.1 -0.846 27.0 164.2-106.3 111.5 15.1 28.5 18.2 48 49 A F S S- 0 0 13 -21,-2.3 7,-0.4 -2,-0.7 2,-0.3 0.898 88.3 -9.9 -81.9 -50.1 11.9 30.5 18.0 49 50 A S S S+ 0 0 65 -22,-2.2 2,-0.3 5,-0.2 -1,-0.3 -0.819 79.5 145.8-151.9 109.7 13.6 33.3 16.0 50 51 A Y B > S-K 53 0C 99 3,-2.8 3,-2.6 -2,-0.3 2,-0.1 -0.861 73.4 -51.8-147.1 108.6 17.3 33.4 15.7 51 52 A G T 3 S- 0 0 74 -2,-0.3 -1,-0.1 1,-0.3 0, 0.0 -0.449 123.7 -20.5 60.0-128.4 18.9 34.8 12.5 52 53 A A T 3 S+ 0 0 97 -2,-0.1 2,-0.5 -3,-0.1 -1,-0.3 0.425 117.7 104.8 -86.1 -2.7 17.2 32.9 9.7 53 54 A D B < +K 50 0C 31 -3,-2.6 -3,-2.8 3,-0.0 2,-0.4 -0.732 41.7 170.2 -86.9 124.6 16.2 30.0 12.1 54 55 A Q - 0 0 131 -2,-0.5 -6,-0.2 -5,-0.2 -5,-0.2 -0.991 67.9 -10.1-137.8 121.6 12.5 29.9 13.1 55 56 A N S S+ 0 0 90 -8,-1.1 2,-0.3 -2,-0.4 -7,-0.2 0.937 98.0 128.0 55.7 59.5 11.0 27.0 15.0 56 57 A V E -D 47 0A 19 -9,-1.7 -9,-2.8 -3,-0.1 2,-0.4 -0.974 54.8-133.0-138.7 149.1 14.0 24.6 14.7 57 58 A L E -DE 46 74A 0 17,-3.1 17,-2.4 -2,-0.3 2,-0.4 -0.891 21.0-166.1 -97.3 136.5 16.1 22.6 17.0 58 59 A V E -DE 45 73A 1 -13,-2.2 -13,-3.2 -2,-0.4 2,-0.4 -0.995 3.2-167.5-125.0 126.7 19.9 22.8 16.6 59 60 A L E +DE 44 72A 3 13,-3.3 13,-2.5 -2,-0.4 2,-0.3 -0.911 20.7 138.4-115.2 139.5 22.2 20.3 18.3 60 61 A N E -D 43 0A 5 -17,-1.8 -17,-2.6 -2,-0.4 2,-0.3 -0.966 40.8-116.9-163.4 172.3 26.0 20.6 18.7 61 62 A S E - 0 0 3 -2,-0.3 8,-2.2 -19,-0.2 2,-0.5 -0.934 18.6-148.0-120.4 153.2 29.0 20.1 20.9 62 63 A L E -DF 40 68A 15 -22,-2.6 -22,-2.1 -2,-0.3 2,-0.4 -0.987 8.8-152.5-123.4 125.3 31.4 22.8 22.2 63 64 A V E >> - F 0 67A 52 4,-2.3 4,-2.4 -2,-0.5 3,-2.3 -0.863 31.2-101.8-104.4 133.3 35.0 22.0 22.8 64 65 A H T 34 S- 0 0 114 -2,-0.4 -25,-0.1 1,-0.3 -1,-0.0 -0.243 101.6 -5.7 -58.7 130.7 36.9 24.1 25.3 65 66 A N T 34 S+ 0 0 147 1,-0.1 -1,-0.3 -27,-0.1 -26,-0.1 0.628 131.6 68.9 57.8 17.8 39.2 26.7 23.8 66 67 A V T <4 S- 0 0 107 -3,-2.3 2,-0.3 1,-0.1 -2,-0.2 0.636 88.0-140.6-127.2 -54.7 38.3 25.4 20.3 67 68 A G E < -F 63 0A 22 -4,-2.4 -4,-2.3 -29,-0.2 2,-0.1 -0.795 39.5 -11.2 126.4-168.8 34.6 26.1 19.6 68 69 A W E -F 62 0A 121 -2,-0.3 -6,-0.2 -6,-0.2 3,-0.1 -0.413 54.4-155.3 -75.2 141.3 31.4 24.7 18.1 69 70 A Q - 0 0 87 -8,-2.2 2,-0.5 1,-0.2 -1,-0.1 0.164 50.8 -33.5 -96.6-146.9 31.6 21.5 16.0 70 71 A Q - 0 0 128 1,-0.0 -1,-0.2 -10,-0.0 2,-0.1 -0.642 64.7-133.1 -83.3 123.3 29.2 20.2 13.2 71 72 A E - 0 0 77 -2,-0.5 2,-0.4 -11,-0.1 -11,-0.2 -0.443 13.8-159.7 -69.6 144.4 25.5 21.3 13.8 72 73 A E E -E 59 0A 68 -13,-2.5 -13,-3.3 -2,-0.1 2,-0.3 -0.944 14.0-155.5-120.3 140.3 22.7 18.8 13.5 73 74 A R E -E 58 0A 114 -2,-0.4 2,-0.4 -15,-0.2 -15,-0.2 -0.928 10.6-167.8-121.9 146.7 19.2 20.2 12.9 74 75 A S E -E 57 0A 7 -17,-2.4 -17,-3.1 -2,-0.3 32,-0.0 -1.000 18.8-156.6-135.3 148.3 15.7 18.9 13.6 75 76 A K + 0 0 161 -2,-0.4 2,-0.6 -19,-0.2 -1,-0.1 0.402 63.2 112.7 -97.2 -8.7 12.4 20.3 12.4 76 77 A K + 0 0 53 1,-0.1 -2,-0.1 -19,-0.1 -19,-0.0 -0.631 37.6 159.6 -69.7 117.1 10.5 18.6 15.3 77 78 A F + 0 0 34 -2,-0.6 2,-1.5 -21,-0.1 -1,-0.1 -0.466 16.1 161.9-146.3 73.4 9.3 21.6 17.3 78 79 A P + 0 0 45 0, 0.0 2,-0.4 0, 0.0 23,-0.1 -0.260 44.9 118.9 -83.7 51.1 6.4 21.0 19.7 79 80 A F - 0 0 16 -2,-1.5 2,-0.4 6,-0.1 6,-0.1 -0.946 41.9-170.2-122.8 141.8 7.2 24.2 21.7 80 81 A T > - 0 0 82 -2,-0.4 3,-1.9 4,-0.2 -58,-0.4 -0.997 31.6-109.4-128.7 134.7 5.1 27.3 22.3 81 82 A K T 3 S+ 0 0 102 -2,-0.4 -57,-0.2 1,-0.3 -58,-0.2 -0.376 106.7 21.3 -58.2 136.0 6.2 30.6 23.8 82 83 A G T 3 S+ 0 0 31 -60,-1.4 -1,-0.3 -59,-0.3 2,-0.2 0.283 108.0 106.6 86.2 -6.6 4.7 31.1 27.3 83 84 A D S < S- 0 0 83 -3,-1.9 -61,-2.7 -60,-0.2 -1,-0.3 -0.629 71.2-104.1-107.4 162.5 4.0 27.3 27.6 84 85 A H E -G 21 0B 138 -63,-0.2 2,-0.3 -2,-0.2 -63,-0.3 -0.354 32.0-172.6 -75.3 156.4 5.5 24.4 29.6 85 86 A F E -G 20 0B 8 -65,-2.1 -65,-2.1 -2,-0.1 2,-0.3 -0.961 9.6-157.9-142.6 164.3 7.8 21.8 28.2 86 87 A Q E -G 19 0B 94 -2,-0.3 2,-0.4 -67,-0.2 -67,-0.2 -0.985 11.7-176.8-145.7 129.6 9.3 18.5 29.5 87 88 A T E -G 18 0B 1 -69,-2.4 -69,-2.5 -2,-0.3 2,-0.4 -0.995 9.1-161.9-134.7 139.3 12.4 16.7 28.1 88 89 A T E -GI 17 99B 33 11,-1.9 11,-2.8 -2,-0.4 2,-0.4 -0.969 10.0-173.4-122.1 135.3 14.0 13.5 29.1 89 90 A I E +GI 16 98B 1 -73,-2.6 -73,-2.5 -2,-0.4 2,-0.3 -0.977 11.8 160.3-128.8 136.9 17.6 12.6 28.2 90 91 A T E - 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0 0 78 -5,-0.1 -4,-3.3 1,-0.0 -1,-0.3 -0.390 44.1-143.8 -71.2 153.4 8.9 12.5 19.5 105 106 A T E -J 99 0B 52 -6,-0.2 2,-0.3 -3,-0.1 -6,-0.2 -0.849 16.7-166.9-120.7 157.3 12.6 11.7 19.9 106 107 A V E -J 98 0B 13 -8,-2.2 -8,-2.9 -2,-0.3 2,-0.4 -0.976 9.8-158.6-134.4 141.7 15.9 13.1 18.6 107 108 A E E -J 97 0B 93 -2,-0.3 -10,-0.2 -10,-0.2 -12,-0.0 -0.958 9.6-178.4-118.9 146.6 19.3 11.3 18.8 108 109 A F E -J 96 0B 2 -12,-1.8 -12,-3.5 -2,-0.4 -48,-0.0 -0.994 33.7-100.9-143.8 135.9 22.7 13.0 18.7 109 110 A P E -J 95 0B 47 0, 0.0 2,-1.5 0, 0.0 -14,-0.3 -0.301 20.4-128.3 -60.5 144.5 26.1 11.3 18.8 110 111 A N > - 0 0 5 -16,-2.1 3,-1.2 1,-0.2 -68,-0.1 -0.721 34.7-174.0 -87.4 86.4 28.2 11.2 22.0 111 112 A R T 3 S+ 0 0 74 -2,-1.5 -1,-0.2 -70,-0.3 -69,-0.0 0.799 75.9 41.1 -63.1 -33.2 31.2 12.6 20.1 112 113 A N T 3 S- 0 0 84 -3,-0.1 -1,-0.3 -71,-0.1 -18,-0.1 0.543 103.8-124.7 -93.3 -1.7 33.8 12.3 22.9 113 114 A K < + 0 0 115 -3,-1.2 -2,-0.1 1,-0.2 -20,-0.1 0.833 48.5 174.5 61.8 34.1 32.5 8.8 24.1 114 115 A D - 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