==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR BINDING PROTEIN 28-JAN-10 3LKY . COMPND 2 MOLECULE: GRIFFITHSIN; . SOURCE 2 ORGANISM_SCIENTIFIC: GRIFFITHSIA; . AUTHOR T.MOULAEI,A.WLODAWER . 123 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6018.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 86 69.9 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 . 65 52.8 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 . 1 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 3 2.4 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 . 11 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 3 2.4 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 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 0 3 1 2 1 0 1 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 2 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 S 0 0 146 0, 0.0 121,-0.5 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 60.4 -1.0 11.6 0.3 2 2 A L - 0 0 99 119,-0.1 2,-0.3 117,-0.0 119,-0.2 -0.387 360.0-162.3 -77.8 154.8 0.7 14.2 2.4 3 3 A T E -A 120 0A 48 117,-2.3 117,-2.6 -2,-0.1 2,-0.4 -0.926 5.3-154.6-128.2 146.2 0.5 18.0 1.8 4 4 A H E -A 119 0A 110 -2,-0.3 2,-0.4 115,-0.2 115,-0.2 -0.994 15.9-175.1-117.2 136.4 2.8 20.7 3.2 5 5 A R E -A 118 0A 135 113,-2.0 113,-2.7 -2,-0.4 2,-0.3 -0.999 13.7-140.4-136.4 137.5 1.5 24.3 3.6 6 6 A K E -A 117 0A 126 -2,-0.4 2,-0.4 111,-0.2 111,-0.2 -0.702 14.3-175.4-101.2 142.8 3.2 27.4 4.6 7 7 A F E +A 116 0A 14 109,-2.5 109,-2.3 -2,-0.3 2,-0.2 -0.994 48.6 24.5-131.6 136.2 2.0 30.2 6.9 8 8 A G E S-A 115 0A 27 -2,-0.4 107,-0.3 107,-0.2 62,-0.2 -0.628 85.1 -40.0 109.6-167.4 3.7 33.4 7.6 9 9 A G - 0 0 13 105,-2.0 60,-0.1 60,-1.0 -2,-0.1 -0.029 50.2 -99.9 -94.5-166.5 6.3 35.7 5.9 10 10 A S S S+ 0 0 114 105,-0.0 105,-0.1 60,-0.0 60,-0.1 0.461 81.8 96.5 -98.9 -3.2 9.5 35.4 4.0 11 11 A G + 0 0 29 58,-0.4 103,-0.1 103,-0.1 104,-0.1 -0.163 54.1 41.4 -82.9 177.8 12.1 36.0 6.6 12 12 A G S S- 0 0 42 96,-0.1 98,-0.2 102,-0.1 101,-0.1 -0.057 82.4 -66.6 84.9 178.4 14.3 33.9 8.9 13 13 A S E -B 109 0A 86 96,-2.6 96,-2.1 1,-0.1 101,-0.1 -0.866 55.1-104.1-108.0 138.1 16.4 30.8 8.5 14 14 A P E +B 108 0A 121 0, 0.0 2,-0.3 0, 0.0 94,-0.3 -0.238 39.4 177.5 -65.0 149.7 14.7 27.4 7.9 15 15 A F E -B 107 0A 29 92,-2.5 92,-2.2 26,-0.1 2,-0.4 -0.980 22.8-142.0-142.0 156.4 14.3 24.6 10.5 16 16 A S E -B 106 0A 81 -2,-0.3 90,-0.2 90,-0.2 2,-0.0 -0.984 30.4-118.5-111.6 132.6 12.8 21.2 10.8 17 16AA G - 0 0 5 88,-1.6 3,-0.1 -2,-0.4 20,-0.1 -0.341 19.8-130.4 -62.4 145.3 11.0 20.3 14.1 18 16BA S S S- 0 0 79 18,-0.3 2,-0.3 21,-0.1 -1,-0.1 0.540 71.5 -44.8 -85.5 1.4 12.7 17.3 15.8 19 17 A G - 0 0 21 86,-0.2 86,-0.3 3,-0.1 -1,-0.1 -0.900 56.9-102.2 160.5-177.2 9.5 15.3 16.4 20 18 A L S S+ 0 0 36 -2,-0.3 3,-0.1 84,-0.1 34,-0.1 -0.366 77.7 115.3-131.9 58.2 5.9 16.1 17.7 21 19 A S S S+ 0 0 76 1,-0.3 33,-2.2 32,-0.1 2,-0.3 0.779 84.3 5.9 -90.5 -31.0 6.1 14.8 21.2 22 20 A S E -D 53 0B 19 31,-0.2 15,-2.4 -3,-0.1 2,-0.4 -0.990 59.9-167.0-153.4 149.9 5.7 18.3 22.9 23 21 A I E +DE 52 36B 1 29,-2.3 29,-3.1 -2,-0.3 2,-0.3 -0.999 13.5 158.9-135.3 139.8 5.0 21.9 21.9 24 22 A A E - E 0 35B 0 11,-2.2 11,-3.3 -2,-0.4 2,-0.3 -0.898 20.9-147.7-139.1 174.4 5.3 25.2 23.8 25 23 A V E - E 0 34B 0 25,-0.3 24,-2.9 -2,-0.3 2,-0.5 -0.966 12.9-140.6-137.8 157.6 5.6 28.7 22.6 26 24 A R E +FE 48 33B 67 7,-2.6 7,-1.9 -2,-0.3 6,-1.3 -0.994 45.1 164.8-109.1 123.8 7.2 31.9 23.6 27 25 A S E +FE 47 31B 17 20,-2.1 20,-2.4 -2,-0.5 4,-0.2 -0.970 31.9 150.1-147.6 157.4 4.7 34.6 22.8 28 26 A G S S- 0 0 41 2,-2.6 60,-0.2 -2,-0.4 -1,-0.0 -0.101 93.0 -30.9-140.9-113.6 3.6 38.2 23.3 29 27 A S S S+ 0 0 90 59,-0.1 60,-0.9 -2,-0.1 62,-0.4 0.587 140.0 36.4 -84.2 -18.4 1.8 39.9 20.5 30 28 A Y S S- 0 0 94 58,-0.2 -2,-2.6 60,-0.1 2,-1.1 -0.823 98.3 -99.4-115.8 170.1 3.8 37.7 18.1 31 29 A L E -E 27 0B 0 40,-2.9 82,-2.6 -2,-0.3 40,-0.3 -0.809 38.7-176.9 -86.4 100.1 5.0 34.2 18.3 32 30 A D E - 0 0 17 -6,-1.3 11,-2.4 -2,-1.1 2,-0.3 0.867 66.7 -10.1 -65.0 -40.1 8.5 34.9 19.3 33 31 A A E -EG 26 42B 0 -7,-1.9 -7,-2.6 9,-0.3 2,-0.4 -0.977 55.1-139.0-155.6 149.8 9.4 31.2 19.2 34 32 A I E -EG 25 41B 3 7,-2.0 7,-1.8 -2,-0.3 2,-0.6 -0.937 21.3-150.4-104.4 140.8 7.8 27.8 18.8 35 33 A I E -EG 24 40B 19 -11,-3.3 -11,-2.2 -2,-0.4 2,-0.5 -0.956 14.3-175.8-114.7 116.2 9.4 25.2 21.1 36 34 A I E > S-EG 23 39B 0 3,-2.5 3,-1.9 -2,-0.6 -18,-0.3 -0.971 75.3 -14.8-119.0 118.7 9.2 21.6 19.6 37 35 A D T 3 S- 0 0 49 -15,-2.4 -1,-0.2 -2,-0.5 -14,-0.1 0.853 130.9 -53.9 52.5 39.2 10.5 18.8 21.9 38 36 A G T 3 S+ 0 0 62 1,-0.2 2,-0.5 -16,-0.2 -1,-0.3 0.399 114.3 116.1 82.1 -2.7 12.1 21.5 24.1 39 37 A V E < -G 36 0B 74 -3,-1.9 -3,-2.5 2,-0.0 -1,-0.2 -0.884 57.7-139.1-103.4 122.9 14.1 23.1 21.2 40 38 A H E -G 35 0B 107 -2,-0.5 2,-0.4 -5,-0.3 -5,-0.2 -0.490 12.4-164.6 -81.8 151.5 13.1 26.7 20.4 41 39 A H E +G 34 0B 28 -7,-1.8 -7,-2.0 -2,-0.2 2,-0.3 -0.924 66.0 20.2-136.6 103.8 12.8 28.2 16.9 42 40 A G E S-G 33 0B 13 -2,-0.4 -9,-0.3 -9,-0.2 70,-0.2 -0.954 97.4 -37.2 133.4-153.3 12.8 32.0 17.1 43 41 A G - 0 0 12 -11,-2.4 68,-0.1 68,-0.7 -2,-0.1 -0.213 45.2-110.0-103.4-170.7 13.9 34.5 19.6 44 42 A S S S+ 0 0 106 -2,-0.1 2,-0.1 -4,-0.0 -11,-0.1 0.419 77.6 103.6-105.6 -3.8 14.0 35.0 23.3 45 43 A G + 0 0 35 66,-0.4 -13,-0.1 -13,-0.1 -2,-0.1 -0.456 62.4 38.4 -78.7 162.0 11.4 37.7 23.9 46 44 A G S S- 0 0 42 -2,-0.1 2,-0.3 -14,-0.1 -18,-0.2 -0.224 93.8 -56.3 88.9 179.8 7.9 37.0 25.2 47 45 A N E -F 27 0B 122 -20,-2.4 -20,-2.1 -2,-0.1 2,-0.6 -0.765 45.9-119.7-106.9 134.6 6.7 34.6 27.9 48 46 A L E -F 26 0B 83 -2,-0.3 -22,-0.2 -22,-0.2 3,-0.1 -0.696 28.0-147.0 -74.4 116.1 7.2 30.8 27.9 49 47 A S - 0 0 8 -24,-2.9 -1,-0.0 -2,-0.6 3,-0.0 -0.268 30.7 -89.4 -70.5 159.6 3.9 28.8 27.9 50 48 A P - 0 0 94 0, 0.0 2,-0.4 0, 0.0 -25,-0.3 -0.368 52.2 -98.9 -59.6 155.3 3.6 25.5 29.6 51 49 A T - 0 0 81 -27,-0.1 2,-0.6 -3,-0.1 -27,-0.2 -0.702 24.8-145.9 -82.7 133.1 4.5 22.5 27.5 52 50 A F E -D 23 0B 18 -29,-3.1 -29,-2.3 -2,-0.4 2,-0.5 -0.909 17.7-161.9 -94.9 118.4 1.7 20.5 25.8 53 51 A T E -D 22 0B 87 -2,-0.6 -31,-0.2 -31,-0.2 2,-0.2 -0.922 14.1-130.5-107.9 123.6 2.9 16.8 25.8 54 52 A F - 0 0 22 -33,-2.2 3,-0.1 -2,-0.5 2,-0.1 -0.481 17.9-133.5 -73.6 139.5 1.1 14.6 23.3 55 53 A G > - 0 0 35 -2,-0.2 3,-2.2 1,-0.2 2,-0.2 -0.273 45.0 -66.4 -79.2 170.3 -0.2 11.2 24.5 56 54 A S T 3 S+ 0 0 124 1,-0.3 -1,-0.2 -2,-0.1 3,-0.1 -0.435 126.0 7.4 -58.5 125.5 0.2 8.0 22.7 57 55 A G T 3 S+ 0 0 57 1,-0.3 2,-0.4 -2,-0.2 -1,-0.3 0.592 99.9 134.5 74.5 12.5 -1.6 8.1 19.4 58 56 A E < + 0 0 16 -3,-2.2 2,-0.3 21,-0.1 -1,-0.3 -0.782 23.5 158.9 -99.3 137.9 -2.3 11.8 19.9 59 57 A Y - 0 0 65 -2,-0.4 20,-2.2 -3,-0.1 2,-0.4 -0.967 47.0 -84.4-149.9 160.8 -1.8 14.3 17.0 60 58 A I E +H 78 0C 1 42,-0.4 42,-2.2 -2,-0.3 18,-0.3 -0.582 41.3 169.6 -71.3 126.2 -3.0 17.7 15.9 61 59 A S E + 0 0 14 16,-2.5 39,-2.4 -2,-0.4 38,-0.7 0.574 67.0 24.0-111.1 -21.1 -6.3 17.6 14.1 62 60 A N E +HI 77 98C 45 15,-1.9 15,-2.6 36,-0.2 2,-0.3 -0.985 65.0 176.8-146.9 138.9 -7.2 21.2 13.8 63 61 A M E -HI 76 97C 6 34,-2.6 34,-2.9 -2,-0.3 2,-0.5 -0.974 14.7-160.7-147.8 134.3 -5.0 24.3 13.9 64 62 A T E -HI 75 96C 46 11,-2.1 11,-1.8 -2,-0.3 2,-0.5 -0.963 14.0-174.9-116.9 125.3 -5.7 28.0 13.6 65 63 A I E -HI 74 95C 1 30,-3.0 30,-2.3 -2,-0.5 2,-0.4 -0.980 11.2-160.6-120.0 125.3 -2.7 30.2 12.7 66 64 A R E +HI 73 94C 73 7,-2.2 6,-2.9 -2,-0.5 7,-1.7 -0.901 30.5 159.2 -98.0 134.7 -2.8 34.0 12.6 67 65 A S E +HI 71 93C 9 26,-2.2 26,-2.1 -2,-0.4 4,-0.2 -0.997 27.4 154.9-154.9 156.4 0.1 35.4 10.6 68 66 A G S S- 0 0 35 2,-2.5 4,-0.0 -2,-0.3 3,-0.0 -0.183 92.2 -19.6-135.2-115.9 1.6 38.3 8.6 69 67 A D S S+ 0 0 113 -61,-0.1 -60,-1.0 -2,-0.1 -58,-0.4 0.824 142.8 22.8 -59.2 -36.7 5.3 38.8 8.3 70 68 A Y S S- 0 0 64 -62,-0.2 -2,-2.5 -60,-0.1 2,-0.5 -0.805 100.2 -86.6-122.7 165.4 5.5 36.5 11.4 71 69 A I E -H 67 0C 0 42,-3.0 -40,-2.9 -40,-0.3 42,-0.3 -0.703 43.5-178.8 -69.5 124.9 3.4 34.0 13.1 72 70 A D E + 0 0 8 -6,-2.9 17,-2.2 -2,-0.5 2,-0.3 0.742 59.4 3.2 -96.4 -33.1 1.1 36.1 15.3 73 71 A N E -HJ 66 88C 20 -7,-1.7 -7,-2.2 15,-0.3 2,-0.4 -0.984 55.8-163.9-158.4 142.9 -1.0 33.4 17.1 74 72 A I E +HJ 65 87C 6 13,-2.0 13,-1.8 -2,-0.3 2,-0.3 -1.000 12.9 164.4-132.0 140.6 -1.3 29.6 17.3 75 73 A S E +H 64 0C 28 -11,-1.8 -11,-2.1 -2,-0.4 2,-0.3 -0.984 10.8 176.6-142.2 146.9 -4.1 27.4 18.6 76 74 A F E -HJ 63 84C 7 8,-2.4 8,-2.4 -2,-0.3 2,-0.3 -0.988 18.6-155.2-147.4 162.5 -4.7 23.7 18.1 77 75 A E E -HJ 62 83C 52 -15,-2.6 -16,-2.5 -2,-0.3 -15,-1.9 -0.979 20.8-136.5-131.8 145.5 -6.9 20.8 19.0 78 76 A T E > -H 60 0C 5 4,-2.4 3,-2.1 -2,-0.3 -18,-0.2 -0.493 30.2-102.7 -98.0 169.8 -5.9 17.2 18.9 79 77 A N T 3 S+ 0 0 60 -20,-2.2 -19,-0.1 1,-0.3 -1,-0.1 0.713 125.0 55.6 -59.0 -25.4 -7.7 14.1 17.7 80 78 A M T 3 S- 0 0 106 -21,-0.3 -1,-0.3 2,-0.1 -20,-0.1 0.351 122.5-107.2 -91.0 4.3 -8.4 13.4 21.4 81 79 A G S < S+ 0 0 37 -3,-2.1 2,-0.2 1,-0.3 -2,-0.1 0.459 71.3 141.2 88.3 2.9 -10.1 16.8 21.9 82 80 A R - 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