==== 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 07-AUG-06 2HYR . COMPND 2 MOLECULE: GRIFFITHSIN; . SOURCE 2 ORGANISM_SCIENTIFIC: GRIFFITHSIA; . AUTHOR N.E.ZIOLKOWSKA,A.WLODAWER . 242 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10397.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 174 71.9 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 . 129 53.3 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 . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 6 2.5 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 . 24 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 6 2.5 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 4 2 4 2 3 3 0 2 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 4 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 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 0 110 0, 0.0 2,-0.3 0, 0.0 124,-0.2 0.000 360.0 360.0 360.0 -5.0 19.9 -13.5 -2.1 2 2 A L - 0 0 22 122,-0.7 122,-0.3 239,-0.1 2,-0.2 -0.925 360.0-148.3-149.3 177.1 18.2 -11.5 -4.7 3 3 A T E -A 240 0A 48 237,-2.8 237,-2.4 -2,-0.3 2,-0.3 -0.749 1.2-142.8-137.3 176.0 19.2 -10.2 -8.1 4 4 A H E -A 239 0A 62 235,-0.3 2,-0.4 -2,-0.2 235,-0.2 -0.989 5.2-162.9-144.7 157.1 18.7 -7.3 -10.5 5 5 A R E -A 238 0A 146 233,-2.0 233,-2.8 -2,-0.3 2,-0.3 -0.999 12.6-141.1-140.7 141.4 18.3 -6.8 -14.3 6 6 A K E -A 237 0A 151 -2,-0.4 2,-0.3 231,-0.2 231,-0.2 -0.808 15.7-174.8-103.9 143.3 18.6 -3.6 -16.4 7 7 A F E +A 236 0A 17 229,-2.6 229,-2.2 -2,-0.3 2,-0.2 -0.987 44.2 20.5-132.0 145.9 16.5 -2.8 -19.4 8 8 A G E S-A 235 0A 30 -2,-0.3 227,-0.3 227,-0.2 182,-0.2 -0.569 83.5 -42.1 100.4-165.5 16.8 0.2 -21.8 9 9 A G - 0 0 22 225,-2.1 180,-0.1 180,-1.1 -2,-0.1 -0.064 48.7-101.1-101.0-167.3 19.4 2.7 -22.9 10 10 A S S S+ 0 0 131 -2,-0.0 225,-0.1 225,-0.0 180,-0.1 0.448 81.1 99.5-103.6 2.7 22.1 4.8 -21.4 11 11 A G + 0 0 28 178,-0.4 223,-0.1 223,-0.1 224,-0.1 -0.100 55.0 39.3 -82.0 177.3 20.3 8.2 -21.3 12 12 A G S S- 0 0 42 216,-0.1 218,-0.3 222,-0.1 221,-0.1 -0.153 86.9 -60.5 85.3-173.3 18.6 10.2 -18.7 13 13 A S E -B 229 0A 84 216,-2.8 216,-2.1 -2,-0.0 221,-0.1 -0.932 53.5-109.1-112.2 135.4 19.2 10.8 -15.0 14 14 A P E -B 228 0A 115 0, 0.0 2,-0.3 0, 0.0 214,-0.3 -0.278 35.9-175.2 -67.6 147.1 19.3 7.9 -12.4 15 15 A F E -B 227 0A 28 212,-2.6 212,-1.8 39,-0.1 2,-0.4 -0.958 16.3-145.1-135.5 155.7 16.5 7.6 -9.9 16 16 A S - 0 0 44 -2,-0.3 210,-0.2 210,-0.2 85,-0.0 -0.959 16.1-137.9-115.0 139.7 15.9 5.3 -6.9 17 17 A G S S+ 0 0 1 -2,-0.4 2,-1.0 84,-0.1 -1,-0.1 0.840 93.1 75.3 -59.1 -34.4 12.4 4.1 -5.9 18 18 A L + 0 0 8 83,-0.3 -1,-0.1 1,-0.2 3,-0.1 -0.715 56.4 141.2 -89.1 100.7 13.2 4.8 -2.2 19 19 A S + 0 0 27 -2,-1.0 33,-2.4 1,-0.3 2,-0.3 0.591 56.1 23.5-123.3 -14.1 13.0 8.6 -2.0 20 20 A S E -D 51 0B 20 31,-0.2 15,-2.5 2,-0.0 2,-0.3 -0.977 52.5-175.8-155.3 145.9 11.3 9.6 1.3 21 21 A I E +DE 50 34B 1 29,-2.2 29,-3.3 -2,-0.3 2,-0.3 -0.998 9.3 161.1-136.9 134.8 10.8 8.2 4.7 22 22 A A E - E 0 33B 1 11,-1.7 11,-2.9 -2,-0.3 2,-0.3 -0.915 17.2-157.4-137.6 168.3 8.9 9.4 7.8 23 23 A V E - E 0 32B 0 25,-0.3 24,-3.0 -2,-0.3 2,-0.4 -0.931 17.2-135.7-137.9 159.8 7.7 7.5 10.9 24 24 A R E +FE 46 31B 63 7,-2.2 6,-2.2 -2,-0.3 7,-1.5 -0.991 39.6 176.7-105.6 137.8 5.2 7.7 13.7 25 25 A S E +FE 45 29B 16 20,-2.1 20,-2.5 -2,-0.4 4,-0.2 -0.987 27.7 140.3-146.6 151.1 6.7 6.8 17.0 26 26 A G S S- 0 0 37 2,-2.9 60,-0.2 -2,-0.3 3,-0.0 -0.147 93.6 -21.8-137.7-114.3 6.1 6.5 20.7 27 27 A S S S+ 0 0 88 -2,-0.1 60,-1.0 59,-0.1 62,-0.4 0.764 142.3 13.1 -67.8 -31.8 7.5 3.7 22.7 28 28 A Y S S- 0 0 80 58,-0.2 -2,-2.9 60,-0.1 2,-0.7 -0.696 101.0 -78.4-125.9-178.7 7.7 1.8 19.4 29 29 A L E -E 25 0B 0 40,-2.8 82,-3.1 82,-0.3 40,-0.3 -0.831 39.2-174.7 -82.6 112.4 7.4 2.6 15.7 30 30 A D E - 0 0 12 -6,-2.2 11,-2.5 -2,-0.7 2,-0.3 0.813 65.8 -10.9 -74.0 -32.5 3.7 3.0 15.1 31 31 A A E -EG 24 40B 0 -7,-1.5 -7,-2.2 9,-0.3 2,-0.4 -0.981 52.3-140.7-162.7 157.9 4.2 3.4 11.4 32 32 A I E -EG 23 39B 0 7,-2.3 7,-2.1 -2,-0.3 2,-0.6 -0.960 15.6-153.7-126.1 136.3 6.6 4.0 8.6 33 33 A I E -EG 22 38B 22 -11,-2.9 -11,-1.7 -2,-0.4 2,-0.6 -0.961 11.8-170.2-115.0 113.2 5.7 6.2 5.7 34 34 A I E > S-EG 21 37B 1 3,-2.2 3,-1.9 -2,-0.6 -13,-0.2 -0.909 71.8 -18.9-113.5 116.6 7.5 5.4 2.5 35 35 A D T 3 S- 0 0 10 -15,-2.5 -1,-0.2 -2,-0.6 -14,-0.1 0.852 130.1 -52.1 56.6 34.6 7.3 7.8 -0.5 36 36 A G T 3 S+ 0 0 62 1,-0.2 2,-0.5 -3,-0.2 -1,-0.3 0.356 111.1 122.5 91.7 -8.4 4.3 9.2 1.2 37 37 A V E < -G 34 0B 43 -3,-1.9 -3,-2.2 102,-0.1 2,-0.3 -0.822 57.8-132.6 -99.9 127.7 2.4 5.9 1.7 38 38 A H E -G 33 0B 87 -2,-0.5 2,-0.4 -5,-0.2 -5,-0.2 -0.587 21.8-176.5 -90.3 131.5 1.5 5.1 5.3 39 39 A H E +G 32 0B 18 -7,-2.1 -7,-2.3 -2,-0.3 2,-0.3 -0.932 54.2 8.0-128.9 108.6 2.2 1.7 6.7 40 40 A G E S-G 31 0B 26 -2,-0.4 -9,-0.3 -9,-0.2 70,-0.2 -0.884 91.0 -26.9 123.7-160.2 1.0 1.1 10.3 41 41 A G - 0 0 9 -11,-2.5 68,-0.1 68,-0.5 -2,-0.1 -0.090 42.9-116.4 -90.7-171.1 -1.1 2.8 12.9 42 42 A S S S+ 0 0 103 -2,-0.0 -11,-0.1 68,-0.0 68,-0.1 0.353 77.3 102.4-111.4 2.6 -2.2 6.2 13.9 43 43 A G + 0 0 30 66,-0.4 -13,-0.1 -13,-0.1 -12,-0.0 -0.061 62.2 33.4 -75.2 179.4 -0.5 6.3 17.4 44 44 A G S S- 0 0 27 -20,-0.1 2,-0.4 -14,-0.1 -18,-0.2 -0.076 95.6 -60.7 67.5-166.1 2.7 8.0 18.3 45 45 A N E -F 25 0B 125 -20,-2.5 -20,-2.1 0, 0.0 2,-0.3 -0.945 47.4-111.3-121.8 140.1 3.9 11.3 16.9 46 46 A L E -F 24 0B 104 -2,-0.4 -22,-0.2 -22,-0.2 3,-0.1 -0.511 29.8-146.8 -75.5 124.1 4.8 12.1 13.3 47 47 A S - 0 0 10 -24,-3.0 -1,-0.1 -2,-0.3 38,-0.0 -0.362 31.9 -86.4 -73.6 164.5 8.5 12.6 12.6 48 48 A P - 0 0 88 0, 0.0 2,-0.5 0, 0.0 -25,-0.3 -0.350 51.1-104.7 -60.4 159.1 9.8 15.1 10.0 49 49 A T - 0 0 84 -27,-0.1 2,-0.7 -3,-0.1 -27,-0.2 -0.798 23.6-145.6 -91.5 130.6 10.1 13.6 6.5 50 50 A F E -D 21 0B 22 -29,-3.3 -29,-2.2 -2,-0.5 2,-0.6 -0.860 14.8-165.2 -94.2 117.7 13.4 12.7 5.2 51 51 A T E -D 20 0B 89 -2,-0.7 -31,-0.2 -31,-0.2 2,-0.1 -0.897 19.2-127.1-108.5 123.8 13.6 13.3 1.5 52 52 A F - 0 0 23 -33,-2.4 2,-0.1 -2,-0.6 3,-0.1 -0.382 22.2-141.7 -71.2 138.9 16.6 11.8 -0.2 53 53 A G > - 0 0 29 1,-0.2 3,-2.0 -2,-0.1 -1,-0.1 -0.384 41.8 -60.6 -86.0 177.6 18.8 14.0 -2.4 54 54 A S T 3 S+ 0 0 123 1,-0.3 -1,-0.2 -2,-0.1 3,-0.1 -0.322 125.1 5.1 -58.8 125.4 20.4 13.3 -5.7 55 55 A G T 3 S+ 0 0 64 1,-0.2 2,-0.3 -41,-0.2 -1,-0.3 0.525 99.9 136.6 76.9 16.0 22.9 10.4 -5.3 56 56 A E < + 0 0 15 -3,-2.0 2,-0.3 21,-0.1 -1,-0.2 -0.709 20.8 159.3-106.8 139.2 21.9 9.8 -1.7 57 57 A Y - 0 0 76 -2,-0.3 20,-2.1 -3,-0.1 2,-0.4 -0.970 47.0 -91.2-150.8 154.2 21.2 6.4 -0.0 58 58 A I E +H 76 0C 2 42,-0.3 42,-1.9 -2,-0.3 18,-0.3 -0.643 42.1 168.1 -68.5 123.4 21.2 4.9 3.4 59 59 A S E + 0 0 14 16,-2.4 39,-2.0 -2,-0.4 38,-0.7 0.600 65.4 30.6-113.2 -14.3 24.6 3.6 4.3 60 60 A N E +HI 75 96C 60 15,-1.8 15,-2.5 36,-0.2 2,-0.3 -0.996 64.8 173.6-147.0 134.8 24.2 2.9 8.1 61 61 A M E -HI 74 95C 2 34,-2.2 34,-2.7 -2,-0.3 2,-0.5 -0.992 14.9-163.6-147.4 138.6 21.1 1.9 10.0 62 62 A T E -HI 73 94C 45 11,-2.6 11,-1.9 -2,-0.3 2,-0.4 -0.993 12.4-176.4-123.6 126.3 20.4 0.8 13.6 63 63 A I E -HI 72 93C 3 30,-2.7 30,-2.0 -2,-0.5 2,-0.5 -0.989 12.5-158.0-121.9 129.6 17.1 -0.9 14.4 64 64 A R E +HI 71 92C 72 7,-2.1 6,-2.3 -2,-0.4 7,-1.7 -0.887 30.2 160.8 -98.7 135.2 16.0 -1.9 17.8 65 65 A S E +HI 69 91C 13 26,-2.2 26,-2.1 -2,-0.5 4,-0.2 -0.999 25.7 150.6-154.2 157.8 13.4 -4.6 17.8 66 66 A G S S- 0 0 36 2,-2.4 64,-0.1 -2,-0.3 23,-0.0 -0.162 92.4 -18.3-144.6-114.6 11.6 -7.4 19.7 67 67 A D S S+ 0 0 129 63,-0.1 64,-1.1 -2,-0.1 66,-0.4 0.781 142.3 16.2 -67.6 -27.7 8.1 -8.3 18.8 68 68 A Y S S- 0 0 73 62,-0.2 -2,-2.4 64,-0.1 2,-0.7 -0.697 102.3 -78.6-126.1-177.2 7.8 -4.9 17.0 69 69 A I E -H 65 0C 0 42,-2.6 -40,-2.8 -40,-0.3 42,-0.3 -0.866 42.9-177.4 -88.4 116.0 10.2 -2.3 15.8 70 70 A D E - 0 0 11 -6,-2.3 17,-2.1 -2,-0.7 2,-0.3 0.817 60.7 -7.8 -82.3 -35.6 11.2 -0.3 18.8 71 71 A N E -HJ 64 86C 19 -7,-1.7 -7,-2.1 15,-0.2 2,-0.4 -0.993 54.0-161.2-162.0 149.3 13.5 2.3 17.2 72 72 A I E +HJ 63 85C 3 13,-2.1 13,-2.1 -2,-0.3 2,-0.3 -0.998 13.3 164.4-137.1 142.3 15.1 3.3 14.0 73 73 A S E +H 62 0C 27 -11,-1.9 -11,-2.6 -2,-0.4 2,-0.3 -0.967 10.4 175.6-144.2 149.7 18.0 5.6 13.1 74 74 A F E -HJ 61 82C 7 8,-2.1 8,-2.4 -2,-0.3 2,-0.3 -0.988 18.1-152.1-148.9 163.0 20.0 5.8 9.9 75 75 A E E -HJ 60 81C 61 -15,-2.5 -16,-2.4 -2,-0.3 -15,-1.8 -0.976 18.2-140.0-130.6 144.1 22.7 7.8 8.2 76 76 A T E > -H 58 0C 2 4,-2.0 3,-1.8 -2,-0.3 -18,-0.2 -0.468 32.4-100.6 -98.6 169.4 23.2 8.4 4.5 77 77 A N T 3 S+ 0 0 64 -20,-2.1 -19,-0.1 1,-0.3 -21,-0.1 0.747 124.5 56.2 -56.1 -23.3 26.3 8.4 2.3 78 78 A M T 3 S- 0 0 93 -21,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.338 121.9-107.0 -95.2 8.0 26.1 12.2 2.4 79 79 A G S < S+ 0 0 38 -3,-1.8 2,-0.4 1,-0.3 -2,-0.1 0.648 72.6 141.2 81.6 15.1 26.1 12.3 6.2 80 80 A R - 0 0 113 2,-0.0 -4,-2.0 1,-0.0 -1,-0.3 -0.762 34.2-156.4 -98.3 133.0 22.5 13.1 6.7 81 81 A R E -J 75 0C 181 -2,-0.4 2,-0.4 -6,-0.2 -6,-0.2 -0.705 16.5-159.4-115.3 158.4 20.7 11.4 9.5 82 82 A F E -J 74 0C 9 -8,-2.4 -8,-2.1 -2,-0.3 3,-0.2 -0.992 44.4 -63.7-130.2 130.3 17.3 10.4 10.6 83 83 A G E - 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