==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-SEP-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR BINDING PROTEIN 21-AUG-06 2J3F . COMPND 2 MOLECULE: FICOLIN-2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR V.GARLATTI,C.GABORIAUD . 1298 9 17 16 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 50997.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 819 63.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 24 1.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 333 25.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 16 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 5 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 139 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 104 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 105 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 24 1.8 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 7 2 13 2 3 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 . 12 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 . 22 26 10 0 6 9 2 5 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 . 11 3 0 0 0 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 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 70 A P 0 0 114 0, 0.0 30,-0.2 0, 0.0 31,-0.0 0.000 360.0 360.0 360.0 170.1 -33.1 53.4 -20.3 2 71 A Q - 0 0 155 28,-1.4 3,-0.2 27,-0.1 90,-0.0 -0.899 360.0 -56.9-177.2 149.5 -34.3 49.9 -19.0 3 72 A P - 0 0 65 0, 0.0 26,-0.1 0, 0.0 28,-0.1 0.138 55.8-120.4 -46.7 113.4 -33.0 46.7 -17.2 4 73 A a - 0 0 3 24,-0.4 3,-0.2 25,-0.3 5,-0.1 -0.296 25.6-171.7 -55.8 119.2 -30.0 45.2 -19.1 5 74 A L S S+ 0 0 177 -3,-0.2 -1,-0.2 1,-0.1 4,-0.0 0.401 74.6 67.1 -85.3 -1.6 -31.0 41.7 -20.1 6 75 A T S S+ 0 0 119 1,-0.1 -1,-0.1 22,-0.1 -2,-0.1 0.505 103.9 4.9-109.1 -10.7 -27.5 40.9 -21.3 7 76 A G S S- 0 0 9 -3,-0.2 2,-0.3 21,-0.1 21,-0.1 -0.948 100.3 -41.0-159.4-176.3 -25.1 40.9 -18.3 8 77 A P - 0 0 24 0, 0.0 20,-2.1 0, 0.0 3,-0.1 -0.346 48.0-170.2 -63.3 115.3 -24.9 41.2 -14.4 9 78 A R - 0 0 103 -2,-0.3 2,-0.3 18,-0.2 23,-0.1 0.862 61.0 -3.6 -75.3 -40.9 -27.3 43.9 -13.5 10 79 A T S > S- 0 0 23 17,-0.1 4,-1.8 16,-0.1 3,-0.2 -0.898 77.8 -91.7-146.8 170.6 -26.4 44.4 -9.8 11 80 A b H > S+ 0 0 0 -2,-0.3 4,-1.9 1,-0.2 36,-0.2 0.732 123.5 62.3 -58.7 -21.9 -24.2 43.1 -7.0 12 81 A K H > S+ 0 0 60 35,-0.2 4,-2.5 2,-0.2 5,-0.3 0.959 100.1 49.2 -69.7 -51.3 -27.2 40.8 -6.2 13 82 A D H > S+ 0 0 27 1,-0.2 4,-1.3 2,-0.2 -2,-0.2 0.903 108.2 56.4 -52.6 -44.3 -27.0 39.1 -9.6 14 83 A L H >X>S+ 0 0 7 -4,-1.8 5,-1.9 2,-0.2 3,-0.7 0.943 107.2 48.1 -51.4 -53.7 -23.3 38.6 -9.0 15 84 A L H ><5S+ 0 0 32 -4,-1.9 3,-2.3 1,-0.2 -2,-0.2 0.960 110.3 50.7 -50.7 -55.8 -24.0 36.8 -5.7 16 85 A D H 3<5S+ 0 0 100 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.746 109.0 55.2 -55.3 -22.8 -26.7 34.6 -7.3 17 86 A R H <<5S- 0 0 137 -4,-1.3 -1,-0.3 -3,-0.7 -2,-0.2 0.497 126.9 -95.7 -94.1 -8.4 -24.1 33.8 -10.0 18 87 A G T <<5S+ 0 0 34 -3,-2.3 2,-1.1 -4,-0.6 -3,-0.2 0.626 79.3 132.0 106.9 14.0 -21.5 32.6 -7.5 19 88 A H < + 0 0 79 -5,-1.9 -1,-0.3 1,-0.1 -2,-0.1 -0.843 25.1 168.1 -87.2 99.8 -19.2 35.4 -6.7 20 89 A F + 0 0 66 -2,-1.1 2,-0.4 483,-0.2 486,-0.4 0.534 42.1 91.0 -91.8 -7.1 -19.3 34.9 -3.0 21 90 A L S S- 0 0 17 484,-0.1 486,-0.2 -3,-0.1 18,-0.1 -0.756 79.5-116.0-100.3 134.9 -16.4 37.2 -2.0 22 91 A S B +a 507 0A 10 484,-3.4 486,-2.5 -2,-0.4 487,-0.4 -0.364 63.8 108.5 -60.9 140.1 -16.8 40.9 -1.2 23 92 A G E S-B 39 0B 0 16,-1.7 16,-1.9 484,-0.2 2,-0.6 -0.904 71.6 -53.7 160.9 164.2 -14.9 43.0 -3.8 24 93 A W E +B 38 0B 37 -2,-0.3 14,-0.2 14,-0.2 2,-0.2 -0.557 61.7 160.1 -72.5 108.3 -14.7 45.4 -6.8 25 94 A H E -B 37 0B 15 12,-2.3 12,-1.3 -2,-0.6 2,-0.4 -0.648 35.6-112.7-118.2 177.7 -16.8 43.8 -9.5 26 95 A T E +B 36 0B 67 10,-0.2 2,-0.2 -2,-0.2 10,-0.2 -0.957 31.7 179.3-126.5 136.3 -18.4 45.3 -12.6 27 96 A I E -B 35 0B 0 8,-2.4 8,-1.0 -2,-0.4 2,-0.5 -0.724 27.5-120.0-125.9 172.6 -22.1 45.7 -13.4 28 97 A Y E -B 34 0B 80 -20,-2.1 -24,-0.4 -2,-0.2 -21,-0.1 -0.870 24.6-147.7-122.2 99.6 -24.4 47.0 -16.0 29 98 A L > - 0 0 9 4,-2.4 3,-4.6 -2,-0.5 4,-0.3 0.065 45.3 -86.6 -51.8 171.1 -26.9 49.9 -15.0 30 99 A P T 3 S+ 0 0 18 0, 0.0 -28,-1.4 0, 0.0 -1,-0.1 0.851 134.0 68.2 -61.9 -29.2 -30.3 50.0 -16.7 31 100 A D T 3 S- 0 0 65 -30,-0.2 -2,-0.1 57,-0.2 -3,-0.0 0.865 116.2-124.4 -33.6 -39.4 -28.5 51.9 -19.4 32 101 A a < + 0 0 53 -3,-4.6 -1,-0.1 1,-0.3 -3,-0.1 0.707 69.6 140.8 75.4 29.4 -26.9 48.5 -19.8 33 102 A R - 0 0 171 -4,-0.3 -4,-2.4 1,-0.0 -1,-0.3 -0.860 51.0-117.4-104.9 144.3 -23.7 50.6 -19.2 34 103 A P E +B 28 0B 85 0, 0.0 2,-0.3 0, 0.0 -6,-0.2 -0.369 34.7 162.4 -87.6 160.7 -20.8 49.4 -17.1 35 104 A L E -B 27 0B 34 -8,-1.0 -8,-2.4 -2,-0.1 2,-0.7 -0.892 38.5-118.9-167.0 147.4 -19.3 50.8 -13.9 36 105 A T E +B 26 0B 38 -2,-0.3 -10,-0.2 -10,-0.2 2,-0.2 -0.874 41.3 178.3-108.9 107.8 -17.0 49.1 -11.5 37 106 A V E -B 25 0B 0 -12,-1.3 -12,-2.3 -2,-0.7 2,-0.6 -0.520 33.9-109.5-108.7 165.0 -18.7 48.9 -8.0 38 107 A L E -BC 24 50B 8 12,-0.5 12,-2.5 -14,-0.2 2,-0.5 -0.872 33.6-156.0 -97.1 117.1 -17.9 47.5 -4.5 39 108 A b E -BC 23 49B 0 -16,-1.9 -16,-1.7 -2,-0.6 2,-0.9 -0.835 6.9-154.2 -98.8 122.6 -20.1 44.5 -3.8 40 109 A D E + C 0 48B 14 8,-2.9 8,-2.0 -2,-0.5 3,-0.2 -0.827 23.2 166.5 -95.0 103.0 -20.7 43.6 -0.2 41 110 A M + 0 0 10 -2,-0.9 -1,-0.1 5,-0.3 466,-0.1 0.518 64.9 58.0 -93.1 -1.6 -21.5 39.9 -0.4 42 111 A D S S+ 0 0 49 4,-0.1 2,-0.5 -3,-0.1 3,-0.5 0.631 83.2 84.7-110.1 -17.5 -21.2 39.2 3.3 43 112 A T S > S- 0 0 36 1,-0.3 3,-1.3 -3,-0.2 5,-0.2 -0.814 100.5 -9.5-115.1 128.3 -23.7 41.3 5.2 44 113 A D T 3 S- 0 0 76 -2,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.954 137.9 -43.5 57.7 43.5 -27.3 40.9 6.0 45 114 A G T 3 S- 0 0 69 -3,-0.5 -1,-0.3 2,-0.0 2,-0.2 -0.006 100.1 -98.5 96.4 -27.4 -27.2 37.9 3.6 46 115 A G S < S+ 0 0 1 -3,-1.3 -5,-0.3 -6,-0.0 -4,-0.1 -0.553 79.5 109.4 115.4-178.2 -25.2 39.6 0.9 47 116 A G + 0 0 0 1,-0.2 -35,-0.2 -36,-0.2 2,-0.2 0.418 48.4 146.4 97.2 4.6 -25.9 41.3 -2.5 48 117 A W E -C 40 0B 2 -8,-2.0 -8,-2.9 -37,-0.2 2,-0.5 -0.486 39.6-150.2 -87.6 140.7 -25.1 44.9 -1.7 49 118 A T E -CD 39 216B 3 167,-2.8 167,-2.0 -10,-0.2 2,-0.6 -0.940 19.5-145.2-101.9 126.0 -23.7 47.7 -3.8 50 119 A V E +CD 38 215B 2 -12,-2.5 -12,-0.5 -2,-0.5 165,-0.3 -0.799 25.8 170.3 -98.2 113.1 -21.7 50.3 -1.8 51 120 A F E S+ 0 0 2 163,-2.2 30,-2.3 -2,-0.6 2,-0.3 0.562 70.5 34.3 -94.4 -10.3 -21.9 53.9 -2.9 52 121 A Q E +ED 80 214B 0 162,-1.2 162,-2.0 28,-0.2 2,-0.3 -0.993 61.3 169.3-148.1 140.2 -20.1 55.4 0.2 53 122 A R E +ED 79 213B 51 26,-1.6 26,-1.6 -2,-0.3 2,-0.3 -0.961 8.9 178.6-157.1 133.7 -17.4 54.3 2.5 54 123 A R E + D 0 212B 3 158,-2.3 158,-2.2 -2,-0.3 156,-0.0 -0.958 22.0 138.0-129.0 146.0 -15.2 55.7 5.3 55 124 A V S S+ 0 0 39 -2,-0.3 -1,-0.1 156,-0.2 158,-0.0 0.466 72.4 15.7-149.2 -48.2 -12.6 53.8 7.3 56 125 A D S S- 0 0 70 155,-0.0 155,-0.1 3,-0.0 154,-0.0 -0.002 86.7-112.1-142.6 20.5 -9.3 55.5 8.0 57 126 A G S S+ 0 0 26 153,-0.2 128,-0.1 1,-0.2 20,-0.0 0.490 75.7 131.4 57.9 2.9 -9.6 59.2 7.4 58 127 A S + 0 0 77 2,-0.1 2,-0.3 1,-0.0 -1,-0.2 0.709 59.3 56.8 -59.9 -21.9 -7.2 58.8 4.5 59 128 A V S S- 0 0 17 15,-0.0 2,-0.9 20,-0.0 126,-0.2 -0.890 80.4-121.9-125.7 145.9 -9.4 60.9 2.1 60 129 A D + 0 0 92 -2,-0.3 13,-0.1 1,-0.1 124,-0.1 -0.721 23.5 179.0 -94.4 105.1 -10.9 64.4 2.2 61 130 A F + 0 0 5 -2,-0.9 2,-0.9 122,-0.2 -1,-0.1 0.222 58.2 96.7 -86.1 10.9 -14.7 64.4 1.9 62 131 A Y + 0 0 62 89,-0.0 -1,-0.2 90,-0.0 2,-0.1 -0.376 61.4 144.1 -96.9 58.5 -15.0 68.2 2.1 63 132 A R - 0 0 45 -2,-0.9 89,-0.7 1,-0.1 90,-0.2 -0.391 47.8-105.4-102.2 171.6 -15.3 68.5 -1.6 64 133 A D > - 0 0 46 87,-0.2 4,-1.6 88,-0.1 3,-0.3 -0.217 41.1 -89.9 -88.7 179.0 -17.2 70.8 -4.0 65 134 A W H > S+ 0 0 21 1,-0.2 4,-1.7 2,-0.2 3,-0.1 0.875 122.0 50.5 -57.0 -48.6 -20.3 70.0 -6.3 66 135 A A H > S+ 0 0 45 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.806 110.5 50.6 -63.6 -32.6 -18.4 68.9 -9.4 67 136 A T H > S+ 0 0 29 -3,-0.3 4,-0.6 2,-0.2 -1,-0.2 0.819 112.6 44.5 -78.7 -31.7 -16.3 66.4 -7.4 68 137 A Y H < S+ 0 0 0 -4,-1.6 15,-2.4 2,-0.2 -2,-0.2 0.740 106.5 66.3 -76.4 -23.6 -19.3 64.8 -5.7 69 138 A K H < S+ 0 0 58 -4,-1.7 15,-1.9 13,-0.2 16,-0.4 0.905 115.0 23.7 -60.0 -45.4 -20.9 64.8 -9.1 70 139 A Q H < S- 0 0 76 -4,-1.1 -1,-0.2 12,-0.2 168,-0.2 0.382 114.3-108.9-105.5 -3.9 -18.5 62.3 -10.5 71 140 A G < - 0 0 4 -4,-0.6 2,-0.2 -5,-0.1 10,-0.2 0.198 32.7-154.1 84.6 149.2 -17.3 60.5 -7.4 72 141 A F E +F 80 0B 7 8,-1.2 8,-1.6 -4,-0.1 2,-0.1 -0.750 41.7 61.3-140.8-172.9 -14.0 60.7 -5.7 73 142 A G E S-F 79 0B 0 6,-0.2 167,-2.2 -2,-0.2 2,-0.4 -0.432 75.5 -58.8 92.7-158.6 -11.7 58.6 -3.4 74 143 A S B > -k 240 0C 24 4,-3.3 3,-1.7 165,-0.2 167,-0.2 -0.990 17.9-137.0-139.3 141.7 -10.1 55.3 -3.8 75 144 A R T 3 S+ 0 0 33 165,-3.1 166,-0.1 -2,-0.4 -1,-0.1 0.667 112.1 53.4 -59.6 -19.1 -11.1 51.7 -4.4 76 145 A L T 3 S- 0 0 59 164,-0.2 -1,-0.3 2,-0.1 2,-0.1 0.486 126.7 -3.5 -97.5 -5.6 -8.6 50.8 -1.7 77 146 A G S < S- 0 0 6 -3,-1.7 2,-0.1 1,-0.3 -20,-0.0 -0.354 112.4 -2.5-147.8-132.9 -10.0 53.1 0.9 78 147 A E + 0 0 0 -2,-0.1 -4,-3.3 -26,-0.0 -1,-0.3 -0.457 67.0 164.2 -72.4 149.0 -12.7 55.8 1.4 79 148 A F E -EF 53 73B 1 -26,-1.6 -26,-1.6 -6,-0.3 2,-0.4 -0.964 35.8-147.1-162.9 149.4 -14.8 56.7 -1.7 80 149 A W E -EF 52 72B 0 -8,-1.6 -8,-1.2 -2,-0.3 -28,-0.2 -0.993 18.3-145.4-114.9 132.7 -17.9 58.3 -3.0 81 150 A L - 0 0 2 -30,-2.3 4,-0.3 -2,-0.4 -29,-0.1 0.520 48.8-107.4 -71.8 -5.6 -19.4 56.7 -6.1 82 151 A G > - 0 0 0 -31,-0.3 4,-2.4 3,-0.1 -13,-0.2 0.294 19.3-102.5 83.2 142.6 -20.6 60.1 -7.5 83 152 A N H > S+ 0 0 2 -15,-2.4 4,-3.2 2,-0.2 5,-0.2 0.899 117.9 55.8 -70.5 -41.6 -24.2 61.4 -7.7 84 153 A D H > S+ 0 0 65 -15,-1.9 4,-2.3 1,-0.2 5,-0.3 0.989 113.5 42.9 -48.0 -62.2 -24.7 60.8 -11.4 85 154 A N H > S+ 0 0 42 -16,-0.4 4,-1.3 -4,-0.3 -2,-0.2 0.888 113.1 51.8 -49.9 -48.3 -23.8 57.1 -10.8 86 155 A I H X S+ 0 0 2 -4,-2.4 4,-2.0 2,-0.2 5,-0.4 0.918 111.2 48.4 -60.5 -44.7 -25.9 56.9 -7.6 87 156 A H H >X S+ 0 0 55 -4,-3.2 4,-1.9 1,-0.2 3,-0.9 0.994 112.2 47.5 -47.1 -73.9 -28.9 58.3 -9.5 88 157 A A H 3< S+ 0 0 22 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.665 114.0 51.0 -39.9 -25.9 -28.5 55.9 -12.4 89 158 A L H 3< S+ 0 0 24 -4,-1.3 -1,-0.2 -5,-0.3 4,-0.2 0.868 123.0 20.0 -92.7 -39.9 -28.1 53.0 -9.9 90 159 A T H X< S+ 0 0 2 -4,-2.0 2,-3.6 -3,-0.9 3,-0.9 0.892 107.3 72.8 -96.1 -53.1 -31.1 53.4 -7.6 91 160 A A T 3< S+ 0 0 32 -4,-1.9 -1,-0.2 -5,-0.4 3,-0.1 -0.223 82.1 74.4 -71.3 57.3 -33.6 55.6 -9.5 92 161 A Q T 3 S- 0 0 78 -2,-3.6 -1,-0.2 1,-0.4 2,-0.2 0.486 110.6 -30.5-116.1 -57.5 -34.6 52.8 -12.0 93 162 A G S < S- 0 0 32 -3,-0.9 -1,-0.4 -4,-0.2 2,-0.3 -0.547 93.3 -33.5-139.3-156.8 -36.8 50.7 -9.6 94 163 A T + 0 0 94 -2,-0.2 2,-0.3 -3,-0.1 125,-0.1 -0.554 60.1 160.0 -73.9 133.7 -37.2 49.5 -6.0 95 164 A S - 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