==== 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-SEP-03 1UL9 . COMPND 2 MOLECULE: GALECTIN-2; . SOURCE 2 ORGANISM_SCIENTIFIC: COPRINOPSIS CINEREA; . AUTHOR P.J.WALSER,P.W.HAEBEL,M.KUENZLER,U.KUES,M.AEBI,N.BAN . 300 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14165.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 202 67.3 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 . 128 42.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 44 14.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 2 0 0 8 6 6 0 0 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 0 4 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 M 0 0 111 0, 0.0 139,-2.9 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 134.6 23.0 52.7 3.3 2 2 A L E +A 139 0A 88 137,-0.2 2,-0.3 135,-0.0 137,-0.2 -0.807 360.0 175.0 -99.1 134.0 20.5 53.9 5.9 3 3 A Y E -A 138 0A 24 135,-2.5 135,-2.1 -2,-0.4 2,-0.6 -0.929 27.0-140.4-132.0 156.8 17.2 52.2 6.5 4 4 A H E -A 137 0A 101 -2,-0.3 2,-0.8 133,-0.2 133,-0.2 -0.922 20.6-162.5-120.2 100.1 14.4 52.7 9.0 5 5 A L E -A 136 0A 0 131,-1.9 131,-2.1 -2,-0.6 2,-0.2 -0.774 8.0-155.1 -89.6 108.6 13.2 49.2 10.2 6 6 A F > - 0 0 106 -2,-0.8 3,-0.8 4,-0.3 119,-0.3 -0.540 28.9 -92.2 -83.5 149.3 9.8 49.5 11.8 7 7 A V T 3 S+ 0 0 38 1,-0.2 119,-0.2 -2,-0.2 3,-0.1 -0.233 110.6 14.0 -59.6 146.3 8.6 46.9 14.3 8 8 A N T 3 S+ 0 0 98 117,-1.4 -1,-0.2 1,-0.2 2,-0.2 0.894 121.7 76.3 52.1 44.7 6.6 44.0 12.9 9 9 A N E < -F 125 0B 94 116,-1.4 116,-2.3 -3,-0.8 2,-0.3 -0.826 66.6-140.0-157.8-169.0 7.8 45.0 9.4 10 10 A Q E -F 124 0B 91 -2,-0.2 2,-0.4 114,-0.2 -4,-0.3 -0.921 8.7-124.8-154.8 179.1 11.0 44.7 7.3 11 11 A V E -F 123 0B 18 112,-1.7 112,-1.8 -2,-0.3 2,-0.6 -0.999 19.1-133.7-137.0 134.0 13.2 46.5 4.9 12 12 A K E -F 122 0B 159 -2,-0.4 110,-0.2 110,-0.2 2,-0.1 -0.782 29.9-128.6 -87.5 122.2 14.3 45.2 1.5 13 13 A L E - 0 0 12 108,-2.3 3,-0.1 -2,-0.6 4,-0.0 -0.449 2.1-138.3 -73.5 142.9 18.1 45.8 1.1 14 14 A Q E S+ 0 0 123 -2,-0.1 2,-0.3 1,-0.1 -1,-0.1 0.842 93.2 21.9 -66.8 -32.7 19.4 47.5 -2.0 15 15 A N E S- 0 0 125 3,-0.0 -1,-0.1 106,-0.0 -2,-0.0 -0.938 99.9 -86.6-133.5 155.9 22.1 44.9 -2.1 16 16 A D E - 0 0 87 -2,-0.3 2,-0.8 1,-0.1 105,-0.2 -0.321 36.8-125.0 -61.6 139.9 22.5 41.4 -0.7 17 17 A F E +F 120 0B 1 103,-2.7 103,-2.1 4,-0.1 -1,-0.1 -0.820 57.8 142.4 -85.4 116.3 23.8 41.2 2.8 18 18 A K > - 0 0 91 -2,-0.8 3,-3.0 101,-0.2 77,-0.4 -0.790 51.6 -28.6-144.8-174.1 26.8 38.9 2.3 19 19 A P T 3 S+ 0 0 41 0, 0.0 77,-0.2 0, 0.0 -1,-0.2 -0.131 129.7 20.4 -46.4 135.5 30.5 38.3 3.4 20 20 A E T 3 S+ 0 0 20 75,-3.1 124,-0.2 1,-0.3 76,-0.1 0.119 96.0 132.1 88.5 -16.4 32.1 41.6 4.5 21 21 A S < - 0 0 3 -3,-3.0 74,-2.2 122,-0.1 2,-0.4 -0.361 39.1-162.4 -69.0 144.6 28.7 43.2 5.0 22 22 A V E -BC 94 141A 1 119,-2.0 119,-3.1 72,-0.2 2,-0.5 -0.994 8.3-165.0-132.1 133.4 28.0 45.1 8.2 23 23 A A E -BC 93 140A 0 70,-2.6 70,-2.1 -2,-0.4 2,-0.9 -0.968 3.4-165.7-120.4 114.4 24.6 46.0 9.7 24 24 A A E -BC 92 139A 11 115,-3.4 115,-2.2 -2,-0.5 2,-0.5 -0.851 10.8-172.5-103.4 98.0 24.7 48.6 12.4 25 25 A I E -BC 91 138A 4 66,-2.7 66,-2.3 -2,-0.9 2,-0.4 -0.807 5.7-179.1 -92.9 124.8 21.3 48.5 14.1 26 26 A R E -BC 90 137A 129 111,-3.4 111,-3.1 -2,-0.5 2,-0.3 -0.983 14.8-150.1-130.3 139.1 20.6 51.3 16.6 27 27 A S - 0 0 6 62,-2.5 109,-0.1 -2,-0.4 107,-0.0 -0.819 13.0-146.1-105.5 144.8 17.6 52.0 18.8 28 28 A S S S+ 0 0 90 107,-0.4 2,-0.3 -2,-0.3 60,-0.1 0.350 83.6 17.3 -88.8 7.7 16.5 55.4 20.0 29 29 A A - 0 0 30 60,-0.2 104,-0.6 104,-0.1 2,-0.4 -0.992 61.1-135.1-167.3 166.3 15.3 53.9 23.3 30 30 A F B -K 132 0C 53 -2,-0.3 2,-1.3 102,-0.2 102,-0.2 -0.927 14.8-159.5-134.6 106.5 15.3 51.0 25.7 31 31 A N > - 0 0 74 100,-2.9 3,-2.5 -2,-0.4 101,-0.0 -0.724 4.0-166.7 -90.1 91.3 12.0 49.9 27.0 32 32 A S T 3 S+ 0 0 84 -2,-1.3 -1,-0.2 1,-0.3 99,-0.1 0.631 86.0 56.0 -52.0 -19.1 13.0 48.0 30.2 33 33 A K T 3 S+ 0 0 180 97,-0.1 -1,-0.3 98,-0.1 2,-0.1 0.149 85.6 120.1-102.0 19.0 9.5 46.5 30.4 34 34 A G < - 0 0 8 -3,-2.5 96,-0.2 1,-0.1 97,-0.1 -0.331 50.3-141.1 -81.5 164.9 9.5 45.1 26.9 35 35 A G - 0 0 25 94,-2.7 96,-0.3 1,-0.3 -1,-0.1 -0.112 53.6 -20.9-106.0-155.4 9.1 41.4 25.9 36 36 A T - 0 0 74 19,-0.1 92,-0.5 94,-0.1 2,-0.4 -0.282 61.9-166.4 -55.0 127.8 10.6 39.1 23.4 37 37 A T E -GH 54 127B 0 17,-2.7 17,-3.0 90,-0.1 2,-0.4 -0.983 2.5-163.2-125.5 125.8 12.2 41.1 20.5 38 38 A V E -GH 53 126B 17 88,-3.2 88,-2.8 -2,-0.4 2,-0.4 -0.895 15.3-175.3-118.9 138.5 13.2 39.5 17.2 39 39 A F E -GH 52 125B 1 13,-1.9 13,-2.4 -2,-0.4 2,-0.4 -0.996 14.0-171.0-125.4 125.7 15.5 40.4 14.3 40 40 A N E -GH 51 124B 12 84,-2.1 84,-3.2 -2,-0.4 2,-0.7 -0.960 18.0-150.5-121.1 136.2 15.6 38.1 11.2 41 41 A F E -GH 50 123B 0 9,-2.4 8,-1.8 -2,-0.4 9,-1.2 -0.922 29.6-163.0-102.7 113.0 18.0 38.3 8.3 42 42 A L E -GH 48 122B 18 80,-3.0 79,-3.5 -2,-0.7 80,-2.0 -0.722 13.9-137.3-103.2 149.1 16.0 36.8 5.4 43 43 A S > - 0 0 4 4,-1.7 3,-2.4 77,-0.3 77,-0.2 -0.446 41.1 -96.5 -90.3 171.8 17.0 35.5 2.0 44 44 A A T 3 S+ 0 0 89 75,-0.4 -1,-0.1 1,-0.3 76,-0.1 0.873 129.4 54.3 -56.3 -36.6 15.0 36.3 -1.2 45 45 A G T 3 S- 0 0 38 2,-0.1 -1,-0.3 1,-0.1 23,-0.2 0.345 121.4-111.4 -80.4 7.7 13.3 33.0 -0.7 46 46 A E < + 0 0 109 -3,-2.4 2,-0.4 1,-0.3 -2,-0.1 0.814 63.7 154.0 67.0 32.1 12.3 34.0 2.8 47 47 A N - 0 0 24 20,-0.1 -4,-1.7 21,-0.1 2,-1.3 -0.787 49.9-122.5 -89.0 134.0 14.6 31.5 4.5 48 48 A I E +GI 42 66B 10 18,-2.3 18,-1.9 -2,-0.4 -6,-0.2 -0.657 35.9 174.2 -81.7 96.4 15.5 32.8 8.0 49 49 A L E S+ 0 0 4 -8,-1.8 2,-0.4 -2,-1.3 66,-0.4 0.884 73.5 17.3 -69.0 -41.5 19.4 32.8 7.7 50 50 A L E -G 41 0B 0 -9,-1.2 -9,-2.4 -3,-0.2 2,-0.5 -0.965 67.2-172.1-139.7 119.3 19.8 34.4 11.1 51 51 A H E -GI 40 64B 22 13,-2.3 13,-1.5 -2,-0.4 2,-0.6 -0.955 3.9-169.2-111.8 123.6 17.2 34.6 13.8 52 52 A I E -GI 39 63B 0 -13,-2.4 -13,-1.9 -2,-0.5 2,-0.7 -0.928 4.4-175.2-117.9 104.9 18.0 36.7 16.8 53 53 A S E -GI 38 62B 4 9,-3.3 9,-2.8 -2,-0.6 2,-0.7 -0.859 6.7-165.2-107.2 102.5 15.5 36.3 19.7 54 54 A I E -GI 37 61B 0 -17,-3.0 -17,-2.7 -2,-0.7 7,-0.2 -0.774 10.4-178.3 -87.3 114.5 16.1 38.6 22.6 55 55 A R E >>> + I 0 60B 46 5,-2.7 5,-1.8 -2,-0.7 3,-0.8 -0.800 15.5 177.1-119.6 90.4 14.0 37.2 25.5 56 56 A P G >45S+ 0 0 33 0, 0.0 3,-1.2 0, 0.0 -1,-0.2 0.914 84.1 58.2 -57.5 -41.1 14.3 39.3 28.7 57 57 A G G 345S+ 0 0 83 1,-0.3 -2,-0.0 2,-0.1 -22,-0.0 0.815 114.7 36.1 -57.8 -32.3 11.8 37.0 30.5 58 58 A E G <45S- 0 0 94 -3,-0.8 -1,-0.3 2,-0.2 3,-0.1 0.398 106.2-130.9 -99.8 1.1 14.1 34.0 29.9 59 59 A N T <<5S+ 0 0 80 -3,-1.2 21,-1.6 -4,-0.7 22,-0.3 0.867 71.5 104.2 50.3 41.7 17.2 36.2 30.4 60 60 A V E < -IJ 55 79B 11 -5,-1.8 -5,-2.7 19,-0.3 2,-0.5 -0.980 64.7-139.3-148.4 159.2 18.6 34.8 27.2 61 61 A I E -IJ 54 78B 0 17,-2.5 17,-0.9 -2,-0.3 2,-0.4 -0.989 25.4-157.4-121.9 119.6 19.3 35.7 23.6 62 62 A V E -IJ 53 77B 0 -9,-2.8 -9,-3.3 -2,-0.5 2,-0.4 -0.793 6.7-165.5-101.6 140.0 18.6 32.8 21.2 63 63 A F E +IJ 52 76B 1 13,-2.4 13,-2.1 -2,-0.4 2,-0.3 -0.978 24.5 142.3-123.0 136.4 20.1 32.5 17.7 64 64 A N E -I 51 0B 1 -13,-1.5 -13,-2.3 -2,-0.4 2,-0.3 -0.915 31.1-140.0-157.6-177.3 18.7 30.0 15.1 65 65 A S E + 0 0 5 -2,-0.3 8,-1.2 -15,-0.2 2,-0.3 -0.987 17.5 168.5-152.9 153.0 17.9 29.4 11.4 66 66 A R E -I 48 0B 71 -18,-1.9 -18,-2.3 -2,-0.3 6,-0.1 -0.939 34.1-110.0-167.2 145.0 15.2 27.7 9.4 67 67 A L > - 0 0 94 4,-0.3 3,-2.0 -2,-0.3 -20,-0.1 -0.322 47.8 -97.7 -70.5 162.1 13.9 27.4 5.8 68 68 A K T 3 S+ 0 0 99 1,-0.3 -1,-0.1 -23,-0.2 -21,-0.1 0.891 125.5 19.9 -47.4 -48.3 10.7 29.2 4.9 69 69 A N T 3 S+ 0 0 151 2,-0.1 -1,-0.3 0, 0.0 2,-0.2 -0.107 112.5 100.6-114.8 34.1 8.7 25.9 5.4 70 70 A G S < S- 0 0 31 -3,-2.0 2,-0.2 1,-0.0 -4,-0.0 -0.581 73.7 -95.7-113.3 177.5 11.3 24.1 7.5 71 71 A A - 0 0 89 -2,-0.2 -4,-0.3 1,-0.1 -6,-0.1 -0.638 41.4-101.4 -93.9 150.1 11.8 23.4 11.2 72 72 A W - 0 0 112 -2,-0.2 -6,-0.2 -6,-0.1 3,-0.1 -0.354 38.6-139.6 -63.5 148.5 13.9 25.4 13.5 73 73 A G - 0 0 31 -8,-1.2 -1,-0.1 1,-0.2 2,-0.0 -0.193 46.6 -47.9 -95.8-166.2 17.3 23.8 14.2 74 74 A P - 0 0 101 0, 0.0 -1,-0.2 0, 0.0 2,-0.2 -0.381 64.6-121.7 -65.0 144.0 19.1 23.6 17.6 75 75 A E - 0 0 81 -11,-0.1 2,-0.4 -3,-0.1 -11,-0.2 -0.593 16.0-150.1 -88.1 149.0 19.2 26.9 19.4 76 76 A E E -J 63 0B 71 -13,-2.1 -13,-2.4 -2,-0.2 2,-0.3 -0.947 22.7-161.0-115.9 139.0 22.4 28.6 20.4 77 77 A R E +J 62 0B 118 -2,-0.4 -15,-0.2 -15,-0.2 -17,-0.0 -0.822 24.7 174.3-127.2 164.6 22.3 30.8 23.5 78 78 A I E -J 61 0B 31 -17,-0.9 -17,-2.5 -2,-0.3 32,-0.0 -0.939 46.3 -89.6-159.6 140.5 24.0 33.6 25.4 79 79 A P E -J 60 0B 77 0, 0.0 -19,-0.3 0, 0.0 -20,-0.1 -0.218 25.6-149.6 -56.7 145.6 22.8 35.4 28.6 80 80 A Y > + 0 0 32 -21,-1.6 3,-0.6 -25,-0.2 4,-0.3 0.873 65.3 97.5 -82.5 -44.0 20.7 38.6 28.1 81 81 A A T 3 S+ 0 0 44 -22,-0.3 0, 0.0 1,-0.2 0, 0.0 -0.141 91.5 11.9 -52.5 139.1 21.7 40.5 31.2 82 82 A E T 3 S+ 0 0 172 2,-0.2 -1,-0.2 1,-0.1 3,-0.1 0.907 98.2 104.8 59.3 45.7 24.4 43.2 30.7 83 83 A K < + 0 0 22 -3,-0.6 22,-2.4 1,-0.2 23,-1.5 0.607 68.6 55.6-121.1 -32.4 24.3 43.1 26.9 84 84 A F - 0 0 18 -4,-0.3 -1,-0.2 21,-0.2 -2,-0.2 -0.870 65.2-149.0-112.5 141.5 22.4 46.3 26.1 85 85 A R > - 0 0 113 -2,-0.4 3,-0.7 3,-0.1 0, 0.0 -0.880 34.0-111.7-108.8 105.7 23.2 49.9 27.1 86 86 A P T 3 S+ 0 0 73 0, 0.0 -58,-0.0 0, 0.0 -57,-0.0 -0.355 86.6 24.9 -70.4 159.4 20.2 52.2 27.5 87 87 A P T 3 S+ 0 0 89 0, 0.0 -56,-0.0 0, 0.0 -2,-0.0 -0.981 133.8 27.9 -91.2 2.1 19.0 54.6 26.2 88 88 A N S < S- 0 0 93 -3,-0.7 -3,-0.1 -60,-0.1 -60,-0.1 -0.573 76.1-180.0-121.6 68.9 20.5 53.8 22.8 89 89 A P - 0 0 0 0, 0.0 -62,-2.5 0, 0.0 2,-0.3 -0.312 9.4-167.2 -66.7 152.9 21.0 50.0 22.7 90 90 A S E -B 26 0A 23 -64,-0.2 2,-0.4 2,-0.0 -64,-0.2 -0.931 22.0-156.2-142.0 164.7 22.5 48.5 19.5 91 91 A I E -B 25 0A 2 -66,-2.3 -66,-2.7 -2,-0.3 2,-0.5 -0.992 11.8-165.6-140.0 129.6 23.1 45.3 17.6 92 92 A T E -BD 24 103A 24 11,-2.9 11,-2.7 -2,-0.4 2,-0.5 -0.975 4.2-170.5-123.7 122.3 25.9 44.9 15.1 93 93 A V E -BD 23 102A 0 -70,-2.1 -70,-2.6 -2,-0.5 2,-0.4 -0.942 2.7-175.4-115.5 130.0 25.9 42.0 12.7 94 94 A I E -BD 22 101A 11 7,-2.5 7,-2.6 -2,-0.5 2,-0.6 -0.986 20.3-138.0-127.1 132.4 28.8 41.2 10.4 95 95 A D E + D 0 100A 2 -74,-2.2 -75,-3.1 -2,-0.4 5,-0.2 -0.799 19.9 178.5 -89.9 117.2 29.0 38.5 7.8 96 96 A H - 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