==== 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 14-OCT-10 3APB . COMPND 2 MOLECULE: GALECTIN-8; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR T.MATSUZAKA,H.IDEO,K.YAMASHITA,T.NONAKA . 304 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15134.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 203 66.8 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 . 143 47.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 2.0 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 . 37 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 5.3 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 . 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 2 4 2 4 7 3 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 2 0 2 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 3 A L 0 0 206 0, 0.0 2,-0.4 0, 0.0 117,-0.0 0.000 360.0 360.0 360.0 178.8 41.5 7.2 26.6 2 4 A S + 0 0 88 1,-0.1 0, 0.0 2,-0.0 0, 0.0 -0.443 360.0 173.3 -85.8 123.1 40.6 3.8 25.0 3 5 A L + 0 0 44 -2,-0.4 3,-0.4 3,-0.0 -1,-0.1 -0.281 38.1 141.9-106.0 43.1 39.3 3.4 21.5 4 6 A N + 0 0 111 1,-0.2 148,-0.2 146,-0.0 -2,-0.0 -0.390 52.2 26.7 -81.6 161.3 39.4 -0.4 21.6 5 7 A N S S+ 0 0 106 1,-0.2 146,-0.5 -2,-0.1 2,-0.4 0.867 71.4 178.0 57.2 45.1 36.9 -2.7 20.0 6 8 A L - 0 0 39 -3,-0.4 2,-0.3 144,-0.1 144,-0.2 -0.673 9.4-178.0 -75.8 131.3 35.6 -0.4 17.3 7 9 A Q E +A 149 0A 75 142,-3.3 142,-2.2 -2,-0.4 -1,-0.0 -0.784 49.1 35.1-128.8 169.5 33.0 -2.2 15.2 8 10 A N E S- 0 0 83 -2,-0.3 2,-0.2 1,-0.2 -1,-0.2 0.880 77.5-171.8 56.2 45.4 30.7 -1.7 12.2 9 11 A I E - 0 0 72 -3,-0.2 2,-0.4 139,-0.1 139,-0.2 -0.466 13.5-168.4 -77.4 133.7 33.4 0.4 10.6 10 12 A I E -A 147 0A 70 137,-2.5 137,-2.2 -2,-0.2 2,-0.4 -0.990 6.4-155.1-122.0 131.1 32.7 2.3 7.4 11 13 A Y E S-A 146 0A 155 -2,-0.4 135,-0.3 135,-0.2 134,-0.1 -0.838 70.1 -3.7-103.6 140.6 35.4 3.9 5.3 12 14 A N S S- 0 0 121 133,-2.6 -1,-0.2 -2,-0.4 133,-0.2 0.886 80.3-166.7 48.8 53.6 35.0 6.9 3.0 13 15 A P - 0 0 17 0, 0.0 131,-0.4 0, 0.0 2,-0.3 -0.372 25.5-106.4 -67.0 148.7 31.2 7.2 3.4 14 16 A V - 0 0 122 2,-0.1 129,-0.0 129,-0.1 -2,-0.0 -0.586 46.2-104.1 -74.5 136.1 29.3 9.4 0.9 15 17 A I S S+ 0 0 42 -2,-0.3 2,-0.1 2,-0.1 124,-0.1 -0.936 106.4 55.2-107.8 131.4 28.2 12.7 2.5 16 18 A P S S- 0 0 97 0, 0.0 2,-0.5 0, 0.0 123,-0.2 0.316 85.6-171.2 -67.3 136.7 25.3 13.3 3.3 17 19 A F E +F 138 0B 30 121,-2.6 121,-2.5 -2,-0.1 2,-0.4 -0.921 15.9 174.1-105.5 128.3 25.5 10.2 5.4 18 20 A V E +F 137 0B 73 -2,-0.5 2,-0.4 119,-0.2 119,-0.2 -0.926 18.0 166.4-133.1 110.1 22.4 8.9 7.2 19 21 A G E -F 136 0B 15 117,-2.9 117,-3.2 -2,-0.4 2,-0.3 -0.950 39.3-114.3-132.0 147.4 22.9 5.5 8.9 20 22 A T E -F 135 0B 123 -2,-0.4 115,-0.3 115,-0.2 -2,-0.0 -0.574 34.6-127.1 -72.4 129.3 21.3 3.2 11.4 21 23 A I - 0 0 10 113,-2.8 -1,-0.0 -2,-0.3 4,-0.0 -0.682 17.6-134.5 -79.3 132.4 23.4 2.9 14.6 22 24 A P S S+ 0 0 55 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.710 76.6 10.6 -72.8 -18.3 23.9 -0.8 15.2 23 25 A D S S- 0 0 105 3,-0.0 2,-0.2 0, 0.0 -2,-0.0 -0.914 93.3 -71.0-146.8 175.9 23.1 -0.9 18.9 24 26 A Q - 0 0 92 -2,-0.3 2,-1.8 1,-0.1 107,-0.1 -0.436 42.2-122.2 -74.6 137.0 21.6 1.3 21.7 25 27 A L + 0 0 1 108,-0.5 108,-0.1 105,-0.4 -1,-0.1 -0.566 45.7 169.7 -81.8 82.7 23.7 4.2 23.0 26 28 A D > - 0 0 74 -2,-1.8 3,-2.4 1,-0.2 81,-0.3 -0.492 49.9 -72.9 -85.9 158.7 23.9 3.3 26.6 27 29 A P T 3 S+ 0 0 80 0, 0.0 81,-0.2 0, 0.0 -1,-0.2 -0.268 124.7 33.5 -48.0 138.7 26.2 5.1 29.1 28 30 A G T 3 S+ 0 0 55 79,-3.0 80,-0.1 1,-0.3 2,-0.1 0.202 91.9 117.4 94.5 -14.2 29.8 4.0 28.2 29 31 A T < - 0 0 11 -3,-2.4 78,-2.3 78,-0.3 -1,-0.3 -0.413 44.9-160.9 -82.4 159.8 29.3 3.6 24.5 30 32 A L E -BC 106 150A 14 120,-1.8 120,-2.7 76,-0.2 2,-0.4 -0.992 19.0-150.2-145.3 158.0 31.1 5.7 21.9 31 33 A I E -BC 105 149A 1 74,-2.4 74,-2.9 -2,-0.3 2,-0.5 -0.985 16.1-160.2-122.9 128.8 31.1 6.9 18.3 32 34 A V E -BC 104 148A 1 116,-2.7 116,-2.5 -2,-0.4 2,-0.5 -0.969 10.0-179.6-117.3 124.4 34.3 7.6 16.5 33 35 A I E -BC 103 147A 0 70,-2.9 70,-3.5 -2,-0.5 2,-0.4 -0.978 4.2-170.9-130.0 117.0 34.4 9.8 13.5 34 36 A R E +BC 102 146A 85 112,-2.5 111,-2.4 -2,-0.5 112,-1.7 -0.875 30.7 105.2-108.7 141.6 37.6 10.7 11.5 35 37 A G E -BC 101 144A 0 66,-2.2 66,-3.0 -2,-0.4 2,-0.3 -0.964 45.6-126.4-179.6-169.7 37.7 13.2 8.7 36 38 A H E - C 0 143A 49 107,-1.9 107,-2.7 -2,-0.3 64,-0.1 -0.962 20.2-121.8-154.1 158.8 38.8 16.7 7.6 37 39 A V - 0 0 1 59,-0.4 61,-3.0 62,-0.4 105,-0.1 -0.884 29.6-120.5-104.5 146.5 37.2 19.7 6.0 38 40 A P > - 0 0 35 0, 0.0 3,-1.8 0, 0.0 61,-0.1 -0.205 32.8 -97.8 -72.7 170.7 38.4 21.1 2.7 39 41 A S T 3 S+ 0 0 13 1,-0.3 171,-0.2 58,-0.1 58,-0.1 0.685 122.5 54.1 -66.7 -21.0 39.7 24.7 2.3 40 42 A D T 3 S+ 0 0 25 169,-0.1 2,-0.3 168,-0.0 -1,-0.3 0.347 84.7 113.4 -93.8 7.9 36.3 25.9 0.9 41 43 A A < + 0 0 0 -3,-1.8 3,-0.1 1,-0.1 56,-0.1 -0.604 34.6 174.4 -80.8 136.5 34.3 24.6 4.0 42 44 A D - 0 0 25 1,-0.4 26,-2.8 -2,-0.3 27,-0.6 0.649 68.4 -15.4-103.9 -24.5 32.6 26.9 6.4 43 45 A R B -G 67 0B 62 24,-0.2 98,-1.2 25,-0.1 -1,-0.4 -0.986 49.2-171.4-167.7 163.1 30.8 24.3 8.5 44 46 A F E -H 140 0B 2 22,-1.5 2,-0.3 -2,-0.3 96,-0.2 -0.947 15.6-144.4-154.1 167.6 29.7 20.7 8.9 45 47 A Q E -H 139 0B 43 94,-2.6 94,-2.2 -2,-0.3 2,-0.4 -0.998 10.9-158.2-142.5 146.7 27.5 18.8 11.3 46 48 A V E -HI 138 64B 1 18,-2.3 18,-3.0 -2,-0.3 2,-0.4 -0.984 21.5-168.2-115.9 132.2 27.1 15.5 13.1 47 49 A D E -HI 137 63B 3 90,-3.2 90,-3.0 -2,-0.4 2,-0.7 -0.986 20.1-152.3-127.3 130.4 23.6 14.7 14.3 48 50 A L E -HI 136 62B 0 14,-2.9 13,-2.1 -2,-0.4 14,-1.2 -0.899 37.9-170.7 -96.5 112.4 22.5 11.9 16.7 49 51 A Q E -HI 135 60B 13 86,-3.2 85,-2.2 -2,-0.7 86,-2.1 -0.748 37.5-132.0-115.4 149.3 18.9 11.4 15.5 50 52 A N E S- I 0 59B 61 9,-2.5 9,-0.6 -2,-0.3 3,-0.2 -0.847 87.1 -32.4 -92.3 92.8 15.7 9.6 16.5 51 53 A G S S- 0 0 19 -2,-1.0 84,-0.1 1,-0.1 83,-0.1 -0.193 70.2 -95.5 84.1-177.6 15.0 8.1 13.0 52 54 A S + 0 0 76 -3,-0.1 -1,-0.1 -34,-0.1 -32,-0.0 0.141 62.7 145.7-126.8 14.7 15.6 9.4 9.5 53 55 A S > - 0 0 58 -3,-0.2 5,-2.2 1,-0.1 -3,-0.1 -0.273 31.0-166.9 -56.7 137.4 12.3 11.1 8.7 54 56 A V T 5S+ 0 0 84 1,-0.3 -1,-0.1 3,-0.2 3,-0.0 0.826 75.1 52.9 -93.1 -42.2 12.6 14.2 6.5 55 57 A K T 5S+ 0 0 128 1,-0.3 -1,-0.3 2,-0.1 2,-0.2 -0.953 115.1 30.2-137.9 116.4 9.0 15.4 7.1 56 58 A P T 5S- 0 0 81 0, 0.0 -1,-0.3 0, 0.0 2,-0.3 0.633 116.0-116.8 -61.4 156.5 8.3 15.6 9.9 57 59 A R T 5 - 0 0 34 -2,-0.2 25,-0.4 135,-0.1 -3,-0.2 -0.482 31.1-109.4 -69.3 126.5 11.9 16.4 10.6 58 60 A A < - 0 0 9 -5,-2.2 -7,-0.1 -2,-0.3 -1,-0.1 -0.267 36.5-105.3 -56.8 138.9 13.6 13.7 12.8 59 61 A D E -I 50 0B 38 -9,-0.6 -9,-2.5 -3,-0.1 2,-0.6 -0.348 29.5-147.5 -61.8 144.2 14.4 14.8 16.3 60 62 A V E -IJ 49 79B 7 19,-2.1 19,-2.1 -11,-0.2 -11,-0.2 -0.951 15.0-174.5-120.0 109.4 18.1 15.4 16.9 61 63 A A E S+ 0 0 4 -13,-2.1 2,-0.4 -2,-0.6 66,-0.3 0.888 80.9 18.7 -68.1 -37.6 19.2 14.6 20.4 62 64 A F E -I 48 0B 1 -14,-1.2 -14,-2.9 16,-0.1 2,-0.5 -0.954 63.3-176.2-144.5 111.6 22.7 16.0 19.8 63 65 A H E -IJ 47 77B 10 14,-2.5 14,-1.7 -2,-0.4 2,-0.5 -0.967 8.1-170.9-107.5 120.1 23.7 18.3 16.9 64 66 A F E +IJ 46 76B 0 -18,-3.0 -18,-2.3 -2,-0.5 12,-0.2 -0.973 9.0 176.6-120.8 112.5 27.4 19.0 16.9 65 67 A N E - J 0 75B 4 10,-2.6 10,-2.5 -2,-0.5 2,-0.2 -0.829 14.8-163.0-133.4 87.6 28.3 21.8 14.4 66 68 A P E - J 0 74B 1 0, 0.0 -22,-1.5 0, 0.0 2,-0.4 -0.533 11.3-161.4 -67.4 136.2 31.9 23.1 14.0 67 69 A R E -GJ 43 73B 51 6,-3.2 6,-2.3 -2,-0.2 -24,-0.2 -0.994 9.3-165.8-125.4 132.7 32.0 26.4 12.2 68 70 A F + 0 0 11 -26,-2.8 29,-0.2 -2,-0.4 -25,-0.1 0.483 39.9 129.3-105.1 -5.8 35.2 27.6 10.6 69 71 A K S > S- 0 0 60 -27,-0.6 3,-2.0 2,-0.1 -2,-0.1 -0.288 83.8 -42.3 -58.6 135.2 34.6 31.3 9.9 70 72 A R T 3 S+ 0 0 134 1,-0.3 3,-0.1 2,-0.1 0, 0.0 -0.183 134.6 0.5 35.1-113.6 37.4 33.5 11.3 71 73 A A T 3 S- 0 0 100 1,-0.1 -1,-0.3 0, 0.0 22,-0.2 0.687 106.9-136.4 -76.2 -18.4 38.5 32.3 14.8 72 74 A G < - 0 0 18 -3,-2.0 2,-0.3 20,-0.1 -4,-0.2 0.127 25.3-160.6 92.6 159.8 36.0 29.5 14.8 73 75 A C E -J 67 0B 23 -6,-2.3 -6,-3.2 19,-0.1 2,-0.4 -0.955 17.6-124.5-161.5 173.0 33.5 27.9 17.1 74 76 A I E -JK 66 90B 0 16,-2.2 16,-3.2 -2,-0.3 2,-0.5 -0.996 21.5-158.4-126.7 126.7 31.4 24.8 17.7 75 77 A V E -JK 65 89B 1 -10,-2.5 -10,-2.6 -2,-0.4 2,-0.4 -0.900 7.6-170.1-104.8 129.4 27.6 25.0 18.1 76 78 A C E +JK 64 88B 1 12,-2.7 12,-2.9 -2,-0.5 2,-0.3 -0.955 18.1 144.9-120.2 142.6 25.7 22.3 19.9 77 79 A N E -J 63 0B 3 -14,-1.7 -14,-2.5 -2,-0.4 2,-0.3 -0.922 36.9-123.3-160.9 175.9 21.9 22.0 20.0 78 80 A T E - 0 0 3 -2,-0.3 7,-2.5 -16,-0.2 2,-0.5 -0.985 14.0-148.9-133.3 139.8 18.9 19.7 20.0 79 81 A L E +JL 60 84B 0 -19,-2.1 -19,-2.1 -2,-0.3 2,-0.4 -0.973 21.5 173.1-111.4 120.4 15.9 19.6 17.6 80 82 A I E > - L 0 83B 67 3,-2.4 3,-1.5 -2,-0.5 -22,-0.1 -1.000 68.8 -5.4-130.3 132.5 12.6 18.6 19.1 81 83 A N T 3 S- 0 0 128 -2,-0.4 -1,-0.1 1,-0.3 -23,-0.1 0.879 130.7 -55.5 50.2 46.2 9.2 18.7 17.3 82 84 A E T 3 S+ 0 0 74 -25,-0.4 2,-0.4 1,-0.2 -1,-0.3 0.609 116.9 112.5 64.7 17.0 10.9 20.4 14.3 83 85 A K E < -L 80 0B 158 -3,-1.5 -3,-2.4 139,-0.1 2,-0.2 -0.976 63.4-133.0-123.3 129.8 12.2 23.2 16.5 84 86 A W E -L 79 0B 30 -2,-0.4 -5,-0.2 -5,-0.2 3,-0.1 -0.528 23.7-144.1 -70.4 139.3 15.8 24.0 17.4 85 87 A G - 0 0 29 -7,-2.5 2,-0.5 -2,-0.2 -1,-0.1 0.054 44.3 -54.1 -80.3-160.4 16.4 24.6 21.1 86 88 A R - 0 0 191 1,-0.1 -1,-0.1 -9,-0.0 -8,-0.0 -0.727 63.4-124.7 -85.2 126.5 18.8 27.1 22.6 87 89 A E - 0 0 66 -2,-0.5 2,-0.5 -10,-0.1 -10,-0.2 -0.277 9.3-145.5 -77.5 149.7 22.3 26.6 21.3 88 90 A E E -K 76 0B 78 -12,-2.9 -12,-2.7 2,-0.0 2,-0.5 -0.986 20.1-158.4-112.5 118.9 25.5 26.0 23.4 89 91 A I E -K 75 0B 56 -2,-0.5 2,-0.5 -14,-0.2 -14,-0.2 -0.898 9.0-164.1-109.1 127.1 28.5 27.6 21.8 90 92 A T E -K 74 0B 36 -16,-3.2 -16,-2.2 -2,-0.5 -2,-0.0 -0.949 5.3-176.2-107.5 121.3 32.0 26.5 22.5 91 93 A Y + 0 0 164 -2,-0.5 2,-1.3 -18,-0.2 -1,-0.1 0.667 67.7 80.7 -93.5 -20.7 34.7 29.1 21.4 92 94 A D + 0 0 147 29,-0.1 -1,-0.1 -18,-0.1 -19,-0.1 -0.742 69.3 167.7 -87.4 91.5 37.8 27.1 22.3 93 95 A T - 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