==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-FEB-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR BINDING PROTEIN 31-JAN-07 2EAK . COMPND 2 MOLECULE: GALECTIN-9; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.NAGAE,S.NAKAMURA-TSURUTA,N.NISHI,T.NAKAMURA,J.HIRABAYASHI, . 427 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18979.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 317 74.2 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 . 207 48.5 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 . 9 2.1 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 . 66 15.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 5.4 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 . 3 6 3 6 3 9 6 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 3 0 3 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 6 A S 0 0 16 0, 0.0 4,-0.1 0, 0.0 15,-0.0 0.000 360.0 360.0 360.0 175.1 8.6 70.2 32.9 2 7 A Q + 0 0 115 1,-0.1 139,-0.1 2,-0.1 14,-0.0 0.045 360.0 79.9-160.9 83.8 5.2 69.9 34.0 3 8 A A S S- 0 0 47 221,-0.0 2,-0.1 3,-0.0 -1,-0.1 -0.724 92.3-122.5 -98.3 149.2 2.9 68.8 31.7 4 9 A P - 0 0 42 0, 0.0 2,-0.7 0, 0.0 137,-0.2 -0.436 16.6-108.8 -75.5 167.9 3.9 65.2 32.2 5 10 A Y E -A 140 0A 20 135,-3.4 135,-2.1 -2,-0.1 2,-0.4 -0.898 39.3-148.3 -94.9 116.9 5.0 63.1 29.2 6 11 A L E -A 139 0A 131 -2,-0.7 133,-0.2 1,-0.2 132,-0.1 -0.748 65.3 -19.0 -96.1 133.9 2.1 60.7 28.7 7 12 A S S S- 0 0 96 131,-3.3 -1,-0.2 -2,-0.4 131,-0.2 0.871 84.4-165.1 40.6 53.0 2.8 57.2 27.3 8 13 A P - 0 0 14 0, 0.0 129,-0.6 0, 0.0 -1,-0.2 -0.448 17.8-117.4 -71.0 139.8 6.2 58.2 26.0 9 14 A A - 0 0 80 -2,-0.1 127,-0.1 2,-0.1 -2,-0.0 -0.471 40.7 -95.3 -68.9 144.3 7.8 55.8 23.5 10 15 A V S S+ 0 0 43 -2,-0.1 2,-0.2 125,-0.1 122,-0.1 -0.922 109.6 51.8-107.7 133.0 11.1 54.2 24.6 11 16 A P S S+ 0 0 111 0, 0.0 2,-0.4 0, 0.0 121,-0.2 0.406 89.7 177.9 -73.3 143.8 13.9 55.2 23.9 12 17 A F E +F 131 0B 27 119,-2.8 119,-1.9 -2,-0.2 2,-0.3 -0.937 20.7 179.5-121.4 143.3 12.8 58.5 25.2 13 18 A S E +F 130 0B 48 -2,-0.4 207,-0.5 117,-0.2 2,-0.3 -0.955 16.3 161.9-142.2 128.6 14.5 61.8 25.7 14 19 A G E -F 129 0B 0 115,-2.5 115,-2.9 -2,-0.3 207,-0.2 -0.999 37.5-100.3-148.8 149.1 12.9 64.9 27.1 15 20 A T E -F 128 0B 2 205,-1.8 2,-0.6 -2,-0.3 113,-0.3 -0.311 19.4-146.7 -59.6 136.2 13.5 68.3 28.6 16 21 A I > - 0 0 2 111,-2.4 3,-2.3 205,-0.1 2,-0.2 -0.965 33.8-123.5 -96.4 110.8 13.2 68.9 32.3 17 22 A Q T 3 S+ 0 0 76 -2,-0.6 111,-0.0 1,-0.3 110,-0.0 -0.404 91.2 2.3 -65.8 123.5 11.9 72.5 32.4 18 23 A G T 3 S- 0 0 59 -2,-0.2 -1,-0.3 245,-0.2 109,-0.0 0.414 114.5-108.5 80.7 1.1 14.3 74.8 34.5 19 24 A G < - 0 0 7 -3,-2.3 108,-0.2 108,-0.2 2,-0.1 0.034 63.8 -27.0 64.4-176.6 16.6 71.7 35.0 20 25 A L + 0 0 0 106,-1.9 2,-0.3 103,-0.6 106,-0.1 -0.419 67.9 176.9 -66.4 133.1 17.0 69.9 38.3 21 26 A Q > - 0 0 110 -2,-0.1 3,-2.3 79,-0.0 79,-0.2 -0.976 42.2 -82.1-135.5 149.9 16.4 72.1 41.3 22 27 A D T 3 S+ 0 0 100 -2,-0.3 79,-0.2 1,-0.3 3,-0.1 -0.271 117.5 20.8 -49.6 129.8 16.4 71.2 45.0 23 28 A G T 3 S+ 0 0 37 77,-3.2 -1,-0.3 1,-0.3 78,-0.1 0.117 86.2 138.4 95.6 -14.5 13.1 69.6 45.9 24 29 A L < - 0 0 29 -3,-2.3 76,-2.3 75,-0.1 2,-0.5 -0.351 38.8-155.0 -66.8 134.0 12.0 68.6 42.4 25 30 A Q E -B 99 0A 61 74,-0.2 118,-2.7 -3,-0.1 2,-0.6 -0.962 5.8-165.2-114.9 124.8 10.4 65.1 42.2 26 31 A I E -BC 98 142A 0 72,-2.9 72,-2.7 -2,-0.5 2,-0.5 -0.932 5.5-160.5-114.0 119.7 10.6 63.2 38.9 27 32 A T E -BC 97 141A 22 114,-2.8 114,-2.0 -2,-0.6 2,-0.6 -0.865 9.8-171.2-103.9 132.2 8.3 60.2 38.5 28 33 A V E -BC 96 140A 0 68,-3.4 68,-2.9 -2,-0.5 2,-0.5 -0.976 13.5-176.1-117.2 108.9 8.9 57.5 36.0 29 34 A N E +BC 95 139A 35 110,-3.1 109,-2.8 -2,-0.6 110,-2.0 -0.941 29.7 96.3-111.4 122.1 5.9 55.2 36.0 30 35 A G E -BC 94 137A 1 64,-2.3 64,-3.0 -2,-0.5 2,-0.3 -0.846 60.9 -82.6-168.6-150.8 5.9 52.2 33.8 31 36 A T E -BC 93 136A 32 105,-2.7 105,-2.5 62,-0.3 2,-0.3 -0.994 29.8-120.1-143.6 133.1 6.5 48.4 33.4 32 37 A V E - C 0 135A 0 60,-1.9 59,-1.6 57,-0.4 103,-0.3 -0.594 44.3-111.0 -68.9 128.4 9.6 46.3 32.9 33 38 A L - 0 0 64 101,-1.6 58,-0.3 -2,-0.3 59,-0.2 -0.249 12.6-136.4 -58.4 148.7 9.2 44.4 29.7 34 39 A S S S+ 0 0 95 56,-0.2 -1,-0.1 57,-0.1 56,-0.1 0.660 75.1 94.7 -81.6 -17.6 8.7 40.6 29.9 35 40 A S S S- 0 0 71 1,-0.1 99,-0.0 56,-0.0 56,-0.0 0.309 95.2 -80.5 -66.9-159.6 11.1 39.9 27.0 36 41 A S S S+ 0 0 105 2,-0.0 2,-0.2 54,-0.0 -1,-0.1 0.132 83.5 128.9-127.4 26.1 14.8 39.0 27.2 37 42 A G - 0 0 22 2,-0.1 3,-0.0 1,-0.0 53,-0.0 -0.335 41.3-171.4 72.4 65.9 15.6 42.1 27.6 38 43 A T + 0 0 48 -2,-0.2 23,-3.6 1,-0.1 2,-0.3 0.476 55.8 32.7-113.9 -0.8 17.9 42.3 30.6 39 44 A R B -G 60 0B 93 21,-0.2 95,-3.1 22,-0.1 2,-0.3 -0.992 46.1-176.3-149.1 155.4 18.4 46.1 31.4 40 45 A F E -H 133 0B 1 19,-1.7 2,-0.4 -2,-0.3 93,-0.3 -0.959 13.7-153.9-144.1 160.7 16.9 49.5 31.4 41 46 A A E -H 132 0B 1 91,-2.6 91,-1.9 -2,-0.3 2,-0.5 -0.997 14.4-161.5-136.8 146.1 18.2 52.9 32.3 42 47 A V E -HI 131 57B 0 15,-2.5 15,-2.7 -2,-0.4 2,-0.4 -0.998 24.1-166.1-117.5 124.9 16.9 56.3 33.5 43 48 A N E -HI 130 56B 7 87,-3.2 87,-2.2 -2,-0.5 2,-0.7 -0.964 19.0-160.4-118.1 127.3 19.5 59.1 32.8 44 49 A F E +HI 129 55B 0 11,-2.8 11,-1.5 -2,-0.4 10,-1.5 -0.948 42.6 158.8-100.6 108.1 19.6 62.6 34.2 45 50 A Q E -HI 128 53B 6 83,-2.5 83,-1.7 -2,-0.7 82,-1.5 -0.755 49.0-107.9-133.8 173.0 21.8 64.2 31.7 46 51 A T S S- 0 0 24 6,-2.6 6,-0.4 -2,-0.2 4,-0.4 -0.928 81.9 -32.0-107.9 115.1 23.0 67.5 30.1 47 52 A G S S- 0 0 0 -2,-0.6 3,-0.3 1,-0.2 171,-0.2 -0.110 91.7 -58.1 66.2-167.1 21.7 67.8 26.5 48 53 A F S S+ 0 0 84 169,-0.8 -1,-0.2 312,-0.2 170,-0.1 0.726 110.7 76.4 -85.2 -26.8 21.0 65.1 24.0 49 54 A S S S- 0 0 36 311,-0.4 -1,-0.2 -3,-0.2 -2,-0.1 0.741 80.5-137.1 -68.7 -31.0 24.4 63.3 23.6 50 55 A G S S+ 0 0 9 -4,-0.4 3,-0.2 -3,-0.3 -1,-0.1 0.499 73.3 114.1 78.4 5.0 24.6 61.2 26.8 51 56 A N S S+ 0 0 43 1,-0.3 24,-2.8 -5,-0.2 2,-0.5 0.756 78.5 45.3 -76.5 -21.8 28.3 62.1 27.2 52 57 A D + 0 0 48 -6,-0.4 -6,-2.6 21,-0.2 2,-0.6 -0.854 67.9 163.8-127.9 93.0 27.4 63.9 30.4 53 58 A I E -IJ 45 72B 8 19,-1.4 19,-2.3 -2,-0.5 -8,-0.3 -0.939 19.4-169.0-110.6 107.6 25.0 61.9 32.6 54 59 A A E S+ 0 0 5 -10,-1.5 66,-0.4 -2,-0.6 2,-0.3 0.875 83.8 16.1 -62.8 -34.9 24.9 63.3 36.2 55 60 A F E -I 44 0B 0 -11,-1.5 -11,-2.8 -3,-0.1 2,-0.5 -0.904 63.5-174.6-150.7 112.4 23.0 60.1 37.3 56 61 A H E -IJ 43 70B 22 14,-2.6 14,-1.8 -2,-0.3 2,-0.6 -0.950 9.0-168.9-103.7 118.1 22.6 56.9 35.4 57 62 A F E +IJ 42 69B 0 -15,-2.7 -15,-2.5 -2,-0.5 12,-0.2 -0.968 11.5 177.8-118.3 113.6 20.3 54.6 37.1 58 63 A N E - J 0 68B 10 10,-2.5 10,-2.3 -2,-0.6 -17,-0.2 -0.797 16.7-163.5-135.0 80.3 20.5 51.1 35.5 59 64 A P E - J 0 67B 0 0, 0.0 -19,-1.7 0, 0.0 2,-0.4 -0.473 14.4-165.1 -59.5 132.2 18.6 48.0 36.8 60 65 A R E -GJ 39 66B 23 6,-2.9 6,-2.2 -21,-0.2 2,-1.6 -0.989 19.2-154.3-127.0 123.1 20.1 44.8 35.4 61 66 A F + 0 0 37 -23,-3.6 2,-0.3 -2,-0.4 -22,-0.1 -0.521 66.0 102.1 -94.9 66.4 18.3 41.5 35.5 62 67 A E S > S+ 0 0 43 -2,-1.6 3,-2.8 4,-0.1 -2,-0.1 -0.969 71.4 14.8-148.1 150.8 21.5 39.7 35.4 63 68 A D T 3 S- 0 0 143 -2,-0.3 -1,-0.1 1,-0.3 -2,-0.0 0.833 141.5 -37.9 49.7 41.3 23.8 37.8 37.9 64 69 A G T 3 S- 0 0 87 -3,-0.1 -1,-0.3 2,-0.0 21,-0.2 0.249 109.4 -73.2 94.7 -10.1 21.0 37.8 40.5 65 70 A G < + 0 0 12 -3,-2.8 20,-0.4 1,-0.1 21,-0.3 0.557 64.6 167.1 90.2 119.7 19.6 41.2 39.7 66 71 A Y E -J 60 0B 14 -6,-2.2 -6,-2.9 18,-0.1 2,-0.5 -0.984 30.0-123.7-156.2 162.5 21.3 44.5 40.6 67 72 A V E -JK 59 83B 0 16,-2.6 16,-2.5 -2,-0.3 2,-0.5 -0.953 17.2-151.6-112.3 129.4 21.2 48.2 39.9 68 73 A V E -JK 58 82B 0 -10,-2.3 -10,-2.5 -2,-0.5 2,-0.4 -0.865 9.8-168.3 -93.0 132.1 24.2 50.1 38.7 69 74 A C E +JK 57 81B 1 12,-3.3 12,-2.6 -2,-0.5 2,-0.3 -0.972 24.4 143.8-115.9 133.0 24.4 53.8 39.7 70 75 A N E -J 56 0B 2 -14,-1.8 -14,-2.6 -2,-0.4 2,-0.4 -0.954 40.5-126.9-158.2 173.7 27.0 56.0 37.9 71 76 A T E - 0 0 0 -2,-0.3 7,-2.2 -16,-0.2 2,-0.5 -0.991 14.2-155.3-130.8 138.1 28.0 59.3 36.4 72 77 A R E -JL 53 77B 69 -19,-2.3 -19,-1.4 -2,-0.4 2,-0.4 -0.972 10.8-171.7-113.8 132.8 29.4 59.9 33.0 73 78 A Q E > S- L 0 76B 98 3,-2.3 3,-2.3 -2,-0.5 -21,-0.2 -0.996 70.9 -21.5-132.3 123.5 31.5 63.0 32.4 74 79 A N T 3 S- 0 0 98 -2,-0.4 -22,-0.2 1,-0.3 -1,-0.1 0.816 132.1 -45.2 36.2 49.0 32.6 64.1 28.9 75 80 A G T 3 S+ 0 0 23 -24,-2.8 2,-0.5 1,-0.2 -1,-0.3 0.301 115.9 116.3 88.3 -5.1 32.1 60.5 27.7 76 81 A S E < -L 73 0B 81 -3,-2.3 -3,-2.3 -25,-0.3 2,-0.2 -0.859 56.3-140.7-108.6 120.2 33.8 58.9 30.7 77 82 A W E -L 72 0B 112 -2,-0.5 -5,-0.2 -5,-0.2 3,-0.1 -0.506 16.9-146.1 -73.2 139.9 32.1 56.6 33.2 78 83 A G - 0 0 27 -7,-2.2 2,-0.3 -2,-0.2 -1,-0.1 -0.047 44.3 -56.5 -84.4-170.8 33.1 56.9 36.9 79 84 A P - 0 0 102 0, 0.0 -1,-0.2 0, 0.0 -8,-0.1 -0.599 64.2-118.1 -74.3 136.3 33.2 54.1 39.5 80 85 A E - 0 0 83 -2,-0.3 2,-0.5 -10,-0.1 -10,-0.2 -0.419 12.6-150.6 -77.5 144.3 29.9 52.2 39.8 81 86 A E E -K 69 0B 76 -12,-2.6 -12,-3.3 -2,-0.1 2,-0.4 -0.991 22.7-163.3-103.7 124.7 27.7 52.0 42.9 82 87 A R E -K 68 0B 135 -2,-0.5 2,-0.5 -14,-0.2 -14,-0.2 -0.935 6.6-165.5-115.4 133.1 25.9 48.7 42.7 83 88 A K E -K 67 0B 80 -16,-2.5 -16,-2.6 -2,-0.4 3,-0.1 -0.970 4.3-158.6-119.9 128.4 22.8 47.8 44.8 84 89 A T + 0 0 78 -2,-0.5 -18,-0.1 -18,-0.2 -19,-0.1 -0.228 68.2 54.3 -88.8-174.2 21.4 44.3 45.2 85 90 A H S S- 0 0 169 -20,-0.4 -1,-0.2 1,-0.2 -19,-0.1 0.944 79.8-163.1 51.2 56.6 17.8 43.3 46.3 86 91 A M - 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