==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR-BINDING PROTEIN 18-MAR-08 2JJ6 . COMPND 2 MOLECULE: GALECTIN-RELATED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.THORE,M.A.WALTI,M.KUNZLER,M.AEBI . 267 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13737.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 186 69.7 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 . 122 45.7 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 2.2 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 13.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), 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 . 4 1.5 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 1 3 2 6 4 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 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 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 V 0 0 188 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 107.9 -5.0 22.7 -22.7 2 2 A P - 0 0 34 0, 0.0 124,-0.2 0, 0.0 2,-0.2 -0.556 360.0-114.3 -85.3 150.6 -5.9 25.3 -20.0 3 3 A F E -A 125 0A 95 122,-2.7 122,-1.9 -2,-0.2 2,-0.4 -0.567 30.7-163.6 -77.7 144.8 -9.4 26.1 -18.8 4 4 A C E -A 124 0A 45 120,-0.2 2,-0.4 -2,-0.2 120,-0.2 -0.998 5.8-172.4-132.5 129.8 -10.6 29.6 -19.7 5 5 A G E -A 123 0A 14 118,-2.8 118,-2.6 -2,-0.4 2,-0.2 -0.983 21.6-126.1-124.1 134.3 -13.6 31.2 -18.0 6 6 A H E -A 122 0A 119 -2,-0.4 2,-0.6 116,-0.2 116,-0.2 -0.522 10.8-155.9 -79.2 144.1 -15.2 34.5 -19.1 7 7 A I > - 0 0 18 114,-2.9 3,-2.6 -2,-0.2 -1,-0.0 -0.889 23.3-133.9-119.4 94.5 -15.7 37.3 -16.5 8 8 A K T 3 S+ 0 0 175 -2,-0.6 114,-0.0 1,-0.3 -2,-0.0 -0.242 88.2 6.8 -52.1 124.7 -18.5 39.5 -17.9 9 9 A G T 3 S- 0 0 55 109,-0.1 -1,-0.3 112,-0.1 111,-0.1 0.434 107.8-118.6 82.4 -3.4 -17.5 43.1 -17.6 10 10 A G < - 0 0 0 -3,-2.6 108,-0.3 111,-0.2 111,-0.2 -0.175 54.6 -33.3 66.7-162.9 -14.0 42.3 -16.5 11 11 A M + 0 0 2 106,-2.0 109,-0.1 109,-0.5 5,-0.0 -0.484 59.7 165.5 -89.6 163.7 -12.7 43.4 -13.2 12 12 A R > - 0 0 169 -2,-0.2 3,-2.4 3,-0.1 81,-0.3 -0.932 51.7 -63.8-168.8 154.0 -13.6 46.6 -11.3 13 13 A P T 3 S+ 0 0 57 0, 0.0 81,-0.2 0, 0.0 3,-0.1 -0.185 123.2 20.0 -49.5 135.0 -13.1 47.8 -7.8 14 14 A G T 3 S+ 0 0 58 79,-3.2 2,-0.2 1,-0.3 80,-0.1 0.118 90.5 125.6 93.2 -22.7 -15.1 45.6 -5.4 15 15 A K < - 0 0 65 -3,-2.4 78,-2.9 78,-0.1 2,-0.4 -0.509 42.6-160.6 -75.2 140.5 -15.4 42.6 -7.7 16 16 A K E -G 92 0B 117 76,-0.2 2,-0.4 -2,-0.2 76,-0.2 -0.990 6.3-153.0-127.0 126.0 -14.2 39.3 -6.3 17 17 A V E -G 91 0B 18 74,-2.6 74,-2.8 -2,-0.4 2,-0.5 -0.835 13.8-156.3 -98.4 132.2 -13.3 36.2 -8.3 18 18 A L E +G 90 0B 34 -2,-0.4 2,-0.4 72,-0.2 72,-0.2 -0.938 14.1 177.7-116.7 128.2 -13.7 32.8 -6.6 19 19 A V E +G 89 0B 1 70,-3.2 70,-3.7 -2,-0.5 2,-0.4 -0.986 3.0 176.8-129.1 122.5 -11.9 29.6 -7.5 20 20 A M E +GH 88 133B 41 113,-2.2 112,-2.4 -2,-0.4 113,-2.1 -0.955 18.9 130.2-122.1 143.1 -12.4 26.4 -5.5 21 21 A G E -GH 87 131B 1 66,-1.7 66,-2.4 -2,-0.4 2,-0.4 -0.932 49.7 -96.4-168.5-171.4 -10.8 23.1 -6.4 22 22 A I E -GH 86 130B 48 108,-2.8 108,-2.6 -2,-0.3 2,-0.1 -0.995 32.5-124.4-130.1 130.8 -8.8 20.1 -5.1 23 23 A V E - H 0 129B 0 62,-1.7 61,-0.3 -2,-0.4 106,-0.3 -0.489 36.5-106.5 -71.8 142.2 -5.0 19.8 -5.4 24 24 A D - 0 0 47 104,-2.6 60,-1.3 59,-0.2 61,-0.2 -0.235 28.5-108.6 -65.6 160.4 -3.9 16.6 -7.2 25 25 A L S S+ 0 0 109 1,-0.3 -1,-0.1 58,-0.2 -2,-0.1 0.874 113.9 19.7 -59.4 -43.3 -2.3 13.7 -5.2 26 26 A N S S+ 0 0 138 57,-0.1 -1,-0.3 58,-0.0 2,-0.1 -0.579 90.2 179.4-127.7 68.4 1.2 14.2 -6.5 27 27 A P - 0 0 11 0, 0.0 3,-0.1 0, 0.0 102,-0.0 -0.361 25.2-177.1 -72.9 149.2 1.1 17.8 -7.9 28 28 A E - 0 0 137 1,-0.4 26,-2.0 26,-0.1 27,-0.5 0.720 66.6 -46.7-107.5 -46.7 4.0 19.5 -9.5 29 29 A S E -B 53 0A 28 24,-0.2 99,-3.2 25,-0.1 -1,-0.4 -0.987 45.1-162.7-174.7 170.0 2.3 22.9 -10.0 30 30 A F E -BC 52 127A 3 22,-1.5 22,-1.9 97,-0.3 2,-0.3 -0.966 12.4-145.7-156.7 165.1 -0.8 24.8 -11.2 31 31 A A E -BC 51 126A 9 95,-2.7 95,-1.7 -2,-0.3 2,-0.4 -0.994 7.5-167.1-141.3 146.6 -1.6 28.4 -12.1 32 32 A I E +BC 50 125A 1 18,-2.3 18,-3.1 -2,-0.3 2,-0.3 -0.995 24.6 172.2-131.4 121.9 -4.6 30.6 -11.8 33 33 A S E -BC 49 124A 10 91,-3.0 91,-2.8 -2,-0.4 2,-0.5 -0.950 31.8-143.4-134.5 154.5 -4.4 33.8 -13.8 34 34 A L E +BC 48 123A 0 14,-2.4 13,-2.1 -2,-0.3 14,-1.5 -0.976 37.3 174.9-112.6 126.7 -6.7 36.7 -14.8 35 35 A T E -BC 46 122A 0 87,-2.7 87,-1.4 -2,-0.5 2,-0.9 -0.772 39.4-102.9-129.5 172.9 -5.9 37.8 -18.4 36 36 A C S S- 0 0 36 9,-2.5 9,-0.4 -2,-0.2 3,-0.3 -0.807 93.3 -24.3 -99.4 96.5 -7.1 40.2 -21.1 37 37 A G S S- 0 0 25 -2,-0.9 85,-0.1 82,-0.4 7,-0.1 -0.228 80.0 -96.0 86.6 172.9 -9.1 38.0 -23.5 38 38 A D + 0 0 102 -2,-0.1 -1,-0.2 83,-0.1 -32,-0.0 0.238 66.3 144.1-115.6 17.2 -8.5 34.3 -23.8 39 39 A S > + 0 0 53 -3,-0.3 5,-2.2 1,-0.1 -3,-0.1 -0.218 20.6 177.3 -57.5 138.3 -6.1 34.1 -26.7 40 40 A E T 5 + 0 0 93 1,-0.3 -1,-0.1 3,-0.2 0, 0.0 0.769 69.6 58.6-109.7 -50.7 -3.4 31.4 -26.4 41 41 A D T 5S+ 0 0 146 1,-0.3 -1,-0.3 2,-0.1 -2,-0.0 -0.821 122.6 28.1-100.7 89.7 -1.4 31.4 -29.6 42 42 A P T 5S- 0 0 84 0, 0.0 -1,-0.3 0, 0.0 3,-0.1 0.563 115.5-124.0 121.3 98.1 -0.4 35.0 -29.1 43 43 A P T 5 - 0 0 102 0, 0.0 -3,-0.2 0, 0.0 24,-0.2 -0.324 22.5-116.7 -51.1 132.9 -0.7 34.6 -25.4 44 44 A A < - 0 0 12 -5,-2.2 -7,-0.1 1,-0.1 23,-0.0 -0.387 41.9 -87.1 -66.5 153.3 -3.2 37.1 -24.1 45 45 A D - 0 0 50 -9,-0.4 -9,-2.5 -10,-0.1 2,-0.6 -0.343 40.7-137.5 -60.7 143.7 -1.7 39.6 -21.6 46 46 A V E -BD 35 64A 18 18,-2.2 18,-2.1 -11,-0.2 -11,-0.3 -0.914 17.5-172.3-108.7 117.4 -1.8 38.4 -18.0 47 47 A A E S- 0 0 2 -13,-2.1 2,-0.3 -2,-0.6 66,-0.3 0.874 80.1 -2.0 -74.5 -38.7 -2.8 41.0 -15.4 48 48 A I E -B 34 0A 0 -14,-1.5 -14,-2.4 65,-0.1 2,-0.4 -0.955 63.3-166.2-155.6 134.6 -1.9 38.6 -12.6 49 49 A E E -BD 33 62A 38 13,-2.0 13,-1.1 -2,-0.3 2,-0.7 -0.992 5.6-160.7-124.1 128.4 -0.7 35.0 -12.5 50 50 A L E -BD 32 61A 7 -18,-3.1 -18,-2.3 -2,-0.4 2,-0.6 -0.943 15.2-176.0-110.5 112.1 -0.8 32.9 -9.3 51 51 A K E -BD 31 60A 73 9,-3.2 9,-2.9 -2,-0.7 2,-0.6 -0.922 11.7-162.2-118.6 113.2 1.6 30.0 -9.7 52 52 A A E -BD 30 59A 0 -22,-1.9 -22,-1.5 -2,-0.6 2,-0.6 -0.806 6.7-171.0 -91.9 119.2 1.9 27.3 -7.0 53 53 A V E >> -BD 29 58A 22 5,-3.0 5,-2.1 -2,-0.6 4,-0.8 -0.945 4.3-167.3-114.0 111.1 5.1 25.3 -7.3 54 54 A F T 45S+ 0 0 24 -26,-2.0 -1,-0.1 -2,-0.6 -25,-0.1 0.794 77.6 65.1 -72.8 -29.1 5.1 22.3 -5.0 55 55 A T T 45S+ 0 0 112 -27,-0.5 -1,-0.2 1,-0.2 -26,-0.1 0.924 121.3 23.0 -61.3 -42.3 8.7 21.2 -5.1 56 56 A D T 45S- 0 0 95 -3,-0.2 -1,-0.2 2,-0.1 -2,-0.2 0.462 104.3-126.1 -99.8 -4.8 9.8 24.5 -3.5 57 57 A R T <5 + 0 0 173 -4,-0.8 2,-0.3 1,-0.2 -3,-0.2 0.943 59.1 150.5 55.9 49.2 6.5 25.2 -1.8 58 58 A Q E < -D 53 0A 65 -5,-2.1 -5,-3.0 21,-0.1 2,-0.6 -0.875 42.4-156.3-113.4 146.2 6.4 28.7 -3.5 59 59 A L E -D 52 0A 3 15,-0.5 2,-0.3 -2,-0.3 -7,-0.2 -0.907 24.1-167.5-121.6 98.6 3.4 30.8 -4.6 60 60 A L E -D 51 0A 29 -9,-2.9 -9,-3.2 -2,-0.6 2,-0.4 -0.689 6.5-164.5 -94.9 139.6 4.8 33.1 -7.3 61 61 A R E +DE 50 73A 9 12,-2.7 12,-2.4 -2,-0.3 2,-0.3 -0.957 22.2 136.3-122.3 142.9 2.9 36.1 -8.7 62 62 A N E -D 49 0A 5 -13,-1.1 -13,-2.0 -2,-0.4 2,-0.3 -0.964 34.9-129.5-165.1 179.2 3.6 38.0 -11.9 63 63 A S E - 0 0 3 -2,-0.3 7,-2.0 -15,-0.2 2,-0.4 -0.872 9.8-147.4-134.8 165.8 2.1 39.7 -15.0 64 64 A C E +DF 46 69A 23 -18,-2.1 -18,-2.2 -2,-0.3 2,-0.5 -0.950 15.7 177.8-142.7 116.0 2.9 39.5 -18.7 65 65 A I E > S- F 0 68A 62 3,-2.5 3,-2.3 -2,-0.4 -21,-0.1 -0.978 76.9 -17.4-125.3 117.9 2.4 42.5 -21.0 66 66 A S T 3 S- 0 0 101 -2,-0.5 -1,-0.2 1,-0.3 3,-0.1 0.895 129.9 -53.6 54.4 40.3 3.3 42.3 -24.7 67 67 A G T 3 S+ 0 0 60 1,-0.2 2,-0.6 -24,-0.2 -1,-0.3 0.270 111.8 124.6 80.3 -10.8 5.4 39.2 -23.7 68 68 A E E < -F 65 0A 105 -3,-2.3 -3,-2.5 1,-0.0 -1,-0.2 -0.740 53.5-144.5 -88.7 120.5 7.3 41.1 -21.0 69 69 A R E -F 64 0A 107 -2,-0.6 -5,-0.2 -5,-0.2 3,-0.1 -0.553 16.3-143.5 -76.5 144.5 7.1 39.5 -17.5 70 70 A G - 0 0 23 -7,-2.0 2,-0.4 -2,-0.2 -1,-0.1 0.024 45.5 -45.6 -90.2-155.7 7.1 41.9 -14.7 71 71 A E - 0 0 41 159,-0.1 2,-0.4 1,-0.1 -1,-0.2 -0.593 59.4-130.0 -76.4 127.4 8.7 41.6 -11.2 72 72 A E - 0 0 104 -2,-0.4 2,-0.4 -10,-0.1 -10,-0.2 -0.626 23.0-163.6 -81.9 130.3 8.1 38.2 -9.7 73 73 A Q B +E 61 0A 27 -12,-2.4 -12,-2.7 -2,-0.4 37,-0.0 -0.898 22.3 159.0-113.7 143.6 6.8 38.3 -6.1 74 74 A S + 0 0 46 -2,-0.4 -15,-0.5 -14,-0.2 -1,-0.1 0.539 22.1 133.5-137.9 -14.8 6.9 35.3 -3.8 75 75 A A + 0 0 77 -17,-0.1 3,-0.1 2,-0.0 -2,-0.0 -0.157 26.9 155.5 -50.2 125.1 6.6 36.5 -0.1 76 76 A I - 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