==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LECTIN 20-OCT-93 1SLT . COMPND 2 MOLECULE: BOVINE GALECTIN-1; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR D.-I.LIAO,O.HERZBERG . 265 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11440.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 205 77.4 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 . 146 55.1 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 . 4 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 3.0 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 . 34 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 5.7 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+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 3 4 2 5 3 3 1 1 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 0 0 0 0 1 0 0 0 0 0 1 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 2 A C 0 0 118 0, 0.0 121,-0.2 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 -59.6 2.4 33.6 32.5 2 3 A G - 0 0 21 119,-1.5 139,-0.1 1,-0.3 140,-0.1 -0.304 360.0 -32.2 -96.9-167.3 5.9 34.4 31.5 3 4 A L - 0 0 19 -2,-0.1 118,-2.1 138,-0.1 2,-0.4 -0.081 50.4-163.9 -45.6 138.2 6.8 37.4 29.5 4 5 A V E -AB 120 139A 32 135,-2.1 135,-2.4 116,-0.2 2,-0.4 -1.000 10.0-176.3-123.1 123.5 4.5 39.0 27.0 5 6 A A E +AB 119 138A 3 114,-3.4 114,-2.5 -2,-0.4 2,-0.2 -0.985 9.8 162.5-123.1 131.7 6.1 41.4 24.5 6 7 A S E + B 0 137A 40 131,-2.2 131,-2.1 -2,-0.4 112,-0.2 -0.747 48.2 62.7-133.2-176.6 4.1 43.4 21.8 7 8 A N S S+ 0 0 116 110,-0.3 2,-0.2 1,-0.3 111,-0.1 0.816 74.2 140.7 66.1 26.5 4.5 46.4 19.7 8 9 A L - 0 0 6 109,-1.7 -1,-0.3 -3,-0.1 128,-0.1 -0.541 38.9-165.6 -91.4 164.9 7.3 44.5 18.0 9 10 A N + 0 0 98 126,-0.2 2,-0.4 -2,-0.2 108,-0.2 -0.307 18.5 167.5-150.1 63.9 7.8 44.8 14.4 10 11 A L B -P 116 0B 10 106,-2.7 106,-2.6 4,-0.0 108,-0.1 -0.617 17.4-165.7 -77.2 132.0 10.2 42.0 13.6 11 12 A K > - 0 0 95 -2,-0.4 3,-3.0 104,-0.2 79,-0.2 -0.746 30.0 -64.2-123.6 173.5 10.4 41.5 9.9 12 13 A P T 3 S+ 0 0 62 0, 0.0 79,-0.2 0, 0.0 -1,-0.1 -0.113 119.3 30.6 -50.7 135.9 11.7 38.9 7.5 13 14 A G T 3 S+ 0 0 68 77,-3.1 2,-0.2 1,-0.4 78,-0.1 0.157 95.4 112.4 100.2 -22.2 15.3 38.6 7.6 14 15 A E < - 0 0 66 -3,-3.0 76,-1.8 76,-0.2 -1,-0.4 -0.580 55.0-141.3 -92.7 158.4 15.6 39.4 11.2 15 16 A X E -Q 89 0C 38 118,-2.4 118,-2.8 74,-0.2 2,-0.4 -0.946 3.3-154.3-117.2 135.0 16.7 37.0 14.1 16 17 A L E -QR 88 132C 6 72,-2.9 72,-1.9 -2,-0.4 2,-0.5 -0.907 8.2-168.6-103.7 127.7 15.4 36.5 17.7 17 18 A R E -QR 87 131C 53 114,-2.0 114,-2.6 -2,-0.4 2,-0.4 -0.977 9.1-175.4-112.9 131.1 17.8 35.0 20.3 18 19 A V E -QR 86 130C 4 68,-2.3 68,-1.9 -2,-0.5 2,-0.4 -0.993 5.2-168.8-128.7 125.9 16.1 34.1 23.5 19 20 A R E +QR 85 129C 105 110,-2.6 109,-2.6 -2,-0.4 110,-1.7 -0.961 17.6 161.3-115.1 142.8 18.0 32.8 26.5 20 21 A G E -QR 84 127C 0 64,-3.0 64,-2.5 -2,-0.4 2,-0.5 -0.930 40.1-111.9-155.7 168.9 16.2 31.3 29.5 21 22 A E E -QR 83 126C 86 105,-2.1 105,-2.7 -2,-0.3 2,-0.4 -0.939 29.2-142.2-106.6 124.1 16.5 29.2 32.5 22 23 A V E - R 0 125C 4 60,-4.3 59,-0.4 -2,-0.5 60,-0.4 -0.762 30.6-106.7 -85.3 131.2 14.6 25.9 32.4 23 24 A A > - 0 0 38 101,-2.6 3,-1.8 -2,-0.4 58,-1.6 -0.165 20.2-121.7 -56.4 151.4 13.0 25.0 35.8 24 25 A A T 3 S+ 0 0 67 1,-0.3 -1,-0.1 56,-0.3 -2,-0.0 0.902 117.0 36.3 -57.4 -41.7 14.6 22.2 37.8 25 26 A D T 3 S+ 0 0 76 55,-0.1 -1,-0.3 56,-0.0 -2,-0.1 0.000 91.0 168.9 -96.2 20.4 11.3 20.3 37.7 26 27 A A < + 0 0 6 -3,-1.8 3,-0.1 1,-0.2 -4,-0.0 -0.096 18.4 168.8 -42.8 136.4 10.4 21.4 34.1 27 28 A K - 0 0 104 1,-0.5 21,-2.1 21,-0.1 22,-1.7 0.612 68.1 -22.0-112.3 -36.7 7.5 19.6 32.5 28 29 A S B -C 47 0A 19 19,-0.2 96,-3.1 20,-0.2 -1,-0.5 -0.980 53.1-169.8-164.9 159.2 7.1 21.9 29.5 29 30 A F E -D 123 0A 0 17,-1.6 2,-0.3 -2,-0.3 94,-0.2 -0.953 10.2-160.8-153.0 160.5 7.8 25.4 28.2 30 31 A L E -D 122 0A 37 92,-1.7 92,-2.1 -2,-0.3 2,-0.3 -0.960 14.9-157.0-147.1 158.0 6.7 27.3 25.2 31 32 A L E -DE 121 44A 2 13,-1.6 13,-3.0 -2,-0.3 2,-0.5 -0.986 17.5-161.4-132.4 118.5 7.6 30.4 23.1 32 33 A N E -DE 120 43A 25 88,-2.9 88,-2.4 -2,-0.3 2,-0.4 -0.941 9.4-178.5-106.6 128.2 4.8 31.9 21.1 33 34 A L E +DE 119 42A 3 9,-2.9 9,-2.5 -2,-0.5 8,-1.5 -0.991 31.5 82.2-126.6 135.3 5.6 34.2 18.1 34 35 A G E S-DE 118 40A 0 84,-2.3 83,-2.6 -2,-0.4 84,-2.0 -0.918 83.6 -55.1 176.9-146.7 3.0 36.0 15.9 35 36 A K E S- 0 0 117 4,-3.1 2,-0.3 1,-0.4 -1,-0.2 0.828 106.5 -29.3 -92.9 -52.8 0.7 38.9 15.5 36 37 A D E > S- E 0 39A 51 3,-1.2 3,-1.4 82,-0.1 -1,-0.4 -0.864 84.4 -68.2-156.2-177.6 -1.2 38.6 18.6 37 38 A D T 3 S+ 0 0 95 -2,-0.3 3,-0.1 1,-0.2 -4,-0.0 0.634 131.2 42.3 -61.1 -13.5 -2.3 35.9 21.0 38 39 A N T 3 S+ 0 0 71 1,-0.2 27,-2.5 26,-0.1 26,-0.5 0.394 109.6 58.8-105.9 -2.7 -4.7 34.3 18.5 39 40 A N E < +EF 36 63A 37 -3,-1.4 -4,-3.1 24,-0.2 -3,-1.2 -0.809 67.5 167.6-135.1 89.0 -2.5 34.5 15.4 40 41 A L E -EF 34 62A 2 22,-1.8 22,-2.2 -2,-0.4 -6,-0.3 -0.929 27.1-172.6-110.6 121.7 0.7 32.7 16.0 41 42 A C E S+ 0 0 0 -8,-1.5 2,-0.4 -2,-0.5 69,-0.3 0.765 85.3 26.0 -80.2 -24.2 3.0 31.9 13.3 42 43 A L E +E 33 0A 0 -9,-2.5 -9,-2.9 67,-0.1 2,-0.5 -0.916 51.2 176.7-145.7 120.2 4.9 29.8 15.7 43 44 A H E -EF 32 60A 15 17,-2.6 17,-1.9 -2,-0.4 2,-0.6 -0.986 20.7-170.9-111.6 109.7 4.0 27.9 19.0 44 45 A F E +EF 31 59A 0 -13,-3.0 -13,-1.6 -2,-0.5 15,-0.2 -0.944 9.5 173.0-107.8 112.7 7.4 26.2 20.0 45 46 A N E - F 0 58A 6 13,-2.6 13,-1.8 -2,-0.6 2,-0.3 -0.692 18.1-165.7-131.0 84.8 6.7 23.8 22.9 46 47 A P E - F 0 57A 0 0, 0.0 -17,-1.6 0, 0.0 2,-0.6 -0.505 16.8-155.4 -61.7 121.2 9.5 21.4 24.1 47 48 A R E +CF 28 56A 21 9,-3.8 9,-1.9 -2,-0.3 -19,-0.2 -0.923 21.6 178.0-107.5 116.7 7.7 18.8 26.3 48 49 A F E S- 0 0 11 -21,-2.1 7,-2.3 -2,-0.6 -1,-0.2 0.961 88.1 -19.7 -71.5 -52.5 9.9 17.2 29.0 49 50 A N E S+ F 0 54A 94 -22,-1.7 2,-0.3 5,-0.3 5,-0.2 -0.688 102.1 114.6-151.4 87.7 6.9 15.3 30.2 50 51 A A E > + F 0 53A 17 3,-2.0 3,-2.6 -2,-0.1 -3,-0.0 -0.975 66.0 11.4-161.3 149.9 3.5 16.6 29.3 51 52 A H T 3 S- 0 0 143 1,-0.3 3,-0.1 -2,-0.3 -1,-0.1 0.782 129.1 -58.5 57.6 27.4 0.3 15.8 27.2 52 53 A G T 3 S+ 0 0 73 1,-0.3 2,-0.3 -3,-0.0 -1,-0.3 0.629 112.6 120.9 81.7 8.8 1.6 12.4 26.9 53 54 A D E < -F 50 0A 23 -3,-2.6 -3,-2.0 3,-0.1 2,-0.4 -0.839 43.6-161.6-110.2 152.3 4.8 13.5 25.2 54 55 A V E S-F 49 0A 86 -2,-0.3 -5,-0.3 -5,-0.2 -6,-0.2 -1.000 71.8 -19.1-131.3 131.4 8.2 12.8 26.6 55 56 A N E S+ 0 0 83 -7,-2.3 2,-0.4 -2,-0.4 -7,-0.2 0.825 101.2 134.7 40.1 47.6 11.3 14.7 25.5 56 57 A T E -F 47 0A 26 -9,-1.9 -9,-3.8 -11,-0.1 2,-0.6 -0.964 53.3-137.6-127.1 142.1 9.6 15.9 22.3 57 58 A I E -FG 46 73A 0 16,-3.4 16,-2.7 -2,-0.4 2,-0.5 -0.863 19.7-166.3 -97.0 122.0 9.4 19.2 20.7 58 59 A V E -FG 45 72A 1 -13,-1.8 -13,-2.6 -2,-0.6 2,-0.4 -0.943 5.0-172.5-108.6 130.0 5.9 20.0 19.4 59 60 A C E +FG 44 71A 1 12,-3.0 12,-1.7 -2,-0.5 2,-0.3 -0.930 13.2 158.7-118.0 136.7 5.5 23.0 16.9 60 61 A N E -F 43 0A 5 -17,-1.9 -17,-2.6 -2,-0.4 2,-0.3 -0.915 31.6-129.8-146.5 176.2 2.2 24.4 15.8 61 62 A S E - 0 0 7 -2,-0.3 7,-1.8 -19,-0.2 2,-0.4 -0.749 15.8-147.9-121.1 164.7 0.5 27.5 14.3 62 63 A K E -FH 40 67A 38 -22,-2.2 -22,-1.8 -2,-0.3 2,-0.5 -0.974 12.2-171.0-141.5 122.6 -2.6 29.2 15.7 63 64 A D E > S-FH 39 66A 90 3,-2.3 3,-1.5 -2,-0.4 -24,-0.2 -0.960 71.5 -23.6-125.5 111.7 -4.9 30.9 13.2 64 65 A A T 3 S- 0 0 75 -26,-0.5 -25,-0.2 -2,-0.5 -1,-0.1 0.834 130.5 -46.2 56.3 41.3 -7.8 33.1 14.6 65 66 A G T 3 S+ 0 0 33 -27,-2.5 2,-0.7 1,-0.2 -1,-0.3 0.295 117.0 109.0 86.6 -2.9 -7.7 31.2 17.7 66 67 A A E < -H 63 0A 57 -3,-1.5 -3,-2.3 -28,-0.4 -1,-0.2 -0.819 65.9-123.1-117.1 136.7 -7.5 27.8 16.4 67 68 A W E -H 62 0A 125 -2,-0.7 -5,-0.2 -5,-0.2 3,-0.1 -0.198 23.8-147.9 -61.2 147.7 -4.5 25.4 16.4 68 69 A G - 0 0 37 -7,-1.8 2,-0.5 1,-0.1 -1,-0.1 0.066 46.5 -47.2 -92.1-156.8 -3.2 24.0 13.1 69 70 A A - 0 0 66 1,-0.1 -1,-0.1 -9,-0.0 -10,-0.0 -0.742 63.6-120.6 -83.7 123.2 -1.5 20.6 12.4 70 71 A E - 0 0 91 -2,-0.5 2,-0.4 -10,-0.1 -10,-0.2 -0.125 20.2-158.8 -62.1 157.1 1.3 19.7 14.9 71 72 A Q E -G 59 0A 61 -12,-1.7 -12,-3.0 2,-0.0 2,-0.4 -0.996 12.3-152.0-139.6 124.7 4.8 19.0 13.8 72 73 A R E -G 58 0A 113 -2,-0.4 2,-0.5 -14,-0.2 -14,-0.2 -0.852 8.7-163.6-112.5 144.4 7.0 17.0 16.1 73 74 A E E -G 57 0A 30 -16,-2.7 -16,-3.4 -2,-0.4 -2,-0.0 -0.990 11.0-168.8-125.5 129.8 10.7 17.0 16.6 74 75 A S + 0 0 101 -2,-0.5 -1,-0.1 -18,-0.2 2,-0.1 0.674 60.5 106.2 -90.6 -18.8 12.6 14.3 18.3 75 76 A A + 0 0 20 1,-0.1 -18,-0.2 -18,-0.1 -2,-0.1 -0.334 48.6 175.3 -56.2 129.8 15.8 16.3 18.5 76 77 A F + 0 0 41 -2,-0.1 2,-1.4 -20,-0.1 -1,-0.1 -0.186 18.2 159.9-147.3 65.1 15.8 17.2 22.3 77 78 A P + 0 0 37 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.166 42.6 110.6 -77.6 43.4 18.9 19.0 23.5 78 79 A F - 0 0 13 -2,-1.4 6,-0.0 6,-0.1 -23,-0.0 -0.972 44.4-167.8-125.2 139.0 17.3 20.4 26.7 79 80 A Q > - 0 0 131 -2,-0.4 3,-0.5 -57,-0.0 -57,-0.2 -0.959 30.6-109.6-125.1 135.6 18.0 19.5 30.3 80 81 A P T 3 S+ 0 0 45 0, 0.0 -56,-0.3 0, 0.0 -57,-0.1 -0.296 101.3 28.3 -63.9 146.1 15.9 20.5 33.2 81 82 A G T 3 S+ 0 0 46 -58,-1.6 2,-0.3 -59,-0.4 -58,-0.2 0.896 99.1 114.9 69.7 40.7 17.5 23.0 35.5 82 83 A S < - 0 0 26 -3,-0.5 -60,-4.3 -60,-0.4 2,-0.6 -0.823 67.3-118.8-131.9 175.8 19.6 24.6 32.8 83 84 A V E +Q 21 0C 83 -62,-0.3 2,-0.3 -2,-0.3 -62,-0.3 -0.970 40.7 177.0-114.2 114.3 20.1 27.9 31.0 84 85 A V E -Q 20 0C 15 -64,-2.5 -64,-3.0 -2,-0.6 2,-0.4 -0.833 22.0-146.0-120.3 164.7 19.5 27.5 27.2 85 86 A E E -Q 19 0C 52 -2,-0.3 2,-0.3 -66,-0.3 -66,-0.2 -0.983 13.7-174.8-127.3 137.0 19.4 29.8 24.2 86 87 A V E -Q 18 0C 1 -68,-1.9 -68,-2.3 -2,-0.4 2,-0.4 -0.926 8.9-156.2-125.9 145.5 17.1 29.3 21.1 87 88 A X E -QS 17 98C 37 11,-1.7 11,-2.6 -2,-0.3 2,-0.4 -0.999 3.2-163.3-130.1 134.7 17.2 31.4 17.9 88 89 A I E -QS 16 97C 7 -72,-1.9 -72,-2.9 -2,-0.4 2,-0.5 -0.987 2.6-160.4-123.7 125.7 14.4 31.9 15.5 89 90 A S E -QS 15 96C 31 7,-2.5 7,-1.8 -2,-0.4 2,-0.7 -0.895 9.9-148.3-106.0 132.6 14.9 33.3 12.0 90 91 A F E + S 0 95C 4 -76,-1.8 -77,-3.1 -2,-0.5 -76,-0.2 -0.888 23.5 170.2-105.1 115.0 12.0 34.6 10.3 91 92 A N - 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