==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER APOPTOSIS 26-MAR-08 2ZKN . COMPND 2 MOLECULE: GALECTIN-1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.ABE,H.YOSHIDA,S.KAMITORI . 268 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12033.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 198 73.9 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 . 138 51.5 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 . 4 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 2.6 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 . 35 13.1 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 . 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 5 3 4 4 0 4 2 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 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 1 A A 0 0 73 0, 0.0 122,-0.1 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0-176.5 50.8 39.0 34.0 2 2 A S + 0 0 95 120,-0.1 121,-0.2 2,-0.1 3,-0.1 0.848 360.0 31.0 -82.2 -38.2 52.4 41.8 31.9 3 3 A G S S- 0 0 13 119,-2.2 121,-0.1 1,-0.3 124,-0.1 -0.118 114.5 -25.6-103.3-157.6 49.2 43.4 30.6 4 4 A L - 0 0 20 122,-0.3 118,-2.3 119,-0.2 2,-0.4 -0.244 57.8-164.9 -55.6 134.3 45.6 43.7 31.9 5 5 A V E -AB 121 142A 12 137,-2.4 137,-2.9 116,-0.2 2,-0.4 -0.991 5.9-173.8-127.6 127.4 44.6 41.1 34.4 6 6 A A E +AB 120 141A 5 114,-2.9 114,-2.4 -2,-0.4 2,-0.3 -0.974 8.4 176.1-123.4 132.9 41.0 40.4 35.4 7 7 A S E +AB 119 140A 44 133,-3.1 133,-2.2 -2,-0.4 112,-0.2 -0.829 54.7 41.4-131.3 170.1 39.9 38.1 38.1 8 8 A N E + 0 0 63 110,-0.9 -1,-0.2 -2,-0.3 111,-0.1 0.876 68.0 145.6 61.4 37.8 36.7 36.9 39.9 9 9 A L E - 0 0 25 109,-1.2 109,-0.2 -3,-0.2 3,-0.2 0.842 36.9-161.5 -73.8 -36.0 35.0 36.9 36.5 10 10 A N E - 0 0 90 1,-0.2 2,-0.7 106,-0.1 108,-0.2 0.901 14.7-176.7 51.1 47.1 32.8 33.9 37.2 11 11 A L E -A 117 0A 4 106,-3.1 106,-2.3 4,-0.0 -1,-0.2 -0.668 12.3-153.8 -77.0 113.0 32.2 33.4 33.4 12 12 A K > - 0 0 105 -2,-0.7 3,-2.5 104,-0.2 79,-0.3 -0.398 29.7 -71.0 -89.5 164.2 29.7 30.5 33.3 13 13 A P T 3 S+ 0 0 60 0, 0.0 79,-0.3 0, 0.0 -1,-0.2 -0.223 122.8 23.7 -51.8 136.7 29.1 27.9 30.6 14 14 A G T 3 S+ 0 0 47 77,-3.5 2,-0.2 1,-0.3 78,-0.1 0.247 99.0 113.7 90.3 -14.4 27.4 29.5 27.6 15 15 A E < - 0 0 55 -3,-2.5 76,-2.3 76,-0.3 -1,-0.3 -0.617 51.7-150.2 -91.5 152.5 28.8 33.0 28.4 16 16 A S E -P 90 0B 20 -2,-0.2 118,-1.4 74,-0.2 2,-0.4 -0.838 11.6-149.6-126.1 162.1 31.3 34.8 26.3 17 17 A L E -PQ 89 133B 1 72,-2.2 72,-2.9 -2,-0.3 2,-0.5 -0.992 9.7-160.7-128.6 130.4 34.1 37.3 26.5 18 18 A R E -PQ 88 132B 130 114,-2.9 114,-2.4 -2,-0.4 2,-0.5 -0.967 10.7-172.5-116.4 122.4 35.0 39.8 23.7 19 19 A V E -PQ 87 131B 1 68,-3.1 68,-2.5 -2,-0.5 2,-0.4 -0.955 7.2-177.7-120.2 129.6 38.4 41.3 23.7 20 20 A R E +PQ 86 130B 121 110,-2.5 109,-3.4 -2,-0.5 110,-2.0 -0.984 21.7 142.9-123.1 134.1 39.7 44.1 21.5 21 21 A G E -PQ 85 128B 0 64,-2.4 64,-3.2 -2,-0.4 2,-0.5 -0.925 46.6 -97.9-157.3-178.9 43.2 45.4 21.6 22 22 A E E -PQ 84 127B 82 105,-2.6 105,-2.8 -2,-0.3 2,-0.4 -0.953 30.7-138.7-115.4 123.9 46.3 46.7 19.9 23 23 A V E - Q 0 126B 5 60,-3.3 60,-0.2 -2,-0.5 103,-0.2 -0.671 34.8 -99.5 -83.1 131.7 49.2 44.3 19.1 24 24 A A > - 0 0 23 101,-2.4 3,-1.5 -2,-0.4 58,-1.3 -0.138 24.7-128.7 -49.3 139.0 52.7 45.8 19.7 25 25 A P T 3 S+ 0 0 102 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.838 110.2 36.7 -59.9 -35.9 54.4 47.1 16.6 26 26 A D T 3 S+ 0 0 133 55,-0.1 2,-0.5 3,-0.0 -2,-0.1 -0.206 90.2 137.6-110.0 39.5 57.6 45.1 17.3 27 27 A A < - 0 0 7 -3,-1.5 3,-0.1 1,-0.1 55,-0.0 -0.753 41.9-166.5 -93.7 129.5 55.8 42.1 18.8 28 28 A K S S- 0 0 117 -2,-0.5 22,-2.4 1,-0.3 21,-2.1 0.661 79.6 -26.4 -80.8 -17.8 56.9 38.6 17.9 29 29 A S B -C 48 0A 17 19,-0.3 2,-0.3 20,-0.2 -1,-0.3 -0.965 59.5-134.8-179.4 169.6 53.6 37.4 19.4 30 30 A F - 0 0 0 17,-1.8 2,-0.4 -2,-0.3 -7,-0.0 -0.957 14.7-144.3-141.1 160.5 50.8 38.2 21.9 31 31 A V - 0 0 14 -2,-0.3 92,-1.7 15,-0.2 2,-0.4 -0.975 15.2-176.7-134.7 143.8 48.9 36.3 24.5 32 32 A L E -DE 45 122A 0 13,-1.9 13,-2.8 -2,-0.4 2,-0.4 -0.971 20.3-165.2-134.0 114.1 45.4 36.2 26.0 33 33 A N E -DE 44 121A 27 88,-3.4 88,-2.0 -2,-0.4 2,-0.4 -0.853 8.7-179.0-107.1 141.3 45.1 33.7 28.9 34 34 A L E +DE 43 120A 0 9,-2.1 9,-2.6 -2,-0.4 8,-1.5 -0.999 31.8 84.8-135.9 137.2 41.8 32.4 30.3 35 35 A G E S-DE 41 119A 0 84,-2.4 84,-2.3 -2,-0.4 83,-1.9 -0.916 84.7 -53.2 173.8-145.8 41.4 30.0 33.2 36 36 A K E S- 0 0 100 4,-2.7 2,-0.3 1,-0.4 5,-0.2 0.839 107.2 -29.4 -93.1 -44.7 41.1 29.6 37.0 37 37 A D E > S-D 40 0A 58 3,-1.4 3,-1.6 82,-0.1 -1,-0.4 -0.928 80.7 -69.1-160.3 179.1 44.4 31.4 37.8 38 38 A S T 3 S+ 0 0 65 -2,-0.3 3,-0.1 1,-0.3 -4,-0.0 0.679 131.5 39.3 -53.5 -22.8 47.8 32.2 36.4 39 39 A N T 3 S+ 0 0 82 1,-0.2 27,-2.4 26,-0.0 2,-0.4 0.463 112.0 58.3-107.8 -3.9 48.9 28.6 36.7 40 40 A N E < +D 37 0A 38 -3,-1.6 -4,-2.7 25,-0.2 -3,-1.4 -0.847 68.9 174.1-130.6 94.1 45.7 26.9 35.6 41 41 A L E -DF 35 63A 2 22,-1.8 22,-2.3 -2,-0.4 -6,-0.3 -0.896 27.4-172.2-111.0 125.8 44.7 28.0 32.1 42 42 A S E S+ 0 0 1 -8,-1.5 2,-0.3 -2,-0.5 69,-0.3 0.811 88.5 19.5 -77.1 -33.5 41.8 26.6 30.1 43 43 A L E -D 34 0A 0 -9,-2.6 -9,-2.1 67,-0.1 2,-0.8 -0.886 54.0-177.1-148.0 115.5 43.1 28.6 27.2 44 44 A H E -DF 33 61A 21 17,-2.8 17,-1.3 -2,-0.3 2,-0.8 -0.939 22.1-164.3-104.6 102.1 46.5 30.2 26.4 45 45 A F E +DF 32 60A 0 -13,-2.8 -13,-1.9 -2,-0.8 15,-0.2 -0.853 14.3 173.1 -95.0 109.7 45.7 31.9 23.1 46 46 A N E - F 0 59A 7 13,-2.9 13,-1.5 -2,-0.8 2,-0.4 -0.723 17.1-168.9-127.2 83.2 49.0 32.7 21.5 47 47 A P E - F 0 58A 0 0, 0.0 -17,-1.8 0, 0.0 2,-0.6 -0.571 17.7-157.4 -69.4 124.7 49.1 34.2 18.0 48 48 A R E +CF 29 57A 17 9,-2.6 9,-2.1 -2,-0.4 8,-0.5 -0.919 24.4 177.6-110.8 120.1 52.8 34.0 16.9 49 49 A F E S- 0 0 14 -21,-2.1 7,-1.1 -2,-0.6 -20,-0.2 0.901 88.7 -15.0 -81.3 -43.9 54.1 36.3 14.2 50 50 A N E S+ F 0 55A 105 -22,-2.4 2,-0.3 5,-0.2 5,-0.2 -0.586 99.3 116.0-162.0 88.9 57.6 35.1 14.6 51 51 A A E > S+ F 0 54A 17 3,-1.9 3,-2.1 -3,-0.1 -3,-0.1 -0.958 70.6 4.4-161.7 139.9 58.4 33.1 17.7 52 52 A H T 3 S- 0 0 152 -2,-0.3 3,-0.1 1,-0.3 -4,-0.0 0.781 128.9 -54.4 57.4 31.2 59.5 29.6 18.8 53 53 A G T 3 S+ 0 0 81 1,-0.3 2,-0.4 0, 0.0 -1,-0.3 0.303 111.3 123.6 88.2 -11.0 59.8 28.5 15.1 54 54 A D E < -F 51 0A 18 -3,-2.1 -3,-1.9 3,-0.1 2,-0.5 -0.708 42.4-166.6 -89.1 134.0 56.3 29.6 14.3 55 55 A A E S-F 50 0A 72 -2,-0.4 -5,-0.2 -5,-0.2 -6,-0.2 -0.961 74.3 -23.2-121.6 111.5 55.6 32.1 11.6 56 56 A N E S+ 0 0 95 -7,-1.1 2,-0.4 -2,-0.5 -7,-0.2 0.957 99.2 138.4 52.6 58.2 52.1 33.6 11.5 57 57 A T E -F 48 0A 21 -9,-2.1 -9,-2.6 -3,-0.1 2,-0.6 -0.997 53.1-131.7-137.4 135.9 50.5 30.7 13.4 58 58 A I E -F 47 0A 0 18,-0.5 16,-1.5 -2,-0.4 2,-0.5 -0.748 26.8-169.1 -83.0 121.3 47.9 30.7 16.1 59 59 A V E -FG 46 73A 0 -13,-1.5 -13,-2.9 -2,-0.6 2,-0.3 -0.963 4.5-175.9-115.5 128.5 49.0 28.4 18.9 60 60 A S E +FG 45 72A 0 12,-2.8 12,-2.3 -2,-0.5 2,-0.3 -0.917 10.7 155.9-121.9 148.9 46.6 27.4 21.7 61 61 A N E -F 44 0A 3 -17,-1.3 -17,-2.8 -2,-0.3 2,-0.2 -0.979 32.4-122.2-161.8 169.5 47.3 25.3 24.8 62 62 A S E - 0 0 8 -2,-0.3 7,-2.5 -19,-0.2 2,-0.4 -0.685 16.4-148.8-112.1 167.5 46.2 24.6 28.3 63 63 A K E -FH 41 68A 42 -22,-2.3 -22,-1.8 -2,-0.2 2,-0.5 -0.944 11.5-172.5-143.6 117.8 48.2 24.9 31.5 64 64 A D E > S- H 0 67A 96 3,-2.6 3,-2.1 -2,-0.4 -24,-0.2 -0.950 75.5 -20.3-118.1 116.4 47.5 22.5 34.4 65 65 A G T 3 S- 0 0 60 -2,-0.5 -25,-0.2 1,-0.3 -1,-0.2 0.814 130.4 -51.1 58.2 28.2 49.3 23.1 37.7 66 66 A G T 3 S+ 0 0 31 -27,-2.4 2,-0.6 1,-0.2 -1,-0.3 0.412 113.4 122.7 90.0 -1.7 51.8 25.1 35.7 67 67 A A E < -H 64 0A 61 -3,-2.1 -3,-2.6 -28,-0.2 -1,-0.2 -0.844 62.1-125.9-101.1 123.1 52.4 22.4 33.2 68 68 A W E -H 63 0A 127 -2,-0.6 -5,-0.2 -5,-0.2 3,-0.1 -0.358 24.8-147.2 -63.9 138.9 51.8 23.1 29.5 69 69 A G - 0 0 32 -7,-2.5 2,-0.5 1,-0.1 -1,-0.1 0.108 42.4 -54.4 -87.3-155.2 49.4 20.7 27.8 70 70 A T - 0 0 108 1,-0.1 -1,-0.1 -9,-0.0 -8,-0.1 -0.779 62.1-123.0 -90.4 126.3 49.5 19.6 24.1 71 71 A E - 0 0 84 -2,-0.5 2,-0.4 -10,-0.1 -10,-0.2 -0.235 18.5-156.6 -69.2 153.9 49.5 22.5 21.7 72 72 A Q E -G 60 0A 52 -12,-2.3 -12,-2.8 36,-0.0 2,-0.4 -0.988 8.3-162.2-129.5 137.7 46.9 23.1 18.9 73 73 A R E -G 59 0A 105 -2,-0.4 -14,-0.2 -14,-0.2 2,-0.2 -0.945 7.2-141.0-124.6 145.9 47.6 25.1 15.8 74 74 A E - 0 0 32 -16,-1.5 -16,-0.2 -2,-0.4 32,-0.0 -0.567 15.5-129.4-102.3 168.2 45.2 26.7 13.3 75 75 A A S S+ 0 0 93 -2,-0.2 2,-0.3 -18,-0.1 -1,-0.1 0.356 86.8 55.7 -96.9 3.0 45.3 27.1 9.5 76 76 A V - 0 0 43 -18,-0.1 -18,-0.5 2,-0.0 -2,-0.2 -0.905 55.9-163.9-131.7 161.7 44.6 30.8 9.3 77 77 A F + 0 0 35 -2,-0.3 2,-1.7 -20,-0.1 -20,-0.0 -0.560 9.7 175.4-147.7 76.6 46.2 33.9 10.9 78 78 A P + 0 0 21 0, 0.0 2,-0.4 0, 0.0 -2,-0.0 -0.247 49.3 103.7 -80.5 51.3 43.9 37.0 10.7 79 79 A F - 0 0 10 -2,-1.7 6,-0.1 6,-0.1 5,-0.0 -0.986 49.8-163.3-134.3 143.3 46.3 39.2 12.7 80 80 A Q - 0 0 107 -2,-0.4 3,-0.4 4,-0.2 -57,-0.2 -0.990 30.7-106.0-131.0 126.6 48.7 42.0 11.6 81 81 A P S S+ 0 0 71 0, 0.0 -57,-0.1 0, 0.0 3,-0.1 0.023 102.2 16.8 -44.1 150.7 51.5 43.4 13.7 82 82 A G S S+ 0 0 48 -58,-1.3 2,-0.3 1,-0.2 -58,-0.2 0.887 110.0 103.1 47.6 47.5 51.0 46.9 15.2 83 83 A S S S- 0 0 38 -3,-0.4 -60,-3.3 -60,-0.2 2,-0.2 -0.920 77.4 -81.1-148.2 172.3 47.3 46.7 14.6 84 84 A V E -P 22 0B 79 -2,-0.3 2,-0.4 -62,-0.3 -62,-0.3 -0.552 38.3-166.1 -81.2 142.4 44.0 46.1 16.4 85 85 A A E -P 21 0B 4 -64,-3.2 -64,-2.4 -2,-0.2 2,-0.5 -0.997 4.9-170.6-132.6 130.9 42.9 42.5 17.2 86 86 A E E +P 20 0B 51 -2,-0.4 2,-0.3 -66,-0.2 -66,-0.2 -0.980 10.6 169.8-125.2 123.5 39.4 41.4 18.3 87 87 A V E -P 19 0B 2 -68,-2.5 -68,-3.1 -2,-0.5 2,-0.4 -0.959 18.2-154.0-131.5 148.2 38.6 37.9 19.5 88 88 A S E -PR 18 99B 19 11,-1.9 11,-2.9 -2,-0.3 2,-0.4 -0.974 10.1-166.4-121.7 136.5 35.6 36.4 21.2 89 89 A I E -PR 17 98B 1 -72,-2.9 -72,-2.2 -2,-0.4 2,-0.5 -0.985 3.4-161.6-129.4 124.6 35.8 33.4 23.4 90 90 A T E -PR 16 97B 39 7,-3.1 7,-2.8 -2,-0.4 2,-0.4 -0.898 11.5-145.6-106.4 130.9 32.8 31.3 24.5 91 91 A F + 0 0 0 -76,-2.3 -77,-3.5 -2,-0.5 -76,-0.3 -0.789 26.8 161.6 -96.2 136.5 33.2 29.0 27.5 92 92 A D - 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