==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TOXIN 07-AUG-92 1FAS . COMPND 2 MOLECULE: FASCICULIN 1; . SOURCE 2 ORGANISM_SCIENTIFIC: DENDROASPIS ANGUSTICEPS; . AUTHOR M.H.LE DU,P.MARCHOT,P.E.BOUGIS,J.C.FONTECILLA-CAMPS . 61 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 4069.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 26 42.6 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 . 18 29.5 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 . 1 1.6 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 . 3 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 3 4.9 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 . 0 0 1 0 1 1 0 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 . 1 1 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 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 T 0 0 30 0, 0.0 16,-1.9 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 146.3 44.9 15.9 2.1 2 2 A M E -A 16 0A 50 14,-0.2 56,-3.2 15,-0.2 57,-0.4 -0.847 360.0-171.7 -87.7 135.3 42.0 16.4 -0.4 3 3 A a E -A 15 0A 0 12,-3.0 12,-2.6 -2,-0.5 2,-0.2 -0.869 29.6-106.1-129.6 155.2 39.2 18.1 1.5 4 4 A Y E -A 14 0A 41 -2,-0.3 19,-0.2 10,-0.2 10,-0.2 -0.526 30.6-167.0 -70.9 149.3 35.6 19.1 1.0 5 5 A S + 0 0 31 8,-0.6 32,-0.3 3,-0.2 2,-0.2 0.286 54.1 63.9-123.5 6.3 35.4 22.8 0.5 6 6 A H S S- 0 0 83 2,-0.2 30,-0.1 7,-0.2 29,-0.1 -0.811 82.5-111.0-129.4 173.5 31.7 23.7 0.7 7 7 A T S S+ 0 0 75 -2,-0.2 2,-0.3 28,-0.1 27,-0.2 0.631 108.9 49.9 -78.2 -17.8 28.8 23.7 3.3 8 8 A T S S- 0 0 75 29,-0.1 -2,-0.2 1,-0.0 -3,-0.2 -0.906 71.8-152.1-112.6 154.7 27.2 20.9 1.3 9 9 A T S S+ 0 0 43 -2,-0.3 4,-0.0 1,-0.1 -1,-0.0 0.281 73.2 94.0-103.7 9.6 29.1 17.8 0.1 10 10 A S + 0 0 101 2,-0.1 2,-0.2 0, 0.0 -1,-0.1 0.859 62.0 84.9 -70.0 -42.3 26.9 17.2 -3.0 11 11 A R S S- 0 0 185 -3,-0.2 2,-2.4 1,-0.1 -5,-0.1 -0.479 84.3-120.4 -76.5 137.3 28.9 19.0 -5.6 12 12 A A S S+ 0 0 116 -2,-0.2 2,-0.4 2,-0.0 -1,-0.1 -0.265 76.3 108.3 -76.0 54.5 31.7 17.2 -7.3 13 13 A I + 0 0 93 -2,-2.4 -8,-0.6 -4,-0.0 2,-0.3 -0.996 38.6 174.1-139.7 132.2 34.4 19.7 -6.2 14 14 A L E -A 4 0A 65 -2,-0.4 2,-0.4 -10,-0.2 -10,-0.2 -0.790 25.6-127.7-129.6 168.0 37.2 19.4 -3.7 15 15 A T E -A 3 0A 46 -12,-2.6 -12,-3.0 -2,-0.3 2,-1.0 -0.959 17.0-137.0-122.5 135.7 40.2 21.5 -2.6 16 16 A N E -A 2 0A 115 -2,-0.4 -14,-0.2 -14,-0.2 3,-0.1 -0.832 20.1-175.7 -94.7 102.8 43.7 20.0 -2.5 17 17 A b > - 0 0 16 -16,-1.9 3,-1.7 -2,-1.0 2,-0.2 0.555 17.9-158.0 -77.3 -6.1 45.0 21.3 0.8 18 18 A G T 3 S- 0 0 36 -17,-0.4 -1,-0.3 1,-0.3 -3,-0.0 -0.493 71.6 -7.4 66.4-125.9 48.5 19.8 0.2 19 19 A E T 3 S+ 0 0 198 -2,-0.2 -1,-0.3 -3,-0.1 2,-0.2 0.504 117.5 95.6 -84.3 -2.3 50.3 19.4 3.5 20 20 A N S < S- 0 0 76 -3,-1.7 -3,-0.1 -19,-0.1 21,-0.0 -0.505 76.5-106.2 -89.1 159.4 47.6 21.2 5.4 21 21 A S - 0 0 16 -2,-0.2 19,-2.9 1,-0.1 2,-0.3 -0.197 25.7-118.6 -74.9 166.6 44.7 19.7 7.4 22 22 A a E -BC 39 53B 0 31,-2.8 31,-2.0 17,-0.2 2,-0.3 -0.808 29.5-159.4 -93.4 147.9 41.0 19.8 6.4 23 23 A Y E -BC 38 52B 40 15,-2.6 15,-1.4 -2,-0.3 2,-0.4 -0.935 13.7-164.5-125.6 159.8 38.6 21.6 8.7 24 24 A R E -BC 37 51B 64 27,-2.3 27,-2.5 -2,-0.3 2,-0.4 -0.981 13.9-165.0-133.7 119.7 34.8 21.4 9.2 25 25 A K E +BC 36 50B 65 11,-3.0 10,-2.9 -2,-0.4 11,-1.4 -0.895 17.0 157.2-112.6 140.8 33.2 24.3 11.2 26 26 A S E -BC 34 49B 2 23,-2.2 23,-3.2 -2,-0.4 2,-0.3 -0.944 50.3 -75.2-148.5 164.7 29.7 24.1 12.6 27 27 A R E - C 0 48B 51 6,-2.0 21,-0.2 -2,-0.3 20,-0.1 -0.526 36.7-146.6 -63.4 127.4 27.5 25.6 15.3 28 28 A R S S+ 0 0 86 19,-3.0 -1,-0.2 -2,-0.3 20,-0.1 0.855 82.1 54.9 -64.5 -36.4 28.6 24.1 18.6 29 29 A H S S- 0 0 97 18,-0.5 4,-0.3 2,-0.2 20,-0.1 -0.754 105.5 -52.5-105.2 146.3 25.0 24.2 20.0 30 30 A P S S+ 0 0 101 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.296 120.6 52.2 -59.1 147.0 21.9 22.6 18.3 31 31 A P S S- 0 0 81 0, 0.0 2,-2.4 0, 0.0 -2,-0.2 0.396 82.3-162.2 -69.1 127.1 20.9 23.0 15.5 32 32 A K + 0 0 122 -4,-0.1 2,-0.1 -6,-0.1 -4,-0.1 -0.355 18.8 177.3 -81.6 64.4 24.6 22.0 14.7 33 33 A M - 0 0 99 -2,-2.4 -6,-2.0 -4,-0.3 2,-0.3 -0.418 34.6-111.8 -71.1 142.4 24.5 23.4 11.1 34 34 A V E -B 26 0B 34 -8,-0.2 -8,-0.3 -27,-0.2 3,-0.1 -0.540 31.9-177.5 -73.8 131.7 27.7 23.2 9.0 35 35 A L E - 0 0 71 -10,-2.9 2,-0.3 1,-0.4 -9,-0.2 0.527 59.6 -24.7-110.5 -12.3 29.0 26.7 8.4 36 36 A G E -B 25 0B 10 -11,-1.4 -11,-3.0 -30,-0.1 -1,-0.4 -0.876 45.0-155.0 172.6 160.9 32.1 26.0 6.2 37 37 A R E +B 24 0B 20 -32,-0.3 2,-0.3 -2,-0.3 -13,-0.2 -0.970 37.3 112.4-146.0 147.4 34.7 23.4 5.2 38 38 A G E -B 23 0B 8 -15,-1.4 -15,-2.6 -2,-0.3 2,-0.3 -0.981 60.8 -38.6 176.8-156.0 38.2 24.1 3.8 39 39 A b E S+B 22 0B 51 -2,-0.3 2,-0.2 -17,-0.2 -17,-0.2 -0.704 94.5 24.6 -96.1 143.9 42.0 23.9 4.3 40 40 A G S S- 0 0 11 -19,-2.9 -2,-0.1 -2,-0.3 -23,-0.0 -0.669 83.5 -91.2 106.7-161.5 43.6 24.7 7.7 41 41 A c - 0 0 77 -2,-0.2 -1,-0.1 11,-0.1 11,-0.1 -0.491 39.2-167.1-157.4 74.4 42.3 24.6 11.2 42 42 A P - 0 0 47 0, 0.0 2,-0.2 0, 0.0 -2,-0.0 -0.187 34.1 -90.2 -62.7 157.2 40.8 27.9 12.4 43 43 A P - 0 0 114 0, 0.0 2,-0.1 0, 0.0 5,-0.0 -0.524 35.7-149.9 -72.3 136.8 40.0 28.5 16.1 44 44 A G + 0 0 37 -2,-0.2 2,-0.2 6,-0.2 5,-0.2 -0.382 16.4 177.6 -87.8 179.4 36.6 27.6 17.6 45 45 A D - 0 0 85 3,-2.1 5,-0.1 -2,-0.1 -17,-0.1 -0.781 55.1 -56.5-156.5-156.7 34.9 29.3 20.5 46 46 A D S S+ 0 0 125 -2,-0.2 3,-0.1 1,-0.2 -17,-0.1 0.786 136.4 36.2 -66.2 -31.8 31.6 29.0 22.4 47 47 A Y S S+ 0 0 112 1,-0.2 -19,-3.0 -19,-0.1 2,-0.5 0.862 115.0 55.4 -85.2 -41.9 29.6 29.5 19.2 48 48 A L E -C 27 0B 29 -21,-0.2 -3,-2.1 -20,-0.1 2,-0.4 -0.843 59.4-162.4-111.7 127.9 31.8 27.7 16.7 49 49 A E E -C 26 0B 39 -23,-3.2 -23,-2.2 -2,-0.5 2,-0.5 -0.846 11.1-169.2-100.2 133.7 33.0 24.1 16.7 50 50 A V E -C 25 0B 28 -2,-0.4 2,-0.4 -25,-0.2 -25,-0.2 -0.981 3.3-169.0-130.7 114.6 36.0 23.4 14.4 51 51 A K E -C 24 0B 115 -27,-2.5 -27,-2.3 -2,-0.5 2,-0.4 -0.885 7.6-165.8 -99.5 142.2 37.1 19.8 13.7 52 52 A c E +C 23 0B 51 -2,-0.4 2,-0.3 -29,-0.2 -29,-0.2 -0.983 9.7 174.0-132.8 134.4 40.4 19.3 11.9 53 53 A d E -C 22 0B 30 -31,-2.0 -31,-2.8 -2,-0.4 7,-0.1 -0.974 24.2-163.3-141.4 150.7 41.6 16.1 10.3 54 54 A T + 0 0 96 1,-0.4 -1,-0.1 -2,-0.3 -31,-0.0 0.546 63.1 72.8-114.7 -13.5 44.6 15.2 8.2 55 55 A S S S+ 0 0 83 -54,-0.1 -1,-0.4 -33,-0.1 2,-0.2 -0.955 71.2 25.4-159.8 167.7 43.5 11.8 6.8 56 56 A P S > S- 0 0 101 0, 0.0 3,-1.3 0, 0.0 -3,-0.0 0.709 90.9 -92.3 -68.3-172.7 41.8 10.0 5.1 57 57 A D T 3 S+ 0 0 97 1,-0.3 -54,-0.2 -2,-0.2 -2,-0.1 -0.373 112.6 18.4 -62.0 147.2 40.9 12.2 2.1 58 58 A K T > S+ 0 0 90 -56,-3.2 3,-1.3 1,-0.1 -1,-0.3 0.663 79.2 146.5 63.0 25.9 37.6 14.0 2.6 59 59 A d T < + 0 0 35 -3,-1.3 -2,-0.1 -57,-0.4 -1,-0.1 0.676 55.9 73.9 -66.6 -14.5 37.8 13.4 6.3 60 60 A N T 3 0 0 4 1,-0.2 -1,-0.3 -7,-0.1 -9,-0.1 0.136 360.0 360.0 -90.1 22.8 36.0 16.8 7.0 61 61 A Y < 0 0 170 -3,-1.3 -1,-0.2 -37,-0.1 -2,-0.1 0.934 360.0 360.0 -58.7 360.0 32.6 15.5 5.8