==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TOXIN 09-SEP-93 1OMB . COMPND 2 MOLECULE: OMEGA-AGA-IVB; . SOURCE 2 ORGANISM_SCIENTIFIC: AGELENOPSIS APERTA; . AUTHOR H.YU,M.K.ROSEN,S.L.SCHREIBER . 34 1 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 3050.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 20 58.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 5.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 14.7 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 . 2 5.9 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-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 . 7 20.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 3 8.8 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 . 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 0 PARALLEL 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 ANTIPARALLEL BRIDGES PER LADDER . 0 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 4 A a 0 0 108 0, 0.0 2,-1.0 0, 0.0 15,-0.1 0.000 360.0 360.0 360.0-172.4 -4.1 -17.6 -12.7 2 5 A I B +a 16 0A 22 13,-1.2 15,-0.9 1,-0.1 5,-0.1 -0.715 360.0 154.1-103.2 86.3 -4.2 -21.2 -11.2 3 6 A A + 0 0 85 -2,-1.0 2,-0.2 13,-0.2 -1,-0.1 0.303 44.4 104.4 -93.5 11.4 -7.8 -22.3 -11.7 4 7 A E S > S- 0 0 146 4,-0.1 3,-1.0 -3,-0.1 2,-0.4 -0.513 83.5 -98.1 -88.7 161.1 -6.7 -26.0 -11.7 5 8 A D T 3 S- 0 0 143 1,-0.3 29,-0.1 -2,-0.2 3,-0.1 -0.619 105.3 -6.2 -79.7 132.1 -7.1 -28.4 -8.8 6 9 A Y T 3 S+ 0 0 148 27,-1.1 -1,-0.3 -2,-0.4 28,-0.1 0.733 93.4 175.6 58.6 16.5 -4.0 -28.7 -6.6 7 10 A G < - 0 0 7 -3,-1.0 26,-1.8 25,-0.2 -1,-0.2 -0.262 39.8-100.1 -54.1 136.2 -2.3 -26.6 -9.3 8 11 A K B +B 32 0B 145 24,-0.2 2,-0.2 -3,-0.1 24,-0.2 -0.247 54.1 171.8 -57.2 146.5 1.3 -25.9 -8.3 9 12 A b - 0 0 14 22,-1.8 22,-0.4 -3,-0.1 2,-0.3 -0.755 25.1-128.1-142.6-169.6 1.7 -22.4 -6.8 10 13 A T > - 0 0 93 4,-1.0 3,-1.7 -2,-0.2 2,-1.3 -0.989 27.6-110.3-150.1 138.0 4.2 -20.1 -5.1 11 14 A W T 3 S+ 0 0 205 -2,-0.3 3,-0.1 1,-0.3 4,-0.1 -0.513 112.9 5.7 -70.2 97.7 4.0 -18.1 -1.9 12 15 A G T 3 S+ 0 0 87 -2,-1.3 -1,-0.3 1,-0.2 3,-0.1 0.322 124.8 74.4 110.6 -6.7 4.1 -14.6 -3.3 13 16 A G S < S- 0 0 47 -3,-1.7 2,-0.6 1,-0.3 -1,-0.2 0.225 101.5 -5.3-107.5-128.6 3.9 -15.6 -7.0 14 17 A T S S- 0 0 81 -3,-0.1 -4,-1.0 -13,-0.1 -1,-0.3 -0.542 73.7-161.8 -70.5 114.4 0.9 -17.0 -8.9 15 18 A K - 0 0 144 -2,-0.6 -13,-1.2 -6,-0.1 2,-0.1 -0.486 30.3 -84.3 -92.7 167.6 -1.9 -17.4 -6.3 16 19 A c B > -a 2 0A 7 4,-0.6 3,-0.8 -15,-0.1 4,-0.5 -0.454 53.8-100.0 -70.4 140.7 -5.1 -19.5 -6.7 17 20 A a T 3 S+ 0 0 49 -15,-0.9 2,-0.9 1,-0.2 3,-0.1 -0.248 108.4 20.1 -58.4 148.3 -7.9 -17.8 -8.6 18 21 A R T 3 S- 0 0 229 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.1 -0.114 131.0 -73.5 83.3 -41.9 -10.6 -16.3 -6.3 19 22 A G < + 0 0 50 -2,-0.9 -2,-0.2 -3,-0.8 -1,-0.2 0.706 68.8 171.5 117.4 63.9 -8.2 -16.4 -3.3 20 23 A R - 0 0 128 -4,-0.5 -4,-0.6 -3,-0.1 -1,-0.1 -0.856 36.4-111.1-106.8 141.1 -7.6 -20.0 -2.1 21 24 A P - 0 0 104 0, 0.0 13,-1.6 0, 0.0 2,-0.5 -0.361 29.3-133.3 -65.3 140.9 -4.9 -20.9 0.5 22 25 A b E -C 33 0B 26 11,-0.2 11,-0.2 -2,-0.1 2,-0.2 -0.853 17.2-150.9-101.5 126.6 -2.0 -23.0 -0.9 23 26 A R E -C 32 0B 175 9,-2.2 9,-0.9 -2,-0.5 2,-0.2 -0.547 10.6-161.5 -91.5 160.2 -0.9 -26.0 1.1 24 27 A d - 0 0 32 7,-0.3 7,-0.2 -2,-0.2 -1,-0.0 -0.723 34.9-100.3-130.0-178.6 2.6 -27.4 1.1 25 28 A S - 0 0 63 -2,-0.2 6,-0.1 1,-0.1 -2,-0.0 -0.029 65.1 -97.5 -95.3 33.7 4.3 -30.8 2.1 26 29 A M S S+ 0 0 190 1,-0.1 -1,-0.1 3,-0.0 5,-0.0 0.683 119.8 78.9 62.8 12.0 5.4 -29.4 5.5 27 30 A I S S- 0 0 119 3,-0.1 -1,-0.1 0, 0.0 4,-0.1 0.456 102.0-118.8-125.8 -8.9 8.8 -28.7 3.7 28 31 A G S S+ 0 0 59 2,-0.1 3,-0.1 1,-0.0 -4,-0.0 0.975 84.3 95.4 69.5 53.0 8.0 -25.5 1.8 29 32 A T S S+ 0 0 88 1,-0.1 2,-1.4 -19,-0.0 -3,-0.0 0.348 78.5 26.6-134.2 -87.3 8.6 -27.0 -1.7 30 33 A N S S- 0 0 89 -22,-0.1 2,-0.6 -20,-0.0 -1,-0.1 -0.649 71.5-179.0 -87.8 90.1 5.8 -28.3 -3.8 31 34 A d - 0 0 12 -2,-1.4 -22,-1.8 -22,-0.4 2,-0.3 -0.784 7.7-162.4 -92.8 121.4 2.8 -26.3 -2.6 32 35 A E E -BC 8 23B 76 -9,-0.9 -9,-2.2 -2,-0.6 2,-0.3 -0.781 24.0-111.0-102.7 146.7 -0.5 -27.3 -4.3 33 36 A c E C 0 22B 4 -26,-1.8 -27,-1.1 -2,-0.3 -11,-0.2 -0.561 360.0 360.0 -75.3 132.7 -3.6 -25.1 -4.2 34 37 A T 0 0 75 -13,-1.6 -18,-0.0 -2,-0.3 -29,-0.0 -0.896 360.0 360.0-106.9 360.0 -6.4 -26.7 -2.2