==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TOXIN 14-JUL-05 2CZP . COMPND 2 MOLECULE: MASTOPARAN X; . SOURCE 2 ORGANISM_SCIENTIFIC: VESPA SIMILLIMA XANTHOPTERA; . AUTHOR Y.TODOKORO,T.FUJIWARA,I.YUMEN,K.FUKUSHIMA,S.-W.KANG,J.- . 14 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 1751.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 9 64.3 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 . 0 0.0 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 . 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 . 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+3), SAME NUMBER PER 100 RESIDUES . 9 64.3 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 1 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 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 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 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 I 0 0 198 0, 0.0 2,-0.5 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 109.5 -9.5 4.3 0.2 2 2 A N > - 0 0 112 1,-0.2 4,-2.4 2,-0.0 5,-0.2 -0.775 360.0-145.5 -92.1 128.3 -9.0 0.7 1.1 3 3 A W H > S+ 0 0 225 -2,-0.5 4,-3.2 1,-0.2 5,-0.2 0.935 105.0 51.7 -54.2 -49.6 -6.5 0.1 4.0 4 4 A K H > S+ 0 0 169 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.900 107.9 52.8 -53.4 -44.4 -5.4 -3.1 2.3 5 5 A G H > S+ 0 0 29 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.894 111.0 46.2 -58.6 -43.1 -4.9 -1.1 -0.9 6 6 A I H X S+ 0 0 75 -4,-2.4 4,-3.6 2,-0.2 -2,-0.2 0.946 111.2 51.1 -64.7 -50.3 -2.7 1.4 1.0 7 7 A A H X S+ 0 0 56 -4,-3.2 4,-1.8 1,-0.3 -2,-0.2 0.904 113.5 45.6 -52.9 -45.3 -0.8 -1.4 2.7 8 8 A A H X S+ 0 0 41 -4,-2.8 4,-1.6 -5,-0.2 -1,-0.3 0.850 114.6 48.8 -66.4 -35.3 -0.2 -2.9 -0.7 9 9 A M H X S+ 0 0 118 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.847 106.3 56.1 -72.0 -36.1 0.7 0.5 -2.0 10 10 A A H X S+ 0 0 63 -4,-3.6 4,-0.6 1,-0.2 -2,-0.2 0.900 114.8 38.5 -62.1 -42.3 3.1 1.1 0.8 11 11 A K H < S+ 0 0 140 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.775 103.9 72.4 -77.8 -28.5 5.0 -2.0 -0.0 12 12 A K H < S+ 0 0 166 -4,-1.6 -2,-0.2 1,-0.3 -1,-0.2 0.915 100.9 43.6 -50.8 -48.5 4.5 -1.3 -3.7 13 13 A L H < 0 0 174 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.773 360.0 360.0 -68.1 -26.5 7.0 1.5 -3.4 14 14 A L < 0 0 185 -4,-0.6 -2,-0.2 -5,-0.2 -1,-0.2 0.924 360.0 360.0 -74.3 360.0 9.1 -0.9 -1.3