==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TOXIN 22-NOV-99 1DFZ . COMPND 2 MOLECULE: CONTRYPHAN-SM; . SOURCE 2 ORGANISM_SCIENTIFIC: CONUS STERCUSMUSCARUM; . AUTHOR P.K.PALLAGHY,W.HE,E.C.JIMENEZ,B.M.OLIVERA,R.S.NORTON . 8 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 1069.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 4 50.0 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 . 1 12.5 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 37.5 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 . 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 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 G 0 0 113 0, 0.0 2,-0.2 0, 0.0 4,-0.0 0.000 360.0 360.0 360.0-106.0 27.6 16.2 16.8 2 2 A C - 0 0 51 3,-1.2 2,-0.5 1,-0.1 5,-0.1 -0.530 360.0 -46.5-124.5-169.3 26.3 16.9 20.3 3 3 A X S S- 0 0 126 1,-0.2 2,-1.3 -2,-0.2 -1,-0.1 -0.490 127.5 -13.5 -64.1 113.6 23.0 18.3 21.7 4 4 A X S S+ 0 0 253 -2,-0.5 -1,-0.2 -3,-0.0 4,-0.0 -0.413 142.4 9.0 91.1 -59.0 22.2 21.4 19.6 5 5 A Q S S- 0 0 87 -2,-1.3 -3,-1.2 1,-0.2 3,-0.0 -0.861 73.5-110.7-140.8 174.2 25.8 21.5 18.2 6 6 A P S S+ 0 0 89 0, 0.0 2,-0.9 0, 0.0 -1,-0.2 0.985 95.4 75.4 -70.1 -72.8 29.1 19.5 18.0 7 7 A W 0 0 207 1,-0.2 -2,-0.0 -5,-0.1 -5,-0.0 -0.185 360.0 360.0 -45.8 87.8 31.5 21.5 20.2 8 8 A X 0 0 143 -2,-0.9 -1,-0.2 -4,-0.0 -4,-0.0 0.654 360.0 360.0-117.2 360.0 30.1 20.4 23.6