==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-MAY-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SIGNALING PROTEIN INHIBITOR, TOXIN 02-SEP-07 2JUS . COMPND 2 MOLECULE: ALPHA-CONOTOXIN RGIA; . SOURCE 2 SYNTHETIC: YES; . AUTHOR Z.FENG,M.ELLISON . 13 1 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 1558.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 4 30.8 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 . 2 15.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 2 15.4 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 0 129 0, 0.0 8,-0.1 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 153.8 0.4 8.4 -1.9 2 2 A a > + 0 0 49 6,-0.2 2,-2.0 1,-0.1 3,-0.9 0.135 360.0 119.6-117.2 20.1 -1.4 5.0 -2.4 3 3 A b T 3 + 0 0 73 1,-0.2 6,-0.1 6,-0.1 -1,-0.1 -0.201 49.2 94.5 -79.6 51.1 -1.1 3.7 1.2 4 4 A S T 3 S+ 0 0 97 -2,-2.0 -1,-0.2 1,-0.1 -2,-0.1 0.685 82.8 32.9-112.1 -28.2 -4.9 3.5 1.5 5 5 A D S X S- 0 0 45 -3,-0.9 3,-0.6 1,-0.0 4,-0.4 -0.742 79.2-111.9-124.6 174.6 -5.6 -0.2 0.6 6 6 A P T 3 S+ 0 0 126 0, 0.0 -3,-0.0 0, 0.0 -1,-0.0 0.406 114.0 56.8 -84.6 0.9 -3.9 -3.5 1.0 7 7 A R T 3 S+ 0 0 187 -5,-0.1 -4,-0.1 1,-0.1 3,-0.1 0.423 113.0 35.8-111.1 -0.6 -3.3 -3.7 -2.8 8 8 A a S < S+ 0 0 23 -3,-0.6 2,-1.6 -6,-0.2 4,-0.2 0.305 82.4 104.5-131.7 5.6 -1.3 -0.5 -3.2 9 9 A R + 0 0 131 -4,-0.4 4,-0.4 1,-0.2 -6,-0.1 -0.306 42.2 130.4 -86.2 57.6 0.7 -0.4 0.0 10 10 A W S S+ 0 0 197 -2,-1.6 -1,-0.2 1,-0.1 -2,-0.1 0.954 83.9 11.9 -72.5 -84.5 3.9 -1.4 -1.7 11 11 A R S S+ 0 0 199 -3,-0.2 -1,-0.1 1,-0.1 -2,-0.1 0.573 119.8 81.0 -71.2 -4.3 6.6 1.0 -0.6 12 12 A b 0 0 30 -4,-0.2 -1,-0.1 1,-0.2 -2,-0.1 0.981 360.0 360.0 -65.1 -81.3 4.1 2.2 2.1 13 13 A R 0 0 272 -4,-0.4 -1,-0.2 0, 0.0 -2,-0.1 0.321 360.0 360.0 45.0 360.0 4.4 -0.3 4.9