==== 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 2JUQ . 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) . 1644.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 6 46.2 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 . 1 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 3 23.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 1 7.7 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 0 119 0, 0.0 11,-0.1 0, 0.0 7,-0.0 0.000 360.0 360.0 360.0 55.5 -2.1 8.7 -0.8 2 2 A a > > + 0 0 42 6,-0.1 3,-1.8 2,-0.1 6,-1.0 0.755 360.0 55.4-112.7 -45.0 -1.5 4.9 -1.1 3 3 A b G > 5S+ 0 0 68 1,-0.3 3,-1.5 2,-0.2 6,-0.1 0.672 89.6 82.0 -65.5 -12.0 -2.2 3.5 2.4 4 4 A S G 3 5S+ 0 0 108 1,-0.3 -1,-0.3 2,-0.1 -2,-0.1 0.668 92.4 48.1 -68.4 -11.8 -5.6 5.2 2.2 5 5 A D G < 5S- 0 0 109 -3,-1.8 -1,-0.3 3,-0.1 -2,-0.2 0.317 102.7-130.3-109.3 8.5 -6.8 2.2 0.2 6 6 A V T < 5S+ 0 0 115 -3,-1.5 -3,-0.1 1,-0.2 3,-0.1 0.711 96.8 79.5 52.4 16.1 -5.4 -0.5 2.6 7 7 A R S + 0 0 154 -2,-1.1 4,-1.5 -3,-0.1 -1,-0.2 0.828 62.7 60.5 -93.8 -38.4 1.4 -0.9 1.7 10 10 A Y T >4 S+ 0 0 186 -3,-0.3 3,-1.0 1,-0.2 -2,-0.1 0.985 113.3 33.6 -53.7 -70.8 4.7 -1.3 -0.1 11 11 A R T 34 S+ 0 0 179 1,-0.2 -1,-0.2 2,-0.1 -2,-0.1 0.806 107.1 75.4 -58.5 -25.2 5.1 2.3 -1.5 12 12 A b T 34 0 0 52 -4,-0.2 -1,-0.2 1,-0.2 -2,-0.2 0.938 360.0 360.0 -53.2 -46.7 3.4 3.5 1.8 13 13 A R << 0 0 264 -4,-1.5 -1,-0.2 -3,-1.0 -3,-0.1 0.696 360.0 360.0 55.9 360.0 6.6 2.8 3.7