==== 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 2JUT . 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) . 1630.0 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 . 1 7.7 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 . 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 89 0, 0.0 4,-1.9 0, 0.0 3,-0.6 0.000 360.0 360.0 360.0 127.0 -3.6 6.5 -1.5 2 2 A a T 34 + 0 0 44 1,-0.2 6,-0.2 2,-0.2 9,-0.1 0.881 360.0 64.3 -68.0 -35.3 -1.5 3.4 -0.7 3 3 A b T 34 S+ 0 0 99 1,-0.2 -1,-0.2 9,-0.2 9,-0.1 0.816 117.0 29.2 -59.2 -26.5 -2.6 3.4 3.0 4 4 A S T <4 S+ 0 0 102 -3,-0.6 -1,-0.2 8,-0.0 -2,-0.2 0.638 102.5 97.1-106.7 -19.2 -6.2 2.7 1.7 5 5 A D S < S- 0 0 68 -4,-1.9 -3,-0.0 3,-0.2 7,-0.0 -0.356 70.1-138.2 -70.0 153.2 -5.3 0.8 -1.5 6 6 A P S > S+ 0 0 104 0, 0.0 3,-0.7 0, 0.0 -1,-0.1 0.734 104.4 53.9 -82.9 -24.7 -5.3 -3.0 -1.4 7 7 A R T 3 S+ 0 0 206 1,-0.2 3,-0.2 2,-0.1 4,-0.1 0.692 109.6 48.9 -82.7 -17.1 -2.1 -3.2 -3.5 8 8 A a T 3 + 0 0 17 -6,-0.2 -1,-0.2 -7,-0.2 -3,-0.2 -0.154 66.6 150.9-112.4 38.6 -0.3 -0.9 -1.0 9 9 A R S < S- 0 0 191 -3,-0.7 -1,-0.2 1,-0.2 -2,-0.1 0.870 92.0 -3.7 -36.8 -50.4 -1.3 -2.7 2.2 10 10 A Y S S+ 0 0 210 -3,-0.2 2,-2.3 1,-0.1 3,-0.3 0.527 113.6 92.3-122.6 -13.8 2.0 -1.5 3.8 11 11 A R + 0 0 184 1,-0.2 -2,-0.1 -9,-0.1 -1,-0.1 -0.320 41.6 133.2 -80.0 61.5 3.7 0.3 1.0 12 12 A b 0 0 54 -2,-2.3 -1,-0.2 -10,-0.1 -9,-0.2 0.439 360.0 360.0 -90.3 3.0 2.2 3.7 1.9 13 13 A R 0 0 262 -3,-0.3 -3,-0.0 -11,-0.1 0, 0.0 -0.820 360.0 360.0-132.3 360.0 5.7 5.4 1.6