==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TOXIN 18-JAN-98 1XGB . COMPND 2 MOLECULE: ALPHA-CONOTOXIN GI; . AUTHOR J.GEHRMANN,P.F.ALEWOOD,D.J.CRAIK . 13 1 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 1271.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1 7.7 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 . 1 7.7 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 E > 0 0 147 0, 0.0 3,-1.3 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 -49.1 -6.4 2.7 1.1 2 2 A a T 3 - 0 0 69 1,-0.3 11,-0.2 11,-0.1 10,-0.1 -0.255 360.0 -42.2 -49.7 101.9 -5.4 2.3 4.8 3 3 A b T 3 S- 0 0 49 -2,-0.4 -1,-0.3 9,-0.3 10,-0.1 0.875 91.2-143.0 36.9 55.9 -2.7 -0.5 4.8 4 4 A N S < S- 0 0 67 -3,-1.3 5,-0.2 2,-0.3 -1,-0.2 -0.853 74.6 -9.0-101.1 124.2 -4.8 -2.5 2.4 5 5 A P S S- 0 0 127 0, 0.0 -1,-0.2 0, 0.0 -3,-0.0 -0.944 145.3 -35.4 -79.8 -23.1 -4.9 -5.3 2.7 6 6 A A S S- 0 0 77 -2,-0.0 -2,-0.3 0, 0.0 -3,-0.1 -0.341 91.2 -73.2-160.6 69.5 -2.1 -5.1 5.3 7 7 A b S S+ 0 0 44 2,-0.1 3,-0.4 1,-0.1 -3,-0.1 0.759 76.1 155.6 44.6 31.6 0.5 -2.3 4.6 8 8 A G S S+ 0 0 42 1,-0.3 -1,-0.1 2,-0.1 -5,-0.0 0.955 88.0 12.0 -46.1 -64.0 1.9 -4.6 1.8 9 9 A R S S- 0 0 211 -5,-0.2 -1,-0.3 0, 0.0 -2,-0.1 0.116 122.9-102.7-100.5 16.3 3.4 -1.6 -0.0 10 10 A H - 0 0 145 -3,-0.4 -2,-0.1 -4,-0.1 -8,-0.0 0.992 50.3-151.5 54.1 71.4 2.7 0.4 3.2 11 11 A Y - 0 0 82 1,-0.1 -8,-0.2 -10,-0.1 2,-0.1 -0.102 11.2-102.7 -65.1 163.6 -0.3 2.2 1.9 12 12 A S 0 0 80 1,-0.1 -9,-0.3 -10,-0.1 -8,-0.2 -0.359 360.0 360.0 -87.2 168.7 -1.5 5.6 3.0 13 13 A a 0 0 131 -11,-0.2 -1,-0.1 -2,-0.1 -11,-0.1 0.169 360.0 360.0-170.2 360.0 -4.4 6.6 5.4