==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TOXIN 24-JAN-00 1DW4 . COMPND 2 MOLECULE: OMEGA-CONOTOXIN MVIIA; . SOURCE 2 SYNTHETIC: YES; . AUTHOR R.A.ATKINSON,B.KIEFFER,A.DEJAEGERE,F.SIROCKIN,J.-F.LEFEVRE . 25 1 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 2023.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 8 32.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 8.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 8.0 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 4.0 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 4.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 2 8.0 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 . 1 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 . 1 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 a 0 0 121 0, 0.0 2,-0.3 0, 0.0 14,-0.2 0.000 360.0 360.0 360.0 169.4 10.0 1.8 -3.5 2 2 A K B -a 15 0A 101 12,-4.2 14,-4.6 15,-0.0 15,-0.5 -0.787 360.0-117.6-122.3 168.2 6.9 4.0 -2.8 3 3 A G > - 0 0 41 -2,-0.3 3,-2.2 12,-0.2 22,-0.3 -0.770 45.2 -83.0-105.2 151.4 5.9 6.2 0.1 4 4 A K T 3 S+ 0 0 145 -2,-0.3 -1,-0.1 1,-0.3 16,-0.1 -0.040 117.8 29.9 -46.2 153.0 2.8 5.7 2.2 5 5 A G T 3 S+ 0 0 55 20,-2.4 2,-1.7 1,-0.1 -1,-0.3 0.236 86.2 114.0 78.9 -18.7 -0.4 7.0 0.7 6 6 A A S < S- 0 0 34 -3,-2.2 -1,-0.1 1,-0.2 -2,-0.1 -0.111 89.2-102.6 -78.2 46.4 1.0 6.3 -2.8 7 7 A K - 0 0 146 -2,-1.7 18,-0.4 18,-0.2 17,-0.3 0.307 44.5-153.6 52.5 164.2 -1.6 3.7 -3.4 8 8 A b - 0 0 19 15,-2.0 -1,-0.1 16,-0.2 17,-0.0 -0.981 17.1-135.4-161.2 170.5 -0.7 -0.0 -3.1 9 9 A S - 0 0 59 -2,-0.3 -1,-0.2 15,-0.0 14,-0.0 0.774 55.7 -84.0 -98.7 -86.9 -1.7 -3.5 -4.3 10 10 A R S S- 0 0 153 10,-0.0 10,-0.1 11,-0.0 13,-0.1 0.337 101.6 -13.3-156.7 -38.9 -1.8 -6.1 -1.6 11 11 A L S S+ 0 0 105 8,-0.1 -3,-0.0 2,-0.0 8,-0.0 0.017 83.4 124.2-167.1 42.1 1.7 -7.5 -1.0 12 12 A M S S- 0 0 106 0, 0.0 7,-0.0 0, 0.0 -4,-0.0 0.674 73.7-123.2 -83.4 -15.4 4.0 -6.4 -3.9 13 13 A Y + 0 0 179 -12,-0.0 6,-0.1 1,-0.0 -5,-0.0 0.954 68.2 133.2 74.9 49.5 6.4 -4.8 -1.4 14 14 A D + 0 0 58 -13,-0.1 -12,-4.2 -11,-0.0 5,-0.1 0.810 37.1 96.8 -99.3 -38.9 6.3 -1.3 -2.9 15 15 A c B -a 2 0A 15 -14,-0.2 -12,-0.2 1,-0.2 5,-0.1 -0.296 66.4-148.9 -55.0 122.8 5.9 0.8 0.2 16 16 A a S S+ 0 0 78 -14,-4.6 -1,-0.2 3,-0.1 -13,-0.2 0.888 88.1 12.8 -63.1 -38.0 9.3 2.0 1.2 17 17 A T S S+ 0 0 111 -15,-0.5 -14,-0.1 2,-0.1 -2,-0.0 0.616 133.0 6.9-104.5 -99.7 8.3 1.9 4.9 18 18 A G S S- 0 0 46 1,-0.1 2,-0.2 7,-0.0 3,-0.1 0.469 82.7-122.0 -60.9-143.3 5.1 0.2 6.0 19 19 A S - 0 0 53 1,-0.2 -1,-0.1 5,-0.1 -8,-0.1 -0.738 54.7 -17.3-148.1-162.9 3.2 -1.8 3.3 20 20 A b + 0 0 24 -2,-0.2 2,-0.4 5,-0.2 5,-0.2 -0.165 65.1 175.8 -46.7 132.2 -0.3 -2.0 1.7 21 21 A R B > -B 24 0B 170 3,-3.7 3,-3.2 -3,-0.1 -16,-0.1 -0.972 63.6 -21.7-146.2 128.9 -2.8 -0.1 3.8 22 22 A S T 3 S- 0 0 81 -2,-0.4 3,-0.1 1,-0.3 -14,-0.1 0.799 127.0 -55.7 44.1 26.0 -6.4 0.7 3.1 23 23 A G T 3 S+ 0 0 26 1,-0.4 -15,-2.0 -16,-0.1 -1,-0.3 0.077 130.2 86.2 96.4 -26.4 -5.5 0.0 -0.5 24 24 A K B < B 21 0B 95 -3,-3.2 -3,-3.7 -17,-0.3 -1,-0.4 -0.628 360.0 360.0-103.3 165.4 -2.7 2.7 -0.4 25 25 A c 0 0 2 -18,-0.4 -20,-2.4 -22,-0.3 -5,-0.2 -0.199 360.0 360.0 -62.8 360.0 0.9 2.3 0.8