==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TOXIN 22-JUN-04 1TTK . COMPND 2 MOLECULE: OMEGA-CONOTOXIN MVIIA; . SOURCE 2 SYNTHETIC: YES; . AUTHOR D.J.ADAMS,A.B.SMITH,C.I.SCHROEDER,T.YASUDA,R.J.LEWIS . 25 1 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 2039.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 11 44.0 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 . 4 16.0 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 . 4 16.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 1 4.0 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 . 2 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 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 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 97 0, 0.0 14,-0.3 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0-177.3 19.7 -4.5 3.8 2 2 A K - 0 0 75 12,-0.2 15,-1.6 16,-0.1 14,-1.0 -0.930 360.0 -85.2-146.4 169.1 19.3 -1.1 5.7 3 3 A G > - 0 0 36 -2,-0.3 3,-1.5 13,-0.2 22,-0.3 -0.284 61.2 -80.9 -71.8 159.9 16.9 1.2 7.5 4 4 A K T 3 S+ 0 0 156 1,-0.3 -1,-0.1 11,-0.1 3,-0.1 -0.219 118.4 24.0 -60.3 153.8 14.8 3.7 5.6 5 5 A G T 3 S+ 0 0 39 20,-0.5 -1,-0.3 1,-0.2 3,-0.1 0.579 104.2 113.8 66.8 8.0 16.6 7.0 4.6 6 6 A A S < S- 0 0 26 -3,-1.5 19,-2.5 1,-0.2 -1,-0.2 -0.190 82.2 -53.7 -95.8-168.8 19.9 5.0 4.9 7 7 A K B S+A 24 0A 150 17,-0.2 2,-0.3 -3,-0.1 17,-0.2 -0.480 71.1 164.1 -68.7 135.9 22.4 4.1 2.1 8 8 A b - 0 0 14 15,-1.7 2,-0.3 -2,-0.2 12,-0.0 -0.846 32.0-140.9-143.8-179.2 20.7 2.3 -0.8 9 9 A S >> - 0 0 48 -2,-0.3 4,-2.7 13,-0.0 3,-1.1 -0.973 15.1-143.7-149.2 130.6 21.0 1.1 -4.4 10 10 A R T 34 S+ 0 0 162 -2,-0.3 9,-0.0 1,-0.2 -2,-0.0 0.199 106.9 50.4 -80.9 19.3 18.3 1.1 -7.1 11 11 A L T 34 S+ 0 0 133 0, 0.0 -1,-0.2 0, 0.0 -3,-0.0 0.345 124.8 22.9-130.7 -6.8 19.9 -2.1 -8.4 12 12 A M T <4 S- 0 0 132 -3,-1.1 -2,-0.2 0, 0.0 3,-0.1 0.579 81.9-146.7-128.4 -39.4 20.0 -4.0 -5.0 13 13 A Y < + 0 0 125 -4,-2.7 2,-0.4 1,-0.2 5,-0.1 0.989 22.3 179.5 56.8 62.8 17.4 -2.3 -2.9 14 14 A D + 0 0 53 -5,-0.3 2,-0.6 -13,-0.1 -12,-0.2 -0.223 40.3 120.3 -86.6 38.1 19.5 -2.9 0.2 15 15 A c > - 0 0 6 -2,-0.4 3,-1.5 3,-0.4 -12,-0.2 -0.871 46.1-170.9-115.1 96.6 16.7 -1.2 2.1 16 16 A a T 3 S+ 0 0 75 -14,-1.0 2,-0.3 -2,-0.6 -13,-0.2 0.873 93.3 45.1 -48.8 -42.9 15.1 -3.4 4.8 17 17 A T T 3 S- 0 0 91 -15,-1.6 2,-0.4 -3,-0.1 -1,-0.3 -0.322 131.5 -45.9 -99.7 46.4 12.5 -0.7 5.2 18 18 A G S < S- 0 0 47 -3,-1.5 -3,-0.4 -2,-0.3 2,-0.2 -0.983 76.4 -50.9 140.3-147.1 11.7 -0.0 1.5 19 19 A S - 0 0 68 -2,-0.4 2,-0.2 -5,-0.1 -9,-0.1 -0.662 63.3 -77.0-126.1 178.5 13.4 0.6 -1.8 20 20 A b - 0 0 17 -11,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.580 32.3-166.1 -86.7 150.1 16.2 3.0 -2.9 21 21 A R B > S-B 24 0A 182 3,-2.0 3,-0.8 -2,-0.2 -13,-0.0 -0.735 74.8 -43.9-137.0 82.0 15.5 6.6 -3.5 22 22 A S T 3 S- 0 0 128 -2,-0.3 3,-0.1 1,-0.2 -13,-0.0 0.895 122.4 -39.8 59.9 45.2 18.5 8.2 -5.4 23 23 A G T 3 S+ 0 0 44 1,-0.2 -15,-1.7 -16,-0.1 2,-0.4 0.400 130.6 87.2 87.6 -1.3 21.0 6.4 -3.2 24 24 A K B < AB 7 21A 120 -3,-0.8 -3,-2.0 -17,-0.2 -17,-0.2 -0.993 360.0 360.0-126.8 134.7 19.0 6.9 0.1 25 25 A c 0 0 15 -19,-2.5 -20,-0.5 -2,-0.4 -5,-0.2 -0.114 360.0 360.0 -63.5 360.0 16.3 4.4 1.1