==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TOXIN 25-DEC-01 1KOZ . COMPND 2 MOLECULE: VOLTAGE-DEPENDENT CHANNEL INHIBITOR; . SOURCE 2 SYNTHETIC: YES; . AUTHOR K.TAKEUCHI,E.J.PARK,C.W.LEE,J.I.KIM,H.TAKAHASHI,K.J.SWARTZ, . 36 1 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 3165.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 13 36.1 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 . 5 13.9 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 . 1 2.8 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 . 4 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 1 2.8 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 . 1 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 ANTIPARALLEL 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 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 D 0 0 203 0, 0.0 15,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 86.9 -11.7 5.6 -4.4 2 2 A a - 0 0 69 13,-0.1 2,-0.3 1,-0.1 13,-0.2 0.069 360.0-134.0 -49.4 172.7 -8.4 6.1 -2.5 3 3 A V - 0 0 42 4,-0.1 13,-1.7 11,-0.0 4,-0.1 -0.976 10.6-147.6-135.3 149.2 -7.1 3.2 -0.5 4 4 A R - 0 0 179 -2,-0.3 26,-0.3 1,-0.3 15,-0.0 -0.279 56.1 -29.9-102.6-168.3 -5.6 2.8 3.0 5 5 A F S S+ 0 0 69 1,-0.1 26,-0.3 26,-0.1 -1,-0.3 -0.089 128.6 11.5 -42.7 132.8 -3.0 0.5 4.5 6 6 A W S S+ 0 0 101 24,-1.1 2,-0.4 1,-0.2 -2,-0.2 0.984 85.8 149.3 58.3 81.0 -3.0 -2.8 2.7 7 7 A G - 0 0 11 23,-0.3 23,-1.1 -4,-0.1 -1,-0.2 -0.955 58.5 -93.9-146.9 123.4 -5.2 -2.2 -0.3 8 8 A K B +A 29 0A 166 -2,-0.4 21,-0.4 21,-0.3 2,-0.3 -0.036 60.2 165.6 -36.9 119.2 -4.8 -3.9 -3.7 9 9 A b - 0 0 5 19,-1.3 5,-0.1 1,-0.1 4,-0.0 -0.971 33.0-163.8-140.7 155.8 -2.6 -1.5 -5.7 10 10 A S - 0 0 99 -2,-0.3 -1,-0.1 2,-0.1 19,-0.1 0.817 61.7 -75.9-106.6 -57.7 -0.6 -1.7 -9.0 11 11 A Q S S+ 0 0 161 1,-0.3 2,-0.3 11,-0.0 10,-0.2 0.198 103.4 27.2-175.7 -39.5 1.9 1.2 -9.0 12 12 A T S S+ 0 0 111 1,-0.2 -1,-0.3 8,-0.1 -2,-0.1 -0.999 111.5 20.0-142.8 143.4 0.1 4.5 -9.9 13 13 A S S S+ 0 0 125 -2,-0.3 -1,-0.2 2,-0.1 3,-0.1 0.983 96.9 94.2 66.8 56.8 -3.4 5.8 -9.4 14 14 A D S S+ 0 0 47 1,-0.6 -5,-0.1 -3,-0.1 -6,-0.1 0.273 77.4 17.6-138.0 -89.5 -4.5 3.3 -6.7 15 15 A c S S- 0 0 22 -13,-0.2 -1,-0.6 1,-0.2 -11,-0.1 -0.134 97.0 -71.2 -81.3-175.0 -4.2 4.1 -2.9 16 16 A a > - 0 0 42 -13,-1.7 3,-1.6 1,-0.1 -1,-0.2 -0.407 43.6-107.6 -78.5 159.1 -3.8 7.7 -1.5 17 17 A P T 3 S+ 0 0 122 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.603 113.0 76.4 -59.7 -11.5 -0.6 9.6 -1.9 18 18 A H T 3 S+ 0 0 135 14,-0.0 15,-1.9 2,-0.0 2,-0.3 0.328 100.3 41.7 -85.1 12.8 -0.0 9.1 1.8 19 19 A L E < S-B 32 0B 23 -3,-1.6 2,-0.3 13,-0.3 13,-0.2 -0.850 74.4-130.0-143.7-179.5 1.0 5.5 1.1 20 20 A A E -B 31 0B 19 11,-2.2 11,-1.4 -2,-0.3 2,-0.8 -0.833 26.4-110.1-131.3 170.8 3.1 3.5 -1.4 21 21 A b S S+ 0 0 42 9,-0.3 2,-0.4 -2,-0.3 9,-0.2 -0.408 79.5 103.8-101.3 61.5 2.5 0.3 -3.6 22 22 A K - 0 0 125 -2,-0.8 2,-0.2 9,-0.1 9,-0.1 -0.898 45.3-175.0-142.5 110.6 4.9 -2.1 -1.8 23 23 A S - 0 0 10 -2,-0.4 -2,-0.0 6,-0.1 8,-0.0 -0.563 26.1-139.5-100.6 169.1 3.6 -4.8 0.6 24 24 A K S S- 0 0 159 -2,-0.2 -1,-0.1 3,-0.0 -2,-0.0 0.016 95.8 -4.5-114.8 27.4 5.5 -7.3 2.8 25 25 A W S S+ 0 0 199 0, 0.0 -2,-0.1 0, 0.0 0, 0.0 0.001 125.5 60.6-177.3 -60.2 3.3 -10.3 2.2 26 26 A P S S- 0 0 48 0, 0.0 -18,-0.0 0, 0.0 0, 0.0 0.858 78.6-160.6 -56.4 -33.5 0.2 -9.5 0.0 27 27 A R S S+ 0 0 156 1,-0.1 -6,-0.0 -19,-0.0 -5,-0.0 0.954 72.9 62.4 51.6 53.2 2.6 -8.5 -2.7 28 28 A N S S+ 0 0 98 -21,-0.0 -19,-1.3 1,-0.0 2,-0.2 0.263 85.1 77.0 167.5 38.3 -0.0 -6.4 -4.5 29 29 A I B S-A 8 0A 14 -21,-0.4 2,-0.5 -19,-0.1 -21,-0.3 -0.829 73.8 -98.1-147.0-173.4 -1.3 -3.6 -2.3 30 30 A c - 0 0 1 -23,-1.1 -24,-1.1 -26,-0.3 2,-0.4 -0.953 31.5-162.2-118.4 120.9 -0.5 -0.1 -1.0 31 31 A V E -B 20 0B 15 -11,-1.4 -11,-2.2 -2,-0.5 -9,-0.1 -0.852 31.1-100.7-106.0 137.2 0.9 0.2 2.5 32 32 A W E -B 19 0B 122 -2,-0.4 2,-0.9 -13,-0.2 -13,-0.3 -0.099 42.7-108.5 -46.7 145.8 0.9 3.5 4.5 33 33 A D + 0 0 62 -15,-1.9 2,-0.2 1,-0.1 -1,-0.1 -0.693 48.2 163.5 -84.5 107.4 4.3 5.3 4.3 34 34 A G + 0 0 45 -2,-0.9 2,-2.1 -3,-0.1 -1,-0.1 -0.454 1.0 166.7-120.9 61.4 5.9 4.9 7.8 35 35 A S 0 0 111 -2,-0.2 -2,-0.1 0, 0.0 0, 0.0 -0.490 360.0 360.0 -76.7 82.3 9.6 5.7 7.2 36 36 A V 0 0 207 -2,-2.1 -2,-0.0 0, 0.0 0, 0.0 0.053 360.0 360.0 -52.0 360.0 10.6 6.2 10.8