==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TOXIN 30-APR-05 1ZJQ . COMPND 2 MOLECULE: JINGZHAOTOXIN-VII; . SOURCE 2 ORGANISM_SCIENTIFIC: CHILOBRACHYS JINGZHAO; . AUTHOR Z.LIAO . 34 1 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 2917.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 13 38.2 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 14.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 2.9 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 . 3 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 1 2.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 1 2.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 2.9 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 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 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 G 0 0 134 0, 0.0 2,-0.5 0, 0.0 6,-0.0 0.000 360.0 360.0 360.0 59.7 11.3 4.5 3.8 2 2 A a - 0 0 88 16,-0.0 2,-0.7 5,-0.0 15,-0.3 -0.944 360.0-145.7-120.2 116.6 7.7 5.7 3.8 3 3 A G + 0 0 8 -2,-0.5 14,-2.4 1,-0.1 15,-0.4 -0.675 31.2 159.5 -81.5 116.2 5.1 4.0 1.5 4 4 A G S S- 0 0 24 -2,-0.7 3,-0.2 12,-0.2 -1,-0.1 0.632 70.4 -34.9-101.0-102.3 2.6 6.5 0.3 5 5 A L S S+ 0 0 103 1,-0.2 26,-0.1 25,-0.1 -2,-0.1 0.499 142.4 33.3-104.0 -5.0 0.5 5.8 -2.9 6 6 A M S S+ 0 0 132 24,-0.1 -1,-0.2 2,-0.0 24,-0.1 -0.188 82.3 137.3-143.0 47.6 3.3 3.8 -4.7 7 7 A A - 0 0 27 22,-0.6 2,-0.5 -3,-0.2 -4,-0.1 0.190 61.3 -83.2 -76.1-157.9 5.3 2.0 -2.1 8 8 A G + 0 0 46 20,-0.2 3,-0.3 1,-0.1 20,-0.3 -0.940 36.7 175.5-118.7 117.8 6.6 -1.6 -2.4 9 9 A b > + 0 0 15 18,-2.6 3,-0.9 -2,-0.5 19,-0.2 0.083 52.3 108.6-104.4 24.2 4.2 -4.5 -1.5 10 10 A D T 3 S+ 0 0 132 17,-0.3 -1,-0.2 1,-0.2 18,-0.1 0.829 72.6 60.5 -69.8 -28.9 6.7 -7.2 -2.6 11 11 A G T 3 S- 0 0 37 -3,-0.3 -1,-0.2 1,-0.1 -2,-0.1 0.666 99.3-139.4 -72.1 -13.8 7.3 -8.2 1.0 12 12 A K S < S+ 0 0 177 -3,-0.9 -2,-0.1 1,-0.1 -1,-0.1 0.615 92.2 57.0 65.7 9.7 3.5 -9.1 1.3 13 13 A S + 0 0 94 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.042 69.0 144.9-159.4 36.8 3.6 -7.4 4.8 14 14 A T - 0 0 60 1,-0.1 8,-0.2 -6,-0.1 -5,-0.0 -0.314 41.5-145.9 -76.3 165.0 4.9 -3.8 4.5 15 15 A F - 0 0 185 1,-0.2 5,-0.2 6,-0.1 -1,-0.1 0.302 25.4-152.2-114.5 8.5 3.5 -1.0 6.7 16 16 A c - 0 0 15 -8,-0.2 -1,-0.2 2,-0.1 -12,-0.2 -0.110 39.2 -73.0 50.7-152.6 3.7 1.9 4.2 17 17 A a S S- 0 0 47 -14,-2.4 2,-0.3 -15,-0.3 -13,-0.1 0.821 90.9 -36.2-102.7 -72.9 4.1 5.3 5.9 18 18 A S S S+ 0 0 101 -15,-0.4 3,-0.1 1,-0.1 -1,-0.1 -0.816 121.3 4.8-159.8 114.5 0.9 6.5 7.6 19 19 A G S S+ 0 0 54 -2,-0.3 13,-0.7 1,-0.2 2,-0.4 0.924 94.0 120.5 79.2 45.5 -2.7 5.9 6.5 20 20 A Y E -A 31 0A 86 11,-0.2 11,-0.3 -5,-0.2 2,-0.2 -0.935 47.6-154.0-144.9 120.3 -1.9 3.7 3.5 21 21 A N E -A 30 0A 89 9,-1.2 9,-4.3 -2,-0.4 2,-0.3 -0.624 25.6-115.9 -90.6 151.5 -3.1 0.1 2.9 22 22 A b E -A 29 0A 27 7,-0.3 7,-0.2 -2,-0.2 -1,-0.0 -0.661 22.3-145.3 -89.0 142.1 -1.0 -2.2 0.6 23 23 A S E >> -A 28 0A 20 5,-1.8 4,-1.6 -2,-0.3 5,-0.8 -0.917 9.6-162.7-110.3 127.7 -2.5 -3.5 -2.6 24 24 A P T 45S+ 0 0 109 0, 0.0 -1,-0.1 0, 0.0 5,-0.0 0.806 93.7 51.0 -75.2 -31.2 -1.8 -7.0 -3.9 25 25 A T T 45S+ 0 0 123 1,-0.2 -2,-0.0 3,-0.1 0, 0.0 0.814 121.9 32.0 -77.0 -29.4 -2.9 -6.3 -7.5 26 26 A W T 45S- 0 0 148 2,-0.2 -1,-0.2 -17,-0.0 -17,-0.1 0.654 97.8-136.3-100.7 -18.4 -0.8 -3.1 -7.7 27 27 A K T <5S+ 0 0 111 -4,-1.6 -18,-2.6 1,-0.2 -17,-0.3 0.828 71.7 83.2 67.4 32.9 2.1 -4.3 -5.5 28 28 A W E