==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ANTIMICROBIAL PROTEIN 02-JUL-07 2JSB . COMPND 2 MOLECULE: ARENICIN-1; . SOURCE 2 SYNTHETIC: YES; . AUTHOR I.B.JAKOVKIN,O.HECHT,C.GELHAUS,A.D.KRASNOSDEMBSKAYA, . 21 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 2461.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 10 47.6 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 . 9 42.9 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 . 1 4.8 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-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 4.8 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 . 0 0 0 0 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 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 R 0 0 278 0, 0.0 2,-0.3 0, 0.0 19,-0.0 0.000 360.0 360.0 360.0 143.4 2.1 0.0 -1.2 2 2 A W - 0 0 192 19,-1.7 19,-1.4 2,-0.0 2,-0.4 -0.953 360.0-124.0-161.5 159.2 5.7 -1.1 -1.8 3 3 A a E +A 20 0A 54 -2,-0.3 2,-0.3 17,-0.2 17,-0.2 -0.985 37.3 158.3-115.6 128.4 8.1 -1.8 -4.6 4 4 A V E -A 19 0A 66 15,-1.8 15,-1.9 -2,-0.4 13,-0.1 -0.880 47.9 -50.2-137.7 172.6 9.8 -5.2 -5.0 5 5 A Y E S+A 18 0A 135 -2,-0.3 2,-0.3 13,-0.2 13,-0.2 -0.059 70.8 133.0 -41.9 142.0 11.5 -7.4 -7.7 6 6 A A E -A 17 0A 8 11,-1.5 11,-2.5 -3,-0.1 2,-0.4 -0.943 52.8 -95.4-176.9-176.6 9.6 -7.8 -11.0 7 7 A Y E -A 16 0A 119 9,-0.3 9,-0.3 -2,-0.3 11,-0.0 -0.990 32.1-142.7-129.6 114.6 9.8 -7.7 -14.8 8 8 A V E -A 15 0A 33 7,-2.9 7,-1.4 -2,-0.4 2,-0.2 -0.110 7.1-140.4 -59.3-178.9 8.9 -4.5 -16.8 9 9 A R E +A 14 0A 169 5,-0.3 2,-0.5 7,-0.0 5,-0.3 -0.740 28.8 164.0-152.9 82.4 7.1 -4.6 -20.1 10 10 A V E > S-A 13 0A 84 3,-2.1 3,-1.4 -2,-0.2 -2,-0.0 -0.940 75.3 -10.4-107.8 125.8 8.4 -2.0 -22.7 11 11 A R T 3 S- 0 0 235 -2,-0.5 -1,-0.2 1,-0.3 3,-0.1 0.902 126.3 -59.0 54.2 51.4 7.4 -2.6 -26.3 12 12 A G T 3 S+ 0 0 75 -3,-0.3 2,-0.5 1,-0.2 -1,-0.3 0.761 117.2 117.3 47.8 30.4 6.0 -6.1 -25.6 13 13 A V E < -A 10 0A 90 -3,-1.4 -3,-2.1 2,-0.0 -1,-0.2 -0.982 62.5-140.9-129.0 100.0 9.5 -6.9 -24.4 14 14 A L E -A 9 0A 90 -2,-0.5 2,-0.3 -5,-0.3 -5,-0.3 -0.461 22.2-175.6 -58.9 137.0 9.7 -7.8 -20.7 15 15 A V E -A 8 0A 73 -7,-1.4 -7,-2.9 -2,-0.1 -2,-0.0 -0.919 32.2-105.3-145.7 113.3 12.8 -6.4 -19.0 16 16 A R E +A 7 0A 160 -2,-0.3 -9,-0.3 -9,-0.3 2,-0.3 -0.084 64.4 120.8 -39.6 133.0 13.7 -7.1 -15.4 17 17 A Y E -A 6 0A 89 -11,-2.5 -11,-1.5 -13,-0.1 2,-0.4 -0.926 60.4 -65.4-162.8-160.7 13.0 -4.2 -13.1 18 18 A R E -A 5 0A 177 -2,-0.3 2,-0.4 -13,-0.2 -13,-0.2 -0.916 38.7-162.3-112.2 134.9 11.1 -3.0 -9.9 19 19 A R E -A 4 0A 122 -15,-1.9 -15,-1.8 -2,-0.4 2,-0.4 -0.888 2.1-157.0-120.1 137.7 7.3 -2.7 -9.8 20 20 A a E A 3 0A 80 -2,-0.4 -17,-0.2 -17,-0.2 -2,-0.0 -0.903 360.0 360.0-115.0 142.9 5.2 -0.8 -7.3 21 21 A W 0 0 132 -19,-1.4 -19,-1.7 -2,-0.4 -2,-0.0 -0.925 360.0 360.0-175.6 360.0 1.5 -1.5 -6.5