==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-NOV-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ANTIMICROBIAL PROTEIN 18-SEP-12 2LYE . COMPND 2 MOLECULE: BTD-2; . SOURCE 2 SYNTHETIC: YES; . AUTHOR A.C.CONIBEAR,K.ROSENGREN,P.J.HARVEY,D.J.CRAIK . 18 1 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 2109.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 17 94.4 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 . 8 44.4 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 5.6 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 . 9 50.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 1 5.6 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 1 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 77 0, 0.0 2,-0.6 0, 0.0 17,-0.3 0.000 360.0 360.0 360.0 -14.3 -11.8 -4.0 -0.3 2 2 A V E -A 17 0A 101 15,-2.0 15,-3.0 2,-0.0 2,-0.6 -0.834 360.0-164.0 -95.6 118.0 -9.1 -2.8 -2.7 3 3 A a E -A 16 0A 73 -2,-0.6 2,-0.4 13,-0.3 13,-0.3 -0.917 4.2-170.4-107.6 122.4 -5.6 -3.2 -1.4 4 4 A R E -A 15 0A 177 11,-2.9 11,-3.1 -2,-0.6 2,-0.5 -0.893 7.2-154.6-107.0 138.9 -2.8 -1.3 -2.9 5 5 A b E -A 14 0A 71 -2,-0.4 2,-0.6 9,-0.3 9,-0.3 -0.971 4.0-162.6-120.4 126.3 0.7 -2.1 -2.1 6 6 A V E -A 13 0A 62 7,-3.0 7,-3.3 -2,-0.5 2,-0.5 -0.916 13.3-157.5-103.4 116.2 3.5 0.4 -2.5 7 7 A c E +A 12 0A 81 -2,-0.6 2,-0.4 5,-0.3 5,-0.3 -0.859 20.3 162.0-104.3 128.3 6.8 -1.2 -2.5 8 8 A R E > -A 11 0A 166 3,-3.1 3,-2.3 -2,-0.5 -2,-0.0 -0.981 69.0 -7.3-145.0 125.8 9.9 0.7 -1.6 9 9 A R T 3 S- 0 0 249 -2,-0.4 3,-0.1 1,-0.3 -1,-0.0 0.768 128.0 -57.4 63.0 28.6 13.3 -0.6 -0.6 10 10 A G T 3 S+ 0 0 78 1,-0.3 2,-0.5 0, 0.0 -1,-0.3 0.350 117.6 113.8 84.0 -7.4 11.9 -4.2 -0.5 11 11 A V E < -A 8 0A 74 -3,-2.3 -3,-3.1 2,-0.0 2,-0.7 -0.843 54.6-155.2 -98.1 124.8 9.3 -3.1 2.0 12 12 A c E -A 7 0A 66 -2,-0.5 2,-0.8 -5,-0.3 -5,-0.3 -0.901 3.0-161.3-107.6 120.3 5.7 -3.2 0.8 13 13 A R E -A 6 0A 156 -7,-3.3 -7,-3.0 -2,-0.7 2,-0.5 -0.861 12.4-161.6 -99.3 110.7 3.2 -0.9 2.4 14 14 A b E -A 5 0A 74 -2,-0.8 2,-0.5 -9,-0.3 -9,-0.3 -0.837 7.0-168.7-100.7 133.6 -0.2 -2.1 1.7 15 15 A V E -A 4 0A 79 -11,-3.1 -11,-2.9 -2,-0.5 2,-0.5 -0.984 8.1-154.5-121.9 117.5 -3.1 0.1 2.2 16 16 A a E +A 3 0A 85 -2,-0.5 2,-0.4 -13,-0.3 -13,-0.3 -0.833 16.6 173.1 -97.9 133.2 -6.6 -1.4 2.0 17 17 A R E A 2 0A 202 -15,-3.0 -15,-2.0 -2,-0.5 -2,-0.1 -0.927 360.0 360.0-144.0 110.6 -9.4 0.8 1.0 18 18 A R 0 0 238 -2,-0.4 -15,-0.1 -17,-0.3 -2,-0.0 0.867 360.0 360.0 58.1 360.0 -13.0 -0.5 0.4