==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ANTIMICROBIAL PROTEIN 03-JAN-13 2M2Y . COMPND 2 MOLECULE: BTD-2[3,4]; . SOURCE 2 SYNTHETIC: YES; . AUTHOR A.C.CONIBEAR,K.ROSENGREN,N.L.DALY,S.TROIERA HENRIQUES,D.J.CR . 18 1 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 2071.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 13 72.2 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 . 6 33.3 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 . 2 11.1 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 . 7 38.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 2 11.1 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 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 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 0 152 0, 0.0 11,-0.4 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 100.6 -2.2 5.3 2.7 2 2 A a - 0 0 71 9,-0.2 2,-0.6 16,-0.1 9,-0.3 -0.980 360.0-139.0-120.7 137.6 0.7 3.1 1.7 3 3 A V E -A 10 0A 54 7,-3.1 7,-3.1 -2,-0.4 2,-0.5 -0.847 17.3-165.7-101.9 119.7 2.9 1.4 4.2 4 4 A b E -A 9 0A 73 -2,-0.6 2,-0.5 5,-0.3 5,-0.3 -0.906 9.1-175.8-109.6 133.7 6.5 1.4 3.5 5 5 A R E > S-A 8 0A 170 3,-2.4 3,-1.8 -2,-0.5 -2,-0.0 -0.919 76.6 -32.2-130.1 98.8 8.9 -0.8 5.3 6 6 A R T 3 S- 0 0 255 -2,-0.5 3,-0.1 1,-0.3 -1,-0.1 0.899 128.5 -40.8 58.3 45.6 12.5 -0.2 4.3 7 7 A G T 3 S+ 0 0 71 1,-0.2 2,-1.0 0, 0.0 -1,-0.3 0.175 114.2 117.3 92.3 -19.0 11.6 0.6 0.8 8 8 A V E < -A 5 0A 96 -3,-1.8 -3,-2.4 2,-0.0 2,-0.6 -0.727 48.0-168.5 -85.8 103.3 9.0 -2.1 0.5 9 9 A b E +A 4 0A 78 -2,-1.0 2,-0.4 -5,-0.3 -5,-0.3 -0.839 12.2 171.5 -99.2 123.6 5.8 -0.1 -0.0 10 10 A R E -A 3 0A 180 -7,-3.1 -7,-3.1 -2,-0.6 2,-0.8 -0.999 27.9-133.4-131.2 129.5 2.5 -2.0 0.3 11 11 A a - 0 0 63 -2,-0.4 2,-1.3 -9,-0.3 -9,-0.2 -0.753 11.0-162.7 -91.9 113.4 -0.8 -0.2 0.2 12 12 A V - 0 0 68 -2,-0.8 2,-0.2 -11,-0.4 -1,-0.0 -0.793 24.6-174.1 -92.7 92.3 -3.1 -1.3 2.9 13 13 A c - 0 0 43 -2,-1.3 2,-1.1 5,-0.2 5,-0.3 -0.489 33.9-120.0 -89.3 158.9 -6.2 0.0 1.5 14 14 A R B > S-B 17 0B 190 3,-3.1 3,-1.7 -2,-0.2 4,-0.0 -0.788 81.2 -58.7-100.2 83.2 -9.6 0.1 3.0 15 15 A R T 3 S- 0 0 243 -2,-1.1 -1,-0.1 1,-0.3 3,-0.1 0.878 124.3 -19.7 39.2 63.2 -11.3 -1.9 0.3 16 16 A G T 3 S+ 0 0 69 1,-0.1 2,-1.3 0, 0.0 -1,-0.3 0.147 115.9 104.9 101.7 -20.8 -10.5 0.4 -2.5 17 17 A V B < B 14 0B 102 -3,-1.7 -3,-3.1 -16,-0.0 -1,-0.1 -0.768 360.0 360.0 -95.4 86.2 -9.8 3.4 -0.3 18 18 A c 0 0 93 -2,-1.3 -5,-0.2 -5,-0.3 -16,-0.1 -0.775 360.0 360.0 -82.2 360.0 -6.1 3.4 -0.5