==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DE NOVO PROTEIN 11-OCT-02 1N0C . COMPND 2 MOLECULE: BHP_HWLV, DISULFIDE CYCLIZED BETA-HAIRPIN . SOURCE 2 SYNTHETIC: YES; . AUTHOR S.J.RUSSEL,T.BLANDL,N.J.SKELTON,A.G.COCHRAN . 10 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 1104.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 8 80.0 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 . 4 40.0 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 10.0 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 . 4 40.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 1 10.0 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+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 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 2 A a 0 0 122 0, 0.0 2,-0.3 0, 0.0 9,-0.3 0.000 360.0 360.0 360.0 141.6 7.4 1.8 -9.6 2 3 A H E -A 9 0A 97 7,-3.0 7,-3.2 2,-0.0 2,-0.6 -0.915 360.0-118.4-135.8 157.8 4.1 1.3 -11.5 3 4 A W E -A 8 0A 189 -2,-0.3 2,-0.6 5,-0.2 5,-0.2 -0.891 27.9-169.6-108.5 112.5 0.4 1.9 -10.7 4 5 A E E > -A 7 0A 106 3,-2.8 2,-2.4 -2,-0.6 3,-1.7 -0.915 57.1 -58.7-117.2 103.9 -1.7 -1.3 -10.7 5 6 A G T 3 S- 0 0 94 -2,-0.6 -2,-0.1 1,-0.3 3,-0.0 -0.382 127.4 -9.9 67.3 -71.8 -5.5 -0.9 -10.6 6 7 A N T 3 S+ 0 0 151 -2,-2.4 -1,-0.3 1,-0.0 2,-0.3 0.296 124.8 55.6-137.9 0.6 -5.7 1.1 -7.3 7 8 A K E < S-A 4 0A 104 -3,-1.7 -3,-2.8 2,-0.0 2,-0.5 -0.881 74.7-103.2-141.4 167.3 -2.1 1.0 -5.8 8 9 A L E -A 3 0A 80 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.856 31.0-170.6 -91.9 118.1 1.7 1.6 -6.2 9 10 A V E A 2 0A 46 -7,-3.2 -7,-3.0 -2,-0.5 -2,-0.0 -0.943 360.0 360.0-106.3 136.1 3.9 -1.4 -6.9 10 11 A a 0 0 115 -2,-0.4 -2,-0.0 -9,-0.3 -7,-0.0 -0.950 360.0 360.0-125.2 360.0 7.7 -1.1 -6.8