==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DE NOVO PROTEIN 09-APR-02 1LE1 . COMPND 2 MOLECULE: TRYPTOPHAN ZIPPER 2; . SOURCE 2 SYNTHETIC: YES; . AUTHOR A.G.COCHRAN,N.J.SKELTON,M.A.STAROVASNIK . 12 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 1510.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 6 50.0 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 . 5 41.7 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 8.3 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 . 1 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 1 8.3 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 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 S 0 0 87 0, 0.0 11,-3.0 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 129.9 -3.2 8.1 1.0 2 2 A W E +A 11 0A 154 9,-0.2 2,-0.3 7,-0.1 9,-0.2 -0.703 360.0 178.0 -77.1 127.1 -2.1 4.6 1.9 3 3 A T E -A 10 0A 71 7,-2.5 7,-2.7 -2,-0.4 2,-0.5 -0.944 30.1-108.6-128.8 147.5 -4.5 1.8 0.7 4 4 A W E +A 9 0A 158 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.698 36.8 170.2 -83.0 129.2 -4.1 -2.0 1.1 5 5 A E E > -A 8 0A 122 3,-2.7 3,-2.1 -2,-0.5 -2,-0.0 -0.989 62.6 -36.4-141.1 122.7 -3.3 -4.2 -2.0 6 6 A N T 3 S- 0 0 159 -2,-0.4 3,-0.1 1,-0.3 -1,-0.0 0.749 125.7 -29.8 31.2 71.2 -2.3 -7.9 -1.8 7 7 A G T 3 S+ 0 0 53 1,-0.2 -1,-0.3 0, 0.0 2,-0.3 0.402 128.3 70.0 81.6 -2.3 -0.2 -8.1 1.3 8 8 A K E < S-A 5 0A 157 -3,-2.1 -3,-2.7 -5,-0.0 2,-0.4 -0.869 75.8-114.2-138.8 169.5 1.1 -4.5 1.1 9 9 A W E -A 4 0A 155 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.912 29.8-169.2-101.2 135.6 0.3 -0.8 1.3 10 10 A T E -A 3 0A 54 -7,-2.7 -7,-2.5 -2,-0.4 2,-1.0 -0.941 28.5-113.2-123.9 146.8 0.5 1.4 -1.9 11 11 A W E A 2 0A 174 -2,-0.3 -9,-0.2 -9,-0.2 -7,-0.0 -0.729 360.0 360.0 -85.1 100.4 0.3 5.2 -2.1 12 12 A K 0 0 166 -11,-3.0 -2,-0.0 -2,-1.0 0, 0.0 -0.817 360.0 360.0 -99.8 360.0 -3.0 6.1 -3.8