==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DE NOVO PROTEIN 21-MAY-11 2LDD . COMPND 2 MOLECULE: ESTROGEN RECEPTOR-BINDING STAPLED PEPTIDE SP6; . SOURCE 2 SYNTHETIC: YES . AUTHOR C.PHILLIPS,R.BAZIN,A.BENT,N.DAVIES,R.MOORE,A.PANNIFER,A.PICK . 13 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 1855.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 8 61.5 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 . 0 0.0 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 . 0 0.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 1 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 7 53.8 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 1 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 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 . 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 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 E > 0 0 183 0, 0.0 4,-1.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -1.0 5.8 2.9 -6.2 2 2 A K H > + 0 0 186 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.805 360.0 53.1 -74.9 -35.5 5.6 -0.7 -4.7 3 3 A H H > S+ 0 0 154 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.822 107.0 53.1 -71.8 -33.1 5.6 0.6 -1.0 4 4 A K H > S+ 0 0 127 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.890 108.7 48.2 -66.4 -45.0 2.6 3.0 -1.7 5 5 A I H X S+ 0 0 116 -4,-1.1 4,-1.5 2,-0.2 -2,-0.2 0.871 112.3 49.0 -66.0 -39.5 0.4 0.2 -3.2 6 6 A L H X S+ 0 0 117 -4,-1.5 4,-1.5 1,-0.2 3,-0.2 0.908 107.9 53.6 -64.5 -48.1 1.1 -2.3 -0.3 7 7 A X H X S+ 0 0 93 -4,-1.8 4,-1.5 1,-0.2 -1,-0.2 0.820 112.5 45.8 -53.6 -41.6 0.3 0.5 2.4 8 8 A R H < S+ 0 0 179 -4,-1.3 4,-0.3 2,-0.2 -1,-0.2 0.797 108.2 53.8 -76.2 -33.6 -3.3 1.1 0.7 9 9 A L H < S+ 0 0 151 -4,-1.5 4,-0.2 -3,-0.2 -2,-0.2 0.794 116.0 41.5 -70.1 -33.8 -4.3 -2.6 0.2 10 10 A L H >< S+ 0 0 122 -4,-1.5 3,-2.0 2,-0.1 -2,-0.2 0.985 113.2 43.6 -76.5 -74.2 -3.7 -3.2 4.0 11 11 A X T 3< S+ 0 0 144 -4,-1.5 -1,-0.1 1,-0.3 -2,-0.1 0.430 95.2 87.6 -57.4 0.6 -5.1 -0.1 6.1 12 12 A D T 3 0 0 138 -4,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.832 360.0 360.0 -67.2 -36.1 -8.2 -0.4 3.6 13 13 A S < 0 0 145 -3,-2.0 -2,-0.2 -4,-0.2 -1,-0.2 0.890 360.0 360.0 -73.2 360.0 -9.8 -3.0 6.1