==== 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 20-MAY-11 2LDA . COMPND 2 MOLECULE: ESTROGEN RECEPTOR-BINDING STAPLED PEPTIDE SP2; . SOURCE 2 SYNTHETIC: YES . AUTHOR C.PHILLIPS,R.BAZIN,A.BENT,N.DAVIES,R.MOORE,A.PANNIFER,A.PICK . 11 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 1517.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 8 72.7 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 . 2 18.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 6 54.5 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 H > 0 0 202 0, 0.0 4,-0.7 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 -30.0 4.3 6.4 1.5 2 2 A K H >> + 0 0 173 2,-0.2 4,-1.3 1,-0.2 3,-0.7 0.901 360.0 66.8 -70.7 -50.7 4.7 3.1 -0.4 3 3 A X H 3> S+ 0 0 140 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.776 101.4 55.6 -42.7 -33.0 3.6 0.5 2.4 4 4 A L H 3> S+ 0 0 116 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.939 101.0 53.4 -66.0 -52.4 0.1 2.3 2.0 5 5 A H H << S+ 0 0 125 -4,-0.7 4,-0.4 -3,-0.7 -1,-0.2 0.749 110.4 53.9 -52.1 -31.1 -0.2 1.6 -1.8 6 6 A Q H >X S+ 0 0 116 -4,-1.3 3,-1.9 2,-0.2 4,-1.3 0.955 97.4 54.9 -70.1 -62.0 0.5 -2.1 -0.9 7 7 A X H 3X S+ 0 0 91 -4,-1.7 4,-2.0 1,-0.3 -1,-0.2 0.705 102.4 67.3 -47.2 -25.1 -2.3 -3.0 1.8 8 8 A L H 3< S+ 0 0 127 -4,-0.9 -1,-0.3 2,-0.2 -2,-0.2 0.836 104.1 38.0 -64.1 -41.7 -4.7 -1.7 -0.9 9 9 A Q H <4 S+ 0 0 166 -3,-1.9 -2,-0.2 -4,-0.4 -1,-0.2 0.829 118.1 47.6 -81.0 -39.2 -4.0 -4.7 -3.4 10 10 A D H < 0 0 139 -4,-1.3 -2,-0.2 1,-0.2 -3,-0.1 0.867 360.0 360.0 -68.4 -42.6 -3.7 -7.5 -0.7 11 11 A S < 0 0 122 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.285 360.0 360.0 -82.9 360.0 -7.0 -6.3 1.1