==== 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 2LDC . COMPND 2 MOLECULE: ESTROGEN RECEPTOR-BINDING STAPLED PEPTIDE SP1; . 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) . 1298.0 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 1 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 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 0 157 0, 0.0 4,-0.9 0, 0.0 3,-0.9 0.000 360.0 360.0 360.0 -31.2 -3.1 -0.7 6.2 2 2 A X H 3> + 0 0 130 1,-0.2 4,-2.7 2,-0.2 3,-0.3 0.783 360.0 57.0 -46.5 -36.4 0.7 -0.5 5.2 3 3 A I H 3> S+ 0 0 111 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.898 98.3 58.9 -63.8 -43.7 -0.1 -3.2 2.5 4 4 A L H <> S+ 0 0 82 -3,-0.9 4,-0.7 1,-0.2 -1,-0.2 0.777 112.9 41.0 -54.0 -34.1 -2.7 -0.9 0.9 5 5 A H H >X S+ 0 0 83 -4,-0.9 4,-2.8 -3,-0.3 3,-0.8 0.912 107.2 56.6 -81.0 -52.1 0.1 1.7 0.5 6 6 A X H 3< S+ 0 0 105 -4,-2.7 4,-0.4 1,-0.3 -2,-0.2 0.608 111.4 52.1 -54.9 -14.5 3.0 -0.7 -0.7 7 7 A L H 3X S+ 0 0 125 -4,-0.9 4,-1.4 -5,-0.2 -1,-0.3 0.811 112.2 40.1 -89.2 -40.7 0.3 -1.5 -3.4 8 8 A L H << S+ 0 0 102 -3,-0.8 -2,-0.2 -4,-0.7 -3,-0.1 0.803 118.1 47.4 -77.6 -36.9 -0.4 2.2 -4.5 9 9 A Q T < S+ 0 0 140 -4,-2.8 -3,-0.2 2,-0.2 -1,-0.1 0.773 112.4 50.2 -74.4 -33.1 3.3 3.2 -4.3 10 10 A D T 4 0 0 136 -4,-0.4 -2,-0.2 -5,-0.4 -1,-0.2 0.900 360.0 360.0 -70.2 -47.6 4.4 0.1 -6.3 11 11 A S < 0 0 127 -4,-1.4 -2,-0.2 -5,-0.0 -3,-0.1 0.958 360.0 360.0 -57.8 360.0 1.8 0.7 -9.1