==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-MAY-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DE NOVO PROTEIN 10-MAY-09 3HEV . COMPND 2 MOLECULE: ALPHA/BETA-PEPTIDE BASED ON THE GCN4-PLI SIDE CHA . SOURCE 2 SYNTHETIC: YES; . AUTHOR W.S.HORNE,J.L.PRICE,S.H.GELLMAN . 31 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 3301.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 27 87.1 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 3.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 26 83.9 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 1 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 X > 0 0 116 0, 0.0 4,-2.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -74.0 11.8 2.4 21.3 2 2 A M H > + 0 0 152 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.841 360.0 35.5 -69.6 -39.3 14.3 -1.9 21.1 3 3 A K H > S+ 0 0 77 2,-0.2 4,-1.6 3,-0.2 -1,-0.2 0.792 117.2 58.8 -83.9 -30.1 11.6 -4.3 19.7 4 4 A X H > S+ 0 0 106 2,-0.2 4,-2.5 3,-0.1 -2,-0.2 0.948 115.0 45.6 -25.5 -67.9 10.3 -0.4 17.3 5 5 A I H X S+ 0 0 90 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.887 107.8 41.8 -60.5 -54.2 14.0 -1.0 16.2 6 6 A E H X S+ 0 0 95 -4,-2.3 4,-1.6 2,-0.2 -1,-0.2 0.903 115.8 60.5 -68.6 -38.1 14.2 -4.7 15.5 7 7 A X H X S+ 0 0 95 -4,-1.6 4,-2.0 2,-0.2 -2,-0.2 0.869 113.8 42.7 -20.1 -58.5 10.0 -3.7 13.5 8 8 A K H X S+ 0 0 118 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.925 103.6 51.1 -74.0 -43.1 12.2 -1.4 11.4 9 9 A L H X S+ 0 0 73 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.849 110.9 58.3 -71.3 -35.6 15.2 -3.6 10.7 10 10 A X H X S+ 0 0 125 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.929 111.6 47.9 -19.7 -69.3 11.6 -6.4 9.4 11 11 A E H X S+ 0 0 96 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.830 103.4 48.2 -60.2 -42.1 11.0 -3.4 7.1 12 12 A I H X S+ 0 0 64 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.909 109.0 60.2 -76.7 -44.9 14.5 -2.9 5.8 13 13 A X H X S+ 0 0 138 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.955 112.8 45.5 -15.5 -67.8 14.2 -7.4 5.1 14 14 A S H X S+ 0 0 54 -4,-2.1 4,-3.1 2,-0.2 5,-0.2 0.916 107.7 45.1 -60.3 -51.2 11.3 -6.2 2.9 15 15 A K H X S+ 0 0 132 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.843 112.7 58.8 -72.2 -36.6 13.0 -3.3 1.1 16 16 A X H X S+ 0 0 118 -4,-2.7 4,-2.8 3,-0.2 5,-0.3 0.986 116.0 41.4 -20.8 -78.6 16.3 -6.4 0.6 17 17 A Y H X S+ 0 0 129 -4,-2.6 4,-2.4 2,-0.2 5,-0.3 0.933 117.6 36.4 -51.9 -60.2 13.5 -8.2 -1.1 18 18 A H H X S+ 0 0 103 -4,-3.1 4,-2.7 2,-0.2 -3,-0.2 0.948 121.0 53.6 -75.0 -48.2 11.7 -5.5 -3.2 19 19 A X H X S+ 0 0 71 -4,-2.4 4,-2.7 -5,-0.2 5,-0.2 0.969 118.6 40.9 -12.6 -77.2 16.0 -3.7 -3.9 20 20 A E H X S+ 0 0 126 -4,-2.8 4,-1.8 2,-0.2 -2,-0.2 0.848 115.4 40.5 -60.4 -44.6 16.9 -7.1 -5.1 21 21 A N H X S+ 0 0 50 -4,-2.4 4,-2.4 -5,-0.3 -2,-0.2 0.900 115.1 58.7 -86.9 -41.0 13.9 -8.3 -7.1 22 22 A X H X S+ 0 0 129 -4,-2.7 4,-2.2 -5,-0.3 -2,-0.2 0.959 116.4 40.8 -10.8 -76.1 13.8 -3.9 -8.7 23 23 A L H X S+ 0 0 115 -4,-2.7 4,-2.8 2,-0.2 -2,-0.2 0.897 117.7 43.3 -60.0 -45.3 17.4 -4.9 -9.8 24 24 A A H X S+ 0 0 40 -4,-1.8 4,-2.9 2,-0.2 -2,-0.2 0.874 112.3 48.1 -77.6 -38.2 16.8 -8.4 -11.1 25 25 A X H X S+ 0 0 173 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.915 116.3 50.1 -87.0 -8.9 13.6 -7.9 -13.0 26 26 A I H X S+ 0 0 88 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.935 106.5 52.0 -68.1 -50.1 15.9 -4.3 -14.7 27 27 A K H < S+ 0 0 147 -4,-2.8 4,-0.4 2,-0.2 -2,-0.2 0.928 104.9 57.7 -64.8 -46.4 18.5 -7.0 -15.3 28 28 A X H >< S+ 0 0 84 -4,-2.9 3,-1.4 2,-0.2 -2,-0.2 0.967 112.2 45.6 -11.8 -82.7 14.8 -9.0 -17.3 29 29 A L H 3< S+ 0 0 156 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.738 124.4 28.4 -49.8 -35.9 14.8 -5.8 -19.4 30 30 A L T 3< 0 0 142 -4,-1.7 -1,-0.2 -3,-0.2 -2,-0.2 0.470 360.0 360.0 -96.0 -2.8 18.5 -5.7 -20.2 31 31 A X < 0 0 99 -3,-1.4 -3,-0.2 -4,-0.4 -2,-0.1 0.196 360.0 360.0 115.5 360.0 20.2 -9.8 -20.2