==== 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 3HEY . 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) . 3345.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 27 87.1 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 1 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 0 151 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -99.3 -12.1 -3.3 44.3 2 2 A M H > + 0 0 153 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.883 360.0 47.0 -57.4 -47.4 -13.5 0.2 43.7 3 3 A K H > S+ 0 0 63 2,-0.2 4,-2.4 3,-0.2 -1,-0.2 0.894 114.2 54.5 -71.9 -45.2 -10.3 1.8 42.4 4 4 A X H > S+ 0 0 77 2,-0.2 4,-3.0 3,-0.1 -2,-0.2 0.908 114.8 46.6 -19.0 -68.1 -10.3 -2.2 39.8 5 5 A I H X S+ 0 0 94 -4,-3.0 4,-2.3 2,-0.2 -2,-0.2 0.953 110.4 40.5 -57.4 -54.2 -13.8 -1.0 38.8 6 6 A E H X S+ 0 0 118 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.912 115.2 59.5 -74.2 -43.4 -13.0 2.7 38.1 7 7 A X H X S+ 0 0 101 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.921 113.4 44.2 -12.0 -69.6 -9.2 0.9 36.1 8 8 A K H X S+ 0 0 118 -4,-3.0 4,-1.8 2,-0.2 -2,-0.2 0.881 102.2 51.6 -65.4 -42.3 -11.9 -0.8 34.1 9 9 A L H X S+ 0 0 81 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.883 111.0 58.7 -71.2 -35.9 -14.2 2.1 33.4 10 10 A X H X S+ 0 0 82 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.905 110.6 47.3 -22.8 -61.6 -10.0 3.8 32.0 11 11 A E H X S+ 0 0 112 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.861 103.8 48.6 -65.2 -41.6 -10.1 0.9 29.7 12 12 A I H X S+ 0 0 69 -4,-1.8 4,-3.2 2,-0.2 -2,-0.2 0.957 108.7 60.7 -74.0 -51.9 -13.7 1.4 28.5 13 13 A X H X S+ 0 0 161 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.954 115.3 40.6 -5.9 -76.0 -12.1 5.7 28.0 14 14 A S H X S+ 0 0 54 -4,-2.3 4,-3.0 2,-0.2 -2,-0.2 0.897 109.7 45.8 -57.5 -54.3 -9.7 3.8 25.6 15 15 A K H X S+ 0 0 134 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.830 113.8 59.9 -71.5 -34.0 -12.0 1.2 23.8 16 16 A X H X S+ 0 0 139 -4,-3.2 4,-2.9 -5,-0.2 5,-0.3 0.954 115.3 41.0 -24.1 -70.7 -14.6 5.1 23.5 17 17 A Y H X S+ 0 0 136 -4,-2.3 4,-2.8 2,-0.2 5,-0.3 0.955 115.1 38.9 -57.4 -62.1 -11.6 6.3 21.7 18 18 A H H X S+ 0 0 101 -4,-3.0 4,-3.0 2,-0.2 -2,-0.2 0.929 119.9 55.7 -69.6 -47.7 -10.5 3.3 19.5 19 19 A X H X S+ 0 0 72 -4,-2.6 4,-2.4 -5,-0.2 5,-0.2 0.961 117.9 37.5 -10.2 -83.8 -15.1 2.8 19.0 20 20 A E H X S+ 0 0 52 -4,-2.9 4,-2.1 2,-0.2 -2,-0.2 0.893 117.8 42.3 -52.9 -51.1 -15.1 6.4 17.7 21 21 A N H X S+ 0 0 56 -4,-2.8 4,-2.7 -5,-0.3 -2,-0.2 0.911 114.1 56.6 -83.8 -42.7 -11.9 6.6 15.8 22 22 A X H X S+ 0 0 136 -4,-3.0 4,-2.3 -5,-0.3 5,-0.2 0.941 116.8 42.5 -11.9 -73.8 -12.9 2.4 14.1 23 23 A L H X S+ 0 0 112 -4,-2.4 4,-2.9 2,-0.2 -2,-0.2 0.877 117.4 42.1 -59.4 -46.0 -16.1 4.2 13.0 24 24 A A H X S+ 0 0 44 -4,-2.1 4,-2.7 -5,-0.2 -2,-0.2 0.919 112.3 48.9 -74.4 -44.0 -14.6 7.5 11.7 25 25 A X H X S+ 0 0 170 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.951 117.7 47.8 -77.1 -16.7 -11.6 6.1 9.9 26 26 A I H X S+ 0 0 95 -4,-2.3 4,-1.9 2,-0.2 5,-0.2 0.936 107.4 52.3 -61.5 -54.0 -14.8 3.3 8.1 27 27 A K H X S+ 0 0 142 -4,-2.9 4,-1.5 2,-0.2 -2,-0.2 0.919 105.4 59.0 -64.8 -42.7 -16.9 6.4 7.5 28 28 A X H < S+ 0 0 108 -4,-2.7 -2,-0.2 2,-0.2 -1,-0.2 0.940 110.5 45.1 -13.3 -73.2 -12.8 7.5 5.5 29 29 A L H < S+ 0 0 154 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.832 130.2 20.3 -60.1 -36.8 -13.4 4.5 3.3 30 30 A L H < 0 0 150 -4,-1.9 -2,-0.2 1,-0.0 -1,-0.2 0.726 360.0 360.0 -92.4 -22.5 -17.0 5.2 2.5 31 31 A X < 0 0 110 -4,-1.5 -3,-0.1 -5,-0.2 -2,-0.1 0.457 360.0 360.0 -73.0 360.0 -17.5 9.8 3.4