==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DE NOVO PROTEIN 28-JAN-08 3C3H . 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 . 33 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 3287.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 28 84.8 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 81.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 3.0 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 0 150 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0-116.3 10.8 3.8 21.9 2 2 A M H > + 0 0 164 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.903 360.0 44.0 -57.3 -49.9 11.9 0.2 21.6 3 3 A K H > S+ 0 0 74 2,-0.2 4,-1.7 3,-0.2 -1,-0.2 0.763 113.2 59.5 -82.2 -29.4 8.7 -1.2 20.1 4 4 A X H > S+ 0 0 81 2,-0.2 4,-2.5 3,-0.1 -2,-0.2 0.874 113.6 42.9 -27.6 -62.5 9.0 2.8 17.5 5 5 A I H X S+ 0 0 96 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.952 108.8 45.4 -65.6 -55.5 12.3 1.3 16.4 6 6 A E H X S+ 0 0 52 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.907 115.6 56.9 -64.5 -46.4 11.3 -2.4 15.9 7 7 A X H X S+ 0 0 122 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.940 114.1 42.3 -14.1 -72.7 7.8 -0.2 13.7 8 8 A K H X S+ 0 0 106 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.867 104.3 52.4 -61.8 -42.0 10.5 1.4 11.6 9 9 A L H X S+ 0 0 83 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.913 112.0 55.4 -67.9 -42.4 12.6 -1.8 11.1 10 10 A X H X S+ 0 0 81 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.903 113.2 46.4 -17.1 -67.1 8.3 -3.2 9.7 11 11 A E H X S+ 0 0 114 -4,-2.5 4,-2.0 2,-0.2 5,-0.2 0.950 103.9 49.6 -59.4 -53.0 8.6 -0.3 7.4 12 12 A I H X S+ 0 0 67 -4,-2.3 4,-2.9 2,-0.2 3,-0.3 0.966 108.1 60.4 -66.4 -54.8 12.1 -0.9 6.1 13 13 A X H X S+ 0 0 167 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.948 111.2 46.4 -7.8 -70.8 10.4 -5.0 5.5 14 14 A S H X S+ 0 0 62 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.879 105.9 46.8 -61.0 -38.4 8.1 -2.9 3.2 15 15 A K H X S+ 0 0 103 -4,-2.0 4,-2.0 -3,-0.3 -2,-0.2 0.854 107.9 64.3 -81.5 -32.8 10.8 -0.9 1.5 16 16 A X H X S+ 0 0 135 -4,-2.9 4,-2.1 2,-0.2 -2,-0.2 0.941 112.9 40.7 -16.9 -73.2 12.6 -5.0 1.1 17 17 A Y H X S+ 0 0 153 -4,-2.0 4,-2.7 2,-0.2 5,-0.3 0.963 104.4 51.0 -58.5 -60.4 9.5 -5.4 -1.0 18 18 A H H X S+ 0 0 112 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.874 113.7 55.6 -52.9 -39.4 9.4 -2.1 -2.9 19 19 A X H X S+ 0 0 69 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.894 112.4 48.6 -25.8 -61.3 14.0 -3.7 -3.6 20 20 A E H X S+ 0 0 124 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.905 105.9 43.9 -60.3 -50.6 12.0 -6.8 -5.0 21 21 A N H X S+ 0 0 61 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.883 110.2 62.7 -75.7 -42.4 9.7 -4.8 -7.2 22 22 A X H X S+ 0 0 71 -4,-2.2 4,-2.7 -5,-0.3 -2,-0.2 0.981 116.0 38.9 -12.9 -77.7 13.5 -2.5 -8.3 23 23 A L H X S+ 0 0 76 -4,-2.2 4,-3.7 2,-0.2 -2,-0.2 0.827 116.0 46.7 -56.0 -46.9 14.4 -6.0 -9.6 24 24 A A H X S+ 0 0 45 -4,-2.0 4,-1.4 2,-0.2 -1,-0.2 0.918 115.8 42.9 -68.7 -45.8 11.1 -7.2 -11.0 25 25 A X H X S+ 0 0 79 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.913 118.8 51.0 -83.0 -13.5 10.4 -4.0 -13.0 26 26 A I H X S+ 0 0 77 -4,-2.7 4,-2.8 2,-0.2 -2,-0.2 0.916 106.1 53.4 -64.2 -49.2 15.0 -4.3 -14.1 27 27 A K H X>S+ 0 0 63 -4,-3.7 4,-1.6 2,-0.2 5,-1.2 0.848 102.3 59.0 -66.3 -35.7 14.0 -7.9 -15.0 28 28 A X H <5S+ 0 0 112 -4,-1.4 -2,-0.2 3,-0.2 -1,-0.2 0.913 114.5 41.3 -19.7 -66.8 10.9 -5.5 -17.5 29 29 A L H <5S+ 0 0 149 -4,-1.9 -2,-0.2 1,-0.2 -3,-0.2 0.878 125.2 29.6 -69.9 -41.6 14.1 -4.0 -19.0 30 30 A L H <5S- 0 0 95 -4,-2.8 -2,-0.2 2,-0.1 -1,-0.2 0.872 94.5-138.2 -72.6 -34.2 16.1 -7.2 -19.3 31 31 A X T <5 + 0 0 90 -4,-1.6 2,-0.3 -5,-0.2 -3,-0.2 0.970 60.0 148.8 34.7 81.4 12.4 -10.2 -19.9 32 32 A E < 0 0 121 -5,-1.2 -1,-0.2 -8,-0.1 -2,-0.1 -0.947 360.0 360.0-133.4 148.9 14.5 -12.3 -17.5 33 33 A R 0 0 133 -2,-0.3 -1,-0.1 0, 0.0 -6,-0.1 0.781 360.0 360.0 -75.9 360.0 13.6 -14.9 -14.8