==== 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 UNKNOWN FUNCTION 20-FEB-07 2OXJ . COMPND 2 MOLECULE: HYBRID ALPHA/BETA PEPTIDE BASED ON THE GCN4-P1 SE . SOURCE 2 SYNTHETIC: YES; . AUTHOR W.S.HORNE,J.L.PRICE,J.L.KECK,S.H.GELLMAN . 95 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6214.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 82 86.3 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 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 81 85.3 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 3 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 R > 0 0 174 0, 0.0 4,-1.3 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 -22.1 -0.9 -0.6 -8.4 2 2 A M H > + 0 0 56 2,-0.2 4,-2.3 3,-0.1 5,-0.1 0.901 360.0 51.4 -77.7 -50.5 -4.3 -1.8 -7.3 3 3 A X H > S+ 0 0 106 2,-0.2 4,-2.3 3,-0.2 5,-0.3 0.963 110.0 52.8 -14.3 -81.2 -2.0 -5.4 -6.0 4 4 A Q H > S+ 0 0 91 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.845 114.5 38.7 -42.0 -43.9 0.2 -2.8 -4.2 5 5 A L H X S+ 0 0 0 -4,-1.3 4,-2.1 2,-0.2 -2,-0.2 0.944 111.9 49.1 -77.2 -51.3 -2.9 -1.2 -2.5 6 6 A E H X S+ 0 0 28 -4,-2.3 4,-1.5 2,-0.2 -2,-0.2 0.867 115.8 54.5 -54.1 -43.9 -5.0 -4.3 -1.7 7 7 A X H X S+ 0 0 103 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.812 111.4 49.5 -19.1 -60.9 -0.6 -5.3 -0.1 8 8 A K H X S+ 0 0 24 -4,-2.1 4,-1.7 -5,-0.3 -2,-0.2 0.854 102.0 47.4 -68.9 -38.5 -1.1 -2.0 1.8 9 9 A V H X S+ 0 0 0 -4,-2.1 4,-2.9 2,-0.2 5,-0.2 0.918 113.1 59.0 -76.8 -43.8 -4.6 -2.9 3.3 10 10 A X H X S+ 0 0 93 -4,-1.5 4,-1.7 2,-0.2 -2,-0.2 0.945 111.6 43.8 -11.2 -80.7 -2.1 -6.7 4.2 11 11 A E H X S+ 0 0 54 -4,-2.6 4,-3.2 1,-0.2 -2,-0.2 0.829 116.3 44.7 -49.8 -46.2 0.1 -4.3 6.1 12 12 A L H X S+ 0 0 0 -4,-1.7 4,-2.7 2,-0.2 5,-0.2 0.953 112.3 44.9 -73.5 -54.7 -2.7 -2.3 7.8 13 13 A L H X S+ 0 0 23 -4,-2.9 4,-1.9 2,-0.2 -1,-0.2 0.840 116.4 56.9 -63.0 -34.2 -5.1 -5.0 9.0 14 14 A X H X S+ 0 0 99 -4,-1.7 4,-2.8 -5,-0.2 -2,-0.2 0.962 113.6 43.7 -26.1 -75.3 -0.8 -6.6 10.2 15 15 A K H X S+ 0 0 96 -4,-3.2 4,-2.3 2,-0.2 -2,-0.2 0.865 108.7 46.7 -55.1 -44.9 -0.6 -3.3 12.1 16 16 A N H X S+ 0 0 0 -4,-2.7 4,-2.9 2,-0.2 -2,-0.2 0.892 112.0 58.1 -74.8 -42.9 -4.2 -3.3 13.6 17 17 A X H X S+ 0 0 139 -4,-1.9 4,-1.9 -5,-0.2 -2,-0.2 0.918 115.4 42.4 -15.7 -67.8 -3.0 -7.7 14.7 18 18 A H H X S+ 0 0 93 -4,-2.8 4,-2.3 2,-0.2 -2,-0.2 0.921 114.9 44.0 -67.1 -49.0 -0.3 -5.9 16.5 19 19 A L H X S+ 0 0 1 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.938 112.3 48.7 -67.2 -49.3 -2.1 -3.0 18.1 20 20 A E H X S+ 0 0 21 -4,-2.9 4,-2.8 2,-0.2 -1,-0.2 0.913 109.8 61.5 -61.2 -39.8 -5.0 -5.0 19.2 21 21 A X H X S+ 0 0 87 -4,-1.9 4,-2.9 2,-0.2 -2,-0.2 0.927 113.4 40.9 -13.2 -73.3 -1.4 -7.5 20.7 22 22 A E H X S+ 0 0 48 -4,-2.3 4,-2.8 2,-0.2 5,-0.2 0.911 110.0 47.4 -60.8 -50.4 -0.6 -4.4 22.7 23 23 A V H X S+ 0 0 0 -4,-2.6 4,-2.8 2,-0.2 5,-0.2 0.988 115.9 51.6 -66.1 -60.5 -4.0 -3.4 23.9 24 24 A X H X S+ 0 0 16 -4,-2.8 4,-3.1 2,-0.2 -2,-0.2 0.941 113.7 50.5 -7.1 -76.2 -4.3 -7.8 25.0 25 25 A R H X S+ 0 0 116 -4,-2.9 4,-2.9 1,-0.2 -2,-0.2 0.862 114.0 37.8 -52.2 -47.9 -1.0 -7.0 26.7 26 26 A L H X S+ 0 0 2 -4,-2.8 4,-1.9 -3,-0.2 5,-0.3 0.892 114.2 48.9 -75.7 -42.3 -2.1 -3.9 28.7 27 27 A K H X S+ 0 0 38 -4,-2.8 4,-2.8 -5,-0.2 5,-0.2 0.904 115.1 54.3 -67.0 -42.9 -5.6 -5.1 29.6 28 28 A X H < S+ 0 0 196 -4,-3.1 -2,-0.2 -5,-0.2 -3,-0.2 0.954 115.6 43.6 -20.7 -75.4 -2.9 -8.8 30.8 29 29 A L H < S+ 0 0 116 -4,-2.9 -2,-0.2 1,-0.2 -3,-0.2 0.794 130.1 18.9 -53.9 -44.5 -0.9 -6.3 32.9 30 30 A V H < S+ 0 0 58 -4,-1.9 -2,-0.2 -5,-0.2 -3,-0.2 0.884 104.3 33.0 -92.9 -45.1 -3.7 -4.3 34.5 31 31 A X S < S+ 0 0 34 -4,-2.8 -3,-0.1 -5,-0.3 -4,-0.1 0.906 81.7 26.3-107.8 -68.2 -7.8 -5.9 34.7 32 32 A E 0 0 185 -5,-0.2 -1,-0.1 1,-0.1 -4,-0.1 0.695 360.0 360.0 -82.1 -27.6 -10.6 -8.6 35.0 33 33 A R 0 0 286 -5,-0.1 -2,-0.1 0, 0.0 -5,-0.1 0.166 360.0 360.0-158.0 360.0 -8.3 -11.0 37.0 34 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 35 1 B R > 0 0 103 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -37.7 -11.3 6.2 -7.6 36 2 B M H > + 0 0 42 2,-0.2 4,-3.4 3,-0.2 5,-0.2 0.873 360.0 60.5 -70.6 -44.8 -8.3 3.9 -6.6 37 3 B X H > S+ 0 0 130 2,-0.2 4,-2.6 1,-0.2 5,-0.1 0.978 112.5 42.6 -16.2 -75.5 -6.6 8.2 -5.9 38 4 B Q H > S+ 0 0 120 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.857 115.8 43.3 -57.6 -46.1 -9.5 8.3 -3.5 39 5 B L H X S+ 0 0 0 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.928 111.3 49.6 -72.4 -45.5 -9.1 4.8 -1.9 40 6 B E H X S+ 0 0 30 -4,-3.4 4,-3.5 2,-0.2 -2,-0.2 0.954 111.1 59.1 -61.6 -49.5 -5.3 4.9 -1.6 41 7 B X H X S+ 0 0 81 -4,-2.6 4,-2.5 -5,-0.2 -2,-0.2 0.911 113.0 43.0 -9.6 -71.4 -6.6 8.9 0.3 42 8 B K H X S+ 0 0 62 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.893 109.4 46.1 -64.4 -43.2 -8.5 6.7 2.6 43 9 B V H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.959 112.7 57.1 -74.3 -53.5 -5.9 4.0 3.3 44 10 B X H X S+ 0 0 99 -4,-3.5 4,-2.5 -5,-0.2 -2,-0.2 0.953 115.5 44.2 -7.8 -73.4 -3.2 7.6 3.9 45 11 B E H X S+ 0 0 142 -4,-2.5 4,-3.0 1,-0.2 -2,-0.2 0.841 109.8 48.9 -62.6 -40.8 -5.9 8.4 6.5 46 12 B L H X S+ 0 0 8 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.888 109.0 50.0 -70.9 -41.2 -6.3 4.9 8.0 47 13 B L H X S+ 0 0 35 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.925 111.2 55.4 -60.6 -48.3 -2.5 4.6 8.5 48 14 B X H X S+ 0 0 107 -4,-2.5 4,-2.4 -5,-0.2 -2,-0.2 0.939 114.7 45.5 -20.5 -67.9 -3.3 8.8 10.3 49 15 B K H X S+ 0 0 45 -4,-3.0 4,-2.3 2,-0.2 -2,-0.2 0.913 106.6 46.2 -63.6 -43.9 -5.8 6.8 12.5 50 16 B N H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.900 114.1 56.3 -69.0 -43.9 -3.6 3.8 13.4 51 17 B X H X S+ 0 0 143 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.975 116.7 43.2 -18.2 -75.4 -0.5 7.3 14.3 52 18 B H H X S+ 0 0 82 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.872 114.6 43.5 -50.3 -51.8 -3.3 8.4 16.5 53 19 B L H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.904 111.9 48.9 -76.4 -41.6 -4.4 5.2 18.1 54 20 B E H X S+ 0 0 51 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.864 111.2 58.9 -69.8 -37.1 -0.9 3.8 18.8 55 21 B X H X S+ 0 0 80 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.945 114.6 43.0 -23.6 -67.0 -0.5 8.2 20.5 56 22 B E H X S+ 0 0 53 -4,-2.7 4,-1.8 2,-0.2 -2,-0.2 0.912 108.8 45.4 -63.1 -49.5 -3.4 7.0 22.7 57 23 B V H X S+ 0 0 4 -4,-2.6 4,-3.0 2,-0.2 5,-0.2 0.956 114.4 57.7 -66.7 -51.9 -2.2 3.5 23.6 58 24 B X H X S+ 0 0 22 -4,-2.6 4,-2.9 2,-0.2 -2,-0.2 0.929 111.6 46.5 -7.7 -73.0 1.7 5.8 24.4 59 25 B R H X S+ 0 0 105 -4,-2.5 4,-3.3 2,-0.2 -2,-0.2 0.809 114.5 41.3 -61.8 -40.0 -0.5 7.8 26.8 60 26 B L H X S+ 0 0 1 -4,-1.8 4,-2.6 2,-0.2 5,-0.2 0.923 113.2 47.8 -76.4 -48.7 -2.2 4.9 28.5 61 27 B K H X S+ 0 0 72 -4,-3.0 4,-1.8 2,-0.2 -2,-0.2 0.904 115.2 55.5 -59.0 -42.6 0.9 2.7 28.8 62 28 B X H < S+ 0 0 173 -4,-2.9 -2,-0.2 -5,-0.2 -3,-0.2 0.964 112.3 46.8 -19.8 -76.9 2.3 6.9 30.3 63 29 B L H < S+ 0 0 75 -4,-3.3 -2,-0.2 1,-0.2 -3,-0.2 0.944 112.1 38.2 -47.1 -67.2 -0.6 6.6 32.8 64 30 B V H < 0 0 61 -4,-2.6 -1,-0.2 1,-0.1 -2,-0.2 0.866 360.0 360.0 -52.4 -47.4 0.1 3.0 33.9 65 31 B X < 0 0 118 -4,-1.8 -1,-0.1 -5,-0.2 -2,-0.1 -0.498 360.0 360.0 70.4 360.0 4.7 4.6 33.6 66 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 67 1 C R > 0 0 120 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -38.1 -12.5 -5.5 -8.1 68 2 C M H > + 0 0 66 2,-0.2 4,-2.9 3,-0.2 5,-0.1 0.931 360.0 57.2 -75.2 -46.2 -12.7 -1.8 -7.2 69 3 C X H > S+ 0 0 93 2,-0.2 4,-2.6 1,-0.2 -1,-0.1 0.953 112.5 43.6 -8.4 -79.8 -16.4 -3.3 -5.2 70 4 C Q H > S+ 0 0 135 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.849 113.8 47.4 -58.4 -39.2 -14.1 -5.6 -3.4 71 5 C L H X S+ 0 0 7 -4,-2.0 4,-1.7 2,-0.2 5,-0.2 0.972 110.0 47.9 -69.5 -50.8 -11.5 -3.0 -2.6 72 6 C E H X S+ 0 0 33 -4,-2.9 4,-2.3 2,-0.2 3,-0.3 0.955 111.5 60.9 -58.5 -53.6 -13.9 -0.4 -1.4 73 7 C X H X S+ 0 0 96 -4,-2.6 4,-2.8 2,-0.2 -2,-0.2 0.885 109.3 43.9 -3.2 -75.8 -15.2 -4.1 0.9 74 8 C K H X S+ 0 0 27 -4,-2.2 4,-0.6 2,-0.2 -2,-0.2 0.799 107.2 49.7 -62.2 -37.2 -11.7 -4.2 2.4 75 9 C V H X S+ 0 0 1 -4,-1.7 4,-2.4 -3,-0.3 -2,-0.2 0.836 113.4 53.5 -82.2 -35.4 -11.4 -0.4 3.2 76 10 C X H X S+ 0 0 73 -4,-2.3 4,-1.9 -5,-0.2 -2,-0.2 0.984 112.9 47.4 -28.9 -78.0 -15.6 -1.2 5.1 77 11 C E H X S+ 0 0 106 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.782 117.6 40.7 -48.7 -29.4 -13.7 -4.0 6.9 78 12 C L H X S+ 0 0 1 -4,-0.6 4,-2.4 2,-0.2 -2,-0.2 0.903 114.4 43.6 -93.7 -44.2 -10.8 -1.5 7.8 79 13 C L H X S+ 0 0 50 -4,-2.4 4,-2.8 2,-0.2 -3,-0.2 0.956 117.9 57.6 -64.9 -54.6 -12.6 1.7 8.8 80 14 C X H X S+ 0 0 94 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.908 112.4 42.8 -3.2 -78.2 -15.0 -1.6 10.8 81 15 C K H X S+ 0 0 43 -4,-2.3 4,-2.7 2,-0.2 5,-0.2 0.900 105.2 53.1 -58.3 -44.6 -11.7 -2.6 12.5 82 16 C N H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.975 110.5 54.4 -69.0 -55.7 -10.5 0.9 13.3 83 17 C X H X S+ 0 0 111 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.926 113.9 46.1 -7.2 -77.2 -14.7 1.1 15.2 84 18 C H H X S+ 0 0 68 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.888 113.4 44.3 -54.7 -47.8 -13.5 -2.1 17.1 85 19 C L H X S+ 0 0 0 -4,-2.7 4,-2.1 2,-0.2 5,-0.2 0.908 108.1 51.8 -70.1 -44.5 -10.0 -0.8 18.2 86 20 C E H X S+ 0 0 32 -4,-2.3 4,-2.5 -5,-0.2 -1,-0.2 0.876 111.2 57.4 -62.6 -39.1 -11.2 2.5 19.3 87 21 C X H X S+ 0 0 95 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.936 114.4 43.0 -26.1 -67.1 -14.1 -0.5 21.6 88 22 C E H X S+ 0 0 14 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.852 110.4 44.6 -61.9 -39.4 -10.8 -1.9 22.9 89 23 C V H X S+ 0 0 4 -4,-2.1 4,-3.1 2,-0.2 5,-0.2 0.917 114.0 56.5 -85.5 -47.3 -9.0 1.4 23.7 90 24 C X H X S+ 0 0 44 -4,-2.5 4,-3.0 2,-0.2 3,-0.3 0.968 114.1 44.5 -12.1 -94.4 -13.0 2.5 25.4 91 25 C R H X S+ 0 0 128 -4,-2.5 4,-0.9 1,-0.2 -2,-0.2 0.731 114.5 44.6 -40.0 -42.3 -12.4 -0.7 27.5 92 26 C L H >X S+ 0 0 1 -4,-1.8 4,-3.1 2,-0.2 3,-1.0 0.958 111.5 47.5 -71.4 -49.7 -8.7 0.1 28.3 93 27 C K H 3X S+ 0 0 57 -4,-3.1 4,-2.3 -3,-0.3 -2,-0.2 0.867 107.1 67.8 -60.7 -41.1 -9.3 3.8 29.2 94 28 C X H 3< S+ 0 0 108 -4,-3.0 -2,-0.2 -5,-0.2 -1,-0.2 0.798 117.2 28.8 -13.0 -52.2 -12.6 1.4 31.5 95 29 C L H << S+ 0 0 65 -3,-1.0 -2,-0.2 -4,-0.9 -3,-0.1 0.916 132.3 25.3 -93.7 -55.0 -9.5 0.2 33.4 96 30 C V H < 0 0 35 -4,-3.1 -3,-0.2 1,-0.1 -2,-0.2 0.753 360.0 360.0 -87.3 -26.2 -6.7 2.8 33.5 97 31 C X < 0 0 80 -4,-2.3 -3,-0.1 -5,-0.3 -1,-0.1 -0.040 360.0 360.0 150.2 360.0 -7.7 7.2 33.0