==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DE NOVO PROTEIN 18-FEB-10 2X6P . COMPND 2 MOLECULE: COIL SER L19C; . SOURCE 2 SYNTHETIC: YES; . AUTHOR S.CHAKRABORTY,D.S.TOUW,A.F.A.PEACOCK,J.A.STUCKEY, . 87 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5993.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 75 86.2 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 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 73 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 2 1 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 E > 0 0 147 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -45.7 24.6 9.7 -0.5 2 2 A W H > + 0 0 95 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.959 360.0 41.4 -49.6 -53.8 22.8 6.6 0.5 3 3 A E H > S+ 0 0 138 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.733 110.8 55.4 -68.4 -28.8 20.7 8.6 3.0 4 4 A A H > S+ 0 0 55 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.908 109.9 48.8 -66.3 -41.1 20.3 11.6 0.8 5 5 A L H X S+ 0 0 5 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.891 109.7 51.8 -60.4 -43.2 18.8 9.2 -1.8 6 6 A E H X S+ 0 0 35 -4,-1.8 4,-1.8 -5,-0.2 -1,-0.2 0.863 109.8 48.3 -64.7 -36.1 16.6 7.7 0.8 7 7 A K H X S+ 0 0 137 -4,-1.5 4,-1.9 2,-0.2 -1,-0.2 0.755 109.8 52.9 -75.5 -27.7 15.3 11.2 1.8 8 8 A K H X S+ 0 0 103 -4,-1.6 4,-3.1 2,-0.2 -2,-0.2 0.870 107.2 51.9 -70.5 -39.7 14.6 12.2 -1.8 9 9 A L H X S+ 0 0 4 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.924 109.5 49.5 -66.2 -42.3 12.6 9.1 -2.2 10 10 A A H X S+ 0 0 52 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.894 112.8 46.4 -60.7 -45.3 10.6 10.0 0.9 11 11 A A H X S+ 0 0 44 -4,-1.9 4,-3.1 2,-0.2 5,-0.3 0.928 109.9 54.1 -62.3 -44.2 9.9 13.6 -0.4 12 12 A L H X S+ 0 0 14 -4,-3.1 4,-2.8 1,-0.2 5,-0.2 0.926 109.1 50.2 -53.7 -42.9 9.0 12.2 -3.9 13 13 A E H X S+ 0 0 63 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.907 113.7 43.6 -64.1 -39.1 6.5 10.0 -2.1 14 14 A S H X S+ 0 0 77 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.892 114.3 49.3 -73.2 -44.4 5.0 12.9 -0.2 15 15 A K H X S+ 0 0 105 -4,-3.1 4,-2.7 2,-0.2 -2,-0.2 0.923 110.8 51.0 -55.0 -48.6 5.0 15.2 -3.2 16 16 A L H X S+ 0 0 4 -4,-2.8 4,-2.7 -5,-0.3 -2,-0.2 0.905 109.0 50.4 -63.4 -40.2 3.3 12.5 -5.3 17 17 A Q H X S+ 0 0 82 -4,-1.9 4,-1.4 -5,-0.2 -1,-0.2 0.898 108.7 52.3 -62.2 -40.9 0.6 12.1 -2.6 18 18 A A H X S+ 0 0 47 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.861 111.5 47.3 -58.7 -46.8 0.1 15.9 -2.6 19 19 A C H X S+ 0 0 3 -4,-2.7 4,-3.4 2,-0.2 5,-0.2 0.890 107.9 55.0 -50.3 -52.3 -0.4 15.7 -6.5 20 20 A E H X S+ 0 0 69 -4,-2.7 4,-1.3 1,-0.2 -2,-0.2 0.841 111.1 46.5 -52.7 -36.4 -2.8 12.8 -6.1 21 21 A K H X S+ 0 0 151 -4,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.854 113.9 44.5 -79.4 -43.2 -4.8 15.0 -3.7 22 22 A K H X S+ 0 0 69 -4,-1.9 4,-2.5 2,-0.2 5,-0.3 0.935 112.3 54.9 -55.9 -53.9 -4.8 18.2 -5.9 23 23 A L H X S+ 0 0 3 -4,-3.4 4,-1.7 1,-0.2 -2,-0.2 0.873 110.9 45.7 -49.6 -42.2 -5.6 15.9 -8.9 24 24 A E H X S+ 0 0 67 -4,-1.3 4,-1.5 -5,-0.2 -1,-0.2 0.974 112.8 47.0 -66.9 -57.0 -8.6 14.6 -6.9 25 25 A A H < S+ 0 0 67 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.690 110.6 52.6 -67.1 -21.1 -10.0 17.9 -5.7 26 26 A L H < S+ 0 0 54 -4,-2.5 -1,-0.3 1,-0.1 -2,-0.2 0.883 105.9 55.5 -68.1 -42.0 -9.7 19.4 -9.2 27 27 A E H < S+ 0 0 85 -4,-1.7 -2,-0.2 -5,-0.3 -3,-0.1 0.882 120.5 32.6 -55.7 -32.2 -11.7 16.4 -10.4 28 28 A H < 0 0 119 -4,-1.5 -3,-0.1 1,-0.1 0, 0.0 -0.031 360.0 360.0-104.2-156.7 -14.3 17.5 -7.8 29 29 A G 0 0 129 -2,-0.0 -1,-0.1 0, 0.0 -3,-0.1 -0.408 360.0 360.0 92.2 360.0 -15.8 20.7 -6.2 30 !* 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 31 1 B E > 0 0 146 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -26.1 22.9 -0.1 -10.4 32 2 B W H > + 0 0 64 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.892 360.0 34.7 -69.0 -52.0 23.7 3.2 -8.5 33 3 B E H > S+ 0 0 113 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.769 116.8 57.8 -78.4 -26.4 23.9 5.8 -11.3 34 4 B A H > S+ 0 0 64 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.953 109.6 43.6 -60.8 -54.4 21.1 3.9 -13.1 35 5 B L H X S+ 0 0 12 -4,-2.9 4,-2.9 2,-0.2 -2,-0.2 0.920 113.5 52.1 -56.8 -43.0 18.8 4.3 -10.0 36 6 B E H X S+ 0 0 50 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.879 110.4 48.2 -59.9 -38.5 20.0 8.0 -9.7 37 7 B K H X S+ 0 0 142 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.896 111.4 50.6 -67.4 -40.4 19.1 8.6 -13.3 38 8 B K H X S+ 0 0 96 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.903 110.8 48.4 -67.5 -40.8 15.7 6.9 -12.7 39 9 B L H X S+ 0 0 6 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.914 110.5 51.4 -63.0 -48.7 15.1 9.1 -9.6 40 10 B A H X S+ 0 0 53 -4,-2.7 4,-1.8 2,-0.2 -2,-0.2 0.869 109.7 50.3 -52.5 -42.8 16.0 12.2 -11.7 41 11 B A H X S+ 0 0 40 -4,-2.2 4,-2.7 2,-0.2 5,-0.2 0.932 112.0 47.3 -66.6 -42.3 13.5 11.2 -14.4 42 12 B L H X S+ 0 0 13 -4,-2.1 4,-2.7 1,-0.2 -2,-0.2 0.895 109.2 53.8 -62.5 -47.3 10.7 10.7 -11.9 43 13 B E H X S+ 0 0 87 -4,-2.5 4,-1.7 2,-0.2 -1,-0.2 0.868 112.5 43.0 -53.4 -40.4 11.4 14.0 -10.2 44 14 B S H X S+ 0 0 63 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.909 112.8 52.6 -80.0 -33.3 11.1 15.9 -13.5 45 15 B K H X S+ 0 0 111 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.916 111.9 47.5 -60.8 -39.0 8.0 13.9 -14.6 46 16 B L H X S+ 0 0 8 -4,-2.7 4,-2.3 -5,-0.2 -1,-0.2 0.891 109.6 52.3 -68.8 -37.2 6.5 14.7 -11.3 47 17 B Q H X S+ 0 0 87 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.903 109.9 49.0 -62.9 -43.9 7.5 18.4 -11.7 48 18 B A H X S+ 0 0 39 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.952 110.6 51.4 -59.0 -46.5 5.8 18.4 -15.2 49 19 B C H X S+ 0 0 3 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.901 110.8 47.3 -61.0 -43.2 2.7 16.8 -13.6 50 20 B E H X S+ 0 0 65 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.838 113.0 49.1 -70.6 -35.9 2.6 19.5 -10.9 51 21 B K H X S+ 0 0 136 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.880 112.8 46.2 -67.2 -39.3 3.0 22.3 -13.5 52 22 B K H X S+ 0 0 103 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.910 112.2 52.0 -72.9 -39.5 0.3 20.9 -15.7 53 23 B L H X S+ 0 0 0 -4,-2.8 4,-2.9 -5,-0.2 -2,-0.2 0.907 109.5 48.9 -59.8 -43.5 -2.0 20.4 -12.7 54 24 B E H X S+ 0 0 74 -4,-1.8 4,-1.4 2,-0.2 -1,-0.2 0.905 112.1 49.5 -62.2 -43.4 -1.5 24.1 -11.7 55 25 B A H < S+ 0 0 55 -4,-2.1 3,-0.2 2,-0.2 -2,-0.2 0.908 109.9 50.3 -56.6 -47.7 -2.2 25.2 -15.3 56 26 B L H >< S+ 0 0 47 -4,-2.5 3,-2.3 3,-0.2 -2,-0.2 0.950 105.7 57.7 -58.0 -50.2 -5.4 23.1 -15.3 57 27 B E H 3< S+ 0 0 95 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.862 113.4 38.4 -39.6 -46.4 -6.3 24.9 -12.0 58 28 B H T 3< 0 0 139 -4,-1.4 -1,-0.3 -3,-0.2 -2,-0.2 0.318 360.0 360.0 -92.2 6.4 -6.1 28.3 -13.8 59 29 B G < 0 0 89 -3,-2.3 -3,-0.2 -4,-0.2 -2,-0.1 -0.079 360.0 360.0 104.5 360.0 -7.7 26.8 -16.9 60 !* 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 61 1 C E >> 0 0 143 0, 0.0 4,-2.3 0, 0.0 3,-0.8 0.000 360.0 360.0 360.0 -36.2 17.7 -2.7 1.6 62 2 C W H 3> + 0 0 50 1,-0.3 4,-2.1 2,-0.2 3,-0.3 0.947 360.0 48.7 -48.1 -49.5 18.7 -2.1 -2.0 63 3 C E H 3> S+ 0 0 122 1,-0.3 4,-1.7 2,-0.2 -1,-0.3 0.738 109.3 52.9 -66.2 -25.5 15.8 -4.3 -3.1 64 4 C A H <> S+ 0 0 53 -3,-0.8 4,-1.7 2,-0.2 -1,-0.3 0.878 108.1 50.3 -74.7 -41.7 13.5 -2.4 -0.9 65 5 C L H X S+ 0 0 9 -4,-2.3 4,-1.9 -3,-0.3 -2,-0.2 0.825 111.1 49.7 -59.6 -43.7 14.5 0.9 -2.3 66 6 C E H X S+ 0 0 52 -4,-2.1 4,-2.3 -5,-0.2 -2,-0.2 0.909 109.0 50.3 -65.5 -43.2 14.0 -0.4 -5.8 67 7 C K H X S+ 0 0 156 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.869 110.6 50.2 -60.6 -35.7 10.5 -1.7 -5.0 68 8 C K H X S+ 0 0 108 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.878 110.2 50.6 -67.3 -41.6 9.6 1.7 -3.5 69 9 C L H X S+ 0 0 3 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.888 110.3 50.2 -62.6 -42.7 10.9 3.4 -6.7 70 10 C A H X S+ 0 0 41 -4,-2.3 4,-1.5 1,-0.2 -2,-0.2 0.911 111.6 47.7 -58.5 -48.8 8.8 1.0 -8.9 71 11 C A H X S+ 0 0 40 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.867 110.5 51.9 -59.1 -47.5 5.7 1.7 -6.8 72 12 C L H X S+ 0 0 4 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.887 109.7 50.1 -55.7 -43.1 6.3 5.5 -7.0 73 13 C E H X S+ 0 0 72 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.826 109.1 50.8 -69.5 -33.4 6.6 5.2 -10.7 74 14 C S H X S+ 0 0 75 -4,-1.5 4,-1.8 2,-0.2 -1,-0.2 0.857 111.6 47.6 -64.0 -43.1 3.3 3.3 -11.0 75 15 C K H X S+ 0 0 92 -4,-2.1 4,-2.7 2,-0.2 5,-0.2 0.891 112.0 50.7 -69.0 -37.9 1.5 5.9 -8.9 76 16 C L H X S+ 0 0 10 -4,-2.4 4,-3.4 2,-0.2 -2,-0.2 0.968 109.3 49.5 -62.2 -51.8 3.0 8.6 -11.1 77 17 C Q H X S+ 0 0 99 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.876 113.5 49.3 -49.7 -39.9 1.9 6.8 -14.4 78 18 C A H X S+ 0 0 58 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.923 110.7 46.8 -72.1 -43.5 -1.5 6.6 -12.8 79 19 C C H X S+ 0 0 5 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.887 112.4 53.2 -61.6 -35.8 -1.6 10.3 -11.8 80 20 C E H X S+ 0 0 64 -4,-3.4 4,-2.3 -5,-0.2 -2,-0.2 0.936 108.9 47.6 -66.4 -44.1 -0.4 11.1 -15.3 81 21 C K H X S+ 0 0 144 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.891 112.8 49.6 -61.9 -42.6 -3.3 9.1 -17.0 82 22 C K H X S+ 0 0 73 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.873 109.3 52.0 -62.9 -39.6 -5.8 10.8 -14.6 83 23 C L H X S+ 0 0 3 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.939 108.1 50.2 -63.6 -45.9 -4.5 14.2 -15.5 84 24 C E H X S+ 0 0 78 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.879 109.6 52.4 -56.5 -39.5 -4.8 13.6 -19.2 85 25 C A H X S+ 0 0 55 -4,-1.7 4,-1.3 1,-0.2 -1,-0.2 0.878 112.3 45.7 -68.5 -35.6 -8.4 12.4 -18.7 86 26 C L H < S+ 0 0 56 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.822 113.1 49.2 -74.9 -33.2 -9.1 15.6 -16.8 87 27 C E H < S+ 0 0 65 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.853 125.2 26.6 -68.9 -34.7 -7.4 17.9 -19.4 88 28 C H H < 0 0 139 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.383 360.0 360.0-119.0 -3.8 -9.1 16.4 -22.3 89 29 C G < 0 0 101 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.1 -0.113 360.0 360.0 80.3 360.0 -12.5 15.0 -21.1