==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER UNKNOWN FUNCTION 21-SEP-11 3TWF . COMPND 2 MOLECULE: ALPHA4F3A; . SOURCE 2 SYNTHETIC: YES; . AUTHOR B.C.BUER,J.L.MEAGHER,J.A.STUCKEY,E.N.G.MARSH . 51 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 4152.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 41 80.4 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 . 41 80.4 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 1 1 0 0 0 0 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 G 0 0 125 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 40.3 40.5 26.0 4.0 2 2 A N > - 0 0 92 1,-0.0 4,-1.8 0, 0.0 3,-0.3 -0.720 360.0 -87.5-129.1 179.1 42.3 22.8 4.8 3 3 A A H > S+ 0 0 53 1,-0.2 4,-2.9 -2,-0.2 5,-0.1 0.862 122.6 58.4 -58.7 -39.5 44.6 20.2 3.2 4 4 A D H > S+ 0 0 57 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.901 106.9 48.3 -58.4 -42.3 41.6 18.2 1.9 5 5 A E H > S+ 0 0 93 -3,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.910 113.2 46.0 -65.8 -43.3 40.4 21.3 -0.1 6 6 A L H X S+ 0 0 87 -4,-1.8 4,-2.7 2,-0.2 -2,-0.2 0.912 111.5 53.7 -66.4 -39.2 43.9 22.0 -1.5 7 7 A Y H X S+ 0 0 83 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.949 111.2 44.3 -59.9 -49.5 44.2 18.2 -2.4 8 8 A K H X S+ 0 0 114 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.887 113.1 52.6 -63.0 -38.7 40.9 18.3 -4.4 9 9 A E H X S+ 0 0 91 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.907 109.5 48.2 -60.3 -46.7 41.9 21.6 -6.0 10 10 A X H X S+ 0 0 35 -4,-2.7 4,-2.5 2,-0.2 -1,-0.2 0.878 111.6 49.5 -64.4 -40.1 45.2 20.1 -7.1 11 11 A E H X S+ 0 0 35 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.902 111.2 51.0 -65.0 -40.3 43.5 16.9 -8.5 12 12 A D H X S+ 0 0 79 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.955 111.5 46.1 -61.8 -48.8 41.0 19.2 -10.4 13 13 A L H X S+ 0 0 51 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.915 112.7 51.3 -60.4 -44.9 43.8 21.3 -11.9 14 14 A Q H X S+ 0 0 4 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.910 111.5 46.7 -58.8 -45.4 45.8 18.1 -12.9 15 15 A E H X S+ 0 0 56 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.845 108.0 56.2 -69.1 -29.9 42.7 16.6 -14.6 16 16 A R H X S+ 0 0 152 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.892 108.8 47.9 -65.9 -35.7 42.0 19.9 -16.4 17 17 A X H X S+ 0 0 43 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.890 109.9 51.2 -70.4 -40.5 45.5 19.7 -17.9 18 18 A R H X S+ 0 0 70 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.923 108.5 53.3 -59.9 -42.1 45.0 16.0 -18.9 19 19 A K H X S+ 0 0 101 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.904 108.5 49.4 -60.2 -41.3 41.7 17.1 -20.6 20 20 A L H X S+ 0 0 71 -4,-1.9 4,-2.4 1,-0.2 -1,-0.2 0.908 111.9 48.4 -62.8 -41.7 43.7 19.8 -22.6 21 21 A R H X S+ 0 0 50 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.901 112.4 48.3 -63.3 -43.3 46.3 17.2 -23.6 22 22 A K H < S+ 0 0 113 -4,-2.6 -2,-0.2 2,-0.2 -1,-0.2 0.887 113.9 46.2 -64.1 -40.0 43.6 14.7 -24.7 23 23 A K H < S+ 0 0 156 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.880 110.1 54.2 -69.3 -38.6 41.7 17.3 -26.7 24 24 A X H < 0 0 109 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.855 360.0 360.0 -62.2 -36.9 45.0 18.5 -28.3 25 25 A R < 0 0 107 -4,-1.7 -3,-0.2 -5,-0.1 -2,-0.2 0.842 360.0 360.0 -97.8 360.0 45.7 14.9 -29.4 26 !* 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 27 1 B G 0 0 105 0, 0.0 2,-0.2 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 113.3 56.5 27.2 -29.0 28 2 B N > - 0 0 100 1,-0.0 4,-2.3 0, 0.0 5,-0.2 -0.937 360.0 -86.6-160.6 173.5 55.2 24.0 -30.7 29 3 B A H > S+ 0 0 62 -2,-0.2 4,-2.5 1,-0.2 5,-0.1 0.851 123.5 51.6 -60.2 -40.5 53.0 20.9 -30.1 30 4 B D H > S+ 0 0 68 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.888 111.6 46.8 -64.4 -43.7 55.9 18.8 -28.6 31 5 B E H > S+ 0 0 119 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.904 113.6 48.6 -64.1 -45.7 56.8 21.6 -26.1 32 6 B L H X S+ 0 0 71 -4,-2.3 4,-2.8 2,-0.2 5,-0.2 0.953 114.3 46.0 -61.1 -47.1 53.1 22.0 -25.1 33 7 B Y H X S+ 0 0 118 -4,-2.5 4,-2.4 2,-0.2 5,-0.2 0.943 114.1 47.3 -60.9 -49.4 52.7 18.2 -24.7 34 8 B K H X S+ 0 0 58 -4,-2.7 4,-3.0 1,-0.2 5,-0.2 0.924 114.5 46.6 -61.4 -45.7 56.0 17.9 -22.7 35 9 B E H X S+ 0 0 102 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.902 112.1 50.4 -63.0 -46.0 55.2 20.8 -20.4 36 10 B X H X S+ 0 0 25 -4,-2.8 4,-1.9 -5,-0.2 -1,-0.2 0.888 114.8 44.2 -60.4 -41.3 51.6 19.6 -19.9 37 11 B E H X S+ 0 0 43 -4,-2.4 4,-2.2 -5,-0.2 -2,-0.2 0.891 112.9 50.4 -72.4 -37.3 52.9 16.1 -18.9 38 12 B D H X S+ 0 0 91 -4,-3.0 4,-2.7 -5,-0.2 -2,-0.2 0.935 112.2 48.5 -63.0 -44.5 55.7 17.4 -16.7 39 13 B L H X S+ 0 0 46 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.899 109.5 51.5 -63.7 -40.1 53.2 19.7 -14.8 40 14 B Q H X S+ 0 0 0 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.937 112.6 46.0 -61.4 -42.9 50.7 16.8 -14.4 41 15 B E H X S+ 0 0 85 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.915 110.3 53.0 -67.1 -39.7 53.5 14.6 -12.9 42 16 B R H X S+ 0 0 162 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.909 110.5 49.2 -59.7 -39.4 54.8 17.5 -10.7 43 17 B X H X S+ 0 0 26 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.836 106.9 53.8 -70.9 -35.3 51.1 17.8 -9.4 44 18 B R H X S+ 0 0 69 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.943 112.6 45.4 -61.2 -44.6 50.9 14.0 -8.7 45 19 B K H X S+ 0 0 130 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.899 113.4 48.8 -66.2 -40.2 54.1 14.3 -6.6 46 20 B L H X S+ 0 0 49 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.923 112.5 47.4 -66.6 -43.6 52.9 17.5 -4.8 47 21 B R H X S+ 0 0 37 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.914 111.7 53.0 -59.5 -43.5 49.4 15.9 -4.0 48 22 B K H X S+ 0 0 134 -4,-2.3 4,-1.7 1,-0.2 -2,-0.2 0.925 113.3 41.0 -59.5 -50.6 51.3 12.7 -2.8 49 23 B K H < S+ 0 0 140 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.785 109.0 60.3 -73.1 -25.5 53.5 14.6 -0.3 50 24 B X H < S+ 0 0 84 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.921 109.8 41.5 -65.5 -44.1 50.7 16.9 0.8 51 25 B R H < 0 0 76 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.858 360.0 360.0 -70.5 -37.3 48.6 14.0 2.1 52 26 B S < 0 0 125 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.447 360.0 360.0 -78.0 360.0 51.8 12.2 3.6