==== 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 3TWG . COMPND 2 MOLECULE: ALPHA4F3AF3D; . SOURCE 2 SYNTHETIC: YES; . AUTHOR B.C.BUER,J.L.MEAGHER,J.A.STUCKEY,E.N.G.MARSH . 47 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 4230.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 35 74.5 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 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 34 72.3 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 1 0 0 0 0 0 1 0 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 5 A E 0 0 138 0, 0.0 4,-0.2 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 -39.6 -6.9 -4.8 -20.7 2 6 A X > + 0 0 112 1,-0.1 4,-1.9 2,-0.1 5,-0.1 0.161 360.0 100.2-104.3 12.3 -5.1 -4.2 -17.3 3 7 A Y H > S+ 0 0 61 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.937 81.0 48.5 -63.9 -48.0 -7.4 -1.2 -16.5 4 8 A K H > S+ 0 0 78 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.837 111.4 51.1 -62.7 -36.8 -9.8 -3.2 -14.2 5 9 A E H > S+ 0 0 113 2,-0.2 4,-2.2 -4,-0.2 -1,-0.2 0.875 111.0 46.7 -69.7 -38.8 -6.7 -4.6 -12.3 6 10 A X H X S+ 0 0 52 -4,-1.9 4,-2.7 2,-0.2 -2,-0.2 0.896 112.3 50.6 -70.2 -39.0 -5.2 -1.1 -11.7 7 11 A E H X S+ 0 0 88 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.939 112.9 47.0 -60.3 -47.9 -8.5 0.3 -10.6 8 12 A D H X S+ 0 0 62 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.881 110.9 51.0 -61.8 -41.0 -8.9 -2.7 -8.2 9 13 A X H X S+ 0 0 66 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.945 113.2 46.3 -61.6 -44.4 -5.3 -2.2 -6.9 10 14 A Q H X S+ 0 0 25 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.936 113.0 49.5 -61.3 -45.0 -6.1 1.5 -6.3 11 15 A E H X S+ 0 0 44 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.885 108.3 53.2 -62.5 -39.5 -9.4 0.5 -4.6 12 16 A R H X S+ 0 0 155 -4,-2.9 4,-1.9 2,-0.2 -1,-0.2 0.884 109.6 47.3 -66.4 -37.1 -7.7 -2.0 -2.3 13 17 A X H X S+ 0 0 56 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.928 110.9 52.7 -68.2 -40.0 -5.2 0.6 -1.1 14 18 A R H X S+ 0 0 113 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.921 109.7 49.1 -57.7 -44.4 -8.1 3.1 -0.6 15 19 A K H X S+ 0 0 98 -4,-2.6 4,-1.1 1,-0.2 -1,-0.2 0.867 110.1 51.0 -62.6 -39.0 -9.8 0.3 1.5 16 20 A X H < S+ 0 0 65 -4,-1.9 4,-0.4 1,-0.2 3,-0.3 0.913 111.9 47.1 -65.2 -42.2 -6.6 -0.2 3.5 17 21 A R H >< S+ 0 0 47 -4,-2.5 3,-0.9 1,-0.2 -2,-0.2 0.817 104.5 60.3 -65.3 -39.5 -6.4 3.6 4.2 18 22 A K H 3< S+ 0 0 143 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.802 103.9 51.9 -60.3 -32.6 -10.1 3.9 5.2 19 23 A K T 3< S+ 0 0 161 -4,-1.1 -1,-0.2 -3,-0.3 2,-0.2 0.614 99.0 82.5 -77.7 -19.1 -9.4 1.4 8.1 20 24 A X S < S- 0 0 80 -3,-0.9 2,-0.2 -4,-0.4 -3,-0.0 -0.600 79.6-120.6 -92.0 151.3 -6.4 3.4 9.4 21 25 A R 0 0 78 -2,-0.2 9,-0.1 1,-0.1 -2,-0.1 -0.528 360.0 360.0 -81.3 155.2 -6.5 6.4 11.7 22 26 A S 0 0 89 -2,-0.2 9,-0.1 8,-0.1 -1,-0.1 0.753 360.0 360.0 -63.6 360.0 -4.9 9.7 10.4 23 !* 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 24 1 B G 0 0 131 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 171.7 7.2 1.7 11.9 25 2 B N > - 0 0 96 1,-0.1 4,-2.1 2,-0.0 5,-0.1 -0.958 360.0-143.0-156.9 136.6 4.5 4.4 12.3 26 3 B A H > S+ 0 0 53 -2,-0.3 4,-2.6 2,-0.2 5,-0.2 0.903 104.1 52.1 -65.1 -47.0 0.8 4.8 11.4 27 4 B D H > S+ 0 0 74 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.893 112.8 46.3 -58.5 -41.5 1.0 8.5 10.3 28 5 B E H > S+ 0 0 112 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.904 111.6 50.8 -68.4 -43.9 3.9 7.5 7.9 29 6 B X H X S+ 0 0 60 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.926 111.5 48.6 -58.8 -46.7 2.0 4.5 6.6 30 7 B Y H X S+ 0 0 56 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.953 113.3 45.9 -60.7 -47.1 -1.1 6.6 5.9 31 8 B K H X S+ 0 0 104 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.918 112.9 49.9 -63.6 -43.1 0.9 9.4 4.1 32 9 B E H X S+ 0 0 95 -4,-2.7 4,-2.5 2,-0.2 -1,-0.2 0.905 111.7 48.4 -64.9 -37.3 2.9 6.9 2.0 33 10 B X H X S+ 0 0 36 -4,-2.4 4,-2.8 2,-0.2 5,-0.2 0.931 110.4 51.2 -69.1 -43.9 -0.3 5.1 1.0 34 11 B E H X S+ 0 0 84 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.923 113.3 46.9 -55.1 -45.8 -2.0 8.4 0.1 35 12 B D H X S+ 0 0 90 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.911 113.1 45.7 -67.2 -44.4 1.1 9.2 -2.1 36 13 B X H X S+ 0 0 77 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.861 111.2 53.7 -67.1 -36.3 1.3 5.9 -3.8 37 14 B Q H X S+ 0 0 33 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.934 111.3 46.8 -61.3 -44.0 -2.5 6.0 -4.5 38 15 B E H X S+ 0 0 78 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.901 109.8 52.1 -64.8 -39.4 -2.0 9.4 -6.1 39 16 B R H X S+ 0 0 141 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.916 112.3 47.3 -64.1 -39.8 1.0 8.2 -8.2 40 17 B X H X S+ 0 0 47 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.901 109.0 53.3 -64.9 -41.7 -1.2 5.3 -9.4 41 18 B R H X S+ 0 0 123 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.907 112.0 45.6 -59.3 -45.0 -4.1 7.7 -10.2 42 19 B K H X S+ 0 0 96 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.856 111.9 50.7 -67.6 -40.3 -1.8 9.9 -12.3 43 20 B X H X S+ 0 0 68 -4,-2.2 4,-1.9 -5,-0.2 -1,-0.2 0.905 113.3 47.0 -63.3 -40.1 -0.3 6.8 -14.1 44 21 B R H X S+ 0 0 31 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.924 111.4 49.8 -65.3 -46.4 -3.9 5.7 -14.8 45 22 B K H < S+ 0 0 59 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.869 111.1 50.8 -59.1 -40.0 -5.0 9.2 -16.0 46 23 B K H < S+ 0 0 173 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.2 0.888 111.3 47.1 -66.3 -40.8 -1.9 9.1 -18.3 47 24 B X H < 0 0 161 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.862 360.0 360.0 -67.9 -35.8 -2.8 5.7 -19.7 48 25 B R < 0 0 228 -4,-2.3 -2,-0.2 -5,-0.1 -1,-0.2 0.808 360.0 360.0 -70.2 360.0 -6.4 6.9 -20.3