==== 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 OXIDOREDUCTASE/DNA 18-SEP-07 2RBF . COMPND 2 MOLECULE: BIFUNCTIONAL PROTEIN PUTA; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR J.J.TANNER . 89 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5491.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 69 77.5 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 . 7 7.9 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 . 4 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 3 3.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 53 59.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 2.2 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 2 0 0 0 1 1 0 0 0 0 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 1 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 . 1 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 3 A T 0 0 124 0, 0.0 2,-0.3 0, 0.0 52,-0.3 0.000 360.0 360.0 360.0 146.9 -43.7 9.7 76.2 2 4 A T E -A 52 0A 72 50,-2.5 50,-2.8 48,-0.1 2,-0.6 -0.966 360.0-103.9-142.3 164.2 -40.9 12.2 75.6 3 5 A T E -A 51 0A 80 -2,-0.3 2,-0.6 48,-0.3 48,-0.3 -0.808 31.8-158.5 -90.1 119.6 -39.9 14.6 72.9 4 6 A M E -A 50 0A 68 46,-3.0 46,-2.0 -2,-0.6 2,-0.1 -0.878 12.4-137.5 -99.7 121.7 -36.8 13.4 70.9 5 7 A G E -A 49 0A 43 -2,-0.6 2,-0.4 44,-0.2 44,-0.2 -0.434 13.7-164.7 -72.7 150.1 -34.8 16.0 69.0 6 8 A V E -A 48 0A 0 42,-2.3 42,-1.9 -2,-0.1 2,-0.7 -0.986 22.0-129.3-135.6 124.1 -33.5 15.5 65.5 7 9 A K E +A 47 0A 122 -2,-0.4 2,-0.4 40,-0.2 40,-0.3 -0.678 39.2 172.3 -74.7 111.9 -30.8 17.8 64.1 8 10 A L - 0 0 3 38,-2.5 2,-0.1 -2,-0.7 -2,-0.0 -0.982 26.6-131.7-128.5 130.1 -32.3 18.9 60.7 9 11 A D > - 0 0 94 -2,-0.4 4,-2.2 1,-0.1 3,-0.2 -0.341 33.9 -99.6 -80.3 172.9 -30.8 21.5 58.4 10 12 A D H > S+ 0 0 110 1,-0.3 4,-2.1 2,-0.2 5,-0.2 0.853 120.1 52.9 -65.1 -42.9 -33.0 24.3 56.9 11 13 A A H > S+ 0 0 67 2,-0.2 4,-2.0 1,-0.2 -1,-0.3 0.881 110.6 48.5 -56.2 -42.1 -33.5 22.7 53.5 12 14 A T H > S+ 0 0 8 -3,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.914 109.0 52.7 -69.4 -41.6 -34.7 19.5 55.1 13 15 A R H X S+ 0 0 57 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.888 111.1 47.5 -60.9 -37.3 -37.1 21.3 57.4 14 16 A E H X S+ 0 0 126 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.859 108.1 54.4 -71.4 -36.2 -38.6 23.1 54.4 15 17 A R H X S+ 0 0 77 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.916 111.5 46.9 -59.4 -40.2 -38.9 19.8 52.5 16 18 A I H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.883 111.3 49.1 -66.5 -44.2 -40.9 18.5 55.5 17 19 A K H X S+ 0 0 43 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.884 114.3 47.2 -63.5 -41.0 -43.1 21.6 55.7 18 20 A S H X S+ 0 0 68 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.903 114.3 44.3 -67.7 -47.3 -43.8 21.3 52.0 19 21 A A H X S+ 0 0 3 -4,-2.4 4,-1.0 -5,-0.2 -2,-0.2 0.930 111.8 54.6 -66.8 -40.9 -44.6 17.6 52.0 20 22 A A H ><>S+ 0 0 1 -4,-2.7 5,-2.5 1,-0.2 3,-0.6 0.893 107.3 51.7 -54.0 -46.4 -46.7 17.9 55.1 21 23 A T H ><5S+ 0 0 114 -4,-1.8 3,-1.2 1,-0.2 -1,-0.2 0.917 107.7 49.4 -59.2 -49.6 -48.8 20.6 53.5 22 24 A R H 3<5S+ 0 0 167 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.605 114.4 44.7 -78.5 -4.6 -49.6 18.6 50.4 23 25 A I T <<5S- 0 0 52 -4,-1.0 -1,-0.2 -3,-0.6 -2,-0.2 0.312 111.8-119.3-108.0 6.0 -50.7 15.5 52.4 24 26 A D T < 5S+ 0 0 133 -3,-1.2 2,-0.3 -4,-0.4 -3,-0.2 0.871 74.2 111.1 61.4 45.7 -52.7 17.6 54.9 25 27 A R S - 0 0 81 -2,-0.3 4,-2.1 1,-0.1 5,-0.1 -0.473 32.8-113.7 -80.6 155.9 -48.5 18.4 60.4 27 29 A P H > S+ 0 0 43 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.866 120.6 55.3 -50.4 -38.7 -44.7 18.2 60.1 28 30 A H H > S+ 0 0 65 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.936 105.8 49.8 -59.9 -48.9 -44.8 16.3 63.4 29 31 A W H > S+ 0 0 86 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.892 109.2 52.9 -57.5 -42.2 -47.2 13.7 62.0 30 32 A L H X S+ 0 0 0 -4,-2.1 4,-2.9 1,-0.2 -1,-0.2 0.930 109.6 47.4 -63.5 -45.4 -44.9 13.2 58.9 31 33 A I H X S+ 0 0 0 -4,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.908 113.1 48.0 -61.6 -48.7 -41.8 12.5 61.0 32 34 A K H X S+ 0 0 80 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.935 114.1 46.7 -55.2 -53.5 -43.7 10.1 63.3 33 35 A Q H X S+ 0 0 65 -4,-2.8 4,-2.7 1,-0.2 5,-0.3 0.905 109.0 55.1 -57.0 -43.8 -45.1 8.3 60.2 34 36 A A H X S+ 0 0 1 -4,-2.9 4,-1.9 -5,-0.2 -1,-0.2 0.885 108.9 49.3 -52.5 -41.9 -41.7 8.3 58.6 35 37 A I H X S+ 0 0 0 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.939 111.2 47.7 -66.4 -48.2 -40.4 6.5 61.7 36 38 A F H X S+ 0 0 66 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.882 113.1 47.7 -64.1 -39.4 -43.1 3.9 61.8 37 39 A S H X S+ 0 0 29 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.876 111.8 50.0 -69.6 -36.6 -42.8 3.1 58.0 38 40 A Y H X S+ 0 0 34 -4,-1.9 4,-2.3 -5,-0.3 -2,-0.2 0.898 109.1 51.0 -71.6 -38.7 -39.0 2.8 58.3 39 41 A L H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.868 109.7 51.4 -62.2 -39.3 -39.3 0.4 61.3 40 42 A E H X S+ 0 0 74 -4,-1.8 4,-1.4 2,-0.2 -2,-0.2 0.948 110.0 49.7 -61.0 -46.6 -41.7 -1.7 59.3 41 43 A Q H < S+ 0 0 94 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.895 114.4 44.8 -56.6 -45.1 -39.2 -1.8 56.5 42 44 A L H < S+ 0 0 61 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.937 115.2 46.2 -66.2 -45.4 -36.3 -2.8 58.8 43 45 A E H < 0 0 92 -4,-2.5 -1,-0.2 -5,-0.1 -2,-0.2 0.607 360.0 360.0 -77.5 -13.9 -38.3 -5.4 60.7 44 46 A N < 0 0 116 -4,-1.4 -4,-0.0 -3,-0.2 -3,-0.0 -0.505 360.0 360.0 -80.6 360.0 -39.7 -7.0 57.5 45 !* 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 46 4 B T 0 0 126 0, 0.0 -38,-2.5 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 -23.1 -31.2 23.3 64.3 47 5 B T E -A 7 0A 73 -40,-0.3 2,-0.3 -42,-0.0 -40,-0.2 -0.787 360.0-163.3-116.9 156.4 -33.7 20.8 65.6 48 6 B M E -A 6 0A 42 -42,-1.9 -42,-2.3 -2,-0.3 2,-0.4 -0.874 25.3-135.5-115.8 162.9 -37.2 19.5 65.3 49 7 B G E -A 5 0A 32 -2,-0.3 2,-0.4 -44,-0.2 -44,-0.2 -0.927 13.2-165.3-120.8 145.0 -38.9 17.4 68.0 50 8 B V E -A 4 0A 0 -46,-2.0 -46,-3.0 -2,-0.4 2,-0.7 -0.993 19.0-136.7-129.0 126.4 -41.0 14.3 67.8 51 9 B K E +A 3 0A 114 -2,-0.4 2,-0.3 -48,-0.3 -48,-0.3 -0.735 32.3 176.2 -84.4 113.2 -43.0 13.1 70.8 52 10 B L E -A 2 0A 3 -50,-2.8 -50,-2.5 -2,-0.7 2,-0.1 -0.897 25.1-129.5-119.1 145.6 -42.6 9.3 71.1 53 11 B D > - 0 0 75 -2,-0.3 4,-2.3 -52,-0.3 5,-0.2 -0.411 36.8 -99.1 -84.2 171.5 -43.9 6.8 73.7 54 12 B D H > S+ 0 0 88 1,-0.2 4,-2.6 2,-0.2 5,-0.1 0.846 118.5 54.9 -63.7 -40.3 -41.6 4.3 75.4 55 13 B A H > S+ 0 0 55 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.921 110.2 46.1 -59.5 -45.2 -42.4 1.3 73.2 56 14 B T H > S+ 0 0 8 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.949 112.1 51.0 -67.6 -44.8 -41.6 3.2 70.0 57 15 B R H X S+ 0 0 66 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.896 109.2 53.3 -54.2 -39.8 -38.4 4.5 71.6 58 16 B E H X S+ 0 0 123 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.941 109.9 46.4 -59.4 -50.0 -37.6 0.8 72.5 59 17 B R H X S+ 0 0 80 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.866 110.5 53.0 -62.1 -41.5 -38.1 -0.4 68.9 60 18 B I H X S+ 0 0 4 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.934 111.2 45.9 -60.0 -46.0 -36.0 2.4 67.5 61 19 B K H X S+ 0 0 42 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.934 113.7 47.2 -65.7 -47.8 -33.1 1.6 69.8 62 20 B S H X S+ 0 0 46 -4,-2.5 4,-1.5 1,-0.2 -1,-0.2 0.887 114.9 47.8 -61.7 -35.8 -33.2 -2.2 69.2 63 21 B A H X S+ 0 0 2 -4,-2.4 4,-1.2 -5,-0.2 -2,-0.2 0.878 110.7 50.6 -72.1 -39.0 -33.4 -1.5 65.4 64 22 B A H <>S+ 0 0 0 -4,-2.4 5,-2.6 2,-0.2 4,-0.5 0.813 107.7 53.5 -66.7 -34.8 -30.5 1.0 65.4 65 23 B T H ><5S+ 0 0 115 -4,-1.9 3,-1.1 1,-0.2 -1,-0.2 0.920 104.4 55.1 -69.2 -44.0 -28.3 -1.4 67.3 66 24 B R H 3<5S+ 0 0 173 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.863 114.1 40.6 -52.1 -41.2 -28.9 -4.2 64.8 67 25 B I T 3<5S- 0 0 60 -4,-1.2 -1,-0.2 2,-0.1 -2,-0.2 0.360 112.6-114.8 -97.0 3.9 -27.7 -1.9 62.0 68 26 B D T < 5S+ 0 0 139 -3,-1.1 2,-0.3 -4,-0.5 -3,-0.2 0.927 77.9 112.3 67.0 46.3 -24.8 -0.3 63.8 69 27 B R < - 0 0 120 -5,-2.6 -1,-0.3 -6,-0.1 -2,-0.1 -0.892 68.5-101.1-139.8 164.8 -26.3 3.2 63.8 70 28 B T > - 0 0 81 -2,-0.3 4,-2.2 1,-0.1 5,-0.1 -0.497 30.2-115.4 -84.2 158.8 -27.7 5.6 66.5 71 29 B P H > S+ 0 0 54 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.907 119.2 55.0 -53.7 -41.7 -31.4 6.1 67.1 72 30 B H H > S+ 0 0 70 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.919 107.5 46.9 -58.0 -51.6 -30.8 9.7 65.9 73 31 B W H > S+ 0 0 73 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.934 111.4 54.7 -51.7 -47.4 -29.3 8.6 62.5 74 32 B L H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.908 107.1 47.7 -56.1 -49.2 -32.2 6.1 62.3 75 33 B I H X S+ 0 0 6 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.905 112.1 50.6 -61.0 -42.6 -34.9 8.8 62.6 76 34 B K H X S+ 0 0 51 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.928 111.5 47.0 -61.0 -47.5 -33.1 11.1 60.0 77 35 B Q H X S+ 0 0 62 -4,-2.7 4,-2.6 2,-0.2 -1,-0.2 0.858 109.1 54.9 -60.9 -39.9 -32.9 8.3 57.5 78 36 B A H X S+ 0 0 1 -4,-2.2 4,-2.4 -5,-0.2 -2,-0.2 0.927 110.5 47.1 -57.0 -44.4 -36.6 7.5 58.2 79 37 B I H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.954 112.7 47.3 -64.0 -51.7 -37.4 11.1 57.4 80 38 B F H X S+ 0 0 51 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.880 113.0 49.9 -55.2 -42.3 -35.3 11.2 54.2 81 39 B S H X S+ 0 0 29 -4,-2.6 4,-1.8 2,-0.2 -1,-0.2 0.939 112.3 46.5 -66.4 -43.3 -36.8 7.9 53.0 82 40 B Y H X S+ 0 0 32 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.895 111.6 51.2 -66.8 -40.9 -40.4 9.1 53.6 83 41 B L H X S+ 0 0 0 -4,-2.6 4,-3.1 2,-0.2 -1,-0.2 0.868 106.5 53.6 -63.8 -41.1 -39.8 12.4 51.9 84 42 B E H X S+ 0 0 49 -4,-1.9 4,-2.7 2,-0.2 -1,-0.2 0.899 109.2 50.6 -57.7 -44.6 -38.4 10.8 48.8 85 43 B Q H X S+ 0 0 91 -4,-1.8 4,-0.8 2,-0.2 -2,-0.2 0.939 114.2 43.0 -57.3 -48.5 -41.5 8.7 48.6 86 44 B L H < S+ 0 0 33 -4,-2.2 3,-0.5 1,-0.2 -2,-0.2 0.924 118.4 45.0 -65.1 -42.3 -43.7 11.7 48.9 87 45 B E H < S+ 0 0 71 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.786 114.5 48.0 -74.2 -31.9 -41.6 13.8 46.5 88 46 B N H < S+ 0 0 136 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.523 91.7 105.7 -83.2 -8.3 -41.3 10.9 43.9 89 47 B S < 0 0 74 -4,-0.8 -3,-0.0 -3,-0.5 -4,-0.0 -0.387 360.0 360.0 -75.2 157.9 -45.1 10.2 44.0 90 48 B D 0 0 197 -2,-0.1 -1,-0.1 0, 0.0 -2,-0.1 -0.679 360.0 360.0-134.5 360.0 -47.3 11.2 41.1