==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 20-JUN-13 4LB5 . COMPND 2 MOLECULE: PROTEIN KINASE CONTAINING Z-DNA BINDING DOMAINS; . SOURCE 2 ORGANISM_SCIENTIFIC: DANIO RERIO; . AUTHOR M.DE ROSA,S.ZACARIAS,A.ATHANASIADIS . 120 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7885.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 79 65.8 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 . 14 11.7 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 . 3 2.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 56 46.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 3.3 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 2 0 0 0 1 2 1 0 0 0 0 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 . 2 0 0 2 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 2 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 9 A E > 0 0 153 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -56.4 -45.5 10.8 -14.7 2 10 A I H > + 0 0 46 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.909 360.0 53.1 -57.3 -40.2 -42.8 9.6 -12.3 3 11 A E H > S+ 0 0 54 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.860 105.7 53.9 -65.7 -32.9 -42.3 13.3 -11.5 4 12 A M H > S+ 0 0 126 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.942 109.8 46.9 -62.8 -46.6 -46.0 13.6 -10.8 5 13 A R H X S+ 0 0 87 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.851 112.5 50.0 -66.7 -36.4 -45.8 10.7 -8.3 6 14 A I H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 5,-0.2 0.957 111.9 46.2 -65.9 -51.4 -42.7 12.1 -6.6 7 15 A C H X S+ 0 0 9 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.853 112.0 53.7 -60.4 -33.7 -44.2 15.6 -6.2 8 16 A D H X S+ 0 0 69 -4,-2.1 4,-1.5 2,-0.2 -1,-0.2 0.872 107.4 49.3 -68.9 -38.3 -47.3 14.0 -4.9 9 17 A Y H X S+ 0 0 18 -4,-1.8 4,-3.0 2,-0.2 5,-0.4 0.949 115.1 44.9 -63.6 -47.9 -45.4 12.0 -2.3 10 18 A L H X S+ 0 0 2 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.890 108.8 56.2 -60.7 -42.7 -43.7 15.2 -1.2 11 19 A R H < S+ 0 0 161 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.842 118.2 34.6 -60.2 -32.3 -46.9 17.1 -1.2 12 20 A R H < S+ 0 0 139 -4,-1.5 -2,-0.2 -3,-0.3 -1,-0.2 0.866 130.0 27.8 -90.1 -41.1 -48.4 14.6 1.2 13 21 A H H < S- 0 0 98 -4,-3.0 -3,-0.2 1,-0.3 -2,-0.2 0.592 87.2-155.6-103.3 -12.7 -45.4 13.6 3.4 14 22 A G < + 0 0 22 -4,-2.2 -1,-0.3 -5,-0.4 41,-0.1 -0.425 64.3 34.1 71.6-146.5 -43.2 16.7 3.4 15 23 A R S S+ 0 0 144 -2,-0.1 2,-0.3 39,-0.1 41,-0.2 -0.123 76.9 166.9 -47.5 122.2 -39.5 16.3 4.0 16 24 A S B -A 55 0A 2 39,-2.3 39,-3.2 4,-0.0 2,-0.2 -0.999 33.9-131.8-145.0 141.4 -38.4 13.0 2.6 17 25 A T > - 0 0 21 -2,-0.3 4,-1.9 37,-0.2 3,-0.1 -0.494 38.3-108.3 -80.9 162.3 -35.1 11.2 1.8 18 26 A V H > S+ 0 0 7 35,-0.5 4,-3.0 1,-0.2 5,-0.3 0.874 122.7 59.9 -58.5 -31.9 -34.8 9.5 -1.5 19 27 A Q H > S+ 0 0 46 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.917 102.2 49.7 -61.6 -47.5 -35.1 6.3 0.5 20 28 A D H > S+ 0 0 74 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.946 115.4 45.6 -52.0 -50.4 -38.5 7.2 1.8 21 29 A I H X S+ 0 0 0 -4,-1.9 4,-2.7 1,-0.2 -2,-0.2 0.931 113.7 43.3 -65.1 -52.5 -39.7 8.0 -1.7 22 30 A F H X>S+ 0 0 52 -4,-3.0 5,-1.9 1,-0.2 4,-1.2 0.873 111.8 54.9 -68.1 -33.6 -38.4 5.0 -3.7 23 31 A K H <5S+ 0 0 90 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.919 115.4 38.9 -61.1 -45.7 -39.5 2.5 -1.0 24 32 A E H <5S+ 0 0 120 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.912 119.6 44.6 -72.2 -44.5 -43.1 3.8 -1.1 25 33 A L H <5S- 0 0 12 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.588 104.7-126.5 -79.3 -9.4 -43.3 4.4 -4.9 26 34 A K T <5 + 0 0 86 -4,-1.2 2,-0.3 1,-0.2 -3,-0.2 0.971 63.6 133.3 58.8 57.4 -41.6 1.0 -5.7 27 35 A L < - 0 0 41 -5,-1.9 -1,-0.2 -6,-0.1 2,-0.1 -0.910 63.1 -89.4-133.9 160.2 -39.0 2.6 -7.9 28 36 A E > - 0 0 114 -2,-0.3 4,-2.2 1,-0.1 5,-0.2 -0.437 32.0-128.2 -66.1 140.6 -35.2 2.4 -8.3 29 37 A K H > S+ 0 0 104 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.926 111.2 52.1 -54.2 -47.0 -33.2 4.8 -6.2 30 38 A S H > S+ 0 0 71 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.893 107.8 52.4 -59.0 -40.9 -31.3 6.1 -9.3 31 39 A T H > S+ 0 0 22 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.952 111.7 44.7 -59.8 -50.8 -34.7 6.7 -11.1 32 40 A V H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.929 114.6 49.2 -61.8 -44.9 -36.0 8.8 -8.2 33 41 A N H X S+ 0 0 33 -4,-2.9 4,-2.4 2,-0.2 5,-0.2 0.892 106.6 55.4 -62.0 -40.0 -32.7 10.7 -7.8 34 42 A R H X S+ 0 0 84 -4,-2.7 4,-1.3 -5,-0.2 -1,-0.2 0.933 113.4 42.3 -59.5 -42.2 -32.6 11.4 -11.6 35 43 A H H X S+ 0 0 36 -4,-2.0 4,-2.8 2,-0.2 -2,-0.2 0.868 110.7 54.8 -73.4 -36.0 -36.0 13.0 -11.4 36 44 A L H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 9,-0.2 0.929 109.0 48.2 -62.5 -44.1 -35.4 14.9 -8.1 37 45 A Y H X S+ 0 0 93 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.837 112.5 48.9 -67.9 -30.1 -32.3 16.6 -9.5 38 46 A S H X S+ 0 0 56 -4,-1.3 4,-1.5 -5,-0.2 -2,-0.2 0.902 111.7 48.4 -73.0 -41.8 -34.3 17.5 -12.7 39 47 A L H <>S+ 0 0 1 -4,-2.8 5,-2.9 2,-0.2 6,-1.0 0.827 108.5 55.9 -63.5 -32.7 -37.1 18.9 -10.5 40 48 A Q H ><5S+ 0 0 69 -4,-2.3 3,-1.8 1,-0.2 -2,-0.2 0.949 106.7 48.9 -62.8 -48.1 -34.4 20.8 -8.5 41 49 A A H 3<5S+ 0 0 77 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.814 108.5 54.8 -59.0 -31.4 -33.2 22.4 -11.8 42 50 A S T 3<5S- 0 0 60 -4,-1.5 -1,-0.3 -5,-0.1 -2,-0.2 0.466 113.4-120.5 -79.9 -2.2 -36.9 23.2 -12.5 43 51 A K T < 5S+ 0 0 122 -3,-1.8 -3,-0.2 2,-0.2 -2,-0.1 0.802 83.7 117.0 61.5 31.9 -37.1 25.0 -9.1 44 52 A Q S 0 0 142 0, 0.0 4,-1.5 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 141.1 -4.6 -1.8 -28.5 61 8 B N H > + 0 0 124 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.836 360.0 62.4 -62.4 -33.8 -5.7 -5.1 -30.2 62 9 B E H > S+ 0 0 101 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.924 101.5 49.8 -61.0 -45.1 -4.8 -6.8 -26.9 63 10 B I H > S+ 0 0 21 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.921 111.9 48.2 -57.3 -45.8 -7.5 -4.8 -25.0 64 11 B E H X S+ 0 0 43 -4,-1.5 4,-2.7 1,-0.2 5,-0.2 0.907 109.3 53.3 -65.2 -39.0 -10.1 -5.7 -27.6 65 12 B M H X S+ 0 0 125 -4,-2.8 4,-2.8 1,-0.2 -1,-0.2 0.931 110.6 46.9 -57.0 -46.8 -9.1 -9.3 -27.5 66 13 B R H X S+ 0 0 78 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.862 111.1 51.5 -68.3 -35.5 -9.5 -9.4 -23.7 67 14 B I H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.948 113.4 43.9 -65.5 -47.1 -12.9 -7.6 -24.0 68 15 B C H X S+ 0 0 14 -4,-2.7 4,-2.8 2,-0.2 -2,-0.2 0.907 112.1 53.1 -64.5 -40.7 -14.2 -10.1 -26.5 69 16 B D H X S+ 0 0 69 -4,-2.8 4,-2.0 -5,-0.2 -1,-0.2 0.900 108.6 50.8 -61.8 -39.8 -12.7 -13.0 -24.5 70 17 B Y H X S+ 0 0 16 -4,-2.3 4,-2.4 1,-0.2 5,-0.3 0.927 113.1 45.2 -60.1 -45.4 -14.6 -11.7 -21.5 71 18 B L H X S+ 0 0 1 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.860 110.3 54.1 -67.5 -36.0 -17.8 -11.5 -23.5 72 19 B R H < S+ 0 0 155 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.882 115.9 40.0 -64.9 -37.0 -17.2 -15.0 -25.0 73 20 B R H < S+ 0 0 130 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.835 130.9 23.7 -79.7 -35.7 -16.9 -16.4 -21.5 74 21 B H H < S- 0 0 93 -4,-2.4 -3,-0.2 1,-0.2 -2,-0.2 0.612 85.4-155.2-111.7 -17.1 -19.6 -14.4 -19.7 75 22 B G < + 0 0 18 -4,-2.7 -1,-0.2 -5,-0.3 43,-0.1 -0.449 65.1 33.2 71.9-146.8 -22.2 -13.4 -22.4 76 23 B R S S+ 0 0 159 -2,-0.1 2,-0.3 41,-0.1 43,-0.2 -0.123 77.0 158.4 -47.2 127.7 -24.4 -10.3 -21.7 77 24 B S B -C 118 0B 5 41,-1.9 41,-3.8 4,-0.0 2,-0.2 -0.997 37.3-131.9-154.2 147.2 -22.5 -7.7 -19.7 78 25 B T > - 0 0 22 -2,-0.3 4,-1.6 39,-0.2 3,-0.3 -0.537 43.5-101.0 -88.9 169.9 -22.4 -4.0 -18.8 79 26 B V H > S+ 0 0 13 37,-0.4 4,-3.1 1,-0.2 5,-0.3 0.847 121.6 65.3 -58.2 -32.2 -19.1 -2.0 -18.9 80 27 B Q H > S+ 0 0 42 1,-0.2 4,-1.9 2,-0.2 5,-0.3 0.924 100.9 45.1 -54.0 -54.7 -19.1 -2.5 -15.1 81 28 B D H > S+ 0 0 73 -3,-0.3 4,-1.6 1,-0.2 -1,-0.2 0.922 117.4 47.1 -58.4 -44.1 -18.7 -6.3 -15.2 82 29 B I H X S+ 0 0 0 -4,-1.6 4,-2.9 1,-0.2 5,-0.2 0.958 113.1 42.6 -67.3 -54.4 -16.0 -6.0 -17.9 83 30 B F H X>S+ 0 0 45 -4,-3.1 5,-1.6 1,-0.2 4,-1.2 0.846 113.3 52.7 -68.7 -30.8 -13.8 -3.3 -16.5 84 31 B K H <5S+ 0 0 132 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.880 115.3 41.5 -70.2 -36.8 -13.8 -4.6 -13.0 85 32 B E H <5S+ 0 0 108 -4,-1.6 -2,-0.2 -5,-0.3 -1,-0.2 0.918 118.3 43.8 -75.3 -43.7 -12.8 -8.0 -14.1 86 33 B L H <5S- 0 0 15 -4,-2.9 -2,-0.2 -5,-0.2 -1,-0.2 0.657 102.8-128.9 -77.5 -13.7 -10.2 -6.9 -16.6 87 34 B K T <5 + 0 0 135 -4,-1.2 2,-0.3 1,-0.2 -3,-0.2 0.959 64.9 128.6 58.5 53.5 -8.7 -4.3 -14.3 88 35 B L < - 0 0 36 -5,-1.6 -1,-0.2 -6,-0.1 2,-0.1 -0.868 68.0 -87.8-126.5 162.7 -8.9 -1.6 -17.0 89 36 B E > - 0 0 138 -2,-0.3 4,-2.1 1,-0.1 5,-0.2 -0.464 32.7-124.2 -69.0 145.2 -10.5 1.9 -16.8 90 37 B K H > S+ 0 0 94 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.874 112.7 53.6 -52.5 -42.6 -14.2 2.0 -17.7 91 38 B S H > S+ 0 0 65 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.885 105.4 52.0 -64.4 -40.9 -13.4 4.6 -20.4 92 39 B T H > S+ 0 0 33 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.934 113.3 45.7 -60.0 -44.4 -10.8 2.4 -22.0 93 40 B V H X S+ 0 0 0 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.920 112.7 49.0 -67.2 -44.9 -13.4 -0.4 -22.1 94 41 B N H X S+ 0 0 39 -4,-2.7 4,-2.8 2,-0.2 5,-0.3 0.880 106.5 57.3 -60.9 -42.7 -16.2 1.8 -23.4 95 42 B R H X S+ 0 0 153 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.938 113.5 39.1 -50.1 -51.1 -13.9 3.2 -26.2 96 43 B H H X S+ 0 0 20 -4,-1.7 4,-3.4 2,-0.2 5,-0.2 0.858 112.0 57.1 -75.6 -33.0 -13.3 -0.3 -27.5 97 44 B L H X S+ 0 0 0 -4,-2.6 4,-1.8 2,-0.2 -2,-0.2 0.945 111.9 41.9 -57.8 -48.6 -16.9 -1.5 -27.0 98 45 B Y H X S+ 0 0 101 -4,-2.8 4,-1.9 2,-0.2 -2,-0.2 0.874 115.4 51.0 -72.2 -31.8 -18.2 1.4 -29.1 99 46 B S H X S+ 0 0 59 -4,-1.9 4,-1.6 -5,-0.3 -2,-0.2 0.930 111.6 47.3 -64.2 -45.9 -15.4 0.8 -31.6 100 47 B L H <>S+ 0 0 0 -4,-3.4 5,-2.8 1,-0.2 6,-1.2 0.786 108.2 56.5 -66.4 -28.6 -16.2 -2.9 -31.8 101 48 B Q H ><5S+ 0 0 49 -4,-1.8 3,-1.8 -5,-0.2 -1,-0.2 0.937 104.6 52.5 -66.9 -44.0 -19.9 -2.0 -32.2 102 49 B A H 3<5S+ 0 0 82 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.873 109.5 48.3 -59.0 -40.0 -19.0 0.0 -35.2 103 50 B S T 3<5S- 0 0 68 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.156 116.4-115.3 -89.5 20.3 -17.1 -2.9 -36.8 104 51 B K T < 5S+ 0 0 160 -3,-1.8 -3,-0.2 2,-0.1 -2,-0.1 0.790 84.4 116.4 54.5 37.0 -20.1 -5.3 -36.1 105 52 B Q S - 0 0 58 -2,-0.4 3,-1.6 4,-0.3 -2,-0.0 -0.726 53.7 -80.3 -81.1 144.0 -33.4 -0.1 -21.8 112 59 B D T 3 S+ 0 0 147 -2,-0.3 -1,-0.1 1,-0.3 3,-0.1 -0.152 113.8 2.3 -48.6 130.8 -34.3 3.6 -21.3 113 60 B N T 3 S+ 0 0 111 1,-0.2 2,-0.3 -3,-0.1 -1,-0.3 0.780 110.8 110.9 60.7 30.5 -32.2 5.2 -18.6 114 61 B K S < S- 0 0 124 -3,-1.6 -1,-0.2 3,-0.0 3,-0.1 -0.928 77.9 -87.9-131.3 158.1 -30.2 2.1 -18.0 115 62 B R - 0 0 161 -2,-0.3 -4,-0.3 1,-0.1 -6,-0.1 -0.400 52.5-106.1 -60.5 132.4 -26.6 0.9 -18.6 116 63 B P - 0 0 35 0, 0.0 2,-0.4 0, 0.0 -37,-0.4 -0.357 30.0-139.6 -58.4 141.1 -26.1 -0.6 -22.0 117 64 B V E - D 0 109B 26 -8,-2.9 -8,-2.3 -39,-0.1 2,-0.3 -0.922 20.9-156.2-107.1 132.5 -25.7 -4.4 -22.0 118 65 B W E +CD 77 108B 3 -41,-3.8 -41,-1.9 -2,-0.4 2,-0.3 -0.806 18.8 162.0-116.0 148.8 -23.1 -5.8 -24.4 119 66 B N E - D 0 107B 38 -12,-2.1 -12,-2.7 -2,-0.3 2,-0.1 -0.984 42.3 -88.8-154.4 160.8 -22.5 -9.1 -26.1 120 67 B L E - D 0 106B 11 -2,-0.3 -14,-0.3 -14,-0.2 -15,-0.1 -0.409 27.0-136.4 -63.7 143.1 -20.6 -10.7 -29.0 121 68 B V 0 0 80 -16,-2.4 -15,-0.1 1,-0.2 -1,-0.1 0.899 360.0 360.0 -65.6 -41.6 -22.3 -10.7 -32.4 122 69 B E 0 0 125 -17,-0.5 -1,-0.2 -3,-0.0 -2,-0.1 -0.466 360.0 360.0 -68.5 360.0 -21.1 -14.3 -32.9