==== 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 4LB6 . COMPND 2 MOLECULE: PROTEIN KINASE CONTAINING Z-DNA BINDING DOMAINS; . SOURCE 2 ORGANISM_SCIENTIFIC: DANIO RERIO; . AUTHOR M.DE ROSA,S.ZACARIAS,A.ATHANASIADIS . 63 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 4516.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 41 65.1 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 11.1 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 3.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 29 46.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 3.2 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 1 0 0 0 0 1 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 . 1 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 7 B E > 0 0 149 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 133.1 -7.3 20.7 28.3 2 8 B N H > + 0 0 132 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.826 360.0 61.2 -61.4 -30.6 -4.5 23.1 28.5 3 9 B E H > S+ 0 0 105 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.907 103.4 46.3 -66.7 -44.2 -3.8 21.8 25.0 4 10 B I H > S+ 0 0 24 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.936 114.7 48.0 -59.2 -46.3 -7.2 23.0 23.7 5 11 B E H X S+ 0 0 37 -4,-2.1 4,-2.4 1,-0.2 5,-0.2 0.913 111.4 49.6 -68.3 -39.5 -6.7 26.3 25.3 6 12 B M H X S+ 0 0 120 -4,-2.8 4,-2.4 2,-0.2 -1,-0.2 0.915 111.6 50.0 -59.3 -43.3 -3.1 26.6 23.9 7 13 B R H X S+ 0 0 84 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.887 111.4 48.1 -66.5 -36.3 -4.5 25.7 20.4 8 14 B I H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.942 113.6 46.4 -66.1 -45.4 -7.2 28.3 20.6 9 15 B C H X S+ 0 0 24 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.855 110.6 53.5 -68.8 -33.0 -4.9 31.0 21.8 10 16 B D H X S+ 0 0 58 -4,-2.4 4,-2.0 -5,-0.2 -1,-0.2 0.894 106.7 52.2 -69.5 -37.9 -2.4 30.1 19.1 11 17 B Y H X S+ 0 0 12 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.953 111.8 46.2 -57.0 -49.9 -5.1 30.4 16.5 12 18 B L H X S+ 0 0 1 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.875 108.2 57.1 -62.7 -38.4 -5.9 33.9 17.8 13 19 B R H < S+ 0 0 159 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.925 116.0 35.9 -57.2 -43.8 -2.2 34.8 17.8 14 20 B R H < S+ 0 0 107 -4,-2.0 -2,-0.2 1,-0.1 -1,-0.2 0.779 129.8 30.7 -80.7 -29.6 -1.9 34.0 14.1 15 21 B H H < S- 0 0 90 -4,-2.5 -3,-0.2 1,-0.2 -2,-0.2 0.617 85.2-154.7-107.8 -12.7 -5.2 35.2 12.9 16 22 B G < + 0 0 22 -4,-2.5 -1,-0.2 -5,-0.2 43,-0.1 -0.331 67.0 27.2 62.8-152.2 -6.3 38.1 15.2 17 23 B R S S+ 0 0 144 41,-0.1 2,-0.3 44,-0.1 43,-0.2 -0.092 79.6 161.8 -45.9 123.7 -10.0 38.8 15.6 18 24 B S B -A 59 0A 3 41,-2.0 41,-3.7 4,-0.0 2,-0.2 -0.983 35.4-128.4-146.7 152.9 -11.9 35.6 15.0 19 25 B T > - 0 0 19 -2,-0.3 4,-1.6 39,-0.2 39,-0.1 -0.560 36.8-107.6 -92.4 164.2 -15.4 34.1 15.6 20 26 B V H > S+ 0 0 8 37,-0.4 4,-3.0 1,-0.2 5,-0.3 0.843 121.2 60.4 -58.7 -31.9 -15.8 30.7 17.2 21 27 B Q H > S+ 0 0 33 1,-0.2 4,-1.6 2,-0.2 5,-0.3 0.951 102.6 51.2 -64.7 -43.5 -16.8 29.4 13.8 22 28 B D H > S+ 0 0 72 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.907 115.5 42.8 -47.5 -50.7 -13.4 30.3 12.5 23 29 B I H X S+ 0 0 0 -4,-1.6 4,-2.7 1,-0.2 5,-0.2 0.944 110.6 50.3 -75.6 -48.1 -11.6 28.5 15.3 24 30 B F H X>S+ 0 0 53 -4,-3.0 5,-1.4 1,-0.2 4,-0.9 0.847 109.5 50.8 -67.2 -31.4 -13.6 25.3 15.6 25 31 B K H <5S+ 0 0 148 -4,-1.6 -1,-0.2 -5,-0.3 -2,-0.2 0.901 114.4 43.4 -71.6 -37.3 -13.4 24.4 11.9 26 32 B E H <5S+ 0 0 101 -4,-1.1 -2,-0.2 -5,-0.3 -1,-0.2 0.931 120.6 40.9 -71.5 -42.4 -9.6 24.9 11.8 27 33 B L H <5S- 0 0 13 -4,-2.7 -1,-0.2 -5,-0.1 -2,-0.2 0.552 103.2-131.4 -81.3 -10.2 -9.0 23.1 15.1 28 34 B K T <5 + 0 0 188 -4,-0.9 2,-0.3 -5,-0.2 -3,-0.2 0.941 62.1 129.5 52.6 53.0 -11.6 20.3 14.3 29 35 B L < - 0 0 40 -5,-1.4 2,-0.2 -6,-0.1 -1,-0.2 -0.800 68.1 -86.4-121.4 166.5 -13.2 20.7 17.8 30 36 B E > - 0 0 141 -2,-0.3 4,-2.1 1,-0.1 3,-0.3 -0.564 34.1-125.9 -69.2 147.4 -16.9 21.1 18.7 31 37 B K H > S+ 0 0 93 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.912 111.8 54.7 -56.7 -44.1 -18.1 24.7 18.6 32 38 B S H > S+ 0 0 63 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.868 106.7 51.0 -64.6 -35.6 -19.4 24.3 22.2 33 39 B T H > S+ 0 0 33 -3,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.913 112.0 46.3 -66.9 -42.7 -16.0 23.1 23.4 34 40 B V H X S+ 0 0 0 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.946 113.8 48.5 -65.6 -43.2 -14.2 26.0 21.8 35 41 B N H X S+ 0 0 36 -4,-3.1 4,-2.6 2,-0.2 5,-0.3 0.904 107.2 55.6 -61.9 -41.3 -16.8 28.4 23.3 36 42 B R H X S+ 0 0 148 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.948 113.6 42.3 -53.9 -48.1 -16.5 26.9 26.8 37 43 B H H X S+ 0 0 24 -4,-1.9 4,-2.6 2,-0.2 -1,-0.2 0.849 110.8 54.2 -70.7 -34.5 -12.8 27.6 26.6 38 44 B L H X S+ 0 0 0 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.939 111.0 46.3 -62.5 -45.1 -13.1 31.1 25.1 39 45 B Y H X S+ 0 0 96 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.922 114.0 49.1 -64.5 -42.5 -15.4 32.1 27.9 40 46 B S H X S+ 0 0 57 -4,-2.3 4,-1.3 -5,-0.3 -1,-0.2 0.890 111.9 47.8 -59.8 -43.0 -13.0 30.5 30.5 41 47 B L H <>S+ 0 0 0 -4,-2.6 5,-2.7 2,-0.2 6,-1.0 0.786 109.2 54.4 -68.2 -30.4 -10.0 32.3 28.9 42 48 B Q H ><5S+ 0 0 55 -4,-2.1 3,-1.7 4,-0.2 -2,-0.2 0.903 105.6 52.3 -66.8 -38.9 -12.0 35.6 28.9 43 49 B A H 3<5S+ 0 0 83 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.853 109.7 50.6 -67.4 -29.1 -12.6 35.1 32.7 44 50 B S T 3<5S- 0 0 57 -4,-1.3 -1,-0.3 -5,-0.1 -2,-0.2 0.196 115.7-116.2 -96.0 17.4 -8.8 34.7 33.1 45 51 B K T < 5S+ 0 0 172 -3,-1.7 -3,-0.2 2,-0.2 -2,-0.1 0.714 85.1 114.7 56.2 29.7 -8.0 37.8 31.1 46 52 B Q S - 0 0 114 -2,-0.3 3,-2.4 3,-0.1 -2,-0.0 -0.971 61.2 -53.2-142.7 120.0 -22.5 44.2 18.7 53 59 B D T 3 S- 0 0 146 -2,-0.4 -1,-0.1 1,-0.3 0, 0.0 -0.133 115.0 -26.0 49.0-130.9 -26.3 43.5 18.7 54 60 B N T 3 S+ 0 0 175 -3,-0.1 -1,-0.3 2,-0.0 -3,-0.0 0.215 104.9 129.5 -95.3 16.5 -27.0 39.8 17.9 55 61 B K S < S- 0 0 119 -3,-2.4 -3,-0.1 1,-0.2 3,-0.1 -0.123 72.8 -83.3 -68.9 162.7 -23.7 39.4 15.9 56 62 B R - 0 0 138 -5,-0.1 -1,-0.2 1,-0.1 -4,-0.1 -0.523 51.3-114.7 -60.1 128.4 -21.2 36.7 16.4 57 63 B P - 0 0 39 0, 0.0 2,-0.5 0, 0.0 -37,-0.4 -0.314 28.6-138.9 -59.1 149.9 -18.9 37.7 19.2 58 64 B V E - B 0 50A 24 -8,-2.1 -8,-1.7 -39,-0.1 2,-0.3 -0.986 16.8-154.2-119.1 131.4 -15.4 38.3 17.9 59 65 B W E +AB 18 49A 1 -41,-3.7 -41,-2.0 -2,-0.5 2,-0.3 -0.721 19.2 160.3-109.0 148.0 -12.5 37.1 20.0 60 66 B N E - B 0 48A 40 -12,-1.8 -12,-2.6 -2,-0.3 2,-0.2 -0.976 42.7 -84.6-152.5 168.4 -8.9 38.2 20.3 61 67 B L E - B 0 47A 49 -2,-0.3 -14,-0.3 -14,-0.2 2,-0.1 -0.505 46.2-110.7 -69.8 140.3 -5.9 38.0 22.6 62 68 B V 0 0 55 -16,-1.7 -1,-0.1 -2,-0.2 -20,-0.0 -0.500 360.0 360.0 -61.3 134.9 -5.6 40.5 25.4 63 69 B E 0 0 220 -2,-0.1 -2,-0.1 -3,-0.0 -17,-0.0 0.352 360.0 360.0 50.8 360.0 -2.7 43.0 24.8