==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-JAN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DNA BINDING PROTEIN/DNA 07-JAN-12 3VEA . COMPND 2 MOLECULE: MACRODOMAIN TER PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: YERSINIA PESTIS; . AUTHOR M.A.SCHUMACHER . 298 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20289.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 245 82.2 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 . 12 4.0 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 . 9 3.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 186 62.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.7 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 1 3 0 1 2 0 0 1 1 0 3 0 0 0 0 0 0 0 0 0 1 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 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 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 14 B M 0 0 207 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 125.5 6.5 28.2 -7.5 2 15 B K + 0 0 163 1,-0.2 0, 0.0 2,-0.0 0, 0.0 0.656 360.0 54.9-120.3 -71.2 9.3 30.1 -5.7 3 16 B Y S S- 0 0 53 1,-0.1 2,-0.3 2,-0.0 -1,-0.2 -0.242 83.3-109.5 -69.2 159.9 11.7 32.1 -7.9 4 17 B Q - 0 0 130 74,-0.1 2,-0.9 -3,-0.1 -1,-0.1 -0.695 22.4-127.4 -92.4 149.5 10.4 34.8 -10.3 5 18 B Q - 0 0 100 -2,-0.3 2,-1.5 1,-0.0 3,-0.1 -0.765 14.9-160.6-102.2 99.0 10.4 34.3 -14.1 6 19 B L >> - 0 0 65 -2,-0.9 4,-2.6 1,-0.2 3,-0.9 -0.658 5.1-162.3 -77.3 85.1 12.2 37.2 -15.8 7 20 B E H 3> S+ 0 0 159 -2,-1.5 4,-0.7 1,-0.2 -1,-0.2 0.682 86.2 54.3 -37.4 -39.4 10.8 36.8 -19.3 8 21 B N H 3> S+ 0 0 127 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.928 116.8 34.8 -65.9 -43.1 13.5 39.0 -20.8 9 22 B L H <> S+ 0 0 45 -3,-0.9 4,-1.9 1,-0.2 -2,-0.2 0.918 116.0 53.1 -79.3 -49.8 16.4 37.0 -19.3 10 23 B E H X S+ 0 0 15 -4,-2.6 4,-1.3 1,-0.2 -1,-0.2 0.688 105.5 57.6 -66.0 -13.9 14.9 33.6 -19.5 11 24 B S H X S+ 0 0 7 -4,-0.7 4,-1.5 -5,-0.4 -1,-0.2 0.928 104.7 48.0 -84.6 -44.7 14.2 34.2 -23.2 12 25 B G H X S+ 0 0 32 -4,-1.4 4,-3.2 1,-0.2 5,-0.2 0.845 109.8 55.2 -62.4 -32.8 17.9 34.9 -24.1 13 26 B W H X S+ 0 0 40 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.940 107.4 48.9 -60.9 -48.0 18.8 31.7 -22.1 14 27 B K H X S+ 0 0 46 -4,-1.3 4,-0.9 1,-0.2 -1,-0.2 0.803 113.9 48.0 -62.1 -28.9 16.3 29.8 -24.3 15 28 B W H >X S+ 0 0 30 -4,-1.5 4,-2.3 2,-0.2 3,-0.9 0.949 108.3 50.6 -78.6 -50.4 17.9 31.3 -27.3 16 29 B A H 3X S+ 0 0 56 -4,-3.2 4,-1.1 1,-0.3 -2,-0.2 0.791 110.6 54.0 -56.4 -28.6 21.6 30.7 -26.3 17 30 B Y H 3X S+ 0 0 23 -4,-1.7 4,-2.0 -5,-0.2 -1,-0.3 0.781 109.4 45.7 -76.6 -32.4 20.5 27.1 -25.7 18 31 B L H S+ 0 0 29 -4,-2.0 5,-1.1 1,-0.2 4,-0.2 0.874 115.4 49.0 -54.6 -34.1 22.4 22.9 -29.5 22 35 B H H ><5S+ 0 0 68 -4,-2.4 3,-1.0 1,-0.2 -1,-0.2 0.877 107.7 51.0 -76.6 -33.5 22.3 23.7 -33.2 23 36 B R H 3<5S+ 0 0 144 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.645 107.6 57.1 -75.2 -11.8 26.0 24.5 -33.5 24 37 B E T 3<5S- 0 0 76 -4,-1.3 -1,-0.2 -3,-0.1 -2,-0.2 0.444 125.4-101.0 -93.2 -5.7 26.6 21.2 -31.8 25 38 B G T < 5S+ 0 0 68 -3,-1.0 2,-0.3 1,-0.2 -3,-0.2 0.934 72.8 136.4 86.8 53.1 24.7 19.3 -34.5 26 39 B E < - 0 0 71 -5,-1.1 2,-1.6 -4,-0.1 -1,-0.2 -0.886 62.7 -96.6-128.1 162.1 21.3 18.6 -33.0 27 40 B A + 0 0 58 -2,-0.3 39,-0.3 1,-0.2 36,-0.2 -0.568 44.9 164.0 -85.3 89.2 17.6 18.8 -34.4 28 41 B I + 0 0 6 -2,-1.6 35,-4.1 34,-0.1 -1,-0.2 0.985 61.5 60.8 -63.4 -50.0 16.4 22.1 -33.1 29 42 B T B S-A 62 0A 11 33,-0.3 33,-0.2 -3,-0.2 8,-0.1 -0.149 74.6-138.5 -78.6 164.7 13.5 22.0 -35.6 30 43 B R S S+ 0 0 126 31,-1.3 2,-0.6 33,-0.1 32,-0.1 0.140 70.8 106.2-113.0 29.1 10.7 19.6 -35.8 31 44 B H - 0 0 55 30,-0.2 6,-0.2 1,-0.1 -2,-0.1 -0.916 54.6-159.6-110.1 112.0 10.7 19.4 -39.7 32 45 B I S S+ 0 0 165 -2,-0.6 2,-0.3 4,-0.1 -1,-0.1 0.808 74.9 86.3 -57.0 -32.7 12.1 16.2 -41.1 33 46 B E S > S- 0 0 128 1,-0.1 4,-2.2 -3,-0.1 5,-0.2 -0.549 76.4-144.1 -72.3 128.7 12.6 18.1 -44.4 34 47 B N H > S+ 0 0 137 -2,-0.3 4,-1.4 1,-0.2 -1,-0.1 0.632 98.7 64.4 -67.1 -11.8 15.9 19.9 -44.5 35 48 B S H > S+ 0 0 70 2,-0.2 4,-1.6 3,-0.2 -1,-0.2 0.988 110.8 29.4 -72.4 -63.7 14.0 22.6 -46.4 36 49 B A H > S+ 0 0 41 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.835 122.4 54.4 -64.4 -37.8 11.6 23.7 -43.7 37 50 B A H >X S+ 0 0 13 -4,-2.2 4,-2.3 -6,-0.2 3,-0.7 0.985 111.1 42.2 -61.4 -60.1 14.1 22.8 -41.0 38 51 B Q H 3X S+ 0 0 91 -4,-1.4 4,-1.6 1,-0.2 -1,-0.2 0.821 109.5 62.0 -58.3 -29.7 16.9 25.0 -42.4 39 52 B D H 3X S+ 0 0 90 -4,-1.6 4,-1.0 1,-0.2 -1,-0.2 0.908 108.1 41.5 -61.2 -43.3 14.3 27.6 -43.1 40 53 B A H < S+ 0 0 106 -4,-1.6 3,-0.8 -5,-0.2 -1,-0.2 0.906 109.9 47.0 -63.6 -40.8 18.0 30.9 -40.2 43 56 B Q H >X S+ 0 0 73 -4,-1.0 3,-2.7 -3,-0.4 4,-0.8 0.954 105.6 57.8 -65.5 -50.1 15.1 32.9 -38.6 44 57 B L T 3< S+ 0 0 3 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.626 97.2 68.1 -57.6 -9.0 16.1 31.8 -35.1 45 58 B M T <4 S+ 0 0 77 -3,-0.8 -1,-0.3 -4,-0.4 -2,-0.2 0.585 102.4 41.3 -88.0 -10.0 19.5 33.3 -35.9 46 59 B K T <4 S+ 0 0 146 -3,-2.7 3,-0.4 -4,-0.2 -2,-0.2 0.467 88.2 87.1-113.2 -1.2 18.2 36.9 -35.9 47 60 B L >< + 0 0 14 -4,-0.8 3,-1.8 1,-0.2 7,-0.2 0.364 53.9 137.0 -84.3 11.2 15.9 36.6 -32.9 48 61 B E T 3 S+ 0 0 95 1,-0.2 -1,-0.2 -3,-0.1 -33,-0.1 0.698 83.9 3.5 -9.6 -70.7 19.0 37.5 -30.9 49 62 B N T 3 S+ 0 0 136 -3,-0.4 -1,-0.2 1,-0.1 3,-0.2 0.010 103.9 103.7-121.2 29.3 17.3 40.1 -28.5 50 63 B E X> + 0 0 81 -3,-1.8 4,-2.5 1,-0.2 3,-1.6 -0.623 36.9 167.0-111.3 71.0 13.7 39.8 -29.7 51 64 B P H 3> S+ 0 0 30 0, 0.0 4,-1.7 0, 0.0 5,-0.2 0.795 73.9 64.6 -51.6 -35.7 12.2 37.7 -26.8 52 65 B V H 34 S+ 0 0 117 1,-0.2 4,-0.4 2,-0.2 -2,-0.1 0.891 113.9 33.8 -55.6 -39.0 8.7 38.5 -28.1 53 66 B K H X> S+ 0 0 90 -3,-1.6 4,-1.8 2,-0.2 3,-0.8 0.860 105.2 69.6 -83.3 -44.7 9.7 36.6 -31.2 54 67 B V H 3X S+ 0 0 2 -4,-2.5 4,-1.6 1,-0.3 3,-0.3 0.874 101.6 48.4 -43.3 -48.2 12.0 33.9 -29.7 55 68 B Q H 3X S+ 0 0 78 -4,-1.7 4,-2.5 1,-0.2 -1,-0.3 0.845 103.9 60.3 -64.0 -35.4 8.9 32.3 -28.0 56 69 B E H <> S+ 0 0 113 -3,-0.8 4,-2.5 -4,-0.4 5,-0.3 0.878 103.4 52.9 -58.8 -38.3 7.0 32.4 -31.3 57 70 B W H X>S+ 0 0 4 -4,-1.8 4,-5.1 -3,-0.3 5,-0.6 0.961 108.2 47.9 -62.7 -53.0 9.8 30.2 -32.7 58 71 B I H X5S+ 0 0 25 -4,-1.6 4,-1.1 1,-0.2 -2,-0.2 0.918 112.9 48.7 -53.3 -50.2 9.5 27.6 -30.0 59 72 B D H <5S+ 0 0 122 -4,-2.5 -1,-0.2 1,-0.1 -2,-0.2 0.922 128.5 25.5 -57.1 -43.7 5.7 27.5 -30.3 60 73 B A H <5S+ 0 0 45 -4,-2.5 -2,-0.2 -5,-0.2 -3,-0.2 0.899 133.2 23.8 -94.2 -43.6 6.1 27.2 -34.1 61 74 B H H <5S+ 0 0 43 -4,-5.1 -31,-1.3 -5,-0.3 2,-0.2 0.599 83.9 121.5-105.0 1.1 9.5 25.6 -35.0 62 75 B M B << -A 29 0A 4 -4,-1.1 -33,-0.3 -5,-0.6 -34,-0.1 -0.430 61.5-115.7 -79.7 130.7 10.9 23.5 -31.9 63 76 B N > - 0 0 40 -35,-4.1 4,-1.9 -2,-0.2 -33,-0.1 -0.240 25.8-130.3 -58.4 128.4 11.8 19.6 -31.8 64 77 B V H >> S+ 0 0 115 1,-0.2 4,-1.3 2,-0.2 3,-0.6 0.936 104.1 47.0 -45.7 -58.9 9.4 17.8 -29.5 65 78 B N H 3> S+ 0 0 91 1,-0.3 4,-1.4 2,-0.2 -1,-0.2 0.878 110.3 51.4 -52.6 -49.4 12.2 16.0 -27.6 66 79 B L H 3> S+ 0 0 2 -39,-0.3 4,-3.1 1,-0.2 -1,-0.3 0.823 102.3 63.7 -60.2 -32.2 14.4 19.1 -27.2 67 80 B A H < S+ 0 0 28 -4,-1.8 3,-1.1 1,-0.2 -1,-0.2 0.698 112.2 61.6 -81.2 -25.5 18.8 33.2 -7.7 83 96 B N H >< S+ 0 0 17 -4,-1.9 3,-1.1 -5,-0.3 6,-0.3 0.779 92.7 68.2 -74.2 -20.8 20.6 30.8 -5.4 84 97 B A T 3< S+ 0 0 62 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.1 0.288 83.3 75.0 -80.8 11.6 23.9 32.5 -6.3 85 98 B E T < S+ 0 0 113 -3,-1.1 2,-0.3 1,-0.3 -1,-0.2 0.536 102.6 30.5 -99.0 -10.3 22.9 35.6 -4.5 86 99 B H S X> S- 0 0 108 -3,-1.1 3,-1.3 -4,-0.1 4,-0.5 -0.982 73.7-135.4-148.4 134.7 23.4 34.3 -1.0 87 100 B Q G >4 S+ 0 0 119 -2,-0.3 3,-1.8 1,-0.3 161,-0.3 0.899 100.2 62.6 -60.0 -45.1 25.9 31.7 0.2 88 101 B H G 34 S+ 0 0 131 1,-0.3 -1,-0.3 160,-0.1 159,-0.0 0.261 108.2 46.0 -68.0 16.8 23.6 29.6 2.3 89 102 B T G <4 S+ 0 0 37 -3,-1.3 -1,-0.3 -6,-0.3 -2,-0.2 0.345 95.5 94.7-130.5 -12.2 21.6 28.8 -0.8 90 103 B R << - 0 0 92 -3,-1.8 158,-2.2 -4,-0.5 2,-0.3 -0.310 66.5-135.7 -75.9 168.1 24.5 28.0 -3.1 91 104 B K E -B 247 0B 84 156,-0.2 2,-0.5 157,-0.1 156,-0.2 -0.926 5.4-140.2-126.6 147.6 25.8 24.5 -3.7 92 105 B K E -B 246 0B 59 154,-3.4 154,-2.2 -2,-0.3 2,-0.5 -0.947 12.1-142.8-113.5 127.3 29.4 23.1 -3.7 93 106 B S E +B 245 0B 91 -2,-0.5 2,-0.3 152,-0.2 152,-0.2 -0.738 30.2 161.4 -87.3 125.4 30.5 20.5 -6.3 94 107 B I E -B 244 0B 14 150,-2.5 150,-1.9 -2,-0.5 2,-0.4 -0.822 31.0-132.0-130.7 176.4 33.0 17.9 -5.1 95 108 B D E -B 243 0B 90 -2,-0.3 2,-0.3 148,-0.2 148,-0.2 -0.990 17.7-166.3-129.0 130.0 34.1 14.5 -6.2 96 109 B L E -B 242 0B 2 146,-3.1 146,-3.9 -2,-0.4 2,-0.1 -0.822 33.7 -99.4-111.4 162.8 34.3 11.6 -4.0 97 110 B E E >> -B 241 0B 75 -2,-0.3 4,-2.6 144,-0.2 3,-0.7 -0.530 43.2-111.0 -71.2 148.3 36.1 8.3 -4.7 98 111 B F H 3> S+ 0 0 10 142,-2.8 4,-2.4 1,-0.3 5,-0.2 0.909 114.2 45.7 -48.0 -59.7 33.6 5.7 -5.8 99 112 B L H 3> S+ 0 0 73 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.761 113.6 50.9 -56.3 -31.4 33.7 3.4 -2.8 100 113 B V H <> S+ 0 0 7 -3,-0.7 4,-1.9 2,-0.2 -1,-0.2 0.888 109.7 48.8 -75.0 -42.8 33.6 6.3 -0.4 101 114 B W H X S+ 0 0 53 -4,-2.6 4,-3.2 1,-0.2 -2,-0.2 0.892 109.6 55.5 -60.6 -38.9 30.5 7.8 -2.2 102 115 B Q H X S+ 0 0 73 -4,-2.4 4,-3.0 -5,-0.3 -2,-0.2 0.937 105.9 48.4 -63.1 -45.1 28.9 4.3 -2.0 103 116 B R H X S+ 0 0 97 -4,-1.6 4,-2.0 2,-0.2 -1,-0.2 0.907 114.8 47.4 -61.4 -35.2 29.3 4.0 1.7 104 117 B L H X S+ 0 0 0 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.925 112.3 49.0 -72.9 -42.7 27.8 7.6 2.0 105 118 B A H X S+ 0 0 8 -4,-3.2 4,-2.5 2,-0.2 5,-0.4 0.915 106.2 56.7 -62.0 -42.0 25.0 6.8 -0.3 106 119 B V H X S+ 0 0 43 -4,-3.0 4,-2.4 -5,-0.2 -2,-0.2 0.976 109.8 45.5 -57.2 -51.9 24.2 3.6 1.6 107 120 B L H X S+ 0 0 24 -4,-2.0 4,-2.6 1,-0.2 6,-0.3 0.938 112.9 49.3 -55.3 -51.0 23.8 5.5 4.8 108 121 B A H X>S+ 0 0 7 -4,-2.3 4,-1.3 1,-0.2 5,-1.0 0.942 112.6 45.7 -54.7 -57.1 21.6 8.2 3.2 109 122 B R H <5S+ 0 0 171 -4,-2.5 3,-0.4 1,-0.2 -1,-0.2 0.894 111.3 55.9 -53.3 -42.8 19.2 5.8 1.4 110 123 B R H <5S+ 0 0 180 -4,-2.4 -1,-0.2 -5,-0.4 -2,-0.2 0.961 117.0 32.9 -55.7 -54.5 19.0 3.9 4.6 111 124 B R H <5S- 0 0 90 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.470 105.2-123.9 -84.7 -1.8 17.9 6.9 6.7 112 125 B G T <5 + 0 0 68 -4,-1.3 -3,-0.2 -3,-0.4 -4,-0.1 0.506 69.2 129.2 74.2 2.4 16.0 8.6 3.9 113 126 B N < - 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