==== 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 DNA BINDING PROTEIN/DNA 18-SEP-06 2IEF . COMPND 2 MOLECULE: 15-MER DNA; . SOURCE 2 SYNTHETIC: YES; . AUTHOR M.A.ABBANI,C.V.PAPAGIANNIS,M.D.SAM,D.CASCIO,R.C.JOHNSON,R.T. . 162 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12027.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 94 58.0 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 . 32 19.8 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 . 3 1.9 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 . 13 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 33 20.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.9 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 1 1 1 0 3 0 0 0 0 0 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 . 0 4 5 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 . 3 3 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 1 A M 0 0 172 0, 0.0 44,-0.5 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 154.0 37.3 51.6 15.5 2 2 A Y - 0 0 117 42,-0.1 2,-0.2 43,-0.1 42,-0.2 -0.972 360.0-131.4-110.2 144.5 35.1 49.3 13.6 3 3 A L E -A 43 0A 2 40,-2.3 40,-3.3 -2,-0.4 2,-0.1 -0.590 6.9-119.0 -98.2 151.6 32.0 48.4 15.5 4 4 A T E > -A 42 0A 35 -2,-0.2 4,-3.3 38,-0.2 5,-0.2 -0.340 38.1-103.7 -69.3 163.8 30.4 45.1 16.3 5 5 A L H > S+ 0 0 18 36,-0.6 4,-3.3 1,-0.2 5,-0.2 0.948 125.2 50.1 -50.6 -48.8 26.9 44.5 15.0 6 6 A Q H > S+ 0 0 130 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.896 112.8 45.2 -61.9 -41.6 25.6 45.1 18.5 7 7 A E H > S+ 0 0 85 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.909 114.2 48.6 -72.2 -41.4 27.6 48.3 18.9 8 8 A W H >X S+ 0 0 2 -4,-3.3 3,-1.6 1,-0.2 4,-0.7 0.955 111.4 49.8 -57.7 -52.0 26.6 49.6 15.5 9 9 A N H >< S+ 0 0 12 -4,-3.3 3,-0.6 1,-0.3 -1,-0.2 0.822 105.7 59.0 -57.3 -29.6 23.0 48.8 16.2 10 10 A A H 3< S+ 0 0 70 -4,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.627 103.2 50.8 -80.4 -14.9 23.2 50.6 19.5 11 11 A R H << S+ 0 0 151 -3,-1.6 -1,-0.2 -4,-0.6 -2,-0.2 0.567 87.8 102.0 -99.2 -10.9 24.2 53.9 17.9 12 12 A Q S << S- 0 0 51 -4,-0.7 36,-0.0 -3,-0.6 -3,-0.0 -0.359 86.1-110.8 -73.4 156.4 21.4 54.1 15.4 13 13 A R S S+ 0 0 131 1,-0.3 -1,-0.1 -2,-0.1 45,-0.1 0.823 112.6 24.0 -52.9 -44.2 18.4 56.3 16.0 14 14 A R S S- 0 0 80 -5,-0.0 -1,-0.3 0, 0.0 -3,-0.1 -0.802 83.0-152.6-129.2 92.1 16.2 53.2 16.5 15 15 A P - 0 0 71 0, 0.0 2,-0.2 0, 0.0 -5,-0.1 -0.350 18.9-169.2 -56.5 140.0 18.1 50.1 17.6 16 16 A R - 0 0 62 1,-0.2 2,-0.1 -7,-0.1 -4,-0.1 -0.535 34.0 -63.1-117.5-173.8 16.4 46.9 16.6 17 17 A S > - 0 0 65 -2,-0.2 4,-1.7 1,-0.1 -1,-0.2 -0.437 47.0-120.0 -64.7 150.2 16.8 43.2 17.4 18 18 A L H > S+ 0 0 51 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.849 113.9 59.8 -62.1 -33.3 20.1 41.7 16.3 19 19 A E H > S+ 0 0 82 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.939 103.7 49.6 -63.1 -44.3 18.3 39.4 14.0 20 20 A T H > S+ 0 0 32 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.922 109.5 51.9 -57.2 -44.4 16.7 42.2 12.1 21 21 A V H X S+ 0 0 0 -4,-1.7 4,-1.7 1,-0.2 -1,-0.2 0.876 108.2 51.0 -66.7 -34.8 20.1 43.9 11.7 22 22 A R H X S+ 0 0 99 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.894 105.4 55.8 -65.5 -41.7 21.6 40.7 10.3 23 23 A R H X S+ 0 0 121 -4,-2.2 4,-1.1 1,-0.2 -1,-0.2 0.819 106.2 53.3 -58.6 -33.4 18.7 40.5 7.8 24 24 A W H <>S+ 0 0 28 -4,-1.5 5,-2.5 2,-0.2 6,-0.4 0.900 107.2 49.4 -66.7 -45.5 19.7 43.9 6.7 25 25 A V H ><5S+ 0 0 19 -4,-1.7 3,-1.5 1,-0.2 -2,-0.2 0.925 109.2 51.7 -60.0 -47.0 23.3 42.8 6.1 26 26 A R H 3<5S+ 0 0 145 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.817 111.9 48.5 -56.2 -33.3 22.1 39.8 4.1 27 27 A E T 3<5S- 0 0 119 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.406 113.6-120.3 -92.0 0.6 20.0 42.2 2.0 28 28 A S T < 5S+ 0 0 77 -3,-1.5 -3,-0.2 -4,-0.3 -2,-0.1 0.665 70.2 136.8 73.6 20.3 23.0 44.7 1.5 29 29 A R < + 0 0 52 -5,-2.5 21,-3.8 -6,-0.2 2,-0.5 0.616 47.3 82.1 -79.9 -11.7 21.0 47.5 3.2 30 30 A I E S-C 49 0B 4 -6,-0.4 19,-0.2 19,-0.2 17,-0.1 -0.831 79.4-130.5 -97.5 126.3 24.0 48.6 5.3 31 31 A F E S+C 48 0B 135 17,-3.2 17,-2.8 -2,-0.5 -2,-0.0 -0.988 94.3 25.7-128.0 128.1 26.5 50.9 3.5 32 32 A P S S- 0 0 43 0, 0.0 12,-0.4 0, 0.0 -1,-0.2 0.698 106.7-122.5 -66.8 159.9 29.3 50.4 3.5 33 33 A P - 0 0 93 0, 0.0 -2,-0.1 0, 0.0 11,-0.1 -0.317 29.2-101.4 -71.6 147.6 28.7 46.7 4.1 34 34 A P - 0 0 19 0, 0.0 9,-0.2 0, 0.0 2,-0.2 -0.340 30.4-129.9 -69.3 148.9 30.2 45.0 7.1 35 35 A V E -B 42 0A 86 7,-2.2 7,-2.1 -2,-0.0 2,-0.5 -0.471 19.6-117.8 -90.0 166.5 33.3 42.9 6.9 36 36 A K E +B 41 0A 132 5,-0.2 2,-0.5 -2,-0.2 5,-0.2 -0.949 28.5 178.7-112.3 117.9 33.7 39.4 8.3 37 37 A D E > -B 40 0A 98 3,-2.3 3,-1.6 -2,-0.5 2,-0.4 -0.929 64.5 -58.7-121.0 109.3 36.2 38.8 11.0 38 38 A G T 3 S- 0 0 69 -2,-0.5 0, 0.0 1,-0.3 0, 0.0 -0.472 121.9 -13.1 52.9-109.1 36.2 35.2 12.3 39 39 A R T 3 S+ 0 0 239 -2,-0.4 -1,-0.3 -3,-0.1 2,-0.1 0.776 124.7 63.1 -86.2 -33.1 32.7 34.7 13.5 40 40 A E E < S- B 0 37A 104 -3,-1.6 -3,-2.3 1,-0.0 2,-0.3 -0.452 73.5-117.6-108.0 161.8 31.3 38.2 13.6 41 41 A Y E - B 0 36A 64 -5,-0.2 -36,-0.6 -2,-0.1 2,-0.4 -0.763 24.4-156.9 -87.6 149.8 30.5 41.2 11.4 42 42 A L E -AB 4 35A 28 -7,-2.1 -7,-2.2 -2,-0.3 2,-0.3 -0.996 9.6-151.8-131.5 136.9 32.4 44.5 11.9 43 43 A F E -A 3 0A 0 -40,-3.3 -40,-2.3 -2,-0.4 2,-0.1 -0.771 19.8-108.7-113.4 149.7 31.0 47.8 10.7 44 44 A H > - 0 0 70 -12,-0.4 3,-1.2 -2,-0.3 -42,-0.1 -0.408 33.9-120.8 -66.8 148.4 32.3 51.1 9.6 45 45 A E T 3 S+ 0 0 101 -44,-0.5 -1,-0.1 1,-0.3 -43,-0.1 0.758 115.0 40.3 -63.9 -30.1 31.8 53.8 12.2 46 46 A S T 3 S+ 0 0 95 2,-0.1 -1,-0.3 0, 0.0 -15,-0.1 0.391 86.0 137.8-100.8 2.8 29.8 55.9 9.7 47 47 A A < - 0 0 3 -3,-1.2 2,-0.3 -17,-0.1 -4,-0.1 -0.141 33.0-170.7 -52.6 142.8 28.0 52.9 8.3 48 48 A V E -C 31 0B 66 -17,-2.8 -17,-3.2 -36,-0.0 2,-0.6 -0.934 28.0-108.0-140.8 151.2 24.4 53.6 7.7 49 49 A K E -C 30 0B 46 -2,-0.3 2,-0.3 -19,-0.2 -19,-0.2 -0.770 45.0-175.5 -81.2 125.9 21.2 51.8 6.8 50 50 A V - 0 0 39 -21,-3.8 2,-0.6 -2,-0.6 0, 0.0 -0.778 26.8-126.3-125.1 164.9 20.2 52.6 3.3 51 51 A D - 0 0 97 -2,-0.3 -22,-0.0 1,-0.1 -2,-0.0 -0.940 13.7-167.5-117.9 116.0 17.4 51.9 0.9 52 52 A L + 0 0 116 -2,-0.6 2,-0.2 2,-0.0 -1,-0.1 0.311 60.0 89.9 -95.8 11.7 18.4 50.5 -2.4 53 53 A N - 0 0 121 1,-0.0 -2,-0.1 0, 0.0 0, 0.0 -0.635 60.5-152.0-101.3 163.2 15.0 51.0 -4.1 54 54 A R 0 0 238 -2,-0.2 -2,-0.0 1,-0.1 -1,-0.0 -0.438 360.0 360.0-134.4 63.2 13.8 54.1 -6.1 55 55 A P 0 0 177 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 0.889 360.0 360.0 -64.5 360.0 9.9 54.2 -5.8 56 !* 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 57 1 B M 0 0 143 0, 0.0 44,-2.1 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 155.3 17.0 64.3 17.4 58 2 B Y E -D 100 0C 106 42,-0.2 2,-0.3 43,-0.1 42,-0.3 -0.833 360.0-153.9-111.4 149.1 14.1 62.3 16.0 59 3 B L E -D 99 0C 5 40,-4.1 40,-2.8 -2,-0.3 2,-0.1 -0.832 18.6-114.5-115.9 155.2 10.8 61.3 17.6 60 4 B T E > -D 98 0C 16 -2,-0.3 4,-3.0 38,-0.2 5,-0.3 -0.381 40.8-104.4 -69.0 164.0 8.3 58.5 17.1 61 5 B L H > S+ 0 0 17 36,-0.6 4,-2.3 2,-0.2 5,-0.2 0.930 125.7 49.0 -56.4 -45.0 4.9 59.4 15.9 62 6 B Q H > S+ 0 0 132 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.967 111.8 47.3 -57.0 -54.6 3.7 59.0 19.5 63 7 B E H > S+ 0 0 83 1,-0.2 4,-0.6 2,-0.2 -2,-0.2 0.875 113.9 48.6 -59.1 -38.7 6.5 61.1 21.0 64 8 B W H >< S+ 0 0 1 -4,-3.0 3,-0.9 1,-0.2 -1,-0.2 0.909 111.4 49.5 -67.3 -40.4 5.9 63.8 18.4 65 9 B N H >< S+ 0 0 12 -4,-2.3 3,-1.2 -5,-0.3 -2,-0.2 0.856 103.6 59.0 -70.6 -33.1 2.2 63.9 19.0 66 10 B A H 3< S+ 0 0 75 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.715 105.3 51.8 -65.9 -20.9 2.6 64.1 22.8 67 11 B R T << S+ 0 0 158 -3,-0.9 -1,-0.2 -4,-0.6 -2,-0.2 0.294 88.1 102.7-104.2 6.0 4.6 67.4 22.4 68 12 B Q S < S- 0 0 55 -3,-1.2 36,-0.0 -4,-0.1 -3,-0.0 -0.428 91.4 -96.1 -82.5 164.7 2.1 69.3 20.2 69 13 B R S S+ 0 0 87 1,-0.2 44,-0.4 -2,-0.1 -1,-0.1 0.922 115.7 2.8 -35.0 -60.0 -0.3 72.1 21.3 70 14 B R S S- 0 0 47 42,-0.1 -1,-0.2 83,-0.0 2,-0.2 -0.974 81.5-131.2-139.0 120.4 -2.9 69.4 21.5 71 15 B P - 0 0 67 0, 0.0 2,-0.2 0, 0.0 -5,-0.1 -0.494 25.1-166.1 -69.6 138.2 -2.3 65.7 20.9 72 16 B R - 0 0 62 -2,-0.2 2,-0.1 1,-0.1 -4,-0.1 -0.566 37.2 -65.9-107.1-177.8 -4.7 64.0 18.6 73 17 B S >> - 0 0 66 -2,-0.2 4,-1.9 1,-0.1 3,-0.6 -0.424 43.9-120.9 -64.0 148.0 -5.3 60.3 17.9 74 18 B L H 3> S+ 0 0 48 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.827 113.5 59.8 -58.3 -35.8 -2.4 58.5 16.3 75 19 B E H 3> S+ 0 0 106 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.884 105.1 48.7 -64.6 -34.6 -4.7 57.6 13.5 76 20 B T H <> S+ 0 0 37 -3,-0.6 4,-2.1 2,-0.2 -2,-0.2 0.932 108.7 51.5 -69.1 -45.0 -5.2 61.2 12.8 77 21 B V H X S+ 0 0 0 -4,-1.9 4,-1.5 1,-0.2 -2,-0.2 0.889 108.3 53.2 -63.7 -34.3 -1.5 62.1 12.9 78 22 B R H X S+ 0 0 93 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.914 106.4 52.2 -64.0 -43.5 -0.9 59.2 10.4 79 23 B R H X S+ 0 0 92 -4,-1.7 4,-1.5 1,-0.3 -1,-0.2 0.882 105.2 56.7 -61.2 -36.3 -3.4 60.7 8.0 80 24 B W H <>S+ 0 0 19 -4,-2.1 5,-2.6 2,-0.2 6,-0.4 0.878 108.2 46.6 -58.1 -42.5 -1.6 64.0 8.3 81 25 B V H ><5S+ 0 0 16 -4,-1.5 3,-1.3 -3,-0.2 -2,-0.2 0.906 111.3 50.3 -70.3 -42.8 1.6 62.3 7.2 82 26 B R H 3<5S+ 0 0 147 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.789 111.3 51.0 -59.8 -30.4 -0.1 60.5 4.3 83 27 B E T 3<5S- 0 0 87 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.420 113.4-119.3 -96.5 6.2 -1.6 63.9 3.3 84 28 B S T < 5S+ 0 0 86 -3,-1.3 -3,-0.2 -4,-0.2 -2,-0.1 0.907 70.2 135.6 62.7 41.8 1.8 65.6 3.4 85 29 B R < + 0 0 103 -5,-2.6 21,-2.0 -6,-0.1 2,-0.4 0.501 49.1 78.5 -94.9 -10.6 0.7 68.0 6.1 86 30 B I E S-F 105 0D 2 -6,-0.4 19,-0.2 19,-0.2 17,-0.1 -0.899 76.1-127.5-111.4 133.2 3.9 67.7 8.2 87 31 B F E S+F 104 0D 105 17,-2.6 17,-2.0 -2,-0.4 12,-0.0 -0.982 96.8 28.8-133.2 127.5 7.2 69.5 7.4 88 32 B P S S- 0 0 63 0, 0.0 12,-0.2 0, 0.0 -1,-0.1 0.542 105.1-124.2 -63.2 152.8 9.8 68.0 7.1 89 33 B P - 0 0 83 0, 0.0 -2,-0.1 0, 0.0 2,-0.1 -0.485 28.0-116.9 -71.6 128.2 7.9 65.0 6.0 90 34 B P - 0 0 16 0, 0.0 2,-0.4 0, 0.0 9,-0.2 -0.331 21.6-132.3 -65.1 162.3 8.7 62.0 8.2 91 35 B V E -E 98 0C 96 7,-1.3 7,-2.2 -2,-0.1 2,-1.3 -0.855 15.3-119.8-123.1 138.7 10.3 59.0 6.9 92 36 B K E -E 97 0C 130 -2,-0.4 2,-1.3 5,-0.2 5,-0.3 -0.687 24.5-165.2 -82.3 92.8 9.2 55.4 7.6 93 37 B D E > -E 96 0C 14 3,-1.8 3,-1.4 -2,-1.3 2,-1.1 -0.700 69.9 -49.3 -76.2 92.4 12.1 53.8 9.3 94 38 B G T 3 S- 0 0 59 -2,-1.3 -2,-0.1 1,-0.3 3,-0.0 -0.662 124.8 -19.1 82.3-101.6 11.1 50.2 8.9 95 39 B R T 3 S+ 0 0 233 -2,-1.1 2,-0.3 2,-0.0 -1,-0.3 0.391 127.0 67.5-119.9 0.7 7.5 50.1 10.0 96 40 B E E < S- E 0 93C 48 -3,-1.4 -3,-1.8 -5,-0.0 2,-0.3 -0.902 78.0-115.9-130.8 147.6 7.4 53.2 12.0 97 41 B Y E - E 0 92C 50 -2,-0.3 -36,-0.6 -5,-0.3 2,-0.5 -0.598 19.6-153.8 -80.8 140.2 7.6 56.9 11.2 98 42 B L E -DE 60 91C 6 -7,-2.2 -7,-1.3 -2,-0.3 2,-0.5 -0.969 9.0-163.9-112.5 119.9 10.4 59.1 12.5 99 43 B F E -D 59 0C 0 -40,-2.8 -40,-4.1 -2,-0.5 2,-0.2 -0.842 22.0-124.6 -92.7 136.6 9.7 62.8 12.9 100 44 B H E > -D 58 0C 58 -2,-0.5 3,-2.2 -42,-0.3 -42,-0.2 -0.536 29.9-117.5 -66.4 143.8 12.5 65.3 13.3 101 45 B E T 3 S+ 0 0 106 -44,-2.1 -1,-0.1 1,-0.3 -43,-0.1 0.721 114.3 58.2 -63.2 -19.2 11.8 67.2 16.5 102 46 B S T 3 S+ 0 0 73 -45,-0.2 -1,-0.3 2,-0.0 -15,-0.1 0.485 80.6 124.5 -84.4 -5.0 11.5 70.4 14.5 103 47 B A < - 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