==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION/DNA 02-NOV-11 3UGO . COMPND 2 MOLECULE: RNA POLYMERASE SIGMA FACTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS AQUATICUS; . AUTHOR A.FEKLISTOV,S.A.DARST . 180 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10671.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 132 73.3 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 . 0 0.0 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 . 3 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 109 60.6 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+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 2 0 1 0 0 0 0 0 1 0 1 0 1 0 0 1 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 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 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 92 A T 0 0 149 0, 0.0 5,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 49.0 17.7 4.8 39.7 2 93 A S > - 0 0 63 1,-0.1 4,-4.3 2,-0.1 5,-0.3 -0.224 360.0-127.5 -44.3 128.5 20.7 7.0 40.3 3 94 A D H > S+ 0 0 108 1,-0.2 4,-1.8 2,-0.2 -1,-0.1 0.907 109.1 43.0 -52.6 -49.4 19.4 10.2 41.9 4 95 A P H > S+ 0 0 91 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.875 118.8 45.6 -64.9 -36.4 21.1 12.5 39.3 5 96 A V H > S+ 0 0 15 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.915 110.8 51.2 -72.0 -44.8 20.1 10.2 36.5 6 97 A R H X S+ 0 0 137 -4,-4.3 4,-1.7 1,-0.2 -1,-0.2 0.860 110.9 51.5 -58.1 -34.8 16.5 9.8 37.7 7 98 A Q H X S+ 0 0 88 -4,-1.8 4,-1.9 -5,-0.3 -1,-0.2 0.849 108.5 49.6 -72.1 -37.6 16.4 13.6 37.9 8 99 A Y H X S+ 0 0 16 -4,-1.6 4,-3.0 2,-0.2 5,-0.3 0.936 111.0 49.4 -63.3 -47.4 17.7 14.0 34.3 9 100 A L H X S+ 0 0 61 -4,-2.7 4,-1.5 1,-0.2 -2,-0.2 0.872 110.2 51.6 -60.7 -37.3 15.0 11.5 33.1 10 101 A H H < S+ 0 0 109 -4,-1.7 4,-0.3 -5,-0.2 -1,-0.2 0.917 112.7 46.3 -64.1 -41.8 12.4 13.5 35.0 11 102 A E H >< S+ 0 0 79 -4,-1.9 3,-1.2 1,-0.2 4,-0.2 0.906 112.6 45.8 -71.2 -45.1 13.6 16.7 33.4 12 103 A I H >< S+ 0 0 4 -4,-3.0 3,-1.6 1,-0.2 105,-0.2 0.810 102.2 69.4 -70.1 -24.8 13.8 15.4 29.8 13 104 A G T 3< S+ 0 0 42 -4,-1.5 -1,-0.2 -5,-0.3 -2,-0.2 0.673 92.3 59.0 -64.0 -16.6 10.4 13.8 30.2 14 105 A Q T < S+ 0 0 135 -3,-1.2 -1,-0.3 -4,-0.3 -2,-0.2 0.537 81.4 97.4 -90.1 -7.8 8.8 17.2 30.3 15 106 A V S < S- 0 0 7 -3,-1.6 102,-0.1 -4,-0.2 2,-0.0 -0.731 75.3-133.3 -85.3 120.2 10.0 18.2 26.9 16 107 A P - 0 0 82 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 -0.343 21.7-107.6 -71.7 154.7 7.2 17.6 24.4 17 108 A L - 0 0 109 1,-0.1 2,-0.2 98,-0.1 98,-0.1 -0.503 36.4-110.4 -75.8 153.3 8.0 15.8 21.1 18 109 A L - 0 0 30 96,-0.3 2,-0.1 -2,-0.2 -1,-0.1 -0.554 21.1-127.3 -83.3 147.2 8.0 17.8 17.9 19 110 A T > - 0 0 67 -2,-0.2 4,-2.5 1,-0.1 5,-0.2 -0.429 35.0-102.6 -75.8 165.0 5.5 17.6 15.2 20 111 A L H > S+ 0 0 73 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.930 122.7 53.0 -53.2 -47.0 6.7 17.0 11.6 21 112 A E H > S+ 0 0 130 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.881 110.7 44.6 -59.3 -45.1 6.2 20.6 10.8 22 113 A E H > S+ 0 0 94 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.898 111.2 55.2 -67.0 -41.1 8.1 21.9 13.8 23 114 A E H X S+ 0 0 12 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.934 110.0 45.3 -56.8 -50.0 10.9 19.4 13.1 24 115 A I H X S+ 0 0 52 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.904 112.3 52.4 -61.4 -40.8 11.3 20.7 9.5 25 116 A D H X S+ 0 0 56 -4,-2.0 4,-1.9 -5,-0.2 -2,-0.2 0.901 111.3 45.6 -65.9 -40.6 11.2 24.3 10.7 26 117 A L H X S+ 0 0 19 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.914 112.8 49.9 -67.8 -42.4 13.9 23.8 13.2 27 118 A A H X S+ 0 0 8 -4,-2.3 4,-2.2 -5,-0.2 -2,-0.2 0.885 109.7 51.9 -64.8 -38.0 16.1 21.9 10.8 28 119 A R H X S+ 0 0 87 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.913 109.3 50.0 -62.6 -42.6 15.7 24.6 8.2 29 120 A K H X S+ 0 0 58 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.839 108.1 53.3 -64.4 -35.4 16.7 27.2 10.8 30 121 A V H X S+ 0 0 11 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.942 109.6 48.1 -66.0 -44.7 19.8 25.2 11.7 31 122 A E H X S+ 0 0 81 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.923 112.8 47.7 -58.9 -47.8 20.9 25.1 8.0 32 123 A E H X S+ 0 0 104 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.900 110.3 53.6 -62.4 -38.9 20.3 28.8 7.6 33 124 A G H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.876 107.5 50.2 -62.5 -38.9 22.3 29.4 10.8 34 125 A M H X S+ 0 0 62 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.856 110.2 50.0 -70.0 -34.3 25.2 27.4 9.5 35 126 A E H X S+ 0 0 90 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.928 111.8 47.9 -68.1 -41.7 25.2 29.3 6.2 36 127 A A H X S+ 0 0 2 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.887 109.0 54.4 -62.7 -37.2 25.2 32.6 8.1 37 128 A I H X S+ 0 0 1 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.893 103.9 55.1 -68.5 -35.8 28.0 31.4 10.4 38 129 A K H X S+ 0 0 65 -4,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.940 108.1 49.3 -55.1 -50.5 30.1 30.7 7.3 39 130 A K H X S+ 0 0 76 -4,-1.8 4,-2.0 1,-0.2 -2,-0.2 0.886 109.6 51.0 -58.3 -43.6 29.6 34.3 6.2 40 131 A L H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 6,-0.3 0.872 109.8 50.9 -62.0 -37.3 30.6 35.6 9.6 41 132 A S H X S+ 0 0 23 -4,-2.2 4,-2.2 2,-0.2 5,-0.5 0.908 109.7 49.1 -66.4 -45.1 33.7 33.4 9.5 42 133 A E H < S+ 0 0 115 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.886 115.2 46.2 -59.9 -37.8 34.7 34.8 6.1 43 134 A A H < S+ 0 0 54 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.825 124.0 29.4 -75.9 -32.4 34.1 38.3 7.4 44 135 A T H < S- 0 0 39 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.556 94.2-126.5-106.3 -12.3 36.0 38.0 10.7 45 136 A G < + 0 0 70 -4,-2.2 2,-0.3 1,-0.3 -3,-0.1 0.703 66.6 135.3 66.2 20.1 38.7 35.4 9.9 46 137 A L - 0 0 28 -5,-0.5 -1,-0.3 -6,-0.3 -2,-0.2 -0.734 66.4 -92.4 -99.6 151.7 37.5 33.4 12.9 47 138 A D > - 0 0 99 -2,-0.3 4,-2.7 1,-0.1 5,-0.2 -0.376 28.5-134.3 -61.6 129.9 36.9 29.7 12.9 48 139 A Q H > S+ 0 0 81 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.872 106.3 49.3 -50.5 -44.5 33.2 28.7 12.1 49 140 A E H > S+ 0 0 55 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.870 109.7 51.7 -68.2 -37.0 33.0 26.3 15.0 50 141 A L H > S+ 0 0 48 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.925 110.8 47.9 -62.8 -46.7 34.4 28.9 17.3 51 142 A I H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 5,-0.2 0.966 112.1 50.2 -57.2 -49.2 31.7 31.3 16.1 52 143 A R H X S+ 0 0 30 -4,-2.7 4,-3.1 1,-0.2 -2,-0.2 0.909 109.9 50.6 -53.7 -48.4 29.0 28.7 16.5 53 144 A E H X S+ 0 0 43 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.851 112.8 45.0 -64.3 -35.3 30.1 27.8 20.1 54 145 A V H X S+ 0 0 0 -4,-1.9 4,-1.3 -3,-0.2 -1,-0.2 0.894 113.2 49.7 -75.1 -40.8 30.1 31.4 21.2 55 146 A V H < S+ 0 0 5 -4,-2.7 3,-0.4 -5,-0.2 4,-0.3 0.928 112.0 50.1 -63.7 -42.2 26.8 32.1 19.6 56 147 A R H >X S+ 0 0 40 -4,-3.1 3,-3.1 -5,-0.2 4,-1.3 0.967 104.6 56.8 -56.1 -54.1 25.4 29.0 21.2 57 148 A A H 3< S+ 0 0 13 -4,-2.2 4,-0.3 1,-0.3 -1,-0.2 0.790 105.2 53.8 -50.0 -29.8 26.7 30.1 24.6 58 149 A K T 3< S+ 0 0 114 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.483 111.0 43.9 -87.3 -3.9 24.7 33.3 24.2 59 150 A I T X4 S+ 0 0 22 -3,-3.1 3,-1.2 -4,-0.3 -2,-0.2 0.490 88.5 86.5-112.6 -8.5 21.4 31.5 23.6 60 151 A L G >< S+ 0 0 10 -4,-1.3 3,-2.1 1,-0.3 -2,-0.1 0.742 74.4 72.2 -64.6 -25.5 21.7 28.9 26.3 61 152 A G G 3 S+ 0 0 69 -4,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.827 99.4 47.6 -58.7 -31.0 20.1 31.2 28.9 62 153 A T G < S+ 0 0 135 -3,-1.2 -1,-0.3 -4,-0.0 -2,-0.2 0.193 93.8 119.5 -93.8 15.3 16.8 30.7 27.1 63 154 A A < - 0 0 21 -3,-2.1 3,-0.1 1,-0.1 -3,-0.1 -0.391 59.2-144.8 -86.5 160.6 17.2 26.9 27.0 64 155 A R S S+ 0 0 95 1,-0.3 2,-0.6 -2,-0.1 -1,-0.1 0.874 90.8 38.2 -89.5 -44.5 15.0 24.3 28.6 65 156 A I + 0 0 5 1,-0.2 -1,-0.3 44,-0.1 3,-0.2 -0.947 66.1 179.3-113.9 119.4 17.7 21.7 29.5 66 157 A Q + 0 0 104 -2,-0.6 2,-0.8 1,-0.2 -1,-0.2 0.954 68.2 41.9 -89.9 -55.2 20.8 23.3 30.9 67 158 A K + 0 0 190 2,-0.0 -1,-0.2 -59,-0.0 0, 0.0 -0.835 68.8 178.9 -99.1 105.3 23.2 20.5 31.8 68 159 A I > - 0 0 15 -2,-0.8 3,-1.9 -3,-0.2 45,-0.0 -0.922 30.7-119.1-109.9 117.7 23.1 17.8 29.1 69 160 A P T 3 S+ 0 0 26 0, 0.0 3,-0.1 0, 0.0 72,-0.1 -0.191 95.3 17.8 -55.3 137.4 25.4 14.8 29.6 70 161 A G T 3 S+ 0 0 26 1,-0.3 2,-0.4 71,-0.1 3,-0.0 0.320 92.9 127.8 87.4 -8.4 28.0 14.3 26.9 71 162 A L < - 0 0 30 -3,-1.9 -1,-0.3 1,-0.1 -3,-0.1 -0.690 68.4-103.0 -88.1 135.1 27.7 17.8 25.5 72 163 A K - 0 0 121 -2,-0.4 -1,-0.1 -3,-0.1 -4,-0.1 -0.244 40.9-116.7 -49.7 128.9 30.8 20.0 25.0 73 164 A E - 0 0 163 1,-0.1 -1,-0.1 -3,-0.0 3,-0.1 -0.286 37.6 -89.1 -65.4 155.9 31.1 22.6 27.7 74 165 A K - 0 0 115 1,-0.1 -1,-0.1 -17,-0.1 -20,-0.1 -0.228 51.9 -98.0 -57.0 155.4 30.9 26.3 26.8 75 166 A P - 0 0 25 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 -0.338 59.0 -69.6 -71.7 165.2 34.2 27.9 25.9 76 167 A D >> - 0 0 85 1,-0.1 4,-2.0 -3,-0.1 3,-0.8 -0.256 47.8-116.0 -57.7 142.2 36.0 29.9 28.6 77 168 A P H 3> S+ 0 0 107 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.738 114.2 56.3 -52.6 -30.7 34.2 33.1 29.5 78 169 A K H 3> S+ 0 0 106 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.898 107.5 47.5 -72.5 -41.3 37.1 35.3 28.3 79 170 A T H <> S+ 0 0 38 -3,-0.8 4,-2.5 2,-0.2 5,-0.3 0.884 113.1 50.8 -62.4 -38.9 37.0 33.7 24.9 80 171 A V H X S+ 0 0 15 -4,-2.0 4,-3.5 2,-0.2 5,-0.4 0.980 111.1 46.1 -62.4 -55.9 33.2 34.2 24.8 81 172 A E H X S+ 0 0 131 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.901 115.3 48.1 -53.5 -44.4 33.4 37.9 25.8 82 173 A E H X S+ 0 0 93 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.933 117.5 38.6 -65.6 -47.5 36.2 38.4 23.2 83 174 A V H X S+ 0 0 6 -4,-2.5 4,-2.3 2,-0.2 5,-0.2 0.896 115.5 52.0 -72.3 -40.5 34.5 36.7 20.3 84 175 A D H X S+ 0 0 19 -4,-3.5 4,-2.4 -5,-0.3 -1,-0.2 0.890 107.7 56.3 -62.6 -34.8 31.0 38.0 21.2 85 176 A G H X S+ 0 0 38 -4,-2.0 4,-1.3 -5,-0.4 -2,-0.2 0.950 108.2 44.9 -59.4 -51.3 32.7 41.4 21.2 86 177 A K H < S+ 0 0 93 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.869 113.6 50.0 -62.8 -37.2 33.9 41.1 17.7 87 178 A L H >< S+ 0 0 0 -4,-2.3 3,-1.4 1,-0.2 -1,-0.2 0.934 110.2 49.7 -68.9 -44.0 30.6 39.7 16.4 88 179 A K H 3< S+ 0 0 119 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.734 104.8 58.9 -64.3 -27.5 28.6 42.5 18.0 89 180 A S T 3< S+ 0 0 91 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.369 80.9 120.5 -85.0 1.9 30.8 45.2 16.5 90 181 A L S < S- 0 0 23 -3,-1.4 5,-0.1 -4,-0.2 -3,-0.0 -0.326 70.4 -93.9 -71.5 154.4 30.2 44.2 13.0 91 182 A P >> - 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