==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-FEB-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SIGNALING 06-JUL-11 3ZTA . COMPND 2 MOLECULE: ANTI-SIGMA-FACTOR ANTAGONIST (STAS) DOMAIN PROTEI . SOURCE 2 ORGANISM_SCIENTIFIC: MOORELLA THERMOACETICA; . AUTHOR M.B.QUIN,J.M.BERRISFORD,J.A.NEWMAN,A.BASLE,R.J.LEWIS,J.MARLE . 139 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8460.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 119 85.6 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 . 2 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 102 73.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.4 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 0 0 1 0 0 0 0 1 0 1 0 1 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 . 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 8 A K > 0 0 92 0, 0.0 3,-2.7 0, 0.0 4,-0.2 0.000 360.0 360.0 360.0-169.4 20.3 32.9 79.4 2 9 A A T >> + 0 0 51 1,-0.3 3,-2.2 2,-0.2 4,-1.2 -0.024 360.0 19.4 48.7-120.6 21.3 29.3 78.8 3 10 A E H 3> S+ 0 0 103 1,-0.3 4,-3.0 2,-0.2 5,-0.4 0.751 113.2 74.6 -54.3 -27.7 21.7 27.4 82.1 4 11 A N H <> S+ 0 0 73 -3,-2.7 4,-0.6 1,-0.2 -1,-0.3 0.809 100.8 44.1 -58.6 -30.0 19.6 30.1 83.9 5 12 A I H <> S+ 0 0 0 -3,-2.2 4,-3.3 -4,-0.2 3,-0.3 0.939 113.5 50.6 -71.0 -53.2 16.7 28.5 82.2 6 13 A V H X S+ 0 0 5 -4,-1.2 4,-3.4 1,-0.3 5,-0.3 0.939 110.3 46.5 -53.5 -58.4 17.8 24.9 83.0 7 14 A E H X S+ 0 0 124 -4,-3.0 4,-1.8 1,-0.2 -1,-0.3 0.809 115.0 50.0 -57.9 -29.2 18.4 25.5 86.7 8 15 A K H X S+ 0 0 64 -4,-0.6 4,-2.5 -5,-0.4 -1,-0.2 0.956 112.3 45.5 -72.4 -49.1 15.0 27.3 86.9 9 16 A A H X S+ 0 0 0 -4,-3.3 4,-2.7 1,-0.2 5,-0.2 0.967 113.9 49.2 -55.2 -56.0 13.3 24.4 85.1 10 17 A I H X S+ 0 0 24 -4,-3.4 4,-2.0 1,-0.2 -1,-0.2 0.908 108.4 55.3 -48.5 -45.8 15.0 21.8 87.3 11 18 A N H X S+ 0 0 71 -4,-1.8 4,-0.6 -5,-0.3 3,-0.5 0.944 108.6 46.0 -57.8 -49.0 14.0 23.9 90.3 12 19 A L H >< S+ 0 0 35 -4,-2.5 3,-1.7 1,-0.3 -1,-0.2 0.920 111.5 52.6 -57.2 -43.7 10.3 23.8 89.3 13 20 A L H >< S+ 0 0 4 -4,-2.7 3,-1.8 1,-0.3 -1,-0.3 0.778 95.4 69.3 -67.1 -25.3 10.7 20.0 88.6 14 21 A S H 3< S+ 0 0 64 -4,-2.0 -1,-0.3 -3,-0.5 -2,-0.2 0.773 100.4 49.8 -58.6 -26.1 12.1 19.6 92.1 15 22 A K T << S+ 0 0 144 -3,-1.7 -1,-0.3 -4,-0.6 2,-0.3 0.367 102.3 81.4 -94.8 3.1 8.6 20.5 93.3 16 23 A E S < S- 0 0 73 -3,-1.8 2,-0.3 -4,-0.1 -3,-0.0 -0.737 89.6 -93.6-114.9 157.4 6.9 17.9 91.1 17 24 A D - 0 0 134 -2,-0.3 -2,-0.1 1,-0.1 -1,-0.0 -0.523 31.0-157.0 -65.9 128.4 6.2 14.2 91.2 18 25 A Q > - 0 0 58 -2,-0.3 3,-1.6 -4,-0.1 -1,-0.1 0.419 26.3-127.4 -95.1 1.0 8.9 12.5 89.2 19 26 A A T 3 S- 0 0 34 1,-0.3 49,-0.5 48,-0.1 3,-0.1 0.807 70.5 -55.1 60.4 32.7 7.0 9.3 88.4 20 27 A G T 3 S+ 0 0 60 1,-0.3 -1,-0.3 47,-0.1 2,-0.1 0.101 104.0 133.3 90.5 -22.2 9.7 7.0 89.7 21 28 A V < - 0 0 3 -3,-1.6 -1,-0.3 1,-0.1 -3,-0.1 -0.392 63.9-110.2 -64.4 132.6 12.4 8.6 87.6 22 29 A H > - 0 0 121 -2,-0.1 4,-2.1 1,-0.1 3,-0.3 -0.332 23.5-123.0 -62.9 145.5 15.6 9.4 89.4 23 30 A F H > S+ 0 0 67 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.819 108.7 58.2 -65.0 -33.2 16.2 13.1 89.8 24 31 A N H > S+ 0 0 119 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.900 108.7 46.6 -63.6 -39.0 19.6 13.1 88.0 25 32 A E H > S+ 0 0 36 -3,-0.3 4,-2.9 2,-0.2 5,-0.2 0.916 109.8 54.2 -65.8 -43.4 17.9 11.7 84.9 26 33 A I H X S+ 0 0 3 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.939 110.6 46.8 -51.1 -50.1 15.2 14.3 85.3 27 34 A S H X S+ 0 0 13 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.923 110.9 50.9 -60.8 -47.7 17.8 17.0 85.3 28 35 A A H X S+ 0 0 42 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.934 110.8 49.1 -56.8 -48.6 19.7 15.5 82.3 29 36 A L H X S+ 0 0 7 -4,-2.9 4,-2.8 1,-0.2 5,-0.2 0.930 109.4 51.9 -55.9 -49.2 16.4 15.3 80.3 30 37 A T H X S+ 0 0 0 -4,-2.6 4,-2.7 -5,-0.2 -1,-0.2 0.914 111.4 48.5 -53.7 -43.5 15.6 18.9 81.2 31 38 A R H X S+ 0 0 111 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.928 110.4 49.3 -64.8 -47.1 19.1 19.9 79.9 32 39 A D H X S+ 0 0 30 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.919 114.0 46.9 -57.7 -45.5 18.8 18.0 76.7 33 40 A F H X S+ 0 0 1 -4,-2.8 4,-2.9 2,-0.2 5,-0.3 0.941 112.7 47.0 -64.9 -49.7 15.4 19.5 76.0 34 41 A C H X S+ 0 0 1 -4,-2.7 4,-2.1 -5,-0.2 5,-0.2 0.934 113.2 50.7 -56.0 -47.2 16.5 23.1 76.8 35 42 A R H X S+ 0 0 142 -4,-2.7 4,-2.4 -5,-0.2 -1,-0.2 0.928 112.6 46.9 -55.2 -48.1 19.6 22.6 74.7 36 43 A A H X S+ 0 0 2 -4,-2.4 4,-2.3 1,-0.2 15,-0.4 0.941 112.6 46.3 -62.2 -51.6 17.5 21.4 71.8 37 44 A I H X S+ 0 0 1 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.796 113.0 51.4 -66.2 -27.4 14.8 24.1 71.8 38 45 A L H X S+ 0 0 36 -4,-2.1 4,-2.5 -5,-0.3 -1,-0.2 0.900 107.7 51.7 -73.4 -41.7 17.5 26.7 72.1 39 46 A S H < S+ 0 0 38 -4,-2.4 4,-0.3 -5,-0.2 -2,-0.2 0.899 113.7 45.8 -56.8 -41.1 19.3 25.3 69.1 40 47 A D H >< S+ 0 0 3 -4,-2.3 3,-0.8 1,-0.2 7,-0.7 0.900 112.1 51.0 -67.4 -42.4 16.0 25.5 67.3 41 48 A L H 3< S+ 0 0 25 -4,-2.1 -2,-0.2 1,-0.2 5,-0.2 0.905 101.9 56.8 -65.1 -45.4 15.2 29.0 68.5 42 49 A E T 3< S+ 0 0 155 -4,-2.5 -1,-0.2 -5,-0.1 -2,-0.2 0.625 94.6 98.6 -65.0 -10.1 18.5 30.6 67.5 43 50 A Q S < S- 0 0 103 -3,-0.8 2,-0.4 -4,-0.3 3,-0.3 -0.310 73.9-128.2 -73.5 157.6 17.7 29.4 64.0 44 51 A S S S+ 0 0 107 1,-0.2 -2,-0.1 2,-0.1 -1,-0.0 -0.897 89.1 34.4-103.0 139.0 16.2 31.4 61.2 45 52 A G S S- 0 0 74 -2,-0.4 -1,-0.2 1,-0.1 -2,-0.0 0.635 117.3 -85.2 92.5 14.4 13.1 30.0 59.4 46 53 A F - 0 0 83 -3,-0.3 2,-0.5 -5,-0.2 -5,-0.1 0.961 52.6-165.5 58.2 73.9 11.6 28.3 62.4 47 54 A T + 0 0 41 -7,-0.7 -1,-0.2 1,-0.1 4,-0.2 -0.819 21.2 174.6 -93.0 129.1 13.1 24.8 62.8 48 55 A T > + 0 0 34 -2,-0.5 4,-1.9 1,-0.1 5,-0.2 0.359 56.3 101.2 -99.2 -0.1 11.4 22.3 65.1 49 56 A S H > S+ 0 0 66 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.832 74.6 48.7 -62.5 -43.7 13.8 19.5 64.1 50 57 A E H > S+ 0 0 51 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.954 113.0 45.7 -65.5 -52.2 16.2 19.4 67.0 51 58 A L H > S+ 0 0 5 -15,-0.4 4,-2.5 1,-0.2 -1,-0.2 0.894 112.1 54.3 -57.0 -40.2 13.6 19.3 69.8 52 59 A E H X S+ 0 0 59 -4,-1.9 4,-2.8 2,-0.2 -1,-0.2 0.923 107.4 50.6 -57.9 -45.2 11.8 16.7 67.7 53 60 A K H X S+ 0 0 120 -4,-2.3 4,-2.7 1,-0.2 5,-0.2 0.968 111.3 46.9 -56.0 -56.2 15.0 14.6 67.6 54 61 A E H X S+ 0 0 18 -4,-2.6 4,-2.7 1,-0.2 -1,-0.2 0.886 112.9 51.0 -53.4 -42.5 15.4 14.8 71.4 55 62 A I H X S+ 0 0 0 -4,-2.5 4,-2.2 -5,-0.2 -1,-0.2 0.946 110.4 46.2 -64.9 -51.0 11.8 13.9 71.9 56 63 A A H X S+ 0 0 18 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.955 115.4 47.5 -54.7 -51.5 11.7 10.8 69.7 57 64 A D H X S+ 0 0 63 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.940 113.4 47.0 -55.6 -50.4 15.0 9.6 71.3 58 65 A K H X S+ 0 0 20 -4,-2.7 4,-2.6 -5,-0.2 -1,-0.2 0.759 107.5 56.3 -69.1 -26.9 13.8 10.2 74.8 59 66 A V H X S+ 0 0 2 -4,-2.2 4,-2.7 2,-0.2 5,-0.3 0.964 109.7 47.5 -63.4 -52.3 10.4 8.5 74.2 60 67 A K H X S+ 0 0 128 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.966 114.5 45.1 -48.0 -62.4 12.4 5.5 73.1 61 68 A I H X S+ 0 0 56 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.907 112.7 51.4 -49.4 -50.3 14.7 5.6 76.2 62 69 A X H X>S+ 0 0 0 -4,-2.6 5,-2.2 1,-0.2 4,-0.7 0.907 111.1 47.1 -57.0 -46.4 11.7 6.2 78.5 63 70 A F H ><5S+ 0 0 79 -4,-2.7 3,-0.7 1,-0.2 -1,-0.2 0.906 111.7 50.5 -65.8 -41.2 9.8 3.3 77.2 64 71 A A H 3<5S+ 0 0 90 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.867 111.7 48.4 -62.9 -36.5 12.8 1.0 77.4 65 72 A Q H 3<5S- 0 0 90 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.537 113.6-120.8 -82.0 -8.7 13.4 2.0 81.0 66 73 A G T <<5 + 0 0 63 -3,-0.7 2,-0.3 -4,-0.7 -3,-0.2 0.747 62.2 142.1 76.6 25.8 9.8 1.5 81.8 67 74 A Y < - 0 0 56 -5,-2.2 -1,-0.2 -6,-0.2 2,-0.1 -0.753 62.4 -95.3 -97.4 145.4 8.9 5.0 83.0 68 75 A H > - 0 0 122 -49,-0.5 3,-1.3 -2,-0.3 4,-0.1 -0.398 29.4-143.7 -57.0 127.6 5.6 6.8 82.3 69 76 A I T >> S+ 0 0 12 1,-0.3 3,-2.5 2,-0.2 4,-0.7 0.754 90.6 78.8 -70.8 -23.5 6.2 8.9 79.1 70 77 A E H 3> S+ 0 0 128 1,-0.3 4,-2.0 2,-0.2 -1,-0.3 0.767 75.3 77.9 -54.4 -25.7 4.0 11.7 80.5 71 78 A V H <> S+ 0 0 7 -3,-1.3 4,-1.6 1,-0.2 -1,-0.3 0.734 89.1 56.4 -60.9 -21.4 6.9 12.7 82.6 72 79 A L H <> S+ 0 0 0 -3,-2.5 4,-2.9 2,-0.2 -1,-0.2 0.930 102.2 53.6 -73.5 -46.0 8.4 14.3 79.4 73 80 A Q H X S+ 0 0 63 -4,-0.7 4,-3.2 -3,-0.2 -2,-0.2 0.953 108.4 50.7 -49.3 -54.6 5.3 16.5 78.9 74 81 A L H X S+ 0 0 35 -4,-2.0 4,-3.0 1,-0.2 5,-0.2 0.927 108.7 51.6 -49.5 -52.0 5.7 17.8 82.4 75 82 A I H X S+ 0 0 0 -4,-1.6 4,-3.1 1,-0.2 -1,-0.2 0.955 110.5 48.0 -52.4 -54.5 9.3 18.6 81.8 76 83 A L H X S+ 0 0 2 -4,-2.9 4,-2.9 1,-0.2 -1,-0.2 0.945 110.7 52.3 -50.5 -52.5 8.4 20.5 78.6 77 84 A E H X S+ 0 0 84 -4,-3.2 4,-2.4 1,-0.2 -1,-0.2 0.934 111.5 45.4 -50.8 -52.1 5.7 22.3 80.6 78 85 A K H X S+ 0 0 33 -4,-3.0 4,-3.2 1,-0.2 -1,-0.2 0.922 109.6 55.3 -62.4 -42.2 8.1 23.4 83.3 79 86 A I H X S+ 0 0 2 -4,-3.1 4,-2.6 -5,-0.2 -1,-0.2 0.941 106.7 52.0 -52.6 -47.8 10.7 24.4 80.7 80 87 A L H X S+ 0 0 30 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.967 109.6 48.3 -53.3 -55.2 8.1 26.6 79.2 81 88 A D H X S+ 0 0 69 -4,-2.4 4,-3.1 1,-0.2 -1,-0.2 0.929 108.6 55.6 -49.4 -49.6 7.4 28.2 82.6 82 89 A S H X S+ 0 0 0 -4,-3.2 4,-3.0 1,-0.2 5,-0.3 0.937 107.0 48.4 -50.8 -55.0 11.1 28.7 83.0 83 90 A F H X S+ 0 0 0 -4,-2.6 4,-3.6 1,-0.2 5,-0.3 0.948 111.7 49.7 -50.4 -55.7 11.5 30.6 79.8 84 91 A I H X S+ 0 0 42 -4,-2.4 4,-2.1 1,-0.2 5,-0.2 0.933 111.9 48.7 -49.2 -54.7 8.6 32.9 80.7 85 92 A S H >X S+ 0 0 37 -4,-3.1 4,-1.5 1,-0.2 3,-0.8 0.940 114.8 43.9 -51.0 -56.7 10.0 33.5 84.1 86 93 A V H >X S+ 0 0 6 -4,-3.0 4,-2.7 1,-0.3 3,-0.5 0.904 112.9 51.6 -57.1 -44.4 13.4 34.3 82.7 87 94 A I H 3X S+ 0 0 2 -4,-3.6 4,-1.2 -5,-0.3 -1,-0.3 0.759 104.9 56.7 -69.8 -22.8 12.1 36.5 79.9 88 95 A R H << S+ 0 0 181 -4,-2.1 -1,-0.3 -3,-0.8 -2,-0.2 0.833 115.3 39.4 -73.4 -31.8 10.0 38.4 82.4 89 96 A E H << S+ 0 0 120 -4,-1.5 -2,-0.2 -3,-0.5 -3,-0.1 0.977 119.6 39.7 -77.0 -65.4 13.2 39.2 84.2 90 97 A Q H < S+ 0 0 90 -4,-2.7 2,-0.7 1,-0.1 -3,-0.2 0.790 108.9 62.0 -61.7 -35.1 15.8 39.9 81.4 91 98 A Y < + 0 0 75 -4,-1.2 -1,-0.1 -5,-0.3 6,-0.1 -0.832 49.1 173.5-104.8 109.3 13.5 41.8 79.0 92 99 A H + 0 0 167 -2,-0.7 2,-0.8 1,-0.0 -1,-0.1 0.545 63.3 88.6 -87.5 -8.3 12.1 45.1 80.3 93 100 A D > - 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