==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-SEP-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 09-SEP-11 3TQQ . COMPND 2 MOLECULE: METHIONYL-TRNA FORMYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: COXIELLA BURNETII; . AUTHOR M.RUDOLPH,J.CHEUNG,M.FRANKLIN,M.CASSIDY,E.GARY,F.BURSHTEYN,J . 304 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15179.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 206 67.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 26 8.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 45 14.8 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 1.0 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 . 24 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 66 21.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.3 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 1 0 0 0 4 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 1 1 0 2 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 1 0 4 0 0 2 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 1 1 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 X 0 0 127 0, 0.0 173,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -94.0 19.9 11.1 -21.2 2 2 A S - 0 0 29 1,-0.1 2,-0.3 24,-0.0 24,-0.1 0.871 360.0-148.2 69.0 109.5 17.5 12.3 -18.4 3 3 A L - 0 0 0 70,-0.0 24,-3.7 69,-0.0 2,-0.6 -0.734 14.1-123.7-103.4 154.3 14.1 13.7 -19.3 4 4 A K E -a 27 0A 47 -2,-0.3 69,-2.8 22,-0.2 70,-1.7 -0.887 41.0-172.9 -95.4 123.9 12.1 16.4 -17.6 5 5 A I E -ab 28 74A 0 22,-3.3 24,-2.4 -2,-0.6 25,-0.8 -0.939 29.1-155.6-128.9 134.3 8.7 14.9 -16.8 6 6 A V E -ab 30 75A 0 68,-2.1 70,-2.8 -2,-0.4 2,-0.4 -0.946 25.5-156.4 -99.0 128.2 5.4 16.0 -15.5 7 7 A F E -ab 31 76A 0 23,-2.6 25,-3.4 -2,-0.5 2,-0.4 -0.852 11.9-174.6-108.0 140.3 3.6 13.1 -13.9 8 8 A A E +ab 32 77A 0 68,-2.5 70,-2.7 -2,-0.4 2,-0.3 -0.986 28.2 113.2-136.3 125.6 -0.2 12.8 -13.4 9 9 A G E - b 0 78A 0 23,-2.5 71,-0.2 -2,-0.4 70,-0.2 -0.956 31.5-167.1-178.4 167.4 -1.9 10.0 -11.6 10 10 A T + 0 0 17 69,-1.2 31,-1.6 68,-0.6 32,-0.3 0.626 56.5 56.5-135.3 -63.9 -3.9 9.3 -8.4 11 11 A P S > S- 0 0 54 0, 0.0 3,-1.6 0, 0.0 4,-0.5 -0.042 92.4 -85.2 -81.4-178.0 -4.6 5.7 -7.1 12 12 A Q G > S+ 0 0 99 1,-0.3 3,-1.4 2,-0.2 67,-0.0 0.802 118.7 71.5 -58.0 -31.2 -2.3 2.9 -6.2 13 13 A F G 3 S+ 0 0 19 1,-0.3 4,-0.4 2,-0.1 -1,-0.3 0.818 98.9 49.8 -54.6 -30.0 -2.0 1.6 -9.8 14 14 A A G <> S+ 0 0 0 -3,-1.6 4,-2.1 1,-0.2 -1,-0.3 0.681 89.6 83.3 -82.5 -18.3 0.1 4.7 -10.6 15 15 A V H <> S+ 0 0 10 -3,-1.4 4,-3.2 -4,-0.5 5,-0.2 0.894 85.4 51.1 -62.6 -46.5 2.6 4.5 -7.7 16 16 A P H > S+ 0 0 19 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.883 111.0 50.1 -59.8 -38.8 5.1 2.0 -9.2 17 17 A T H > S+ 0 0 2 -4,-0.4 4,-2.0 -3,-0.2 -2,-0.2 0.942 112.4 46.7 -64.2 -46.8 5.5 4.0 -12.3 18 18 A L H X S+ 0 0 0 -4,-2.1 4,-2.9 1,-0.2 -1,-0.2 0.929 112.4 50.8 -58.0 -44.3 6.0 7.2 -10.3 19 19 A R H X S+ 0 0 107 -4,-3.2 4,-2.7 1,-0.2 -1,-0.2 0.888 107.5 53.2 -63.4 -36.6 8.5 5.4 -8.1 20 20 A A H X S+ 0 0 18 -4,-2.4 4,-0.7 2,-0.2 -1,-0.2 0.880 111.2 46.0 -65.2 -37.6 10.3 4.1 -11.2 21 21 A L H >< S+ 0 0 1 -4,-2.0 3,-0.5 2,-0.2 -2,-0.2 0.905 112.6 51.2 -69.7 -41.5 10.6 7.7 -12.4 22 22 A I H 3< S+ 0 0 34 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.878 111.2 47.2 -60.7 -39.8 11.7 8.8 -9.0 23 23 A D H 3< S+ 0 0 120 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.632 105.8 75.4 -79.0 -11.7 14.4 6.1 -8.8 24 24 A S S << S- 0 0 34 -4,-0.7 -3,-0.1 -3,-0.5 146,-0.0 -0.093 95.1-105.5 -86.2-173.1 15.7 7.0 -12.3 25 25 A S S S+ 0 0 105 2,-0.1 -4,-0.1 -2,-0.0 -3,-0.1 0.512 85.4 108.9 -91.4 -6.9 17.8 9.9 -13.5 26 26 A H S S- 0 0 25 -5,-0.2 2,-0.7 -24,-0.1 -22,-0.2 -0.273 73.1-120.5 -63.5 155.6 14.8 11.6 -15.2 27 27 A R E -a 4 0A 115 -24,-3.7 -22,-3.3 -21,-0.0 2,-1.1 -0.874 13.7-154.9-108.3 112.4 13.5 14.7 -13.4 28 28 A V E -a 5 0A 21 -2,-0.7 -22,-0.2 -24,-0.2 3,-0.1 -0.743 13.3-175.3 -80.7 102.7 9.9 14.7 -12.2 29 29 A L E - 0 0 51 -24,-2.4 2,-0.3 -2,-1.1 -23,-0.2 0.847 63.0 -10.8 -70.2 -37.1 9.2 18.4 -12.2 30 30 A A E -a 6 0A 2 -25,-0.8 -23,-2.6 -3,-0.1 2,-0.5 -0.988 57.1-135.0-159.0 156.9 5.7 18.1 -10.7 31 31 A V E -ac 7 52A 0 20,-2.3 22,-3.0 -2,-0.3 2,-0.5 -0.988 14.8-154.8-120.2 124.4 3.0 15.5 -9.8 32 32 A Y E +ac 8 53A 0 -25,-3.4 -23,-2.5 -2,-0.5 2,-0.3 -0.853 27.0 159.3 -93.7 131.7 -0.6 16.1 -10.7 33 33 A T - 0 0 0 20,-2.1 -23,-0.2 -2,-0.5 3,-0.1 -0.971 45.9 -74.6-146.4 161.4 -3.1 14.3 -8.4 34 34 A Q - 0 0 120 -2,-0.3 5,-0.4 -25,-0.1 22,-0.1 -0.225 60.7 -96.9 -52.4 139.0 -6.8 14.4 -7.3 35 35 A P 0 0 28 0, 0.0 -1,-0.1 0, 0.0 18,-0.0 -0.234 360.0 360.0 -53.8 151.3 -7.6 17.1 -4.8 36 36 A D 0 0 131 18,-0.1 18,-0.0 -3,-0.1 -3,-0.0 -0.292 360.0 360.0 -60.1 360.0 -7.5 15.9 -1.2 37 ! 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 38 47 A E 0 0 115 0, 0.0 -2,-0.1 0, 0.0 -4,-0.0 0.000 360.0 360.0 360.0 156.9 -4.8 12.1 0.3 39 48 A S > - 0 0 12 -5,-0.4 4,-1.9 1,-0.1 3,-0.1 -0.335 360.0-116.0 -75.2 157.2 -4.0 9.9 -2.7 40 49 A P H > S+ 0 0 42 0, 0.0 4,-1.9 0, 0.0 5,-0.2 0.881 118.2 56.2 -57.3 -37.8 -1.2 7.3 -2.7 41 50 A V H > S+ 0 0 0 -31,-1.6 4,-2.1 1,-0.2 5,-0.2 0.887 103.9 51.3 -63.9 -40.8 0.5 9.3 -5.4 42 51 A K H > S+ 0 0 30 -32,-0.3 4,-2.6 1,-0.2 5,-0.2 0.929 107.6 54.7 -61.1 -44.4 0.5 12.5 -3.3 43 52 A E H X S+ 0 0 91 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.930 110.3 43.6 -53.6 -50.5 2.1 10.5 -0.4 44 53 A I H X S+ 0 0 2 -4,-1.9 4,-0.5 1,-0.2 -1,-0.2 0.861 111.8 54.5 -70.4 -33.3 5.0 9.3 -2.6 45 54 A A H ><>S+ 0 0 0 -4,-2.1 5,-2.5 -5,-0.2 3,-1.0 0.938 109.8 46.7 -60.2 -48.0 5.5 12.7 -4.1 46 55 A R H ><5S+ 0 0 114 -4,-2.6 3,-1.3 1,-0.3 -2,-0.2 0.889 107.5 56.1 -63.4 -41.0 5.8 14.3 -0.7 47 56 A Q H 3<5S+ 0 0 114 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.630 113.7 43.1 -65.3 -14.0 8.2 11.7 0.5 48 57 A N T <<5S- 0 0 62 -3,-1.0 -1,-0.3 -4,-0.5 -2,-0.2 0.157 113.5-110.1-123.1 19.1 10.4 12.6 -2.4 49 58 A E T < 5 + 0 0 173 -3,-1.3 -3,-0.2 1,-0.2 -4,-0.1 0.732 64.4 150.4 65.0 26.6 10.3 16.4 -2.5 50 59 A I < - 0 0 16 -5,-2.5 -1,-0.2 -6,-0.2 -2,-0.1 -0.803 52.2-111.6 -93.5 129.3 8.2 16.6 -5.6 51 60 A P - 0 0 74 0, 0.0 -20,-2.3 0, 0.0 2,-0.5 -0.316 32.4-140.8 -56.4 136.5 5.9 19.6 -6.0 52 61 A I E -c 31 0A 46 -22,-0.2 2,-0.5 -20,-0.0 -20,-0.2 -0.904 16.7-171.3-112.4 124.6 2.3 18.6 -5.8 53 62 A I E -c 32 0A 22 -22,-3.0 -20,-2.1 -2,-0.5 -23,-0.0 -0.967 4.8-179.8-117.3 126.7 -0.4 20.1 -8.0 54 63 A Q + 0 0 50 -2,-0.5 2,-0.1 -22,-0.2 -18,-0.1 -0.587 8.1 173.3-128.6 72.1 -4.1 19.3 -7.4 55 64 A P - 0 0 6 0, 0.0 3,-0.1 0, 0.0 27,-0.1 -0.449 29.5-148.0 -72.5 150.8 -6.4 21.1 -9.9 56 65 A F S S+ 0 0 172 1,-0.3 2,-0.3 -22,-0.1 -22,-0.0 0.670 88.2 14.3 -84.4 -20.8 -10.1 20.3 -9.8 57 66 A S - 0 0 55 25,-0.1 -1,-0.3 3,-0.0 6,-0.1 -0.991 54.4-156.4-154.6 142.3 -10.1 21.0 -13.6 58 67 A L S S+ 0 0 5 -2,-0.3 30,-0.1 25,-0.3 9,-0.1 0.273 88.7 73.0-105.2 10.5 -7.5 21.4 -16.3 59 68 A R S S+ 0 0 173 25,-0.1 -1,-0.1 4,-0.1 2,-0.1 0.705 70.3 106.8 -90.7 -23.5 -9.8 23.5 -18.6 60 69 A D S > S- 0 0 75 1,-0.1 4,-2.7 -3,-0.1 5,-0.3 -0.357 78.5-127.2 -56.9 126.2 -9.5 26.5 -16.4 61 70 A E H > S+ 0 0 147 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.873 105.3 49.2 -37.8 -56.1 -7.2 29.1 -18.0 62 71 A V H > S+ 0 0 90 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.947 114.1 41.0 -56.9 -58.9 -5.0 29.4 -15.0 63 72 A E H > S+ 0 0 41 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.867 113.9 55.2 -60.6 -38.2 -4.3 25.7 -14.3 64 73 A Q H X S+ 0 0 29 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.902 111.6 42.0 -61.9 -43.3 -3.9 25.0 -18.0 65 74 A E H X S+ 0 0 121 -4,-2.2 4,-1.5 -5,-0.3 -1,-0.2 0.804 108.8 58.9 -78.4 -29.5 -1.2 27.6 -18.5 66 75 A K H < S+ 0 0 96 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.918 111.2 43.8 -60.7 -43.4 0.6 26.7 -15.3 67 76 A L H >< S+ 0 0 1 -4,-1.9 3,-1.7 1,-0.2 4,-0.3 0.948 113.9 46.6 -66.9 -52.1 0.9 23.2 -16.7 68 77 A I H >< S+ 0 0 68 -4,-2.1 3,-0.6 1,-0.3 -1,-0.2 0.758 106.1 62.7 -65.7 -20.4 2.0 24.1 -20.2 69 78 A A T 3< S+ 0 0 79 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.409 79.0 89.1 -83.1 2.7 4.5 26.7 -18.8 70 79 A X T < S- 0 0 46 -3,-1.7 -1,-0.2 -5,-0.0 -2,-0.1 0.807 82.6-140.8 -74.5 -29.4 6.5 23.9 -17.0 71 80 A N < + 0 0 114 -3,-0.6 2,-0.2 -4,-0.3 -2,-0.1 0.958 39.5 161.2 65.8 51.4 8.8 23.2 -19.9 72 81 A A - 0 0 8 -4,-0.1 21,-0.5 1,-0.1 -67,-0.2 -0.572 45.7-134.0 -90.3 163.8 8.9 19.4 -19.5 73 82 A D S S- 0 0 22 -69,-2.8 21,-2.6 1,-0.3 2,-0.3 0.768 86.1 -1.7 -81.8 -30.8 10.0 17.1 -22.3 74 83 A V E -b 5 0A 0 -70,-1.7 -68,-2.1 19,-0.2 2,-0.5 -0.992 59.8-132.2-158.2 153.1 7.1 14.8 -21.7 75 84 A X E -bd 6 96A 0 20,-2.1 22,-3.1 -2,-0.3 2,-0.5 -0.976 20.0-156.6-112.7 127.8 4.0 14.3 -19.5 76 85 A V E -bd 7 97A 0 -70,-2.8 -68,-2.5 -2,-0.5 2,-0.5 -0.921 11.0-168.3-106.6 124.7 3.5 10.8 -18.1 77 86 A V E +bd 8 98A 5 20,-2.9 22,-1.6 -2,-0.5 2,-0.4 -0.952 13.2 168.7-121.6 122.7 -0.1 9.9 -17.2 78 87 A V E S-b 9 0A 0 -70,-2.7 -68,-0.6 -2,-0.5 -64,-0.1 -0.951 73.4 -24.8-135.0 115.6 -1.2 6.9 -15.2 79 88 A A S S+ 0 0 42 -2,-0.4 -69,-1.2 20,-0.3 2,-0.4 0.945 83.5 164.1 48.3 58.3 -4.8 6.5 -13.9 80 89 A Y - 0 0 29 -71,-0.2 -1,-0.2 -72,-0.1 -47,-0.1 -0.906 33.3-148.4-107.0 138.0 -5.5 10.3 -13.8 81 90 A G + 0 0 74 -2,-0.4 2,-0.3 2,-0.1 -1,-0.1 0.630 68.5 84.0 -83.9 -16.2 -9.1 11.4 -13.5 82 91 A L S S- 0 0 47 -27,-0.1 2,-0.3 -25,-0.0 -2,-0.1 -0.695 77.8-121.4 -93.4 140.3 -9.0 14.7 -15.5 83 92 A I - 0 0 100 -2,-0.3 -25,-0.3 1,-0.1 -2,-0.1 -0.590 29.4-125.1 -72.7 135.1 -9.3 14.9 -19.2 84 93 A L - 0 0 9 -2,-0.3 -25,-0.1 48,-0.2 5,-0.1 -0.775 23.5-129.0 -88.7 121.8 -6.3 16.6 -20.8 85 94 A P > - 0 0 13 0, 0.0 4,-1.7 0, 0.0 3,-0.4 -0.232 26.1-104.0 -63.1 153.8 -7.1 19.6 -23.0 86 95 A K H > S+ 0 0 117 1,-0.2 4,-1.2 2,-0.2 5,-0.1 0.863 122.3 51.8 -45.9 -46.8 -5.8 19.9 -26.5 87 96 A K H 4 S+ 0 0 131 1,-0.2 3,-0.5 2,-0.2 4,-0.3 0.898 105.4 55.3 -62.8 -40.6 -3.2 22.5 -25.4 88 97 A A H >4 S+ 0 0 2 -3,-0.4 3,-1.0 1,-0.2 4,-0.4 0.888 106.9 51.7 -55.2 -40.7 -2.0 20.2 -22.6 89 98 A L H 3< S+ 0 0 17 -4,-1.7 7,-0.3 1,-0.2 -1,-0.2 0.752 114.7 41.1 -70.6 -25.7 -1.4 17.5 -25.3 90 99 A N T 3< S+ 0 0 113 -4,-1.2 -1,-0.2 -3,-0.5 -2,-0.2 0.252 91.1 94.8-104.1 10.3 0.7 19.8 -27.4 91 100 A A S < S+ 0 0 25 -3,-1.0 2,-0.3 -4,-0.3 -1,-0.1 0.835 81.9 44.2 -72.5 -36.1 2.5 21.4 -24.5 92 101 A F S > S- 0 0 11 -4,-0.4 3,-1.8 -3,-0.2 -19,-0.2 -0.855 80.5-121.0-121.4 150.3 5.6 19.2 -24.5 93 102 A R T 3 S+ 0 0 139 -21,-0.5 -19,-0.2 -2,-0.3 -20,-0.1 0.815 114.9 40.4 -60.5 -34.4 7.9 18.0 -27.4 94 103 A L T 3 S- 0 0 27 -21,-2.6 -1,-0.3 1,-0.3 -20,-0.2 0.387 105.7-143.6 -93.7 3.3 7.3 14.3 -26.6 95 104 A G < - 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