==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSLATION 27-JUL-12 4B43 . COMPND 2 MOLECULE: TRANSLATION INITIATION FACTOR IF-2; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR A.SIMONETTI,A.URZHUMTSEV,B.P.KLAHOLZ . 346 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19853.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 250 72.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 23 6.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 56 16.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 21 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 103 29.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 1 0 2 1 1 0 0 1 0 0 0 0 0 0 0 1 0 0 0 1 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 1 0 1 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 PARALLEL BRIDGES PER LADDER . 1 3 1 3 1 1 0 0 1 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 . 2 0 0 0 1 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 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 0 119 0, 0.0 3,-0.7 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 -54.2 22.2 63.6 -16.6 2 2 A A T 3 - 0 0 67 1,-0.4 37,-0.1 41,-0.1 2,-0.0 -0.831 360.0 -0.2-139.3 96.1 23.0 66.4 -19.1 3 3 A K T 3 S+ 0 0 160 -2,-0.4 -1,-0.4 35,-0.3 2,-0.4 0.457 81.4 167.6-117.4 148.4 22.2 68.8 -17.7 4 4 A V E < -A 38 0A 8 -3,-0.7 34,-3.1 34,-0.6 2,-0.2 -0.826 26.6-136.1-108.4 141.5 20.8 68.5 -14.3 5 5 A R E >> -A 37 0A 106 -2,-0.4 4,-2.6 32,-0.3 3,-0.7 -0.627 31.1-110.8 -85.3 154.9 20.2 71.2 -11.7 6 6 A I H 3> S+ 0 0 0 30,-2.5 4,-2.5 1,-0.3 29,-0.2 0.913 117.9 51.9 -57.2 -41.5 21.2 70.4 -8.1 7 7 A Y H 3> S+ 0 0 108 27,-1.9 4,-1.8 1,-0.2 -1,-0.3 0.843 111.3 49.2 -65.1 -26.8 17.5 70.3 -6.9 8 8 A Q H <> S+ 0 0 88 -3,-0.7 4,-2.2 26,-0.2 -1,-0.2 0.902 110.1 48.7 -74.3 -41.4 16.7 67.8 -9.6 9 9 A L H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.900 110.0 53.9 -67.5 -37.8 19.7 65.6 -8.8 10 10 A A H X>S+ 0 0 6 -4,-2.5 5,-2.3 -5,-0.3 4,-1.2 0.940 108.7 48.0 -58.3 -50.4 18.7 65.7 -5.1 11 11 A K H ><5S+ 0 0 184 -4,-1.8 3,-0.6 1,-0.2 -1,-0.2 0.927 112.1 50.8 -55.8 -44.9 15.2 64.5 -5.9 12 12 A E H 3<5S+ 0 0 106 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.870 116.7 38.6 -62.9 -40.5 16.6 61.7 -8.1 13 13 A L H 3<5S- 0 0 27 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.2 0.533 110.2-119.0 -89.2 -6.3 19.0 60.5 -5.5 14 14 A G T <<5 + 0 0 58 -4,-1.2 2,-0.3 -3,-0.6 -3,-0.2 0.907 64.8 140.0 65.3 46.4 16.6 61.0 -2.6 15 15 A M < - 0 0 26 -5,-2.3 -1,-0.2 -6,-0.1 2,-0.2 -0.867 55.7-112.2-117.8 153.6 18.7 63.4 -0.7 16 16 A E >> - 0 0 127 -2,-0.3 4,-2.2 1,-0.1 3,-0.6 -0.566 34.5-112.9 -78.6 146.3 17.9 66.6 1.1 17 17 A T H 3> S+ 0 0 34 1,-0.3 4,-2.7 -2,-0.2 5,-0.2 0.897 115.8 47.5 -41.4 -58.7 19.1 69.8 -0.4 18 18 A Q H 3> S+ 0 0 133 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.829 108.3 56.2 -64.0 -31.1 21.6 70.6 2.3 19 19 A E H <> S+ 0 0 104 -3,-0.6 4,-2.6 2,-0.2 -1,-0.2 0.944 110.9 43.8 -63.6 -46.1 23.0 67.0 2.2 20 20 A L H X S+ 0 0 0 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.938 111.9 53.0 -65.6 -40.2 23.8 67.3 -1.5 21 21 A L H X S+ 0 0 17 -4,-2.7 4,-1.9 -5,-0.3 -2,-0.2 0.909 109.7 49.9 -63.0 -40.0 25.2 70.8 -1.0 22 22 A E H X S+ 0 0 116 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.929 109.6 51.0 -58.2 -50.3 27.5 69.3 1.7 23 23 A L H X S+ 0 0 4 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.955 108.5 50.8 -55.2 -48.6 28.6 66.5 -0.6 24 24 A L H X>S+ 0 0 0 -4,-2.8 5,-2.6 1,-0.3 4,-0.5 0.847 108.3 52.8 -61.5 -36.4 29.5 69.0 -3.4 25 25 A D H ><5S+ 0 0 101 -4,-1.9 3,-1.0 -5,-0.2 -1,-0.3 0.915 107.6 51.6 -59.4 -45.4 31.5 71.0 -0.9 26 26 A Q H 3<5S+ 0 0 123 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.858 112.5 46.7 -57.4 -34.9 33.4 67.8 0.0 27 27 A M H 3<5S- 0 0 58 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.523 112.6-119.2 -87.6 -4.1 34.0 67.2 -3.7 28 28 A G T <<5 + 0 0 64 -3,-1.0 2,-0.8 -4,-0.5 -3,-0.2 0.695 61.1 150.4 71.0 18.9 35.2 70.8 -4.3 29 29 A V < - 0 0 17 -5,-2.6 -1,-0.2 -6,-0.2 -2,-0.1 -0.765 37.1-144.2 -88.0 115.7 32.3 71.4 -6.8 30 30 A A + 0 0 95 -2,-0.8 2,-0.3 -3,-0.1 -5,-0.0 -0.411 26.9 163.4 -77.1 151.2 31.4 75.1 -6.8 31 31 A Y - 0 0 68 -2,-0.1 3,-0.1 1,-0.1 7,-0.0 -0.960 38.8-136.6-160.2 158.4 27.8 76.2 -7.2 32 32 A K S S- 0 0 198 1,-0.3 2,-0.3 -2,-0.3 -1,-0.1 0.868 80.1 -31.7 -88.8 -41.7 25.7 79.3 -6.6 33 33 A S S > S- 0 0 47 -12,-0.0 3,-2.3 0, 0.0 -1,-0.3 -0.921 75.9 -76.8-164.8 176.3 22.6 77.7 -5.1 34 34 A H T 3 S+ 0 0 82 1,-0.3 -27,-1.9 -2,-0.3 -26,-0.2 0.607 126.7 66.3 -65.8 -6.6 20.6 74.5 -5.3 35 35 A A T 3 S+ 0 0 38 -29,-0.2 -1,-0.3 -30,-0.1 -27,-0.0 0.544 78.5 111.8 -85.7 -7.1 19.3 76.0 -8.5 36 36 A S S < S- 0 0 24 -3,-2.3 -30,-2.5 -31,-0.1 2,-0.4 -0.274 70.5-116.9 -69.3 154.9 22.7 75.8 -10.2 37 37 A T E -A 5 0A 62 -32,-0.2 2,-0.4 -31,-0.1 -32,-0.3 -0.704 23.3-138.7 -90.4 138.8 23.3 73.5 -13.1 38 38 A L E -A 4 0A 4 -34,-3.1 -34,-0.6 -2,-0.4 -35,-0.3 -0.791 17.4-117.1 -98.1 138.7 25.8 70.7 -12.8 39 39 A E >> - 0 0 109 -2,-0.4 4,-2.5 1,-0.1 3,-1.0 -0.420 33.5-114.3 -61.0 144.7 28.3 69.6 -15.5 40 40 A E H 3> S+ 0 0 106 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.862 116.1 53.8 -55.9 -38.8 27.6 66.1 -16.6 41 41 A K H 3> S+ 0 0 144 2,-0.2 4,-1.6 1,-0.2 -1,-0.3 0.779 109.6 48.1 -71.5 -25.5 30.9 64.8 -15.2 42 42 A D H <> S+ 0 0 37 -3,-1.0 4,-2.6 2,-0.2 -2,-0.2 0.932 111.8 48.2 -77.3 -46.8 30.2 66.3 -11.8 43 43 A A H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.900 112.8 49.4 -58.4 -41.6 26.7 64.9 -11.6 44 44 A E H X S+ 0 0 71 -4,-2.5 4,-2.5 -5,-0.2 -1,-0.2 0.932 109.7 50.9 -62.4 -48.0 28.1 61.5 -12.6 45 45 A A H X S+ 0 0 42 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.891 110.6 50.8 -53.7 -43.0 30.8 61.8 -10.0 46 46 A V H X S+ 0 0 0 -4,-2.6 4,-2.8 2,-0.2 5,-0.3 0.960 108.1 50.5 -62.3 -50.7 28.0 62.6 -7.4 47 47 A R H X S+ 0 0 22 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.895 113.9 46.4 -52.2 -43.8 25.9 59.6 -8.4 48 48 A E H X S+ 0 0 94 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.874 112.9 47.7 -66.0 -43.4 29.0 57.3 -8.1 49 49 A L H X S+ 0 0 49 -4,-2.3 4,-2.9 -5,-0.2 5,-0.2 0.921 112.5 48.5 -68.4 -42.6 30.1 58.7 -4.8 50 50 A V H X S+ 0 0 7 -4,-2.8 4,-1.8 2,-0.2 5,-0.2 0.895 110.9 51.1 -64.9 -42.7 26.6 58.5 -3.2 51 51 A K H X S+ 0 0 130 -4,-2.0 4,-2.2 -5,-0.3 -1,-0.2 0.934 114.0 45.0 -56.6 -48.6 26.2 54.9 -4.4 52 52 A E H X S+ 0 0 126 -4,-2.0 4,-3.1 2,-0.2 -2,-0.2 0.950 111.0 50.7 -63.9 -52.3 29.5 54.0 -2.9 53 53 A Q H X S+ 0 0 78 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.836 113.4 47.5 -56.2 -33.0 28.9 55.8 0.4 54 54 A R H X S+ 0 0 109 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.845 109.5 53.0 -78.4 -35.1 25.6 54.0 0.7 55 55 A G H X S+ 0 0 42 -4,-2.2 4,-2.6 -5,-0.2 -2,-0.2 0.966 111.0 47.8 -55.7 -50.5 27.2 50.7 -0.2 56 56 A L H X S+ 0 0 118 -4,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.875 108.2 53.3 -63.9 -42.0 29.7 51.3 2.6 57 57 A Q H X S+ 0 0 127 -4,-2.0 4,-2.5 -5,-0.2 -1,-0.2 0.940 111.2 46.9 -56.0 -48.2 27.1 52.3 5.2 58 58 A E H X S+ 0 0 99 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.914 109.2 52.7 -65.5 -46.8 25.2 49.1 4.5 59 59 A K H X S+ 0 0 128 -4,-2.6 4,-1.5 1,-0.2 -1,-0.2 0.943 112.9 47.0 -46.5 -52.0 28.3 46.9 4.7 60 60 A L H X S+ 0 0 106 -4,-2.3 4,-2.0 1,-0.2 3,-0.3 0.902 111.5 47.9 -62.9 -46.4 29.1 48.5 8.1 61 61 A A H X S+ 0 0 38 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.846 109.3 55.0 -66.2 -32.2 25.6 48.1 9.5 62 62 A E H X S+ 0 0 92 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.790 107.6 50.2 -71.5 -30.1 25.5 44.4 8.3 63 63 A E H X S+ 0 0 107 -4,-1.5 4,-1.8 -3,-0.3 -2,-0.2 0.892 105.8 55.0 -71.2 -43.2 28.7 43.8 10.2 64 64 A E H < S+ 0 0 117 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.911 114.5 41.5 -58.7 -42.2 27.3 45.4 13.4 65 65 A R H >< S+ 0 0 137 -4,-1.7 3,-2.3 1,-0.2 -1,-0.2 0.930 108.7 56.4 -68.6 -50.9 24.3 43.0 13.3 66 66 A R H 3< S+ 0 0 174 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.822 101.8 58.4 -56.3 -34.2 26.1 39.8 12.3 67 67 A K T 3< S+ 0 0 145 -4,-1.8 2,-0.7 -5,-0.1 -1,-0.3 0.423 88.0 84.7 -79.5 1.4 28.4 40.0 15.3 68 68 A S S < S- 0 0 83 -3,-2.3 -1,-0.1 -5,-0.1 -4,-0.0 -0.908 76.8-147.9-103.5 109.6 25.4 40.0 17.7 69 69 A L - 0 0 56 -2,-0.7 165,-0.2 1,-0.1 -2,-0.1 -0.442 16.5-107.6 -81.4 147.5 24.6 36.3 18.2 70 70 A P - 0 0 65 0, 0.0 163,-2.2 0, 0.0 -1,-0.1 -0.363 39.3 -95.2 -69.0 154.5 21.0 35.1 18.8 71 71 A R B -B 232 0B 95 161,-0.2 161,-0.3 163,-0.0 160,-0.0 -0.216 34.5-156.6 -56.1 146.3 19.9 33.9 22.2 72 72 A R - 0 0 54 159,-2.1 159,-0.1 225,-0.0 225,-0.1 -0.960 27.7-100.7-123.4 152.5 19.9 30.2 23.0 73 73 A P - 0 0 29 0, 0.0 49,-0.2 0, 0.0 2,-0.1 -0.355 39.0 -99.5 -73.9 151.2 17.7 28.6 25.6 74 74 A P - 0 0 1 0, 0.0 49,-2.5 0, 0.0 2,-0.5 -0.438 32.6-141.1 -64.3 139.3 19.0 27.7 29.1 75 75 A V E -c 123 0C 7 47,-0.2 62,-2.5 -2,-0.1 63,-2.0 -0.918 23.5-169.2-106.1 128.3 19.8 24.0 29.4 76 76 A V E -cd 124 138C 0 47,-3.0 49,-2.8 -2,-0.5 2,-0.4 -0.929 15.3-163.0-125.4 136.8 18.8 22.5 32.8 77 77 A V E - d 0 139C 17 61,-2.3 63,-2.9 -2,-0.4 2,-0.5 -0.927 14.1-143.3-113.9 142.3 19.5 19.3 34.6 78 78 A I E + d 0 140C 1 -2,-0.4 51,-0.9 47,-0.4 2,-0.3 -0.910 31.7 160.9-103.7 131.2 17.4 18.1 37.6 79 79 A M E + d 0 141C 11 61,-2.8 63,-3.1 -2,-0.5 2,-0.2 -0.871 13.4 94.0-145.5 167.5 19.4 16.2 40.4 80 80 A G E S- d 0 142C 10 49,-0.3 63,-0.1 -2,-0.3 2,-0.1 -0.796 79.8 -15.0 136.9-171.8 19.2 15.2 44.0 81 81 A H > - 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