==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-JUL-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSLATION 10-OCT-11 2LKD . COMPND 2 MOLECULE: TRANSLATION INITIATION FACTOR IF-2; . SOURCE 2 ORGANISM_SCIENTIFIC: GEOBACILLUS STEAROTHERMOPHILUS; . AUTHOR H.WIENK,E.TISHCHENKO,R.BELARDINELLI,S.TOMASELLI,R.DONGRE,R.S . 178 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9948.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 114 64.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 10.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 3.4 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 . 1 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 . 25 14.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 42 23.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 2.2 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 0 0 0 0 1 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 1 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 0 PARALLEL BRIDGES PER LADDER . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 G 0 0 107 0, 0.0 2,-2.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 169.7 -24.7 -14.6 -16.7 2 2 A S + 0 0 138 1,-0.2 3,-0.1 3,-0.0 0, 0.0 -0.404 360.0 107.7 -81.7 64.2 -26.5 -11.3 -17.6 3 3 A H + 0 0 188 -2,-2.2 2,-0.3 1,-0.1 -1,-0.2 -0.059 69.9 62.0-126.8 27.8 -28.2 -11.1 -14.2 4 4 A M + 0 0 132 -3,-0.1 3,-0.1 1,-0.1 -1,-0.1 -0.973 36.9 151.3-154.4 136.7 -26.1 -8.2 -12.9 5 5 A V + 0 0 125 -2,-0.3 2,-0.6 1,-0.2 -1,-0.1 0.449 60.6 80.5-139.6 -23.2 -25.5 -4.6 -14.1 6 6 A E - 0 0 161 2,-0.0 -1,-0.2 1,-0.0 0, 0.0 -0.825 59.5-170.6 -92.3 119.4 -24.7 -2.7 -10.9 7 7 A R - 0 0 153 -2,-0.6 -3,-0.0 -3,-0.1 -1,-0.0 -0.820 8.4-178.5-118.1 91.9 -21.1 -3.2 -10.0 8 8 A P - 0 0 39 0, 0.0 2,-0.1 0, 0.0 48,-0.1 -0.807 32.0-127.3 -85.4 109.0 -20.0 -1.9 -6.6 9 9 A P - 0 0 16 0, 0.0 49,-1.9 0, 0.0 2,-1.7 -0.358 12.5-133.1 -60.9 128.3 -16.3 -2.6 -6.3 10 10 A V - 0 0 0 47,-0.2 2,-1.9 -2,-0.1 58,-0.2 -0.590 22.6-170.9 -87.0 79.9 -15.5 -4.5 -3.1 11 11 A V - 0 0 2 -2,-1.7 49,-1.8 47,-0.3 71,-0.2 -0.538 15.7-152.2 -73.0 84.4 -12.5 -2.4 -1.9 12 12 A T E -a 82 0A 1 -2,-1.9 71,-3.0 69,-0.7 2,-0.5 -0.410 3.2-141.5 -62.2 127.1 -11.5 -4.7 0.9 13 13 A I E +a 83 0A 12 69,-0.2 2,-0.2 -2,-0.2 71,-0.2 -0.809 36.9 148.9 -92.6 129.9 -9.8 -2.9 3.8 14 14 A M E +a 84 0A 23 69,-2.7 71,-3.1 -2,-0.5 2,-0.3 -0.781 6.0 107.2-143.8-171.6 -6.9 -4.8 5.3 15 15 A G E -a 85 0A 0 80,-0.3 2,-0.2 69,-0.3 71,-0.2 -0.920 69.9 -23.9 130.0-158.6 -3.6 -4.3 7.0 16 16 A H > - 0 0 20 69,-1.8 3,-0.6 -2,-0.3 5,-0.1 -0.548 63.3-106.1 -91.0 157.1 -2.4 -4.6 10.5 17 17 A V T 3 S+ 0 0 67 1,-0.2 -1,-0.1 -2,-0.2 79,-0.1 -0.403 104.6 29.5 -73.5 154.6 -4.5 -4.4 13.7 18 18 A D T 3 S+ 0 0 108 1,-0.1 -1,-0.2 -2,-0.1 -2,-0.0 0.172 101.1 86.9 74.8 -18.9 -4.2 -1.3 15.9 19 19 A H S < S- 0 0 0 -3,-0.6 -2,-0.2 66,-0.1 -1,-0.1 0.475 124.4 -81.5 -83.0 -4.9 -3.5 0.5 12.6 20 20 A G > + 0 0 2 65,-0.1 4,-1.1 95,-0.1 5,-0.1 0.844 67.1 163.5 111.0 47.3 -7.3 0.7 12.4 21 21 A K T 4 S+ 0 0 69 2,-0.1 4,-0.2 1,-0.1 -4,-0.1 0.983 92.4 3.2 -50.6 -66.6 -8.8 -2.5 11.1 22 22 A T T >> S+ 0 0 97 2,-0.1 3,-1.0 1,-0.1 4,-0.8 0.772 123.8 71.4 -94.2 -30.7 -12.4 -1.6 12.3 23 23 A T H 3> S+ 0 0 95 1,-0.3 4,-3.1 2,-0.2 3,-0.2 0.780 95.5 55.3 -58.0 -27.5 -11.7 1.8 13.7 24 24 A L H 3X S+ 0 0 5 -4,-1.1 4,-2.2 2,-0.2 -1,-0.3 0.779 100.3 57.8 -78.6 -25.3 -11.3 3.2 10.1 25 25 A L H <4 S+ 0 0 8 -3,-1.0 4,-0.3 -4,-0.2 -1,-0.2 0.680 115.6 38.5 -74.9 -17.1 -14.7 1.9 9.2 26 26 A D H >X S+ 0 0 54 -4,-0.8 4,-2.7 -3,-0.2 3,-0.6 0.827 114.8 52.0 -91.1 -45.7 -15.8 4.1 12.1 27 27 A A H 3< S+ 0 0 8 -4,-3.1 -2,-0.2 1,-0.3 -3,-0.2 0.828 106.6 55.9 -58.4 -34.1 -13.4 6.9 11.3 28 28 A I T >X S+ 0 0 18 -4,-2.2 4,-0.8 1,-0.2 3,-0.6 0.812 109.8 44.7 -72.1 -31.0 -14.7 6.8 7.7 29 29 A R T <4 S+ 0 0 24 -3,-0.6 3,-0.5 -4,-0.3 -2,-0.2 0.871 110.5 54.4 -78.0 -38.8 -18.3 7.3 8.9 30 30 A H T 3< S+ 0 0 108 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.011 103.6 59.2 -87.0 26.8 -17.2 10.0 11.3 31 31 A S T <4 S- 0 0 31 -3,-0.6 2,-0.3 1,-0.5 -1,-0.2 0.560 122.7 -64.7-114.3 -35.7 -15.6 11.8 8.4 32 32 A K S < S+ 0 0 64 -4,-0.8 2,-1.4 -3,-0.5 -1,-0.5 -0.935 100.7 60.7 176.0-158.8 -18.7 12.2 6.3 33 33 A V S S+ 0 0 44 -2,-0.3 2,-0.5 18,-0.2 -4,-0.1 -0.281 101.2 44.3 49.9 -80.2 -21.5 10.3 4.4 34 34 A T + 0 0 13 -2,-1.4 -2,-0.2 -6,-0.2 -3,-0.2 -0.808 50.0 140.7-105.3 129.2 -23.1 8.2 7.2 35 35 A E S S+ 0 0 135 -2,-0.5 -1,-0.2 -5,-0.1 -6,-0.0 0.630 89.9 13.1-123.2 -49.9 -23.9 9.5 10.7 36 36 A Q S S+ 0 0 156 2,-0.1 2,-0.2 0, 0.0 -2,-0.1 0.442 97.2 117.7-109.9 -7.7 -27.3 8.0 11.6 37 37 A E S S- 0 0 87 1,-0.1 2,-2.1 -4,-0.1 -3,-0.0 -0.456 70.5-126.7 -66.1 131.1 -27.3 5.4 8.8 38 38 A A S S+ 0 0 68 -2,-0.2 2,-0.3 2,-0.1 -1,-0.1 -0.510 74.0 93.3 -82.2 72.9 -27.2 1.8 10.2 39 39 A G + 0 0 19 -2,-2.1 2,-1.8 2,-0.2 9,-0.2 -0.985 68.0 24.7-158.0 159.4 -24.2 0.7 8.2 40 40 A G B S+D 47 0B 6 7,-2.1 7,-1.8 -2,-0.3 2,-0.5 -0.519 122.3 32.8 85.4 -72.4 -20.5 0.3 8.5 41 41 A I S S+ 0 0 51 -2,-1.8 -2,-0.2 5,-0.2 5,-0.1 -0.904 93.9 75.8-126.1 100.5 -20.3 0.1 12.3 42 42 A T S S- 0 0 82 -2,-0.5 3,-0.1 3,-0.3 4,-0.1 -0.062 87.1 -97.2-157.0 -83.8 -23.2 -1.6 14.1 43 43 A Q S S+ 0 0 183 2,-0.5 2,-0.7 1,-0.4 -1,-0.0 -0.031 95.2 83.1 178.5 -58.9 -23.6 -5.3 14.1 44 44 A H S S- 0 0 115 -3,-0.1 -1,-0.4 -5,-0.0 -3,-0.0 -0.618 111.1 -14.2 -68.9 109.8 -26.1 -6.4 11.4 45 45 A I S S- 0 0 122 -2,-0.7 -2,-0.5 -3,-0.1 2,-0.3 0.304 81.9-114.9 68.9 154.9 -23.9 -6.5 8.4 46 46 A G - 0 0 38 15,-0.2 15,-0.2 -5,-0.1 -5,-0.2 -0.932 65.4 -0.3-126.1 150.2 -20.4 -5.0 8.3 47 47 A A B -D 40 0B 6 -7,-1.8 -7,-2.1 -2,-0.3 2,-0.3 -0.053 67.6-145.1 64.9-172.6 -18.9 -2.1 6.3 48 48 A Y - 0 0 22 -9,-0.2 11,-1.6 11,-0.2 2,-0.7 -0.978 24.1 -76.5-174.2 174.7 -20.9 -0.1 3.7 49 49 A Q B -E 58 0C 85 -2,-0.3 2,-0.2 9,-0.2 9,-0.2 -0.844 47.3-144.1 -95.6 111.7 -20.9 1.8 0.5 50 50 A V - 0 0 3 7,-2.1 2,-1.3 -2,-0.7 3,-0.5 -0.544 9.0-129.5 -82.2 140.9 -19.2 5.2 0.9 51 51 A T + 0 0 63 -2,-0.2 -18,-0.2 4,-0.2 -1,-0.1 -0.669 62.6 124.9 -93.4 84.3 -20.5 8.2 -0.9 52 52 A V S S- 0 0 32 -2,-1.3 -1,-0.2 110,-0.0 5,-0.0 0.632 102.7 -4.1 -99.8 -28.4 -17.5 9.8 -2.5 53 53 A N S S- 0 0 56 -3,-0.5 -2,-0.1 4,-0.0 4,-0.0 0.602 139.8 -40.7-125.7 -59.9 -19.2 9.6 -5.9 54 54 A D S S- 0 0 104 -4,-0.4 -3,-0.2 0, 0.0 3,-0.1 -0.010 99.8 -65.5-171.3 43.0 -22.5 7.8 -5.3 55 55 A K S S+ 0 0 109 -5,-0.4 2,-1.9 1,-0.2 -4,-0.2 0.625 85.3 148.4 74.0 17.3 -21.7 5.0 -2.9 56 56 A K + 0 0 51 -7,-0.1 -1,-0.2 1,-0.1 -5,-0.0 -0.552 49.5 69.3 -86.6 76.4 -19.5 3.3 -5.5 57 57 A I - 0 0 2 -2,-1.9 -7,-2.1 -3,-0.1 2,-1.1 -0.267 58.8-167.3 175.6 93.6 -17.1 1.7 -3.0 58 58 A T B -E 49 0C 7 -49,-1.9 -47,-0.3 -9,-0.2 -9,-0.2 -0.774 23.7-145.5 -90.9 95.9 -18.1 -1.1 -0.8 59 59 A F - 0 0 3 -11,-1.6 2,-1.3 -2,-1.1 -47,-0.3 -0.223 68.5 -0.7 -59.2 150.5 -15.3 -1.3 1.7 60 60 A L S S- 0 0 53 -49,-1.8 8,-0.4 -13,-0.1 7,-0.4 -0.546 117.6 -53.2 72.1 -91.4 -14.3 -4.7 3.1 61 61 A D - 0 0 33 -2,-1.3 5,-0.2 -15,-0.2 -15,-0.2 -0.985 36.8-129.7-170.4 165.8 -16.8 -7.0 1.3 62 62 A T B > -F 65 0D 51 3,-0.7 3,-3.2 -2,-0.3 2,-0.3 -0.996 45.2 -93.1-129.5 136.0 -20.4 -7.8 0.5 63 63 A P T 3 S+ 0 0 96 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 -0.265 117.4 24.0 -50.3 106.4 -22.1 -11.2 1.0 64 64 A G T 3 S+ 0 0 41 -2,-0.3 8,-0.0 0, 0.0 2,-0.0 0.076 120.4 57.7 122.6 -22.8 -21.7 -12.8 -2.4 65 65 A H B < +F 62 0D 76 -3,-3.2 -3,-0.7 7,-0.0 2,-0.5 -0.487 62.8 159.5-138.5 63.2 -18.7 -10.9 -3.6 66 66 A E + 0 0 22 -5,-0.2 6,-0.4 1,-0.2 8,-0.1 -0.784 3.2 164.0 -88.8 125.6 -15.9 -11.4 -1.1 67 67 A A S S+ 0 0 7 -2,-0.5 -1,-0.2 -7,-0.4 10,-0.1 0.827 75.1 9.9-105.4 -65.0 -12.5 -10.6 -2.6 68 68 A F S S+ 0 0 6 -8,-0.4 3,-0.2 -58,-0.2 -7,-0.1 0.593 124.6 60.3 -99.5 -12.4 -9.8 -10.2 0.1 69 69 A T S S- 0 0 63 1,-0.3 2,-0.3 -9,-0.3 -1,-0.1 0.943 127.9 -18.7 -74.5 -52.1 -11.9 -11.3 3.0 70 70 A T - 0 0 88 4,-0.0 2,-0.8 0, 0.0 -1,-0.3 -0.970 58.3-137.0-156.0 140.1 -12.5 -14.8 1.6 71 71 A M + 0 0 65 -2,-0.3 -4,-0.1 1,-0.2 4,-0.1 -0.832 22.6 174.0-105.8 97.5 -12.2 -16.3 -1.9 72 72 A R S S- 0 0 165 -2,-0.8 -1,-0.2 -6,-0.4 -5,-0.1 0.972 91.5 -3.7 -62.9 -57.0 -15.2 -18.5 -2.6 73 73 A A S S- 0 0 83 1,-0.0 2,-3.0 0, 0.0 -1,-0.2 0.175 92.5-130.1-121.4 13.2 -14.3 -19.2 -6.2 74 74 A R S > S+ 0 0 188 1,-0.2 2,-2.4 -8,-0.1 3,-0.6 -0.287 92.2 85.0 70.2 -56.1 -11.3 -16.9 -6.4 75 75 A G T 3 + 0 0 66 -2,-3.0 -1,-0.2 1,-0.2 -8,-0.1 -0.268 47.8 112.2 -78.9 55.3 -12.6 -15.2 -9.5 76 76 A A T 3 + 0 0 22 -2,-2.4 2,-0.4 -10,-0.1 -1,-0.2 0.388 54.4 102.6 -97.8 -1.3 -14.8 -12.6 -7.8 77 77 A Q < + 0 0 89 -3,-0.6 -11,-0.0 1,-0.2 -10,-0.0 -0.695 30.7 154.3 -87.4 128.5 -12.5 -9.9 -9.0 78 78 A V S S- 0 0 90 -2,-0.4 -1,-0.2 0, 0.0 -3,-0.0 0.678 88.9 -34.8-114.4 -48.9 -13.5 -7.8 -11.9 79 79 A T S S+ 0 0 80 2,-0.0 -2,-0.1 29,-0.0 2,-0.0 -0.059 92.6 154.3-165.0 39.4 -11.5 -4.6 -11.3 80 80 A D - 0 0 5 -70,-0.1 2,-0.3 -72,-0.0 -69,-0.1 -0.236 29.9-142.2 -81.2 166.0 -11.6 -4.4 -7.5 81 81 A I - 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