==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-OCT-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSLATION 26-AUG-13 3J4J . COMPND 2 MOLECULE: TRANSLATION INITIATION FACTOR IF-2; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR A.SIMONETTI,S.MARZI,I.M.L.BILLAS,A.TSAI,A.FABBRETTI,A.MYASNI . 569 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 35404.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 353 62.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 24 4.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 82 14.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 48 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 46 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 124 21.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 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 1 2 1 1 3 0 0 2 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 1 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 0 PARALLEL BRIDGES PER LADDER . 5 3 4 3 3 0 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 . 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 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 0 170 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 168.9 -40.8 90.8 -6.8 2 2 A A + 0 0 109 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.942 360.0 37.7 53.3 56.7 -39.5 91.0 -10.4 3 3 A K S S- 0 0 187 2,-0.0 2,-0.3 0, 0.0 34,-0.0 0.420 87.5-160.3-106.1-176.1 -39.4 94.3 -10.2 4 4 A V - 0 0 56 -2,-0.1 34,-0.4 34,-0.1 2,-0.3 -0.995 17.5-149.4-129.4 131.0 -38.3 96.1 -6.9 5 5 A R >> - 0 0 137 -2,-0.3 4,-1.7 1,-0.1 3,-1.3 -0.764 31.8-123.2 -97.5 138.1 -38.4 99.4 -4.9 6 6 A I H 3> S+ 0 0 6 28,-0.7 4,-1.8 30,-0.6 29,-0.2 0.869 113.2 61.2 -43.2 -41.2 -35.5 100.3 -2.6 7 7 A Y H 3> S+ 0 0 116 27,-0.9 4,-1.3 2,-0.2 -1,-0.2 0.804 106.8 44.7 -50.2 -33.4 -38.0 100.6 0.4 8 8 A Q H <> S+ 0 0 90 -3,-1.3 4,-1.6 2,-0.2 -2,-0.2 0.885 107.6 58.0 -77.7 -40.5 -38.9 96.8 -0.2 9 9 A L H X S+ 0 0 24 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.845 109.4 47.5 -50.9 -44.6 -35.1 96.0 -0.5 10 10 A A H X>S+ 0 0 8 -4,-1.8 4,-2.3 2,-0.2 5,-2.1 0.831 110.7 48.1 -64.2 -45.1 -34.8 97.5 3.1 11 11 A K H <5S+ 0 0 188 -4,-1.3 -2,-0.2 3,-0.2 -1,-0.2 0.768 115.9 46.6 -69.1 -28.1 -37.9 95.6 4.7 12 12 A E H <5S+ 0 0 118 -4,-1.6 -2,-0.2 1,-0.1 -3,-0.2 0.845 118.4 39.8 -71.5 -57.4 -36.5 92.3 3.1 13 13 A L H <5S- 0 0 73 -4,-2.2 -2,-0.2 -5,-0.2 -3,-0.2 0.942 108.3-123.4 -55.5 -56.2 -32.8 92.9 4.3 14 14 A G T <5 + 0 0 72 -4,-2.3 2,-0.3 1,-0.3 -3,-0.2 0.645 66.9 128.2 100.7 49.8 -34.0 94.3 7.7 15 15 A M < - 0 0 65 -5,-2.1 -1,-0.3 -6,-0.1 -2,-0.1 -0.914 61.6 -97.0-130.1 144.4 -32.2 97.7 7.3 16 16 A E > - 0 0 128 -2,-0.3 4,-2.5 1,-0.1 5,-0.3 -0.152 30.3-117.7 -66.2 144.4 -33.2 101.5 7.6 17 17 A T H > S+ 0 0 62 1,-0.2 4,-1.0 2,-0.2 -1,-0.1 0.919 121.1 44.8 -38.3 -40.1 -34.2 103.6 4.5 18 18 A Q H > S+ 0 0 134 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.824 108.0 54.7 -85.5 -36.0 -31.1 105.8 5.4 19 19 A E H > S+ 0 0 109 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.914 111.1 47.3 -52.9 -50.3 -28.7 102.8 6.1 20 20 A L H X S+ 0 0 1 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.798 111.1 50.4 -64.5 -32.8 -29.6 101.5 2.5 21 21 A L H X S+ 0 0 26 -4,-1.0 4,-3.1 -5,-0.3 -2,-0.2 0.931 108.1 53.7 -67.5 -46.9 -29.0 104.9 1.1 22 22 A E H X S+ 0 0 130 -4,-2.4 4,-0.8 2,-0.2 -2,-0.2 0.806 109.1 49.5 -50.1 -39.7 -25.6 105.0 3.0 23 23 A L H >X S+ 0 0 30 -4,-1.7 4,-1.7 2,-0.2 3,-0.7 0.903 112.3 45.6 -66.2 -48.4 -24.7 101.7 1.3 24 24 A L H 3X>S+ 0 0 2 -4,-2.1 5,-1.3 1,-0.2 4,-1.2 0.907 109.8 56.1 -64.1 -39.0 -25.7 103.1 -2.2 25 25 A D H 3<5S+ 0 0 102 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.667 110.8 45.0 -65.9 -20.2 -23.7 106.4 -1.3 26 26 A Q H <<5S+ 0 0 149 -4,-0.8 -1,-0.2 -3,-0.7 -2,-0.2 0.702 109.1 55.6 -83.8 -37.8 -20.5 104.2 -0.7 27 27 A M H <5S- 0 0 63 -4,-1.7 -2,-0.2 -5,-0.1 -3,-0.1 0.791 108.9-124.3 -63.2 -20.5 -21.0 102.1 -3.8 28 28 A G T <5 + 0 0 74 -4,-1.2 2,-0.3 1,-0.2 -3,-0.2 0.724 54.7 159.6 75.2 22.5 -21.1 105.4 -6.0 29 29 A V < - 0 0 25 -5,-1.3 2,-0.3 1,-0.1 -1,-0.2 -0.615 39.5-127.2 -77.1 123.4 -24.6 104.3 -7.4 30 30 A A + 0 0 95 -2,-0.3 2,-0.3 -5,-0.0 -1,-0.1 -0.565 38.8 164.2 -80.0 133.9 -26.7 107.2 -8.9 31 31 A Y - 0 0 77 -2,-0.3 3,-0.1 1,-0.1 7,-0.0 -0.910 35.7-159.0-145.2 157.0 -30.3 107.5 -7.5 32 32 A K S S- 0 0 193 1,-0.5 2,-0.2 -2,-0.3 -1,-0.1 0.657 78.3 -26.7-103.0 -48.2 -33.2 110.2 -7.4 33 33 A S S > S- 0 0 58 0, 0.0 3,-1.6 0, 0.0 -1,-0.5 -0.841 71.9 -86.2-156.8 171.7 -35.1 108.9 -4.3 34 34 A H T 3 S+ 0 0 75 1,-0.2 -27,-0.9 -2,-0.2 -28,-0.7 0.725 126.2 64.4 -61.8 -15.1 -35.8 105.5 -2.3 35 35 A A T 3 S+ 0 0 45 -29,-0.2 -1,-0.2 -30,-0.2 2,-0.1 0.334 83.0 113.9 -75.9 -14.6 -38.6 105.1 -4.9 36 36 A S < - 0 0 27 -3,-1.6 -30,-0.6 1,-0.1 2,-0.1 -0.365 69.0-111.5 -49.6 152.3 -36.0 104.8 -7.7 37 37 A T - 0 0 113 -2,-0.1 2,-0.4 -32,-0.1 -32,-0.1 -0.437 22.4-143.5 -80.3 150.1 -35.3 101.7 -9.8 38 38 A L - 0 0 37 -34,-0.4 -34,-0.1 -2,-0.1 -1,-0.1 -0.898 17.8-118.4-108.1 155.7 -32.1 99.6 -9.7 39 39 A E > - 0 0 126 -2,-0.4 4,-2.3 1,-0.1 5,-0.2 -0.421 25.1-116.1 -79.5 140.3 -30.3 97.9 -12.6 40 40 A E H > S+ 0 0 162 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.939 118.9 48.4 -39.1 -44.3 -29.9 94.0 -12.6 41 41 A K H > S+ 0 0 139 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.835 113.4 49.9 -61.9 -43.5 -26.0 94.4 -12.5 42 42 A D H > S+ 0 0 44 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.831 110.4 45.6 -78.6 -32.5 -26.4 97.0 -9.5 43 43 A A H >X S+ 0 0 24 -4,-2.3 4,-1.8 -3,-0.2 3,-0.7 0.924 116.5 48.0 -69.7 -37.1 -28.7 94.9 -7.3 44 44 A E H 3X S+ 0 0 85 -4,-2.2 4,-2.0 1,-0.3 5,-0.3 0.881 104.0 58.2 -68.2 -40.9 -26.5 91.9 -7.9 45 45 A A H 3X S+ 0 0 43 -4,-2.6 4,-0.8 -5,-0.2 -1,-0.3 0.650 109.3 48.0 -55.5 -29.9 -23.3 93.8 -7.1 46 46 A V H X S+ 0 0 101 -4,-2.0 3,-1.6 2,-0.2 4,-0.6 0.841 110.4 54.1 -60.3 -53.1 -22.3 89.4 -4.0 49 49 A L H 3X S+ 0 0 84 -4,-0.8 4,-1.5 -5,-0.3 3,-0.2 0.791 96.3 69.4 -53.0 -26.1 -20.3 92.1 -2.1 50 50 A V H 3X S+ 0 0 31 -4,-1.6 4,-2.9 2,-0.2 -1,-0.2 0.787 90.0 66.1 -62.8 -11.4 -22.4 91.1 1.0 51 51 A K H <> S+ 0 0 129 -3,-1.6 4,-1.8 2,-0.2 5,-0.2 0.905 101.6 42.3 -87.4 -37.2 -20.4 87.7 1.0 52 52 A E H X S+ 0 0 137 -4,-0.6 4,-1.5 -3,-0.2 -1,-0.2 0.931 117.3 48.7 -65.2 -44.6 -17.0 89.0 1.8 53 53 A Q H X S+ 0 0 100 -4,-1.5 4,-2.1 1,-0.2 -2,-0.2 0.880 114.3 44.2 -71.7 -44.6 -18.4 91.5 4.4 54 54 A R H X S+ 0 0 168 -4,-2.9 4,-1.7 2,-0.2 -1,-0.2 0.843 111.2 54.9 -56.2 -40.5 -20.5 88.7 6.2 55 55 A G H X S+ 0 0 42 -4,-1.8 4,-1.1 -5,-0.2 -2,-0.2 0.834 113.4 42.2 -66.5 -34.8 -17.6 86.3 6.0 56 56 A L H X S+ 0 0 87 -4,-1.5 4,-3.0 2,-0.2 -2,-0.2 0.825 107.1 59.2 -70.3 -39.3 -15.5 88.9 7.8 57 57 A Q H < S+ 0 0 160 -4,-2.1 -2,-0.2 1,-0.2 -3,-0.2 0.823 113.4 41.3 -64.9 -22.8 -18.3 89.9 10.3 58 58 A E H >X S+ 0 0 107 -4,-1.7 4,-3.2 3,-0.2 3,-0.9 0.722 111.9 53.4 -89.5 -29.8 -18.2 86.1 11.4 59 59 A K H 3X S+ 0 0 115 -4,-1.1 4,-2.2 1,-0.2 -2,-0.2 0.949 110.7 47.8 -66.8 -43.2 -14.4 85.9 11.3 60 60 A L H 3< S+ 0 0 118 -4,-3.0 -1,-0.2 2,-0.2 -2,-0.1 0.172 115.8 46.7 -78.0 21.9 -14.3 89.0 13.6 61 61 A A H X> S+ 0 0 26 -3,-0.9 4,-3.3 3,-0.1 3,-1.1 0.603 113.3 45.2-121.9 -36.5 -17.0 87.1 15.8 62 62 A E H 3X S+ 0 0 75 -4,-3.2 4,-2.1 1,-0.3 -2,-0.2 0.930 114.2 49.5 -74.7 -46.5 -15.1 83.6 15.9 63 63 A E H 3< S+ 0 0 140 -4,-2.2 -1,-0.3 -5,-0.3 -3,-0.1 0.646 119.3 40.8 -67.5 -5.2 -11.7 85.4 16.7 64 64 A E H X4 S+ 0 0 120 -3,-1.1 3,-1.7 2,-0.2 4,-0.4 0.728 114.6 46.5-109.7 -49.6 -13.6 87.4 19.6 65 65 A R H 3< S+ 0 0 102 -4,-3.3 3,-0.4 1,-0.3 -2,-0.2 0.851 114.9 53.0 -62.5 -18.3 -15.9 84.5 21.0 66 66 A R T 3< S+ 0 0 90 -4,-2.1 -1,-0.3 -5,-0.4 -2,-0.2 0.069 104.5 55.9 -95.8 -0.9 -12.6 82.7 20.8 67 67 A K S < S+ 0 0 136 -3,-1.7 -1,-0.2 2,-0.0 -2,-0.2 0.017 91.1 67.7 -91.1 -37.6 -10.9 85.6 22.9 68 68 A S S S+ 0 0 100 -4,-0.4 -4,-0.1 -3,-0.4 -3,-0.0 -0.515 82.2 169.6 -84.2 59.0 -13.2 85.4 25.9 69 69 A L - 0 0 37 1,-0.2 173,-0.1 -2,-0.1 3,-0.1 -0.513 24.7-121.0-100.7 111.2 -11.6 82.1 26.5 70 70 A P - 0 0 50 0, 0.0 2,-0.4 0, 0.0 171,-0.3 0.254 43.1 -53.2 -24.6 162.1 -12.2 80.2 29.9 71 71 A R - 0 0 170 169,-0.1 169,-0.1 49,-0.0 49,-0.1 -0.540 68.0-165.7 -32.1 139.0 -10.3 78.9 32.9 72 72 A R - 0 0 33 -2,-0.4 49,-0.4 49,-0.2 233,-0.1 -0.934 31.9-131.2-140.2 139.5 -7.5 76.5 31.5 73 73 A P - 0 0 12 0, 0.0 50,-1.4 0, 0.0 71,-0.0 0.522 26.3-171.0 27.2-102.7 -4.9 73.8 32.4 74 74 A P - 0 0 1 0, 0.0 72,-0.3 0, 0.0 70,-0.1 0.667 19.0-155.5-112.1 99.1 -2.1 75.2 30.8 75 75 A V - 0 0 6 68,-0.2 71,-1.8 70,-0.1 2,-0.3 -0.197 14.1-166.4 -61.9-163.9 0.0 72.3 31.4 76 76 A V B -a 124 0A 0 47,-1.0 49,-2.0 68,-0.2 2,-0.3 -0.995 6.1-155.0-167.8 138.2 3.9 72.1 31.5 77 77 A V - 0 0 29 69,-0.4 2,-0.2 -2,-0.3 71,-0.1 -0.809 10.4-143.6-119.5 146.8 6.6 69.2 31.4 78 78 A I - 0 0 2 -2,-0.3 2,-0.3 47,-0.2 71,-0.1 -0.737 25.2-151.6-112.8 144.8 10.3 69.2 32.9 79 79 A M + 0 0 8 -2,-0.2 52,-0.2 71,-0.1 71,-0.1 -0.953 34.4 81.0-133.4 153.8 13.3 67.4 31.1 80 80 A G B -c 131 0B 0 50,-2.0 52,-0.6 -2,-0.3 53,-0.1 -0.412 67.1 -59.5 138.9-177.8 16.7 65.6 31.1 81 81 A H - 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