==== 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 04-MAY-13 4KJZ . COMPND 2 MOLECULE: TRANSLATION INITIATION FACTOR IF-2; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR D.R.EILER,J.LIN,T.A.STEITZ . 1813 12 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 101503.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1284 70.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 146 8.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 209 11.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 8 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 3 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 4 0.2 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 . 131 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 185 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 522 28.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 33 1.8 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 4 4 2 3 9 7 5 4 1 1 3 0 0 0 0 0 2 0 1 0 0 0 3 1 1 0 RESIDUES PER ALPHA HELIX . 7 10 3 8 3 1 3 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 . 13 7 5 11 5 3 1 0 2 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 . 5 1 3 2 2 1 2 2 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 3 A K 0 0 109 0, 0.0 2,-0.3 0, 0.0 36,-0.2 0.000 360.0 360.0 360.0 109.3 13.2 56.3 32.9 2 4 A V E -A 36 0A 38 34,-1.0 34,-1.6 31,-0.0 2,-0.6 -0.989 360.0-127.1-149.2 151.4 10.2 54.0 33.3 3 5 A R E >> -A 35 0A 97 -2,-0.3 3,-3.8 32,-0.2 4,-1.3 -0.714 30.6-129.0 -85.9 117.4 7.7 52.8 35.8 4 6 A I H 3> S+ 0 0 1 30,-1.6 4,-1.6 -2,-0.6 3,-0.3 0.812 110.7 53.1 -38.9 -35.6 7.7 49.0 35.7 5 7 A Y H 3> S+ 0 0 112 27,-0.9 4,-0.9 1,-0.2 -1,-0.3 0.653 103.1 55.2 -77.3 -16.7 3.9 49.2 35.3 6 8 A Q H <> S+ 0 0 8 -3,-3.8 4,-2.1 2,-0.2 -1,-0.2 0.768 106.1 52.9 -82.7 -27.2 4.1 51.6 32.3 7 9 A L H X S+ 0 0 1 -4,-1.3 4,-2.9 -3,-0.3 5,-0.3 0.905 108.4 47.5 -76.7 -52.6 6.3 49.2 30.4 8 10 A A H X S+ 0 0 0 -4,-1.6 4,-1.2 -5,-0.2 5,-0.3 0.789 113.5 50.5 -61.6 -32.6 3.9 46.2 30.9 9 11 A K H < S+ 0 0 159 -4,-0.9 -2,-0.2 3,-0.2 -1,-0.2 0.922 113.8 44.6 -68.2 -43.8 1.1 48.5 29.8 10 12 A E H < S+ 0 0 130 -4,-2.1 -2,-0.2 1,-0.2 -3,-0.2 0.995 114.5 45.3 -62.3 -60.3 3.0 49.6 26.7 11 13 A L H < S- 0 0 56 -4,-2.9 -1,-0.2 1,-0.1 -3,-0.2 0.846 116.5-110.3 -50.7 -42.0 4.3 46.2 25.6 12 14 A G S < S+ 0 0 57 -4,-1.2 2,-0.2 1,-0.5 -3,-0.2 0.345 80.0 126.0 116.5 3.8 0.8 44.7 26.2 13 15 A M - 0 0 13 -5,-0.3 -1,-0.5 -6,-0.3 2,-0.4 -0.501 56.3-136.0 -71.0 150.2 2.0 42.7 29.1 14 16 A E >> - 0 0 145 -2,-0.2 4,-1.0 -3,-0.1 3,-0.9 -0.919 28.1-111.9-105.0 154.6 0.4 42.9 32.4 15 17 A C H 3>>S+ 0 0 26 -2,-0.4 4,-2.9 1,-0.3 5,-0.5 0.719 108.2 71.0 -63.7 -27.6 2.7 43.2 35.3 16 18 A Q H 3>5S+ 0 0 155 1,-0.3 4,-2.1 2,-0.2 -1,-0.3 0.968 110.5 39.6 -54.1 -49.7 2.2 40.0 36.9 17 19 A E H <>5S+ 0 0 90 -3,-0.9 4,-2.3 1,-0.2 -1,-0.3 0.845 114.4 54.9 -60.1 -38.7 4.1 38.7 33.9 18 20 A L H X5S+ 0 0 5 -4,-1.0 4,-2.3 2,-0.2 -1,-0.2 0.910 110.2 42.4 -68.4 -42.2 6.5 41.6 33.8 19 21 A L H X5S+ 0 0 38 -4,-2.9 4,-2.8 -3,-0.2 5,-0.2 0.969 111.5 58.1 -67.2 -48.0 7.8 41.3 37.3 20 22 A E H <X S+ 0 0 38 -4,-2.3 3,-3.3 1,-0.2 4,-3.3 0.984 112.6 47.8 -64.1 -50.2 10.2 37.9 34.0 22 24 A L H 3X>S+ 0 0 2 -4,-2.3 4,-2.9 1,-0.3 5,-1.5 0.813 105.1 61.6 -60.1 -25.5 12.4 40.4 35.8 23 25 A D H 3<5S+ 0 0 66 -4,-2.8 -1,-0.3 1,-0.2 -2,-0.2 0.244 112.1 36.6 -95.8 17.2 12.4 38.1 38.6 24 26 A Q H <45S+ 0 0 169 -3,-3.3 -2,-0.3 -5,-0.2 -1,-0.2 0.421 113.1 57.2-113.9 -28.1 14.0 35.7 36.4 25 27 A M H <5S- 0 0 78 -4,-3.3 -2,-0.2 -5,-0.1 -3,-0.2 0.873 109.4-122.9 -61.0 -36.3 16.1 38.2 34.6 26 28 A G T <5 + 0 0 68 -4,-2.9 2,-0.5 1,-0.2 -3,-0.2 0.871 59.5 138.5 96.7 45.5 17.7 39.3 37.9 27 29 A V < - 0 0 33 -5,-1.5 -1,-0.2 13,-0.0 -2,-0.1 -0.970 53.3-109.8-129.1 120.0 16.9 43.0 38.2 28 30 A A + 0 0 93 -2,-0.5 2,-0.3 1,-0.0 -5,-0.0 0.042 35.7 175.3 -50.0 142.3 15.8 44.5 41.5 29 31 A Y - 0 0 78 1,-0.1 3,-0.1 7,-0.0 -1,-0.0 -0.934 23.7-168.9-149.1 127.8 12.3 45.8 42.2 30 32 A K S S- 0 0 195 1,-0.4 2,-0.3 -2,-0.3 -1,-0.1 0.924 81.2 -30.8 -73.4 -47.2 10.7 47.2 45.4 31 33 A S S > S- 0 0 49 -12,-0.0 3,-1.3 1,-0.0 -1,-0.4 -0.906 79.0 -77.1-157.4 179.8 7.3 47.1 43.8 32 34 A H T 3 S+ 0 0 105 1,-0.3 -27,-0.9 -2,-0.3 -28,-0.0 0.793 126.2 58.1 -60.6 -29.6 5.7 47.5 40.4 33 35 A A T 3 S+ 0 0 47 -29,-0.2 -29,-0.4 -30,-0.1 -1,-0.3 0.839 78.4 116.7 -65.9 -34.5 6.1 51.2 40.5 34 36 A S < - 0 0 30 -3,-1.3 -30,-1.6 -31,-0.2 -29,-0.1 0.007 68.5-108.3 -48.6 143.3 9.9 51.1 41.0 35 37 A T E -A 3 0A 118 -32,-0.2 2,-0.3 -31,-0.1 -32,-0.2 -0.183 27.8-157.5 -76.9 157.7 11.9 52.7 38.2 36 38 A L E -A 2 0A 11 -34,-1.6 -34,-1.0 -7,-0.0 2,-0.3 -0.980 19.1-120.2-132.6 148.2 14.1 51.1 35.4 37 39 A E > - 0 0 115 -2,-0.3 3,-0.8 -36,-0.2 4,-0.0 -0.639 29.5-121.4 -81.1 146.3 17.0 52.3 33.2 38 40 A E T 3>>S+ 0 0 112 2,-0.4 4,-3.2 1,-0.3 5,-0.6 0.861 117.9 64.9 -55.6 -38.5 16.2 52.0 29.5 39 41 A K H 3>5S+ 0 0 72 1,-0.4 4,-1.8 2,-0.3 -1,-0.3 0.972 116.0 33.8 -48.6 -38.5 19.2 49.7 29.0 40 42 A D H <>5S+ 0 0 36 -3,-0.8 4,-0.9 2,-0.2 -1,-0.4 0.699 102.2 81.1 -68.2 -24.7 16.6 48.2 31.1 41 43 A A H >5S+ 0 0 5 1,-0.3 4,-0.5 2,-0.1 -2,-0.3 0.959 116.3 9.2 -57.2 -47.3 14.4 50.0 29.0 42 44 A E H X>S+ 0 0 83 -4,-3.2 4,-3.5 -3,-0.3 5,-0.5 0.517 97.9 100.7-104.4 -8.8 14.8 47.2 26.5 43 45 A A H X S+ 0 0 111 -4,-0.3 4,-2.2 2,-0.2 -1,-0.3 0.877 111.4 57.0 -59.5 -44.2 9.7 34.3 23.6 52 54 A R H X S+ 0 0 104 -4,-1.4 4,-1.0 2,-0.2 -2,-0.2 0.876 113.6 37.6 -64.0 -41.8 6.7 36.2 22.2 53 55 A G H >X S+ 0 0 35 -4,-2.6 3,-0.8 2,-0.2 4,-0.7 0.937 112.7 60.0 -66.2 -49.3 7.6 35.2 18.6 54 56 A L H 3X S+ 0 0 106 -4,-2.9 4,-0.8 -5,-0.3 -2,-0.2 0.750 103.9 50.2 -53.0 -33.8 8.6 31.7 19.9 55 57 A Q H 3X S+ 0 0 124 -4,-2.2 4,-2.4 2,-0.2 3,-0.4 0.845 102.8 59.1 -69.7 -39.1 5.0 31.2 21.3 56 58 A E H X S+ 0 0 48 -4,-2.4 4,-1.6 2,-0.3 3,-1.5 0.969 103.8 50.3 -50.6 -51.5 0.3 28.7 17.8 60 62 A E H 3X S+ 0 0 90 -4,-1.1 4,-3.8 1,-0.4 -1,-0.3 0.887 107.1 50.8 -54.0 -40.6 1.1 27.7 14.3 61 63 A E H 3X S+ 0 0 94 -4,-1.3 4,-1.5 1,-0.2 -1,-0.4 0.711 108.8 56.5 -61.5 -18.5 1.6 24.3 15.9 62 64 A E H - 0 0 37 54,-0.6 3,-1.1 -2,-0.3 4,-0.3 -0.207 66.0 -95.4 -65.4 142.4 -2.7 -7.6 -12.2 80 82 A V T 3 S+ 0 0 83 1,-0.3 5,-0.2 2,-0.1 3,-0.1 0.676 117.7 15.5 -38.9 -38.6 -4.8 -7.1 -15.3 81 83 A D T 3 S+ 0 0 107 1,-0.1 -1,-0.3 2,-0.1 -2,-0.1 -0.462 85.1 109.7-135.9 73.6 -7.5 -9.5 -14.1 82 84 A H S < S- 0 0 8 -3,-1.1 81,-0.2 -2,-0.1 -2,-0.1 0.220 101.7 -76.5-127.3 8.7 -7.1 -10.2 -10.4 83 85 A G S > S+ 0 0 3 -4,-0.3 4,-1.6 -3,-0.1 5,-0.1 0.708 90.9 121.3 113.0 17.7 -10.3 -8.3 -9.5 84 86 A K H > S+ 0 0 50 -5,-0.3 4,-1.6 2,-0.2 5,-0.2 0.833 80.1 45.3 -73.6 -47.7 -9.7 -4.5 -9.6 85 87 A T H > S+ 0 0 89 -5,-0.2 4,-1.7 1,-0.2 -1,-0.1 0.900 118.5 49.6 -65.2 -40.6 -12.2 -3.3 -12.2 86 88 A T H > S+ 0 0 59 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.853 109.6 45.4 -65.8 -43.6 -14.7 -5.6 -10.4 87 89 A L H X S+ 0 0 0 -4,-1.6 4,-1.3 2,-0.2 -1,-0.2 0.807 111.9 53.6 -76.4 -29.1 -14.1 -4.5 -6.8 88 90 A L H X S+ 0 0 27 -4,-1.6 4,-2.4 2,-0.2 3,-0.4 0.924 105.0 54.7 -62.7 -47.9 -14.3 -0.8 -7.8 89 91 A D H X S+ 0 0 71 -4,-1.7 4,-1.3 1,-0.3 -2,-0.2 0.948 106.9 51.7 -53.8 -44.0 -17.5 -1.5 -9.5 90 92 A Y H < S+ 0 0 18 -4,-1.7 4,-0.3 1,-0.2 -1,-0.3 0.876 111.3 47.3 -57.1 -38.7 -18.7 -2.9 -6.1 91 93 A L H < S+ 0 0 0 -4,-1.3 3,-0.5 -3,-0.4 -1,-0.2 0.803 107.2 54.1 -81.3 -30.5 -17.6 0.3 -4.3 92 94 A R H < S+ 0 0 70 -4,-2.4 3,-0.5 1,-0.2 -1,-0.2 0.864 90.0 85.7 -62.8 -36.6 -19.1 2.8 -6.6 93 95 A K < + 0 0 116 -4,-1.3 -1,-0.2 -5,-0.3 -2,-0.1 0.640 56.6 92.9 -49.6 -30.7 -22.5 1.3 -6.4 94 96 A S S S+ 0 0 35 -3,-0.5 2,-0.6 -4,-0.3 3,-0.2 0.735 71.3 62.0 -52.4 -64.8 -24.2 2.7 -3.4 95 97 A R S S- 0 0 104 -3,-0.5 1161,-0.0 1,-0.3 0, 0.0 -0.459 75.2-174.7 -55.0 109.0 -26.1 5.6 -4.3 96 98 A I S S- 0 0 145 -2,-0.6 -1,-0.3 1160,-0.0 -2,-0.1 0.921 86.7 -26.8 -65.3 -42.5 -28.0 3.0 -6.4 97 99 A A 0 0 86 -3,-0.2 -2,-0.1 0, 0.0 -3,-0.0 0.322 360.0 360.0-129.9 -46.2 -29.8 5.9 -7.7 98 100 A E 0 0 90 -4,-0.2 -3,-0.1 0, 0.0 -4,-0.1 0.551 360.0 360.0 10.3 360.0 -29.3 8.0 -4.7 99 ! 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 0.0 100 107 A T 0 0 131 0, 0.0 179,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 65.4 -22.1 9.8 -14.8 101 108 A Q - 0 0 128 1,-0.1 2,-0.1 2,-0.1 178,-0.0 0.518 360.0-119.7 -45.4 138.4 -19.1 11.2 -16.2 102 109 A H - 0 0 80 1,-0.1 -1,-0.1 2,-0.1 4,-0.1 -0.348 18.9-158.6 -77.3 159.2 -16.2 10.7 -13.9 103 110 A V - 0 0 2 2,-0.6 188,-0.2 -2,-0.1 133,-0.1 0.190 61.9 -95.4-114.7 -0.6 -13.9 13.0 -12.1 104 111 A G S S+ 0 0 0 1,-0.2 15,-3.9 15,-0.1 2,-0.3 0.236 102.5 44.9 103.5 -15.8 -11.2 10.4 -11.6 105 112 A A E -E 118 0C 2 13,-0.3 -2,-0.6 144,-0.1 2,-0.3 -0.928 62.5-162.8-148.1 167.0 -12.3 9.4 -8.1 106 113 A F E -E 117 0C 17 11,-2.0 11,-2.0 -2,-0.3 2,-0.3 -0.905 16.8-113.5-148.4 171.0 -15.5 8.6 -6.2 107 114 A E E -E 116 0C 71 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.811 10.4-165.9-114.0 148.2 -16.7 8.3 -2.7 108 115 A V E -E 115 0C 0 7,-1.4 7,-1.4 -2,-0.3 2,-0.9 -0.957 19.9-153.8-122.0 117.5 -18.0 5.7 -0.3 109 116 A K E +E 114 0C 105 -2,-0.3 5,-0.2 5,-0.2 -2,-0.0 -0.749 18.6 178.9-100.6 105.8 -19.7 7.3 2.8 110 117 A T - 0 0 10 3,-2.5 1150,-0.0 -2,-0.9 1153,-0.0 -0.513 42.0-114.7-107.0 159.1 -19.6 5.1 5.7 111 118 A P S S+ 0 0 58 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.896 119.6 45.4 -62.8 -39.2 -20.8 5.7 9.1 112 119 A Q S S- 0 0 96 1,-0.2 2,-0.3 1150,-0.0 -3,-0.0 0.923 129.7 -38.3 -66.7 -45.2 -17.3 5.6 10.4 113 120 A G - 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