==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 28-MAR-09 3GTZ . COMPND 2 MOLECULE: PUTATIVE TRANSLATION INITIATION INHIBITOR; . SOURCE 2 ORGANISM_SCIENTIFIC: SALMONELLA TYPHIMURIUM; . AUTHOR J.B.BONANNO,J.FREEMAN,K.T.BAIN,S.MILLER,R.ROMERO,S.WASSERMAN . 345 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13482.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 244 70.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 21 6.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 85 24.6 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 . 5 1.4 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 . 22 6.4 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 . 75 21.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.9 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 0 0 0 3 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 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 PARALLEL BRIDGES PER LADDER . 2 1 2 4 0 3 3 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 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 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 0 A S 0 0 83 0, 0.0 19,-2.6 0, 0.0 20,-0.3 0.000 360.0 360.0 360.0 143.4 36.2 20.8 -17.5 2 1 A L + 0 0 85 17,-0.2 2,-0.3 18,-0.1 17,-0.0 0.090 360.0 99.4 -76.0 20.1 35.4 22.3 -14.1 3 2 A S S S- 0 0 59 343,-0.0 2,-0.5 2,-0.0 17,-0.4 -0.821 76.9-122.8-104.0 151.1 34.8 18.7 -12.8 4 3 A I - 0 0 36 -2,-0.3 2,-0.5 15,-0.1 15,-0.2 -0.837 23.2-167.9-100.5 125.0 37.6 17.0 -10.9 5 4 A V E -A 18 0A 74 13,-2.3 13,-2.7 -2,-0.5 2,-0.4 -0.963 2.6-165.9-113.7 133.7 38.9 13.7 -12.1 6 5 A R E -A 17 0A 35 -2,-0.5 3,-0.4 11,-0.2 2,-0.4 -0.985 6.9-152.1-122.1 123.9 41.2 11.6 -9.9 7 6 A I E S+A 16 0A 53 9,-2.5 9,-1.8 -2,-0.4 8,-1.7 -0.842 81.9 2.4 -99.7 133.0 43.3 8.7 -11.2 8 7 A D E S- 0 0 56 -2,-0.4 2,-0.8 1,-0.2 7,-0.8 0.977 84.3-165.2 52.6 59.4 44.1 5.9 -8.7 9 8 A A E +A 14 0A 41 -3,-0.4 5,-0.2 5,-0.2 -1,-0.2 -0.710 14.3 178.4 -78.8 109.8 42.1 7.6 -6.0 10 9 A E - 0 0 101 3,-2.7 310,-1.5 -2,-0.8 312,-0.5 -0.457 44.0 -87.9-106.8 177.9 43.1 5.9 -2.8 11 10 A D S S+ 0 0 117 308,-0.2 310,-0.2 1,-0.2 3,-0.1 0.856 122.4 12.9 -54.1 -40.8 42.2 6.3 0.9 12 11 A R S S+ 0 0 122 1,-0.2 2,-0.3 307,-0.1 -1,-0.2 0.523 131.3 18.5-120.0 -12.7 44.9 8.9 1.7 13 12 A W - 0 0 125 309,-0.1 -3,-2.7 -5,-0.1 2,-0.3 -0.977 57.2-137.2-154.8 159.9 46.1 10.1 -1.8 14 13 A S E -A 9 0A 5 309,-1.0 311,-0.3 -2,-0.3 -5,-0.2 -0.915 15.8-143.7-114.5 149.2 45.3 10.2 -5.4 15 14 A D E S+ 0 0 62 -8,-1.7 11,-0.6 -7,-0.8 2,-0.3 0.923 83.2 13.4 -81.7 -38.9 48.0 9.5 -7.9 16 15 A V E -AB 7 25A 3 -9,-1.8 -9,-2.5 9,-0.1 2,-0.4 -0.991 62.6-163.1-138.2 138.5 46.8 12.0 -10.5 17 16 A V E -AB 6 24A 0 7,-2.1 7,-2.5 -2,-0.3 2,-0.4 -0.988 5.4-169.0-123.2 139.6 44.4 14.9 -10.5 18 17 A I E +AB 5 23A 21 -13,-2.7 -13,-2.3 -2,-0.4 2,-0.3 -0.993 19.4 147.9-130.5 125.6 42.9 16.6 -13.5 19 18 A Y E > + B 0 22A 2 3,-2.8 3,-1.4 -2,-0.4 -17,-0.2 -0.969 62.6 3.7-157.4 142.3 41.0 19.9 -13.4 20 19 A N T 3 S- 0 0 16 -19,-2.6 -18,-0.1 -17,-0.4 3,-0.1 0.897 128.8 -55.5 49.9 46.3 40.4 22.9 -15.6 21 20 A N T 3 S+ 0 0 51 -20,-0.3 94,-1.6 1,-0.2 2,-0.3 0.748 118.7 111.4 59.1 29.5 42.5 21.3 -18.5 22 21 A T E < -BC 19 114A 9 -3,-1.4 -3,-2.8 92,-0.2 2,-0.4 -0.954 52.1-156.8-136.8 147.0 45.4 20.9 -16.0 23 22 A L E -BC 18 113A 0 90,-2.4 90,-2.5 -2,-0.3 2,-0.4 -0.985 3.4-163.5-133.6 134.0 46.9 17.9 -14.5 24 23 A W E +BC 17 112A 22 -7,-2.5 -7,-2.1 -2,-0.4 2,-0.3 -0.950 19.5 154.2-122.4 143.5 49.0 17.6 -11.3 25 24 A Y E -BC 16 111A 6 86,-1.8 86,-2.9 -2,-0.4 2,-0.4 -0.968 30.0-147.5-166.2 150.0 51.2 14.7 -10.4 26 25 A T E - C 0 110A 14 -11,-0.6 2,-0.4 -2,-0.3 84,-0.3 -0.988 17.9-149.6-127.4 121.0 54.2 13.8 -8.3 27 26 A G E - C 0 109A 0 82,-3.5 82,-2.6 -2,-0.4 16,-0.1 -0.760 15.9-178.2 -95.5 135.6 56.6 11.1 -9.4 28 27 A V - 0 0 45 -2,-0.4 80,-0.1 80,-0.2 18,-0.1 -0.925 33.9 -89.2-126.9 153.2 58.4 9.1 -6.9 29 28 A P - 0 0 8 0, 0.0 3,-0.1 0, 0.0 10,-0.1 -0.191 22.2-162.7 -65.0 151.7 61.0 6.3 -7.5 30 29 A E S S+ 0 0 130 1,-0.2 2,-0.9 9,-0.1 9,-0.1 0.847 80.3 58.1 -94.4 -48.9 60.2 2.6 -7.9 31 30 A N > - 0 0 66 1,-0.2 3,-0.8 4,-0.1 -1,-0.2 -0.761 64.3-171.7 -90.7 106.5 63.6 1.0 -7.3 32 31 A L T 3 S+ 0 0 57 -2,-0.9 -1,-0.2 1,-0.2 7,-0.0 0.776 83.8 50.9 -73.8 -27.5 64.7 2.0 -3.9 33 32 A D T 3 S+ 0 0 124 72,-0.0 -1,-0.2 2,-0.0 2,-0.1 0.509 88.9 106.1 -85.9 -5.8 68.2 0.6 -4.2 34 33 A A S < S- 0 0 6 -3,-0.8 72,-0.1 1,-0.1 2,-0.0 -0.414 74.1-113.1 -71.7 151.3 68.8 2.3 -7.5 35 34 A D > - 0 0 99 -2,-0.1 4,-2.4 1,-0.1 5,-0.2 -0.105 38.7 -90.7 -69.6 177.1 71.1 5.3 -7.8 36 35 A A H > S+ 0 0 3 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.787 123.3 56.4 -69.6 -31.3 69.9 8.8 -8.6 37 36 A F H > S+ 0 0 72 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.957 112.4 41.6 -64.6 -49.9 70.4 8.4 -12.4 38 37 A E H > S+ 0 0 83 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.935 115.3 50.7 -59.6 -45.0 68.2 5.4 -12.5 39 38 A Q H X S+ 0 0 2 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.911 114.3 43.9 -65.6 -39.6 65.6 6.9 -10.1 40 39 A T H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 5,-0.2 0.953 115.8 46.3 -67.6 -50.1 65.4 10.1 -12.2 41 40 A A H X S+ 0 0 38 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.899 115.2 48.1 -56.4 -43.9 65.2 8.3 -15.6 42 41 A N H X S+ 0 0 43 -4,-2.8 4,-1.9 -5,-0.3 -1,-0.2 0.875 110.3 51.1 -66.6 -38.3 62.7 5.9 -14.2 43 42 A T H X S+ 0 0 0 -4,-1.9 4,-2.1 -5,-0.3 -2,-0.2 0.893 107.6 51.7 -72.3 -36.0 60.6 8.6 -12.8 44 43 A L H X S+ 0 0 2 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.866 107.9 54.1 -65.0 -35.6 60.5 10.6 -16.0 45 44 A A H X S+ 0 0 54 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.881 108.3 49.3 -62.6 -39.3 59.3 7.3 -17.7 46 45 A Q H X S+ 0 0 31 -4,-1.9 4,-2.7 2,-0.2 -2,-0.2 0.886 107.8 54.2 -64.6 -43.2 56.4 7.1 -15.2 47 46 A I H X S+ 0 0 0 -4,-2.1 4,-3.1 2,-0.2 5,-0.2 0.949 107.9 49.6 -55.6 -52.4 55.5 10.7 -15.8 48 47 A D H X S+ 0 0 26 -4,-2.1 4,-2.9 2,-0.2 5,-0.3 0.941 111.1 49.5 -48.4 -53.1 55.3 9.9 -19.6 49 48 A A H X S+ 0 0 57 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.907 112.8 47.0 -56.8 -47.5 53.1 6.9 -19.0 50 49 A V H X S+ 0 0 21 -4,-2.7 4,-0.8 1,-0.2 -1,-0.2 0.905 112.9 49.5 -58.4 -48.3 50.8 8.9 -16.7 51 50 A L H <>S+ 0 0 0 -4,-3.1 5,-2.9 1,-0.2 3,-0.4 0.886 113.3 45.3 -63.9 -37.8 50.6 11.8 -19.2 52 51 A E H ><5S+ 0 0 118 -4,-2.9 3,-2.0 1,-0.2 -1,-0.2 0.847 100.6 64.9 -81.7 -24.7 49.7 9.6 -22.2 53 52 A K H 3<5S+ 0 0 179 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.835 108.8 44.7 -59.4 -29.5 47.1 7.5 -20.3 54 53 A Q T 3<5S- 0 0 56 -4,-0.8 -1,-0.3 -3,-0.4 -2,-0.2 0.208 125.3-104.1 -96.4 9.4 45.2 10.9 -20.2 55 54 A G T < 5S+ 0 0 71 -3,-2.0 -3,-0.2 1,-0.2 -2,-0.1 0.575 89.2 109.4 78.3 7.5 45.9 11.7 -23.8 56 55 A S < - 0 0 8 -5,-2.9 2,-0.3 -6,-0.2 -1,-0.2 -0.284 50.4-156.3 -98.7-169.2 48.6 14.3 -22.9 57 56 A S > - 0 0 36 57,-0.4 3,-1.6 -2,-0.1 57,-0.2 -0.938 35.4 -90.4-157.0 177.3 52.4 13.9 -23.5 58 57 A K G > S+ 0 0 59 1,-0.3 3,-0.9 -2,-0.3 28,-0.2 0.655 119.1 65.9 -72.9 -14.8 55.8 15.2 -22.2 59 58 A S G 3 S+ 0 0 41 1,-0.2 -1,-0.3 26,-0.1 26,-0.0 0.546 98.2 57.2 -73.3 -12.4 55.8 18.0 -24.7 60 59 A R G < S+ 0 0 77 -3,-1.6 54,-2.5 54,-0.1 2,-0.3 0.177 73.8 121.9-107.4 14.6 52.8 19.3 -22.8 61 60 A I E < -D 113 0A 0 -3,-0.9 52,-0.3 28,-0.3 3,-0.1 -0.618 38.5-172.1 -82.2 138.4 54.4 19.7 -19.3 62 61 A L E + 0 0 0 50,-2.3 30,-2.0 1,-0.3 2,-0.3 0.883 63.1 5.1 -98.0 -47.1 54.2 23.2 -18.0 63 62 A D E -De 112 92A 1 49,-1.8 49,-1.9 28,-0.2 2,-0.4 -0.999 58.3-168.8-145.4 139.8 56.3 23.3 -14.8 64 63 A A E -De 111 93A 0 28,-2.4 30,-1.3 -2,-0.3 2,-0.5 -0.996 3.8-168.3-134.4 133.8 58.6 20.8 -13.1 65 64 A T E -De 110 94A 5 45,-2.3 45,-2.6 -2,-0.4 2,-0.5 -0.990 10.0-160.7-122.6 122.5 60.1 20.9 -9.6 66 65 A I E -De 109 95A 0 28,-2.9 30,-2.4 -2,-0.5 2,-0.5 -0.918 1.3-163.6-106.6 121.9 62.8 18.3 -8.8 67 66 A F E -De 108 96A 9 41,-2.6 41,-1.5 -2,-0.5 2,-0.4 -0.933 7.7-170.7-105.2 125.2 63.6 17.6 -5.2 68 67 A L E -De 107 97A 0 28,-2.1 30,-2.3 -2,-0.5 39,-0.2 -0.939 22.4-147.2-112.3 141.5 66.9 15.8 -4.5 69 68 A S S S+ 0 0 41 37,-1.7 2,-0.4 -2,-0.4 38,-0.1 0.720 87.1 36.9 -73.6 -20.5 67.9 14.4 -1.2 70 69 A D > - 0 0 87 36,-0.5 3,-1.4 1,-0.1 -1,-0.1 -0.997 66.6-143.2-142.7 135.2 71.6 15.1 -1.8 71 70 A K G > S+ 0 0 101 -2,-0.4 3,-1.2 1,-0.3 4,-0.2 0.712 100.7 69.6 -69.8 -24.8 73.4 17.9 -3.6 72 71 A A G 3 S+ 0 0 81 1,-0.2 3,-0.3 2,-0.1 4,-0.3 0.586 90.7 62.8 -67.2 -13.2 75.9 15.4 -5.0 73 72 A D G <> S+ 0 0 36 -3,-1.4 4,-2.2 1,-0.2 -1,-0.2 0.498 71.2 98.7 -94.2 -3.2 73.1 13.9 -7.2 74 73 A F H <> S+ 0 0 19 -3,-1.2 4,-1.9 1,-0.2 -1,-0.2 0.857 84.9 46.4 -48.4 -44.6 72.6 17.1 -9.3 75 74 A A H > S+ 0 0 75 -3,-0.3 4,-1.8 -4,-0.2 -1,-0.2 0.897 110.5 52.2 -72.8 -40.0 74.7 15.8 -12.2 76 75 A A H > S+ 0 0 29 -4,-0.3 4,-1.7 1,-0.2 -2,-0.2 0.921 111.9 46.0 -62.1 -41.7 73.1 12.4 -12.3 77 76 A M H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.821 110.8 52.5 -75.0 -29.9 69.6 13.9 -12.5 78 77 A N H X S+ 0 0 27 -4,-1.9 4,-3.0 -5,-0.2 -1,-0.2 0.836 106.2 54.5 -66.9 -36.4 70.6 16.4 -15.2 79 78 A K H X S+ 0 0 137 -4,-1.8 4,-1.3 2,-0.2 -2,-0.2 0.935 112.1 43.5 -63.4 -45.4 72.0 13.6 -17.3 80 79 A A H X S+ 0 0 3 -4,-1.7 4,-1.1 2,-0.2 3,-0.5 0.950 115.5 48.3 -64.2 -48.1 68.6 11.7 -17.0 81 80 A W H >X S+ 0 0 0 -4,-2.5 4,-3.1 1,-0.2 3,-0.9 0.931 110.6 52.0 -55.2 -46.5 66.7 14.9 -17.7 82 81 A D H 3< S+ 0 0 46 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.772 106.6 52.2 -66.0 -27.1 68.9 15.8 -20.6 83 82 A A H 3< S+ 0 0 90 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.727 122.0 32.0 -78.0 -20.1 68.4 12.3 -22.3 84 83 A W H << S+ 0 0 26 -4,-1.1 -2,-0.2 -3,-0.9 -3,-0.1 0.798 88.0 105.1-106.4 -44.3 64.5 12.7 -22.0 85 84 A V S < S- 0 0 18 -4,-3.1 2,-0.7 -5,-0.2 5,-0.1 -0.062 70.6-119.9 -52.3 145.9 63.6 16.4 -22.3 86 85 A V > - 0 0 45 -28,-0.2 3,-2.5 3,-0.2 4,-0.1 -0.808 28.5-122.5 -93.9 111.6 62.0 17.5 -25.6 87 86 A A T 3 S+ 0 0 55 -2,-0.7 40,-0.3 1,-0.3 41,-0.1 -0.242 96.0 8.6 -52.3 132.1 64.1 20.3 -27.2 88 87 A G T 3 S+ 0 0 27 38,-2.5 -1,-0.3 41,-0.2 39,-0.1 0.362 124.6 67.8 77.1 -7.9 62.0 23.4 -27.7 89 88 A H < + 0 0 97 -3,-2.5 -28,-0.3 38,-0.2 -3,-0.2 -0.000 68.4 133.8-131.7 27.0 59.1 22.0 -25.7 90 89 A A - 0 0 0 36,-0.5 39,-0.1 39,-0.2 3,-0.1 -0.494 49.0-126.8 -81.1 147.6 60.6 21.9 -22.2 91 90 A P - 0 0 2 0, 0.0 39,-1.2 0, 0.0 -28,-0.2 -0.271 38.9 -78.4 -80.7 172.9 58.8 23.2 -19.1 92 91 A V E -e 63 0A 3 -30,-2.0 -28,-2.4 37,-0.2 2,-0.4 -0.524 59.2-156.1 -60.3 137.9 59.9 25.7 -16.5 93 92 A R E +e 64 0A 44 37,-0.4 2,-0.3 -30,-0.2 -28,-0.2 -0.957 21.9 177.4-131.5 149.9 62.3 23.8 -14.3 94 93 A C E -e 65 0A 2 -30,-1.3 -28,-2.9 -2,-0.4 2,-0.5 -0.956 6.9-167.6-157.4 120.6 63.4 24.2 -10.8 95 94 A T E +e 66 0A 9 -2,-0.3 122,-0.4 -30,-0.2 2,-0.3 -0.977 14.5 162.3-119.7 127.8 65.7 21.9 -8.8 96 95 A V E -e 67 0A 0 -30,-2.4 -28,-2.1 -2,-0.5 2,-0.4 -0.968 34.3-120.8-139.4 157.8 66.3 22.1 -5.1 97 96 A Q E +eF 68 215A 52 118,-2.4 118,-1.7 -2,-0.3 2,-0.3 -0.838 45.5 145.4-102.1 131.5 67.7 19.8 -2.4 98 97 A A - 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