==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 21-FEB-04 1VB3 . COMPND 2 MOLECULE: THREONINE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR R.OMI . 428 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15894.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 303 70.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 44 10.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 19 4.4 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 . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 34 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 55 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 142 33.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 1 5 5 0 2 3 0 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 0 3 2 2 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 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 1 0 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 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 33 0, 0.0 14,-0.5 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 154.6 -9.8 46.4 -6.9 2 2 A K - 0 0 89 12,-0.2 31,-3.1 60,-0.2 32,-0.6 -0.978 360.0-178.0-127.4 139.8 -6.7 44.1 -7.1 3 3 A L E -AB 13 32A 0 10,-2.6 10,-1.9 -2,-0.4 2,-0.3 -0.904 7.0-158.0-131.9 159.7 -4.2 43.3 -4.4 4 4 A Y E -AB 12 31A 5 27,-2.1 27,-2.6 -2,-0.3 2,-0.5 -0.972 26.9-105.3-140.0 154.8 -1.0 41.2 -4.3 5 5 A N E > -AB 8 30A 0 6,-1.7 3,-2.0 3,-1.2 6,-0.2 -0.678 21.2-141.2 -80.3 124.0 1.1 39.5 -1.7 6 6 A L T 3 S+ 0 0 36 23,-2.5 3,-0.2 -2,-0.5 -1,-0.2 0.761 108.8 49.0 -55.1 -22.6 4.3 41.4 -1.0 7 7 A K T 3 S+ 0 0 129 1,-0.3 -1,-0.3 22,-0.2 2,-0.2 0.569 124.6 26.7 -92.5 -12.5 5.8 37.9 -0.8 8 8 A D E X -A 5 0A 70 -3,-2.0 3,-1.7 3,-0.2 -3,-1.2 -0.678 59.4-169.8-154.6 93.8 4.3 36.8 -4.1 9 9 A H E 3 S+ 0 0 89 1,-0.3 -3,-0.1 -3,-0.2 -1,-0.1 0.653 91.7 57.0 -57.7 -17.2 3.4 39.3 -6.8 10 10 A N E 3 S+ 0 0 145 -5,-0.1 2,-1.0 -6,-0.1 -1,-0.3 0.684 84.5 86.4 -88.9 -20.6 1.5 36.6 -8.6 11 11 A E E < + 0 0 20 -3,-1.7 -6,-1.7 -6,-0.2 2,-0.3 -0.727 66.8 173.3 -81.5 105.2 -0.8 35.8 -5.7 12 12 A Q E +A 4 0A 79 -2,-1.0 2,-0.3 -8,-0.2 -8,-0.2 -0.874 14.9 175.3-120.9 151.6 -3.6 38.3 -6.3 13 13 A V E -A 3 0A 12 -10,-1.9 -10,-2.6 -2,-0.3 2,-0.0 -0.977 28.0-112.9-148.1 158.5 -7.0 39.0 -4.8 14 14 A S > - 0 0 31 -2,-0.3 4,-2.2 -12,-0.2 -12,-0.2 -0.195 42.2 -97.9 -81.4 179.2 -9.8 41.5 -5.0 15 15 A F H > S+ 0 0 0 -14,-0.5 4,-2.5 48,-0.2 5,-0.2 0.913 125.1 53.7 -65.3 -41.6 -10.8 43.9 -2.2 16 16 A A H > S+ 0 0 28 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.897 111.5 43.7 -59.4 -44.5 -13.5 41.5 -1.2 17 17 A Q H > S+ 0 0 94 2,-0.2 4,-2.0 1,-0.2 5,-0.3 0.889 112.8 52.0 -69.6 -40.3 -11.1 38.5 -0.9 18 18 A A H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 198,-0.3 0.896 109.0 51.3 -62.5 -40.9 -8.5 40.6 0.9 19 19 A V H < S+ 0 0 0 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.847 118.5 35.4 -65.8 -36.8 -11.0 41.8 3.5 20 20 A T H < S+ 0 0 55 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.647 122.6 44.5 -92.5 -18.2 -12.3 38.3 4.3 21 21 A Q H < S- 0 0 72 -4,-2.0 2,-2.0 1,-0.2 -3,-0.2 0.763 78.0-175.6 -95.1 -32.0 -8.9 36.5 4.0 22 22 A G < + 0 0 1 -4,-2.3 8,-0.4 -5,-0.3 2,-0.3 -0.490 60.5 46.9 74.2 -82.0 -6.8 39.1 5.9 23 23 A L S S- 0 0 5 -2,-2.0 6,-0.2 -3,-0.1 2,-0.1 -0.690 75.2-136.9 -97.3 148.1 -3.4 37.6 5.4 24 24 A G B >> -C 28 0B 5 4,-2.7 3,-0.8 -2,-0.3 4,-0.5 -0.308 50.6 -58.2 -88.8 179.8 -1.9 36.3 2.1 25 25 A K G >4 S+ 0 0 131 1,-0.2 3,-1.4 2,-0.2 -1,-0.2 -0.153 123.1 20.0 -58.7 154.5 0.1 33.0 1.9 26 26 A N G 34 S- 0 0 122 1,-0.3 -1,-0.2 171,-0.1 172,-0.1 0.789 132.1 -69.2 54.9 32.0 3.2 32.6 4.1 27 27 A Q G <4 S+ 0 0 42 -3,-0.8 2,-0.3 1,-0.2 -1,-0.3 0.847 90.7 157.8 57.5 36.5 2.0 35.4 6.4 28 28 A G B << -C 24 0B 0 -3,-1.4 -4,-2.7 -4,-0.5 -1,-0.2 -0.740 40.2-121.0 -95.0 141.7 2.5 38.0 3.7 29 29 A L - 0 0 6 -2,-0.3 -23,-2.5 -6,-0.2 2,-0.3 -0.536 23.7-118.8 -81.4 144.8 0.7 41.3 3.7 30 30 A F E -B 5 0A 0 184,-0.5 -25,-0.2 -8,-0.4 -1,-0.1 -0.604 28.1-164.7 -82.6 141.5 -1.5 42.4 0.8 31 31 A F E -B 4 0A 4 -27,-2.6 -27,-2.1 -2,-0.3 185,-0.0 -0.983 31.8 -95.7-129.3 138.8 -0.6 45.5 -1.1 32 32 A P E -B 3 0A 0 0, 0.0 -29,-0.3 0, 0.0 3,-0.1 -0.265 25.8-150.7 -52.5 128.3 -2.8 47.6 -3.5 33 33 A H S S+ 0 0 61 -31,-3.1 2,-0.4 1,-0.1 -30,-0.2 0.878 84.9 39.8 -69.8 -36.8 -2.0 46.4 -7.1 34 34 A D S S- 0 0 94 -32,-0.6 -1,-0.1 28,-0.1 -32,-0.1 -0.933 70.1-152.8-117.1 137.5 -2.9 49.9 -8.4 35 35 A L - 0 0 31 -2,-0.4 27,-0.1 -3,-0.1 26,-0.0 -0.807 25.0-146.2-108.1 88.5 -2.0 53.2 -6.7 36 36 A P - 0 0 29 0, 0.0 2,-0.4 0, 0.0 26,-0.1 -0.078 7.9-153.8 -53.0 153.2 -4.7 55.6 -7.8 37 37 A E - 0 0 118 24,-0.1 226,-0.2 226,-0.1 225,-0.1 -0.915 0.9-153.8-137.4 107.5 -3.8 59.3 -8.4 38 38 A F - 0 0 35 224,-2.5 2,-0.2 -2,-0.4 20,-0.0 -0.384 27.5-111.6 -73.8 158.4 -6.4 62.1 -8.1 39 39 A S > - 0 0 47 1,-0.1 4,-3.1 -2,-0.1 5,-0.3 -0.506 26.4-107.4 -87.8 161.6 -5.7 65.2 -10.1 40 40 A L H > S+ 0 0 136 1,-0.2 4,-2.0 2,-0.2 -1,-0.1 0.841 122.8 50.4 -55.3 -34.4 -4.9 68.5 -8.4 41 41 A T H > S+ 0 0 76 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.922 111.3 46.0 -70.9 -45.8 -8.4 69.7 -9.3 42 42 A E H > S+ 0 0 82 2,-0.2 4,-3.4 1,-0.2 5,-0.2 0.944 113.5 49.6 -61.4 -48.6 -10.1 66.7 -7.9 43 43 A I H X S+ 0 0 15 -4,-3.1 4,-1.8 1,-0.2 -1,-0.2 0.922 110.4 51.1 -54.9 -46.5 -8.0 66.9 -4.7 44 44 A D H < S+ 0 0 65 -4,-2.0 4,-0.3 -5,-0.3 -1,-0.2 0.872 114.9 43.4 -59.4 -38.9 -8.9 70.5 -4.5 45 45 A E H >X S+ 0 0 120 -4,-2.1 3,-1.4 1,-0.2 4,-0.6 0.882 108.0 56.7 -76.0 -41.0 -12.6 69.6 -4.8 46 46 A M H >< S+ 0 0 7 -4,-3.4 3,-1.2 1,-0.3 -2,-0.2 0.868 99.2 61.5 -59.0 -38.2 -12.6 66.6 -2.5 47 47 A L T 3< S+ 0 0 11 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.675 100.0 55.3 -63.9 -18.0 -11.3 68.8 0.4 48 48 A K T <4 S+ 0 0 164 -3,-1.4 -1,-0.3 -4,-0.3 -2,-0.2 0.628 91.6 90.2 -89.8 -15.5 -14.4 71.0 0.2 49 49 A L S << S- 0 0 64 -3,-1.2 182,-0.0 -4,-0.6 -3,-0.0 -0.401 91.5 -90.7 -78.1 157.7 -16.7 68.0 0.6 50 50 A D > - 0 0 81 -2,-0.1 4,-2.3 1,-0.1 5,-0.2 -0.191 42.8-101.7 -63.4 162.2 -17.9 66.9 4.1 51 51 A F H > S+ 0 0 24 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.924 117.2 46.6 -51.4 -55.7 -15.8 64.3 5.9 52 52 A V H > S+ 0 0 18 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.937 115.0 43.5 -56.0 -54.9 -18.1 61.3 5.2 53 53 A T H > S+ 0 0 24 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.883 114.3 51.6 -60.9 -39.7 -18.6 61.9 1.4 54 54 A R H X S+ 0 0 7 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.936 108.2 50.8 -62.7 -47.5 -14.9 62.7 0.9 55 55 A S H X S+ 0 0 0 -4,-2.5 4,-2.5 -5,-0.2 5,-0.2 0.894 106.1 56.8 -56.8 -42.6 -13.8 59.5 2.6 56 56 A A H X S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.915 108.1 46.5 -56.1 -47.5 -16.2 57.5 0.4 57 57 A K H X S+ 0 0 71 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.951 110.3 52.0 -61.2 -51.3 -14.6 58.8 -2.8 58 58 A I H < S+ 0 0 1 -4,-2.3 4,-0.5 1,-0.2 -1,-0.2 0.908 114.2 44.3 -50.9 -46.8 -11.0 58.2 -1.5 59 59 A L H >X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 3,-1.3 0.876 109.0 55.3 -67.5 -40.0 -12.0 54.6 -0.7 60 60 A S H 3X S+ 0 0 23 -4,-2.5 4,-2.5 1,-0.3 -1,-0.2 0.837 94.6 70.2 -62.4 -32.0 -13.9 54.1 -4.0 61 61 A A H 3< S+ 0 0 36 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.806 113.9 27.0 -55.3 -30.1 -10.7 55.2 -5.8 62 62 A F H <4 S+ 0 0 11 -3,-1.3 -2,-0.2 -4,-0.5 -60,-0.2 0.879 119.8 52.2 -96.3 -55.7 -9.2 51.9 -4.6 63 63 A I H >< S+ 0 0 0 -4,-2.6 3,-1.0 1,-0.2 -48,-0.2 0.850 83.5 173.9 -50.9 -41.8 -12.2 49.5 -4.2 64 64 A G G >< - 0 0 32 -4,-2.5 3,-0.8 1,-0.2 -1,-0.2 -0.431 58.5 -9.6 73.0-138.7 -13.4 50.3 -7.7 65 65 A D G 3 S+ 0 0 167 1,-0.2 -1,-0.2 -2,-0.2 -2,-0.1 0.744 114.5 84.7 -69.8 -25.4 -16.3 48.5 -9.3 66 66 A E G < S+ 0 0 64 -3,-1.0 -1,-0.2 1,-0.2 -2,-0.1 0.849 104.7 20.9 -46.6 -40.2 -16.5 45.9 -6.4 67 67 A I S < S- 0 0 7 -3,-0.8 -1,-0.2 -7,-0.1 2,-0.1 -0.978 85.4-118.8-138.4 126.0 -18.6 48.3 -4.4 68 68 A P >> - 0 0 60 0, 0.0 4,-2.4 0, 0.0 3,-0.7 -0.357 22.9-129.5 -60.6 132.0 -20.7 51.3 -5.6 69 69 A Q H 3> S+ 0 0 42 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.801 107.9 61.3 -52.2 -31.3 -19.5 54.6 -4.1 70 70 A E H 3> S+ 0 0 117 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.938 107.6 41.5 -62.5 -48.0 -23.1 55.3 -3.1 71 71 A I H <> S+ 0 0 47 -3,-0.7 4,-2.2 1,-0.2 3,-0.3 0.910 111.1 58.4 -64.7 -41.3 -23.2 52.2 -0.9 72 72 A L H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.822 101.5 55.9 -57.7 -33.2 -19.7 53.0 0.3 73 73 A E H X S+ 0 0 52 -4,-1.7 4,-2.4 -5,-0.2 -1,-0.2 0.899 107.2 48.7 -66.5 -41.6 -21.0 56.4 1.5 74 74 A E H X S+ 0 0 129 -4,-1.3 4,-1.3 -3,-0.3 -2,-0.2 0.909 112.7 46.8 -64.6 -44.7 -23.7 54.7 3.6 75 75 A R H X S+ 0 0 57 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.882 115.0 46.6 -66.1 -39.5 -21.2 52.3 5.2 76 76 A V H X S+ 0 0 0 -4,-2.1 4,-3.2 2,-0.2 -2,-0.2 0.886 108.3 55.1 -69.6 -40.1 -18.7 55.0 5.9 77 77 A R H < S+ 0 0 122 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.821 110.5 47.9 -62.4 -29.8 -21.4 57.3 7.4 78 78 A A H < S+ 0 0 41 -4,-1.3 3,-0.3 -5,-0.2 -2,-0.2 0.896 118.7 38.5 -76.7 -41.9 -22.2 54.5 9.7 79 79 A A H < S+ 0 0 0 -4,-2.0 2,-2.4 1,-0.2 -2,-0.2 0.962 110.4 56.4 -73.7 -56.4 -18.6 53.8 10.7 80 80 A F < + 0 0 7 -4,-3.2 -1,-0.2 1,-0.2 -28,-0.1 -0.355 63.1 148.5 -76.8 61.8 -17.2 57.4 10.9 81 81 A A + 0 0 69 -2,-2.4 -1,-0.2 -3,-0.3 -4,-0.1 0.109 59.9 53.6 -83.9 24.8 -19.9 58.5 13.4 82 82 A F S S- 0 0 20 19,-0.0 19,-0.1 27,-0.0 18,-0.0 -0.992 82.9-107.8-155.4 154.0 -17.4 61.0 14.9 83 83 A P - 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