==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-NOV-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 26-APR-04 1T3D . COMPND 2 MOLECULE: SERINE ACETYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR V.E.PYE,A.P.TINGEY,R.L.ROBSON,P.C.E.MOODY . 789 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25533.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 590 74.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 108 13.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 15 1.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.4 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 . 3 0.4 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 . 55 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 63 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 287 36.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 1.9 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 2 0 3 3 0 0 0 0 0 3 3 3 3 2 1 0 0 3 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 30 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 PARALLEL BRIDGES PER LADDER . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 6 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 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 X 0 0 73 0, 0.0 2,-0.1 0, 0.0 82,-0.1 0.000 360.0 360.0 360.0 91.8 57.2 54.5 -5.3 2 2 A S > - 0 0 44 1,-0.1 4,-2.1 77,-0.0 5,-0.1 -0.407 360.0-103.6 -83.1 167.0 57.0 58.3 -5.8 3 3 A C H > S+ 0 0 98 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.813 122.4 51.3 -64.4 -27.3 53.8 60.1 -6.3 4 4 A E H > S+ 0 0 141 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.910 109.8 48.1 -72.9 -46.4 54.5 60.4 -10.1 5 5 A E H > S+ 0 0 103 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.814 108.1 56.4 -63.9 -34.3 55.2 56.7 -10.5 6 6 A L H X S+ 0 0 41 -4,-2.1 4,-2.6 2,-0.2 3,-0.2 0.964 104.7 51.6 -58.9 -52.0 52.0 55.9 -8.6 7 7 A E H X S+ 0 0 78 -4,-1.6 4,-2.5 1,-0.2 -2,-0.2 0.818 108.7 52.8 -59.3 -28.5 49.9 58.0 -11.1 8 8 A I H X S+ 0 0 87 -4,-1.3 4,-2.2 2,-0.2 -1,-0.2 0.894 107.1 49.6 -76.6 -39.8 51.5 56.0 -13.9 9 9 A V H X S+ 0 0 8 -4,-1.9 4,-2.2 -3,-0.2 -2,-0.2 0.957 114.4 47.3 -56.1 -43.6 50.6 52.6 -12.4 10 10 A W H X S+ 0 0 2 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.924 109.6 51.7 -67.7 -42.7 47.1 54.0 -12.0 11 11 A N H X S+ 0 0 80 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.864 110.6 49.5 -61.3 -39.0 47.0 55.4 -15.6 12 12 A N H X S+ 0 0 55 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.889 108.1 52.9 -64.9 -42.9 48.0 51.9 -16.9 13 13 A I H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.931 112.2 45.7 -57.6 -46.8 45.4 50.2 -14.8 14 14 A K H X S+ 0 0 23 -4,-2.4 4,-1.6 2,-0.2 -2,-0.2 0.924 110.6 52.3 -64.5 -45.1 42.7 52.5 -16.4 15 15 A A H X S+ 0 0 44 -4,-2.4 4,-1.2 1,-0.2 3,-0.4 0.929 112.0 47.0 -56.3 -44.5 44.1 52.1 -19.9 16 16 A E H X S+ 0 0 29 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.917 107.4 58.2 -61.4 -42.1 43.8 48.3 -19.4 17 17 A A H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.807 99.8 55.7 -60.1 -37.0 40.4 48.6 -18.0 18 18 A R H X S+ 0 0 132 -4,-1.6 4,-1.7 -3,-0.4 -1,-0.2 0.924 110.4 45.3 -62.2 -45.0 39.0 50.3 -21.1 19 19 A T H X S+ 0 0 88 -4,-1.2 4,-1.2 -3,-0.2 -2,-0.2 0.885 112.1 51.9 -63.9 -43.1 40.1 47.4 -23.3 20 20 A L H X S+ 0 0 18 -4,-2.3 4,-1.2 1,-0.2 3,-0.4 0.914 108.5 51.1 -61.7 -44.1 38.8 44.9 -20.9 21 21 A A H < S+ 0 0 18 -4,-2.5 3,-0.3 1,-0.2 -1,-0.2 0.881 109.4 50.6 -61.6 -37.3 35.3 46.6 -20.8 22 22 A D H < S+ 0 0 140 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.751 113.4 46.1 -71.6 -24.4 35.2 46.6 -24.7 23 23 A C H < S+ 0 0 91 -4,-1.2 -1,-0.2 -3,-0.4 -2,-0.2 0.633 113.2 41.5 -94.5 -19.4 36.0 42.9 -24.9 24 24 A E >X - 0 0 2 -4,-1.2 3,-1.7 -3,-0.3 4,-0.7 -0.768 57.1-174.7-136.7 87.0 33.8 41.3 -22.3 25 25 A P G >4 S+ 0 0 104 0, 0.0 3,-0.5 0, 0.0 4,-0.5 0.807 84.6 60.2 -58.0 -27.7 30.2 42.6 -22.1 26 26 A X G 34 S+ 0 0 59 1,-0.2 4,-0.1 2,-0.1 -5,-0.1 0.783 115.6 34.5 -67.9 -28.8 29.3 40.5 -19.0 27 27 A L G <> S+ 0 0 0 -3,-1.7 4,-2.6 -7,-0.2 5,-0.2 0.334 88.1 101.1-106.6 5.8 32.1 42.2 -17.1 28 28 A A H S+ 0 0 101 -4,-0.5 4,-2.1 2,-0.2 -1,-0.2 0.836 111.3 53.9 -66.7 -31.4 30.0 47.2 -15.7 30 30 A F H > S+ 0 0 23 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.940 110.4 46.7 -66.7 -49.4 32.3 45.4 -13.2 31 31 A Y H X>S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 5,-1.8 0.857 113.1 50.3 -58.2 -39.1 35.4 47.0 -14.8 32 32 A H H <>S+ 0 0 97 -4,-2.1 5,-2.1 -5,-0.2 -2,-0.2 0.918 114.7 41.8 -66.4 -42.9 33.6 50.4 -14.8 33 33 A A H <5S+ 0 0 24 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.897 122.2 38.7 -75.3 -40.9 32.6 50.3 -11.2 34 34 A T H <5S- 0 0 3 -4,-2.6 -3,-0.2 -5,-0.1 -2,-0.2 0.893 137.8 -0.2 -77.8 -41.9 36.0 48.9 -9.9 35 35 A L T ><5S+ 0 0 0 -4,-2.2 3,-1.7 -5,-0.3 -3,-0.2 0.839 119.7 55.4-117.5 -58.3 38.4 50.8 -12.2 36 36 A L T 3 S- 0 0 71 -5,-0.1 4,-1.4 1,-0.1 3,-0.3 -0.983 79.9-104.8-157.6 164.9 43.3 57.0 -8.2 41 41 A L H > S+ 0 0 3 -2,-0.3 4,-3.1 1,-0.2 5,-0.2 0.876 113.1 62.2 -62.5 -35.5 44.5 53.7 -6.8 42 42 A G H > S+ 0 0 3 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.899 104.5 45.1 -58.5 -45.4 43.2 54.4 -3.3 43 43 A S H > S+ 0 0 28 -3,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.860 114.4 49.4 -65.2 -41.5 39.6 54.7 -4.3 44 44 A A H X S+ 0 0 0 -4,-1.4 4,-2.4 2,-0.2 -2,-0.2 0.914 111.5 50.1 -63.9 -43.5 39.8 51.5 -6.4 45 45 A L H X S+ 0 0 2 -4,-3.1 4,-2.5 2,-0.2 -2,-0.2 0.898 110.2 47.5 -63.0 -44.8 41.5 49.7 -3.6 46 46 A S H X S+ 0 0 0 -4,-2.2 4,-2.9 1,-0.2 5,-0.3 0.931 112.0 53.6 -66.2 -38.6 38.9 50.7 -0.9 47 47 A Y H X S+ 0 0 63 -4,-2.0 4,-2.3 -5,-0.2 -2,-0.2 0.938 111.2 42.9 -54.5 -54.9 36.2 49.7 -3.4 48 48 A X H X S+ 0 0 6 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.883 116.2 48.2 -63.0 -43.1 37.7 46.2 -3.9 49 49 A L H X S+ 0 0 4 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.940 111.4 49.1 -65.4 -43.4 38.4 45.6 -0.2 50 50 A A H X S+ 0 0 3 -4,-2.9 4,-0.7 1,-0.2 -2,-0.2 0.934 114.9 45.0 -62.0 -44.7 34.9 46.7 0.9 51 51 A N H < S+ 0 0 84 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.873 115.5 44.9 -68.7 -35.5 33.2 44.5 -1.7 52 52 A K H < S+ 0 0 64 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.873 116.4 42.9 -81.5 -37.0 35.3 41.4 -1.1 53 53 A L H < S+ 0 0 7 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.423 84.9 131.7 -83.6 -8.2 35.3 41.4 2.7 54 54 A S < + 0 0 52 -4,-0.7 3,-0.1 -5,-0.2 -3,-0.0 -0.213 26.9 159.1 -45.8 133.2 31.6 42.3 2.9 55 55 A S - 0 0 18 3,-2.2 3,-0.2 1,-0.1 -2,-0.0 -0.947 57.3 -99.1-148.1 168.8 29.5 40.1 5.3 56 56 A P S S+ 0 0 143 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.912 125.0 55.9 -58.7 -34.1 26.2 40.2 7.2 57 57 A I S S+ 0 0 49 1,-0.2 499,-0.1 -3,-0.1 -3,-0.1 0.884 128.3 9.3 -65.9 -35.2 28.3 41.2 10.3 58 58 A X S S- 0 0 6 -3,-0.2 -3,-2.2 -5,-0.1 -1,-0.2 -0.838 79.1-143.0-151.3 115.6 29.8 44.2 8.3 59 59 A P >> - 0 0 63 0, 0.0 4,-2.4 0, 0.0 3,-0.9 -0.271 27.7-107.4 -79.6 161.9 28.7 45.5 4.9 60 60 A A H 3> S+ 0 0 18 1,-0.3 4,-2.7 2,-0.2 5,-0.2 0.828 116.5 57.3 -49.7 -42.3 30.8 46.8 2.1 61 61 A I H 3> S+ 0 0 133 1,-0.2 4,-1.0 2,-0.2 -1,-0.3 0.872 111.4 42.0 -66.8 -36.3 29.6 50.4 2.7 62 62 A A H <> S+ 0 0 26 -3,-0.9 4,-1.3 2,-0.2 3,-0.3 0.916 112.2 53.5 -74.3 -48.0 30.9 50.3 6.3 63 63 A I H >X S+ 0 0 4 -4,-2.4 4,-2.4 1,-0.2 3,-0.6 0.929 104.5 59.0 -47.8 -45.5 34.1 48.5 5.6 64 64 A R H 3X S+ 0 0 70 -4,-2.7 4,-2.8 1,-0.3 5,-0.2 0.852 101.1 51.2 -62.6 -39.6 34.9 51.2 2.9 65 65 A E H 3X S+ 0 0 141 -4,-1.0 4,-2.3 -3,-0.3 -1,-0.3 0.868 110.5 50.6 -62.7 -34.8 34.8 54.1 5.3 66 66 A V H < + 0 0 63 -4,-2.1 3,-1.9 -5,-0.2 4,-0.3 -0.659 63.1 172.1-144.6 75.5 48.6 56.7 6.1 75 75 A P T >> S+ 0 0 80 0, 0.0 3,-1.5 0, 0.0 4,-1.1 0.669 70.7 80.5 -62.4 -18.9 48.6 57.2 2.3 76 76 A E H 3> S+ 0 0 107 1,-0.3 4,-2.3 2,-0.2 5,-0.1 0.687 79.4 70.0 -57.4 -23.8 51.9 55.2 2.1 77 77 A X H <> S+ 0 0 11 -3,-1.9 4,-1.9 2,-0.2 -1,-0.3 0.844 96.9 50.0 -59.5 -32.7 49.6 52.2 2.4 78 78 A I H <> S+ 0 0 26 -3,-1.5 4,-2.1 -4,-0.3 -2,-0.2 0.908 109.7 49.8 -73.9 -42.3 48.4 53.0 -1.1 79 79 A A H X S+ 0 0 8 -4,-1.1 4,-2.1 2,-0.2 -2,-0.2 0.886 108.5 54.3 -58.2 -36.9 52.0 53.3 -2.3 80 80 A S H X S+ 0 0 14 -4,-2.3 4,-2.0 1,-0.2 73,-0.6 0.938 107.2 49.9 -66.1 -46.0 52.7 49.9 -0.7 81 81 A A H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.873 107.7 54.6 -54.9 -45.5 49.8 48.4 -2.7 82 82 A A H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.894 109.8 46.4 -58.6 -40.0 51.2 49.9 -5.9 83 83 A C H X S+ 0 0 21 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.847 110.1 53.1 -68.2 -38.1 54.5 48.2 -5.2 84 84 A D H X S+ 0 0 0 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.864 108.2 51.5 -64.5 -37.3 52.8 45.0 -4.4 85 85 A I H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.928 110.4 47.3 -63.8 -47.2 51.0 45.2 -7.8 86 86 A Q H X S+ 0 0 55 -4,-2.1 4,-2.6 1,-0.2 5,-0.3 0.895 107.8 58.0 -60.5 -40.3 54.3 45.8 -9.6 87 87 A A H X S+ 0 0 3 -4,-2.5 4,-2.2 1,-0.2 5,-0.3 0.948 110.2 42.8 -52.9 -50.8 55.7 42.8 -7.7 88 88 A V H X S+ 0 0 9 -4,-2.0 4,-2.4 66,-0.2 7,-0.3 0.925 114.9 48.4 -65.5 -46.0 53.0 40.5 -9.1 89 89 A R H < S+ 0 0 88 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.911 118.8 38.7 -64.7 -40.9 53.1 41.8 -12.6 90 90 A T H < S+ 0 0 65 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.826 125.1 36.4 -79.2 -28.2 56.9 41.6 -12.9 91 91 A R H < S+ 0 0 9 -4,-2.2 -2,-0.2 -5,-0.3 -3,-0.2 0.727 104.6 68.4-100.5 -22.0 57.4 38.3 -11.0 92 92 A D >< - 0 0 7 -4,-2.4 3,-2.1 -5,-0.3 -1,-0.1 -0.875 60.3-162.2-106.0 109.4 54.4 36.2 -11.9 93 93 A P T 3 S+ 0 0 23 0, 0.0 360,-0.1 0, 0.0 -1,-0.1 0.662 89.6 66.2 -67.7 -16.2 54.4 35.1 -15.6 94 94 A A T 3 S+ 0 0 35 358,-0.1 2,-0.5 1,-0.1 -5,-0.1 0.510 95.2 68.3 -76.1 -8.1 50.7 34.4 -15.4 95 95 A V < + 0 0 8 -3,-2.1 -3,-0.1 -7,-0.3 -1,-0.1 -0.964 45.9 160.8-115.9 120.0 50.0 38.1 -14.9 96 96 A D + 0 0 119 -2,-0.5 2,-0.3 1,-0.0 -1,-0.1 0.256 61.1 64.0-116.3 12.5 50.7 40.5 -17.8 97 97 A K - 0 0 65 1,-0.1 3,-0.4 -81,-0.0 -84,-0.1 -0.984 69.3-137.8-140.1 143.0 48.6 43.5 -16.5 98 98 A Y S > S+ 0 0 27 -2,-0.3 4,-0.8 1,-0.2 -85,-0.1 0.834 105.8 60.2 -64.2 -32.4 48.6 45.8 -13.6 99 99 A S H > S+ 0 0 0 1,-0.2 4,-2.3 -87,-0.2 5,-0.2 0.812 87.6 76.3 -66.8 -28.6 44.8 45.5 -13.3 100 100 A T H >>S+ 0 0 13 -3,-0.4 4,-2.5 1,-0.2 5,-0.7 0.888 95.0 42.4 -58.9 -51.7 45.0 41.7 -12.7 101 101 A P H >5S+ 0 0 0 0, 0.0 4,-0.9 0, 0.0 -1,-0.2 0.928 116.4 50.4 -59.8 -43.7 46.1 41.5 -9.0 102 102 A L H <5S+ 0 0 0 -4,-0.8 -2,-0.2 1,-0.2 -3,-0.1 0.857 119.1 36.0 -61.5 -38.6 43.8 44.4 -8.1 103 103 A L H <5S+ 0 0 1 -4,-2.3 -1,-0.2 -3,-0.1 -3,-0.2 0.882 136.4 1.9 -82.0 -39.7 40.7 42.8 -9.7 104 104 A Y H <5S+ 0 0 12 -4,-2.5 2,-0.8 -5,-0.2 -2,-0.1 0.651 88.4 103.5-128.7 -26.1 41.2 39.0 -9.1 105 105 A L >X< - 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