==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 07-FEB-06 2FY4 . COMPND 2 MOLECULE: CHOLINE O-ACETYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.R.KIM,R.J.RYLETT,B.H.SHILTON . 589 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24310.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 423 71.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 21 3.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 57 9.7 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 . 1 0.2 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 . 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 . 48 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 52 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 221 37.5 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 1 1 1 0 1 0 1 1 3 0 3 1 1 1 0 1 1 0 0 2 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 2 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 . 3 1 3 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 1 0 1 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 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 11 A S 0 0 121 0, 0.0 428,-0.1 0, 0.0 140,-0.0 0.000 360.0 360.0 360.0 150.1 7.0 -22.7 59.9 2 12 A G + 0 0 86 2,-0.1 427,-0.0 0, 0.0 0, 0.0 0.524 360.0 105.8 -94.5 -7.9 9.8 -24.1 62.1 3 13 A L S S- 0 0 24 1,-0.1 425,-0.1 137,-0.0 2,-0.1 -0.359 78.2-105.3 -71.0 151.5 9.9 -21.1 64.4 4 14 A P - 0 0 72 0, 0.0 425,-1.8 0, 0.0 2,-0.2 -0.360 37.9-103.2 -74.3 158.0 8.5 -21.4 67.9 5 15 A K - 0 0 76 423,-0.2 59,-0.1 1,-0.1 58,-0.1 -0.544 44.3 -89.2 -81.8 148.9 5.1 -19.8 68.7 6 16 A L - 0 0 2 57,-0.5 59,-0.2 423,-0.3 -1,-0.1 -0.359 55.3-117.6 -53.4 126.7 5.0 -16.6 70.8 7 17 A P - 0 0 31 0, 0.0 -1,-0.1 0, 0.0 421,-0.0 -0.255 9.2-132.3 -70.9 156.9 4.9 -17.7 74.4 8 18 A V - 0 0 25 476,-0.0 3,-0.1 48,-0.0 476,-0.1 -0.932 27.9-138.2-107.3 106.9 2.1 -17.1 76.8 9 19 A P - 0 0 3 0, 0.0 475,-0.1 0, 0.0 476,-0.0 -0.236 31.6 -90.5 -62.0 152.7 3.6 -15.8 80.0 10 20 A P > - 0 0 61 0, 0.0 4,-1.8 0, 0.0 5,-0.2 -0.341 34.3-124.4 -63.9 145.7 2.2 -17.1 83.2 11 21 A L H > S+ 0 0 14 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.943 107.5 48.3 -56.7 -54.6 -0.6 -15.0 84.6 12 22 A Q H > S+ 0 0 103 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.820 108.6 56.2 -57.8 -33.4 0.8 -14.3 88.0 13 23 A Q H > S+ 0 0 63 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.943 110.0 43.7 -64.7 -47.5 4.2 -13.3 86.5 14 24 A T H X S+ 0 0 1 -4,-1.8 4,-2.7 2,-0.2 -2,-0.2 0.890 114.1 50.3 -66.0 -39.0 2.6 -10.6 84.3 15 25 A L H X S+ 0 0 4 -4,-2.4 4,-2.2 2,-0.2 5,-0.2 0.928 111.9 46.8 -67.1 -43.5 0.4 -9.3 87.1 16 26 A A H X S+ 0 0 61 -4,-2.4 4,-2.3 -5,-0.2 -2,-0.2 0.948 114.6 47.2 -62.2 -47.5 3.3 -9.0 89.5 17 27 A T H X S+ 0 0 30 -4,-2.4 4,-2.6 -5,-0.2 -2,-0.2 0.914 109.4 55.3 -59.7 -44.5 5.5 -7.3 86.9 18 28 A Y H X S+ 0 0 1 -4,-2.7 4,-1.4 2,-0.2 -1,-0.2 0.951 109.8 43.7 -53.1 -57.2 2.7 -5.0 86.0 19 29 A L H X S+ 0 0 32 -4,-2.2 4,-1.9 1,-0.2 3,-0.4 0.910 114.0 51.0 -56.6 -45.4 2.2 -3.7 89.5 20 30 A Q H < S+ 0 0 98 -4,-2.3 4,-0.5 1,-0.2 -1,-0.2 0.871 107.2 54.9 -61.4 -37.2 5.9 -3.4 90.1 21 31 A C H < S+ 0 0 17 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.808 118.2 33.9 -64.4 -31.5 6.2 -1.4 86.8 22 32 A M H >< S+ 0 0 1 -4,-1.4 3,-1.7 -3,-0.4 4,-0.5 0.589 88.4 91.7-105.1 -12.7 3.6 1.1 88.0 23 33 A R G >< S+ 0 0 132 -4,-1.9 3,-1.0 1,-0.3 8,-0.1 0.914 95.3 41.3 -49.9 -49.6 4.1 1.5 91.7 24 34 A H G 3 S+ 0 0 43 -4,-0.5 -1,-0.3 1,-0.2 392,-0.2 0.497 110.7 60.4 -78.9 -1.4 6.5 4.4 91.4 25 35 A L G < S+ 0 0 28 -3,-1.7 2,-0.3 2,-0.1 -1,-0.2 0.341 104.6 47.0-106.9 5.9 4.5 6.0 88.6 26 36 A V S < S- 0 0 24 -3,-1.0 486,-0.0 -4,-0.5 0, 0.0 -0.922 93.1 -84.8-139.9 165.7 1.3 6.5 90.6 27 37 A S > - 0 0 62 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.249 39.5-114.8 -66.7 159.6 0.2 7.9 94.0 28 38 A E H > S+ 0 0 153 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.925 117.1 51.7 -61.1 -45.8 0.3 5.6 97.0 29 39 A E H > S+ 0 0 126 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.944 111.8 45.7 -55.3 -52.7 -3.5 5.7 97.3 30 40 A Q H > S+ 0 0 49 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.879 111.1 53.5 -60.8 -39.0 -4.0 4.8 93.7 31 41 A F H X S+ 0 0 11 -4,-2.4 4,-3.0 2,-0.2 -1,-0.2 0.926 105.8 52.8 -63.3 -43.4 -1.5 2.0 93.9 32 42 A R H X S+ 0 0 166 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.927 110.2 48.3 -57.5 -44.5 -3.3 0.5 96.9 33 43 A K H X S+ 0 0 121 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.900 112.5 48.5 -62.9 -40.6 -6.5 0.5 94.9 34 44 A S H X S+ 0 0 0 -4,-2.3 4,-3.1 2,-0.2 5,-0.3 0.892 106.3 57.1 -66.6 -39.9 -4.7 -1.1 91.9 35 45 A Q H X S+ 0 0 79 -4,-3.0 4,-2.6 1,-0.2 -1,-0.2 0.936 111.0 43.4 -54.5 -49.3 -3.2 -3.7 94.2 36 46 A A H X S+ 0 0 62 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.880 112.2 53.0 -65.5 -40.4 -6.6 -4.8 95.3 37 47 A I H X S+ 0 0 25 -4,-2.2 4,-1.9 1,-0.2 470,-0.2 0.935 113.4 43.3 -61.4 -44.9 -8.0 -4.7 91.8 38 48 A V H X S+ 0 0 6 -4,-3.1 4,-2.9 2,-0.2 -2,-0.2 0.901 109.7 56.0 -66.7 -44.3 -5.2 -6.9 90.5 39 49 A Q H < S+ 0 0 129 -4,-2.6 4,-0.3 -5,-0.3 -1,-0.2 0.931 111.7 44.4 -53.5 -46.4 -5.5 -9.3 93.5 40 50 A Q H >< S+ 0 0 123 -4,-2.2 3,-0.7 1,-0.2 7,-0.3 0.873 112.4 52.1 -68.1 -37.6 -9.1 -9.8 92.7 41 51 A F H 3< S+ 0 0 7 -4,-1.9 7,-2.6 1,-0.2 8,-0.4 0.924 117.2 36.6 -65.3 -45.6 -8.5 -10.2 89.0 42 52 A G T 3< S+ 0 0 6 -4,-2.9 -1,-0.2 6,-0.2 -2,-0.2 0.219 87.3 128.7 -95.5 16.5 -5.9 -12.9 89.3 43 53 A A S X S- 0 0 23 -3,-0.7 3,-2.5 -4,-0.3 6,-0.5 -0.298 74.7 -76.6 -70.1 154.9 -7.3 -14.8 92.2 44 54 A P T 3 S+ 0 0 118 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.242 120.2 5.5 -52.6 130.5 -7.8 -18.6 92.0 45 55 A G T 3 S+ 0 0 70 1,-0.2 -2,-0.1 -3,-0.1 -3,-0.1 0.659 108.0 130.9 68.3 14.8 -10.8 -19.4 89.9 46 56 A G S <> S- 0 0 18 -3,-2.5 4,-1.4 -4,-0.1 -1,-0.2 -0.125 77.3 -87.5 -88.3-171.9 -11.2 -15.7 89.1 47 57 A L H > S+ 0 0 59 -7,-0.3 4,-2.8 1,-0.2 5,-0.3 0.921 121.7 60.4 -63.8 -45.8 -11.6 -13.9 85.8 48 58 A G H > S+ 0 0 0 -7,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.911 106.6 45.7 -48.8 -49.6 -7.9 -13.6 85.2 49 59 A E H > S+ 0 0 83 -6,-0.5 4,-1.9 -8,-0.4 -1,-0.2 0.840 110.6 53.8 -66.1 -33.2 -7.5 -17.4 85.1 50 60 A T H X S+ 0 0 64 -4,-1.4 4,-1.7 -3,-0.2 -1,-0.2 0.936 112.5 43.6 -65.5 -45.6 -10.6 -17.9 82.9 51 61 A L H X S+ 0 0 0 -4,-2.8 4,-1.8 1,-0.2 -2,-0.2 0.886 110.1 56.2 -67.2 -38.2 -9.2 -15.4 80.4 52 62 A Q H X S+ 0 0 24 -4,-2.5 4,-2.3 -5,-0.3 -1,-0.2 0.908 106.1 50.8 -59.6 -42.3 -5.7 -17.0 80.6 53 63 A Q H X S+ 0 0 108 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.921 109.2 51.0 -63.0 -41.7 -7.2 -20.4 79.7 54 64 A K H X S+ 0 0 77 -4,-1.7 4,-2.1 1,-0.2 -1,-0.2 0.834 108.3 52.8 -64.3 -31.1 -8.9 -18.8 76.7 55 65 A L H X S+ 0 0 0 -4,-1.8 4,-3.0 2,-0.2 -1,-0.2 0.901 106.8 51.3 -71.4 -40.4 -5.6 -17.3 75.7 56 66 A L H X S+ 0 0 62 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.905 110.6 49.8 -62.0 -38.3 -3.8 -20.7 75.8 57 67 A E H X S+ 0 0 97 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.920 111.8 48.2 -65.6 -41.6 -6.6 -22.0 73.6 58 68 A R H X S+ 0 0 52 -4,-2.1 4,-1.4 1,-0.2 -2,-0.2 0.897 107.8 55.3 -64.9 -40.7 -6.1 -19.1 71.2 59 69 A Q H < S+ 0 0 46 -4,-3.0 -1,-0.2 1,-0.2 3,-0.2 0.894 110.2 46.3 -58.5 -41.1 -2.4 -19.7 71.2 60 70 A E H < S+ 0 0 155 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.872 114.4 46.9 -69.4 -38.6 -3.0 -23.3 70.1 61 71 A K H < S+ 0 0 174 -4,-2.0 2,-0.3 -5,-0.1 -1,-0.2 0.582 113.7 49.7 -82.1 -11.6 -5.5 -22.4 67.4 62 72 A T S < S- 0 0 44 -4,-1.4 3,-0.3 -3,-0.2 0, 0.0 -0.858 75.0-128.0-127.2 163.8 -3.4 -19.6 65.9 63 73 A A S S+ 0 0 34 1,-0.3 -57,-0.5 -2,-0.3 2,-0.3 0.841 106.3 11.3 -74.5 -34.8 0.1 -19.0 64.6 64 74 A N > - 0 0 10 -59,-0.1 3,-0.8 -6,-0.1 4,-0.4 -0.886 68.8-153.6-147.7 109.3 0.5 -15.9 66.8 65 75 A W T 3 S+ 0 0 6 -2,-0.3 4,-0.2 -3,-0.3 -6,-0.1 0.526 92.9 41.6 -63.6 -7.0 -2.1 -15.2 69.5 66 76 A V T 3> S+ 0 0 4 2,-0.1 4,-3.4 3,-0.1 5,-0.4 0.573 81.2 96.5-117.8 -11.3 -1.5 -11.4 69.4 67 77 A S H <> S+ 0 0 30 -3,-0.8 4,-2.7 1,-0.2 5,-0.2 0.892 91.8 41.4 -44.1 -53.7 -1.1 -10.5 65.8 68 78 A E H > S+ 0 0 119 -4,-0.4 4,-2.0 2,-0.2 5,-0.2 0.941 118.5 43.5 -63.7 -51.4 -4.7 -9.4 65.3 69 79 A Y H > S+ 0 0 24 -4,-0.2 4,-3.1 2,-0.2 5,-0.3 0.936 117.6 47.1 -60.0 -46.7 -5.1 -7.6 68.6 70 80 A W H X S+ 0 0 10 -4,-3.4 4,-3.2 1,-0.2 5,-0.5 0.938 109.1 52.8 -60.8 -51.0 -1.7 -5.9 68.2 71 81 A L H X>S+ 0 0 39 -4,-2.7 5,-1.9 -5,-0.4 4,-1.4 0.877 117.3 38.9 -54.8 -41.1 -2.3 -4.9 64.6 72 82 A N H <>S+ 0 0 22 -4,-2.0 5,-2.8 3,-0.2 6,-0.4 0.929 119.2 44.4 -76.5 -46.6 -5.6 -3.2 65.6 73 83 A D H <5S+ 0 0 72 -4,-3.1 -2,-0.2 -5,-0.2 -3,-0.2 0.882 120.3 39.9 -65.6 -40.6 -4.5 -1.7 68.9 74 84 A M H <5S- 0 0 54 -4,-3.2 -3,-0.2 -5,-0.3 -1,-0.2 0.887 138.9 -12.4 -78.4 -40.1 -1.2 -0.4 67.7 75 85 A Y T ><5S+ 0 0 16 -4,-1.4 3,-1.7 -5,-0.5 -3,-0.2 0.703 120.0 56.4-128.1 -66.3 -2.2 0.9 64.2 76 86 A L T 3 >S+ 0 0 1 143,-0.6 4,-2.7 141,-0.4 5,-2.5 0.893 82.4 93.8 -61.7 -44.3 -0.7 8.9 59.4 83 93 A P B 45S-a 87 0A 0 0, 0.0 2,-2.9 0, 0.0 195,-0.1 -0.278 109.9 -15.9 -56.2 132.9 1.8 11.7 58.7 84 94 A V T 45S+ 0 0 2 3,-0.6 453,-1.8 193,-0.4 -2,-0.1 -0.212 133.7 66.9 68.6 -49.7 4.1 12.3 61.8 85 95 A N T 45S- 0 0 30 -2,-2.9 -1,-0.2 -4,-0.4 -3,-0.2 0.874 125.5 -6.9 -67.8 -37.6 1.7 10.4 64.1 86 96 A S T <5S+ 0 0 13 -4,-2.7 -4,-0.1 -5,-0.2 225,-0.1 0.724 108.8 80.1-129.8 -45.8 2.3 7.0 62.6 87 97 A S B < -a 83 0A 0 -5,-2.5 -3,-0.6 223,-0.1 223,-0.2 -0.617 63.0-152.9 -80.1 109.0 4.3 6.7 59.4 88 98 A P - 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