==== 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 04-JUL-05 2CY2 . COMPND 2 MOLECULE: PROBABLE ACETYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR T.KAMINISHI,C.TAKEMOTO,T.UCHIKUBO-KAMO,T.TERADA,M.SHIROUZU, . 174 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9251.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 122 70.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 3.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 40 23.0 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 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 . 9 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 51 29.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.1 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 0 0 1 0 0 0 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 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 0 PARALLEL BRIDGES PER LADDER . 0 0 1 0 0 1 2 0 1 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 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 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 V 0 0 111 0, 0.0 2,-0.3 0, 0.0 64,-0.2 0.000 360.0 360.0 360.0 -70.9 1.9 30.8 57.1 2 2 A R - 0 0 111 62,-0.4 62,-2.8 63,-0.3 2,-0.4 -0.868 360.0-143.9-123.3 152.7 1.8 32.1 53.5 3 3 A I E +A 63 0A 27 -2,-0.3 2,-0.3 60,-0.2 60,-0.2 -0.861 29.0 152.7-109.3 137.7 0.5 35.1 51.6 4 4 A R E -A 62 0A 63 58,-2.1 58,-2.8 -2,-0.4 2,-0.1 -0.969 48.5 -80.3-154.4 167.1 -1.0 35.0 48.0 5 5 A R E -A 61 0A 114 -2,-0.3 56,-0.3 56,-0.2 2,-0.1 -0.474 55.7-109.7 -70.4 146.9 -3.4 36.8 45.7 6 6 A A - 0 0 14 54,-2.1 2,-0.2 -2,-0.1 54,-0.2 -0.392 28.1-159.4 -78.2 154.6 -7.0 35.9 46.3 7 7 A G >> - 0 0 29 -2,-0.1 3,-0.8 1,-0.0 4,-0.6 -0.729 37.7 -98.0-121.3 174.3 -9.1 33.8 43.9 8 8 A L G >4 S+ 0 0 91 -2,-0.2 3,-0.7 1,-0.2 40,-0.1 0.800 122.5 58.6 -64.6 -29.2 -12.9 33.6 43.7 9 9 A E G 34 S+ 0 0 188 1,-0.2 4,-0.4 2,-0.1 -1,-0.2 0.762 100.2 58.7 -71.7 -24.4 -13.0 30.4 45.8 10 10 A D G <> S+ 0 0 23 -3,-0.8 4,-2.1 1,-0.2 3,-0.4 0.669 84.5 84.9 -76.1 -19.2 -11.2 32.3 48.6 11 11 A L H S+ 0 0 63 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.936 114.8 44.5 -56.5 -40.7 -16.5 33.1 51.3 13 13 A G H > S+ 0 0 7 -4,-0.4 4,-2.3 -3,-0.4 -2,-0.2 0.883 111.3 52.6 -67.6 -39.1 -13.5 32.8 53.7 14 14 A V H X S+ 0 0 0 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.912 107.8 52.8 -61.6 -43.2 -12.5 36.4 53.1 15 15 A A H X S+ 0 0 0 -4,-3.3 4,-2.7 1,-0.2 5,-0.2 0.879 109.3 48.1 -62.8 -36.4 -16.0 37.5 53.9 16 16 A R H X S+ 0 0 111 -4,-1.7 4,-3.1 -5,-0.2 5,-0.4 0.925 110.3 50.6 -71.2 -41.0 -15.9 35.5 57.2 17 17 A V H X S+ 0 0 2 -4,-2.3 4,-2.4 2,-0.2 5,-0.3 0.950 114.2 47.5 -58.6 -46.1 -12.5 37.0 58.2 18 18 A L H X S+ 0 0 11 -4,-2.6 4,-2.6 2,-0.2 5,-0.2 0.976 116.8 38.9 -58.9 -59.6 -13.9 40.4 57.5 19 19 A V H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 5,-0.2 0.938 118.2 47.9 -61.9 -45.8 -17.2 40.1 59.3 20 20 A D H X S+ 0 0 53 -4,-3.1 4,-2.1 -5,-0.2 -1,-0.2 0.912 114.7 45.0 -64.9 -39.0 -15.8 38.2 62.3 21 21 A T H X S+ 0 0 2 -4,-2.4 4,-3.3 -5,-0.4 5,-0.3 0.884 111.1 53.3 -73.5 -34.8 -12.8 40.5 62.8 22 22 A W H X S+ 0 0 45 -4,-2.6 4,-3.0 -5,-0.3 -1,-0.2 0.948 112.1 46.9 -58.7 -47.5 -15.1 43.7 62.4 23 23 A R H < S+ 0 0 86 -4,-2.4 4,-0.4 -5,-0.2 -2,-0.2 0.880 116.2 43.3 -63.0 -40.5 -17.3 42.2 65.1 24 24 A A H < S+ 0 0 54 -4,-2.1 3,-0.3 -5,-0.2 -2,-0.2 0.897 120.6 40.6 -74.8 -37.9 -14.4 41.4 67.4 25 25 A T H < S+ 0 0 34 -4,-3.3 -2,-0.2 1,-0.2 -3,-0.2 0.877 116.1 43.8 -80.6 -37.7 -12.5 44.6 66.8 26 26 A Y S >X S+ 0 0 15 -4,-3.0 3,-2.6 -5,-0.3 4,-2.5 0.279 71.6 142.8 -97.0 13.1 -15.2 47.3 66.8 27 27 A R B 34 S+g 30 0B 199 -4,-0.4 -4,-0.0 -3,-0.3 -3,-0.0 -0.283 81.9 5.0 -50.8 126.3 -17.3 46.1 69.8 28 28 A G T 34 S+ 0 0 77 2,-0.5 -1,-0.3 1,-0.1 -2,-0.1 0.636 125.5 68.8 71.8 13.0 -18.6 49.2 71.6 29 29 A V T <4 S+ 0 0 44 -3,-2.6 -2,-0.2 1,-0.6 -1,-0.1 0.579 99.9 40.3-123.4 -47.4 -17.1 51.5 69.0 30 30 A V B < S-g 27 0B 3 -4,-2.5 -1,-0.6 1,-0.1 -2,-0.5 -0.858 109.0 -87.3-103.7 139.0 -19.3 50.8 66.0 31 31 A P > - 0 0 37 0, 0.0 4,-2.4 0, 0.0 5,-0.2 -0.151 27.5-132.5 -48.6 135.5 -23.1 50.3 66.7 32 32 A E H > S+ 0 0 146 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.885 107.5 59.1 -56.2 -41.8 -24.0 46.7 67.7 33 33 A A H > S+ 0 0 69 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.957 107.8 44.8 -50.6 -56.4 -26.9 47.0 65.2 34 34 A F H > S+ 0 0 63 1,-0.2 4,-1.4 2,-0.2 -2,-0.2 0.920 113.9 49.0 -56.0 -48.7 -24.5 47.7 62.4 35 35 A L H < S+ 0 0 10 -4,-2.4 3,-0.3 1,-0.2 -1,-0.2 0.888 111.1 49.1 -61.5 -39.7 -22.1 44.9 63.4 36 36 A E H < S+ 0 0 137 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.859 107.6 59.6 -66.7 -32.7 -25.0 42.4 63.7 37 37 A G H < S+ 0 0 58 -4,-2.2 -2,-0.2 -5,-0.3 -1,-0.2 0.803 75.5 110.5 -65.5 -34.0 -26.1 43.5 60.3 38 38 A L < - 0 0 23 -4,-1.4 2,-0.4 -3,-0.3 -3,-0.0 -0.086 60.1-144.9 -43.4 144.3 -22.9 42.7 58.4 39 39 A S > - 0 0 52 1,-0.1 4,-2.6 2,-0.0 5,-0.2 -0.974 19.8-154.6-123.5 129.9 -23.5 39.7 56.0 40 40 A Y H > S+ 0 0 93 -2,-0.4 4,-2.3 1,-0.2 -1,-0.1 0.937 104.1 42.0 -61.6 -46.0 -21.1 36.9 55.1 41 41 A E H > S+ 0 0 166 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.909 113.4 50.7 -67.4 -46.4 -23.0 36.4 51.8 42 42 A G H > S+ 0 0 26 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.969 113.5 46.1 -56.5 -51.9 -23.3 40.1 51.1 43 43 A Q H X S+ 0 0 27 -4,-2.6 4,-2.2 1,-0.2 5,-0.3 0.913 110.9 51.6 -57.7 -45.9 -19.6 40.7 51.6 44 44 A A H X S+ 0 0 19 -4,-2.3 4,-1.9 -5,-0.2 -1,-0.2 0.888 110.6 49.5 -61.6 -37.2 -18.6 37.7 49.5 45 45 A E H X S+ 0 0 113 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.912 107.8 53.1 -68.6 -42.1 -20.7 38.9 46.6 46 46 A R H X S+ 0 0 149 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.938 112.4 43.7 -59.5 -47.4 -19.4 42.5 46.7 47 47 A W H X S+ 0 0 17 -4,-2.2 4,-3.0 1,-0.2 -1,-0.2 0.911 111.4 57.0 -64.6 -38.1 -15.8 41.3 46.5 48 48 A A H X S+ 0 0 8 -4,-1.9 4,-1.9 -5,-0.3 -2,-0.2 0.896 104.0 50.5 -59.8 -44.1 -16.8 38.8 43.8 49 49 A Q H X S+ 0 0 100 -4,-2.5 4,-0.6 1,-0.2 -1,-0.2 0.957 113.1 47.8 -60.1 -45.7 -18.2 41.5 41.6 50 50 A R H >< S+ 0 0 78 -4,-1.8 3,-1.4 1,-0.2 6,-0.3 0.934 110.0 50.5 -59.6 -49.1 -15.0 43.5 41.9 51 51 A L H 3< S+ 0 0 53 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.838 110.2 51.6 -59.5 -32.7 -12.7 40.5 41.3 52 52 A K H 3< S+ 0 0 128 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.564 87.5 94.5 -81.3 -11.8 -14.7 39.7 38.1 53 53 A T X< - 0 0 49 -3,-1.4 3,-2.1 -4,-0.6 -1,-0.0 -0.768 64.2-156.8 -87.7 107.8 -14.4 43.3 36.8 54 54 A P T 3 S+ 0 0 129 0, 0.0 -1,-0.2 0, 0.0 -4,-0.0 0.782 92.4 48.5 -52.4 -35.6 -11.3 43.3 34.4 55 55 A T T 3 S+ 0 0 126 -3,-0.1 -5,-0.0 2,-0.0 -3,-0.0 0.389 80.0 123.3 -90.6 3.9 -10.8 47.1 34.8 56 56 A W < - 0 0 42 -3,-2.1 -6,-0.0 -6,-0.3 0, 0.0 -0.520 50.1-156.7 -67.2 121.5 -11.0 47.0 38.7 57 57 A P + 0 0 52 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 0.455 56.4 112.3 -81.1 1.2 -7.8 48.5 40.1 58 58 A G - 0 0 2 19,-0.1 2,-0.4 -8,-0.1 19,-0.2 -0.359 53.8-152.3 -72.4 154.1 -8.1 46.7 43.4 59 59 A R E - B 0 76A 56 17,-2.5 17,-2.4 -2,-0.1 2,-0.4 -0.996 9.1-155.6-131.5 125.7 -5.6 44.0 44.5 60 60 A L E + B 0 75A 3 -2,-0.4 -54,-2.1 15,-0.2 2,-0.3 -0.862 12.5 178.0-110.5 134.8 -6.6 41.2 46.9 61 61 A F E -AB 5 74A 8 13,-2.7 13,-2.1 -2,-0.4 2,-0.3 -0.932 7.8-163.1-129.4 150.1 -4.4 39.1 49.1 62 62 A V E -AB 4 73A 0 -58,-2.8 -58,-2.1 -2,-0.3 2,-0.5 -0.940 12.8-140.2-130.5 154.6 -5.2 36.3 51.6 63 63 A A E -AB 3 72A 0 9,-2.4 8,-2.5 -2,-0.3 9,-1.1 -0.967 20.9-145.3-113.9 131.5 -3.1 34.8 54.4 64 64 A E E - B 0 70A 35 -62,-2.8 -62,-0.4 -2,-0.5 6,-0.2 -0.705 6.7-131.5 -97.7 147.9 -3.3 31.1 54.9 65 65 A S > - 0 0 7 4,-2.5 3,-1.0 -2,-0.3 -63,-0.3 -0.319 46.5 -89.1 -80.1 178.6 -3.1 29.1 58.2 66 66 A E T 3 S+ 0 0 179 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.902 131.6 45.6 -57.5 -41.2 -0.8 26.2 58.2 67 67 A S T 3 S- 0 0 101 1,-0.0 -1,-0.3 2,-0.0 -3,-0.0 0.570 125.9 -98.7 -80.4 -10.3 -3.5 23.9 57.0 68 68 A G S < S+ 0 0 28 -3,-1.0 -2,-0.1 1,-0.3 2,-0.1 0.451 71.6 143.3 111.1 -1.3 -4.7 26.3 54.3 69 69 A E - 0 0 112 1,-0.1 -4,-2.5 -5,-0.1 2,-0.8 -0.409 58.3-112.1 -69.7 152.3 -7.7 28.1 55.7 70 70 A V E +B 64 0A 21 -6,-0.2 -6,-0.2 1,-0.2 -53,-0.1 -0.782 49.7 158.0 -85.1 112.3 -8.0 31.8 54.9 71 71 A V E + 0 0 2 -8,-2.5 26,-2.9 -2,-0.8 2,-0.3 0.341 60.9 25.6-119.9 4.2 -7.4 33.5 58.2 72 72 A G E -BC 63 96A 0 -9,-1.1 -9,-2.4 24,-0.3 2,-0.3 -0.991 59.3-179.2-159.5 155.1 -6.4 37.0 56.9 73 73 A F E -BC 62 95A 0 22,-2.7 22,-2.3 -2,-0.3 2,-0.3 -0.996 7.2-165.7-157.0 160.0 -6.8 39.3 54.0 74 74 A A E -BC 61 94A 0 -13,-2.1 -13,-2.7 -2,-0.3 2,-0.4 -0.987 5.6-158.7-150.9 138.5 -5.8 42.6 52.6 75 75 A A E -BC 60 93A 0 18,-2.4 18,-1.6 -2,-0.3 17,-1.3 -0.969 13.1-175.9-119.2 133.4 -7.1 44.8 49.7 76 76 A F E +BC 59 91A 1 -17,-2.4 -17,-2.5 -2,-0.4 15,-0.2 -0.939 16.6 133.0-128.8 148.6 -5.0 47.6 48.1 77 77 A G E - C 0 90A 0 13,-2.3 13,-2.7 -2,-0.3 -19,-0.1 -0.956 55.3 -43.1-171.9-172.2 -5.9 50.1 45.4 78 78 A P E S- C 0 89A 38 0, 0.0 11,-0.3 0, 0.0 10,-0.1 -0.352 74.9 -87.1 -68.6 155.3 -5.7 53.7 44.2 79 79 A D - 0 0 34 9,-3.2 2,-1.0 1,-0.1 11,-0.1 -0.289 33.8-128.4 -59.2 147.4 -6.6 56.2 46.9 80 80 A R - 0 0 137 1,-0.1 -1,-0.1 -3,-0.1 9,-0.0 -0.529 62.1 -74.4-100.2 66.0 -10.3 57.0 47.2 81 81 A A S S+ 0 0 97 -2,-1.0 -1,-0.1 1,-0.1 7,-0.1 0.913 73.3 161.7 45.6 60.9 -10.1 60.8 47.0 82 82 A S - 0 0 17 5,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.673 51.6-118.9 -82.3 -15.4 -8.8 61.3 50.5 83 83 A G S S+ 0 0 65 4,-0.1 -2,-0.0 1,-0.1 -1,-0.0 0.759 73.3 123.5 84.4 26.5 -7.5 64.8 49.8 84 84 A F > - 0 0 50 3,-0.3 3,-2.3 65,-0.0 -1,-0.1 -0.803 54.8-143.4-121.4 90.5 -3.8 64.3 50.4 85 85 A P T 3 S+ 0 0 127 0, 0.0 3,-0.1 0, 0.0 0, 0.0 -0.180 88.3 33.2 -49.9 138.4 -1.8 65.3 47.3 86 86 A G T 3 S+ 0 0 36 1,-0.1 2,-0.7 38,-0.0 38,-0.1 0.277 94.9 97.5 96.6 -14.5 1.2 62.9 46.9 87 87 A Y < + 0 0 39 -3,-2.3 -3,-0.3 1,-0.1 -5,-0.2 -0.896 38.1 156.8-110.1 100.0 -0.7 59.9 48.3 88 88 A T + 0 0 70 36,-1.0 -9,-3.2 -2,-0.7 2,-0.3 0.663 55.4 57.0 -98.6 -19.2 -2.0 58.0 45.3 89 89 A A E -Cd 78 125A 0 35,-2.6 37,-2.2 -11,-0.3 2,-0.3 -0.727 61.6-166.9-109.6 162.4 -2.4 54.5 46.8 90 90 A E E -Cd 77 126A 2 -13,-2.7 -13,-2.3 35,-0.3 2,-1.0 -0.997 26.8-128.0-149.5 145.5 -4.5 53.4 49.8 91 91 A L E -Cd 76 127A 2 35,-2.1 37,-0.5 -2,-0.3 -15,-0.2 -0.851 28.4-170.7 -91.9 103.6 -4.7 50.2 51.9 92 92 A W E - 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