==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 22-NOV-07 3BFP . COMPND 2 MOLECULE: ACETYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CAMPYLOBACTER JEJUNI; . AUTHOR E.S.RANGARAJAN,D.C.WATSON,S.LECLERC,A.PROTEAU,M.CYGLER, . 184 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9370.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 139 75.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 60 32.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 25 13.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 19 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 20 10.9 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 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 15 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 PARALLEL BRIDGES PER LADDER . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 1 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 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 2 A A 0 0 132 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 107.5 20.1 -27.0 19.8 2 3 A R - 0 0 95 1,-0.1 4,-0.1 2,-0.0 38,-0.0 -0.383 360.0-121.5 -68.6 142.8 21.6 -29.9 17.8 3 4 A T - 0 0 38 2,-0.2 -1,-0.1 1,-0.1 37,-0.1 -0.268 17.1-119.7 -76.9 167.0 20.7 -33.5 18.8 4 5 A E S S+ 0 0 121 22,-0.1 23,-2.4 23,-0.1 24,-1.4 0.767 97.5 47.9 -82.9 -22.5 23.4 -36.0 19.8 5 6 A K E -a 28 0A 64 22,-0.2 36,-0.8 21,-0.2 2,-0.3 -0.797 69.3-163.5-112.3 158.3 22.4 -38.3 17.0 6 7 A I E -ab 29 41A 0 22,-1.8 24,-3.0 -2,-0.3 2,-0.5 -0.998 16.0-135.7-142.1 136.5 21.9 -37.5 13.3 7 8 A Y E -ab 30 42A 7 34,-2.4 36,-2.1 -2,-0.3 2,-0.5 -0.830 19.1-160.8 -85.9 132.4 20.2 -39.4 10.5 8 9 A I E -ab 31 43A 0 22,-2.5 24,-2.6 -2,-0.5 2,-0.6 -0.969 3.7-155.3-116.6 115.5 22.2 -39.3 7.2 9 10 A Y E ab 32 44A 54 34,-2.7 36,-2.7 -2,-0.5 24,-0.2 -0.824 360.0 360.0 -92.8 120.3 20.2 -40.1 4.1 10 11 A G 0 0 29 22,-2.6 23,-0.1 -2,-0.6 22,-0.1 0.133 360.0 360.0 134.1 360.0 22.5 -41.4 1.3 11 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 12 14 A G > 0 0 83 0, 0.0 4,-1.6 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 -81.6 30.6 -42.8 -0.2 13 15 A H H > + 0 0 53 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.791 360.0 59.4 -59.8 -29.5 29.2 -39.3 0.2 14 16 A G H > S+ 0 0 2 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.904 103.2 47.5 -66.6 -45.2 27.4 -40.6 3.3 15 17 A L H > S+ 0 0 100 -3,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.849 111.4 52.9 -65.7 -33.9 30.6 -41.6 5.1 16 18 A V H X S+ 0 0 52 -4,-1.6 4,-1.7 2,-0.2 -2,-0.2 0.912 109.8 47.0 -66.2 -43.6 32.1 -38.2 4.3 17 19 A C H X S+ 0 0 0 -4,-2.0 4,-2.8 2,-0.2 -2,-0.2 0.876 108.2 57.3 -65.0 -36.2 29.0 -36.4 5.7 18 20 A E H X S+ 0 0 36 -4,-2.3 4,-2.8 1,-0.2 5,-0.2 0.912 104.5 51.9 -58.2 -44.5 29.4 -38.7 8.8 19 21 A D H X S+ 0 0 112 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.896 111.2 46.7 -59.4 -41.8 32.9 -37.4 9.2 20 22 A V H X S+ 0 0 3 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.917 111.5 51.4 -68.8 -40.4 31.7 -33.8 9.1 21 23 A A H X>S+ 0 0 0 -4,-2.8 5,-2.2 2,-0.2 4,-0.9 0.936 111.9 46.5 -59.1 -47.1 28.8 -34.7 11.6 22 24 A K H ><5S+ 0 0 104 -4,-2.8 3,-0.6 1,-0.2 -1,-0.2 0.892 108.2 56.5 -65.2 -37.9 31.3 -36.2 14.0 23 25 A N H 3<5S+ 0 0 53 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.878 104.9 52.9 -56.6 -40.2 33.6 -33.3 13.7 24 26 A M H 3<5S- 0 0 51 -4,-1.8 -1,-0.2 -3,-0.1 -2,-0.2 0.705 130.8 -93.9 -68.5 -23.9 30.8 -31.0 14.7 25 27 A G T <<5S+ 0 0 34 -4,-0.9 -3,-0.2 -3,-0.6 2,-0.1 0.417 72.6 148.6 121.5 2.2 30.2 -33.1 17.8 26 28 A Y < - 0 0 3 -5,-2.2 -1,-0.3 -6,-0.2 -21,-0.2 -0.486 33.0-157.9 -64.1 136.6 27.5 -35.5 16.8 27 29 A K S S+ 0 0 130 -23,-2.4 2,-0.3 1,-0.2 -22,-0.2 0.772 70.5 24.1 -89.1 -29.9 28.1 -38.7 18.8 28 30 A E E -a 5 0A 100 -24,-1.4 -22,-1.8 -7,-0.1 2,-0.5 -1.000 60.1-156.7-142.9 138.5 26.3 -41.1 16.4 29 31 A C E -a 6 0A 21 -2,-0.3 2,-0.6 -24,-0.2 -22,-0.2 -0.967 8.4-159.9-116.3 129.0 25.3 -41.2 12.8 30 32 A I E -a 7 0A 54 -24,-3.0 -22,-2.5 -2,-0.5 2,-0.3 -0.929 14.2-144.1-111.4 111.9 22.4 -43.3 11.6 31 33 A F E +a 8 0A 83 -2,-0.6 2,-0.4 -24,-0.2 -22,-0.2 -0.582 20.1 178.6 -81.4 133.6 22.4 -44.1 7.9 32 34 A L E a 9 0A 54 -24,-2.6 -22,-2.6 -2,-0.3 -2,-0.0 -0.972 360.0 360.0-128.1 145.1 19.2 -44.4 5.9 33 35 A D 0 0 153 -2,-0.4 -24,-0.0 -24,-0.2 -1,-0.0 -0.390 360.0 360.0-154.3 360.0 18.6 -45.0 2.2 34 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 35 44 A S 0 0 132 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-175.9 6.8 -43.1 10.2 36 45 A T + 0 0 143 3,-0.0 3,-0.1 2,-0.0 0, 0.0 0.031 360.0 136.2-100.7 29.0 7.4 -43.2 14.0 37 46 A L - 0 0 70 1,-0.1 0, 0.0 3,-0.0 0, 0.0 -0.387 63.9 -92.2 -73.5 151.1 11.2 -42.6 14.5 38 47 A P - 0 0 66 0, 0.0 2,-1.8 0, 0.0 -1,-0.1 -0.300 43.9-110.4 -57.2 146.2 12.6 -40.3 17.1 39 48 A K + 0 0 108 -3,-0.1 2,-0.1 25,-0.0 3,-0.1 -0.453 54.3 159.7 -83.2 66.5 13.1 -36.7 15.7 40 49 A Y - 0 0 66 -2,-1.8 25,-0.3 1,-0.1 -34,-0.2 -0.452 54.3 -79.2 -76.3 160.6 16.9 -36.5 15.6 41 50 A D E -b 6 0A 5 -36,-0.8 -34,-2.4 -2,-0.1 2,-0.3 -0.246 53.0-145.9 -52.5 149.9 18.5 -33.9 13.3 42 51 A F E -bc 7 66A 10 23,-2.5 25,-1.6 -36,-0.2 2,-0.3 -0.910 16.8-172.9-123.5 150.5 18.6 -35.0 9.6 43 52 A F E -b 8 0A 3 -36,-2.1 -34,-2.7 -2,-0.3 2,-0.7 -0.995 19.3-139.1-139.2 147.9 21.0 -34.5 6.7 44 53 A I E -b 9 0A 5 -2,-0.3 2,-1.2 -36,-0.2 -34,-0.2 -0.892 14.2-171.3-107.9 105.3 20.7 -35.4 3.0 45 54 A A + 0 0 4 -36,-2.7 2,-0.5 -2,-0.7 -32,-0.1 -0.487 39.8 126.9 -95.3 61.1 24.0 -36.7 1.7 46 55 A I - 0 0 27 -2,-1.2 6,-0.1 1,-0.1 -2,-0.1 -0.979 45.8-160.4-122.0 118.3 23.1 -36.8 -1.9 47 56 A G + 0 0 23 -2,-0.5 2,-0.5 4,-0.1 -1,-0.1 0.767 69.0 95.3 -68.6 -26.4 25.5 -35.0 -4.3 48 57 A N > - 0 0 86 1,-0.1 4,-2.5 2,-0.0 5,-0.2 -0.571 68.8-149.5 -73.2 119.5 22.9 -34.9 -7.0 49 58 A N H > S+ 0 0 21 -2,-0.5 4,-1.8 1,-0.2 -1,-0.1 0.830 91.3 48.0 -59.3 -41.0 21.1 -31.5 -6.9 50 59 A E H > S+ 0 0 125 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.885 114.9 42.7 -72.7 -42.3 17.7 -32.7 -8.1 51 60 A I H > S+ 0 0 85 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.901 111.4 56.8 -70.1 -42.8 17.3 -35.7 -5.8 52 61 A R H X S+ 0 0 4 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.913 108.3 47.4 -53.7 -45.3 18.6 -33.7 -2.9 53 62 A K H X S+ 0 0 56 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.894 112.1 48.8 -64.5 -43.6 15.9 -31.2 -3.3 54 63 A K H X S+ 0 0 62 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.951 114.5 44.5 -62.3 -49.7 13.1 -33.8 -3.7 55 64 A I H X S+ 0 0 33 -4,-2.8 4,-2.8 1,-0.2 5,-0.3 0.883 110.8 56.7 -61.9 -40.6 14.3 -35.6 -0.5 56 65 A Y H X S+ 0 0 17 -4,-2.5 4,-2.2 -5,-0.3 -1,-0.2 0.914 108.0 47.1 -53.5 -48.3 14.6 -32.2 1.2 57 66 A Q H X S+ 0 0 93 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.920 113.7 47.2 -63.6 -44.1 11.0 -31.5 0.5 58 67 A K H < S+ 0 0 61 -4,-2.1 4,-0.5 2,-0.2 -2,-0.2 0.913 114.1 46.0 -63.2 -47.4 9.8 -34.9 1.7 59 68 A I H ><>S+ 0 0 15 -4,-2.8 5,-1.5 1,-0.2 3,-0.9 0.885 112.0 51.5 -65.2 -41.0 11.8 -34.9 4.9 60 69 A S H ><5S+ 0 0 50 -4,-2.2 3,-1.1 -5,-0.3 -1,-0.2 0.840 106.3 55.3 -62.9 -36.3 10.7 -31.3 5.7 61 70 A E T 3<5S+ 0 0 158 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.578 101.2 59.4 -75.1 -12.1 7.1 -32.3 5.2 62 71 A N T < 5S- 0 0 103 -3,-0.9 -1,-0.2 -4,-0.5 -2,-0.2 0.113 122.3-100.2-103.1 18.8 7.4 -35.1 7.8 63 72 A G T < 5S+ 0 0 59 -3,-1.1 2,-0.3 1,-0.2 -3,-0.2 0.717 74.6 140.1 76.6 24.5 8.4 -32.7 10.6 64 73 A F < - 0 0 33 -5,-1.5 2,-0.6 -23,-0.0 -1,-0.2 -0.742 51.6-127.7 -98.8 148.6 12.2 -33.2 10.6 65 74 A K - 0 0 87 -2,-0.3 -23,-2.5 -25,-0.3 2,-0.9 -0.850 17.4-154.5 -90.5 120.7 14.8 -30.6 11.1 66 75 A I B -c 42 0A 6 -2,-0.6 21,-1.2 19,-0.4 -23,-0.2 -0.843 21.7-161.0 -98.4 101.6 17.4 -30.7 8.2 67 76 A V - 0 0 0 -25,-1.6 2,-0.4 -2,-0.9 17,-0.0 -0.147 18.1-109.4 -77.4 169.8 20.5 -29.2 9.7 68 77 A N - 0 0 8 19,-0.2 2,-0.6 18,-0.1 21,-0.2 -0.834 22.7-145.4 -92.1 141.7 23.6 -27.8 8.1 69 78 A L E +d 89 0B 0 19,-2.3 21,-3.1 -2,-0.4 2,-0.4 -0.963 25.7 173.8-108.0 116.7 26.8 -29.8 8.4 70 79 A I E -d 90 0B 34 -2,-0.6 21,-0.2 19,-0.2 19,-0.1 -0.971 28.6-129.8-130.5 112.0 29.7 -27.4 8.7 71 80 A H > - 0 0 38 19,-2.7 3,-2.1 -2,-0.4 -51,-0.1 -0.302 22.5-121.3 -61.4 141.9 33.2 -28.6 9.4 72 81 A K T 3 S+ 0 0 158 1,-0.3 -1,-0.1 -52,-0.2 19,-0.1 0.746 112.0 59.5 -57.9 -23.4 34.9 -26.7 12.2 73 82 A S T 3 S+ 0 0 25 2,-0.1 2,-0.4 22,-0.0 -1,-0.3 0.500 77.9 106.6 -83.8 -7.8 37.7 -25.7 9.8 74 83 A A < - 0 0 13 -3,-2.1 2,-0.6 16,-0.2 21,-0.2 -0.615 65.2-145.4 -71.2 129.4 35.3 -23.9 7.5 75 84 A L E -j 95 0C 114 19,-2.7 21,-2.9 -2,-0.4 2,-0.5 -0.894 18.9-176.2-103.7 118.5 35.8 -20.2 7.9 76 85 A I E -j 96 0C 60 -2,-0.6 21,-0.2 19,-0.2 22,-0.1 -0.962 25.9-122.2-121.1 122.6 32.7 -18.1 7.6 77 86 A S > - 0 0 26 19,-2.7 3,-1.6 -2,-0.5 22,-0.0 -0.307 20.5-125.4 -57.7 139.7 32.6 -14.3 7.8 78 87 A P T 3 S+ 0 0 139 0, 0.0 -1,-0.1 0, 0.0 19,-0.1 0.758 113.7 50.3 -54.9 -26.4 30.4 -12.9 10.6 79 88 A S T 3 S+ 0 0 55 2,-0.1 2,-0.1 0, 0.0 -2,-0.1 0.458 89.2 102.2 -94.6 -3.5 28.7 -10.8 7.9 80 89 A A < - 0 0 15 -3,-1.6 2,-0.5 16,-0.2 21,-0.2 -0.448 68.9-133.9 -71.6 156.1 28.1 -13.8 5.6 81 90 A I E +o 101 0D 93 19,-2.9 21,-3.0 -2,-0.1 2,-0.5 -0.964 24.3 176.5-117.2 117.6 24.6 -15.3 5.5 82 91 A V E -o 102 0D 32 -2,-0.5 21,-0.2 19,-0.2 19,-0.0 -0.983 38.3-116.6-118.9 116.6 24.2 -19.0 5.7 83 92 A E > - 0 0 79 19,-2.0 3,-0.5 -2,-0.5 5,-0.3 -0.295 35.7-120.1 -58.0 129.6 20.5 -20.1 5.8 84 93 A E T 3 S+ 0 0 153 1,-0.2 -1,-0.1 2,-0.1 20,-0.1 -0.439 85.1 1.3 -76.3 144.9 20.0 -21.8 9.1 85 94 A N T 3 S+ 0 0 51 -2,-0.1 -19,-0.4 1,-0.1 -1,-0.2 0.925 90.9 132.1 44.2 60.3 18.8 -25.4 9.2 86 95 A A S < S- 0 0 0 -3,-0.5 19,-2.8 2,-0.1 -19,-0.2 0.111 77.3-105.0-132.2 22.4 18.8 -25.7 5.4 87 96 A G + 0 0 5 -21,-1.2 2,-0.4 1,-0.2 -19,-0.2 0.781 63.9 159.6 61.5 28.7 20.7 -28.9 4.6 88 97 A I - 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