==== 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 TRANSFERASE 27-JAN-03 1NSL . COMPND 2 MOLECULE: PROBABLE ACETYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR J.S.BRUNZELLE,S.V.KOROLEV,R.WU,A.JOACHIMIAK,W.F.ANDERSON,MID . 1068 10 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 48391.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 793 74.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 27 2.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 290 27.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 18 1.7 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 . 1 0.1 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 . 79 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 105 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 242 22.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 44 4.1 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 1 5 1 0 5 9 3 0 0 0 6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 3 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 PARALLEL BRIDGES PER LADDER . 6 4 2 1 5 0 19 5 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 0 0 0 0 0 0 0 0 0 0 0 3 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 0 A G 0 0 54 0, 0.0 3,-0.1 0, 0.0 295,-0.0 0.000 360.0 360.0 360.0 134.4 -15.2 -27.4 -33.4 2 1 A X + 0 0 14 1,-0.2 2,-0.6 181,-0.1 189,-0.1 0.918 360.0 41.3 -63.1 -50.9 -11.4 -27.5 -33.8 3 2 A F S S+ 0 0 8 180,-0.1 12,-0.3 178,-0.1 2,-0.3 -0.818 82.1 152.5-109.2 126.4 -11.3 -27.9 -30.0 4 3 A T B -A 182 0A 35 178,-4.0 178,-2.2 -2,-0.6 2,-0.4 -0.828 40.8-132.3-147.2 172.4 -13.7 -30.1 -28.4 5 4 A C E -B 13 0B 13 8,-1.3 8,-2.5 -2,-0.3 2,-0.4 -0.824 19.0-157.5-135.8 96.2 -14.5 -32.4 -25.5 6 5 A K E +B 12 0B 136 -2,-0.4 6,-0.2 6,-0.2 3,-0.1 -0.551 14.2 177.0 -75.1 125.1 -15.9 -35.7 -26.4 7 6 A V - 0 0 18 4,-2.6 2,-0.2 1,-0.5 -1,-0.2 0.887 67.5 -56.5 -88.2 -49.8 -17.8 -37.0 -23.4 8 7 A N S S- 0 0 68 3,-1.4 -1,-0.5 1,-0.2 3,-0.1 -0.842 84.0 -43.6-162.8-159.9 -18.9 -40.1 -25.3 9 8 A E S S+ 0 0 133 -2,-0.2 2,-4.0 1,-0.2 -1,-0.2 -0.273 129.2 18.4 -71.0 172.1 -20.8 -40.7 -28.5 10 9 A H S S+ 0 0 81 62,-0.1 63,-1.3 1,-0.1 2,-0.7 0.017 115.5 82.7 62.0 -42.8 -23.8 -38.4 -28.9 11 10 A I E + C 0 72B 5 -2,-4.0 -4,-2.6 61,-0.2 -3,-1.4 -0.810 49.3 159.1-111.8 106.8 -22.4 -36.1 -26.3 12 11 A T E -BC 6 71B 32 59,-2.4 59,-2.7 -2,-0.7 2,-0.4 -0.934 24.3-149.0-121.3 144.1 -19.8 -33.5 -27.0 13 12 A I E +BC 5 70B 0 -8,-2.5 -8,-1.3 -2,-0.4 2,-0.3 -0.927 27.4 157.1-108.1 134.9 -18.9 -30.4 -25.0 14 13 A R E - C 0 69B 39 55,-2.0 55,-3.0 -2,-0.4 -10,-0.1 -0.999 45.2 -98.9-156.7 147.0 -17.7 -27.2 -26.7 15 14 A L E - C 0 68B 8 -2,-0.3 53,-0.2 -12,-0.3 2,-0.1 -0.302 49.0-118.7 -49.4 148.9 -17.3 -23.4 -26.3 16 15 A L - 0 0 3 51,-0.6 -1,-0.1 37,-0.1 51,-0.1 -0.351 27.3-155.7 -87.9 178.4 -20.1 -21.6 -28.2 17 16 A E > - 0 0 27 -2,-0.1 3,-1.2 1,-0.1 4,-0.5 -0.961 36.0 -92.6-149.6 158.8 -19.6 -19.2 -31.0 18 17 A P G > S+ 0 0 30 0, 0.0 3,-2.0 0, 0.0 4,-0.2 0.843 122.7 57.8 -43.7 -39.1 -21.4 -16.3 -32.6 19 18 A K G 3 S+ 0 0 131 1,-0.3 4,-0.4 2,-0.2 3,-0.4 0.806 93.4 64.9 -72.2 -28.8 -23.0 -18.7 -35.1 20 19 A D G <> S+ 0 0 18 -3,-1.2 4,-2.4 1,-0.2 -1,-0.3 0.607 81.7 94.1 -56.5 -10.5 -24.5 -20.8 -32.4 21 20 A A H <> S+ 0 0 0 -3,-2.0 4,-2.2 -4,-0.5 5,-0.4 0.976 75.9 49.4 -57.9 -59.1 -26.5 -17.6 -31.7 22 21 A E H > S+ 0 0 149 -3,-0.4 4,-1.7 -4,-0.2 -1,-0.2 0.892 119.5 40.4 -45.4 -46.0 -29.8 -18.2 -33.7 23 22 A R H > S+ 0 0 82 -4,-0.4 4,-3.1 2,-0.2 5,-0.2 0.906 109.8 56.6 -75.3 -40.3 -30.2 -21.7 -32.2 24 23 A L H X S+ 0 0 0 -4,-2.4 4,-1.1 1,-0.2 -1,-0.2 0.937 111.9 44.0 -53.9 -45.0 -29.1 -20.9 -28.6 25 24 A A H X S+ 0 0 3 -4,-2.2 4,-2.1 -5,-0.3 -1,-0.2 0.890 113.7 49.7 -66.4 -39.7 -31.9 -18.2 -28.4 26 25 A E H X S+ 0 0 110 -4,-1.7 4,-2.1 -5,-0.4 -1,-0.2 0.932 111.1 50.7 -61.9 -42.4 -34.4 -20.5 -30.1 27 26 A L H < S+ 0 0 0 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.747 111.4 48.5 -71.2 -21.3 -33.5 -23.1 -27.6 28 27 A I H >< S+ 0 0 1 -4,-1.1 3,-0.6 -5,-0.2 4,-0.4 0.755 108.9 51.7 -90.0 -28.5 -33.9 -20.7 -24.8 29 28 A I H >< S+ 0 0 106 -4,-2.1 3,-0.8 2,-0.2 4,-0.3 0.923 103.3 56.2 -74.8 -44.2 -37.3 -19.4 -25.8 30 29 A Q T 3< S+ 0 0 106 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.1 0.464 123.5 30.2 -60.7 -2.7 -38.9 -22.8 -26.2 31 30 A N T X> S+ 0 0 16 -3,-0.6 4,-1.3 -5,-0.1 3,-1.2 0.254 82.6 125.2-140.1 -4.3 -37.7 -23.2 -22.5 32 31 A Q T <4 S+ 0 0 43 -3,-0.8 2,-0.8 -4,-0.4 -2,-0.1 0.775 71.4 54.3 -18.8 -64.4 -38.0 -19.5 -21.3 33 32 A Q T 34 S+ 0 0 109 -4,-0.3 -1,-0.3 1,-0.2 3,-0.1 -0.101 112.7 43.1 -80.9 39.2 -40.3 -20.2 -18.4 34 33 A R T X> S+ 0 0 78 -3,-1.2 3,-2.5 -2,-0.8 4,-1.0 0.407 82.0 86.2-143.9 -53.0 -38.0 -22.9 -16.9 35 34 A L T 3< S+ 0 0 6 -4,-1.3 -1,-0.2 1,-0.3 62,-0.1 -0.363 83.1 62.3 -61.0 101.8 -34.3 -21.9 -16.9 36 35 A G T >4 S+ 0 0 12 -2,-0.9 3,-0.7 4,-0.1 -1,-0.3 -0.095 97.5 54.6 170.0 -45.0 -34.3 -20.0 -13.7 37 36 A K T <4 S+ 0 0 108 -3,-2.5 96,-0.8 1,-0.2 -2,-0.2 0.765 110.7 49.7 -69.6 -29.3 -35.2 -22.9 -11.6 38 37 A W T 3< S- 0 0 25 -4,-1.0 58,-0.4 94,-0.1 -1,-0.2 0.291 127.7-111.7 -92.1 16.5 -32.1 -24.2 -13.4 39 38 A L S < S+ 0 0 68 -3,-0.7 -2,-0.1 1,-0.1 -4,-0.1 0.882 89.0 78.0 60.6 47.1 -30.4 -21.0 -12.3 40 39 A F 0 0 62 -6,-0.1 -4,-0.1 55,-0.0 -1,-0.1 0.293 360.0 360.0-138.3 -85.6 -30.0 -19.2 -15.8 41 40 A F 0 0 150 -13,-0.0 -5,-0.1 2,-0.0 -9,-0.1 0.852 360.0 360.0 74.4 360.0 -32.7 -17.3 -17.8 42 ! 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 43 45 A S 0 0 66 0, 0.0 2,-0.9 0, 0.0 -15,-0.1 0.000 360.0 360.0 360.0 -23.5 -32.6 -13.4 -24.9 44 46 A S >> - 0 0 69 1,-0.2 3,-3.3 2,-0.1 4,-0.8 -0.518 360.0-135.3 -65.2 103.7 -32.6 -11.4 -28.2 45 47 A A H 3> S+ 0 0 27 -2,-0.9 4,-0.6 1,-0.3 -1,-0.2 0.531 103.7 59.7 -39.9 -10.7 -30.5 -13.9 -30.5 46 48 A D H 3> S+ 0 0 90 2,-0.2 4,-2.6 1,-0.1 3,-0.4 0.846 96.4 58.5 -83.2 -39.3 -28.6 -10.8 -31.7 47 49 A T H <>>S+ 0 0 59 -3,-3.3 5,-2.4 1,-0.3 4,-2.0 0.794 105.0 52.0 -59.0 -29.0 -27.4 -10.0 -28.2 48 50 A Y H <>S+ 0 0 6 -4,-0.8 5,-2.8 3,-0.2 -1,-0.3 0.852 110.8 46.8 -78.4 -31.7 -25.8 -13.4 -28.0 49 51 A R H <5S+ 0 0 86 -4,-0.6 -2,-0.2 -3,-0.4 -1,-0.2 0.869 124.1 30.1 -76.9 -38.3 -24.0 -13.0 -31.3 50 52 A E H <5S+ 0 0 152 -4,-2.6 -2,-0.2 3,-0.1 -3,-0.2 0.840 137.9 4.7 -97.6 -25.9 -22.7 -9.6 -30.5 51 53 A T T X5S+ 0 0 67 -4,-2.0 4,-2.4 -5,-0.4 -3,-0.2 0.814 120.1 44.8-124.9 -55.6 -22.3 -9.6 -26.8 52 54 A I H > S+ 0 0 20 0, 0.0 4,-3.3 0, 0.0 5,-0.3 0.934 110.7 51.6 -60.0 -43.6 -18.1 -13.3 -27.2 55 57 A D H X S+ 0 0 72 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.931 109.2 50.0 -59.8 -36.7 -18.1 -12.3 -23.6 56 58 A W H X S+ 0 0 46 -4,-2.4 4,-1.8 1,-0.2 11,-0.3 0.926 112.2 48.8 -67.5 -42.0 -18.2 -16.0 -22.6 57 59 A R H X S+ 0 0 8 -4,-2.6 4,-2.9 2,-0.2 -1,-0.2 0.937 109.8 49.3 -60.1 -50.3 -15.4 -16.7 -24.9 58 60 A R H X S+ 0 0 100 -4,-3.3 4,-3.0 1,-0.2 -2,-0.2 0.948 109.3 55.4 -58.9 -34.0 -13.2 -13.8 -23.6 59 61 A Q H <>S+ 0 0 79 -4,-2.6 5,-2.3 1,-0.3 -1,-0.2 0.900 109.5 45.2 -69.6 -30.0 -13.9 -15.2 -20.2 60 62 A Y H ><5S+ 0 0 25 -4,-1.8 3,-1.3 -3,-0.2 -1,-0.3 0.880 110.1 53.5 -77.8 -34.7 -12.6 -18.5 -21.1 61 63 A A H 3<5S+ 0 0 3 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.957 109.1 49.6 -63.6 -40.4 -9.7 -17.1 -22.8 62 64 A D T 3<5S- 0 0 81 -4,-3.0 -1,-0.3 -5,-0.2 -2,-0.2 0.369 116.5-117.8 -80.5 10.1 -8.9 -15.2 -19.6 63 65 A L T < 5S+ 0 0 65 -3,-1.3 2,-0.4 -5,-0.2 -3,-0.2 0.779 74.4 121.2 60.7 32.0 -9.3 -18.3 -17.6 64 66 A N S S-CD 11 75B 34 3,-2.3 3,-4.1 -2,-0.6 -61,-0.2 -0.868 85.7 -19.3 -95.5 135.3 -26.3 -34.3 -28.3 73 75 A D T 3 S- 0 0 102 -63,-1.3 -1,-0.2 -2,-0.5 -62,-0.1 0.743 131.2 -48.6 28.9 45.1 -25.5 -36.0 -31.6 74 76 A G T 3 S+ 0 0 64 -64,-0.6 2,-0.4 1,-0.3 -1,-0.3 0.419 117.2 106.0 86.6 -2.0 -24.0 -32.8 -32.9 75 77 A S E < S-D 72 0B 41 -3,-4.1 -3,-2.3 -65,-0.2 2,-0.4 -0.902 77.3-109.9-114.5 146.9 -26.7 -30.5 -32.0 76 78 A L E +D 71 0B 7 -2,-0.4 -5,-0.3 -5,-0.3 3,-0.1 -0.587 45.2 159.1 -62.7 119.8 -26.7 -28.0 -29.1 77 79 A C E - 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