==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 14-JUL-04 1W3D . COMPND 2 MOLECULE: DIHYDROLIPOYLLYSINE-RESIDUE ACETYLTRANSFERASE . SOURCE 2 ORGANISM_SCIENTIFIC: GEOBACILLUS STEAROTHERMOPHILUS; . AUTHOR M.D.ALLEN,R.W.BROADHURST,R.G.SOLOMON,R.N.PERHAM . 45 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 3834.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 31 68.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 4.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 4.4 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 2.2 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 . 6 13.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 5 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 15 33.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 2.2 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 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 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 0 0 ANTIPARALLEL 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 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 1 126 A N 0 0 197 0, 0.0 2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-179.2 -5.1 10.5 -14.7 2 127 A R - 0 0 201 2,-0.0 2,-0.1 0, 0.0 0, 0.0 -0.332 360.0-161.5-175.5 82.6 -5.4 7.7 -12.2 3 128 A R - 0 0 227 1,-0.1 2,-0.3 2,-0.0 0, 0.0 -0.394 16.0-135.6 -71.3 147.3 -5.6 8.5 -8.5 4 129 A V - 0 0 49 -2,-0.1 2,-1.4 2,-0.1 18,-0.1 -0.779 11.5-125.7-106.4 150.3 -4.8 5.8 -6.0 5 130 A I + 0 0 81 -2,-0.3 28,-2.2 26,-0.3 2,-0.3 -0.533 66.5 121.4 -92.3 68.7 -6.7 4.9 -2.8 6 131 A A B -a 33 0A 30 -2,-1.4 28,-0.1 26,-0.2 -2,-0.1 -0.819 57.4-117.0-126.9 166.8 -3.7 5.1 -0.4 7 132 A M > - 0 0 79 26,-0.8 4,-2.1 -2,-0.3 5,-0.2 -0.682 30.8-108.9-103.1 158.0 -2.8 7.1 2.8 8 133 A P H > S+ 0 0 114 0, 0.0 4,-1.2 0, 0.0 -1,-0.1 0.776 122.3 48.0 -53.6 -27.4 0.1 9.5 3.2 9 134 A S H > S+ 0 0 66 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.916 106.8 52.6 -80.1 -47.2 1.7 6.9 5.4 10 135 A V H > S+ 0 0 4 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.825 107.1 56.3 -58.3 -31.3 1.3 4.0 3.1 11 136 A R H X S+ 0 0 120 -4,-2.1 4,-2.0 2,-0.2 5,-0.2 0.969 105.2 48.3 -65.4 -52.7 2.9 6.1 0.4 12 137 A K H X S+ 0 0 126 -4,-1.2 4,-2.1 1,-0.2 5,-0.2 0.888 109.9 57.6 -52.9 -39.5 6.1 6.6 2.5 13 138 A Y H >X S+ 0 0 20 -4,-2.1 4,-2.4 1,-0.2 3,-0.7 0.970 108.5 41.0 -54.3 -62.8 6.0 2.9 3.0 14 139 A A H 3X>S+ 0 0 3 -4,-2.3 4,-1.4 1,-0.3 5,-0.9 0.757 116.7 52.6 -60.2 -24.7 6.1 1.9 -0.6 15 140 A R H 3<5S+ 0 0 172 -4,-2.0 -1,-0.3 3,-0.2 -2,-0.2 0.772 111.7 44.4 -82.2 -27.6 8.7 4.7 -1.1 16 141 A E H <<5S+ 0 0 136 -4,-2.1 -2,-0.2 -3,-0.7 -3,-0.2 0.772 123.3 35.8 -85.7 -29.4 10.9 3.4 1.7 17 142 A K H <5S- 0 0 127 -4,-2.4 -2,-0.2 -5,-0.2 -3,-0.2 0.697 111.6-115.0 -95.0 -24.4 10.7 -0.2 0.6 18 143 A G T <5 + 0 0 69 -4,-1.4 -3,-0.2 -5,-0.4 2,-0.2 0.598 69.2 134.9 98.7 14.3 10.6 0.4 -3.1 19 144 A V < - 0 0 14 -5,-0.9 2,-0.6 -6,-0.3 -1,-0.3 -0.560 52.9-129.4 -94.2 160.1 7.0 -0.9 -3.7 20 145 A D > - 0 0 72 -2,-0.2 3,-2.9 1,-0.1 -9,-0.1 -0.902 5.6-158.3-114.9 105.0 4.3 0.8 -5.8 21 146 A I G > S+ 0 0 10 -2,-0.6 3,-2.8 1,-0.3 5,-0.2 0.821 87.9 78.0 -45.5 -36.3 1.0 1.2 -4.0 22 147 A R G 3 S+ 0 0 161 1,-0.3 -1,-0.3 -3,-0.1 -17,-0.1 0.723 105.8 31.4 -48.3 -25.6 -0.6 1.4 -7.4 23 148 A L G < S+ 0 0 83 -3,-2.9 -1,-0.3 2,-0.0 2,-0.2 -0.013 95.0 120.5-125.5 30.0 -0.3 -2.4 -7.7 24 149 A V S < S- 0 0 16 -3,-2.8 2,-2.1 1,-0.1 14,-0.1 -0.610 76.8-100.2 -94.6 155.6 -0.7 -3.3 -4.0 25 150 A Q - 0 0 136 12,-0.6 2,-0.7 -2,-0.2 9,-0.2 -0.494 44.2-166.2 -75.0 79.5 -3.4 -5.6 -2.6 26 151 A G + 0 0 28 -2,-2.1 7,-0.3 1,-0.2 5,-0.0 -0.580 23.5 160.3 -73.3 110.5 -5.6 -2.9 -1.3 27 152 A T + 0 0 116 -2,-0.7 4,-0.3 5,-0.6 3,-0.2 0.599 39.6 108.0-103.4 -17.8 -8.2 -4.6 1.0 28 153 A G B >> S-B 32 0B 15 4,-2.2 3,-1.3 1,-0.2 4,-0.9 0.104 91.3 -48.8 -52.6 173.9 -9.2 -1.5 2.9 29 154 A K T 34 S+ 0 0 173 1,-0.3 -1,-0.2 2,-0.2 4,-0.0 -0.232 132.3 1.2 -50.3 123.9 -12.6 0.2 2.4 30 155 A N T 34 S- 0 0 143 -3,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.913 140.8 -50.4 61.2 44.5 -13.2 0.6 -1.4 31 156 A G T <4 S+ 0 0 38 -3,-1.3 2,-0.6 -4,-0.3 -26,-0.3 0.969 84.8 178.0 58.8 57.6 -9.8 -1.1 -2.2 32 157 A R B < -B 28 0B 90 -4,-0.9 -4,-2.2 -7,-0.1 2,-0.8 -0.838 26.1-136.1 -98.0 121.2 -7.7 1.0 0.1 33 158 A V B +a 6 0A 7 -28,-2.2 -26,-0.8 -2,-0.6 2,-0.2 -0.644 34.8 173.9 -78.0 110.3 -4.0 0.2 0.3 34 159 A L >> - 0 0 65 -2,-0.8 4,-1.9 -9,-0.2 3,-0.6 -0.523 49.8 -86.8-109.4 178.5 -3.0 0.2 3.9 35 160 A K H 3> S+ 0 0 120 1,-0.3 4,-2.2 2,-0.2 3,-0.3 0.911 130.2 51.3 -50.0 -47.7 0.2 -0.6 5.8 36 161 A E H 3> S+ 0 0 155 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.839 106.4 55.6 -60.0 -33.6 -0.9 -4.3 6.0 37 162 A D H <> S+ 0 0 7 -3,-0.6 4,-2.0 2,-0.2 -12,-0.6 0.871 106.2 50.7 -67.7 -36.6 -1.5 -4.2 2.3 38 163 A I H X S+ 0 0 0 -4,-1.9 4,-2.2 -3,-0.3 5,-0.3 0.951 110.5 47.5 -65.2 -50.1 2.1 -3.1 1.7 39 164 A D H X S+ 0 0 83 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.878 111.2 53.0 -58.6 -38.9 3.5 -5.9 3.9 40 165 A A H < S+ 0 0 43 -4,-2.0 -1,-0.2 2,-0.2 -2,-0.2 0.903 107.1 51.8 -63.8 -42.1 1.2 -8.4 2.0 41 166 A F H < S+ 0 0 75 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.947 117.1 37.4 -59.7 -51.3 2.5 -7.2 -1.3 42 167 A L H < S+ 0 0 88 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.2 0.810 118.2 62.4 -70.9 -30.3 6.2 -7.7 -0.3 43 168 A A < + 0 0 62 -4,-2.5 -3,-0.0 -5,-0.3 0, 0.0 -0.242 56.0 115.8 -87.5 179.3 5.3 -10.8 1.6 44 169 A G 0 0 79 1,-0.4 -4,-0.0 -2,-0.1 -3,-0.0 0.367 360.0 360.0 120.9 106.0 3.8 -14.0 0.4 45 170 A G 0 0 134 0, 0.0 -1,-0.4 0, 0.0 0, 0.0 -0.022 360.0 360.0 114.6 360.0 5.3 -17.5 0.4