==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-DEC-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DNA BINDING PROTEIN 16-JUL-12 4G4K . COMPND 2 MOLECULE: ACCESSORY GENE REGULATOR PROTEIN A; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS; . AUTHOR P.G.LEONARD,I.F.BEZAR,A.M.STOCK . 198 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11885.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 138 69.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 76 38.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 2.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 2.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 23 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 12 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.0 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 2 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 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 1 0 4 8 2 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 . 2 2 0 2 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 1 141 A E 0 0 123 0, 0.0 15,-2.7 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 41.1 37.9 52.5 44.4 2 142 A T E -A 15 0A 78 13,-0.2 2,-0.4 14,-0.1 13,-0.2 -0.756 360.0-166.2 -95.8 135.2 35.6 52.8 41.4 3 143 A I E -A 14 0A 13 11,-3.1 11,-2.1 -2,-0.4 2,-0.6 -0.981 15.1-138.4-122.2 132.9 35.3 50.0 38.8 4 144 A E E -A 13 0A 80 -2,-0.4 2,-0.8 9,-0.2 9,-0.2 -0.793 11.9-159.8 -87.8 122.2 33.7 50.4 35.4 5 145 A L E -A 12 0A 0 7,-3.6 7,-2.3 -2,-0.6 2,-0.5 -0.881 12.9-147.5-103.1 104.3 31.6 47.4 34.5 6 146 A K E +A 11 0A 117 -2,-0.8 37,-2.8 37,-0.5 5,-0.2 -0.569 22.6 174.4 -75.8 116.5 31.2 47.5 30.7 7 147 A R - 0 0 118 3,-2.4 2,-0.3 -2,-0.5 4,-0.2 0.678 53.8 -90.8 -98.2 -19.2 27.8 46.1 29.8 8 148 A G S S+ 0 0 56 2,-1.0 -1,-0.1 35,-0.1 34,-0.0 -0.844 109.6 13.4 144.9-104.2 27.7 46.8 26.1 9 149 A S S S+ 0 0 118 -2,-0.3 2,-0.3 -3,-0.1 -3,-0.0 0.796 135.1 33.8 -72.8 -29.3 26.2 50.1 25.0 10 150 A N S S- 0 0 114 -5,-0.0 -3,-2.4 2,-0.0 -2,-1.0 -0.789 70.3-144.0-121.1 162.7 26.4 51.3 28.6 11 151 A S E -A 6 0A 40 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.935 7.6-146.3-120.2 153.3 28.6 50.9 31.6 12 152 A V E -A 5 0A 33 -7,-2.3 -7,-3.6 -2,-0.3 2,-0.5 -0.956 13.0-150.6-110.9 137.8 27.8 50.7 35.3 13 153 A Y E +A 4 0A 145 -2,-0.4 2,-0.3 -9,-0.2 -9,-0.2 -0.947 24.0 166.3-110.1 125.3 30.2 52.2 37.8 14 154 A V E -A 3 0A 12 -11,-2.1 -11,-3.1 -2,-0.5 2,-0.2 -0.896 36.6-104.3-131.0 162.8 30.4 50.7 41.2 15 155 A Q E > -A 2 0A 83 -2,-0.3 3,-2.1 -13,-0.2 4,-0.4 -0.619 35.2-112.3 -82.9 151.6 32.7 50.8 44.2 16 156 A Y G > S+ 0 0 30 -15,-2.7 3,-1.8 1,-0.3 -1,-0.1 0.889 116.6 50.8 -45.5 -50.0 35.0 47.8 44.9 17 157 A D G 3 S+ 0 0 56 1,-0.3 -1,-0.3 -16,-0.2 49,-0.0 0.452 93.0 72.6 -83.6 6.2 33.2 46.9 48.1 18 158 A D G < S+ 0 0 77 -3,-2.1 18,-0.9 17,-0.1 2,-0.6 0.612 88.3 83.1 -77.6 -15.9 29.8 46.9 46.4 19 159 A I E < -B 35 0B 0 -3,-1.8 16,-0.2 -4,-0.4 50,-0.2 -0.808 53.3-178.4 -98.6 122.7 31.1 43.7 44.9 20 160 A M E S- 0 0 4 14,-3.2 46,-2.5 -2,-0.6 2,-0.3 0.944 70.7 -36.9 -74.1 -57.8 30.8 40.4 46.7 21 161 A F E -BC 34 65B 2 13,-0.8 13,-2.8 44,-0.2 2,-0.4 -0.974 51.8-117.3-159.6 164.8 32.5 38.4 44.0 22 162 A F E -BC 33 64B 0 42,-3.0 42,-2.2 -2,-0.3 2,-0.4 -0.903 30.0-161.0-106.9 145.4 32.9 38.0 40.2 23 163 A E E -BC 32 63B 44 9,-2.3 9,-2.8 -2,-0.4 2,-0.4 -0.976 14.6-154.0-131.5 136.6 31.8 34.9 38.4 24 164 A S - 0 0 48 38,-2.5 2,-0.4 -2,-0.4 7,-0.1 -0.916 22.4-170.8 -99.5 136.8 32.5 33.2 35.1 25 165 A S > - 0 0 19 5,-0.5 3,-1.3 -2,-0.4 5,-0.0 -0.971 32.0-138.1-129.3 144.1 29.7 31.0 33.8 26 166 A T T 3 S+ 0 0 149 -2,-0.4 -1,-0.1 1,-0.2 3,-0.0 0.608 104.0 66.1 -71.9 -10.0 29.6 28.6 30.9 27 167 A K T 3 S+ 0 0 165 1,-0.1 2,-0.3 3,-0.1 -1,-0.2 0.445 104.9 41.5 -92.3 1.3 26.1 29.9 30.2 28 168 A S < - 0 0 25 -3,-1.3 -3,-0.3 2,-0.1 -1,-0.1 -0.999 59.6-146.3-146.1 148.7 27.4 33.4 29.3 29 169 A H S S+ 0 0 131 -2,-0.3 2,-0.3 -5,-0.1 -1,-0.1 0.488 89.5 74.3 -82.5 -7.1 30.1 35.1 27.3 30 170 A R S S- 0 0 76 13,-0.1 -5,-0.5 -5,-0.0 13,-0.2 -0.767 84.3-121.1-104.1 151.4 29.9 37.9 30.0 31 171 A L E - D 0 42B 12 11,-2.5 11,-2.3 -2,-0.3 2,-0.5 -0.461 26.0-126.8 -78.3 164.4 31.2 37.8 33.5 32 172 A I E -BD 23 41B 14 -9,-2.8 -9,-2.3 9,-0.2 2,-0.6 -0.968 11.1-154.7-119.6 118.7 28.8 38.3 36.4 33 173 A A E -BD 22 40B 0 7,-2.9 7,-2.3 -2,-0.5 2,-0.9 -0.833 12.4-148.8 -87.2 120.4 29.3 40.9 39.1 34 174 A H E -BD 21 39B 8 -13,-2.8 -14,-3.2 -2,-0.6 -13,-0.8 -0.808 22.0-175.8 -92.3 104.1 27.5 39.9 42.3 35 175 A L E -B 19 0B 13 3,-2.6 -16,-0.2 -2,-0.9 -17,-0.1 -0.403 42.3 -93.1 -92.3 175.0 26.5 43.1 44.0 36 176 A D S S+ 0 0 98 -18,-0.9 50,-0.1 1,-0.2 -17,-0.1 0.920 121.0 17.2 -54.1 -46.2 24.8 43.3 47.4 37 177 A N S S+ 0 0 134 1,-0.1 2,-0.3 0, 0.0 -1,-0.2 0.492 129.6 4.9-111.2 -7.2 21.3 43.5 45.9 38 178 A R - 0 0 165 2,-0.0 -3,-2.6 -5,-0.0 2,-0.4 -0.986 65.6-104.9-165.6 171.0 21.6 42.2 42.4 39 179 A Q E -D 34 0B 107 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.879 25.6-167.1-109.1 141.6 23.8 40.7 39.6 40 180 A I E -D 33 0B 21 -7,-2.3 -7,-2.9 -2,-0.4 2,-0.2 -0.987 12.9-142.2-129.8 122.3 25.1 42.6 36.7 41 181 A E E +D 32 0B 60 -2,-0.4 2,-0.3 -9,-0.2 -9,-0.2 -0.605 32.9 158.0 -81.3 144.3 26.7 41.0 33.6 42 182 A F E -D 31 0B 4 -11,-2.3 -11,-2.5 -2,-0.2 2,-0.5 -0.966 42.9 -91.4-157.1 169.3 29.6 42.7 32.0 43 183 A Y + 0 0 106 -37,-2.8 -37,-0.5 -2,-0.3 2,-0.3 -0.775 68.8 96.8 -93.0 123.2 32.7 42.3 29.8 44 184 A G - 0 0 43 -2,-0.5 2,-0.4 -39,-0.1 3,-0.1 -0.978 60.2-103.0-175.6-173.8 36.0 41.4 31.5 45 185 A N > - 0 0 69 -2,-0.3 4,-2.1 1,-0.1 5,-0.2 -0.999 19.0-132.9-137.5 144.0 38.3 38.7 32.6 46 186 A L H > S+ 0 0 10 -2,-0.4 4,-2.4 1,-0.2 5,-0.2 0.843 103.8 55.8 -61.9 -36.9 38.9 37.2 36.0 47 187 A K H > S+ 0 0 130 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.949 109.7 45.6 -63.6 -47.8 42.7 37.4 35.9 48 188 A E H 4 S+ 0 0 114 1,-0.2 3,-0.5 2,-0.2 4,-0.4 0.894 112.1 52.3 -60.3 -42.2 42.7 41.2 35.2 49 189 A L H >< S+ 0 0 12 -4,-2.1 3,-1.3 1,-0.2 4,-0.5 0.892 103.9 55.8 -63.8 -39.5 40.0 41.7 37.9 50 190 A S H 3< S+ 0 0 31 -4,-2.4 3,-0.4 1,-0.3 -1,-0.2 0.788 105.8 55.0 -63.8 -24.6 42.1 39.8 40.5 51 191 A Q T 3< S+ 0 0 149 -4,-1.0 -1,-0.3 -3,-0.5 -2,-0.2 0.547 84.9 82.2 -86.1 -7.3 44.9 42.2 39.8 52 192 A L S < S- 0 0 72 -3,-1.3 2,-0.3 -4,-0.4 -1,-0.2 0.839 107.7 -7.1 -64.4 -32.9 42.9 45.4 40.4 53 193 A D > - 0 0 48 -4,-0.5 3,-1.8 -3,-0.4 -1,-0.2 -0.983 64.3-111.9-165.9 148.0 43.4 45.2 44.2 54 194 A D T 3 S+ 0 0 148 -2,-0.3 13,-0.1 1,-0.3 -1,-0.1 0.731 112.3 65.5 -57.1 -26.2 44.8 43.0 47.0 55 195 A R T 3 S+ 0 0 19 11,-0.1 12,-3.1 12,-0.1 2,-0.4 0.747 87.9 80.4 -71.6 -21.1 41.3 42.5 48.3 56 196 A F E < +E 66 0B 6 -3,-1.8 2,-0.4 10,-0.2 10,-0.2 -0.697 62.7 179.1 -89.2 137.1 40.3 40.6 45.1 57 197 A F E -E 65 0B 36 8,-1.9 8,-2.8 -2,-0.4 2,-0.9 -0.978 31.7-132.8-146.4 125.8 41.4 37.0 45.0 58 198 A R E +E 64 0B 63 -2,-0.4 6,-0.2 6,-0.3 3,-0.1 -0.683 36.5 161.8 -74.8 107.1 41.0 34.2 42.4 59 199 A C E + 0 0 0 4,-1.5 32,-2.7 -2,-0.9 35,-0.3 0.407 62.7 14.3-108.5 -0.7 39.9 31.3 44.6 60 200 A H E > S-E 63 0B 45 3,-1.0 3,-0.9 30,-0.2 -1,-0.2 -0.958 84.0 -99.7-167.3 154.5 38.4 29.0 41.9 61 201 A N T 3 S+ 0 0 121 -2,-0.3 -15,-0.1 1,-0.2 -1,-0.1 0.848 125.3 37.8 -53.5 -31.8 38.5 28.7 38.1 62 202 A S T 3 S+ 0 0 32 1,-0.1 -38,-2.5 -39,-0.1 2,-0.4 0.499 111.3 63.0 -98.6 -8.1 35.1 30.4 38.1 63 203 A F E < -CE 23 60B 16 -3,-0.9 -4,-1.5 -40,-0.2 -3,-1.0 -0.970 41.6-174.5-136.6 136.5 35.4 33.0 40.9 64 204 A V E -CE 22 58B 0 -42,-2.2 -42,-3.0 -2,-0.4 -6,-0.3 -0.993 30.5-156.6-117.8 120.1 37.2 36.1 42.0 65 205 A V E -CE 21 57B 0 -8,-2.8 -8,-1.9 -2,-0.5 2,-0.8 -0.655 18.2-130.6-102.5 151.6 36.2 37.1 45.5 66 206 A N E > - 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