==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-JUL-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER NUCLEOTIDE-BINDING PROTEIN 08-FEB-12 4DMZ . COMPND 2 MOLECULE: PUTATIVE UNCHARACTERIZED PROTEIN PELD; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR J.C.WHITNEY,K.M.COLVIN,L.S.MARMONT,H.ROBINSON,M.R.PARSEK,P.L . 558 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24759.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 405 72.6 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 . 98 17.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 1.1 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 . 43 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 44 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 193 34.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 2.3 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 1 0 4 1 0 0 0 1 3 1 1 2 1 1 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 . 2 2 2 0 0 6 2 2 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 2 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 1 156 A N 0 0 90 0, 0.0 2,-0.9 0, 0.0 312,-0.3 0.000 360.0 360.0 360.0 1.1 32.9 -24.3 -39.8 2 157 A D + 0 0 88 310,-0.2 3,-0.3 1,-0.1 4,-0.2 -0.732 360.0 171.7 -78.6 104.5 29.2 -23.6 -39.3 3 158 A Q > + 0 0 43 -2,-0.9 4,-2.8 1,-0.2 5,-0.2 0.007 38.0 116.0-102.3 25.0 29.3 -19.9 -38.2 4 159 A S H > S+ 0 0 5 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.895 76.0 50.4 -66.8 -39.8 25.5 -19.3 -38.4 5 160 A L H > S+ 0 0 20 -3,-0.3 4,-2.3 2,-0.2 5,-0.2 0.961 113.1 45.8 -61.0 -51.6 25.2 -18.6 -34.6 6 161 A R H > S+ 0 0 8 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.931 113.4 50.8 -55.8 -45.8 28.0 -16.1 -34.8 7 162 A S H X S+ 0 0 0 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.904 108.8 50.8 -62.4 -39.1 26.5 -14.6 -37.9 8 163 A S H X S+ 0 0 2 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.901 112.5 46.8 -64.2 -39.5 23.0 -14.3 -36.2 9 164 A L H X S+ 0 0 3 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.891 108.5 54.9 -70.9 -38.4 24.6 -12.6 -33.2 10 165 A L H X S+ 0 0 0 -4,-2.6 4,-1.9 -5,-0.2 -1,-0.2 0.902 108.5 49.3 -59.7 -39.2 26.6 -10.2 -35.4 11 166 A G H X S+ 0 0 0 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.926 111.3 49.1 -65.7 -45.1 23.4 -9.1 -37.2 12 167 A L H X S+ 0 0 4 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.867 107.4 54.8 -58.3 -41.6 21.7 -8.5 -33.8 13 168 A R H X S+ 0 0 61 -4,-2.5 4,-2.8 1,-0.2 -1,-0.2 0.907 110.5 46.8 -63.8 -39.3 24.7 -6.5 -32.6 14 169 A Q H X S+ 0 0 41 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.917 109.3 51.8 -68.9 -43.5 24.4 -4.3 -35.6 15 170 A L H < S+ 0 0 16 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.936 113.6 48.0 -53.3 -44.8 20.6 -3.8 -35.3 16 171 A L H >< S+ 0 0 30 -4,-2.5 3,-1.5 1,-0.2 -2,-0.2 0.949 107.8 51.7 -62.0 -52.9 21.3 -2.8 -31.7 17 172 A R H 3< S+ 0 0 188 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.821 114.4 47.3 -53.9 -31.8 24.1 -0.4 -32.5 18 173 A E T 3< S+ 0 0 45 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 -0.191 84.6 101.2-115.2 42.9 21.8 1.3 -34.9 19 174 A L S < S- 0 0 44 -3,-1.5 2,-0.1 4,-0.0 -3,-0.0 -0.902 82.0 -97.6-110.3 152.2 18.5 1.8 -33.1 20 175 A P > - 0 0 56 0, 0.0 3,-1.3 0, 0.0 2,-0.1 -0.478 33.2-122.9 -66.3 142.3 17.4 5.1 -31.7 21 176 A G T 3 S+ 0 0 86 1,-0.2 3,-0.0 -2,-0.1 -3,-0.0 0.160 95.5 85.0 -76.1 21.9 18.2 5.2 -27.9 22 177 A D T 3 S+ 0 0 124 -2,-0.1 2,-0.4 2,-0.1 -1,-0.2 0.666 80.7 63.1 -95.6 -20.9 14.6 5.9 -27.0 23 178 A E S < S- 0 0 42 -3,-1.3 -1,-0.1 2,-0.0 -4,-0.0 -0.900 89.7-113.0-110.0 133.2 13.4 2.3 -26.9 24 179 A A >> - 0 0 52 -2,-0.4 4,-1.8 1,-0.1 3,-0.5 -0.402 30.3-122.5 -59.9 138.6 14.7 -0.3 -24.6 25 180 A P H 3> S+ 0 0 47 0, 0.0 4,-1.9 0, 0.0 -1,-0.1 0.825 107.5 55.6 -58.2 -39.4 16.5 -3.0 -26.6 26 181 A L H 3> S+ 0 0 15 1,-0.2 4,-0.6 2,-0.2 7,-0.2 0.910 110.7 45.3 -59.9 -42.7 14.4 -5.9 -25.5 27 182 A D H <4 S+ 0 0 75 -3,-0.5 4,-0.3 1,-0.2 3,-0.3 0.858 113.8 46.5 -73.0 -37.7 11.2 -4.2 -26.6 28 183 A A H < S+ 0 0 44 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.816 122.1 37.0 -74.4 -29.5 12.5 -3.1 -30.0 29 184 A L H X S+ 0 0 11 -4,-1.9 4,-2.9 -5,-0.2 3,-0.3 0.347 84.2 107.5-105.4 5.5 14.0 -6.4 -30.8 30 185 A A H X S+ 0 0 3 -4,-0.6 4,-2.7 -3,-0.3 5,-0.2 0.902 81.1 45.3 -51.2 -55.4 11.4 -8.8 -29.2 31 186 A E H > S+ 0 0 77 -4,-0.3 4,-1.9 1,-0.2 -1,-0.3 0.838 116.2 49.0 -60.4 -33.3 9.9 -10.1 -32.5 32 187 A T H > S+ 0 0 1 -3,-0.3 4,-2.0 250,-0.3 -2,-0.2 0.903 110.7 48.7 -73.8 -42.3 13.3 -10.6 -33.9 33 188 A V H X S+ 0 0 0 -4,-2.9 4,-2.1 2,-0.2 -2,-0.2 0.897 113.4 47.3 -65.8 -42.0 14.6 -12.4 -30.8 34 189 A L H X S+ 0 0 4 -4,-2.7 4,-2.8 -5,-0.2 -1,-0.2 0.914 109.1 54.2 -67.5 -42.2 11.6 -14.7 -30.8 35 190 A A H X S+ 0 0 17 -4,-1.9 4,-1.6 -5,-0.2 -2,-0.2 0.911 109.8 48.0 -56.4 -42.8 11.9 -15.4 -34.5 36 191 A L H X S+ 0 0 2 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.926 113.1 45.7 -67.6 -46.9 15.5 -16.5 -34.0 37 192 A L H X S+ 0 0 0 -4,-2.1 4,-1.8 1,-0.2 6,-0.3 0.914 110.5 55.2 -58.8 -41.2 14.8 -18.8 -31.0 38 193 A A H <>S+ 0 0 11 -4,-2.8 5,-1.9 1,-0.2 4,-0.5 0.849 107.0 51.1 -64.1 -33.0 11.8 -20.2 -33.0 39 194 A Q H ><5S+ 0 0 27 -4,-1.6 3,-0.8 3,-0.2 -1,-0.2 0.924 108.8 50.2 -68.9 -44.0 14.2 -21.0 -35.8 40 195 A Y H 3<5S+ 0 0 21 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.791 122.1 32.5 -66.6 -27.2 16.6 -22.8 -33.5 41 196 A G T 3<5S- 0 0 0 -4,-1.8 -1,-0.2 -5,-0.1 -2,-0.2 0.319 100.4-124.6-109.0 8.4 13.9 -24.9 -31.9 42 197 A S T < 5 - 0 0 13 -3,-0.8 -3,-0.2 -4,-0.5 -4,-0.1 0.893 48.3-171.5 40.4 43.7 11.5 -25.3 -34.9 43 198 A L < - 0 0 13 -5,-1.9 73,-0.2 -6,-0.3 -1,-0.1 -0.279 26.0-178.6 -65.0 146.5 9.1 -23.8 -32.4 44 199 A R S S+ 0 0 86 71,-2.5 2,-0.4 1,-0.4 72,-0.2 0.717 73.6 21.0-115.3 -39.7 5.4 -23.7 -33.4 45 200 A I E S+A 115 0A 32 70,-1.9 70,-2.2 21,-0.1 69,-2.0 -0.984 81.7 128.4-135.2 125.8 3.7 -22.1 -30.4 46 201 A A E -AB 113 65A 0 19,-1.9 19,-2.6 -2,-0.4 2,-0.3 -0.982 35.7-142.1-166.7 162.0 5.7 -20.0 -28.0 47 202 A G E -AB 112 64A 0 65,-2.3 65,-2.9 -2,-0.3 2,-0.5 -0.986 8.7-143.2-138.0 151.0 5.9 -16.6 -26.2 48 203 A L E -AB 111 63A 0 15,-2.7 14,-2.5 -2,-0.3 15,-1.2 -0.969 26.6-174.6-114.0 128.4 8.7 -14.2 -25.2 49 204 A Y E -A 110 0A 3 61,-2.9 61,-2.7 -2,-0.5 2,-0.2 -0.955 25.8-121.2-129.2 139.3 8.2 -12.5 -21.8 50 205 A R E -A 109 0A 61 10,-0.4 8,-2.9 -2,-0.4 2,-0.5 -0.560 26.6-143.3 -71.1 139.3 10.0 -9.8 -19.8 51 206 A V B -E 57 0B 10 57,-1.9 4,-0.0 6,-0.3 2,-0.0 -0.924 15.9-132.5-106.6 131.9 11.2 -11.0 -16.4 52 207 A R > - 0 0 103 4,-4.0 3,-2.0 -2,-0.5 55,-0.2 -0.202 32.3 -93.3 -77.8 171.3 11.0 -8.4 -13.6 53 208 A H T 3 S+ 0 0 117 1,-0.3 54,-0.1 2,-0.1 -1,-0.1 0.758 125.4 56.2 -56.7 -24.9 13.7 -7.6 -11.1 54 209 A D T 3 S- 0 0 101 2,-0.2 -1,-0.3 1,-0.0 -2,-0.1 0.061 121.2-102.4 -99.8 24.1 12.2 -10.2 -8.8 55 210 A R S < S+ 0 0 99 -3,-2.0 -2,-0.1 1,-0.2 27,-0.1 0.824 83.2 128.0 60.0 30.5 12.3 -13.1 -11.2 56 211 A T - 0 0 40 -4,-0.2 -4,-4.0 26,-0.0 2,-0.3 -0.943 57.2-126.6-110.6 142.1 8.6 -12.8 -12.0 57 212 A P B -E 51 0B 6 0, 0.0 -6,-0.3 0, 0.0 16,-0.1 -0.679 20.0-116.2 -87.5 140.6 7.5 -12.7 -15.6 58 213 A E - 0 0 68 -8,-2.9 -8,-0.1 -2,-0.3 13,-0.0 -0.547 24.5-133.8 -66.9 140.5 5.3 -9.9 -16.9 59 214 A P S S+ 0 0 84 0, 0.0 12,-0.5 0, 0.0 -1,-0.1 0.906 85.0 75.3 -67.1 -44.6 2.0 -11.4 -18.0 60 215 A Q S S- 0 0 69 10,-0.1 -10,-0.4 1,-0.1 -2,-0.1 -0.585 86.4-124.2 -77.9 122.7 1.7 -9.6 -21.4 61 216 A P - 0 0 59 0, 0.0 -12,-0.2 0, 0.0 3,-0.1 -0.253 7.0-147.1 -66.1 147.6 4.0 -11.0 -24.0 62 217 A L S S- 0 0 32 -14,-2.5 2,-0.3 1,-0.3 -31,-0.2 0.791 88.4 -6.9 -75.6 -35.0 6.6 -8.9 -25.8 63 218 A A E -B 48 0A 4 -15,-1.2 -15,-2.7 -33,-0.1 -1,-0.3 -0.979 66.4-159.8-157.7 153.0 6.0 -11.3 -28.8 64 219 A T E -B 47 0A 64 -2,-0.3 2,-0.4 -17,-0.2 -17,-0.2 -0.939 8.1-152.2-133.8 158.2 4.2 -14.5 -29.6 65 220 A L E -B 46 0A 60 -19,-2.6 -19,-1.9 -2,-0.3 -21,-0.1 -0.998 67.9 -19.0-129.0 128.4 4.3 -17.3 -32.2 66 221 A G S S- 0 0 48 -2,-0.4 2,-2.4 -21,-0.2 -21,-0.1 -0.103 118.4 -28.8 66.4-171.3 1.2 -19.2 -33.1 67 222 A E S S- 0 0 88 -23,-0.1 -1,-0.2 -3,-0.1 -22,-0.1 -0.405 75.2-174.4 -76.9 67.5 -1.9 -19.3 -30.8 68 223 A M - 0 0 30 -2,-2.4 3,-0.1 -22,-0.2 -2,-0.1 -0.476 16.8-135.5 -67.6 125.8 0.1 -18.8 -27.6 69 224 A P - 0 0 58 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.359 38.7 -72.1 -75.7 162.3 -2.2 -19.1 -24.6 70 225 A V - 0 0 139 1,-0.1 2,-0.4 -2,-0.1 -10,-0.1 -0.230 57.1-110.2 -49.0 136.7 -2.1 -16.7 -21.6 71 226 A L - 0 0 17 -12,-0.5 2,-0.9 -3,-0.1 -1,-0.1 -0.615 21.9-150.3 -77.4 126.1 1.0 -17.2 -19.5 72 227 A D > - 0 0 91 -2,-0.4 3,-2.7 1,-0.1 6,-0.2 -0.842 3.9-163.4 -96.1 103.5 0.3 -18.7 -16.1 73 228 A A T 3 S+ 0 0 57 -2,-0.9 -1,-0.1 1,-0.3 6,-0.1 0.702 89.6 59.6 -60.4 -20.6 3.1 -17.4 -13.9 74 229 A D T 3 S+ 0 0 82 4,-0.1 -1,-0.3 -3,-0.1 -2,-0.0 0.485 77.3 131.0 -85.0 -2.8 2.3 -20.1 -11.3 75 230 A D <> - 0 0 22 -3,-2.7 4,-2.4 1,-0.1 5,-0.3 -0.243 65.1-128.9 -55.0 131.3 3.1 -22.8 -13.9 76 231 A L H > S+ 0 0 140 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.868 108.4 48.3 -49.1 -45.7 5.4 -25.4 -12.6 77 232 A L H > S+ 0 0 15 2,-0.2 4,-1.9 3,-0.2 -1,-0.2 0.879 112.4 49.5 -64.7 -41.1 7.8 -25.1 -15.6 78 233 A V H > S+ 0 0 0 -6,-0.2 4,-2.7 -3,-0.2 5,-0.3 0.987 113.5 43.1 -62.2 -59.8 7.9 -21.3 -15.3 79 234 A R H X S+ 0 0 45 -4,-2.4 4,-2.1 1,-0.2 5,-0.2 0.905 115.0 48.9 -53.2 -48.4 8.6 -21.1 -11.6 80 235 A T H X S+ 0 0 30 -4,-2.2 4,-2.4 -5,-0.3 6,-0.2 0.911 112.5 50.2 -62.4 -40.7 11.2 -23.9 -11.6 81 236 A C H X>S+ 0 0 0 -4,-1.9 4,-2.7 -5,-0.2 5,-1.3 0.945 115.0 41.0 -58.1 -54.0 12.9 -22.2 -14.6 82 237 A L H <5S+ 0 0 8 -4,-2.7 -1,-0.2 2,-0.2 -2,-0.2 0.713 114.4 53.9 -71.9 -22.6 13.0 -18.7 -13.0 83 238 A E H <5S+ 0 0 160 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.904 118.9 33.4 -76.2 -42.3 14.0 -20.3 -9.7 84 239 A R H <5S- 0 0 162 -4,-2.4 -2,-0.2 -5,-0.2 -3,-0.2 0.772 96.6-134.4 -81.6 -29.0 17.0 -22.1 -11.2 85 240 A G T <5S+ 0 0 17 -4,-2.7 2,-0.3 1,-0.3 -3,-0.2 0.821 71.7 105.4 72.0 32.7 17.9 -19.5 -13.9 86 241 A E S - 0 0 22 4,-1.9 3,-1.5 -2,-0.4 33,-0.1 -0.212 41.1 -90.1 -81.6 179.3 23.4 -13.0 -18.6 103 270 A T T 3 S+ 0 0 19 1,-0.3 -1,-0.1 2,-0.1 31,-0.0 0.635 126.5 57.0 -69.8 -13.2 26.7 -14.1 -17.1 104 271 A D T 3 S- 0 0 120 2,-0.1 -1,-0.3 0, 0.0 3,-0.1 0.581 118.5-108.9 -91.6 -11.8 25.8 -12.4 -13.8 105 272 A G < + 0 0 29 -3,-1.5 2,-0.5 1,-0.3 -2,-0.1 0.539 68.6 144.4 97.3 8.1 22.6 -14.4 -13.4 106 273 A R - 0 0 49 1,-0.0 -4,-1.9 2,-0.0 2,-0.8 -0.713 46.0-137.7 -79.1 123.7 20.1 -11.6 -14.0 107 274 A I E + D 0 101A 14 -2,-0.5 -6,-0.2 -6,-0.2 -52,-0.2 -0.750 25.9 175.4 -86.1 110.9 17.1 -13.0 -16.0 108 275 A L E - 0 0 37 -8,-2.8 -57,-1.9 -2,-0.8 2,-0.3 0.856 62.2 -11.0 -81.8 -38.7 16.2 -10.5 -18.7 109 276 A A E -AD 50 100A 0 -9,-1.1 -9,-3.0 -59,-0.3 2,-0.4 -0.919 57.8-125.2-155.3 176.2 13.4 -12.5 -20.3 110 277 A L E -AD 49 99A 0 -61,-2.7 -61,-2.9 -2,-0.3 2,-0.6 -0.998 5.7-153.5-138.1 129.0 11.7 -15.9 -20.7 111 278 A L E -AD 48 98A 0 -13,-3.2 -13,-2.7 -2,-0.4 2,-0.6 -0.920 17.0-167.0 -97.9 115.3 10.9 -18.1 -23.7 112 279 A A E -AD 47 97A 0 -65,-2.9 -65,-2.3 -2,-0.6 2,-0.6 -0.920 3.8-158.8-106.2 115.8 7.8 -20.2 -23.0 113 280 A V E +AD 46 96A 0 -17,-3.0 -18,-2.9 -2,-0.6 -17,-1.2 -0.844 19.8 172.3-100.5 118.4 7.3 -23.0 -25.4 114 281 A E E S+ 0 0 59 -69,-2.0 2,-0.3 -2,-0.6 -68,-0.2 0.774 73.6 11.3 -88.4 -31.9 3.8 -24.4 -25.7 115 282 A Q E +A 45 0A 72 -70,-2.2 -71,-2.5 -19,-0.1 -70,-1.9 -0.923 57.8 153.8-156.3 125.6 4.6 -26.7 -28.7 116 283 A M - 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