==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=16-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SIGNALING PROTEIN 24-APR-12 4ETZ . COMPND 2 MOLECULE: PELD; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR Z.LI,J.CHEN,S.K.NAIR . 574 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28371.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 397 69.2 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 . 96 16.7 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 . 6 1.0 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 . 44 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 195 34.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.7 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 1 0 2 0 0 2 2 0 1 0 1 1 0 1 3 1 2 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 8 0 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 1 158 A Q > 0 0 162 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -23.9 24.8 0.8 -1.3 2 159 A S H > + 0 0 66 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.943 360.0 46.1 -65.8 -48.0 28.5 -0.2 -0.7 3 160 A L H > S+ 0 0 29 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.940 112.8 49.7 -56.3 -53.5 28.2 0.3 3.1 4 161 A R H > S+ 0 0 66 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.928 113.5 46.4 -52.7 -49.0 24.9 -1.6 3.2 5 162 A S H X S+ 0 0 66 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.901 111.2 51.1 -62.0 -43.3 26.4 -4.5 1.3 6 163 A S H X S+ 0 0 20 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.936 113.4 46.4 -59.3 -44.0 29.6 -4.6 3.4 7 164 A L H X S+ 0 0 2 -4,-2.8 4,-2.8 2,-0.2 -2,-0.2 0.898 110.9 50.9 -67.9 -39.6 27.4 -4.7 6.5 8 165 A L H X S+ 0 0 35 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.879 109.0 52.9 -63.4 -43.0 25.1 -7.4 5.2 9 166 A G H X S+ 0 0 37 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.943 112.3 44.1 -52.1 -52.8 28.1 -9.5 4.3 10 167 A L H X S+ 0 0 3 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.926 111.2 54.3 -59.1 -46.1 29.5 -9.1 7.8 11 168 A R H X S+ 0 0 12 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.902 108.4 49.5 -58.9 -39.7 26.0 -9.8 9.3 12 169 A Q H X S+ 0 0 63 -4,-2.2 4,-1.5 2,-0.2 -1,-0.2 0.859 107.4 52.7 -69.3 -36.2 25.8 -13.1 7.3 13 170 A L H X S+ 0 0 76 -4,-1.9 4,-0.6 1,-0.2 -1,-0.2 0.902 110.3 50.9 -64.2 -38.5 29.2 -14.2 8.4 14 171 A L H >< S+ 0 0 5 -4,-2.4 3,-0.7 1,-0.2 -2,-0.2 0.888 107.1 52.6 -60.5 -44.5 27.9 -13.6 12.0 15 172 A R H 3< S+ 0 0 104 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.820 111.8 46.6 -62.9 -32.1 24.7 -15.6 11.4 16 173 A E H 3< S+ 0 0 146 -4,-1.5 -1,-0.2 -5,-0.1 -2,-0.2 0.480 82.0 119.0 -95.1 -4.8 26.8 -18.6 10.2 17 174 A L S << S- 0 0 22 -3,-0.7 -3,-0.0 -4,-0.6 -4,-0.0 -0.401 76.3-117.0 -57.5 136.6 29.4 -18.6 13.0 18 175 A P - 0 0 90 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.707 33.7-127.5 -43.3 -29.0 29.4 -21.9 15.0 19 176 A G S S+ 0 0 45 2,-0.2 -2,-0.1 -5,-0.1 3,-0.0 0.523 93.6 96.4 79.5 3.3 28.4 -20.0 18.2 20 177 A D S S+ 0 0 103 2,-0.1 2,-0.2 0, 0.0 -3,-0.0 0.833 78.2 57.4 -77.9 -46.4 31.3 -21.7 19.8 21 178 A E S S- 0 0 79 1,-0.1 -2,-0.2 2,-0.0 319,-0.0 -0.541 91.1-105.7 -98.7 152.5 33.6 -18.7 19.2 22 179 A A > - 0 0 10 -2,-0.2 4,-2.3 1,-0.1 3,-0.4 -0.549 29.8-132.3 -65.4 132.5 33.4 -15.1 20.2 23 180 A P H > S+ 0 0 8 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.913 104.4 55.3 -55.7 -42.1 32.5 -13.0 17.1 24 181 A L H 4 S+ 0 0 1 115,-0.2 4,-0.2 1,-0.2 7,-0.1 0.820 111.9 40.8 -67.7 -31.8 35.3 -10.5 17.8 25 182 A D H >4 S+ 0 0 78 -3,-0.4 3,-0.6 2,-0.1 4,-0.3 0.929 120.2 42.2 -77.6 -45.4 38.0 -13.1 17.8 26 183 A A H 3< S+ 0 0 35 -4,-2.3 -2,-0.2 1,-0.2 3,-0.2 0.793 123.4 36.1 -74.8 -30.1 36.8 -15.2 14.9 27 184 A L T 3X S+ 0 0 12 -4,-2.6 4,-2.5 -5,-0.3 3,-0.3 0.280 83.0 110.1-104.0 10.3 35.9 -12.3 12.6 28 185 A A H <> S+ 0 0 2 -3,-0.6 4,-2.6 1,-0.2 5,-0.2 0.873 77.6 51.3 -55.1 -46.5 38.7 -10.0 13.6 29 186 A E H > S+ 0 0 95 -4,-0.3 4,-2.4 1,-0.2 -1,-0.2 0.894 113.3 45.5 -55.0 -44.4 40.5 -10.3 10.2 30 187 A T H > S+ 0 0 35 -3,-0.3 4,-2.5 2,-0.2 -2,-0.2 0.878 111.6 51.1 -69.0 -42.0 37.3 -9.5 8.4 31 188 A V H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.959 114.6 43.9 -62.5 -47.6 36.4 -6.6 10.6 32 189 A L H X S+ 0 0 8 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.899 112.6 51.8 -64.9 -42.1 39.9 -5.1 10.2 33 190 A A H X S+ 0 0 59 -4,-2.4 4,-1.7 -5,-0.2 -1,-0.2 0.897 109.1 51.9 -62.7 -39.6 39.9 -5.8 6.4 34 191 A L H X S+ 0 0 19 -4,-2.5 4,-1.5 1,-0.2 -2,-0.2 0.933 112.7 43.7 -59.7 -48.1 36.5 -4.0 6.2 35 192 A L H X S+ 0 0 1 -4,-2.1 4,-2.1 1,-0.2 6,-0.3 0.827 111.3 55.2 -64.9 -37.3 37.8 -0.9 8.0 36 193 A A H X>S+ 0 0 14 -4,-2.6 5,-1.3 1,-0.2 4,-0.6 0.842 106.1 52.5 -61.4 -38.6 41.0 -1.0 5.9 37 194 A Q H <5S+ 0 0 118 -4,-1.7 3,-0.2 2,-0.2 -2,-0.2 0.859 113.5 41.5 -67.6 -42.0 39.0 -0.9 2.7 38 195 A Y H <5S+ 0 0 30 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.802 122.5 39.1 -82.7 -27.5 37.0 2.2 3.7 39 196 A G H <5S- 0 0 0 -4,-2.1 -1,-0.2 -5,-0.1 -2,-0.2 0.373 99.8-126.3 -96.8 3.6 39.9 4.1 5.2 40 197 A S T <5 - 0 0 58 -4,-0.6 -3,-0.2 -3,-0.2 -4,-0.1 0.848 46.7-174.0 45.3 37.5 42.6 3.1 2.7 41 198 A L < + 0 0 15 -5,-1.3 74,-0.2 -6,-0.3 -1,-0.1 -0.106 26.2 177.3 -56.7 155.1 44.5 2.0 5.7 42 199 A R S S+ 0 0 166 72,-2.2 2,-0.4 1,-0.2 73,-0.2 0.559 73.5 24.2-127.5 -48.7 48.1 0.8 5.3 43 200 A I E S+A 114 0A 27 71,-2.2 70,-3.0 21,-0.1 71,-1.9 -0.963 81.7 133.9-126.1 120.6 49.3 0.1 8.9 44 201 A A E -AB 112 63A 0 19,-1.8 19,-2.8 -2,-0.4 2,-0.3 -0.984 33.5-151.8-159.0 153.8 46.7 -0.7 11.6 45 202 A G E -AB 111 62A 0 66,-1.8 66,-2.6 -2,-0.3 2,-0.5 -0.972 12.1-142.1-129.5 152.3 45.7 -3.1 14.4 46 203 A L E -AB 110 61A 0 15,-2.5 14,-3.1 -2,-0.3 15,-1.0 -0.959 25.6-172.8-111.2 130.6 42.4 -4.2 15.9 47 204 A Y E -A 109 0A 2 62,-2.8 62,-2.5 -2,-0.5 2,-0.2 -0.942 25.8-120.0-128.6 142.0 42.2 -4.6 19.6 48 205 A R E -A 108 0A 9 10,-0.4 8,-2.7 -2,-0.4 2,-0.4 -0.566 29.4-143.2 -69.6 141.7 39.7 -5.9 22.2 49 206 A V B -E 55 0B 6 58,-1.8 4,-0.0 6,-0.2 2,-0.0 -0.925 16.8-129.2-109.8 137.5 38.7 -3.2 24.7 50 207 A R > - 0 0 28 4,-3.9 3,-1.6 -2,-0.4 56,-0.2 -0.205 27.7 -94.7 -79.0 170.4 38.1 -4.3 28.2 51 208 A Y T 3 S+ 0 0 80 1,-0.3 55,-0.2 2,-0.1 -1,-0.1 0.873 124.3 49.3 -39.3 -52.1 35.2 -3.7 30.6 52 209 A D T 3 S- 0 0 70 2,-0.1 -1,-0.3 1,-0.1 -2,-0.1 0.063 123.6 -99.7 -88.8 21.7 36.9 -0.6 32.1 53 210 A R S < S+ 0 0 92 -3,-1.6 -2,-0.1 1,-0.2 -1,-0.1 0.789 82.8 128.8 61.7 28.8 37.7 1.0 28.7 54 211 A T - 0 0 56 26,-0.0 -4,-3.9 18,-0.0 2,-0.3 -0.889 57.5-119.0-104.6 149.7 41.3 -0.1 28.6 55 212 A P B -E 49 0B 10 0, 0.0 -6,-0.2 0, 0.0 53,-0.0 -0.690 14.4-123.2 -87.5 138.6 42.7 -2.0 25.5 56 213 A E - 0 0 56 -8,-2.7 -8,-0.3 -2,-0.3 13,-0.0 -0.705 26.2-144.5 -70.9 119.0 44.1 -5.5 25.5 57 214 A P S S+ 0 0 56 0, 0.0 12,-0.5 0, 0.0 -1,-0.1 0.811 77.1 82.6 -64.4 -35.3 47.6 -4.8 24.0 58 215 A Q S S- 0 0 156 10,-0.1 -10,-0.4 1,-0.1 -2,-0.1 -0.614 87.8-122.5 -72.5 122.3 48.0 -8.1 22.0 59 216 A P - 0 0 52 0, 0.0 -12,-0.2 0, 0.0 3,-0.1 -0.276 11.1-146.9 -73.9 151.0 46.1 -7.4 18.7 60 217 A L S S- 0 0 46 -14,-3.1 2,-0.3 1,-0.3 -31,-0.2 0.757 87.5 -10.1 -77.8 -28.9 43.3 -9.5 17.4 61 218 A A E -B 46 0A 19 -15,-1.0 -15,-2.5 -33,-0.1 -1,-0.3 -0.951 66.6-155.1-165.1 150.0 44.5 -8.7 13.8 62 219 A T E -B 45 0A 74 -2,-0.3 2,-0.4 -17,-0.2 -17,-0.2 -0.921 6.3-150.0-131.2 161.0 47.0 -6.5 12.1 63 220 A L E -B 44 0A 57 -19,-2.8 -19,-1.8 -2,-0.3 -21,-0.1 -1.000 69.0 -21.4-132.2 131.0 47.5 -4.9 8.7 64 221 A G S S- 0 0 36 -2,-0.4 2,-1.5 -21,-0.2 -21,-0.1 -0.213 119.9 -29.1 59.8-155.7 51.0 -4.2 7.4 65 222 A E S S- 0 0 174 -3,-0.1 -1,-0.2 -23,-0.1 -22,-0.1 -0.584 73.4-177.3 -97.2 74.5 53.8 -3.9 10.0 66 223 A M - 0 0 27 -2,-1.5 3,-0.1 -22,-0.2 -2,-0.1 -0.603 18.0-136.4 -75.1 126.7 51.9 -2.6 13.0 67 224 A P - 0 0 62 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.276 40.0 -68.2 -74.9 168.3 54.1 -1.9 16.0 68 225 A A - 0 0 97 1,-0.1 2,-0.7 -2,-0.0 -10,-0.1 -0.227 60.8-101.5 -58.9 145.4 53.3 -2.9 19.6 69 226 A L - 0 0 17 -12,-0.5 2,-1.4 -3,-0.1 -1,-0.1 -0.614 20.4-141.2 -85.2 112.9 50.3 -0.9 21.1 70 227 A D > - 0 0 59 -2,-0.7 3,-2.2 1,-0.2 6,-0.2 -0.546 16.6-162.8 -66.4 88.9 51.2 1.9 23.4 71 228 A A T 3 S+ 0 0 45 -2,-1.4 -1,-0.2 1,-0.3 -2,-0.0 0.885 86.8 37.4 -44.8 -54.3 48.4 1.4 25.9 72 229 A D T 3 S+ 0 0 126 -3,-0.1 -1,-0.3 4,-0.1 -2,-0.1 0.166 82.7 140.9 -95.6 24.7 48.6 4.8 27.5 73 230 A D <> - 0 0 35 -3,-2.2 4,-2.6 1,-0.1 5,-0.2 -0.322 62.0-120.0 -51.9 141.9 49.4 6.6 24.2 74 231 A L H > S+ 0 0 111 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.858 111.6 50.7 -59.6 -40.6 47.6 10.0 24.3 75 232 A L H > S+ 0 0 24 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.907 112.5 47.8 -66.7 -40.4 45.5 9.2 21.2 76 233 A V H > S+ 0 0 0 -6,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.906 113.3 46.0 -66.6 -47.3 44.4 5.9 22.6 77 234 A R H X S+ 0 0 132 -4,-2.6 4,-1.9 2,-0.2 5,-0.2 0.921 114.1 49.2 -62.6 -42.7 43.4 7.2 26.0 78 235 A T H X S+ 0 0 42 -4,-2.3 4,-2.4 -5,-0.2 5,-0.3 0.930 110.1 50.7 -63.4 -47.3 41.6 10.2 24.5 79 236 A C H X>S+ 0 0 0 -4,-2.2 4,-1.7 1,-0.2 5,-1.0 0.887 113.3 44.8 -54.4 -46.4 39.6 7.9 22.1 80 237 A L H <5S+ 0 0 5 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.771 114.9 46.1 -80.6 -25.6 38.5 5.6 24.8 81 238 A E H <5S+ 0 0 158 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.840 120.6 39.6 -79.0 -36.5 37.5 8.3 27.3 82 239 A R H <5S- 0 0 157 -4,-2.4 -2,-0.2 -5,-0.2 -3,-0.2 0.724 97.9-140.4 -83.7 -25.9 35.6 10.3 24.7 83 240 A G T <5 + 0 0 17 -4,-1.7 2,-0.3 -5,-0.3 -3,-0.2 0.770 67.7 98.6 66.6 27.6 34.2 7.2 23.0 84 241 A E S - 0 0 11 4,-2.1 3,-2.3 -2,-0.5 33,-0.1 -0.201 39.1 -88.5 -80.4 178.5 27.4 -0.1 20.2 102 270 A T T 3 S+ 0 0 14 1,-0.3 -1,-0.1 31,-0.1 32,-0.0 0.644 128.2 53.2 -65.5 -16.6 24.0 1.7 20.6 103 271 A D T 3 S- 0 0 129 2,-0.1 -1,-0.3 34,-0.0 -2,-0.0 0.269 120.2-107.4 -97.6 8.1 24.3 1.3 24.4 104 272 A G < + 0 0 34 -3,-2.3 2,-0.4 1,-0.3 -2,-0.1 0.569 67.7 147.0 77.2 10.2 27.8 3.0 24.6 105 273 A R - 0 0 99 1,-0.0 -4,-2.1 2,-0.0 2,-0.8 -0.663 44.5-140.1 -72.5 124.6 29.8 -0.2 25.3 106 274 A I E + D 0 100A 11 -2,-0.4 -6,-0.2 -6,-0.2 -53,-0.2 -0.829 27.1 174.2 -89.5 113.3 33.2 0.1 23.6 107 275 A L E - 0 0 5 -8,-3.0 -58,-1.8 -2,-0.8 2,-0.3 0.801 57.0 -5.8 -90.0 -32.7 33.9 -3.4 22.2 108 276 A A E -AD 48 99A 0 -9,-0.7 -9,-2.6 -60,-0.3 2,-0.4 -0.925 58.4-128.1-156.9 171.7 37.0 -2.9 20.3 109 277 A L E -AD 47 98A 0 -62,-2.5 -62,-2.8 -2,-0.3 2,-0.6 -0.996 5.3-155.6-138.2 125.1 39.6 -0.3 19.1 110 278 A L E -AD 46 97A 0 -13,-3.3 -13,-2.7 -2,-0.4 2,-0.5 -0.911 16.6-167.6 -92.9 120.3 41.0 0.3 15.6 111 279 A A E -AD 45 96A 0 -66,-2.6 -66,-1.8 -2,-0.6 2,-0.6 -0.941 6.0-154.4-110.8 123.2 44.5 2.0 15.9 112 280 A V E +AD 44 95A 0 -17,-3.4 -18,-3.3 -2,-0.5 -17,-1.1 -0.827 20.7 173.0-105.4 120.1 45.9 3.5 12.7 113 281 A E E S+ 0 0 48 -70,-3.0 2,-0.4 -2,-0.6 -69,-0.2 0.872 73.5 6.8 -81.6 -46.3 49.6 3.8 12.3 114 282 A Q E +A 43 0A 83 -71,-1.9 -72,-2.2 -21,-0.1 -71,-2.2 -0.999 58.7 157.2-148.2 132.3 49.6 4.9 8.7 115 283 A M - 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