==== 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 ALLERGEN 28-FEB-02 1L3P . COMPND 2 MOLECULE: POLLEN ALLERGEN PHL P 5B; . SOURCE 2 ORGANISM_SCIENTIFIC: PHLEUM PRATENSE; . AUTHOR K.R.RAJASHANKAR,A.BUFE,W.WEBER,S.ESCHENBURG,B.LINDNER,CH.BET . 102 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5652.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 81 79.4 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 . 0 0.0 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 . 0 0.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 15.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 64 62.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 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 1 0 0 0 0 0 0 0 1 0 0 0 2 0 0 0 0 0 0 1 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 . 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 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 1 150 A I 0 0 81 0, 0.0 5,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 121.1 5.8 13.8 46.9 2 151 A P >> - 0 0 72 0, 0.0 3,-3.1 0, 0.0 4,-1.0 -0.319 360.0-125.7 -55.9 125.1 5.6 14.5 50.6 3 152 A A H 3> S+ 0 0 85 1,-0.3 4,-0.6 2,-0.2 3,-0.4 0.784 108.6 62.4 -42.0 -36.6 2.0 15.6 51.4 4 153 A G H 34 S+ 0 0 61 1,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.728 104.0 47.2 -66.2 -22.4 3.3 18.7 53.0 5 154 A E H X4 S+ 0 0 7 -3,-3.1 3,-2.0 1,-0.1 4,-0.5 0.672 88.4 85.2 -91.6 -20.8 4.8 19.9 49.7 6 155 A L H >< S+ 0 0 42 -4,-1.0 3,-1.5 -3,-0.4 4,-0.4 0.867 82.0 61.5 -47.5 -46.1 1.8 19.3 47.6 7 156 A Q T 3< S+ 0 0 85 -4,-0.6 -1,-0.3 1,-0.3 4,-0.2 0.670 108.7 42.1 -58.6 -20.5 0.2 22.6 48.4 8 157 A I T <> S+ 0 0 13 -3,-2.0 4,-2.1 1,-0.1 -1,-0.3 0.380 81.5 97.7-110.6 5.4 3.2 24.5 46.9 9 158 A I H <> S+ 0 0 2 -3,-1.5 4,-2.5 -4,-0.5 5,-0.2 0.927 85.2 51.7 -58.3 -46.0 3.9 22.6 43.7 10 159 A D H > S+ 0 0 80 -4,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.857 110.4 49.8 -58.1 -36.6 1.9 25.1 41.6 11 160 A K H > S+ 0 0 72 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.860 108.2 52.6 -71.4 -36.5 3.9 27.9 43.1 12 161 A I H X S+ 0 0 4 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.947 110.1 48.3 -63.3 -47.1 7.2 26.1 42.4 13 162 A D H X S+ 0 0 28 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.907 114.1 46.1 -59.9 -43.9 6.2 25.7 38.7 14 163 A A H X S+ 0 0 49 -4,-2.0 4,-1.8 1,-0.2 -1,-0.2 0.938 113.6 48.2 -64.7 -48.6 5.2 29.3 38.4 15 164 A A H X S+ 0 0 2 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.856 108.6 56.2 -60.4 -36.4 8.3 30.6 40.2 16 165 A F H X S+ 0 0 9 -4,-2.5 4,-3.0 2,-0.2 5,-0.2 0.926 106.2 48.7 -62.3 -45.7 10.4 28.3 37.9 17 166 A K H X S+ 0 0 109 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.877 111.0 51.9 -62.2 -37.3 9.0 29.9 34.8 18 167 A V H X S+ 0 0 83 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.939 112.9 44.0 -63.6 -47.7 9.7 33.3 36.2 19 168 A A H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.881 112.5 51.3 -65.3 -42.4 13.3 32.4 36.9 20 169 A A H X S+ 0 0 13 -4,-3.0 4,-1.5 1,-0.2 -1,-0.2 0.920 111.7 48.6 -61.0 -43.3 13.8 30.7 33.5 21 170 A T H X S+ 0 0 103 -4,-2.3 4,-0.7 -5,-0.2 -2,-0.2 0.911 109.5 52.7 -63.1 -41.8 12.4 33.9 31.9 22 171 A A H >< S+ 0 0 37 -4,-2.2 3,-0.5 1,-0.2 4,-0.3 0.925 113.8 41.8 -60.0 -46.2 14.8 36.0 34.0 23 172 A A H >< S+ 0 0 0 -4,-2.4 3,-0.8 1,-0.2 -1,-0.2 0.688 95.2 82.8 -76.1 -18.0 17.8 34.1 33.0 24 173 A A H 3< S+ 0 0 63 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.868 100.4 35.0 -54.2 -41.4 16.7 33.8 29.3 25 174 A T T << S+ 0 0 132 -4,-0.7 -1,-0.3 -3,-0.5 -2,-0.2 0.482 96.1 107.2 -94.3 -2.1 18.1 37.3 28.5 26 175 A A S < S- 0 0 12 -3,-0.8 5,-0.2 -4,-0.3 -3,-0.0 -0.476 82.9 -95.5 -77.2 146.3 21.1 37.1 30.8 27 176 A P >> - 0 0 82 0, 0.0 3,-2.3 0, 0.0 4,-0.9 -0.235 41.8-104.5 -56.5 149.7 24.6 36.7 29.3 28 177 A A G >4 S+ 0 0 72 1,-0.3 3,-0.9 2,-0.2 4,-0.4 0.852 121.3 52.1 -43.4 -48.1 25.7 33.0 29.2 29 178 A D G 34 S+ 0 0 156 1,-0.2 -1,-0.3 2,-0.1 4,-0.3 0.648 112.2 46.9 -67.2 -16.3 28.1 33.5 32.2 30 179 A D G <> S+ 0 0 78 -3,-2.3 4,-2.8 1,-0.1 5,-0.3 0.484 84.2 94.3-103.4 -5.6 25.3 35.0 34.3 31 180 A K H S+ 0 0 55 -4,-0.4 4,-2.6 2,-0.2 5,-0.2 0.952 117.2 44.5 -60.9 -47.9 23.1 30.2 36.7 33 182 A T H > S+ 0 0 101 -4,-0.3 4,-2.4 1,-0.2 5,-0.2 0.924 116.8 45.2 -62.4 -45.5 23.4 33.1 39.1 34 183 A V H X S+ 0 0 50 -4,-2.8 4,-2.7 2,-0.2 5,-0.3 0.917 112.3 52.5 -65.2 -42.3 20.5 35.0 37.7 35 184 A F H X S+ 0 0 2 -4,-2.9 4,-3.0 -5,-0.3 -2,-0.2 0.951 112.3 44.3 -58.2 -51.2 18.3 31.9 37.5 36 185 A E H X S+ 0 0 50 -4,-2.6 4,-3.0 -5,-0.2 5,-0.2 0.924 114.0 48.6 -60.4 -47.5 19.0 31.0 41.2 37 186 A A H X S+ 0 0 61 -4,-2.4 4,-2.2 -5,-0.2 -1,-0.2 0.939 116.3 43.8 -58.8 -47.6 18.5 34.6 42.5 38 187 A A H X S+ 0 0 20 -4,-2.7 4,-2.5 -5,-0.2 5,-0.2 0.902 113.6 51.3 -64.5 -42.1 15.2 34.9 40.5 39 188 A F H X S+ 0 0 0 -4,-3.0 4,-2.3 -5,-0.3 5,-0.2 0.942 110.8 48.0 -62.4 -47.3 14.0 31.4 41.5 40 189 A N H X S+ 0 0 37 -4,-3.0 4,-2.6 1,-0.2 -1,-0.2 0.921 113.2 47.3 -60.8 -44.2 14.6 32.1 45.2 41 190 A K H X S+ 0 0 123 -4,-2.2 4,-2.7 -5,-0.2 5,-0.2 0.919 112.1 49.3 -64.3 -43.7 12.8 35.5 45.1 42 191 A A H X S+ 0 0 16 -4,-2.5 4,-2.9 2,-0.2 -1,-0.2 0.884 113.4 47.1 -63.9 -38.6 9.8 34.1 43.2 43 192 A I H X S+ 0 0 0 -4,-2.3 4,-2.5 -5,-0.2 6,-0.3 0.937 112.3 49.1 -67.7 -46.4 9.6 31.2 45.7 44 193 A K H <>S+ 0 0 92 -4,-2.6 5,-2.5 -5,-0.2 6,-0.2 0.918 117.3 42.4 -58.8 -44.3 9.9 33.5 48.7 45 194 A E H ><5S+ 0 0 128 -4,-2.7 3,-1.1 3,-0.2 -2,-0.2 0.934 116.2 45.9 -70.1 -47.4 7.2 35.8 47.2 46 195 A T H 3<5S+ 0 0 48 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.813 113.7 48.0 -68.9 -30.5 4.8 33.1 46.0 47 196 A T T ><5S- 0 0 16 -4,-2.5 3,-1.3 4,-0.2 -1,-0.2 0.312 111.8-116.5 -92.8 10.0 4.9 31.0 49.2 48 197 A G T < 5S- 0 0 72 -3,-1.1 -3,-0.2 1,-0.3 -4,-0.1 0.822 74.6 -50.2 61.5 32.4 4.4 34.1 51.4 49 198 A G T 3 - 0 0 28 -10,-0.1 3,-1.9 1,-0.1 -1,-0.2 -0.993 69.6-124.7-156.7 147.9 15.3 29.4 48.9 54 203 A Y G > S+ 0 0 3 -2,-0.3 3,-1.4 1,-0.3 7,-0.3 0.746 108.3 71.8 -63.4 -23.7 14.5 26.5 46.6 55 204 A K G 3 S+ 0 0 120 1,-0.2 -1,-0.3 5,-0.1 6,-0.0 0.643 93.0 57.2 -66.4 -14.1 17.2 24.6 48.5 56 205 A C G < S+ 0 0 77 -3,-1.9 -1,-0.2 1,-0.1 -2,-0.2 0.439 83.6 84.2 -98.5 -3.1 14.8 24.4 51.4 57 206 A I S <> S- 0 0 0 -3,-1.4 4,-2.9 -4,-0.2 3,-0.4 -0.907 76.8-145.7-100.2 106.2 11.9 22.7 49.6 58 207 A P H > S+ 0 0 81 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.845 91.9 41.2 -36.7 -64.1 13.0 19.0 49.9 59 208 A S H > S+ 0 0 29 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.851 117.8 48.7 -60.4 -36.4 11.6 17.6 46.6 60 209 A L H > S+ 0 0 0 -3,-0.4 4,-3.2 2,-0.2 5,-0.2 0.914 108.3 51.7 -70.8 -44.7 12.8 20.7 44.7 61 210 A E H X S+ 0 0 36 -4,-2.9 4,-2.4 -7,-0.3 -2,-0.2 0.884 110.3 52.2 -58.6 -37.2 16.3 20.7 46.1 62 211 A A H X S+ 0 0 53 -4,-1.9 4,-2.0 -5,-0.3 -1,-0.2 0.910 111.1 45.5 -64.9 -44.3 16.5 17.0 45.1 63 212 A A H X S+ 0 0 11 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.902 111.9 51.5 -66.8 -42.4 15.4 17.9 41.5 64 213 A V H X S+ 0 0 3 -4,-3.2 4,-2.3 2,-0.2 -2,-0.2 0.920 109.4 50.6 -61.6 -43.1 17.9 20.8 41.3 65 214 A K H X S+ 0 0 133 -4,-2.4 4,-2.3 -5,-0.2 -1,-0.2 0.924 112.6 46.2 -60.0 -44.9 20.7 18.5 42.5 66 215 A Q H X S+ 0 0 85 -4,-2.0 4,-1.3 2,-0.2 -1,-0.2 0.863 110.2 53.5 -65.9 -36.7 19.8 15.9 39.8 67 216 A A H < S+ 0 0 2 -4,-2.5 4,-0.3 1,-0.2 -1,-0.2 0.902 110.7 47.2 -65.3 -39.4 19.5 18.6 37.2 68 217 A Y H >X S+ 0 0 67 -4,-2.3 3,-1.9 1,-0.2 4,-0.6 0.901 106.3 57.3 -67.0 -41.9 23.0 19.8 38.1 69 218 A A H >< S+ 0 0 66 -4,-2.3 3,-0.7 1,-0.3 4,-0.4 0.809 99.3 61.6 -58.6 -29.2 24.4 16.3 38.0 70 219 A A T 3< S+ 0 0 50 -4,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.671 99.5 56.6 -71.5 -16.1 23.2 16.1 34.4 71 220 A T T X4 S+ 0 0 13 -3,-1.9 3,-0.9 -4,-0.3 -1,-0.2 0.631 78.8 89.6 -90.5 -16.1 25.5 19.0 33.6 72 221 A V T << S+ 0 0 110 -3,-0.7 -1,-0.2 -4,-0.6 -2,-0.1 0.897 96.4 37.0 -48.2 -49.0 28.8 17.4 34.7 73 222 A A T 3 S+ 0 0 104 -4,-0.4 -1,-0.3 -3,-0.2 2,-0.2 0.595 99.6 99.8 -81.2 -12.0 29.5 15.7 31.3 74 223 A A S < S- 0 0 20 -3,-0.9 5,-0.1 -4,-0.2 -3,-0.0 -0.499 82.9-104.3 -78.4 144.8 28.1 18.7 29.3 75 224 A A >> - 0 0 58 -2,-0.2 3,-1.6 1,-0.1 4,-0.6 -0.303 34.3-108.8 -64.0 149.3 30.4 21.3 27.8 76 225 A P G >4 S+ 0 0 107 0, 0.0 3,-1.4 0, 0.0 4,-0.5 0.873 115.5 61.0 -45.3 -49.7 30.6 24.6 29.7 77 226 A Q G 34 S+ 0 0 183 1,-0.3 4,-0.2 2,-0.1 3,-0.1 0.776 116.6 31.3 -51.8 -31.7 28.8 26.5 26.9 78 227 A V G <> S+ 0 0 53 -3,-1.6 4,-2.7 1,-0.1 -1,-0.3 0.284 83.0 105.5-114.9 11.2 25.7 24.3 27.4 79 228 A K H S+ 0 0 23 -4,-0.5 4,-3.1 2,-0.2 5,-0.2 0.922 111.6 51.7 -67.2 -41.7 22.9 25.8 31.8 81 230 A A H > S+ 0 0 53 1,-0.2 4,-1.9 -4,-0.2 -2,-0.2 0.908 113.0 45.7 -59.7 -41.5 20.9 24.6 28.8 82 231 A V H X S+ 0 0 47 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.922 113.2 50.5 -66.5 -43.6 21.3 21.1 30.0 83 232 A F H X S+ 0 0 0 -4,-2.5 4,-3.0 -5,-0.3 5,-0.3 0.932 111.0 47.6 -59.0 -50.2 20.4 22.1 33.5 84 233 A E H X S+ 0 0 66 -4,-3.1 4,-2.5 1,-0.2 -1,-0.2 0.886 111.5 49.9 -61.8 -41.5 17.2 23.9 32.5 85 234 A A H X S+ 0 0 56 -4,-1.9 4,-1.7 -5,-0.2 -1,-0.2 0.936 114.3 45.3 -63.8 -45.8 16.0 21.1 30.3 86 235 A A H X S+ 0 0 30 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.951 115.9 45.0 -62.1 -51.0 16.5 18.6 33.0 87 236 A L H X S+ 0 0 0 -4,-3.0 4,-2.8 1,-0.2 5,-0.3 0.871 107.3 59.5 -63.7 -36.3 14.9 20.7 35.7 88 237 A T H X S+ 0 0 51 -4,-2.5 4,-2.3 -5,-0.3 -1,-0.2 0.926 108.3 44.6 -58.9 -44.6 12.0 21.6 33.5 89 238 A K H X S+ 0 0 158 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.913 112.7 51.9 -65.8 -43.4 11.0 18.0 33.1 90 239 A A H X S+ 0 0 32 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.934 113.4 43.0 -59.1 -49.3 11.5 17.3 36.8 91 240 A I H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 -1,-0.2 0.910 111.5 54.0 -66.6 -41.0 9.2 20.2 37.9 92 241 A T H X S+ 0 0 54 -4,-2.3 4,-2.2 -5,-0.3 -1,-0.2 0.866 106.7 53.5 -60.5 -34.5 6.6 19.4 35.2 93 242 A A H X S+ 0 0 44 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.903 109.0 48.2 -66.2 -40.2 6.5 15.8 36.6 94 243 A M H X S+ 0 0 21 -4,-1.7 4,-2.6 1,-0.2 -2,-0.2 0.917 110.5 51.8 -63.9 -44.6 5.8 17.2 40.1 95 244 A S H X S+ 0 0 12 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.885 107.6 51.9 -60.3 -40.9 3.1 19.5 38.7 96 245 A E H X S+ 0 0 118 -4,-2.2 4,-1.4 2,-0.2 -1,-0.2 0.915 111.6 46.6 -62.9 -43.3 1.4 16.6 36.9 97 246 A V H X S+ 0 0 61 -4,-1.9 4,-1.7 1,-0.2 -2,-0.2 0.911 111.7 51.4 -64.6 -42.8 1.3 14.6 40.2 98 247 A Q H X S+ 0 0 18 -4,-2.6 4,-1.4 1,-0.2 -2,-0.2 0.897 107.2 53.3 -62.5 -40.2 0.1 17.6 42.1 99 248 A K H < S+ 0 0 139 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.827 114.9 39.8 -65.8 -32.1 -2.8 18.2 39.6 100 249 A V H < S+ 0 0 118 -4,-1.4 -1,-0.2 -3,-0.2 -2,-0.2 0.673 113.9 54.8 -90.0 -18.3 -4.0 14.6 39.9 101 250 A S H < 0 0 70 -4,-1.7 -2,-0.2 1,-0.2 -3,-0.2 0.672 360.0 360.0 -86.5 -20.2 -3.5 14.4 43.7 102 251 A Q < 0 0 126 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.1 -0.517 360.0 360.0-142.2 360.0 -5.5 17.5 44.3