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ID	1776	NAME	Thaumatin-like protein_2   Blast NCBI-PROT
LENGTH	30	DISULFIDE BRIDGE			View PDB REMARK YASARA ************************************************************* REMARK YASARA * * REMARK YASARA * Y A S A R A * REMARK YASARA * * REMARK YASARA * Yet Another Scientific Artificial Reality Application * REMARK YASARA * * REMARK YASARA * MOLECULE STRUCTURE FILE, PDB FORMAT * REMARK YASARA * * REMARK YASARA * Just use YASARA every day to make your questions go away! * REMARK YASARA * * REMARK YASARA * www.YASARA.org * REMARK YASARA * * REMARK YASARA ************************************************************* REMARK YASARA REMARK YASARA Original filename: C:\Users\federica\Favorites\Dropbox\lab13\Lucia\pdb_yadamp\pdb_HM_final\ANFEIVNNCPYTVWAAASPGGGRRLDRGQT.pdb REMARK YASARA Written on: Wed May 14 14:36:39 2014 REMARK YASARA Number of models: 1 REMARK YASARA Number of atoms: 442 REMARK YASARA Please address questions or suggestions to: Eliza@yasara.org REMARK YASARA REMARK 2 RESOLUTION. 2.50 ANGSTROMS. REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 31.44750 REMARK 290 SMTRY1 3 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 47.17125 REMARK 290 SMTRY1 4 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY2 4 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 15.72375 COMPND MOL_ID: 1; COMPND 2 MOLECULE: PROTEIN NP24; COMPND 3 CHAIN: A; COMPND 4 MOL_ID: 2; COMPND 5 MOLECULE: `NOTE:` This template has been downloaded from PDB_REDO (www.cmbi.ru.nl/pdb_redo), since re-refinement improved the structure quality Z-score by 0.257.; SEQRES 1 A 30 ALA ASN PHE GLU ILE VAL ASN ASN CYS PRO TYR THR VAL SEQRES 2 A 30 TRP ALA ALA ALA SER PRO GLY GLY GLY ARG ARG LEU ASP SEQRES 3 A 30 ARG GLY GLN THR CRYST1 61.010 61.010 62.895 90.00 90.00 90.00 P 43 4 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.016391 0.000000 0.000000 0.00000 SCALE2 0.000000 0.016391 0.000000 0.00000 SCALE3 0.000000 0.000000 0.015900 0.00000 ATOM 1 N ALA A 1 -12.270 8.303 26.839 1.00-31.44 N ATOM 2 1H ALA A 1 -12.080 7.420 26.392 1.00-31.44 H ATOM 3 2H ALA A 1 -13.027 8.771 26.358 1.00-31.44 H ATOM 4 3H ALA A 1 -12.544 8.147 27.801 1.00-31.44 H ATOM 5 CA ALA A 1 -11.057 9.166 26.800 1.00-31.44 C ATOM 6 HA ALA A 1 -10.244 8.623 27.280 1.00-31.44 H ATOM 7 C ALA A 1 -11.305 10.428 27.619 1.00-31.44 C ATOM 8 O ALA A 1 -11.718 10.315 28.767 1.00-31.44 O ATOM 9 CB ALA A 1 -10.633 9.486 25.333 1.00-31.44 C ATOM 10 1HB ALA A 1 -10.475 8.556 24.785 1.00-31.44 H ATOM 11 2HB ALA A 1 -9.697 10.051 25.330 1.00-31.44 H ATOM 12 3HB ALA A 1 -11.411 10.065 24.829 1.00-31.44 H ATOM 13 N ASN A 2 -11.043 11.612 27.086 1.00 0.65 N ATOM 14 H ASN A 2 -10.721 11.692 26.135 1.00 0.65 H ATOM 15 CA ASN A 2 -11.174 12.837 27.870 1.00 0.65 C ATOM 16 HA ASN A 2 -10.878 12.631 28.899 1.00 0.65 H ATOM 17 C ASN A 2 -12.610 13.344 27.870 1.00 0.65 C ATOM 18 O ASN A 2 -13.255 13.440 26.829 1.00 0.65 O ATOM 19 CB ASN A 2 -10.267 13.945 27.317 1.00 0.65 C ATOM 20 1HB ASN A 2 -10.507 14.124 26.270 1.00 0.65 H ATOM 21 2HB ASN A 2 -10.459 14.864 27.872 1.00 0.65 H ATOM 22 CG ASN A 2 -8.796 13.619 27.431 1.00 0.65 C ATOM 23 OD1 ASN A 2 -8.326 12.625 26.887 1.00 0.65 O ATOM 24 ND2 ASN A 2 -8.064 14.430 28.134 1.00 0.65 N ATOM 25 1HD2 ASN A 2 -7.084 14.251 28.225 1.00 0.65 H ATOM 26 2HD2 ASN A 2 -8.487 15.248 28.594 1.00 0.65 H ATOM 27 N PHE A 3 -13.073 13.720 29.048 1.00 -8.48 N ATOM 28 H PHE A 3 -12.563 13.481 29.891 1.00 -8.48 H ATOM 29 CA PHE A 3 -14.215 14.599 29.248 1.00 -8.48 C ATOM 30 HA PHE A 3 -14.241 15.402 28.512 1.00 -8.48 H ATOM 31 C PHE A 3 -13.822 15.113 30.615 1.00 -8.48 C ATOM 32 O PHE A 3 -13.336 14.305 31.406 1.00 -8.48 O ATOM 33 CB PHE A 3 -15.541 13.846 29.311 1.00 -8.48 C ATOM 34 1HB PHE A 3 -15.756 13.440 28.324 1.00 -8.48 H ATOM 35 2HB PHE A 3 -15.446 13.020 30.014 1.00 -8.48 H ATOM 36 CG PHE A 3 -16.689 14.708 29.740 1.00 -8.48 C ATOM 37 CD1 PHE A 3 -17.179 15.714 28.888 1.00 -8.48 C ATOM 38 HD1 PHE A 3 -16.729 15.867 27.917 1.00 -8.48 H ATOM 39 CD2 PHE A 3 -17.277 14.531 31.005 1.00 -8.48 C ATOM 40 HD2 PHE A 3 -16.895 13.775 31.678 1.00 -8.48 H ATOM 41 CE1 PHE A 3 -18.259 16.538 29.289 1.00 -8.48 C ATOM 42 HE1 PHE A 3 -18.624 17.315 28.632 1.00 -8.48 H ATOM 43 CE2 PHE A 3 -18.364 15.337 31.414 1.00 -8.48 C ATOM 44 HE2 PHE A 3 -18.810 15.193 32.386 1.00 -8.48 H ATOM 45 CZ PHE A 3 -18.858 16.342 30.552 1.00 -8.48 C ATOM 46 HZ PHE A 3 -19.687 16.962 30.861 1.00 -8.48 H ATOM 47 N GLU A 4 -13.909 16.409 30.863 1.00 5.60 N ATOM 48 H GLU A 4 -14.364 17.039 30.220 1.00 5.60 H ATOM 49 CA GLU A 4 -13.292 17.008 32.042 1.00 5.60 C ATOM 50 HA GLU A 4 -13.131 16.255 32.811 1.00 5.60 H ATOM 51 C GLU A 4 -14.219 18.078 32.596 1.00 5.60 C ATOM 52 O GLU A 4 -14.841 18.815 31.828 1.00 5.60 O ATOM 53 CB GLU A 4 -11.948 17.637 31.648 1.00 5.60 C ATOM 54 1HB GLU A 4 -12.110 18.240 30.755 1.00 5.60 H ATOM 55 2HB GLU A 4 -11.614 18.294 32.451 1.00 5.60 H ATOM 56 CG GLU A 4 -10.845 16.616 31.360 1.00 5.60 C ATOM 57 1HG GLU A 4 -10.491 16.195 32.302 1.00 5.60 H ATOM 58 2HG GLU A 4 -11.254 15.807 30.758 1.00 5.60 H ATOM 59 CD GLU A 4 -9.680 17.204 30.587 1.00 5.60 C ATOM 60 OE1 GLU A 4 -9.130 18.254 30.975 1.00 5.60 O ATOM 61 OE2 GLU A 4 -9.320 16.589 29.552 1.00 5.60 O ATOM 62 N ILE A 5 -14.324 18.137 33.916 1.00 3.58 N ATOM 63 H ILE A 5 -13.775 17.483 34.488 1.00 3.58 H ATOM 64 CA ILE A 5 -15.093 19.152 34.638 1.00 3.58 C ATOM 65 HA ILE A 5 -15.121 20.084 34.075 1.00 3.58 H ATOM 66 C ILE A 5 -14.269 19.299 35.909 1.00 3.58 C ATOM 67 O ILE A 5 -14.054 18.306 36.590 1.00 3.58 O ATOM 68 CB ILE A 5 -16.538 18.703 35.056 1.00 3.58 C ATOM 69 HB ILE A 5 -16.453 17.793 35.646 1.00 3.58 H ATOM 70 CG1 ILE A 5 -17.409 18.391 33.821 1.00 3.58 C ATOM 71 1HG1 ILE A 5 -17.526 19.307 33.242 1.00 3.58 H ATOM 72 2HG1 ILE A 5 -16.885 17.666 33.201 1.00 3.58 H ATOM 73 CG2 ILE A 5 -17.214 19.797 35.939 1.00 3.58 C ATOM 74 1HG2 ILE A 5 -18.183 19.450 36.294 1.00 3.58 H ATOM 75 2HG2 ILE A 5 -17.346 20.716 35.367 1.00 3.58 H ATOM 76 3HG2 ILE A 5 -16.603 20.003 36.820 1.00 3.58 H ATOM 77 CD1 ILE A 5 -18.810 17.819 34.114 1.00 3.58 C ATOM 78 1HD1 ILE A 5 -19.295 17.561 33.175 1.00 3.58 H ATOM 79 2HD1 ILE A 5 -19.424 18.560 34.626 1.00 3.58 H ATOM 80 3HD1 ILE A 5 -18.727 16.925 34.730 1.00 3.58 H ATOM 81 N VAL A 6 -13.818 20.498 36.253 1.00 2.40 N ATOM 82 H VAL A 6 -14.015 21.301 35.684 1.00 2.40 H ATOM 83 CA VAL A 6 -13.049 20.660 37.487 1.00 2.40 C ATOM 84 HA VAL A 6 -12.294 19.878 37.516 1.00 2.40 H ATOM 85 C VAL A 6 -13.995 20.462 38.668 1.00 2.40 C ATOM 86 O VAL A 6 -14.914 21.261 38.889 1.00 2.40 O ATOM 87 CB VAL A 6 -12.340 22.036 37.591 1.00 2.40 C ATOM 88 HB VAL A 6 -13.093 22.824 37.599 1.00 2.40 H ATOM 89 CG1 VAL A 6 -11.506 22.133 38.882 1.00 2.40 C ATOM 90 1HG1 VAL A 6 -10.984 23.088 38.920 1.00 2.40 H ATOM 91 2HG1 VAL A 6 -10.773 21.323 38.920 1.00 2.40 H ATOM 92 3HG1 VAL A 6 -12.154 22.064 39.757 1.00 2.40 H ATOM 93 CG2 VAL A 6 -11.422 22.262 36.381 1.00 2.40 C ATOM 94 1HG2 VAL A 6 -10.921 23.226 36.472 1.00 2.40 H ATOM 95 2HG2 VAL A 6 -11.996 22.258 35.456 1.00 2.40 H ATOM 96 3HG2 VAL A 6 -10.670 21.475 36.338 1.00 2.40 H ATOM 97 N ASN A 7 -13.801 19.387 39.415 1.00 4.99 N ATOM 98 H ASN A 7 -13.048 18.740 39.172 1.00 4.99 H ATOM 99 CA ASN A 7 -14.654 19.116 40.562 1.00 4.99 C ATOM 100 HA ASN A 7 -15.662 19.460 40.336 1.00 4.99 H ATOM 101 C ASN A 7 -14.174 19.860 41.801 1.00 4.99 C ATOM 102 O ASN A 7 -13.190 19.491 42.438 1.00 4.99 O ATOM 103 CB ASN A 7 -14.723 17.632 40.890 1.00 4.99 C ATOM 104 1HB ASN A 7 -15.114 17.087 40.034 1.00 4.99 H ATOM 105 2HB ASN A 7 -13.720 17.277 41.104 1.00 4.99 H ATOM 106 CG ASN A 7 -15.587 17.378 42.091 1.00 4.99 C ATOM 107 OD1 ASN A 7 -16.488 18.152 42.375 1.00 4.99 O ATOM 108 ND2 ASN A 7 -15.295 16.359 42.833 1.00 4.99 N ATOM 109 1HD2 ASN A 7 -15.802 16.209 43.696 1.00 4.99 H ATOM 110 2HD2 ASN A 7 -14.585 15.716 42.518 1.00 4.99 H ATOM 111 N ASN A 8 -14.922 20.890 42.165 1.00-13.11 N ATOM 112 H ASN A 8 -15.728 21.120 41.604 1.00-13.11 H ATOM 113 CA ASN A 8 -14.613 21.704 43.337 1.00-13.11 C ATOM 114 HA ASN A 8 -13.569 21.553 43.617 1.00-13.11 H ATOM 115 C ASN A 8 -15.478 21.320 44.539 1.00-13.11 C ATOM 116 O ASN A 8 -15.446 21.979 45.575 1.00-13.11 O ATOM 117 CB ASN A 8 -14.809 23.183 42.986 1.00-13.11 C ATOM 118 1HB ASN A 8 -15.830 23.334 42.643 1.00-13.11 H ATOM 119 2HB ASN A 8 -14.647 23.789 43.877 1.00-13.11 H ATOM 120 CG ASN A 8 -13.852 23.652 41.921 1.00-13.11 C ATOM 121 OD1 ASN A 8 -12.648 23.593 42.079 1.00-13.11 O ATOM 122 ND2 ASN A 8 -14.378 24.114 40.819 1.00-13.11 N ATOM 123 1HD2 ASN A 8 -13.756 24.422 40.093 1.00-13.11 H ATOM 124 2HD2 ASN A 8 -15.373 24.140 40.700 1.00-13.11 H ATOM 125 N CYS A 9 -16.283 20.275 44.412 1.00 -7.04 N ATOM 126 H CYS A 9 -16.293 19.726 43.557 1.00 -7.04 H ATOM 127 CA CYS A 9 -17.122 19.839 45.523 1.00 -7.04 C ATOM 128 HA CYS A 9 -17.551 20.715 46.007 1.00 -7.04 H ATOM 129 C CYS A 9 -16.261 19.061 46.524 1.00 -7.04 C ATOM 130 O CYS A 9 -15.297 18.407 46.130 1.00 -7.04 O ATOM 131 CB CYS A 9 -18.246 18.941 44.998 1.00 -7.04 C ATOM 132 1HB CYS A 9 -17.803 18.067 44.516 1.00 -7.04 H ATOM 133 2HB CYS A 9 -18.845 18.596 45.839 1.00 -7.04 H ATOM 134 SG CYS A 9 -19.329 19.778 43.811 1.00 -7.04 S ATOM 135 HG CYS A 9 -19.780 20.718 44.648 1.00 -7.04 H ATOM 136 N PRO A 10 -16.617 19.065 47.823 1.00 2.59 N ATOM 137 CA PRO A 10 -15.819 18.308 48.800 1.00 2.59 C ATOM 138 HA PRO A 10 -14.756 18.482 48.629 1.00 2.59 H ATOM 139 C PRO A 10 -16.081 16.795 48.810 1.00 2.59 C ATOM 140 O PRO A 10 -15.771 16.098 49.783 1.00 2.59 O ATOM 141 CB PRO A 10 -16.235 18.957 50.123 1.00 2.59 C ATOM 142 1HB PRO A 10 -16.100 18.281 50.967 1.00 2.59 H ATOM 143 2HB PRO A 10 -15.673 19.877 50.284 1.00 2.59 H ATOM 144 CG PRO A 10 -17.662 19.264 49.916 1.00 2.59 C ATOM 145 1HG PRO A 10 -18.255 18.357 50.028 1.00 2.59 H ATOM 146 2HG PRO A 10 -18.001 20.028 50.615 1.00 2.59 H ATOM 147 CD PRO A 10 -17.730 19.768 48.494 1.00 2.59 C ATOM 148 1HD PRO A 10 -18.689 19.512 48.044 1.00 2.59 H ATOM 149 2HD PRO A 10 -17.563 20.846 48.466 1.00 2.59 H ATOM 150 N TYR A 11 -16.636 16.265 47.731 1.00-14.79 N ATOM 151 H TYR A 11 -16.783 16.838 46.909 1.00-14.79 H ATOM 152 CA TYR A 11 -16.982 14.856 47.607 1.00-14.79 C ATOM 153 HA TYR A 11 -16.338 14.256 48.240 1.00-14.79 H ATOM 154 C TYR A 11 -16.721 14.473 46.158 1.00-14.79 C ATOM 155 O TYR A 11 -16.586 15.343 45.303 1.00-14.79 O ATOM 156 CB TYR A 11 -18.444 14.613 48.001 1.00-14.79 C ATOM 157 1HB TYR A 11 -18.723 13.595 47.731 1.00-14.79 H ATOM 158 2HB TYR A 11 -18.525 14.711 49.084 1.00-14.79 H ATOM 159 CG TYR A 11 -19.430 15.579 47.375 1.00-14.79 C ATOM 160 CD1 TYR A 11 -19.911 15.388 46.063 1.00-14.79 C ATOM 161 HD1 TYR A 11 -19.576 14.540 45.481 1.00-14.79 H ATOM 162 CD2 TYR A 11 -19.911 16.684 48.109 1.00-14.79 C ATOM 163 HD2 TYR A 11 -19.579 16.836 49.126 1.00-14.79 H ATOM 164 CE1 TYR A 11 -20.848 16.293 45.492 1.00-14.79 C ATOM 165 HE1 TYR A 11 -21.214 16.134 44.491 1.00-14.79 H ATOM 166 CE2 TYR A 11 -20.839 17.594 47.537 1.00-14.79 C ATOM 167 HE2 TYR A 11 -21.200 18.438 48.104 1.00-14.79 H ATOM 168 CZ TYR A 11 -21.293 17.390 46.233 1.00-14.79 C ATOM 169 OH TYR A 11 -22.173 18.282 45.679 1.00-14.79 O ATOM 170 HH TYR A 11 -22.408 18.056 44.778 1.00-14.79 H ATOM 171 N THR A 12 -16.612 13.179 45.905 1.00 -4.14 N ATOM 172 H THR A 12 -16.722 12.511 46.648 1.00 -4.14 H ATOM 173 CA THR A 12 -16.380 12.653 44.565 1.00 -4.14 C ATOM 174 HA THR A 12 -15.562 13.191 44.090 1.00 -4.14 H ATOM 175 C THR A 12 -17.658 12.811 43.748 1.00 -4.14 C ATOM 176 O THR A 12 -18.741 12.505 44.243 1.00 -4.14 O ATOM 177 CB THR A 12 -16.044 11.152 44.675 1.00 -4.14 C ATOM 178 HB THR A 12 -16.925 10.621 45.035 1.00 -4.14 H ATOM 179 OG1 THR A 12 -14.992 10.978 45.631 1.00 -4.14 O ATOM 180 HG1 THR A 12 -14.203 11.451 45.318 1.00 -4.14 H ATOM 181 CG2 THR A 12 -15.604 10.539 43.362 1.00 -4.14 C ATOM 182 1HG2 THR A 12 -15.370 9.489 43.522 1.00 -4.14 H ATOM 183 2HG2 THR A 12 -14.724 11.051 42.982 1.00 -4.14 H ATOM 184 3HG2 THR A 12 -16.409 10.609 42.627 1.00 -4.14 H ATOM 185 N VAL A 13 -17.533 13.265 42.512 1.00 -6.63 N ATOM 186 H VAL A 13 -16.610 13.488 42.141 1.00 -6.63 H ATOM 187 CA VAL A 13 -18.656 13.443 41.598 1.00 -6.63 C ATOM 188 HA VAL A 13 -19.595 13.198 42.090 1.00 -6.63 H ATOM 189 C VAL A 13 -18.379 12.413 40.502 1.00 -6.63 C ATOM 190 O VAL A 13 -17.257 11.912 40.389 1.00 -6.63 O ATOM 191 CB VAL A 13 -18.703 14.933 41.111 1.00 -6.63 C ATOM 192 HB VAL A 13 -17.748 15.183 40.652 1.00 -6.63 H ATOM 193 CG1 VAL A 13 -19.825 15.205 40.091 1.00 -6.63 C ATOM 194 1HG1 VAL A 13 -19.842 16.266 39.840 1.00 -6.63 H ATOM 195 2HG1 VAL A 13 -20.794 14.920 40.504 1.00 -6.63 H ATOM 196 3HG1 VAL A 13 -19.641 14.648 39.174 1.00 -6.63 H ATOM 197 CG2 VAL A 13 -18.921 15.863 42.314 1.00 -6.63 C ATOM 198 1HG2 VAL A 13 -18.950 16.902 41.980 1.00 -6.63 H ATOM 199 2HG2 VAL A 13 -18.100 15.766 43.022 1.00 -6.63 H ATOM 200 3HG2 VAL A 13 -19.856 15.618 42.813 1.00 -6.63 H ATOM 201 N TRP A 14 -19.382 12.049 39.721 1.00-17.07 N ATOM 202 H TRP A 14 -20.298 12.458 39.846 1.00-17.07 H ATOM 203 CA TRP A 14 -19.221 11.126 38.606 1.00-17.07 C ATOM 204 HA TRP A 14 -18.172 11.011 38.340 1.00-17.07 H ATOM 205 C TRP A 14 -19.979 11.783 37.466 1.00-17.07 C ATOM 206 O TRP A 14 -20.917 12.535 37.731 1.00-17.07 O ATOM 207 CB TRP A 14 -19.831 9.765 38.944 1.00-17.07 C ATOM 208 1HB TRP A 14 -20.866 9.915 39.251 1.00-17.07 H ATOM 209 2HB TRP A 14 -19.821 9.140 38.051 1.00-17.07 H ATOM 210 CG TRP A 14 -19.097 9.048 40.045 1.00-17.07 C ATOM 211 CD1 TRP A 14 -19.250 9.222 41.386 1.00-17.07 C ATOM 212 HD1 TRP A 14 -19.939 9.931 41.829 1.00-17.07 H ATOM 213 CD2 TRP A 14 -18.100 8.019 39.905 1.00-17.07 C ATOM 214 NE1 TRP A 14 -18.429 8.394 42.098 1.00-17.07 N ATOM 215 HE1 TRP A 14 -18.395 8.362 43.106 1.00-17.07 H ATOM 216 CE2 TRP A 14 -17.706 7.634 41.220 1.00-17.07 C ATOM 217 CE3 TRP A 14 -17.525 7.353 38.803 1.00-17.07 C ATOM 218 HE3 TRP A 14 -17.815 7.618 37.797 1.00-17.07 H ATOM 219 CZ2 TRP A 14 -16.766 6.608 41.456 1.00-17.07 C ATOM 220 HZ2 TRP A 14 -16.508 6.322 42.463 1.00-17.07 H ATOM 221 CZ3 TRP A 14 -16.575 6.323 39.035 1.00-17.07 C ATOM 222 HZ3 TRP A 14 -16.133 5.803 38.196 1.00-17.07 H ATOM 223 CH2 TRP A 14 -16.208 5.964 40.365 1.00-17.07 C ATOM 224 HH2 TRP A 14 -15.496 5.166 40.520 1.00-17.07 H ATOM 225 N ALA A 15 -19.595 11.512 36.230 1.00 11.34 N ATOM 226 H ALA A 15 -18.809 10.885 36.070 1.00 11.34 H ATOM 227 CA ALA A 15 -20.279 12.047 35.057 1.00 11.34 C ATOM 228 HA ALA A 15 -21.349 12.142 35.252 1.00 11.34 H ATOM 229 C ALA A 15 -20.050 11.033 33.945 1.00 11.34 C ATOM 230 O ALA A 15 -19.227 10.135 34.108 1.00 11.34 O ATOM 231 CB ALA A 15 -19.694 13.415 34.675 1.00 11.34 C ATOM 232 1HB ALA A 15 -19.846 14.115 35.499 1.00 11.34 H ATOM 233 2HB ALA A 15 -20.197 13.802 33.789 1.00 11.34 H ATOM 234 3HB ALA A 15 -18.626 13.319 34.475 1.00 11.34 H ATOM 235 N ALA A 16 -20.718 11.196 32.814 1.00 -4.37 N ATOM 236 H ALA A 16 -21.396 11.941 32.715 1.00 -4.37 H ATOM 237 CA ALA A 16 -20.458 10.384 31.634 1.00 -4.37 C ATOM 238 HA ALA A 16 -19.412 10.083 31.617 1.00 -4.37 H ATOM 239 C ALA A 16 -20.747 11.291 30.445 1.00 -4.37 C ATOM 240 O ALA A 16 -21.657 12.115 30.528 1.00 -4.37 O ATOM 241 CB ALA A 16 -21.371 9.148 31.619 1.00 -4.37 C ATOM 242 1HB ALA A 16 -21.194 8.550 32.514 1.00 -4.37 H ATOM 243 2HB ALA A 16 -21.154 8.545 30.737 1.00 -4.37 H ATOM 244 3HB ALA A 16 -22.417 9.460 31.594 1.00 -4.37 H ATOM 245 N ALA A 17 -20.001 11.135 29.363 1.00 23.19 N ATOM 246 H ALA A 17 -19.239 10.462 29.370 1.00 23.19 H ATOM 247 CA ALA A 17 -20.250 11.860 28.120 1.00 23.19 C ATOM 248 HA ALA A 17 -21.323 11.935 27.938 1.00 23.19 H ATOM 249 C ALA A 17 -19.586 11.019 27.038 1.00 23.19 C ATOM 250 O ALA A 17 -18.644 10.294 27.344 1.00 23.19 O ATOM 251 CB ALA A 17 -19.624 13.254 28.173 1.00 23.19 C ATOM 252 1HB ALA A 17 -20.047 13.813 29.010 1.00 23.19 H ATOM 253 2HB ALA A 17 -19.833 13.793 27.249 1.00 23.19 H ATOM 254 3HB ALA A 17 -18.548 13.168 28.309 1.00 23.19 H ATOM 255 N SER A 18 -20.011 11.137 25.790 1.00 8.46 N ATOM 256 H SER A 18 -20.767 11.765 25.558 1.00 8.46 H ATOM 257 CA SER A 18 -19.441 10.334 24.707 1.00 8.46 C ATOM 258 HA SER A 18 -19.713 9.299 24.915 1.00 8.46 H ATOM 259 C SER A 18 -17.914 10.348 24.523 1.00 8.46 C ATOM 260 O SER A 18 -17.332 9.277 24.369 1.00 8.46 O ATOM 261 CB SER A 18 -20.125 10.738 23.403 1.00 8.46 C ATOM 262 1HB SER A 18 -19.644 11.628 22.998 1.00 8.46 H ATOM 263 2HB SER A 18 -20.048 9.924 22.681 1.00 8.46 H ATOM 264 OG SER A 18 -21.487 11.037 23.673 1.00 8.46 O ATOM 265 HG SER A 18 -21.967 11.071 22.839 1.00 8.46 H ATOM 266 N PRO A 19 -17.234 11.518 24.568 1.00 -2.36 N ATOM 267 CA PRO A 19 -15.781 11.343 24.418 1.00 -2.36 C ATOM 268 HA PRO A 19 -15.560 10.697 23.567 1.00 -2.36 H ATOM 269 C PRO A 19 -15.072 10.791 25.660 1.00 -2.36 C ATOM 270 O PRO A 19 -13.943 10.306 25.574 1.00 -2.36 O ATOM 271 CB PRO A 19 -15.306 12.763 24.107 1.00 -2.36 C ATOM 272 1HB PRO A 19 -14.275 12.910 24.425 1.00 -2.36 H ATOM 273 2HB PRO A 19 -15.407 12.967 23.041 1.00 -2.36 H ATOM 274 CG PRO A 19 -16.234 13.621 24.877 1.00 -2.36 C ATOM 275 1HG PRO A 19 -15.952 13.626 25.930 1.00 -2.36 H ATOM 276 2HG PRO A 19 -16.246 14.636 24.481 1.00 -2.36 H ATOM 277 CD PRO A 19 -17.574 12.952 24.692 1.00 -2.36 C ATOM 278 1HD PRO A 19 -18.210 13.136 25.556 1.00 -2.36 H ATOM 279 2HD PRO A 19 -18.052 13.305 23.777 1.00 -2.36 H ATOM 280 N GLY A 20 -15.724 10.842 26.814 1.00 14.67 N ATOM 281 H GLY A 20 -16.667 11.200 26.847 1.00 14.67 H ATOM 282 CA GLY A 20 -15.104 10.388 28.046 1.00 14.67 C ATOM 283 1HA GLY A 20 -14.035 10.572 28.001 1.00 14.67 H ATOM 284 2HA GLY A 20 -15.512 10.963 28.875 1.00 14.67 H ATOM 285 C GLY A 20 -15.347 8.925 28.338 1.00 14.67 C ATOM 286 O GLY A 20 -14.451 8.213 28.787 1.00 14.67 O ATOM 287 N GLY A 21 -16.565 8.476 28.080 1.00 1.62 N ATOM 288 H GLY A 21 -17.238 9.073 27.608 1.00 1.62 H ATOM 289 CA GLY A 21 -17.053 7.246 28.675 1.00 1.62 C ATOM 290 1HA GLY A 21 -17.866 6.828 28.083 1.00 1.62 H ATOM 291 2HA GLY A 21 -16.245 6.522 28.778 1.00 1.62 H ATOM 292 C GLY A 21 -17.564 7.663 30.041 1.00 1.62 C ATOM 293 O GLY A 21 -17.780 8.858 30.270 1.00 1.62 O ATOM 294 N GLY A 22 -17.749 6.720 30.953 1.00 12.96 N ATOM 295 H GLY A 22 -17.565 5.755 30.734 1.00 12.96 H ATOM 296 CA GLY A 22 -18.119 7.072 32.315 1.00 12.96 C ATOM 297 1HA GLY A 22 -18.839 7.887 32.315 1.00 12.96 H ATOM 298 2HA GLY A 22 -18.543 6.207 32.824 1.00 12.96 H ATOM 299 C GLY A 22 -16.859 7.505 33.036 1.00 12.96 C ATOM 300 O GLY A 22 -15.805 6.908 32.818 1.00 12.96 O ATOM 301 N ARG A 23 -16.932 8.529 33.873 1.00 -1.34 N ATOM 302 H ARG A 23 -17.827 8.996 34.029 1.00 -1.34 H ATOM 303 CA ARG A 23 -15.755 9.047 34.568 1.00 -1.34 C ATOM 304 HA ARG A 23 -14.961 8.304 34.517 1.00 -1.34 H ATOM 305 C ARG A 23 -15.984 9.378 36.028 1.00 -1.34 C ATOM 306 O ARG A 23 -17.013 9.927 36.413 1.00 -1.34 O ATOM 307 CB ARG A 23 -15.280 10.332 33.891 1.00 -1.34 C ATOM 308 1HB ARG A 23 -16.059 10.703 33.224 1.00 -1.34 H ATOM 309 2HB ARG A 23 -15.130 11.079 34.671 1.00 -1.34 H ATOM 310 CG ARG A 23 -13.985 10.162 33.108 1.00 -1.34 C ATOM 311 1HG ARG A 23 -13.353 9.425 33.604 1.00 -1.34 H ATOM 312 2HG ARG A 23 -14.216 9.813 32.101 1.00 -1.34 H ATOM 313 CD ARG A 23 -13.224 11.472 33.041 1.00 -1.34 C ATOM 314 1HD ARG A 23 -12.397 11.369 32.337 1.00 -1.34 H ATOM 315 2HD ARG A 23 -13.897 12.252 32.686 1.00 -1.34 H ATOM 316 NE ARG A 23 -12.693 11.847 34.362 1.00 -1.34 N ATOM 317 HE ARG A 23 -12.869 11.221 35.133 1.00 -1.34 H ATOM 318 CZ ARG A 23 -12.030 12.954 34.660 1.00 -1.34 C ATOM 319 NH1 ARG A 23 -11.592 13.105 35.873 1.00 -1.34 N ATOM 320 1HH1 ARG A 23 -11.799 12.425 36.587 1.00 -1.34 H ATOM 321 2HH1 ARG A 23 -11.076 13.964 36.087 1.00 -1.34 H ATOM 322 NH2 ARG A 23 -11.819 13.927 33.825 1.00 -1.34 N ATOM 323 1HH2 ARG A 23 -12.174 13.889 32.881 1.00 -1.34 H ATOM 324 2HH2 ARG A 23 -11.364 14.773 34.169 1.00 -1.34 H ATOM 325 N ARG A 24 -14.962 9.102 36.824 1.00-20.37 N ATOM 326 H ARG A 24 -14.179 8.590 36.453 1.00-20.37 H ATOM 327 CA ARG A 24 -14.868 9.620 38.187 1.00-20.37 C ATOM 328 HA ARG A 24 -15.847 9.607 38.670 1.00-20.37 H ATOM 329 C ARG A 24 -14.362 11.047 38.052 1.00-20.37 C ATOM 330 O ARG A 24 -13.450 11.284 37.259 1.00-20.37 O ATOM 331 CB ARG A 24 -13.857 8.788 38.983 1.00-20.37 C ATOM 332 1HB ARG A 24 -14.096 7.734 38.847 1.00-20.37 H ATOM 333 2HB ARG A 24 -12.863 8.966 38.570 1.00-20.37 H ATOM 334 CG ARG A 24 -13.818 9.072 40.477 1.00-20.37 C ATOM 335 1HG ARG A 24 -13.636 10.133 40.647 1.00-20.37 H ATOM 336 2HG ARG A 24 -14.776 8.795 40.917 1.00-20.37 H ATOM 337 CD ARG A 24 -12.702 8.266 41.130 1.00-20.37 C ATOM 338 1HD ARG A 24 -12.819 7.214 40.869 1.00-20.37 H ATOM 339 2HD ARG A 24 -11.748 8.614 40.729 1.00-20.37 H ATOM 340 NE ARG A 24 -12.680 8.411 42.593 1.00-20.37 N ATOM 341 HE ARG A 24 -12.210 9.232 42.975 1.00-20.37 H ATOM 342 CZ ARG A 24 -13.195 7.584 43.491 1.00-20.37 C ATOM 343 NH1 ARG A 24 -13.080 7.906 44.745 1.00-20.37 N ATOM 344 1HH1 ARG A 24 -12.630 8.798 44.971 1.00-20.37 H ATOM 345 2HH1 ARG A 24 -13.425 7.308 45.469 1.00-20.37 H ATOM 346 NH2 ARG A 24 -13.799 6.461 43.197 1.00-20.37 N ATOM 347 1HH2 ARG A 24 -13.912 6.200 42.234 1.00-20.37 H ATOM 348 2HH2 ARG A 24 -14.140 5.865 43.928 1.00-20.37 H ATOM 349 N LEU A 25 -14.920 11.961 38.826 1.00 7.05 N ATOM 350 H LEU A 25 -15.715 11.707 39.411 1.00 7.05 H ATOM 351 CA LEU A 25 -14.464 13.343 38.931 1.00 7.05 C ATOM 352 HA LEU A 25 -13.542 13.501 38.372 1.00 7.05 H ATOM 353 C LEU A 25 -14.211 13.541 40.422 1.00 7.05 C ATOM 354 O LEU A 25 -15.082 13.984 41.163 1.00 7.05 O ATOM 355 CB LEU A 25 -15.551 14.311 38.444 1.00 7.05 C ATOM 356 1HB LEU A 25 -16.435 14.136 39.052 1.00 7.05 H ATOM 357 2HB LEU A 25 -15.205 15.322 38.650 1.00 7.05 H ATOM 358 CG LEU A 25 -16.012 14.272 36.982 1.00 7.05 C ATOM 359 HG LEU A 25 -16.305 13.254 36.727 1.00 7.05 H ATOM 360 CD1 LEU A 25 -17.231 15.169 36.842 1.00 7.05 C ATOM 361 1HD1 LEU A 25 -17.539 15.209 35.800 1.00 7.05 H ATOM 362 2HD1 LEU A 25 -16.995 16.180 37.183 1.00 7.05 H ATOM 363 3HD1 LEU A 25 -18.051 14.771 37.436 1.00 7.05 H ATOM 364 CD2 LEU A 25 -14.933 14.724 36.013 1.00 7.05 C ATOM 365 1HD2 LEU A 25 -15.307 14.703 34.990 1.00 7.05 H ATOM 366 2HD2 LEU A 25 -14.078 14.062 36.084 1.00 7.05 H ATOM 367 3HD2 LEU A 25 -14.604 15.741 36.252 1.00 7.05 H ATOM 368 N ASP A 26 -13.063 13.114 40.916 1.00 0.41 N ATOM 369 H ASP A 26 -12.339 12.745 40.300 1.00 0.41 H ATOM 370 CA ASP A 26 -12.795 13.242 42.346 1.00 0.41 C ATOM 371 HA ASP A 26 -13.712 13.028 42.889 1.00 0.41 H ATOM 372 C ASP A 26 -12.385 14.675 42.665 1.00 0.41 C ATOM 373 O ASP A 26 -12.192 15.489 41.771 1.00 0.41 O ATOM 374 CB ASP A 26 -11.741 12.248 42.828 1.00 0.41 C ATOM 375 1HB ASP A 26 -11.710 11.412 42.129 1.00 0.41 H ATOM 376 2HB ASP A 26 -10.763 12.729 42.839 1.00 0.41 H ATOM 377 CG ASP A 26 -12.065 11.700 44.210 1.00 0.41 C ATOM 378 OD1 ASP A 26 -12.586 12.438 45.080 1.00 0.41 O ATOM 379 OD2 ASP A 26 -11.902 10.481 44.403 1.00 0.41 O ATOM 380 N ARG A 27 -12.274 14.982 43.945 1.00 21.40 N ATOM 381 H ARG A 27 -12.372 14.230 44.624 1.00 21.40 H ATOM 382 CA ARG A 27 -12.010 16.336 44.430 1.00 21.40 C ATOM 383 HA ARG A 27 -12.847 16.987 44.170 1.00 21.40 H ATOM 384 C ARG A 27 -10.735 16.893 43.808 1.00 21.40 C ATOM 385 O ARG A 27 -9.679 16.275 43.905 1.00 21.40 O ATOM 386 CB ARG A 27 -11.831 16.280 45.947 1.00 21.40 C ATOM 387 1HB ARG A 27 -10.956 15.660 46.146 1.00 21.40 H ATOM 388 2HB ARG A 27 -11.629 17.283 46.326 1.00 21.40 H ATOM 389 CG ARG A 27 -13.002 15.682 46.716 1.00 21.40 C ATOM 390 1HG ARG A 27 -13.800 16.415 46.811 1.00 21.40 H ATOM 391 2HG ARG A 27 -13.386 14.803 46.204 1.00 21.40 H ATOM 392 CD ARG A 27 -12.516 15.253 48.087 1.00 21.40 C ATOM 393 1HD ARG A 27 -11.655 14.593 47.970 1.00 21.40 H ATOM 394 2HD ARG A 27 -12.200 16.139 48.639 1.00 21.40 H ATOM 395 NE ARG A 27 -13.554 14.552 48.852 1.00 21.40 N ATOM 396 HE ARG A 27 -14.120 15.129 49.467 1.00 21.40 H ATOM 397 CZ ARG A 27 -13.822 13.255 48.828 1.00 21.40 C ATOM 398 NH1 ARG A 27 -14.668 12.796 49.707 1.00 21.40 N ATOM 399 1HH1 ARG A 27 -15.096 13.431 50.365 1.00 21.40 H ATOM 400 2HH1 ARG A 27 -14.887 11.817 49.735 1.00 21.40 H ATOM 401 NH2 ARG A 27 -13.319 12.405 47.970 1.00 21.40 N ATOM 402 1HH2 ARG A 27 -12.731 12.731 47.208 1.00 21.40 H ATOM 403 2HH2 ARG A 27 -13.534 11.428 48.026 1.00 21.40 H ATOM 404 N GLY A 28 -10.838 18.043 43.161 1.00 -5.97 N ATOM 405 H GLY A 28 -11.747 18.491 43.053 1.00 -5.97 H ATOM 406 CA GLY A 28 -9.685 18.690 42.558 1.00 -5.97 C ATOM 407 1HA GLY A 28 -9.899 19.754 42.465 1.00 -5.97 H ATOM 408 2HA GLY A 28 -8.828 18.571 43.220 1.00 -5.97 H ATOM 409 C GLY A 28 -9.293 18.167 41.190 1.00 -5.97 C ATOM 410 O GLY A 28 -8.386 18.717 40.571 1.00 -5.97 O ATOM 411 N GLN A 29 -9.934 17.117 40.695 1.00 -9.26 N ATOM 412 H GLN A 29 -10.689 16.677 41.213 1.00 -9.26 H ATOM 413 CA GLN A 29 -9.599 16.607 39.370 1.00 -9.26 C ATOM 414 HA GLN A 29 -8.522 16.665 39.220 1.00 -9.26 H ATOM 415 C GLN A 29 -10.296 17.468 38.327 1.00 -9.26 C ATOM 416 O GLN A 29 -11.424 17.910 38.547 1.00 -9.26 O ATOM 417 CB GLN A 29 -10.054 15.155 39.186 1.00 -9.26 C ATOM 418 1HB GLN A 29 -11.133 15.096 39.321 1.00 -9.26 H ATOM 419 2HB GLN A 29 -9.821 14.859 38.165 1.00 -9.26 H ATOM 420 CG GLN A 29 -9.380 14.165 40.120 1.00 -9.26 C ATOM 421 1HG GLN A 29 -8.306 14.349 40.106 1.00 -9.26 H ATOM 422 2HG GLN A 29 -9.745 14.316 41.135 1.00 -9.26 H ATOM 423 CD GLN A 29 -9.622 12.726 39.704 1.00 -9.26 C ATOM 424 OE1 GLN A 29 -10.743 12.293 39.460 1.00 -9.26 O ATOM 425 NE2 GLN A 29 -8.562 11.969 39.608 1.00 -9.26 N ATOM 426 1HE2 GLN A 29 -8.680 11.016 39.318 1.00 -9.26 H ATOM 427 2HE2 GLN A 29 -7.653 12.348 39.811 1.00 -9.26 H ATOM 428 N THR A 30 -9.643 17.642 37.188 1.00 -9.05 N ATOM 429 H THR A 30 -8.662 17.427 37.127 1.00 -9.05 H ATOM 430 CA THR A 30 -10.316 17.940 35.927 1.00 -9.05 C ATOM 431 HA THR A 30 -11.059 18.728 36.028 1.00 -9.05 H ATOM 432 C THR A 30 -10.988 16.640 35.531 1.00 -9.05 C ATOM 433 O THR A 30 -10.334 15.597 35.763 1.00 -9.05 O ATOM 434 OXT THR A 30 -12.091 16.629 34.966 1.00 -9.05 O ATOM 435 CB THR A 30 -9.280 18.258 34.843 1.00 -9.05 C ATOM 436 HB THR A 30 -9.745 18.205 33.859 1.00 -9.05 H ATOM 437 OG1 THR A 30 -8.231 17.293 34.951 1.00 -9.05 O ATOM 438 HG1 THR A 30 -8.660 16.427 34.990 1.00 -9.05 H ATOM 439 CG2 THR A 30 -8.652 19.623 35.031 1.00 -9.05 C ATOM 440 1HG2 THR A 30 -7.854 19.743 34.298 1.00 -9.05 H ATOM 441 2HG2 THR A 30 -8.241 19.719 36.034 1.00 -9.05 H ATOM 442 3HG2 THR A 30 -9.402 20.391 34.858 1.00 -9.05 H TER 443 THR A 30 END
SEQUENCE	ANFEIVNNCPYTVWAAASPGGGRRLDRGQT
HELICITY	13.30	INSTAB. INDEX	42.49	FLEXIBILITY	14.88
a HYD. MOM.	43.32	b HYD. MOM.	14.20	c HYD. MOM	3.51
a MEAN HYD. MOM.	1.44	b MEAN HYD. MOM.	0.47	c MEAN HYD. MOM.	0.12
CHARGE pH5	1.22	CHARGE pH7	0.95	CHARGE pH9	-0.09
Δ CHARGE pH5-pH9	1.31	ISOELECTRIC POINT	8.27	BOMAN INDEX	1.96
ΔG	16	CPP	-0,45	MLP	-6,28
MOLECULAR VOLUME		POLARITY
MIC E. coli		MIC P. aeruginosa		MIC S. typhimurium
MIC S. aureus		MIC M. luteus		MIC B. subtilis
MIC C. albicans		OTHER
MIC OTHER gram+
MIC OTHER gram-
PHYLUM	Magnoliophyta	CLASS	Magnoliopsida	ORDER	Fabales
FAMILY	Fabaceae	GENUS	Phaseolus	SPECIES	Phaseolus vulgaris
DATE	1999
TITLE PAPER	First chromatographic isolation of an antifungal thaumatin-like protein from French bean legumes and demonstration of its antifungal activity.