Back to Resultset

ID	859	NAME	Capistruin   Blast NCBI-PROT
LENGTH	19	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\risultati_grimd_abalone\pdb_final\GTPGFQTPDARVISRFGFN.pdb REMARK YASARA Written on: Mon May 19 16:44:21 2014 REMARK YASARA Number of models: 1 REMARK YASARA Number of atoms: 287 REMARK YASARA Please address questions or suggestions to: Eliza@yasara.org REMARK YASARA SEQRES 1 19 GLY THR PRO GLY PHE GLN THR PRO ASP ALA ARG VAL ILE SEQRES 2 19 SER ARG PHE GLY PHE ASN ATOM 1 N GLY 1 -4.864 -4.000 33.037 1.00 -0.42 N ATOM 2 1H GLY 1 -4.363 -3.154 33.272 1.00 -0.42 H ATOM 3 2H GLY 1 -4.299 -4.567 32.420 1.00 -0.42 H ATOM 4 3H GLY 1 -5.728 -3.763 32.568 1.00 0.27 H ATOM 5 CA GLY 1 -5.166 -4.767 34.273 1.00 -0.03 C ATOM 6 1HA GLY 1 -4.234 -5.012 34.782 1.00 0.07 H ATOM 7 2HA GLY 1 -5.795 -4.167 34.928 1.00 0.07 H ATOM 8 C GLY 1 -5.883 -6.040 33.920 1.00 0.60 C ATOM 9 O GLY 1 -5.901 -6.319 32.736 1.00 -0.57 O ATOM 10 N THR 2 -6.463 -6.787 34.855 1.00 -0.42 N ATOM 11 H THR 2 -6.408 -6.542 35.833 1.00 0.27 H ATOM 12 CA THR 2 -7.148 -8.043 34.515 1.00 -0.04 C ATOM 13 HA THR 2 -7.076 -8.188 33.437 1.00 0.10 H ATOM 14 C THR 2 -8.643 -8.236 34.821 1.00 0.60 C ATOM 15 O THR 2 -9.326 -8.775 33.962 1.00 -0.57 O ATOM 16 CB THR 2 -6.402 -9.237 35.152 1.00 0.37 C ATOM 17 HB THR 2 -6.983 -10.149 35.016 1.00 0.00 H ATOM 18 OG1 THR 2 -6.205 -8.970 36.543 1.00 -0.68 O ATOM 19 HG1 THR 2 -5.784 -9.742 36.938 1.00 0.41 H ATOM 20 CG2 THR 2 -5.019 -9.425 34.549 1.00 -0.24 C ATOM 21 1HG2 THR 2 -4.574 -10.338 34.946 1.00 0.06 H ATOM 22 2HG2 THR 2 -5.094 -9.519 33.464 1.00 0.06 H ATOM 23 3HG2 THR 2 -4.374 -8.583 34.798 1.00 0.06 H ATOM 24 N PRO 3 -9.190 -7.814 35.987 1.00 -0.25 N ATOM 25 CA PRO 3 -10.512 -8.424 36.237 1.00 -0.03 C ATOM 26 HA PRO 3 -10.404 -9.510 36.213 1.00 0.06 H ATOM 27 C PRO 3 -11.674 -8.042 35.314 1.00 0.59 C ATOM 28 O PRO 3 -12.372 -8.908 34.801 1.00 -0.57 O ATOM 29 CB PRO 3 -10.828 -7.991 37.676 1.00 -0.01 C ATOM 30 1HB PRO 3 -11.432 -7.084 37.682 1.00 0.03 H ATOM 31 2HB PRO 3 -11.340 -8.789 38.214 1.00 0.03 H ATOM 32 CG PRO 3 -9.501 -7.724 38.279 1.00 0.02 C ATOM 33 1HG PRO 3 -9.589 -7.073 39.149 1.00 0.02 H ATOM 34 2HG PRO 3 -9.018 -8.665 38.548 1.00 0.02 H ATOM 35 CD PRO 3 -8.750 -7.052 37.173 1.00 0.02 C ATOM 36 1HD PRO 3 -9.045 -6.005 37.085 1.00 0.04 H ATOM 37 2HD PRO 3 -7.677 -7.142 37.337 1.00 0.04 H ATOM 38 N GLY 4 -11.868 -6.754 35.060 1.00 -0.42 N ATOM 39 H GLY 4 -11.306 -6.055 35.515 1.00 0.27 H ATOM 40 CA GLY 4 -12.923 -6.337 34.144 1.00 -0.03 C ATOM 41 1HA GLY 4 -13.837 -6.892 34.356 1.00 0.07 H ATOM 42 2HA GLY 4 -13.116 -5.273 34.279 1.00 0.07 H ATOM 43 C GLY 4 -12.522 -6.580 32.703 1.00 0.60 C ATOM 44 O GLY 4 -13.338 -6.810 31.824 1.00 -0.57 O ATOM 45 N PHE 5 -11.216 -6.550 32.488 1.00 -0.42 N ATOM 46 H PHE 5 -10.609 -6.409 33.270 1.00 0.27 H ATOM 47 CA PHE 5 -10.599 -6.694 31.171 1.00 -0.00 C ATOM 48 HA PHE 5 -11.049 -5.978 30.482 1.00 0.10 H ATOM 49 C PHE 5 -10.798 -8.098 30.603 1.00 0.60 C ATOM 50 O PHE 5 -10.838 -8.292 29.399 1.00 -0.57 O ATOM 51 CB PHE 5 -9.099 -6.401 31.297 1.00 -0.03 C ATOM 52 1HB PHE 5 -8.653 -7.143 31.955 1.00 0.03 H ATOM 53 2HB PHE 5 -8.640 -6.500 30.313 1.00 0.03 H ATOM 54 CG PHE 5 -8.788 -5.025 31.844 1.00 0.01 C ATOM 55 CD1 PHE 5 -8.784 -4.776 33.233 1.00 -0.13 C ATOM 56 HD1 PHE 5 -9.002 -5.577 33.921 1.00 0.13 H ATOM 57 CD2 PHE 5 -8.487 -3.970 30.966 1.00 -0.13 C ATOM 58 HD2 PHE 5 -8.487 -4.143 29.897 1.00 0.13 H ATOM 59 CE1 PHE 5 -8.507 -3.483 33.743 1.00 -0.17 C ATOM 60 HE1 PHE 5 -8.536 -3.298 34.808 1.00 0.14 H ATOM 61 CE2 PHE 5 -8.190 -2.674 31.461 1.00 -0.17 C ATOM 62 HE2 PHE 5 -7.970 -1.870 30.771 1.00 0.14 H ATOM 63 CZ PHE 5 -8.207 -2.430 32.852 1.00 -0.11 C ATOM 64 HZ PHE 5 -8.006 -1.436 33.230 1.00 0.13 H ATOM 65 N GLN 6 -10.970 -9.072 31.486 1.00 -0.42 N ATOM 66 H GLN 6 -10.900 -8.868 32.476 1.00 0.27 H ATOM 67 CA GLN 6 -11.242 -10.452 31.091 1.00 -0.00 C ATOM 68 HA GLN 6 -10.537 -10.740 30.311 1.00 0.09 H ATOM 69 C GLN 6 -12.668 -10.611 30.550 1.00 0.60 C ATOM 70 O GLN 6 -13.021 -11.663 30.032 1.00 -0.57 O ATOM 71 CB GLN 6 -11.031 -11.352 32.318 1.00 -0.00 C ATOM 72 1HB GLN 6 -10.131 -11.014 32.828 1.00 0.02 H ATOM 73 2HB GLN 6 -11.875 -11.223 32.996 1.00 0.02 H ATOM 74 CG GLN 6 -10.848 -12.838 32.022 1.00 -0.06 C ATOM 75 1HG GLN 6 -11.738 -13.228 31.536 1.00 0.04 H ATOM 76 2HG GLN 6 -10.002 -12.958 31.347 1.00 0.04 H ATOM 77 CD GLN 6 -10.592 -13.648 33.273 1.00 0.69 C ATOM 78 OE1 GLN 6 -11.438 -13.752 34.151 1.00 -0.61 O ATOM 79 NE2 GLN 6 -9.431 -14.238 33.364 1.00 -0.94 N ATOM 80 1HE2 GLN 6 -9.233 -14.785 34.184 1.00 0.43 H ATOM 81 2HE2 GLN 6 -8.754 -14.139 32.627 1.00 0.43 H ATOM 82 N THR 7 -13.475 -9.565 30.692 1.00 -0.42 N ATOM 83 H THR 7 -13.089 -8.697 31.043 1.00 0.27 H ATOM 84 CA THR 7 -14.913 -9.575 30.404 1.00 -0.04 C ATOM 85 HA THR 7 -15.302 -8.605 30.705 1.00 0.10 H ATOM 86 C THR 7 -15.618 -10.657 31.232 1.00 0.60 C ATOM 87 O THR 7 -15.834 -11.778 30.763 1.00 -0.57 O ATOM 88 CB THR 7 -15.211 -9.690 28.896 1.00 0.37 C ATOM 89 HB THR 7 -15.096 -10.722 28.563 1.00 0.00 H ATOM 90 OG1 THR 7 -14.294 -8.854 28.186 1.00 -0.68 O ATOM 91 HG1 THR 7 -13.400 -9.152 28.381 1.00 0.41 H ATOM 92 CG2 THR 7 -16.605 -9.176 28.572 1.00 -0.24 C ATOM 93 1HG2 THR 7 -16.763 -9.243 27.495 1.00 0.06 H ATOM 94 2HG2 THR 7 -17.356 -9.776 29.080 1.00 0.06 H ATOM 95 3HG2 THR 7 -16.696 -8.132 28.873 1.00 0.06 H ATOM 96 N PRO 8 -15.956 -10.346 32.504 1.00 -0.25 N ATOM 97 CA PRO 8 -16.456 -11.387 33.417 1.00 -0.03 C ATOM 98 HA PRO 8 -15.647 -12.082 33.619 1.00 0.06 H ATOM 99 C PRO 8 -17.672 -12.200 32.982 1.00 0.59 C ATOM 100 O PRO 8 -17.830 -13.336 33.430 1.00 -0.57 O ATOM 101 CB PRO 8 -16.782 -10.607 34.692 1.00 -0.01 C ATOM 102 1HB PRO 8 -17.824 -10.289 34.684 1.00 0.03 H ATOM 103 2HB PRO 8 -16.574 -11.210 35.576 1.00 0.03 H ATOM 104 CG PRO 8 -15.883 -9.449 34.648 1.00 0.02 C ATOM 105 1HG PRO 8 -16.259 -8.637 35.271 1.00 0.02 H ATOM 106 2HG PRO 8 -14.887 -9.749 34.970 1.00 0.02 H ATOM 107 CD PRO 8 -15.855 -9.052 33.207 1.00 0.02 C ATOM 108 1HD PRO 8 -16.711 -8.420 32.963 1.00 0.04 H ATOM 109 2HD PRO 8 -14.918 -8.544 32.979 1.00 0.04 H ATOM 110 N ASP 9 -18.492 -11.649 32.099 1.00 -0.52 N ATOM 111 H ASP 9 -18.375 -10.685 31.844 1.00 0.29 H ATOM 112 CA ASP 9 -19.504 -12.433 31.391 1.00 0.04 C ATOM 113 HA ASP 9 -19.995 -13.125 32.077 1.00 0.09 H ATOM 114 C ASP 9 -18.875 -13.253 30.257 1.00 0.54 C ATOM 115 O ASP 9 -18.690 -14.461 30.382 1.00 -0.58 O ATOM 116 CB ASP 9 -20.555 -11.492 30.800 1.00 -0.03 C ATOM 117 1HB ASP 9 -21.150 -11.063 31.607 1.00 -0.01 H ATOM 118 2HB ASP 9 -20.044 -10.678 30.283 1.00 -0.01 H ATOM 119 CG ASP 9 -21.462 -12.195 29.809 1.00 0.80 C ATOM 120 OD1 ASP 9 -22.014 -13.261 30.138 1.00 -0.55 O ATOM 121 OD2 ASP 9 -21.558 -11.697 28.669 1.00 -0.55 O ATOM 122 N ALA 10 -18.491 -12.594 29.168 1.00 -0.42 N ATOM 123 H ALA 10 -18.556 -11.591 29.161 1.00 0.27 H ATOM 124 CA ALA 10 -18.133 -13.260 27.914 1.00 0.03 C ATOM 125 HA ALA 10 -19.012 -13.824 27.597 1.00 0.08 H ATOM 126 C ALA 10 -16.981 -14.266 27.981 1.00 0.60 C ATOM 127 O ALA 10 -16.894 -15.160 27.136 1.00 -0.57 O ATOM 128 CB ALA 10 -17.856 -12.213 26.837 1.00 -0.18 C ATOM 129 1HB ALA 10 -18.691 -11.510 26.782 1.00 0.06 H ATOM 130 2HB ALA 10 -16.934 -11.680 27.062 1.00 0.06 H ATOM 131 3HB ALA 10 -17.751 -12.708 25.870 1.00 0.06 H ATOM 132 N ARG 11 -16.145 -14.214 29.007 1.00 -0.35 N ATOM 133 H ARG 11 -16.217 -13.445 29.673 1.00 0.28 H ATOM 134 CA ARG 11 -15.167 -15.280 29.234 1.00 -0.26 C ATOM 135 HA ARG 11 -14.473 -15.287 28.395 1.00 0.16 H ATOM 136 C ARG 11 -15.813 -16.667 29.294 1.00 0.73 C ATOM 137 O ARG 11 -15.185 -17.641 28.885 1.00 -0.59 O ATOM 138 CB ARG 11 -14.362 -15.006 30.511 1.00 -0.00 C ATOM 139 1HB ARG 11 -13.583 -15.764 30.604 1.00 0.03 H ATOM 140 2HB ARG 11 -13.883 -14.035 30.409 1.00 0.03 H ATOM 141 CG ARG 11 -15.194 -14.994 31.786 1.00 0.04 C ATOM 142 1HG ARG 11 -15.984 -14.255 31.682 1.00 0.03 H ATOM 143 2HG ARG 11 -15.649 -15.972 31.935 1.00 0.03 H ATOM 144 CD ARG 11 -14.383 -14.656 33.013 1.00 0.05 C ATOM 145 1HD ARG 11 -13.635 -15.431 33.185 1.00 0.07 H ATOM 146 2HD ARG 11 -13.887 -13.695 32.864 1.00 0.07 H ATOM 147 NE ARG 11 -15.296 -14.562 34.157 1.00 -0.53 N ATOM 148 HE ARG 11 -16.285 -14.640 33.939 1.00 0.35 H ATOM 149 CZ ARG 11 -14.976 -14.313 35.417 1.00 0.81 C ATOM 150 NH1 ARG 11 -15.947 -14.239 36.283 1.00 -0.86 N ATOM 151 1HH1 ARG 11 -16.900 -14.348 35.971 1.00 0.32 H ATOM 152 2HH1 ARG 11 -15.748 -14.070 37.252 1.00 0.32 H ATOM 153 NH2 ARG 11 -13.756 -14.120 35.844 1.00 -0.86 N ATOM 154 1HH2 ARG 11 -12.983 -14.110 35.176 1.00 0.32 H ATOM 155 2HH2 ARG 11 -13.571 -13.972 36.816 1.00 0.32 H ATOM 156 N VAL 12 -17.060 -16.795 29.738 1.00 -0.42 N ATOM 157 H VAL 12 -17.596 -15.974 30.027 1.00 0.27 H ATOM 158 CA VAL 12 -17.667 -18.123 29.848 1.00 -0.09 C ATOM 159 HA VAL 12 -16.911 -18.769 30.292 1.00 0.10 H ATOM 160 C VAL 12 -18.020 -18.725 28.492 1.00 0.60 C ATOM 161 O VAL 12 -18.083 -19.949 28.373 1.00 -0.57 O ATOM 162 CB VAL 12 -18.905 -18.170 30.798 1.00 0.30 C ATOM 163 HB VAL 12 -19.154 -19.218 30.959 1.00 -0.03 H ATOM 164 CG1 VAL 12 -18.555 -17.555 32.162 1.00 -0.32 C ATOM 165 1HG1 VAL 12 -17.649 -18.009 32.561 1.00 0.08 H ATOM 166 2HG1 VAL 12 -18.415 -16.475 32.071 1.00 0.08 H ATOM 167 3HG1 VAL 12 -19.375 -17.734 32.859 1.00 0.08 H ATOM 168 CG2 VAL 12 -20.148 -17.493 30.202 1.00 -0.32 C ATOM 169 1HG2 VAL 12 -19.935 -16.471 29.899 1.00 0.08 H ATOM 170 2HG2 VAL 12 -20.505 -18.053 29.339 1.00 0.08 H ATOM 171 3HG2 VAL 12 -20.949 -17.468 30.943 1.00 0.08 H ATOM 172 N ILE 13 -18.187 -17.901 27.464 1.00 -0.42 N ATOM 173 H ILE 13 -18.146 -16.898 27.609 1.00 0.27 H ATOM 174 CA ILE 13 -18.422 -18.405 26.107 1.00 -0.06 C ATOM 175 HA ILE 13 -18.726 -19.446 26.177 1.00 0.09 H ATOM 176 C ILE 13 -17.123 -18.385 25.305 1.00 0.60 C ATOM 177 O ILE 13 -16.960 -19.139 24.356 1.00 -0.57 O ATOM 178 CB ILE 13 -19.575 -17.658 25.369 1.00 0.13 C ATOM 179 HB ILE 13 -19.712 -18.138 24.399 1.00 0.02 H ATOM 180 CG1 ILE 13 -19.240 -16.173 25.129 1.00 -0.04 C ATOM 181 1HG1 ILE 13 -19.230 -15.661 26.089 1.00 0.02 H ATOM 182 2HG1 ILE 13 -18.245 -16.101 24.694 1.00 0.02 H ATOM 183 CG2 ILE 13 -20.892 -17.811 26.172 1.00 -0.32 C ATOM 184 1HG2 ILE 13 -21.060 -18.858 26.423 1.00 0.09 H ATOM 185 2HG2 ILE 13 -20.856 -17.219 27.089 1.00 0.09 H ATOM 186 3HG2 ILE 13 -21.735 -17.466 25.571 1.00 0.09 H ATOM 187 CD1 ILE 13 -20.201 -15.421 24.202 1.00 -0.07 C ATOM 188 1HD1 ILE 13 -20.271 -15.934 23.242 1.00 0.02 H ATOM 189 2HD1 ILE 13 -21.190 -15.354 24.656 1.00 0.02 H ATOM 190 3HD1 ILE 13 -19.823 -14.410 24.039 1.00 0.02 H ATOM 191 N SER 14 -16.147 -17.611 25.760 1.00 -0.42 N ATOM 192 H SER 14 -16.321 -17.003 26.551 1.00 0.27 H ATOM 193 CA SER 14 -14.825 -17.572 25.127 1.00 -0.03 C ATOM 194 HA SER 14 -14.951 -17.406 24.056 1.00 0.08 H ATOM 195 C SER 14 -14.082 -18.889 25.315 1.00 0.60 C ATOM 196 O SER 14 -13.195 -19.227 24.541 1.00 -0.57 O ATOM 197 CB SER 14 -13.989 -16.429 25.698 1.00 0.21 C ATOM 198 1HB SER 14 -13.827 -16.598 26.762 1.00 0.04 H ATOM 199 2HB SER 14 -13.023 -16.406 25.192 1.00 0.04 H ATOM 200 OG SER 14 -14.647 -15.186 25.510 1.00 -0.65 O ATOM 201 HG SER 14 -15.476 -15.180 26.010 1.00 0.43 H ATOM 202 N ARG 15 -14.531 -19.693 26.273 1.00 -0.35 N ATOM 203 H ARG 15 -15.257 -19.351 26.885 1.00 0.28 H ATOM 204 CA ARG 15 -14.046 -21.070 26.437 1.00 -0.26 C ATOM 205 HA ARG 15 -12.969 -21.057 26.611 1.00 0.16 H ATOM 206 C ARG 15 -14.292 -21.945 25.214 1.00 0.73 C ATOM 207 O ARG 15 -13.677 -22.993 25.081 1.00 -0.59 O ATOM 208 CB ARG 15 -14.752 -21.756 27.610 1.00 -0.00 C ATOM 209 1HB ARG 15 -15.825 -21.724 27.422 1.00 0.03 H ATOM 210 2HB ARG 15 -14.444 -22.802 27.625 1.00 0.03 H ATOM 211 CG ARG 15 -14.460 -21.165 28.983 1.00 0.04 C ATOM 212 1HG ARG 15 -13.386 -21.199 29.166 1.00 0.03 H ATOM 213 2HG ARG 15 -14.794 -20.131 29.016 1.00 0.03 H ATOM 214 CD ARG 15 -15.177 -21.955 30.073 1.00 0.05 C ATOM 215 1HD ARG 15 -14.890 -23.005 29.997 1.00 0.07 H ATOM 216 2HD ARG 15 -14.873 -21.572 31.048 1.00 0.07 H ATOM 217 NE ARG 15 -16.635 -21.834 29.937 1.00 -0.53 N ATOM 218 HE ARG 15 -16.972 -21.210 29.208 1.00 0.35 H ATOM 219 CZ ARG 15 -17.563 -22.448 30.653 1.00 0.81 C ATOM 220 NH1 ARG 15 -18.809 -22.174 30.388 1.00 -0.86 N ATOM 221 1HH1 ARG 15 -19.018 -21.498 29.662 1.00 0.32 H ATOM 222 2HH1 ARG 15 -19.552 -22.616 30.897 1.00 0.32 H ATOM 223 NH2 ARG 15 -17.302 -23.312 31.602 1.00 -0.86 N ATOM 224 1HH2 ARG 15 -16.345 -23.545 31.808 1.00 0.32 H ATOM 225 2HH2 ARG 15 -18.048 -23.750 32.112 1.00 0.32 H ATOM 226 N PHE 16 -15.209 -21.535 24.350 1.00 -0.42 N ATOM 227 H PHE 16 -15.692 -20.657 24.503 1.00 0.27 H ATOM 228 CA PHE 16 -15.588 -22.316 23.179 1.00 -0.00 C ATOM 229 HA PHE 16 -15.124 -23.297 23.233 1.00 0.10 H ATOM 230 C PHE 16 -15.136 -21.638 21.891 1.00 0.60 C ATOM 231 O PHE 16 -15.475 -22.078 20.800 1.00 -0.57 O ATOM 232 CB PHE 16 -17.104 -22.502 23.195 1.00 -0.03 C ATOM 233 1HB PHE 16 -17.573 -21.548 22.953 1.00 0.03 H ATOM 234 2HB PHE 16 -17.381 -23.227 22.430 1.00 0.03 H ATOM 235 CG PHE 16 -17.625 -22.956 24.532 1.00 0.01 C ATOM 236 CD1 PHE 16 -18.491 -22.131 25.270 1.00 -0.13 C ATOM 237 HD1 PHE 16 -18.818 -21.190 24.850 1.00 0.13 H ATOM 238 CD2 PHE 16 -17.220 -24.188 25.080 1.00 -0.13 C ATOM 239 HD2 PHE 16 -16.562 -24.837 24.519 1.00 0.13 H ATOM 240 CE1 PHE 16 -18.938 -22.513 26.559 1.00 -0.17 C ATOM 241 HE1 PHE 16 -19.604 -21.867 27.111 1.00 0.14 H ATOM 242 CE2 PHE 16 -17.654 -24.584 26.370 1.00 -0.17 C ATOM 243 HE2 PHE 16 -17.332 -25.530 26.780 1.00 0.14 H ATOM 244 CZ PHE 16 -18.517 -23.744 27.110 1.00 -0.11 C ATOM 245 HZ PHE 16 -18.859 -24.048 28.088 1.00 0.13 H ATOM 246 N GLY 17 -14.359 -20.569 22.031 1.00 -0.42 N ATOM 247 H GLY 17 -14.046 -20.295 22.953 1.00 0.27 H ATOM 248 CA GLY 17 -13.932 -19.748 20.905 1.00 -0.03 C ATOM 249 1HA GLY 17 -14.788 -19.587 20.247 1.00 0.07 H ATOM 250 2HA GLY 17 -13.616 -18.778 21.290 1.00 0.07 H ATOM 251 C GLY 17 -12.799 -20.303 20.061 1.00 0.60 C ATOM 252 O GLY 17 -11.840 -19.601 19.755 1.00 -0.57 O ATOM 253 N PHE 18 -12.900 -21.575 19.714 1.00 -0.42 N ATOM 254 H PHE 18 -13.727 -22.088 20.012 1.00 0.27 H ATOM 255 CA PHE 18 -11.922 -22.278 18.887 1.00 -0.00 C ATOM 256 HA PHE 18 -11.158 -21.585 18.537 1.00 0.10 H ATOM 257 C PHE 18 -12.654 -22.835 17.666 1.00 0.60 C ATOM 258 O PHE 18 -12.121 -23.648 16.909 1.00 -0.57 O ATOM 259 CB PHE 18 -11.257 -23.398 19.699 1.00 -0.03 C ATOM 260 1HB PHE 18 -10.607 -23.974 19.042 1.00 0.03 H ATOM 261 2HB PHE 18 -10.639 -22.941 20.471 1.00 0.03 H ATOM 262 CG PHE 18 -12.236 -24.333 20.371 1.00 0.01 C ATOM 263 CD1 PHE 18 -12.878 -25.354 19.643 1.00 -0.13 C ATOM 264 HD1 PHE 18 -12.673 -25.475 18.588 1.00 0.13 H ATOM 265 CD2 PHE 18 -12.507 -24.207 21.747 1.00 -0.13 C ATOM 266 HD2 PHE 18 -12.020 -23.434 22.325 1.00 0.13 H ATOM 267 CE1 PHE 18 -13.804 -26.224 20.270 1.00 -0.17 C ATOM 268 HE1 PHE 18 -14.307 -26.984 19.690 1.00 0.14 H ATOM 269 CE2 PHE 18 -13.405 -25.092 22.395 1.00 -0.17 C ATOM 270 HE2 PHE 18 -13.587 -24.997 23.456 1.00 0.14 H ATOM 271 CZ PHE 18 -14.065 -26.093 21.651 1.00 -0.11 C ATOM 272 HZ PHE 18 -14.766 -26.757 22.136 1.00 0.13 H ATOM 273 N ASN 19 -13.901 -22.413 17.523 1.00 -0.42 N ATOM 274 H ASN 19 -14.271 -21.682 18.124 1.00 0.27 H ATOM 275 CA ASN 19 -14.828 -22.867 16.497 1.00 0.01 C ATOM 276 HA ASN 19 -14.308 -23.170 15.589 1.00 0.10 H ATOM 277 C ASN 19 -15.619 -21.584 16.286 1.00 0.60 C ATOM 278 O ASN 19 -16.250 -21.380 15.231 1.00 -0.57 O ATOM 279 OXT ASN 19 -15.576 -20.790 17.253 1.00 -0.57 O ATOM 280 CB ASN 19 -15.712 -23.997 17.057 1.00 -0.20 C ATOM 281 1HB ASN 19 -15.083 -24.698 17.600 1.00 0.08 H ATOM 282 2HB ASN 19 -16.434 -23.564 17.747 1.00 0.08 H ATOM 283 CG ASN 19 -16.449 -24.772 15.985 1.00 0.71 C ATOM 284 OD1 ASN 19 -16.504 -25.993 16.030 1.00 -0.59 O ATOM 285 ND2 ASN 19 -17.024 -24.098 15.034 1.00 -0.92 N ATOM 286 1HD2 ASN 19 -17.538 -24.589 14.333 1.00 0.42 H ATOM 287 2HD2 ASN 19 -16.921 -23.080 15.010 1.00 0.42 H TER 288 ASN 19 END
SEQUENCE	GTPGFQTPDARVISRFGFN
HELICITY	0.00	INSTAB. INDEX	11.17	FLEXIBILITY	14.04
a HYD. MOM.	22.30	b HYD. MOM.	10.33	c HYD. MOM	3.10
a MEAN HYD. MOM.	1.17	b MEAN HYD. MOM.	0.54	c MEAN HYD. MOM.	0.16
CHARGE pH5	1.07	CHARGE pH7	1.00	CHARGE pH9	0.83
Δ CHARGE pH5-pH9	0.24	ISOELECTRIC POINT	9.60	BOMAN INDEX	1.93
ΔG	7	CPP	-0,41	MLP	-5,40
MOLECULAR VOLUME		POLARITY
MIC E. coli	30	MIC P. aeruginosa	30	MIC S. typhimurium
MIC S. aureus		MIC M. luteus		MIC B. subtilis
MIC C. albicans		OTHER
MIC OTHER gram+
MIC OTHER gram-
PHYLUM	Proteobacteria	CLASS	Betaproteobacteria	ORDER	Burkholderiales
FAMILY	Burkholderiaceae	GENUS	Burkholderia	SPECIES	Burkholderia thailandensis E264
DATE	2008
TITLE PAPER	Isolation and structural characterization of capistruin, a lasso peptide predicted from the genome sequence of Burkholderia thailandensis