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ID	727	NAME	Peptide BmKb1   Blast NCBI-PROT
LENGTH	18	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\FLFSLIPSAISGLISAFK.pdb REMARK YASARA Written on: Mon May 19 15:47:43 2014 REMARK YASARA Number of models: 1 REMARK YASARA Number of atoms: 284 REMARK YASARA Please address questions or suggestions to: Eliza@yasara.org REMARK YASARA SEQRES 1 18 PHE LEU PHE SER LEU ILE PRO SER ALA ILE SER GLY LEU SEQRES 2 18 ILE SER ALA PHE LYS ATOM 1 N PHE 1 -17.020 -17.070 37.129 1.00 -0.42 N ATOM 2 1H PHE 1 -16.990 -17.075 38.138 1.00 -0.42 H ATOM 3 2H PHE 1 -17.732 -17.711 36.807 1.00 -0.42 H ATOM 4 3H PHE 1 -16.126 -17.366 36.760 1.00 0.27 H ATOM 5 CA PHE 1 -17.333 -15.697 36.636 1.00 -0.00 C ATOM 6 HA PHE 1 -18.311 -15.416 37.027 1.00 0.10 H ATOM 7 C PHE 1 -17.426 -15.731 35.123 1.00 0.60 C ATOM 8 O PHE 1 -17.404 -16.827 34.595 1.00 -0.57 O ATOM 9 CB PHE 1 -16.305 -14.676 37.148 1.00 -0.03 C ATOM 10 1HB PHE 1 -16.695 -13.673 36.978 1.00 0.03 H ATOM 11 2HB PHE 1 -16.187 -14.814 38.223 1.00 0.03 H ATOM 12 CG PHE 1 -14.947 -14.773 36.497 1.00 0.01 C ATOM 13 CD1 PHE 1 -14.548 -13.806 35.553 1.00 -0.13 C ATOM 14 HD1 PHE 1 -15.215 -12.998 35.285 1.00 0.13 H ATOM 15 CD2 PHE 1 -14.038 -15.788 36.857 1.00 -0.13 C ATOM 16 HD2 PHE 1 -14.302 -16.522 37.603 1.00 0.13 H ATOM 17 CE1 PHE 1 -13.264 -13.853 34.964 1.00 -0.17 C ATOM 18 HE1 PHE 1 -12.961 -13.096 34.253 1.00 0.14 H ATOM 19 CE2 PHE 1 -12.756 -15.857 36.260 1.00 -0.17 C ATOM 20 HE2 PHE 1 -12.067 -16.644 36.538 1.00 0.14 H ATOM 21 CZ PHE 1 -12.368 -14.885 35.316 1.00 -0.11 C ATOM 22 HZ PHE 1 -11.383 -14.926 34.869 1.00 0.13 H ATOM 23 N LEU 2 -17.545 -14.608 34.420 1.00 -0.42 N ATOM 24 H LEU 2 -17.495 -13.707 34.873 1.00 0.27 H ATOM 25 CA LEU 2 -17.802 -14.634 32.974 1.00 -0.05 C ATOM 26 HA LEU 2 -18.778 -15.099 32.820 1.00 0.09 H ATOM 27 C LEU 2 -16.804 -15.456 32.159 1.00 0.60 C ATOM 28 O LEU 2 -17.219 -16.274 31.357 1.00 -0.57 O ATOM 29 CB LEU 2 -17.875 -13.190 32.450 1.00 -0.11 C ATOM 30 1HB LEU 2 -18.568 -12.665 33.107 1.00 0.05 H ATOM 31 2HB LEU 2 -16.898 -12.724 32.574 1.00 0.05 H ATOM 32 CG LEU 2 -18.346 -12.923 31.005 1.00 0.35 C ATOM 33 HG LEU 2 -19.183 -13.585 30.787 1.00 -0.04 H ATOM 34 CD1 LEU 2 -18.851 -11.482 30.922 1.00 -0.41 C ATOM 35 1HD1 LEU 2 -19.675 -11.331 31.621 1.00 0.10 H ATOM 36 2HD1 LEU 2 -18.049 -10.779 31.150 1.00 0.10 H ATOM 37 3HD1 LEU 2 -19.223 -11.280 29.916 1.00 0.10 H ATOM 38 CD2 LEU 2 -17.271 -13.113 29.926 1.00 -0.41 C ATOM 39 1HD2 LEU 2 -16.957 -14.153 29.880 1.00 0.10 H ATOM 40 2HD2 LEU 2 -17.680 -12.849 28.950 1.00 0.10 H ATOM 41 3HD2 LEU 2 -16.406 -12.481 30.131 1.00 0.10 H ATOM 42 N PHE 3 -15.505 -15.299 32.376 1.00 -0.42 N ATOM 43 H PHE 3 -15.175 -14.643 33.064 1.00 0.27 H ATOM 44 CA PHE 3 -14.524 -16.035 31.571 1.00 -0.00 C ATOM 45 HA PHE 3 -14.747 -15.863 30.516 1.00 0.10 H ATOM 46 C PHE 3 -14.561 -17.544 31.819 1.00 0.60 C ATOM 47 O PHE 3 -14.188 -18.335 30.972 1.00 -0.57 O ATOM 48 CB PHE 3 -13.121 -15.504 31.857 1.00 -0.03 C ATOM 49 1HB PHE 3 -13.174 -14.419 31.936 1.00 0.03 H ATOM 50 2HB PHE 3 -12.779 -15.908 32.807 1.00 0.03 H ATOM 51 CG PHE 3 -12.115 -15.841 30.793 1.00 0.01 C ATOM 52 CD1 PHE 3 -11.934 -14.974 29.704 1.00 -0.13 C ATOM 53 HD1 PHE 3 -12.524 -14.072 29.632 1.00 0.13 H ATOM 54 CD2 PHE 3 -11.335 -17.010 30.877 1.00 -0.13 C ATOM 55 HD2 PHE 3 -11.468 -17.691 31.705 1.00 0.13 H ATOM 56 CE1 PHE 3 -10.980 -15.258 28.703 1.00 -0.17 C ATOM 57 HE1 PHE 3 -10.843 -14.572 27.883 1.00 0.14 H ATOM 58 CE2 PHE 3 -10.380 -17.315 29.875 1.00 -0.17 C ATOM 59 HE2 PHE 3 -9.794 -18.220 29.942 1.00 0.14 H ATOM 60 CZ PHE 3 -10.202 -16.435 28.786 1.00 -0.11 C ATOM 61 HZ PHE 3 -9.480 -16.666 28.016 1.00 0.13 H ATOM 62 N SER 4 -15.064 -17.950 32.977 1.00 -0.42 N ATOM 63 H SER 4 -15.390 -17.277 33.649 1.00 0.27 H ATOM 64 CA SER 4 -15.196 -19.370 33.296 1.00 -0.03 C ATOM 65 HA SER 4 -14.245 -19.870 33.109 1.00 0.08 H ATOM 66 C SER 4 -16.280 -20.040 32.458 1.00 0.60 C ATOM 67 O SER 4 -16.311 -21.255 32.336 1.00 -0.57 O ATOM 68 CB SER 4 -15.577 -19.530 34.766 1.00 0.21 C ATOM 69 1HB SER 4 -16.639 -19.312 34.877 1.00 0.04 H ATOM 70 2HB SER 4 -15.393 -20.558 35.081 1.00 0.04 H ATOM 71 OG SER 4 -14.838 -18.621 35.573 1.00 -0.65 O ATOM 72 HG SER 4 -13.905 -18.858 35.494 1.00 0.43 H ATOM 73 N LEU 5 -17.187 -19.231 31.928 1.00 -0.42 N ATOM 74 H LEU 5 -17.115 -18.237 32.088 1.00 0.27 H ATOM 75 CA LEU 5 -18.289 -19.717 31.101 1.00 -0.05 C ATOM 76 HA LEU 5 -18.421 -20.789 31.246 1.00 0.09 H ATOM 77 C LEU 5 -17.986 -19.455 29.631 1.00 0.60 C ATOM 78 O LEU 5 -18.292 -20.265 28.764 1.00 -0.57 O ATOM 79 CB LEU 5 -19.580 -18.984 31.487 1.00 -0.11 C ATOM 80 1HB LEU 5 -19.438 -17.925 31.272 1.00 0.05 H ATOM 81 2HB LEU 5 -20.377 -19.349 30.839 1.00 0.05 H ATOM 82 CG LEU 5 -20.053 -19.102 32.945 1.00 0.35 C ATOM 83 HG LEU 5 -19.252 -18.770 33.603 1.00 -0.04 H ATOM 84 CD1 LEU 5 -21.251 -18.180 33.168 1.00 -0.41 C ATOM 85 1HD1 LEU 5 -20.974 -17.151 32.939 1.00 0.10 H ATOM 86 2HD1 LEU 5 -22.078 -18.479 32.520 1.00 0.10 H ATOM 87 3HD1 LEU 5 -21.574 -18.238 34.207 1.00 0.10 H ATOM 88 CD2 LEU 5 -20.425 -20.533 33.330 1.00 -0.41 C ATOM 89 1HD2 LEU 5 -21.201 -20.913 32.663 1.00 0.10 H ATOM 90 2HD2 LEU 5 -19.549 -21.179 33.255 1.00 0.10 H ATOM 91 3HD2 LEU 5 -20.790 -20.563 34.356 1.00 0.10 H ATOM 92 N ILE 6 -17.385 -18.301 29.368 1.00 -0.42 N ATOM 93 H ILE 6 -17.170 -17.674 30.133 1.00 0.27 H ATOM 94 CA ILE 6 -17.051 -17.856 28.016 1.00 -0.06 C ATOM 95 HA ILE 6 -17.303 -18.652 27.318 1.00 0.09 H ATOM 96 C ILE 6 -15.535 -17.607 27.946 1.00 0.60 C ATOM 97 O ILE 6 -15.074 -16.457 27.963 1.00 -0.57 O ATOM 98 CB ILE 6 -17.859 -16.567 27.610 1.00 0.13 C ATOM 99 HB ILE 6 -17.500 -15.740 28.221 1.00 0.02 H ATOM 100 CG1 ILE 6 -19.372 -16.703 27.900 1.00 -0.04 C ATOM 101 1HG1 ILE 6 -19.512 -16.896 28.962 1.00 0.02 H ATOM 102 2HG1 ILE 6 -19.832 -15.737 27.694 1.00 0.02 H ATOM 103 CG2 ILE 6 -17.646 -16.198 26.112 1.00 -0.32 C ATOM 104 1HG2 ILE 6 -16.611 -15.913 25.947 1.00 0.09 H ATOM 105 2HG2 ILE 6 -17.890 -17.047 25.473 1.00 0.09 H ATOM 106 3HG2 ILE 6 -18.281 -15.352 25.846 1.00 0.09 H ATOM 107 CD1 ILE 6 -20.163 -17.769 27.105 1.00 -0.07 C ATOM 108 1HD1 ILE 6 -20.178 -17.519 26.045 1.00 0.02 H ATOM 109 2HD1 ILE 6 -19.718 -18.754 27.240 1.00 0.02 H ATOM 110 3HD1 ILE 6 -21.189 -17.798 27.472 1.00 0.02 H ATOM 111 N PRO 7 -14.721 -18.677 27.848 1.00 -0.25 N ATOM 112 CA PRO 7 -13.286 -18.389 27.710 1.00 -0.03 C ATOM 113 HA PRO 7 -12.955 -17.691 28.480 1.00 0.06 H ATOM 114 C PRO 7 -12.966 -17.818 26.330 1.00 0.59 C ATOM 115 O PRO 7 -11.945 -17.171 26.109 1.00 -0.57 O ATOM 116 CB PRO 7 -12.642 -19.757 27.938 1.00 -0.01 C ATOM 117 1HB PRO 7 -11.700 -19.842 27.398 1.00 0.03 H ATOM 118 2HB PRO 7 -12.488 -19.920 29.005 1.00 0.03 H ATOM 119 CG PRO 7 -13.653 -20.717 27.420 1.00 0.02 C ATOM 120 1HG PRO 7 -13.604 -20.758 26.332 1.00 0.02 H ATOM 121 2HG PRO 7 -13.503 -21.708 27.847 1.00 0.02 H ATOM 122 CD PRO 7 -14.972 -20.133 27.862 1.00 0.02 C ATOM 123 1HD PRO 7 -15.767 -20.406 27.167 1.00 0.04 H ATOM 124 2HD PRO 7 -15.214 -20.459 28.876 1.00 0.04 H ATOM 125 N SER 8 -13.914 -17.971 25.414 1.00 -0.42 N ATOM 126 H SER 8 -14.731 -18.523 25.642 1.00 0.27 H ATOM 127 CA SER 8 -13.895 -17.382 24.082 1.00 -0.03 C ATOM 128 HA SER 8 -13.023 -17.745 23.539 1.00 0.08 H ATOM 129 C SER 8 -13.868 -15.855 24.079 1.00 0.60 C ATOM 130 O SER 8 -13.666 -15.237 23.035 1.00 -0.57 O ATOM 131 CB SER 8 -15.161 -17.861 23.379 1.00 0.21 C ATOM 132 1HB SER 8 -15.762 -17.001 23.077 1.00 0.04 H ATOM 133 2HB SER 8 -14.891 -18.446 22.499 1.00 0.04 H ATOM 134 OG SER 8 -15.901 -18.669 24.289 1.00 -0.65 O ATOM 135 HG SER 8 -16.671 -19.024 23.831 1.00 0.43 H ATOM 136 N ALA 9 -14.006 -15.238 25.245 1.00 -0.42 N ATOM 137 H ALA 9 -14.203 -15.777 26.081 1.00 0.27 H ATOM 138 CA ALA 9 -13.816 -13.802 25.378 1.00 0.03 C ATOM 139 HA ALA 9 -14.520 -13.289 24.721 1.00 0.08 H ATOM 140 C ALA 9 -12.395 -13.406 24.952 1.00 0.60 C ATOM 141 O ALA 9 -12.214 -12.345 24.363 1.00 -0.57 O ATOM 142 CB ALA 9 -14.095 -13.383 26.825 1.00 -0.18 C ATOM 143 1HB ALA 9 -15.127 -13.624 27.087 1.00 0.06 H ATOM 144 2HB ALA 9 -13.424 -13.910 27.501 1.00 0.06 H ATOM 145 3HB ALA 9 -13.942 -12.307 26.928 1.00 0.06 H ATOM 146 N ILE 10 -11.395 -14.253 25.180 1.00 -0.42 N ATOM 147 H ILE 10 -11.566 -15.141 25.646 1.00 0.27 H ATOM 148 CA ILE 10 -10.033 -13.912 24.751 1.00 -0.06 C ATOM 149 HA ILE 10 -9.846 -12.886 25.064 1.00 0.09 H ATOM 150 C ILE 10 -9.946 -13.934 23.224 1.00 0.60 C ATOM 151 O ILE 10 -9.248 -13.125 22.620 1.00 -0.57 O ATOM 152 CB ILE 10 -8.945 -14.824 25.420 1.00 0.13 C ATOM 153 HB ILE 10 -9.192 -14.918 26.473 1.00 0.02 H ATOM 154 CG1 ILE 10 -7.545 -14.188 25.330 1.00 -0.04 C ATOM 155 1HG1 ILE 10 -6.811 -14.945 25.607 1.00 0.02 H ATOM 156 2HG1 ILE 10 -7.350 -13.899 24.298 1.00 0.02 H ATOM 157 CG2 ILE 10 -8.890 -16.250 24.820 1.00 -0.32 C ATOM 158 1HG2 ILE 10 -9.876 -16.708 24.837 1.00 0.09 H ATOM 159 2HG2 ILE 10 -8.525 -16.223 23.791 1.00 0.09 H ATOM 160 3HG2 ILE 10 -8.218 -16.871 25.415 1.00 0.09 H ATOM 161 CD1 ILE 10 -7.324 -12.971 26.233 1.00 -0.07 C ATOM 162 1HD1 ILE 10 -7.503 -13.243 27.274 1.00 0.02 H ATOM 163 2HD1 ILE 10 -6.294 -12.628 26.128 1.00 0.02 H ATOM 164 3HD1 ILE 10 -7.995 -12.161 25.948 1.00 0.02 H ATOM 165 N SER 11 -10.718 -14.803 22.586 1.00 -0.42 N ATOM 166 H SER 11 -11.309 -15.433 23.106 1.00 0.27 H ATOM 167 CA SER 11 -10.726 -14.885 21.132 1.00 -0.03 C ATOM 168 HA SER 11 -9.697 -14.939 20.782 1.00 0.08 H ATOM 169 C SER 11 -11.386 -13.642 20.555 1.00 0.60 C ATOM 170 O SER 11 -10.963 -13.118 19.531 1.00 -0.57 O ATOM 171 CB SER 11 -11.472 -16.137 20.680 1.00 0.21 C ATOM 172 1HB SER 11 -12.542 -15.996 20.836 1.00 0.04 H ATOM 173 2HB SER 11 -11.284 -16.309 19.620 1.00 0.04 H ATOM 174 OG SER 11 -11.040 -17.250 21.447 1.00 -0.65 O ATOM 175 HG SER 11 -11.207 -18.051 20.943 1.00 0.43 H ATOM 176 N GLY 12 -12.393 -13.129 21.248 1.00 -0.42 N ATOM 177 H GLY 12 -12.728 -13.605 22.079 1.00 0.27 H ATOM 178 CA GLY 12 -13.017 -11.883 20.836 1.00 -0.03 C ATOM 179 1HA GLY 12 -13.291 -11.949 19.783 1.00 0.07 H ATOM 180 2HA GLY 12 -13.915 -11.711 21.429 1.00 0.07 H ATOM 181 C GLY 12 -12.072 -10.714 21.022 1.00 0.60 C ATOM 182 O GLY 12 -12.002 -9.822 20.179 1.00 -0.57 O ATOM 183 N LEU 13 -11.298 -10.730 22.098 1.00 -0.42 N ATOM 184 H LEU 13 -11.388 -11.484 22.774 1.00 0.27 H ATOM 185 CA LEU 13 -10.340 -9.661 22.359 1.00 -0.05 C ATOM 186 HA LEU 13 -10.884 -8.717 22.361 1.00 0.09 H ATOM 187 C LEU 13 -9.277 -9.591 21.267 1.00 0.60 C ATOM 188 O LEU 13 -9.004 -8.514 20.753 1.00 -0.57 O ATOM 189 CB LEU 13 -9.670 -9.862 23.724 1.00 -0.11 C ATOM 190 1HB LEU 13 -10.445 -10.065 24.463 1.00 0.05 H ATOM 191 2HB LEU 13 -9.033 -10.742 23.659 1.00 0.05 H ATOM 192 CG LEU 13 -8.814 -8.693 24.237 1.00 0.35 C ATOM 193 HG LEU 13 -8.134 -8.380 23.447 1.00 -0.04 H ATOM 194 CD1 LEU 13 -9.675 -7.496 24.650 1.00 -0.41 C ATOM 195 1HD1 LEU 13 -10.355 -7.777 25.455 1.00 0.10 H ATOM 196 2HD1 LEU 13 -9.033 -6.682 24.988 1.00 0.10 H ATOM 197 3HD1 LEU 13 -10.256 -7.141 23.799 1.00 0.10 H ATOM 198 CD2 LEU 13 -7.976 -9.141 25.428 1.00 -0.41 C ATOM 199 1HD2 LEU 13 -7.366 -8.309 25.780 1.00 0.10 H ATOM 200 2HD2 LEU 13 -8.619 -9.486 26.238 1.00 0.10 H ATOM 201 3HD2 LEU 13 -7.311 -9.949 25.122 1.00 0.10 H ATOM 202 N ILE 14 -8.713 -10.724 20.868 1.00 -0.42 N ATOM 203 H ILE 14 -8.956 -11.601 21.322 1.00 0.27 H ATOM 204 CA ILE 14 -7.695 -10.723 19.809 1.00 -0.06 C ATOM 205 HA ILE 14 -7.060 -9.855 19.978 1.00 0.09 H ATOM 206 C ILE 14 -8.297 -10.558 18.412 1.00 0.60 C ATOM 207 O ILE 14 -7.600 -10.266 17.437 1.00 -0.57 O ATOM 208 CB ILE 14 -6.763 -11.966 19.867 1.00 0.13 C ATOM 209 HB ILE 14 -5.976 -11.825 19.125 1.00 0.02 H ATOM 210 CG1 ILE 14 -7.526 -13.257 19.512 1.00 -0.04 C ATOM 211 1HG1 ILE 14 -8.268 -13.438 20.280 1.00 0.02 H ATOM 212 2HG1 ILE 14 -8.048 -13.111 18.568 1.00 0.02 H ATOM 213 CG2 ILE 14 -6.092 -12.045 21.265 1.00 -0.32 C ATOM 214 1HG2 ILE 14 -5.302 -12.795 21.256 1.00 0.09 H ATOM 215 2HG2 ILE 14 -5.644 -11.081 21.512 1.00 0.09 H ATOM 216 3HG2 ILE 14 -6.823 -12.309 22.031 1.00 0.09 H ATOM 217 CD1 ILE 14 -6.667 -14.518 19.373 1.00 -0.07 C ATOM 218 1HD1 ILE 14 -7.294 -15.342 19.033 1.00 0.02 H ATOM 219 2HD1 ILE 14 -5.874 -14.349 18.644 1.00 0.02 H ATOM 220 3HD1 ILE 14 -6.229 -14.784 20.335 1.00 0.02 H ATOM 221 N SER 15 -9.611 -10.695 18.298 1.00 -0.42 N ATOM 222 H SER 15 -10.160 -10.998 19.092 1.00 0.27 H ATOM 223 CA SER 15 -10.281 -10.371 17.043 1.00 -0.03 C ATOM 224 HA SER 15 -9.703 -10.772 16.211 1.00 0.08 H ATOM 225 C SER 15 -10.340 -8.854 16.913 1.00 0.60 C ATOM 226 O SER 15 -10.177 -8.322 15.817 1.00 -0.57 O ATOM 227 CB SER 15 -11.694 -10.952 16.979 1.00 0.21 C ATOM 228 1HB SER 15 -12.283 -10.577 17.814 1.00 0.04 H ATOM 229 2HB SER 15 -12.164 -10.639 16.047 1.00 0.04 H ATOM 230 OG SER 15 -11.651 -12.368 17.025 1.00 -0.65 O ATOM 231 HG SER 15 -11.338 -12.644 17.903 1.00 0.43 H ATOM 232 N ALA 16 -10.525 -8.155 18.024 1.00 -0.42 N ATOM 233 H ALA 16 -10.666 -8.635 18.907 1.00 0.27 H ATOM 234 CA ALA 16 -10.578 -6.697 18.004 1.00 0.03 C ATOM 235 HA ALA 16 -11.072 -6.392 17.081 1.00 0.08 H ATOM 236 C ALA 16 -9.200 -6.016 18.033 1.00 0.60 C ATOM 237 O ALA 16 -9.007 -5.001 17.369 1.00 -0.57 O ATOM 238 CB ALA 16 -11.428 -6.218 19.187 1.00 -0.18 C ATOM 239 1HB ALA 16 -12.436 -6.627 19.107 1.00 0.06 H ATOM 240 2HB ALA 16 -10.979 -6.549 20.125 1.00 0.06 H ATOM 241 3HB ALA 16 -11.478 -5.128 19.181 1.00 0.06 H ATOM 242 N PHE 17 -8.261 -6.541 18.808 1.00 -0.42 N ATOM 243 H PHE 17 -8.448 -7.395 19.329 1.00 0.27 H ATOM 244 CA PHE 17 -6.980 -5.870 19.045 1.00 -0.00 C ATOM 245 HA PHE 17 -6.898 -5.002 18.393 1.00 0.10 H ATOM 246 C PHE 17 -5.782 -6.776 18.806 1.00 0.60 C ATOM 247 O PHE 17 -5.837 -7.967 19.100 1.00 -0.57 O ATOM 248 CB PHE 17 -6.926 -5.392 20.498 1.00 -0.03 C ATOM 249 1HB PHE 17 -6.867 -6.265 21.148 1.00 0.03 H ATOM 250 2HB PHE 17 -6.025 -4.796 20.638 1.00 0.03 H ATOM 251 CG PHE 17 -8.123 -4.580 20.908 1.00 0.01 C ATOM 252 CD1 PHE 17 -9.063 -5.118 21.803 1.00 -0.13 C ATOM 253 HD1 PHE 17 -8.916 -6.114 22.193 1.00 0.13 H ATOM 254 CD2 PHE 17 -8.329 -3.289 20.392 1.00 -0.13 C ATOM 255 HD2 PHE 17 -7.616 -2.866 19.698 1.00 0.13 H ATOM 256 CE1 PHE 17 -10.209 -4.377 22.188 1.00 -0.17 C ATOM 257 HE1 PHE 17 -10.924 -4.803 22.876 1.00 0.14 H ATOM 258 CE2 PHE 17 -9.475 -2.537 20.757 1.00 -0.17 C ATOM 259 HE2 PHE 17 -9.629 -1.551 20.344 1.00 0.14 H ATOM 260 CZ PHE 17 -10.417 -3.084 21.659 1.00 -0.11 C ATOM 261 HZ PHE 17 -11.292 -2.516 21.940 1.00 0.13 H ATOM 262 N LYS 18 -4.718 -6.206 18.258 1.00 -0.35 N ATOM 263 H LYS 18 -4.722 -5.216 18.012 1.00 0.28 H ATOM 264 CA LYS 18 -3.439 -6.868 18.004 1.00 -0.24 C ATOM 265 HA LYS 18 -3.081 -7.389 18.890 1.00 0.14 H ATOM 266 C LYS 18 -2.553 -5.669 17.719 1.00 0.73 C ATOM 267 O LYS 18 -3.191 -4.599 17.560 1.00 -0.59 O ATOM 268 OXT LYS 18 -1.319 -5.779 17.647 1.00 -0.59 O ATOM 269 CB LYS 18 -3.489 -7.826 16.805 1.00 -0.01 C ATOM 270 1HB LYS 18 -2.494 -8.252 16.672 1.00 0.04 H ATOM 271 2HB LYS 18 -4.162 -8.643 17.059 1.00 0.04 H ATOM 272 CG LYS 18 -3.925 -7.209 15.469 1.00 0.02 C ATOM 273 1HG LYS 18 -4.253 -6.180 15.612 1.00 0.01 H ATOM 274 2HG LYS 18 -3.068 -7.207 14.795 1.00 0.01 H ATOM 275 CD LYS 18 -5.060 -8.000 14.826 1.00 -0.05 C ATOM 276 1HD LYS 18 -5.138 -7.715 13.777 1.00 0.06 H ATOM 277 2HD LYS 18 -4.828 -9.064 14.887 1.00 0.06 H ATOM 278 CE LYS 18 -6.395 -7.723 15.514 1.00 -0.01 C ATOM 279 1HE LYS 18 -6.290 -7.900 16.585 1.00 0.11 H ATOM 280 2HE LYS 18 -6.671 -6.678 15.360 1.00 0.11 H ATOM 281 NZ LYS 18 -7.471 -8.612 15.005 1.00 -0.38 N ATOM 282 1HZ LYS 18 -8.375 -8.272 15.321 1.00 0.17 H ATOM 283 2HZ LYS 18 -7.461 -8.642 13.998 1.00 0.17 H ATOM 284 3HZ LYS 18 -7.341 -9.542 15.390 1.00 0.17 H TER 285 LYS 18 END
SEQUENCE	FLFSLIPSAISGLISAFK
HELICITY	94.40	INSTAB. INDEX	10.19	FLEXIBILITY	13.23
a HYD. MOM.	59.97	b HYD. MOM.	24.05	c HYD. MOM	4.43
a MEAN HYD. MOM.	3.33	b MEAN HYD. MOM.	1.34	c MEAN HYD. MOM.	0.25
CHARGE pH5	1.00	CHARGE pH7	1.00	CHARGE pH9	0.80
Δ CHARGE pH5-pH9	0.20	ISOELECTRIC POINT	8.75	BOMAN INDEX	-1.33
ΔG	-5,31	CPP	-0,21	MLP	0,98
MOLECULAR VOLUME		POLARITY
MIC E. coli	7	MIC P. aeruginosa	34	MIC S. typhimurium
MIC S. aureus	6	MIC M. luteus	30	MIC B. subtilis	18
MIC C. albicans		OTHER
MIC OTHER gram+
MIC OTHER gram-
PHYLUM	Arthropoda	CLASS	Arachnida	ORDER	Scorpiones
FAMILY	Buthidae	GENUS	Mesobuthus	SPECIES	Mesobuthus martensii
DATE	2004
TITLE PAPER	Identification and functional characterization of novel scorpion venom peptides with no disulfide bridge from Buthus martensii Karsch.