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ID	685	NAME	Bombolitin 4   Blast NCBI-PROT
LENGTH	17	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\INIKDILAKLVKVLGHV.pdb REMARK YASARA Written on: Wed May 14 20:10:28 2014 REMARK YASARA Number of models: 1 REMARK YASARA Number of atoms: 292 REMARK YASARA Please address questions or suggestions to: Eliza@yasara.org REMARK YASARA SEQRES 1 17 ILE ASN ILE LYS ASP ILE LEU ALA LYS LEU VAL LYS VAL SEQRES 2 17 LEU GLY HIS VAL ATOM 1 N ILE 1 -9.156 0.222 26.645 1.00 -0.42 N ATOM 2 1H ILE 1 -9.752 1.038 26.619 1.00 -0.42 H ATOM 3 2H ILE 1 -9.564 -0.465 27.264 1.00 -0.42 H ATOM 4 3H ILE 1 -8.247 0.496 26.991 1.00 0.27 H ATOM 5 CA ILE 1 -9.028 -0.340 25.263 1.00 -0.06 C ATOM 6 HA ILE 1 -10.036 -0.561 24.910 1.00 0.09 H ATOM 7 C ILE 1 -8.252 -1.662 25.239 1.00 0.60 C ATOM 8 O ILE 1 -8.455 -2.470 24.342 1.00 -0.57 O ATOM 9 CB ILE 1 -8.407 0.684 24.249 1.00 0.13 C ATOM 10 HB ILE 1 -8.538 0.247 23.258 1.00 0.02 H ATOM 11 CG1 ILE 1 -6.882 0.903 24.417 1.00 -0.04 C ATOM 12 1HG1 ILE 1 -6.379 -0.057 24.308 1.00 0.02 H ATOM 13 2HG1 ILE 1 -6.558 1.520 23.578 1.00 0.02 H ATOM 14 CG2 ILE 1 -9.195 2.021 24.255 1.00 -0.32 C ATOM 15 1HG2 ILE 1 -10.255 1.842 24.055 1.00 0.09 H ATOM 16 2HG2 ILE 1 -9.085 2.562 25.196 1.00 0.09 H ATOM 17 3HG2 ILE 1 -8.817 2.663 23.453 1.00 0.09 H ATOM 18 CD1 ILE 1 -6.346 1.581 25.705 1.00 -0.07 C ATOM 19 1HD1 ILE 1 -6.829 2.547 25.859 1.00 0.02 H ATOM 20 2HD1 ILE 1 -6.495 0.945 26.574 1.00 0.02 H ATOM 21 3HD1 ILE 1 -5.274 1.755 25.589 1.00 0.02 H ATOM 22 N ASN 2 -7.399 -1.941 26.220 1.00 -0.42 N ATOM 23 H ASN 2 -7.274 -1.323 27.012 1.00 0.27 H ATOM 24 CA ASN 2 -6.586 -3.165 26.236 1.00 0.01 C ATOM 25 HA ASN 2 -6.062 -3.247 25.283 1.00 0.10 H ATOM 26 C ASN 2 -7.390 -4.449 26.434 1.00 0.60 C ATOM 27 O ASN 2 -6.899 -5.538 26.174 1.00 -0.57 O ATOM 28 CB ASN 2 -5.561 -3.083 27.375 1.00 -0.20 C ATOM 29 1HB ASN 2 -4.891 -3.942 27.309 1.00 0.08 H ATOM 30 2HB ASN 2 -4.969 -2.175 27.270 1.00 0.08 H ATOM 31 CG ASN 2 -6.216 -3.084 28.741 1.00 0.71 C ATOM 32 OD1 ASN 2 -7.150 -2.321 28.978 1.00 -0.59 O ATOM 33 ND2 ASN 2 -5.769 -3.929 29.623 1.00 -0.92 N ATOM 34 1HD2 ASN 2 -6.183 -3.936 30.541 1.00 0.42 H ATOM 35 2HD2 ASN 2 -5.017 -4.560 29.396 1.00 0.42 H ATOM 36 N ILE 3 -8.644 -4.315 26.841 1.00 -0.42 N ATOM 37 H ILE 3 -8.999 -3.402 27.053 1.00 0.27 H ATOM 38 CA ILE 3 -9.542 -5.452 27.032 1.00 -0.06 C ATOM 39 HA ILE 3 -9.045 -6.159 27.698 1.00 0.09 H ATOM 40 C ILE 3 -9.835 -6.212 25.740 1.00 0.60 C ATOM 41 O ILE 3 -10.310 -7.340 25.783 1.00 -0.57 O ATOM 42 CB ILE 3 -10.866 -5.012 27.727 1.00 0.13 C ATOM 43 HB ILE 3 -11.464 -5.903 27.924 1.00 0.02 H ATOM 44 CG1 ILE 3 -11.700 -4.046 26.856 1.00 -0.04 C ATOM 45 1HG1 ILE 3 -12.190 -3.334 27.521 1.00 0.02 H ATOM 46 2HG1 ILE 3 -11.042 -3.480 26.198 1.00 0.02 H ATOM 47 CG2 ILE 3 -10.548 -4.344 29.087 1.00 -0.32 C ATOM 48 1HG2 ILE 3 -10.014 -3.403 28.963 1.00 0.09 H ATOM 49 2HG2 ILE 3 -11.480 -4.153 29.626 1.00 0.09 H ATOM 50 3HG2 ILE 3 -9.944 -5.020 29.696 1.00 0.09 H ATOM 51 CD1 ILE 3 -12.799 -4.709 26.008 1.00 -0.07 C ATOM 52 1HD1 ILE 3 -13.358 -3.942 25.472 1.00 0.02 H ATOM 53 2HD1 ILE 3 -12.365 -5.399 25.286 1.00 0.02 H ATOM 54 3HD1 ILE 3 -13.487 -5.257 26.656 1.00 0.02 H ATOM 55 N LYS 4 -9.477 -5.650 24.590 1.00 -0.35 N ATOM 56 H LYS 4 -9.083 -4.720 24.584 1.00 0.28 H ATOM 57 CA LYS 4 -9.608 -6.381 23.329 1.00 -0.24 C ATOM 58 HA LYS 4 -10.651 -6.680 23.214 1.00 0.14 H ATOM 59 C LYS 4 -8.770 -7.657 23.346 1.00 0.73 C ATOM 60 O LYS 4 -9.112 -8.620 22.680 1.00 -0.59 O ATOM 61 CB LYS 4 -9.218 -5.506 22.127 1.00 -0.01 C ATOM 62 1HB LYS 4 -9.524 -6.034 21.223 1.00 0.04 H ATOM 63 2HB LYS 4 -9.775 -4.570 22.179 1.00 0.04 H ATOM 64 CG LYS 4 -7.721 -5.192 22.000 1.00 0.02 C ATOM 65 1HG LYS 4 -7.383 -4.646 22.881 1.00 0.01 H ATOM 66 2HG LYS 4 -7.174 -6.130 21.936 1.00 0.01 H ATOM 67 CD LYS 4 -7.412 -4.377 20.751 1.00 -0.05 C ATOM 68 1HD LYS 4 -7.843 -4.876 19.881 1.00 0.06 H ATOM 69 2HD LYS 4 -7.868 -3.391 20.850 1.00 0.06 H ATOM 70 CE LYS 4 -5.901 -4.219 20.537 1.00 -0.01 C ATOM 71 1HE LYS 4 -5.740 -3.518 19.713 1.00 0.11 H ATOM 72 2HE LYS 4 -5.461 -3.791 21.441 1.00 0.11 H ATOM 73 NZ LYS 4 -5.204 -5.522 20.212 1.00 -0.38 N ATOM 74 1HZ LYS 4 -5.592 -5.920 19.367 1.00 0.17 H ATOM 75 2HZ LYS 4 -4.215 -5.362 20.076 1.00 0.17 H ATOM 76 3HZ LYS 4 -5.327 -6.180 20.971 1.00 0.17 H ATOM 77 N ASP 5 -7.686 -7.679 24.112 1.00 -0.52 N ATOM 78 H ASP 5 -7.442 -6.876 24.680 1.00 0.29 H ATOM 79 CA ASP 5 -6.827 -8.858 24.165 1.00 0.04 C ATOM 80 HA ASP 5 -6.578 -9.182 23.154 1.00 0.09 H ATOM 81 C ASP 5 -7.517 -10.015 24.876 1.00 0.54 C ATOM 82 O ASP 5 -7.506 -11.160 24.409 1.00 -0.58 O ATOM 83 CB ASP 5 -5.547 -8.540 24.932 1.00 -0.03 C ATOM 84 1HB ASP 5 -4.969 -7.796 24.384 1.00 -0.01 H ATOM 85 2HB ASP 5 -5.819 -8.125 25.903 1.00 -0.01 H ATOM 86 CG ASP 5 -4.718 -9.777 25.170 1.00 0.80 C ATOM 87 OD1 ASP 5 -4.666 -10.238 26.330 1.00 -0.55 O ATOM 88 OD2 ASP 5 -4.231 -10.378 24.192 1.00 -0.55 O ATOM 89 N ILE 6 -8.134 -9.721 26.011 1.00 -0.42 N ATOM 90 H ILE 6 -8.122 -8.780 26.370 1.00 0.27 H ATOM 91 CA ILE 6 -8.799 -10.771 26.772 1.00 -0.06 C ATOM 92 HA ILE 6 -8.145 -11.640 26.762 1.00 0.09 H ATOM 93 C ILE 6 -10.070 -11.175 26.037 1.00 0.60 C ATOM 94 O ILE 6 -10.417 -12.346 26.021 1.00 -0.57 O ATOM 95 CB ILE 6 -9.019 -10.405 28.272 1.00 0.13 C ATOM 96 HB ILE 6 -9.447 -11.278 28.766 1.00 0.02 H ATOM 97 CG1 ILE 6 -9.992 -9.224 28.454 1.00 -0.04 C ATOM 98 1HG1 ILE 6 -9.519 -8.326 28.065 1.00 0.02 H ATOM 99 2HG1 ILE 6 -10.891 -9.416 27.872 1.00 0.02 H ATOM 100 CG2 ILE 6 -7.644 -10.104 28.927 1.00 -0.32 C ATOM 101 1HG2 ILE 6 -6.942 -10.913 28.714 1.00 0.09 H ATOM 102 2HG2 ILE 6 -7.225 -9.172 28.545 1.00 0.09 H ATOM 103 3HG2 ILE 6 -7.753 -10.027 30.009 1.00 0.09 H ATOM 104 CD1 ILE 6 -10.435 -8.941 29.894 1.00 -0.07 C ATOM 105 1HD1 ILE 6 -9.585 -8.620 30.496 1.00 0.02 H ATOM 106 2HD1 ILE 6 -11.183 -8.148 29.890 1.00 0.02 H ATOM 107 3HD1 ILE 6 -10.873 -9.839 30.332 1.00 0.02 H ATOM 108 N LEU 7 -10.716 -10.247 25.343 1.00 -0.42 N ATOM 109 H LEU 7 -10.395 -9.283 25.371 1.00 0.27 H ATOM 110 CA LEU 7 -11.904 -10.571 24.560 1.00 -0.05 C ATOM 111 HA LEU 7 -12.619 -11.077 25.206 1.00 0.09 H ATOM 112 C LEU 7 -11.556 -11.502 23.402 1.00 0.60 C ATOM 113 O LEU 7 -12.271 -12.469 23.133 1.00 -0.57 O ATOM 114 CB LEU 7 -12.535 -9.282 24.024 1.00 -0.11 C ATOM 115 1HB LEU 7 -12.710 -8.616 24.869 1.00 0.05 H ATOM 116 2HB LEU 7 -11.809 -8.803 23.369 1.00 0.05 H ATOM 117 CG LEU 7 -13.850 -9.416 23.239 1.00 0.35 C ATOM 118 HG LEU 7 -13.681 -10.072 22.386 1.00 -0.04 H ATOM 119 CD1 LEU 7 -14.984 -10.004 24.082 1.00 -0.41 C ATOM 120 1HD1 LEU 7 -14.743 -11.027 24.369 1.00 0.10 H ATOM 121 2HD1 LEU 7 -15.140 -9.402 24.978 1.00 0.10 H ATOM 122 3HD1 LEU 7 -15.904 -10.023 23.497 1.00 0.10 H ATOM 123 CD2 LEU 7 -14.262 -8.046 22.708 1.00 -0.41 C ATOM 124 1HD2 LEU 7 -13.479 -7.647 22.064 1.00 0.10 H ATOM 125 2HD2 LEU 7 -15.176 -8.141 22.120 1.00 0.10 H ATOM 126 3HD2 LEU 7 -14.439 -7.357 23.535 1.00 0.10 H ATOM 127 N ALA 8 -10.427 -11.255 22.751 1.00 -0.42 N ATOM 128 H ALA 8 -9.857 -10.459 23.025 1.00 0.27 H ATOM 129 CA ALA 8 -9.995 -12.060 21.613 1.00 0.03 C ATOM 130 HA ALA 8 -10.772 -12.011 20.850 1.00 0.08 H ATOM 131 C ALA 8 -9.802 -13.534 21.975 1.00 0.60 C ATOM 132 O ALA 8 -10.057 -14.409 21.143 1.00 -0.57 O ATOM 133 CB ALA 8 -8.703 -11.476 21.028 1.00 -0.18 C ATOM 134 1HB ALA 8 -8.391 -12.062 20.164 1.00 0.06 H ATOM 135 2HB ALA 8 -8.877 -10.445 20.714 1.00 0.06 H ATOM 136 3HB ALA 8 -7.910 -11.489 21.778 1.00 0.06 H ATOM 137 N LYS 9 -9.380 -13.817 23.201 1.00 -0.35 N ATOM 138 H LYS 9 -9.144 -13.052 23.827 1.00 0.28 H ATOM 139 CA LYS 9 -9.270 -15.204 23.671 1.00 -0.24 C ATOM 140 HA LYS 9 -9.145 -15.846 22.801 1.00 0.14 H ATOM 141 C LYS 9 -10.537 -15.698 24.373 1.00 0.73 C ATOM 142 O LYS 9 -10.842 -16.886 24.313 1.00 -0.59 O ATOM 143 CB LYS 9 -8.009 -15.388 24.527 1.00 -0.01 C ATOM 144 1HB LYS 9 -7.947 -16.432 24.834 1.00 0.04 H ATOM 145 2HB LYS 9 -7.159 -15.175 23.881 1.00 0.04 H ATOM 146 CG LYS 9 -7.903 -14.498 25.770 1.00 0.02 C ATOM 147 1HG LYS 9 -7.987 -13.460 25.465 1.00 0.01 H ATOM 148 2HG LYS 9 -8.733 -14.728 26.437 1.00 0.01 H ATOM 149 CD LYS 9 -6.589 -14.668 26.550 1.00 -0.05 C ATOM 150 1HD LYS 9 -6.649 -14.062 27.456 1.00 0.06 H ATOM 151 2HD LYS 9 -6.494 -15.713 26.847 1.00 0.06 H ATOM 152 CE LYS 9 -5.321 -14.262 25.774 1.00 -0.01 C ATOM 153 1HE LYS 9 -4.449 -14.478 26.394 1.00 0.11 H ATOM 154 2HE LYS 9 -5.247 -14.871 24.872 1.00 0.11 H ATOM 155 NZ LYS 9 -5.281 -12.818 25.384 1.00 -0.38 N ATOM 156 1HZ LYS 9 -5.174 -12.216 26.196 1.00 0.17 H ATOM 157 2HZ LYS 9 -4.495 -12.617 24.776 1.00 0.17 H ATOM 158 3HZ LYS 9 -6.129 -12.540 24.902 1.00 0.17 H ATOM 159 N LEU 10 -11.323 -14.805 24.957 1.00 -0.42 N ATOM 160 H LEU 10 -11.036 -13.831 25.009 1.00 0.27 H ATOM 161 CA LEU 10 -12.594 -15.177 25.579 1.00 -0.05 C ATOM 162 HA LEU 10 -12.407 -15.945 26.327 1.00 0.09 H ATOM 163 C LEU 10 -13.556 -15.747 24.548 1.00 0.60 C ATOM 164 O LEU 10 -14.157 -16.789 24.768 1.00 -0.57 O ATOM 165 CB LEU 10 -13.243 -13.964 26.255 1.00 -0.11 C ATOM 166 1HB LEU 10 -12.542 -13.576 26.991 1.00 0.05 H ATOM 167 2HB LEU 10 -13.389 -13.200 25.493 1.00 0.05 H ATOM 168 CG LEU 10 -14.598 -14.170 26.951 1.00 0.35 C ATOM 169 HG LEU 10 -15.315 -14.515 26.211 1.00 -0.04 H ATOM 170 CD1 LEU 10 -14.548 -15.194 28.083 1.00 -0.41 C ATOM 171 1HD1 LEU 10 -14.307 -16.178 27.680 1.00 0.10 H ATOM 172 2HD1 LEU 10 -13.798 -14.909 28.821 1.00 0.10 H ATOM 173 3HD1 LEU 10 -15.524 -15.256 28.565 1.00 0.10 H ATOM 174 CD2 LEU 10 -15.089 -12.829 27.489 1.00 -0.41 C ATOM 175 1HD2 LEU 10 -15.174 -12.111 26.673 1.00 0.10 H ATOM 176 2HD2 LEU 10 -16.072 -12.954 27.943 1.00 0.10 H ATOM 177 3HD2 LEU 10 -14.395 -12.443 28.238 1.00 0.10 H ATOM 178 N VAL 11 -13.654 -15.129 23.380 1.00 -0.42 N ATOM 179 H VAL 11 -13.130 -14.274 23.202 1.00 0.27 H ATOM 180 CA VAL 11 -14.561 -15.652 22.355 1.00 -0.09 C ATOM 181 HA VAL 11 -15.531 -15.808 22.827 1.00 0.10 H ATOM 182 C VAL 11 -14.122 -17.011 21.817 1.00 0.60 C ATOM 183 O VAL 11 -14.925 -17.723 21.218 1.00 -0.57 O ATOM 184 CB VAL 11 -14.773 -14.660 21.178 1.00 0.30 C ATOM 185 HB VAL 11 -15.484 -15.108 20.485 1.00 -0.03 H ATOM 186 CG1 VAL 11 -15.382 -13.350 21.692 1.00 -0.32 C ATOM 187 1HG1 VAL 11 -14.690 -12.830 22.354 1.00 0.08 H ATOM 188 2HG1 VAL 11 -15.616 -12.698 20.850 1.00 0.08 H ATOM 189 3HG1 VAL 11 -16.305 -13.557 22.235 1.00 0.08 H ATOM 190 CG2 VAL 11 -13.469 -14.380 20.408 1.00 -0.32 C ATOM 191 1HG2 VAL 11 -12.732 -13.916 21.062 1.00 0.08 H ATOM 192 2HG2 VAL 11 -13.069 -15.308 20.005 1.00 0.08 H ATOM 193 3HG2 VAL 11 -13.680 -13.700 19.582 1.00 0.08 H ATOM 194 N LYS 12 -12.874 -17.401 22.050 1.00 -0.35 N ATOM 195 H LYS 12 -12.250 -16.796 22.568 1.00 0.28 H ATOM 196 CA LYS 12 -12.407 -18.724 21.637 1.00 -0.24 C ATOM 197 HA LYS 12 -12.843 -18.970 20.676 1.00 0.14 H ATOM 198 C LYS 12 -12.890 -19.764 22.633 1.00 0.73 C ATOM 199 O LYS 12 -13.458 -20.771 22.239 1.00 -0.59 O ATOM 200 CB LYS 12 -10.880 -18.786 21.514 1.00 -0.01 C ATOM 201 1HB LYS 12 -10.441 -18.632 22.497 1.00 0.04 H ATOM 202 2HB LYS 12 -10.600 -19.779 21.174 1.00 0.04 H ATOM 203 CG LYS 12 -10.270 -17.775 20.559 1.00 0.02 C ATOM 204 1HG LYS 12 -10.549 -16.782 20.889 1.00 0.01 H ATOM 205 2HG LYS 12 -9.185 -17.866 20.610 1.00 0.01 H ATOM 206 CD LYS 12 -10.709 -17.968 19.107 1.00 -0.05 C ATOM 207 1HD LYS 12 -10.487 -18.994 18.805 1.00 0.06 H ATOM 208 2HD LYS 12 -11.782 -17.801 19.017 1.00 0.06 H ATOM 209 CE LYS 12 -9.973 -17.008 18.176 1.00 -0.01 C ATOM 210 1HE LYS 12 -8.899 -17.183 18.274 1.00 0.11 H ATOM 211 2HE LYS 12 -10.263 -17.230 17.147 1.00 0.11 H ATOM 212 NZ LYS 12 -10.272 -15.562 18.475 1.00 -0.38 N ATOM 213 1HZ LYS 12 -11.252 -15.373 18.326 1.00 0.17 H ATOM 214 2HZ LYS 12 -10.047 -15.350 19.445 1.00 0.17 H ATOM 215 3HZ LYS 12 -9.722 -14.963 17.876 1.00 0.17 H ATOM 216 N VAL 13 -12.725 -19.515 23.923 1.00 -0.42 N ATOM 217 H VAL 13 -12.291 -18.655 24.233 1.00 0.27 H ATOM 218 CA VAL 13 -13.149 -20.508 24.915 1.00 -0.09 C ATOM 219 HA VAL 13 -12.812 -21.484 24.564 1.00 0.10 H ATOM 220 C VAL 13 -14.672 -20.588 25.000 1.00 0.60 C ATOM 221 O VAL 13 -15.225 -21.612 25.388 1.00 -0.57 O ATOM 222 CB VAL 13 -12.501 -20.280 26.309 1.00 0.30 C ATOM 223 HB VAL 13 -12.835 -21.076 26.974 1.00 -0.03 H ATOM 224 CG1 VAL 13 -10.969 -20.362 26.193 1.00 -0.32 C ATOM 225 1HG1 VAL 13 -10.685 -21.310 25.734 1.00 0.08 H ATOM 226 2HG1 VAL 13 -10.581 -19.539 25.591 1.00 0.08 H ATOM 227 3HG1 VAL 13 -10.527 -20.313 27.189 1.00 0.08 H ATOM 228 CG2 VAL 13 -12.893 -18.936 26.932 1.00 -0.32 C ATOM 229 1HG2 VAL 13 -12.498 -18.114 26.340 1.00 0.08 H ATOM 230 2HG2 VAL 13 -13.979 -18.850 26.993 1.00 0.08 H ATOM 231 3HG2 VAL 13 -12.486 -18.872 27.941 1.00 0.08 H ATOM 232 N LEU 14 -15.359 -19.559 24.521 1.00 -0.42 N ATOM 233 H LEU 14 -14.863 -18.708 24.286 1.00 0.27 H ATOM 234 CA LEU 14 -16.805 -19.605 24.290 1.00 -0.05 C ATOM 235 HA LEU 14 -17.272 -20.152 25.109 1.00 0.09 H ATOM 236 C LEU 14 -17.165 -20.350 22.994 1.00 0.60 C ATOM 237 O LEU 14 -17.863 -19.823 22.128 1.00 -0.57 O ATOM 238 CB LEU 14 -17.382 -18.181 24.271 1.00 -0.11 C ATOM 239 1HB LEU 14 -16.858 -17.620 23.499 1.00 0.05 H ATOM 240 2HB LEU 14 -18.430 -18.247 23.980 1.00 0.05 H ATOM 241 CG LEU 14 -17.334 -17.369 25.577 1.00 0.35 C ATOM 242 HG LEU 14 -16.311 -17.333 25.939 1.00 -0.04 H ATOM 243 CD1 LEU 14 -17.795 -15.939 25.298 1.00 -0.41 C ATOM 244 1HD1 LEU 14 -17.139 -15.479 24.560 1.00 0.10 H ATOM 245 2HD1 LEU 14 -18.821 -15.936 24.927 1.00 0.10 H ATOM 246 3HD1 LEU 14 -17.743 -15.353 26.216 1.00 0.10 H ATOM 247 CD2 LEU 14 -18.202 -17.976 26.680 1.00 -0.41 C ATOM 248 1HD2 LEU 14 -17.824 -18.962 26.949 1.00 0.10 H ATOM 249 2HD2 LEU 14 -18.164 -17.342 27.567 1.00 0.10 H ATOM 250 3HD2 LEU 14 -19.236 -18.064 26.344 1.00 0.10 H ATOM 251 N GLY 15 -16.703 -21.587 22.867 1.00 -0.42 N ATOM 252 H GLY 15 -16.090 -21.958 23.589 1.00 0.27 H ATOM 253 CA GLY 15 -17.141 -22.462 21.786 1.00 -0.03 C ATOM 254 1HA GLY 15 -16.979 -23.493 22.102 1.00 0.07 H ATOM 255 2HA GLY 15 -18.214 -22.325 21.658 1.00 0.07 H ATOM 256 C GLY 15 -16.505 -22.307 20.417 1.00 0.60 C ATOM 257 O GLY 15 -17.135 -22.635 19.415 1.00 -0.57 O ATOM 258 N HIS 16 -15.286 -21.789 20.354 1.00 -0.35 N ATOM 259 H HIS 16 -14.810 -21.524 21.215 1.00 0.28 H ATOM 260 CA HIS 16 -14.558 -21.599 19.093 1.00 -0.14 C ATOM 261 HA HIS 16 -14.984 -22.258 18.335 1.00 0.12 H ATOM 262 C HIS 16 -13.097 -21.996 19.285 1.00 0.73 C ATOM 263 O HIS 16 -12.176 -21.263 18.903 1.00 -0.59 O ATOM 264 CB HIS 16 -14.695 -20.154 18.602 1.00 -0.04 C ATOM 265 1HB HIS 16 -14.191 -19.493 19.297 1.00 0.08 H ATOM 266 2HB HIS 16 -14.206 -20.069 17.631 1.00 0.08 H ATOM 267 CG HIS 16 -16.117 -19.709 18.473 1.00 -0.00 C ATOM 268 ND1 HIS 16 -16.777 -18.981 19.452 1.00 -0.15 N ATOM 269 HD1 HIS 16 -16.350 -18.649 20.322 1.00 0.14 H ATOM 270 CD2 HIS 16 -17.055 -19.941 17.520 1.00 -0.11 C ATOM 271 HD2 HIS 16 -16.896 -20.506 16.610 1.00 0.23 H ATOM 272 CE1 HIS 16 -18.047 -18.834 19.108 1.00 -0.02 C ATOM 273 HE1 HIS 16 -18.804 -18.354 19.719 1.00 0.27 H ATOM 274 NE2 HIS 16 -18.237 -19.395 17.937 1.00 -0.17 N ATOM 275 HE2 HIS 16 -19.117 -19.447 17.439 1.00 0.14 H ATOM 276 N VAL 17 -12.936 -23.159 19.896 1.00 -0.42 N ATOM 277 H VAL 17 -13.754 -23.699 20.158 1.00 0.27 H ATOM 278 CA VAL 17 -11.683 -23.896 20.057 1.00 -0.09 C ATOM 279 HA VAL 17 -10.929 -23.575 19.341 1.00 0.10 H ATOM 280 C VAL 17 -12.171 -25.287 19.684 1.00 0.60 C ATOM 281 O VAL 17 -11.374 -26.229 19.535 1.00 -0.57 O ATOM 282 OXT VAL 17 -13.418 -25.378 19.564 1.00 -0.57 O ATOM 283 CB VAL 17 -11.114 -23.912 21.503 1.00 0.30 C ATOM 284 HB VAL 17 -10.357 -24.696 21.560 1.00 -0.03 H ATOM 285 CG1 VAL 17 -10.437 -22.588 21.824 1.00 -0.32 C ATOM 286 1HG1 VAL 17 -9.655 -22.395 21.090 1.00 0.08 H ATOM 287 2HG1 VAL 17 -11.172 -21.793 21.782 1.00 0.08 H ATOM 288 3HG1 VAL 17 -9.995 -22.631 22.817 1.00 0.08 H ATOM 289 CG2 VAL 17 -12.210 -24.203 22.550 1.00 -0.32 C ATOM 290 1HG2 VAL 17 -12.946 -23.401 22.568 1.00 0.08 H ATOM 291 2HG2 VAL 17 -12.709 -25.143 22.305 1.00 0.08 H ATOM 292 3HG2 VAL 17 -11.758 -24.299 23.536 1.00 0.08 H TER 293 VAL 17 END
SEQUENCE	INIKDILAKLVKVLGHV
HELICITY	94.10	INSTAB. INDEX	29.91	FLEXIBILITY	9.29
a HYD. MOM.	66.06	b HYD. MOM.	29.28	c HYD. MOM	5.16
a MEAN HYD. MOM.	3.89	b MEAN HYD. MOM.	1.72	c MEAN HYD. MOM.	0.30
CHARGE pH5	2.98	CHARGE pH7	2.09	CHARGE pH9	1.74
Δ CHARGE pH5-pH9	1.24	ISOELECTRIC POINT	9.70	BOMAN INDEX	-0.45
ΔG	8	CPP	-0,36	MLP	-4,82
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	Arthropoda	CLASS	Insecta	ORDER	Hymenoptera
FAMILY	Apidae	GENUS	Bombus	SPECIES	Megabombus pennsylvanicus
DATE	1984
TITLE PAPER	Bombolitins, a new class of mast cell degranulating peptides from the venom of the bumblebee Megabombus pennsylvanicus.