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ID	2455	NAME	Moricin-like peptide B   Blast NCBI-PROT
LENGTH	43	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\GKIPVKAIKKGGQIIGKALRGINIASTAHDIISQFKPKKKKNH.pdb REMARK YASARA Written on: Wed May 14 20:50:01 2014 REMARK YASARA Number of models: 1 REMARK YASARA Number of atoms: 701 REMARK YASARA Please address questions or suggestions to: Eliza@yasara.org REMARK YASARA COMPND MOL_ID: 1; COMPND 2 MOLECULE: MORICIN; COMPND 3 CHAIN: A; SEQRES 1 A 43 GLY LYS ILE PRO VAL LYS ALA ILE LYS LYS GLY GLY GLN SEQRES 2 A 43 ILE ILE GLY LYS ALA LEU ARG GLY ILE ASN ILE ALA SER SEQRES 3 A 43 THR ALA HIS ASP ILE ILE SER GLN PHE LYS PRO LYS LYS SEQRES 4 A 43 LYS LYS ASN HIS CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 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 1.000000 0.000000 0.000000 0.00000 SCALE2 0.000000 1.000000 0.000000 0.00000 SCALE3 0.000000 0.000000 1.000000 0.00000 ATOM 1 N GLY A 1 18.137 17.008 24.964 1.00-27.80 N ATOM 2 1H GLY A 1 17.285 16.778 24.474 1.00-27.80 H ATOM 3 2H GLY A 1 18.675 16.167 25.123 1.00-27.80 H ATOM 4 3H GLY A 1 18.686 17.650 24.410 1.00-27.80 H ATOM 5 CA GLY A 1 17.812 17.636 26.265 1.00-27.80 C ATOM 6 1HA GLY A 1 17.225 18.538 26.095 1.00-27.80 H ATOM 7 2HA GLY A 1 17.239 16.935 26.870 1.00-27.80 H ATOM 8 C GLY A 1 19.076 17.997 26.992 1.00-27.80 C ATOM 9 O GLY A 1 20.117 17.909 26.359 1.00-27.80 O ATOM 10 N LYS A 2 19.030 18.369 28.266 1.00 -8.42 N ATOM 11 H LYS A 2 18.149 18.437 28.753 1.00 -8.42 H ATOM 12 CA LYS A 2 20.263 18.600 29.025 1.00 -8.42 C ATOM 13 HA LYS A 2 20.914 19.286 28.482 1.00 -8.42 H ATOM 14 C LYS A 2 20.939 17.239 29.151 1.00 -8.42 C ATOM 15 O LYS A 2 20.246 16.238 29.311 1.00 -8.42 O ATOM 16 CB LYS A 2 19.939 19.170 30.413 1.00 -8.42 C ATOM 17 1HB LYS A 2 19.298 20.043 30.288 1.00 -8.42 H ATOM 18 2HB LYS A 2 19.385 18.419 30.977 1.00 -8.42 H ATOM 19 CG LYS A 2 21.167 19.586 31.223 1.00 -8.42 C ATOM 20 1HG LYS A 2 21.830 18.731 31.334 1.00 -8.42 H ATOM 21 2HG LYS A 2 21.697 20.375 30.690 1.00 -8.42 H ATOM 22 CD LYS A 2 20.795 20.085 32.612 1.00 -8.42 C ATOM 23 1HD LYS A 2 20.139 20.952 32.518 1.00 -8.42 H ATOM 24 2HD LYS A 2 20.271 19.293 33.147 1.00 -8.42 H ATOM 25 CE LYS A 2 22.052 20.475 33.388 1.00 -8.42 C ATOM 26 1HE LYS A 2 22.706 19.602 33.461 1.00 -8.42 H ATOM 27 2HE LYS A 2 22.581 21.255 32.834 1.00 -8.42 H ATOM 28 NZ LYS A 2 21.732 20.977 34.771 1.00 -8.42 N ATOM 29 1HZ LYS A 2 22.586 21.226 35.252 1.00 -8.42 H ATOM 30 2HZ LYS A 2 21.254 20.258 35.297 1.00 -8.42 H ATOM 31 3HZ LYS A 2 21.139 21.794 34.711 1.00 -8.42 H ATOM 32 N ILE A 3 22.261 17.205 29.084 1.00-16.93 N ATOM 33 H ILE A 3 22.777 18.054 28.934 1.00-16.93 H ATOM 34 CA ILE A 3 23.013 15.964 29.268 1.00-16.93 C ATOM 35 HA ILE A 3 22.654 15.225 28.556 1.00-16.93 H ATOM 36 C ILE A 3 22.726 15.508 30.708 1.00-16.93 C ATOM 37 O ILE A 3 22.814 16.328 31.633 1.00-16.93 O ATOM 38 CB ILE A 3 24.542 16.197 29.043 1.00-16.93 C ATOM 39 HB ILE A 3 24.886 16.934 29.768 1.00-16.93 H ATOM 40 CG1 ILE A 3 24.791 16.757 27.625 1.00-16.93 C ATOM 41 1HG1 ILE A 3 24.535 15.985 26.898 1.00-16.93 H ATOM 42 2HG1 ILE A 3 24.135 17.607 27.452 1.00-16.93 H ATOM 43 CG2 ILE A 3 25.340 14.889 29.250 1.00-16.93 C ATOM 44 1HG2 ILE A 3 26.409 15.080 29.158 1.00-16.93 H ATOM 45 2HG2 ILE A 3 25.048 14.140 28.511 1.00-16.93 H ATOM 46 3HG2 ILE A 3 25.162 14.498 30.249 1.00-16.93 H ATOM 47 CD1 ILE A 3 26.224 17.233 27.344 1.00-16.93 C ATOM 48 1HD1 ILE A 3 26.259 17.710 26.364 1.00-16.93 H ATOM 49 2HD1 ILE A 3 26.913 16.388 27.343 1.00-16.93 H ATOM 50 3HD1 ILE A 3 26.534 17.956 28.101 1.00-16.93 H ATOM 51 N PRO A 4 22.332 14.236 30.923 1.00 -1.86 N ATOM 52 CA PRO A 4 22.070 13.850 32.316 1.00 -1.86 C ATOM 53 HA PRO A 4 21.266 14.460 32.728 1.00 -1.86 H ATOM 54 C PRO A 4 23.312 13.941 33.192 1.00 -1.86 C ATOM 55 O PRO A 4 24.424 13.693 32.735 1.00 -1.86 O ATOM 56 CB PRO A 4 21.633 12.385 32.195 1.00 -1.86 C ATOM 57 1HB PRO A 4 22.491 11.727 32.338 1.00 -1.86 H ATOM 58 2HB PRO A 4 20.847 12.152 32.913 1.00 -1.86 H ATOM 59 CG PRO A 4 21.129 12.264 30.805 1.00 -1.86 C ATOM 60 1HG PRO A 4 21.144 11.226 30.471 1.00 -1.86 H ATOM 61 2HG PRO A 4 20.122 12.678 30.737 1.00 -1.86 H ATOM 62 CD PRO A 4 22.087 13.101 30.013 1.00 -1.86 C ATOM 63 1HD PRO A 4 23.013 12.559 29.821 1.00 -1.86 H ATOM 64 2HD PRO A 4 21.622 13.429 29.083 1.00 -1.86 H ATOM 65 N VAL A 5 23.145 14.237 34.474 1.00 5.65 N ATOM 66 H VAL A 5 22.219 14.390 34.843 1.00 5.65 H ATOM 67 CA VAL A 5 24.302 14.425 35.354 1.00 5.65 C ATOM 68 HA VAL A 5 24.958 15.147 34.870 1.00 5.65 H ATOM 69 C VAL A 5 25.144 13.168 35.553 1.00 5.65 C ATOM 70 O VAL A 5 26.334 13.259 35.832 1.00 5.65 O ATOM 71 CB VAL A 5 23.892 15.021 36.730 1.00 5.65 C ATOM 72 HB VAL A 5 24.793 15.150 37.328 1.00 5.65 H ATOM 73 CG1 VAL A 5 23.244 16.402 36.539 1.00 5.65 C ATOM 74 1HG1 VAL A 5 23.052 16.850 37.515 1.00 5.65 H ATOM 75 2HG1 VAL A 5 22.302 16.320 35.996 1.00 5.65 H ATOM 76 3HG1 VAL A 5 23.924 17.053 35.987 1.00 5.65 H ATOM 77 CG2 VAL A 5 22.924 14.097 37.498 1.00 5.65 C ATOM 78 1HG2 VAL A 5 22.685 14.548 38.464 1.00 5.65 H ATOM 79 2HG2 VAL A 5 23.392 13.131 37.684 1.00 5.65 H ATOM 80 3HG2 VAL A 5 21.994 13.955 36.947 1.00 5.65 H ATOM 81 N LYS A 6 24.572 11.988 35.340 1.00-13.27 N ATOM 82 H LYS A 6 23.592 11.947 35.111 1.00-13.27 H ATOM 83 CA LYS A 6 25.365 10.758 35.400 1.00-13.27 C ATOM 84 HA LYS A 6 25.956 10.756 36.316 1.00-13.27 H ATOM 85 C LYS A 6 26.341 10.711 34.230 1.00-13.27 C ATOM 86 O LYS A 6 27.477 10.284 34.386 1.00-13.27 O ATOM 87 CB LYS A 6 24.481 9.506 35.368 1.00-13.27 C ATOM 88 1HB LYS A 6 23.816 9.560 34.506 1.00-13.27 H ATOM 89 2HB LYS A 6 25.134 8.641 35.241 1.00-13.27 H ATOM 90 CG LYS A 6 23.649 9.289 36.630 1.00-13.27 C ATOM 91 1HG LYS A 6 24.303 9.350 37.499 1.00-13.27 H ATOM 92 2HG LYS A 6 22.885 10.064 36.702 1.00-13.27 H ATOM 93 CD LYS A 6 22.979 7.913 36.611 1.00-13.27 C ATOM 94 1HD LYS A 6 22.340 7.837 35.730 1.00-13.27 H ATOM 95 2HD LYS A 6 23.754 7.147 36.552 1.00-13.27 H ATOM 96 CE LYS A 6 22.140 7.672 37.870 1.00-13.27 C ATOM 97 1HE LYS A 6 22.778 7.799 38.748 1.00-13.27 H ATOM 98 2HE LYS A 6 21.342 8.418 37.913 1.00-13.27 H ATOM 99 NZ LYS A 6 21.534 6.290 37.897 1.00-13.27 N ATOM 100 1HZ LYS A 6 20.987 6.169 38.740 1.00-13.27 H ATOM 101 2HZ LYS A 6 22.266 5.592 37.880 1.00-13.27 H ATOM 102 3HZ LYS A 6 20.933 6.159 37.094 1.00-13.27 H ATOM 103 N ALA A 7 25.906 11.171 33.067 1.00 -6.61 N ATOM 104 H ALA A 7 24.981 11.563 32.993 1.00 -6.61 H ATOM 105 CA ALA A 7 26.751 11.166 31.881 1.00 -6.61 C ATOM 106 HA ALA A 7 27.261 10.205 31.814 1.00 -6.61 H ATOM 107 C ALA A 7 27.811 12.263 31.998 1.00 -6.61 C ATOM 108 O ALA A 7 28.952 12.052 31.605 1.00 -6.61 O ATOM 109 CB ALA A 7 25.892 11.353 30.626 1.00 -6.61 C ATOM 110 1HB ALA A 7 25.209 10.511 30.513 1.00 -6.61 H ATOM 111 2HB ALA A 7 26.539 11.406 29.747 1.00 -6.61 H ATOM 112 3HB ALA A 7 25.317 12.275 30.697 1.00 -6.61 H ATOM 113 N ILE A 8 27.457 13.398 32.587 1.00-12.75 N ATOM 114 H ILE A 8 26.489 13.539 32.856 1.00-12.75 H ATOM 115 CA ILE A 8 28.431 14.469 32.832 1.00-12.75 C ATOM 116 HA ILE A 8 28.904 14.732 31.885 1.00-12.75 H ATOM 117 C ILE A 8 29.521 13.943 33.767 1.00-12.75 C ATOM 118 O ILE A 8 30.714 14.086 33.496 1.00-12.75 O ATOM 119 CB ILE A 8 27.769 15.753 33.437 1.00-12.75 C ATOM 120 HB ILE A 8 27.265 15.479 34.364 1.00-12.75 H ATOM 121 CG1 ILE A 8 26.725 16.323 32.455 1.00-12.75 C ATOM 122 1HG1 ILE A 8 27.247 16.682 31.567 1.00-12.75 H ATOM 123 2HG1 ILE A 8 26.062 15.524 32.145 1.00-12.75 H ATOM 124 CG2 ILE A 8 28.836 16.833 33.760 1.00-12.75 C ATOM 125 1HG2 ILE A 8 28.374 17.712 34.208 1.00-12.75 H ATOM 126 2HG2 ILE A 8 29.361 17.132 32.849 1.00-12.75 H ATOM 127 3HG2 ILE A 8 29.568 16.449 34.471 1.00-12.75 H ATOM 128 CD1 ILE A 8 25.842 17.463 32.990 1.00-12.75 C ATOM 129 1HD1 ILE A 8 25.080 17.700 32.247 1.00-12.75 H ATOM 130 2HD1 ILE A 8 26.442 18.354 33.171 1.00-12.75 H ATOM 131 3HD1 ILE A 8 25.353 17.154 33.912 1.00-12.75 H ATOM 132 N LYS A 9 29.138 13.277 34.849 1.00-21.57 N ATOM 133 H LYS A 9 28.147 13.173 35.055 1.00-21.57 H ATOM 134 CA LYS A 9 30.134 12.712 35.765 1.00-21.57 C ATOM 135 HA LYS A 9 30.841 13.497 36.036 1.00-21.57 H ATOM 136 C LYS A 9 30.958 11.611 35.112 1.00-21.57 C ATOM 137 O LYS A 9 32.157 11.525 35.355 1.00-21.57 O ATOM 138 CB LYS A 9 29.477 12.199 37.048 1.00-21.57 C ATOM 139 1HB LYS A 9 28.634 11.556 36.793 1.00-21.57 H ATOM 140 2HB LYS A 9 30.214 11.611 37.596 1.00-21.57 H ATOM 141 CG LYS A 9 29.011 13.334 37.955 1.00-21.57 C ATOM 142 1HG LYS A 9 29.860 13.988 38.157 1.00-21.57 H ATOM 143 2HG LYS A 9 28.238 13.912 37.453 1.00-21.57 H ATOM 144 CD LYS A 9 28.471 12.820 39.281 1.00-21.57 C ATOM 145 1HD LYS A 9 27.620 12.164 39.095 1.00-21.57 H ATOM 146 2HD LYS A 9 29.257 12.258 39.788 1.00-21.57 H ATOM 147 CE LYS A 9 28.039 13.992 40.162 1.00-21.57 C ATOM 148 1HE LYS A 9 28.881 14.682 40.260 1.00-21.57 H ATOM 149 2HE LYS A 9 27.218 14.519 39.670 1.00-21.57 H ATOM 150 NZ LYS A 9 27.606 13.552 41.535 1.00-21.57 N ATOM 151 1HZ LYS A 9 27.319 14.355 42.080 1.00-21.57 H ATOM 152 2HZ LYS A 9 28.375 13.094 42.007 1.00-21.57 H ATOM 153 3HZ LYS A 9 26.831 12.907 41.464 1.00-21.57 H ATOM 154 N LYS A 10 30.357 10.803 34.250 1.00-23.80 N ATOM 155 H LYS A 10 29.353 10.877 34.110 1.00-23.80 H ATOM 156 CA LYS A 10 31.115 9.798 33.499 1.00-23.80 C ATOM 157 HA LYS A 10 31.661 9.176 34.208 1.00-23.80 H ATOM 158 C LYS A 10 32.137 10.470 32.587 1.00-23.80 C ATOM 159 O LYS A 10 33.270 10.014 32.500 1.00-23.80 O ATOM 160 CB LYS A 10 30.170 8.911 32.680 1.00-23.80 C ATOM 161 1HB LYS A 10 29.394 8.529 33.344 1.00-23.80 H ATOM 162 2HB LYS A 10 29.697 9.518 31.909 1.00-23.80 H ATOM 163 CG LYS A 10 30.858 7.727 32.010 1.00-23.80 C ATOM 164 1HG LYS A 10 31.646 8.093 31.354 1.00-23.80 H ATOM 165 2HG LYS A 10 31.300 7.091 32.776 1.00-23.80 H ATOM 166 CD LYS A 10 29.877 6.907 31.183 1.00-23.80 C ATOM 167 1HD LYS A 10 29.067 6.563 31.827 1.00-23.80 H ATOM 168 2HD LYS A 10 29.465 7.536 30.392 1.00-23.80 H ATOM 169 CE LYS A 10 30.581 5.703 30.560 1.00-23.80 C ATOM 170 1HE LYS A 10 31.410 6.061 29.944 1.00-23.80 H ATOM 171 2HE LYS A 10 30.991 5.083 31.361 1.00-23.80 H ATOM 172 NZ LYS A 10 29.657 4.870 29.712 1.00-23.80 N ATOM 173 1HZ LYS A 10 30.163 4.084 29.325 1.00-23.80 H ATOM 174 2HZ LYS A 10 29.288 5.428 28.953 1.00-23.80 H ATOM 175 3HZ LYS A 10 28.892 4.523 30.274 1.00-23.80 H ATOM 176 N GLY A 11 31.767 11.565 31.942 1.00 4.30 N ATOM 177 H GLY A 11 30.813 11.913 32.026 1.00 4.30 H ATOM 178 CA GLY A 11 32.705 12.281 31.093 1.00 4.30 C ATOM 179 1HA GLY A 11 33.117 11.592 30.356 1.00 4.30 H ATOM 180 2HA GLY A 11 32.190 13.092 30.579 1.00 4.30 H ATOM 181 C GLY A 11 33.848 12.851 31.907 1.00 4.30 C ATOM 182 O GLY A 11 35.005 12.720 31.525 1.00 4.30 O ATOM 183 N GLY A 12 33.549 13.416 33.069 1.00 -3.77 N ATOM 184 H GLY A 12 32.575 13.506 33.355 1.00 -3.77 H ATOM 185 CA GLY A 12 34.600 13.923 33.938 1.00 -3.77 C ATOM 186 1HA GLY A 12 35.194 14.651 33.385 1.00 -3.77 H ATOM 187 2HA GLY A 12 34.150 14.417 34.799 1.00 -3.77 H ATOM 188 C GLY A 12 35.525 12.824 34.425 1.00 -3.77 C ATOM 189 O GLY A 12 36.736 13.015 34.507 1.00 -3.77 O ATOM 190 N GLN A 13 34.984 11.644 34.692 1.00 -6.19 N ATOM 191 H GLN A 13 33.974 11.534 34.631 1.00 -6.19 H ATOM 192 CA GLN A 13 35.793 10.494 35.089 1.00 -6.19 C ATOM 193 HA GLN A 13 36.392 10.774 35.956 1.00 -6.19 H ATOM 194 C GLN A 13 36.740 10.084 33.957 1.00 -6.19 C ATOM 195 O GLN A 13 37.897 9.752 34.210 1.00 -6.19 O ATOM 196 CB GLN A 13 34.870 9.328 35.470 1.00 -6.19 C ATOM 197 1HB GLN A 13 34.104 9.706 36.147 1.00 -6.19 H ATOM 198 2HB GLN A 13 34.373 8.974 34.569 1.00 -6.19 H ATOM 199 CG GLN A 13 35.546 8.127 36.136 1.00 -6.19 C ATOM 200 1HG GLN A 13 34.811 7.328 36.228 1.00 -6.19 H ATOM 201 2HG GLN A 13 36.360 7.775 35.504 1.00 -6.19 H ATOM 202 CD GLN A 13 36.091 8.432 37.518 1.00 -6.19 C ATOM 203 OE1 GLN A 13 37.296 8.490 37.726 1.00 -6.19 O ATOM 204 NE2 GLN A 13 35.220 8.611 38.474 1.00 -6.19 N ATOM 205 1HE2 GLN A 13 35.557 8.804 39.402 1.00 -6.19 H ATOM 206 2HE2 GLN A 13 34.236 8.547 38.281 1.00 -6.19 H ATOM 207 N ILE A 14 36.278 10.123 32.714 1.00-13.74 N ATOM 208 H ILE A 14 35.308 10.388 32.553 1.00-13.74 H ATOM 209 CA ILE A 14 37.113 9.780 31.555 1.00-13.74 C ATOM 210 HA ILE A 14 37.620 8.839 31.760 1.00-13.74 H ATOM 211 C ILE A 14 38.193 10.843 31.328 1.00-13.74 C ATOM 212 O ILE A 14 39.352 10.498 31.101 1.00-13.74 O ATOM 213 CB ILE A 14 36.245 9.594 30.267 1.00-13.74 C ATOM 214 HB ILE A 14 35.640 10.490 30.127 1.00-13.74 H ATOM 215 CG1 ILE A 14 35.313 8.376 30.438 1.00-13.74 C ATOM 216 1HG1 ILE A 14 35.911 7.468 30.351 1.00-13.74 H ATOM 217 2HG1 ILE A 14 34.886 8.386 31.437 1.00-13.74 H ATOM 218 CG2 ILE A 14 37.126 9.391 29.002 1.00-13.74 C ATOM 219 1HG2 ILE A 14 36.501 9.248 28.121 1.00-13.74 H ATOM 220 2HG2 ILE A 14 37.780 8.527 29.124 1.00-13.74 H ATOM 221 3HG2 ILE A 14 37.739 10.276 28.824 1.00-13.74 H ATOM 222 CD1 ILE A 14 34.147 8.293 29.440 1.00-13.74 C ATOM 223 1HD1 ILE A 14 33.524 7.435 29.688 1.00-13.74 H ATOM 224 2HD1 ILE A 14 34.523 8.175 28.424 1.00-13.74 H ATOM 225 3HD1 ILE A 14 33.546 9.201 29.502 1.00-13.74 H ATOM 226 N ILE A 15 37.860 12.121 31.441 1.00-23.25 N ATOM 227 H ILE A 15 36.887 12.374 31.619 1.00-23.25 H ATOM 228 CA ILE A 15 38.856 13.192 31.291 1.00-23.25 C ATOM 229 HA ILE A 15 39.370 13.075 30.337 1.00-23.25 H ATOM 230 C ILE A 15 39.892 13.057 32.408 1.00-23.25 C ATOM 231 O ILE A 15 41.102 13.109 32.175 1.00-23.25 O ATOM 232 CB ILE A 15 38.183 14.600 31.328 1.00-23.25 C ATOM 233 HB ILE A 15 37.590 14.674 32.240 1.00-23.25 H ATOM 234 CG1 ILE A 15 37.250 14.767 30.110 1.00-23.25 C ATOM 235 1HG1 ILE A 15 37.864 14.911 29.221 1.00-23.25 H ATOM 236 2HG1 ILE A 15 36.679 13.853 29.966 1.00-23.25 H ATOM 237 CG2 ILE A 15 39.243 15.737 31.331 1.00-23.25 C ATOM 238 1HG2 ILE A 15 38.754 16.712 31.348 1.00-23.25 H ATOM 239 2HG2 ILE A 15 39.875 15.670 30.443 1.00-23.25 H ATOM 240 3HG2 ILE A 15 39.872 15.667 32.219 1.00-23.25 H ATOM 241 CD1 ILE A 15 36.245 15.924 30.206 1.00-23.25 C ATOM 242 1HD1 ILE A 15 35.591 15.903 29.334 1.00-23.25 H ATOM 243 2HD1 ILE A 15 36.766 16.880 30.232 1.00-23.25 H ATOM 244 3HD1 ILE A 15 35.638 15.813 31.106 1.00-23.25 H ATOM 245 N GLY A 16 39.431 12.793 33.621 1.00 -9.86 N ATOM 246 H GLY A 16 38.424 12.767 33.792 1.00 -9.86 H ATOM 247 CA GLY A 16 40.342 12.555 34.725 1.00 -9.86 C ATOM 248 1HA GLY A 16 41.004 13.414 34.833 1.00 -9.86 H ATOM 249 2HA GLY A 16 39.764 12.435 35.641 1.00 -9.86 H ATOM 250 C GLY A 16 41.188 11.316 34.507 1.00 -9.86 C ATOM 251 O GLY A 16 42.336 11.264 34.932 1.00 -9.86 O ATOM 252 N LYS A 17 40.655 10.290 33.858 1.00-19.85 N ATOM 253 H LYS A 17 39.689 10.352 33.534 1.00-19.85 H ATOM 254 CA LYS A 17 41.419 9.069 33.577 1.00-19.85 C ATOM 255 HA LYS A 17 41.899 8.724 34.491 1.00-19.85 H ATOM 256 C LYS A 17 42.513 9.380 32.569 1.00-19.85 C ATOM 257 O LYS A 17 43.631 8.908 32.732 1.00-19.85 O ATOM 258 CB LYS A 17 40.505 7.957 33.046 1.00-19.85 C ATOM 259 1HB LYS A 17 39.673 7.831 33.738 1.00-19.85 H ATOM 260 2HB LYS A 17 40.106 8.261 32.080 1.00-19.85 H ATOM 261 CG LYS A 17 41.194 6.608 32.875 1.00-19.85 C ATOM 262 1HG LYS A 17 42.047 6.722 32.205 1.00-19.85 H ATOM 263 2HG LYS A 17 41.548 6.259 33.845 1.00-19.85 H ATOM 264 CD LYS A 17 40.246 5.573 32.282 1.00-19.85 C ATOM 265 1HD LYS A 17 39.376 5.470 32.931 1.00-19.85 H ATOM 266 2HD LYS A 17 39.920 5.914 31.298 1.00-19.85 H ATOM 267 CE LYS A 17 40.946 4.221 32.143 1.00-19.85 C ATOM 268 1HE LYS A 17 41.841 4.350 31.530 1.00-19.85 H ATOM 269 2HE LYS A 17 41.255 3.880 33.134 1.00-19.85 H ATOM 270 NZ LYS A 17 40.061 3.177 31.512 1.00-19.85 N ATOM 271 1HZ LYS A 17 40.561 2.301 31.442 1.00-19.85 H ATOM 272 2HZ LYS A 17 39.786 3.473 30.585 1.00-19.85 H ATOM 273 3HZ LYS A 17 39.234 3.039 32.076 1.00-19.85 H ATOM 274 N ALA A 18 42.213 10.193 31.569 1.00 -5.05 N ATOM 275 H ALA A 18 41.262 10.546 31.470 1.00 -5.05 H ATOM 276 CA ALA A 18 43.214 10.587 30.586 1.00 -5.05 C ATOM 277 HA ALA A 18 43.655 9.687 30.156 1.00 -5.05 H ATOM 278 C ALA A 18 44.329 11.380 31.272 1.00 -5.05 C ATOM 279 O ALA A 18 45.503 11.090 31.079 1.00 -5.05 O ATOM 280 CB ALA A 18 42.559 11.407 29.465 1.00 -5.05 C ATOM 281 1HB ALA A 18 41.777 10.818 28.984 1.00 -5.05 H ATOM 282 2HB ALA A 18 43.312 11.673 28.722 1.00 -5.05 H ATOM 283 3HB ALA A 18 42.120 12.321 29.869 1.00 -5.05 H ATOM 284 N LEU A 19 43.971 12.335 32.119 1.00-14.20 N ATOM 285 H LEU A 19 42.982 12.551 32.241 1.00-14.20 H ATOM 286 CA LEU A 19 44.971 13.117 32.848 1.00-14.20 C ATOM 287 HA LEU A 19 45.637 13.583 32.122 1.00-14.20 H ATOM 288 C LEU A 19 45.826 12.248 33.768 1.00-14.20 C ATOM 289 O LEU A 19 47.044 12.397 33.833 1.00-14.20 O ATOM 290 CB LEU A 19 44.276 14.210 33.666 1.00-14.20 C ATOM 291 1HB LEU A 19 43.662 14.800 32.985 1.00-14.20 H ATOM 292 2HB LEU A 19 43.610 13.724 34.378 1.00-14.20 H ATOM 293 CG LEU A 19 45.179 15.173 34.456 1.00-14.20 C ATOM 294 HG LEU A 19 45.764 14.593 35.168 1.00-14.20 H ATOM 295 CD1 LEU A 19 46.147 15.955 33.568 1.00-14.20 C ATOM 296 1HD1 LEU A 19 46.711 16.667 34.172 1.00-14.20 H ATOM 297 2HD1 LEU A 19 45.601 16.495 32.793 1.00-14.20 H ATOM 298 3HD1 LEU A 19 46.860 15.274 33.102 1.00-14.20 H ATOM 299 CD2 LEU A 19 44.310 16.144 35.247 1.00-14.20 C ATOM 300 1HD2 LEU A 19 44.942 16.802 35.845 1.00-14.20 H ATOM 301 2HD2 LEU A 19 43.650 15.594 35.918 1.00-14.20 H ATOM 302 3HD2 LEU A 19 43.708 16.751 34.568 1.00-14.20 H ATOM 303 N ARG A 20 45.205 11.298 34.453 1.00-16.90 N ATOM 304 H ARG A 20 44.192 11.222 34.390 1.00-16.90 H ATOM 305 CA ARG A 20 45.953 10.354 35.287 1.00-16.90 C ATOM 306 HA ARG A 20 46.586 10.913 35.976 1.00-16.90 H ATOM 307 C ARG A 20 46.888 9.517 34.427 1.00-16.90 C ATOM 308 O ARG A 20 48.024 9.308 34.815 1.00-16.90 O ATOM 309 CB ARG A 20 45.001 9.469 36.100 1.00-16.90 C ATOM 310 1HB ARG A 20 44.187 9.149 35.452 1.00-16.90 H ATOM 311 2HB ARG A 20 45.542 8.585 36.439 1.00-16.90 H ATOM 312 CG ARG A 20 44.439 10.189 37.332 1.00-16.90 C ATOM 313 1HG ARG A 20 45.254 10.336 38.041 1.00-16.90 H ATOM 314 2HG ARG A 20 44.061 11.168 37.037 1.00-16.90 H ATOM 315 CD ARG A 20 43.308 9.428 38.030 1.00-16.90 C ATOM 316 1HD ARG A 20 43.606 8.389 38.183 1.00-16.90 H ATOM 317 2HD ARG A 20 43.130 9.893 39.000 1.00-16.90 H ATOM 318 NE ARG A 20 42.066 9.489 37.245 1.00-16.90 N ATOM 319 HE ARG A 20 42.139 9.962 36.350 1.00-16.90 H ATOM 320 CZ ARG A 20 40.871 9.037 37.603 1.00-16.90 C ATOM 321 NH1 ARG A 20 39.877 9.151 36.774 1.00-16.90 N ATOM 322 1HH1 ARG A 20 40.008 9.519 35.846 1.00-16.90 H ATOM 323 2HH1 ARG A 20 38.942 8.871 37.070 1.00-16.90 H ATOM 324 NH2 ARG A 20 40.610 8.486 38.759 1.00-16.90 N ATOM 325 1HH2 ARG A 20 41.343 8.366 39.437 1.00-16.90 H ATOM 326 2HH2 ARG A 20 39.665 8.192 38.965 1.00-16.90 H ATOM 327 N GLY A 21 46.457 9.100 33.247 1.00 -6.01 N ATOM 328 H GLY A 21 45.506 9.302 32.951 1.00 -6.01 H ATOM 329 CA GLY A 21 47.331 8.362 32.350 1.00 -6.01 C ATOM 330 1HA GLY A 21 47.701 7.476 32.866 1.00 -6.01 H ATOM 331 2HA GLY A 21 46.765 8.049 31.474 1.00 -6.01 H ATOM 332 C GLY A 21 48.526 9.175 31.889 1.00 -6.01 C ATOM 333 O GLY A 21 49.636 8.658 31.857 1.00 -6.01 O ATOM 334 N ILE A 22 48.330 10.452 31.590 1.00-18.97 N ATOM 335 H ILE A 22 47.385 10.831 31.616 1.00-18.97 H ATOM 336 CA ILE A 22 49.431 11.342 31.204 1.00-18.97 C ATOM 337 HA ILE A 22 49.974 10.900 30.368 1.00-18.97 H ATOM 338 C ILE A 22 50.405 11.477 32.374 1.00-18.97 C ATOM 339 O ILE A 22 51.619 11.404 32.191 1.00-18.97 O ATOM 340 CB ILE A 22 48.899 12.749 30.772 1.00-18.97 C ATOM 341 HB ILE A 22 48.269 13.136 31.572 1.00-18.97 H ATOM 342 CG1 ILE A 22 48.052 12.621 29.490 1.00-18.97 C ATOM 343 1HG1 ILE A 22 48.724 12.458 28.646 1.00-18.97 H ATOM 344 2HG1 ILE A 22 47.412 11.747 29.567 1.00-18.97 H ATOM 345 CG2 ILE A 22 50.059 13.755 30.532 1.00-18.97 C ATOM 346 1HG2 ILE A 22 49.666 14.719 30.210 1.00-18.97 H ATOM 347 2HG2 ILE A 22 50.742 13.373 29.772 1.00-18.97 H ATOM 348 3HG2 ILE A 22 50.612 13.917 31.459 1.00-18.97 H ATOM 349 CD1 ILE A 22 47.150 13.825 29.174 1.00-18.97 C ATOM 350 1HD1 ILE A 22 46.544 13.598 28.297 1.00-18.97 H ATOM 351 2HD1 ILE A 22 47.753 14.708 28.967 1.00-18.97 H ATOM 352 3HD1 ILE A 22 46.489 14.024 30.019 1.00-18.97 H ATOM 353 N ASN A 23 49.892 11.622 33.586 1.00-12.65 N ATOM 354 H ASN A 23 48.884 11.676 33.700 1.00-12.65 H ATOM 355 CA ASN A 23 50.762 11.746 34.756 1.00-12.65 C ATOM 356 HA ASN A 23 51.498 12.524 34.554 1.00-12.65 H ATOM 357 C ASN A 23 51.530 10.457 35.052 1.00-12.65 C ATOM 358 O ASN A 23 52.685 10.496 35.467 1.00-12.65 O ATOM 359 CB ASN A 23 49.951 12.156 35.988 1.00-12.65 C ATOM 360 1HB ASN A 23 49.129 11.458 36.127 1.00-12.65 H ATOM 361 2HB ASN A 23 50.601 12.111 36.861 1.00-12.65 H ATOM 362 CG ASN A 23 49.403 13.559 35.882 1.00-12.65 C ATOM 363 OD1 ASN A 23 49.970 14.420 35.232 1.00-12.65 O ATOM 364 ND2 ASN A 23 48.301 13.806 36.535 1.00-12.65 N ATOM 365 1HD2 ASN A 23 47.915 14.731 36.471 1.00-12.65 H ATOM 366 2HD2 ASN A 23 47.862 13.086 37.075 1.00-12.65 H ATOM 367 N ILE A 24 50.924 9.304 34.814 1.00-22.48 N ATOM 368 H ILE A 24 49.950 9.297 34.518 1.00-22.48 H ATOM 369 CA ILE A 24 51.628 8.031 34.983 1.00-22.48 C ATOM 370 HA ILE A 24 52.139 8.029 35.946 1.00-22.48 H ATOM 371 C ILE A 24 52.693 7.934 33.893 1.00-22.48 C ATOM 372 O ILE A 24 53.818 7.523 34.166 1.00-22.48 O ATOM 373 CB ILE A 24 50.647 6.817 34.937 1.00-22.48 C ATOM 374 HB ILE A 24 50.044 6.897 34.032 1.00-22.48 H ATOM 375 CG1 ILE A 24 49.721 6.849 36.170 1.00-22.48 C ATOM 376 1HG1 ILE A 24 50.292 6.526 37.040 1.00-22.48 H ATOM 377 2HG1 ILE A 24 49.404 7.872 36.353 1.00-22.48 H ATOM 378 CG2 ILE A 24 51.408 5.462 34.905 1.00-22.48 C ATOM 379 1HG2 ILE A 24 50.705 4.630 34.897 1.00-22.48 H ATOM 380 2HG2 ILE A 24 52.061 5.374 35.776 1.00-22.48 H ATOM 381 3HG2 ILE A 24 52.015 5.395 34.001 1.00-22.48 H ATOM 382 CD1 ILE A 24 48.454 5.985 36.064 1.00-22.48 C ATOM 383 1HD1 ILE A 24 47.843 6.134 36.954 1.00-22.48 H ATOM 384 2HD1 ILE A 24 48.719 4.931 35.991 1.00-22.48 H ATOM 385 3HD1 ILE A 24 47.880 6.279 35.184 1.00-22.48 H ATOM 386 N ALA A 25 52.385 8.353 32.675 1.00-18.61 N ATOM 387 H ALA A 25 51.447 8.697 32.479 1.00-18.61 H ATOM 388 CA ALA A 25 53.358 8.301 31.589 1.00-18.61 C ATOM 389 HA ALA A 25 53.737 7.280 31.525 1.00-18.61 H ATOM 390 C ALA A 25 54.557 9.222 31.843 1.00-18.61 C ATOM 391 O ALA A 25 55.693 8.843 31.567 1.00-18.61 O ATOM 392 CB ALA A 25 52.676 8.652 30.260 1.00-18.61 C ATOM 393 1HB ALA A 25 51.844 7.969 30.082 1.00-18.61 H ATOM 394 2HB ALA A 25 53.395 8.561 29.446 1.00-18.61 H ATOM 395 3HB ALA A 25 52.298 9.674 30.293 1.00-18.61 H ATOM 396 N SER A 26 54.335 10.411 32.384 1.00-22.25 N ATOM 397 H SER A 26 53.381 10.719 32.575 1.00-22.25 H ATOM 398 CA SER A 26 55.446 11.312 32.687 1.00-22.25 C ATOM 399 HA SER A 26 56.108 11.350 31.822 1.00-22.25 H ATOM 400 C SER A 26 56.263 10.798 33.870 1.00-22.25 C ATOM 401 O SER A 26 57.487 10.911 33.871 1.00-22.25 O ATOM 402 CB SER A 26 54.929 12.725 32.957 1.00-22.25 C ATOM 403 1HB SER A 26 55.771 13.379 33.189 1.00-22.25 H ATOM 404 2HB SER A 26 54.428 13.093 32.061 1.00-22.25 H ATOM 405 OG SER A 26 54.006 12.733 34.029 1.00-22.25 O ATOM 406 HG SER A 26 53.597 13.602 34.082 1.00-22.25 H ATOM 407 N THR A 27 55.616 10.165 34.838 1.00-13.03 N ATOM 408 H THR A 27 54.601 10.135 34.827 1.00-13.03 H ATOM 409 CA THR A 27 56.339 9.535 35.944 1.00-13.03 C ATOM 410 HA THR A 27 57.008 10.271 36.391 1.00-13.03 H ATOM 411 C THR A 27 57.181 8.375 35.416 1.00-13.03 C ATOM 412 O THR A 27 58.336 8.211 35.786 1.00-13.03 O ATOM 413 CB THR A 27 55.365 9.017 37.032 1.00-13.03 C ATOM 414 HB THR A 27 54.752 8.214 36.622 1.00-13.03 H ATOM 415 OG1 THR A 27 54.516 10.085 37.460 1.00-13.03 O ATOM 416 HG1 THR A 27 53.890 10.291 36.747 1.00-13.03 H ATOM 417 CG2 THR A 27 56.091 8.519 38.269 1.00-13.03 C ATOM 418 1HG2 THR A 27 55.358 8.237 39.023 1.00-13.03 H ATOM 419 2HG2 THR A 27 56.727 9.312 38.667 1.00-13.03 H ATOM 420 3HG2 THR A 27 56.704 7.654 38.022 1.00-13.03 H ATOM 421 N ALA A 28 56.630 7.583 34.508 1.00-11.44 N ATOM 422 H ALA A 28 55.665 7.736 34.225 1.00-11.44 H ATOM 423 CA ALA A 28 57.372 6.474 33.918 1.00-11.44 C ATOM 424 HA ALA A 28 57.760 5.848 34.721 1.00-11.44 H ATOM 425 C ALA A 28 58.562 6.997 33.113 1.00-11.44 C ATOM 426 O ALA A 28 59.639 6.415 33.153 1.00-11.44 O ATOM 427 CB ALA A 28 56.440 5.633 33.036 1.00-11.44 C ATOM 428 1HB ALA A 28 55.607 5.260 33.633 1.00-11.44 H ATOM 429 2HB ALA A 28 56.994 4.788 32.626 1.00-11.44 H ATOM 430 3HB ALA A 28 56.051 6.239 32.217 1.00-11.44 H ATOM 431 N HIS A 29 58.381 8.106 32.411 1.00-15.89 N ATOM 432 H HIS A 29 57.460 8.535 32.379 1.00-15.89 H ATOM 433 CA HIS A 29 59.474 8.724 31.667 1.00-15.89 C ATOM 434 HA HIS A 29 59.880 7.994 30.967 1.00-15.89 H ATOM 435 C HIS A 29 60.597 9.156 32.606 1.00-15.89 C ATOM 436 O HIS A 29 61.768 8.903 32.322 1.00-15.89 O ATOM 437 CB HIS A 29 58.966 9.930 30.874 1.00-15.89 C ATOM 438 1HB HIS A 29 58.101 9.623 30.286 1.00-15.89 H ATOM 439 2HB HIS A 29 58.651 10.705 31.569 1.00-15.89 H ATOM 440 CG HIS A 29 59.991 10.508 29.949 1.00-15.89 C ATOM 441 ND1 HIS A 29 60.180 10.100 28.650 1.00-15.89 N ATOM 442 HD1 HIS A 29 59.656 9.385 28.171 1.00-15.89 H ATOM 443 CD2 HIS A 29 60.915 11.485 30.150 1.00-15.89 C ATOM 444 HD2 HIS A 29 61.056 12.021 31.079 1.00-15.89 H ATOM 445 CE1 HIS A 29 61.174 10.823 28.129 1.00-15.89 C ATOM 446 HE1 HIS A 29 61.540 10.721 27.116 1.00-15.89 H ATOM 447 NE2 HIS A 29 61.649 11.687 29.002 1.00-15.89 N ATOM 448 N ASP A 30 60.260 9.748 33.745 1.00 2.66 N ATOM 449 H ASP A 30 59.287 9.967 33.948 1.00 2.66 H ATOM 450 CA ASP A 30 61.288 10.087 34.730 1.00 2.66 C ATOM 451 HA ASP A 30 62.038 10.718 34.253 1.00 2.66 H ATOM 452 C ASP A 30 61.985 8.835 35.241 1.00 2.66 C ATOM 453 O ASP A 30 63.202 8.804 35.295 1.00 2.66 O ATOM 454 CB ASP A 30 60.731 10.828 35.943 1.00 2.66 C ATOM 455 1HB ASP A 30 60.251 11.750 35.616 1.00 2.66 H ATOM 456 2HB ASP A 30 59.984 10.199 36.425 1.00 2.66 H ATOM 457 CG ASP A 30 61.822 11.142 36.957 1.00 2.66 C ATOM 458 OD1 ASP A 30 62.827 11.787 36.584 1.00 2.66 O ATOM 459 OD2 ASP A 30 61.706 10.705 38.119 1.00 2.66 O ATOM 460 N ILE A 31 61.251 7.777 35.551 1.00-21.53 N ATOM 461 H ILE A 31 60.237 7.835 35.472 1.00-21.53 H ATOM 462 CA ILE A 31 61.869 6.539 36.040 1.00-21.53 C ATOM 463 HA ILE A 31 62.468 6.781 36.918 1.00-21.53 H ATOM 464 C ILE A 31 62.828 5.975 34.989 1.00-21.53 C ATOM 465 O ILE A 31 63.930 5.546 35.330 1.00-21.53 O ATOM 466 CB ILE A 31 60.789 5.487 36.455 1.00-21.53 C ATOM 467 HB ILE A 31 60.106 5.350 35.617 1.00-21.53 H ATOM 468 CG1 ILE A 31 59.997 6.007 37.672 1.00-21.53 C ATOM 469 1HG1 ILE A 31 60.636 5.940 38.553 1.00-21.53 H ATOM 470 2HG1 ILE A 31 59.760 7.057 37.525 1.00-21.53 H ATOM 471 CG2 ILE A 31 61.426 4.111 36.802 1.00-21.53 C ATOM 472 1HG2 ILE A 31 60.658 3.400 37.103 1.00-21.53 H ATOM 473 2HG2 ILE A 31 62.152 4.226 37.610 1.00-21.53 H ATOM 474 3HG2 ILE A 31 61.935 3.703 35.928 1.00-21.53 H ATOM 475 CD1 ILE A 31 58.678 5.273 37.964 1.00-21.53 C ATOM 476 1HD1 ILE A 31 58.178 5.759 38.801 1.00-21.53 H ATOM 477 2HD1 ILE A 31 58.870 4.233 38.224 1.00-21.53 H ATOM 478 3HD1 ILE A 31 58.030 5.319 37.088 1.00-21.53 H ATOM 479 N ILE A 32 62.474 6.029 33.713 1.00 -9.30 N ATOM 480 H ILE A 32 61.547 6.372 33.468 1.00 -9.30 H ATOM 481 CA ILE A 32 63.387 5.601 32.648 1.00 -9.30 C ATOM 482 HA ILE A 32 63.722 4.586 32.857 1.00 -9.30 H ATOM 483 C ILE A 32 64.623 6.507 32.634 1.00 -9.30 C ATOM 484 O ILE A 32 65.747 6.020 32.503 1.00 -9.30 O ATOM 485 CB ILE A 32 62.678 5.612 31.255 1.00 -9.30 C ATOM 486 HB ILE A 32 62.234 6.594 31.102 1.00 -9.30 H ATOM 487 CG1 ILE A 32 61.564 4.545 31.228 1.00 -9.30 C ATOM 488 1HG1 ILE A 32 62.028 3.563 31.131 1.00 -9.30 H ATOM 489 2HG1 ILE A 32 61.031 4.557 32.175 1.00 -9.30 H ATOM 490 CG2 ILE A 32 63.676 5.334 30.095 1.00 -9.30 C ATOM 491 1HG2 ILE A 32 63.154 5.320 29.139 1.00 -9.30 H ATOM 492 2HG2 ILE A 32 64.177 4.376 30.248 1.00 -9.30 H ATOM 493 3HG2 ILE A 32 64.428 6.122 30.052 1.00 -9.30 H ATOM 494 CD1 ILE A 32 60.522 4.711 30.111 1.00 -9.30 C ATOM 495 1HD1 ILE A 32 59.749 3.950 30.227 1.00 -9.30 H ATOM 496 2HD1 ILE A 32 60.989 4.594 29.134 1.00 -9.30 H ATOM 497 3HD1 ILE A 32 60.061 5.697 30.181 1.00 -9.30 H ATOM 498 N SER A 33 64.463 7.810 32.813 1.00 -3.52 N ATOM 499 H SER A 33 63.526 8.194 32.941 1.00 -3.52 H ATOM 500 CA SER A 33 65.617 8.711 32.813 1.00 -3.52 C ATOM 501 HA SER A 33 66.227 8.464 31.944 1.00 -3.52 H ATOM 502 C SER A 33 66.488 8.547 34.058 1.00 -3.52 C ATOM 503 O SER A 33 67.693 8.822 34.027 1.00 -3.52 O ATOM 504 CB SER A 33 65.176 10.170 32.680 1.00 -3.52 C ATOM 505 1HB SER A 33 66.041 10.767 32.393 1.00 -3.52 H ATOM 506 2HB SER A 33 64.422 10.248 31.895 1.00 -3.52 H ATOM 507 OG SER A 33 64.665 10.698 33.891 1.00 -3.52 O ATOM 508 HG SER A 33 64.041 10.073 34.296 1.00 -3.52 H ATOM 509 N GLN A 34 65.906 8.072 35.152 1.00 -9.82 N ATOM 510 H GLN A 34 64.895 7.934 35.166 1.00 -9.82 H ATOM 511 CA GLN A 34 66.684 7.786 36.348 1.00 -9.82 C ATOM 512 HA GLN A 34 67.429 8.553 36.425 1.00 -9.82 H ATOM 513 C GLN A 34 67.425 6.461 36.232 1.00 -9.82 C ATOM 514 O GLN A 34 68.580 6.366 36.645 1.00 -9.82 O ATOM 515 CB GLN A 34 65.860 7.848 37.638 1.00 -9.82 C ATOM 516 1HB GLN A 34 65.070 7.097 37.602 1.00 -9.82 H ATOM 517 2HB GLN A 34 66.529 7.598 38.460 1.00 -9.82 H ATOM 518 CG GLN A 34 65.232 9.220 37.951 1.00 -9.82 C ATOM 519 1HG GLN A 34 64.394 9.386 37.287 1.00 -9.82 H ATOM 520 2HG GLN A 34 64.843 9.204 38.968 1.00 -9.82 H ATOM 521 CD GLN A 34 66.178 10.404 37.799 1.00 -9.82 C ATOM 522 OE1 GLN A 34 67.387 10.328 38.052 1.00 -9.82 O ATOM 523 NE2 GLN A 34 65.644 11.507 37.353 1.00 -9.82 N ATOM 524 1HE2 GLN A 34 66.211 12.326 37.249 1.00 -9.82 H ATOM 525 2HE2 GLN A 34 64.644 11.536 37.120 1.00 -9.82 H ATOM 526 N PHE A 35 66.782 5.475 35.624 1.00 -4.71 N ATOM 527 H PHE A 35 65.813 5.618 35.341 1.00 -4.71 H ATOM 528 CA PHE A 35 67.393 4.175 35.349 1.00 -4.71 C ATOM 529 HA PHE A 35 67.789 3.754 36.272 1.00 -4.71 H ATOM 530 C PHE A 35 68.541 4.295 34.349 1.00 -4.71 C ATOM 531 O PHE A 35 69.557 3.613 34.464 1.00 -4.71 O ATOM 532 CB PHE A 35 66.317 3.240 34.787 1.00 -4.71 C ATOM 533 1HB PHE A 35 65.508 3.164 35.514 1.00 -4.71 H ATOM 534 2HB PHE A 35 65.917 3.672 33.871 1.00 -4.71 H ATOM 535 CG PHE A 35 66.818 1.857 34.479 1.00 -4.71 C ATOM 536 CD1 PHE A 35 66.927 0.894 35.498 1.00 -4.71 C ATOM 537 HD1 PHE A 35 66.649 1.149 36.510 1.00 -4.71 H ATOM 538 CD2 PHE A 35 67.187 1.510 33.165 1.00 -4.71 C ATOM 539 HD2 PHE A 35 67.107 2.242 32.374 1.00 -4.71 H ATOM 540 CE1 PHE A 35 67.411 -0.408 35.216 1.00 -4.71 C ATOM 541 HE1 PHE A 35 67.501 -1.136 36.010 1.00 -4.71 H ATOM 542 CE2 PHE A 35 67.674 0.214 32.866 1.00 -4.71 C ATOM 543 HE2 PHE A 35 67.965 -0.036 31.857 1.00 -4.71 H ATOM 544 CZ PHE A 35 67.785 -0.749 33.896 1.00 -4.71 C ATOM 545 HZ PHE A 35 68.163 -1.737 33.676 1.00 -4.71 H ATOM 546 N LYS A 36 68.383 5.179 33.372 1.00 9.99 N ATOM 547 H LYS A 36 67.504 5.688 33.310 1.00 9.99 H ATOM 548 CA LYS A 36 69.429 5.446 32.384 1.00 9.99 C ATOM 549 HA LYS A 36 69.631 4.522 31.851 1.00 9.99 H ATOM 550 C LYS A 36 70.700 5.909 33.110 1.00 9.99 C ATOM 551 O LYS A 36 70.664 6.903 33.840 1.00 9.99 O ATOM 552 CB LYS A 36 68.912 6.502 31.394 1.00 9.99 C ATOM 553 1HB LYS A 36 68.001 6.110 30.940 1.00 9.99 H ATOM 554 2HB LYS A 36 68.645 7.402 31.948 1.00 9.99 H ATOM 555 CG LYS A 36 69.867 6.893 30.270 1.00 9.99 C ATOM 556 1HG LYS A 36 70.595 6.096 30.121 1.00 9.99 H ATOM 557 2HG LYS A 36 69.296 7.028 29.351 1.00 9.99 H ATOM 558 CD LYS A 36 70.587 8.199 30.590 1.00 9.99 C ATOM 559 1HD LYS A 36 69.854 8.999 30.702 1.00 9.99 H ATOM 560 2HD LYS A 36 71.117 8.087 31.531 1.00 9.99 H ATOM 561 CE LYS A 36 71.588 8.575 29.507 1.00 9.99 C ATOM 562 1HE LYS A 36 72.231 7.716 29.301 1.00 9.99 H ATOM 563 2HE LYS A 36 71.054 8.852 28.596 1.00 9.99 H ATOM 564 NZ LYS A 36 72.437 9.715 29.976 1.00 9.99 N ATOM 565 1HZ LYS A 36 73.013 10.064 29.223 1.00 9.99 H ATOM 566 2HZ LYS A 36 73.030 9.402 30.735 1.00 9.99 H ATOM 567 3HZ LYS A 36 71.847 10.472 30.313 1.00 9.99 H ATOM 568 N PRO A 37 71.834 5.201 32.936 1.00-10.24 N ATOM 569 CA PRO A 37 73.013 5.679 33.668 1.00-10.24 C ATOM 570 HA PRO A 37 72.768 5.837 34.718 1.00-10.24 H ATOM 571 C PRO A 37 73.584 6.961 33.068 1.00-10.24 C ATOM 572 O PRO A 37 73.472 7.210 31.864 1.00-10.24 O ATOM 573 CB PRO A 37 73.992 4.510 33.531 1.00-10.24 C ATOM 574 1HB PRO A 37 75.024 4.859 33.550 1.00-10.24 H ATOM 575 2HB PRO A 37 73.818 3.784 34.325 1.00-10.24 H ATOM 576 CG PRO A 37 73.651 3.915 32.214 1.00-10.24 C ATOM 577 1HG PRO A 37 74.081 4.515 31.411 1.00-10.24 H ATOM 578 2HG PRO A 37 73.999 2.884 32.150 1.00-10.24 H ATOM 579 CD PRO A 37 72.146 3.980 32.165 1.00-10.24 C ATOM 580 1HD PRO A 37 71.801 4.065 31.134 1.00-10.24 H ATOM 581 2HD PRO A 37 71.709 3.107 32.654 1.00-10.24 H ATOM 582 N LYS A 38 74.190 7.797 33.900 1.00 12.78 N ATOM 583 H LYS A 38 74.304 7.558 34.876 1.00 12.78 H ATOM 584 CA LYS A 38 74.703 9.087 33.439 1.00 12.78 C ATOM 585 HA LYS A 38 75.095 8.964 32.428 1.00 12.78 H ATOM 586 C LYS A 38 75.838 9.600 34.302 1.00 12.78 C ATOM 587 O LYS A 38 76.000 9.175 35.446 1.00 12.78 O ATOM 588 CB LYS A 38 73.576 10.129 33.384 1.00 12.78 C ATOM 589 1HB LYS A 38 73.988 11.015 32.918 1.00 12.78 H ATOM 590 2HB LYS A 38 72.799 9.754 32.722 1.00 12.78 H ATOM 591 CG LYS A 38 72.909 10.550 34.703 1.00 12.78 C ATOM 592 1HG LYS A 38 73.602 10.436 35.536 1.00 12.78 H ATOM 593 2HG LYS A 38 72.624 11.598 34.628 1.00 12.78 H ATOM 594 CD LYS A 38 71.654 9.730 34.959 1.00 12.78 C ATOM 595 1HD LYS A 38 71.017 9.769 34.074 1.00 12.78 H ATOM 596 2HD LYS A 38 71.941 8.696 35.137 1.00 12.78 H ATOM 597 CE LYS A 38 70.853 10.217 36.146 1.00 12.78 C ATOM 598 1HE LYS A 38 71.462 10.172 37.051 1.00 12.78 H ATOM 599 2HE LYS A 38 70.529 11.245 35.974 1.00 12.78 H ATOM 600 NZ LYS A 38 69.662 9.329 36.288 1.00 12.78 N ATOM 601 1HZ LYS A 38 69.053 9.664 37.034 1.00 12.78 H ATOM 602 2HZ LYS A 38 69.940 8.375 36.491 1.00 12.78 H ATOM 603 3HZ LYS A 38 69.127 9.313 35.422 1.00 12.78 H ATOM 604 N LYS A 39 76.598 10.543 33.770 1.00 -1.72 N ATOM 605 H LYS A 39 76.369 10.860 32.819 1.00 -1.72 H ATOM 606 CA LYS A 39 77.752 11.161 34.440 1.00 -1.72 C ATOM 607 HA LYS A 39 78.277 10.403 35.022 1.00 -1.72 H ATOM 608 C LYS A 39 77.321 12.280 35.390 1.00 -1.72 C ATOM 609 O LYS A 39 77.903 13.368 35.392 1.00 -1.72 O ATOM 610 CB LYS A 39 78.699 11.704 33.362 1.00 -1.72 C ATOM 611 1HB LYS A 39 78.160 12.449 32.774 1.00 -1.72 H ATOM 612 2HB LYS A 39 79.553 12.185 33.839 1.00 -1.72 H ATOM 613 CG LYS A 39 79.216 10.617 32.422 1.00 -1.72 C ATOM 614 1HG LYS A 39 79.787 9.887 32.994 1.00 -1.72 H ATOM 615 2HG LYS A 39 78.369 10.115 31.959 1.00 -1.72 H ATOM 616 CD LYS A 39 80.093 11.199 31.323 1.00 -1.72 C ATOM 617 1HD LYS A 39 79.528 11.962 30.791 1.00 -1.72 H ATOM 618 2HD LYS A 39 80.973 11.662 31.773 1.00 -1.72 H ATOM 619 CE LYS A 39 80.538 10.130 30.324 1.00 -1.72 C ATOM 620 1HE LYS A 39 81.207 10.592 29.595 1.00 -1.72 H ATOM 621 2HE LYS A 39 81.088 9.351 30.857 1.00 -1.72 H ATOM 622 NZ LYS A 39 79.369 9.513 29.602 1.00 -1.72 N ATOM 623 1HZ LYS A 39 79.686 8.929 28.843 1.00 -1.72 H ATOM 624 2HZ LYS A 39 78.761 10.247 29.232 1.00 -1.72 H ATOM 625 3HZ LYS A 39 78.813 8.968 30.245 1.00 -1.72 H ATOM 626 N LYS A 40 76.266 12.002 36.153 1.00 8.58 N ATOM 627 H LYS A 40 75.929 11.046 36.100 1.00 8.58 H ATOM 628 CA LYS A 40 75.501 12.930 37.016 1.00 8.58 C ATOM 629 HA LYS A 40 74.716 12.341 37.490 1.00 8.58 H ATOM 630 C LYS A 40 74.768 14.024 36.238 1.00 8.58 C ATOM 631 O LYS A 40 73.563 14.180 36.389 1.00 8.58 O ATOM 632 CB LYS A 40 76.352 13.531 38.144 1.00 8.58 C ATOM 633 1HB LYS A 40 77.139 14.148 37.712 1.00 8.58 H ATOM 634 2HB LYS A 40 75.712 14.175 38.749 1.00 8.58 H ATOM 635 CG LYS A 40 76.992 12.488 39.054 1.00 8.58 C ATOM 636 1HG LYS A 40 76.211 11.867 39.492 1.00 8.58 H ATOM 637 2HG LYS A 40 77.663 11.859 38.469 1.00 8.58 H ATOM 638 CD LYS A 40 77.790 13.149 40.169 1.00 8.58 C ATOM 639 1HD LYS A 40 78.547 13.798 39.728 1.00 8.58 H ATOM 640 2HD LYS A 40 77.117 13.749 40.783 1.00 8.58 H ATOM 641 CE LYS A 40 78.472 12.096 41.040 1.00 8.58 C ATOM 642 1HE LYS A 40 77.709 11.437 41.461 1.00 8.58 H ATOM 643 2HE LYS A 40 79.139 11.498 40.414 1.00 8.58 H ATOM 644 NZ LYS A 40 79.263 12.722 42.156 1.00 8.58 N ATOM 645 1HZ LYS A 40 79.703 12.001 42.713 1.00 8.58 H ATOM 646 2HZ LYS A 40 78.651 13.269 42.747 1.00 8.58 H ATOM 647 3HZ LYS A 40 79.979 13.325 41.773 1.00 8.58 H ATOM 648 N LYS A 41 75.459 14.697 35.332 1.00 -2.36 N ATOM 649 H LYS A 41 76.464 14.550 35.289 1.00 -2.36 H ATOM 650 CA LYS A 41 74.817 15.454 34.260 1.00 -2.36 C ATOM 651 HA LYS A 41 74.012 16.082 34.644 1.00 -2.36 H ATOM 652 C LYS A 41 74.269 14.341 33.384 1.00 -2.36 C ATOM 653 O LYS A 41 74.876 13.275 33.346 1.00 -2.36 O ATOM 654 CB LYS A 41 75.849 16.269 33.483 1.00 -2.36 C ATOM 655 1HB LYS A 41 76.626 15.586 33.136 1.00 -2.36 H ATOM 656 2HB LYS A 41 75.362 16.705 32.610 1.00 -2.36 H ATOM 657 CG LYS A 41 76.511 17.384 34.279 1.00 -2.36 C ATOM 658 1HG LYS A 41 75.752 18.091 34.613 1.00 -2.36 H ATOM 659 2HG LYS A 41 77.019 16.962 35.147 1.00 -2.36 H ATOM 660 CD LYS A 41 77.531 18.105 33.408 1.00 -2.36 C ATOM 661 1HD LYS A 41 78.265 17.379 33.057 1.00 -2.36 H ATOM 662 2HD LYS A 41 77.019 18.532 32.544 1.00 -2.36 H ATOM 663 CE LYS A 41 78.252 19.212 34.165 1.00 -2.36 C ATOM 664 1HE LYS A 41 77.518 19.938 34.523 1.00 -2.36 H ATOM 665 2HE LYS A 41 78.769 18.779 35.024 1.00 -2.36 H ATOM 666 NZ LYS A 41 79.250 19.897 33.269 1.00 -2.36 N ATOM 667 1HZ LYS A 41 79.734 20.623 33.782 1.00 -2.36 H ATOM 668 2HZ LYS A 41 78.774 20.311 32.478 1.00 -2.36 H ATOM 669 3HZ LYS A 41 79.924 19.224 32.930 1.00 -2.36 H ATOM 670 N ASN A 42 73.152 14.544 32.698 1.00 -6.38 N ATOM 671 H ASN A 42 72.720 15.452 32.706 1.00 -6.38 H ATOM 672 CA ASN A 42 72.483 13.447 31.987 1.00 -6.38 C ATOM 673 HA ASN A 42 72.563 12.588 32.643 1.00 -6.38 H ATOM 674 C ASN A 42 73.085 13.008 30.640 1.00 -6.38 C ATOM 675 O ASN A 42 72.366 12.747 29.675 1.00 -6.38 O ATOM 676 CB ASN A 42 70.983 13.737 31.847 1.00 -6.38 C ATOM 677 1HB ASN A 42 70.632 14.224 32.756 1.00 -6.38 H ATOM 678 2HB ASN A 42 70.820 14.408 31.004 1.00 -6.38 H ATOM 679 CG ASN A 42 70.169 12.475 31.650 1.00 -6.38 C ATOM 680 OD1 ASN A 42 70.681 11.365 31.741 1.00 -6.38 O ATOM 681 ND2 ASN A 42 68.896 12.627 31.417 1.00 -6.38 N ATOM 682 1HD2 ASN A 42 68.322 11.806 31.322 1.00 -6.38 H ATOM 683 2HD2 ASN A 42 68.496 13.547 31.343 1.00 -6.38 H ATOM 684 N HIS A 43 74.403 12.894 30.584 1.00 -4.79 N ATOM 685 H HIS A 43 74.945 13.060 31.428 1.00 -4.79 H ATOM 686 CA HIS A 43 75.141 12.454 29.403 1.00 -4.79 C ATOM 687 HA HIS A 43 74.479 11.905 28.736 1.00 -4.79 H ATOM 688 C HIS A 43 76.229 11.500 29.899 1.00 -4.79 C ATOM 689 O HIS A 43 77.277 11.309 29.246 1.00 -4.79 O ATOM 690 OXT HIS A 43 76.013 10.959 31.003 1.00 -4.79 O ATOM 691 CB HIS A 43 75.703 13.665 28.642 1.00 -4.79 C ATOM 692 1HB HIS A 43 76.230 13.303 27.759 1.00 -4.79 H ATOM 693 2HB HIS A 43 74.869 14.285 28.312 1.00 -4.79 H ATOM 694 CG HIS A 43 76.641 14.514 29.443 1.00 -4.79 C ATOM 695 ND1 HIS A 43 77.872 14.094 29.871 1.00 -4.79 N ATOM 696 HD1 HIS A 43 78.240 13.163 29.704 1.00 -4.79 H ATOM 697 CD2 HIS A 43 76.537 15.796 29.879 1.00 -4.79 C ATOM 698 HD2 HIS A 43 75.686 16.438 29.704 1.00 -4.79 H ATOM 699 CE1 HIS A 43 78.455 15.094 30.529 1.00 -4.79 C ATOM 700 HE1 HIS A 43 79.440 15.042 30.973 1.00 -4.79 H ATOM 701 NE2 HIS A 43 77.681 16.161 30.560 1.00 -4.79 N TER 702 HIS A 43 END
SEQUENCE	GKIPVKAIKKGGQIIGKALRGINIASTAHDIISQFKPKKKKNH
HELICITY	88.40	INSTAB. INDEX	12.16	FLEXIBILITY	11.39
a HYD. MOM.	56.00	b HYD. MOM.	28.20	c HYD. MOM	7.42
a MEAN HYD. MOM.	1.30	b MEAN HYD. MOM.	0.66	c MEAN HYD. MOM.	0.17
CHARGE pH5	11.89	CHARGE pH7	10.18	CHARGE pH9	9.53
Δ CHARGE pH5-pH9	2.36	ISOELECTRIC POINT	10.92	BOMAN INDEX	1.37
ΔG	38	CPP	0,44	MLP	-28,20
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	Lepidoptera
FAMILY	Pyralidae	GENUS	Galleria	SPECIES	Galleria mellonella
DATE	2008
TITLE PAPER	The discovery and analysis of a diverged family of novel antifungal moricin-like peptides in the wax moth Galleria mellonella.