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ID	2318	NAME	Lactococcin G-a   Blast NCBI-PROT
LENGTH	39	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\GTWDDIGQGIGRVAYWVGKALGNLSDVNQASRINRKKKH.pdb REMARK YASARA Written on: Wed May 14 18:28:35 2014 REMARK YASARA Number of models: 1 REMARK YASARA Number of atoms: 612 REMARK YASARA Please address questions or suggestions to: Eliza@yasara.org REMARK YASARA COMPND MOL_ID: 1; COMPND 2 MOLECULE: BACTERIOCIN LACTOCOCCIN-G SUBUNIT ALPHA; COMPND 3 CHAIN: A; SEQRES 1 A 39 GLY THR TRP ASP ASP ILE GLY GLN GLY ILE GLY ARG VAL SEQRES 2 A 39 ALA TYR TRP VAL GLY LYS ALA LEU GLY ASN LEU SER ASP SEQRES 3 A 39 VAL ASN GLN ALA SER ARG ILE ASN ARG LYS LYS LYS 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 -1.024 -55.602 -24.504 1.00-28.56 N ATOM 2 1H GLY A 1 -1.440 -55.946 -23.653 1.00-28.56 H ATOM 3 2H GLY A 1 -0.428 -56.318 -24.897 1.00-28.56 H ATOM 4 3H GLY A 1 -1.753 -55.379 -25.170 1.00-28.56 H ATOM 5 CA GLY A 1 -0.220 -54.390 -24.222 1.00-28.56 C ATOM 6 1HA GLY A 1 -0.869 -53.625 -23.802 1.00-28.56 H ATOM 7 2HA GLY A 1 0.563 -54.646 -23.510 1.00-28.56 H ATOM 8 C GLY A 1 0.420 -53.857 -25.480 1.00-28.56 C ATOM 9 O GLY A 1 0.290 -54.470 -26.522 1.00-28.56 O ATOM 10 N THR A 2 1.106 -52.722 -25.429 1.00 12.96 N ATOM 11 H THR A 2 1.319 -52.279 -24.547 1.00 12.96 H ATOM 12 CA THR A 2 1.465 -51.971 -26.635 1.00 12.96 C ATOM 13 HA THR A 2 0.545 -51.530 -27.018 1.00 12.96 H ATOM 14 C THR A 2 2.116 -52.706 -27.807 1.00 12.96 C ATOM 15 O THR A 2 1.763 -52.462 -28.955 1.00 12.96 O ATOM 16 CB THR A 2 2.404 -50.829 -26.212 1.00 12.96 C ATOM 17 HB THR A 2 3.430 -51.194 -26.179 1.00 12.96 H ATOM 18 OG1 THR A 2 2.026 -50.413 -24.896 1.00 12.96 O ATOM 19 HG1 THR A 2 2.451 -49.568 -24.722 1.00 12.96 H ATOM 20 CG2 THR A 2 2.313 -49.627 -27.130 1.00 12.96 C ATOM 21 1HG2 THR A 2 3.013 -48.860 -26.800 1.00 12.96 H ATOM 22 2HG2 THR A 2 1.299 -49.224 -27.120 1.00 12.96 H ATOM 23 3HG2 THR A 2 2.574 -49.917 -28.151 1.00 12.96 H ATOM 24 N TRP A 3 3.049 -53.609 -27.541 1.00-19.70 N ATOM 25 H TRP A 3 3.288 -53.814 -26.585 1.00-19.70 H ATOM 26 CA TRP A 3 3.764 -54.286 -28.625 1.00-19.70 C ATOM 27 HA TRP A 3 3.592 -53.750 -29.557 1.00-19.70 H ATOM 28 C TRP A 3 3.283 -55.717 -28.806 1.00-19.70 C ATOM 29 O TRP A 3 3.259 -56.269 -29.903 1.00-19.70 O ATOM 30 CB TRP A 3 5.264 -54.253 -28.333 1.00-19.70 C ATOM 31 1HB TRP A 3 5.505 -55.034 -27.612 1.00-19.70 H ATOM 32 2HB TRP A 3 5.808 -54.452 -29.257 1.00-19.70 H ATOM 33 CG TRP A 3 5.702 -52.928 -27.760 1.00-19.70 C ATOM 34 CD1 TRP A 3 6.250 -52.709 -26.533 1.00-19.70 C ATOM 35 HD1 TRP A 3 6.459 -53.493 -25.816 1.00-19.70 H ATOM 36 CD2 TRP A 3 5.613 -51.626 -28.375 1.00-19.70 C ATOM 37 NE1 TRP A 3 6.508 -51.382 -26.327 1.00-19.70 N ATOM 38 HE1 TRP A 3 6.932 -51.003 -25.492 1.00-19.70 H ATOM 39 CE2 TRP A 3 6.112 -50.680 -27.433 1.00-19.70 C ATOM 40 CE3 TRP A 3 5.123 -51.155 -29.611 1.00-19.70 C ATOM 41 HE3 TRP A 3 4.728 -51.845 -30.340 1.00-19.70 H ATOM 42 CZ2 TRP A 3 6.141 -49.295 -27.696 1.00-19.70 C ATOM 43 HZ2 TRP A 3 6.533 -48.600 -26.968 1.00-19.70 H ATOM 44 CZ3 TRP A 3 5.146 -49.762 -29.879 1.00-19.70 C ATOM 45 HZ3 TRP A 3 4.769 -49.391 -30.822 1.00-19.70 H ATOM 46 CH2 TRP A 3 5.657 -48.847 -28.913 1.00-19.70 C ATOM 47 HH2 TRP A 3 5.675 -47.790 -29.139 1.00-19.70 H ATOM 48 N ASP A 4 2.848 -56.313 -27.711 1.00-12.86 N ATOM 49 H ASP A 4 2.843 -55.824 -26.820 1.00-12.86 H ATOM 50 CA ASP A 4 2.343 -57.678 -27.712 1.00-12.86 C ATOM 51 HA ASP A 4 2.984 -58.286 -28.349 1.00-12.86 H ATOM 52 C ASP A 4 0.938 -57.743 -28.302 1.00-12.86 C ATOM 53 O ASP A 4 0.589 -58.746 -28.905 1.00-12.86 O ATOM 54 CB ASP A 4 2.397 -58.271 -26.298 1.00-12.86 C ATOM 55 1HB ASP A 4 1.943 -59.262 -26.314 1.00-12.86 H ATOM 56 2HB ASP A 4 3.441 -58.374 -26.004 1.00-12.86 H ATOM 57 CG ASP A 4 1.700 -57.408 -25.261 1.00-12.86 C ATOM 58 OD1 ASP A 4 2.167 -56.267 -25.008 1.00-12.86 O ATOM 59 OD2 ASP A 4 0.683 -57.836 -24.692 1.00-12.86 O ATOM 60 N ASP A 5 0.166 -56.665 -28.266 1.00 12.44 N ATOM 61 H ASP A 5 0.443 -55.852 -27.716 1.00 12.44 H ATOM 62 CA ASP A 5 -1.118 -56.625 -28.979 1.00 12.44 C ATOM 63 HA ASP A 5 -1.691 -57.523 -28.749 1.00 12.44 H ATOM 64 C ASP A 5 -0.858 -56.580 -30.475 1.00 12.44 C ATOM 65 O ASP A 5 -1.607 -57.151 -31.265 1.00 12.44 O ATOM 66 CB ASP A 5 -1.964 -55.396 -28.622 1.00 12.44 C ATOM 67 1HB ASP A 5 -1.353 -54.500 -28.731 1.00 12.44 H ATOM 68 2HB ASP A 5 -2.798 -55.334 -29.320 1.00 12.44 H ATOM 69 CG ASP A 5 -2.527 -55.456 -27.214 1.00 12.44 C ATOM 70 OD1 ASP A 5 -2.709 -56.568 -26.679 1.00 12.44 O ATOM 71 OD2 ASP A 5 -2.720 -54.390 -26.589 1.00 12.44 O ATOM 72 N ILE A 6 0.227 -55.940 -30.887 1.00 3.32 N ATOM 73 H ILE A 6 0.817 -55.470 -30.212 1.00 3.32 H ATOM 74 CA ILE A 6 0.592 -55.920 -32.303 1.00 3.32 C ATOM 75 HA ILE A 6 -0.281 -55.658 -32.880 1.00 3.32 H ATOM 76 C ILE A 6 0.991 -57.341 -32.682 1.00 3.32 C ATOM 77 O ILE A 6 0.529 -57.867 -33.697 1.00 3.32 O ATOM 78 CB ILE A 6 1.714 -54.891 -32.634 1.00 3.32 C ATOM 79 HB ILE A 6 2.602 -55.134 -32.057 1.00 3.32 H ATOM 80 CG1 ILE A 6 1.244 -53.475 -32.243 1.00 3.32 C ATOM 81 1HG1 ILE A 6 0.410 -53.195 -32.888 1.00 3.32 H ATOM 82 2HG1 ILE A 6 0.878 -53.493 -31.219 1.00 3.32 H ATOM 83 CG2 ILE A 6 2.079 -54.938 -34.144 1.00 3.32 C ATOM 84 1HG2 ILE A 6 2.907 -54.259 -34.351 1.00 3.32 H ATOM 85 2HG2 ILE A 6 1.221 -54.648 -34.753 1.00 3.32 H ATOM 86 3HG2 ILE A 6 2.399 -55.942 -34.427 1.00 3.32 H ATOM 87 CD1 ILE A 6 2.313 -52.377 -32.326 1.00 3.32 C ATOM 88 1HD1 ILE A 6 1.921 -51.461 -31.882 1.00 3.32 H ATOM 89 2HD1 ILE A 6 2.578 -52.180 -33.364 1.00 3.32 H ATOM 90 3HD1 ILE A 6 3.200 -52.683 -31.772 1.00 3.32 H ATOM 91 N GLY A 7 1.778 -57.996 -31.842 1.00 16.61 N ATOM 92 H GLY A 7 2.142 -57.523 -31.015 1.00 16.61 H ATOM 93 CA GLY A 7 2.139 -59.380 -32.098 1.00 16.61 C ATOM 94 1HA GLY A 7 2.666 -59.427 -33.046 1.00 16.61 H ATOM 95 2HA GLY A 7 2.810 -59.724 -31.310 1.00 16.61 H ATOM 96 C GLY A 7 0.947 -60.319 -32.164 1.00 16.61 C ATOM 97 O GLY A 7 0.866 -61.162 -33.055 1.00 16.61 O ATOM 98 N GLN A 8 0.014 -60.177 -31.239 1.00 -1.74 N ATOM 99 H GLN A 8 0.137 -59.467 -30.515 1.00 -1.74 H ATOM 100 CA GLN A 8 -1.148 -61.056 -31.143 1.00 -1.74 C ATOM 101 HA GLN A 8 -0.817 -62.082 -31.305 1.00 -1.74 H ATOM 102 C GLN A 8 -2.274 -60.764 -32.140 1.00 -1.74 C ATOM 103 O GLN A 8 -2.701 -61.655 -32.867 1.00 -1.74 O ATOM 104 CB GLN A 8 -1.687 -60.936 -29.710 1.00 -1.74 C ATOM 105 1HB GLN A 8 -0.843 -61.064 -29.032 1.00 -1.74 H ATOM 106 2HB GLN A 8 -2.082 -59.930 -29.575 1.00 -1.74 H ATOM 107 CG GLN A 8 -2.764 -61.945 -29.320 1.00 -1.74 C ATOM 108 1HG GLN A 8 -3.617 -61.832 -29.989 1.00 -1.74 H ATOM 109 2HG GLN A 8 -2.358 -62.949 -29.439 1.00 -1.74 H ATOM 110 CD GLN A 8 -3.261 -61.793 -27.885 1.00 -1.74 C ATOM 111 OE1 GLN A 8 -4.101 -62.558 -27.446 1.00 -1.74 O ATOM 112 NE2 GLN A 8 -2.765 -60.824 -27.155 1.00 -1.74 N ATOM 113 1HE2 GLN A 8 -3.110 -60.711 -26.217 1.00 -1.74 H ATOM 114 2HE2 GLN A 8 -2.067 -60.199 -27.521 1.00 -1.74 H ATOM 115 N GLY A 9 -2.791 -59.542 -32.140 1.00 44.45 N ATOM 116 H GLY A 9 -2.348 -58.808 -31.587 1.00 44.45 H ATOM 117 CA GLY A 9 -4.065 -59.253 -32.788 1.00 44.45 C ATOM 118 1HA GLY A 9 -4.385 -60.128 -33.351 1.00 44.45 H ATOM 119 2HA GLY A 9 -4.803 -59.103 -31.999 1.00 44.45 H ATOM 120 C GLY A 9 -4.165 -58.062 -33.720 1.00 44.45 C ATOM 121 O GLY A 9 -5.023 -58.075 -34.603 1.00 44.45 O ATOM 122 N ILE A 10 -3.325 -57.047 -33.571 1.00 -7.13 N ATOM 123 H ILE A 10 -2.647 -57.053 -32.810 1.00 -7.13 H ATOM 124 CA ILE A 10 -3.394 -55.890 -34.470 1.00 -7.13 C ATOM 125 HA ILE A 10 -4.434 -55.737 -34.757 1.00 -7.13 H ATOM 126 C ILE A 10 -2.592 -56.212 -35.731 1.00 -7.13 C ATOM 127 O ILE A 10 -3.118 -56.179 -36.834 1.00 -7.13 O ATOM 128 CB ILE A 10 -2.869 -54.569 -33.815 1.00 -7.13 C ATOM 129 HB ILE A 10 -1.814 -54.681 -33.606 1.00 -7.13 H ATOM 130 CG1 ILE A 10 -3.590 -54.298 -32.477 1.00 -7.13 C ATOM 131 1HG1 ILE A 10 -4.632 -54.053 -32.685 1.00 -7.13 H ATOM 132 2HG1 ILE A 10 -3.574 -55.202 -31.870 1.00 -7.13 H ATOM 133 CG2 ILE A 10 -3.038 -53.372 -34.788 1.00 -7.13 C ATOM 134 1HG2 ILE A 10 -2.600 -52.471 -34.358 1.00 -7.13 H ATOM 135 2HG2 ILE A 10 -4.097 -53.194 -34.987 1.00 -7.13 H ATOM 136 3HG2 ILE A 10 -2.531 -53.574 -35.733 1.00 -7.13 H ATOM 137 CD1 ILE A 10 -2.981 -53.175 -31.621 1.00 -7.13 C ATOM 138 1HD1 ILE A 10 -3.507 -53.126 -30.666 1.00 -7.13 H ATOM 139 2HD1 ILE A 10 -3.083 -52.214 -32.124 1.00 -7.13 H ATOM 140 3HD1 ILE A 10 -1.926 -53.379 -31.431 1.00 -7.13 H ATOM 141 N GLY A 11 -1.324 -56.566 -35.558 1.00 38.68 N ATOM 142 H GLY A 11 -0.929 -56.600 -34.628 1.00 38.68 H ATOM 143 CA GLY A 11 -0.461 -56.898 -36.685 1.00 38.68 C ATOM 144 1HA GLY A 11 -0.794 -56.366 -37.577 1.00 38.68 H ATOM 145 2HA GLY A 11 0.558 -56.592 -36.454 1.00 38.68 H ATOM 146 C GLY A 11 -0.460 -58.385 -36.971 1.00 38.68 C ATOM 147 O GLY A 11 -0.134 -58.812 -38.071 1.00 38.68 O ATOM 148 N ARG A 12 -0.845 -59.159 -35.959 1.00 -5.39 N ATOM 149 H ARG A 12 -1.023 -58.708 -35.074 1.00 -5.39 H ATOM 150 CA ARG A 12 -1.017 -60.620 -36.039 1.00 -5.39 C ATOM 151 HA ARG A 12 -1.241 -60.986 -35.035 1.00 -5.39 H ATOM 152 C ARG A 12 0.267 -61.296 -36.493 1.00 -5.39 C ATOM 153 O ARG A 12 0.272 -62.234 -37.284 1.00 -5.39 O ATOM 154 CB ARG A 12 -2.201 -60.981 -36.947 1.00 -5.39 C ATOM 155 1HB ARG A 12 -1.970 -60.685 -37.970 1.00 -5.39 H ATOM 156 2HB ARG A 12 -2.363 -62.057 -36.921 1.00 -5.39 H ATOM 157 CG ARG A 12 -3.470 -60.281 -36.513 1.00 -5.39 C ATOM 158 1HG ARG A 12 -3.724 -60.605 -35.505 1.00 -5.39 H ATOM 159 2HG ARG A 12 -3.297 -59.207 -36.499 1.00 -5.39 H ATOM 160 CD ARG A 12 -4.653 -60.513 -37.414 1.00 -5.39 C ATOM 161 1HD ARG A 12 -4.376 -60.284 -38.444 1.00 -5.39 H ATOM 162 2HD ARG A 12 -4.985 -61.549 -37.335 1.00 -5.39 H ATOM 163 NE ARG A 12 -5.704 -59.592 -36.966 1.00 -5.39 N ATOM 164 HE ARG A 12 -5.466 -58.999 -36.171 1.00 -5.39 H ATOM 165 CZ ARG A 12 -6.908 -59.429 -37.488 1.00 -5.39 C ATOM 166 NH1 ARG A 12 -7.686 -58.531 -36.954 1.00 -5.39 N ATOM 167 1HH1 ARG A 12 -7.345 -57.987 -36.173 1.00 -5.39 H ATOM 168 2HH1 ARG A 12 -8.610 -58.375 -37.316 1.00 -5.39 H ATOM 169 NH2 ARG A 12 -7.355 -60.113 -38.512 1.00 -5.39 N ATOM 170 1HH2 ARG A 12 -6.758 -60.801 -38.942 1.00 -5.39 H ATOM 171 2HH2 ARG A 12 -8.281 -59.952 -38.864 1.00 -5.39 H ATOM 172 N VAL A 13 1.368 -60.820 -35.939 1.00 16.02 N ATOM 173 H VAL A 13 1.289 -60.075 -35.264 1.00 16.02 H ATOM 174 CA VAL A 13 2.692 -61.340 -36.261 1.00 16.02 C ATOM 175 HA VAL A 13 2.824 -61.303 -37.342 1.00 16.02 H ATOM 176 C VAL A 13 2.777 -62.801 -35.817 1.00 16.02 C ATOM 177 O VAL A 13 3.384 -63.618 -36.490 1.00 16.02 O ATOM 178 CB VAL A 13 3.801 -60.481 -35.591 1.00 16.02 C ATOM 179 HB VAL A 13 3.722 -60.595 -34.511 1.00 16.02 H ATOM 180 CG1 VAL A 13 5.202 -60.928 -36.027 1.00 16.02 C ATOM 181 1HG1 VAL A 13 5.956 -60.293 -35.561 1.00 16.02 H ATOM 182 2HG1 VAL A 13 5.299 -60.862 -37.112 1.00 16.02 H ATOM 183 3HG1 VAL A 13 5.381 -61.958 -35.716 1.00 16.02 H ATOM 184 CG2 VAL A 13 3.605 -58.987 -35.931 1.00 16.02 C ATOM 185 1HG2 VAL A 13 4.440 -58.406 -35.537 1.00 16.02 H ATOM 186 2HG2 VAL A 13 2.689 -58.607 -35.482 1.00 16.02 H ATOM 187 3HG2 VAL A 13 3.559 -58.852 -37.014 1.00 16.02 H ATOM 188 N ALA A 14 2.104 -63.166 -34.733 1.00 -2.88 N ATOM 189 H ALA A 14 1.598 -62.467 -34.191 1.00 -2.88 H ATOM 190 CA ALA A 14 2.080 -64.561 -34.296 1.00 -2.88 C ATOM 191 HA ALA A 14 3.110 -64.897 -34.163 1.00 -2.88 H ATOM 192 C ALA A 14 1.427 -65.472 -35.347 1.00 -2.88 C ATOM 193 O ALA A 14 1.893 -66.584 -35.598 1.00 -2.88 O ATOM 194 CB ALA A 14 1.346 -64.664 -32.951 1.00 -2.88 C ATOM 195 1HB ALA A 14 1.859 -64.058 -32.203 1.00 -2.88 H ATOM 196 2HB ALA A 14 1.338 -65.705 -32.621 1.00 -2.88 H ATOM 197 3HB ALA A 14 0.317 -64.313 -33.055 1.00 -2.88 H ATOM 198 N TYR A 15 0.372 -64.988 -35.991 1.00-15.66 N ATOM 199 H TYR A 15 0.024 -64.069 -35.771 1.00-15.66 H ATOM 200 CA TYR A 15 -0.261 -65.747 -37.068 1.00-15.66 C ATOM 201 HA TYR A 15 -0.454 -66.767 -36.735 1.00-15.66 H ATOM 202 C TYR A 15 0.689 -65.811 -38.254 1.00-15.66 C ATOM 203 O TYR A 15 0.845 -66.864 -38.863 1.00-15.66 O ATOM 204 CB TYR A 15 -1.580 -65.114 -37.523 1.00-15.66 C ATOM 205 1HB TYR A 15 -2.322 -65.217 -36.731 1.00-15.66 H ATOM 206 2HB TYR A 15 -1.421 -64.058 -37.720 1.00-15.66 H ATOM 207 CG TYR A 15 -2.094 -65.752 -38.797 1.00-15.66 C ATOM 208 CD1 TYR A 15 -2.707 -67.023 -38.776 1.00-15.66 C ATOM 209 HD1 TYR A 15 -2.873 -67.524 -37.833 1.00-15.66 H ATOM 210 CD2 TYR A 15 -1.904 -65.117 -40.044 1.00-15.66 C ATOM 211 HD2 TYR A 15 -1.445 -64.139 -40.084 1.00-15.66 H ATOM 212 CE1 TYR A 15 -3.085 -67.668 -39.987 1.00-15.66 C ATOM 213 HE1 TYR A 15 -3.539 -68.647 -39.960 1.00-15.66 H ATOM 214 CE2 TYR A 15 -2.280 -65.761 -41.254 1.00-15.66 C ATOM 215 HE2 TYR A 15 -2.116 -65.277 -42.204 1.00-15.66 H ATOM 216 CZ TYR A 15 -2.855 -67.032 -41.211 1.00-15.66 C ATOM 217 OH TYR A 15 -3.192 -67.657 -42.384 1.00-15.66 O ATOM 218 HH TYR A 15 -3.589 -68.519 -42.239 1.00-15.66 H ATOM 219 N TRP A 16 1.350 -64.706 -38.570 1.00 -9.53 N ATOM 220 H TRP A 16 1.185 -63.849 -38.047 1.00 -9.53 H ATOM 221 CA TRP A 16 2.303 -64.692 -39.675 1.00 -9.53 C ATOM 222 HA TRP A 16 1.777 -64.977 -40.586 1.00 -9.53 H ATOM 223 C TRP A 16 3.422 -65.708 -39.458 1.00 -9.53 C ATOM 224 O TRP A 16 3.767 -66.432 -40.382 1.00 -9.53 O ATOM 225 CB TRP A 16 2.895 -63.294 -39.875 1.00 -9.53 C ATOM 226 1HB TRP A 16 2.083 -62.573 -39.971 1.00 -9.53 H ATOM 227 2HB TRP A 16 3.497 -63.030 -39.008 1.00 -9.53 H ATOM 228 CG TRP A 16 3.762 -63.226 -41.098 1.00 -9.53 C ATOM 229 CD1 TRP A 16 3.381 -62.885 -42.357 1.00 -9.53 C ATOM 230 HD1 TRP A 16 2.377 -62.580 -42.624 1.00 -9.53 H ATOM 231 CD2 TRP A 16 5.165 -63.542 -41.195 1.00 -9.53 C ATOM 232 NE1 TRP A 16 4.422 -62.986 -43.241 1.00 -9.53 N ATOM 233 HE1 TRP A 16 4.360 -62.770 -44.225 1.00 -9.53 H ATOM 234 CE2 TRP A 16 5.530 -63.422 -42.566 1.00 -9.53 C ATOM 235 CE3 TRP A 16 6.148 -63.942 -40.265 1.00 -9.53 C ATOM 236 HE3 TRP A 16 5.904 -64.027 -39.218 1.00 -9.53 H ATOM 237 CZ2 TRP A 16 6.829 -63.716 -43.031 1.00 -9.53 C ATOM 238 HZ2 TRP A 16 7.079 -63.620 -44.076 1.00 -9.53 H ATOM 239 CZ3 TRP A 16 7.455 -64.242 -40.726 1.00 -9.53 C ATOM 240 HZ3 TRP A 16 8.213 -64.559 -40.023 1.00 -9.53 H ATOM 241 CH2 TRP A 16 7.777 -64.130 -42.110 1.00 -9.53 C ATOM 242 HH2 TRP A 16 8.778 -64.365 -42.445 1.00 -9.53 H ATOM 243 N VAL A 17 3.951 -65.821 -38.247 1.00-10.01 N ATOM 244 H VAL A 17 3.644 -65.194 -37.505 1.00-10.01 H ATOM 245 CA VAL A 17 4.991 -66.814 -37.958 1.00-10.01 C ATOM 246 HA VAL A 17 5.786 -66.707 -38.694 1.00-10.01 H ATOM 247 C VAL A 17 4.420 -68.221 -38.108 1.00-10.01 C ATOM 248 O VAL A 17 5.057 -69.077 -38.712 1.00-10.01 O ATOM 249 CB VAL A 17 5.606 -66.609 -36.539 1.00-10.01 C ATOM 250 HB VAL A 17 4.800 -66.606 -35.805 1.00-10.01 H ATOM 251 CG1 VAL A 17 6.596 -67.730 -36.170 1.00-10.01 C ATOM 252 1HG1 VAL A 17 7.051 -67.520 -35.202 1.00-10.01 H ATOM 253 2HG1 VAL A 17 7.377 -67.808 -36.928 1.00-10.01 H ATOM 254 3HG1 VAL A 17 6.072 -68.684 -36.101 1.00-10.01 H ATOM 255 CG2 VAL A 17 6.351 -65.263 -36.467 1.00-10.01 C ATOM 256 1HG2 VAL A 17 6.730 -65.107 -35.457 1.00-10.01 H ATOM 257 2HG2 VAL A 17 5.682 -64.443 -36.712 1.00-10.01 H ATOM 258 3HG2 VAL A 17 7.186 -65.258 -37.169 1.00-10.01 H ATOM 259 N GLY A 18 3.204 -68.471 -37.641 1.00 -0.08 N ATOM 260 H GLY A 18 2.681 -67.748 -37.150 1.00 -0.08 H ATOM 261 CA GLY A 18 2.613 -69.789 -37.832 1.00 -0.08 C ATOM 262 1HA GLY A 18 3.275 -70.538 -37.399 1.00 -0.08 H ATOM 263 2HA GLY A 18 1.650 -69.831 -37.326 1.00 -0.08 H ATOM 264 C GLY A 18 2.414 -70.121 -39.302 1.00 -0.08 C ATOM 265 O GLY A 18 2.684 -71.236 -39.750 1.00 -0.08 O ATOM 266 N LYS A 19 1.991 -69.134 -40.080 1.00-12.65 N ATOM 267 H LYS A 19 1.772 -68.231 -39.656 1.00-12.65 H ATOM 268 CA LYS A 19 1.809 -69.298 -41.522 1.00-12.65 C ATOM 269 HA LYS A 19 1.185 -70.175 -41.690 1.00-12.65 H ATOM 270 C LYS A 19 3.158 -69.548 -42.182 1.00-12.65 C ATOM 271 O LYS A 19 3.245 -70.369 -43.079 1.00-12.65 O ATOM 272 CB LYS A 19 1.100 -68.058 -42.094 1.00-12.65 C ATOM 273 1HB LYS A 19 0.298 -67.805 -41.400 1.00-12.65 H ATOM 274 2HB LYS A 19 1.794 -67.217 -42.114 1.00-12.65 H ATOM 275 CG LYS A 19 0.451 -68.214 -43.478 1.00-12.65 C ATOM 276 1HG LYS A 19 0.006 -69.206 -43.548 1.00-12.65 H ATOM 277 2HG LYS A 19 -0.350 -67.477 -43.552 1.00-12.65 H ATOM 278 CD LYS A 19 1.393 -67.996 -44.667 1.00-12.65 C ATOM 279 1HD LYS A 19 1.860 -67.015 -44.580 1.00-12.65 H ATOM 280 2HD LYS A 19 2.166 -68.761 -44.671 1.00-12.65 H ATOM 281 CE LYS A 19 0.614 -68.075 -45.979 1.00-12.65 C ATOM 282 1HE LYS A 19 0.135 -69.055 -46.043 1.00-12.65 H ATOM 283 2HE LYS A 19 -0.161 -67.307 -45.979 1.00-12.65 H ATOM 284 NZ LYS A 19 1.499 -67.887 -47.173 1.00-12.65 N ATOM 285 1HZ LYS A 19 0.974 -67.939 -48.037 1.00-12.65 H ATOM 286 2HZ LYS A 19 2.214 -68.607 -47.201 1.00-12.65 H ATOM 287 3HZ LYS A 19 1.975 -66.994 -47.148 1.00-12.65 H ATOM 288 N ALA A 20 4.202 -68.866 -41.733 1.00 -4.19 N ATOM 289 H ALA A 20 4.064 -68.177 -40.997 1.00 -4.19 H ATOM 290 CA ALA A 20 5.550 -69.036 -42.270 1.00 -4.19 C ATOM 291 HA ALA A 20 5.502 -68.918 -43.351 1.00 -4.19 H ATOM 292 C ALA A 20 6.117 -70.431 -41.972 1.00 -4.19 C ATOM 293 O ALA A 20 6.766 -71.034 -42.822 1.00 -4.19 O ATOM 294 CB ALA A 20 6.476 -67.944 -41.711 1.00 -4.19 C ATOM 295 1HB ALA A 20 6.069 -66.957 -41.942 1.00 -4.19 H ATOM 296 2HB ALA A 20 7.465 -68.037 -42.162 1.00 -4.19 H ATOM 297 3HB ALA A 20 6.568 -68.047 -40.630 1.00 -4.19 H ATOM 298 N LEU A 21 5.860 -70.956 -40.784 1.00-24.82 N ATOM 299 H LEU A 21 5.356 -70.405 -40.090 1.00-24.82 H ATOM 300 CA LEU A 21 6.313 -72.303 -40.432 1.00-24.82 C ATOM 301 HA LEU A 21 7.379 -72.388 -40.640 1.00-24.82 H ATOM 302 C LEU A 21 5.595 -73.363 -41.265 1.00-24.82 C ATOM 303 O LEU A 21 6.182 -74.368 -41.648 1.00-24.82 O ATOM 304 CB LEU A 21 6.063 -72.574 -38.943 1.00-24.82 C ATOM 305 1HB LEU A 21 5.017 -72.354 -38.738 1.00-24.82 H ATOM 306 2HB LEU A 21 6.216 -73.639 -38.767 1.00-24.82 H ATOM 307 CG LEU A 21 6.927 -71.806 -37.929 1.00-24.82 C ATOM 308 HG LEU A 21 6.889 -70.746 -38.163 1.00-24.82 H ATOM 309 CD1 LEU A 21 6.367 -71.999 -36.521 1.00-24.82 C ATOM 310 1HD1 LEU A 21 6.964 -71.432 -35.807 1.00-24.82 H ATOM 311 2HD1 LEU A 21 6.383 -73.055 -36.249 1.00-24.82 H ATOM 312 3HD1 LEU A 21 5.341 -71.631 -36.484 1.00-24.82 H ATOM 313 CD2 LEU A 21 8.392 -72.245 -37.961 1.00-24.82 C ATOM 314 1HD2 LEU A 21 8.958 -71.694 -37.210 1.00-24.82 H ATOM 315 2HD2 LEU A 21 8.821 -72.031 -38.940 1.00-24.82 H ATOM 316 3HD2 LEU A 21 8.470 -73.314 -37.760 1.00-24.82 H ATOM 317 N GLY A 22 4.330 -73.123 -41.575 1.00 7.19 N ATOM 318 H GLY A 22 3.881 -72.282 -41.223 1.00 7.19 H ATOM 319 CA GLY A 22 3.549 -74.051 -42.381 1.00 7.19 C ATOM 320 1HA GLY A 22 3.935 -75.062 -42.246 1.00 7.19 H ATOM 321 2HA GLY A 22 2.521 -74.033 -42.020 1.00 7.19 H ATOM 322 C GLY A 22 3.525 -73.741 -43.866 1.00 7.19 C ATOM 323 O GLY A 22 2.610 -74.170 -44.570 1.00 7.19 O ATOM 324 N ASN A 23 4.466 -72.946 -44.359 1.00 21.21 N ATOM 325 H ASN A 23 5.270 -72.712 -43.786 1.00 21.21 H ATOM 326 CA ASN A 23 4.289 -72.253 -45.641 1.00 21.21 C ATOM 327 HA ASN A 23 3.242 -71.947 -45.651 1.00 21.21 H ATOM 328 C ASN A 23 4.523 -73.013 -46.949 1.00 21.21 C ATOM 329 O ASN A 23 5.074 -72.479 -47.915 1.00 21.21 O ATOM 330 CB ASN A 23 5.126 -70.979 -45.655 1.00 21.21 C ATOM 331 1HB ASN A 23 5.197 -70.611 -44.647 1.00 21.21 H ATOM 332 2HB ASN A 23 6.133 -71.192 -46.014 1.00 21.21 H ATOM 333 CG ASN A 23 4.504 -69.891 -46.475 1.00 21.21 C ATOM 334 OD1 ASN A 23 3.457 -70.065 -47.107 1.00 21.21 O ATOM 335 ND2 ASN A 23 5.112 -68.741 -46.448 1.00 21.21 N ATOM 336 1HD2 ASN A 23 4.763 -67.989 -47.043 1.00 21.21 H ATOM 337 2HD2 ASN A 23 5.931 -68.614 -45.879 1.00 21.21 H ATOM 338 N LEU A 24 4.025 -74.238 -47.023 1.00 -5.61 N ATOM 339 H LEU A 24 3.568 -74.622 -46.197 1.00 -5.61 H ATOM 340 CA LEU A 24 4.051 -75.022 -48.259 1.00 -5.61 C ATOM 341 HA LEU A 24 5.081 -75.134 -48.596 1.00 -5.61 H ATOM 342 C LEU A 24 3.258 -74.286 -49.341 1.00 -5.61 C ATOM 343 O LEU A 24 3.544 -74.382 -50.534 1.00 -5.61 O ATOM 344 CB LEU A 24 3.444 -76.405 -47.999 1.00 -5.61 C ATOM 345 1HB LEU A 24 3.972 -76.848 -47.155 1.00 -5.61 H ATOM 346 2HB LEU A 24 2.405 -76.261 -47.701 1.00 -5.61 H ATOM 347 CG LEU A 24 3.464 -77.420 -49.156 1.00 -5.61 C ATOM 348 HG LEU A 24 2.924 -76.997 -50.001 1.00 -5.61 H ATOM 349 CD1 LEU A 24 4.882 -77.770 -49.614 1.00 -5.61 C ATOM 350 1HD1 LEU A 24 4.840 -78.532 -50.392 1.00 -5.61 H ATOM 351 2HD1 LEU A 24 5.469 -78.146 -48.773 1.00 -5.61 H ATOM 352 3HD1 LEU A 24 5.367 -76.887 -50.028 1.00 -5.61 H ATOM 353 CD2 LEU A 24 2.741 -78.693 -48.725 1.00 -5.61 C ATOM 354 1HD2 LEU A 24 2.709 -79.397 -49.557 1.00 -5.61 H ATOM 355 2HD2 LEU A 24 1.717 -78.458 -48.433 1.00 -5.61 H ATOM 356 3HD2 LEU A 24 3.257 -79.156 -47.883 1.00 -5.61 H ATOM 357 N SER A 25 2.312 -73.466 -48.903 1.00 -9.39 N ATOM 358 H SER A 25 2.119 -73.409 -47.912 1.00 -9.39 H ATOM 359 CA SER A 25 1.562 -72.594 -49.793 1.00 -9.39 C ATOM 360 HA SER A 25 0.985 -73.205 -50.487 1.00 -9.39 H ATOM 361 C SER A 25 2.447 -71.665 -50.619 1.00 -9.39 C ATOM 362 O SER A 25 2.238 -71.543 -51.821 1.00 -9.39 O ATOM 363 CB SER A 25 0.616 -71.750 -48.943 1.00 -9.39 C ATOM 364 1HB SER A 25 0.455 -70.782 -49.419 1.00 -9.39 H ATOM 365 2HB SER A 25 -0.337 -72.272 -48.853 1.00 -9.39 H ATOM 366 OG SER A 25 1.165 -71.579 -47.641 1.00 -9.39 O ATOM 367 HG SER A 25 1.939 -70.994 -47.684 1.00 -9.39 H ATOM 368 N ASP A 26 3.445 -71.027 -50.024 1.00-12.79 N ATOM 369 H ASP A 26 3.643 -71.162 -49.037 1.00-12.79 H ATOM 370 CA ASP A 26 4.258 -70.080 -50.790 1.00-12.79 C ATOM 371 HA ASP A 26 3.639 -69.646 -51.566 1.00-12.79 H ATOM 372 C ASP A 26 5.400 -70.798 -51.479 1.00-12.79 C ATOM 373 O ASP A 26 5.924 -70.301 -52.464 1.00-12.79 O ATOM 374 CB ASP A 26 4.783 -68.914 -49.954 1.00-12.79 C ATOM 375 1HB ASP A 26 5.316 -69.312 -49.094 1.00-12.79 H ATOM 376 2HB ASP A 26 5.484 -68.339 -50.557 1.00-12.79 H ATOM 377 CG ASP A 26 3.672 -67.977 -49.490 1.00-12.79 C ATOM 378 OD1 ASP A 26 2.531 -68.051 -50.009 1.00-12.79 O ATOM 379 OD2 ASP A 26 3.908 -67.192 -48.545 1.00-12.79 O ATOM 380 N VAL A 27 5.718 -72.014 -51.058 1.00-12.79 N ATOM 381 H VAL A 27 5.302 -72.379 -50.207 1.00-12.79 H ATOM 382 CA VAL A 27 6.634 -72.857 -51.832 1.00-12.79 C ATOM 383 HA VAL A 27 7.536 -72.289 -52.062 1.00-12.79 H ATOM 384 C VAL A 27 5.924 -73.188 -53.147 1.00-12.79 C ATOM 385 O VAL A 27 6.509 -73.120 -54.234 1.00-12.79 O ATOM 386 CB VAL A 27 7.032 -74.152 -51.061 1.00-12.79 C ATOM 387 HB VAL A 27 6.129 -74.697 -50.801 1.00-12.79 H ATOM 388 CG1 VAL A 27 7.922 -75.071 -51.911 1.00-12.79 C ATOM 389 1HG1 VAL A 27 8.210 -75.948 -51.330 1.00-12.79 H ATOM 390 2HG1 VAL A 27 8.820 -74.540 -52.229 1.00-12.79 H ATOM 391 3HG1 VAL A 27 7.376 -75.409 -52.793 1.00-12.79 H ATOM 392 CG2 VAL A 27 7.776 -73.798 -49.764 1.00-12.79 C ATOM 393 1HG2 VAL A 27 8.032 -74.710 -49.223 1.00-12.79 H ATOM 394 2HG2 VAL A 27 7.149 -73.186 -49.120 1.00-12.79 H ATOM 395 3HG2 VAL A 27 8.690 -73.247 -49.991 1.00-12.79 H ATOM 396 N ASN A 28 4.630 -73.471 -53.076 1.00 -2.03 N ATOM 397 H ASN A 28 4.180 -73.557 -52.164 1.00 -2.03 H ATOM 398 CA ASN A 28 3.845 -73.673 -54.289 1.00 -2.03 C ATOM 399 HA ASN A 28 4.329 -74.449 -54.882 1.00 -2.03 H ATOM 400 C ASN A 28 3.821 -72.396 -55.125 1.00 -2.03 C ATOM 401 O ASN A 28 4.009 -72.470 -56.338 1.00 -2.03 O ATOM 402 CB ASN A 28 2.419 -74.130 -53.962 1.00 -2.03 C ATOM 403 1HB ASN A 28 2.469 -74.999 -53.307 1.00 -2.03 H ATOM 404 2HB ASN A 28 1.891 -73.336 -53.443 1.00 -2.03 H ATOM 405 CG ASN A 28 1.626 -74.483 -55.196 1.00 -2.03 C ATOM 406 OD1 ASN A 28 1.124 -73.619 -55.910 1.00 -2.03 O ATOM 407 ND2 ASN A 28 1.488 -75.754 -55.453 1.00 -2.03 N ATOM 408 1HD2 ASN A 28 0.945 -76.032 -56.253 1.00 -2.03 H ATOM 409 2HD2 ASN A 28 1.908 -76.441 -54.850 1.00 -2.03 H ATOM 410 N GLN A 29 3.656 -71.229 -54.515 1.00-13.76 N ATOM 411 H GLN A 29 3.515 -71.196 -53.508 1.00-13.76 H ATOM 412 CA GLN A 29 3.654 -69.987 -55.293 1.00-13.76 C ATOM 413 HA GLN A 29 2.924 -70.101 -56.089 1.00-13.76 H ATOM 414 C GLN A 29 5.009 -69.721 -55.950 1.00-13.76 C ATOM 415 O GLN A 29 5.070 -69.364 -57.125 1.00-13.76 O ATOM 416 CB GLN A 29 3.247 -68.774 -54.451 1.00-13.76 C ATOM 417 1HB GLN A 29 3.986 -68.606 -53.669 1.00-13.76 H ATOM 418 2HB GLN A 29 3.239 -67.903 -55.106 1.00-13.76 H ATOM 419 CG GLN A 29 1.873 -68.905 -53.808 1.00-13.76 C ATOM 420 1HG GLN A 29 1.253 -69.554 -54.420 1.00-13.76 H ATOM 421 2HG GLN A 29 1.976 -69.349 -52.827 1.00-13.76 H ATOM 422 CD GLN A 29 1.164 -67.585 -53.659 1.00-13.76 C ATOM 423 OE1 GLN A 29 0.518 -67.126 -54.590 1.00-13.76 O ATOM 424 NE2 GLN A 29 1.241 -66.985 -52.501 1.00-13.76 N ATOM 425 1HE2 GLN A 29 0.787 -66.095 -52.392 1.00-13.76 H ATOM 426 2HE2 GLN A 29 1.751 -67.407 -51.723 1.00-13.76 H ATOM 427 N ALA A 30 6.098 -69.970 -55.239 1.00-15.50 N ATOM 428 H ALA A 30 6.010 -70.251 -54.260 1.00-15.50 H ATOM 429 CA ALA A 30 7.437 -69.813 -55.792 1.00-15.50 C ATOM 430 HA ALA A 30 7.545 -68.794 -56.163 1.00-15.50 H ATOM 431 C ALA A 30 7.651 -70.771 -56.963 1.00-15.50 C ATOM 432 O ALA A 30 8.303 -70.428 -57.948 1.00-15.50 O ATOM 433 CB ALA A 30 8.482 -70.055 -54.697 1.00-15.50 C ATOM 434 1HB ALA A 30 8.326 -69.349 -53.879 1.00-15.50 H ATOM 435 2HB ALA A 30 9.483 -69.912 -55.104 1.00-15.50 H ATOM 436 3HB ALA A 30 8.391 -71.071 -54.309 1.00-15.50 H ATOM 437 N SER A 31 7.083 -71.966 -56.898 1.00-11.60 N ATOM 438 H SER A 31 6.591 -72.246 -56.049 1.00-11.60 H ATOM 439 CA SER A 31 7.213 -72.900 -58.014 1.00-11.60 C ATOM 440 HA SER A 31 8.275 -72.978 -58.249 1.00-11.60 H ATOM 441 C SER A 31 6.499 -72.390 -59.269 1.00-11.60 C ATOM 442 O SER A 31 6.935 -72.664 -60.382 1.00-11.60 O ATOM 443 CB SER A 31 6.720 -74.300 -57.638 1.00-11.60 C ATOM 444 1HB SER A 31 7.123 -75.009 -58.362 1.00-11.60 H ATOM 445 2HB SER A 31 7.101 -74.562 -56.650 1.00-11.60 H ATOM 446 OG SER A 31 5.304 -74.406 -57.653 1.00-11.60 O ATOM 447 HG SER A 31 4.931 -73.733 -57.052 1.00-11.60 H ATOM 448 N ARG A 32 5.437 -71.605 -59.114 1.00-18.42 N ATOM 449 H ARG A 32 5.110 -71.388 -58.175 1.00-18.42 H ATOM 450 CA ARG A 32 4.742 -71.018 -60.271 1.00-18.42 C ATOM 451 HA ARG A 32 4.541 -71.795 -61.007 1.00-18.42 H ATOM 452 C ARG A 32 5.633 -69.965 -60.910 1.00-18.42 C ATOM 453 O ARG A 32 5.732 -69.883 -62.127 1.00-18.42 O ATOM 454 CB ARG A 32 3.432 -70.327 -59.864 1.00-18.42 C ATOM 455 1HB ARG A 32 3.683 -69.493 -59.214 1.00-18.42 H ATOM 456 2HB ARG A 32 2.958 -69.916 -60.756 1.00-18.42 H ATOM 457 CG ARG A 32 2.422 -71.198 -59.131 1.00-18.42 C ATOM 458 1HG ARG A 32 1.963 -71.908 -59.818 1.00-18.42 H ATOM 459 2HG ARG A 32 2.929 -71.744 -58.350 1.00-18.42 H ATOM 460 CD ARG A 32 1.357 -70.328 -58.480 1.00-18.42 C ATOM 461 1HD ARG A 32 1.843 -69.455 -58.042 1.00-18.42 H ATOM 462 2HD ARG A 32 0.648 -69.992 -59.237 1.00-18.42 H ATOM 463 NE ARG A 32 0.653 -71.044 -57.405 1.00-18.42 N ATOM 464 HE ARG A 32 0.908 -72.015 -57.247 1.00-18.42 H ATOM 465 CZ ARG A 32 -0.253 -70.533 -56.583 1.00-18.42 C ATOM 466 NH1 ARG A 32 -0.742 -71.308 -55.659 1.00-18.42 N ATOM 467 1HH1 ARG A 32 -0.400 -72.261 -55.583 1.00-18.42 H ATOM 468 2HH1 ARG A 32 -1.442 -70.963 -55.024 1.00-18.42 H ATOM 469 NH2 ARG A 32 -0.664 -69.291 -56.627 1.00-18.42 N ATOM 470 1HH2 ARG A 32 -0.296 -68.665 -57.323 1.00-18.42 H ATOM 471 2HH2 ARG A 32 -1.317 -68.942 -55.945 1.00-18.42 H ATOM 472 N ILE A 33 6.289 -69.169 -60.079 1.00-16.78 N ATOM 473 H ILE A 33 6.157 -69.281 -59.078 1.00-16.78 H ATOM 474 CA ILE A 33 7.171 -68.102 -60.555 1.00-16.78 C ATOM 475 HA ILE A 33 6.632 -67.492 -61.280 1.00-16.78 H ATOM 476 C ILE A 33 8.367 -68.734 -61.264 1.00-16.78 C ATOM 477 O ILE A 33 8.777 -68.293 -62.337 1.00-16.78 O ATOM 478 CB ILE A 33 7.636 -67.190 -59.374 1.00-16.78 C ATOM 479 HB ILE A 33 8.139 -67.813 -58.635 1.00-16.78 H ATOM 480 CG1 ILE A 33 6.411 -66.527 -58.707 1.00-16.78 C ATOM 481 1HG1 ILE A 33 6.004 -65.784 -59.393 1.00-16.78 H ATOM 482 2HG1 ILE A 33 5.641 -67.275 -58.541 1.00-16.78 H ATOM 483 CG2 ILE A 33 8.634 -66.102 -59.861 1.00-16.78 C ATOM 484 1HG2 ILE A 33 8.969 -65.495 -59.018 1.00-16.78 H ATOM 485 2HG2 ILE A 33 8.158 -65.455 -60.599 1.00-16.78 H ATOM 486 3HG2 ILE A 33 9.513 -66.567 -60.307 1.00-16.78 H ATOM 487 CD1 ILE A 33 6.678 -65.849 -57.355 1.00-16.78 C ATOM 488 1HD1 ILE A 33 5.733 -65.504 -56.933 1.00-16.78 H ATOM 489 2HD1 ILE A 33 7.339 -64.992 -57.482 1.00-16.78 H ATOM 490 3HD1 ILE A 33 7.131 -66.561 -56.664 1.00-16.78 H ATOM 491 N ASN A 34 8.909 -69.803 -60.701 1.00-14.81 N ATOM 492 H ASN A 34 8.563 -70.135 -59.804 1.00-14.81 H ATOM 493 CA ASN A 34 10.018 -70.488 -61.357 1.00-14.81 C ATOM 494 HA ASN A 34 10.773 -69.744 -61.601 1.00-14.81 H ATOM 495 C ASN A 34 9.587 -71.120 -62.678 1.00-14.81 C ATOM 496 O ASN A 34 10.314 -71.011 -63.654 1.00-14.81 O ATOM 497 CB ASN A 34 10.658 -71.532 -60.439 1.00-14.81 C ATOM 498 1HB ASN A 34 9.882 -72.079 -59.908 1.00-14.81 H ATOM 499 2HB ASN A 34 11.219 -72.235 -61.056 1.00-14.81 H ATOM 500 CG ASN A 34 11.624 -70.915 -59.455 1.00-14.81 C ATOM 501 OD1 ASN A 34 12.722 -70.511 -59.818 1.00-14.81 O ATOM 502 ND2 ASN A 34 11.227 -70.807 -58.221 1.00-14.81 N ATOM 503 1HD2 ASN A 34 11.872 -70.459 -57.533 1.00-14.81 H ATOM 504 2HD2 ASN A 34 10.279 -71.047 -57.969 1.00-14.81 H ATOM 505 N ARG A 35 8.399 -71.706 -62.756 1.00-16.90 N ATOM 506 H ARG A 35 7.825 -71.817 -61.925 1.00-16.90 H ATOM 507 CA ARG A 35 7.908 -72.220 -64.040 1.00-16.90 C ATOM 508 HA ARG A 35 8.675 -72.855 -64.475 1.00-16.90 H ATOM 509 C ARG A 35 7.639 -71.135 -65.068 1.00-16.90 C ATOM 510 O ARG A 35 7.845 -71.342 -66.250 1.00-16.90 O ATOM 511 CB ARG A 35 6.663 -73.081 -63.861 1.00-16.90 C ATOM 512 1HB ARG A 35 5.971 -72.586 -63.180 1.00-16.90 H ATOM 513 2HB ARG A 35 6.184 -73.180 -64.830 1.00-16.90 H ATOM 514 CG ARG A 35 7.000 -74.478 -63.359 1.00-16.90 C ATOM 515 1HG ARG A 35 7.755 -74.913 -64.011 1.00-16.90 H ATOM 516 2HG ARG A 35 7.410 -74.416 -62.352 1.00-16.90 H ATOM 517 CD ARG A 35 5.784 -75.394 -63.359 1.00-16.90 C ATOM 518 1HD ARG A 35 5.352 -75.401 -64.362 1.00-16.90 H ATOM 519 2HD ARG A 35 6.104 -76.409 -63.120 1.00-16.90 H ATOM 520 NE ARG A 35 4.763 -74.957 -62.393 1.00-16.90 N ATOM 521 HE ARG A 35 4.010 -74.408 -62.771 1.00-16.90 H ATOM 522 CZ ARG A 35 4.757 -75.210 -61.091 1.00-16.90 C ATOM 523 NH1 ARG A 35 3.806 -74.707 -60.354 1.00-16.90 N ATOM 524 1HH1 ARG A 35 3.056 -74.194 -60.781 1.00-16.90 H ATOM 525 2HH1 ARG A 35 3.841 -74.830 -59.352 1.00-16.90 H ATOM 526 NH2 ARG A 35 5.655 -75.945 -60.487 1.00-16.90 N ATOM 527 1HH2 ARG A 35 6.404 -76.350 -61.026 1.00-16.90 H ATOM 528 2HH2 ARG A 35 5.602 -76.091 -59.493 1.00-16.90 H ATOM 529 N LYS A 36 7.245 -69.950 -64.623 1.00 -9.69 N ATOM 530 H LYS A 36 7.075 -69.825 -63.631 1.00 -9.69 H ATOM 531 CA LYS A 36 7.027 -68.826 -65.538 1.00 -9.69 C ATOM 532 HA LYS A 36 6.280 -69.125 -66.274 1.00 -9.69 H ATOM 533 C LYS A 36 8.294 -68.466 -66.315 1.00 -9.69 C ATOM 534 O LYS A 36 8.205 -68.103 -67.482 1.00 -9.69 O ATOM 535 CB LYS A 36 6.502 -67.611 -64.762 1.00 -9.69 C ATOM 536 1HB LYS A 36 5.672 -67.935 -64.135 1.00 -9.69 H ATOM 537 2HB LYS A 36 7.297 -67.237 -64.119 1.00 -9.69 H ATOM 538 CG LYS A 36 6.020 -66.468 -65.647 1.00 -9.69 C ATOM 539 1HG LYS A 36 6.836 -66.145 -66.293 1.00 -9.69 H ATOM 540 2HG LYS A 36 5.194 -66.819 -66.266 1.00 -9.69 H ATOM 541 CD LYS A 36 5.559 -65.279 -64.821 1.00 -9.69 C ATOM 542 1HD LYS A 36 4.757 -65.593 -64.153 1.00 -9.69 H ATOM 543 2HD LYS A 36 6.398 -64.910 -64.230 1.00 -9.69 H ATOM 544 CE LYS A 36 5.059 -64.167 -65.741 1.00 -9.69 C ATOM 545 1HE LYS A 36 5.859 -63.899 -66.435 1.00 -9.69 H ATOM 546 2HE LYS A 36 4.214 -64.545 -66.322 1.00 -9.69 H ATOM 547 NZ LYS A 36 4.631 -62.943 -64.977 1.00 -9.69 N ATOM 548 1HZ LYS A 36 4.307 -62.235 -65.622 1.00 -9.69 H ATOM 549 2HZ LYS A 36 5.412 -62.577 -64.450 1.00 -9.69 H ATOM 550 3HZ LYS A 36 3.882 -63.179 -64.341 1.00 -9.69 H ATOM 551 N LYS A 37 9.462 -68.573 -65.692 1.00-10.08 N ATOM 552 H LYS A 37 9.480 -68.845 -64.718 1.00-10.08 H ATOM 553 CA LYS A 37 10.724 -68.332 -66.409 1.00-10.08 C ATOM 554 HA LYS A 37 10.526 -67.642 -67.230 1.00-10.08 H ATOM 555 C LYS A 37 11.293 -69.604 -67.051 1.00-10.08 C ATOM 556 O LYS A 37 12.043 -69.513 -68.016 1.00-10.08 O ATOM 557 CB LYS A 37 11.771 -67.668 -65.499 1.00-10.08 C ATOM 558 1HB LYS A 37 12.638 -67.415 -66.110 1.00-10.08 H ATOM 559 2HB LYS A 37 11.350 -66.746 -65.099 1.00-10.08 H ATOM 560 CG LYS A 37 12.229 -68.532 -64.336 1.00-10.08 C ATOM 561 1HG LYS A 37 11.366 -68.760 -63.718 1.00-10.08 H ATOM 562 2HG LYS A 37 12.641 -69.461 -64.728 1.00-10.08 H ATOM 563 CD LYS A 37 13.276 -67.896 -63.450 1.00-10.08 C ATOM 564 1HD LYS A 37 14.143 -67.602 -64.042 1.00-10.08 H ATOM 565 2HD LYS A 37 12.847 -67.024 -62.954 1.00-10.08 H ATOM 566 CE LYS A 37 13.675 -68.947 -62.423 1.00-10.08 C ATOM 567 1HE LYS A 37 12.761 -69.330 -61.968 1.00-10.08 H ATOM 568 2HE LYS A 37 14.151 -69.780 -62.944 1.00-10.08 H ATOM 569 NZ LYS A 37 14.575 -68.479 -61.319 1.00-10.08 N ATOM 570 1HZ LYS A 37 14.670 -69.221 -60.633 1.00-10.08 H ATOM 571 2HZ LYS A 37 14.170 -67.673 -60.865 1.00-10.08 H ATOM 572 3HZ LYS A 37 15.484 -68.240 -61.687 1.00-10.08 H ATOM 573 N LYS A 38 10.976 -70.771 -66.501 1.00 2.12 N ATOM 574 H LYS A 38 10.383 -70.784 -65.678 1.00 2.12 H ATOM 575 CA LYS A 38 11.453 -72.067 -66.997 1.00 2.12 C ATOM 576 HA LYS A 38 11.421 -72.075 -68.086 1.00 2.12 H ATOM 577 C LYS A 38 10.562 -73.188 -66.466 1.00 2.12 C ATOM 578 O LYS A 38 10.716 -73.606 -65.317 1.00 2.12 O ATOM 579 CB LYS A 38 12.898 -72.322 -66.532 1.00 2.12 C ATOM 580 1HB LYS A 38 13.535 -71.523 -66.911 1.00 2.12 H ATOM 581 2HB LYS A 38 12.925 -72.281 -65.443 1.00 2.12 H ATOM 582 CG LYS A 38 13.479 -73.667 -66.992 1.00 2.12 C ATOM 583 1HG LYS A 38 12.723 -74.206 -67.558 1.00 2.12 H ATOM 584 2HG LYS A 38 14.334 -73.489 -67.643 1.00 2.12 H ATOM 585 CD LYS A 38 13.920 -74.516 -65.793 1.00 2.12 C ATOM 586 1HD LYS A 38 14.811 -74.062 -65.358 1.00 2.12 H ATOM 587 2HD LYS A 38 13.130 -74.517 -65.041 1.00 2.12 H ATOM 588 CE LYS A 38 14.224 -75.964 -66.168 1.00 2.12 C ATOM 589 1HE LYS A 38 14.858 -75.977 -67.056 1.00 2.12 H ATOM 590 2HE LYS A 38 14.767 -76.429 -65.344 1.00 2.12 H ATOM 591 NZ LYS A 38 12.975 -76.761 -66.428 1.00 2.12 N ATOM 592 1HZ LYS A 38 13.187 -77.721 -66.646 1.00 2.12 H ATOM 593 2HZ LYS A 38 12.444 -76.367 -67.207 1.00 2.12 H ATOM 594 3HZ LYS A 38 12.347 -76.735 -65.631 1.00 2.12 H ATOM 595 N HIS A 39 9.664 -73.696 -67.296 1.00-18.42 N ATOM 596 H HIS A 39 9.515 -73.272 -68.193 1.00-18.42 H ATOM 597 CA HIS A 39 8.954 -74.937 -66.977 1.00-18.42 C ATOM 598 HA HIS A 39 8.544 -74.887 -65.975 1.00-18.42 H ATOM 599 C HIS A 39 10.005 -76.027 -67.020 1.00-18.42 C ATOM 600 O HIS A 39 10.087 -76.856 -66.094 1.00-18.42 O ATOM 601 OXT HIS A 39 10.814 -75.981 -67.973 1.00-18.42 O ATOM 602 CB HIS A 39 7.843 -75.233 -67.989 1.00-18.42 C ATOM 603 1HB HIS A 39 8.278 -75.233 -68.988 1.00-18.42 H ATOM 604 2HB HIS A 39 7.444 -76.227 -67.789 1.00-18.42 H ATOM 605 CG HIS A 39 6.715 -74.251 -67.954 1.00-18.42 C ATOM 606 ND1 HIS A 39 5.616 -74.401 -67.131 1.00-18.42 N ATOM 607 CD2 HIS A 39 6.530 -73.106 -68.668 1.00-18.42 C ATOM 608 HD2 HIS A 39 7.228 -72.727 -69.399 1.00-18.42 H ATOM 609 CE1 HIS A 39 4.819 -73.320 -67.383 1.00-18.42 C ATOM 610 HE1 HIS A 39 3.873 -73.143 -66.892 1.00-18.42 H ATOM 611 NE2 HIS A 39 5.353 -72.497 -68.318 1.00-18.42 N ATOM 612 HE2 HIS A 39 4.977 -71.631 -68.671 1.00-18.42 H TER 613 HIS A 39 END
SEQUENCE	GTWDDIGQGIGRVAYWVGKALGNLSDVNQASRINRKKKH
HELICITY	56.40	INSTAB. INDEX	-6.83	FLEXIBILITY	14.76
a HYD. MOM.	65.83	b HYD. MOM.	32.45	c HYD. MOM	4.85
a MEAN HYD. MOM.	1.69	b MEAN HYD. MOM.	0.83	c MEAN HYD. MOM.	0.12
CHARGE pH5	5.11	CHARGE pH7	4.09	CHARGE pH9	3.62
Δ CHARGE pH5-pH9	1.50	ISOELECTRIC POINT	10.16	BOMAN INDEX	2.20
ΔG	31	CPP	0,12	MLP	-16,15
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	Firmicutes	CLASS	Bacilli	ORDER	Lactobacillales
FAMILY	Streptococcaceae	GENUS	Lactococcus	SPECIES	Lactococcus lactis LMGT2081
DATE	1992
TITLE PAPER	A novel lactococcal bacteriocin whose activity depends on the complementary action of two peptides