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ID	2319	NAME	Bacteriocin lactococcin-G subunit alpha   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\GTWDDIGQGIGRVAYWVGKAMGNMSDVNQASRINRKKKH.pdb REMARK YASARA Written on: Wed May 14 18:26:53 2014 REMARK YASARA Number of models: 1 REMARK YASARA Number of atoms: 608 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 MET GLY ASN MET 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 -9.939 -50.922 -33.126 1.00-24.89 N ATOM 2 1H GLY A 1 -10.808 -51.285 -33.490 1.00-24.89 H ATOM 3 2H GLY A 1 -9.171 -51.416 -33.562 1.00-24.89 H ATOM 4 3H GLY A 1 -9.867 -49.936 -33.330 1.00-24.89 H ATOM 5 CA GLY A 1 -9.888 -51.132 -31.673 1.00-24.89 C ATOM 6 1HA GLY A 1 -10.751 -50.658 -31.209 1.00-24.89 H ATOM 7 2HA GLY A 1 -9.912 -52.201 -31.465 1.00-24.89 H ATOM 8 C GLY A 1 -8.636 -50.540 -31.085 1.00-24.89 C ATOM 9 O GLY A 1 -8.557 -49.324 -30.972 1.00-24.89 O ATOM 10 N THR A 2 -7.665 -51.363 -30.731 1.00 -4.09 N ATOM 11 H THR A 2 -7.763 -52.370 -30.899 1.00 -4.09 H ATOM 12 CA THR A 2 -6.409 -50.922 -30.127 1.00 -4.09 C ATOM 13 HA THR A 2 -6.318 -49.836 -30.145 1.00 -4.09 H ATOM 14 C THR A 2 -5.296 -51.541 -30.964 1.00 -4.09 C ATOM 15 O THR A 2 -5.575 -52.131 -32.004 1.00 -4.09 O ATOM 16 CB THR A 2 -6.310 -51.430 -28.675 1.00 -4.09 C ATOM 17 HB THR A 2 -5.325 -51.202 -28.267 1.00 -4.09 H ATOM 18 OG1 THR A 2 -6.528 -52.839 -28.680 1.00 -4.09 O ATOM 19 HG1 THR A 2 -5.920 -53.242 -28.029 1.00 -4.09 H ATOM 20 CG2 THR A 2 -7.374 -50.816 -27.780 1.00 -4.09 C ATOM 21 1HG2 THR A 2 -7.199 -51.138 -26.753 1.00 -4.09 H ATOM 22 2HG2 THR A 2 -8.363 -51.154 -28.090 1.00 -4.09 H ATOM 23 3HG2 THR A 2 -7.324 -49.729 -27.830 1.00 -4.09 H ATOM 24 N TRP A 3 -4.047 -51.457 -30.529 1.00-25.79 N ATOM 25 H TRP A 3 -3.837 -50.973 -29.671 1.00-25.79 H ATOM 26 CA TRP A 3 -2.941 -52.076 -31.262 1.00-25.79 C ATOM 27 HA TRP A 3 -2.959 -51.725 -32.294 1.00-25.79 H ATOM 28 C TRP A 3 -3.059 -53.596 -31.267 1.00-25.79 C ATOM 29 O TRP A 3 -2.545 -54.280 -32.145 1.00-25.79 O ATOM 30 CB TRP A 3 -1.616 -51.671 -30.619 1.00-25.79 C ATOM 31 1HB TRP A 3 -1.558 -52.101 -29.619 1.00-25.79 H ATOM 32 2HB TRP A 3 -0.796 -52.067 -31.219 1.00-25.79 H ATOM 33 CG TRP A 3 -1.482 -50.182 -30.512 1.00-25.79 C ATOM 34 CD1 TRP A 3 -1.512 -49.434 -29.376 1.00-25.79 C ATOM 35 HD1 TRP A 3 -1.620 -49.849 -28.381 1.00-25.79 H ATOM 36 CD2 TRP A 3 -1.308 -49.240 -31.587 1.00-25.79 C ATOM 37 NE1 TRP A 3 -1.385 -48.100 -29.651 1.00-25.79 N ATOM 38 HE1 TRP A 3 -1.379 -47.370 -28.954 1.00-25.79 H ATOM 39 CE2 TRP A 3 -1.264 -47.940 -31.005 1.00-25.79 C ATOM 40 CE3 TRP A 3 -1.197 -49.359 -32.988 1.00-25.79 C ATOM 41 HE3 TRP A 3 -1.228 -50.331 -33.456 1.00-25.79 H ATOM 42 CZ2 TRP A 3 -1.120 -46.770 -31.780 1.00-25.79 C ATOM 43 HZ2 TRP A 3 -1.098 -45.796 -31.314 1.00-25.79 H ATOM 44 CZ3 TRP A 3 -1.051 -48.185 -33.773 1.00-25.79 C ATOM 45 HZ3 TRP A 3 -0.964 -48.264 -34.848 1.00-25.79 H ATOM 46 CH2 TRP A 3 -1.019 -46.901 -33.154 1.00-25.79 C ATOM 47 HH2 TRP A 3 -0.916 -46.017 -33.768 1.00-25.79 H ATOM 48 N ASP A 4 -3.799 -54.116 -30.302 1.00-13.63 N ATOM 49 H ASP A 4 -4.207 -53.508 -29.603 1.00-13.63 H ATOM 50 CA ASP A 4 -4.042 -55.547 -30.151 1.00-13.63 C ATOM 51 HA ASP A 4 -3.083 -56.062 -30.083 1.00-13.63 H ATOM 52 C ASP A 4 -4.830 -56.113 -31.328 1.00-13.63 C ATOM 53 O ASP A 4 -4.734 -57.295 -31.640 1.00-13.63 O ATOM 54 CB ASP A 4 -4.812 -55.774 -28.852 1.00-13.63 C ATOM 55 1HB ASP A 4 -5.803 -55.333 -28.956 1.00-13.63 H ATOM 56 2HB ASP A 4 -4.926 -56.844 -28.678 1.00-13.63 H ATOM 57 CG ASP A 4 -4.128 -55.125 -27.665 1.00-13.63 C ATOM 58 OD1 ASP A 4 -3.253 -55.750 -27.041 1.00-13.63 O ATOM 59 OD2 ASP A 4 -4.429 -53.931 -27.408 1.00-13.63 O ATOM 60 N ASP A 5 -5.527 -55.247 -32.055 1.00 9.14 N ATOM 61 H ASP A 5 -5.556 -54.273 -31.771 1.00 9.14 H ATOM 62 CA ASP A 5 -6.259 -55.632 -33.265 1.00 9.14 C ATOM 63 HA ASP A 5 -7.049 -56.341 -33.017 1.00 9.14 H ATOM 64 C ASP A 5 -5.326 -56.261 -34.289 1.00 9.14 C ATOM 65 O ASP A 5 -5.703 -57.174 -35.031 1.00 9.14 O ATOM 66 CB ASP A 5 -6.860 -54.411 -33.970 1.00 9.14 C ATOM 67 1HB ASP A 5 -6.106 -53.629 -34.045 1.00 9.14 H ATOM 68 2HB ASP A 5 -7.132 -54.705 -34.982 1.00 9.14 H ATOM 69 CG ASP A 5 -8.103 -53.865 -33.293 1.00 9.14 C ATOM 70 OD1 ASP A 5 -8.967 -53.352 -34.036 1.00 9.14 O ATOM 71 OD2 ASP A 5 -8.232 -53.858 -32.052 1.00 9.14 O ATOM 72 N ILE A 6 -4.099 -55.763 -34.331 1.00 11.69 N ATOM 73 H ILE A 6 -3.838 -55.049 -33.653 1.00 11.69 H ATOM 74 CA ILE A 6 -3.094 -56.199 -35.297 1.00 11.69 C ATOM 75 HA ILE A 6 -3.501 -56.127 -36.303 1.00 11.69 H ATOM 76 C ILE A 6 -2.764 -57.666 -35.019 1.00 11.69 C ATOM 77 O ILE A 6 -2.676 -58.475 -35.951 1.00 11.69 O ATOM 78 CB ILE A 6 -1.829 -55.288 -35.202 1.00 11.69 C ATOM 79 HB ILE A 6 -1.435 -55.350 -34.189 1.00 11.69 H ATOM 80 CG1 ILE A 6 -2.217 -53.820 -35.497 1.00 11.69 C ATOM 81 1HG1 ILE A 6 -2.501 -53.741 -36.546 1.00 11.69 H ATOM 82 2HG1 ILE A 6 -3.083 -53.548 -34.897 1.00 11.69 H ATOM 83 CG2 ILE A 6 -0.728 -55.748 -36.174 1.00 11.69 C ATOM 84 1HG2 ILE A 6 0.176 -55.155 -36.028 1.00 11.69 H ATOM 85 2HG2 ILE A 6 -1.071 -55.630 -37.201 1.00 11.69 H ATOM 86 3HG2 ILE A 6 -0.473 -56.793 -35.994 1.00 11.69 H ATOM 87 CD1 ILE A 6 -1.130 -52.774 -35.206 1.00 11.69 C ATOM 88 1HD1 ILE A 6 -1.542 -51.777 -35.364 1.00 11.69 H ATOM 89 2HD1 ILE A 6 -0.280 -52.910 -35.875 1.00 11.69 H ATOM 90 3HD1 ILE A 6 -0.800 -52.863 -34.170 1.00 11.69 H ATOM 91 N GLY A 7 -2.655 -58.012 -33.742 1.00 16.89 N ATOM 92 H GLY A 7 -2.793 -57.311 -33.024 1.00 16.89 H ATOM 93 CA GLY A 7 -2.374 -59.382 -33.333 1.00 16.89 C ATOM 94 1HA GLY A 7 -1.610 -59.799 -33.988 1.00 16.89 H ATOM 95 2HA GLY A 7 -1.992 -59.378 -32.313 1.00 16.89 H ATOM 96 C GLY A 7 -3.595 -60.281 -33.384 1.00 16.89 C ATOM 97 O GLY A 7 -3.491 -61.456 -33.706 1.00 16.89 O ATOM 98 N GLN A 8 -4.769 -59.716 -33.139 1.00 7.16 N ATOM 99 H GLN A 8 -4.794 -58.747 -32.825 1.00 7.16 H ATOM 100 CA GLN A 8 -6.039 -60.433 -33.273 1.00 7.16 C ATOM 101 HA GLN A 8 -6.003 -61.348 -32.681 1.00 7.16 H ATOM 102 C GLN A 8 -6.281 -60.812 -34.737 1.00 7.16 C ATOM 103 O GLN A 8 -6.991 -61.765 -35.049 1.00 7.16 O ATOM 104 CB GLN A 8 -7.175 -59.538 -32.749 1.00 7.16 C ATOM 105 1HB GLN A 8 -6.944 -59.264 -31.720 1.00 7.16 H ATOM 106 2HB GLN A 8 -7.194 -58.626 -33.342 1.00 7.16 H ATOM 107 CG GLN A 8 -8.579 -60.148 -32.783 1.00 7.16 C ATOM 108 1HG GLN A 8 -9.294 -59.413 -32.415 1.00 7.16 H ATOM 109 2HG GLN A 8 -8.839 -60.387 -33.812 1.00 7.16 H ATOM 110 CD GLN A 8 -8.705 -61.406 -31.946 1.00 7.16 C ATOM 111 OE1 GLN A 8 -8.848 -61.352 -30.740 1.00 7.16 O ATOM 112 NE2 GLN A 8 -8.663 -62.546 -32.584 1.00 7.16 N ATOM 113 1HE2 GLN A 8 -8.789 -63.391 -32.057 1.00 7.16 H ATOM 114 2HE2 GLN A 8 -8.476 -62.564 -33.578 1.00 7.16 H ATOM 115 N GLY A 9 -5.677 -60.058 -35.642 1.00 27.34 N ATOM 116 H GLY A 9 -5.119 -59.269 -35.332 1.00 27.34 H ATOM 117 CA GLY A 9 -5.760 -60.348 -37.062 1.00 27.34 C ATOM 118 1HA GLY A 9 -4.805 -60.095 -37.518 1.00 27.34 H ATOM 119 2HA GLY A 9 -5.946 -61.412 -37.213 1.00 27.34 H ATOM 120 C GLY A 9 -6.839 -59.557 -37.764 1.00 27.34 C ATOM 121 O GLY A 9 -6.892 -59.551 -38.988 1.00 27.34 O ATOM 122 N ILE A 10 -7.645 -58.812 -37.020 1.00 4.95 N ATOM 123 H ILE A 10 -7.573 -58.854 -36.014 1.00 4.95 H ATOM 124 CA ILE A 10 -8.620 -57.905 -37.632 1.00 4.95 C ATOM 125 HA ILE A 10 -9.059 -58.411 -38.493 1.00 4.95 H ATOM 126 C ILE A 10 -7.861 -56.682 -38.170 1.00 4.95 C ATOM 127 O ILE A 10 -8.227 -56.091 -39.185 1.00 4.95 O ATOM 128 CB ILE A 10 -9.782 -57.572 -36.647 1.00 4.95 C ATOM 129 HB ILE A 10 -10.146 -58.520 -36.250 1.00 4.95 H ATOM 130 CG1 ILE A 10 -10.941 -56.912 -37.414 1.00 4.95 C ATOM 131 1HG1 ILE A 10 -10.631 -55.914 -37.726 1.00 4.95 H ATOM 132 2HG1 ILE A 10 -11.134 -57.501 -38.311 1.00 4.95 H ATOM 133 CG2 ILE A 10 -9.308 -56.727 -35.446 1.00 4.95 C ATOM 134 1HG2 ILE A 10 -10.107 -56.648 -34.708 1.00 4.95 H ATOM 135 2HG2 ILE A 10 -9.043 -55.719 -35.773 1.00 4.95 H ATOM 136 3HG2 ILE A 10 -8.450 -57.190 -34.963 1.00 4.95 H ATOM 137 CD1 ILE A 10 -12.260 -56.788 -36.638 1.00 4.95 C ATOM 138 1HD1 ILE A 10 -13.031 -56.390 -37.298 1.00 4.95 H ATOM 139 2HD1 ILE A 10 -12.138 -56.112 -35.791 1.00 4.95 H ATOM 140 3HD1 ILE A 10 -12.574 -57.770 -36.278 1.00 4.95 H ATOM 141 N GLY A 11 -6.698 -56.422 -37.581 1.00 41.50 N ATOM 142 H GLY A 11 -6.457 -56.920 -36.726 1.00 41.50 H ATOM 143 CA GLY A 11 -5.729 -55.464 -38.096 1.00 41.50 C ATOM 144 1HA GLY A 11 -6.256 -54.633 -38.564 1.00 41.50 H ATOM 145 2HA GLY A 11 -5.134 -55.078 -37.270 1.00 41.50 H ATOM 146 C GLY A 11 -4.796 -56.087 -39.122 1.00 41.50 C ATOM 147 O GLY A 11 -3.747 -55.543 -39.453 1.00 41.50 O ATOM 148 N ARG A 12 -5.212 -57.242 -39.629 1.00 0.12 N ATOM 149 H ARG A 12 -6.042 -57.653 -39.216 1.00 0.12 H ATOM 150 CA ARG A 12 -4.687 -57.942 -40.814 1.00 0.12 C ATOM 151 HA ARG A 12 -5.294 -58.843 -40.908 1.00 0.12 H ATOM 152 C ARG A 12 -3.254 -58.452 -40.873 1.00 0.12 C ATOM 153 O ARG A 12 -3.007 -59.407 -41.593 1.00 0.12 O ATOM 154 CB ARG A 12 -4.991 -57.111 -42.069 1.00 0.12 C ATOM 155 1HB ARG A 12 -4.356 -56.225 -42.070 1.00 0.12 H ATOM 156 2HB ARG A 12 -4.756 -57.709 -42.951 1.00 0.12 H ATOM 157 CG ARG A 12 -6.453 -56.672 -42.138 1.00 0.12 C ATOM 158 1HG ARG A 12 -7.096 -57.548 -42.052 1.00 0.12 H ATOM 159 2HG ARG A 12 -6.662 -56.003 -41.306 1.00 0.12 H ATOM 160 CD ARG A 12 -6.807 -55.927 -43.404 1.00 0.12 C ATOM 161 1HD ARG A 12 -6.098 -55.111 -43.550 1.00 0.12 H ATOM 162 2HD ARG A 12 -6.762 -56.610 -44.254 1.00 0.12 H ATOM 163 NE ARG A 12 -8.164 -55.379 -43.261 1.00 0.12 N ATOM 164 HE ARG A 12 -8.616 -55.550 -42.374 1.00 0.12 H ATOM 165 CZ ARG A 12 -8.835 -54.674 -44.162 1.00 0.12 C ATOM 166 NH1 ARG A 12 -10.023 -54.236 -43.852 1.00 0.12 N ATOM 167 1HH1 ARG A 12 -10.406 -54.419 -42.938 1.00 0.12 H ATOM 168 2HH1 ARG A 12 -10.558 -53.707 -44.518 1.00 0.12 H ATOM 169 NH2 ARG A 12 -8.369 -54.390 -45.352 1.00 0.12 N ATOM 170 1HH2 ARG A 12 -7.454 -54.715 -45.614 1.00 0.12 H ATOM 171 2HH2 ARG A 12 -8.917 -53.851 -45.999 1.00 0.12 H ATOM 172 N VAL A 13 -2.315 -57.901 -40.124 1.00 19.65 N ATOM 173 H VAL A 13 -2.546 -57.100 -39.544 1.00 19.65 H ATOM 174 CA VAL A 13 -0.932 -58.380 -40.194 1.00 19.65 C ATOM 175 HA VAL A 13 -0.642 -58.393 -41.245 1.00 19.65 H ATOM 176 C VAL A 13 -0.801 -59.813 -39.675 1.00 19.65 C ATOM 177 O VAL A 13 -0.165 -60.635 -40.324 1.00 19.65 O ATOM 178 CB VAL A 13 0.043 -57.436 -39.442 1.00 19.65 C ATOM 179 HB VAL A 13 -0.231 -57.433 -38.392 1.00 19.65 H ATOM 180 CG1 VAL A 13 1.501 -57.905 -39.562 1.00 19.65 C ATOM 181 1HG1 VAL A 13 2.160 -57.200 -39.056 1.00 19.65 H ATOM 182 2HG1 VAL A 13 1.792 -57.975 -40.612 1.00 19.65 H ATOM 183 3HG1 VAL A 13 1.624 -58.883 -39.094 1.00 19.65 H ATOM 184 CG2 VAL A 13 -0.074 -56.000 -39.988 1.00 19.65 C ATOM 185 1HG2 VAL A 13 0.648 -55.355 -39.485 1.00 19.65 H ATOM 186 2HG2 VAL A 13 -1.069 -55.596 -39.806 1.00 19.65 H ATOM 187 3HG2 VAL A 13 0.129 -55.986 -41.061 1.00 19.65 H ATOM 188 N ALA A 14 -1.437 -60.167 -38.564 1.00 -6.05 N ATOM 189 H ALA A 14 -1.955 -59.489 -38.021 1.00 -6.05 H ATOM 190 CA ALA A 14 -1.351 -61.552 -38.092 1.00 -6.05 C ATOM 191 HA ALA A 14 -0.297 -61.828 -38.029 1.00 -6.05 H ATOM 192 C ALA A 14 -2.020 -62.524 -39.074 1.00 -6.05 C ATOM 193 O ALA A 14 -1.539 -63.634 -39.289 1.00 -6.05 O ATOM 194 CB ALA A 14 -1.963 -61.678 -36.699 1.00 -6.05 C ATOM 195 1HB ALA A 14 -1.441 -61.020 -36.004 1.00 -6.05 H ATOM 196 2HB ALA A 14 -1.863 -62.707 -36.348 1.00 -6.05 H ATOM 197 3HB ALA A 14 -3.019 -61.415 -36.716 1.00 -6.05 H ATOM 198 N TYR A 15 -3.093 -62.080 -39.716 1.00-13.12 N ATOM 199 H TYR A 15 -3.452 -61.164 -39.517 1.00-13.12 H ATOM 200 CA TYR A 15 -3.732 -62.886 -40.754 1.00-13.12 C ATOM 201 HA TYR A 15 -3.971 -63.872 -40.355 1.00-13.12 H ATOM 202 C TYR A 15 -2.769 -63.077 -41.921 1.00-13.12 C ATOM 203 O TYR A 15 -2.628 -64.182 -42.434 1.00-13.12 O ATOM 204 CB TYR A 15 -5.019 -62.230 -41.266 1.00-13.12 C ATOM 205 1HB TYR A 15 -5.777 -62.261 -40.484 1.00-13.12 H ATOM 206 2HB TYR A 15 -4.818 -61.192 -41.516 1.00-13.12 H ATOM 207 CG TYR A 15 -5.534 -62.921 -42.512 1.00-13.12 C ATOM 208 CD1 TYR A 15 -6.224 -64.147 -42.427 1.00-13.12 C ATOM 209 HD1 TYR A 15 -6.451 -64.571 -41.458 1.00-13.12 H ATOM 210 CD2 TYR A 15 -5.268 -62.386 -43.792 1.00-13.12 C ATOM 211 HD2 TYR A 15 -4.750 -61.440 -43.882 1.00-13.12 H ATOM 212 CE1 TYR A 15 -6.605 -64.851 -43.603 1.00-13.12 C ATOM 213 HE1 TYR A 15 -7.119 -65.797 -43.525 1.00-13.12 H ATOM 214 CE2 TYR A 15 -5.645 -63.088 -44.968 1.00-13.12 C ATOM 215 HE2 TYR A 15 -5.422 -62.684 -45.943 1.00-13.12 H ATOM 216 CZ TYR A 15 -6.298 -64.317 -44.859 1.00-13.12 C ATOM 217 OH TYR A 15 -6.634 -65.004 -45.998 1.00-13.12 O ATOM 218 HH TYR A 15 -7.095 -65.823 -45.806 1.00-13.12 H ATOM 219 N TRP A 16 -2.079 -62.021 -42.327 1.00 -9.21 N ATOM 220 H TRP A 16 -2.231 -61.116 -41.889 1.00 -9.21 H ATOM 221 CA TRP A 16 -1.113 -62.121 -43.415 1.00 -9.21 C ATOM 222 HA TRP A 16 -1.624 -62.503 -44.298 1.00 -9.21 H ATOM 223 C TRP A 16 0.004 -63.097 -43.069 1.00 -9.21 C ATOM 224 O TRP A 16 0.385 -63.895 -43.913 1.00 -9.21 O ATOM 225 CB TRP A 16 -0.520 -60.750 -43.752 1.00 -9.21 C ATOM 226 1HB TRP A 16 -1.330 -60.049 -43.950 1.00 -9.21 H ATOM 227 2HB TRP A 16 0.057 -60.388 -42.904 1.00 -9.21 H ATOM 228 CG TRP A 16 0.379 -60.814 -44.952 1.00 -9.21 C ATOM 229 CD1 TRP A 16 0.031 -60.627 -46.252 1.00 -9.21 C ATOM 230 HD1 TRP A 16 -0.968 -60.368 -46.579 1.00 -9.21 H ATOM 231 CD2 TRP A 16 1.787 -61.122 -44.973 1.00 -9.21 C ATOM 232 NE1 TRP A 16 1.097 -60.819 -47.090 1.00 -9.21 N ATOM 233 HE1 TRP A 16 1.062 -60.727 -48.094 1.00 -9.21 H ATOM 234 CE2 TRP A 16 2.189 -61.159 -46.339 1.00 -9.21 C ATOM 235 CE3 TRP A 16 2.747 -61.398 -43.976 1.00 -9.21 C ATOM 236 HE3 TRP A 16 2.474 -61.365 -42.933 1.00 -9.21 H ATOM 237 CZ2 TRP A 16 3.503 -61.490 -46.730 1.00 -9.21 C ATOM 238 HZ2 TRP A 16 3.781 -61.517 -47.773 1.00 -9.21 H ATOM 239 CZ3 TRP A 16 4.069 -61.735 -44.363 1.00 -9.21 C ATOM 240 HZ3 TRP A 16 4.809 -61.957 -43.608 1.00 -9.21 H ATOM 241 CH2 TRP A 16 4.429 -61.780 -45.742 1.00 -9.21 C ATOM 242 HH2 TRP A 16 5.441 -62.042 -46.019 1.00 -9.21 H ATOM 243 N VAL A 17 0.499 -63.091 -41.839 1.00-16.96 N ATOM 244 H VAL A 17 0.166 -62.406 -41.165 1.00-16.96 H ATOM 245 CA VAL A 17 1.543 -64.040 -41.439 1.00-16.96 C ATOM 246 HA VAL A 17 2.359 -63.979 -42.159 1.00-16.96 H ATOM 247 C VAL A 17 0.994 -65.465 -41.493 1.00-16.96 C ATOM 248 O VAL A 17 1.651 -66.358 -42.021 1.00-16.96 O ATOM 249 CB VAL A 17 2.110 -63.713 -40.025 1.00-16.96 C ATOM 250 HB VAL A 17 1.285 -63.684 -39.314 1.00-16.96 H ATOM 251 CG1 VAL A 17 3.123 -64.772 -39.552 1.00-16.96 C ATOM 252 1HG1 VAL A 17 3.538 -64.483 -38.586 1.00-16.96 H ATOM 253 2HG1 VAL A 17 3.932 -64.873 -40.277 1.00-16.96 H ATOM 254 3HG1 VAL A 17 2.629 -65.738 -39.434 1.00-16.96 H ATOM 255 CG2 VAL A 17 2.807 -62.340 -40.031 1.00-16.96 C ATOM 256 1HG2 VAL A 17 3.167 -62.108 -39.029 1.00-16.96 H ATOM 257 2HG2 VAL A 17 2.114 -61.561 -40.335 1.00-16.96 H ATOM 258 3HG2 VAL A 17 3.652 -62.351 -40.721 1.00-16.96 H ATOM 259 N GLY A 18 -0.228 -65.690 -41.029 1.00 -9.20 N ATOM 260 H GLY A 18 -0.760 -64.938 -40.597 1.00 -9.20 H ATOM 261 CA GLY A 18 -0.807 -67.023 -41.125 1.00 -9.20 C ATOM 262 1HA GLY A 18 -0.141 -67.732 -40.632 1.00 -9.20 H ATOM 263 2HA GLY A 18 -1.773 -67.034 -40.622 1.00 -9.20 H ATOM 264 C GLY A 18 -0.994 -67.463 -42.566 1.00 -9.20 C ATOM 265 O GLY A 18 -0.711 -68.606 -42.928 1.00 -9.20 O ATOM 266 N LYS A 19 -1.415 -66.541 -43.421 1.00-16.22 N ATOM 267 H LYS A 19 -1.647 -65.612 -43.070 1.00-16.22 H ATOM 268 CA LYS A 19 -1.574 -66.815 -44.850 1.00-16.22 C ATOM 269 HA LYS A 19 -2.197 -67.702 -44.961 1.00-16.22 H ATOM 270 C LYS A 19 -0.218 -67.119 -45.473 1.00-16.22 C ATOM 271 O LYS A 19 -0.126 -67.996 -46.318 1.00-16.22 O ATOM 272 CB LYS A 19 -2.272 -65.624 -45.530 1.00-16.22 C ATOM 273 1HB LYS A 19 -3.124 -65.356 -44.905 1.00-16.22 H ATOM 274 2HB LYS A 19 -1.596 -64.770 -45.551 1.00-16.22 H ATOM 275 CG LYS A 19 -2.815 -65.872 -46.944 1.00-16.22 C ATOM 276 1HG LYS A 19 -3.170 -66.900 -47.012 1.00-16.22 H ATOM 277 2HG LYS A 19 -3.666 -65.206 -47.097 1.00-16.22 H ATOM 278 CD LYS A 19 -1.806 -65.606 -48.066 1.00-16.22 C ATOM 279 1HD LYS A 19 -1.440 -64.583 -47.984 1.00-16.22 H ATOM 280 2HD LYS A 19 -0.966 -66.292 -47.976 1.00-16.22 H ATOM 281 CE LYS A 19 -2.458 -65.805 -49.432 1.00-16.22 C ATOM 282 1HE LYS A 19 -2.838 -66.827 -49.497 1.00-16.22 H ATOM 283 2HE LYS A 19 -3.294 -65.110 -49.534 1.00-16.22 H ATOM 284 NZ LYS A 19 -1.478 -65.574 -50.541 1.00-16.22 N ATOM 285 1HZ LYS A 19 -1.909 -65.696 -51.450 1.00-16.22 H ATOM 286 2HZ LYS A 19 -0.713 -66.239 -50.480 1.00-16.22 H ATOM 287 3HZ LYS A 19 -1.084 -64.645 -50.497 1.00-16.22 H ATOM 288 N ALA A 20 0.829 -66.424 -45.055 1.00 -7.28 N ATOM 289 H ALA A 20 0.691 -65.685 -44.371 1.00 -7.28 H ATOM 290 CA ALA A 20 2.180 -66.653 -45.558 1.00 -7.28 C ATOM 291 HA ALA A 20 2.144 -66.634 -46.646 1.00 -7.28 H ATOM 292 C ALA A 20 2.725 -68.021 -45.128 1.00 -7.28 C ATOM 293 O ALA A 20 3.411 -68.686 -45.899 1.00 -7.28 O ATOM 294 CB ALA A 20 3.111 -65.524 -45.088 1.00 -7.28 C ATOM 295 1HB ALA A 20 2.718 -64.559 -45.413 1.00 -7.28 H ATOM 296 2HB ALA A 20 4.104 -65.668 -45.514 1.00 -7.28 H ATOM 297 3HB ALA A 20 3.186 -65.529 -44.000 1.00 -7.28 H ATOM 298 N MET A 21 2.406 -68.465 -43.921 1.00-26.33 N ATOM 299 H MET A 21 1.878 -67.869 -43.287 1.00-26.33 H ATOM 300 CA MET A 21 2.827 -69.796 -43.478 1.00-26.33 C ATOM 301 HA MET A 21 3.887 -69.923 -43.700 1.00-26.33 H ATOM 302 C MET A 21 2.059 -70.890 -44.218 1.00-26.33 C ATOM 303 O MET A 21 2.602 -71.944 -44.528 1.00-26.33 O ATOM 304 CB MET A 21 2.612 -69.960 -41.971 1.00-26.33 C ATOM 305 1HB MET A 21 1.570 -69.740 -41.739 1.00-26.33 H ATOM 306 2HB MET A 21 2.812 -70.998 -41.710 1.00-26.33 H ATOM 307 CG MET A 21 3.508 -69.065 -41.120 1.00-26.33 C ATOM 308 1HG MET A 21 4.550 -69.306 -41.327 1.00-26.33 H ATOM 309 2HG MET A 21 3.335 -68.026 -41.394 1.00-26.33 H ATOM 310 SD MET A 21 3.198 -69.247 -39.347 1.00-26.33 S ATOM 311 CE MET A 21 3.952 -70.849 -38.978 1.00-26.33 C ATOM 312 1HE MET A 21 3.856 -71.056 -37.911 1.00-26.33 H ATOM 313 2HE MET A 21 5.008 -70.829 -39.247 1.00-26.33 H ATOM 314 3HE MET A 21 3.447 -71.634 -39.542 1.00-26.33 H ATOM 315 N GLY A 22 0.798 -70.629 -44.532 1.00 6.92 N ATOM 316 H GLY A 22 0.380 -69.752 -44.233 1.00 6.92 H ATOM 317 CA GLY A 22 -0.031 -71.586 -45.251 1.00 6.92 C ATOM 318 1HA GLY A 22 0.298 -72.599 -45.019 1.00 6.92 H ATOM 319 2HA GLY A 22 -1.057 -71.475 -44.899 1.00 6.92 H ATOM 320 C GLY A 22 -0.042 -71.411 -46.758 1.00 6.92 C ATOM 321 O GLY A 22 -1.000 -71.815 -47.418 1.00 6.92 O ATOM 322 N ASN A 23 0.962 -70.751 -47.320 1.00 23.64 N ATOM 323 H ASN A 23 1.789 -70.549 -46.772 1.00 23.64 H ATOM 324 CA ASN A 23 0.835 -70.146 -48.652 1.00 23.64 C ATOM 325 HA ASN A 23 -0.174 -69.733 -48.676 1.00 23.64 H ATOM 326 C ASN A 23 0.963 -71.030 -49.897 1.00 23.64 C ATOM 327 O ASN A 23 1.538 -70.636 -50.915 1.00 23.64 O ATOM 328 CB ASN A 23 1.799 -68.969 -48.771 1.00 23.64 C ATOM 329 1HB ASN A 23 1.901 -68.516 -47.797 1.00 23.64 H ATOM 330 2HB ASN A 23 2.780 -69.318 -49.095 1.00 23.64 H ATOM 331 CG ASN A 23 1.299 -67.904 -49.702 1.00 23.64 C ATOM 332 OD1 ASN A 23 0.214 -67.998 -50.283 1.00 23.64 O ATOM 333 ND2 ASN A 23 2.061 -66.858 -49.828 1.00 23.64 N ATOM 334 1HD2 ASN A 23 1.792 -66.134 -50.495 1.00 23.64 H ATOM 335 2HD2 ASN A 23 2.916 -66.786 -49.304 1.00 23.64 H ATOM 336 N MET A 24 0.342 -72.200 -49.863 1.00-11.94 N ATOM 337 H MET A 24 -0.125 -72.472 -48.999 1.00-11.94 H ATOM 338 CA MET A 24 0.248 -73.071 -51.035 1.00-11.94 C ATOM 339 HA MET A 24 1.248 -73.282 -51.411 1.00-11.94 H ATOM 340 C MET A 24 -0.550 -72.349 -52.126 1.00-11.94 C ATOM 341 O MET A 24 -0.382 -72.591 -53.321 1.00-11.94 O ATOM 342 CB MET A 24 -0.432 -74.387 -50.646 1.00-11.94 C ATOM 343 1HB MET A 24 0.100 -74.807 -49.792 1.00-11.94 H ATOM 344 2HB MET A 24 -1.456 -74.172 -50.342 1.00-11.94 H ATOM 345 CG MET A 24 -0.449 -75.433 -51.757 1.00-11.94 C ATOM 346 1HG MET A 24 -0.994 -75.040 -52.614 1.00-11.94 H ATOM 347 2HG MET A 24 0.578 -75.635 -52.060 1.00-11.94 H ATOM 348 SD MET A 24 -1.215 -76.986 -51.244 1.00-11.94 S ATOM 349 CE MET A 24 -2.977 -76.578 -51.212 1.00-11.94 C ATOM 350 1HE MET A 24 -3.549 -77.472 -50.963 1.00-11.94 H ATOM 351 2HE MET A 24 -3.288 -76.214 -52.191 1.00-11.94 H ATOM 352 3HE MET A 24 -3.166 -75.813 -50.459 1.00-11.94 H ATOM 353 N SER A 25 -1.362 -71.388 -51.710 1.00-16.39 N ATOM 354 H SER A 25 -1.474 -71.215 -50.719 1.00-16.39 H ATOM 355 CA SER A 25 -2.078 -70.519 -52.631 1.00-16.39 C ATOM 356 HA SER A 25 -2.767 -71.118 -53.226 1.00-16.39 H ATOM 357 C SER A 25 -1.156 -69.776 -53.591 1.00-16.39 C ATOM 358 O SER A 25 -1.431 -69.729 -54.785 1.00-16.39 O ATOM 359 CB SER A 25 -2.862 -69.500 -51.808 1.00-16.39 C ATOM 360 1HB SER A 25 -2.924 -68.555 -52.349 1.00-16.39 H ATOM 361 2HB SER A 25 -3.868 -69.884 -51.637 1.00-16.39 H ATOM 362 OG SER A 25 -2.226 -69.313 -50.550 1.00-16.39 O ATOM 363 HG SER A 25 -1.412 -68.797 -50.666 1.00-16.39 H ATOM 364 N ASP A 26 -0.053 -69.217 -53.114 1.00-10.35 N ATOM 365 H ASP A 26 0.191 -69.287 -52.131 1.00-10.35 H ATOM 366 CA ASP A 26 0.813 -68.445 -54.007 1.00-10.35 C ATOM 367 HA ASP A 26 0.198 -67.998 -54.781 1.00-10.35 H ATOM 368 C ASP A 26 1.809 -69.352 -54.701 1.00-10.35 C ATOM 369 O ASP A 26 2.312 -69.008 -55.760 1.00-10.35 O ATOM 370 CB ASP A 26 1.530 -67.294 -53.305 1.00-10.35 C ATOM 371 1HB ASP A 26 2.058 -67.686 -52.438 1.00-10.35 H ATOM 372 2HB ASP A 26 2.261 -66.868 -53.992 1.00-10.35 H ATOM 373 CG ASP A 26 0.575 -66.187 -52.875 1.00-10.35 C ATOM 374 OD1 ASP A 26 -0.596 -66.155 -53.329 1.00-10.35 O ATOM 375 OD2 ASP A 26 0.964 -65.364 -52.018 1.00-10.35 O ATOM 376 N VAL A 27 2.009 -70.560 -54.193 1.00-15.06 N ATOM 377 H VAL A 27 1.618 -70.799 -53.290 1.00-15.06 H ATOM 378 CA VAL A 27 2.762 -71.569 -54.943 1.00-15.06 C ATOM 379 HA VAL A 27 3.704 -71.134 -55.279 1.00-15.06 H ATOM 380 C VAL A 27 1.925 -71.926 -56.174 1.00-15.06 C ATOM 381 O VAL A 27 2.432 -72.024 -57.297 1.00-15.06 O ATOM 382 CB VAL A 27 3.068 -72.831 -54.081 1.00-15.06 C ATOM 383 HB VAL A 27 2.129 -73.251 -53.729 1.00-15.06 H ATOM 384 CG1 VAL A 27 3.806 -73.906 -54.891 1.00-15.06 C ATOM 385 1HG1 VAL A 27 4.033 -74.761 -54.252 1.00-15.06 H ATOM 386 2HG1 VAL A 27 4.737 -73.504 -55.295 1.00-15.06 H ATOM 387 3HG1 VAL A 27 3.180 -74.252 -55.714 1.00-15.06 H ATOM 388 CG2 VAL A 27 3.919 -72.452 -52.859 1.00-15.06 C ATOM 389 1HG2 VAL A 27 4.123 -73.340 -52.260 1.00-15.06 H ATOM 390 2HG2 VAL A 27 3.390 -71.736 -52.233 1.00-15.06 H ATOM 391 3HG2 VAL A 27 4.864 -72.011 -53.178 1.00-15.06 H ATOM 392 N ASN A 28 0.614 -72.037 -55.997 1.00 -4.27 N ATOM 393 H ASN A 28 0.226 -71.988 -55.057 1.00 -4.27 H ATOM 394 CA ASN A 28 -0.275 -72.242 -57.135 1.00 -4.27 C ATOM 395 HA ASN A 28 0.071 -73.116 -57.686 1.00 -4.27 H ATOM 396 C ASN A 28 -0.213 -71.044 -58.079 1.00 -4.27 C ATOM 397 O ASN A 28 -0.138 -71.240 -59.290 1.00 -4.27 O ATOM 398 CB ASN A 28 -1.717 -72.494 -56.681 1.00 -4.27 C ATOM 399 1HB ASN A 28 -1.721 -73.309 -55.959 1.00 -4.27 H ATOM 400 2HB ASN A 28 -2.109 -71.604 -56.199 1.00 -4.27 H ATOM 401 CG ASN A 28 -2.634 -72.842 -57.827 1.00 -4.27 C ATOM 402 OD1 ASN A 28 -3.092 -71.980 -58.572 1.00 -4.27 O ATOM 403 ND2 ASN A 28 -2.929 -74.103 -57.973 1.00 -4.27 N ATOM 404 1HD2 ASN A 28 -3.559 -74.374 -58.708 1.00 -4.27 H ATOM 405 2HD2 ASN A 28 -2.537 -74.791 -57.349 1.00 -4.27 H ATOM 406 N GLN A 29 -0.183 -69.820 -57.570 1.00-17.28 N ATOM 407 H GLN A 29 -0.238 -69.685 -56.564 1.00-17.28 H ATOM 408 CA GLN A 29 -0.088 -68.657 -58.457 1.00-17.28 C ATOM 409 HA GLN A 29 -0.885 -68.741 -59.190 1.00-17.28 H ATOM 410 C GLN A 29 1.235 -68.626 -59.222 1.00-17.28 C ATOM 411 O GLN A 29 1.250 -68.381 -60.427 1.00-17.28 O ATOM 412 CB GLN A 29 -0.279 -67.335 -57.706 1.00-17.28 C ATOM 413 1HB GLN A 29 0.529 -67.201 -56.988 1.00-17.28 H ATOM 414 2HB GLN A 29 -0.224 -66.529 -58.437 1.00-17.28 H ATOM 415 CG GLN A 29 -1.611 -67.231 -56.976 1.00-17.28 C ATOM 416 1HG GLN A 29 -2.347 -67.844 -57.488 1.00-17.28 H ATOM 417 2HG GLN A 29 -1.495 -67.598 -55.964 1.00-17.28 H ATOM 418 CD GLN A 29 -2.137 -65.821 -56.914 1.00-17.28 C ATOM 419 OE1 GLN A 29 -2.788 -65.366 -57.843 1.00-17.28 O ATOM 420 NE2 GLN A 29 -1.901 -65.135 -55.829 1.00-17.28 N ATOM 421 1HE2 GLN A 29 -2.225 -64.186 -55.783 1.00-17.28 H ATOM 422 2HE2 GLN A 29 -1.387 -65.547 -55.048 1.00-17.28 H ATOM 423 N ALA A 30 2.336 -68.957 -58.564 1.00-16.56 N ATOM 424 H ALA A 30 2.290 -69.135 -57.560 1.00-16.56 H ATOM 425 CA ALA A 30 3.638 -69.032 -59.217 1.00-16.56 C ATOM 426 HA ALA A 30 3.847 -68.071 -59.687 1.00-16.56 H ATOM 427 C ALA A 30 3.636 -70.104 -60.307 1.00-16.56 C ATOM 428 O ALA A 30 4.256 -69.937 -61.356 1.00-16.56 O ATOM 429 CB ALA A 30 4.724 -69.319 -58.175 1.00-16.56 C ATOM 430 1HB ALA A 30 4.719 -68.535 -57.416 1.00-16.56 H ATOM 431 2HB ALA A 30 5.701 -69.341 -58.658 1.00-16.56 H ATOM 432 3HB ALA A 30 4.537 -70.280 -57.692 1.00-16.56 H ATOM 433 N SER A 31 2.917 -71.197 -60.100 1.00-14.91 N ATOM 434 H SER A 31 2.460 -71.335 -59.200 1.00-14.91 H ATOM 435 CA SER A 31 2.827 -72.223 -61.137 1.00-14.91 C ATOM 436 HA SER A 31 3.845 -72.461 -61.444 1.00-14.91 H ATOM 437 C SER A 31 2.074 -71.723 -62.373 1.00-14.91 C ATOM 438 O SER A 31 2.368 -72.142 -63.489 1.00-14.91 O ATOM 439 CB SER A 31 2.195 -73.511 -60.601 1.00-14.91 C ATOM 440 1HB SER A 31 2.444 -74.324 -61.283 1.00-14.91 H ATOM 441 2HB SER A 31 2.619 -73.739 -59.622 1.00-14.91 H ATOM 442 OG SER A 31 0.780 -73.429 -60.507 1.00-14.91 O ATOM 443 HG SER A 31 0.546 -72.663 -59.953 1.00-14.91 H ATOM 444 N ARG A 32 1.136 -70.794 -62.209 1.00-23.01 N ATOM 445 H ARG A 32 0.924 -70.460 -61.272 1.00-23.01 H ATOM 446 CA ARG A 32 0.420 -70.218 -63.359 1.00-23.01 C ATOM 447 HA ARG A 32 0.061 -71.018 -64.003 1.00-23.01 H ATOM 448 C ARG A 32 1.385 -69.353 -64.151 1.00-23.01 C ATOM 449 O ARG A 32 1.404 -69.391 -65.377 1.00-23.01 O ATOM 450 CB ARG A 32 -0.752 -69.326 -62.922 1.00-23.01 C ATOM 451 1HB ARG A 32 -0.342 -68.486 -62.365 1.00-23.01 H ATOM 452 2HB ARG A 32 -1.239 -68.925 -63.811 1.00-23.01 H ATOM 453 CG ARG A 32 -1.802 -69.993 -62.046 1.00-23.01 C ATOM 454 1HG ARG A 32 -2.403 -70.686 -62.634 1.00-23.01 H ATOM 455 2HG ARG A 32 -1.304 -70.541 -61.259 1.00-23.01 H ATOM 456 CD ARG A 32 -2.693 -68.945 -61.397 1.00-23.01 C ATOM 457 1HD ARG A 32 -2.069 -68.113 -61.066 1.00-23.01 H ATOM 458 2HD ARG A 32 -3.413 -68.575 -62.128 1.00-23.01 H ATOM 459 NE ARG A 32 -3.391 -69.487 -60.222 1.00-23.01 N ATOM 460 HE ARG A 32 -3.234 -70.464 -59.997 1.00-23.01 H ATOM 461 CZ ARG A 32 -4.174 -68.812 -59.391 1.00-23.01 C ATOM 462 NH1 ARG A 32 -4.680 -69.452 -58.377 1.00-23.01 N ATOM 463 1HH1 ARG A 32 -4.441 -70.428 -58.242 1.00-23.01 H ATOM 464 2HH1 ARG A 32 -5.290 -68.982 -57.732 1.00-23.01 H ATOM 465 NH2 ARG A 32 -4.447 -67.538 -59.514 1.00-23.01 N ATOM 466 1HH2 ARG A 32 -4.058 -67.013 -60.277 1.00-23.01 H ATOM 467 2HH2 ARG A 32 -5.014 -67.066 -58.831 1.00-23.01 H ATOM 468 N ILE A 33 2.191 -68.585 -63.434 1.00-24.08 N ATOM 469 H ILE A 33 2.117 -68.594 -62.421 1.00-24.08 H ATOM 470 CA ILE A 33 3.163 -67.689 -64.058 1.00-24.08 C ATOM 471 HA ILE A 33 2.653 -67.069 -64.794 1.00-24.08 H ATOM 472 C ILE A 33 4.194 -68.540 -64.792 1.00-24.08 C ATOM 473 O ILE A 33 4.503 -68.277 -65.946 1.00-24.08 O ATOM 474 CB ILE A 33 3.847 -66.762 -63.003 1.00-24.08 C ATOM 475 HB ILE A 33 4.318 -67.389 -62.247 1.00-24.08 H ATOM 476 CG1 ILE A 33 2.785 -65.876 -62.318 1.00-24.08 C ATOM 477 1HG1 ILE A 33 2.433 -65.137 -63.039 1.00-24.08 H ATOM 478 2HG1 ILE A 33 1.933 -66.488 -62.036 1.00-24.08 H ATOM 479 CG2 ILE A 33 4.942 -65.877 -63.661 1.00-24.08 C ATOM 480 1HG2 ILE A 33 5.420 -65.248 -62.909 1.00-24.08 H ATOM 481 2HG2 ILE A 33 4.504 -65.241 -64.431 1.00-24.08 H ATOM 482 3HG2 ILE A 33 5.713 -66.502 -64.112 1.00-24.08 H ATOM 483 CD1 ILE A 33 3.251 -65.140 -61.054 1.00-24.08 C ATOM 484 1HD1 ILE A 33 2.402 -64.625 -60.604 1.00-24.08 H ATOM 485 2HD1 ILE A 33 4.016 -64.405 -61.301 1.00-24.08 H ATOM 486 3HD1 ILE A 33 3.650 -65.854 -60.333 1.00-24.08 H ATOM 487 N ASN A 34 4.685 -69.599 -64.168 1.00-13.31 N ATOM 488 H ASN A 34 4.403 -69.789 -63.209 1.00-13.31 H ATOM 489 CA ASN A 34 5.653 -70.477 -64.823 1.00-13.31 C ATOM 490 HA ASN A 34 6.464 -69.863 -65.208 1.00-13.31 H ATOM 491 C ASN A 34 5.074 -71.225 -66.026 1.00-13.31 C ATOM 492 O ASN A 34 5.792 -71.466 -66.988 1.00-13.31 O ATOM 493 CB ASN A 34 6.261 -71.462 -63.823 1.00-13.31 C ATOM 494 1HB ASN A 34 5.480 -71.834 -63.163 1.00-13.31 H ATOM 495 2HB ASN A 34 6.683 -72.303 -64.372 1.00-13.31 H ATOM 496 CG ASN A 34 7.374 -70.840 -63.008 1.00-13.31 C ATOM 497 OD1 ASN A 34 8.390 -70.400 -63.543 1.00-13.31 O ATOM 498 ND2 ASN A 34 7.197 -70.784 -61.720 1.00-13.31 N ATOM 499 1HD2 ASN A 34 7.934 -70.423 -61.141 1.00-13.31 H ATOM 500 2HD2 ASN A 34 6.321 -71.075 -61.317 1.00-13.31 H ATOM 501 N ARG A 35 3.785 -71.540 -66.042 1.00-18.15 N ATOM 502 H ARG A 35 3.214 -71.404 -65.214 1.00-18.15 H ATOM 503 CA ARG A 35 3.178 -72.073 -67.269 1.00-18.15 C ATOM 504 HA ARG A 35 3.834 -72.845 -67.674 1.00-18.15 H ATOM 505 C ARG A 35 3.051 -71.022 -68.366 1.00-18.15 C ATOM 506 O ARG A 35 3.279 -71.335 -69.516 1.00-18.15 O ATOM 507 CB ARG A 35 1.811 -72.701 -66.992 1.00-18.15 C ATOM 508 1HB ARG A 35 1.221 -72.024 -66.375 1.00-18.15 H ATOM 509 2HB ARG A 35 1.301 -72.837 -67.946 1.00-18.15 H ATOM 510 CG ARG A 35 1.919 -74.066 -66.320 1.00-18.15 C ATOM 511 1HG ARG A 35 2.526 -74.713 -66.954 1.00-18.15 H ATOM 512 2HG ARG A 35 2.415 -73.963 -65.357 1.00-18.15 H ATOM 513 CD ARG A 35 0.557 -74.732 -66.119 1.00-18.15 C ATOM 514 1HD ARG A 35 0.032 -74.744 -67.076 1.00-18.15 H ATOM 515 2HD ARG A 35 0.713 -75.765 -65.806 1.00-18.15 H ATOM 516 NE ARG A 35 -0.281 -74.047 -65.120 1.00-18.15 N ATOM 517 HE ARG A 35 -0.949 -73.388 -65.483 1.00-18.15 H ATOM 518 CZ ARG A 35 -0.245 -74.229 -63.805 1.00-18.15 C ATOM 519 NH1 ARG A 35 -1.064 -73.552 -63.051 1.00-18.15 N ATOM 520 1HH1 ARG A 35 -1.752 -72.950 -63.463 1.00-18.15 H ATOM 521 2HH1 ARG A 35 -0.991 -73.633 -62.047 1.00-18.15 H ATOM 522 NH2 ARG A 35 0.561 -75.063 -63.203 1.00-18.15 N ATOM 523 1HH2 ARG A 35 1.200 -75.616 -63.748 1.00-18.15 H ATOM 524 2HH2 ARG A 35 0.550 -75.136 -62.198 1.00-18.15 H ATOM 525 N LYS A 36 2.738 -69.779 -68.023 1.00-19.47 N ATOM 526 H LYS A 36 2.533 -69.573 -67.050 1.00-19.47 H ATOM 527 CA LYS A 36 2.658 -68.689 -69.013 1.00-19.47 C ATOM 528 HA LYS A 36 2.026 -69.008 -69.843 1.00-19.47 H ATOM 529 C LYS A 36 4.035 -68.337 -69.589 1.00-19.47 C ATOM 530 O LYS A 36 4.171 -67.847 -70.706 1.00-19.47 O ATOM 531 CB LYS A 36 2.029 -67.464 -68.338 1.00-19.47 C ATOM 532 1HB LYS A 36 1.118 -67.788 -67.834 1.00-19.47 H ATOM 533 2HB LYS A 36 2.719 -67.084 -67.586 1.00-19.47 H ATOM 534 CG LYS A 36 1.667 -66.329 -69.289 1.00-19.47 C ATOM 535 1HG LYS A 36 2.565 -65.975 -69.793 1.00-19.47 H ATOM 536 2HG LYS A 36 0.966 -66.701 -70.037 1.00-19.47 H ATOM 537 CD LYS A 36 1.028 -65.164 -68.548 1.00-19.47 C ATOM 538 1HD LYS A 36 0.138 -65.518 -68.026 1.00-19.47 H ATOM 539 2HD LYS A 36 1.741 -64.769 -67.823 1.00-19.47 H ATOM 540 CE LYS A 36 0.640 -64.064 -69.533 1.00-19.47 C ATOM 541 1HE LYS A 36 1.534 -63.751 -70.077 1.00-19.47 H ATOM 542 2HE LYS A 36 -0.075 -64.471 -70.254 1.00-19.47 H ATOM 543 NZ LYS A 36 0.034 -62.869 -68.846 1.00-19.47 N ATOM 544 1HZ LYS A 36 -0.207 -62.165 -69.530 1.00-19.47 H ATOM 545 2HZ LYS A 36 0.695 -62.477 -68.188 1.00-19.47 H ATOM 546 3HZ LYS A 36 -0.803 -63.145 -68.350 1.00-19.47 H ATOM 547 N LYS A 37 5.050 -68.572 -68.776 1.00-16.02 N ATOM 548 H LYS A 37 4.835 -68.891 -67.840 1.00-16.02 H ATOM 549 CA LYS A 37 6.461 -68.388 -69.124 1.00-16.02 C ATOM 550 HA LYS A 37 6.613 -67.433 -69.627 1.00-16.02 H ATOM 551 C LYS A 37 6.984 -69.498 -70.035 1.00-16.02 C ATOM 552 O LYS A 37 7.938 -69.285 -70.778 1.00-16.02 O ATOM 553 CB LYS A 37 7.209 -68.406 -67.789 1.00-16.02 C ATOM 554 1HB LYS A 37 6.817 -67.597 -67.173 1.00-16.02 H ATOM 555 2HB LYS A 37 6.947 -69.339 -67.309 1.00-16.02 H ATOM 556 CG LYS A 37 8.724 -68.327 -67.769 1.00-16.02 C ATOM 557 1HG LYS A 37 9.144 -69.109 -68.400 1.00-16.02 H ATOM 558 2HG LYS A 37 9.066 -67.347 -68.101 1.00-16.02 H ATOM 559 CD LYS A 37 9.126 -68.585 -66.322 1.00-16.02 C ATOM 560 1HD LYS A 37 8.717 -67.793 -65.692 1.00-16.02 H ATOM 561 2HD LYS A 37 8.685 -69.533 -66.015 1.00-16.02 H ATOM 562 CE LYS A 37 10.622 -68.685 -66.101 1.00-16.02 C ATOM 563 1HE LYS A 37 11.027 -69.469 -66.744 1.00-16.02 H ATOM 564 2HE LYS A 37 11.100 -67.733 -66.341 1.00-16.02 H ATOM 565 NZ LYS A 37 10.847 -69.040 -64.654 1.00-16.02 N ATOM 566 1HZ LYS A 37 11.815 -69.287 -64.500 1.00-16.02 H ATOM 567 2HZ LYS A 37 10.252 -69.823 -64.395 1.00-16.02 H ATOM 568 3HZ LYS A 37 10.603 -68.255 -64.066 1.00-16.02 H ATOM 569 N LYS A 38 6.407 -70.689 -69.956 1.00 -6.38 N ATOM 570 H LYS A 38 5.609 -70.830 -69.355 1.00 -6.38 H ATOM 571 CA LYS A 38 6.882 -71.810 -70.766 1.00 -6.38 C ATOM 572 HA LYS A 38 7.970 -71.788 -70.791 1.00 -6.38 H ATOM 573 C LYS A 38 6.370 -71.660 -72.187 1.00 -6.38 C ATOM 574 O LYS A 38 5.172 -71.558 -72.417 1.00 -6.38 O ATOM 575 CB LYS A 38 6.422 -73.151 -70.173 1.00 -6.38 C ATOM 576 1HB LYS A 38 6.739 -73.179 -69.131 1.00 -6.38 H ATOM 577 2HB LYS A 38 5.333 -73.201 -70.197 1.00 -6.38 H ATOM 578 CG LYS A 38 6.998 -74.390 -70.881 1.00 -6.38 C ATOM 579 1HG LYS A 38 7.966 -74.128 -71.310 1.00 -6.38 H ATOM 580 2HG LYS A 38 7.153 -75.172 -70.138 1.00 -6.38 H ATOM 581 CD LYS A 38 6.078 -74.951 -71.981 1.00 -6.38 C ATOM 582 1HD LYS A 38 5.143 -75.269 -71.519 1.00 -6.38 H ATOM 583 2HD LYS A 38 5.850 -74.174 -72.709 1.00 -6.38 H ATOM 584 CE LYS A 38 6.699 -76.137 -72.721 1.00 -6.38 C ATOM 585 1HE LYS A 38 7.039 -76.869 -71.988 1.00 -6.38 H ATOM 586 2HE LYS A 38 5.926 -76.597 -73.339 1.00 -6.38 H ATOM 587 NZ LYS A 38 7.847 -75.745 -73.611 1.00 -6.38 N ATOM 588 1HZ LYS A 38 8.296 -76.555 -74.007 1.00 -6.38 H ATOM 589 2HZ LYS A 38 8.526 -75.189 -73.104 1.00 -6.38 H ATOM 590 3HZ LYS A 38 7.520 -75.152 -74.378 1.00 -6.38 H ATOM 591 N HIS A 39 7.296 -71.762 -73.126 1.00-14.27 N ATOM 592 H HIS A 39 8.270 -71.870 -72.874 1.00-14.27 H ATOM 593 CA HIS A 39 7.019 -71.848 -74.552 1.00-14.27 C ATOM 594 HA HIS A 39 5.987 -72.147 -74.735 1.00-14.27 H ATOM 595 C HIS A 39 7.965 -72.975 -74.903 1.00-14.27 C ATOM 596 O HIS A 39 7.636 -73.837 -75.737 1.00-14.27 O ATOM 597 OXT HIS A 39 8.915 -73.130 -74.096 1.00-14.27 O ATOM 598 CB HIS A 39 7.324 -70.514 -75.237 1.00-14.27 C ATOM 599 1HB HIS A 39 8.352 -70.234 -75.009 1.00-14.27 H ATOM 600 2HB HIS A 39 7.224 -70.633 -76.315 1.00-14.27 H ATOM 601 CG HIS A 39 6.414 -69.416 -74.783 1.00-14.27 C ATOM 602 ND1 HIS A 39 5.278 -69.052 -75.476 1.00-14.27 N ATOM 603 CD2 HIS A 39 6.451 -68.662 -73.649 1.00-14.27 C ATOM 604 HD2 HIS A 39 7.244 -68.710 -72.917 1.00-14.27 H ATOM 605 CE1 HIS A 39 4.621 -68.173 -74.662 1.00-14.27 C ATOM 606 HE1 HIS A 39 3.655 -67.748 -74.895 1.00-14.27 H ATOM 607 NE2 HIS A 39 5.313 -67.912 -73.526 1.00-14.27 N ATOM 608 HE2 HIS A 39 5.027 -67.342 -72.740 1.00-14.27 H TER 609 HIS A 39 END
SEQUENCE	GTWDDIGQGIGRVAYWVGKAMGNMSDVNQASRINRKKKH
HELICITY	56.40	INSTAB. INDEX	4.44	FLEXIBILITY	14.60
a HYD. MOM.	57.10	b HYD. MOM.	29.31	c HYD. MOM	4.38
a MEAN HYD. MOM.	1.46	b MEAN HYD. MOM.	0.75	c MEAN HYD. MOM.	0.11
CHARGE pH5	5.11	CHARGE pH7	4.09	CHARGE pH9	3.62
Δ CHARGE pH5-pH9	1.50	ISOELECTRIC POINT	10.16	BOMAN INDEX	2.33
ΔG	33	CPP	0,12	MLP	-15,22
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
DATE	1992
TITLE PAPER	A novel lactococcal bacteriocin whose activity depends on the complementary action of two peptides