Back to Resultset

ID	2441	NAME	Bacteriocin carnobacteriocin BM1   Blast NCBI-PROT
LENGTH	43	DISULFIDE BRIDGE	1		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\AISYGNGVYCNKEKCWVNKAENKQAITGIVIGGWASSLAGMGH.pdb REMARK YASARA Written on: Wed May 14 20:33:12 2014 REMARK YASARA Number of models: 1 REMARK YASARA Number of atoms: 627 REMARK YASARA Please address questions or suggestions to: Eliza@yasara.org REMARK YASARA COMPND MOL_ID: 1; COMPND 2 MOLECULE: BACTERIOCIN CARNOBACTERIOCIN B2; COMPND 3 CHAIN: A; SEQRES 1 A 43 ALA ILE SER TYR GLY ASN GLY VAL TYR CYS ASN LYS GLU SEQRES 2 A 43 LYS CYS TRP VAL ASN LYS ALA GLU ASN LYS GLN ALA ILE SEQRES 3 A 43 THR GLY ILE VAL ILE GLY GLY TRP ALA SER SER LEU ALA SEQRES 4 A 43 GLY MET GLY 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 SSBOND 1 CYS A 10 CYS A 15 2.03 ATOM 1 N ALA A 1 -9.426 -35.135 -2.747 1.00-19.25 N ATOM 2 1H ALA A 1 -9.463 -36.042 -2.304 1.00-19.25 H ATOM 3 2H ALA A 1 -10.160 -35.061 -3.436 1.00-19.25 H ATOM 4 3H ALA A 1 -9.547 -34.421 -2.043 1.00-19.25 H ATOM 5 CA ALA A 1 -8.097 -34.955 -3.403 1.00-19.25 C ATOM 6 HA ALA A 1 -7.949 -35.752 -4.132 1.00-19.25 H ATOM 7 C ALA A 1 -7.016 -35.057 -2.346 1.00-19.25 C ATOM 8 O ALA A 1 -7.341 -34.907 -1.179 1.00-19.25 O ATOM 9 CB ALA A 1 -8.020 -33.587 -4.128 1.00-19.25 C ATOM 10 1HB ALA A 1 -8.802 -33.518 -4.887 1.00-19.25 H ATOM 11 2HB ALA A 1 -7.048 -33.481 -4.616 1.00-19.25 H ATOM 12 3HB ALA A 1 -8.142 -32.774 -3.409 1.00-19.25 H ATOM 13 N ILE A 2 -5.774 -35.313 -2.733 1.00-15.02 N ATOM 14 H ILE A 2 -5.541 -35.402 -3.714 1.00-15.02 H ATOM 15 CA ILE A 2 -4.652 -35.423 -1.802 1.00-15.02 C ATOM 16 HA ILE A 2 -4.935 -35.103 -0.799 1.00-15.02 H ATOM 17 C ILE A 2 -3.667 -34.439 -2.419 1.00-15.02 C ATOM 18 O ILE A 2 -3.540 -34.423 -3.644 1.00-15.02 O ATOM 19 CB ILE A 2 -4.070 -36.874 -1.755 1.00-15.02 C ATOM 20 HB ILE A 2 -3.777 -37.155 -2.765 1.00-15.02 H ATOM 21 CG1 ILE A 2 -5.148 -37.869 -1.273 1.00-15.02 C ATOM 22 1HG1 ILE A 2 -5.372 -37.658 -0.227 1.00-15.02 H ATOM 23 2HG1 ILE A 2 -6.058 -37.711 -1.848 1.00-15.02 H ATOM 24 CG2 ILE A 2 -2.822 -36.942 -0.841 1.00-15.02 C ATOM 25 1HG2 ILE A 2 -2.401 -37.947 -0.844 1.00-15.02 H ATOM 26 2HG2 ILE A 2 -3.079 -36.669 0.184 1.00-15.02 H ATOM 27 3HG2 ILE A 2 -2.048 -36.267 -1.208 1.00-15.02 H ATOM 28 CD1 ILE A 2 -4.782 -39.357 -1.406 1.00-15.02 C ATOM 29 1HD1 ILE A 2 -5.648 -39.965 -1.145 1.00-15.02 H ATOM 30 2HD1 ILE A 2 -3.965 -39.608 -0.729 1.00-15.02 H ATOM 31 3HD1 ILE A 2 -4.486 -39.579 -2.432 1.00-15.02 H ATOM 32 N SER A 3 -3.047 -33.589 -1.613 1.00 16.00 N ATOM 33 H SER A 3 -3.209 -33.632 -0.620 1.00 16.00 H ATOM 34 CA SER A 3 -2.059 -32.633 -2.110 1.00 16.00 C ATOM 35 HA SER A 3 -2.325 -32.306 -3.115 1.00 16.00 H ATOM 36 C SER A 3 -0.710 -33.342 -2.133 1.00 16.00 C ATOM 37 O SER A 3 -0.490 -34.257 -1.342 1.00 16.00 O ATOM 38 CB SER A 3 -1.980 -31.413 -1.190 1.00 16.00 C ATOM 39 1HB SER A 3 -2.969 -30.961 -1.113 1.00 16.00 H ATOM 40 2HB SER A 3 -1.650 -31.729 -0.200 1.00 16.00 H ATOM 41 OG SER A 3 -1.076 -30.454 -1.710 1.00 16.00 O ATOM 42 HG SER A 3 -1.037 -29.704 -1.109 1.00 16.00 H ATOM 43 N TYR A 4 0.193 -32.931 -3.011 1.00-24.51 N ATOM 44 H TYR A 4 -0.007 -32.143 -3.611 1.00-24.51 H ATOM 45 CA TYR A 4 1.514 -33.542 -3.114 1.00-24.51 C ATOM 46 HA TYR A 4 1.752 -34.080 -2.196 1.00-24.51 H ATOM 47 C TYR A 4 2.532 -32.435 -3.325 1.00-24.51 C ATOM 48 O TYR A 4 2.232 -31.441 -3.979 1.00-24.51 O ATOM 49 CB TYR A 4 1.575 -34.510 -4.301 1.00-24.51 C ATOM 50 1HB TYR A 4 1.316 -33.969 -5.211 1.00-24.51 H ATOM 51 2HB TYR A 4 2.599 -34.871 -4.398 1.00-24.51 H ATOM 52 CG TYR A 4 0.663 -35.711 -4.157 1.00-24.51 C ATOM 53 CD1 TYR A 4 -0.664 -35.683 -4.635 1.00-24.51 C ATOM 54 HD1 TYR A 4 -1.056 -34.779 -5.084 1.00-24.51 H ATOM 55 CD2 TYR A 4 1.123 -36.883 -3.524 1.00-24.51 C ATOM 56 HD2 TYR A 4 2.128 -36.920 -3.126 1.00-24.51 H ATOM 57 CE1 TYR A 4 -1.506 -36.820 -4.505 1.00-24.51 C ATOM 58 HE1 TYR A 4 -2.525 -36.787 -4.861 1.00-24.51 H ATOM 59 CE2 TYR A 4 0.282 -38.016 -3.389 1.00-24.51 C ATOM 60 HE2 TYR A 4 0.646 -38.905 -2.896 1.00-24.51 H ATOM 61 CZ TYR A 4 -1.021 -37.975 -3.888 1.00-24.51 C ATOM 62 OH TYR A 4 -1.822 -39.082 -3.786 1.00-24.51 O ATOM 63 HH TYR A 4 -1.394 -39.794 -3.304 1.00-24.51 H ATOM 64 N GLY A 5 3.735 -32.632 -2.806 1.00 1.37 N ATOM 65 H GLY A 5 3.909 -33.452 -2.250 1.00 1.37 H ATOM 66 CA GLY A 5 4.844 -31.739 -3.099 1.00 1.37 C ATOM 67 1HA GLY A 5 4.478 -30.732 -3.299 1.00 1.37 H ATOM 68 2HA GLY A 5 5.532 -31.715 -2.254 1.00 1.37 H ATOM 69 C GLY A 5 5.564 -32.272 -4.322 1.00 1.37 C ATOM 70 O GLY A 5 5.107 -33.243 -4.931 1.00 1.37 O ATOM 71 N ASN A 6 6.709 -31.702 -4.673 1.00 6.39 N ATOM 72 H ASN A 6 7.081 -30.934 -4.139 1.00 6.39 H ATOM 73 CA ASN A 6 7.477 -32.225 -5.803 1.00 6.39 C ATOM 74 HA ASN A 6 6.779 -32.500 -6.595 1.00 6.39 H ATOM 75 C ASN A 6 8.246 -33.488 -5.417 1.00 6.39 C ATOM 76 O ASN A 6 9.380 -33.430 -4.950 1.00 6.39 O ATOM 77 CB ASN A 6 8.456 -31.196 -6.376 1.00 6.39 C ATOM 78 1HB ASN A 6 7.909 -30.297 -6.660 1.00 6.39 H ATOM 79 2HB ASN A 6 9.193 -30.937 -5.617 1.00 6.39 H ATOM 80 CG ASN A 6 9.187 -31.731 -7.586 1.00 6.39 C ATOM 81 OD1 ASN A 6 8.818 -32.756 -8.141 1.00 6.39 O ATOM 82 ND2 ASN A 6 10.227 -31.061 -7.998 1.00 6.39 N ATOM 83 1HD2 ASN A 6 10.724 -31.406 -8.802 1.00 6.39 H ATOM 84 2HD2 ASN A 6 10.517 -30.228 -7.520 1.00 6.39 H ATOM 85 N GLY A 7 7.600 -34.621 -5.643 1.00 25.14 N ATOM 86 H GLY A 7 6.631 -34.572 -5.933 1.00 25.14 H ATOM 87 CA GLY A 7 8.217 -35.926 -5.480 1.00 25.14 C ATOM 88 1HA GLY A 7 9.113 -35.839 -4.876 1.00 25.14 H ATOM 89 2HA GLY A 7 7.520 -36.585 -4.965 1.00 25.14 H ATOM 90 C GLY A 7 8.573 -36.563 -6.809 1.00 25.14 C ATOM 91 O GLY A 7 8.666 -37.783 -6.889 1.00 25.14 O ATOM 92 N VAL A 8 8.646 -35.772 -7.873 1.00 -0.65 N ATOM 93 H VAL A 8 8.640 -34.762 -7.761 1.00 -0.65 H ATOM 94 CA VAL A 8 8.688 -36.297 -9.243 1.00 -0.65 C ATOM 95 HA VAL A 8 8.230 -37.282 -9.225 1.00 -0.65 H ATOM 96 C VAL A 8 10.134 -36.467 -9.730 1.00 -0.65 C ATOM 97 O VAL A 8 10.625 -35.762 -10.612 1.00 -0.65 O ATOM 98 CB VAL A 8 7.839 -35.409 -10.214 1.00 -0.65 C ATOM 99 HB VAL A 8 8.381 -34.490 -10.429 1.00 -0.65 H ATOM 100 CG1 VAL A 8 7.546 -36.146 -11.528 1.00 -0.65 C ATOM 101 1HG1 VAL A 8 6.957 -35.508 -12.186 1.00 -0.65 H ATOM 102 2HG1 VAL A 8 7.003 -37.071 -11.330 1.00 -0.65 H ATOM 103 3HG1 VAL A 8 8.484 -36.378 -12.030 1.00 -0.65 H ATOM 104 CG2 VAL A 8 6.489 -35.019 -9.568 1.00 -0.65 C ATOM 105 1HG2 VAL A 8 5.880 -34.481 -10.296 1.00 -0.65 H ATOM 106 2HG2 VAL A 8 6.657 -34.354 -8.723 1.00 -0.65 H ATOM 107 3HG2 VAL A 8 5.956 -35.909 -9.242 1.00 -0.65 H ATOM 108 N TYR A 9 10.862 -37.373 -9.095 1.00 5.91 N ATOM 109 H TYR A 9 10.425 -37.931 -8.372 1.00 5.91 H ATOM 110 CA TYR A 9 12.297 -37.532 -9.355 1.00 5.91 C ATOM 111 HA TYR A 9 12.701 -36.546 -9.584 1.00 5.91 H ATOM 112 C TYR A 9 12.601 -38.437 -10.555 1.00 5.91 C ATOM 113 O TYR A 9 13.200 -39.506 -10.418 1.00 5.91 O ATOM 114 CB TYR A 9 12.998 -38.027 -8.087 1.00 5.91 C ATOM 115 1HB TYR A 9 12.786 -39.081 -7.948 1.00 5.91 H ATOM 116 2HB TYR A 9 14.075 -37.905 -8.206 1.00 5.91 H ATOM 117 CG TYR A 9 12.547 -37.303 -6.836 1.00 5.91 C ATOM 118 CD1 TYR A 9 12.061 -38.031 -5.729 1.00 5.91 C ATOM 119 HD1 TYR A 9 12.024 -39.111 -5.768 1.00 5.91 H ATOM 120 CD2 TYR A 9 12.582 -35.893 -6.752 1.00 5.91 C ATOM 121 HD2 TYR A 9 12.959 -35.310 -7.581 1.00 5.91 H ATOM 122 CE1 TYR A 9 11.615 -37.362 -4.559 1.00 5.91 C ATOM 123 HE1 TYR A 9 11.251 -37.925 -3.713 1.00 5.91 H ATOM 124 CE2 TYR A 9 12.112 -35.224 -5.593 1.00 5.91 C ATOM 125 HE2 TYR A 9 12.114 -34.145 -5.549 1.00 5.91 H ATOM 126 CZ TYR A 9 11.636 -35.967 -4.510 1.00 5.91 C ATOM 127 OH TYR A 9 11.150 -35.318 -3.405 1.00 5.91 O ATOM 128 HH TYR A 9 11.044 -34.375 -3.561 1.00 5.91 H ATOM 129 N CYS A 10 12.127 -38.031 -11.725 1.00 -5.06 N ATOM 130 H CYS A 10 11.691 -37.116 -11.780 1.00 -5.06 H ATOM 131 CA CYS A 10 12.156 -38.872 -12.922 1.00 -5.06 C ATOM 132 HA CYS A 10 11.475 -39.694 -12.745 1.00 -5.06 H ATOM 133 C CYS A 10 13.467 -39.543 -13.310 1.00 -5.06 C ATOM 134 O CYS A 10 14.420 -38.942 -13.796 1.00 -5.06 O ATOM 135 CB CYS A 10 11.629 -38.122 -14.144 1.00 -5.06 C ATOM 136 1HB CYS A 10 12.156 -37.171 -14.229 1.00 -5.06 H ATOM 137 2HB CYS A 10 11.866 -38.716 -15.028 1.00 -5.06 H ATOM 138 SG CYS A 10 9.832 -37.824 -14.148 1.00 -5.06 S ATOM 139 N ASN A 11 13.414 -40.858 -13.188 1.00 15.20 N ATOM 140 H ASN A 11 12.646 -41.252 -12.650 1.00 15.20 H ATOM 141 CA ASN A 11 14.262 -41.780 -13.929 1.00 15.20 C ATOM 142 HA ASN A 11 15.174 -41.296 -14.284 1.00 15.20 H ATOM 143 C ASN A 11 13.339 -42.124 -15.102 1.00 15.20 C ATOM 144 O ASN A 11 12.201 -41.665 -15.124 1.00 15.20 O ATOM 145 CB ASN A 11 14.574 -43.037 -13.104 1.00 15.20 C ATOM 146 1HB ASN A 11 13.657 -43.387 -12.642 1.00 15.20 H ATOM 147 2HB ASN A 11 14.950 -43.815 -13.765 1.00 15.20 H ATOM 148 CG ASN A 11 15.617 -42.820 -12.023 1.00 15.20 C ATOM 149 OD1 ASN A 11 16.399 -43.713 -11.764 1.00 15.20 O ATOM 150 ND2 ASN A 11 15.630 -41.686 -11.377 1.00 15.20 N ATOM 151 1HD2 ASN A 11 16.336 -41.539 -10.678 1.00 15.20 H ATOM 152 2HD2 ASN A 11 14.949 -40.968 -11.589 1.00 15.20 H ATOM 153 N LYS A 12 13.781 -42.944 -16.050 1.00 -4.10 N ATOM 154 H LYS A 12 14.706 -43.337 -15.970 1.00 -4.10 H ATOM 155 CA LYS A 12 12.976 -43.257 -17.245 1.00 -4.10 C ATOM 156 HA LYS A 12 12.858 -42.338 -17.821 1.00 -4.10 H ATOM 157 C LYS A 12 11.561 -43.766 -16.950 1.00 -4.10 C ATOM 158 O LYS A 12 10.600 -43.369 -17.611 1.00 -4.10 O ATOM 159 CB LYS A 12 13.729 -44.282 -18.103 1.00 -4.10 C ATOM 160 1HB LYS A 12 14.747 -43.926 -18.261 1.00 -4.10 H ATOM 161 2HB LYS A 12 13.775 -45.223 -17.554 1.00 -4.10 H ATOM 162 CG LYS A 12 13.093 -44.551 -19.464 1.00 -4.10 C ATOM 163 1HG LYS A 12 12.063 -44.853 -19.310 1.00 -4.10 H ATOM 164 2HG LYS A 12 13.107 -43.640 -20.063 1.00 -4.10 H ATOM 165 CD LYS A 12 13.829 -45.662 -20.208 1.00 -4.10 C ATOM 166 1HD LYS A 12 14.842 -45.329 -20.434 1.00 -4.10 H ATOM 167 2HD LYS A 12 13.887 -46.541 -19.564 1.00 -4.10 H ATOM 168 CE LYS A 12 13.120 -46.058 -21.506 1.00 -4.10 C ATOM 169 1HE LYS A 12 13.038 -45.183 -22.154 1.00 -4.10 H ATOM 170 2HE LYS A 12 13.722 -46.815 -22.013 1.00 -4.10 H ATOM 171 NZ LYS A 12 11.751 -46.624 -21.237 1.00 -4.10 N ATOM 172 1HZ LYS A 12 11.342 -46.998 -22.079 1.00 -4.10 H ATOM 173 2HZ LYS A 12 11.148 -45.913 -20.843 1.00 -4.10 H ATOM 174 3HZ LYS A 12 11.818 -47.362 -20.533 1.00 -4.10 H ATOM 175 N GLU A 13 11.426 -44.630 -15.953 1.00 23.13 N ATOM 176 H GLU A 13 12.242 -44.948 -15.465 1.00 23.13 H ATOM 177 CA GLU A 13 10.104 -45.132 -15.568 1.00 23.13 C ATOM 178 HA GLU A 13 9.368 -44.715 -16.243 1.00 23.13 H ATOM 179 C GLU A 13 9.698 -44.690 -14.163 1.00 23.13 C ATOM 180 O GLU A 13 8.559 -44.281 -13.936 1.00 23.13 O ATOM 181 CB GLU A 13 10.008 -46.658 -15.686 1.00 23.13 C ATOM 182 1HB GLU A 13 10.081 -47.051 -14.681 1.00 23.13 H ATOM 183 2HB GLU A 13 9.015 -46.912 -16.054 1.00 23.13 H ATOM 184 CG GLU A 13 11.049 -47.404 -16.534 1.00 23.13 C ATOM 185 1HG GLU A 13 12.052 -47.123 -16.212 1.00 23.13 H ATOM 186 2HG GLU A 13 10.929 -48.469 -16.336 1.00 23.13 H ATOM 187 CD GLU A 13 10.931 -47.205 -18.037 1.00 23.13 C ATOM 188 OE1 GLU A 13 10.113 -46.396 -18.532 1.00 23.13 O ATOM 189 OE2 GLU A 13 11.696 -47.872 -18.761 1.00 23.13 O ATOM 190 N LYS A 14 10.637 -44.723 -13.225 1.00 15.16 N ATOM 191 H LYS A 14 11.544 -45.098 -13.446 1.00 15.16 H ATOM 192 CA LYS A 14 10.401 -44.217 -11.870 1.00 15.16 C ATOM 193 HA LYS A 14 9.421 -44.552 -11.525 1.00 15.16 H ATOM 194 C LYS A 14 10.425 -42.697 -11.829 1.00 15.16 C ATOM 195 O LYS A 14 11.458 -42.103 -11.564 1.00 15.16 O ATOM 196 CB LYS A 14 11.470 -44.723 -10.896 1.00 15.16 C ATOM 197 1HB LYS A 14 12.450 -44.544 -11.329 1.00 15.16 H ATOM 198 2HB LYS A 14 11.387 -44.151 -9.971 1.00 15.16 H ATOM 199 CG LYS A 14 11.356 -46.191 -10.549 1.00 15.16 C ATOM 200 1HG LYS A 14 10.461 -46.342 -9.950 1.00 15.16 H ATOM 201 2HG LYS A 14 11.243 -46.751 -11.467 1.00 15.16 H ATOM 202 CD LYS A 14 12.574 -46.751 -9.809 1.00 15.16 C ATOM 203 1HD LYS A 14 12.386 -47.804 -9.592 1.00 15.16 H ATOM 204 2HD LYS A 14 13.437 -46.690 -10.472 1.00 15.16 H ATOM 205 CE LYS A 14 12.923 -46.028 -8.507 1.00 15.16 C ATOM 206 1HE LYS A 14 13.817 -46.489 -8.084 1.00 15.16 H ATOM 207 2HE LYS A 14 13.160 -44.989 -8.737 1.00 15.16 H ATOM 208 NZ LYS A 14 11.838 -46.045 -7.480 1.00 15.16 N ATOM 209 1HZ LYS A 14 12.117 -45.533 -6.653 1.00 15.16 H ATOM 210 2HZ LYS A 14 11.585 -46.993 -7.234 1.00 15.16 H ATOM 211 3HZ LYS A 14 10.993 -45.609 -7.853 1.00 15.16 H ATOM 212 N CYS A 15 9.273 -42.073 -12.005 1.00 44.18 N ATOM 213 H CYS A 15 8.501 -42.594 -12.401 1.00 44.18 H ATOM 214 CA CYS A 15 9.080 -40.673 -11.612 1.00 44.18 C ATOM 215 HA CYS A 15 10.045 -40.183 -11.543 1.00 44.18 H ATOM 216 C CYS A 15 8.453 -40.595 -10.220 1.00 44.18 C ATOM 217 O CYS A 15 7.872 -39.581 -9.855 1.00 44.18 O ATOM 218 CB CYS A 15 8.229 -39.910 -12.632 1.00 44.18 C ATOM 219 1HB CYS A 15 7.285 -40.430 -12.764 1.00 44.18 H ATOM 220 2HB CYS A 15 8.009 -38.924 -12.226 1.00 44.18 H ATOM 221 SG CYS A 15 8.990 -39.672 -14.269 1.00 44.18 S ATOM 222 N TRP A 16 8.591 -41.672 -9.455 1.00 42.01 N ATOM 223 H TRP A 16 9.033 -42.496 -9.830 1.00 42.01 H ATOM 224 CA TRP A 16 8.239 -41.717 -8.037 1.00 42.01 C ATOM 225 HA TRP A 16 8.222 -42.762 -7.739 1.00 42.01 H ATOM 226 C TRP A 16 6.861 -41.151 -7.657 1.00 42.01 C ATOM 227 O TRP A 16 5.820 -41.636 -8.146 1.00 42.01 O ATOM 228 CB TRP A 16 9.374 -41.064 -7.235 1.00 42.01 C ATOM 229 1HB TRP A 16 9.420 -40.014 -7.506 1.00 42.01 H ATOM 230 2HB TRP A 16 9.162 -41.144 -6.168 1.00 42.01 H ATOM 231 CG TRP A 16 10.741 -41.636 -7.480 1.00 42.01 C ATOM 232 CD1 TRP A 16 11.576 -41.347 -8.508 1.00 42.01 C ATOM 233 HD1 TRP A 16 11.322 -40.700 -9.339 1.00 42.01 H ATOM 234 CD2 TRP A 16 11.482 -42.534 -6.634 1.00 42.01 C ATOM 235 NE1 TRP A 16 12.796 -41.935 -8.353 1.00 42.01 N ATOM 236 HE1 TRP A 16 13.559 -41.815 -9.007 1.00 42.01 H ATOM 237 CE2 TRP A 16 12.795 -42.636 -7.181 1.00 42.01 C ATOM 238 CE3 TRP A 16 11.192 -43.220 -5.437 1.00 42.01 C ATOM 239 HE3 TRP A 16 10.202 -43.166 -5.005 1.00 42.01 H ATOM 240 CZ2 TRP A 16 13.827 -43.355 -6.540 1.00 42.01 C ATOM 241 HZ2 TRP A 16 14.822 -43.387 -6.960 1.00 42.01 H ATOM 242 CZ3 TRP A 16 12.222 -43.962 -4.797 1.00 42.01 C ATOM 243 HZ3 TRP A 16 12.012 -44.480 -3.871 1.00 42.01 H ATOM 244 CH2 TRP A 16 13.534 -44.007 -5.354 1.00 42.01 C ATOM 245 HH2 TRP A 16 14.314 -44.549 -4.836 1.00 42.01 H ATOM 246 N VAL A 17 6.842 -40.201 -6.726 1.00 46.16 N ATOM 247 H VAL A 17 7.684 -39.652 -6.584 1.00 46.16 H ATOM 248 CA VAL A 17 5.714 -39.966 -5.817 1.00 46.16 C ATOM 249 HA VAL A 17 6.096 -39.413 -4.960 1.00 46.16 H ATOM 250 C VAL A 17 5.250 -41.347 -5.307 1.00 46.16 C ATOM 251 O VAL A 17 6.054 -42.260 -5.164 1.00 46.16 O ATOM 252 CB VAL A 17 4.583 -39.094 -6.475 1.00 46.16 C ATOM 253 HB VAL A 17 3.860 -39.747 -6.956 1.00 46.16 H ATOM 254 CG1 VAL A 17 3.860 -38.240 -5.413 1.00 46.16 C ATOM 255 1HG1 VAL A 17 3.073 -37.650 -5.880 1.00 46.16 H ATOM 256 2HG1 VAL A 17 4.570 -37.561 -4.933 1.00 46.16 H ATOM 257 3HG1 VAL A 17 3.411 -38.875 -4.649 1.00 46.16 H ATOM 258 CG2 VAL A 17 5.138 -38.149 -7.554 1.00 46.16 C ATOM 259 1HG2 VAL A 17 4.347 -37.505 -7.935 1.00 46.16 H ATOM 260 2HG2 VAL A 17 5.538 -38.723 -8.392 1.00 46.16 H ATOM 261 3HG2 VAL A 17 5.933 -37.529 -7.141 1.00 46.16 H ATOM 262 N ASN A 18 3.958 -41.548 -5.092 1.00 6.48 N ATOM 263 H ASN A 18 3.310 -40.774 -5.146 1.00 6.48 H ATOM 264 CA ASN A 18 3.395 -42.875 -4.834 1.00 6.48 C ATOM 265 HA ASN A 18 4.178 -43.559 -4.504 1.00 6.48 H ATOM 266 C ASN A 18 2.787 -43.410 -6.134 1.00 6.48 C ATOM 267 O ASN A 18 1.872 -44.228 -6.115 1.00 6.48 O ATOM 268 CB ASN A 18 2.316 -42.788 -3.742 1.00 6.48 C ATOM 269 1HB ASN A 18 2.016 -43.800 -3.472 1.00 6.48 H ATOM 270 2HB ASN A 18 2.734 -42.305 -2.860 1.00 6.48 H ATOM 271 CG ASN A 18 1.085 -42.024 -4.183 1.00 6.48 C ATOM 272 OD1 ASN A 18 1.161 -40.864 -4.571 1.00 6.48 O ATOM 273 ND2 ASN A 18 -0.053 -42.655 -4.121 1.00 6.48 N ATOM 274 1HD2 ASN A 18 -0.892 -42.177 -4.391 1.00 6.48 H ATOM 275 2HD2 ASN A 18 -0.077 -43.619 -3.828 1.00 6.48 H ATOM 276 N LYS A 19 3.207 -42.847 -7.262 1.00 2.80 N ATOM 277 H LYS A 19 4.071 -42.310 -7.254 1.00 2.80 H ATOM 278 CA LYS A 19 2.425 -42.924 -8.504 1.00 2.80 C ATOM 279 HA LYS A 19 1.506 -43.479 -8.311 1.00 2.80 H ATOM 280 C LYS A 19 3.135 -43.625 -9.647 1.00 2.80 C ATOM 281 O LYS A 19 2.660 -44.634 -10.156 1.00 2.80 O ATOM 282 CB LYS A 19 2.041 -41.505 -8.949 1.00 2.80 C ATOM 283 1HB LYS A 19 2.954 -40.935 -9.123 1.00 2.80 H ATOM 284 2HB LYS A 19 1.485 -41.566 -9.885 1.00 2.80 H ATOM 285 CG LYS A 19 1.200 -40.756 -7.925 1.00 2.80 C ATOM 286 1HG LYS A 19 0.268 -41.295 -7.756 1.00 2.80 H ATOM 287 2HG LYS A 19 1.752 -40.709 -6.993 1.00 2.80 H ATOM 288 CD LYS A 19 0.894 -39.330 -8.345 1.00 2.80 C ATOM 289 1HD LYS A 19 1.830 -38.815 -8.565 1.00 2.80 H ATOM 290 2HD LYS A 19 0.264 -39.336 -9.236 1.00 2.80 H ATOM 291 CE LYS A 19 0.182 -38.613 -7.204 1.00 2.80 C ATOM 292 1HE LYS A 19 -0.753 -39.133 -6.986 1.00 2.80 H ATOM 293 2HE LYS A 19 0.811 -38.663 -6.311 1.00 2.80 H ATOM 294 NZ LYS A 19 -0.108 -37.173 -7.515 1.00 2.80 N ATOM 295 1HZ LYS A 19 -0.544 -36.737 -6.711 1.00 2.80 H ATOM 296 2HZ LYS A 19 -0.731 -37.108 -8.308 1.00 2.80 H ATOM 297 3HZ LYS A 19 0.752 -36.685 -7.723 1.00 2.80 H ATOM 298 N ALA A 20 4.282 -43.109 -10.056 1.00 21.21 N ATOM 299 H ALA A 20 4.694 -42.326 -9.554 1.00 21.21 H ATOM 300 CA ALA A 20 4.972 -43.623 -11.233 1.00 21.21 C ATOM 301 HA ALA A 20 4.223 -43.922 -11.968 1.00 21.21 H ATOM 302 C ALA A 20 5.814 -44.854 -10.901 1.00 21.21 C ATOM 303 O ALA A 20 6.397 -45.474 -11.775 1.00 21.21 O ATOM 304 CB ALA A 20 5.809 -42.536 -11.846 1.00 21.21 C ATOM 305 1HB ALA A 20 5.168 -41.713 -12.169 1.00 21.21 H ATOM 306 2HB ALA A 20 6.346 -42.930 -12.711 1.00 21.21 H ATOM 307 3HB ALA A 20 6.515 -42.171 -11.108 1.00 21.21 H ATOM 308 N GLU A 21 5.792 -45.276 -9.650 1.00 7.19 N ATOM 309 H GLU A 21 5.406 -44.694 -8.924 1.00 7.19 H ATOM 310 CA GLU A 21 6.299 -46.600 -9.304 1.00 7.19 C ATOM 311 HA GLU A 21 7.316 -46.715 -9.683 1.00 7.19 H ATOM 312 C GLU A 21 5.424 -47.664 -9.968 1.00 7.19 C ATOM 313 O GLU A 21 5.904 -48.697 -10.423 1.00 7.19 O ATOM 314 CB GLU A 21 6.313 -46.758 -7.784 1.00 7.19 C ATOM 315 1HB GLU A 21 5.305 -46.601 -7.399 1.00 7.19 H ATOM 316 2HB GLU A 21 6.627 -47.772 -7.540 1.00 7.19 H ATOM 317 CG GLU A 21 7.259 -45.767 -7.113 1.00 7.19 C ATOM 318 1HG GLU A 21 6.895 -44.752 -7.281 1.00 7.19 H ATOM 319 2HG GLU A 21 7.270 -45.955 -6.039 1.00 7.19 H ATOM 320 CD GLU A 21 8.672 -45.888 -7.662 1.00 7.19 C ATOM 321 OE1 GLU A 21 9.235 -47.002 -7.637 1.00 7.19 O ATOM 322 OE2 GLU A 21 9.242 -44.881 -8.144 1.00 7.19 O ATOM 323 N ASN A 22 4.143 -47.366 -10.142 1.00 0.75 N ATOM 324 H ASN A 22 3.766 -46.502 -9.774 1.00 0.75 H ATOM 325 CA ASN A 22 3.266 -48.273 -10.880 1.00 0.75 C ATOM 326 HA ASN A 22 3.397 -49.286 -10.493 1.00 0.75 H ATOM 327 C ASN A 22 3.651 -48.262 -12.357 1.00 0.75 C ATOM 328 O ASN A 22 3.611 -49.284 -13.029 1.00 0.75 O ATOM 329 CB ASN A 22 1.797 -47.868 -10.729 1.00 0.75 C ATOM 330 1HB ASN A 22 1.666 -46.846 -11.077 1.00 0.75 H ATOM 331 2HB ASN A 22 1.187 -48.527 -11.346 1.00 0.75 H ATOM 332 CG ASN A 22 1.317 -47.968 -9.307 1.00 0.75 C ATOM 333 OD1 ASN A 22 1.083 -49.044 -8.797 1.00 0.75 O ATOM 334 ND2 ASN A 22 1.185 -46.847 -8.652 1.00 0.75 N ATOM 335 1HD2 ASN A 22 0.880 -46.885 -7.693 1.00 0.75 H ATOM 336 2HD2 ASN A 22 1.398 -45.969 -9.101 1.00 0.75 H ATOM 337 N LYS A 23 4.071 -47.110 -12.867 1.00-19.24 N ATOM 338 H LYS A 23 4.101 -46.293 -12.277 1.00-19.24 H ATOM 339 CA LYS A 23 4.521 -47.014 -14.260 1.00-19.24 C ATOM 340 HA LYS A 23 3.755 -47.454 -14.899 1.00-19.24 H ATOM 341 C LYS A 23 5.794 -47.830 -14.431 1.00-19.24 C ATOM 342 O LYS A 23 5.937 -48.521 -15.432 1.00-19.24 O ATOM 343 CB LYS A 23 4.726 -45.550 -14.680 1.00-19.24 C ATOM 344 1HB LYS A 23 3.833 -44.998 -14.387 1.00-19.24 H ATOM 345 2HB LYS A 23 5.573 -45.128 -14.142 1.00-19.24 H ATOM 346 CG LYS A 23 4.936 -45.323 -16.182 1.00-19.24 C ATOM 347 1HG LYS A 23 4.502 -46.156 -16.735 1.00-19.24 H ATOM 348 2HG LYS A 23 4.411 -44.410 -16.464 1.00-19.24 H ATOM 349 CD LYS A 23 6.407 -45.161 -16.570 1.00-19.24 C ATOM 350 1HD LYS A 23 6.833 -44.336 -15.998 1.00-19.24 H ATOM 351 2HD LYS A 23 6.947 -46.076 -16.335 1.00-19.24 H ATOM 352 CE LYS A 23 6.545 -44.861 -18.061 1.00-19.24 C ATOM 353 1HE LYS A 23 6.149 -45.710 -18.623 1.00-19.24 H ATOM 354 2HE LYS A 23 5.939 -43.983 -18.293 1.00-19.24 H ATOM 355 NZ LYS A 23 7.960 -44.599 -18.505 1.00-19.24 N ATOM 356 1HZ LYS A 23 7.979 -44.342 -19.479 1.00-19.24 H ATOM 357 2HZ LYS A 23 8.536 -45.433 -18.388 1.00-19.24 H ATOM 358 3HZ LYS A 23 8.381 -43.852 -17.964 1.00-19.24 H ATOM 359 N GLN A 24 6.686 -47.812 -13.451 1.00 4.17 N ATOM 360 H GLN A 24 6.559 -47.175 -12.669 1.00 4.17 H ATOM 361 CA GLN A 24 7.857 -48.687 -13.474 1.00 4.17 C ATOM 362 HA GLN A 24 8.406 -48.506 -14.394 1.00 4.17 H ATOM 363 C GLN A 24 7.450 -50.155 -13.483 1.00 4.17 C ATOM 364 O GLN A 24 8.013 -50.924 -14.256 1.00 4.17 O ATOM 365 CB GLN A 24 8.779 -48.402 -12.279 1.00 4.17 C ATOM 366 1HB GLN A 24 9.127 -47.372 -12.353 1.00 4.17 H ATOM 367 2HB GLN A 24 8.196 -48.490 -11.368 1.00 4.17 H ATOM 368 CG GLN A 24 9.996 -49.337 -12.130 1.00 4.17 C ATOM 369 1HG GLN A 24 10.499 -49.105 -11.193 1.00 4.17 H ATOM 370 2HG GLN A 24 9.648 -50.367 -12.073 1.00 4.17 H ATOM 371 CD GLN A 24 11.009 -49.229 -13.254 1.00 4.17 C ATOM 372 OE1 GLN A 24 11.796 -48.294 -13.315 1.00 4.17 O ATOM 373 NE2 GLN A 24 11.006 -50.185 -14.143 1.00 4.17 N ATOM 374 1HE2 GLN A 24 11.699 -50.164 -14.870 1.00 4.17 H ATOM 375 2HE2 GLN A 24 10.309 -50.915 -14.101 1.00 4.17 H ATOM 376 N ALA A 25 6.488 -50.557 -12.665 1.00-13.03 N ATOM 377 H ALA A 25 6.064 -49.904 -12.011 1.00-13.03 H ATOM 378 CA ALA A 25 6.069 -51.955 -12.648 1.00-13.03 C ATOM 379 HA ALA A 25 6.953 -52.567 -12.464 1.00-13.03 H ATOM 380 C ALA A 25 5.480 -52.384 -13.998 1.00-13.03 C ATOM 381 O ALA A 25 5.824 -53.437 -14.526 1.00-13.03 O ATOM 382 CB ALA A 25 5.063 -52.185 -11.511 1.00-13.03 C ATOM 383 1HB ALA A 25 5.510 -51.894 -10.559 1.00-13.03 H ATOM 384 2HB ALA A 25 4.794 -53.241 -11.471 1.00-13.03 H ATOM 385 3HB ALA A 25 4.162 -51.593 -11.680 1.00-13.03 H ATOM 386 N ILE A 26 4.619 -51.555 -14.571 1.00-24.42 N ATOM 387 H ILE A 26 4.360 -50.698 -14.089 1.00-24.42 H ATOM 388 CA ILE A 26 3.985 -51.867 -15.855 1.00-24.42 C ATOM 389 HA ILE A 26 3.543 -52.861 -15.799 1.00-24.42 H ATOM 390 C ILE A 26 5.042 -51.896 -16.955 1.00-24.42 C ATOM 391 O ILE A 26 5.077 -52.817 -17.768 1.00-24.42 O ATOM 392 CB ILE A 26 2.861 -50.838 -16.194 1.00-24.42 C ATOM 393 HB ILE A 26 3.288 -49.836 -16.142 1.00-24.42 H ATOM 394 CG1 ILE A 26 1.719 -50.951 -15.162 1.00-24.42 C ATOM 395 1HG1 ILE A 26 1.152 -51.859 -15.371 1.00-24.42 H ATOM 396 2HG1 ILE A 26 2.142 -51.056 -14.166 1.00-24.42 H ATOM 397 CG2 ILE A 26 2.293 -51.061 -17.623 1.00-24.42 C ATOM 398 1HG2 ILE A 26 1.496 -50.347 -17.833 1.00-24.42 H ATOM 399 2HG2 ILE A 26 1.897 -52.075 -17.718 1.00-24.42 H ATOM 400 3HG2 ILE A 26 3.076 -50.918 -18.369 1.00-24.42 H ATOM 401 CD1 ILE A 26 0.747 -49.761 -15.123 1.00-24.42 C ATOM 402 1HD1 ILE A 26 0.027 -49.913 -14.319 1.00-24.42 H ATOM 403 2HD1 ILE A 26 0.208 -49.679 -16.067 1.00-24.42 H ATOM 404 3HD1 ILE A 26 1.299 -48.839 -14.935 1.00-24.42 H ATOM 405 N THR A 27 5.942 -50.925 -16.975 1.00 -3.36 N ATOM 406 H THR A 27 5.917 -50.188 -16.278 1.00 -3.36 H ATOM 407 CA THR A 27 6.959 -50.892 -18.024 1.00 -3.36 C ATOM 408 HA THR A 27 6.454 -51.015 -18.982 1.00 -3.36 H ATOM 409 C THR A 27 7.924 -52.061 -17.852 1.00 -3.36 C ATOM 410 O THR A 27 8.383 -52.629 -18.830 1.00 -3.36 O ATOM 411 CB THR A 27 7.727 -49.551 -18.070 1.00 -3.36 C ATOM 412 HB THR A 27 8.409 -49.483 -17.221 1.00 -3.36 H ATOM 413 OG1 THR A 27 6.797 -48.465 -18.013 1.00 -3.36 O ATOM 414 HG1 THR A 27 6.411 -48.458 -17.124 1.00 -3.36 H ATOM 415 CG2 THR A 27 8.491 -49.398 -19.373 1.00 -3.36 C ATOM 416 1HG2 THR A 27 8.866 -48.383 -19.453 1.00 -3.36 H ATOM 417 2HG2 THR A 27 7.834 -49.600 -20.219 1.00 -3.36 H ATOM 418 3HG2 THR A 27 9.333 -50.090 -19.392 1.00 -3.36 H ATOM 419 N GLY A 28 8.162 -52.499 -16.624 1.00 -4.65 N ATOM 420 H GLY A 28 7.774 -52.012 -15.820 1.00 -4.65 H ATOM 421 CA GLY A 28 8.968 -53.687 -16.398 1.00 -4.65 C ATOM 422 1HA GLY A 28 9.949 -53.540 -16.849 1.00 -4.65 H ATOM 423 2HA GLY A 28 9.090 -53.836 -15.325 1.00 -4.65 H ATOM 424 C GLY A 28 8.351 -54.935 -16.999 1.00 -4.65 C ATOM 425 O GLY A 28 9.068 -55.768 -17.546 1.00 -4.65 O ATOM 426 N ILE A 29 7.030 -55.057 -16.969 1.00-29.38 N ATOM 427 H ILE A 29 6.473 -54.354 -16.493 1.00-29.38 H ATOM 428 CA ILE A 29 6.346 -56.187 -17.609 1.00-29.38 C ATOM 429 HA ILE A 29 6.807 -57.115 -17.273 1.00-29.38 H ATOM 430 C ILE A 29 6.535 -56.084 -19.126 1.00-29.38 C ATOM 431 O ILE A 29 6.805 -57.084 -19.791 1.00-29.38 O ATOM 432 CB ILE A 29 4.824 -56.224 -17.244 1.00-29.38 C ATOM 433 HB ILE A 29 4.381 -55.270 -17.520 1.00-29.38 H ATOM 434 CG1 ILE A 29 4.651 -56.432 -15.725 1.00-29.38 C ATOM 435 1HG1 ILE A 29 4.885 -57.470 -15.489 1.00-29.38 H ATOM 436 2HG1 ILE A 29 5.364 -55.810 -15.194 1.00-29.38 H ATOM 437 CG2 ILE A 29 4.078 -57.352 -18.010 1.00-29.38 C ATOM 438 1HG2 ILE A 29 3.023 -57.362 -17.737 1.00-29.38 H ATOM 439 2HG2 ILE A 29 4.519 -58.323 -17.778 1.00-29.38 H ATOM 440 3HG2 ILE A 29 4.143 -57.183 -19.085 1.00-29.38 H ATOM 441 CD1 ILE A 29 3.256 -56.102 -15.172 1.00-29.38 C ATOM 442 1HD1 ILE A 29 3.269 -56.200 -14.086 1.00-29.38 H ATOM 443 2HD1 ILE A 29 2.513 -56.788 -15.579 1.00-29.38 H ATOM 444 3HD1 ILE A 29 2.988 -55.077 -15.431 1.00-29.38 H ATOM 445 N VAL A 30 6.450 -54.883 -19.682 1.00-15.21 N ATOM 446 H VAL A 30 6.230 -54.078 -19.103 1.00-15.21 H ATOM 447 CA VAL A 30 6.653 -54.694 -21.124 1.00-15.21 C ATOM 448 HA VAL A 30 5.993 -55.379 -21.655 1.00-15.21 H ATOM 449 C VAL A 30 8.090 -55.050 -21.514 1.00-15.21 C ATOM 450 O VAL A 30 8.307 -55.746 -22.504 1.00-15.21 O ATOM 451 CB VAL A 30 6.307 -53.237 -21.565 1.00-15.21 C ATOM 452 HB VAL A 30 6.931 -52.541 -21.008 1.00-15.21 H ATOM 453 CG1 VAL A 30 6.560 -53.015 -23.066 1.00-15.21 C ATOM 454 1HG1 VAL A 30 6.260 -52.006 -23.347 1.00-15.21 H ATOM 455 2HG1 VAL A 30 5.993 -53.738 -23.656 1.00-15.21 H ATOM 456 3HG1 VAL A 30 7.622 -53.131 -23.286 1.00-15.21 H ATOM 457 CG2 VAL A 30 4.833 -52.919 -21.261 1.00-15.21 C ATOM 458 1HG2 VAL A 30 4.606 -51.896 -21.564 1.00-15.21 H ATOM 459 2HG2 VAL A 30 4.635 -53.008 -20.196 1.00-15.21 H ATOM 460 3HG2 VAL A 30 4.179 -53.605 -21.801 1.00-15.21 H ATOM 461 N ILE A 31 9.071 -54.639 -20.723 1.00-13.19 N ATOM 462 H ILE A 31 8.846 -54.058 -19.917 1.00-13.19 H ATOM 463 CA ILE A 31 10.477 -54.973 -20.977 1.00-13.19 C ATOM 464 HA ILE A 31 10.728 -54.695 -22.000 1.00-13.19 H ATOM 465 C ILE A 31 10.659 -56.487 -20.850 1.00-13.19 C ATOM 466 O ILE A 31 11.344 -57.096 -21.667 1.00-13.19 O ATOM 467 CB ILE A 31 11.431 -54.200 -20.010 1.00-13.19 C ATOM 468 HB ILE A 31 11.111 -54.393 -18.986 1.00-13.19 H ATOM 469 CG1 ILE A 31 11.350 -52.683 -20.288 1.00-13.19 C ATOM 470 1HG1 ILE A 31 11.888 -52.472 -21.213 1.00-13.19 H ATOM 471 2HG1 ILE A 31 10.313 -52.401 -20.447 1.00-13.19 H ATOM 472 CG2 ILE A 31 12.906 -54.667 -20.167 1.00-13.19 C ATOM 473 1HG2 ILE A 31 13.555 -54.108 -19.493 1.00-13.19 H ATOM 474 2HG2 ILE A 31 13.244 -54.518 -21.195 1.00-13.19 H ATOM 475 3HG2 ILE A 31 12.994 -55.724 -19.914 1.00-13.19 H ATOM 476 CD1 ILE A 31 11.909 -51.776 -19.175 1.00-13.19 C ATOM 477 1HD1 ILE A 31 11.755 -50.732 -19.447 1.00-13.19 H ATOM 478 2HD1 ILE A 31 12.976 -51.950 -19.043 1.00-13.19 H ATOM 479 3HD1 ILE A 31 11.388 -51.979 -18.238 1.00-13.19 H ATOM 480 N GLY A 32 10.003 -57.123 -19.891 1.00 -3.33 N ATOM 481 H GLY A 32 9.453 -56.598 -19.214 1.00 -3.33 H ATOM 482 CA GLY A 32 10.065 -58.572 -19.782 1.00 -3.33 C ATOM 483 1HA GLY A 32 11.107 -58.873 -19.681 1.00 -3.33 H ATOM 484 2HA GLY A 32 9.522 -58.886 -18.891 1.00 -3.33 H ATOM 485 C GLY A 32 9.477 -59.285 -20.987 1.00 -3.33 C ATOM 486 O GLY A 32 10.047 -60.260 -21.479 1.00 -3.33 O ATOM 487 N GLY A 33 8.363 -58.793 -21.511 1.00-14.35 N ATOM 488 H GLY A 33 7.908 -57.993 -21.072 1.00-14.35 H ATOM 489 CA GLY A 33 7.772 -59.387 -22.701 1.00-14.35 C ATOM 490 1HA GLY A 33 7.673 -60.461 -22.547 1.00-14.35 H ATOM 491 2HA GLY A 33 6.783 -58.961 -22.869 1.00-14.35 H ATOM 492 C GLY A 33 8.627 -59.151 -23.931 1.00-14.35 C ATOM 493 O GLY A 33 8.772 -60.026 -24.780 1.00-14.35 O ATOM 494 N TRP A 34 9.253 -57.987 -24.011 1.00-10.69 N ATOM 495 H TRP A 34 9.073 -57.272 -23.309 1.00-10.69 H ATOM 496 CA TRP A 34 10.190 -57.682 -25.088 1.00-10.69 C ATOM 497 HA TRP A 34 9.705 -57.846 -26.050 1.00-10.69 H ATOM 498 C TRP A 34 11.409 -58.599 -25.018 1.00-10.69 C ATOM 499 O TRP A 34 11.812 -59.166 -26.023 1.00-10.69 O ATOM 500 CB TRP A 34 10.604 -56.215 -24.986 1.00-10.69 C ATOM 501 1HB TRP A 34 9.755 -55.593 -25.268 1.00-10.69 H ATOM 502 2HB TRP A 34 10.856 -55.991 -23.954 1.00-10.69 H ATOM 503 CG TRP A 34 11.780 -55.852 -25.833 1.00-10.69 C ATOM 504 CD1 TRP A 34 11.792 -55.607 -27.169 1.00-10.69 C ATOM 505 HD1 TRP A 34 10.918 -55.669 -27.805 1.00-10.69 H ATOM 506 CD2 TRP A 34 13.139 -55.672 -25.396 1.00-10.69 C ATOM 507 NE1 TRP A 34 13.044 -55.267 -27.604 1.00-10.69 N ATOM 508 HE1 TRP A 34 13.276 -55.047 -28.561 1.00-10.69 H ATOM 509 CE2 TRP A 34 13.896 -55.267 -26.533 1.00-10.69 C ATOM 510 CE3 TRP A 34 13.792 -55.782 -24.150 1.00-10.69 C ATOM 511 HE3 TRP A 34 13.244 -56.095 -23.273 1.00-10.69 H ATOM 512 CZ2 TRP A 34 15.265 -54.938 -26.449 1.00-10.69 C ATOM 513 HZ2 TRP A 34 15.813 -54.622 -27.324 1.00-10.69 H ATOM 514 CZ3 TRP A 34 15.173 -55.469 -24.063 1.00-10.69 C ATOM 515 HZ3 TRP A 34 15.682 -55.548 -23.113 1.00-10.69 H ATOM 516 CH2 TRP A 34 15.891 -55.037 -25.218 1.00-10.69 C ATOM 517 HH2 TRP A 34 16.940 -54.793 -25.131 1.00-10.69 H ATOM 518 N ALA A 35 11.954 -58.821 -23.830 1.00 -7.01 N ATOM 519 H ALA A 35 11.600 -58.326 -23.014 1.00 -7.01 H ATOM 520 CA ALA A 35 13.085 -59.730 -23.667 1.00 -7.01 C ATOM 521 HA ALA A 35 13.875 -59.425 -24.352 1.00 -7.01 H ATOM 522 C ALA A 35 12.686 -61.169 -24.016 1.00 -7.01 C ATOM 523 O ALA A 35 13.463 -61.918 -24.598 1.00 -7.01 O ATOM 524 CB ALA A 35 13.613 -59.642 -22.233 1.00 -7.01 C ATOM 525 1HB ALA A 35 13.918 -58.617 -22.017 1.00 -7.01 H ATOM 526 2HB ALA A 35 14.473 -60.304 -22.122 1.00 -7.01 H ATOM 527 3HB ALA A 35 12.836 -59.942 -21.528 1.00 -7.01 H ATOM 528 N SER A 36 11.453 -61.540 -23.708 1.00-15.49 N ATOM 529 H SER A 36 10.853 -60.902 -23.196 1.00-15.49 H ATOM 530 CA SER A 36 10.945 -62.860 -24.076 1.00-15.49 C ATOM 531 HA SER A 36 11.659 -63.615 -23.748 1.00-15.49 H ATOM 532 C SER A 36 10.778 -62.986 -25.589 1.00-15.49 C ATOM 533 O SER A 36 10.936 -64.063 -26.148 1.00-15.49 O ATOM 534 CB SER A 36 9.603 -63.122 -23.395 1.00-15.49 C ATOM 535 1HB SER A 36 8.867 -62.404 -23.756 1.00-15.49 H ATOM 536 2HB SER A 36 9.266 -64.129 -23.644 1.00-15.49 H ATOM 537 OG SER A 36 9.726 -62.997 -21.987 1.00-15.49 O ATOM 538 HG SER A 36 9.881 -62.066 -21.766 1.00-15.49 H ATOM 539 N SER A 37 10.500 -61.878 -26.259 1.00 8.47 N ATOM 540 H SER A 37 10.355 -61.012 -25.754 1.00 8.47 H ATOM 541 CA SER A 37 10.395 -61.866 -27.716 1.00 8.47 C ATOM 542 HA SER A 37 9.788 -62.715 -28.032 1.00 8.47 H ATOM 543 C SER A 37 11.777 -61.995 -28.351 1.00 8.47 C ATOM 544 O SER A 37 11.924 -62.627 -29.390 1.00 8.47 O ATOM 545 CB SER A 37 9.723 -60.578 -28.196 1.00 8.47 C ATOM 546 1HB SER A 37 10.358 -59.727 -27.956 1.00 8.47 H ATOM 547 2HB SER A 37 9.590 -60.624 -29.277 1.00 8.47 H ATOM 548 OG SER A 37 8.460 -60.409 -27.568 1.00 8.47 O ATOM 549 HG SER A 37 8.586 -60.353 -26.610 1.00 8.47 H ATOM 550 N LEU A 38 12.805 -61.452 -27.709 1.00 -9.38 N ATOM 551 H LEU A 38 12.639 -60.914 -26.865 1.00 -9.38 H ATOM 552 CA LEU A 38 14.182 -61.606 -28.195 1.00 -9.38 C ATOM 553 HA LEU A 38 14.225 -61.328 -29.248 1.00 -9.38 H ATOM 554 C LEU A 38 14.637 -63.057 -28.068 1.00 -9.38 C ATOM 555 O LEU A 38 15.462 -63.532 -28.838 1.00 -9.38 O ATOM 556 CB LEU A 38 15.169 -60.744 -27.396 1.00 -9.38 C ATOM 557 1HB LEU A 38 15.136 -61.087 -26.364 1.00 -9.38 H ATOM 558 2HB LEU A 38 16.164 -60.975 -27.775 1.00 -9.38 H ATOM 559 CG LEU A 38 15.041 -59.215 -27.373 1.00 -9.38 C ATOM 560 HG LEU A 38 14.066 -58.946 -26.984 1.00 -9.38 H ATOM 561 CD1 LEU A 38 16.101 -58.660 -26.425 1.00 -9.38 C ATOM 562 1HD1 LEU A 38 15.997 -57.581 -26.357 1.00 -9.38 H ATOM 563 2HD1 LEU A 38 17.101 -58.904 -26.787 1.00 -9.38 H ATOM 564 3HD1 LEU A 38 15.963 -59.082 -25.429 1.00 -9.38 H ATOM 565 CD2 LEU A 38 15.194 -58.582 -28.753 1.00 -9.38 C ATOM 566 1HD2 LEU A 38 15.129 -57.498 -28.665 1.00 -9.38 H ATOM 567 2HD2 LEU A 38 14.390 -58.927 -29.403 1.00 -9.38 H ATOM 568 3HD2 LEU A 38 16.154 -58.857 -29.190 1.00 -9.38 H ATOM 569 N ALA A 39 14.079 -63.757 -27.091 1.00 8.15 N ATOM 570 H ALA A 39 13.439 -63.293 -26.462 1.00 8.15 H ATOM 571 CA ALA A 39 14.356 -65.175 -26.874 1.00 8.15 C ATOM 572 HA ALA A 39 15.395 -65.377 -27.136 1.00 8.15 H ATOM 573 C ALA A 39 13.461 -66.071 -27.746 1.00 8.15 C ATOM 574 O ALA A 39 13.512 -67.299 -27.649 1.00 8.15 O ATOM 575 CB ALA A 39 14.151 -65.497 -25.386 1.00 8.15 C ATOM 576 1HB ALA A 39 14.769 -64.838 -24.776 1.00 8.15 H ATOM 577 2HB ALA A 39 14.433 -66.534 -25.199 1.00 8.15 H ATOM 578 3HB ALA A 39 13.102 -65.360 -25.121 1.00 8.15 H ATOM 579 N GLY A 40 12.608 -65.467 -28.559 1.00 22.93 N ATOM 580 H GLY A 40 12.610 -64.459 -28.644 1.00 22.93 H ATOM 581 CA GLY A 40 11.668 -66.231 -29.357 1.00 22.93 C ATOM 582 1HA GLY A 40 11.214 -66.996 -28.727 1.00 22.93 H ATOM 583 2HA GLY A 40 10.882 -65.566 -29.715 1.00 22.93 H ATOM 584 C GLY A 40 12.319 -66.901 -30.549 1.00 22.93 C ATOM 585 O GLY A 40 13.219 -66.366 -31.184 1.00 22.93 O ATOM 586 N MET A 41 11.821 -68.078 -30.900 1.00-16.17 N ATOM 587 H MET A 41 11.069 -68.470 -30.356 1.00-16.17 H ATOM 588 CA MET A 41 12.309 -68.835 -32.060 1.00-16.17 C ATOM 589 HA MET A 41 13.362 -68.609 -32.228 1.00-16.17 H ATOM 590 C MET A 41 11.516 -68.441 -33.310 1.00-16.17 C ATOM 591 O MET A 41 11.496 -69.140 -34.318 1.00-16.17 O ATOM 592 CB MET A 41 12.157 -70.337 -31.798 1.00-16.17 C ATOM 593 1HB MET A 41 11.105 -70.558 -31.623 1.00-16.17 H ATOM 594 2HB MET A 41 12.482 -70.878 -32.686 1.00-16.17 H ATOM 595 CG MET A 41 12.969 -70.831 -30.605 1.00-16.17 C ATOM 596 1HG MET A 41 14.022 -70.607 -30.772 1.00-16.17 H ATOM 597 2HG MET A 41 12.640 -70.306 -29.707 1.00-16.17 H ATOM 598 SD MET A 41 12.779 -72.608 -30.336 1.00-16.17 S ATOM 599 CE MET A 41 13.818 -73.309 -31.638 1.00-16.17 C ATOM 600 1HE MET A 41 13.828 -74.395 -31.546 1.00-16.17 H ATOM 601 2HE MET A 41 14.836 -72.930 -31.539 1.00-16.17 H ATOM 602 3HE MET A 41 13.421 -73.035 -32.616 1.00-16.17 H ATOM 603 N GLY A 42 10.820 -67.324 -33.185 1.00 17.32 N ATOM 604 H GLY A 42 10.910 -66.776 -32.339 1.00 17.32 H ATOM 605 CA GLY A 42 9.872 -66.825 -34.160 1.00 17.32 C ATOM 606 1HA GLY A 42 10.363 -66.180 -34.887 1.00 17.32 H ATOM 607 2HA GLY A 42 9.332 -67.636 -34.649 1.00 17.32 H ATOM 608 C GLY A 42 8.959 -66.019 -33.261 1.00 17.32 C ATOM 609 O GLY A 42 9.322 -65.839 -32.088 1.00 17.32 O ATOM 610 N HIS A 43 7.825 -65.552 -33.756 1.00-27.64 N ATOM 611 H HIS A 43 7.532 -65.790 -34.700 1.00-27.64 H ATOM 612 CA HIS A 43 6.825 -64.808 -32.992 1.00-27.64 C ATOM 613 HA HIS A 43 6.907 -64.982 -31.920 1.00-27.64 H ATOM 614 C HIS A 43 5.575 -65.481 -33.538 1.00-27.64 C ATOM 615 O HIS A 43 5.743 -66.035 -34.653 1.00-27.64 O ATOM 616 OXT HIS A 43 4.506 -65.477 -32.904 1.00-27.64 O ATOM 617 CB HIS A 43 6.783 -63.306 -33.327 1.00-27.64 C ATOM 618 1HB HIS A 43 6.720 -63.191 -34.409 1.00-27.64 H ATOM 619 2HB HIS A 43 5.875 -62.891 -32.889 1.00-27.64 H ATOM 620 CG HIS A 43 7.947 -62.509 -32.815 1.00-27.64 C ATOM 621 ND1 HIS A 43 8.992 -63.016 -32.085 1.00-27.64 N ATOM 622 HD1 HIS A 43 9.107 -63.992 -31.819 1.00-27.64 H ATOM 623 CD2 HIS A 43 8.220 -61.183 -32.933 1.00-27.64 C ATOM 624 HD2 HIS A 43 7.593 -60.470 -33.447 1.00-27.64 H ATOM 625 CE1 HIS A 43 9.841 -62.023 -31.817 1.00-27.64 C ATOM 626 HE1 HIS A 43 10.767 -62.142 -31.270 1.00-27.64 H ATOM 627 NE2 HIS A 43 9.410 -60.878 -32.308 1.00-27.64 N TER 628 HIS A 43 CONECT 138 135 221 CONECT 221 138 218 END
SEQUENCE	AISYGNGVYCNKEKCWVNKAENKQAITGIVIGGWASSLAGMGH
HELICITY	65.10	INSTAB. INDEX	26.93	FLEXIBILITY	15.77
a HYD. MOM.	56.86	b HYD. MOM.	12.62	c HYD. MOM	2.44
a MEAN HYD. MOM.	1.32	b MEAN HYD. MOM.	0.29	c MEAN HYD. MOM.	0.06
CHARGE pH5	3.21	CHARGE pH7	2.00	CHARGE pH9	-0.12
Δ CHARGE pH5-pH9	3.33	ISOELECTRIC POINT	8.76	BOMAN INDEX	0.55
ΔG	24	CPP	-0,42	MLP	-13,21
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	Carnobacteriaceae	GENUS	Carnobacterium	SPECIES	Carnobacterium maltaromaticum
DATE	1994
TITLE PAPER	Chemical and genetic characterization of bacteriocins produced by Carnobacterium piscicola LV17B