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ID	787	NAME	BTD-2   Blast NCBI-PROT
LENGTH	18	DISULFIDE BRIDGE			View PDB REMARK YASARA ************************************************************* REMARK YASARA * * REMARK YASARA * Y A S A R A * REMARK YASARA * * REMARK YASARA * Yet Another Scientific Artificial Reality Application * REMARK YASARA * * REMARK YASARA * MOLECULE STRUCTURE FILE, PDB FORMAT * REMARK YASARA * * REMARK YASARA * Just use YASARA every day to make your questions go away! * REMARK YASARA * * REMARK YASARA * www.YASARA.org * REMARK YASARA * * REMARK YASARA ************************************************************* REMARK YASARA REMARK YASARA Original filename: C:\Users\federica\Favorites\Dropbox\lab13\Lucia\pdb_yadamp\risultati_grimd_abalone\pdb_final\RCVCRRGVCRCVCRRGVC.pdb REMARK YASARA Written on: Mon May 19 17:35:56 2014 REMARK YASARA Number of models: 1 REMARK YASARA Number of atoms: 291 REMARK YASARA Please address questions or suggestions to: Eliza@yasara.org REMARK YASARA SEQRES 1 18 ARG CYS VAL CYS ARG ARG GLY VAL CYS ARG CYS VAL CYS SEQRES 2 18 ARG ARG GLY VAL CYS ATOM 1 N ARG 1 -16.447 -8.591 37.495 1.00 -0.35 N ATOM 2 1H ARG 1 -16.742 -8.738 38.450 1.00 -0.35 H ATOM 3 2H ARG 1 -17.257 -8.420 36.916 1.00 -0.35 H ATOM 4 3H ARG 1 -15.976 -9.421 37.156 1.00 0.28 H ATOM 5 CA ARG 1 -15.515 -7.421 37.417 1.00 -0.26 C ATOM 6 HA ARG 1 -16.040 -6.521 37.740 1.00 0.16 H ATOM 7 C ARG 1 -15.077 -7.232 35.977 1.00 0.73 C ATOM 8 O ARG 1 -15.224 -8.163 35.204 1.00 -0.59 O ATOM 9 CB ARG 1 -14.273 -7.633 38.305 1.00 -0.00 C ATOM 10 1HB ARG 1 -13.804 -8.579 38.033 1.00 0.03 H ATOM 11 2HB ARG 1 -13.565 -6.832 38.089 1.00 0.03 H ATOM 12 CG ARG 1 -14.532 -7.622 39.820 1.00 0.04 C ATOM 13 1HG ARG 1 -15.063 -6.705 40.079 1.00 0.03 H ATOM 14 2HG ARG 1 -15.146 -8.479 40.098 1.00 0.03 H ATOM 15 CD ARG 1 -13.214 -7.661 40.610 1.00 0.05 C ATOM 16 1HD ARG 1 -12.679 -8.584 40.379 1.00 0.07 H ATOM 17 2HD ARG 1 -12.596 -6.822 40.286 1.00 0.07 H ATOM 18 NE ARG 1 -13.413 -7.547 42.066 1.00 -0.53 N ATOM 19 HE ARG 1 -13.496 -6.610 42.430 1.00 0.35 H ATOM 20 CZ ARG 1 -13.457 -8.535 42.952 1.00 0.81 C ATOM 21 NH1 ARG 1 -13.663 -8.238 44.204 1.00 -0.86 N ATOM 22 1HH1 ARG 1 -13.784 -7.281 44.494 1.00 0.32 H ATOM 23 2HH1 ARG 1 -13.692 -8.967 44.899 1.00 0.32 H ATOM 24 NH2 ARG 1 -13.295 -9.798 42.654 1.00 -0.86 N ATOM 25 1HH2 ARG 1 -13.096 -10.071 41.710 1.00 0.32 H ATOM 26 2HH2 ARG 1 -13.349 -10.498 43.377 1.00 0.32 H ATOM 27 N CYS 2 -14.528 -6.082 35.604 1.00 -0.42 N ATOM 28 H CYS 2 -14.367 -5.338 36.270 1.00 0.27 H ATOM 29 CA CYS 2 -14.134 -5.821 34.216 1.00 0.02 C ATOM 30 HA CYS 2 -15.012 -5.861 33.568 1.00 0.11 H ATOM 31 C CYS 2 -13.116 -6.825 33.666 1.00 0.60 C ATOM 32 O CYS 2 -13.232 -7.283 32.536 1.00 -0.57 O ATOM 33 CB CYS 2 -13.539 -4.414 34.172 1.00 -0.12 C ATOM 34 1HB CYS 2 -12.956 -4.293 33.255 1.00 0.11 H ATOM 35 2HB CYS 2 -14.350 -3.682 34.166 1.00 0.11 H ATOM 36 SG CYS 2 -12.492 -4.108 35.624 1.00 -0.31 S ATOM 37 HG CYS 2 -12.070 -2.885 35.260 1.00 0.19 H ATOM 38 N VAL 3 -12.170 -7.244 34.493 1.00 -0.42 N ATOM 39 H VAL 3 -12.116 -6.853 35.419 1.00 0.27 H ATOM 40 CA VAL 3 -11.144 -8.209 34.090 1.00 -0.09 C ATOM 41 HA VAL 3 -10.662 -7.825 33.189 1.00 0.10 H ATOM 42 C VAL 3 -11.669 -9.602 33.733 1.00 0.60 C ATOM 43 O VAL 3 -10.954 -10.398 33.128 1.00 -0.57 O ATOM 44 CB VAL 3 -10.053 -8.341 35.190 1.00 0.30 C ATOM 45 HB VAL 3 -9.313 -9.064 34.855 1.00 -0.03 H ATOM 46 CG1 VAL 3 -9.341 -6.999 35.401 1.00 -0.32 C ATOM 47 1HG1 VAL 3 -8.932 -6.641 34.454 1.00 0.08 H ATOM 48 2HG1 VAL 3 -10.018 -6.244 35.801 1.00 0.08 H ATOM 49 3HG1 VAL 3 -8.512 -7.129 36.099 1.00 0.08 H ATOM 50 CG2 VAL 3 -10.644 -8.829 36.530 1.00 -0.32 C ATOM 51 1HG2 VAL 3 -11.149 -9.786 36.395 1.00 0.08 H ATOM 52 2HG2 VAL 3 -9.830 -8.976 37.245 1.00 0.08 H ATOM 53 3HG2 VAL 3 -11.337 -8.099 36.941 1.00 0.08 H ATOM 54 N CYS 4 -12.925 -9.897 34.040 1.00 -0.42 N ATOM 55 H CYS 4 -13.504 -9.224 34.524 1.00 0.27 H ATOM 56 CA CYS 4 -13.523 -11.172 33.655 1.00 0.02 C ATOM 57 HA CYS 4 -12.818 -11.978 33.864 1.00 0.11 H ATOM 58 C CYS 4 -13.856 -11.192 32.160 1.00 0.60 C ATOM 59 O CYS 4 -14.033 -12.246 31.561 1.00 -0.57 O ATOM 60 CB CYS 4 -14.794 -11.395 34.479 1.00 -0.12 C ATOM 61 1HB CYS 4 -15.529 -10.640 34.195 1.00 0.11 H ATOM 62 2HB CYS 4 -15.204 -12.379 34.238 1.00 0.11 H ATOM 63 SG CYS 4 -14.499 -11.278 36.271 1.00 -0.31 S ATOM 64 HG CYS 4 -13.871 -12.458 36.390 1.00 0.19 H ATOM 65 N ARG 5 -13.914 -10.025 31.527 1.00 -0.35 N ATOM 66 H ARG 5 -13.718 -9.159 32.027 1.00 0.28 H ATOM 67 CA ARG 5 -14.253 -9.954 30.101 1.00 -0.26 C ATOM 68 HA ARG 5 -15.093 -10.618 29.910 1.00 0.16 H ATOM 69 C ARG 5 -13.118 -10.432 29.211 1.00 0.73 C ATOM 70 O ARG 5 -13.330 -10.680 28.032 1.00 -0.59 O ATOM 71 CB ARG 5 -14.636 -8.523 29.699 1.00 -0.00 C ATOM 72 1HB ARG 5 -13.796 -7.868 29.927 1.00 0.03 H ATOM 73 2HB ARG 5 -14.791 -8.496 28.620 1.00 0.03 H ATOM 74 CG ARG 5 -15.891 -7.960 30.385 1.00 0.04 C ATOM 75 1HG ARG 5 -15.748 -7.985 31.465 1.00 0.03 H ATOM 76 2HG ARG 5 -16.009 -6.918 30.083 1.00 0.03 H ATOM 77 CD ARG 5 -17.185 -8.714 30.040 1.00 0.05 C ATOM 78 1HD ARG 5 -17.095 -9.748 30.367 1.00 0.07 H ATOM 79 2HD ARG 5 -18.008 -8.258 30.592 1.00 0.07 H ATOM 80 NE ARG 5 -17.500 -8.659 28.601 1.00 -0.53 N ATOM 81 HE ARG 5 -17.680 -7.742 28.226 1.00 0.35 H ATOM 82 CZ ARG 5 -17.557 -9.681 27.755 1.00 0.81 C ATOM 83 NH1 ARG 5 -17.808 -9.433 26.499 1.00 -0.86 N ATOM 84 1HH1 ARG 5 -17.956 -8.488 26.187 1.00 0.32 H ATOM 85 2HH1 ARG 5 -17.859 -10.189 25.837 1.00 0.32 H ATOM 86 NH2 ARG 5 -17.393 -10.934 28.102 1.00 -0.86 N ATOM 87 1HH2 ARG 5 -17.236 -11.169 29.065 1.00 0.32 H ATOM 88 2HH2 ARG 5 -17.434 -11.661 27.409 1.00 0.32 H ATOM 89 N ARG 6 -11.933 -10.620 29.778 1.00 -0.35 N ATOM 90 H ARG 6 -11.833 -10.441 30.766 1.00 0.28 H ATOM 91 CA ARG 6 -10.763 -11.093 29.026 1.00 -0.26 C ATOM 92 HA ARG 6 -10.607 -10.436 28.168 1.00 0.16 H ATOM 93 C ARG 6 -10.919 -12.505 28.470 1.00 0.73 C ATOM 94 O ARG 6 -10.154 -12.910 27.606 1.00 -0.59 O ATOM 95 CB ARG 6 -9.512 -11.047 29.907 1.00 -0.00 C ATOM 96 1HB ARG 6 -9.698 -11.656 30.792 1.00 0.03 H ATOM 97 2HB ARG 6 -8.686 -11.494 29.353 1.00 0.03 H ATOM 98 CG ARG 6 -9.092 -9.638 30.333 1.00 0.04 C ATOM 99 1HG ARG 6 -8.879 -9.047 29.442 1.00 0.03 H ATOM 100 2HG ARG 6 -9.900 -9.161 30.887 1.00 0.03 H ATOM 101 CD ARG 6 -7.844 -9.678 31.211 1.00 0.05 C ATOM 102 1HD ARG 6 -7.048 -10.189 30.667 1.00 0.07 H ATOM 103 2HD ARG 6 -7.527 -8.656 31.424 1.00 0.07 H ATOM 104 NE ARG 6 -8.102 -10.381 32.477 1.00 -0.53 N ATOM 105 HE ARG 6 -9.071 -10.618 32.664 1.00 0.35 H ATOM 106 CZ ARG 6 -7.205 -10.734 33.388 1.00 0.81 C ATOM 107 NH1 ARG 6 -7.611 -11.407 34.428 1.00 -0.86 N ATOM 108 1HH1 ARG 6 -8.583 -11.652 34.519 1.00 0.32 H ATOM 109 2HH1 ARG 6 -6.954 -11.690 35.135 1.00 0.32 H ATOM 110 NH2 ARG 6 -5.928 -10.457 33.296 1.00 -0.86 N ATOM 111 1HH2 ARG 6 -5.588 -9.942 32.502 1.00 0.32 H ATOM 112 2HH2 ARG 6 -5.288 -10.759 34.010 1.00 0.32 H ATOM 113 N GLY 7 -11.939 -13.237 28.899 1.00 -0.42 N ATOM 114 H GLY 7 -12.561 -12.878 29.609 1.00 0.27 H ATOM 115 CA GLY 7 -12.195 -14.556 28.338 1.00 -0.03 C ATOM 116 1HA GLY 7 -11.315 -15.179 28.502 1.00 0.07 H ATOM 117 2HA GLY 7 -13.038 -15.007 28.860 1.00 0.07 H ATOM 118 C GLY 7 -12.485 -14.554 26.846 1.00 0.60 C ATOM 119 O GLY 7 -12.290 -15.572 26.183 1.00 -0.57 O ATOM 120 N VAL 8 -12.875 -13.417 26.276 1.00 -0.42 N ATOM 121 H VAL 8 -12.991 -12.578 26.832 1.00 0.27 H ATOM 122 CA VAL 8 -13.125 -13.341 24.832 1.00 -0.09 C ATOM 123 HA VAL 8 -13.809 -14.150 24.571 1.00 0.10 H ATOM 124 C VAL 8 -11.857 -13.548 24.006 1.00 0.60 C ATOM 125 O VAL 8 -11.935 -13.890 22.828 1.00 -0.57 O ATOM 126 CB VAL 8 -13.790 -12.001 24.401 1.00 0.30 C ATOM 127 HB VAL 8 -14.010 -12.062 23.335 1.00 -0.03 H ATOM 128 CG1 VAL 8 -15.121 -11.798 25.143 1.00 -0.32 C ATOM 129 1HG1 VAL 8 -15.623 -10.920 24.736 1.00 0.08 H ATOM 130 2HG1 VAL 8 -15.759 -12.671 24.992 1.00 0.08 H ATOM 131 3HG1 VAL 8 -14.946 -11.650 26.208 1.00 0.08 H ATOM 132 CG2 VAL 8 -12.866 -10.788 24.623 1.00 -0.32 C ATOM 133 1HG2 VAL 8 -11.982 -10.871 23.988 1.00 0.08 H ATOM 134 2HG2 VAL 8 -13.389 -9.871 24.350 1.00 0.08 H ATOM 135 3HG2 VAL 8 -12.551 -10.719 25.662 1.00 0.08 H ATOM 136 N CYS 9 -10.682 -13.430 24.613 1.00 -0.42 N ATOM 137 H CYS 9 -10.628 -13.154 25.588 1.00 0.27 H ATOM 138 CA CYS 9 -9.442 -13.705 23.899 1.00 0.02 C ATOM 139 HA CYS 9 -9.428 -13.109 22.987 1.00 0.11 H ATOM 140 C CYS 9 -9.344 -15.176 23.496 1.00 0.60 C ATOM 141 O CYS 9 -8.684 -15.510 22.520 1.00 -0.57 O ATOM 142 CB CYS 9 -8.243 -13.299 24.754 1.00 -0.12 C ATOM 143 1HB CYS 9 -8.260 -13.866 25.686 1.00 0.11 H ATOM 144 2HB CYS 9 -7.327 -13.543 24.211 1.00 0.11 H ATOM 145 SG CYS 9 -8.254 -11.528 25.139 1.00 -0.31 S ATOM 146 HG CYS 9 -7.087 -11.507 25.792 1.00 0.19 H ATOM 147 N ARG 10 -10.062 -16.065 24.174 1.00 -0.35 N ATOM 148 H ARG 10 -10.631 -15.768 24.964 1.00 0.28 H ATOM 149 CA ARG 10 -10.073 -17.473 23.765 1.00 -0.26 C ATOM 150 HA ARG 10 -9.041 -17.796 23.632 1.00 0.16 H ATOM 151 C ARG 10 -10.779 -17.619 22.420 1.00 0.73 C ATOM 152 O ARG 10 -10.414 -18.463 21.611 1.00 -0.59 O ATOM 153 CB ARG 10 -10.749 -18.334 24.840 1.00 -0.00 C ATOM 154 1HB ARG 10 -10.337 -18.055 25.810 1.00 0.03 H ATOM 155 2HB ARG 10 -11.816 -18.105 24.847 1.00 0.03 H ATOM 156 CG ARG 10 -10.575 -19.849 24.669 1.00 0.04 C ATOM 157 1HG ARG 10 -11.249 -20.357 25.359 1.00 0.03 H ATOM 158 2HG ARG 10 -10.841 -20.134 23.651 1.00 0.03 H ATOM 159 CD ARG 10 -9.138 -20.295 24.960 1.00 0.05 C ATOM 160 1HD ARG 10 -8.464 -19.768 24.285 1.00 0.07 H ATOM 161 2HD ARG 10 -8.879 -20.020 25.983 1.00 0.07 H ATOM 162 NE ARG 10 -8.941 -21.743 24.775 1.00 -0.53 N ATOM 163 HE ARG 10 -8.602 -22.029 23.870 1.00 0.35 H ATOM 164 CZ ARG 10 -9.135 -22.694 25.681 1.00 0.81 C ATOM 165 NH1 ARG 10 -8.867 -23.929 25.358 1.00 -0.86 N ATOM 166 1HH1 ARG 10 -8.502 -24.150 24.447 1.00 0.32 H ATOM 167 2HH1 ARG 10 -9.013 -24.668 26.026 1.00 0.32 H ATOM 168 NH2 ARG 10 -9.579 -22.470 26.893 1.00 -0.86 N ATOM 169 1HH2 ARG 10 -9.790 -21.529 27.178 1.00 0.32 H ATOM 170 2HH2 ARG 10 -9.701 -23.230 27.540 1.00 0.32 H ATOM 171 N CYS 11 -11.756 -16.765 22.157 1.00 -0.42 N ATOM 172 H CYS 11 -12.025 -16.078 22.848 1.00 0.27 H ATOM 173 CA CYS 11 -12.438 -16.761 20.868 1.00 0.02 C ATOM 174 HA CYS 11 -12.624 -17.791 20.565 1.00 0.11 H ATOM 175 C CYS 11 -11.578 -16.096 19.797 1.00 0.60 C ATOM 176 O CYS 11 -11.612 -16.503 18.642 1.00 -0.57 O ATOM 177 CB CYS 11 -13.778 -16.036 20.994 1.00 -0.12 C ATOM 178 1HB CYS 11 -13.595 -14.991 21.247 1.00 0.11 H ATOM 179 2HB CYS 11 -14.292 -16.075 20.032 1.00 0.11 H ATOM 180 SG CYS 11 -14.824 -16.778 22.272 1.00 -0.31 S ATOM 181 HG CYS 11 -15.878 -15.970 22.101 1.00 0.19 H ATOM 182 N VAL 12 -10.758 -15.125 20.178 1.00 -0.42 N ATOM 183 H VAL 12 -10.783 -14.793 21.135 1.00 0.27 H ATOM 184 CA VAL 12 -9.799 -14.519 19.246 1.00 -0.09 C ATOM 185 HA VAL 12 -10.339 -14.179 18.363 1.00 0.10 H ATOM 186 C VAL 12 -8.809 -15.599 18.807 1.00 0.60 C ATOM 187 O VAL 12 -8.539 -15.742 17.617 1.00 -0.57 O ATOM 188 CB VAL 12 -9.064 -13.295 19.879 1.00 0.30 C ATOM 189 HB VAL 12 -8.567 -13.620 20.789 1.00 -0.03 H ATOM 190 CG1 VAL 12 -8.000 -12.705 18.942 1.00 -0.32 C ATOM 191 1HG1 VAL 12 -8.456 -12.337 18.023 1.00 0.08 H ATOM 192 2HG1 VAL 12 -7.495 -11.875 19.439 1.00 0.08 H ATOM 193 3HG1 VAL 12 -7.250 -13.457 18.696 1.00 0.08 H ATOM 194 CG2 VAL 12 -10.076 -12.195 20.244 1.00 -0.32 C ATOM 195 1HG2 VAL 12 -9.554 -11.355 20.705 1.00 0.08 H ATOM 196 2HG2 VAL 12 -10.589 -11.843 19.347 1.00 0.08 H ATOM 197 3HG2 VAL 12 -10.812 -12.568 20.951 1.00 0.08 H ATOM 198 N CYS 13 -8.369 -16.453 19.720 1.00 -0.42 N ATOM 199 H CYS 13 -8.586 -16.298 20.701 1.00 0.27 H ATOM 200 CA CYS 13 -7.530 -17.600 19.360 1.00 0.02 C ATOM 201 HA CYS 13 -6.677 -17.228 18.791 1.00 0.11 H ATOM 202 C CYS 13 -8.208 -18.672 18.494 1.00 0.60 C ATOM 203 O CYS 13 -7.562 -19.630 18.087 1.00 -0.57 O ATOM 204 CB CYS 13 -6.991 -18.257 20.632 1.00 -0.12 C ATOM 205 1HB CYS 13 -7.828 -18.616 21.229 1.00 0.11 H ATOM 206 2HB CYS 13 -6.377 -19.112 20.341 1.00 0.11 H ATOM 207 SG CYS 13 -5.983 -17.129 21.627 1.00 -0.31 S ATOM 208 HG CYS 13 -5.524 -18.040 22.490 1.00 0.19 H ATOM 209 N ARG 14 -9.494 -18.520 18.197 1.00 -0.35 N ATOM 210 H ARG 14 -9.995 -17.726 18.580 1.00 0.28 H ATOM 211 CA ARG 14 -10.220 -19.428 17.301 1.00 -0.26 C ATOM 212 HA ARG 14 -9.560 -20.236 16.982 1.00 0.16 H ATOM 213 C ARG 14 -10.727 -18.733 16.041 1.00 0.73 C ATOM 214 O ARG 14 -11.400 -19.365 15.231 1.00 -0.59 O ATOM 215 CB ARG 14 -11.422 -20.031 18.032 1.00 -0.00 C ATOM 216 1HB ARG 14 -12.060 -19.219 18.381 1.00 0.03 H ATOM 217 2HB ARG 14 -11.990 -20.626 17.318 1.00 0.03 H ATOM 218 CG ARG 14 -11.067 -20.922 19.216 1.00 0.04 C ATOM 219 1HG ARG 14 -10.475 -21.768 18.866 1.00 0.03 H ATOM 220 2HG ARG 14 -10.481 -20.358 19.937 1.00 0.03 H ATOM 221 CD ARG 14 -12.333 -21.433 19.893 1.00 0.05 C ATOM 222 1HD ARG 14 -12.058 -21.963 20.805 1.00 0.07 H ATOM 223 2HD ARG 14 -12.958 -20.578 20.156 1.00 0.07 H ATOM 224 NE ARG 14 -13.086 -22.339 19.010 1.00 -0.53 N ATOM 225 HE ARG 14 -12.642 -22.575 18.135 1.00 0.35 H ATOM 226 CZ ARG 14 -14.283 -22.862 19.245 1.00 0.81 C ATOM 227 NH1 ARG 14 -14.799 -23.665 18.358 1.00 -0.86 N ATOM 228 1HH1 ARG 14 -14.294 -23.882 17.515 1.00 0.32 H ATOM 229 2HH1 ARG 14 -15.707 -24.068 18.511 1.00 0.32 H ATOM 230 NH2 ARG 14 -14.986 -22.608 20.320 1.00 -0.86 N ATOM 231 1HH2 ARG 14 -14.626 -21.969 21.007 1.00 0.32 H ATOM 232 2HH2 ARG 14 -15.887 -23.035 20.451 1.00 0.32 H ATOM 233 N ARG 15 -10.459 -17.441 15.890 1.00 -0.35 N ATOM 234 H ARG 15 -9.887 -16.974 16.581 1.00 0.28 H ATOM 235 CA ARG 15 -10.998 -16.671 14.758 1.00 -0.26 C ATOM 236 HA ARG 15 -11.106 -17.337 13.900 1.00 0.16 H ATOM 237 C ARG 15 -10.167 -15.474 14.298 1.00 0.73 C ATOM 238 O ARG 15 -10.064 -15.216 13.106 1.00 -0.59 O ATOM 239 CB ARG 15 -12.389 -16.142 15.151 1.00 -0.00 C ATOM 240 1HB ARG 15 -12.973 -16.956 15.579 1.00 0.03 H ATOM 241 2HB ARG 15 -12.256 -15.381 15.920 1.00 0.03 H ATOM 242 CG ARG 15 -13.179 -15.531 13.997 1.00 0.04 C ATOM 243 1HG ARG 15 -12.526 -14.880 13.424 1.00 0.03 H ATOM 244 2HG ARG 15 -13.544 -16.318 13.338 1.00 0.03 H ATOM 245 CD ARG 15 -14.336 -14.682 14.483 1.00 0.05 C ATOM 246 1HD ARG 15 -15.116 -15.311 14.910 1.00 0.07 H ATOM 247 2HD ARG 15 -13.966 -14.001 15.251 1.00 0.07 H ATOM 248 NE ARG 15 -14.846 -13.876 13.367 1.00 -0.53 N ATOM 249 HE ARG 15 -14.300 -13.038 13.138 1.00 0.35 H ATOM 250 CZ ARG 15 -15.890 -14.131 12.593 1.00 0.81 C ATOM 251 NH1 ARG 15 -16.146 -13.306 11.623 1.00 -0.86 N ATOM 252 1HH1 ARG 15 -15.503 -12.513 11.488 1.00 0.32 H ATOM 253 2HH1 ARG 15 -16.928 -13.435 11.016 1.00 0.32 H ATOM 254 NH2 ARG 15 -16.676 -15.168 12.743 1.00 -0.86 N ATOM 255 1HH2 ARG 15 -16.489 -15.821 13.481 1.00 0.32 H ATOM 256 2HH2 ARG 15 -17.450 -15.306 12.122 1.00 0.32 H ATOM 257 N GLY 16 -9.628 -14.720 15.243 1.00 -0.42 N ATOM 258 H GLY 16 -9.169 -15.161 16.032 1.00 0.27 H ATOM 259 CA GLY 16 -9.789 -13.270 15.292 1.00 -0.03 C ATOM 260 1HA GLY 16 -10.840 -13.056 15.097 1.00 0.07 H ATOM 261 2HA GLY 16 -9.590 -12.956 16.313 1.00 0.07 H ATOM 262 C GLY 16 -8.992 -12.351 14.387 1.00 0.60 C ATOM 263 O GLY 16 -8.626 -11.259 14.803 1.00 -0.57 O ATOM 264 N VAL 17 -8.748 -12.767 13.156 1.00 -0.42 N ATOM 265 H VAL 17 -9.062 -13.695 12.884 1.00 0.27 H ATOM 266 CA VAL 17 -8.142 -11.919 12.128 1.00 -0.09 C ATOM 267 HA VAL 17 -7.663 -11.058 12.593 1.00 0.10 H ATOM 268 C VAL 17 -9.264 -11.402 11.225 1.00 0.60 C ATOM 269 O VAL 17 -9.039 -10.615 10.307 1.00 -0.57 O ATOM 270 CB VAL 17 -7.079 -12.696 11.300 1.00 0.30 C ATOM 271 HB VAL 17 -6.684 -12.031 10.533 1.00 -0.03 H ATOM 272 CG1 VAL 17 -5.912 -13.127 12.206 1.00 -0.32 C ATOM 273 1HG1 VAL 17 -5.133 -13.589 11.601 1.00 0.08 H ATOM 274 2HG1 VAL 17 -5.496 -12.250 12.703 1.00 0.08 H ATOM 275 3HG1 VAL 17 -6.254 -13.838 12.959 1.00 0.08 H ATOM 276 CG2 VAL 17 -7.677 -13.941 10.610 1.00 -0.32 C ATOM 277 1HG2 VAL 17 -8.039 -14.660 11.345 1.00 0.08 H ATOM 278 2HG2 VAL 17 -8.502 -13.646 9.959 1.00 0.08 H ATOM 279 3HG2 VAL 17 -6.913 -14.417 9.996 1.00 0.08 H ATOM 280 N CYS 18 -10.472 -11.871 11.509 1.00 -0.42 N ATOM 281 H CYS 18 -10.599 -12.468 12.317 1.00 0.27 H ATOM 282 CA CYS 18 -11.709 -11.538 10.814 1.00 0.02 C ATOM 283 HA CYS 18 -11.724 -10.494 10.501 1.00 0.11 H ATOM 284 C CYS 18 -12.747 -11.788 11.899 1.00 0.60 C ATOM 285 O CYS 18 -13.954 -11.558 11.690 1.00 -0.57 O ATOM 286 OXT CYS 18 -12.322 -12.326 12.946 1.00 -0.57 O ATOM 287 CB CYS 18 -11.961 -12.484 9.634 1.00 -0.12 C ATOM 288 1HB CYS 18 -11.876 -13.510 9.993 1.00 0.11 H ATOM 289 2HB CYS 18 -12.982 -12.329 9.283 1.00 0.11 H ATOM 290 SG CYS 18 -10.828 -12.250 8.241 1.00 -0.31 S ATOM 291 HG CYS 18 -9.948 -11.483 8.911 1.00 0.19 H TER 292 CYS 18 END
SEQUENCE	RCVCRRGVCRCVCRRGVC
HELICITY	0.00	INSTAB. INDEX	55.28	FLEXIBILITY	13.20
a HYD. MOM.	0.00	b HYD. MOM.	0.00	c HYD. MOM	0.00
a MEAN HYD. MOM.	0.00	b MEAN HYD. MOM.	0.00	c MEAN HYD. MOM.	0.00
CHARGE pH5	6.00	CHARGE pH7	5.73	CHARGE pH9	0.88
Δ CHARGE pH5-pH9	5.11	ISOELECTRIC POINT	9.69	BOMAN INDEX	3.54
ΔG	11	CPP	0,17	MLP	-6,28
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	Chordata	CLASS	Mammalia	ORDER	Primates
FAMILY	Cercopithecidae	GENUS	Macaca	SPECIES	Macaca mulatta
DATE	2008
TITLE PAPER	Isolation, synthesis, and antimicrobial activities of naturally occurring theta-defensin isoforms from baboon leukocytes