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ID	488	NAME	Tat13   Blast NCBI-PROT
LENGTH	14	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\WGRKKRRQRRRPPQ.pdb REMARK YASARA Written on: Wed May 14 18:00:45 2014 REMARK YASARA Number of models: 1 REMARK YASARA Number of atoms: 284 REMARK YASARA Please address questions or suggestions to: Eliza@yasara.org REMARK YASARA SEQRES 1 14 TRP GLY ARG LYS LYS ARG ARG GLN ARG ARG ARG PRO PRO SEQRES 2 14 GLN ATOM 1 N TRP 1 -0.566 -11.636 22.525 1.00 -0.42 N ATOM 2 1H TRP 1 -0.203 -11.721 23.464 1.00 -0.42 H ATOM 3 2H TRP 1 -0.964 -12.519 22.235 1.00 -0.42 H ATOM 4 3H TRP 1 0.186 -11.390 21.896 1.00 0.27 H ATOM 5 CA TRP 1 -1.619 -10.580 22.485 1.00 -0.03 C ATOM 6 HA TRP 1 -2.400 -10.859 23.190 1.00 0.11 H ATOM 7 C TRP 1 -2.236 -10.537 21.090 1.00 0.60 C ATOM 8 O TRP 1 -2.514 -11.595 20.556 1.00 -0.57 O ATOM 9 CB TRP 1 -1.023 -9.236 22.927 1.00 -0.00 C ATOM 10 1HB TRP 1 -0.441 -9.405 23.833 1.00 0.03 H ATOM 11 2HB TRP 1 -0.344 -8.872 22.157 1.00 0.03 H ATOM 12 CG TRP 1 -2.052 -8.172 23.234 1.00 -0.14 C ATOM 13 CD1 TRP 1 -3.151 -8.287 24.034 1.00 -0.16 C ATOM 14 HD1 TRP 1 -3.436 -9.186 24.568 1.00 0.21 H ATOM 15 CD2 TRP 1 -2.060 -6.805 22.772 1.00 0.12 C ATOM 16 NE1 TRP 1 -3.840 -7.109 24.107 1.00 -0.34 N ATOM 17 HE1 TRP 1 -4.682 -6.957 24.673 1.00 0.34 H ATOM 18 CE2 TRP 1 -3.191 -6.168 23.360 1.00 0.14 C ATOM 19 CE3 TRP 1 -1.205 -6.041 21.950 1.00 -0.24 C ATOM 20 HE3 TRP 1 -0.332 -6.489 21.495 1.00 0.17 H ATOM 21 CZ2 TRP 1 -3.466 -4.799 23.179 1.00 -0.26 C ATOM 22 HZ2 TRP 1 -4.317 -4.340 23.664 1.00 0.16 H ATOM 23 CZ3 TRP 1 -1.476 -4.658 21.767 1.00 -0.20 C ATOM 24 HZ3 TRP 1 -0.805 -4.056 21.169 1.00 0.14 H ATOM 25 CH2 TRP 1 -2.601 -4.051 22.401 1.00 -0.11 C ATOM 26 HH2 TRP 1 -2.770 -2.990 22.292 1.00 0.14 H ATOM 27 N GLY 2 -2.475 -9.380 20.481 1.00 -0.42 N ATOM 28 H GLY 2 -2.323 -8.509 20.976 1.00 0.27 H ATOM 29 CA GLY 2 -2.880 -9.316 19.079 1.00 -0.03 C ATOM 30 1HA GLY 2 -2.620 -8.327 18.700 1.00 0.07 H ATOM 31 2HA GLY 2 -2.280 -10.039 18.523 1.00 0.07 H ATOM 32 C GLY 2 -4.333 -9.576 18.716 1.00 0.60 C ATOM 33 O GLY 2 -4.812 -9.059 17.710 1.00 -0.57 O ATOM 34 N ARG 3 -5.066 -10.316 19.543 1.00 -0.35 N ATOM 35 H ARG 3 -4.611 -10.712 20.355 1.00 0.28 H ATOM 36 CA ARG 3 -6.473 -10.679 19.287 1.00 -0.26 C ATOM 37 HA ARG 3 -6.500 -11.187 18.322 1.00 0.16 H ATOM 38 C ARG 3 -7.436 -9.492 19.178 1.00 0.73 C ATOM 39 O ARG 3 -8.573 -9.632 18.736 1.00 -0.59 O ATOM 40 CB ARG 3 -6.927 -11.688 20.358 1.00 -0.00 C ATOM 41 1HB ARG 3 -6.086 -12.355 20.546 1.00 0.03 H ATOM 42 2HB ARG 3 -7.149 -11.159 21.281 1.00 0.03 H ATOM 43 CG ARG 3 -8.127 -12.569 19.984 1.00 0.04 C ATOM 44 1HG ARG 3 -9.046 -11.982 20.007 1.00 0.03 H ATOM 45 2HG ARG 3 -7.972 -12.940 18.971 1.00 0.03 H ATOM 46 CD ARG 3 -8.262 -13.781 20.915 1.00 0.05 C ATOM 47 1HD ARG 3 -8.945 -14.494 20.452 1.00 0.07 H ATOM 48 2HD ARG 3 -7.285 -14.257 21.006 1.00 0.07 H ATOM 49 NE ARG 3 -8.783 -13.454 22.253 1.00 -0.53 N ATOM 50 HE ARG 3 -9.484 -12.722 22.291 1.00 0.35 H ATOM 51 CZ ARG 3 -8.501 -14.078 23.391 1.00 0.81 C ATOM 52 NH1 ARG 3 -9.023 -13.637 24.500 1.00 -0.86 N ATOM 53 1HH1 ARG 3 -9.629 -12.822 24.492 1.00 0.32 H ATOM 54 2HH1 ARG 3 -8.817 -14.091 25.373 1.00 0.32 H ATOM 55 NH2 ARG 3 -7.719 -15.126 23.473 1.00 -0.86 N ATOM 56 1HH2 ARG 3 -7.317 -15.515 22.639 1.00 0.32 H ATOM 57 2HH2 ARG 3 -7.534 -15.553 24.365 1.00 0.32 H ATOM 58 N LYS 4 -6.952 -8.295 19.487 1.00 -0.35 N ATOM 59 H LYS 4 -6.003 -8.230 19.812 1.00 0.28 H ATOM 60 CA LYS 4 -7.728 -7.066 19.311 1.00 -0.24 C ATOM 61 HA LYS 4 -8.636 -7.157 19.904 1.00 0.14 H ATOM 62 C LYS 4 -8.179 -6.872 17.865 1.00 0.73 C ATOM 63 O LYS 4 -9.247 -6.322 17.641 1.00 -0.59 O ATOM 64 CB LYS 4 -6.957 -5.833 19.811 1.00 -0.01 C ATOM 65 1HB LYS 4 -7.634 -4.979 19.762 1.00 0.04 H ATOM 66 2HB LYS 4 -6.689 -5.992 20.855 1.00 0.04 H ATOM 67 CG LYS 4 -5.682 -5.475 19.033 1.00 0.02 C ATOM 68 1HG LYS 4 -4.967 -6.295 19.108 1.00 0.01 H ATOM 69 2HG LYS 4 -5.932 -5.315 17.985 1.00 0.01 H ATOM 70 CD LYS 4 -5.042 -4.197 19.573 1.00 -0.05 C ATOM 71 1HD LYS 4 -5.780 -3.393 19.543 1.00 0.06 H ATOM 72 2HD LYS 4 -4.739 -4.359 20.606 1.00 0.06 H ATOM 73 CE LYS 4 -3.823 -3.785 18.741 1.00 -0.01 C ATOM 74 1HE LYS 4 -3.087 -4.591 18.770 1.00 0.11 H ATOM 75 2HE LYS 4 -4.139 -3.645 17.704 1.00 0.11 H ATOM 76 NZ LYS 4 -3.181 -2.510 19.231 1.00 -0.38 N ATOM 77 1HZ LYS 4 -2.399 -2.266 18.635 1.00 0.17 H ATOM 78 2HZ LYS 4 -3.852 -1.753 19.213 1.00 0.17 H ATOM 79 3HZ LYS 4 -2.844 -2.633 20.176 1.00 0.17 H ATOM 80 N LYS 5 -7.440 -7.394 16.891 1.00 -0.35 N ATOM 81 H LYS 5 -6.585 -7.890 17.122 1.00 0.28 H ATOM 82 CA LYS 5 -7.822 -7.258 15.478 1.00 -0.24 C ATOM 83 HA LYS 5 -8.098 -6.214 15.313 1.00 0.14 H ATOM 84 C LYS 5 -9.046 -8.081 15.074 1.00 0.73 C ATOM 85 O LYS 5 -9.523 -7.975 13.946 1.00 -0.59 O ATOM 86 CB LYS 5 -6.626 -7.553 14.563 1.00 -0.01 C ATOM 87 1HB LYS 5 -6.885 -7.229 13.554 1.00 0.04 H ATOM 88 2HB LYS 5 -5.790 -6.940 14.902 1.00 0.04 H ATOM 89 CG LYS 5 -6.157 -9.006 14.483 1.00 0.02 C ATOM 90 1HG LYS 5 -5.938 -9.378 15.480 1.00 0.01 H ATOM 91 2HG LYS 5 -6.938 -9.620 14.035 1.00 0.01 H ATOM 92 CD LYS 5 -4.891 -9.082 13.625 1.00 -0.05 C ATOM 93 1HD LYS 5 -5.110 -8.668 12.640 1.00 0.06 H ATOM 94 2HD LYS 5 -4.113 -8.478 14.094 1.00 0.06 H ATOM 95 CE LYS 5 -4.375 -10.511 13.463 1.00 -0.01 C ATOM 96 1HE LYS 5 -4.175 -10.929 14.452 1.00 0.11 H ATOM 97 2HE LYS 5 -5.146 -11.114 12.978 1.00 0.11 H ATOM 98 NZ LYS 5 -3.112 -10.557 12.636 1.00 -0.38 N ATOM 99 1HZ LYS 5 -2.389 -10.002 13.075 1.00 0.17 H ATOM 100 2HZ LYS 5 -2.786 -11.512 12.553 1.00 0.17 H ATOM 101 3HZ LYS 5 -3.289 -10.190 11.710 1.00 0.17 H ATOM 102 N ARG 6 -9.570 -8.883 15.995 1.00 -0.35 N ATOM 103 H ARG 6 -9.120 -8.962 16.901 1.00 0.28 H ATOM 104 CA ARG 6 -10.809 -9.632 15.777 1.00 -0.26 C ATOM 105 HA ARG 6 -11.336 -9.163 14.951 1.00 0.16 H ATOM 106 C ARG 6 -11.745 -9.541 16.982 1.00 0.73 C ATOM 107 O ARG 6 -12.573 -10.424 17.193 1.00 -0.59 O ATOM 108 CB ARG 6 -10.484 -11.083 15.374 1.00 -0.00 C ATOM 109 1HB ARG 6 -11.408 -11.568 15.066 1.00 0.03 H ATOM 110 2HB ARG 6 -9.824 -11.044 14.508 1.00 0.03 H ATOM 111 CG ARG 6 -9.813 -11.954 16.447 1.00 0.04 C ATOM 112 1HG ARG 6 -8.990 -11.402 16.897 1.00 0.03 H ATOM 113 2HG ARG 6 -10.541 -12.189 17.222 1.00 0.03 H ATOM 114 CD ARG 6 -9.247 -13.255 15.871 1.00 0.05 C ATOM 115 1HD ARG 6 -8.460 -13.000 15.159 1.00 0.07 H ATOM 116 2HD ARG 6 -8.803 -13.831 16.685 1.00 0.07 H ATOM 117 NE ARG 6 -10.249 -14.081 15.178 1.00 -0.53 N ATOM 118 HE ARG 6 -11.182 -13.704 15.134 1.00 0.35 H ATOM 119 CZ ARG 6 -10.036 -15.260 14.601 1.00 0.81 C ATOM 120 NH1 ARG 6 -11.016 -15.831 13.955 1.00 -0.86 N ATOM 121 1HH1 ARG 6 -11.914 -15.386 13.884 1.00 0.32 H ATOM 122 2HH1 ARG 6 -10.870 -16.725 13.512 1.00 0.32 H ATOM 123 NH2 ARG 6 -8.889 -15.892 14.636 1.00 -0.86 N ATOM 124 1HH2 ARG 6 -8.113 -15.496 15.136 1.00 0.32 H ATOM 125 2HH2 ARG 6 -8.781 -16.779 14.171 1.00 0.32 H ATOM 126 N ARG 7 -11.613 -8.484 17.779 1.00 -0.35 N ATOM 127 H ARG 7 -10.963 -7.746 17.531 1.00 0.28 H ATOM 128 CA ARG 7 -12.338 -8.383 19.058 1.00 -0.26 C ATOM 129 HA ARG 7 -12.110 -9.287 19.627 1.00 0.16 H ATOM 130 C ARG 7 -13.861 -8.333 18.995 1.00 0.73 C ATOM 131 O ARG 7 -14.514 -8.565 19.995 1.00 -0.59 O ATOM 132 CB ARG 7 -11.858 -7.183 19.893 1.00 -0.00 C ATOM 133 1HB ARG 7 -12.305 -7.282 20.876 1.00 0.03 H ATOM 134 2HB ARG 7 -10.779 -7.248 20.017 1.00 0.03 H ATOM 135 CG ARG 7 -12.212 -5.780 19.374 1.00 0.04 C ATOM 136 1HG ARG 7 -11.431 -5.435 18.700 1.00 0.03 H ATOM 137 2HG ARG 7 -13.150 -5.813 18.825 1.00 0.03 H ATOM 138 CD ARG 7 -12.380 -4.774 20.523 1.00 0.05 C ATOM 139 1HD ARG 7 -12.655 -3.805 20.103 1.00 0.07 H ATOM 140 2HD ARG 7 -13.203 -5.114 21.152 1.00 0.07 H ATOM 141 NE ARG 7 -11.167 -4.617 21.344 1.00 -0.53 N ATOM 142 HE ARG 7 -10.340 -4.319 20.859 1.00 0.35 H ATOM 143 CZ ARG 7 -11.059 -4.852 22.648 1.00 0.81 C ATOM 144 NH1 ARG 7 -9.877 -4.840 23.191 1.00 -0.86 N ATOM 145 1HH1 ARG 7 -9.072 -4.531 22.692 1.00 0.32 H ATOM 146 2HH1 ARG 7 -9.800 -5.166 24.158 1.00 0.32 H ATOM 147 NH2 ARG 7 -12.063 -5.116 23.441 1.00 -0.86 N ATOM 148 1HH2 ARG 7 -13.007 -5.058 23.112 1.00 0.32 H ATOM 149 2HH2 ARG 7 -11.868 -5.394 24.403 1.00 0.32 H ATOM 150 N GLN 8 -14.426 -8.014 17.842 1.00 -0.42 N ATOM 151 H GLN 8 -13.851 -7.822 17.037 1.00 0.27 H ATOM 152 CA GLN 8 -15.881 -7.925 17.701 1.00 -0.00 C ATOM 153 HA GLN 8 -16.342 -7.941 18.688 1.00 0.09 H ATOM 154 C GLN 8 -16.424 -9.141 16.950 1.00 0.60 C ATOM 155 O GLN 8 -17.592 -9.185 16.586 1.00 -0.57 O ATOM 156 CB GLN 8 -16.287 -6.597 17.036 1.00 -0.00 C ATOM 157 1HB GLN 8 -17.323 -6.673 16.707 1.00 0.02 H ATOM 158 2HB GLN 8 -16.245 -5.818 17.797 1.00 0.02 H ATOM 159 CG GLN 8 -15.431 -6.127 15.857 1.00 -0.06 C ATOM 160 1HG GLN 8 -15.871 -5.219 15.445 1.00 0.04 H ATOM 161 2HG GLN 8 -14.430 -5.885 16.214 1.00 0.04 H ATOM 162 CD GLN 8 -15.309 -7.154 14.759 1.00 0.69 C ATOM 163 OE1 GLN 8 -14.293 -7.838 14.661 1.00 -0.61 O ATOM 164 NE2 GLN 8 -16.319 -7.290 13.944 1.00 -0.94 N ATOM 165 1HE2 GLN 8 -16.270 -7.965 13.203 1.00 0.43 H ATOM 166 2HE2 GLN 8 -17.151 -6.736 14.076 1.00 0.43 H ATOM 167 N ARG 9 -15.565 -10.123 16.697 1.00 -0.35 N ATOM 168 H ARG 9 -14.604 -10.024 16.996 1.00 0.28 H ATOM 169 CA ARG 9 -15.984 -11.349 16.003 1.00 -0.26 C ATOM 170 HA ARG 9 -17.070 -11.415 16.092 1.00 0.16 H ATOM 171 C ARG 9 -15.463 -12.639 16.624 1.00 0.73 C ATOM 172 O ARG 9 -15.884 -13.725 16.230 1.00 -0.59 O ATOM 173 CB ARG 9 -15.692 -11.239 14.498 1.00 -0.00 C ATOM 174 1HB ARG 9 -16.149 -12.088 13.989 1.00 0.03 H ATOM 175 2HB ARG 9 -16.192 -10.337 14.145 1.00 0.03 H ATOM 176 CG ARG 9 -14.229 -11.147 14.070 1.00 0.04 C ATOM 177 1HG ARG 9 -13.715 -10.412 14.684 1.00 0.03 H ATOM 178 2HG ARG 9 -13.749 -12.118 14.184 1.00 0.03 H ATOM 179 CD ARG 9 -14.172 -10.695 12.604 1.00 0.05 C ATOM 180 1HD ARG 9 -14.750 -11.401 12.006 1.00 0.07 H ATOM 181 2HD ARG 9 -14.653 -9.718 12.523 1.00 0.07 H ATOM 182 NE ARG 9 -12.813 -10.604 12.042 1.00 -0.53 N ATOM 183 HE ARG 9 -12.497 -11.401 11.517 1.00 0.35 H ATOM 184 CZ ARG 9 -11.994 -9.560 12.111 1.00 0.81 C ATOM 185 NH1 ARG 9 -10.825 -9.638 11.540 1.00 -0.86 N ATOM 186 1HH1 ARG 9 -10.582 -10.428 10.973 1.00 0.32 H ATOM 187 2HH1 ARG 9 -10.170 -8.880 11.665 1.00 0.32 H ATOM 188 NH2 ARG 9 -12.265 -8.444 12.730 1.00 -0.86 N ATOM 189 1HH2 ARG 9 -13.155 -8.319 13.204 1.00 0.32 H ATOM 190 2HH2 ARG 9 -11.573 -7.712 12.769 1.00 0.32 H ATOM 191 N ARG 10 -14.617 -12.533 17.640 1.00 -0.35 N ATOM 192 H ARG 10 -14.232 -11.620 17.877 1.00 0.28 H ATOM 193 CA ARG 10 -14.281 -13.616 18.573 1.00 -0.26 C ATOM 194 HA ARG 10 -15.127 -14.287 18.713 1.00 0.16 H ATOM 195 C ARG 10 -14.037 -12.843 19.860 1.00 0.73 C ATOM 196 O ARG 10 -13.916 -11.626 19.799 1.00 -0.59 O ATOM 197 CB ARG 10 -13.012 -14.397 18.183 1.00 -0.00 C ATOM 198 1HB ARG 10 -12.245 -13.673 17.909 1.00 0.03 H ATOM 199 2HB ARG 10 -12.655 -14.932 19.063 1.00 0.03 H ATOM 200 CG ARG 10 -13.133 -15.430 17.047 1.00 0.04 C ATOM 201 1HG ARG 10 -13.496 -14.939 16.145 1.00 0.03 H ATOM 202 2HG ARG 10 -12.133 -15.813 16.844 1.00 0.03 H ATOM 203 CD ARG 10 -14.038 -16.638 17.369 1.00 0.05 C ATOM 204 1HD ARG 10 -13.703 -17.487 16.772 1.00 0.07 H ATOM 205 2HD ARG 10 -13.937 -16.893 18.425 1.00 0.07 H ATOM 206 NE ARG 10 -15.449 -16.374 17.053 1.00 -0.53 N ATOM 207 HE ARG 10 -15.659 -15.450 16.677 1.00 0.35 H ATOM 208 CZ ARG 10 -16.479 -17.194 17.208 1.00 0.81 C ATOM 209 NH1 ARG 10 -17.663 -16.752 16.890 1.00 -0.86 N ATOM 210 1HH1 ARG 10 -17.771 -15.811 16.540 1.00 0.32 H ATOM 211 2HH1 ARG 10 -18.470 -17.343 16.985 1.00 0.32 H ATOM 212 NH2 ARG 10 -16.377 -18.417 17.664 1.00 -0.86 N ATOM 213 1HH2 ARG 10 -15.475 -18.787 17.904 1.00 0.32 H ATOM 214 2HH2 ARG 10 -17.199 -18.990 17.764 1.00 0.32 H ATOM 215 N ARG 11 -13.955 -13.542 20.985 1.00 -0.35 N ATOM 216 H ARG 11 -14.040 -14.543 20.938 1.00 0.28 H ATOM 217 CA ARG 11 -13.747 -12.933 22.306 1.00 -0.26 C ATOM 218 HA ARG 11 -14.647 -12.381 22.562 1.00 0.16 H ATOM 219 C ARG 11 -12.546 -11.965 22.307 1.00 0.73 C ATOM 220 O ARG 11 -11.442 -12.361 21.915 1.00 -0.59 O ATOM 221 CB ARG 11 -13.565 -14.078 23.326 1.00 -0.00 C ATOM 222 1HB ARG 11 -14.530 -14.566 23.461 1.00 0.03 H ATOM 223 2HB ARG 11 -12.892 -14.809 22.875 1.00 0.03 H ATOM 224 CG ARG 11 -12.989 -13.749 24.715 1.00 0.04 C ATOM 225 1HG ARG 11 -12.825 -14.685 25.249 1.00 0.03 H ATOM 226 2HG ARG 11 -12.017 -13.282 24.579 1.00 0.03 H ATOM 227 CD ARG 11 -13.843 -12.838 25.596 1.00 0.05 C ATOM 228 1HD ARG 11 -14.649 -12.405 25.004 1.00 0.07 H ATOM 229 2HD ARG 11 -14.270 -13.418 26.416 1.00 0.07 H ATOM 230 NE ARG 11 -12.988 -11.767 26.129 1.00 -0.53 N ATOM 231 HE ARG 11 -12.000 -11.832 25.918 1.00 0.35 H ATOM 232 CZ ARG 11 -13.366 -10.687 26.798 1.00 0.81 C ATOM 233 NH1 ARG 11 -12.441 -9.837 27.121 1.00 -0.86 N ATOM 234 1HH1 ARG 11 -11.472 -10.056 26.957 1.00 0.32 H ATOM 235 2HH1 ARG 11 -12.673 -8.923 27.500 1.00 0.32 H ATOM 236 NH2 ARG 11 -14.603 -10.409 27.118 1.00 -0.86 N ATOM 237 1HH2 ARG 11 -15.338 -11.050 26.885 1.00 0.32 H ATOM 238 2HH2 ARG 11 -14.810 -9.551 27.602 1.00 0.32 H ATOM 239 N PRO 12 -12.728 -10.710 22.766 1.00 -0.25 N ATOM 240 CA PRO 12 -11.576 -9.801 22.860 1.00 -0.03 C ATOM 241 HA PRO 12 -11.226 -9.546 21.861 1.00 0.06 H ATOM 242 C PRO 12 -10.405 -10.279 23.724 1.00 0.59 C ATOM 243 O PRO 12 -10.580 -11.142 24.592 1.00 -0.57 O ATOM 244 CB PRO 12 -12.173 -8.580 23.557 1.00 -0.01 C ATOM 245 1HB PRO 12 -12.019 -8.662 24.630 1.00 0.03 H ATOM 246 2HB PRO 12 -11.714 -7.672 23.180 1.00 0.03 H ATOM 247 CG PRO 12 -13.585 -8.596 23.264 1.00 0.02 C ATOM 248 1HG PRO 12 -14.146 -8.074 24.039 1.00 0.02 H ATOM 249 2HG PRO 12 -13.764 -8.129 22.302 1.00 0.02 H ATOM 250 CD PRO 12 -13.965 -10.034 23.210 1.00 0.02 C ATOM 251 1HD PRO 12 -14.263 -10.382 24.196 1.00 0.04 H ATOM 252 2HD PRO 12 -14.771 -10.180 22.489 1.00 0.04 H ATOM 253 N PRO 13 -9.196 -9.713 23.528 1.00 -0.25 N ATOM 254 CA PRO 13 -8.119 -10.089 24.458 1.00 -0.03 C ATOM 255 HA PRO 13 -8.001 -11.169 24.488 1.00 0.06 H ATOM 256 C PRO 13 -8.367 -9.582 25.881 1.00 0.59 C ATOM 257 O PRO 13 -8.080 -10.283 26.842 1.00 -0.57 O ATOM 258 CB PRO 13 -6.880 -9.453 23.825 1.00 -0.01 C ATOM 259 1HB PRO 13 -6.159 -9.160 24.588 1.00 0.03 H ATOM 260 2HB PRO 13 -6.426 -10.148 23.123 1.00 0.03 H ATOM 261 CG PRO 13 -7.407 -8.271 23.091 1.00 0.02 C ATOM 262 1HG PRO 13 -7.571 -7.443 23.778 1.00 0.02 H ATOM 263 2HG PRO 13 -6.725 -7.973 22.298 1.00 0.02 H ATOM 264 CD PRO 13 -8.728 -8.729 22.533 1.00 0.02 C ATOM 265 1HD PRO 13 -9.417 -7.888 22.452 1.00 0.04 H ATOM 266 2HD PRO 13 -8.594 -9.214 21.568 1.00 0.04 H ATOM 267 N GLN 14 -8.986 -8.414 25.989 1.00 -0.42 N ATOM 268 H GLN 14 -9.119 -7.834 25.167 1.00 0.27 H ATOM 269 CA GLN 14 -9.623 -7.889 27.188 1.00 -0.00 C ATOM 270 HA GLN 14 -10.095 -8.680 27.764 1.00 0.09 H ATOM 271 C GLN 14 -10.681 -7.040 26.501 1.00 0.60 C ATOM 272 O GLN 14 -11.833 -6.969 26.955 1.00 -0.57 O ATOM 273 OXT GLN 14 -10.339 -6.577 25.384 1.00 -0.57 O ATOM 274 CB GLN 14 -8.692 -7.068 28.096 1.00 -0.00 C ATOM 275 1HB GLN 14 -9.326 -6.509 28.785 1.00 0.02 H ATOM 276 2HB GLN 14 -8.103 -7.763 28.693 1.00 0.02 H ATOM 277 CG GLN 14 -7.738 -6.067 27.420 1.00 -0.06 C ATOM 278 1HG GLN 14 -8.255 -5.565 26.604 1.00 0.04 H ATOM 279 2HG GLN 14 -7.460 -5.314 28.157 1.00 0.04 H ATOM 280 CD GLN 14 -6.457 -6.694 26.893 1.00 0.69 C ATOM 281 OE1 GLN 14 -6.147 -6.622 25.707 1.00 -0.61 O ATOM 282 NE2 GLN 14 -5.688 -7.296 27.764 1.00 -0.94 N ATOM 283 1HE2 GLN 14 -4.817 -7.686 27.462 1.00 0.43 H ATOM 284 2HE2 GLN 14 -5.975 -7.352 28.728 1.00 0.43 H TER 285 GLN 14 END
SEQUENCE	WGRKKRRQRRRPPQ
HELICITY	0.00	INSTAB. INDEX	202.94	FLEXIBILITY	6.86
a HYD. MOM.	27.42	b HYD. MOM.	7.35	c HYD. MOM	4.32
a MEAN HYD. MOM.	1.96	b MEAN HYD. MOM.	0.52	c MEAN HYD. MOM.	0.31
CHARGE pH5	8.00	CHARGE pH7	8.00	CHARGE pH9	7.77
Δ CHARGE pH5-pH9	0.24	ISOELECTRIC POINT	12.70	BOMAN INDEX	7.75
ΔG	17	CPP	1	MLP	-13,00
MOLECULAR VOLUME		POLARITY
MIC E. coli	256	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	Synthetic	CLASS	Synthetic	ORDER	Synthetic
FAMILY	Synthetic	GENUS	Synthetic	SPECIES	Synthetic
DATE	2013
TITLE PAPER	Antimicrobial and cell-penetrating properties of penetratin analogs: Effect of sequence and secondary structure