ATOM 1 N GLY A 1 2.215 4.748 6.196 1.00 0.00 N1+ ATOM 2 CA GLY A 1 0.945 4.316 5.547 1.00 0.00 C ATOM 3 C GLY A 1 1.160 2.982 4.842 1.00 0.00 C ATOM 4 O GLY A 1 2.288 2.620 4.507 1.00 0.00 O ATOM 5 H1 GLY A 1 2.217 4.445 7.190 1.00 0.00 H ATOM 6 H2 GLY A 1 2.294 5.784 6.148 1.00 0.00 H ATOM 7 H3 GLY A 1 3.021 4.314 5.702 1.00 0.00 H ATOM 8 HA2 GLY A 1 0.176 4.207 6.300 1.00 0.00 H ATOM 9 HA3 GLY A 1 0.639 5.056 4.824 1.00 0.00 H ATOM 10 N CYS A 2 0.071 2.254 4.618 1.00 0.00 N ATOM 11 CA CYS A 2 0.158 0.959 3.953 1.00 0.00 C ATOM 12 C CYS A 2 0.625 1.142 2.513 1.00 0.00 C ATOM 13 O CYS A 2 1.306 0.284 1.952 1.00 0.00 O ATOM 14 CB CYS A 2 -1.214 0.279 3.955 1.00 0.00 C ATOM 15 SG CYS A 2 -2.243 0.983 2.635 1.00 0.00 S ATOM 16 H CYS A 2 -0.802 2.592 4.907 1.00 0.00 H ATOM 17 HA CYS A 2 0.862 0.333 4.482 1.00 0.00 H ATOM 18 HB2 CYS A 2 -1.093 -0.781 3.792 1.00 0.00 H ATOM 19 HB3 CYS A 2 -1.692 0.439 4.910 1.00 0.00 H HETATM 20 N ABA A 3 0.258 2.277 1.927 1.00 0.00 N HETATM 21 CA ABA A 3 0.640 2.573 0.553 1.00 0.00 C HETATM 22 C ABA A 3 2.144 2.428 0.369 1.00 0.00 C HETATM 23 O ABA A 3 2.614 2.061 -0.708 1.00 0.00 O HETATM 24 CB ABA A 3 0.221 3.999 0.186 1.00 0.00 C HETATM 25 CG ABA A 3 -1.209 4.006 -0.173 1.00 0.00 C HETATM 26 H ABA A 3 -0.280 2.926 2.427 1.00 0.00 H HETATM 27 HA ABA A 3 0.138 1.879 -0.099 1.00 0.00 H HETATM 28 HB3 ABA A 3 0.811 4.346 -0.641 1.00 0.00 H HETATM 29 HB2 ABA A 3 0.396 4.654 1.027 1.00 0.00 H HETATM 30 HG1 ABA A 3 -1.944 4.170 0.601 1.00 0.00 H ATOM 31 N SER A 4 2.891 2.718 1.426 1.00 0.00 N ATOM 32 CA SER A 4 4.342 2.617 1.369 1.00 0.00 C ATOM 33 C SER A 4 4.766 1.185 1.067 1.00 0.00 C ATOM 34 O SER A 4 5.710 0.957 0.310 1.00 0.00 O ATOM 35 CB SER A 4 4.949 3.061 2.700 1.00 0.00 C ATOM 36 OG SER A 4 4.675 4.440 2.904 1.00 0.00 O ATOM 37 H SER A 4 2.459 3.005 2.258 1.00 0.00 H ATOM 38 HA SER A 4 4.708 3.265 0.586 1.00 0.00 H ATOM 39 HB2 SER A 4 4.515 2.490 3.505 1.00 0.00 H ATOM 40 HB3 SER A 4 6.018 2.894 2.680 1.00 0.00 H ATOM 41 HG SER A 4 3.979 4.698 2.295 1.00 0.00 H ATOM 42 N ASP A 5 4.064 0.225 1.664 1.00 0.00 N ATOM 43 CA ASP A 5 4.377 -1.181 1.451 1.00 0.00 C ATOM 44 C ASP A 5 3.310 -1.868 0.575 1.00 0.00 C ATOM 45 O ASP A 5 2.126 -1.534 0.653 1.00 0.00 O ATOM 46 CB ASP A 5 4.469 -1.899 2.799 1.00 0.00 C ATOM 47 CG ASP A 5 5.654 -1.364 3.596 1.00 0.00 C ATOM 48 OD1 ASP A 5 6.459 -0.653 3.017 1.00 0.00 O ATOM 49 OD2 ASP A 5 5.741 -1.676 4.772 1.00 0.00 O ATOM 50 H ASP A 5 3.322 0.468 2.256 1.00 0.00 H ATOM 51 HA ASP A 5 5.331 -1.238 0.965 1.00 0.00 H ATOM 52 HB2 ASP A 5 3.559 -1.732 3.357 1.00 0.00 H ATOM 53 HB3 ASP A 5 4.597 -2.955 2.632 1.00 0.00 H ATOM 54 N PRO A 6 3.711 -2.825 -0.252 1.00 0.00 N ATOM 55 CA PRO A 6 2.784 -3.574 -1.154 1.00 0.00 C ATOM 56 C PRO A 6 1.847 -4.486 -0.372 1.00 0.00 C ATOM 57 O PRO A 6 0.886 -5.025 -0.922 1.00 0.00 O ATOM 58 CB PRO A 6 3.709 -4.388 -2.054 1.00 0.00 C ATOM 59 CG PRO A 6 4.987 -4.524 -1.294 1.00 0.00 C ATOM 60 CD PRO A 6 5.100 -3.288 -0.416 1.00 0.00 C ATOM 61 HA PRO A 6 2.213 -2.885 -1.754 1.00 0.00 H ATOM 62 HB2 PRO A 6 3.284 -5.366 -2.242 1.00 0.00 H ATOM 63 HB3 PRO A 6 3.886 -3.869 -2.983 1.00 0.00 H ATOM 64 HG2 PRO A 6 4.963 -5.417 -0.683 1.00 0.00 H ATOM 65 HG3 PRO A 6 5.824 -4.562 -1.972 1.00 0.00 H ATOM 66 HD2 PRO A 6 5.530 -3.549 0.542 1.00 0.00 H ATOM 67 HD3 PRO A 6 5.689 -2.530 -0.908 1.00 0.00 H ATOM 68 N ARG A 7 2.136 -4.657 0.912 1.00 0.00 N ATOM 69 CA ARG A 7 1.317 -5.508 1.761 1.00 0.00 C ATOM 70 C ARG A 7 -0.090 -4.931 1.896 1.00 0.00 C ATOM 71 O ARG A 7 -1.034 -5.649 2.221 1.00 0.00 O ATOM 72 CB ARG A 7 1.953 -5.633 3.147 1.00 0.00 C ATOM 73 CG ARG A 7 3.248 -6.442 3.041 1.00 0.00 C ATOM 74 CD ARG A 7 3.994 -6.381 4.375 1.00 0.00 C ATOM 75 NE ARG A 7 3.192 -6.985 5.431 1.00 0.00 N ATOM 76 CZ ARG A 7 3.527 -6.850 6.710 1.00 0.00 C ATOM 77 NH1 ARG A 7 4.589 -6.165 7.038 1.00 0.00 N ATOM 78 NH2 ARG A 7 2.792 -7.399 7.638 1.00 0.00 N ATOM 79 H ARG A 7 2.914 -4.203 1.298 1.00 0.00 H ATOM 80 HA ARG A 7 1.255 -6.489 1.315 1.00 0.00 H ATOM 81 HB2 ARG A 7 2.171 -4.648 3.533 1.00 0.00 H ATOM 82 HB3 ARG A 7 1.268 -6.138 3.811 1.00 0.00 H ATOM 83 HG2 ARG A 7 3.011 -7.470 2.806 1.00 0.00 H ATOM 84 HG3 ARG A 7 3.869 -6.027 2.262 1.00 0.00 H ATOM 85 HD2 ARG A 7 4.927 -6.916 4.286 1.00 0.00 H ATOM 86 HD3 ARG A 7 4.198 -5.349 4.622 1.00 0.00 H ATOM 87 HE ARG A 7 2.393 -7.499 5.193 1.00 0.00 H ATOM 88 HH11 ARG A 7 5.151 -5.744 6.327 1.00 0.00 H ATOM 89 HH12 ARG A 7 4.840 -6.063 8.000 1.00 0.00 H ATOM 90 HH21 ARG A 7 1.978 -7.924 7.387 1.00 0.00 H ATOM 91 HH22 ARG A 7 3.044 -7.297 8.600 1.00 0.00 H ATOM 92 N CYS A 8 -0.220 -3.629 1.644 1.00 0.00 N ATOM 93 CA CYS A 8 -1.516 -2.966 1.744 1.00 0.00 C ATOM 94 C CYS A 8 -2.584 -3.744 0.979 1.00 0.00 C ATOM 95 O CYS A 8 -2.287 -4.463 0.025 1.00 0.00 O ATOM 96 CB CYS A 8 -1.427 -1.551 1.175 1.00 0.00 C ATOM 97 SG CYS A 8 -2.925 -0.628 1.613 1.00 0.00 S ATOM 98 H CYS A 8 0.570 -3.103 1.387 1.00 0.00 H ATOM 99 HA CYS A 8 -1.800 -2.902 2.784 1.00 0.00 H ATOM 100 HB2 CYS A 8 -0.565 -1.049 1.581 1.00 0.00 H ATOM 101 HB3 CYS A 8 -1.334 -1.604 0.100 1.00 0.00 H ATOM 102 N ARG A 9 -3.832 -3.597 1.412 1.00 0.00 N ATOM 103 CA ARG A 9 -4.945 -4.289 0.768 1.00 0.00 C ATOM 104 C ARG A 9 -5.066 -3.857 -0.692 1.00 0.00 C ATOM 105 O ARG A 9 -5.395 -4.664 -1.561 1.00 0.00 O ATOM 106 CB ARG A 9 -6.251 -3.978 1.502 1.00 0.00 C ATOM 107 CG ARG A 9 -6.232 -4.641 2.880 1.00 0.00 C ATOM 108 CD ARG A 9 -7.458 -4.194 3.679 1.00 0.00 C ATOM 109 NE ARG A 9 -7.379 -2.767 3.968 1.00 0.00 N ATOM 110 CZ ARG A 9 -8.373 -2.136 4.584 1.00 0.00 C ATOM 111 NH1 ARG A 9 -9.443 -2.793 4.941 1.00 0.00 N ATOM 112 NH2 ARG A 9 -8.280 -0.857 4.832 1.00 0.00 N ATOM 113 H ARG A 9 -4.006 -3.020 2.184 1.00 0.00 H ATOM 114 HA ARG A 9 -4.769 -5.354 0.805 1.00 0.00 H ATOM 115 HB2 ARG A 9 -6.352 -2.908 1.618 1.00 0.00 H ATOM 116 HB3 ARG A 9 -7.085 -4.359 0.932 1.00 0.00 H ATOM 117 HG2 ARG A 9 -6.250 -5.716 2.763 1.00 0.00 H ATOM 118 HG3 ARG A 9 -5.336 -4.352 3.408 1.00 0.00 H ATOM 119 HD2 ARG A 9 -8.350 -4.392 3.104 1.00 0.00 H ATOM 120 HD3 ARG A 9 -7.501 -4.748 4.606 1.00 0.00 H ATOM 121 HE ARG A 9 -6.580 -2.266 3.706 1.00 0.00 H ATOM 122 HH11 ARG A 9 -9.515 -3.772 4.750 1.00 0.00 H ATOM 123 HH12 ARG A 9 -10.191 -2.317 5.404 1.00 0.00 H ATOM 124 HH21 ARG A 9 -7.460 -0.354 4.560 1.00 0.00 H ATOM 125 HH22 ARG A 9 -9.028 -0.382 5.295 1.00 0.00 H ATOM 126 N TYR A 10 -4.799 -2.580 -0.954 1.00 0.00 N ATOM 127 CA TYR A 10 -4.883 -2.053 -2.315 1.00 0.00 C ATOM 128 C TYR A 10 -3.604 -1.307 -2.683 1.00 0.00 C ATOM 129 O TYR A 10 -2.890 -0.813 -1.809 1.00 0.00 O ATOM 130 CB TYR A 10 -6.078 -1.107 -2.431 1.00 0.00 C ATOM 131 CG TYR A 10 -5.834 0.120 -1.586 1.00 0.00 C ATOM 132 CD1 TYR A 10 -6.068 0.077 -0.206 1.00 0.00 C ATOM 133 CD2 TYR A 10 -5.373 1.301 -2.181 1.00 0.00 C ATOM 134 CE1 TYR A 10 -5.841 1.215 0.578 1.00 0.00 C ATOM 135 CE2 TYR A 10 -5.146 2.439 -1.396 1.00 0.00 C ATOM 136 CZ TYR A 10 -5.381 2.395 -0.016 1.00 0.00 C ATOM 137 OH TYR A 10 -5.157 3.516 0.757 1.00 0.00 O ATOM 138 H TYR A 10 -4.541 -1.985 -0.221 1.00 0.00 H ATOM 139 HA TYR A 10 -5.019 -2.872 -3.004 1.00 0.00 H ATOM 140 HB2 TYR A 10 -6.204 -0.813 -3.462 1.00 0.00 H ATOM 141 HB3 TYR A 10 -6.971 -1.609 -2.087 1.00 0.00 H ATOM 142 HD1 TYR A 10 -6.422 -0.834 0.253 1.00 0.00 H ATOM 143 HD2 TYR A 10 -5.193 1.333 -3.244 1.00 0.00 H ATOM 144 HE1 TYR A 10 -6.022 1.181 1.643 1.00 0.00 H ATOM 145 HE2 TYR A 10 -4.791 3.349 -1.855 1.00 0.00 H ATOM 146 HH TYR A 10 -4.731 3.235 1.569 1.00 0.00 H ATOM 147 N ARG A 11 -3.322 -1.230 -3.982 1.00 0.00 N ATOM 148 CA ARG A 11 -2.125 -0.544 -4.454 1.00 0.00 C ATOM 149 C ARG A 11 -2.307 0.968 -4.382 1.00 0.00 C ATOM 150 O ARG A 11 -3.362 1.495 -4.737 1.00 0.00 O ATOM 151 CB ARG A 11 -1.821 -0.954 -5.898 1.00 0.00 C ATOM 152 CG ARG A 11 -1.037 -2.269 -5.904 1.00 0.00 C ATOM 153 CD ARG A 11 -1.881 -3.369 -5.260 1.00 0.00 C ATOM 154 NE ARG A 11 -1.284 -4.676 -5.512 1.00 0.00 N ATOM 155 CZ ARG A 11 -1.794 -5.780 -4.975 1.00 0.00 C ATOM 156 NH1 ARG A 11 -2.847 -5.705 -4.206 1.00 0.00 N ATOM 157 NH2 ARG A 11 -1.243 -6.938 -5.216 1.00 0.00 N ATOM 158 H ARG A 11 -3.927 -1.641 -4.632 1.00 0.00 H ATOM 159 HA ARG A 11 -1.292 -0.828 -3.828 1.00 0.00 H ATOM 160 HB2 ARG A 11 -2.748 -1.084 -6.437 1.00 0.00 H ATOM 161 HB3 ARG A 11 -1.233 -0.185 -6.374 1.00 0.00 H ATOM 162 HG2 ARG A 11 -0.804 -2.544 -6.923 1.00 0.00 H ATOM 163 HG3 ARG A 11 -0.120 -2.146 -5.347 1.00 0.00 H ATOM 164 HD2 ARG A 11 -1.932 -3.202 -4.195 1.00 0.00 H ATOM 165 HD3 ARG A 11 -2.878 -3.343 -5.673 1.00 0.00 H ATOM 166 HE ARG A 11 -0.494 -4.742 -6.088 1.00 0.00 H ATOM 167 HH11 ARG A 11 -3.269 -4.818 -4.022 1.00 0.00 H ATOM 168 HH12 ARG A 11 -3.231 -6.535 -3.803 1.00 0.00 H ATOM 169 HH21 ARG A 11 -0.436 -6.994 -5.804 1.00 0.00 H ATOM 170 HH22 ARG A 11 -1.627 -7.768 -4.811 1.00 0.00 H HETATM 171 N ABA A 12 -1.273 1.661 -3.924 1.00 0.00 N HETATM 172 CA ABA A 12 -1.331 3.113 -3.813 1.00 0.00 C HETATM 173 C ABA A 12 -0.665 3.770 -5.018 1.00 0.00 C HETATM 174 O ABA A 12 -0.483 4.987 -5.052 1.00 0.00 O HETATM 175 CB ABA A 12 -0.630 3.563 -2.532 1.00 0.00 C HETATM 176 CG ABA A 12 -1.613 3.799 -1.461 1.00 0.00 C HETATM 177 H ABA A 12 -0.458 1.188 -3.655 1.00 0.00 H HETATM 178 HA ABA A 12 -2.364 3.421 -3.775 1.00 0.00 H HETATM 179 HB3 ABA A 12 -0.090 4.478 -2.732 1.00 0.00 H HETATM 180 HB2 ABA A 12 0.058 2.796 -2.220 1.00 0.00 H HETATM 181 HG1 ABA A 12 -2.665 3.805 -1.703 1.00 0.00 H ATOM 182 N ARG A 13 -0.305 2.956 -6.003 1.00 0.00 N ATOM 183 CA ARG A 13 0.339 3.470 -7.207 1.00 0.00 C ATOM 184 C ARG A 13 0.135 2.502 -8.369 1.00 0.00 C ATOM 185 O ARG A 13 0.726 1.436 -8.335 1.00 0.00 O ATOM 186 CB ARG A 13 1.846 3.680 -6.960 1.00 0.00 C ATOM 187 CG ARG A 13 2.578 3.924 -8.296 1.00 0.00 C ATOM 188 CD ARG A 13 1.917 5.090 -9.037 1.00 0.00 C ATOM 189 NE ARG A 13 2.770 5.550 -10.127 1.00 0.00 N ATOM 190 CZ ARG A 13 2.333 6.440 -11.012 1.00 0.00 C ATOM 191 NH1 ARG A 13 1.121 6.915 -10.917 1.00 0.00 N ATOM 192 NH2 ARG A 13 3.116 6.840 -11.976 1.00 0.00 N ATOM 193 OXT ARG A 13 -0.601 2.844 -9.281 1.00 0.00 O ATOM 194 H ARG A 13 -0.475 1.996 -5.922 1.00 0.00 H ATOM 195 HA ARG A 13 -0.105 4.421 -7.458 1.00 0.00 H ATOM 196 HB2 ARG A 13 1.988 4.535 -6.314 1.00 0.00 H ATOM 197 HB3 ARG A 13 2.254 2.799 -6.488 1.00 0.00 H ATOM 198 HG2 ARG A 13 3.615 4.163 -8.106 1.00 0.00 H ATOM 199 HG3 ARG A 13 2.529 3.036 -8.904 1.00 0.00 H ATOM 200 HD2 ARG A 13 0.976 4.762 -9.448 1.00 0.00 H ATOM 201 HD3 ARG A 13 1.745 5.900 -8.344 1.00 0.00 H ATOM 202 HE ARG A 13 3.682 5.200 -10.206 1.00 0.00 H ATOM 203 HH11 ARG A 13 0.521 6.608 -10.178 1.00 0.00 H ATOM 204 HH12 ARG A 13 0.793 7.585 -11.582 1.00 0.00 H ATOM 205 HH21 ARG A 13 4.046 6.477 -12.049 1.00 0.00 H ATOM 206 HH22 ARG A 13 2.788 7.510 -12.642 1.00 0.00 H TER 207 ARG A 13