ATOM 1 N GLY A 1 2.754 5.896 4.612 1.00 0.00 N1+ ATOM 2 CA GLY A 1 1.422 5.405 4.157 1.00 0.00 C ATOM 3 C GLY A 1 1.489 3.904 3.897 1.00 0.00 C ATOM 4 O GLY A 1 2.510 3.388 3.445 1.00 0.00 O ATOM 5 H1 GLY A 1 3.103 6.617 3.949 1.00 0.00 H ATOM 6 H2 GLY A 1 3.424 5.100 4.646 1.00 0.00 H ATOM 7 H3 GLY A 1 2.664 6.313 5.560 1.00 0.00 H ATOM 8 HA2 GLY A 1 0.684 5.607 4.921 1.00 0.00 H ATOM 9 HA3 GLY A 1 1.145 5.912 3.245 1.00 0.00 H ATOM 10 N CYS A 2 0.393 3.210 4.177 1.00 0.00 N ATOM 11 CA CYS A 2 0.338 1.768 3.963 1.00 0.00 C ATOM 12 C CYS A 2 0.575 1.411 2.502 1.00 0.00 C ATOM 13 O CYS A 2 1.365 0.520 2.193 1.00 0.00 O ATOM 14 CB CYS A 2 -1.022 1.229 4.397 1.00 0.00 C ATOM 15 SG CYS A 2 -1.137 -0.524 3.965 1.00 0.00 S ATOM 16 H CYS A 2 -0.394 3.675 4.530 1.00 0.00 H ATOM 17 HA CYS A 2 1.103 1.302 4.563 1.00 0.00 H ATOM 18 HB2 CYS A 2 -1.128 1.341 5.466 1.00 0.00 H ATOM 19 HB3 CYS A 2 -1.806 1.776 3.896 1.00 0.00 H HETATM 20 N ABA A 3 -0.121 2.103 1.608 1.00 0.00 N HETATM 21 CA ABA A 3 0.017 1.841 0.181 1.00 0.00 C HETATM 22 C ABA A 3 1.474 1.591 -0.194 1.00 0.00 C HETATM 23 O ABA A 3 1.764 0.843 -1.128 1.00 0.00 O HETATM 24 CB ABA A 3 -0.515 3.029 -0.620 1.00 0.00 C HETATM 25 CG ABA A 3 -1.976 3.062 -0.527 1.00 0.00 C HETATM 26 H ABA A 3 -0.744 2.794 1.914 1.00 0.00 H HETATM 27 HA ABA A 3 -0.564 0.968 -0.072 1.00 0.00 H HETATM 28 HB3 ABA A 3 -0.218 2.918 -1.650 1.00 0.00 H HETATM 29 HB2 ABA A 3 -0.106 3.946 -0.219 1.00 0.00 H HETATM 30 HG1 ABA A 3 -2.468 2.428 0.196 1.00 0.00 H ATOM 31 N SER A 4 2.387 2.233 0.526 1.00 0.00 N ATOM 32 CA SER A 4 3.808 2.082 0.242 1.00 0.00 C ATOM 33 C SER A 4 4.256 0.635 0.436 1.00 0.00 C ATOM 34 O SER A 4 5.033 0.108 -0.360 1.00 0.00 O ATOM 35 CB SER A 4 4.625 2.987 1.164 1.00 0.00 C ATOM 36 OG SER A 4 4.301 4.345 0.896 1.00 0.00 O ATOM 37 H SER A 4 2.101 2.828 1.249 1.00 0.00 H ATOM 38 HA SER A 4 3.994 2.371 -0.780 1.00 0.00 H ATOM 39 HB2 SER A 4 4.396 2.761 2.192 1.00 0.00 H ATOM 40 HB3 SER A 4 5.679 2.817 0.988 1.00 0.00 H ATOM 41 HG SER A 4 3.449 4.531 1.297 1.00 0.00 H ATOM 42 N ASP A 5 3.774 0.000 1.501 1.00 0.00 N ATOM 43 CA ASP A 5 4.152 -1.381 1.782 1.00 0.00 C ATOM 44 C ASP A 5 3.404 -2.350 0.857 1.00 0.00 C ATOM 45 O ASP A 5 2.242 -2.117 0.522 1.00 0.00 O ATOM 46 CB ASP A 5 3.832 -1.714 3.241 1.00 0.00 C ATOM 47 CG ASP A 5 2.327 -1.677 3.469 1.00 0.00 C ATOM 48 OD1 ASP A 5 1.632 -2.444 2.824 1.00 0.00 O ATOM 49 OD2 ASP A 5 1.891 -0.892 4.296 1.00 0.00 O ATOM 50 H ASP A 5 3.165 0.468 2.109 1.00 0.00 H ATOM 51 HA ASP A 5 5.214 -1.475 1.627 1.00 0.00 H ATOM 52 HB2 ASP A 5 4.203 -2.698 3.475 1.00 0.00 H ATOM 53 HB3 ASP A 5 4.305 -0.988 3.883 1.00 0.00 H ATOM 54 N PRO A 6 4.028 -3.438 0.454 1.00 0.00 N ATOM 55 CA PRO A 6 3.380 -4.445 -0.439 1.00 0.00 C ATOM 56 C PRO A 6 2.261 -5.199 0.268 1.00 0.00 C ATOM 57 O PRO A 6 1.391 -5.787 -0.375 1.00 0.00 O ATOM 58 CB PRO A 6 4.519 -5.384 -0.829 1.00 0.00 C ATOM 59 CG PRO A 6 5.525 -5.257 0.266 1.00 0.00 C ATOM 60 CD PRO A 6 5.407 -3.830 0.795 1.00 0.00 C ATOM 61 HA PRO A 6 2.999 -3.963 -1.325 1.00 0.00 H ATOM 62 HB2 PRO A 6 4.157 -6.402 -0.887 1.00 0.00 H ATOM 63 HB3 PRO A 6 4.955 -5.084 -1.769 1.00 0.00 H ATOM 64 HG2 PRO A 6 5.310 -5.967 1.052 1.00 0.00 H ATOM 65 HG3 PRO A 6 6.518 -5.418 -0.122 1.00 0.00 H ATOM 66 HD2 PRO A 6 5.556 -3.812 1.866 1.00 0.00 H ATOM 67 HD3 PRO A 6 6.113 -3.182 0.299 1.00 0.00 H ATOM 68 N ARG A 7 2.295 -5.178 1.595 1.00 0.00 N ATOM 69 CA ARG A 7 1.283 -5.863 2.387 1.00 0.00 C ATOM 70 C ARG A 7 -0.065 -5.168 2.249 1.00 0.00 C ATOM 71 O ARG A 7 -1.113 -5.783 2.451 1.00 0.00 O ATOM 72 CB ARG A 7 1.699 -5.890 3.859 1.00 0.00 C ATOM 73 CG ARG A 7 2.912 -6.805 4.029 1.00 0.00 C ATOM 74 CD ARG A 7 3.330 -6.837 5.499 1.00 0.00 C ATOM 75 NE ARG A 7 4.492 -7.700 5.675 1.00 0.00 N ATOM 76 CZ ARG A 7 5.034 -7.889 6.873 1.00 0.00 C ATOM 77 NH1 ARG A 7 4.526 -7.296 7.920 1.00 0.00 N ATOM 78 NH2 ARG A 7 6.073 -8.667 7.004 1.00 0.00 N ATOM 79 H ARG A 7 3.014 -4.693 2.051 1.00 0.00 H ATOM 80 HA ARG A 7 1.193 -6.879 2.033 1.00 0.00 H ATOM 81 HB2 ARG A 7 1.952 -4.890 4.180 1.00 0.00 H ATOM 82 HB3 ARG A 7 0.882 -6.264 4.456 1.00 0.00 H ATOM 83 HG2 ARG A 7 2.658 -7.804 3.704 1.00 0.00 H ATOM 84 HG3 ARG A 7 3.731 -6.431 3.433 1.00 0.00 H ATOM 85 HD2 ARG A 7 3.577 -5.837 5.823 1.00 0.00 H ATOM 86 HD3 ARG A 7 2.510 -7.212 6.095 1.00 0.00 H ATOM 87 HE ARG A 7 4.880 -8.149 4.895 1.00 0.00 H ATOM 88 HH11 ARG A 7 3.730 -6.700 7.819 1.00 0.00 H ATOM 89 HH12 ARG A 7 4.934 -7.438 8.821 1.00 0.00 H ATOM 90 HH21 ARG A 7 6.462 -9.121 6.204 1.00 0.00 H ATOM 91 HH22 ARG A 7 6.481 -8.809 7.907 1.00 0.00 H ATOM 92 N CYS A 8 -0.037 -3.880 1.916 1.00 0.00 N ATOM 93 CA CYS A 8 -1.271 -3.118 1.772 1.00 0.00 C ATOM 94 C CYS A 8 -2.256 -3.856 0.868 1.00 0.00 C ATOM 95 O CYS A 8 -1.861 -4.530 -0.085 1.00 0.00 O ATOM 96 CB CYS A 8 -0.973 -1.736 1.196 1.00 0.00 C ATOM 97 SG CYS A 8 -1.935 -0.502 2.106 1.00 0.00 S ATOM 98 H CYS A 8 0.828 -3.431 1.774 1.00 0.00 H ATOM 99 HA CYS A 8 -1.725 -2.996 2.743 1.00 0.00 H ATOM 100 HB2 CYS A 8 0.081 -1.519 1.294 1.00 0.00 H ATOM 101 HB3 CYS A 8 -1.253 -1.711 0.152 1.00 0.00 H ATOM 102 N ARG A 9 -3.538 -3.726 1.184 1.00 0.00 N ATOM 103 CA ARG A 9 -4.585 -4.382 0.412 1.00 0.00 C ATOM 104 C ARG A 9 -4.596 -3.859 -1.022 1.00 0.00 C ATOM 105 O ARG A 9 -4.833 -4.616 -1.964 1.00 0.00 O ATOM 106 CB ARG A 9 -5.951 -4.123 1.063 1.00 0.00 C ATOM 107 CG ARG A 9 -6.032 -4.761 2.461 1.00 0.00 C ATOM 108 CD ARG A 9 -6.172 -6.287 2.372 1.00 0.00 C ATOM 109 NE ARG A 9 -6.357 -6.849 3.705 1.00 0.00 N ATOM 110 CZ ARG A 9 -5.316 -7.170 4.469 1.00 0.00 C ATOM 111 NH1 ARG A 9 -4.103 -6.961 4.037 1.00 0.00 N ATOM 112 NH2 ARG A 9 -5.509 -7.693 5.648 1.00 0.00 N ATOM 113 H ARG A 9 -3.786 -3.181 1.960 1.00 0.00 H ATOM 114 HA ARG A 9 -4.393 -5.438 0.386 1.00 0.00 H ATOM 115 HB2 ARG A 9 -6.104 -3.058 1.150 1.00 0.00 H ATOM 116 HB3 ARG A 9 -6.726 -4.541 0.437 1.00 0.00 H ATOM 117 HG2 ARG A 9 -5.133 -4.521 3.010 1.00 0.00 H ATOM 118 HG3 ARG A 9 -6.885 -4.357 2.987 1.00 0.00 H ATOM 119 HD2 ARG A 9 -7.026 -6.535 1.762 1.00 0.00 H ATOM 120 HD3 ARG A 9 -5.285 -6.714 1.934 1.00 0.00 H ATOM 121 HE ARG A 9 -7.265 -7.000 4.041 1.00 0.00 H ATOM 122 HH11 ARG A 9 -3.954 -6.560 3.134 1.00 0.00 H ATOM 123 HH12 ARG A 9 -3.321 -7.202 4.611 1.00 0.00 H ATOM 124 HH21 ARG A 9 -6.440 -7.853 5.978 1.00 0.00 H ATOM 125 HH22 ARG A 9 -4.726 -7.934 6.222 1.00 0.00 H ATOM 126 N TYR A 10 -4.352 -2.561 -1.183 1.00 0.00 N ATOM 127 CA TYR A 10 -4.354 -1.963 -2.515 1.00 0.00 C ATOM 128 C TYR A 10 -3.255 -0.911 -2.639 1.00 0.00 C ATOM 129 O TYR A 10 -2.759 -0.393 -1.638 1.00 0.00 O ATOM 130 CB TYR A 10 -5.711 -1.313 -2.778 1.00 0.00 C ATOM 131 CG TYR A 10 -5.837 -0.061 -1.944 1.00 0.00 C ATOM 132 CD1 TYR A 10 -6.158 -0.148 -0.584 1.00 0.00 C ATOM 133 CD2 TYR A 10 -5.640 1.192 -2.538 1.00 0.00 C ATOM 134 CE1 TYR A 10 -6.282 1.015 0.183 1.00 0.00 C ATOM 135 CE2 TYR A 10 -5.765 2.356 -1.770 1.00 0.00 C ATOM 136 CZ TYR A 10 -6.086 2.268 -0.410 1.00 0.00 C ATOM 137 OH TYR A 10 -6.208 3.417 0.345 1.00 0.00 O ATOM 138 H TYR A 10 -4.179 -2.000 -0.399 1.00 0.00 H ATOM 139 HA TYR A 10 -4.188 -2.735 -3.249 1.00 0.00 H ATOM 140 HB2 TYR A 10 -5.788 -1.058 -3.825 1.00 0.00 H ATOM 141 HB3 TYR A 10 -6.498 -2.002 -2.514 1.00 0.00 H ATOM 142 HD1 TYR A 10 -6.304 -1.116 -0.125 1.00 0.00 H ATOM 143 HD2 TYR A 10 -5.393 1.259 -3.586 1.00 0.00 H ATOM 144 HE1 TYR A 10 -6.529 0.948 1.231 1.00 0.00 H ATOM 145 HE2 TYR A 10 -5.615 3.322 -2.229 1.00 0.00 H ATOM 146 HH TYR A 10 -5.964 4.164 -0.208 1.00 0.00 H ATOM 147 N ARG A 11 -2.883 -0.600 -3.878 1.00 0.00 N ATOM 148 CA ARG A 11 -1.841 0.388 -4.132 1.00 0.00 C ATOM 149 C ARG A 11 -2.440 1.789 -4.238 1.00 0.00 C ATOM 150 O ARG A 11 -3.505 1.975 -4.827 1.00 0.00 O ATOM 151 CB ARG A 11 -1.099 0.044 -5.425 1.00 0.00 C ATOM 152 CG ARG A 11 0.116 0.961 -5.565 1.00 0.00 C ATOM 153 CD ARG A 11 0.856 0.641 -6.865 1.00 0.00 C ATOM 154 NE ARG A 11 1.339 -0.735 -6.846 1.00 0.00 N ATOM 155 CZ ARG A 11 2.474 -1.055 -6.233 1.00 0.00 C ATOM 156 NH1 ARG A 11 3.175 -0.133 -5.634 1.00 0.00 N ATOM 157 NH2 ARG A 11 2.887 -2.294 -6.231 1.00 0.00 N ATOM 158 H ARG A 11 -3.313 -1.046 -4.635 1.00 0.00 H ATOM 159 HA ARG A 11 -1.139 0.370 -3.314 1.00 0.00 H ATOM 160 HB2 ARG A 11 -0.774 -0.986 -5.390 1.00 0.00 H ATOM 161 HB3 ARG A 11 -1.756 0.188 -6.269 1.00 0.00 H ATOM 162 HG2 ARG A 11 -0.210 1.989 -5.579 1.00 0.00 H ATOM 163 HG3 ARG A 11 0.780 0.804 -4.728 1.00 0.00 H ATOM 164 HD2 ARG A 11 0.185 0.771 -7.701 1.00 0.00 H ATOM 165 HD3 ARG A 11 1.693 1.314 -6.973 1.00 0.00 H ATOM 166 HE ARG A 11 0.818 -1.435 -7.293 1.00 0.00 H ATOM 167 HH11 ARG A 11 2.858 0.816 -5.636 1.00 0.00 H ATOM 168 HH12 ARG A 11 4.029 -0.373 -5.174 1.00 0.00 H ATOM 169 HH21 ARG A 11 2.349 -3.001 -6.690 1.00 0.00 H ATOM 170 HH22 ARG A 11 3.741 -2.534 -5.771 1.00 0.00 H HETATM 171 N ABA A 12 -1.747 2.767 -3.662 1.00 0.00 N HETATM 172 CA ABA A 12 -2.215 4.151 -3.694 1.00 0.00 C HETATM 173 C ABA A 12 -1.388 4.974 -4.676 1.00 0.00 C HETATM 174 O ABA A 12 -0.528 4.443 -5.378 1.00 0.00 O HETATM 175 CB ABA A 12 -2.129 4.783 -2.300 1.00 0.00 C HETATM 176 CG ABA A 12 -2.726 3.876 -1.307 1.00 0.00 C HETATM 177 H ABA A 12 -0.906 2.555 -3.212 1.00 0.00 H HETATM 178 HA ABA A 12 -3.245 4.161 -4.016 1.00 0.00 H HETATM 179 HB3 ABA A 12 -2.677 5.716 -2.306 1.00 0.00 H HETATM 180 HB2 ABA A 12 -1.102 4.990 -2.057 1.00 0.00 H HETATM 181 HG1 ABA A 12 -3.800 3.863 -1.195 1.00 0.00 H ATOM 182 N ARG A 13 -1.656 6.276 -4.719 1.00 0.00 N ATOM 183 CA ARG A 13 -0.931 7.166 -5.620 1.00 0.00 C ATOM 184 C ARG A 13 0.346 7.670 -4.955 1.00 0.00 C ATOM 185 O ARG A 13 0.530 7.390 -3.782 1.00 0.00 O ATOM 186 CB ARG A 13 -1.803 8.367 -6.024 1.00 0.00 C ATOM 187 CG ARG A 13 -3.147 8.332 -5.289 1.00 0.00 C ATOM 188 CD ARG A 13 -2.935 8.632 -3.803 1.00 0.00 C ATOM 189 NE ARG A 13 -3.111 10.058 -3.554 1.00 0.00 N ATOM 190 CZ ARG A 13 -2.804 10.600 -2.381 1.00 0.00 C ATOM 191 NH1 ARG A 13 -2.325 9.855 -1.422 1.00 0.00 N ATOM 192 NH2 ARG A 13 -2.982 11.879 -2.186 1.00 0.00 N ATOM 193 OXT ARG A 13 1.120 8.330 -5.628 1.00 0.00 O ATOM 194 H ARG A 13 -2.350 6.643 -4.136 1.00 0.00 H ATOM 195 HA ARG A 13 -0.664 6.617 -6.510 1.00 0.00 H ATOM 196 HB2 ARG A 13 -1.285 9.283 -5.776 1.00 0.00 H ATOM 197 HB3 ARG A 13 -1.982 8.332 -7.088 1.00 0.00 H ATOM 198 HG2 ARG A 13 -3.800 9.081 -5.713 1.00 0.00 H ATOM 199 HG3 ARG A 13 -3.601 7.361 -5.406 1.00 0.00 H ATOM 200 HD2 ARG A 13 -3.652 8.076 -3.218 1.00 0.00 H ATOM 201 HD3 ARG A 13 -1.935 8.339 -3.516 1.00 0.00 H ATOM 202 HE ARG A 13 -3.466 10.628 -4.268 1.00 0.00 H ATOM 203 HH11 ARG A 13 -2.189 8.876 -1.572 1.00 0.00 H ATOM 204 HH12 ARG A 13 -2.095 10.263 -0.540 1.00 0.00 H ATOM 205 HH21 ARG A 13 -3.349 12.450 -2.920 1.00 0.00 H ATOM 206 HH22 ARG A 13 -2.751 12.287 -1.303 1.00 0.00 H TER 207 ARG A 13