ATOM 1 N GLY A 1 1.245 5.224 4.944 1.00 0.00 N1+ ATOM 2 CA GLY A 1 2.260 4.207 5.340 1.00 0.00 C ATOM 3 C GLY A 1 1.941 2.876 4.668 1.00 0.00 C ATOM 4 O GLY A 1 2.831 2.190 4.160 1.00 0.00 O ATOM 5 H1 GLY A 1 1.045 5.137 3.928 1.00 0.00 H ATOM 6 H2 GLY A 1 1.613 6.177 5.145 1.00 0.00 H ATOM 7 H3 GLY A 1 0.369 5.067 5.482 1.00 0.00 H ATOM 8 HA2 GLY A 1 3.242 4.541 5.036 1.00 0.00 H ATOM 9 HA3 GLY A 1 2.240 4.077 6.412 1.00 0.00 H ATOM 10 N CYS A 2 0.662 2.516 4.662 1.00 0.00 N ATOM 11 CA CYS A 2 0.246 1.268 4.043 1.00 0.00 C ATOM 12 C CYS A 2 0.554 1.319 2.552 1.00 0.00 C ATOM 13 O CYS A 2 1.093 0.371 1.983 1.00 0.00 O ATOM 14 CB CYS A 2 -1.254 1.056 4.257 1.00 0.00 C ATOM 15 SG CYS A 2 -1.703 -0.630 3.781 1.00 0.00 S ATOM 16 H CYS A 2 -0.011 3.101 5.069 1.00 0.00 H ATOM 17 HA CYS A 2 0.789 0.449 4.488 1.00 0.00 H ATOM 18 HB2 CYS A 2 -1.497 1.212 5.297 1.00 0.00 H ATOM 19 HB3 CYS A 2 -1.804 1.760 3.649 1.00 0.00 H HETATM 20 N ABA A 3 0.211 2.444 1.940 1.00 0.00 N HETATM 21 CA ABA A 3 0.449 2.645 0.518 1.00 0.00 C HETATM 22 C ABA A 3 1.865 2.232 0.145 1.00 0.00 C HETATM 23 O ABA A 3 2.077 1.502 -0.823 1.00 0.00 O HETATM 24 CB ABA A 3 0.243 4.118 0.167 1.00 0.00 C HETATM 25 CG ABA A 3 -1.157 4.340 -0.190 1.00 0.00 C HETATM 26 H ABA A 3 -0.210 3.161 2.459 1.00 0.00 H HETATM 27 HA ABA A 3 -0.251 2.049 -0.044 1.00 0.00 H HETATM 28 HB3 ABA A 3 0.890 4.388 -0.652 1.00 0.00 H HETATM 29 HB2 ABA A 3 0.488 4.726 1.028 1.00 0.00 H HETATM 30 HG1 ABA A 3 -1.857 4.621 0.584 1.00 0.00 H ATOM 31 N SER A 4 2.832 2.711 0.916 1.00 0.00 N ATOM 32 CA SER A 4 4.228 2.389 0.654 1.00 0.00 C ATOM 33 C SER A 4 4.464 0.887 0.774 1.00 0.00 C ATOM 34 O SER A 4 5.202 0.301 -0.018 1.00 0.00 O ATOM 35 CB SER A 4 5.127 3.128 1.645 1.00 0.00 C ATOM 36 OG SER A 4 5.024 4.528 1.420 1.00 0.00 O ATOM 37 H SER A 4 2.603 3.292 1.670 1.00 0.00 H ATOM 38 HA SER A 4 4.479 2.706 -0.348 1.00 0.00 H ATOM 39 HB2 SER A 4 4.815 2.906 2.652 1.00 0.00 H ATOM 40 HB3 SER A 4 6.152 2.805 1.508 1.00 0.00 H ATOM 41 HG SER A 4 4.093 4.761 1.428 1.00 0.00 H ATOM 42 N ASP A 5 3.844 0.271 1.778 1.00 0.00 N ATOM 43 CA ASP A 5 4.017 -1.162 1.995 1.00 0.00 C ATOM 44 C ASP A 5 3.301 -1.986 0.905 1.00 0.00 C ATOM 45 O ASP A 5 2.141 -1.717 0.590 1.00 0.00 O ATOM 46 CB ASP A 5 3.472 -1.547 3.368 1.00 0.00 C ATOM 47 CG ASP A 5 4.264 -0.826 4.454 1.00 0.00 C ATOM 48 OD1 ASP A 5 5.297 -0.263 4.129 1.00 0.00 O ATOM 49 OD2 ASP A 5 3.825 -0.843 5.593 1.00 0.00 O ATOM 50 H ASP A 5 3.276 0.791 2.388 1.00 0.00 H ATOM 51 HA ASP A 5 5.073 -1.366 1.980 1.00 0.00 H ATOM 52 HB2 ASP A 5 2.430 -1.270 3.437 1.00 0.00 H ATOM 53 HB3 ASP A 5 3.573 -2.614 3.504 1.00 0.00 H ATOM 54 N PRO A 6 3.948 -2.980 0.329 1.00 0.00 N ATOM 55 CA PRO A 6 3.326 -3.827 -0.738 1.00 0.00 C ATOM 56 C PRO A 6 2.244 -4.752 -0.189 1.00 0.00 C ATOM 57 O PRO A 6 1.426 -5.286 -0.938 1.00 0.00 O ATOM 58 CB PRO A 6 4.502 -4.628 -1.302 1.00 0.00 C ATOM 59 CG PRO A 6 5.499 -4.695 -0.197 1.00 0.00 C ATOM 60 CD PRO A 6 5.322 -3.422 0.630 1.00 0.00 C ATOM 61 HA PRO A 6 2.915 -3.204 -1.515 1.00 0.00 H ATOM 62 HB2 PRO A 6 4.181 -5.623 -1.579 1.00 0.00 H ATOM 63 HB3 PRO A 6 4.928 -4.118 -2.153 1.00 0.00 H ATOM 64 HG2 PRO A 6 5.319 -5.569 0.416 1.00 0.00 H ATOM 65 HG3 PRO A 6 6.498 -4.723 -0.602 1.00 0.00 H ATOM 66 HD2 PRO A 6 5.429 -3.642 1.685 1.00 0.00 H ATOM 67 HD3 PRO A 6 6.033 -2.671 0.323 1.00 0.00 H ATOM 68 N ARG A 7 2.251 -4.940 1.123 1.00 0.00 N ATOM 69 CA ARG A 7 1.272 -5.809 1.768 1.00 0.00 C ATOM 70 C ARG A 7 -0.094 -5.130 1.831 1.00 0.00 C ATOM 71 O ARG A 7 -1.097 -5.770 2.146 1.00 0.00 O ATOM 72 CB ARG A 7 1.741 -6.153 3.185 1.00 0.00 C ATOM 73 CG ARG A 7 3.085 -6.892 3.131 1.00 0.00 C ATOM 74 CD ARG A 7 2.861 -8.384 2.861 1.00 0.00 C ATOM 75 NE ARG A 7 4.129 -9.104 2.920 1.00 0.00 N ATOM 76 CZ ARG A 7 4.171 -10.424 2.772 1.00 0.00 C ATOM 77 NH1 ARG A 7 3.069 -11.093 2.568 1.00 0.00 N ATOM 78 NH2 ARG A 7 5.314 -11.052 2.833 1.00 0.00 N ATOM 79 H ARG A 7 2.930 -4.493 1.669 1.00 0.00 H ATOM 80 HA ARG A 7 1.179 -6.717 1.197 1.00 0.00 H ATOM 81 HB2 ARG A 7 1.854 -5.242 3.757 1.00 0.00 H ATOM 82 HB3 ARG A 7 1.005 -6.784 3.659 1.00 0.00 H ATOM 83 HG2 ARG A 7 3.688 -6.474 2.338 1.00 0.00 H ATOM 84 HG3 ARG A 7 3.600 -6.771 4.073 1.00 0.00 H ATOM 85 HD2 ARG A 7 2.193 -8.790 3.604 1.00 0.00 H ATOM 86 HD3 ARG A 7 2.426 -8.515 1.882 1.00 0.00 H ATOM 87 HE ARG A 7 4.961 -8.608 3.072 1.00 0.00 H ATOM 88 HH11 ARG A 7 2.194 -10.613 2.523 1.00 0.00 H ATOM 89 HH12 ARG A 7 3.101 -12.086 2.458 1.00 0.00 H ATOM 90 HH21 ARG A 7 6.158 -10.539 2.990 1.00 0.00 H ATOM 91 HH22 ARG A 7 5.346 -12.045 2.722 1.00 0.00 H ATOM 92 N CYS A 8 -0.129 -3.834 1.537 1.00 0.00 N ATOM 93 CA CYS A 8 -1.383 -3.091 1.576 1.00 0.00 C ATOM 94 C CYS A 8 -2.464 -3.821 0.790 1.00 0.00 C ATOM 95 O CYS A 8 -2.183 -4.473 -0.216 1.00 0.00 O ATOM 96 CB CYS A 8 -1.175 -1.692 0.992 1.00 0.00 C ATOM 97 SG CYS A 8 -2.249 -0.502 1.840 1.00 0.00 S ATOM 98 H CYS A 8 0.703 -3.367 1.297 1.00 0.00 H ATOM 99 HA CYS A 8 -1.705 -3.002 2.600 1.00 0.00 H ATOM 100 HB2 CYS A 8 -0.143 -1.401 1.118 1.00 0.00 H ATOM 101 HB3 CYS A 8 -1.418 -1.703 -0.062 1.00 0.00 H ATOM 102 N ARG A 9 -3.699 -3.710 1.265 1.00 0.00 N ATOM 103 CA ARG A 9 -4.830 -4.363 0.615 1.00 0.00 C ATOM 104 C ARG A 9 -5.009 -3.841 -0.805 1.00 0.00 C ATOM 105 O ARG A 9 -5.353 -4.597 -1.713 1.00 0.00 O ATOM 106 CB ARG A 9 -6.107 -4.118 1.421 1.00 0.00 C ATOM 107 CG ARG A 9 -6.039 -4.901 2.734 1.00 0.00 C ATOM 108 CD ARG A 9 -7.244 -4.541 3.605 1.00 0.00 C ATOM 109 NE ARG A 9 -7.221 -5.313 4.842 1.00 0.00 N ATOM 110 CZ ARG A 9 -6.475 -4.935 5.874 1.00 0.00 C ATOM 111 NH1 ARG A 9 -5.747 -3.856 5.792 1.00 0.00 N ATOM 112 NH2 ARG A 9 -6.471 -5.643 6.971 1.00 0.00 N ATOM 113 H ARG A 9 -3.854 -3.181 2.076 1.00 0.00 H ATOM 114 HA ARG A 9 -4.644 -5.425 0.573 1.00 0.00 H ATOM 115 HB2 ARG A 9 -6.203 -3.062 1.634 1.00 0.00 H ATOM 116 HB3 ARG A 9 -6.961 -4.450 0.850 1.00 0.00 H ATOM 117 HG2 ARG A 9 -6.053 -5.959 2.520 1.00 0.00 H ATOM 118 HG3 ARG A 9 -5.130 -4.649 3.257 1.00 0.00 H ATOM 119 HD2 ARG A 9 -7.211 -3.489 3.844 1.00 0.00 H ATOM 120 HD3 ARG A 9 -8.154 -4.755 3.063 1.00 0.00 H ATOM 121 HE ARG A 9 -7.765 -6.126 4.912 1.00 0.00 H ATOM 122 HH11 ARG A 9 -5.750 -3.314 4.952 1.00 0.00 H ATOM 123 HH12 ARG A 9 -5.185 -3.571 6.568 1.00 0.00 H ATOM 124 HH21 ARG A 9 -7.028 -6.471 7.033 1.00 0.00 H ATOM 125 HH22 ARG A 9 -5.909 -5.358 7.747 1.00 0.00 H ATOM 126 N TYR A 10 -4.782 -2.544 -0.987 1.00 0.00 N ATOM 127 CA TYR A 10 -4.927 -1.927 -2.302 1.00 0.00 C ATOM 128 C TYR A 10 -3.676 -1.137 -2.669 1.00 0.00 C ATOM 129 O TYR A 10 -2.957 -0.650 -1.796 1.00 0.00 O ATOM 130 CB TYR A 10 -6.137 -0.994 -2.294 1.00 0.00 C ATOM 131 CG TYR A 10 -5.898 0.131 -1.314 1.00 0.00 C ATOM 132 CD1 TYR A 10 -6.188 -0.050 0.044 1.00 0.00 C ATOM 133 CD2 TYR A 10 -5.388 1.355 -1.763 1.00 0.00 C ATOM 134 CE1 TYR A 10 -5.968 0.992 0.951 1.00 0.00 C ATOM 135 CE2 TYR A 10 -5.167 2.397 -0.855 1.00 0.00 C ATOM 136 CZ TYR A 10 -5.457 2.215 0.502 1.00 0.00 C ATOM 137 OH TYR A 10 -5.240 3.243 1.398 1.00 0.00 O ATOM 138 H TYR A 10 -4.515 -1.990 -0.224 1.00 0.00 H ATOM 139 HA TYR A 10 -5.087 -2.697 -3.041 1.00 0.00 H ATOM 140 HB2 TYR A 10 -6.279 -0.584 -3.283 1.00 0.00 H ATOM 141 HB3 TYR A 10 -7.019 -1.545 -2.002 1.00 0.00 H ATOM 142 HD1 TYR A 10 -6.578 -0.996 0.391 1.00 0.00 H ATOM 143 HD2 TYR A 10 -5.165 1.494 -2.810 1.00 0.00 H ATOM 144 HE1 TYR A 10 -6.192 0.852 2.000 1.00 0.00 H ATOM 145 HE2 TYR A 10 -4.773 3.341 -1.202 1.00 0.00 H ATOM 146 HH TYR A 10 -6.094 3.551 1.710 1.00 0.00 H ATOM 147 N ARG A 11 -3.420 -1.021 -3.968 1.00 0.00 N ATOM 148 CA ARG A 11 -2.250 -0.295 -4.445 1.00 0.00 C ATOM 149 C ARG A 11 -2.453 1.209 -4.299 1.00 0.00 C ATOM 150 O ARG A 11 -3.553 1.719 -4.505 1.00 0.00 O ATOM 151 CB ARG A 11 -1.983 -0.633 -5.912 1.00 0.00 C ATOM 152 CG ARG A 11 -1.633 -2.116 -6.042 1.00 0.00 C ATOM 153 CD ARG A 11 -1.561 -2.495 -7.521 1.00 0.00 C ATOM 154 NE ARG A 11 -2.877 -2.379 -8.140 1.00 0.00 N ATOM 155 CZ ARG A 11 -3.041 -2.559 -9.446 1.00 0.00 C ATOM 156 NH1 ARG A 11 -2.015 -2.845 -10.199 1.00 0.00 N ATOM 157 NH2 ARG A 11 -4.230 -2.451 -9.975 1.00 0.00 N ATOM 158 H ARG A 11 -4.027 -1.435 -4.616 1.00 0.00 H ATOM 159 HA ARG A 11 -1.393 -0.591 -3.859 1.00 0.00 H ATOM 160 HB2 ARG A 11 -2.865 -0.417 -6.498 1.00 0.00 H ATOM 161 HB3 ARG A 11 -1.156 -0.038 -6.274 1.00 0.00 H ATOM 162 HG2 ARG A 11 -0.678 -2.304 -5.573 1.00 0.00 H ATOM 163 HG3 ARG A 11 -2.395 -2.709 -5.557 1.00 0.00 H ATOM 164 HD2 ARG A 11 -0.872 -1.836 -8.026 1.00 0.00 H ATOM 165 HD3 ARG A 11 -1.210 -3.514 -7.613 1.00 0.00 H ATOM 166 HE ARG A 11 -3.654 -2.164 -7.581 1.00 0.00 H ATOM 167 HH11 ARG A 11 -1.105 -2.927 -9.793 1.00 0.00 H ATOM 168 HH12 ARG A 11 -2.138 -2.980 -11.182 1.00 0.00 H ATOM 169 HH21 ARG A 11 -5.016 -2.232 -9.398 1.00 0.00 H ATOM 170 HH22 ARG A 11 -4.353 -2.586 -10.958 1.00 0.00 H HETATM 171 N ABA A 12 -1.385 1.915 -3.945 1.00 0.00 N HETATM 172 CA ABA A 12 -1.462 3.360 -3.776 1.00 0.00 C HETATM 173 C ABA A 12 -0.873 4.071 -4.991 1.00 0.00 C HETATM 174 O ABA A 12 -0.769 5.297 -5.012 1.00 0.00 O HETATM 175 CB ABA A 12 -0.683 3.771 -2.528 1.00 0.00 C HETATM 176 CG ABA A 12 -1.599 4.177 -1.456 1.00 0.00 C HETATM 177 H ABA A 12 -0.532 1.458 -3.794 1.00 0.00 H HETATM 178 HA ABA A 12 -2.493 3.649 -3.666 1.00 0.00 H HETATM 179 HB3 ABA A 12 -0.030 4.595 -2.775 1.00 0.00 H HETATM 180 HB2 ABA A 12 -0.089 2.935 -2.192 1.00 0.00 H HETATM 181 HG1 ABA A 12 -2.641 4.351 -1.677 1.00 0.00 H ATOM 182 N ARG A 13 -0.488 3.294 -5.997 1.00 0.00 N ATOM 183 CA ARG A 13 0.093 3.858 -7.210 1.00 0.00 C ATOM 184 C ARG A 13 -0.503 3.190 -8.445 1.00 0.00 C ATOM 185 O ARG A 13 -1.257 2.246 -8.276 1.00 0.00 O ATOM 186 CB ARG A 13 1.615 3.674 -7.210 1.00 0.00 C ATOM 187 CG ARG A 13 2.050 2.854 -5.992 1.00 0.00 C ATOM 188 CD ARG A 13 1.470 1.443 -6.092 1.00 0.00 C ATOM 189 NE ARG A 13 2.544 0.468 -6.213 1.00 0.00 N ATOM 190 CZ ARG A 13 3.161 -0.014 -5.139 1.00 0.00 C ATOM 191 NH1 ARG A 13 2.809 0.389 -3.948 1.00 0.00 N ATOM 192 NH2 ARG A 13 4.118 -0.890 -5.274 1.00 0.00 N ATOM 193 OXT ARG A 13 -0.197 3.632 -9.540 1.00 0.00 O ATOM 194 H ARG A 13 -0.594 2.322 -5.921 1.00 0.00 H ATOM 195 HA ARG A 13 -0.127 4.912 -7.245 1.00 0.00 H ATOM 196 HB2 ARG A 13 1.914 3.160 -8.112 1.00 0.00 H ATOM 197 HB3 ARG A 13 2.092 4.642 -7.172 1.00 0.00 H ATOM 198 HG2 ARG A 13 3.128 2.799 -5.966 1.00 0.00 H ATOM 199 HG3 ARG A 13 1.695 3.330 -5.092 1.00 0.00 H ATOM 200 HD2 ARG A 13 0.892 1.228 -5.206 1.00 0.00 H ATOM 201 HD3 ARG A 13 0.829 1.378 -6.960 1.00 0.00 H ATOM 202 HE ARG A 13 2.816 0.164 -7.102 1.00 0.00 H ATOM 203 HH11 ARG A 13 2.075 1.062 -3.844 1.00 0.00 H ATOM 204 HH12 ARG A 13 3.272 0.027 -3.140 1.00 0.00 H ATOM 205 HH21 ARG A 13 4.388 -1.199 -6.186 1.00 0.00 H ATOM 206 HH22 ARG A 13 4.582 -1.253 -4.466 1.00 0.00 H TER 207 ARG A 13