HETATM 1 C ACE A 0 12.752 -6.200 2.864 1.00 0.95 C HETATM 2 O ACE A 0 12.892 -4.995 3.081 1.00 0.95 O HETATM 3 CH3 ACE A 0 13.660 -7.210 3.513 1.00 1.17 C HETATM 4 H1 ACE A 0 14.534 -7.344 2.886 1.00 1.49 H HETATM 5 H2 ACE A 0 13.142 -8.143 3.611 1.00 1.66 H HETATM 6 H3 ACE A 0 13.937 -6.845 4.497 1.00 1.58 H ATOM 7 N PRO A 1 11.805 -6.668 2.037 1.00 0.84 N ATOM 8 CA PRO A 1 10.768 -5.809 1.465 1.00 0.69 C ATOM 9 C PRO A 1 9.882 -5.197 2.546 1.00 0.57 C ATOM 10 O PRO A 1 9.714 -5.778 3.623 1.00 0.60 O ATOM 11 CB PRO A 1 9.946 -6.753 0.583 1.00 0.75 C ATOM 12 CG PRO A 1 10.786 -7.965 0.390 1.00 0.91 C ATOM 13 CD PRO A 1 11.669 -8.065 1.599 1.00 0.97 C ATOM 14 HA PRO A 1 11.197 -5.025 0.861 1.00 0.71 H ATOM 15 HB2 PRO A 1 9.019 -6.998 1.083 1.00 0.87 H ATOM 16 HB3 PRO A 1 9.741 -6.288 -0.369 1.00 0.76 H ATOM 17 HG2 PRO A 1 10.155 -8.839 0.310 1.00 1.14 H ATOM 18 HG3 PRO A 1 11.391 -7.854 -0.496 1.00 1.06 H ATOM 19 HD2 PRO A 1 11.196 -8.663 2.364 1.00 1.03 H ATOM 20 HD3 PRO A 1 12.629 -8.479 1.333 1.00 1.19 H ATOM 21 N PRO A 2 9.300 -4.021 2.281 1.00 0.51 N ATOM 22 CA PRO A 2 8.427 -3.348 3.236 1.00 0.47 C ATOM 23 C PRO A 2 7.084 -4.054 3.357 1.00 0.42 C ATOM 24 O PRO A 2 6.790 -4.987 2.603 1.00 0.43 O ATOM 25 CB PRO A 2 8.244 -1.940 2.651 1.00 0.50 C ATOM 26 CG PRO A 2 9.155 -1.855 1.471 1.00 0.55 C ATOM 27 CD PRO A 2 9.425 -3.262 1.033 1.00 0.56 C ATOM 28 HA PRO A 2 8.886 -3.281 4.212 1.00 0.52 H ATOM 29 HB2 PRO A 2 7.214 -1.801 2.353 1.00 0.66 H ATOM 30 HB3 PRO A 2 8.522 -1.200 3.384 1.00 0.61 H ATOM 31 HG2 PRO A 2 8.673 -1.300 0.679 1.00 0.72 H ATOM 32 HG3 PRO A 2 10.080 -1.376 1.756 1.00 0.86 H ATOM 33 HD2 PRO A 2 8.688 -3.582 0.310 1.00 0.62 H ATOM 34 HD3 PRO A 2 10.419 -3.348 0.627 1.00 0.79 H ATOM 35 N THR A 3 6.274 -3.621 4.306 1.00 0.45 N ATOM 36 CA THR A 3 4.971 -4.213 4.522 1.00 0.45 C ATOM 37 C THR A 3 4.006 -3.861 3.396 1.00 0.38 C ATOM 38 O THR A 3 3.350 -2.820 3.427 1.00 0.44 O ATOM 39 CB THR A 3 4.382 -3.763 5.869 1.00 0.57 C ATOM 40 OG1 THR A 3 4.605 -2.358 6.056 1.00 0.63 O ATOM 41 CG2 THR A 3 5.003 -4.539 7.020 1.00 0.70 C ATOM 42 H THR A 3 6.562 -2.883 4.887 1.00 0.51 H ATOM 43 HA THR A 3 5.097 -5.285 4.551 1.00 0.50 H ATOM 44 HB THR A 3 3.321 -3.952 5.859 1.00 0.57 H ATOM 45 HG1 THR A 3 4.174 -1.866 5.345 1.00 1.14 H ATOM 46 HG21 THR A 3 4.585 -4.193 7.953 1.00 1.25 H ATOM 47 HG22 THR A 3 6.072 -4.382 7.024 1.00 1.31 H ATOM 48 HG23 THR A 3 4.794 -5.592 6.900 1.00 1.20 H ATOM 49 N LYS A 4 3.965 -4.710 2.379 1.00 0.36 N ATOM 50 CA LYS A 4 3.006 -4.561 1.301 1.00 0.32 C ATOM 51 C LYS A 4 1.581 -4.578 1.854 1.00 0.30 C ATOM 52 O LYS A 4 1.206 -5.488 2.596 1.00 0.37 O ATOM 53 CB LYS A 4 3.190 -5.649 0.227 1.00 0.40 C ATOM 54 CG LYS A 4 3.043 -7.094 0.706 1.00 0.54 C ATOM 55 CD LYS A 4 4.320 -7.632 1.340 1.00 0.91 C ATOM 56 CE LYS A 4 4.300 -9.147 1.419 1.00 1.42 C ATOM 57 NZ LYS A 4 5.580 -9.692 1.944 1.00 1.96 N ATOM 58 H LYS A 4 4.615 -5.436 2.340 1.00 0.46 H ATOM 59 HA LYS A 4 3.185 -3.599 0.847 1.00 0.33 H ATOM 60 HB2 LYS A 4 2.463 -5.486 -0.548 1.00 0.43 H ATOM 61 HB3 LYS A 4 4.177 -5.539 -0.202 1.00 0.44 H ATOM 62 HG2 LYS A 4 2.250 -7.138 1.437 1.00 1.02 H ATOM 63 HG3 LYS A 4 2.785 -7.714 -0.140 1.00 0.90 H ATOM 64 HD2 LYS A 4 5.169 -7.321 0.747 1.00 1.39 H ATOM 65 HD3 LYS A 4 4.409 -7.237 2.340 1.00 1.43 H ATOM 66 HE2 LYS A 4 3.496 -9.451 2.071 1.00 1.78 H ATOM 67 HE3 LYS A 4 4.130 -9.546 0.430 1.00 2.07 H ATOM 68 HZ1 LYS A 4 6.365 -9.434 1.311 1.00 2.37 H ATOM 69 HZ2 LYS A 4 5.528 -10.728 2.008 1.00 2.18 H ATOM 70 HZ3 LYS A 4 5.773 -9.307 2.892 1.00 2.55 H ATOM 71 N PRO A 5 0.780 -3.551 1.531 1.00 0.29 N ATOM 72 CA PRO A 5 -0.598 -3.447 2.012 1.00 0.33 C ATOM 73 C PRO A 5 -1.498 -4.497 1.379 1.00 0.33 C ATOM 74 O PRO A 5 -1.187 -5.031 0.312 1.00 0.42 O ATOM 75 CB PRO A 5 -1.040 -2.040 1.580 1.00 0.38 C ATOM 76 CG PRO A 5 0.192 -1.345 1.108 1.00 0.44 C ATOM 77 CD PRO A 5 1.140 -2.417 0.667 1.00 0.36 C ATOM 78 HA PRO A 5 -0.650 -3.531 3.089 1.00 0.40 H ATOM 79 HB2 PRO A 5 -1.767 -2.117 0.783 1.00 0.47 H ATOM 80 HB3 PRO A 5 -1.462 -1.512 2.419 1.00 0.48 H ATOM 81 HG2 PRO A 5 -0.051 -0.692 0.280 1.00 0.66 H ATOM 82 HG3 PRO A 5 0.627 -0.779 1.917 1.00 0.69 H ATOM 83 HD2 PRO A 5 0.983 -2.657 -0.374 1.00 0.48 H ATOM 84 HD3 PRO A 5 2.159 -2.108 0.836 1.00 0.54 H ATOM 85 N THR A 6 -2.604 -4.802 2.042 1.00 0.41 N ATOM 86 CA THR A 6 -3.575 -5.729 1.494 1.00 0.48 C ATOM 87 C THR A 6 -4.190 -5.145 0.227 1.00 0.36 C ATOM 88 O THR A 6 -4.490 -3.951 0.157 1.00 0.34 O ATOM 89 CB THR A 6 -4.684 -6.079 2.514 1.00 0.68 C ATOM 90 OG1 THR A 6 -5.664 -6.940 1.915 1.00 0.79 O ATOM 91 CG2 THR A 6 -5.361 -4.825 3.046 1.00 0.74 C ATOM 92 H THR A 6 -2.769 -4.394 2.916 1.00 0.52 H ATOM 93 HA THR A 6 -3.053 -6.638 1.235 1.00 0.53 H ATOM 94 HB THR A 6 -4.228 -6.597 3.342 1.00 0.75 H ATOM 95 HG1 THR A 6 -6.536 -6.728 2.272 1.00 1.10 H ATOM 96 HG21 THR A 6 -6.161 -5.103 3.714 1.00 1.30 H ATOM 97 HG22 THR A 6 -5.761 -4.257 2.220 1.00 1.25 H ATOM 98 HG23 THR A 6 -4.638 -4.224 3.578 1.00 1.26 H ATOM 99 N LYS A 7 -4.356 -5.986 -0.774 1.00 0.36 N ATOM 100 CA LYS A 7 -4.837 -5.538 -2.068 1.00 0.30 C ATOM 101 C LYS A 7 -6.350 -5.366 -2.061 1.00 0.28 C ATOM 102 O LYS A 7 -7.084 -6.243 -1.603 1.00 0.37 O ATOM 103 CB LYS A 7 -4.402 -6.504 -3.171 1.00 0.38 C ATOM 104 CG LYS A 7 -3.015 -6.200 -3.718 1.00 0.52 C ATOM 105 CD LYS A 7 -1.949 -6.241 -2.638 1.00 0.64 C ATOM 106 CE LYS A 7 -1.493 -7.660 -2.345 1.00 0.88 C ATOM 107 NZ LYS A 7 -0.910 -8.315 -3.547 1.00 1.68 N ATOM 108 H LYS A 7 -4.169 -6.939 -0.633 1.00 0.46 H ATOM 109 HA LYS A 7 -4.380 -4.578 -2.260 1.00 0.29 H ATOM 110 HB2 LYS A 7 -4.401 -7.509 -2.777 1.00 0.48 H ATOM 111 HB3 LYS A 7 -5.108 -6.446 -3.986 1.00 0.45 H ATOM 112 HG2 LYS A 7 -2.770 -6.930 -4.472 1.00 0.91 H ATOM 113 HG3 LYS A 7 -3.026 -5.216 -4.160 1.00 0.95 H ATOM 114 HD2 LYS A 7 -1.105 -5.657 -2.960 1.00 1.00 H ATOM 115 HD3 LYS A 7 -2.355 -5.812 -1.733 1.00 0.91 H ATOM 116 HE2 LYS A 7 -0.746 -7.631 -1.566 1.00 1.40 H ATOM 117 HE3 LYS A 7 -2.342 -8.235 -2.008 1.00 1.32 H ATOM 118 HZ1 LYS A 7 -1.640 -8.446 -4.274 1.00 2.13 H ATOM 119 HZ2 LYS A 7 -0.518 -9.244 -3.295 1.00 2.29 H ATOM 120 HZ3 LYS A 7 -0.148 -7.728 -3.941 1.00 2.09 H ATOM 121 N PRO A 8 -6.833 -4.206 -2.527 1.00 0.30 N ATOM 122 CA PRO A 8 -8.266 -3.913 -2.594 1.00 0.36 C ATOM 123 C PRO A 8 -8.990 -4.717 -3.674 1.00 0.28 C ATOM 124 O PRO A 8 -9.100 -4.287 -4.827 1.00 0.35 O ATOM 125 CB PRO A 8 -8.309 -2.420 -2.916 1.00 0.55 C ATOM 126 CG PRO A 8 -7.023 -2.138 -3.607 1.00 0.73 C ATOM 127 CD PRO A 8 -6.013 -3.072 -3.000 1.00 0.37 C ATOM 128 HA PRO A 8 -8.745 -4.088 -1.644 1.00 0.46 H ATOM 129 HB2 PRO A 8 -9.153 -2.212 -3.562 1.00 0.59 H ATOM 130 HB3 PRO A 8 -8.378 -1.844 -2.007 1.00 0.77 H ATOM 131 HG2 PRO A 8 -7.128 -2.330 -4.666 1.00 1.03 H ATOM 132 HG3 PRO A 8 -6.727 -1.114 -3.435 1.00 1.08 H ATOM 133 HD2 PRO A 8 -5.298 -3.393 -3.744 1.00 0.50 H ATOM 134 HD3 PRO A 8 -5.509 -2.593 -2.173 1.00 0.36 H ATOM 135 N GLY A 9 -9.452 -5.899 -3.301 1.00 0.31 N ATOM 136 CA GLY A 9 -10.219 -6.722 -4.213 1.00 0.37 C ATOM 137 C GLY A 9 -11.702 -6.650 -3.931 1.00 0.47 C ATOM 138 O GLY A 9 -12.464 -6.046 -4.686 1.00 0.51 O ATOM 139 H GLY A 9 -9.265 -6.219 -2.394 1.00 0.41 H ATOM 140 HA2 GLY A 9 -10.041 -6.391 -5.218 1.00 0.39 H ATOM 141 HA3 GLY A 9 -9.896 -7.747 -4.117 1.00 0.47 H ATOM 142 N ASP A 10 -12.099 -7.253 -2.828 1.00 0.62 N ATOM 143 CA ASP A 10 -13.497 -7.262 -2.401 1.00 0.82 C ATOM 144 C ASP A 10 -13.767 -6.103 -1.455 1.00 0.85 C ATOM 145 O ASP A 10 -14.887 -5.609 -1.344 1.00 1.09 O ATOM 146 CB ASP A 10 -13.828 -8.593 -1.719 1.00 1.05 C ATOM 147 CG ASP A 10 -15.235 -8.636 -1.153 1.00 1.81 C ATOM 148 OD1 ASP A 10 -15.393 -8.492 0.075 1.00 2.41 O ATOM 149 OD2 ASP A 10 -16.193 -8.800 -1.938 1.00 2.32 O ATOM 150 H ASP A 10 -11.429 -7.718 -2.284 1.00 0.65 H ATOM 151 HA ASP A 10 -14.112 -7.148 -3.276 1.00 0.85 H ATOM 152 HB2 ASP A 10 -13.728 -9.392 -2.437 1.00 1.54 H ATOM 153 HB3 ASP A 10 -13.132 -8.756 -0.909 1.00 1.00 H ATOM 154 N ASN A 11 -12.713 -5.663 -0.795 1.00 0.71 N ATOM 155 CA ASN A 11 -12.787 -4.562 0.155 1.00 0.81 C ATOM 156 C ASN A 11 -12.359 -3.258 -0.506 1.00 0.62 C ATOM 157 O ASN A 11 -11.969 -2.308 0.168 1.00 0.71 O ATOM 158 CB ASN A 11 -11.908 -4.846 1.377 1.00 1.00 C ATOM 159 CG ASN A 11 -12.432 -5.982 2.234 1.00 1.72 C ATOM 160 OD1 ASN A 11 -12.088 -7.143 2.025 1.00 2.31 O ATOM 161 ND2 ASN A 11 -13.264 -5.655 3.212 1.00 2.49 N ATOM 162 H ASN A 11 -11.846 -6.094 -0.957 1.00 0.65 H ATOM 163 HA ASN A 11 -13.814 -4.470 0.475 1.00 0.95 H ATOM 164 HB2 ASN A 11 -10.914 -5.102 1.044 1.00 1.31 H ATOM 165 HB3 ASN A 11 -11.858 -3.956 1.986 1.00 1.48 H ATOM 166 HD21 ASN A 11 -13.494 -4.705 3.329 1.00 2.63 H ATOM 167 HD22 ASN A 11 -13.611 -6.372 3.786 1.00 3.19 H ATOM 168 N ALA A 12 -12.446 -3.220 -1.832 1.00 0.42 N ATOM 169 CA ALA A 12 -11.965 -2.087 -2.628 1.00 0.31 C ATOM 170 C ALA A 12 -12.871 -0.860 -2.522 1.00 0.32 C ATOM 171 O ALA A 12 -12.981 -0.075 -3.465 1.00 0.40 O ATOM 172 CB ALA A 12 -11.845 -2.501 -4.079 1.00 0.32 C ATOM 173 H ALA A 12 -12.865 -3.976 -2.298 1.00 0.44 H ATOM 174 HA ALA A 12 -10.980 -1.827 -2.273 1.00 0.38 H ATOM 175 HB1 ALA A 12 -12.826 -2.730 -4.465 1.00 1.05 H ATOM 176 HB2 ALA A 12 -11.215 -3.375 -4.152 1.00 0.95 H ATOM 177 HB3 ALA A 12 -11.413 -1.693 -4.647 1.00 1.02 H ATOM 178 N THR A 13 -13.501 -0.692 -1.379 1.00 0.36 N ATOM 179 CA THR A 13 -14.324 0.476 -1.120 1.00 0.43 C ATOM 180 C THR A 13 -13.455 1.725 -1.074 1.00 0.33 C ATOM 181 O THR A 13 -12.294 1.650 -0.673 1.00 0.24 O ATOM 182 CB THR A 13 -15.080 0.342 0.214 1.00 0.56 C ATOM 183 OG1 THR A 13 -14.153 0.096 1.281 1.00 0.59 O ATOM 184 CG2 THR A 13 -16.099 -0.781 0.149 1.00 0.74 C ATOM 185 H THR A 13 -13.392 -1.366 -0.681 1.00 0.41 H ATOM 186 HA THR A 13 -15.043 0.570 -1.919 1.00 0.52 H ATOM 187 HB THR A 13 -15.601 1.269 0.409 1.00 0.61 H ATOM 188 HG1 THR A 13 -14.077 -0.855 1.433 1.00 0.81 H ATOM 189 HG21 THR A 13 -16.616 -0.851 1.095 1.00 1.36 H ATOM 190 HG22 THR A 13 -15.595 -1.713 -0.055 1.00 1.35 H ATOM 191 HG23 THR A 13 -16.811 -0.575 -0.636 1.00 1.13 H ATOM 192 N PRO A 14 -13.991 2.886 -1.482 1.00 0.40 N ATOM 193 CA PRO A 14 -13.244 4.149 -1.461 1.00 0.38 C ATOM 194 C PRO A 14 -12.642 4.439 -0.089 1.00 0.30 C ATOM 195 O PRO A 14 -11.583 5.060 0.015 1.00 0.32 O ATOM 196 CB PRO A 14 -14.298 5.195 -1.819 1.00 0.52 C ATOM 197 CG PRO A 14 -15.339 4.452 -2.579 1.00 0.68 C ATOM 198 CD PRO A 14 -15.358 3.062 -2.009 1.00 0.56 C ATOM 199 HA PRO A 14 -12.461 4.154 -2.204 1.00 0.40 H ATOM 200 HB2 PRO A 14 -14.711 5.625 -0.914 1.00 0.61 H ATOM 201 HB3 PRO A 14 -13.866 5.964 -2.436 1.00 0.65 H ATOM 202 HG2 PRO A 14 -16.300 4.929 -2.446 1.00 0.90 H ATOM 203 HG3 PRO A 14 -15.076 4.417 -3.624 1.00 0.87 H ATOM 204 HD2 PRO A 14 -16.090 2.987 -1.218 1.00 0.63 H ATOM 205 HD3 PRO A 14 -15.566 2.341 -2.786 1.00 0.63 H ATOM 206 N GLU A 15 -13.311 3.965 0.958 1.00 0.34 N ATOM 207 CA GLU A 15 -12.842 4.159 2.320 1.00 0.38 C ATOM 208 C GLU A 15 -11.519 3.433 2.557 1.00 0.32 C ATOM 209 O GLU A 15 -10.548 4.024 3.036 1.00 0.39 O ATOM 210 CB GLU A 15 -13.892 3.665 3.311 1.00 0.53 C ATOM 211 CG GLU A 15 -15.175 4.476 3.298 1.00 0.69 C ATOM 212 CD GLU A 15 -16.145 4.039 4.375 1.00 1.65 C ATOM 213 OE1 GLU A 15 -15.872 4.285 5.566 1.00 1.97 O ATOM 214 OE2 GLU A 15 -17.191 3.447 4.032 1.00 2.44 O ATOM 215 H GLU A 15 -14.137 3.458 0.807 1.00 0.40 H ATOM 216 HA GLU A 15 -12.691 5.214 2.471 1.00 0.43 H ATOM 217 HB2 GLU A 15 -14.136 2.644 3.072 1.00 0.54 H ATOM 218 HB3 GLU A 15 -13.476 3.703 4.303 1.00 0.58 H ATOM 219 HG2 GLU A 15 -14.931 5.517 3.454 1.00 0.96 H ATOM 220 HG3 GLU A 15 -15.652 4.358 2.335 1.00 1.29 H ATOM 221 N LYS A 16 -11.483 2.153 2.208 1.00 0.27 N ATOM 222 CA LYS A 16 -10.296 1.337 2.425 1.00 0.26 C ATOM 223 C LYS A 16 -9.262 1.600 1.339 1.00 0.19 C ATOM 224 O LYS A 16 -8.058 1.565 1.589 1.00 0.25 O ATOM 225 CB LYS A 16 -10.667 -0.144 2.442 1.00 0.30 C ATOM 226 CG LYS A 16 -9.538 -1.049 2.907 1.00 0.44 C ATOM 227 CD LYS A 16 -9.973 -2.503 2.940 1.00 1.16 C ATOM 228 CE LYS A 16 -8.894 -3.410 3.513 1.00 1.17 C ATOM 229 NZ LYS A 16 -8.494 -3.007 4.886 1.00 1.80 N ATOM 230 H LYS A 16 -12.274 1.745 1.791 1.00 0.30 H ATOM 231 HA LYS A 16 -9.876 1.607 3.382 1.00 0.32 H ATOM 232 HB2 LYS A 16 -11.509 -0.282 3.101 1.00 0.38 H ATOM 233 HB3 LYS A 16 -10.951 -0.444 1.444 1.00 0.26 H ATOM 234 HG2 LYS A 16 -8.704 -0.948 2.228 1.00 1.12 H ATOM 235 HG3 LYS A 16 -9.235 -0.749 3.899 1.00 1.12 H ATOM 236 HD2 LYS A 16 -10.859 -2.588 3.550 1.00 1.84 H ATOM 237 HD3 LYS A 16 -10.198 -2.821 1.933 1.00 1.91 H ATOM 238 HE2 LYS A 16 -9.271 -4.421 3.541 1.00 1.60 H ATOM 239 HE3 LYS A 16 -8.029 -3.369 2.868 1.00 1.66 H ATOM 240 HZ1 LYS A 16 -7.854 -3.717 5.295 1.00 2.19 H ATOM 241 HZ2 LYS A 16 -9.331 -2.920 5.495 1.00 2.27 H ATOM 242 HZ3 LYS A 16 -8.001 -2.092 4.861 1.00 2.33 H ATOM 243 N LEU A 17 -9.744 1.873 0.138 1.00 0.14 N ATOM 244 CA LEU A 17 -8.879 2.135 -1.000 1.00 0.13 C ATOM 245 C LEU A 17 -7.999 3.355 -0.750 1.00 0.15 C ATOM 246 O LEU A 17 -6.825 3.371 -1.118 1.00 0.19 O ATOM 247 CB LEU A 17 -9.730 2.343 -2.253 1.00 0.18 C ATOM 248 CG LEU A 17 -8.962 2.593 -3.551 1.00 0.27 C ATOM 249 CD1 LEU A 17 -8.131 1.380 -3.938 1.00 0.30 C ATOM 250 CD2 LEU A 17 -9.928 2.945 -4.662 1.00 0.36 C ATOM 251 H LEU A 17 -10.720 1.878 0.004 1.00 0.16 H ATOM 252 HA LEU A 17 -8.251 1.273 -1.140 1.00 0.18 H ATOM 253 HB2 LEU A 17 -10.343 1.466 -2.391 1.00 0.20 H ATOM 254 HB3 LEU A 17 -10.380 3.189 -2.081 1.00 0.21 H ATOM 255 HG LEU A 17 -8.291 3.429 -3.412 1.00 0.29 H ATOM 256 HD11 LEU A 17 -7.292 1.285 -3.269 1.00 1.08 H ATOM 257 HD12 LEU A 17 -7.774 1.498 -4.950 1.00 1.00 H ATOM 258 HD13 LEU A 17 -8.746 0.492 -3.874 1.00 1.02 H ATOM 259 HD21 LEU A 17 -10.624 2.131 -4.802 1.00 1.09 H ATOM 260 HD22 LEU A 17 -9.380 3.113 -5.577 1.00 1.04 H ATOM 261 HD23 LEU A 17 -10.470 3.840 -4.396 1.00 1.12 H ATOM 262 N ALA A 18 -8.562 4.376 -0.119 1.00 0.16 N ATOM 263 CA ALA A 18 -7.794 5.561 0.237 1.00 0.21 C ATOM 264 C ALA A 18 -6.738 5.218 1.280 1.00 0.20 C ATOM 265 O ALA A 18 -5.631 5.754 1.253 1.00 0.23 O ATOM 266 CB ALA A 18 -8.711 6.659 0.741 1.00 0.27 C ATOM 267 H ALA A 18 -9.518 4.335 0.107 1.00 0.17 H ATOM 268 HA ALA A 18 -7.295 5.917 -0.656 1.00 0.25 H ATOM 269 HB1 ALA A 18 -9.456 6.875 -0.008 1.00 1.10 H ATOM 270 HB2 ALA A 18 -8.130 7.547 0.941 1.00 1.03 H ATOM 271 HB3 ALA A 18 -9.196 6.333 1.650 1.00 1.03 H ATOM 272 N LYS A 19 -7.081 4.306 2.183 1.00 0.19 N ATOM 273 CA LYS A 19 -6.145 3.845 3.201 1.00 0.22 C ATOM 274 C LYS A 19 -5.016 3.055 2.548 1.00 0.22 C ATOM 275 O LYS A 19 -3.859 3.149 2.954 1.00 0.27 O ATOM 276 CB LYS A 19 -6.866 2.983 4.241 1.00 0.29 C ATOM 277 CG LYS A 19 -5.978 2.552 5.399 1.00 0.43 C ATOM 278 CD LYS A 19 -6.705 1.616 6.352 1.00 1.34 C ATOM 279 CE LYS A 19 -7.917 2.280 6.989 1.00 1.73 C ATOM 280 NZ LYS A 19 -8.586 1.390 7.977 1.00 2.54 N ATOM 281 H LYS A 19 -7.987 3.932 2.164 1.00 0.19 H ATOM 282 HA LYS A 19 -5.728 4.714 3.688 1.00 0.25 H ATOM 283 HB2 LYS A 19 -7.697 3.543 4.642 1.00 0.34 H ATOM 284 HB3 LYS A 19 -7.243 2.095 3.754 1.00 0.28 H ATOM 285 HG2 LYS A 19 -5.113 2.042 5.003 1.00 0.87 H ATOM 286 HG3 LYS A 19 -5.661 3.430 5.942 1.00 1.07 H ATOM 287 HD2 LYS A 19 -7.034 0.747 5.804 1.00 1.98 H ATOM 288 HD3 LYS A 19 -6.022 1.314 7.131 1.00 1.95 H ATOM 289 HE2 LYS A 19 -7.597 3.181 7.489 1.00 2.11 H ATOM 290 HE3 LYS A 19 -8.624 2.533 6.211 1.00 2.03 H ATOM 291 HZ1 LYS A 19 -8.896 0.510 7.517 1.00 3.08 H ATOM 292 HZ2 LYS A 19 -9.416 1.865 8.383 1.00 2.94 H ATOM 293 HZ3 LYS A 19 -7.929 1.150 8.748 1.00 2.86 H HETATM 294 N 0A1 A 20 -5.370 2.282 1.524 1.00 0.20 N HETATM 295 CA 0A1 A 20 -4.394 1.550 0.724 1.00 0.22 C HETATM 296 CB 0A1 A 20 -5.117 0.695 -0.327 1.00 0.23 C HETATM 297 CG 0A1 A 20 -4.192 -0.008 -1.299 1.00 0.26 C HETATM 298 CD1 0A1 A 20 -4.022 0.467 -2.595 1.00 0.31 C HETATM 299 CE1 0A1 A 20 -3.174 -0.172 -3.485 1.00 0.37 C HETATM 300 CZ 0A1 A 20 -2.486 -1.300 -3.085 1.00 0.39 C HETATM 301 OH 0A1 A 20 -1.631 -1.933 -3.982 1.00 0.48 O HETATM 302 CM 0A1 A 20 -0.573 -2.603 -3.276 1.00 0.78 C HETATM 303 CE2 0A1 A 20 -2.644 -1.786 -1.799 1.00 0.38 C HETATM 304 CD2 0A1 A 20 -3.490 -1.141 -0.919 1.00 0.32 C HETATM 305 C 0A1 A 20 -3.436 2.522 0.047 1.00 0.23 C HETATM 306 O 0A1 A 20 -2.219 2.361 0.113 1.00 0.26 O HETATM 307 HN1 0A1 A 20 -6.325 2.190 1.310 1.00 0.19 H HETATM 308 HA 0A1 A 20 -3.834 0.906 1.383 1.00 0.26 H HETATM 309 HBC1 0A1 A 20 -5.780 1.327 -0.899 1.00 0.23 H HETATM 310 HBC2 0A1 A 20 -5.698 -0.061 0.176 1.00 0.26 H HETATM 311 HD1 0A1 A 20 -4.562 1.351 -2.906 1.00 0.34 H HETATM 312 HD2 0A1 A 20 -3.614 -1.523 0.082 1.00 0.36 H HETATM 313 HE1 0A1 A 20 -3.056 0.212 -4.486 1.00 0.44 H HETATM 314 HE2 0A1 A 20 -2.111 -2.670 -1.480 1.00 0.45 H HETATM 315 HMC1 0A1 A 20 0.348 -2.521 -3.834 1.00 1.34 H HETATM 316 HMC2 0A1 A 20 -0.829 -3.642 -3.145 1.00 1.25 H HETATM 317 HMC3 0A1 A 20 -0.451 -2.145 -2.303 1.00 1.48 H ATOM 318 N GLN A 21 -4.004 3.543 -0.581 1.00 0.21 N ATOM 319 CA GLN A 21 -3.224 4.572 -1.261 1.00 0.26 C ATOM 320 C GLN A 21 -2.324 5.308 -0.281 1.00 0.29 C ATOM 321 O GLN A 21 -1.175 5.631 -0.588 1.00 0.34 O ATOM 322 CB GLN A 21 -4.168 5.557 -1.943 1.00 0.27 C ATOM 323 CG GLN A 21 -4.986 4.918 -3.046 1.00 0.30 C ATOM 324 CD GLN A 21 -6.045 5.842 -3.606 1.00 1.32 C ATOM 325 OE1 GLN A 21 -5.799 6.600 -4.543 1.00 1.99 O ATOM 326 NE2 GLN A 21 -7.239 5.761 -3.051 1.00 1.78 N ATOM 327 H GLN A 21 -4.985 3.603 -0.596 1.00 0.19 H ATOM 328 HA GLN A 21 -2.613 4.091 -2.009 1.00 0.28 H ATOM 329 HB2 GLN A 21 -4.847 5.956 -1.203 1.00 0.25 H ATOM 330 HB3 GLN A 21 -3.593 6.364 -2.364 1.00 0.33 H ATOM 331 HG2 GLN A 21 -4.324 4.625 -3.844 1.00 0.95 H ATOM 332 HG3 GLN A 21 -5.473 4.044 -2.641 1.00 0.92 H ATOM 333 HE21 GLN A 21 -7.368 5.113 -2.325 1.00 1.48 H ATOM 334 HE22 GLN A 21 -7.952 6.352 -3.384 1.00 2.56 H ATOM 335 N ALA A 22 -2.855 5.558 0.905 1.00 0.27 N ATOM 336 CA ALA A 22 -2.106 6.242 1.949 1.00 0.33 C ATOM 337 C ALA A 22 -1.022 5.340 2.533 1.00 0.31 C ATOM 338 O ALA A 22 0.035 5.813 2.944 1.00 0.34 O ATOM 339 CB ALA A 22 -3.042 6.727 3.046 1.00 0.38 C ATOM 340 H ALA A 22 -3.784 5.286 1.078 1.00 0.24 H ATOM 341 HA ALA A 22 -1.637 7.107 1.503 1.00 0.36 H ATOM 342 HB1 ALA A 22 -2.477 7.266 3.790 1.00 1.04 H ATOM 343 HB2 ALA A 22 -3.527 5.878 3.507 1.00 1.08 H ATOM 344 HB3 ALA A 22 -3.790 7.378 2.619 1.00 1.13 H ATOM 345 N ASP A 23 -1.277 4.037 2.556 1.00 0.28 N ATOM 346 CA ASP A 23 -0.320 3.086 3.109 1.00 0.28 C ATOM 347 C ASP A 23 0.790 2.822 2.106 1.00 0.24 C ATOM 348 O ASP A 23 1.895 2.421 2.471 1.00 0.24 O ATOM 349 CB ASP A 23 -1.002 1.775 3.502 1.00 0.30 C ATOM 350 CG ASP A 23 -0.167 0.966 4.477 1.00 0.36 C ATOM 351 OD1 ASP A 23 -0.022 1.405 5.636 1.00 0.57 O ATOM 352 OD2 ASP A 23 0.331 -0.115 4.097 1.00 0.55 O ATOM 353 H ASP A 23 -2.128 3.708 2.199 1.00 0.28 H ATOM 354 HA ASP A 23 0.114 3.533 3.993 1.00 0.31 H ATOM 355 HB2 ASP A 23 -1.954 1.994 3.964 1.00 0.33 H ATOM 356 HB3 ASP A 23 -1.166 1.180 2.615 1.00 0.31 H ATOM 357 N LEU A 24 0.490 3.056 0.834 1.00 0.24 N ATOM 358 CA LEU A 24 1.499 2.987 -0.211 1.00 0.22 C ATOM 359 C LEU A 24 2.583 4.029 0.035 1.00 0.23 C ATOM 360 O LEU A 24 3.720 3.861 -0.394 1.00 0.22 O ATOM 361 CB LEU A 24 0.871 3.201 -1.589 1.00 0.26 C ATOM 362 CG LEU A 24 -0.038 2.072 -2.074 1.00 0.29 C ATOM 363 CD1 LEU A 24 -0.618 2.414 -3.432 1.00 0.32 C ATOM 364 CD2 LEU A 24 0.727 0.759 -2.143 1.00 0.27 C ATOM 365 H LEU A 24 -0.437 3.269 0.593 1.00 0.27 H ATOM 366 HA LEU A 24 1.944 2.005 -0.177 1.00 0.22 H ATOM 367 HB2 LEU A 24 0.291 4.112 -1.558 1.00 0.30 H ATOM 368 HB3 LEU A 24 1.667 3.324 -2.307 1.00 0.24 H ATOM 369 HG LEU A 24 -0.857 1.949 -1.380 1.00 0.32 H ATOM 370 HD11 LEU A 24 -1.175 3.335 -3.362 1.00 1.15 H ATOM 371 HD12 LEU A 24 -1.273 1.619 -3.755 1.00 1.08 H ATOM 372 HD13 LEU A 24 0.185 2.532 -4.145 1.00 0.97 H ATOM 373 HD21 LEU A 24 0.075 -0.017 -2.514 1.00 0.96 H ATOM 374 HD22 LEU A 24 1.078 0.494 -1.157 1.00 0.98 H ATOM 375 HD23 LEU A 24 1.571 0.870 -2.808 1.00 1.03 H ATOM 376 N ALA A 25 2.225 5.096 0.745 1.00 0.26 N ATOM 377 CA ALA A 25 3.187 6.119 1.128 1.00 0.30 C ATOM 378 C ALA A 25 4.232 5.551 2.083 1.00 0.28 C ATOM 379 O ALA A 25 5.309 6.118 2.254 1.00 0.33 O ATOM 380 CB ALA A 25 2.481 7.312 1.750 1.00 0.37 C ATOM 381 H ALA A 25 1.288 5.197 1.013 1.00 0.28 H ATOM 382 HA ALA A 25 3.684 6.452 0.232 1.00 0.34 H ATOM 383 HB1 ALA A 25 3.207 8.073 1.994 1.00 1.08 H ATOM 384 HB2 ALA A 25 1.970 7.000 2.649 1.00 1.05 H ATOM 385 HB3 ALA A 25 1.763 7.713 1.050 1.00 1.09 H ATOM 386 N LYS A 26 3.901 4.434 2.709 1.00 0.26 N ATOM 387 CA LYS A 26 4.851 3.717 3.536 1.00 0.28 C ATOM 388 C LYS A 26 5.597 2.704 2.679 1.00 0.22 C ATOM 389 O LYS A 26 6.826 2.718 2.599 1.00 0.22 O ATOM 390 CB LYS A 26 4.142 2.975 4.670 1.00 0.38 C ATOM 391 CG LYS A 26 3.204 3.827 5.506 1.00 0.49 C ATOM 392 CD LYS A 26 2.656 3.026 6.680 1.00 1.26 C ATOM 393 CE LYS A 26 1.560 3.772 7.423 1.00 1.78 C ATOM 394 NZ LYS A 26 0.316 3.888 6.617 1.00 2.48 N ATOM 395 H LYS A 26 2.993 4.079 2.605 1.00 0.26 H ATOM 396 HA LYS A 26 5.552 4.425 3.948 1.00 0.33 H ATOM 397 HB2 LYS A 26 3.566 2.169 4.244 1.00 0.39 H ATOM 398 HB3 LYS A 26 4.889 2.557 5.323 1.00 0.43 H ATOM 399 HG2 LYS A 26 3.744 4.683 5.884 1.00 0.94 H ATOM 400 HG3 LYS A 26 2.381 4.156 4.889 1.00 0.89 H ATOM 401 HD2 LYS A 26 2.252 2.097 6.308 1.00 1.84 H ATOM 402 HD3 LYS A 26 3.466 2.817 7.365 1.00 1.81 H ATOM 403 HE2 LYS A 26 1.337 3.241 8.337 1.00 2.10 H ATOM 404 HE3 LYS A 26 1.917 4.762 7.662 1.00 2.31 H ATOM 405 HZ1 LYS A 26 -0.447 4.302 7.192 1.00 2.99 H ATOM 406 HZ2 LYS A 26 0.015 2.945 6.281 1.00 2.94 H ATOM 407 HZ3 LYS A 26 0.481 4.499 5.793 1.00 2.73 H HETATM 408 N 0A1 A 27 4.823 1.850 2.018 1.00 0.21 N HETATM 409 CA 0A1 A 27 5.363 0.744 1.238 1.00 0.19 C HETATM 410 CB 0A1 A 27 4.225 -0.118 0.682 1.00 0.23 C HETATM 411 CG 0A1 A 27 4.702 -1.229 -0.231 1.00 0.22 C HETATM 412 CD1 0A1 A 27 4.454 -1.185 -1.596 1.00 1.04 C HETATM 413 CE1 0A1 A 27 4.897 -2.184 -2.436 1.00 1.12 C HETATM 414 CZ 0A1 A 27 5.601 -3.257 -1.916 1.00 0.33 C HETATM 415 OH 0A1 A 27 6.059 -4.274 -2.744 1.00 0.42 O HETATM 416 CM 0A1 A 27 5.329 -4.291 -3.981 1.00 0.78 C HETATM 417 CE2 0A1 A 27 5.862 -3.321 -0.564 1.00 1.02 C HETATM 418 CD2 0A1 A 27 5.414 -2.312 0.269 1.00 1.06 C HETATM 419 C 0A1 A 27 6.252 1.223 0.095 1.00 0.15 C HETATM 420 O 0A1 A 27 7.423 0.872 0.038 1.00 0.19 O HETATM 421 HN1 0A1 A 27 3.847 1.963 2.066 1.00 0.23 H HETATM 422 HA 0A1 A 27 5.959 0.139 1.902 1.00 0.24 H HETATM 423 HBC1 0A1 A 27 3.550 0.508 0.120 1.00 0.24 H HETATM 424 HBC2 0A1 A 27 3.689 -0.569 1.504 1.00 0.30 H HETATM 425 HD1 0A1 A 27 3.901 -0.354 -2.003 1.00 1.81 H HETATM 426 HD2 0A1 A 27 5.616 -2.363 1.328 1.00 1.88 H HETATM 427 HE1 0A1 A 27 4.694 -2.123 -3.493 1.00 1.94 H HETATM 428 HE2 0A1 A 27 6.411 -4.156 -0.152 1.00 1.79 H HETATM 429 HMC1 0A1 A 27 5.257 -5.303 -4.348 1.00 1.41 H HETATM 430 HMC2 0A1 A 27 5.832 -3.673 -4.707 1.00 1.11 H HETATM 431 HMC3 0A1 A 27 4.335 -3.896 -3.808 1.00 1.38 H ATOM 432 N GLN A 28 5.695 2.030 -0.801 1.00 0.15 N ATOM 433 CA GLN A 28 6.407 2.445 -2.007 1.00 0.22 C ATOM 434 C GLN A 28 7.644 3.264 -1.658 1.00 0.27 C ATOM 435 O GLN A 28 8.679 3.154 -2.317 1.00 0.36 O ATOM 436 CB GLN A 28 5.488 3.254 -2.924 1.00 0.27 C ATOM 437 CG GLN A 28 4.250 2.498 -3.376 1.00 0.37 C ATOM 438 CD GLN A 28 3.334 3.341 -4.243 1.00 0.45 C ATOM 439 OE1 GLN A 28 3.278 4.565 -4.106 1.00 0.72 O ATOM 440 NE2 GLN A 28 2.601 2.694 -5.132 1.00 0.38 N ATOM 441 H GLN A 28 4.786 2.371 -0.643 1.00 0.16 H ATOM 442 HA GLN A 28 6.721 1.551 -2.528 1.00 0.27 H ATOM 443 HB2 GLN A 28 5.168 4.142 -2.398 1.00 0.26 H ATOM 444 HB3 GLN A 28 6.044 3.549 -3.802 1.00 0.35 H ATOM 445 HG2 GLN A 28 4.559 1.632 -3.943 1.00 0.44 H ATOM 446 HG3 GLN A 28 3.700 2.178 -2.503 1.00 0.38 H ATOM 447 HE21 GLN A 28 2.690 1.715 -5.181 1.00 0.46 H ATOM 448 HE22 GLN A 28 1.999 3.212 -5.704 1.00 0.43 H ATOM 449 N LYS A 29 7.533 4.076 -0.616 1.00 0.26 N ATOM 450 CA LYS A 29 8.636 4.901 -0.173 1.00 0.36 C ATOM 451 C LYS A 29 9.799 4.029 0.291 1.00 0.43 C ATOM 452 O LYS A 29 10.933 4.185 -0.169 1.00 0.55 O ATOM 453 CB LYS A 29 8.174 5.809 0.962 1.00 0.38 C ATOM 454 CG LYS A 29 9.155 6.917 1.275 1.00 0.53 C ATOM 455 CD LYS A 29 8.690 7.775 2.443 1.00 0.84 C ATOM 456 CE LYS A 29 7.374 8.482 2.146 1.00 1.50 C ATOM 457 NZ LYS A 29 7.462 9.355 0.947 1.00 2.36 N ATOM 458 H LYS A 29 6.685 4.125 -0.135 1.00 0.23 H ATOM 459 HA LYS A 29 8.959 5.507 -1.006 1.00 0.42 H ATOM 460 HB2 LYS A 29 7.230 6.256 0.689 1.00 0.38 H ATOM 461 HB3 LYS A 29 8.038 5.214 1.854 1.00 0.40 H ATOM 462 HG2 LYS A 29 10.106 6.476 1.519 1.00 0.70 H ATOM 463 HG3 LYS A 29 9.257 7.540 0.400 1.00 0.74 H ATOM 464 HD2 LYS A 29 8.558 7.143 3.309 1.00 1.31 H ATOM 465 HD3 LYS A 29 9.446 8.517 2.652 1.00 1.23 H ATOM 466 HE2 LYS A 29 6.609 7.738 1.982 1.00 1.91 H ATOM 467 HE3 LYS A 29 7.105 9.086 3.001 1.00 2.00 H ATOM 468 HZ1 LYS A 29 7.666 8.786 0.100 1.00 2.75 H ATOM 469 HZ2 LYS A 29 8.218 10.057 1.067 1.00 2.67 H ATOM 470 HZ3 LYS A 29 6.562 9.856 0.801 1.00 2.94 H ATOM 471 N ASP A 30 9.505 3.108 1.201 1.00 0.41 N ATOM 472 CA ASP A 30 10.518 2.203 1.726 1.00 0.52 C ATOM 473 C ASP A 30 10.973 1.218 0.651 1.00 0.49 C ATOM 474 O ASP A 30 12.102 0.741 0.674 1.00 0.61 O ATOM 475 CB ASP A 30 9.983 1.445 2.942 1.00 0.57 C ATOM 476 CG ASP A 30 11.081 0.740 3.717 1.00 0.71 C ATOM 477 OD1 ASP A 30 11.384 -0.428 3.397 1.00 0.75 O ATOM 478 OD2 ASP A 30 11.655 1.348 4.641 1.00 0.94 O ATOM 479 H ASP A 30 8.581 3.033 1.529 1.00 0.37 H ATOM 480 HA ASP A 30 11.367 2.799 2.031 1.00 0.63 H ATOM 481 HB2 ASP A 30 9.491 2.140 3.604 1.00 0.65 H ATOM 482 HB3 ASP A 30 9.270 0.704 2.611 1.00 0.48 H ATOM 483 N LEU A 31 10.084 0.925 -0.294 1.00 0.37 N ATOM 484 CA LEU A 31 10.387 0.009 -1.389 1.00 0.41 C ATOM 485 C LEU A 31 11.538 0.540 -2.234 1.00 0.58 C ATOM 486 O LEU A 31 12.403 -0.221 -2.667 1.00 0.65 O ATOM 487 CB LEU A 31 9.146 -0.193 -2.267 1.00 0.39 C ATOM 488 CG LEU A 31 9.274 -1.241 -3.376 1.00 0.55 C ATOM 489 CD1 LEU A 31 9.339 -2.644 -2.789 1.00 1.16 C ATOM 490 CD2 LEU A 31 8.114 -1.123 -4.351 1.00 1.33 C ATOM 491 H LEU A 31 9.186 1.318 -0.240 1.00 0.30 H ATOM 492 HA LEU A 31 10.676 -0.935 -0.958 1.00 0.41 H ATOM 493 HB2 LEU A 31 8.325 -0.480 -1.627 1.00 0.33 H ATOM 494 HB3 LEU A 31 8.902 0.754 -2.727 1.00 0.44 H ATOM 495 HG LEU A 31 10.191 -1.067 -3.922 1.00 1.45 H ATOM 496 HD11 LEU A 31 8.513 -2.786 -2.107 1.00 1.78 H ATOM 497 HD12 LEU A 31 10.270 -2.776 -2.261 1.00 1.78 H ATOM 498 HD13 LEU A 31 9.273 -3.369 -3.587 1.00 1.70 H ATOM 499 HD21 LEU A 31 8.119 -0.140 -4.798 1.00 1.86 H ATOM 500 HD22 LEU A 31 7.184 -1.275 -3.824 1.00 1.86 H ATOM 501 HD23 LEU A 31 8.217 -1.870 -5.124 1.00 2.00 H ATOM 502 N ALA A 32 11.544 1.848 -2.460 1.00 0.66 N ATOM 503 CA ALA A 32 12.626 2.493 -3.190 1.00 0.86 C ATOM 504 C ALA A 32 13.932 2.391 -2.408 1.00 0.94 C ATOM 505 O ALA A 32 15.011 2.271 -2.985 1.00 1.08 O ATOM 506 CB ALA A 32 12.282 3.946 -3.471 1.00 0.96 C ATOM 507 H ALA A 32 10.797 2.393 -2.128 1.00 0.61 H ATOM 508 HA ALA A 32 12.742 1.983 -4.136 1.00 0.91 H ATOM 509 HB1 ALA A 32 13.086 4.407 -4.025 1.00 1.56 H ATOM 510 HB2 ALA A 32 12.143 4.469 -2.536 1.00 1.38 H ATOM 511 HB3 ALA A 32 11.372 3.995 -4.049 1.00 1.28 H ATOM 512 N ASP A 33 13.814 2.426 -1.087 1.00 0.91 N ATOM 513 CA ASP A 33 14.964 2.291 -0.196 1.00 1.06 C ATOM 514 C ASP A 33 15.440 0.841 -0.160 1.00 1.02 C ATOM 515 O ASP A 33 16.635 0.564 -0.059 1.00 1.18 O ATOM 516 CB ASP A 33 14.586 2.770 1.209 1.00 1.12 C ATOM 517 CG ASP A 33 15.684 2.546 2.227 1.00 1.31 C ATOM 518 OD1 ASP A 33 16.669 3.317 2.229 1.00 1.46 O ATOM 519 OD2 ASP A 33 15.551 1.614 3.048 1.00 1.38 O ATOM 520 H ASP A 33 12.924 2.545 -0.694 1.00 0.83 H ATOM 521 HA ASP A 33 15.759 2.913 -0.580 1.00 1.20 H ATOM 522 HB2 ASP A 33 14.365 3.826 1.175 1.00 1.16 H ATOM 523 HB3 ASP A 33 13.705 2.236 1.535 1.00 1.04 H HETATM 524 N 0A1 A 34 14.484 -0.076 -0.242 1.00 0.84 N HETATM 525 CA 0A1 A 34 14.765 -1.503 -0.323 1.00 0.82 C HETATM 526 CB 0A1 A 34 13.449 -2.284 -0.346 1.00 0.66 C HETATM 527 CG 0A1 A 34 13.605 -3.750 -0.681 1.00 0.70 C HETATM 528 CD1 0A1 A 34 12.997 -4.288 -1.805 1.00 1.27 C HETATM 529 CE1 0A1 A 34 13.138 -5.623 -2.123 1.00 1.35 C HETATM 530 CZ 0A1 A 34 13.895 -6.445 -1.315 1.00 0.94 C HETATM 531 OH 0A1 A 34 14.025 -7.790 -1.657 1.00 1.11 O HETATM 532 CM 0A1 A 34 15.168 -8.384 -1.019 1.00 1.53 C HETATM 533 CE2 0A1 A 34 14.513 -5.925 -0.186 1.00 1.52 C HETATM 534 CD2 0A1 A 34 14.363 -4.588 0.120 1.00 1.45 C HETATM 535 C 0A1 A 34 15.597 -1.820 -1.563 1.00 0.88 C HETATM 536 O 0A1 A 34 16.550 -2.599 -1.503 1.00 1.46 O HETATM 537 HN1 0A1 A 34 13.546 0.222 -0.231 1.00 0.74 H HETATM 538 HA 0A1 A 34 15.323 -1.791 0.552 1.00 0.94 H HETATM 539 HBC1 0A1 A 34 12.796 -1.843 -1.081 1.00 0.60 H HETATM 540 HBC2 0A1 A 34 12.984 -2.217 0.625 1.00 0.69 H HETATM 541 HD1 0A1 A 34 12.404 -3.647 -2.438 1.00 2.06 H HETATM 542 HD2 0A1 A 34 14.842 -4.183 1.000 1.00 2.25 H HETATM 543 HE1 0A1 A 34 12.656 -6.018 -3.004 1.00 2.14 H HETATM 544 HE2 0A1 A 34 15.106 -6.554 0.455 1.00 2.34 H HETATM 545 HMC1 0A1 A 34 15.577 -9.157 -1.652 1.00 1.87 H HETATM 546 HMC2 0A1 A 34 14.877 -8.805 -0.070 1.00 2.13 H HETATM 547 HMC3 0A1 A 34 15.917 -7.621 -0.852 1.00 2.08 H HETATM 548 N NH2 A 35 15.246 -1.205 -2.682 1.00 1.14 N HETATM 549 HN1 NH2 A 35 14.610 -0.879 -2.009 1.00 1.36 H HETATM 550 HN2 NH2 A 35 15.235 -0.919 -3.620 1.00 1.45 H TER 551 NH2 A 35