ATOM 32 N GLN S 3 -12.941 -3.177 0.295 1.00 0.47 N ATOM 33 CA GLN S 3 -12.305 -4.483 0.182 1.00 0.32 C ATOM 34 C GLN S 3 -10.908 -4.379 -0.394 1.00 0.20 C ATOM 35 O GLN S 3 -10.137 -5.349 -0.348 1.00 0.16 O ATOM 36 CB GLN S 3 -13.152 -5.418 -0.684 1.00 0.41 C ATOM 37 CG GLN S 3 -13.190 -5.024 -2.152 1.00 1.00 C ATOM 38 CD GLN S 3 -13.903 -6.047 -3.015 1.00 1.06 C ATOM 39 OE1 GLN S 3 -13.916 -7.239 -2.702 1.00 1.31 O ATOM 40 NE2 GLN S 3 -14.497 -5.588 -4.110 1.00 1.80 N ATOM 41 H GLN S 3 -13.508 -2.873 -0.442 1.00 0.79 H ATOM 42 HA GLN S 3 -12.226 -4.897 1.168 1.00 0.34 H ATOM 43 HB2 GLN S 3 -12.751 -6.419 -0.612 1.00 1.09 H ATOM 44 HB3 GLN S 3 -14.163 -5.419 -0.308 1.00 1.01 H ATOM 45 HG2 GLN S 3 -13.705 -4.080 -2.244 1.00 1.66 H ATOM 46 HG3 GLN S 3 -12.177 -4.918 -2.509 1.00 1.68 H ATOM 47 HE21 GLN S 3 -14.442 -4.629 -4.299 1.00 2.41 H ATOM 48 HE22 GLN S 3 -14.966 -6.229 -4.685 1.00 1.95 H ATOM 49 N GLU S 4 -10.564 -3.217 -0.937 1.00 0.22 N ATOM 50 CA GLU S 4 -9.269 -3.093 -1.564 1.00 0.23 C ATOM 51 C GLU S 4 -8.149 -3.298 -0.570 1.00 0.21 C ATOM 52 O GLU S 4 -7.049 -3.682 -0.949 1.00 0.27 O ATOM 53 CB GLU S 4 -9.098 -1.766 -2.325 1.00 0.28 C ATOM 54 CG GLU S 4 -8.872 -0.534 -1.455 1.00 0.28 C ATOM 55 CD GLU S 4 -7.588 -0.583 -0.648 1.00 0.92 C ATOM 56 OE1 GLU S 4 -7.631 -0.256 0.555 1.00 1.37 O ATOM 57 OE2 GLU S 4 -6.541 -0.954 -1.217 1.00 1.34 O ATOM 58 H GLU S 4 -11.163 -2.435 -0.869 1.00 0.28 H ATOM 59 HA GLU S 4 -9.220 -3.902 -2.271 1.00 0.25 H ATOM 60 HB2 GLU S 4 -8.251 -1.858 -2.986 1.00 0.34 H ATOM 61 HB3 GLU S 4 -9.982 -1.596 -2.922 1.00 0.33 H ATOM 62 HG2 GLU S 4 -8.824 0.328 -2.104 1.00 0.68 H ATOM 63 HG3 GLU S 4 -9.705 -0.429 -0.778 1.00 0.62 H ATOM 64 N THR S 5 -8.410 -3.048 0.702 1.00 0.17 N ATOM 65 CA THR S 5 -7.378 -3.235 1.696 1.00 0.20 C ATOM 66 C THR S 5 -6.900 -4.676 1.672 1.00 0.20 C ATOM 67 O THR S 5 -5.745 -4.957 1.358 1.00 0.22 O ATOM 68 CB THR S 5 -7.890 -2.898 3.108 1.00 0.21 C ATOM 69 OG1 THR S 5 -9.271 -3.261 3.223 1.00 0.99 O ATOM 70 CG2 THR S 5 -7.718 -1.419 3.411 1.00 1.04 C ATOM 71 H THR S 5 -9.300 -2.748 0.981 1.00 0.18 H ATOM 72 HA THR S 5 -6.553 -2.579 1.460 1.00 0.23 H ATOM 73 HB THR S 5 -7.319 -3.469 3.826 1.00 0.71 H ATOM 74 HG1 THR S 5 -9.375 -3.908 3.924 1.00 1.46 H ATOM 75 HG21 THR S 5 -6.674 -1.154 3.331 1.00 1.61 H ATOM 76 HG22 THR S 5 -8.293 -0.837 2.705 1.00 1.62 H ATOM 77 HG23 THR S 5 -8.066 -1.215 4.413 1.00 1.63 H ATOM 78 N ARG S 6 -7.803 -5.589 1.997 1.00 0.19 N ATOM 79 CA ARG S 6 -7.479 -7.005 2.009 1.00 0.20 C ATOM 80 C ARG S 6 -6.655 -7.437 0.804 1.00 0.17 C ATOM 81 O ARG S 6 -5.479 -7.772 0.950 1.00 0.17 O ATOM 82 CB ARG S 6 -8.765 -7.830 2.078 1.00 0.27 C ATOM 83 CG ARG S 6 -9.734 -7.337 3.141 1.00 0.82 C ATOM 84 CD ARG S 6 -11.087 -8.030 3.049 1.00 0.61 C ATOM 85 NE ARG S 6 -11.578 -8.102 1.675 1.00 0.94 N ATOM 86 CZ ARG S 6 -12.801 -8.509 1.348 1.00 1.24 C ATOM 87 NH1 ARG S 6 -13.658 -8.871 2.294 1.00 1.00 N ATOM 88 NH2 ARG S 6 -13.169 -8.553 0.074 1.00 1.95 N ATOM 89 H ARG S 6 -8.653 -5.307 2.382 1.00 0.19 H ATOM 90 HA ARG S 6 -6.904 -7.197 2.900 1.00 0.23 H ATOM 91 HB2 ARG S 6 -9.260 -7.788 1.119 1.00 0.95 H ATOM 92 HB3 ARG S 6 -8.513 -8.857 2.299 1.00 0.83 H ATOM 93 HG2 ARG S 6 -9.309 -7.530 4.114 1.00 1.40 H ATOM 94 HG3 ARG S 6 -9.874 -6.273 3.014 1.00 1.47 H ATOM 95 HD2 ARG S 6 -10.992 -9.031 3.440 1.00 0.70 H ATOM 96 HD3 ARG S 6 -11.803 -7.474 3.648 1.00 1.03 H ATOM 97 HE ARG S 6 -10.962 -7.837 0.959 1.00 1.26 H ATOM 98 HH11 ARG S 6 -13.385 -8.840 3.256 1.00 0.81 H ATOM 99 HH12 ARG S 6 -14.578 -9.175 2.045 1.00 1.29 H ATOM 100 HH21 ARG S 6 -12.526 -8.281 -0.641 1.00 2.27 H ATOM 101 HH22 ARG S 6 -14.089 -8.858 -0.170 1.00 2.22 H ATOM 102 N ASP S 7 -7.232 -7.376 -0.392 1.00 0.17 N ATOM 103 CA ASP S 7 -6.527 -7.836 -1.594 1.00 0.18 C ATOM 104 C ASP S 7 -5.407 -6.916 -2.075 1.00 0.16 C ATOM 105 O ASP S 7 -4.317 -7.388 -2.389 1.00 0.16 O ATOM 106 CB ASP S 7 -7.528 -8.042 -2.718 1.00 0.24 C ATOM 107 CG ASP S 7 -6.889 -8.612 -3.970 1.00 0.73 C ATOM 108 OD1 ASP S 7 -6.410 -7.817 -4.805 1.00 1.06 O ATOM 109 OD2 ASP S 7 -6.868 -9.853 -4.114 1.00 1.30 O ATOM 110 H ASP S 7 -8.166 -7.076 -0.501 1.00 0.18 H ATOM 111 HA ASP S 7 -6.097 -8.786 -1.370 1.00 0.18 H ATOM 112 HB2 ASP S 7 -8.300 -8.720 -2.388 1.00 0.74 H ATOM 113 HB3 ASP S 7 -7.964 -7.097 -2.958 1.00 0.50 H ATOM 114 N GLN S 8 -5.660 -5.618 -2.133 1.00 0.17 N ATOM 115 CA GLN S 8 -4.651 -4.688 -2.633 1.00 0.18 C ATOM 116 C GLN S 8 -3.635 -4.311 -1.561 1.00 0.17 C ATOM 117 O GLN S 8 -2.444 -4.563 -1.719 1.00 0.17 O ATOM 118 CB GLN S 8 -5.306 -3.429 -3.199 1.00 0.19 C ATOM 119 CG GLN S 8 -6.383 -3.712 -4.237 1.00 0.31 C ATOM 120 CD GLN S 8 -5.815 -4.200 -5.557 1.00 0.49 C ATOM 121 OE1 GLN S 8 -4.772 -4.855 -5.597 1.00 1.34 O ATOM 122 NE2 GLN S 8 -6.502 -3.881 -6.649 1.00 1.25 N ATOM 123 H GLN S 8 -6.515 -5.278 -1.802 1.00 0.19 H ATOM 124 HA GLN S 8 -4.125 -5.187 -3.432 1.00 0.18 H ATOM 125 HB2 GLN S 8 -5.754 -2.873 -2.390 1.00 0.21 H ATOM 126 HB3 GLN S 8 -4.544 -2.819 -3.662 1.00 0.25 H ATOM 127 HG2 GLN S 8 -7.048 -4.468 -3.848 1.00 0.73 H ATOM 128 HG3 GLN S 8 -6.940 -2.803 -4.415 1.00 0.72 H ATOM 129 HE21 GLN S 8 -7.322 -3.356 -6.543 1.00 1.92 H ATOM 130 HE22 GLN S 8 -6.158 -4.183 -7.515 1.00 1.47 H ATOM 131 N MET S 9 -4.097 -3.705 -0.476 1.00 0.18 N ATOM 132 CA MET S 9 -3.194 -3.288 0.591 1.00 0.20 C ATOM 133 C MET S 9 -2.227 -4.403 0.993 1.00 0.19 C ATOM 134 O MET S 9 -1.027 -4.165 1.095 1.00 0.20 O ATOM 135 CB MET S 9 -3.966 -2.796 1.815 1.00 0.24 C ATOM 136 CG MET S 9 -3.088 -2.059 2.815 1.00 0.27 C ATOM 137 SD MET S 9 -2.253 -0.638 2.083 1.00 1.34 S ATOM 138 CE MET S 9 -0.926 -0.376 3.257 1.00 0.80 C ATOM 139 H MET S 9 -5.057 -3.522 -0.402 1.00 0.19 H ATOM 140 HA MET S 9 -2.610 -2.464 0.205 1.00 0.22 H ATOM 141 HB2 MET S 9 -4.749 -2.126 1.491 1.00 0.27 H ATOM 142 HB3 MET S 9 -4.407 -3.644 2.314 1.00 0.27 H ATOM 143 HG2 MET S 9 -3.706 -1.716 3.631 1.00 0.86 H ATOM 144 HG3 MET S 9 -2.342 -2.743 3.192 1.00 0.91 H ATOM 145 HE1 MET S 9 -1.341 -0.218 4.241 1.00 1.02 H ATOM 146 HE2 MET S 9 -0.282 -1.242 3.271 1.00 1.39 H ATOM 147 HE3 MET S 9 -0.355 0.493 2.964 1.00 1.27 H ATOM 148 N LYS S 10 -2.730 -5.617 1.222 1.00 0.19 N ATOM 149 CA LYS S 10 -1.859 -6.723 1.622 1.00 0.21 C ATOM 150 C LYS S 10 -0.929 -7.170 0.496 1.00 0.19 C ATOM 151 O LYS S 10 0.243 -7.463 0.736 1.00 0.21 O ATOM 152 CB LYS S 10 -2.687 -7.917 2.094 1.00 0.25 C ATOM 153 CG LYS S 10 -3.161 -7.819 3.539 1.00 1.11 C ATOM 154 CD LYS S 10 -4.247 -6.768 3.715 1.00 1.64 C ATOM 155 CE LYS S 10 -3.664 -5.430 4.135 1.00 2.24 C ATOM 156 NZ LYS S 10 -2.923 -5.526 5.422 1.00 3.19 N ATOM 157 H LYS S 10 -3.703 -5.773 1.152 1.00 0.20 H ATOM 158 HA LYS S 10 -1.255 -6.378 2.447 1.00 0.25 H ATOM 159 HB2 LYS S 10 -3.553 -8.004 1.461 1.00 0.75 H ATOM 160 HB3 LYS S 10 -2.091 -8.811 1.994 1.00 0.78 H ATOM 161 HG2 LYS S 10 -3.555 -8.778 3.842 1.00 1.84 H ATOM 162 HG3 LYS S 10 -2.319 -7.562 4.165 1.00 1.69 H ATOM 163 HD2 LYS S 10 -4.768 -6.644 2.778 1.00 2.34 H ATOM 164 HD3 LYS S 10 -4.939 -7.104 4.473 1.00 2.01 H ATOM 165 HE2 LYS S 10 -2.987 -5.089 3.366 1.00 2.66 H ATOM 166 HE3 LYS S 10 -4.470 -4.719 4.244 1.00 2.46 H ATOM 167 HZ1 LYS S 10 -3.555 -5.867 6.174 1.00 3.36 H ATOM 168 HZ2 LYS S 10 -2.126 -6.187 5.327 1.00 3.52 H ATOM 169 HZ3 LYS S 10 -2.553 -4.593 5.693 1.00 3.85 H ATOM 170 N ASN S 11 -1.446 -7.227 -0.726 1.00 0.16 N ATOM 171 CA ASN S 11 -0.649 -7.673 -1.867 1.00 0.17 C ATOM 172 C ASN S 11 0.207 -6.551 -2.446 1.00 0.15 C ATOM 173 O ASN S 11 1.432 -6.653 -2.465 1.00 0.15 O ATOM 174 CB ASN S 11 -1.561 -8.253 -2.950 1.00 0.20 C ATOM 175 CG ASN S 11 -0.782 -8.915 -4.068 1.00 0.31 C ATOM 176 OD1 ASN S 11 -0.421 -8.273 -5.055 1.00 0.99 O ATOM 177 ND2 ASN S 11 -0.519 -10.209 -3.921 1.00 1.27 N ATOM 178 H ASN S 11 -2.379 -6.961 -0.866 1.00 0.15 H ATOM 179 HA ASN S 11 0.014 -8.452 -1.515 1.00 0.18 H ATOM 180 HB2 ASN S 11 -2.218 -8.989 -2.505 1.00 0.27 H ATOM 181 HB3 ASN S 11 -2.158 -7.457 -3.372 1.00 0.22 H ATOM 182 HD21 ASN S 11 -0.838 -10.657 -3.110 1.00 2.00 H ATOM 183 HD22 ASN S 11 -0.015 -10.662 -4.630 1.00 1.33 H ATOM 184 N ALA S 12 -0.434 -5.492 -2.933 1.00 0.16 N ATOM 185 CA ALA S 12 0.293 -4.361 -3.504 1.00 0.17 C ATOM 186 C ALA S 12 1.466 -3.975 -2.615 1.00 0.15 C ATOM 187 O ALA S 12 2.604 -3.878 -3.078 1.00 0.16 O ATOM 188 CB ALA S 12 -0.637 -3.175 -3.704 1.00 0.20 C ATOM 189 H ALA S 12 -1.412 -5.482 -2.943 1.00 0.16 H ATOM 190 HA ALA S 12 0.672 -4.662 -4.470 1.00 0.20 H ATOM 191 HB1 ALA S 12 -1.013 -2.847 -2.746 1.00 0.85 H ATOM 192 HB2 ALA S 12 -0.095 -2.367 -4.174 1.00 0.88 H ATOM 193 HB3 ALA S 12 -1.464 -3.467 -4.335 1.00 0.89 H ATOM 194 N ALA S 13 1.181 -3.756 -1.337 1.00 0.15 N ATOM 195 CA ALA S 13 2.227 -3.413 -0.386 1.00 0.15 C ATOM 196 C ALA S 13 3.326 -4.461 -0.451 1.00 0.13 C ATOM 197 O ALA S 13 4.500 -4.135 -0.608 1.00 0.12 O ATOM 198 CB ALA S 13 1.672 -3.309 1.025 1.00 0.18 C ATOM 199 H ALA S 13 0.249 -3.819 -1.041 1.00 0.15 H ATOM 200 HA ALA S 13 2.636 -2.453 -0.665 1.00 0.16 H ATOM 201 HB1 ALA S 13 2.461 -3.013 1.701 1.00 1.01 H ATOM 202 HB2 ALA S 13 1.279 -4.268 1.329 1.00 1.05 H ATOM 203 HB3 ALA S 13 0.882 -2.573 1.048 1.00 1.04 H ATOM 204 N ALA S 14 2.926 -5.722 -0.287 1.00 0.14 N ATOM 205 CA ALA S 14 3.852 -6.846 -0.363 1.00 0.15 C ATOM 206 C ALA S 14 4.867 -6.686 -1.493 1.00 0.13 C ATOM 207 O ALA S 14 6.073 -6.770 -1.262 1.00 0.14 O ATOM 208 CB ALA S 14 3.086 -8.150 -0.527 1.00 0.17 C ATOM 209 H ALA S 14 2.005 -5.895 -0.010 1.00 0.16 H ATOM 210 HA ALA S 14 4.380 -6.894 0.573 1.00 0.17 H ATOM 211 HB1 ALA S 14 2.652 -8.190 -1.515 1.00 1.06 H ATOM 212 HB2 ALA S 14 3.761 -8.982 -0.396 1.00 0.97 H ATOM 213 HB3 ALA S 14 2.302 -8.202 0.212 1.00 0.96 H ATOM 214 N GLU S 15 4.385 -6.455 -2.717 1.00 0.14 N ATOM 215 CA GLU S 15 5.252 -6.303 -3.884 1.00 0.14 C ATOM 216 C GLU S 15 6.084 -5.023 -3.855 1.00 0.12 C ATOM 217 O GLU S 15 7.100 -4.930 -4.541 1.00 0.13 O ATOM 218 CB GLU S 15 4.405 -6.332 -5.154 1.00 0.18 C ATOM 219 CG GLU S 15 3.906 -7.718 -5.506 1.00 0.31 C ATOM 220 CD GLU S 15 5.018 -8.634 -5.976 1.00 0.87 C ATOM 221 OE1 GLU S 15 5.633 -9.308 -5.123 1.00 1.13 O ATOM 222 OE2 GLU S 15 5.275 -8.677 -7.198 1.00 1.28 O ATOM 223 H GLU S 15 3.423 -6.391 -2.886 1.00 0.15 H ATOM 224 HA GLU S 15 5.917 -7.149 -3.905 1.00 0.15 H ATOM 225 HB2 GLU S 15 3.547 -5.689 -5.015 1.00 0.29 H ATOM 226 HB3 GLU S 15 4.995 -5.962 -5.978 1.00 0.17 H ATOM 227 HG2 GLU S 15 3.453 -8.147 -4.633 1.00 0.27 H ATOM 228 HG3 GLU S 15 3.168 -7.637 -6.286 1.00 0.60 H ATOM 229 N ALA S 16 5.674 -4.045 -3.054 1.00 0.11 N ATOM 230 CA ALA S 16 6.396 -2.778 -3.009 1.00 0.12 C ATOM 231 C ALA S 16 7.535 -2.886 -2.015 1.00 0.10 C ATOM 232 O ALA S 16 8.598 -2.288 -2.185 1.00 0.11 O ATOM 233 CB ALA S 16 5.465 -1.639 -2.625 1.00 0.14 C ATOM 234 H ALA S 16 5.014 -4.233 -2.361 1.00 0.11 H ATOM 235 HA ALA S 16 6.799 -2.581 -3.989 1.00 0.14 H ATOM 236 HB1 ALA S 16 5.149 -1.764 -1.599 1.00 0.99 H ATOM 237 HB2 ALA S 16 5.985 -0.697 -2.731 1.00 1.02 H ATOM 238 HB3 ALA S 16 4.600 -1.647 -3.271 1.00 1.06 H ATOM 239 N LYS S 17 7.285 -3.665 -0.977 1.00 0.09 N ATOM 240 CA LYS S 17 8.270 -3.891 0.060 1.00 0.08 C ATOM 241 C LYS S 17 9.299 -4.912 -0.408 1.00 0.09 C ATOM 242 O LYS S 17 10.473 -4.848 -0.060 1.00 0.10 O ATOM 243 CB LYS S 17 7.603 -4.366 1.352 1.00 0.10 C ATOM 244 CG LYS S 17 6.842 -3.273 2.081 1.00 0.10 C ATOM 245 CD LYS S 17 7.788 -2.250 2.691 1.00 0.11 C ATOM 246 CE LYS S 17 7.026 -1.162 3.430 1.00 0.14 C ATOM 247 NZ LYS S 17 6.082 -0.441 2.534 1.00 1.35 N ATOM 248 H LYS S 17 6.413 -4.107 -0.936 1.00 0.10 H ATOM 249 HA LYS S 17 8.766 -2.946 0.238 1.00 0.09 H ATOM 250 HB2 LYS S 17 6.911 -5.160 1.115 1.00 0.10 H ATOM 251 HB3 LYS S 17 8.364 -4.749 2.016 1.00 0.11 H ATOM 252 HG2 LYS S 17 6.189 -2.773 1.380 1.00 0.10 H ATOM 253 HG3 LYS S 17 6.254 -3.722 2.868 1.00 0.11 H ATOM 254 HD2 LYS S 17 8.448 -2.752 3.386 1.00 0.14 H ATOM 255 HD3 LYS S 17 8.372 -1.798 1.902 1.00 0.10 H ATOM 256 HE2 LYS S 17 6.470 -1.614 4.237 1.00 1.01 H ATOM 257 HE3 LYS S 17 7.737 -0.455 3.834 1.00 0.97 H ATOM 258 HZ1 LYS S 17 6.596 -0.026 1.732 1.00 1.77 H ATOM 259 HZ2 LYS S 17 5.365 -1.101 2.166 1.00 1.96 H ATOM 260 HZ3 LYS S 17 5.602 0.319 3.056 1.00 2.03 H ATOM 261 N ASP S 18 8.857 -5.855 -1.212 1.00 0.09 N ATOM 262 CA ASP S 18 9.756 -6.873 -1.718 1.00 0.10 C ATOM 263 C ASP S 18 10.603 -6.304 -2.848 1.00 0.11 C ATOM 264 O ASP S 18 11.771 -6.633 -2.990 1.00 0.13 O ATOM 265 CB ASP S 18 8.971 -8.092 -2.202 1.00 0.11 C ATOM 266 CG ASP S 18 9.877 -9.215 -2.669 1.00 1.10 C ATOM 267 OD1 ASP S 18 10.238 -9.226 -3.866 1.00 2.14 O ATOM 268 OD2 ASP S 18 10.225 -10.081 -1.841 1.00 0.95 O ATOM 269 H ASP S 18 7.915 -5.846 -1.484 1.00 0.09 H ATOM 270 HA ASP S 18 10.406 -7.167 -0.908 1.00 0.11 H ATOM 271 HB2 ASP S 18 8.358 -8.463 -1.394 1.00 0.81 H ATOM 272 HB3 ASP S 18 8.336 -7.801 -3.026 1.00 0.79 H ATOM 273 N ASN S 19 10.039 -5.342 -3.556 1.00 0.11 N ATOM 274 CA ASN S 19 10.748 -4.781 -4.700 1.00 0.13 C ATOM 275 C ASN S 19 11.662 -3.636 -4.282 1.00 0.13 C ATOM 276 O ASN S 19 12.903 -3.763 -4.286 1.00 0.14 O ATOM 277 CB ASN S 19 9.758 -4.296 -5.761 1.00 0.14 C ATOM 278 CG ASN S 19 9.122 -5.439 -6.532 1.00 1.11 C ATOM 279 OD1 ASN S 19 8.767 -5.290 -7.701 1.00 2.00 O ATOM 280 ND2 ASN S 19 8.974 -6.587 -5.882 1.00 1.74 N ATOM 281 H ASN S 19 9.255 -4.914 -3.157 1.00 0.10 H ATOM 282 HA ASN S 19 11.353 -5.567 -5.126 1.00 0.14 H ATOM 283 HB2 ASN S 19 8.973 -3.733 -5.280 1.00 0.73 H ATOM 284 HB3 ASN S 19 10.276 -3.658 -6.461 1.00 0.83 H ATOM 285 HD21 ASN S 19 9.279 -6.636 -4.952 1.00 2.04 H ATOM 286 HD22 ASN S 19 8.565 -7.338 -6.358 1.00 2.33 H ATOM 287 N VAL S 20 11.044 -2.562 -3.813 1.00 0.12 N ATOM 288 CA VAL S 20 11.784 -1.382 -3.420 1.00 0.13 C ATOM 289 C VAL S 20 12.302 -1.473 -2.004 1.00 0.12 C ATOM 290 O VAL S 20 13.356 -0.929 -1.705 1.00 0.12 O ATOM 291 CB VAL S 20 10.948 -0.101 -3.550 1.00 0.15 C ATOM 292 CG1 VAL S 20 11.859 1.094 -3.738 1.00 0.15 C ATOM 293 CG2 VAL S 20 9.960 -0.205 -4.695 1.00 0.19 C ATOM 294 H VAL S 20 10.068 -2.568 -3.730 1.00 0.12 H ATOM 295 HA VAL S 20 12.628 -1.291 -4.088 1.00 0.14 H ATOM 296 HB VAL S 20 10.393 0.038 -2.634 1.00 0.15 H ATOM 297 N HIS S 21 11.598 -2.178 -1.126 1.00 0.11 N ATOM 298 CA HIS S 21 12.062 -2.260 0.242 1.00 0.11 C ATOM 299 C HIS S 21 13.118 -3.336 0.358 1.00 0.11 C ATOM 300 O HIS S 21 14.009 -3.222 1.199 1.00 0.12 O ATOM 301 CB HIS S 21 10.931 -2.502 1.237 1.00 0.12 C ATOM 302 CG HIS S 21 11.222 -1.984 2.612 1.00 0.16 C ATOM 303 ND1 HIS S 21 11.831 -0.770 2.847 1.00 1.17 N ATOM 304 CD2 HIS S 21 10.978 -2.523 3.831 1.00 1.00 C ATOM 305 CE1 HIS S 21 11.950 -0.585 4.150 1.00 0.89 C ATOM 306 NE2 HIS S 21 11.440 -1.633 4.768 1.00 0.52 N ATOM 307 H HIS S 21 10.837 -2.724 -1.415 1.00 0.11 H ATOM 308 HA HIS S 21 12.527 -1.311 0.474 1.00 0.11 H ATOM 309 HB2 HIS S 21 10.036 -2.018 0.881 1.00 0.15 H ATOM 310 HB3 HIS S 21 10.756 -3.564 1.316 1.00 0.13 H ATOM 311 HD1 HIS S 21 12.133 -0.138 2.161 1.00 2.05 H ATOM 312 HD2 HIS S 21 10.507 -3.476 4.029 1.00 2.02 H ATOM 313 HE1 HIS S 21 12.390 0.279 4.627 1.00 1.57 H ATOM 314 HE2 HIS S 21 11.329 -1.719 5.738 1.00 0.98 H ATOM 315 N ASP S 22 13.048 -4.395 -0.469 1.00 0.12 N ATOM 316 CA ASP S 22 14.080 -5.395 -0.378 1.00 0.14 C ATOM 317 C ASP S 22 15.403 -4.709 -0.630 1.00 0.14 C ATOM 318 O ASP S 22 16.274 -4.713 0.244 1.00 0.15 O ATOM 319 CB ASP S 22 13.860 -6.536 -1.357 1.00 0.16 C ATOM 320 CG ASP S 22 14.887 -7.641 -1.201 1.00 0.19 C ATOM 321 OD1 ASP S 22 14.662 -8.548 -0.374 1.00 0.26 O ATOM 322 OD2 ASP S 22 15.917 -7.597 -1.907 1.00 0.24 O ATOM 323 H ASP S 22 12.312 -4.498 -1.126 1.00 0.11 H ATOM 324 HA ASP S 22 14.077 -5.779 0.635 1.00 0.15 H ATOM 325 HB2 ASP S 22 12.877 -6.953 -1.186 1.00 0.16 H ATOM 326 HB3 ASP S 22 13.916 -6.153 -2.366 1.00 0.15 H ATOM 327 N LYS S 23 15.585 -4.103 -1.817 1.00 0.14 N ATOM 328 CA LYS S 23 16.814 -3.367 -2.080 1.00 0.16 C ATOM 329 C LYS S 23 17.106 -2.282 -1.048 1.00 0.12 C ATOM 330 O LYS S 23 18.246 -2.149 -0.609 1.00 0.14 O ATOM 331 CB LYS S 23 16.732 -2.731 -3.468 1.00 0.20 C ATOM 332 CG LYS S 23 15.456 -1.930 -3.686 1.00 0.28 C ATOM 333 CD LYS S 23 15.373 -1.371 -5.098 1.00 0.71 C ATOM 334 CE LYS S 23 16.272 -0.159 -5.272 1.00 0.31 C ATOM 335 NZ LYS S 23 16.198 0.398 -6.650 1.00 0.74 N ATOM 336 H LYS S 23 15.036 -4.277 -2.620 1.00 0.14 H ATOM 337 HA LYS S 23 17.627 -4.075 -2.076 1.00 0.21 H ATOM 338 HB2 LYS S 23 17.576 -2.069 -3.599 1.00 0.18 H ATOM 339 HB3 LYS S 23 16.776 -3.510 -4.213 1.00 0.29 H ATOM 340 HG2 LYS S 23 14.607 -2.573 -3.514 1.00 0.78 H ATOM 341 HG3 LYS S 23 15.436 -1.110 -2.983 1.00 0.89 H ATOM 342 HD2 LYS S 23 15.677 -2.135 -5.797 1.00 1.40 H ATOM 343 HD3 LYS S 23 14.351 -1.082 -5.300 1.00 1.45 H ATOM 344 HE2 LYS S 23 15.966 0.603 -4.569 1.00 0.28 H ATOM 345 HE3 LYS S 23 17.291 -0.451 -5.064 1.00 0.31 H ATOM 346 HZ1 LYS S 23 16.475 -0.325 -7.343 1.00 1.32 H ATOM 347 HZ2 LYS S 23 15.227 0.709 -6.858 1.00 1.19 H ATOM 348 HZ3 LYS S 23 16.837 1.214 -6.740 1.00 1.09 H ATOM 349 N ILE S 24 16.098 -1.497 -0.655 1.00 0.09 N ATOM 350 CA ILE S 24 16.328 -0.415 0.293 1.00 0.08 C ATOM 351 C ILE S 24 16.886 -0.906 1.624 1.00 0.09 C ATOM 352 O ILE S 24 18.026 -0.601 1.956 1.00 0.10 O ATOM 353 CB ILE S 24 15.036 0.394 0.557 1.00 0.09 C ATOM 354 CG1 ILE S 24 14.668 1.261 -0.648 1.00 0.09 C ATOM 355 CG2 ILE S 24 15.207 1.272 1.774 1.00 0.12 C ATOM 356 CD1 ILE S 24 13.290 1.899 -0.545 1.00 0.11 C ATOM 357 H ILE S 24 15.187 -1.633 -0.985 1.00 0.09 H ATOM 358 HA ILE S 24 17.052 0.250 -0.152 1.00 0.09 H ATOM 359 HB ILE S 24 14.234 -0.301 0.752 1.00 0.10 H ATOM 360 HD11 ILE S 24 12.609 1.206 -0.074 1.00 0.84 H ATOM 361 HD12 ILE S 24 13.347 2.805 0.046 1.00 0.88 H ATOM 362 HD13 ILE S 24 12.925 2.137 -1.534 1.00 0.88 H ATOM 363 N GLN S 25 16.094 -1.672 2.378 1.00 0.10 N ATOM 364 CA GLN S 25 16.545 -2.173 3.678 1.00 0.13 C ATOM 365 C GLN S 25 18.032 -2.494 3.613 1.00 0.14 C ATOM 366 O GLN S 25 18.840 -1.997 4.397 1.00 0.15 O ATOM 367 CB GLN S 25 15.767 -3.434 4.068 1.00 0.14 C ATOM 368 CG GLN S 25 14.256 -3.247 4.103 1.00 0.14 C ATOM 369 CD GLN S 25 13.658 -3.610 5.447 1.00 0.34 C ATOM 370 OE1 GLN S 25 13.539 -2.765 6.336 1.00 1.19 O ATOM 371 NE2 GLN S 25 13.276 -4.873 5.606 1.00 1.09 N ATOM 372 H GLN S 25 15.179 -1.854 2.079 1.00 0.10 H ATOM 373 HA GLN S 25 16.377 -1.404 4.414 1.00 0.14 H ATOM 374 HB2 GLN S 25 15.992 -4.214 3.356 1.00 0.14 H ATOM 375 HB3 GLN S 25 16.090 -3.751 5.048 1.00 0.16 H ATOM 376 HG2 GLN S 25 14.025 -2.214 3.890 1.00 0.20 H ATOM 377 HG3 GLN S 25 13.810 -3.878 3.344 1.00 0.18 H ATOM 378 HE21 GLN S 25 13.402 -5.491 4.857 1.00 1.83 H ATOM 379 HE22 GLN S 25 12.884 -5.133 6.466 1.00 1.13 H ATOM 380 N GLU S 26 18.356 -3.343 2.666 1.00 0.14 N ATOM 381 CA GLU S 26 19.737 -3.733 2.440 1.00 0.16 C ATOM 382 C GLU S 26 20.647 -2.500 2.279 1.00 0.15 C ATOM 383 O GLU S 26 21.528 -2.256 3.103 1.00 0.17 O ATOM 384 CB GLU S 26 19.836 -4.615 1.193 1.00 0.17 C ATOM 385 CG GLU S 26 21.222 -5.199 0.965 1.00 0.71 C ATOM 386 CD GLU S 26 21.597 -6.232 2.010 1.00 1.33 C ATOM 387 OE1 GLU S 26 21.405 -7.438 1.748 1.00 1.09 O ATOM 388 OE2 GLU S 26 22.083 -5.835 3.090 1.00 2.39 O ATOM 389 H GLU S 26 17.603 -3.754 2.191 1.00 0.14 H ATOM 390 HA GLU S 26 20.066 -4.300 3.298 1.00 0.18 H ATOM 391 HB2 GLU S 26 19.135 -5.432 1.288 1.00 0.59 H ATOM 392 HB3 GLU S 26 19.572 -4.025 0.328 1.00 0.55 H ATOM 393 HG2 GLU S 26 21.245 -5.668 -0.007 1.00 1.38 H ATOM 394 HG3 GLU S 26 21.945 -4.398 0.996 1.00 1.31 H ATOM 395 N LEU S 27 20.419 -1.732 1.213 1.00 0.14 N ATOM 396 CA LEU S 27 21.229 -0.544 0.897 1.00 0.14 C ATOM 397 C LEU S 27 20.707 0.803 1.427 1.00 0.12 C ATOM 398 O LEU S 27 21.367 1.494 2.202 1.00 0.13 O ATOM 399 CB LEU S 27 21.329 -0.413 -0.616 1.00 0.15 C ATOM 400 CG LEU S 27 21.740 -1.682 -1.359 1.00 0.20 C ATOM 401 CD1 LEU S 27 21.444 -1.533 -2.840 1.00 0.47 C ATOM 402 CD2 LEU S 27 23.216 -1.979 -1.133 1.00 0.61 C ATOM 403 H LEU S 27 19.683 -1.970 0.615 1.00 0.13 H ATOM 404 HA LEU S 27 22.221 -0.707 1.285 1.00 0.16 H ATOM 405 HB2 LEU S 27 20.361 -0.096 -0.989 1.00 0.13 H ATOM 406 HB3 LEU S 27 22.047 0.359 -0.840 1.00 0.18 H ATOM 407 HG LEU S 27 21.166 -2.516 -0.983 1.00 0.55 H ATOM 408 HD11 LEU S 27 20.479 -1.061 -2.962 1.00 1.07 H ATOM 409 HD12 LEU S 27 22.203 -0.919 -3.299 1.00 1.08 H ATOM 410 HD13 LEU S 27 21.433 -2.506 -3.307 1.00 1.28 H ATOM 411 HD21 LEU S 27 23.401 -2.096 -0.076 1.00 1.18 H ATOM 412 HD22 LEU S 27 23.482 -2.889 -1.650 1.00 1.32 H ATOM 413 HD23 LEU S 27 23.809 -1.161 -1.514 1.00 1.20 H ATOM 414 N LYS S 28 19.502 1.136 0.978 1.00 0.11 N ATOM 415 CA LYS S 28 18.839 2.432 1.203 1.00 0.11 C ATOM 416 C LYS S 28 18.115 2.623 2.540 1.00 0.12 C ATOM 417 O LYS S 28 17.638 3.725 2.805 1.00 0.14 O ATOM 418 CB LYS S 28 17.834 2.674 0.090 1.00 0.12 C ATOM 419 CG LYS S 28 18.439 2.709 -1.297 1.00 0.14 C ATOM 420 CD LYS S 28 18.236 1.388 -2.015 1.00 0.13 C ATOM 421 CE LYS S 28 18.682 1.467 -3.465 1.00 0.21 C ATOM 422 NZ LYS S 28 17.921 2.498 -4.225 1.00 1.31 N ATOM 423 H LYS S 28 18.967 0.450 0.529 1.00 0.10 H ATOM 424 HA LYS S 28 19.599 3.192 1.122 1.00 0.13 H ATOM 425 HB2 LYS S 28 17.097 1.890 0.112 1.00 0.10 H ATOM 426 HB3 LYS S 28 17.345 3.609 0.271 1.00 0.14 H ATOM 427 HG2 LYS S 28 17.962 3.495 -1.865 1.00 0.17 H ATOM 428 HG3 LYS S 28 19.496 2.909 -1.215 1.00 0.16 H ATOM 429 HD2 LYS S 28 18.811 0.626 -1.511 1.00 0.14 H ATOM 430 HD3 LYS S 28 17.186 1.132 -1.979 1.00 0.12 H ATOM 431 HE2 LYS S 28 19.733 1.715 -3.493 1.00 1.09 H ATOM 432 HE3 LYS S 28 18.529 0.503 -3.928 1.00 0.98 H ATOM 433 HZ1 LYS S 28 18.049 3.431 -3.786 1.00 1.89 H ATOM 434 HZ2 LYS S 28 18.258 2.539 -5.207 1.00 1.54 H ATOM 435 HZ3 LYS S 28 16.907 2.264 -4.227 1.00 1.96 H ATOM 436 N ASP S 29 17.985 1.577 3.343 1.00 0.12 N ATOM 437 CA ASP S 29 17.190 1.629 4.582 1.00 0.14 C ATOM 438 C ASP S 29 17.206 2.979 5.319 1.00 0.17 C ATOM 439 O ASP S 29 16.288 3.250 6.093 1.00 0.19 O ATOM 440 CB ASP S 29 17.673 0.547 5.547 1.00 0.16 C ATOM 441 CG ASP S 29 16.842 0.486 6.814 1.00 1.17 C ATOM 442 OD1 ASP S 29 15.824 -0.237 6.822 1.00 2.17 O ATOM 443 OD2 ASP S 29 17.212 1.160 7.797 1.00 1.10 O ATOM 444 H ASP S 29 18.470 0.754 3.135 1.00 0.12 H ATOM 445 HA ASP S 29 16.171 1.407 4.315 1.00 0.14 H ATOM 446 HB2 ASP S 29 17.619 -0.410 5.058 1.00 0.90 H ATOM 447 HB3 ASP S 29 18.699 0.748 5.820 1.00 0.91 H ATOM 448 N ASP S 30 18.206 3.830 5.108 1.00 0.18 N ATOM 449 CA ASP S 30 18.212 5.117 5.806 1.00 0.21 C ATOM 450 C ASP S 30 17.452 6.200 5.018 1.00 0.22 C ATOM 451 O ASP S 30 16.343 6.592 5.379 1.00 0.23 O ATOM 452 CB ASP S 30 19.651 5.574 6.057 1.00 0.23 C ATOM 453 CG ASP S 30 20.420 4.605 6.933 1.00 1.12 C ATOM 454 OD1 ASP S 30 20.371 4.756 8.172 1.00 1.04 O ATOM 455 OD2 ASP S 30 21.073 3.694 6.381 1.00 2.14 O ATOM 456 H ASP S 30 18.878 3.641 4.422 1.00 0.16 H ATOM 457 HA ASP S 30 17.722 4.976 6.758 1.00 0.23 H ATOM 458 HB2 ASP S 30 20.165 5.662 5.113 1.00 1.01 H ATOM 459 HB3 ASP S 30 19.635 6.537 6.545 1.00 0.89 H ATOM 460 N VAL S 31 18.081 6.661 3.937 1.00 0.21 N ATOM 461 CA VAL S 31 17.498 7.701 3.071 1.00 0.23 C ATOM 462 C VAL S 31 16.629 7.149 1.935 1.00 0.21 C ATOM 463 O VAL S 31 15.450 7.484 1.819 1.00 0.23 O ATOM 464 CB VAL S 31 18.608 8.575 2.454 1.00 0.24 C ATOM 465 CG1 VAL S 31 19.078 9.623 3.450 1.00 1.32 C ATOM 466 CG2 VAL S 31 19.779 7.714 1.992 1.00 1.26 C ATOM 467 H VAL S 31 19.012 6.384 3.825 1.00 0.20 H ATOM 468 HA VAL S 31 16.886 8.337 3.692 1.00 0.25 H ATOM 469 HB VAL S 31 18.200 9.085 1.593 1.00 1.09 H ATOM 470 N GLY S 32 17.234 6.314 1.107 1.00 0.19 N ATOM 471 CA GLY S 32 16.530 5.732 -0.030 1.00 0.18 C ATOM 472 C GLY S 32 15.209 5.084 0.363 1.00 0.17 C ATOM 473 O GLY S 32 14.377 4.786 -0.491 1.00 0.18 O ATOM 474 H GLY S 32 18.172 6.110 1.296 1.00 0.18 H ATOM 475 HA2 GLY S 32 17.160 4.991 -0.490 1.00 0.17 H ATOM 476 HA3 GLY S 32 16.331 6.512 -0.750 1.00 0.21 H ATOM 477 N ASN S 33 15.043 4.852 1.661 1.00 0.18 N ATOM 478 CA ASN S 33 13.830 4.236 2.211 1.00 0.19 C ATOM 479 C ASN S 33 12.545 4.944 1.775 1.00 0.23 C ATOM 480 O ASN S 33 11.447 4.483 2.092 1.00 0.26 O ATOM 481 CB ASN S 33 13.908 4.210 3.738 1.00 0.23 C ATOM 482 CG ASN S 33 12.751 3.458 4.371 1.00 1.14 C ATOM 483 OD1 ASN S 33 12.319 3.780 5.477 1.00 2.05 O ATOM 484 ND2 ASN S 33 12.246 2.448 3.673 1.00 1.79 N ATOM 485 H ASN S 33 15.784 5.077 2.262 1.00 0.18 H ATOM 486 HA ASN S 33 13.787 3.222 1.850 1.00 0.17 H ATOM 487 HB2 ASN S 33 14.828 3.732 4.038 1.00 0.87 H ATOM 488 HB3 ASN S 33 13.896 5.225 4.107 1.00 0.97 H ATOM 489 HD21 ASN S 33 12.640 2.245 2.799 1.00 2.06 H ATOM 490 HD22 ASN S 33 11.496 1.946 4.058 1.00 2.43 H ATOM 491 N LYS S 34 12.663 6.047 1.050 1.00 0.25 N ATOM 492 CA LYS S 34 11.487 6.771 0.597 1.00 0.30 C ATOM 493 C LYS S 34 10.964 6.206 -0.714 1.00 0.28 C ATOM 494 O LYS S 34 9.803 6.398 -1.060 1.00 0.43 O ATOM 495 CB LYS S 34 11.787 8.259 0.445 1.00 0.35 C ATOM 496 CG LYS S 34 10.550 9.073 0.118 1.00 0.71 C ATOM 497 CD LYS S 34 9.417 8.776 1.086 1.00 0.43 C ATOM 498 CE LYS S 34 8.166 9.551 0.738 1.00 0.74 C ATOM 499 NZ LYS S 34 8.401 11.021 0.736 1.00 1.04 N ATOM 500 H LYS S 34 13.545 6.360 0.772 1.00 0.24 H ATOM 501 HA LYS S 34 10.719 6.653 1.338 1.00 0.33 H ATOM 502 HB2 LYS S 34 12.207 8.629 1.369 1.00 0.54 H ATOM 503 HB3 LYS S 34 12.504 8.394 -0.351 1.00 0.45 H ATOM 504 HG2 LYS S 34 10.793 10.121 0.170 1.00 1.35 H ATOM 505 HG3 LYS S 34 10.229 8.820 -0.879 1.00 1.36 H ATOM 506 HD2 LYS S 34 9.186 7.723 1.038 1.00 1.09 H ATOM 507 HD3 LYS S 34 9.727 9.037 2.086 1.00 1.10 H ATOM 508 HE2 LYS S 34 7.837 9.243 -0.241 1.00 0.96 H ATOM 509 HE3 LYS S 34 7.405 9.314 1.463 1.00 0.96 H ATOM 510 HZ1 LYS S 34 9.136 11.265 0.042 1.00 1.30 H ATOM 511 HZ2 LYS S 34 7.524 11.521 0.486 1.00 1.60 H ATOM 512 HZ3 LYS S 34 8.711 11.335 1.678 1.00 1.17 H ATOM 513 N ALA S 35 11.819 5.498 -1.434 1.00 0.19 N ATOM 514 CA ALA S 35 11.438 4.920 -2.712 1.00 0.19 C ATOM 515 C ALA S 35 10.350 3.858 -2.544 1.00 0.16 C ATOM 516 O ALA S 35 9.471 3.726 -3.396 1.00 0.18 O ATOM 517 CB ALA S 35 12.658 4.345 -3.416 1.00 0.24 C ATOM 518 H ALA S 35 12.721 5.346 -1.087 1.00 0.24 H ATOM 519 HA ALA S 35 11.043 5.719 -3.325 1.00 0.21 H ATOM 520 HB1 ALA S 35 13.368 5.137 -3.604 1.00 0.96 H ATOM 521 HB2 ALA S 35 13.115 3.595 -2.792 1.00 0.96 H ATOM 522 HB3 ALA S 35 12.358 3.903 -4.354 1.00 1.04 H ATOM 523 N ALA S 36 10.407 3.102 -1.446 1.00 0.12 N ATOM 524 CA ALA S 36 9.410 2.065 -1.175 1.00 0.13 C ATOM 525 C ALA S 36 8.163 2.697 -0.566 1.00 0.21 C ATOM 526 O ALA S 36 7.056 2.158 -0.654 1.00 0.59 O ATOM 527 CB ALA S 36 9.980 0.989 -0.254 1.00 0.20 C ATOM 528 H ALA S 36 11.080 3.288 -0.757 1.00 0.13 H ATOM 529 HA ALA S 36 9.144 1.605 -2.117 1.00 0.16 H ATOM 530 HB1 ALA S 36 10.920 0.636 -0.652 1.00 1.13 H ATOM 531 HB2 ALA S 36 9.285 0.156 -0.186 1.00 0.98 H ATOM 532 HB3 ALA S 36 10.142 1.404 0.730 1.00 0.96 H ATOM 533 N GLU S 37 8.361 3.877 0.016 1.00 0.32 N ATOM 534 CA GLU S 37 7.284 4.604 0.671 1.00 0.32 C ATOM 535 C GLU S 37 6.491 5.386 -0.361 1.00 0.23 C ATOM 536 O GLU S 37 5.281 5.578 -0.224 1.00 0.21 O ATOM 537 CB GLU S 37 7.851 5.543 1.737 1.00 0.42 C ATOM 538 CG GLU S 37 8.177 4.850 3.051 1.00 0.46 C ATOM 539 CD GLU S 37 6.948 4.276 3.729 1.00 1.23 C ATOM 540 OE1 GLU S 37 6.597 3.113 3.436 1.00 2.24 O ATOM 541 OE2 GLU S 37 6.337 4.989 4.552 1.00 1.13 O ATOM 542 H GLU S 37 9.229 4.315 -0.095 1.00 0.74 H ATOM 543 HA GLU S 37 6.630 3.884 1.141 1.00 0.36 H ATOM 544 HB2 GLU S 37 8.760 5.990 1.359 1.00 0.45 H ATOM 545 HB3 GLU S 37 7.131 6.324 1.935 1.00 0.51 H ATOM 546 HG2 GLU S 37 8.869 4.044 2.855 1.00 0.93 H ATOM 547 HG3 GLU S 37 8.637 5.566 3.717 1.00 0.95 H ATOM 548 N VAL S 38 7.185 5.832 -1.401 1.00 0.25 N ATOM 549 CA VAL S 38 6.548 6.568 -2.475 1.00 0.25 C ATOM 550 C VAL S 38 5.702 5.607 -3.295 1.00 0.21 C ATOM 551 O VAL S 38 4.586 5.928 -3.702 1.00 0.18 O ATOM 552 CB VAL S 38 7.578 7.256 -3.393 1.00 0.36 C ATOM 553 CG1 VAL S 38 6.897 7.838 -4.623 1.00 0.39 C ATOM 554 CG2 VAL S 38 8.324 8.340 -2.634 1.00 0.45 C ATOM 555 H VAL S 38 8.146 5.654 -1.448 1.00 0.31 H ATOM 556 HA VAL S 38 5.915 7.324 -2.033 1.00 0.24 H ATOM 557 HB VAL S 38 8.294 6.517 -3.720 1.00 0.38 H ATOM 558 N ARG S 39 6.265 4.425 -3.546 1.00 0.25 N ATOM 559 CA ARG S 39 5.570 3.388 -4.292 1.00 0.30 C ATOM 560 C ARG S 39 4.182 3.173 -3.709 1.00 0.31 C ATOM 561 O ARG S 39 3.192 3.130 -4.440 1.00 0.37 O ATOM 562 CB ARG S 39 6.363 2.077 -4.244 1.00 0.41 C ATOM 563 CG ARG S 39 6.013 1.096 -5.356 1.00 0.53 C ATOM 564 CD ARG S 39 4.624 0.502 -5.174 1.00 0.36 C ATOM 565 NE ARG S 39 4.423 -0.687 -5.996 1.00 0.63 N ATOM 566 CZ ARG S 39 3.332 -1.444 -5.943 1.00 0.88 C ATOM 567 NH1 ARG S 39 2.341 -1.129 -5.119 1.00 1.02 N ATOM 568 NH2 ARG S 39 3.229 -2.518 -6.714 1.00 1.24 N ATOM 569 H ARG S 39 7.186 4.264 -3.249 1.00 0.28 H ATOM 570 HA ARG S 39 5.478 3.713 -5.317 1.00 0.33 H ATOM 571 HB2 ARG S 39 7.416 2.302 -4.313 1.00 0.68 H ATOM 572 HB3 ARG S 39 6.172 1.592 -3.297 1.00 0.58 H ATOM 573 HG2 ARG S 39 6.049 1.613 -6.302 1.00 0.91 H ATOM 574 HG3 ARG S 39 6.739 0.295 -5.356 1.00 1.03 H ATOM 575 HD2 ARG S 39 4.491 0.240 -4.136 1.00 0.67 H ATOM 576 HD3 ARG S 39 3.891 1.246 -5.451 1.00 0.36 H ATOM 577 HE ARG S 39 5.140 -0.938 -6.616 1.00 0.86 H ATOM 578 HH11 ARG S 39 2.414 -0.321 -4.536 1.00 0.99 H ATOM 579 HH12 ARG S 39 1.521 -1.701 -5.082 1.00 1.33 H ATOM 580 HH21 ARG S 39 3.973 -2.759 -7.338 1.00 1.39 H ATOM 581 HH22 ARG S 39 2.407 -3.086 -6.674 1.00 1.46 H ATOM 582 N ASP S 40 4.111 3.045 -2.386 1.00 0.31 N ATOM 583 CA ASP S 40 2.837 2.834 -1.713 1.00 0.37 C ATOM 584 C ASP S 40 1.968 4.089 -1.755 1.00 0.32 C ATOM 585 O ASP S 40 0.748 4.011 -1.617 1.00 0.39 O ATOM 586 CB ASP S 40 3.081 2.419 -0.260 1.00 0.46 C ATOM 587 CG ASP S 40 1.792 2.247 0.519 1.00 0.57 C ATOM 588 OD1 ASP S 40 1.361 3.218 1.175 1.00 0.54 O ATOM 589 OD2 ASP S 40 1.215 1.140 0.473 1.00 0.71 O ATOM 590 H ASP S 40 4.927 3.093 -1.839 1.00 0.33 H ATOM 591 HA ASP S 40 2.322 2.034 -2.224 1.00 0.45 H ATOM 592 HB2 ASP S 40 3.615 1.481 -0.246 1.00 0.52 H ATOM 593 HB3 ASP S 40 3.679 3.175 0.229 1.00 0.42 H ATOM 594 N ALA S 41 2.600 5.245 -1.945 1.00 0.24 N ATOM 595 CA ALA S 41 1.875 6.514 -1.991 1.00 0.24 C ATOM 596 C ALA S 41 0.963 6.601 -3.213 1.00 0.25 C ATOM 597 O ALA S 41 -0.245 6.800 -3.080 1.00 0.28 O ATOM 598 CB ALA S 41 2.853 7.679 -1.974 1.00 0.26 C ATOM 599 H ALA S 41 3.574 5.246 -2.054 1.00 0.22 H ATOM 600 HA ALA S 41 1.267 6.577 -1.101 1.00 0.24 H ATOM 601 HB1 ALA S 41 3.422 7.685 -2.893 1.00 0.90 H ATOM 602 HB2 ALA S 41 3.524 7.573 -1.136 1.00 0.97 H ATOM 603 HB3 ALA S 41 2.306 8.606 -1.884 1.00 0.99 H ATOM 604 N VAL S 42 1.543 6.458 -4.400 1.00 0.25 N ATOM 605 CA VAL S 42 0.772 6.520 -5.639 1.00 0.29 C ATOM 606 C VAL S 42 -0.338 5.474 -5.645 1.00 0.29 C ATOM 607 O VAL S 42 -1.485 5.765 -5.985 1.00 0.29 O ATOM 608 CB VAL S 42 1.668 6.301 -6.868 1.00 0.34 C ATOM 609 CG1 VAL S 42 2.429 7.573 -7.206 1.00 0.36 C ATOM 610 CG2 VAL S 42 2.634 5.151 -6.635 1.00 0.35 C ATOM 611 H VAL S 42 2.510 6.308 -4.445 1.00 0.25 H ATOM 612 HA VAL S 42 0.329 7.503 -5.709 1.00 0.30 H ATOM 613 HB VAL S 42 1.037 6.046 -7.704 1.00 0.39 H ATOM 614 N SER S 43 0.026 4.257 -5.269 1.00 0.30 N ATOM 615 CA SER S 43 -0.927 3.157 -5.212 1.00 0.32 C ATOM 616 C SER S 43 -2.102 3.534 -4.317 1.00 0.28 C ATOM 617 O SER S 43 -3.261 3.444 -4.719 1.00 0.27 O ATOM 618 CB SER S 43 -0.252 1.889 -4.687 1.00 0.34 C ATOM 619 OG SER S 43 0.824 1.502 -5.522 1.00 1.24 O ATOM 620 H SER S 43 0.963 4.114 -5.021 1.00 0.31 H ATOM 621 HA SER S 43 -1.291 2.978 -6.213 1.00 0.35 H ATOM 622 HB2 SER S 43 0.129 2.072 -3.694 1.00 1.03 H ATOM 623 HB3 SER S 43 -0.974 1.086 -4.654 1.00 1.02 H ATOM 624 HG SER S 43 0.800 2.014 -6.333 1.00 1.72 H ATOM 625 N SER S 44 -1.781 3.947 -3.094 1.00 0.27 N ATOM 626 CA SER S 44 -2.787 4.357 -2.117 1.00 0.25 C ATOM 627 C SER S 44 -3.791 5.335 -2.726 1.00 0.22 C ATOM 628 O SER S 44 -4.990 5.252 -2.456 1.00 0.21 O ATOM 629 CB SER S 44 -2.112 5.003 -0.903 1.00 0.26 C ATOM 630 OG SER S 44 -1.863 6.379 -1.128 1.00 1.31 O ATOM 631 H SER S 44 -0.839 3.935 -2.829 1.00 0.29 H ATOM 632 HA SER S 44 -3.315 3.473 -1.794 1.00 0.27 H ATOM 633 HB2 SER S 44 -2.751 4.901 -0.040 1.00 0.92 H ATOM 634 HB3 SER S 44 -1.170 4.508 -0.712 1.00 1.02 H ATOM 635 HG SER S 44 -1.614 6.799 -0.301 1.00 1.65 H ATOM 636 N THR S 45 -3.297 6.261 -3.545 1.00 0.22 N ATOM 637 CA THR S 45 -4.155 7.254 -4.186 1.00 0.22 C ATOM 638 C THR S 45 -5.216 6.581 -5.049 1.00 0.21 C ATOM 639 O THR S 45 -6.363 7.027 -5.106 1.00 0.19 O ATOM 640 CB THR S 45 -3.340 8.228 -5.058 1.00 0.26 C ATOM 641 OG1 THR S 45 -2.364 8.904 -4.255 1.00 0.74 O ATOM 642 CG2 THR S 45 -4.245 9.251 -5.728 1.00 0.81 C ATOM 643 H THR S 45 -2.333 6.276 -3.723 1.00 0.24 H ATOM 644 HA THR S 45 -4.645 7.823 -3.408 1.00 0.21 H ATOM 645 HB THR S 45 -2.832 7.661 -5.825 1.00 0.63 H ATOM 646 HG1 THR S 45 -2.794 9.302 -3.496 1.00 1.32 H ATOM 647 HG21 THR S 45 -4.801 9.789 -4.974 1.00 1.54 H ATOM 648 HG22 THR S 45 -3.645 9.946 -6.296 1.00 1.36 H ATOM 649 HG23 THR S 45 -4.933 8.745 -6.389 1.00 1.30 H ATOM 650 N VAL S 46 -4.822 5.499 -5.707 1.00 0.24 N ATOM 651 CA VAL S 46 -5.732 4.753 -6.568 1.00 0.25 C ATOM 652 C VAL S 46 -6.664 3.888 -5.726 1.00 0.23 C ATOM 653 O VAL S 46 -7.878 4.088 -5.720 1.00 0.21 O ATOM 654 CB VAL S 46 -4.959 3.857 -7.554 1.00 0.30 C ATOM 655 CG1 VAL S 46 -5.917 3.045 -8.412 1.00 0.34 C ATOM 656 CG2 VAL S 46 -4.036 4.697 -8.423 1.00 0.32 C ATOM 657 H VAL S 46 -3.899 5.189 -5.584 1.00 0.25 H ATOM 658 HA VAL S 46 -6.319 5.462 -7.134 1.00 0.25 H ATOM 659 HB VAL S 46 -4.350 3.171 -6.982 1.00 0.30 H ATOM 660 N GLU S 47 -6.073 2.925 -5.027 1.00 0.24 N ATOM 661 CA GLU S 47 -6.815 2.022 -4.147 1.00 0.25 C ATOM 662 C GLU S 47 -7.833 2.762 -3.275 1.00 0.19 C ATOM 663 O GLU S 47 -8.799 2.165 -2.798 1.00 0.18 O ATOM 664 CB GLU S 47 -5.844 1.235 -3.273 1.00 0.30 C ATOM 665 CG GLU S 47 -5.510 -0.134 -3.835 1.00 0.41 C ATOM 666 CD GLU S 47 -4.926 -0.069 -5.233 1.00 1.37 C ATOM 667 OE1 GLU S 47 -5.702 -0.182 -6.206 1.00 2.44 O ATOM 668 OE2 GLU S 47 -3.695 0.096 -5.354 1.00 1.32 O ATOM 669 H GLU S 47 -5.114 2.783 -5.162 1.00 0.26 H ATOM 670 HA GLU S 47 -7.346 1.324 -4.766 1.00 0.29 H ATOM 671 HB2 GLU S 47 -4.927 1.796 -3.174 1.00 0.41 H ATOM 672 HB3 GLU S 47 -6.283 1.101 -2.298 1.00 0.28 H ATOM 673 HG2 GLU S 47 -4.793 -0.611 -3.184 1.00 0.58 H ATOM 674 HG3 GLU S 47 -6.418 -0.722 -3.863 1.00 1.01 H ATOM 675 N SER S 48 -7.664 4.068 -3.127 1.00 0.17 N ATOM 676 CA SER S 48 -8.560 4.842 -2.277 1.00 0.16 C ATOM 677 C SER S 48 -9.798 5.305 -3.038 1.00 0.17 C ATOM 678 O SER S 48 -10.924 4.958 -2.681 1.00 0.19 O ATOM 679 CB SER S 48 -7.830 6.051 -1.690 1.00 0.20 C ATOM 680 OG SER S 48 -8.685 6.805 -0.848 1.00 1.00 O ATOM 681 H SER S 48 -6.981 4.527 -3.657 1.00 0.18 H ATOM 682 HA SER S 48 -8.873 4.197 -1.473 1.00 0.18 H ATOM 683 HB2 SER S 48 -6.984 5.712 -1.110 1.00 0.93 H ATOM 684 HB3 SER S 48 -7.484 6.685 -2.492 1.00 0.88 H ATOM 685 HG SER S 48 -8.205 7.075 -0.062 1.00 1.35 H ATOM 686 N ILE S 49 -9.580 6.089 -4.084 1.00 0.18 N ATOM 687 CA ILE S 49 -10.678 6.601 -4.896 1.00 0.23 C ATOM 688 C ILE S 49 -11.452 5.480 -5.566 1.00 0.21 C ATOM 689 O ILE S 49 -12.582 5.673 -6.014 1.00 0.25 O ATOM 690 CB ILE S 49 -10.195 7.578 -5.980 1.00 0.30 C ATOM 691 CG1 ILE S 49 -8.960 7.026 -6.702 1.00 0.29 C ATOM 692 CG2 ILE S 49 -9.911 8.940 -5.371 1.00 0.34 C ATOM 693 CD1 ILE S 49 -9.268 5.917 -7.691 1.00 0.32 C ATOM 694 H ILE S 49 -8.657 6.338 -4.302 1.00 0.18 H ATOM 695 HA ILE S 49 -11.347 7.137 -4.238 1.00 0.25 H ATOM 696 HB ILE S 49 -10.996 7.696 -6.695 1.00 0.34 H ATOM 697 HD11 ILE S 49 -10.134 6.189 -8.279 1.00 1.02 H ATOM 698 HD12 ILE S 49 -8.420 5.769 -8.343 1.00 1.01 H ATOM 699 HD13 ILE S 49 -9.472 5.000 -7.153 1.00 0.92 H ATOM 700 N LYS S 50 -10.838 4.316 -5.669 1.00 0.19 N ATOM 701 CA LYS S 50 -11.486 3.201 -6.325 1.00 0.22 C ATOM 702 C LYS S 50 -12.479 2.476 -5.418 1.00 0.20 C ATOM 703 O LYS S 50 -13.657 2.397 -5.754 1.00 0.21 O ATOM 704 CB LYS S 50 -10.447 2.233 -6.886 1.00 0.28 C ATOM 705 CG LYS S 50 -9.530 1.640 -5.839 1.00 0.33 C ATOM 706 CD LYS S 50 -9.887 0.198 -5.537 1.00 0.36 C ATOM 707 CE LYS S 50 -9.514 -0.721 -6.689 1.00 1.13 C ATOM 708 NZ LYS S 50 -9.841 -2.144 -6.395 1.00 1.59 N ATOM 709 H LYS S 50 -9.936 4.207 -5.301 1.00 0.17 H ATOM 710 HA LYS S 50 -12.042 3.614 -7.155 1.00 0.26 H ATOM 711 HB2 LYS S 50 -10.958 1.422 -7.383 1.00 0.34 H ATOM 712 HB3 LYS S 50 -9.837 2.758 -7.606 1.00 0.36 H ATOM 713 HG2 LYS S 50 -8.516 1.678 -6.206 1.00 0.52 H ATOM 714 HG3 LYS S 50 -9.610 2.221 -4.930 1.00 0.57 H ATOM 715 HD2 LYS S 50 -9.359 -0.117 -4.651 1.00 0.81 H ATOM 716 HD3 LYS S 50 -10.951 0.135 -5.367 1.00 0.83 H ATOM 717 HE2 LYS S 50 -10.058 -0.411 -7.569 1.00 1.86 H ATOM 718 HE3 LYS S 50 -8.453 -0.633 -6.872 1.00 1.65 H ATOM 719 HZ1 LYS S 50 -9.335 -2.458 -5.543 1.00 2.04 H ATOM 720 HZ2 LYS S 50 -10.863 -2.250 -6.236 1.00 1.98 H ATOM 721 HZ3 LYS S 50 -9.560 -2.748 -7.193 1.00 2.09 H ATOM 722 N ASP S 51 -12.026 1.939 -4.279 1.00 0.19 N ATOM 723 CA ASP S 51 -12.931 1.201 -3.395 1.00 0.24 C ATOM 724 C ASP S 51 -13.698 2.071 -2.401 1.00 0.24 C ATOM 725 O ASP S 51 -14.873 1.818 -2.139 1.00 0.29 O ATOM 726 CB ASP S 51 -12.174 0.105 -2.650 1.00 0.31 C ATOM 727 CG ASP S 51 -12.455 -1.273 -3.220 1.00 0.76 C ATOM 728 OD1 ASP S 51 -13.376 -1.949 -2.719 1.00 1.03 O ATOM 729 OD2 ASP S 51 -11.749 -1.678 -4.167 1.00 1.06 O ATOM 730 H ASP S 51 -11.075 2.007 -4.034 1.00 0.19 H ATOM 731 HA ASP S 51 -13.658 0.731 -4.030 1.00 0.27 H ATOM 732 HB2 ASP S 51 -11.113 0.295 -2.721 1.00 0.34 H ATOM 733 HB3 ASP S 51 -12.470 0.113 -1.612 1.00 0.38 H ATOM 734 N LYS S 52 -13.054 3.079 -1.835 1.00 0.23 N ATOM 735 CA LYS S 52 -13.733 3.930 -0.864 1.00 0.31 C ATOM 736 C LYS S 52 -14.658 4.909 -1.567 1.00 0.29 C ATOM 737 O LYS S 52 -15.797 5.117 -1.146 1.00 0.31 O ATOM 738 CB LYS S 52 -12.727 4.667 0.007 1.00 0.41 C ATOM 739 CG LYS S 52 -13.373 5.582 1.037 1.00 0.43 C ATOM 740 CD LYS S 52 -12.335 6.254 1.921 1.00 1.03 C ATOM 741 CE LYS S 52 -11.498 7.256 1.142 1.00 1.73 C ATOM 742 NZ LYS S 52 -10.550 7.990 2.025 1.00 2.23 N ATOM 743 H LYS S 52 -12.127 3.269 -2.091 1.00 0.19 H ATOM 744 HA LYS S 52 -14.332 3.287 -0.234 1.00 0.38 H ATOM 745 HB2 LYS S 52 -12.129 3.934 0.529 1.00 0.54 H ATOM 746 HB3 LYS S 52 -12.085 5.262 -0.624 1.00 0.47 H ATOM 747 HG2 LYS S 52 -13.938 6.345 0.523 1.00 0.85 H ATOM 748 HG3 LYS S 52 -14.036 4.997 1.658 1.00 0.96 H ATOM 749 HD2 LYS S 52 -12.841 6.771 2.723 1.00 1.70 H ATOM 750 HD3 LYS S 52 -11.683 5.497 2.332 1.00 1.54 H ATOM 751 HE2 LYS S 52 -10.937 6.727 0.386 1.00 2.21 H ATOM 752 HE3 LYS S 52 -12.160 7.967 0.667 1.00 2.28 H ATOM 753 HZ1 LYS S 52 -9.920 7.318 2.507 1.00 2.51 H ATOM 754 HZ2 LYS S 52 -9.974 8.647 1.462 1.00 2.67 H ATOM 755 HZ3 LYS S 52 -11.075 8.531 2.740 1.00 2.58 H ATOM 756 N LEU S 53 -14.164 5.510 -2.640 1.00 0.27 N ATOM 757 CA LEU S 53 -14.958 6.442 -3.424 1.00 0.30 C ATOM 758 C LEU S 53 -15.879 5.668 -4.335 1.00 0.28 C ATOM 759 O LEU S 53 -16.716 6.237 -5.038 1.00 0.33 O ATOM 760 CB LEU S 53 -14.055 7.333 -4.267 1.00 0.34 C ATOM 761 CG LEU S 53 -13.788 8.718 -3.686 1.00 0.53 C ATOM 762 CD1 LEU S 53 -15.084 9.509 -3.608 1.00 0.66 C ATOM 763 CD2 LEU S 53 -13.145 8.598 -2.313 1.00 0.63 C ATOM 764 H LEU S 53 -13.246 5.314 -2.919 1.00 0.27 H ATOM 765 HA LEU S 53 -15.542 7.050 -2.749 1.00 0.35 H ATOM 766 HB2 LEU S 53 -13.113 6.825 -4.399 1.00 0.30 H ATOM 767 HB3 LEU S 53 -14.512 7.451 -5.236 1.00 0.39 H ATOM 768 HG LEU S 53 -13.107 9.251 -4.333 1.00 0.57 H ATOM 769 HD11 LEU S 53 -15.789 8.980 -2.983 1.00 1.48 H ATOM 770 HD12 LEU S 53 -14.888 10.483 -3.186 1.00 1.15 H ATOM 771 HD13 LEU S 53 -15.496 9.619 -4.599 1.00 1.02 H ATOM 772 HD21 LEU S 53 -13.790 8.025 -1.664 1.00 1.05 H ATOM 773 HD22 LEU S 53 -12.193 8.095 -2.405 1.00 1.27 H ATOM 774 HD23 LEU S 53 -12.995 9.583 -1.897 1.00 1.10 H ATOM 775 N SER S 54 -15.697 4.357 -4.313 1.00 0.24 N ATOM 776 CA SER S 54 -16.478 3.455 -5.136 1.00 0.27 C ATOM 777 C SER S 54 -17.957 3.835 -5.139 1.00 0.32 C ATOM 778 O SER S 54 -18.621 3.762 -6.173 1.00 0.41 O ATOM 779 CB SER S 54 -16.327 2.016 -4.644 1.00 0.28 C ATOM 780 OG SER S 54 -17.046 1.116 -5.470 1.00 0.86 O ATOM 781 H SER S 54 -14.960 4.000 -3.780 1.00 0.22 H ATOM 782 HA SER S 54 -16.081 3.526 -6.132 1.00 0.29 H ATOM 783 HB2 SER S 54 -15.284 1.741 -4.657 1.00 0.69 H ATOM 784 HB3 SER S 54 -16.706 1.942 -3.636 1.00 0.69 H ATOM 785 HG SER S 54 -17.427 0.420 -4.930 1.00 1.22 H ATOM 786 N GLY S 55 -18.468 4.237 -3.979 1.00 0.30 N ATOM 787 CA GLY S 55 -19.862 4.626 -3.878 1.00 0.35 C ATOM 788 C GLY S 55 -20.587 3.923 -2.747 1.00 0.43 C ATOM 789 O GLY S 55 -21.606 4.411 -2.259 1.00 0.52 O ATOM 790 H GLY S 55 -17.892 4.269 -3.186 1.00 0.28 H ATOM 791 HA2 GLY S 55 -20.357 4.392 -4.808 1.00 0.46 H ATOM 792 HA3 GLY S 55 -19.914 5.692 -3.713 1.00 0.35 H