ATOM 32 N GLN S 3 -12.876 -2.967 0.459 1.00 0.47 N ATOM 33 CA GLN S 3 -12.279 -4.273 0.198 1.00 0.32 C ATOM 34 C GLN S 3 -10.876 -4.183 -0.372 1.00 0.20 C ATOM 35 O GLN S 3 -10.144 -5.182 -0.398 1.00 0.16 O ATOM 36 CB GLN S 3 -13.176 -5.071 -0.744 1.00 0.41 C ATOM 37 CG GLN S 3 -12.731 -6.510 -0.950 1.00 1.00 C ATOM 38 CD GLN S 3 -13.680 -7.290 -1.839 1.00 1.06 C ATOM 39 OE1 GLN S 3 -13.522 -7.323 -3.059 1.00 1.31 O ATOM 40 NE2 GLN S 3 -14.674 -7.924 -1.228 1.00 1.80 N ATOM 41 H GLN S 3 -13.447 -2.575 -0.231 1.00 0.79 H ATOM 42 HA GLN S 3 -12.218 -4.795 1.124 1.00 0.34 H ATOM 43 HB2 GLN S 3 -14.179 -5.081 -0.346 1.00 1.09 H ATOM 44 HB3 GLN S 3 -13.183 -4.581 -1.698 1.00 1.01 H ATOM 45 HG2 GLN S 3 -11.753 -6.510 -1.409 1.00 1.66 H ATOM 46 HG3 GLN S 3 -12.677 -6.998 0.011 1.00 1.68 H ATOM 47 HE21 GLN S 3 -14.740 -7.854 -0.253 1.00 2.41 H ATOM 48 HE22 GLN S 3 -15.302 -8.439 -1.778 1.00 1.95 H ATOM 49 N GLU S 4 -10.477 -3.008 -0.826 1.00 0.22 N ATOM 50 CA GLU S 4 -9.170 -2.902 -1.433 1.00 0.23 C ATOM 51 C GLU S 4 -8.062 -3.029 -0.413 1.00 0.21 C ATOM 52 O GLU S 4 -6.921 -3.284 -0.778 1.00 0.27 O ATOM 53 CB GLU S 4 -9.009 -1.614 -2.253 1.00 0.28 C ATOM 54 CG GLU S 4 -8.962 -0.335 -1.431 1.00 0.28 C ATOM 55 CD GLU S 4 -7.790 -0.282 -0.471 1.00 0.92 C ATOM 56 OE1 GLU S 4 -8.028 -0.171 0.749 1.00 1.37 O ATOM 57 OE2 GLU S 4 -6.634 -0.344 -0.940 1.00 1.34 O ATOM 58 H GLU S 4 -11.052 -2.214 -0.728 1.00 0.28 H ATOM 59 HA GLU S 4 -9.086 -3.745 -2.097 1.00 0.25 H ATOM 60 HB2 GLU S 4 -8.089 -1.679 -2.814 1.00 0.34 H ATOM 61 HB3 GLU S 4 -9.833 -1.539 -2.949 1.00 0.33 H ATOM 62 HG2 GLU S 4 -8.878 0.496 -2.109 1.00 0.68 H ATOM 63 HG3 GLU S 4 -9.878 -0.249 -0.867 1.00 0.62 H ATOM 64 N THR S 5 -8.366 -2.856 0.863 1.00 0.17 N ATOM 65 CA THR S 5 -7.328 -2.981 1.858 1.00 0.20 C ATOM 66 C THR S 5 -6.803 -4.405 1.846 1.00 0.20 C ATOM 67 O THR S 5 -5.645 -4.646 1.521 1.00 0.22 O ATOM 68 CB THR S 5 -7.842 -2.634 3.267 1.00 0.21 C ATOM 69 OG1 THR S 5 -8.390 -1.310 3.277 1.00 0.99 O ATOM 70 CG2 THR S 5 -6.725 -2.732 4.294 1.00 1.04 C ATOM 71 H THR S 5 -9.284 -2.664 1.148 1.00 0.18 H ATOM 72 HA THR S 5 -6.526 -2.303 1.602 1.00 0.23 H ATOM 73 HB THR S 5 -8.616 -3.339 3.532 1.00 0.71 H ATOM 74 HG1 THR S 5 -7.813 -0.728 3.774 1.00 1.46 H ATOM 75 HG21 THR S 5 -5.873 -2.160 3.956 1.00 1.63 H ATOM 76 HG22 THR S 5 -7.070 -2.339 5.240 1.00 1.61 H ATOM 77 HG23 THR S 5 -6.439 -3.766 4.418 1.00 1.62 H ATOM 78 N ARG S 6 -7.665 -5.354 2.186 1.00 0.19 N ATOM 79 CA ARG S 6 -7.262 -6.748 2.188 1.00 0.20 C ATOM 80 C ARG S 6 -6.509 -7.138 0.921 1.00 0.17 C ATOM 81 O ARG S 6 -5.322 -7.461 0.989 1.00 0.17 O ATOM 82 CB ARG S 6 -8.468 -7.669 2.405 1.00 0.27 C ATOM 83 CG ARG S 6 -9.662 -7.355 1.522 1.00 0.82 C ATOM 84 CD ARG S 6 -10.919 -8.055 2.020 1.00 0.61 C ATOM 85 NE ARG S 6 -10.734 -9.500 2.127 1.00 0.94 N ATOM 86 CZ ARG S 6 -11.554 -10.303 2.797 1.00 1.24 C ATOM 87 NH1 ARG S 6 -12.615 -9.805 3.421 1.00 1.00 N ATOM 88 NH2 ARG S 6 -11.316 -11.606 2.844 1.00 1.95 N ATOM 89 H ARG S 6 -8.521 -5.110 2.588 1.00 0.19 H ATOM 90 HA ARG S 6 -6.590 -6.874 3.020 1.00 0.23 H ATOM 91 HB2 ARG S 6 -8.165 -8.686 2.208 1.00 0.95 H ATOM 92 HB3 ARG S 6 -8.780 -7.592 3.435 1.00 0.83 H ATOM 93 HG2 ARG S 6 -9.830 -6.289 1.525 1.00 1.40 H ATOM 94 HG3 ARG S 6 -9.451 -7.686 0.515 1.00 1.47 H ATOM 95 HD2 ARG S 6 -11.176 -7.660 2.996 1.00 0.70 H ATOM 96 HD3 ARG S 6 -11.725 -7.854 1.330 1.00 1.03 H ATOM 97 HE ARG S 6 -9.957 -9.892 1.673 1.00 1.26 H ATOM 98 HH11 ARG S 6 -12.799 -8.823 3.388 1.00 0.81 H ATOM 99 HH12 ARG S 6 -13.229 -10.413 3.923 1.00 1.29 H ATOM 100 HH21 ARG S 6 -10.519 -11.986 2.375 1.00 2.27 H ATOM 101 HH22 ARG S 6 -11.934 -12.210 3.349 1.00 2.22 H ATOM 102 N ASP S 7 -7.158 -7.076 -0.240 1.00 0.17 N ATOM 103 CA ASP S 7 -6.520 -7.484 -1.492 1.00 0.18 C ATOM 104 C ASP S 7 -5.359 -6.595 -1.934 1.00 0.16 C ATOM 105 O ASP S 7 -4.281 -7.094 -2.247 1.00 0.16 O ATOM 106 CB ASP S 7 -7.569 -7.510 -2.596 1.00 0.24 C ATOM 107 CG ASP S 7 -7.677 -8.867 -3.263 1.00 0.73 C ATOM 108 OD1 ASP S 7 -6.919 -9.119 -4.224 1.00 1.06 O ATOM 109 OD2 ASP S 7 -8.519 -9.678 -2.826 1.00 1.30 O ATOM 110 H ASP S 7 -8.101 -6.795 -0.302 1.00 0.18 H ATOM 111 HA ASP S 7 -6.150 -8.483 -1.359 1.00 0.18 H ATOM 112 HB2 ASP S 7 -8.525 -7.261 -2.170 1.00 0.74 H ATOM 113 HB3 ASP S 7 -7.312 -6.778 -3.345 1.00 0.50 H ATOM 114 N GLN S 8 -5.572 -5.287 -1.959 1.00 0.17 N ATOM 115 CA GLN S 8 -4.540 -4.371 -2.432 1.00 0.18 C ATOM 116 C GLN S 8 -3.526 -4.018 -1.351 1.00 0.17 C ATOM 117 O GLN S 8 -2.333 -4.242 -1.529 1.00 0.17 O ATOM 118 CB GLN S 8 -5.167 -3.099 -2.999 1.00 0.19 C ATOM 119 CG GLN S 8 -6.281 -3.369 -3.997 1.00 0.31 C ATOM 120 CD GLN S 8 -5.787 -4.057 -5.256 1.00 0.49 C ATOM 121 OE1 GLN S 8 -6.513 -4.831 -5.878 1.00 1.34 O ATOM 122 NE2 GLN S 8 -4.547 -3.774 -5.642 1.00 1.25 N ATOM 123 H GLN S 8 -6.414 -4.931 -1.608 1.00 0.19 H ATOM 124 HA GLN S 8 -4.014 -4.871 -3.231 1.00 0.18 H ATOM 125 HB2 GLN S 8 -5.571 -2.515 -2.186 1.00 0.21 H ATOM 126 HB3 GLN S 8 -4.399 -2.524 -3.495 1.00 0.25 H ATOM 127 HG2 GLN S 8 -7.020 -4.002 -3.528 1.00 0.73 H ATOM 128 HG3 GLN S 8 -6.736 -2.429 -4.272 1.00 0.72 H ATOM 129 HE21 GLN S 8 -4.025 -3.145 -5.101 1.00 1.92 H ATOM 130 HE22 GLN S 8 -4.205 -4.205 -6.453 1.00 1.47 H ATOM 131 N MET S 9 -3.987 -3.461 -0.238 1.00 0.18 N ATOM 132 CA MET S 9 -3.067 -3.073 0.832 1.00 0.20 C ATOM 133 C MET S 9 -2.069 -4.188 1.143 1.00 0.19 C ATOM 134 O MET S 9 -0.866 -3.949 1.165 1.00 0.20 O ATOM 135 CB MET S 9 -3.815 -2.672 2.106 1.00 0.24 C ATOM 136 CG MET S 9 -2.961 -1.875 3.082 1.00 0.27 C ATOM 137 SD MET S 9 -1.685 -2.871 3.880 1.00 1.34 S ATOM 138 CE MET S 9 -0.481 -1.613 4.297 1.00 0.80 C ATOM 139 H MET S 9 -4.953 -3.300 -0.143 1.00 0.19 H ATOM 140 HA MET S 9 -2.513 -2.217 0.478 1.00 0.22 H ATOM 141 HB2 MET S 9 -4.671 -2.073 1.835 1.00 0.27 H ATOM 142 HB3 MET S 9 -4.155 -3.566 2.608 1.00 0.27 H ATOM 143 HG2 MET S 9 -2.482 -1.071 2.544 1.00 0.86 H ATOM 144 HG3 MET S 9 -3.603 -1.463 3.844 1.00 0.91 H ATOM 145 HE1 MET S 9 -0.944 -0.864 4.924 1.00 1.39 H ATOM 146 HE2 MET S 9 0.344 -2.066 4.826 1.00 1.27 H ATOM 147 HE3 MET S 9 -0.116 -1.149 3.392 1.00 1.02 H ATOM 148 N LYS S 10 -2.559 -5.403 1.379 1.00 0.19 N ATOM 149 CA LYS S 10 -1.673 -6.519 1.701 1.00 0.21 C ATOM 150 C LYS S 10 -0.766 -6.902 0.531 1.00 0.19 C ATOM 151 O LYS S 10 0.430 -7.119 0.717 1.00 0.21 O ATOM 152 CB LYS S 10 -2.492 -7.730 2.129 1.00 0.25 C ATOM 153 CG LYS S 10 -2.266 -8.136 3.575 1.00 1.11 C ATOM 154 CD LYS S 10 -3.390 -9.024 4.078 1.00 1.64 C ATOM 155 CE LYS S 10 -4.696 -8.252 4.196 1.00 2.24 C ATOM 156 NZ LYS S 10 -5.830 -9.135 4.580 1.00 3.19 N ATOM 157 H LYS S 10 -3.533 -5.556 1.356 1.00 0.20 H ATOM 158 HA LYS S 10 -1.052 -6.213 2.528 1.00 0.25 H ATOM 159 HB2 LYS S 10 -3.537 -7.503 2.001 1.00 0.75 H ATOM 160 HB3 LYS S 10 -2.234 -8.567 1.497 1.00 0.78 H ATOM 161 HG2 LYS S 10 -1.334 -8.677 3.646 1.00 1.84 H ATOM 162 HG3 LYS S 10 -2.219 -7.247 4.186 1.00 1.69 H ATOM 163 HD2 LYS S 10 -3.528 -9.841 3.385 1.00 2.34 H ATOM 164 HD3 LYS S 10 -3.122 -9.413 5.049 1.00 2.01 H ATOM 165 HE2 LYS S 10 -4.579 -7.485 4.947 1.00 2.66 H ATOM 166 HE3 LYS S 10 -4.914 -7.791 3.243 1.00 2.46 H ATOM 167 HZ1 LYS S 10 -5.957 -9.884 3.869 1.00 3.36 H ATOM 168 HZ2 LYS S 10 -5.643 -9.577 5.504 1.00 3.52 H ATOM 169 HZ3 LYS S 10 -6.709 -8.582 4.646 1.00 3.85 H ATOM 170 N ASN S 11 -1.333 -6.983 -0.668 1.00 0.16 N ATOM 171 CA ASN S 11 -0.561 -7.373 -1.847 1.00 0.17 C ATOM 172 C ASN S 11 0.279 -6.222 -2.396 1.00 0.15 C ATOM 173 O ASN S 11 1.504 -6.319 -2.443 1.00 0.15 O ATOM 174 CB ASN S 11 -1.499 -7.905 -2.934 1.00 0.20 C ATOM 175 CG ASN S 11 -0.754 -8.379 -4.167 1.00 0.31 C ATOM 176 OD1 ASN S 11 -1.261 -8.286 -5.285 1.00 0.99 O ATOM 177 ND2 ASN S 11 0.454 -8.896 -3.971 1.00 1.27 N ATOM 178 H ASN S 11 -2.287 -6.779 -0.763 1.00 0.15 H ATOM 179 HA ASN S 11 0.111 -8.165 -1.547 1.00 0.18 H ATOM 180 HB2 ASN S 11 -2.065 -8.735 -2.535 1.00 0.27 H ATOM 181 HB3 ASN S 11 -2.181 -7.121 -3.226 1.00 0.22 H ATOM 182 HD21 ASN S 11 0.795 -8.943 -3.053 1.00 2.00 H ATOM 183 HD22 ASN S 11 0.957 -9.209 -4.753 1.00 1.33 H ATOM 184 N ALA S 12 -0.374 -5.146 -2.825 1.00 0.16 N ATOM 185 CA ALA S 12 0.336 -3.988 -3.363 1.00 0.17 C ATOM 186 C ALA S 12 1.525 -3.632 -2.486 1.00 0.15 C ATOM 187 O ALA S 12 2.654 -3.523 -2.967 1.00 0.16 O ATOM 188 CB ALA S 12 -0.606 -2.800 -3.495 1.00 0.20 C ATOM 189 H ALA S 12 -1.351 -5.140 -2.813 1.00 0.16 H ATOM 190 HA ALA S 12 0.694 -4.248 -4.348 1.00 0.20 H ATOM 191 HB1 ALA S 12 -0.991 -2.537 -2.521 1.00 0.85 H ATOM 192 HB2 ALA S 12 -0.068 -1.960 -3.908 1.00 0.88 H ATOM 193 HB3 ALA S 12 -1.425 -3.061 -4.148 1.00 0.89 H ATOM 194 N ALA S 13 1.267 -3.453 -1.195 1.00 0.15 N ATOM 195 CA ALA S 13 2.336 -3.139 -0.258 1.00 0.15 C ATOM 196 C ALA S 13 3.414 -4.206 -0.357 1.00 0.13 C ATOM 197 O ALA S 13 4.587 -3.898 -0.550 1.00 0.12 O ATOM 198 CB ALA S 13 1.809 -3.043 1.165 1.00 0.18 C ATOM 199 H ALA S 13 0.342 -3.528 -0.879 1.00 0.15 H ATOM 200 HA ALA S 13 2.757 -2.184 -0.532 1.00 0.16 H ATOM 201 HB1 ALA S 13 2.614 -2.761 1.828 1.00 1.04 H ATOM 202 HB2 ALA S 13 1.413 -4.000 1.469 1.00 1.01 H ATOM 203 HB3 ALA S 13 1.029 -2.298 1.210 1.00 1.05 H ATOM 204 N ALA S 14 3.001 -5.462 -0.185 1.00 0.14 N ATOM 205 CA ALA S 14 3.908 -6.597 -0.291 1.00 0.15 C ATOM 206 C ALA S 14 4.895 -6.443 -1.447 1.00 0.13 C ATOM 207 O ALA S 14 6.107 -6.467 -1.235 1.00 0.14 O ATOM 208 CB ALA S 14 3.123 -7.891 -0.447 1.00 0.17 C ATOM 209 H ALA S 14 2.084 -5.623 0.121 1.00 0.16 H ATOM 210 HA ALA S 14 4.460 -6.661 0.631 1.00 0.17 H ATOM 211 HB1 ALA S 14 2.564 -7.866 -1.370 1.00 0.97 H ATOM 212 HB2 ALA S 14 3.806 -8.727 -0.464 1.00 0.96 H ATOM 213 HB3 ALA S 14 2.442 -8.001 0.384 1.00 1.06 H ATOM 214 N GLU S 15 4.385 -6.274 -2.667 1.00 0.14 N ATOM 215 CA GLU S 15 5.223 -6.137 -3.856 1.00 0.14 C ATOM 216 C GLU S 15 6.068 -4.866 -3.849 1.00 0.12 C ATOM 217 O GLU S 15 7.071 -4.783 -4.560 1.00 0.13 O ATOM 218 CB GLU S 15 4.345 -6.162 -5.104 1.00 0.18 C ATOM 219 CG GLU S 15 3.742 -7.526 -5.379 1.00 0.31 C ATOM 220 CD GLU S 15 4.765 -8.530 -5.872 1.00 0.87 C ATOM 221 OE1 GLU S 15 5.433 -9.160 -5.026 1.00 1.13 O ATOM 222 OE2 GLU S 15 4.896 -8.688 -7.104 1.00 1.28 O ATOM 223 H GLU S 15 3.418 -6.234 -2.818 1.00 0.15 H ATOM 224 HA GLU S 15 5.880 -6.990 -3.888 1.00 0.15 H ATOM 225 HB2 GLU S 15 3.538 -5.455 -4.979 1.00 0.29 H ATOM 226 HB3 GLU S 15 4.939 -5.874 -5.958 1.00 0.17 H ATOM 227 HG2 GLU S 15 3.313 -7.894 -4.466 1.00 0.27 H ATOM 228 HG3 GLU S 15 2.969 -7.424 -6.120 1.00 0.60 H ATOM 229 N ALA S 16 5.685 -3.884 -3.040 1.00 0.11 N ATOM 230 CA ALA S 16 6.415 -2.622 -3.013 1.00 0.12 C ATOM 231 C ALA S 16 7.570 -2.738 -2.044 1.00 0.10 C ATOM 232 O ALA S 16 8.628 -2.136 -2.226 1.00 0.11 O ATOM 233 CB ALA S 16 5.497 -1.476 -2.617 1.00 0.14 C ATOM 234 H ALA S 16 5.041 -4.067 -2.328 1.00 0.11 H ATOM 235 HA ALA S 16 6.802 -2.431 -4.000 1.00 0.14 H ATOM 236 HB1 ALA S 16 5.205 -1.591 -1.584 1.00 1.02 H ATOM 237 HB2 ALA S 16 6.019 -0.539 -2.741 1.00 1.06 H ATOM 238 HB3 ALA S 16 4.618 -1.485 -3.244 1.00 0.99 H ATOM 239 N LYS S 17 7.342 -3.528 -1.008 1.00 0.09 N ATOM 240 CA LYS S 17 8.347 -3.762 0.003 1.00 0.08 C ATOM 241 C LYS S 17 9.367 -4.777 -0.496 1.00 0.09 C ATOM 242 O LYS S 17 10.547 -4.712 -0.175 1.00 0.10 O ATOM 243 CB LYS S 17 7.709 -4.249 1.305 1.00 0.10 C ATOM 244 CG LYS S 17 7.004 -3.153 2.083 1.00 0.10 C ATOM 245 CD LYS S 17 7.997 -2.155 2.659 1.00 0.11 C ATOM 246 CE LYS S 17 7.309 -1.124 3.540 1.00 0.14 C ATOM 247 NZ LYS S 17 8.275 -0.140 4.100 1.00 1.35 N ATOM 248 H LYS S 17 6.470 -3.970 -0.949 1.00 0.10 H ATOM 249 HA LYS S 17 8.847 -2.821 0.177 1.00 0.09 H ATOM 250 HB2 LYS S 17 6.988 -5.018 1.074 1.00 0.10 H ATOM 251 HB3 LYS S 17 8.480 -4.668 1.935 1.00 0.11 H ATOM 252 HG2 LYS S 17 6.328 -2.634 1.419 1.00 0.10 H ATOM 253 HG3 LYS S 17 6.446 -3.601 2.892 1.00 0.11 H ATOM 254 HD2 LYS S 17 8.730 -2.688 3.250 1.00 0.14 H ATOM 255 HD3 LYS S 17 8.494 -1.646 1.845 1.00 0.10 H ATOM 256 HE2 LYS S 17 6.574 -0.598 2.950 1.00 1.01 H ATOM 257 HE3 LYS S 17 6.817 -1.637 4.353 1.00 0.97 H ATOM 258 HZ1 LYS S 17 9.004 -0.631 4.656 1.00 1.96 H ATOM 259 HZ2 LYS S 17 8.736 0.387 3.331 1.00 2.03 H ATOM 260 HZ3 LYS S 17 7.780 0.533 4.719 1.00 1.77 H ATOM 261 N ASP S 18 8.909 -5.715 -1.294 1.00 0.09 N ATOM 262 CA ASP S 18 9.803 -6.722 -1.824 1.00 0.10 C ATOM 263 C ASP S 18 10.612 -6.146 -2.977 1.00 0.11 C ATOM 264 O ASP S 18 11.767 -6.490 -3.171 1.00 0.13 O ATOM 265 CB ASP S 18 9.024 -7.957 -2.280 1.00 0.11 C ATOM 266 CG ASP S 18 8.467 -8.752 -1.116 1.00 1.10 C ATOM 267 OD1 ASP S 18 7.229 -8.778 -0.952 1.00 2.14 O ATOM 268 OD2 ASP S 18 9.269 -9.349 -0.368 1.00 0.95 O ATOM 269 H ASP S 18 7.961 -5.715 -1.541 1.00 0.09 H ATOM 270 HA ASP S 18 10.481 -7.002 -1.031 1.00 0.11 H ATOM 271 HB2 ASP S 18 8.200 -7.643 -2.904 1.00 0.81 H ATOM 272 HB3 ASP S 18 9.679 -8.597 -2.851 1.00 0.79 H ATOM 273 N ASN S 19 10.037 -5.170 -3.655 1.00 0.11 N ATOM 274 CA ASN S 19 10.720 -4.606 -4.813 1.00 0.13 C ATOM 275 C ASN S 19 11.662 -3.479 -4.409 1.00 0.13 C ATOM 276 O ASN S 19 12.901 -3.627 -4.425 1.00 0.14 O ATOM 277 CB ASN S 19 9.705 -4.089 -5.833 1.00 0.14 C ATOM 278 CG ASN S 19 10.367 -3.572 -7.096 1.00 1.11 C ATOM 279 OD1 ASN S 19 9.871 -2.644 -7.736 1.00 2.00 O ATOM 280 ND2 ASN S 19 11.492 -4.175 -7.465 1.00 1.74 N ATOM 281 H ASN S 19 9.267 -4.739 -3.234 1.00 0.10 H ATOM 282 HA ASN S 19 11.300 -5.395 -5.268 1.00 0.14 H ATOM 283 HB2 ASN S 19 9.034 -4.890 -6.103 1.00 0.73 H ATOM 284 HB3 ASN S 19 9.138 -3.283 -5.391 1.00 0.83 H ATOM 285 HD21 ASN S 19 11.828 -4.909 -6.909 1.00 2.04 H ATOM 286 HD22 ASN S 19 11.941 -3.861 -8.278 1.00 2.33 H ATOM 287 N VAL S 20 11.067 -2.400 -3.924 1.00 0.12 N ATOM 288 CA VAL S 20 11.830 -1.233 -3.543 1.00 0.13 C ATOM 289 C VAL S 20 12.375 -1.347 -2.142 1.00 0.12 C ATOM 290 O VAL S 20 13.447 -0.832 -1.863 1.00 0.12 O ATOM 291 CB VAL S 20 11.007 0.060 -3.638 1.00 0.15 C ATOM 292 CG1 VAL S 20 11.934 1.262 -3.670 1.00 0.15 C ATOM 293 CG2 VAL S 20 10.109 0.041 -4.860 1.00 0.19 C ATOM 294 H VAL S 20 10.093 -2.392 -3.822 1.00 0.12 H ATOM 295 HA VAL S 20 12.660 -1.148 -4.228 1.00 0.14 H ATOM 296 HB VAL S 20 10.385 0.135 -2.758 1.00 0.15 H ATOM 297 N HIS S 21 11.680 -2.051 -1.259 1.00 0.11 N ATOM 298 CA HIS S 21 12.169 -2.148 0.098 1.00 0.11 C ATOM 299 C HIS S 21 13.210 -3.242 0.187 1.00 0.11 C ATOM 300 O HIS S 21 14.133 -3.132 0.990 1.00 0.12 O ATOM 301 CB HIS S 21 11.053 -2.378 1.113 1.00 0.12 C ATOM 302 CG HIS S 21 11.372 -1.867 2.485 1.00 0.16 C ATOM 303 ND1 HIS S 21 11.076 -2.568 3.636 1.00 1.17 N ATOM 304 CD2 HIS S 21 11.955 -0.715 2.890 1.00 1.00 C ATOM 305 CE1 HIS S 21 11.461 -1.867 4.688 1.00 0.89 C ATOM 306 NE2 HIS S 21 11.998 -0.740 4.262 1.00 0.52 N ATOM 307 H HIS S 21 10.914 -2.594 -1.539 1.00 0.11 H ATOM 308 HA HIS S 21 12.653 -1.209 0.327 1.00 0.11 H ATOM 309 HB2 HIS S 21 10.158 -1.883 0.774 1.00 0.15 H ATOM 310 HB3 HIS S 21 10.867 -3.438 1.193 1.00 0.13 H ATOM 311 HD1 HIS S 21 10.644 -3.447 3.675 1.00 2.05 H ATOM 312 HD2 HIS S 21 12.319 0.078 2.251 1.00 2.02 H ATOM 313 HE1 HIS S 21 11.355 -2.166 5.720 1.00 1.57 H ATOM 314 HE2 HIS S 21 12.426 -0.067 4.831 1.00 0.98 H ATOM 315 N ASP S 22 13.094 -4.306 -0.630 1.00 0.12 N ATOM 316 CA ASP S 22 14.107 -5.330 -0.561 1.00 0.14 C ATOM 317 C ASP S 22 15.445 -4.674 -0.810 1.00 0.14 C ATOM 318 O ASP S 22 16.321 -4.721 0.058 1.00 0.15 O ATOM 319 CB ASP S 22 13.854 -6.445 -1.560 1.00 0.16 C ATOM 320 CG ASP S 22 14.849 -7.582 -1.427 1.00 0.19 C ATOM 321 OD1 ASP S 22 14.587 -8.508 -0.629 1.00 0.26 O ATOM 322 OD2 ASP S 22 15.887 -7.547 -2.120 1.00 0.24 O ATOM 323 H ASP S 22 12.339 -4.394 -1.268 1.00 0.11 H ATOM 324 HA ASP S 22 14.099 -5.733 0.443 1.00 0.15 H ATOM 325 HB2 ASP S 22 12.861 -6.837 -1.396 1.00 0.16 H ATOM 326 HB3 ASP S 22 13.920 -6.046 -2.562 1.00 0.15 H ATOM 327 N LYS S 23 15.634 -4.050 -1.984 1.00 0.14 N ATOM 328 CA LYS S 23 16.884 -3.346 -2.238 1.00 0.16 C ATOM 329 C LYS S 23 17.209 -2.307 -1.170 1.00 0.12 C ATOM 330 O LYS S 23 18.368 -2.165 -0.785 1.00 0.14 O ATOM 331 CB LYS S 23 16.807 -2.653 -3.599 1.00 0.20 C ATOM 332 CG LYS S 23 15.600 -1.738 -3.737 1.00 0.28 C ATOM 333 CD LYS S 23 15.483 -1.169 -5.142 1.00 0.71 C ATOM 334 CE LYS S 23 16.397 0.029 -5.334 1.00 0.31 C ATOM 335 NZ LYS S 23 16.362 0.534 -6.734 1.00 0.74 N ATOM 336 H LYS S 23 15.062 -4.177 -2.781 1.00 0.14 H ATOM 337 HA LYS S 23 17.676 -4.076 -2.267 1.00 0.21 H ATOM 338 HB2 LYS S 23 17.700 -2.063 -3.743 1.00 0.18 H ATOM 339 HB3 LYS S 23 16.753 -3.405 -4.372 1.00 0.29 H ATOM 340 HG2 LYS S 23 14.706 -2.300 -3.513 1.00 0.78 H ATOM 341 HG3 LYS S 23 15.697 -0.920 -3.034 1.00 0.89 H ATOM 342 HD2 LYS S 23 15.753 -1.934 -5.854 1.00 1.40 H ATOM 343 HD3 LYS S 23 14.460 -0.861 -5.311 1.00 1.45 H ATOM 344 HE2 LYS S 23 16.078 0.818 -4.669 1.00 0.28 H ATOM 345 HE3 LYS S 23 17.407 -0.263 -5.089 1.00 0.31 H ATOM 346 HZ1 LYS S 23 16.665 -0.214 -7.391 1.00 1.32 H ATOM 347 HZ2 LYS S 23 15.397 0.828 -6.984 1.00 1.19 H ATOM 348 HZ3 LYS S 23 17.000 1.349 -6.836 1.00 1.09 H ATOM 349 N ILE S 24 16.205 -1.576 -0.689 1.00 0.09 N ATOM 350 CA ILE S 24 16.445 -0.538 0.301 1.00 0.08 C ATOM 351 C ILE S 24 17.009 -1.081 1.610 1.00 0.09 C ATOM 352 O ILE S 24 18.153 -0.797 1.943 1.00 0.10 O ATOM 353 CB ILE S 24 15.157 0.254 0.601 1.00 0.09 C ATOM 354 CG1 ILE S 24 14.790 1.165 -0.568 1.00 0.09 C ATOM 355 CG2 ILE S 24 15.329 1.079 1.851 1.00 0.12 C ATOM 356 CD1 ILE S 24 13.413 1.799 -0.441 1.00 0.11 C ATOM 357 H ILE S 24 15.285 -1.715 -0.993 1.00 0.09 H ATOM 358 HA ILE S 24 17.166 0.147 -0.120 1.00 0.09 H ATOM 359 HB ILE S 24 14.356 -0.448 0.767 1.00 0.10 H ATOM 360 HD11 ILE S 24 12.703 1.050 -0.125 1.00 0.84 H ATOM 361 HD12 ILE S 24 13.443 2.598 0.290 1.00 0.88 H ATOM 362 HD13 ILE S 24 13.109 2.197 -1.397 1.00 0.88 H ATOM 363 N GLN S 25 16.218 -1.866 2.346 1.00 0.10 N ATOM 364 CA GLN S 25 16.679 -2.410 3.623 1.00 0.13 C ATOM 365 C GLN S 25 18.161 -2.742 3.528 1.00 0.14 C ATOM 366 O GLN S 25 18.984 -2.281 4.319 1.00 0.15 O ATOM 367 CB GLN S 25 15.887 -3.670 3.995 1.00 0.14 C ATOM 368 CG GLN S 25 14.376 -3.484 3.979 1.00 0.14 C ATOM 369 CD GLN S 25 13.654 -4.482 4.866 1.00 0.34 C ATOM 370 OE1 GLN S 25 12.529 -4.888 4.575 1.00 1.19 O ATOM 371 NE2 GLN S 25 14.296 -4.879 5.961 1.00 1.09 N ATOM 372 H GLN S 25 15.300 -2.037 2.051 1.00 0.10 H ATOM 373 HA GLN S 25 16.530 -1.658 4.382 1.00 0.14 H ATOM 374 HB2 GLN S 25 16.135 -4.452 3.294 1.00 0.14 H ATOM 375 HB3 GLN S 25 16.179 -3.983 4.986 1.00 0.16 H ATOM 376 HG2 GLN S 25 14.141 -2.486 4.319 1.00 0.20 H ATOM 377 HG3 GLN S 25 14.022 -3.611 2.965 1.00 0.18 H ATOM 378 HE21 GLN S 25 15.187 -4.511 6.134 1.00 1.83 H ATOM 379 HE22 GLN S 25 13.850 -5.522 6.550 1.00 1.13 H ATOM 380 N GLU S 26 18.465 -3.563 2.551 1.00 0.14 N ATOM 381 CA GLU S 26 19.840 -3.952 2.292 1.00 0.16 C ATOM 382 C GLU S 26 20.751 -2.718 2.151 1.00 0.15 C ATOM 383 O GLU S 26 21.654 -2.506 2.961 1.00 0.17 O ATOM 384 CB GLU S 26 19.917 -4.805 1.024 1.00 0.17 C ATOM 385 CG GLU S 26 21.308 -5.350 0.740 1.00 0.71 C ATOM 386 CD GLU S 26 21.367 -6.147 -0.549 1.00 1.33 C ATOM 387 OE1 GLU S 26 21.077 -7.361 -0.510 1.00 1.09 O ATOM 388 OE2 GLU S 26 21.705 -5.558 -1.596 1.00 2.39 O ATOM 389 H GLU S 26 17.702 -3.962 2.082 1.00 0.14 H ATOM 390 HA GLU S 26 20.180 -4.541 3.131 1.00 0.18 H ATOM 391 HB2 GLU S 26 19.240 -5.639 1.125 1.00 0.59 H ATOM 392 HB3 GLU S 26 19.611 -4.203 0.181 1.00 0.55 H ATOM 393 HG2 GLU S 26 21.998 -4.523 0.666 1.00 1.38 H ATOM 394 HG3 GLU S 26 21.601 -5.992 1.557 1.00 1.31 H ATOM 395 N LEU S 27 20.503 -1.914 1.115 1.00 0.14 N ATOM 396 CA LEU S 27 21.312 -0.717 0.819 1.00 0.14 C ATOM 397 C LEU S 27 20.810 0.615 1.408 1.00 0.12 C ATOM 398 O LEU S 27 21.494 1.274 2.192 1.00 0.13 O ATOM 399 CB LEU S 27 21.381 -0.538 -0.692 1.00 0.15 C ATOM 400 CG LEU S 27 21.673 -1.807 -1.488 1.00 0.20 C ATOM 401 CD1 LEU S 27 21.276 -1.612 -2.940 1.00 0.47 C ATOM 402 CD2 LEU S 27 23.143 -2.182 -1.379 1.00 0.61 C ATOM 403 H LEU S 27 19.752 -2.128 0.526 1.00 0.13 H ATOM 404 HA LEU S 27 22.311 -0.899 1.181 1.00 0.16 H ATOM 405 HB2 LEU S 27 20.433 -0.136 -1.024 1.00 0.13 H ATOM 406 HB3 LEU S 27 22.151 0.184 -0.909 1.00 0.18 H ATOM 407 HG LEU S 27 21.086 -2.622 -1.087 1.00 0.55 H ATOM 408 HD11 LEU S 27 20.299 -1.155 -2.983 1.00 1.07 H ATOM 409 HD12 LEU S 27 21.995 -0.970 -3.427 1.00 1.08 H ATOM 410 HD13 LEU S 27 21.250 -2.569 -3.440 1.00 1.28 H ATOM 411 HD21 LEU S 27 23.413 -2.286 -0.339 1.00 1.18 H ATOM 412 HD22 LEU S 27 23.316 -3.118 -1.890 1.00 1.32 H ATOM 413 HD23 LEU S 27 23.746 -1.408 -1.832 1.00 1.20 H ATOM 414 N LYS S 28 19.599 0.976 0.998 1.00 0.11 N ATOM 415 CA LYS S 28 18.955 2.271 1.288 1.00 0.11 C ATOM 416 C LYS S 28 18.250 2.416 2.641 1.00 0.12 C ATOM 417 O LYS S 28 17.795 3.512 2.961 1.00 0.14 O ATOM 418 CB LYS S 28 17.936 2.582 0.204 1.00 0.12 C ATOM 419 CG LYS S 28 18.514 2.673 -1.190 1.00 0.14 C ATOM 420 CD LYS S 28 18.365 1.355 -1.922 1.00 0.13 C ATOM 421 CE LYS S 28 18.871 1.448 -3.351 1.00 0.21 C ATOM 422 NZ LYS S 28 18.137 2.482 -4.134 1.00 1.31 N ATOM 423 H LYS S 28 19.047 0.310 0.539 1.00 0.10 H ATOM 424 HA LYS S 28 19.726 3.023 1.230 1.00 0.13 H ATOM 425 HB2 LYS S 28 17.186 1.810 0.205 1.00 0.10 H ATOM 426 HB3 LYS S 28 17.466 3.516 0.439 1.00 0.14 H ATOM 427 HG2 LYS S 28 17.988 3.441 -1.738 1.00 0.17 H ATOM 428 HG3 LYS S 28 19.561 2.925 -1.122 1.00 0.16 H ATOM 429 HD2 LYS S 28 18.931 0.601 -1.397 1.00 0.14 H ATOM 430 HD3 LYS S 28 17.319 1.081 -1.930 1.00 0.12 H ATOM 431 HE2 LYS S 28 19.920 1.702 -3.334 1.00 1.09 H ATOM 432 HE3 LYS S 28 18.741 0.488 -3.828 1.00 0.98 H ATOM 433 HZ1 LYS S 28 17.121 2.261 -4.153 1.00 1.96 H ATOM 434 HZ2 LYS S 28 18.268 3.418 -3.700 1.00 1.89 H ATOM 435 HZ3 LYS S 28 18.494 2.512 -5.111 1.00 1.54 H ATOM 436 N ASP S 29 18.116 1.339 3.402 1.00 0.12 N ATOM 437 CA ASP S 29 17.326 1.347 4.648 1.00 0.14 C ATOM 438 C ASP S 29 17.356 2.657 5.450 1.00 0.17 C ATOM 439 O ASP S 29 16.445 2.891 6.246 1.00 0.19 O ATOM 440 CB ASP S 29 17.796 0.215 5.559 1.00 0.16 C ATOM 441 CG ASP S 29 16.893 0.025 6.761 1.00 1.17 C ATOM 442 OD1 ASP S 29 15.936 -0.772 6.664 1.00 2.17 O ATOM 443 OD2 ASP S 29 17.142 0.674 7.799 1.00 1.10 O ATOM 444 H ASP S 29 18.603 0.526 3.165 1.00 0.12 H ATOM 445 HA ASP S 29 16.303 1.148 4.372 1.00 0.14 H ATOM 446 HB2 ASP S 29 17.814 -0.703 4.999 1.00 0.90 H ATOM 447 HB3 ASP S 29 18.793 0.436 5.911 1.00 0.91 H ATOM 448 N ASP S 30 18.354 3.516 5.274 1.00 0.18 N ATOM 449 CA ASP S 30 18.367 4.763 6.041 1.00 0.21 C ATOM 450 C ASP S 30 17.591 5.882 5.326 1.00 0.22 C ATOM 451 O ASP S 30 16.487 6.250 5.726 1.00 0.23 O ATOM 452 CB ASP S 30 19.809 5.210 6.293 1.00 0.23 C ATOM 453 CG ASP S 30 19.885 6.455 7.154 1.00 1.12 C ATOM 454 OD1 ASP S 30 19.959 6.317 8.394 1.00 1.04 O ATOM 455 OD2 ASP S 30 19.869 7.569 6.589 1.00 2.14 O ATOM 456 H ASP S 30 19.021 3.360 4.574 1.00 0.16 H ATOM 457 HA ASP S 30 17.893 4.568 6.991 1.00 0.23 H ATOM 458 HB2 ASP S 30 20.342 4.416 6.793 1.00 1.01 H ATOM 459 HB3 ASP S 30 20.285 5.417 5.347 1.00 0.89 H ATOM 460 N VAL S 31 18.201 6.410 4.265 1.00 0.21 N ATOM 461 CA VAL S 31 17.595 7.489 3.469 1.00 0.23 C ATOM 462 C VAL S 31 16.692 6.985 2.339 1.00 0.21 C ATOM 463 O VAL S 31 15.508 7.316 2.271 1.00 0.23 O ATOM 464 CB VAL S 31 18.700 8.381 2.861 1.00 0.24 C ATOM 465 CG1 VAL S 31 19.698 7.555 2.057 1.00 1.32 C ATOM 466 CG2 VAL S 31 18.096 9.488 2.009 1.00 1.26 C ATOM 467 H VAL S 31 19.136 6.158 4.131 1.00 0.20 H ATOM 468 HA VAL S 31 17.007 8.101 4.135 1.00 0.25 H ATOM 469 HB VAL S 31 19.235 8.837 3.672 1.00 1.09 H ATOM 470 N GLY S 32 17.282 6.195 1.466 1.00 0.19 N ATOM 471 CA GLY S 32 16.560 5.648 0.324 1.00 0.18 C ATOM 472 C GLY S 32 15.263 4.956 0.723 1.00 0.17 C ATOM 473 O GLY S 32 14.405 4.690 -0.119 1.00 0.18 O ATOM 474 H GLY S 32 18.229 6.008 1.629 1.00 0.18 H ATOM 475 HA2 GLY S 32 17.193 4.941 -0.184 1.00 0.17 H ATOM 476 HA3 GLY S 32 16.326 6.454 -0.356 1.00 0.21 H ATOM 477 N ASN S 33 15.141 4.658 2.015 1.00 0.18 N ATOM 478 CA ASN S 33 13.958 3.993 2.571 1.00 0.19 C ATOM 479 C ASN S 33 12.649 4.660 2.170 1.00 0.23 C ATOM 480 O ASN S 33 11.575 4.147 2.490 1.00 0.26 O ATOM 481 CB ASN S 33 14.044 3.951 4.094 1.00 0.23 C ATOM 482 CG ASN S 33 13.137 2.897 4.698 1.00 1.14 C ATOM 483 OD1 ASN S 33 12.874 1.865 4.084 1.00 2.05 O ATOM 484 ND2 ASN S 33 12.653 3.154 5.907 1.00 1.79 N ATOM 485 H ASN S 33 15.897 4.866 2.602 1.00 0.18 H ATOM 486 HA ASN S 33 13.942 2.985 2.198 1.00 0.17 H ATOM 487 HB2 ASN S 33 15.059 3.739 4.388 1.00 0.87 H ATOM 488 HB3 ASN S 33 13.749 4.915 4.485 1.00 0.97 H ATOM 489 HD21 ASN S 33 12.906 3.998 6.337 1.00 2.06 H ATOM 490 HD22 ASN S 33 12.066 2.489 6.321 1.00 2.43 H ATOM 491 N LYS S 34 12.713 5.787 1.479 1.00 0.25 N ATOM 492 CA LYS S 34 11.497 6.461 1.073 1.00 0.30 C ATOM 493 C LYS S 34 10.989 5.887 -0.242 1.00 0.28 C ATOM 494 O LYS S 34 9.788 5.687 -0.420 1.00 0.43 O ATOM 495 CB LYS S 34 11.722 7.966 0.942 1.00 0.35 C ATOM 496 CG LYS S 34 10.559 8.810 1.449 1.00 0.71 C ATOM 497 CD LYS S 34 9.246 8.436 0.779 1.00 0.43 C ATOM 498 CE LYS S 34 8.070 9.160 1.411 1.00 0.74 C ATOM 499 NZ LYS S 34 8.216 10.639 1.324 1.00 1.04 N ATOM 500 H LYS S 34 13.576 6.145 1.190 1.00 0.24 H ATOM 501 HA LYS S 34 10.763 6.280 1.835 1.00 0.33 H ATOM 502 HB2 LYS S 34 12.601 8.231 1.507 1.00 0.54 H ATOM 503 HB3 LYS S 34 11.886 8.204 -0.097 1.00 0.45 H ATOM 504 HG2 LYS S 34 10.459 8.665 2.512 1.00 1.35 H ATOM 505 HG3 LYS S 34 10.770 9.849 1.243 1.00 1.36 H ATOM 506 HD2 LYS S 34 9.299 8.701 -0.266 1.00 1.09 H ATOM 507 HD3 LYS S 34 9.094 7.370 0.875 1.00 1.10 H ATOM 508 HE2 LYS S 34 7.166 8.867 0.900 1.00 0.96 H ATOM 509 HE3 LYS S 34 8.005 8.874 2.450 1.00 0.96 H ATOM 510 HZ1 LYS S 34 9.098 10.940 1.788 1.00 1.17 H ATOM 511 HZ2 LYS S 34 8.242 10.938 0.329 1.00 1.30 H ATOM 512 HZ3 LYS S 34 7.414 11.106 1.794 1.00 1.60 H ATOM 513 N ALA S 35 11.925 5.618 -1.151 1.00 0.19 N ATOM 514 CA ALA S 35 11.604 5.069 -2.464 1.00 0.19 C ATOM 515 C ALA S 35 10.500 4.017 -2.387 1.00 0.16 C ATOM 516 O ALA S 35 9.656 3.935 -3.278 1.00 0.18 O ATOM 517 CB ALA S 35 12.856 4.492 -3.107 1.00 0.24 C ATOM 518 H ALA S 35 12.861 5.809 -0.936 1.00 0.24 H ATOM 519 HA ALA S 35 11.258 5.883 -3.084 1.00 0.21 H ATOM 520 HB1 ALA S 35 13.556 5.289 -3.309 1.00 0.96 H ATOM 521 HB2 ALA S 35 13.309 3.779 -2.436 1.00 0.96 H ATOM 522 HB3 ALA S 35 12.593 4.001 -4.032 1.00 1.04 H ATOM 523 N ALA S 36 10.500 3.213 -1.322 1.00 0.12 N ATOM 524 CA ALA S 36 9.470 2.194 -1.159 1.00 0.13 C ATOM 525 C ALA S 36 8.140 2.871 -0.857 1.00 0.21 C ATOM 526 O ALA S 36 7.196 2.786 -1.645 1.00 0.59 O ATOM 527 CB ALA S 36 9.847 1.212 -0.051 1.00 0.20 C ATOM 528 H ALA S 36 11.187 3.318 -0.631 1.00 0.13 H ATOM 529 HA ALA S 36 9.382 1.651 -2.090 1.00 0.16 H ATOM 530 HB1 ALA S 36 10.923 1.109 -0.014 1.00 0.96 H ATOM 531 HB2 ALA S 36 9.397 0.244 -0.246 1.00 1.13 H ATOM 532 HB3 ALA S 36 9.495 1.589 0.898 1.00 0.98 H ATOM 533 N GLU S 37 8.066 3.529 0.302 1.00 0.32 N ATOM 534 CA GLU S 37 6.874 4.270 0.705 1.00 0.32 C ATOM 535 C GLU S 37 6.296 5.103 -0.440 1.00 0.23 C ATOM 536 O GLU S 37 5.115 5.454 -0.422 1.00 0.21 O ATOM 537 CB GLU S 37 7.213 5.187 1.886 1.00 0.42 C ATOM 538 CG GLU S 37 7.969 4.490 3.008 1.00 0.46 C ATOM 539 CD GLU S 37 7.158 3.389 3.664 1.00 1.23 C ATOM 540 OE1 GLU S 37 7.224 2.238 3.185 1.00 2.24 O ATOM 541 OE2 GLU S 37 6.459 3.679 4.657 1.00 1.13 O ATOM 542 H GLU S 37 8.782 3.433 0.963 1.00 0.74 H ATOM 543 HA GLU S 37 6.133 3.556 1.022 1.00 0.36 H ATOM 544 HB2 GLU S 37 7.821 6.005 1.526 1.00 0.45 H ATOM 545 HB3 GLU S 37 6.295 5.585 2.292 1.00 0.51 H ATOM 546 HG2 GLU S 37 8.874 4.058 2.604 1.00 0.93 H ATOM 547 HG3 GLU S 37 8.229 5.223 3.759 1.00 0.95 H ATOM 548 N VAL S 38 7.120 5.413 -1.439 1.00 0.25 N ATOM 549 CA VAL S 38 6.665 6.204 -2.574 1.00 0.25 C ATOM 550 C VAL S 38 5.761 5.369 -3.474 1.00 0.21 C ATOM 551 O VAL S 38 4.664 5.794 -3.836 1.00 0.18 O ATOM 552 CB VAL S 38 7.851 6.745 -3.395 1.00 0.36 C ATOM 553 CG1 VAL S 38 7.358 7.499 -4.621 1.00 0.39 C ATOM 554 CG2 VAL S 38 8.729 7.638 -2.533 1.00 0.45 C ATOM 555 H VAL S 38 8.037 5.069 -1.438 1.00 0.31 H ATOM 556 HA VAL S 38 6.101 7.043 -2.192 1.00 0.24 H ATOM 557 HB VAL S 38 8.445 5.906 -3.730 1.00 0.38 H ATOM 558 N ARG S 39 6.246 4.189 -3.852 1.00 0.25 N ATOM 559 CA ARG S 39 5.476 3.280 -4.694 1.00 0.30 C ATOM 560 C ARG S 39 4.060 3.105 -4.146 1.00 0.31 C ATOM 561 O ARG S 39 3.088 3.071 -4.903 1.00 0.37 O ATOM 562 CB ARG S 39 6.177 1.920 -4.781 1.00 0.41 C ATOM 563 CG ARG S 39 5.712 1.059 -5.947 1.00 0.53 C ATOM 564 CD ARG S 39 4.423 0.316 -5.624 1.00 0.36 C ATOM 565 NE ARG S 39 3.978 -0.514 -6.738 1.00 0.63 N ATOM 566 CZ ARG S 39 2.967 -1.374 -6.661 1.00 0.88 C ATOM 567 NH1 ARG S 39 2.304 -1.525 -5.522 1.00 1.02 N ATOM 568 NH2 ARG S 39 2.618 -2.086 -7.723 1.00 1.24 N ATOM 569 H ARG S 39 7.164 3.948 -3.595 1.00 0.28 H ATOM 570 HA ARG S 39 5.418 3.711 -5.682 1.00 0.33 H ATOM 571 HB2 ARG S 39 7.240 2.081 -4.885 1.00 0.68 H ATOM 572 HB3 ARG S 39 5.995 1.376 -3.866 1.00 0.58 H ATOM 573 HG2 ARG S 39 5.542 1.693 -6.803 1.00 0.91 H ATOM 574 HG3 ARG S 39 6.482 0.338 -6.178 1.00 1.03 H ATOM 575 HD2 ARG S 39 4.592 -0.313 -4.764 1.00 0.67 H ATOM 576 HD3 ARG S 39 3.654 1.038 -5.395 1.00 0.36 H ATOM 577 HE ARG S 39 4.456 -0.426 -7.590 1.00 0.86 H ATOM 578 HH11 ARG S 39 2.564 -0.992 -4.717 1.00 0.99 H ATOM 579 HH12 ARG S 39 1.543 -2.171 -5.469 1.00 1.33 H ATOM 580 HH21 ARG S 39 3.116 -1.977 -8.584 1.00 1.39 H ATOM 581 HH22 ARG S 39 1.857 -2.732 -7.665 1.00 1.46 H ATOM 582 N ASP S 40 3.950 3.011 -2.823 1.00 0.31 N ATOM 583 CA ASP S 40 2.656 2.829 -2.173 1.00 0.37 C ATOM 584 C ASP S 40 1.852 4.127 -2.152 1.00 0.32 C ATOM 585 O ASP S 40 0.628 4.103 -2.025 1.00 0.39 O ATOM 586 CB ASP S 40 2.851 2.312 -0.746 1.00 0.46 C ATOM 587 CG ASP S 40 1.537 2.085 -0.026 1.00 0.57 C ATOM 588 OD1 ASP S 40 1.179 2.918 0.835 1.00 0.54 O ATOM 589 OD2 ASP S 40 0.862 1.077 -0.324 1.00 0.71 O ATOM 590 H ASP S 40 4.756 3.071 -2.267 1.00 0.33 H ATOM 591 HA ASP S 40 2.106 2.091 -2.738 1.00 0.45 H ATOM 592 HB2 ASP S 40 3.389 1.376 -0.779 1.00 0.52 H ATOM 593 HB3 ASP S 40 3.428 3.034 -0.185 1.00 0.42 H ATOM 594 N ALA S 41 2.543 5.256 -2.273 1.00 0.24 N ATOM 595 CA ALA S 41 1.884 6.558 -2.266 1.00 0.24 C ATOM 596 C ALA S 41 0.905 6.687 -3.431 1.00 0.25 C ATOM 597 O ALA S 41 -0.283 6.942 -3.230 1.00 0.28 O ATOM 598 CB ALA S 41 2.918 7.672 -2.314 1.00 0.26 C ATOM 599 H ALA S 41 3.518 5.213 -2.365 1.00 0.22 H ATOM 600 HA ALA S 41 1.338 6.648 -1.339 1.00 0.24 H ATOM 601 HB1 ALA S 41 3.433 7.645 -3.263 1.00 0.99 H ATOM 602 HB2 ALA S 41 3.632 7.534 -1.514 1.00 0.90 H ATOM 603 HB3 ALA S 41 2.427 8.626 -2.197 1.00 0.97 H ATOM 604 N VAL S 42 1.412 6.511 -4.648 1.00 0.25 N ATOM 605 CA VAL S 42 0.585 6.604 -5.848 1.00 0.29 C ATOM 606 C VAL S 42 -0.514 5.547 -5.849 1.00 0.29 C ATOM 607 O VAL S 42 -1.681 5.840 -6.122 1.00 0.29 O ATOM 608 CB VAL S 42 1.430 6.435 -7.121 1.00 0.34 C ATOM 609 CG1 VAL S 42 2.202 7.708 -7.422 1.00 0.36 C ATOM 610 CG2 VAL S 42 2.379 5.253 -6.988 1.00 0.35 C ATOM 611 H VAL S 42 2.369 6.313 -4.741 1.00 0.25 H ATOM 612 HA VAL S 42 0.132 7.584 -5.868 1.00 0.30 H ATOM 613 HB VAL S 42 0.762 6.237 -7.943 1.00 0.39 H ATOM 614 N SER S 43 -0.122 4.320 -5.544 1.00 0.30 N ATOM 615 CA SER S 43 -1.061 3.205 -5.501 1.00 0.32 C ATOM 616 C SER S 43 -2.247 3.558 -4.608 1.00 0.28 C ATOM 617 O SER S 43 -3.405 3.436 -5.010 1.00 0.27 O ATOM 618 CB SER S 43 -0.369 1.943 -4.983 1.00 0.34 C ATOM 619 OG SER S 43 -1.259 0.842 -4.970 1.00 1.24 O ATOM 620 H SER S 43 0.825 4.181 -5.323 1.00 0.31 H ATOM 621 HA SER S 43 -1.417 3.028 -6.506 1.00 0.35 H ATOM 622 HB2 SER S 43 0.468 1.705 -5.622 1.00 1.03 H ATOM 623 HB3 SER S 43 -0.016 2.117 -3.978 1.00 1.02 H ATOM 624 HG SER S 43 -1.098 0.309 -4.188 1.00 1.72 H ATOM 625 N SER S 44 -1.934 3.993 -3.393 1.00 0.27 N ATOM 626 CA SER S 44 -2.945 4.385 -2.414 1.00 0.25 C ATOM 627 C SER S 44 -3.968 5.354 -3.009 1.00 0.22 C ATOM 628 O SER S 44 -5.165 5.238 -2.745 1.00 0.21 O ATOM 629 CB SER S 44 -2.278 5.026 -1.197 1.00 0.26 C ATOM 630 OG SER S 44 -3.243 5.428 -0.239 1.00 1.31 O ATOM 631 H SER S 44 -0.990 4.011 -3.140 1.00 0.29 H ATOM 632 HA SER S 44 -3.460 3.490 -2.098 1.00 0.27 H ATOM 633 HB2 SER S 44 -1.609 4.314 -0.739 1.00 0.92 H ATOM 634 HB3 SER S 44 -1.717 5.894 -1.512 1.00 1.02 H ATOM 635 HG SER S 44 -2.868 5.357 0.642 1.00 1.65 H ATOM 636 N THR S 45 -3.495 6.306 -3.812 1.00 0.22 N ATOM 637 CA THR S 45 -4.378 7.294 -4.431 1.00 0.22 C ATOM 638 C THR S 45 -5.468 6.612 -5.251 1.00 0.21 C ATOM 639 O THR S 45 -6.629 7.029 -5.242 1.00 0.19 O ATOM 640 CB THR S 45 -3.588 8.256 -5.339 1.00 0.26 C ATOM 641 OG1 THR S 45 -2.559 8.907 -4.585 1.00 0.74 O ATOM 642 CG2 THR S 45 -4.507 9.300 -5.955 1.00 0.81 C ATOM 643 H THR S 45 -2.536 6.338 -4.006 1.00 0.24 H ATOM 644 HA THR S 45 -4.840 7.870 -3.642 1.00 0.21 H ATOM 645 HB THR S 45 -3.133 7.683 -6.135 1.00 0.63 H ATOM 646 HG1 THR S 45 -1.700 8.597 -4.881 1.00 1.32 H ATOM 647 HG21 THR S 45 -4.996 9.859 -5.171 1.00 1.36 H ATOM 648 HG22 THR S 45 -3.926 9.973 -6.568 1.00 1.30 H ATOM 649 HG23 THR S 45 -5.252 8.810 -6.565 1.00 1.54 H ATOM 650 N VAL S 46 -5.083 5.552 -5.946 1.00 0.24 N ATOM 651 CA VAL S 46 -6.022 4.797 -6.767 1.00 0.25 C ATOM 652 C VAL S 46 -6.919 3.955 -5.871 1.00 0.23 C ATOM 653 O VAL S 46 -8.136 4.134 -5.836 1.00 0.21 O ATOM 654 CB VAL S 46 -5.294 3.878 -7.765 1.00 0.30 C ATOM 655 CG1 VAL S 46 -6.294 3.049 -8.559 1.00 0.34 C ATOM 656 CG2 VAL S 46 -4.413 4.694 -8.698 1.00 0.32 C ATOM 657 H VAL S 46 -4.150 5.257 -5.865 1.00 0.25 H ATOM 658 HA VAL S 46 -6.629 5.499 -7.320 1.00 0.25 H ATOM 659 HB VAL S 46 -4.661 3.203 -7.207 1.00 0.30 H ATOM 660 N GLU S 47 -6.293 3.024 -5.163 1.00 0.24 N ATOM 661 CA GLU S 47 -6.989 2.141 -4.231 1.00 0.25 C ATOM 662 C GLU S 47 -7.979 2.895 -3.344 1.00 0.19 C ATOM 663 O GLU S 47 -8.908 2.301 -2.800 1.00 0.18 O ATOM 664 CB GLU S 47 -5.980 1.393 -3.371 1.00 0.30 C ATOM 665 CG GLU S 47 -5.628 0.024 -3.915 1.00 0.41 C ATOM 666 CD GLU S 47 -5.070 0.078 -5.324 1.00 1.37 C ATOM 667 OE1 GLU S 47 -5.835 -0.186 -6.276 1.00 2.44 O ATOM 668 OE2 GLU S 47 -3.869 0.385 -5.477 1.00 1.32 O ATOM 669 H GLU S 47 -5.335 2.894 -5.321 1.00 0.26 H ATOM 670 HA GLU S 47 -7.540 1.423 -4.810 1.00 0.29 H ATOM 671 HB2 GLU S 47 -5.074 1.976 -3.304 1.00 0.41 H ATOM 672 HB3 GLU S 47 -6.390 1.266 -2.384 1.00 0.28 H ATOM 673 HG2 GLU S 47 -4.891 -0.427 -3.269 1.00 0.58 H ATOM 674 HG3 GLU S 47 -6.524 -0.583 -3.918 1.00 1.01 H ATOM 675 N SER S 48 -7.820 4.205 -3.235 1.00 0.17 N ATOM 676 CA SER S 48 -8.716 4.981 -2.395 1.00 0.16 C ATOM 677 C SER S 48 -9.998 5.298 -3.152 1.00 0.17 C ATOM 678 O SER S 48 -11.092 4.917 -2.735 1.00 0.19 O ATOM 679 CB SER S 48 -8.042 6.272 -1.926 1.00 0.20 C ATOM 680 OG SER S 48 -6.978 5.998 -1.031 1.00 1.00 O ATOM 681 H SER S 48 -7.146 4.659 -3.781 1.00 0.18 H ATOM 682 HA SER S 48 -8.960 4.373 -1.538 1.00 0.18 H ATOM 683 HB2 SER S 48 -7.648 6.801 -2.780 1.00 0.93 H ATOM 684 HB3 SER S 48 -8.769 6.893 -1.422 1.00 0.88 H ATOM 685 HG SER S 48 -6.877 6.730 -0.419 1.00 1.35 H ATOM 686 N ILE S 49 -9.845 5.994 -4.268 1.00 0.18 N ATOM 687 CA ILE S 49 -10.983 6.349 -5.103 1.00 0.23 C ATOM 688 C ILE S 49 -11.658 5.110 -5.681 1.00 0.21 C ATOM 689 O ILE S 49 -12.799 5.171 -6.136 1.00 0.25 O ATOM 690 CB ILE S 49 -10.598 7.294 -6.257 1.00 0.30 C ATOM 691 CG1 ILE S 49 -9.328 6.811 -6.965 1.00 0.29 C ATOM 692 CG2 ILE S 49 -10.427 8.713 -5.738 1.00 0.34 C ATOM 693 CD1 ILE S 49 -9.572 5.685 -7.951 1.00 0.32 C ATOM 694 H ILE S 49 -8.943 6.298 -4.506 1.00 0.18 H ATOM 695 HA ILE S 49 -11.697 6.864 -4.477 1.00 0.25 H ATOM 696 HB ILE S 49 -11.414 7.300 -6.964 1.00 0.34 H ATOM 697 HD11 ILE S 49 -10.347 5.975 -8.645 1.00 1.01 H ATOM 698 HD12 ILE S 49 -8.662 5.477 -8.493 1.00 0.92 H ATOM 699 HD13 ILE S 49 -9.881 4.799 -7.416 1.00 1.02 H ATOM 700 N LYS S 50 -10.950 3.986 -5.690 1.00 0.19 N ATOM 701 CA LYS S 50 -11.510 2.771 -6.249 1.00 0.22 C ATOM 702 C LYS S 50 -12.546 2.120 -5.325 1.00 0.20 C ATOM 703 O LYS S 50 -13.710 1.996 -5.698 1.00 0.21 O ATOM 704 CB LYS S 50 -10.389 1.766 -6.591 1.00 0.28 C ATOM 705 CG LYS S 50 -9.981 0.861 -5.429 1.00 0.33 C ATOM 706 CD LYS S 50 -9.026 -0.242 -5.838 1.00 0.36 C ATOM 707 CE LYS S 50 -9.550 -1.032 -7.026 1.00 1.13 C ATOM 708 NZ LYS S 50 -8.638 -2.149 -7.399 1.00 1.59 N ATOM 709 H LYS S 50 -10.045 3.975 -5.317 1.00 0.17 H ATOM 710 HA LYS S 50 -12.007 3.048 -7.165 1.00 0.26 H ATOM 711 HB2 LYS S 50 -10.725 1.140 -7.403 1.00 0.34 H ATOM 712 HB3 LYS S 50 -9.518 2.317 -6.913 1.00 0.36 H ATOM 713 HG2 LYS S 50 -9.503 1.463 -4.672 1.00 0.52 H ATOM 714 HG3 LYS S 50 -10.868 0.409 -5.016 1.00 0.57 H ATOM 715 HD2 LYS S 50 -8.073 0.193 -6.096 1.00 0.81 H ATOM 716 HD3 LYS S 50 -8.907 -0.913 -4.994 1.00 0.83 H ATOM 717 HE2 LYS S 50 -10.518 -1.437 -6.773 1.00 1.86 H ATOM 718 HE3 LYS S 50 -9.650 -0.362 -7.867 1.00 1.65 H ATOM 719 HZ1 LYS S 50 -8.512 -2.792 -6.592 1.00 2.09 H ATOM 720 HZ2 LYS S 50 -9.038 -2.686 -8.195 1.00 2.04 H ATOM 721 HZ3 LYS S 50 -7.709 -1.775 -7.679 1.00 1.98 H ATOM 722 N ASP S 51 -12.128 1.705 -4.128 1.00 0.19 N ATOM 723 CA ASP S 51 -13.017 1.012 -3.204 1.00 0.24 C ATOM 724 C ASP S 51 -13.813 1.919 -2.269 1.00 0.24 C ATOM 725 O ASP S 51 -14.979 1.643 -1.989 1.00 0.29 O ATOM 726 CB ASP S 51 -12.218 -0.014 -2.409 1.00 0.31 C ATOM 727 CG ASP S 51 -12.764 -1.421 -2.576 1.00 0.76 C ATOM 728 OD1 ASP S 51 -13.951 -1.638 -2.256 1.00 1.03 O ATOM 729 OD2 ASP S 51 -12.002 -2.305 -3.020 1.00 1.06 O ATOM 730 H ASP S 51 -11.186 1.821 -3.874 1.00 0.19 H ATOM 731 HA ASP S 51 -13.725 0.482 -3.809 1.00 0.27 H ATOM 732 HB2 ASP S 51 -11.190 -0.006 -2.760 1.00 0.34 H ATOM 733 HB3 ASP S 51 -12.246 0.246 -1.363 1.00 0.38 H ATOM 734 N LYS S 52 -13.203 2.981 -1.773 1.00 0.23 N ATOM 735 CA LYS S 52 -13.907 3.872 -0.857 1.00 0.31 C ATOM 736 C LYS S 52 -14.881 4.754 -1.618 1.00 0.29 C ATOM 737 O LYS S 52 -16.001 4.994 -1.169 1.00 0.31 O ATOM 738 CB LYS S 52 -12.922 4.713 -0.061 1.00 0.41 C ATOM 739 CG LYS S 52 -13.592 5.705 0.881 1.00 0.43 C ATOM 740 CD LYS S 52 -12.573 6.511 1.672 1.00 1.03 C ATOM 741 CE LYS S 52 -12.046 5.732 2.866 1.00 1.73 C ATOM 742 NZ LYS S 52 -11.026 6.507 3.627 1.00 2.23 N ATOM 743 H LYS S 52 -12.286 3.188 -2.047 1.00 0.19 H ATOM 744 HA LYS S 52 -14.470 3.254 -0.171 1.00 0.38 H ATOM 745 HB2 LYS S 52 -12.302 4.046 0.524 1.00 0.54 H ATOM 746 HB3 LYS S 52 -12.297 5.263 -0.747 1.00 0.47 H ATOM 747 HG2 LYS S 52 -14.196 6.385 0.300 1.00 0.85 H ATOM 748 HG3 LYS S 52 -14.220 5.162 1.571 1.00 0.96 H ATOM 749 HD2 LYS S 52 -11.745 6.760 1.025 1.00 1.70 H ATOM 750 HD3 LYS S 52 -13.043 7.418 2.025 1.00 1.54 H ATOM 751 HE2 LYS S 52 -12.872 5.501 3.523 1.00 2.21 H ATOM 752 HE3 LYS S 52 -11.600 4.814 2.514 1.00 2.28 H ATOM 753 HZ1 LYS S 52 -11.435 7.401 3.967 1.00 2.51 H ATOM 754 HZ2 LYS S 52 -10.696 5.957 4.445 1.00 2.67 H ATOM 755 HZ3 LYS S 52 -10.212 6.721 3.016 1.00 2.58 H ATOM 756 N LEU S 53 -14.446 5.233 -2.775 1.00 0.27 N ATOM 757 CA LEU S 53 -15.287 6.062 -3.621 1.00 0.30 C ATOM 758 C LEU S 53 -16.178 5.175 -4.455 1.00 0.28 C ATOM 759 O LEU S 53 -17.079 5.644 -5.152 1.00 0.33 O ATOM 760 CB LEU S 53 -14.430 6.912 -4.548 1.00 0.34 C ATOM 761 CG LEU S 53 -14.193 8.344 -4.079 1.00 0.53 C ATOM 762 CD1 LEU S 53 -15.510 9.099 -4.023 1.00 0.66 C ATOM 763 CD2 LEU S 53 -13.508 8.346 -2.720 1.00 0.63 C ATOM 764 H LEU S 53 -13.539 5.014 -3.075 1.00 0.27 H ATOM 765 HA LEU S 53 -15.890 6.699 -2.993 1.00 0.35 H ATOM 766 HB2 LEU S 53 -13.474 6.423 -4.663 1.00 0.30 H ATOM 767 HB3 LEU S 53 -14.910 6.942 -5.512 1.00 0.39 H ATOM 768 HG LEU S 53 -13.547 8.847 -4.784 1.00 0.57 H ATOM 769 HD11 LEU S 53 -16.188 8.587 -3.356 1.00 1.02 H ATOM 770 HD12 LEU S 53 -15.338 10.102 -3.665 1.00 1.48 H ATOM 771 HD13 LEU S 53 -15.941 9.138 -5.013 1.00 1.15 H ATOM 772 HD21 LEU S 53 -14.105 7.783 -2.017 1.00 1.27 H ATOM 773 HD22 LEU S 53 -12.533 7.890 -2.810 1.00 1.10 H ATOM 774 HD23 LEU S 53 -13.401 9.362 -2.371 1.00 1.05 H ATOM 775 N SER S 54 -15.897 3.884 -4.376 1.00 0.24 N ATOM 776 CA SER S 54 -16.634 2.891 -5.129 1.00 0.27 C ATOM 777 C SER S 54 -18.138 3.152 -5.085 1.00 0.32 C ATOM 778 O SER S 54 -18.840 2.953 -6.076 1.00 0.41 O ATOM 779 CB SER S 54 -16.347 1.487 -4.594 1.00 0.28 C ATOM 780 OG SER S 54 -17.137 1.207 -3.451 1.00 0.86 O ATOM 781 H SER S 54 -15.131 3.604 -3.837 1.00 0.22 H ATOM 782 HA SER S 54 -16.283 2.958 -6.144 1.00 0.29 H ATOM 783 HB2 SER S 54 -16.572 0.758 -5.358 1.00 0.69 H ATOM 784 HB3 SER S 54 -15.304 1.413 -4.321 1.00 0.69 H ATOM 785 HG SER S 54 -17.806 0.556 -3.675 1.00 1.22 H ATOM 786 N GLY S 55 -18.625 3.596 -3.930 1.00 0.30 N ATOM 787 CA GLY S 55 -20.041 3.877 -3.778 1.00 0.35 C ATOM 788 C GLY S 55 -20.593 3.380 -2.456 1.00 0.43 C ATOM 789 O GLY S 55 -21.542 3.948 -1.918 1.00 0.52 O ATOM 790 H GLY S 55 -18.016 3.732 -3.173 1.00 0.28 H ATOM 791 HA2 GLY S 55 -20.581 3.400 -4.583 1.00 0.46 H ATOM 792 HA3 GLY S 55 -20.194 4.944 -3.840 1.00 0.35 H