ATOM 32 N GLN S 3 -12.902 -3.052 0.562 1.00 0.47 N ATOM 33 CA GLN S 3 -12.226 -4.339 0.406 1.00 0.32 C ATOM 34 C GLN S 3 -10.846 -4.219 -0.208 1.00 0.20 C ATOM 35 O GLN S 3 -10.073 -5.188 -0.194 1.00 0.16 O ATOM 36 CB GLN S 3 -13.085 -5.297 -0.425 1.00 0.41 C ATOM 37 CG GLN S 3 -13.356 -4.811 -1.838 1.00 1.00 C ATOM 38 CD GLN S 3 -14.146 -5.813 -2.656 1.00 1.06 C ATOM 39 OE1 GLN S 3 -14.955 -6.570 -2.118 1.00 1.31 O ATOM 40 NE2 GLN S 3 -13.914 -5.827 -3.963 1.00 1.80 N ATOM 41 H GLN S 3 -13.475 -2.744 -0.167 1.00 0.79 H ATOM 42 HA GLN S 3 -12.103 -4.757 1.381 1.00 0.34 H ATOM 43 HB2 GLN S 3 -12.582 -6.250 -0.486 1.00 1.09 H ATOM 44 HB3 GLN S 3 -14.034 -5.432 0.074 1.00 1.01 H ATOM 45 HG2 GLN S 3 -13.917 -3.891 -1.787 1.00 1.66 H ATOM 46 HG3 GLN S 3 -12.412 -4.630 -2.331 1.00 1.68 H ATOM 47 HE21 GLN S 3 -13.254 -5.196 -4.322 1.00 2.41 H ATOM 48 HE22 GLN S 3 -14.410 -6.465 -4.516 1.00 1.95 H ATOM 49 N GLU S 4 -10.518 -3.058 -0.754 1.00 0.22 N ATOM 50 CA GLU S 4 -9.232 -2.931 -1.403 1.00 0.23 C ATOM 51 C GLU S 4 -8.098 -3.165 -0.424 1.00 0.21 C ATOM 52 O GLU S 4 -6.991 -3.494 -0.824 1.00 0.27 O ATOM 53 CB GLU S 4 -9.070 -1.585 -2.117 1.00 0.28 C ATOM 54 CG GLU S 4 -8.615 -0.456 -1.213 1.00 0.28 C ATOM 55 CD GLU S 4 -9.305 -0.476 0.131 1.00 0.92 C ATOM 56 OE1 GLU S 4 -10.550 -0.557 0.156 1.00 1.37 O ATOM 57 OE2 GLU S 4 -8.601 -0.409 1.159 1.00 1.34 O ATOM 58 H GLU S 4 -11.121 -2.278 -0.678 1.00 0.28 H ATOM 59 HA GLU S 4 -9.193 -3.719 -2.132 1.00 0.25 H ATOM 60 HB2 GLU S 4 -8.337 -1.698 -2.903 1.00 0.34 H ATOM 61 HB3 GLU S 4 -10.012 -1.305 -2.561 1.00 0.33 H ATOM 62 HG2 GLU S 4 -7.549 -0.542 -1.059 1.00 0.68 H ATOM 63 HG3 GLU S 4 -8.833 0.480 -1.695 1.00 0.62 H ATOM 64 N THR S 5 -8.361 -3.005 0.863 1.00 0.17 N ATOM 65 CA THR S 5 -7.318 -3.237 1.839 1.00 0.20 C ATOM 66 C THR S 5 -6.864 -4.683 1.742 1.00 0.20 C ATOM 67 O THR S 5 -5.717 -4.966 1.405 1.00 0.22 O ATOM 68 CB THR S 5 -7.794 -2.952 3.276 1.00 0.21 C ATOM 69 OG1 THR S 5 -8.261 -1.603 3.386 1.00 0.99 O ATOM 70 CG2 THR S 5 -6.669 -3.185 4.274 1.00 1.04 C ATOM 71 H THR S 5 -9.257 -2.735 1.158 1.00 0.18 H ATOM 72 HA THR S 5 -6.487 -2.584 1.610 1.00 0.23 H ATOM 73 HB THR S 5 -8.606 -3.626 3.508 1.00 0.71 H ATOM 74 HG1 THR S 5 -8.984 -1.564 4.015 1.00 1.46 H ATOM 75 HG21 THR S 5 -5.822 -2.570 4.011 1.00 1.63 H ATOM 76 HG22 THR S 5 -7.009 -2.925 5.266 1.00 1.61 H ATOM 77 HG23 THR S 5 -6.380 -4.225 4.254 1.00 1.62 H ATOM 78 N ARG S 6 -7.784 -5.595 2.026 1.00 0.19 N ATOM 79 CA ARG S 6 -7.488 -7.015 1.964 1.00 0.20 C ATOM 80 C ARG S 6 -6.649 -7.383 0.749 1.00 0.17 C ATOM 81 O ARG S 6 -5.486 -7.758 0.895 1.00 0.17 O ATOM 82 CB ARG S 6 -8.791 -7.818 1.958 1.00 0.27 C ATOM 83 CG ARG S 6 -9.760 -7.394 3.049 1.00 0.82 C ATOM 84 CD ARG S 6 -11.110 -8.084 2.919 1.00 0.61 C ATOM 85 NE ARG S 6 -11.605 -8.072 1.545 1.00 0.94 N ATOM 86 CZ ARG S 6 -12.806 -8.519 1.188 1.00 1.24 C ATOM 87 NH1 ARG S 6 -13.640 -8.994 2.105 1.00 1.00 N ATOM 88 NH2 ARG S 6 -13.175 -8.488 -0.085 1.00 1.95 N ATOM 89 H ARG S 6 -8.630 -5.314 2.420 1.00 0.19 H ATOM 90 HA ARG S 6 -6.933 -7.268 2.851 1.00 0.23 H ATOM 91 HB2 ARG S 6 -9.276 -7.690 1.002 1.00 0.95 H ATOM 92 HB3 ARG S 6 -8.559 -8.863 2.098 1.00 0.83 H ATOM 93 HG2 ARG S 6 -9.335 -7.641 4.009 1.00 1.40 H ATOM 94 HG3 ARG S 6 -9.906 -6.326 2.984 1.00 1.47 H ATOM 95 HD2 ARG S 6 -11.010 -9.107 3.248 1.00 0.70 H ATOM 96 HD3 ARG S 6 -11.824 -7.568 3.553 1.00 1.03 H ATOM 97 HE ARG S 6 -11.010 -7.719 0.851 1.00 1.26 H ATOM 98 HH11 ARG S 6 -13.367 -9.015 3.066 1.00 0.81 H ATOM 99 HH12 ARG S 6 -14.543 -9.328 1.833 1.00 1.29 H ATOM 100 HH21 ARG S 6 -12.551 -8.129 -0.779 1.00 2.27 H ATOM 101 HH22 ARG S 6 -14.079 -8.826 -0.352 1.00 2.22 H ATOM 102 N ASP S 7 -7.202 -7.232 -0.449 1.00 0.17 N ATOM 103 CA ASP S 7 -6.476 -7.617 -1.668 1.00 0.18 C ATOM 104 C ASP S 7 -5.377 -6.647 -2.094 1.00 0.16 C ATOM 105 O ASP S 7 -4.267 -7.076 -2.403 1.00 0.16 O ATOM 106 CB ASP S 7 -7.458 -7.797 -2.811 1.00 0.24 C ATOM 107 CG ASP S 7 -6.792 -8.295 -4.078 1.00 0.73 C ATOM 108 OD1 ASP S 7 -6.453 -7.458 -4.939 1.00 1.06 O ATOM 109 OD2 ASP S 7 -6.610 -9.523 -4.209 1.00 1.30 O ATOM 110 H ASP S 7 -8.136 -6.930 -0.551 1.00 0.18 H ATOM 111 HA ASP S 7 -6.022 -8.566 -1.484 1.00 0.18 H ATOM 112 HB2 ASP S 7 -8.218 -8.507 -2.520 1.00 0.74 H ATOM 113 HB3 ASP S 7 -7.915 -6.853 -3.013 1.00 0.50 H ATOM 114 N GLN S 8 -5.666 -5.356 -2.116 1.00 0.17 N ATOM 115 CA GLN S 8 -4.668 -4.386 -2.559 1.00 0.18 C ATOM 116 C GLN S 8 -3.641 -4.103 -1.471 1.00 0.17 C ATOM 117 O GLN S 8 -2.456 -4.348 -1.662 1.00 0.17 O ATOM 118 CB GLN S 8 -5.325 -3.085 -3.022 1.00 0.19 C ATOM 119 CG GLN S 8 -6.413 -3.289 -4.063 1.00 0.31 C ATOM 120 CD GLN S 8 -5.866 -3.790 -5.386 1.00 0.49 C ATOM 121 OE1 GLN S 8 -5.768 -4.996 -5.614 1.00 1.34 O ATOM 122 NE2 GLN S 8 -5.507 -2.863 -6.266 1.00 1.25 N ATOM 123 H GLN S 8 -6.533 -5.048 -1.783 1.00 0.19 H ATOM 124 HA GLN S 8 -4.152 -4.825 -3.401 1.00 0.18 H ATOM 125 HB2 GLN S 8 -5.757 -2.586 -2.170 1.00 0.21 H ATOM 126 HB3 GLN S 8 -4.564 -2.448 -3.452 1.00 0.25 H ATOM 127 HG2 GLN S 8 -7.121 -4.013 -3.686 1.00 0.73 H ATOM 128 HG3 GLN S 8 -6.915 -2.348 -4.230 1.00 0.72 H ATOM 129 HE21 GLN S 8 -5.611 -1.921 -6.016 1.00 1.92 H ATOM 130 HE22 GLN S 8 -5.150 -3.159 -7.130 1.00 1.47 H ATOM 131 N MET S 9 -4.086 -3.582 -0.335 1.00 0.18 N ATOM 132 CA MET S 9 -3.160 -3.278 0.755 1.00 0.20 C ATOM 133 C MET S 9 -2.207 -4.446 1.009 1.00 0.19 C ATOM 134 O MET S 9 -0.997 -4.254 1.070 1.00 0.20 O ATOM 135 CB MET S 9 -3.901 -2.917 2.043 1.00 0.24 C ATOM 136 CG MET S 9 -3.005 -2.291 3.102 1.00 0.27 C ATOM 137 SD MET S 9 -1.935 -3.494 3.918 1.00 1.34 S ATOM 138 CE MET S 9 -0.601 -2.437 4.478 1.00 0.80 C ATOM 139 H MET S 9 -5.044 -3.381 -0.244 1.00 0.19 H ATOM 140 HA MET S 9 -2.572 -2.426 0.445 1.00 0.22 H ATOM 141 HB2 MET S 9 -4.689 -2.216 1.809 1.00 0.27 H ATOM 142 HB3 MET S 9 -4.337 -3.812 2.459 1.00 0.27 H ATOM 143 HG2 MET S 9 -2.385 -1.543 2.633 1.00 0.86 H ATOM 144 HG3 MET S 9 -3.628 -1.822 3.848 1.00 0.91 H ATOM 145 HE1 MET S 9 -1.000 -1.657 5.110 1.00 1.02 H ATOM 146 HE2 MET S 9 0.113 -3.023 5.036 1.00 1.39 H ATOM 147 HE3 MET S 9 -0.112 -1.994 3.623 1.00 1.27 H ATOM 148 N LYS S 10 -2.744 -5.657 1.155 1.00 0.19 N ATOM 149 CA LYS S 10 -1.906 -6.825 1.411 1.00 0.21 C ATOM 150 C LYS S 10 -0.943 -7.112 0.257 1.00 0.19 C ATOM 151 O LYS S 10 0.233 -7.394 0.483 1.00 0.21 O ATOM 152 CB LYS S 10 -2.777 -8.052 1.662 1.00 0.25 C ATOM 153 CG LYS S 10 -1.987 -9.303 2.013 1.00 1.11 C ATOM 154 CD LYS S 10 -2.902 -10.496 2.242 1.00 1.64 C ATOM 155 CE LYS S 10 -3.605 -10.918 0.960 1.00 2.24 C ATOM 156 NZ LYS S 10 -2.637 -11.285 -0.110 1.00 3.19 N ATOM 157 H LYS S 10 -3.723 -5.769 1.117 1.00 0.20 H ATOM 158 HA LYS S 10 -1.327 -6.625 2.300 1.00 0.25 H ATOM 159 HB2 LYS S 10 -3.453 -7.839 2.476 1.00 0.75 H ATOM 160 HB3 LYS S 10 -3.352 -8.255 0.771 1.00 0.78 H ATOM 161 HG2 LYS S 10 -1.313 -9.531 1.202 1.00 1.84 H ATOM 162 HG3 LYS S 10 -1.419 -9.118 2.913 1.00 1.69 H ATOM 163 HD2 LYS S 10 -2.314 -11.325 2.606 1.00 2.34 H ATOM 164 HD3 LYS S 10 -3.646 -10.230 2.978 1.00 2.01 H ATOM 165 HE2 LYS S 10 -4.233 -11.770 1.172 1.00 2.66 H ATOM 166 HE3 LYS S 10 -4.217 -10.098 0.614 1.00 2.46 H ATOM 167 HZ1 LYS S 10 -2.006 -10.483 -0.312 1.00 3.36 H ATOM 168 HZ2 LYS S 10 -2.062 -12.098 0.191 1.00 3.52 H ATOM 169 HZ3 LYS S 10 -3.146 -11.539 -0.981 1.00 3.85 H ATOM 170 N ASN S 11 -1.442 -7.041 -0.974 1.00 0.16 N ATOM 171 CA ASN S 11 -0.621 -7.330 -2.152 1.00 0.17 C ATOM 172 C ASN S 11 0.207 -6.128 -2.597 1.00 0.15 C ATOM 173 O ASN S 11 1.433 -6.194 -2.605 1.00 0.15 O ATOM 174 CB ASN S 11 -1.510 -7.811 -3.301 1.00 0.20 C ATOM 175 CG ASN S 11 -0.712 -8.196 -4.531 1.00 0.31 C ATOM 176 OD1 ASN S 11 0.429 -8.650 -4.430 1.00 0.99 O ATOM 177 ND2 ASN S 11 -1.310 -8.016 -5.704 1.00 1.27 N ATOM 178 H ASN S 11 -2.381 -6.791 -1.097 1.00 0.15 H ATOM 179 HA ASN S 11 0.064 -8.121 -1.885 1.00 0.18 H ATOM 180 HB2 ASN S 11 -2.074 -8.673 -2.974 1.00 0.27 H ATOM 181 HB3 ASN S 11 -2.196 -7.021 -3.570 1.00 0.22 H ATOM 182 HD21 ASN S 11 -2.218 -7.649 -5.709 1.00 2.00 H ATOM 183 HD22 ASN S 11 -0.817 -8.255 -6.516 1.00 1.33 H ATOM 184 N ALA S 12 -0.458 -5.040 -2.977 1.00 0.16 N ATOM 185 CA ALA S 12 0.242 -3.837 -3.421 1.00 0.17 C ATOM 186 C ALA S 12 1.405 -3.520 -2.495 1.00 0.15 C ATOM 187 O ALA S 12 2.539 -3.349 -2.944 1.00 0.16 O ATOM 188 CB ALA S 12 -0.715 -2.657 -3.497 1.00 0.20 C ATOM 189 H ALA S 12 -1.435 -5.053 -2.992 1.00 0.16 H ATOM 190 HA ALA S 12 0.627 -4.026 -4.412 1.00 0.20 H ATOM 191 HB1 ALA S 12 -1.093 -2.437 -2.510 1.00 0.85 H ATOM 192 HB2 ALA S 12 -0.193 -1.795 -3.884 1.00 0.88 H ATOM 193 HB3 ALA S 12 -1.539 -2.903 -4.152 1.00 0.89 H ATOM 194 N ALA S 13 1.118 -3.440 -1.202 1.00 0.15 N ATOM 195 CA ALA S 13 2.162 -3.174 -0.222 1.00 0.15 C ATOM 196 C ALA S 13 3.242 -4.236 -0.346 1.00 0.13 C ATOM 197 O ALA S 13 4.419 -3.921 -0.508 1.00 0.12 O ATOM 198 CB ALA S 13 1.599 -3.147 1.190 1.00 0.18 C ATOM 199 H ALA S 13 0.189 -3.556 -0.912 1.00 0.15 H ATOM 200 HA ALA S 13 2.590 -2.207 -0.439 1.00 0.16 H ATOM 201 HB1 ALA S 13 2.378 -2.862 1.882 1.00 1.01 H ATOM 202 HB2 ALA S 13 1.229 -4.128 1.449 1.00 1.05 H ATOM 203 HB3 ALA S 13 0.793 -2.431 1.243 1.00 1.04 H ATOM 204 N ALA S 14 2.826 -5.497 -0.229 1.00 0.14 N ATOM 205 CA ALA S 14 3.736 -6.630 -0.366 1.00 0.15 C ATOM 206 C ALA S 14 4.737 -6.433 -1.499 1.00 0.13 C ATOM 207 O ALA S 14 5.945 -6.465 -1.272 1.00 0.14 O ATOM 208 CB ALA S 14 2.952 -7.916 -0.585 1.00 0.17 C ATOM 209 H ALA S 14 1.906 -5.669 0.055 1.00 0.16 H ATOM 210 HA ALA S 14 4.274 -6.731 0.561 1.00 0.17 H ATOM 211 HB1 ALA S 14 2.364 -7.831 -1.485 1.00 1.06 H ATOM 212 HB2 ALA S 14 3.639 -8.743 -0.680 1.00 0.97 H ATOM 213 HB3 ALA S 14 2.300 -8.087 0.257 1.00 0.96 H ATOM 214 N GLU S 15 4.242 -6.222 -2.717 1.00 0.14 N ATOM 215 CA GLU S 15 5.091 -6.041 -3.890 1.00 0.14 C ATOM 216 C GLU S 15 5.929 -4.766 -3.833 1.00 0.12 C ATOM 217 O GLU S 15 6.937 -4.655 -4.530 1.00 0.13 O ATOM 218 CB GLU S 15 4.219 -6.023 -5.143 1.00 0.18 C ATOM 219 CG GLU S 15 3.603 -7.370 -5.464 1.00 0.31 C ATOM 220 CD GLU S 15 4.611 -8.361 -6.011 1.00 0.87 C ATOM 221 OE1 GLU S 15 5.252 -9.064 -5.201 1.00 1.13 O ATOM 222 OE2 GLU S 15 4.762 -8.435 -7.249 1.00 1.28 O ATOM 223 H GLU S 15 3.279 -6.181 -2.881 1.00 0.15 H ATOM 224 HA GLU S 15 5.751 -6.890 -3.948 1.00 0.15 H ATOM 225 HB2 GLU S 15 3.419 -5.312 -4.998 1.00 0.29 H ATOM 226 HB3 GLU S 15 4.821 -5.714 -5.985 1.00 0.17 H ATOM 227 HG2 GLU S 15 3.182 -7.772 -4.561 1.00 0.27 H ATOM 228 HG3 GLU S 15 2.821 -7.232 -6.190 1.00 0.60 H ATOM 229 N ALA S 16 5.532 -3.812 -2.997 1.00 0.11 N ATOM 230 CA ALA S 16 6.251 -2.546 -2.923 1.00 0.12 C ATOM 231 C ALA S 16 7.404 -2.679 -1.952 1.00 0.10 C ATOM 232 O ALA S 16 8.472 -2.092 -2.132 1.00 0.11 O ATOM 233 CB ALA S 16 5.319 -1.426 -2.488 1.00 0.14 C ATOM 234 H ALA S 16 4.877 -4.018 -2.302 1.00 0.11 H ATOM 235 HA ALA S 16 6.638 -2.313 -3.903 1.00 0.14 H ATOM 236 HB1 ALA S 16 4.943 -1.637 -1.498 1.00 1.06 H ATOM 237 HB2 ALA S 16 4.494 -1.354 -3.181 1.00 1.02 H ATOM 238 HB3 ALA S 16 5.861 -0.492 -2.475 1.00 0.99 H ATOM 239 N LYS S 17 7.161 -3.463 -0.918 1.00 0.09 N ATOM 240 CA LYS S 17 8.159 -3.707 0.101 1.00 0.08 C ATOM 241 C LYS S 17 9.172 -4.736 -0.385 1.00 0.09 C ATOM 242 O LYS S 17 10.347 -4.687 -0.046 1.00 0.10 O ATOM 243 CB LYS S 17 7.505 -4.171 1.402 1.00 0.10 C ATOM 244 CG LYS S 17 6.777 -3.063 2.141 1.00 0.10 C ATOM 245 CD LYS S 17 7.751 -2.041 2.710 1.00 0.11 C ATOM 246 CE LYS S 17 7.026 -0.941 3.467 1.00 0.14 C ATOM 247 NZ LYS S 17 7.973 0.048 4.053 1.00 1.35 N ATOM 248 H LYS S 17 6.287 -3.900 -0.870 1.00 0.10 H ATOM 249 HA LYS S 17 8.669 -2.769 0.273 1.00 0.09 H ATOM 250 HB2 LYS S 17 6.794 -4.954 1.178 1.00 0.10 H ATOM 251 HB3 LYS S 17 8.269 -4.567 2.055 1.00 0.11 H ATOM 252 HG2 LYS S 17 6.109 -2.566 1.451 1.00 0.10 H ATOM 253 HG3 LYS S 17 6.207 -3.495 2.950 1.00 0.11 H ATOM 254 HD2 LYS S 17 8.433 -2.541 3.384 1.00 0.14 H ATOM 255 HD3 LYS S 17 8.310 -1.599 1.897 1.00 0.10 H ATOM 256 HE2 LYS S 17 6.363 -0.429 2.785 1.00 1.01 H ATOM 257 HE3 LYS S 17 6.448 -1.388 4.262 1.00 0.97 H ATOM 258 HZ1 LYS S 17 8.545 0.485 3.302 1.00 1.96 H ATOM 259 HZ2 LYS S 17 7.448 0.794 4.553 1.00 2.03 H ATOM 260 HZ3 LYS S 17 8.610 -0.423 4.727 1.00 1.77 H ATOM 261 N ASP S 18 8.714 -5.667 -1.197 1.00 0.09 N ATOM 262 CA ASP S 18 9.600 -6.692 -1.716 1.00 0.10 C ATOM 263 C ASP S 18 10.422 -6.144 -2.875 1.00 0.11 C ATOM 264 O ASP S 18 11.571 -6.508 -3.060 1.00 0.13 O ATOM 265 CB ASP S 18 8.803 -7.919 -2.163 1.00 0.11 C ATOM 266 CG ASP S 18 8.367 -8.782 -0.995 1.00 1.10 C ATOM 267 OD1 ASP S 18 7.333 -8.458 -0.372 1.00 2.14 O ATOM 268 OD2 ASP S 18 9.055 -9.782 -0.703 1.00 0.95 O ATOM 269 H ASP S 18 7.771 -5.652 -1.461 1.00 0.09 H ATOM 270 HA ASP S 18 10.269 -6.977 -0.920 1.00 0.11 H ATOM 271 HB2 ASP S 18 7.921 -7.594 -2.695 1.00 0.81 H ATOM 272 HB3 ASP S 18 9.415 -8.518 -2.822 1.00 0.79 H ATOM 273 N ASN S 19 9.863 -5.174 -3.572 1.00 0.11 N ATOM 274 CA ASN S 19 10.562 -4.636 -4.733 1.00 0.13 C ATOM 275 C ASN S 19 11.509 -3.512 -4.333 1.00 0.13 C ATOM 276 O ASN S 19 12.748 -3.672 -4.334 1.00 0.14 O ATOM 277 CB ASN S 19 9.565 -4.129 -5.776 1.00 0.14 C ATOM 278 CG ASN S 19 10.252 -3.559 -7.001 1.00 1.11 C ATOM 279 OD1 ASN S 19 10.543 -2.365 -7.064 1.00 2.00 O ATOM 280 ND2 ASN S 19 10.517 -4.414 -7.982 1.00 1.74 N ATOM 281 H ASN S 19 9.093 -4.729 -3.166 1.00 0.10 H ATOM 282 HA ASN S 19 11.142 -5.436 -5.167 1.00 0.14 H ATOM 283 HB2 ASN S 19 8.932 -4.947 -6.089 1.00 0.73 H ATOM 284 HB3 ASN S 19 8.954 -3.355 -5.335 1.00 0.83 H ATOM 285 HD21 ASN S 19 10.257 -5.351 -7.863 1.00 2.04 H ATOM 286 HD22 ASN S 19 10.962 -4.072 -8.786 1.00 2.33 H ATOM 287 N VAL S 20 10.917 -2.425 -3.862 1.00 0.12 N ATOM 288 CA VAL S 20 11.684 -1.259 -3.484 1.00 0.13 C ATOM 289 C VAL S 20 12.223 -1.373 -2.081 1.00 0.12 C ATOM 290 O VAL S 20 13.310 -0.888 -1.807 1.00 0.12 O ATOM 291 CB VAL S 20 10.864 0.036 -3.582 1.00 0.15 C ATOM 292 CG1 VAL S 20 11.787 1.231 -3.743 1.00 0.15 C ATOM 293 CG2 VAL S 20 9.872 -0.029 -4.726 1.00 0.19 C ATOM 294 H VAL S 20 9.942 -2.409 -3.768 1.00 0.12 H ATOM 295 HA VAL S 20 12.515 -1.179 -4.169 1.00 0.14 H ATOM 296 HB VAL S 20 10.313 0.160 -2.662 1.00 0.15 H ATOM 297 N HIS S 21 11.508 -2.043 -1.188 1.00 0.11 N ATOM 298 CA HIS S 21 11.997 -2.131 0.169 1.00 0.11 C ATOM 299 C HIS S 21 13.007 -3.249 0.282 1.00 0.11 C ATOM 300 O HIS S 21 13.933 -3.148 1.082 1.00 0.12 O ATOM 301 CB HIS S 21 10.873 -2.310 1.185 1.00 0.12 C ATOM 302 CG HIS S 21 11.193 -1.760 2.543 1.00 0.16 C ATOM 303 ND1 HIS S 21 10.771 -2.356 3.713 1.00 1.17 N ATOM 304 CD2 HIS S 21 11.889 -0.659 2.916 1.00 1.00 C ATOM 305 CE1 HIS S 21 11.190 -1.646 4.745 1.00 0.89 C ATOM 306 NE2 HIS S 21 11.871 -0.612 4.288 1.00 0.52 N ATOM 307 H HIS S 21 10.729 -2.575 -1.456 1.00 0.11 H ATOM 308 HA HIS S 21 12.505 -1.201 0.381 1.00 0.11 H ATOM 309 HB2 HIS S 21 9.987 -1.811 0.826 1.00 0.15 H ATOM 310 HB3 HIS S 21 10.669 -3.363 1.299 1.00 0.13 H ATOM 311 HD1 HIS S 21 10.241 -3.178 3.777 1.00 2.05 H ATOM 312 HD2 HIS S 21 12.368 0.050 2.255 1.00 2.02 H ATOM 313 HE1 HIS S 21 11.008 -1.872 5.784 1.00 1.57 H ATOM 314 HE2 HIS S 21 12.381 0.017 4.841 1.00 0.98 H ATOM 315 N ASP S 22 12.868 -4.325 -0.514 1.00 0.12 N ATOM 316 CA ASP S 22 13.849 -5.375 -0.414 1.00 0.14 C ATOM 317 C ASP S 22 15.208 -4.770 -0.667 1.00 0.14 C ATOM 318 O ASP S 22 16.073 -4.823 0.212 1.00 0.15 O ATOM 319 CB ASP S 22 13.572 -6.514 -1.379 1.00 0.16 C ATOM 320 CG ASP S 22 14.536 -7.671 -1.202 1.00 0.19 C ATOM 321 OD1 ASP S 22 14.360 -8.448 -0.240 1.00 0.26 O ATOM 322 OD2 ASP S 22 15.465 -7.801 -2.026 1.00 0.24 O ATOM 323 H ASP S 22 12.117 -4.405 -1.158 1.00 0.11 H ATOM 324 HA ASP S 22 13.823 -5.748 0.602 1.00 0.15 H ATOM 325 HB2 ASP S 22 12.568 -6.874 -1.208 1.00 0.16 H ATOM 326 HB3 ASP S 22 13.655 -6.150 -2.392 1.00 0.15 H ATOM 327 N LYS S 23 15.433 -4.177 -1.851 1.00 0.14 N ATOM 328 CA LYS S 23 16.714 -3.532 -2.098 1.00 0.16 C ATOM 329 C LYS S 23 17.028 -2.422 -1.099 1.00 0.12 C ATOM 330 O LYS S 23 18.182 -2.271 -0.702 1.00 0.14 O ATOM 331 CB LYS S 23 16.738 -2.971 -3.523 1.00 0.20 C ATOM 332 CG LYS S 23 15.469 -2.222 -3.904 1.00 0.28 C ATOM 333 CD LYS S 23 15.623 -0.721 -3.721 1.00 0.71 C ATOM 334 CE LYS S 23 15.981 -0.032 -5.027 1.00 0.31 C ATOM 335 NZ LYS S 23 15.068 -0.430 -6.133 1.00 0.74 N ATOM 336 H LYS S 23 14.869 -4.289 -2.656 1.00 0.14 H ATOM 337 HA LYS S 23 17.478 -4.289 -2.018 1.00 0.21 H ATOM 338 HB2 LYS S 23 17.573 -2.292 -3.615 1.00 0.18 H ATOM 339 HB3 LYS S 23 16.871 -3.788 -4.217 1.00 0.29 H ATOM 340 HG2 LYS S 23 15.241 -2.425 -4.939 1.00 0.78 H ATOM 341 HG3 LYS S 23 14.657 -2.569 -3.280 1.00 0.89 H ATOM 342 HD2 LYS S 23 14.692 -0.316 -3.357 1.00 1.40 H ATOM 343 HD3 LYS S 23 16.406 -0.536 -3.000 1.00 1.45 H ATOM 344 HE2 LYS S 23 15.910 1.036 -4.884 1.00 0.28 H ATOM 345 HE3 LYS S 23 16.995 -0.294 -5.293 1.00 0.31 H ATOM 346 HZ1 LYS S 23 14.084 -0.201 -5.886 1.00 1.19 H ATOM 347 HZ2 LYS S 23 15.320 0.077 -7.006 1.00 1.09 H ATOM 348 HZ3 LYS S 23 15.141 -1.453 -6.306 1.00 1.32 H ATOM 349 N ILE S 24 16.028 -1.638 -0.688 1.00 0.09 N ATOM 350 CA ILE S 24 16.281 -0.550 0.245 1.00 0.08 C ATOM 351 C ILE S 24 16.828 -1.045 1.581 1.00 0.09 C ATOM 352 O ILE S 24 17.973 -0.762 1.913 1.00 0.10 O ATOM 353 CB ILE S 24 15.009 0.287 0.511 1.00 0.09 C ATOM 354 CG1 ILE S 24 14.675 1.186 -0.680 1.00 0.09 C ATOM 355 CG2 ILE S 24 15.198 1.139 1.743 1.00 0.12 C ATOM 356 CD1 ILE S 24 13.324 1.877 -0.566 1.00 0.11 C ATOM 357 H ILE S 24 15.113 -1.767 -1.009 1.00 0.09 H ATOM 358 HA ILE S 24 17.019 0.095 -0.205 1.00 0.09 H ATOM 359 HB ILE S 24 14.187 -0.387 0.688 1.00 0.10 H ATOM 360 HD11 ILE S 24 12.606 1.193 -0.137 1.00 0.88 H ATOM 361 HD12 ILE S 24 13.411 2.752 0.067 1.00 0.84 H ATOM 362 HD13 ILE S 24 12.987 2.179 -1.546 1.00 0.88 H ATOM 363 N GLN S 25 16.017 -1.790 2.338 1.00 0.10 N ATOM 364 CA GLN S 25 16.455 -2.293 3.641 1.00 0.13 C ATOM 365 C GLN S 25 17.933 -2.649 3.577 1.00 0.14 C ATOM 366 O GLN S 25 18.750 -2.179 4.369 1.00 0.15 O ATOM 367 CB GLN S 25 15.645 -3.530 4.050 1.00 0.14 C ATOM 368 CG GLN S 25 14.136 -3.324 4.044 1.00 0.14 C ATOM 369 CD GLN S 25 13.422 -4.253 5.006 1.00 0.34 C ATOM 370 OE1 GLN S 25 13.022 -5.357 4.638 1.00 1.19 O ATOM 371 NE2 GLN S 25 13.261 -3.810 6.247 1.00 1.09 N ATOM 372 H GLN S 25 15.100 -1.957 2.039 1.00 0.10 H ATOM 373 HA GLN S 25 16.307 -1.511 4.371 1.00 0.14 H ATOM 374 HB2 GLN S 25 15.875 -4.334 3.368 1.00 0.14 H ATOM 375 HB3 GLN S 25 15.941 -3.824 5.046 1.00 0.16 H ATOM 376 HG2 GLN S 25 13.919 -2.304 4.322 1.00 0.20 H ATOM 377 HG3 GLN S 25 13.765 -3.514 3.047 1.00 0.18 H ATOM 378 HE21 GLN S 25 13.608 -2.921 6.470 1.00 1.83 H ATOM 379 HE22 GLN S 25 12.802 -4.390 6.890 1.00 1.13 H ATOM 380 N GLU S 26 18.241 -3.498 2.625 1.00 0.14 N ATOM 381 CA GLU S 26 19.615 -3.915 2.402 1.00 0.16 C ATOM 382 C GLU S 26 20.547 -2.698 2.227 1.00 0.15 C ATOM 383 O GLU S 26 21.437 -2.467 3.044 1.00 0.17 O ATOM 384 CB GLU S 26 19.697 -4.821 1.172 1.00 0.17 C ATOM 385 CG GLU S 26 21.104 -5.300 0.858 1.00 0.71 C ATOM 386 CD GLU S 26 21.151 -6.212 -0.351 1.00 1.33 C ATOM 387 OE1 GLU S 26 20.972 -7.435 -0.181 1.00 1.09 O ATOM 388 OE2 GLU S 26 21.369 -5.701 -1.471 1.00 2.39 O ATOM 389 H GLU S 26 17.481 -3.897 2.147 1.00 0.14 H ATOM 390 HA GLU S 26 19.935 -4.473 3.270 1.00 0.18 H ATOM 391 HB2 GLU S 26 19.074 -5.688 1.337 1.00 0.59 H ATOM 392 HB3 GLU S 26 19.325 -4.279 0.316 1.00 0.55 H ATOM 393 HG2 GLU S 26 21.730 -4.441 0.667 1.00 1.38 H ATOM 394 HG3 GLU S 26 21.488 -5.839 1.713 1.00 1.31 H ATOM 395 N LEU S 27 20.330 -1.932 1.156 1.00 0.14 N ATOM 396 CA LEU S 27 21.163 -0.758 0.833 1.00 0.14 C ATOM 397 C LEU S 27 20.665 0.599 1.365 1.00 0.12 C ATOM 398 O LEU S 27 21.343 1.280 2.133 1.00 0.13 O ATOM 399 CB LEU S 27 21.266 -0.632 -0.682 1.00 0.15 C ATOM 400 CG LEU S 27 21.614 -1.918 -1.426 1.00 0.20 C ATOM 401 CD1 LEU S 27 21.358 -1.739 -2.911 1.00 0.47 C ATOM 402 CD2 LEU S 27 23.064 -2.307 -1.171 1.00 0.61 C ATOM 403 H LEU S 27 19.591 -2.161 0.556 1.00 0.13 H ATOM 404 HA LEU S 27 22.150 -0.939 1.222 1.00 0.16 H ATOM 405 HB2 LEU S 27 20.314 -0.270 -1.052 1.00 0.13 H ATOM 406 HB3 LEU S 27 22.019 0.106 -0.907 1.00 0.18 H ATOM 407 HG LEU S 27 20.982 -2.717 -1.069 1.00 0.55 H ATOM 408 HD11 LEU S 27 20.446 -1.175 -3.046 1.00 1.08 H ATOM 409 HD12 LEU S 27 22.182 -1.204 -3.357 1.00 1.28 H ATOM 410 HD13 LEU S 27 21.258 -2.707 -3.378 1.00 1.07 H ATOM 411 HD21 LEU S 27 23.219 -2.441 -0.111 1.00 1.20 H ATOM 412 HD22 LEU S 27 23.284 -3.229 -1.688 1.00 1.18 H ATOM 413 HD23 LEU S 27 23.714 -1.527 -1.535 1.00 1.32 H ATOM 414 N LYS S 28 19.463 0.954 0.924 1.00 0.11 N ATOM 415 CA LYS S 28 18.826 2.260 1.158 1.00 0.11 C ATOM 416 C LYS S 28 18.133 2.461 2.510 1.00 0.12 C ATOM 417 O LYS S 28 17.689 3.573 2.791 1.00 0.14 O ATOM 418 CB LYS S 28 17.800 2.516 0.065 1.00 0.12 C ATOM 419 CG LYS S 28 18.376 2.562 -1.333 1.00 0.14 C ATOM 420 CD LYS S 28 18.243 1.218 -2.022 1.00 0.13 C ATOM 421 CE LYS S 28 18.749 1.273 -3.454 1.00 0.21 C ATOM 422 NZ LYS S 28 20.165 1.726 -3.525 1.00 1.31 N ATOM 423 H LYS S 28 18.917 0.278 0.472 1.00 0.10 H ATOM 424 HA LYS S 28 19.596 3.009 1.062 1.00 0.13 H ATOM 425 HB2 LYS S 28 17.064 1.733 0.093 1.00 0.10 H ATOM 426 HB3 LYS S 28 17.315 3.449 0.263 1.00 0.14 H ATOM 427 HG2 LYS S 28 17.842 3.305 -1.903 1.00 0.17 H ATOM 428 HG3 LYS S 28 19.420 2.827 -1.273 1.00 0.16 H ATOM 429 HD2 LYS S 28 18.817 0.485 -1.476 1.00 0.14 H ATOM 430 HD3 LYS S 28 17.200 0.931 -2.024 1.00 0.12 H ATOM 431 HE2 LYS S 28 18.674 0.287 -3.888 1.00 1.09 H ATOM 432 HE3 LYS S 28 18.131 1.959 -4.016 1.00 0.98 H ATOM 433 HZ1 LYS S 28 20.257 2.675 -3.110 1.00 1.89 H ATOM 434 HZ2 LYS S 28 20.777 1.069 -3.000 1.00 1.54 H ATOM 435 HZ3 LYS S 28 20.480 1.761 -4.515 1.00 1.96 H ATOM 436 N ASP S 29 17.998 1.417 3.313 1.00 0.12 N ATOM 437 CA ASP S 29 17.231 1.483 4.569 1.00 0.14 C ATOM 438 C ASP S 29 17.296 2.827 5.313 1.00 0.17 C ATOM 439 O ASP S 29 16.396 3.117 6.103 1.00 0.19 O ATOM 440 CB ASP S 29 17.704 0.385 5.518 1.00 0.16 C ATOM 441 CG ASP S 29 19.173 0.520 5.870 1.00 1.17 C ATOM 442 OD1 ASP S 29 20.020 0.087 5.060 1.00 2.17 O ATOM 443 OD2 ASP S 29 19.477 1.056 6.956 1.00 1.10 O ATOM 444 H ASP S 29 18.466 0.586 3.097 1.00 0.12 H ATOM 445 HA ASP S 29 16.201 1.288 4.321 1.00 0.14 H ATOM 446 HB2 ASP S 29 17.130 0.434 6.431 1.00 0.90 H ATOM 447 HB3 ASP S 29 17.552 -0.574 5.053 1.00 0.91 H ATOM 448 N ASP S 30 18.318 3.650 5.095 1.00 0.18 N ATOM 449 CA ASP S 30 18.371 4.931 5.805 1.00 0.21 C ATOM 450 C ASP S 30 17.633 6.044 5.037 1.00 0.22 C ATOM 451 O ASP S 30 16.537 6.458 5.412 1.00 0.23 O ATOM 452 CB ASP S 30 19.826 5.341 6.041 1.00 0.23 C ATOM 453 CG ASP S 30 19.941 6.650 6.795 1.00 1.12 C ATOM 454 OD1 ASP S 30 20.043 6.613 8.038 1.00 1.04 O ATOM 455 OD2 ASP S 30 19.928 7.715 6.141 1.00 2.14 O ATOM 456 H ASP S 30 18.976 3.446 4.400 1.00 0.16 H ATOM 457 HA ASP S 30 17.890 4.794 6.761 1.00 0.23 H ATOM 458 HB2 ASP S 30 20.321 4.572 6.616 1.00 1.01 H ATOM 459 HB3 ASP S 30 20.322 5.449 5.088 1.00 0.89 H ATOM 460 N VAL S 31 18.265 6.507 3.960 1.00 0.21 N ATOM 461 CA VAL S 31 17.698 7.571 3.115 1.00 0.23 C ATOM 462 C VAL S 31 16.813 7.044 1.986 1.00 0.21 C ATOM 463 O VAL S 31 15.636 7.393 1.881 1.00 0.23 O ATOM 464 CB VAL S 31 18.829 8.424 2.504 1.00 0.24 C ATOM 465 CG1 VAL S 31 19.820 7.557 1.733 1.00 1.32 C ATOM 466 CG2 VAL S 31 18.260 9.520 1.614 1.00 1.26 C ATOM 467 H VAL S 31 19.192 6.218 3.839 1.00 0.20 H ATOM 468 HA VAL S 31 17.105 8.213 3.748 1.00 0.25 H ATOM 469 HB VAL S 31 19.363 8.889 3.309 1.00 1.09 H ATOM 470 N GLY S 32 17.407 6.216 1.152 1.00 0.19 N ATOM 471 CA GLY S 32 16.700 5.640 0.016 1.00 0.18 C ATOM 472 C GLY S 32 15.381 4.995 0.418 1.00 0.17 C ATOM 473 O GLY S 32 14.534 4.712 -0.427 1.00 0.18 O ATOM 474 H GLY S 32 18.349 6.018 1.336 1.00 0.18 H ATOM 475 HA2 GLY S 32 17.327 4.896 -0.446 1.00 0.17 H ATOM 476 HA3 GLY S 32 16.499 6.422 -0.701 1.00 0.21 H ATOM 477 N ASN S 33 15.228 4.751 1.717 1.00 0.18 N ATOM 478 CA ASN S 33 14.018 4.137 2.273 1.00 0.19 C ATOM 479 C ASN S 33 12.743 4.881 1.889 1.00 0.23 C ATOM 480 O ASN S 33 11.644 4.429 2.211 1.00 0.26 O ATOM 481 CB ASN S 33 14.127 4.060 3.796 1.00 0.23 C ATOM 482 CG ASN S 33 13.018 3.233 4.419 1.00 1.14 C ATOM 483 OD1 ASN S 33 11.964 3.758 4.777 1.00 2.05 O ATOM 484 ND2 ASN S 33 13.253 1.934 4.551 1.00 1.79 N ATOM 485 H ASN S 33 15.974 4.969 2.313 1.00 0.18 H ATOM 486 HA ASN S 33 13.947 3.138 1.880 1.00 0.17 H ATOM 487 HB2 ASN S 33 15.074 3.616 4.061 1.00 0.87 H ATOM 488 HB3 ASN S 33 14.075 5.060 4.201 1.00 0.97 H ATOM 489 HD21 ASN S 33 14.115 1.585 4.244 1.00 2.06 H ATOM 490 HD22 ASN S 33 12.553 1.377 4.952 1.00 2.43 H ATOM 491 N LYS S 34 12.872 6.007 1.205 1.00 0.25 N ATOM 492 CA LYS S 34 11.702 6.768 0.807 1.00 0.30 C ATOM 493 C LYS S 34 11.144 6.262 -0.516 1.00 0.28 C ATOM 494 O LYS S 34 9.973 6.466 -0.825 1.00 0.43 O ATOM 495 CB LYS S 34 12.029 8.255 0.712 1.00 0.35 C ATOM 496 CG LYS S 34 10.849 9.097 0.264 1.00 0.71 C ATOM 497 CD LYS S 34 9.671 8.979 1.218 1.00 0.43 C ATOM 498 CE LYS S 34 8.613 10.034 0.934 1.00 0.74 C ATOM 499 NZ LYS S 34 9.154 11.415 1.062 1.00 1.04 N ATOM 500 H LYS S 34 13.756 6.312 0.919 1.00 0.24 H ATOM 501 HA LYS S 34 10.954 6.626 1.561 1.00 0.33 H ATOM 502 HB2 LYS S 34 12.351 8.607 1.681 1.00 0.54 H ATOM 503 HB3 LYS S 34 12.832 8.392 0.002 1.00 0.45 H ATOM 504 HG2 LYS S 34 11.154 10.130 0.206 1.00 1.35 H ATOM 505 HG3 LYS S 34 10.541 8.754 -0.709 1.00 1.36 H ATOM 506 HD2 LYS S 34 9.226 8.002 1.102 1.00 1.09 H ATOM 507 HD3 LYS S 34 10.025 9.100 2.231 1.00 1.10 H ATOM 508 HE2 LYS S 34 8.244 9.893 -0.072 1.00 0.96 H ATOM 509 HE3 LYS S 34 7.800 9.907 1.634 1.00 0.96 H ATOM 510 HZ1 LYS S 34 9.955 11.547 0.413 1.00 1.60 H ATOM 511 HZ2 LYS S 34 8.417 12.111 0.832 1.00 1.17 H ATOM 512 HZ3 LYS S 34 9.480 11.582 2.036 1.00 1.30 H ATOM 513 N ALA S 35 11.983 5.582 -1.282 1.00 0.19 N ATOM 514 CA ALA S 35 11.579 5.060 -2.579 1.00 0.19 C ATOM 515 C ALA S 35 10.455 4.034 -2.447 1.00 0.16 C ATOM 516 O ALA S 35 9.576 3.956 -3.306 1.00 0.18 O ATOM 517 CB ALA S 35 12.778 4.463 -3.298 1.00 0.24 C ATOM 518 H ALA S 35 12.891 5.414 -0.959 1.00 0.24 H ATOM 519 HA ALA S 35 11.217 5.892 -3.167 1.00 0.21 H ATOM 520 HB1 ALA S 35 13.478 5.249 -3.542 1.00 0.96 H ATOM 521 HB2 ALA S 35 13.259 3.740 -2.657 1.00 0.96 H ATOM 522 HB3 ALA S 35 12.450 3.980 -4.206 1.00 1.04 H ATOM 523 N ALA S 36 10.482 3.245 -1.374 1.00 0.12 N ATOM 524 CA ALA S 36 9.454 2.234 -1.140 1.00 0.13 C ATOM 525 C ALA S 36 8.216 2.879 -0.531 1.00 0.21 C ATOM 526 O ALA S 36 7.105 2.352 -0.626 1.00 0.59 O ATOM 527 CB ALA S 36 9.986 1.118 -0.242 1.00 0.20 C ATOM 528 H ALA S 36 11.162 3.385 -0.682 1.00 0.13 H ATOM 529 HA ALA S 36 9.187 1.806 -2.096 1.00 0.16 H ATOM 530 HB1 ALA S 36 10.882 0.703 -0.680 1.00 0.98 H ATOM 531 HB2 ALA S 36 9.239 0.337 -0.144 1.00 0.96 H ATOM 532 HB3 ALA S 36 10.218 1.521 0.734 1.00 1.13 H ATOM 533 N GLU S 37 8.424 4.049 0.066 1.00 0.32 N ATOM 534 CA GLU S 37 7.346 4.777 0.720 1.00 0.32 C ATOM 535 C GLU S 37 6.592 5.603 -0.310 1.00 0.23 C ATOM 536 O GLU S 37 5.391 5.845 -0.179 1.00 0.21 O ATOM 537 CB GLU S 37 7.901 5.679 1.823 1.00 0.42 C ATOM 538 CG GLU S 37 8.459 4.913 3.013 1.00 0.46 C ATOM 539 CD GLU S 37 7.403 4.088 3.722 1.00 1.23 C ATOM 540 OE1 GLU S 37 7.215 2.912 3.344 1.00 2.24 O ATOM 541 OE2 GLU S 37 6.763 4.617 4.656 1.00 1.13 O ATOM 542 H GLU S 37 9.293 4.484 -0.044 1.00 0.74 H ATOM 543 HA GLU S 37 6.670 4.056 1.153 1.00 0.36 H ATOM 544 HB2 GLU S 37 8.694 6.284 1.409 1.00 0.45 H ATOM 545 HB3 GLU S 37 7.112 6.325 2.176 1.00 0.51 H ATOM 546 HG2 GLU S 37 9.237 4.250 2.665 1.00 0.93 H ATOM 547 HG3 GLU S 37 8.875 5.619 3.715 1.00 0.95 H ATOM 548 N VAL S 38 7.313 6.023 -1.343 1.00 0.25 N ATOM 549 CA VAL S 38 6.725 6.808 -2.412 1.00 0.25 C ATOM 550 C VAL S 38 5.917 5.905 -3.331 1.00 0.21 C ATOM 551 O VAL S 38 4.793 6.232 -3.709 1.00 0.18 O ATOM 552 CB VAL S 38 7.804 7.542 -3.234 1.00 0.36 C ATOM 553 CG1 VAL S 38 7.182 8.250 -4.429 1.00 0.39 C ATOM 554 CG2 VAL S 38 8.557 8.530 -2.358 1.00 0.45 C ATOM 555 H VAL S 38 8.262 5.790 -1.391 1.00 0.31 H ATOM 556 HA VAL S 38 6.071 7.544 -1.967 1.00 0.24 H ATOM 557 HB VAL S 38 8.508 6.810 -3.603 1.00 0.38 H ATOM 558 N ARG S 39 6.505 4.768 -3.698 1.00 0.25 N ATOM 559 CA ARG S 39 5.828 3.814 -4.560 1.00 0.30 C ATOM 560 C ARG S 39 4.492 3.401 -3.954 1.00 0.31 C ATOM 561 O ARG S 39 3.508 3.206 -4.672 1.00 0.37 O ATOM 562 CB ARG S 39 6.706 2.586 -4.805 1.00 0.41 C ATOM 563 CG ARG S 39 6.182 1.682 -5.909 1.00 0.53 C ATOM 564 CD ARG S 39 5.219 0.631 -5.378 1.00 0.36 C ATOM 565 NE ARG S 39 4.782 -0.285 -6.428 1.00 0.63 N ATOM 566 CZ ARG S 39 3.799 -1.168 -6.279 1.00 0.88 C ATOM 567 NH1 ARG S 39 3.149 -1.255 -5.126 1.00 1.02 N ATOM 568 NH2 ARG S 39 3.464 -1.964 -7.285 1.00 1.24 N ATOM 569 H ARG S 39 7.426 4.586 -3.407 1.00 0.28 H ATOM 570 HA ARG S 39 5.640 4.303 -5.505 1.00 0.33 H ATOM 571 HB2 ARG S 39 7.695 2.917 -5.080 1.00 0.68 H ATOM 572 HB3 ARG S 39 6.771 2.010 -3.893 1.00 0.58 H ATOM 573 HG2 ARG S 39 5.663 2.289 -6.636 1.00 0.91 H ATOM 574 HG3 ARG S 39 7.018 1.186 -6.382 1.00 1.03 H ATOM 575 HD2 ARG S 39 5.715 0.065 -4.603 1.00 0.67 H ATOM 576 HD3 ARG S 39 4.354 1.128 -4.963 1.00 0.36 H ATOM 577 HE ARG S 39 5.245 -0.239 -7.291 1.00 0.86 H ATOM 578 HH11 ARG S 39 3.397 -0.656 -4.365 1.00 0.99 H ATOM 579 HH12 ARG S 39 2.411 -1.921 -5.018 1.00 1.33 H ATOM 580 HH21 ARG S 39 3.950 -1.900 -8.157 1.00 1.39 H ATOM 581 HH22 ARG S 39 2.724 -2.626 -7.174 1.00 1.46 H ATOM 582 N ASP S 40 4.450 3.272 -2.631 1.00 0.31 N ATOM 583 CA ASP S 40 3.219 2.894 -1.956 1.00 0.37 C ATOM 584 C ASP S 40 2.259 4.078 -1.915 1.00 0.32 C ATOM 585 O ASP S 40 1.045 3.906 -1.806 1.00 0.39 O ATOM 586 CB ASP S 40 3.514 2.408 -0.537 1.00 0.46 C ATOM 587 CG ASP S 40 2.260 1.978 0.202 1.00 0.57 C ATOM 588 OD1 ASP S 40 1.640 2.835 0.866 1.00 0.54 O ATOM 589 OD2 ASP S 40 1.900 0.785 0.117 1.00 0.71 O ATOM 590 H ASP S 40 5.253 3.441 -2.088 1.00 0.33 H ATOM 591 HA ASP S 40 2.765 2.093 -2.520 1.00 0.45 H ATOM 592 HB2 ASP S 40 4.187 1.565 -0.584 1.00 0.52 H ATOM 593 HB3 ASP S 40 3.982 3.207 0.020 1.00 0.42 H ATOM 594 N ALA S 41 2.818 5.283 -2.003 1.00 0.24 N ATOM 595 CA ALA S 41 2.024 6.506 -1.979 1.00 0.24 C ATOM 596 C ALA S 41 1.078 6.581 -3.174 1.00 0.25 C ATOM 597 O ALA S 41 -0.119 6.819 -3.011 1.00 0.28 O ATOM 598 CB ALA S 41 2.934 7.725 -1.949 1.00 0.26 C ATOM 599 H ALA S 41 3.794 5.351 -2.080 1.00 0.22 H ATOM 600 HA ALA S 41 1.440 6.504 -1.072 1.00 0.24 H ATOM 601 HB1 ALA S 41 3.424 7.832 -2.906 1.00 0.90 H ATOM 602 HB2 ALA S 41 3.677 7.601 -1.175 1.00 0.97 H ATOM 603 HB3 ALA S 41 2.347 8.608 -1.746 1.00 0.99 H ATOM 604 N VAL S 42 1.617 6.375 -4.375 1.00 0.25 N ATOM 605 CA VAL S 42 0.810 6.424 -5.591 1.00 0.29 C ATOM 606 C VAL S 42 -0.254 5.336 -5.585 1.00 0.29 C ATOM 607 O VAL S 42 -1.421 5.584 -5.894 1.00 0.29 O ATOM 608 CB VAL S 42 1.675 6.266 -6.852 1.00 0.34 C ATOM 609 CG1 VAL S 42 2.362 7.576 -7.196 1.00 0.36 C ATOM 610 CG2 VAL S 42 2.696 5.155 -6.671 1.00 0.35 C ATOM 611 H VAL S 42 2.576 6.178 -4.443 1.00 0.25 H ATOM 612 HA VAL S 42 0.326 7.389 -5.630 1.00 0.30 H ATOM 613 HB VAL S 42 1.026 5.995 -7.668 1.00 0.39 H ATOM 614 N SER S 43 0.160 4.130 -5.232 1.00 0.30 N ATOM 615 CA SER S 43 -0.762 3.004 -5.170 1.00 0.32 C ATOM 616 C SER S 43 -1.964 3.372 -4.303 1.00 0.28 C ATOM 617 O SER S 43 -3.115 3.225 -4.712 1.00 0.27 O ATOM 618 CB SER S 43 -0.058 1.766 -4.609 1.00 0.34 C ATOM 619 OG SER S 43 1.006 1.359 -5.452 1.00 1.24 O ATOM 620 H SER S 43 1.104 4.011 -4.992 1.00 0.31 H ATOM 621 HA SER S 43 -1.104 2.795 -6.174 1.00 0.35 H ATOM 622 HB2 SER S 43 0.343 1.993 -3.632 1.00 1.03 H ATOM 623 HB3 SER S 43 -0.768 0.956 -4.528 1.00 1.02 H ATOM 624 HG SER S 43 0.858 1.695 -6.339 1.00 1.72 H ATOM 625 N SER S 44 -1.668 3.849 -3.097 1.00 0.27 N ATOM 626 CA SER S 44 -2.694 4.269 -2.143 1.00 0.25 C ATOM 627 C SER S 44 -3.734 5.197 -2.779 1.00 0.22 C ATOM 628 O SER S 44 -4.932 5.044 -2.534 1.00 0.21 O ATOM 629 CB SER S 44 -2.043 4.967 -0.949 1.00 0.26 C ATOM 630 OG SER S 44 -1.167 4.091 -0.260 1.00 1.31 O ATOM 631 H SER S 44 -0.728 3.866 -2.826 1.00 0.29 H ATOM 632 HA SER S 44 -3.196 3.380 -1.792 1.00 0.27 H ATOM 633 HB2 SER S 44 -1.479 5.820 -1.296 1.00 0.92 H ATOM 634 HB3 SER S 44 -2.812 5.298 -0.266 1.00 1.02 H ATOM 635 HG SER S 44 -0.292 4.482 -0.218 1.00 1.65 H ATOM 636 N THR S 45 -3.284 6.159 -3.588 1.00 0.22 N ATOM 637 CA THR S 45 -4.204 7.099 -4.230 1.00 0.22 C ATOM 638 C THR S 45 -5.247 6.356 -5.054 1.00 0.21 C ATOM 639 O THR S 45 -6.404 6.771 -5.135 1.00 0.19 O ATOM 640 CB THR S 45 -3.469 8.107 -5.136 1.00 0.26 C ATOM 641 OG1 THR S 45 -2.993 7.457 -6.319 1.00 0.74 O ATOM 642 CG2 THR S 45 -2.304 8.748 -4.399 1.00 0.81 C ATOM 643 H THR S 45 -2.321 6.234 -3.758 1.00 0.24 H ATOM 644 HA THR S 45 -4.707 7.650 -3.450 1.00 0.21 H ATOM 645 HB THR S 45 -4.165 8.883 -5.419 1.00 0.63 H ATOM 646 HG1 THR S 45 -3.275 6.541 -6.319 1.00 1.32 H ATOM 647 HG21 THR S 45 -2.663 9.212 -3.492 1.00 1.30 H ATOM 648 HG22 THR S 45 -1.574 7.991 -4.153 1.00 1.54 H ATOM 649 HG23 THR S 45 -1.848 9.496 -5.030 1.00 1.36 H ATOM 650 N VAL S 46 -4.828 5.251 -5.657 1.00 0.24 N ATOM 651 CA VAL S 46 -5.732 4.437 -6.459 1.00 0.25 C ATOM 652 C VAL S 46 -6.655 3.648 -5.540 1.00 0.23 C ATOM 653 O VAL S 46 -7.873 3.826 -5.561 1.00 0.21 O ATOM 654 CB VAL S 46 -4.961 3.462 -7.371 1.00 0.30 C ATOM 655 CG1 VAL S 46 -5.926 2.629 -8.200 1.00 0.34 C ATOM 656 CG2 VAL S 46 -3.995 4.222 -8.267 1.00 0.32 C ATOM 657 H VAL S 46 -3.894 4.973 -5.533 1.00 0.25 H ATOM 658 HA VAL S 46 -6.324 5.097 -7.078 1.00 0.25 H ATOM 659 HB VAL S 46 -4.387 2.795 -6.744 1.00 0.30 H ATOM 660 N GLU S 47 -6.048 2.768 -4.748 1.00 0.24 N ATOM 661 CA GLU S 47 -6.765 1.947 -3.771 1.00 0.25 C ATOM 662 C GLU S 47 -7.864 2.732 -3.046 1.00 0.19 C ATOM 663 O GLU S 47 -8.851 2.156 -2.586 1.00 0.18 O ATOM 664 CB GLU S 47 -5.778 1.385 -2.749 1.00 0.30 C ATOM 665 CG GLU S 47 -4.869 0.308 -3.308 1.00 0.41 C ATOM 666 CD GLU S 47 -3.708 -0.009 -2.386 1.00 1.37 C ATOM 667 OE1 GLU S 47 -3.879 -0.855 -1.484 1.00 2.44 O ATOM 668 OE2 GLU S 47 -2.625 0.587 -2.568 1.00 1.32 O ATOM 669 H GLU S 47 -5.090 2.622 -4.885 1.00 0.26 H ATOM 670 HA GLU S 47 -7.218 1.125 -4.294 1.00 0.29 H ATOM 671 HB2 GLU S 47 -5.161 2.190 -2.379 1.00 0.41 H ATOM 672 HB3 GLU S 47 -6.334 0.962 -1.927 1.00 0.28 H ATOM 673 HG2 GLU S 47 -5.450 -0.591 -3.449 1.00 0.58 H ATOM 674 HG3 GLU S 47 -4.478 0.639 -4.258 1.00 1.01 H ATOM 675 N SER S 48 -7.741 4.051 -3.018 1.00 0.17 N ATOM 676 CA SER S 48 -8.710 4.871 -2.302 1.00 0.16 C ATOM 677 C SER S 48 -9.920 5.201 -3.168 1.00 0.17 C ATOM 678 O SER S 48 -11.052 4.859 -2.822 1.00 0.19 O ATOM 679 CB SER S 48 -8.054 6.161 -1.807 1.00 0.20 C ATOM 680 OG SER S 48 -7.014 5.883 -0.885 1.00 1.00 O ATOM 681 H SER S 48 -7.046 4.480 -3.555 1.00 0.18 H ATOM 682 HA SER S 48 -9.044 4.300 -1.451 1.00 0.18 H ATOM 683 HB2 SER S 48 -7.639 6.697 -2.647 1.00 0.93 H ATOM 684 HB3 SER S 48 -8.797 6.775 -1.319 1.00 0.88 H ATOM 685 HG SER S 48 -6.355 6.579 -0.927 1.00 1.35 H ATOM 686 N ILE S 49 -9.679 5.863 -4.290 1.00 0.18 N ATOM 687 CA ILE S 49 -10.752 6.238 -5.201 1.00 0.23 C ATOM 688 C ILE S 49 -11.467 5.019 -5.757 1.00 0.21 C ATOM 689 O ILE S 49 -12.576 5.121 -6.280 1.00 0.25 O ATOM 690 CB ILE S 49 -10.249 7.089 -6.378 1.00 0.30 C ATOM 691 CG1 ILE S 49 -8.964 6.499 -6.972 1.00 0.29 C ATOM 692 CG2 ILE S 49 -10.034 8.525 -5.932 1.00 0.34 C ATOM 693 CD1 ILE S 49 -9.194 5.280 -7.846 1.00 0.32 C ATOM 694 H ILE S 49 -8.754 6.110 -4.507 1.00 0.18 H ATOM 695 HA ILE S 49 -11.464 6.828 -4.643 1.00 0.25 H ATOM 696 HB ILE S 49 -11.018 7.090 -7.136 1.00 0.34 H ATOM 697 HD11 ILE S 49 -10.023 5.465 -8.513 1.00 1.02 H ATOM 698 HD12 ILE S 49 -8.305 5.077 -8.422 1.00 1.01 H ATOM 699 HD13 ILE S 49 -9.420 4.425 -7.222 1.00 0.92 H ATOM 700 N LYS S 50 -10.823 3.869 -5.681 1.00 0.19 N ATOM 701 CA LYS S 50 -11.418 2.665 -6.217 1.00 0.22 C ATOM 702 C LYS S 50 -12.457 2.053 -5.278 1.00 0.20 C ATOM 703 O LYS S 50 -13.620 1.942 -5.655 1.00 0.21 O ATOM 704 CB LYS S 50 -10.339 1.638 -6.573 1.00 0.28 C ATOM 705 CG LYS S 50 -9.466 1.223 -5.408 1.00 0.33 C ATOM 706 CD LYS S 50 -9.051 -0.232 -5.509 1.00 0.36 C ATOM 707 CE LYS S 50 -7.786 -0.399 -6.338 1.00 1.13 C ATOM 708 NZ LYS S 50 -8.015 -0.077 -7.774 1.00 1.59 N ATOM 709 H LYS S 50 -9.938 3.832 -5.261 1.00 0.17 H ATOM 710 HA LYS S 50 -11.924 2.949 -7.127 1.00 0.26 H ATOM 711 HB2 LYS S 50 -10.816 0.754 -6.969 1.00 0.34 H ATOM 712 HB3 LYS S 50 -9.700 2.062 -7.334 1.00 0.36 H ATOM 713 HG2 LYS S 50 -8.582 1.836 -5.406 1.00 0.52 H ATOM 714 HG3 LYS S 50 -10.006 1.371 -4.488 1.00 0.57 H ATOM 715 HD2 LYS S 50 -8.875 -0.615 -4.514 1.00 0.81 H ATOM 716 HD3 LYS S 50 -9.850 -0.788 -5.975 1.00 0.83 H ATOM 717 HE2 LYS S 50 -7.025 0.263 -5.949 1.00 1.86 H ATOM 718 HE3 LYS S 50 -7.448 -1.421 -6.255 1.00 1.65 H ATOM 719 HZ1 LYS S 50 -8.767 -0.684 -8.161 1.00 2.04 H ATOM 720 HZ2 LYS S 50 -8.300 0.917 -7.877 1.00 1.98 H ATOM 721 HZ3 LYS S 50 -7.143 -0.235 -8.318 1.00 2.09 H ATOM 722 N ASP S 51 -12.059 1.652 -4.067 1.00 0.19 N ATOM 723 CA ASP S 51 -13.002 1.021 -3.144 1.00 0.24 C ATOM 724 C ASP S 51 -13.797 1.986 -2.270 1.00 0.24 C ATOM 725 O ASP S 51 -14.974 1.744 -2.004 1.00 0.29 O ATOM 726 CB ASP S 51 -12.288 -0.009 -2.276 1.00 0.31 C ATOM 727 CG ASP S 51 -12.669 -1.427 -2.659 1.00 0.76 C ATOM 728 OD1 ASP S 51 -13.813 -1.836 -2.372 1.00 1.03 O ATOM 729 OD2 ASP S 51 -11.816 -2.131 -3.237 1.00 1.06 O ATOM 730 H ASP S 51 -11.117 1.738 -3.801 1.00 0.19 H ATOM 731 HA ASP S 51 -13.711 0.500 -3.754 1.00 0.27 H ATOM 732 HB2 ASP S 51 -11.219 0.106 -2.393 1.00 0.34 H ATOM 733 HB3 ASP S 51 -12.557 0.153 -1.244 1.00 0.38 H ATOM 734 N LYS S 52 -13.181 3.061 -1.810 1.00 0.23 N ATOM 735 CA LYS S 52 -13.894 3.998 -0.951 1.00 0.31 C ATOM 736 C LYS S 52 -14.790 4.910 -1.772 1.00 0.29 C ATOM 737 O LYS S 52 -15.887 5.268 -1.343 1.00 0.31 O ATOM 738 CB LYS S 52 -12.921 4.807 -0.113 1.00 0.41 C ATOM 739 CG LYS S 52 -13.592 5.891 0.719 1.00 0.43 C ATOM 740 CD LYS S 52 -12.578 6.731 1.480 1.00 1.03 C ATOM 741 CE LYS S 52 -12.139 6.048 2.765 1.00 1.73 C ATOM 742 NZ LYS S 52 -13.276 5.848 3.705 1.00 2.23 N ATOM 743 H LYS S 52 -12.255 3.243 -2.073 1.00 0.19 H ATOM 744 HA LYS S 52 -14.519 3.416 -0.289 1.00 0.38 H ATOM 745 HB2 LYS S 52 -12.408 4.128 0.553 1.00 0.54 H ATOM 746 HB3 LYS S 52 -12.199 5.273 -0.765 1.00 0.47 H ATOM 747 HG2 LYS S 52 -14.157 6.537 0.063 1.00 0.85 H ATOM 748 HG3 LYS S 52 -14.262 5.423 1.427 1.00 0.96 H ATOM 749 HD2 LYS S 52 -11.713 6.886 0.853 1.00 1.70 H ATOM 750 HD3 LYS S 52 -13.025 7.684 1.723 1.00 1.54 H ATOM 751 HE2 LYS S 52 -11.713 5.087 2.519 1.00 2.21 H ATOM 752 HE3 LYS S 52 -11.390 6.662 3.245 1.00 2.28 H ATOM 753 HZ1 LYS S 52 -13.721 6.762 3.927 1.00 2.51 H ATOM 754 HZ2 LYS S 52 -13.989 5.225 3.276 1.00 2.67 H ATOM 755 HZ3 LYS S 52 -12.938 5.414 4.587 1.00 2.58 H ATOM 756 N LEU S 53 -14.317 5.285 -2.951 1.00 0.27 N ATOM 757 CA LEU S 53 -15.093 6.124 -3.847 1.00 0.30 C ATOM 758 C LEU S 53 -15.992 5.242 -4.679 1.00 0.28 C ATOM 759 O LEU S 53 -16.848 5.716 -5.428 1.00 0.33 O ATOM 760 CB LEU S 53 -14.171 6.922 -4.764 1.00 0.34 C ATOM 761 CG LEU S 53 -13.913 8.361 -4.328 1.00 0.53 C ATOM 762 CD1 LEU S 53 -15.214 9.147 -4.330 1.00 0.66 C ATOM 763 CD2 LEU S 53 -13.267 8.387 -2.952 1.00 0.63 C ATOM 764 H LEU S 53 -13.432 4.979 -3.239 1.00 0.27 H ATOM 765 HA LEU S 53 -15.693 6.799 -3.255 1.00 0.35 H ATOM 766 HB2 LEU S 53 -13.226 6.406 -4.820 1.00 0.30 H ATOM 767 HB3 LEU S 53 -14.607 6.937 -5.749 1.00 0.39 H ATOM 768 HG LEU S 53 -13.236 8.828 -5.028 1.00 0.57 H ATOM 769 HD11 LEU S 53 -15.933 8.648 -3.697 1.00 1.02 H ATOM 770 HD12 LEU S 53 -15.033 10.144 -3.958 1.00 1.48 H ATOM 771 HD13 LEU S 53 -15.597 9.200 -5.337 1.00 1.15 H ATOM 772 HD21 LEU S 53 -13.900 7.862 -2.250 1.00 1.05 H ATOM 773 HD22 LEU S 53 -12.304 7.902 -2.998 1.00 1.27 H ATOM 774 HD23 LEU S 53 -13.142 9.409 -2.630 1.00 1.10 H ATOM 775 N SER S 54 -15.767 3.945 -4.532 1.00 0.24 N ATOM 776 CA SER S 54 -16.520 2.940 -5.255 1.00 0.27 C ATOM 777 C SER S 54 -18.011 3.266 -5.280 1.00 0.32 C ATOM 778 O SER S 54 -18.664 3.144 -6.316 1.00 0.41 O ATOM 779 CB SER S 54 -16.315 1.562 -4.626 1.00 0.28 C ATOM 780 OG SER S 54 -16.984 0.557 -5.367 1.00 0.86 O ATOM 781 H SER S 54 -15.015 3.664 -3.973 1.00 0.22 H ATOM 782 HA SER S 54 -16.133 2.927 -6.257 1.00 0.29 H ATOM 783 HB2 SER S 54 -15.260 1.332 -4.602 1.00 0.69 H ATOM 784 HB3 SER S 54 -16.702 1.568 -3.619 1.00 0.69 H ATOM 785 HG SER S 54 -16.866 0.717 -6.305 1.00 1.22 H ATOM 786 N GLY S 55 -18.540 3.682 -4.134 1.00 0.30 N ATOM 787 CA GLY S 55 -19.949 4.021 -4.047 1.00 0.35 C ATOM 788 C GLY S 55 -20.698 3.143 -3.065 1.00 0.43 C ATOM 789 O GLY S 55 -21.837 3.438 -2.702 1.00 0.52 O ATOM 790 H GLY S 55 -17.970 3.757 -3.340 1.00 0.28 H ATOM 791 HA2 GLY S 55 -20.395 3.911 -5.023 1.00 0.46 H ATOM 792 HA3 GLY S 55 -20.041 5.050 -3.734 1.00 0.35 H