NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
543571 | 2lr0 | 18337 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 1H MET 1 2.792 8.014 14.089 2 H2 MET 1 2H MET 1 3.232 9.636 14.259 3 H3 MET 1 3H MET 1 4.376 8.418 14.517 4 HA MET 1 HA MET 1 3.034 9.019 11.957 5 HB2 MET 1 2HB MET 1 4.608 10.807 12.507 6 HB3 MET 1 3HB MET 1 5.858 9.644 12.930 7 HG2 MET 1 2HG MET 1 6.277 10.694 10.736 8 HG3 MET 1 3HG MET 1 6.043 8.949 10.586 9 HE1 MET 1 3HE MET 1 5.554 9.001 8.004 10 HE2 MET 1 1HE MET 1 5.896 10.733 7.992 11 HE3 MET 1 2HE MET 1 4.423 10.119 7.242 12 H LYS 2 H LYS 2 2.761 7.089 10.983 13 HA LYS 2 HA LYS 2 4.917 5.052 11.129 14 HB2 LYS 2 2HB LYS 2 2.935 3.401 10.633 15 HB3 LYS 2 3HB LYS 2 3.198 3.973 12.274 16 HG2 LYS 2 2HG LYS 2 1.353 5.535 12.102 17 HG3 LYS 2 3HG LYS 2 1.156 5.189 10.382 18 HD2 LYS 2 2HD LYS 2 -0.541 4.067 11.894 19 HD3 LYS 2 3HD LYS 2 0.336 2.969 10.829 20 HE2 LYS 2 2HE LYS 2 1.790 2.302 12.706 21 HE3 LYS 2 3HE LYS 2 0.957 3.437 13.766 22 HZ1 LYS 2 3HZ LYS 2 -1.019 2.171 13.631 23 HZ2 LYS 2 1HZ LYS 2 0.226 1.079 13.955 24 HZ3 LYS 2 2HZ LYS 2 -0.412 1.192 12.393 25 H ILE 3 H ILE 3 5.645 4.206 9.271 26 HA ILE 3 HA ILE 3 4.842 5.447 6.735 27 HB ILE 3 HB ILE 3 7.267 3.734 7.466 28 HG12 ILE 3 2HG1 ILE 3 7.046 6.741 6.970 29 HG13 ILE 3 3HG1 ILE 3 7.275 5.977 8.539 30 HG21 ILE 3 1HG2 ILE 3 6.710 3.435 5.091 31 HG22 ILE 3 2HG2 ILE 3 8.199 4.363 5.262 32 HG23 ILE 3 3HG2 ILE 3 6.692 5.185 4.857 33 HD11 ILE 3 3HD1 ILE 3 9.471 5.149 7.786 34 HD12 ILE 3 1HD1 ILE 3 9.341 6.906 7.747 35 HD13 ILE 3 2HD1 ILE 3 9.238 5.986 6.249 36 H LEU 4 H LEU 4 3.158 4.366 5.857 37 HA LEU 4 HA LEU 4 3.067 1.418 5.867 38 HB2 LEU 4 2HB LEU 4 0.971 3.559 5.458 39 HB3 LEU 4 3HB LEU 4 0.698 1.956 4.801 40 HG LEU 4 HG LEU 4 0.887 0.988 7.091 41 HD11 LEU 4 1HD1 LEU 4 0.818 2.426 9.072 42 HD12 LEU 4 2HD1 LEU 4 1.031 3.853 8.053 43 HD13 LEU 4 3HD1 LEU 4 2.312 2.644 8.163 44 HD21 LEU 4 3HD2 LEU 4 -1.299 1.529 6.139 45 HD22 LEU 4 1HD2 LEU 4 -1.212 3.157 6.821 46 HD23 LEU 4 2HD2 LEU 4 -1.295 1.751 7.886 47 H ILE 5 H ILE 5 3.723 0.369 4.114 48 HA ILE 5 HA ILE 5 3.416 1.578 1.433 49 HB ILE 5 HB ILE 5 5.014 -0.897 2.258 50 HG12 ILE 5 2HG1 ILE 5 5.960 1.851 1.311 51 HG13 ILE 5 3HG1 ILE 5 6.134 1.201 2.938 52 HG21 ILE 5 1HG2 ILE 5 5.802 -0.980 -0.090 53 HG22 ILE 5 2HG2 ILE 5 4.728 0.359 -0.497 54 HG23 ILE 5 3HG2 ILE 5 4.053 -1.191 0.008 55 HD11 ILE 5 3HD1 ILE 5 7.505 0.190 0.439 56 HD12 ILE 5 1HD1 ILE 5 7.623 -0.562 2.035 57 HD13 ILE 5 2HD1 ILE 5 8.234 1.071 1.781 58 H LEU 6 H LEU 6 1.370 1.220 0.894 59 HA LEU 6 HA LEU 6 -0.073 -1.212 1.477 60 HB2 LEU 6 2HB LEU 6 -0.803 1.459 1.247 61 HB3 LEU 6 3HB LEU 6 -1.269 0.859 -0.327 62 HG LEU 6 HG LEU 6 -2.263 -0.118 2.350 63 HD11 LEU 6 1HD1 LEU 6 -4.435 0.802 1.662 64 HD12 LEU 6 2HD1 LEU 6 -3.719 1.375 0.151 65 HD13 LEU 6 3HD1 LEU 6 -3.185 2.048 1.694 66 HD21 LEU 6 3HD2 LEU 6 -3.008 -1.143 -0.409 67 HD22 LEU 6 1HD2 LEU 6 -3.821 -1.583 1.098 68 HD23 LEU 6 2HD2 LEU 6 -2.136 -2.030 0.844 69 H ILE 7 H ILE 7 -0.259 -2.834 0.061 70 HA ILE 7 HA ILE 7 0.648 -2.527 -2.737 71 HB ILE 7 HB ILE 7 1.137 -4.878 -0.851 72 HG12 ILE 7 2HG1 ILE 7 2.694 -2.973 -0.523 73 HG13 ILE 7 3HG1 ILE 7 3.535 -4.375 -1.164 74 HG21 ILE 7 1HG2 ILE 7 1.799 -4.683 -3.813 75 HG22 ILE 7 2HG2 ILE 7 0.611 -5.760 -3.079 76 HG23 ILE 7 3HG2 ILE 7 2.327 -5.981 -2.736 77 HD11 ILE 7 3HD1 ILE 7 3.526 -3.345 -3.396 78 HD12 ILE 7 1HD1 ILE 7 4.321 -2.340 -2.185 79 HD13 ILE 7 2HD1 ILE 7 2.694 -1.935 -2.726 80 H ASN 8 H ASN 8 -0.958 -2.854 -4.069 81 HA ASN 8 HA ASN 8 -2.857 -5.075 -3.623 82 HB2 ASN 8 2HB ASN 8 -4.062 -2.958 -3.433 83 HB3 ASN 8 3HB ASN 8 -3.374 -2.376 -4.944 84 HD21 ASN 8 1HD2 ASN 8 -5.419 -2.057 -5.859 85 HD22 ASN 8 2HD2 ASN 8 -6.431 -3.369 -6.346 86 H THR 9 H THR 9 -1.748 -6.537 -4.799 87 HA THR 9 HA THR 9 -1.751 -6.099 -7.704 88 HB THR 9 HB THR 9 0.581 -6.069 -7.238 89 HG1 THR 9 HG1 THR 9 0.407 -7.354 -8.966 90 HG21 THR 9 3HG2 THR 9 0.268 -8.565 -5.573 91 HG22 THR 9 1HG2 THR 9 0.605 -6.946 -4.959 92 HG23 THR 9 2HG2 THR 9 1.794 -7.773 -5.971 93 H ASN 10 H ASN 10 -2.613 -7.711 -8.907 94 HA ASN 10 HA ASN 10 -4.238 -9.690 -7.523 95 HB2 ASN 10 2HB ASN 10 -4.961 -8.512 -9.661 96 HB3 ASN 10 3HB ASN 10 -3.782 -9.485 -10.530 97 HD21 ASN 10 1HD2 ASN 10 -4.200 -11.738 -10.799 98 HD22 ASN 10 2HD2 ASN 10 -5.772 -12.402 -10.540 99 H ASN 11 H ASN 11 -1.097 -9.540 -8.903 100 HA ASN 11 HA ASN 11 -0.591 -12.391 -8.950 101 HB2 ASN 11 2HB ASN 11 1.478 -10.154 -8.823 102 HB3 ASN 11 3HB ASN 11 1.704 -11.789 -9.434 103 HD21 ASN 11 1HD2 ASN 11 2.252 -9.244 -10.718 104 HD22 ASN 11 2HD2 ASN 11 1.340 -9.226 -12.185 105 H ASP 12 H ASP 12 -1.249 -13.080 -6.900 106 HA ASP 12 HA ASP 12 -0.656 -11.757 -4.457 107 HB2 ASP 12 2HB ASP 12 -2.622 -13.258 -4.861 108 HB3 ASP 12 3HB ASP 12 -1.533 -14.641 -4.906 109 H GLU 13 H GLU 13 1.098 -14.054 -6.367 110 HA GLU 13 HA GLU 13 3.017 -14.869 -4.371 111 HB2 GLU 13 2HB GLU 13 3.095 -15.048 -7.415 112 HB3 GLU 13 3HB GLU 13 4.255 -15.818 -6.333 113 HG2 GLU 13 2HG GLU 13 2.500 -17.241 -5.399 114 HG3 GLU 13 3HG GLU 13 1.279 -16.420 -6.377 115 H LEU 14 H LEU 14 2.744 -12.246 -6.714 116 HA LEU 14 HA LEU 14 5.420 -11.281 -6.606 117 HB2 LEU 14 2HB LEU 14 3.893 -10.613 -8.397 118 HB3 LEU 14 3HB LEU 14 2.809 -9.866 -7.241 119 HG LEU 14 HG LEU 14 4.490 -8.097 -6.776 120 HD11 LEU 14 1HD1 LEU 14 6.194 -9.424 -8.902 121 HD12 LEU 14 2HD1 LEU 14 6.552 -9.331 -7.175 122 HD13 LEU 14 3HD1 LEU 14 6.510 -7.860 -8.142 123 HD21 LEU 14 3HD2 LEU 14 3.834 -8.429 -9.721 124 HD22 LEU 14 1HD2 LEU 14 4.351 -6.926 -8.948 125 HD23 LEU 14 2HD2 LEU 14 2.821 -7.668 -8.490 126 H ILE 15 H ILE 15 2.570 -10.815 -4.551 127 HA ILE 15 HA ILE 15 3.481 -8.742 -2.881 128 HB ILE 15 HB ILE 15 1.757 -11.130 -2.061 129 HG12 ILE 15 2HG1 ILE 15 0.915 -8.377 -3.066 130 HG13 ILE 15 3HG1 ILE 15 0.810 -9.873 -3.982 131 HG21 ILE 15 1HG2 ILE 15 0.949 -9.693 -0.223 132 HG22 ILE 15 2HG2 ILE 15 2.052 -8.412 -0.719 133 HG23 ILE 15 3HG2 ILE 15 2.687 -9.940 -0.104 134 HD11 ILE 15 3HD1 ILE 15 -0.838 -10.720 -2.367 135 HD12 ILE 15 1HD1 ILE 15 -1.349 -9.229 -3.159 136 HD13 ILE 15 2HD1 ILE 15 -0.753 -9.183 -1.502 137 H LYS 16 H LYS 16 4.073 -12.241 -2.811 138 HA LYS 16 HA LYS 16 5.436 -12.385 -0.334 139 HB2 LYS 16 2HB LYS 16 5.734 -14.208 -2.759 140 HB3 LYS 16 3HB LYS 16 6.265 -14.591 -1.124 141 HG2 LYS 16 2HG LYS 16 3.389 -14.162 -2.007 142 HG3 LYS 16 3HG LYS 16 4.152 -15.722 -1.693 143 HD2 LYS 16 2HD LYS 16 3.707 -13.526 0.370 144 HD3 LYS 16 3HD LYS 16 2.718 -14.973 0.183 145 HE2 LYS 16 2HE LYS 16 5.663 -14.953 0.932 146 HE3 LYS 16 3HE LYS 16 4.321 -15.181 2.051 147 HZ1 LYS 16 3HZ LYS 16 5.280 -17.287 1.457 148 HZ2 LYS 16 1HZ LYS 16 5.048 -16.990 -0.195 149 HZ3 LYS 16 2HZ LYS 16 3.716 -17.190 0.825 150 H LYS 17 H LYS 17 6.504 -11.548 -3.574 151 HA LYS 17 HA LYS 17 9.332 -11.594 -3.045 152 HB2 LYS 17 2HB LYS 17 7.805 -10.179 -5.269 153 HB3 LYS 17 3HB LYS 17 9.539 -10.507 -5.235 154 HG2 LYS 17 2HG LYS 17 8.961 -12.986 -5.179 155 HG3 LYS 17 3HG LYS 17 7.282 -12.520 -5.481 156 HD2 LYS 17 2HD LYS 17 8.376 -13.136 -7.585 157 HD3 LYS 17 3HD LYS 17 7.978 -11.416 -7.598 158 HE2 LYS 17 2HE LYS 17 10.310 -10.849 -7.079 159 HE3 LYS 17 3HE LYS 17 10.720 -12.560 -6.945 160 HZ1 LYS 17 3HZ LYS 17 11.329 -11.507 -9.082 161 HZ2 LYS 17 1HZ LYS 17 9.685 -11.305 -9.415 162 HZ3 LYS 17 2HZ LYS 17 10.328 -12.859 -9.251 163 H ILE 18 H ILE 18 6.832 -9.106 -3.266 164 HA ILE 18 HA ILE 18 8.361 -6.816 -2.659 165 HB ILE 18 HB ILE 18 5.394 -7.438 -2.316 166 HG12 ILE 18 2HG1 ILE 18 6.862 -5.773 -4.421 167 HG13 ILE 18 3HG1 ILE 18 6.280 -7.415 -4.655 168 HG21 ILE 18 1HG2 ILE 18 4.996 -5.000 -2.075 169 HG22 ILE 18 2HG2 ILE 18 6.736 -4.734 -1.979 170 HG23 ILE 18 3HG2 ILE 18 5.914 -5.665 -0.726 171 HD11 ILE 18 3HD1 ILE 18 4.811 -5.854 -5.721 172 HD12 ILE 18 1HD1 ILE 18 4.584 -4.959 -4.219 173 HD13 ILE 18 2HD1 ILE 18 3.968 -6.608 -4.369 174 H LYS 19 H LYS 19 6.864 -9.285 -0.644 175 HA LYS 19 HA LYS 19 7.255 -8.150 1.897 176 HB2 LYS 19 2HB LYS 19 7.054 -11.018 0.950 177 HB3 LYS 19 3HB LYS 19 7.408 -10.655 2.638 178 HG2 LYS 19 2HG LYS 19 5.297 -9.484 2.895 179 HG3 LYS 19 3HG LYS 19 4.954 -9.639 1.169 180 HD2 LYS 19 2HD LYS 19 3.685 -11.267 2.567 181 HD3 LYS 19 3HD LYS 19 4.719 -12.046 1.367 182 HE2 LYS 19 2HE LYS 19 4.836 -13.232 3.503 183 HE3 LYS 19 3HE LYS 19 6.397 -12.511 3.127 184 HZ1 LYS 19 3HZ LYS 19 5.714 -12.261 5.460 185 HZ2 LYS 19 1HZ LYS 19 4.402 -11.312 4.977 186 HZ3 LYS 19 2HZ LYS 19 5.986 -10.774 4.704 187 H LYS 20 H LYS 20 9.365 -10.319 -0.079 188 HA LYS 20 HA LYS 20 11.522 -10.570 1.684 189 HB2 LYS 20 2HB LYS 20 11.771 -10.346 -1.352 190 HB3 LYS 20 3HB LYS 20 12.938 -11.088 -0.259 191 HG2 LYS 20 2HG LYS 20 10.135 -12.095 -0.813 192 HG3 LYS 20 3HG LYS 20 11.623 -12.761 -1.487 193 HD2 LYS 20 2HD LYS 20 12.364 -13.381 0.820 194 HD3 LYS 20 3HD LYS 20 10.846 -12.744 1.467 195 HE2 LYS 20 2HE LYS 20 10.774 -15.209 1.231 196 HE3 LYS 20 3HE LYS 20 9.579 -14.430 0.193 197 HZ1 LYS 20 3HZ LYS 20 11.070 -14.710 -1.683 198 HZ2 LYS 20 1HZ LYS 20 10.751 -16.201 -0.954 199 HZ3 LYS 20 2HZ LYS 20 12.235 -15.436 -0.692 200 H GLU 21 H GLU 21 10.863 -8.034 -0.702 201 HA GLU 21 HA GLU 21 13.142 -6.439 -0.413 202 HB2 GLU 21 2HB GLU 21 10.309 -5.418 -0.918 203 HB3 GLU 21 3HB GLU 21 11.809 -4.596 -1.339 204 HG2 GLU 21 2HG GLU 21 10.671 -7.112 -2.587 205 HG3 GLU 21 3HG GLU 21 10.825 -5.525 -3.335 206 H VAL 22 H VAL 22 10.012 -6.232 1.339 207 HA VAL 22 HA VAL 22 10.905 -3.992 2.936 208 HB VAL 22 HB VAL 22 8.722 -3.937 3.936 209 HG11 VAL 22 1HG1 VAL 22 7.274 -3.695 1.958 210 HG12 VAL 22 2HG1 VAL 22 8.461 -4.567 0.984 211 HG13 VAL 22 3HG1 VAL 22 8.877 -3.006 1.691 212 HG21 VAL 22 3HG2 VAL 22 8.325 -6.306 4.386 213 HG22 VAL 22 1HG2 VAL 22 8.146 -6.632 2.661 214 HG23 VAL 22 2HG2 VAL 22 6.962 -5.627 3.498 215 H GLU 23 H GLU 23 10.928 -7.445 3.385 216 HA GLU 23 HA GLU 23 10.884 -7.558 6.246 217 HB2 GLU 23 2HB GLU 23 11.902 -9.565 4.188 218 HB3 GLU 23 3HB GLU 23 11.853 -9.896 5.912 219 HG2 GLU 23 2HG GLU 23 9.410 -9.253 4.252 220 HG3 GLU 23 3HG GLU 23 9.983 -10.888 4.541 221 H ASN 24 H ASN 24 13.381 -7.453 3.758 222 HA ASN 24 HA ASN 24 15.665 -7.562 5.432 223 HB2 ASN 24 2HB ASN 24 15.300 -6.411 2.634 224 HB3 ASN 24 3HB ASN 24 16.866 -6.613 3.418 225 HD21 ASN 24 1HD2 ASN 24 15.910 -7.816 0.943 226 HD22 ASN 24 2HD2 ASN 24 16.009 -9.525 1.166 227 H GLN 25 H GLN 25 13.419 -5.026 4.731 228 HA GLN 25 HA GLN 25 15.161 -2.914 5.853 229 HB2 GLN 25 2HB GLN 25 12.504 -2.661 4.376 230 HB3 GLN 25 3HB GLN 25 13.520 -1.324 4.904 231 HG2 GLN 25 2HG GLN 25 14.226 -3.387 2.789 232 HG3 GLN 25 3HG GLN 25 13.759 -1.714 2.499 233 HE21 GLN 25 1HE2 GLN 25 16.328 -3.842 3.515 234 HE22 GLN 25 2HE2 GLN 25 17.587 -2.662 3.501 235 H GLY 26 H GLY 26 12.890 -5.118 6.924 236 HA2 GLY 26 2HA GLY 26 12.210 -5.442 9.090 237 HA3 GLY 26 3HA GLY 26 12.835 -3.863 9.517 238 H TYR 27 H TYR 27 10.356 -4.533 7.052 239 HA TYR 27 HA TYR 27 8.396 -2.891 8.482 240 HB2 TYR 27 2HB TYR 27 8.364 -4.156 5.713 241 HB3 TYR 27 3HB TYR 27 6.951 -3.371 6.400 242 HD1 TYR 27 HD1 TYR 27 10.614 -2.528 5.928 243 HD2 TYR 27 HD2 TYR 27 6.549 -1.226 5.608 244 HE1 TYR 27 HE1 TYR 27 11.371 -0.382 5.000 245 HE2 TYR 27 HE2 TYR 27 7.312 0.921 4.692 246 HH TYR 27 HH TYR 27 10.422 1.425 3.537 247 H GLN 28 H GLN 28 6.670 -3.685 9.500 248 HA GLN 28 HA GLN 28 6.301 -6.523 9.941 249 HB2 GLN 28 2HB GLN 28 6.067 -4.745 11.721 250 HB3 GLN 28 3HB GLN 28 4.643 -4.142 10.884 251 HG2 GLN 28 2HG GLN 28 3.576 -6.398 11.248 252 HG3 GLN 28 3HG GLN 28 4.974 -6.836 12.231 253 HE21 GLN 28 1HE2 GLN 28 5.175 -4.050 13.346 254 HE22 GLN 28 2HE2 GLN 28 3.894 -3.956 14.492 255 H VAL 29 H VAL 29 5.139 -7.720 8.511 256 HA VAL 29 HA VAL 29 3.452 -6.465 6.513 257 HB VAL 29 HB VAL 29 4.106 -9.425 6.883 258 HG11 VAL 29 1HG1 VAL 29 2.860 -7.987 4.500 259 HG12 VAL 29 2HG1 VAL 29 2.018 -9.098 5.582 260 HG13 VAL 29 3HG1 VAL 29 3.316 -9.693 4.545 261 HG21 VAL 29 3HG2 VAL 29 5.729 -9.076 5.041 262 HG22 VAL 29 1HG2 VAL 29 6.122 -8.075 6.444 263 HG23 VAL 29 2HG2 VAL 29 5.345 -7.352 5.032 264 H ARG 30 H ARG 30 1.544 -5.855 7.189 265 HA ARG 30 HA ARG 30 -0.301 -7.551 8.724 266 HB2 ARG 30 2HB ARG 30 0.007 -5.142 9.316 267 HB3 ARG 30 3HB ARG 30 -0.486 -4.676 7.699 268 HG2 ARG 30 2HG ARG 30 -2.357 -4.251 9.054 269 HG3 ARG 30 3HG ARG 30 -2.740 -5.757 8.225 270 HD2 ARG 30 2HD ARG 30 -1.812 -5.447 11.096 271 HD3 ARG 30 3HD ARG 30 -3.433 -5.872 10.558 272 HE ARG 30 HE ARG 30 -1.082 -7.594 10.680 273 HH11 ARG 30 1HH1 ARG 30 -4.437 -7.312 9.622 274 HH12 ARG 30 2HH1 ARG 30 -4.662 -9.027 9.488 275 HH21 ARG 30 1HH2 ARG 30 -1.377 -9.822 10.446 276 HH22 ARG 30 2HH2 ARG 30 -2.918 -10.447 9.956 277 H ASP 31 H ASP 31 -2.591 -7.807 7.761 278 HA ASP 31 HA ASP 31 -2.854 -7.429 4.892 279 HB2 ASP 31 2HB ASP 31 -3.302 -9.745 4.322 280 HB3 ASP 31 3HB ASP 31 -1.710 -9.632 5.054 281 H VAL 32 H VAL 32 -4.817 -6.720 4.473 282 HA VAL 32 HA VAL 32 -7.025 -7.036 6.391 283 HB VAL 32 HB VAL 32 -6.975 -5.271 3.896 284 HG11 VAL 32 1HG1 VAL 32 -8.781 -5.207 6.343 285 HG12 VAL 32 2HG1 VAL 32 -9.235 -5.773 4.735 286 HG13 VAL 32 3HG1 VAL 32 -8.842 -4.073 4.988 287 HG21 VAL 32 3HG2 VAL 32 -6.467 -3.361 5.399 288 HG22 VAL 32 1HG2 VAL 32 -5.153 -4.540 5.358 289 HG23 VAL 32 2HG2 VAL 32 -6.247 -4.483 6.742 290 H ASN 33 H ASN 33 -8.595 -8.507 6.006 291 HA ASN 33 HA ASN 33 -8.764 -9.809 3.343 292 HB2 ASN 33 2HB ASN 33 -9.697 -10.798 6.072 293 HB3 ASN 33 3HB ASN 33 -9.880 -11.682 4.558 294 HD21 ASN 33 1HD2 ASN 33 -7.538 -10.437 6.865 295 HD22 ASN 33 2HD2 ASN 33 -6.260 -11.502 6.415 296 H ASP 34 H ASP 34 -10.669 -8.038 5.706 297 HA ASP 34 HA ASP 34 -13.049 -8.007 3.988 298 HB2 ASP 34 2HB ASP 34 -13.249 -10.110 5.329 299 HB3 ASP 34 3HB ASP 34 -13.087 -9.185 6.816 300 H SER 35 H SER 35 -14.821 -6.604 5.061 301 HA SER 35 HA SER 35 -13.799 -4.047 5.704 302 HB2 SER 35 2HB SER 35 -15.987 -4.502 4.545 303 HB3 SER 35 3HB SER 35 -16.655 -5.043 6.084 304 HG SER 35 HG SER 35 -15.634 -2.461 5.478 305 H ASP 36 H ASP 36 -15.192 -6.606 7.723 306 HA ASP 36 HA ASP 36 -15.238 -5.264 10.212 307 HB2 ASP 36 2HB ASP 36 -16.485 -7.324 9.891 308 HB3 ASP 36 3HB ASP 36 -15.032 -8.212 9.450 309 H GLU 37 H GLU 37 -12.830 -7.354 8.651 310 HA GLU 37 HA GLU 37 -10.772 -7.198 10.566 311 HB2 GLU 37 2HB GLU 37 -10.538 -7.550 7.544 312 HB3 GLU 37 3HB GLU 37 -9.289 -7.948 8.723 313 HG2 GLU 37 2HG GLU 37 -12.013 -9.275 8.528 314 HG3 GLU 37 3HG GLU 37 -10.511 -9.940 7.889 315 H LEU 38 H LEU 38 -11.690 -5.075 7.887 316 HA LEU 38 HA LEU 38 -9.395 -3.493 7.639 317 HB2 LEU 38 2HB LEU 38 -11.194 -3.483 5.965 318 HB3 LEU 38 3HB LEU 38 -12.307 -2.780 7.125 319 HG LEU 38 HG LEU 38 -10.901 -0.690 7.166 320 HD11 LEU 38 1HD1 LEU 38 -8.755 -1.631 6.528 321 HD12 LEU 38 2HD1 LEU 38 -9.208 -0.328 5.434 322 HD13 LEU 38 3HD1 LEU 38 -9.368 -2.008 4.914 323 HD21 LEU 38 3HD2 LEU 38 -11.914 -1.461 4.413 324 HD22 LEU 38 1HD2 LEU 38 -11.615 0.182 4.991 325 HD23 LEU 38 2HD2 LEU 38 -12.883 -0.795 5.729 326 H LYS 39 H LYS 39 -12.421 -2.810 9.456 327 HA LYS 39 HA LYS 39 -11.452 -0.377 10.561 328 HB2 LYS 39 2HB LYS 39 -13.492 -0.422 11.983 329 HB3 LYS 39 3HB LYS 39 -13.821 -0.677 10.281 330 HG2 LYS 39 2HG LYS 39 -15.234 -2.255 11.189 331 HG3 LYS 39 3HG LYS 39 -13.790 -3.240 10.959 332 HD2 LYS 39 2HD LYS 39 -13.194 -2.944 13.342 333 HD3 LYS 39 3HD LYS 39 -14.607 -1.910 13.578 334 HE2 LYS 39 2HE LYS 39 -14.680 -4.843 12.779 335 HE3 LYS 39 3HE LYS 39 -15.004 -4.210 14.395 336 HZ1 LYS 39 3HZ LYS 39 -16.592 -3.649 11.946 337 HZ2 LYS 39 1HZ LYS 39 -16.891 -2.979 13.467 338 HZ3 LYS 39 2HZ LYS 39 -17.053 -4.641 13.229 339 H LYS 40 H LYS 40 -11.370 -3.740 11.765 340 HA LYS 40 HA LYS 40 -10.389 -3.328 14.367 341 HB2 LYS 40 2HB LYS 40 -9.830 -5.497 12.347 342 HB3 LYS 40 3HB LYS 40 -9.205 -5.558 13.998 343 HG2 LYS 40 2HG LYS 40 -11.463 -5.566 14.907 344 HG3 LYS 40 3HG LYS 40 -12.150 -5.376 13.284 345 HD2 LYS 40 2HD LYS 40 -11.235 -7.533 12.611 346 HD3 LYS 40 3HD LYS 40 -10.440 -7.712 14.175 347 HE2 LYS 40 2HE LYS 40 -12.576 -7.914 15.298 348 HE3 LYS 40 3HE LYS 40 -13.443 -7.537 13.806 349 HZ1 LYS 40 3HZ LYS 40 -11.697 -9.909 14.152 350 HZ2 LYS 40 1HZ LYS 40 -12.706 -9.567 12.838 351 HZ3 LYS 40 2HZ LYS 40 -13.375 -9.930 14.352 352 H GLU 41 H GLU 41 -8.621 -3.592 11.315 353 HA GLU 41 HA GLU 41 -6.006 -3.236 12.454 354 HB2 GLU 41 2HB GLU 41 -6.996 -3.273 9.569 355 HB3 GLU 41 3HB GLU 41 -5.289 -3.272 10.030 356 HG2 GLU 41 2HG GLU 41 -5.469 -5.435 11.059 357 HG3 GLU 41 3HG GLU 41 -7.230 -5.407 10.975 358 H MET 42 H MET 42 -8.459 -1.118 11.159 359 HA MET 42 HA MET 42 -6.830 1.211 10.805 360 HB2 MET 42 2HB MET 42 -9.835 0.849 11.145 361 HB3 MET 42 3HB MET 42 -9.099 2.440 10.990 362 HG2 MET 42 2HG MET 42 -9.045 0.226 8.929 363 HG3 MET 42 3HG MET 42 -9.967 1.727 8.842 364 HE1 MET 42 3HE MET 42 -6.917 4.323 8.609 365 HE2 MET 42 1HE MET 42 -7.410 3.635 10.154 366 HE3 MET 42 2HE MET 42 -8.625 4.152 8.990 367 H LYS 43 H LYS 43 -8.559 -0.259 13.506 368 HA LYS 43 HA LYS 43 -8.267 1.855 15.362 369 HB2 LYS 43 2HB LYS 43 -9.297 -0.834 15.453 370 HB3 LYS 43 3HB LYS 43 -8.119 -0.713 16.745 371 HG2 LYS 43 2HG LYS 43 -10.182 -0.128 17.735 372 HG3 LYS 43 3HG LYS 43 -9.325 1.398 17.503 373 HD2 LYS 43 2HD LYS 43 -11.593 1.768 16.834 374 HD3 LYS 43 3HD LYS 43 -10.634 1.708 15.348 375 HE2 LYS 43 2HE LYS 43 -12.722 0.461 15.085 376 HE3 LYS 43 3HE LYS 43 -11.350 -0.644 15.006 377 HZ1 LYS 43 3HZ LYS 43 -13.030 -0.176 17.412 378 HZ2 LYS 43 1HZ LYS 43 -11.782 -1.310 17.274 379 HZ3 LYS 43 2HZ LYS 43 -13.195 -1.485 16.359 380 H LYS 44 H LYS 44 -6.138 -0.812 14.398 381 HA LYS 44 HA LYS 44 -4.069 -0.369 16.283 382 HB2 LYS 44 2HB LYS 44 -3.942 -1.565 13.485 383 HB3 LYS 44 3HB LYS 44 -2.604 -1.600 14.627 384 HG2 LYS 44 2HG LYS 44 -5.293 -2.971 14.947 385 HG3 LYS 44 3HG LYS 44 -3.748 -3.744 14.584 386 HD2 LYS 44 2HD LYS 44 -4.591 -2.406 17.178 387 HD3 LYS 44 3HD LYS 44 -4.228 -4.110 16.911 388 HE2 LYS 44 2HE LYS 44 -2.258 -1.797 16.913 389 HE3 LYS 44 3HE LYS 44 -2.377 -3.100 18.092 390 HZ1 LYS 44 3HZ LYS 44 -0.541 -3.379 16.521 391 HZ2 LYS 44 1HZ LYS 44 -1.643 -3.471 15.240 392 HZ3 LYS 44 2HZ LYS 44 -1.647 -4.657 16.443 393 H LEU 45 H LEU 45 -4.736 1.021 13.092 394 HA LEU 45 HA LEU 45 -2.344 2.555 12.882 395 HB2 LEU 45 2HB LEU 45 -5.034 3.020 11.540 396 HB3 LEU 45 3HB LEU 45 -3.513 3.763 11.063 397 HG LEU 45 HG LEU 45 -4.234 0.812 10.853 398 HD11 LEU 45 1HD1 LEU 45 -4.050 1.138 8.440 399 HD12 LEU 45 2HD1 LEU 45 -3.728 2.858 8.682 400 HD13 LEU 45 3HD1 LEU 45 -5.291 2.173 9.140 401 HD21 LEU 45 3HD2 LEU 45 -1.608 2.141 10.113 402 HD22 LEU 45 1HD2 LEU 45 -2.061 0.467 9.766 403 HD23 LEU 45 2HD2 LEU 45 -1.869 0.998 11.434 404 H ALA 46 H ALA 46 -5.418 3.080 14.475 405 HA ALA 46 HA ALA 46 -5.022 5.880 15.067 406 HB1 ALA 46 3HB ALA 46 -6.993 3.882 16.229 407 HB2 ALA 46 1HB ALA 46 -7.284 4.941 14.847 408 HB3 ALA 46 2HB ALA 46 -7.051 5.633 16.454 409 H GLU 47 H GLU 47 -4.503 2.814 16.795 410 HA GLU 47 HA GLU 47 -4.012 3.967 19.379 411 HB2 GLU 47 2HB GLU 47 -3.599 1.171 18.243 412 HB3 GLU 47 3HB GLU 47 -3.225 1.577 19.914 413 HG2 GLU 47 2HG GLU 47 -5.976 1.851 18.664 414 HG3 GLU 47 3HG GLU 47 -5.437 0.448 19.582 415 H GLU 48 H GLU 48 -1.941 2.382 16.947 416 HA GLU 48 HA GLU 48 0.513 2.912 18.380 417 HB2 GLU 48 2HB GLU 48 0.117 1.885 15.535 418 HB3 GLU 48 3HB GLU 48 1.612 1.813 16.465 419 HG2 GLU 48 2HG GLU 48 0.687 0.196 17.984 420 HG3 GLU 48 3HG GLU 48 -0.935 0.412 17.328 421 H LYS 49 H LYS 49 0.675 5.129 18.559 422 HA LYS 49 HA LYS 49 0.858 6.823 16.167 423 HB2 LYS 49 2HB LYS 49 -0.369 7.579 18.230 424 HB3 LYS 49 3HB LYS 49 1.157 7.577 19.105 425 HG2 LYS 49 2HG LYS 49 2.025 9.381 17.743 426 HG3 LYS 49 3HG LYS 49 0.657 9.275 16.634 427 HD2 LYS 49 2HD LYS 49 0.521 10.145 19.548 428 HD3 LYS 49 3HD LYS 49 0.445 11.211 18.143 429 HE2 LYS 49 2HE LYS 49 -1.596 9.086 18.904 430 HE3 LYS 49 3HE LYS 49 -1.805 10.834 19.010 431 HZ1 LYS 49 3HZ LYS 49 -1.559 10.928 16.571 432 HZ2 LYS 49 1HZ LYS 49 -2.892 10.010 17.059 433 HZ3 LYS 49 2HZ LYS 49 -1.488 9.240 16.520 434 H ASN 50 H ASN 50 2.838 4.995 18.268 435 HA ASN 50 HA ASN 50 5.336 6.287 18.081 436 HB2 ASN 50 2HB ASN 50 4.833 4.427 19.665 437 HB3 ASN 50 3HB ASN 50 4.728 3.301 18.314 438 HD21 ASN 50 1HD2 ASN 50 6.402 2.003 19.141 439 HD22 ASN 50 2HD2 ASN 50 8.058 2.501 19.138 440 H PHE 51 H PHE 51 7.101 5.928 16.670 441 HA PHE 51 HA PHE 51 6.470 5.799 13.918 442 HB2 PHE 51 2HB PHE 51 8.336 7.159 14.845 443 HB3 PHE 51 3HB PHE 51 9.196 5.690 15.279 444 HD1 PHE 51 HD2 PHE 51 7.955 7.697 12.388 445 HD2 PHE 51 HD1 PHE 51 10.585 4.559 13.656 446 HE1 PHE 51 HE2 PHE 51 9.034 7.694 10.180 447 HE2 PHE 51 HE1 PHE 51 11.657 4.572 11.445 448 HZ PHE 51 HZ PHE 51 10.881 6.132 9.705 449 H GLU 52 H GLU 52 6.140 4.019 12.690 450 HA GLU 52 HA GLU 52 7.868 1.703 12.909 451 HB2 GLU 52 2HB GLU 52 6.073 1.224 14.602 452 HB3 GLU 52 3HB GLU 52 4.863 1.335 13.328 453 HG2 GLU 52 2HG GLU 52 5.404 -1.014 13.865 454 HG3 GLU 52 3HG GLU 52 5.829 -0.627 12.197 455 H LYS 53 H LYS 53 7.910 0.469 11.119 456 HA LYS 53 HA LYS 53 6.750 1.505 8.628 457 HB2 LYS 53 2HB LYS 53 8.973 -0.504 9.202 458 HB3 LYS 53 3HB LYS 53 8.521 0.073 7.604 459 HG2 LYS 53 2HG LYS 53 9.387 2.243 8.000 460 HG3 LYS 53 3HG LYS 53 9.452 2.000 9.747 461 HD2 LYS 53 2HD LYS 53 11.133 0.290 7.892 462 HD3 LYS 53 3HD LYS 53 11.679 1.901 8.355 463 HE2 LYS 53 2HE LYS 53 12.648 0.118 9.793 464 HE3 LYS 53 3HE LYS 53 11.691 1.269 10.715 465 HZ1 LYS 53 3HZ LYS 53 10.660 -1.358 9.812 466 HZ2 LYS 53 1HZ LYS 53 9.941 -0.302 10.917 467 HZ3 LYS 53 2HZ LYS 53 11.370 -1.108 11.323 468 H ILE 54 H ILE 54 4.989 0.431 7.820 469 HA ILE 54 HA ILE 54 4.498 -2.419 8.516 470 HB ILE 54 HB ILE 54 2.338 -0.272 8.173 471 HG12 ILE 54 2HG1 ILE 54 3.280 -1.560 10.777 472 HG13 ILE 54 3HG1 ILE 54 3.641 0.090 10.281 473 HG21 ILE 54 1HG2 ILE 54 2.097 -3.157 9.104 474 HG22 ILE 54 2HG2 ILE 54 1.578 -2.528 7.539 475 HG23 ILE 54 3HG2 ILE 54 0.771 -1.993 9.014 476 HD11 ILE 54 3HD1 ILE 54 1.857 0.051 11.910 477 HD12 ILE 54 1HD1 ILE 54 0.895 -1.018 10.890 478 HD13 ILE 54 2HD1 ILE 54 1.246 0.631 10.362 479 H LEU 55 H LEU 55 4.082 -3.720 6.759 480 HA LEU 55 HA LEU 55 3.500 -2.539 4.111 481 HB2 LEU 55 2HB LEU 55 5.321 -4.273 4.286 482 HB3 LEU 55 3HB LEU 55 4.133 -5.428 4.870 483 HG LEU 55 HG LEU 55 2.885 -5.019 2.611 484 HD11 LEU 55 1HD1 LEU 55 4.025 -3.009 1.921 485 HD12 LEU 55 2HD1 LEU 55 4.291 -4.284 0.737 486 HD13 LEU 55 3HD1 LEU 55 5.574 -3.854 1.869 487 HD21 LEU 55 3HD2 LEU 55 5.561 -6.438 2.523 488 HD22 LEU 55 1HD2 LEU 55 4.207 -6.685 1.416 489 HD23 LEU 55 2HD2 LEU 55 4.045 -7.117 3.116 490 H ILE 56 H ILE 56 1.296 -2.264 3.791 491 HA ILE 56 HA ILE 56 -0.636 -4.096 5.045 492 HB ILE 56 HB ILE 56 -1.167 -1.615 3.351 493 HG12 ILE 56 2HG1 ILE 56 -0.058 -1.105 5.564 494 HG13 ILE 56 3HG1 ILE 56 -1.665 -0.408 5.412 495 HG21 ILE 56 1HG2 ILE 56 -3.506 -1.787 4.201 496 HG22 ILE 56 2HG2 ILE 56 -3.092 -3.311 4.989 497 HG23 ILE 56 3HG2 ILE 56 -3.041 -3.187 3.230 498 HD11 ILE 56 3HD1 ILE 56 -2.563 -2.208 6.818 499 HD12 ILE 56 1HD1 ILE 56 -1.295 -1.286 7.622 500 HD13 ILE 56 2HD1 ILE 56 -0.937 -2.885 6.972 501 H LYS 57 H LYS 57 -0.875 -5.964 3.926 502 HA LYS 57 HA LYS 57 -0.965 -6.022 0.997 503 HB2 LYS 57 2HB LYS 57 0.368 -7.749 2.048 504 HB3 LYS 57 3HB LYS 57 -0.914 -8.168 3.168 505 HG2 LYS 57 2HG LYS 57 -1.477 -8.564 0.244 506 HG3 LYS 57 3HG LYS 57 -0.314 -9.653 0.995 507 HD2 LYS 57 2HD LYS 57 -2.069 -10.210 2.728 508 HD3 LYS 57 3HD LYS 57 -3.216 -9.243 1.803 509 HE2 LYS 57 2HE LYS 57 -1.762 -11.693 0.751 510 HE3 LYS 57 3HE LYS 57 -3.413 -11.685 1.368 511 HZ1 LYS 57 3HZ LYS 57 -4.045 -10.187 -0.408 512 HZ2 LYS 57 1HZ LYS 57 -3.342 -11.589 -1.042 513 HZ3 LYS 57 2HZ LYS 57 -2.457 -10.154 -0.987 514 H SER 58 H SER 58 -2.864 -5.642 0.046 515 HA SER 58 HA SER 58 -5.204 -7.146 0.817 516 HB2 SER 58 2HB SER 58 -5.491 -5.109 2.219 517 HB3 SER 58 3HB SER 58 -5.366 -4.096 0.783 518 HG SER 58 HG SER 58 -7.430 -4.394 0.563 519 H ASN 59 H ASN 59 -5.892 -7.956 -1.008 520 HA ASN 59 HA ASN 59 -5.191 -6.764 -3.600 521 HB2 ASN 59 2HB ASN 59 -5.889 -9.052 -4.486 522 HB3 ASN 59 3HB ASN 59 -4.494 -9.049 -3.413 523 HD21 ASN 59 1HD2 ASN 59 -7.899 -9.863 -3.674 524 HD22 ASN 59 2HD2 ASN 59 -7.943 -10.918 -2.305 525 H ASP 60 H ASP 60 -7.663 -6.340 -1.575 526 HA ASP 60 HA ASP 60 -9.717 -6.129 -3.708 527 HB2 ASP 60 2HB ASP 60 -10.459 -7.431 -1.730 528 HB3 ASP 60 3HB ASP 60 -10.067 -6.079 -0.672 529 H LYS 61 H LYS 61 -9.384 -4.222 -4.655 530 HA LYS 61 HA LYS 61 -8.112 -2.000 -3.514 531 HB2 LYS 61 2HB LYS 61 -9.046 -0.764 -5.627 532 HB3 LYS 61 3HB LYS 61 -7.885 -2.063 -5.820 533 HG2 LYS 61 2HG LYS 61 -9.545 -2.296 -7.530 534 HG3 LYS 61 3HG LYS 61 -9.763 -3.615 -6.380 535 HD2 LYS 61 2HD LYS 61 -11.681 -2.443 -5.373 536 HD3 LYS 61 3HD LYS 61 -11.433 -1.073 -6.461 537 HE2 LYS 61 2HE LYS 61 -12.151 -3.896 -7.335 538 HE3 LYS 61 3HE LYS 61 -13.278 -2.545 -7.214 539 HZ1 LYS 61 3HZ LYS 61 -12.623 -2.774 -9.475 540 HZ2 LYS 61 1HZ LYS 61 -10.976 -2.786 -9.084 541 HZ3 LYS 61 2HZ LYS 61 -11.887 -1.374 -8.885 542 H GLN 62 H GLN 62 -11.435 -2.883 -3.159 543 HA GLN 62 HA GLN 62 -12.519 -0.259 -2.738 544 HB2 GLN 62 2HB GLN 62 -13.532 -2.977 -1.797 545 HB3 GLN 62 3HB GLN 62 -14.450 -1.475 -1.704 546 HG2 GLN 62 2HG GLN 62 -13.493 -2.806 -4.260 547 HG3 GLN 62 3HG GLN 62 -15.134 -2.874 -3.620 548 HE21 GLN 62 1HE2 GLN 62 -15.221 -0.063 -2.806 549 HE22 GLN 62 2HE2 GLN 62 -15.333 0.851 -4.263 550 H LEU 63 H LEU 63 -11.335 -2.853 -0.580 551 HA LEU 63 HA LEU 63 -11.631 -1.633 1.920 552 HB2 LEU 63 2HB LEU 63 -9.517 -3.586 0.911 553 HB3 LEU 63 3HB LEU 63 -9.619 -3.108 2.599 554 HG LEU 63 HG LEU 63 -11.867 -4.513 1.104 555 HD11 LEU 63 1HD1 LEU 63 -9.930 -5.998 1.233 556 HD12 LEU 63 2HD1 LEU 63 -11.227 -6.556 2.287 557 HD13 LEU 63 3HD1 LEU 63 -9.824 -5.737 2.977 558 HD21 LEU 63 3HD2 LEU 63 -12.801 -4.906 3.335 559 HD22 LEU 63 1HD2 LEU 63 -12.636 -3.183 3.006 560 HD23 LEU 63 2HD2 LEU 63 -11.479 -3.992 4.067 561 H LEU 64 H LEU 64 -9.122 -1.212 -0.523 562 HA LEU 64 HA LEU 64 -7.189 0.180 0.998 563 HB2 LEU 64 2HB LEU 64 -7.768 -0.035 -1.955 564 HB3 LEU 64 3HB LEU 64 -6.579 1.128 -1.397 565 HG LEU 64 HG LEU 64 -5.290 -0.733 -0.351 566 HD11 LEU 64 1HD1 LEU 64 -7.061 -2.373 -0.041 567 HD12 LEU 64 2HD1 LEU 64 -5.725 -3.044 -0.973 568 HD13 LEU 64 3HD1 LEU 64 -7.213 -2.556 -1.790 569 HD21 LEU 64 3HD2 LEU 64 -4.764 0.182 -2.577 570 HD22 LEU 64 1HD2 LEU 64 -5.747 -1.090 -3.313 571 HD23 LEU 64 2HD2 LEU 64 -4.297 -1.506 -2.382 572 H LYS 65 H LYS 65 -9.740 1.378 -1.206 573 HA LYS 65 HA LYS 65 -9.086 4.095 -1.057 574 HB2 LYS 65 2HB LYS 65 -10.602 2.759 -2.712 575 HB3 LYS 65 3HB LYS 65 -11.892 3.046 -1.548 576 HG2 LYS 65 2HG LYS 65 -11.547 5.494 -1.803 577 HG3 LYS 65 3HG LYS 65 -10.262 5.172 -2.972 578 HD2 LYS 65 2HD LYS 65 -12.233 5.695 -4.217 579 HD3 LYS 65 3HD LYS 65 -11.961 3.968 -4.403 580 HE2 LYS 65 2HE LYS 65 -14.342 4.430 -4.041 581 HE3 LYS 65 3HE LYS 65 -13.692 3.532 -2.668 582 HZ1 LYS 65 3HZ LYS 65 -13.544 5.593 -1.424 583 HZ2 LYS 65 1HZ LYS 65 -15.127 5.368 -1.978 584 HZ3 LYS 65 2HZ LYS 65 -14.109 6.480 -2.747 585 H GLU 66 H GLU 66 -11.470 2.124 0.686 586 HA GLU 66 HA GLU 66 -12.633 4.154 2.290 587 HB2 GLU 66 2HB GLU 66 -12.483 1.141 2.733 588 HB3 GLU 66 3HB GLU 66 -13.583 2.237 3.575 589 HG2 GLU 66 2HG GLU 66 -14.707 2.771 1.478 590 HG3 GLU 66 3HG GLU 66 -13.558 1.795 0.573 591 H MET 67 H MET 67 -9.906 1.959 2.800 592 HA MET 67 HA MET 67 -9.297 2.410 5.507 593 HB2 MET 67 2HB MET 67 -8.261 0.642 4.099 594 HB3 MET 67 3HB MET 67 -7.420 1.864 3.165 595 HG2 MET 67 2HG MET 67 -6.194 2.503 5.282 596 HG3 MET 67 3HG MET 67 -6.926 1.091 6.048 597 HE1 MET 67 3HE MET 67 -6.638 -1.442 4.848 598 HE2 MET 67 1HE MET 67 -5.477 -1.727 3.552 599 HE3 MET 67 2HE MET 67 -6.928 -0.775 3.240 600 H LEU 68 H LEU 68 -8.100 3.989 2.558 601 HA LEU 68 HA LEU 68 -6.307 5.790 3.814 602 HB2 LEU 68 2HB LEU 68 -7.538 5.760 1.034 603 HB3 LEU 68 3HB LEU 68 -6.263 6.871 1.517 604 HG LEU 68 HG LEU 68 -5.981 3.836 1.538 605 HD11 LEU 68 1HD1 LEU 68 -4.556 4.076 -0.424 606 HD12 LEU 68 2HD1 LEU 68 -4.907 5.807 -0.488 607 HD13 LEU 68 3HD1 LEU 68 -6.196 4.628 -0.754 608 HD21 LEU 68 3HD2 LEU 68 -3.903 6.011 1.931 609 HD22 LEU 68 1HD2 LEU 68 -3.589 4.274 1.849 610 HD23 LEU 68 2HD2 LEU 68 -4.537 4.932 3.176 611 H GLU 69 H GLU 69 -9.700 6.061 2.882 612 HA GLU 69 HA GLU 69 -10.018 8.858 3.337 613 HB2 GLU 69 2HB GLU 69 -12.023 6.566 3.335 614 HB3 GLU 69 3HB GLU 69 -12.491 8.261 3.478 615 HG2 GLU 69 2HG GLU 69 -11.588 8.756 1.272 616 HG3 GLU 69 3HG GLU 69 -10.939 7.122 1.129 617 H LEU 70 H LEU 70 -10.079 6.045 5.474 618 HA LEU 70 HA LEU 70 -10.911 7.578 7.814 619 HB2 LEU 70 2HB LEU 70 -9.881 4.728 7.571 620 HB3 LEU 70 3HB LEU 70 -10.523 5.444 9.043 621 HG LEU 70 HG LEU 70 -12.108 4.954 6.489 622 HD11 LEU 70 1HD1 LEU 70 -12.219 3.469 9.130 623 HD12 LEU 70 2HD1 LEU 70 -11.525 2.865 7.623 624 HD13 LEU 70 3HD1 LEU 70 -13.253 3.188 7.723 625 HD21 LEU 70 3HD2 LEU 70 -14.088 5.584 7.802 626 HD22 LEU 70 1HD2 LEU 70 -12.946 6.920 7.688 627 HD23 LEU 70 2HD2 LEU 70 -13.064 5.987 9.184 628 H ILE 71 H ILE 71 -7.895 6.543 6.323 629 HA ILE 71 HA ILE 71 -6.125 7.165 8.488 630 HB ILE 71 HB ILE 71 -5.646 6.864 5.485 631 HG12 ILE 71 2HG1 ILE 71 -4.890 5.097 7.855 632 HG13 ILE 71 3HG1 ILE 71 -6.173 4.777 6.697 633 HG21 ILE 71 1HG2 ILE 71 -3.204 6.899 5.913 634 HG22 ILE 71 2HG2 ILE 71 -3.509 7.351 7.590 635 HG23 ILE 71 3HG2 ILE 71 -3.955 8.449 6.283 636 HD11 ILE 71 3HD1 ILE 71 -4.254 3.391 6.252 637 HD12 ILE 71 1HD1 ILE 71 -3.210 4.806 6.114 638 HD13 ILE 71 2HD1 ILE 71 -4.487 4.527 4.926 639 H SER 72 H SER 72 -7.817 9.059 6.112 640 HA SER 72 HA SER 72 -6.327 11.433 6.069 641 HB2 SER 72 2HB SER 72 -9.347 11.112 5.837 642 HB3 SER 72 3HB SER 72 -8.403 12.504 5.285 643 HG SER 72 HG SER 72 -7.383 10.213 4.286 644 H LYS 73 H LYS 73 -8.280 10.082 8.585 645 HA LYS 73 HA LYS 73 -8.639 12.493 10.140 646 HB2 LYS 73 2HB LYS 73 -8.930 9.563 10.952 647 HB3 LYS 73 3HB LYS 73 -9.515 10.948 11.873 648 HG2 LYS 73 2HG LYS 73 -10.494 10.078 9.132 649 HG3 LYS 73 3HG LYS 73 -11.345 9.844 10.663 650 HD2 LYS 73 2HD LYS 73 -11.537 12.303 10.935 651 HD3 LYS 73 3HD LYS 73 -10.661 12.545 9.421 652 HE2 LYS 73 2HE LYS 73 -12.471 11.467 8.173 653 HE3 LYS 73 3HE LYS 73 -13.335 11.128 9.675 654 HZ1 LYS 73 3HZ LYS 73 -12.691 13.827 8.622 655 HZ2 LYS 73 1HZ LYS 73 -13.527 13.507 10.054 656 HZ3 LYS 73 2HZ LYS 73 -14.208 13.087 8.564 657 H LEU 74 H LEU 74 -6.238 9.996 9.839 658 HA LEU 74 HA LEU 74 -4.900 10.521 12.373 659 HB2 LEU 74 2HB LEU 74 -4.109 8.711 10.055 660 HB3 LEU 74 3HB LEU 74 -3.394 8.701 11.662 661 HG LEU 74 HG LEU 74 -6.299 7.994 11.072 662 HD11 LEU 74 1HD1 LEU 74 -4.819 6.333 10.078 663 HD12 LEU 74 2HD1 LEU 74 -5.689 5.665 11.455 664 HD13 LEU 74 3HD1 LEU 74 -3.989 6.115 11.622 665 HD21 LEU 74 3HD2 LEU 74 -6.340 7.131 13.378 666 HD22 LEU 74 1HD2 LEU 74 -6.001 8.859 13.336 667 HD23 LEU 74 2HD2 LEU 74 -4.692 7.711 13.635 668 H GLY 75 H GLY 75 -4.092 10.778 8.897 669 HA2 GLY 75 2HA GLY 75 -3.050 12.467 7.746 670 HA3 GLY 75 3HA GLY 75 -2.794 13.323 9.255 671 H TYR 76 H TYR 76 -1.571 10.648 7.246 672 HA TYR 76 HA TYR 76 1.143 11.558 7.692 673 HB2 TYR 76 2HB TYR 76 2.045 9.281 8.259 674 HB3 TYR 76 3HB TYR 76 1.069 9.987 9.526 675 HD1 TYR 76 HD2 TYR 76 1.210 7.286 6.997 676 HD2 TYR 76 HD1 TYR 76 -1.032 8.950 10.235 677 HE1 TYR 76 HE2 TYR 76 -0.091 5.214 7.165 678 HE2 TYR 76 HE1 TYR 76 -2.320 6.868 10.404 679 HH TYR 76 HH TYR 76 -2.944 4.950 8.915 680 H LYS 77 H LYS 77 2.706 10.334 6.337 681 HA LYS 77 HA LYS 77 1.814 10.251 3.618 682 HB2 LYS 77 2HB LYS 77 4.041 11.125 4.220 683 HB3 LYS 77 3HB LYS 77 4.498 9.562 4.878 684 HG2 LYS 77 2HG LYS 77 5.563 9.767 2.747 685 HG3 LYS 77 3HG LYS 77 4.263 8.587 2.559 686 HD2 LYS 77 2HD LYS 77 2.837 10.332 1.522 687 HD3 LYS 77 3HD LYS 77 4.134 11.512 1.729 688 HE2 LYS 77 2HE LYS 77 5.576 10.139 0.237 689 HE3 LYS 77 3HE LYS 77 4.228 9.027 -0.010 690 HZ1 LYS 77 3HZ LYS 77 4.281 11.903 -0.759 691 HZ2 LYS 77 1HZ LYS 77 2.962 10.863 -0.961 692 HZ3 LYS 77 2HZ LYS 77 4.392 10.589 -1.822 693 H VAL 78 H VAL 78 0.649 8.544 2.944 694 HA VAL 78 HA VAL 78 1.569 5.793 3.534 695 HB VAL 78 HB VAL 78 -1.112 6.580 2.292 696 HG11 VAL 78 1HG1 VAL 78 -0.152 3.948 3.490 697 HG12 VAL 78 2HG1 VAL 78 -0.392 4.276 1.773 698 HG13 VAL 78 3HG1 VAL 78 -1.776 4.254 2.867 699 HG21 VAL 78 3HG2 VAL 78 -2.141 6.155 4.492 700 HG22 VAL 78 1HG2 VAL 78 -0.989 7.491 4.576 701 HG23 VAL 78 2HG2 VAL 78 -0.542 5.900 5.196 702 H PHE 79 H PHE 79 2.182 4.513 1.894 703 HA PHE 79 HA PHE 79 2.441 5.599 -0.831 704 HB2 PHE 79 2HB PHE 79 3.901 3.288 0.537 705 HB3 PHE 79 3HB PHE 79 4.212 3.860 -1.100 706 HD1 PHE 79 HD1 PHE 79 5.232 6.122 -1.453 707 HD2 PHE 79 HD2 PHE 79 4.879 4.425 2.458 708 HE1 PHE 79 HE1 PHE 79 6.865 7.733 -0.599 709 HE2 PHE 79 HE2 PHE 79 6.521 6.050 3.298 710 HZ PHE 79 HZ PHE 79 7.514 7.706 1.773 711 H LEU 80 H LEU 80 1.599 4.369 -2.560 712 HA LEU 80 HA LEU 80 0.373 1.756 -1.989 713 HB2 LEU 80 2HB LEU 80 -1.468 3.334 -1.751 714 HB3 LEU 80 3HB LEU 80 -1.072 4.110 -3.273 715 HG LEU 80 HG LEU 80 -1.821 2.132 -4.535 716 HD11 LEU 80 1HD1 LEU 80 -1.135 0.378 -2.973 717 HD12 LEU 80 2HD1 LEU 80 -2.809 0.182 -3.472 718 HD13 LEU 80 3HD1 LEU 80 -2.440 0.831 -1.872 719 HD21 LEU 80 3HD2 LEU 80 -3.518 3.808 -3.957 720 HD22 LEU 80 1HD2 LEU 80 -3.892 2.937 -2.466 721 HD23 LEU 80 2HD2 LEU 80 -4.219 2.193 -4.035 722 H LEU 81 H LEU 81 0.531 0.333 -3.592 723 HA LEU 81 HA LEU 81 1.520 1.145 -6.257 724 HB2 LEU 81 2HB LEU 81 3.328 0.176 -4.806 725 HB3 LEU 81 3HB LEU 81 2.389 -1.296 -4.661 726 HG LEU 81 HG LEU 81 2.614 -1.659 -7.131 727 HD11 LEU 81 1HD1 LEU 81 4.398 0.788 -7.043 728 HD12 LEU 81 2HD1 LEU 81 2.855 0.629 -7.887 729 HD13 LEU 81 3HD1 LEU 81 4.242 -0.320 -8.410 730 HD21 LEU 81 3HD2 LEU 81 4.973 -2.320 -7.110 731 HD22 LEU 81 1HD2 LEU 81 4.182 -2.738 -5.593 732 HD23 LEU 81 2HD2 LEU 81 5.253 -1.336 -5.672 733 H LEU 82 H LEU 82 0.477 0.186 -7.914 734 HA LEU 82 HA LEU 82 -1.609 -1.861 -7.403 735 HB2 LEU 82 2HB LEU 82 -1.656 0.449 -9.400 736 HB3 LEU 82 3HB LEU 82 -2.929 -0.740 -9.188 737 HG LEU 82 HG LEU 82 -2.111 1.344 -7.119 738 HD11 LEU 82 1HD1 LEU 82 -4.557 1.270 -8.912 739 HD12 LEU 82 2HD1 LEU 82 -3.194 2.385 -9.040 740 HD13 LEU 82 3HD1 LEU 82 -4.242 2.442 -7.626 741 HD21 LEU 82 3HD2 LEU 82 -4.405 -0.648 -7.064 742 HD22 LEU 82 1HD2 LEU 82 -4.128 0.645 -5.890 743 HD23 LEU 82 2HD2 LEU 82 -2.968 -0.671 -6.037 744 H ALA 83 H ALA 83 -0.831 -3.736 -8.333 745 HA ALA 83 HA ALA 83 0.470 -3.574 -11.005 746 HB1 ALA 83 3HB ALA 83 1.996 -5.378 -10.377 747 HB2 ALA 83 1HB ALA 83 1.283 -5.453 -8.765 748 HB3 ALA 83 2HB ALA 83 2.166 -4.015 -9.270 749 H ASP 84 H ASP 84 -0.895 -4.410 -12.413 750 HA ASP 84 HA ASP 84 -1.739 -7.116 -12.366 751 HB2 ASP 84 2HB ASP 84 -3.444 -6.383 -10.766 752 HB3 ASP 84 3HB ASP 84 -3.898 -5.031 -11.795 753 H GLN 85 H GLN 85 -2.827 -7.731 -14.314 754 HA GLN 85 HA GLN 85 -1.819 -6.340 -16.591 755 HB2 GLN 85 2HB GLN 85 -1.945 -8.838 -16.304 756 HB3 GLN 85 3HB GLN 85 -3.689 -8.742 -16.514 757 HG2 GLN 85 2HG GLN 85 -3.427 -8.008 -18.814 758 HG3 GLN 85 3HG GLN 85 -1.687 -7.828 -18.609 759 HE21 GLN 85 1HE2 GLN 85 -0.383 -9.717 -18.479 760 HE22 GLN 85 2HE2 GLN 85 -0.959 -11.248 -19.037 761 H ASP 86 H ASP 86 -4.985 -6.459 -15.005 762 HA ASP 86 HA ASP 86 -6.218 -4.787 -17.074 763 HB2 ASP 86 2HB ASP 86 -7.526 -6.498 -15.577 764 HB3 ASP 86 3HB ASP 86 -7.413 -5.287 -14.311 765 H GLU 87 H GLU 87 -4.285 -3.438 -16.822 766 HA GLU 87 HA GLU 87 -3.924 -1.721 -14.568 767 HB2 GLU 87 2HB GLU 87 -2.319 -0.526 -16.083 768 HB3 GLU 87 3HB GLU 87 -2.011 -2.235 -15.878 769 HG2 GLU 87 2HG GLU 87 -1.601 -1.916 -18.145 770 HG3 GLU 87 3HG GLU 87 -3.247 -2.539 -18.140 771 H ASN 88 H ASN 88 -6.073 -1.760 -17.158 772 HA ASN 88 HA ASN 88 -6.806 0.901 -17.548 773 HB2 ASN 88 2HB ASN 88 -7.637 -0.955 -18.927 774 HB3 ASN 88 3HB ASN 88 -8.499 -1.637 -17.553 775 HD21 ASN 88 1HD2 ASN 88 -10.466 -1.580 -18.598 776 HD22 ASN 88 2HD2 ASN 88 -11.322 -0.114 -18.918 777 H GLU 89 H GLU 89 -8.170 -1.481 -15.186 778 HA GLU 89 HA GLU 89 -9.811 0.486 -13.887 779 HB2 GLU 89 2HB GLU 89 -10.415 -1.206 -12.296 780 HB3 GLU 89 3HB GLU 89 -10.398 -1.931 -13.896 781 HG2 GLU 89 2HG GLU 89 -8.377 -3.135 -13.441 782 HG3 GLU 89 3HG GLU 89 -8.077 -2.220 -11.960 783 H LEU 90 H LEU 90 -6.536 -0.703 -13.356 784 HA LEU 90 HA LEU 90 -6.120 0.400 -10.763 785 HB2 LEU 90 2HB LEU 90 -4.065 -0.090 -12.957 786 HB3 LEU 90 3HB LEU 90 -3.703 0.201 -11.259 787 HG LEU 90 HG LEU 90 -5.083 -2.248 -12.422 788 HD11 LEU 90 1HD1 LEU 90 -3.072 -3.433 -11.621 789 HD12 LEU 90 2HD1 LEU 90 -2.358 -1.890 -11.154 790 HD13 LEU 90 3HD1 LEU 90 -2.707 -2.228 -12.852 791 HD21 LEU 90 3HD2 LEU 90 -6.075 -1.744 -10.237 792 HD22 LEU 90 1HD2 LEU 90 -4.470 -1.642 -9.504 793 HD23 LEU 90 2HD2 LEU 90 -5.062 -3.181 -10.138 794 H GLU 91 H GLU 91 -5.825 1.671 -14.039 795 HA GLU 91 HA GLU 91 -4.540 4.134 -13.367 796 HB2 GLU 91 2HB GLU 91 -4.514 3.059 -15.663 797 HB3 GLU 91 3HB GLU 91 -6.204 3.509 -15.842 798 HG2 GLU 91 2HG GLU 91 -4.878 5.140 -17.022 799 HG3 GLU 91 3HG GLU 91 -5.538 5.921 -15.589 800 H GLU 92 H GLU 92 -7.867 3.022 -13.534 801 HA GLU 92 HA GLU 92 -9.074 5.633 -13.252 802 HB2 GLU 92 2HB GLU 92 -10.007 3.212 -14.151 803 HB3 GLU 92 3HB GLU 92 -10.611 3.146 -12.506 804 HG2 GLU 92 2HG GLU 92 -11.206 5.340 -14.515 805 HG3 GLU 92 3HG GLU 92 -12.272 3.990 -14.145 806 H PHE 93 H PHE 93 -8.171 2.961 -11.132 807 HA PHE 93 HA PHE 93 -9.432 3.905 -8.771 808 HB2 PHE 93 2HB PHE 93 -8.820 1.531 -9.053 809 HB3 PHE 93 3HB PHE 93 -7.108 1.951 -9.031 810 HD1 PHE 93 HD1 PHE 93 -10.162 2.592 -6.909 811 HD2 PHE 93 HD2 PHE 93 -6.012 1.540 -6.984 812 HE1 PHE 93 HE1 PHE 93 -10.149 2.415 -4.460 813 HE2 PHE 93 HE2 PHE 93 -6.015 1.367 -4.538 814 HZ PHE 93 HZ PHE 93 -8.077 1.808 -3.272 815 H LYS 94 H LYS 94 -6.118 4.276 -10.014 816 HA LYS 94 HA LYS 94 -4.986 5.481 -7.732 817 HB2 LYS 94 2HB LYS 94 -3.130 6.166 -9.194 818 HB3 LYS 94 3HB LYS 94 -3.600 4.506 -9.495 819 HG2 LYS 94 2HG LYS 94 -3.284 5.239 -11.655 820 HG3 LYS 94 3HG LYS 94 -5.006 5.538 -11.465 821 HD2 LYS 94 2HD LYS 94 -4.077 7.451 -12.561 822 HD3 LYS 94 3HD LYS 94 -4.435 7.953 -10.907 823 HE2 LYS 94 2HE LYS 94 -2.255 8.817 -11.603 824 HE3 LYS 94 3HE LYS 94 -2.033 7.619 -10.325 825 HZ1 LYS 94 3HZ LYS 94 -1.395 5.996 -11.952 826 HZ2 LYS 94 1HZ LYS 94 -0.463 7.381 -12.199 827 HZ3 LYS 94 2HZ LYS 94 -1.760 7.035 -13.233 828 H ARG 95 H ARG 95 -7.077 6.738 -10.184 829 HA ARG 95 HA ARG 95 -6.451 9.478 -10.110 830 HB2 ARG 95 2HB ARG 95 -9.069 8.069 -10.778 831 HB3 ARG 95 3HB ARG 95 -8.779 9.782 -11.072 832 HG2 ARG 95 2HG ARG 95 -6.982 7.666 -12.263 833 HG3 ARG 95 3HG ARG 95 -8.506 8.089 -13.032 834 HD2 ARG 95 2HD ARG 95 -6.535 9.253 -14.009 835 HD3 ARG 95 3HD ARG 95 -7.760 10.357 -13.403 836 HE ARG 95 HE ARG 95 -5.263 9.736 -11.922 837 HH11 ARG 95 1HH1 ARG 95 -7.579 12.103 -13.111 838 HH12 ARG 95 2HH1 ARG 95 -6.781 13.442 -12.351 839 HH21 ARG 95 1HH2 ARG 95 -4.235 11.528 -10.918 840 HH22 ARG 95 2HH2 ARG 95 -4.902 13.113 -11.119 841 H LYS 96 H LYS 96 -8.687 7.533 -8.095 842 HA LYS 96 HA LYS 96 -9.793 9.749 -6.659 843 HB2 LYS 96 2HB LYS 96 -9.580 6.894 -5.590 844 HB3 LYS 96 3HB LYS 96 -10.635 8.165 -4.993 845 HG2 LYS 96 2HG LYS 96 -12.157 6.943 -6.204 846 HG3 LYS 96 3HG LYS 96 -11.625 8.065 -7.460 847 HD2 LYS 96 2HD LYS 96 -10.072 6.386 -8.342 848 HD3 LYS 96 3HD LYS 96 -10.498 5.269 -7.042 849 HE2 LYS 96 2HE LYS 96 -11.643 4.605 -9.059 850 HE3 LYS 96 3HE LYS 96 -12.837 5.228 -7.922 851 HZ1 LYS 96 3HZ LYS 96 -12.801 7.334 -9.130 852 HZ2 LYS 96 1HZ LYS 96 -13.235 6.051 -10.143 853 HZ3 LYS 96 2HZ LYS 96 -11.679 6.703 -10.226 854 H ILE 97 H ILE 97 -7.215 7.428 -5.998 855 HA ILE 97 HA ILE 97 -6.688 8.142 -3.321 856 HB ILE 97 HB ILE 97 -4.817 6.746 -5.291 857 HG12 ILE 97 2HG1 ILE 97 -6.951 5.561 -5.312 858 HG13 ILE 97 3HG1 ILE 97 -5.797 4.591 -4.408 859 HG21 ILE 97 1HG2 ILE 97 -4.883 6.662 -2.252 860 HG22 ILE 97 2HG2 ILE 97 -3.643 7.411 -3.259 861 HG23 ILE 97 3HG2 ILE 97 -3.846 5.659 -3.274 862 HD11 ILE 97 3HD1 ILE 97 -7.942 4.530 -3.342 863 HD12 ILE 97 1HD1 ILE 97 -8.019 6.289 -3.274 864 HD13 ILE 97 2HD1 ILE 97 -6.828 5.419 -2.306 865 H GLU 98 H GLU 98 -5.233 9.108 -6.370 866 HA GLU 98 HA GLU 98 -3.065 10.646 -5.354 867 HB2 GLU 98 2HB GLU 98 -3.265 9.569 -7.641 868 HB3 GLU 98 3HB GLU 98 -4.408 10.827 -8.083 869 HG2 GLU 98 2HG GLU 98 -2.725 12.513 -8.045 870 HG3 GLU 98 3HG GLU 98 -1.594 11.472 -7.175 871 H SER 99 H SER 99 -6.420 11.342 -6.202 872 HA SER 99 HA SER 99 -6.267 14.200 -5.850 873 HB2 SER 99 2HB SER 99 -8.667 12.323 -5.970 874 HB3 SER 99 3HB SER 99 -8.774 14.085 -5.944 875 HG SER 99 HG SER 99 -7.289 12.664 -7.895 876 H GLN 100 H GLN 100 -6.879 11.441 -3.758 877 HA GLN 100 HA GLN 100 -7.857 12.891 -1.478 878 HB2 GLN 100 2HB GLN 100 -6.634 10.104 -1.710 879 HB3 GLN 100 3HB GLN 100 -7.328 10.752 -0.228 880 HG2 GLN 100 2HG GLN 100 -9.534 10.899 -1.312 881 HG3 GLN 100 3HG GLN 100 -8.850 10.273 -2.809 882 HE21 GLN 100 1HE2 GLN 100 -8.086 9.093 0.460 883 HE22 GLN 100 2HE2 GLN 100 -8.784 7.529 0.240 884 H GLY 101 H GLY 101 -4.781 12.573 -2.901 885 HA2 GLY 101 2HA GLY 101 -2.850 13.721 -2.346 886 HA3 GLY 101 3HA GLY 101 -3.511 14.081 -0.756 887 H TYR 102 H TYR 102 -3.406 10.855 -2.123 888 HA TYR 102 HA TYR 102 -1.255 10.076 -0.240 889 HB2 TYR 102 2HB TYR 102 -3.582 8.438 -1.329 890 HB3 TYR 102 3HB TYR 102 -2.220 7.725 -0.465 891 HD1 TYR 102 HD2 TYR 102 -1.693 8.725 1.887 892 HD2 TYR 102 HD1 TYR 102 -5.465 9.149 -0.080 893 HE1 TYR 102 HE2 TYR 102 -2.760 9.197 4.037 894 HE2 TYR 102 HE1 TYR 102 -6.535 9.625 2.075 895 HH TYR 102 HH TYR 102 -4.721 10.269 4.910 896 H GLU 103 H GLU 103 0.397 8.807 -0.948 897 HA GLU 103 HA GLU 103 1.248 9.092 -3.645 898 HB2 GLU 103 2HB GLU 103 2.771 8.939 -1.646 899 HB3 GLU 103 3HB GLU 103 2.341 7.247 -1.481 900 HG2 GLU 103 2HG GLU 103 4.472 7.340 -2.559 901 HG3 GLU 103 3HG GLU 103 3.298 6.854 -3.784 902 H VAL 104 H VAL 104 0.584 7.878 -5.304 903 HA VAL 104 HA VAL 104 0.029 5.014 -4.948 904 HB VAL 104 HB VAL 104 -2.173 6.102 -4.833 905 HG11 VAL 104 1HG1 VAL 104 -1.727 8.169 -6.081 906 HG12 VAL 104 2HG1 VAL 104 -3.150 7.343 -6.718 907 HG13 VAL 104 3HG1 VAL 104 -1.617 7.252 -7.589 908 HG21 VAL 104 3HG2 VAL 104 -1.784 4.599 -7.447 909 HG22 VAL 104 1HG2 VAL 104 -3.316 4.808 -6.593 910 HG23 VAL 104 2HG2 VAL 104 -2.016 3.872 -5.856 911 H ARG 105 H ARG 105 0.748 3.791 -6.600 912 HA ARG 105 HA ARG 105 1.942 5.102 -8.960 913 HB2 ARG 105 2HB ARG 105 3.285 3.081 -7.102 914 HB3 ARG 105 3HB ARG 105 3.939 3.571 -8.666 915 HG2 ARG 105 2HG ARG 105 3.441 5.435 -6.310 916 HG3 ARG 105 3HG ARG 105 5.009 4.776 -6.782 917 HD2 ARG 105 2HD ARG 105 5.051 6.034 -8.799 918 HD3 ARG 105 3HD ARG 105 3.334 6.422 -8.697 919 HE ARG 105 HE ARG 105 4.245 7.605 -6.500 920 HH11 ARG 105 1HH1 ARG 105 5.534 7.723 -9.780 921 HH12 ARG 105 2HH1 ARG 105 6.170 9.328 -9.589 922 HH21 ARG 105 1HH2 ARG 105 4.984 9.731 -6.320 923 HH22 ARG 105 2HH2 ARG 105 5.852 10.459 -7.632 924 H LYS 106 H LYS 106 1.202 4.226 -10.723 925 HA LYS 106 HA LYS 106 -0.208 1.656 -10.691 926 HB2 LYS 106 2HB LYS 106 -1.528 3.495 -11.522 927 HB3 LYS 106 3HB LYS 106 -0.234 4.066 -12.562 928 HG2 LYS 106 2HG LYS 106 -1.395 1.338 -13.089 929 HG3 LYS 106 3HG LYS 106 -2.346 2.754 -13.547 930 HD2 LYS 106 2HD LYS 106 -0.508 3.557 -14.976 931 HD3 LYS 106 3HD LYS 106 0.515 2.215 -14.463 932 HE2 LYS 106 2HE LYS 106 -0.385 1.779 -16.668 933 HE3 LYS 106 3HE LYS 106 -1.073 0.637 -15.514 934 HZ1 LYS 106 3HZ LYS 106 -2.722 1.533 -17.057 935 HZ2 LYS 106 1HZ LYS 106 -2.422 3.098 -16.496 936 HZ3 LYS 106 2HZ LYS 106 -3.092 1.941 -15.459 937 H VAL 107 H VAL 107 0.853 -0.067 -11.368 938 HA VAL 107 HA VAL 107 2.741 -0.002 -13.629 939 HB VAL 107 HB VAL 107 4.313 -1.547 -12.499 940 HG11 VAL 107 1HG1 VAL 107 5.381 -0.001 -10.908 941 HG12 VAL 107 2HG1 VAL 107 3.905 0.966 -10.841 942 HG13 VAL 107 3HG1 VAL 107 4.818 0.854 -12.348 943 HG21 VAL 107 3HG2 VAL 107 4.162 -2.006 -10.064 944 HG22 VAL 107 1HG2 VAL 107 2.794 -2.675 -10.956 945 HG23 VAL 107 2HG2 VAL 107 2.596 -1.193 -10.018 946 H THR 108 H THR 108 3.324 -2.586 -13.947 947 HA THR 108 HA THR 108 0.896 -4.259 -13.719 948 HB THR 108 HB THR 108 1.301 -5.066 -16.106 949 HG1 THR 108 HG1 THR 108 3.092 -2.835 -16.121 950 HG21 THR 108 3HG2 THR 108 -0.499 -3.427 -15.681 951 HG22 THR 108 1HG2 THR 108 0.250 -3.167 -17.259 952 HG23 THR 108 2HG2 THR 108 0.650 -2.106 -15.908 953 H ASP 109 H ASP 109 4.278 -4.082 -14.763 954 HA ASP 109 HA ASP 109 4.642 -6.911 -14.900 955 HB2 ASP 109 2HB ASP 109 5.718 -5.411 -16.496 956 HB3 ASP 109 3HB ASP 109 6.563 -4.573 -15.208 957 H ASP 110 H ASP 110 6.380 -8.074 -13.845 958 HA ASP 110 HA ASP 110 6.131 -8.156 -11.060 959 HB2 ASP 110 2HB ASP 110 6.653 -10.125 -12.430 960 HB3 ASP 110 3HB ASP 110 8.173 -9.411 -12.944 961 H GLU 111 H GLU 111 9.046 -7.264 -13.000 962 HA GLU 111 HA GLU 111 10.475 -6.444 -10.618 963 HB2 GLU 111 2HB GLU 111 12.398 -6.119 -11.974 964 HB3 GLU 111 3HB GLU 111 11.605 -7.563 -12.586 965 HG2 GLU 111 2HG GLU 111 10.738 -6.327 -14.500 966 HG3 GLU 111 3HG GLU 111 11.382 -4.817 -13.855 967 H GLU 112 H GLU 112 8.573 -4.914 -13.087 968 HA GLU 112 HA GLU 112 9.329 -2.208 -12.685 969 HB2 GLU 112 2HB GLU 112 8.044 -2.957 -14.643 970 HB3 GLU 112 3HB GLU 112 6.696 -3.418 -13.612 971 HG2 GLU 112 2HG GLU 112 6.389 -1.030 -12.990 972 HG3 GLU 112 3HG GLU 112 7.711 -0.597 -14.074 973 H ALA 113 H ALA 113 6.988 -4.334 -11.063 974 HA ALA 113 HA ALA 113 5.968 -2.385 -9.243 975 HB1 ALA 113 3HB ALA 113 4.771 -4.484 -9.727 976 HB2 ALA 113 1HB ALA 113 5.076 -4.318 -7.995 977 HB3 ALA 113 2HB ALA 113 6.064 -5.414 -8.967 978 H LEU 114 H LEU 114 8.501 -4.886 -8.953 979 HA LEU 114 HA LEU 114 9.138 -4.562 -6.247 980 HB2 LEU 114 2HB LEU 114 10.851 -5.548 -8.551 981 HB3 LEU 114 3HB LEU 114 11.336 -5.678 -6.864 982 HG LEU 114 HG LEU 114 8.882 -7.011 -8.083 983 HD11 LEU 114 1HD1 LEU 114 10.092 -9.109 -7.861 984 HD12 LEU 114 2HD1 LEU 114 11.519 -8.254 -7.267 985 HD13 LEU 114 3HD1 LEU 114 10.956 -8.000 -8.923 986 HD21 LEU 114 3HD2 LEU 114 8.707 -8.219 -5.956 987 HD22 LEU 114 1HD2 LEU 114 8.548 -6.482 -5.712 988 HD23 LEU 114 2HD2 LEU 114 10.061 -7.295 -5.298 989 H LYS 115 H LYS 115 10.398 -2.841 -9.085 990 HA LYS 115 HA LYS 115 12.563 -1.563 -7.775 991 HB2 LYS 115 2HB LYS 115 12.776 -0.142 -9.711 992 HB3 LYS 115 3HB LYS 115 12.393 -1.767 -10.262 993 HG2 LYS 115 2HG LYS 115 10.034 -1.069 -10.616 994 HG3 LYS 115 3HG LYS 115 10.453 0.572 -10.122 995 HD2 LYS 115 2HD LYS 115 11.512 -0.923 -12.555 996 HD3 LYS 115 3HD LYS 115 10.354 0.407 -12.562 997 HE2 LYS 115 2HE LYS 115 13.254 0.615 -11.659 998 HE3 LYS 115 3HE LYS 115 12.619 1.156 -13.213 999 HZ1 LYS 115 3HZ LYS 115 12.851 2.973 -11.623 1000 HZ2 LYS 115 1HZ LYS 115 11.774 2.207 -10.569 1001 HZ3 LYS 115 2HZ LYS 115 11.237 2.752 -12.074 1002 H ILE 116 H ILE 116 9.146 -0.694 -8.177 1003 HA ILE 116 HA ILE 116 9.389 1.982 -7.186 1004 HB ILE 116 HB ILE 116 6.834 0.313 -7.219 1005 HG12 ILE 116 2HG1 ILE 116 7.888 0.329 -9.493 1006 HG13 ILE 116 3HG1 ILE 116 6.341 1.156 -9.454 1007 HG21 ILE 116 1HG2 ILE 116 5.701 2.515 -7.394 1008 HG22 ILE 116 2HG2 ILE 116 7.266 3.324 -7.281 1009 HG23 ILE 116 3HG2 ILE 116 6.657 2.383 -5.917 1010 HD11 ILE 116 3HD1 ILE 116 7.486 3.308 -9.498 1011 HD12 ILE 116 1HD1 ILE 116 7.950 2.286 -10.857 1012 HD13 ILE 116 2HD1 ILE 116 9.048 2.482 -9.493 1013 H VAL 117 H VAL 117 8.840 -1.175 -5.714 1014 HA VAL 117 HA VAL 117 8.081 -0.323 -3.100 1015 HB VAL 117 HB VAL 117 9.493 -2.907 -3.918 1016 HG11 VAL 117 1HG1 VAL 117 7.922 -2.287 -1.381 1017 HG12 VAL 117 2HG1 VAL 117 9.667 -2.527 -1.487 1018 HG13 VAL 117 3HG1 VAL 117 8.574 -3.869 -1.824 1019 HG21 VAL 117 3HG2 VAL 117 6.518 -2.357 -3.602 1020 HG22 VAL 117 1HG2 VAL 117 7.246 -3.922 -3.976 1021 HG23 VAL 117 2HG2 VAL 117 7.368 -2.595 -5.131 1022 H ARG 118 H ARG 118 11.206 -1.144 -4.599 1023 HA ARG 118 HA ARG 118 12.875 -0.611 -2.358 1024 HB2 ARG 118 2HB ARG 118 13.537 -0.515 -5.332 1025 HB3 ARG 118 3HB ARG 118 14.728 -0.489 -4.030 1026 HG2 ARG 118 2HG ARG 118 13.931 -2.738 -3.302 1027 HG3 ARG 118 3HG ARG 118 12.823 -2.763 -4.675 1028 HD2 ARG 118 2HD ARG 118 14.831 -4.058 -5.180 1029 HD3 ARG 118 3HD ARG 118 14.754 -2.633 -6.219 1030 HE ARG 118 HE ARG 118 16.270 -1.915 -4.011 1031 HH11 ARG 118 1HH1 ARG 118 16.592 -4.262 -6.626 1032 HH12 ARG 118 2HH1 ARG 118 18.323 -4.228 -6.587 1033 HH21 ARG 118 1HH2 ARG 118 18.529 -1.899 -3.976 1034 HH22 ARG 118 2HH2 ARG 118 19.421 -2.891 -5.085 1035 H GLU 119 H GLU 119 11.489 1.414 -4.877 1036 HA GLU 119 HA GLU 119 12.881 3.818 -4.243 1037 HB2 GLU 119 2HB GLU 119 10.323 3.237 -5.756 1038 HB3 GLU 119 3HB GLU 119 10.865 4.891 -5.488 1039 HG2 GLU 119 2HG GLU 119 12.903 4.495 -6.729 1040 HG3 GLU 119 3HG GLU 119 12.534 2.774 -6.873 1041 H PHE 120 H PHE 120 9.737 2.465 -3.151 1042 HA PHE 120 HA PHE 120 8.786 4.637 -1.691 1043 HB2 PHE 120 2HB PHE 120 8.433 1.661 -1.208 1044 HB3 PHE 120 3HB PHE 120 7.599 2.875 -0.243 1045 HD1 PHE 120 HD2 PHE 120 7.089 4.814 -2.683 1046 HD2 PHE 120 HD1 PHE 120 6.412 0.634 -2.035 1047 HE1 PHE 120 HE2 PHE 120 5.205 4.864 -4.261 1048 HE2 PHE 120 HE1 PHE 120 4.536 0.702 -3.605 1049 HZ PHE 120 HZ PHE 120 3.922 2.810 -4.721 1050 H MET 121 H MET 121 11.374 2.465 -0.901 1051 HA MET 121 HA MET 121 11.698 3.078 1.856 1052 HB2 MET 121 2HB MET 121 13.897 2.286 -0.098 1053 HB3 MET 121 3HB MET 121 13.897 2.071 1.650 1054 HG2 MET 121 2HG MET 121 12.151 0.619 -0.347 1055 HG3 MET 121 3HG MET 121 13.521 -0.050 0.546 1056 HE1 MET 121 3HE MET 121 10.369 -1.862 2.051 1057 HE2 MET 121 1HE MET 121 11.896 -2.071 1.194 1058 HE3 MET 121 2HE MET 121 10.526 -1.304 0.385 1059 H GLN 122 H GLN 122 13.210 4.406 -1.121 1060 HA GLN 122 HA GLN 122 14.795 6.354 0.302 1061 HB2 GLN 122 2HB GLN 122 15.700 6.996 -1.814 1062 HB3 GLN 122 3HB GLN 122 15.512 5.248 -1.865 1063 HG2 GLN 122 2HG GLN 122 13.440 5.531 -3.199 1064 HG3 GLN 122 3HG GLN 122 13.669 7.276 -3.179 1065 HE21 GLN 122 1HE2 GLN 122 15.391 8.168 -4.411 1066 HE22 GLN 122 2HE2 GLN 122 16.141 7.280 -5.690 1067 H LYS 123 H LYS 123 11.635 6.331 -1.159 1068 HA LYS 123 HA LYS 123 11.163 9.149 -1.265 1069 HB2 LYS 123 2HB LYS 123 9.414 6.686 -1.395 1070 HB3 LYS 123 3HB LYS 123 8.635 8.204 -0.993 1071 HG2 LYS 123 2HG LYS 123 8.364 7.800 -3.341 1072 HG3 LYS 123 3HG LYS 123 9.451 9.173 -3.130 1073 HD2 LYS 123 2HD LYS 123 11.379 7.803 -3.677 1074 HD3 LYS 123 3HD LYS 123 10.393 6.342 -3.677 1075 HE2 LYS 123 2HE LYS 123 10.857 7.002 -5.966 1076 HE3 LYS 123 3HE LYS 123 9.137 7.218 -5.640 1077 HZ1 LYS 123 3HZ LYS 123 9.541 9.582 -5.321 1078 HZ2 LYS 123 1HZ LYS 123 10.058 9.090 -6.852 1079 HZ3 LYS 123 2HZ LYS 123 11.186 9.369 -5.625 1080 H ALA 124 H ALA 124 10.490 6.564 1.085 1081 HA ALA 124 HA ALA 124 9.517 8.179 3.207 1082 HB1 ALA 124 3HB ALA 124 9.953 6.207 4.628 1083 HB2 ALA 124 1HB ALA 124 10.870 5.461 3.320 1084 HB3 ALA 124 2HB ALA 124 9.140 5.759 3.129 1085 H GLY 125 H GLY 125 12.690 7.796 1.938 1086 HA2 GLY 125 2HA GLY 125 14.325 8.442 4.112 1087 HA3 GLY 125 3HA GLY 125 14.670 8.797 2.430 1088 H SER 126 H SER 126 12.233 10.509 2.160 1089 HA SER 126 HA SER 126 13.362 13.010 3.029 1090 HB2 SER 126 2HB SER 126 11.400 14.038 1.943 1091 HB3 SER 126 3HB SER 126 12.101 12.809 0.890 1092 HG SER 126 HG SER 126 10.303 11.734 0.995 1093 H LEU 127 H LEU 127 10.915 10.796 4.184 1094 HA LEU 127 HA LEU 127 9.649 12.472 6.148 1095 HB2 LEU 127 2HB LEU 127 9.836 9.426 6.026 1096 HB3 LEU 127 3HB LEU 127 8.719 10.344 7.028 1097 HG LEU 127 HG LEU 127 8.691 10.311 3.984 1098 HD11 LEU 127 1HD1 LEU 127 6.686 8.926 4.170 1099 HD12 LEU 127 2HD1 LEU 127 6.852 8.881 5.927 1100 HD13 LEU 127 3HD1 LEU 127 8.074 8.125 4.900 1101 HD21 LEU 127 3HD2 LEU 127 6.726 11.528 5.959 1102 HD22 LEU 127 1HD2 LEU 127 6.512 11.445 4.206 1103 HD23 LEU 127 2HD2 LEU 127 7.815 12.411 4.886 1104 H GLU 128 H GLU 128 12.353 10.223 6.084 1105 HA GLU 128 HA GLU 128 13.026 10.245 8.840 1106 HB2 GLU 128 2HB GLU 128 13.813 8.487 7.321 1107 HB3 GLU 128 3HB GLU 128 14.684 9.664 6.349 1108 HG2 GLU 128 2HG GLU 128 16.240 8.403 7.731 1109 HG3 GLU 128 3HG GLU 128 16.222 10.094 8.229 1110 H HIS 129 H HIS 129 14.008 12.256 6.061 1111 HA HIS 129 HA HIS 129 15.894 13.807 7.667 1112 HB2 HIS 129 2HB HIS 129 15.109 14.096 4.737 1113 HB3 HIS 129 3HB HIS 129 16.379 15.013 5.544 1114 HD1 HIS 129 HD1 HIS 129 16.253 12.496 3.241 1115 HD2 HIS 129 HD2 HIS 129 18.149 12.721 6.920 1116 HE1 HIS 129 HE1 HIS 129 18.107 10.817 3.139 1117 HE2 HIS 129 HE2 HIS 129 19.066 10.799 5.465 1118 H HIS 130 H HIS 130 14.059 14.399 9.126 1119 HA HIS 130 HA HIS 130 13.295 17.179 8.436 1120 HB2 HIS 130 2HB HIS 130 11.561 15.127 9.901 1121 HB3 HIS 130 3HB HIS 130 11.287 16.859 10.041 1122 HD1 HIS 130 HD1 HIS 130 10.366 18.093 7.947 1123 HD2 HIS 130 HD2 HIS 130 10.666 13.996 7.502 1124 HE1 HIS 130 HE1 HIS 130 9.034 17.545 5.900 1125 HE2 HIS 130 HE2 HIS 130 9.433 15.086 5.544 1126 H HIS 131 H HIS 131 15.145 17.904 9.406 1127 HA HIS 131 HA HIS 131 16.440 18.799 11.010 1128 HB2 HIS 131 2HB HIS 131 14.247 19.538 11.943 1129 HB3 HIS 131 3HB HIS 131 14.169 18.079 12.915 1130 HD1 HIS 131 HD1 HIS 131 14.492 18.806 15.259 1131 HD2 HIS 131 HD2 HIS 131 17.103 20.769 12.687 1132 HE1 HIS 131 HE1 HIS 131 15.905 20.280 16.726 1133 HE2 HIS 131 HE2 HIS 131 17.552 21.363 15.156 1134 H HIS 132 H HIS 132 16.188 15.694 10.561 1135 HA HIS 132 HA HIS 132 17.523 14.669 12.969 1136 HB2 HIS 132 2HB HIS 132 16.445 13.273 10.485 1137 HB3 HIS 132 3HB HIS 132 17.411 12.433 11.692 1138 HD1 HIS 132 HD1 HIS 132 14.532 11.555 11.081 1139 HD2 HIS 132 HD2 HIS 132 15.565 14.143 14.160 1140 HE1 HIS 132 HE1 HIS 132 12.647 11.431 12.727 1141 HE2 HIS 132 HE2 HIS 132 13.381 12.874 14.652 1142 H HIS 133 H HIS 133 19.421 15.928 12.729 1143 HA HIS 133 HA HIS 133 21.208 15.641 10.481 1144 HB2 HIS 133 2HB HIS 133 22.796 16.957 11.799 1145 HB3 HIS 133 3HB HIS 133 21.196 17.674 11.978 1146 HD1 HIS 133 HD1 HIS 133 23.688 15.539 13.903 1147 HD2 HIS 133 HD2 HIS 133 20.290 17.825 14.603 1148 HE1 HIS 133 HE1 HIS 133 23.487 15.710 16.398 1149 HE2 HIS 133 HE2 HIS 133 21.337 16.952 16.784 1150 H HIS 134 H HIS 134 23.393 14.687 10.654 1151 HA HIS 134 HA HIS 134 23.678 12.510 12.666 1152 HB2 HIS 134 2HB HIS 134 24.766 12.607 9.815 1153 HB3 HIS 134 3HB HIS 134 25.147 11.351 10.989 1154 HD1 HIS 134 HD1 HIS 134 22.967 11.967 8.251 1155 HD2 HIS 134 HD2 HIS 134 22.569 10.030 11.903 1156 HE1 HIS 134 HE1 HIS 134 20.989 10.448 8.000 1157 HE2 HIS 134 HE2 HIS 134 20.904 9.148 10.150 Start of MODEL 2 1 H1 MET 1 1H MET 1 5.130 9.495 12.816 2 H2 MET 1 2H MET 1 5.798 10.896 12.146 3 H3 MET 1 3H MET 1 6.698 9.461 12.176 4 HA MET 1 HA MET 1 4.223 9.948 10.639 5 HB2 MET 1 2HB MET 1 6.187 11.089 9.682 6 HB3 MET 1 3HB MET 1 7.132 9.608 9.778 7 HG2 MET 1 2HG MET 1 6.451 9.982 7.491 8 HG3 MET 1 3HG MET 1 5.615 8.561 8.112 9 HE1 MET 1 3HE MET 1 4.777 12.464 8.644 10 HE2 MET 1 1HE MET 1 3.618 12.671 7.327 11 HE3 MET 1 2HE MET 1 5.303 12.302 6.966 12 H LYS 2 H LYS 2 3.052 8.087 10.523 13 HA LYS 2 HA LYS 2 4.337 5.475 10.839 14 HB2 LYS 2 2HB LYS 2 2.149 6.038 11.977 15 HB3 LYS 2 3HB LYS 2 1.385 6.116 10.391 16 HG2 LYS 2 2HG LYS 2 2.037 3.721 10.017 17 HG3 LYS 2 3HG LYS 2 2.671 3.669 11.662 18 HD2 LYS 2 2HD LYS 2 -0.218 4.304 10.955 19 HD3 LYS 2 3HD LYS 2 0.362 2.703 11.411 20 HE2 LYS 2 2HE LYS 2 0.537 5.165 13.179 21 HE3 LYS 2 3HE LYS 2 -0.716 3.930 13.289 22 HZ1 LYS 2 3HZ LYS 2 2.189 3.562 13.777 23 HZ2 LYS 2 1HZ LYS 2 1.071 2.294 13.702 24 HZ3 LYS 2 2HZ LYS 2 0.933 3.461 14.908 25 H ILE 3 H ILE 3 5.103 4.463 9.084 26 HA ILE 3 HA ILE 3 4.461 5.461 6.390 27 HB ILE 3 HB ILE 3 6.726 3.638 7.345 28 HG12 ILE 3 2HG1 ILE 3 6.842 6.619 6.665 29 HG13 ILE 3 3HG1 ILE 3 6.807 5.976 8.301 30 HG21 ILE 3 1HG2 ILE 3 6.367 5.024 4.655 31 HG22 ILE 3 2HG2 ILE 3 6.182 3.296 4.958 32 HG23 ILE 3 3HG2 ILE 3 7.761 4.056 5.144 33 HD11 ILE 3 3HD1 ILE 3 8.987 5.556 6.271 34 HD12 ILE 3 1HD1 ILE 3 8.949 4.860 7.893 35 HD13 ILE 3 2HD1 ILE 3 9.033 6.609 7.683 36 H LEU 4 H LEU 4 2.657 4.345 5.626 37 HA LEU 4 HA LEU 4 2.707 1.377 5.692 38 HB2 LEU 4 2HB LEU 4 0.457 3.341 5.103 39 HB3 LEU 4 3HB LEU 4 0.341 1.650 4.655 40 HG LEU 4 HG LEU 4 0.631 1.048 7.104 41 HD11 LEU 4 1HD1 LEU 4 0.188 2.780 8.794 42 HD12 LEU 4 2HD1 LEU 4 0.265 4.022 7.541 43 HD13 LEU 4 3HD1 LEU 4 1.694 3.062 7.926 44 HD21 LEU 4 3HD2 LEU 4 -1.572 1.015 6.047 45 HD22 LEU 4 1HD2 LEU 4 -1.789 2.736 6.390 46 HD23 LEU 4 2HD2 LEU 4 -1.697 1.572 7.713 47 H ILE 5 H ILE 5 2.892 0.208 3.838 48 HA ILE 5 HA ILE 5 2.718 1.593 1.226 49 HB ILE 5 HB ILE 5 4.443 -0.868 1.852 50 HG12 ILE 5 2HG1 ILE 5 5.283 1.999 1.179 51 HG13 ILE 5 3HG1 ILE 5 5.486 1.200 2.733 52 HG21 ILE 5 1HG2 ILE 5 5.213 -0.693 -0.502 53 HG22 ILE 5 2HG2 ILE 5 4.097 0.644 -0.774 54 HG23 ILE 5 3HG2 ILE 5 3.472 -0.968 -0.421 55 HD11 ILE 5 3HD1 ILE 5 7.050 -0.392 1.691 56 HD12 ILE 5 1HD1 ILE 5 7.578 1.285 1.560 57 HD13 ILE 5 2HD1 ILE 5 6.880 0.474 0.159 58 H LEU 6 H LEU 6 0.810 1.074 0.391 59 HA LEU 6 HA LEU 6 -0.591 -1.397 1.081 60 HB2 LEU 6 2HB LEU 6 -1.433 0.918 -0.726 61 HB3 LEU 6 3HB LEU 6 -2.461 -0.425 -0.245 62 HG LEU 6 HG LEU 6 -1.349 1.717 1.587 63 HD11 LEU 6 1HD1 LEU 6 -3.679 2.462 1.814 64 HD12 LEU 6 2HD1 LEU 6 -4.198 1.241 0.651 65 HD13 LEU 6 3HD1 LEU 6 -3.140 2.558 0.139 66 HD21 LEU 6 3HD2 LEU 6 -3.205 -0.569 2.282 67 HD22 LEU 6 1HD2 LEU 6 -2.706 0.739 3.359 68 HD23 LEU 6 2HD2 LEU 6 -1.515 -0.416 2.768 69 H ILE 7 H ILE 7 -0.290 -3.128 -0.111 70 HA ILE 7 HA ILE 7 0.393 -2.935 -2.989 71 HB ILE 7 HB ILE 7 0.824 -5.302 -1.088 72 HG12 ILE 7 2HG1 ILE 7 2.399 -3.450 -0.616 73 HG13 ILE 7 3HG1 ILE 7 3.241 -4.834 -1.297 74 HG21 ILE 7 1HG2 ILE 7 2.089 -6.332 -2.961 75 HG22 ILE 7 2HG2 ILE 7 1.625 -4.989 -4.010 76 HG23 ILE 7 3HG2 ILE 7 0.391 -6.080 -3.374 77 HD11 ILE 7 3HD1 ILE 7 4.098 -2.749 -2.182 78 HD12 ILE 7 1HD1 ILE 7 2.496 -2.311 -2.776 79 HD13 ILE 7 2HD1 ILE 7 3.349 -3.696 -3.466 80 H ASN 8 H ASN 8 -1.402 -3.115 -4.157 81 HA ASN 8 HA ASN 8 -3.204 -5.409 -3.624 82 HB2 ASN 8 2HB ASN 8 -4.332 -3.159 -3.223 83 HB3 ASN 8 3HB ASN 8 -4.067 -2.781 -4.919 84 HD21 ASN 8 1HD2 ASN 8 -6.550 -3.165 -3.294 85 HD22 ASN 8 2HD2 ASN 8 -7.478 -4.331 -4.165 86 H THR 9 H THR 9 -2.286 -6.804 -4.958 87 HA THR 9 HA THR 9 -2.209 -6.182 -7.833 88 HB THR 9 HB THR 9 0.109 -6.197 -7.229 89 HG1 THR 9 HG1 THR 9 -0.153 -7.318 -9.113 90 HG21 THR 9 3HG2 THR 9 -0.326 -8.845 -5.840 91 HG22 THR 9 1HG2 THR 9 0.013 -7.297 -5.057 92 HG23 THR 9 2HG2 THR 9 1.229 -8.050 -6.092 93 H ASN 10 H ASN 10 -2.926 -7.749 -9.170 94 HA ASN 10 HA ASN 10 -4.636 -9.825 -8.206 95 HB2 ASN 10 2HB ASN 10 -4.745 -8.646 -10.472 96 HB3 ASN 10 3HB ASN 10 -3.368 -9.610 -10.976 97 HD21 ASN 10 1HD2 ASN 10 -5.947 -9.509 -12.194 98 HD22 ASN 10 2HD2 ASN 10 -6.614 -11.103 -12.136 99 H ASN 11 H ASN 11 -1.284 -9.697 -9.275 100 HA ASN 11 HA ASN 11 -0.800 -12.559 -9.081 101 HB2 ASN 11 2HB ASN 11 0.323 -11.208 -10.839 102 HB3 ASN 11 3HB ASN 11 1.106 -10.228 -9.605 103 HD21 ASN 11 1HD2 ASN 11 3.155 -10.771 -10.366 104 HD22 ASN 11 2HD2 ASN 11 3.861 -12.328 -10.134 105 H ASP 12 H ASP 12 -1.133 -13.097 -6.927 106 HA ASP 12 HA ASP 12 -0.040 -11.707 -4.679 107 HB2 ASP 12 2HB ASP 12 -2.073 -13.059 -4.471 108 HB3 ASP 12 3HB ASP 12 -1.195 -14.517 -4.916 109 H GLU 13 H GLU 13 1.223 -14.111 -6.827 110 HA GLU 13 HA GLU 13 3.361 -15.192 -5.321 111 HB2 GLU 13 2HB GLU 13 3.242 -14.632 -8.317 112 HB3 GLU 13 3HB GLU 13 4.356 -15.745 -7.524 113 HG2 GLU 13 2HG GLU 13 2.539 -17.228 -6.910 114 HG3 GLU 13 3HG GLU 13 1.341 -16.067 -7.485 115 H LEU 14 H LEU 14 3.032 -12.237 -7.202 116 HA LEU 14 HA LEU 14 5.630 -11.191 -7.047 117 HB2 LEU 14 2HB LEU 14 4.038 -10.282 -8.583 118 HB3 LEU 14 3HB LEU 14 2.891 -9.928 -7.309 119 HG LEU 14 HG LEU 14 4.307 -8.081 -6.507 120 HD11 LEU 14 1HD1 LEU 14 6.527 -8.892 -7.049 121 HD12 LEU 14 2HD1 LEU 14 6.273 -7.315 -7.788 122 HD13 LEU 14 3HD1 LEU 14 6.190 -8.774 -8.776 123 HD21 LEU 14 3HD2 LEU 14 3.753 -7.900 -9.486 124 HD22 LEU 14 1HD2 LEU 14 3.935 -6.546 -8.371 125 HD23 LEU 14 2HD2 LEU 14 2.571 -7.645 -8.199 126 H ILE 15 H ILE 15 2.975 -11.118 -4.694 127 HA ILE 15 HA ILE 15 4.009 -9.090 -2.992 128 HB ILE 15 HB ILE 15 2.037 -11.332 -2.325 129 HG12 ILE 15 2HG1 ILE 15 1.641 -8.445 -3.219 130 HG13 ILE 15 3HG1 ILE 15 1.298 -9.882 -4.170 131 HG21 ILE 15 1HG2 ILE 15 3.025 -10.392 -0.249 132 HG22 ILE 15 2HG2 ILE 15 1.324 -9.954 -0.405 133 HG23 ILE 15 3HG2 ILE 15 2.575 -8.765 -0.771 134 HD11 ILE 15 3HD1 ILE 15 -0.149 -8.953 -1.711 135 HD12 ILE 15 1HD1 ILE 15 -0.476 -10.463 -2.566 136 HD13 ILE 15 2HD1 ILE 15 -0.724 -8.916 -3.375 137 H LYS 16 H LYS 16 4.574 -12.575 -3.173 138 HA LYS 16 HA LYS 16 5.853 -13.006 -0.687 139 HB2 LYS 16 2HB LYS 16 6.776 -14.399 -3.231 140 HB3 LYS 16 3HB LYS 16 6.736 -15.039 -1.596 141 HG2 LYS 16 2HG LYS 16 4.383 -14.543 -3.420 142 HG3 LYS 16 3HG LYS 16 5.049 -16.108 -2.960 143 HD2 LYS 16 2HD LYS 16 4.325 -15.702 -0.612 144 HD3 LYS 16 3HD LYS 16 3.647 -14.142 -1.103 145 HE2 LYS 16 2HE LYS 16 2.155 -15.366 -2.708 146 HE3 LYS 16 3HE LYS 16 2.764 -16.889 -2.056 147 HZ1 LYS 16 3HZ LYS 16 0.682 -16.282 -1.044 148 HZ2 LYS 16 1HZ LYS 16 1.309 -14.794 -0.549 149 HZ3 LYS 16 2HZ LYS 16 1.916 -16.222 0.117 150 H LYS 17 H LYS 17 6.976 -11.764 -3.752 151 HA LYS 17 HA LYS 17 9.777 -11.619 -3.197 152 HB2 LYS 17 2HB LYS 17 8.245 -9.979 -5.266 153 HB3 LYS 17 3HB LYS 17 9.936 -10.461 -5.315 154 HG2 LYS 17 2HG LYS 17 9.173 -12.859 -5.547 155 HG3 LYS 17 3HG LYS 17 7.517 -12.260 -5.665 156 HD2 LYS 17 2HD LYS 17 8.316 -12.650 -7.914 157 HD3 LYS 17 3HD LYS 17 8.224 -10.902 -7.680 158 HE2 LYS 17 2HE LYS 17 10.643 -10.791 -7.323 159 HE3 LYS 17 3HE LYS 17 10.765 -12.548 -7.425 160 HZ1 LYS 17 3HZ LYS 17 9.858 -10.789 -9.645 161 HZ2 LYS 17 1HZ LYS 17 10.094 -12.460 -9.712 162 HZ3 LYS 17 2HZ LYS 17 11.414 -11.434 -9.487 163 H ILE 18 H ILE 18 7.103 -9.258 -3.247 164 HA ILE 18 HA ILE 18 8.531 -6.923 -2.571 165 HB ILE 18 HB ILE 18 5.568 -7.588 -2.197 166 HG12 ILE 18 2HG1 ILE 18 6.995 -6.042 -4.419 167 HG13 ILE 18 3HG1 ILE 18 6.342 -7.669 -4.563 168 HG21 ILE 18 1HG2 ILE 18 5.147 -5.155 -2.042 169 HG22 ILE 18 2HG2 ILE 18 6.883 -4.845 -2.078 170 HG23 ILE 18 3HG2 ILE 18 6.171 -5.709 -0.716 171 HD11 ILE 18 3HD1 ILE 18 4.883 -6.083 -5.623 172 HD12 ILE 18 1HD1 ILE 18 4.758 -5.138 -4.138 173 HD13 ILE 18 2HD1 ILE 18 4.080 -6.767 -4.210 174 H LYS 19 H LYS 19 7.123 -9.470 -0.596 175 HA LYS 19 HA LYS 19 7.230 -8.217 1.935 176 HB2 LYS 19 2HB LYS 19 7.309 -11.140 1.110 177 HB3 LYS 19 3HB LYS 19 7.380 -10.649 2.802 178 HG2 LYS 19 2HG LYS 19 5.191 -9.608 2.664 179 HG3 LYS 19 3HG LYS 19 5.127 -9.884 0.920 180 HD2 LYS 19 2HD LYS 19 3.759 -11.540 2.141 181 HD3 LYS 19 3HD LYS 19 5.089 -12.315 1.278 182 HE2 LYS 19 2HE LYS 19 6.364 -12.513 3.367 183 HE3 LYS 19 3HE LYS 19 5.094 -11.661 4.249 184 HZ1 LYS 19 3HZ LYS 19 4.892 -14.015 4.569 185 HZ2 LYS 19 1HZ LYS 19 4.817 -14.294 2.904 186 HZ3 LYS 19 2HZ LYS 19 3.571 -13.459 3.687 187 H LYS 20 H LYS 20 9.616 -10.280 0.222 188 HA LYS 20 HA LYS 20 11.605 -10.128 2.249 189 HB2 LYS 20 2HB LYS 20 11.770 -10.826 -0.714 190 HB3 LYS 20 3HB LYS 20 13.171 -10.877 0.350 191 HG2 LYS 20 2HG LYS 20 10.634 -12.497 0.748 192 HG3 LYS 20 3HG LYS 20 12.133 -13.109 0.042 193 HD2 LYS 20 2HD LYS 20 13.322 -12.865 2.118 194 HD3 LYS 20 3HD LYS 20 12.011 -11.931 2.846 195 HE2 LYS 20 2HE LYS 20 11.855 -14.867 2.071 196 HE3 LYS 20 3HE LYS 20 12.092 -14.243 3.707 197 HZ1 LYS 20 3HZ LYS 20 9.700 -13.907 1.997 198 HZ2 LYS 20 1HZ LYS 20 9.934 -13.070 3.449 199 HZ3 LYS 20 2HZ LYS 20 9.816 -14.752 3.463 200 H GLU 21 H GLU 21 10.854 -8.072 -0.527 201 HA GLU 21 HA GLU 21 13.075 -6.351 -0.498 202 HB2 GLU 21 2HB GLU 21 10.182 -5.707 -1.207 203 HB3 GLU 21 3HB GLU 21 11.557 -4.682 -1.592 204 HG2 GLU 21 2HG GLU 21 11.010 -7.452 -2.667 205 HG3 GLU 21 3HG GLU 21 10.859 -5.937 -3.553 206 H VAL 22 H VAL 22 10.022 -6.207 1.349 207 HA VAL 22 HA VAL 22 10.762 -3.723 2.652 208 HB VAL 22 HB VAL 22 8.646 -3.773 3.787 209 HG11 VAL 22 1HG1 VAL 22 8.282 -4.654 0.910 210 HG12 VAL 22 2HG1 VAL 22 8.612 -3.015 1.470 211 HG13 VAL 22 3HG1 VAL 22 7.086 -3.794 1.885 212 HG21 VAL 22 3HG2 VAL 22 8.498 -6.130 4.430 213 HG22 VAL 22 1HG2 VAL 22 8.226 -6.595 2.749 214 HG23 VAL 22 2HG2 VAL 22 7.023 -5.629 3.605 215 H GLU 23 H GLU 23 10.953 -7.125 3.414 216 HA GLU 23 HA GLU 23 11.420 -6.894 6.225 217 HB2 GLU 23 2HB GLU 23 12.047 -9.111 4.231 218 HB3 GLU 23 3HB GLU 23 12.449 -9.242 5.941 219 HG2 GLU 23 2HG GLU 23 10.071 -9.040 6.545 220 HG3 GLU 23 3HG GLU 23 9.647 -8.837 4.849 221 H ASN 24 H ASN 24 13.473 -6.650 3.377 222 HA ASN 24 HA ASN 24 16.034 -6.552 4.460 223 HB2 ASN 24 2HB ASN 24 14.882 -4.754 2.271 224 HB3 ASN 24 3HB ASN 24 16.601 -4.938 2.605 225 HD21 ASN 24 1HD2 ASN 24 15.036 -5.497 0.187 226 HD22 ASN 24 2HD2 ASN 24 15.355 -7.149 -0.206 227 H GLN 25 H GLN 25 13.472 -4.150 4.548 228 HA GLN 25 HA GLN 25 15.159 -2.231 6.041 229 HB2 GLN 25 2HB GLN 25 12.631 -1.769 4.414 230 HB3 GLN 25 3HB GLN 25 13.517 -0.521 5.278 231 HG2 GLN 25 2HG GLN 25 14.567 -2.139 2.937 232 HG3 GLN 25 3HG GLN 25 14.012 -0.471 2.873 233 HE21 GLN 25 1HE2 GLN 25 16.617 -2.579 3.806 234 HE22 GLN 25 2HE2 GLN 25 17.767 -1.342 4.160 235 H GLY 26 H GLY 26 13.043 -4.607 6.746 236 HA2 GLY 26 2HA GLY 26 12.190 -5.199 8.785 237 HA3 GLY 26 3HA GLY 26 12.806 -3.699 9.445 238 H TYR 27 H TYR 27 10.423 -3.981 6.806 239 HA TYR 27 HA TYR 27 8.397 -2.525 8.278 240 HB2 TYR 27 2HB TYR 27 8.378 -3.887 5.567 241 HB3 TYR 27 3HB TYR 27 6.934 -3.154 6.248 242 HD1 TYR 27 HD1 TYR 27 10.542 -2.156 5.673 243 HD2 TYR 27 HD2 TYR 27 6.419 -1.042 5.413 244 HE1 TYR 27 HE1 TYR 27 11.184 -0.012 4.653 245 HE2 TYR 27 HE2 TYR 27 7.065 1.101 4.399 246 HH TYR 27 HH TYR 27 10.142 1.699 3.163 247 H GLN 28 H GLN 28 6.398 -3.323 8.934 248 HA GLN 28 HA GLN 28 6.285 -6.094 9.827 249 HB2 GLN 28 2HB GLN 28 5.677 -4.282 11.385 250 HB3 GLN 28 3HB GLN 28 4.469 -3.669 10.263 251 HG2 GLN 28 2HG GLN 28 3.146 -5.736 10.573 252 HG3 GLN 28 3HG GLN 28 4.353 -6.333 11.712 253 HE21 GLN 28 1HE2 GLN 28 3.245 -2.958 11.543 254 HE22 GLN 28 2HE2 GLN 28 2.453 -2.955 13.077 255 H VAL 29 H VAL 29 5.515 -7.556 8.367 256 HA VAL 29 HA VAL 29 3.725 -6.862 6.204 257 HB VAL 29 HB VAL 29 4.649 -9.641 7.108 258 HG11 VAL 29 1HG1 VAL 29 2.587 -9.736 5.747 259 HG12 VAL 29 2HG1 VAL 29 3.955 -10.413 4.871 260 HG13 VAL 29 3HG1 VAL 29 3.373 -8.797 4.475 261 HG21 VAL 29 3HG2 VAL 29 5.801 -7.854 4.926 262 HG22 VAL 29 1HG2 VAL 29 6.303 -9.514 5.263 263 HG23 VAL 29 2HG2 VAL 29 6.575 -8.248 6.462 264 H ARG 30 H ARG 30 1.738 -6.247 6.959 265 HA ARG 30 HA ARG 30 0.115 -8.262 8.415 266 HB2 ARG 30 2HB ARG 30 0.345 -6.141 9.707 267 HB3 ARG 30 3HB ARG 30 -0.279 -5.228 8.336 268 HG2 ARG 30 2HG ARG 30 -2.456 -6.335 8.541 269 HG3 ARG 30 3HG ARG 30 -1.840 -7.366 9.833 270 HD2 ARG 30 2HD ARG 30 -3.168 -5.613 10.822 271 HD3 ARG 30 3HD ARG 30 -1.479 -5.314 11.227 272 HE ARG 30 HE ARG 30 -2.756 -3.895 8.973 273 HH11 ARG 30 1HH1 ARG 30 -1.262 -3.711 12.166 274 HH12 ARG 30 2HH1 ARG 30 -1.125 -1.984 12.128 275 HH21 ARG 30 1HH2 ARG 30 -2.629 -1.661 8.956 276 HH22 ARG 30 2HH2 ARG 30 -1.906 -0.813 10.288 277 H ASP 31 H ASP 31 -1.604 -9.049 7.317 278 HA ASP 31 HA ASP 31 -2.353 -7.805 4.732 279 HB2 ASP 31 2HB ASP 31 -3.099 -10.054 4.018 280 HB3 ASP 31 3HB ASP 31 -1.398 -10.044 4.464 281 H VAL 32 H VAL 32 -4.408 -7.277 4.357 282 HA VAL 32 HA VAL 32 -6.581 -8.017 6.226 283 HB VAL 32 HB VAL 32 -6.124 -5.340 4.807 284 HG11 VAL 32 1HG1 VAL 32 -8.241 -4.583 5.811 285 HG12 VAL 32 2HG1 VAL 32 -8.533 -6.200 6.455 286 HG13 VAL 32 3HG1 VAL 32 -8.504 -5.935 4.711 287 HG21 VAL 32 3HG2 VAL 32 -6.252 -5.977 7.780 288 HG22 VAL 32 1HG2 VAL 32 -6.071 -4.367 7.075 289 HG23 VAL 32 2HG2 VAL 32 -4.798 -5.571 6.864 290 H ASN 33 H ASN 33 -7.847 -9.403 5.106 291 HA ASN 33 HA ASN 33 -8.234 -8.993 2.182 292 HB2 ASN 33 2HB ASN 33 -8.215 -11.567 3.808 293 HB3 ASN 33 3HB ASN 33 -8.664 -11.479 2.107 294 HD21 ASN 33 1HD2 ASN 33 -5.999 -11.070 4.377 295 HD22 ASN 33 2HD2 ASN 33 -4.734 -11.230 3.215 296 H ASP 34 H ASP 34 -9.814 -8.643 5.094 297 HA ASP 34 HA ASP 34 -12.486 -8.755 3.831 298 HB2 ASP 34 2HB ASP 34 -12.066 -10.830 5.244 299 HB3 ASP 34 3HB ASP 34 -11.900 -9.791 6.648 300 H SER 35 H SER 35 -14.088 -7.409 4.955 301 HA SER 35 HA SER 35 -13.133 -4.787 5.424 302 HB2 SER 35 2HB SER 35 -15.925 -5.916 5.890 303 HB3 SER 35 3HB SER 35 -15.508 -4.203 5.749 304 HG SER 35 HG SER 35 -15.258 -6.205 3.745 305 H ASP 36 H ASP 36 -14.276 -7.309 7.629 306 HA ASP 36 HA ASP 36 -14.443 -5.810 10.011 307 HB2 ASP 36 2HB ASP 36 -15.377 -8.108 9.806 308 HB3 ASP 36 3HB ASP 36 -13.754 -8.775 9.691 309 H GLU 37 H GLU 37 -11.822 -7.657 8.538 310 HA GLU 37 HA GLU 37 -9.882 -7.353 10.561 311 HB2 GLU 37 2HB GLU 37 -9.385 -7.765 7.581 312 HB3 GLU 37 3HB GLU 37 -8.293 -8.177 8.901 313 HG2 GLU 37 2HG GLU 37 -9.950 -9.861 9.709 314 HG3 GLU 37 3HG GLU 37 -10.978 -9.481 8.329 315 H LEU 38 H LEU 38 -10.805 -5.363 7.802 316 HA LEU 38 HA LEU 38 -8.657 -3.550 7.744 317 HB2 LEU 38 2HB LEU 38 -10.376 -3.754 5.942 318 HB3 LEU 38 3HB LEU 38 -11.569 -3.044 7.021 319 HG LEU 38 HG LEU 38 -10.052 -0.954 7.111 320 HD11 LEU 38 1HD1 LEU 38 -7.990 -1.932 6.300 321 HD12 LEU 38 2HD1 LEU 38 -8.500 -0.605 5.262 322 HD13 LEU 38 3HD1 LEU 38 -8.730 -2.273 4.730 323 HD21 LEU 38 3HD2 LEU 38 -11.330 -1.663 4.458 324 HD22 LEU 38 1HD2 LEU 38 -10.924 -0.037 5.018 325 HD23 LEU 38 2HD2 LEU 38 -12.148 -0.981 5.865 326 H LYS 39 H LYS 39 -11.917 -3.119 9.229 327 HA LYS 39 HA LYS 39 -11.220 -0.603 10.367 328 HB2 LYS 39 2HB LYS 39 -13.438 -0.765 11.552 329 HB3 LYS 39 3HB LYS 39 -13.495 -0.933 9.807 330 HG2 LYS 39 2HG LYS 39 -14.995 -2.562 10.467 331 HG3 LYS 39 3HG LYS 39 -13.519 -3.508 10.288 332 HD2 LYS 39 2HD LYS 39 -13.160 -3.455 12.717 333 HD3 LYS 39 3HD LYS 39 -14.577 -2.419 12.924 334 HE2 LYS 39 2HE LYS 39 -14.591 -5.265 11.879 335 HE3 LYS 39 3HE LYS 39 -15.088 -4.752 13.488 336 HZ1 LYS 39 3HZ LYS 39 -16.399 -4.038 10.924 337 HZ2 LYS 39 1HZ LYS 39 -16.851 -3.423 12.431 338 HZ3 LYS 39 2HZ LYS 39 -17.004 -5.074 12.111 339 H LYS 40 H LYS 40 -10.902 -3.868 11.564 340 HA LYS 40 HA LYS 40 -10.505 -3.379 14.313 341 HB2 LYS 40 2HB LYS 40 -9.417 -5.532 12.467 342 HB3 LYS 40 3HB LYS 40 -9.010 -5.501 14.173 343 HG2 LYS 40 2HG LYS 40 -11.826 -5.773 13.067 344 HG3 LYS 40 3HG LYS 40 -10.814 -7.100 13.642 345 HD2 LYS 40 2HD LYS 40 -10.721 -5.851 15.894 346 HD3 LYS 40 3HD LYS 40 -12.018 -4.834 15.265 347 HE2 LYS 40 2HE LYS 40 -12.130 -7.849 15.634 348 HE3 LYS 40 3HE LYS 40 -12.911 -6.648 16.662 349 HZ1 LYS 40 3HZ LYS 40 -13.514 -7.160 13.803 350 HZ2 LYS 40 1HZ LYS 40 -14.240 -5.964 14.755 351 HZ3 LYS 40 2HZ LYS 40 -14.473 -7.594 15.123 352 H GLU 41 H GLU 41 -8.073 -3.624 11.678 353 HA GLU 41 HA GLU 41 -5.873 -2.849 13.360 354 HB2 GLU 41 2HB GLU 41 -4.512 -2.976 11.297 355 HB3 GLU 41 3HB GLU 41 -5.480 -4.415 11.565 356 HG2 GLU 41 2HG GLU 41 -5.898 -4.225 9.349 357 HG3 GLU 41 3HG GLU 41 -7.140 -3.110 9.884 358 H MET 42 H MET 42 -8.118 -1.171 11.307 359 HA MET 42 HA MET 42 -6.717 1.246 10.900 360 HB2 MET 42 2HB MET 42 -9.649 0.500 10.833 361 HB3 MET 42 3HB MET 42 -9.199 2.194 10.756 362 HG2 MET 42 2HG MET 42 -7.822 0.396 8.821 363 HG3 MET 42 3HG MET 42 -9.542 0.682 8.567 364 HE1 MET 42 3HE MET 42 -6.412 4.120 8.571 365 HE2 MET 42 1HE MET 42 -5.956 2.427 8.767 366 HE3 MET 42 2HE MET 42 -6.832 3.264 10.051 367 H LYS 43 H LYS 43 -8.898 0.147 13.515 368 HA LYS 43 HA LYS 43 -8.776 2.571 14.996 369 HB2 LYS 43 2HB LYS 43 -9.266 -0.222 16.107 370 HB3 LYS 43 3HB LYS 43 -9.588 1.294 16.944 371 HG2 LYS 43 2HG LYS 43 -11.003 0.158 14.548 372 HG3 LYS 43 3HG LYS 43 -11.671 0.513 16.139 373 HD2 LYS 43 2HD LYS 43 -11.555 2.903 15.734 374 HD3 LYS 43 3HD LYS 43 -10.626 2.664 14.248 375 HE2 LYS 43 2HE LYS 43 -12.941 3.193 13.710 376 HE3 LYS 43 3HE LYS 43 -12.573 1.541 13.224 377 HZ1 LYS 43 3HZ LYS 43 -13.679 0.755 15.215 378 HZ2 LYS 43 1HZ LYS 43 -14.731 1.692 14.283 379 HZ3 LYS 43 2HZ LYS 43 -14.029 2.333 15.684 380 H LYS 44 H LYS 44 -6.649 -0.264 14.898 381 HA LYS 44 HA LYS 44 -5.010 0.395 17.116 382 HB2 LYS 44 2HB LYS 44 -4.371 -1.194 14.586 383 HB3 LYS 44 3HB LYS 44 -3.269 -1.070 15.952 384 HG2 LYS 44 2HG LYS 44 -6.054 -2.279 16.039 385 HG3 LYS 44 3HG LYS 44 -4.542 -3.184 15.992 386 HD2 LYS 44 2HD LYS 44 -5.401 -1.302 18.226 387 HD3 LYS 44 3HD LYS 44 -5.487 -3.063 18.286 388 HE2 LYS 44 2HE LYS 44 -3.095 -3.271 18.244 389 HE3 LYS 44 3HE LYS 44 -2.884 -1.561 17.859 390 HZ1 LYS 44 3HZ LYS 44 -2.414 -1.842 20.148 391 HZ2 LYS 44 1HZ LYS 44 -3.840 -2.715 20.416 392 HZ3 LYS 44 2HZ LYS 44 -3.913 -1.072 20.047 393 H LEU 45 H LEU 45 -4.957 1.463 13.760 394 HA LEU 45 HA LEU 45 -2.455 2.899 13.916 395 HB2 LEU 45 2HB LEU 45 -4.676 3.186 11.854 396 HB3 LEU 45 3HB LEU 45 -3.004 3.699 11.669 397 HG LEU 45 HG LEU 45 -4.046 0.849 11.768 398 HD11 LEU 45 1HD1 LEU 45 -2.683 2.368 9.534 399 HD12 LEU 45 2HD1 LEU 45 -4.385 1.907 9.618 400 HD13 LEU 45 3HD1 LEU 45 -3.146 0.662 9.491 401 HD21 LEU 45 3HD2 LEU 45 -1.944 0.925 13.012 402 HD22 LEU 45 1HD2 LEU 45 -1.148 1.714 11.648 403 HD23 LEU 45 2HD2 LEU 45 -1.744 0.062 11.490 404 H ALA 46 H ALA 46 -5.841 3.637 14.409 405 HA ALA 46 HA ALA 46 -5.571 6.509 14.417 406 HB1 ALA 46 3HB ALA 46 -7.646 5.409 13.686 407 HB2 ALA 46 1HB ALA 46 -7.949 6.503 15.038 408 HB3 ALA 46 2HB ALA 46 -7.885 4.758 15.309 409 H GLU 47 H GLU 47 -5.735 3.973 16.837 410 HA GLU 47 HA GLU 47 -5.883 5.680 19.160 411 HB2 GLU 47 2HB GLU 47 -5.240 2.712 18.849 412 HB3 GLU 47 3HB GLU 47 -5.387 3.517 20.407 413 HG2 GLU 47 2HG GLU 47 -7.758 3.981 19.989 414 HG3 GLU 47 3HG GLU 47 -7.635 3.293 18.367 415 H GLU 48 H GLU 48 -3.339 3.942 17.410 416 HA GLU 48 HA GLU 48 -1.249 5.239 19.074 417 HB2 GLU 48 2HB GLU 48 -1.096 2.461 17.817 418 HB3 GLU 48 3HB GLU 48 0.138 3.222 18.813 419 HG2 GLU 48 2HG GLU 48 -1.313 3.106 20.767 420 HG3 GLU 48 3HG GLU 48 -2.628 2.462 19.789 421 H LYS 49 H LYS 49 -1.439 6.927 17.393 422 HA LYS 49 HA LYS 49 -0.433 6.348 14.726 423 HB2 LYS 49 2HB LYS 49 -2.150 8.149 15.161 424 HB3 LYS 49 3HB LYS 49 -0.930 9.050 16.053 425 HG2 LYS 49 2HG LYS 49 0.456 8.934 13.822 426 HG3 LYS 49 3HG LYS 49 -1.089 8.512 13.077 427 HD2 LYS 49 2HD LYS 49 -0.744 10.913 12.857 428 HD3 LYS 49 3HD LYS 49 -2.065 10.642 13.998 429 HE2 LYS 49 2HE LYS 49 -0.457 10.964 15.881 430 HE3 LYS 49 3HE LYS 49 0.818 11.297 14.711 431 HZ1 LYS 49 3HZ LYS 49 -1.658 12.897 15.076 432 HZ2 LYS 49 1HZ LYS 49 -0.434 13.214 13.955 433 HZ3 LYS 49 2HZ LYS 49 -0.115 13.329 15.611 434 H ASN 50 H ASN 50 1.488 5.316 15.642 435 HA ASN 50 HA ASN 50 3.622 7.117 16.621 436 HB2 ASN 50 2HB ASN 50 4.696 4.996 17.478 437 HB3 ASN 50 3HB ASN 50 3.140 5.349 18.220 438 HD21 ASN 50 1HD2 ASN 50 2.747 3.205 18.834 439 HD22 ASN 50 2HD2 ASN 50 2.428 1.941 17.699 440 H PHE 51 H PHE 51 5.856 6.548 15.858 441 HA PHE 51 HA PHE 51 6.032 6.300 13.021 442 HB2 PHE 51 2HB PHE 51 7.751 7.522 14.335 443 HB3 PHE 51 3HB PHE 51 8.234 6.029 15.131 444 HD1 PHE 51 HD2 PHE 51 8.092 7.719 11.795 445 HD2 PHE 51 HD1 PHE 51 9.892 4.608 14.115 446 HE1 PHE 51 HE2 PHE 51 9.704 7.295 9.988 447 HE2 PHE 51 HE1 PHE 51 11.501 4.193 12.298 448 HZ PHE 51 HZ PHE 51 11.406 5.533 10.234 449 H GLU 52 H GLU 52 5.463 4.445 12.031 450 HA GLU 52 HA GLU 52 6.601 1.871 12.806 451 HB2 GLU 52 2HB GLU 52 4.594 2.032 14.228 452 HB3 GLU 52 3HB GLU 52 3.593 2.403 12.831 453 HG2 GLU 52 2HG GLU 52 4.054 0.132 11.928 454 HG3 GLU 52 3HG GLU 52 5.024 -0.220 13.357 455 H LYS 53 H LYS 53 7.107 0.817 11.011 456 HA LYS 53 HA LYS 53 6.021 1.609 8.394 457 HB2 LYS 53 2HB LYS 53 8.385 -0.178 9.137 458 HB3 LYS 53 3HB LYS 53 7.939 0.294 7.499 459 HG2 LYS 53 2HG LYS 53 8.488 2.604 7.915 460 HG3 LYS 53 3HG LYS 53 8.704 2.304 9.640 461 HD2 LYS 53 2HD LYS 53 10.455 1.197 7.408 462 HD3 LYS 53 3HD LYS 53 10.883 2.504 8.515 463 HE2 LYS 53 2HE LYS 53 10.627 0.859 10.426 464 HE3 LYS 53 3HE LYS 53 10.430 -0.419 9.223 465 HZ1 LYS 53 3HZ LYS 53 12.698 -0.338 9.947 466 HZ2 LYS 53 1HZ LYS 53 12.813 1.311 9.596 467 HZ3 LYS 53 2HZ LYS 53 12.637 0.193 8.343 468 H ILE 54 H ILE 54 4.420 0.393 7.532 469 HA ILE 54 HA ILE 54 4.178 -2.492 8.198 470 HB ILE 54 HB ILE 54 1.749 -0.647 7.804 471 HG12 ILE 54 2HG1 ILE 54 2.816 -1.649 10.489 472 HG13 ILE 54 3HG1 ILE 54 2.989 0.001 9.902 473 HG21 ILE 54 1HG2 ILE 54 1.383 -3.045 7.297 474 HG22 ILE 54 2HG2 ILE 54 0.472 -2.557 8.724 475 HG23 ILE 54 3HG2 ILE 54 1.961 -3.487 8.907 476 HD11 ILE 54 3HD1 ILE 54 1.180 -0.168 11.479 477 HD12 ILE 54 1HD1 ILE 54 0.391 -1.399 10.495 478 HD13 ILE 54 2HD1 ILE 54 0.559 0.251 9.885 479 H LEU 55 H LEU 55 4.170 -3.701 6.353 480 HA LEU 55 HA LEU 55 3.269 -2.592 3.780 481 HB2 LEU 55 2HB LEU 55 5.303 -4.112 3.946 482 HB3 LEU 55 3HB LEU 55 4.246 -5.408 4.481 483 HG LEU 55 HG LEU 55 2.984 -5.086 2.230 484 HD11 LEU 55 1HD1 LEU 55 3.818 -2.919 1.609 485 HD12 LEU 55 2HD1 LEU 55 4.310 -4.099 0.398 486 HD13 LEU 55 3HD1 LEU 55 5.480 -3.513 1.577 487 HD21 LEU 55 3HD2 LEU 55 5.831 -6.140 2.131 488 HD22 LEU 55 1HD2 LEU 55 4.542 -6.515 0.985 489 HD23 LEU 55 2HD2 LEU 55 4.409 -7.039 2.661 490 H ILE 56 H ILE 56 1.085 -2.695 3.379 491 HA ILE 56 HA ILE 56 -0.555 -4.780 4.669 492 HB ILE 56 HB ILE 56 -1.444 -2.259 3.203 493 HG12 ILE 56 2HG1 ILE 56 -0.463 -1.810 5.452 494 HG13 ILE 56 3HG1 ILE 56 -2.186 -1.452 5.421 495 HG21 ILE 56 1HG2 ILE 56 -3.751 -2.815 3.948 496 HG22 ILE 56 2HG2 ILE 56 -3.177 -4.356 4.587 497 HG23 ILE 56 3HG2 ILE 56 -3.108 -4.039 2.853 498 HD11 ILE 56 3HD1 ILE 56 -2.642 -3.558 6.582 499 HD12 ILE 56 1HD1 ILE 56 -1.528 -2.538 7.490 500 HD13 ILE 56 2HD1 ILE 56 -0.916 -3.928 6.595 501 H LYS 57 H LYS 57 -1.040 -6.538 3.550 502 HA LYS 57 HA LYS 57 -1.127 -6.551 0.596 503 HB2 LYS 57 2HB LYS 57 0.214 -8.297 1.704 504 HB3 LYS 57 3HB LYS 57 -1.132 -8.764 2.715 505 HG2 LYS 57 2HG LYS 57 -1.267 -9.067 -0.286 506 HG3 LYS 57 3HG LYS 57 -0.457 -10.271 0.712 507 HD2 LYS 57 2HD LYS 57 -2.624 -10.556 1.986 508 HD3 LYS 57 3HD LYS 57 -3.394 -9.483 0.814 509 HE2 LYS 57 2HE LYS 57 -2.087 -12.151 0.228 510 HE3 LYS 57 3HE LYS 57 -3.817 -11.817 0.236 511 HZ1 LYS 57 3HZ LYS 57 -3.390 -10.233 -1.619 512 HZ2 LYS 57 1HZ LYS 57 -3.048 -11.848 -1.992 513 HZ3 LYS 57 2HZ LYS 57 -1.795 -10.782 -1.655 514 H SER 58 H SER 58 -3.119 -6.262 -0.320 515 HA SER 58 HA SER 58 -5.500 -7.454 0.922 516 HB2 SER 58 2HB SER 58 -5.488 -5.134 1.778 517 HB3 SER 58 3HB SER 58 -5.341 -4.512 0.132 518 HG SER 58 HG SER 58 -7.431 -4.629 0.012 519 H ASN 59 H ASN 59 -6.884 -8.271 -0.551 520 HA ASN 59 HA ASN 59 -6.147 -8.244 -3.371 521 HB2 ASN 59 2HB ASN 59 -7.959 -9.950 -3.620 522 HB3 ASN 59 3HB ASN 59 -6.798 -10.391 -2.367 523 HD21 ASN 59 1HD2 ASN 59 -7.491 -10.377 -0.190 524 HD22 ASN 59 2HD2 ASN 59 -9.166 -10.341 0.237 525 H ASP 60 H ASP 60 -8.776 -7.075 -1.306 526 HA ASP 60 HA ASP 60 -10.399 -6.162 -3.540 527 HB2 ASP 60 2HB ASP 60 -11.561 -7.141 -1.646 528 HB3 ASP 60 3HB ASP 60 -10.794 -6.027 -0.523 529 H LYS 61 H LYS 61 -10.610 -4.125 -4.214 530 HA LYS 61 HA LYS 61 -8.525 -2.227 -3.685 531 HB2 LYS 61 2HB LYS 61 -9.600 -0.928 -5.495 532 HB3 LYS 61 3HB LYS 61 -9.438 -2.622 -5.950 533 HG2 LYS 61 2HG LYS 61 -11.840 -2.967 -5.280 534 HG3 LYS 61 3HG LYS 61 -11.970 -1.228 -5.026 535 HD2 LYS 61 2HD LYS 61 -11.508 -0.815 -7.401 536 HD3 LYS 61 3HD LYS 61 -11.252 -2.543 -7.674 537 HE2 LYS 61 2HE LYS 61 -13.635 -2.956 -6.993 538 HE3 LYS 61 3HE LYS 61 -13.865 -1.209 -6.870 539 HZ1 LYS 61 3HZ LYS 61 -13.300 -1.030 -9.226 540 HZ2 LYS 61 1HZ LYS 61 -14.639 -2.034 -8.986 541 HZ3 LYS 61 2HZ LYS 61 -13.129 -2.707 -9.328 542 H GLN 62 H GLN 62 -11.834 -2.621 -2.599 543 HA GLN 62 HA GLN 62 -12.380 0.174 -2.135 544 HB2 GLN 62 2HB GLN 62 -13.918 -2.327 -1.327 545 HB3 GLN 62 3HB GLN 62 -14.516 -0.685 -1.146 546 HG2 GLN 62 2HG GLN 62 -13.839 -2.016 -3.781 547 HG3 GLN 62 3HG GLN 62 -15.463 -1.828 -3.118 548 HE21 GLN 62 1HE2 GLN 62 -16.410 0.246 -3.101 549 HE22 GLN 62 2HE2 GLN 62 -15.797 1.546 -4.061 550 H LEU 63 H LEU 63 -11.156 -2.519 -0.258 551 HA LEU 63 HA LEU 63 -11.335 -1.511 2.353 552 HB2 LEU 63 2HB LEU 63 -9.168 -3.250 1.093 553 HB3 LEU 63 3HB LEU 63 -9.317 -2.968 2.821 554 HG LEU 63 HG LEU 63 -11.335 -4.429 1.070 555 HD11 LEU 63 1HD1 LEU 63 -10.721 -6.426 2.366 556 HD12 LEU 63 2HD1 LEU 63 -9.495 -5.498 3.234 557 HD13 LEU 63 3HD1 LEU 63 -9.336 -5.767 1.497 558 HD21 LEU 63 3HD2 LEU 63 -12.558 -4.920 3.151 559 HD22 LEU 63 1HD2 LEU 63 -12.509 -3.191 2.812 560 HD23 LEU 63 2HD2 LEU 63 -11.454 -3.877 4.050 561 H LEU 64 H LEU 64 -8.923 -0.966 -0.183 562 HA LEU 64 HA LEU 64 -7.076 0.581 1.337 563 HB2 LEU 64 2HB LEU 64 -7.507 0.299 -1.662 564 HB3 LEU 64 3HB LEU 64 -6.262 1.340 -0.993 565 HG LEU 64 HG LEU 64 -5.186 -0.653 0.077 566 HD11 LEU 64 1HD1 LEU 64 -7.081 -2.138 0.316 567 HD12 LEU 64 2HD1 LEU 64 -5.815 -2.919 -0.628 568 HD13 LEU 64 3HD1 LEU 64 -7.245 -2.271 -1.438 569 HD21 LEU 64 3HD2 LEU 64 -4.408 0.164 -2.087 570 HD22 LEU 64 1HD2 LEU 64 -5.552 -0.893 -2.920 571 HD23 LEU 64 2HD2 LEU 64 -4.231 -1.585 -1.969 572 H LYS 65 H LYS 65 -9.896 1.399 -0.656 573 HA LYS 65 HA LYS 65 -9.718 4.191 -0.678 574 HB2 LYS 65 2HB LYS 65 -12.166 2.368 -0.618 575 HB3 LYS 65 3HB LYS 65 -12.277 4.107 -0.861 576 HG2 LYS 65 2HG LYS 65 -10.775 2.191 -2.666 577 HG3 LYS 65 3HG LYS 65 -12.398 2.801 -2.975 578 HD2 LYS 65 2HD LYS 65 -10.008 4.664 -2.663 579 HD3 LYS 65 3HD LYS 65 -10.453 3.953 -4.210 580 HE2 LYS 65 2HE LYS 65 -11.376 6.187 -4.082 581 HE3 LYS 65 3HE LYS 65 -12.698 5.026 -4.028 582 HZ1 LYS 65 3HZ LYS 65 -13.013 6.809 -2.444 583 HZ2 LYS 65 1HZ LYS 65 -11.551 6.448 -1.683 584 HZ3 LYS 65 2HZ LYS 65 -12.826 5.347 -1.632 585 H GLU 66 H GLU 66 -11.518 2.101 1.594 586 HA GLU 66 HA GLU 66 -12.489 4.111 3.303 587 HB2 GLU 66 2HB GLU 66 -11.882 1.211 4.033 588 HB3 GLU 66 3HB GLU 66 -13.006 2.279 4.870 589 HG2 GLU 66 2HG GLU 66 -14.472 2.305 2.918 590 HG3 GLU 66 3HG GLU 66 -13.320 1.338 2.011 591 H MET 67 H MET 67 -9.554 2.142 3.438 592 HA MET 67 HA MET 67 -8.647 2.753 5.998 593 HB2 MET 67 2HB MET 67 -7.692 0.918 4.599 594 HB3 MET 67 3HB MET 67 -6.954 2.109 3.536 595 HG2 MET 67 2HG MET 67 -5.649 2.945 5.517 596 HG3 MET 67 3HG MET 67 -6.286 1.595 6.444 597 HE1 MET 67 3HE MET 67 -4.502 -1.468 4.914 598 HE2 MET 67 1HE MET 67 -6.159 -0.934 4.626 599 HE3 MET 67 2HE MET 67 -5.467 -0.844 6.250 600 H LEU 68 H LEU 68 -7.780 4.273 2.890 601 HA LEU 68 HA LEU 68 -6.017 6.209 4.007 602 HB2 LEU 68 2HB LEU 68 -7.334 6.018 1.273 603 HB3 LEU 68 3HB LEU 68 -6.102 7.205 1.681 604 HG LEU 68 HG LEU 68 -5.688 4.186 1.742 605 HD11 LEU 68 1HD1 LEU 68 -4.717 6.209 -0.297 606 HD12 LEU 68 2HD1 LEU 68 -5.938 4.959 -0.547 607 HD13 LEU 68 3HD1 LEU 68 -4.268 4.500 -0.237 608 HD21 LEU 68 3HD2 LEU 68 -3.688 6.430 2.148 609 HD22 LEU 68 1HD2 LEU 68 -3.309 4.707 2.053 610 HD23 LEU 68 2HD2 LEU 68 -4.283 5.320 3.385 611 H GLU 69 H GLU 69 -9.458 6.211 3.438 612 HA GLU 69 HA GLU 69 -9.820 9.067 3.737 613 HB2 GLU 69 2HB GLU 69 -11.812 6.759 3.789 614 HB3 GLU 69 3HB GLU 69 -12.268 8.464 3.850 615 HG2 GLU 69 2HG GLU 69 -11.243 8.854 1.652 616 HG3 GLU 69 3HG GLU 69 -10.690 7.180 1.603 617 H LEU 70 H LEU 70 -9.594 6.354 5.921 618 HA LEU 70 HA LEU 70 -10.353 7.919 8.263 619 HB2 LEU 70 2HB LEU 70 -9.154 5.136 7.971 620 HB3 LEU 70 3HB LEU 70 -9.565 5.861 9.519 621 HG LEU 70 HG LEU 70 -11.578 5.298 7.299 622 HD11 LEU 70 1HD1 LEU 70 -10.720 3.203 8.218 623 HD12 LEU 70 2HD1 LEU 70 -12.395 3.452 8.696 624 HD13 LEU 70 3HD1 LEU 70 -11.095 3.738 9.857 625 HD21 LEU 70 3HD2 LEU 70 -12.260 7.183 8.706 626 HD22 LEU 70 1HD2 LEU 70 -12.027 6.213 10.162 627 HD23 LEU 70 2HD2 LEU 70 -13.293 5.788 9.007 628 H ILE 71 H ILE 71 -7.419 6.962 6.579 629 HA ILE 71 HA ILE 71 -5.532 7.789 8.570 630 HB ILE 71 HB ILE 71 -5.238 7.149 5.598 631 HG12 ILE 71 2HG1 ILE 71 -4.336 5.653 8.106 632 HG13 ILE 71 3HG1 ILE 71 -5.709 5.227 7.093 633 HG21 ILE 71 1HG2 ILE 71 -3.492 8.796 6.115 634 HG22 ILE 71 2HG2 ILE 71 -2.779 7.205 5.862 635 HG23 ILE 71 3HG2 ILE 71 -2.966 7.836 7.499 636 HD11 ILE 71 3HD1 ILE 71 -4.156 4.772 5.232 637 HD12 ILE 71 1HD1 ILE 71 -3.869 3.763 6.649 638 HD13 ILE 71 2HD1 ILE 71 -2.801 5.121 6.311 639 H SER 72 H SER 72 -7.232 9.445 5.961 640 HA SER 72 HA SER 72 -5.668 11.795 5.799 641 HB2 SER 72 2HB SER 72 -7.721 12.797 4.768 642 HB3 SER 72 3HB SER 72 -7.329 11.214 4.094 643 HG SER 72 HG SER 72 -9.421 11.014 4.534 644 H LYS 73 H LYS 73 -8.037 10.752 8.125 645 HA LYS 73 HA LYS 73 -8.408 13.283 9.461 646 HB2 LYS 73 2HB LYS 73 -8.949 10.427 10.390 647 HB3 LYS 73 3HB LYS 73 -9.526 11.883 11.201 648 HG2 LYS 73 2HG LYS 73 -10.934 12.452 9.292 649 HG3 LYS 73 3HG LYS 73 -10.281 11.098 8.361 650 HD2 LYS 73 2HD LYS 73 -11.288 9.492 9.920 651 HD3 LYS 73 3HD LYS 73 -11.858 10.809 10.951 652 HE2 LYS 73 2HE LYS 73 -13.678 9.921 9.557 653 HE3 LYS 73 3HE LYS 73 -13.333 11.598 9.142 654 HZ1 LYS 73 3HZ LYS 73 -12.412 9.214 7.627 655 HZ2 LYS 73 1HZ LYS 73 -12.069 10.821 7.228 656 HZ3 LYS 73 2HZ LYS 73 -13.660 10.257 7.179 657 H LEU 74 H LEU 74 -6.122 10.661 9.645 658 HA LEU 74 HA LEU 74 -5.043 11.355 12.265 659 HB2 LEU 74 2HB LEU 74 -4.132 9.294 10.211 660 HB3 LEU 74 3HB LEU 74 -3.520 9.431 11.855 661 HG LEU 74 HG LEU 74 -6.395 8.742 11.127 662 HD11 LEU 74 1HD1 LEU 74 -4.197 6.907 12.134 663 HD12 LEU 74 2HD1 LEU 74 -4.873 6.929 10.503 664 HD13 LEU 74 3HD1 LEU 74 -5.887 6.462 11.866 665 HD21 LEU 74 3HD2 LEU 74 -6.660 8.207 13.522 666 HD22 LEU 74 1HD2 LEU 74 -6.274 9.908 13.267 667 HD23 LEU 74 2HD2 LEU 74 -5.027 8.797 13.839 668 H GLY 75 H GLY 75 -4.134 11.628 8.871 669 HA2 GLY 75 2HA GLY 75 -2.658 12.965 7.771 670 HA3 GLY 75 3HA GLY 75 -2.301 13.774 9.284 671 H TYR 76 H TYR 76 -1.546 10.894 7.338 672 HA TYR 76 HA TYR 76 1.247 11.441 7.620 673 HB2 TYR 76 2HB TYR 76 1.927 9.106 8.328 674 HB3 TYR 76 3HB TYR 76 1.196 10.067 9.592 675 HD1 TYR 76 HD2 TYR 76 0.512 7.247 7.221 676 HD2 TYR 76 HD1 TYR 76 -0.706 9.242 10.799 677 HE1 TYR 76 HE2 TYR 76 -0.985 5.378 7.759 678 HE2 TYR 76 HE1 TYR 76 -2.194 7.360 11.334 679 HH TYR 76 HH TYR 76 -3.384 5.533 10.084 680 H LYS 77 H LYS 77 2.566 10.243 6.055 681 HA LYS 77 HA LYS 77 1.057 10.020 3.600 682 HB2 LYS 77 2HB LYS 77 3.229 11.283 3.703 683 HB3 LYS 77 3HB LYS 77 4.070 9.741 3.905 684 HG2 LYS 77 2HG LYS 77 3.298 8.972 1.728 685 HG3 LYS 77 3HG LYS 77 2.273 10.395 1.540 686 HD2 LYS 77 2HD LYS 77 4.304 11.822 1.473 687 HD3 LYS 77 3HD LYS 77 5.298 10.372 1.618 688 HE2 LYS 77 2HE LYS 77 4.352 9.519 -0.506 689 HE3 LYS 77 3HE LYS 77 3.379 10.985 -0.648 690 HZ1 LYS 77 3HZ LYS 77 5.330 11.138 -2.012 691 HZ2 LYS 77 1HZ LYS 77 6.341 10.838 -0.686 692 HZ3 LYS 77 2HZ LYS 77 5.437 12.269 -0.758 693 H VAL 78 H VAL 78 0.574 8.257 2.495 694 HA VAL 78 HA VAL 78 1.787 5.639 3.191 695 HB VAL 78 HB VAL 78 -1.062 6.200 2.230 696 HG11 VAL 78 1HG1 VAL 78 -0.261 4.077 1.305 697 HG12 VAL 78 2HG1 VAL 78 -1.484 3.783 2.540 698 HG13 VAL 78 3HG1 VAL 78 0.221 3.531 2.913 699 HG21 VAL 78 3HG2 VAL 78 -0.748 6.819 4.593 700 HG22 VAL 78 1HG2 VAL 78 -0.100 5.213 4.946 701 HG23 VAL 78 2HG2 VAL 78 -1.785 5.399 4.455 702 H PHE 79 H PHE 79 2.463 4.380 1.505 703 HA PHE 79 HA PHE 79 2.596 5.555 -1.201 704 HB2 PHE 79 2HB PHE 79 4.297 3.376 0.110 705 HB3 PHE 79 3HB PHE 79 4.543 4.040 -1.501 706 HD1 PHE 79 HD1 PHE 79 5.240 6.464 -1.747 707 HD2 PHE 79 HD2 PHE 79 5.230 4.469 2.037 708 HE1 PHE 79 HE1 PHE 79 6.738 8.183 -0.832 709 HE2 PHE 79 HE2 PHE 79 6.731 6.196 2.940 710 HZ PHE 79 HZ PHE 79 7.485 8.051 1.509 711 H LEU 80 H LEU 80 1.142 4.660 -2.581 712 HA LEU 80 HA LEU 80 0.167 1.899 -2.138 713 HB2 LEU 80 2HB LEU 80 -1.603 3.558 -2.263 714 HB3 LEU 80 3HB LEU 80 -0.963 4.224 -3.757 715 HG LEU 80 HG LEU 80 -1.628 2.213 -5.001 716 HD11 LEU 80 1HD1 LEU 80 -2.906 0.386 -3.996 717 HD12 LEU 80 2HD1 LEU 80 -2.665 1.085 -2.394 718 HD13 LEU 80 3HD1 LEU 80 -1.285 0.492 -3.316 719 HD21 LEU 80 3HD2 LEU 80 -3.301 3.984 -4.747 720 HD22 LEU 80 1HD2 LEU 80 -3.921 3.208 -3.288 721 HD23 LEU 80 2HD2 LEU 80 -4.058 2.398 -4.851 722 H LEU 81 H LEU 81 0.463 0.336 -3.619 723 HA LEU 81 HA LEU 81 1.552 0.943 -6.281 724 HB2 LEU 81 2HB LEU 81 3.377 0.056 -4.822 725 HB3 LEU 81 3HB LEU 81 2.410 -1.377 -4.504 726 HG LEU 81 HG LEU 81 2.499 -1.961 -6.939 727 HD11 LEU 81 1HD1 LEU 81 4.351 0.421 -7.171 728 HD12 LEU 81 2HD1 LEU 81 2.765 0.236 -7.919 729 HD13 LEU 81 3HD1 LEU 81 4.098 -0.801 -8.417 730 HD21 LEU 81 3HD2 LEU 81 5.218 -1.614 -5.637 731 HD22 LEU 81 1HD2 LEU 81 4.844 -2.695 -6.982 732 HD23 LEU 81 2HD2 LEU 81 4.111 -2.971 -5.405 733 H LEU 82 H LEU 82 0.096 0.345 -7.675 734 HA LEU 82 HA LEU 82 -1.790 -1.888 -7.232 735 HB2 LEU 82 2HB LEU 82 -1.789 0.394 -9.266 736 HB3 LEU 82 3HB LEU 82 -3.049 -0.819 -9.113 737 HG LEU 82 HG LEU 82 -2.367 1.208 -6.947 738 HD11 LEU 82 1HD1 LEU 82 -4.378 2.425 -7.619 739 HD12 LEU 82 2HD1 LEU 82 -4.652 1.298 -8.949 740 HD13 LEU 82 3HD1 LEU 82 -3.230 2.345 -8.952 741 HD21 LEU 82 3HD2 LEU 82 -4.498 0.512 -5.931 742 HD22 LEU 82 1HD2 LEU 82 -3.378 -0.843 -6.061 743 HD23 LEU 82 2HD2 LEU 82 -4.721 -0.698 -7.197 744 H ALA 83 H ALA 83 -1.235 -3.795 -8.311 745 HA ALA 83 HA ALA 83 0.256 -3.557 -10.880 746 HB1 ALA 83 3HB ALA 83 1.621 -5.470 -10.334 747 HB2 ALA 83 1HB ALA 83 0.766 -5.710 -8.815 748 HB3 ALA 83 2HB ALA 83 1.768 -4.285 -9.038 749 H ASP 84 H ASP 84 -1.126 -4.134 -12.415 750 HA ASP 84 HA ASP 84 -2.088 -6.816 -12.610 751 HB2 ASP 84 2HB ASP 84 -3.875 -5.930 -11.124 752 HB3 ASP 84 3HB ASP 84 -4.205 -4.637 -12.273 753 H GLN 85 H GLN 85 -2.769 -7.329 -14.712 754 HA GLN 85 HA GLN 85 -1.620 -5.732 -16.779 755 HB2 GLN 85 2HB GLN 85 -3.397 -8.199 -17.004 756 HB3 GLN 85 3HB GLN 85 -2.455 -7.493 -18.317 757 HG2 GLN 85 2HG GLN 85 -0.375 -7.947 -16.989 758 HG3 GLN 85 3HG GLN 85 -1.366 -8.791 -15.803 759 HE21 GLN 85 1HE2 GLN 85 -0.102 -8.879 -19.067 760 HE22 GLN 85 2HE2 GLN 85 -0.406 -10.556 -19.353 761 H ASP 86 H ASP 86 -4.974 -6.397 -15.748 762 HA ASP 86 HA ASP 86 -6.105 -4.546 -17.680 763 HB2 ASP 86 2HB ASP 86 -7.461 -6.484 -16.888 764 HB3 ASP 86 3HB ASP 86 -7.454 -5.819 -15.260 765 H GLU 87 H GLU 87 -4.792 -2.804 -17.222 766 HA GLU 87 HA GLU 87 -4.654 -1.508 -14.665 767 HB2 GLU 87 2HB GLU 87 -3.352 0.189 -15.824 768 HB3 GLU 87 3HB GLU 87 -2.801 -1.425 -16.259 769 HG2 GLU 87 2HG GLU 87 -3.968 -1.283 -18.409 770 HG3 GLU 87 3HG GLU 87 -4.603 0.309 -17.975 771 H ASN 88 H ASN 88 -6.943 -1.483 -17.169 772 HA ASN 88 HA ASN 88 -7.970 1.126 -17.173 773 HB2 ASN 88 2HB ASN 88 -8.662 -0.662 -18.770 774 HB3 ASN 88 3HB ASN 88 -9.496 -1.512 -17.474 775 HD21 ASN 88 1HD2 ASN 88 -11.525 -0.721 -16.778 776 HD22 ASN 88 2HD2 ASN 88 -12.385 0.512 -17.634 777 H GLU 89 H GLU 89 -8.565 -1.587 -14.993 778 HA GLU 89 HA GLU 89 -10.411 -0.383 -13.220 779 HB2 GLU 89 2HB GLU 89 -9.999 -2.802 -13.275 780 HB3 GLU 89 3HB GLU 89 -8.323 -2.565 -12.797 781 HG2 GLU 89 2HG GLU 89 -9.619 -3.390 -10.916 782 HG3 GLU 89 3HG GLU 89 -9.070 -1.748 -10.584 783 H LEU 90 H LEU 90 -6.862 -0.612 -13.142 784 HA LEU 90 HA LEU 90 -6.495 0.690 -10.623 785 HB2 LEU 90 2HB LEU 90 -4.422 0.314 -12.823 786 HB3 LEU 90 3HB LEU 90 -4.115 0.552 -11.109 787 HG LEU 90 HG LEU 90 -5.321 -1.935 -12.393 788 HD11 LEU 90 1HD1 LEU 90 -2.931 -1.753 -12.810 789 HD12 LEU 90 2HD1 LEU 90 -3.231 -3.039 -11.646 790 HD13 LEU 90 3HD1 LEU 90 -2.611 -1.482 -11.094 791 HD21 LEU 90 3HD2 LEU 90 -4.758 -1.412 -9.451 792 HD22 LEU 90 1HD2 LEU 90 -5.249 -2.961 -10.147 793 HD23 LEU 90 2HD2 LEU 90 -6.349 -1.585 -10.198 794 H GLU 91 H GLU 91 -7.048 1.854 -13.783 795 HA GLU 91 HA GLU 91 -5.481 4.249 -13.721 796 HB2 GLU 91 2HB GLU 91 -6.100 3.071 -15.825 797 HB3 GLU 91 3HB GLU 91 -7.795 3.455 -15.550 798 HG2 GLU 91 2HG GLU 91 -6.759 4.935 -17.229 799 HG3 GLU 91 3HG GLU 91 -7.340 5.834 -15.829 800 H GLU 92 H GLU 92 -8.942 3.503 -13.253 801 HA GLU 92 HA GLU 92 -9.716 6.152 -12.526 802 HB2 GLU 92 2HB GLU 92 -10.954 3.410 -12.083 803 HB3 GLU 92 3HB GLU 92 -11.679 4.849 -11.374 804 HG2 GLU 92 2HG GLU 92 -11.206 4.414 -14.337 805 HG3 GLU 92 3HG GLU 92 -12.746 4.210 -13.499 806 H PHE 93 H PHE 93 -8.590 3.332 -10.727 807 HA PHE 93 HA PHE 93 -9.261 4.185 -8.141 808 HB2 PHE 93 2HB PHE 93 -8.676 1.810 -8.912 809 HB3 PHE 93 3HB PHE 93 -6.980 2.273 -8.812 810 HD1 PHE 93 HD1 PHE 93 -10.107 1.869 -6.835 811 HD2 PHE 93 HD2 PHE 93 -5.864 2.329 -6.652 812 HE1 PHE 93 HE1 PHE 93 -10.139 1.358 -4.436 813 HE2 PHE 93 HE2 PHE 93 -5.912 1.807 -4.252 814 HZ PHE 93 HZ PHE 93 -8.050 1.325 -3.143 815 H LYS 94 H LYS 94 -6.209 4.462 -9.966 816 HA LYS 94 HA LYS 94 -4.599 5.523 -7.937 817 HB2 LYS 94 2HB LYS 94 -3.022 6.188 -9.655 818 HB3 LYS 94 3HB LYS 94 -3.703 4.628 -10.097 819 HG2 LYS 94 2HG LYS 94 -5.111 5.643 -11.789 820 HG3 LYS 94 3HG LYS 94 -4.658 7.263 -11.258 821 HD2 LYS 94 2HD LYS 94 -3.448 6.776 -13.282 822 HD3 LYS 94 3HD LYS 94 -2.294 6.773 -11.949 823 HE2 LYS 94 2HE LYS 94 -2.403 4.294 -11.909 824 HE3 LYS 94 3HE LYS 94 -3.503 4.338 -13.284 825 HZ1 LYS 94 3HZ LYS 94 -1.300 3.931 -14.070 826 HZ2 LYS 94 1HZ LYS 94 -0.682 5.265 -13.230 827 HZ3 LYS 94 2HZ LYS 94 -1.728 5.496 -14.534 828 H ARG 95 H ARG 95 -6.889 7.104 -10.089 829 HA ARG 95 HA ARG 95 -5.928 9.780 -9.732 830 HB2 ARG 95 2HB ARG 95 -8.600 8.757 -10.796 831 HB3 ARG 95 3HB ARG 95 -8.045 10.427 -10.903 832 HG2 ARG 95 2HG ARG 95 -6.153 9.726 -12.315 833 HG3 ARG 95 3HG ARG 95 -6.664 8.045 -12.178 834 HD2 ARG 95 2HD ARG 95 -8.825 8.672 -13.311 835 HD3 ARG 95 3HD ARG 95 -8.166 10.297 -13.565 836 HE ARG 95 HE ARG 95 -6.590 8.037 -14.545 837 HH11 ARG 95 1HH1 ARG 95 -8.820 10.613 -15.413 838 HH12 ARG 95 2HH1 ARG 95 -8.434 10.542 -17.099 839 HH21 ARG 95 1HH2 ARG 95 -6.084 7.959 -16.748 840 HH22 ARG 95 2HH2 ARG 95 -6.874 9.031 -17.862 841 H LYS 96 H LYS 96 -8.355 7.794 -8.125 842 HA LYS 96 HA LYS 96 -9.518 9.837 -6.502 843 HB2 LYS 96 2HB LYS 96 -9.470 6.806 -6.360 844 HB3 LYS 96 3HB LYS 96 -10.056 7.715 -4.974 845 HG2 LYS 96 2HG LYS 96 -11.905 6.963 -6.400 846 HG3 LYS 96 3HG LYS 96 -11.825 8.727 -6.333 847 HD2 LYS 96 2HD LYS 96 -10.701 8.741 -8.551 848 HD3 LYS 96 3HD LYS 96 -10.811 6.980 -8.608 849 HE2 LYS 96 2HE LYS 96 -13.260 7.111 -8.632 850 HE3 LYS 96 3HE LYS 96 -13.184 8.870 -8.491 851 HZ1 LYS 96 3HZ LYS 96 -12.078 8.971 -10.628 852 HZ2 LYS 96 1HZ LYS 96 -13.554 8.161 -10.775 853 HZ3 LYS 96 2HZ LYS 96 -12.113 7.285 -10.766 854 H ILE 97 H ILE 97 -6.898 7.482 -5.960 855 HA ILE 97 HA ILE 97 -6.388 8.154 -3.242 856 HB ILE 97 HB ILE 97 -4.562 6.757 -5.252 857 HG12 ILE 97 2HG1 ILE 97 -6.671 5.569 -5.188 858 HG13 ILE 97 3HG1 ILE 97 -5.505 4.624 -4.286 859 HG21 ILE 97 1HG2 ILE 97 -3.511 5.677 -3.280 860 HG22 ILE 97 2HG2 ILE 97 -4.482 6.693 -2.216 861 HG23 ILE 97 3HG2 ILE 97 -3.287 7.428 -3.284 862 HD11 ILE 97 3HD1 ILE 97 -7.656 4.573 -3.210 863 HD12 ILE 97 1HD1 ILE 97 -7.709 6.334 -3.124 864 HD13 ILE 97 2HD1 ILE 97 -6.518 5.437 -2.184 865 H GLU 98 H GLU 98 -4.956 9.159 -6.300 866 HA GLU 98 HA GLU 98 -2.838 10.779 -5.363 867 HB2 GLU 98 2HB GLU 98 -3.049 9.966 -7.698 868 HB3 GLU 98 3HB GLU 98 -4.478 10.972 -7.931 869 HG2 GLU 98 2HG GLU 98 -3.053 12.991 -7.561 870 HG3 GLU 98 3HG GLU 98 -1.643 11.935 -7.445 871 H SER 99 H SER 99 -6.272 11.402 -5.979 872 HA SER 99 HA SER 99 -6.194 14.241 -5.563 873 HB2 SER 99 2HB SER 99 -7.962 13.102 -6.908 874 HB3 SER 99 3HB SER 99 -8.597 12.369 -5.435 875 HG SER 99 HG SER 99 -8.559 15.096 -6.200 876 H GLN 100 H GLN 100 -6.711 11.422 -3.491 877 HA GLN 100 HA GLN 100 -7.507 12.828 -1.117 878 HB2 GLN 100 2HB GLN 100 -6.279 10.055 -1.448 879 HB3 GLN 100 3HB GLN 100 -6.959 10.672 0.055 880 HG2 GLN 100 2HG GLN 100 -9.177 10.784 -0.945 881 HG3 GLN 100 3HG GLN 100 -8.532 10.293 -2.508 882 HE21 GLN 100 1HE2 GLN 100 -10.620 9.011 -0.985 883 HE22 GLN 100 2HE2 GLN 100 -10.084 7.409 -0.623 884 H GLY 101 H GLY 101 -4.518 12.559 -2.732 885 HA2 GLY 101 2HA GLY 101 -2.684 13.952 -2.266 886 HA3 GLY 101 3HA GLY 101 -3.191 14.065 -0.586 887 H TYR 102 H TYR 102 -3.169 10.888 -1.891 888 HA TYR 102 HA TYR 102 -0.730 10.231 -0.366 889 HB2 TYR 102 2HB TYR 102 -2.981 8.450 -1.401 890 HB3 TYR 102 3HB TYR 102 -1.551 7.853 -0.554 891 HD1 TYR 102 HD2 TYR 102 -1.150 8.520 1.842 892 HD2 TYR 102 HD1 TYR 102 -4.803 9.445 -0.175 893 HE1 TYR 102 HE2 TYR 102 -2.225 8.989 3.997 894 HE2 TYR 102 HE1 TYR 102 -5.866 9.926 1.983 895 HH TYR 102 HH TYR 102 -4.108 10.314 4.831 896 H GLU 103 H GLU 103 0.798 8.775 -1.221 897 HA GLU 103 HA GLU 103 1.502 9.230 -3.957 898 HB2 GLU 103 2HB GLU 103 3.092 8.851 -1.953 899 HB3 GLU 103 3HB GLU 103 2.708 7.143 -2.082 900 HG2 GLU 103 2HG GLU 103 4.785 7.520 -3.217 901 HG3 GLU 103 3HG GLU 103 3.559 7.199 -4.446 902 H VAL 104 H VAL 104 0.906 7.983 -5.678 903 HA VAL 104 HA VAL 104 0.192 5.163 -5.260 904 HB VAL 104 HB VAL 104 -1.965 6.294 -5.343 905 HG11 VAL 104 1HG1 VAL 104 -2.775 7.571 -7.270 906 HG12 VAL 104 2HG1 VAL 104 -1.201 7.427 -8.053 907 HG13 VAL 104 3HG1 VAL 104 -1.360 8.347 -6.554 908 HG21 VAL 104 3HG2 VAL 104 -3.011 5.025 -7.163 909 HG22 VAL 104 1HG2 VAL 104 -1.764 4.059 -6.380 910 HG23 VAL 104 2HG2 VAL 104 -1.446 4.807 -7.948 911 H ARG 105 H ARG 105 1.389 3.986 -6.486 912 HA ARG 105 HA ARG 105 2.234 4.872 -9.177 913 HB2 ARG 105 2HB ARG 105 3.623 2.978 -7.225 914 HB3 ARG 105 3HB ARG 105 4.125 3.209 -8.891 915 HG2 ARG 105 2HG ARG 105 4.111 5.402 -6.795 916 HG3 ARG 105 3HG ARG 105 5.518 4.433 -7.221 917 HD2 ARG 105 2HD ARG 105 5.759 6.468 -8.408 918 HD3 ARG 105 3HD ARG 105 5.230 5.289 -9.608 919 HE ARG 105 HE ARG 105 3.088 6.782 -8.410 920 HH11 ARG 105 1HH1 ARG 105 5.482 6.929 -10.987 921 HH12 ARG 105 2HH1 ARG 105 4.541 8.041 -11.935 922 HH21 ARG 105 1HH2 ARG 105 1.859 8.161 -9.707 923 HH22 ARG 105 2HH2 ARG 105 2.512 8.728 -11.214 924 H LYS 106 H LYS 106 1.647 3.592 -10.821 925 HA LYS 106 HA LYS 106 0.364 0.974 -10.279 926 HB2 LYS 106 2HB LYS 106 -1.279 2.396 -11.282 927 HB3 LYS 106 3HB LYS 106 -0.149 3.077 -12.436 928 HG2 LYS 106 2HG LYS 106 -0.820 0.131 -12.604 929 HG3 LYS 106 3HG LYS 106 -1.983 1.316 -13.206 930 HD2 LYS 106 2HD LYS 106 -0.408 2.161 -14.836 931 HD3 LYS 106 3HD LYS 106 0.924 1.259 -14.115 932 HE2 LYS 106 2HE LYS 106 -0.104 -0.852 -14.821 933 HE3 LYS 106 3HE LYS 106 -1.462 0.036 -15.501 934 HZ1 LYS 106 3HZ LYS 106 0.175 1.169 -16.977 935 HZ2 LYS 106 1HZ LYS 106 -0.008 -0.489 -17.266 936 HZ3 LYS 106 2HZ LYS 106 1.343 0.082 -16.431 937 H VAL 107 H VAL 107 1.042 -0.761 -11.397 938 HA VAL 107 HA VAL 107 3.116 -0.641 -13.440 939 HB VAL 107 HB VAL 107 4.481 -2.403 -12.298 940 HG11 VAL 107 1HG1 VAL 107 4.243 0.135 -10.636 941 HG12 VAL 107 2HG1 VAL 107 5.216 -0.064 -12.094 942 HG13 VAL 107 3HG1 VAL 107 5.616 -0.977 -10.640 943 HG21 VAL 107 3HG2 VAL 107 2.782 -3.370 -10.848 944 HG22 VAL 107 1HG2 VAL 107 2.670 -1.873 -9.918 945 HG23 VAL 107 2HG2 VAL 107 4.147 -2.833 -9.873 946 H THR 108 H THR 108 3.488 -2.989 -14.225 947 HA THR 108 HA THR 108 1.067 -4.682 -14.012 948 HB THR 108 HB THR 108 1.548 -5.358 -16.459 949 HG1 THR 108 HG1 THR 108 3.599 -4.421 -16.696 950 HG21 THR 108 3HG2 THR 108 0.631 -2.496 -15.990 951 HG22 THR 108 1HG2 THR 108 -0.393 -3.934 -15.934 952 HG23 THR 108 2HG2 THR 108 0.354 -3.442 -17.453 953 H ASP 109 H ASP 109 4.541 -4.501 -14.781 954 HA ASP 109 HA ASP 109 4.915 -7.385 -14.701 955 HB2 ASP 109 2HB ASP 109 6.838 -5.059 -15.102 956 HB3 ASP 109 3HB ASP 109 7.381 -6.732 -15.041 957 H ASP 110 H ASP 110 6.649 -8.325 -13.408 958 HA ASP 110 HA ASP 110 6.125 -7.888 -10.623 959 HB2 ASP 110 2HB ASP 110 7.483 -9.889 -10.234 960 HB3 ASP 110 3HB ASP 110 6.357 -10.175 -11.552 961 H GLU 111 H GLU 111 9.079 -7.673 -12.661 962 HA GLU 111 HA GLU 111 10.749 -6.709 -10.564 963 HB2 GLU 111 2HB GLU 111 12.360 -6.142 -12.426 964 HB3 GLU 111 3HB GLU 111 11.822 -7.810 -12.369 965 HG2 GLU 111 2HG GLU 111 11.866 -7.284 -14.652 966 HG3 GLU 111 3HG GLU 111 10.163 -7.212 -14.217 967 H GLU 112 H GLU 112 8.653 -5.176 -12.866 968 HA GLU 112 HA GLU 112 9.467 -2.484 -12.556 969 HB2 GLU 112 2HB GLU 112 8.063 -3.358 -14.436 970 HB3 GLU 112 3HB GLU 112 6.721 -3.574 -13.317 971 HG2 GLU 112 2HG GLU 112 6.668 -1.135 -12.931 972 HG3 GLU 112 3HG GLU 112 8.013 -0.931 -14.050 973 H ALA 113 H ALA 113 7.023 -4.485 -10.916 974 HA ALA 113 HA ALA 113 6.053 -2.563 -9.096 975 HB1 ALA 113 3HB ALA 113 4.939 -4.718 -9.490 976 HB2 ALA 113 1HB ALA 113 5.261 -4.477 -7.772 977 HB3 ALA 113 2HB ALA 113 6.277 -5.571 -8.718 978 H LEU 114 H LEU 114 8.725 -4.885 -8.842 979 HA LEU 114 HA LEU 114 9.400 -4.479 -6.142 980 HB2 LEU 114 2HB LEU 114 11.126 -5.427 -8.459 981 HB3 LEU 114 3HB LEU 114 11.594 -5.538 -6.768 982 HG LEU 114 HG LEU 114 9.245 -6.989 -8.047 983 HD11 LEU 114 1HD1 LEU 114 11.398 -7.890 -8.779 984 HD12 LEU 114 2HD1 LEU 114 10.557 -9.025 -7.731 985 HD13 LEU 114 3HD1 LEU 114 11.910 -8.083 -7.099 986 HD21 LEU 114 3HD2 LEU 114 8.765 -6.443 -5.707 987 HD22 LEU 114 1HD2 LEU 114 10.285 -7.189 -5.206 988 HD23 LEU 114 2HD2 LEU 114 9.007 -8.173 -5.922 989 H LYS 115 H LYS 115 10.580 -2.868 -9.102 990 HA LYS 115 HA LYS 115 12.739 -1.485 -7.835 991 HB2 LYS 115 2HB LYS 115 13.045 -0.335 -9.946 992 HB3 LYS 115 3HB LYS 115 12.687 -2.024 -10.274 993 HG2 LYS 115 2HG LYS 115 10.306 -1.343 -10.742 994 HG3 LYS 115 3HG LYS 115 10.818 0.337 -10.616 995 HD2 LYS 115 2HD LYS 115 11.821 -1.703 -12.642 996 HD3 LYS 115 3HD LYS 115 10.701 -0.383 -12.967 997 HE2 LYS 115 2HE LYS 115 13.587 -0.042 -12.085 998 HE3 LYS 115 3HE LYS 115 12.999 0.113 -13.739 999 HZ1 LYS 115 3HZ LYS 115 12.304 1.842 -11.433 1000 HZ2 LYS 115 1HZ LYS 115 11.550 1.933 -12.946 1001 HZ3 LYS 115 2HZ LYS 115 13.201 2.264 -12.802 1002 H ILE 116 H ILE 116 9.345 -0.812 -8.282 1003 HA ILE 116 HA ILE 116 9.341 1.942 -7.513 1004 HB ILE 116 HB ILE 116 7.143 -0.164 -7.275 1005 HG12 ILE 116 2HG1 ILE 116 7.880 0.242 -9.619 1006 HG13 ILE 116 3HG1 ILE 116 6.219 0.729 -9.346 1007 HG21 ILE 116 1HG2 ILE 116 5.564 1.738 -7.125 1008 HG22 ILE 116 2HG2 ILE 116 6.926 2.851 -7.038 1009 HG23 ILE 116 3HG2 ILE 116 6.670 1.669 -5.755 1010 HD11 ILE 116 3HD1 ILE 116 6.883 3.059 -9.338 1011 HD12 ILE 116 1HD1 ILE 116 7.426 2.245 -10.804 1012 HD13 ILE 116 2HD1 ILE 116 8.577 2.594 -9.517 1013 H VAL 117 H VAL 117 8.903 -1.131 -5.751 1014 HA VAL 117 HA VAL 117 8.368 -0.050 -3.182 1015 HB VAL 117 HB VAL 117 9.504 -2.800 -3.906 1016 HG11 VAL 117 1HG1 VAL 117 8.125 -1.932 -1.334 1017 HG12 VAL 117 2HG1 VAL 117 9.829 -2.348 -1.514 1018 HG13 VAL 117 3HG1 VAL 117 8.595 -3.585 -1.743 1019 HG21 VAL 117 3HG2 VAL 117 7.359 -2.377 -5.029 1020 HG22 VAL 117 1HG2 VAL 117 6.608 -1.969 -3.484 1021 HG23 VAL 117 2HG2 VAL 117 7.177 -3.614 -3.785 1022 H ARG 118 H ARG 118 11.341 -0.915 -4.858 1023 HA ARG 118 HA ARG 118 13.182 -0.643 -2.702 1024 HB2 ARG 118 2HB ARG 118 13.557 -0.461 -5.728 1025 HB3 ARG 118 3HB ARG 118 14.898 -0.469 -4.583 1026 HG2 ARG 118 2HG ARG 118 14.446 -2.702 -3.892 1027 HG3 ARG 118 3HG ARG 118 12.853 -2.703 -4.643 1028 HD2 ARG 118 2HD ARG 118 13.986 -2.607 -6.895 1029 HD3 ARG 118 3HD ARG 118 15.543 -2.776 -6.067 1030 HE ARG 118 HE ARG 118 14.156 -4.861 -5.101 1031 HH11 ARG 118 1HH1 ARG 118 14.709 -3.917 -8.438 1032 HH12 ARG 118 2HH1 ARG 118 14.599 -5.542 -9.030 1033 HH21 ARG 118 1HH2 ARG 118 13.999 -6.968 -5.876 1034 HH22 ARG 118 2HH2 ARG 118 14.195 -7.276 -7.578 1035 H GLU 119 H GLU 119 11.877 1.642 -5.082 1036 HA GLU 119 HA GLU 119 13.392 3.908 -4.161 1037 HB2 GLU 119 2HB GLU 119 10.934 3.660 -5.923 1038 HB3 GLU 119 3HB GLU 119 11.609 5.219 -5.468 1039 HG2 GLU 119 2HG GLU 119 13.800 4.465 -6.506 1040 HG3 GLU 119 3HG GLU 119 12.927 3.061 -7.123 1041 H PHE 120 H PHE 120 10.227 2.530 -3.376 1042 HA PHE 120 HA PHE 120 9.128 4.588 -1.833 1043 HB2 PHE 120 2HB PHE 120 8.726 1.586 -1.845 1044 HB3 PHE 120 3HB PHE 120 7.958 2.541 -0.589 1045 HD1 PHE 120 HD2 PHE 120 7.739 4.842 -3.079 1046 HD2 PHE 120 HD1 PHE 120 6.270 0.911 -2.208 1047 HE1 PHE 120 HE2 PHE 120 5.766 5.253 -4.492 1048 HE2 PHE 120 HE1 PHE 120 4.299 1.342 -3.620 1049 HZ PHE 120 HZ PHE 120 4.045 3.511 -4.756 1050 H MET 121 H MET 121 11.590 2.236 -1.044 1051 HA MET 121 HA MET 121 11.700 2.525 1.761 1052 HB2 MET 121 2HB MET 121 14.040 1.979 -0.133 1053 HB3 MET 121 3HB MET 121 14.003 1.650 1.599 1054 HG2 MET 121 2HG MET 121 12.359 0.311 -0.541 1055 HG3 MET 121 3HG MET 121 13.652 -0.408 0.429 1056 HE1 MET 121 3HE MET 121 11.818 -2.399 0.857 1057 HE2 MET 121 1HE MET 121 10.600 -1.473 -0.024 1058 HE3 MET 121 2HE MET 121 10.242 -2.095 1.585 1059 H GLN 122 H GLN 122 13.168 4.391 -0.867 1060 HA GLN 122 HA GLN 122 14.903 5.911 0.900 1061 HB2 GLN 122 2HB GLN 122 14.348 6.333 -2.072 1062 HB3 GLN 122 3HB GLN 122 15.698 6.989 -1.151 1063 HG2 GLN 122 2HG GLN 122 15.205 4.078 -1.825 1064 HG3 GLN 122 3HG GLN 122 16.483 5.114 -2.467 1065 HE21 GLN 122 1HE2 GLN 122 18.270 5.608 -1.102 1066 HE22 GLN 122 2HE2 GLN 122 18.620 4.684 0.318 1067 H LYS 123 H LYS 123 11.930 6.394 -0.881 1068 HA LYS 123 HA LYS 123 11.389 9.099 -0.273 1069 HB2 LYS 123 2HB LYS 123 9.559 6.737 -0.873 1070 HB3 LYS 123 3HB LYS 123 9.003 8.406 -0.801 1071 HG2 LYS 123 2HG LYS 123 10.348 9.007 -2.730 1072 HG3 LYS 123 3HG LYS 123 11.113 7.412 -2.751 1073 HD2 LYS 123 2HD LYS 123 9.044 6.337 -3.369 1074 HD3 LYS 123 3HD LYS 123 8.120 7.823 -3.108 1075 HE2 LYS 123 2HE LYS 123 8.402 7.481 -5.485 1076 HE3 LYS 123 3HE LYS 123 9.359 8.879 -5.008 1077 HZ1 LYS 123 3HZ LYS 123 11.311 7.378 -4.964 1078 HZ2 LYS 123 1HZ LYS 123 10.623 7.557 -6.497 1079 HZ3 LYS 123 2HZ LYS 123 10.347 6.152 -5.609 1080 H ALA 124 H ALA 124 10.620 6.065 1.408 1081 HA ALA 124 HA ALA 124 9.146 7.184 3.584 1082 HB1 ALA 124 3HB ALA 124 8.934 4.836 2.932 1083 HB2 ALA 124 1HB ALA 124 9.429 4.965 4.618 1084 HB3 ALA 124 2HB ALA 124 10.616 4.533 3.380 1085 H GLY 125 H GLY 125 12.561 6.512 3.011 1086 HA2 GLY 125 2HA GLY 125 13.580 7.087 5.600 1087 HA3 GLY 125 3HA GLY 125 14.472 7.191 4.080 1088 H SER 126 H SER 126 12.608 9.090 2.884 1089 HA SER 126 HA SER 126 13.671 11.573 3.840 1090 HB2 SER 126 2HB SER 126 11.453 11.042 1.819 1091 HB3 SER 126 3HB SER 126 12.271 12.588 2.063 1092 HG SER 126 HG SER 126 13.607 10.188 1.344 1093 H LEU 127 H LEU 127 10.690 9.791 4.385 1094 HA LEU 127 HA LEU 127 9.097 11.841 5.512 1095 HB2 LEU 127 2HB LEU 127 9.027 8.845 6.027 1096 HB3 LEU 127 3HB LEU 127 7.793 9.969 6.564 1097 HG LEU 127 HG LEU 127 8.431 9.183 3.697 1098 HD11 LEU 127 1HD1 LEU 127 6.114 8.347 3.689 1099 HD12 LEU 127 2HD1 LEU 127 5.936 8.796 5.386 1100 HD13 LEU 127 3HD1 LEU 127 7.093 7.547 4.917 1101 HD21 LEU 127 3HD2 LEU 127 6.454 11.294 4.630 1102 HD22 LEU 127 1HD2 LEU 127 6.622 10.685 2.980 1103 HD23 LEU 127 2HD2 LEU 127 7.941 11.585 3.723 1104 H GLU 128 H GLU 128 11.366 9.532 6.986 1105 HA GLU 128 HA GLU 128 10.878 10.488 9.693 1106 HB2 GLU 128 2HB GLU 128 12.450 8.806 10.409 1107 HB3 GLU 128 3HB GLU 128 11.428 8.089 9.171 1108 HG2 GLU 128 2HG GLU 128 13.220 8.393 7.506 1109 HG3 GLU 128 3HG GLU 128 14.242 9.125 8.738 1110 H HIS 129 H HIS 129 13.039 11.214 7.104 1111 HA HIS 129 HA HIS 129 15.318 12.236 8.370 1112 HB2 HIS 129 2HB HIS 129 15.116 11.714 5.925 1113 HB3 HIS 129 3HB HIS 129 14.048 13.091 5.725 1114 HD1 HIS 129 HD1 HIS 129 17.582 12.120 5.752 1115 HD2 HIS 129 HD2 HIS 129 15.414 15.657 6.002 1116 HE1 HIS 129 HE1 HIS 129 19.213 13.948 5.226 1117 HE2 HIS 129 HE2 HIS 129 17.836 16.046 5.198 1118 H HIS 130 H HIS 130 15.442 13.891 9.777 1119 HA HIS 130 HA HIS 130 13.201 15.551 10.345 1120 HB2 HIS 130 2HB HIS 130 14.657 16.608 12.098 1121 HB3 HIS 130 3HB HIS 130 14.556 14.860 12.203 1122 HD1 HIS 130 HD1 HIS 130 16.958 17.587 11.132 1123 HD2 HIS 130 HD2 HIS 130 16.993 13.582 12.220 1124 HE1 HIS 130 HE1 HIS 130 19.376 16.986 11.402 1125 HE2 HIS 130 HE2 HIS 130 19.371 14.528 11.921 1126 H HIS 131 H HIS 131 12.780 16.666 8.452 1127 HA HIS 131 HA HIS 131 14.497 19.000 7.841 1128 HB2 HIS 131 2HB HIS 131 13.797 17.626 5.883 1129 HB3 HIS 131 3HB HIS 131 12.104 17.858 6.314 1130 HD1 HIS 131 HD1 HIS 131 11.003 20.031 5.575 1131 HD2 HIS 131 HD2 HIS 131 15.079 19.982 4.809 1132 HE1 HIS 131 HE1 HIS 131 11.442 22.059 4.172 1133 HE2 HIS 131 HE2 HIS 131 13.877 21.913 3.586 1134 H HIS 132 H HIS 132 13.937 19.944 9.899 1135 HA HIS 132 HA HIS 132 11.187 20.565 10.530 1136 HB2 HIS 132 2HB HIS 132 11.956 21.484 12.558 1137 HB3 HIS 132 3HB HIS 132 13.116 20.200 12.238 1138 HD1 HIS 132 HD1 HIS 132 12.963 23.619 13.286 1139 HD2 HIS 132 HD2 HIS 132 15.615 21.400 10.984 1140 HE1 HIS 132 HE1 HIS 132 15.102 24.930 13.268 1141 HE2 HIS 132 HE2 HIS 132 16.688 23.566 11.878 1142 H HIS 133 H HIS 133 10.198 22.622 10.474 1143 HA HIS 133 HA HIS 133 11.560 24.804 9.058 1144 HB2 HIS 133 2HB HIS 133 10.528 23.551 7.232 1145 HB3 HIS 133 3HB HIS 133 8.985 23.503 8.073 1146 HD1 HIS 133 HD1 HIS 133 11.332 26.279 6.853 1147 HD2 HIS 133 HD2 HIS 133 7.283 25.367 7.063 1148 HE1 HIS 133 HE1 HIS 133 10.146 28.213 5.775 1149 HE2 HIS 133 HE2 HIS 133 7.709 27.609 5.857 1150 H HIS 134 H HIS 134 11.516 25.899 10.967 1151 HA HIS 134 HA HIS 134 8.957 26.685 12.177 1152 HB2 HIS 134 2HB HIS 134 10.765 25.947 13.710 1153 HB3 HIS 134 3HB HIS 134 11.828 27.201 13.084 1154 HD1 HIS 134 HD1 HIS 134 8.768 26.720 15.220 1155 HD2 HIS 134 HD2 HIS 134 11.442 29.740 14.221 1156 HE1 HIS 134 HE1 HIS 134 8.278 28.606 16.804 1157 HE2 HIS 134 HE2 HIS 134 9.773 30.476 16.053 Start of MODEL 3 1 H1 MET 1 1H MET 1 3.330 9.404 13.931 2 H2 MET 1 2H MET 1 3.782 11.031 13.846 3 H3 MET 1 3H MET 1 4.933 9.848 14.212 4 HA MET 1 HA MET 1 3.476 10.073 11.652 5 HB2 MET 1 2HB MET 1 5.139 11.911 12.062 6 HB3 MET 1 3HB MET 1 6.393 10.701 12.309 7 HG2 MET 1 2HG MET 1 6.518 11.685 10.071 8 HG3 MET 1 3HG MET 1 6.145 9.960 9.982 9 HE1 MET 1 3HE MET 1 4.147 11.537 6.948 10 HE2 MET 1 1HE MET 1 5.411 10.401 7.415 11 HE3 MET 1 2HE MET 1 5.681 12.138 7.575 12 H LYS 2 H LYS 2 3.563 8.203 10.441 13 HA LYS 2 HA LYS 2 5.673 6.232 10.922 14 HB2 LYS 2 2HB LYS 2 4.069 4.359 11.191 15 HB3 LYS 2 3HB LYS 2 3.954 5.519 12.507 16 HG2 LYS 2 2HG LYS 2 1.911 6.468 11.530 17 HG3 LYS 2 3HG LYS 2 2.037 5.356 10.161 18 HD2 LYS 2 2HD LYS 2 1.781 3.428 11.713 19 HD3 LYS 2 3HD LYS 2 1.629 4.548 13.072 20 HE2 LYS 2 2HE LYS 2 -0.261 4.387 10.703 21 HE3 LYS 2 3HE LYS 2 -0.559 3.714 12.304 22 HZ1 LYS 2 3HZ LYS 2 -0.127 6.593 11.745 23 HZ2 LYS 2 1HZ LYS 2 -0.537 5.906 13.231 24 HZ3 LYS 2 2HZ LYS 2 -1.635 5.867 11.952 25 H ILE 3 H ILE 3 5.608 4.474 9.351 26 HA ILE 3 HA ILE 3 5.056 5.514 6.651 27 HB ILE 3 HB ILE 3 6.834 3.211 7.602 28 HG12 ILE 3 2HG1 ILE 3 7.682 5.935 6.501 29 HG13 ILE 3 3HG1 ILE 3 7.632 5.534 8.215 30 HG21 ILE 3 1HG2 ILE 3 5.985 2.756 5.335 31 HG22 ILE 3 2HG2 ILE 3 7.710 3.110 5.289 32 HG23 ILE 3 3HG2 ILE 3 6.548 4.338 4.787 33 HD11 ILE 3 3HD1 ILE 3 9.330 3.841 7.885 34 HD12 ILE 3 1HD1 ILE 3 9.878 5.412 7.315 35 HD13 ILE 3 2HD1 ILE 3 9.367 4.185 6.156 36 H LEU 4 H LEU 4 3.210 4.768 5.715 37 HA LEU 4 HA LEU 4 2.560 1.882 5.963 38 HB2 LEU 4 2HB LEU 4 0.751 4.289 5.817 39 HB3 LEU 4 3HB LEU 4 0.230 2.829 4.999 40 HG LEU 4 HG LEU 4 0.346 1.589 7.163 41 HD11 LEU 4 1HD1 LEU 4 0.488 2.820 9.286 42 HD12 LEU 4 2HD1 LEU 4 0.937 4.288 8.408 43 HD13 LEU 4 3HD1 LEU 4 1.996 2.875 8.379 44 HD21 LEU 4 3HD2 LEU 4 -1.691 2.578 8.116 45 HD22 LEU 4 1HD2 LEU 4 -1.766 2.496 6.359 46 HD23 LEU 4 2HD2 LEU 4 -1.442 4.039 7.158 47 H ILE 5 H ILE 5 3.005 0.816 4.171 48 HA ILE 5 HA ILE 5 2.753 2.147 1.530 49 HB ILE 5 HB ILE 5 4.503 -0.286 2.196 50 HG12 ILE 5 2HG1 ILE 5 5.350 2.602 1.653 51 HG13 ILE 5 3HG1 ILE 5 5.450 1.776 3.202 52 HG21 ILE 5 1HG2 ILE 5 4.269 1.320 -0.386 53 HG22 ILE 5 2HG2 ILE 5 3.644 -0.308 -0.121 54 HG23 ILE 5 3HG2 ILE 5 5.382 -0.021 -0.104 55 HD11 ILE 5 3HD1 ILE 5 7.615 1.918 2.167 56 HD12 ILE 5 1HD1 ILE 5 7.024 1.102 0.720 57 HD13 ILE 5 2HD1 ILE 5 7.107 0.232 2.255 58 H LEU 6 H LEU 6 0.906 1.519 0.623 59 HA LEU 6 HA LEU 6 -0.440 -0.963 1.374 60 HB2 LEU 6 2HB LEU 6 -1.312 1.220 -0.565 61 HB3 LEU 6 3HB LEU 6 -2.297 -0.116 -0.006 62 HG LEU 6 HG LEU 6 -1.326 2.210 1.669 63 HD11 LEU 6 1HD1 LEU 6 -3.696 2.858 1.759 64 HD12 LEU 6 2HD1 LEU 6 -4.116 1.512 0.695 65 HD13 LEU 6 3HD1 LEU 6 -3.100 2.829 0.101 66 HD21 LEU 6 3HD2 LEU 6 -1.423 0.203 3.050 67 HD22 LEU 6 1HD2 LEU 6 -3.076 -0.115 2.512 68 HD23 LEU 6 2HD2 LEU 6 -2.715 1.318 3.480 69 H ILE 7 H ILE 7 -0.681 -2.670 0.022 70 HA ILE 7 HA ILE 7 0.440 -2.566 -2.720 71 HB ILE 7 HB ILE 7 0.800 -4.868 -0.722 72 HG12 ILE 7 2HG1 ILE 7 2.338 -2.980 -0.264 73 HG13 ILE 7 3HG1 ILE 7 3.217 -4.386 -0.841 74 HG21 ILE 7 1HG2 ILE 7 2.163 -5.963 -2.492 75 HG22 ILE 7 2HG2 ILE 7 1.722 -4.678 -3.621 76 HG23 ILE 7 3HG2 ILE 7 0.481 -5.758 -2.983 77 HD11 ILE 7 3HD1 ILE 7 4.112 -2.331 -1.778 78 HD12 ILE 7 1HD1 ILE 7 2.538 -1.930 -2.466 79 HD13 ILE 7 2HD1 ILE 7 3.429 -3.337 -3.053 80 H ASN 8 H ASN 8 -1.217 -2.838 -4.020 81 HA ASN 8 HA ASN 8 -3.106 -5.080 -3.597 82 HB2 ASN 8 2HB ASN 8 -4.275 -2.889 -3.391 83 HB3 ASN 8 3HB ASN 8 -3.629 -2.381 -4.944 84 HD21 ASN 8 1HD2 ASN 8 -5.918 -4.482 -3.339 85 HD22 ASN 8 2HD2 ASN 8 -6.875 -4.821 -4.736 86 H THR 9 H THR 9 -1.930 -6.539 -4.795 87 HA THR 9 HA THR 9 -1.822 -6.018 -7.689 88 HB THR 9 HB THR 9 0.505 -5.951 -7.036 89 HG1 THR 9 HG1 THR 9 0.193 -7.055 -8.943 90 HG21 THR 9 3HG2 THR 9 1.676 -7.810 -5.943 91 HG22 THR 9 1HG2 THR 9 0.140 -8.657 -5.719 92 HG23 THR 9 2HG2 THR 9 0.439 -7.131 -4.881 93 H ASN 10 H ASN 10 -2.676 -7.551 -8.945 94 HA ASN 10 HA ASN 10 -4.114 -9.786 -7.785 95 HB2 ASN 10 2HB ASN 10 -4.976 -8.379 -9.705 96 HB3 ASN 10 3HB ASN 10 -3.721 -9.069 -10.725 97 HD21 ASN 10 1HD2 ASN 10 -5.184 -9.992 -12.148 98 HD22 ASN 10 2HD2 ASN 10 -6.195 -11.333 -11.738 99 H ASN 11 H ASN 11 -0.996 -9.251 -9.077 100 HA ASN 11 HA ASN 11 -0.292 -11.955 -9.742 101 HB2 ASN 11 2HB ASN 11 1.527 -9.645 -8.914 102 HB3 ASN 11 3HB ASN 11 2.023 -11.113 -9.744 103 HD21 ASN 11 1HD2 ASN 11 3.004 -9.590 -11.220 104 HD22 ASN 11 2HD2 ASN 11 2.061 -8.844 -12.460 105 H ASP 12 H ASP 12 -0.488 -13.476 -8.131 106 HA ASP 12 HA ASP 12 -0.838 -12.852 -5.405 107 HB2 ASP 12 2HB ASP 12 -1.910 -14.802 -6.327 108 HB3 ASP 12 3HB ASP 12 -0.373 -15.497 -6.829 109 H GLU 13 H GLU 13 1.902 -14.486 -7.030 110 HA GLU 13 HA GLU 13 3.362 -14.709 -4.549 111 HB2 GLU 13 2HB GLU 13 4.230 -15.417 -7.373 112 HB3 GLU 13 3HB GLU 13 5.134 -15.777 -5.904 113 HG2 GLU 13 2HG GLU 13 3.004 -17.046 -5.127 114 HG3 GLU 13 3HG GLU 13 2.494 -16.937 -6.807 115 H LEU 14 H LEU 14 3.152 -12.304 -7.017 116 HA LEU 14 HA LEU 14 5.610 -10.960 -6.629 117 HB2 LEU 14 2HB LEU 14 4.133 -10.338 -8.451 118 HB3 LEU 14 3HB LEU 14 2.855 -9.896 -7.331 119 HG LEU 14 HG LEU 14 4.130 -7.936 -6.579 120 HD11 LEU 14 1HD1 LEU 14 6.241 -7.246 -7.652 121 HD12 LEU 14 2HD1 LEU 14 6.316 -8.794 -8.501 122 HD13 LEU 14 3HD1 LEU 14 6.414 -8.741 -6.739 123 HD21 LEU 14 3HD2 LEU 14 2.643 -7.686 -8.522 124 HD22 LEU 14 1HD2 LEU 14 3.986 -8.053 -9.611 125 HD23 LEU 14 2HD2 LEU 14 4.017 -6.592 -8.620 126 H ILE 15 H ILE 15 2.534 -10.881 -4.853 127 HA ILE 15 HA ILE 15 2.996 -8.974 -2.898 128 HB ILE 15 HB ILE 15 1.632 -11.692 -2.595 129 HG12 ILE 15 2HG1 ILE 15 0.408 -8.936 -3.070 130 HG13 ILE 15 3HG1 ILE 15 0.625 -10.167 -4.307 131 HG21 ILE 15 1HG2 ILE 15 1.495 -9.323 -0.700 132 HG22 ILE 15 2HG2 ILE 15 2.243 -10.888 -0.374 133 HG23 ILE 15 3HG2 ILE 15 0.499 -10.778 -0.595 134 HD11 ILE 15 3HD1 ILE 15 -1.656 -10.104 -3.579 135 HD12 ILE 15 1HD1 ILE 15 -1.172 -10.344 -1.902 136 HD13 ILE 15 2HD1 ILE 15 -0.925 -11.630 -3.083 137 H LYS 16 H LYS 16 3.909 -12.427 -2.835 138 HA LYS 16 HA LYS 16 5.190 -12.581 -0.349 139 HB2 LYS 16 2HB LYS 16 5.744 -14.149 -2.905 140 HB3 LYS 16 3HB LYS 16 6.330 -14.610 -1.308 141 HG2 LYS 16 2HG LYS 16 4.098 -15.070 -0.526 142 HG3 LYS 16 3HG LYS 16 3.382 -14.335 -1.964 143 HD2 LYS 16 2HD LYS 16 3.315 -16.824 -2.053 144 HD3 LYS 16 3HD LYS 16 4.248 -16.131 -3.379 145 HE2 LYS 16 2HE LYS 16 6.345 -16.631 -2.114 146 HE3 LYS 16 3HE LYS 16 5.376 -17.407 -0.862 147 HZ1 LYS 16 3HZ LYS 16 4.646 -19.047 -2.439 148 HZ2 LYS 16 1HZ LYS 16 6.336 -18.981 -2.471 149 HZ3 LYS 16 2HZ LYS 16 5.438 -18.260 -3.711 150 H LYS 17 H LYS 17 6.481 -11.749 -3.529 151 HA LYS 17 HA LYS 17 9.243 -11.583 -2.850 152 HB2 LYS 17 2HB LYS 17 7.670 -10.297 -5.123 153 HB3 LYS 17 3HB LYS 17 9.430 -10.388 -5.047 154 HG2 LYS 17 2HG LYS 17 9.416 -12.779 -5.282 155 HG3 LYS 17 3HG LYS 17 7.673 -12.860 -5.009 156 HD2 LYS 17 2HD LYS 17 8.187 -13.167 -7.394 157 HD3 LYS 17 3HD LYS 17 7.266 -11.684 -7.140 158 HE2 LYS 17 2HE LYS 17 9.372 -10.378 -7.274 159 HE3 LYS 17 3HE LYS 17 10.264 -11.870 -7.575 160 HZ1 LYS 17 3HZ LYS 17 8.077 -10.853 -9.299 161 HZ2 LYS 17 1HZ LYS 17 9.071 -12.181 -9.606 162 HZ3 LYS 17 2HZ LYS 17 9.724 -10.624 -9.610 163 H ILE 18 H ILE 18 6.635 -9.188 -2.954 164 HA ILE 18 HA ILE 18 8.209 -6.869 -2.372 165 HB ILE 18 HB ILE 18 5.204 -7.394 -2.160 166 HG12 ILE 18 2HG1 ILE 18 6.823 -5.858 -4.256 167 HG13 ILE 18 3HG1 ILE 18 6.163 -7.475 -4.467 168 HG21 ILE 18 1HG2 ILE 18 4.891 -4.938 -2.002 169 HG22 ILE 18 2HG2 ILE 18 6.638 -4.727 -1.882 170 HG23 ILE 18 3HG2 ILE 18 5.763 -5.578 -0.610 171 HD11 ILE 18 3HD1 ILE 18 4.804 -5.852 -5.603 172 HD12 ILE 18 1HD1 ILE 18 4.581 -4.935 -4.112 173 HD13 ILE 18 2HD1 ILE 18 3.895 -6.555 -4.266 174 H LYS 19 H LYS 19 6.452 -9.239 -0.435 175 HA LYS 19 HA LYS 19 6.616 -7.975 2.091 176 HB2 LYS 19 2HB LYS 19 6.414 -10.935 1.370 177 HB3 LYS 19 3HB LYS 19 6.290 -10.315 3.018 178 HG2 LYS 19 2HG LYS 19 4.276 -9.080 2.476 179 HG3 LYS 19 3HG LYS 19 4.449 -9.469 0.765 180 HD2 LYS 19 2HD LYS 19 2.717 -10.869 1.761 181 HD3 LYS 19 3HD LYS 19 4.085 -11.866 1.272 182 HE2 LYS 19 2HE LYS 19 4.852 -11.976 3.604 183 HE3 LYS 19 3HE LYS 19 3.525 -10.924 4.105 184 HZ1 LYS 19 3HZ LYS 19 1.958 -12.596 3.419 185 HZ2 LYS 19 1HZ LYS 19 3.060 -13.267 4.509 186 HZ3 LYS 19 2HZ LYS 19 3.196 -13.599 2.855 187 H LYS 20 H LYS 20 8.699 -10.459 0.554 188 HA LYS 20 HA LYS 20 10.665 -10.528 2.587 189 HB2 LYS 20 2HB LYS 20 10.638 -11.405 -0.318 190 HB3 LYS 20 3HB LYS 20 12.139 -11.468 0.601 191 HG2 LYS 20 2HG LYS 20 9.569 -12.867 1.412 192 HG3 LYS 20 3HG LYS 20 10.914 -13.638 0.568 193 HD2 LYS 20 2HD LYS 20 12.400 -13.281 2.458 194 HD3 LYS 20 3HD LYS 20 11.200 -12.283 3.282 195 HE2 LYS 20 2HE LYS 20 10.881 -15.245 2.687 196 HE3 LYS 20 3HE LYS 20 11.376 -14.564 4.238 197 HZ1 LYS 20 3HZ LYS 20 8.782 -14.134 2.882 198 HZ2 LYS 20 1HZ LYS 20 9.255 -13.370 4.315 199 HZ3 LYS 20 2HZ LYS 20 9.050 -15.050 4.273 200 H GLU 21 H GLU 21 10.256 -8.442 -0.207 201 HA GLU 21 HA GLU 21 12.779 -7.226 -0.299 202 HB2 GLU 21 2HB GLU 21 11.008 -7.060 -2.069 203 HB3 GLU 21 3HB GLU 21 10.084 -5.995 -1.017 204 HG2 GLU 21 2HG GLU 21 11.266 -4.699 -2.694 205 HG3 GLU 21 3HG GLU 21 11.913 -4.339 -1.092 206 H VAL 22 H VAL 22 9.817 -6.298 1.458 207 HA VAL 22 HA VAL 22 11.068 -3.974 2.667 208 HB VAL 22 HB VAL 22 8.948 -3.574 3.788 209 HG11 VAL 22 1HG1 VAL 22 7.486 -3.287 1.835 210 HG12 VAL 22 2HG1 VAL 22 8.506 -4.380 0.897 211 HG13 VAL 22 3HG1 VAL 22 9.154 -2.839 1.463 212 HG21 VAL 22 3HG2 VAL 22 8.032 -6.267 2.718 213 HG22 VAL 22 1HG2 VAL 22 7.006 -5.087 3.542 214 HG23 VAL 22 2HG2 VAL 22 8.331 -5.860 4.409 215 H GLU 23 H GLU 23 10.541 -7.318 3.556 216 HA GLU 23 HA GLU 23 11.001 -7.177 6.350 217 HB2 GLU 23 2HB GLU 23 11.435 -9.428 4.345 218 HB3 GLU 23 3HB GLU 23 11.806 -9.630 6.055 219 HG2 GLU 23 2HG GLU 23 9.467 -9.229 6.649 220 HG3 GLU 23 3HG GLU 23 9.067 -8.922 4.960 221 H ASN 24 H ASN 24 13.167 -7.164 3.599 222 HA ASN 24 HA ASN 24 15.663 -7.517 4.771 223 HB2 ASN 24 2HB ASN 24 14.908 -5.628 2.494 224 HB3 ASN 24 3HB ASN 24 16.559 -6.103 2.889 225 HD21 ASN 24 1HD2 ASN 24 14.899 -6.518 0.450 226 HD22 ASN 24 2HD2 ASN 24 14.954 -8.221 0.160 227 H GLN 25 H GLN 25 13.545 -4.727 4.958 228 HA GLN 25 HA GLN 25 15.560 -3.223 6.542 229 HB2 GLN 25 2HB GLN 25 13.190 -2.191 4.936 230 HB3 GLN 25 3HB GLN 25 14.215 -1.183 5.950 231 HG2 GLN 25 2HG GLN 25 15.198 -2.756 3.548 232 HG3 GLN 25 3HG GLN 25 14.757 -1.052 3.517 233 HE21 GLN 25 1HE2 GLN 25 17.105 -3.376 4.684 234 HE22 GLN 25 2HE2 GLN 25 18.335 -2.225 5.057 235 H GLY 26 H GLY 26 13.320 -5.315 7.216 236 HA2 GLY 26 2HA GLY 26 12.298 -5.858 9.192 237 HA3 GLY 26 3HA GLY 26 13.016 -4.419 9.891 238 H TYR 27 H TYR 27 10.782 -4.440 7.130 239 HA TYR 27 HA TYR 27 8.811 -2.841 8.521 240 HB2 TYR 27 2HB TYR 27 8.908 -4.122 5.778 241 HB3 TYR 27 3HB TYR 27 7.418 -3.411 6.376 242 HD1 TYR 27 HD1 TYR 27 11.055 -2.334 6.258 243 HD2 TYR 27 HD2 TYR 27 6.977 -1.340 5.432 244 HE1 TYR 27 HE1 TYR 27 11.756 -0.149 5.368 245 HE2 TYR 27 HE2 TYR 27 7.681 0.837 4.553 246 HH TYR 27 HH TYR 27 10.975 1.609 3.930 247 H GLN 28 H GLN 28 6.919 -3.494 9.407 248 HA GLN 28 HA GLN 28 6.362 -6.324 9.832 249 HB2 GLN 28 2HB GLN 28 6.156 -4.599 11.660 250 HB3 GLN 28 3HB GLN 28 4.860 -3.827 10.756 251 HG2 GLN 28 2HG GLN 28 3.479 -5.844 10.989 252 HG3 GLN 28 3HG GLN 28 4.775 -6.651 11.869 253 HE21 GLN 28 1HE2 GLN 28 5.479 -4.202 13.413 254 HE22 GLN 28 2HE2 GLN 28 4.213 -4.020 14.569 255 H VAL 29 H VAL 29 5.284 -7.365 8.225 256 HA VAL 29 HA VAL 29 3.529 -5.948 6.365 257 HB VAL 29 HB VAL 29 4.171 -8.946 6.441 258 HG11 VAL 29 1HG1 VAL 29 2.993 -7.232 4.211 259 HG12 VAL 29 2HG1 VAL 29 2.111 -8.406 5.191 260 HG13 VAL 29 3HG1 VAL 29 3.380 -8.952 4.098 261 HG21 VAL 29 3HG2 VAL 29 5.523 -6.765 4.798 262 HG22 VAL 29 1HG2 VAL 29 5.827 -8.501 4.658 263 HG23 VAL 29 2HG2 VAL 29 6.244 -7.649 6.144 264 H ARG 30 H ARG 30 1.319 -6.112 6.344 265 HA ARG 30 HA ARG 30 -0.035 -7.930 8.244 266 HB2 ARG 30 2HB ARG 30 -0.287 -5.415 8.725 267 HB3 ARG 30 3HB ARG 30 -1.131 -5.275 7.184 268 HG2 ARG 30 2HG ARG 30 -2.781 -5.433 8.909 269 HG3 ARG 30 3HG ARG 30 -2.802 -6.954 8.012 270 HD2 ARG 30 2HD ARG 30 -2.933 -7.558 10.304 271 HD3 ARG 30 3HD ARG 30 -1.259 -7.886 9.843 272 HE ARG 30 HE ARG 30 -2.232 -5.604 11.427 273 HH11 ARG 30 1HH1 ARG 30 0.560 -7.565 10.471 274 HH12 ARG 30 2HH1 ARG 30 1.592 -6.809 11.640 275 HH21 ARG 30 1HH2 ARG 30 -0.892 -4.722 12.963 276 HH22 ARG 30 2HH2 ARG 30 0.775 -5.204 13.050 277 H ASP 31 H ASP 31 -1.564 -9.249 7.373 278 HA ASP 31 HA ASP 31 -2.182 -9.082 4.482 279 HB2 ASP 31 2HB ASP 31 -1.145 -11.203 5.565 280 HB3 ASP 31 3HB ASP 31 -2.689 -11.430 6.376 281 H VAL 32 H VAL 32 -4.054 -7.970 4.177 282 HA VAL 32 HA VAL 32 -6.284 -8.200 6.112 283 HB VAL 32 HB VAL 32 -5.821 -6.054 3.978 284 HG11 VAL 32 1HG1 VAL 32 -8.001 -6.204 6.099 285 HG12 VAL 32 2HG1 VAL 32 -8.221 -6.428 4.363 286 HG13 VAL 32 3HG1 VAL 32 -7.727 -4.857 4.988 287 HG21 VAL 32 3HG2 VAL 32 -5.517 -5.854 7.002 288 HG22 VAL 32 1HG2 VAL 32 -5.374 -4.513 5.859 289 HG23 VAL 32 2HG2 VAL 32 -4.210 -5.836 5.817 290 H ASN 33 H ASN 33 -7.882 -9.464 5.539 291 HA ASN 33 HA ASN 33 -8.294 -10.234 2.707 292 HB2 ASN 33 2HB ASN 33 -9.245 -11.729 5.198 293 HB3 ASN 33 3HB ASN 33 -9.274 -12.305 3.530 294 HD21 ASN 33 1HD2 ASN 33 -7.185 -12.713 2.493 295 HD22 ASN 33 2HD2 ASN 33 -5.820 -13.146 3.464 296 H ASP 34 H ASP 34 -10.131 -9.803 5.725 297 HA ASP 34 HA ASP 34 -12.630 -9.330 4.275 298 HB2 ASP 34 2HB ASP 34 -12.017 -9.776 7.237 299 HB3 ASP 34 3HB ASP 34 -13.640 -9.561 6.581 300 H SER 35 H SER 35 -14.100 -7.631 5.047 301 HA SER 35 HA SER 35 -13.030 -5.043 5.536 302 HB2 SER 35 2HB SER 35 -15.872 -6.063 6.019 303 HB3 SER 35 3HB SER 35 -15.387 -4.364 5.931 304 HG SER 35 HG SER 35 -14.928 -6.198 3.821 305 H ASP 36 H ASP 36 -14.146 -7.643 7.635 306 HA ASP 36 HA ASP 36 -14.013 -6.385 10.141 307 HB2 ASP 36 2HB ASP 36 -14.963 -8.661 9.820 308 HB3 ASP 36 3HB ASP 36 -13.367 -9.282 9.420 309 H GLU 37 H GLU 37 -11.520 -8.245 8.358 310 HA GLU 37 HA GLU 37 -9.335 -7.879 10.064 311 HB2 GLU 37 2HB GLU 37 -9.358 -8.208 7.033 312 HB3 GLU 37 3HB GLU 37 -7.913 -8.335 8.027 313 HG2 GLU 37 2HG GLU 37 -10.324 -10.163 8.142 314 HG3 GLU 37 3HG GLU 37 -8.755 -10.538 7.428 315 H LEU 38 H LEU 38 -10.642 -5.782 7.569 316 HA LEU 38 HA LEU 38 -8.553 -3.909 7.359 317 HB2 LEU 38 2HB LEU 38 -10.432 -4.053 5.742 318 HB3 LEU 38 3HB LEU 38 -11.550 -3.507 6.984 319 HG LEU 38 HG LEU 38 -10.294 -1.318 7.086 320 HD11 LEU 38 1HD1 LEU 38 -8.766 -0.718 5.273 321 HD12 LEU 38 2HD1 LEU 38 -8.819 -2.375 4.665 322 HD13 LEU 38 3HD1 LEU 38 -8.132 -2.035 6.257 323 HD21 LEU 38 3HD2 LEU 38 -12.363 -1.479 5.805 324 HD22 LEU 38 1HD2 LEU 38 -11.473 -2.023 4.380 325 HD23 LEU 38 2HD2 LEU 38 -11.229 -0.391 5.008 326 H LYS 39 H LYS 39 -11.622 -3.670 9.244 327 HA LYS 39 HA LYS 39 -10.807 -1.197 10.418 328 HB2 LYS 39 2HB LYS 39 -12.951 -1.343 11.730 329 HB3 LYS 39 3HB LYS 39 -13.096 -1.349 9.984 330 HG2 LYS 39 2HG LYS 39 -14.684 -2.906 10.653 331 HG3 LYS 39 3HG LYS 39 -13.321 -3.914 10.181 332 HD2 LYS 39 2HD LYS 39 -12.770 -4.412 12.446 333 HD3 LYS 39 3HD LYS 39 -13.794 -3.107 13.064 334 HE2 LYS 39 2HE LYS 39 -15.806 -4.287 12.417 335 HE3 LYS 39 3HE LYS 39 -14.872 -5.528 11.575 336 HZ1 LYS 39 3HZ LYS 39 -14.790 -5.027 14.503 337 HZ2 LYS 39 1HZ LYS 39 -13.971 -6.252 13.666 338 HZ3 LYS 39 2HZ LYS 39 -15.654 -6.260 13.737 339 H LYS 40 H LYS 40 -10.515 -4.510 11.497 340 HA LYS 40 HA LYS 40 -9.953 -4.248 14.220 341 HB2 LYS 40 2HB LYS 40 -8.655 -6.013 12.099 342 HB3 LYS 40 3HB LYS 40 -8.258 -6.161 13.804 343 HG2 LYS 40 2HG LYS 40 -11.066 -6.506 12.728 344 HG3 LYS 40 3HG LYS 40 -9.918 -7.835 12.888 345 HD2 LYS 40 2HD LYS 40 -9.759 -7.360 15.338 346 HD3 LYS 40 3HD LYS 40 -10.987 -6.104 15.148 347 HE2 LYS 40 2HE LYS 40 -12.652 -7.734 14.504 348 HE3 LYS 40 3HE LYS 40 -11.440 -9.015 14.410 349 HZ1 LYS 40 3HZ LYS 40 -12.299 -7.606 16.880 350 HZ2 LYS 40 1HZ LYS 40 -11.086 -8.780 16.810 351 HZ3 LYS 40 2HZ LYS 40 -12.687 -9.191 16.451 352 H GLU 41 H GLU 41 -7.757 -3.950 11.456 353 HA GLU 41 HA GLU 41 -5.590 -2.931 13.085 354 HB2 GLU 41 2HB GLU 41 -5.731 -3.484 10.100 355 HB3 GLU 41 3HB GLU 41 -4.273 -3.006 10.973 356 HG2 GLU 41 2HG GLU 41 -5.869 -5.553 11.325 357 HG3 GLU 41 3HG GLU 41 -4.233 -5.398 10.691 358 H MET 42 H MET 42 -8.154 -1.523 11.240 359 HA MET 42 HA MET 42 -6.953 1.016 10.768 360 HB2 MET 42 2HB MET 42 -9.845 0.166 11.010 361 HB3 MET 42 3HB MET 42 -9.429 1.865 10.862 362 HG2 MET 42 2HG MET 42 -8.195 0.094 8.821 363 HG3 MET 42 3HG MET 42 -9.946 0.249 8.746 364 HE1 MET 42 3HE MET 42 -7.184 3.987 8.445 365 HE2 MET 42 1HE MET 42 -6.551 2.383 8.825 366 HE3 MET 42 2HE MET 42 -7.561 3.239 9.994 367 H LYS 43 H LYS 43 -8.625 -0.324 13.626 368 HA LYS 43 HA LYS 43 -8.454 1.913 15.323 369 HB2 LYS 43 2HB LYS 43 -8.401 -1.062 15.832 370 HB3 LYS 43 3HB LYS 43 -7.947 -0.004 17.161 371 HG2 LYS 43 2HG LYS 43 -10.264 -0.535 17.417 372 HG3 LYS 43 3HG LYS 43 -10.161 1.154 16.917 373 HD2 LYS 43 2HD LYS 43 -10.665 0.433 14.566 374 HD3 LYS 43 3HD LYS 43 -10.869 -1.220 15.154 375 HE2 LYS 43 2HE LYS 43 -12.521 1.161 16.035 376 HE3 LYS 43 3HE LYS 43 -13.019 -0.038 14.844 377 HZ1 LYS 43 3HZ LYS 43 -12.902 -1.731 16.567 378 HZ2 LYS 43 1HZ LYS 43 -13.975 -0.495 16.994 379 HZ3 LYS 43 2HZ LYS 43 -12.444 -0.569 17.707 380 H LYS 44 H LYS 44 -5.941 -0.429 14.416 381 HA LYS 44 HA LYS 44 -3.875 0.509 16.135 382 HB2 LYS 44 2HB LYS 44 -3.503 -0.833 13.421 383 HB3 LYS 44 3HB LYS 44 -2.323 -0.762 14.722 384 HG2 LYS 44 2HG LYS 44 -4.970 -2.219 14.869 385 HG3 LYS 44 3HG LYS 44 -3.429 -2.977 14.474 386 HD2 LYS 44 2HD LYS 44 -2.563 -2.328 16.722 387 HD3 LYS 44 3HD LYS 44 -4.143 -1.630 17.110 388 HE2 LYS 44 2HE LYS 44 -3.879 -3.903 18.049 389 HE3 LYS 44 3HE LYS 44 -5.195 -3.835 16.876 390 HZ1 LYS 44 3HZ LYS 44 -3.748 -5.802 16.633 391 HZ2 LYS 44 1HZ LYS 44 -2.450 -4.791 16.256 392 HZ3 LYS 44 2HZ LYS 44 -3.797 -4.858 15.233 393 H LEU 45 H LEU 45 -4.624 1.155 12.708 394 HA LEU 45 HA LEU 45 -2.411 2.878 12.225 395 HB2 LEU 45 2HB LEU 45 -4.975 2.574 10.611 396 HB3 LEU 45 3HB LEU 45 -3.475 3.288 10.037 397 HG LEU 45 HG LEU 45 -3.880 0.367 10.790 398 HD11 LEU 45 1HD1 LEU 45 -4.999 0.912 8.696 399 HD12 LEU 45 2HD1 LEU 45 -3.606 -0.127 8.406 400 HD13 LEU 45 3HD1 LEU 45 -3.505 1.599 8.049 401 HD21 LEU 45 3HD2 LEU 45 -1.606 -0.031 9.919 402 HD22 LEU 45 1HD2 LEU 45 -1.601 1.023 11.332 403 HD23 LEU 45 2HD2 LEU 45 -1.380 1.709 9.721 404 H ALA 46 H ALA 46 -5.543 3.438 13.589 405 HA ALA 46 HA ALA 46 -5.552 6.313 13.117 406 HB1 ALA 46 3HB ALA 46 -7.402 4.613 14.821 407 HB2 ALA 46 1HB ALA 46 -7.664 5.052 13.132 408 HB3 ALA 46 2HB ALA 46 -7.656 6.304 14.373 409 H GLU 47 H GLU 47 -5.275 4.159 15.924 410 HA GLU 47 HA GLU 47 -4.867 6.335 17.796 411 HB2 GLU 47 2HB GLU 47 -4.774 3.318 18.210 412 HB3 GLU 47 3HB GLU 47 -4.736 4.520 19.498 413 HG2 GLU 47 2HG GLU 47 -6.997 5.287 18.869 414 HG3 GLU 47 3HG GLU 47 -7.023 4.117 17.548 415 H GLU 48 H GLU 48 -2.882 3.581 16.660 416 HA GLU 48 HA GLU 48 -0.531 4.368 18.099 417 HB2 GLU 48 2HB GLU 48 -0.707 2.472 15.712 418 HB3 GLU 48 3HB GLU 48 0.602 2.568 16.883 419 HG2 GLU 48 2HG GLU 48 -2.212 1.564 17.338 420 HG3 GLU 48 3HG GLU 48 -0.718 0.629 17.391 421 H LYS 49 H LYS 49 0.656 6.116 17.592 422 HA LYS 49 HA LYS 49 0.799 7.064 14.778 423 HB2 LYS 49 2HB LYS 49 1.039 8.710 17.335 424 HB3 LYS 49 3HB LYS 49 1.135 9.336 15.693 425 HG2 LYS 49 2HG LYS 49 -1.221 8.687 15.301 426 HG3 LYS 49 3HG LYS 49 -1.306 8.049 16.946 427 HD2 LYS 49 2HD LYS 49 -2.316 10.264 16.906 428 HD3 LYS 49 3HD LYS 49 -0.820 10.330 17.838 429 HE2 LYS 49 2HE LYS 49 0.348 11.269 15.856 430 HE3 LYS 49 3HE LYS 49 -1.172 11.237 14.960 431 HZ1 LYS 49 3HZ LYS 49 -0.781 12.759 17.475 432 HZ2 LYS 49 1HZ LYS 49 -2.102 12.841 16.428 433 HZ3 LYS 49 2HZ LYS 49 -0.593 13.426 15.938 434 H ASN 50 H ASN 50 2.631 5.570 17.154 435 HA ASN 50 HA ASN 50 5.120 6.928 16.990 436 HB2 ASN 50 2HB ASN 50 4.522 4.023 17.709 437 HB3 ASN 50 3HB ASN 50 6.109 4.772 17.872 438 HD21 ASN 50 1HD2 ASN 50 6.082 4.336 20.114 439 HD22 ASN 50 2HD2 ASN 50 5.133 5.275 21.212 440 H PHE 51 H PHE 51 7.032 6.340 15.877 441 HA PHE 51 HA PHE 51 6.655 5.939 13.113 442 HB2 PHE 51 2HB PHE 51 8.479 7.319 14.075 443 HB3 PHE 51 3HB PHE 51 9.240 5.873 14.723 444 HD1 PHE 51 HD2 PHE 51 8.103 7.361 11.454 445 HD2 PHE 51 HD1 PHE 51 10.909 4.798 13.427 446 HE1 PHE 51 HE2 PHE 51 9.360 7.106 9.352 447 HE2 PHE 51 HE1 PHE 51 12.149 4.546 11.318 448 HZ PHE 51 HZ PHE 51 11.380 5.697 9.281 449 H GLU 52 H GLU 52 5.768 3.992 12.607 450 HA GLU 52 HA GLU 52 7.536 1.650 12.878 451 HB2 GLU 52 2HB GLU 52 5.522 1.333 14.303 452 HB3 GLU 52 3HB GLU 52 4.483 1.579 12.903 453 HG2 GLU 52 2HG GLU 52 4.674 -0.797 13.418 454 HG3 GLU 52 3HG GLU 52 5.397 -0.448 11.854 455 H LYS 53 H LYS 53 7.921 0.564 11.103 456 HA LYS 53 HA LYS 53 7.122 1.642 8.503 457 HB2 LYS 53 2HB LYS 53 9.106 -0.578 9.187 458 HB3 LYS 53 3HB LYS 53 8.974 0.297 7.665 459 HG2 LYS 53 2HG LYS 53 9.829 2.322 8.659 460 HG3 LYS 53 3HG LYS 53 9.728 1.638 10.278 461 HD2 LYS 53 2HD LYS 53 11.604 0.725 8.062 462 HD3 LYS 53 3HD LYS 53 12.055 1.655 9.493 463 HE2 LYS 53 2HE LYS 53 11.049 -1.205 9.412 464 HE3 LYS 53 3HE LYS 53 12.664 -0.658 9.850 465 HZ1 LYS 53 3HZ LYS 53 11.496 -1.167 11.827 466 HZ2 LYS 53 1HZ LYS 53 10.159 -0.229 11.385 467 HZ3 LYS 53 2HZ LYS 53 11.628 0.516 11.754 468 H ILE 54 H ILE 54 5.127 0.824 7.941 469 HA ILE 54 HA ILE 54 4.548 -2.052 8.395 470 HB ILE 54 HB ILE 54 2.464 0.190 8.197 471 HG12 ILE 54 2HG1 ILE 54 3.489 -1.189 10.733 472 HG13 ILE 54 3HG1 ILE 54 3.859 0.464 10.260 473 HG21 ILE 54 1HG2 ILE 54 2.192 -2.723 9.068 474 HG22 ILE 54 2HG2 ILE 54 1.629 -2.040 7.541 475 HG23 ILE 54 3HG2 ILE 54 0.894 -1.525 9.056 476 HD11 ILE 54 3HD1 ILE 54 1.492 1.056 10.483 477 HD12 ILE 54 1HD1 ILE 54 2.168 0.409 11.978 478 HD13 ILE 54 2HD1 ILE 54 1.131 -0.601 10.974 479 H LEU 55 H LEU 55 4.307 -3.227 6.592 480 HA LEU 55 HA LEU 55 3.458 -1.975 4.051 481 HB2 LEU 55 2HB LEU 55 5.485 -3.541 4.101 482 HB3 LEU 55 3HB LEU 55 4.395 -4.841 4.554 483 HG LEU 55 HG LEU 55 3.105 -4.192 2.339 484 HD11 LEU 55 1HD1 LEU 55 5.807 -2.979 1.753 485 HD12 LEU 55 2HD1 LEU 55 4.253 -2.145 1.837 486 HD13 LEU 55 3HD1 LEU 55 4.554 -3.314 0.558 487 HD21 LEU 55 3HD2 LEU 55 4.401 -5.773 1.018 488 HD22 LEU 55 1HD2 LEU 55 4.245 -6.354 2.674 489 HD23 LEU 55 2HD2 LEU 55 5.764 -5.640 2.129 490 H ILE 56 H ILE 56 1.225 -1.850 4.061 491 HA ILE 56 HA ILE 56 -0.363 -4.086 5.134 492 HB ILE 56 HB ILE 56 -1.338 -1.489 3.849 493 HG12 ILE 56 2HG1 ILE 56 -0.167 -1.149 6.081 494 HG13 ILE 56 3HG1 ILE 56 -1.847 -0.633 6.051 495 HG21 ILE 56 1HG2 ILE 56 -2.865 -3.712 5.261 496 HG22 ILE 56 2HG2 ILE 56 -3.007 -3.215 3.572 497 HG23 ILE 56 3HG2 ILE 56 -3.550 -2.140 4.854 498 HD11 ILE 56 3HD1 ILE 56 -1.286 -1.741 8.139 499 HD12 ILE 56 1HD1 ILE 56 -0.814 -3.195 7.262 500 HD13 ILE 56 2HD1 ILE 56 -2.497 -2.664 7.251 501 H LYS 57 H LYS 57 -0.796 -5.723 3.827 502 HA LYS 57 HA LYS 57 -1.049 -5.390 0.898 503 HB2 LYS 57 2HB LYS 57 0.538 -7.091 1.465 504 HB3 LYS 57 3HB LYS 57 -0.475 -7.761 2.729 505 HG2 LYS 57 2HG LYS 57 -1.466 -7.900 -0.111 506 HG3 LYS 57 3HG LYS 57 -0.164 -8.977 0.380 507 HD2 LYS 57 2HD LYS 57 -1.616 -9.838 2.231 508 HD3 LYS 57 3HD LYS 57 -2.925 -8.806 1.649 509 HE2 LYS 57 2HE LYS 57 -2.923 -10.027 -0.500 510 HE3 LYS 57 3HE LYS 57 -1.614 -11.054 0.087 511 HZ1 LYS 57 3HZ LYS 57 -3.107 -11.807 1.871 512 HZ2 LYS 57 1HZ LYS 57 -3.700 -12.177 0.333 513 HZ3 LYS 57 2HZ LYS 57 -4.359 -10.894 1.205 514 H SER 58 H SER 58 -3.019 -5.749 -0.083 515 HA SER 58 HA SER 58 -5.096 -7.351 1.071 516 HB2 SER 58 2HB SER 58 -5.538 -5.299 2.366 517 HB3 SER 58 3HB SER 58 -5.569 -4.343 0.887 518 HG SER 58 HG SER 58 -7.322 -6.520 1.145 519 H ASN 59 H ASN 59 -6.458 -8.090 -0.482 520 HA ASN 59 HA ASN 59 -5.691 -7.717 -3.251 521 HB2 ASN 59 2HB ASN 59 -7.781 -9.517 -1.954 522 HB3 ASN 59 3HB ASN 59 -7.392 -9.538 -3.673 523 HD21 ASN 59 1HD2 ASN 59 -6.712 -11.654 -3.667 524 HD22 ASN 59 2HD2 ASN 59 -5.271 -12.191 -2.881 525 H ASP 60 H ASP 60 -8.424 -6.875 -1.197 526 HA ASP 60 HA ASP 60 -10.117 -6.034 -3.432 527 HB2 ASP 60 2HB ASP 60 -10.583 -5.949 -0.417 528 HB3 ASP 60 3HB ASP 60 -11.770 -5.460 -1.625 529 H LYS 61 H LYS 61 -9.454 -4.149 -4.336 530 HA LYS 61 HA LYS 61 -7.988 -2.093 -3.124 531 HB2 LYS 61 2HB LYS 61 -8.482 -0.681 -5.074 532 HB3 LYS 61 3HB LYS 61 -8.032 -2.301 -5.556 533 HG2 LYS 61 2HG LYS 61 -10.955 -1.614 -5.349 534 HG3 LYS 61 3HG LYS 61 -10.037 -1.027 -6.734 535 HD2 LYS 61 2HD LYS 61 -9.395 -3.355 -7.290 536 HD3 LYS 61 3HD LYS 61 -10.315 -3.941 -5.902 537 HE2 LYS 61 2HE LYS 61 -12.399 -3.143 -6.902 538 HE3 LYS 61 3HE LYS 61 -11.513 -2.426 -8.251 539 HZ1 LYS 61 3HZ LYS 61 -11.473 -5.323 -7.627 540 HZ2 LYS 61 1HZ LYS 61 -10.886 -4.567 -9.021 541 HZ3 LYS 61 2HZ LYS 61 -12.551 -4.622 -8.720 542 H GLN 62 H GLN 62 -11.363 -2.714 -2.907 543 HA GLN 62 HA GLN 62 -12.421 -0.174 -2.252 544 HB2 GLN 62 2HB GLN 62 -13.217 -2.943 -1.251 545 HB3 GLN 62 3HB GLN 62 -14.139 -1.482 -0.912 546 HG2 GLN 62 2HG GLN 62 -14.527 -1.175 -3.336 547 HG3 GLN 62 3HG GLN 62 -13.636 -2.662 -3.655 548 HE21 GLN 62 1HE2 GLN 62 -15.910 -2.181 -0.949 549 HE22 GLN 62 2HE2 GLN 62 -17.081 -3.314 -1.516 550 H LEU 63 H LEU 63 -11.002 -2.733 -0.239 551 HA LEU 63 HA LEU 63 -11.366 -1.583 2.289 552 HB2 LEU 63 2HB LEU 63 -9.196 -3.541 1.420 553 HB3 LEU 63 3HB LEU 63 -9.684 -3.229 3.079 554 HG LEU 63 HG LEU 63 -11.371 -4.564 0.926 555 HD11 LEU 63 1HD1 LEU 63 -10.165 -5.716 3.462 556 HD12 LEU 63 2HD1 LEU 63 -9.613 -6.020 1.813 557 HD13 LEU 63 3HD1 LEU 63 -11.204 -6.578 2.321 558 HD21 LEU 63 3HD2 LEU 63 -12.143 -3.944 3.797 559 HD22 LEU 63 1HD2 LEU 63 -13.077 -4.936 2.671 560 HD23 LEU 63 2HD2 LEU 63 -12.840 -3.222 2.345 561 H LEU 64 H LEU 64 -8.671 -1.327 -0.001 562 HA LEU 64 HA LEU 64 -6.853 0.020 1.723 563 HB2 LEU 64 2HB LEU 64 -6.937 -0.034 -1.325 564 HB3 LEU 64 3HB LEU 64 -5.640 0.687 -0.387 565 HG LEU 64 HG LEU 64 -5.346 -1.685 0.677 566 HD11 LEU 64 1HD1 LEU 64 -6.867 -2.475 -1.809 567 HD12 LEU 64 2HD1 LEU 64 -7.386 -2.709 -0.140 568 HD13 LEU 64 3HD1 LEU 64 -5.975 -3.567 -0.749 569 HD21 LEU 64 3HD2 LEU 64 -3.822 -2.396 -1.066 570 HD22 LEU 64 1HD2 LEU 64 -3.719 -0.650 -0.852 571 HD23 LEU 64 2HD2 LEU 64 -4.594 -1.313 -2.229 572 H LYS 65 H LYS 65 -9.305 1.181 -0.582 573 HA LYS 65 HA LYS 65 -8.702 3.957 -0.339 574 HB2 LYS 65 2HB LYS 65 -9.971 3.193 -2.262 575 HB3 LYS 65 3HB LYS 65 -11.231 2.511 -1.236 576 HG2 LYS 65 2HG LYS 65 -11.911 4.732 -0.516 577 HG3 LYS 65 3HG LYS 65 -10.582 5.471 -1.412 578 HD2 LYS 65 2HD LYS 65 -11.590 4.842 -3.538 579 HD3 LYS 65 3HD LYS 65 -12.830 3.886 -2.713 580 HE2 LYS 65 2HE LYS 65 -13.593 6.157 -3.524 581 HE3 LYS 65 3HE LYS 65 -13.869 5.849 -1.809 582 HZ1 LYS 65 3HZ LYS 65 -12.956 8.083 -2.303 583 HZ2 LYS 65 1HZ LYS 65 -11.542 7.357 -2.874 584 HZ3 LYS 65 2HZ LYS 65 -11.981 7.187 -1.251 585 H GLU 66 H GLU 66 -11.111 1.850 1.244 586 HA GLU 66 HA GLU 66 -12.438 3.773 2.817 587 HB2 GLU 66 2HB GLU 66 -12.054 0.795 3.329 588 HB3 GLU 66 3HB GLU 66 -13.223 1.816 4.166 589 HG2 GLU 66 2HG GLU 66 -14.406 2.234 2.055 590 HG3 GLU 66 3HG GLU 66 -13.216 1.279 1.181 591 H MET 67 H MET 67 -9.503 1.976 3.310 592 HA MET 67 HA MET 67 -8.939 2.585 6.011 593 HB2 MET 67 2HB MET 67 -7.822 0.841 4.548 594 HB3 MET 67 3HB MET 67 -6.972 2.136 3.722 595 HG2 MET 67 2HG MET 67 -5.951 2.732 5.961 596 HG3 MET 67 3HG MET 67 -6.647 1.239 6.589 597 HE1 MET 67 3HE MET 67 -6.451 -0.455 3.799 598 HE2 MET 67 1HE MET 67 -6.045 -1.243 5.327 599 HE3 MET 67 2HE MET 67 -4.920 -1.306 3.972 600 H LEU 68 H LEU 68 -8.039 4.140 2.963 601 HA LEU 68 HA LEU 68 -6.449 6.237 4.029 602 HB2 LEU 68 2HB LEU 68 -7.792 5.907 1.327 603 HB3 LEU 68 3HB LEU 68 -6.641 7.181 1.695 604 HG LEU 68 HG LEU 68 -6.009 4.205 1.754 605 HD11 LEU 68 1HD1 LEU 68 -4.715 4.594 -0.293 606 HD12 LEU 68 2HD1 LEU 68 -5.274 6.269 -0.339 607 HD13 LEU 68 3HD1 LEU 68 -6.426 4.946 -0.527 608 HD21 LEU 68 3HD2 LEU 68 -4.142 6.579 2.043 609 HD22 LEU 68 1HD2 LEU 68 -3.660 4.882 1.951 610 HD23 LEU 68 2HD2 LEU 68 -4.607 5.454 3.323 611 H GLU 69 H GLU 69 -9.899 5.933 3.514 612 HA GLU 69 HA GLU 69 -10.685 8.648 3.491 613 HB2 GLU 69 2HB GLU 69 -12.231 6.343 4.759 614 HB3 GLU 69 3HB GLU 69 -12.902 7.878 4.223 615 HG2 GLU 69 2HG GLU 69 -11.725 5.721 2.462 616 HG3 GLU 69 3HG GLU 69 -13.435 6.068 2.670 617 H LEU 70 H LEU 70 -9.937 6.431 6.133 618 HA LEU 70 HA LEU 70 -10.534 8.324 8.244 619 HB2 LEU 70 2HB LEU 70 -9.060 5.660 8.409 620 HB3 LEU 70 3HB LEU 70 -9.703 6.574 9.763 621 HG LEU 70 HG LEU 70 -11.316 5.142 7.614 622 HD11 LEU 70 1HD1 LEU 70 -12.130 3.731 9.447 623 HD12 LEU 70 2HD1 LEU 70 -11.122 4.614 10.597 624 HD13 LEU 70 3HD1 LEU 70 -10.374 3.652 9.324 625 HD21 LEU 70 3HD2 LEU 70 -12.474 7.225 8.172 626 HD22 LEU 70 1HD2 LEU 70 -12.378 6.845 9.894 627 HD23 LEU 70 2HD2 LEU 70 -13.352 5.841 8.815 628 H ILE 71 H ILE 71 -7.665 7.069 6.597 629 HA ILE 71 HA ILE 71 -5.653 8.031 8.319 630 HB ILE 71 HB ILE 71 -5.557 7.267 5.376 631 HG12 ILE 71 2HG1 ILE 71 -4.624 5.799 7.892 632 HG13 ILE 71 3HG1 ILE 71 -6.064 5.420 6.955 633 HG21 ILE 71 1HG2 ILE 71 -3.707 8.837 5.770 634 HG22 ILE 71 2HG2 ILE 71 -3.094 7.207 5.526 635 HG23 ILE 71 3HG2 ILE 71 -3.166 7.883 7.153 636 HD11 ILE 71 3HD1 ILE 71 -4.296 3.854 6.488 637 HD12 ILE 71 1HD1 ILE 71 -3.215 5.164 6.011 638 HD13 ILE 71 2HD1 ILE 71 -4.653 4.809 5.050 639 H SER 72 H SER 72 -7.365 9.604 5.706 640 HA SER 72 HA SER 72 -5.703 11.623 4.888 641 HB2 SER 72 2HB SER 72 -7.830 12.847 4.291 642 HB3 SER 72 3HB SER 72 -7.830 11.152 3.796 643 HG SER 72 HG SER 72 -9.693 11.206 4.834 644 H LYS 73 H LYS 73 -8.089 11.856 7.541 645 HA LYS 73 HA LYS 73 -7.133 14.498 8.322 646 HB2 LYS 73 2HB LYS 73 -9.369 12.762 9.422 647 HB3 LYS 73 3HB LYS 73 -9.032 14.410 9.948 648 HG2 LYS 73 2HG LYS 73 -9.504 15.243 7.663 649 HG3 LYS 73 3HG LYS 73 -9.830 13.595 7.129 650 HD2 LYS 73 2HD LYS 73 -11.431 15.111 9.232 651 HD3 LYS 73 3HD LYS 73 -11.919 14.864 7.555 652 HE2 LYS 73 2HE LYS 73 -11.879 12.390 7.966 653 HE3 LYS 73 3HE LYS 73 -11.549 12.717 9.669 654 HZ1 LYS 73 3HZ LYS 73 -13.663 13.982 9.726 655 HZ2 LYS 73 1HZ LYS 73 -13.885 12.343 9.373 656 HZ3 LYS 73 2HZ LYS 73 -13.975 13.494 8.142 657 H LEU 74 H LEU 74 -6.333 11.273 9.189 658 HA LEU 74 HA LEU 74 -5.337 11.781 11.833 659 HB2 LEU 74 2HB LEU 74 -4.359 9.751 9.781 660 HB3 LEU 74 3HB LEU 74 -3.916 9.761 11.481 661 HG LEU 74 HG LEU 74 -6.719 9.266 10.401 662 HD11 LEU 74 1HD1 LEU 74 -4.766 7.285 11.605 663 HD12 LEU 74 2HD1 LEU 74 -5.169 7.422 9.896 664 HD13 LEU 74 3HD1 LEU 74 -6.407 6.941 11.049 665 HD21 LEU 74 3HD2 LEU 74 -7.327 8.651 12.700 666 HD22 LEU 74 1HD2 LEU 74 -6.792 10.328 12.613 667 HD23 LEU 74 2HD2 LEU 74 -5.712 9.091 13.259 668 H GLY 75 H GLY 75 -3.834 11.751 8.598 669 HA2 GLY 75 2HA GLY 75 -2.477 13.374 7.665 670 HA3 GLY 75 3HA GLY 75 -2.252 14.110 9.239 671 H TYR 76 H TYR 76 -1.341 11.268 7.300 672 HA TYR 76 HA TYR 76 1.451 11.824 7.751 673 HB2 TYR 76 2HB TYR 76 2.064 9.516 8.508 674 HB3 TYR 76 3HB TYR 76 1.137 10.394 9.705 675 HD1 TYR 76 HD1 TYR 76 -1.297 9.793 10.083 676 HD2 TYR 76 HD2 TYR 76 1.259 7.400 7.631 677 HE1 TYR 76 HE1 TYR 76 -2.843 7.902 10.311 678 HE2 TYR 76 HE2 TYR 76 -0.300 5.522 7.860 679 HH TYR 76 HH TYR 76 -3.425 5.836 9.131 680 H LYS 77 H LYS 77 2.826 10.418 6.387 681 HA LYS 77 HA LYS 77 1.739 10.422 3.732 682 HB2 LYS 77 2HB LYS 77 4.025 11.232 4.174 683 HB3 LYS 77 3HB LYS 77 4.494 9.645 4.772 684 HG2 LYS 77 2HG LYS 77 5.363 9.914 2.535 685 HG3 LYS 77 3HG LYS 77 4.079 8.703 2.489 686 HD2 LYS 77 2HD LYS 77 2.503 10.487 1.710 687 HD3 LYS 77 3HD LYS 77 3.865 11.606 1.654 688 HE2 LYS 77 2HE LYS 77 3.679 9.050 0.044 689 HE3 LYS 77 3HE LYS 77 3.255 10.650 -0.563 690 HZ1 LYS 77 3HZ LYS 77 5.534 11.356 -0.144 691 HZ2 LYS 77 1HZ LYS 77 5.472 10.054 -1.221 692 HZ3 LYS 77 2HZ LYS 77 5.933 9.803 0.383 693 H VAL 78 H VAL 78 0.744 8.761 2.804 694 HA VAL 78 HA VAL 78 1.629 5.986 3.350 695 HB VAL 78 HB VAL 78 -1.219 6.877 2.670 696 HG11 VAL 78 1HG1 VAL 78 -0.162 4.086 3.260 697 HG12 VAL 78 2HG1 VAL 78 -0.729 4.679 1.698 698 HG13 VAL 78 3HG1 VAL 78 -1.862 4.515 3.039 699 HG21 VAL 78 3HG2 VAL 78 -0.651 7.448 4.979 700 HG22 VAL 78 1HG2 VAL 78 -0.099 5.801 5.281 701 HG23 VAL 78 2HG2 VAL 78 -1.803 6.114 4.952 702 H PHE 79 H PHE 79 1.858 4.690 1.623 703 HA PHE 79 HA PHE 79 1.943 5.872 -1.100 704 HB2 PHE 79 2HB PHE 79 3.472 3.463 0.030 705 HB3 PHE 79 3HB PHE 79 3.748 4.273 -1.510 706 HD1 PHE 79 HD1 PHE 79 4.875 6.500 -1.568 707 HD2 PHE 79 HD2 PHE 79 4.371 4.387 2.114 708 HE1 PHE 79 HE1 PHE 79 6.522 7.965 -0.489 709 HE2 PHE 79 HE2 PHE 79 6.027 5.861 3.184 710 HZ PHE 79 HZ PHE 79 7.098 7.656 1.882 711 H LEU 80 H LEU 80 1.318 4.321 -2.841 712 HA LEU 80 HA LEU 80 0.053 1.799 -2.078 713 HB2 LEU 80 2HB LEU 80 -1.884 3.228 -1.957 714 HB3 LEU 80 3HB LEU 80 -1.473 4.039 -3.457 715 HG LEU 80 HG LEU 80 -2.072 2.048 -4.763 716 HD11 LEU 80 1HD1 LEU 80 -1.401 0.275 -3.225 717 HD12 LEU 80 2HD1 LEU 80 -3.053 0.040 -3.785 718 HD13 LEU 80 3HD1 LEU 80 -2.755 0.665 -2.161 719 HD21 LEU 80 3HD2 LEU 80 -3.861 3.633 -4.253 720 HD22 LEU 80 1HD2 LEU 80 -4.256 2.746 -2.776 721 HD23 LEU 80 2HD2 LEU 80 -4.492 1.992 -4.357 722 H LEU 81 H LEU 81 0.469 0.261 -3.489 723 HA LEU 81 HA LEU 81 1.449 0.926 -6.203 724 HB2 LEU 81 2HB LEU 81 3.140 -0.142 -4.711 725 HB3 LEU 81 3HB LEU 81 2.070 -1.512 -4.482 726 HG LEU 81 HG LEU 81 2.289 -2.117 -6.860 727 HD11 LEU 81 1HD1 LEU 81 2.518 0.062 -7.881 728 HD12 LEU 81 2HD1 LEU 81 3.898 -0.936 -8.329 729 HD13 LEU 81 3HD1 LEU 81 4.080 0.313 -7.099 730 HD21 LEU 81 3HD2 LEU 81 4.664 -2.786 -6.853 731 HD22 LEU 81 1HD2 LEU 81 3.910 -3.064 -5.287 732 HD23 LEU 81 2HD2 LEU 81 4.982 -1.681 -5.518 733 H LEU 82 H LEU 82 0.099 0.366 -7.758 734 HA LEU 82 HA LEU 82 -1.890 -1.802 -7.379 735 HB2 LEU 82 2HB LEU 82 -1.911 0.618 -9.243 736 HB3 LEU 82 3HB LEU 82 -3.139 -0.638 -9.230 737 HG LEU 82 HG LEU 82 -2.556 1.263 -6.922 738 HD11 LEU 82 1HD1 LEU 82 -4.677 2.329 -7.464 739 HD12 LEU 82 2HD1 LEU 82 -4.905 1.243 -8.837 740 HD13 LEU 82 3HD1 LEU 82 -3.576 2.404 -8.837 741 HD21 LEU 82 3HD2 LEU 82 -4.745 -0.822 -7.199 742 HD22 LEU 82 1HD2 LEU 82 -4.606 0.364 -5.895 743 HD23 LEU 82 2HD2 LEU 82 -3.374 -0.879 -6.089 744 H ALA 83 H ALA 83 -1.208 -3.663 -8.395 745 HA ALA 83 HA ALA 83 0.150 -3.448 -11.034 746 HB1 ALA 83 3HB ALA 83 0.974 -5.343 -8.809 747 HB2 ALA 83 1HB ALA 83 1.851 -3.895 -9.298 748 HB3 ALA 83 2HB ALA 83 1.691 -5.249 -10.416 749 H ASP 84 H ASP 84 -1.251 -4.288 -12.436 750 HA ASP 84 HA ASP 84 -2.058 -7.035 -12.347 751 HB2 ASP 84 2HB ASP 84 -3.837 -6.170 -10.868 752 HB3 ASP 84 3HB ASP 84 -4.229 -4.906 -12.023 753 H GLN 85 H GLN 85 -2.959 -7.710 -14.305 754 HA GLN 85 HA GLN 85 -1.899 -6.466 -16.617 755 HB2 GLN 85 2HB GLN 85 -3.786 -8.823 -16.272 756 HB3 GLN 85 3HB GLN 85 -3.183 -8.312 -17.841 757 HG2 GLN 85 2HG GLN 85 -1.941 -10.236 -16.937 758 HG3 GLN 85 3HG GLN 85 -0.895 -8.838 -17.183 759 HE21 GLN 85 1HE2 GLN 85 0.090 -7.881 -15.368 760 HE22 GLN 85 2HE2 GLN 85 0.047 -8.602 -13.798 761 H ASP 86 H ASP 86 -5.135 -6.503 -15.191 762 HA ASP 86 HA ASP 86 -6.223 -4.759 -17.260 763 HB2 ASP 86 2HB ASP 86 -7.671 -6.377 -15.880 764 HB3 ASP 86 3HB ASP 86 -7.449 -5.300 -14.509 765 H GLU 87 H GLU 87 -4.543 -3.228 -17.196 766 HA GLU 87 HA GLU 87 -3.860 -1.697 -14.861 767 HB2 GLU 87 2HB GLU 87 -2.482 -0.366 -16.376 768 HB3 GLU 87 3HB GLU 87 -2.250 -2.077 -16.692 769 HG2 GLU 87 2HG GLU 87 -3.480 -1.987 -18.728 770 HG3 GLU 87 3HG GLU 87 -4.158 -0.408 -18.339 771 H ASN 88 H ASN 88 -6.400 -1.556 -17.128 772 HA ASN 88 HA ASN 88 -6.882 1.217 -17.360 773 HB2 ASN 88 2HB ASN 88 -7.919 -0.349 -18.909 774 HB3 ASN 88 3HB ASN 88 -8.777 -1.155 -17.605 775 HD21 ASN 88 1HD2 ASN 88 -8.508 2.387 -17.962 776 HD22 ASN 88 2HD2 ASN 88 -10.180 2.643 -18.286 777 H GLU 89 H GLU 89 -8.389 -1.235 -15.230 778 HA GLU 89 HA GLU 89 -10.058 0.497 -13.752 779 HB2 GLU 89 2HB GLU 89 -10.396 -1.946 -13.834 780 HB3 GLU 89 3HB GLU 89 -8.881 -2.216 -12.982 781 HG2 GLU 89 2HG GLU 89 -9.805 -1.092 -10.990 782 HG3 GLU 89 3HG GLU 89 -11.320 -0.810 -11.849 783 H LEU 90 H LEU 90 -6.746 -0.623 -13.273 784 HA LEU 90 HA LEU 90 -6.257 0.445 -10.705 785 HB2 LEU 90 2HB LEU 90 -4.260 0.042 -12.965 786 HB3 LEU 90 3HB LEU 90 -3.865 0.255 -11.265 787 HG LEU 90 HG LEU 90 -5.277 -2.137 -12.496 788 HD11 LEU 90 1HD1 LEU 90 -3.231 -3.352 -11.835 789 HD12 LEU 90 2HD1 LEU 90 -2.504 -1.836 -11.303 790 HD13 LEU 90 3HD1 LEU 90 -2.906 -2.077 -13.006 791 HD21 LEU 90 3HD2 LEU 90 -4.568 -1.660 -9.578 792 HD22 LEU 90 1HD2 LEU 90 -5.167 -3.175 -10.260 793 HD23 LEU 90 2HD2 LEU 90 -6.194 -1.747 -10.261 794 H GLU 91 H GLU 91 -5.940 1.815 -13.964 795 HA GLU 91 HA GLU 91 -4.491 4.147 -13.185 796 HB2 GLU 91 2HB GLU 91 -4.461 3.122 -15.511 797 HB3 GLU 91 3HB GLU 91 -6.066 3.802 -15.779 798 HG2 GLU 91 2HG GLU 91 -5.207 6.057 -15.492 799 HG3 GLU 91 3HG GLU 91 -3.617 5.442 -15.047 800 H GLU 92 H GLU 92 -7.905 3.397 -13.638 801 HA GLU 92 HA GLU 92 -8.902 6.048 -13.271 802 HB2 GLU 92 2HB GLU 92 -10.385 3.505 -12.460 803 HB3 GLU 92 3HB GLU 92 -11.076 5.053 -12.928 804 HG2 GLU 92 2HG GLU 92 -9.782 2.976 -14.694 805 HG3 GLU 92 3HG GLU 92 -11.441 3.558 -14.738 806 H PHE 93 H PHE 93 -8.507 3.279 -11.085 807 HA PHE 93 HA PHE 93 -9.495 4.410 -8.741 808 HB2 PHE 93 2HB PHE 93 -9.168 1.969 -9.104 809 HB3 PHE 93 3HB PHE 93 -7.423 2.185 -8.999 810 HD1 PHE 93 HD1 PHE 93 -10.548 2.870 -7.012 811 HD2 PHE 93 HD2 PHE 93 -6.408 1.810 -6.894 812 HE1 PHE 93 HE1 PHE 93 -10.680 2.580 -4.572 813 HE2 PHE 93 HE2 PHE 93 -6.553 1.521 -4.457 814 HZ PHE 93 HZ PHE 93 -8.687 1.909 -3.297 815 H LYS 94 H LYS 94 -6.171 4.412 -9.993 816 HA LYS 94 HA LYS 94 -4.942 5.401 -7.627 817 HB2 LYS 94 2HB LYS 94 -2.916 5.743 -8.973 818 HB3 LYS 94 3HB LYS 94 -3.618 4.168 -9.255 819 HG2 LYS 94 2HG LYS 94 -2.967 4.779 -11.385 820 HG3 LYS 94 3HG LYS 94 -4.662 5.248 -11.377 821 HD2 LYS 94 2HD LYS 94 -3.280 6.951 -12.469 822 HD3 LYS 94 3HD LYS 94 -4.017 7.602 -11.005 823 HE2 LYS 94 2HE LYS 94 -1.886 7.321 -9.799 824 HE3 LYS 94 3HE LYS 94 -1.150 6.609 -11.244 825 HZ1 LYS 94 3HZ LYS 94 -0.559 8.918 -11.097 826 HZ2 LYS 94 1HZ LYS 94 -2.180 9.386 -10.967 827 HZ3 LYS 94 2HZ LYS 94 -1.607 8.713 -12.410 828 H ARG 95 H ARG 95 -6.497 6.974 -10.343 829 HA ARG 95 HA ARG 95 -5.546 9.604 -9.881 830 HB2 ARG 95 2HB ARG 95 -8.113 8.607 -11.176 831 HB3 ARG 95 3HB ARG 95 -7.677 10.313 -11.100 832 HG2 ARG 95 2HG ARG 95 -5.637 9.848 -12.428 833 HG3 ARG 95 3HG ARG 95 -6.087 8.144 -12.511 834 HD2 ARG 95 2HD ARG 95 -8.202 8.807 -13.679 835 HD3 ARG 95 3HD ARG 95 -7.647 10.480 -13.663 836 HE ARG 95 HE ARG 95 -5.930 9.914 -15.209 837 HH11 ARG 95 1HH1 ARG 95 -8.142 7.258 -14.627 838 HH12 ARG 95 2HH1 ARG 95 -7.714 6.414 -16.078 839 HH21 ARG 95 1HH2 ARG 95 -5.402 8.825 -17.135 840 HH22 ARG 95 2HH2 ARG 95 -6.153 7.304 -17.504 841 H LYS 96 H LYS 96 -8.264 7.753 -8.537 842 HA LYS 96 HA LYS 96 -9.434 9.802 -6.963 843 HB2 LYS 96 2HB LYS 96 -9.423 6.772 -6.585 844 HB3 LYS 96 3HB LYS 96 -10.252 7.851 -5.471 845 HG2 LYS 96 2HG LYS 96 -11.897 6.981 -6.950 846 HG3 LYS 96 3HG LYS 96 -11.644 8.665 -7.409 847 HD2 LYS 96 2HD LYS 96 -10.250 7.960 -9.302 848 HD3 LYS 96 3HD LYS 96 -10.405 6.272 -8.810 849 HE2 LYS 96 2HE LYS 96 -11.899 6.763 -10.680 850 HE3 LYS 96 3HE LYS 96 -12.836 6.377 -9.238 851 HZ1 LYS 96 3HZ LYS 96 -13.721 8.279 -10.460 852 HZ2 LYS 96 1HZ LYS 96 -12.274 9.118 -10.231 853 HZ3 LYS 96 2HZ LYS 96 -13.243 8.723 -8.902 854 H ILE 97 H ILE 97 -6.974 7.331 -6.209 855 HA ILE 97 HA ILE 97 -6.648 7.953 -3.471 856 HB ILE 97 HB ILE 97 -4.694 6.561 -5.364 857 HG12 ILE 97 2HG1 ILE 97 -6.879 5.448 -5.385 858 HG13 ILE 97 3HG1 ILE 97 -5.714 4.441 -4.545 859 HG21 ILE 97 1HG2 ILE 97 -3.550 7.218 -3.302 860 HG22 ILE 97 2HG2 ILE 97 -3.767 5.469 -3.342 861 HG23 ILE 97 3HG2 ILE 97 -4.813 6.464 -2.326 862 HD11 ILE 97 3HD1 ILE 97 -7.853 6.140 -3.247 863 HD12 ILE 97 1HD1 ILE 97 -6.685 5.129 -2.393 864 HD13 ILE 97 2HD1 ILE 97 -7.879 4.391 -3.456 865 H GLU 98 H GLU 98 -5.065 9.156 -6.375 866 HA GLU 98 HA GLU 98 -2.980 10.638 -5.068 867 HB2 GLU 98 2HB GLU 98 -2.991 9.752 -7.489 868 HB3 GLU 98 3HB GLU 98 -4.040 11.106 -7.894 869 HG2 GLU 98 2HG GLU 98 -2.305 12.695 -7.309 870 HG3 GLU 98 3HG GLU 98 -1.276 11.408 -6.677 871 H SER 99 H SER 99 -6.277 11.286 -6.114 872 HA SER 99 HA SER 99 -6.261 14.113 -5.461 873 HB2 SER 99 2HB SER 99 -8.570 12.216 -6.067 874 HB3 SER 99 3HB SER 99 -8.724 13.967 -5.886 875 HG SER 99 HG SER 99 -7.185 14.142 -7.642 876 H GLN 100 H GLN 100 -6.659 11.171 -3.719 877 HA GLN 100 HA GLN 100 -7.896 12.349 -1.361 878 HB2 GLN 100 2HB GLN 100 -6.610 9.624 -1.828 879 HB3 GLN 100 3HB GLN 100 -7.388 10.102 -0.321 880 HG2 GLN 100 2HG GLN 100 -9.540 10.283 -1.421 881 HG3 GLN 100 3HG GLN 100 -8.805 10.010 -2.996 882 HE21 GLN 100 1HE2 GLN 100 -8.054 8.194 -0.029 883 HE22 GLN 100 2HE2 GLN 100 -8.701 6.693 -0.583 884 H GLY 101 H GLY 101 -4.774 12.195 -2.729 885 HA2 GLY 101 2HA GLY 101 -3.057 13.657 -2.084 886 HA3 GLY 101 3HA GLY 101 -3.698 13.698 -0.449 887 H TYR 102 H TYR 102 -2.736 10.977 -2.574 888 HA TYR 102 HA TYR 102 -0.615 10.206 -0.658 889 HB2 TYR 102 2HB TYR 102 -2.686 8.285 -1.819 890 HB3 TYR 102 3HB TYR 102 -1.320 7.823 -0.800 891 HD1 TYR 102 HD2 TYR 102 -1.227 8.814 1.590 892 HD2 TYR 102 HD1 TYR 102 -4.759 8.907 -0.815 893 HE1 TYR 102 HE2 TYR 102 -2.582 9.219 3.596 894 HE2 TYR 102 HE1 TYR 102 -6.106 9.318 1.197 895 HH TYR 102 HH TYR 102 -5.985 8.995 3.576 896 H GLU 103 H GLU 103 1.075 8.961 -1.524 897 HA GLU 103 HA GLU 103 1.609 9.373 -4.350 898 HB2 GLU 103 2HB GLU 103 3.450 9.674 -2.733 899 HB3 GLU 103 3HB GLU 103 3.272 8.012 -2.180 900 HG2 GLU 103 2HG GLU 103 3.982 7.164 -4.365 901 HG3 GLU 103 3HG GLU 103 4.055 8.796 -4.999 902 H VAL 104 H VAL 104 0.484 8.073 -5.654 903 HA VAL 104 HA VAL 104 0.417 5.162 -5.116 904 HB VAL 104 HB VAL 104 -1.809 6.052 -4.765 905 HG11 VAL 104 1HG1 VAL 104 -3.102 7.234 -6.484 906 HG12 VAL 104 2HG1 VAL 104 -1.691 7.257 -7.547 907 HG13 VAL 104 3HG1 VAL 104 -1.662 8.144 -6.020 908 HG21 VAL 104 3HG2 VAL 104 -3.094 4.695 -6.377 909 HG22 VAL 104 1HG2 VAL 104 -1.652 3.841 -5.828 910 HG23 VAL 104 2HG2 VAL 104 -1.681 4.583 -7.428 911 H ARG 105 H ARG 105 1.315 3.973 -6.658 912 HA ARG 105 HA ARG 105 1.827 5.147 -9.329 913 HB2 ARG 105 2HB ARG 105 3.424 2.939 -7.974 914 HB3 ARG 105 3HB ARG 105 3.818 3.758 -9.481 915 HG2 ARG 105 2HG ARG 105 3.783 5.035 -6.735 916 HG3 ARG 105 3HG ARG 105 5.224 4.511 -7.598 917 HD2 ARG 105 2HD ARG 105 4.842 6.206 -9.318 918 HD3 ARG 105 3HD ARG 105 3.328 6.689 -8.535 919 HE ARG 105 HE ARG 105 5.115 6.996 -6.541 920 HH11 ARG 105 1HH1 ARG 105 5.148 8.183 -9.860 921 HH12 ARG 105 2HH1 ARG 105 6.065 9.595 -9.453 922 HH21 ARG 105 1HH2 ARG 105 6.296 8.847 -6.038 923 HH22 ARG 105 2HH2 ARG 105 6.718 9.973 -7.292 924 H LYS 106 H LYS 106 1.353 3.970 -11.082 925 HA LYS 106 HA LYS 106 -0.354 1.576 -10.758 926 HB2 LYS 106 2HB LYS 106 -1.705 3.403 -11.458 927 HB3 LYS 106 3HB LYS 106 -0.508 4.000 -12.587 928 HG2 LYS 106 2HG LYS 106 -1.695 1.300 -13.165 929 HG3 LYS 106 3HG LYS 106 -2.746 2.705 -13.362 930 HD2 LYS 106 2HD LYS 106 -0.978 3.722 -14.847 931 HD3 LYS 106 3HD LYS 106 -0.090 2.206 -14.751 932 HE2 LYS 106 2HE LYS 106 -1.894 1.019 -15.844 933 HE3 LYS 106 3HE LYS 106 -2.916 2.457 -15.811 934 HZ1 LYS 106 3HZ LYS 106 -0.357 2.215 -17.303 935 HZ2 LYS 106 1HZ LYS 106 -1.380 3.562 -17.295 936 HZ3 LYS 106 2HZ LYS 106 -1.898 2.109 -17.978 937 H VAL 107 H VAL 107 0.591 -0.172 -11.466 938 HA VAL 107 HA VAL 107 2.419 -0.224 -13.763 939 HB VAL 107 HB VAL 107 4.057 -1.636 -12.620 940 HG11 VAL 107 1HG1 VAL 107 3.560 0.872 -10.978 941 HG12 VAL 107 2HG1 VAL 107 4.480 0.769 -12.479 942 HG13 VAL 107 3HG1 VAL 107 5.072 -0.040 -11.029 943 HG21 VAL 107 3HG2 VAL 107 3.973 -2.101 -10.183 944 HG22 VAL 107 1HG2 VAL 107 2.627 -2.835 -11.056 945 HG23 VAL 107 2HG2 VAL 107 2.368 -1.369 -10.111 946 H THR 108 H THR 108 2.989 -2.811 -13.998 947 HA THR 108 HA THR 108 0.472 -4.362 -13.837 948 HB THR 108 HB THR 108 0.976 -5.198 -16.216 949 HG1 THR 108 HG1 THR 108 2.869 -4.532 -16.884 950 HG21 THR 108 3HG2 THR 108 -0.055 -3.295 -17.376 951 HG22 THR 108 1HG2 THR 108 0.265 -2.249 -15.992 952 HG23 THR 108 2HG2 THR 108 -0.863 -3.597 -15.840 953 H ASP 109 H ASP 109 3.994 -4.383 -14.427 954 HA ASP 109 HA ASP 109 4.130 -7.314 -14.303 955 HB2 ASP 109 2HB ASP 109 6.224 -5.212 -15.008 956 HB3 ASP 109 3HB ASP 109 6.543 -6.946 -14.982 957 H ASP 110 H ASP 110 5.994 -8.293 -13.232 958 HA ASP 110 HA ASP 110 5.957 -7.857 -10.411 959 HB2 ASP 110 2HB ASP 110 7.315 -9.837 -12.261 960 HB3 ASP 110 3HB ASP 110 7.934 -9.692 -10.623 961 H GLU 111 H GLU 111 8.612 -7.759 -12.798 962 HA GLU 111 HA GLU 111 10.573 -6.807 -10.998 963 HB2 GLU 111 2HB GLU 111 11.953 -6.379 -13.078 964 HB3 GLU 111 3HB GLU 111 11.319 -8.005 -12.904 965 HG2 GLU 111 2HG GLU 111 11.061 -7.544 -15.180 966 HG3 GLU 111 3HG GLU 111 9.454 -7.311 -14.513 967 H GLU 112 H GLU 112 8.269 -5.144 -12.985 968 HA GLU 112 HA GLU 112 9.272 -2.489 -12.783 969 HB2 GLU 112 2HB GLU 112 7.660 -3.264 -14.486 970 HB3 GLU 112 3HB GLU 112 6.457 -3.566 -13.242 971 HG2 GLU 112 2HG GLU 112 6.353 -1.159 -12.757 972 HG3 GLU 112 3HG GLU 112 7.587 -0.857 -13.984 973 H ALA 113 H ALA 113 6.824 -4.332 -10.980 974 HA ALA 113 HA ALA 113 6.047 -2.360 -9.130 975 HB1 ALA 113 3HB ALA 113 5.109 -4.232 -7.828 976 HB2 ALA 113 1HB ALA 113 6.007 -5.380 -8.822 977 HB3 ALA 113 2HB ALA 113 4.739 -4.389 -9.545 978 H LEU 114 H LEU 114 8.617 -4.817 -8.979 979 HA LEU 114 HA LEU 114 9.404 -4.526 -6.290 980 HB2 LEU 114 2HB LEU 114 11.015 -5.392 -8.716 981 HB3 LEU 114 3HB LEU 114 11.593 -5.536 -7.063 982 HG LEU 114 HG LEU 114 9.178 -6.983 -8.221 983 HD11 LEU 114 1HD1 LEU 114 10.542 -9.014 -8.034 984 HD12 LEU 114 2HD1 LEU 114 11.915 -8.060 -7.475 985 HD13 LEU 114 3HD1 LEU 114 11.292 -7.839 -9.112 986 HD21 LEU 114 3HD2 LEU 114 8.826 -6.523 -5.841 987 HD22 LEU 114 1HD2 LEU 114 10.403 -7.217 -5.447 988 HD23 LEU 114 2HD2 LEU 114 9.118 -8.241 -6.097 989 H LYS 115 H LYS 115 10.370 -2.745 -9.187 990 HA LYS 115 HA LYS 115 12.428 -1.130 -8.123 991 HB2 LYS 115 2HB LYS 115 10.353 -0.378 -10.236 992 HB3 LYS 115 3HB LYS 115 11.844 0.501 -9.921 993 HG2 LYS 115 2HG LYS 115 13.168 -1.423 -10.675 994 HG3 LYS 115 3HG LYS 115 11.688 -2.347 -10.949 995 HD2 LYS 115 2HD LYS 115 10.965 -0.691 -12.651 996 HD3 LYS 115 3HD LYS 115 12.443 0.237 -12.375 997 HE2 LYS 115 2HE LYS 115 12.649 -1.107 -14.391 998 HE3 LYS 115 3HE LYS 115 13.781 -1.693 -13.172 999 HZ1 LYS 115 3HZ LYS 115 12.687 -3.517 -14.270 1000 HZ2 LYS 115 1HZ LYS 115 11.162 -2.906 -13.872 1001 HZ3 LYS 115 2HZ LYS 115 12.192 -3.467 -12.652 1002 H ILE 116 H ILE 116 8.932 -0.680 -8.304 1003 HA ILE 116 HA ILE 116 8.874 1.985 -7.332 1004 HB ILE 116 HB ILE 116 6.611 -0.046 -7.542 1005 HG12 ILE 116 2HG1 ILE 116 7.675 0.283 -9.727 1006 HG13 ILE 116 3HG1 ILE 116 6.093 1.039 -9.724 1007 HG21 ILE 116 1HG2 ILE 116 6.484 2.977 -7.305 1008 HG22 ILE 116 2HG2 ILE 116 5.996 1.806 -6.078 1009 HG23 ILE 116 3HG2 ILE 116 5.111 1.908 -7.597 1010 HD11 ILE 116 3HD1 ILE 116 7.162 3.242 -9.480 1011 HD12 ILE 116 1HD1 ILE 116 7.707 2.379 -10.918 1012 HD13 ILE 116 2HD1 ILE 116 8.747 2.464 -9.498 1013 H VAL 117 H VAL 117 8.415 -1.168 -5.770 1014 HA VAL 117 HA VAL 117 7.520 -0.391 -3.229 1015 HB VAL 117 HB VAL 117 9.423 -2.687 -3.932 1016 HG11 VAL 117 1HG1 VAL 117 7.783 -2.294 -1.396 1017 HG12 VAL 117 2HG1 VAL 117 9.540 -2.214 -1.524 1018 HG13 VAL 117 3HG1 VAL 117 8.710 -3.742 -1.806 1019 HG21 VAL 117 3HG2 VAL 117 7.411 -4.105 -3.922 1020 HG22 VAL 117 1HG2 VAL 117 7.279 -2.820 -5.122 1021 HG23 VAL 117 2HG2 VAL 117 6.402 -2.692 -3.598 1022 H ARG 118 H ARG 118 10.804 -0.743 -4.514 1023 HA ARG 118 HA ARG 118 12.198 0.060 -2.172 1024 HB2 ARG 118 2HB ARG 118 13.035 -0.107 -5.095 1025 HB3 ARG 118 3HB ARG 118 14.147 0.375 -3.814 1026 HG2 ARG 118 2HG ARG 118 13.735 -1.805 -2.674 1027 HG3 ARG 118 3HG ARG 118 12.711 -2.290 -4.025 1028 HD2 ARG 118 2HD ARG 118 14.546 -2.419 -5.522 1029 HD3 ARG 118 3HD ARG 118 15.598 -1.470 -4.461 1030 HE ARG 118 HE ARG 118 14.671 -4.219 -3.851 1031 HH11 ARG 118 1HH1 ARG 118 17.235 -1.809 -3.843 1032 HH12 ARG 118 2HH1 ARG 118 18.374 -2.861 -3.067 1033 HH21 ARG 118 1HH2 ARG 118 16.118 -5.523 -2.718 1034 HH22 ARG 118 2HH2 ARG 118 17.739 -4.970 -2.428 1035 H GLU 119 H GLU 119 10.926 1.878 -4.954 1036 HA GLU 119 HA GLU 119 12.109 4.389 -4.411 1037 HB2 GLU 119 2HB GLU 119 9.400 3.829 -5.706 1038 HB3 GLU 119 3HB GLU 119 10.264 5.360 -5.779 1039 HG2 GLU 119 2HG GLU 119 11.260 2.749 -6.939 1040 HG3 GLU 119 3HG GLU 119 10.452 4.015 -7.852 1041 H PHE 120 H PHE 120 8.990 2.994 -3.431 1042 HA PHE 120 HA PHE 120 7.988 5.057 -1.859 1043 HB2 PHE 120 2HB PHE 120 7.619 2.047 -1.640 1044 HB3 PHE 120 3HB PHE 120 6.742 3.175 -0.613 1045 HD1 PHE 120 HD2 PHE 120 6.558 5.238 -3.141 1046 HD2 PHE 120 HD1 PHE 120 5.428 1.181 -2.392 1047 HE1 PHE 120 HE2 PHE 120 4.735 5.434 -4.775 1048 HE2 PHE 120 HE1 PHE 120 3.608 1.400 -4.020 1049 HZ PHE 120 HZ PHE 120 3.256 3.517 -5.213 1050 H MET 121 H MET 121 10.215 2.456 -1.021 1051 HA MET 121 HA MET 121 10.377 2.949 1.777 1052 HB2 MET 121 2HB MET 121 12.319 1.497 -0.081 1053 HB3 MET 121 3HB MET 121 12.371 1.433 1.679 1054 HG2 MET 121 2HG MET 121 10.303 0.240 1.794 1055 HG3 MET 121 3HG MET 121 9.946 0.562 0.100 1056 HE1 MET 121 3HE MET 121 13.041 -2.522 1.612 1057 HE2 MET 121 1HE MET 121 11.856 -1.721 2.643 1058 HE3 MET 121 2HE MET 121 13.203 -0.801 1.965 1059 H GLN 122 H GLN 122 11.926 4.456 -0.978 1060 HA GLN 122 HA GLN 122 14.093 5.721 0.449 1061 HB2 GLN 122 2HB GLN 122 12.851 6.563 -2.211 1062 HB3 GLN 122 3HB GLN 122 14.409 7.088 -1.579 1063 HG2 GLN 122 2HG GLN 122 13.665 4.296 -2.455 1064 HG3 GLN 122 3HG GLN 122 14.716 5.413 -3.311 1065 HE21 GLN 122 1HE2 GLN 122 15.215 2.680 -2.282 1066 HE22 GLN 122 2HE2 GLN 122 16.600 2.818 -1.257 1067 H LYS 123 H LYS 123 10.968 6.876 -0.831 1068 HA LYS 123 HA LYS 123 11.059 9.482 0.314 1069 HB2 LYS 123 2HB LYS 123 8.749 7.792 -0.729 1070 HB3 LYS 123 3HB LYS 123 8.490 9.393 -0.059 1071 HG2 LYS 123 2HG LYS 123 8.506 9.626 -2.423 1072 HG3 LYS 123 3HG LYS 123 10.023 10.311 -1.840 1073 HD2 LYS 123 2HD LYS 123 11.259 8.356 -2.570 1074 HD3 LYS 123 3HD LYS 123 9.764 7.493 -2.944 1075 HE2 LYS 123 2HE LYS 123 10.781 9.968 -4.376 1076 HE3 LYS 123 3HE LYS 123 10.853 8.313 -4.985 1077 HZ1 LYS 123 3HZ LYS 123 8.991 9.437 -5.939 1078 HZ2 LYS 123 1HZ LYS 123 8.398 9.872 -4.418 1079 HZ3 LYS 123 2HZ LYS 123 8.414 8.250 -4.884 1080 H ALA 124 H ALA 124 10.057 6.362 1.490 1081 HA ALA 124 HA ALA 124 8.643 7.166 3.838 1082 HB1 ALA 124 3HB ALA 124 10.064 4.543 3.189 1083 HB2 ALA 124 1HB ALA 124 8.385 4.933 2.812 1084 HB3 ALA 124 2HB ALA 124 8.900 4.792 4.491 1085 H GLY 125 H GLY 125 12.017 6.255 3.088 1086 HA2 GLY 125 2HA GLY 125 13.118 6.449 5.698 1087 HA3 GLY 125 3HA GLY 125 14.011 6.556 4.183 1088 H SER 126 H SER 126 12.170 8.849 3.400 1089 HA SER 126 HA SER 126 13.778 11.011 4.454 1090 HB2 SER 126 2HB SER 126 11.401 11.060 2.545 1091 HB3 SER 126 3HB SER 126 12.517 12.398 2.850 1092 HG SER 126 HG SER 126 13.424 9.870 1.944 1093 H LEU 127 H LEU 127 10.724 9.543 5.212 1094 HA LEU 127 HA LEU 127 9.464 11.712 6.587 1095 HB2 LEU 127 2HB LEU 127 9.060 8.727 7.023 1096 HB3 LEU 127 3HB LEU 127 7.959 10.004 7.519 1097 HG LEU 127 HG LEU 127 8.608 9.230 4.651 1098 HD11 LEU 127 1HD1 LEU 127 6.295 8.415 4.537 1099 HD12 LEU 127 2HD1 LEU 127 6.064 8.794 6.245 1100 HD13 LEU 127 3HD1 LEU 127 7.224 7.553 5.764 1101 HD21 LEU 127 3HD2 LEU 127 8.199 11.621 4.761 1102 HD22 LEU 127 1HD2 LEU 127 6.709 11.362 5.675 1103 HD23 LEU 127 2HD2 LEU 127 6.828 10.820 4.001 1104 H GLU 128 H GLU 128 11.942 9.460 7.421 1105 HA GLU 128 HA GLU 128 11.984 9.544 10.221 1106 HB2 GLU 128 2HB GLU 128 13.357 8.000 8.846 1107 HB3 GLU 128 3HB GLU 128 14.311 9.352 8.250 1108 HG2 GLU 128 2HG GLU 128 15.088 9.780 10.583 1109 HG3 GLU 128 3HG GLU 128 14.216 8.339 11.113 1110 H HIS 129 H HIS 129 13.289 11.767 7.787 1111 HA HIS 129 HA HIS 129 14.209 13.820 7.799 1112 HB2 HIS 129 2HB HIS 129 12.390 14.100 10.220 1113 HB3 HIS 129 3HB HIS 129 13.254 15.464 9.512 1114 HD1 HIS 129 HD1 HIS 129 10.134 13.602 9.211 1115 HD2 HIS 129 HD2 HIS 129 12.508 15.892 6.680 1116 HE1 HIS 129 HE1 HIS 129 8.685 14.157 7.237 1117 HE2 HIS 129 HE2 HIS 129 10.104 15.626 5.779 1118 H HIS 130 H HIS 130 15.588 11.690 9.257 1119 HA HIS 130 HA HIS 130 17.749 13.372 10.349 1120 HB2 HIS 130 2HB HIS 130 16.809 10.740 11.599 1121 HB3 HIS 130 3HB HIS 130 18.217 11.666 12.109 1122 HD1 HIS 130 HD1 HIS 130 14.615 11.305 12.687 1123 HD2 HIS 130 HD2 HIS 130 17.520 14.191 13.399 1124 HE1 HIS 130 HE1 HIS 130 13.614 12.867 14.371 1125 HE2 HIS 130 HE2 HIS 130 15.441 14.516 14.893 1126 H HIS 131 H HIS 131 17.000 11.884 7.784 1127 HA HIS 131 HA HIS 131 18.404 9.373 7.760 1128 HB2 HIS 131 2HB HIS 131 16.248 9.782 6.568 1129 HB3 HIS 131 3HB HIS 131 17.072 10.888 5.480 1130 HD1 HIS 131 HD1 HIS 131 18.407 9.865 3.559 1131 HD2 HIS 131 HD2 HIS 131 16.793 7.029 6.129 1132 HE1 HIS 131 HE1 HIS 131 18.720 7.662 2.405 1133 HE2 HIS 131 HE2 HIS 131 17.809 5.953 4.011 1134 H HIS 132 H HIS 132 19.557 12.428 7.514 1135 HA HIS 132 HA HIS 132 22.179 11.614 6.650 1136 HB2 HIS 132 2HB HIS 132 21.154 12.114 4.444 1137 HB3 HIS 132 3HB HIS 132 20.646 13.695 5.016 1138 HD1 HIS 132 HD1 HIS 132 21.991 15.214 3.555 1139 HD2 HIS 132 HD2 HIS 132 24.331 12.218 5.240 1140 HE1 HIS 132 HE1 HIS 132 24.355 15.774 2.925 1141 HE2 HIS 132 HE2 HIS 132 25.718 13.847 3.791 1142 H HIS 133 H HIS 133 19.982 14.321 7.252 1143 HA HIS 133 HA HIS 133 21.112 14.840 9.822 1144 HB2 HIS 133 2HB HIS 133 21.735 17.196 9.543 1145 HB3 HIS 133 3HB HIS 133 22.698 16.217 8.445 1146 HD1 HIS 133 HD1 HIS 133 20.202 18.968 8.515 1147 HD2 HIS 133 HD2 HIS 133 22.088 16.592 5.671 1148 HE1 HIS 133 HE1 HIS 133 19.834 20.122 6.318 1149 HE2 HIS 133 HE2 HIS 133 20.777 18.548 4.604 1150 H HIS 134 H HIS 134 19.816 16.638 10.918 1151 HA HIS 134 HA HIS 134 17.022 16.493 10.175 1152 HB2 HIS 134 2HB HIS 134 17.657 16.461 12.566 1153 HB3 HIS 134 3HB HIS 134 18.374 18.063 12.423 1154 HD1 HIS 134 HD1 HIS 134 14.967 16.402 12.018 1155 HD2 HIS 134 HD2 HIS 134 16.609 20.112 12.945 1156 HE1 HIS 134 HE1 HIS 134 13.023 17.880 12.612 1157 HE2 HIS 134 HE2 HIS 134 14.025 20.140 13.049 Start of MODEL 4 1 H1 MET 1 1H MET 1 5.591 9.583 14.147 2 H2 MET 1 2H MET 1 4.150 9.111 14.896 3 H3 MET 1 3H MET 1 4.413 10.736 14.515 4 HA MET 1 HA MET 1 2.888 9.727 12.975 5 HB2 MET 1 2HB MET 1 4.256 11.558 12.132 6 HB3 MET 1 3HB MET 1 5.614 10.478 11.842 7 HG2 MET 1 2HG MET 1 4.341 9.337 10.076 8 HG3 MET 1 3HG MET 1 2.965 10.394 10.377 9 HE1 MET 1 3HE MET 1 4.322 11.541 6.884 10 HE2 MET 1 1HE MET 1 2.917 10.955 7.774 11 HE3 MET 1 2HE MET 1 4.310 9.900 7.528 12 H LYS 2 H LYS 2 2.428 8.081 11.442 13 HA LYS 2 HA LYS 2 4.099 5.652 11.682 14 HB2 LYS 2 2HB LYS 2 1.599 5.887 12.642 15 HB3 LYS 2 3HB LYS 2 1.167 5.509 10.979 16 HG2 LYS 2 2HG LYS 2 2.370 3.398 11.104 17 HG3 LYS 2 3HG LYS 2 2.978 3.811 12.712 18 HD2 LYS 2 2HD LYS 2 0.476 3.959 13.401 19 HD3 LYS 2 3HD LYS 2 0.146 3.105 11.888 20 HE2 LYS 2 2HE LYS 2 0.266 1.503 13.699 21 HE3 LYS 2 3HE LYS 2 1.671 1.283 12.658 22 HZ1 LYS 2 3HZ LYS 2 1.622 2.710 15.258 23 HZ2 LYS 2 1HZ LYS 2 2.982 2.582 14.258 24 HZ3 LYS 2 2HZ LYS 2 2.313 1.198 14.964 25 H ILE 3 H ILE 3 4.350 4.338 9.804 26 HA ILE 3 HA ILE 3 3.894 5.691 7.196 27 HB ILE 3 HB ILE 3 6.121 3.733 7.925 28 HG12 ILE 3 2HG1 ILE 3 6.359 6.744 7.463 29 HG13 ILE 3 3HG1 ILE 3 6.420 5.963 9.042 30 HG21 ILE 3 1HG2 ILE 3 5.472 3.590 5.555 31 HG22 ILE 3 2HG2 ILE 3 7.076 4.306 5.710 32 HG23 ILE 3 3HG2 ILE 3 5.683 5.335 5.372 33 HD11 ILE 3 3HD1 ILE 3 8.637 6.519 8.230 34 HD12 ILE 3 1HD1 ILE 3 8.385 5.535 6.789 35 HD13 ILE 3 2HD1 ILE 3 8.445 4.774 8.382 36 H LEU 4 H LEU 4 2.494 4.600 5.907 37 HA LEU 4 HA LEU 4 2.419 1.636 6.005 38 HB2 LEU 4 2HB LEU 4 0.124 3.595 5.818 39 HB3 LEU 4 3HB LEU 4 -0.017 2.059 4.985 40 HG LEU 4 HG LEU 4 0.402 0.903 7.216 41 HD11 LEU 4 1HD1 LEU 4 1.437 2.718 8.467 42 HD12 LEU 4 2HD1 LEU 4 -0.000 2.137 9.297 43 HD13 LEU 4 3HD1 LEU 4 -0.054 3.654 8.396 44 HD21 LEU 4 3HD2 LEU 4 -1.816 1.065 6.203 45 HD22 LEU 4 1HD2 LEU 4 -2.084 2.616 7.007 46 HD23 LEU 4 2HD2 LEU 4 -1.905 1.140 7.961 47 H ILE 5 H ILE 5 2.730 0.626 4.113 48 HA ILE 5 HA ILE 5 2.408 2.100 1.566 49 HB ILE 5 HB ILE 5 4.366 -0.196 2.080 50 HG12 ILE 5 2HG1 ILE 5 4.938 2.776 1.639 51 HG13 ILE 5 3HG1 ILE 5 5.174 1.891 3.142 52 HG21 ILE 5 1HG2 ILE 5 3.466 -0.227 -0.221 53 HG22 ILE 5 2HG2 ILE 5 5.172 0.222 -0.233 54 HG23 ILE 5 3HG2 ILE 5 3.933 1.462 -0.440 55 HD11 ILE 5 3HD1 ILE 5 6.704 1.471 0.569 56 HD12 ILE 5 1HD1 ILE 5 6.930 0.553 2.062 57 HD13 ILE 5 2HD1 ILE 5 7.282 2.279 2.027 58 H LEU 6 H LEU 6 0.565 1.396 0.678 59 HA LEU 6 HA LEU 6 -0.644 -1.157 1.363 60 HB2 LEU 6 2HB LEU 6 -1.626 1.018 -0.527 61 HB3 LEU 6 3HB LEU 6 -2.567 -0.350 0.048 62 HG LEU 6 HG LEU 6 -1.579 1.979 1.717 63 HD11 LEU 6 1HD1 LEU 6 -3.425 2.590 0.246 64 HD12 LEU 6 2HD1 LEU 6 -3.927 2.593 1.933 65 HD13 LEU 6 3HD1 LEU 6 -4.395 1.255 0.877 66 HD21 LEU 6 3HD2 LEU 6 -1.575 -0.030 3.075 67 HD22 LEU 6 1HD2 LEU 6 -3.231 -0.405 2.590 68 HD23 LEU 6 2HD2 LEU 6 -2.891 1.031 3.564 69 H ILE 7 H ILE 7 -0.708 -2.871 0.046 70 HA ILE 7 HA ILE 7 0.269 -2.699 -2.747 71 HB ILE 7 HB ILE 7 0.691 -5.005 -0.783 72 HG12 ILE 7 2HG1 ILE 7 2.230 -3.117 -0.305 73 HG13 ILE 7 3HG1 ILE 7 3.115 -4.507 -0.920 74 HG21 ILE 7 1HG2 ILE 7 0.333 -5.869 -3.049 75 HG22 ILE 7 2HG2 ILE 7 2.027 -6.076 -2.595 76 HG23 ILE 7 3HG2 ILE 7 1.560 -4.773 -3.688 77 HD11 ILE 7 3HD1 ILE 7 3.966 -2.439 -1.824 78 HD12 ILE 7 1HD1 ILE 7 2.382 -2.030 -2.478 79 HD13 ILE 7 2HD1 ILE 7 3.272 -3.419 -3.116 80 H ASN 8 H ASN 8 -1.365 -3.168 -4.104 81 HA ASN 8 HA ASN 8 -3.157 -5.434 -3.455 82 HB2 ASN 8 2HB ASN 8 -4.426 -3.296 -3.214 83 HB3 ASN 8 3HB ASN 8 -4.020 -2.866 -4.869 84 HD21 ASN 8 1HD2 ASN 8 -6.134 -2.852 -5.593 85 HD22 ASN 8 2HD2 ASN 8 -7.121 -4.258 -5.709 86 H THR 9 H THR 9 -2.251 -6.925 -4.739 87 HA THR 9 HA THR 9 -2.139 -6.396 -7.636 88 HB THR 9 HB THR 9 0.170 -6.484 -7.008 89 HG1 THR 9 HG1 THR 9 0.444 -7.671 -8.717 90 HG21 THR 9 3HG2 THR 9 -0.004 -7.570 -4.813 91 HG22 THR 9 1HG2 THR 9 1.210 -8.363 -5.822 92 HG23 THR 9 2HG2 THR 9 -0.374 -9.108 -5.599 93 H ASN 10 H ASN 10 -2.786 -8.029 -8.965 94 HA ASN 10 HA ASN 10 -4.787 -9.783 -7.825 95 HB2 ASN 10 2HB ASN 10 -5.195 -8.409 -9.885 96 HB3 ASN 10 3HB ASN 10 -4.007 -9.383 -10.742 97 HD21 ASN 10 1HD2 ASN 10 -5.610 -9.949 -12.251 98 HD22 ASN 10 2HD2 ASN 10 -6.832 -11.120 -11.900 99 H ASN 11 H ASN 11 -1.473 -10.119 -8.738 100 HA ASN 11 HA ASN 11 -1.752 -13.077 -8.836 101 HB2 ASN 11 2HB ASN 11 0.273 -13.234 -10.085 102 HB3 ASN 11 3HB ASN 11 -0.642 -11.947 -10.844 103 HD21 ASN 11 1HD2 ASN 11 0.064 -9.734 -10.451 104 HD22 ASN 11 2HD2 ASN 11 1.724 -9.434 -10.075 105 H ASP 12 H ASP 12 -1.007 -14.213 -7.203 106 HA ASP 12 HA ASP 12 -0.234 -12.991 -4.743 107 HB2 ASP 12 2HB ASP 12 -1.743 -14.899 -4.754 108 HB3 ASP 12 3HB ASP 12 -0.569 -15.898 -5.604 109 H GLU 13 H GLU 13 1.503 -14.376 -7.369 110 HA GLU 13 HA GLU 13 3.865 -15.354 -6.181 111 HB2 GLU 13 2HB GLU 13 3.628 -14.061 -8.937 112 HB3 GLU 13 3HB GLU 13 4.813 -15.264 -8.422 113 HG2 GLU 13 2HG GLU 13 3.068 -16.965 -8.249 114 HG3 GLU 13 3HG GLU 13 1.829 -15.764 -8.622 115 H LEU 14 H LEU 14 2.990 -12.168 -7.436 116 HA LEU 14 HA LEU 14 5.453 -10.848 -7.127 117 HB2 LEU 14 2HB LEU 14 3.720 -10.002 -8.601 118 HB3 LEU 14 3HB LEU 14 2.615 -9.799 -7.253 119 HG LEU 14 HG LEU 14 3.968 -7.962 -6.353 120 HD11 LEU 14 1HD1 LEU 14 5.846 -8.414 -8.682 121 HD12 LEU 14 2HD1 LEU 14 6.195 -8.690 -6.976 122 HD13 LEU 14 3HD1 LEU 14 5.908 -7.054 -7.558 123 HD21 LEU 14 3HD2 LEU 14 3.557 -6.294 -8.076 124 HD22 LEU 14 1HD2 LEU 14 2.219 -7.434 -7.987 125 HD23 LEU 14 2HD2 LEU 14 3.394 -7.555 -9.299 126 H ILE 15 H ILE 15 2.647 -11.191 -4.961 127 HA ILE 15 HA ILE 15 3.222 -9.369 -2.943 128 HB ILE 15 HB ILE 15 1.956 -12.140 -2.683 129 HG12 ILE 15 2HG1 ILE 15 0.658 -9.397 -2.968 130 HG13 ILE 15 3HG1 ILE 15 0.798 -10.589 -4.253 131 HG21 ILE 15 1HG2 ILE 15 0.955 -11.357 -0.561 132 HG22 ILE 15 2HG2 ILE 15 1.880 -9.860 -0.680 133 HG23 ILE 15 3HG2 ILE 15 2.717 -11.400 -0.472 134 HD11 ILE 15 3HD1 ILE 15 -1.417 -10.599 -3.396 135 HD12 ILE 15 1HD1 ILE 15 -0.843 -10.810 -1.744 136 HD13 ILE 15 2HD1 ILE 15 -0.639 -12.110 -2.922 137 H LYS 16 H LYS 16 4.237 -12.752 -3.245 138 HA LYS 16 HA LYS 16 5.633 -13.086 -0.848 139 HB2 LYS 16 2HB LYS 16 6.222 -14.429 -3.522 140 HB3 LYS 16 3HB LYS 16 6.682 -15.039 -1.931 141 HG2 LYS 16 2HG LYS 16 3.846 -14.687 -2.952 142 HG3 LYS 16 3HG LYS 16 4.718 -16.218 -2.825 143 HD2 LYS 16 2HD LYS 16 4.795 -15.998 -0.368 144 HD3 LYS 16 3HD LYS 16 4.009 -14.417 -0.462 145 HE2 LYS 16 2HE LYS 16 2.426 -16.218 0.172 146 HE3 LYS 16 3HE LYS 16 1.978 -15.447 -1.351 147 HZ1 LYS 16 3HZ LYS 16 2.983 -17.298 -2.535 148 HZ2 LYS 16 1HZ LYS 16 1.779 -17.841 -1.482 149 HZ3 LYS 16 2HZ LYS 16 3.407 -18.037 -1.075 150 H LYS 17 H LYS 17 6.711 -11.883 -3.983 151 HA LYS 17 HA LYS 17 9.496 -11.760 -3.372 152 HB2 LYS 17 2HB LYS 17 8.001 -10.288 -5.577 153 HB3 LYS 17 3HB LYS 17 9.733 -10.623 -5.509 154 HG2 LYS 17 2HG LYS 17 9.192 -13.083 -5.593 155 HG3 LYS 17 3HG LYS 17 7.497 -12.651 -5.834 156 HD2 LYS 17 2HD LYS 17 8.435 -13.130 -8.002 157 HD3 LYS 17 3HD LYS 17 8.196 -11.383 -7.914 158 HE2 LYS 17 2HE LYS 17 10.601 -11.086 -7.406 159 HE3 LYS 17 3HE LYS 17 10.833 -12.835 -7.469 160 HZ1 LYS 17 3HZ LYS 17 10.019 -11.079 -9.707 161 HZ2 LYS 17 1HZ LYS 17 10.107 -12.761 -9.790 162 HZ3 LYS 17 2HZ LYS 17 11.506 -11.857 -9.516 163 H ILE 18 H ILE 18 6.856 -9.343 -3.426 164 HA ILE 18 HA ILE 18 8.331 -7.006 -2.855 165 HB ILE 18 HB ILE 18 5.420 -7.675 -2.220 166 HG12 ILE 18 2HG1 ILE 18 6.648 -6.035 -4.481 167 HG13 ILE 18 3HG1 ILE 18 5.921 -7.629 -4.636 168 HG21 ILE 18 1HG2 ILE 18 5.008 -5.253 -1.885 169 HG22 ILE 18 2HG2 ILE 18 6.734 -4.936 -2.061 170 HG23 ILE 18 3HG2 ILE 18 6.148 -5.881 -0.693 171 HD11 ILE 18 3HD1 ILE 18 3.739 -6.667 -4.021 172 HD12 ILE 18 1HD1 ILE 18 4.430 -5.932 -5.466 173 HD13 ILE 18 2HD1 ILE 18 4.484 -5.068 -3.930 174 H LYS 19 H LYS 19 6.834 -9.428 -0.760 175 HA LYS 19 HA LYS 19 7.282 -8.267 1.751 176 HB2 LYS 19 2HB LYS 19 7.134 -11.192 0.935 177 HB3 LYS 19 3HB LYS 19 7.196 -10.646 2.610 178 HG2 LYS 19 2HG LYS 19 5.071 -9.426 2.308 179 HG3 LYS 19 3HG LYS 19 5.010 -9.946 0.620 180 HD2 LYS 19 2HD LYS 19 3.555 -11.357 2.015 181 HD3 LYS 19 3HD LYS 19 4.884 -12.306 1.338 182 HE2 LYS 19 2HE LYS 19 6.102 -12.053 3.523 183 HE3 LYS 19 3HE LYS 19 4.684 -11.227 4.174 184 HZ1 LYS 19 3HZ LYS 19 4.765 -13.576 4.752 185 HZ2 LYS 19 1HZ LYS 19 4.715 -13.993 3.115 186 HZ3 LYS 19 2HZ LYS 19 3.398 -13.210 3.829 187 H LYS 20 H LYS 20 9.348 -10.499 -0.174 188 HA LYS 20 HA LYS 20 11.408 -10.727 1.758 189 HB2 LYS 20 2HB LYS 20 11.556 -11.155 -1.251 190 HB3 LYS 20 3HB LYS 20 12.800 -11.659 -0.103 191 HG2 LYS 20 2HG LYS 20 9.951 -12.696 -0.289 192 HG3 LYS 20 3HG LYS 20 11.432 -13.577 -0.672 193 HD2 LYS 20 2HD LYS 20 12.101 -13.551 1.698 194 HD3 LYS 20 3HD LYS 20 10.714 -12.540 2.107 195 HE2 LYS 20 2HE LYS 20 9.216 -14.399 1.378 196 HE3 LYS 20 3HE LYS 20 10.645 -15.412 1.144 197 HZ1 LYS 20 3HZ LYS 20 9.611 -15.769 3.299 198 HZ2 LYS 20 1HZ LYS 20 9.829 -14.139 3.694 199 HZ3 LYS 20 2HZ LYS 20 11.172 -15.144 3.470 200 H GLU 21 H GLU 21 10.954 -8.450 -0.917 201 HA GLU 21 HA GLU 21 13.365 -7.045 -0.875 202 HB2 GLU 21 2HB GLU 21 10.557 -5.934 -1.353 203 HB3 GLU 21 3HB GLU 21 12.053 -5.109 -1.791 204 HG2 GLU 21 2HG GLU 21 11.209 -7.797 -2.920 205 HG3 GLU 21 3HG GLU 21 10.851 -6.252 -3.685 206 H VAL 22 H VAL 22 10.389 -6.491 0.995 207 HA VAL 22 HA VAL 22 11.525 -4.240 2.421 208 HB VAL 22 HB VAL 22 9.386 -3.923 3.431 209 HG11 VAL 22 1HG1 VAL 22 9.554 -3.169 1.128 210 HG12 VAL 22 2HG1 VAL 22 7.906 -3.698 1.480 211 HG13 VAL 22 3HG1 VAL 22 8.986 -4.738 0.547 212 HG21 VAL 22 3HG2 VAL 22 8.510 -6.637 2.375 213 HG22 VAL 22 1HG2 VAL 22 7.469 -5.473 3.201 214 HG23 VAL 22 2HG2 VAL 22 8.804 -6.233 4.067 215 H GLU 23 H GLU 23 11.277 -7.680 3.018 216 HA GLU 23 HA GLU 23 11.363 -7.607 5.894 217 HB2 GLU 23 2HB GLU 23 11.805 -9.844 3.885 218 HB3 GLU 23 3HB GLU 23 12.116 -10.104 5.604 219 HG2 GLU 23 2HG GLU 23 9.753 -9.468 6.094 220 HG3 GLU 23 3HG GLU 23 9.450 -9.323 4.364 221 H ASN 24 H ASN 24 13.796 -7.995 3.320 222 HA ASN 24 HA ASN 24 16.080 -8.141 5.012 223 HB2 ASN 24 2HB ASN 24 15.789 -7.333 2.091 224 HB3 ASN 24 3HB ASN 24 17.348 -7.313 2.913 225 HD21 ASN 24 1HD2 ASN 24 15.111 -9.248 1.236 226 HD22 ASN 24 2HD2 ASN 24 15.901 -10.760 1.490 227 H GLN 25 H GLN 25 13.972 -5.546 4.336 228 HA GLN 25 HA GLN 25 15.920 -3.517 5.283 229 HB2 GLN 25 2HB GLN 25 13.389 -3.142 3.624 230 HB3 GLN 25 3HB GLN 25 14.449 -1.844 4.166 231 HG2 GLN 25 2HG GLN 25 15.233 -4.076 2.254 232 HG3 GLN 25 3HG GLN 25 14.819 -2.426 1.794 233 HE21 GLN 25 1HE2 GLN 25 17.281 -4.497 3.108 234 HE22 GLN 25 2HE2 GLN 25 18.541 -3.319 3.158 235 H GLY 26 H GLY 26 13.576 -5.440 6.527 236 HA2 GLY 26 2HA GLY 26 12.850 -5.490 8.689 237 HA3 GLY 26 3HA GLY 26 13.612 -3.938 8.961 238 H TYR 27 H TYR 27 11.047 -4.612 6.601 239 HA TYR 27 HA TYR 27 9.223 -2.747 7.961 240 HB2 TYR 27 2HB TYR 27 9.300 -3.920 5.177 241 HB3 TYR 27 3HB TYR 27 7.797 -3.253 5.787 242 HD1 TYR 27 HD1 TYR 27 11.412 -2.098 5.836 243 HD2 TYR 27 HD2 TYR 27 7.345 -1.161 4.859 244 HE1 TYR 27 HE1 TYR 27 12.101 0.150 5.108 245 HE2 TYR 27 HE2 TYR 27 8.039 1.084 4.137 246 HH TYR 27 HH TYR 27 11.307 1.972 3.682 247 H GLN 28 H GLN 28 7.297 -3.358 8.786 248 HA GLN 28 HA GLN 28 6.838 -6.165 9.408 249 HB2 GLN 28 2HB GLN 28 6.760 -4.403 11.155 250 HB3 GLN 28 3HB GLN 28 5.447 -3.604 10.302 251 HG2 GLN 28 2HG GLN 28 3.956 -5.475 10.757 252 HG3 GLN 28 3HG GLN 28 5.277 -6.399 11.472 253 HE21 GLN 28 1HE2 GLN 28 6.136 -5.720 13.488 254 HE22 GLN 28 2HE2 GLN 28 5.221 -4.713 14.550 255 H VAL 29 H VAL 29 5.679 -7.313 7.914 256 HA VAL 29 HA VAL 29 3.711 -6.042 6.174 257 HB VAL 29 HB VAL 29 4.439 -9.009 6.309 258 HG11 VAL 29 1HG1 VAL 29 3.022 -7.416 4.135 259 HG12 VAL 29 2HG1 VAL 29 2.260 -8.588 5.212 260 HG13 VAL 29 3HG1 VAL 29 3.452 -9.126 4.024 261 HG21 VAL 29 3HG2 VAL 29 6.453 -7.686 5.766 262 HG22 VAL 29 1HG2 VAL 29 5.573 -6.862 4.474 263 HG23 VAL 29 2HG2 VAL 29 5.913 -8.591 4.346 264 H ARG 30 H ARG 30 1.534 -6.058 6.535 265 HA ARG 30 HA ARG 30 0.367 -7.981 8.450 266 HB2 ARG 30 2HB ARG 30 0.580 -5.623 9.385 267 HB3 ARG 30 3HB ARG 30 -0.525 -5.075 8.134 268 HG2 ARG 30 2HG ARG 30 -1.361 -7.280 10.030 269 HG3 ARG 30 3HG ARG 30 -1.414 -5.604 10.563 270 HD2 ARG 30 2HD ARG 30 -3.063 -5.040 8.926 271 HD3 ARG 30 3HD ARG 30 -2.837 -6.559 8.056 272 HE ARG 30 HE ARG 30 -3.646 -7.408 10.490 273 HH11 ARG 30 1HH1 ARG 30 -4.993 -5.014 8.319 274 HH12 ARG 30 2HH1 ARG 30 -6.622 -5.279 8.832 275 HH21 ARG 30 1HH2 ARG 30 -5.821 -7.789 11.133 276 HH22 ARG 30 2HH2 ARG 30 -7.093 -6.851 10.425 277 H ASP 31 H ASP 31 -1.082 -9.221 7.530 278 HA ASP 31 HA ASP 31 -2.066 -8.863 4.832 279 HB2 ASP 31 2HB ASP 31 -1.353 -11.067 5.408 280 HB3 ASP 31 3HB ASP 31 -2.205 -11.031 6.947 281 H VAL 32 H VAL 32 -4.171 -8.342 4.217 282 HA VAL 32 HA VAL 32 -6.275 -7.944 6.272 283 HB VAL 32 HB VAL 32 -5.845 -6.033 3.929 284 HG11 VAL 32 1HG1 VAL 32 -8.167 -6.128 4.742 285 HG12 VAL 32 2HG1 VAL 32 -7.444 -4.566 5.136 286 HG13 VAL 32 3HG1 VAL 32 -7.625 -5.797 6.391 287 HG21 VAL 32 3HG2 VAL 32 -4.995 -4.364 5.554 288 HG22 VAL 32 1HG2 VAL 32 -3.928 -5.767 5.415 289 HG23 VAL 32 2HG2 VAL 32 -4.997 -5.603 6.809 290 H ASN 33 H ASN 33 -7.881 -9.346 5.728 291 HA ASN 33 HA ASN 33 -8.549 -9.789 2.869 292 HB2 ASN 33 2HB ASN 33 -9.268 -11.566 5.238 293 HB3 ASN 33 3HB ASN 33 -9.649 -11.885 3.545 294 HD21 ASN 33 1HD2 ASN 33 -7.339 -12.233 6.003 295 HD22 ASN 33 2HD2 ASN 33 -6.080 -12.906 5.033 296 H ASP 34 H ASP 34 -10.047 -9.432 6.084 297 HA ASP 34 HA ASP 34 -12.703 -9.092 4.906 298 HB2 ASP 34 2HB ASP 34 -11.807 -9.261 7.820 299 HB3 ASP 34 3HB ASP 34 -13.488 -9.138 7.305 300 H SER 35 H SER 35 -14.087 -7.330 5.365 301 HA SER 35 HA SER 35 -13.117 -4.686 5.631 302 HB2 SER 35 2HB SER 35 -15.897 -5.753 6.315 303 HB3 SER 35 3HB SER 35 -15.485 -4.080 5.919 304 HG SER 35 HG SER 35 -15.558 -4.569 3.894 305 H ASP 36 H ASP 36 -14.194 -7.106 7.933 306 HA ASP 36 HA ASP 36 -14.212 -5.571 10.298 307 HB2 ASP 36 2HB ASP 36 -15.257 -7.822 10.067 308 HB3 ASP 36 3HB ASP 36 -13.661 -8.547 9.926 309 H GLU 37 H GLU 37 -11.652 -7.479 8.667 310 HA GLU 37 HA GLU 37 -9.635 -6.929 10.612 311 HB2 GLU 37 2HB GLU 37 -9.428 -7.925 7.747 312 HB3 GLU 37 3HB GLU 37 -8.042 -7.774 8.832 313 HG2 GLU 37 2HG GLU 37 -10.447 -9.597 9.159 314 HG3 GLU 37 3HG GLU 37 -8.777 -10.068 8.864 315 H LEU 38 H LEU 38 -10.779 -5.213 7.782 316 HA LEU 38 HA LEU 38 -8.694 -3.357 7.478 317 HB2 LEU 38 2HB LEU 38 -10.500 -3.587 5.839 318 HB3 LEU 38 3HB LEU 38 -11.677 -3.010 7.010 319 HG LEU 38 HG LEU 38 -10.431 -0.785 7.043 320 HD11 LEU 38 1HD1 LEU 38 -8.966 -1.951 4.665 321 HD12 LEU 38 2HD1 LEU 38 -8.269 -1.554 6.239 322 HD13 LEU 38 3HD1 LEU 38 -8.899 -0.273 5.209 323 HD21 LEU 38 3HD2 LEU 38 -12.502 -1.040 5.751 324 HD22 LEU 38 1HD2 LEU 38 -11.576 -1.596 4.352 325 HD23 LEU 38 2HD2 LEU 38 -11.376 0.054 4.949 326 H LYS 39 H LYS 39 -11.752 -3.077 9.391 327 HA LYS 39 HA LYS 39 -11.013 -0.602 10.570 328 HB2 LYS 39 2HB LYS 39 -12.967 -0.803 11.972 329 HB3 LYS 39 3HB LYS 39 -13.364 -1.325 10.349 330 HG2 LYS 39 2HG LYS 39 -14.489 -2.914 11.583 331 HG3 LYS 39 3HG LYS 39 -12.959 -3.749 11.337 332 HD2 LYS 39 2HD LYS 39 -12.209 -3.125 13.588 333 HD3 LYS 39 3HD LYS 39 -13.670 -2.157 13.838 334 HE2 LYS 39 2HE LYS 39 -14.135 -4.139 14.998 335 HE3 LYS 39 3HE LYS 39 -14.922 -4.417 13.444 336 HZ1 LYS 39 3HZ LYS 39 -13.724 -6.358 14.006 337 HZ2 LYS 39 1HZ LYS 39 -12.319 -5.488 14.366 338 HZ3 LYS 39 2HZ LYS 39 -12.854 -5.608 12.768 339 H LYS 40 H LYS 40 -10.405 -3.940 11.516 340 HA LYS 40 HA LYS 40 -9.671 -3.775 14.185 341 HB2 LYS 40 2HB LYS 40 -8.619 -5.475 11.899 342 HB3 LYS 40 3HB LYS 40 -7.931 -5.650 13.509 343 HG2 LYS 40 2HG LYS 40 -10.924 -5.840 13.214 344 HG3 LYS 40 3HG LYS 40 -9.942 -7.205 12.650 345 HD2 LYS 40 2HD LYS 40 -9.813 -6.030 15.457 346 HD3 LYS 40 3HD LYS 40 -10.781 -7.435 15.005 347 HE2 LYS 40 2HE LYS 40 -7.756 -7.268 14.725 348 HE3 LYS 40 3HE LYS 40 -8.604 -8.045 16.062 349 HZ1 LYS 40 3HZ LYS 40 -9.611 -9.575 14.462 350 HZ2 LYS 40 1HZ LYS 40 -7.924 -9.657 14.418 351 HZ3 LYS 40 2HZ LYS 40 -8.761 -8.841 13.202 352 H GLU 41 H GLU 41 -7.649 -3.157 11.320 353 HA GLU 41 HA GLU 41 -5.342 -2.446 12.895 354 HB2 GLU 41 2HB GLU 41 -4.172 -2.203 10.837 355 HB3 GLU 41 3HB GLU 41 -5.268 -3.561 10.599 356 HG2 GLU 41 2HG GLU 41 -6.849 -1.713 9.553 357 HG3 GLU 41 3HG GLU 41 -5.359 -0.798 9.374 358 H MET 42 H MET 42 -7.970 -0.727 11.196 359 HA MET 42 HA MET 42 -6.856 1.814 10.956 360 HB2 MET 42 2HB MET 42 -9.755 0.976 11.297 361 HB3 MET 42 3HB MET 42 -9.301 2.649 11.003 362 HG2 MET 42 2HG MET 42 -8.216 0.652 9.068 363 HG3 MET 42 3HG MET 42 -9.952 0.922 9.018 364 HE1 MET 42 3HE MET 42 -7.138 3.653 9.887 365 HE2 MET 42 1HE MET 42 -6.885 4.342 8.285 366 HE3 MET 42 2HE MET 42 -6.381 2.688 8.618 367 H LYS 43 H LYS 43 -8.675 0.486 13.724 368 HA LYS 43 HA LYS 43 -8.594 2.776 15.392 369 HB2 LYS 43 2HB LYS 43 -8.846 -0.184 16.026 370 HB3 LYS 43 3HB LYS 43 -8.713 0.994 17.320 371 HG2 LYS 43 2HG LYS 43 -11.034 0.462 17.011 372 HG3 LYS 43 3HG LYS 43 -10.771 2.125 16.485 373 HD2 LYS 43 2HD LYS 43 -10.858 1.456 14.148 374 HD3 LYS 43 3HD LYS 43 -10.897 -0.250 14.589 375 HE2 LYS 43 2HE LYS 43 -13.117 0.468 13.925 376 HE3 LYS 43 3HE LYS 43 -13.118 0.103 15.651 377 HZ1 LYS 43 3HZ LYS 43 -13.026 2.443 16.137 378 HZ2 LYS 43 1HZ LYS 43 -14.324 2.148 15.096 379 HZ3 LYS 43 2HZ LYS 43 -12.900 2.834 14.499 380 H LYS 44 H LYS 44 -6.310 0.104 14.934 381 HA LYS 44 HA LYS 44 -4.509 0.746 17.047 382 HB2 LYS 44 2HB LYS 44 -4.006 -0.903 14.531 383 HB3 LYS 44 3HB LYS 44 -2.993 -0.902 15.976 384 HG2 LYS 44 2HG LYS 44 -5.895 -1.784 15.911 385 HG3 LYS 44 3HG LYS 44 -4.516 -2.880 15.784 386 HD2 LYS 44 2HD LYS 44 -3.759 -2.137 18.052 387 HD3 LYS 44 3HD LYS 44 -5.181 -1.095 18.168 388 HE2 LYS 44 2HE LYS 44 -6.654 -3.024 18.128 389 HE3 LYS 44 3HE LYS 44 -5.299 -4.112 17.819 390 HZ1 LYS 44 3HZ LYS 44 -4.394 -3.473 19.992 391 HZ2 LYS 44 1HZ LYS 44 -5.911 -4.211 20.115 392 HZ3 LYS 44 2HZ LYS 44 -5.769 -2.535 20.286 393 H LEU 45 H LEU 45 -4.718 1.747 13.674 394 HA LEU 45 HA LEU 45 -2.070 2.852 13.458 395 HB2 LEU 45 2HB LEU 45 -4.528 3.347 11.735 396 HB3 LEU 45 3HB LEU 45 -2.875 3.751 11.295 397 HG LEU 45 HG LEU 45 -3.896 0.916 11.718 398 HD11 LEU 45 1HD1 LEU 45 -3.424 2.361 9.111 399 HD12 LEU 45 2HD1 LEU 45 -4.982 1.883 9.788 400 HD13 LEU 45 3HD1 LEU 45 -3.826 0.649 9.295 401 HD21 LEU 45 3HD2 LEU 45 -1.244 1.855 10.583 402 HD22 LEU 45 1HD2 LEU 45 -1.802 0.181 10.686 403 HD23 LEU 45 2HD2 LEU 45 -1.498 1.097 12.159 404 H ALA 46 H ALA 46 -5.309 4.051 14.164 405 HA ALA 46 HA ALA 46 -4.739 6.833 14.253 406 HB1 ALA 46 3HB ALA 46 -7.010 5.950 13.969 407 HB2 ALA 46 1HB ALA 46 -6.934 7.013 15.376 408 HB3 ALA 46 2HB ALA 46 -6.968 5.260 15.593 409 H GLU 47 H GLU 47 -4.943 4.332 16.797 410 HA GLU 47 HA GLU 47 -4.394 6.189 18.943 411 HB2 GLU 47 2HB GLU 47 -4.541 3.146 18.996 412 HB3 GLU 47 3HB GLU 47 -4.489 4.195 20.413 413 HG2 GLU 47 2HG GLU 47 -6.717 3.994 18.365 414 HG3 GLU 47 3HG GLU 47 -6.766 3.450 20.040 415 H GLU 48 H GLU 48 -2.713 3.180 17.957 416 HA GLU 48 HA GLU 48 -0.183 4.084 19.024 417 HB2 GLU 48 2HB GLU 48 -0.831 1.678 19.083 418 HB3 GLU 48 3HB GLU 48 -0.815 1.635 17.323 419 HG2 GLU 48 2HG GLU 48 1.610 2.127 17.326 420 HG3 GLU 48 3HG GLU 48 1.597 2.181 19.092 421 H LYS 49 H LYS 49 0.153 5.961 17.917 422 HA LYS 49 HA LYS 49 0.480 6.008 14.993 423 HB2 LYS 49 2HB LYS 49 -0.667 7.814 16.485 424 HB3 LYS 49 3HB LYS 49 0.966 8.299 16.924 425 HG2 LYS 49 2HG LYS 49 1.436 8.754 14.514 426 HG3 LYS 49 3HG LYS 49 -0.229 8.303 14.131 427 HD2 LYS 49 2HD LYS 49 0.726 10.686 15.751 428 HD3 LYS 49 3HD LYS 49 -0.165 10.698 14.228 429 HE2 LYS 49 2HE LYS 49 -1.212 9.904 16.972 430 HE3 LYS 49 3HE LYS 49 -1.714 11.276 15.988 431 HZ1 LYS 49 3HZ LYS 49 -2.557 9.630 14.341 432 HZ2 LYS 49 1HZ LYS 49 -3.356 9.592 15.831 433 HZ3 LYS 49 2HZ LYS 49 -2.224 8.402 15.454 434 H ASN 50 H ASN 50 2.237 4.746 17.271 435 HA ASN 50 HA ASN 50 4.778 5.723 17.393 436 HB2 ASN 50 2HB ASN 50 3.797 3.705 18.600 437 HB3 ASN 50 3HB ASN 50 4.035 2.770 17.132 438 HD21 ASN 50 1HD2 ASN 50 5.124 2.190 19.698 439 HD22 ASN 50 2HD2 ASN 50 6.848 2.255 19.567 440 H PHE 51 H PHE 51 6.532 5.740 16.098 441 HA PHE 51 HA PHE 51 6.257 5.721 13.310 442 HB2 PHE 51 2HB PHE 51 7.912 7.101 14.560 443 HB3 PHE 51 3HB PHE 51 8.820 5.649 14.963 444 HD1 PHE 51 HD2 PHE 51 7.648 7.721 12.051 445 HD2 PHE 51 HD1 PHE 51 10.535 4.874 13.473 446 HE1 PHE 51 HE2 PHE 51 8.960 7.989 9.988 447 HE2 PHE 51 HE1 PHE 51 11.830 5.162 11.404 448 HZ PHE 51 HZ PHE 51 11.044 6.715 9.661 449 H GLU 52 H GLU 52 5.764 3.893 12.278 450 HA GLU 52 HA GLU 52 7.495 1.549 12.521 451 HB2 GLU 52 2HB GLU 52 5.578 1.163 14.067 452 HB3 GLU 52 3HB GLU 52 4.451 1.414 12.740 453 HG2 GLU 52 2HG GLU 52 4.863 -1.010 13.353 454 HG3 GLU 52 3HG GLU 52 5.123 -0.607 11.654 455 H LYS 53 H LYS 53 7.885 0.627 10.657 456 HA LYS 53 HA LYS 53 6.880 1.818 8.177 457 HB2 LYS 53 2HB LYS 53 9.165 -0.127 8.738 458 HB3 LYS 53 3HB LYS 53 8.817 0.603 7.176 459 HG2 LYS 53 2HG LYS 53 9.440 2.787 7.957 460 HG3 LYS 53 3HG LYS 53 9.533 2.240 9.633 461 HD2 LYS 53 2HD LYS 53 11.326 1.038 7.495 462 HD3 LYS 53 3HD LYS 53 11.756 2.557 8.275 463 HE2 LYS 53 2HE LYS 53 12.881 0.614 9.329 464 HE3 LYS 53 3HE LYS 53 11.835 1.460 10.460 465 HZ1 LYS 53 3HZ LYS 53 11.134 -1.061 9.056 466 HZ2 LYS 53 1HZ LYS 53 10.202 -0.275 10.228 467 HZ3 LYS 53 2HZ LYS 53 11.689 -0.955 10.646 468 H ILE 54 H ILE 54 4.778 0.788 8.174 469 HA ILE 54 HA ILE 54 4.671 -2.154 8.192 470 HB ILE 54 HB ILE 54 2.333 -0.192 8.165 471 HG12 ILE 54 2HG1 ILE 54 3.556 -1.727 10.499 472 HG13 ILE 54 3HG1 ILE 54 3.640 0.016 10.259 473 HG21 ILE 54 1HG2 ILE 54 2.384 -3.192 8.678 474 HG22 ILE 54 2HG2 ILE 54 1.742 -2.404 7.236 475 HG23 ILE 54 3HG2 ILE 54 0.956 -2.161 8.797 476 HD11 ILE 54 3HD1 ILE 54 1.205 0.156 10.537 477 HD12 ILE 54 1HD1 ILE 54 2.006 -0.545 11.941 478 HD13 ILE 54 2HD1 ILE 54 1.140 -1.588 10.814 479 H LEU 55 H LEU 55 4.546 -3.259 6.349 480 HA LEU 55 HA LEU 55 3.572 -2.055 3.849 481 HB2 LEU 55 2HB LEU 55 5.679 -3.497 3.899 482 HB3 LEU 55 3HB LEU 55 4.664 -4.859 4.339 483 HG LEU 55 HG LEU 55 3.348 -4.315 2.121 484 HD11 LEU 55 1HD1 LEU 55 4.320 -2.146 1.671 485 HD12 LEU 55 2HD1 LEU 55 4.705 -3.254 0.357 486 HD13 LEU 55 3HD1 LEU 55 5.938 -2.845 1.554 487 HD21 LEU 55 3HD2 LEU 55 4.690 -6.350 2.452 488 HD22 LEU 55 1HD2 LEU 55 6.133 -5.485 1.917 489 HD23 LEU 55 2HD2 LEU 55 4.793 -5.749 0.796 490 H ILE 56 H ILE 56 1.356 -2.187 3.653 491 HA ILE 56 HA ILE 56 -0.173 -4.296 4.987 492 HB ILE 56 HB ILE 56 -1.070 -1.873 3.382 493 HG12 ILE 56 2HG1 ILE 56 -0.119 -1.291 5.596 494 HG13 ILE 56 3HG1 ILE 56 -1.851 -0.976 5.564 495 HG21 ILE 56 1HG2 ILE 56 -3.385 -2.390 4.100 496 HG22 ILE 56 2HG2 ILE 56 -2.818 -3.884 4.842 497 HG23 ILE 56 3HG2 ILE 56 -2.718 -3.678 3.093 498 HD11 ILE 56 3HD1 ILE 56 -1.201 -1.940 7.657 499 HD12 ILE 56 1HD1 ILE 56 -0.482 -3.332 6.849 500 HD13 ILE 56 2HD1 ILE 56 -2.230 -3.077 6.787 501 H LYS 57 H LYS 57 -0.331 -6.155 3.950 502 HA LYS 57 HA LYS 57 -0.436 -6.376 1.043 503 HB2 LYS 57 2HB LYS 57 1.070 -7.858 2.300 504 HB3 LYS 57 3HB LYS 57 -0.255 -8.415 3.309 505 HG2 LYS 57 2HG LYS 57 -0.434 -8.854 0.341 506 HG3 LYS 57 3HG LYS 57 0.674 -9.862 1.271 507 HD2 LYS 57 2HD LYS 57 -1.208 -10.641 2.683 508 HD3 LYS 57 3HD LYS 57 -2.321 -9.597 1.800 509 HE2 LYS 57 2HE LYS 57 -1.920 -10.879 -0.244 510 HE3 LYS 57 3HE LYS 57 -0.752 -11.894 0.600 511 HZ1 LYS 57 3HZ LYS 57 -2.829 -13.019 0.445 512 HZ2 LYS 57 1HZ LYS 57 -3.658 -11.719 1.136 513 HZ3 LYS 57 2HZ LYS 57 -2.571 -12.611 2.065 514 H SER 58 H SER 58 -2.404 -6.373 0.062 515 HA SER 58 HA SER 58 -4.637 -7.871 1.186 516 HB2 SER 58 2HB SER 58 -4.968 -5.580 2.103 517 HB3 SER 58 3HB SER 58 -4.911 -4.925 0.472 518 HG SER 58 HG SER 58 -6.967 -6.110 1.810 519 H ASN 59 H ASN 59 -6.540 -7.674 -0.481 520 HA ASN 59 HA ASN 59 -5.548 -7.881 -3.254 521 HB2 ASN 59 2HB ASN 59 -6.589 -10.106 -3.511 522 HB3 ASN 59 3HB ASN 59 -5.433 -10.154 -2.187 523 HD21 ASN 59 1HD2 ASN 59 -6.260 -10.128 -0.012 524 HD22 ASN 59 2HD2 ASN 59 -7.856 -10.695 0.339 525 H ASP 60 H ASP 60 -7.561 -6.274 -1.405 526 HA ASP 60 HA ASP 60 -9.775 -6.231 -3.387 527 HB2 ASP 60 2HB ASP 60 -10.488 -7.356 -1.249 528 HB3 ASP 60 3HB ASP 60 -10.053 -5.900 -0.359 529 H LYS 61 H LYS 61 -9.509 -4.385 -4.435 530 HA LYS 61 HA LYS 61 -7.951 -2.188 -3.813 531 HB2 LYS 61 2HB LYS 61 -9.181 -1.013 -5.650 532 HB3 LYS 61 3HB LYS 61 -8.728 -2.657 -6.093 533 HG2 LYS 61 2HG LYS 61 -11.011 -3.442 -5.647 534 HG3 LYS 61 3HG LYS 61 -11.485 -1.827 -5.124 535 HD2 LYS 61 2HD LYS 61 -11.120 -0.973 -7.410 536 HD3 LYS 61 3HD LYS 61 -10.599 -2.578 -7.937 537 HE2 LYS 61 2HE LYS 61 -12.846 -3.468 -7.377 538 HE3 LYS 61 3HE LYS 61 -13.356 -1.851 -6.890 539 HZ1 LYS 61 3HZ LYS 61 -14.086 -2.329 -9.115 540 HZ2 LYS 61 1HZ LYS 61 -12.501 -2.676 -9.607 541 HZ3 LYS 61 2HZ LYS 61 -12.919 -1.106 -9.149 542 H GLN 62 H GLN 62 -11.299 -2.789 -2.882 543 HA GLN 62 HA GLN 62 -12.002 -0.039 -2.488 544 HB2 GLN 62 2HB GLN 62 -13.462 -2.589 -1.694 545 HB3 GLN 62 3HB GLN 62 -14.118 -0.969 -1.485 546 HG2 GLN 62 2HG GLN 62 -13.452 -2.322 -4.118 547 HG3 GLN 62 3HG GLN 62 -15.065 -1.992 -3.485 548 HE21 GLN 62 1HE2 GLN 62 -15.760 0.224 -3.356 549 HE22 GLN 62 2HE2 GLN 62 -15.068 1.424 -4.393 550 H LEU 63 H LEU 63 -11.042 -2.767 -0.379 551 HA LEU 63 HA LEU 63 -11.359 -1.604 2.136 552 HB2 LEU 63 2HB LEU 63 -9.175 -3.486 1.161 553 HB3 LEU 63 3HB LEU 63 -9.377 -3.050 2.851 554 HG LEU 63 HG LEU 63 -11.359 -4.616 1.152 555 HD11 LEU 63 1HD1 LEU 63 -9.622 -5.508 3.472 556 HD12 LEU 63 2HD1 LEU 63 -9.397 -5.930 1.772 557 HD13 LEU 63 3HD1 LEU 63 -10.827 -6.493 2.635 558 HD21 LEU 63 3HD2 LEU 63 -12.571 -3.208 2.745 559 HD22 LEU 63 1HD2 LEU 63 -11.575 -3.807 4.074 560 HD23 LEU 63 2HD2 LEU 63 -12.670 -4.900 3.220 561 H LEU 64 H LEU 64 -8.747 -1.229 -0.211 562 HA LEU 64 HA LEU 64 -6.953 0.200 1.473 563 HB2 LEU 64 2HB LEU 64 -7.055 -0.238 -1.519 564 HB3 LEU 64 3HB LEU 64 -5.851 0.815 -0.799 565 HG LEU 64 HG LEU 64 -5.016 -1.123 0.576 566 HD11 LEU 64 1HD1 LEU 64 -6.867 -2.794 -1.126 567 HD12 LEU 64 2HD1 LEU 64 -7.007 -2.517 0.611 568 HD13 LEU 64 3HD1 LEU 64 -5.629 -3.405 -0.028 569 HD21 LEU 64 3HD2 LEU 64 -4.944 -1.543 -2.417 570 HD22 LEU 64 1HD2 LEU 64 -3.831 -2.258 -1.243 571 HD23 LEU 64 2HD2 LEU 64 -3.871 -0.511 -1.469 572 H LYS 65 H LYS 65 -9.338 1.260 -0.994 573 HA LYS 65 HA LYS 65 -8.671 4.006 -0.928 574 HB2 LYS 65 2HB LYS 65 -10.067 2.646 -2.658 575 HB3 LYS 65 3HB LYS 65 -11.427 2.902 -1.570 576 HG2 LYS 65 2HG LYS 65 -11.038 5.388 -1.785 577 HG3 LYS 65 3HG LYS 65 -9.791 5.027 -2.982 578 HD2 LYS 65 2HD LYS 65 -11.715 5.523 -4.250 579 HD3 LYS 65 3HD LYS 65 -11.600 3.770 -4.295 580 HE2 LYS 65 2HE LYS 65 -13.921 4.399 -3.925 581 HE3 LYS 65 3HE LYS 65 -13.301 3.666 -2.444 582 HZ1 LYS 65 3HZ LYS 65 -14.563 5.627 -1.923 583 HZ2 LYS 65 1HZ LYS 65 -13.636 6.577 -2.972 584 HZ3 LYS 65 2HZ LYS 65 -12.939 5.932 -1.573 585 H GLU 66 H GLU 66 -11.108 2.036 0.737 586 HA GLU 66 HA GLU 66 -12.415 4.043 2.239 587 HB2 GLU 66 2HB GLU 66 -12.212 1.043 2.721 588 HB3 GLU 66 3HB GLU 66 -13.316 2.116 3.585 589 HG2 GLU 66 2HG GLU 66 -14.469 2.641 1.486 590 HG3 GLU 66 3HG GLU 66 -13.346 1.617 0.591 591 H MET 67 H MET 67 -9.561 2.090 2.842 592 HA MET 67 HA MET 67 -9.138 2.673 5.580 593 HB2 MET 67 2HB MET 67 -7.887 0.904 4.262 594 HB3 MET 67 3HB MET 67 -7.005 2.184 3.445 595 HG2 MET 67 2HG MET 67 -6.182 2.919 5.733 596 HG3 MET 67 3HG MET 67 -6.882 1.436 6.373 597 HE1 MET 67 3HE MET 67 -4.691 -1.302 4.631 598 HE2 MET 67 1HE MET 67 -6.265 -0.711 4.101 599 HE3 MET 67 2HE MET 67 -5.960 -1.000 5.816 600 H LEU 68 H LEU 68 -8.118 4.226 2.562 601 HA LEU 68 HA LEU 68 -6.557 6.313 3.736 602 HB2 LEU 68 2HB LEU 68 -7.664 5.931 0.934 603 HB3 LEU 68 3HB LEU 68 -6.528 7.200 1.375 604 HG LEU 68 HG LEU 68 -5.917 4.227 1.658 605 HD11 LEU 68 1HD1 LEU 68 -6.219 4.720 -0.694 606 HD12 LEU 68 2HD1 LEU 68 -4.517 4.433 -0.337 607 HD13 LEU 68 3HD1 LEU 68 -5.102 6.083 -0.583 608 HD21 LEU 68 3HD2 LEU 68 -3.597 4.943 1.911 609 HD22 LEU 68 1HD2 LEU 68 -4.611 5.665 3.160 610 HD23 LEU 68 2HD2 LEU 68 -4.077 6.635 1.782 611 H GLU 69 H GLU 69 -9.979 5.988 2.989 612 HA GLU 69 HA GLU 69 -10.705 8.738 3.113 613 HB2 GLU 69 2HB GLU 69 -12.404 6.390 4.073 614 HB3 GLU 69 3HB GLU 69 -12.985 7.998 3.656 615 HG2 GLU 69 2HG GLU 69 -11.806 5.974 1.736 616 HG3 GLU 69 3HG GLU 69 -13.517 6.317 1.933 617 H LEU 70 H LEU 70 -10.078 6.264 5.560 618 HA LEU 70 HA LEU 70 -10.786 8.001 7.794 619 HB2 LEU 70 2HB LEU 70 -9.526 5.234 7.837 620 HB3 LEU 70 3HB LEU 70 -10.214 6.087 9.212 621 HG LEU 70 HG LEU 70 -11.700 4.877 6.846 622 HD11 LEU 70 1HD1 LEU 70 -11.109 3.298 8.603 623 HD12 LEU 70 2HD1 LEU 70 -12.851 3.544 8.536 624 HD13 LEU 70 3HD1 LEU 70 -11.901 4.309 9.815 625 HD21 LEU 70 3HD2 LEU 70 -13.800 5.737 7.805 626 HD22 LEU 70 1HD2 LEU 70 -12.739 7.043 7.283 627 HD23 LEU 70 2HD2 LEU 70 -12.888 6.662 9.001 628 H ILE 71 H ILE 71 -7.861 6.951 6.107 629 HA ILE 71 HA ILE 71 -5.976 7.775 8.109 630 HB ILE 71 HB ILE 71 -5.575 7.163 5.143 631 HG12 ILE 71 2HG1 ILE 71 -4.871 5.575 7.654 632 HG13 ILE 71 3HG1 ILE 71 -6.173 5.205 6.532 633 HG21 ILE 71 1HG2 ILE 71 -3.396 7.714 7.201 634 HG22 ILE 71 2HG2 ILE 71 -3.815 8.753 5.839 635 HG23 ILE 71 3HG2 ILE 71 -3.130 7.158 5.547 636 HD11 ILE 71 3HD1 ILE 71 -4.310 3.720 6.189 637 HD12 ILE 71 1HD1 ILE 71 -3.218 5.081 5.936 638 HD13 ILE 71 2HD1 ILE 71 -4.511 4.756 4.778 639 H SER 72 H SER 72 -7.607 9.393 5.441 640 HA SER 72 HA SER 72 -6.009 11.701 5.217 641 HB2 SER 72 2HB SER 72 -8.040 12.757 4.202 642 HB3 SER 72 3HB SER 72 -7.693 11.163 3.529 643 HG SER 72 HG SER 72 -9.583 10.575 4.163 644 H LYS 73 H LYS 73 -8.526 10.819 7.502 645 HA LYS 73 HA LYS 73 -8.900 13.296 8.840 646 HB2 LYS 73 2HB LYS 73 -9.100 10.486 10.019 647 HB3 LYS 73 3HB LYS 73 -9.854 11.945 10.665 648 HG2 LYS 73 2HG LYS 73 -11.302 12.089 8.692 649 HG3 LYS 73 3HG LYS 73 -10.511 10.671 7.989 650 HD2 LYS 73 2HD LYS 73 -11.346 9.265 9.827 651 HD3 LYS 73 3HD LYS 73 -12.064 10.677 10.610 652 HE2 LYS 73 2HE LYS 73 -12.859 9.577 7.893 653 HE3 LYS 73 3HE LYS 73 -13.755 9.346 9.397 654 HZ1 LYS 73 3HZ LYS 73 -14.048 11.753 9.532 655 HZ2 LYS 73 1HZ LYS 73 -14.703 11.128 8.104 656 HZ3 LYS 73 2HZ LYS 73 -13.226 11.949 8.068 657 H LEU 74 H LEU 74 -6.688 10.595 9.275 658 HA LEU 74 HA LEU 74 -5.450 11.499 11.702 659 HB2 LEU 74 2HB LEU 74 -4.532 9.390 9.693 660 HB3 LEU 74 3HB LEU 74 -3.951 9.561 11.346 661 HG LEU 74 HG LEU 74 -6.809 8.828 10.564 662 HD11 LEU 74 1HD1 LEU 74 -5.284 7.005 10.044 663 HD12 LEU 74 2HD1 LEU 74 -6.320 6.585 11.405 664 HD13 LEU 74 3HD1 LEU 74 -4.636 7.040 11.686 665 HD21 LEU 74 3HD2 LEU 74 -7.151 8.368 12.966 666 HD22 LEU 74 1HD2 LEU 74 -6.768 10.062 12.670 667 HD23 LEU 74 2HD2 LEU 74 -5.533 8.980 13.320 668 H GLY 75 H GLY 75 -4.661 11.673 8.290 669 HA2 GLY 75 2HA GLY 75 -3.295 12.987 7.065 670 HA3 GLY 75 3HA GLY 75 -3.084 13.988 8.495 671 H TYR 76 H TYR 76 -2.159 10.534 7.976 672 HA TYR 76 HA TYR 76 0.684 11.409 7.917 673 HB2 TYR 76 2HB TYR 76 1.389 9.180 8.614 674 HB3 TYR 76 3HB TYR 76 0.313 9.878 9.801 675 HD1 TYR 76 HD2 TYR 76 0.577 7.276 7.145 676 HD2 TYR 76 HD1 TYR 76 -1.734 8.745 10.432 677 HE1 TYR 76 HE2 TYR 76 -0.708 5.190 7.177 678 HE2 TYR 76 HE1 TYR 76 -3.004 6.642 10.468 679 HH TYR 76 HH TYR 76 -2.056 3.872 8.741 680 H LYS 77 H LYS 77 2.050 9.754 6.585 681 HA LYS 77 HA LYS 77 0.979 10.089 3.882 682 HB2 LYS 77 2HB LYS 77 3.046 11.289 4.354 683 HB3 LYS 77 3HB LYS 77 3.825 9.825 4.931 684 HG2 LYS 77 2HG LYS 77 4.548 10.594 2.641 685 HG3 LYS 77 3HG LYS 77 3.995 8.918 2.725 686 HD2 LYS 77 2HD LYS 77 1.912 9.453 1.687 687 HD3 LYS 77 3HD LYS 77 2.177 11.188 1.859 688 HE2 LYS 77 2HE LYS 77 3.836 9.360 0.100 689 HE3 LYS 77 3HE LYS 77 2.487 10.347 -0.472 690 HZ1 LYS 77 3HZ LYS 77 3.700 12.315 0.346 691 HZ2 LYS 77 1HZ LYS 77 4.526 11.486 -0.876 692 HZ3 LYS 77 2HZ LYS 77 5.017 11.325 0.729 693 H VAL 78 H VAL 78 0.494 8.438 2.649 694 HA VAL 78 HA VAL 78 1.460 5.709 3.212 695 HB VAL 78 HB VAL 78 -1.305 6.474 2.152 696 HG11 VAL 78 1HG1 VAL 78 -1.860 4.077 2.412 697 HG12 VAL 78 2HG1 VAL 78 -0.201 3.745 2.920 698 HG13 VAL 78 3HG1 VAL 78 -0.525 4.298 1.276 699 HG21 VAL 78 3HG2 VAL 78 -0.542 5.404 4.894 700 HG22 VAL 78 1HG2 VAL 78 -2.189 5.687 4.319 701 HG23 VAL 78 2HG2 VAL 78 -1.085 7.046 4.542 702 H PHE 79 H PHE 79 1.874 4.432 1.437 703 HA PHE 79 HA PHE 79 2.173 5.722 -1.221 704 HB2 PHE 79 2HB PHE 79 3.943 3.596 0.072 705 HB3 PHE 79 3HB PHE 79 4.224 4.398 -1.467 706 HD1 PHE 79 HD2 PHE 79 4.372 4.777 2.216 707 HD2 PHE 79 HD1 PHE 79 5.115 6.674 -1.551 708 HE1 PHE 79 HE2 PHE 79 5.693 6.508 3.341 709 HE2 PHE 79 HE1 PHE 79 6.434 8.392 -0.409 710 HZ PHE 79 HZ PHE 79 6.729 8.316 2.030 711 H LEU 80 H LEU 80 1.023 4.587 -2.810 712 HA LEU 80 HA LEU 80 0.049 1.863 -2.167 713 HB2 LEU 80 2HB LEU 80 -1.798 3.399 -2.096 714 HB3 LEU 80 3HB LEU 80 -1.328 4.143 -3.612 715 HG LEU 80 HG LEU 80 -1.996 2.129 -4.873 716 HD11 LEU 80 1HD1 LEU 80 -1.439 0.394 -3.249 717 HD12 LEU 80 2HD1 LEU 80 -3.093 0.216 -3.827 718 HD13 LEU 80 3HD1 LEU 80 -2.789 0.894 -2.225 719 HD21 LEU 80 3HD2 LEU 80 -3.703 3.817 -4.462 720 HD22 LEU 80 1HD2 LEU 80 -4.181 3.000 -2.971 721 HD23 LEU 80 2HD2 LEU 80 -4.408 2.203 -4.533 722 H LEU 81 H LEU 81 0.525 0.293 -3.535 723 HA LEU 81 HA LEU 81 1.433 0.895 -6.286 724 HB2 LEU 81 2HB LEU 81 3.138 -0.181 -4.773 725 HB3 LEU 81 3HB LEU 81 2.073 -1.562 -4.610 726 HG LEU 81 HG LEU 81 2.274 -2.023 -7.055 727 HD11 LEU 81 1HD1 LEU 81 4.215 0.308 -7.100 728 HD12 LEU 81 2HD1 LEU 81 2.637 0.231 -7.891 729 HD13 LEU 81 3HD1 LEU 81 3.938 -0.830 -8.424 730 HD21 LEU 81 3HD2 LEU 81 3.797 -3.146 -5.513 731 HD22 LEU 81 1HD2 LEU 81 4.949 -1.811 -5.644 732 HD23 LEU 81 2HD2 LEU 81 4.592 -2.817 -7.050 733 H LEU 82 H LEU 82 0.163 0.212 -7.840 734 HA LEU 82 HA LEU 82 -1.996 -1.765 -7.371 735 HB2 LEU 82 2HB LEU 82 -1.786 0.557 -9.342 736 HB3 LEU 82 3HB LEU 82 -3.140 -0.560 -9.257 737 HG LEU 82 HG LEU 82 -2.330 1.343 -7.018 738 HD11 LEU 82 1HD1 LEU 82 -3.147 2.602 -8.941 739 HD12 LEU 82 2HD1 LEU 82 -4.302 2.664 -7.612 740 HD13 LEU 82 3HD1 LEU 82 -4.609 1.612 -8.998 741 HD21 LEU 82 3HD2 LEU 82 -4.775 -0.448 -7.291 742 HD22 LEU 82 1HD2 LEU 82 -4.498 0.734 -6.005 743 HD23 LEU 82 2HD2 LEU 82 -3.436 -0.662 -6.157 744 H ALA 83 H ALA 83 -1.729 -3.661 -8.470 745 HA ALA 83 HA ALA 83 -0.225 -3.720 -11.022 746 HB1 ALA 83 3HB ALA 83 0.349 -5.584 -8.695 747 HB2 ALA 83 1HB ALA 83 1.393 -4.273 -9.242 748 HB3 ALA 83 2HB ALA 83 1.094 -5.657 -10.293 749 H ASP 84 H ASP 84 -1.671 -4.489 -12.424 750 HA ASP 84 HA ASP 84 -2.771 -7.121 -12.202 751 HB2 ASP 84 2HB ASP 84 -4.457 -5.983 -10.806 752 HB3 ASP 84 3HB ASP 84 -4.675 -4.743 -12.032 753 H GLN 85 H GLN 85 -3.770 -7.804 -14.166 754 HA GLN 85 HA GLN 85 -2.693 -6.842 -16.587 755 HB2 GLN 85 2HB GLN 85 -3.412 -9.181 -16.222 756 HB3 GLN 85 3HB GLN 85 -5.087 -8.669 -16.074 757 HG2 GLN 85 2HG GLN 85 -4.951 -7.872 -18.477 758 HG3 GLN 85 3HG GLN 85 -3.355 -8.611 -18.568 759 HE21 GLN 85 1HE2 GLN 85 -6.142 -9.964 -16.852 760 HE22 GLN 85 2HE2 GLN 85 -6.327 -11.334 -17.885 761 H ASP 86 H ASP 86 -5.849 -6.364 -14.998 762 HA ASP 86 HA ASP 86 -6.774 -4.490 -17.063 763 HB2 ASP 86 2HB ASP 86 -8.353 -6.136 -15.955 764 HB3 ASP 86 3HB ASP 86 -8.111 -5.296 -14.430 765 H GLU 87 H GLU 87 -4.613 -3.464 -16.396 766 HA GLU 87 HA GLU 87 -4.460 -1.828 -14.065 767 HB2 GLU 87 2HB GLU 87 -2.469 -0.801 -15.357 768 HB3 GLU 87 3HB GLU 87 -2.372 -2.492 -14.904 769 HG2 GLU 87 2HG GLU 87 -1.487 -2.179 -17.142 770 HG3 GLU 87 3HG GLU 87 -2.951 -3.158 -17.210 771 H ASN 88 H ASN 88 -6.106 -1.458 -17.006 772 HA ASN 88 HA ASN 88 -6.103 1.314 -17.457 773 HB2 ASN 88 2HB ASN 88 -7.017 -0.389 -19.037 774 HB3 ASN 88 3HB ASN 88 -8.379 -0.654 -17.952 775 HD21 ASN 88 1HD2 ASN 88 -6.917 1.548 -20.234 776 HD22 ASN 88 2HD2 ASN 88 -8.295 2.570 -20.436 777 H GLU 89 H GLU 89 -8.238 -0.670 -15.401 778 HA GLU 89 HA GLU 89 -9.805 1.504 -14.393 779 HB2 GLU 89 2HB GLU 89 -10.624 -0.837 -14.506 780 HB3 GLU 89 3HB GLU 89 -9.444 -1.305 -13.285 781 HG2 GLU 89 2HG GLU 89 -10.544 0.134 -11.633 782 HG3 GLU 89 3HG GLU 89 -11.694 0.687 -12.852 783 H LEU 90 H LEU 90 -6.826 -0.070 -13.375 784 HA LEU 90 HA LEU 90 -6.558 1.168 -10.808 785 HB2 LEU 90 2HB LEU 90 -4.429 0.056 -12.676 786 HB3 LEU 90 3HB LEU 90 -4.156 0.506 -10.996 787 HG LEU 90 HG LEU 90 -5.973 -1.748 -11.945 788 HD11 LEU 90 1HD1 LEU 90 -4.277 -3.245 -10.985 789 HD12 LEU 90 2HD1 LEU 90 -3.243 -1.857 -10.638 790 HD13 LEU 90 3HD1 LEU 90 -3.628 -2.277 -12.308 791 HD21 LEU 90 3HD2 LEU 90 -6.812 -0.760 -9.862 792 HD22 LEU 90 1HD2 LEU 90 -5.220 -0.927 -9.114 793 HD23 LEU 90 2HD2 LEU 90 -6.146 -2.362 -9.564 794 H GLU 91 H GLU 91 -5.951 2.186 -14.090 795 HA GLU 91 HA GLU 91 -4.250 4.430 -13.542 796 HB2 GLU 91 2HB GLU 91 -4.366 3.293 -15.770 797 HB3 GLU 91 3HB GLU 91 -6.012 3.873 -15.968 798 HG2 GLU 91 2HG GLU 91 -4.457 5.255 -17.265 799 HG3 GLU 91 3HG GLU 91 -5.210 6.207 -15.989 800 H GLU 92 H GLU 92 -7.711 3.867 -13.573 801 HA GLU 92 HA GLU 92 -8.433 6.642 -13.156 802 HB2 GLU 92 2HB GLU 92 -9.961 4.020 -12.951 803 HB3 GLU 92 3HB GLU 92 -10.704 5.578 -12.594 804 HG2 GLU 92 2HG GLU 92 -9.479 4.788 -15.258 805 HG3 GLU 92 3HG GLU 92 -11.206 4.780 -14.887 806 H PHE 93 H PHE 93 -8.115 3.704 -11.185 807 HA PHE 93 HA PHE 93 -9.201 4.612 -8.778 808 HB2 PHE 93 2HB PHE 93 -8.764 2.211 -9.363 809 HB3 PHE 93 3HB PHE 93 -7.039 2.485 -9.157 810 HD1 PHE 93 HD1 PHE 93 -10.300 2.471 -7.331 811 HD2 PHE 93 HD2 PHE 93 -6.039 2.325 -6.969 812 HE1 PHE 93 HE1 PHE 93 -10.507 1.907 -4.948 813 HE2 PHE 93 HE2 PHE 93 -6.262 1.764 -4.594 814 HZ PHE 93 HZ PHE 93 -8.489 1.555 -3.581 815 H LYS 94 H LYS 94 -5.829 4.671 -9.929 816 HA LYS 94 HA LYS 94 -4.508 5.586 -7.654 817 HB2 LYS 94 2HB LYS 94 -2.714 6.314 -9.137 818 HB3 LYS 94 3HB LYS 94 -3.354 4.781 -9.720 819 HG2 LYS 94 2HG LYS 94 -4.504 5.837 -11.541 820 HG3 LYS 94 3HG LYS 94 -4.257 7.445 -10.869 821 HD2 LYS 94 2HD LYS 94 -2.787 7.130 -12.756 822 HD3 LYS 94 3HD LYS 94 -1.822 7.228 -11.282 823 HE2 LYS 94 2HE LYS 94 -1.460 4.831 -11.298 824 HE3 LYS 94 3HE LYS 94 -2.607 4.619 -12.625 825 HZ1 LYS 94 3HZ LYS 94 -0.273 4.583 -13.346 826 HZ2 LYS 94 1HZ LYS 94 -0.087 6.174 -12.813 827 HZ3 LYS 94 2HZ LYS 94 -1.152 5.827 -14.081 828 H ARG 95 H ARG 95 -6.466 7.363 -9.978 829 HA ARG 95 HA ARG 95 -5.375 9.963 -9.438 830 HB2 ARG 95 2HB ARG 95 -7.941 9.228 -10.924 831 HB3 ARG 95 3HB ARG 95 -7.112 10.790 -10.979 832 HG2 ARG 95 2HG ARG 95 -5.102 9.582 -11.937 833 HG3 ARG 95 3HG ARG 95 -6.105 8.135 -12.058 834 HD2 ARG 95 2HD ARG 95 -6.434 10.765 -13.527 835 HD3 ARG 95 3HD ARG 95 -6.048 9.193 -14.211 836 HE ARG 95 HE ARG 95 -8.356 8.503 -13.575 837 HH11 ARG 95 1HH1 ARG 95 -7.645 11.908 -14.083 838 HH12 ARG 95 2HH1 ARG 95 -9.281 12.317 -14.486 839 HH21 ARG 95 1HH2 ARG 95 -10.504 9.059 -14.110 840 HH22 ARG 95 2HH2 ARG 95 -10.905 10.702 -14.503 841 H LYS 96 H LYS 96 -7.894 8.023 -8.088 842 HA LYS 96 HA LYS 96 -9.251 10.109 -6.621 843 HB2 LYS 96 2HB LYS 96 -9.349 7.064 -6.424 844 HB3 LYS 96 3HB LYS 96 -10.241 8.105 -5.326 845 HG2 LYS 96 2HG LYS 96 -11.756 7.343 -7.027 846 HG3 LYS 96 3HG LYS 96 -11.469 9.066 -7.271 847 HD2 LYS 96 2HD LYS 96 -9.874 8.530 -9.102 848 HD3 LYS 96 3HD LYS 96 -10.170 6.810 -8.848 849 HE2 LYS 96 2HE LYS 96 -12.257 8.835 -9.735 850 HE3 LYS 96 3HE LYS 96 -11.421 7.695 -10.790 851 HZ1 LYS 96 3HZ LYS 96 -13.162 6.939 -8.514 852 HZ2 LYS 96 1HZ LYS 96 -12.421 5.880 -9.601 853 HZ3 LYS 96 2HZ LYS 96 -13.631 6.930 -10.136 854 H ILE 97 H ILE 97 -6.632 7.833 -6.123 855 HA ILE 97 HA ILE 97 -6.389 8.131 -3.278 856 HB ILE 97 HB ILE 97 -4.399 6.981 -5.285 857 HG12 ILE 97 2HG1 ILE 97 -6.510 5.794 -5.503 858 HG13 ILE 97 3HG1 ILE 97 -5.385 4.746 -4.661 859 HG21 ILE 97 1HG2 ILE 97 -3.293 7.454 -3.160 860 HG22 ILE 97 2HG2 ILE 97 -3.469 5.708 -3.356 861 HG23 ILE 97 3HG2 ILE 97 -4.553 6.589 -2.278 862 HD11 ILE 97 3HD1 ILE 97 -6.518 5.322 -2.532 863 HD12 ILE 97 1HD1 ILE 97 -7.576 4.553 -3.712 864 HD13 ILE 97 2HD1 ILE 97 -7.673 6.292 -3.447 865 H GLU 98 H GLU 98 -4.820 9.475 -6.100 866 HA GLU 98 HA GLU 98 -2.808 11.025 -4.813 867 HB2 GLU 98 2HB GLU 98 -2.887 10.181 -7.246 868 HB3 GLU 98 3HB GLU 98 -4.036 11.466 -7.577 869 HG2 GLU 98 2HG GLU 98 -1.242 11.991 -6.514 870 HG3 GLU 98 3HG GLU 98 -1.589 11.863 -8.233 871 H SER 99 H SER 99 -6.176 11.494 -5.691 872 HA SER 99 HA SER 99 -6.398 14.298 -5.217 873 HB2 SER 99 2HB SER 99 -8.041 12.930 -6.553 874 HB3 SER 99 3HB SER 99 -8.585 12.174 -5.059 875 HG SER 99 HG SER 99 -9.448 14.403 -6.119 876 H GLN 100 H GLN 100 -6.807 11.396 -3.201 877 HA GLN 100 HA GLN 100 -7.621 12.675 -0.789 878 HB2 GLN 100 2HB GLN 100 -6.177 10.029 -1.242 879 HB3 GLN 100 3HB GLN 100 -6.856 10.535 0.302 880 HG2 GLN 100 2HG GLN 100 -9.100 10.372 -0.525 881 HG3 GLN 100 3HG GLN 100 -8.547 10.188 -2.191 882 HE21 GLN 100 1HE2 GLN 100 -10.244 8.401 -0.546 883 HE22 GLN 100 2HE2 GLN 100 -9.447 6.869 -0.554 884 H GLY 101 H GLY 101 -4.515 12.201 -2.341 885 HA2 GLY 101 2HA GLY 101 -2.798 13.838 -1.997 886 HA3 GLY 101 3HA GLY 101 -3.246 13.940 -0.299 887 H TYR 102 H TYR 102 -2.744 10.959 -2.176 888 HA TYR 102 HA TYR 102 -0.375 10.324 -0.496 889 HB2 TYR 102 2HB TYR 102 -2.490 8.361 -1.508 890 HB3 TYR 102 3HB TYR 102 -1.080 7.951 -0.526 891 HD1 TYR 102 HD2 TYR 102 -0.879 9.204 1.789 892 HD2 TYR 102 HD1 TYR 102 -4.529 8.843 -0.412 893 HE1 TYR 102 HE2 TYR 102 -2.161 9.685 3.821 894 HE2 TYR 102 HE1 TYR 102 -5.804 9.335 1.621 895 HH TYR 102 HH TYR 102 -4.416 10.629 4.361 896 H GLU 103 H GLU 103 1.320 9.224 -1.460 897 HA GLU 103 HA GLU 103 1.694 9.550 -4.287 898 HB2 GLU 103 2HB GLU 103 3.608 9.822 -2.777 899 HB3 GLU 103 3HB GLU 103 3.422 8.174 -2.189 900 HG2 GLU 103 2HG GLU 103 4.195 7.232 -4.226 901 HG3 GLU 103 3HG GLU 103 3.973 8.733 -5.104 902 H VAL 104 H VAL 104 1.155 8.125 -5.807 903 HA VAL 104 HA VAL 104 0.686 5.287 -5.160 904 HB VAL 104 HB VAL 104 -1.496 6.359 -4.942 905 HG11 VAL 104 1HG1 VAL 104 -1.146 7.457 -7.759 906 HG12 VAL 104 2HG1 VAL 104 -1.149 8.397 -6.264 907 HG13 VAL 104 3HG1 VAL 104 -2.614 7.566 -6.783 908 HG21 VAL 104 3HG2 VAL 104 -1.450 4.101 -5.918 909 HG22 VAL 104 1HG2 VAL 104 -1.358 4.786 -7.543 910 HG23 VAL 104 2HG2 VAL 104 -2.805 5.034 -6.559 911 H ARG 105 H ARG 105 1.078 3.913 -6.857 912 HA ARG 105 HA ARG 105 1.744 4.940 -9.528 913 HB2 ARG 105 2HB ARG 105 3.581 3.372 -7.703 914 HB3 ARG 105 3HB ARG 105 3.680 3.101 -9.437 915 HG2 ARG 105 2HG ARG 105 4.083 5.787 -8.074 916 HG3 ARG 105 3HG ARG 105 5.369 4.701 -8.617 917 HD2 ARG 105 2HD ARG 105 3.362 6.207 -10.320 918 HD3 ARG 105 3HD ARG 105 5.122 6.353 -10.322 919 HE ARG 105 HE ARG 105 3.562 4.087 -11.411 920 HH11 ARG 105 1HH1 ARG 105 6.601 5.853 -11.329 921 HH12 ARG 105 2HH1 ARG 105 7.283 4.964 -12.650 922 HH21 ARG 105 1HH2 ARG 105 4.460 2.945 -13.138 923 HH22 ARG 105 2HH2 ARG 105 6.065 3.319 -13.670 924 H LYS 106 H LYS 106 1.719 3.340 -11.128 925 HA LYS 106 HA LYS 106 0.187 0.875 -10.566 926 HB2 LYS 106 2HB LYS 106 -1.164 2.664 -11.700 927 HB3 LYS 106 3HB LYS 106 0.008 2.682 -13.010 928 HG2 LYS 106 2HG LYS 106 -0.583 0.191 -13.333 929 HG3 LYS 106 3HG LYS 106 -1.957 0.507 -12.272 930 HD2 LYS 106 2HD LYS 106 -2.782 0.754 -14.487 931 HD3 LYS 106 3HD LYS 106 -2.604 2.393 -13.862 932 HE2 LYS 106 2HE LYS 106 -0.518 2.668 -15.116 933 HE3 LYS 106 3HE LYS 106 -0.593 0.990 -15.657 934 HZ1 LYS 106 3HZ LYS 106 -1.357 2.509 -17.364 935 HZ2 LYS 106 1HZ LYS 106 -2.557 3.111 -16.339 936 HZ3 LYS 106 2HZ LYS 106 -2.610 1.497 -16.869 937 H VAL 107 H VAL 107 0.886 -0.925 -11.669 938 HA VAL 107 HA VAL 107 3.097 -0.844 -13.588 939 HB VAL 107 HB VAL 107 4.382 -2.605 -12.303 940 HG11 VAL 107 1HG1 VAL 107 4.066 0.005 -10.778 941 HG12 VAL 107 2HG1 VAL 107 5.124 -0.264 -12.165 942 HG13 VAL 107 3HG1 VAL 107 5.430 -1.113 -10.648 943 HG21 VAL 107 3HG2 VAL 107 2.566 -3.479 -10.908 944 HG22 VAL 107 1HG2 VAL 107 2.451 -1.943 -10.047 945 HG23 VAL 107 2HG2 VAL 107 3.898 -2.939 -9.889 946 H THR 108 H THR 108 3.551 -3.113 -14.344 947 HA THR 108 HA THR 108 1.152 -4.849 -14.436 948 HB THR 108 HB THR 108 1.659 -5.286 -16.862 949 HG1 THR 108 HG1 THR 108 3.835 -4.719 -16.969 950 HG21 THR 108 3HG2 THR 108 0.821 -3.147 -17.775 951 HG22 THR 108 1HG2 THR 108 1.209 -2.342 -16.251 952 HG23 THR 108 2HG2 THR 108 -0.048 -3.580 -16.299 953 H ASP 109 H ASP 109 4.674 -4.527 -14.618 954 HA ASP 109 HA ASP 109 5.056 -7.450 -14.693 955 HB2 ASP 109 2HB ASP 109 7.031 -5.151 -15.017 956 HB3 ASP 109 3HB ASP 109 7.493 -6.854 -15.043 957 H ASP 110 H ASP 110 6.564 -8.434 -13.269 958 HA ASP 110 HA ASP 110 5.926 -7.860 -10.545 959 HB2 ASP 110 2HB ASP 110 7.115 -9.957 -10.020 960 HB3 ASP 110 3HB ASP 110 6.011 -10.184 -11.368 961 H GLU 111 H GLU 111 9.045 -7.912 -12.371 962 HA GLU 111 HA GLU 111 10.627 -7.075 -10.155 963 HB2 GLU 111 2HB GLU 111 12.455 -6.706 -11.819 964 HB3 GLU 111 3HB GLU 111 11.711 -8.286 -11.941 965 HG2 GLU 111 2HG GLU 111 12.068 -7.638 -14.173 966 HG3 GLU 111 3HG GLU 111 10.351 -7.356 -13.898 967 H GLU 112 H GLU 112 8.882 -5.409 -12.643 968 HA GLU 112 HA GLU 112 9.797 -2.773 -12.319 969 HB2 GLU 112 2HB GLU 112 8.456 -3.498 -14.239 970 HB3 GLU 112 3HB GLU 112 7.093 -3.869 -13.187 971 HG2 GLU 112 2HG GLU 112 6.839 -1.472 -12.657 972 HG3 GLU 112 3HG GLU 112 8.224 -1.094 -13.683 973 H ALA 113 H ALA 113 7.114 -4.564 -10.823 974 HA ALA 113 HA ALA 113 6.106 -2.558 -9.148 975 HB1 ALA 113 3HB ALA 113 5.044 -4.406 -7.910 976 HB2 ALA 113 1HB ALA 113 6.088 -5.567 -8.736 977 HB3 ALA 113 2HB ALA 113 4.900 -4.639 -9.653 978 H LEU 114 H LEU 114 8.565 -5.074 -8.534 979 HA LEU 114 HA LEU 114 9.105 -4.596 -5.810 980 HB2 LEU 114 2HB LEU 114 11.073 -5.535 -7.947 981 HB3 LEU 114 3HB LEU 114 11.280 -5.732 -6.211 982 HG LEU 114 HG LEU 114 9.176 -7.088 -7.935 983 HD11 LEU 114 1HD1 LEU 114 11.378 -8.048 -8.271 984 HD12 LEU 114 2HD1 LEU 114 10.341 -9.170 -7.396 985 HD13 LEU 114 3HD1 LEU 114 11.584 -8.262 -6.528 986 HD21 LEU 114 3HD2 LEU 114 9.629 -7.373 -4.953 987 HD22 LEU 114 1HD2 LEU 114 8.506 -8.318 -5.934 988 HD23 LEU 114 2HD2 LEU 114 8.250 -6.591 -5.730 989 H LYS 115 H LYS 115 10.337 -3.121 -8.718 990 HA LYS 115 HA LYS 115 12.470 -1.582 -7.702 991 HB2 LYS 115 2HB LYS 115 12.062 -2.354 -10.042 992 HB3 LYS 115 3HB LYS 115 10.710 -1.242 -10.153 993 HG2 LYS 115 2HG LYS 115 12.257 0.670 -9.994 994 HG3 LYS 115 3HG LYS 115 13.621 -0.450 -9.835 995 HD2 LYS 115 2HD LYS 115 11.737 -0.276 -12.222 996 HD3 LYS 115 3HD LYS 115 13.391 0.348 -12.178 997 HE2 LYS 115 2HE LYS 115 14.277 -1.932 -11.955 998 HE3 LYS 115 3HE LYS 115 12.647 -2.588 -11.829 999 HZ1 LYS 115 3HZ LYS 115 12.228 -1.810 -14.085 1000 HZ2 LYS 115 1HZ LYS 115 13.483 -2.936 -14.008 1001 HZ3 LYS 115 2HZ LYS 115 13.832 -1.296 -14.216 1002 H ILE 116 H ILE 116 9.012 -0.947 -8.255 1003 HA ILE 116 HA ILE 116 9.094 1.848 -7.569 1004 HB ILE 116 HB ILE 116 6.679 0.001 -7.759 1005 HG12 ILE 116 2HG1 ILE 116 7.922 0.075 -9.903 1006 HG13 ILE 116 3HG1 ILE 116 6.362 0.860 -10.048 1007 HG21 ILE 116 1HG2 ILE 116 6.168 2.054 -6.513 1008 HG22 ILE 116 2HG2 ILE 116 5.359 2.065 -8.080 1009 HG23 ILE 116 3HG2 ILE 116 6.814 3.032 -7.832 1010 HD11 ILE 116 3HD1 ILE 116 8.067 2.050 -11.252 1011 HD12 ILE 116 1HD1 ILE 116 9.027 2.241 -9.789 1012 HD13 ILE 116 2HD1 ILE 116 7.459 3.045 -9.933 1013 H VAL 117 H VAL 117 8.339 -1.156 -5.826 1014 HA VAL 117 HA VAL 117 7.425 -0.147 -3.374 1015 HB VAL 117 HB VAL 117 9.168 -2.614 -3.869 1016 HG11 VAL 117 1HG1 VAL 117 7.558 -1.910 -1.380 1017 HG12 VAL 117 2HG1 VAL 117 9.318 -1.956 -1.492 1018 HG13 VAL 117 3HG1 VAL 117 8.387 -3.445 -1.662 1019 HG21 VAL 117 3HG2 VAL 117 6.996 -2.689 -5.042 1020 HG22 VAL 117 1HG2 VAL 117 6.154 -2.385 -3.524 1021 HG23 VAL 117 2HG2 VAL 117 7.054 -3.889 -3.752 1022 H ARG 118 H ARG 118 10.729 -0.780 -4.519 1023 HA ARG 118 HA ARG 118 12.189 0.061 -2.272 1024 HB2 ARG 118 2HB ARG 118 12.962 0.061 -5.216 1025 HB3 ARG 118 3HB ARG 118 14.102 0.378 -3.906 1026 HG2 ARG 118 2HG ARG 118 13.719 -1.874 -3.006 1027 HG3 ARG 118 3HG ARG 118 12.547 -2.202 -4.288 1028 HD2 ARG 118 2HD ARG 118 14.307 -1.995 -5.979 1029 HD3 ARG 118 3HD ARG 118 15.484 -1.558 -4.733 1030 HE ARG 118 HE ARG 118 14.104 -4.142 -4.599 1031 HH11 ARG 118 1HH1 ARG 118 17.127 -2.403 -5.023 1032 HH12 ARG 118 2HH1 ARG 118 18.102 -3.825 -4.841 1033 HH21 ARG 118 1HH2 ARG 118 15.366 -5.978 -4.366 1034 HH22 ARG 118 2HH2 ARG 118 17.096 -5.866 -4.467 1035 H GLU 119 H GLU 119 10.949 1.880 -5.075 1036 HA GLU 119 HA GLU 119 12.096 4.386 -4.544 1037 HB2 GLU 119 2HB GLU 119 9.488 3.649 -5.925 1038 HB3 GLU 119 3HB GLU 119 10.089 5.303 -5.852 1039 HG2 GLU 119 2HG GLU 119 11.504 2.955 -7.171 1040 HG3 GLU 119 3HG GLU 119 10.625 4.240 -8.002 1041 H PHE 120 H PHE 120 8.839 3.168 -3.651 1042 HA PHE 120 HA PHE 120 7.862 5.297 -2.174 1043 HB2 PHE 120 2HB PHE 120 7.407 2.305 -1.796 1044 HB3 PHE 120 3HB PHE 120 6.472 3.540 -0.953 1045 HD1 PHE 120 HD2 PHE 120 6.240 5.500 -3.356 1046 HD2 PHE 120 HD1 PHE 120 5.584 1.282 -2.970 1047 HE1 PHE 120 HE2 PHE 120 4.577 5.586 -5.159 1048 HE2 PHE 120 HE1 PHE 120 3.925 1.400 -4.764 1049 HZ PHE 120 HZ PHE 120 3.413 3.537 -5.854 1050 H MET 121 H MET 121 9.988 2.700 -1.124 1051 HA MET 121 HA MET 121 9.879 3.147 1.682 1052 HB2 MET 121 2HB MET 121 11.889 1.666 -0.059 1053 HB3 MET 121 3HB MET 121 11.881 1.608 1.702 1054 HG2 MET 121 2HG MET 121 9.807 0.448 1.762 1055 HG3 MET 121 3HG MET 121 9.467 0.805 0.071 1056 HE1 MET 121 3HE MET 121 12.724 -2.160 1.408 1057 HE2 MET 121 1HE MET 121 11.713 -1.266 2.540 1058 HE3 MET 121 2HE MET 121 12.912 -0.415 1.560 1059 H GLN 122 H GLN 122 11.750 4.633 -0.855 1060 HA GLN 122 HA GLN 122 13.879 5.732 0.728 1061 HB2 GLN 122 2HB GLN 122 12.773 6.609 -1.972 1062 HB3 GLN 122 3HB GLN 122 14.296 7.169 -1.276 1063 HG2 GLN 122 2HG GLN 122 15.284 5.000 -1.466 1064 HG3 GLN 122 3HG GLN 122 13.732 4.248 -1.828 1065 HE21 GLN 122 1HE2 GLN 122 14.443 3.355 -3.765 1066 HE22 GLN 122 2HE2 GLN 122 14.763 4.314 -5.168 1067 H LYS 123 H LYS 123 10.785 6.973 -0.525 1068 HA LYS 123 HA LYS 123 11.026 9.572 0.694 1069 HB2 LYS 123 2HB LYS 123 8.491 8.264 -0.388 1070 HB3 LYS 123 3HB LYS 123 8.673 9.951 0.053 1071 HG2 LYS 123 2HG LYS 123 8.763 9.971 -2.289 1072 HG3 LYS 123 3HG LYS 123 10.459 10.083 -1.804 1073 HD2 LYS 123 2HD LYS 123 10.789 7.710 -2.261 1074 HD3 LYS 123 3HD LYS 123 9.070 7.492 -2.578 1075 HE2 LYS 123 2HE LYS 123 10.938 9.192 -4.265 1076 HE3 LYS 123 3HE LYS 123 10.445 7.539 -4.642 1077 HZ1 LYS 123 3HZ LYS 123 8.694 9.924 -4.476 1078 HZ2 LYS 123 1HZ LYS 123 8.121 8.339 -4.628 1079 HZ3 LYS 123 2HZ LYS 123 9.068 9.017 -5.855 1080 H ALA 124 H ALA 124 9.742 6.463 1.598 1081 HA ALA 124 HA ALA 124 8.110 7.180 3.801 1082 HB1 ALA 124 3HB ALA 124 7.978 4.958 2.727 1083 HB2 ALA 124 1HB ALA 124 8.327 4.787 4.451 1084 HB3 ALA 124 2HB ALA 124 9.613 4.575 3.263 1085 H GLY 125 H GLY 125 11.527 6.170 3.516 1086 HA2 GLY 125 2HA GLY 125 12.253 6.268 6.241 1087 HA3 GLY 125 3HA GLY 125 13.349 6.371 4.874 1088 H SER 126 H SER 126 12.319 8.768 3.710 1089 HA SER 126 HA SER 126 13.722 10.712 5.238 1090 HB2 SER 126 2HB SER 126 13.086 12.299 3.424 1091 HB3 SER 126 3HB SER 126 13.762 10.799 2.795 1092 HG SER 126 HG SER 126 11.021 10.802 3.070 1093 H LEU 127 H LEU 127 10.421 9.703 5.342 1094 HA LEU 127 HA LEU 127 8.996 12.019 5.898 1095 HB2 LEU 127 2HB LEU 127 8.560 9.232 7.016 1096 HB3 LEU 127 3HB LEU 127 7.404 10.541 7.210 1097 HG LEU 127 HG LEU 127 8.234 9.257 4.584 1098 HD11 LEU 127 1HD1 LEU 127 5.587 9.145 6.049 1099 HD12 LEU 127 2HD1 LEU 127 6.753 7.828 5.885 1100 HD13 LEU 127 3HD1 LEU 127 5.929 8.455 4.459 1101 HD21 LEU 127 3HD2 LEU 127 6.264 11.522 5.035 1102 HD22 LEU 127 1HD2 LEU 127 6.553 10.686 3.506 1103 HD23 LEU 127 2HD2 LEU 127 7.835 11.647 4.237 1104 H GLU 128 H GLU 128 11.231 10.369 8.057 1105 HA GLU 128 HA GLU 128 10.227 11.539 10.486 1106 HB2 GLU 128 2HB GLU 128 11.479 9.355 10.388 1107 HB3 GLU 128 3HB GLU 128 12.942 10.255 10.013 1108 HG2 GLU 128 2HG GLU 128 12.807 9.588 12.411 1109 HG3 GLU 128 3HG GLU 128 12.916 11.336 12.192 1110 H HIS 129 H HIS 129 12.211 12.746 7.972 1111 HA HIS 129 HA HIS 129 13.001 15.096 9.608 1112 HB2 HIS 129 2HB HIS 129 14.075 14.136 6.917 1113 HB3 HIS 129 3HB HIS 129 14.538 15.648 7.689 1114 HD1 HIS 129 HD1 HIS 129 16.501 15.558 9.186 1115 HD2 HIS 129 HD2 HIS 129 14.858 11.792 8.569 1116 HE1 HIS 129 HE1 HIS 129 18.062 13.947 10.305 1117 HE2 HIS 129 HE2 HIS 129 16.948 11.707 10.070 1118 H HIS 130 H HIS 130 11.981 14.337 6.286 1119 HA HIS 130 HA HIS 130 10.565 16.763 5.790 1120 HB2 HIS 130 2HB HIS 130 11.525 15.325 3.979 1121 HB3 HIS 130 3HB HIS 130 10.391 14.049 4.385 1122 HD1 HIS 130 HD1 HIS 130 7.887 14.421 3.699 1123 HD2 HIS 130 HD2 HIS 130 10.492 17.394 2.397 1124 HE1 HIS 130 HE1 HIS 130 6.630 15.706 1.942 1125 HE2 HIS 130 HE2 HIS 130 8.293 17.351 1.044 1126 H HIS 131 H HIS 131 9.315 16.829 7.792 1127 HA HIS 131 HA HIS 131 7.320 14.863 8.424 1128 HB2 HIS 131 2HB HIS 131 7.926 17.631 9.529 1129 HB3 HIS 131 3HB HIS 131 6.513 16.729 10.065 1130 HD1 HIS 131 HD1 HIS 131 8.164 17.257 12.326 1131 HD2 HIS 131 HD2 HIS 131 9.148 14.122 9.801 1132 HE1 HIS 131 HE1 HIS 131 9.594 15.715 13.693 1133 HE2 HIS 131 HE2 HIS 131 10.083 13.766 12.171 1134 H HIS 132 H HIS 132 5.150 14.893 8.040 1135 HA HIS 132 HA HIS 132 4.257 16.205 5.654 1136 HB2 HIS 132 2HB HIS 132 3.584 13.906 6.138 1137 HB3 HIS 132 3HB HIS 132 2.806 14.397 7.635 1138 HD1 HIS 132 HD1 HIS 132 0.341 14.628 7.437 1139 HD2 HIS 132 HD2 HIS 132 2.220 15.242 3.786 1140 HE1 HIS 132 HE1 HIS 132 -1.504 14.977 5.775 1141 HE2 HIS 132 HE2 HIS 132 -0.339 15.469 3.598 1142 H HIS 133 H HIS 133 3.827 16.793 9.091 1143 HA HIS 133 HA HIS 133 2.045 19.098 8.540 1144 HB2 HIS 133 2HB HIS 133 2.560 17.577 11.129 1145 HB3 HIS 133 3HB HIS 133 1.653 19.085 11.060 1146 HD1 HIS 133 HD1 HIS 133 0.391 16.436 12.062 1147 HD2 HIS 133 HD2 HIS 133 0.050 17.895 8.187 1148 HE1 HIS 133 HE1 HIS 133 -1.726 15.453 11.152 1149 HE2 HIS 133 HE2 HIS 133 -2.025 16.548 8.909 1150 H HIS 134 H HIS 134 2.767 21.132 8.840 1151 HA HIS 134 HA HIS 134 5.177 21.644 10.491 1152 HB2 HIS 134 2HB HIS 134 4.533 23.064 7.860 1153 HB3 HIS 134 3HB HIS 134 5.894 23.413 8.919 1154 HD1 HIS 134 HD1 HIS 134 5.102 21.685 5.934 1155 HD2 HIS 134 HD2 HIS 134 7.649 20.914 9.124 1156 HE1 HIS 134 HE1 HIS 134 6.775 20.037 5.082 1157 HE2 HIS 134 HE2 HIS 134 8.153 19.425 7.087 Start of MODEL 5 1 H1 MET 1 1H MET 1 1.738 9.465 13.314 2 H2 MET 1 2H MET 1 2.499 10.975 13.264 3 H3 MET 1 3H MET 1 3.311 9.638 13.902 4 HA MET 1 HA MET 1 2.426 9.899 11.103 5 HB2 MET 1 2HB MET 1 4.234 11.503 11.577 6 HB3 MET 1 3HB MET 1 5.203 10.243 12.330 7 HG2 MET 1 2HG MET 1 6.029 10.772 10.081 8 HG3 MET 1 3HG MET 1 5.437 9.110 10.151 9 HE1 MET 1 3HE MET 1 4.531 10.165 6.478 10 HE2 MET 1 1HE MET 1 5.317 8.946 7.483 11 HE3 MET 1 2HE MET 1 5.981 10.579 7.391 12 H LYS 2 H LYS 2 2.500 8.035 9.993 13 HA LYS 2 HA LYS 2 4.316 5.846 10.755 14 HB2 LYS 2 2HB LYS 2 1.360 5.513 10.045 15 HB3 LYS 2 3HB LYS 2 2.520 4.188 10.017 16 HG2 LYS 2 2HG LYS 2 2.904 4.496 12.446 17 HG3 LYS 2 3HG LYS 2 1.691 5.785 12.459 18 HD2 LYS 2 2HD LYS 2 -0.029 4.168 11.706 19 HD3 LYS 2 3HD LYS 2 1.178 2.878 11.690 20 HE2 LYS 2 2HE LYS 2 -0.184 2.748 13.721 21 HE3 LYS 2 3HE LYS 2 1.480 3.160 14.138 22 HZ1 LYS 2 3HZ LYS 2 -0.158 4.490 15.339 23 HZ2 LYS 2 1HZ LYS 2 -0.743 5.115 13.883 24 HZ3 LYS 2 2HZ LYS 2 0.841 5.451 14.375 25 H ILE 3 H ILE 3 4.784 4.461 8.900 26 HA ILE 3 HA ILE 3 4.290 5.718 6.249 27 HB ILE 3 HB ILE 3 6.703 4.045 7.098 28 HG12 ILE 3 2HG1 ILE 3 6.660 7.029 6.440 29 HG13 ILE 3 3HG1 ILE 3 6.626 6.395 8.082 30 HG21 ILE 3 1HG2 ILE 3 7.630 4.590 4.883 31 HG22 ILE 3 2HG2 ILE 3 6.170 5.487 4.469 32 HG23 ILE 3 3HG2 ILE 3 6.095 3.741 4.718 33 HD11 ILE 3 3HD1 ILE 3 8.812 5.339 7.701 34 HD12 ILE 3 1HD1 ILE 3 8.845 7.089 7.498 35 HD13 ILE 3 2HD1 ILE 3 8.850 6.042 6.082 36 H LEU 4 H LEU 4 2.596 4.517 5.540 37 HA LEU 4 HA LEU 4 2.760 1.564 5.635 38 HB2 LEU 4 2HB LEU 4 0.453 3.491 5.361 39 HB3 LEU 4 3HB LEU 4 0.294 1.889 4.668 40 HG LEU 4 HG LEU 4 0.652 0.875 6.910 41 HD11 LEU 4 1HD1 LEU 4 0.675 3.713 7.968 42 HD12 LEU 4 2HD1 LEU 4 2.019 2.571 7.983 43 HD13 LEU 4 3HD1 LEU 4 0.585 2.246 8.951 44 HD21 LEU 4 3HD2 LEU 4 -1.619 1.302 6.099 45 HD22 LEU 4 1HD2 LEU 4 -1.596 2.909 6.837 46 HD23 LEU 4 2HD2 LEU 4 -1.527 1.463 7.849 47 H ILE 5 H ILE 5 2.917 0.398 3.790 48 HA ILE 5 HA ILE 5 2.693 1.770 1.168 49 HB ILE 5 HB ILE 5 4.401 -0.687 1.822 50 HG12 ILE 5 2HG1 ILE 5 5.296 2.155 1.132 51 HG13 ILE 5 3HG1 ILE 5 5.407 1.407 2.721 52 HG21 ILE 5 1HG2 ILE 5 4.093 0.831 -0.799 53 HG22 ILE 5 2HG2 ILE 5 3.478 -0.787 -0.456 54 HG23 ILE 5 3HG2 ILE 5 5.217 -0.504 -0.515 55 HD11 ILE 5 3HD1 ILE 5 7.561 1.421 1.634 56 HD12 ILE 5 1HD1 ILE 5 6.912 0.552 0.243 57 HD13 ILE 5 2HD1 ILE 5 6.999 -0.239 1.820 58 H LEU 6 H LEU 6 0.812 1.205 0.315 59 HA LEU 6 HA LEU 6 -0.607 -1.230 1.063 60 HB2 LEU 6 2HB LEU 6 -1.407 1.056 -0.783 61 HB3 LEU 6 3HB LEU 6 -2.444 -0.281 -0.314 62 HG LEU 6 HG LEU 6 -1.374 1.863 1.537 63 HD11 LEU 6 1HD1 LEU 6 -3.093 2.714 0.025 64 HD12 LEU 6 2HD1 LEU 6 -3.690 2.633 1.680 65 HD13 LEU 6 3HD1 LEU 6 -4.186 1.410 0.505 66 HD21 LEU 6 3HD2 LEU 6 -3.274 -0.413 2.153 67 HD22 LEU 6 1HD2 LEU 6 -2.838 0.906 3.247 68 HD23 LEU 6 2HD2 LEU 6 -1.614 -0.247 2.730 69 H ILE 7 H ILE 7 -0.481 -3.004 -0.153 70 HA ILE 7 HA ILE 7 0.384 -2.833 -2.991 71 HB ILE 7 HB ILE 7 0.731 -5.161 -1.042 72 HG12 ILE 7 2HG1 ILE 7 2.301 -3.313 -0.566 73 HG13 ILE 7 3HG1 ILE 7 3.161 -4.708 -1.202 74 HG21 ILE 7 1HG2 ILE 7 2.041 -6.262 -2.848 75 HG22 ILE 7 2HG2 ILE 7 1.611 -4.952 -3.949 76 HG23 ILE 7 3HG2 ILE 7 0.355 -6.015 -3.310 77 HD11 ILE 7 3HD1 ILE 7 3.312 -3.600 -3.388 78 HD12 ILE 7 1HD1 ILE 7 4.038 -2.649 -2.095 79 HD13 ILE 7 2HD1 ILE 7 2.456 -2.202 -2.727 80 H ASN 8 H ASN 8 -1.318 -3.035 -4.252 81 HA ASN 8 HA ASN 8 -3.260 -5.226 -3.777 82 HB2 ASN 8 2HB ASN 8 -4.293 -2.934 -3.587 83 HB3 ASN 8 3HB ASN 8 -3.815 -2.591 -5.237 84 HD21 ASN 8 1HD2 ASN 8 -6.477 -2.685 -3.991 85 HD22 ASN 8 2HD2 ASN 8 -7.396 -3.834 -4.895 86 H THR 9 H THR 9 -2.263 -6.715 -5.001 87 HA THR 9 HA THR 9 -2.149 -6.190 -7.896 88 HB THR 9 HB THR 9 0.162 -6.278 -7.201 89 HG1 THR 9 HG1 THR 9 0.683 -8.401 -8.340 90 HG21 THR 9 3HG2 THR 9 -0.411 -8.986 -5.977 91 HG22 THR 9 1HG2 THR 9 -0.041 -7.507 -5.086 92 HG23 THR 9 2HG2 THR 9 1.177 -8.234 -6.137 93 H ASN 10 H ASN 10 -2.842 -7.832 -9.202 94 HA ASN 10 HA ASN 10 -4.860 -9.517 -7.953 95 HB2 ASN 10 2HB ASN 10 -5.206 -8.245 -10.118 96 HB3 ASN 10 3HB ASN 10 -4.109 -9.377 -10.901 97 HD21 ASN 10 1HD2 ASN 10 -5.725 -10.068 -12.313 98 HD22 ASN 10 2HD2 ASN 10 -7.038 -11.073 -11.815 99 H ASN 11 H ASN 11 -1.591 -9.956 -9.122 100 HA ASN 11 HA ASN 11 -1.797 -12.880 -8.659 101 HB2 ASN 11 2HB ASN 11 0.458 -13.077 -9.681 102 HB3 ASN 11 3HB ASN 11 -0.715 -12.381 -10.784 103 HD21 ASN 11 1HD2 ASN 11 2.247 -12.285 -10.731 104 HD22 ASN 11 2HD2 ASN 11 2.652 -10.606 -10.780 105 H ASP 12 H ASP 12 -1.545 -13.403 -6.642 106 HA ASP 12 HA ASP 12 -0.283 -11.916 -4.576 107 HB2 ASP 12 2HB ASP 12 -2.122 -13.482 -4.138 108 HB3 ASP 12 3HB ASP 12 -1.143 -14.830 -4.717 109 H GLU 13 H GLU 13 0.926 -14.226 -6.858 110 HA GLU 13 HA GLU 13 3.190 -15.285 -5.751 111 HB2 GLU 13 2HB GLU 13 2.133 -15.724 -8.030 112 HB3 GLU 13 3HB GLU 13 2.914 -14.247 -8.601 113 HG2 GLU 13 2HG GLU 13 5.099 -15.315 -7.793 114 HG3 GLU 13 3HG GLU 13 4.184 -16.814 -7.680 115 H LEU 14 H LEU 14 2.735 -12.127 -7.252 116 HA LEU 14 HA LEU 14 5.381 -11.143 -7.215 117 HB2 LEU 14 2HB LEU 14 3.613 -10.220 -8.615 118 HB3 LEU 14 3HB LEU 14 2.667 -9.780 -7.203 119 HG LEU 14 HG LEU 14 4.315 -8.050 -6.600 120 HD11 LEU 14 1HD1 LEU 14 6.140 -7.430 -8.137 121 HD12 LEU 14 2HD1 LEU 14 5.813 -8.876 -9.101 122 HD13 LEU 14 3HD1 LEU 14 6.367 -9.027 -7.430 123 HD21 LEU 14 3HD2 LEU 14 3.839 -6.488 -8.395 124 HD22 LEU 14 1HD2 LEU 14 2.424 -7.473 -8.053 125 HD23 LEU 14 2HD2 LEU 14 3.410 -7.812 -9.479 126 H ILE 15 H ILE 15 2.797 -11.110 -4.780 127 HA ILE 15 HA ILE 15 3.925 -9.205 -2.989 128 HB ILE 15 HB ILE 15 1.935 -11.433 -2.342 129 HG12 ILE 15 2HG1 ILE 15 1.422 -8.552 -3.200 130 HG13 ILE 15 3HG1 ILE 15 1.152 -9.980 -4.190 131 HG21 ILE 15 1HG2 ILE 15 2.476 -8.835 -0.849 132 HG22 ILE 15 2HG2 ILE 15 2.946 -10.447 -0.313 133 HG23 ILE 15 3HG2 ILE 15 1.241 -10.031 -0.439 134 HD11 ILE 15 3HD1 ILE 15 -0.333 -9.246 -1.672 135 HD12 ILE 15 1HD1 ILE 15 -0.588 -10.717 -2.618 136 HD13 ILE 15 2HD1 ILE 15 -0.924 -9.140 -3.330 137 H LYS 16 H LYS 16 4.421 -12.648 -3.443 138 HA LYS 16 HA LYS 16 5.510 -13.402 -0.949 139 HB2 LYS 16 2HB LYS 16 6.443 -14.540 -3.617 140 HB3 LYS 16 3HB LYS 16 6.420 -15.350 -2.054 141 HG2 LYS 16 2HG LYS 16 3.977 -14.573 -3.680 142 HG3 LYS 16 3HG LYS 16 4.697 -16.176 -3.632 143 HD2 LYS 16 2HD LYS 16 2.862 -16.372 -2.186 144 HD3 LYS 16 3HD LYS 16 4.199 -16.107 -1.072 145 HE2 LYS 16 2HE LYS 16 3.518 -13.812 -0.709 146 HE3 LYS 16 3HE LYS 16 2.353 -13.893 -2.030 147 HZ1 LYS 16 3HZ LYS 16 1.228 -14.074 0.033 148 HZ2 LYS 16 1HZ LYS 16 2.205 -15.360 0.537 149 HZ3 LYS 16 2HZ LYS 16 1.134 -15.560 -0.759 150 H LYS 17 H LYS 17 6.864 -11.787 -3.701 151 HA LYS 17 HA LYS 17 9.595 -11.719 -2.776 152 HB2 LYS 17 2HB LYS 17 8.165 -10.197 -4.990 153 HB3 LYS 17 3HB LYS 17 9.914 -10.257 -4.754 154 HG2 LYS 17 2HG LYS 17 9.940 -12.645 -5.235 155 HG3 LYS 17 3HG LYS 17 8.175 -12.678 -5.344 156 HD2 LYS 17 2HD LYS 17 8.216 -11.285 -7.346 157 HD3 LYS 17 3HD LYS 17 9.957 -11.035 -7.194 158 HE2 LYS 17 2HE LYS 17 10.337 -13.437 -7.585 159 HE3 LYS 17 3HE LYS 17 8.596 -13.694 -7.720 160 HZ1 LYS 17 3HZ LYS 17 10.250 -12.014 -9.510 161 HZ2 LYS 17 1HZ LYS 17 8.585 -12.249 -9.640 162 HZ3 LYS 17 2HZ LYS 17 9.640 -13.547 -9.872 163 H ILE 18 H ILE 18 6.889 -9.385 -3.127 164 HA ILE 18 HA ILE 18 8.219 -7.043 -2.361 165 HB ILE 18 HB ILE 18 5.258 -7.732 -2.204 166 HG12 ILE 18 2HG1 ILE 18 6.861 -6.162 -4.281 167 HG13 ILE 18 3HG1 ILE 18 6.231 -7.791 -4.486 168 HG21 ILE 18 1HG2 ILE 18 4.794 -5.296 -2.086 169 HG22 ILE 18 2HG2 ILE 18 6.523 -4.979 -1.920 170 HG23 ILE 18 3HG2 ILE 18 5.658 -5.868 -0.663 171 HD11 ILE 18 3HD1 ILE 18 3.938 -6.901 -4.354 172 HD12 ILE 18 1HD1 ILE 18 4.873 -6.202 -5.675 173 HD13 ILE 18 2HD1 ILE 18 4.595 -5.267 -4.207 174 H LYS 19 H LYS 19 6.522 -9.388 -0.304 175 HA LYS 19 HA LYS 19 6.585 -7.981 2.142 176 HB2 LYS 19 2HB LYS 19 6.583 -10.983 1.617 177 HB3 LYS 19 3HB LYS 19 6.345 -10.262 3.209 178 HG2 LYS 19 2HG LYS 19 4.294 -9.170 2.439 179 HG3 LYS 19 3HG LYS 19 4.557 -9.781 0.807 180 HD2 LYS 19 2HD LYS 19 2.848 -11.111 1.939 181 HD3 LYS 19 3HD LYS 19 4.268 -12.104 1.614 182 HE2 LYS 19 2HE LYS 19 4.910 -12.089 3.925 183 HE3 LYS 19 3HE LYS 19 3.779 -10.794 4.306 184 HZ1 LYS 19 3HZ LYS 19 1.946 -12.246 4.007 185 HZ2 LYS 19 1HZ LYS 19 3.049 -13.040 5.015 186 HZ3 LYS 19 2HZ LYS 19 2.925 -13.478 3.385 187 H LYS 20 H LYS 20 8.837 -10.323 0.688 188 HA LYS 20 HA LYS 20 10.778 -10.300 2.750 189 HB2 LYS 20 2HB LYS 20 10.935 -11.078 -0.185 190 HB3 LYS 20 3HB LYS 20 12.296 -11.276 0.920 191 HG2 LYS 20 2HG LYS 20 9.570 -12.520 1.417 192 HG3 LYS 20 3HG LYS 20 10.859 -13.346 0.534 193 HD2 LYS 20 2HD LYS 20 12.281 -13.405 2.481 194 HD3 LYS 20 3HD LYS 20 11.260 -12.261 3.354 195 HE2 LYS 20 2HE LYS 20 10.377 -15.061 2.558 196 HE3 LYS 20 3HE LYS 20 11.010 -14.626 4.148 197 HZ1 LYS 20 3HZ LYS 20 8.605 -14.610 4.152 198 HZ2 LYS 20 1HZ LYS 20 8.573 -13.491 2.885 199 HZ3 LYS 20 2HZ LYS 20 9.193 -13.041 4.387 200 H GLU 21 H GLU 21 10.317 -8.244 -0.098 201 HA GLU 21 HA GLU 21 12.803 -6.919 -0.143 202 HB2 GLU 21 2HB GLU 21 10.097 -5.728 -0.924 203 HB3 GLU 21 3HB GLU 21 11.674 -5.114 -1.409 204 HG2 GLU 21 2HG GLU 21 10.349 -7.694 -2.275 205 HG3 GLU 21 3HG GLU 21 10.662 -6.272 -3.260 206 H VAL 22 H VAL 22 9.735 -6.016 1.461 207 HA VAL 22 HA VAL 22 10.842 -3.647 2.674 208 HB VAL 22 HB VAL 22 8.686 -3.364 3.779 209 HG11 VAL 22 1HG1 VAL 22 8.314 -4.271 0.905 210 HG12 VAL 22 2HG1 VAL 22 8.848 -2.672 1.430 211 HG13 VAL 22 3HG1 VAL 22 7.215 -3.223 1.810 212 HG21 VAL 22 3HG2 VAL 22 6.852 -5.015 3.526 213 HG22 VAL 22 1HG2 VAL 22 8.203 -5.667 4.446 214 HG23 VAL 22 2HG2 VAL 22 7.975 -6.139 2.760 215 H GLU 23 H GLU 23 10.602 -7.004 3.654 216 HA GLU 23 HA GLU 23 10.944 -6.749 6.449 217 HB2 GLU 23 2HB GLU 23 11.683 -8.941 4.490 218 HB3 GLU 23 3HB GLU 23 12.067 -9.091 6.201 219 HG2 GLU 23 2HG GLU 23 9.732 -9.034 6.810 220 HG3 GLU 23 3HG GLU 23 9.259 -8.646 5.155 221 H ASN 24 H ASN 24 13.282 -6.535 3.797 222 HA ASN 24 HA ASN 24 15.674 -6.561 5.316 223 HB2 ASN 24 2HB ASN 24 15.074 -5.163 2.672 224 HB3 ASN 24 3HB ASN 24 16.688 -5.291 3.374 225 HD21 ASN 24 1HD2 ASN 24 14.178 -6.954 1.691 226 HD22 ASN 24 2HD2 ASN 24 15.058 -8.408 1.400 227 H GLN 25 H GLN 25 13.355 -4.004 4.653 228 HA GLN 25 HA GLN 25 14.955 -1.926 5.965 229 HB2 GLN 25 2HB GLN 25 12.205 -1.849 4.653 230 HB3 GLN 25 3HB GLN 25 13.011 -0.445 5.352 231 HG2 GLN 25 2HG GLN 25 14.057 -2.093 3.027 232 HG3 GLN 25 3HG GLN 25 13.222 -0.548 2.895 233 HE21 GLN 25 1HE2 GLN 25 16.200 -2.124 3.808 234 HE22 GLN 25 2HE2 GLN 25 17.161 -0.694 3.895 235 H GLY 26 H GLY 26 12.967 -4.377 7.038 236 HA2 GLY 26 2HA GLY 26 12.246 -4.846 9.167 237 HA3 GLY 26 3HA GLY 26 12.846 -3.281 9.691 238 H TYR 27 H TYR 27 10.486 -3.817 7.114 239 HA TYR 27 HA TYR 27 8.428 -2.302 8.461 240 HB2 TYR 27 2HB TYR 27 8.556 -3.747 5.797 241 HB3 TYR 27 3HB TYR 27 7.000 -3.227 6.429 242 HD1 TYR 27 HD1 TYR 27 10.440 -1.707 5.954 243 HD2 TYR 27 HD2 TYR 27 6.208 -1.222 5.555 244 HE1 TYR 27 HE1 TYR 27 10.780 0.511 4.947 245 HE2 TYR 27 HE2 TYR 27 6.551 0.993 4.559 246 HH TYR 27 HH TYR 27 9.551 2.077 3.459 247 H GLN 28 H GLN 28 6.734 -3.053 9.533 248 HA GLN 28 HA GLN 28 6.306 -5.798 10.234 249 HB2 GLN 28 2HB GLN 28 5.819 -3.889 11.766 250 HB3 GLN 28 3HB GLN 28 4.645 -3.259 10.616 251 HG2 GLN 28 2HG GLN 28 3.348 -5.446 10.965 252 HG3 GLN 28 3HG GLN 28 4.435 -5.749 12.324 253 HE21 GLN 28 1HE2 GLN 28 1.862 -3.736 11.102 254 HE22 GLN 28 2HE2 GLN 28 1.463 -2.979 12.603 255 H VAL 29 H VAL 29 5.408 -7.160 8.714 256 HA VAL 29 HA VAL 29 3.765 -6.041 6.552 257 HB VAL 29 HB VAL 29 4.785 -8.905 6.802 258 HG11 VAL 29 1HG1 VAL 29 2.817 -8.668 5.337 259 HG12 VAL 29 2HG1 VAL 29 4.255 -9.011 4.376 260 HG13 VAL 29 3HG1 VAL 29 3.615 -7.368 4.447 261 HG21 VAL 29 3HG2 VAL 29 6.534 -8.259 5.162 262 HG22 VAL 29 1HG2 VAL 29 6.700 -7.351 6.669 263 HG23 VAL 29 2HG2 VAL 29 5.994 -6.580 5.247 264 H ARG 30 H ARG 30 1.683 -6.065 6.732 265 HA ARG 30 HA ARG 30 0.243 -7.935 8.501 266 HB2 ARG 30 2HB ARG 30 0.076 -5.719 9.383 267 HB3 ARG 30 3HB ARG 30 -0.178 -5.009 7.797 268 HG2 ARG 30 2HG ARG 30 -2.227 -4.946 9.092 269 HG3 ARG 30 3HG ARG 30 -2.427 -6.006 7.697 270 HD2 ARG 30 2HD ARG 30 -2.141 -7.985 9.155 271 HD3 ARG 30 3HD ARG 30 -1.919 -6.921 10.556 272 HE ARG 30 HE ARG 30 -4.280 -6.110 9.491 273 HH11 ARG 30 1HH1 ARG 30 -3.188 -9.298 10.574 274 HH12 ARG 30 2HH1 ARG 30 -4.791 -9.803 10.995 275 HH21 ARG 30 1HH2 ARG 30 -6.303 -6.771 10.055 276 HH22 ARG 30 2HH2 ARG 30 -6.569 -8.367 10.702 277 H ASP 31 H ASP 31 -1.177 -9.234 7.536 278 HA ASP 31 HA ASP 31 -1.899 -8.852 4.696 279 HB2 ASP 31 2HB ASP 31 -1.988 -11.373 6.428 280 HB3 ASP 31 3HB ASP 31 -2.384 -11.286 4.712 281 H VAL 32 H VAL 32 -3.837 -7.931 4.469 282 HA VAL 32 HA VAL 32 -5.884 -8.015 6.551 283 HB VAL 32 HB VAL 32 -5.954 -6.567 3.852 284 HG11 VAL 32 1HG1 VAL 32 -7.767 -5.202 4.840 285 HG12 VAL 32 2HG1 VAL 32 -7.694 -6.154 6.325 286 HG13 VAL 32 3HG1 VAL 32 -8.217 -6.910 4.818 287 HG21 VAL 32 3HG2 VAL 32 -4.076 -5.769 5.241 288 HG22 VAL 32 1HG2 VAL 32 -5.185 -5.479 6.590 289 HG23 VAL 32 2HG2 VAL 32 -5.330 -4.535 5.103 290 H ASN 33 H ASN 33 -7.307 -9.622 6.586 291 HA ASN 33 HA ASN 33 -7.759 -11.324 4.226 292 HB2 ASN 33 2HB ASN 33 -8.380 -11.725 7.180 293 HB3 ASN 33 3HB ASN 33 -8.783 -12.896 5.927 294 HD21 ASN 33 1HD2 ASN 33 -6.140 -11.325 7.636 295 HD22 ASN 33 2HD2 ASN 33 -4.939 -12.488 7.217 296 H ASP 34 H ASP 34 -9.420 -8.778 5.849 297 HA ASP 34 HA ASP 34 -11.902 -9.194 4.455 298 HB2 ASP 34 2HB ASP 34 -11.909 -10.921 6.409 299 HB3 ASP 34 3HB ASP 34 -12.067 -9.541 7.491 300 H SER 35 H SER 35 -13.654 -7.601 5.317 301 HA SER 35 HA SER 35 -12.657 -4.960 5.630 302 HB2 SER 35 2HB SER 35 -15.077 -4.365 5.927 303 HB3 SER 35 3HB SER 35 -14.792 -5.381 4.512 304 HG SER 35 HG SER 35 -16.226 -6.646 5.356 305 H ASP 36 H ASP 36 -13.948 -7.377 7.897 306 HA ASP 36 HA ASP 36 -13.927 -5.811 10.237 307 HB2 ASP 36 2HB ASP 36 -13.856 -8.773 9.691 308 HB3 ASP 36 3HB ASP 36 -13.411 -8.248 11.312 309 H GLU 37 H GLU 37 -11.385 -7.821 8.755 310 HA GLU 37 HA GLU 37 -9.270 -7.404 10.534 311 HB2 GLU 37 2HB GLU 37 -9.263 -7.707 7.505 312 HB3 GLU 37 3HB GLU 37 -7.781 -7.703 8.461 313 HG2 GLU 37 2HG GLU 37 -10.027 -9.671 8.971 314 HG3 GLU 37 3HG GLU 37 -8.762 -9.969 7.781 315 H LEU 38 H LEU 38 -10.314 -5.455 7.767 316 HA LEU 38 HA LEU 38 -8.332 -3.509 7.676 317 HB2 LEU 38 2HB LEU 38 -9.985 -3.790 5.898 318 HB3 LEU 38 3HB LEU 38 -11.282 -3.319 6.983 319 HG LEU 38 HG LEU 38 -10.169 -1.015 7.156 320 HD11 LEU 38 1HD1 LEU 38 -7.937 -1.628 6.428 321 HD12 LEU 38 2HD1 LEU 38 -8.602 -0.355 5.408 322 HD13 LEU 38 3HD1 LEU 38 -8.543 -2.016 4.813 323 HD21 LEU 38 3HD2 LEU 38 -11.078 -0.191 5.036 324 HD22 LEU 38 1HD2 LEU 38 -12.168 -1.350 5.792 325 HD23 LEU 38 2HD2 LEU 38 -11.174 -1.843 4.418 326 H LYS 39 H LYS 39 -11.562 -3.236 9.271 327 HA LYS 39 HA LYS 39 -10.997 -0.660 10.320 328 HB2 LYS 39 2HB LYS 39 -13.115 -0.893 11.602 329 HB3 LYS 39 3HB LYS 39 -13.289 -1.236 9.893 330 HG2 LYS 39 2HG LYS 39 -14.606 -2.896 10.814 331 HG3 LYS 39 3HG LYS 39 -13.073 -3.747 10.626 332 HD2 LYS 39 2HD LYS 39 -12.574 -3.339 13.033 333 HD3 LYS 39 3HD LYS 39 -14.122 -2.505 13.205 334 HE2 LYS 39 2HE LYS 39 -13.739 -5.427 12.469 335 HE3 LYS 39 3HE LYS 39 -14.257 -4.811 14.038 336 HZ1 LYS 39 3HZ LYS 39 -16.114 -5.609 12.671 337 HZ2 LYS 39 1HZ LYS 39 -15.762 -4.444 11.497 338 HZ3 LYS 39 2HZ LYS 39 -16.266 -3.963 13.039 339 H LYS 40 H LYS 40 -10.638 -3.924 11.661 340 HA LYS 40 HA LYS 40 -10.185 -3.348 14.359 341 HB2 LYS 40 2HB LYS 40 -9.183 -5.551 12.539 342 HB3 LYS 40 3HB LYS 40 -8.642 -5.488 14.211 343 HG2 LYS 40 2HG LYS 40 -11.566 -5.626 13.392 344 HG3 LYS 40 3HG LYS 40 -10.578 -7.045 13.745 345 HD2 LYS 40 2HD LYS 40 -11.199 -4.789 15.693 346 HD3 LYS 40 3HD LYS 40 -11.968 -6.382 15.673 347 HE2 LYS 40 2HE LYS 40 -9.030 -5.813 16.217 348 HE3 LYS 40 3HE LYS 40 -10.239 -6.303 17.400 349 HZ1 LYS 40 3HZ LYS 40 -8.851 -8.157 16.704 350 HZ2 LYS 40 1HZ LYS 40 -9.331 -7.956 15.098 351 HZ3 LYS 40 2HZ LYS 40 -10.458 -8.421 16.269 352 H GLU 41 H GLU 41 -7.790 -3.534 11.689 353 HA GLU 41 HA GLU 41 -5.594 -2.788 13.387 354 HB2 GLU 41 2HB GLU 41 -4.255 -2.767 11.331 355 HB3 GLU 41 3HB GLU 41 -5.237 -4.226 11.448 356 HG2 GLU 41 2HG GLU 41 -6.916 -2.986 9.926 357 HG3 GLU 41 3HG GLU 41 -5.600 -1.858 9.599 358 H MET 42 H MET 42 -7.915 -1.014 11.401 359 HA MET 42 HA MET 42 -6.542 1.451 11.205 360 HB2 MET 42 2HB MET 42 -9.497 0.776 11.148 361 HB3 MET 42 3HB MET 42 -8.954 2.441 11.029 362 HG2 MET 42 2HG MET 42 -7.774 0.473 9.103 363 HG3 MET 42 3HG MET 42 -9.448 0.957 8.863 364 HE1 MET 42 3HE MET 42 -5.863 3.910 8.636 365 HE2 MET 42 1HE MET 42 -5.668 2.169 8.827 366 HE3 MET 42 2HE MET 42 -6.306 3.138 10.156 367 H LYS 43 H LYS 43 -8.695 0.191 13.769 368 HA LYS 43 HA LYS 43 -8.670 2.437 15.482 369 HB2 LYS 43 2HB LYS 43 -9.055 -0.521 16.010 370 HB3 LYS 43 3HB LYS 43 -8.896 0.576 17.368 371 HG2 LYS 43 2HG LYS 43 -11.207 0.328 17.107 372 HG3 LYS 43 3HG LYS 43 -10.862 1.892 16.367 373 HD2 LYS 43 2HD LYS 43 -11.054 0.962 14.150 374 HD3 LYS 43 3HD LYS 43 -11.116 -0.684 14.780 375 HE2 LYS 43 2HE LYS 43 -13.342 -0.024 14.113 376 HE3 LYS 43 3HE LYS 43 -13.300 -0.135 15.872 377 HZ1 LYS 43 3HZ LYS 43 -14.484 1.831 15.056 378 HZ2 LYS 43 1HZ LYS 43 -13.062 2.393 14.329 379 HZ3 LYS 43 2HZ LYS 43 -13.154 2.244 16.012 380 H LYS 44 H LYS 44 -6.352 -0.185 15.016 381 HA LYS 44 HA LYS 44 -4.666 0.416 17.256 382 HB2 LYS 44 2HB LYS 44 -3.971 -1.148 14.735 383 HB3 LYS 44 3HB LYS 44 -3.096 -1.199 16.262 384 HG2 LYS 44 2HG LYS 44 -5.983 -2.105 15.997 385 HG3 LYS 44 3HG LYS 44 -4.623 -3.182 15.712 386 HD2 LYS 44 2HD LYS 44 -5.278 -3.631 17.939 387 HD3 LYS 44 3HD LYS 44 -3.854 -2.609 18.109 388 HE2 LYS 44 2HE LYS 44 -5.315 -0.667 18.578 389 HE3 LYS 44 3HE LYS 44 -6.739 -1.682 18.354 390 HZ1 LYS 44 3HZ LYS 44 -6.146 -1.347 20.686 391 HZ2 LYS 44 1HZ LYS 44 -4.667 -2.122 20.431 392 HZ3 LYS 44 2HZ LYS 44 -6.115 -2.974 20.249 393 H LEU 45 H LEU 45 -4.716 1.378 13.862 394 HA LEU 45 HA LEU 45 -2.135 2.655 13.889 395 HB2 LEU 45 2HB LEU 45 -4.398 2.916 11.866 396 HB3 LEU 45 3HB LEU 45 -2.736 3.444 11.622 397 HG LEU 45 HG LEU 45 -3.705 0.577 11.899 398 HD11 LEU 45 1HD1 LEU 45 -4.172 1.481 9.714 399 HD12 LEU 45 2HD1 LEU 45 -2.910 0.259 9.621 400 HD13 LEU 45 3HD1 LEU 45 -2.487 1.972 9.522 401 HD21 LEU 45 3HD2 LEU 45 -0.853 1.524 11.592 402 HD22 LEU 45 1HD2 LEU 45 -1.409 -0.154 11.537 403 HD23 LEU 45 2HD2 LEU 45 -1.561 0.773 13.024 404 H ALA 46 H ALA 46 -5.364 3.575 14.718 405 HA ALA 46 HA ALA 46 -4.893 6.450 14.692 406 HB1 ALA 46 3HB ALA 46 -7.230 4.825 15.735 407 HB2 ALA 46 1HB ALA 46 -7.093 5.517 14.115 408 HB3 ALA 46 2HB ALA 46 -7.197 6.577 15.522 409 H GLU 47 H GLU 47 -5.407 3.934 17.184 410 HA GLU 47 HA GLU 47 -5.218 5.835 19.372 411 HB2 GLU 47 2HB GLU 47 -5.637 2.820 19.331 412 HB3 GLU 47 3HB GLU 47 -5.626 3.789 20.808 413 HG2 GLU 47 2HG GLU 47 -7.578 5.034 20.068 414 HG3 GLU 47 3HG GLU 47 -7.546 4.234 18.498 415 H GLU 48 H GLU 48 -3.384 2.896 18.423 416 HA GLU 48 HA GLU 48 -1.172 3.479 20.181 417 HB2 GLU 48 2HB GLU 48 -1.761 1.154 19.413 418 HB3 GLU 48 3HB GLU 48 -1.274 1.599 17.784 419 HG2 GLU 48 2HG GLU 48 1.035 2.084 18.704 420 HG3 GLU 48 3HG GLU 48 0.495 1.394 20.235 421 H LYS 49 H LYS 49 -0.249 5.411 19.778 422 HA LYS 49 HA LYS 49 -0.018 6.525 17.087 423 HB2 LYS 49 2HB LYS 49 0.575 7.676 19.843 424 HB3 LYS 49 3HB LYS 49 0.712 8.587 18.341 425 HG2 LYS 49 2HG LYS 49 -1.670 8.375 17.924 426 HG3 LYS 49 3HG LYS 49 -1.865 7.303 19.307 427 HD2 LYS 49 2HD LYS 49 -2.682 9.471 19.941 428 HD3 LYS 49 3HD LYS 49 -1.170 9.205 20.804 429 HE2 LYS 49 2HE LYS 49 -1.340 10.814 18.232 430 HE3 LYS 49 3HE LYS 49 -1.526 11.536 19.827 431 HZ1 LYS 49 3HZ LYS 49 0.720 10.693 20.369 432 HZ2 LYS 49 1HZ LYS 49 0.709 11.817 19.109 433 HZ3 LYS 49 2HZ LYS 49 0.893 10.177 18.769 434 H ASN 50 H ASN 50 1.743 4.243 18.027 435 HA ASN 50 HA ASN 50 4.428 5.143 18.148 436 HB2 ASN 50 2HB ASN 50 3.288 2.450 17.263 437 HB3 ASN 50 3HB ASN 50 5.006 2.771 17.473 438 HD21 ASN 50 1HD2 ASN 50 5.340 1.308 19.093 439 HD22 ASN 50 2HD2 ASN 50 4.647 1.447 20.669 440 H PHE 51 H PHE 51 5.852 5.646 16.554 441 HA PHE 51 HA PHE 51 5.066 5.836 13.798 442 HB2 PHE 51 2HB PHE 51 6.718 7.419 14.649 443 HB3 PHE 51 3HB PHE 51 7.787 6.115 15.157 444 HD1 PHE 51 HD2 PHE 51 6.236 7.658 12.109 445 HD2 PHE 51 HD1 PHE 51 9.453 5.295 13.663 446 HE1 PHE 51 HE2 PHE 51 7.338 7.691 9.917 447 HE2 PHE 51 HE1 PHE 51 10.540 5.340 11.467 448 HZ PHE 51 HZ PHE 51 9.487 6.531 9.598 449 H GLU 52 H GLU 52 4.670 3.968 12.732 450 HA GLU 52 HA GLU 52 6.686 1.807 12.839 451 HB2 GLU 52 2HB GLU 52 4.660 1.163 14.166 452 HB3 GLU 52 3HB GLU 52 3.668 1.382 12.729 453 HG2 GLU 52 2HG GLU 52 4.092 -0.980 13.013 454 HG3 GLU 52 3HG GLU 52 4.965 -0.427 11.587 455 H LYS 53 H LYS 53 7.252 0.955 10.971 456 HA LYS 53 HA LYS 53 6.182 1.973 8.430 457 HB2 LYS 53 2HB LYS 53 8.548 0.120 8.970 458 HB3 LYS 53 3HB LYS 53 8.179 0.936 7.453 459 HG2 LYS 53 2HG LYS 53 8.695 3.108 8.438 460 HG3 LYS 53 3HG LYS 53 8.935 2.372 10.027 461 HD2 LYS 53 2HD LYS 53 10.634 1.927 7.540 462 HD3 LYS 53 3HD LYS 53 11.097 2.833 8.983 463 HE2 LYS 53 2HE LYS 53 10.574 -0.167 8.839 464 HE3 LYS 53 3HE LYS 53 12.143 0.619 9.004 465 HZ1 LYS 53 3HZ LYS 53 11.361 -0.202 11.126 466 HZ2 LYS 53 1HZ LYS 53 9.942 0.711 11.000 467 HZ3 LYS 53 2HZ LYS 53 11.431 1.488 11.155 468 H ILE 54 H ILE 54 4.503 0.753 7.585 469 HA ILE 54 HA ILE 54 4.346 -2.142 8.213 470 HB ILE 54 HB ILE 54 1.985 -0.204 8.042 471 HG12 ILE 54 2HG1 ILE 54 3.164 -1.604 10.482 472 HG13 ILE 54 3HG1 ILE 54 3.342 0.106 10.109 473 HG21 ILE 54 1HG2 ILE 54 1.378 -2.464 7.266 474 HG22 ILE 54 2HG2 ILE 54 0.601 -2.115 8.809 475 HG23 ILE 54 3HG2 ILE 54 2.019 -3.164 8.755 476 HD11 ILE 54 3HD1 ILE 54 1.688 -0.233 11.818 477 HD12 ILE 54 1HD1 ILE 54 0.766 -1.311 10.772 478 HD13 ILE 54 2HD1 ILE 54 0.924 0.401 10.361 479 H LEU 55 H LEU 55 4.264 -3.409 6.427 480 HA LEU 55 HA LEU 55 3.334 -2.363 3.847 481 HB2 LEU 55 2HB LEU 55 5.287 -3.998 4.025 482 HB3 LEU 55 3HB LEU 55 4.134 -5.221 4.537 483 HG LEU 55 HG LEU 55 2.886 -4.760 2.304 484 HD11 LEU 55 1HD1 LEU 55 4.259 -3.819 0.483 485 HD12 LEU 55 2HD1 LEU 55 5.490 -3.364 1.661 486 HD13 LEU 55 3HD1 LEU 55 3.880 -2.645 1.738 487 HD21 LEU 55 3HD2 LEU 55 4.166 -6.812 2.655 488 HD22 LEU 55 1HD2 LEU 55 5.645 -6.000 2.134 489 HD23 LEU 55 2HD2 LEU 55 4.320 -6.245 0.994 490 H ILE 56 H ILE 56 1.318 -2.895 2.998 491 HA ILE 56 HA ILE 56 -0.478 -4.648 4.573 492 HB ILE 56 HB ILE 56 -1.168 -2.241 2.840 493 HG12 ILE 56 2HG1 ILE 56 -0.284 -1.615 5.076 494 HG13 ILE 56 3HG1 ILE 56 -1.986 -1.193 4.935 495 HG21 ILE 56 1HG2 ILE 56 -2.889 -3.952 2.541 496 HG22 ILE 56 2HG2 ILE 56 -3.533 -2.610 3.489 497 HG23 ILE 56 3HG2 ILE 56 -3.067 -4.113 4.289 498 HD11 ILE 56 3HD1 ILE 56 -2.568 -3.170 6.267 499 HD12 ILE 56 1HD1 ILE 56 -1.477 -2.076 7.114 500 HD13 ILE 56 2HD1 ILE 56 -0.850 -3.565 6.408 501 H LYS 57 H LYS 57 -0.879 -6.510 3.586 502 HA LYS 57 HA LYS 57 -0.783 -6.806 0.673 503 HB2 LYS 57 2HB LYS 57 0.525 -8.409 1.965 504 HB3 LYS 57 3HB LYS 57 -0.847 -8.793 2.988 505 HG2 LYS 57 2HG LYS 57 -1.115 -9.337 0.044 506 HG3 LYS 57 3HG LYS 57 -0.045 -10.387 0.972 507 HD2 LYS 57 2HD LYS 57 -1.969 -10.876 2.522 508 HD3 LYS 57 3HD LYS 57 -3.010 -9.911 1.472 509 HE2 LYS 57 2HE LYS 57 -1.529 -12.436 0.664 510 HE3 LYS 57 3HE LYS 57 -3.253 -12.318 1.018 511 HZ1 LYS 57 3HZ LYS 57 -1.819 -11.006 -1.232 512 HZ2 LYS 57 1HZ LYS 57 -3.452 -10.761 -0.868 513 HZ3 LYS 57 2HZ LYS 57 -2.905 -12.288 -1.341 514 H SER 58 H SER 58 -2.675 -6.438 -0.317 515 HA SER 58 HA SER 58 -5.082 -7.817 0.501 516 HB2 SER 58 2HB SER 58 -5.231 -5.706 1.839 517 HB3 SER 58 3HB SER 58 -5.097 -4.762 0.357 518 HG SER 58 HG SER 58 -7.228 -6.285 1.330 519 H ASN 59 H ASN 59 -6.847 -7.386 -1.176 520 HA ASN 59 HA ASN 59 -5.810 -6.699 -3.866 521 HB2 ASN 59 2HB ASN 59 -5.793 -9.207 -3.547 522 HB3 ASN 59 3HB ASN 59 -7.527 -9.157 -3.256 523 HD21 ASN 59 1HD2 ASN 59 -8.010 -10.471 -5.010 524 HD22 ASN 59 2HD2 ASN 59 -7.833 -9.965 -6.652 525 H ASP 60 H ASP 60 -8.496 -6.963 -1.608 526 HA ASP 60 HA ASP 60 -10.533 -6.000 -3.359 527 HB2 ASP 60 2HB ASP 60 -10.354 -6.198 -0.332 528 HB3 ASP 60 3HB ASP 60 -11.753 -5.485 -1.130 529 H LYS 61 H LYS 61 -10.031 -4.183 -4.361 530 HA LYS 61 HA LYS 61 -8.611 -1.964 -3.648 531 HB2 LYS 61 2HB LYS 61 -9.969 -0.752 -5.387 532 HB3 LYS 61 3HB LYS 61 -9.327 -2.304 -5.914 533 HG2 LYS 61 2HG LYS 61 -11.501 -3.377 -5.635 534 HG3 LYS 61 3HG LYS 61 -12.179 -1.914 -4.919 535 HD2 LYS 61 2HD LYS 61 -11.167 -2.142 -7.782 536 HD3 LYS 61 3HD LYS 61 -12.860 -2.259 -7.294 537 HE2 LYS 61 2HE LYS 61 -12.696 0.062 -6.353 538 HE3 LYS 61 3HE LYS 61 -11.054 0.168 -6.999 539 HZ1 LYS 61 3HZ LYS 61 -13.540 -0.219 -8.572 540 HZ2 LYS 61 1HZ LYS 61 -11.972 -0.204 -9.207 541 HZ3 LYS 61 2HZ LYS 61 -12.602 1.184 -8.489 542 H GLN 62 H GLN 62 -11.903 -2.716 -2.676 543 HA GLN 62 HA GLN 62 -12.832 -0.178 -1.872 544 HB2 GLN 62 2HB GLN 62 -13.527 -2.968 -0.843 545 HB3 GLN 62 3HB GLN 62 -14.391 -1.506 -0.366 546 HG2 GLN 62 2HG GLN 62 -15.137 -1.141 -2.660 547 HG3 GLN 62 3HG GLN 62 -14.181 -2.517 -3.218 548 HE21 GLN 62 1HE2 GLN 62 -17.043 -1.557 -1.425 549 HE22 GLN 62 2HE2 GLN 62 -17.804 -3.108 -1.440 550 H LEU 63 H LEU 63 -11.100 -2.762 -0.127 551 HA LEU 63 HA LEU 63 -11.163 -1.638 2.447 552 HB2 LEU 63 2HB LEU 63 -9.102 -3.569 1.315 553 HB3 LEU 63 3HB LEU 63 -9.384 -3.257 3.025 554 HG LEU 63 HG LEU 63 -11.264 -4.648 1.080 555 HD11 LEU 63 1HD1 LEU 63 -10.979 -6.596 2.529 556 HD12 LEU 63 2HD1 LEU 63 -9.844 -5.696 3.539 557 HD13 LEU 63 3HD1 LEU 63 -9.441 -6.057 1.857 558 HD21 LEU 63 3HD2 LEU 63 -11.804 -3.916 3.976 559 HD22 LEU 63 1HD2 LEU 63 -12.811 -4.969 2.971 560 HD23 LEU 63 2HD2 LEU 63 -12.624 -3.271 2.552 561 H LEU 64 H LEU 64 -8.760 -1.337 -0.159 562 HA LEU 64 HA LEU 64 -6.771 -0.048 1.428 563 HB2 LEU 64 2HB LEU 64 -7.094 -0.174 -1.587 564 HB3 LEU 64 3HB LEU 64 -5.733 0.596 -0.787 565 HG LEU 64 HG LEU 64 -5.378 -1.759 0.354 566 HD11 LEU 64 1HD1 LEU 64 -7.449 -2.802 -0.378 567 HD12 LEU 64 2HD1 LEU 64 -6.054 -3.675 -1.008 568 HD13 LEU 64 3HD1 LEU 64 -6.979 -2.605 -2.068 569 HD21 LEU 64 3HD2 LEU 64 -4.729 -1.422 -2.577 570 HD22 LEU 64 1HD2 LEU 64 -3.889 -2.453 -1.412 571 HD23 LEU 64 2HD2 LEU 64 -3.832 -0.701 -1.246 572 H LYS 65 H LYS 65 -9.382 1.151 -0.685 573 HA LYS 65 HA LYS 65 -8.575 3.891 -0.528 574 HB2 LYS 65 2HB LYS 65 -10.041 2.925 -2.354 575 HB3 LYS 65 3HB LYS 65 -11.362 2.853 -1.191 576 HG2 LYS 65 2HG LYS 65 -11.267 5.285 -0.891 577 HG3 LYS 65 3HG LYS 65 -9.882 5.382 -1.983 578 HD2 LYS 65 2HD LYS 65 -11.364 4.486 -3.820 579 HD3 LYS 65 3HD LYS 65 -12.731 4.598 -2.698 580 HE2 LYS 65 2HE LYS 65 -10.998 6.909 -3.661 581 HE3 LYS 65 3HE LYS 65 -12.659 6.575 -4.152 582 HZ1 LYS 65 3HZ LYS 65 -11.773 7.296 -1.398 583 HZ2 LYS 65 1HZ LYS 65 -13.366 6.969 -1.866 584 HZ3 LYS 65 2HZ LYS 65 -12.567 8.317 -2.492 585 H GLU 66 H GLU 66 -10.992 1.904 1.141 586 HA GLU 66 HA GLU 66 -12.106 3.859 2.810 587 HB2 GLU 66 2HB GLU 66 -11.897 0.847 3.155 588 HB3 GLU 66 3HB GLU 66 -12.827 1.881 4.239 589 HG2 GLU 66 2HG GLU 66 -13.322 1.531 1.263 590 HG3 GLU 66 3HG GLU 66 -14.250 0.781 2.557 591 H MET 67 H MET 67 -9.181 1.939 3.121 592 HA MET 67 HA MET 67 -8.560 2.543 5.816 593 HB2 MET 67 2HB MET 67 -7.423 0.777 4.359 594 HB3 MET 67 3HB MET 67 -6.552 2.082 3.562 595 HG2 MET 67 2HG MET 67 -5.623 2.728 5.805 596 HG3 MET 67 3HG MET 67 -6.386 1.294 6.480 597 HE1 MET 67 3HE MET 67 -5.602 -1.180 5.989 598 HE2 MET 67 1HE MET 67 -4.361 -1.595 4.806 599 HE3 MET 67 2HE MET 67 -5.910 -0.952 4.265 600 H LEU 68 H LEU 68 -7.743 4.099 2.714 601 HA LEU 68 HA LEU 68 -6.130 6.196 3.785 602 HB2 LEU 68 2HB LEU 68 -7.452 5.852 1.074 603 HB3 LEU 68 3HB LEU 68 -6.325 7.152 1.450 604 HG LEU 68 HG LEU 68 -5.609 4.193 1.601 605 HD11 LEU 68 1HD1 LEU 68 -4.368 4.501 -0.474 606 HD12 LEU 68 2HD1 LEU 68 -4.967 6.158 -0.608 607 HD13 LEU 68 3HD1 LEU 68 -6.090 4.797 -0.710 608 HD21 LEU 68 3HD2 LEU 68 -3.843 6.659 1.710 609 HD22 LEU 68 1HD2 LEU 68 -3.291 4.979 1.714 610 HD23 LEU 68 2HD2 LEU 68 -4.235 5.597 3.066 611 H GLU 69 H GLU 69 -9.584 5.904 3.262 612 HA GLU 69 HA GLU 69 -10.320 8.643 3.385 613 HB2 GLU 69 2HB GLU 69 -11.912 6.277 4.492 614 HB3 GLU 69 3HB GLU 69 -12.562 7.857 4.058 615 HG2 GLU 69 2HG GLU 69 -11.386 5.839 2.119 616 HG3 GLU 69 3HG GLU 69 -13.098 6.083 2.418 617 H LEU 70 H LEU 70 -9.675 6.171 5.831 618 HA LEU 70 HA LEU 70 -10.346 7.854 8.102 619 HB2 LEU 70 2HB LEU 70 -9.051 5.098 8.051 620 HB3 LEU 70 3HB LEU 70 -9.757 5.889 9.456 621 HG LEU 70 HG LEU 70 -11.242 4.838 7.011 622 HD11 LEU 70 1HD1 LEU 70 -12.327 3.302 8.568 623 HD12 LEU 70 2HD1 LEU 70 -11.353 3.935 9.899 624 HD13 LEU 70 3HD1 LEU 70 -10.579 3.083 8.561 625 HD21 LEU 70 3HD2 LEU 70 -12.303 6.916 7.724 626 HD22 LEU 70 1HD2 LEU 70 -12.411 6.323 9.386 627 HD23 LEU 70 2HD2 LEU 70 -13.328 5.535 8.096 628 H ILE 71 H ILE 71 -7.436 6.772 6.415 629 HA ILE 71 HA ILE 71 -5.499 7.643 8.326 630 HB ILE 71 HB ILE 71 -5.252 7.068 5.338 631 HG12 ILE 71 2HG1 ILE 71 -4.322 5.480 7.774 632 HG13 ILE 71 3HG1 ILE 71 -5.723 5.101 6.782 633 HG21 ILE 71 1HG2 ILE 71 -2.966 7.652 7.261 634 HG22 ILE 71 2HG2 ILE 71 -3.499 8.699 5.946 635 HG23 ILE 71 3HG2 ILE 71 -2.795 7.127 5.584 636 HD11 ILE 71 3HD1 ILE 71 -4.220 4.711 4.863 637 HD12 ILE 71 1HD1 ILE 71 -3.905 3.642 6.231 638 HD13 ILE 71 2HD1 ILE 71 -2.838 5.008 5.921 639 H SER 72 H SER 72 -7.170 9.214 5.630 640 HA SER 72 HA SER 72 -5.661 11.589 5.491 641 HB2 SER 72 2HB SER 72 -7.290 10.896 3.751 642 HB3 SER 72 3HB SER 72 -8.617 11.200 4.870 643 HG SER 72 HG SER 72 -6.784 13.259 4.383 644 H LYS 73 H LYS 73 -8.046 10.507 7.778 645 HA LYS 73 HA LYS 73 -8.427 13.069 9.076 646 HB2 LYS 73 2HB LYS 73 -9.082 10.269 10.103 647 HB3 LYS 73 3HB LYS 73 -9.717 11.787 10.733 648 HG2 LYS 73 2HG LYS 73 -10.252 10.674 7.958 649 HG3 LYS 73 3HG LYS 73 -11.351 10.535 9.330 650 HD2 LYS 73 2HD LYS 73 -10.441 13.264 8.356 651 HD3 LYS 73 3HD LYS 73 -11.740 12.407 7.532 652 HE2 LYS 73 2HE LYS 73 -12.678 13.974 9.132 653 HE3 LYS 73 3HE LYS 73 -13.024 12.328 9.645 654 HZ1 LYS 73 3HZ LYS 73 -12.349 13.826 11.460 655 HZ2 LYS 73 1HZ LYS 73 -10.830 13.993 10.744 656 HZ3 LYS 73 2HZ LYS 73 -11.332 12.483 11.316 657 H LEU 74 H LEU 74 -6.453 10.145 9.522 658 HA LEU 74 HA LEU 74 -5.398 10.800 12.103 659 HB2 LEU 74 2HB LEU 74 -4.371 8.820 10.030 660 HB3 LEU 74 3HB LEU 74 -3.871 8.879 11.718 661 HG LEU 74 HG LEU 74 -6.649 8.174 10.692 662 HD11 LEU 74 1HD1 LEU 74 -5.041 6.381 10.323 663 HD12 LEU 74 2HD1 LEU 74 -6.213 5.933 11.558 664 HD13 LEU 74 3HD1 LEU 74 -4.580 6.411 12.029 665 HD21 LEU 74 3HD2 LEU 74 -7.232 7.691 13.028 666 HD22 LEU 74 1HD2 LEU 74 -6.844 9.391 12.790 667 HD23 LEU 74 2HD2 LEU 74 -5.669 8.318 13.557 668 H GLY 75 H GLY 75 -4.347 11.425 8.831 669 HA2 GLY 75 2HA GLY 75 -2.883 12.941 7.981 670 HA3 GLY 75 3HA GLY 75 -2.583 13.517 9.610 671 H TYR 76 H TYR 76 -1.820 10.728 7.464 672 HA TYR 76 HA TYR 76 0.988 11.323 7.767 673 HB2 TYR 76 2HB TYR 76 1.739 9.056 8.389 674 HB3 TYR 76 3HB TYR 76 0.808 9.815 9.658 675 HD1 TYR 76 HD2 TYR 76 0.803 7.098 7.132 676 HD2 TYR 76 HD1 TYR 76 -1.287 8.832 10.439 677 HE1 TYR 76 HE2 TYR 76 -0.534 5.051 7.372 678 HE2 TYR 76 HE1 TYR 76 -2.610 6.776 10.679 679 HH TYR 76 HH TYR 76 -3.324 4.857 9.227 680 H LYS 77 H LYS 77 2.356 10.098 6.277 681 HA LYS 77 HA LYS 77 1.036 10.140 3.689 682 HB2 LYS 77 2HB LYS 77 3.427 11.162 4.506 683 HB3 LYS 77 3HB LYS 77 3.999 9.607 3.928 684 HG2 LYS 77 2HG LYS 77 2.453 11.646 2.292 685 HG3 LYS 77 3HG LYS 77 4.200 11.406 2.245 686 HD2 LYS 77 2HD LYS 77 3.773 9.047 1.432 687 HD3 LYS 77 3HD LYS 77 2.052 9.440 1.352 688 HE2 LYS 77 2HE LYS 77 4.281 10.755 -0.248 689 HE3 LYS 77 3HE LYS 77 3.054 9.647 -0.863 690 HZ1 LYS 77 3HZ LYS 77 1.355 11.294 -0.297 691 HZ2 LYS 77 1HZ LYS 77 2.486 11.923 -1.384 692 HZ3 LYS 77 2HZ LYS 77 2.547 12.360 0.246 693 H VAL 78 H VAL 78 0.594 8.405 2.522 694 HA VAL 78 HA VAL 78 1.739 5.754 3.164 695 HB VAL 78 HB VAL 78 -1.164 6.368 2.404 696 HG11 VAL 78 1HG1 VAL 78 -1.604 3.949 2.731 697 HG12 VAL 78 2HG1 VAL 78 0.121 3.670 2.985 698 HG13 VAL 78 3HG1 VAL 78 -0.460 4.224 1.415 699 HG21 VAL 78 3HG2 VAL 78 -0.019 5.313 5.013 700 HG22 VAL 78 1HG2 VAL 78 -1.732 5.535 4.651 701 HG23 VAL 78 2HG2 VAL 78 -0.666 6.936 4.744 702 H PHE 79 H PHE 79 2.302 4.537 1.439 703 HA PHE 79 HA PHE 79 2.159 5.627 -1.283 704 HB2 PHE 79 2HB PHE 79 3.740 3.277 -0.143 705 HB3 PHE 79 3HB PHE 79 3.862 3.884 -1.791 706 HD1 PHE 79 HD1 PHE 79 4.591 6.380 -2.058 707 HD2 PHE 79 HD2 PHE 79 5.241 4.093 1.502 708 HE1 PHE 79 HE1 PHE 79 6.403 7.902 -1.404 709 HE2 PHE 79 HE2 PHE 79 7.048 5.626 2.146 710 HZ PHE 79 HZ PHE 79 7.630 7.528 0.695 711 H LEU 80 H LEU 80 1.529 4.129 -3.012 712 HA LEU 80 HA LEU 80 0.092 1.677 -2.299 713 HB2 LEU 80 2HB LEU 80 -1.683 3.314 -2.208 714 HB3 LEU 80 3HB LEU 80 -1.159 4.068 -3.701 715 HG LEU 80 HG LEU 80 -1.937 2.098 -4.998 716 HD11 LEU 80 1HD1 LEU 80 -2.914 0.958 -2.374 717 HD12 LEU 80 2HD1 LEU 80 -1.583 0.334 -3.351 718 HD13 LEU 80 3HD1 LEU 80 -3.226 0.299 -3.983 719 HD21 LEU 80 3HD2 LEU 80 -4.344 2.405 -4.722 720 HD22 LEU 80 1HD2 LEU 80 -3.496 3.946 -4.624 721 HD23 LEU 80 2HD2 LEU 80 -4.087 3.173 -3.151 722 H LEU 81 H LEU 81 0.140 0.166 -3.880 723 HA LEU 81 HA LEU 81 1.324 0.799 -6.505 724 HB2 LEU 81 2HB LEU 81 3.068 -0.162 -5.016 725 HB3 LEU 81 3HB LEU 81 2.047 -1.558 -4.716 726 HG LEU 81 HG LEU 81 2.228 -2.217 -7.115 727 HD11 LEU 81 1HD1 LEU 81 2.498 -0.045 -8.144 728 HD12 LEU 81 2HD1 LEU 81 3.847 -1.084 -8.590 729 HD13 LEU 81 3HD1 LEU 81 4.071 0.172 -7.371 730 HD21 LEU 81 3HD2 LEU 81 3.820 -3.155 -5.510 731 HD22 LEU 81 1HD2 LEU 81 4.924 -1.803 -5.784 732 HD23 LEU 81 2HD2 LEU 81 4.571 -2.941 -7.088 733 H LEU 82 H LEU 82 -0.047 0.198 -8.023 734 HA LEU 82 HA LEU 82 -2.029 -1.956 -7.585 735 HB2 LEU 82 2HB LEU 82 -2.093 0.434 -9.474 736 HB3 LEU 82 3HB LEU 82 -3.346 -0.792 -9.355 737 HG LEU 82 HG LEU 82 -2.585 1.147 -7.132 738 HD11 LEU 82 1HD1 LEU 82 -4.672 2.282 -7.590 739 HD12 LEU 82 2HD1 LEU 82 -5.033 1.170 -8.914 740 HD13 LEU 82 3HD1 LEU 82 -3.660 2.277 -9.030 741 HD21 LEU 82 3HD2 LEU 82 -4.610 0.337 -5.992 742 HD22 LEU 82 1HD2 LEU 82 -3.439 -0.957 -6.225 743 HD23 LEU 82 2HD2 LEU 82 -4.861 -0.860 -7.268 744 H ALA 83 H ALA 83 -1.166 -3.769 -8.457 745 HA ALA 83 HA ALA 83 0.276 -3.605 -11.053 746 HB1 ALA 83 3HB ALA 83 1.569 -5.557 -10.337 747 HB2 ALA 83 1HB ALA 83 0.690 -5.599 -8.812 748 HB3 ALA 83 2HB ALA 83 1.736 -4.233 -9.182 749 H ASP 84 H ASP 84 -0.994 -4.257 -12.624 750 HA ASP 84 HA ASP 84 -1.921 -6.928 -12.834 751 HB2 ASP 84 2HB ASP 84 -3.814 -6.044 -11.450 752 HB3 ASP 84 3HB ASP 84 -4.114 -4.796 -12.656 753 H GLN 85 H GLN 85 -2.755 -7.390 -14.985 754 HA GLN 85 HA GLN 85 -1.471 -6.078 -17.106 755 HB2 GLN 85 2HB GLN 85 -2.369 -8.489 -16.972 756 HB3 GLN 85 3HB GLN 85 -3.955 -7.839 -17.336 757 HG2 GLN 85 2HG GLN 85 -1.572 -7.505 -19.166 758 HG3 GLN 85 3HG GLN 85 -2.651 -8.892 -19.249 759 HE21 GLN 85 1HE2 GLN 85 -2.089 -6.960 -21.311 760 HE22 GLN 85 2HE2 GLN 85 -3.597 -6.233 -21.737 761 H ASP 86 H ASP 86 -4.844 -5.909 -15.968 762 HA ASP 86 HA ASP 86 -5.608 -3.915 -17.950 763 HB2 ASP 86 2HB ASP 86 -7.237 -5.683 -17.239 764 HB3 ASP 86 3HB ASP 86 -7.211 -5.040 -15.602 765 H GLU 87 H GLU 87 -4.678 -2.002 -17.604 766 HA GLU 87 HA GLU 87 -4.391 -0.827 -14.947 767 HB2 GLU 87 2HB GLU 87 -3.201 0.988 -16.090 768 HB3 GLU 87 3HB GLU 87 -2.539 -0.586 -16.509 769 HG2 GLU 87 2HG GLU 87 -3.626 -0.515 -18.686 770 HG3 GLU 87 3HG GLU 87 -4.432 1.000 -18.269 771 H ASN 88 H ASN 88 -6.757 -0.847 -17.382 772 HA ASN 88 HA ASN 88 -7.776 1.769 -17.407 773 HB2 ASN 88 2HB ASN 88 -8.487 0.040 -19.022 774 HB3 ASN 88 3HB ASN 88 -9.264 -0.879 -17.739 775 HD21 ASN 88 1HD2 ASN 88 -11.245 -0.100 -16.863 776 HD22 ASN 88 2HD2 ASN 88 -12.199 1.074 -17.696 777 H GLU 89 H GLU 89 -8.696 -1.007 -15.400 778 HA GLU 89 HA GLU 89 -10.631 0.288 -13.802 779 HB2 GLU 89 2HB GLU 89 -9.944 -2.313 -14.192 780 HB3 GLU 89 3HB GLU 89 -9.092 -2.057 -12.678 781 HG2 GLU 89 2HG GLU 89 -12.065 -1.793 -13.203 782 HG3 GLU 89 3HG GLU 89 -11.259 -3.028 -12.242 783 H LEU 90 H LEU 90 -7.180 -0.376 -13.368 784 HA LEU 90 HA LEU 90 -6.892 0.549 -10.708 785 HB2 LEU 90 2HB LEU 90 -4.796 0.302 -12.899 786 HB3 LEU 90 3HB LEU 90 -4.450 0.490 -11.183 787 HG LEU 90 HG LEU 90 -5.807 -1.913 -12.473 788 HD11 LEU 90 1HD1 LEU 90 -3.760 -3.137 -11.895 789 HD12 LEU 90 2HD1 LEU 90 -3.022 -1.642 -11.316 790 HD13 LEU 90 3HD1 LEU 90 -3.442 -1.821 -13.022 791 HD21 LEU 90 3HD2 LEU 90 -5.039 -1.481 -9.563 792 HD22 LEU 90 1HD2 LEU 90 -5.639 -2.989 -10.263 793 HD23 LEU 90 2HD2 LEU 90 -6.678 -1.571 -10.214 794 H GLU 91 H GLU 91 -6.888 2.227 -13.792 795 HA GLU 91 HA GLU 91 -5.369 4.518 -13.103 796 HB2 GLU 91 2HB GLU 91 -5.886 3.907 -15.470 797 HB3 GLU 91 3HB GLU 91 -7.581 4.296 -15.190 798 HG2 GLU 91 2HG GLU 91 -6.815 6.666 -14.598 799 HG3 GLU 91 3HG GLU 91 -5.223 6.208 -15.194 800 H GLU 92 H GLU 92 -8.888 4.004 -13.307 801 HA GLU 92 HA GLU 92 -9.820 6.492 -12.505 802 HB2 GLU 92 2HB GLU 92 -11.163 4.603 -13.491 803 HB3 GLU 92 3HB GLU 92 -11.105 3.773 -11.945 804 HG2 GLU 92 2HG GLU 92 -12.282 6.551 -12.093 805 HG3 GLU 92 3HG GLU 92 -13.229 5.188 -12.677 806 H PHE 93 H PHE 93 -9.002 3.657 -10.561 807 HA PHE 93 HA PHE 93 -9.715 4.578 -8.006 808 HB2 PHE 93 2HB PHE 93 -9.199 2.189 -8.692 809 HB3 PHE 93 3HB PHE 93 -7.493 2.610 -8.726 810 HD1 PHE 93 HD1 PHE 93 -10.462 2.517 -6.455 811 HD2 PHE 93 HD2 PHE 93 -6.202 2.369 -6.728 812 HE1 PHE 93 HE1 PHE 93 -10.316 1.936 -4.077 813 HE2 PHE 93 HE2 PHE 93 -6.069 1.790 -4.351 814 HZ PHE 93 HZ PHE 93 -8.122 1.573 -3.020 815 H LYS 94 H LYS 94 -6.506 4.566 -9.630 816 HA LYS 94 HA LYS 94 -5.132 5.645 -7.397 817 HB2 LYS 94 2HB LYS 94 -3.143 5.617 -8.760 818 HB3 LYS 94 3HB LYS 94 -4.054 4.153 -9.025 819 HG2 LYS 94 2HG LYS 94 -3.355 4.619 -11.169 820 HG3 LYS 94 3HG LYS 94 -4.939 5.385 -11.166 821 HD2 LYS 94 2HD LYS 94 -3.258 6.814 -12.256 822 HD3 LYS 94 3HD LYS 94 -3.892 7.592 -10.805 823 HE2 LYS 94 2HE LYS 94 -1.843 6.833 -9.564 824 HE3 LYS 94 3HE LYS 94 -1.222 6.166 -11.076 825 HZ1 LYS 94 3HZ LYS 94 -1.876 9.020 -10.610 826 HZ2 LYS 94 1HZ LYS 94 -1.234 8.365 -12.029 827 HZ3 LYS 94 2HZ LYS 94 -0.321 8.360 -10.605 828 H ARG 95 H ARG 95 -6.815 7.194 -10.022 829 HA ARG 95 HA ARG 95 -5.486 9.708 -10.004 830 HB2 ARG 95 2HB ARG 95 -8.326 8.946 -10.793 831 HB3 ARG 95 3HB ARG 95 -7.683 10.577 -10.989 832 HG2 ARG 95 2HG ARG 95 -5.947 9.733 -12.510 833 HG3 ARG 95 3HG ARG 95 -6.547 8.086 -12.303 834 HD2 ARG 95 2HD ARG 95 -7.360 9.042 -14.408 835 HD3 ARG 95 3HD ARG 95 -8.706 8.747 -13.300 836 HE ARG 95 HE ARG 95 -7.810 11.406 -12.974 837 HH11 ARG 95 1HH1 ARG 95 -9.542 9.450 -15.356 838 HH12 ARG 95 2HH1 ARG 95 -10.411 10.808 -16.002 839 HH21 ARG 95 1HH2 ARG 95 -8.954 13.159 -13.838 840 HH22 ARG 95 2HH2 ARG 95 -10.077 12.909 -15.139 841 H LYS 96 H LYS 96 -8.234 8.430 -8.183 842 HA LYS 96 HA LYS 96 -8.853 10.823 -6.748 843 HB2 LYS 96 2HB LYS 96 -9.656 7.912 -6.398 844 HB3 LYS 96 3HB LYS 96 -10.105 9.111 -5.193 845 HG2 LYS 96 2HG LYS 96 -11.947 8.721 -6.756 846 HG3 LYS 96 3HG LYS 96 -11.366 10.383 -6.865 847 HD2 LYS 96 2HD LYS 96 -10.114 9.802 -8.931 848 HD3 LYS 96 3HD LYS 96 -10.693 8.140 -8.808 849 HE2 LYS 96 2HE LYS 96 -12.465 10.576 -9.186 850 HE3 LYS 96 3HE LYS 96 -11.969 9.473 -10.467 851 HZ1 LYS 96 3HZ LYS 96 -13.551 8.712 -8.083 852 HZ2 LYS 96 1HZ LYS 96 -13.118 7.695 -9.357 853 HZ3 LYS 96 2HZ LYS 96 -14.185 8.980 -9.621 854 H ILE 97 H ILE 97 -6.954 7.909 -6.024 855 HA ILE 97 HA ILE 97 -6.310 8.433 -3.333 856 HB ILE 97 HB ILE 97 -4.706 6.851 -5.397 857 HG12 ILE 97 2HG1 ILE 97 -6.947 5.924 -5.280 858 HG13 ILE 97 3HG1 ILE 97 -5.876 4.827 -4.425 859 HG21 ILE 97 1HG2 ILE 97 -3.725 5.632 -3.463 860 HG22 ILE 97 2HG2 ILE 97 -4.550 6.738 -2.363 861 HG23 ILE 97 3HG2 ILE 97 -3.307 7.346 -3.458 862 HD11 ILE 97 3HD1 ILE 97 -7.812 6.788 -3.201 863 HD12 ILE 97 1HD1 ILE 97 -6.697 5.771 -2.289 864 HD13 ILE 97 2HD1 ILE 97 -7.964 5.035 -3.265 865 H GLU 98 H GLU 98 -4.588 9.209 -6.339 866 HA GLU 98 HA GLU 98 -2.292 10.399 -5.179 867 HB2 GLU 98 2HB GLU 98 -2.434 9.459 -7.503 868 HB3 GLU 98 3HB GLU 98 -3.423 10.839 -7.974 869 HG2 GLU 98 2HG GLU 98 -1.560 12.363 -7.503 870 HG3 GLU 98 3HG GLU 98 -0.576 11.016 -6.929 871 H SER 99 H SER 99 -5.438 11.633 -6.139 872 HA SER 99 HA SER 99 -4.819 14.425 -5.889 873 HB2 SER 99 2HB SER 99 -6.686 13.544 -7.306 874 HB3 SER 99 3HB SER 99 -7.543 13.061 -5.842 875 HG SER 99 HG SER 99 -8.102 15.071 -5.515 876 H GLN 100 H GLN 100 -5.773 11.878 -3.677 877 HA GLN 100 HA GLN 100 -6.522 13.581 -1.465 878 HB2 GLN 100 2HB GLN 100 -5.824 10.618 -1.615 879 HB3 GLN 100 3HB GLN 100 -6.338 11.418 -0.130 880 HG2 GLN 100 2HG GLN 100 -8.512 11.943 -1.143 881 HG3 GLN 100 3HG GLN 100 -8.000 11.204 -2.658 882 HE21 GLN 100 1HE2 GLN 100 -8.947 10.571 0.653 883 HE22 GLN 100 2HE2 GLN 100 -9.264 8.884 0.446 884 H GLY 101 H GLY 101 -3.552 12.988 -2.893 885 HA2 GLY 101 2HA GLY 101 -1.527 13.935 -2.247 886 HA3 GLY 101 3HA GLY 101 -2.111 14.102 -0.599 887 H TYR 102 H TYR 102 -2.559 11.030 -2.085 888 HA TYR 102 HA TYR 102 -0.303 9.859 -0.553 889 HB2 TYR 102 2HB TYR 102 -2.853 8.558 -1.619 890 HB3 TYR 102 3HB TYR 102 -1.559 7.697 -0.784 891 HD1 TYR 102 HD2 TYR 102 -0.892 8.660 1.579 892 HD2 TYR 102 HD1 TYR 102 -4.667 9.361 -0.307 893 HE1 TYR 102 HE2 TYR 102 -1.875 9.206 3.751 894 HE2 TYR 102 HE1 TYR 102 -5.654 9.916 1.876 895 HH TYR 102 HH TYR 102 -3.731 10.481 4.634 896 H GLU 103 H GLU 103 1.259 8.696 -1.604 897 HA GLU 103 HA GLU 103 1.497 9.166 -4.444 898 HB2 GLU 103 2HB GLU 103 3.473 9.384 -2.948 899 HB3 GLU 103 3HB GLU 103 3.389 7.662 -2.595 900 HG2 GLU 103 2HG GLU 103 5.117 8.040 -4.246 901 HG3 GLU 103 3HG GLU 103 3.786 7.171 -5.007 902 H VAL 104 H VAL 104 1.065 7.739 -6.025 903 HA VAL 104 HA VAL 104 0.750 4.892 -5.395 904 HB VAL 104 HB VAL 104 -1.504 5.638 -5.108 905 HG11 VAL 104 1HG1 VAL 104 -2.786 6.906 -6.790 906 HG12 VAL 104 2HG1 VAL 104 -1.336 7.065 -7.785 907 HG13 VAL 104 3HG1 VAL 104 -1.404 7.830 -6.193 908 HG21 VAL 104 3HG2 VAL 104 -2.695 4.362 -6.838 909 HG22 VAL 104 1HG2 VAL 104 -1.217 3.526 -6.357 910 HG23 VAL 104 2HG2 VAL 104 -1.274 4.409 -7.886 911 H ARG 105 H ARG 105 1.778 3.729 -6.836 912 HA ARG 105 HA ARG 105 2.154 4.679 -9.613 913 HB2 ARG 105 2HB ARG 105 3.640 2.566 -8.002 914 HB3 ARG 105 3HB ARG 105 3.894 2.834 -9.722 915 HG2 ARG 105 2HG ARG 105 4.390 4.912 -7.561 916 HG3 ARG 105 3HG ARG 105 5.626 3.865 -8.259 917 HD2 ARG 105 2HD ARG 105 5.882 5.874 -9.446 918 HD3 ARG 105 3HD ARG 105 4.925 4.884 -10.541 919 HE ARG 105 HE ARG 105 3.051 6.228 -10.130 920 HH11 ARG 105 1HH1 ARG 105 5.842 7.398 -8.308 921 HH12 ARG 105 2HH1 ARG 105 5.117 8.939 -7.981 922 HH21 ARG 105 1HH2 ARG 105 2.122 8.234 -9.643 923 HH22 ARG 105 2HH2 ARG 105 3.017 9.406 -8.734 924 H LYS 106 H LYS 106 1.365 3.526 -11.254 925 HA LYS 106 HA LYS 106 -0.030 0.963 -10.817 926 HB2 LYS 106 2HB LYS 106 -1.502 2.674 -11.767 927 HB3 LYS 106 3HB LYS 106 -0.316 3.106 -12.984 928 HG2 LYS 106 2HG LYS 106 -1.496 0.321 -12.951 929 HG3 LYS 106 3HG LYS 106 -2.420 1.657 -13.636 930 HD2 LYS 106 2HD LYS 106 0.352 0.764 -14.563 931 HD3 LYS 106 3HD LYS 106 -1.165 0.403 -15.380 932 HE2 LYS 106 2HE LYS 106 -1.526 2.811 -15.789 933 HE3 LYS 106 3HE LYS 106 -0.021 3.188 -14.946 934 HZ1 LYS 106 3HZ LYS 106 -0.271 1.611 -17.454 935 HZ2 LYS 106 1HZ LYS 106 1.178 1.930 -16.638 936 HZ3 LYS 106 2HZ LYS 106 0.296 3.198 -17.323 937 H VAL 107 H VAL 107 1.020 -0.796 -11.579 938 HA VAL 107 HA VAL 107 3.029 -0.545 -13.747 939 HB VAL 107 HB VAL 107 4.504 -2.192 -12.621 940 HG11 VAL 107 1HG1 VAL 107 3.913 0.200 -10.835 941 HG12 VAL 107 2HG1 VAL 107 4.980 0.187 -12.241 942 HG13 VAL 107 3HG1 VAL 107 5.398 -0.759 -10.811 943 HG21 VAL 107 3HG2 VAL 107 4.127 -2.825 -10.253 944 HG22 VAL 107 1HG2 VAL 107 2.848 -3.419 -11.311 945 HG23 VAL 107 2HG2 VAL 107 2.564 -2.006 -10.292 946 H THR 108 H THR 108 3.506 -2.693 -14.732 947 HA THR 108 HA THR 108 1.177 -4.536 -14.737 948 HB THR 108 HB THR 108 1.734 -4.940 -17.200 949 HG1 THR 108 HG1 THR 108 3.821 -4.103 -17.304 950 HG21 THR 108 3HG2 THR 108 -0.175 -3.476 -16.560 951 HG22 THR 108 1HG2 THR 108 0.602 -2.912 -18.045 952 HG23 THR 108 2HG2 THR 108 0.912 -2.086 -16.517 953 H ASP 109 H ASP 109 4.692 -4.169 -15.069 954 HA ASP 109 HA ASP 109 5.141 -7.040 -15.356 955 HB2 ASP 109 2HB ASP 109 7.068 -4.684 -15.236 956 HB3 ASP 109 3HB ASP 109 7.595 -6.355 -15.414 957 H ASP 110 H ASP 110 6.580 -8.213 -14.014 958 HA ASP 110 HA ASP 110 5.980 -8.089 -11.225 959 HB2 ASP 110 2HB ASP 110 6.304 -10.242 -12.353 960 HB3 ASP 110 3HB ASP 110 7.930 -9.794 -12.841 961 H GLU 111 H GLU 111 9.036 -7.775 -13.060 962 HA GLU 111 HA GLU 111 10.696 -7.063 -10.890 963 HB2 GLU 111 2HB GLU 111 12.359 -6.415 -12.595 964 HB3 GLU 111 3HB GLU 111 11.608 -7.955 -12.990 965 HG2 GLU 111 2HG GLU 111 10.174 -6.842 -14.663 966 HG3 GLU 111 3HG GLU 111 10.902 -5.287 -14.264 967 H GLU 112 H GLU 112 8.728 -5.161 -13.095 968 HA GLU 112 HA GLU 112 9.713 -2.571 -12.509 969 HB2 GLU 112 2HB GLU 112 8.340 -3.085 -14.505 970 HB3 GLU 112 3HB GLU 112 6.958 -3.465 -13.484 971 HG2 GLU 112 2HG GLU 112 7.020 -1.054 -12.682 972 HG3 GLU 112 3HG GLU 112 8.239 -0.749 -13.920 973 H ALA 113 H ALA 113 7.094 -4.543 -11.094 974 HA ALA 113 HA ALA 113 6.136 -2.639 -9.232 975 HB1 ALA 113 3HB ALA 113 4.895 -4.675 -9.846 976 HB2 ALA 113 1HB ALA 113 5.105 -4.561 -8.095 977 HB3 ALA 113 2HB ALA 113 6.107 -5.668 -9.038 978 H LEU 114 H LEU 114 8.697 -5.083 -9.029 979 HA LEU 114 HA LEU 114 9.229 -4.949 -6.264 980 HB2 LEU 114 2HB LEU 114 11.047 -5.750 -8.564 981 HB3 LEU 114 3HB LEU 114 11.436 -6.014 -6.867 982 HG LEU 114 HG LEU 114 9.071 -7.248 -8.338 983 HD11 LEU 114 1HD1 LEU 114 11.648 -8.552 -7.433 984 HD12 LEU 114 2HD1 LEU 114 11.192 -8.188 -9.100 985 HD13 LEU 114 3HD1 LEU 114 10.263 -9.363 -8.175 986 HD21 LEU 114 3HD2 LEU 114 8.749 -8.595 -6.309 987 HD22 LEU 114 1HD2 LEU 114 8.559 -6.878 -5.971 988 HD23 LEU 114 2HD2 LEU 114 10.044 -7.710 -5.495 989 H LYS 115 H LYS 115 10.659 -3.154 -8.989 990 HA LYS 115 HA LYS 115 12.670 -1.849 -7.437 991 HB2 LYS 115 2HB LYS 115 13.064 -0.452 -9.402 992 HB3 LYS 115 3HB LYS 115 12.902 -2.137 -9.882 993 HG2 LYS 115 2HG LYS 115 10.728 -1.784 -10.788 994 HG3 LYS 115 3HG LYS 115 10.601 -0.177 -10.071 995 HD2 LYS 115 2HD LYS 115 12.622 -0.940 -12.215 996 HD3 LYS 115 3HD LYS 115 11.060 -0.183 -12.545 997 HE2 LYS 115 2HE LYS 115 11.727 1.779 -11.197 998 HE3 LYS 115 3HE LYS 115 13.285 1.021 -10.857 999 HZ1 LYS 115 3HZ LYS 115 12.285 1.780 -13.546 1000 HZ2 LYS 115 1HZ LYS 115 13.777 1.061 -13.214 1001 HZ3 LYS 115 2HZ LYS 115 13.448 2.619 -12.650 1002 H ILE 116 H ILE 116 9.322 -1.115 -8.245 1003 HA ILE 116 HA ILE 116 9.251 1.603 -7.412 1004 HB ILE 116 HB ILE 116 7.026 -0.474 -7.621 1005 HG12 ILE 116 2HG1 ILE 116 8.058 0.068 -9.789 1006 HG13 ILE 116 3HG1 ILE 116 6.422 0.694 -9.725 1007 HG21 ILE 116 1HG2 ILE 116 6.759 2.515 -7.176 1008 HG22 ILE 116 2HG2 ILE 116 6.302 1.234 -6.051 1009 HG23 ILE 116 3HG2 ILE 116 5.426 1.424 -7.569 1010 HD11 ILE 116 3HD1 ILE 116 7.325 2.936 -9.319 1011 HD12 ILE 116 1HD1 ILE 116 7.912 2.224 -10.819 1012 HD13 ILE 116 2HD1 ILE 116 8.963 2.275 -9.407 1013 H VAL 117 H VAL 117 8.589 -1.464 -5.734 1014 HA VAL 117 HA VAL 117 7.910 -0.432 -3.191 1015 HB VAL 117 HB VAL 117 9.248 -3.088 -3.904 1016 HG11 VAL 117 1HG1 VAL 117 8.400 -3.930 -1.730 1017 HG12 VAL 117 2HG1 VAL 117 7.822 -2.310 -1.329 1018 HG13 VAL 117 3HG1 VAL 117 9.552 -2.612 -1.507 1019 HG21 VAL 117 3HG2 VAL 117 6.307 -2.434 -3.459 1020 HG22 VAL 117 1HG2 VAL 117 6.968 -4.037 -3.796 1021 HG23 VAL 117 2HG2 VAL 117 7.066 -2.769 -5.017 1022 H ARG 118 H ARG 118 11.017 -1.265 -4.689 1023 HA ARG 118 HA ARG 118 12.692 -0.675 -2.464 1024 HB2 ARG 118 2HB ARG 118 13.337 -0.808 -5.438 1025 HB3 ARG 118 3HB ARG 118 14.555 -0.620 -4.172 1026 HG2 ARG 118 2HG ARG 118 13.899 -2.798 -3.211 1027 HG3 ARG 118 3HG ARG 118 12.680 -2.992 -4.476 1028 HD2 ARG 118 2HD ARG 118 14.460 -3.006 -6.187 1029 HD3 ARG 118 3HD ARG 118 15.681 -2.781 -4.925 1030 HE ARG 118 HE ARG 118 13.985 -5.083 -4.535 1031 HH11 ARG 118 1HH1 ARG 118 16.982 -4.011 -6.054 1032 HH12 ARG 118 2HH1 ARG 118 17.649 -5.608 -6.113 1033 HH21 ARG 118 1HH2 ARG 118 14.889 -7.149 -4.626 1034 HH22 ARG 118 2HH2 ARG 118 16.468 -7.381 -5.308 1035 H GLU 119 H GLU 119 11.197 1.371 -4.906 1036 HA GLU 119 HA GLU 119 12.734 3.729 -4.303 1037 HB2 GLU 119 2HB GLU 119 9.979 3.461 -5.579 1038 HB3 GLU 119 3HB GLU 119 10.859 4.980 -5.422 1039 HG2 GLU 119 2HG GLU 119 12.705 3.921 -6.808 1040 HG3 GLU 119 3HG GLU 119 11.599 2.584 -7.121 1041 H PHE 120 H PHE 120 9.493 2.570 -3.384 1042 HA PHE 120 HA PHE 120 8.539 4.691 -1.925 1043 HB2 PHE 120 2HB PHE 120 8.013 1.712 -1.649 1044 HB3 PHE 120 3HB PHE 120 7.144 2.896 -0.678 1045 HD1 PHE 120 HD2 PHE 120 7.242 4.858 -3.375 1046 HD2 PHE 120 HD1 PHE 120 5.711 0.980 -2.374 1047 HE1 PHE 120 HE2 PHE 120 5.480 5.107 -5.073 1048 HE2 PHE 120 HE1 PHE 120 3.956 1.247 -4.068 1049 HZ PHE 120 HZ PHE 120 3.831 3.305 -5.414 1050 H MET 121 H MET 121 10.555 2.046 -0.735 1051 HA MET 121 HA MET 121 10.497 2.779 2.021 1052 HB2 MET 121 2HB MET 121 12.357 1.126 2.255 1053 HB3 MET 121 3HB MET 121 10.952 0.495 1.407 1054 HG2 MET 121 2HG MET 121 12.133 0.874 -0.756 1055 HG3 MET 121 3HG MET 121 13.557 1.386 0.149 1056 HE1 MET 121 3HE MET 121 11.075 -1.561 1.173 1057 HE2 MET 121 1HE MET 121 11.860 -2.925 0.375 1058 HE3 MET 121 2HE MET 121 11.109 -1.656 -0.592 1059 H GLN 122 H GLN 122 12.439 3.951 -0.649 1060 HA GLN 122 HA GLN 122 14.494 5.167 0.995 1061 HB2 GLN 122 2HB GLN 122 13.823 5.785 -1.912 1062 HB3 GLN 122 3HB GLN 122 15.305 6.211 -1.061 1063 HG2 GLN 122 2HG GLN 122 14.376 3.462 -1.909 1064 HG3 GLN 122 3HG GLN 122 15.776 4.353 -2.498 1065 HE21 GLN 122 1HE2 GLN 122 17.624 4.514 -1.140 1066 HE22 GLN 122 2HE2 GLN 122 17.879 3.406 0.161 1067 H LYS 123 H LYS 123 11.617 6.327 -0.812 1068 HA LYS 123 HA LYS 123 11.807 9.060 -0.054 1069 HB2 LYS 123 2HB LYS 123 9.361 7.445 -0.892 1070 HB3 LYS 123 3HB LYS 123 9.296 9.165 -0.551 1071 HG2 LYS 123 2HG LYS 123 9.395 9.030 -2.898 1072 HG3 LYS 123 3HG LYS 123 11.032 9.475 -2.409 1073 HD2 LYS 123 2HD LYS 123 11.811 7.203 -2.737 1074 HD3 LYS 123 3HD LYS 123 10.168 6.626 -3.013 1075 HE2 LYS 123 2HE LYS 123 11.350 6.782 -5.129 1076 HE3 LYS 123 3HE LYS 123 10.066 7.991 -5.088 1077 HZ1 LYS 123 3HZ LYS 123 12.085 8.925 -5.984 1078 HZ2 LYS 123 1HZ LYS 123 12.953 8.488 -4.601 1079 HZ3 LYS 123 2HZ LYS 123 11.739 9.658 -4.501 1080 H ALA 124 H ALA 124 10.468 6.226 1.474 1081 HA ALA 124 HA ALA 124 8.879 7.157 3.511 1082 HB1 ALA 124 3HB ALA 124 9.430 5.069 4.679 1083 HB2 ALA 124 1HB ALA 124 10.825 4.833 3.626 1084 HB3 ALA 124 2HB ALA 124 9.191 4.786 2.956 1085 H GLY 125 H GLY 125 12.421 6.815 3.543 1086 HA2 GLY 125 2HA GLY 125 12.865 7.617 6.230 1087 HA3 GLY 125 3HA GLY 125 14.054 7.631 4.938 1088 H SER 126 H SER 126 12.747 9.394 3.195 1089 HA SER 126 HA SER 126 13.515 11.936 4.183 1090 HB2 SER 126 2HB SER 126 11.790 11.310 1.747 1091 HB3 SER 126 3HB SER 126 12.777 12.758 2.010 1092 HG SER 126 HG SER 126 13.487 10.412 0.949 1093 H LEU 127 H LEU 127 10.382 10.273 3.875 1094 HA LEU 127 HA LEU 127 8.602 12.343 4.499 1095 HB2 LEU 127 2HB LEU 127 8.358 9.401 5.224 1096 HB3 LEU 127 3HB LEU 127 7.043 10.564 5.301 1097 HG LEU 127 HG LEU 127 8.435 9.596 2.781 1098 HD11 LEU 127 1HD1 LEU 127 6.219 8.581 2.293 1099 HD12 LEU 127 2HD1 LEU 127 5.689 9.029 3.916 1100 HD13 LEU 127 3HD1 LEU 127 7.021 7.890 3.702 1101 HD21 LEU 127 3HD2 LEU 127 7.776 11.935 2.500 1102 HD22 LEU 127 1HD2 LEU 127 6.142 11.568 3.065 1103 HD23 LEU 127 2HD2 LEU 127 6.731 10.886 1.547 1104 H GLU 128 H GLU 128 10.292 10.041 6.665 1105 HA GLU 128 HA GLU 128 8.928 11.028 8.986 1106 HB2 GLU 128 2HB GLU 128 10.136 9.400 10.248 1107 HB3 GLU 128 3HB GLU 128 9.630 8.670 8.742 1108 HG2 GLU 128 2HG GLU 128 11.734 7.809 8.812 1109 HG3 GLU 128 3HG GLU 128 12.134 9.327 8.012 1110 H HIS 129 H HIS 129 12.027 11.751 7.444 1111 HA HIS 129 HA HIS 129 12.825 13.653 9.475 1112 HB2 HIS 129 2HB HIS 129 13.764 13.283 6.598 1113 HB3 HIS 129 3HB HIS 129 14.387 14.549 7.648 1114 HD1 HIS 129 HD1 HIS 129 15.543 13.573 9.948 1115 HD2 HIS 129 HD2 HIS 129 15.208 10.982 6.735 1116 HE1 HIS 129 HE1 HIS 129 17.173 11.735 10.400 1117 HE2 HIS 129 HE2 HIS 129 16.845 10.108 8.514 1118 H HIS 130 H HIS 130 10.680 14.622 9.673 1119 HA HIS 130 HA HIS 130 10.387 17.027 8.007 1120 HB2 HIS 130 2HB HIS 130 8.252 14.923 8.473 1121 HB3 HIS 130 3HB HIS 130 7.752 16.607 8.432 1122 HD1 HIS 130 HD1 HIS 130 10.013 14.508 6.142 1123 HD2 HIS 130 HD2 HIS 130 6.799 17.133 5.955 1124 HE1 HIS 130 HE1 HIS 130 9.463 14.730 3.710 1125 HE2 HIS 130 HE2 HIS 130 7.539 16.343 3.615 1126 H HIS 131 H HIS 131 9.377 18.779 9.117 1127 HA HIS 131 HA HIS 131 8.985 20.210 10.819 1128 HB2 HIS 131 2HB HIS 131 8.356 17.696 12.427 1129 HB3 HIS 131 3HB HIS 131 8.100 19.328 13.029 1130 HD1 HIS 131 HD1 HIS 131 5.726 19.943 12.895 1131 HD2 HIS 131 HD2 HIS 131 6.797 17.448 9.754 1132 HE1 HIS 131 HE1 HIS 131 3.628 19.567 11.587 1133 HE2 HIS 131 HE2 HIS 131 4.264 17.891 9.823 1134 H HIS 132 H HIS 132 11.597 19.259 10.222 1135 HA HIS 132 HA HIS 132 13.729 19.104 10.851 1136 HB2 HIS 132 2HB HIS 132 13.197 21.425 11.783 1137 HB3 HIS 132 3HB HIS 132 13.014 20.678 13.364 1138 HD1 HIS 132 HD1 HIS 132 15.603 21.531 10.777 1139 HD2 HIS 132 HD2 HIS 132 15.451 20.021 14.636 1140 HE1 HIS 132 HE1 HIS 132 17.971 21.503 11.579 1141 HE2 HIS 132 HE2 HIS 132 17.864 20.381 13.833 1142 H HIS 133 H HIS 133 12.402 16.875 11.243 1143 HA HIS 133 HA HIS 133 12.936 15.654 13.808 1144 HB2 HIS 133 2HB HIS 133 11.111 14.811 12.408 1145 HB3 HIS 133 3HB HIS 133 12.219 14.477 11.089 1146 HD1 HIS 133 HD1 HIS 133 10.697 12.983 14.056 1147 HD2 HIS 133 HD2 HIS 133 13.974 12.188 11.635 1148 HE1 HIS 133 HE1 HIS 133 11.247 10.570 14.434 1149 HE2 HIS 133 HE2 HIS 133 13.083 10.067 12.791 1150 H HIS 134 H HIS 134 15.012 15.569 14.388 1151 HA HIS 134 HA HIS 134 17.185 15.127 12.511 1152 HB2 HIS 134 2HB HIS 134 17.520 16.705 14.345 1153 HB3 HIS 134 3HB HIS 134 17.114 15.481 15.540 1154 HD1 HIS 134 HD1 HIS 134 19.113 14.563 16.673 1155 HD2 HIS 134 HD2 HIS 134 19.995 15.794 12.804 1156 HE1 HIS 134 HE1 HIS 134 21.564 14.121 16.366 1157 HE2 HIS 134 HE2 HIS 134 22.097 14.984 14.063 Start of MODEL 6 1 H1 MET 1 1H MET 1 4.136 9.267 14.302 2 H2 MET 1 2H MET 1 2.499 9.262 13.898 3 H3 MET 1 3H MET 1 3.347 10.721 13.955 4 HA MET 1 HA MET 1 2.971 10.010 11.710 5 HB2 MET 1 2HB MET 1 4.985 11.337 12.227 6 HB3 MET 1 3HB MET 1 5.884 9.871 12.604 7 HG2 MET 1 2HG MET 1 6.436 10.781 10.369 8 HG3 MET 1 3HG MET 1 5.760 9.152 10.280 9 HE1 MET 1 3HE MET 1 4.440 10.865 7.010 10 HE2 MET 1 1HE MET 1 5.367 9.520 7.672 11 HE3 MET 1 2HE MET 1 5.996 11.168 7.783 12 H LYS 2 H LYS 2 1.968 8.092 11.271 13 HA LYS 2 HA LYS 2 3.338 5.520 11.621 14 HB2 LYS 2 2HB LYS 2 0.905 5.864 12.242 15 HB3 LYS 2 3HB LYS 2 0.550 6.134 10.544 16 HG2 LYS 2 2HG LYS 2 -0.068 3.893 10.900 17 HG3 LYS 2 3HG LYS 2 1.515 3.774 10.133 18 HD2 LYS 2 2HD LYS 2 1.333 2.179 11.972 19 HD3 LYS 2 3HD LYS 2 2.559 3.391 12.349 20 HE2 LYS 2 2HE LYS 2 1.108 4.492 13.917 21 HE3 LYS 2 3HE LYS 2 -0.302 3.599 13.347 22 HZ1 LYS 2 3HZ LYS 2 0.724 1.570 14.210 23 HZ2 LYS 2 1HZ LYS 2 0.419 2.712 15.413 24 HZ3 LYS 2 2HZ LYS 2 1.997 2.480 14.852 25 H ILE 3 H ILE 3 4.156 4.335 9.868 26 HA ILE 3 HA ILE 3 4.045 5.583 7.175 27 HB ILE 3 HB ILE 3 6.062 3.571 8.284 28 HG12 ILE 3 2HG1 ILE 3 6.357 6.556 7.692 29 HG13 ILE 3 3HG1 ILE 3 6.373 5.806 9.283 30 HG21 ILE 3 1HG2 ILE 3 6.043 4.955 5.570 31 HG22 ILE 3 2HG2 ILE 3 5.719 3.244 5.859 32 HG23 ILE 3 3HG2 ILE 3 7.324 3.902 6.178 33 HD11 ILE 3 3HD1 ILE 3 8.602 6.427 8.572 34 HD12 ILE 3 1HD1 ILE 3 8.458 5.423 7.130 35 HD13 ILE 3 2HD1 ILE 3 8.469 4.679 8.731 36 H LEU 4 H LEU 4 2.603 4.648 5.853 37 HA LEU 4 HA LEU 4 2.193 1.711 5.933 38 HB2 LEU 4 2HB LEU 4 0.284 3.978 5.436 39 HB3 LEU 4 3HB LEU 4 0.058 2.549 4.444 40 HG LEU 4 HG LEU 4 -0.133 1.174 6.540 41 HD11 LEU 4 1HD1 LEU 4 -0.138 3.846 7.946 42 HD12 LEU 4 2HD1 LEU 4 1.051 2.554 8.118 43 HD13 LEU 4 3HD1 LEU 4 -0.602 2.307 8.674 44 HD21 LEU 4 3HD2 LEU 4 -2.432 1.861 7.034 45 HD22 LEU 4 1HD2 LEU 4 -2.114 1.903 5.302 46 HD23 LEU 4 2HD2 LEU 4 -2.162 3.406 6.228 47 H ILE 5 H ILE 5 2.925 0.606 4.224 48 HA ILE 5 HA ILE 5 2.790 1.892 1.560 49 HB ILE 5 HB ILE 5 4.333 -0.650 2.286 50 HG12 ILE 5 2HG1 ILE 5 5.342 2.189 1.781 51 HG13 ILE 5 3HG1 ILE 5 5.515 1.255 3.261 52 HG21 ILE 5 1HG2 ILE 5 5.239 -0.510 -0.014 53 HG22 ILE 5 2HG2 ILE 5 4.246 0.915 -0.324 54 HG23 ILE 5 3HG2 ILE 5 3.479 -0.647 -0.036 55 HD11 ILE 5 3HD1 ILE 5 7.028 -0.295 2.078 56 HD12 ILE 5 1HD1 ILE 5 7.612 1.369 2.081 57 HD13 ILE 5 2HD1 ILE 5 6.885 0.698 0.623 58 H LEU 6 H LEU 6 0.773 1.517 0.856 59 HA LEU 6 HA LEU 6 -0.702 -0.941 1.344 60 HB2 LEU 6 2HB LEU 6 -1.361 1.481 -0.399 61 HB3 LEU 6 3HB LEU 6 -2.463 0.155 -0.058 62 HG LEU 6 HG LEU 6 -1.405 2.164 1.949 63 HD11 LEU 6 1HD1 LEU 6 -3.729 2.961 2.070 64 HD12 LEU 6 2HD1 LEU 6 -4.203 1.812 0.816 65 HD13 LEU 6 3HD1 LEU 6 -3.085 3.125 0.439 66 HD21 LEU 6 3HD2 LEU 6 -3.365 -0.101 2.398 67 HD22 LEU 6 1HD2 LEU 6 -2.889 1.126 3.579 68 HD23 LEU 6 2HD2 LEU 6 -1.698 -0.030 2.986 69 H ILE 7 H ILE 7 -0.051 -2.634 0.178 70 HA ILE 7 HA ILE 7 0.492 -2.314 -2.728 71 HB ILE 7 HB ILE 7 1.226 -4.679 -0.943 72 HG12 ILE 7 2HG1 ILE 7 2.622 -2.638 -0.504 73 HG13 ILE 7 3HG1 ILE 7 3.562 -3.963 -1.175 74 HG21 ILE 7 1HG2 ILE 7 0.752 -5.393 -3.252 75 HG22 ILE 7 2HG2 ILE 7 2.479 -5.512 -2.920 76 HG23 ILE 7 3HG2 ILE 7 1.860 -4.168 -3.880 77 HD11 ILE 7 3HD1 ILE 7 2.591 -1.532 -2.675 78 HD12 ILE 7 1HD1 ILE 7 3.529 -2.861 -3.368 79 HD13 ILE 7 2HD1 ILE 7 4.231 -1.845 -2.109 80 H ASN 8 H ASN 8 -1.132 -2.796 -3.977 81 HA ASN 8 HA ASN 8 -3.029 -4.955 -3.295 82 HB2 ASN 8 2HB ASN 8 -4.188 -2.818 -3.010 83 HB3 ASN 8 3HB ASN 8 -3.655 -2.261 -4.587 84 HD21 ASN 8 1HD2 ASN 8 -5.001 -5.421 -3.628 85 HD22 ASN 8 2HD2 ASN 8 -6.384 -5.328 -4.659 86 H THR 9 H THR 9 -2.299 -6.531 -4.615 87 HA THR 9 HA THR 9 -2.437 -6.002 -7.516 88 HB THR 9 HB THR 9 -0.057 -6.402 -6.931 89 HG1 THR 9 HG1 THR 9 -0.646 -7.118 -8.961 90 HG21 THR 9 3HG2 THR 9 -0.368 -7.875 -4.988 91 HG22 THR 9 1HG2 THR 9 0.709 -8.593 -6.184 92 HG23 THR 9 2HG2 THR 9 -0.961 -9.150 -6.050 93 H ASN 10 H ASN 10 -3.470 -7.536 -8.748 94 HA ASN 10 HA ASN 10 -5.225 -9.427 -7.425 95 HB2 ASN 10 2HB ASN 10 -5.972 -8.291 -9.467 96 HB3 ASN 10 3HB ASN 10 -4.624 -8.964 -10.377 97 HD21 ASN 10 1HD2 ASN 10 -4.775 -11.049 -11.147 98 HD22 ASN 10 2HD2 ASN 10 -6.201 -12.016 -11.029 99 H ASN 11 H ASN 11 -2.197 -9.576 -9.276 100 HA ASN 11 HA ASN 11 -1.953 -12.470 -8.996 101 HB2 ASN 11 2HB ASN 11 0.322 -12.091 -10.118 102 HB3 ASN 11 3HB ASN 11 -1.094 -11.669 -11.068 103 HD21 ASN 11 1HD2 ASN 11 1.755 -10.442 -9.491 104 HD22 ASN 11 2HD2 ASN 11 1.649 -8.834 -10.107 105 H ASP 12 H ASP 12 -2.007 -12.747 -6.825 106 HA ASP 12 HA ASP 12 -0.880 -11.384 -4.708 107 HB2 ASP 12 2HB ASP 12 -2.640 -13.100 -4.533 108 HB3 ASP 12 3HB ASP 12 -1.497 -14.358 -4.976 109 H GLU 13 H GLU 13 0.707 -13.719 -6.765 110 HA GLU 13 HA GLU 13 2.807 -14.618 -5.186 111 HB2 GLU 13 2HB GLU 13 2.995 -14.064 -8.169 112 HB3 GLU 13 3HB GLU 13 3.933 -15.236 -7.245 113 HG2 GLU 13 2HG GLU 13 1.004 -15.348 -7.995 114 HG3 GLU 13 3HG GLU 13 2.285 -16.461 -8.468 115 H LEU 14 H LEU 14 2.437 -11.618 -6.906 116 HA LEU 14 HA LEU 14 5.027 -10.588 -6.883 117 HB2 LEU 14 2HB LEU 14 3.266 -9.607 -8.220 118 HB3 LEU 14 3HB LEU 14 2.311 -9.254 -6.790 119 HG LEU 14 HG LEU 14 4.002 -7.565 -6.083 120 HD11 LEU 14 1HD1 LEU 14 5.357 -8.124 -8.730 121 HD12 LEU 14 2HD1 LEU 14 6.002 -8.476 -7.125 122 HD13 LEU 14 3HD1 LEU 14 5.747 -6.806 -7.620 123 HD21 LEU 14 3HD2 LEU 14 2.037 -6.858 -7.338 124 HD22 LEU 14 1HD2 LEU 14 2.895 -7.103 -8.861 125 HD23 LEU 14 2HD2 LEU 14 3.431 -5.859 -7.729 126 H ILE 15 H ILE 15 2.403 -10.270 -4.406 127 HA ILE 15 HA ILE 15 3.901 -8.449 -2.778 128 HB ILE 15 HB ILE 15 1.576 -10.109 -1.696 129 HG12 ILE 15 2HG1 ILE 15 1.420 -7.448 -3.173 130 HG13 ILE 15 3HG1 ILE 15 0.871 -8.994 -3.798 131 HG21 ILE 15 1HG2 ILE 15 2.747 -7.378 -0.949 132 HG22 ILE 15 2HG2 ILE 15 2.877 -8.863 -0.004 133 HG23 ILE 15 3HG2 ILE 15 1.314 -8.085 -0.211 134 HD11 ILE 15 3HD1 ILE 15 -0.998 -7.667 -3.043 135 HD12 ILE 15 1HD1 ILE 15 -0.295 -7.520 -1.431 136 HD13 ILE 15 2HD1 ILE 15 -0.834 -9.095 -2.022 137 H LYS 16 H LYS 16 3.515 -11.952 -2.824 138 HA LYS 16 HA LYS 16 4.629 -12.683 -0.367 139 HB2 LYS 16 2HB LYS 16 4.886 -14.083 -3.063 140 HB3 LYS 16 3HB LYS 16 5.220 -14.838 -1.503 141 HG2 LYS 16 2HG LYS 16 2.915 -14.714 -0.844 142 HG3 LYS 16 3HG LYS 16 2.515 -13.654 -2.198 143 HD2 LYS 16 2HD LYS 16 1.689 -15.896 -2.648 144 HD3 LYS 16 3HD LYS 16 2.986 -15.505 -3.776 145 HE2 LYS 16 2HE LYS 16 4.555 -16.866 -2.440 146 HE3 LYS 16 3HE LYS 16 3.258 -17.240 -1.299 147 HZ1 LYS 16 3HZ LYS 16 3.237 -17.940 -4.187 148 HZ2 LYS 16 1HZ LYS 16 2.059 -18.357 -3.047 149 HZ3 LYS 16 2HZ LYS 16 3.617 -19.006 -2.931 150 H LYS 17 H LYS 17 6.154 -11.499 -3.267 151 HA LYS 17 HA LYS 17 8.894 -11.934 -2.435 152 HB2 LYS 17 2HB LYS 17 7.807 -10.205 -4.694 153 HB3 LYS 17 3HB LYS 17 9.458 -10.804 -4.520 154 HG2 LYS 17 2HG LYS 17 8.596 -13.141 -4.773 155 HG3 LYS 17 3HG LYS 17 6.976 -12.489 -5.033 156 HD2 LYS 17 2HD LYS 17 7.995 -13.029 -7.184 157 HD3 LYS 17 3HD LYS 17 7.809 -11.280 -7.042 158 HE2 LYS 17 2HE LYS 17 10.218 -11.108 -6.399 159 HE3 LYS 17 3HE LYS 17 10.379 -12.850 -6.630 160 HZ1 LYS 17 3HZ LYS 17 9.529 -10.953 -8.736 161 HZ2 LYS 17 1HZ LYS 17 9.884 -12.590 -8.936 162 HZ3 LYS 17 2HZ LYS 17 11.117 -11.502 -8.539 163 H ILE 18 H ILE 18 6.651 -9.183 -2.792 164 HA ILE 18 HA ILE 18 8.300 -7.041 -2.062 165 HB ILE 18 HB ILE 18 5.277 -7.390 -1.839 166 HG12 ILE 18 2HG1 ILE 18 6.989 -5.933 -3.905 167 HG13 ILE 18 3HG1 ILE 18 6.212 -7.493 -4.140 168 HG21 ILE 18 1HG2 ILE 18 6.817 -4.787 -1.525 169 HG22 ILE 18 2HG2 ILE 18 5.917 -5.621 -0.256 170 HG23 ILE 18 3HG2 ILE 18 5.061 -4.932 -1.636 171 HD11 ILE 18 3HD1 ILE 18 4.991 -5.761 -5.269 172 HD12 ILE 18 1HD1 ILE 18 4.823 -4.838 -3.776 173 HD13 ILE 18 2HD1 ILE 18 4.016 -6.400 -3.947 174 H LYS 19 H LYS 19 6.555 -9.337 -0.059 175 HA LYS 19 HA LYS 19 6.676 -8.017 2.433 176 HB2 LYS 19 2HB LYS 19 6.537 -10.978 1.747 177 HB3 LYS 19 3HB LYS 19 6.374 -10.340 3.383 178 HG2 LYS 19 2HG LYS 19 4.322 -9.184 2.809 179 HG3 LYS 19 3HG LYS 19 4.516 -9.586 1.100 180 HD2 LYS 19 2HD LYS 19 2.849 -11.066 2.168 181 HD3 LYS 19 3HD LYS 19 4.251 -11.984 1.608 182 HE2 LYS 19 2HE LYS 19 5.155 -11.876 3.971 183 HE3 LYS 19 3HE LYS 19 3.625 -11.154 4.462 184 HZ1 LYS 19 3HZ LYS 19 3.944 -13.824 3.219 185 HZ2 LYS 19 1HZ LYS 19 2.491 -13.138 3.738 186 HZ3 LYS 19 2HZ LYS 19 3.693 -13.525 4.864 187 H LYS 20 H LYS 20 8.863 -10.306 0.799 188 HA LYS 20 HA LYS 20 10.761 -10.512 2.905 189 HB2 LYS 20 2HB LYS 20 11.342 -10.922 -0.059 190 HB3 LYS 20 3HB LYS 20 12.214 -11.613 1.305 191 HG2 LYS 20 2HG LYS 20 9.434 -12.337 0.329 192 HG3 LYS 20 3HG LYS 20 10.877 -13.346 0.292 193 HD2 LYS 20 2HD LYS 20 9.366 -12.462 2.786 194 HD3 LYS 20 3HD LYS 20 9.319 -14.065 2.055 195 HE2 LYS 20 2HE LYS 20 11.780 -12.770 3.283 196 HE3 LYS 20 3HE LYS 20 10.777 -14.000 4.048 197 HZ1 LYS 20 3HZ LYS 20 12.339 -14.370 1.545 198 HZ2 LYS 20 1HZ LYS 20 11.391 -15.548 2.306 199 HZ3 LYS 20 2HZ LYS 20 12.768 -14.942 3.078 200 H GLU 21 H GLU 21 10.432 -8.367 0.100 201 HA GLU 21 HA GLU 21 12.867 -6.988 0.171 202 HB2 GLU 21 2HB GLU 21 10.130 -5.839 -0.555 203 HB3 GLU 21 3HB GLU 21 11.684 -5.159 -1.029 204 HG2 GLU 21 2HG GLU 21 10.534 -7.816 -1.933 205 HG3 GLU 21 3HG GLU 21 10.602 -6.337 -2.884 206 H VAL 22 H VAL 22 9.772 -6.228 1.786 207 HA VAL 22 HA VAL 22 10.710 -3.789 2.964 208 HB VAL 22 HB VAL 22 8.550 -3.624 4.062 209 HG11 VAL 22 1HG1 VAL 22 8.584 -2.987 1.714 210 HG12 VAL 22 2HG1 VAL 22 7.026 -3.707 2.111 211 HG13 VAL 22 3HG1 VAL 22 8.231 -4.641 1.221 212 HG21 VAL 22 3HG2 VAL 22 6.830 -5.402 3.918 213 HG22 VAL 22 1HG2 VAL 22 8.247 -5.927 4.829 214 HG23 VAL 22 2HG2 VAL 22 8.011 -6.475 3.169 215 H GLU 23 H GLU 23 10.570 -7.150 4.038 216 HA GLU 23 HA GLU 23 10.874 -6.802 6.817 217 HB2 GLU 23 2HB GLU 23 11.677 -9.037 4.937 218 HB3 GLU 23 3HB GLU 23 12.062 -9.131 6.655 219 HG2 GLU 23 2HG GLU 23 9.704 -9.040 7.243 220 HG3 GLU 23 3HG GLU 23 9.254 -8.782 5.557 221 H ASN 24 H ASN 24 13.282 -6.718 4.207 222 HA ASN 24 HA ASN 24 15.632 -6.674 5.790 223 HB2 ASN 24 2HB ASN 24 15.121 -5.424 3.049 224 HB3 ASN 24 3HB ASN 24 16.712 -5.527 3.801 225 HD21 ASN 24 1HD2 ASN 24 14.259 -7.250 2.101 226 HD22 ASN 24 2HD2 ASN 24 15.132 -8.727 1.923 227 H GLN 25 H GLN 25 13.329 -4.157 4.936 228 HA GLN 25 HA GLN 25 14.973 -2.006 6.092 229 HB2 GLN 25 2HB GLN 25 12.267 -1.821 4.698 230 HB3 GLN 25 3HB GLN 25 13.335 -0.479 5.104 231 HG2 GLN 25 2HG GLN 25 13.895 -2.672 3.084 232 HG3 GLN 25 3HG GLN 25 13.474 -0.999 2.723 233 HE21 GLN 25 1HE2 GLN 25 15.854 -2.605 1.996 234 HE22 GLN 25 2HE2 GLN 25 17.215 -1.695 2.554 235 H GLY 26 H GLY 26 12.796 -4.239 7.232 236 HA2 GLY 26 2HA GLY 26 12.234 -4.540 9.450 237 HA3 GLY 26 3HA GLY 26 12.688 -2.880 9.795 238 H TYR 27 H TYR 27 10.337 -3.938 7.350 239 HA TYR 27 HA TYR 27 8.194 -2.462 8.680 240 HB2 TYR 27 2HB TYR 27 8.319 -3.924 6.017 241 HB3 TYR 27 3HB TYR 27 6.814 -3.273 6.653 242 HD1 TYR 27 HD1 TYR 27 10.284 -2.244 5.653 243 HD2 TYR 27 HD2 TYR 27 6.232 -1.023 6.219 244 HE1 TYR 27 HE1 TYR 27 10.786 -0.085 4.612 245 HE2 TYR 27 HE2 TYR 27 6.740 1.139 5.178 246 HH TYR 27 HH TYR 27 9.597 1.711 3.446 247 H GLN 28 H GLN 28 6.610 -3.350 9.823 248 HA GLN 28 HA GLN 28 6.268 -6.189 10.235 249 HB2 GLN 28 2HB GLN 28 5.825 -4.599 12.059 250 HB3 GLN 28 3HB GLN 28 4.660 -3.726 11.072 251 HG2 GLN 28 2HG GLN 28 3.208 -5.778 11.086 252 HG3 GLN 28 3HG GLN 28 4.350 -6.525 12.205 253 HE21 GLN 28 1HE2 GLN 28 3.406 -3.101 12.261 254 HE22 GLN 28 2HE2 GLN 28 2.573 -3.180 13.768 255 H VAL 29 H VAL 29 5.293 -7.381 8.631 256 HA VAL 29 HA VAL 29 3.505 -6.170 6.689 257 HB VAL 29 HB VAL 29 4.239 -9.126 6.979 258 HG11 VAL 29 1HG1 VAL 29 2.136 -8.768 5.724 259 HG12 VAL 29 2HG1 VAL 29 3.413 -9.324 4.643 260 HG13 VAL 29 3HG1 VAL 29 2.953 -7.622 4.658 261 HG21 VAL 29 3HG2 VAL 29 5.843 -8.737 5.123 262 HG22 VAL 29 1HG2 VAL 29 6.260 -7.776 6.546 263 HG23 VAL 29 2HG2 VAL 29 5.472 -7.012 5.164 264 H ARG 30 H ARG 30 1.378 -6.121 6.858 265 HA ARG 30 HA ARG 30 -0.127 -7.910 8.652 266 HB2 ARG 30 2HB ARG 30 0.155 -5.775 9.807 267 HB3 ARG 30 3HB ARG 30 -0.322 -4.874 8.377 268 HG2 ARG 30 2HG ARG 30 -2.157 -4.790 9.860 269 HG3 ARG 30 3HG ARG 30 -2.614 -5.924 8.595 270 HD2 ARG 30 2HD ARG 30 -1.564 -6.738 11.324 271 HD3 ARG 30 3HD ARG 30 -3.272 -6.600 10.927 272 HE ARG 30 HE ARG 30 -1.432 -8.713 10.148 273 HH11 ARG 30 1HH1 ARG 30 -4.634 -7.306 9.585 274 HH12 ARG 30 2HH1 ARG 30 -5.265 -8.769 8.894 275 HH21 ARG 30 1HH2 ARG 30 -2.309 -10.599 9.201 276 HH22 ARG 30 2HH2 ARG 30 -3.968 -10.608 8.678 277 H ASP 31 H ASP 31 -1.667 -8.920 7.489 278 HA ASP 31 HA ASP 31 -2.206 -7.975 4.739 279 HB2 ASP 31 2HB ASP 31 -2.531 -10.416 4.189 280 HB3 ASP 31 3HB ASP 31 -0.898 -9.973 4.650 281 H VAL 32 H VAL 32 -4.143 -7.174 4.523 282 HA VAL 32 HA VAL 32 -6.460 -7.800 6.054 283 HB VAL 32 HB VAL 32 -6.515 -6.461 3.312 284 HG11 VAL 32 1HG1 VAL 32 -8.699 -6.981 4.319 285 HG12 VAL 32 2HG1 VAL 32 -8.449 -5.238 4.224 286 HG13 VAL 32 3HG1 VAL 32 -8.265 -6.071 5.772 287 HG21 VAL 32 3HG2 VAL 32 -4.739 -5.324 4.569 288 HG22 VAL 32 1HG2 VAL 32 -5.842 -5.059 5.924 289 HG23 VAL 32 2HG2 VAL 32 -6.140 -4.269 4.372 290 H ASN 33 H ASN 33 -7.301 -9.814 5.875 291 HA ASN 33 HA ASN 33 -7.730 -11.119 3.258 292 HB2 ASN 33 2HB ASN 33 -8.155 -12.182 6.091 293 HB3 ASN 33 3HB ASN 33 -8.391 -13.111 4.615 294 HD21 ASN 33 1HD2 ASN 33 -6.010 -11.629 6.722 295 HD22 ASN 33 2HD2 ASN 33 -4.662 -12.508 6.111 296 H ASP 34 H ASP 34 -9.347 -9.402 5.768 297 HA ASP 34 HA ASP 34 -12.012 -9.778 4.596 298 HB2 ASP 34 2HB ASP 34 -11.213 -10.583 7.429 299 HB3 ASP 34 3HB ASP 34 -12.870 -10.130 7.060 300 H SER 35 H SER 35 -13.622 -8.376 5.770 301 HA SER 35 HA SER 35 -12.766 -5.675 6.070 302 HB2 SER 35 2HB SER 35 -15.417 -6.990 6.832 303 HB3 SER 35 3HB SER 35 -15.136 -5.249 6.701 304 HG SER 35 HG SER 35 -14.576 -6.957 4.528 305 H ASP 36 H ASP 36 -13.361 -8.346 8.294 306 HA ASP 36 HA ASP 36 -13.220 -6.908 10.741 307 HB2 ASP 36 2HB ASP 36 -12.688 -9.839 10.098 308 HB3 ASP 36 3HB ASP 36 -12.617 -9.198 11.738 309 H GLU 37 H GLU 37 -10.762 -8.642 8.808 310 HA GLU 37 HA GLU 37 -8.455 -8.173 10.298 311 HB2 GLU 37 2HB GLU 37 -8.839 -8.259 7.274 312 HB3 GLU 37 3HB GLU 37 -7.252 -8.226 8.037 313 HG2 GLU 37 2HG GLU 37 -9.279 -10.389 8.645 314 HG3 GLU 37 3HG GLU 37 -8.176 -10.502 7.277 315 H LEU 38 H LEU 38 -9.983 -6.181 7.797 316 HA LEU 38 HA LEU 38 -8.172 -4.108 7.548 317 HB2 LEU 38 2HB LEU 38 -10.107 -4.543 6.029 318 HB3 LEU 38 3HB LEU 38 -11.198 -3.949 7.268 319 HG LEU 38 HG LEU 38 -10.099 -1.677 7.099 320 HD11 LEU 38 1HD1 LEU 38 -8.605 -2.883 4.758 321 HD12 LEU 38 2HD1 LEU 38 -7.907 -2.357 6.292 322 HD13 LEU 38 3HD1 LEU 38 -8.631 -1.173 5.207 323 HD21 LEU 38 3HD2 LEU 38 -11.128 -1.018 4.983 324 HD22 LEU 38 1HD2 LEU 38 -12.170 -2.146 5.851 325 HD23 LEU 38 2HD2 LEU 38 -11.220 -2.706 4.472 326 H LYS 39 H LYS 39 -11.166 -4.086 9.580 327 HA LYS 39 HA LYS 39 -10.608 -1.497 10.615 328 HB2 LYS 39 2HB LYS 39 -12.514 -1.916 12.191 329 HB3 LYS 39 3HB LYS 39 -12.898 -2.150 10.497 330 HG2 LYS 39 2HG LYS 39 -13.975 -3.979 11.349 331 HG3 LYS 39 3HG LYS 39 -12.393 -4.709 11.079 332 HD2 LYS 39 2HD LYS 39 -11.846 -4.276 13.491 333 HD3 LYS 39 3HD LYS 39 -13.485 -3.657 13.717 334 HE2 LYS 39 2HE LYS 39 -12.725 -6.483 12.899 335 HE3 LYS 39 3HE LYS 39 -13.335 -5.982 14.474 336 HZ1 LYS 39 3HZ LYS 39 -14.854 -5.767 11.930 337 HZ2 LYS 39 1HZ LYS 39 -15.428 -5.415 13.480 338 HZ3 LYS 39 2HZ LYS 39 -15.040 -7.007 13.064 339 H LYS 40 H LYS 40 -9.972 -4.780 11.928 340 HA LYS 40 HA LYS 40 -9.209 -4.053 14.540 341 HB2 LYS 40 2HB LYS 40 -8.275 -6.382 12.814 342 HB3 LYS 40 3HB LYS 40 -7.778 -6.192 14.492 343 HG2 LYS 40 2HG LYS 40 -10.626 -6.568 13.516 344 HG3 LYS 40 3HG LYS 40 -9.612 -7.806 14.252 345 HD2 LYS 40 2HD LYS 40 -10.549 -5.258 15.633 346 HD3 LYS 40 3HD LYS 40 -11.274 -6.851 15.839 347 HE2 LYS 40 2HE LYS 40 -9.142 -7.689 16.786 348 HE3 LYS 40 3HE LYS 40 -8.433 -6.081 16.594 349 HZ1 LYS 40 3HZ LYS 40 -10.810 -6.705 18.262 350 HZ2 LYS 40 1HZ LYS 40 -10.050 -5.200 18.125 351 HZ3 LYS 40 2HZ LYS 40 -9.240 -6.492 18.850 352 H GLU 41 H GLU 41 -7.218 -4.329 11.576 353 HA GLU 41 HA GLU 41 -4.785 -3.582 12.919 354 HB2 GLU 41 2HB GLU 41 -3.751 -3.600 10.720 355 HB3 GLU 41 3HB GLU 41 -4.764 -5.023 10.921 356 HG2 GLU 41 2HG GLU 41 -6.553 -3.796 9.591 357 HG3 GLU 41 3HG GLU 41 -5.336 -2.571 9.230 358 H MET 42 H MET 42 -7.380 -1.809 11.313 359 HA MET 42 HA MET 42 -5.930 0.646 11.033 360 HB2 MET 42 2HB MET 42 -8.918 0.110 10.991 361 HB3 MET 42 3HB MET 42 -8.233 1.717 10.797 362 HG2 MET 42 2HG MET 42 -6.832 0.552 8.866 363 HG3 MET 42 3HG MET 42 -8.167 -0.598 8.900 364 HE1 MET 42 3HE MET 42 -8.492 3.876 7.896 365 HE2 MET 42 1HE MET 42 -7.003 3.029 8.310 366 HE3 MET 42 2HE MET 42 -8.216 3.351 9.555 367 H LYS 43 H LYS 43 -7.629 -0.806 13.761 368 HA LYS 43 HA LYS 43 -7.536 1.402 15.536 369 HB2 LYS 43 2HB LYS 43 -7.330 -1.590 15.956 370 HB3 LYS 43 3HB LYS 43 -6.936 -0.536 17.298 371 HG2 LYS 43 2HG LYS 43 -9.172 -1.249 17.600 372 HG3 LYS 43 3HG LYS 43 -9.234 0.445 17.141 373 HD2 LYS 43 2HD LYS 43 -9.603 -1.691 15.037 374 HD3 LYS 43 3HD LYS 43 -10.933 -1.308 16.124 375 HE2 LYS 43 2HE LYS 43 -9.549 0.663 14.272 376 HE3 LYS 43 3HE LYS 43 -11.121 -0.089 13.999 377 HZ1 LYS 43 3HZ LYS 43 -11.975 1.018 15.936 378 HZ2 LYS 43 1HZ LYS 43 -11.299 2.154 14.884 379 HZ3 LYS 43 2HZ LYS 43 -10.465 1.686 16.275 380 H LYS 44 H LYS 44 -5.101 -0.998 14.636 381 HA LYS 44 HA LYS 44 -2.963 0.047 16.216 382 HB2 LYS 44 2HB LYS 44 -3.273 -2.131 14.140 383 HB3 LYS 44 3HB LYS 44 -1.642 -1.576 14.480 384 HG2 LYS 44 2HG LYS 44 -3.572 -2.738 16.515 385 HG3 LYS 44 3HG LYS 44 -2.197 -3.574 15.785 386 HD2 LYS 44 2HD LYS 44 -2.084 -1.155 17.637 387 HD3 LYS 44 3HD LYS 44 -1.559 -2.798 18.005 388 HE2 LYS 44 2HE LYS 44 0.305 -2.633 16.465 389 HE3 LYS 44 3HE LYS 44 -0.302 -1.111 15.809 390 HZ1 LYS 44 3HZ LYS 44 0.728 -1.554 18.549 391 HZ2 LYS 44 1HZ LYS 44 0.047 -0.107 17.992 392 HZ3 LYS 44 2HZ LYS 44 1.484 -0.684 17.306 393 H LEU 45 H LEU 45 -4.167 0.947 13.100 394 HA LEU 45 HA LEU 45 -1.722 2.327 12.327 395 HB2 LEU 45 2HB LEU 45 -4.502 2.553 11.096 396 HB3 LEU 45 3HB LEU 45 -2.987 3.071 10.372 397 HG LEU 45 HG LEU 45 -3.853 0.205 10.881 398 HD11 LEU 45 1HD1 LEU 45 -3.504 1.674 8.270 399 HD12 LEU 45 2HD1 LEU 45 -5.024 1.170 9.010 400 HD13 LEU 45 3HD1 LEU 45 -3.877 -0.043 8.450 401 HD21 LEU 45 3HD2 LEU 45 -1.237 1.159 9.687 402 HD22 LEU 45 1HD2 LEU 45 -1.799 -0.515 9.738 403 HD23 LEU 45 2HD2 LEU 45 -1.458 0.341 11.238 404 H ALA 46 H ALA 46 -4.860 3.122 13.792 405 HA ALA 46 HA ALA 46 -4.485 6.005 13.386 406 HB1 ALA 46 3HB ALA 46 -6.607 4.944 12.762 407 HB2 ALA 46 1HB ALA 46 -6.850 6.159 14.019 408 HB3 ALA 46 2HB ALA 46 -6.865 4.441 14.433 409 H GLU 47 H GLU 47 -5.191 3.810 16.130 410 HA GLU 47 HA GLU 47 -5.643 6.113 17.840 411 HB2 GLU 47 2HB GLU 47 -6.092 3.151 18.339 412 HB3 GLU 47 3HB GLU 47 -6.548 4.438 19.464 413 HG2 GLU 47 2HG GLU 47 -8.027 5.419 17.726 414 HG3 GLU 47 3HG GLU 47 -7.593 4.107 16.631 415 H GLU 48 H GLU 48 -2.765 4.666 17.239 416 HA GLU 48 HA GLU 48 -1.845 6.057 19.699 417 HB2 GLU 48 2HB GLU 48 -0.002 4.583 20.070 418 HB3 GLU 48 3HB GLU 48 -1.429 3.570 19.947 419 HG2 GLU 48 2HG GLU 48 0.594 3.980 17.719 420 HG3 GLU 48 3HG GLU 48 0.627 2.635 18.853 421 H LYS 49 H LYS 49 -1.291 5.164 16.337 422 HA LYS 49 HA LYS 49 -0.441 6.231 14.558 423 HB2 LYS 49 2HB LYS 49 -1.993 8.015 15.558 424 HB3 LYS 49 3HB LYS 49 -0.556 8.774 16.223 425 HG2 LYS 49 2HG LYS 49 0.313 9.049 13.881 426 HG3 LYS 49 3HG LYS 49 -1.213 8.395 13.278 427 HD2 LYS 49 2HD LYS 49 -0.938 10.896 14.992 428 HD3 LYS 49 3HD LYS 49 -1.137 10.898 13.240 429 HE2 LYS 49 2HE LYS 49 -3.358 9.900 13.458 430 HE3 LYS 49 3HE LYS 49 -3.153 9.754 15.208 431 HZ1 LYS 49 3HZ LYS 49 -4.470 11.683 14.631 432 HZ2 LYS 49 1HZ LYS 49 -3.221 12.301 13.677 433 HZ3 LYS 49 2HZ LYS 49 -3.020 12.159 15.354 434 H ASN 50 H ASN 50 1.404 5.252 16.760 435 HA ASN 50 HA ASN 50 3.626 6.998 17.055 436 HB2 ASN 50 2HB ASN 50 4.803 5.088 18.046 437 HB3 ASN 50 3HB ASN 50 3.146 5.120 18.633 438 HD21 ASN 50 1HD2 ASN 50 5.183 2.899 18.298 439 HD22 ASN 50 2HD2 ASN 50 4.326 1.676 17.422 440 H PHE 51 H PHE 51 5.844 6.523 16.321 441 HA PHE 51 HA PHE 51 5.983 6.212 13.477 442 HB2 PHE 51 2HB PHE 51 7.430 7.834 14.671 443 HB3 PHE 51 3HB PHE 51 8.237 6.515 15.511 444 HD1 PHE 51 HD2 PHE 51 7.584 7.871 12.072 445 HD2 PHE 51 HD1 PHE 51 10.170 5.493 14.531 446 HE1 PHE 51 HE2 PHE 51 9.186 7.667 10.215 447 HE2 PHE 51 HE1 PHE 51 11.759 5.300 12.664 448 HZ PHE 51 HZ PHE 51 11.265 6.380 10.507 449 H GLU 52 H GLU 52 5.317 4.122 13.015 450 HA GLU 52 HA GLU 52 7.500 2.181 13.178 451 HB2 GLU 52 2HB GLU 52 5.974 0.286 13.597 452 HB3 GLU 52 3HB GLU 52 5.968 1.422 14.938 453 HG2 GLU 52 2HG GLU 52 3.811 2.309 14.239 454 HG3 GLU 52 3HG GLU 52 3.821 1.291 12.799 455 H LYS 53 H LYS 53 7.624 0.828 11.439 456 HA LYS 53 HA LYS 53 6.472 1.874 8.955 457 HB2 LYS 53 2HB LYS 53 8.816 -0.048 9.383 458 HB3 LYS 53 3HB LYS 53 8.397 0.783 7.886 459 HG2 LYS 53 2HG LYS 53 8.974 2.951 8.899 460 HG3 LYS 53 3HG LYS 53 9.314 2.161 10.438 461 HD2 LYS 53 2HD LYS 53 11.414 2.647 9.293 462 HD3 LYS 53 3HD LYS 53 11.183 0.903 9.359 463 HE2 LYS 53 2HE LYS 53 10.435 0.927 7.023 464 HE3 LYS 53 3HE LYS 53 10.616 2.679 6.968 465 HZ1 LYS 53 3HZ LYS 53 12.961 2.453 7.273 466 HZ2 LYS 53 1HZ LYS 53 12.493 1.465 5.987 467 HZ3 LYS 53 2HZ LYS 53 12.837 0.782 7.495 468 H ILE 54 H ILE 54 4.710 0.766 8.208 469 HA ILE 54 HA ILE 54 4.493 -2.160 8.695 470 HB ILE 54 HB ILE 54 2.179 -0.154 8.629 471 HG12 ILE 54 2HG1 ILE 54 3.338 -1.674 11.015 472 HG13 ILE 54 3HG1 ILE 54 3.496 0.056 10.730 473 HG21 ILE 54 1HG2 ILE 54 0.746 -2.065 9.285 474 HG22 ILE 54 2HG2 ILE 54 2.138 -3.144 9.200 475 HG23 ILE 54 3HG2 ILE 54 1.538 -2.367 7.735 476 HD11 ILE 54 3HD1 ILE 54 1.817 -0.404 12.408 477 HD12 ILE 54 1HD1 ILE 54 0.912 -1.416 11.281 478 HD13 ILE 54 2HD1 ILE 54 1.075 0.318 10.984 479 H LEU 55 H LEU 55 4.503 -3.277 6.823 480 HA LEU 55 HA LEU 55 3.544 -2.153 4.300 481 HB2 LEU 55 2HB LEU 55 5.428 -3.795 4.270 482 HB3 LEU 55 3HB LEU 55 4.386 -5.006 5.003 483 HG LEU 55 HG LEU 55 2.854 -4.732 2.915 484 HD11 LEU 55 1HD1 LEU 55 5.310 -3.347 1.829 485 HD12 LEU 55 2HD1 LEU 55 3.709 -2.645 2.080 486 HD13 LEU 55 3HD1 LEU 55 3.937 -3.905 0.873 487 HD21 LEU 55 3HD2 LEU 55 5.597 -5.932 2.451 488 HD22 LEU 55 1HD2 LEU 55 4.124 -6.290 1.544 489 HD23 LEU 55 2HD2 LEU 55 4.238 -6.727 3.247 490 H ILE 56 H ILE 56 1.340 -2.042 4.050 491 HA ILE 56 HA ILE 56 -0.395 -4.098 5.233 492 HB ILE 56 HB ILE 56 -1.164 -1.657 3.587 493 HG12 ILE 56 2HG1 ILE 56 -0.149 -1.035 5.796 494 HG13 ILE 56 3HG1 ILE 56 -1.845 -0.585 5.691 495 HG21 ILE 56 1HG2 ILE 56 -2.902 -3.589 5.169 496 HG22 ILE 56 2HG2 ILE 56 -2.864 -3.408 3.414 497 HG23 ILE 56 3HG2 ILE 56 -3.474 -2.096 4.422 498 HD11 ILE 56 3HD1 ILE 56 -1.279 -1.464 7.869 499 HD12 ILE 56 1HD1 ILE 56 -0.743 -2.982 7.153 500 HD13 ILE 56 2HD1 ILE 56 -2.446 -2.512 7.067 501 H LYS 57 H LYS 57 -1.263 -5.682 4.065 502 HA LYS 57 HA LYS 57 -0.627 -5.947 1.190 503 HB2 LYS 57 2HB LYS 57 0.651 -7.458 2.704 504 HB3 LYS 57 3HB LYS 57 -0.844 -8.051 3.405 505 HG2 LYS 57 2HG LYS 57 -0.313 -8.377 0.459 506 HG3 LYS 57 3HG LYS 57 0.435 -9.474 1.614 507 HD2 LYS 57 2HD LYS 57 -1.788 -10.206 2.386 508 HD3 LYS 57 3HD LYS 57 -2.572 -9.044 1.313 509 HE2 LYS 57 2HE LYS 57 -1.721 -10.205 -0.635 510 HE3 LYS 57 3HE LYS 57 -0.779 -11.296 0.377 511 HZ1 LYS 57 3HZ LYS 57 -2.805 -12.299 -0.445 512 HZ2 LYS 57 1HZ LYS 57 -3.736 -11.130 0.350 513 HZ3 LYS 57 2HZ LYS 57 -2.799 -12.218 1.242 514 H SER 58 H SER 58 -2.413 -6.135 -0.107 515 HA SER 58 HA SER 58 -4.746 -7.611 0.795 516 HB2 SER 58 2HB SER 58 -5.319 -5.331 1.593 517 HB3 SER 58 3HB SER 58 -5.052 -4.680 -0.024 518 HG SER 58 HG SER 58 -7.227 -5.019 0.164 519 H ASN 59 H ASN 59 -6.094 -8.273 -0.893 520 HA ASN 59 HA ASN 59 -4.966 -8.072 -3.628 521 HB2 ASN 59 2HB ASN 59 -6.875 -10.162 -2.493 522 HB3 ASN 59 3HB ASN 59 -6.161 -10.182 -4.101 523 HD21 ASN 59 1HD2 ASN 59 -3.906 -10.643 -4.304 524 HD22 ASN 59 2HD2 ASN 59 -3.058 -11.453 -3.036 525 H ASP 60 H ASP 60 -7.341 -6.729 -1.730 526 HA ASP 60 HA ASP 60 -9.167 -6.277 -4.024 527 HB2 ASP 60 2HB ASP 60 -10.302 -7.668 -2.337 528 HB3 ASP 60 3HB ASP 60 -9.911 -6.502 -1.073 529 H LYS 61 H LYS 61 -9.611 -4.287 -4.531 530 HA LYS 61 HA LYS 61 -8.027 -2.116 -3.471 531 HB2 LYS 61 2HB LYS 61 -8.982 -0.875 -5.475 532 HB3 LYS 61 3HB LYS 61 -8.061 -2.327 -5.830 533 HG2 LYS 61 2HG LYS 61 -10.278 -3.559 -6.023 534 HG3 LYS 61 3HG LYS 61 -11.071 -1.982 -5.955 535 HD2 LYS 61 2HD LYS 61 -10.210 -1.314 -8.048 536 HD3 LYS 61 3HD LYS 61 -8.879 -2.472 -7.991 537 HE2 LYS 61 2HE LYS 61 -10.533 -3.155 -9.660 538 HE3 LYS 61 3HE LYS 61 -10.475 -4.326 -8.346 539 HZ1 LYS 61 3HZ LYS 61 -12.741 -3.838 -9.029 540 HZ2 LYS 61 1HZ LYS 61 -12.529 -2.199 -8.668 541 HZ3 LYS 61 2HZ LYS 61 -12.487 -3.352 -7.433 542 H GLN 62 H GLN 62 -11.327 -3.113 -2.955 543 HA GLN 62 HA GLN 62 -12.505 -0.517 -2.565 544 HB2 GLN 62 2HB GLN 62 -13.427 -3.209 -1.456 545 HB3 GLN 62 3HB GLN 62 -14.382 -1.729 -1.471 546 HG2 GLN 62 2HG GLN 62 -13.453 -3.285 -3.902 547 HG3 GLN 62 3HG GLN 62 -15.088 -3.251 -3.245 548 HE21 GLN 62 1HE2 GLN 62 -16.313 -1.336 -3.444 549 HE22 GLN 62 2HE2 GLN 62 -15.950 -0.145 -4.635 550 H LEU 63 H LEU 63 -11.153 -2.986 -0.458 551 HA LEU 63 HA LEU 63 -11.565 -1.950 2.081 552 HB2 LEU 63 2HB LEU 63 -9.191 -3.558 1.056 553 HB3 LEU 63 3HB LEU 63 -9.634 -3.390 2.752 554 HG LEU 63 HG LEU 63 -11.422 -4.690 0.650 555 HD11 LEU 63 1HD1 LEU 63 -9.395 -6.025 0.931 556 HD12 LEU 63 2HD1 LEU 63 -10.809 -6.854 1.574 557 HD13 LEU 63 3HD1 LEU 63 -9.663 -6.086 2.674 558 HD21 LEU 63 3HD2 LEU 63 -11.658 -4.650 3.676 559 HD22 LEU 63 1HD2 LEU 63 -12.703 -5.547 2.570 560 HD23 LEU 63 2HD2 LEU 63 -12.689 -3.786 2.530 561 H LEU 64 H LEU 64 -9.127 -1.091 -0.297 562 HA LEU 64 HA LEU 64 -7.431 0.434 1.452 563 HB2 LEU 64 2HB LEU 64 -7.550 0.011 -1.534 564 HB3 LEU 64 3HB LEU 64 -6.548 1.297 -0.881 565 HG LEU 64 HG LEU 64 -5.259 -0.362 0.451 566 HD11 LEU 64 1HD1 LEU 64 -6.918 -2.470 -0.947 567 HD12 LEU 64 2HD1 LEU 64 -6.940 -2.093 0.778 568 HD13 LEU 64 3HD1 LEU 64 -5.487 -2.769 0.045 569 HD21 LEU 64 3HD2 LEU 64 -4.038 -1.365 -1.401 570 HD22 LEU 64 1HD2 LEU 64 -4.475 0.304 -1.755 571 HD23 LEU 64 2HD2 LEU 64 -5.381 -1.018 -2.496 572 H LYS 65 H LYS 65 -10.050 1.258 -0.874 573 HA LYS 65 HA LYS 65 -9.784 4.076 -0.712 574 HB2 LYS 65 2HB LYS 65 -12.292 2.425 -1.260 575 HB3 LYS 65 3HB LYS 65 -12.174 4.173 -1.484 576 HG2 LYS 65 2HG LYS 65 -10.330 3.774 -3.139 577 HG3 LYS 65 3HG LYS 65 -10.634 2.041 -2.996 578 HD2 LYS 65 2HD LYS 65 -12.613 4.135 -3.997 579 HD3 LYS 65 3HD LYS 65 -11.729 2.982 -4.997 580 HE2 LYS 65 2HE LYS 65 -12.909 1.117 -3.806 581 HE3 LYS 65 3HE LYS 65 -13.853 2.321 -2.924 582 HZ1 LYS 65 3HZ LYS 65 -14.644 3.147 -5.109 583 HZ2 LYS 65 1HZ LYS 65 -15.120 1.560 -4.776 584 HZ3 LYS 65 2HZ LYS 65 -13.856 1.853 -5.858 585 H GLU 66 H GLU 66 -11.771 1.778 1.119 586 HA GLU 66 HA GLU 66 -13.090 3.518 2.884 587 HB2 GLU 66 2HB GLU 66 -12.169 0.653 3.392 588 HB3 GLU 66 3HB GLU 66 -13.407 1.511 4.313 589 HG2 GLU 66 2HG GLU 66 -14.845 1.613 2.322 590 HG3 GLU 66 3HG GLU 66 -13.595 0.815 1.365 591 H MET 67 H MET 67 -9.955 1.895 3.109 592 HA MET 67 HA MET 67 -9.222 2.638 5.729 593 HB2 MET 67 2HB MET 67 -8.130 0.857 4.258 594 HB3 MET 67 3HB MET 67 -7.327 2.153 3.387 595 HG2 MET 67 2HG MET 67 -6.318 2.848 5.628 596 HG3 MET 67 3HG MET 67 -6.927 1.325 6.267 597 HE1 MET 67 3HE MET 67 -4.961 -1.212 3.905 598 HE2 MET 67 1HE MET 67 -6.585 -0.555 3.705 599 HE3 MET 67 2HE MET 67 -6.048 -1.128 5.286 600 H LEU 68 H LEU 68 -8.567 4.173 2.570 601 HA LEU 68 HA LEU 68 -6.782 6.176 3.471 602 HB2 LEU 68 2HB LEU 68 -8.390 5.857 0.920 603 HB3 LEU 68 3HB LEU 68 -7.320 7.231 1.163 604 HG LEU 68 HG LEU 68 -6.339 4.348 1.297 605 HD11 LEU 68 1HD1 LEU 68 -6.244 6.200 -1.102 606 HD12 LEU 68 2HD1 LEU 68 -7.231 4.744 -0.947 607 HD13 LEU 68 3HD1 LEU 68 -5.475 4.614 -0.974 608 HD21 LEU 68 3HD2 LEU 68 -4.911 5.973 2.450 609 HD22 LEU 68 1HD2 LEU 68 -4.837 6.971 0.992 610 HD23 LEU 68 2HD2 LEU 68 -4.121 5.356 1.003 611 H GLU 69 H GLU 69 -10.300 6.154 3.191 612 HA GLU 69 HA GLU 69 -10.783 8.942 3.401 613 HB2 GLU 69 2HB GLU 69 -12.540 6.618 4.302 614 HB3 GLU 69 3HB GLU 69 -13.082 8.288 4.114 615 HG2 GLU 69 2HG GLU 69 -12.640 8.205 1.711 616 HG3 GLU 69 3HG GLU 69 -11.978 6.583 1.863 617 H LEU 70 H LEU 70 -10.268 6.413 5.818 618 HA LEU 70 HA LEU 70 -10.694 8.154 8.095 619 HB2 LEU 70 2HB LEU 70 -9.524 5.355 7.971 620 HB3 LEU 70 3HB LEU 70 -10.015 6.193 9.436 621 HG LEU 70 HG LEU 70 -11.873 5.260 7.203 622 HD11 LEU 70 1HD1 LEU 70 -11.007 3.412 8.561 623 HD12 LEU 70 2HD1 LEU 70 -12.729 3.656 8.838 624 HD13 LEU 70 3HD1 LEU 70 -11.556 4.218 10.034 625 HD21 LEU 70 3HD2 LEU 70 -12.563 6.648 9.817 626 HD22 LEU 70 1HD2 LEU 70 -13.721 5.968 8.671 627 HD23 LEU 70 2HD2 LEU 70 -12.716 7.333 8.195 628 H ILE 71 H ILE 71 -7.939 6.850 6.279 629 HA ILE 71 HA ILE 71 -5.792 7.621 7.930 630 HB ILE 71 HB ILE 71 -5.956 7.249 4.908 631 HG12 ILE 71 2HG1 ILE 71 -4.668 5.526 7.077 632 HG13 ILE 71 3HG1 ILE 71 -6.185 5.180 6.259 633 HG21 ILE 71 1HG2 ILE 71 -3.412 7.778 6.484 634 HG22 ILE 71 2HG2 ILE 71 -4.149 8.868 5.308 635 HG23 ILE 71 3HG2 ILE 71 -3.495 7.323 4.782 636 HD11 ILE 71 3HD1 ILE 71 -4.951 4.948 4.127 637 HD12 ILE 71 1HD1 ILE 71 -4.428 3.802 5.361 638 HD13 ILE 71 2HD1 ILE 71 -3.438 5.214 4.999 639 H SER 72 H SER 72 -7.676 9.398 5.541 640 HA SER 72 HA SER 72 -6.178 11.716 5.223 641 HB2 SER 72 2HB SER 72 -8.189 11.141 3.877 642 HB3 SER 72 3HB SER 72 -9.217 11.471 5.271 643 HG SER 72 HG SER 72 -9.212 13.311 4.127 644 H LYS 73 H LYS 73 -8.324 10.744 7.824 645 HA LYS 73 HA LYS 73 -8.489 13.317 9.119 646 HB2 LYS 73 2HB LYS 73 -9.113 10.627 10.406 647 HB3 LYS 73 3HB LYS 73 -9.811 12.198 10.785 648 HG2 LYS 73 2HG LYS 73 -10.323 10.515 8.313 649 HG3 LYS 73 3HG LYS 73 -11.449 10.818 9.640 650 HD2 LYS 73 2HD LYS 73 -11.559 13.211 9.011 651 HD3 LYS 73 3HD LYS 73 -10.388 12.936 7.716 652 HE2 LYS 73 2HE LYS 73 -12.006 11.356 6.651 653 HE3 LYS 73 3HE LYS 73 -13.182 11.761 7.906 654 HZ1 LYS 73 3HZ LYS 73 -13.485 13.004 5.826 655 HZ2 LYS 73 1HZ LYS 73 -11.969 13.720 6.038 656 HZ3 LYS 73 2HZ LYS 73 -13.210 14.017 7.150 657 H LEU 74 H LEU 74 -6.580 10.380 9.411 658 HA LEU 74 HA LEU 74 -5.330 10.894 11.930 659 HB2 LEU 74 2HB LEU 74 -4.327 9.068 9.705 660 HB3 LEU 74 3HB LEU 74 -3.970 8.941 11.423 661 HG LEU 74 HG LEU 74 -6.686 8.459 10.142 662 HD11 LEU 74 1HD1 LEU 74 -4.760 6.432 11.299 663 HD12 LEU 74 2HD1 LEU 74 -5.111 6.682 9.587 664 HD13 LEU 74 3HD1 LEU 74 -6.377 6.101 10.664 665 HD21 LEU 74 3HD2 LEU 74 -6.953 9.361 12.381 666 HD22 LEU 74 1HD2 LEU 74 -5.860 8.137 13.037 667 HD23 LEU 74 2HD2 LEU 74 -7.413 7.664 12.340 668 H GLY 75 H GLY 75 -4.389 11.348 8.558 669 HA2 GLY 75 2HA GLY 75 -2.944 12.747 7.514 670 HA3 GLY 75 3HA GLY 75 -2.702 13.577 9.041 671 H TYR 76 H TYR 76 -1.657 10.805 7.078 672 HA TYR 76 HA TYR 76 1.083 11.314 7.827 673 HB2 TYR 76 2HB TYR 76 1.619 8.956 8.475 674 HB3 TYR 76 3HB TYR 76 0.609 9.791 9.635 675 HD1 TYR 76 HD2 TYR 76 0.317 7.371 6.747 676 HD2 TYR 76 HD1 TYR 76 -1.289 8.685 10.490 677 HE1 TYR 76 HE2 TYR 76 -1.215 5.452 6.763 678 HE2 TYR 76 HE1 TYR 76 -2.803 6.754 10.506 679 HH TYR 76 HH TYR 76 -2.479 4.111 8.402 680 H LYS 77 H LYS 77 2.578 9.718 6.651 681 HA LYS 77 HA LYS 77 2.049 10.105 3.869 682 HB2 LYS 77 2HB LYS 77 4.302 10.429 4.895 683 HB3 LYS 77 3HB LYS 77 4.389 8.703 5.222 684 HG2 LYS 77 2HG LYS 77 5.700 9.119 3.263 685 HG3 LYS 77 3HG LYS 77 4.232 8.287 2.736 686 HD2 LYS 77 2HD LYS 77 3.271 10.563 2.145 687 HD3 LYS 77 3HD LYS 77 4.860 11.252 2.499 688 HE2 LYS 77 2HE LYS 77 4.587 10.891 0.088 689 HE3 LYS 77 3HE LYS 77 5.853 9.840 0.727 690 HZ1 LYS 77 3HZ LYS 77 4.310 8.006 0.736 691 HZ2 LYS 77 1HZ LYS 77 4.362 8.694 -0.804 692 HZ3 LYS 77 2HZ LYS 77 3.046 8.999 0.216 693 H VAL 78 H VAL 78 1.257 8.702 2.438 694 HA VAL 78 HA VAL 78 1.133 5.801 3.033 695 HB VAL 78 HB VAL 78 -0.832 7.472 1.389 696 HG11 VAL 78 1HG1 VAL 78 -2.197 5.411 1.233 697 HG12 VAL 78 2HG1 VAL 78 -0.932 4.507 2.065 698 HG13 VAL 78 3HG1 VAL 78 -0.621 5.189 0.467 699 HG21 VAL 78 3HG2 VAL 78 -1.212 6.143 4.097 700 HG22 VAL 78 1HG2 VAL 78 -2.463 6.991 3.180 701 HG23 VAL 78 2HG2 VAL 78 -1.072 7.879 3.807 702 H PHE 79 H PHE 79 2.023 4.474 1.561 703 HA PHE 79 HA PHE 79 2.835 5.489 -1.107 704 HB2 PHE 79 2HB PHE 79 3.992 3.169 0.516 705 HB3 PHE 79 3HB PHE 79 4.593 3.762 -1.024 706 HD1 PHE 79 HD1 PHE 79 5.629 6.080 -1.125 707 HD2 PHE 79 HD2 PHE 79 4.762 4.124 2.579 708 HE1 PHE 79 HE1 PHE 79 7.205 7.545 0.032 709 HE2 PHE 79 HE2 PHE 79 6.346 5.607 3.728 710 HZ PHE 79 HZ PHE 79 7.577 7.317 2.453 711 H LEU 80 H LEU 80 1.233 4.753 -2.505 712 HA LEU 80 HA LEU 80 0.080 2.059 -2.067 713 HB2 LEU 80 2HB LEU 80 -1.620 3.736 -1.785 714 HB3 LEU 80 3HB LEU 80 -1.165 4.555 -3.267 715 HG LEU 80 HG LEU 80 -2.122 2.759 -4.637 716 HD11 LEU 80 1HD1 LEU 80 -2.772 1.268 -2.092 717 HD12 LEU 80 2HD1 LEU 80 -1.556 0.815 -3.286 718 HD13 LEU 80 3HD1 LEU 80 -3.259 0.811 -3.727 719 HD21 LEU 80 3HD2 LEU 80 -3.684 4.483 -3.888 720 HD22 LEU 80 1HD2 LEU 80 -4.072 3.538 -2.447 721 HD23 LEU 80 2HD2 LEU 80 -4.497 2.929 -4.051 722 H LEU 81 H LEU 81 0.175 0.600 -3.622 723 HA LEU 81 HA LEU 81 1.120 1.293 -6.327 724 HB2 LEU 81 2HB LEU 81 3.028 0.427 -5.040 725 HB3 LEU 81 3HB LEU 81 2.101 -0.984 -4.560 726 HG LEU 81 HG LEU 81 2.086 -1.811 -6.892 727 HD11 LEU 81 1HD1 LEU 81 3.655 0.691 -7.565 728 HD12 LEU 81 2HD1 LEU 81 2.044 0.251 -8.137 729 HD13 LEU 81 3HD1 LEU 81 3.443 -0.692 -8.640 730 HD21 LEU 81 3HD2 LEU 81 4.479 -2.348 -7.105 731 HD22 LEU 81 1HD2 LEU 81 3.921 -2.507 -5.440 732 HD23 LEU 81 2HD2 LEU 81 4.873 -1.099 -5.921 733 H LEU 82 H LEU 82 -0.169 0.492 -7.827 734 HA LEU 82 HA LEU 82 -2.071 -1.710 -7.261 735 HB2 LEU 82 2HB LEU 82 -2.123 0.392 -9.472 736 HB3 LEU 82 3HB LEU 82 -3.380 -0.795 -9.143 737 HG LEU 82 HG LEU 82 -2.598 1.473 -7.263 738 HD11 LEU 82 1HD1 LEU 82 -4.669 2.558 -7.924 739 HD12 LEU 82 2HD1 LEU 82 -5.008 1.271 -9.084 740 HD13 LEU 82 3HD1 LEU 82 -3.613 2.329 -9.315 741 HD21 LEU 82 3HD2 LEU 82 -3.503 -0.442 -6.039 742 HD22 LEU 82 1HD2 LEU 82 -4.921 -0.484 -7.093 743 HD23 LEU 82 2HD2 LEU 82 -4.647 0.896 -6.023 744 H ALA 83 H ALA 83 -1.927 -3.556 -8.543 745 HA ALA 83 HA ALA 83 -0.311 -3.546 -10.982 746 HB1 ALA 83 3HB ALA 83 1.118 -5.411 -10.269 747 HB2 ALA 83 1HB ALA 83 0.381 -5.384 -8.660 748 HB3 ALA 83 2HB ALA 83 1.338 -4.014 -9.218 749 H ASP 84 H ASP 84 -1.550 -4.456 -12.424 750 HA ASP 84 HA ASP 84 -2.315 -7.159 -12.386 751 HB2 ASP 84 2HB ASP 84 -4.197 -6.465 -10.932 752 HB3 ASP 84 3HB ASP 84 -4.640 -5.190 -12.062 753 H GLN 85 H GLN 85 -3.399 -7.766 -14.405 754 HA GLN 85 HA GLN 85 -2.295 -6.560 -16.687 755 HB2 GLN 85 2HB GLN 85 -4.565 -8.575 -16.441 756 HB3 GLN 85 3HB GLN 85 -3.689 -8.219 -17.927 757 HG2 GLN 85 2HG GLN 85 -1.597 -9.054 -16.891 758 HG3 GLN 85 3HG GLN 85 -2.476 -9.415 -15.408 759 HE21 GLN 85 1HE2 GLN 85 -4.848 -10.461 -16.785 760 HE22 GLN 85 2HE2 GLN 85 -4.390 -11.988 -17.441 761 H ASP 86 H ASP 86 -5.588 -6.344 -15.286 762 HA ASP 86 HA ASP 86 -6.547 -4.520 -17.334 763 HB2 ASP 86 2HB ASP 86 -7.748 -5.555 -14.743 764 HB3 ASP 86 3HB ASP 86 -8.489 -4.202 -15.589 765 H GLU 87 H GLU 87 -4.826 -3.069 -17.229 766 HA GLU 87 HA GLU 87 -4.251 -1.489 -14.885 767 HB2 GLU 87 2HB GLU 87 -2.529 -0.454 -16.177 768 HB3 GLU 87 3HB GLU 87 -2.525 -2.145 -16.636 769 HG2 GLU 87 2HG GLU 87 -3.746 0.106 -18.273 770 HG3 GLU 87 3HG GLU 87 -2.154 -0.594 -18.540 771 H ASN 88 H ASN 88 -6.558 -1.309 -17.397 772 HA ASN 88 HA ASN 88 -6.918 1.440 -17.851 773 HB2 ASN 88 2HB ASN 88 -8.065 -0.313 -19.193 774 HB3 ASN 88 3HB ASN 88 -9.061 -0.745 -17.809 775 HD21 ASN 88 1HD2 ASN 88 -10.707 0.742 -17.132 776 HD22 ASN 88 2HD2 ASN 88 -11.312 1.946 -18.211 777 H GLU 89 H GLU 89 -8.678 -0.669 -15.564 778 HA GLU 89 HA GLU 89 -10.147 1.476 -14.375 779 HB2 GLU 89 2HB GLU 89 -11.013 -0.207 -12.834 780 HB3 GLU 89 3HB GLU 89 -11.061 -0.794 -14.491 781 HG2 GLU 89 2HG GLU 89 -9.079 -2.191 -14.091 782 HG3 GLU 89 3HG GLU 89 -8.944 -1.557 -12.449 783 H LEU 90 H LEU 90 -7.135 -0.168 -13.637 784 HA LEU 90 HA LEU 90 -6.771 0.872 -11.001 785 HB2 LEU 90 2HB LEU 90 -4.715 -0.126 -13.014 786 HB3 LEU 90 3HB LEU 90 -4.382 0.219 -11.323 787 HG LEU 90 HG LEU 90 -6.150 -2.008 -12.396 788 HD11 LEU 90 1HD1 LEU 90 -4.442 -3.490 -11.391 789 HD12 LEU 90 2HD1 LEU 90 -3.464 -2.077 -10.985 790 HD13 LEU 90 3HD1 LEU 90 -3.789 -2.475 -12.676 791 HD21 LEU 90 3HD2 LEU 90 -5.580 -1.272 -9.500 792 HD22 LEU 90 1HD2 LEU 90 -6.415 -2.730 -10.048 793 HD23 LEU 90 2HD2 LEU 90 -7.136 -1.150 -10.330 794 H GLU 91 H GLU 91 -6.049 2.022 -14.252 795 HA GLU 91 HA GLU 91 -4.403 4.234 -13.622 796 HB2 GLU 91 2HB GLU 91 -4.792 3.246 -15.955 797 HB3 GLU 91 3HB GLU 91 -6.360 4.037 -15.957 798 HG2 GLU 91 2HG GLU 91 -4.915 5.456 -17.211 799 HG3 GLU 91 3HG GLU 91 -5.130 6.251 -15.651 800 H GLU 92 H GLU 92 -7.908 3.852 -14.071 801 HA GLU 92 HA GLU 92 -8.751 6.493 -13.546 802 HB2 GLU 92 2HB GLU 92 -10.245 3.872 -13.073 803 HB3 GLU 92 3HB GLU 92 -10.987 5.472 -13.148 804 HG2 GLU 92 2HG GLU 92 -10.283 5.687 -15.511 805 HG3 GLU 92 3HG GLU 92 -9.533 4.092 -15.427 806 H PHE 93 H PHE 93 -8.437 3.654 -11.440 807 HA PHE 93 HA PHE 93 -9.393 4.614 -9.014 808 HB2 PHE 93 2HB PHE 93 -8.809 2.214 -9.574 809 HB3 PHE 93 3HB PHE 93 -7.109 2.623 -9.426 810 HD1 PHE 93 HD2 PHE 93 -6.154 3.189 -7.138 811 HD2 PHE 93 HD1 PHE 93 -10.162 1.776 -7.626 812 HE1 PHE 93 HE2 PHE 93 -6.229 2.600 -4.757 813 HE2 PHE 93 HE1 PHE 93 -10.224 1.191 -5.246 814 HZ PHE 93 HZ PHE 93 -8.266 1.595 -3.809 815 H LYS 94 H LYS 94 -6.038 4.635 -10.258 816 HA LYS 94 HA LYS 94 -4.940 5.891 -7.935 817 HB2 LYS 94 2HB LYS 94 -2.839 5.934 -9.090 818 HB3 LYS 94 3HB LYS 94 -3.606 4.392 -9.404 819 HG2 LYS 94 2HG LYS 94 -3.667 4.719 -11.654 820 HG3 LYS 94 3HG LYS 94 -4.165 6.401 -11.510 821 HD2 LYS 94 2HD LYS 94 -1.320 5.362 -11.187 822 HD3 LYS 94 3HD LYS 94 -1.964 6.182 -12.612 823 HE2 LYS 94 2HE LYS 94 -2.394 8.209 -11.209 824 HE3 LYS 94 3HE LYS 94 -1.654 7.381 -9.836 825 HZ1 LYS 94 3HZ LYS 94 0.400 7.228 -11.112 826 HZ2 LYS 94 1HZ LYS 94 -0.083 8.835 -10.895 827 HZ3 LYS 94 2HZ LYS 94 -0.309 8.075 -12.387 828 H ARG 95 H ARG 95 -6.407 7.106 -10.878 829 HA ARG 95 HA ARG 95 -5.327 9.726 -10.872 830 HB2 ARG 95 2HB ARG 95 -7.947 8.612 -11.922 831 HB3 ARG 95 3HB ARG 95 -7.586 10.328 -12.040 832 HG2 ARG 95 2HG ARG 95 -5.723 8.233 -13.187 833 HG3 ARG 95 3HG ARG 95 -7.106 8.845 -14.096 834 HD2 ARG 95 2HD ARG 95 -5.109 10.047 -14.758 835 HD3 ARG 95 3HD ARG 95 -6.186 11.147 -13.899 836 HE ARG 95 HE ARG 95 -3.996 9.887 -12.397 837 HH11 ARG 95 1HH1 ARG 95 -5.218 12.800 -13.956 838 HH12 ARG 95 2HH1 ARG 95 -4.098 13.841 -13.147 839 HH21 ARG 95 1HH2 ARG 95 -2.545 11.277 -11.347 840 HH22 ARG 95 2HH2 ARG 95 -2.586 12.977 -11.676 841 H LYS 96 H LYS 96 -8.217 8.359 -9.249 842 HA LYS 96 HA LYS 96 -9.087 10.741 -7.971 843 HB2 LYS 96 2HB LYS 96 -9.518 7.821 -7.236 844 HB3 LYS 96 3HB LYS 96 -10.165 9.122 -6.251 845 HG2 LYS 96 2HG LYS 96 -11.952 8.404 -7.602 846 HG3 LYS 96 3HG LYS 96 -11.410 9.923 -8.319 847 HD2 LYS 96 2HD LYS 96 -10.288 8.748 -10.119 848 HD3 LYS 96 3HD LYS 96 -10.547 7.191 -9.326 849 HE2 LYS 96 2HE LYS 96 -12.754 8.974 -10.406 850 HE3 LYS 96 3HE LYS 96 -12.104 7.547 -11.217 851 HZ1 LYS 96 3HZ LYS 96 -12.782 6.245 -9.234 852 HZ2 LYS 96 1HZ LYS 96 -14.084 6.931 -10.076 853 HZ3 LYS 96 2HZ LYS 96 -13.554 7.627 -8.631 854 H ILE 97 H ILE 97 -7.086 8.033 -6.783 855 HA ILE 97 HA ILE 97 -6.810 8.962 -4.131 856 HB ILE 97 HB ILE 97 -4.972 7.035 -5.626 857 HG12 ILE 97 2HG1 ILE 97 -7.256 6.213 -5.818 858 HG13 ILE 97 3HG1 ILE 97 -6.423 5.216 -4.639 859 HG21 ILE 97 1HG2 ILE 97 -5.439 7.344 -2.636 860 HG22 ILE 97 2HG2 ILE 97 -3.969 7.770 -3.517 861 HG23 ILE 97 3HG2 ILE 97 -4.465 6.083 -3.395 862 HD11 ILE 97 3HD1 ILE 97 -8.460 7.376 -4.085 863 HD12 ILE 97 1HD1 ILE 97 -7.560 6.510 -2.834 864 HD13 ILE 97 2HD1 ILE 97 -8.656 5.636 -3.901 865 H GLU 98 H GLU 98 -4.753 9.417 -6.983 866 HA GLU 98 HA GLU 98 -2.558 10.675 -5.645 867 HB2 GLU 98 2HB GLU 98 -2.460 9.506 -7.886 868 HB3 GLU 98 3HB GLU 98 -3.299 10.875 -8.596 869 HG2 GLU 98 2HG GLU 98 -1.431 12.319 -8.274 870 HG3 GLU 98 3HG GLU 98 -0.673 11.209 -7.130 871 H SER 99 H SER 99 -5.530 11.797 -7.129 872 HA SER 99 HA SER 99 -4.937 14.613 -7.027 873 HB2 SER 99 2HB SER 99 -6.562 13.655 -8.652 874 HB3 SER 99 3HB SER 99 -7.617 13.185 -7.320 875 HG SER 99 HG SER 99 -8.209 15.172 -8.316 876 H GLN 100 H GLN 100 -6.297 12.232 -4.849 877 HA GLN 100 HA GLN 100 -7.381 14.056 -2.892 878 HB2 GLN 100 2HB GLN 100 -6.738 11.078 -2.795 879 HB3 GLN 100 3HB GLN 100 -7.509 11.947 -1.470 880 HG2 GLN 100 2HG GLN 100 -9.460 12.420 -2.837 881 HG3 GLN 100 3HG GLN 100 -8.676 11.752 -4.265 882 HE21 GLN 100 1HE2 GLN 100 -8.545 10.245 -1.057 883 HE22 GLN 100 2HE2 GLN 100 -9.497 8.872 -1.480 884 H GLY 101 H GLY 101 -4.212 13.153 -3.707 885 HA2 GLY 101 2HA GLY 101 -2.387 14.394 -2.874 886 HA3 GLY 101 3HA GLY 101 -3.200 14.582 -1.329 887 H TYR 102 H TYR 102 -3.164 11.408 -2.740 888 HA TYR 102 HA TYR 102 -1.046 10.536 -0.853 889 HB2 TYR 102 2HB TYR 102 -3.095 8.795 -2.300 890 HB3 TYR 102 3HB TYR 102 -1.979 8.278 -1.040 891 HD1 TYR 102 HD2 TYR 102 -2.248 9.368 1.310 892 HD2 TYR 102 HD1 TYR 102 -5.272 9.536 -1.710 893 HE1 TYR 102 HE2 TYR 102 -3.926 9.901 3.018 894 HE2 TYR 102 HE1 TYR 102 -6.949 10.071 -0.000 895 HH TYR 102 HH TYR 102 -6.114 11.036 3.116 896 H GLU 103 H GLU 103 0.689 9.330 -1.612 897 HA GLU 103 HA GLU 103 1.375 9.513 -4.398 898 HB2 GLU 103 2HB GLU 103 3.142 9.738 -2.723 899 HB3 GLU 103 3HB GLU 103 2.778 8.148 -2.058 900 HG2 GLU 103 2HG GLU 103 3.579 7.057 -4.069 901 HG3 GLU 103 3HG GLU 103 3.750 8.603 -4.896 902 H VAL 104 H VAL 104 0.551 8.147 -5.847 903 HA VAL 104 HA VAL 104 0.370 5.287 -5.219 904 HB VAL 104 HB VAL 104 -1.902 5.982 -4.877 905 HG11 VAL 104 1HG1 VAL 104 -3.268 7.140 -6.564 906 HG12 VAL 104 2HG1 VAL 104 -1.848 7.316 -7.598 907 HG13 VAL 104 3HG1 VAL 104 -1.905 8.131 -6.033 908 HG21 VAL 104 3HG2 VAL 104 -1.712 4.671 -7.620 909 HG22 VAL 104 1HG2 VAL 104 -3.103 4.613 -6.531 910 HG23 VAL 104 2HG2 VAL 104 -1.586 3.837 -6.071 911 H ARG 105 H ARG 105 1.247 4.119 -6.668 912 HA ARG 105 HA ARG 105 1.829 5.121 -9.391 913 HB2 ARG 105 2HB ARG 105 3.285 2.910 -7.871 914 HB3 ARG 105 3HB ARG 105 3.786 3.693 -9.365 915 HG2 ARG 105 2HG ARG 105 3.684 4.998 -6.619 916 HG3 ARG 105 3HG ARG 105 5.136 4.445 -7.452 917 HD2 ARG 105 2HD ARG 105 4.760 6.113 -9.227 918 HD3 ARG 105 3HD ARG 105 3.287 6.654 -8.411 919 HE ARG 105 HE ARG 105 5.497 6.800 -6.648 920 HH11 ARG 105 1HH1 ARG 105 4.107 8.493 -9.407 921 HH12 ARG 105 2HH1 ARG 105 4.812 10.012 -8.976 922 HH21 ARG 105 1HH2 ARG 105 6.435 8.800 -6.127 923 HH22 ARG 105 2HH2 ARG 105 6.127 10.186 -7.120 924 H LYS 106 H LYS 106 1.513 3.580 -11.112 925 HA LYS 106 HA LYS 106 -0.126 1.198 -10.464 926 HB2 LYS 106 2HB LYS 106 -1.572 3.162 -11.079 927 HB3 LYS 106 3HB LYS 106 -0.791 3.225 -12.652 928 HG2 LYS 106 2HG LYS 106 -2.214 0.729 -11.708 929 HG3 LYS 106 3HG LYS 106 -3.111 2.061 -12.414 930 HD2 LYS 106 2HD LYS 106 -0.841 0.636 -13.860 931 HD3 LYS 106 3HD LYS 106 -2.529 0.145 -13.983 932 HE2 LYS 106 2HE LYS 106 -1.934 1.511 -15.899 933 HE3 LYS 106 3HE LYS 106 -3.102 2.374 -14.905 934 HZ1 LYS 106 3HZ LYS 106 -1.183 3.688 -15.812 935 HZ2 LYS 106 1HZ LYS 106 -0.184 2.863 -14.724 936 HZ3 LYS 106 2HZ LYS 106 -1.445 3.839 -14.149 937 H VAL 107 H VAL 107 0.875 -0.483 -11.242 938 HA VAL 107 HA VAL 107 2.478 -0.371 -13.736 939 HB VAL 107 HB VAL 107 4.105 -1.914 -12.724 940 HG11 VAL 107 1HG1 VAL 107 5.141 -0.439 -11.022 941 HG12 VAL 107 2HG1 VAL 107 3.643 0.491 -10.914 942 HG13 VAL 107 3HG1 VAL 107 4.569 0.478 -12.418 943 HG21 VAL 107 3HG2 VAL 107 3.992 -2.526 -10.308 944 HG22 VAL 107 1HG2 VAL 107 2.646 -3.189 -11.236 945 HG23 VAL 107 2HG2 VAL 107 2.401 -1.774 -10.209 946 H THR 108 H THR 108 2.997 -2.782 -14.362 947 HA THR 108 HA THR 108 0.641 -4.556 -14.051 948 HB THR 108 HB THR 108 1.139 -5.340 -16.448 949 HG1 THR 108 HG1 THR 108 3.049 -4.589 -17.059 950 HG21 THR 108 3HG2 THR 108 0.283 -2.434 -16.146 951 HG22 THR 108 1HG2 THR 108 -0.776 -3.841 -16.012 952 HG23 THR 108 2HG2 THR 108 -0.017 -3.451 -17.556 953 H ASP 109 H ASP 109 4.100 -4.362 -14.932 954 HA ASP 109 HA ASP 109 4.566 -7.190 -14.768 955 HB2 ASP 109 2HB ASP 109 6.504 -4.848 -14.988 956 HB3 ASP 109 3HB ASP 109 7.002 -6.535 -15.065 957 H ASP 110 H ASP 110 5.979 -8.267 -13.395 958 HA ASP 110 HA ASP 110 5.704 -7.815 -10.609 959 HB2 ASP 110 2HB ASP 110 5.902 -10.087 -11.335 960 HB3 ASP 110 3HB ASP 110 7.344 -9.755 -12.279 961 H GLU 111 H GLU 111 8.557 -7.653 -12.765 962 HA GLU 111 HA GLU 111 10.426 -6.839 -10.807 963 HB2 GLU 111 2HB GLU 111 11.923 -6.329 -12.713 964 HB3 GLU 111 3HB GLU 111 11.127 -7.887 -12.910 965 HG2 GLU 111 2HG GLU 111 9.490 -6.834 -14.469 966 HG3 GLU 111 3HG GLU 111 10.351 -5.306 -14.313 967 H GLU 112 H GLU 112 8.345 -5.027 -12.990 968 HA GLU 112 HA GLU 112 9.340 -2.433 -12.567 969 HB2 GLU 112 2HB GLU 112 7.867 -3.123 -14.461 970 HB3 GLU 112 3HB GLU 112 6.531 -3.329 -13.341 971 HG2 GLU 112 2HG GLU 112 6.422 -1.216 -14.657 972 HG3 GLU 112 3HG GLU 112 6.425 -0.959 -12.913 973 H ALA 113 H ALA 113 6.811 -4.335 -10.928 974 HA ALA 113 HA ALA 113 5.940 -2.329 -9.119 975 HB1 ALA 113 3HB ALA 113 5.752 -5.341 -8.870 976 HB2 ALA 113 1HB ALA 113 4.594 -4.293 -9.686 977 HB3 ALA 113 2HB ALA 113 4.821 -4.158 -7.943 978 H LEU 114 H LEU 114 8.319 -4.988 -8.758 979 HA LEU 114 HA LEU 114 8.970 -4.634 -6.038 980 HB2 LEU 114 2HB LEU 114 10.679 -5.699 -8.322 981 HB3 LEU 114 3HB LEU 114 11.152 -5.790 -6.631 982 HG LEU 114 HG LEU 114 8.725 -7.171 -7.853 983 HD11 LEU 114 1HD1 LEU 114 10.840 -8.170 -8.592 984 HD12 LEU 114 2HD1 LEU 114 9.955 -9.250 -7.520 985 HD13 LEU 114 3HD1 LEU 114 11.353 -8.358 -6.911 986 HD21 LEU 114 3HD2 LEU 114 8.308 -6.577 -5.515 987 HD22 LEU 114 1HD2 LEU 114 9.828 -7.330 -5.023 988 HD23 LEU 114 2HD2 LEU 114 8.517 -8.317 -5.679 989 H LYS 115 H LYS 115 10.174 -3.098 -8.965 990 HA LYS 115 HA LYS 115 12.288 -1.556 -7.949 991 HB2 LYS 115 2HB LYS 115 11.964 -1.816 -10.333 992 HB3 LYS 115 3HB LYS 115 10.334 -1.163 -10.236 993 HG2 LYS 115 2HG LYS 115 11.500 1.044 -9.441 994 HG3 LYS 115 3HG LYS 115 12.969 0.314 -10.100 995 HD2 LYS 115 2HD LYS 115 10.390 0.706 -11.652 996 HD3 LYS 115 3HD LYS 115 11.755 1.828 -11.701 997 HE2 LYS 115 2HE LYS 115 13.175 0.007 -12.635 998 HE3 LYS 115 3HE LYS 115 11.776 -1.073 -12.606 999 HZ1 LYS 115 3HZ LYS 115 10.643 0.378 -14.150 1000 HZ2 LYS 115 1HZ LYS 115 12.132 -0.096 -14.793 1001 HZ3 LYS 115 2HZ LYS 115 11.946 1.458 -14.158 1002 H ILE 116 H ILE 116 8.796 -0.907 -8.309 1003 HA ILE 116 HA ILE 116 8.860 1.779 -7.415 1004 HB ILE 116 HB ILE 116 6.523 -0.154 -7.636 1005 HG12 ILE 116 2HG1 ILE 116 7.548 0.270 -9.815 1006 HG13 ILE 116 3HG1 ILE 116 6.015 1.117 -9.745 1007 HG21 ILE 116 1HG2 ILE 116 5.062 1.846 -7.597 1008 HG22 ILE 116 2HG2 ILE 116 6.460 2.852 -7.220 1009 HG23 ILE 116 3HG2 ILE 116 5.923 1.622 -6.074 1010 HD11 ILE 116 3HD1 ILE 116 7.702 2.431 -10.857 1011 HD12 ILE 116 1HD1 ILE 116 8.753 2.352 -9.446 1012 HD13 ILE 116 2HD1 ILE 116 7.218 3.226 -9.359 1013 H VAL 117 H VAL 117 8.364 -1.263 -5.680 1014 HA VAL 117 HA VAL 117 7.673 -0.211 -3.143 1015 HB VAL 117 HB VAL 117 9.246 -2.752 -3.792 1016 HG11 VAL 117 1HG1 VAL 117 7.779 -2.009 -1.224 1017 HG12 VAL 117 2HG1 VAL 117 9.528 -2.149 -1.417 1018 HG13 VAL 117 3HG1 VAL 117 8.508 -3.581 -1.569 1019 HG21 VAL 117 3HG2 VAL 117 7.069 -3.907 -3.626 1020 HG22 VAL 117 1HG2 VAL 117 7.041 -2.684 -4.896 1021 HG23 VAL 117 2HG2 VAL 117 6.258 -2.364 -3.346 1022 H ARG 118 H ARG 118 10.798 -0.812 -4.699 1023 HA ARG 118 HA ARG 118 12.455 0.039 -2.514 1024 HB2 ARG 118 2HB ARG 118 13.095 -0.327 -5.468 1025 HB3 ARG 118 3HB ARG 118 14.302 -0.057 -4.211 1026 HG2 ARG 118 2HG ARG 118 13.815 -2.190 -3.178 1027 HG3 ARG 118 3HG ARG 118 12.408 -2.436 -4.216 1028 HD2 ARG 118 2HD ARG 118 13.897 -2.557 -6.189 1029 HD3 ARG 118 3HD ARG 118 15.301 -2.325 -5.140 1030 HE ARG 118 HE ARG 118 13.753 -4.566 -4.297 1031 HH11 ARG 118 1HH1 ARG 118 16.054 -3.614 -6.792 1032 HH12 ARG 118 2HH1 ARG 118 16.628 -5.232 -7.039 1033 HH21 ARG 118 1HH2 ARG 118 14.535 -6.671 -4.636 1034 HH22 ARG 118 2HH2 ARG 118 15.770 -6.958 -5.820 1035 H GLU 119 H GLU 119 10.910 1.663 -5.230 1036 HA GLU 119 HA GLU 119 12.195 4.180 -5.123 1037 HB2 GLU 119 2HB GLU 119 9.327 3.451 -5.876 1038 HB3 GLU 119 3HB GLU 119 10.014 5.051 -6.114 1039 HG2 GLU 119 2HG GLU 119 11.215 2.592 -7.397 1040 HG3 GLU 119 3HG GLU 119 9.872 3.457 -8.133 1041 H PHE 120 H PHE 120 9.302 2.877 -3.516 1042 HA PHE 120 HA PHE 120 8.547 5.047 -1.941 1043 HB2 PHE 120 2HB PHE 120 8.202 2.060 -1.433 1044 HB3 PHE 120 3HB PHE 120 7.397 3.311 -0.487 1045 HD1 PHE 120 HD2 PHE 120 6.850 5.134 -3.039 1046 HD2 PHE 120 HD1 PHE 120 6.103 1.011 -2.108 1047 HE1 PHE 120 HE2 PHE 120 4.919 5.135 -4.556 1048 HE2 PHE 120 HE1 PHE 120 4.168 1.035 -3.625 1049 HZ PHE 120 HZ PHE 120 3.575 3.089 -4.845 1050 H MET 121 H MET 121 10.998 2.560 -1.362 1051 HA MET 121 HA MET 121 11.443 2.927 1.396 1052 HB2 MET 121 2HB MET 121 13.423 2.025 -0.743 1053 HB3 MET 121 3HB MET 121 13.682 1.877 0.995 1054 HG2 MET 121 2HG MET 121 11.535 0.501 -0.619 1055 HG3 MET 121 3HG MET 121 12.977 -0.244 0.076 1056 HE1 MET 121 3HE MET 121 10.059 -1.728 2.221 1057 HE2 MET 121 1HE MET 121 11.426 -2.091 1.169 1058 HE3 MET 121 2HE MET 121 9.985 -1.315 0.507 1059 H GLN 122 H GLN 122 12.577 4.740 -1.370 1060 HA GLN 122 HA GLN 122 14.733 6.154 -0.175 1061 HB2 GLN 122 2HB GLN 122 12.959 7.051 -2.489 1062 HB3 GLN 122 3HB GLN 122 14.575 7.648 -2.112 1063 HG2 GLN 122 2HG GLN 122 15.539 5.453 -2.653 1064 HG3 GLN 122 3HG GLN 122 13.926 4.804 -2.955 1065 HE21 GLN 122 1HE2 GLN 122 16.417 6.958 -4.164 1066 HE22 GLN 122 2HE2 GLN 122 15.787 7.089 -5.766 1067 H LYS 123 H LYS 123 11.278 6.873 -0.579 1068 HA LYS 123 HA LYS 123 11.421 9.491 0.648 1069 HB2 LYS 123 2HB LYS 123 8.986 7.838 -0.155 1070 HB3 LYS 123 3HB LYS 123 8.912 9.480 0.466 1071 HG2 LYS 123 2HG LYS 123 8.645 9.669 -1.880 1072 HG3 LYS 123 3HG LYS 123 10.297 10.192 -1.547 1073 HD2 LYS 123 2HD LYS 123 11.132 7.955 -2.250 1074 HD3 LYS 123 3HD LYS 123 9.477 7.448 -2.589 1075 HE2 LYS 123 2HE LYS 123 9.307 9.127 -4.361 1076 HE3 LYS 123 3HE LYS 123 10.930 9.715 -3.986 1077 HZ1 LYS 123 3HZ LYS 123 10.253 6.991 -4.955 1078 HZ2 LYS 123 1HZ LYS 123 11.808 7.543 -4.590 1079 HZ3 LYS 123 2HZ LYS 123 10.951 8.227 -5.876 1080 H ALA 124 H ALA 124 10.650 6.214 1.652 1081 HA ALA 124 HA ALA 124 9.355 6.841 4.136 1082 HB1 ALA 124 3HB ALA 124 9.570 4.430 4.597 1083 HB2 ALA 124 1HB ALA 124 10.653 4.249 3.212 1084 HB3 ALA 124 2HB ALA 124 8.966 4.711 2.965 1085 H GLY 125 H GLY 125 12.655 5.990 3.157 1086 HA2 GLY 125 2HA GLY 125 13.918 6.104 5.690 1087 HA3 GLY 125 3HA GLY 125 14.696 6.335 4.135 1088 H SER 126 H SER 126 13.266 8.531 3.196 1089 HA SER 126 HA SER 126 14.491 10.770 4.375 1090 HB2 SER 126 2HB SER 126 13.824 10.742 2.020 1091 HB3 SER 126 3HB SER 126 12.128 10.587 2.463 1092 HG SER 126 HG SER 126 13.422 12.769 3.568 1093 H LEU 127 H LEU 127 11.425 9.198 5.107 1094 HA LEU 127 HA LEU 127 10.228 11.313 6.638 1095 HB2 LEU 127 2HB LEU 127 9.797 8.304 6.864 1096 HB3 LEU 127 3HB LEU 127 8.778 9.531 7.603 1097 HG LEU 127 HG LEU 127 9.109 9.083 4.614 1098 HD11 LEU 127 1HD1 LEU 127 6.762 8.418 6.403 1099 HD12 LEU 127 2HD1 LEU 127 7.875 7.262 5.665 1100 HD13 LEU 127 3HD1 LEU 127 6.820 8.239 4.647 1101 HD21 LEU 127 3HD2 LEU 127 7.283 11.013 6.079 1102 HD22 LEU 127 1HD2 LEU 127 7.259 10.689 4.342 1103 HD23 LEU 127 2HD2 LEU 127 8.672 11.440 5.076 1104 H GLU 128 H GLU 128 12.275 8.509 7.380 1105 HA GLU 128 HA GLU 128 12.372 8.827 10.208 1106 HB2 GLU 128 2HB GLU 128 12.884 6.699 8.926 1107 HB3 GLU 128 3HB GLU 128 14.414 7.420 8.433 1108 HG2 GLU 128 2HG GLU 128 14.991 7.640 10.897 1109 HG3 GLU 128 3HG GLU 128 13.537 6.711 11.255 1110 H HIS 129 H HIS 129 14.159 10.262 7.562 1111 HA HIS 129 HA HIS 129 16.176 11.545 9.184 1112 HB2 HIS 129 2HB HIS 129 15.250 11.950 6.315 1113 HB3 HIS 129 3HB HIS 129 16.409 13.042 7.062 1114 HD1 HIS 129 HD1 HIS 129 18.679 12.502 6.322 1115 HD2 HIS 129 HD2 HIS 129 16.387 9.060 6.738 1116 HE1 HIS 129 HE1 HIS 129 20.188 10.598 5.692 1117 HE2 HIS 129 HE2 HIS 129 18.715 8.564 5.762 1118 H HIS 130 H HIS 130 14.594 12.228 10.834 1119 HA HIS 130 HA HIS 130 12.796 14.408 10.365 1120 HB2 HIS 130 2HB HIS 130 12.577 12.932 12.358 1121 HB3 HIS 130 3HB HIS 130 14.131 13.486 12.960 1122 HD1 HIS 130 HD1 HIS 130 14.204 15.803 14.107 1123 HD2 HIS 130 HD2 HIS 130 10.432 14.736 12.729 1124 HE1 HIS 130 HE1 HIS 130 12.624 17.486 15.099 1125 HE2 HIS 130 HE2 HIS 130 10.343 16.809 14.261 1126 H HIS 131 H HIS 131 13.238 16.586 10.396 1127 HA HIS 131 HA HIS 131 15.889 17.487 9.928 1128 HB2 HIS 131 2HB HIS 131 13.307 19.022 10.424 1129 HB3 HIS 131 3HB HIS 131 14.826 19.804 9.999 1130 HD1 HIS 131 HD1 HIS 131 15.380 19.953 7.557 1131 HD2 HIS 131 HD2 HIS 131 12.301 17.268 8.296 1132 HE1 HIS 131 HE1 HIS 131 14.531 19.267 5.303 1133 HE2 HIS 131 HE2 HIS 131 12.520 17.843 5.796 1134 H HIS 132 H HIS 132 17.175 16.983 11.622 1135 HA HIS 132 HA HIS 132 16.623 18.142 14.290 1136 HB2 HIS 132 2HB HIS 132 18.106 16.398 15.217 1137 HB3 HIS 132 3HB HIS 132 16.779 15.683 14.314 1138 HD1 HIS 132 HD1 HIS 132 17.398 14.298 12.200 1139 HD2 HIS 132 HD2 HIS 132 20.687 15.923 14.146 1140 HE1 HIS 132 HE1 HIS 132 19.402 13.195 11.184 1141 HE2 HIS 132 HE2 HIS 132 21.360 14.070 12.490 1142 H HIS 133 H HIS 133 17.842 19.810 14.885 1143 HA HIS 133 HA HIS 133 20.052 20.742 13.247 1144 HB2 HIS 133 2HB HIS 133 18.813 21.881 15.795 1145 HB3 HIS 133 3HB HIS 133 20.052 22.690 14.838 1146 HD1 HIS 133 HD1 HIS 133 16.757 23.248 15.376 1147 HD2 HIS 133 HD2 HIS 133 18.808 22.438 11.866 1148 HE1 HIS 133 HE1 HIS 133 15.327 24.168 13.534 1149 HE2 HIS 133 HE2 HIS 133 16.482 23.444 11.426 1150 H HIS 134 H HIS 134 22.087 21.543 14.373 1151 HA HIS 134 HA HIS 134 23.467 19.320 15.511 1152 HB2 HIS 134 2HB HIS 134 24.615 20.855 13.993 1153 HB3 HIS 134 3HB HIS 134 24.330 22.216 15.072 1154 HD1 HIS 134 HD1 HIS 134 25.740 22.265 17.306 1155 HD2 HIS 134 HD2 HIS 134 26.878 19.332 14.591 1156 HE1 HIS 134 HE1 HIS 134 27.984 21.456 18.083 1157 HE2 HIS 134 HE2 HIS 134 28.606 19.627 16.476 Start of MODEL 7 1 H1 MET 1 1H MET 1 3.777 9.249 14.993 2 H2 MET 1 2H MET 1 2.208 9.255 14.369 3 H3 MET 1 3H MET 1 3.022 10.715 14.615 4 HA MET 1 HA MET 1 2.958 10.089 12.280 5 HB2 MET 1 2HB MET 1 4.854 11.449 13.058 6 HB3 MET 1 3HB MET 1 5.707 10.015 13.616 7 HG2 MET 1 2HG MET 1 6.623 10.901 11.498 8 HG3 MET 1 3HG MET 1 6.012 9.253 11.322 9 HE1 MET 1 3HE MET 1 6.656 11.135 8.849 10 HE2 MET 1 1HE MET 1 5.247 10.874 7.822 11 HE3 MET 1 2HE MET 1 5.998 9.510 8.649 12 H LYS 2 H LYS 2 3.097 8.397 10.759 13 HA LYS 2 HA LYS 2 4.230 5.833 11.508 14 HB2 LYS 2 2HB LYS 2 2.026 6.034 12.750 15 HB3 LYS 2 3HB LYS 2 1.198 6.094 11.198 16 HG2 LYS 2 2HG LYS 2 1.701 3.830 10.715 17 HG3 LYS 2 3HG LYS 2 2.976 3.752 11.936 18 HD2 LYS 2 2HD LYS 2 1.283 3.941 13.736 19 HD3 LYS 2 3HD LYS 2 -0.004 4.059 12.530 20 HE2 LYS 2 2HE LYS 2 0.197 1.804 11.915 21 HE3 LYS 2 3HE LYS 2 1.830 1.662 12.564 22 HZ1 LYS 2 3HZ LYS 2 0.137 0.548 13.934 23 HZ2 LYS 2 1HZ LYS 2 -0.598 2.037 14.243 24 HZ3 LYS 2 2HZ LYS 2 0.976 1.741 14.782 25 H ILE 3 H ILE 3 5.052 5.006 9.686 26 HA ILE 3 HA ILE 3 4.219 6.092 7.066 27 HB ILE 3 HB ILE 3 6.793 4.645 7.891 28 HG12 ILE 3 2HG1 ILE 3 6.344 7.611 7.276 29 HG13 ILE 3 3HG1 ILE 3 6.566 6.933 8.882 30 HG21 ILE 3 1HG2 ILE 3 7.683 5.284 5.678 31 HG22 ILE 3 2HG2 ILE 3 6.117 5.964 5.239 32 HG23 ILE 3 3HG2 ILE 3 6.276 4.230 5.525 33 HD11 ILE 3 3HD1 ILE 3 8.841 6.244 8.262 34 HD12 ILE 3 1HD1 ILE 3 8.585 7.983 8.121 35 HD13 ILE 3 2HD1 ILE 3 8.616 6.980 6.671 36 H LEU 4 H LEU 4 2.918 4.800 5.900 37 HA LEU 4 HA LEU 4 3.051 1.846 6.126 38 HB2 LEU 4 2HB LEU 4 0.756 3.736 5.483 39 HB3 LEU 4 3HB LEU 4 0.695 2.056 4.986 40 HG LEU 4 HG LEU 4 0.699 1.304 7.322 41 HD11 LEU 4 1HD1 LEU 4 0.820 4.217 8.133 42 HD12 LEU 4 2HD1 LEU 4 2.066 2.994 8.394 43 HD13 LEU 4 3HD1 LEU 4 0.513 2.851 9.212 44 HD21 LEU 4 3HD2 LEU 4 -1.375 3.460 6.797 45 HD22 LEU 4 1HD2 LEU 4 -1.514 2.158 7.984 46 HD23 LEU 4 2HD2 LEU 4 -1.448 1.777 6.268 47 H ILE 5 H ILE 5 3.319 0.666 4.225 48 HA ILE 5 HA ILE 5 3.113 2.084 1.628 49 HB ILE 5 HB ILE 5 4.978 -0.278 2.250 50 HG12 ILE 5 2HG1 ILE 5 5.623 2.651 1.621 51 HG13 ILE 5 3HG1 ILE 5 5.917 1.816 3.139 52 HG21 ILE 5 1HG2 ILE 5 5.748 -0.075 -0.090 53 HG22 ILE 5 2HG2 ILE 5 4.575 1.210 -0.383 54 HG23 ILE 5 3HG2 ILE 5 4.020 -0.428 -0.029 55 HD11 ILE 5 3HD1 ILE 5 7.976 2.094 1.941 56 HD12 ILE 5 1HD1 ILE 5 7.314 1.299 0.511 57 HD13 ILE 5 2HD1 ILE 5 7.573 0.380 1.998 58 H LEU 6 H LEU 6 1.164 1.536 0.928 59 HA LEU 6 HA LEU 6 -0.147 -0.974 1.546 60 HB2 LEU 6 2HB LEU 6 -1.009 1.625 1.205 61 HB3 LEU 6 3HB LEU 6 -1.355 1.000 -0.388 62 HG LEU 6 HG LEU 6 -2.478 0.018 2.246 63 HD11 LEU 6 1HD1 LEU 6 -3.415 2.150 1.493 64 HD12 LEU 6 2HD1 LEU 6 -4.622 0.869 1.426 65 HD13 LEU 6 3HD1 LEU 6 -3.854 1.434 -0.063 66 HD21 LEU 6 3HD2 LEU 6 -3.072 -1.079 -0.524 67 HD22 LEU 6 1HD2 LEU 6 -3.906 -1.527 0.969 68 HD23 LEU 6 2HD2 LEU 6 -2.198 -1.911 0.764 69 H ILE 7 H ILE 7 -0.301 -2.666 0.135 70 HA ILE 7 HA ILE 7 0.592 -2.333 -2.680 71 HB ILE 7 HB ILE 7 1.225 -4.714 -0.847 72 HG12 ILE 7 2HG1 ILE 7 2.634 -2.719 -0.341 73 HG13 ILE 7 3HG1 ILE 7 3.585 -4.034 -1.010 74 HG21 ILE 7 1HG2 ILE 7 1.966 -4.256 -3.768 75 HG22 ILE 7 2HG2 ILE 7 0.841 -5.466 -3.144 76 HG23 ILE 7 3HG2 ILE 7 2.558 -5.580 -2.759 77 HD11 ILE 7 3HD1 ILE 7 2.685 -1.561 -2.485 78 HD12 ILE 7 1HD1 ILE 7 3.642 -2.874 -3.177 79 HD13 ILE 7 2HD1 ILE 7 4.305 -1.891 -1.873 80 H ASN 8 H ASN 8 -1.127 -2.684 -3.909 81 HA ASN 8 HA ASN 8 -2.874 -5.023 -3.386 82 HB2 ASN 8 2HB ASN 8 -4.077 -2.826 -3.327 83 HB3 ASN 8 3HB ASN 8 -3.548 -2.497 -4.967 84 HD21 ASN 8 1HD2 ASN 8 -6.241 -2.599 -4.048 85 HD22 ASN 8 2HD2 ASN 8 -7.042 -3.869 -4.895 86 H THR 9 H THR 9 -1.734 -6.515 -4.506 87 HA THR 9 HA THR 9 -1.827 -6.212 -7.425 88 HB THR 9 HB THR 9 0.528 -6.086 -7.066 89 HG1 THR 9 HG1 THR 9 0.129 -7.427 -8.761 90 HG21 THR 9 3HG2 THR 9 0.416 -8.588 -5.365 91 HG22 THR 9 1HG2 THR 9 0.666 -6.949 -4.753 92 HG23 THR 9 2HG2 THR 9 1.865 -7.688 -5.819 93 H ASN 10 H ASN 10 -2.748 -7.840 -8.465 94 HA ASN 10 HA ASN 10 -4.262 -9.787 -6.996 95 HB2 ASN 10 2HB ASN 10 -5.062 -8.589 -9.064 96 HB3 ASN 10 3HB ASN 10 -3.911 -9.519 -10.013 97 HD21 ASN 10 1HD2 ASN 10 -5.682 -10.313 -11.257 98 HD22 ASN 10 2HD2 ASN 10 -6.724 -11.555 -10.651 99 H ASN 11 H ASN 11 -1.134 -9.750 -8.324 100 HA ASN 11 HA ASN 11 -0.780 -12.621 -8.659 101 HB2 ASN 11 2HB ASN 11 1.285 -10.366 -8.668 102 HB3 ASN 11 3HB ASN 11 1.570 -12.032 -9.170 103 HD21 ASN 11 1HD2 ASN 11 1.823 -9.481 -10.634 104 HD22 ASN 11 2HD2 ASN 11 0.848 -9.658 -12.047 105 H ASP 12 H ASP 12 -0.829 -13.748 -6.781 106 HA ASP 12 HA ASP 12 -0.100 -12.825 -4.220 107 HB2 ASP 12 2HB ASP 12 -0.258 -15.705 -5.215 108 HB3 ASP 12 3HB ASP 12 -0.204 -15.216 -3.522 109 H GLU 13 H GLU 13 1.723 -14.510 -6.711 110 HA GLU 13 HA GLU 13 4.018 -15.196 -5.229 111 HB2 GLU 13 2HB GLU 13 3.789 -14.580 -8.209 112 HB3 GLU 13 3HB GLU 13 5.151 -15.380 -7.434 113 HG2 GLU 13 2HG GLU 13 2.322 -16.449 -7.575 114 HG3 GLU 13 3HG GLU 13 3.670 -16.973 -8.580 115 H LEU 14 H LEU 14 3.117 -12.236 -6.980 116 HA LEU 14 HA LEU 14 5.619 -10.876 -6.651 117 HB2 LEU 14 2HB LEU 14 4.111 -10.272 -8.474 118 HB3 LEU 14 3HB LEU 14 2.826 -9.881 -7.348 119 HG LEU 14 HG LEU 14 4.059 -7.899 -6.567 120 HD11 LEU 14 1HD1 LEU 14 6.235 -8.591 -8.563 121 HD12 LEU 14 2HD1 LEU 14 6.365 -8.678 -6.805 122 HD13 LEU 14 3HD1 LEU 14 6.128 -7.120 -7.589 123 HD21 LEU 14 3HD2 LEU 14 3.869 -7.963 -9.600 124 HD22 LEU 14 1HD2 LEU 14 3.884 -6.519 -8.580 125 HD23 LEU 14 2HD2 LEU 14 2.539 -7.650 -8.480 126 H ILE 15 H ILE 15 2.600 -11.072 -4.780 127 HA ILE 15 HA ILE 15 3.046 -9.082 -2.844 128 HB ILE 15 HB ILE 15 1.586 -11.763 -2.533 129 HG12 ILE 15 2HG1 ILE 15 0.437 -8.982 -3.029 130 HG13 ILE 15 3HG1 ILE 15 0.710 -10.172 -4.287 131 HG21 ILE 15 1HG2 ILE 15 2.197 -10.920 -0.313 132 HG22 ILE 15 2HG2 ILE 15 0.459 -10.797 -0.566 133 HG23 ILE 15 3HG2 ILE 15 1.468 -9.353 -0.684 134 HD11 ILE 15 3HD1 ILE 15 -1.592 -10.151 -3.745 135 HD12 ILE 15 1HD1 ILE 15 -1.247 -10.336 -2.033 136 HD13 ILE 15 2HD1 ILE 15 -0.917 -11.662 -3.135 137 H LYS 16 H LYS 16 4.018 -12.522 -2.920 138 HA LYS 16 HA LYS 16 5.163 -12.761 -0.372 139 HB2 LYS 16 2HB LYS 16 6.089 -14.189 -2.906 140 HB3 LYS 16 3HB LYS 16 6.394 -14.718 -1.255 141 HG2 LYS 16 2HG LYS 16 3.682 -14.550 -2.582 142 HG3 LYS 16 3HG LYS 16 4.624 -16.026 -2.379 143 HD2 LYS 16 2HD LYS 16 4.420 -15.815 0.079 144 HD3 LYS 16 3HD LYS 16 3.512 -14.310 -0.117 145 HE2 LYS 16 2HE LYS 16 1.713 -15.525 -1.279 146 HE3 LYS 16 3HE LYS 16 2.630 -17.032 -1.153 147 HZ1 LYS 16 3HZ LYS 16 0.957 -16.900 0.570 148 HZ2 LYS 16 1HZ LYS 16 1.586 -15.435 1.124 149 HZ3 LYS 16 2HZ LYS 16 2.491 -16.849 1.265 150 H LYS 17 H LYS 17 6.518 -11.564 -3.391 151 HA LYS 17 HA LYS 17 9.263 -11.478 -2.533 152 HB2 LYS 17 2HB LYS 17 7.923 -10.188 -4.955 153 HB3 LYS 17 3HB LYS 17 9.661 -10.391 -4.717 154 HG2 LYS 17 2HG LYS 17 9.391 -12.842 -4.746 155 HG3 LYS 17 3HG LYS 17 7.651 -12.650 -4.954 156 HD2 LYS 17 2HD LYS 17 8.643 -13.143 -7.110 157 HD3 LYS 17 3HD LYS 17 8.063 -11.477 -7.118 158 HE2 LYS 17 2HE LYS 17 10.383 -10.687 -6.701 159 HE3 LYS 17 3HE LYS 17 10.940 -12.364 -6.724 160 HZ1 LYS 17 3HZ LYS 17 11.290 -11.300 -8.858 161 HZ2 LYS 17 1HZ LYS 17 9.640 -10.948 -8.989 162 HZ3 LYS 17 2HZ LYS 17 10.167 -12.551 -9.004 163 H ILE 18 H ILE 18 6.660 -9.063 -2.944 164 HA ILE 18 HA ILE 18 8.247 -6.764 -2.332 165 HB ILE 18 HB ILE 18 5.205 -7.145 -2.298 166 HG12 ILE 18 2HG1 ILE 18 7.054 -5.827 -4.360 167 HG13 ILE 18 3HG1 ILE 18 6.263 -7.388 -4.540 168 HG21 ILE 18 1HG2 ILE 18 6.777 -4.546 -2.058 169 HG22 ILE 18 2HG2 ILE 18 5.772 -5.280 -0.806 170 HG23 ILE 18 3HG2 ILE 18 5.030 -4.666 -2.281 171 HD11 ILE 18 3HD1 ILE 18 5.123 -5.715 -5.835 172 HD12 ILE 18 1HD1 ILE 18 4.895 -4.701 -4.409 173 HD13 ILE 18 2HD1 ILE 18 4.074 -6.262 -4.527 174 H LYS 19 H LYS 19 6.253 -8.996 -0.428 175 HA LYS 19 HA LYS 19 6.354 -7.822 2.100 176 HB2 LYS 19 2HB LYS 19 6.356 -10.754 1.267 177 HB3 LYS 19 3HB LYS 19 6.368 -10.284 2.960 178 HG2 LYS 19 2HG LYS 19 4.206 -9.120 2.659 179 HG3 LYS 19 3HG LYS 19 4.206 -9.567 0.954 180 HD2 LYS 19 2HD LYS 19 2.755 -11.126 2.034 181 HD3 LYS 19 3HD LYS 19 4.241 -12.007 1.695 182 HE2 LYS 19 2HE LYS 19 3.504 -10.821 4.396 183 HE3 LYS 19 3HE LYS 19 3.274 -12.503 3.935 184 HZ1 LYS 19 3HZ LYS 19 5.253 -12.298 5.234 185 HZ2 LYS 19 1HZ LYS 19 5.885 -11.096 4.227 186 HZ3 LYS 19 2HZ LYS 19 5.707 -12.678 3.656 187 H LYS 20 H LYS 20 8.601 -10.320 0.797 188 HA LYS 20 HA LYS 20 10.445 -10.107 2.951 189 HB2 LYS 20 2HB LYS 20 10.835 -11.337 0.182 190 HB3 LYS 20 3HB LYS 20 11.938 -11.544 1.539 191 HG2 LYS 20 2HG LYS 20 9.042 -12.459 1.477 192 HG3 LYS 20 3HG LYS 20 10.452 -13.496 1.241 193 HD2 LYS 20 2HD LYS 20 11.201 -13.005 3.553 194 HD3 LYS 20 3HD LYS 20 9.812 -11.943 3.790 195 HE2 LYS 20 2HE LYS 20 9.392 -14.090 4.848 196 HE3 LYS 20 3HE LYS 20 8.302 -13.915 3.472 197 HZ1 LYS 20 3HZ LYS 20 10.835 -15.469 3.476 198 HZ2 LYS 20 1HZ LYS 20 9.755 -15.338 2.186 199 HZ3 LYS 20 2HZ LYS 20 9.285 -16.126 3.603 200 H GLU 21 H GLU 21 10.149 -8.357 -0.034 201 HA GLU 21 HA GLU 21 12.688 -7.233 -0.365 202 HB2 GLU 21 2HB GLU 21 10.710 -7.087 -1.958 203 HB3 GLU 21 3HB GLU 21 9.994 -5.889 -0.896 204 HG2 GLU 21 2HG GLU 21 10.972 -4.672 -2.666 205 HG3 GLU 21 3HG GLU 21 12.073 -4.472 -1.303 206 H VAL 22 H VAL 22 9.819 -5.967 1.338 207 HA VAL 22 HA VAL 22 11.308 -3.777 2.549 208 HB VAL 22 HB VAL 22 9.173 -3.083 3.535 209 HG11 VAL 22 1HG1 VAL 22 9.651 -2.368 1.250 210 HG12 VAL 22 2HG1 VAL 22 7.919 -2.617 1.464 211 HG13 VAL 22 3HG1 VAL 22 8.883 -3.820 0.601 212 HG21 VAL 22 3HG2 VAL 22 8.211 -5.257 4.074 213 HG22 VAL 22 1HG2 VAL 22 8.019 -5.639 2.360 214 HG23 VAL 22 2HG2 VAL 22 7.081 -4.334 3.090 215 H GLU 23 H GLU 23 10.345 -7.014 3.532 216 HA GLU 23 HA GLU 23 10.497 -6.610 6.380 217 HB2 GLU 23 2HB GLU 23 10.483 -9.161 4.701 218 HB3 GLU 23 3HB GLU 23 10.629 -9.186 6.457 219 HG2 GLU 23 2HG GLU 23 8.444 -8.029 6.650 220 HG3 GLU 23 3HG GLU 23 8.297 -8.039 4.894 221 H ASN 24 H ASN 24 12.815 -7.456 3.870 222 HA ASN 24 HA ASN 24 15.049 -7.984 5.588 223 HB2 ASN 24 2HB ASN 24 14.840 -7.141 2.671 224 HB3 ASN 24 3HB ASN 24 16.404 -7.279 3.468 225 HD21 ASN 24 1HD2 ASN 24 13.678 -9.471 4.106 226 HD22 ASN 24 2HD2 ASN 24 14.410 -10.853 3.386 227 H GLN 25 H GLN 25 13.375 -5.116 4.772 228 HA GLN 25 HA GLN 25 15.484 -3.389 5.932 229 HB2 GLN 25 2HB GLN 25 13.072 -2.572 4.262 230 HB3 GLN 25 3HB GLN 25 14.397 -1.536 4.777 231 HG2 GLN 25 2HG GLN 25 14.656 -3.857 2.829 232 HG3 GLN 25 3HG GLN 25 14.520 -2.163 2.368 233 HE21 GLN 25 1HE2 GLN 25 16.638 -4.617 3.637 234 HE22 GLN 25 2HE2 GLN 25 18.088 -3.687 3.568 235 H GLY 26 H GLY 26 13.172 -5.158 7.139 236 HA2 GLY 26 2HA GLY 26 12.520 -5.161 9.345 237 HA3 GLY 26 3HA GLY 26 13.035 -3.493 9.485 238 H TYR 27 H TYR 27 10.756 -4.042 6.933 239 HA TYR 27 HA TYR 27 8.642 -2.671 8.374 240 HB2 TYR 27 2HB TYR 27 8.814 -3.776 5.554 241 HB3 TYR 27 3HB TYR 27 7.293 -3.183 6.210 242 HD1 TYR 27 HD1 TYR 27 10.856 -1.928 6.128 243 HD2 TYR 27 HD2 TYR 27 6.730 -1.067 5.407 244 HE1 TYR 27 HE1 TYR 27 11.454 0.330 5.382 245 HE2 TYR 27 HE2 TYR 27 7.335 1.196 4.661 246 HH TYR 27 HH TYR 27 10.432 2.102 3.856 247 H GLN 28 H GLN 28 6.950 -3.547 9.360 248 HA GLN 28 HA GLN 28 6.587 -6.436 9.529 249 HB2 GLN 28 2HB GLN 28 6.371 -4.979 11.547 250 HB3 GLN 28 3HB GLN 28 5.044 -4.112 10.783 251 HG2 GLN 28 2HG GLN 28 3.747 -6.268 10.744 252 HG3 GLN 28 3HG GLN 28 5.046 -7.019 11.666 253 HE21 GLN 28 1HE2 GLN 28 5.499 -4.605 13.334 254 HE22 GLN 28 2HE2 GLN 28 4.163 -4.543 14.418 255 H VAL 29 H VAL 29 5.031 -7.548 8.325 256 HA VAL 29 HA VAL 29 3.323 -6.076 6.468 257 HB VAL 29 HB VAL 29 3.559 -9.107 6.866 258 HG11 VAL 29 1HG1 VAL 29 2.236 -7.526 4.615 259 HG12 VAL 29 2HG1 VAL 29 1.402 -8.471 5.851 260 HG13 VAL 29 3HG1 VAL 29 2.424 -9.283 4.666 261 HG21 VAL 29 3HG2 VAL 29 5.696 -8.127 6.113 262 HG22 VAL 29 1HG2 VAL 29 4.877 -7.320 4.772 263 HG23 VAL 29 2HG2 VAL 29 4.966 -9.083 4.824 264 H ARG 30 H ARG 30 1.297 -5.549 6.873 265 HA ARG 30 HA ARG 30 -0.385 -7.074 8.753 266 HB2 ARG 30 2HB ARG 30 0.395 -4.946 9.800 267 HB3 ARG 30 3HB ARG 30 -0.194 -4.037 8.421 268 HG2 ARG 30 2HG ARG 30 -1.617 -3.842 10.429 269 HG3 ARG 30 3HG ARG 30 -2.481 -4.465 9.024 270 HD2 ARG 30 2HD ARG 30 -1.328 -6.375 11.063 271 HD3 ARG 30 3HD ARG 30 -2.860 -5.556 11.371 272 HE ARG 30 HE ARG 30 -3.479 -6.533 9.058 273 HH11 ARG 30 1HH1 ARG 30 -1.522 -8.221 11.467 274 HH12 ARG 30 2HH1 ARG 30 -2.029 -9.792 10.936 275 HH21 ARG 30 1HH2 ARG 30 -4.159 -8.603 8.427 276 HH22 ARG 30 2HH2 ARG 30 -3.516 -10.005 9.222 277 H ASP 31 H ASP 31 -1.927 -7.990 7.525 278 HA ASP 31 HA ASP 31 -2.487 -6.879 4.842 279 HB2 ASP 31 2HB ASP 31 -2.713 -9.334 4.150 280 HB3 ASP 31 3HB ASP 31 -1.095 -8.761 4.517 281 H VAL 32 H VAL 32 -4.463 -6.279 4.544 282 HA VAL 32 HA VAL 32 -6.718 -6.912 6.182 283 HB VAL 32 HB VAL 32 -6.684 -5.594 3.416 284 HG11 VAL 32 1HG1 VAL 32 -8.815 -4.555 4.101 285 HG12 VAL 32 2HG1 VAL 32 -8.774 -5.452 5.622 286 HG13 VAL 32 3HG1 VAL 32 -8.925 -6.317 4.091 287 HG21 VAL 32 3HG2 VAL 32 -6.609 -3.417 4.583 288 HG22 VAL 32 1HG2 VAL 32 -5.172 -4.384 4.923 289 HG23 VAL 32 2HG2 VAL 32 -6.447 -4.245 6.135 290 H ASN 33 H ASN 33 -7.634 -8.929 6.088 291 HA ASN 33 HA ASN 33 -7.759 -10.413 3.537 292 HB2 ASN 33 2HB ASN 33 -8.160 -11.258 6.435 293 HB3 ASN 33 3HB ASN 33 -8.634 -12.306 5.105 294 HD21 ASN 33 1HD2 ASN 33 -5.732 -10.246 5.188 295 HD22 ASN 33 2HD2 ASN 33 -4.611 -11.548 5.161 296 H ASP 34 H ASP 34 -9.776 -8.477 5.508 297 HA ASP 34 HA ASP 34 -12.168 -8.916 3.978 298 HB2 ASP 34 2HB ASP 34 -12.159 -10.921 5.519 299 HB3 ASP 34 3HB ASP 34 -12.176 -9.831 6.900 300 H SER 35 H SER 35 -14.022 -7.535 4.958 301 HA SER 35 HA SER 35 -13.277 -4.911 5.612 302 HB2 SER 35 2HB SER 35 -15.454 -5.467 4.624 303 HB3 SER 35 3HB SER 35 -15.935 -6.344 6.075 304 HG SER 35 HG SER 35 -15.370 -3.566 5.872 305 H ASP 36 H ASP 36 -14.265 -7.610 7.673 306 HA ASP 36 HA ASP 36 -14.338 -6.338 10.188 307 HB2 ASP 36 2HB ASP 36 -15.323 -8.575 9.761 308 HB3 ASP 36 3HB ASP 36 -13.723 -9.249 9.477 309 H GLU 37 H GLU 37 -11.761 -8.100 8.480 310 HA GLU 37 HA GLU 37 -9.687 -7.841 10.350 311 HB2 GLU 37 2HB GLU 37 -9.473 -7.958 7.302 312 HB3 GLU 37 3HB GLU 37 -8.163 -8.270 8.436 313 HG2 GLU 37 2HG GLU 37 -10.699 -9.914 8.255 314 HG3 GLU 37 3HG GLU 37 -9.188 -10.320 7.451 315 H LEU 38 H LEU 38 -10.724 -5.745 7.665 316 HA LEU 38 HA LEU 38 -8.642 -3.909 7.560 317 HB2 LEU 38 2HB LEU 38 -10.413 -4.004 5.828 318 HB3 LEU 38 3HB LEU 38 -11.600 -3.425 6.984 319 HG LEU 38 HG LEU 38 -10.365 -1.240 7.129 320 HD11 LEU 38 1HD1 LEU 38 -8.128 -1.953 6.549 321 HD12 LEU 38 2HD1 LEU 38 -8.659 -0.654 5.485 322 HD13 LEU 38 3HD1 LEU 38 -8.633 -2.320 4.897 323 HD21 LEU 38 3HD2 LEU 38 -11.254 -1.993 4.330 324 HD22 LEU 38 1HD2 LEU 38 -11.052 -0.348 4.940 325 HD23 LEU 38 2HD2 LEU 38 -12.276 -1.401 5.641 326 H LYS 39 H LYS 39 -11.774 -3.549 9.284 327 HA LYS 39 HA LYS 39 -11.062 -1.054 10.407 328 HB2 LYS 39 2HB LYS 39 -13.161 -1.245 11.738 329 HB3 LYS 39 3HB LYS 39 -13.382 -1.508 10.019 330 HG2 LYS 39 2HG LYS 39 -14.762 -3.131 10.902 331 HG3 LYS 39 3HG LYS 39 -13.281 -4.052 10.630 332 HD2 LYS 39 2HD LYS 39 -12.701 -3.840 13.019 333 HD3 LYS 39 3HD LYS 39 -14.141 -2.855 13.295 334 HE2 LYS 39 2HE LYS 39 -15.569 -4.777 12.683 335 HE3 LYS 39 3HE LYS 39 -14.127 -5.758 12.398 336 HZ1 LYS 39 3HZ LYS 39 -13.528 -5.479 14.729 337 HZ2 LYS 39 1HZ LYS 39 -15.064 -6.173 14.578 338 HZ3 LYS 39 2HZ LYS 39 -14.911 -4.543 14.996 339 H LYS 40 H LYS 40 -10.798 -4.389 11.646 340 HA LYS 40 HA LYS 40 -10.081 -3.836 14.318 341 HB2 LYS 40 2HB LYS 40 -9.334 -6.146 12.506 342 HB3 LYS 40 3HB LYS 40 -8.785 -6.057 14.181 343 HG2 LYS 40 2HG LYS 40 -11.241 -5.844 14.850 344 HG3 LYS 40 3HG LYS 40 -11.645 -6.261 13.183 345 HD2 LYS 40 2HD LYS 40 -10.048 -7.960 15.123 346 HD3 LYS 40 3HD LYS 40 -11.725 -8.236 14.651 347 HE2 LYS 40 2HE LYS 40 -10.949 -8.553 12.283 348 HE3 LYS 40 3HE LYS 40 -9.283 -8.406 12.852 349 HZ1 LYS 40 3HZ LYS 40 -9.619 -10.361 14.228 350 HZ2 LYS 40 1HZ LYS 40 -9.949 -10.714 12.609 351 HZ3 LYS 40 2HZ LYS 40 -11.219 -10.492 13.702 352 H GLU 41 H GLU 41 -8.015 -4.048 11.404 353 HA GLU 41 HA GLU 41 -5.618 -3.470 12.952 354 HB2 GLU 41 2HB GLU 41 -4.382 -3.837 10.879 355 HB3 GLU 41 3HB GLU 41 -5.473 -5.164 11.226 356 HG2 GLU 41 2HG GLU 41 -7.070 -4.098 9.520 357 HG3 GLU 41 3HG GLU 41 -5.713 -3.073 9.058 358 H MET 42 H MET 42 -7.929 -1.679 11.110 359 HA MET 42 HA MET 42 -6.406 0.706 10.721 360 HB2 MET 42 2HB MET 42 -9.400 0.187 10.832 361 HB3 MET 42 3HB MET 42 -8.782 1.830 10.742 362 HG2 MET 42 2HG MET 42 -8.225 -0.338 8.703 363 HG3 MET 42 3HG MET 42 -9.419 0.949 8.534 364 HE1 MET 42 3HE MET 42 -7.100 4.145 8.343 365 HE2 MET 42 1HE MET 42 -7.814 3.479 9.811 366 HE3 MET 42 2HE MET 42 -8.763 3.560 8.325 367 H LYS 43 H LYS 43 -8.306 -0.565 13.444 368 HA LYS 43 HA LYS 43 -7.942 1.634 15.205 369 HB2 LYS 43 2HB LYS 43 -8.583 -1.284 15.587 370 HB3 LYS 43 3HB LYS 43 -7.968 -0.430 16.990 371 HG2 LYS 43 2HG LYS 43 -10.383 -0.467 17.063 372 HG3 LYS 43 3HG LYS 43 -9.836 1.194 16.816 373 HD2 LYS 43 2HD LYS 43 -10.377 1.028 14.420 374 HD3 LYS 43 3HD LYS 43 -10.866 -0.656 14.633 375 HE2 LYS 43 2HE LYS 43 -12.827 0.799 14.528 376 HE3 LYS 43 3HE LYS 43 -12.694 0.082 16.135 377 HZ1 LYS 43 3HZ LYS 43 -13.236 2.491 16.089 378 HZ2 LYS 43 1HZ LYS 43 -11.703 2.794 15.459 379 HZ3 LYS 43 2HZ LYS 43 -11.864 2.117 17.000 380 H LYS 44 H LYS 44 -5.823 -1.115 14.366 381 HA LYS 44 HA LYS 44 -3.801 -0.564 16.302 382 HB2 LYS 44 2HB LYS 44 -3.478 -2.023 13.637 383 HB3 LYS 44 3HB LYS 44 -2.345 -2.071 14.985 384 HG2 LYS 44 2HG LYS 44 -5.159 -3.193 14.927 385 HG3 LYS 44 3HG LYS 44 -3.655 -4.113 14.929 386 HD2 LYS 44 2HD LYS 44 -4.625 -2.336 17.206 387 HD3 LYS 44 3HD LYS 44 -4.794 -4.090 17.145 388 HE2 LYS 44 2HE LYS 44 -2.381 -4.380 17.214 389 HE3 LYS 44 3HE LYS 44 -2.129 -2.634 17.103 390 HZ1 LYS 44 3HZ LYS 44 -3.542 -3.984 19.346 391 HZ2 LYS 44 1HZ LYS 44 -3.151 -2.345 19.246 392 HZ3 LYS 44 2HZ LYS 44 -1.925 -3.500 19.388 393 H LEU 45 H LEU 45 -4.458 0.724 13.119 394 HA LEU 45 HA LEU 45 -1.912 2.079 12.825 395 HB2 LEU 45 2HB LEU 45 -4.491 2.358 11.231 396 HB3 LEU 45 3HB LEU 45 -2.924 2.995 10.758 397 HG LEU 45 HG LEU 45 -3.579 0.038 11.031 398 HD11 LEU 45 1HD1 LEU 45 -3.570 -0.068 8.587 399 HD12 LEU 45 2HD1 LEU 45 -3.349 1.681 8.497 400 HD13 LEU 45 3HD1 LEU 45 -4.832 1.010 9.181 401 HD21 LEU 45 3HD2 LEU 45 -1.213 0.490 11.434 402 HD22 LEU 45 1HD2 LEU 45 -1.098 1.350 9.895 403 HD23 LEU 45 2HD2 LEU 45 -1.444 -0.382 9.920 404 H ALA 46 H ALA 46 -5.107 2.846 14.081 405 HA ALA 46 HA ALA 46 -4.757 5.757 13.917 406 HB1 ALA 46 3HB ALA 46 -6.903 4.737 13.250 407 HB2 ALA 46 1HB ALA 46 -7.113 5.853 14.602 408 HB3 ALA 46 2HB ALA 46 -7.120 4.109 14.885 409 H GLU 47 H GLU 47 -5.395 3.321 16.476 410 HA GLU 47 HA GLU 47 -5.412 5.199 18.629 411 HB2 GLU 47 2HB GLU 47 -5.006 2.185 18.883 412 HB3 GLU 47 3HB GLU 47 -5.592 3.286 20.125 413 HG2 GLU 47 2HG GLU 47 -7.046 2.435 17.602 414 HG3 GLU 47 3HG GLU 47 -7.435 1.980 19.256 415 H GLU 48 H GLU 48 -3.121 2.479 18.061 416 HA GLU 48 HA GLU 48 -0.949 4.017 19.269 417 HB2 GLU 48 2HB GLU 48 0.477 1.952 18.687 418 HB3 GLU 48 3HB GLU 48 -0.717 1.796 19.959 419 HG2 GLU 48 2HG GLU 48 -1.382 0.910 17.157 420 HG3 GLU 48 3HG GLU 48 -0.403 -0.118 18.195 421 H LYS 49 H LYS 49 -0.802 5.689 17.883 422 HA LYS 49 HA LYS 49 -0.151 5.345 15.043 423 HB2 LYS 49 2HB LYS 49 -0.424 7.816 14.973 424 HB3 LYS 49 3HB LYS 49 -1.818 7.029 15.704 425 HG2 LYS 49 2HG LYS 49 -0.729 7.570 17.971 426 HG3 LYS 49 3HG LYS 49 0.342 8.647 17.072 427 HD2 LYS 49 2HD LYS 49 -2.695 8.827 17.247 428 HD3 LYS 49 3HD LYS 49 -1.531 9.899 18.026 429 HE2 LYS 49 2HE LYS 49 -0.772 10.672 15.807 430 HE3 LYS 49 3HE LYS 49 -1.946 9.603 15.036 431 HZ1 LYS 49 3HZ LYS 49 -2.595 11.864 16.857 432 HZ2 LYS 49 1HZ LYS 49 -3.725 10.826 16.148 433 HZ3 LYS 49 2HZ LYS 49 -2.795 11.852 15.180 434 H ASN 50 H ASN 50 1.670 4.294 16.843 435 HA ASN 50 HA ASN 50 3.859 5.887 17.615 436 HB2 ASN 50 2HB ASN 50 3.295 3.682 18.615 437 HB3 ASN 50 3HB ASN 50 3.675 2.879 17.098 438 HD21 ASN 50 1HD2 ASN 50 5.310 1.593 17.934 439 HD22 ASN 50 2HD2 ASN 50 6.802 2.213 18.543 440 H PHE 51 H PHE 51 6.007 5.957 16.742 441 HA PHE 51 HA PHE 51 6.139 6.205 13.892 442 HB2 PHE 51 2HB PHE 51 7.459 7.652 15.477 443 HB3 PHE 51 3HB PHE 51 8.457 6.255 15.871 444 HD1 PHE 51 HD2 PHE 51 7.396 8.449 13.044 445 HD2 PHE 51 HD1 PHE 51 10.341 5.698 14.478 446 HE1 PHE 51 HE2 PHE 51 8.823 8.954 11.102 447 HE2 PHE 51 HE1 PHE 51 11.755 6.207 12.531 448 HZ PHE 51 HZ PHE 51 10.996 7.830 10.842 449 H GLU 52 H GLU 52 5.735 4.303 12.950 450 HA GLU 52 HA GLU 52 7.805 2.250 12.932 451 HB2 GLU 52 2HB GLU 52 6.178 0.402 13.263 452 HB3 GLU 52 3HB GLU 52 6.249 1.448 14.679 453 HG2 GLU 52 2HG GLU 52 4.184 2.618 13.814 454 HG3 GLU 52 3HG GLU 52 4.065 1.378 12.569 455 H LYS 53 H LYS 53 7.849 1.097 11.007 456 HA LYS 53 HA LYS 53 6.287 2.274 8.791 457 HB2 LYS 53 2HB LYS 53 9.054 1.004 8.706 458 HB3 LYS 53 3HB LYS 53 8.207 1.737 7.347 459 HG2 LYS 53 2HG LYS 53 8.228 3.924 8.654 460 HG3 LYS 53 3HG LYS 53 9.305 3.140 9.806 461 HD2 LYS 53 2HD LYS 53 9.846 3.659 6.857 462 HD3 LYS 53 3HD LYS 53 10.603 4.470 8.233 463 HE2 LYS 53 2HE LYS 53 10.921 1.556 7.452 464 HE3 LYS 53 3HE LYS 53 12.126 2.833 7.302 465 HZ1 LYS 53 3HZ LYS 53 10.995 1.907 9.880 466 HZ2 LYS 53 1HZ LYS 53 12.251 3.009 9.659 467 HZ3 LYS 53 2HZ LYS 53 12.470 1.394 9.235 468 H ILE 54 H ILE 54 4.627 0.959 8.423 469 HA ILE 54 HA ILE 54 4.943 -1.993 8.506 470 HB ILE 54 HB ILE 54 2.416 -0.268 8.738 471 HG12 ILE 54 2HG1 ILE 54 3.895 -1.902 10.866 472 HG13 ILE 54 3HG1 ILE 54 3.779 -0.148 10.789 473 HG21 ILE 54 1HG2 ILE 54 1.193 -2.347 9.222 474 HG22 ILE 54 2HG2 ILE 54 2.659 -3.295 8.965 475 HG23 ILE 54 3HG2 ILE 54 1.927 -2.415 7.622 476 HD11 ILE 54 3HD1 ILE 54 2.286 -0.963 12.468 477 HD12 ILE 54 1HD1 ILE 54 1.523 -2.080 11.334 478 HD13 ILE 54 2HD1 ILE 54 1.323 -0.337 11.129 479 H LEU 55 H LEU 55 4.819 -3.090 6.597 480 HA LEU 55 HA LEU 55 3.806 -1.923 4.140 481 HB2 LEU 55 2HB LEU 55 5.632 -3.703 4.214 482 HB3 LEU 55 3HB LEU 55 4.427 -4.853 4.771 483 HG LEU 55 HG LEU 55 3.134 -4.174 2.547 484 HD11 LEU 55 1HD1 LEU 55 5.942 -3.324 1.829 485 HD12 LEU 55 2HD1 LEU 55 4.498 -2.309 1.900 486 HD13 LEU 55 3HD1 LEU 55 4.623 -3.577 0.685 487 HD21 LEU 55 3HD2 LEU 55 4.219 -5.962 1.279 488 HD22 LEU 55 1HD2 LEU 55 3.985 -6.433 2.961 489 HD23 LEU 55 2HD2 LEU 55 5.587 -5.955 2.396 490 H ILE 56 H ILE 56 1.591 -1.697 3.942 491 HA ILE 56 HA ILE 56 -0.237 -3.682 5.100 492 HB ILE 56 HB ILE 56 -0.927 -1.191 3.454 493 HG12 ILE 56 2HG1 ILE 56 0.220 -0.588 5.594 494 HG13 ILE 56 3HG1 ILE 56 -1.456 -0.059 5.563 495 HG21 ILE 56 1HG2 ILE 56 -3.211 -1.475 4.389 496 HG22 ILE 56 2HG2 ILE 56 -2.704 -2.968 5.189 497 HG23 ILE 56 3HG2 ILE 56 -2.723 -2.869 3.425 498 HD11 ILE 56 3HD1 ILE 56 -0.826 -0.925 7.742 499 HD12 ILE 56 1HD1 ILE 56 -0.392 -2.477 7.029 500 HD13 ILE 56 2HD1 ILE 56 -2.073 -1.936 7.014 501 H LYS 57 H LYS 57 -1.592 -4.970 3.799 502 HA LYS 57 HA LYS 57 -1.025 -5.169 0.901 503 HB2 LYS 57 2HB LYS 57 0.468 -6.757 2.003 504 HB3 LYS 57 3HB LYS 57 -0.829 -7.402 2.988 505 HG2 LYS 57 2HG LYS 57 -0.964 -7.670 -0.019 506 HG3 LYS 57 3HG LYS 57 0.087 -8.742 0.909 507 HD2 LYS 57 2HD LYS 57 -1.920 -9.431 2.271 508 HD3 LYS 57 3HD LYS 57 -2.931 -8.456 1.208 509 HE2 LYS 57 2HE LYS 57 -2.159 -9.861 -0.698 510 HE3 LYS 57 3HE LYS 57 -1.297 -10.890 0.443 511 HZ1 LYS 57 3HZ LYS 57 -3.443 -11.364 1.508 512 HZ2 LYS 57 1HZ LYS 57 -3.424 -11.835 -0.114 513 HZ3 LYS 57 2HZ LYS 57 -4.232 -10.427 0.348 514 H SER 58 H SER 58 -2.856 -5.566 -0.274 515 HA SER 58 HA SER 58 -5.287 -6.640 0.845 516 HB2 SER 58 2HB SER 58 -5.385 -4.276 1.681 517 HB3 SER 58 3HB SER 58 -5.276 -3.693 0.025 518 HG SER 58 HG SER 58 -7.360 -5.237 1.177 519 H ASN 59 H ASN 59 -7.134 -6.210 -0.951 520 HA ASN 59 HA ASN 59 -5.991 -6.964 -3.592 521 HB2 ASN 59 2HB ASN 59 -6.445 -9.041 -2.333 522 HB3 ASN 59 3HB ASN 59 -8.080 -8.506 -1.977 523 HD21 ASN 59 1HD2 ASN 59 -9.110 -10.215 -2.948 524 HD22 ASN 59 2HD2 ASN 59 -9.086 -10.516 -4.651 525 H ASP 60 H ASP 60 -8.968 -6.211 -1.744 526 HA ASP 60 HA ASP 60 -10.403 -5.585 -4.247 527 HB2 ASP 60 2HB ASP 60 -11.549 -7.038 -2.618 528 HB3 ASP 60 3HB ASP 60 -11.434 -5.784 -1.384 529 H LYS 61 H LYS 61 -11.014 -3.615 -4.841 530 HA LYS 61 HA LYS 61 -9.532 -1.381 -4.174 531 HB2 LYS 61 2HB LYS 61 -11.074 -0.089 -5.609 532 HB3 LYS 61 3HB LYS 61 -10.640 -1.630 -6.345 533 HG2 LYS 61 2HG LYS 61 -12.793 -2.576 -5.877 534 HG3 LYS 61 3HG LYS 61 -13.220 -1.247 -4.799 535 HD2 LYS 61 2HD LYS 61 -14.402 -1.012 -6.919 536 HD3 LYS 61 3HD LYS 61 -13.252 0.312 -6.723 537 HE2 LYS 61 2HE LYS 61 -11.673 -0.860 -8.227 538 HE3 LYS 61 3HE LYS 61 -12.854 -2.161 -8.439 539 HZ1 LYS 61 3HZ LYS 61 -13.203 0.691 -9.221 540 HZ2 LYS 61 1HZ LYS 61 -14.414 -0.489 -9.326 541 HZ3 LYS 61 2HZ LYS 61 -13.016 -0.628 -10.254 542 H GLN 62 H GLN 62 -12.634 -2.388 -2.795 543 HA GLN 62 HA GLN 62 -13.494 0.182 -1.867 544 HB2 GLN 62 2HB GLN 62 -14.344 -2.578 -0.872 545 HB3 GLN 62 3HB GLN 62 -15.195 -1.064 -0.565 546 HG2 GLN 62 2HG GLN 62 -14.798 -2.315 -3.302 547 HG3 GLN 62 3HG GLN 62 -16.262 -2.445 -2.326 548 HE21 GLN 62 1HE2 GLN 62 -17.638 -0.686 -2.167 549 HE22 GLN 62 2HE2 GLN 62 -17.503 0.715 -3.171 550 H LEU 63 H LEU 63 -11.763 -2.546 -0.433 551 HA LEU 63 HA LEU 63 -11.647 -1.702 2.238 552 HB2 LEU 63 2HB LEU 63 -9.660 -3.416 0.658 553 HB3 LEU 63 3HB LEU 63 -9.698 -3.300 2.411 554 HG LEU 63 HG LEU 63 -11.965 -4.428 0.710 555 HD11 LEU 63 1HD1 LEU 63 -9.992 -5.880 0.595 556 HD12 LEU 63 2HD1 LEU 63 -11.292 -6.642 1.506 557 HD13 LEU 63 3HD1 LEU 63 -9.912 -5.941 2.358 558 HD21 LEU 63 3HD2 LEU 63 -12.888 -5.235 2.848 559 HD22 LEU 63 1HD2 LEU 63 -12.780 -3.477 2.802 560 HD23 LEU 63 2HD2 LEU 63 -11.597 -4.407 3.726 561 H LEU 64 H LEU 64 -9.542 -0.981 -0.533 562 HA LEU 64 HA LEU 64 -7.526 0.447 0.929 563 HB2 LEU 64 2HB LEU 64 -8.177 0.381 -2.044 564 HB3 LEU 64 3HB LEU 64 -6.870 1.344 -1.375 565 HG LEU 64 HG LEU 64 -5.892 -0.847 -0.452 566 HD11 LEU 64 1HD1 LEU 64 -7.840 -2.275 -0.637 567 HD12 LEU 64 2HD1 LEU 64 -6.510 -2.920 -1.594 568 HD13 LEU 64 3HD1 LEU 64 -7.851 -2.090 -2.392 569 HD21 LEU 64 3HD2 LEU 64 -6.028 -0.550 -3.460 570 HD22 LEU 64 1HD2 LEU 64 -4.780 -1.380 -2.526 571 HD23 LEU 64 2HD2 LEU 64 -4.970 0.362 -2.379 572 H LYS 65 H LYS 65 -10.423 1.419 -0.924 573 HA LYS 65 HA LYS 65 -10.095 4.205 -0.831 574 HB2 LYS 65 2HB LYS 65 -12.616 2.484 -0.932 575 HB3 LYS 65 3HB LYS 65 -12.680 4.242 -1.019 576 HG2 LYS 65 2HG LYS 65 -11.216 2.447 -2.973 577 HG3 LYS 65 3HG LYS 65 -12.813 3.140 -3.243 578 HD2 LYS 65 2HD LYS 65 -10.359 4.874 -2.743 579 HD3 LYS 65 3HD LYS 65 -10.798 4.310 -4.353 580 HE2 LYS 65 2HE LYS 65 -11.633 6.555 -4.075 581 HE3 LYS 65 3HE LYS 65 -13.008 5.460 -4.115 582 HZ1 LYS 65 3HZ LYS 65 -13.233 7.176 -2.422 583 HZ2 LYS 65 1HZ LYS 65 -11.825 6.643 -1.655 584 HZ3 LYS 65 2HZ LYS 65 -13.181 5.642 -1.715 585 H GLU 66 H GLU 66 -11.994 2.094 1.284 586 HA GLU 66 HA GLU 66 -12.891 4.024 3.107 587 HB2 GLU 66 2HB GLU 66 -12.552 1.005 3.497 588 HB3 GLU 66 3HB GLU 66 -13.550 2.060 4.502 589 HG2 GLU 66 2HG GLU 66 -14.978 2.557 2.562 590 HG3 GLU 66 3HG GLU 66 -13.962 1.564 1.543 591 H MET 67 H MET 67 -10.035 1.922 3.116 592 HA MET 67 HA MET 67 -8.979 2.447 5.659 593 HB2 MET 67 2HB MET 67 -8.149 0.741 3.939 594 HB3 MET 67 3HB MET 67 -7.382 2.060 3.076 595 HG2 MET 67 2HG MET 67 -6.056 2.502 5.201 596 HG3 MET 67 3HG MET 67 -6.685 0.973 5.808 597 HE1 MET 67 3HE MET 67 -5.216 -1.466 2.965 598 HE2 MET 67 1HE MET 67 -6.739 -0.586 2.820 599 HE3 MET 67 2HE MET 67 -6.316 -1.381 4.339 600 H LEU 68 H LEU 68 -8.275 4.056 2.550 601 HA LEU 68 HA LEU 68 -6.402 5.911 3.652 602 HB2 LEU 68 2HB LEU 68 -7.637 5.652 0.886 603 HB3 LEU 68 3HB LEU 68 -6.388 6.826 1.278 604 HG LEU 68 HG LEU 68 -6.048 3.803 1.474 605 HD11 LEU 68 1HD1 LEU 68 -4.603 3.983 -0.498 606 HD12 LEU 68 2HD1 LEU 68 -4.972 5.706 -0.635 607 HD13 LEU 68 3HD1 LEU 68 -6.247 4.505 -0.859 608 HD21 LEU 68 3HD2 LEU 68 -4.008 6.019 1.827 609 HD22 LEU 68 1HD2 LEU 68 -3.664 4.286 1.803 610 HD23 LEU 68 2HD2 LEU 68 -4.653 4.967 3.093 611 H GLU 69 H GLU 69 -9.833 6.089 3.032 612 HA GLU 69 HA GLU 69 -10.052 8.967 3.084 613 HB2 GLU 69 2HB GLU 69 -12.134 6.764 3.449 614 HB3 GLU 69 3HB GLU 69 -12.533 8.484 3.411 615 HG2 GLU 69 2HG GLU 69 -11.666 8.672 1.130 616 HG3 GLU 69 3HG GLU 69 -11.148 6.987 1.160 617 H LEU 70 H LEU 70 -10.064 6.411 5.482 618 HA LEU 70 HA LEU 70 -10.731 8.134 7.716 619 HB2 LEU 70 2HB LEU 70 -9.592 5.307 7.635 620 HB3 LEU 70 3HB LEU 70 -10.129 6.129 9.092 621 HG LEU 70 HG LEU 70 -11.922 5.392 6.745 622 HD11 LEU 70 1HD1 LEU 70 -12.883 3.673 8.201 623 HD12 LEU 70 2HD1 LEU 70 -11.721 4.071 9.471 624 HD13 LEU 70 3HD1 LEU 70 -11.162 3.397 7.938 625 HD21 LEU 70 3HD2 LEU 70 -12.712 7.399 7.889 626 HD22 LEU 70 1HD2 LEU 70 -12.670 6.561 9.442 627 HD23 LEU 70 2HD2 LEU 70 -13.795 6.043 8.183 628 H ILE 71 H ILE 71 -7.796 6.786 6.242 629 HA ILE 71 HA ILE 71 -5.903 7.672 8.191 630 HB ILE 71 HB ILE 71 -5.549 6.871 5.260 631 HG12 ILE 71 2HG1 ILE 71 -4.940 5.372 7.856 632 HG13 ILE 71 3HG1 ILE 71 -6.279 5.043 6.766 633 HG21 ILE 71 1HG2 ILE 71 -3.338 7.423 7.278 634 HG22 ILE 71 2HG2 ILE 71 -3.707 8.385 5.847 635 HG23 ILE 71 3HG2 ILE 71 -3.115 6.738 5.668 636 HD11 ILE 71 3HD1 ILE 71 -4.664 4.389 5.021 637 HD12 ILE 71 1HD1 ILE 71 -4.561 3.401 6.479 638 HD13 ILE 71 2HD1 ILE 71 -3.351 4.645 6.176 639 H SER 72 H SER 72 -7.368 9.148 5.342 640 HA SER 72 HA SER 72 -5.719 11.397 5.009 641 HB2 SER 72 2HB SER 72 -7.492 10.626 3.401 642 HB3 SER 72 3HB SER 72 -8.729 11.234 4.501 643 HG SER 72 HG SER 72 -8.277 13.236 3.906 644 H LYS 73 H LYS 73 -8.238 10.700 7.320 645 HA LYS 73 HA LYS 73 -8.363 13.381 8.444 646 HB2 LYS 73 2HB LYS 73 -9.575 10.739 9.380 647 HB3 LYS 73 3HB LYS 73 -9.919 12.319 10.084 648 HG2 LYS 73 2HG LYS 73 -10.891 13.071 7.935 649 HG3 LYS 73 3HG LYS 73 -10.527 11.498 7.226 650 HD2 LYS 73 2HD LYS 73 -12.876 11.567 7.802 651 HD3 LYS 73 3HD LYS 73 -12.070 10.424 8.874 652 HE2 LYS 73 2HE LYS 73 -12.668 13.286 9.680 653 HE3 LYS 73 3HE LYS 73 -13.804 11.965 9.931 654 HZ1 LYS 73 3HZ LYS 73 -12.021 10.844 11.246 655 HZ2 LYS 73 1HZ LYS 73 -12.609 12.277 11.926 656 HZ3 LYS 73 2HZ LYS 73 -11.115 12.270 11.149 657 H LEU 74 H LEU 74 -6.907 10.228 9.227 658 HA LEU 74 HA LEU 74 -6.087 10.802 11.885 659 HB2 LEU 74 2HB LEU 74 -4.988 8.776 9.894 660 HB3 LEU 74 3HB LEU 74 -4.572 8.804 11.601 661 HG LEU 74 HG LEU 74 -7.371 8.314 10.505 662 HD11 LEU 74 1HD1 LEU 74 -5.888 6.461 9.931 663 HD12 LEU 74 2HD1 LEU 74 -7.054 5.965 11.152 664 HD13 LEU 74 3HD1 LEU 74 -5.384 6.303 11.616 665 HD21 LEU 74 3HD2 LEU 74 -6.334 8.132 13.353 666 HD22 LEU 74 1HD2 LEU 74 -7.949 7.664 12.811 667 HD23 LEU 74 2HD2 LEU 74 -7.443 9.348 12.712 668 H GLY 75 H GLY 75 -4.522 11.219 8.760 669 HA2 GLY 75 2HA GLY 75 -2.914 12.686 8.089 670 HA3 GLY 75 3HA GLY 75 -2.793 13.284 9.731 671 H TYR 76 H TYR 76 -1.909 10.455 7.726 672 HA TYR 76 HA TYR 76 0.863 10.884 8.359 673 HB2 TYR 76 2HB TYR 76 1.348 8.536 9.093 674 HB3 TYR 76 3HB TYR 76 0.416 9.460 10.255 675 HD1 TYR 76 HD2 TYR 76 0.123 6.791 7.645 676 HD2 TYR 76 HD1 TYR 76 -1.674 8.603 11.075 677 HE1 TYR 76 HE2 TYR 76 -1.508 4.967 7.759 678 HE2 TYR 76 HE1 TYR 76 -3.298 6.762 11.186 679 HH TYR 76 HH TYR 76 -3.023 3.922 9.253 680 H LYS 77 H LYS 77 2.122 8.835 7.257 681 HA LYS 77 HA LYS 77 1.557 9.364 4.439 682 HB2 LYS 77 2HB LYS 77 3.982 8.157 5.847 683 HB3 LYS 77 3HB LYS 77 3.897 8.476 4.115 684 HG2 LYS 77 2HG LYS 77 3.643 10.600 6.268 685 HG3 LYS 77 3HG LYS 77 5.137 10.212 5.417 686 HD2 LYS 77 2HD LYS 77 4.102 10.884 3.273 687 HD3 LYS 77 3HD LYS 77 2.589 11.244 4.115 688 HE2 LYS 77 2HE LYS 77 3.747 12.980 5.436 689 HE3 LYS 77 3HE LYS 77 5.250 12.632 4.577 690 HZ1 LYS 77 3HZ LYS 77 4.028 14.568 3.704 691 HZ2 LYS 77 1HZ LYS 77 2.746 13.557 3.268 692 HZ3 LYS 77 2HZ LYS 77 4.257 13.371 2.540 693 H VAL 78 H VAL 78 0.855 7.888 3.019 694 HA VAL 78 HA VAL 78 1.396 5.021 3.425 695 HB VAL 78 HB VAL 78 -1.308 6.026 2.382 696 HG11 VAL 78 1HG1 VAL 78 -0.325 3.196 2.945 697 HG12 VAL 78 2HG1 VAL 78 -0.600 3.909 1.354 698 HG13 VAL 78 3HG1 VAL 78 -1.960 3.636 2.441 699 HG21 VAL 78 3HG2 VAL 78 -2.314 5.126 4.441 700 HG22 VAL 78 1HG2 VAL 78 -1.155 6.403 4.812 701 HG23 VAL 78 2HG2 VAL 78 -0.715 4.714 5.064 702 H PHE 79 H PHE 79 2.210 4.078 1.624 703 HA PHE 79 HA PHE 79 2.289 5.603 -0.931 704 HB2 PHE 79 2HB PHE 79 4.313 3.584 0.170 705 HB3 PHE 79 3HB PHE 79 4.467 4.500 -1.325 706 HD1 PHE 79 HD1 PHE 79 4.836 6.985 -1.225 707 HD2 PHE 79 HD2 PHE 79 4.945 4.559 2.292 708 HE1 PHE 79 HE1 PHE 79 5.976 8.790 -0.006 709 HE2 PHE 79 HE2 PHE 79 6.085 6.375 3.499 710 HZ PHE 79 HZ PHE 79 6.598 8.488 2.355 711 H LEU 80 H LEU 80 0.874 4.642 -2.336 712 HA LEU 80 HA LEU 80 0.228 1.782 -1.997 713 HB2 LEU 80 2HB LEU 80 -1.689 3.259 -1.824 714 HB3 LEU 80 3HB LEU 80 -1.302 4.029 -3.354 715 HG LEU 80 HG LEU 80 -1.883 1.977 -4.588 716 HD11 LEU 80 1HD1 LEU 80 -2.845 0.003 -3.524 717 HD12 LEU 80 2HD1 LEU 80 -2.538 0.691 -1.926 718 HD13 LEU 80 3HD1 LEU 80 -1.189 0.280 -2.987 719 HD21 LEU 80 3HD2 LEU 80 -4.082 2.756 -2.641 720 HD22 LEU 80 1HD2 LEU 80 -4.309 1.926 -4.186 721 HD23 LEU 80 2HD2 LEU 80 -3.686 3.573 -4.155 722 H LEU 81 H LEU 81 0.688 0.321 -3.481 723 HA LEU 81 HA LEU 81 1.454 1.110 -6.239 724 HB2 LEU 81 2HB LEU 81 3.381 0.195 -4.977 725 HB3 LEU 81 3HB LEU 81 2.458 -1.240 -4.575 726 HG LEU 81 HG LEU 81 2.437 -1.926 -6.952 727 HD11 LEU 81 1HD1 LEU 81 2.418 0.217 -8.059 728 HD12 LEU 81 2HD1 LEU 81 3.786 -0.729 -8.635 729 HD13 LEU 81 3HD1 LEU 81 4.046 0.582 -7.484 730 HD21 LEU 81 3HD2 LEU 81 4.268 -2.724 -5.529 731 HD22 LEU 81 1HD2 LEU 81 5.239 -1.306 -5.938 732 HD23 LEU 81 2HD2 LEU 81 4.827 -2.490 -7.181 733 H LEU 82 H LEU 82 0.386 0.088 -7.848 734 HA LEU 82 HA LEU 82 -1.669 -1.967 -7.208 735 HB2 LEU 82 2HB LEU 82 -1.775 0.326 -9.224 736 HB3 LEU 82 3HB LEU 82 -3.026 -0.893 -9.029 737 HG LEU 82 HG LEU 82 -2.225 1.087 -6.855 738 HD11 LEU 82 1HD1 LEU 82 -4.275 2.309 -7.370 739 HD12 LEU 82 2HD1 LEU 82 -4.603 1.231 -8.732 740 HD13 LEU 82 3HD1 LEU 82 -3.184 2.283 -8.754 741 HD21 LEU 82 3HD2 LEU 82 -4.307 0.395 -5.746 742 HD22 LEU 82 1HD2 LEU 82 -3.194 -0.957 -5.947 743 HD23 LEU 82 2HD2 LEU 82 -4.594 -0.805 -7.011 744 H ALA 83 H ALA 83 -1.477 -3.842 -8.425 745 HA ALA 83 HA ALA 83 -0.189 -3.800 -11.070 746 HB1 ALA 83 3HB ALA 83 1.404 -5.568 -10.528 747 HB2 ALA 83 1HB ALA 83 0.821 -5.631 -8.862 748 HB3 ALA 83 2HB ALA 83 1.653 -4.199 -9.450 749 H ASP 84 H ASP 84 -1.735 -4.683 -12.286 750 HA ASP 84 HA ASP 84 -2.599 -7.401 -11.981 751 HB2 ASP 84 2HB ASP 84 -4.212 -6.466 -10.398 752 HB3 ASP 84 3HB ASP 84 -4.629 -5.166 -11.503 753 H GLN 85 H GLN 85 -3.808 -8.131 -13.811 754 HA GLN 85 HA GLN 85 -2.963 -7.308 -16.323 755 HB2 GLN 85 2HB GLN 85 -3.828 -9.546 -15.862 756 HB3 GLN 85 3HB GLN 85 -5.412 -8.903 -15.453 757 HG2 GLN 85 2HG GLN 85 -5.569 -8.105 -17.874 758 HG3 GLN 85 3HG GLN 85 -4.126 -9.068 -18.189 759 HE21 GLN 85 1HE2 GLN 85 -6.747 -10.002 -15.981 760 HE22 GLN 85 2HE2 GLN 85 -7.317 -11.329 -16.927 761 H ASP 86 H ASP 86 -5.952 -6.477 -14.590 762 HA ASP 86 HA ASP 86 -7.031 -4.903 -16.778 763 HB2 ASP 86 2HB ASP 86 -8.313 -6.291 -14.848 764 HB3 ASP 86 3HB ASP 86 -8.178 -4.769 -13.975 765 H GLU 87 H GLU 87 -5.241 -3.524 -17.043 766 HA GLU 87 HA GLU 87 -3.954 -2.080 -14.978 767 HB2 GLU 87 2HB GLU 87 -2.609 -1.054 -16.689 768 HB3 GLU 87 3HB GLU 87 -2.872 -2.727 -17.145 769 HG2 GLU 87 2HG GLU 87 -4.252 -0.305 -18.337 770 HG3 GLU 87 3HG GLU 87 -2.954 -1.227 -19.082 771 H ASN 88 H ASN 88 -6.565 -1.169 -17.160 772 HA ASN 88 HA ASN 88 -6.280 1.686 -16.703 773 HB2 ASN 88 2HB ASN 88 -7.082 0.679 -18.888 774 HB3 ASN 88 3HB ASN 88 -8.591 0.258 -18.087 775 HD21 ASN 88 1HD2 ASN 88 -6.576 2.922 -19.181 776 HD22 ASN 88 2HD2 ASN 88 -7.821 4.118 -19.164 777 H GLU 89 H GLU 89 -8.104 -0.941 -15.340 778 HA GLU 89 HA GLU 89 -10.008 0.419 -13.763 779 HB2 GLU 89 2HB GLU 89 -9.966 -2.043 -14.067 780 HB3 GLU 89 3HB GLU 89 -8.445 -2.147 -13.201 781 HG2 GLU 89 2HG GLU 89 -10.131 -2.885 -11.702 782 HG3 GLU 89 3HG GLU 89 -9.657 -1.280 -11.151 783 H LEU 90 H LEU 90 -6.671 -0.575 -13.146 784 HA LEU 90 HA LEU 90 -6.448 0.537 -10.514 785 HB2 LEU 90 2HB LEU 90 -4.261 -0.297 -12.458 786 HB3 LEU 90 3HB LEU 90 -4.034 0.034 -10.745 787 HG LEU 90 HG LEU 90 -5.650 -2.267 -11.906 788 HD11 LEU 90 1HD1 LEU 90 -3.287 -2.575 -12.280 789 HD12 LEU 90 2HD1 LEU 90 -3.803 -3.659 -10.994 790 HD13 LEU 90 3HD1 LEU 90 -2.914 -2.191 -10.598 791 HD21 LEU 90 3HD2 LEU 90 -6.613 -1.548 -9.766 792 HD22 LEU 90 1HD2 LEU 90 -5.025 -1.630 -8.993 793 HD23 LEU 90 2HD2 LEU 90 -5.802 -3.101 -9.586 794 H GLU 91 H GLU 91 -5.780 1.675 -13.761 795 HA GLU 91 HA GLU 91 -4.191 3.944 -13.136 796 HB2 GLU 91 2HB GLU 91 -4.237 2.972 -15.402 797 HB3 GLU 91 3HB GLU 91 -5.944 3.374 -15.571 798 HG2 GLU 91 2HG GLU 91 -5.423 5.762 -15.516 799 HG3 GLU 91 3HG GLU 91 -3.720 5.411 -15.223 800 H GLU 92 H GLU 92 -7.656 3.410 -13.615 801 HA GLU 92 HA GLU 92 -8.528 6.095 -13.255 802 HB2 GLU 92 2HB GLU 92 -9.707 3.799 -14.162 803 HB3 GLU 92 3HB GLU 92 -10.350 3.796 -12.531 804 HG2 GLU 92 2HG GLU 92 -10.694 5.986 -14.602 805 HG3 GLU 92 3HG GLU 92 -11.909 4.808 -14.119 806 H PHE 93 H PHE 93 -8.129 3.322 -11.124 807 HA PHE 93 HA PHE 93 -9.203 4.280 -8.729 808 HB2 PHE 93 2HB PHE 93 -8.542 1.886 -9.269 809 HB3 PHE 93 3HB PHE 93 -6.862 2.334 -8.990 810 HD1 PHE 93 HD1 PHE 93 -10.207 2.513 -7.290 811 HD2 PHE 93 HD2 PHE 93 -6.002 1.919 -6.813 812 HE1 PHE 93 HE1 PHE 93 -10.533 2.035 -4.905 813 HE2 PHE 93 HE2 PHE 93 -6.341 1.441 -4.423 814 HZ PHE 93 HZ PHE 93 -8.613 1.502 -3.471 815 H LYS 94 H LYS 94 -5.830 4.394 -9.910 816 HA LYS 94 HA LYS 94 -4.733 5.512 -7.540 817 HB2 LYS 94 2HB LYS 94 -2.621 5.758 -8.775 818 HB3 LYS 94 3HB LYS 94 -3.318 4.173 -9.005 819 HG2 LYS 94 2HG LYS 94 -2.443 4.696 -11.105 820 HG3 LYS 94 3HG LYS 94 -4.159 5.050 -11.276 821 HD2 LYS 94 2HD LYS 94 -2.742 6.772 -12.354 822 HD3 LYS 94 3HD LYS 94 -3.723 7.458 -11.059 823 HE2 LYS 94 2HE LYS 94 -1.699 7.299 -9.549 824 HE3 LYS 94 3HE LYS 94 -0.760 6.792 -10.958 825 HZ1 LYS 94 3HZ LYS 94 -0.558 9.176 -10.556 826 HZ2 LYS 94 1HZ LYS 94 -2.228 9.368 -10.708 827 HZ3 LYS 94 2HZ LYS 94 -1.307 8.877 -12.034 828 H ARG 95 H ARG 95 -6.286 6.944 -10.280 829 HA ARG 95 HA ARG 95 -5.397 9.616 -10.047 830 HB2 ARG 95 2HB ARG 95 -8.123 8.540 -10.921 831 HB3 ARG 95 3HB ARG 95 -7.590 10.207 -11.147 832 HG2 ARG 95 2HG ARG 95 -5.828 9.485 -12.667 833 HG3 ARG 95 3HG ARG 95 -6.217 7.795 -12.360 834 HD2 ARG 95 2HD ARG 95 -8.569 8.341 -13.265 835 HD3 ARG 95 3HD ARG 95 -7.854 9.846 -13.862 836 HE ARG 95 HE ARG 95 -6.160 8.096 -14.907 837 HH11 ARG 95 1HH1 ARG 95 -9.666 7.948 -14.773 838 HH12 ARG 95 2HH1 ARG 95 -9.805 7.021 -16.238 839 HH21 ARG 95 1HH2 ARG 95 -6.354 6.837 -16.823 840 HH22 ARG 95 2HH2 ARG 95 -7.936 6.395 -17.393 841 H LYS 96 H LYS 96 -8.075 7.865 -8.513 842 HA LYS 96 HA LYS 96 -9.098 10.074 -6.999 843 HB2 LYS 96 2HB LYS 96 -9.695 7.101 -7.116 844 HB3 LYS 96 3HB LYS 96 -10.347 8.052 -5.788 845 HG2 LYS 96 2HG LYS 96 -11.962 7.760 -7.657 846 HG3 LYS 96 3HG LYS 96 -11.613 9.454 -7.299 847 HD2 LYS 96 2HD LYS 96 -10.014 9.487 -9.233 848 HD3 LYS 96 3HD LYS 96 -10.477 7.825 -9.609 849 HE2 LYS 96 2HE LYS 96 -12.433 10.149 -9.540 850 HE3 LYS 96 3HE LYS 96 -11.621 9.583 -11.003 851 HZ1 LYS 96 3HZ LYS 96 -13.426 7.968 -9.299 852 HZ2 LYS 96 1HZ LYS 96 -12.636 7.425 -10.683 853 HZ3 LYS 96 2HZ LYS 96 -13.813 8.626 -10.804 854 H ILE 97 H ILE 97 -6.754 7.528 -6.382 855 HA ILE 97 HA ILE 97 -6.551 7.943 -3.540 856 HB ILE 97 HB ILE 97 -4.548 6.644 -5.453 857 HG12 ILE 97 2HG1 ILE 97 -6.683 5.474 -5.601 858 HG13 ILE 97 3HG1 ILE 97 -5.561 4.464 -4.709 859 HG21 ILE 97 1HG2 ILE 97 -3.662 5.486 -3.448 860 HG22 ILE 97 2HG2 ILE 97 -4.752 6.430 -2.430 861 HG23 ILE 97 3HG2 ILE 97 -3.475 7.239 -3.339 862 HD11 ILE 97 3HD1 ILE 97 -6.678 5.141 -2.606 863 HD12 ILE 97 1HD1 ILE 97 -7.769 4.353 -3.745 864 HD13 ILE 97 2HD1 ILE 97 -7.822 6.103 -3.545 865 H GLU 98 H GLU 98 -4.866 9.124 -6.411 866 HA GLU 98 HA GLU 98 -2.904 10.751 -5.105 867 HB2 GLU 98 2HB GLU 98 -2.712 9.850 -7.442 868 HB3 GLU 98 3HB GLU 98 -4.012 10.922 -7.951 869 HG2 GLU 98 2HG GLU 98 -2.581 12.873 -7.345 870 HG3 GLU 98 3HG GLU 98 -1.274 11.759 -6.937 871 H SER 99 H SER 99 -6.218 11.258 -6.227 872 HA SER 99 HA SER 99 -6.348 14.082 -5.901 873 HB2 SER 99 2HB SER 99 -8.574 11.992 -5.883 874 HB3 SER 99 3HB SER 99 -8.839 13.742 -5.928 875 HG SER 99 HG SER 99 -7.084 12.860 -7.851 876 H GLN 100 H GLN 100 -6.944 11.333 -3.718 877 HA GLN 100 HA GLN 100 -7.761 12.816 -1.429 878 HB2 GLN 100 2HB GLN 100 -6.378 10.107 -1.678 879 HB3 GLN 100 3HB GLN 100 -6.901 10.775 -0.135 880 HG2 GLN 100 2HG GLN 100 -9.243 10.768 -0.923 881 HG3 GLN 100 3HG GLN 100 -8.721 10.082 -2.464 882 HE21 GLN 100 1HE2 GLN 100 -7.981 7.913 -2.501 883 HE22 GLN 100 2HE2 GLN 100 -8.313 6.807 -1.218 884 H GLY 101 H GLY 101 -4.633 12.197 -2.876 885 HA2 GLY 101 2HA GLY 101 -2.803 13.689 -2.577 886 HA3 GLY 101 3HA GLY 101 -3.328 14.001 -0.930 887 H TYR 102 H TYR 102 -3.015 10.802 -2.459 888 HA TYR 102 HA TYR 102 -0.772 10.160 -0.622 889 HB2 TYR 102 2HB TYR 102 -2.831 8.330 -1.929 890 HB3 TYR 102 3HB TYR 102 -1.417 7.738 -1.055 891 HD1 TYR 102 HD2 TYR 102 -1.164 8.300 1.407 892 HD2 TYR 102 HD1 TYR 102 -4.801 9.012 -0.728 893 HE1 TYR 102 HE2 TYR 102 -2.375 8.505 3.533 894 HE2 TYR 102 HE1 TYR 102 -6.004 9.227 1.406 895 HH TYR 102 HH TYR 102 -4.414 9.586 4.360 896 H GLU 103 H GLU 103 1.043 9.160 -1.371 897 HA GLU 103 HA GLU 103 1.774 9.493 -4.129 898 HB2 GLU 103 2HB GLU 103 3.442 9.823 -2.357 899 HB3 GLU 103 3HB GLU 103 3.216 8.175 -1.785 900 HG2 GLU 103 2HG GLU 103 5.289 8.377 -3.057 901 HG3 GLU 103 3HG GLU 103 4.164 7.295 -3.875 902 H VAL 104 H VAL 104 1.060 8.113 -5.626 903 HA VAL 104 HA VAL 104 0.805 5.238 -5.054 904 HB VAL 104 HB VAL 104 -1.407 6.145 -4.596 905 HG11 VAL 104 1HG1 VAL 104 -2.779 7.304 -6.273 906 HG12 VAL 104 2HG1 VAL 104 -1.413 7.328 -7.393 907 HG13 VAL 104 3HG1 VAL 104 -1.325 8.220 -5.871 908 HG21 VAL 104 3HG2 VAL 104 -2.771 4.767 -6.123 909 HG22 VAL 104 1HG2 VAL 104 -1.309 3.913 -5.630 910 HG23 VAL 104 2HG2 VAL 104 -1.412 4.625 -7.242 911 H ARG 105 H ARG 105 1.408 3.983 -6.699 912 HA ARG 105 HA ARG 105 1.664 5.066 -9.444 913 HB2 ARG 105 2HB ARG 105 3.707 3.278 -8.030 914 HB3 ARG 105 3HB ARG 105 3.793 3.798 -9.711 915 HG2 ARG 105 2HG ARG 105 3.898 5.662 -7.320 916 HG3 ARG 105 3HG ARG 105 5.315 5.057 -8.177 917 HD2 ARG 105 2HD ARG 105 4.926 6.402 -10.047 918 HD3 ARG 105 3HD ARG 105 3.188 6.511 -9.753 919 HE ARG 105 HE ARG 105 4.434 7.784 -7.631 920 HH11 ARG 105 1HH1 ARG 105 4.193 8.316 -11.102 921 HH12 ARG 105 2HH1 ARG 105 4.349 10.037 -10.955 922 HH21 ARG 105 1HH2 ARG 105 4.460 10.045 -7.454 923 HH22 ARG 105 2HH2 ARG 105 4.499 11.016 -8.902 924 H LYS 106 H LYS 106 1.536 3.479 -11.097 925 HA LYS 106 HA LYS 106 0.274 0.889 -10.378 926 HB2 LYS 106 2HB LYS 106 -1.374 2.504 -11.365 927 HB3 LYS 106 3HB LYS 106 -0.351 2.665 -12.791 928 HG2 LYS 106 2HG LYS 106 -0.661 -0.020 -12.854 929 HG3 LYS 106 3HG LYS 106 -2.114 0.382 -11.943 930 HD2 LYS 106 2HD LYS 106 -2.903 0.376 -14.136 931 HD3 LYS 106 3HD LYS 106 -2.579 2.086 -13.882 932 HE2 LYS 106 2HE LYS 106 -0.791 0.121 -15.362 933 HE3 LYS 106 3HE LYS 106 -1.814 1.354 -16.092 934 HZ1 LYS 106 3HZ LYS 106 0.574 1.810 -14.398 935 HZ2 LYS 106 1HZ LYS 106 -0.462 3.033 -14.919 936 HZ3 LYS 106 2HZ LYS 106 0.416 2.135 -16.047 937 H VAL 107 H VAL 107 1.101 -0.853 -11.411 938 HA VAL 107 HA VAL 107 3.089 -0.571 -13.569 939 HB VAL 107 HB VAL 107 4.493 -2.350 -12.514 940 HG11 VAL 107 1HG1 VAL 107 5.128 -0.004 -12.213 941 HG12 VAL 107 2HG1 VAL 107 5.547 -0.951 -10.786 942 HG13 VAL 107 3HG1 VAL 107 4.131 0.105 -10.757 943 HG21 VAL 107 3HG2 VAL 107 2.809 -3.439 -11.106 944 HG22 VAL 107 1HG2 VAL 107 2.675 -1.996 -10.096 945 HG23 VAL 107 2HG2 VAL 107 4.175 -2.926 -10.122 946 H THR 108 H THR 108 3.488 -2.600 -14.694 947 HA THR 108 HA THR 108 1.230 -4.518 -14.669 948 HB THR 108 HB THR 108 1.644 -4.708 -17.210 949 HG1 THR 108 HG1 THR 108 3.423 -3.634 -17.711 950 HG21 THR 108 3HG2 THR 108 0.529 -2.065 -16.181 951 HG22 THR 108 1HG2 THR 108 -0.367 -3.584 -16.331 952 HG23 THR 108 2HG2 THR 108 0.232 -2.767 -17.774 953 H ASP 109 H ASP 109 4.655 -4.050 -14.575 954 HA ASP 109 HA ASP 109 5.135 -6.946 -15.018 955 HB2 ASP 109 2HB ASP 109 7.071 -4.599 -15.159 956 HB3 ASP 109 3HB ASP 109 7.589 -6.277 -15.205 957 H ASP 110 H ASP 110 6.420 -8.097 -13.621 958 HA ASP 110 HA ASP 110 6.122 -7.614 -10.826 959 HB2 ASP 110 2HB ASP 110 6.140 -9.899 -11.458 960 HB3 ASP 110 3HB ASP 110 7.523 -9.714 -12.519 961 H GLU 111 H GLU 111 8.961 -7.676 -12.986 962 HA GLU 111 HA GLU 111 10.902 -6.866 -11.114 963 HB2 GLU 111 2HB GLU 111 12.336 -6.398 -13.134 964 HB3 GLU 111 3HB GLU 111 11.610 -7.994 -13.096 965 HG2 GLU 111 2HG GLU 111 11.280 -7.492 -15.306 966 HG3 GLU 111 3HG GLU 111 9.771 -6.869 -14.653 967 H GLU 112 H GLU 112 8.645 -5.033 -12.999 968 HA GLU 112 HA GLU 112 9.815 -2.428 -12.610 969 HB2 GLU 112 2HB GLU 112 8.402 -2.946 -14.552 970 HB3 GLU 112 3HB GLU 112 7.043 -3.324 -13.503 971 HG2 GLU 112 2HG GLU 112 7.018 -0.935 -12.759 972 HG3 GLU 112 3HG GLU 112 8.307 -0.597 -13.918 973 H ALA 113 H ALA 113 7.223 -4.334 -11.091 974 HA ALA 113 HA ALA 113 6.248 -2.465 -9.247 975 HB1 ALA 113 3HB ALA 113 5.130 -4.611 -9.704 976 HB2 ALA 113 1HB ALA 113 5.399 -4.391 -7.974 977 HB3 ALA 113 2HB ALA 113 6.437 -5.482 -8.899 978 H LEU 114 H LEU 114 8.939 -4.767 -8.978 979 HA LEU 114 HA LEU 114 9.657 -4.278 -6.279 980 HB2 LEU 114 2HB LEU 114 11.387 -5.268 -8.585 981 HB3 LEU 114 3HB LEU 114 11.825 -5.377 -6.886 982 HG LEU 114 HG LEU 114 9.468 -6.811 -8.189 983 HD11 LEU 114 1HD1 LEU 114 11.603 -7.736 -8.951 984 HD12 LEU 114 2HD1 LEU 114 10.750 -8.878 -7.918 985 HD13 LEU 114 3HD1 LEU 114 12.123 -7.970 -7.279 986 HD21 LEU 114 3HD2 LEU 114 8.982 -6.319 -5.845 987 HD22 LEU 114 1HD2 LEU 114 10.516 -7.040 -5.344 988 HD23 LEU 114 2HD2 LEU 114 9.254 -8.046 -6.063 989 H LYS 115 H LYS 115 10.549 -2.660 -9.298 990 HA LYS 115 HA LYS 115 12.575 -0.923 -8.349 991 HB2 LYS 115 2HB LYS 115 10.534 -0.470 -10.582 992 HB3 LYS 115 3HB LYS 115 11.931 0.562 -10.295 993 HG2 LYS 115 2HG LYS 115 13.446 -1.285 -10.822 994 HG3 LYS 115 3HG LYS 115 12.076 -2.380 -11.029 995 HD2 LYS 115 2HD LYS 115 11.270 -1.026 -12.939 996 HD3 LYS 115 3HD LYS 115 12.620 0.095 -12.726 997 HE2 LYS 115 2HE LYS 115 13.082 -1.441 -14.562 998 HE3 LYS 115 3HE LYS 115 14.205 -1.758 -13.240 999 HZ1 LYS 115 3HZ LYS 115 11.762 -3.329 -13.881 1000 HZ2 LYS 115 1HZ LYS 115 12.793 -3.626 -12.577 1001 HZ3 LYS 115 2HZ LYS 115 13.359 -3.807 -14.160 1002 H ILE 116 H ILE 116 9.028 -0.569 -8.527 1003 HA ILE 116 HA ILE 116 8.946 2.145 -7.645 1004 HB ILE 116 HB ILE 116 6.680 0.091 -7.667 1005 HG12 ILE 116 2HG1 ILE 116 7.638 0.352 -9.908 1006 HG13 ILE 116 3HG1 ILE 116 6.055 1.106 -9.852 1007 HG21 ILE 116 1HG2 ILE 116 6.546 3.128 -7.543 1008 HG22 ILE 116 2HG2 ILE 116 6.136 2.010 -6.241 1009 HG23 ILE 116 3HG2 ILE 116 5.166 2.043 -7.711 1010 HD11 ILE 116 3HD1 ILE 116 7.610 2.403 -11.157 1011 HD12 ILE 116 1HD1 ILE 116 8.710 2.538 -9.788 1012 HD13 ILE 116 2HD1 ILE 116 7.122 3.312 -9.729 1013 H VAL 117 H VAL 117 8.586 -0.979 -5.976 1014 HA VAL 117 HA VAL 117 7.957 -0.157 -3.396 1015 HB VAL 117 HB VAL 117 9.897 -2.390 -4.219 1016 HG11 VAL 117 1HG1 VAL 117 9.498 -3.357 -1.956 1017 HG12 VAL 117 2HG1 VAL 117 8.598 -1.907 -1.501 1018 HG13 VAL 117 3HG1 VAL 117 10.318 -1.796 -1.878 1019 HG21 VAL 117 3HG2 VAL 117 7.977 -3.907 -3.877 1020 HG22 VAL 117 1HG2 VAL 117 7.606 -2.689 -5.097 1021 HG23 VAL 117 2HG2 VAL 117 6.946 -2.532 -3.470 1022 H ARG 118 H ARG 118 11.148 -0.368 -4.966 1023 HA ARG 118 HA ARG 118 12.706 0.571 -2.793 1024 HB2 ARG 118 2HB ARG 118 13.270 0.396 -5.772 1025 HB3 ARG 118 3HB ARG 118 14.470 0.995 -4.632 1026 HG2 ARG 118 2HG ARG 118 14.511 -1.149 -3.474 1027 HG3 ARG 118 3HG ARG 118 13.208 -1.766 -4.494 1028 HD2 ARG 118 2HD ARG 118 14.665 -1.602 -6.474 1029 HD3 ARG 118 3HD ARG 118 15.954 -0.920 -5.483 1030 HE ARG 118 HE ARG 118 16.552 -3.025 -4.897 1031 HH11 ARG 118 1HH1 ARG 118 13.172 -3.243 -5.907 1032 HH12 ARG 118 2HH1 ARG 118 13.132 -4.970 -5.742 1033 HH21 ARG 118 1HH2 ARG 118 16.455 -5.277 -4.751 1034 HH22 ARG 118 2HH2 ARG 118 14.971 -6.107 -5.097 1035 H GLU 119 H GLU 119 11.067 2.299 -5.443 1036 HA GLU 119 HA GLU 119 12.100 4.889 -4.978 1037 HB2 GLU 119 2HB GLU 119 9.324 4.097 -5.987 1038 HB3 GLU 119 3HB GLU 119 10.009 5.715 -6.086 1039 HG2 GLU 119 2HG GLU 119 11.024 3.236 -7.503 1040 HG3 GLU 119 3HG GLU 119 10.153 4.579 -8.239 1041 H PHE 120 H PHE 120 9.218 3.250 -3.684 1042 HA PHE 120 HA PHE 120 8.347 5.221 -1.879 1043 HB2 PHE 120 2HB PHE 120 7.947 2.203 -1.858 1044 HB3 PHE 120 3HB PHE 120 7.107 3.297 -0.766 1045 HD1 PHE 120 HD2 PHE 120 6.935 5.405 -3.332 1046 HD2 PHE 120 HD1 PHE 120 5.649 1.409 -2.481 1047 HE1 PHE 120 HE2 PHE 120 5.074 5.658 -4.925 1048 HE2 PHE 120 HE1 PHE 120 3.793 1.683 -4.074 1049 HZ PHE 120 HZ PHE 120 3.501 3.802 -5.292 1050 H MET 121 H MET 121 10.825 2.753 -1.562 1051 HA MET 121 HA MET 121 11.189 2.885 1.267 1052 HB2 MET 121 2HB MET 121 13.167 2.035 -0.899 1053 HB3 MET 121 3HB MET 121 13.373 1.756 0.827 1054 HG2 MET 121 2HG MET 121 11.205 0.575 -0.914 1055 HG3 MET 121 3HG MET 121 12.622 -0.270 -0.310 1056 HE1 MET 121 3HE MET 121 11.940 -0.615 3.445 1057 HE2 MET 121 1HE MET 121 12.817 0.734 2.724 1058 HE3 MET 121 2HE MET 121 13.036 -0.900 2.097 1059 H GLN 122 H GLN 122 12.489 4.672 -1.479 1060 HA GLN 122 HA GLN 122 14.503 6.135 -0.016 1061 HB2 GLN 122 2HB GLN 122 13.246 6.542 -2.765 1062 HB3 GLN 122 3HB GLN 122 14.462 7.633 -2.112 1063 HG2 GLN 122 2HG GLN 122 14.904 4.664 -2.545 1064 HG3 GLN 122 3HG GLN 122 15.366 5.921 -3.690 1065 HE21 GLN 122 1HE2 GLN 122 17.072 3.999 -2.314 1066 HE22 GLN 122 2HE2 GLN 122 18.228 4.920 -1.421 1067 H LYS 123 H LYS 123 11.150 6.672 -0.945 1068 HA LYS 123 HA LYS 123 10.856 9.378 -0.143 1069 HB2 LYS 123 2HB LYS 123 8.819 7.125 -0.472 1070 HB3 LYS 123 3HB LYS 123 8.372 8.810 -0.201 1071 HG2 LYS 123 2HG LYS 123 9.238 9.497 -2.310 1072 HG3 LYS 123 3HG LYS 123 10.108 7.978 -2.536 1073 HD2 LYS 123 2HD LYS 123 7.951 6.780 -2.744 1074 HD3 LYS 123 3HD LYS 123 7.081 8.312 -2.565 1075 HE2 LYS 123 2HE LYS 123 9.042 7.658 -4.801 1076 HE3 LYS 123 3HE LYS 123 7.283 7.604 -4.937 1077 HZ1 LYS 123 3HZ LYS 123 8.794 10.042 -4.201 1078 HZ2 LYS 123 1HZ LYS 123 7.157 9.940 -4.582 1079 HZ3 LYS 123 2HZ LYS 123 8.323 9.681 -5.780 1080 H ALA 124 H ALA 124 10.115 6.293 1.472 1081 HA ALA 124 HA ALA 124 9.197 7.328 3.951 1082 HB1 ALA 124 3HB ALA 124 8.687 5.041 3.186 1083 HB2 ALA 124 1HB ALA 124 9.473 5.008 4.762 1084 HB3 ALA 124 2HB ALA 124 10.392 4.600 3.308 1085 H GLY 125 H GLY 125 12.370 6.447 2.680 1086 HA2 GLY 125 2HA GLY 125 13.908 6.724 5.055 1087 HA3 GLY 125 3HA GLY 125 14.515 6.795 3.402 1088 H SER 126 H SER 126 12.940 8.982 2.494 1089 HA SER 126 HA SER 126 14.475 11.226 3.317 1090 HB2 SER 126 2HB SER 126 11.913 11.059 1.677 1091 HB3 SER 126 3HB SER 126 12.853 12.537 1.884 1092 HG SER 126 HG SER 126 13.372 10.308 0.337 1093 H LEU 127 H LEU 127 11.512 9.857 4.479 1094 HA LEU 127 HA LEU 127 10.696 12.136 6.087 1095 HB2 LEU 127 2HB LEU 127 9.748 9.240 6.244 1096 HB3 LEU 127 3HB LEU 127 8.932 10.648 6.913 1097 HG LEU 127 HG LEU 127 9.339 10.178 3.935 1098 HD11 LEU 127 1HD1 LEU 127 6.986 9.518 3.822 1099 HD12 LEU 127 2HD1 LEU 127 6.862 9.613 5.581 1100 HD13 LEU 127 3HD1 LEU 127 7.923 8.418 4.831 1101 HD21 LEU 127 3HD2 LEU 127 7.564 12.181 5.357 1102 HD22 LEU 127 1HD2 LEU 127 7.664 11.927 3.610 1103 HD23 LEU 127 2HD2 LEU 127 9.060 12.540 4.492 1104 H GLU 128 H GLU 128 12.229 8.964 6.595 1105 HA GLU 128 HA GLU 128 12.320 9.262 9.484 1106 HB2 GLU 128 2HB GLU 128 11.727 7.092 8.560 1107 HB3 GLU 128 3HB GLU 128 13.241 7.001 7.658 1108 HG2 GLU 128 2HG GLU 128 14.515 6.906 9.743 1109 HG3 GLU 128 3HG GLU 128 13.038 7.107 10.687 1110 H HIS 129 H HIS 129 14.943 8.316 7.167 1111 HA HIS 129 HA HIS 129 16.885 9.951 8.724 1112 HB2 HIS 129 2HB HIS 129 17.375 7.179 7.526 1113 HB3 HIS 129 3HB HIS 129 18.597 8.183 8.296 1114 HD1 HIS 129 HD1 HIS 129 16.857 5.294 9.039 1115 HD2 HIS 129 HD2 HIS 129 17.407 8.838 11.127 1116 HE1 HIS 129 HE1 HIS 129 16.510 4.713 11.452 1117 HE2 HIS 129 HE2 HIS 129 16.626 6.918 12.654 1118 H HIS 130 H HIS 130 16.893 11.659 7.228 1119 HA HIS 130 HA HIS 130 17.764 11.015 4.469 1120 HB2 HIS 130 2HB HIS 130 16.739 13.118 3.729 1121 HB3 HIS 130 3HB HIS 130 15.554 12.088 4.510 1122 HD1 HIS 130 HD1 HIS 130 17.099 15.428 4.679 1123 HD2 HIS 130 HD2 HIS 130 14.626 13.086 7.068 1124 HE1 HIS 130 HE1 HIS 130 16.103 16.998 6.362 1125 HE2 HIS 130 HE2 HIS 130 14.433 15.605 7.620 1126 H HIS 131 H HIS 131 19.715 11.621 3.898 1127 HA HIS 131 HA HIS 131 21.122 13.818 5.327 1128 HB2 HIS 131 2HB HIS 131 22.341 11.252 4.188 1129 HB3 HIS 131 3HB HIS 131 23.254 12.579 4.904 1130 HD1 HIS 131 HD1 HIS 131 22.102 9.364 5.766 1131 HD2 HIS 131 HD2 HIS 131 22.153 13.006 7.777 1132 HE1 HIS 131 HE1 HIS 131 21.887 8.793 8.202 1133 HE2 HIS 131 HE2 HIS 131 21.801 11.012 9.377 1134 H HIS 132 H HIS 132 20.866 11.945 2.288 1135 HA HIS 132 HA HIS 132 21.739 14.162 0.626 1136 HB2 HIS 132 2HB HIS 132 22.142 11.827 -0.104 1137 HB3 HIS 132 3HB HIS 132 20.416 11.503 -0.097 1138 HD1 HIS 132 HD1 HIS 132 23.131 12.710 -2.256 1139 HD2 HIS 132 HD2 HIS 132 18.976 12.941 -2.232 1140 HE1 HIS 132 HE1 HIS 132 22.456 13.293 -4.604 1141 HE2 HIS 132 HE2 HIS 132 19.953 13.231 -4.598 1142 H HIS 133 H HIS 133 20.398 15.863 0.915 1143 HA HIS 133 HA HIS 133 17.505 15.711 0.825 1144 HB2 HIS 133 2HB HIS 133 18.766 17.480 2.113 1145 HB3 HIS 133 3HB HIS 133 19.333 18.155 0.592 1146 HD1 HIS 133 HD1 HIS 133 17.635 19.562 -0.780 1147 HD2 HIS 133 HD2 HIS 133 16.076 17.981 2.733 1148 HE1 HIS 133 HE1 HIS 133 15.448 20.739 -0.418 1149 HE2 HIS 133 HE2 HIS 133 14.442 19.617 1.585 1150 H HIS 134 H HIS 134 16.211 16.245 -0.947 1151 HA HIS 134 HA HIS 134 17.541 16.653 -3.559 1152 HB2 HIS 134 2HB HIS 134 16.095 14.668 -3.543 1153 HB3 HIS 134 3HB HIS 134 14.733 15.606 -2.931 1154 HD1 HIS 134 HD1 HIS 134 16.957 15.449 -6.031 1155 HD2 HIS 134 HD2 HIS 134 13.125 16.624 -4.920 1156 HE1 HIS 134 HE1 HIS 134 15.828 16.171 -8.152 1157 HE2 HIS 134 HE2 HIS 134 13.472 16.725 -7.473 Start of MODEL 8 1 H1 MET 1 1H MET 1 1.900 9.897 13.526 2 H2 MET 1 2H MET 1 2.943 11.225 13.624 3 H3 MET 1 3H MET 1 3.409 9.722 14.243 4 HA MET 1 HA MET 1 2.829 10.229 11.399 5 HB2 MET 1 2HB MET 1 4.825 11.511 12.083 6 HB3 MET 1 3HB MET 1 5.524 10.081 12.828 7 HG2 MET 1 2HG MET 1 6.563 10.609 10.642 8 HG3 MET 1 3HG MET 1 5.781 9.024 10.635 9 HE1 MET 1 3HE MET 1 6.576 10.367 7.877 10 HE2 MET 1 1HE MET 1 5.096 10.111 6.952 11 HE3 MET 1 2HE MET 1 5.700 8.839 8.015 12 H LYS 2 H LYS 2 2.978 8.413 10.114 13 HA LYS 2 HA LYS 2 4.372 6.038 10.934 14 HB2 LYS 2 2HB LYS 2 2.128 5.796 12.081 15 HB3 LYS 2 3HB LYS 2 1.349 5.834 10.501 16 HG2 LYS 2 2HG LYS 2 2.455 3.752 9.868 17 HG3 LYS 2 3HG LYS 2 3.374 3.739 11.374 18 HD2 LYS 2 2HD LYS 2 0.344 3.722 11.419 19 HD3 LYS 2 3HD LYS 2 1.241 2.231 11.144 20 HE2 LYS 2 2HE LYS 2 0.588 2.513 13.509 21 HE3 LYS 2 3HE LYS 2 2.332 2.430 13.307 22 HZ1 LYS 2 3HZ LYS 2 2.439 4.829 13.579 23 HZ2 LYS 2 1HZ LYS 2 1.690 4.098 14.907 24 HZ3 LYS 2 2HZ LYS 2 0.757 4.907 13.753 25 H ILE 3 H ILE 3 4.586 4.555 9.130 26 HA ILE 3 HA ILE 3 4.085 5.758 6.470 27 HB ILE 3 HB ILE 3 6.484 4.106 7.404 28 HG12 ILE 3 2HG1 ILE 3 6.361 7.032 6.539 29 HG13 ILE 3 3HG1 ILE 3 6.503 6.477 8.203 30 HG21 ILE 3 1HG2 ILE 3 7.419 4.475 5.141 31 HG22 ILE 3 2HG2 ILE 3 5.920 5.268 4.654 32 HG23 ILE 3 3HG2 ILE 3 5.914 3.555 5.080 33 HD11 ILE 3 3HD1 ILE 3 8.670 5.468 7.664 34 HD12 ILE 3 1HD1 ILE 3 8.629 7.205 7.368 35 HD13 ILE 3 2HD1 ILE 3 8.533 6.082 6.014 36 H LEU 4 H LEU 4 2.417 4.572 5.669 37 HA LEU 4 HA LEU 4 2.550 1.614 5.784 38 HB2 LEU 4 2HB LEU 4 0.249 3.518 5.219 39 HB3 LEU 4 3HB LEU 4 0.169 1.831 4.745 40 HG LEU 4 HG LEU 4 0.496 1.208 7.193 41 HD11 LEU 4 1HD1 LEU 4 0.004 2.896 8.911 42 HD12 LEU 4 2HD1 LEU 4 0.005 4.154 7.673 43 HD13 LEU 4 3HD1 LEU 4 1.485 3.264 8.028 44 HD21 LEU 4 3HD2 LEU 4 -1.705 1.119 6.126 45 HD22 LEU 4 1HD2 LEU 4 -1.985 2.817 6.524 46 HD23 LEU 4 2HD2 LEU 4 -1.840 1.617 7.812 47 H ILE 5 H ILE 5 3.065 0.510 3.949 48 HA ILE 5 HA ILE 5 2.723 1.865 1.326 49 HB ILE 5 HB ILE 5 4.509 -0.544 1.958 50 HG12 ILE 5 2HG1 ILE 5 5.239 2.326 1.206 51 HG13 ILE 5 3HG1 ILE 5 5.504 1.565 2.770 52 HG21 ILE 5 1HG2 ILE 5 5.238 -0.415 -0.410 53 HG22 ILE 5 2HG2 ILE 5 4.083 0.887 -0.696 54 HG23 ILE 5 3HG2 ILE 5 3.504 -0.731 -0.295 55 HD11 ILE 5 3HD1 ILE 5 7.566 1.710 1.539 56 HD12 ILE 5 1HD1 ILE 5 6.869 0.836 0.174 57 HD13 ILE 5 2HD1 ILE 5 7.109 0.018 1.723 58 H LEU 6 H LEU 6 0.870 1.284 0.455 59 HA LEU 6 HA LEU 6 -0.524 -1.179 1.155 60 HB2 LEU 6 2HB LEU 6 -1.359 1.080 -0.720 61 HB3 LEU 6 3HB LEU 6 -2.379 -0.262 -0.214 62 HG LEU 6 HG LEU 6 -1.327 1.964 1.560 63 HD11 LEU 6 1HD1 LEU 6 -3.108 2.708 0.058 64 HD12 LEU 6 2HD1 LEU 6 -3.663 2.670 1.728 65 HD13 LEU 6 3HD1 LEU 6 -4.152 1.392 0.610 66 HD21 LEU 6 3HD2 LEU 6 -1.454 -0.115 2.825 67 HD22 LEU 6 1HD2 LEU 6 -3.122 -0.367 2.292 68 HD23 LEU 6 2HD2 LEU 6 -2.715 1.002 3.335 69 H ILE 7 H ILE 7 -0.574 -2.889 -0.142 70 HA ILE 7 HA ILE 7 0.346 -2.698 -2.950 71 HB ILE 7 HB ILE 7 0.881 -4.999 -0.996 72 HG12 ILE 7 2HG1 ILE 7 2.399 -3.067 -0.595 73 HG13 ILE 7 3HG1 ILE 7 3.279 -4.458 -1.212 74 HG21 ILE 7 1HG2 ILE 7 2.183 -6.040 -2.839 75 HG22 ILE 7 2HG2 ILE 7 1.660 -4.752 -3.926 76 HG23 ILE 7 3HG2 ILE 7 0.474 -5.870 -3.250 77 HD11 ILE 7 3HD1 ILE 7 4.078 -2.395 -2.187 78 HD12 ILE 7 1HD1 ILE 7 2.469 -2.027 -2.805 79 HD13 ILE 7 2HD1 ILE 7 3.361 -3.420 -3.430 80 H ASN 8 H ASN 8 -1.483 -2.928 -4.093 81 HA ASN 8 HA ASN 8 -3.189 -5.293 -3.549 82 HB2 ASN 8 2HB ASN 8 -4.503 -3.206 -3.337 83 HB3 ASN 8 3HB ASN 8 -3.951 -2.667 -4.915 84 HD21 ASN 8 1HD2 ASN 8 -6.025 -4.954 -3.233 85 HD22 ASN 8 2HD2 ASN 8 -7.002 -5.361 -4.598 86 H THR 9 H THR 9 -1.968 -6.685 -4.705 87 HA THR 9 HA THR 9 -2.123 -6.364 -7.614 88 HB THR 9 HB THR 9 0.215 -6.019 -7.223 89 HG1 THR 9 HG1 THR 9 -0.127 -7.380 -8.962 90 HG21 THR 9 3HG2 THR 9 0.419 -6.932 -4.951 91 HG22 THR 9 1HG2 THR 9 1.679 -7.551 -6.026 92 HG23 THR 9 2HG2 THR 9 0.297 -8.566 -5.605 93 H ASN 10 H ASN 10 -2.845 -8.065 -8.689 94 HA ASN 10 HA ASN 10 -4.064 -10.273 -7.299 95 HB2 ASN 10 2HB ASN 10 -5.032 -9.173 -9.342 96 HB3 ASN 10 3HB ASN 10 -3.700 -9.822 -10.289 97 HD21 ASN 10 1HD2 ASN 10 -5.270 -10.836 -11.611 98 HD22 ASN 10 2HD2 ASN 10 -6.068 -12.286 -11.108 99 H ASN 11 H ASN 11 -1.005 -9.643 -8.755 100 HA ASN 11 HA ASN 11 -0.118 -12.351 -9.150 101 HB2 ASN 11 2HB ASN 11 1.569 -9.823 -8.844 102 HB3 ASN 11 3HB ASN 11 2.104 -11.359 -9.520 103 HD21 ASN 11 1HD2 ASN 11 2.173 -8.727 -10.727 104 HD22 ASN 11 2HD2 ASN 11 1.255 -8.826 -12.189 105 H ASP 12 H ASP 12 -0.566 -13.396 -7.201 106 HA ASP 12 HA ASP 12 0.105 -12.460 -4.611 107 HB2 ASP 12 2HB ASP 12 -1.689 -14.133 -5.157 108 HB3 ASP 12 3HB ASP 12 -0.440 -15.322 -5.511 109 H GLU 13 H GLU 13 1.737 -14.533 -6.908 110 HA GLU 13 HA GLU 13 3.966 -15.438 -5.533 111 HB2 GLU 13 2HB GLU 13 5.069 -15.473 -7.804 112 HB3 GLU 13 3HB GLU 13 3.468 -16.207 -7.784 113 HG2 GLU 13 2HG GLU 13 2.492 -14.165 -8.767 114 HG3 GLU 13 3HG GLU 13 4.072 -13.387 -8.751 115 H LEU 14 H LEU 14 3.368 -12.315 -7.033 116 HA LEU 14 HA LEU 14 5.994 -11.229 -6.847 117 HB2 LEU 14 2HB LEU 14 4.473 -10.499 -8.563 118 HB3 LEU 14 3HB LEU 14 3.245 -10.077 -7.387 119 HG LEU 14 HG LEU 14 4.614 -8.149 -6.634 120 HD11 LEU 14 1HD1 LEU 14 6.856 -8.986 -7.104 121 HD12 LEU 14 2HD1 LEU 14 6.589 -7.422 -7.870 122 HD13 LEU 14 3HD1 LEU 14 6.547 -8.898 -8.840 123 HD21 LEU 14 3HD2 LEU 14 4.283 -6.749 -8.611 124 HD22 LEU 14 1HD2 LEU 14 2.915 -7.832 -8.368 125 HD23 LEU 14 2HD2 LEU 14 4.109 -8.181 -9.625 126 H ILE 15 H ILE 15 3.145 -11.185 -4.755 127 HA ILE 15 HA ILE 15 3.841 -9.018 -3.076 128 HB ILE 15 HB ILE 15 2.178 -11.461 -2.293 129 HG12 ILE 15 2HG1 ILE 15 1.254 -8.830 -3.524 130 HG13 ILE 15 3HG1 ILE 15 1.383 -10.351 -4.394 131 HG21 ILE 15 1HG2 ILE 15 1.110 -9.929 -0.651 132 HG22 ILE 15 2HG2 ILE 15 2.212 -8.640 -1.136 133 HG23 ILE 15 3HG2 ILE 15 2.844 -10.089 -0.350 134 HD11 ILE 15 3HD1 ILE 15 -0.355 -11.302 -2.962 135 HD12 ILE 15 1HD1 ILE 15 -0.898 -9.866 -3.830 136 HD13 ILE 15 2HD1 ILE 15 -0.491 -9.756 -2.118 137 H LYS 16 H LYS 16 4.590 -12.494 -2.923 138 HA LYS 16 HA LYS 16 5.725 -12.672 -0.355 139 HB2 LYS 16 2HB LYS 16 6.747 -14.238 -2.765 140 HB3 LYS 16 3HB LYS 16 6.772 -14.740 -1.077 141 HG2 LYS 16 2HG LYS 16 4.316 -14.435 -2.828 142 HG3 LYS 16 3HG LYS 16 5.083 -15.959 -2.379 143 HD2 LYS 16 2HD LYS 16 4.501 -15.511 0.015 144 HD3 LYS 16 3HD LYS 16 3.707 -14.010 -0.480 145 HE2 LYS 16 2HE LYS 16 2.152 -15.343 -1.901 146 HE3 LYS 16 3HE LYS 16 2.908 -16.823 -1.310 147 HZ1 LYS 16 3HZ LYS 16 1.529 -14.814 0.386 148 HZ2 LYS 16 1HZ LYS 16 2.175 -16.285 0.913 149 HZ3 LYS 16 2HZ LYS 16 0.849 -16.268 -0.141 150 H LYS 17 H LYS 17 7.006 -11.510 -3.370 151 HA LYS 17 HA LYS 17 9.788 -11.367 -2.603 152 HB2 LYS 17 2HB LYS 17 8.364 -10.193 -5.030 153 HB3 LYS 17 3HB LYS 17 10.099 -10.487 -4.866 154 HG2 LYS 17 2HG LYS 17 9.774 -12.881 -4.859 155 HG3 LYS 17 3HG LYS 17 8.025 -12.700 -4.731 156 HD2 LYS 17 2HD LYS 17 8.607 -13.346 -6.994 157 HD3 LYS 17 3HD LYS 17 7.969 -11.701 -7.002 158 HE2 LYS 17 2HE LYS 17 10.200 -10.786 -7.269 159 HE3 LYS 17 3HE LYS 17 10.926 -12.379 -7.043 160 HZ1 LYS 17 3HZ LYS 17 10.837 -11.807 -9.371 161 HZ2 LYS 17 1HZ LYS 17 9.165 -11.575 -9.290 162 HZ3 LYS 17 2HZ LYS 17 9.815 -13.117 -9.070 163 H ILE 18 H ILE 18 7.105 -9.070 -3.138 164 HA ILE 18 HA ILE 18 8.436 -6.633 -2.612 165 HB ILE 18 HB ILE 18 5.495 -7.388 -2.220 166 HG12 ILE 18 2HG1 ILE 18 6.874 -5.918 -4.517 167 HG13 ILE 18 3HG1 ILE 18 6.302 -7.579 -4.565 168 HG21 ILE 18 1HG2 ILE 18 6.704 -4.598 -2.240 169 HG22 ILE 18 2HG2 ILE 18 5.994 -5.411 -0.843 170 HG23 ILE 18 3HG2 ILE 18 4.977 -4.967 -2.215 171 HD11 ILE 18 3HD1 ILE 18 4.591 -5.103 -4.328 172 HD12 ILE 18 1HD1 ILE 18 3.992 -6.766 -4.291 173 HD13 ILE 18 2HD1 ILE 18 4.781 -6.146 -5.739 174 H LYS 19 H LYS 19 6.866 -9.003 -0.512 175 HA LYS 19 HA LYS 19 7.064 -7.763 1.989 176 HB2 LYS 19 2HB LYS 19 7.170 -10.707 1.218 177 HB3 LYS 19 3HB LYS 19 7.151 -10.165 2.893 178 HG2 LYS 19 2HG LYS 19 4.951 -9.184 2.616 179 HG3 LYS 19 3HG LYS 19 4.975 -9.526 0.886 180 HD2 LYS 19 2HD LYS 19 3.603 -11.216 1.823 181 HD3 LYS 19 3HD LYS 19 5.144 -12.009 1.509 182 HE2 LYS 19 2HE LYS 19 4.233 -10.981 4.222 183 HE3 LYS 19 3HE LYS 19 4.123 -12.647 3.690 184 HZ1 LYS 19 3HZ LYS 19 6.638 -11.115 4.109 185 HZ2 LYS 19 1HZ LYS 19 6.542 -12.715 3.565 186 HZ3 LYS 19 2HZ LYS 19 6.010 -12.318 5.116 187 H LYS 20 H LYS 20 9.336 -10.077 0.419 188 HA LYS 20 HA LYS 20 11.327 -10.044 2.388 189 HB2 LYS 20 2HB LYS 20 11.552 -10.598 -0.598 190 HB3 LYS 20 3HB LYS 20 12.876 -10.865 0.531 191 HG2 LYS 20 2HG LYS 20 10.186 -12.254 0.609 192 HG3 LYS 20 3HG LYS 20 11.669 -12.941 -0.041 193 HD2 LYS 20 2HD LYS 20 11.312 -12.114 2.870 194 HD3 LYS 20 3HD LYS 20 11.027 -13.743 2.266 195 HE2 LYS 20 2HE LYS 20 13.203 -13.762 3.233 196 HE3 LYS 20 3HE LYS 20 13.450 -13.764 1.490 197 HZ1 LYS 20 3HZ LYS 20 14.923 -12.235 2.740 198 HZ2 LYS 20 1HZ LYS 20 13.569 -11.326 3.178 199 HZ3 LYS 20 2HZ LYS 20 14.009 -11.457 1.553 200 H GLU 21 H GLU 21 10.809 -7.816 -0.312 201 HA GLU 21 HA GLU 21 13.211 -6.339 -0.178 202 HB2 GLU 21 2HB GLU 21 10.407 -5.464 -1.010 203 HB3 GLU 21 3HB GLU 21 11.855 -4.495 -1.267 204 HG2 GLU 21 2HG GLU 21 11.296 -7.214 -2.493 205 HG3 GLU 21 3HG GLU 21 11.156 -5.661 -3.314 206 H VAL 22 H VAL 22 10.017 -5.717 1.332 207 HA VAL 22 HA VAL 22 10.978 -3.310 2.648 208 HB VAL 22 HB VAL 22 8.680 -3.044 3.485 209 HG11 VAL 22 1HG1 VAL 22 9.213 -2.216 1.248 210 HG12 VAL 22 2HG1 VAL 22 7.537 -2.765 1.321 211 HG13 VAL 22 3HG1 VAL 22 8.764 -3.770 0.539 212 HG21 VAL 22 3HG2 VAL 22 6.882 -4.634 2.862 213 HG22 VAL 22 1HG2 VAL 22 8.076 -5.376 3.929 214 HG23 VAL 22 2HG2 VAL 22 8.091 -5.740 2.202 215 H GLU 23 H GLU 23 10.610 -6.631 3.584 216 HA GLU 23 HA GLU 23 10.441 -6.266 6.430 217 HB2 GLU 23 2HB GLU 23 11.092 -8.713 4.741 218 HB3 GLU 23 3HB GLU 23 11.049 -8.759 6.500 219 HG2 GLU 23 2HG GLU 23 8.665 -7.995 6.418 220 HG3 GLU 23 3HG GLU 23 8.728 -8.096 4.660 221 H ASN 24 H ASN 24 13.025 -6.376 4.118 222 HA ASN 24 HA ASN 24 15.210 -6.652 5.915 223 HB2 ASN 24 2HB ASN 24 15.052 -5.263 3.207 224 HB3 ASN 24 3HB ASN 24 16.553 -5.576 4.078 225 HD21 ASN 24 1HD2 ASN 24 15.776 -6.506 1.463 226 HD22 ASN 24 2HD2 ASN 24 15.823 -8.232 1.521 227 H GLN 25 H GLN 25 13.016 -4.050 5.316 228 HA GLN 25 HA GLN 25 14.626 -2.150 6.934 229 HB2 GLN 25 2HB GLN 25 12.264 -1.642 5.067 230 HB3 GLN 25 3HB GLN 25 13.049 -0.404 6.044 231 HG2 GLN 25 2HG GLN 25 14.406 -2.016 3.862 232 HG3 GLN 25 3HG GLN 25 13.783 -0.377 3.682 233 HE21 GLN 25 1HE2 GLN 25 16.298 -2.350 5.118 234 HE22 GLN 25 2HE2 GLN 25 17.356 -1.047 5.523 235 H GLY 26 H GLY 26 12.505 -4.491 7.499 236 HA2 GLY 26 2HA GLY 26 11.358 -5.052 9.387 237 HA3 GLY 26 3HA GLY 26 11.838 -3.517 10.088 238 H TYR 27 H TYR 27 9.941 -3.873 7.105 239 HA TYR 27 HA TYR 27 7.680 -2.451 8.185 240 HB2 TYR 27 2HB TYR 27 8.257 -3.790 5.536 241 HB3 TYR 27 3HB TYR 27 6.601 -3.338 5.923 242 HD1 TYR 27 HD1 TYR 27 10.065 -1.888 5.682 243 HD2 TYR 27 HD2 TYR 27 5.859 -1.150 5.451 244 HE1 TYR 27 HE1 TYR 27 10.506 0.368 4.837 245 HE2 TYR 27 HE2 TYR 27 6.307 1.114 4.614 246 HH TYR 27 HH TYR 27 8.072 2.750 4.582 247 H GLN 28 H GLN 28 6.011 -3.267 9.256 248 HA GLN 28 HA GLN 28 5.795 -6.088 9.848 249 HB2 GLN 28 2HB GLN 28 5.294 -4.090 11.446 250 HB3 GLN 28 3HB GLN 28 3.773 -3.921 10.582 251 HG2 GLN 28 2HG GLN 28 3.246 -5.214 12.481 252 HG3 GLN 28 3HG GLN 28 3.340 -6.387 11.176 253 HE21 GLN 28 1HE2 GLN 28 4.879 -5.183 14.061 254 HE22 GLN 28 2HE2 GLN 28 5.964 -6.506 14.283 255 H VAL 29 H VAL 29 4.730 -7.447 8.474 256 HA VAL 29 HA VAL 29 3.071 -6.340 6.330 257 HB VAL 29 HB VAL 29 3.944 -9.247 6.708 258 HG11 VAL 29 1HG1 VAL 29 3.346 -9.454 4.287 259 HG12 VAL 29 2HG1 VAL 29 2.756 -7.795 4.306 260 HG13 VAL 29 3HG1 VAL 29 1.952 -9.027 5.282 261 HG21 VAL 29 3HG2 VAL 29 5.680 -8.774 4.992 262 HG22 VAL 29 1HG2 VAL 29 5.919 -7.791 6.443 263 HG23 VAL 29 2HG2 VAL 29 5.211 -7.072 4.995 264 H ARG 30 H ARG 30 0.938 -6.350 6.418 265 HA ARG 30 HA ARG 30 -0.538 -8.360 8.021 266 HB2 ARG 30 2HB ARG 30 -1.113 -5.427 7.482 267 HB3 ARG 30 3HB ARG 30 -2.468 -6.527 7.680 268 HG2 ARG 30 2HG ARG 30 -2.056 -5.480 9.785 269 HG3 ARG 30 3HG ARG 30 -1.595 -7.174 9.909 270 HD2 ARG 30 2HD ARG 30 0.821 -6.409 9.533 271 HD3 ARG 30 3HD ARG 30 0.226 -4.760 9.740 272 HE ARG 30 HE ARG 30 -0.257 -5.201 11.990 273 HH11 ARG 30 1HH1 ARG 30 1.115 -8.055 10.430 274 HH12 ARG 30 2HH1 ARG 30 1.478 -8.843 11.933 275 HH21 ARG 30 1HH2 ARG 30 0.292 -6.217 13.933 276 HH22 ARG 30 2HH2 ARG 30 1.010 -7.798 13.919 277 H ASP 31 H ASP 31 -2.501 -9.146 7.024 278 HA ASP 31 HA ASP 31 -2.819 -8.580 4.126 279 HB2 ASP 31 2HB ASP 31 -1.811 -10.807 4.290 280 HB3 ASP 31 3HB ASP 31 -3.014 -11.315 5.474 281 H VAL 32 H VAL 32 -4.618 -7.544 3.944 282 HA VAL 32 HA VAL 32 -6.940 -8.063 5.693 283 HB VAL 32 HB VAL 32 -6.211 -5.531 4.132 284 HG11 VAL 32 1HG1 VAL 32 -8.455 -5.969 6.133 285 HG12 VAL 32 2HG1 VAL 32 -8.652 -5.858 4.386 286 HG13 VAL 32 3HG1 VAL 32 -8.079 -4.461 5.294 287 HG21 VAL 32 3HG2 VAL 32 -4.680 -5.856 6.044 288 HG22 VAL 32 1HG2 VAL 32 -6.059 -6.021 7.139 289 HG23 VAL 32 2HG2 VAL 32 -5.752 -4.483 6.324 290 H ASN 33 H ASN 33 -8.270 -9.393 4.615 291 HA ASN 33 HA ASN 33 -8.804 -9.035 1.719 292 HB2 ASN 33 2HB ASN 33 -9.381 -11.350 3.620 293 HB3 ASN 33 3HB ASN 33 -10.048 -11.261 1.995 294 HD21 ASN 33 1HD2 ASN 33 -6.728 -10.311 2.870 295 HD22 ASN 33 2HD2 ASN 33 -5.980 -11.587 1.988 296 H ASP 34 H ASP 34 -10.249 -8.998 4.917 297 HA ASP 34 HA ASP 34 -12.895 -8.250 3.793 298 HB2 ASP 34 2HB ASP 34 -12.819 -10.498 4.910 299 HB3 ASP 34 3HB ASP 34 -12.290 -9.723 6.399 300 H SER 35 H SER 35 -14.177 -6.828 5.124 301 HA SER 35 HA SER 35 -12.827 -4.476 5.892 302 HB2 SER 35 2HB SER 35 -15.171 -4.691 4.884 303 HB3 SER 35 3HB SER 35 -15.742 -5.113 6.499 304 HG SER 35 HG SER 35 -15.186 -2.700 5.445 305 H ASP 36 H ASP 36 -13.877 -7.250 7.767 306 HA ASP 36 HA ASP 36 -13.761 -6.230 10.390 307 HB2 ASP 36 2HB ASP 36 -14.584 -8.519 9.919 308 HB3 ASP 36 3HB ASP 36 -12.997 -9.009 9.342 309 H GLU 37 H GLU 37 -11.262 -7.857 8.451 310 HA GLU 37 HA GLU 37 -9.093 -7.561 10.217 311 HB2 GLU 37 2HB GLU 37 -9.032 -7.881 7.182 312 HB3 GLU 37 3HB GLU 37 -7.717 -8.265 8.292 313 HG2 GLU 37 2HG GLU 37 -9.049 -10.070 9.295 314 HG3 GLU 37 3HG GLU 37 -10.423 -9.652 8.273 315 H LEU 38 H LEU 38 -10.440 -5.416 7.791 316 HA LEU 38 HA LEU 38 -8.348 -3.529 7.566 317 HB2 LEU 38 2HB LEU 38 -10.232 -3.644 5.975 318 HB3 LEU 38 3HB LEU 38 -11.349 -3.162 7.240 319 HG LEU 38 HG LEU 38 -10.214 -0.931 7.373 320 HD11 LEU 38 1HD1 LEU 38 -7.985 -1.547 6.617 321 HD12 LEU 38 2HD1 LEU 38 -8.637 -0.236 5.639 322 HD13 LEU 38 3HD1 LEU 38 -8.599 -1.878 4.992 323 HD21 LEU 38 3HD2 LEU 38 -11.201 -1.628 4.593 324 HD22 LEU 38 1HD2 LEU 38 -11.109 -0.010 5.295 325 HD23 LEU 38 2HD2 LEU 38 -12.211 -1.204 5.976 326 H LYS 39 H LYS 39 -11.384 -3.377 9.508 327 HA LYS 39 HA LYS 39 -10.627 -0.924 10.731 328 HB2 LYS 39 2HB LYS 39 -12.697 -1.098 12.035 329 HB3 LYS 39 3HB LYS 39 -12.969 -1.422 10.337 330 HG2 LYS 39 2HG LYS 39 -14.340 -2.991 11.355 331 HG3 LYS 39 3HG LYS 39 -12.894 -3.944 11.030 332 HD2 LYS 39 2HD LYS 39 -12.205 -3.849 13.338 333 HD3 LYS 39 3HD LYS 39 -13.397 -2.597 13.710 334 HE2 LYS 39 2HE LYS 39 -14.052 -4.825 14.574 335 HE3 LYS 39 3HE LYS 39 -15.217 -4.182 13.418 336 HZ1 LYS 39 3HZ LYS 39 -14.754 -6.540 13.081 337 HZ2 LYS 39 1HZ LYS 39 -13.129 -6.195 12.772 338 HZ3 LYS 39 2HZ LYS 39 -14.331 -5.619 11.732 339 H LYS 40 H LYS 40 -10.102 -4.247 11.614 340 HA LYS 40 HA LYS 40 -9.494 -3.961 14.353 341 HB2 LYS 40 2HB LYS 40 -8.407 -5.927 12.295 342 HB3 LYS 40 3HB LYS 40 -8.059 -6.040 14.016 343 HG2 LYS 40 2HG LYS 40 -10.798 -6.269 12.741 344 HG3 LYS 40 3HG LYS 40 -9.813 -7.609 13.314 345 HD2 LYS 40 2HD LYS 40 -10.942 -5.406 15.086 346 HD3 LYS 40 3HD LYS 40 -11.698 -6.976 14.831 347 HE2 LYS 40 2HE LYS 40 -10.561 -7.127 16.913 348 HE3 LYS 40 3HE LYS 40 -9.571 -8.029 15.770 349 HZ1 LYS 40 3HZ LYS 40 -8.311 -6.568 17.290 350 HZ2 LYS 40 1HZ LYS 40 -9.040 -5.218 16.590 351 HZ3 LYS 40 2HZ LYS 40 -8.029 -6.215 15.666 352 H GLU 41 H GLU 41 -7.409 -3.769 11.446 353 HA GLU 41 HA GLU 41 -5.075 -3.028 12.957 354 HB2 GLU 41 2HB GLU 41 -5.620 -3.259 9.985 355 HB3 GLU 41 3HB GLU 41 -4.084 -2.647 10.604 356 HG2 GLU 41 2HG GLU 41 -5.281 -5.375 11.148 357 HG3 GLU 41 3HG GLU 41 -3.913 -5.027 10.091 358 H MET 42 H MET 42 -7.602 -1.260 11.287 359 HA MET 42 HA MET 42 -6.290 1.275 11.230 360 HB2 MET 42 2HB MET 42 -9.250 0.580 11.276 361 HB3 MET 42 3HB MET 42 -8.647 2.226 11.111 362 HG2 MET 42 2HG MET 42 -8.217 -0.060 9.176 363 HG3 MET 42 3HG MET 42 -9.233 1.359 8.931 364 HE1 MET 42 3HE MET 42 -6.450 4.191 8.651 365 HE2 MET 42 1HE MET 42 -7.259 3.685 10.133 366 HE3 MET 42 2HE MET 42 -8.182 3.870 8.642 367 H LYS 43 H LYS 43 -8.129 -0.435 13.722 368 HA LYS 43 HA LYS 43 -8.154 1.556 15.720 369 HB2 LYS 43 2HB LYS 43 -8.553 -1.381 15.642 370 HB3 LYS 43 3HB LYS 43 -7.797 -0.861 17.129 371 HG2 LYS 43 2HG LYS 43 -10.084 -0.946 17.617 372 HG3 LYS 43 3HG LYS 43 -9.731 0.768 17.427 373 HD2 LYS 43 2HD LYS 43 -10.927 -0.915 15.190 374 HD3 LYS 43 3HD LYS 43 -11.923 -0.120 16.403 375 HE2 LYS 43 2HE LYS 43 -10.985 2.073 15.686 376 HE3 LYS 43 3HE LYS 43 -10.070 1.241 14.427 377 HZ1 LYS 43 3HZ LYS 43 -13.024 1.310 14.675 378 HZ2 LYS 43 1HZ LYS 43 -12.168 0.481 13.479 379 HZ3 LYS 43 2HZ LYS 43 -12.102 2.164 13.554 380 H LYS 44 H LYS 44 -5.745 -0.940 14.901 381 HA LYS 44 HA LYS 44 -3.857 -0.489 16.927 382 HB2 LYS 44 2HB LYS 44 -3.293 -1.400 14.068 383 HB3 LYS 44 3HB LYS 44 -2.280 -1.709 15.476 384 HG2 LYS 44 2HG LYS 44 -5.130 -2.716 15.376 385 HG3 LYS 44 3HG LYS 44 -3.843 -3.601 14.564 386 HD2 LYS 44 2HD LYS 44 -3.819 -2.909 17.526 387 HD3 LYS 44 3HD LYS 44 -4.422 -4.434 16.867 388 HE2 LYS 44 2HE LYS 44 -1.585 -3.377 16.633 389 HE3 LYS 44 3HE LYS 44 -2.129 -4.729 17.628 390 HZ1 LYS 44 3HZ LYS 44 -1.087 -5.409 15.521 391 HZ2 LYS 44 1HZ LYS 44 -2.328 -4.654 14.659 392 HZ3 LYS 44 2HZ LYS 44 -2.673 -5.965 15.668 393 H LEU 45 H LEU 45 -4.285 1.079 13.772 394 HA LEU 45 HA LEU 45 -1.940 2.717 13.799 395 HB2 LEU 45 2HB LEU 45 -4.540 3.261 12.311 396 HB3 LEU 45 3HB LEU 45 -2.958 3.924 11.930 397 HG LEU 45 HG LEU 45 -3.845 1.039 11.581 398 HD11 LEU 45 1HD1 LEU 45 -4.786 2.549 9.923 399 HD12 LEU 45 2HD1 LEU 45 -3.615 1.458 9.191 400 HD13 LEU 45 3HD1 LEU 45 -3.173 3.138 9.509 401 HD21 LEU 45 3HD2 LEU 45 -1.475 1.087 12.221 402 HD22 LEU 45 1HD2 LEU 45 -1.136 2.225 10.914 403 HD23 LEU 45 2HD2 LEU 45 -1.681 0.586 10.546 404 H ALA 46 H ALA 46 -5.273 3.131 14.912 405 HA ALA 46 HA ALA 46 -5.109 5.922 15.541 406 HB1 ALA 46 3HB ALA 46 -7.312 5.597 16.587 407 HB2 ALA 46 1HB ALA 46 -7.124 3.842 16.460 408 HB3 ALA 46 2HB ALA 46 -7.244 4.828 15.000 409 H GLU 47 H GLU 47 -4.629 2.939 17.440 410 HA GLU 47 HA GLU 47 -4.502 4.272 19.991 411 HB2 GLU 47 2HB GLU 47 -3.388 1.487 19.405 412 HB3 GLU 47 3HB GLU 47 -3.916 2.136 20.951 413 HG2 GLU 47 2HG GLU 47 -5.611 1.205 18.635 414 HG3 GLU 47 3HG GLU 47 -5.547 0.552 20.261 415 H GLU 48 H GLU 48 -2.051 2.431 18.142 416 HA GLU 48 HA GLU 48 0.113 4.120 19.174 417 HB2 GLU 48 2HB GLU 48 0.143 1.566 17.508 418 HB3 GLU 48 3HB GLU 48 1.584 2.507 17.867 419 HG2 GLU 48 2HG GLU 48 1.520 0.665 19.391 420 HG3 GLU 48 3HG GLU 48 1.185 2.140 20.299 421 H LYS 49 H LYS 49 -0.271 6.019 18.136 422 HA LYS 49 HA LYS 49 -0.001 6.157 15.189 423 HB2 LYS 49 2HB LYS 49 -0.687 8.547 15.395 424 HB3 LYS 49 3HB LYS 49 -1.916 7.450 15.998 425 HG2 LYS 49 2HG LYS 49 0.027 8.851 17.860 426 HG3 LYS 49 3HG LYS 49 -1.474 9.617 17.331 427 HD2 LYS 49 2HD LYS 49 -2.801 7.835 18.352 428 HD3 LYS 49 3HD LYS 49 -1.343 6.924 18.747 429 HE2 LYS 49 2HE LYS 49 -0.651 8.819 20.240 430 HE3 LYS 49 3HE LYS 49 -2.224 9.565 19.939 431 HZ1 LYS 49 3HZ LYS 49 -1.860 6.844 21.075 432 HZ2 LYS 49 1HZ LYS 49 -3.304 7.702 20.945 433 HZ3 LYS 49 2HZ LYS 49 -2.106 8.235 22.006 434 H ASN 50 H ASN 50 1.939 5.906 17.715 435 HA ASN 50 HA ASN 50 4.068 7.708 17.265 436 HB2 ASN 50 2HB ASN 50 3.897 6.348 19.295 437 HB3 ASN 50 3HB ASN 50 3.976 4.861 18.362 438 HD21 ASN 50 1HD2 ASN 50 5.831 7.646 19.476 439 HD22 ASN 50 2HD2 ASN 50 7.380 6.895 19.328 440 H PHE 51 H PHE 51 6.240 7.037 16.276 441 HA PHE 51 HA PHE 51 5.847 6.566 13.539 442 HB2 PHE 51 2HB PHE 51 7.770 7.883 14.434 443 HB3 PHE 51 3HB PHE 51 8.498 6.396 15.035 444 HD1 PHE 51 HD2 PHE 51 7.487 8.205 11.940 445 HD2 PHE 51 HD1 PHE 51 9.746 4.932 13.533 446 HE1 PHE 51 HE2 PHE 51 8.499 7.817 9.733 447 HE2 PHE 51 HE1 PHE 51 10.746 4.554 11.317 448 HZ PHE 51 HZ PHE 51 10.121 5.989 9.420 449 H GLU 52 H GLU 52 5.825 4.811 12.318 450 HA GLU 52 HA GLU 52 7.126 2.327 12.945 451 HB2 GLU 52 2HB GLU 52 4.983 2.222 14.310 452 HB3 GLU 52 3HB GLU 52 4.075 2.340 12.810 453 HG2 GLU 52 2HG GLU 52 4.217 0.024 13.671 454 HG3 GLU 52 3HG GLU 52 4.929 0.196 12.064 455 H LYS 53 H LYS 53 6.978 0.821 11.137 456 HA LYS 53 HA LYS 53 5.965 1.945 8.591 457 HB2 LYS 53 2HB LYS 53 8.582 0.430 9.052 458 HB3 LYS 53 3HB LYS 53 7.924 0.822 7.463 459 HG2 LYS 53 2HG LYS 53 8.097 3.240 7.993 460 HG3 LYS 53 3HG LYS 53 8.783 2.846 9.570 461 HD2 LYS 53 2HD LYS 53 10.043 2.130 6.888 462 HD3 LYS 53 3HD LYS 53 10.497 3.517 7.881 463 HE2 LYS 53 2HE LYS 53 11.207 1.988 9.692 464 HE3 LYS 53 3HE LYS 53 10.749 0.598 8.700 465 HZ1 LYS 53 3HZ LYS 53 13.107 0.978 8.540 466 HZ2 LYS 53 1HZ LYS 53 12.869 2.589 8.077 467 HZ3 LYS 53 2HZ LYS 53 12.398 1.335 7.047 468 H ILE 54 H ILE 54 4.380 0.701 7.857 469 HA ILE 54 HA ILE 54 4.264 -2.193 8.495 470 HB ILE 54 HB ILE 54 1.968 -0.163 8.639 471 HG12 ILE 54 2HG1 ILE 54 3.258 -1.889 10.802 472 HG13 ILE 54 3HG1 ILE 54 3.409 -0.144 10.644 473 HG21 ILE 54 1HG2 ILE 54 0.480 -2.027 9.250 474 HG22 ILE 54 2HG2 ILE 54 1.799 -3.174 9.013 475 HG23 ILE 54 3HG2 ILE 54 1.158 -2.274 7.638 476 HD11 ILE 54 3HD1 ILE 54 1.890 -0.699 12.418 477 HD12 ILE 54 1HD1 ILE 54 0.897 -1.670 11.331 478 HD13 ILE 54 2HD1 ILE 54 1.000 0.079 11.110 479 H LEU 55 H LEU 55 4.152 -3.384 6.663 480 HA LEU 55 HA LEU 55 3.184 -2.310 4.123 481 HB2 LEU 55 2HB LEU 55 5.136 -3.941 4.290 482 HB3 LEU 55 3HB LEU 55 4.001 -5.167 4.828 483 HG LEU 55 HG LEU 55 2.752 -4.747 2.568 484 HD11 LEU 55 1HD1 LEU 55 3.824 -2.659 1.955 485 HD12 LEU 55 2HD1 LEU 55 4.122 -3.888 0.729 486 HD13 LEU 55 3HD1 LEU 55 5.399 -3.458 1.869 487 HD21 LEU 55 3HD2 LEU 55 5.491 -6.044 2.479 488 HD22 LEU 55 1HD2 LEU 55 4.170 -6.314 1.338 489 HD23 LEU 55 2HD2 LEU 55 3.998 -6.809 3.020 490 H ILE 56 H ILE 56 1.072 -2.555 3.466 491 HA ILE 56 HA ILE 56 -0.650 -4.578 4.802 492 HB ILE 56 HB ILE 56 -1.525 -2.015 3.394 493 HG12 ILE 56 2HG1 ILE 56 -0.463 -1.580 5.643 494 HG13 ILE 56 3HG1 ILE 56 -2.156 -1.108 5.573 495 HG21 ILE 56 1HG2 ILE 56 -3.807 -2.558 4.225 496 HG22 ILE 56 2HG2 ILE 56 -3.203 -4.093 4.848 497 HG23 ILE 56 3HG2 ILE 56 -3.195 -3.784 3.112 498 HD11 ILE 56 3HD1 ILE 56 -2.769 -3.138 6.797 499 HD12 ILE 56 1HD1 ILE 56 -1.608 -2.149 7.681 500 HD13 ILE 56 2HD1 ILE 56 -1.067 -3.609 6.857 501 H LYS 57 H LYS 57 -1.044 -6.265 3.521 502 HA LYS 57 HA LYS 57 -1.048 -6.094 0.588 503 HB2 LYS 57 2HB LYS 57 0.205 -7.960 1.524 504 HB3 LYS 57 3HB LYS 57 -1.123 -8.392 2.596 505 HG2 LYS 57 2HG LYS 57 -2.474 -8.931 0.481 506 HG3 LYS 57 3HG LYS 57 -0.953 -8.785 -0.409 507 HD2 LYS 57 2HD LYS 57 0.025 -10.610 0.883 508 HD3 LYS 57 3HD LYS 57 -1.390 -10.668 1.936 509 HE2 LYS 57 2HE LYS 57 -1.297 -11.415 -1.005 510 HE3 LYS 57 3HE LYS 57 -1.482 -12.516 0.358 511 HZ1 LYS 57 3HZ LYS 57 -3.590 -12.116 -0.674 512 HZ2 LYS 57 1HZ LYS 57 -3.424 -10.442 -0.492 513 HZ3 LYS 57 2HZ LYS 57 -3.591 -11.429 0.868 514 H SER 58 H SER 58 -2.943 -6.296 -0.583 515 HA SER 58 HA SER 58 -5.391 -7.316 0.651 516 HB2 SER 58 2HB SER 58 -5.251 -4.549 -0.623 517 HB3 SER 58 3HB SER 58 -6.746 -5.374 -0.167 518 HG SER 58 HG SER 58 -5.929 -5.388 1.993 519 H ASN 59 H ASN 59 -6.768 -8.265 -0.754 520 HA ASN 59 HA ASN 59 -6.081 -8.401 -3.627 521 HB2 ASN 59 2HB ASN 59 -7.475 -10.444 -3.666 522 HB3 ASN 59 3HB ASN 59 -6.229 -10.569 -2.432 523 HD21 ASN 59 1HD2 ASN 59 -8.674 -12.080 -2.589 524 HD22 ASN 59 2HD2 ASN 59 -9.554 -11.755 -1.137 525 H ASP 60 H ASP 60 -8.005 -6.622 -1.624 526 HA ASP 60 HA ASP 60 -10.216 -6.296 -3.582 527 HB2 ASP 60 2HB ASP 60 -10.958 -7.275 -1.413 528 HB3 ASP 60 3HB ASP 60 -10.266 -5.908 -0.555 529 H LYS 61 H LYS 61 -10.705 -4.226 -4.218 530 HA LYS 61 HA LYS 61 -8.623 -2.239 -3.920 531 HB2 LYS 61 2HB LYS 61 -9.768 -1.046 -5.698 532 HB3 LYS 61 3HB LYS 61 -9.717 -2.755 -6.102 533 HG2 LYS 61 2HG LYS 61 -12.098 -2.951 -5.282 534 HG3 LYS 61 3HG LYS 61 -12.118 -1.202 -5.081 535 HD2 LYS 61 2HD LYS 61 -13.157 -1.541 -7.161 536 HD3 LYS 61 3HD LYS 61 -11.512 -1.081 -7.597 537 HE2 LYS 61 2HE LYS 61 -12.588 -3.928 -7.515 538 HE3 LYS 61 3HE LYS 61 -12.392 -2.958 -8.971 539 HZ1 LYS 61 3HZ LYS 61 -10.237 -3.983 -7.205 540 HZ2 LYS 61 1HZ LYS 61 -9.977 -2.892 -8.469 541 HZ3 LYS 61 2HZ LYS 61 -10.566 -4.438 -8.799 542 H GLN 62 H GLN 62 -11.893 -2.655 -2.661 543 HA GLN 62 HA GLN 62 -12.467 0.112 -2.195 544 HB2 GLN 62 2HB GLN 62 -13.888 -2.464 -1.891 545 HB3 GLN 62 3HB GLN 62 -14.267 -1.362 -0.580 546 HG2 GLN 62 2HG GLN 62 -14.510 -0.581 -3.495 547 HG3 GLN 62 3HG GLN 62 -15.825 -1.320 -2.586 548 HE21 GLN 62 1HE2 GLN 62 -15.291 0.079 -0.091 549 HE22 GLN 62 2HE2 GLN 62 -15.763 1.723 -0.338 550 H LEU 63 H LEU 63 -11.183 -2.526 -0.242 551 HA LEU 63 HA LEU 63 -11.240 -1.525 2.341 552 HB2 LEU 63 2HB LEU 63 -9.040 -3.096 0.950 553 HB3 LEU 63 3HB LEU 63 -9.097 -2.845 2.690 554 HG LEU 63 HG LEU 63 -11.257 -4.303 1.120 555 HD11 LEU 63 1HD1 LEU 63 -9.202 -5.553 0.944 556 HD12 LEU 63 2HD1 LEU 63 -10.289 -6.369 2.064 557 HD13 LEU 63 3HD1 LEU 63 -8.927 -5.433 2.681 558 HD21 LEU 63 3HD2 LEU 63 -10.757 -4.114 4.113 559 HD22 LEU 63 1HD2 LEU 63 -12.000 -5.096 3.328 560 HD23 LEU 63 2HD2 LEU 63 -12.072 -3.339 3.223 561 H LEU 64 H LEU 64 -9.025 -0.764 -0.278 562 HA LEU 64 HA LEU 64 -7.088 0.692 1.232 563 HB2 LEU 64 2HB LEU 64 -7.637 0.464 -1.748 564 HB3 LEU 64 3HB LEU 64 -6.355 1.480 -1.111 565 HG LEU 64 HG LEU 64 -5.195 -0.478 -0.175 566 HD11 LEU 64 1HD1 LEU 64 -7.432 -2.147 -1.338 567 HD12 LEU 64 2HD1 LEU 64 -7.069 -1.919 0.375 568 HD13 LEU 64 3HD1 LEU 64 -5.926 -2.770 -0.658 569 HD21 LEU 64 3HD2 LEU 64 -5.943 -0.896 -3.073 570 HD22 LEU 64 1HD2 LEU 64 -4.524 -1.559 -2.250 571 HD23 LEU 64 2HD2 LEU 64 -4.687 0.185 -2.462 572 H LYS 65 H LYS 65 -9.915 1.606 -0.753 573 HA LYS 65 HA LYS 65 -9.591 4.410 -0.710 574 HB2 LYS 65 2HB LYS 65 -12.167 2.774 -0.809 575 HB3 LYS 65 3HB LYS 65 -12.036 4.489 -1.199 576 HG2 LYS 65 2HG LYS 65 -10.638 3.993 -3.127 577 HG3 LYS 65 3HG LYS 65 -10.604 2.279 -2.698 578 HD2 LYS 65 2HD LYS 65 -12.201 2.742 -4.541 579 HD3 LYS 65 3HD LYS 65 -13.006 2.078 -3.118 580 HE2 LYS 65 2HE LYS 65 -13.778 4.334 -2.493 581 HE3 LYS 65 3HE LYS 65 -12.939 5.021 -3.887 582 HZ1 LYS 65 3HZ LYS 65 -14.377 3.784 -5.347 583 HZ2 LYS 65 1HZ LYS 65 -15.314 4.699 -4.282 584 HZ3 LYS 65 2HZ LYS 65 -15.146 3.031 -4.042 585 H GLU 66 H GLU 66 -11.609 2.259 1.265 586 HA GLU 66 HA GLU 66 -12.681 4.049 3.097 587 HB2 GLU 66 2HB GLU 66 -11.974 1.102 3.487 588 HB3 GLU 66 3HB GLU 66 -13.076 2.015 4.518 589 HG2 GLU 66 2HG GLU 66 -14.662 2.263 2.710 590 HG3 GLU 66 3HG GLU 66 -13.519 1.593 1.552 591 H MET 67 H MET 67 -9.678 2.190 3.230 592 HA MET 67 HA MET 67 -8.813 2.749 5.839 593 HB2 MET 67 2HB MET 67 -7.882 0.995 4.255 594 HB3 MET 67 3HB MET 67 -7.055 2.279 3.388 595 HG2 MET 67 2HG MET 67 -5.870 2.817 5.577 596 HG3 MET 67 3HG MET 67 -6.552 1.317 6.206 597 HE1 MET 67 3HE MET 67 -6.098 -1.109 4.855 598 HE2 MET 67 1HE MET 67 -4.917 -1.232 3.554 599 HE3 MET 67 2HE MET 67 -6.425 -0.354 3.293 600 H LEU 68 H LEU 68 -7.986 4.320 2.740 601 HA LEU 68 HA LEU 68 -6.213 6.269 3.829 602 HB2 LEU 68 2HB LEU 68 -7.591 6.021 1.130 603 HB3 LEU 68 3HB LEU 68 -6.401 7.266 1.488 604 HG LEU 68 HG LEU 68 -5.831 4.276 1.625 605 HD11 LEU 68 1HD1 LEU 68 -4.557 4.571 -0.456 606 HD12 LEU 68 2HD1 LEU 68 -5.127 6.241 -0.572 607 HD13 LEU 68 3HD1 LEU 68 -6.275 4.902 -0.678 608 HD21 LEU 68 3HD2 LEU 68 -3.950 6.651 1.772 609 HD22 LEU 68 1HD2 LEU 68 -3.479 4.949 1.759 610 HD23 LEU 68 2HD2 LEU 68 -4.405 5.592 3.112 611 H GLU 69 H GLU 69 -9.655 6.234 3.247 612 HA GLU 69 HA GLU 69 -10.118 9.049 3.550 613 HB2 GLU 69 2HB GLU 69 -11.969 6.632 3.749 614 HB3 GLU 69 3HB GLU 69 -12.535 8.296 3.883 615 HG2 GLU 69 2HG GLU 69 -11.779 8.785 1.605 616 HG3 GLU 69 3HG GLU 69 -11.088 7.170 1.461 617 H LEU 70 H LEU 70 -9.861 6.304 5.747 618 HA LEU 70 HA LEU 70 -10.595 7.817 8.128 619 HB2 LEU 70 2HB LEU 70 -9.367 5.048 7.823 620 HB3 LEU 70 3HB LEU 70 -9.969 5.725 9.331 621 HG LEU 70 HG LEU 70 -11.702 5.159 6.891 622 HD11 LEU 70 1HD1 LEU 70 -12.572 3.226 8.119 623 HD12 LEU 70 2HD1 LEU 70 -11.413 3.515 9.421 624 HD13 LEU 70 3HD1 LEU 70 -10.843 3.070 7.810 625 HD21 LEU 70 3HD2 LEU 70 -12.485 5.959 9.715 626 HD22 LEU 70 1HD2 LEU 70 -13.604 5.495 8.429 627 HD23 LEU 70 2HD2 LEU 70 -12.627 6.950 8.261 628 H ILE 71 H ILE 71 -7.678 6.935 6.395 629 HA ILE 71 HA ILE 71 -5.762 7.740 8.385 630 HB ILE 71 HB ILE 71 -5.517 7.176 5.394 631 HG12 ILE 71 2HG1 ILE 71 -4.503 5.645 7.837 632 HG13 ILE 71 3HG1 ILE 71 -5.904 5.211 6.868 633 HG21 ILE 71 1HG2 ILE 71 -3.811 8.868 5.924 634 HG22 ILE 71 2HG2 ILE 71 -3.062 7.307 5.597 635 HG23 ILE 71 3HG2 ILE 71 -3.222 7.875 7.260 636 HD11 ILE 71 3HD1 ILE 71 -3.024 5.182 5.980 637 HD12 ILE 71 1HD1 ILE 71 -4.408 4.848 4.934 638 HD13 ILE 71 2HD1 ILE 71 -4.062 3.795 6.304 639 H SER 72 H SER 72 -7.654 9.373 5.939 640 HA SER 72 HA SER 72 -6.376 11.843 5.754 641 HB2 SER 72 2HB SER 72 -8.308 11.249 4.363 642 HB3 SER 72 3HB SER 72 -9.356 11.221 5.780 643 HG SER 72 HG SER 72 -9.161 13.422 5.970 644 H LYS 73 H LYS 73 -8.335 10.504 8.364 645 HA LYS 73 HA LYS 73 -8.515 12.882 9.958 646 HB2 LYS 73 2HB LYS 73 -8.854 9.933 10.657 647 HB3 LYS 73 3HB LYS 73 -9.165 11.239 11.794 648 HG2 LYS 73 2HG LYS 73 -10.637 10.773 9.179 649 HG3 LYS 73 3HG LYS 73 -11.243 10.389 10.793 650 HD2 LYS 73 2HD LYS 73 -10.591 13.185 9.760 651 HD3 LYS 73 3HD LYS 73 -12.207 12.499 9.933 652 HE2 LYS 73 2HE LYS 73 -11.923 12.369 12.373 653 HE3 LYS 73 3HE LYS 73 -10.270 12.972 12.230 654 HZ1 LYS 73 3HZ LYS 73 -12.707 14.477 11.444 655 HZ2 LYS 73 1HZ LYS 73 -11.120 15.050 11.380 656 HZ3 LYS 73 2HZ LYS 73 -11.836 14.712 12.871 657 H LEU 74 H LEU 74 -6.163 10.286 9.640 658 HA LEU 74 HA LEU 74 -4.807 10.845 12.146 659 HB2 LEU 74 2HB LEU 74 -4.061 8.979 9.854 660 HB3 LEU 74 3HB LEU 74 -3.295 9.008 11.437 661 HG LEU 74 HG LEU 74 -6.218 8.286 10.938 662 HD11 LEU 74 1HD1 LEU 74 -3.887 6.447 11.558 663 HD12 LEU 74 2HD1 LEU 74 -4.744 6.573 10.020 664 HD13 LEU 74 3HD1 LEU 74 -5.585 5.971 11.445 665 HD21 LEU 74 3HD2 LEU 74 -5.907 9.267 13.154 666 HD22 LEU 74 1HD2 LEU 74 -4.589 8.144 13.502 667 HD23 LEU 74 2HD2 LEU 74 -6.236 7.544 13.291 668 H GLY 75 H GLY 75 -3.918 11.101 8.691 669 HA2 GLY 75 2HA GLY 75 -2.892 12.816 7.568 670 HA3 GLY 75 3HA GLY 75 -2.643 13.648 9.093 671 H TYR 76 H TYR 76 -1.460 10.852 7.191 672 HA TYR 76 HA TYR 76 1.276 11.754 7.573 673 HB2 TYR 76 2HB TYR 76 2.083 9.418 8.215 674 HB3 TYR 76 3HB TYR 76 1.249 10.305 9.470 675 HD1 TYR 76 HD2 TYR 76 0.470 7.750 6.800 676 HD2 TYR 76 HD1 TYR 76 -0.317 9.133 10.762 677 HE1 TYR 76 HE2 TYR 76 -0.959 5.796 7.206 678 HE2 TYR 76 HE1 TYR 76 -1.734 7.167 11.163 679 HH TYR 76 HH TYR 76 -1.834 4.489 9.019 680 H LYS 77 H LYS 77 2.811 10.194 6.353 681 HA LYS 77 HA LYS 77 2.015 10.132 3.604 682 HB2 LYS 77 2HB LYS 77 4.525 9.308 5.084 683 HB3 LYS 77 3HB LYS 77 4.355 9.011 3.360 684 HG2 LYS 77 2HG LYS 77 4.090 11.775 4.571 685 HG3 LYS 77 3HG LYS 77 5.630 11.099 4.038 686 HD2 LYS 77 2HD LYS 77 4.627 10.773 1.751 687 HD3 LYS 77 3HD LYS 77 3.180 11.624 2.313 688 HE2 LYS 77 2HE LYS 77 5.992 12.767 2.119 689 HE3 LYS 77 3HE LYS 77 4.623 13.156 1.077 690 HZ1 LYS 77 3HZ LYS 77 4.998 14.855 2.755 691 HZ2 LYS 77 1HZ LYS 77 4.773 13.725 3.994 692 HZ3 LYS 77 2HZ LYS 77 3.491 14.125 2.970 693 H VAL 78 H VAL 78 0.856 8.549 2.716 694 HA VAL 78 HA VAL 78 1.580 5.737 3.289 695 HB VAL 78 HB VAL 78 -1.178 6.667 2.356 696 HG11 VAL 78 1HG1 VAL 78 -0.212 3.906 3.205 697 HG12 VAL 78 2HG1 VAL 78 -0.593 4.404 1.557 698 HG13 VAL 78 3HG1 VAL 78 -1.873 4.324 2.768 699 HG21 VAL 78 3HG2 VAL 78 -0.794 7.346 4.688 700 HG22 VAL 78 1HG2 VAL 78 -0.350 5.689 5.108 701 HG23 VAL 78 2HG2 VAL 78 -1.999 6.061 4.593 702 H PHE 79 H PHE 79 2.016 4.517 1.572 703 HA PHE 79 HA PHE 79 2.117 5.704 -1.122 704 HB2 PHE 79 2HB PHE 79 3.693 3.357 0.044 705 HB3 PHE 79 3HB PHE 79 3.953 4.111 -1.529 706 HD1 PHE 79 HD1 PHE 79 4.767 6.528 -1.604 707 HD2 PHE 79 HD2 PHE 79 4.788 4.239 2.009 708 HE1 PHE 79 HE1 PHE 79 6.356 8.107 -0.603 709 HE2 PHE 79 HE2 PHE 79 6.385 5.831 2.994 710 HZ PHE 79 HZ PHE 79 7.165 7.763 1.696 711 H LEU 80 H LEU 80 1.524 4.239 -2.897 712 HA LEU 80 HA LEU 80 0.197 1.718 -2.215 713 HB2 LEU 80 2HB LEU 80 -1.664 3.222 -2.018 714 HB3 LEU 80 3HB LEU 80 -1.239 4.074 -3.489 715 HG LEU 80 HG LEU 80 -1.982 2.187 -4.873 716 HD11 LEU 80 1HD1 LEU 80 -1.309 0.320 -3.441 717 HD12 LEU 80 2HD1 LEU 80 -2.979 0.163 -3.973 718 HD13 LEU 80 3HD1 LEU 80 -2.626 0.690 -2.327 719 HD21 LEU 80 3HD2 LEU 80 -3.683 3.811 -4.187 720 HD22 LEU 80 1HD2 LEU 80 -4.062 2.836 -2.764 721 HD23 LEU 80 2HD2 LEU 80 -4.380 2.204 -4.384 722 H LEU 81 H LEU 81 0.454 0.222 -3.700 723 HA LEU 81 HA LEU 81 1.313 0.900 -6.443 724 HB2 LEU 81 2HB LEU 81 3.152 -0.060 -5.025 725 HB3 LEU 81 3HB LEU 81 2.175 -1.496 -4.779 726 HG LEU 81 HG LEU 81 2.255 -1.948 -7.245 727 HD11 LEU 81 1HD1 LEU 81 2.538 0.288 -8.098 728 HD12 LEU 81 2HD1 LEU 81 3.890 -0.707 -8.632 729 HD13 LEU 81 3HD1 LEU 81 4.111 0.441 -7.312 730 HD21 LEU 81 3HD2 LEU 81 4.592 -2.695 -7.317 731 HD22 LEU 81 1HD2 LEU 81 3.844 -3.057 -5.763 732 HD23 LEU 81 2HD2 LEU 81 4.966 -1.700 -5.909 733 H LEU 82 H LEU 82 0.156 -0.038 -8.008 734 HA LEU 82 HA LEU 82 -1.903 -2.081 -7.369 735 HB2 LEU 82 2HB LEU 82 -2.003 0.234 -9.357 736 HB3 LEU 82 3HB LEU 82 -3.263 -0.972 -9.166 737 HG LEU 82 HG LEU 82 -2.442 0.990 -6.980 738 HD11 LEU 82 1HD1 LEU 82 -4.450 2.251 -7.498 739 HD12 LEU 82 2HD1 LEU 82 -4.829 1.164 -8.838 740 HD13 LEU 82 3HD1 LEU 82 -3.390 2.185 -8.903 741 HD21 LEU 82 3HD2 LEU 82 -4.839 -0.870 -7.167 742 HD22 LEU 82 1HD2 LEU 82 -4.551 0.321 -5.893 743 HD23 LEU 82 2HD2 LEU 82 -3.456 -1.046 -6.082 744 H ALA 83 H ALA 83 -1.564 -3.981 -8.515 745 HA ALA 83 HA ALA 83 -0.423 -3.864 -11.235 746 HB1 ALA 83 3HB ALA 83 0.726 -5.695 -9.093 747 HB2 ALA 83 1HB ALA 83 1.506 -4.255 -9.737 748 HB3 ALA 83 2HB ALA 83 1.209 -5.637 -10.788 749 H ASP 84 H ASP 84 -1.946 -4.790 -12.446 750 HA ASP 84 HA ASP 84 -2.916 -7.468 -11.966 751 HB2 ASP 84 2HB ASP 84 -4.466 -6.223 -10.482 752 HB3 ASP 84 3HB ASP 84 -4.888 -5.136 -11.799 753 H GLN 85 H GLN 85 -4.303 -8.227 -13.712 754 HA GLN 85 HA GLN 85 -3.422 -7.706 -16.311 755 HB2 GLN 85 2HB GLN 85 -6.112 -8.920 -15.533 756 HB3 GLN 85 3HB GLN 85 -5.226 -9.188 -17.036 757 HG2 GLN 85 2HG GLN 85 -3.458 -10.367 -15.793 758 HG3 GLN 85 3HG GLN 85 -4.306 -10.062 -14.279 759 HE21 GLN 85 1HE2 GLN 85 -6.965 -10.607 -15.439 760 HE22 GLN 85 2HE2 GLN 85 -7.045 -12.319 -15.649 761 H ASP 86 H ASP 86 -6.474 -6.700 -14.681 762 HA ASP 86 HA ASP 86 -7.215 -4.879 -16.816 763 HB2 ASP 86 2HB ASP 86 -8.911 -6.046 -15.296 764 HB3 ASP 86 3HB ASP 86 -8.394 -4.975 -14.004 765 H GLU 87 H GLU 87 -5.301 -3.726 -16.945 766 HA GLU 87 HA GLU 87 -4.134 -2.209 -14.820 767 HB2 GLU 87 2HB GLU 87 -2.653 -1.357 -16.588 768 HB3 GLU 87 3HB GLU 87 -2.841 -3.092 -16.732 769 HG2 GLU 87 2HG GLU 87 -3.120 -2.641 -18.952 770 HG3 GLU 87 3HG GLU 87 -4.777 -2.281 -18.485 771 H ASN 88 H ASN 88 -6.769 -1.740 -16.912 772 HA ASN 88 HA ASN 88 -6.701 1.093 -17.287 773 HB2 ASN 88 2HB ASN 88 -7.777 -0.397 -18.910 774 HB3 ASN 88 3HB ASN 88 -8.905 -0.969 -17.690 775 HD21 ASN 88 1HD2 ASN 88 -8.006 1.776 -19.693 776 HD22 ASN 88 2HD2 ASN 88 -9.540 2.572 -19.611 777 H GLU 89 H GLU 89 -8.508 -1.092 -15.112 778 HA GLU 89 HA GLU 89 -9.999 0.940 -13.795 779 HB2 GLU 89 2HB GLU 89 -10.625 -0.729 -12.185 780 HB3 GLU 89 3HB GLU 89 -10.625 -1.485 -13.768 781 HG2 GLU 89 2HG GLU 89 -9.077 -3.036 -13.157 782 HG3 GLU 89 3HG GLU 89 -8.033 -1.831 -12.414 783 H LEU 90 H LEU 90 -6.803 -0.446 -13.307 784 HA LEU 90 HA LEU 90 -6.290 0.559 -10.696 785 HB2 LEU 90 2HB LEU 90 -4.281 -0.113 -12.889 786 HB3 LEU 90 3HB LEU 90 -3.918 0.070 -11.176 787 HG LEU 90 HG LEU 90 -5.588 -2.141 -12.429 788 HD11 LEU 90 1HD1 LEU 90 -2.828 -2.199 -11.185 789 HD12 LEU 90 2HD1 LEU 90 -3.219 -2.373 -12.899 790 HD13 LEU 90 3HD1 LEU 90 -3.737 -3.604 -11.754 791 HD21 LEU 90 3HD2 LEU 90 -5.639 -3.171 -10.186 792 HD22 LEU 90 1HD2 LEU 90 -6.476 -1.620 -10.208 793 HD23 LEU 90 2HD2 LEU 90 -4.862 -1.741 -9.502 794 H GLU 91 H GLU 91 -5.703 1.810 -13.969 795 HA GLU 91 HA GLU 91 -4.186 4.099 -13.179 796 HB2 GLU 91 2HB GLU 91 -4.208 3.041 -15.489 797 HB3 GLU 91 3HB GLU 91 -5.792 3.764 -15.742 798 HG2 GLU 91 2HG GLU 91 -4.817 6.013 -15.483 799 HG3 GLU 91 3HG GLU 91 -3.229 5.298 -15.197 800 H GLU 92 H GLU 92 -7.601 3.471 -13.695 801 HA GLU 92 HA GLU 92 -8.594 6.128 -13.420 802 HB2 GLU 92 2HB GLU 92 -9.696 4.037 -14.472 803 HB3 GLU 92 3HB GLU 92 -10.075 3.522 -12.839 804 HG2 GLU 92 2HG GLU 92 -11.017 6.140 -14.042 805 HG3 GLU 92 3HG GLU 92 -11.943 4.648 -14.137 806 H PHE 93 H PHE 93 -8.206 3.393 -11.234 807 HA PHE 93 HA PHE 93 -9.294 4.425 -8.851 808 HB2 PHE 93 2HB PHE 93 -8.798 1.998 -9.364 809 HB3 PHE 93 3HB PHE 93 -7.090 2.333 -9.164 810 HD1 PHE 93 HD1 PHE 93 -10.321 1.961 -7.405 811 HD2 PHE 93 HD2 PHE 93 -6.115 2.550 -6.926 812 HE1 PHE 93 HE1 PHE 93 -10.494 1.376 -5.024 813 HE2 PHE 93 HE2 PHE 93 -6.299 1.969 -4.548 814 HZ PHE 93 HZ PHE 93 -8.487 1.379 -3.595 815 H LYS 94 H LYS 94 -5.957 4.385 -10.086 816 HA LYS 94 HA LYS 94 -4.720 5.322 -7.724 817 HB2 LYS 94 2HB LYS 94 -2.676 5.368 -8.932 818 HB3 LYS 94 3HB LYS 94 -3.585 4.036 -9.604 819 HG2 LYS 94 2HG LYS 94 -2.849 4.899 -11.583 820 HG3 LYS 94 3HG LYS 94 -4.255 5.947 -11.406 821 HD2 LYS 94 2HD LYS 94 -2.308 7.287 -12.032 822 HD3 LYS 94 3HD LYS 94 -2.793 7.702 -10.385 823 HE2 LYS 94 2HE LYS 94 -0.977 6.278 -9.496 824 HE3 LYS 94 3HE LYS 94 -0.515 5.837 -11.139 825 HZ1 LYS 94 3HZ LYS 94 -0.424 8.577 -9.994 826 HZ2 LYS 94 1HZ LYS 94 0.006 8.159 -11.572 827 HZ3 LYS 94 2HZ LYS 94 0.906 7.574 -10.270 828 H ARG 95 H ARG 95 -6.064 6.934 -10.548 829 HA ARG 95 HA ARG 95 -5.007 9.513 -10.164 830 HB2 ARG 95 2HB ARG 95 -7.441 8.419 -11.589 831 HB3 ARG 95 3HB ARG 95 -7.210 10.162 -11.482 832 HG2 ARG 95 2HG ARG 95 -5.150 8.263 -12.652 833 HG3 ARG 95 3HG ARG 95 -6.371 9.109 -13.608 834 HD2 ARG 95 2HD ARG 95 -4.164 10.393 -11.947 835 HD3 ARG 95 3HD ARG 95 -4.265 10.330 -13.712 836 HE ARG 95 HE ARG 95 -6.370 11.674 -13.471 837 HH11 ARG 95 1HH1 ARG 95 -3.854 11.927 -11.018 838 HH12 ARG 95 2HH1 ARG 95 -4.324 13.523 -10.529 839 HH21 ARG 95 1HH2 ARG 95 -7.001 13.768 -12.792 840 HH22 ARG 95 2HH2 ARG 95 -6.106 14.562 -11.534 841 H LYS 96 H LYS 96 -7.788 7.920 -8.729 842 HA LYS 96 HA LYS 96 -8.895 10.214 -7.417 843 HB2 LYS 96 2HB LYS 96 -9.421 7.247 -7.379 844 HB3 LYS 96 3HB LYS 96 -9.965 8.161 -5.979 845 HG2 LYS 96 2HG LYS 96 -11.752 7.873 -7.667 846 HG3 LYS 96 3HG LYS 96 -11.371 9.570 -7.353 847 HD2 LYS 96 2HD LYS 96 -9.917 9.516 -9.453 848 HD3 LYS 96 3HD LYS 96 -10.583 7.913 -9.780 849 HE2 LYS 96 2HE LYS 96 -12.230 10.458 -9.511 850 HE3 LYS 96 3HE LYS 96 -11.733 9.733 -11.040 851 HZ1 LYS 96 3HZ LYS 96 -12.991 7.756 -10.468 852 HZ2 LYS 96 1HZ LYS 96 -13.985 9.124 -10.468 853 HZ3 LYS 96 2HZ LYS 96 -13.473 8.449 -9.006 854 H ILE 97 H ILE 97 -6.763 7.554 -6.400 855 HA ILE 97 HA ILE 97 -6.468 8.293 -3.663 856 HB ILE 97 HB ILE 97 -4.578 6.679 -5.442 857 HG12 ILE 97 2HG1 ILE 97 -6.790 5.655 -5.514 858 HG13 ILE 97 3HG1 ILE 97 -5.742 4.645 -4.534 859 HG21 ILE 97 1HG2 ILE 97 -3.779 5.608 -3.356 860 HG22 ILE 97 2HG2 ILE 97 -4.770 6.725 -2.413 861 HG23 ILE 97 3HG2 ILE 97 -3.439 7.340 -3.395 862 HD11 ILE 97 3HD1 ILE 97 -6.816 5.573 -2.502 863 HD12 ILE 97 1HD1 ILE 97 -7.947 4.756 -3.579 864 HD13 ILE 97 2HD1 ILE 97 -7.892 6.517 -3.534 865 H GLU 98 H GLU 98 -4.844 9.158 -6.597 866 HA GLU 98 HA GLU 98 -2.551 10.528 -5.576 867 HB2 GLU 98 2HB GLU 98 -2.742 9.435 -7.816 868 HB3 GLU 98 3HB GLU 98 -3.918 10.644 -8.302 869 HG2 GLU 98 2HG GLU 98 -2.239 12.369 -8.292 870 HG3 GLU 98 3HG GLU 98 -1.063 11.287 -7.536 871 H SER 99 H SER 99 -5.790 11.409 -6.608 872 HA SER 99 HA SER 99 -5.539 14.243 -6.334 873 HB2 SER 99 2HB SER 99 -7.265 13.163 -7.777 874 HB3 SER 99 3HB SER 99 -8.053 12.515 -6.337 875 HG SER 99 HG SER 99 -8.988 14.373 -6.072 876 H GLN 100 H GLN 100 -6.404 11.575 -4.143 877 HA GLN 100 HA GLN 100 -7.302 13.125 -1.928 878 HB2 GLN 100 2HB GLN 100 -5.983 10.377 -1.980 879 HB3 GLN 100 3HB GLN 100 -6.708 11.090 -0.545 880 HG2 GLN 100 2HG GLN 100 -8.920 11.016 -1.598 881 HG3 GLN 100 3HG GLN 100 -8.213 10.378 -3.084 882 HE21 GLN 100 1HE2 GLN 100 -10.240 9.160 -1.346 883 HE22 GLN 100 2HE2 GLN 100 -9.599 7.636 -0.850 884 H GLY 101 H GLY 101 -4.154 12.600 -3.258 885 HA2 GLY 101 2HA GLY 101 -2.291 13.967 -2.748 886 HA3 GLY 101 3HA GLY 101 -2.918 14.223 -1.124 887 H TYR 102 H TYR 102 -2.801 11.024 -2.537 888 HA TYR 102 HA TYR 102 -0.566 10.263 -0.747 889 HB2 TYR 102 2HB TYR 102 -2.825 8.580 -1.920 890 HB3 TYR 102 3HB TYR 102 -1.473 7.909 -1.013 891 HD1 TYR 102 HD2 TYR 102 -1.150 8.711 1.435 892 HD2 TYR 102 HD1 TYR 102 -4.758 9.362 -0.764 893 HE1 TYR 102 HE2 TYR 102 -2.363 9.087 3.535 894 HE2 TYR 102 HE1 TYR 102 -5.971 9.743 1.342 895 HH TYR 102 HH TYR 102 -4.342 10.102 4.375 896 H GLU 103 H GLU 103 1.170 9.155 -1.558 897 HA GLU 103 HA GLU 103 1.820 9.338 -4.339 898 HB2 GLU 103 2HB GLU 103 3.548 9.534 -2.584 899 HB3 GLU 103 3HB GLU 103 3.214 7.897 -2.040 900 HG2 GLU 103 2HG GLU 103 5.223 7.778 -3.307 901 HG3 GLU 103 3HG GLU 103 3.966 7.083 -4.326 902 H VAL 104 H VAL 104 1.017 7.960 -5.806 903 HA VAL 104 HA VAL 104 0.638 5.107 -5.176 904 HB VAL 104 HB VAL 104 -1.543 6.070 -4.736 905 HG11 VAL 104 1HG1 VAL 104 -2.832 7.337 -6.398 906 HG12 VAL 104 2HG1 VAL 104 -1.456 7.308 -7.504 907 HG13 VAL 104 3HG1 VAL 104 -1.337 8.174 -5.967 908 HG21 VAL 104 3HG2 VAL 104 -2.954 4.811 -6.304 909 HG22 VAL 104 1HG2 VAL 104 -1.522 3.876 -5.873 910 HG23 VAL 104 2HG2 VAL 104 -1.610 4.679 -7.441 911 H ARG 105 H ARG 105 0.877 3.754 -6.927 912 HA ARG 105 HA ARG 105 1.584 4.925 -9.546 913 HB2 ARG 105 2HB ARG 105 3.220 2.800 -8.086 914 HB3 ARG 105 3HB ARG 105 3.556 3.442 -9.691 915 HG2 ARG 105 2HG ARG 105 3.640 5.057 -7.116 916 HG3 ARG 105 3HG ARG 105 5.044 4.367 -7.925 917 HD2 ARG 105 2HD ARG 105 4.726 5.802 -9.839 918 HD3 ARG 105 3HD ARG 105 3.190 6.394 -9.202 919 HE ARG 105 HE ARG 105 4.368 7.552 -7.488 920 HH11 ARG 105 1HH1 ARG 105 6.505 6.271 -9.982 921 HH12 ARG 105 2HH1 ARG 105 7.794 7.364 -9.588 922 HH21 ARG 105 1HH2 ARG 105 6.038 8.980 -7.015 923 HH22 ARG 105 2HH2 ARG 105 7.531 8.901 -7.906 924 H LYS 106 H LYS 106 0.925 3.767 -11.241 925 HA LYS 106 HA LYS 106 -0.527 1.228 -10.884 926 HB2 LYS 106 2HB LYS 106 -1.937 2.915 -11.860 927 HB3 LYS 106 3HB LYS 106 -0.683 3.473 -12.949 928 HG2 LYS 106 2HG LYS 106 -1.779 0.679 -13.286 929 HG3 LYS 106 3HG LYS 106 -2.743 2.051 -13.842 930 HD2 LYS 106 2HD LYS 106 -0.802 2.786 -15.256 931 HD3 LYS 106 3HD LYS 106 0.084 1.349 -14.747 932 HE2 LYS 106 2HE LYS 106 -0.821 0.923 -16.919 933 HE3 LYS 106 3HE LYS 106 -1.755 -0.036 -15.768 934 HZ1 LYS 106 3HZ LYS 106 -3.146 1.084 -17.418 935 HZ2 LYS 106 1HZ LYS 106 -2.601 2.586 -16.883 936 HZ3 LYS 106 2HZ LYS 106 -3.513 1.601 -15.856 937 H VAL 107 H VAL 107 0.513 -0.547 -11.513 938 HA VAL 107 HA VAL 107 2.403 -0.599 -13.768 939 HB VAL 107 HB VAL 107 4.009 -2.028 -12.574 940 HG11 VAL 107 1HG1 VAL 107 4.457 0.378 -12.511 941 HG12 VAL 107 2HG1 VAL 107 5.041 -0.404 -11.040 942 HG13 VAL 107 3HG1 VAL 107 3.541 0.529 -11.008 943 HG21 VAL 107 3HG2 VAL 107 2.296 -1.647 -10.095 944 HG22 VAL 107 1HG2 VAL 107 3.882 -2.424 -10.131 945 HG23 VAL 107 2HG2 VAL 107 2.524 -3.149 -10.994 946 H THR 108 H THR 108 3.065 -3.092 -13.969 947 HA THR 108 HA THR 108 0.727 -4.837 -13.758 948 HB THR 108 HB THR 108 1.948 -4.201 -16.493 949 HG1 THR 108 HG1 THR 108 -0.429 -3.240 -15.255 950 HG21 THR 108 3HG2 THR 108 -0.005 -5.415 -17.373 951 HG22 THR 108 1HG2 THR 108 -0.545 -5.737 -15.726 952 HG23 THR 108 2HG2 THR 108 0.957 -6.454 -16.315 953 H ASP 109 H ASP 109 4.056 -4.313 -14.903 954 HA ASP 109 HA ASP 109 4.745 -7.114 -15.104 955 HB2 ASP 109 2HB ASP 109 5.742 -5.475 -16.643 956 HB3 ASP 109 3HB ASP 109 6.428 -4.581 -15.297 957 H ASP 110 H ASP 110 6.464 -8.131 -13.897 958 HA ASP 110 HA ASP 110 5.982 -8.076 -11.103 959 HB2 ASP 110 2HB ASP 110 6.466 -10.150 -12.338 960 HB3 ASP 110 3HB ASP 110 8.060 -9.558 -12.770 961 H GLU 111 H GLU 111 9.057 -7.468 -12.916 962 HA GLU 111 HA GLU 111 10.391 -6.612 -10.491 963 HB2 GLU 111 2HB GLU 111 12.391 -6.294 -11.848 964 HB3 GLU 111 3HB GLU 111 11.657 -7.858 -12.186 965 HG2 GLU 111 2HG GLU 111 10.698 -6.964 -14.273 966 HG3 GLU 111 3HG GLU 111 11.414 -5.389 -13.929 967 H GLU 112 H GLU 112 8.675 -5.079 -13.075 968 HA GLU 112 HA GLU 112 9.443 -2.382 -12.701 969 HB2 GLU 112 2HB GLU 112 8.103 -3.090 -14.619 970 HB3 GLU 112 3HB GLU 112 6.798 -3.630 -13.571 971 HG2 GLU 112 2HG GLU 112 6.375 -1.285 -12.901 972 HG3 GLU 112 3HG GLU 112 7.687 -0.751 -13.956 973 H ALA 113 H ALA 113 6.923 -4.379 -11.140 974 HA ALA 113 HA ALA 113 5.934 -2.451 -9.349 975 HB1 ALA 113 3HB ALA 113 6.103 -5.463 -8.962 976 HB2 ALA 113 1HB ALA 113 4.803 -4.596 -9.782 977 HB3 ALA 113 2HB ALA 113 5.067 -4.360 -8.053 978 H LEU 114 H LEU 114 8.617 -4.758 -9.017 979 HA LEU 114 HA LEU 114 9.197 -4.316 -6.289 980 HB2 LEU 114 2HB LEU 114 10.967 -5.354 -8.533 981 HB3 LEU 114 3HB LEU 114 11.430 -5.387 -6.838 982 HG LEU 114 HG LEU 114 9.032 -6.869 -8.012 983 HD11 LEU 114 1HD1 LEU 114 11.144 -7.830 -8.803 984 HD12 LEU 114 2HD1 LEU 114 10.318 -8.919 -7.694 985 HD13 LEU 114 3HD1 LEU 114 11.713 -7.988 -7.138 986 HD21 LEU 114 3HD2 LEU 114 8.909 -8.004 -5.830 987 HD22 LEU 114 1HD2 LEU 114 8.665 -6.266 -5.665 988 HD23 LEU 114 2HD2 LEU 114 10.213 -6.986 -5.213 989 H LYS 115 H LYS 115 10.377 -2.642 -9.213 990 HA LYS 115 HA LYS 115 12.473 -1.201 -7.842 991 HB2 LYS 115 2HB LYS 115 12.845 -0.032 -9.961 992 HB3 LYS 115 3HB LYS 115 12.649 -1.756 -10.256 993 HG2 LYS 115 2HG LYS 115 10.263 -1.294 -10.904 994 HG3 LYS 115 3HG LYS 115 10.619 0.429 -10.808 995 HD2 LYS 115 2HD LYS 115 12.083 -1.525 -12.633 996 HD3 LYS 115 3HD LYS 115 10.697 -0.560 -13.134 997 HE2 LYS 115 2HE LYS 115 13.299 0.630 -12.113 998 HE3 LYS 115 3HE LYS 115 12.908 0.395 -13.818 999 HZ1 LYS 115 3HZ LYS 115 11.013 1.850 -13.563 1000 HZ2 LYS 115 1HZ LYS 115 12.427 2.643 -13.085 1001 HZ3 LYS 115 2HZ LYS 115 11.354 2.057 -11.924 1002 H ILE 116 H ILE 116 9.094 -0.633 -8.530 1003 HA ILE 116 HA ILE 116 8.999 2.153 -7.879 1004 HB ILE 116 HB ILE 116 6.808 0.035 -7.856 1005 HG12 ILE 116 2HG1 ILE 116 7.810 0.423 -10.109 1006 HG13 ILE 116 3HG1 ILE 116 6.122 0.889 -10.038 1007 HG21 ILE 116 1HG2 ILE 116 5.203 1.920 -7.922 1008 HG22 ILE 116 2HG2 ILE 116 6.541 3.047 -7.689 1009 HG23 ILE 116 3HG2 ILE 116 6.140 1.879 -6.428 1010 HD11 ILE 116 3HD1 ILE 116 7.471 2.404 -11.359 1011 HD12 ILE 116 1HD1 ILE 116 8.467 2.777 -9.956 1012 HD13 ILE 116 2HD1 ILE 116 6.758 3.232 -9.975 1013 H VAL 117 H VAL 117 8.359 -0.855 -6.055 1014 HA VAL 117 HA VAL 117 7.631 0.174 -3.562 1015 HB VAL 117 HB VAL 117 9.217 -2.374 -4.166 1016 HG11 VAL 117 1HG1 VAL 117 7.746 -1.629 -1.604 1017 HG12 VAL 117 2HG1 VAL 117 9.494 -1.788 -1.789 1018 HG13 VAL 117 3HG1 VAL 117 8.459 -3.207 -1.952 1019 HG21 VAL 117 3HG2 VAL 117 6.234 -1.971 -3.710 1020 HG22 VAL 117 1HG2 VAL 117 7.034 -3.525 -3.977 1021 HG23 VAL 117 2HG2 VAL 117 7.009 -2.313 -5.258 1022 H ARG 118 H ARG 118 10.826 -0.386 -4.965 1023 HA ARG 118 HA ARG 118 12.398 0.270 -2.713 1024 HB2 ARG 118 2HB ARG 118 13.068 0.316 -5.680 1025 HB3 ARG 118 3HB ARG 118 14.264 0.567 -4.405 1026 HG2 ARG 118 2HG ARG 118 13.847 -1.656 -3.507 1027 HG3 ARG 118 3HG ARG 118 12.548 -1.922 -4.669 1028 HD2 ARG 118 2HD ARG 118 14.211 -1.810 -6.518 1029 HD3 ARG 118 3HD ARG 118 15.503 -1.600 -5.322 1030 HE ARG 118 HE ARG 118 14.061 -3.880 -4.626 1031 HH11 ARG 118 1HH1 ARG 118 16.151 -2.939 -7.309 1032 HH12 ARG 118 2HH1 ARG 118 16.665 -4.567 -7.615 1033 HH21 ARG 118 1HH2 ARG 118 14.768 -5.970 -5.015 1034 HH22 ARG 118 2HH2 ARG 118 15.882 -6.283 -6.314 1035 H GLU 119 H GLU 119 10.987 2.317 -5.282 1036 HA GLU 119 HA GLU 119 12.212 4.756 -4.513 1037 HB2 GLU 119 2HB GLU 119 9.486 4.333 -5.813 1038 HB3 GLU 119 3HB GLU 119 10.260 5.902 -5.598 1039 HG2 GLU 119 2HG GLU 119 12.216 4.919 -6.972 1040 HG3 GLU 119 3HG GLU 119 11.087 3.634 -7.414 1041 H PHE 120 H PHE 120 9.101 3.267 -3.558 1042 HA PHE 120 HA PHE 120 8.141 5.195 -1.792 1043 HB2 PHE 120 2HB PHE 120 7.841 2.169 -1.636 1044 HB3 PHE 120 3HB PHE 120 6.885 3.308 -0.691 1045 HD1 PHE 120 HD2 PHE 120 6.703 5.297 -3.259 1046 HD2 PHE 120 HD1 PHE 120 5.774 1.181 -2.497 1047 HE1 PHE 120 HE2 PHE 120 4.957 5.358 -4.993 1048 HE2 PHE 120 HE1 PHE 120 4.036 1.267 -4.223 1049 HZ PHE 120 HZ PHE 120 3.620 3.346 -5.468 1050 H MET 121 H MET 121 10.489 2.639 -1.242 1051 HA MET 121 HA MET 121 10.789 2.982 1.584 1052 HB2 MET 121 2HB MET 121 12.569 1.610 -0.481 1053 HB3 MET 121 3HB MET 121 12.772 1.467 1.264 1054 HG2 MET 121 2HG MET 121 10.758 0.231 1.505 1055 HG3 MET 121 3HG MET 121 10.186 0.690 -0.098 1056 HE1 MET 121 3HE MET 121 12.456 -1.795 1.956 1057 HE2 MET 121 1HE MET 121 13.666 -0.766 1.177 1058 HE3 MET 121 2HE MET 121 13.487 -2.450 0.685 1059 H GLN 122 H GLN 122 12.367 4.385 -1.273 1060 HA GLN 122 HA GLN 122 14.526 5.703 0.050 1061 HB2 GLN 122 2HB GLN 122 13.140 6.337 -2.592 1062 HB3 GLN 122 3HB GLN 122 14.557 7.209 -2.016 1063 HG2 GLN 122 2HG GLN 122 14.445 4.244 -2.614 1064 HG3 GLN 122 3HG GLN 122 15.125 5.475 -3.675 1065 HE21 GLN 122 1HE2 GLN 122 16.422 3.132 -2.487 1066 HE22 GLN 122 2HE2 GLN 122 17.757 3.733 -1.563 1067 H LYS 123 H LYS 123 11.245 6.794 -0.873 1068 HA LYS 123 HA LYS 123 11.355 9.381 0.257 1069 HB2 LYS 123 2HB LYS 123 9.003 7.519 -0.260 1070 HB3 LYS 123 3HB LYS 123 8.771 9.070 0.520 1071 HG2 LYS 123 2HG LYS 123 8.173 9.395 -1.738 1072 HG3 LYS 123 3HG LYS 123 9.754 10.156 -1.563 1073 HD2 LYS 123 2HD LYS 123 10.840 8.358 -2.722 1074 HD3 LYS 123 3HD LYS 123 9.404 7.339 -2.631 1075 HE2 LYS 123 2HE LYS 123 9.682 8.190 -4.898 1076 HE3 LYS 123 3HE LYS 123 8.227 8.883 -4.183 1077 HZ1 LYS 123 3HZ LYS 123 9.550 10.513 -5.417 1078 HZ2 LYS 123 1HZ LYS 123 10.857 10.253 -4.380 1079 HZ3 LYS 123 2HZ LYS 123 9.427 10.927 -3.782 1080 H ALA 124 H ALA 124 10.501 6.204 1.608 1081 HA ALA 124 HA ALA 124 9.284 7.037 4.004 1082 HB1 ALA 124 3HB ALA 124 9.462 4.684 4.675 1083 HB2 ALA 124 1HB ALA 124 10.619 4.386 3.370 1084 HB3 ALA 124 2HB ALA 124 8.949 4.816 2.993 1085 H GLY 125 H GLY 125 12.641 6.033 3.310 1086 HA2 GLY 125 2HA GLY 125 13.717 6.137 5.907 1087 HA3 GLY 125 3HA GLY 125 14.620 6.380 4.423 1088 H SER 126 H SER 126 13.568 8.601 3.374 1089 HA SER 126 HA SER 126 14.810 10.728 4.692 1090 HB2 SER 126 2HB SER 126 12.663 10.812 2.536 1091 HB3 SER 126 3HB SER 126 13.812 12.105 2.911 1092 HG SER 126 HG SER 126 14.147 9.942 1.344 1093 H LEU 127 H LEU 127 11.485 9.567 4.923 1094 HA LEU 127 HA LEU 127 10.281 11.886 6.098 1095 HB2 LEU 127 2HB LEU 127 9.453 8.963 6.248 1096 HB3 LEU 127 3HB LEU 127 8.437 10.321 6.721 1097 HG LEU 127 HG LEU 127 9.461 9.854 3.898 1098 HD11 LEU 127 1HD1 LEU 127 7.216 9.128 3.318 1099 HD12 LEU 127 2HD1 LEU 127 6.708 9.278 5.003 1100 HD13 LEU 127 3HD1 LEU 127 7.915 8.075 4.547 1101 HD21 LEU 127 3HD2 LEU 127 7.823 11.564 3.244 1102 HD22 LEU 127 1HD2 LEU 127 9.029 12.215 4.352 1103 HD23 LEU 127 2HD2 LEU 127 7.408 11.828 4.940 1104 H GLU 128 H GLU 128 11.983 9.094 7.354 1105 HA GLU 128 HA GLU 128 11.342 9.397 10.125 1106 HB2 GLU 128 2HB GLU 128 12.099 7.262 9.100 1107 HB3 GLU 128 3HB GLU 128 13.681 7.971 8.789 1108 HG2 GLU 128 2HG GLU 128 14.028 8.229 11.240 1109 HG3 GLU 128 3HG GLU 128 12.455 7.481 11.528 1110 H HIS 129 H HIS 129 13.804 10.758 8.008 1111 HA HIS 129 HA HIS 129 15.632 11.461 10.148 1112 HB2 HIS 129 2HB HIS 129 15.736 11.914 7.147 1113 HB3 HIS 129 3HB HIS 129 16.975 12.524 8.239 1114 HD1 HIS 129 HD1 HIS 129 18.277 10.604 9.657 1115 HD2 HIS 129 HD2 HIS 129 16.150 9.336 6.327 1116 HE1 HIS 129 HE1 HIS 129 19.166 8.321 9.118 1117 HE2 HIS 129 HE2 HIS 129 17.906 7.610 7.060 1118 H HIS 130 H HIS 130 12.906 12.827 10.100 1119 HA HIS 130 HA HIS 130 13.627 15.644 10.096 1120 HB2 HIS 130 2HB HIS 130 11.259 14.184 11.368 1121 HB3 HIS 130 3HB HIS 130 11.449 15.930 11.349 1122 HD1 HIS 130 HD1 HIS 130 9.631 13.423 9.675 1123 HD2 HIS 130 HD2 HIS 130 11.696 16.797 8.404 1124 HE1 HIS 130 HE1 HIS 130 8.640 14.029 7.454 1125 HE2 HIS 130 HE2 HIS 130 9.748 16.190 6.829 1126 H HIS 131 H HIS 131 15.696 15.076 11.295 1127 HA HIS 131 HA HIS 131 15.522 14.165 14.044 1128 HB2 HIS 131 2HB HIS 131 18.074 14.476 13.987 1129 HB3 HIS 131 3HB HIS 131 17.388 13.272 12.914 1130 HD1 HIS 131 HD1 HIS 131 17.553 13.691 10.366 1131 HD2 HIS 131 HD2 HIS 131 19.326 16.662 12.673 1132 HE1 HIS 131 HE1 HIS 131 18.926 15.059 8.774 1133 HE2 HIS 131 HE2 HIS 131 20.075 16.770 10.208 1134 H HIS 132 H HIS 132 14.212 15.819 14.860 1135 HA HIS 132 HA HIS 132 15.261 18.511 15.170 1136 HB2 HIS 132 2HB HIS 132 13.189 18.893 16.535 1137 HB3 HIS 132 3HB HIS 132 12.863 18.303 14.910 1138 HD1 HIS 132 HD1 HIS 132 11.944 15.846 14.708 1139 HD2 HIS 132 HD2 HIS 132 12.244 17.269 18.604 1140 HE1 HIS 132 HE1 HIS 132 10.582 14.275 16.112 1141 HE2 HIS 132 HE2 HIS 132 10.964 15.030 18.481 1142 H HIS 133 H HIS 133 16.388 19.282 16.856 1143 HA HIS 133 HA HIS 133 16.574 17.909 19.420 1144 HB2 HIS 133 2HB HIS 133 18.204 16.731 17.834 1145 HB3 HIS 133 3HB HIS 133 19.097 18.243 17.721 1146 HD1 HIS 133 HD1 HIS 133 17.912 15.898 20.494 1147 HD2 HIS 133 HD2 HIS 133 21.156 18.307 19.509 1148 HE1 HIS 133 HE1 HIS 133 19.583 15.579 22.341 1149 HE2 HIS 133 HE2 HIS 133 21.476 17.136 21.777 1150 H HIS 134 H HIS 134 16.168 20.670 17.853 1151 HA HIS 134 HA HIS 134 17.384 22.329 19.980 1152 HB2 HIS 134 2HB HIS 134 18.681 22.655 17.858 1153 HB3 HIS 134 3HB HIS 134 17.199 23.127 17.034 1154 HD1 HIS 134 HD1 HIS 134 16.070 25.419 17.913 1155 HD2 HIS 134 HD2 HIS 134 19.960 24.705 19.202 1156 HE1 HIS 134 HE1 HIS 134 16.923 27.625 18.768 1157 HE2 HIS 134 HE2 HIS 134 19.228 27.133 19.647 Start of MODEL 9 1 H1 MET 1 1H MET 1 2.039 10.114 13.460 2 H2 MET 1 2H MET 1 2.679 11.671 13.299 3 H3 MET 1 3H MET 1 3.570 10.465 14.072 4 HA MET 1 HA MET 1 2.784 10.451 11.234 5 HB2 MET 1 2HB MET 1 4.531 12.154 11.715 6 HB3 MET 1 3HB MET 1 5.519 10.938 12.515 7 HG2 MET 1 2HG MET 1 6.325 11.440 10.235 8 HG3 MET 1 3HG MET 1 5.822 9.752 10.391 9 HE1 MET 1 3HE MET 1 4.697 10.285 6.742 10 HE2 MET 1 1HE MET 1 5.516 9.224 7.889 11 HE3 MET 1 2HE MET 1 6.201 10.806 7.500 12 H LYS 2 H LYS 2 3.181 8.566 10.169 13 HA LYS 2 HA LYS 2 5.059 6.582 11.058 14 HB2 LYS 2 2HB LYS 2 3.447 4.705 11.250 15 HB3 LYS 2 3HB LYS 2 3.134 5.940 12.463 16 HG2 LYS 2 2HG LYS 2 1.323 6.837 10.885 17 HG3 LYS 2 3HG LYS 2 1.535 5.352 9.958 18 HD2 LYS 2 2HD LYS 2 0.731 5.475 12.894 19 HD3 LYS 2 3HD LYS 2 -0.393 5.284 11.551 20 HE2 LYS 2 2HE LYS 2 -0.062 3.111 12.480 21 HE3 LYS 2 3HE LYS 2 0.837 3.133 10.971 22 HZ1 LYS 2 3HZ LYS 2 2.089 3.635 13.608 23 HZ2 LYS 2 1HZ LYS 2 2.866 3.318 12.141 24 HZ3 LYS 2 2HZ LYS 2 1.983 2.099 12.912 25 H ILE 3 H ILE 3 5.029 4.698 9.418 26 HA ILE 3 HA ILE 3 4.487 5.757 6.698 27 HB ILE 3 HB ILE 3 6.538 3.674 7.583 28 HG12 ILE 3 2HG1 ILE 3 7.010 6.528 6.609 29 HG13 ILE 3 3HG1 ILE 3 7.096 6.017 8.293 30 HG21 ILE 3 1HG2 ILE 3 6.093 4.886 4.824 31 HG22 ILE 3 2HG2 ILE 3 5.710 3.231 5.299 32 HG23 ILE 3 3HG2 ILE 3 7.390 3.767 5.261 33 HD11 ILE 3 3HD1 ILE 3 8.986 4.605 7.799 34 HD12 ILE 3 1HD1 ILE 3 9.291 6.249 7.262 35 HD13 ILE 3 2HD1 ILE 3 8.883 5.001 6.087 36 H LEU 4 H LEU 4 2.799 4.775 5.735 37 HA LEU 4 HA LEU 4 2.509 1.835 5.999 38 HB2 LEU 4 2HB LEU 4 0.382 3.966 5.885 39 HB3 LEU 4 3HB LEU 4 0.057 2.467 5.035 40 HG LEU 4 HG LEU 4 0.447 1.219 7.198 41 HD11 LEU 4 1HD1 LEU 4 1.790 2.817 8.413 42 HD12 LEU 4 2HD1 LEU 4 0.330 2.452 9.325 43 HD13 LEU 4 3HD1 LEU 4 0.462 3.976 8.441 44 HD21 LEU 4 3HD2 LEU 4 -1.755 1.765 8.151 45 HD22 LEU 4 1HD2 LEU 4 -1.801 1.657 6.393 46 HD23 LEU 4 2HD2 LEU 4 -1.810 3.239 7.179 47 H ILE 5 H ILE 5 3.163 0.853 4.214 48 HA ILE 5 HA ILE 5 2.716 2.131 1.581 49 HB ILE 5 HB ILE 5 4.544 -0.229 2.241 50 HG12 ILE 5 2HG1 ILE 5 5.201 2.680 1.570 51 HG13 ILE 5 3HG1 ILE 5 5.486 1.873 3.108 52 HG21 ILE 5 1HG2 ILE 5 4.140 1.227 -0.409 53 HG22 ILE 5 2HG2 ILE 5 3.587 -0.407 -0.036 54 HG23 ILE 5 3HG2 ILE 5 5.313 -0.061 -0.109 55 HD11 ILE 5 3HD1 ILE 5 7.545 2.128 1.887 56 HD12 ILE 5 1HD1 ILE 5 6.874 1.280 0.493 57 HD13 ILE 5 2HD1 ILE 5 7.138 0.417 2.011 58 H LEU 6 H LEU 6 0.853 1.544 0.769 59 HA LEU 6 HA LEU 6 -0.534 -0.904 1.496 60 HB2 LEU 6 2HB LEU 6 -1.306 1.373 -0.378 61 HB3 LEU 6 3HB LEU 6 -2.355 0.040 0.074 62 HG LEU 6 HG LEU 6 -1.320 2.214 1.907 63 HD11 LEU 6 1HD1 LEU 6 -4.128 1.656 0.905 64 HD12 LEU 6 2HD1 LEU 6 -3.086 2.995 0.415 65 HD13 LEU 6 3HD1 LEU 6 -3.672 2.903 2.073 66 HD21 LEU 6 3HD2 LEU 6 -2.721 1.214 3.657 67 HD22 LEU 6 1HD2 LEU 6 -1.447 0.117 3.134 68 HD23 LEU 6 2HD2 LEU 6 -3.106 -0.138 2.585 69 H ILE 7 H ILE 7 -0.294 -2.691 0.335 70 HA ILE 7 HA ILE 7 0.451 -2.551 -2.533 71 HB ILE 7 HB ILE 7 0.848 -4.828 -0.543 72 HG12 ILE 7 2HG1 ILE 7 2.511 -3.028 -0.282 73 HG13 ILE 7 3HG1 ILE 7 3.273 -4.468 -0.941 74 HG21 ILE 7 1HG2 ILE 7 1.487 -4.794 -3.519 75 HG22 ILE 7 2HG2 ILE 7 0.261 -5.784 -2.725 76 HG23 ILE 7 3HG2 ILE 7 1.971 -6.065 -2.391 77 HD11 ILE 7 3HD1 ILE 7 4.115 -2.464 -1.987 78 HD12 ILE 7 1HD1 ILE 7 2.492 -2.002 -2.495 79 HD13 ILE 7 2HD1 ILE 7 3.256 -3.447 -3.172 80 H ASN 8 H ASN 8 -1.300 -2.709 -3.740 81 HA ASN 8 HA ASN 8 -3.202 -4.917 -3.221 82 HB2 ASN 8 2HB ASN 8 -4.382 -2.776 -2.961 83 HB3 ASN 8 3HB ASN 8 -3.796 -2.224 -4.528 84 HD21 ASN 8 1HD2 ASN 8 -5.928 -4.476 -2.896 85 HD22 ASN 8 2HD2 ASN 8 -6.904 -4.851 -4.271 86 H THR 9 H THR 9 -2.376 -6.442 -4.506 87 HA THR 9 HA THR 9 -2.248 -5.858 -7.379 88 HB THR 9 HB THR 9 0.057 -6.012 -6.803 89 HG1 THR 9 HG1 THR 9 -0.119 -7.096 -8.653 90 HG21 THR 9 3HG2 THR 9 -0.091 -7.098 -4.620 91 HG22 THR 9 1HG2 THR 9 1.086 -7.909 -5.655 92 HG23 THR 9 2HG2 THR 9 -0.506 -8.627 -5.400 93 H ASN 10 H ASN 10 -3.059 -7.322 -8.714 94 HA ASN 10 HA ASN 10 -4.979 -9.246 -7.907 95 HB2 ASN 10 2HB ASN 10 -4.878 -7.910 -10.094 96 HB3 ASN 10 3HB ASN 10 -3.592 -8.981 -10.621 97 HD21 ASN 10 1HD2 ASN 10 -6.322 -8.404 -11.691 98 HD22 ASN 10 2HD2 ASN 10 -7.078 -9.950 -11.854 99 H ASN 11 H ASN 11 -1.567 -9.322 -8.363 100 HA ASN 11 HA ASN 11 -1.336 -12.241 -8.641 101 HB2 ASN 11 2HB ASN 11 0.903 -10.168 -8.690 102 HB3 ASN 11 3HB ASN 11 0.966 -11.829 -9.274 103 HD21 ASN 11 1HD2 ASN 11 -0.244 -8.622 -9.897 104 HD22 ASN 11 2HD2 ASN 11 -0.577 -8.855 -11.568 105 H ASP 12 H ASP 12 -1.853 -12.929 -6.553 106 HA ASP 12 HA ASP 12 -0.816 -11.897 -4.134 107 HB2 ASP 12 2HB ASP 12 -2.833 -13.356 -4.306 108 HB3 ASP 12 3HB ASP 12 -1.808 -14.721 -4.743 109 H GLU 13 H GLU 13 0.517 -14.079 -6.497 110 HA GLU 13 HA GLU 13 2.672 -15.224 -5.069 111 HB2 GLU 13 2HB GLU 13 2.419 -14.521 -8.025 112 HB3 GLU 13 3HB GLU 13 3.687 -15.545 -7.349 113 HG2 GLU 13 2HG GLU 13 1.949 -17.163 -6.606 114 HG3 GLU 13 3HG GLU 13 0.707 -16.153 -7.354 115 H LEU 14 H LEU 14 2.382 -12.216 -6.935 116 HA LEU 14 HA LEU 14 5.031 -11.288 -6.818 117 HB2 LEU 14 2HB LEU 14 3.418 -10.359 -8.371 118 HB3 LEU 14 3HB LEU 14 2.381 -9.825 -7.064 119 HG LEU 14 HG LEU 14 4.102 -8.126 -6.414 120 HD11 LEU 14 1HD1 LEU 14 5.588 -8.995 -8.908 121 HD12 LEU 14 2HD1 LEU 14 6.128 -9.201 -7.240 122 HD13 LEU 14 3HD1 LEU 14 5.961 -7.581 -7.914 123 HD21 LEU 14 3HD2 LEU 14 3.682 -6.588 -8.266 124 HD22 LEU 14 1HD2 LEU 14 2.233 -7.506 -7.865 125 HD23 LEU 14 2HD2 LEU 14 3.179 -7.931 -9.295 126 H ILE 15 H ILE 15 2.370 -11.033 -4.508 127 HA ILE 15 HA ILE 15 3.410 -9.097 -2.762 128 HB ILE 15 HB ILE 15 1.576 -11.436 -2.094 129 HG12 ILE 15 2HG1 ILE 15 0.941 -8.530 -2.772 130 HG13 ILE 15 3HG1 ILE 15 0.676 -9.911 -3.829 131 HG21 ILE 15 1HG2 ILE 15 2.632 -10.557 -0.048 132 HG22 ILE 15 2HG2 ILE 15 0.922 -10.144 -0.087 133 HG23 ILE 15 3HG2 ILE 15 2.131 -8.919 -0.474 134 HD11 ILE 15 3HD1 ILE 15 -0.739 -9.369 -1.220 135 HD12 ILE 15 1HD1 ILE 15 -1.000 -10.776 -2.258 136 HD13 ILE 15 2HD1 ILE 15 -1.389 -9.160 -2.845 137 H LYS 16 H LYS 16 3.885 -12.641 -2.826 138 HA LYS 16 HA LYS 16 5.244 -13.098 -0.449 139 HB2 LYS 16 2HB LYS 16 5.890 -14.346 -3.155 140 HB3 LYS 16 3HB LYS 16 6.381 -14.994 -1.590 141 HG2 LYS 16 2HG LYS 16 4.037 -15.402 -1.000 142 HG3 LYS 16 3HG LYS 16 3.513 -14.703 -2.541 143 HD2 LYS 16 2HD LYS 16 4.716 -16.488 -3.767 144 HD3 LYS 16 3HD LYS 16 5.281 -17.170 -2.238 145 HE2 LYS 16 2HE LYS 16 2.381 -16.959 -3.095 146 HE3 LYS 16 3HE LYS 16 3.363 -18.422 -3.174 147 HZ1 LYS 16 3HZ LYS 16 2.674 -16.944 -0.689 148 HZ2 LYS 16 1HZ LYS 16 3.589 -18.364 -0.778 149 HZ3 LYS 16 2HZ LYS 16 1.957 -18.380 -1.213 150 H LYS 17 H LYS 17 6.472 -11.927 -3.524 151 HA LYS 17 HA LYS 17 9.249 -11.861 -2.873 152 HB2 LYS 17 2HB LYS 17 7.816 -10.316 -5.065 153 HB3 LYS 17 3HB LYS 17 9.520 -10.776 -5.022 154 HG2 LYS 17 2HG LYS 17 8.895 -13.151 -5.246 155 HG3 LYS 17 3HG LYS 17 7.184 -12.712 -5.223 156 HD2 LYS 17 2HD LYS 17 7.816 -13.092 -7.515 157 HD3 LYS 17 3HD LYS 17 7.564 -11.357 -7.312 158 HE2 LYS 17 2HE LYS 17 9.550 -11.731 -8.659 159 HE3 LYS 17 3HE LYS 17 10.042 -11.074 -7.097 160 HZ1 LYS 17 3HZ LYS 17 11.466 -12.887 -7.766 161 HZ2 LYS 17 1HZ LYS 17 10.146 -13.937 -7.891 162 HZ3 LYS 17 2HZ LYS 17 10.599 -13.321 -6.382 163 H ILE 18 H ILE 18 6.626 -9.468 -2.953 164 HA ILE 18 HA ILE 18 8.121 -7.140 -2.346 165 HB ILE 18 HB ILE 18 5.170 -7.789 -1.939 166 HG12 ILE 18 2HG1 ILE 18 6.574 -6.163 -4.111 167 HG13 ILE 18 3HG1 ILE 18 5.971 -7.804 -4.303 168 HG21 ILE 18 1HG2 ILE 18 4.749 -5.359 -1.708 169 HG22 ILE 18 2HG2 ILE 18 6.486 -5.057 -1.726 170 HG23 ILE 18 3HG2 ILE 18 5.764 -5.966 -0.399 171 HD11 ILE 18 3HD1 ILE 18 4.310 -5.328 -3.830 172 HD12 ILE 18 1HD1 ILE 18 3.678 -6.975 -3.943 173 HD13 ILE 18 2HD1 ILE 18 4.471 -6.238 -5.332 174 H LYS 19 H LYS 19 6.691 -9.631 -0.289 175 HA LYS 19 HA LYS 19 6.862 -8.369 2.240 176 HB2 LYS 19 2HB LYS 19 6.987 -11.311 1.472 177 HB3 LYS 19 3HB LYS 19 6.857 -10.742 3.136 178 HG2 LYS 19 2HG LYS 19 4.662 -9.831 2.740 179 HG3 LYS 19 3HG LYS 19 4.801 -10.097 1.000 180 HD2 LYS 19 2HD LYS 19 3.358 -11.790 2.110 181 HD3 LYS 19 3HD LYS 19 4.753 -12.515 1.307 182 HE2 LYS 19 2HE LYS 19 4.290 -13.513 3.540 183 HE3 LYS 19 3HE LYS 19 5.893 -12.783 3.456 184 HZ1 LYS 19 3HZ LYS 19 3.492 -11.499 4.653 185 HZ2 LYS 19 1HZ LYS 19 5.063 -10.868 4.636 186 HZ3 LYS 19 2HZ LYS 19 4.725 -12.265 5.519 187 H LYS 20 H LYS 20 9.042 -10.659 0.593 188 HA LYS 20 HA LYS 20 11.082 -10.661 2.560 189 HB2 LYS 20 2HB LYS 20 11.508 -11.255 -0.395 190 HB3 LYS 20 3HB LYS 20 12.439 -11.872 0.966 191 HG2 LYS 20 2HG LYS 20 9.617 -12.628 0.162 192 HG3 LYS 20 3HG LYS 20 11.053 -13.640 0.074 193 HD2 LYS 20 2HD LYS 20 9.877 -12.628 2.695 194 HD3 LYS 20 3HD LYS 20 9.407 -14.154 1.952 195 HE2 LYS 20 2HE LYS 20 11.029 -14.640 3.649 196 HE3 LYS 20 3HE LYS 20 11.815 -14.882 2.090 197 HZ1 LYS 20 3HZ LYS 20 13.183 -13.708 3.754 198 HZ2 LYS 20 1HZ LYS 20 12.084 -12.425 3.731 199 HZ3 LYS 20 2HZ LYS 20 12.964 -12.816 2.338 200 H GLU 21 H GLU 21 10.407 -8.657 -0.199 201 HA GLU 21 HA GLU 21 12.853 -7.332 -0.546 202 HB2 GLU 21 2HB GLU 21 10.534 -7.448 -1.972 203 HB3 GLU 21 3HB GLU 21 10.269 -5.903 -1.188 204 HG2 GLU 21 2HG GLU 21 11.222 -5.532 -3.362 205 HG3 GLU 21 3HG GLU 21 12.410 -5.088 -2.135 206 H VAL 22 H VAL 22 9.915 -6.421 1.267 207 HA VAL 22 HA VAL 22 10.959 -3.904 2.172 208 HB VAL 22 HB VAL 22 8.945 -3.651 3.514 209 HG11 VAL 22 1HG1 VAL 22 7.241 -3.758 1.741 210 HG12 VAL 22 2HG1 VAL 22 8.305 -4.786 0.782 211 HG13 VAL 22 3HG1 VAL 22 8.778 -3.126 1.144 212 HG21 VAL 22 3HG2 VAL 22 8.688 -5.927 4.414 213 HG22 VAL 22 1HG2 VAL 22 8.250 -6.529 2.813 214 HG23 VAL 22 2HG2 VAL 22 7.189 -5.394 3.653 215 H GLU 23 H GLU 23 11.012 -7.164 3.468 216 HA GLU 23 HA GLU 23 11.737 -6.625 6.137 217 HB2 GLU 23 2HB GLU 23 12.475 -8.955 4.332 218 HB3 GLU 23 3HB GLU 23 12.879 -8.906 6.045 219 HG2 GLU 23 2HG GLU 23 10.456 -8.726 6.587 220 HG3 GLU 23 3HG GLU 23 10.083 -8.869 4.869 221 H ASN 24 H ASN 24 13.646 -6.408 3.186 222 HA ASN 24 HA ASN 24 16.235 -6.271 4.377 223 HB2 ASN 24 2HB ASN 24 15.248 -5.199 1.699 224 HB3 ASN 24 3HB ASN 24 16.941 -5.185 2.194 225 HD21 ASN 24 1HD2 ASN 24 14.301 -7.162 1.109 226 HD22 ASN 24 2HD2 ASN 24 15.221 -8.604 0.864 227 H GLN 25 H GLN 25 13.661 -3.990 4.257 228 HA GLN 25 HA GLN 25 15.428 -1.809 5.235 229 HB2 GLN 25 2HB GLN 25 12.698 -1.695 3.886 230 HB3 GLN 25 3HB GLN 25 13.446 -0.302 4.662 231 HG2 GLN 25 2HG GLN 25 14.617 -1.840 2.318 232 HG3 GLN 25 3HG GLN 25 13.774 -0.290 2.221 233 HE21 GLN 25 1HE2 GLN 25 16.708 -1.902 3.268 234 HE22 GLN 25 2HE2 GLN 25 17.651 -0.473 3.484 235 H GLY 26 H GLY 26 13.338 -4.178 6.329 236 HA2 GLY 26 2HA GLY 26 12.922 -4.667 8.551 237 HA3 GLY 26 3HA GLY 26 13.393 -3.039 9.006 238 H TYR 27 H TYR 27 10.967 -3.745 6.558 239 HA TYR 27 HA TYR 27 8.846 -2.505 8.142 240 HB2 TYR 27 2HB TYR 27 8.913 -3.544 5.284 241 HB3 TYR 27 3HB TYR 27 7.436 -2.963 6.042 242 HD1 TYR 27 HD1 TYR 27 10.982 -1.728 5.769 243 HD2 TYR 27 HD2 TYR 27 6.829 -0.836 5.290 244 HE1 TYR 27 HE1 TYR 27 11.551 0.534 5.072 245 HE2 TYR 27 HE2 TYR 27 7.409 1.447 4.592 246 HH TYR 27 HH TYR 27 10.643 2.373 3.876 247 H GLN 28 H GLN 28 7.173 -3.534 8.994 248 HA GLN 28 HA GLN 28 7.018 -6.431 9.144 249 HB2 GLN 28 2HB GLN 28 5.219 -4.223 10.244 250 HB3 GLN 28 3HB GLN 28 4.977 -5.935 10.557 251 HG2 GLN 28 2HG GLN 28 6.006 -4.890 12.486 252 HG3 GLN 28 3HG GLN 28 7.130 -6.029 11.761 253 HE21 GLN 28 1HE2 GLN 28 6.352 -2.589 11.975 254 HE22 GLN 28 2HE2 GLN 28 7.959 -2.020 11.710 255 H VAL 29 H VAL 29 4.813 -7.443 8.655 256 HA VAL 29 HA VAL 29 3.418 -6.150 6.380 257 HB VAL 29 HB VAL 29 4.071 -9.128 6.567 258 HG11 VAL 29 1HG1 VAL 29 2.594 -7.602 4.388 259 HG12 VAL 29 2HG1 VAL 29 1.869 -8.743 5.521 260 HG13 VAL 29 3HG1 VAL 29 3.031 -9.314 4.320 261 HG21 VAL 29 3HG2 VAL 29 5.142 -7.040 4.626 262 HG22 VAL 29 1HG2 VAL 29 5.486 -8.772 4.560 263 HG23 VAL 29 2HG2 VAL 29 6.059 -7.807 5.923 264 H ARG 30 H ARG 30 1.276 -6.031 6.666 265 HA ARG 30 HA ARG 30 -0.024 -7.554 8.846 266 HB2 ARG 30 2HB ARG 30 0.278 -5.156 9.426 267 HB3 ARG 30 3HB ARG 30 -0.557 -4.685 7.952 268 HG2 ARG 30 2HG ARG 30 -2.158 -4.438 9.678 269 HG3 ARG 30 3HG ARG 30 -2.600 -5.935 8.858 270 HD2 ARG 30 2HD ARG 30 -1.039 -5.740 11.453 271 HD3 ARG 30 3HD ARG 30 -2.757 -6.089 11.325 272 HE ARG 30 HE ARG 30 -0.681 -7.893 10.224 273 HH11 ARG 30 1HH1 ARG 30 -3.545 -7.458 12.195 274 HH12 ARG 30 2HH1 ARG 30 -3.735 -9.156 12.485 275 HH21 ARG 30 1HH2 ARG 30 -0.916 -10.095 10.656 276 HH22 ARG 30 2HH2 ARG 30 -2.250 -10.649 11.618 277 H ASP 31 H ASP 31 -1.384 -8.980 7.956 278 HA ASP 31 HA ASP 31 -2.378 -8.683 5.252 279 HB2 ASP 31 2HB ASP 31 -2.623 -10.918 7.302 280 HB3 ASP 31 3HB ASP 31 -3.341 -10.991 5.692 281 H VAL 32 H VAL 32 -4.028 -7.395 5.012 282 HA VAL 32 HA VAL 32 -6.482 -7.679 6.606 283 HB VAL 32 HB VAL 32 -5.707 -5.644 4.455 284 HG11 VAL 32 1HG1 VAL 32 -8.133 -6.050 4.398 285 HG12 VAL 32 2HG1 VAL 32 -7.796 -4.442 5.037 286 HG13 VAL 32 3HG1 VAL 32 -8.245 -5.749 6.134 287 HG21 VAL 32 3HG2 VAL 32 -5.997 -5.272 7.468 288 HG22 VAL 32 1HG2 VAL 32 -5.649 -3.990 6.303 289 HG23 VAL 32 2HG2 VAL 32 -4.477 -5.284 6.566 290 H ASN 33 H ASN 33 -7.638 -9.351 5.893 291 HA ASN 33 HA ASN 33 -7.629 -10.254 3.096 292 HB2 ASN 33 2HB ASN 33 -8.855 -11.486 5.614 293 HB3 ASN 33 3HB ASN 33 -8.895 -12.222 4.013 294 HD21 ASN 33 1HD2 ASN 33 -6.785 -11.275 6.682 295 HD22 ASN 33 2HD2 ASN 33 -5.495 -12.341 6.260 296 H ASP 34 H ASP 34 -9.713 -8.740 5.461 297 HA ASP 34 HA ASP 34 -12.018 -8.672 3.643 298 HB2 ASP 34 2HB ASP 34 -12.179 -10.810 4.959 299 HB3 ASP 34 3HB ASP 34 -12.102 -9.883 6.454 300 H SER 35 H SER 35 -13.837 -7.371 4.688 301 HA SER 35 HA SER 35 -13.117 -4.820 5.544 302 HB2 SER 35 2HB SER 35 -15.592 -4.651 6.141 303 HB3 SER 35 3HB SER 35 -15.253 -5.201 4.501 304 HG SER 35 HG SER 35 -15.931 -7.188 4.995 305 H ASP 36 H ASP 36 -13.971 -7.697 7.435 306 HA ASP 36 HA ASP 36 -14.102 -6.503 10.000 307 HB2 ASP 36 2HB ASP 36 -15.029 -8.751 9.519 308 HB3 ASP 36 3HB ASP 36 -13.414 -9.382 9.213 309 H GLU 37 H GLU 37 -11.512 -8.236 8.287 310 HA GLU 37 HA GLU 37 -9.397 -7.963 10.090 311 HB2 GLU 37 2HB GLU 37 -9.360 -7.997 7.043 312 HB3 GLU 37 3HB GLU 37 -7.937 -8.227 8.051 313 HG2 GLU 37 2HG GLU 37 -10.357 -10.051 8.171 314 HG3 GLU 37 3HG GLU 37 -9.002 -10.322 7.073 315 H LEU 38 H LEU 38 -10.631 -5.763 7.607 316 HA LEU 38 HA LEU 38 -8.568 -3.858 7.535 317 HB2 LEU 38 2HB LEU 38 -10.363 -4.036 5.826 318 HB3 LEU 38 3HB LEU 38 -11.540 -3.494 7.011 319 HG LEU 38 HG LEU 38 -10.228 -1.288 7.153 320 HD11 LEU 38 1HD1 LEU 38 -8.857 -2.373 4.690 321 HD12 LEU 38 2HD1 LEU 38 -8.113 -2.051 6.259 322 HD13 LEU 38 3HD1 LEU 38 -8.745 -0.717 5.297 323 HD21 LEU 38 3HD2 LEU 38 -12.343 -1.439 5.933 324 HD22 LEU 38 1HD2 LEU 38 -11.489 -1.976 4.482 325 HD23 LEU 38 2HD2 LEU 38 -11.222 -0.351 5.118 326 H LYS 39 H LYS 39 -11.741 -3.747 9.213 327 HA LYS 39 HA LYS 39 -11.282 -1.215 10.387 328 HB2 LYS 39 2HB LYS 39 -13.405 -1.583 11.580 329 HB3 LYS 39 3HB LYS 39 -13.538 -1.997 9.882 330 HG2 LYS 39 2HG LYS 39 -14.706 -3.758 10.818 331 HG3 LYS 39 3HG LYS 39 -13.090 -4.461 10.743 332 HD2 LYS 39 2HD LYS 39 -12.768 -3.735 13.163 333 HD3 LYS 39 3HD LYS 39 -14.471 -3.272 13.184 334 HE2 LYS 39 2HE LYS 39 -13.384 -6.066 12.695 335 HE3 LYS 39 3HE LYS 39 -14.139 -5.491 14.181 336 HZ1 LYS 39 3HZ LYS 39 -16.198 -5.222 13.040 337 HZ2 LYS 39 1HZ LYS 39 -15.633 -6.787 12.752 338 HZ3 LYS 39 2HZ LYS 39 -15.499 -5.606 11.554 339 H LYS 40 H LYS 40 -10.786 -4.535 11.609 340 HA LYS 40 HA LYS 40 -10.280 -3.990 14.314 341 HB2 LYS 40 2HB LYS 40 -9.122 -6.124 12.489 342 HB3 LYS 40 3HB LYS 40 -8.775 -6.041 14.218 343 HG2 LYS 40 2HG LYS 40 -11.319 -6.117 14.578 344 HG3 LYS 40 3HG LYS 40 -11.437 -6.569 12.878 345 HD2 LYS 40 2HD LYS 40 -9.866 -8.074 14.982 346 HD3 LYS 40 3HD LYS 40 -11.483 -8.506 14.437 347 HE2 LYS 40 2HE LYS 40 -10.030 -9.972 13.273 348 HE3 LYS 40 3HE LYS 40 -10.455 -8.746 12.084 349 HZ1 LYS 40 3HZ LYS 40 -7.943 -8.786 13.671 350 HZ2 LYS 40 1HZ LYS 40 -8.320 -7.699 12.432 351 HZ3 LYS 40 2HZ LYS 40 -8.091 -9.337 12.075 352 H GLU 41 H GLU 41 -8.035 -4.114 11.541 353 HA GLU 41 HA GLU 41 -5.777 -3.256 13.073 354 HB2 GLU 41 2HB GLU 41 -6.010 -3.246 10.042 355 HB3 GLU 41 3HB GLU 41 -4.528 -3.252 10.996 356 HG2 GLU 41 2HG GLU 41 -6.432 -5.510 10.414 357 HG3 GLU 41 3HG GLU 41 -4.685 -5.466 10.260 358 H MET 42 H MET 42 -8.345 -1.578 11.379 359 HA MET 42 HA MET 42 -6.910 0.839 10.896 360 HB2 MET 42 2HB MET 42 -9.867 0.209 10.818 361 HB3 MET 42 3HB MET 42 -9.286 1.864 10.639 362 HG2 MET 42 2HG MET 42 -8.761 -0.486 8.819 363 HG3 MET 42 3HG MET 42 -9.569 1.037 8.436 364 HE1 MET 42 3HE MET 42 -8.230 3.408 8.298 365 HE2 MET 42 1HE MET 42 -6.481 3.544 8.455 366 HE3 MET 42 2HE MET 42 -7.466 3.177 9.872 367 H LYS 43 H LYS 43 -8.992 -0.222 13.636 368 HA LYS 43 HA LYS 43 -8.821 2.186 15.107 369 HB2 LYS 43 2HB LYS 43 -9.006 -0.679 16.092 370 HB3 LYS 43 3HB LYS 43 -8.812 0.650 17.224 371 HG2 LYS 43 2HG LYS 43 -11.096 0.468 17.276 372 HG3 LYS 43 3HG LYS 43 -10.933 1.641 15.974 373 HD2 LYS 43 2HD LYS 43 -12.520 0.102 15.177 374 HD3 LYS 43 3HD LYS 43 -11.026 -0.370 14.374 375 HE2 LYS 43 2HE LYS 43 -12.252 -1.719 16.807 376 HE3 LYS 43 3HE LYS 43 -12.267 -2.338 15.156 377 HZ1 LYS 43 3HZ LYS 43 -9.929 -2.042 16.956 378 HZ2 LYS 43 1HZ LYS 43 -9.782 -2.375 15.305 379 HZ3 LYS 43 2HZ LYS 43 -10.573 -3.463 16.324 380 H LYS 44 H LYS 44 -6.564 -0.544 14.817 381 HA LYS 44 HA LYS 44 -4.679 0.236 16.758 382 HB2 LYS 44 2HB LYS 44 -4.236 -1.395 14.224 383 HB3 LYS 44 3HB LYS 44 -3.117 -1.313 15.577 384 HG2 LYS 44 2HG LYS 44 -5.943 -2.415 15.786 385 HG3 LYS 44 3HG LYS 44 -4.529 -3.405 15.440 386 HD2 LYS 44 2HD LYS 44 -4.792 -3.713 17.751 387 HD3 LYS 44 3HD LYS 44 -3.575 -2.443 17.688 388 HE2 LYS 44 2HE LYS 44 -5.349 -0.756 18.143 389 HE3 LYS 44 3HE LYS 44 -6.545 -2.051 18.201 390 HZ1 LYS 44 3HZ LYS 44 -5.880 -1.446 20.407 391 HZ2 LYS 44 1HZ LYS 44 -4.249 -1.699 20.047 392 HZ3 LYS 44 2HZ LYS 44 -5.319 -3.006 20.076 393 H LEU 45 H LEU 45 -4.465 0.564 13.214 394 HA LEU 45 HA LEU 45 -2.176 2.108 12.992 395 HB2 LEU 45 2HB LEU 45 -4.592 2.064 11.136 396 HB3 LEU 45 3HB LEU 45 -2.994 2.654 10.697 397 HG LEU 45 HG LEU 45 -3.577 -0.230 11.487 398 HD11 LEU 45 1HD1 LEU 45 -4.787 0.275 9.443 399 HD12 LEU 45 2HD1 LEU 45 -3.439 -0.810 9.115 400 HD13 LEU 45 3HD1 LEU 45 -3.317 0.900 8.691 401 HD21 LEU 45 3HD2 LEU 45 -1.252 0.398 11.875 402 HD22 LEU 45 1HD2 LEU 45 -1.106 0.996 10.218 403 HD23 LEU 45 2HD2 LEU 45 -1.372 -0.724 10.523 404 H ALA 46 H ALA 46 -5.497 3.112 13.648 405 HA ALA 46 HA ALA 46 -5.098 5.925 13.293 406 HB1 ALA 46 3HB ALA 46 -7.273 4.482 14.837 407 HB2 ALA 46 1HB ALA 46 -7.333 4.911 13.125 408 HB3 ALA 46 2HB ALA 46 -7.296 6.179 14.352 409 H GLU 47 H GLU 47 -5.212 3.800 16.158 410 HA GLU 47 HA GLU 47 -4.676 5.824 18.093 411 HB2 GLU 47 2HB GLU 47 -4.322 2.802 18.299 412 HB3 GLU 47 3HB GLU 47 -4.219 3.916 19.660 413 HG2 GLU 47 2HG GLU 47 -6.676 3.314 17.986 414 HG3 GLU 47 3HG GLU 47 -6.381 2.824 19.650 415 H GLU 48 H GLU 48 -2.648 4.021 15.962 416 HA GLU 48 HA GLU 48 -0.188 4.287 17.403 417 HB2 GLU 48 2HB GLU 48 -0.805 3.548 14.525 418 HB3 GLU 48 3HB GLU 48 0.837 3.611 15.163 419 HG2 GLU 48 2HG GLU 48 0.306 1.854 16.782 420 HG3 GLU 48 3HG GLU 48 -1.369 1.822 16.230 421 H LYS 49 H LYS 49 -0.073 6.481 17.931 422 HA LYS 49 HA LYS 49 0.461 8.472 15.856 423 HB2 LYS 49 2HB LYS 49 0.968 9.979 17.778 424 HB3 LYS 49 3HB LYS 49 -0.622 9.232 17.918 425 HG2 LYS 49 2HG LYS 49 0.298 7.593 19.533 426 HG3 LYS 49 3HG LYS 49 1.885 8.360 19.402 427 HD2 LYS 49 2HD LYS 49 0.915 10.474 20.294 428 HD3 LYS 49 3HD LYS 49 -0.656 9.680 20.449 429 HE2 LYS 49 2HE LYS 49 0.513 9.752 22.615 430 HE3 LYS 49 3HE LYS 49 0.313 8.084 22.068 431 HZ1 LYS 49 3HZ LYS 49 2.787 9.714 21.845 432 HZ2 LYS 49 1HZ LYS 49 2.611 8.134 21.264 433 HZ3 LYS 49 2HZ LYS 49 2.526 8.442 22.925 434 H ASN 50 H ASN 50 2.168 6.042 17.560 435 HA ASN 50 HA ASN 50 4.812 7.058 17.526 436 HB2 ASN 50 2HB ASN 50 4.207 5.114 18.914 437 HB3 ASN 50 3HB ASN 50 3.801 4.174 17.481 438 HD21 ASN 50 1HD2 ASN 50 5.295 2.546 17.844 439 HD22 ASN 50 2HD2 ASN 50 7.005 2.773 17.772 440 H PHE 51 H PHE 51 6.405 6.910 16.016 441 HA PHE 51 HA PHE 51 5.748 6.554 13.250 442 HB2 PHE 51 2HB PHE 51 7.387 8.261 14.076 443 HB3 PHE 51 3HB PHE 51 8.464 6.966 14.580 444 HD1 PHE 51 HD2 PHE 51 6.756 8.386 11.572 445 HD2 PHE 51 HD1 PHE 51 10.068 6.095 13.039 446 HE1 PHE 51 HE2 PHE 51 7.759 8.376 9.331 447 HE2 PHE 51 HE1 PHE 51 11.055 6.095 10.792 448 HZ PHE 51 HZ PHE 51 9.905 7.235 8.943 449 H GLU 52 H GLU 52 5.615 4.581 12.318 450 HA GLU 52 HA GLU 52 7.790 2.699 12.593 451 HB2 GLU 52 2HB GLU 52 6.253 2.022 14.458 452 HB3 GLU 52 3HB GLU 52 4.967 1.769 13.282 453 HG2 GLU 52 2HG GLU 52 6.083 -0.347 13.996 454 HG3 GLU 52 3HG GLU 52 6.171 -0.072 12.255 455 H LYS 53 H LYS 53 7.980 1.330 10.914 456 HA LYS 53 HA LYS 53 6.722 2.108 8.403 457 HB2 LYS 53 2HB LYS 53 9.003 0.139 8.748 458 HB3 LYS 53 3HB LYS 53 8.661 1.195 7.382 459 HG2 LYS 53 2HG LYS 53 9.370 3.144 8.691 460 HG3 LYS 53 3HG LYS 53 9.639 2.126 10.102 461 HD2 LYS 53 2HD LYS 53 11.175 2.088 7.483 462 HD3 LYS 53 3HD LYS 53 11.772 2.603 9.063 463 HE2 LYS 53 2HE LYS 53 11.090 -0.217 8.166 464 HE3 LYS 53 3HE LYS 53 12.660 0.411 8.657 465 HZ1 LYS 53 3HZ LYS 53 11.605 -0.975 10.357 466 HZ2 LYS 53 1HZ LYS 53 10.318 0.114 10.466 467 HZ3 LYS 53 2HZ LYS 53 11.875 0.598 10.905 468 H ILE 54 H ILE 54 4.923 0.972 7.909 469 HA ILE 54 HA ILE 54 4.759 -1.933 8.462 470 HB ILE 54 HB ILE 54 2.446 0.066 8.556 471 HG12 ILE 54 2HG1 ILE 54 3.777 -1.378 10.900 472 HG13 ILE 54 3HG1 ILE 54 4.010 0.322 10.509 473 HG21 ILE 54 1HG2 ILE 54 1.747 -2.178 7.803 474 HG22 ILE 54 2HG2 ILE 54 1.096 -1.827 9.405 475 HG23 ILE 54 3HG2 ILE 54 2.487 -2.900 9.235 476 HD11 ILE 54 3HD1 ILE 54 2.459 0.074 12.335 477 HD12 ILE 54 1HD1 ILE 54 1.416 -0.966 11.362 478 HD13 ILE 54 2HD1 ILE 54 1.628 0.732 10.927 479 H LEU 55 H LEU 55 4.595 -3.049 6.620 480 HA LEU 55 HA LEU 55 3.457 -1.953 4.157 481 HB2 LEU 55 2HB LEU 55 5.487 -3.510 4.171 482 HB3 LEU 55 3HB LEU 55 4.426 -4.788 4.733 483 HG LEU 55 HG LEU 55 3.030 -4.289 2.557 484 HD11 LEU 55 1HD1 LEU 55 4.070 -2.213 1.936 485 HD12 LEU 55 2HD1 LEU 55 4.387 -3.407 0.682 486 HD13 LEU 55 3HD1 LEU 55 5.658 -2.976 1.825 487 HD21 LEU 55 3HD2 LEU 55 4.360 -5.851 1.226 488 HD22 LEU 55 1HD2 LEU 55 4.259 -6.382 2.905 489 HD23 LEU 55 2HD2 LEU 55 5.740 -5.631 2.306 490 H ILE 56 H ILE 56 1.247 -2.105 3.878 491 HA ILE 56 HA ILE 56 -0.307 -4.115 5.357 492 HB ILE 56 HB ILE 56 -1.292 -1.851 3.573 493 HG12 ILE 56 2HG1 ILE 56 -0.226 -1.005 5.674 494 HG13 ILE 56 3HG1 ILE 56 -1.952 -0.671 5.639 495 HG21 ILE 56 1HG2 ILE 56 -2.903 -3.688 3.580 496 HG22 ILE 56 2HG2 ILE 56 -3.546 -2.353 4.536 497 HG23 ILE 56 3HG2 ILE 56 -2.861 -3.763 5.341 498 HD11 ILE 56 3HD1 ILE 56 -1.225 -1.347 7.833 499 HD12 ILE 56 1HD1 ILE 56 -0.601 -2.869 7.198 500 HD13 ILE 56 2HD1 ILE 56 -2.338 -2.541 7.168 501 H LYS 57 H LYS 57 -0.652 -5.999 4.418 502 HA LYS 57 HA LYS 57 -0.515 -6.452 1.542 503 HB2 LYS 57 2HB LYS 57 0.646 -7.889 3.286 504 HB3 LYS 57 3HB LYS 57 -0.931 -8.385 3.873 505 HG2 LYS 57 2HG LYS 57 -0.048 -8.866 1.025 506 HG3 LYS 57 3HG LYS 57 0.375 -9.970 2.325 507 HD2 LYS 57 2HD LYS 57 -2.131 -10.247 2.757 508 HD3 LYS 57 3HD LYS 57 -2.411 -9.329 1.273 509 HE2 LYS 57 2HE LYS 57 -1.093 -11.041 0.018 510 HE3 LYS 57 3HE LYS 57 -0.920 -11.968 1.505 511 HZ1 LYS 57 3HZ LYS 57 -3.505 -11.297 0.220 512 HZ2 LYS 57 1HZ LYS 57 -3.281 -12.288 1.571 513 HZ3 LYS 57 2HZ LYS 57 -2.699 -12.773 0.057 514 H SER 58 H SER 58 -2.406 -6.313 0.391 515 HA SER 58 HA SER 58 -4.797 -7.636 1.341 516 HB2 SER 58 2HB SER 58 -5.076 -5.384 2.353 517 HB3 SER 58 3HB SER 58 -4.895 -4.646 0.765 518 HG SER 58 HG SER 58 -7.061 -5.929 1.889 519 H ASN 59 H ASN 59 -6.066 -8.323 -0.305 520 HA ASN 59 HA ASN 59 -5.021 -8.003 -3.046 521 HB2 ASN 59 2HB ASN 59 -6.817 -10.157 -1.834 522 HB3 ASN 59 3HB ASN 59 -6.272 -10.131 -3.509 523 HD21 ASN 59 1HD2 ASN 59 -5.242 -12.129 -3.296 524 HD22 ASN 59 2HD2 ASN 59 -3.773 -12.325 -2.420 525 H ASP 60 H ASP 60 -7.625 -7.063 -1.034 526 HA ASP 60 HA ASP 60 -9.536 -6.715 -3.252 527 HB2 ASP 60 2HB ASP 60 -10.389 -7.741 -1.142 528 HB3 ASP 60 3HB ASP 60 -9.946 -6.281 -0.261 529 H LYS 61 H LYS 61 -10.083 -4.776 -4.024 530 HA LYS 61 HA LYS 61 -8.172 -2.633 -3.684 531 HB2 LYS 61 2HB LYS 61 -10.538 -2.924 -5.592 532 HB3 LYS 61 3HB LYS 61 -9.244 -1.730 -5.732 533 HG2 LYS 61 2HG LYS 61 -7.600 -3.518 -6.036 534 HG3 LYS 61 3HG LYS 61 -8.851 -4.739 -5.831 535 HD2 LYS 61 2HD LYS 61 -9.935 -3.957 -7.923 536 HD3 LYS 61 3HD LYS 61 -8.663 -2.745 -8.130 537 HE2 LYS 61 2HE LYS 61 -6.981 -4.463 -8.416 538 HE3 LYS 61 3HE LYS 61 -8.110 -5.730 -7.944 539 HZ1 LYS 61 3HZ LYS 61 -9.381 -5.269 -9.944 540 HZ2 LYS 61 1HZ LYS 61 -7.790 -5.709 -10.307 541 HZ3 LYS 61 2HZ LYS 61 -8.268 -4.087 -10.405 542 H GLN 62 H GLN 62 -11.484 -3.236 -2.742 543 HA GLN 62 HA GLN 62 -12.338 -0.516 -2.434 544 HB2 GLN 62 2HB GLN 62 -13.434 -3.146 -1.387 545 HB3 GLN 62 3HB GLN 62 -14.208 -1.608 -1.028 546 HG2 GLN 62 2HG GLN 62 -13.722 -2.562 -3.864 547 HG3 GLN 62 3HG GLN 62 -15.178 -2.971 -2.960 548 HE21 GLN 62 1HE2 GLN 62 -16.656 -1.337 -2.436 549 HE22 GLN 62 2HE2 GLN 62 -16.650 0.202 -3.222 550 H LEU 63 H LEU 63 -10.930 -2.956 -0.301 551 HA LEU 63 HA LEU 63 -11.392 -1.823 2.206 552 HB2 LEU 63 2HB LEU 63 -9.035 -3.525 1.311 553 HB3 LEU 63 3HB LEU 63 -9.445 -3.199 2.992 554 HG LEU 63 HG LEU 63 -11.148 -4.743 1.004 555 HD11 LEU 63 1HD1 LEU 63 -10.693 -6.700 2.356 556 HD12 LEU 63 2HD1 LEU 63 -9.676 -5.752 3.440 557 HD13 LEU 63 3HD1 LEU 63 -9.189 -5.998 1.762 558 HD21 LEU 63 3HD2 LEU 63 -12.649 -5.222 2.908 559 HD22 LEU 63 1HD2 LEU 63 -12.604 -3.508 2.501 560 HD23 LEU 63 2HD2 LEU 63 -11.724 -4.102 3.913 561 H LEU 64 H LEU 64 -8.764 -1.180 -0.063 562 HA LEU 64 HA LEU 64 -7.166 0.383 1.731 563 HB2 LEU 64 2HB LEU 64 -7.078 -0.001 -1.278 564 HB3 LEU 64 3HB LEU 64 -5.975 1.079 -0.442 565 HG LEU 64 HG LEU 64 -5.169 -0.884 0.939 566 HD11 LEU 64 1HD1 LEU 64 -6.785 -2.548 -0.999 567 HD12 LEU 64 2HD1 LEU 64 -7.073 -2.375 0.733 568 HD13 LEU 64 3HD1 LEU 64 -5.607 -3.159 0.163 569 HD21 LEU 64 3HD2 LEU 64 -3.762 -1.860 -0.794 570 HD22 LEU 64 1HD2 LEU 64 -3.887 -0.111 -0.975 571 HD23 LEU 64 2HD2 LEU 64 -4.804 -1.173 -2.045 572 H LYS 65 H LYS 65 -9.734 1.115 -0.566 573 HA LYS 65 HA LYS 65 -9.484 3.940 -0.623 574 HB2 LYS 65 2HB LYS 65 -11.962 2.199 -0.953 575 HB3 LYS 65 3HB LYS 65 -11.838 3.893 -1.422 576 HG2 LYS 65 2HG LYS 65 -10.263 3.378 -3.173 577 HG3 LYS 65 3HG LYS 65 -10.094 1.712 -2.610 578 HD2 LYS 65 2HD LYS 65 -11.532 1.828 -4.612 579 HD3 LYS 65 3HD LYS 65 -12.432 1.240 -3.213 580 HE2 LYS 65 2HE LYS 65 -13.338 3.573 -2.909 581 HE3 LYS 65 3HE LYS 65 -12.534 4.030 -4.413 582 HZ1 LYS 65 3HZ LYS 65 -14.825 3.508 -4.811 583 HZ2 LYS 65 1HZ LYS 65 -14.658 1.981 -4.101 584 HZ3 LYS 65 2HZ LYS 65 -13.860 2.336 -5.551 585 H GLU 66 H GLU 66 -11.501 1.740 1.321 586 HA GLU 66 HA GLU 66 -12.819 3.616 2.947 587 HB2 GLU 66 2HB GLU 66 -12.072 0.796 3.823 588 HB3 GLU 66 3HB GLU 66 -13.445 1.754 4.369 589 HG2 GLU 66 2HG GLU 66 -13.058 0.405 1.685 590 HG3 GLU 66 3HG GLU 66 -14.256 0.030 2.915 591 H MET 67 H MET 67 -9.752 1.992 3.235 592 HA MET 67 HA MET 67 -9.002 2.601 5.875 593 HB2 MET 67 2HB MET 67 -7.956 0.865 4.383 594 HB3 MET 67 3HB MET 67 -7.231 2.152 3.433 595 HG2 MET 67 2HG MET 67 -6.028 2.877 5.533 596 HG3 MET 67 3HG MET 67 -6.621 1.410 6.292 597 HE1 MET 67 3HE MET 67 -4.915 -1.323 3.992 598 HE2 MET 67 1HE MET 67 -6.523 -0.626 3.820 599 HE3 MET 67 2HE MET 67 -5.926 -1.089 5.415 600 H LEU 68 H LEU 68 -8.306 4.227 2.759 601 HA LEU 68 HA LEU 68 -6.591 6.240 3.817 602 HB2 LEU 68 2HB LEU 68 -8.031 6.011 1.153 603 HB3 LEU 68 3HB LEU 68 -6.920 7.323 1.526 604 HG LEU 68 HG LEU 68 -6.174 4.370 1.446 605 HD11 LEU 68 1HD1 LEU 68 -4.923 4.907 -0.581 606 HD12 LEU 68 2HD1 LEU 68 -5.522 6.569 -0.530 607 HD13 LEU 68 3HD1 LEU 68 -6.644 5.228 -0.787 608 HD21 LEU 68 3HD2 LEU 68 -4.795 5.568 3.068 609 HD22 LEU 68 1HD2 LEU 68 -4.410 6.806 1.867 610 HD23 LEU 68 2HD2 LEU 68 -3.843 5.148 1.647 611 H GLU 69 H GLU 69 -10.054 6.049 3.598 612 HA GLU 69 HA GLU 69 -10.606 8.857 3.841 613 HB2 GLU 69 2HB GLU 69 -12.328 6.432 4.509 614 HB3 GLU 69 3HB GLU 69 -12.910 8.101 4.476 615 HG2 GLU 69 2HG GLU 69 -12.316 8.252 2.074 616 HG3 GLU 69 3HG GLU 69 -11.771 6.572 2.111 617 H LEU 70 H LEU 70 -9.948 6.237 6.063 618 HA LEU 70 HA LEU 70 -10.524 7.749 8.475 619 HB2 LEU 70 2HB LEU 70 -9.128 5.069 8.130 620 HB3 LEU 70 3HB LEU 70 -9.736 5.731 9.644 621 HG LEU 70 HG LEU 70 -11.444 4.878 7.265 622 HD11 LEU 70 1HD1 LEU 70 -10.454 2.967 8.411 623 HD12 LEU 70 2HD1 LEU 70 -12.193 3.032 8.673 624 HD13 LEU 70 3HD1 LEU 70 -11.091 3.537 9.957 625 HD21 LEU 70 3HD2 LEU 70 -12.326 5.883 9.994 626 HD22 LEU 70 1HD2 LEU 70 -13.385 5.252 8.727 627 HD23 LEU 70 2HD2 LEU 70 -12.488 6.743 8.461 628 H ILE 71 H ILE 71 -7.707 6.789 6.555 629 HA ILE 71 HA ILE 71 -5.658 7.714 8.303 630 HB ILE 71 HB ILE 71 -5.620 7.176 5.300 631 HG12 ILE 71 2HG1 ILE 71 -4.583 5.545 7.666 632 HG13 ILE 71 3HG1 ILE 71 -5.975 5.154 6.663 633 HG21 ILE 71 1HG2 ILE 71 -3.220 7.765 7.075 634 HG22 ILE 71 2HG2 ILE 71 -3.846 8.809 5.796 635 HG23 ILE 71 3HG2 ILE 71 -3.150 7.243 5.389 636 HD11 ILE 71 3HD1 ILE 71 -3.083 5.166 5.783 637 HD12 ILE 71 1HD1 ILE 71 -4.468 4.828 4.738 638 HD13 ILE 71 2HD1 ILE 71 -4.098 3.756 6.087 639 H SER 72 H SER 72 -7.715 9.275 5.949 640 HA SER 72 HA SER 72 -6.423 11.670 5.433 641 HB2 SER 72 2HB SER 72 -8.552 10.907 4.365 642 HB3 SER 72 3HB SER 72 -9.411 11.250 5.867 643 HG SER 72 HG SER 72 -8.191 13.040 4.066 644 H LYS 73 H LYS 73 -8.207 10.674 8.305 645 HA LYS 73 HA LYS 73 -8.282 13.238 9.613 646 HB2 LYS 73 2HB LYS 73 -8.676 10.442 10.765 647 HB3 LYS 73 3HB LYS 73 -9.130 11.954 11.550 648 HG2 LYS 73 2HG LYS 73 -10.337 10.843 8.992 649 HG3 LYS 73 3HG LYS 73 -11.072 10.789 10.598 650 HD2 LYS 73 2HD LYS 73 -11.043 13.325 10.607 651 HD3 LYS 73 3HD LYS 73 -10.501 13.276 8.927 652 HE2 LYS 73 2HE LYS 73 -12.923 13.641 9.032 653 HE3 LYS 73 3HE LYS 73 -12.584 12.063 8.316 654 HZ1 LYS 73 3HZ LYS 73 -14.385 11.988 9.947 655 HZ2 LYS 73 1HZ LYS 73 -13.333 12.524 11.155 656 HZ3 LYS 73 2HZ LYS 73 -13.083 11.022 10.421 657 H LEU 74 H LEU 74 -6.031 10.605 9.412 658 HA LEU 74 HA LEU 74 -4.624 11.155 11.899 659 HB2 LEU 74 2HB LEU 74 -3.942 9.202 9.667 660 HB3 LEU 74 3HB LEU 74 -3.287 9.193 11.300 661 HG LEU 74 HG LEU 74 -6.207 8.669 10.596 662 HD11 LEU 74 1HD1 LEU 74 -5.791 6.322 11.139 663 HD12 LEU 74 2HD1 LEU 74 -4.073 6.663 11.377 664 HD13 LEU 74 3HD1 LEU 74 -4.801 6.854 9.780 665 HD21 LEU 74 3HD2 LEU 74 -6.449 7.959 12.942 666 HD22 LEU 74 1HD2 LEU 74 -5.983 9.653 12.821 667 HD23 LEU 74 2HD2 LEU 74 -4.782 8.438 13.272 668 H GLY 75 H GLY 75 -3.893 11.319 8.402 669 HA2 GLY 75 2HA GLY 75 -2.716 12.853 7.188 670 HA3 GLY 75 3HA GLY 75 -2.490 13.789 8.654 671 H TYR 76 H TYR 76 -1.335 10.768 7.112 672 HA TYR 76 HA TYR 76 1.439 11.672 7.458 673 HB2 TYR 76 2HB TYR 76 2.185 9.380 8.152 674 HB3 TYR 76 3HB TYR 76 1.192 10.176 9.357 675 HD1 TYR 76 HD2 TYR 76 1.259 7.423 6.859 676 HD2 TYR 76 HD1 TYR 76 -0.960 9.254 10.023 677 HE1 TYR 76 HE2 TYR 76 -0.182 5.444 6.999 678 HE2 TYR 76 HE1 TYR 76 -2.386 7.269 10.162 679 HH TYR 76 HH TYR 76 -3.093 5.396 8.725 680 H LYS 77 H LYS 77 2.941 10.468 6.082 681 HA LYS 77 HA LYS 77 2.008 10.470 3.391 682 HB2 LYS 77 2HB LYS 77 4.267 11.270 4.079 683 HB3 LYS 77 3HB LYS 77 4.696 9.638 4.551 684 HG2 LYS 77 2HG LYS 77 5.735 9.948 2.460 685 HG3 LYS 77 3HG LYS 77 4.312 8.963 2.107 686 HD2 LYS 77 2HD LYS 77 3.112 11.031 1.377 687 HD3 LYS 77 3HD LYS 77 4.583 11.959 1.680 688 HE2 LYS 77 2HE LYS 77 5.767 10.630 -0.038 689 HE3 LYS 77 3HE LYS 77 4.290 9.712 -0.340 690 HZ1 LYS 77 3HZ LYS 77 3.219 11.749 -1.058 691 HZ2 LYS 77 1HZ LYS 77 4.609 11.458 -1.977 692 HZ3 LYS 77 2HZ LYS 77 4.621 12.636 -0.760 693 H VAL 78 H VAL 78 0.924 8.809 2.533 694 HA VAL 78 HA VAL 78 1.626 6.001 3.150 695 HB VAL 78 HB VAL 78 -0.969 7.094 1.963 696 HG11 VAL 78 1HG1 VAL 78 -0.297 4.267 2.867 697 HG12 VAL 78 2HG1 VAL 78 -0.498 4.793 1.195 698 HG13 VAL 78 3HG1 VAL 78 -1.876 4.817 2.297 699 HG21 VAL 78 3HG2 VAL 78 -0.431 6.062 4.769 700 HG22 VAL 78 1HG2 VAL 78 -2.008 6.546 4.135 701 HG23 VAL 78 2HG2 VAL 78 -0.726 7.743 4.325 702 H PHE 79 H PHE 79 2.184 4.650 1.495 703 HA PHE 79 HA PHE 79 2.456 5.740 -1.248 704 HB2 PHE 79 2HB PHE 79 4.142 3.606 0.142 705 HB3 PHE 79 3HB PHE 79 4.403 4.239 -1.475 706 HD1 PHE 79 HD2 PHE 79 4.750 4.939 2.141 707 HD2 PHE 79 HD1 PHE 79 5.496 6.412 -1.818 708 HE1 PHE 79 HE2 PHE 79 6.309 6.604 3.039 709 HE2 PHE 79 HE1 PHE 79 7.048 8.069 -0.899 710 HZ PHE 79 HZ PHE 79 7.463 8.166 1.524 711 H LEU 80 H LEU 80 0.809 4.805 -2.416 712 HA LEU 80 HA LEU 80 0.019 2.015 -1.961 713 HB2 LEU 80 2HB LEU 80 -1.843 3.543 -1.831 714 HB3 LEU 80 3HB LEU 80 -1.391 4.317 -3.340 715 HG LEU 80 HG LEU 80 -2.119 2.390 -4.651 716 HD11 LEU 80 1HD1 LEU 80 -1.408 0.569 -3.194 717 HD12 LEU 80 2HD1 LEU 80 -3.085 0.366 -3.687 718 HD13 LEU 80 3HD1 LEU 80 -2.709 0.940 -2.060 719 HD21 LEU 80 3HD2 LEU 80 -4.224 3.042 -2.570 720 HD22 LEU 80 1HD2 LEU 80 -4.517 2.337 -4.164 721 HD23 LEU 80 2HD2 LEU 80 -3.873 3.971 -4.028 722 H LEU 81 H LEU 81 0.664 0.529 -3.338 723 HA LEU 81 HA LEU 81 1.410 1.232 -6.105 724 HB2 LEU 81 2HB LEU 81 3.210 0.143 -4.762 725 HB3 LEU 81 3HB LEU 81 2.167 -1.244 -4.508 726 HG LEU 81 HG LEU 81 2.182 -1.724 -6.953 727 HD11 LEU 81 1HD1 LEU 81 3.732 -0.515 -8.456 728 HD12 LEU 81 2HD1 LEU 81 4.053 0.654 -7.172 729 HD13 LEU 81 3HD1 LEU 81 2.431 0.511 -7.855 730 HD21 LEU 81 3HD2 LEU 81 4.966 -1.448 -5.788 731 HD22 LEU 81 1HD2 LEU 81 4.493 -2.487 -7.137 732 HD23 LEU 81 2HD2 LEU 81 3.852 -2.795 -5.526 733 H LEU 82 H LEU 82 0.058 0.627 -7.612 734 HA LEU 82 HA LEU 82 -1.926 -1.521 -7.188 735 HB2 LEU 82 2HB LEU 82 -1.829 0.752 -9.214 736 HB3 LEU 82 3HB LEU 82 -3.093 -0.462 -9.127 737 HG LEU 82 HG LEU 82 -2.496 1.612 -6.983 738 HD11 LEU 82 1HD1 LEU 82 -3.444 2.615 -8.997 739 HD12 LEU 82 2HD1 LEU 82 -4.584 2.669 -7.655 740 HD13 LEU 82 3HD1 LEU 82 -4.799 1.480 -8.945 741 HD21 LEU 82 3HD2 LEU 82 -4.740 -0.438 -7.111 742 HD22 LEU 82 1HD2 LEU 82 -4.581 0.846 -5.907 743 HD23 LEU 82 2HD2 LEU 82 -3.384 -0.443 -5.981 744 H ALA 83 H ALA 83 -1.340 -3.421 -8.118 745 HA ALA 83 HA ALA 83 0.090 -3.399 -10.714 746 HB1 ALA 83 3HB ALA 83 1.469 -5.311 -9.984 747 HB2 ALA 83 1HB ALA 83 0.737 -5.235 -8.379 748 HB3 ALA 83 2HB ALA 83 1.738 -3.903 -8.954 749 H ASP 84 H ASP 84 -1.325 -4.207 -12.120 750 HA ASP 84 HA ASP 84 -2.793 -6.711 -11.546 751 HB2 ASP 84 2HB ASP 84 -4.253 -4.630 -11.034 752 HB3 ASP 84 3HB ASP 84 -4.168 -4.245 -12.740 753 H GLN 85 H GLN 85 -3.678 -7.587 -13.621 754 HA GLN 85 HA GLN 85 -1.762 -7.448 -15.749 755 HB2 GLN 85 2HB GLN 85 -3.597 -8.990 -16.915 756 HB3 GLN 85 3HB GLN 85 -2.548 -9.593 -15.656 757 HG2 GLN 85 2HG GLN 85 -4.537 -10.498 -14.973 758 HG3 GLN 85 3HG GLN 85 -4.571 -9.004 -14.063 759 HE21 GLN 85 1HE2 GLN 85 -5.510 -7.277 -16.210 760 HE22 GLN 85 2HE2 GLN 85 -7.114 -7.748 -16.562 761 H ASP 86 H ASP 86 -4.270 -5.413 -14.982 762 HA ASP 86 HA ASP 86 -4.332 -4.263 -17.704 763 HB2 ASP 86 2HB ASP 86 -6.482 -5.427 -17.349 764 HB3 ASP 86 3HB ASP 86 -6.718 -4.582 -15.824 765 H GLU 87 H GLU 87 -3.505 -2.336 -17.640 766 HA GLU 87 HA GLU 87 -3.041 -0.795 -15.229 767 HB2 GLU 87 2HB GLU 87 -1.708 0.685 -16.612 768 HB3 GLU 87 3HB GLU 87 -1.329 -0.962 -17.066 769 HG2 GLU 87 2HG GLU 87 -3.108 0.940 -18.630 770 HG3 GLU 87 3HG GLU 87 -1.433 0.554 -19.010 771 H ASN 88 H ASN 88 -5.432 -0.845 -17.691 772 HA ASN 88 HA ASN 88 -6.070 1.910 -17.916 773 HB2 ASN 88 2HB ASN 88 -6.693 0.315 -19.663 774 HB3 ASN 88 3HB ASN 88 -7.705 -0.585 -18.536 775 HD21 ASN 88 1HD2 ASN 88 -7.403 2.419 -20.341 776 HD22 ASN 88 2HD2 ASN 88 -9.076 2.841 -20.273 777 H GLU 89 H GLU 89 -7.609 -0.713 -16.051 778 HA GLU 89 HA GLU 89 -9.509 0.868 -14.663 779 HB2 GLU 89 2HB GLU 89 -9.757 -1.580 -14.880 780 HB3 GLU 89 3HB GLU 89 -8.299 -1.826 -13.924 781 HG2 GLU 89 2HG GLU 89 -9.437 -0.754 -11.970 782 HG3 GLU 89 3HG GLU 89 -10.905 -0.609 -12.937 783 H LEU 90 H LEU 90 -6.178 -0.134 -13.938 784 HA LEU 90 HA LEU 90 -6.059 0.724 -11.238 785 HB2 LEU 90 2HB LEU 90 -3.813 0.502 -13.264 786 HB3 LEU 90 3HB LEU 90 -3.580 0.730 -11.536 787 HG LEU 90 HG LEU 90 -4.713 -1.716 -12.918 788 HD11 LEU 90 1HD1 LEU 90 -2.306 -1.511 -13.115 789 HD12 LEU 90 2HD1 LEU 90 -2.712 -2.823 -12.014 790 HD13 LEU 90 3HD1 LEU 90 -2.147 -1.283 -11.370 791 HD21 LEU 90 3HD2 LEU 90 -4.476 -1.174 -9.936 792 HD22 LEU 90 1HD2 LEU 90 -4.814 -2.750 -10.656 793 HD23 LEU 90 2HD2 LEU 90 -5.959 -1.430 -10.855 794 H GLU 91 H GLU 91 -5.405 2.425 -14.297 795 HA GLU 91 HA GLU 91 -4.262 4.749 -13.091 796 HB2 GLU 91 2HB GLU 91 -3.832 4.098 -15.458 797 HB3 GLU 91 3HB GLU 91 -5.495 4.514 -15.864 798 HG2 GLU 91 2HG GLU 91 -5.125 6.846 -15.432 799 HG3 GLU 91 3HG GLU 91 -3.587 6.530 -14.628 800 H GLU 92 H GLU 92 -7.475 3.850 -14.190 801 HA GLU 92 HA GLU 92 -8.917 6.215 -13.688 802 HB2 GLU 92 2HB GLU 92 -9.511 3.903 -14.894 803 HB3 GLU 92 3HB GLU 92 -10.082 3.427 -13.305 804 HG2 GLU 92 2HG GLU 92 -11.106 5.718 -14.995 805 HG3 GLU 92 3HG GLU 92 -11.908 4.173 -14.755 806 H PHE 93 H PHE 93 -8.046 3.480 -11.670 807 HA PHE 93 HA PHE 93 -9.509 4.087 -9.315 808 HB2 PHE 93 2HB PHE 93 -8.613 1.813 -9.980 809 HB3 PHE 93 3HB PHE 93 -6.996 2.378 -9.593 810 HD1 PHE 93 HD2 PHE 93 -6.353 2.799 -7.193 811 HD2 PHE 93 HD1 PHE 93 -10.155 1.136 -8.235 812 HE1 PHE 93 HE2 PHE 93 -6.644 2.026 -4.888 813 HE2 PHE 93 HE1 PHE 93 -10.435 0.368 -5.919 814 HZ PHE 93 HZ PHE 93 -8.682 0.810 -4.246 815 H LYS 94 H LYS 94 -6.107 4.674 -10.262 816 HA LYS 94 HA LYS 94 -5.315 5.624 -7.692 817 HB2 LYS 94 2HB LYS 94 -3.135 6.158 -8.708 818 HB3 LYS 94 3HB LYS 94 -3.659 4.532 -9.073 819 HG2 LYS 94 2HG LYS 94 -2.681 5.242 -11.057 820 HG3 LYS 94 3HG LYS 94 -4.399 5.457 -11.355 821 HD2 LYS 94 2HD LYS 94 -3.050 7.335 -12.240 822 HD3 LYS 94 3HD LYS 94 -4.190 7.879 -11.005 823 HE2 LYS 94 2HE LYS 94 -2.380 7.946 -9.345 824 HE3 LYS 94 3HE LYS 94 -1.243 7.320 -10.540 825 HZ1 LYS 94 3HZ LYS 94 -2.671 9.906 -10.700 826 HZ2 LYS 94 1HZ LYS 94 -1.607 9.297 -11.861 827 HZ3 LYS 94 2HZ LYS 94 -1.041 9.689 -10.320 828 H ARG 95 H ARG 95 -6.836 7.119 -10.384 829 HA ARG 95 HA ARG 95 -6.115 9.821 -9.938 830 HB2 ARG 95 2HB ARG 95 -8.553 8.531 -11.208 831 HB3 ARG 95 3HB ARG 95 -8.350 10.284 -11.146 832 HG2 ARG 95 2HG ARG 95 -6.370 8.378 -12.432 833 HG3 ARG 95 3HG ARG 95 -7.635 9.233 -13.312 834 HD2 ARG 95 2HD ARG 95 -5.422 10.588 -11.719 835 HD3 ARG 95 3HD ARG 95 -5.390 10.320 -13.466 836 HE ARG 95 HE ARG 95 -7.702 11.619 -13.206 837 HH11 ARG 95 1HH1 ARG 95 -4.545 12.416 -11.890 838 HH12 ARG 95 2HH1 ARG 95 -4.853 14.123 -11.906 839 HH21 ARG 95 1HH2 ARG 95 -8.092 13.857 -13.158 840 HH22 ARG 95 2HH2 ARG 95 -6.845 14.940 -12.617 841 H LYS 96 H LYS 96 -8.678 7.789 -8.522 842 HA LYS 96 HA LYS 96 -9.920 9.721 -6.870 843 HB2 LYS 96 2HB LYS 96 -9.713 6.708 -6.766 844 HB3 LYS 96 3HB LYS 96 -10.298 7.533 -5.335 845 HG2 LYS 96 2HG LYS 96 -12.177 6.779 -6.603 846 HG3 LYS 96 3HG LYS 96 -12.118 8.541 -6.665 847 HD2 LYS 96 2HD LYS 96 -11.210 8.453 -8.951 848 HD3 LYS 96 3HD LYS 96 -11.162 6.686 -8.889 849 HE2 LYS 96 2HE LYS 96 -13.628 6.642 -8.647 850 HE3 LYS 96 3HE LYS 96 -13.662 8.406 -8.721 851 HZ1 LYS 96 3HZ LYS 96 -12.720 6.600 -10.877 852 HZ2 LYS 96 1HZ LYS 96 -12.754 8.290 -10.939 853 HZ3 LYS 96 2HZ LYS 96 -14.196 7.422 -10.833 854 H ILE 97 H ILE 97 -7.178 7.570 -6.329 855 HA ILE 97 HA ILE 97 -6.790 8.089 -3.557 856 HB ILE 97 HB ILE 97 -4.781 6.979 -5.574 857 HG12 ILE 97 2HG1 ILE 97 -6.847 5.674 -5.762 858 HG13 ILE 97 3HG1 ILE 97 -5.634 4.701 -4.946 859 HG21 ILE 97 1HG2 ILE 97 -3.784 5.796 -3.638 860 HG22 ILE 97 2HG2 ILE 97 -4.930 6.602 -2.565 861 HG23 ILE 97 3HG2 ILE 97 -3.730 7.550 -3.443 862 HD11 ILE 97 3HD1 ILE 97 -7.822 4.399 -3.962 863 HD12 ILE 97 1HD1 ILE 97 -7.951 6.128 -3.636 864 HD13 ILE 97 2HD1 ILE 97 -6.737 5.157 -2.798 865 H GLU 98 H GLU 98 -5.386 9.340 -6.506 866 HA GLU 98 HA GLU 98 -3.402 11.049 -5.373 867 HB2 GLU 98 2HB GLU 98 -3.221 10.082 -7.628 868 HB3 GLU 98 3HB GLU 98 -4.671 10.936 -8.137 869 HG2 GLU 98 2HG GLU 98 -3.488 13.093 -7.887 870 HG3 GLU 98 3HG GLU 98 -2.039 12.233 -7.349 871 H SER 99 H SER 99 -6.790 11.419 -6.319 872 HA SER 99 HA SER 99 -6.943 14.266 -6.011 873 HB2 SER 99 2HB SER 99 -8.594 13.002 -7.358 874 HB3 SER 99 3HB SER 99 -9.178 12.194 -5.904 875 HG SER 99 HG SER 99 -9.514 14.533 -5.177 876 H GLN 100 H GLN 100 -7.008 11.585 -3.804 877 HA GLN 100 HA GLN 100 -7.883 13.166 -1.501 878 HB2 GLN 100 2HB GLN 100 -6.850 10.308 -1.753 879 HB3 GLN 100 3HB GLN 100 -7.382 11.030 -0.236 880 HG2 GLN 100 2HG GLN 100 -9.652 11.221 -1.055 881 HG3 GLN 100 3HG GLN 100 -9.168 10.689 -2.666 882 HE21 GLN 100 1HE2 GLN 100 -8.676 8.484 -2.994 883 HE22 GLN 100 2HE2 GLN 100 -9.148 7.265 -1.864 884 H GLY 101 H GLY 101 -5.052 12.927 -3.247 885 HA2 GLY 101 2HA GLY 101 -3.008 13.892 -2.908 886 HA3 GLY 101 3HA GLY 101 -3.527 14.384 -1.304 887 H TYR 102 H TYR 102 -3.446 11.062 -2.530 888 HA TYR 102 HA TYR 102 -1.251 10.393 -0.651 889 HB2 TYR 102 2HB TYR 102 -3.463 8.626 -1.786 890 HB3 TYR 102 3HB TYR 102 -2.095 8.005 -0.863 891 HD1 TYR 102 HD2 TYR 102 -1.767 8.872 1.537 892 HD2 TYR 102 HD1 TYR 102 -5.399 9.434 -0.639 893 HE1 TYR 102 HE2 TYR 102 -2.961 9.286 3.636 894 HE2 TYR 102 HE1 TYR 102 -6.597 9.851 1.463 895 HH TYR 102 HH TYR 102 -4.973 10.356 4.427 896 H GLU 103 H GLU 103 0.501 9.229 -1.365 897 HA GLU 103 HA GLU 103 1.281 9.638 -4.094 898 HB2 GLU 103 2HB GLU 103 2.807 9.779 -2.030 899 HB3 GLU 103 3HB GLU 103 2.765 8.022 -1.972 900 HG2 GLU 103 2HG GLU 103 4.799 8.704 -3.078 901 HG3 GLU 103 3HG GLU 103 3.740 7.968 -4.285 902 H VAL 104 H VAL 104 0.691 8.252 -5.700 903 HA VAL 104 HA VAL 104 0.479 5.369 -5.127 904 HB VAL 104 HB VAL 104 -1.772 6.188 -4.780 905 HG11 VAL 104 1HG1 VAL 104 -1.685 7.436 -7.549 906 HG12 VAL 104 2HG1 VAL 104 -1.696 8.303 -6.011 907 HG13 VAL 104 3HG1 VAL 104 -3.103 7.353 -6.497 908 HG21 VAL 104 3HG2 VAL 104 -1.527 3.992 -5.871 909 HG22 VAL 104 1HG2 VAL 104 -1.620 4.757 -7.460 910 HG23 VAL 104 2HG2 VAL 104 -3.015 4.794 -6.378 911 H ARG 105 H ARG 105 1.438 4.181 -6.651 912 HA ARG 105 HA ARG 105 1.832 5.274 -9.389 913 HB2 ARG 105 2HB ARG 105 3.548 3.266 -7.870 914 HB3 ARG 105 3HB ARG 105 3.799 3.701 -9.556 915 HG2 ARG 105 2HG ARG 105 4.009 5.655 -7.227 916 HG3 ARG 105 3HG ARG 105 5.371 4.800 -7.947 917 HD2 ARG 105 2HD ARG 105 5.359 7.007 -8.874 918 HD3 ARG 105 3HD ARG 105 4.797 5.918 -10.144 919 HE ARG 105 HE ARG 105 2.588 6.948 -8.722 920 HH11 ARG 105 1HH1 ARG 105 4.994 8.113 -11.010 921 HH12 ARG 105 2HH1 ARG 105 3.937 9.333 -11.641 922 HH21 ARG 105 1HH2 ARG 105 1.239 8.470 -9.612 923 HH22 ARG 105 2HH2 ARG 105 1.812 9.538 -10.855 924 H LYS 106 H LYS 106 1.337 4.028 -11.100 925 HA LYS 106 HA LYS 106 -0.217 1.545 -10.699 926 HB2 LYS 106 2HB LYS 106 -1.685 3.186 -11.613 927 HB3 LYS 106 3HB LYS 106 -0.450 3.857 -12.660 928 HG2 LYS 106 2HG LYS 106 -1.298 1.042 -13.231 929 HG3 LYS 106 3HG LYS 106 -2.487 2.299 -13.558 930 HD2 LYS 106 2HD LYS 106 0.339 2.230 -14.716 931 HD3 LYS 106 3HD LYS 106 -1.111 1.692 -15.564 932 HE2 LYS 106 2HE LYS 106 -2.033 3.977 -15.436 933 HE3 LYS 106 3HE LYS 106 -0.588 4.518 -14.583 934 HZ1 LYS 106 3HZ LYS 106 -0.601 3.389 -17.330 935 HZ2 LYS 106 1HZ LYS 106 0.722 4.056 -16.516 936 HZ3 LYS 106 2HZ LYS 106 -0.580 5.041 -16.963 937 H VAL 107 H VAL 107 0.700 -0.270 -11.459 938 HA VAL 107 HA VAL 107 2.582 -0.250 -13.733 939 HB VAL 107 HB VAL 107 4.171 -1.769 -12.593 940 HG11 VAL 107 1HG1 VAL 107 4.659 0.639 -12.453 941 HG12 VAL 107 2HG1 VAL 107 5.236 -0.202 -11.014 942 HG13 VAL 107 3HG1 VAL 107 3.750 0.752 -10.943 943 HG21 VAL 107 3HG2 VAL 107 2.646 -2.893 -11.043 944 HG22 VAL 107 1HG2 VAL 107 2.461 -1.408 -10.107 945 HG23 VAL 107 2HG2 VAL 107 4.021 -2.230 -10.160 946 H THR 108 H THR 108 2.886 -2.463 -14.620 947 HA THR 108 HA THR 108 0.668 -4.346 -14.047 948 HB THR 108 HB THR 108 0.815 -4.886 -16.601 949 HG1 THR 108 HG1 THR 108 1.844 -3.486 -17.862 950 HG21 THR 108 3HG2 THR 108 -0.766 -3.092 -17.204 951 HG22 THR 108 1HG2 THR 108 -0.353 -2.225 -15.720 952 HG23 THR 108 2HG2 THR 108 -1.157 -3.797 -15.633 953 H ASP 109 H ASP 109 4.015 -3.986 -14.173 954 HA ASP 109 HA ASP 109 4.485 -6.802 -14.987 955 HB2 ASP 109 2HB ASP 109 5.557 -5.126 -16.449 956 HB3 ASP 109 3HB ASP 109 6.374 -4.409 -15.068 957 H ASP 110 H ASP 110 6.140 -7.984 -13.855 958 HA ASP 110 HA ASP 110 5.740 -8.012 -11.051 959 HB2 ASP 110 2HB ASP 110 6.053 -10.082 -12.293 960 HB3 ASP 110 3HB ASP 110 7.623 -9.559 -12.876 961 H GLU 111 H GLU 111 8.792 -7.531 -12.955 962 HA GLU 111 HA GLU 111 10.316 -6.898 -10.605 963 HB2 GLU 111 2HB GLU 111 12.221 -6.491 -12.034 964 HB3 GLU 111 3HB GLU 111 11.386 -7.923 -12.618 965 HG2 GLU 111 2HG GLU 111 10.425 -6.675 -14.467 966 HG3 GLU 111 3HG GLU 111 11.093 -5.166 -13.846 967 H GLU 112 H GLU 112 8.527 -5.067 -12.963 968 HA GLU 112 HA GLU 112 9.430 -2.463 -12.417 969 HB2 GLU 112 2HB GLU 112 7.943 -3.101 -14.331 970 HB3 GLU 112 3HB GLU 112 6.625 -3.364 -13.200 971 HG2 GLU 112 2HG GLU 112 6.322 -1.216 -14.273 972 HG3 GLU 112 3HG GLU 112 6.707 -0.958 -12.571 973 H ALA 113 H ALA 113 6.809 -4.413 -10.951 974 HA ALA 113 HA ALA 113 5.859 -2.467 -9.132 975 HB1 ALA 113 3HB ALA 113 5.675 -5.499 -8.946 976 HB2 ALA 113 1HB ALA 113 4.534 -4.439 -9.779 977 HB3 ALA 113 2HB ALA 113 4.704 -4.346 -8.025 978 H LEU 114 H LEU 114 8.121 -5.199 -8.672 979 HA LEU 114 HA LEU 114 8.753 -4.951 -5.962 980 HB2 LEU 114 2HB LEU 114 10.591 -5.771 -8.245 981 HB3 LEU 114 3HB LEU 114 10.894 -6.103 -6.544 982 HG LEU 114 HG LEU 114 8.523 -7.208 -8.094 983 HD11 LEU 114 1HD1 LEU 114 9.724 -9.327 -8.183 984 HD12 LEU 114 2HD1 LEU 114 11.138 -8.586 -7.431 985 HD13 LEU 114 3HD1 LEU 114 10.611 -8.066 -9.034 986 HD21 LEU 114 3HD2 LEU 114 8.284 -8.732 -6.184 987 HD22 LEU 114 1HD2 LEU 114 8.128 -7.051 -5.681 988 HD23 LEU 114 2HD2 LEU 114 9.625 -7.933 -5.357 989 H LYS 115 H LYS 115 10.105 -3.322 -8.763 990 HA LYS 115 HA LYS 115 12.274 -1.958 -7.625 991 HB2 LYS 115 2HB LYS 115 11.934 -2.367 -10.019 992 HB3 LYS 115 3HB LYS 115 10.491 -1.364 -10.001 993 HG2 LYS 115 2HG LYS 115 12.106 0.559 -9.294 994 HG3 LYS 115 3HG LYS 115 13.386 -0.522 -9.866 995 HD2 LYS 115 2HD LYS 115 10.999 0.435 -11.488 996 HD3 LYS 115 3HD LYS 115 12.649 1.050 -11.640 997 HE2 LYS 115 2HE LYS 115 13.403 -1.133 -12.467 998 HE3 LYS 115 3HE LYS 115 11.795 -1.815 -12.206 999 HZ1 LYS 115 3HZ LYS 115 12.438 0.384 -14.093 1000 HZ2 LYS 115 1HZ LYS 115 10.909 -0.305 -13.848 1001 HZ3 LYS 115 2HZ LYS 115 12.162 -1.230 -14.516 1002 H ILE 116 H ILE 116 8.886 -1.001 -8.233 1003 HA ILE 116 HA ILE 116 9.127 1.674 -7.292 1004 HB ILE 116 HB ILE 116 6.589 0.014 -7.630 1005 HG12 ILE 116 2HG1 ILE 116 7.808 0.095 -9.755 1006 HG13 ILE 116 3HG1 ILE 116 6.388 1.112 -9.871 1007 HG21 ILE 116 1HG2 ILE 116 5.420 2.188 -7.846 1008 HG22 ILE 116 2HG2 ILE 116 6.931 3.030 -7.492 1009 HG23 ILE 116 3HG2 ILE 116 6.182 2.008 -6.263 1010 HD11 ILE 116 3HD1 ILE 116 8.289 2.096 -10.971 1011 HD12 ILE 116 1HD1 ILE 116 9.226 2.049 -9.480 1012 HD13 ILE 116 2HD1 ILE 116 7.803 3.090 -9.599 1013 H VAL 117 H VAL 117 8.224 -1.378 -5.712 1014 HA VAL 117 HA VAL 117 7.298 -0.439 -3.220 1015 HB VAL 117 HB VAL 117 8.873 -2.976 -3.875 1016 HG11 VAL 117 1HG1 VAL 117 7.374 -2.331 -1.307 1017 HG12 VAL 117 2HG1 VAL 117 9.123 -2.508 -1.471 1018 HG13 VAL 117 3HG1 VAL 117 8.069 -3.903 -1.713 1019 HG21 VAL 117 3HG2 VAL 117 6.676 -4.109 -3.784 1020 HG22 VAL 117 1HG2 VAL 117 6.693 -2.840 -5.011 1021 HG23 VAL 117 2HG2 VAL 117 5.890 -2.561 -3.466 1022 H ARG 118 H ARG 118 10.566 -1.182 -4.352 1023 HA ARG 118 HA ARG 118 11.942 -0.557 -1.939 1024 HB2 ARG 118 2HB ARG 118 12.948 -0.795 -4.801 1025 HB3 ARG 118 3HB ARG 118 13.994 -0.660 -3.384 1026 HG2 ARG 118 2HG ARG 118 13.132 -2.773 -2.497 1027 HG3 ARG 118 3HG ARG 118 11.998 -2.910 -3.846 1028 HD2 ARG 118 2HD ARG 118 15.019 -2.870 -4.128 1029 HD3 ARG 118 3HD ARG 118 14.041 -4.338 -4.081 1030 HE ARG 118 HE ARG 118 12.898 -3.282 -6.132 1031 HH11 ARG 118 1HH1 ARG 118 16.332 -2.971 -5.400 1032 HH12 ARG 118 2HH1 ARG 118 16.788 -2.785 -7.056 1033 HH21 ARG 118 1HH2 ARG 118 13.546 -3.059 -8.310 1034 HH22 ARG 118 2HH2 ARG 118 15.215 -2.838 -8.691 1035 H GLU 119 H GLU 119 11.127 1.288 -4.836 1036 HA GLU 119 HA GLU 119 12.569 3.654 -4.174 1037 HB2 GLU 119 2HB GLU 119 10.213 3.170 -6.028 1038 HB3 GLU 119 3HB GLU 119 11.015 4.730 -5.866 1039 HG2 GLU 119 2HG GLU 119 13.143 3.685 -6.608 1040 HG3 GLU 119 3HG GLU 119 12.292 2.156 -6.830 1041 H PHE 120 H PHE 120 9.278 2.536 -3.483 1042 HA PHE 120 HA PHE 120 8.319 4.816 -2.153 1043 HB2 PHE 120 2HB PHE 120 7.615 1.877 -1.957 1044 HB3 PHE 120 3HB PHE 120 6.848 3.052 -0.895 1045 HD1 PHE 120 HD2 PHE 120 7.010 5.159 -3.461 1046 HD2 PHE 120 HD1 PHE 120 5.256 1.327 -2.667 1047 HE1 PHE 120 HE2 PHE 120 5.240 5.625 -5.093 1048 HE2 PHE 120 HE1 PHE 120 3.496 1.824 -4.293 1049 HZ PHE 120 HZ PHE 120 3.478 3.952 -5.506 1050 H MET 121 H MET 121 10.304 2.111 -1.044 1051 HA MET 121 HA MET 121 10.189 2.780 1.731 1052 HB2 MET 121 2HB MET 121 11.962 0.859 0.208 1053 HB3 MET 121 3HB MET 121 12.069 1.074 1.954 1054 HG2 MET 121 2HG MET 121 9.629 0.469 2.098 1055 HG3 MET 121 3HG MET 121 9.687 0.048 0.387 1056 HE1 MET 121 3HE MET 121 12.129 -2.991 0.380 1057 HE2 MET 121 1HE MET 121 12.508 -1.299 0.054 1058 HE3 MET 121 2HE MET 121 11.020 -2.007 -0.581 1059 H GLN 122 H GLN 122 12.381 3.781 -0.882 1060 HA GLN 122 HA GLN 122 14.343 4.889 0.954 1061 HB2 GLN 122 2HB GLN 122 15.499 5.786 -1.009 1062 HB3 GLN 122 3HB GLN 122 15.081 4.096 -1.264 1063 HG2 GLN 122 2HG GLN 122 13.184 4.777 -2.675 1064 HG3 GLN 122 3HG GLN 122 13.592 6.470 -2.426 1065 HE21 GLN 122 1HE2 GLN 122 15.965 3.907 -3.001 1066 HE22 GLN 122 2HE2 GLN 122 16.445 4.477 -4.557 1067 H LYS 123 H LYS 123 11.575 6.149 -0.915 1068 HA LYS 123 HA LYS 123 11.838 8.877 -0.074 1069 HB2 LYS 123 2HB LYS 123 9.590 7.272 -1.304 1070 HB3 LYS 123 3HB LYS 123 9.196 8.816 -0.568 1071 HG2 LYS 123 2HG LYS 123 9.486 9.186 -2.909 1072 HG3 LYS 123 3HG LYS 123 10.855 9.921 -2.068 1073 HD2 LYS 123 2HD LYS 123 12.247 7.934 -2.656 1074 HD3 LYS 123 3HD LYS 123 10.871 7.255 -3.531 1075 HE2 LYS 123 2HE LYS 123 10.902 9.198 -5.062 1076 HE3 LYS 123 3HE LYS 123 12.296 9.851 -4.193 1077 HZ1 LYS 123 3HZ LYS 123 12.975 8.686 -6.174 1078 HZ2 LYS 123 1HZ LYS 123 12.206 7.272 -5.655 1079 HZ3 LYS 123 2HZ LYS 123 13.540 7.872 -4.804 1080 H ALA 124 H ALA 124 10.462 6.006 1.317 1081 HA ALA 124 HA ALA 124 9.083 7.288 3.495 1082 HB1 ALA 124 3HB ALA 124 9.901 4.385 3.136 1083 HB2 ALA 124 1HB ALA 124 8.378 5.101 2.602 1084 HB3 ALA 124 2HB ALA 124 8.750 5.009 4.320 1085 H GLY 125 H GLY 125 12.320 5.972 2.926 1086 HA2 GLY 125 2HA GLY 125 13.307 5.990 5.584 1087 HA3 GLY 125 3HA GLY 125 14.272 6.099 4.126 1088 H SER 126 H SER 126 12.720 8.505 3.281 1089 HA SER 126 HA SER 126 14.277 10.594 4.457 1090 HB2 SER 126 2HB SER 126 13.553 10.596 2.067 1091 HB3 SER 126 3HB SER 126 11.873 10.741 2.575 1092 HG SER 126 HG SER 126 13.895 12.615 3.239 1093 H LEU 127 H LEU 127 11.222 9.126 5.197 1094 HA LEU 127 HA LEU 127 10.002 11.373 6.570 1095 HB2 LEU 127 2HB LEU 127 9.213 8.435 6.585 1096 HB3 LEU 127 3HB LEU 127 8.225 9.773 7.159 1097 HG LEU 127 HG LEU 127 9.077 9.363 4.266 1098 HD11 LEU 127 1HD1 LEU 127 6.767 8.701 3.839 1099 HD12 LEU 127 2HD1 LEU 127 6.396 8.816 5.561 1100 HD13 LEU 127 3HD1 LEU 127 7.545 7.608 4.981 1101 HD21 LEU 127 3HD2 LEU 127 8.713 11.737 4.798 1102 HD22 LEU 127 1HD2 LEU 127 7.118 11.363 5.459 1103 HD23 LEU 127 2HD2 LEU 127 7.445 11.130 3.739 1104 H GLU 128 H GLU 128 12.269 8.887 7.415 1105 HA GLU 128 HA GLU 128 11.893 8.759 10.218 1106 HB2 GLU 128 2HB GLU 128 13.352 7.191 8.965 1107 HB3 GLU 128 3HB GLU 128 14.483 8.499 8.632 1108 HG2 GLU 128 2HG GLU 128 14.997 8.704 11.026 1109 HG3 GLU 128 3HG GLU 128 13.787 7.479 11.408 1110 H HIS 129 H HIS 129 13.353 11.113 8.119 1111 HA HIS 129 HA HIS 129 14.314 12.891 10.215 1112 HB2 HIS 129 2HB HIS 129 13.814 13.522 7.258 1113 HB3 HIS 129 3HB HIS 129 14.864 14.400 8.374 1114 HD1 HIS 129 HD1 HIS 129 15.059 12.054 5.728 1115 HD2 HIS 129 HD2 HIS 129 17.050 12.497 9.348 1116 HE1 HIS 129 HE1 HIS 129 17.128 10.646 5.539 1117 HE2 HIS 129 HE2 HIS 129 18.223 10.801 7.795 1118 H HIS 130 H HIS 130 13.200 14.718 10.961 1119 HA HIS 130 HA HIS 130 10.448 14.485 11.312 1120 HB2 HIS 130 2HB HIS 130 10.534 16.744 12.353 1121 HB3 HIS 130 3HB HIS 130 11.805 15.683 12.928 1122 HD1 HIS 130 HD1 HIS 130 11.232 18.901 11.149 1123 HD2 HIS 130 HD2 HIS 130 14.436 16.483 12.183 1124 HE1 HIS 130 HE1 HIS 130 13.268 20.315 10.821 1125 HE2 HIS 130 HE2 HIS 130 15.183 18.878 11.601 1126 H HIS 131 H HIS 131 9.033 14.522 9.678 1127 HA HIS 131 HA HIS 131 9.385 16.283 7.361 1128 HB2 HIS 131 2HB HIS 131 8.938 13.797 7.079 1129 HB3 HIS 131 3HB HIS 131 7.342 14.044 7.780 1130 HD1 HIS 131 HD1 HIS 131 9.239 14.307 4.623 1131 HD2 HIS 131 HD2 HIS 131 5.575 15.615 6.085 1132 HE1 HIS 131 HE1 HIS 131 7.901 14.976 2.608 1133 HE2 HIS 131 HE2 HIS 131 5.749 15.887 3.531 1134 H HIS 132 H HIS 132 8.443 18.222 7.470 1135 HA HIS 132 HA HIS 132 6.370 18.933 9.324 1136 HB2 HIS 132 2HB HIS 132 8.099 20.565 8.720 1137 HB3 HIS 132 3HB HIS 132 7.650 20.479 7.024 1138 HD1 HIS 132 HD1 HIS 132 5.624 21.867 6.260 1139 HD2 HIS 132 HD2 HIS 132 6.320 22.079 10.351 1140 HE1 HIS 132 HE1 HIS 132 4.165 23.723 7.103 1141 HE2 HIS 132 HE2 HIS 132 4.453 23.685 9.600 1142 H HIS 133 H HIS 133 4.282 18.530 8.997 1143 HA HIS 133 HA HIS 133 3.073 18.962 6.323 1144 HB2 HIS 133 2HB HIS 133 1.312 17.410 6.862 1145 HB3 HIS 133 3HB HIS 133 2.811 16.591 7.262 1146 HD1 HIS 133 HD1 HIS 133 3.194 15.976 9.737 1147 HD2 HIS 133 HD2 HIS 133 -0.344 18.044 9.100 1148 HE1 HIS 133 HE1 HIS 133 1.845 15.677 11.827 1149 HE2 HIS 133 HE2 HIS 133 -0.225 17.050 11.469 1150 H HIS 134 H HIS 134 0.952 20.033 6.397 1151 HA HIS 134 HA HIS 134 0.814 22.237 8.226 1152 HB2 HIS 134 2HB HIS 134 0.012 22.442 5.883 1153 HB3 HIS 134 3HB HIS 134 -1.260 21.267 6.200 1154 HD1 HIS 134 HD1 HIS 134 -3.045 22.063 8.132 1155 HD2 HIS 134 HD2 HIS 134 -0.736 25.039 6.378 1156 HE1 HIS 134 HE1 HIS 134 -4.200 24.223 8.680 1157 HE2 HIS 134 HE2 HIS 134 -2.872 25.985 7.463 Start of MODEL 10 1 H1 MET 1 1H MET 1 3.212 10.960 13.576 2 H2 MET 1 2H MET 1 4.389 12.127 13.245 3 H3 MET 1 3H MET 1 4.836 10.644 13.915 4 HA MET 1 HA MET 1 3.593 10.966 11.260 5 HB2 MET 1 2HB MET 1 5.829 12.012 11.286 6 HB3 MET 1 3HB MET 1 6.531 10.563 11.997 7 HG2 MET 1 2HG MET 1 6.986 10.811 9.558 8 HG3 MET 1 3HG MET 1 6.150 9.309 9.970 9 HE1 MET 1 3HE MET 1 6.243 10.157 6.982 10 HE2 MET 1 1HE MET 1 4.556 9.955 6.513 11 HE3 MET 1 2HE MET 1 5.316 8.782 7.585 12 H LYS 2 H LYS 2 3.565 8.999 10.039 13 HA LYS 2 HA LYS 2 4.415 6.482 11.160 14 HB2 LYS 2 2HB LYS 2 2.294 6.843 12.380 15 HB3 LYS 2 3HB LYS 2 1.439 7.125 10.870 16 HG2 LYS 2 2HG LYS 2 1.619 4.822 10.233 17 HG3 LYS 2 3HG LYS 2 2.774 4.482 11.530 18 HD2 LYS 2 2HD LYS 2 1.035 4.889 13.226 19 HD3 LYS 2 3HD LYS 2 -0.125 5.327 11.968 20 HE2 LYS 2 2HE LYS 2 -0.371 3.114 11.242 21 HE3 LYS 2 3HE LYS 2 1.178 2.606 11.922 22 HZ1 LYS 2 3HZ LYS 2 0.274 2.733 14.118 23 HZ2 LYS 2 1HZ LYS 2 -0.760 1.788 13.177 24 HZ3 LYS 2 2HZ LYS 2 -1.184 3.381 13.561 25 H ILE 3 H ILE 3 4.775 5.036 9.466 26 HA ILE 3 HA ILE 3 4.205 6.054 6.735 27 HB ILE 3 HB ILE 3 6.457 4.199 7.653 28 HG12 ILE 3 2HG1 ILE 3 6.580 7.112 6.732 29 HG13 ILE 3 3HG1 ILE 3 6.772 6.558 8.391 30 HG21 ILE 3 1HG2 ILE 3 5.734 3.666 5.353 31 HG22 ILE 3 2HG2 ILE 3 7.337 4.398 5.346 32 HG23 ILE 3 3HG2 ILE 3 5.930 5.356 4.884 33 HD11 ILE 3 3HD1 ILE 3 8.789 5.335 7.732 34 HD12 ILE 3 1HD1 ILE 3 8.901 7.067 7.427 35 HD13 ILE 3 2HD1 ILE 3 8.610 5.959 6.088 36 H LEU 4 H LEU 4 2.724 4.942 5.637 37 HA LEU 4 HA LEU 4 2.523 1.996 5.950 38 HB2 LEU 4 2HB LEU 4 0.390 4.092 5.446 39 HB3 LEU 4 3HB LEU 4 0.174 2.483 4.782 40 HG LEU 4 HG LEU 4 0.265 1.522 7.079 41 HD11 LEU 4 1HD1 LEU 4 0.038 2.973 9.049 42 HD12 LEU 4 2HD1 LEU 4 0.344 4.393 8.043 43 HD13 LEU 4 3HD1 LEU 4 1.597 3.168 8.254 44 HD21 LEU 4 3HD2 LEU 4 -1.965 2.293 7.763 45 HD22 LEU 4 1HD2 LEU 4 -1.875 2.010 6.027 46 HD23 LEU 4 2HD2 LEU 4 -1.840 3.660 6.657 47 H ILE 5 H ILE 5 2.787 0.808 4.108 48 HA ILE 5 HA ILE 5 2.611 2.154 1.472 49 HB ILE 5 HB ILE 5 4.419 -0.245 2.118 50 HG12 ILE 5 2HG1 ILE 5 5.154 2.666 1.548 51 HG13 ILE 5 3HG1 ILE 5 5.404 1.802 3.058 52 HG21 ILE 5 1HG2 ILE 5 5.229 -0.007 -0.218 53 HG22 ILE 5 2HG2 ILE 5 4.078 1.302 -0.491 54 HG23 ILE 5 3HG2 ILE 5 3.494 -0.335 -0.178 55 HD11 ILE 5 3HD1 ILE 5 7.475 2.056 1.861 56 HD12 ILE 5 1HD1 ILE 5 6.800 1.255 0.443 57 HD13 ILE 5 2HD1 ILE 5 7.037 0.351 1.942 58 H LEU 6 H LEU 6 0.741 1.523 0.626 59 HA LEU 6 HA LEU 6 -0.555 -0.985 1.370 60 HB2 LEU 6 2HB LEU 6 -1.487 1.205 -0.541 61 HB3 LEU 6 3HB LEU 6 -2.458 -0.135 0.042 62 HG LEU 6 HG LEU 6 -1.421 2.171 1.717 63 HD11 LEU 6 1HD1 LEU 6 -4.237 1.533 0.770 64 HD12 LEU 6 2HD1 LEU 6 -3.211 2.854 0.199 65 HD13 LEU 6 3HD1 LEU 6 -3.784 2.845 1.863 66 HD21 LEU 6 3HD2 LEU 6 -2.806 1.275 3.530 67 HD22 LEU 6 1HD2 LEU 6 -1.535 0.147 3.065 68 HD23 LEU 6 2HD2 LEU 6 -3.197 -0.139 2.543 69 H ILE 7 H ILE 7 -0.724 -2.684 0.039 70 HA ILE 7 HA ILE 7 0.284 -2.560 -2.744 71 HB ILE 7 HB ILE 7 0.752 -4.861 -0.765 72 HG12 ILE 7 2HG1 ILE 7 2.284 -2.951 -0.335 73 HG13 ILE 7 3HG1 ILE 7 3.160 -4.355 -0.929 74 HG21 ILE 7 1HG2 ILE 7 2.071 -5.923 -2.587 75 HG22 ILE 7 2HG2 ILE 7 1.587 -4.629 -3.686 76 HG23 ILE 7 3HG2 ILE 7 0.373 -5.726 -3.026 77 HD11 ILE 7 3HD1 ILE 7 4.013 -2.296 -1.891 78 HD12 ILE 7 1HD1 ILE 7 2.422 -1.913 -2.546 79 HD13 ILE 7 2HD1 ILE 7 3.311 -3.314 -3.147 80 H ASN 8 H ASN 8 -1.442 -2.887 -3.979 81 HA ASN 8 HA ASN 8 -3.209 -5.191 -3.399 82 HB2 ASN 8 2HB ASN 8 -4.500 -3.101 -3.066 83 HB3 ASN 8 3HB ASN 8 -4.050 -2.548 -4.674 84 HD21 ASN 8 1HD2 ASN 8 -5.957 -4.890 -2.876 85 HD22 ASN 8 2HD2 ASN 8 -6.999 -5.326 -4.182 86 H THR 9 H THR 9 -2.287 -6.620 -4.702 87 HA THR 9 HA THR 9 -2.303 -6.041 -7.576 88 HB THR 9 HB THR 9 0.036 -6.062 -6.988 89 HG1 THR 9 HG1 THR 9 0.562 -8.161 -8.195 90 HG21 THR 9 3HG2 THR 9 -0.020 -7.335 -4.895 91 HG22 THR 9 1HG2 THR 9 1.149 -8.027 -6.022 92 HG23 THR 9 2HG2 THR 9 -0.415 -8.807 -5.787 93 H ASN 10 H ASN 10 -2.932 -7.680 -8.905 94 HA ASN 10 HA ASN 10 -4.918 -9.410 -7.761 95 HB2 ASN 10 2HB ASN 10 -5.123 -8.175 -9.980 96 HB3 ASN 10 3HB ASN 10 -3.988 -9.335 -10.660 97 HD21 ASN 10 1HD2 ASN 10 -5.557 -10.017 -12.165 98 HD22 ASN 10 2HD2 ASN 10 -6.891 -11.016 -11.709 99 H ASN 11 H ASN 11 -1.562 -9.833 -8.639 100 HA ASN 11 HA ASN 11 -1.795 -12.752 -8.166 101 HB2 ASN 11 2HB ASN 11 0.409 -13.051 -9.211 102 HB3 ASN 11 3HB ASN 11 -0.711 -12.274 -10.319 103 HD21 ASN 11 1HD2 ASN 11 2.266 -12.337 -10.125 104 HD22 ASN 11 2HD2 ASN 11 2.739 -10.680 -10.212 105 H ASP 12 H ASP 12 -1.383 -13.356 -6.161 106 HA ASP 12 HA ASP 12 -0.155 -11.708 -4.174 107 HB2 ASP 12 2HB ASP 12 -1.915 -13.314 -3.588 108 HB3 ASP 12 3HB ASP 12 -0.910 -14.662 -4.107 109 H GLU 13 H GLU 13 1.124 -13.978 -6.444 110 HA GLU 13 HA GLU 13 3.499 -14.843 -5.268 111 HB2 GLU 13 2HB GLU 13 3.166 -14.021 -8.187 112 HB3 GLU 13 3HB GLU 13 4.374 -15.126 -7.546 113 HG2 GLU 13 2HG GLU 13 1.394 -15.583 -7.720 114 HG3 GLU 13 3HG GLU 13 2.642 -16.374 -8.677 115 H LEU 14 H LEU 14 2.731 -11.797 -6.872 116 HA LEU 14 HA LEU 14 5.297 -10.607 -6.825 117 HB2 LEU 14 2HB LEU 14 3.539 -9.800 -8.279 118 HB3 LEU 14 3HB LEU 14 2.488 -9.449 -6.917 119 HG LEU 14 HG LEU 14 3.839 -7.546 -6.263 120 HD11 LEU 14 1HD1 LEU 14 6.080 -8.367 -6.700 121 HD12 LEU 14 2HD1 LEU 14 5.842 -6.824 -7.511 122 HD13 LEU 14 3HD1 LEU 14 5.797 -8.323 -8.440 123 HD21 LEU 14 3HD2 LEU 14 2.167 -7.197 -8.038 124 HD22 LEU 14 1HD2 LEU 14 3.398 -7.501 -9.267 125 HD23 LEU 14 2HD2 LEU 14 3.528 -6.095 -8.206 126 H ILE 15 H ILE 15 2.566 -10.478 -4.493 127 HA ILE 15 HA ILE 15 3.664 -8.624 -2.678 128 HB ILE 15 HB ILE 15 1.794 -10.939 -1.971 129 HG12 ILE 15 2HG1 ILE 15 1.073 -8.095 -2.807 130 HG13 ILE 15 3HG1 ILE 15 0.970 -9.499 -3.859 131 HG21 ILE 15 1HG2 ILE 15 2.285 -8.292 -0.537 132 HG22 ILE 15 2HG2 ILE 15 2.785 -9.889 0.027 133 HG23 ILE 15 3HG2 ILE 15 1.072 -9.492 -0.085 134 HD11 ILE 15 3HD1 ILE 15 -1.199 -8.898 -3.031 135 HD12 ILE 15 1HD1 ILE 15 -0.638 -9.027 -1.364 136 HD13 ILE 15 2HD1 ILE 15 -0.722 -10.467 -2.380 137 H LYS 16 H LYS 16 3.978 -12.153 -2.896 138 HA LYS 16 HA LYS 16 5.313 -12.600 -0.452 139 HB2 LYS 16 2HB LYS 16 5.328 -14.246 -3.017 140 HB3 LYS 16 3HB LYS 16 6.023 -14.797 -1.493 141 HG2 LYS 16 2HG LYS 16 3.734 -14.443 -0.450 142 HG3 LYS 16 3HG LYS 16 3.109 -14.186 -2.066 143 HD2 LYS 16 2HD LYS 16 4.569 -16.732 -1.294 144 HD3 LYS 16 3HD LYS 16 2.842 -16.531 -1.023 145 HE2 LYS 16 2HE LYS 16 3.070 -17.719 -3.060 146 HE3 LYS 16 3HE LYS 16 2.609 -16.079 -3.507 147 HZ1 LYS 16 3HZ LYS 16 4.988 -15.656 -4.002 148 HZ2 LYS 16 1HZ LYS 16 4.323 -16.885 -4.954 149 HZ3 LYS 16 2HZ LYS 16 5.329 -17.275 -3.660 150 H LYS 17 H LYS 17 6.560 -11.540 -3.582 151 HA LYS 17 HA LYS 17 9.339 -11.633 -2.796 152 HB2 LYS 17 2HB LYS 17 7.927 -10.139 -5.037 153 HB3 LYS 17 3HB LYS 17 9.676 -10.184 -4.826 154 HG2 LYS 17 2HG LYS 17 9.649 -12.643 -5.123 155 HG3 LYS 17 3HG LYS 17 7.902 -12.589 -5.383 156 HD2 LYS 17 2HD LYS 17 9.912 -11.084 -7.078 157 HD3 LYS 17 3HD LYS 17 9.280 -12.672 -7.495 158 HE2 LYS 17 2HE LYS 17 7.545 -10.221 -7.092 159 HE3 LYS 17 3HE LYS 17 8.171 -10.743 -8.655 160 HZ1 LYS 17 3HZ LYS 17 5.916 -11.525 -8.239 161 HZ2 LYS 17 1HZ LYS 17 6.459 -12.406 -6.902 162 HZ3 LYS 17 2HZ LYS 17 7.000 -12.799 -8.451 163 H ILE 18 H ILE 18 6.830 -9.086 -2.965 164 HA ILE 18 HA ILE 18 8.404 -6.834 -2.362 165 HB ILE 18 HB ILE 18 5.416 -7.306 -1.915 166 HG12 ILE 18 2HG1 ILE 18 6.915 -5.878 -4.166 167 HG13 ILE 18 3HG1 ILE 18 6.129 -7.448 -4.286 168 HG21 ILE 18 1HG2 ILE 18 6.897 -4.647 -1.841 169 HG22 ILE 18 2HG2 ILE 18 6.159 -5.456 -0.459 170 HG23 ILE 18 3HG2 ILE 18 5.144 -4.850 -1.766 171 HD11 ILE 18 3HD1 ILE 18 3.958 -6.371 -3.900 172 HD12 ILE 18 1HD1 ILE 18 4.790 -5.748 -5.325 173 HD13 ILE 18 2HD1 ILE 18 4.766 -4.800 -3.839 174 H LYS 19 H LYS 19 6.835 -9.189 -0.285 175 HA LYS 19 HA LYS 19 7.086 -8.022 2.249 176 HB2 LYS 19 2HB LYS 19 7.278 -10.950 1.396 177 HB3 LYS 19 3HB LYS 19 7.188 -10.435 3.079 178 HG2 LYS 19 2HG LYS 19 4.961 -9.559 2.779 179 HG3 LYS 19 3HG LYS 19 5.060 -9.768 1.030 180 HD2 LYS 19 2HD LYS 19 3.694 -11.547 1.964 181 HD3 LYS 19 3HD LYS 19 5.195 -12.227 1.341 182 HE2 LYS 19 2HE LYS 19 4.641 -13.269 3.467 183 HE3 LYS 19 3HE LYS 19 6.096 -12.291 3.659 184 HZ1 LYS 19 3HZ LYS 19 4.820 -10.594 4.728 185 HZ2 LYS 19 1HZ LYS 19 4.472 -12.060 5.488 186 HZ3 LYS 19 2HZ LYS 19 3.361 -11.387 4.403 187 H LYS 20 H LYS 20 9.328 -10.130 0.439 188 HA LYS 20 HA LYS 20 11.357 -10.222 2.429 189 HB2 LYS 20 2HB LYS 20 11.832 -10.704 -0.541 190 HB3 LYS 20 3HB LYS 20 12.723 -11.380 0.816 191 HG2 LYS 20 2HG LYS 20 9.924 -12.074 -0.079 192 HG3 LYS 20 3HG LYS 20 11.348 -13.114 -0.110 193 HD2 LYS 20 2HD LYS 20 11.373 -13.170 2.367 194 HD3 LYS 20 3HD LYS 20 9.983 -12.079 2.416 195 HE2 LYS 20 2HE LYS 20 9.241 -14.369 2.786 196 HE3 LYS 20 3HE LYS 20 8.625 -13.805 1.233 197 HZ1 LYS 20 3HZ LYS 20 9.465 -16.035 1.057 198 HZ2 LYS 20 1HZ LYS 20 10.975 -15.570 1.649 199 HZ3 LYS 20 2HZ LYS 20 10.442 -15.001 0.153 200 H GLU 21 H GLU 21 10.807 -8.135 -0.359 201 HA GLU 21 HA GLU 21 13.177 -6.651 -0.433 202 HB2 GLU 21 2HB GLU 21 10.339 -5.644 -0.955 203 HB3 GLU 21 3HB GLU 21 11.813 -4.849 -1.486 204 HG2 GLU 21 2HG GLU 21 10.849 -7.565 -2.401 205 HG3 GLU 21 3HG GLU 21 10.676 -6.067 -3.307 206 H VAL 22 H VAL 22 10.172 -6.017 1.418 207 HA VAL 22 HA VAL 22 11.242 -3.627 2.628 208 HB VAL 22 HB VAL 22 9.121 -3.390 3.763 209 HG11 VAL 22 1HG1 VAL 22 7.590 -3.300 1.840 210 HG12 VAL 22 2HG1 VAL 22 8.688 -4.321 0.906 211 HG13 VAL 22 3HG1 VAL 22 9.199 -2.712 1.419 212 HG21 VAL 22 3HG2 VAL 22 8.719 -5.685 4.481 213 HG22 VAL 22 1HG2 VAL 22 8.412 -6.183 2.815 214 HG23 VAL 22 2HG2 VAL 22 7.312 -5.062 3.622 215 H GLU 23 H GLU 23 11.282 -6.996 3.523 216 HA GLU 23 HA GLU 23 11.588 -6.787 6.320 217 HB2 GLU 23 2HB GLU 23 12.845 -8.839 4.453 218 HB3 GLU 23 3HB GLU 23 12.824 -8.970 6.208 219 HG2 GLU 23 2HG GLU 23 10.489 -9.129 4.305 220 HG3 GLU 23 3HG GLU 23 11.100 -10.381 5.368 221 H ASN 24 H ASN 24 13.879 -6.310 3.706 222 HA ASN 24 HA ASN 24 16.302 -6.199 5.121 223 HB2 ASN 24 2HB ASN 24 15.457 -4.704 2.597 224 HB3 ASN 24 3HB ASN 24 17.103 -4.718 3.210 225 HD21 ASN 24 1HD2 ASN 24 14.613 -6.640 1.708 226 HD22 ASN 24 2HD2 ASN 24 15.643 -7.930 1.216 227 H GLN 25 H GLN 25 13.717 -3.877 4.910 228 HA GLN 25 HA GLN 25 15.331 -1.787 6.254 229 HB2 GLN 25 2HB GLN 25 12.924 -1.582 4.413 230 HB3 GLN 25 3HB GLN 25 13.546 -0.223 5.333 231 HG2 GLN 25 2HG GLN 25 15.088 -1.766 3.234 232 HG3 GLN 25 3HG GLN 25 14.340 -0.191 3.003 233 HE21 GLN 25 1HE2 GLN 25 17.003 -1.910 4.468 234 HE22 GLN 25 2HE2 GLN 25 17.934 -0.516 4.877 235 H GLY 26 H GLY 26 13.280 -4.129 7.122 236 HA2 GLY 26 2HA GLY 26 12.445 -4.559 9.214 237 HA3 GLY 26 3HA GLY 26 12.974 -2.963 9.714 238 H TYR 27 H TYR 27 10.675 -3.651 7.080 239 HA TYR 27 HA TYR 27 8.576 -2.112 8.366 240 HB2 TYR 27 2HB TYR 27 8.667 -3.696 5.772 241 HB3 TYR 27 3HB TYR 27 7.193 -2.926 6.350 242 HD1 TYR 27 HD1 TYR 27 10.746 -2.158 5.417 243 HD2 TYR 27 HD2 TYR 27 6.753 -0.675 5.761 244 HE1 TYR 27 HE1 TYR 27 11.408 -0.105 4.248 245 HE2 TYR 27 HE2 TYR 27 7.420 1.381 4.593 246 HH TYR 27 HH TYR 27 10.317 1.653 2.890 247 H GLN 28 H GLN 28 6.488 -2.948 8.812 248 HA GLN 28 HA GLN 28 6.384 -5.718 9.856 249 HB2 GLN 28 2HB GLN 28 6.051 -3.976 11.552 250 HB3 GLN 28 3HB GLN 28 4.890 -3.132 10.537 251 HG2 GLN 28 2HG GLN 28 3.302 -5.011 10.800 252 HG3 GLN 28 3HG GLN 28 4.458 -5.836 11.844 253 HE21 GLN 28 1HE2 GLN 28 3.918 -2.335 11.941 254 HE22 GLN 28 2HE2 GLN 28 3.157 -2.316 13.488 255 H VAL 29 H VAL 29 5.307 -7.073 8.449 256 HA VAL 29 HA VAL 29 3.496 -5.948 6.438 257 HB VAL 29 HB VAL 29 4.426 -8.858 6.689 258 HG11 VAL 29 1HG1 VAL 29 3.680 -9.059 4.338 259 HG12 VAL 29 2HG1 VAL 29 3.106 -7.390 4.366 260 HG13 VAL 29 3HG1 VAL 29 2.340 -8.604 5.393 261 HG21 VAL 29 3HG2 VAL 29 6.051 -8.323 4.905 262 HG22 VAL 29 1HG2 VAL 29 6.350 -7.348 6.345 263 HG23 VAL 29 2HG2 VAL 29 5.556 -6.629 4.942 264 H ARG 30 H ARG 30 1.385 -5.940 6.650 265 HA ARG 30 HA ARG 30 -0.041 -7.887 8.363 266 HB2 ARG 30 2HB ARG 30 -0.118 -5.867 9.634 267 HB3 ARG 30 3HB ARG 30 -0.292 -4.865 8.201 268 HG2 ARG 30 2HG ARG 30 -2.351 -4.896 9.522 269 HG3 ARG 30 3HG ARG 30 -2.607 -5.589 7.924 270 HD2 ARG 30 2HD ARG 30 -2.485 -7.876 8.934 271 HD3 ARG 30 3HD ARG 30 -2.316 -7.131 10.532 272 HE ARG 30 HE ARG 30 -4.564 -6.008 9.490 273 HH11 ARG 30 1HH1 ARG 30 -3.639 -9.363 10.065 274 HH12 ARG 30 2HH1 ARG 30 -5.279 -9.874 10.323 275 HH21 ARG 30 1HH2 ARG 30 -6.678 -6.707 9.924 276 HH22 ARG 30 2HH2 ARG 30 -6.970 -8.389 10.246 277 H ASP 31 H ASP 31 -1.339 -9.081 7.113 278 HA ASP 31 HA ASP 31 -2.296 -8.037 4.526 279 HB2 ASP 31 2HB ASP 31 -2.797 -10.442 3.988 280 HB3 ASP 31 3HB ASP 31 -1.099 -10.082 4.238 281 H VAL 32 H VAL 32 -4.235 -7.332 4.388 282 HA VAL 32 HA VAL 32 -6.359 -7.875 6.295 283 HB VAL 32 HB VAL 32 -6.392 -6.082 3.813 284 HG11 VAL 32 1HG1 VAL 32 -8.242 -6.126 6.221 285 HG12 VAL 32 2HG1 VAL 32 -8.638 -6.681 4.594 286 HG13 VAL 32 3HG1 VAL 32 -8.314 -4.972 4.884 287 HG21 VAL 32 3HG2 VAL 32 -5.966 -4.179 5.343 288 HG22 VAL 32 1HG2 VAL 32 -4.626 -5.327 5.336 289 HG23 VAL 32 2HG2 VAL 32 -5.761 -5.306 6.686 290 H ASN 33 H ASN 33 -7.583 -9.617 5.981 291 HA ASN 33 HA ASN 33 -7.767 -10.956 3.387 292 HB2 ASN 33 2HB ASN 33 -8.910 -11.879 6.051 293 HB3 ASN 33 3HB ASN 33 -8.608 -12.865 4.624 294 HD21 ASN 33 1HD2 ASN 33 -5.928 -11.666 4.145 295 HD22 ASN 33 2HD2 ASN 33 -4.913 -12.303 5.383 296 H ASP 34 H ASP 34 -9.714 -8.912 5.381 297 HA ASP 34 HA ASP 34 -12.051 -9.052 3.702 298 HB2 ASP 34 2HB ASP 34 -12.268 -11.144 5.101 299 HB3 ASP 34 3HB ASP 34 -12.273 -10.149 6.547 300 H SER 35 H SER 35 -13.883 -7.642 4.749 301 HA SER 35 HA SER 35 -12.904 -5.090 5.494 302 HB2 SER 35 2HB SER 35 -15.315 -4.528 5.878 303 HB3 SER 35 3HB SER 35 -15.047 -5.363 4.344 304 HG SER 35 HG SER 35 -15.632 -7.333 5.521 305 H ASP 36 H ASP 36 -13.925 -7.845 7.397 306 HA ASP 36 HA ASP 36 -14.086 -6.687 9.971 307 HB2 ASP 36 2HB ASP 36 -14.932 -8.960 9.493 308 HB3 ASP 36 3HB ASP 36 -13.309 -9.519 9.107 309 H GLU 37 H GLU 37 -11.461 -8.333 8.245 310 HA GLU 37 HA GLU 37 -9.371 -7.924 10.060 311 HB2 GLU 37 2HB GLU 37 -9.303 -8.198 7.026 312 HB3 GLU 37 3HB GLU 37 -7.877 -8.266 8.052 313 HG2 GLU 37 2HG GLU 37 -10.203 -10.198 8.256 314 HG3 GLU 37 3HG GLU 37 -8.744 -10.493 7.315 315 H LEU 38 H LEU 38 -10.739 -5.815 7.569 316 HA LEU 38 HA LEU 38 -8.709 -3.868 7.446 317 HB2 LEU 38 2HB LEU 38 -10.580 -4.033 5.786 318 HB3 LEU 38 3HB LEU 38 -11.694 -3.450 7.014 319 HG LEU 38 HG LEU 38 -10.285 -1.313 7.129 320 HD11 LEU 38 1HD1 LEU 38 -8.228 -2.143 6.144 321 HD12 LEU 38 2HD1 LEU 38 -8.846 -0.767 5.237 322 HD13 LEU 38 3HD1 LEU 38 -9.041 -2.399 4.595 323 HD21 LEU 38 3HD2 LEU 38 -11.306 -0.279 5.164 324 HD22 LEU 38 1HD2 LEU 38 -12.446 -1.353 5.971 325 HD23 LEU 38 2HD2 LEU 38 -11.653 -1.869 4.482 326 H LYS 39 H LYS 39 -11.790 -3.831 9.341 327 HA LYS 39 HA LYS 39 -11.137 -1.397 10.661 328 HB2 LYS 39 2HB LYS 39 -13.084 -1.881 12.151 329 HB3 LYS 39 3HB LYS 39 -13.447 -1.965 10.439 330 HG2 LYS 39 2HG LYS 39 -14.601 -3.804 11.171 331 HG3 LYS 39 3HG LYS 39 -13.059 -4.557 10.775 332 HD2 LYS 39 2HD LYS 39 -12.418 -4.443 13.184 333 HD3 LYS 39 3HD LYS 39 -13.990 -3.724 13.549 334 HE2 LYS 39 2HE LYS 39 -15.097 -5.776 12.673 335 HE3 LYS 39 3HE LYS 39 -13.506 -6.491 12.400 336 HZ1 LYS 39 3HZ LYS 39 -14.727 -5.754 15.003 337 HZ2 LYS 39 1HZ LYS 39 -13.104 -6.194 14.835 338 HZ3 LYS 39 2HZ LYS 39 -14.321 -7.298 14.456 339 H LYS 40 H LYS 40 -10.424 -4.752 11.426 340 HA LYS 40 HA LYS 40 -9.554 -4.497 14.086 341 HB2 LYS 40 2HB LYS 40 -8.665 -6.361 11.861 342 HB3 LYS 40 3HB LYS 40 -8.018 -6.493 13.485 343 HG2 LYS 40 2HG LYS 40 -11.005 -6.608 13.103 344 HG3 LYS 40 3HG LYS 40 -10.027 -8.010 12.679 345 HD2 LYS 40 2HD LYS 40 -10.849 -8.292 14.939 346 HD3 LYS 40 3HD LYS 40 -9.105 -8.052 14.997 347 HE2 LYS 40 2HE LYS 40 -9.454 -5.710 15.672 348 HE3 LYS 40 3HE LYS 40 -11.201 -5.942 15.595 349 HZ1 LYS 40 3HZ LYS 40 -10.454 -6.111 17.859 350 HZ2 LYS 40 1HZ LYS 40 -9.320 -7.298 17.458 351 HZ3 LYS 40 2HZ LYS 40 -10.970 -7.638 17.353 352 H GLU 41 H GLU 41 -7.685 -4.174 11.039 353 HA GLU 41 HA GLU 41 -5.307 -3.391 12.487 354 HB2 GLU 41 2HB GLU 41 -4.234 -3.219 10.266 355 HB3 GLU 41 3HB GLU 41 -4.969 -4.780 10.574 356 HG2 GLU 41 2HG GLU 41 -5.560 -4.470 8.383 357 HG3 GLU 41 3HG GLU 41 -6.976 -3.802 9.182 358 H MET 42 H MET 42 -7.959 -1.772 10.925 359 HA MET 42 HA MET 42 -6.799 0.806 10.654 360 HB2 MET 42 2HB MET 42 -9.654 -0.187 10.738 361 HB3 MET 42 3HB MET 42 -9.392 1.531 11.016 362 HG2 MET 42 2HG MET 42 -8.605 -0.038 8.548 363 HG3 MET 42 3HG MET 42 -9.889 1.163 8.687 364 HE1 MET 42 3HE MET 42 -7.604 4.431 9.337 365 HE2 MET 42 1HE MET 42 -8.057 3.324 10.633 366 HE3 MET 42 2HE MET 42 -9.250 3.803 9.426 367 H LYS 43 H LYS 43 -8.272 -0.857 13.401 368 HA LYS 43 HA LYS 43 -8.084 1.358 15.203 369 HB2 LYS 43 2HB LYS 43 -8.622 -1.566 15.442 370 HB3 LYS 43 3HB LYS 43 -7.849 -0.861 16.850 371 HG2 LYS 43 2HG LYS 43 -10.140 -0.785 17.335 372 HG3 LYS 43 3HG LYS 43 -9.745 0.863 16.877 373 HD2 LYS 43 2HD LYS 43 -11.003 -1.131 14.958 374 HD3 LYS 43 3HD LYS 43 -11.958 -0.096 16.014 375 HE2 LYS 43 2HE LYS 43 -10.081 0.828 13.817 376 HE3 LYS 43 3HE LYS 43 -11.838 0.851 13.772 377 HZ1 LYS 43 3HZ LYS 43 -10.188 2.410 15.685 378 HZ2 LYS 43 1HZ LYS 43 -11.869 2.474 15.516 379 HZ3 LYS 43 2HZ LYS 43 -10.872 3.020 14.267 380 H LYS 44 H LYS 44 -5.797 -1.140 14.172 381 HA LYS 44 HA LYS 44 -3.685 -0.460 15.997 382 HB2 LYS 44 2HB LYS 44 -3.458 -1.825 13.272 383 HB3 LYS 44 3HB LYS 44 -2.260 -1.872 14.556 384 HG2 LYS 44 2HG LYS 44 -5.040 -3.059 14.743 385 HG3 LYS 44 3HG LYS 44 -3.597 -3.972 14.330 386 HD2 LYS 44 2HD LYS 44 -3.798 -2.453 16.948 387 HD3 LYS 44 3HD LYS 44 -4.475 -4.070 16.774 388 HE2 LYS 44 2HE LYS 44 -2.254 -4.207 17.761 389 HE3 LYS 44 3HE LYS 44 -2.229 -4.935 16.157 390 HZ1 LYS 44 3HZ LYS 44 -1.162 -2.973 15.292 391 HZ2 LYS 44 1HZ LYS 44 -0.289 -3.534 16.623 392 HZ3 LYS 44 2HZ LYS 44 -1.287 -2.183 16.782 393 H LEU 45 H LEU 45 -4.759 0.801 12.901 394 HA LEU 45 HA LEU 45 -2.414 2.422 12.393 395 HB2 LEU 45 2HB LEU 45 -5.147 2.513 11.050 396 HB3 LEU 45 3HB LEU 45 -3.690 3.304 10.469 397 HG LEU 45 HG LEU 45 -4.168 0.312 10.606 398 HD11 LEU 45 1HD1 LEU 45 -4.148 0.376 8.160 399 HD12 LEU 45 2HD1 LEU 45 -3.976 2.132 8.200 400 HD13 LEU 45 3HD1 LEU 45 -5.439 1.374 8.827 401 HD21 LEU 45 3HD2 LEU 45 -1.712 1.767 9.599 402 HD22 LEU 45 1HD2 LEU 45 -2.016 0.032 9.466 403 HD23 LEU 45 2HD2 LEU 45 -1.816 0.771 11.052 404 H ALA 46 H ALA 46 -5.694 2.932 13.670 405 HA ALA 46 HA ALA 46 -5.418 5.846 13.575 406 HB1 ALA 46 3HB ALA 46 -7.836 4.166 14.300 407 HB2 ALA 46 1HB ALA 46 -7.472 4.817 12.700 408 HB3 ALA 46 2HB ALA 46 -7.811 5.914 14.038 409 H GLU 47 H GLU 47 -6.263 3.359 16.075 410 HA GLU 47 HA GLU 47 -6.386 5.243 18.221 411 HB2 GLU 47 2HB GLU 47 -5.745 2.299 18.644 412 HB3 GLU 47 3HB GLU 47 -6.563 3.400 19.738 413 HG2 GLU 47 2HG GLU 47 -7.651 2.120 17.234 414 HG3 GLU 47 3HG GLU 47 -8.179 1.858 18.890 415 H GLU 48 H GLU 48 -3.918 2.956 17.116 416 HA GLU 48 HA GLU 48 -1.819 4.238 18.730 417 HB2 GLU 48 2HB GLU 48 -1.809 1.726 17.001 418 HB3 GLU 48 3HB GLU 48 -0.413 2.332 17.882 419 HG2 GLU 48 2HG GLU 48 -3.019 1.509 19.185 420 HG3 GLU 48 3HG GLU 48 -1.614 0.464 19.025 421 H LYS 49 H LYS 49 -1.199 6.092 17.786 422 HA LYS 49 HA LYS 49 -0.738 6.221 14.865 423 HB2 LYS 49 2HB LYS 49 -2.271 7.892 16.112 424 HB3 LYS 49 3HB LYS 49 -0.814 8.540 16.855 425 HG2 LYS 49 2HG LYS 49 0.048 9.012 14.509 426 HG3 LYS 49 3HG LYS 49 -1.548 8.565 13.902 427 HD2 LYS 49 2HD LYS 49 -0.938 10.828 15.843 428 HD3 LYS 49 3HD LYS 49 -1.339 11.013 14.137 429 HE2 LYS 49 2HE LYS 49 -3.587 10.211 14.507 430 HE3 LYS 49 3HE LYS 49 -3.212 9.762 16.175 431 HZ1 LYS 49 3HZ LYS 49 -2.923 12.077 16.724 432 HZ2 LYS 49 1HZ LYS 49 -4.435 11.866 16.001 433 HZ3 LYS 49 2HZ LYS 49 -3.165 12.541 15.118 434 H ASN 50 H ASN 50 1.020 5.066 17.167 435 HA ASN 50 HA ASN 50 3.355 6.634 17.455 436 HB2 ASN 50 2HB ASN 50 4.461 4.584 18.261 437 HB3 ASN 50 3HB ASN 50 2.853 4.722 18.963 438 HD21 ASN 50 1HD2 ASN 50 1.229 3.245 18.290 439 HD22 ASN 50 2HD2 ASN 50 1.612 1.790 17.439 440 H PHE 51 H PHE 51 5.407 6.433 16.416 441 HA PHE 51 HA PHE 51 5.219 6.201 13.603 442 HB2 PHE 51 2HB PHE 51 6.879 7.721 14.691 443 HB3 PHE 51 3HB PHE 51 7.789 6.313 15.249 444 HD1 PHE 51 HD2 PHE 51 6.639 8.136 12.227 445 HD2 PHE 51 HD1 PHE 51 9.260 5.109 13.728 446 HE1 PHE 51 HE2 PHE 51 7.711 7.972 10.026 447 HE2 PHE 51 HE1 PHE 51 10.320 4.941 11.512 448 HZ PHE 51 HZ PHE 51 9.528 6.365 9.673 449 H GLU 52 H GLU 52 4.827 4.300 12.704 450 HA GLU 52 HA GLU 52 6.800 2.157 12.946 451 HB2 GLU 52 2HB GLU 52 5.031 0.413 13.155 452 HB3 GLU 52 3HB GLU 52 5.051 1.500 14.541 453 HG2 GLU 52 2HG GLU 52 3.147 2.764 13.489 454 HG3 GLU 52 3HG GLU 52 3.058 1.507 12.260 455 H LYS 53 H LYS 53 7.093 1.073 11.070 456 HA LYS 53 HA LYS 53 5.837 2.129 8.623 457 HB2 LYS 53 2HB LYS 53 8.379 0.489 9.032 458 HB3 LYS 53 3HB LYS 53 7.796 1.091 7.482 459 HG2 LYS 53 2HG LYS 53 8.098 3.405 8.227 460 HG3 LYS 53 3HG LYS 53 8.615 2.848 9.819 461 HD2 LYS 53 2HD LYS 53 10.067 2.229 7.216 462 HD3 LYS 53 3HD LYS 53 10.520 3.509 8.341 463 HE2 LYS 53 2HE LYS 53 10.870 1.781 10.112 464 HE3 LYS 53 3HE LYS 53 10.515 0.527 8.921 465 HZ1 LYS 53 3HZ LYS 53 12.705 2.512 8.622 466 HZ2 LYS 53 1HZ LYS 53 12.435 1.142 7.671 467 HZ3 LYS 53 2HZ LYS 53 12.923 0.970 9.280 468 H ILE 54 H ILE 54 4.178 0.919 7.896 469 HA ILE 54 HA ILE 54 4.198 -2.014 8.362 470 HB ILE 54 HB ILE 54 1.685 -0.262 8.198 471 HG12 ILE 54 2HG1 ILE 54 3.000 -1.425 10.709 472 HG13 ILE 54 3HG1 ILE 54 2.982 0.279 10.269 473 HG21 ILE 54 1HG2 ILE 54 2.046 -3.170 9.050 474 HG22 ILE 54 2HG2 ILE 54 1.364 -2.624 7.516 475 HG23 ILE 54 3HG2 ILE 54 0.518 -2.282 9.024 476 HD11 ILE 54 3HD1 ILE 54 1.340 -0.215 11.969 477 HD12 ILE 54 1HD1 ILE 54 0.559 -1.390 10.913 478 HD13 ILE 54 2HD1 ILE 54 0.558 0.323 10.484 479 H LEU 55 H LEU 55 4.440 -3.097 6.472 480 HA LEU 55 HA LEU 55 3.450 -2.076 3.928 481 HB2 LEU 55 2HB LEU 55 5.537 -3.520 4.104 482 HB3 LEU 55 3HB LEU 55 4.514 -4.859 4.607 483 HG LEU 55 HG LEU 55 3.249 -4.484 2.345 484 HD11 LEU 55 1HD1 LEU 55 5.798 -2.996 1.699 485 HD12 LEU 55 2HD1 LEU 55 4.162 -2.330 1.762 486 HD13 LEU 55 3HD1 LEU 55 4.580 -3.518 0.532 487 HD21 LEU 55 3HD2 LEU 55 4.636 -6.467 2.806 488 HD22 LEU 55 1HD2 LEU 55 6.066 -5.604 2.236 489 HD23 LEU 55 2HD2 LEU 55 4.746 -5.963 1.122 490 H ILE 56 H ILE 56 1.261 -2.074 3.788 491 HA ILE 56 HA ILE 56 -0.349 -4.244 4.910 492 HB ILE 56 HB ILE 56 -1.195 -1.729 3.398 493 HG12 ILE 56 2HG1 ILE 56 -0.218 -1.269 5.663 494 HG13 ILE 56 3HG1 ILE 56 -1.918 -0.829 5.557 495 HG21 ILE 56 1HG2 ILE 56 -2.943 -3.774 4.829 496 HG22 ILE 56 2HG2 ILE 56 -2.845 -3.526 3.085 497 HG23 ILE 56 3HG2 ILE 56 -3.496 -2.260 4.114 498 HD11 ILE 56 3HD1 ILE 56 -1.417 -1.874 7.679 499 HD12 ILE 56 1HD1 ILE 56 -0.807 -3.311 6.860 500 HD13 ILE 56 2HD1 ILE 56 -2.518 -2.889 6.749 501 H LYS 57 H LYS 57 -0.613 -6.022 3.714 502 HA LYS 57 HA LYS 57 -1.039 -5.922 0.807 503 HB2 LYS 57 2HB LYS 57 0.177 -7.876 1.433 504 HB3 LYS 57 3HB LYS 57 -0.786 -8.132 2.885 505 HG2 LYS 57 2HG LYS 57 -2.720 -8.798 1.472 506 HG3 LYS 57 3HG LYS 57 -1.726 -8.597 0.026 507 HD2 LYS 57 2HD LYS 57 -0.287 -10.419 0.677 508 HD3 LYS 57 3HD LYS 57 -1.015 -10.504 2.280 509 HE2 LYS 57 2HE LYS 57 -3.150 -11.244 1.264 510 HE3 LYS 57 3HE LYS 57 -2.402 -11.179 -0.336 511 HZ1 LYS 57 3HZ LYS 57 -0.821 -12.866 0.370 512 HZ2 LYS 57 1HZ LYS 57 -2.407 -13.424 0.545 513 HZ3 LYS 57 2HZ LYS 57 -1.533 -12.933 1.903 514 H SER 58 H SER 58 -3.106 -6.082 -0.072 515 HA SER 58 HA SER 58 -5.293 -7.199 1.498 516 HB2 SER 58 2HB SER 58 -5.461 -4.765 2.040 517 HB3 SER 58 3HB SER 58 -5.561 -4.389 0.319 518 HG SER 58 HG SER 58 -7.633 -4.659 0.582 519 H ASN 59 H ASN 59 -6.436 -8.483 0.233 520 HA ASN 59 HA ASN 59 -5.886 -8.726 -2.584 521 HB2 ASN 59 2HB ASN 59 -7.509 -10.634 -2.517 522 HB3 ASN 59 3HB ASN 59 -6.274 -10.764 -1.269 523 HD21 ASN 59 1HD2 ASN 59 -6.886 -10.453 0.925 524 HD22 ASN 59 2HD2 ASN 59 -8.539 -10.544 1.416 525 H ASP 60 H ASP 60 -8.528 -7.466 -0.610 526 HA ASP 60 HA ASP 60 -10.264 -6.911 -2.881 527 HB2 ASP 60 2HB ASP 60 -11.193 -7.626 -0.676 528 HB3 ASP 60 3HB ASP 60 -10.591 -6.140 0.048 529 H LYS 61 H LYS 61 -10.426 -5.031 -3.879 530 HA LYS 61 HA LYS 61 -8.240 -3.139 -3.588 531 HB2 LYS 61 2HB LYS 61 -10.467 -3.047 -5.673 532 HB3 LYS 61 3HB LYS 61 -8.815 -2.449 -5.821 533 HG2 LYS 61 2HG LYS 61 -7.987 -4.808 -5.727 534 HG3 LYS 61 3HG LYS 61 -9.657 -5.359 -5.651 535 HD2 LYS 61 2HD LYS 61 -8.972 -5.659 -7.908 536 HD3 LYS 61 3HD LYS 61 -10.011 -4.237 -7.917 537 HE2 LYS 61 2HE LYS 61 -8.144 -2.766 -8.166 538 HE3 LYS 61 3HE LYS 61 -6.991 -4.045 -7.772 539 HZ1 LYS 61 3HZ LYS 61 -8.715 -4.036 -10.198 540 HZ2 LYS 61 1HZ LYS 61 -7.501 -5.150 -9.825 541 HZ3 LYS 61 2HZ LYS 61 -7.099 -3.547 -10.167 542 H GLN 62 H GLN 62 -11.645 -3.215 -2.797 543 HA GLN 62 HA GLN 62 -12.082 -0.366 -2.788 544 HB2 GLN 62 2HB GLN 62 -13.703 -2.589 -1.465 545 HB3 GLN 62 3HB GLN 62 -14.227 -0.917 -1.640 546 HG2 GLN 62 2HG GLN 62 -13.676 -2.851 -3.905 547 HG3 GLN 62 3HG GLN 62 -15.264 -2.362 -3.330 548 HE21 GLN 62 1HE2 GLN 62 -12.401 -1.328 -5.053 549 HE22 GLN 62 2HE2 GLN 62 -13.108 0.057 -5.802 550 H LEU 63 H LEU 63 -11.200 -2.811 -0.393 551 HA LEU 63 HA LEU 63 -11.549 -1.474 2.005 552 HB2 LEU 63 2HB LEU 63 -9.367 -3.468 1.294 553 HB3 LEU 63 3HB LEU 63 -9.752 -2.971 2.937 554 HG LEU 63 HG LEU 63 -11.550 -4.532 1.049 555 HD11 LEU 63 1HD1 LEU 63 -9.747 -5.859 2.032 556 HD12 LEU 63 2HD1 LEU 63 -11.318 -6.355 2.654 557 HD13 LEU 63 3HD1 LEU 63 -10.249 -5.365 3.652 558 HD21 LEU 63 3HD2 LEU 63 -12.947 -3.016 2.351 559 HD22 LEU 63 1HD2 LEU 63 -12.186 -3.555 3.850 560 HD23 LEU 63 2HD2 LEU 63 -13.170 -4.673 2.902 561 H LEU 64 H LEU 64 -8.919 -1.114 -0.288 562 HA LEU 64 HA LEU 64 -7.085 0.319 1.338 563 HB2 LEU 64 2HB LEU 64 -7.437 0.229 -1.682 564 HB3 LEU 64 3HB LEU 64 -6.175 1.164 -0.907 565 HG LEU 64 HG LEU 64 -5.407 -1.056 0.181 566 HD11 LEU 64 1HD1 LEU 64 -7.366 -2.407 -0.281 567 HD12 LEU 64 2HD1 LEU 64 -5.942 -3.100 -1.051 568 HD13 LEU 64 3HD1 LEU 64 -7.125 -2.217 -2.019 569 HD21 LEU 64 3HD2 LEU 64 -4.069 -1.649 -1.782 570 HD22 LEU 64 1HD2 LEU 64 -4.149 0.094 -1.542 571 HD23 LEU 64 2HD2 LEU 64 -5.123 -0.664 -2.803 572 H LYS 65 H LYS 65 -9.672 1.377 -0.848 573 HA LYS 65 HA LYS 65 -9.248 4.184 -0.599 574 HB2 LYS 65 2HB LYS 65 -11.827 2.701 -1.280 575 HB3 LYS 65 3HB LYS 65 -11.519 4.413 -1.567 576 HG2 LYS 65 2HG LYS 65 -9.677 3.786 -3.131 577 HG3 LYS 65 3HG LYS 65 -10.096 2.085 -2.892 578 HD2 LYS 65 2HD LYS 65 -12.380 2.546 -3.783 579 HD3 LYS 65 3HD LYS 65 -11.922 4.229 -4.054 580 HE2 LYS 65 2HE LYS 65 -10.159 3.462 -5.636 581 HE3 LYS 65 3HE LYS 65 -10.699 1.797 -5.396 582 HZ1 LYS 65 3HZ LYS 65 -12.876 2.421 -6.265 583 HZ2 LYS 65 1HZ LYS 65 -11.658 2.759 -7.387 584 HZ3 LYS 65 2HZ LYS 65 -12.348 4.008 -6.494 585 H GLU 66 H GLU 66 -11.413 1.901 1.044 586 HA GLU 66 HA GLU 66 -12.812 3.737 2.687 587 HB2 GLU 66 2HB GLU 66 -12.332 0.796 3.339 588 HB3 GLU 66 3HB GLU 66 -13.695 1.790 3.833 589 HG2 GLU 66 2HG GLU 66 -13.089 0.760 1.053 590 HG3 GLU 66 3HG GLU 66 -14.412 0.266 2.101 591 H MET 67 H MET 67 -9.793 2.005 3.085 592 HA MET 67 HA MET 67 -9.255 2.583 5.826 593 HB2 MET 67 2HB MET 67 -8.100 0.774 4.541 594 HB3 MET 67 3HB MET 67 -7.337 1.984 3.523 595 HG2 MET 67 2HG MET 67 -6.252 2.888 5.647 596 HG3 MET 67 3HG MET 67 -6.810 1.417 6.442 597 HE1 MET 67 3HE MET 67 -4.899 -1.339 4.412 598 HE2 MET 67 1HE MET 67 -6.515 -0.727 4.079 599 HE3 MET 67 2HE MET 67 -6.004 -1.022 5.743 600 H LEU 68 H LEU 68 -8.103 4.043 2.760 601 HA LEU 68 HA LEU 68 -6.447 6.033 3.858 602 HB2 LEU 68 2HB LEU 68 -7.756 5.772 1.135 603 HB3 LEU 68 3HB LEU 68 -6.692 7.117 1.520 604 HG LEU 68 HG LEU 68 -5.857 4.191 1.614 605 HD11 LEU 68 1HD1 LEU 68 -6.319 4.864 -0.686 606 HD12 LEU 68 2HD1 LEU 68 -4.592 4.633 -0.438 607 HD13 LEU 68 3HD1 LEU 68 -5.259 6.268 -0.515 608 HD21 LEU 68 3HD2 LEU 68 -3.565 5.055 1.796 609 HD22 LEU 68 1HD2 LEU 68 -4.555 5.576 3.158 610 HD23 LEU 68 2HD2 LEU 68 -4.178 6.709 1.857 611 H GLU 69 H GLU 69 -9.876 6.033 3.091 612 HA GLU 69 HA GLU 69 -10.602 8.678 3.201 613 HB2 GLU 69 2HB GLU 69 -11.889 6.336 2.859 614 HB3 GLU 69 3HB GLU 69 -12.284 6.548 4.556 615 HG2 GLU 69 2HG GLU 69 -12.908 8.502 2.344 616 HG3 GLU 69 3HG GLU 69 -14.025 7.328 3.005 617 H LEU 70 H LEU 70 -10.160 6.365 5.852 618 HA LEU 70 HA LEU 70 -10.747 8.269 7.956 619 HB2 LEU 70 2HB LEU 70 -9.647 5.442 8.155 620 HB3 LEU 70 3HB LEU 70 -10.360 6.371 9.463 621 HG LEU 70 HG LEU 70 -11.839 5.338 7.009 622 HD11 LEU 70 1HD1 LEU 70 -12.997 3.823 8.554 623 HD12 LEU 70 2HD1 LEU 70 -11.999 4.402 9.890 624 HD13 LEU 70 3HD1 LEU 70 -11.258 3.531 8.546 625 HD21 LEU 70 3HD2 LEU 70 -13.901 6.118 8.113 626 HD22 LEU 70 1HD2 LEU 70 -12.817 7.452 7.727 627 HD23 LEU 70 2HD2 LEU 70 -12.939 6.869 9.390 628 H ILE 71 H ILE 71 -7.871 6.861 6.471 629 HA ILE 71 HA ILE 71 -5.872 7.668 8.305 630 HB ILE 71 HB ILE 71 -5.771 7.114 5.310 631 HG12 ILE 71 2HG1 ILE 71 -4.776 5.533 7.726 632 HG13 ILE 71 3HG1 ILE 71 -6.185 5.152 6.741 633 HG21 ILE 71 1HG2 ILE 71 -3.367 7.713 7.069 634 HG22 ILE 71 2HG2 ILE 71 -3.962 8.710 5.740 635 HG23 ILE 71 3HG2 ILE 71 -3.301 7.113 5.408 636 HD11 ILE 71 3HD1 ILE 71 -4.716 4.754 4.817 637 HD12 ILE 71 1HD1 ILE 71 -4.351 3.705 6.186 638 HD13 ILE 71 2HD1 ILE 71 -3.311 5.084 5.838 639 H SER 72 H SER 72 -7.565 9.410 5.781 640 HA SER 72 HA SER 72 -5.976 11.658 5.427 641 HB2 SER 72 2HB SER 72 -7.948 11.113 4.038 642 HB3 SER 72 3HB SER 72 -9.018 11.514 5.384 643 HG SER 72 HG SER 72 -7.422 13.190 3.785 644 H LYS 73 H LYS 73 -8.181 10.879 8.045 645 HA LYS 73 HA LYS 73 -8.131 13.464 9.320 646 HB2 LYS 73 2HB LYS 73 -8.926 10.730 10.420 647 HB3 LYS 73 3HB LYS 73 -9.192 12.266 11.240 648 HG2 LYS 73 2HG LYS 73 -10.625 12.962 9.271 649 HG3 LYS 73 3HG LYS 73 -10.472 11.312 8.669 650 HD2 LYS 73 2HD LYS 73 -12.564 11.410 9.821 651 HD3 LYS 73 3HD LYS 73 -11.472 10.519 10.880 652 HE2 LYS 73 2HE LYS 73 -12.119 13.474 11.183 653 HE3 LYS 73 3HE LYS 73 -12.939 12.185 12.056 654 HZ1 LYS 73 3HZ LYS 73 -10.703 11.569 12.968 655 HZ2 LYS 73 1HZ LYS 73 -11.288 13.071 13.477 656 HZ3 LYS 73 2HZ LYS 73 -10.096 12.990 12.292 657 H LEU 74 H LEU 74 -6.262 10.480 9.586 658 HA LEU 74 HA LEU 74 -4.967 11.031 12.070 659 HB2 LEU 74 2HB LEU 74 -4.152 9.165 9.813 660 HB3 LEU 74 3HB LEU 74 -3.455 9.153 11.427 661 HG LEU 74 HG LEU 74 -6.365 8.535 10.789 662 HD11 LEU 74 1HD1 LEU 74 -5.830 6.200 11.277 663 HD12 LEU 74 2HD1 LEU 74 -4.131 6.614 11.519 664 HD13 LEU 74 3HD1 LEU 74 -4.868 6.790 9.924 665 HD21 LEU 74 3HD2 LEU 74 -6.516 7.802 13.137 666 HD22 LEU 74 1HD2 LEU 74 -6.106 9.513 13.019 667 HD23 LEU 74 2HD2 LEU 74 -4.856 8.333 13.419 668 H GLY 75 H GLY 75 -4.131 11.617 8.701 669 HA2 GLY 75 2HA GLY 75 -2.834 13.228 7.737 670 HA3 GLY 75 3HA GLY 75 -2.609 13.936 9.324 671 H TYR 76 H TYR 76 -1.487 11.226 7.286 672 HA TYR 76 HA TYR 76 1.259 12.016 7.750 673 HB2 TYR 76 2HB TYR 76 2.010 9.649 8.306 674 HB3 TYR 76 3HB TYR 76 1.141 10.465 9.587 675 HD1 TYR 76 HD2 TYR 76 0.572 7.990 6.804 676 HD2 TYR 76 HD1 TYR 76 -0.599 9.314 10.696 677 HE1 TYR 76 HE2 TYR 76 -0.867 6.014 7.048 678 HE2 TYR 76 HE1 TYR 76 -2.030 7.332 10.938 679 HH TYR 76 HH TYR 76 -1.912 4.681 8.747 680 H LYS 77 H LYS 77 2.743 10.542 6.382 681 HA LYS 77 HA LYS 77 1.671 10.713 3.683 682 HB2 LYS 77 2HB LYS 77 3.983 11.648 4.591 683 HB3 LYS 77 3HB LYS 77 4.557 10.013 4.312 684 HG2 LYS 77 2HG LYS 77 3.236 11.694 2.165 685 HG3 LYS 77 3HG LYS 77 4.976 11.691 2.442 686 HD2 LYS 77 2HD LYS 77 5.158 9.376 1.801 687 HD3 LYS 77 3HD LYS 77 3.403 9.168 1.808 688 HE2 LYS 77 2HE LYS 77 4.339 9.352 -0.482 689 HE3 LYS 77 3HE LYS 77 3.178 10.629 -0.123 690 HZ1 LYS 77 3HZ LYS 77 5.049 12.116 0.316 691 HZ2 LYS 77 1HZ LYS 77 5.084 11.512 -1.260 692 HZ3 LYS 77 2HZ LYS 77 6.135 10.889 -0.094 693 H VAL 78 H VAL 78 0.997 9.013 2.590 694 HA VAL 78 HA VAL 78 1.759 6.249 3.349 695 HB VAL 78 HB VAL 78 -0.903 7.150 2.130 696 HG11 VAL 78 1HG1 VAL 78 -0.311 4.840 1.539 697 HG12 VAL 78 2HG1 VAL 78 -1.696 4.871 2.629 698 HG13 VAL 78 3HG1 VAL 78 -0.099 4.439 3.244 699 HG21 VAL 78 3HG2 VAL 78 -0.338 6.374 5.009 700 HG22 VAL 78 1HG2 VAL 78 -1.928 6.725 4.324 701 HG23 VAL 78 2HG2 VAL 78 -0.709 7.996 4.420 702 H PHE 79 H PHE 79 2.287 4.889 1.688 703 HA PHE 79 HA PHE 79 2.415 5.900 -1.083 704 HB2 PHE 79 2HB PHE 79 3.869 3.536 0.204 705 HB3 PHE 79 3HB PHE 79 4.116 4.143 -1.433 706 HD1 PHE 79 HD1 PHE 79 5.215 6.361 -1.785 707 HD2 PHE 79 HD2 PHE 79 4.944 4.594 2.098 708 HE1 PHE 79 HE1 PHE 79 6.943 7.891 -0.960 709 HE2 PHE 79 HE2 PHE 79 6.683 6.128 2.910 710 HZ PHE 79 HZ PHE 79 7.680 7.779 1.383 711 H LEU 80 H LEU 80 1.709 4.461 -2.737 712 HA LEU 80 HA LEU 80 0.302 2.002 -1.999 713 HB2 LEU 80 2HB LEU 80 -1.499 3.593 -1.837 714 HB3 LEU 80 3HB LEU 80 -1.031 4.399 -3.324 715 HG LEU 80 HG LEU 80 -1.862 2.555 -4.674 716 HD11 LEU 80 1HD1 LEU 80 -2.911 0.556 -3.771 717 HD12 LEU 80 2HD1 LEU 80 -2.501 1.059 -2.131 718 HD13 LEU 80 3HD1 LEU 80 -1.223 0.660 -3.278 719 HD21 LEU 80 3HD2 LEU 80 -3.521 4.210 -3.977 720 HD22 LEU 80 1HD2 LEU 80 -3.893 3.263 -2.533 721 HD23 LEU 80 2HD2 LEU 80 -4.262 2.620 -4.136 722 H LEU 81 H LEU 81 0.647 0.473 -3.430 723 HA LEU 81 HA LEU 81 1.500 1.127 -6.179 724 HB2 LEU 81 2HB LEU 81 3.345 0.155 -4.787 725 HB3 LEU 81 3HB LEU 81 2.362 -1.277 -4.518 726 HG LEU 81 HG LEU 81 2.403 -1.756 -6.965 727 HD11 LEU 81 1HD1 LEU 81 2.631 0.493 -7.854 728 HD12 LEU 81 2HD1 LEU 81 3.934 -0.528 -8.452 729 HD13 LEU 81 3HD1 LEU 81 4.251 0.638 -7.166 730 HD21 LEU 81 3HD2 LEU 81 4.071 -2.806 -5.510 731 HD22 LEU 81 1HD2 LEU 81 5.163 -1.437 -5.741 732 HD23 LEU 81 2HD2 LEU 81 4.746 -2.480 -7.102 733 H LEU 82 H LEU 82 0.162 0.450 -7.621 734 HA LEU 82 HA LEU 82 -1.858 -1.645 -7.080 735 HB2 LEU 82 2HB LEU 82 -1.838 0.690 -9.049 736 HB3 LEU 82 3HB LEU 82 -3.132 -0.488 -8.910 737 HG LEU 82 HG LEU 82 -2.319 1.389 -6.660 738 HD11 LEU 82 1HD1 LEU 82 -3.150 2.690 -8.552 739 HD12 LEU 82 2HD1 LEU 82 -4.291 2.723 -7.214 740 HD13 LEU 82 3HD1 LEU 82 -4.613 1.702 -8.619 741 HD21 LEU 82 3HD2 LEU 82 -3.420 -0.636 -5.853 742 HD22 LEU 82 1HD2 LEU 82 -4.766 -0.382 -6.970 743 HD23 LEU 82 2HD2 LEU 82 -4.476 0.760 -5.655 744 H ALA 83 H ALA 83 -1.562 -3.520 -8.245 745 HA ALA 83 HA ALA 83 -0.202 -3.403 -10.873 746 HB1 ALA 83 3HB ALA 83 1.182 -5.360 -10.330 747 HB2 ALA 83 1HB ALA 83 0.546 -5.374 -8.684 748 HB3 ALA 83 2HB ALA 83 1.528 -4.021 -9.237 749 H ASP 84 H ASP 84 -1.406 -4.377 -12.333 750 HA ASP 84 HA ASP 84 -2.815 -6.846 -12.028 751 HB2 ASP 84 2HB ASP 84 -4.325 -5.115 -10.796 752 HB3 ASP 84 3HB ASP 84 -4.610 -4.385 -12.364 753 H GLN 85 H GLN 85 -3.576 -7.547 -14.070 754 HA GLN 85 HA GLN 85 -2.274 -6.507 -16.370 755 HB2 GLN 85 2HB GLN 85 -3.095 -8.941 -15.897 756 HB3 GLN 85 3HB GLN 85 -4.669 -8.385 -16.452 757 HG2 GLN 85 2HG GLN 85 -3.543 -9.463 -18.293 758 HG3 GLN 85 3HG GLN 85 -3.611 -7.731 -18.631 759 HE21 GLN 85 1HE2 GLN 85 -1.832 -7.743 -20.020 760 HE22 GLN 85 2HE2 GLN 85 -0.217 -8.033 -19.477 761 H ASP 86 H ASP 86 -5.537 -6.209 -15.031 762 HA ASP 86 HA ASP 86 -6.448 -4.361 -17.090 763 HB2 ASP 86 2HB ASP 86 -7.693 -5.285 -14.464 764 HB3 ASP 86 3HB ASP 86 -8.442 -4.081 -15.508 765 H GLU 87 H GLU 87 -4.787 -2.844 -16.979 766 HA GLU 87 HA GLU 87 -4.088 -1.380 -14.604 767 HB2 GLU 87 2HB GLU 87 -2.650 -0.062 -16.052 768 HB3 GLU 87 3HB GLU 87 -2.458 -1.771 -16.410 769 HG2 GLU 87 2HG GLU 87 -3.737 -1.559 -18.456 770 HG3 GLU 87 3HG GLU 87 -4.191 0.095 -18.051 771 H ASN 88 H ASN 88 -6.518 -1.022 -17.007 772 HA ASN 88 HA ASN 88 -7.067 1.762 -16.907 773 HB2 ASN 88 2HB ASN 88 -7.989 0.294 -18.662 774 HB3 ASN 88 3HB ASN 88 -8.950 -0.575 -17.476 775 HD21 ASN 88 1HD2 ASN 88 -8.619 2.435 -19.241 776 HD22 ASN 88 2HD2 ASN 88 -10.209 3.028 -18.916 777 H GLU 89 H GLU 89 -8.218 -0.969 -14.994 778 HA GLU 89 HA GLU 89 -10.003 0.288 -13.227 779 HB2 GLU 89 2HB GLU 89 -9.803 -2.166 -13.389 780 HB3 GLU 89 3HB GLU 89 -8.130 -2.090 -12.844 781 HG2 GLU 89 2HG GLU 89 -9.398 -2.864 -10.999 782 HG3 GLU 89 3HG GLU 89 -8.977 -1.196 -10.634 783 H LEU 90 H LEU 90 -6.505 -0.262 -13.090 784 HA LEU 90 HA LEU 90 -6.091 0.764 -10.468 785 HB2 LEU 90 2HB LEU 90 -4.019 0.479 -12.663 786 HB3 LEU 90 3HB LEU 90 -3.724 0.544 -10.932 787 HG LEU 90 HG LEU 90 -5.068 -1.726 -12.435 788 HD11 LEU 90 1HD1 LEU 90 -2.332 -1.540 -11.140 789 HD12 LEU 90 2HD1 LEU 90 -2.678 -1.573 -12.871 790 HD13 LEU 90 3HD1 LEU 90 -3.030 -2.982 -11.880 791 HD21 LEU 90 3HD2 LEU 90 -4.440 -1.524 -9.470 792 HD22 LEU 90 1HD2 LEU 90 -5.006 -2.970 -10.307 793 HD23 LEU 90 2HD2 LEU 90 -6.044 -1.553 -10.202 794 H GLU 91 H GLU 91 -6.129 2.197 -13.667 795 HA GLU 91 HA GLU 91 -4.801 4.648 -12.998 796 HB2 GLU 91 2HB GLU 91 -6.570 3.896 -15.366 797 HB3 GLU 91 3HB GLU 91 -5.871 5.503 -15.167 798 HG2 GLU 91 2HG GLU 91 -3.599 4.512 -15.153 799 HG3 GLU 91 3HG GLU 91 -4.312 2.919 -15.413 800 H GLU 92 H GLU 92 -8.233 3.744 -13.402 801 HA GLU 92 HA GLU 92 -9.394 6.155 -12.546 802 HB2 GLU 92 2HB GLU 92 -10.311 3.364 -12.956 803 HB3 GLU 92 3HB GLU 92 -11.189 4.154 -11.655 804 HG2 GLU 92 2HG GLU 92 -10.925 5.210 -14.490 805 HG3 GLU 92 3HG GLU 92 -12.330 4.383 -13.829 806 H PHE 93 H PHE 93 -8.194 3.413 -10.756 807 HA PHE 93 HA PHE 93 -8.980 4.081 -8.143 808 HB2 PHE 93 2HB PHE 93 -7.953 1.885 -9.145 809 HB3 PHE 93 3HB PHE 93 -6.396 2.625 -8.830 810 HD1 PHE 93 HD2 PHE 93 -6.575 3.781 -6.185 811 HD2 PHE 93 HD1 PHE 93 -8.356 0.175 -7.636 812 HE1 PHE 93 HE2 PHE 93 -6.586 2.865 -3.900 813 HE2 PHE 93 HE1 PHE 93 -8.367 -0.726 -5.351 814 HZ PHE 93 HZ PHE 93 -7.477 0.608 -3.485 815 H LYS 94 H LYS 94 -5.875 4.678 -9.856 816 HA LYS 94 HA LYS 94 -4.679 5.985 -7.612 817 HB2 LYS 94 2HB LYS 94 -2.700 6.298 -9.021 818 HB3 LYS 94 3HB LYS 94 -3.301 4.659 -9.122 819 HG2 LYS 94 2HG LYS 94 -2.729 5.057 -11.326 820 HG3 LYS 94 3HG LYS 94 -4.441 5.469 -11.335 821 HD2 LYS 94 2HD LYS 94 -3.157 7.115 -12.617 822 HD3 LYS 94 3HD LYS 94 -3.856 7.876 -11.187 823 HE2 LYS 94 2HE LYS 94 -1.682 7.739 -10.041 824 HE3 LYS 94 3HE LYS 94 -0.980 6.924 -11.444 825 HZ1 LYS 94 3HZ LYS 94 -2.016 9.710 -11.337 826 HZ2 LYS 94 1HZ LYS 94 -1.534 8.937 -12.758 827 HZ3 LYS 94 2HZ LYS 94 -0.410 9.235 -11.536 828 H ARG 95 H ARG 95 -6.512 7.173 -10.338 829 HA ARG 95 HA ARG 95 -5.611 9.874 -10.289 830 HB2 ARG 95 2HB ARG 95 -8.168 8.592 -11.317 831 HB3 ARG 95 3HB ARG 95 -7.890 10.331 -11.428 832 HG2 ARG 95 2HG ARG 95 -5.996 10.034 -12.871 833 HG3 ARG 95 3HG ARG 95 -5.969 8.290 -12.588 834 HD2 ARG 95 2HD ARG 95 -6.900 8.780 -14.785 835 HD3 ARG 95 3HD ARG 95 -8.138 8.073 -13.746 836 HE ARG 95 HE ARG 95 -8.101 10.975 -13.853 837 HH11 ARG 95 1HH1 ARG 95 -9.463 8.044 -15.250 838 HH12 ARG 95 2HH1 ARG 95 -10.841 8.857 -15.919 839 HH21 ARG 95 1HH2 ARG 95 -9.905 12.039 -14.754 840 HH22 ARG 95 2HH2 ARG 95 -11.092 11.133 -15.637 841 H LYS 96 H LYS 96 -8.080 8.144 -8.470 842 HA LYS 96 HA LYS 96 -9.129 10.454 -7.104 843 HB2 LYS 96 2HB LYS 96 -9.437 7.454 -6.735 844 HB3 LYS 96 3HB LYS 96 -9.964 8.540 -5.450 845 HG2 LYS 96 2HG LYS 96 -11.829 7.887 -6.926 846 HG3 LYS 96 3HG LYS 96 -11.547 9.629 -6.944 847 HD2 LYS 96 2HD LYS 96 -10.347 9.399 -9.102 848 HD3 LYS 96 3HD LYS 96 -10.639 7.660 -9.074 849 HE2 LYS 96 2HE LYS 96 -13.044 8.021 -9.263 850 HE3 LYS 96 3HE LYS 96 -12.822 9.770 -9.134 851 HZ1 LYS 96 3HZ LYS 96 -11.626 9.765 -11.213 852 HZ2 LYS 96 1HZ LYS 96 -13.130 9.030 -11.438 853 HZ3 LYS 96 2HZ LYS 96 -11.738 8.082 -11.335 854 H ILE 97 H ILE 97 -6.878 7.827 -6.211 855 HA ILE 97 HA ILE 97 -6.443 8.600 -3.540 856 HB ILE 97 HB ILE 97 -4.616 6.954 -5.347 857 HG12 ILE 97 2HG1 ILE 97 -6.822 5.955 -5.337 858 HG13 ILE 97 3HG1 ILE 97 -5.785 4.967 -4.328 859 HG21 ILE 97 1HG2 ILE 97 -3.425 7.646 -3.335 860 HG22 ILE 97 2HG2 ILE 97 -3.775 5.921 -3.264 861 HG23 ILE 97 3HG2 ILE 97 -4.739 7.054 -2.315 862 HD11 ILE 97 3HD1 ILE 97 -6.826 6.006 -2.321 863 HD12 ILE 97 1HD1 ILE 97 -7.970 5.146 -3.348 864 HD13 ILE 97 2HD1 ILE 97 -7.907 6.906 -3.387 865 H GLU 98 H GLU 98 -4.586 9.311 -6.493 866 HA GLU 98 HA GLU 98 -2.460 10.786 -5.333 867 HB2 GLU 98 2HB GLU 98 -2.473 9.796 -7.640 868 HB3 GLU 98 3HB GLU 98 -3.623 11.013 -8.155 869 HG2 GLU 98 2HG GLU 98 -0.952 11.851 -7.027 870 HG3 GLU 98 3HG GLU 98 -1.056 11.279 -8.685 871 H SER 99 H SER 99 -5.654 11.710 -6.571 872 HA SER 99 HA SER 99 -5.358 14.540 -6.387 873 HB2 SER 99 2HB SER 99 -7.078 13.449 -7.797 874 HB3 SER 99 3HB SER 99 -7.897 12.852 -6.357 875 HG SER 99 HG SER 99 -8.462 14.917 -5.823 876 H GLN 100 H GLN 100 -6.229 12.051 -4.091 877 HA GLN 100 HA GLN 100 -7.204 13.821 -2.006 878 HB2 GLN 100 2HB GLN 100 -6.487 10.858 -1.959 879 HB3 GLN 100 3HB GLN 100 -7.242 11.726 -0.625 880 HG2 GLN 100 2HG GLN 100 -9.202 12.213 -2.027 881 HG3 GLN 100 3HG GLN 100 -8.449 11.356 -3.374 882 HE21 GLN 100 1HE2 GLN 100 -8.283 9.075 -3.268 883 HE22 GLN 100 2HE2 GLN 100 -9.247 8.150 -2.175 884 H GLY 101 H GLY 101 -4.130 13.085 -3.151 885 HA2 GLY 101 2HA GLY 101 -2.187 14.194 -2.450 886 HA3 GLY 101 3HA GLY 101 -2.906 14.454 -0.869 887 H TYR 102 H TYR 102 -2.495 11.433 -2.711 888 HA TYR 102 HA TYR 102 -0.545 10.448 -0.694 889 HB2 TYR 102 2HB TYR 102 -2.674 8.824 -2.164 890 HB3 TYR 102 3HB TYR 102 -1.451 8.150 -1.090 891 HD1 TYR 102 HD2 TYR 102 -1.493 8.872 1.387 892 HD2 TYR 102 HD1 TYR 102 -4.755 9.587 -1.276 893 HE1 TYR 102 HE2 TYR 102 -3.001 9.155 3.311 894 HE2 TYR 102 HE1 TYR 102 -6.257 9.874 0.642 895 HH TYR 102 HH TYR 102 -6.414 9.281 2.974 896 H GLU 103 H GLU 103 1.151 9.164 -1.480 897 HA GLU 103 HA GLU 103 1.865 9.451 -4.281 898 HB2 GLU 103 2HB GLU 103 3.592 9.537 -2.472 899 HB3 GLU 103 3HB GLU 103 3.243 7.863 -2.062 900 HG2 GLU 103 2HG GLU 103 5.263 7.926 -3.365 901 HG3 GLU 103 3HG GLU 103 3.999 7.197 -4.352 902 H VAL 104 H VAL 104 1.035 8.110 -5.759 903 HA VAL 104 HA VAL 104 0.646 5.256 -5.145 904 HB VAL 104 HB VAL 104 -1.553 6.201 -4.760 905 HG11 VAL 104 1HG1 VAL 104 -1.358 8.301 -5.984 906 HG12 VAL 104 2HG1 VAL 104 -2.824 7.444 -6.455 907 HG13 VAL 104 3HG1 VAL 104 -1.421 7.439 -7.525 908 HG21 VAL 104 3HG2 VAL 104 -2.898 4.905 -6.356 909 HG22 VAL 104 1HG2 VAL 104 -1.463 4.001 -5.875 910 HG23 VAL 104 2HG2 VAL 104 -1.522 4.784 -7.455 911 H ARG 105 H ARG 105 1.183 3.938 -6.824 912 HA ARG 105 HA ARG 105 1.663 5.115 -9.501 913 HB2 ARG 105 2HB ARG 105 3.482 3.140 -8.044 914 HB3 ARG 105 3HB ARG 105 3.695 3.666 -9.710 915 HG2 ARG 105 2HG ARG 105 3.832 5.462 -7.278 916 HG3 ARG 105 3HG ARG 105 5.223 4.825 -8.151 917 HD2 ARG 105 2HD ARG 105 4.680 6.118 -10.112 918 HD3 ARG 105 3HD ARG 105 3.115 6.593 -9.439 919 HE ARG 105 HE ARG 105 4.574 7.669 -7.614 920 HH11 ARG 105 1HH1 ARG 105 5.421 7.586 -11.026 921 HH12 ARG 105 2HH1 ARG 105 6.349 9.051 -10.941 922 HH21 ARG 105 1HH2 ARG 105 5.734 9.581 -7.526 923 HH22 ARG 105 2HH2 ARG 105 6.528 10.184 -8.951 924 H LYS 106 H LYS 106 1.322 3.783 -11.216 925 HA LYS 106 HA LYS 106 -0.240 1.309 -10.752 926 HB2 LYS 106 2HB LYS 106 -1.600 3.122 -11.679 927 HB3 LYS 106 3HB LYS 106 -0.434 3.435 -12.949 928 HG2 LYS 106 2HG LYS 106 -1.801 0.741 -12.792 929 HG3 LYS 106 3HG LYS 106 -2.660 2.118 -13.464 930 HD2 LYS 106 2HD LYS 106 -0.018 1.031 -14.502 931 HD3 LYS 106 3HD LYS 106 -1.600 0.724 -15.208 932 HE2 LYS 106 2HE LYS 106 -1.871 3.106 -15.710 933 HE3 LYS 106 3HE LYS 106 -0.325 3.453 -14.943 934 HZ1 LYS 106 3HZ LYS 106 -0.726 1.792 -17.370 935 HZ2 LYS 106 1HZ LYS 106 0.759 2.076 -16.620 936 HZ3 LYS 106 2HZ LYS 106 -0.084 3.354 -17.331 937 H VAL 107 H VAL 107 0.870 -0.432 -11.291 938 HA VAL 107 HA VAL 107 2.598 -0.501 -13.690 939 HB VAL 107 HB VAL 107 4.092 -2.145 -12.538 940 HG11 VAL 107 1HG1 VAL 107 5.344 -0.559 -11.129 941 HG12 VAL 107 2HG1 VAL 107 3.958 0.534 -11.113 942 HG13 VAL 107 3HG1 VAL 107 4.798 0.196 -12.628 943 HG21 VAL 107 3HG2 VAL 107 4.012 -2.403 -10.073 944 HG22 VAL 107 1HG2 VAL 107 2.541 -2.997 -10.842 945 HG23 VAL 107 2HG2 VAL 107 2.537 -1.436 -10.020 946 H THR 108 H THR 108 3.071 -3.056 -14.009 947 HA THR 108 HA THR 108 0.528 -4.561 -13.769 948 HB THR 108 HB THR 108 1.030 -5.486 -16.105 949 HG1 THR 108 HG1 THR 108 2.951 -3.383 -16.005 950 HG21 THR 108 3HG2 THR 108 0.097 -3.553 -17.330 951 HG22 THR 108 1HG2 THR 108 0.431 -2.508 -15.948 952 HG23 THR 108 2HG2 THR 108 -0.756 -3.808 -15.808 953 H ASP 109 H ASP 109 3.990 -4.842 -14.682 954 HA ASP 109 HA ASP 109 3.998 -7.711 -14.211 955 HB2 ASP 109 2HB ASP 109 5.157 -6.726 -16.173 956 HB3 ASP 109 3HB ASP 109 6.226 -5.829 -15.101 957 H ASP 110 H ASP 110 5.673 -8.761 -12.965 958 HA ASP 110 HA ASP 110 5.594 -8.061 -10.251 959 HB2 ASP 110 2HB ASP 110 7.348 -10.100 -11.695 960 HB3 ASP 110 3HB ASP 110 7.177 -9.996 -9.948 961 H GLU 111 H GLU 111 8.449 -8.170 -12.446 962 HA GLU 111 HA GLU 111 10.187 -7.210 -10.341 963 HB2 GLU 111 2HB GLU 111 12.021 -7.495 -11.918 964 HB3 GLU 111 3HB GLU 111 10.968 -8.897 -11.948 965 HG2 GLU 111 2HG GLU 111 11.358 -8.657 -14.196 966 HG3 GLU 111 3HG GLU 111 9.903 -7.684 -14.039 967 H GLU 112 H GLU 112 8.411 -5.787 -12.923 968 HA GLU 112 HA GLU 112 9.538 -3.186 -12.998 969 HB2 GLU 112 2HB GLU 112 7.941 -3.983 -14.682 970 HB3 GLU 112 3HB GLU 112 6.688 -4.177 -13.463 971 HG2 GLU 112 2HG GLU 112 6.591 -1.754 -13.152 972 HG3 GLU 112 3HG GLU 112 7.904 -1.535 -14.310 973 H ALA 113 H ALA 113 6.895 -4.611 -11.094 974 HA ALA 113 HA ALA 113 6.172 -2.385 -9.541 975 HB1 ALA 113 3HB ALA 113 5.049 -4.002 -8.077 976 HB2 ALA 113 1HB ALA 113 5.937 -5.327 -8.836 977 HB3 ALA 113 2HB ALA 113 4.773 -4.391 -9.774 978 H LEU 114 H LEU 114 8.590 -4.925 -8.990 979 HA LEU 114 HA LEU 114 9.239 -4.412 -6.310 980 HB2 LEU 114 2HB LEU 114 10.971 -5.545 -8.536 981 HB3 LEU 114 3HB LEU 114 11.439 -5.549 -6.840 982 HG LEU 114 HG LEU 114 9.030 -7.012 -7.998 983 HD11 LEU 114 1HD1 LEU 114 11.130 -8.046 -8.697 984 HD12 LEU 114 2HD1 LEU 114 10.289 -9.071 -7.538 985 HD13 LEU 114 3HD1 LEU 114 11.681 -8.116 -7.020 986 HD21 LEU 114 3HD2 LEU 114 8.597 -6.309 -5.693 987 HD22 LEU 114 1HD2 LEU 114 10.119 -7.033 -5.163 988 HD23 LEU 114 2HD2 LEU 114 8.816 -8.054 -5.776 989 H LYS 115 H LYS 115 10.476 -2.932 -9.280 990 HA LYS 115 HA LYS 115 12.567 -1.349 -8.244 991 HB2 LYS 115 2HB LYS 115 10.666 -0.712 -10.548 992 HB3 LYS 115 3HB LYS 115 12.170 0.146 -10.220 993 HG2 LYS 115 2HG LYS 115 13.463 -1.882 -10.665 994 HG3 LYS 115 3HG LYS 115 11.972 -2.795 -10.937 995 HD2 LYS 115 2HD LYS 115 11.424 -1.344 -12.865 996 HD3 LYS 115 3HD LYS 115 12.893 -0.401 -12.583 997 HE2 LYS 115 2HE LYS 115 13.158 -2.012 -14.426 998 HE3 LYS 115 3HE LYS 115 14.273 -2.363 -13.103 999 HZ1 LYS 115 3HZ LYS 115 11.712 -3.767 -13.671 1000 HZ2 LYS 115 1HZ LYS 115 12.731 -4.098 -12.361 1001 HZ3 LYS 115 2HZ LYS 115 13.266 -4.373 -13.940 1002 H ILE 116 H ILE 116 9.096 -0.766 -8.520 1003 HA ILE 116 HA ILE 116 9.160 1.980 -7.705 1004 HB ILE 116 HB ILE 116 6.715 0.150 -7.738 1005 HG12 ILE 116 2HG1 ILE 116 7.839 -0.028 -9.928 1006 HG13 ILE 116 3HG1 ILE 116 6.331 0.853 -10.084 1007 HG21 ILE 116 1HG2 ILE 116 6.348 2.304 -6.631 1008 HG22 ILE 116 2HG2 ILE 116 5.467 2.237 -8.154 1009 HG23 ILE 116 3HG2 ILE 116 6.965 3.165 -8.046 1010 HD11 ILE 116 3HD1 ILE 116 9.104 2.056 -10.078 1011 HD12 ILE 116 1HD1 ILE 116 7.594 2.965 -10.223 1012 HD13 ILE 116 2HD1 ILE 116 8.058 1.813 -11.475 1013 H VAL 117 H VAL 117 8.580 -1.111 -6.070 1014 HA VAL 117 HA VAL 117 7.811 -0.198 -3.515 1015 HB VAL 117 HB VAL 117 9.468 -2.686 -4.206 1016 HG11 VAL 117 1HG1 VAL 117 8.722 -3.597 -2.022 1017 HG12 VAL 117 2HG1 VAL 117 7.938 -2.060 -1.644 1018 HG13 VAL 117 3HG1 VAL 117 9.692 -2.139 -1.813 1019 HG21 VAL 117 3HG2 VAL 117 7.291 -2.671 -5.341 1020 HG22 VAL 117 1HG2 VAL 117 6.468 -2.389 -3.806 1021 HG23 VAL 117 2HG2 VAL 117 7.322 -3.908 -4.086 1022 H ARG 118 H ARG 118 11.016 -0.864 -4.914 1023 HA ARG 118 HA ARG 118 12.624 -0.213 -2.692 1024 HB2 ARG 118 2HB ARG 118 13.269 -0.089 -5.671 1025 HB3 ARG 118 3HB ARG 118 14.477 0.035 -4.393 1026 HG2 ARG 118 2HG ARG 118 14.069 -2.218 -3.667 1027 HG3 ARG 118 3HG ARG 118 12.646 -2.355 -4.699 1028 HD2 ARG 118 2HD ARG 118 14.151 -2.139 -6.705 1029 HD3 ARG 118 3HD ARG 118 15.542 -2.181 -5.606 1030 HE ARG 118 HE ARG 118 14.043 -4.361 -4.929 1031 HH11 ARG 118 1HH1 ARG 118 15.584 -3.356 -7.939 1032 HH12 ARG 118 2HH1 ARG 118 15.801 -4.991 -8.485 1033 HH21 ARG 118 1HH2 ARG 118 14.304 -6.450 -5.656 1034 HH22 ARG 118 2HH2 ARG 118 15.074 -6.750 -7.193 1035 H GLU 119 H GLU 119 11.357 1.788 -5.339 1036 HA GLU 119 HA GLU 119 12.587 4.232 -4.666 1037 HB2 GLU 119 2HB GLU 119 9.931 3.667 -6.053 1038 HB3 GLU 119 3HB GLU 119 10.607 5.283 -5.888 1039 HG2 GLU 119 2HG GLU 119 11.866 2.968 -7.374 1040 HG3 GLU 119 3HG GLU 119 11.073 4.364 -8.101 1041 H PHE 120 H PHE 120 9.425 2.872 -3.698 1042 HA PHE 120 HA PHE 120 8.584 4.952 -2.003 1043 HB2 PHE 120 2HB PHE 120 7.901 1.986 -1.966 1044 HB3 PHE 120 3HB PHE 120 7.112 3.160 -0.921 1045 HD1 PHE 120 HD2 PHE 120 7.262 5.280 -3.460 1046 HD2 PHE 120 HD1 PHE 120 5.600 1.399 -2.738 1047 HE1 PHE 120 HE2 PHE 120 5.532 5.692 -5.162 1048 HE2 PHE 120 HE1 PHE 120 3.878 1.831 -4.439 1049 HZ PHE 120 HZ PHE 120 3.839 3.969 -5.648 1050 H MET 121 H MET 121 10.776 2.294 -1.454 1051 HA MET 121 HA MET 121 10.903 2.511 1.417 1052 HB2 MET 121 2HB MET 121 12.698 1.077 -0.595 1053 HB3 MET 121 3HB MET 121 12.879 0.950 1.152 1054 HG2 MET 121 2HG MET 121 10.837 -0.224 1.397 1055 HG3 MET 121 3HG MET 121 10.281 0.244 -0.209 1056 HE1 MET 121 3HE MET 121 13.614 -2.886 0.515 1057 HE2 MET 121 1HE MET 121 12.691 -2.150 1.825 1058 HE3 MET 121 2HE MET 121 13.826 -1.176 0.884 1059 H GLN 122 H GLN 122 12.587 4.016 -1.296 1060 HA GLN 122 HA GLN 122 14.748 5.153 0.264 1061 HB2 GLN 122 2HB GLN 122 13.665 6.178 -2.405 1062 HB3 GLN 122 3HB GLN 122 15.217 6.577 -1.688 1063 HG2 GLN 122 2HG GLN 122 14.358 3.951 -2.896 1064 HG3 GLN 122 3HG GLN 122 15.604 5.046 -3.475 1065 HE21 GLN 122 1HE2 GLN 122 14.831 2.532 -1.208 1066 HE22 GLN 122 2HE2 GLN 122 16.436 2.271 -0.625 1067 H LYS 123 H LYS 123 11.598 6.176 -0.885 1068 HA LYS 123 HA LYS 123 11.664 8.887 -0.024 1069 HB2 LYS 123 2HB LYS 123 9.288 7.096 -0.676 1070 HB3 LYS 123 3HB LYS 123 9.252 8.858 -0.592 1071 HG2 LYS 123 2HG LYS 123 10.609 9.079 -2.550 1072 HG3 LYS 123 3HG LYS 123 11.038 7.368 -2.532 1073 HD2 LYS 123 2HD LYS 123 8.625 6.818 -2.969 1074 HD3 LYS 123 3HD LYS 123 8.303 8.545 -3.146 1075 HE2 LYS 123 2HE LYS 123 10.096 6.829 -4.886 1076 HE3 LYS 123 3HE LYS 123 8.561 7.562 -5.340 1077 HZ1 LYS 123 3HZ LYS 123 11.120 8.947 -4.791 1078 HZ2 LYS 123 1HZ LYS 123 9.646 9.754 -4.976 1079 HZ3 LYS 123 2HZ LYS 123 10.285 8.862 -6.258 1080 H ALA 124 H ALA 124 10.410 5.880 1.369 1081 HA ALA 124 HA ALA 124 9.223 7.050 3.707 1082 HB1 ALA 124 3HB ALA 124 8.481 4.867 2.858 1083 HB2 ALA 124 1HB ALA 124 9.054 4.732 4.519 1084 HB3 ALA 124 2HB ALA 124 10.072 4.177 3.184 1085 H GLY 125 H GLY 125 12.381 5.676 2.849 1086 HA2 GLY 125 2HA GLY 125 13.667 5.748 5.347 1087 HA3 GLY 125 3HA GLY 125 14.457 5.953 3.785 1088 H SER 126 H SER 126 13.028 8.269 2.965 1089 HA SER 126 HA SER 126 14.530 10.350 4.268 1090 HB2 SER 126 2HB SER 126 12.381 10.526 2.115 1091 HB3 SER 126 3HB SER 126 13.508 11.811 2.565 1092 HG SER 126 HG SER 126 14.652 9.365 1.908 1093 H LEU 127 H LEU 127 11.298 9.073 4.566 1094 HA LEU 127 HA LEU 127 10.121 11.353 5.891 1095 HB2 LEU 127 2HB LEU 127 9.194 8.455 5.759 1096 HB3 LEU 127 3HB LEU 127 8.261 9.760 6.476 1097 HG LEU 127 HG LEU 127 9.035 9.570 3.545 1098 HD11 LEU 127 1HD1 LEU 127 6.679 9.085 3.129 1099 HD12 LEU 127 2HD1 LEU 127 6.345 9.121 4.861 1100 HD13 LEU 127 3HD1 LEU 127 7.395 7.871 4.188 1101 HD21 LEU 127 3HD2 LEU 127 8.863 11.904 4.244 1102 HD22 LEU 127 1HD2 LEU 127 7.271 11.602 4.948 1103 HD23 LEU 127 2HD2 LEU 127 7.510 11.472 3.204 1104 H GLU 128 H GLU 128 11.314 8.164 6.944 1105 HA GLU 128 HA GLU 128 10.868 8.541 9.720 1106 HB2 GLU 128 2HB GLU 128 12.263 6.532 10.056 1107 HB3 GLU 128 3HB GLU 128 11.094 6.291 8.767 1108 HG2 GLU 128 2HG GLU 128 12.924 6.733 7.114 1109 HG3 GLU 128 3HG GLU 128 14.055 6.803 8.465 1110 H HIS 129 H HIS 129 13.778 8.892 7.704 1111 HA HIS 129 HA HIS 129 15.232 10.247 9.867 1112 HB2 HIS 129 2HB HIS 129 16.189 9.786 7.004 1113 HB3 HIS 129 3HB HIS 129 17.172 10.153 8.417 1114 HD1 HIS 129 HD1 HIS 129 16.581 7.487 6.297 1115 HD2 HIS 129 HD2 HIS 129 16.637 7.809 10.437 1116 HE1 HIS 129 HE1 HIS 129 16.992 5.164 7.144 1117 HE2 HIS 129 HE2 HIS 129 17.148 5.404 9.636 1118 H HIS 130 H HIS 130 13.554 11.898 9.911 1119 HA HIS 130 HA HIS 130 13.052 13.643 7.694 1120 HB2 HIS 130 2HB HIS 130 11.429 13.249 9.578 1121 HB3 HIS 130 3HB HIS 130 12.521 14.094 10.669 1122 HD1 HIS 130 HD1 HIS 130 11.481 16.281 11.168 1123 HD2 HIS 130 HD2 HIS 130 11.013 15.262 7.169 1124 HE1 HIS 130 HE1 HIS 130 10.280 18.216 10.117 1125 HE2 HIS 130 HE2 HIS 130 10.073 17.614 7.691 1126 H HIS 131 H HIS 131 15.145 14.119 7.039 1127 HA HIS 131 HA HIS 131 17.071 15.441 8.762 1128 HB2 HIS 131 2HB HIS 131 18.488 15.443 6.626 1129 HB3 HIS 131 3HB HIS 131 18.032 13.859 7.235 1130 HD1 HIS 131 HD1 HIS 131 16.582 12.394 5.743 1131 HD2 HIS 131 HD2 HIS 131 17.212 16.176 4.138 1132 HE1 HIS 131 HE1 HIS 131 15.756 12.266 3.385 1133 HE2 HIS 131 HE2 HIS 131 16.075 14.572 2.449 1134 H HIS 132 H HIS 132 17.906 17.518 8.429 1135 HA HIS 132 HA HIS 132 15.957 19.518 7.781 1136 HB2 HIS 132 2HB HIS 132 18.898 19.749 8.557 1137 HB3 HIS 132 3HB HIS 132 17.827 21.134 8.350 1138 HD1 HIS 132 HD1 HIS 132 15.547 20.904 9.953 1139 HD2 HIS 132 HD2 HIS 132 18.994 18.919 11.146 1140 HE1 HIS 132 HE1 HIS 132 15.258 20.474 12.406 1141 HE2 HIS 132 HE2 HIS 132 17.236 19.064 13.034 1142 H HIS 133 H HIS 133 16.149 21.198 6.245 1143 HA HIS 133 HA HIS 133 17.718 20.587 3.794 1144 HB2 HIS 133 2HB HIS 133 14.870 21.707 3.877 1145 HB3 HIS 133 3HB HIS 133 15.810 21.362 2.427 1146 HD1 HIS 133 HD1 HIS 133 15.600 19.024 1.475 1147 HD2 HIS 133 HD2 HIS 133 14.044 19.342 5.310 1148 HE1 HIS 133 HE1 HIS 133 14.437 16.844 1.921 1149 HE2 HIS 133 HE2 HIS 133 13.352 17.139 4.163 1150 H HIS 134 H HIS 134 17.928 22.563 2.382 1151 HA HIS 134 HA HIS 134 18.753 24.877 3.916 1152 HB2 HIS 134 2HB HIS 134 18.786 24.360 0.905 1153 HB3 HIS 134 3HB HIS 134 19.414 25.820 1.662 1154 HD1 HIS 134 HD1 HIS 134 21.766 25.724 2.595 1155 HD2 HIS 134 HD2 HIS 134 20.312 21.978 1.526 1156 HE1 HIS 134 HE1 HIS 134 23.727 24.167 2.744 1157 HE2 HIS 134 HE2 HIS 134 22.852 21.943 1.980 Start of MODEL 11 1 H1 MET 1 1H MET 1 1.525 9.641 13.190 2 H2 MET 1 2H MET 1 1.975 11.256 12.968 3 H3 MET 1 3H MET 1 3.075 10.152 13.613 4 HA MET 1 HA MET 1 1.942 10.015 10.895 5 HB2 MET 1 2HB MET 1 3.532 11.964 11.280 6 HB3 MET 1 3HB MET 1 4.774 10.809 11.737 7 HG2 MET 1 2HG MET 1 3.449 10.939 9.016 8 HG3 MET 1 3HG MET 1 5.021 11.628 9.414 9 HE1 MET 1 3HE MET 1 5.695 10.107 7.113 10 HE2 MET 1 1HE MET 1 4.113 9.319 7.097 11 HE3 MET 1 2HE MET 1 5.586 8.348 7.113 12 H LYS 2 H LYS 2 2.078 7.984 10.098 13 HA LYS 2 HA LYS 2 4.127 6.110 11.124 14 HB2 LYS 2 2HB LYS 2 1.234 5.360 10.461 15 HB3 LYS 2 3HB LYS 2 2.482 4.280 11.073 16 HG2 LYS 2 2HG LYS 2 2.536 5.671 13.189 17 HG3 LYS 2 3HG LYS 2 1.155 6.569 12.560 18 HD2 LYS 2 2HD LYS 2 0.389 4.867 14.140 19 HD3 LYS 2 3HD LYS 2 -0.177 4.469 12.517 20 HE2 LYS 2 2HE LYS 2 1.503 2.755 12.276 21 HE3 LYS 2 3HE LYS 2 2.314 3.260 13.757 22 HZ1 LYS 2 3HZ LYS 2 1.026 1.289 14.138 23 HZ2 LYS 2 1HZ LYS 2 -0.383 2.039 13.575 24 HZ3 LYS 2 2HZ LYS 2 0.346 2.573 15.000 25 H ILE 3 H ILE 3 4.949 4.654 9.531 26 HA ILE 3 HA ILE 3 4.585 5.517 6.746 27 HB ILE 3 HB ILE 3 6.589 3.505 7.899 28 HG12 ILE 3 2HG1 ILE 3 7.022 6.418 7.064 29 HG13 ILE 3 3HG1 ILE 3 7.039 5.810 8.716 30 HG21 ILE 3 1HG2 ILE 3 7.733 3.657 5.700 31 HG22 ILE 3 2HG2 ILE 3 6.457 4.720 5.107 32 HG23 ILE 3 3HG2 ILE 3 6.085 3.048 5.524 33 HD11 ILE 3 3HD1 ILE 3 9.279 6.193 7.939 34 HD12 ILE 3 1HD1 ILE 3 9.024 5.142 6.546 35 HD13 ILE 3 2HD1 ILE 3 9.028 4.464 8.178 36 H LEU 4 H LEU 4 2.798 4.613 5.916 37 HA LEU 4 HA LEU 4 2.344 1.689 6.142 38 HB2 LEU 4 2HB LEU 4 0.497 4.024 5.534 39 HB3 LEU 4 3HB LEU 4 0.071 2.401 5.021 40 HG LEU 4 HG LEU 4 0.071 1.638 7.383 41 HD11 LEU 4 1HD1 LEU 4 1.670 3.164 8.393 42 HD12 LEU 4 2HD1 LEU 4 0.130 3.245 9.242 43 HD13 LEU 4 3HD1 LEU 4 0.588 4.531 8.120 44 HD21 LEU 4 3HD2 LEU 4 -2.002 2.776 8.044 45 HD22 LEU 4 1HD2 LEU 4 -2.006 2.373 6.328 46 HD23 LEU 4 2HD2 LEU 4 -1.707 4.036 6.845 47 H ILE 5 H ILE 5 2.658 0.475 4.356 48 HA ILE 5 HA ILE 5 2.571 1.765 1.689 49 HB ILE 5 HB ILE 5 4.274 -0.675 2.436 50 HG12 ILE 5 2HG1 ILE 5 5.117 2.202 1.839 51 HG13 ILE 5 3HG1 ILE 5 5.317 1.346 3.360 52 HG21 ILE 5 1HG2 ILE 5 5.154 -0.522 0.121 53 HG22 ILE 5 2HG2 ILE 5 4.056 0.818 -0.213 54 HG23 ILE 5 3HG2 ILE 5 3.409 -0.789 0.122 55 HD11 ILE 5 3HD1 ILE 5 7.417 1.531 2.196 56 HD12 ILE 5 1HD1 ILE 5 6.747 0.732 0.774 57 HD13 ILE 5 2HD1 ILE 5 6.932 -0.161 2.287 58 H LEU 6 H LEU 6 0.664 1.230 0.865 59 HA LEU 6 HA LEU 6 -0.684 -1.297 1.480 60 HB2 LEU 6 2HB LEU 6 -1.543 1.082 -0.226 61 HB3 LEU 6 3HB LEU 6 -2.541 -0.328 0.100 62 HG LEU 6 HG LEU 6 -1.603 1.716 2.132 63 HD11 LEU 6 1HD1 LEU 6 -4.384 1.152 1.057 64 HD12 LEU 6 2HD1 LEU 6 -3.383 2.557 0.681 65 HD13 LEU 6 3HD1 LEU 6 -3.974 2.316 2.322 66 HD21 LEU 6 3HD2 LEU 6 -1.683 -0.500 3.155 67 HD22 LEU 6 1HD2 LEU 6 -3.343 -0.720 2.588 68 HD23 LEU 6 2HD2 LEU 6 -2.964 0.535 3.772 69 H ILE 7 H ILE 7 -0.582 -2.998 0.168 70 HA ILE 7 HA ILE 7 0.204 -2.664 -2.678 71 HB ILE 7 HB ILE 7 0.652 -5.109 -0.895 72 HG12 ILE 7 2HG1 ILE 7 2.227 -3.309 -0.317 73 HG13 ILE 7 3HG1 ILE 7 3.083 -4.609 -1.129 74 HG21 ILE 7 1HG2 ILE 7 0.209 -5.789 -3.209 75 HG22 ILE 7 2HG2 ILE 7 1.907 -6.058 -2.816 76 HG23 ILE 7 3HG2 ILE 7 1.441 -4.671 -3.802 77 HD11 ILE 7 3HD1 ILE 7 3.892 -2.454 -1.854 78 HD12 ILE 7 1HD1 ILE 7 2.271 -1.970 -2.351 79 HD13 ILE 7 2HD1 ILE 7 3.106 -3.274 -3.202 80 H ASN 8 H ASN 8 -1.519 -2.885 -3.937 81 HA ASN 8 HA ASN 8 -3.386 -5.129 -3.478 82 HB2 ASN 8 2HB ASN 8 -4.573 -3.034 -2.944 83 HB3 ASN 8 3HB ASN 8 -4.123 -2.354 -4.503 84 HD21 ASN 8 1HD2 ASN 8 -5.273 -2.993 -6.345 85 HD22 ASN 8 2HD2 ASN 8 -6.701 -3.961 -6.269 86 H THR 9 H THR 9 -2.632 -6.507 -4.916 87 HA THR 9 HA THR 9 -2.430 -5.719 -7.752 88 HB THR 9 HB THR 9 -0.133 -5.918 -7.040 89 HG1 THR 9 HG1 THR 9 0.369 -8.014 -8.261 90 HG21 THR 9 3HG2 THR 9 -0.406 -7.235 -4.987 91 HG22 THR 9 1HG2 THR 9 0.803 -7.965 -6.046 92 HG23 THR 9 2HG2 THR 9 -0.815 -8.660 -5.945 93 H ASN 10 H ASN 10 -3.088 -7.258 -9.233 94 HA ASN 10 HA ASN 10 -5.143 -9.060 -8.517 95 HB2 ASN 10 2HB ASN 10 -4.850 -7.941 -10.770 96 HB3 ASN 10 3HB ASN 10 -3.519 -9.035 -11.106 97 HD21 ASN 10 1HD2 ASN 10 -6.033 -8.663 -12.558 98 HD22 ASN 10 2HD2 ASN 10 -6.820 -10.198 -12.593 99 H ASN 11 H ASN 11 -1.727 -9.630 -9.480 100 HA ASN 11 HA ASN 11 -1.962 -12.483 -8.875 101 HB2 ASN 11 2HB ASN 11 0.349 -12.703 -9.701 102 HB3 ASN 11 3HB ASN 11 -0.673 -11.889 -10.873 103 HD21 ASN 11 1HD2 ASN 11 2.318 -11.912 -10.150 104 HD22 ASN 11 2HD2 ASN 11 2.732 -10.238 -10.219 105 H ASP 12 H ASP 12 -1.671 -13.247 -6.917 106 HA ASP 12 HA ASP 12 -0.869 -11.682 -4.674 107 HB2 ASP 12 2HB ASP 12 -2.578 -13.458 -4.538 108 HB3 ASP 12 3HB ASP 12 -1.371 -14.682 -4.911 109 H GLU 13 H GLU 13 0.827 -13.905 -6.768 110 HA GLU 13 HA GLU 13 3.019 -14.648 -5.184 111 HB2 GLU 13 2HB GLU 13 2.810 -14.282 -8.191 112 HB3 GLU 13 3HB GLU 13 4.211 -14.996 -7.398 113 HG2 GLU 13 2HG GLU 13 2.796 -16.830 -6.538 114 HG3 GLU 13 3HG GLU 13 1.387 -16.115 -7.321 115 H LEU 14 H LEU 14 2.383 -11.676 -6.930 116 HA LEU 14 HA LEU 14 4.992 -10.590 -6.906 117 HB2 LEU 14 2HB LEU 14 3.288 -9.691 -8.370 118 HB3 LEU 14 3HB LEU 14 2.274 -9.255 -7.002 119 HG LEU 14 HG LEU 14 3.824 -7.495 -6.326 120 HD11 LEU 14 1HD1 LEU 14 5.975 -8.483 -6.879 121 HD12 LEU 14 2HD1 LEU 14 5.831 -6.895 -7.625 122 HD13 LEU 14 3HD1 LEU 14 5.633 -8.350 -8.605 123 HD21 LEU 14 3HD2 LEU 14 3.270 -7.331 -9.292 124 HD22 LEU 14 1HD2 LEU 14 3.581 -5.976 -8.203 125 HD23 LEU 14 2HD2 LEU 14 2.129 -6.950 -7.997 126 H ILE 15 H ILE 15 2.316 -10.450 -4.540 127 HA ILE 15 HA ILE 15 3.387 -8.463 -2.846 128 HB ILE 15 HB ILE 15 1.613 -10.769 -1.897 129 HG12 ILE 15 2HG1 ILE 15 0.736 -8.093 -3.085 130 HG13 ILE 15 3HG1 ILE 15 0.608 -9.645 -3.894 131 HG21 ILE 15 1HG2 ILE 15 2.030 -7.945 -0.820 132 HG22 ILE 15 2HG2 ILE 15 2.602 -9.441 -0.078 133 HG23 ILE 15 3HG2 ILE 15 0.879 -9.115 -0.184 134 HD11 ILE 15 3HD1 ILE 15 -1.529 -8.914 -3.021 135 HD12 ILE 15 1HD1 ILE 15 -0.866 -8.837 -1.389 136 HD13 ILE 15 2HD1 ILE 15 -1.004 -10.391 -2.216 137 H LYS 16 H LYS 16 3.831 -11.959 -2.987 138 HA LYS 16 HA LYS 16 5.212 -12.479 -0.611 139 HB2 LYS 16 2HB LYS 16 5.758 -13.825 -3.298 140 HB3 LYS 16 3HB LYS 16 6.014 -14.514 -1.694 141 HG2 LYS 16 2HG LYS 16 3.563 -14.467 -1.305 142 HG3 LYS 16 3HG LYS 16 3.334 -13.830 -2.936 143 HD2 LYS 16 2HD LYS 16 4.412 -15.918 -3.838 144 HD3 LYS 16 3HD LYS 16 4.473 -16.550 -2.188 145 HE2 LYS 16 2HE LYS 16 1.985 -15.863 -3.784 146 HE3 LYS 16 3HE LYS 16 2.537 -17.472 -3.319 147 HZ1 LYS 16 3HZ LYS 16 1.566 -15.337 -1.500 148 HZ2 LYS 16 1HZ LYS 16 2.214 -16.812 -0.979 149 HZ3 LYS 16 2HZ LYS 16 0.780 -16.783 -1.878 150 H LYS 17 H LYS 17 6.391 -11.329 -3.740 151 HA LYS 17 HA LYS 17 9.187 -11.322 -3.171 152 HB2 LYS 17 2HB LYS 17 7.713 -9.555 -5.171 153 HB3 LYS 17 3HB LYS 17 9.417 -9.988 -5.205 154 HG2 LYS 17 2HG LYS 17 8.792 -12.341 -5.690 155 HG3 LYS 17 3HG LYS 17 7.085 -11.874 -5.685 156 HD2 LYS 17 2HD LYS 17 7.545 -10.283 -7.564 157 HD3 LYS 17 3HD LYS 17 9.226 -10.826 -7.590 158 HE2 LYS 17 2HE LYS 17 8.013 -11.932 -9.364 159 HE3 LYS 17 3HE LYS 17 8.412 -13.132 -8.134 160 HZ1 LYS 17 3HZ LYS 17 5.780 -11.789 -8.455 161 HZ2 LYS 17 1HZ LYS 17 6.156 -12.959 -7.289 162 HZ3 LYS 17 2HZ LYS 17 6.150 -13.365 -8.929 163 H ILE 18 H ILE 18 6.637 -8.849 -3.088 164 HA ILE 18 HA ILE 18 8.209 -6.577 -2.470 165 HB ILE 18 HB ILE 18 5.225 -7.094 -2.045 166 HG12 ILE 18 2HG1 ILE 18 6.695 -5.628 -4.289 167 HG13 ILE 18 3HG1 ILE 18 5.947 -7.214 -4.419 168 HG21 ILE 18 1HG2 ILE 18 4.957 -4.622 -1.892 169 HG22 ILE 18 2HG2 ILE 18 6.710 -4.443 -1.897 170 HG23 ILE 18 3HG2 ILE 18 5.914 -5.273 -0.558 171 HD11 ILE 18 3HD1 ILE 18 3.748 -6.190 -4.061 172 HD12 ILE 18 1HD1 ILE 18 4.585 -5.532 -5.467 173 HD13 ILE 18 2HD1 ILE 18 4.512 -4.600 -3.972 174 H LYS 19 H LYS 19 6.584 -8.990 -0.486 175 HA LYS 19 HA LYS 19 6.680 -7.728 2.032 176 HB2 LYS 19 2HB LYS 19 6.523 -10.653 1.213 177 HB3 LYS 19 3HB LYS 19 6.588 -10.174 2.908 178 HG2 LYS 19 2HG LYS 19 4.516 -8.901 2.666 179 HG3 LYS 19 3HG LYS 19 4.456 -9.284 0.943 180 HD2 LYS 19 2HD LYS 19 2.935 -10.725 2.293 181 HD3 LYS 19 3HD LYS 19 4.160 -11.650 1.424 182 HE2 LYS 19 2HE LYS 19 5.488 -11.853 3.496 183 HE3 LYS 19 3HE LYS 19 4.284 -10.906 4.370 184 HZ1 LYS 19 3HZ LYS 19 3.994 -13.259 4.744 185 HZ2 LYS 19 1HZ LYS 19 3.820 -13.544 3.085 186 HZ3 LYS 19 2HZ LYS 19 2.661 -12.633 3.916 187 H LYS 20 H LYS 20 8.834 -10.203 0.588 188 HA LYS 20 HA LYS 20 10.701 -10.129 2.747 189 HB2 LYS 20 2HB LYS 20 11.041 -11.268 -0.066 190 HB3 LYS 20 3HB LYS 20 12.106 -11.591 1.302 191 HG2 LYS 20 2HG LYS 20 9.190 -12.378 1.045 192 HG3 LYS 20 3HG LYS 20 10.582 -13.464 1.018 193 HD2 LYS 20 2HD LYS 20 11.045 -13.030 3.367 194 HD3 LYS 20 3HD LYS 20 9.843 -11.740 3.418 195 HE2 LYS 20 2HE LYS 20 8.083 -13.490 2.932 196 HE3 LYS 20 3HE LYS 20 9.336 -14.717 3.157 197 HZ1 LYS 20 3HZ LYS 20 9.692 -13.899 5.392 198 HZ2 LYS 20 1HZ LYS 20 8.069 -14.315 5.187 199 HZ3 LYS 20 2HZ LYS 20 8.535 -12.689 5.176 200 H GLU 21 H GLU 21 10.382 -8.301 -0.179 201 HA GLU 21 HA GLU 21 12.900 -7.081 -0.389 202 HB2 GLU 21 2HB GLU 21 11.055 -6.956 -2.088 203 HB3 GLU 21 3HB GLU 21 10.148 -5.909 -1.008 204 HG2 GLU 21 2HG GLU 21 11.188 -4.579 -2.736 205 HG3 GLU 21 3HG GLU 21 11.935 -4.203 -1.186 206 H VAL 22 H VAL 22 9.956 -6.075 1.378 207 HA VAL 22 HA VAL 22 11.273 -3.749 2.521 208 HB VAL 22 HB VAL 22 9.109 -3.186 3.511 209 HG11 VAL 22 1HG1 VAL 22 7.807 -2.841 1.448 210 HG12 VAL 22 2HG1 VAL 22 8.829 -4.006 0.601 211 HG13 VAL 22 3HG1 VAL 22 9.520 -2.497 1.202 212 HG21 VAL 22 3HG2 VAL 22 8.086 -5.824 2.400 213 HG22 VAL 22 1HG2 VAL 22 7.085 -4.558 3.120 214 HG23 VAL 22 2HG2 VAL 22 8.276 -5.409 4.104 215 H GLU 23 H GLU 23 10.523 -7.001 3.559 216 HA GLU 23 HA GLU 23 10.627 -6.610 6.386 217 HB2 GLU 23 2HB GLU 23 10.895 -9.084 4.640 218 HB3 GLU 23 3HB GLU 23 11.129 -9.178 6.384 219 HG2 GLU 23 2HG GLU 23 8.833 -8.354 6.746 220 HG3 GLU 23 3HG GLU 23 8.600 -8.242 5.001 221 H ASN 24 H ASN 24 13.098 -7.173 3.928 222 HA ASN 24 HA ASN 24 15.377 -7.634 5.457 223 HB2 ASN 24 2HB ASN 24 15.102 -5.853 2.983 224 HB3 ASN 24 3HB ASN 24 16.646 -6.366 3.657 225 HD21 ASN 24 1HD2 ASN 24 15.556 -6.830 1.015 226 HD22 ASN 24 2HD2 ASN 24 15.548 -8.540 0.794 227 H GLN 25 H GLN 25 13.609 -4.663 4.862 228 HA GLN 25 HA GLN 25 15.502 -3.006 6.378 229 HB2 GLN 25 2HB GLN 25 13.186 -2.298 4.536 230 HB3 GLN 25 3HB GLN 25 14.204 -1.123 5.355 231 HG2 GLN 25 2HG GLN 25 15.139 -3.127 3.285 232 HG3 GLN 25 3HG GLN 25 14.886 -1.405 3.019 233 HE21 GLN 25 1HE2 GLN 25 16.085 -0.584 5.557 234 HE22 GLN 25 2HE2 GLN 25 17.782 -0.824 5.382 235 H GLY 26 H GLY 26 13.055 -4.869 7.307 236 HA2 GLY 26 2HA GLY 26 12.156 -5.019 9.418 237 HA3 GLY 26 3HA GLY 26 12.797 -3.430 9.789 238 H TYR 27 H TYR 27 10.599 -4.179 7.108 239 HA TYR 27 HA TYR 27 8.499 -2.493 8.266 240 HB2 TYR 27 2HB TYR 27 8.856 -3.810 5.561 241 HB3 TYR 27 3HB TYR 27 7.298 -3.148 6.039 242 HD1 TYR 27 HD1 TYR 27 10.918 -2.143 5.724 243 HD2 TYR 27 HD2 TYR 27 6.828 -0.896 5.563 244 HE1 TYR 27 HE1 TYR 27 11.628 0.090 4.974 245 HE2 TYR 27 HE2 TYR 27 7.543 1.330 4.815 246 HH TYR 27 HH TYR 27 10.717 2.023 3.796 247 H GLN 28 H GLN 28 6.926 -3.279 9.437 248 HA GLN 28 HA GLN 28 6.571 -6.089 9.971 249 HB2 GLN 28 2HB GLN 28 6.386 -4.439 11.775 250 HB3 GLN 28 3HB GLN 28 5.136 -3.562 10.904 251 HG2 GLN 28 2HG GLN 28 3.585 -5.449 11.211 252 HG3 GLN 28 3HG GLN 28 4.838 -6.345 12.071 253 HE21 GLN 28 1HE2 GLN 28 2.757 -3.511 12.188 254 HE22 GLN 28 2HE2 GLN 28 2.850 -3.270 13.897 255 H VAL 29 H VAL 29 5.389 -7.343 8.631 256 HA VAL 29 HA VAL 29 3.424 -6.141 6.811 257 HB VAL 29 HB VAL 29 4.514 -8.996 6.766 258 HG11 VAL 29 1HG1 VAL 29 2.357 -8.742 5.605 259 HG12 VAL 29 2HG1 VAL 29 3.654 -9.037 4.446 260 HG13 VAL 29 3HG1 VAL 29 3.011 -7.408 4.651 261 HG21 VAL 29 3HG2 VAL 29 6.024 -8.253 4.947 262 HG22 VAL 29 1HG2 VAL 29 6.367 -7.397 6.456 263 HG23 VAL 29 2HG2 VAL 29 5.473 -6.589 5.167 264 H ARG 30 H ARG 30 1.318 -6.480 6.976 265 HA ARG 30 HA ARG 30 0.191 -8.798 8.371 266 HB2 ARG 30 2HB ARG 30 0.094 -7.078 10.099 267 HB3 ARG 30 3HB ARG 30 -0.524 -5.882 8.960 268 HG2 ARG 30 2HG ARG 30 -2.601 -7.190 8.721 269 HG3 ARG 30 3HG ARG 30 -1.996 -8.373 9.879 270 HD2 ARG 30 2HD ARG 30 -2.145 -6.821 11.680 271 HD3 ARG 30 3HD ARG 30 -2.339 -5.449 10.579 272 HE ARG 30 HE ARG 30 -4.495 -6.566 9.897 273 HH11 ARG 30 1HH1 ARG 30 -3.249 -6.966 13.169 274 HH12 ARG 30 2HH1 ARG 30 -4.819 -7.202 13.852 275 HH21 ARG 30 1HH2 ARG 30 -6.527 -6.727 10.797 276 HH22 ARG 30 2HH2 ARG 30 -6.703 -7.065 12.494 277 H ASP 31 H ASP 31 -1.923 -9.317 7.557 278 HA ASP 31 HA ASP 31 -2.632 -8.074 4.958 279 HB2 ASP 31 2HB ASP 31 -3.413 -10.322 4.253 280 HB3 ASP 31 3HB ASP 31 -1.705 -10.330 4.654 281 H VAL 32 H VAL 32 -4.814 -7.844 4.475 282 HA VAL 32 HA VAL 32 -6.701 -7.804 6.729 283 HB VAL 32 HB VAL 32 -7.193 -6.765 3.894 284 HG11 VAL 32 1HG1 VAL 32 -8.898 -5.351 4.981 285 HG12 VAL 32 2HG1 VAL 32 -8.517 -6.079 6.543 286 HG13 VAL 32 3HG1 VAL 32 -9.210 -7.068 5.253 287 HG21 VAL 32 3HG2 VAL 32 -6.556 -4.514 4.662 288 HG22 VAL 32 1HG2 VAL 32 -5.193 -5.635 4.747 289 HG23 VAL 32 2HG2 VAL 32 -6.054 -5.180 6.218 290 H ASN 33 H ASN 33 -8.109 -9.491 6.935 291 HA ASN 33 HA ASN 33 -8.528 -11.351 4.665 292 HB2 ASN 33 2HB ASN 33 -8.926 -11.773 7.657 293 HB3 ASN 33 3HB ASN 33 -9.280 -12.982 6.429 294 HD21 ASN 33 1HD2 ASN 33 -6.766 -11.285 8.129 295 HD22 ASN 33 2HD2 ASN 33 -5.456 -12.276 7.600 296 H ASP 34 H ASP 34 -10.122 -8.870 6.310 297 HA ASP 34 HA ASP 34 -12.587 -9.134 4.940 298 HB2 ASP 34 2HB ASP 34 -12.837 -10.989 6.692 299 HB3 ASP 34 3HB ASP 34 -12.794 -9.747 7.935 300 H SER 35 H SER 35 -14.222 -7.420 5.766 301 HA SER 35 HA SER 35 -13.071 -4.899 6.304 302 HB2 SER 35 2HB SER 35 -15.344 -5.312 5.252 303 HB3 SER 35 3HB SER 35 -15.959 -5.730 6.853 304 HG SER 35 HG SER 35 -15.217 -3.243 5.799 305 H ASP 36 H ASP 36 -14.190 -7.453 8.387 306 HA ASP 36 HA ASP 36 -14.361 -6.111 10.868 307 HB2 ASP 36 2HB ASP 36 -15.253 -8.450 10.300 308 HB3 ASP 36 3HB ASP 36 -13.599 -9.039 10.396 309 H GLU 37 H GLU 37 -11.794 -8.009 9.318 310 HA GLU 37 HA GLU 37 -9.746 -7.626 11.215 311 HB2 GLU 37 2HB GLU 37 -9.525 -8.168 8.215 312 HB3 GLU 37 3HB GLU 37 -8.225 -8.384 9.385 313 HG2 GLU 37 2HG GLU 37 -10.840 -9.919 9.340 314 HG3 GLU 37 3HG GLU 37 -9.280 -10.520 8.786 315 H LEU 38 H LEU 38 -10.772 -5.806 8.399 316 HA LEU 38 HA LEU 38 -8.676 -4.011 8.048 317 HB2 LEU 38 2HB LEU 38 -10.563 -4.373 6.454 318 HB3 LEU 38 3HB LEU 38 -11.652 -3.579 7.578 319 HG LEU 38 HG LEU 38 -10.315 -1.452 7.295 320 HD11 LEU 38 1HD1 LEU 38 -8.894 -2.984 5.103 321 HD12 LEU 38 2HD1 LEU 38 -8.184 -2.378 6.603 322 HD13 LEU 38 3HD1 LEU 38 -8.778 -1.245 5.393 323 HD21 LEU 38 3HD2 LEU 38 -11.513 -2.582 4.746 324 HD22 LEU 38 1HD2 LEU 38 -11.220 -0.873 5.086 325 HD23 LEU 38 2HD2 LEU 38 -12.392 -1.772 6.046 326 H LYS 39 H LYS 39 -11.718 -3.587 9.937 327 HA LYS 39 HA LYS 39 -10.977 -1.008 10.905 328 HB2 LYS 39 2HB LYS 39 -12.989 -1.132 12.328 329 HB3 LYS 39 3HB LYS 39 -13.313 -1.504 10.650 330 HG2 LYS 39 2HG LYS 39 -14.661 -3.025 11.758 331 HG3 LYS 39 3HG LYS 39 -13.234 -4.003 11.425 332 HD2 LYS 39 2HD LYS 39 -12.540 -3.973 13.685 333 HD3 LYS 39 3HD LYS 39 -13.490 -2.534 14.055 334 HE2 LYS 39 2HE LYS 39 -14.489 -4.490 15.107 335 HE3 LYS 39 3HE LYS 39 -15.562 -3.859 13.856 336 HZ1 LYS 39 3HZ LYS 39 -13.730 -6.158 13.475 337 HZ2 LYS 39 1HZ LYS 39 -14.910 -5.591 12.405 338 HZ3 LYS 39 2HZ LYS 39 -15.373 -6.291 13.871 339 H LYS 40 H LYS 40 -10.506 -4.265 12.174 340 HA LYS 40 HA LYS 40 -9.611 -3.640 14.772 341 HB2 LYS 40 2HB LYS 40 -8.681 -5.845 12.897 342 HB3 LYS 40 3HB LYS 40 -8.121 -5.699 14.553 343 HG2 LYS 40 2HG LYS 40 -10.842 -5.745 14.940 344 HG3 LYS 40 3HG LYS 40 -10.692 -6.748 13.494 345 HD2 LYS 40 2HD LYS 40 -8.925 -8.099 14.727 346 HD3 LYS 40 3HD LYS 40 -9.317 -7.176 16.180 347 HE2 LYS 40 2HE LYS 40 -10.530 -9.232 16.318 348 HE3 LYS 40 3HE LYS 40 -11.714 -7.991 15.895 349 HZ1 LYS 40 3HZ LYS 40 -11.492 -8.668 13.564 350 HZ2 LYS 40 1HZ LYS 40 -12.034 -9.928 14.542 351 HZ3 LYS 40 2HZ LYS 40 -10.432 -9.901 14.011 352 H GLU 41 H GLU 41 -7.742 -3.851 11.702 353 HA GLU 41 HA GLU 41 -5.329 -2.932 12.979 354 HB2 GLU 41 2HB GLU 41 -4.317 -3.001 10.708 355 HB3 GLU 41 3HB GLU 41 -5.032 -4.511 11.229 356 HG2 GLU 41 2HG GLU 41 -7.098 -3.711 9.832 357 HG3 GLU 41 3HG GLU 41 -5.930 -2.639 9.063 358 H MET 42 H MET 42 -8.019 -1.357 11.433 359 HA MET 42 HA MET 42 -6.735 1.144 10.972 360 HB2 MET 42 2HB MET 42 -9.668 0.529 11.512 361 HB3 MET 42 3HB MET 42 -9.074 2.156 11.190 362 HG2 MET 42 2HG MET 42 -9.060 -0.208 9.310 363 HG3 MET 42 3HG MET 42 -9.944 1.306 9.139 364 HE1 MET 42 3HE MET 42 -6.946 3.810 8.366 365 HE2 MET 42 1HE MET 42 -7.521 3.429 9.991 366 HE3 MET 42 2HE MET 42 -8.674 3.681 8.682 367 H LYS 43 H LYS 43 -8.116 -0.328 13.896 368 HA LYS 43 HA LYS 43 -7.636 1.908 15.602 369 HB2 LYS 43 2HB LYS 43 -8.137 -1.001 16.003 370 HB3 LYS 43 3HB LYS 43 -7.244 -0.231 17.300 371 HG2 LYS 43 2HG LYS 43 -9.580 -0.263 17.851 372 HG3 LYS 43 3HG LYS 43 -9.079 1.402 17.591 373 HD2 LYS 43 2HD LYS 43 -10.419 -0.171 15.374 374 HD3 LYS 43 3HD LYS 43 -11.379 0.570 16.649 375 HE2 LYS 43 2HE LYS 43 -10.433 2.792 16.027 376 HE3 LYS 43 3HE LYS 43 -9.552 2.021 14.705 377 HZ1 LYS 43 3HZ LYS 43 -11.678 1.315 13.773 378 HZ2 LYS 43 1HZ LYS 43 -11.590 2.998 13.906 379 HZ3 LYS 43 2HZ LYS 43 -12.499 2.106 15.015 380 H LYS 44 H LYS 44 -5.493 -0.681 14.464 381 HA LYS 44 HA LYS 44 -3.235 -0.043 16.075 382 HB2 LYS 44 2HB LYS 44 -3.212 -1.324 13.300 383 HB3 LYS 44 3HB LYS 44 -1.922 -1.408 14.490 384 HG2 LYS 44 2HG LYS 44 -4.682 -2.620 14.834 385 HG3 LYS 44 3HG LYS 44 -3.253 -3.507 14.312 386 HD2 LYS 44 2HD LYS 44 -3.507 -2.082 16.984 387 HD3 LYS 44 3HD LYS 44 -3.821 -3.799 16.735 388 HE2 LYS 44 2HE LYS 44 -1.484 -4.141 16.037 389 HE3 LYS 44 3HE LYS 44 -1.165 -2.414 16.244 390 HZ1 LYS 44 3HZ LYS 44 -1.702 -2.632 18.586 391 HZ2 LYS 44 1HZ LYS 44 -0.438 -3.673 18.167 392 HZ3 LYS 44 2HZ LYS 44 -1.997 -4.285 18.395 393 H LEU 45 H LEU 45 -4.326 1.097 12.888 394 HA LEU 45 HA LEU 45 -1.929 2.572 12.259 395 HB2 LEU 45 2HB LEU 45 -4.667 2.685 10.916 396 HB3 LEU 45 3HB LEU 45 -3.158 3.270 10.232 397 HG LEU 45 HG LEU 45 -3.810 0.361 10.804 398 HD11 LEU 45 1HD1 LEU 45 -3.726 1.771 8.133 399 HD12 LEU 45 2HD1 LEU 45 -5.164 1.180 8.966 400 HD13 LEU 45 3HD1 LEU 45 -3.956 0.038 8.387 401 HD21 LEU 45 3HD2 LEU 45 -1.761 -0.200 9.585 402 HD22 LEU 45 1HD2 LEU 45 -1.428 0.746 11.034 403 HD23 LEU 45 2HD2 LEU 45 -1.370 1.516 9.449 404 H ALA 46 H ALA 46 -5.222 3.429 13.341 405 HA ALA 46 HA ALA 46 -4.672 6.302 13.157 406 HB1 ALA 46 3HB ALA 46 -7.083 6.590 13.501 407 HB2 ALA 46 1HB ALA 46 -7.266 4.858 13.810 408 HB3 ALA 46 2HB ALA 46 -6.773 5.424 12.214 409 H GLU 47 H GLU 47 -5.722 3.944 15.668 410 HA GLU 47 HA GLU 47 -5.873 6.010 17.701 411 HB2 GLU 47 2HB GLU 47 -6.182 2.987 17.921 412 HB3 GLU 47 3HB GLU 47 -6.457 4.115 19.242 413 HG2 GLU 47 2HG GLU 47 -8.027 3.985 16.650 414 HG3 GLU 47 3HG GLU 47 -8.571 3.420 18.228 415 H GLU 48 H GLU 48 -3.799 3.174 17.102 416 HA GLU 48 HA GLU 48 -1.916 3.918 19.195 417 HB2 GLU 48 2HB GLU 48 -1.830 1.708 17.102 418 HB3 GLU 48 3HB GLU 48 -0.639 1.923 18.382 419 HG2 GLU 48 2HG GLU 48 -2.390 1.544 20.081 420 HG3 GLU 48 3HG GLU 48 -3.586 1.347 18.798 421 H LYS 49 H LYS 49 -1.553 6.016 18.346 422 HA LYS 49 HA LYS 49 -0.197 6.418 15.823 423 HB2 LYS 49 2HB LYS 49 -1.856 8.043 16.750 424 HB3 LYS 49 3HB LYS 49 -0.774 8.369 18.099 425 HG2 LYS 49 2HG LYS 49 0.893 9.319 16.567 426 HG3 LYS 49 3HG LYS 49 -0.123 8.920 15.182 427 HD2 LYS 49 2HD LYS 49 -0.851 10.869 17.403 428 HD3 LYS 49 3HD LYS 49 -0.287 11.318 15.794 429 HE2 LYS 49 2HE LYS 49 -2.297 10.333 14.787 430 HE3 LYS 49 3HE LYS 49 -2.848 9.784 16.372 431 HZ1 LYS 49 3HZ LYS 49 -2.494 12.611 15.530 432 HZ2 LYS 49 1HZ LYS 49 -2.973 12.109 17.072 433 HZ3 LYS 49 2HZ LYS 49 -3.961 11.807 15.738 434 H ASN 50 H ASN 50 1.613 5.104 16.133 435 HA ASN 50 HA ASN 50 3.851 6.387 17.576 436 HB2 ASN 50 2HB ASN 50 3.009 4.335 18.849 437 HB3 ASN 50 3HB ASN 50 3.443 3.350 17.458 438 HD21 ASN 50 1HD2 ASN 50 4.460 3.109 20.134 439 HD22 ASN 50 2HD2 ASN 50 6.164 3.376 20.070 440 H PHE 51 H PHE 51 5.602 6.635 16.258 441 HA PHE 51 HA PHE 51 5.350 6.212 13.463 442 HB2 PHE 51 2HB PHE 51 6.680 8.078 14.538 443 HB3 PHE 51 3HB PHE 51 7.901 6.899 15.000 444 HD1 PHE 51 HD1 PHE 51 9.312 5.798 13.220 445 HD2 PHE 51 HD2 PHE 51 6.511 8.889 12.251 446 HE1 PHE 51 HE1 PHE 51 10.381 6.086 11.022 447 HE2 PHE 51 HE2 PHE 51 7.596 9.174 10.061 448 HZ PHE 51 HZ PHE 51 9.522 7.776 9.447 449 H GLU 52 H GLU 52 5.606 4.337 12.420 450 HA GLU 52 HA GLU 52 7.851 2.585 12.841 451 HB2 GLU 52 2HB GLU 52 6.512 0.546 13.331 452 HB3 GLU 52 3HB GLU 52 6.379 1.743 14.614 453 HG2 GLU 52 2HG GLU 52 4.173 2.443 13.726 454 HG3 GLU 52 3HG GLU 52 4.299 1.213 12.469 455 H LYS 53 H LYS 53 7.690 0.674 11.363 456 HA LYS 53 HA LYS 53 6.758 1.553 8.712 457 HB2 LYS 53 2HB LYS 53 8.855 -0.469 9.614 458 HB3 LYS 53 3HB LYS 53 8.434 -0.173 7.929 459 HG2 LYS 53 2HG LYS 53 9.260 2.084 8.028 460 HG3 LYS 53 3HG LYS 53 9.481 1.989 9.779 461 HD2 LYS 53 2HD LYS 53 11.269 0.354 9.514 462 HD3 LYS 53 3HD LYS 53 10.990 0.270 7.771 463 HE2 LYS 53 2HE LYS 53 11.925 2.730 9.284 464 HE3 LYS 53 3HE LYS 53 12.952 1.658 8.327 465 HZ1 LYS 53 3HZ LYS 53 12.287 3.640 7.100 466 HZ2 LYS 53 1HZ LYS 53 10.665 3.220 7.260 467 HZ3 LYS 53 2HZ LYS 53 11.708 2.243 6.356 468 H ILE 54 H ILE 54 5.039 0.555 7.838 469 HA ILE 54 HA ILE 54 4.288 -2.192 8.654 470 HB ILE 54 HB ILE 54 2.296 0.118 8.307 471 HG12 ILE 54 2HG1 ILE 54 3.147 -1.255 10.903 472 HG13 ILE 54 3HG1 ILE 54 3.627 0.365 10.412 473 HG21 ILE 54 1HG2 ILE 54 0.595 -1.480 9.124 474 HG22 ILE 54 2HG2 ILE 54 1.817 -2.747 9.233 475 HG23 ILE 54 3HG2 ILE 54 1.370 -2.087 7.658 476 HD11 ILE 54 3HD1 ILE 54 1.277 1.068 10.490 477 HD12 ILE 54 1HD1 ILE 54 1.872 0.468 12.038 478 HD13 ILE 54 2HD1 ILE 54 0.828 -0.549 11.047 479 H LEU 55 H LEU 55 4.036 -3.463 6.893 480 HA LEU 55 HA LEU 55 3.156 -2.317 4.309 481 HB2 LEU 55 2HB LEU 55 5.237 -3.754 4.307 482 HB3 LEU 55 3HB LEU 55 4.280 -5.093 4.921 483 HG LEU 55 HG LEU 55 2.830 -4.830 2.781 484 HD11 LEU 55 1HD1 LEU 55 5.204 -3.179 1.912 485 HD12 LEU 55 2HD1 LEU 55 3.535 -2.633 2.106 486 HD13 LEU 55 3HD1 LEU 55 3.938 -3.797 0.849 487 HD21 LEU 55 3HD2 LEU 55 4.297 -6.185 1.399 488 HD22 LEU 55 1HD2 LEU 55 4.383 -6.710 3.079 489 HD23 LEU 55 2HD2 LEU 55 5.689 -5.746 2.390 490 H ILE 56 H ILE 56 1.041 -2.692 3.748 491 HA ILE 56 HA ILE 56 -0.490 -4.789 5.169 492 HB ILE 56 HB ILE 56 -1.516 -2.317 3.707 493 HG12 ILE 56 2HG1 ILE 56 -0.506 -1.766 5.911 494 HG13 ILE 56 3HG1 ILE 56 -2.245 -1.515 5.938 495 HG21 ILE 56 1HG2 ILE 56 -3.101 -4.477 5.151 496 HG22 ILE 56 2HG2 ILE 56 -3.113 -4.143 3.417 497 HG23 ILE 56 3HG2 ILE 56 -3.768 -2.961 4.545 498 HD11 ILE 56 3HD1 ILE 56 -1.464 -2.509 8.003 499 HD12 ILE 56 1HD1 ILE 56 -0.775 -3.872 7.123 500 HD13 ILE 56 2HD1 ILE 56 -2.525 -3.631 7.154 501 H LYS 57 H LYS 57 -1.115 -6.486 4.064 502 HA LYS 57 HA LYS 57 -0.817 -6.695 1.157 503 HB2 LYS 57 2HB LYS 57 0.316 -8.366 2.592 504 HB3 LYS 57 3HB LYS 57 -1.195 -8.765 3.379 505 HG2 LYS 57 2HG LYS 57 -0.812 -9.226 0.420 506 HG3 LYS 57 3HG LYS 57 -0.214 -10.383 1.602 507 HD2 LYS 57 2HD LYS 57 -2.566 -10.645 2.458 508 HD3 LYS 57 3HD LYS 57 -3.121 -9.563 1.179 509 HE2 LYS 57 2HE LYS 57 -2.240 -11.152 -0.511 510 HE3 LYS 57 3HE LYS 57 -1.743 -12.237 0.786 511 HZ1 LYS 57 3HZ LYS 57 -4.131 -12.315 1.453 512 HZ2 LYS 57 1HZ LYS 57 -3.799 -13.000 -0.059 513 HZ3 LYS 57 2HZ LYS 57 -4.501 -11.470 0.037 514 H SER 58 H SER 58 -2.611 -6.632 -0.085 515 HA SER 58 HA SER 58 -5.046 -7.959 0.685 516 HB2 SER 58 2HB SER 58 -5.434 -5.743 1.737 517 HB3 SER 58 3HB SER 58 -5.097 -4.943 0.205 518 HG SER 58 HG SER 58 -7.160 -5.148 -0.137 519 H ASN 59 H ASN 59 -6.319 -8.449 -1.099 520 HA ASN 59 HA ASN 59 -5.338 -7.660 -3.794 521 HB2 ASN 59 2HB ASN 59 -6.781 -10.229 -2.982 522 HB3 ASN 59 3HB ASN 59 -6.262 -9.819 -4.617 523 HD21 ASN 59 1HD2 ASN 59 -4.029 -9.986 -5.138 524 HD22 ASN 59 2HD2 ASN 59 -2.903 -10.779 -4.095 525 H ASP 60 H ASP 60 -7.487 -6.714 -1.680 526 HA ASP 60 HA ASP 60 -9.738 -6.355 -3.579 527 HB2 ASP 60 2HB ASP 60 -9.820 -6.483 -0.527 528 HB3 ASP 60 3HB ASP 60 -11.198 -6.083 -1.549 529 H LYS 61 H LYS 61 -9.337 -4.396 -4.425 530 HA LYS 61 HA LYS 61 -8.028 -2.201 -3.298 531 HB2 LYS 61 2HB LYS 61 -8.929 -0.923 -5.208 532 HB3 LYS 61 3HB LYS 61 -8.377 -2.511 -5.725 533 HG2 LYS 61 2HG LYS 61 -10.671 -3.332 -5.821 534 HG3 LYS 61 3HG LYS 61 -11.281 -1.804 -5.183 535 HD2 LYS 61 2HD LYS 61 -10.496 -0.643 -7.240 536 HD3 LYS 61 3HD LYS 61 -9.886 -2.177 -7.871 537 HE2 LYS 61 2HE LYS 61 -12.180 -3.094 -7.872 538 HE3 LYS 61 3HE LYS 61 -12.796 -1.572 -7.221 539 HZ1 LYS 61 3HZ LYS 61 -11.395 -1.832 -9.823 540 HZ2 LYS 61 1HZ LYS 61 -12.172 -0.459 -9.224 541 HZ3 LYS 61 2HZ LYS 61 -13.073 -1.823 -9.647 542 H GLN 62 H GLN 62 -11.272 -3.286 -2.885 543 HA GLN 62 HA GLN 62 -12.677 -0.929 -2.233 544 HB2 GLN 62 2HB GLN 62 -13.104 -3.854 -1.502 545 HB3 GLN 62 3HB GLN 62 -14.249 -2.600 -1.048 546 HG2 GLN 62 2HG GLN 62 -13.463 -3.259 -3.901 547 HG3 GLN 62 3HG GLN 62 -14.913 -3.848 -3.090 548 HE21 GLN 62 1HE2 GLN 62 -16.580 -2.367 -2.602 549 HE22 GLN 62 2HE2 GLN 62 -16.708 -0.842 -3.399 550 H LEU 63 H LEU 63 -10.981 -3.275 -0.216 551 HA LEU 63 HA LEU 63 -11.628 -2.212 2.326 552 HB2 LEU 63 2HB LEU 63 -9.288 -3.966 1.476 553 HB3 LEU 63 3HB LEU 63 -9.780 -3.694 3.143 554 HG LEU 63 HG LEU 63 -11.499 -5.054 1.021 555 HD11 LEU 63 1HD1 LEU 63 -10.005 -6.323 3.327 556 HD12 LEU 63 2HD1 LEU 63 -9.584 -6.450 1.619 557 HD13 LEU 63 3HD1 LEU 63 -11.091 -7.148 2.205 558 HD21 LEU 63 3HD2 LEU 63 -12.885 -3.914 2.679 559 HD22 LEU 63 1HD2 LEU 63 -12.009 -4.703 3.996 560 HD23 LEU 63 2HD2 LEU 63 -12.998 -5.659 2.886 561 H LEU 64 H LEU 64 -9.047 -1.541 0.034 562 HA LEU 64 HA LEU 64 -7.413 0.064 1.754 563 HB2 LEU 64 2HB LEU 64 -7.511 -0.227 -1.268 564 HB3 LEU 64 3HB LEU 64 -6.445 0.926 -0.479 565 HG LEU 64 HG LEU 64 -5.382 -0.995 0.779 566 HD11 LEU 64 1HD1 LEU 64 -7.163 -2.635 0.630 567 HD12 LEU 64 2HD1 LEU 64 -5.671 -3.268 -0.058 568 HD13 LEU 64 3HD1 LEU 64 -6.969 -2.723 -1.123 569 HD21 LEU 64 3HD2 LEU 64 -5.211 -1.106 -2.236 570 HD22 LEU 64 1HD2 LEU 64 -4.023 -1.765 -1.105 571 HD23 LEU 64 2HD2 LEU 64 -4.308 -0.027 -1.169 572 H LYS 65 H LYS 65 -10.065 0.766 -0.534 573 HA LYS 65 HA LYS 65 -9.991 3.564 -0.542 574 HB2 LYS 65 2HB LYS 65 -12.370 1.663 -0.688 575 HB3 LYS 65 3HB LYS 65 -12.488 3.393 -1.004 576 HG2 LYS 65 2HG LYS 65 -11.149 3.238 -2.961 577 HG3 LYS 65 3HG LYS 65 -10.608 1.609 -2.549 578 HD2 LYS 65 2HD LYS 65 -12.252 1.524 -4.360 579 HD3 LYS 65 3HD LYS 65 -12.887 0.740 -2.915 580 HE2 LYS 65 2HE LYS 65 -14.247 2.732 -2.423 581 HE3 LYS 65 3HE LYS 65 -13.584 3.546 -3.844 582 HZ1 LYS 65 3HZ LYS 65 -14.539 1.802 -5.232 583 HZ2 LYS 65 1HZ LYS 65 -15.739 2.580 -4.330 584 HZ3 LYS 65 2HZ LYS 65 -15.198 1.048 -3.872 585 H GLU 66 H GLU 66 -11.910 1.386 1.532 586 HA GLU 66 HA GLU 66 -13.070 3.324 3.215 587 HB2 GLU 66 2HB GLU 66 -12.406 0.438 3.921 588 HB3 GLU 66 3HB GLU 66 -13.609 1.452 4.715 589 HG2 GLU 66 2HG GLU 66 -14.910 1.531 2.608 590 HG3 GLU 66 3HG GLU 66 -13.709 0.495 1.841 591 H MET 67 H MET 67 -10.035 1.555 3.454 592 HA MET 67 HA MET 67 -9.185 2.332 6.025 593 HB2 MET 67 2HB MET 67 -8.160 0.492 4.654 594 HB3 MET 67 3HB MET 67 -7.480 1.697 3.570 595 HG2 MET 67 2HG MET 67 -6.227 2.622 5.558 596 HG3 MET 67 3HG MET 67 -6.766 1.214 6.461 597 HE1 MET 67 3HE MET 67 -5.951 -1.317 5.883 598 HE2 MET 67 1HE MET 67 -4.999 -1.686 4.448 599 HE3 MET 67 2HE MET 67 -6.650 -1.096 4.276 600 H LEU 68 H LEU 68 -8.521 3.742 2.807 601 HA LEU 68 HA LEU 68 -6.783 5.817 3.700 602 HB2 LEU 68 2HB LEU 68 -8.207 5.335 1.056 603 HB3 LEU 68 3HB LEU 68 -7.109 6.685 1.304 604 HG LEU 68 HG LEU 68 -6.291 3.763 1.598 605 HD11 LEU 68 1HD1 LEU 68 -5.137 3.993 -0.559 606 HD12 LEU 68 2HD1 LEU 68 -5.824 5.606 -0.766 607 HD13 LEU 68 3HD1 LEU 68 -6.879 4.192 -0.729 608 HD21 LEU 68 3HD2 LEU 68 -4.592 6.275 1.488 609 HD22 LEU 68 1HD2 LEU 68 -3.996 4.616 1.580 610 HD23 LEU 68 2HD2 LEU 68 -4.912 5.295 2.922 611 H GLU 69 H GLU 69 -10.263 5.641 3.284 612 HA GLU 69 HA GLU 69 -10.901 8.393 3.342 613 HB2 GLU 69 2HB GLU 69 -12.443 5.999 4.447 614 HB3 GLU 69 3HB GLU 69 -13.107 7.626 4.363 615 HG2 GLU 69 2HG GLU 69 -12.239 5.944 1.998 616 HG3 GLU 69 3HG GLU 69 -13.901 6.228 2.515 617 H LEU 70 H LEU 70 -10.233 6.058 5.915 618 HA LEU 70 HA LEU 70 -10.711 7.939 8.078 619 HB2 LEU 70 2HB LEU 70 -9.653 5.094 8.109 620 HB3 LEU 70 3HB LEU 70 -10.146 6.006 9.530 621 HG LEU 70 HG LEU 70 -12.004 5.201 7.252 622 HD11 LEU 70 1HD1 LEU 70 -12.975 3.565 8.791 623 HD12 LEU 70 2HD1 LEU 70 -11.774 3.980 10.014 624 HD13 LEU 70 3HD1 LEU 70 -11.268 3.230 8.501 625 HD21 LEU 70 3HD2 LEU 70 -12.737 7.267 8.325 626 HD22 LEU 70 1HD2 LEU 70 -12.637 6.510 9.918 627 HD23 LEU 70 2HD2 LEU 70 -13.825 5.947 8.740 628 H ILE 71 H ILE 71 -7.935 6.679 6.325 629 HA ILE 71 HA ILE 71 -5.886 7.657 8.078 630 HB ILE 71 HB ILE 71 -5.773 6.983 5.100 631 HG12 ILE 71 2HG1 ILE 71 -4.810 5.376 7.517 632 HG13 ILE 71 3HG1 ILE 71 -6.258 5.030 6.578 633 HG21 ILE 71 1HG2 ILE 71 -3.312 6.969 5.314 634 HG22 ILE 71 2HG2 ILE 71 -3.446 7.543 6.975 635 HG23 ILE 71 3HG2 ILE 71 -3.975 8.570 5.641 636 HD11 ILE 71 3HD1 ILE 71 -4.450 3.540 5.980 637 HD12 ILE 71 1HD1 ILE 71 -3.420 4.907 5.557 638 HD13 ILE 71 2HD1 ILE 71 -4.874 4.569 4.614 639 H SER 72 H SER 72 -7.828 9.053 5.499 640 HA SER 72 HA SER 72 -6.389 11.364 4.885 641 HB2 SER 72 2HB SER 72 -8.326 10.576 3.582 642 HB3 SER 72 3HB SER 72 -9.410 10.953 4.921 643 HG SER 72 HG SER 72 -9.132 12.536 3.113 644 H LYS 73 H LYS 73 -8.258 10.593 7.719 645 HA LYS 73 HA LYS 73 -8.631 13.270 8.725 646 HB2 LYS 73 2HB LYS 73 -8.666 10.692 10.364 647 HB3 LYS 73 3HB LYS 73 -9.510 12.198 10.710 648 HG2 LYS 73 2HG LYS 73 -10.110 10.303 8.428 649 HG3 LYS 73 3HG LYS 73 -11.046 10.449 9.914 650 HD2 LYS 73 2HD LYS 73 -12.127 12.357 9.209 651 HD3 LYS 73 3HD LYS 73 -10.709 12.998 8.382 652 HE2 LYS 73 2HE LYS 73 -11.101 11.469 6.503 653 HE3 LYS 73 3HE LYS 73 -12.499 10.780 7.335 654 HZ1 LYS 73 3HZ LYS 73 -13.616 12.874 7.196 655 HZ2 LYS 73 1HZ LYS 73 -13.077 12.449 5.651 656 HZ3 LYS 73 2HZ LYS 73 -12.254 13.629 6.539 657 H LEU 74 H LEU 74 -6.207 10.774 8.969 658 HA LEU 74 HA LEU 74 -4.801 11.798 11.271 659 HB2 LEU 74 2HB LEU 74 -4.006 9.661 9.257 660 HB3 LEU 74 3HB LEU 74 -3.272 9.912 10.835 661 HG LEU 74 HG LEU 74 -6.177 9.105 10.432 662 HD11 LEU 74 1HD1 LEU 74 -4.705 7.347 9.585 663 HD12 LEU 74 2HD1 LEU 74 -5.527 6.836 11.055 664 HD13 LEU 74 3HD1 LEU 74 -3.828 7.316 11.117 665 HD21 LEU 74 3HD2 LEU 74 -6.121 8.540 12.829 666 HD22 LEU 74 1HD2 LEU 74 -5.789 10.251 12.557 667 HD23 LEU 74 2HD2 LEU 74 -4.467 9.146 12.943 668 H GLY 75 H GLY 75 -4.041 11.482 7.780 669 HA2 GLY 75 2HA GLY 75 -2.844 12.856 6.383 670 HA3 GLY 75 3HA GLY 75 -2.602 13.977 7.710 671 H TYR 76 H TYR 76 -1.382 11.086 6.118 672 HA TYR 76 HA TYR 76 1.323 11.925 6.560 673 HB2 TYR 76 2HB TYR 76 2.122 9.723 7.553 674 HB3 TYR 76 3HB TYR 76 1.229 10.748 8.652 675 HD1 TYR 76 HD2 TYR 76 0.722 7.772 6.390 676 HD2 TYR 76 HD1 TYR 76 -0.503 9.809 9.940 677 HE1 TYR 76 HE2 TYR 76 -0.711 5.869 6.998 678 HE2 TYR 76 HE1 TYR 76 -1.924 7.901 10.541 679 HH TYR 76 HH TYR 76 -1.746 4.888 8.998 680 H LYS 77 H LYS 77 2.882 10.202 5.618 681 HA LYS 77 HA LYS 77 2.135 9.740 2.908 682 HB2 LYS 77 2HB LYS 77 4.645 9.124 4.495 683 HB3 LYS 77 3HB LYS 77 4.467 8.580 2.832 684 HG2 LYS 77 2HG LYS 77 4.291 11.481 3.698 685 HG3 LYS 77 3HG LYS 77 5.754 10.709 3.083 686 HD2 LYS 77 2HD LYS 77 4.578 10.226 0.940 687 HD3 LYS 77 3HD LYS 77 3.137 11.042 1.560 688 HE2 LYS 77 2HE LYS 77 5.849 12.342 1.107 689 HE3 LYS 77 3HE LYS 77 4.436 12.509 0.066 690 HZ1 LYS 77 3HZ LYS 77 4.690 14.397 1.544 691 HZ2 LYS 77 1HZ LYS 77 4.590 13.386 2.894 692 HZ3 LYS 77 2HZ LYS 77 3.255 13.567 1.876 693 H VAL 78 H VAL 78 0.751 8.197 2.448 694 HA VAL 78 HA VAL 78 1.389 5.410 3.210 695 HB VAL 78 HB VAL 78 -1.224 6.489 2.037 696 HG11 VAL 78 1HG1 VAL 78 -0.766 4.177 1.320 697 HG12 VAL 78 2HG1 VAL 78 -2.121 4.224 2.447 698 HG13 VAL 78 3HG1 VAL 78 -0.532 3.689 3.000 699 HG21 VAL 78 3HG2 VAL 78 -2.217 6.001 4.241 700 HG22 VAL 78 1HG2 VAL 78 -0.924 7.197 4.373 701 HG23 VAL 78 2HG2 VAL 78 -0.631 5.526 4.856 702 H PHE 79 H PHE 79 2.287 4.222 1.655 703 HA PHE 79 HA PHE 79 2.578 5.312 -1.064 704 HB2 PHE 79 2HB PHE 79 4.158 3.117 0.367 705 HB3 PHE 79 3HB PHE 79 4.553 3.852 -1.183 706 HD1 PHE 79 HD1 PHE 79 5.240 6.294 -1.249 707 HD2 PHE 79 HD2 PHE 79 4.900 4.135 2.429 708 HE1 PHE 79 HE1 PHE 79 6.613 7.990 -0.120 709 HE2 PHE 79 HE2 PHE 79 6.281 5.839 3.550 710 HZ PHE 79 HZ PHE 79 7.135 7.765 2.276 711 H LEU 80 H LEU 80 0.994 4.488 -2.334 712 HA LEU 80 HA LEU 80 0.078 1.707 -1.929 713 HB2 LEU 80 2HB LEU 80 -1.729 3.274 -1.725 714 HB3 LEU 80 3HB LEU 80 -1.266 4.120 -3.192 715 HG LEU 80 HG LEU 80 -2.015 2.235 -4.579 716 HD11 LEU 80 1HD1 LEU 80 -1.457 0.357 -3.138 717 HD12 LEU 80 2HD1 LEU 80 -3.134 0.265 -3.669 718 HD13 LEU 80 3HD1 LEU 80 -2.757 0.795 -2.027 719 HD21 LEU 80 3HD2 LEU 80 -4.416 2.351 -4.189 720 HD22 LEU 80 1HD2 LEU 80 -3.678 3.934 -3.960 721 HD23 LEU 80 2HD2 LEU 80 -4.151 2.972 -2.557 722 H LEU 81 H LEU 81 0.449 0.243 -3.409 723 HA LEU 81 HA LEU 81 1.357 1.006 -6.116 724 HB2 LEU 81 2HB LEU 81 3.204 0.054 -4.714 725 HB3 LEU 81 3HB LEU 81 2.257 -1.404 -4.494 726 HG LEU 81 HG LEU 81 2.371 -1.859 -6.938 727 HD11 LEU 81 1HD1 LEU 81 4.130 0.606 -7.088 728 HD12 LEU 81 2HD1 LEU 81 2.526 0.408 -7.803 729 HD13 LEU 81 3HD1 LEU 81 3.875 -0.559 -8.390 730 HD21 LEU 81 3HD2 LEU 81 4.044 -2.852 -5.460 731 HD22 LEU 81 1HD2 LEU 81 5.086 -1.439 -5.656 732 HD23 LEU 81 2HD2 LEU 81 4.740 -2.486 -7.035 733 H LEU 82 H LEU 82 0.078 0.286 -7.632 734 HA LEU 82 HA LEU 82 -1.745 -2.012 -7.202 735 HB2 LEU 82 2HB LEU 82 -1.912 0.249 -9.233 736 HB3 LEU 82 3HB LEU 82 -3.101 -1.027 -9.014 737 HG LEU 82 HG LEU 82 -2.451 1.112 -6.946 738 HD11 LEU 82 1HD1 LEU 82 -3.532 2.011 -8.987 739 HD12 LEU 82 2HD1 LEU 82 -4.522 2.166 -7.546 740 HD13 LEU 82 3HD1 LEU 82 -4.891 0.911 -8.732 741 HD21 LEU 82 3HD2 LEU 82 -4.455 0.304 -5.768 742 HD22 LEU 82 1HD2 LEU 82 -3.238 -0.964 -5.907 743 HD23 LEU 82 2HD2 LEU 82 -4.653 -0.982 -6.962 744 H ALA 83 H ALA 83 -1.653 -3.707 -8.730 745 HA ALA 83 HA ALA 83 0.074 -3.436 -11.082 746 HB1 ALA 83 3HB ALA 83 0.603 -5.584 -9.014 747 HB2 ALA 83 1HB ALA 83 1.596 -4.156 -9.284 748 HB3 ALA 83 2HB ALA 83 1.442 -5.374 -10.551 749 H ASP 84 H ASP 84 -0.889 -4.282 -12.715 750 HA ASP 84 HA ASP 84 -1.949 -6.847 -13.022 751 HB2 ASP 84 2HB ASP 84 -3.914 -6.083 -11.725 752 HB3 ASP 84 3HB ASP 84 -4.077 -4.660 -12.747 753 H GLN 85 H GLN 85 -2.698 -7.152 -15.251 754 HA GLN 85 HA GLN 85 -1.123 -5.754 -17.131 755 HB2 GLN 85 2HB GLN 85 -3.495 -7.597 -17.641 756 HB3 GLN 85 3HB GLN 85 -2.297 -7.111 -18.839 757 HG2 GLN 85 2HG GLN 85 -0.542 -8.230 -17.430 758 HG3 GLN 85 3HG GLN 85 -1.831 -8.842 -16.395 759 HE21 GLN 85 1HE2 GLN 85 -0.301 -9.104 -19.515 760 HE22 GLN 85 2HE2 GLN 85 -1.108 -10.550 -20.008 761 H ASP 86 H ASP 86 -4.575 -5.529 -16.303 762 HA ASP 86 HA ASP 86 -5.148 -3.537 -18.331 763 HB2 ASP 86 2HB ASP 86 -6.880 -5.190 -17.287 764 HB3 ASP 86 3HB ASP 86 -6.927 -4.087 -15.920 765 H GLU 87 H GLU 87 -3.702 -1.927 -17.981 766 HA GLU 87 HA GLU 87 -3.018 -0.759 -15.497 767 HB2 GLU 87 2HB GLU 87 -1.791 0.873 -16.780 768 HB3 GLU 87 3HB GLU 87 -1.610 -0.679 -17.584 769 HG2 GLU 87 2HG GLU 87 -3.221 -0.042 -19.287 770 HG3 GLU 87 3HG GLU 87 -3.575 1.464 -18.444 771 H ASN 88 H ASN 88 -5.703 -0.344 -17.571 772 HA ASN 88 HA ASN 88 -6.315 2.417 -16.993 773 HB2 ASN 88 2HB ASN 88 -6.904 1.430 -19.166 774 HB3 ASN 88 3HB ASN 88 -7.941 0.245 -18.382 775 HD21 ASN 88 1HD2 ASN 88 -7.587 3.654 -19.178 776 HD22 ASN 88 2HD2 ASN 88 -9.254 4.065 -18.965 777 H GLU 89 H GLU 89 -7.435 -0.759 -15.864 778 HA GLU 89 HA GLU 89 -9.669 0.029 -14.326 779 HB2 GLU 89 2HB GLU 89 -8.680 -2.384 -15.002 780 HB3 GLU 89 3HB GLU 89 -7.903 -2.281 -13.434 781 HG2 GLU 89 2HG GLU 89 -10.888 -2.229 -13.988 782 HG3 GLU 89 3HG GLU 89 -9.977 -3.581 -13.335 783 H LEU 90 H LEU 90 -6.290 -0.496 -13.530 784 HA LEU 90 HA LEU 90 -6.371 0.299 -10.805 785 HB2 LEU 90 2HB LEU 90 -4.020 0.211 -12.720 786 HB3 LEU 90 3HB LEU 90 -3.917 0.259 -10.965 787 HG LEU 90 HG LEU 90 -5.052 -2.033 -12.604 788 HD11 LEU 90 1HD1 LEU 90 -3.014 -3.228 -11.912 789 HD12 LEU 90 2HD1 LEU 90 -2.408 -1.758 -11.148 790 HD13 LEU 90 3HD1 LEU 90 -2.657 -1.812 -12.896 791 HD21 LEU 90 3HD2 LEU 90 -6.175 -1.927 -10.434 792 HD22 LEU 90 1HD2 LEU 90 -4.622 -1.827 -9.594 793 HD23 LEU 90 2HD2 LEU 90 -5.067 -3.295 -10.470 794 H GLU 91 H GLU 91 -5.764 2.016 -13.856 795 HA GLU 91 HA GLU 91 -4.568 4.351 -12.823 796 HB2 GLU 91 2HB GLU 91 -4.530 3.792 -15.242 797 HB3 GLU 91 3HB GLU 91 -6.265 4.096 -15.347 798 HG2 GLU 91 2HG GLU 91 -5.802 6.476 -14.606 799 HG3 GLU 91 3HG GLU 91 -4.082 6.117 -14.728 800 H GLU 92 H GLU 92 -7.965 3.658 -13.681 801 HA GLU 92 HA GLU 92 -9.177 6.037 -12.918 802 HB2 GLU 92 2HB GLU 92 -10.270 3.195 -12.743 803 HB3 GLU 92 3HB GLU 92 -11.257 4.649 -12.633 804 HG2 GLU 92 2HG GLU 92 -9.612 3.830 -15.042 805 HG3 GLU 92 3HG GLU 92 -11.346 3.594 -14.863 806 H PHE 93 H PHE 93 -8.280 3.263 -10.958 807 HA PHE 93 HA PHE 93 -9.444 4.064 -8.507 808 HB2 PHE 93 2HB PHE 93 -8.627 1.734 -9.082 809 HB3 PHE 93 3HB PHE 93 -6.974 2.309 -8.891 810 HD1 PHE 93 HD1 PHE 93 -10.195 1.841 -7.108 811 HD2 PHE 93 HD2 PHE 93 -5.989 2.402 -6.690 812 HE1 PHE 93 HE1 PHE 93 -10.351 1.376 -4.710 813 HE2 PHE 93 HE2 PHE 93 -6.157 1.935 -4.286 814 HZ PHE 93 HZ PHE 93 -8.344 1.423 -3.289 815 H LYS 94 H LYS 94 -6.115 4.409 -9.756 816 HA LYS 94 HA LYS 94 -5.155 5.548 -7.298 817 HB2 LYS 94 2HB LYS 94 -2.958 5.534 -8.333 818 HB3 LYS 94 3HB LYS 94 -3.766 4.006 -8.578 819 HG2 LYS 94 2HG LYS 94 -2.792 4.286 -10.646 820 HG3 LYS 94 3HG LYS 94 -4.366 5.017 -10.946 821 HD2 LYS 94 2HD LYS 94 -2.484 6.355 -11.885 822 HD3 LYS 94 3HD LYS 94 -3.412 7.261 -10.687 823 HE2 LYS 94 2HE LYS 94 -1.674 6.805 -8.993 824 HE3 LYS 94 3HE LYS 94 -0.764 5.857 -10.172 825 HZ1 LYS 94 3HZ LYS 94 -0.466 7.822 -11.503 826 HZ2 LYS 94 1HZ LYS 94 0.095 8.107 -9.936 827 HZ3 LYS 94 2HZ LYS 94 -1.387 8.747 -10.431 828 H ARG 95 H ARG 95 -6.434 6.890 -10.214 829 HA ARG 95 HA ARG 95 -5.241 9.453 -10.196 830 HB2 ARG 95 2HB ARG 95 -7.975 8.512 -11.181 831 HB3 ARG 95 3HB ARG 95 -7.415 10.169 -11.396 832 HG2 ARG 95 2HG ARG 95 -5.618 9.474 -12.830 833 HG3 ARG 95 3HG ARG 95 -5.879 7.774 -12.445 834 HD2 ARG 95 2HD ARG 95 -6.781 8.114 -14.624 835 HD3 ARG 95 3HD ARG 95 -8.166 7.988 -13.541 836 HE ARG 95 HE ARG 95 -7.613 10.687 -13.760 837 HH11 ARG 95 1HH1 ARG 95 -8.530 8.110 -15.995 838 HH12 ARG 95 2HH1 ARG 95 -9.338 9.188 -17.089 839 HH21 ARG 95 1HH2 ARG 95 -8.684 12.081 -15.186 840 HH22 ARG 95 2HH2 ARG 95 -9.426 11.456 -16.626 841 H LYS 96 H LYS 96 -8.148 8.183 -8.603 842 HA LYS 96 HA LYS 96 -8.928 10.644 -7.349 843 HB2 LYS 96 2HB LYS 96 -9.815 7.753 -6.977 844 HB3 LYS 96 3HB LYS 96 -10.424 9.037 -5.940 845 HG2 LYS 96 2HG LYS 96 -12.039 8.577 -7.676 846 HG3 LYS 96 3HG LYS 96 -11.364 10.189 -7.926 847 HD2 LYS 96 2HD LYS 96 -9.925 9.329 -9.722 848 HD3 LYS 96 3HD LYS 96 -10.500 7.688 -9.419 849 HE2 LYS 96 2HE LYS 96 -12.219 9.998 -10.374 850 HE3 LYS 96 3HE LYS 96 -11.588 8.701 -11.387 851 HZ1 LYS 96 3HZ LYS 96 -13.545 8.434 -9.175 852 HZ2 LYS 96 1HZ LYS 96 -12.832 7.122 -9.969 853 HZ3 LYS 96 2HZ LYS 96 -13.817 8.190 -10.824 854 H ILE 97 H ILE 97 -7.107 7.766 -6.326 855 HA ILE 97 HA ILE 97 -6.868 8.383 -3.572 856 HB ILE 97 HB ILE 97 -5.020 6.710 -5.335 857 HG12 ILE 97 2HG1 ILE 97 -7.302 5.846 -5.432 858 HG13 ILE 97 3HG1 ILE 97 -6.322 4.749 -4.476 859 HG21 ILE 97 1HG2 ILE 97 -5.268 6.718 -2.309 860 HG22 ILE 97 2HG2 ILE 97 -3.880 7.268 -3.252 861 HG23 ILE 97 3HG2 ILE 97 -4.326 5.563 -3.254 862 HD11 ILE 97 3HD1 ILE 97 -8.355 6.730 -3.435 863 HD12 ILE 97 1HD1 ILE 97 -7.321 5.721 -2.417 864 HD13 ILE 97 2HD1 ILE 97 -8.498 4.974 -3.494 865 H GLU 98 H GLU 98 -4.861 9.169 -6.375 866 HA GLU 98 HA GLU 98 -2.729 10.493 -5.057 867 HB2 GLU 98 2HB GLU 98 -2.995 9.610 -7.544 868 HB3 GLU 98 3HB GLU 98 -3.654 11.199 -7.869 869 HG2 GLU 98 2HG GLU 98 -0.889 10.693 -6.730 870 HG3 GLU 98 3HG GLU 98 -1.224 10.908 -8.443 871 H SER 99 H SER 99 -5.904 11.531 -6.206 872 HA SER 99 HA SER 99 -5.558 14.354 -5.821 873 HB2 SER 99 2HB SER 99 -8.128 12.721 -5.999 874 HB3 SER 99 3HB SER 99 -8.016 14.480 -6.128 875 HG SER 99 HG SER 99 -7.297 12.497 -7.945 876 H GLN 100 H GLN 100 -6.572 11.681 -3.754 877 HA GLN 100 HA GLN 100 -7.525 13.283 -1.560 878 HB2 GLN 100 2HB GLN 100 -6.575 10.381 -1.597 879 HB3 GLN 100 3HB GLN 100 -7.401 11.158 -0.247 880 HG2 GLN 100 2HG GLN 100 -9.416 11.450 -1.607 881 HG3 GLN 100 3HG GLN 100 -8.601 10.745 -3.001 882 HE21 GLN 100 1HE2 GLN 100 -11.033 9.870 -1.677 883 HE22 GLN 100 2HE2 GLN 100 -10.763 8.250 -1.140 884 H GLY 101 H GLY 101 -4.407 12.388 -2.724 885 HA2 GLY 101 2HA GLY 101 -2.504 13.671 -2.118 886 HA3 GLY 101 3HA GLY 101 -3.136 13.844 -0.488 887 H TYR 102 H TYR 102 -2.784 10.901 -2.469 888 HA TYR 102 HA TYR 102 -0.869 9.837 -0.467 889 HB2 TYR 102 2HB TYR 102 -2.982 8.334 -2.066 890 HB3 TYR 102 3HB TYR 102 -1.760 7.560 -1.052 891 HD1 TYR 102 HD2 TYR 102 -1.643 8.359 1.427 892 HD2 TYR 102 HD1 TYR 102 -5.075 8.929 -1.058 893 HE1 TYR 102 HE2 TYR 102 -3.025 8.697 3.418 894 HE2 TYR 102 HE1 TYR 102 -6.461 9.281 0.952 895 HH TYR 102 HH TYR 102 -6.425 8.785 3.320 896 H GLU 103 H GLU 103 0.976 8.946 -1.140 897 HA GLU 103 HA GLU 103 1.896 9.368 -3.827 898 HB2 GLU 103 2HB GLU 103 3.432 9.623 -1.923 899 HB3 GLU 103 3HB GLU 103 3.163 7.957 -1.429 900 HG2 GLU 103 2HG GLU 103 5.333 8.178 -2.508 901 HG3 GLU 103 3HG GLU 103 4.274 7.167 -3.486 902 H VAL 104 H VAL 104 0.997 8.087 -5.352 903 HA VAL 104 HA VAL 104 0.821 5.180 -4.905 904 HB VAL 104 HB VAL 104 -1.405 5.988 -4.386 905 HG11 VAL 104 1HG1 VAL 104 -1.388 8.156 -5.513 906 HG12 VAL 104 2HG1 VAL 104 -2.819 7.231 -5.967 907 HG13 VAL 104 3HG1 VAL 104 -1.464 7.364 -7.090 908 HG21 VAL 104 3HG2 VAL 104 -1.242 3.854 -5.612 909 HG22 VAL 104 1HG2 VAL 104 -1.407 4.711 -7.147 910 HG23 VAL 104 2HG2 VAL 104 -2.743 4.697 -5.994 911 H ARG 105 H ARG 105 1.396 3.989 -6.581 912 HA ARG 105 HA ARG 105 1.595 5.182 -9.279 913 HB2 ARG 105 2HB ARG 105 3.652 3.311 -8.021 914 HB3 ARG 105 3HB ARG 105 3.707 3.948 -9.661 915 HG2 ARG 105 2HG ARG 105 3.898 5.608 -7.127 916 HG3 ARG 105 3HG ARG 105 5.263 5.120 -8.130 917 HD2 ARG 105 2HD ARG 105 4.625 6.557 -9.904 918 HD3 ARG 105 3HD ARG 105 2.979 6.743 -9.288 919 HE ARG 105 HE ARG 105 4.481 7.778 -7.303 920 HH11 ARG 105 1HH1 ARG 105 4.412 8.473 -10.755 921 HH12 ARG 105 2HH1 ARG 105 4.874 10.133 -10.540 922 HH21 ARG 105 1HH2 ARG 105 4.973 9.949 -7.026 923 HH22 ARG 105 2HH2 ARG 105 5.191 10.974 -8.416 924 H LYS 106 H LYS 106 1.283 3.779 -10.966 925 HA LYS 106 HA LYS 106 -0.065 1.208 -10.389 926 HB2 LYS 106 2HB LYS 106 -1.690 2.817 -11.145 927 HB3 LYS 106 3HB LYS 106 -0.645 3.407 -12.421 928 HG2 LYS 106 2HG LYS 106 -1.630 0.555 -12.507 929 HG3 LYS 106 3HG LYS 106 -2.714 1.864 -12.972 930 HD2 LYS 106 2HD LYS 106 -0.012 1.281 -14.244 931 HD3 LYS 106 3HD LYS 106 -1.582 0.860 -14.922 932 HE2 LYS 106 2HE LYS 106 -2.173 3.207 -15.157 933 HE3 LYS 106 3HE LYS 106 -0.693 3.700 -14.326 934 HZ1 LYS 106 3HZ LYS 106 -0.423 3.926 -16.685 935 HZ2 LYS 106 1HZ LYS 106 -0.851 2.313 -16.948 936 HZ3 LYS 106 2HZ LYS 106 0.579 2.692 -16.132 937 H VAL 107 H VAL 107 0.904 -0.522 -11.264 938 HA VAL 107 HA VAL 107 2.748 -0.245 -13.563 939 HB VAL 107 HB VAL 107 4.316 -1.850 -12.545 940 HG11 VAL 107 1HG1 VAL 107 5.293 -0.440 -10.768 941 HG12 VAL 107 2HG1 VAL 107 3.796 0.491 -10.675 942 HG13 VAL 107 3HG1 VAL 107 4.770 0.529 -12.148 943 HG21 VAL 107 3HG2 VAL 107 4.120 -2.561 -10.188 944 HG22 VAL 107 1HG2 VAL 107 2.765 -3.140 -11.156 945 HG23 VAL 107 2HG2 VAL 107 2.552 -1.762 -10.076 946 H THR 108 H THR 108 3.318 -2.567 -14.354 947 HA THR 108 HA THR 108 0.913 -4.305 -14.368 948 HB THR 108 HB THR 108 1.393 -4.786 -16.802 949 HG1 THR 108 HG1 THR 108 3.600 -4.076 -16.784 950 HG21 THR 108 3HG2 THR 108 -0.360 -3.114 -16.264 951 HG22 THR 108 1HG2 THR 108 0.501 -2.683 -17.742 952 HG23 THR 108 2HG2 THR 108 0.862 -1.840 -16.236 953 H ASP 109 H ASP 109 4.445 -4.038 -14.574 954 HA ASP 109 HA ASP 109 4.814 -6.959 -14.768 955 HB2 ASP 109 2HB ASP 109 6.944 -4.780 -14.698 956 HB3 ASP 109 3HB ASP 109 7.190 -6.462 -15.136 957 H ASP 110 H ASP 110 5.898 -8.168 -13.212 958 HA ASP 110 HA ASP 110 5.710 -7.458 -10.462 959 HB2 ASP 110 2HB ASP 110 7.115 -9.776 -11.878 960 HB3 ASP 110 3HB ASP 110 7.133 -9.596 -10.125 961 H GLU 111 H GLU 111 8.474 -7.824 -12.659 962 HA GLU 111 HA GLU 111 10.556 -7.107 -10.948 963 HB2 GLU 111 2HB GLU 111 11.832 -6.607 -13.055 964 HB3 GLU 111 3HB GLU 111 11.007 -8.163 -13.078 965 HG2 GLU 111 2HG GLU 111 9.182 -7.148 -14.442 966 HG3 GLU 111 3HG GLU 111 10.081 -5.633 -14.469 967 H GLU 112 H GLU 112 8.471 -5.087 -12.976 968 HA GLU 112 HA GLU 112 9.694 -2.563 -12.557 969 HB2 GLU 112 2HB GLU 112 8.182 -2.992 -14.426 970 HB3 GLU 112 3HB GLU 112 6.860 -3.353 -13.328 971 HG2 GLU 112 2HG GLU 112 6.888 -0.977 -12.571 972 HG3 GLU 112 3HG GLU 112 8.162 -0.648 -13.753 973 H ALA 113 H ALA 113 7.024 -4.269 -10.973 974 HA ALA 113 HA ALA 113 6.118 -2.280 -9.246 975 HB1 ALA 113 3HB ALA 113 5.109 -4.099 -7.944 976 HB2 ALA 113 1HB ALA 113 6.111 -5.285 -8.796 977 HB3 ALA 113 2HB ALA 113 4.890 -4.360 -9.672 978 H LEU 114 H LEU 114 8.620 -4.763 -8.747 979 HA LEU 114 HA LEU 114 9.193 -4.215 -6.032 980 HB2 LEU 114 2HB LEU 114 10.942 -5.460 -8.190 981 HB3 LEU 114 3HB LEU 114 11.348 -5.451 -6.478 982 HG LEU 114 HG LEU 114 8.942 -6.841 -7.722 983 HD11 LEU 114 1HD1 LEU 114 11.453 -8.019 -6.499 984 HD12 LEU 114 2HD1 LEU 114 11.048 -7.985 -8.216 985 HD13 LEU 114 3HD1 LEU 114 10.061 -8.924 -7.100 986 HD21 LEU 114 3HD2 LEU 114 8.497 -7.744 -5.497 987 HD22 LEU 114 1HD2 LEU 114 8.422 -5.985 -5.472 988 HD23 LEU 114 2HD2 LEU 114 9.837 -6.816 -4.821 989 H LYS 115 H LYS 115 10.468 -2.854 -9.022 990 HA LYS 115 HA LYS 115 12.563 -1.273 -7.972 991 HB2 LYS 115 2HB LYS 115 10.784 -0.767 -10.398 992 HB3 LYS 115 3HB LYS 115 12.288 0.085 -10.065 993 HG2 LYS 115 2HG LYS 115 13.589 -1.920 -10.398 994 HG3 LYS 115 3HG LYS 115 12.136 -2.916 -10.457 995 HD2 LYS 115 2HD LYS 115 12.894 -2.690 -12.713 996 HD3 LYS 115 3HD LYS 115 11.467 -1.671 -12.564 997 HE2 LYS 115 2HE LYS 115 14.301 -0.602 -12.383 998 HE3 LYS 115 3HE LYS 115 13.392 -0.694 -13.886 999 HZ1 LYS 115 3HZ LYS 115 13.240 1.489 -12.960 1000 HZ2 LYS 115 1HZ LYS 115 12.651 0.899 -11.494 1001 HZ3 LYS 115 2HZ LYS 115 11.722 0.761 -12.896 1002 H ILE 116 H ILE 116 9.101 -0.620 -8.510 1003 HA ILE 116 HA ILE 116 9.131 2.096 -7.651 1004 HB ILE 116 HB ILE 116 6.751 0.185 -7.806 1005 HG12 ILE 116 2HG1 ILE 116 7.925 0.354 -9.980 1006 HG13 ILE 116 3HG1 ILE 116 6.351 1.124 -10.058 1007 HG21 ILE 116 1HG2 ILE 116 6.805 3.225 -7.766 1008 HG22 ILE 116 2HG2 ILE 116 6.217 2.173 -6.477 1009 HG23 ILE 116 3HG2 ILE 116 5.373 2.229 -8.023 1010 HD11 ILE 116 3HD1 ILE 116 7.421 3.320 -9.897 1011 HD12 ILE 116 1HD1 ILE 116 8.015 2.382 -11.265 1012 HD13 ILE 116 2HD1 ILE 116 9.002 2.536 -9.814 1013 H VAL 117 H VAL 117 8.552 -0.974 -5.976 1014 HA VAL 117 HA VAL 117 7.730 -0.028 -3.454 1015 HB VAL 117 HB VAL 117 9.386 -2.507 -4.153 1016 HG11 VAL 117 1HG1 VAL 117 9.740 -1.966 -1.779 1017 HG12 VAL 117 2HG1 VAL 117 8.744 -3.414 -1.937 1018 HG13 VAL 117 3HG1 VAL 117 7.995 -1.869 -1.521 1019 HG21 VAL 117 3HG2 VAL 117 7.137 -2.494 -5.153 1020 HG22 VAL 117 1HG2 VAL 117 6.417 -2.219 -3.569 1021 HG23 VAL 117 2HG2 VAL 117 7.259 -3.733 -3.906 1022 H ARG 118 H ARG 118 10.982 -0.719 -4.741 1023 HA ARG 118 HA ARG 118 12.490 0.035 -2.473 1024 HB2 ARG 118 2HB ARG 118 13.284 -0.020 -5.418 1025 HB3 ARG 118 3HB ARG 118 14.423 0.187 -4.089 1026 HG2 ARG 118 2HG ARG 118 13.928 -2.034 -3.244 1027 HG3 ARG 118 3HG ARG 118 12.646 -2.246 -4.436 1028 HD2 ARG 118 2HD ARG 118 14.360 -2.091 -6.247 1029 HD3 ARG 118 3HD ARG 118 15.619 -1.997 -5.008 1030 HE ARG 118 HE ARG 118 14.543 -4.238 -4.256 1031 HH11 ARG 118 1HH1 ARG 118 15.041 -3.285 -7.611 1032 HH12 ARG 118 2HH1 ARG 118 15.180 -4.921 -8.161 1033 HH21 ARG 118 1HH2 ARG 118 14.693 -6.344 -4.999 1034 HH22 ARG 118 2HH2 ARG 118 14.985 -6.652 -6.682 1035 H GLU 119 H GLU 119 11.212 1.884 -5.220 1036 HA GLU 119 HA GLU 119 12.456 4.365 -4.698 1037 HB2 GLU 119 2HB GLU 119 9.783 3.755 -6.043 1038 HB3 GLU 119 3HB GLU 119 10.505 5.360 -5.985 1039 HG2 GLU 119 2HG GLU 119 11.656 2.919 -7.348 1040 HG3 GLU 119 3HG GLU 119 10.931 4.316 -8.137 1041 H PHE 120 H PHE 120 9.222 3.142 -3.747 1042 HA PHE 120 HA PHE 120 8.309 5.247 -2.198 1043 HB2 PHE 120 2HB PHE 120 7.812 2.255 -1.930 1044 HB3 PHE 120 3HB PHE 120 6.964 3.436 -0.939 1045 HD1 PHE 120 HD2 PHE 120 6.646 5.549 -3.253 1046 HD2 PHE 120 HD1 PHE 120 5.817 1.352 -2.968 1047 HE1 PHE 120 HE2 PHE 120 4.850 5.776 -4.923 1048 HE2 PHE 120 HE1 PHE 120 4.025 1.610 -4.633 1049 HZ PHE 120 HZ PHE 120 3.536 3.811 -5.606 1050 H MET 121 H MET 121 10.521 2.683 -1.342 1051 HA MET 121 HA MET 121 10.618 3.209 1.484 1052 HB2 MET 121 2HB MET 121 12.431 1.539 -0.307 1053 HB3 MET 121 3HB MET 121 12.453 1.520 1.455 1054 HG2 MET 121 2HG MET 121 10.235 0.567 1.540 1055 HG3 MET 121 3HG MET 121 10.023 0.780 -0.195 1056 HE1 MET 121 3HE MET 121 12.782 -2.327 1.776 1057 HE2 MET 121 1HE MET 121 11.641 -1.307 2.651 1058 HE3 MET 121 2HE MET 121 13.083 -0.596 1.918 1059 H GLN 122 H GLN 122 12.337 4.453 -1.323 1060 HA GLN 122 HA GLN 122 14.488 5.717 0.110 1061 HB2 GLN 122 2HB GLN 122 13.315 6.569 -2.580 1062 HB3 GLN 122 3HB GLN 122 14.866 7.068 -1.918 1063 HG2 GLN 122 2HG GLN 122 14.082 4.333 -2.920 1064 HG3 GLN 122 3HG GLN 122 15.264 5.428 -3.616 1065 HE21 GLN 122 1HE2 GLN 122 14.647 3.077 -1.146 1066 HE22 GLN 122 2HE2 GLN 122 16.275 2.913 -0.598 1067 H LYS 123 H LYS 123 11.251 6.757 -1.007 1068 HA LYS 123 HA LYS 123 11.347 9.414 0.012 1069 HB2 LYS 123 2HB LYS 123 8.938 7.618 -0.533 1070 HB3 LYS 123 3HB LYS 123 8.780 9.275 0.021 1071 HG2 LYS 123 2HG LYS 123 8.404 9.435 -2.279 1072 HG3 LYS 123 3HG LYS 123 10.097 9.917 -2.131 1073 HD2 LYS 123 2HD LYS 123 10.827 7.709 -2.848 1074 HD3 LYS 123 3HD LYS 123 9.167 7.115 -2.836 1075 HE2 LYS 123 2HE LYS 123 9.842 7.517 -5.114 1076 HE3 LYS 123 3HE LYS 123 8.631 8.721 -4.672 1077 HZ1 LYS 123 3HZ LYS 123 11.567 9.141 -4.767 1078 HZ2 LYS 123 1HZ LYS 123 10.435 10.304 -4.299 1079 HZ3 LYS 123 2HZ LYS 123 10.439 9.720 -5.884 1080 H ALA 124 H ALA 124 10.379 6.296 1.403 1081 HA ALA 124 HA ALA 124 9.255 7.223 3.837 1082 HB1 ALA 124 3HB ALA 124 8.801 4.981 2.926 1083 HB2 ALA 124 1HB ALA 124 9.429 4.876 4.571 1084 HB3 ALA 124 2HB ALA 124 10.481 4.516 3.197 1085 H GLY 125 H GLY 125 12.512 6.229 2.873 1086 HA2 GLY 125 2HA GLY 125 13.830 6.499 5.363 1087 HA3 GLY 125 3HA GLY 125 14.584 6.575 3.776 1088 H SER 126 H SER 126 13.227 8.805 2.710 1089 HA SER 126 HA SER 126 14.732 10.982 3.708 1090 HB2 SER 126 2HB SER 126 12.306 10.985 1.862 1091 HB3 SER 126 3HB SER 126 13.395 12.357 2.106 1092 HG SER 126 HG SER 126 13.735 10.079 0.605 1093 H LEU 127 H LEU 127 11.522 9.816 4.487 1094 HA LEU 127 HA LEU 127 10.483 12.127 5.818 1095 HB2 LEU 127 2HB LEU 127 9.823 9.181 6.231 1096 HB3 LEU 127 3HB LEU 127 8.860 10.522 6.834 1097 HG LEU 127 HG LEU 127 9.334 9.952 3.888 1098 HD11 LEU 127 1HD1 LEU 127 8.050 8.140 4.919 1099 HD12 LEU 127 2HD1 LEU 127 7.069 9.079 3.798 1100 HD13 LEU 127 3HD1 LEU 127 6.883 9.310 5.537 1101 HD21 LEU 127 3HD2 LEU 127 7.522 11.563 3.493 1102 HD22 LEU 127 1HD2 LEU 127 8.879 12.314 4.330 1103 HD23 LEU 127 2HD2 LEU 127 7.419 11.886 5.225 1104 H GLU 128 H GLU 128 12.303 9.291 6.824 1105 HA GLU 128 HA GLU 128 12.374 9.884 9.643 1106 HB2 GLU 128 2HB GLU 128 14.087 7.940 8.050 1107 HB3 GLU 128 3HB GLU 128 13.832 7.941 9.798 1108 HG2 GLU 128 2HG GLU 128 11.424 7.481 9.431 1109 HG3 GLU 128 3HG GLU 128 11.711 7.432 7.693 1110 H HIS 129 H HIS 129 14.377 10.595 6.865 1111 HA HIS 129 HA HIS 129 16.598 11.682 8.325 1112 HB2 HIS 129 2HB HIS 129 15.661 12.293 5.483 1113 HB3 HIS 129 3HB HIS 129 17.206 12.783 6.170 1114 HD1 HIS 129 HD1 HIS 129 17.214 11.201 3.634 1115 HD2 HIS 129 HD2 HIS 129 17.329 9.395 7.375 1116 HE1 HIS 129 HE1 HIS 129 18.222 8.932 3.259 1117 HE2 HIS 129 HE2 HIS 129 18.121 7.811 5.506 1118 H HIS 130 H HIS 130 15.488 12.858 9.941 1119 HA HIS 130 HA HIS 130 13.745 15.076 9.247 1120 HB2 HIS 130 2HB HIS 130 14.731 13.950 11.894 1121 HB3 HIS 130 3HB HIS 130 13.781 15.431 11.800 1122 HD1 HIS 130 HD1 HIS 130 11.324 15.169 10.766 1123 HD2 HIS 130 HD2 HIS 130 13.197 11.613 11.822 1124 HE1 HIS 130 HE1 HIS 130 9.508 13.447 10.847 1125 HE2 HIS 130 HE2 HIS 130 10.642 11.337 11.601 1126 H HIS 131 H HIS 131 14.356 17.122 9.005 1127 HA HIS 131 HA HIS 131 17.147 17.806 8.924 1128 HB2 HIS 131 2HB HIS 131 16.385 19.967 7.990 1129 HB3 HIS 131 3HB HIS 131 15.642 18.607 7.165 1130 HD1 HIS 131 HD1 HIS 131 13.113 18.503 7.135 1131 HD2 HIS 131 HD2 HIS 131 14.548 21.468 9.667 1132 HE1 HIS 131 HE1 HIS 131 11.119 19.866 7.786 1133 HE2 HIS 131 HE2 HIS 131 11.985 21.546 9.437 1134 H HIS 132 H HIS 132 15.369 17.547 11.587 1135 HA HIS 132 HA HIS 132 16.106 19.832 13.109 1136 HB2 HIS 132 2HB HIS 132 14.364 18.102 13.786 1137 HB3 HIS 132 3HB HIS 132 15.669 16.963 14.088 1138 HD1 HIS 132 HD1 HIS 132 13.842 19.818 15.587 1139 HD2 HIS 132 HD2 HIS 132 17.259 17.589 16.410 1140 HE1 HIS 132 HE1 HIS 132 14.441 20.337 17.972 1141 HE2 HIS 132 HE2 HIS 132 16.560 19.060 18.408 1142 H HIS 133 H HIS 133 18.209 20.370 12.699 1143 HA HIS 133 HA HIS 133 20.389 18.669 12.293 1144 HB2 HIS 133 2HB HIS 133 20.269 21.607 13.065 1145 HB3 HIS 133 3HB HIS 133 21.790 20.790 12.727 1146 HD1 HIS 133 HD1 HIS 133 22.437 20.489 10.304 1147 HD2 HIS 133 HD2 HIS 133 18.560 21.912 10.745 1148 HE1 HIS 133 HE1 HIS 133 21.688 21.134 8.003 1149 HE2 HIS 133 HE2 HIS 133 19.348 21.995 8.294 1150 H HIS 134 H HIS 134 21.514 17.466 13.624 1151 HA HIS 134 HA HIS 134 21.439 17.845 16.530 1152 HB2 HIS 134 2HB HIS 134 20.996 15.580 15.683 1153 HB3 HIS 134 3HB HIS 134 22.527 15.565 14.815 1154 HD1 HIS 134 HD1 HIS 134 23.997 13.960 15.975 1155 HD2 HIS 134 HD2 HIS 134 21.835 16.246 18.693 1156 HE1 HIS 134 HE1 HIS 134 24.771 13.226 18.241 1157 HE2 HIS 134 HE2 HIS 134 23.549 14.706 19.858 Start of MODEL 12 1 H1 MET 1 1H MET 1 1.250 9.889 13.270 2 H2 MET 1 2H MET 1 1.721 11.503 13.091 3 H3 MET 1 3H MET 1 2.778 10.381 13.786 4 HA MET 1 HA MET 1 1.809 10.340 10.999 5 HB2 MET 1 2HB MET 1 3.404 12.174 11.328 6 HB3 MET 1 3HB MET 1 4.520 11.114 12.179 7 HG2 MET 1 2HG MET 1 5.293 11.568 9.890 8 HG3 MET 1 3HG MET 1 4.919 9.854 10.098 9 HE1 MET 1 3HE MET 1 3.738 10.105 6.443 10 HE2 MET 1 1HE MET 1 4.680 9.212 7.637 11 HE3 MET 1 2HE MET 1 5.197 10.820 7.125 12 H LYS 2 H LYS 2 2.220 8.439 9.908 13 HA LYS 2 HA LYS 2 4.141 6.491 10.940 14 HB2 LYS 2 2HB LYS 2 1.890 5.995 12.053 15 HB3 LYS 2 3HB LYS 2 1.231 5.680 10.449 16 HG2 LYS 2 2HG LYS 2 2.987 3.868 10.177 17 HG3 LYS 2 3HG LYS 2 3.432 4.125 11.864 18 HD2 LYS 2 2HD LYS 2 0.697 3.258 10.869 19 HD3 LYS 2 3HD LYS 2 1.916 2.187 11.560 20 HE2 LYS 2 2HE LYS 2 0.599 4.494 13.035 21 HE3 LYS 2 3HE LYS 2 0.126 2.801 13.171 22 HZ1 LYS 2 3HZ LYS 2 2.309 2.290 14.048 23 HZ2 LYS 2 1HZ LYS 2 1.561 3.482 14.988 24 HZ3 LYS 2 2HZ LYS 2 2.784 3.902 13.898 25 H ILE 3 H ILE 3 4.765 4.961 9.332 26 HA ILE 3 HA ILE 3 4.251 5.704 6.545 27 HB ILE 3 HB ILE 3 6.189 3.658 7.725 28 HG12 ILE 3 2HG1 ILE 3 6.790 6.429 6.596 29 HG13 ILE 3 3HG1 ILE 3 6.773 6.014 8.307 30 HG21 ILE 3 1HG2 ILE 3 5.966 4.651 4.857 31 HG22 ILE 3 2HG2 ILE 3 5.521 3.043 5.434 32 HG23 ILE 3 3HG2 ILE 3 7.207 3.557 5.473 33 HD11 ILE 3 3HD1 ILE 3 9.027 6.128 7.430 34 HD12 ILE 3 1HD1 ILE 3 8.662 4.872 6.246 35 HD13 ILE 3 2HD1 ILE 3 8.645 4.496 7.974 36 H LEU 4 H LEU 4 2.474 4.767 5.709 37 HA LEU 4 HA LEU 4 2.149 1.828 5.961 38 HB2 LEU 4 2HB LEU 4 0.165 4.033 5.342 39 HB3 LEU 4 3HB LEU 4 -0.124 2.415 4.731 40 HG LEU 4 HG LEU 4 -0.148 1.539 7.059 41 HD11 LEU 4 1HD1 LEU 4 1.265 3.119 8.206 42 HD12 LEU 4 2HD1 LEU 4 -0.323 3.096 8.972 43 HD13 LEU 4 3HD1 LEU 4 0.123 4.426 7.901 44 HD21 LEU 4 3HD2 LEU 4 -2.097 3.779 6.467 45 HD22 LEU 4 1HD2 LEU 4 -2.335 2.510 7.667 46 HD23 LEU 4 2HD2 LEU 4 -2.232 2.090 5.963 47 H ILE 5 H ILE 5 2.675 0.664 4.206 48 HA ILE 5 HA ILE 5 2.484 1.940 1.538 49 HB ILE 5 HB ILE 5 4.336 -0.380 2.289 50 HG12 ILE 5 2HG1 ILE 5 5.000 2.550 1.717 51 HG13 ILE 5 3HG1 ILE 5 5.222 1.706 3.243 52 HG21 ILE 5 1HG2 ILE 5 3.503 -0.527 -0.035 53 HG22 ILE 5 2HG2 ILE 5 5.228 -0.155 -0.011 54 HG23 ILE 5 3HG2 ILE 5 4.056 1.122 -0.347 55 HD11 ILE 5 3HD1 ILE 5 6.745 1.180 0.685 56 HD12 ILE 5 1HD1 ILE 5 6.950 0.302 2.206 57 HD13 ILE 5 2HD1 ILE 5 7.333 2.020 2.120 58 H LEU 6 H LEU 6 0.614 1.298 0.712 59 HA LEU 6 HA LEU 6 -0.660 -1.238 1.379 60 HB2 LEU 6 2HB LEU 6 -1.528 0.972 -0.539 61 HB3 LEU 6 3HB LEU 6 -2.506 -0.414 -0.083 62 HG LEU 6 HG LEU 6 -1.649 1.853 1.738 63 HD11 LEU 6 1HD1 LEU 6 -3.382 2.528 0.150 64 HD12 LEU 6 2HD1 LEU 6 -4.030 2.452 1.785 65 HD13 LEU 6 3HD1 LEU 6 -4.393 1.161 0.635 66 HD21 LEU 6 3HD2 LEU 6 -3.395 -0.532 2.399 67 HD22 LEU 6 1HD2 LEU 6 -3.043 0.840 3.454 68 HD23 LEU 6 2HD2 LEU 6 -1.748 -0.252 2.979 69 H ILE 7 H ILE 7 -0.749 -2.955 0.036 70 HA ILE 7 HA ILE 7 0.295 -2.764 -2.734 71 HB ILE 7 HB ILE 7 0.574 -5.126 -0.805 72 HG12 ILE 7 2HG1 ILE 7 2.189 -3.335 -0.278 73 HG13 ILE 7 3HG1 ILE 7 3.027 -4.725 -0.952 74 HG21 ILE 7 1HG2 ILE 7 0.208 -5.944 -3.088 75 HG22 ILE 7 2HG2 ILE 7 1.880 -6.235 -2.606 76 HG23 ILE 7 3HG2 ILE 7 1.498 -4.901 -3.697 77 HD11 ILE 7 3HD1 ILE 7 3.945 -2.659 -1.792 78 HD12 ILE 7 1HD1 ILE 7 2.370 -2.160 -2.404 79 HD13 ILE 7 2HD1 ILE 7 3.194 -3.553 -3.112 80 H ASN 8 H ASN 8 -1.387 -2.956 -4.051 81 HA ASN 8 HA ASN 8 -3.350 -5.133 -3.621 82 HB2 ASN 8 2HB ASN 8 -4.519 -3.019 -3.258 83 HB3 ASN 8 3HB ASN 8 -3.849 -2.337 -4.733 84 HD21 ASN 8 1HD2 ASN 8 -5.909 -1.875 -5.553 85 HD22 ASN 8 2HD2 ASN 8 -6.970 -3.102 -6.142 86 H THR 9 H THR 9 -2.437 -6.587 -4.912 87 HA THR 9 HA THR 9 -2.169 -5.980 -7.783 88 HB THR 9 HB THR 9 0.112 -6.092 -6.955 89 HG1 THR 9 HG1 THR 9 0.574 -8.325 -8.101 90 HG21 THR 9 3HG2 THR 9 -0.556 -8.841 -5.874 91 HG22 THR 9 1HG2 THR 9 -0.204 -7.405 -4.908 92 HG23 THR 9 2HG2 THR 9 1.052 -8.116 -5.926 93 H ASN 10 H ASN 10 -2.776 -7.603 -9.170 94 HA ASN 10 HA ASN 10 -4.890 -9.306 -8.383 95 HB2 ASN 10 2HB ASN 10 -4.677 -8.403 -10.663 96 HB3 ASN 10 3HB ASN 10 -3.196 -9.320 -10.914 97 HD21 ASN 10 1HD2 ASN 10 -3.969 -10.448 -12.675 98 HD22 ASN 10 2HD2 ASN 10 -5.205 -11.654 -12.561 99 H ASN 11 H ASN 11 -1.472 -9.976 -9.110 100 HA ASN 11 HA ASN 11 -1.779 -12.825 -8.471 101 HB2 ASN 11 2HB ASN 11 0.571 -13.066 -9.272 102 HB3 ASN 11 3HB ASN 11 -0.499 -12.389 -10.484 103 HD21 ASN 11 1HD2 ASN 11 2.453 -12.274 -10.140 104 HD22 ASN 11 2HD2 ASN 11 2.843 -10.594 -10.205 105 H ASP 12 H ASP 12 -1.630 -13.422 -6.456 106 HA ASP 12 HA ASP 12 -0.707 -11.949 -4.246 107 HB2 ASP 12 2HB ASP 12 -2.368 -13.730 -4.028 108 HB3 ASP 12 3HB ASP 12 -1.222 -14.934 -4.596 109 H GLU 13 H GLU 13 0.928 -14.197 -6.361 110 HA GLU 13 HA GLU 13 3.121 -14.972 -4.821 111 HB2 GLU 13 2HB GLU 13 4.199 -15.536 -6.991 112 HB3 GLU 13 3HB GLU 13 2.544 -16.125 -6.875 113 HG2 GLU 13 2HG GLU 13 1.751 -14.286 -8.290 114 HG3 GLU 13 3HG GLU 13 3.380 -13.614 -8.364 115 H LEU 14 H LEU 14 2.586 -12.046 -6.703 116 HA LEU 14 HA LEU 14 5.212 -10.990 -6.629 117 HB2 LEU 14 2HB LEU 14 3.548 -10.183 -8.216 118 HB3 LEU 14 3HB LEU 14 2.511 -9.642 -6.909 119 HG LEU 14 HG LEU 14 4.117 -7.865 -6.314 120 HD11 LEU 14 1HD1 LEU 14 6.081 -7.351 -7.674 121 HD12 LEU 14 2HD1 LEU 14 5.829 -8.815 -8.626 122 HD13 LEU 14 3HD1 LEU 14 6.226 -8.931 -6.910 123 HD21 LEU 14 3HD2 LEU 14 3.454 -7.832 -9.268 124 HD22 LEU 14 1HD2 LEU 14 3.838 -6.432 -8.262 125 HD23 LEU 14 2HD2 LEU 14 2.375 -7.360 -7.951 126 H ILE 15 H ILE 15 2.431 -10.735 -4.383 127 HA ILE 15 HA ILE 15 3.471 -8.725 -2.679 128 HB ILE 15 HB ILE 15 1.595 -10.963 -1.782 129 HG12 ILE 15 2HG1 ILE 15 0.798 -8.283 -2.998 130 HG13 ILE 15 3HG1 ILE 15 0.761 -9.813 -3.861 131 HG21 ILE 15 1HG2 ILE 15 0.814 -9.296 -0.117 132 HG22 ILE 15 2HG2 ILE 15 1.997 -8.136 -0.714 133 HG23 ILE 15 3HG2 ILE 15 2.536 -9.626 0.063 134 HD11 ILE 15 3HD1 ILE 15 -1.447 -9.158 -3.130 135 HD12 ILE 15 1HD1 ILE 15 -0.908 -9.104 -1.453 136 HD13 ILE 15 2HD1 ILE 15 -0.947 -10.641 -2.318 137 H LYS 16 H LYS 16 3.695 -12.279 -2.598 138 HA LYS 16 HA LYS 16 4.992 -12.773 -0.199 139 HB2 LYS 16 2HB LYS 16 5.386 -14.141 -2.898 140 HB3 LYS 16 3HB LYS 16 6.014 -14.786 -1.386 141 HG2 LYS 16 2HG LYS 16 3.075 -14.309 -1.960 142 HG3 LYS 16 3HG LYS 16 3.890 -15.857 -2.173 143 HD2 LYS 16 2HD LYS 16 3.828 -14.422 0.509 144 HD3 LYS 16 3HD LYS 16 2.537 -15.504 -0.005 145 HE2 LYS 16 2HE LYS 16 4.087 -16.691 1.450 146 HE3 LYS 16 3HE LYS 16 4.169 -17.362 -0.175 147 HZ1 LYS 16 3HZ LYS 16 6.232 -16.271 -0.550 148 HZ2 LYS 16 1HZ LYS 16 6.346 -17.054 0.941 149 HZ3 LYS 16 2HZ LYS 16 6.114 -15.384 0.886 150 H LYS 17 H LYS 17 6.316 -11.590 -3.225 151 HA LYS 17 HA LYS 17 9.095 -11.706 -2.493 152 HB2 LYS 17 2HB LYS 17 7.712 -10.218 -4.759 153 HB3 LYS 17 3HB LYS 17 9.444 -10.534 -4.629 154 HG2 LYS 17 2HG LYS 17 9.023 -12.963 -4.806 155 HG3 LYS 17 3HG LYS 17 7.285 -12.657 -4.914 156 HD2 LYS 17 2HD LYS 17 8.267 -13.059 -7.147 157 HD3 LYS 17 3HD LYS 17 7.611 -11.424 -7.019 158 HE2 LYS 17 2HE LYS 17 9.864 -10.516 -6.685 159 HE3 LYS 17 3HE LYS 17 10.545 -12.145 -6.690 160 HZ1 LYS 17 3HZ LYS 17 9.828 -12.393 -8.970 161 HZ2 LYS 17 1HZ LYS 17 10.838 -11.049 -8.806 162 HZ3 LYS 17 2HZ LYS 17 9.167 -10.839 -8.965 163 H ILE 18 H ILE 18 6.606 -9.182 -2.735 164 HA ILE 18 HA ILE 18 8.210 -6.912 -2.240 165 HB ILE 18 HB ILE 18 5.211 -7.328 -1.825 166 HG12 ILE 18 2HG1 ILE 18 6.744 -6.075 -4.153 167 HG13 ILE 18 3HG1 ILE 18 5.986 -7.661 -4.166 168 HG21 ILE 18 1HG2 ILE 18 6.736 -4.698 -1.907 169 HG22 ILE 18 2HG2 ILE 18 5.939 -5.391 -0.493 170 HG23 ILE 18 3HG2 ILE 18 4.979 -4.861 -1.873 171 HD11 ILE 18 3HD1 ILE 18 4.649 -6.058 -5.372 172 HD12 ILE 18 1HD1 ILE 18 4.550 -5.012 -3.955 173 HD13 ILE 18 2HD1 ILE 18 3.785 -6.604 -3.937 174 H LYS 19 H LYS 19 6.640 -9.206 -0.075 175 HA LYS 19 HA LYS 19 6.867 -7.846 2.379 176 HB2 LYS 19 2HB LYS 19 7.012 -10.837 1.809 177 HB3 LYS 19 3HB LYS 19 6.840 -10.130 3.416 178 HG2 LYS 19 2HG LYS 19 4.683 -9.132 2.749 179 HG3 LYS 19 3HG LYS 19 4.851 -9.845 1.145 180 HD2 LYS 19 2HD LYS 19 3.342 -11.192 2.545 181 HD3 LYS 19 3HD LYS 19 4.792 -12.109 2.128 182 HE2 LYS 19 2HE LYS 19 5.726 -11.698 4.358 183 HE3 LYS 19 3HE LYS 19 4.355 -10.667 4.771 184 HZ1 LYS 19 3HZ LYS 19 4.058 -12.824 5.717 185 HZ2 LYS 19 1HZ LYS 19 4.263 -13.579 4.214 186 HZ3 LYS 19 2HZ LYS 19 2.912 -12.607 4.498 187 H LYS 20 H LYS 20 9.063 -10.267 0.902 188 HA LYS 20 HA LYS 20 11.109 -10.023 2.865 189 HB2 LYS 20 2HB LYS 20 11.207 -11.165 0.037 190 HB3 LYS 20 3HB LYS 20 12.497 -11.349 1.226 191 HG2 LYS 20 2HG LYS 20 9.655 -12.363 1.558 192 HG3 LYS 20 3HG LYS 20 11.039 -13.353 1.084 193 HD2 LYS 20 2HD LYS 20 12.106 -13.008 3.252 194 HD3 LYS 20 3HD LYS 20 10.888 -11.818 3.717 195 HE2 LYS 20 2HE LYS 20 9.161 -13.623 3.642 196 HE3 LYS 20 3HE LYS 20 10.443 -14.794 3.306 197 HZ1 LYS 20 3HZ LYS 20 10.275 -13.064 5.713 198 HZ2 LYS 20 1HZ LYS 20 11.475 -14.218 5.407 199 HZ3 LYS 20 2HZ LYS 20 9.876 -14.709 5.662 200 H GLU 21 H GLU 21 10.409 -8.299 -0.073 201 HA GLU 21 HA GLU 21 12.830 -6.969 -0.549 202 HB2 GLU 21 2HB GLU 21 10.642 -7.089 -1.983 203 HB3 GLU 21 3HB GLU 21 10.074 -5.748 -1.002 204 HG2 GLU 21 2HG GLU 21 10.919 -4.763 -2.967 205 HG3 GLU 21 3HG GLU 21 12.168 -4.488 -1.755 206 H VAL 22 H VAL 22 9.937 -5.930 1.306 207 HA VAL 22 HA VAL 22 11.151 -3.466 2.193 208 HB VAL 22 HB VAL 22 9.084 -3.025 3.408 209 HG11 VAL 22 1HG1 VAL 22 7.478 -3.045 1.533 210 HG12 VAL 22 2HG1 VAL 22 8.499 -4.192 0.664 211 HG13 VAL 22 3HG1 VAL 22 9.091 -2.564 0.999 212 HG21 VAL 22 3HG2 VAL 22 7.200 -4.640 3.462 213 HG22 VAL 22 1HG2 VAL 22 8.611 -5.245 4.334 214 HG23 VAL 22 2HG2 VAL 22 8.235 -5.866 2.726 215 H GLU 23 H GLU 23 10.945 -6.695 3.488 216 HA GLU 23 HA GLU 23 11.319 -6.185 6.247 217 HB2 GLU 23 2HB GLU 23 11.882 -8.600 4.511 218 HB3 GLU 23 3HB GLU 23 12.294 -8.607 6.224 219 HG2 GLU 23 2HG GLU 23 9.952 -8.276 6.832 220 HG3 GLU 23 3HG GLU 23 9.505 -8.131 5.131 221 H ASN 24 H ASN 24 13.588 -6.246 3.555 222 HA ASN 24 HA ASN 24 16.027 -6.386 4.944 223 HB2 ASN 24 2HB ASN 24 15.343 -4.940 2.350 224 HB3 ASN 24 3HB ASN 24 16.987 -5.040 2.975 225 HD21 ASN 24 1HD2 ASN 24 14.515 -6.674 1.254 226 HD22 ASN 24 2HD2 ASN 24 15.381 -8.137 0.971 227 H GLN 25 H GLN 25 13.757 -3.736 4.633 228 HA GLN 25 HA GLN 25 15.577 -1.882 6.075 229 HB2 GLN 25 2HB GLN 25 13.197 -1.317 4.260 230 HB3 GLN 25 3HB GLN 25 14.010 -0.080 5.213 231 HG2 GLN 25 2HG GLN 25 15.242 -1.732 2.990 232 HG3 GLN 25 3HG GLN 25 14.798 -0.028 2.908 233 HE21 GLN 25 1HE2 GLN 25 17.115 -2.329 4.136 234 HE22 GLN 25 2HE2 GLN 25 18.294 -1.182 4.655 235 H GLY 26 H GLY 26 13.589 -4.082 7.031 236 HA2 GLY 26 2HA GLY 26 12.822 -4.443 9.159 237 HA3 GLY 26 3HA GLY 26 13.224 -2.785 9.560 238 H TYR 27 H TYR 27 11.058 -3.394 6.891 239 HA TYR 27 HA TYR 27 8.861 -2.098 8.245 240 HB2 TYR 27 2HB TYR 27 9.061 -3.362 5.484 241 HB3 TYR 27 3HB TYR 27 7.572 -2.656 6.099 242 HD1 TYR 27 HD1 TYR 27 11.197 -1.641 5.838 243 HD2 TYR 27 HD2 TYR 27 7.115 -0.488 5.296 244 HE1 TYR 27 HE1 TYR 27 11.928 0.547 5.020 245 HE2 TYR 27 HE2 TYR 27 7.861 1.714 4.479 246 HH TYR 27 HH TYR 27 11.080 2.382 3.623 247 H GLN 28 H GLN 28 7.055 -2.988 9.032 248 HA GLN 28 HA GLN 28 6.792 -5.804 9.628 249 HB2 GLN 28 2HB GLN 28 6.076 -3.952 11.179 250 HB3 GLN 28 3HB GLN 28 4.872 -3.447 10.006 251 HG2 GLN 28 2HG GLN 28 3.708 -4.655 11.704 252 HG3 GLN 28 3HG GLN 28 3.769 -5.715 10.297 253 HE21 GLN 28 1HE2 GLN 28 4.933 -5.181 13.539 254 HE22 GLN 28 2HE2 GLN 28 5.616 -6.752 13.772 255 H VAL 29 H VAL 29 4.842 -7.082 8.868 256 HA VAL 29 HA VAL 29 3.406 -5.958 6.532 257 HB VAL 29 HB VAL 29 4.379 -8.861 6.549 258 HG11 VAL 29 1HG1 VAL 29 3.624 -8.864 4.192 259 HG12 VAL 29 2HG1 VAL 29 3.084 -7.195 4.356 260 HG13 VAL 29 3HG1 VAL 29 2.300 -8.471 5.289 261 HG21 VAL 29 3HG2 VAL 29 6.365 -7.419 6.292 262 HG22 VAL 29 1HG2 VAL 29 5.586 -6.551 4.968 263 HG23 VAL 29 2HG2 VAL 29 6.011 -8.255 4.777 264 H ARG 30 H ARG 30 1.243 -6.389 6.550 265 HA ARG 30 HA ARG 30 0.176 -8.611 8.178 266 HB2 ARG 30 2HB ARG 30 -0.126 -6.566 9.533 267 HB3 ARG 30 3HB ARG 30 -0.904 -5.750 8.175 268 HG2 ARG 30 2HG ARG 30 -2.757 -7.395 8.249 269 HG3 ARG 30 3HG ARG 30 -1.982 -8.210 9.608 270 HD2 ARG 30 2HD ARG 30 -2.258 -6.161 10.975 271 HD3 ARG 30 3HD ARG 30 -3.034 -5.366 9.601 272 HE ARG 30 HE ARG 30 -4.956 -6.565 9.976 273 HH11 ARG 30 1HH1 ARG 30 -2.414 -7.908 12.013 274 HH12 ARG 30 2HH1 ARG 30 -3.498 -8.921 12.909 275 HH21 ARG 30 1HH2 ARG 30 -6.361 -7.978 11.108 276 HH22 ARG 30 2HH2 ARG 30 -5.734 -8.956 12.392 277 H ASP 31 H ASP 31 -1.543 -9.652 7.263 278 HA ASP 31 HA ASP 31 -2.457 -8.985 4.562 279 HB2 ASP 31 2HB ASP 31 -3.135 -11.353 6.387 280 HB3 ASP 31 3HB ASP 31 -3.696 -11.165 4.732 281 H VAL 32 H VAL 32 -4.106 -7.472 4.517 282 HA VAL 32 HA VAL 32 -6.328 -7.710 6.455 283 HB VAL 32 HB VAL 32 -5.897 -5.631 4.257 284 HG11 VAL 32 1HG1 VAL 32 -8.294 -5.943 4.747 285 HG12 VAL 32 2HG1 VAL 32 -7.744 -4.379 5.346 286 HG13 VAL 32 3HG1 VAL 32 -7.990 -5.716 6.471 287 HG21 VAL 32 3HG2 VAL 32 -5.486 -5.399 7.264 288 HG22 VAL 32 1HG2 VAL 32 -5.350 -4.075 6.104 289 HG23 VAL 32 2HG2 VAL 32 -4.213 -5.424 6.040 290 H ASN 33 H ASN 33 -7.777 -9.196 5.941 291 HA ASN 33 HA ASN 33 -8.065 -10.117 3.137 292 HB2 ASN 33 2HB ASN 33 -8.642 -11.641 5.717 293 HB3 ASN 33 3HB ASN 33 -8.649 -12.311 4.087 294 HD21 ASN 33 1HD2 ASN 33 -7.094 -13.129 6.417 295 HD22 ASN 33 2HD2 ASN 33 -5.432 -13.014 5.961 296 H ASP 34 H ASP 34 -9.730 -8.492 5.595 297 HA ASP 34 HA ASP 34 -12.341 -8.775 4.345 298 HB2 ASP 34 2HB ASP 34 -12.220 -10.796 5.794 299 HB3 ASP 34 3HB ASP 34 -11.829 -9.796 7.187 300 H SER 35 H SER 35 -13.952 -7.355 5.436 301 HA SER 35 HA SER 35 -12.969 -4.759 5.961 302 HB2 SER 35 2HB SER 35 -15.186 -5.283 4.933 303 HB3 SER 35 3HB SER 35 -15.746 -5.882 6.495 304 HG SER 35 HG SER 35 -15.648 -3.361 5.580 305 H ASP 36 H ASP 36 -13.965 -7.403 8.114 306 HA ASP 36 HA ASP 36 -13.935 -5.905 10.535 307 HB2 ASP 36 2HB ASP 36 -14.973 -8.239 10.154 308 HB3 ASP 36 3HB ASP 36 -13.347 -8.890 10.308 309 H GLU 37 H GLU 37 -11.514 -7.857 8.783 310 HA GLU 37 HA GLU 37 -9.314 -7.489 10.509 311 HB2 GLU 37 2HB GLU 37 -9.300 -7.840 7.477 312 HB3 GLU 37 3HB GLU 37 -7.884 -7.987 8.514 313 HG2 GLU 37 2HG GLU 37 -10.318 -9.785 8.482 314 HG3 GLU 37 3HG GLU 37 -8.692 -10.188 7.929 315 H LEU 38 H LEU 38 -10.672 -5.456 7.976 316 HA LEU 38 HA LEU 38 -8.594 -3.598 7.639 317 HB2 LEU 38 2HB LEU 38 -10.572 -3.843 6.116 318 HB3 LEU 38 3HB LEU 38 -11.589 -3.130 7.357 319 HG LEU 38 HG LEU 38 -10.136 -1.021 7.199 320 HD11 LEU 38 1HD1 LEU 38 -8.804 -0.712 5.170 321 HD12 LEU 38 2HD1 LEU 38 -9.050 -2.404 4.742 322 HD13 LEU 38 3HD1 LEU 38 -8.157 -1.979 6.206 323 HD21 LEU 38 3HD2 LEU 38 -11.222 -0.161 5.181 324 HD22 LEU 38 1HD2 LEU 38 -12.351 -1.094 6.164 325 HD23 LEU 38 2HD2 LEU 38 -11.665 -1.801 4.698 326 H LYS 39 H LYS 39 -11.554 -3.424 9.679 327 HA LYS 39 HA LYS 39 -10.800 -0.913 10.826 328 HB2 LYS 39 2HB LYS 39 -12.769 -1.179 12.282 329 HB3 LYS 39 3HB LYS 39 -13.150 -1.485 10.599 330 HG2 LYS 39 2HG LYS 39 -14.357 -3.151 11.669 331 HG3 LYS 39 3HG LYS 39 -12.877 -4.007 11.235 332 HD2 LYS 39 2HD LYS 39 -12.023 -3.669 13.552 333 HD3 LYS 39 3HD LYS 39 -13.520 -2.829 13.971 334 HE2 LYS 39 2HE LYS 39 -13.334 -5.713 13.060 335 HE3 LYS 39 3HE LYS 39 -13.486 -5.182 14.737 336 HZ1 LYS 39 3HZ LYS 39 -15.474 -4.576 12.616 337 HZ2 LYS 39 1HZ LYS 39 -15.629 -4.268 14.270 338 HZ3 LYS 39 2HZ LYS 39 -15.607 -5.864 13.702 339 H LYS 40 H LYS 40 -10.123 -4.249 11.682 340 HA LYS 40 HA LYS 40 -9.368 -3.941 14.375 341 HB2 LYS 40 2HB LYS 40 -8.393 -5.859 12.227 342 HB3 LYS 40 3HB LYS 40 -7.784 -5.938 13.870 343 HG2 LYS 40 2HG LYS 40 -10.743 -6.186 13.264 344 HG3 LYS 40 3HG LYS 40 -9.654 -7.570 13.175 345 HD2 LYS 40 2HD LYS 40 -10.595 -7.726 15.330 346 HD3 LYS 40 3HD LYS 40 -9.012 -7.013 15.622 347 HE2 LYS 40 2HE LYS 40 -10.006 -4.818 15.942 348 HE3 LYS 40 3HE LYS 40 -11.584 -5.409 15.422 349 HZ1 LYS 40 3HZ LYS 40 -11.688 -6.812 17.357 350 HZ2 LYS 40 1HZ LYS 40 -11.417 -5.213 17.831 351 HZ3 LYS 40 2HZ LYS 40 -10.145 -6.326 17.854 352 H GLU 41 H GLU 41 -7.308 -3.849 11.432 353 HA GLU 41 HA GLU 41 -5.020 -2.984 12.951 354 HB2 GLU 41 2HB GLU 41 -3.859 -2.893 10.719 355 HB3 GLU 41 3HB GLU 41 -4.509 -4.451 11.188 356 HG2 GLU 41 2HG GLU 41 -5.052 -4.378 8.946 357 HG3 GLU 41 3HG GLU 41 -6.540 -3.813 9.694 358 H MET 42 H MET 42 -7.441 -1.372 10.952 359 HA MET 42 HA MET 42 -6.138 1.137 10.791 360 HB2 MET 42 2HB MET 42 -9.025 0.295 10.487 361 HB3 MET 42 3HB MET 42 -8.665 2.011 10.660 362 HG2 MET 42 2HG MET 42 -7.662 0.159 8.487 363 HG3 MET 42 3HG MET 42 -8.812 1.488 8.318 364 HE1 MET 42 3HE MET 42 -7.998 4.119 8.917 365 HE2 MET 42 1HE MET 42 -6.306 4.555 9.134 366 HE3 MET 42 2HE MET 42 -7.142 3.624 10.376 367 H LYS 43 H LYS 43 -8.063 -0.333 13.351 368 HA LYS 43 HA LYS 43 -8.124 1.983 15.038 369 HB2 LYS 43 2HB LYS 43 -8.912 -0.865 15.294 370 HB3 LYS 43 3HB LYS 43 -8.312 -0.191 16.797 371 HG2 LYS 43 2HG LYS 43 -10.710 0.002 16.741 372 HG3 LYS 43 3HG LYS 43 -10.001 1.618 16.651 373 HD2 LYS 43 2HD LYS 43 -10.445 1.718 14.247 374 HD3 LYS 43 3HD LYS 43 -11.022 0.050 14.251 375 HE2 LYS 43 2HE LYS 43 -12.921 1.557 14.198 376 HE3 LYS 43 3HE LYS 43 -12.887 0.740 15.762 377 HZ1 LYS 43 3HZ LYS 43 -11.982 3.510 15.182 378 HZ2 LYS 43 1HZ LYS 43 -11.794 2.738 16.673 379 HZ3 LYS 43 2HZ LYS 43 -13.340 3.051 16.076 380 H LYS 44 H LYS 44 -5.740 -0.562 14.448 381 HA LYS 44 HA LYS 44 -4.061 0.085 16.702 382 HB2 LYS 44 2HB LYS 44 -3.183 -1.287 14.120 383 HB3 LYS 44 3HB LYS 44 -2.364 -1.337 15.677 384 HG2 LYS 44 2HG LYS 44 -4.996 -2.644 14.942 385 HG3 LYS 44 3HG LYS 44 -3.469 -3.450 15.295 386 HD2 LYS 44 2HD LYS 44 -5.168 -1.884 17.278 387 HD3 LYS 44 3HD LYS 44 -5.057 -3.639 17.167 388 HE2 LYS 44 2HE LYS 44 -2.825 -1.739 17.956 389 HE3 LYS 44 3HE LYS 44 -3.695 -2.844 19.017 390 HZ1 LYS 44 3HZ LYS 44 -1.591 -3.771 18.452 391 HZ2 LYS 44 1HZ LYS 44 -1.880 -3.597 16.794 392 HZ3 LYS 44 2HZ LYS 44 -2.794 -4.691 17.704 393 H LEU 45 H LEU 45 -4.330 1.153 13.368 394 HA LEU 45 HA LEU 45 -1.960 2.785 13.293 395 HB2 LEU 45 2HB LEU 45 -4.433 2.864 11.514 396 HB3 LEU 45 3HB LEU 45 -2.871 3.572 11.133 397 HG LEU 45 HG LEU 45 -3.331 0.584 11.467 398 HD11 LEU 45 1HD1 LEU 45 -3.243 0.419 9.017 399 HD12 LEU 45 2HD1 LEU 45 -3.264 2.183 8.908 400 HD13 LEU 45 3HD1 LEU 45 -4.642 1.320 9.594 401 HD21 LEU 45 3HD2 LEU 45 -0.970 2.059 10.281 402 HD22 LEU 45 1HD2 LEU 45 -1.172 0.306 10.372 403 HD23 LEU 45 2HD2 LEU 45 -1.012 1.249 11.850 404 H ALA 46 H ALA 46 -5.302 3.197 14.262 405 HA ALA 46 HA ALA 46 -5.279 6.093 14.230 406 HB1 ALA 46 3HB ALA 46 -7.328 4.859 13.685 407 HB2 ALA 46 1HB ALA 46 -7.575 5.905 15.086 408 HB3 ALA 46 2HB ALA 46 -7.360 4.165 15.307 409 H GLU 47 H GLU 47 -5.447 3.580 16.790 410 HA GLU 47 HA GLU 47 -5.313 5.487 18.940 411 HB2 GLU 47 2HB GLU 47 -4.829 2.478 19.093 412 HB3 GLU 47 3HB GLU 47 -5.154 3.553 20.449 413 HG2 GLU 47 2HG GLU 47 -7.052 2.637 18.285 414 HG3 GLU 47 3HG GLU 47 -7.170 2.376 20.023 415 H GLU 48 H GLU 48 -3.019 3.176 17.512 416 HA GLU 48 HA GLU 48 -0.752 4.547 18.839 417 HB2 GLU 48 2HB GLU 48 -0.841 1.871 17.361 418 HB3 GLU 48 3HB GLU 48 0.581 2.559 18.142 419 HG2 GLU 48 2HG GLU 48 -0.464 2.348 20.340 420 HG3 GLU 48 3HG GLU 48 -1.971 1.800 19.604 421 H LYS 49 H LYS 49 -1.213 6.362 17.385 422 HA LYS 49 HA LYS 49 -0.605 6.063 14.527 423 HB2 LYS 49 2HB LYS 49 -2.530 7.443 15.350 424 HB3 LYS 49 3HB LYS 49 -1.396 8.537 16.135 425 HG2 LYS 49 2HG LYS 49 -0.532 9.290 14.003 426 HG3 LYS 49 3HG LYS 49 -1.408 8.024 13.140 427 HD2 LYS 49 2HD LYS 49 -2.461 10.256 12.905 428 HD3 LYS 49 3HD LYS 49 -3.534 9.068 13.645 429 HE2 LYS 49 2HE LYS 49 -3.708 11.260 14.753 430 HE3 LYS 49 3HE LYS 49 -3.092 10.044 15.869 431 HZ1 LYS 49 3HZ LYS 49 -0.891 10.897 15.575 432 HZ2 LYS 49 1HZ LYS 49 -1.916 12.173 15.998 433 HZ3 LYS 49 2HZ LYS 49 -1.408 11.993 14.394 434 H ASN 50 H ASN 50 1.329 5.935 16.965 435 HA ASN 50 HA ASN 50 3.403 7.800 16.650 436 HB2 ASN 50 2HB ASN 50 4.808 6.127 17.793 437 HB3 ASN 50 3HB ASN 50 3.232 6.222 18.567 438 HD21 ASN 50 1HD2 ASN 50 5.188 4.058 18.627 439 HD22 ASN 50 2HD2 ASN 50 4.383 2.652 18.031 440 H PHE 51 H PHE 51 5.612 7.216 15.744 441 HA PHE 51 HA PHE 51 5.334 6.668 12.961 442 HB2 PHE 51 2HB PHE 51 6.995 8.292 14.106 443 HB3 PHE 51 3HB PHE 51 7.990 6.877 14.434 444 HD1 PHE 51 HD1 PHE 51 9.021 5.601 12.515 445 HD2 PHE 51 HD2 PHE 51 6.811 9.218 11.883 446 HE1 PHE 51 HE1 PHE 51 9.963 5.795 10.257 447 HE2 PHE 51 HE2 PHE 51 7.765 9.398 9.629 448 HZ PHE 51 HZ PHE 51 9.334 7.691 8.815 449 H GLU 52 H GLU 52 5.572 4.799 11.897 450 HA GLU 52 HA GLU 52 7.276 2.648 12.747 451 HB2 GLU 52 2HB GLU 52 5.278 2.237 14.197 452 HB3 GLU 52 3HB GLU 52 4.250 2.184 12.770 453 HG2 GLU 52 2HG GLU 52 4.723 -0.078 13.588 454 HG3 GLU 52 3HG GLU 52 5.411 0.164 11.985 455 H LYS 53 H LYS 53 7.695 1.241 11.080 456 HA LYS 53 HA LYS 53 6.771 1.955 8.383 457 HB2 LYS 53 2HB LYS 53 8.963 0.036 9.321 458 HB3 LYS 53 3HB LYS 53 8.681 0.546 7.659 459 HG2 LYS 53 2HG LYS 53 9.377 2.796 8.137 460 HG3 LYS 53 3HG LYS 53 9.405 2.484 9.875 461 HD2 LYS 53 2HD LYS 53 11.276 0.810 9.450 462 HD3 LYS 53 3HD LYS 53 11.313 1.365 7.773 463 HE2 LYS 53 2HE LYS 53 11.917 3.616 8.496 464 HE3 LYS 53 3HE LYS 53 11.741 3.153 10.190 465 HZ1 LYS 53 3HZ LYS 53 14.052 3.203 9.476 466 HZ2 LYS 53 1HZ LYS 53 13.735 2.008 8.316 467 HZ3 LYS 53 2HZ LYS 53 13.582 1.654 9.964 468 H ILE 54 H ILE 54 4.818 0.939 7.954 469 HA ILE 54 HA ILE 54 4.626 -1.996 8.408 470 HB ILE 54 HB ILE 54 2.303 -0.003 8.618 471 HG12 ILE 54 2HG1 ILE 54 3.685 -1.657 10.783 472 HG13 ILE 54 3HG1 ILE 54 3.745 0.092 10.619 473 HG21 ILE 54 1HG2 ILE 54 1.575 -2.158 7.641 474 HG22 ILE 54 2HG2 ILE 54 0.911 -1.948 9.261 475 HG23 ILE 54 3HG2 ILE 54 2.285 -3.025 9.006 476 HD11 ILE 54 3HD1 ILE 54 2.265 -0.544 12.406 477 HD12 ILE 54 1HD1 ILE 54 1.302 -1.545 11.317 478 HD13 ILE 54 2HD1 ILE 54 1.341 0.210 11.110 479 H LEU 55 H LEU 55 4.103 -3.149 6.689 480 HA LEU 55 HA LEU 55 3.259 -1.931 4.137 481 HB2 LEU 55 2HB LEU 55 5.384 -3.273 4.115 482 HB3 LEU 55 3HB LEU 55 4.506 -4.662 4.723 483 HG LEU 55 HG LEU 55 3.045 -4.350 2.507 484 HD11 LEU 55 1HD1 LEU 55 4.344 -3.486 0.610 485 HD12 LEU 55 2HD1 LEU 55 5.597 -2.936 1.725 486 HD13 LEU 55 3HD1 LEU 55 3.974 -2.244 1.804 487 HD21 LEU 55 3HD2 LEU 55 4.414 -6.337 2.981 488 HD22 LEU 55 1HD2 LEU 55 5.838 -5.514 2.345 489 HD23 LEU 55 2HD2 LEU 55 4.482 -5.889 1.278 490 H ILE 56 H ILE 56 1.043 -2.032 4.046 491 HA ILE 56 HA ILE 56 -0.394 -4.328 5.174 492 HB ILE 56 HB ILE 56 -1.412 -1.714 4.002 493 HG12 ILE 56 2HG1 ILE 56 -0.429 -1.502 6.273 494 HG13 ILE 56 3HG1 ILE 56 -2.167 -1.234 6.321 495 HG21 ILE 56 1HG2 ILE 56 -3.024 -4.057 5.063 496 HG22 ILE 56 2HG2 ILE 56 -3.029 -3.431 3.414 497 HG23 ILE 56 3HG2 ILE 56 -3.684 -2.463 4.725 498 HD11 ILE 56 3HD1 ILE 56 -2.480 -3.515 7.196 499 HD12 ILE 56 1HD1 ILE 56 -1.432 -2.529 8.215 500 HD13 ILE 56 2HD1 ILE 56 -0.727 -3.752 7.162 501 H LYS 57 H LYS 57 -0.926 -5.956 3.982 502 HA LYS 57 HA LYS 57 -0.851 -5.971 1.072 503 HB2 LYS 57 2HB LYS 57 0.295 -7.825 2.089 504 HB3 LYS 57 3HB LYS 57 -1.010 -8.102 3.239 505 HG2 LYS 57 2HG LYS 57 -2.473 -8.825 1.348 506 HG3 LYS 57 3HG LYS 57 -1.094 -8.649 0.259 507 HD2 LYS 57 2HD LYS 57 0.118 -10.397 1.460 508 HD3 LYS 57 3HD LYS 57 -1.172 -10.503 2.662 509 HE2 LYS 57 2HE LYS 57 -2.729 -11.296 0.924 510 HE3 LYS 57 3HE LYS 57 -1.448 -11.177 -0.284 511 HZ1 LYS 57 3HZ LYS 57 -1.648 -13.428 0.434 512 HZ2 LYS 57 1HZ LYS 57 -1.502 -12.985 2.066 513 HZ3 LYS 57 2HZ LYS 57 -0.186 -12.811 1.024 514 H SER 58 H SER 58 -2.634 -6.279 -0.175 515 HA SER 58 HA SER 58 -4.992 -7.608 0.672 516 HB2 SER 58 2HB SER 58 -5.508 -5.332 1.609 517 HB3 SER 58 3HB SER 58 -5.320 -4.640 0.001 518 HG SER 58 HG SER 58 -7.487 -5.705 1.083 519 H ASN 59 H ASN 59 -6.619 -7.540 -1.216 520 HA ASN 59 HA ASN 59 -5.512 -6.882 -3.846 521 HB2 ASN 59 2HB ASN 59 -6.292 -9.135 -4.743 522 HB3 ASN 59 3HB ASN 59 -4.864 -9.187 -3.720 523 HD21 ASN 59 1HD2 ASN 59 -5.182 -11.374 -3.275 524 HD22 ASN 59 2HD2 ASN 59 -6.419 -11.936 -2.208 525 H ASP 60 H ASP 60 -7.654 -6.092 -1.822 526 HA ASP 60 HA ASP 60 -9.940 -5.940 -3.697 527 HB2 ASP 60 2HB ASP 60 -10.517 -7.562 -1.928 528 HB3 ASP 60 3HB ASP 60 -10.074 -6.399 -0.681 529 H LYS 61 H LYS 61 -9.633 -3.933 -4.367 530 HA LYS 61 HA LYS 61 -8.520 -1.762 -3.032 531 HB2 LYS 61 2HB LYS 61 -9.342 -0.351 -4.896 532 HB3 LYS 61 3HB LYS 61 -8.549 -1.809 -5.459 533 HG2 LYS 61 2HG LYS 61 -11.563 -1.766 -5.234 534 HG3 LYS 61 3HG LYS 61 -10.781 -0.965 -6.598 535 HD2 LYS 61 2HD LYS 61 -9.657 -3.114 -7.189 536 HD3 LYS 61 3HD LYS 61 -10.489 -3.906 -5.850 537 HE2 LYS 61 2HE LYS 61 -12.653 -3.461 -6.915 538 HE3 LYS 61 3HE LYS 61 -11.843 -2.607 -8.232 539 HZ1 LYS 61 3HZ LYS 61 -10.758 -4.623 -8.884 540 HZ2 LYS 61 1HZ LYS 61 -12.423 -4.910 -8.787 541 HZ3 LYS 61 2HZ LYS 61 -11.400 -5.465 -7.563 542 H GLN 62 H GLN 62 -11.699 -2.985 -2.621 543 HA GLN 62 HA GLN 62 -13.144 -0.638 -1.965 544 HB2 GLN 62 2HB GLN 62 -13.488 -3.442 -0.813 545 HB3 GLN 62 3HB GLN 62 -14.682 -2.150 -0.742 546 HG2 GLN 62 2HG GLN 62 -13.703 -3.531 -3.260 547 HG3 GLN 62 3HG GLN 62 -15.239 -3.825 -2.453 548 HE21 GLN 62 1HE2 GLN 62 -16.872 -2.254 -2.594 549 HE22 GLN 62 2HE2 GLN 62 -16.857 -1.012 -3.795 550 H LEU 63 H LEU 63 -11.407 -2.993 0.029 551 HA LEU 63 HA LEU 63 -11.576 -1.850 2.556 552 HB2 LEU 63 2HB LEU 63 -9.286 -3.467 1.349 553 HB3 LEU 63 3HB LEU 63 -9.501 -3.180 3.071 554 HG LEU 63 HG LEU 63 -11.404 -4.760 1.296 555 HD11 LEU 63 1HD1 LEU 63 -9.319 -5.974 1.661 556 HD12 LEU 63 2HD1 LEU 63 -10.652 -6.743 2.518 557 HD13 LEU 63 3HD1 LEU 63 -9.480 -5.767 3.407 558 HD21 LEU 63 3HD2 LEU 63 -12.630 -3.633 3.066 559 HD22 LEU 63 1HD2 LEU 63 -11.513 -4.259 4.284 560 HD23 LEU 63 2HD2 LEU 63 -12.559 -5.363 3.386 561 H LEU 64 H LEU 64 -9.271 -1.215 -0.056 562 HA LEU 64 HA LEU 64 -7.435 0.371 1.418 563 HB2 LEU 64 2HB LEU 64 -7.934 0.044 -1.552 564 HB3 LEU 64 3HB LEU 64 -6.756 1.200 -0.950 565 HG LEU 64 HG LEU 64 -5.550 -0.707 0.205 566 HD11 LEU 64 1HD1 LEU 64 -7.397 -2.480 -1.401 567 HD12 LEU 64 2HD1 LEU 64 -7.361 -2.326 0.357 568 HD13 LEU 64 3HD1 LEU 64 -5.975 -3.007 -0.493 569 HD21 LEU 64 3HD2 LEU 64 -4.754 0.186 -1.908 570 HD22 LEU 64 1HD2 LEU 64 -5.796 -0.928 -2.799 571 HD23 LEU 64 2HD2 LEU 64 -4.469 -1.551 -1.810 572 H LYS 65 H LYS 65 -10.259 1.251 -0.636 573 HA LYS 65 HA LYS 65 -9.985 4.051 -0.572 574 HB2 LYS 65 2HB LYS 65 -12.534 2.374 -0.656 575 HB3 LYS 65 3HB LYS 65 -12.489 4.117 -0.928 576 HG2 LYS 65 2HG LYS 65 -11.033 3.767 -2.889 577 HG3 LYS 65 3HG LYS 65 -11.112 2.023 -2.635 578 HD2 LYS 65 2HD LYS 65 -13.512 3.806 -3.225 579 HD3 LYS 65 3HD LYS 65 -12.660 2.834 -4.426 580 HE2 LYS 65 2HE LYS 65 -13.262 0.781 -3.139 581 HE3 LYS 65 3HE LYS 65 -14.179 1.785 -2.012 582 HZ1 LYS 65 3HZ LYS 65 -14.715 1.530 -4.920 583 HZ2 LYS 65 1HZ LYS 65 -15.606 2.464 -3.830 584 HZ3 LYS 65 2HZ LYS 65 -15.598 0.779 -3.692 585 H GLU 66 H GLU 66 -11.859 1.874 1.494 586 HA GLU 66 HA GLU 66 -12.991 3.790 3.229 587 HB2 GLU 66 2HB GLU 66 -12.488 0.821 3.673 588 HB3 GLU 66 3HB GLU 66 -13.610 1.818 4.601 589 HG2 GLU 66 2HG GLU 66 -15.006 2.162 2.642 590 HG3 GLU 66 3HG GLU 66 -13.840 1.330 1.617 591 H MET 67 H MET 67 -10.022 1.889 3.428 592 HA MET 67 HA MET 67 -9.158 2.463 6.028 593 HB2 MET 67 2HB MET 67 -8.018 0.793 4.648 594 HB3 MET 67 3HB MET 67 -7.559 2.011 3.469 595 HG2 MET 67 2HG MET 67 -6.145 3.096 5.196 596 HG3 MET 67 3HG MET 67 -6.562 1.808 6.313 597 HE1 MET 67 3HE MET 67 -4.779 -1.249 4.867 598 HE2 MET 67 1HE MET 67 -6.473 -0.816 4.712 599 HE3 MET 67 2HE MET 67 -5.631 -0.572 6.244 600 H LEU 68 H LEU 68 -8.474 4.130 2.956 601 HA LEU 68 HA LEU 68 -6.812 6.167 4.002 602 HB2 LEU 68 2HB LEU 68 -8.364 6.009 1.394 603 HB3 LEU 68 3HB LEU 68 -7.132 7.215 1.735 604 HG LEU 68 HG LEU 68 -6.565 4.219 1.692 605 HD11 LEU 68 1HD1 LEU 68 -7.310 4.906 -0.521 606 HD12 LEU 68 2HD1 LEU 68 -5.592 4.522 -0.524 607 HD13 LEU 68 3HD1 LEU 68 -6.117 6.209 -0.544 608 HD21 LEU 68 3HD2 LEU 68 -4.658 6.578 1.613 609 HD22 LEU 68 1HD2 LEU 68 -4.213 4.870 1.530 610 HD23 LEU 68 2HD2 LEU 68 -4.943 5.519 2.997 611 H GLU 69 H GLU 69 -10.315 5.950 3.570 612 HA GLU 69 HA GLU 69 -10.975 8.685 3.924 613 HB2 GLU 69 2HB GLU 69 -12.633 6.228 4.641 614 HB3 GLU 69 3HB GLU 69 -13.256 7.871 4.521 615 HG2 GLU 69 2HG GLU 69 -12.143 6.188 2.259 616 HG3 GLU 69 3HG GLU 69 -13.830 6.597 2.529 617 H LEU 70 H LEU 70 -10.320 6.081 6.211 618 HA LEU 70 HA LEU 70 -10.951 7.607 8.587 619 HB2 LEU 70 2HB LEU 70 -9.397 5.020 8.238 620 HB3 LEU 70 3HB LEU 70 -9.951 5.662 9.777 621 HG LEU 70 HG LEU 70 -11.789 4.768 7.515 622 HD11 LEU 70 1HD1 LEU 70 -12.272 2.782 8.855 623 HD12 LEU 70 2HD1 LEU 70 -11.077 3.278 10.058 624 HD13 LEU 70 3HD1 LEU 70 -10.564 2.858 8.422 625 HD21 LEU 70 3HD2 LEU 70 -12.817 6.478 8.925 626 HD22 LEU 70 1HD2 LEU 70 -12.445 5.547 10.378 627 HD23 LEU 70 2HD2 LEU 70 -13.588 4.917 9.188 628 H ILE 71 H ILE 71 -8.075 6.817 6.693 629 HA ILE 71 HA ILE 71 -6.079 7.941 8.383 630 HB ILE 71 HB ILE 71 -6.077 7.393 5.378 631 HG12 ILE 71 2HG1 ILE 71 -4.841 5.839 7.695 632 HG13 ILE 71 3HG1 ILE 71 -6.290 5.380 6.808 633 HG21 ILE 71 1HG2 ILE 71 -4.395 9.130 5.831 634 HG22 ILE 71 2HG2 ILE 71 -3.612 7.609 5.407 635 HG23 ILE 71 3HG2 ILE 71 -3.676 8.127 7.093 636 HD11 ILE 71 3HD1 ILE 71 -4.938 5.100 4.776 637 HD12 ILE 71 1HD1 ILE 71 -4.406 4.065 6.099 638 HD13 ILE 71 2HD1 ILE 71 -3.489 5.514 5.698 639 H SER 72 H SER 72 -8.384 9.357 6.168 640 HA SER 72 HA SER 72 -7.294 11.855 5.627 641 HB2 SER 72 2HB SER 72 -9.435 11.007 4.667 642 HB3 SER 72 3HB SER 72 -10.212 11.211 6.235 643 HG SER 72 HG SER 72 -9.963 12.992 4.326 644 H LYS 73 H LYS 73 -8.910 10.696 8.578 645 HA LYS 73 HA LYS 73 -8.844 13.216 9.981 646 HB2 LYS 73 2HB LYS 73 -9.234 10.391 11.051 647 HB3 LYS 73 3HB LYS 73 -9.527 11.876 11.954 648 HG2 LYS 73 2HG LYS 73 -11.345 12.462 10.365 649 HG3 LYS 73 3HG LYS 73 -11.070 10.936 9.509 650 HD2 LYS 73 2HD LYS 73 -11.657 9.662 11.533 651 HD3 LYS 73 3HD LYS 73 -11.833 11.157 12.455 652 HE2 LYS 73 2HE LYS 73 -13.734 11.803 11.010 653 HE3 LYS 73 3HE LYS 73 -13.565 10.287 10.122 654 HZ1 LYS 73 3HZ LYS 73 -14.019 9.085 12.157 655 HZ2 LYS 73 1HZ LYS 73 -15.286 10.148 11.808 656 HZ3 LYS 73 2HZ LYS 73 -14.172 10.529 13.020 657 H LEU 74 H LEU 74 -6.759 10.400 9.695 658 HA LEU 74 HA LEU 74 -5.222 10.845 12.085 659 HB2 LEU 74 2HB LEU 74 -4.698 9.012 9.707 660 HB3 LEU 74 3HB LEU 74 -3.832 8.959 11.235 661 HG LEU 74 HG LEU 74 -6.793 8.340 10.860 662 HD11 LEU 74 1HD1 LEU 74 -4.497 6.454 11.471 663 HD12 LEU 74 2HD1 LEU 74 -5.363 6.584 9.939 664 HD13 LEU 74 3HD1 LEU 74 -6.210 6.024 11.377 665 HD21 LEU 74 3HD2 LEU 74 -6.391 9.353 13.050 666 HD22 LEU 74 1HD2 LEU 74 -5.115 8.178 13.384 667 HD23 LEU 74 2HD2 LEU 74 -6.790 7.647 13.211 668 H GLY 75 H GLY 75 -4.787 11.517 8.664 669 HA2 GLY 75 2HA GLY 75 -3.448 12.910 7.490 670 HA3 GLY 75 3HA GLY 75 -3.099 13.726 9.002 671 H TYR 76 H TYR 76 -2.179 10.862 7.061 672 HA TYR 76 HA TYR 76 0.598 11.637 7.307 673 HB2 TYR 76 2HB TYR 76 1.392 9.314 7.939 674 HB3 TYR 76 3HB TYR 76 0.613 10.212 9.223 675 HD1 TYR 76 HD2 TYR 76 -0.281 7.645 6.597 676 HD2 TYR 76 HD1 TYR 76 -0.887 9.038 10.596 677 HE1 TYR 76 HE2 TYR 76 -1.698 5.700 7.063 678 HE2 TYR 76 HE1 TYR 76 -2.293 7.079 11.060 679 HH TYR 76 HH TYR 76 -2.493 4.389 8.950 680 H LYS 77 H LYS 77 2.017 10.351 5.854 681 HA LYS 77 HA LYS 77 0.734 10.196 3.270 682 HB2 LYS 77 2HB LYS 77 2.895 11.412 3.645 683 HB3 LYS 77 3HB LYS 77 3.671 9.855 3.924 684 HG2 LYS 77 2HG LYS 77 3.160 9.141 1.637 685 HG3 LYS 77 3HG LYS 77 2.249 10.629 1.348 686 HD2 LYS 77 2HD LYS 77 4.299 11.957 1.624 687 HD3 LYS 77 3HD LYS 77 5.213 10.489 1.969 688 HE2 LYS 77 2HE LYS 77 5.594 11.178 -0.340 689 HE3 LYS 77 3HE LYS 77 4.692 9.665 -0.324 690 HZ1 LYS 77 3HZ LYS 77 2.643 11.032 -0.645 691 HZ2 LYS 77 1HZ LYS 77 3.735 11.100 -1.937 692 HZ3 LYS 77 2HZ LYS 77 3.638 12.384 -0.853 693 H VAL 78 H VAL 78 0.225 8.403 2.227 694 HA VAL 78 HA VAL 78 1.210 5.755 3.116 695 HB VAL 78 HB VAL 78 -1.478 6.429 1.819 696 HG11 VAL 78 1HG1 VAL 78 -0.702 4.170 1.223 697 HG12 VAL 78 2HG1 VAL 78 -2.095 4.089 2.303 698 HG13 VAL 78 3HG1 VAL 78 -0.472 3.789 2.930 699 HG21 VAL 78 3HG2 VAL 78 -1.372 7.264 4.144 700 HG22 VAL 78 1HG2 VAL 78 -0.890 5.662 4.707 701 HG23 VAL 78 2HG2 VAL 78 -2.495 5.909 4.013 702 H PHE 79 H PHE 79 1.826 4.295 1.484 703 HA PHE 79 HA PHE 79 2.303 5.412 -1.217 704 HB2 PHE 79 2HB PHE 79 3.970 3.384 0.352 705 HB3 PHE 79 3HB PHE 79 4.333 3.979 -1.263 706 HD1 PHE 79 HD2 PHE 79 4.203 4.899 2.324 707 HD2 PHE 79 HD1 PHE 79 5.401 6.131 -1.596 708 HE1 PHE 79 HE2 PHE 79 5.505 6.734 3.289 709 HE2 PHE 79 HE1 PHE 79 6.703 7.962 -0.615 710 HZ PHE 79 HZ PHE 79 6.759 8.266 1.824 711 H LEU 80 H LEU 80 0.894 4.401 -2.601 712 HA LEU 80 HA LEU 80 0.104 1.599 -2.066 713 HB2 LEU 80 2HB LEU 80 -1.774 3.072 -1.894 714 HB3 LEU 80 3HB LEU 80 -1.356 3.910 -3.379 715 HG LEU 80 HG LEU 80 -2.070 2.018 -4.741 716 HD11 LEU 80 1HD1 LEU 80 -2.624 0.484 -2.197 717 HD12 LEU 80 2HD1 LEU 80 -1.321 0.163 -3.343 718 HD13 LEU 80 3HD1 LEU 80 -2.998 -0.043 -3.839 719 HD21 LEU 80 3HD2 LEU 80 -3.811 3.592 -4.037 720 HD22 LEU 80 1HD2 LEU 80 -4.157 2.597 -2.618 721 HD23 LEU 80 2HD2 LEU 80 -4.461 1.967 -4.240 722 H LEU 81 H LEU 81 0.949 0.146 -3.388 723 HA LEU 81 HA LEU 81 1.614 0.831 -6.177 724 HB2 LEU 81 2HB LEU 81 3.400 -0.269 -4.842 725 HB3 LEU 81 3HB LEU 81 2.351 -1.648 -4.572 726 HG LEU 81 HG LEU 81 2.413 -2.242 -6.958 727 HD11 LEU 81 1HD1 LEU 81 4.107 0.237 -7.374 728 HD12 LEU 81 2HD1 LEU 81 2.465 -0.028 -7.964 729 HD13 LEU 81 3HD1 LEU 81 3.789 -1.009 -8.585 730 HD21 LEU 81 3HD2 LEU 81 4.217 -3.105 -5.547 731 HD22 LEU 81 1HD2 LEU 81 5.202 -1.682 -5.907 732 HD23 LEU 81 2HD2 LEU 81 4.786 -2.824 -7.191 733 H LEU 82 H LEU 82 0.327 0.190 -7.728 734 HA LEU 82 HA LEU 82 -1.678 -1.952 -7.322 735 HB2 LEU 82 2HB LEU 82 -1.695 0.491 -9.146 736 HB3 LEU 82 3HB LEU 82 -2.956 -0.734 -9.110 737 HG LEU 82 HG LEU 82 -2.233 1.000 -6.712 738 HD11 LEU 82 1HD1 LEU 82 -4.215 2.318 -7.176 739 HD12 LEU 82 2HD1 LEU 82 -4.516 1.398 -8.655 740 HD13 LEU 82 3HD1 LEU 82 -3.074 2.411 -8.516 741 HD21 LEU 82 3HD2 LEU 82 -3.287 -1.119 -6.104 742 HD22 LEU 82 1HD2 LEU 82 -4.627 -0.798 -7.211 743 HD23 LEU 82 2HD2 LEU 82 -4.375 0.231 -5.796 744 H ALA 83 H ALA 83 -1.362 -3.748 -8.615 745 HA ALA 83 HA ALA 83 0.427 -3.533 -10.962 746 HB1 ALA 83 3HB ALA 83 0.869 -5.496 -8.694 747 HB2 ALA 83 1HB ALA 83 1.861 -4.083 -9.043 748 HB3 ALA 83 2HB ALA 83 1.793 -5.421 -10.194 749 H ASP 84 H ASP 84 -0.657 -4.307 -12.592 750 HA ASP 84 HA ASP 84 -1.226 -7.012 -12.946 751 HB2 ASP 84 2HB ASP 84 -3.284 -6.614 -11.592 752 HB3 ASP 84 3HB ASP 84 -3.765 -5.311 -12.676 753 H GLN 85 H GLN 85 -1.910 -7.476 -15.125 754 HA GLN 85 HA GLN 85 -0.814 -5.841 -17.112 755 HB2 GLN 85 2HB GLN 85 -1.043 -8.288 -17.313 756 HB3 GLN 85 3HB GLN 85 -2.794 -8.136 -17.363 757 HG2 GLN 85 2HG GLN 85 -1.835 -8.557 -19.601 758 HG3 GLN 85 3HG GLN 85 -2.682 -7.017 -19.531 759 HE21 GLN 85 1HE2 GLN 85 -1.495 -5.098 -19.730 760 HE22 GLN 85 2HE2 GLN 85 0.149 -5.069 -20.257 761 H ASP 86 H ASP 86 -4.211 -6.207 -16.055 762 HA ASP 86 HA ASP 86 -5.188 -4.163 -17.867 763 HB2 ASP 86 2HB ASP 86 -6.773 -5.900 -17.049 764 HB3 ASP 86 3HB ASP 86 -6.532 -5.349 -15.393 765 H GLU 87 H GLU 87 -3.776 -2.506 -17.509 766 HA GLU 87 HA GLU 87 -3.297 -1.285 -14.964 767 HB2 GLU 87 2HB GLU 87 -2.060 0.385 -16.179 768 HB3 GLU 87 3HB GLU 87 -1.694 -1.182 -16.886 769 HG2 GLU 87 2HG GLU 87 -3.266 -0.704 -18.742 770 HG3 GLU 87 3HG GLU 87 -3.607 0.878 -18.041 771 H ASN 88 H ASN 88 -5.939 -1.246 -17.058 772 HA ASN 88 HA ASN 88 -6.824 1.406 -17.074 773 HB2 ASN 88 2HB ASN 88 -7.760 -0.316 -18.562 774 HB3 ASN 88 3HB ASN 88 -8.465 -1.156 -17.185 775 HD21 ASN 88 1HD2 ASN 88 -8.482 2.384 -17.578 776 HD22 ASN 88 2HD2 ASN 88 -10.190 2.508 -17.799 777 H GLU 89 H GLU 89 -7.955 -1.262 -14.945 778 HA GLU 89 HA GLU 89 -9.648 0.260 -13.297 779 HB2 GLU 89 2HB GLU 89 -9.736 -2.195 -13.367 780 HB3 GLU 89 3HB GLU 89 -8.114 -2.302 -12.695 781 HG2 GLU 89 2HG GLU 89 -8.973 -1.225 -10.597 782 HG3 GLU 89 3HG GLU 89 -10.604 -1.297 -11.266 783 H LEU 90 H LEU 90 -6.247 -0.586 -13.034 784 HA LEU 90 HA LEU 90 -5.707 0.289 -10.420 785 HB2 LEU 90 2HB LEU 90 -3.767 0.183 -12.756 786 HB3 LEU 90 3HB LEU 90 -3.358 0.108 -11.047 787 HG LEU 90 HG LEU 90 -4.814 -2.037 -12.645 788 HD11 LEU 90 1HD1 LEU 90 -2.015 -2.002 -11.486 789 HD12 LEU 90 2HD1 LEU 90 -2.448 -1.888 -13.194 790 HD13 LEU 90 3HD1 LEU 90 -2.786 -3.367 -12.300 791 HD21 LEU 90 3HD2 LEU 90 -4.013 -2.072 -9.712 792 HD22 LEU 90 1HD2 LEU 90 -4.652 -3.441 -10.626 793 HD23 LEU 90 2HD2 LEU 90 -5.660 -2.023 -10.351 794 H GLU 91 H GLU 91 -5.350 1.924 -13.570 795 HA GLU 91 HA GLU 91 -4.023 4.235 -12.536 796 HB2 GLU 91 2HB GLU 91 -3.734 3.441 -14.879 797 HB3 GLU 91 3HB GLU 91 -5.404 3.882 -15.228 798 HG2 GLU 91 2HG GLU 91 -4.880 6.264 -14.754 799 HG3 GLU 91 3HG GLU 91 -3.214 5.818 -14.381 800 H GLU 92 H GLU 92 -7.361 3.559 -13.559 801 HA GLU 92 HA GLU 92 -8.381 6.166 -13.151 802 HB2 GLU 92 2HB GLU 92 -9.846 3.495 -13.090 803 HB3 GLU 92 3HB GLU 92 -10.616 5.074 -13.232 804 HG2 GLU 92 2HG GLU 92 -8.761 3.781 -15.254 805 HG3 GLU 92 3HG GLU 92 -10.501 3.993 -15.411 806 H PHE 93 H PHE 93 -8.144 3.334 -11.046 807 HA PHE 93 HA PHE 93 -9.384 4.336 -8.730 808 HB2 PHE 93 2HB PHE 93 -8.813 1.946 -9.046 809 HB3 PHE 93 3HB PHE 93 -7.099 2.330 -8.986 810 HD1 PHE 93 HD1 PHE 93 -10.049 3.207 -6.825 811 HD2 PHE 93 HD2 PHE 93 -6.142 1.487 -7.011 812 HE1 PHE 93 HE1 PHE 93 -10.077 2.837 -4.412 813 HE2 PHE 93 HE2 PHE 93 -6.180 1.126 -4.585 814 HZ PHE 93 HZ PHE 93 -8.156 1.802 -3.274 815 H LYS 94 H LYS 94 -5.973 4.500 -9.805 816 HA LYS 94 HA LYS 94 -4.972 5.513 -7.346 817 HB2 LYS 94 2HB LYS 94 -2.824 5.518 -8.331 818 HB3 LYS 94 3HB LYS 94 -3.659 4.179 -9.079 819 HG2 LYS 94 2HG LYS 94 -2.646 5.020 -10.939 820 HG3 LYS 94 3HG LYS 94 -4.104 6.007 -10.986 821 HD2 LYS 94 2HD LYS 94 -2.873 7.850 -9.833 822 HD3 LYS 94 3HD LYS 94 -1.414 6.855 -9.831 823 HE2 LYS 94 2HE LYS 94 -1.417 6.835 -12.284 824 HE3 LYS 94 3HE LYS 94 -2.891 7.809 -12.299 825 HZ1 LYS 94 3HZ LYS 94 -0.941 9.174 -12.649 826 HZ2 LYS 94 1HZ LYS 94 -0.264 8.643 -11.194 827 HZ3 LYS 94 2HZ LYS 94 -1.667 9.575 -11.176 828 H ARG 95 H ARG 95 -6.269 7.053 -10.196 829 HA ARG 95 HA ARG 95 -5.228 9.645 -9.995 830 HB2 ARG 95 2HB ARG 95 -7.948 8.679 -10.974 831 HB3 ARG 95 3HB ARG 95 -7.411 10.349 -11.146 832 HG2 ARG 95 2HG ARG 95 -5.600 9.697 -12.606 833 HG3 ARG 95 3HG ARG 95 -5.914 7.986 -12.318 834 HD2 ARG 95 2HD ARG 95 -8.169 8.279 -13.391 835 HD3 ARG 95 3HD ARG 95 -7.726 9.945 -13.777 836 HE ARG 95 HE ARG 95 -6.681 7.493 -14.994 837 HH11 ARG 95 1HH1 ARG 95 -6.510 11.010 -14.844 838 HH12 ARG 95 2HH1 ARG 95 -5.663 11.149 -16.349 839 HH21 ARG 95 1HH2 ARG 95 -5.605 7.704 -16.976 840 HH22 ARG 95 2HH2 ARG 95 -5.148 9.274 -17.561 841 H LYS 96 H LYS 96 -7.968 8.161 -8.301 842 HA LYS 96 HA LYS 96 -8.859 10.527 -6.946 843 HB2 LYS 96 2HB LYS 96 -9.437 7.578 -6.447 844 HB3 LYS 96 3HB LYS 96 -10.120 8.850 -5.446 845 HG2 LYS 96 2HG LYS 96 -11.802 8.219 -7.008 846 HG3 LYS 96 3HG LYS 96 -11.208 9.800 -7.518 847 HD2 LYS 96 2HD LYS 96 -9.840 8.726 -9.274 848 HD3 LYS 96 3HD LYS 96 -10.374 7.135 -8.729 849 HE2 LYS 96 2HE LYS 96 -12.181 9.287 -9.889 850 HE3 LYS 96 3HE LYS 96 -11.584 7.869 -10.754 851 HZ1 LYS 96 3HZ LYS 96 -13.363 7.845 -8.377 852 HZ2 LYS 96 1HZ LYS 96 -12.753 6.467 -9.141 853 HZ3 LYS 96 2HZ LYS 96 -13.814 7.492 -9.964 854 H ILE 97 H ILE 97 -6.707 7.849 -6.166 855 HA ILE 97 HA ILE 97 -6.436 8.362 -3.375 856 HB ILE 97 HB ILE 97 -4.535 6.786 -5.172 857 HG12 ILE 97 2HG1 ILE 97 -6.734 5.858 -5.566 858 HG13 ILE 97 3HG1 ILE 97 -5.878 4.738 -4.517 859 HG21 ILE 97 1HG2 ILE 97 -3.587 7.207 -2.960 860 HG22 ILE 97 2HG2 ILE 97 -3.984 5.496 -3.132 861 HG23 ILE 97 3HG2 ILE 97 -5.035 6.553 -2.189 862 HD11 ILE 97 3HD1 ILE 97 -7.145 5.688 -2.590 863 HD12 ILE 97 1HD1 ILE 97 -8.147 4.912 -3.813 864 HD13 ILE 97 2HD1 ILE 97 -8.059 6.669 -3.736 865 H GLU 98 H GLU 98 -4.664 9.281 -6.256 866 HA GLU 98 HA GLU 98 -2.293 10.308 -5.009 867 HB2 GLU 98 2HB GLU 98 -2.468 9.321 -7.336 868 HB3 GLU 98 3HB GLU 98 -3.326 10.769 -7.841 869 HG2 GLU 98 2HG GLU 98 -1.330 12.129 -7.337 870 HG3 GLU 98 3HG GLU 98 -0.477 10.683 -6.791 871 H SER 99 H SER 99 -5.349 11.620 -6.102 872 HA SER 99 HA SER 99 -4.676 14.381 -6.139 873 HB2 SER 99 2HB SER 99 -6.631 13.429 -7.340 874 HB3 SER 99 3HB SER 99 -7.413 13.076 -5.798 875 HG SER 99 HG SER 99 -6.687 15.644 -6.790 876 H GLN 100 H GLN 100 -5.493 12.164 -3.602 877 HA GLN 100 HA GLN 100 -6.195 14.173 -1.610 878 HB2 GLN 100 2HB GLN 100 -5.850 11.156 -1.359 879 HB3 GLN 100 3HB GLN 100 -6.532 12.213 -0.121 880 HG2 GLN 100 2HG GLN 100 -8.430 12.736 -1.574 881 HG3 GLN 100 3HG GLN 100 -7.727 11.784 -2.878 882 HE21 GLN 100 1HE2 GLN 100 -7.701 9.497 -2.677 883 HE22 GLN 100 2HE2 GLN 100 -8.766 8.678 -1.593 884 H GLY 101 H GLY 101 -3.301 13.027 -2.847 885 HA2 GLY 101 2HA GLY 101 -1.230 13.969 -2.162 886 HA3 GLY 101 3HA GLY 101 -1.786 14.006 -0.499 887 H TYR 102 H TYR 102 -2.745 11.061 -1.483 888 HA TYR 102 HA TYR 102 -0.583 9.661 -0.207 889 HB2 TYR 102 2HB TYR 102 -2.928 8.508 -1.778 890 HB3 TYR 102 3HB TYR 102 -1.871 7.611 -0.689 891 HD1 TYR 102 HD2 TYR 102 -1.727 8.802 1.785 892 HD2 TYR 102 HD1 TYR 102 -5.046 9.037 -0.905 893 HE1 TYR 102 HE2 TYR 102 -3.225 9.279 3.675 894 HE2 TYR 102 HE1 TYR 102 -6.543 9.519 0.984 895 HH TYR 102 HH TYR 102 -6.627 9.175 3.417 896 H GLU 103 H GLU 103 1.126 8.660 -1.146 897 HA GLU 103 HA GLU 103 1.761 9.256 -3.899 898 HB2 GLU 103 2HB GLU 103 3.384 9.271 -1.882 899 HB3 GLU 103 3HB GLU 103 3.396 7.520 -2.000 900 HG2 GLU 103 2HG GLU 103 5.338 8.360 -3.143 901 HG3 GLU 103 3HG GLU 103 4.217 7.753 -4.368 902 H VAL 104 H VAL 104 0.702 7.992 -5.386 903 HA VAL 104 HA VAL 104 0.748 5.054 -4.986 904 HB VAL 104 HB VAL 104 -1.498 5.729 -4.464 905 HG11 VAL 104 1HG1 VAL 104 -1.597 7.182 -7.124 906 HG12 VAL 104 2HG1 VAL 104 -1.588 7.921 -5.520 907 HG13 VAL 104 3HG1 VAL 104 -2.964 6.943 -6.031 908 HG21 VAL 104 3HG2 VAL 104 -2.781 4.413 -6.095 909 HG22 VAL 104 1HG2 VAL 104 -1.232 3.639 -5.760 910 HG23 VAL 104 2HG2 VAL 104 -1.463 4.533 -7.264 911 H ARG 105 H ARG 105 1.613 4.005 -6.570 912 HA ARG 105 HA ARG 105 1.695 5.098 -9.328 913 HB2 ARG 105 2HB ARG 105 3.641 3.173 -7.991 914 HB3 ARG 105 3HB ARG 105 3.728 3.699 -9.663 915 HG2 ARG 105 2HG ARG 105 4.079 5.509 -7.249 916 HG3 ARG 105 3HG ARG 105 5.394 4.791 -8.176 917 HD2 ARG 105 2HD ARG 105 5.298 6.925 -9.085 918 HD3 ARG 105 3HD ARG 105 4.278 6.037 -10.213 919 HE ARG 105 HE ARG 105 2.340 6.968 -9.092 920 HH11 ARG 105 1HH1 ARG 105 5.400 8.560 -8.372 921 HH12 ARG 105 2HH1 ARG 105 4.648 10.031 -7.856 922 HH21 ARG 105 1HH2 ARG 105 1.379 8.896 -8.351 923 HH22 ARG 105 2HH2 ARG 105 2.385 10.218 -7.848 924 H LYS 106 H LYS 106 1.501 3.513 -11.010 925 HA LYS 106 HA LYS 106 0.344 0.913 -10.285 926 HB2 LYS 106 2HB LYS 106 -1.712 1.477 -11.055 927 HB3 LYS 106 3HB LYS 106 -1.174 3.105 -11.393 928 HG2 LYS 106 2HG LYS 106 -0.832 0.872 -13.412 929 HG3 LYS 106 3HG LYS 106 -2.344 1.770 -13.271 930 HD2 LYS 106 2HD LYS 106 -1.182 3.869 -13.807 931 HD3 LYS 106 3HD LYS 106 0.372 3.035 -13.860 932 HE2 LYS 106 2HE LYS 106 -0.436 1.676 -15.754 933 HE3 LYS 106 3HE LYS 106 -1.983 2.522 -15.702 934 HZ1 LYS 106 3HZ LYS 106 0.641 3.785 -16.252 935 HZ2 LYS 106 1HZ LYS 106 -0.863 4.557 -16.271 936 HZ3 LYS 106 2HZ LYS 106 -0.509 3.367 -17.418 937 H VAL 107 H VAL 107 0.712 -0.747 -11.801 938 HA VAL 107 HA VAL 107 2.627 -0.325 -13.986 939 HB VAL 107 HB VAL 107 4.200 -2.088 -13.109 940 HG11 VAL 107 1HG1 VAL 107 5.402 -0.694 -11.485 941 HG12 VAL 107 2HG1 VAL 107 3.975 0.324 -11.278 942 HG13 VAL 107 3HG1 VAL 107 4.807 0.277 -12.835 943 HG21 VAL 107 3HG2 VAL 107 2.644 -1.808 -10.512 944 HG22 VAL 107 1HG2 VAL 107 4.140 -2.720 -10.724 945 HG23 VAL 107 2HG2 VAL 107 2.673 -3.230 -11.558 946 H THR 108 H THR 108 3.204 -2.539 -14.980 947 HA THR 108 HA THR 108 0.766 -4.220 -15.180 948 HB THR 108 HB THR 108 1.470 -4.584 -17.598 949 HG1 THR 108 HG1 THR 108 3.649 -3.261 -16.782 950 HG21 THR 108 3HG2 THR 108 0.633 -2.425 -18.438 951 HG22 THR 108 1HG2 THR 108 0.903 -1.676 -16.868 952 HG23 THR 108 2HG2 THR 108 -0.321 -2.939 -17.045 953 H ASP 109 H ASP 109 4.182 -4.246 -14.557 954 HA ASP 109 HA ASP 109 4.363 -7.166 -15.137 955 HB2 ASP 109 2HB ASP 109 5.630 -5.635 -16.750 956 HB3 ASP 109 3HB ASP 109 6.654 -5.160 -15.406 957 H ASP 110 H ASP 110 5.981 -8.333 -13.871 958 HA ASP 110 HA ASP 110 5.753 -7.943 -11.064 959 HB2 ASP 110 2HB ASP 110 5.868 -10.208 -11.825 960 HB3 ASP 110 3HB ASP 110 7.269 -9.898 -12.834 961 H GLU 111 H GLU 111 8.670 -7.909 -13.206 962 HA GLU 111 HA GLU 111 10.381 -7.094 -11.047 963 HB2 GLU 111 2HB GLU 111 12.199 -6.999 -12.779 964 HB3 GLU 111 3HB GLU 111 11.365 -8.536 -12.669 965 HG2 GLU 111 2HG GLU 111 11.703 -8.224 -14.962 966 HG3 GLU 111 3HG GLU 111 10.015 -7.804 -14.709 967 H GLU 112 H GLU 112 8.564 -5.428 -13.452 968 HA GLU 112 HA GLU 112 9.674 -2.827 -13.154 969 HB2 GLU 112 2HB GLU 112 8.226 -3.389 -15.038 970 HB3 GLU 112 3HB GLU 112 6.897 -3.782 -13.951 971 HG2 GLU 112 2HG GLU 112 6.725 -1.423 -13.275 972 HG3 GLU 112 3HG GLU 112 8.095 -1.014 -14.308 973 H ALA 113 H ALA 113 6.998 -4.570 -11.553 974 HA ALA 113 HA ALA 113 6.122 -2.562 -9.801 975 HB1 ALA 113 3HB ALA 113 6.054 -5.568 -9.358 976 HB2 ALA 113 1HB ALA 113 4.842 -4.625 -10.227 977 HB3 ALA 113 2HB ALA 113 5.083 -4.367 -8.498 978 H LEU 114 H LEU 114 8.662 -5.011 -9.460 979 HA LEU 114 HA LEU 114 9.343 -4.673 -6.756 980 HB2 LEU 114 2HB LEU 114 11.060 -5.533 -9.115 981 HB3 LEU 114 3HB LEU 114 11.577 -5.660 -7.440 982 HG LEU 114 HG LEU 114 9.202 -7.134 -8.653 983 HD11 LEU 114 1HD1 LEU 114 11.937 -8.190 -7.884 984 HD12 LEU 114 2HD1 LEU 114 11.326 -7.967 -9.525 985 HD13 LEU 114 3HD1 LEU 114 10.570 -9.149 -8.461 986 HD21 LEU 114 3HD2 LEU 114 9.137 -8.386 -6.530 987 HD22 LEU 114 1HD2 LEU 114 8.834 -6.668 -6.278 988 HD23 LEU 114 2HD2 LEU 114 10.410 -7.353 -5.871 989 H LYS 115 H LYS 115 10.480 -2.956 -9.652 990 HA LYS 115 HA LYS 115 12.486 -1.325 -8.524 991 HB2 LYS 115 2HB LYS 115 10.580 -0.680 -10.813 992 HB3 LYS 115 3HB LYS 115 12.044 0.226 -10.443 993 HG2 LYS 115 2HG LYS 115 13.418 -1.730 -10.994 994 HG3 LYS 115 3HG LYS 115 11.961 -2.684 -11.306 995 HD2 LYS 115 2HD LYS 115 11.349 -1.144 -13.153 996 HD3 LYS 115 3HD LYS 115 12.797 -0.183 -12.836 997 HE2 LYS 115 2HE LYS 115 13.144 -1.655 -14.757 998 HE3 LYS 115 3HE LYS 115 14.203 -2.133 -13.430 999 HZ1 LYS 115 3HZ LYS 115 11.642 -3.443 -14.179 1000 HZ2 LYS 115 1HZ LYS 115 12.625 -3.898 -12.881 1001 HZ3 LYS 115 2HZ LYS 115 13.192 -4.050 -14.466 1002 H ILE 116 H ILE 116 8.986 -0.966 -8.747 1003 HA ILE 116 HA ILE 116 8.925 1.749 -7.797 1004 HB ILE 116 HB ILE 116 6.580 -0.172 -8.113 1005 HG12 ILE 116 2HG1 ILE 116 7.800 -0.006 -10.257 1006 HG13 ILE 116 3HG1 ILE 116 6.257 0.822 -10.370 1007 HG21 ILE 116 1HG2 ILE 116 6.035 1.806 -6.776 1008 HG22 ILE 116 2HG2 ILE 116 5.233 1.897 -8.343 1009 HG23 ILE 116 3HG2 ILE 116 6.676 2.865 -8.032 1010 HD11 ILE 116 3HD1 ILE 116 7.400 2.977 -10.154 1011 HD12 ILE 116 1HD1 ILE 116 8.007 2.032 -11.512 1012 HD13 ILE 116 2HD1 ILE 116 8.951 2.139 -10.028 1013 H VAL 117 H VAL 117 8.498 -1.462 -6.355 1014 HA VAL 117 HA VAL 117 7.646 -0.745 -3.771 1015 HB VAL 117 HB VAL 117 9.600 -2.986 -4.507 1016 HG11 VAL 117 1HG1 VAL 117 8.903 -4.053 -2.375 1017 HG12 VAL 117 2HG1 VAL 117 7.924 -2.637 -1.987 1018 HG13 VAL 117 3HG1 VAL 117 9.679 -2.492 -2.094 1019 HG21 VAL 117 3HG2 VAL 117 6.581 -3.123 -4.170 1020 HG22 VAL 117 1HG2 VAL 117 7.651 -4.489 -4.508 1021 HG23 VAL 117 2HG2 VAL 117 7.450 -3.207 -5.702 1022 H ARG 118 H ARG 118 10.877 -0.929 -5.236 1023 HA ARG 118 HA ARG 118 12.466 -0.197 -3.038 1024 HB2 ARG 118 2HB ARG 118 12.949 0.277 -6.011 1025 HB3 ARG 118 3HB ARG 118 14.170 0.494 -4.758 1026 HG2 ARG 118 2HG ARG 118 14.056 -1.899 -4.205 1027 HG3 ARG 118 3HG ARG 118 12.803 -2.134 -5.427 1028 HD2 ARG 118 2HD ARG 118 14.972 -2.848 -6.294 1029 HD3 ARG 118 3HD ARG 118 14.401 -1.436 -7.185 1030 HE ARG 118 HE ARG 118 15.944 -0.273 -5.339 1031 HH11 ARG 118 1HH1 ARG 118 16.643 -3.052 -7.396 1032 HH12 ARG 118 2HH1 ARG 118 18.349 -2.745 -7.431 1033 HH21 ARG 118 1HH2 ARG 118 18.182 0.108 -5.389 1034 HH22 ARG 118 2HH2 ARG 118 19.223 -0.947 -6.291 1035 H GLU 119 H GLU 119 10.945 1.787 -5.600 1036 HA GLU 119 HA GLU 119 11.813 4.330 -4.886 1037 HB2 GLU 119 2HB GLU 119 9.117 3.500 -6.046 1038 HB3 GLU 119 3HB GLU 119 9.671 5.169 -5.956 1039 HG2 GLU 119 2HG GLU 119 10.978 2.945 -7.545 1040 HG3 GLU 119 3HG GLU 119 9.963 4.226 -8.205 1041 H PHE 120 H PHE 120 8.820 2.669 -3.844 1042 HA PHE 120 HA PHE 120 7.881 4.632 -2.080 1043 HB2 PHE 120 2HB PHE 120 7.375 1.632 -2.165 1044 HB3 PHE 120 3HB PHE 120 6.515 2.719 -1.074 1045 HD1 PHE 120 HD2 PHE 120 6.178 5.092 -2.980 1046 HD2 PHE 120 HD1 PHE 120 5.537 0.891 -3.528 1047 HE1 PHE 120 HE2 PHE 120 4.488 5.566 -4.695 1048 HE2 PHE 120 HE1 PHE 120 3.861 1.401 -5.240 1049 HZ PHE 120 HZ PHE 120 3.330 3.709 -5.819 1050 H MET 121 H MET 121 10.136 1.961 -1.525 1051 HA MET 121 HA MET 121 10.229 2.127 1.324 1052 HB2 MET 121 2HB MET 121 12.112 0.904 -0.733 1053 HB3 MET 121 3HB MET 121 12.404 0.788 0.997 1054 HG2 MET 121 2HG MET 121 10.448 -0.546 1.332 1055 HG3 MET 121 3HG MET 121 9.858 -0.213 -0.296 1056 HE1 MET 121 3HE MET 121 13.646 -1.052 0.565 1057 HE2 MET 121 1HE MET 121 13.615 -2.812 0.466 1058 HE3 MET 121 2HE MET 121 12.748 -1.990 1.763 1059 H GLN 122 H GLN 122 12.041 3.755 -1.261 1060 HA GLN 122 HA GLN 122 14.066 4.883 0.460 1061 HB2 GLN 122 2HB GLN 122 13.267 5.729 -2.362 1062 HB3 GLN 122 3HB GLN 122 14.733 6.214 -1.519 1063 HG2 GLN 122 2HG GLN 122 14.027 3.441 -2.500 1064 HG3 GLN 122 3HG GLN 122 15.271 4.500 -3.143 1065 HE21 GLN 122 1HE2 GLN 122 17.212 4.740 -1.981 1066 HE22 GLN 122 2HE2 GLN 122 17.683 3.633 -0.744 1067 H LYS 123 H LYS 123 11.127 6.108 -1.122 1068 HA LYS 123 HA LYS 123 11.267 8.766 -0.114 1069 HB2 LYS 123 2HB LYS 123 9.070 7.147 -1.439 1070 HB3 LYS 123 3HB LYS 123 8.694 8.713 -0.737 1071 HG2 LYS 123 2HG LYS 123 9.049 8.975 -3.111 1072 HG3 LYS 123 3HG LYS 123 10.353 9.782 -2.240 1073 HD2 LYS 123 2HD LYS 123 11.881 7.922 -2.749 1074 HD3 LYS 123 3HD LYS 123 10.570 7.029 -3.520 1075 HE2 LYS 123 2HE LYS 123 10.404 8.766 -5.260 1076 HE3 LYS 123 3HE LYS 123 11.697 9.675 -4.477 1077 HZ1 LYS 123 3HZ LYS 123 12.588 8.438 -6.294 1078 HZ2 LYS 123 1HZ LYS 123 11.923 6.990 -5.729 1079 HZ3 LYS 123 2HZ LYS 123 13.165 7.746 -4.863 1080 H ALA 124 H ALA 124 9.882 5.782 1.131 1081 HA ALA 124 HA ALA 124 8.453 6.940 3.342 1082 HB1 ALA 124 3HB ALA 124 9.341 4.082 2.849 1083 HB2 ALA 124 1HB ALA 124 7.773 4.779 2.444 1084 HB3 ALA 124 2HB ALA 124 8.246 4.602 4.133 1085 H GLY 125 H GLY 125 11.646 5.402 2.922 1086 HA2 GLY 125 2HA GLY 125 12.529 5.406 5.583 1087 HA3 GLY 125 3HA GLY 125 13.571 5.484 4.173 1088 H SER 126 H SER 126 12.553 7.942 3.143 1089 HA SER 126 HA SER 126 14.094 9.888 4.473 1090 HB2 SER 126 2HB SER 126 11.936 10.145 2.344 1091 HB3 SER 126 3HB SER 126 12.967 11.482 2.869 1092 HG SER 126 HG SER 126 13.497 9.668 1.047 1093 H LEU 127 H LEU 127 10.778 8.899 4.979 1094 HA LEU 127 HA LEU 127 9.720 11.335 6.007 1095 HB2 LEU 127 2HB LEU 127 8.807 8.475 6.485 1096 HB3 LEU 127 3HB LEU 127 7.891 9.904 6.947 1097 HG LEU 127 HG LEU 127 8.552 9.028 4.104 1098 HD11 LEU 127 1HD1 LEU 127 6.129 8.725 3.856 1099 HD12 LEU 127 2HD1 LEU 127 5.899 9.121 5.559 1100 HD13 LEU 127 3HD1 LEU 127 6.801 7.675 5.102 1101 HD21 LEU 127 3HD2 LEU 127 7.013 11.489 5.003 1102 HD22 LEU 127 1HD2 LEU 127 7.173 10.920 3.337 1103 HD23 LEU 127 2HD2 LEU 127 8.595 11.470 4.217 1104 H GLU 128 H GLU 128 11.661 8.795 7.449 1105 HA GLU 128 HA GLU 128 11.352 9.790 10.167 1106 HB2 GLU 128 2HB GLU 128 11.822 7.394 9.840 1107 HB3 GLU 128 3HB GLU 128 13.303 7.775 8.966 1108 HG2 GLU 128 2HG GLU 128 13.806 7.036 11.252 1109 HG3 GLU 128 3HG GLU 128 14.306 8.707 11.008 1110 H HIS 129 H HIS 129 14.316 9.381 8.190 1111 HA HIS 129 HA HIS 129 15.300 12.016 9.121 1112 HB2 HIS 129 2HB HIS 129 16.399 10.022 10.284 1113 HB3 HIS 129 3HB HIS 129 17.032 9.525 8.717 1114 HD1 HIS 129 HD1 HIS 129 17.534 11.970 11.465 1115 HD2 HIS 129 HD2 HIS 129 19.111 11.238 7.698 1116 HE1 HIS 129 HE1 HIS 129 19.617 13.345 11.328 1117 HE2 HIS 129 HE2 HIS 129 20.635 12.761 9.103 1118 H HIS 130 H HIS 130 16.814 13.024 7.616 1119 HA HIS 130 HA HIS 130 16.897 14.151 5.679 1120 HB2 HIS 130 2HB HIS 130 16.632 11.388 4.392 1121 HB3 HIS 130 3HB HIS 130 16.986 12.864 3.495 1122 HD1 HIS 130 HD1 HIS 130 18.711 10.080 4.760 1123 HD2 HIS 130 HD2 HIS 130 19.434 14.164 4.847 1124 HE1 HIS 130 HE1 HIS 130 21.158 10.319 5.230 1125 HE2 HIS 130 HE2 HIS 130 21.525 12.796 5.459 1126 H HIS 131 H HIS 131 14.802 14.509 6.953 1127 HA HIS 131 HA HIS 131 12.301 13.669 5.826 1128 HB2 HIS 131 2HB HIS 131 12.700 14.060 8.276 1129 HB3 HIS 131 3HB HIS 131 12.944 15.770 7.950 1130 HD1 HIS 131 HD1 HIS 131 10.317 13.217 8.518 1131 HD2 HIS 131 HD2 HIS 131 10.539 17.198 7.365 1132 HE1 HIS 131 HE1 HIS 131 7.996 14.133 8.775 1133 HE2 HIS 131 HE2 HIS 131 8.136 16.499 7.950 1134 H HIS 132 H HIS 132 12.561 14.372 3.658 1135 HA HIS 132 HA HIS 132 13.301 16.845 2.668 1136 HB2 HIS 132 2HB HIS 132 11.292 14.887 1.486 1137 HB3 HIS 132 3HB HIS 132 11.922 16.273 0.612 1138 HD1 HIS 132 HD1 HIS 132 13.999 15.879 -0.717 1139 HD2 HIS 132 HD2 HIS 132 13.381 12.912 2.105 1140 HE1 HIS 132 HE1 HIS 132 15.688 14.093 -1.234 1141 HE2 HIS 132 HE2 HIS 132 15.114 12.221 0.342 1142 H HIS 133 H HIS 133 10.077 15.807 3.698 1143 HA HIS 133 HA HIS 133 8.670 18.160 2.864 1144 HB2 HIS 133 2HB HIS 133 7.932 15.774 4.600 1145 HB3 HIS 133 3HB HIS 133 6.836 17.140 4.435 1146 HD1 HIS 133 HD1 HIS 133 5.310 17.112 2.487 1147 HD2 HIS 133 HD2 HIS 133 8.463 14.441 2.020 1148 HE1 HIS 133 HE1 HIS 133 4.807 15.834 0.389 1149 HE2 HIS 133 HE2 HIS 133 6.820 14.376 0.026 1150 H HIS 134 H HIS 134 10.044 19.796 3.823 1151 HA HIS 134 HA HIS 134 9.151 20.621 6.461 1152 HB2 HIS 134 2HB HIS 134 11.325 20.880 7.493 1153 HB3 HIS 134 3HB HIS 134 11.242 19.225 6.904 1154 HD1 HIS 134 HD1 HIS 134 12.665 18.750 4.646 1155 HD2 HIS 134 HD2 HIS 134 13.495 22.322 6.584 1156 HE1 HIS 134 HE1 HIS 134 14.845 19.545 3.695 1157 HE2 HIS 134 HE2 HIS 134 15.283 21.742 4.832 Start of MODEL 13 1 H1 MET 1 1H MET 1 3.738 9.470 14.606 2 H2 MET 1 2H MET 1 2.117 9.681 14.183 3 H3 MET 1 3H MET 1 3.164 11.007 14.203 4 HA MET 1 HA MET 1 2.667 10.234 11.965 5 HB2 MET 1 2HB MET 1 4.792 11.406 12.374 6 HB3 MET 1 3HB MET 1 5.559 9.909 12.889 7 HG2 MET 1 2HG MET 1 6.257 10.532 10.621 8 HG3 MET 1 3HG MET 1 5.368 9.010 10.610 9 HE1 MET 1 3HE MET 1 4.348 10.566 7.159 10 HE2 MET 1 1HE MET 1 5.005 9.152 7.984 11 HE3 MET 1 2HE MET 1 5.927 10.657 7.940 12 H LYS 2 H LYS 2 2.674 8.580 10.447 13 HA LYS 2 HA LYS 2 3.740 5.939 11.116 14 HB2 LYS 2 2HB LYS 2 1.268 6.090 11.848 15 HB3 LYS 2 3HB LYS 2 0.864 6.307 10.151 16 HG2 LYS 2 2HG LYS 2 0.495 4.017 10.564 17 HG3 LYS 2 3HG LYS 2 2.046 4.071 9.726 18 HD2 LYS 2 2HD LYS 2 2.214 2.490 11.545 19 HD3 LYS 2 3HD LYS 2 3.190 3.899 11.964 20 HE2 LYS 2 2HE LYS 2 1.405 4.727 13.426 21 HE3 LYS 2 3HE LYS 2 0.363 3.382 12.955 22 HZ1 LYS 2 3HZ LYS 2 2.947 3.132 14.392 23 HZ2 LYS 2 1HZ LYS 2 1.920 1.861 13.964 24 HZ3 LYS 2 2HZ LYS 2 1.415 3.011 15.091 25 H ILE 3 H ILE 3 4.323 4.801 9.221 26 HA ILE 3 HA ILE 3 3.947 6.197 6.625 27 HB ILE 3 HB ILE 3 6.342 4.482 7.461 28 HG12 ILE 3 2HG1 ILE 3 6.223 7.506 7.011 29 HG13 ILE 3 3HG1 ILE 3 6.341 6.720 8.579 30 HG21 ILE 3 1HG2 ILE 3 5.827 4.268 5.059 31 HG22 ILE 3 2HG2 ILE 3 7.331 5.150 5.296 32 HG23 ILE 3 3HG2 ILE 3 5.860 6.026 4.879 33 HD11 ILE 3 3HD1 ILE 3 8.417 6.623 6.397 34 HD12 ILE 3 1HD1 ILE 3 8.527 5.821 7.967 35 HD13 ILE 3 2HD1 ILE 3 8.480 7.580 7.876 36 H LEU 4 H LEU 4 2.364 5.057 5.643 37 HA LEU 4 HA LEU 4 2.423 2.102 5.652 38 HB2 LEU 4 2HB LEU 4 0.290 4.152 5.035 39 HB3 LEU 4 3HB LEU 4 0.188 2.587 4.248 40 HG LEU 4 HG LEU 4 0.067 1.455 6.436 41 HD11 LEU 4 1HD1 LEU 4 0.171 4.220 7.654 42 HD12 LEU 4 2HD1 LEU 4 1.378 2.941 7.809 43 HD13 LEU 4 3HD1 LEU 4 -0.221 2.729 8.515 44 HD21 LEU 4 3HD2 LEU 4 -1.978 3.679 6.149 45 HD22 LEU 4 1HD2 LEU 4 -2.181 2.191 7.078 46 HD23 LEU 4 2HD2 LEU 4 -2.015 2.116 5.327 47 H ILE 5 H ILE 5 2.982 0.974 3.879 48 HA ILE 5 HA ILE 5 2.821 2.292 1.227 49 HB ILE 5 HB ILE 5 4.630 -0.074 1.970 50 HG12 ILE 5 2HG1 ILE 5 5.387 2.822 1.333 51 HG13 ILE 5 3HG1 ILE 5 5.512 2.050 2.908 52 HG21 ILE 5 1HG2 ILE 5 4.363 1.433 -0.668 53 HG22 ILE 5 2HG2 ILE 5 3.787 -0.206 -0.352 54 HG23 ILE 5 3HG2 ILE 5 5.516 0.139 -0.338 55 HD11 ILE 5 3HD1 ILE 5 7.674 2.222 1.869 56 HD12 ILE 5 1HD1 ILE 5 7.108 1.342 0.449 57 HD13 ILE 5 2HD1 ILE 5 7.215 0.527 2.012 58 H LEU 6 H LEU 6 0.978 1.636 0.353 59 HA LEU 6 HA LEU 6 -0.374 -0.806 1.196 60 HB2 LEU 6 2HB LEU 6 -1.275 1.342 -0.774 61 HB3 LEU 6 3HB LEU 6 -2.268 0.037 -0.147 62 HG LEU 6 HG LEU 6 -1.174 2.368 1.454 63 HD11 LEU 6 1HD1 LEU 6 -2.982 3.033 -0.065 64 HD12 LEU 6 2HD1 LEU 6 -3.517 3.098 1.611 65 HD13 LEU 6 3HD1 LEU 6 -4.020 1.755 0.579 66 HD21 LEU 6 3HD2 LEU 6 -2.520 1.536 3.315 67 HD22 LEU 6 1HD2 LEU 6 -1.297 0.360 2.835 68 HD23 LEU 6 2HD2 LEU 6 -2.984 0.120 2.364 69 H ILE 7 H ILE 7 -0.359 -2.591 0.016 70 HA ILE 7 HA ILE 7 0.505 -2.541 -2.822 71 HB ILE 7 HB ILE 7 0.893 -4.799 -0.786 72 HG12 ILE 7 2HG1 ILE 7 2.481 -2.938 -0.396 73 HG13 ILE 7 3HG1 ILE 7 3.321 -4.358 -1.001 74 HG21 ILE 7 1HG2 ILE 7 1.732 -4.655 -3.710 75 HG22 ILE 7 2HG2 ILE 7 0.483 -5.703 -3.030 76 HG23 ILE 7 3HG2 ILE 7 2.172 -5.941 -2.583 77 HD11 ILE 7 3HD1 ILE 7 3.460 -3.327 -3.225 78 HD12 ILE 7 1HD1 ILE 7 4.197 -2.316 -1.982 79 HD13 ILE 7 2HD1 ILE 7 2.604 -1.907 -2.616 80 H ASN 8 H ASN 8 -1.246 -2.791 -4.030 81 HA ASN 8 HA ASN 8 -3.164 -4.957 -3.392 82 HB2 ASN 8 2HB ASN 8 -4.281 -2.760 -3.169 83 HB3 ASN 8 3HB ASN 8 -3.750 -2.303 -4.782 84 HD21 ASN 8 1HD2 ASN 8 -5.877 -4.453 -2.973 85 HD22 ASN 8 2HD2 ASN 8 -6.961 -4.782 -4.276 86 H THR 9 H THR 9 -2.327 -6.520 -4.617 87 HA THR 9 HA THR 9 -2.182 -6.055 -7.518 88 HB THR 9 HB THR 9 0.136 -6.196 -6.790 89 HG1 THR 9 HG1 THR 9 0.368 -8.552 -7.893 90 HG21 THR 9 3HG2 THR 9 -0.534 -8.912 -5.628 91 HG22 THR 9 1HG2 THR 9 -0.111 -7.466 -4.703 92 HG23 THR 9 2HG2 THR 9 1.080 -8.215 -5.769 93 H ASN 10 H ASN 10 -2.918 -7.677 -8.802 94 HA ASN 10 HA ASN 10 -5.010 -9.311 -7.787 95 HB2 ASN 10 2HB ASN 10 -5.060 -8.416 -10.057 96 HB3 ASN 10 3HB ASN 10 -3.597 -9.290 -10.482 97 HD21 ASN 10 1HD2 ASN 10 -4.700 -10.212 -12.245 98 HD22 ASN 10 2HD2 ASN 10 -5.827 -11.510 -12.044 99 H ASN 11 H ASN 11 -1.767 -10.123 -9.054 100 HA ASN 11 HA ASN 11 -1.987 -12.881 -8.190 101 HB2 ASN 11 2HB ASN 11 0.363 -13.148 -9.014 102 HB3 ASN 11 3HB ASN 11 -0.750 -12.566 -10.239 103 HD21 ASN 11 1HD2 ASN 11 2.193 -12.382 -10.048 104 HD22 ASN 11 2HD2 ASN 11 2.551 -10.702 -10.220 105 H ASP 12 H ASP 12 -2.109 -13.079 -6.070 106 HA ASP 12 HA ASP 12 -0.875 -11.554 -4.048 107 HB2 ASP 12 2HB ASP 12 -2.893 -12.899 -3.701 108 HB3 ASP 12 3HB ASP 12 -2.013 -14.386 -4.006 109 H GLU 13 H GLU 13 0.370 -14.051 -6.014 110 HA GLU 13 HA GLU 13 2.542 -15.100 -4.598 111 HB2 GLU 13 2HB GLU 13 2.371 -14.459 -7.571 112 HB3 GLU 13 3HB GLU 13 3.461 -15.625 -6.826 113 HG2 GLU 13 2HG GLU 13 1.651 -17.108 -6.282 114 HG3 GLU 13 3HG GLU 13 0.446 -15.888 -6.690 115 H LEU 14 H LEU 14 2.249 -12.152 -6.564 116 HA LEU 14 HA LEU 14 4.913 -11.275 -6.551 117 HB2 LEU 14 2HB LEU 14 3.277 -10.383 -8.100 118 HB3 LEU 14 3HB LEU 14 2.291 -9.757 -6.792 119 HG LEU 14 HG LEU 14 4.002 -8.046 -6.290 120 HD11 LEU 14 1HD1 LEU 14 6.040 -9.226 -6.942 121 HD12 LEU 14 2HD1 LEU 14 5.935 -7.659 -7.737 122 HD13 LEU 14 3HD1 LEU 14 5.575 -9.131 -8.644 123 HD21 LEU 14 3HD2 LEU 14 2.202 -7.536 -7.883 124 HD22 LEU 14 1HD2 LEU 14 3.226 -8.061 -9.222 125 HD23 LEU 14 2HD2 LEU 14 3.672 -6.647 -8.262 126 H ILE 15 H ILE 15 2.338 -10.867 -4.178 127 HA ILE 15 HA ILE 15 3.430 -8.841 -2.567 128 HB ILE 15 HB ILE 15 1.600 -11.138 -1.727 129 HG12 ILE 15 2HG1 ILE 15 0.894 -8.295 -2.590 130 HG13 ILE 15 3HG1 ILE 15 0.770 -9.708 -3.627 131 HG21 ILE 15 1HG2 ILE 15 2.094 -8.479 -0.326 132 HG22 ILE 15 2HG2 ILE 15 2.655 -10.056 0.235 133 HG23 ILE 15 3HG2 ILE 15 0.929 -9.710 0.164 134 HD11 ILE 15 3HD1 ILE 15 -0.927 -10.635 -2.104 135 HD12 ILE 15 1HD1 ILE 15 -1.387 -9.091 -2.818 136 HD13 ILE 15 2HD1 ILE 15 -0.832 -9.158 -1.152 137 H LYS 16 H LYS 16 3.900 -12.376 -2.513 138 HA LYS 16 HA LYS 16 5.185 -12.702 -0.055 139 HB2 LYS 16 2HB LYS 16 5.929 -14.246 -2.571 140 HB3 LYS 16 3HB LYS 16 6.080 -14.795 -0.910 141 HG2 LYS 16 2HG LYS 16 3.528 -14.382 -2.474 142 HG3 LYS 16 3HG LYS 16 4.229 -15.921 -1.969 143 HD2 LYS 16 2HD LYS 16 3.854 -15.252 0.420 144 HD3 LYS 16 3HD LYS 16 3.063 -13.778 -0.150 145 HE2 LYS 16 2HE LYS 16 1.410 -15.222 -1.378 146 HE3 LYS 16 3HE LYS 16 2.150 -16.632 -0.611 147 HZ1 LYS 16 3HZ LYS 16 0.268 -16.000 0.655 148 HZ2 LYS 16 1HZ LYS 16 0.757 -14.384 0.727 149 HZ3 LYS 16 2HZ LYS 16 1.626 -15.572 1.558 150 H LYS 17 H LYS 17 6.487 -11.768 -3.184 151 HA LYS 17 HA LYS 17 9.260 -11.765 -2.454 152 HB2 LYS 17 2HB LYS 17 7.864 -10.440 -4.820 153 HB3 LYS 17 3HB LYS 17 9.594 -10.746 -4.677 154 HG2 LYS 17 2HG LYS 17 9.188 -13.178 -4.689 155 HG3 LYS 17 3HG LYS 17 7.447 -12.896 -4.774 156 HD2 LYS 17 2HD LYS 17 8.265 -13.453 -6.995 157 HD3 LYS 17 3HD LYS 17 7.768 -11.762 -6.977 158 HE2 LYS 17 2HE LYS 17 10.159 -11.099 -6.719 159 HE3 LYS 17 3HE LYS 17 10.615 -12.802 -6.822 160 HZ1 LYS 17 3HZ LYS 17 9.214 -11.261 -8.954 161 HZ2 LYS 17 1HZ LYS 17 9.667 -12.889 -9.034 162 HZ3 LYS 17 2HZ LYS 17 10.852 -11.696 -8.950 163 H ILE 18 H ILE 18 6.757 -9.271 -2.896 164 HA ILE 18 HA ILE 18 8.253 -6.947 -2.419 165 HB ILE 18 HB ILE 18 5.294 -7.555 -1.971 166 HG12 ILE 18 2HG1 ILE 18 6.738 -6.107 -4.242 167 HG13 ILE 18 3HG1 ILE 18 6.053 -7.724 -4.322 168 HG21 ILE 18 1HG2 ILE 18 4.865 -5.128 -1.895 169 HG22 ILE 18 2HG2 ILE 18 6.597 -4.813 -1.932 170 HG23 ILE 18 3HG2 ILE 18 5.883 -5.639 -0.547 171 HD11 ILE 18 3HD1 ILE 18 4.626 -6.169 -5.454 172 HD12 ILE 18 1HD1 ILE 18 4.529 -5.140 -4.023 173 HD13 ILE 18 2HD1 ILE 18 3.808 -6.752 -4.005 174 H LYS 19 H LYS 19 6.673 -9.189 -0.194 175 HA LYS 19 HA LYS 19 6.917 -7.771 2.219 176 HB2 LYS 19 2HB LYS 19 6.930 -10.789 1.741 177 HB3 LYS 19 3HB LYS 19 6.800 -10.033 3.327 178 HG2 LYS 19 2HG LYS 19 4.676 -8.949 2.612 179 HG3 LYS 19 3HG LYS 19 4.799 -9.788 1.067 180 HD2 LYS 19 2HD LYS 19 3.265 -11.007 2.521 181 HD3 LYS 19 3HD LYS 19 4.718 -11.976 2.271 182 HE2 LYS 19 2HE LYS 19 5.566 -11.327 4.470 183 HE3 LYS 19 3HE LYS 19 4.195 -10.247 4.713 184 HZ1 LYS 19 3HZ LYS 19 4.163 -13.204 4.594 185 HZ2 LYS 19 1HZ LYS 19 2.759 -12.259 4.525 186 HZ3 LYS 19 2HZ LYS 19 3.747 -12.201 5.892 187 H LYS 20 H LYS 20 9.000 -10.272 0.768 188 HA LYS 20 HA LYS 20 10.963 -10.146 2.815 189 HB2 LYS 20 2HB LYS 20 10.890 -11.490 0.088 190 HB3 LYS 20 3HB LYS 20 12.296 -11.594 1.144 191 HG2 LYS 20 2HG LYS 20 9.493 -12.519 1.875 192 HG3 LYS 20 3HG LYS 20 10.824 -13.567 1.377 193 HD2 LYS 20 2HD LYS 20 12.109 -12.992 3.356 194 HD3 LYS 20 3HD LYS 20 10.934 -11.761 3.825 195 HE2 LYS 20 2HE LYS 20 10.400 -14.752 3.722 196 HE3 LYS 20 3HE LYS 20 10.724 -13.810 5.178 197 HZ1 LYS 20 3HZ LYS 20 8.369 -14.157 4.900 198 HZ2 LYS 20 1HZ LYS 20 8.405 -13.454 3.364 199 HZ3 LYS 20 2HZ LYS 20 8.725 -12.516 4.727 200 H GLU 21 H GLU 21 10.569 -8.304 -0.145 201 HA GLU 21 HA GLU 21 13.117 -7.069 -0.221 202 HB2 GLU 21 2HB GLU 21 10.405 -5.878 -0.967 203 HB3 GLU 21 3HB GLU 21 11.959 -5.179 -1.406 204 HG2 GLU 21 2HG GLU 21 10.907 -7.864 -2.323 205 HG3 GLU 21 3HG GLU 21 10.916 -6.387 -3.277 206 H VAL 22 H VAL 22 10.076 -6.079 1.419 207 HA VAL 22 HA VAL 22 11.267 -3.674 2.473 208 HB VAL 22 HB VAL 22 9.109 -3.201 3.503 209 HG11 VAL 22 1HG1 VAL 22 8.784 -4.240 0.669 210 HG12 VAL 22 2HG1 VAL 22 9.397 -2.654 1.136 211 HG13 VAL 22 3HG1 VAL 22 7.722 -3.080 1.477 212 HG21 VAL 22 3HG2 VAL 22 8.230 -5.969 2.600 213 HG22 VAL 22 1HG2 VAL 22 7.185 -4.734 3.308 214 HG23 VAL 22 2HG2 VAL 22 8.479 -5.448 4.268 215 H GLU 23 H GLU 23 10.732 -6.886 3.762 216 HA GLU 23 HA GLU 23 10.683 -6.257 6.527 217 HB2 GLU 23 2HB GLU 23 11.244 -8.847 5.043 218 HB3 GLU 23 3HB GLU 23 11.234 -8.755 6.804 219 HG2 GLU 23 2HG GLU 23 8.880 -8.005 6.774 220 HG3 GLU 23 3HG GLU 23 8.884 -8.044 5.012 221 H ASN 24 H ASN 24 13.350 -6.609 4.317 222 HA ASN 24 HA ASN 24 15.482 -6.963 6.121 223 HB2 ASN 24 2HB ASN 24 15.416 -5.405 3.501 224 HB3 ASN 24 3HB ASN 24 16.894 -5.773 4.379 225 HD21 ASN 24 1HD2 ASN 24 14.567 -6.922 2.198 226 HD22 ASN 24 2HD2 ASN 24 15.200 -8.512 1.983 227 H GLN 25 H GLN 25 13.665 -4.079 5.262 228 HA GLN 25 HA GLN 25 15.403 -2.333 6.885 229 HB2 GLN 25 2HB GLN 25 13.225 -1.696 4.858 230 HB3 GLN 25 3HB GLN 25 14.146 -0.487 5.744 231 HG2 GLN 25 2HG GLN 25 15.310 -2.500 3.794 232 HG3 GLN 25 3HG GLN 25 15.009 -0.799 3.453 233 HE21 GLN 25 1HE2 GLN 25 17.068 -3.062 5.144 234 HE22 GLN 25 2HE2 GLN 25 18.317 -1.934 5.533 235 H GLY 26 H GLY 26 13.182 -4.303 7.784 236 HA2 GLY 26 2HA GLY 26 12.062 -4.448 9.776 237 HA3 GLY 26 3HA GLY 26 12.573 -2.809 10.135 238 H TYR 27 H TYR 27 10.652 -3.783 7.321 239 HA TYR 27 HA TYR 27 8.364 -2.217 8.251 240 HB2 TYR 27 2HB TYR 27 8.856 -3.767 5.680 241 HB3 TYR 27 3HB TYR 27 7.322 -2.988 6.050 242 HD1 TYR 27 HD1 TYR 27 10.987 -2.167 5.786 243 HD2 TYR 27 HD2 TYR 27 6.977 -0.792 5.256 244 HE1 TYR 27 HE1 TYR 27 11.830 -0.107 4.770 245 HE2 TYR 27 HE2 TYR 27 7.833 1.279 4.244 246 HH TYR 27 HH TYR 27 9.954 2.613 4.344 247 H GLN 28 H GLN 28 6.836 -3.093 9.474 248 HA GLN 28 HA GLN 28 6.396 -5.953 9.718 249 HB2 GLN 28 2HB GLN 28 4.959 -3.512 10.837 250 HB3 GLN 28 3HB GLN 28 4.418 -5.162 11.150 251 HG2 GLN 28 2HG GLN 28 6.422 -5.700 12.327 252 HG3 GLN 28 3HG GLN 28 7.211 -4.227 11.785 253 HE21 GLN 28 1HE2 GLN 28 7.695 -3.679 13.939 254 HE22 GLN 28 2HE2 GLN 28 6.497 -3.056 15.014 255 H VAL 29 H VAL 29 5.315 -7.038 8.207 256 HA VAL 29 HA VAL 29 3.548 -5.642 6.330 257 HB VAL 29 HB VAL 29 4.233 -8.620 6.291 258 HG11 VAL 29 1HG1 VAL 29 2.204 -8.007 5.022 259 HG12 VAL 29 2HG1 VAL 29 3.501 -8.482 3.929 260 HG13 VAL 29 3HG1 VAL 29 3.110 -6.774 4.137 261 HG21 VAL 29 3HG2 VAL 29 5.935 -8.075 4.579 262 HG22 VAL 29 1HG2 VAL 29 6.318 -7.312 6.125 263 HG23 VAL 29 2HG2 VAL 29 5.632 -6.351 4.813 264 H ARG 30 H ARG 30 1.416 -5.663 6.444 265 HA ARG 30 HA ARG 30 0.025 -7.329 8.451 266 HB2 ARG 30 2HB ARG 30 0.123 -4.478 8.090 267 HB3 ARG 30 3HB ARG 30 -1.482 -4.962 7.567 268 HG2 ARG 30 2HG ARG 30 -1.529 -4.339 9.893 269 HG3 ARG 30 3HG ARG 30 -1.838 -6.069 9.749 270 HD2 ARG 30 2HD ARG 30 0.624 -6.440 10.292 271 HD3 ARG 30 3HD ARG 30 0.720 -4.713 10.676 272 HE ARG 30 HE ARG 30 -1.428 -5.928 12.062 273 HH11 ARG 30 1HH1 ARG 30 2.076 -5.712 12.182 274 HH12 ARG 30 2HH1 ARG 30 2.159 -6.021 13.885 275 HH21 ARG 30 1HH2 ARG 30 -1.307 -6.388 14.280 276 HH22 ARG 30 2HH2 ARG 30 0.239 -6.406 15.074 277 H ASP 31 H ASP 31 -0.961 -8.982 7.407 278 HA ASP 31 HA ASP 31 -1.749 -8.800 4.613 279 HB2 ASP 31 2HB ASP 31 -0.687 -10.858 5.714 280 HB3 ASP 31 3HB ASP 31 -2.203 -11.117 6.563 281 H VAL 32 H VAL 32 -3.595 -7.709 4.219 282 HA VAL 32 HA VAL 32 -5.981 -8.104 5.934 283 HB VAL 32 HB VAL 32 -5.392 -5.852 3.944 284 HG11 VAL 32 1HG1 VAL 32 -7.410 -4.757 4.836 285 HG12 VAL 32 2HG1 VAL 32 -7.743 -6.166 5.845 286 HG13 VAL 32 3HG1 VAL 32 -7.795 -6.306 4.087 287 HG21 VAL 32 3HG2 VAL 32 -5.365 -5.787 6.987 288 HG22 VAL 32 1HG2 VAL 32 -5.188 -4.380 5.932 289 HG23 VAL 32 2HG2 VAL 32 -3.962 -5.649 5.924 290 H ASN 33 H ASN 33 -7.524 -9.338 5.111 291 HA ASN 33 HA ASN 33 -7.514 -10.073 2.243 292 HB2 ASN 33 2HB ASN 33 -8.728 -11.596 4.590 293 HB3 ASN 33 3HB ASN 33 -8.612 -12.164 2.927 294 HD21 ASN 33 1HD2 ASN 33 -6.918 -11.701 5.925 295 HD22 ASN 33 2HD2 ASN 33 -5.457 -12.505 5.465 296 H ASP 34 H ASP 34 -9.521 -8.974 4.893 297 HA ASP 34 HA ASP 34 -11.882 -8.635 3.160 298 HB2 ASP 34 2HB ASP 34 -11.981 -10.830 4.425 299 HB3 ASP 34 3HB ASP 34 -11.917 -9.928 5.932 300 H SER 35 H SER 35 -13.591 -7.270 4.401 301 HA SER 35 HA SER 35 -12.427 -4.855 5.345 302 HB2 SER 35 2HB SER 35 -14.594 -5.047 4.074 303 HB3 SER 35 3HB SER 35 -15.354 -5.685 5.532 304 HG SER 35 HG SER 35 -14.370 -3.089 4.990 305 H ASP 36 H ASP 36 -13.575 -7.730 6.956 306 HA ASP 36 HA ASP 36 -13.677 -6.786 9.638 307 HB2 ASP 36 2HB ASP 36 -14.651 -8.959 9.023 308 HB3 ASP 36 3HB ASP 36 -13.081 -9.566 8.516 309 H GLU 37 H GLU 37 -11.152 -8.451 7.752 310 HA GLU 37 HA GLU 37 -9.000 -8.301 9.519 311 HB2 GLU 37 2HB GLU 37 -8.934 -8.115 6.476 312 HB3 GLU 37 3HB GLU 37 -7.566 -8.536 7.495 313 HG2 GLU 37 2HG GLU 37 -10.107 -10.175 7.304 314 HG3 GLU 37 3HG GLU 37 -8.665 -10.469 6.336 315 H LEU 38 H LEU 38 -10.319 -5.926 7.291 316 HA LEU 38 HA LEU 38 -8.213 -4.067 7.269 317 HB2 LEU 38 2HB LEU 38 -10.021 -4.110 5.590 318 HB3 LEU 38 3HB LEU 38 -11.182 -3.637 6.823 319 HG LEU 38 HG LEU 38 -9.882 -1.472 7.111 320 HD11 LEU 38 1HD1 LEU 38 -8.420 -2.367 4.616 321 HD12 LEU 38 2HD1 LEU 38 -7.728 -2.159 6.229 322 HD13 LEU 38 3HD1 LEU 38 -8.347 -0.763 5.353 323 HD21 LEU 38 3HD2 LEU 38 -10.800 -0.407 5.104 324 HD22 LEU 38 1HD2 LEU 38 -11.948 -1.519 5.845 325 HD23 LEU 38 2HD2 LEU 38 -11.082 -1.993 4.382 326 H LYS 39 H LYS 39 -11.337 -3.982 9.107 327 HA LYS 39 HA LYS 39 -10.670 -1.625 10.526 328 HB2 LYS 39 2HB LYS 39 -12.660 -2.160 11.987 329 HB3 LYS 39 3HB LYS 39 -12.982 -2.053 10.270 330 HG2 LYS 39 2HG LYS 39 -14.301 -3.847 10.935 331 HG3 LYS 39 3HG LYS 39 -12.875 -4.635 10.268 332 HD2 LYS 39 2HD LYS 39 -12.020 -5.087 12.510 333 HD3 LYS 39 3HD LYS 39 -13.335 -4.157 13.237 334 HE2 LYS 39 2HE LYS 39 -14.972 -5.774 12.499 335 HE3 LYS 39 3HE LYS 39 -13.765 -6.641 11.548 336 HZ1 LYS 39 3HZ LYS 39 -12.626 -7.192 13.638 337 HZ2 LYS 39 1HZ LYS 39 -14.201 -7.804 13.573 338 HZ3 LYS 39 2HZ LYS 39 -13.864 -6.437 14.511 339 H LYS 40 H LYS 40 -10.243 -5.034 11.257 340 HA LYS 40 HA LYS 40 -9.248 -5.008 13.839 341 HB2 LYS 40 2HB LYS 40 -8.597 -6.641 11.377 342 HB3 LYS 40 3HB LYS 40 -7.642 -6.887 12.828 343 HG2 LYS 40 2HG LYS 40 -10.665 -7.086 12.894 344 HG3 LYS 40 3HG LYS 40 -9.659 -8.448 12.400 345 HD2 LYS 40 2HD LYS 40 -9.444 -7.015 15.078 346 HD3 LYS 40 3HD LYS 40 -10.286 -8.541 14.809 347 HE2 LYS 40 2HE LYS 40 -8.168 -9.605 14.120 348 HE3 LYS 40 3HE LYS 40 -7.312 -8.080 14.357 349 HZ1 LYS 40 3HZ LYS 40 -8.715 -9.620 16.475 350 HZ2 LYS 40 1HZ LYS 40 -7.876 -8.173 16.701 351 HZ3 LYS 40 2HZ LYS 40 -7.039 -9.569 16.245 352 H GLU 41 H GLU 41 -7.426 -4.457 10.804 353 HA GLU 41 HA GLU 41 -5.029 -3.720 12.226 354 HB2 GLU 41 2HB GLU 41 -5.581 -3.464 9.243 355 HB3 GLU 41 3HB GLU 41 -4.006 -3.413 10.028 356 HG2 GLU 41 2HG GLU 41 -5.806 -5.775 9.554 357 HG3 GLU 41 3HG GLU 41 -4.101 -5.594 9.167 358 H MET 42 H MET 42 -7.811 -1.983 11.112 359 HA MET 42 HA MET 42 -6.592 0.616 11.093 360 HB2 MET 42 2HB MET 42 -9.510 -0.188 11.393 361 HB3 MET 42 3HB MET 42 -8.971 1.489 11.359 362 HG2 MET 42 2HG MET 42 -8.705 -0.537 9.125 363 HG3 MET 42 3HG MET 42 -9.779 0.857 9.167 364 HE1 MET 42 3HE MET 42 -7.748 3.165 10.347 365 HE2 MET 42 1HE MET 42 -8.890 3.403 9.023 366 HE3 MET 42 2HE MET 42 -7.193 3.834 8.811 367 H LYS 43 H LYS 43 -7.762 -1.477 13.694 368 HA LYS 43 HA LYS 43 -7.527 0.380 15.821 369 HB2 LYS 43 2HB LYS 43 -7.022 -2.587 15.596 370 HB3 LYS 43 3HB LYS 43 -6.466 -1.769 17.042 371 HG2 LYS 43 2HG LYS 43 -8.569 -2.781 17.519 372 HG3 LYS 43 3HG LYS 43 -8.800 -1.043 17.504 373 HD2 LYS 43 2HD LYS 43 -9.468 -2.664 15.040 374 HD3 LYS 43 3HD LYS 43 -10.582 -2.657 16.404 375 HE2 LYS 43 2HE LYS 43 -9.671 -0.226 14.830 376 HE3 LYS 43 3HE LYS 43 -11.250 -0.990 14.745 377 HZ1 LYS 43 3HZ LYS 43 -11.207 1.019 16.123 378 HZ2 LYS 43 1HZ LYS 43 -10.133 0.271 17.186 379 HZ3 LYS 43 2HZ LYS 43 -11.696 -0.342 16.998 380 H LYS 44 H LYS 44 -5.029 -1.398 14.022 381 HA LYS 44 HA LYS 44 -2.771 -0.524 15.536 382 HB2 LYS 44 2HB LYS 44 -2.907 -1.622 12.691 383 HB3 LYS 44 3HB LYS 44 -1.438 -1.481 13.643 384 HG2 LYS 44 2HG LYS 44 -3.807 -3.239 14.354 385 HG3 LYS 44 3HG LYS 44 -2.339 -3.797 13.553 386 HD2 LYS 44 2HD LYS 44 -2.441 -2.549 16.326 387 HD3 LYS 44 3HD LYS 44 -2.354 -4.280 15.995 388 HE2 LYS 44 2HE LYS 44 -0.167 -4.013 14.938 389 HE3 LYS 44 3HE LYS 44 -0.260 -2.258 15.123 390 HZ1 LYS 44 3HZ LYS 44 -0.117 -2.457 17.457 391 HZ2 LYS 44 1HZ LYS 44 1.109 -3.429 16.819 392 HZ3 LYS 44 2HZ LYS 44 -0.307 -4.138 17.416 393 H LEU 45 H LEU 45 -4.304 0.675 12.563 394 HA LEU 45 HA LEU 45 -2.146 2.512 11.941 395 HB2 LEU 45 2HB LEU 45 -4.894 2.215 10.644 396 HB3 LEU 45 3HB LEU 45 -3.512 3.070 9.967 397 HG LEU 45 HG LEU 45 -3.661 0.072 10.462 398 HD11 LEU 45 1HD1 LEU 45 -3.697 -0.176 8.022 399 HD12 LEU 45 2HD1 LEU 45 -3.761 1.578 7.837 400 HD13 LEU 45 3HD1 LEU 45 -5.096 0.722 8.609 401 HD21 LEU 45 3HD2 LEU 45 -1.380 0.862 10.759 402 HD22 LEU 45 1HD2 LEU 45 -1.431 1.689 9.200 403 HD23 LEU 45 2HD2 LEU 45 -1.508 -0.073 9.273 404 H ALA 46 H ALA 46 -5.434 2.705 13.246 405 HA ALA 46 HA ALA 46 -5.440 5.633 13.192 406 HB1 ALA 46 3HB ALA 46 -7.801 5.491 13.744 407 HB2 ALA 46 1HB ALA 46 -7.677 3.744 13.983 408 HB3 ALA 46 2HB ALA 46 -7.427 4.439 12.381 409 H GLU 47 H GLU 47 -5.577 2.995 15.618 410 HA GLU 47 HA GLU 47 -5.688 4.992 17.785 411 HB2 GLU 47 2HB GLU 47 -5.879 1.962 17.952 412 HB3 GLU 47 3HB GLU 47 -6.065 3.075 19.304 413 HG2 GLU 47 2HG GLU 47 -8.023 4.112 18.075 414 HG3 GLU 47 3HG GLU 47 -7.876 2.817 16.889 415 H GLU 48 H GLU 48 -3.224 3.456 16.085 416 HA GLU 48 HA GLU 48 -1.339 4.110 18.288 417 HB2 GLU 48 2HB GLU 48 -0.839 2.089 16.061 418 HB3 GLU 48 3HB GLU 48 0.270 2.494 17.364 419 HG2 GLU 48 2HG GLU 48 -1.371 1.570 19.007 420 HG3 GLU 48 3HG GLU 48 -2.408 1.098 17.660 421 H LYS 49 H LYS 49 -0.631 6.096 17.827 422 HA LYS 49 HA LYS 49 -0.014 6.942 15.067 423 HB2 LYS 49 2HB LYS 49 -0.386 8.471 17.678 424 HB3 LYS 49 3HB LYS 49 0.321 9.230 16.259 425 HG2 LYS 49 2HG LYS 49 -2.040 9.814 16.464 426 HG3 LYS 49 3HG LYS 49 -1.753 8.886 14.995 427 HD2 LYS 49 2HD LYS 49 -3.841 8.190 16.063 428 HD3 LYS 49 3HD LYS 49 -2.672 6.871 16.083 429 HE2 LYS 49 2HE LYS 49 -3.768 6.896 18.217 430 HE3 LYS 49 3HE LYS 49 -2.137 7.505 18.479 431 HZ1 LYS 49 3HZ LYS 49 -4.593 9.155 18.223 432 HZ2 LYS 49 1HZ LYS 49 -3.030 9.754 18.469 433 HZ3 LYS 49 2HZ LYS 49 -3.773 8.815 19.661 434 H ASN 50 H ASN 50 1.563 5.447 17.585 435 HA ASN 50 HA ASN 50 4.073 6.692 17.707 436 HB2 ASN 50 2HB ASN 50 3.321 3.753 18.023 437 HB3 ASN 50 3HB ASN 50 4.942 4.370 18.329 438 HD21 ASN 50 1HD2 ASN 50 3.138 3.074 20.204 439 HD22 ASN 50 2HD2 ASN 50 2.874 4.205 21.481 440 H PHE 51 H PHE 51 5.967 6.462 16.534 441 HA PHE 51 HA PHE 51 5.638 6.324 13.746 442 HB2 PHE 51 2HB PHE 51 7.347 7.748 14.840 443 HB3 PHE 51 3HB PHE 51 8.240 6.314 15.340 444 HD1 PHE 51 HD2 PHE 51 7.005 8.140 12.322 445 HD2 PHE 51 HD1 PHE 51 9.866 5.356 13.872 446 HE1 PHE 51 HE2 PHE 51 8.190 8.148 10.169 447 HE2 PHE 51 HE1 PHE 51 11.041 5.369 11.708 448 HZ PHE 51 HZ PHE 51 10.193 6.762 9.869 449 H GLU 52 H GLU 52 5.668 4.674 12.371 450 HA GLU 52 HA GLU 52 7.441 2.435 12.577 451 HB2 GLU 52 2HB GLU 52 5.637 1.686 14.132 452 HB3 GLU 52 3HB GLU 52 4.445 1.891 12.853 453 HG2 GLU 52 2HG GLU 52 5.036 -0.475 13.162 454 HG3 GLU 52 3HG GLU 52 5.480 0.088 11.555 455 H LYS 53 H LYS 53 7.719 1.443 10.625 456 HA LYS 53 HA LYS 53 6.239 2.454 8.286 457 HB2 LYS 53 2HB LYS 53 8.841 0.861 8.437 458 HB3 LYS 53 3HB LYS 53 8.091 1.459 6.963 459 HG2 LYS 53 2HG LYS 53 8.405 3.796 7.803 460 HG3 LYS 53 3HG LYS 53 9.277 3.145 9.189 461 HD2 LYS 53 2HD LYS 53 10.092 2.880 6.268 462 HD3 LYS 53 3HD LYS 53 10.836 3.941 7.461 463 HE2 LYS 53 2HE LYS 53 10.846 0.902 7.553 464 HE3 LYS 53 3HE LYS 53 12.197 1.927 7.071 465 HZ1 LYS 53 3HZ LYS 53 12.427 1.181 9.338 466 HZ2 LYS 53 1HZ LYS 53 10.952 1.887 9.763 467 HZ3 LYS 53 2HZ LYS 53 12.246 2.854 9.281 468 H ILE 54 H ILE 54 4.454 1.225 7.981 469 HA ILE 54 HA ILE 54 4.587 -1.718 8.312 470 HB ILE 54 HB ILE 54 2.081 0.044 8.305 471 HG12 ILE 54 2HG1 ILE 54 3.549 -1.129 10.721 472 HG13 ILE 54 3HG1 ILE 54 3.495 0.574 10.285 473 HG21 ILE 54 1HG2 ILE 54 2.436 -2.871 9.127 474 HG22 ILE 54 2HG2 ILE 54 1.687 -2.309 7.631 475 HG23 ILE 54 3HG2 ILE 54 0.928 -1.953 9.182 476 HD11 ILE 54 3HD1 ILE 54 1.978 0.123 12.091 477 HD12 ILE 54 1HD1 ILE 54 1.153 -1.118 11.146 478 HD13 ILE 54 2HD1 ILE 54 1.065 0.575 10.651 479 H LEU 55 H LEU 55 4.600 -2.846 6.436 480 HA LEU 55 HA LEU 55 3.592 -1.729 3.928 481 HB2 LEU 55 2HB LEU 55 5.615 -3.280 4.040 482 HB3 LEU 55 3HB LEU 55 4.530 -4.577 4.517 483 HG LEU 55 HG LEU 55 3.255 -3.968 2.260 484 HD11 LEU 55 1HD1 LEU 55 4.464 -1.957 1.722 485 HD12 LEU 55 2HD1 LEU 55 4.725 -3.166 0.470 486 HD13 LEU 55 3HD1 LEU 55 5.990 -2.841 1.655 487 HD21 LEU 55 3HD2 LEU 55 5.881 -5.477 2.141 488 HD22 LEU 55 1HD2 LEU 55 4.537 -5.615 1.006 489 HD23 LEU 55 2HD2 LEU 55 4.338 -6.139 2.677 490 H ILE 56 H ILE 56 1.342 -1.588 3.933 491 HA ILE 56 HA ILE 56 -0.241 -3.767 5.117 492 HB ILE 56 HB ILE 56 -1.231 -1.233 3.738 493 HG12 ILE 56 2HG1 ILE 56 0.035 -0.837 5.928 494 HG13 ILE 56 3HG1 ILE 56 -1.617 -0.239 5.885 495 HG21 ILE 56 1HG2 ILE 56 -2.733 -3.330 5.357 496 HG22 ILE 56 2HG2 ILE 56 -2.903 -3.008 3.630 497 HG23 ILE 56 3HG2 ILE 56 -3.421 -1.802 4.805 498 HD11 ILE 56 3HD1 ILE 56 -1.082 -1.249 8.015 499 HD12 ILE 56 1HD1 ILE 56 -0.698 -2.772 7.223 500 HD13 ILE 56 2HD1 ILE 56 -2.353 -2.159 7.202 501 H LYS 57 H LYS 57 -0.584 -5.465 3.895 502 HA LYS 57 HA LYS 57 -0.888 -5.331 0.976 503 HB2 LYS 57 2HB LYS 57 0.420 -7.207 1.723 504 HB3 LYS 57 3HB LYS 57 -0.668 -7.575 3.047 505 HG2 LYS 57 2HG LYS 57 -1.676 -7.875 0.222 506 HG3 LYS 57 3HG LYS 57 -0.578 -9.092 0.863 507 HD2 LYS 57 2HD LYS 57 -2.143 -9.570 2.703 508 HD3 LYS 57 3HD LYS 57 -3.228 -8.303 2.135 509 HE2 LYS 57 2HE LYS 57 -3.616 -9.562 0.054 510 HE3 LYS 57 3HE LYS 57 -2.507 -10.824 0.603 511 HZ1 LYS 57 3HZ LYS 57 -3.984 -11.247 2.479 512 HZ2 LYS 57 1HZ LYS 57 -4.802 -11.434 1.008 513 HZ3 LYS 57 2HZ LYS 57 -5.046 -10.047 1.936 514 H SER 58 H SER 58 -2.828 -5.538 -0.018 515 HA SER 58 HA SER 58 -5.070 -6.791 1.314 516 HB2 SER 58 2HB SER 58 -5.483 -4.474 1.982 517 HB3 SER 58 3HB SER 58 -5.288 -3.926 0.315 518 HG SER 58 HG SER 58 -7.410 -4.167 0.404 519 H ASN 59 H ASN 59 -6.120 -8.019 -0.087 520 HA ASN 59 HA ASN 59 -5.404 -7.981 -2.926 521 HB2 ASN 59 2HB ASN 59 -6.684 -10.182 -2.961 522 HB3 ASN 59 3HB ASN 59 -5.304 -10.154 -1.872 523 HD21 ASN 59 1HD2 ASN 59 -8.807 -10.228 -2.037 524 HD22 ASN 59 2HD2 ASN 59 -9.055 -10.640 -0.375 525 H ASP 60 H ASP 60 -7.677 -6.394 -1.133 526 HA ASP 60 HA ASP 60 -9.506 -6.181 -3.447 527 HB2 ASP 60 2HB ASP 60 -10.765 -7.364 -1.777 528 HB3 ASP 60 3HB ASP 60 -10.258 -6.259 -0.509 529 H LYS 61 H LYS 61 -9.795 -4.234 -4.187 530 HA LYS 61 HA LYS 61 -8.180 -2.051 -3.322 531 HB2 LYS 61 2HB LYS 61 -9.466 -0.827 -5.260 532 HB3 LYS 61 3HB LYS 61 -8.359 -2.133 -5.643 533 HG2 LYS 61 2HG LYS 61 -10.348 -2.323 -7.021 534 HG3 LYS 61 3HG LYS 61 -10.283 -3.683 -5.900 535 HD2 LYS 61 2HD LYS 61 -11.926 -2.509 -4.436 536 HD3 LYS 61 3HD LYS 61 -12.022 -1.205 -5.619 537 HE2 LYS 61 2HE LYS 61 -12.772 -4.097 -6.146 538 HE3 LYS 61 3HE LYS 61 -13.912 -2.805 -5.771 539 HZ1 LYS 61 3HZ LYS 61 -13.050 -1.644 -7.779 540 HZ2 LYS 61 1HZ LYS 61 -13.872 -3.087 -8.101 541 HZ3 LYS 61 2HZ LYS 61 -12.187 -3.044 -8.160 542 H GLN 62 H GLN 62 -11.454 -2.925 -2.560 543 HA GLN 62 HA GLN 62 -12.454 -0.294 -1.966 544 HB2 GLN 62 2HB GLN 62 -13.415 -3.059 -1.160 545 HB3 GLN 62 3HB GLN 62 -14.254 -1.580 -0.705 546 HG2 GLN 62 2HG GLN 62 -14.612 -1.046 -3.080 547 HG3 GLN 62 3HG GLN 62 -13.759 -2.515 -3.538 548 HE21 GLN 62 1HE2 GLN 62 -16.004 -2.426 -0.801 549 HE22 GLN 62 2HE2 GLN 62 -17.224 -3.378 -1.563 550 H LEU 63 H LEU 63 -10.722 -2.757 -0.209 551 HA LEU 63 HA LEU 63 -11.046 -1.757 2.420 552 HB2 LEU 63 2HB LEU 63 -8.695 -3.359 1.338 553 HB3 LEU 63 3HB LEU 63 -9.204 -3.238 3.017 554 HG LEU 63 HG LEU 63 -10.689 -4.628 0.765 555 HD11 LEU 63 1HD1 LEU 63 -8.805 -5.916 1.624 556 HD12 LEU 63 2HD1 LEU 63 -10.337 -6.677 2.036 557 HD13 LEU 63 3HD1 LEU 63 -9.442 -5.782 3.266 558 HD21 LEU 63 3HD2 LEU 63 -12.344 -3.551 2.162 559 HD22 LEU 63 1HD2 LEU 63 -11.609 -4.224 3.622 560 HD23 LEU 63 2HD2 LEU 63 -12.375 -5.289 2.439 561 H LEU 64 H LEU 64 -8.763 -1.082 -0.167 562 HA LEU 64 HA LEU 64 -6.960 0.597 1.223 563 HB2 LEU 64 2HB LEU 64 -7.715 0.414 -1.714 564 HB3 LEU 64 3HB LEU 64 -6.562 1.609 -1.141 565 HG LEU 64 HG LEU 64 -5.076 -0.238 -0.327 566 HD11 LEU 64 1HD1 LEU 64 -6.716 -1.997 0.036 567 HD12 LEU 64 2HD1 LEU 64 -5.460 -2.542 -1.071 568 HD13 LEU 64 3HD1 LEU 64 -7.047 -2.082 -1.695 569 HD21 LEU 64 3HD2 LEU 64 -4.761 0.789 -2.537 570 HD22 LEU 64 1HD2 LEU 64 -5.798 -0.443 -3.259 571 HD23 LEU 64 2HD2 LEU 64 -4.260 -0.902 -2.512 572 H LYS 65 H LYS 65 -10.065 1.228 -0.431 573 HA LYS 65 HA LYS 65 -9.933 4.052 -0.251 574 HB2 LYS 65 2HB LYS 65 -12.291 2.171 -0.627 575 HB3 LYS 65 3HB LYS 65 -12.477 3.920 -0.589 576 HG2 LYS 65 2HG LYS 65 -10.947 2.283 -2.624 577 HG3 LYS 65 3HG LYS 65 -12.413 3.224 -2.886 578 HD2 LYS 65 2HD LYS 65 -9.623 4.297 -2.319 579 HD3 LYS 65 3HD LYS 65 -10.533 4.436 -3.821 580 HE2 LYS 65 2HE LYS 65 -11.283 5.751 -1.186 581 HE3 LYS 65 3HE LYS 65 -10.520 6.554 -2.553 582 HZ1 LYS 65 3HZ LYS 65 -12.924 6.914 -2.427 583 HZ2 LYS 65 1HZ LYS 65 -13.188 5.259 -2.658 584 HZ3 LYS 65 2HZ LYS 65 -12.455 6.178 -3.871 585 H GLU 66 H GLU 66 -11.797 1.695 1.724 586 HA GLU 66 HA GLU 66 -12.939 3.456 3.558 587 HB2 GLU 66 2HB GLU 66 -11.959 0.639 4.133 588 HB3 GLU 66 3HB GLU 66 -13.163 1.516 5.064 589 HG2 GLU 66 2HG GLU 66 -14.697 1.448 3.135 590 HG3 GLU 66 3HG GLU 66 -13.473 0.602 2.197 591 H MET 67 H MET 67 -9.791 1.858 3.584 592 HA MET 67 HA MET 67 -8.806 2.665 6.089 593 HB2 MET 67 2HB MET 67 -7.860 0.884 4.528 594 HB3 MET 67 3HB MET 67 -7.174 2.178 3.560 595 HG2 MET 67 2HG MET 67 -5.946 2.889 5.707 596 HG3 MET 67 3HG MET 67 -6.417 1.316 6.350 597 HE1 MET 67 3HE MET 67 -5.906 -0.986 4.793 598 HE2 MET 67 1HE MET 67 -4.740 -0.973 3.470 599 HE3 MET 67 2HE MET 67 -6.301 -0.178 3.273 600 H LEU 68 H LEU 68 -8.234 4.080 2.831 601 HA LEU 68 HA LEU 68 -6.528 6.163 3.709 602 HB2 LEU 68 2HB LEU 68 -7.971 5.639 1.094 603 HB3 LEU 68 3HB LEU 68 -6.999 7.084 1.315 604 HG LEU 68 HG LEU 68 -5.899 4.253 1.591 605 HD11 LEU 68 1HD1 LEU 68 -5.673 6.126 -0.792 606 HD12 LEU 68 2HD1 LEU 68 -6.606 4.630 -0.720 607 HD13 LEU 68 3HD1 LEU 68 -4.851 4.571 -0.608 608 HD21 LEU 68 3HD2 LEU 68 -4.633 5.922 2.867 609 HD22 LEU 68 1HD2 LEU 68 -4.447 6.916 1.421 610 HD23 LEU 68 2HD2 LEU 68 -3.692 5.320 1.507 611 H GLU 69 H GLU 69 -10.035 6.042 3.314 612 HA GLU 69 HA GLU 69 -10.496 8.852 3.440 613 HB2 GLU 69 2HB GLU 69 -12.351 6.617 4.366 614 HB3 GLU 69 3HB GLU 69 -12.820 8.290 4.095 615 HG2 GLU 69 2HG GLU 69 -12.069 6.196 2.057 616 HG3 GLU 69 3HG GLU 69 -13.578 7.088 2.202 617 H LEU 70 H LEU 70 -10.190 6.319 5.889 618 HA LEU 70 HA LEU 70 -10.646 8.067 8.135 619 HB2 LEU 70 2HB LEU 70 -9.504 5.249 8.024 620 HB3 LEU 70 3HB LEU 70 -9.983 6.087 9.493 621 HG LEU 70 HG LEU 70 -11.857 5.251 7.239 622 HD11 LEU 70 1HD1 LEU 70 -12.786 3.638 8.836 623 HD12 LEU 70 2HD1 LEU 70 -11.593 4.125 10.044 624 HD13 LEU 70 3HD1 LEU 70 -11.071 3.339 8.553 625 HD21 LEU 70 3HD2 LEU 70 -13.697 6.000 8.695 626 HD22 LEU 70 1HD2 LEU 70 -12.630 7.335 8.259 627 HD23 LEU 70 2HD2 LEU 70 -12.529 6.614 9.867 628 H ILE 71 H ILE 71 -7.840 7.001 6.301 629 HA ILE 71 HA ILE 71 -5.800 7.883 8.108 630 HB ILE 71 HB ILE 71 -5.737 7.392 5.097 631 HG12 ILE 71 2HG1 ILE 71 -4.589 5.760 7.412 632 HG13 ILE 71 3HG1 ILE 71 -6.064 5.376 6.532 633 HG21 ILE 71 1HG2 ILE 71 -3.357 8.010 6.893 634 HG22 ILE 71 2HG2 ILE 71 -3.996 9.052 5.620 635 HG23 ILE 71 3HG2 ILE 71 -3.269 7.505 5.204 636 HD11 ILE 71 3HD1 ILE 71 -4.749 5.069 4.485 637 HD12 ILE 71 1HD1 ILE 71 -4.247 3.991 5.785 638 HD13 ILE 71 2HD1 ILE 71 -3.274 5.408 5.396 639 H SER 72 H SER 72 -7.697 9.439 5.559 640 HA SER 72 HA SER 72 -6.342 11.889 5.351 641 HB2 SER 72 2HB SER 72 -8.138 11.185 3.792 642 HB3 SER 72 3HB SER 72 -9.337 11.368 5.073 643 HG SER 72 HG SER 72 -8.168 13.267 3.475 644 H LYS 73 H LYS 73 -8.616 10.680 7.730 645 HA LYS 73 HA LYS 73 -8.953 13.116 9.210 646 HB2 LYS 73 2HB LYS 73 -9.424 10.208 10.011 647 HB3 LYS 73 3HB LYS 73 -9.958 11.601 10.939 648 HG2 LYS 73 2HG LYS 73 -10.882 10.920 8.129 649 HG3 LYS 73 3HG LYS 73 -11.783 10.575 9.605 650 HD2 LYS 73 2HD LYS 73 -11.019 13.352 8.623 651 HD3 LYS 73 3HD LYS 73 -12.610 12.611 8.447 652 HE2 LYS 73 2HE LYS 73 -12.907 12.567 10.875 653 HE3 LYS 73 3HE LYS 73 -11.266 13.172 11.120 654 HZ1 LYS 73 3HZ LYS 73 -11.900 15.227 10.013 655 HZ2 LYS 73 1HZ LYS 73 -12.899 14.933 11.344 656 HZ3 LYS 73 2HZ LYS 73 -13.468 14.649 9.779 657 H LEU 74 H LEU 74 -6.805 10.302 9.445 658 HA LEU 74 HA LEU 74 -5.696 10.849 12.006 659 HB2 LEU 74 2HB LEU 74 -4.629 9.136 9.733 660 HB3 LEU 74 3HB LEU 74 -4.020 9.100 11.381 661 HG LEU 74 HG LEU 74 -6.855 8.355 10.580 662 HD11 LEU 74 1HD1 LEU 74 -4.545 6.509 11.247 663 HD12 LEU 74 2HD1 LEU 74 -5.270 6.746 9.655 664 HD13 LEU 74 3HD1 LEU 74 -6.217 6.019 10.951 665 HD21 LEU 74 3HD2 LEU 74 -7.054 7.468 12.870 666 HD22 LEU 74 1HD2 LEU 74 -6.740 9.203 12.866 667 HD23 LEU 74 2HD2 LEU 74 -5.439 8.073 13.249 668 H GLY 75 H GLY 75 -4.585 11.565 8.720 669 HA2 GLY 75 2HA GLY 75 -3.219 13.216 7.919 670 HA3 GLY 75 3HA GLY 75 -3.052 13.837 9.549 671 H TYR 76 H TYR 76 -1.964 11.118 7.485 672 HA TYR 76 HA TYR 76 0.790 11.869 7.999 673 HB2 TYR 76 2HB TYR 76 1.563 9.540 8.488 674 HB3 TYR 76 3HB TYR 76 0.577 10.213 9.764 675 HD1 TYR 76 HD2 TYR 76 0.528 7.768 6.934 676 HD2 TYR 76 HD1 TYR 76 -1.398 9.068 10.521 677 HE1 TYR 76 HE2 TYR 76 -0.829 5.721 6.953 678 HE2 TYR 76 HE1 TYR 76 -2.741 7.011 10.538 679 HH TYR 76 HH TYR 76 -3.526 5.303 8.988 680 H LYS 77 H LYS 77 2.302 10.439 6.584 681 HA LYS 77 HA LYS 77 1.256 10.740 3.874 682 HB2 LYS 77 2HB LYS 77 3.574 11.618 4.856 683 HB3 LYS 77 3HB LYS 77 4.139 9.998 4.497 684 HG2 LYS 77 2HG LYS 77 2.877 11.807 2.413 685 HG3 LYS 77 3HG LYS 77 4.608 11.779 2.742 686 HD2 LYS 77 2HD LYS 77 4.790 9.483 2.011 687 HD3 LYS 77 3HD LYS 77 3.034 9.317 1.901 688 HE2 LYS 77 2HE LYS 77 4.098 9.595 -0.316 689 HE3 LYS 77 3HE LYS 77 2.970 10.902 0.046 690 HZ1 LYS 77 3HZ LYS 77 4.858 12.291 0.669 691 HZ2 LYS 77 1HZ LYS 77 5.002 11.751 -0.922 692 HZ3 LYS 77 2HZ LYS 77 5.928 11.040 0.297 693 H VAL 78 H VAL 78 0.794 9.094 2.535 694 HA VAL 78 HA VAL 78 1.589 6.316 3.206 695 HB VAL 78 HB VAL 78 -1.107 7.221 2.078 696 HG11 VAL 78 1HG1 VAL 78 -0.456 5.041 1.149 697 HG12 VAL 78 2HG1 VAL 78 -1.809 4.863 2.265 698 HG13 VAL 78 3HG1 VAL 78 -0.180 4.411 2.775 699 HG21 VAL 78 3HG2 VAL 78 -0.456 6.052 4.804 700 HG22 VAL 78 1HG2 VAL 78 -2.075 6.414 4.198 701 HG23 VAL 78 2HG2 VAL 78 -0.923 7.722 4.470 702 H PHE 79 H PHE 79 2.340 5.133 1.552 703 HA PHE 79 HA PHE 79 2.367 6.150 -1.214 704 HB2 PHE 79 2HB PHE 79 3.910 3.819 0.040 705 HB3 PHE 79 3HB PHE 79 4.122 4.448 -1.593 706 HD1 PHE 79 HD1 PHE 79 5.142 6.718 -1.928 707 HD2 PHE 79 HD2 PHE 79 5.016 4.862 1.925 708 HE1 PHE 79 HE1 PHE 79 6.848 8.283 -1.107 709 HE2 PHE 79 HE2 PHE 79 6.727 6.436 2.730 710 HZ PHE 79 HZ PHE 79 7.636 8.146 1.218 711 H LEU 80 H LEU 80 1.600 4.755 -2.885 712 HA LEU 80 HA LEU 80 0.253 2.245 -2.124 713 HB2 LEU 80 2HB LEU 80 -1.560 3.835 -2.080 714 HB3 LEU 80 3HB LEU 80 -1.043 4.586 -3.580 715 HG LEU 80 HG LEU 80 -1.776 2.647 -4.878 716 HD11 LEU 80 1HD1 LEU 80 -2.575 1.324 -2.282 717 HD12 LEU 80 2HD1 LEU 80 -1.234 0.850 -3.322 718 HD13 LEU 80 3HD1 LEU 80 -2.885 0.710 -3.908 719 HD21 LEU 80 3HD2 LEU 80 -3.467 4.344 -4.396 720 HD22 LEU 80 1HD2 LEU 80 -3.935 3.493 -2.921 721 HD23 LEU 80 2HD2 LEU 80 -4.202 2.746 -4.500 722 H LEU 81 H LEU 81 0.516 0.676 -3.556 723 HA LEU 81 HA LEU 81 1.450 1.241 -6.292 724 HB2 LEU 81 2HB LEU 81 3.335 0.406 -4.912 725 HB3 LEU 81 3HB LEU 81 2.393 -1.009 -4.470 726 HG LEU 81 HG LEU 81 2.422 -1.808 -6.800 727 HD11 LEU 81 1HD1 LEU 81 3.784 -0.673 -8.532 728 HD12 LEU 81 2HD1 LEU 81 3.991 0.700 -7.445 729 HD13 LEU 81 3HD1 LEU 81 2.385 0.270 -8.027 730 HD21 LEU 81 3HD2 LEU 81 4.818 -2.329 -6.991 731 HD22 LEU 81 1HD2 LEU 81 4.251 -2.489 -5.330 732 HD23 LEU 81 2HD2 LEU 81 5.192 -1.072 -5.807 733 H LEU 82 H LEU 82 -0.052 0.617 -7.608 734 HA LEU 82 HA LEU 82 -1.872 -1.648 -7.075 735 HB2 LEU 82 2HB LEU 82 -1.932 0.524 -9.227 736 HB3 LEU 82 3HB LEU 82 -3.183 -0.680 -8.955 737 HG LEU 82 HG LEU 82 -2.433 1.478 -6.940 738 HD11 LEU 82 1HD1 LEU 82 -4.794 1.443 -8.846 739 HD12 LEU 82 2HD1 LEU 82 -3.376 2.487 -8.970 740 HD13 LEU 82 3HD1 LEU 82 -4.466 2.651 -7.598 741 HD21 LEU 82 3HD2 LEU 82 -4.526 0.860 -5.807 742 HD22 LEU 82 1HD2 LEU 82 -3.404 -0.499 -5.880 743 HD23 LEU 82 2HD2 LEU 82 -4.787 -0.438 -6.976 744 H ALA 83 H ALA 83 -1.652 -3.516 -8.343 745 HA ALA 83 HA ALA 83 -0.015 -3.459 -10.791 746 HB1 ALA 83 3HB ALA 83 1.607 -3.906 -8.989 747 HB2 ALA 83 1HB ALA 83 1.424 -5.312 -10.040 748 HB3 ALA 83 2HB ALA 83 0.653 -5.288 -8.452 749 H ASP 84 H ASP 84 -1.404 -4.286 -12.220 750 HA ASP 84 HA ASP 84 -2.219 -7.035 -12.030 751 HB2 ASP 84 2HB ASP 84 -4.104 -6.119 -10.770 752 HB3 ASP 84 3HB ASP 84 -4.373 -4.870 -11.978 753 H GLN 85 H GLN 85 -2.851 -7.868 -13.999 754 HA GLN 85 HA GLN 85 -1.711 -6.892 -16.343 755 HB2 GLN 85 2HB GLN 85 -4.021 -8.857 -16.067 756 HB3 GLN 85 3HB GLN 85 -2.946 -8.712 -17.457 757 HG2 GLN 85 2HG GLN 85 -1.047 -9.484 -16.119 758 HG3 GLN 85 3HG GLN 85 -2.052 -9.529 -14.673 759 HE21 GLN 85 1HE2 GLN 85 -3.127 -10.650 -17.864 760 HE22 GLN 85 2HE2 GLN 85 -3.217 -12.316 -17.427 761 H ASP 86 H ASP 86 -5.112 -6.799 -15.235 762 HA ASP 86 HA ASP 86 -5.902 -4.929 -17.338 763 HB2 ASP 86 2HB ASP 86 -7.520 -6.630 -16.299 764 HB3 ASP 86 3HB ASP 86 -7.511 -5.641 -14.840 765 H GLU 87 H GLU 87 -5.062 -2.992 -17.186 766 HA GLU 87 HA GLU 87 -4.354 -1.770 -14.624 767 HB2 GLU 87 2HB GLU 87 -3.193 -0.087 -16.007 768 HB3 GLU 87 3HB GLU 87 -2.697 -1.728 -16.409 769 HG2 GLU 87 2HG GLU 87 -4.086 -1.704 -18.414 770 HG3 GLU 87 3HG GLU 87 -4.709 -0.111 -17.993 771 H ASN 88 H ASN 88 -7.051 -1.765 -16.671 772 HA ASN 88 HA ASN 88 -7.625 0.961 -17.064 773 HB2 ASN 88 2HB ASN 88 -8.651 -0.839 -18.399 774 HB3 ASN 88 3HB ASN 88 -9.555 -1.399 -17.005 775 HD21 ASN 88 1HD2 ASN 88 -9.256 1.166 -19.384 776 HD22 ASN 88 2HD2 ASN 88 -10.817 1.860 -19.117 777 H GLU 89 H GLU 89 -9.035 -1.301 -14.639 778 HA GLU 89 HA GLU 89 -10.605 0.643 -13.282 779 HB2 GLU 89 2HB GLU 89 -11.033 -1.751 -12.994 780 HB3 GLU 89 3HB GLU 89 -9.457 -1.978 -12.241 781 HG2 GLU 89 2HG GLU 89 -10.161 -0.541 -10.348 782 HG3 GLU 89 3HG GLU 89 -11.741 -0.328 -11.102 783 H LEU 90 H LEU 90 -7.353 -0.595 -12.701 784 HA LEU 90 HA LEU 90 -6.763 0.792 -10.314 785 HB2 LEU 90 2HB LEU 90 -4.855 -0.191 -12.471 786 HB3 LEU 90 3HB LEU 90 -4.393 0.279 -10.844 787 HG LEU 90 HG LEU 90 -6.049 -2.153 -11.618 788 HD11 LEU 90 1HD1 LEU 90 -3.237 -1.903 -10.488 789 HD12 LEU 90 2HD1 LEU 90 -3.680 -2.404 -12.122 790 HD13 LEU 90 3HD1 LEU 90 -4.105 -3.418 -10.749 791 HD21 LEU 90 3HD2 LEU 90 -6.894 -1.291 -9.495 792 HD22 LEU 90 1HD2 LEU 90 -5.257 -1.213 -8.837 793 HD23 LEU 90 2HD2 LEU 90 -5.986 -2.775 -9.224 794 H GLU 91 H GLU 91 -6.702 1.754 -13.658 795 HA GLU 91 HA GLU 91 -4.895 3.935 -13.551 796 HB2 GLU 91 2HB GLU 91 -5.527 2.799 -15.652 797 HB3 GLU 91 3HB GLU 91 -7.191 3.345 -15.472 798 HG2 GLU 91 2HG GLU 91 -6.175 4.738 -17.115 799 HG3 GLU 91 3HG GLU 91 -6.351 5.718 -15.667 800 H GLU 92 H GLU 92 -8.436 3.705 -13.372 801 HA GLU 92 HA GLU 92 -8.955 6.496 -13.013 802 HB2 GLU 92 2HB GLU 92 -10.692 4.141 -12.151 803 HB3 GLU 92 3HB GLU 92 -11.229 5.787 -12.485 804 HG2 GLU 92 2HG GLU 92 -10.788 5.533 -14.849 805 HG3 GLU 92 3HG GLU 92 -10.009 3.971 -14.590 806 H PHE 93 H PHE 93 -8.467 3.747 -10.900 807 HA PHE 93 HA PHE 93 -9.223 4.764 -8.415 808 HB2 PHE 93 2HB PHE 93 -8.728 2.340 -9.101 809 HB3 PHE 93 3HB PHE 93 -7.022 2.708 -8.900 810 HD1 PHE 93 HD1 PHE 93 -10.283 2.512 -7.111 811 HD2 PHE 93 HD2 PHE 93 -6.028 2.642 -6.703 812 HE1 PHE 93 HE1 PHE 93 -10.473 1.856 -4.746 813 HE2 PHE 93 HE2 PHE 93 -6.231 2.000 -4.337 814 HZ PHE 93 HZ PHE 93 -8.455 1.599 -3.360 815 H LYS 94 H LYS 94 -6.009 4.696 -9.989 816 HA LYS 94 HA LYS 94 -4.627 5.872 -7.804 817 HB2 LYS 94 2HB LYS 94 -2.688 6.056 -9.349 818 HB3 LYS 94 3HB LYS 94 -3.394 4.457 -9.284 819 HG2 LYS 94 2HG LYS 94 -2.880 4.713 -11.537 820 HG3 LYS 94 3HG LYS 94 -4.599 5.088 -11.477 821 HD2 LYS 94 2HD LYS 94 -3.354 6.632 -12.955 822 HD3 LYS 94 3HD LYS 94 -4.110 7.486 -11.609 823 HE2 LYS 94 2HE LYS 94 -1.956 7.609 -10.445 824 HE3 LYS 94 3HE LYS 94 -1.184 6.669 -11.728 825 HZ1 LYS 94 3HZ LYS 94 -0.796 9.053 -11.982 826 HZ2 LYS 94 1HZ LYS 94 -2.459 9.326 -12.085 827 HZ3 LYS 94 2HZ LYS 94 -1.679 8.432 -13.281 828 H ARG 95 H ARG 95 -6.351 7.258 -10.508 829 HA ARG 95 HA ARG 95 -5.312 9.908 -10.354 830 HB2 ARG 95 2HB ARG 95 -8.017 8.901 -11.342 831 HB3 ARG 95 3HB ARG 95 -7.423 10.543 -11.579 832 HG2 ARG 95 2HG ARG 95 -5.628 9.763 -13.008 833 HG3 ARG 95 3HG ARG 95 -6.002 8.079 -12.640 834 HD2 ARG 95 2HD ARG 95 -6.878 8.524 -14.816 835 HD3 ARG 95 3HD ARG 95 -8.265 8.449 -13.728 836 HE ARG 95 HE ARG 95 -8.049 11.016 -13.742 837 HH11 ARG 95 1HH1 ARG 95 -7.306 8.977 -16.528 838 HH12 ARG 95 2HH1 ARG 95 -7.698 10.213 -17.685 839 HH21 ARG 95 1HH2 ARG 95 -8.585 12.610 -15.280 840 HH22 ARG 95 2HH2 ARG 95 -8.423 12.268 -16.972 841 H LYS 96 H LYS 96 -7.923 8.209 -8.708 842 HA LYS 96 HA LYS 96 -9.087 10.363 -7.280 843 HB2 LYS 96 2HB LYS 96 -8.883 7.451 -6.398 844 HB3 LYS 96 3HB LYS 96 -10.068 8.621 -5.848 845 HG2 LYS 96 2HG LYS 96 -9.873 7.530 -8.666 846 HG3 LYS 96 3HG LYS 96 -10.971 6.937 -7.430 847 HD2 LYS 96 2HD LYS 96 -11.002 9.693 -8.695 848 HD3 LYS 96 3HD LYS 96 -12.143 8.380 -8.986 849 HE2 LYS 96 2HE LYS 96 -11.773 9.897 -6.383 850 HE3 LYS 96 3HE LYS 96 -13.139 10.021 -7.486 851 HZ1 LYS 96 3HZ LYS 96 -12.377 7.606 -5.933 852 HZ2 LYS 96 1HZ LYS 96 -13.680 7.705 -7.007 853 HZ3 LYS 96 2HZ LYS 96 -13.672 8.639 -5.597 854 H ILE 97 H ILE 97 -6.625 7.951 -6.380 855 HA ILE 97 HA ILE 97 -6.342 8.781 -3.673 856 HB ILE 97 HB ILE 97 -4.452 7.055 -5.336 857 HG12 ILE 97 2HG1 ILE 97 -6.644 6.049 -5.478 858 HG13 ILE 97 3HG1 ILE 97 -5.714 5.099 -4.335 859 HG21 ILE 97 1HG2 ILE 97 -3.411 7.778 -3.239 860 HG22 ILE 97 2HG2 ILE 97 -3.762 6.051 -3.196 861 HG23 ILE 97 3HG2 ILE 97 -4.797 7.181 -2.321 862 HD11 ILE 97 3HD1 ILE 97 -6.914 6.263 -2.486 863 HD12 ILE 97 1HD1 ILE 97 -7.955 5.322 -3.553 864 HD13 ILE 97 2HD1 ILE 97 -7.904 7.076 -3.701 865 H GLU 98 H GLU 98 -4.540 9.444 -6.645 866 HA GLU 98 HA GLU 98 -2.350 10.882 -5.623 867 HB2 GLU 98 2HB GLU 98 -2.693 10.036 -8.002 868 HB3 GLU 98 3HB GLU 98 -3.774 11.387 -8.275 869 HG2 GLU 98 2HG GLU 98 -0.846 11.685 -7.535 870 HG3 GLU 98 3HG GLU 98 -1.439 11.649 -9.189 871 H SER 99 H SER 99 -5.617 11.889 -6.576 872 HA SER 99 HA SER 99 -5.243 14.696 -6.307 873 HB2 SER 99 2HB SER 99 -7.029 13.623 -7.710 874 HB3 SER 99 3HB SER 99 -7.864 13.128 -6.240 875 HG SER 99 HG SER 99 -7.547 15.648 -5.867 876 H GLN 100 H GLN 100 -6.102 12.144 -4.071 877 HA GLN 100 HA GLN 100 -7.028 13.851 -1.931 878 HB2 GLN 100 2HB GLN 100 -6.257 10.911 -1.988 879 HB3 GLN 100 3HB GLN 100 -6.932 11.726 -0.578 880 HG2 GLN 100 2HG GLN 100 -8.979 12.252 -1.864 881 HG3 GLN 100 3HG GLN 100 -8.313 11.407 -3.259 882 HE21 GLN 100 1HE2 GLN 100 -10.744 10.938 -1.595 883 HE22 GLN 100 2HE2 GLN 100 -10.634 9.290 -1.076 884 H GLY 101 H GLY 101 -3.944 13.191 -3.122 885 HA2 GLY 101 2HA GLY 101 -2.066 14.433 -2.415 886 HA3 GLY 101 3HA GLY 101 -2.754 14.560 -0.805 887 H TYR 102 H TYR 102 -2.838 11.415 -2.177 888 HA TYR 102 HA TYR 102 -0.551 10.538 -0.526 889 HB2 TYR 102 2HB TYR 102 -2.699 8.882 -1.925 890 HB3 TYR 102 3HB TYR 102 -1.461 8.254 -0.838 891 HD1 TYR 102 HD2 TYR 102 -1.439 9.340 1.591 892 HD2 TYR 102 HD1 TYR 102 -4.826 9.384 -1.019 893 HE1 TYR 102 HE2 TYR 102 -2.918 9.712 3.518 894 HE2 TYR 102 HE1 TYR 102 -6.307 9.767 0.912 895 HH TYR 102 HH TYR 102 -6.306 9.444 3.345 896 H GLU 103 H GLU 103 1.136 9.252 -1.427 897 HA GLU 103 HA GLU 103 1.673 9.657 -4.249 898 HB2 GLU 103 2HB GLU 103 3.557 9.711 -2.657 899 HB3 GLU 103 3HB GLU 103 3.223 8.054 -2.166 900 HG2 GLU 103 2HG GLU 103 5.142 8.149 -3.695 901 HG3 GLU 103 3HG GLU 103 3.814 7.241 -4.414 902 H VAL 104 H VAL 104 1.167 8.259 -5.834 903 HA VAL 104 HA VAL 104 0.669 5.446 -5.227 904 HB VAL 104 HB VAL 104 -1.556 6.396 -5.063 905 HG11 VAL 104 1HG1 VAL 104 -1.235 8.471 -6.310 906 HG12 VAL 104 2HG1 VAL 104 -2.658 7.608 -6.894 907 HG13 VAL 104 3HG1 VAL 104 -1.160 7.574 -7.829 908 HG21 VAL 104 3HG2 VAL 104 -1.264 4.921 -7.712 909 HG22 VAL 104 1HG2 VAL 104 -2.740 5.057 -6.752 910 HG23 VAL 104 2HG2 VAL 104 -1.354 4.171 -6.117 911 H ARG 105 H ARG 105 1.462 4.146 -6.711 912 HA ARG 105 HA ARG 105 2.031 5.093 -9.453 913 HB2 ARG 105 2HB ARG 105 3.609 3.083 -7.774 914 HB3 ARG 105 3HB ARG 105 3.886 3.372 -9.483 915 HG2 ARG 105 2HG ARG 105 4.278 5.407 -7.277 916 HG3 ARG 105 3HG ARG 105 5.552 4.475 -8.055 917 HD2 ARG 105 2HD ARG 105 5.772 6.218 -9.482 918 HD3 ARG 105 3HD ARG 105 4.261 5.692 -10.221 919 HE ARG 105 HE ARG 105 3.808 7.400 -7.969 920 HH11 ARG 105 1HH1 ARG 105 4.676 7.461 -11.383 921 HH12 ARG 105 2HH1 ARG 105 4.095 9.081 -11.625 922 HH21 ARG 105 1HH2 ARG 105 3.119 9.545 -8.274 923 HH22 ARG 105 2HH2 ARG 105 3.209 10.277 -9.856 924 H LYS 106 H LYS 106 1.178 3.830 -11.044 925 HA LYS 106 HA LYS 106 -0.156 1.285 -10.303 926 HB2 LYS 106 2HB LYS 106 -1.757 3.094 -10.834 927 HB3 LYS 106 3HB LYS 106 -1.014 3.329 -12.406 928 HG2 LYS 106 2HG LYS 106 -2.106 0.597 -11.732 929 HG3 LYS 106 3HG LYS 106 -3.246 1.885 -12.096 930 HD2 LYS 106 2HD LYS 106 -1.016 0.952 -13.945 931 HD3 LYS 106 3HD LYS 106 -2.718 0.506 -14.086 932 HE2 LYS 106 2HE LYS 106 -3.341 2.829 -14.502 933 HE3 LYS 106 3HE LYS 106 -1.679 3.355 -14.236 934 HZ1 LYS 106 3HZ LYS 106 -2.621 1.614 -16.449 935 HZ2 LYS 106 1HZ LYS 106 -1.018 2.074 -16.184 936 HZ3 LYS 106 2HZ LYS 106 -2.175 3.239 -16.575 937 H VAL 107 H VAL 107 0.883 -0.362 -11.110 938 HA VAL 107 HA VAL 107 2.355 -0.221 -13.677 939 HB VAL 107 HB VAL 107 4.060 -1.720 -12.753 940 HG11 VAL 107 1HG1 VAL 107 5.153 -0.232 -11.097 941 HG12 VAL 107 2HG1 VAL 107 3.647 0.673 -10.919 942 HG13 VAL 107 3HG1 VAL 107 4.500 0.670 -12.465 943 HG21 VAL 107 3HG2 VAL 107 4.095 -2.362 -10.345 944 HG22 VAL 107 1HG2 VAL 107 2.712 -3.040 -11.202 945 HG23 VAL 107 2HG2 VAL 107 2.497 -1.645 -10.144 946 H THR 108 H THR 108 2.895 -2.675 -14.303 947 HA THR 108 HA THR 108 0.540 -4.419 -13.829 948 HB THR 108 HB THR 108 0.808 -5.252 -16.214 949 HG1 THR 108 HG1 THR 108 2.681 -4.622 -17.026 950 HG21 THR 108 3HG2 THR 108 -0.977 -3.620 -15.686 951 HG22 THR 108 1HG2 THR 108 -0.331 -3.355 -17.306 952 HG23 THR 108 2HG2 THR 108 0.148 -2.293 -15.981 953 H ASP 109 H ASP 109 3.957 -4.300 -14.937 954 HA ASP 109 HA ASP 109 4.307 -7.148 -14.860 955 HB2 ASP 109 2HB ASP 109 6.320 -4.888 -15.199 956 HB3 ASP 109 3HB ASP 109 6.737 -6.590 -15.350 957 H ASP 110 H ASP 110 5.768 -8.363 -13.607 958 HA ASP 110 HA ASP 110 5.724 -8.024 -10.807 959 HB2 ASP 110 2HB ASP 110 5.905 -10.259 -11.653 960 HB3 ASP 110 3HB ASP 110 7.259 -9.852 -12.696 961 H GLU 111 H GLU 111 8.404 -7.797 -13.119 962 HA GLU 111 HA GLU 111 10.481 -7.002 -11.454 963 HB2 GLU 111 2HB GLU 111 11.610 -6.260 -13.524 964 HB3 GLU 111 3HB GLU 111 10.747 -7.767 -13.810 965 HG2 GLU 111 2HG GLU 111 8.846 -6.378 -14.791 966 HG3 GLU 111 3HG GLU 111 9.911 -4.983 -14.681 967 H GLU 112 H GLU 112 7.948 -5.145 -12.941 968 HA GLU 112 HA GLU 112 9.134 -2.534 -12.644 969 HB2 GLU 112 2HB GLU 112 7.735 -3.203 -14.571 970 HB3 GLU 112 3HB GLU 112 6.359 -3.443 -13.505 971 HG2 GLU 112 2HG GLU 112 6.379 -1.018 -12.983 972 HG3 GLU 112 3HG GLU 112 7.728 -0.806 -14.104 973 H ALA 113 H ALA 113 6.647 -4.483 -11.036 974 HA ALA 113 HA ALA 113 5.765 -2.532 -9.183 975 HB1 ALA 113 3HB ALA 113 4.504 -4.589 -9.621 976 HB2 ALA 113 1HB ALA 113 4.865 -4.436 -7.901 977 HB3 ALA 113 2HB ALA 113 5.790 -5.561 -8.903 978 H LEU 114 H LEU 114 8.254 -5.077 -8.953 979 HA LEU 114 HA LEU 114 8.976 -4.703 -6.262 980 HB2 LEU 114 2HB LEU 114 10.574 -5.828 -8.588 981 HB3 LEU 114 3HB LEU 114 11.075 -5.952 -6.909 982 HG LEU 114 HG LEU 114 8.525 -7.179 -8.040 983 HD11 LEU 114 1HD1 LEU 114 9.647 -9.345 -7.867 984 HD12 LEU 114 2HD1 LEU 114 11.138 -8.558 -7.343 985 HD13 LEU 114 3HD1 LEU 114 10.513 -8.277 -8.971 986 HD21 LEU 114 3HD2 LEU 114 8.389 -8.384 -5.898 987 HD22 LEU 114 1HD2 LEU 114 8.314 -6.639 -5.662 988 HD23 LEU 114 2HD2 LEU 114 9.805 -7.512 -5.305 989 H LYS 115 H LYS 115 10.185 -3.104 -9.211 990 HA LYS 115 HA LYS 115 12.391 -1.810 -7.890 991 HB2 LYS 115 2HB LYS 115 12.752 -0.583 -9.973 992 HB3 LYS 115 3HB LYS 115 12.440 -2.275 -10.332 993 HG2 LYS 115 2HG LYS 115 10.090 -1.672 -10.914 994 HG3 LYS 115 3HG LYS 115 10.500 0.024 -10.679 995 HD2 LYS 115 2HD LYS 115 11.816 -1.817 -12.724 996 HD3 LYS 115 3HD LYS 115 10.526 -0.669 -13.080 997 HE2 LYS 115 2HE LYS 115 13.272 0.078 -12.018 998 HE3 LYS 115 3HE LYS 115 12.758 0.209 -13.700 999 HZ1 LYS 115 3HZ LYS 115 12.615 2.317 -12.501 1000 HZ2 LYS 115 1HZ LYS 115 11.494 1.645 -11.430 1001 HZ3 LYS 115 2HZ LYS 115 11.104 1.812 -13.066 1002 H ILE 116 H ILE 116 8.990 -1.030 -8.383 1003 HA ILE 116 HA ILE 116 9.152 1.709 -7.508 1004 HB ILE 116 HB ILE 116 6.751 -0.181 -7.478 1005 HG12 ILE 116 2HG1 ILE 116 7.590 0.219 -9.763 1006 HG13 ILE 116 3HG1 ILE 116 6.022 0.966 -9.536 1007 HG21 ILE 116 1HG2 ILE 116 6.395 1.642 -5.894 1008 HG22 ILE 116 2HG2 ILE 116 5.361 1.864 -7.302 1009 HG23 ILE 116 3HG2 ILE 116 6.821 2.837 -7.123 1010 HD11 ILE 116 3HD1 ILE 116 7.477 2.351 -10.845 1011 HD12 ILE 116 1HD1 ILE 116 8.684 2.370 -9.562 1012 HD13 ILE 116 2HD1 ILE 116 7.115 3.148 -9.315 1013 H VAL 117 H VAL 117 8.532 -1.418 -5.920 1014 HA VAL 117 HA VAL 117 7.761 -0.580 -3.372 1015 HB VAL 117 HB VAL 117 9.292 -3.087 -4.210 1016 HG11 VAL 117 1HG1 VAL 117 8.558 -4.115 -2.075 1017 HG12 VAL 117 2HG1 VAL 117 7.917 -2.558 -1.547 1018 HG13 VAL 117 3HG1 VAL 117 9.652 -2.756 -1.808 1019 HG21 VAL 117 3HG2 VAL 117 7.078 -2.894 -5.247 1020 HG22 VAL 117 1HG2 VAL 117 6.330 -2.668 -3.665 1021 HG23 VAL 117 2HG2 VAL 117 7.094 -4.207 -4.072 1022 H ARG 118 H ARG 118 11.014 -1.441 -4.552 1023 HA ARG 118 HA ARG 118 12.415 -0.995 -2.141 1024 HB2 ARG 118 2HB ARG 118 13.454 -0.924 -5.004 1025 HB3 ARG 118 3HB ARG 118 14.456 -1.069 -3.562 1026 HG2 ARG 118 2HG ARG 118 13.472 -3.249 -3.044 1027 HG3 ARG 118 3HG ARG 118 12.362 -3.099 -4.408 1028 HD2 ARG 118 2HD ARG 118 14.186 -4.567 -5.034 1029 HD3 ARG 118 3HD ARG 118 14.322 -3.065 -5.952 1030 HE ARG 118 HE ARG 118 15.880 -3.268 -3.486 1031 HH11 ARG 118 1HH1 ARG 118 15.921 -3.505 -7.011 1032 HH12 ARG 118 2HH1 ARG 118 17.650 -3.356 -7.106 1033 HH21 ARG 118 1HH2 ARG 118 18.142 -3.069 -3.640 1034 HH22 ARG 118 2HH2 ARG 118 18.904 -3.107 -5.200 1035 H GLU 119 H GLU 119 11.537 1.142 -4.798 1036 HA GLU 119 HA GLU 119 13.118 3.381 -3.948 1037 HB2 GLU 119 2HB GLU 119 10.891 3.032 -5.978 1038 HB3 GLU 119 3HB GLU 119 11.543 4.623 -5.604 1039 HG2 GLU 119 2HG GLU 119 13.182 2.286 -6.616 1040 HG3 GLU 119 3HG GLU 119 12.551 3.588 -7.621 1041 H PHE 120 H PHE 120 9.707 2.434 -3.493 1042 HA PHE 120 HA PHE 120 8.782 4.686 -2.104 1043 HB2 PHE 120 2HB PHE 120 7.951 1.780 -2.159 1044 HB3 PHE 120 3HB PHE 120 7.234 2.824 -0.943 1045 HD1 PHE 120 HD2 PHE 120 7.564 5.114 -3.467 1046 HD2 PHE 120 HD1 PHE 120 5.426 1.495 -2.633 1047 HE1 PHE 120 HE2 PHE 120 5.777 5.796 -5.016 1048 HE2 PHE 120 HE1 PHE 120 3.653 2.198 -4.183 1049 HZ PHE 120 HZ PHE 120 3.824 4.341 -5.369 1050 H MET 121 H MET 121 10.625 1.915 -1.043 1051 HA MET 121 HA MET 121 10.583 2.371 1.756 1052 HB2 MET 121 2HB MET 121 12.589 0.900 -0.003 1053 HB3 MET 121 3HB MET 121 12.544 0.801 1.754 1054 HG2 MET 121 2HG MET 121 10.461 -0.362 1.737 1055 HG3 MET 121 3HG MET 121 10.177 0.026 0.040 1056 HE1 MET 121 3HE MET 121 13.655 -1.150 1.507 1057 HE2 MET 121 1HE MET 121 13.465 -2.900 1.411 1058 HE3 MET 121 2HE MET 121 12.469 -1.968 2.528 1059 H GLN 122 H GLN 122 12.563 3.650 -0.854 1060 HA GLN 122 HA GLN 122 14.559 4.923 0.760 1061 HB2 GLN 122 2HB GLN 122 13.681 5.551 -2.095 1062 HB3 GLN 122 3HB GLN 122 15.136 6.167 -1.322 1063 HG2 GLN 122 2HG GLN 122 14.565 3.257 -1.918 1064 HG3 GLN 122 3HG GLN 122 15.612 4.314 -2.864 1065 HE21 GLN 122 1HE2 GLN 122 17.621 4.919 -1.997 1066 HE22 GLN 122 2HE2 GLN 122 18.351 4.081 -0.674 1067 H LYS 123 H LYS 123 11.568 6.054 -0.837 1068 HA LYS 123 HA LYS 123 11.772 8.750 0.097 1069 HB2 LYS 123 2HB LYS 123 9.472 7.176 -1.110 1070 HB3 LYS 123 3HB LYS 123 9.244 8.815 -0.517 1071 HG2 LYS 123 2HG LYS 123 9.557 9.014 -2.850 1072 HG3 LYS 123 3HG LYS 123 11.081 9.537 -2.133 1073 HD2 LYS 123 2HD LYS 123 12.069 7.324 -2.638 1074 HD3 LYS 123 3HD LYS 123 10.531 6.795 -3.324 1075 HE2 LYS 123 2HE LYS 123 10.725 8.607 -5.040 1076 HE3 LYS 123 3HE LYS 123 12.323 8.997 -4.396 1077 HZ1 LYS 123 3HZ LYS 123 12.511 7.562 -6.303 1078 HZ2 LYS 123 1HZ LYS 123 11.503 6.405 -5.593 1079 HZ3 LYS 123 2HZ LYS 123 13.025 6.725 -4.928 1080 H ALA 124 H ALA 124 10.344 5.817 1.409 1081 HA ALA 124 HA ALA 124 8.979 7.006 3.618 1082 HB1 ALA 124 3HB ALA 124 10.053 4.187 3.254 1083 HB2 ALA 124 1HB ALA 124 8.432 4.759 2.856 1084 HB3 ALA 124 2HB ALA 124 8.956 4.706 4.540 1085 H GLY 125 H GLY 125 12.247 5.743 3.084 1086 HA2 GLY 125 2HA GLY 125 13.317 6.142 5.667 1087 HA3 GLY 125 3HA GLY 125 14.237 6.118 4.163 1088 H SER 126 H SER 126 12.915 8.309 2.903 1089 HA SER 126 HA SER 126 14.256 10.568 3.929 1090 HB2 SER 126 2HB SER 126 11.903 10.512 1.998 1091 HB3 SER 126 3HB SER 126 13.064 11.823 2.185 1092 HG SER 126 HG SER 126 14.570 9.797 1.695 1093 H LEU 127 H LEU 127 11.022 9.260 4.422 1094 HA LEU 127 HA LEU 127 9.935 11.566 5.773 1095 HB2 LEU 127 2HB LEU 127 8.937 8.704 5.647 1096 HB3 LEU 127 3HB LEU 127 8.045 10.036 6.365 1097 HG LEU 127 HG LEU 127 8.766 9.763 3.423 1098 HD11 LEU 127 1HD1 LEU 127 6.365 9.432 3.076 1099 HD12 LEU 127 2HD1 LEU 127 6.088 9.511 4.818 1100 HD13 LEU 127 3HD1 LEU 127 7.036 8.188 4.131 1101 HD21 LEU 127 3HD2 LEU 127 7.366 11.754 3.058 1102 HD22 LEU 127 1HD2 LEU 127 8.760 12.123 4.073 1103 HD23 LEU 127 2HD2 LEU 127 7.164 11.941 4.801 1104 H GLU 128 H GLU 128 11.838 8.816 6.722 1105 HA GLU 128 HA GLU 128 11.233 8.825 9.521 1106 HB2 GLU 128 2HB GLU 128 13.797 7.863 8.179 1107 HB3 GLU 128 3HB GLU 128 13.263 7.481 9.814 1108 HG2 GLU 128 2HG GLU 128 11.207 6.391 8.732 1109 HG3 GLU 128 3HG GLU 128 12.076 6.541 7.203 1110 H HIS 129 H HIS 129 14.032 10.109 7.678 1111 HA HIS 129 HA HIS 129 14.819 11.800 9.942 1112 HB2 HIS 129 2HB HIS 129 16.853 12.291 8.675 1113 HB3 HIS 129 3HB HIS 129 16.583 10.560 8.741 1114 HD1 HIS 129 HD1 HIS 129 16.567 9.322 6.539 1115 HD2 HIS 129 HD2 HIS 129 16.373 13.449 6.032 1116 HE1 HIS 129 HE1 HIS 129 16.912 9.731 4.084 1117 HE2 HIS 129 HE2 HIS 129 16.815 12.219 3.807 1118 H HIS 130 H HIS 130 12.380 12.221 8.125 1119 HA HIS 130 HA HIS 130 12.629 14.765 6.870 1120 HB2 HIS 130 2HB HIS 130 10.772 12.940 6.630 1121 HB3 HIS 130 3HB HIS 130 10.060 13.648 8.068 1122 HD1 HIS 130 HD1 HIS 130 8.156 15.072 7.400 1123 HD2 HIS 130 HD2 HIS 130 11.223 15.237 4.597 1124 HE1 HIS 130 HE1 HIS 130 7.302 16.532 5.544 1125 HE2 HIS 130 HE2 HIS 130 9.241 16.778 3.975 1126 H HIS 131 H HIS 131 13.334 16.463 8.068 1127 HA HIS 131 HA HIS 131 13.147 16.439 10.965 1128 HB2 HIS 131 2HB HIS 131 15.290 16.880 9.766 1129 HB3 HIS 131 3HB HIS 131 14.605 18.331 9.052 1130 HD1 HIS 131 HD1 HIS 131 14.663 20.450 10.434 1131 HD2 HIS 131 HD2 HIS 131 15.876 17.110 12.586 1132 HE1 HIS 131 HE1 HIS 131 15.650 21.339 12.557 1133 HE2 HIS 131 HE2 HIS 131 16.505 19.321 13.767 1134 H HIS 132 H HIS 132 10.677 16.769 10.596 1135 HA HIS 132 HA HIS 132 8.768 17.968 10.809 1136 HB2 HIS 132 2HB HIS 132 10.665 19.861 12.261 1137 HB3 HIS 132 3HB HIS 132 8.907 19.950 12.356 1138 HD1 HIS 132 HD1 HIS 132 11.582 18.766 14.295 1139 HD2 HIS 132 HD2 HIS 132 7.913 17.126 13.233 1140 HE1 HIS 132 HE1 HIS 132 11.132 16.972 15.988 1141 HE2 HIS 132 HE2 HIS 132 9.040 15.847 15.179 1142 H HIS 133 H HIS 133 10.437 18.524 8.397 1143 HA HIS 133 HA HIS 133 9.487 21.238 7.637 1144 HB2 HIS 133 2HB HIS 133 11.976 21.085 7.999 1145 HB3 HIS 133 3HB HIS 133 12.070 19.818 6.789 1146 HD1 HIS 133 HD1 HIS 133 12.817 23.211 7.121 1147 HD2 HIS 133 HD2 HIS 133 10.896 21.032 4.154 1148 HE1 HIS 133 HE1 HIS 133 12.990 24.602 5.038 1149 HE2 HIS 133 HE2 HIS 133 11.989 23.174 3.234 1150 H HIS 134 H HIS 134 7.926 21.017 6.111 1151 HA HIS 134 HA HIS 134 7.279 18.605 4.820 1152 HB2 HIS 134 2HB HIS 134 5.593 20.354 5.271 1153 HB3 HIS 134 3HB HIS 134 6.388 21.445 4.140 1154 HD1 HIS 134 HD1 HIS 134 4.425 18.212 4.208 1155 HD2 HIS 134 HD2 HIS 134 5.615 21.115 1.473 1156 HE1 HIS 134 HE1 HIS 134 3.250 17.650 2.070 1157 HE2 HIS 134 HE2 HIS 134 3.989 19.395 0.424 Start of MODEL 14 1 H1 MET 1 1H MET 1 1.207 8.714 14.432 2 H2 MET 1 2H MET 1 1.490 10.364 14.638 3 H3 MET 1 3H MET 1 2.705 9.246 14.984 4 HA MET 1 HA MET 1 1.535 9.577 12.302 5 HB2 MET 1 2HB MET 1 2.567 11.706 12.779 6 HB3 MET 1 3HB MET 1 3.931 10.947 13.590 7 HG2 MET 1 2HG MET 1 4.544 11.897 11.389 8 HG3 MET 1 3HG MET 1 4.818 10.154 11.462 9 HE1 MET 1 3HE MET 1 3.811 10.467 7.724 10 HE2 MET 1 1HE MET 1 4.923 9.728 8.875 11 HE3 MET 1 2HE MET 1 4.899 11.481 8.672 12 H LYS 2 H LYS 2 2.435 8.164 10.801 13 HA LYS 2 HA LYS 2 4.882 6.750 11.298 14 HB2 LYS 2 2HB LYS 2 4.034 4.480 11.274 15 HB3 LYS 2 3HB LYS 2 3.296 5.335 12.613 16 HG2 LYS 2 2HG LYS 2 1.754 5.244 10.044 17 HG3 LYS 2 3HG LYS 2 1.906 3.736 10.940 18 HD2 LYS 2 2HD LYS 2 0.840 6.320 12.135 19 HD3 LYS 2 3HD LYS 2 -0.175 5.052 11.445 20 HE2 LYS 2 2HE LYS 2 0.861 3.445 13.111 21 HE3 LYS 2 3HE LYS 2 1.623 4.845 13.874 22 HZ1 LYS 2 3HZ LYS 2 -0.434 5.699 14.496 23 HZ2 LYS 2 1HZ LYS 2 -0.559 4.049 14.819 24 HZ3 LYS 2 2HZ LYS 2 -1.297 4.700 13.446 25 H ILE 3 H ILE 3 5.094 4.973 9.472 26 HA ILE 3 HA ILE 3 4.378 6.262 6.896 27 HB ILE 3 HB ILE 3 6.760 4.479 7.607 28 HG12 ILE 3 2HG1 ILE 3 6.693 7.466 6.972 29 HG13 ILE 3 3HG1 ILE 3 6.892 6.779 8.580 30 HG21 ILE 3 1HG2 ILE 3 7.619 4.952 5.345 31 HG22 ILE 3 2HG2 ILE 3 6.162 5.871 4.971 32 HG23 ILE 3 3HG2 ILE 3 6.054 4.135 5.262 33 HD11 ILE 3 3HD1 ILE 3 9.000 5.764 7.868 34 HD12 ILE 3 1HD1 ILE 3 8.999 7.517 7.705 35 HD13 ILE 3 2HD1 ILE 3 8.808 6.503 6.277 36 H LEU 4 H LEU 4 2.950 5.113 5.676 37 HA LEU 4 HA LEU 4 2.818 2.157 5.945 38 HB2 LEU 4 2HB LEU 4 0.685 4.181 5.168 39 HB3 LEU 4 3HB LEU 4 0.547 2.499 4.690 40 HG LEU 4 HG LEU 4 0.557 1.823 7.102 41 HD11 LEU 4 1HD1 LEU 4 1.745 3.685 8.100 42 HD12 LEU 4 2HD1 LEU 4 0.162 3.499 8.851 43 HD13 LEU 4 3HD1 LEU 4 0.434 4.788 7.677 44 HD21 LEU 4 3HD2 LEU 4 -1.547 2.049 5.905 45 HD22 LEU 4 1HD2 LEU 4 -1.619 3.771 6.294 46 HD23 LEU 4 2HD2 LEU 4 -1.746 2.565 7.578 47 H ILE 5 H ILE 5 3.398 0.965 4.196 48 HA ILE 5 HA ILE 5 3.143 2.208 1.513 49 HB ILE 5 HB ILE 5 4.862 -0.239 2.196 50 HG12 ILE 5 2HG1 ILE 5 5.705 2.644 1.627 51 HG13 ILE 5 3HG1 ILE 5 5.941 1.764 3.129 52 HG21 ILE 5 1HG2 ILE 5 3.938 -0.287 -0.107 53 HG22 ILE 5 2HG2 ILE 5 5.682 -0.039 -0.139 54 HG23 ILE 5 3HG2 ILE 5 4.596 1.324 -0.414 55 HD11 ILE 5 3HD1 ILE 5 8.012 1.943 1.917 56 HD12 ILE 5 1HD1 ILE 5 7.293 1.189 0.493 57 HD13 ILE 5 2HD1 ILE 5 7.508 0.255 1.977 58 H LEU 6 H LEU 6 1.146 1.746 0.943 59 HA LEU 6 HA LEU 6 -0.246 -0.686 1.653 60 HB2 LEU 6 2HB LEU 6 -0.990 1.970 1.239 61 HB3 LEU 6 3HB LEU 6 -1.514 1.235 -0.257 62 HG LEU 6 HG LEU 6 -2.412 0.522 2.545 63 HD11 LEU 6 1HD1 LEU 6 -3.373 2.597 1.685 64 HD12 LEU 6 2HD1 LEU 6 -4.607 1.345 1.813 65 HD13 LEU 6 3HD1 LEU 6 -3.937 1.761 0.233 66 HD21 LEU 6 3HD2 LEU 6 -3.247 -0.805 -0.058 67 HD22 LEU 6 1HD2 LEU 6 -3.983 -1.088 1.524 68 HD23 LEU 6 2HD2 LEU 6 -2.305 -1.546 1.239 69 H ILE 7 H ILE 7 -0.495 -2.396 0.318 70 HA ILE 7 HA ILE 7 0.359 -2.243 -2.512 71 HB ILE 7 HB ILE 7 0.847 -4.544 -0.550 72 HG12 ILE 7 2HG1 ILE 7 2.442 -2.686 -0.219 73 HG13 ILE 7 3HG1 ILE 7 3.260 -4.084 -0.900 74 HG21 ILE 7 1HG2 ILE 7 1.524 -4.384 -3.515 75 HG22 ILE 7 2HG2 ILE 7 0.330 -5.450 -2.770 76 HG23 ILE 7 3HG2 ILE 7 2.045 -5.667 -2.421 77 HD11 ILE 7 3HD1 ILE 7 4.064 -2.022 -1.887 78 HD12 ILE 7 1HD1 ILE 7 2.432 -1.602 -2.406 79 HD13 ILE 7 2HD1 ILE 7 3.250 -3.000 -3.108 80 H ASN 8 H ASN 8 -1.313 -2.615 -3.761 81 HA ASN 8 HA ASN 8 -3.237 -4.762 -3.109 82 HB2 ASN 8 2HB ASN 8 -4.426 -2.644 -3.046 83 HB3 ASN 8 3HB ASN 8 -3.719 -2.131 -4.571 84 HD21 ASN 8 1HD2 ASN 8 -6.018 -4.358 -3.079 85 HD22 ASN 8 2HD2 ASN 8 -6.931 -4.663 -4.516 86 H THR 9 H THR 9 -2.399 -6.347 -4.156 87 HA THR 9 HA THR 9 -1.918 -6.119 -7.055 88 HB THR 9 HB THR 9 -0.361 -7.768 -5.034 89 HG1 THR 9 HG1 THR 9 1.207 -6.223 -6.449 90 HG21 THR 9 3HG2 THR 9 -0.578 -8.966 -7.162 91 HG22 THR 9 1HG2 THR 9 1.079 -8.427 -6.888 92 HG23 THR 9 2HG2 THR 9 0.043 -7.551 -8.016 93 H ASN 10 H ASN 10 -3.125 -7.505 -8.198 94 HA ASN 10 HA ASN 10 -5.107 -9.144 -6.903 95 HB2 ASN 10 2HB ASN 10 -5.520 -7.928 -9.045 96 HB3 ASN 10 3HB ASN 10 -4.371 -8.982 -9.860 97 HD21 ASN 10 1HD2 ASN 10 -5.905 -9.763 -11.308 98 HD22 ASN 10 2HD2 ASN 10 -7.194 -10.820 -10.846 99 H ASN 11 H ASN 11 -1.945 -9.697 -8.265 100 HA ASN 11 HA ASN 11 -2.249 -12.634 -8.070 101 HB2 ASN 11 2HB ASN 11 0.117 -12.619 -9.155 102 HB3 ASN 11 3HB ASN 11 -1.259 -12.225 -10.168 103 HD21 ASN 11 1HD2 ASN 11 1.728 -11.510 -10.134 104 HD22 ASN 11 2HD2 ASN 11 1.715 -9.811 -10.430 105 H ASP 12 H ASP 12 -2.059 -13.127 -5.982 106 HA ASP 12 HA ASP 12 -0.827 -11.536 -4.019 107 HB2 ASP 12 2HB ASP 12 -2.737 -13.070 -3.630 108 HB3 ASP 12 3HB ASP 12 -1.674 -14.454 -3.826 109 H GLU 13 H GLU 13 0.472 -14.198 -5.892 110 HA GLU 13 HA GLU 13 2.726 -14.894 -4.404 111 HB2 GLU 13 2HB GLU 13 3.740 -15.546 -6.630 112 HB3 GLU 13 3HB GLU 13 2.139 -16.212 -6.322 113 HG2 GLU 13 2HG GLU 13 1.111 -14.549 -7.787 114 HG3 GLU 13 3HG GLU 13 2.673 -13.769 -8.040 115 H LEU 14 H LEU 14 2.266 -12.167 -6.635 116 HA LEU 14 HA LEU 14 4.939 -11.171 -6.531 117 HB2 LEU 14 2HB LEU 14 3.481 -10.702 -8.415 118 HB3 LEU 14 3HB LEU 14 2.313 -9.911 -7.375 119 HG LEU 14 HG LEU 14 3.828 -8.017 -7.020 120 HD11 LEU 14 1HD1 LEU 14 5.976 -7.781 -8.168 121 HD12 LEU 14 2HD1 LEU 14 5.852 -9.433 -8.777 122 HD13 LEU 14 3HD1 LEU 14 5.996 -9.139 -7.043 123 HD21 LEU 14 3HD2 LEU 14 3.872 -7.091 -9.302 124 HD22 LEU 14 1HD2 LEU 14 2.349 -7.912 -8.961 125 HD23 LEU 14 2HD2 LEU 14 3.569 -8.696 -9.968 126 H ILE 15 H ILE 15 1.986 -10.565 -4.605 127 HA ILE 15 HA ILE 15 2.867 -8.365 -3.081 128 HB ILE 15 HB ILE 15 1.125 -10.653 -2.019 129 HG12 ILE 15 2HG1 ILE 15 0.279 -8.038 -3.337 130 HG13 ILE 15 3HG1 ILE 15 0.083 -9.648 -4.017 131 HG21 ILE 15 1HG2 ILE 15 2.106 -9.212 -0.246 132 HG22 ILE 15 2HG2 ILE 15 0.359 -9.043 -0.336 133 HG23 ILE 15 3HG2 ILE 15 1.395 -7.790 -1.016 134 HD11 ILE 15 3HD1 ILE 15 -1.484 -10.204 -2.206 135 HD12 ILE 15 1HD1 ILE 15 -2.014 -8.819 -3.160 136 HD13 ILE 15 2HD1 ILE 15 -1.305 -8.568 -1.565 137 H LYS 16 H LYS 16 3.258 -11.879 -2.599 138 HA LYS 16 HA LYS 16 4.471 -11.888 -0.086 139 HB2 LYS 16 2HB LYS 16 4.939 -13.847 -2.374 140 HB3 LYS 16 3HB LYS 16 5.347 -14.132 -0.685 141 HG2 LYS 16 2HG LYS 16 2.921 -13.964 -0.105 142 HG3 LYS 16 3HG LYS 16 2.560 -13.787 -1.826 143 HD2 LYS 16 2HD LYS 16 2.206 -16.116 -1.183 144 HD3 LYS 16 3HD LYS 16 3.607 -16.019 -2.251 145 HE2 LYS 16 2HE LYS 16 5.100 -16.114 -0.248 146 HE3 LYS 16 3HE LYS 16 3.676 -16.291 0.779 147 HZ1 LYS 16 3HZ LYS 16 4.545 -18.187 -1.340 148 HZ2 LYS 16 1HZ LYS 16 3.157 -18.352 -0.394 149 HZ3 LYS 16 2HZ LYS 16 4.680 -18.426 0.329 150 H LYS 17 H LYS 17 5.896 -11.528 -3.312 151 HA LYS 17 HA LYS 17 8.636 -11.581 -2.583 152 HB2 LYS 17 2HB LYS 17 7.318 -10.195 -4.961 153 HB3 LYS 17 3HB LYS 17 9.037 -10.556 -4.807 154 HG2 LYS 17 2HG LYS 17 8.530 -12.978 -4.782 155 HG3 LYS 17 3HG LYS 17 6.809 -12.613 -4.946 156 HD2 LYS 17 2HD LYS 17 7.746 -13.235 -7.125 157 HD3 LYS 17 3HD LYS 17 7.250 -11.542 -7.143 158 HE2 LYS 17 2HE LYS 17 9.568 -10.819 -6.889 159 HE3 LYS 17 3HE LYS 17 10.104 -12.493 -6.720 160 HZ1 LYS 17 3HZ LYS 17 10.505 -11.674 -8.941 161 HZ2 LYS 17 1HZ LYS 17 8.864 -11.308 -9.144 162 HZ3 LYS 17 2HZ LYS 17 9.362 -12.913 -8.979 163 H ILE 18 H ILE 18 6.334 -8.924 -3.026 164 HA ILE 18 HA ILE 18 8.005 -6.725 -2.460 165 HB ILE 18 HB ILE 18 4.999 -7.136 -2.157 166 HG12 ILE 18 2HG1 ILE 18 6.590 -5.678 -4.325 167 HG13 ILE 18 3HG1 ILE 18 5.957 -7.312 -4.477 168 HG21 ILE 18 1HG2 ILE 18 4.764 -4.668 -2.074 169 HG22 ILE 18 2HG2 ILE 18 6.516 -4.518 -1.951 170 HG23 ILE 18 3HG2 ILE 18 5.610 -5.310 -0.662 171 HD11 ILE 18 3HD1 ILE 18 4.549 -5.768 -5.652 172 HD12 ILE 18 1HD1 ILE 18 4.339 -4.782 -4.203 173 HD13 ILE 18 2HD1 ILE 18 3.671 -6.416 -4.267 174 H LYS 19 H LYS 19 6.133 -8.869 -0.341 175 HA LYS 19 HA LYS 19 6.403 -7.476 2.106 176 HB2 LYS 19 2HB LYS 19 5.991 -10.454 1.557 177 HB3 LYS 19 3HB LYS 19 5.865 -9.720 3.156 178 HG2 LYS 19 2HG LYS 19 3.952 -8.415 2.506 179 HG3 LYS 19 3HG LYS 19 4.164 -8.840 0.810 180 HD2 LYS 19 2HD LYS 19 2.285 -10.089 1.775 181 HD3 LYS 19 3HD LYS 19 3.582 -11.187 1.311 182 HE2 LYS 19 2HE LYS 19 4.289 -11.360 3.662 183 HE3 LYS 19 3HE LYS 19 3.023 -10.221 4.130 184 HZ1 LYS 19 3HZ LYS 19 1.367 -11.795 3.381 185 HZ2 LYS 19 1HZ LYS 19 2.367 -12.502 4.542 186 HZ3 LYS 19 2HZ LYS 19 2.565 -12.898 2.913 187 H LYS 20 H LYS 20 8.398 -9.946 0.503 188 HA LYS 20 HA LYS 20 10.334 -10.265 2.556 189 HB2 LYS 20 2HB LYS 20 10.716 -10.673 -0.452 190 HB3 LYS 20 3HB LYS 20 11.752 -11.313 0.821 191 HG2 LYS 20 2HG LYS 20 8.877 -12.086 0.280 192 HG3 LYS 20 3HG LYS 20 10.304 -13.063 -0.055 193 HD2 LYS 20 2HD LYS 20 10.756 -13.288 2.346 194 HD3 LYS 20 3HD LYS 20 9.406 -12.213 2.735 195 HE2 LYS 20 2HE LYS 20 8.805 -14.589 3.055 196 HE3 LYS 20 3HE LYS 20 7.820 -13.845 1.795 197 HZ1 LYS 20 3HZ LYS 20 8.529 -15.986 1.073 198 HZ2 LYS 20 1HZ LYS 20 10.146 -15.645 1.413 199 HZ3 LYS 20 2HZ LYS 20 9.359 -14.839 0.157 200 H GLU 21 H GLU 21 10.205 -8.229 -0.374 201 HA GLU 21 HA GLU 21 12.673 -7.023 -0.413 202 HB2 GLU 21 2HB GLU 21 9.946 -5.889 -1.145 203 HB3 GLU 21 3HB GLU 21 11.427 -4.987 -1.431 204 HG2 GLU 21 2HG GLU 21 10.759 -7.687 -2.619 205 HG3 GLU 21 3HG GLU 21 10.602 -6.137 -3.445 206 H VAL 22 H VAL 22 9.785 -5.833 1.280 207 HA VAL 22 HA VAL 22 11.111 -3.571 2.407 208 HB VAL 22 HB VAL 22 9.033 -3.166 3.643 209 HG11 VAL 22 1HG1 VAL 22 7.535 -2.872 1.715 210 HG12 VAL 22 2HG1 VAL 22 8.519 -3.990 0.766 211 HG13 VAL 22 3HG1 VAL 22 9.197 -2.449 1.300 212 HG21 VAL 22 3HG2 VAL 22 7.078 -4.674 3.422 213 HG22 VAL 22 1HG2 VAL 22 8.417 -5.450 4.275 214 HG23 VAL 22 2HG2 VAL 22 8.091 -5.857 2.590 215 H GLU 23 H GLU 23 10.383 -6.850 3.636 216 HA GLU 23 HA GLU 23 11.256 -6.364 6.325 217 HB2 GLU 23 2HB GLU 23 10.823 -8.928 4.761 218 HB3 GLU 23 3HB GLU 23 11.395 -8.934 6.430 219 HG2 GLU 23 2HG GLU 23 9.349 -7.792 7.169 220 HG3 GLU 23 3HG GLU 23 8.774 -7.707 5.503 221 H ASN 24 H ASN 24 13.067 -7.089 3.384 222 HA ASN 24 HA ASN 24 15.536 -7.722 4.612 223 HB2 ASN 24 2HB ASN 24 14.982 -6.320 1.964 224 HB3 ASN 24 3HB ASN 24 16.603 -6.727 2.498 225 HD21 ASN 24 1HD2 ASN 24 13.813 -7.889 0.946 226 HD22 ASN 24 2HD2 ASN 24 14.342 -9.511 0.731 227 H GLN 25 H GLN 25 13.820 -4.709 4.268 228 HA GLN 25 HA GLN 25 16.002 -3.252 5.658 229 HB2 GLN 25 2HB GLN 25 13.704 -2.179 3.970 230 HB3 GLN 25 3HB GLN 25 14.847 -1.174 4.851 231 HG2 GLN 25 2HG GLN 25 15.577 -3.074 2.603 232 HG3 GLN 25 3HG GLN 25 15.374 -1.333 2.438 233 HE21 GLN 25 1HE2 GLN 25 17.448 -3.864 3.645 234 HE22 GLN 25 2HE2 GLN 25 18.820 -2.865 3.959 235 H GLY 26 H GLY 26 13.689 -5.063 6.638 236 HA2 GLY 26 2HA GLY 26 12.875 -5.336 8.738 237 HA3 GLY 26 3HA GLY 26 13.698 -3.861 9.197 238 H TYR 27 H TYR 27 11.191 -3.916 6.698 239 HA TYR 27 HA TYR 27 9.450 -2.204 8.249 240 HB2 TYR 27 2HB TYR 27 9.100 -3.518 5.538 241 HB3 TYR 27 3HB TYR 27 7.823 -2.578 6.296 242 HD1 TYR 27 HD1 TYR 27 11.529 -2.076 5.678 243 HD2 TYR 27 HD2 TYR 27 7.580 -0.468 5.347 244 HE1 TYR 27 HE1 TYR 27 12.448 -0.050 4.635 245 HE2 TYR 27 HE2 TYR 27 8.499 1.565 4.318 246 HH TYR 27 HH TYR 27 11.741 1.768 3.209 247 H GLN 28 H GLN 28 7.614 -2.737 9.279 248 HA GLN 28 HA GLN 28 7.070 -5.497 9.977 249 HB2 GLN 28 2HB GLN 28 6.948 -3.668 11.660 250 HB3 GLN 28 3HB GLN 28 5.686 -2.878 10.724 251 HG2 GLN 28 2HG GLN 28 4.706 -4.024 12.618 252 HG3 GLN 28 3HG GLN 28 4.188 -4.798 11.133 253 HE21 GLN 28 1HE2 GLN 28 6.173 -5.108 13.980 254 HE22 GLN 28 2HE2 GLN 28 6.408 -6.813 13.877 255 H VAL 29 H VAL 29 5.687 -6.760 8.748 256 HA VAL 29 HA VAL 29 3.969 -5.429 6.727 257 HB VAL 29 HB VAL 29 4.784 -8.374 6.860 258 HG11 VAL 29 1HG1 VAL 29 2.621 -8.051 5.717 259 HG12 VAL 29 2HG1 VAL 29 3.873 -8.507 4.561 260 HG13 VAL 29 3HG1 VAL 29 3.344 -6.827 4.667 261 HG21 VAL 29 3HG2 VAL 29 6.725 -6.929 6.394 262 HG22 VAL 29 1HG2 VAL 29 5.844 -6.144 5.079 263 HG23 VAL 29 2HG2 VAL 29 6.282 -7.851 4.954 264 H ARG 30 H ARG 30 1.812 -5.578 6.783 265 HA ARG 30 HA ARG 30 0.444 -7.261 8.777 266 HB2 ARG 30 2HB ARG 30 0.823 -4.985 9.684 267 HB3 ARG 30 3HB ARG 30 0.016 -4.278 8.290 268 HG2 ARG 30 2HG ARG 30 -2.114 -5.022 8.991 269 HG3 ARG 30 3HG ARG 30 -1.436 -6.226 10.095 270 HD2 ARG 30 2HD ARG 30 -1.230 -3.226 10.438 271 HD3 ARG 30 3HD ARG 30 -2.354 -4.273 11.303 272 HE ARG 30 HE ARG 30 0.588 -4.220 11.627 273 HH11 ARG 30 1HH1 ARG 30 -2.537 -5.256 12.860 274 HH12 ARG 30 2HH1 ARG 30 -1.893 -5.805 14.373 275 HH21 ARG 30 1HH2 ARG 30 1.426 -5.037 13.569 276 HH22 ARG 30 2HH2 ARG 30 0.355 -5.683 14.773 277 H ASP 31 H ASP 31 -1.007 -8.445 7.713 278 HA ASP 31 HA ASP 31 -1.707 -7.779 4.927 279 HB2 ASP 31 2HB ASP 31 -1.621 -10.422 6.447 280 HB3 ASP 31 3HB ASP 31 -2.384 -10.282 4.866 281 H VAL 32 H VAL 32 -3.743 -7.584 4.239 282 HA VAL 32 HA VAL 32 -6.028 -8.130 6.039 283 HB VAL 32 HB VAL 32 -5.762 -5.753 4.120 284 HG11 VAL 32 1HG1 VAL 32 -7.965 -5.035 4.991 285 HG12 VAL 32 2HG1 VAL 32 -8.079 -6.517 5.942 286 HG13 VAL 32 3HG1 VAL 32 -8.064 -6.599 4.178 287 HG21 VAL 32 3HG2 VAL 32 -5.840 -4.318 6.136 288 HG22 VAL 32 1HG2 VAL 32 -4.435 -5.387 6.157 289 HG23 VAL 32 2HG2 VAL 32 -5.836 -5.753 7.166 290 H ASN 33 H ASN 33 -7.068 -9.801 5.145 291 HA ASN 33 HA ASN 33 -7.134 -10.178 2.204 292 HB2 ASN 33 2HB ASN 33 -7.862 -12.149 4.427 293 HB3 ASN 33 3HB ASN 33 -7.823 -12.516 2.704 294 HD21 ASN 33 1HD2 ASN 33 -6.343 -13.636 5.047 295 HD22 ASN 33 2HD2 ASN 33 -4.673 -13.538 4.615 296 H ASP 34 H ASP 34 -9.057 -9.202 4.892 297 HA ASP 34 HA ASP 34 -11.544 -9.272 3.340 298 HB2 ASP 34 2HB ASP 34 -11.464 -11.458 4.485 299 HB3 ASP 34 3HB ASP 34 -11.223 -10.661 6.034 300 H SER 35 H SER 35 -13.293 -8.092 4.324 301 HA SER 35 HA SER 35 -12.717 -5.517 5.143 302 HB2 SER 35 2HB SER 35 -15.330 -7.049 5.491 303 HB3 SER 35 3HB SER 35 -15.151 -5.293 5.466 304 HG SER 35 HG SER 35 -14.820 -5.320 3.357 305 H ASP 36 H ASP 36 -13.481 -8.347 7.120 306 HA ASP 36 HA ASP 36 -13.892 -7.172 9.636 307 HB2 ASP 36 2HB ASP 36 -14.398 -9.539 9.232 308 HB3 ASP 36 3HB ASP 36 -12.708 -9.893 8.898 309 H GLU 37 H GLU 37 -10.947 -8.443 8.114 310 HA GLU 37 HA GLU 37 -9.173 -7.740 10.216 311 HB2 GLU 37 2HB GLU 37 -8.605 -8.332 7.279 312 HB3 GLU 37 3HB GLU 37 -7.378 -8.212 8.538 313 HG2 GLU 37 2HG GLU 37 -8.360 -10.147 9.715 314 HG3 GLU 37 3HG GLU 37 -9.632 -10.254 8.498 315 H LEU 38 H LEU 38 -10.337 -6.038 7.330 316 HA LEU 38 HA LEU 38 -8.575 -3.885 7.198 317 HB2 LEU 38 2HB LEU 38 -10.338 -4.281 5.511 318 HB3 LEU 38 3HB LEU 38 -11.576 -3.894 6.696 319 HG LEU 38 HG LEU 38 -10.578 -1.540 6.830 320 HD11 LEU 38 1HD1 LEU 38 -9.040 -2.418 4.380 321 HD12 LEU 38 2HD1 LEU 38 -8.366 -1.991 5.957 322 HD13 LEU 38 3HD1 LEU 38 -9.175 -0.764 4.987 323 HD21 LEU 38 3HD2 LEU 38 -12.641 -1.941 5.610 324 HD22 LEU 38 1HD2 LEU 38 -11.737 -2.405 4.166 325 HD23 LEU 38 2HD2 LEU 38 -11.660 -0.745 4.765 326 H LYS 39 H LYS 39 -11.723 -3.996 8.937 327 HA LYS 39 HA LYS 39 -11.403 -1.464 10.147 328 HB2 LYS 39 2HB LYS 39 -13.405 -2.034 11.496 329 HB3 LYS 39 3HB LYS 39 -13.619 -2.345 9.785 330 HG2 LYS 39 2HG LYS 39 -14.641 -4.205 10.677 331 HG3 LYS 39 3HG LYS 39 -13.008 -4.828 10.444 332 HD2 LYS 39 2HD LYS 39 -12.515 -4.410 12.842 333 HD3 LYS 39 3HD LYS 39 -14.146 -3.772 13.064 334 HE2 LYS 39 2HE LYS 39 -15.082 -5.979 12.464 335 HE3 LYS 39 3HE LYS 39 -13.448 -6.614 12.251 336 HZ1 LYS 39 3HZ LYS 39 -13.019 -6.188 14.591 337 HZ2 LYS 39 1HZ LYS 39 -14.364 -7.194 14.403 338 HZ3 LYS 39 2HZ LYS 39 -14.577 -5.565 14.790 339 H LYS 40 H LYS 40 -10.536 -4.723 11.259 340 HA LYS 40 HA LYS 40 -9.822 -4.119 13.912 341 HB2 LYS 40 2HB LYS 40 -8.614 -6.178 12.049 342 HB3 LYS 40 3HB LYS 40 -8.273 -6.077 13.773 343 HG2 LYS 40 2HG LYS 40 -10.823 -6.332 14.100 344 HG3 LYS 40 3HG LYS 40 -10.854 -6.849 12.418 345 HD2 LYS 40 2HD LYS 40 -9.240 -8.137 14.635 346 HD3 LYS 40 3HD LYS 40 -10.773 -8.743 14.018 347 HE2 LYS 40 2HE LYS 40 -9.119 -10.096 12.987 348 HE3 LYS 40 3HE LYS 40 -9.598 -8.955 11.734 349 HZ1 LYS 40 3HZ LYS 40 -7.173 -8.706 13.440 350 HZ2 LYS 40 1HZ LYS 40 -7.589 -7.688 12.157 351 HZ3 LYS 40 2HZ LYS 40 -7.186 -9.302 11.863 352 H GLU 41 H GLU 41 -7.749 -4.092 10.959 353 HA GLU 41 HA GLU 41 -5.411 -3.314 12.419 354 HB2 GLU 41 2HB GLU 41 -5.750 -3.121 9.395 355 HB3 GLU 41 3HB GLU 41 -4.246 -3.218 10.299 356 HG2 GLU 41 2HG GLU 41 -6.217 -5.396 9.664 357 HG3 GLU 41 3HG GLU 41 -4.489 -5.360 9.378 358 H MET 42 H MET 42 -7.960 -1.551 10.745 359 HA MET 42 HA MET 42 -6.669 0.991 10.661 360 HB2 MET 42 2HB MET 42 -9.609 0.220 10.598 361 HB3 MET 42 3HB MET 42 -9.078 1.900 10.519 362 HG2 MET 42 2HG MET 42 -8.467 -0.296 8.531 363 HG3 MET 42 3HG MET 42 -9.496 1.113 8.280 364 HE1 MET 42 3HE MET 42 -8.525 3.630 8.097 365 HE2 MET 42 1HE MET 42 -6.810 4.018 8.230 366 HE3 MET 42 2HE MET 42 -7.696 3.455 9.646 367 H LYS 43 H LYS 43 -8.641 -0.674 13.124 368 HA LYS 43 HA LYS 43 -8.662 1.434 15.016 369 HB2 LYS 43 2HB LYS 43 -9.222 -1.477 15.098 370 HB3 LYS 43 3HB LYS 43 -8.531 -0.882 16.593 371 HG2 LYS 43 2HG LYS 43 -10.824 -0.767 16.972 372 HG3 LYS 43 3HG LYS 43 -10.407 0.893 16.567 373 HD2 LYS 43 2HD LYS 43 -11.561 -1.062 14.543 374 HD3 LYS 43 3HD LYS 43 -12.572 -0.049 15.568 375 HE2 LYS 43 2HE LYS 43 -11.547 1.967 14.571 376 HE3 LYS 43 3HE LYS 43 -10.556 0.943 13.528 377 HZ1 LYS 43 3HZ LYS 43 -12.573 0.075 12.525 378 HZ2 LYS 43 1HZ LYS 43 -12.523 1.758 12.384 379 HZ3 LYS 43 2HZ LYS 43 -13.527 1.034 13.537 380 H LYS 44 H LYS 44 -6.246 -1.134 14.341 381 HA LYS 44 HA LYS 44 -4.450 -0.562 16.434 382 HB2 LYS 44 2HB LYS 44 -3.853 -1.651 13.651 383 HB3 LYS 44 3HB LYS 44 -2.693 -1.639 14.967 384 HG2 LYS 44 2HG LYS 44 -5.335 -3.072 15.282 385 HG3 LYS 44 3HG LYS 44 -4.007 -3.824 14.406 386 HD2 LYS 44 2HD LYS 44 -3.918 -4.667 16.645 387 HD3 LYS 44 3HD LYS 44 -2.575 -3.542 16.476 388 HE2 LYS 44 2HE LYS 44 -3.676 -3.313 18.668 389 HE3 LYS 44 3HE LYS 44 -3.844 -1.836 17.724 390 HZ1 LYS 44 3HZ LYS 44 -6.092 -2.348 17.262 391 HZ2 LYS 44 1HZ LYS 44 -5.882 -2.588 18.917 392 HZ3 LYS 44 2HZ LYS 44 -5.956 -3.918 17.874 393 H LEU 45 H LEU 45 -4.775 0.884 13.221 394 HA LEU 45 HA LEU 45 -2.403 2.512 13.350 395 HB2 LEU 45 2HB LEU 45 -4.817 2.672 11.502 396 HB3 LEU 45 3HB LEU 45 -3.304 3.534 11.255 397 HG LEU 45 HG LEU 45 -3.598 0.502 11.251 398 HD11 LEU 45 1HD1 LEU 45 -3.245 0.599 8.835 399 HD12 LEU 45 2HD1 LEU 45 -3.235 2.363 8.892 400 HD13 LEU 45 3HD1 LEU 45 -4.703 1.474 9.306 401 HD21 LEU 45 3HD2 LEU 45 -1.292 0.441 10.412 402 HD22 LEU 45 1HD2 LEU 45 -1.373 1.193 12.006 403 HD23 LEU 45 2HD2 LEU 45 -1.176 2.196 10.567 404 H ALA 46 H ALA 46 -5.734 2.926 14.330 405 HA ALA 46 HA ALA 46 -5.576 5.823 14.670 406 HB1 ALA 46 3HB ALA 46 -7.915 5.646 15.396 407 HB2 ALA 46 1HB ALA 46 -7.795 3.880 15.408 408 HB3 ALA 46 2HB ALA 46 -7.661 4.766 13.889 409 H GLU 47 H GLU 47 -5.540 2.953 16.755 410 HA GLU 47 HA GLU 47 -5.805 4.381 19.255 411 HB2 GLU 47 2HB GLU 47 -5.034 1.475 18.707 412 HB3 GLU 47 3HB GLU 47 -5.360 2.143 20.303 413 HG2 GLU 47 2HG GLU 47 -7.696 2.542 19.716 414 HG3 GLU 47 3HG GLU 47 -7.397 2.029 18.056 415 H GLU 48 H GLU 48 -3.227 2.391 17.780 416 HA GLU 48 HA GLU 48 -1.157 3.395 19.509 417 HB2 GLU 48 2HB GLU 48 -0.762 1.906 16.866 418 HB3 GLU 48 3HB GLU 48 0.378 2.039 18.198 419 HG2 GLU 48 2HG GLU 48 -2.209 0.472 18.158 420 HG3 GLU 48 3HG GLU 48 -0.572 -0.183 18.180 421 H LYS 49 H LYS 49 -0.050 5.237 19.234 422 HA LYS 49 HA LYS 49 -0.343 6.777 16.714 423 HB2 LYS 49 2HB LYS 49 -1.164 7.722 18.943 424 HB3 LYS 49 3HB LYS 49 0.511 7.782 19.474 425 HG2 LYS 49 2HG LYS 49 1.035 9.409 17.709 426 HG3 LYS 49 3HG LYS 49 -0.617 9.287 17.088 427 HD2 LYS 49 2HD LYS 49 -1.470 10.155 19.274 428 HD3 LYS 49 3HD LYS 49 0.195 10.336 19.828 429 HE2 LYS 49 2HE LYS 49 0.613 11.988 18.054 430 HE3 LYS 49 3HE LYS 49 -1.035 11.778 17.457 431 HZ1 LYS 49 3HZ LYS 49 -0.827 13.744 18.838 432 HZ2 LYS 49 1HZ LYS 49 -0.295 12.809 20.145 433 HZ3 LYS 49 2HZ LYS 49 -1.868 12.626 19.558 434 H ASN 50 H ASN 50 1.715 4.698 18.107 435 HA ASN 50 HA ASN 50 4.284 5.779 18.139 436 HB2 ASN 50 2HB ASN 50 3.694 3.648 19.195 437 HB3 ASN 50 3HB ASN 50 3.311 2.937 17.630 438 HD21 ASN 50 1HD2 ASN 50 4.751 1.280 17.876 439 HD22 ASN 50 2HD2 ASN 50 6.467 1.490 17.825 440 H PHE 51 H PHE 51 5.878 6.025 16.649 441 HA PHE 51 HA PHE 51 5.285 6.033 13.828 442 HB2 PHE 51 2HB PHE 51 6.731 7.750 15.006 443 HB3 PHE 51 3HB PHE 51 7.962 6.516 15.212 444 HD1 PHE 51 HD2 PHE 51 6.183 8.631 12.736 445 HD2 PHE 51 HD1 PHE 51 9.418 5.891 13.344 446 HE1 PHE 51 HE2 PHE 51 7.131 9.256 10.554 447 HE2 PHE 51 HE1 PHE 51 10.358 6.527 11.158 448 HZ PHE 51 HZ PHE 51 9.218 8.208 9.767 449 H GLU 52 H GLU 52 5.548 4.360 12.494 450 HA GLU 52 HA GLU 52 7.676 2.441 12.678 451 HB2 GLU 52 2HB GLU 52 6.060 1.511 14.347 452 HB3 GLU 52 3HB GLU 52 4.808 1.471 13.110 453 HG2 GLU 52 2HG GLU 52 5.749 -0.764 13.481 454 HG3 GLU 52 3HG GLU 52 6.080 -0.205 11.844 455 H LYS 53 H LYS 53 8.091 1.564 10.681 456 HA LYS 53 HA LYS 53 6.473 2.504 8.422 457 HB2 LYS 53 2HB LYS 53 9.095 0.954 8.364 458 HB3 LYS 53 3HB LYS 53 8.314 1.763 7.008 459 HG2 LYS 53 2HG LYS 53 8.643 3.948 8.169 460 HG3 LYS 53 3HG LYS 53 9.515 3.107 9.448 461 HD2 LYS 53 2HD LYS 53 10.335 3.301 6.523 462 HD3 LYS 53 3HD LYS 53 11.093 4.132 7.884 463 HE2 LYS 53 2HE LYS 53 11.047 1.131 7.420 464 HE3 LYS 53 3HE LYS 53 12.430 2.200 7.209 465 HZ1 LYS 53 3HZ LYS 53 11.066 1.617 9.782 466 HZ2 LYS 53 1HZ LYS 53 12.367 2.677 9.578 467 HZ3 LYS 53 2HZ LYS 53 12.574 1.026 9.283 468 H ILE 54 H ILE 54 4.686 1.275 8.363 469 HA ILE 54 HA ILE 54 4.873 -1.664 8.487 470 HB ILE 54 HB ILE 54 2.389 0.101 8.808 471 HG12 ILE 54 2HG1 ILE 54 4.065 -1.355 10.912 472 HG13 ILE 54 3HG1 ILE 54 3.923 0.387 10.724 473 HG21 ILE 54 1HG2 ILE 54 1.252 -1.977 9.549 474 HG22 ILE 54 2HG2 ILE 54 2.720 -2.901 9.226 475 HG23 ILE 54 3HG2 ILE 54 1.849 -2.138 7.895 476 HD11 ILE 54 3HD1 ILE 54 2.622 -0.362 12.595 477 HD12 ILE 54 1HD1 ILE 54 1.739 -1.505 11.584 478 HD13 ILE 54 2HD1 ILE 54 1.539 0.233 11.334 479 H LEU 55 H LEU 55 4.821 -2.700 6.580 480 HA LEU 55 HA LEU 55 3.686 -1.570 4.163 481 HB2 LEU 55 2HB LEU 55 5.633 -3.157 4.122 482 HB3 LEU 55 3HB LEU 55 4.602 -4.421 4.766 483 HG LEU 55 HG LEU 55 3.128 -3.871 2.574 484 HD11 LEU 55 1HD1 LEU 55 5.871 -2.952 1.729 485 HD12 LEU 55 2HD1 LEU 55 4.395 -1.991 1.802 486 HD13 LEU 55 3HD1 LEU 55 4.530 -3.303 0.638 487 HD21 LEU 55 3HD2 LEU 55 4.240 -5.653 1.336 488 HD22 LEU 55 1HD2 LEU 55 4.099 -6.069 3.044 489 HD23 LEU 55 2HD2 LEU 55 5.648 -5.538 2.393 490 H ILE 56 H ILE 56 1.480 -1.392 4.157 491 HA ILE 56 HA ILE 56 -0.216 -3.417 5.432 492 HB ILE 56 HB ILE 56 -0.991 -0.863 3.935 493 HG12 ILE 56 2HG1 ILE 56 0.169 -0.431 6.118 494 HG13 ILE 56 3HG1 ILE 56 -1.510 0.102 6.125 495 HG21 ILE 56 1HG2 ILE 56 -2.784 -2.532 3.773 496 HG22 ILE 56 2HG2 ILE 56 -3.273 -1.237 4.866 497 HG23 ILE 56 3HG2 ILE 56 -2.743 -2.788 5.520 498 HD11 ILE 56 3HD1 ILE 56 -2.146 -1.853 7.429 499 HD12 ILE 56 1HD1 ILE 56 -0.861 -0.948 8.230 500 HD13 ILE 56 2HD1 ILE 56 -0.484 -2.445 7.378 501 H LYS 57 H LYS 57 -0.501 -5.212 4.245 502 HA LYS 57 HA LYS 57 -0.895 -5.144 1.344 503 HB2 LYS 57 2HB LYS 57 0.446 -6.963 2.273 504 HB3 LYS 57 3HB LYS 57 -0.799 -7.374 3.435 505 HG2 LYS 57 2HG LYS 57 -1.352 -7.632 0.478 506 HG3 LYS 57 3HG LYS 57 -0.418 -8.866 1.318 507 HD2 LYS 57 2HD LYS 57 -2.400 -9.084 2.932 508 HD3 LYS 57 3HD LYS 57 -3.315 -8.076 1.806 509 HE2 LYS 57 2HE LYS 57 -3.770 -10.438 1.387 510 HE3 LYS 57 3HE LYS 57 -2.902 -9.748 0.015 511 HZ1 LYS 57 3HZ LYS 57 -1.670 -11.358 2.195 512 HZ2 LYS 57 1HZ LYS 57 -0.861 -10.724 0.853 513 HZ3 LYS 57 2HZ LYS 57 -2.032 -11.919 0.639 514 H SER 58 H SER 58 -2.892 -5.157 0.452 515 HA SER 58 HA SER 58 -5.186 -6.249 1.879 516 HB2 SER 58 2HB SER 58 -5.215 -3.826 2.477 517 HB3 SER 58 3HB SER 58 -5.212 -3.407 0.765 518 HG SER 58 HG SER 58 -7.301 -3.462 1.076 519 H ASN 59 H ASN 59 -6.089 -7.593 0.510 520 HA ASN 59 HA ASN 59 -5.182 -7.852 -2.188 521 HB2 ASN 59 2HB ASN 59 -5.663 -9.813 -0.774 522 HB3 ASN 59 3HB ASN 59 -7.351 -9.341 -0.643 523 HD21 ASN 59 1HD2 ASN 59 -8.747 -9.794 -2.350 524 HD22 ASN 59 2HD2 ASN 59 -8.301 -10.781 -3.699 525 H ASP 60 H ASP 60 -8.217 -6.801 -0.686 526 HA ASP 60 HA ASP 60 -9.522 -6.578 -3.313 527 HB2 ASP 60 2HB ASP 60 -10.655 -6.488 -0.490 528 HB3 ASP 60 3HB ASP 60 -11.618 -6.259 -1.946 529 H LYS 61 H LYS 61 -9.856 -4.737 -4.270 530 HA LYS 61 HA LYS 61 -8.613 -2.313 -3.632 531 HB2 LYS 61 2HB LYS 61 -9.791 -1.451 -5.636 532 HB3 LYS 61 3HB LYS 61 -9.131 -3.063 -5.915 533 HG2 LYS 61 2HG LYS 61 -11.444 -3.977 -5.341 534 HG3 LYS 61 3HG LYS 61 -12.026 -2.314 -5.426 535 HD2 LYS 61 2HD LYS 61 -11.302 -2.193 -7.791 536 HD3 LYS 61 3HD LYS 61 -10.700 -3.851 -7.692 537 HE2 LYS 61 2HE LYS 61 -13.007 -4.636 -7.199 538 HE3 LYS 61 3HE LYS 61 -13.592 -2.978 -7.355 539 HZ1 LYS 61 3HZ LYS 61 -12.272 -4.533 -9.510 540 HZ2 LYS 61 1HZ LYS 61 -12.908 -2.977 -9.659 541 HZ3 LYS 61 2HZ LYS 61 -13.930 -4.289 -9.369 542 H GLN 62 H GLN 62 -11.884 -3.413 -2.922 543 HA GLN 62 HA GLN 62 -13.222 -1.008 -2.331 544 HB2 GLN 62 2HB GLN 62 -13.487 -3.779 -1.095 545 HB3 GLN 62 3HB GLN 62 -14.583 -2.452 -0.714 546 HG2 GLN 62 2HG GLN 62 -15.437 -2.398 -2.948 547 HG3 GLN 62 3HG GLN 62 -14.182 -3.490 -3.527 548 HE21 GLN 62 1HE2 GLN 62 -15.888 -4.008 -0.475 549 HE22 GLN 62 2HE2 GLN 62 -16.741 -5.412 -0.995 550 H LEU 63 H LEU 63 -11.224 -3.132 -0.385 551 HA LEU 63 HA LEU 63 -11.611 -2.005 2.142 552 HB2 LEU 63 2HB LEU 63 -9.146 -3.517 1.192 553 HB3 LEU 63 3HB LEU 63 -9.693 -3.342 2.853 554 HG LEU 63 HG LEU 63 -11.071 -4.936 0.660 555 HD11 LEU 63 1HD1 LEU 63 -9.672 -5.887 3.175 556 HD12 LEU 63 2HD1 LEU 63 -9.071 -6.037 1.523 557 HD13 LEU 63 3HD1 LEU 63 -10.522 -6.909 2.010 558 HD21 LEU 63 3HD2 LEU 63 -12.668 -5.673 2.395 559 HD22 LEU 63 1HD2 LEU 63 -12.779 -3.943 2.071 560 HD23 LEU 63 2HD2 LEU 63 -11.964 -4.517 3.527 561 H LEU 64 H LEU 64 -9.286 -1.294 -0.408 562 HA LEU 64 HA LEU 64 -7.537 0.396 1.058 563 HB2 LEU 64 2HB LEU 64 -8.086 0.117 -1.909 564 HB3 LEU 64 3HB LEU 64 -6.972 1.326 -1.287 565 HG LEU 64 HG LEU 64 -5.709 -0.625 -0.169 566 HD11 LEU 64 1HD1 LEU 64 -5.916 -2.822 -1.203 567 HD12 LEU 64 2HD1 LEU 64 -7.296 -2.265 -2.153 568 HD13 LEU 64 3HD1 LEU 64 -7.415 -2.360 -0.395 569 HD21 LEU 64 3HD2 LEU 64 -5.745 -0.460 -3.178 570 HD22 LEU 64 1HD2 LEU 64 -4.419 -1.032 -2.159 571 HD23 LEU 64 2HD2 LEU 64 -4.915 0.658 -2.090 572 H LYS 65 H LYS 65 -10.327 1.102 -1.080 573 HA LYS 65 HA LYS 65 -10.229 3.890 -1.014 574 HB2 LYS 65 2HB LYS 65 -12.658 2.049 -1.216 575 HB3 LYS 65 3HB LYS 65 -12.706 3.785 -1.521 576 HG2 LYS 65 2HG LYS 65 -11.108 3.503 -3.388 577 HG3 LYS 65 3HG LYS 65 -11.075 1.760 -3.093 578 HD2 LYS 65 2HD LYS 65 -13.466 1.601 -3.628 579 HD3 LYS 65 3HD LYS 65 -13.564 3.348 -3.843 580 HE2 LYS 65 2HE LYS 65 -11.881 1.480 -5.548 581 HE3 LYS 65 3HE LYS 65 -13.472 2.099 -5.992 582 HZ1 LYS 65 3HZ LYS 65 -11.039 3.733 -5.514 583 HZ2 LYS 65 1HZ LYS 65 -12.566 4.347 -5.910 584 HZ3 LYS 65 2HZ LYS 65 -11.725 3.387 -7.018 585 H GLU 66 H GLU 66 -12.090 1.664 1.029 586 HA GLU 66 HA GLU 66 -13.252 3.489 2.821 587 HB2 GLU 66 2HB GLU 66 -12.462 0.591 3.346 588 HB3 GLU 66 3HB GLU 66 -13.672 1.512 4.237 589 HG2 GLU 66 2HG GLU 66 -15.088 1.630 2.233 590 HG3 GLU 66 3HG GLU 66 -13.860 0.785 1.298 591 H MET 67 H MET 67 -10.184 1.749 2.930 592 HA MET 67 HA MET 67 -9.321 2.332 5.541 593 HB2 MET 67 2HB MET 67 -8.321 0.598 3.990 594 HB3 MET 67 3HB MET 67 -7.592 1.891 3.057 595 HG2 MET 67 2HG MET 67 -6.391 2.551 5.216 596 HG3 MET 67 3HG MET 67 -6.934 1.008 5.863 597 HE1 MET 67 3HE MET 67 -6.743 -0.797 3.088 598 HE2 MET 67 1HE MET 67 -6.265 -1.372 4.688 599 HE3 MET 67 2HE MET 67 -5.139 -1.488 3.339 600 H LEU 68 H LEU 68 -8.661 3.926 2.435 601 HA LEU 68 HA LEU 68 -6.837 5.853 3.474 602 HB2 LEU 68 2HB LEU 68 -8.170 5.474 0.777 603 HB3 LEU 68 3HB LEU 68 -7.092 6.827 1.087 604 HG LEU 68 HG LEU 68 -6.196 3.950 1.528 605 HD11 LEU 68 1HD1 LEU 68 -5.124 3.970 -0.673 606 HD12 LEU 68 2HD1 LEU 68 -5.864 5.533 -1.034 607 HD13 LEU 68 3HD1 LEU 68 -6.878 4.107 -0.808 608 HD21 LEU 68 3HD2 LEU 68 -4.610 6.502 1.088 609 HD22 LEU 68 1HD2 LEU 68 -3.935 4.886 1.313 610 HD23 LEU 68 2HD2 LEU 68 -4.826 5.655 2.623 611 H GLU 69 H GLU 69 -10.294 5.890 2.822 612 HA GLU 69 HA GLU 69 -10.774 8.678 3.115 613 HB2 GLU 69 2HB GLU 69 -12.559 6.267 3.644 614 HB3 GLU 69 3HB GLU 69 -13.136 7.932 3.701 615 HG2 GLU 69 2HG GLU 69 -12.618 8.250 1.341 616 HG3 GLU 69 3HG GLU 69 -11.880 6.652 1.255 617 H LEU 70 H LEU 70 -10.417 6.064 5.465 618 HA LEU 70 HA LEU 70 -10.993 7.720 7.779 619 HB2 LEU 70 2HB LEU 70 -9.791 4.931 7.595 620 HB3 LEU 70 3HB LEU 70 -10.362 5.697 9.070 621 HG LEU 70 HG LEU 70 -12.125 4.949 6.698 622 HD11 LEU 70 1HD1 LEU 70 -11.876 3.590 9.399 623 HD12 LEU 70 2HD1 LEU 70 -11.280 2.964 7.860 624 HD13 LEU 70 3HD1 LEU 70 -13.013 3.158 8.116 625 HD21 LEU 70 3HD2 LEU 70 -12.905 6.047 9.421 626 HD22 LEU 70 1HD2 LEU 70 -14.028 5.483 8.180 627 HD23 LEU 70 2HD2 LEU 70 -13.018 6.895 7.877 628 H ILE 71 H ILE 71 -8.171 6.595 6.031 629 HA ILE 71 HA ILE 71 -6.110 7.458 7.785 630 HB ILE 71 HB ILE 71 -6.193 6.844 4.807 631 HG12 ILE 71 2HG1 ILE 71 -4.861 5.439 7.162 632 HG13 ILE 71 3HG1 ILE 71 -6.314 4.911 6.325 633 HG21 ILE 71 1HG2 ILE 71 -4.502 8.591 4.986 634 HG22 ILE 71 2HG2 ILE 71 -3.731 7.038 4.672 635 HG23 ILE 71 3HG2 ILE 71 -3.706 7.722 6.297 636 HD11 ILE 71 3HD1 ILE 71 -4.443 3.570 5.656 637 HD12 ILE 71 1HD1 ILE 71 -3.521 5.001 5.191 638 HD13 ILE 71 2HD1 ILE 71 -4.969 4.549 4.288 639 H SER 72 H SER 72 -8.153 9.124 5.463 640 HA SER 72 HA SER 72 -6.732 11.512 5.121 641 HB2 SER 72 2HB SER 72 -8.742 10.819 3.802 642 HB3 SER 72 3HB SER 72 -9.760 11.185 5.197 643 HG SER 72 HG SER 72 -9.266 13.326 4.990 644 H LYS 73 H LYS 73 -8.665 10.389 7.836 645 HA LYS 73 HA LYS 73 -8.570 12.915 9.283 646 HB2 LYS 73 2HB LYS 73 -9.406 10.108 10.138 647 HB3 LYS 73 3HB LYS 73 -9.478 11.511 11.198 648 HG2 LYS 73 2HG LYS 73 -11.028 11.158 8.619 649 HG3 LYS 73 3HG LYS 73 -11.675 10.963 10.245 650 HD2 LYS 73 2HD LYS 73 -10.504 13.590 9.244 651 HD3 LYS 73 3HD LYS 73 -12.203 13.167 9.060 652 HE2 LYS 73 2HE LYS 73 -11.986 14.593 10.993 653 HE3 LYS 73 3HE LYS 73 -12.376 12.972 11.560 654 HZ1 LYS 73 3HZ LYS 73 -10.650 14.140 12.865 655 HZ2 LYS 73 1HZ LYS 73 -9.632 14.125 11.521 656 HZ3 LYS 73 2HZ LYS 73 -10.107 12.667 12.238 657 H LEU 74 H LEU 74 -6.807 9.850 9.199 658 HA LEU 74 HA LEU 74 -5.313 10.188 11.589 659 HB2 LEU 74 2HB LEU 74 -4.824 8.413 9.168 660 HB3 LEU 74 3HB LEU 74 -3.919 8.294 10.670 661 HG LEU 74 HG LEU 74 -6.925 7.843 10.420 662 HD11 LEU 74 1HD1 LEU 74 -6.466 5.462 10.772 663 HD12 LEU 74 2HD1 LEU 74 -4.729 5.780 10.771 664 HD13 LEU 74 3HD1 LEU 74 -5.678 6.051 9.309 665 HD21 LEU 74 3HD2 LEU 74 -6.320 8.693 12.629 666 HD22 LEU 74 1HD2 LEU 74 -5.087 7.440 12.803 667 HD23 LEU 74 2HD2 LEU 74 -6.796 7.001 12.732 668 H GLY 75 H GLY 75 -4.644 11.105 8.235 669 HA2 GLY 75 2HA GLY 75 -3.201 12.607 7.315 670 HA3 GLY 75 3HA GLY 75 -3.052 13.301 8.918 671 H TYR 76 H TYR 76 -1.907 10.409 7.114 672 HA TYR 76 HA TYR 76 0.858 11.155 7.741 673 HB2 TYR 76 2HB TYR 76 1.429 8.733 8.288 674 HB3 TYR 76 3HB TYR 76 0.519 9.594 9.513 675 HD1 TYR 76 HD2 TYR 76 -0.580 7.640 6.450 676 HD2 TYR 76 HD1 TYR 76 -0.762 8.041 10.694 677 HE1 TYR 76 HE2 TYR 76 -2.153 5.760 6.570 678 HE2 TYR 76 HE1 TYR 76 -2.329 6.159 10.808 679 HH TYR 76 HH TYR 76 -2.958 4.112 8.149 680 H LYS 77 H LYS 77 2.409 9.627 6.534 681 HA LYS 77 HA LYS 77 1.803 9.941 3.740 682 HB2 LYS 77 2HB LYS 77 4.055 10.429 4.704 683 HB3 LYS 77 3HB LYS 77 4.255 8.722 5.079 684 HG2 LYS 77 2HG LYS 77 5.492 9.133 3.090 685 HG3 LYS 77 3HG LYS 77 4.052 8.240 2.602 686 HD2 LYS 77 2HD LYS 77 3.008 10.426 1.917 687 HD3 LYS 77 3HD LYS 77 4.531 11.229 2.310 688 HE2 LYS 77 2HE LYS 77 5.684 9.820 0.629 689 HE3 LYS 77 3HE LYS 77 4.144 9.065 0.220 690 HZ1 LYS 77 3HZ LYS 77 4.798 11.941 -0.110 691 HZ2 LYS 77 1HZ LYS 77 3.331 11.207 -0.528 692 HZ3 LYS 77 2HZ LYS 77 4.755 10.787 -1.343 693 H VAL 78 H VAL 78 0.949 8.448 2.438 694 HA VAL 78 HA VAL 78 1.317 5.559 3.010 695 HB VAL 78 HB VAL 78 -1.074 6.849 1.597 696 HG11 VAL 78 1HG1 VAL 78 -0.564 4.613 0.690 697 HG12 VAL 78 2HG1 VAL 78 -2.078 4.595 1.593 698 HG13 VAL 78 3HG1 VAL 78 -0.613 3.927 2.317 699 HG21 VAL 78 3HG2 VAL 78 -2.411 6.155 3.556 700 HG22 VAL 78 1HG2 VAL 78 -1.138 7.289 4.016 701 HG23 VAL 78 2HG2 VAL 78 -0.951 5.566 4.355 702 H PHE 79 H PHE 79 2.257 4.433 1.439 703 HA PHE 79 HA PHE 79 2.737 5.618 -1.244 704 HB2 PHE 79 2HB PHE 79 4.226 3.407 0.261 705 HB3 PHE 79 3HB PHE 79 4.623 3.995 -1.344 706 HD1 PHE 79 HD1 PHE 79 5.511 6.316 -1.631 707 HD2 PHE 79 HD2 PHE 79 5.036 4.544 2.230 708 HE1 PHE 79 HE1 PHE 79 7.075 7.941 -0.680 709 HE2 PHE 79 HE2 PHE 79 6.604 6.189 3.169 710 HZ PHE 79 HZ PHE 79 7.630 7.880 1.716 711 H LEU 80 H LEU 80 1.176 4.745 -2.606 712 HA LEU 80 HA LEU 80 0.178 2.019 -2.045 713 HB2 LEU 80 2HB LEU 80 -1.551 3.688 -1.817 714 HB3 LEU 80 3HB LEU 80 -1.181 4.371 -3.393 715 HG LEU 80 HG LEU 80 -2.054 2.395 -4.534 716 HD11 LEU 80 1HD1 LEU 80 -1.323 0.664 -2.968 717 HD12 LEU 80 2HD1 LEU 80 -3.020 0.485 -3.388 718 HD13 LEU 80 3HD1 LEU 80 -2.570 1.158 -1.819 719 HD21 LEU 80 3HD2 LEU 80 -4.422 2.513 -3.921 720 HD22 LEU 80 1HD2 LEU 80 -3.687 4.116 -3.926 721 HD23 LEU 80 2HD2 LEU 80 -4.003 3.297 -2.394 722 H LEU 81 H LEU 81 0.475 0.475 -3.458 723 HA LEU 81 HA LEU 81 1.241 1.088 -6.252 724 HB2 LEU 81 2HB LEU 81 3.108 0.097 -4.990 725 HB3 LEU 81 3HB LEU 81 2.096 -1.257 -4.512 726 HG LEU 81 HG LEU 81 1.990 -2.063 -6.831 727 HD11 LEU 81 1HD1 LEU 81 3.363 -0.969 -8.613 728 HD12 LEU 81 2HD1 LEU 81 3.582 0.407 -7.538 729 HD13 LEU 81 3HD1 LEU 81 1.968 -0.030 -8.089 730 HD21 LEU 81 3HD2 LEU 81 4.342 -2.703 -7.150 731 HD22 LEU 81 1HD2 LEU 81 3.872 -2.826 -5.454 732 HD23 LEU 81 2HD2 LEU 81 4.848 -1.461 -6.003 733 H LEU 82 H LEU 82 0.051 0.185 -7.794 734 HA LEU 82 HA LEU 82 -2.115 -1.727 -7.116 735 HB2 LEU 82 2HB LEU 82 -2.068 0.490 -9.213 736 HB3 LEU 82 3HB LEU 82 -3.409 -0.607 -8.928 737 HG LEU 82 HG LEU 82 -2.394 1.427 -6.900 738 HD11 LEU 82 1HD1 LEU 82 -3.357 2.557 -8.839 739 HD12 LEU 82 2HD1 LEU 82 -4.387 2.743 -7.423 740 HD13 LEU 82 3HD1 LEU 82 -4.833 1.597 -8.692 741 HD21 LEU 82 3HD2 LEU 82 -4.476 0.931 -5.668 742 HD22 LEU 82 1HD2 LEU 82 -3.447 -0.494 -5.815 743 HD23 LEU 82 2HD2 LEU 82 -4.874 -0.328 -6.840 744 H ALA 83 H ALA 83 -1.030 -3.628 -7.730 745 HA ALA 83 HA ALA 83 0.203 -3.755 -10.428 746 HB1 ALA 83 3HB ALA 83 1.712 -4.226 -8.537 747 HB2 ALA 83 1HB ALA 83 1.518 -5.636 -9.581 748 HB3 ALA 83 2HB ALA 83 0.672 -5.558 -8.035 749 H ASP 84 H ASP 84 -1.248 -4.510 -11.885 750 HA ASP 84 HA ASP 84 -1.990 -7.273 -11.781 751 HB2 ASP 84 2HB ASP 84 -3.902 -6.489 -10.482 752 HB3 ASP 84 3HB ASP 84 -4.237 -5.213 -11.646 753 H GLN 85 H GLN 85 -2.857 -8.052 -13.785 754 HA GLN 85 HA GLN 85 -1.637 -7.078 -16.092 755 HB2 GLN 85 2HB GLN 85 -3.935 -9.049 -15.783 756 HB3 GLN 85 3HB GLN 85 -3.047 -8.793 -17.284 757 HG2 GLN 85 2HG GLN 85 -0.978 -9.568 -16.248 758 HG3 GLN 85 3HG GLN 85 -1.783 -9.733 -14.691 759 HE21 GLN 85 1HE2 GLN 85 -0.366 -11.738 -16.297 760 HE22 GLN 85 2HE2 GLN 85 -1.503 -13.023 -16.530 761 H ASP 86 H ASP 86 -5.069 -6.764 -15.044 762 HA ASP 86 HA ASP 86 -5.681 -4.914 -17.197 763 HB2 ASP 86 2HB ASP 86 -7.538 -6.214 -16.172 764 HB3 ASP 86 3HB ASP 86 -7.260 -5.410 -14.632 765 H GLU 87 H GLU 87 -4.409 -3.207 -17.183 766 HA GLU 87 HA GLU 87 -3.703 -1.709 -14.804 767 HB2 GLU 87 2HB GLU 87 -2.389 -0.317 -16.326 768 HB3 GLU 87 3HB GLU 87 -2.092 -2.017 -16.664 769 HG2 GLU 87 2HG GLU 87 -3.460 -1.939 -18.653 770 HG3 GLU 87 3HG GLU 87 -4.004 -0.305 -18.278 771 H ASN 88 H ASN 88 -6.364 -1.759 -16.915 772 HA ASN 88 HA ASN 88 -6.785 0.954 -17.551 773 HB2 ASN 88 2HB ASN 88 -7.779 -0.910 -18.820 774 HB3 ASN 88 3HB ASN 88 -8.769 -1.360 -17.441 775 HD21 ASN 88 1HD2 ASN 88 -8.321 0.996 -20.007 776 HD22 ASN 88 2HD2 ASN 88 -9.898 1.695 -19.886 777 H GLU 89 H GLU 89 -8.545 -1.064 -15.152 778 HA GLU 89 HA GLU 89 -10.064 1.061 -14.045 779 HB2 GLU 89 2HB GLU 89 -10.704 -1.347 -13.936 780 HB3 GLU 89 3HB GLU 89 -9.371 -1.640 -12.822 781 HG2 GLU 89 2HG GLU 89 -10.439 -0.014 -11.221 782 HG3 GLU 89 3HG GLU 89 -11.816 0.081 -12.321 783 H LEU 90 H LEU 90 -7.026 -0.471 -13.100 784 HA LEU 90 HA LEU 90 -6.612 0.849 -10.633 785 HB2 LEU 90 2HB LEU 90 -4.610 -0.357 -12.578 786 HB3 LEU 90 3HB LEU 90 -4.204 0.177 -10.955 787 HG LEU 90 HG LEU 90 -6.086 -2.110 -11.641 788 HD11 LEU 90 1HD1 LEU 90 -3.268 -2.165 -10.519 789 HD12 LEU 90 2HD1 LEU 90 -3.770 -2.684 -12.130 790 HD13 LEU 90 3HD1 LEU 90 -4.325 -3.567 -10.710 791 HD21 LEU 90 3HD2 LEU 90 -5.164 -1.132 -8.917 792 HD22 LEU 90 1HD2 LEU 90 -6.085 -2.608 -9.222 793 HD23 LEU 90 2HD2 LEU 90 -6.804 -1.037 -9.568 794 H GLU 91 H GLU 91 -5.972 1.760 -13.958 795 HA GLU 91 HA GLU 91 -4.168 3.907 -13.619 796 HB2 GLU 91 2HB GLU 91 -4.681 2.841 -15.820 797 HB3 GLU 91 3HB GLU 91 -6.297 3.527 -15.776 798 HG2 GLU 91 2HG GLU 91 -4.998 4.866 -17.266 799 HG3 GLU 91 3HG GLU 91 -5.244 5.818 -15.803 800 H GLU 92 H GLU 92 -7.671 3.671 -13.520 801 HA GLU 92 HA GLU 92 -8.178 6.480 -13.173 802 HB2 GLU 92 2HB GLU 92 -9.969 4.058 -12.708 803 HB3 GLU 92 3HB GLU 92 -10.508 5.736 -12.778 804 HG2 GLU 92 2HG GLU 92 -9.908 5.900 -15.132 805 HG3 GLU 92 3HG GLU 92 -9.155 4.307 -15.093 806 H PHE 93 H PHE 93 -8.044 3.604 -11.073 807 HA PHE 93 HA PHE 93 -8.977 4.570 -8.656 808 HB2 PHE 93 2HB PHE 93 -8.387 2.160 -9.243 809 HB3 PHE 93 3HB PHE 93 -6.701 2.552 -8.976 810 HD1 PHE 93 HD2 PHE 93 -6.012 3.305 -6.558 811 HD2 PHE 93 HD1 PHE 93 -9.763 1.465 -7.446 812 HE1 PHE 93 HE2 PHE 93 -6.263 2.659 -4.196 813 HE2 PHE 93 HE1 PHE 93 -9.996 0.819 -5.087 814 HZ PHE 93 HZ PHE 93 -8.249 1.411 -3.464 815 H LYS 94 H LYS 94 -5.626 4.612 -9.884 816 HA LYS 94 HA LYS 94 -4.372 5.648 -7.596 817 HB2 LYS 94 2HB LYS 94 -2.411 5.948 -8.931 818 HB3 LYS 94 3HB LYS 94 -3.217 4.519 -9.562 819 HG2 LYS 94 2HG LYS 94 -4.020 5.732 -11.495 820 HG3 LYS 94 3HG LYS 94 -3.472 7.270 -10.830 821 HD2 LYS 94 2HD LYS 94 -1.733 4.985 -11.818 822 HD3 LYS 94 3HD LYS 94 -1.947 6.564 -12.568 823 HE2 LYS 94 2HE LYS 94 -0.608 6.041 -9.888 824 HE3 LYS 94 3HE LYS 94 0.207 6.438 -11.395 825 HZ1 LYS 94 3HZ LYS 94 -0.732 8.596 -11.375 826 HZ2 LYS 94 1HZ LYS 94 -0.070 8.328 -9.843 827 HZ3 LYS 94 2HZ LYS 94 -1.742 8.237 -10.072 828 H ARG 95 H ARG 95 -6.061 7.256 -10.215 829 HA ARG 95 HA ARG 95 -4.963 9.860 -9.939 830 HB2 ARG 95 2HB ARG 95 -7.607 8.930 -11.143 831 HB3 ARG 95 3HB ARG 95 -6.973 10.570 -11.299 832 HG2 ARG 95 2HG ARG 95 -5.026 9.753 -12.506 833 HG3 ARG 95 3HG ARG 95 -5.541 8.082 -12.276 834 HD2 ARG 95 2HD ARG 95 -7.495 8.455 -13.684 835 HD3 ARG 95 3HD ARG 95 -7.091 10.172 -13.839 836 HE ARG 95 HE ARG 95 -4.859 9.001 -14.761 837 HH11 ARG 95 1HH1 ARG 95 -8.223 8.420 -15.582 838 HH12 ARG 95 2HH1 ARG 95 -7.874 7.930 -17.205 839 HH21 ARG 95 1HH2 ARG 95 -4.391 8.387 -16.884 840 HH22 ARG 95 2HH2 ARG 95 -5.674 7.912 -17.951 841 H LYS 96 H LYS 96 -7.730 8.249 -8.486 842 HA LYS 96 HA LYS 96 -8.878 10.466 -7.137 843 HB2 LYS 96 2HB LYS 96 -8.985 7.465 -6.597 844 HB3 LYS 96 3HB LYS 96 -9.813 8.618 -5.564 845 HG2 LYS 96 2HG LYS 96 -11.401 7.641 -7.102 846 HG3 LYS 96 3HG LYS 96 -11.195 9.346 -7.503 847 HD2 LYS 96 2HD LYS 96 -9.743 8.746 -9.389 848 HD3 LYS 96 3HD LYS 96 -9.850 7.039 -8.952 849 HE2 LYS 96 2HE LYS 96 -11.311 7.570 -10.854 850 HE3 LYS 96 3HE LYS 96 -12.258 7.050 -9.460 851 HZ1 LYS 96 3HZ LYS 96 -11.806 9.889 -10.195 852 HZ2 LYS 96 1HZ LYS 96 -12.869 9.299 -9.019 853 HZ3 LYS 96 2HZ LYS 96 -13.167 9.001 -10.656 854 H ILE 97 H ILE 97 -6.571 7.947 -6.133 855 HA ILE 97 HA ILE 97 -6.346 8.735 -3.425 856 HB ILE 97 HB ILE 97 -4.319 7.118 -5.037 857 HG12 ILE 97 2HG1 ILE 97 -6.470 6.082 -5.435 858 HG13 ILE 97 3HG1 ILE 97 -5.600 5.076 -4.292 859 HG21 ILE 97 1HG2 ILE 97 -3.492 7.720 -2.822 860 HG22 ILE 97 2HG2 ILE 97 -3.823 5.992 -2.891 861 HG23 ILE 97 3HG2 ILE 97 -4.949 7.072 -2.066 862 HD11 ILE 97 3HD1 ILE 97 -6.975 6.057 -2.463 863 HD12 ILE 97 1HD1 ILE 97 -7.911 5.185 -3.678 864 HD13 ILE 97 2HD1 ILE 97 -7.890 6.947 -3.681 865 H GLU 98 H GLU 98 -4.480 9.498 -6.321 866 HA GLU 98 HA GLU 98 -2.302 10.853 -5.053 867 HB2 GLU 98 2HB GLU 98 -2.236 9.786 -7.354 868 HB3 GLU 98 3HB GLU 98 -3.221 11.116 -7.952 869 HG2 GLU 98 2HG GLU 98 -1.445 12.717 -7.400 870 HG3 GLU 98 3HG GLU 98 -0.475 11.425 -6.690 871 H SER 99 H SER 99 -5.411 11.858 -6.403 872 HA SER 99 HA SER 99 -4.983 14.697 -6.196 873 HB2 SER 99 2HB SER 99 -6.603 13.685 -7.787 874 HB3 SER 99 3HB SER 99 -7.597 13.147 -6.433 875 HG SER 99 HG SER 99 -6.909 15.881 -6.791 876 H GLN 100 H GLN 100 -6.141 12.176 -4.043 877 HA GLN 100 HA GLN 100 -7.158 13.904 -1.970 878 HB2 GLN 100 2HB GLN 100 -6.367 10.955 -1.942 879 HB3 GLN 100 3HB GLN 100 -7.127 11.787 -0.585 880 HG2 GLN 100 2HG GLN 100 -9.144 12.177 -1.854 881 HG3 GLN 100 3HG GLN 100 -8.393 11.580 -3.328 882 HE21 GLN 100 1HE2 GLN 100 -9.860 10.676 -0.297 883 HE22 GLN 100 2HE2 GLN 100 -10.024 8.995 -0.646 884 H GLY 101 H GLY 101 -4.010 13.121 -3.016 885 HA2 GLY 101 2HA GLY 101 -2.118 14.325 -2.274 886 HA3 GLY 101 3HA GLY 101 -2.863 14.528 -0.695 887 H TYR 102 H TYR 102 -2.379 11.538 -2.578 888 HA TYR 102 HA TYR 102 -0.397 10.601 -0.576 889 HB2 TYR 102 2HB TYR 102 -2.475 8.889 -2.004 890 HB3 TYR 102 3HB TYR 102 -1.262 8.295 -0.878 891 HD1 TYR 102 HD2 TYR 102 -1.405 9.128 1.589 892 HD2 TYR 102 HD1 TYR 102 -4.618 9.586 -1.198 893 HE1 TYR 102 HE2 TYR 102 -2.983 9.427 3.450 894 HE2 TYR 102 HE1 TYR 102 -6.183 9.888 0.665 895 HH TYR 102 HH TYR 102 -5.173 10.399 3.887 896 H GLU 103 H GLU 103 1.212 9.144 -1.398 897 HA GLU 103 HA GLU 103 1.909 9.611 -4.204 898 HB2 GLU 103 2HB GLU 103 3.640 9.904 -2.428 899 HB3 GLU 103 3HB GLU 103 3.477 8.207 -1.993 900 HG2 GLU 103 2HG GLU 103 4.348 7.520 -4.159 901 HG3 GLU 103 3HG GLU 103 4.372 9.187 -4.714 902 H VAL 104 H VAL 104 1.088 8.224 -5.652 903 HA VAL 104 HA VAL 104 0.909 5.363 -5.036 904 HB VAL 104 HB VAL 104 -1.317 6.072 -4.497 905 HG11 VAL 104 1HG1 VAL 104 -1.441 7.552 -7.140 906 HG12 VAL 104 2HG1 VAL 104 -1.350 8.275 -5.531 907 HG13 VAL 104 3HG1 VAL 104 -2.779 7.354 -6.003 908 HG21 VAL 104 3HG2 VAL 104 -1.396 4.895 -7.309 909 HG22 VAL 104 1HG2 VAL 104 -2.702 4.831 -6.117 910 HG23 VAL 104 2HG2 VAL 104 -1.185 3.981 -5.813 911 H ARG 105 H ARG 105 1.776 4.233 -6.566 912 HA ARG 105 HA ARG 105 1.826 5.155 -9.382 913 HB2 ARG 105 2HB ARG 105 3.584 3.094 -7.979 914 HB3 ARG 105 3HB ARG 105 3.711 3.547 -9.670 915 HG2 ARG 105 2HG ARG 105 4.104 5.601 -7.483 916 HG3 ARG 105 3HG ARG 105 5.409 4.524 -7.971 917 HD2 ARG 105 2HD ARG 105 5.664 6.622 -9.122 918 HD3 ARG 105 3HD ARG 105 5.217 5.391 -10.293 919 HE ARG 105 HE ARG 105 3.272 6.528 -10.735 920 HH11 ARG 105 1HH1 ARG 105 4.698 7.928 -7.826 921 HH12 ARG 105 2HH1 ARG 105 3.599 9.272 -7.802 922 HH21 ARG 105 1HH2 ARG 105 1.895 8.329 -10.720 923 HH22 ARG 105 2HH2 ARG 105 2.009 9.502 -9.442 924 H LYS 106 H LYS 106 1.489 3.499 -10.985 925 HA LYS 106 HA LYS 106 -0.141 1.162 -10.179 926 HB2 LYS 106 2HB LYS 106 -1.598 3.024 -10.964 927 HB3 LYS 106 3HB LYS 106 -0.704 3.114 -12.471 928 HG2 LYS 106 2HG LYS 106 -2.123 0.569 -11.669 929 HG3 LYS 106 3HG LYS 106 -3.013 1.896 -12.397 930 HD2 LYS 106 2HD LYS 106 -0.623 0.573 -13.734 931 HD3 LYS 106 3HD LYS 106 -2.282 0.037 -13.969 932 HE2 LYS 106 2HE LYS 106 -1.619 1.445 -15.828 933 HE3 LYS 106 3HE LYS 106 -2.859 2.274 -14.893 934 HZ1 LYS 106 3HZ LYS 106 -1.204 3.690 -13.947 935 HZ2 LYS 106 1HZ LYS 106 -1.005 3.704 -15.623 936 HZ3 LYS 106 2HZ LYS 106 0.053 2.809 -14.652 937 H VAL 107 H VAL 107 0.597 -0.685 -11.078 938 HA VAL 107 HA VAL 107 2.309 -0.640 -13.491 939 HB VAL 107 HB VAL 107 3.871 -2.255 -12.523 940 HG11 VAL 107 1HG1 VAL 107 3.580 0.160 -10.715 941 HG12 VAL 107 2HG1 VAL 107 4.462 0.087 -12.241 942 HG13 VAL 107 3HG1 VAL 107 5.025 -0.848 -10.856 943 HG21 VAL 107 3HG2 VAL 107 3.811 -2.870 -10.115 944 HG22 VAL 107 1HG2 VAL 107 2.403 -3.459 -11.001 945 HG23 VAL 107 2HG2 VAL 107 2.260 -2.045 -9.959 946 H THR 108 H THR 108 2.816 -3.041 -13.997 947 HA THR 108 HA THR 108 0.400 -4.707 -13.961 948 HB THR 108 HB THR 108 1.697 -3.606 -16.502 949 HG1 THR 108 HG1 THR 108 -0.805 -3.129 -15.224 950 HG21 THR 108 3HG2 THR 108 0.913 -5.907 -16.871 951 HG22 THR 108 1HG2 THR 108 -0.115 -4.751 -17.718 952 HG23 THR 108 2HG2 THR 108 -0.665 -5.479 -16.211 953 H ASP 109 H ASP 109 3.820 -4.257 -14.609 954 HA ASP 109 HA ASP 109 4.335 -7.096 -15.126 955 HB2 ASP 109 2HB ASP 109 5.335 -5.398 -16.614 956 HB3 ASP 109 3HB ASP 109 6.096 -4.614 -15.246 957 H ASP 110 H ASP 110 6.103 -8.163 -13.947 958 HA ASP 110 HA ASP 110 5.663 -8.173 -11.132 959 HB2 ASP 110 2HB ASP 110 6.024 -10.256 -12.324 960 HB3 ASP 110 3HB ASP 110 7.561 -9.701 -12.962 961 H GLU 111 H GLU 111 8.698 -7.642 -13.029 962 HA GLU 111 HA GLU 111 10.203 -6.876 -10.700 963 HB2 GLU 111 2HB GLU 111 12.077 -6.521 -12.180 964 HB3 GLU 111 3HB GLU 111 11.225 -7.962 -12.726 965 HG2 GLU 111 2HG GLU 111 10.091 -6.545 -14.466 966 HG3 GLU 111 3HG GLU 111 11.113 -5.203 -13.971 967 H GLU 112 H GLU 112 8.319 -5.219 -13.076 968 HA GLU 112 HA GLU 112 9.125 -2.533 -12.622 969 HB2 GLU 112 2HB GLU 112 7.851 -3.232 -14.598 970 HB3 GLU 112 3HB GLU 112 6.495 -3.726 -13.593 971 HG2 GLU 112 2HG GLU 112 6.176 -1.339 -12.937 972 HG3 GLU 112 3HG GLU 112 7.477 -0.889 -14.036 973 H ALA 113 H ALA 113 6.684 -4.646 -11.069 974 HA ALA 113 HA ALA 113 5.698 -2.723 -9.226 975 HB1 ALA 113 3HB ALA 113 4.850 -4.638 -7.936 976 HB2 ALA 113 1HB ALA 113 5.848 -5.744 -8.894 977 HB3 ALA 113 2HB ALA 113 4.536 -4.848 -9.658 978 H LEU 114 H LEU 114 8.384 -5.030 -9.048 979 HA LEU 114 HA LEU 114 9.015 -4.753 -6.317 980 HB2 LEU 114 2HB LEU 114 10.776 -5.597 -8.649 981 HB3 LEU 114 3HB LEU 114 11.203 -5.810 -6.958 982 HG LEU 114 HG LEU 114 8.840 -7.145 -8.351 983 HD11 LEU 114 1HD1 LEU 114 11.486 -8.358 -7.487 984 HD12 LEU 114 2HD1 LEU 114 10.978 -8.041 -9.147 985 HD13 LEU 114 3HD1 LEU 114 10.115 -9.233 -8.178 986 HD21 LEU 114 3HD2 LEU 114 8.353 -6.767 -5.984 987 HD22 LEU 114 1HD2 LEU 114 9.878 -7.528 -5.520 988 HD23 LEU 114 2HD2 LEU 114 8.608 -8.483 -6.290 989 H LYS 115 H LYS 115 10.186 -2.962 -9.178 990 HA LYS 115 HA LYS 115 12.248 -1.530 -7.807 991 HB2 LYS 115 2HB LYS 115 12.366 -0.084 -9.814 992 HB3 LYS 115 3HB LYS 115 12.364 -1.790 -10.242 993 HG2 LYS 115 2HG LYS 115 10.074 -1.696 -10.956 994 HG3 LYS 115 3HG LYS 115 9.894 -0.045 -10.365 995 HD2 LYS 115 2HD LYS 115 11.766 -0.875 -12.623 996 HD3 LYS 115 3HD LYS 115 10.147 -0.205 -12.850 997 HE2 LYS 115 2HE LYS 115 12.491 1.200 -11.522 998 HE3 LYS 115 3HE LYS 115 11.826 1.552 -13.117 999 HZ1 LYS 115 3HZ LYS 115 11.006 3.133 -11.542 1000 HZ2 LYS 115 1HZ LYS 115 10.447 1.913 -10.509 1001 HZ3 LYS 115 2HZ LYS 115 9.726 2.142 -12.019 1002 H ILE 116 H ILE 116 8.822 -0.886 -8.491 1003 HA ILE 116 HA ILE 116 8.702 1.826 -7.728 1004 HB ILE 116 HB ILE 116 6.544 -0.326 -7.660 1005 HG12 ILE 116 2HG1 ILE 116 7.405 0.153 -9.917 1006 HG13 ILE 116 3HG1 ILE 116 5.745 0.682 -9.754 1007 HG21 ILE 116 1HG2 ILE 116 6.227 2.662 -7.292 1008 HG22 ILE 116 2HG2 ILE 116 5.830 1.395 -6.130 1009 HG23 ILE 116 3HG2 ILE 116 4.898 1.555 -7.616 1010 HD11 ILE 116 3HD1 ILE 116 7.003 2.224 -11.064 1011 HD12 ILE 116 1HD1 ILE 116 8.195 2.423 -9.783 1012 HD13 ILE 116 2HD1 ILE 116 6.542 3.003 -9.550 1013 H VAL 117 H VAL 117 8.253 -1.166 -5.876 1014 HA VAL 117 HA VAL 117 7.544 -0.090 -3.385 1015 HB VAL 117 HB VAL 117 9.117 -2.642 -3.981 1016 HG11 VAL 117 1HG1 VAL 117 8.315 -3.471 -1.789 1017 HG12 VAL 117 2HG1 VAL 117 7.587 -1.898 -1.456 1018 HG13 VAL 117 3HG1 VAL 117 9.339 -2.044 -1.604 1019 HG21 VAL 117 3HG2 VAL 117 6.948 -2.557 -5.141 1020 HG22 VAL 117 1HG2 VAL 117 6.127 -2.241 -3.612 1021 HG23 VAL 117 2HG2 VAL 117 6.940 -3.786 -3.877 1022 H ARG 118 H ARG 118 10.736 -0.850 -4.778 1023 HA ARG 118 HA ARG 118 12.319 -0.197 -2.525 1024 HB2 ARG 118 2HB ARG 118 13.035 -0.270 -5.489 1025 HB3 ARG 118 3HB ARG 118 14.217 -0.097 -4.193 1026 HG2 ARG 118 2HG ARG 118 13.657 -2.281 -3.304 1027 HG3 ARG 118 3HG ARG 118 12.340 -2.461 -4.463 1028 HD2 ARG 118 2HD ARG 118 13.978 -2.462 -6.317 1029 HD3 ARG 118 3HD ARG 118 15.296 -2.291 -5.146 1030 HE ARG 118 HE ARG 118 13.954 -4.508 -4.305 1031 HH11 ARG 118 1HH1 ARG 118 15.420 -3.651 -7.383 1032 HH12 ARG 118 2HH1 ARG 118 15.774 -5.295 -7.801 1033 HH21 ARG 118 1HH2 ARG 118 14.431 -6.654 -4.847 1034 HH22 ARG 118 2HH2 ARG 118 15.213 -7.004 -6.359 1035 H GLU 119 H GLU 119 11.196 1.732 -5.283 1036 HA GLU 119 HA GLU 119 12.567 4.144 -4.671 1037 HB2 GLU 119 2HB GLU 119 9.998 3.662 -6.238 1038 HB3 GLU 119 3HB GLU 119 10.818 5.219 -6.157 1039 HG2 GLU 119 2HG GLU 119 12.762 4.332 -7.306 1040 HG3 GLU 119 3HG GLU 119 12.110 2.695 -7.248 1041 H PHE 120 H PHE 120 9.279 2.991 -3.877 1042 HA PHE 120 HA PHE 120 8.305 5.107 -2.361 1043 HB2 PHE 120 2HB PHE 120 7.829 2.105 -2.208 1044 HB3 PHE 120 3HB PHE 120 7.027 3.193 -1.083 1045 HD1 PHE 120 HD2 PHE 120 6.906 5.331 -3.666 1046 HD2 PHE 120 HD1 PHE 120 5.468 1.398 -2.736 1047 HE1 PHE 120 HE2 PHE 120 4.998 5.656 -5.188 1048 HE2 PHE 120 HE1 PHE 120 3.567 1.749 -4.254 1049 HZ PHE 120 HZ PHE 120 3.328 3.871 -5.476 1050 H MET 121 H MET 121 10.368 2.420 -1.399 1051 HA MET 121 HA MET 121 10.508 2.946 1.373 1052 HB2 MET 121 2HB MET 121 12.348 1.402 -0.502 1053 HB3 MET 121 3HB MET 121 12.552 1.420 1.249 1054 HG2 MET 121 2HG MET 121 10.546 0.222 1.614 1055 HG3 MET 121 3HG MET 121 9.930 0.585 0.006 1056 HE1 MET 121 3HE MET 121 13.229 -2.528 0.860 1057 HE2 MET 121 1HE MET 121 12.350 -1.676 2.127 1058 HE3 MET 121 2HE MET 121 13.496 -0.803 1.105 1059 H GLN 122 H GLN 122 12.284 4.281 -1.376 1060 HA GLN 122 HA GLN 122 14.433 5.482 0.061 1061 HB2 GLN 122 2HB GLN 122 13.202 6.497 -2.539 1062 HB3 GLN 122 3HB GLN 122 14.799 6.890 -1.921 1063 HG2 GLN 122 2HG GLN 122 13.860 4.201 -2.937 1064 HG3 GLN 122 3HG GLN 122 14.977 5.293 -3.738 1065 HE21 GLN 122 1HE2 GLN 122 14.601 2.898 -1.247 1066 HE22 GLN 122 2HE2 GLN 122 16.283 2.711 -0.887 1067 H LYS 123 H LYS 123 11.236 6.742 -0.951 1068 HA LYS 123 HA LYS 123 11.568 9.332 0.247 1069 HB2 LYS 123 2HB LYS 123 9.028 7.890 -0.626 1070 HB3 LYS 123 3HB LYS 123 9.040 9.531 -0.005 1071 HG2 LYS 123 2HG LYS 123 8.889 9.759 -2.338 1072 HG3 LYS 123 3HG LYS 123 10.578 10.119 -1.969 1073 HD2 LYS 123 2HD LYS 123 11.264 7.916 -2.737 1074 HD3 LYS 123 3HD LYS 123 9.582 7.411 -2.921 1075 HE2 LYS 123 2HE LYS 123 10.929 9.603 -4.530 1076 HE3 LYS 123 3HE LYS 123 10.652 7.954 -5.087 1077 HZ1 LYS 123 3HZ LYS 123 8.599 9.991 -4.437 1078 HZ2 LYS 123 1HZ LYS 123 8.245 8.363 -4.737 1079 HZ3 LYS 123 2HZ LYS 123 8.938 9.310 -5.951 1080 H ALA 124 H ALA 124 10.460 6.210 1.428 1081 HA ALA 124 HA ALA 124 9.220 7.072 3.857 1082 HB1 ALA 124 3HB ALA 124 9.413 4.698 4.529 1083 HB2 ALA 124 1HB ALA 124 10.485 4.391 3.153 1084 HB3 ALA 124 2HB ALA 124 8.805 4.851 2.880 1085 H GLY 125 H GLY 125 12.506 6.067 2.951 1086 HA2 GLY 125 2HA GLY 125 13.729 6.285 5.516 1087 HA3 GLY 125 3HA GLY 125 14.561 6.267 3.962 1088 H SER 126 H SER 126 12.902 8.593 3.032 1089 HA SER 126 HA SER 126 14.585 10.760 3.867 1090 HB2 SER 126 2HB SER 126 13.663 10.617 1.577 1091 HB3 SER 126 3HB SER 126 12.024 10.773 2.211 1092 HG SER 126 HG SER 126 12.383 12.864 2.669 1093 H LEU 127 H LEU 127 11.559 9.456 4.950 1094 HA LEU 127 HA LEU 127 10.815 11.770 6.571 1095 HB2 LEU 127 2HB LEU 127 9.634 8.969 6.508 1096 HB3 LEU 127 3HB LEU 127 8.915 10.377 7.276 1097 HG LEU 127 HG LEU 127 9.350 10.075 4.279 1098 HD11 LEU 127 1HD1 LEU 127 6.785 9.770 5.860 1099 HD12 LEU 127 2HD1 LEU 127 7.694 8.473 5.078 1100 HD13 LEU 127 3HD1 LEU 127 6.938 9.728 4.100 1101 HD21 LEU 127 3HD2 LEU 127 7.811 12.209 5.797 1102 HD22 LEU 127 1HD2 LEU 127 7.902 12.047 4.042 1103 HD23 LEU 127 2HD2 LEU 127 9.352 12.431 4.965 1104 H GLU 128 H GLU 128 12.336 8.610 6.899 1105 HA GLU 128 HA GLU 128 12.441 8.485 9.758 1106 HB2 GLU 128 2HB GLU 128 12.559 6.485 8.196 1107 HB3 GLU 128 3HB GLU 128 14.193 6.980 7.763 1108 HG2 GLU 128 2HG GLU 128 14.749 6.805 10.272 1109 HG3 GLU 128 3HG GLU 128 13.191 6.004 10.459 1110 H HIS 129 H HIS 129 14.284 10.198 7.396 1111 HA HIS 129 HA HIS 129 16.741 10.829 8.416 1112 HB2 HIS 129 2HB HIS 129 16.050 12.017 6.460 1113 HB3 HIS 129 3HB HIS 129 14.556 12.566 7.205 1114 HD1 HIS 129 HD1 HIS 129 14.688 14.647 8.759 1115 HD2 HIS 129 HD2 HIS 129 18.252 13.730 6.826 1116 HE1 HIS 129 HE1 HIS 129 16.093 16.715 8.936 1117 HE2 HIS 129 HE2 HIS 129 18.161 16.191 7.614 1118 H HIS 130 H HIS 130 17.584 11.982 10.179 1119 HA HIS 130 HA HIS 130 16.646 11.408 12.586 1120 HB2 HIS 130 2HB HIS 130 18.133 13.080 13.622 1121 HB3 HIS 130 3HB HIS 130 18.903 12.289 12.259 1122 HD1 HIS 130 HD1 HIS 130 18.007 15.589 13.580 1123 HD2 HIS 130 HD2 HIS 130 19.181 14.001 9.930 1124 HE1 HIS 130 HE1 HIS 130 18.720 17.548 12.189 1125 HE2 HIS 130 HE2 HIS 130 19.640 16.531 10.086 1126 H HIS 131 H HIS 131 14.593 11.561 13.010 1127 HA HIS 131 HA HIS 131 13.119 14.114 12.911 1128 HB2 HIS 131 2HB HIS 131 12.440 12.096 11.469 1129 HB3 HIS 131 3HB HIS 131 12.007 11.270 12.961 1130 HD1 HIS 131 HD1 HIS 131 10.537 13.137 10.327 1131 HD2 HIS 131 HD2 HIS 131 9.900 12.944 14.433 1132 HE1 HIS 131 HE1 HIS 131 8.211 14.027 10.700 1133 HE2 HIS 131 HE2 HIS 131 7.837 13.862 13.182 1134 H HIS 132 H HIS 132 12.918 15.007 14.933 1135 HA HIS 132 HA HIS 132 13.181 13.596 17.363 1136 HB2 HIS 132 2HB HIS 132 12.329 15.664 18.473 1137 HB3 HIS 132 3HB HIS 132 13.588 16.018 17.297 1138 HD1 HIS 132 HD1 HIS 132 12.817 17.225 15.080 1139 HD2 HIS 132 HD2 HIS 132 9.906 16.936 18.026 1140 HE1 HIS 132 HE1 HIS 132 11.001 18.805 14.392 1141 HE2 HIS 132 HE2 HIS 132 9.393 18.798 16.317 1142 H HIS 133 H HIS 133 11.828 12.134 18.127 1143 HA HIS 133 HA HIS 133 8.911 12.488 17.937 1144 HB2 HIS 133 2HB HIS 133 8.494 10.259 17.055 1145 HB3 HIS 133 3HB HIS 133 9.625 11.055 15.966 1146 HD1 HIS 133 HD1 HIS 133 9.309 8.194 18.315 1147 HD2 HIS 133 HD2 HIS 133 12.246 9.900 15.925 1148 HE1 HIS 133 HE1 HIS 133 11.160 6.521 18.222 1149 HE2 HIS 133 HE2 HIS 133 13.010 7.670 16.983 1150 H HIS 134 H HIS 134 7.794 10.784 19.319 1151 HA HIS 134 HA HIS 134 8.979 10.770 21.912 1152 HB2 HIS 134 2HB HIS 134 6.930 9.543 22.638 1153 HB3 HIS 134 3HB HIS 134 6.580 11.021 21.752 1154 HD1 HIS 134 HD1 HIS 134 5.768 10.661 19.215 1155 HD2 HIS 134 HD2 HIS 134 5.720 7.291 21.641 1156 HE1 HIS 134 HE1 HIS 134 4.332 8.991 18.021 1157 HE2 HIS 134 HE2 HIS 134 4.161 7.053 19.601 Start of MODEL 15 1 H1 MET 1 1H MET 1 3.629 9.478 13.190 2 H2 MET 1 2H MET 1 4.756 10.735 13.261 3 H3 MET 1 3H MET 1 5.207 9.170 13.710 4 HA MET 1 HA MET 1 4.366 10.000 11.004 5 HB2 MET 1 2HB MET 1 6.554 10.975 11.620 6 HB3 MET 1 3HB MET 1 7.150 9.395 12.090 7 HG2 MET 1 2HG MET 1 8.104 9.984 9.964 8 HG3 MET 1 3HG MET 1 6.970 8.664 9.709 9 HE1 MET 1 3HE MET 1 4.384 10.074 7.306 10 HE2 MET 1 1HE MET 1 4.230 9.405 8.930 11 HE3 MET 1 2HE MET 1 5.348 8.675 7.779 12 H LYS 2 H LYS 2 2.879 8.230 10.982 13 HA LYS 2 HA LYS 2 3.933 5.489 11.217 14 HB2 LYS 2 2HB LYS 2 1.524 6.455 11.981 15 HB3 LYS 2 3HB LYS 2 1.094 6.076 10.324 16 HG2 LYS 2 2HG LYS 2 0.449 4.220 11.699 17 HG3 LYS 2 3HG LYS 2 1.843 3.701 10.744 18 HD2 LYS 2 2HD LYS 2 3.328 3.979 12.648 19 HD3 LYS 2 3HD LYS 2 2.047 4.733 13.595 20 HE2 LYS 2 2HE LYS 2 0.789 2.558 13.502 21 HE3 LYS 2 3HE LYS 2 2.202 1.840 12.716 22 HZ1 LYS 2 3HZ LYS 2 2.214 1.442 15.105 23 HZ2 LYS 2 1HZ LYS 2 2.184 3.097 15.417 24 HZ3 LYS 2 2HZ LYS 2 3.529 2.406 14.666 25 H ILE 3 H ILE 3 5.005 4.790 9.448 26 HA ILE 3 HA ILE 3 4.314 5.813 6.775 27 HB ILE 3 HB ILE 3 6.694 4.121 7.691 28 HG12 ILE 3 2HG1 ILE 3 6.574 7.107 7.023 29 HG13 ILE 3 3HG1 ILE 3 6.655 6.445 8.649 30 HG21 ILE 3 1HG2 ILE 3 6.154 3.754 5.304 31 HG22 ILE 3 2HG2 ILE 3 7.683 4.606 5.498 32 HG23 ILE 3 3HG2 ILE 3 6.239 5.495 5.010 33 HD11 ILE 3 3HD1 ILE 3 8.800 7.280 7.924 34 HD12 ILE 3 1HD1 ILE 3 8.791 6.193 6.535 35 HD13 ILE 3 2HD1 ILE 3 8.870 5.537 8.174 36 H LEU 4 H LEU 4 2.609 4.693 5.981 37 HA LEU 4 HA LEU 4 2.619 1.733 6.020 38 HB2 LEU 4 2HB LEU 4 0.439 3.800 5.661 39 HB3 LEU 4 3HB LEU 4 0.244 2.253 4.860 40 HG LEU 4 HG LEU 4 0.400 1.089 7.059 41 HD11 LEU 4 1HD1 LEU 4 0.443 3.851 8.293 42 HD12 LEU 4 2HD1 LEU 4 1.749 2.666 8.315 43 HD13 LEU 4 3HD1 LEU 4 0.242 2.325 9.162 44 HD21 LEU 4 3HD2 LEU 4 -1.777 3.206 6.914 45 HD22 LEU 4 1HD2 LEU 4 -1.830 1.718 7.865 46 HD23 LEU 4 2HD2 LEU 4 -1.789 1.633 6.109 47 H ILE 5 H ILE 5 3.072 0.623 4.210 48 HA ILE 5 HA ILE 5 2.868 1.970 1.568 49 HB ILE 5 HB ILE 5 4.542 -0.499 2.294 50 HG12 ILE 5 2HG1 ILE 5 5.437 2.347 1.598 51 HG13 ILE 5 3HG1 ILE 5 5.563 1.579 3.175 52 HG21 ILE 5 1HG2 ILE 5 4.313 0.962 -0.371 53 HG22 ILE 5 2HG2 ILE 5 3.652 -0.634 -0.007 54 HG23 ILE 5 3HG2 ILE 5 5.398 -0.389 -0.027 55 HD11 ILE 5 3HD1 ILE 5 7.708 1.618 2.090 56 HD12 ILE 5 1HD1 ILE 5 7.061 0.776 0.681 57 HD13 ILE 5 2HD1 ILE 5 7.155 -0.047 2.241 58 H LEU 6 H LEU 6 0.960 1.472 0.690 59 HA LEU 6 HA LEU 6 -0.467 -0.991 1.408 60 HB2 LEU 6 2HB LEU 6 -1.363 1.357 -0.324 61 HB3 LEU 6 3HB LEU 6 -2.360 -0.017 0.122 62 HG LEU 6 HG LEU 6 -1.318 2.144 1.946 63 HD11 LEU 6 1HD1 LEU 6 -4.160 1.408 1.176 64 HD12 LEU 6 2HD1 LEU 6 -3.256 2.820 0.621 65 HD13 LEU 6 3HD1 LEU 6 -3.691 2.670 2.320 66 HD21 LEU 6 3HD2 LEU 6 -2.857 -0.322 2.755 67 HD22 LEU 6 1HD2 LEU 6 -2.482 1.056 3.795 68 HD23 LEU 6 2HD2 LEU 6 -1.179 0.057 3.162 69 H ILE 7 H ILE 7 -0.365 -2.710 0.186 70 HA ILE 7 HA ILE 7 0.450 -2.515 -2.662 71 HB ILE 7 HB ILE 7 0.892 -4.806 -0.676 72 HG12 ILE 7 2HG1 ILE 7 2.444 -2.909 -0.336 73 HG13 ILE 7 3HG1 ILE 7 3.299 -4.317 -0.948 74 HG21 ILE 7 1HG2 ILE 7 2.153 -5.926 -2.506 75 HG22 ILE 7 2HG2 ILE 7 1.638 -4.665 -3.629 76 HG23 ILE 7 3HG2 ILE 7 0.443 -5.735 -2.894 77 HD11 ILE 7 3HD1 ILE 7 2.504 -1.880 -2.543 78 HD12 ILE 7 1HD1 ILE 7 3.346 -3.294 -3.184 79 HD13 ILE 7 2HD1 ILE 7 4.120 -2.284 -1.964 80 H ASN 8 H ASN 8 -1.299 -2.709 -3.868 81 HA ASN 8 HA ASN 8 -3.159 -4.969 -3.393 82 HB2 ASN 8 2HB ASN 8 -4.370 -2.825 -3.384 83 HB3 ASN 8 3HB ASN 8 -3.628 -2.356 -4.908 84 HD21 ASN 8 1HD2 ASN 8 -5.892 -4.559 -3.396 85 HD22 ASN 8 2HD2 ASN 8 -6.752 -4.971 -4.838 86 H THR 9 H THR 9 -2.010 -6.526 -4.472 87 HA THR 9 HA THR 9 -2.119 -6.218 -7.387 88 HB THR 9 HB THR 9 0.221 -6.119 -7.059 89 HG1 THR 9 HG1 THR 9 -0.202 -7.493 -8.730 90 HG21 THR 9 3HG2 THR 9 0.397 -6.918 -4.745 91 HG22 THR 9 1HG2 THR 9 1.560 -7.724 -5.803 92 HG23 THR 9 2HG2 THR 9 0.097 -8.567 -5.299 93 H ASN 10 H ASN 10 -3.075 -7.763 -8.453 94 HA ASN 10 HA ASN 10 -4.624 -9.794 -7.150 95 HB2 ASN 10 2HB ASN 10 -5.389 -8.619 -9.195 96 HB3 ASN 10 3HB ASN 10 -4.044 -9.280 -10.110 97 HD21 ASN 10 1HD2 ASN 10 -5.396 -10.252 -11.629 98 HD22 ASN 10 2HD2 ASN 10 -6.379 -11.630 -11.277 99 H ASN 11 H ASN 11 -1.428 -9.639 -8.299 100 HA ASN 11 HA ASN 11 -1.065 -12.470 -8.919 101 HB2 ASN 11 2HB ASN 11 1.008 -10.227 -8.899 102 HB3 ASN 11 3HB ASN 11 1.143 -11.798 -9.688 103 HD21 ASN 11 1HD2 ASN 11 1.361 -9.095 -10.797 104 HD22 ASN 11 2HD2 ASN 11 0.197 -9.008 -12.070 105 H ASP 12 H ASP 12 -0.906 -13.748 -7.127 106 HA ASP 12 HA ASP 12 -0.115 -12.904 -4.542 107 HB2 ASP 12 2HB ASP 12 -0.274 -15.731 -5.686 108 HB3 ASP 12 3HB ASP 12 -0.028 -15.371 -3.980 109 H GLU 13 H GLU 13 1.698 -14.364 -7.180 110 HA GLU 13 HA GLU 13 4.045 -15.064 -5.751 111 HB2 GLU 13 2HB GLU 13 3.700 -14.424 -8.714 112 HB3 GLU 13 3HB GLU 13 5.136 -15.151 -7.999 113 HG2 GLU 13 2HG GLU 13 3.700 -17.076 -7.235 114 HG3 GLU 13 3HG GLU 13 2.361 -16.359 -8.131 115 H LEU 14 H LEU 14 3.005 -12.100 -7.367 116 HA LEU 14 HA LEU 14 5.453 -10.657 -7.027 117 HB2 LEU 14 2HB LEU 14 3.855 -10.017 -8.762 118 HB3 LEU 14 3HB LEU 14 2.609 -9.715 -7.564 119 HG LEU 14 HG LEU 14 3.795 -7.748 -6.733 120 HD11 LEU 14 1HD1 LEU 14 5.877 -6.914 -7.742 121 HD12 LEU 14 2HD1 LEU 14 6.008 -8.382 -8.709 122 HD13 LEU 14 3HD1 LEU 14 6.109 -8.469 -6.951 123 HD21 LEU 14 3HD2 LEU 14 3.623 -6.294 -8.700 124 HD22 LEU 14 1HD2 LEU 14 2.288 -7.442 -8.639 125 HD23 LEU 14 2HD2 LEU 14 3.623 -7.702 -9.765 126 H ILE 15 H ILE 15 2.426 -10.943 -5.127 127 HA ILE 15 HA ILE 15 2.906 -9.115 -3.075 128 HB ILE 15 HB ILE 15 1.589 -11.873 -2.769 129 HG12 ILE 15 2HG1 ILE 15 0.341 -9.151 -3.334 130 HG13 ILE 15 3HG1 ILE 15 0.467 -10.481 -4.474 131 HG21 ILE 15 1HG2 ILE 15 0.478 -10.950 -0.776 132 HG22 ILE 15 2HG2 ILE 15 1.381 -9.445 -0.958 133 HG23 ILE 15 3HG2 ILE 15 2.232 -10.945 -0.589 134 HD11 ILE 15 3HD1 ILE 15 -1.771 -10.321 -3.632 135 HD12 ILE 15 1HD1 ILE 15 -1.193 -10.411 -1.969 136 HD13 ILE 15 2HD1 ILE 15 -1.033 -11.809 -3.036 137 H LYS 16 H LYS 16 3.896 -12.514 -3.334 138 HA LYS 16 HA LYS 16 5.240 -12.927 -0.946 139 HB2 LYS 16 2HB LYS 16 5.798 -14.072 -3.717 140 HB3 LYS 16 3HB LYS 16 6.555 -14.679 -2.247 141 HG2 LYS 16 2HG LYS 16 4.406 -15.405 -1.368 142 HG3 LYS 16 3HG LYS 16 3.559 -14.641 -2.713 143 HD2 LYS 16 2HD LYS 16 3.720 -17.078 -3.034 144 HD3 LYS 16 3HD LYS 16 4.586 -16.207 -4.300 145 HE2 LYS 16 2HE LYS 16 5.881 -18.134 -3.579 146 HE3 LYS 16 3HE LYS 16 6.724 -16.659 -3.111 147 HZ1 LYS 16 3HZ LYS 16 5.083 -18.388 -1.337 148 HZ2 LYS 16 1HZ LYS 16 5.818 -16.942 -0.863 149 HZ3 LYS 16 2HZ LYS 16 6.768 -18.258 -1.325 150 H LYS 17 H LYS 17 6.501 -11.598 -3.995 151 HA LYS 17 HA LYS 17 9.236 -11.474 -3.172 152 HB2 LYS 17 2HB LYS 17 7.808 -10.061 -5.473 153 HB3 LYS 17 3HB LYS 17 9.559 -10.171 -5.271 154 HG2 LYS 17 2HG LYS 17 9.451 -12.628 -5.472 155 HG3 LYS 17 3HG LYS 17 7.697 -12.545 -5.627 156 HD2 LYS 17 2HD LYS 17 8.680 -12.845 -7.837 157 HD3 LYS 17 3HD LYS 17 7.965 -11.233 -7.736 158 HE2 LYS 17 2HE LYS 17 10.174 -10.253 -7.373 159 HE3 LYS 17 3HE LYS 17 10.909 -11.856 -7.372 160 HZ1 LYS 17 3HZ LYS 17 10.210 -12.140 -9.675 161 HZ2 LYS 17 1HZ LYS 17 11.194 -10.779 -9.508 162 HZ3 LYS 17 2HZ LYS 17 9.523 -10.597 -9.690 163 H ILE 18 H ILE 18 6.568 -9.145 -3.159 164 HA ILE 18 HA ILE 18 8.110 -6.851 -2.432 165 HB ILE 18 HB ILE 18 5.110 -7.404 -2.220 166 HG12 ILE 18 2HG1 ILE 18 6.717 -5.737 -4.231 167 HG13 ILE 18 3HG1 ILE 18 6.092 -7.353 -4.533 168 HG21 ILE 18 1HG2 ILE 18 6.552 -4.755 -1.801 169 HG22 ILE 18 2HG2 ILE 18 5.690 -5.681 -0.569 170 HG23 ILE 18 3HG2 ILE 18 4.803 -4.965 -1.913 171 HD11 ILE 18 3HD1 ILE 18 3.809 -6.506 -4.324 172 HD12 ILE 18 1HD1 ILE 18 4.719 -5.687 -5.591 173 HD13 ILE 18 2HD1 ILE 18 4.441 -4.879 -4.049 174 H LYS 19 H LYS 19 6.448 -9.400 -0.555 175 HA LYS 19 HA LYS 19 6.881 -8.390 2.042 176 HB2 LYS 19 2HB LYS 19 6.554 -11.185 0.951 177 HB3 LYS 19 3HB LYS 19 7.255 -11.035 2.555 178 HG2 LYS 19 2HG LYS 19 4.926 -11.399 2.825 179 HG3 LYS 19 3HG LYS 19 5.249 -9.713 3.248 180 HD2 LYS 19 2HD LYS 19 4.470 -9.035 0.974 181 HD3 LYS 19 3HD LYS 19 4.091 -10.726 0.627 182 HE2 LYS 19 2HE LYS 19 2.842 -8.988 2.748 183 HE3 LYS 19 3HE LYS 19 2.081 -9.558 1.270 184 HZ1 LYS 19 3HZ LYS 19 3.021 -11.300 3.485 185 HZ2 LYS 19 1HZ LYS 19 2.224 -11.817 2.087 186 HZ3 LYS 19 2HZ LYS 19 1.417 -10.854 3.217 187 H LYS 20 H LYS 20 8.962 -10.449 -0.005 188 HA LYS 20 HA LYS 20 11.095 -10.767 1.784 189 HB2 LYS 20 2HB LYS 20 11.361 -10.688 -1.256 190 HB3 LYS 20 3HB LYS 20 12.482 -11.433 -0.123 191 HG2 LYS 20 2HG LYS 20 9.684 -12.347 -0.816 192 HG3 LYS 20 3HG LYS 20 11.197 -13.172 -1.178 193 HD2 LYS 20 2HD LYS 20 9.988 -12.772 1.592 194 HD3 LYS 20 3HD LYS 20 9.979 -14.271 0.665 195 HE2 LYS 20 2HE LYS 20 12.439 -12.871 1.771 196 HE3 LYS 20 3HE LYS 20 11.707 -14.347 2.395 197 HZ1 LYS 20 3HZ LYS 20 12.956 -14.037 -0.286 198 HZ2 LYS 20 1HZ LYS 20 12.242 -15.449 0.309 199 HZ3 LYS 20 2HZ LYS 20 13.634 -14.834 1.041 200 H GLU 21 H GLU 21 10.496 -8.194 -0.578 201 HA GLU 21 HA GLU 21 12.852 -6.705 -0.270 202 HB2 GLU 21 2HB GLU 21 10.026 -5.798 -0.943 203 HB3 GLU 21 3HB GLU 21 11.413 -4.717 -0.983 204 HG2 GLU 21 2HG GLU 21 11.001 -7.174 -2.707 205 HG3 GLU 21 3HG GLU 21 10.872 -5.493 -3.223 206 H VAL 22 H VAL 22 9.731 -6.391 1.504 207 HA VAL 22 HA VAL 22 10.736 -4.257 3.164 208 HB VAL 22 HB VAL 22 8.615 -4.199 4.257 209 HG11 VAL 22 1HG1 VAL 22 7.039 -3.976 2.363 210 HG12 VAL 22 2HG1 VAL 22 8.186 -4.822 1.322 211 HG13 VAL 22 3HG1 VAL 22 8.612 -3.261 2.020 212 HG21 VAL 22 3HG2 VAL 22 6.834 -5.886 3.956 213 HG22 VAL 22 1HG2 VAL 22 8.264 -6.561 4.743 214 HG23 VAL 22 2HG2 VAL 22 7.955 -6.897 3.040 215 H GLU 23 H GLU 23 10.825 -7.723 3.443 216 HA GLU 23 HA GLU 23 11.110 -7.969 6.273 217 HB2 GLU 23 2HB GLU 23 12.080 -9.782 4.022 218 HB3 GLU 23 3HB GLU 23 12.220 -10.194 5.725 219 HG2 GLU 23 2HG GLU 23 9.655 -9.809 4.166 220 HG3 GLU 23 3HG GLU 23 10.329 -11.334 4.723 221 H ASN 24 H ASN 24 13.386 -7.636 3.603 222 HA ASN 24 HA ASN 24 15.825 -7.643 4.996 223 HB2 ASN 24 2HB ASN 24 15.003 -6.287 2.379 224 HB3 ASN 24 3HB ASN 24 16.669 -6.345 2.956 225 HD21 ASN 24 1HD2 ASN 24 17.139 -7.454 0.974 226 HD22 ASN 24 2HD2 ASN 24 16.840 -9.149 0.823 227 H GLN 25 H GLN 25 13.387 -5.188 4.673 228 HA GLN 25 HA GLN 25 15.125 -3.006 5.614 229 HB2 GLN 25 2HB GLN 25 12.244 -2.952 4.619 230 HB3 GLN 25 3HB GLN 25 13.238 -1.546 4.989 231 HG2 GLN 25 2HG GLN 25 13.838 -3.569 2.812 232 HG3 GLN 25 3HG GLN 25 13.068 -2.007 2.556 233 HE21 GLN 25 1HE2 GLN 25 16.083 -3.633 3.305 234 HE22 GLN 25 2HE2 GLN 25 17.107 -2.266 3.044 235 H GLY 26 H GLY 26 12.818 -5.227 6.850 236 HA2 GLY 26 2HA GLY 26 12.368 -5.665 9.075 237 HA3 GLY 26 3HA GLY 26 13.132 -4.153 9.524 238 H TYR 27 H TYR 27 10.568 -4.243 7.134 239 HA TYR 27 HA TYR 27 8.712 -2.761 8.809 240 HB2 TYR 27 2HB TYR 27 8.449 -3.903 5.993 241 HB3 TYR 27 3HB TYR 27 7.138 -3.063 6.805 242 HD1 TYR 27 HD1 TYR 27 10.810 -2.204 6.526 243 HD2 TYR 27 HD2 TYR 27 6.785 -1.079 5.614 244 HE1 TYR 27 HE1 TYR 27 11.613 -0.097 5.547 245 HE2 TYR 27 HE2 TYR 27 7.594 1.029 4.642 246 HH TYR 27 HH TYR 27 10.783 1.584 3.830 247 H GLN 28 H GLN 28 6.697 -3.530 9.562 248 HA GLN 28 HA GLN 28 6.366 -6.400 9.930 249 HB2 GLN 28 2HB GLN 28 4.412 -4.148 10.634 250 HB3 GLN 28 3HB GLN 28 4.270 -5.832 11.120 251 HG2 GLN 28 2HG GLN 28 5.028 -4.650 13.018 252 HG3 GLN 28 3HG GLN 28 6.421 -5.544 12.424 253 HE21 GLN 28 1HE2 GLN 28 4.921 -2.382 12.545 254 HE22 GLN 28 2HE2 GLN 28 6.355 -1.469 12.296 255 H VAL 29 H VAL 29 4.377 -7.493 9.211 256 HA VAL 29 HA VAL 29 3.221 -6.393 6.707 257 HB VAL 29 HB VAL 29 4.271 -9.259 7.060 258 HG11 VAL 29 1HG1 VAL 29 2.765 -8.030 4.713 259 HG12 VAL 29 2HG1 VAL 29 2.152 -9.262 5.821 260 HG13 VAL 29 3HG1 VAL 29 3.494 -9.639 4.746 261 HG21 VAL 29 3HG2 VAL 29 5.187 -7.058 5.154 262 HG22 VAL 29 1HG2 VAL 29 5.789 -8.720 5.178 263 HG23 VAL 29 2HG2 VAL 29 6.077 -7.659 6.555 264 H ARG 30 H ARG 30 1.145 -6.078 7.278 265 HA ARG 30 HA ARG 30 -0.360 -8.306 8.514 266 HB2 ARG 30 2HB ARG 30 -0.731 -6.144 9.624 267 HB3 ARG 30 3HB ARG 30 -1.140 -5.386 8.087 268 HG2 ARG 30 2HG ARG 30 -3.172 -5.836 9.352 269 HG3 ARG 30 3HG ARG 30 -3.139 -6.834 7.900 270 HD2 ARG 30 2HD ARG 30 -2.116 -8.671 9.509 271 HD3 ARG 30 3HD ARG 30 -2.805 -7.659 10.787 272 HE ARG 30 HE ARG 30 -4.715 -8.226 8.740 273 HH11 ARG 30 1HH1 ARG 30 -3.166 -9.690 11.570 274 HH12 ARG 30 2HH1 ARG 30 -4.486 -10.786 11.851 275 HH21 ARG 30 1HH2 ARG 30 -6.353 -9.745 9.073 276 HH22 ARG 30 2HH2 ARG 30 -6.284 -10.816 10.440 277 H ASP 31 H ASP 31 -1.287 -9.645 7.105 278 HA ASP 31 HA ASP 31 -2.133 -8.822 4.425 279 HB2 ASP 31 2HB ASP 31 -2.172 -11.505 5.887 280 HB3 ASP 31 3HB ASP 31 -2.809 -11.284 4.258 281 H VAL 32 H VAL 32 -4.053 -8.002 4.109 282 HA VAL 32 HA VAL 32 -6.331 -8.548 5.934 283 HB VAL 32 HB VAL 32 -5.867 -6.162 4.061 284 HG11 VAL 32 1HG1 VAL 32 -7.922 -5.185 5.046 285 HG12 VAL 32 2HG1 VAL 32 -8.215 -6.682 5.935 286 HG13 VAL 32 3HG1 VAL 32 -8.257 -6.678 4.171 287 HG21 VAL 32 3HG2 VAL 32 -4.430 -6.069 6.046 288 HG22 VAL 32 1HG2 VAL 32 -5.826 -6.285 7.106 289 HG23 VAL 32 2HG2 VAL 32 -5.673 -4.821 6.130 290 H ASN 33 H ASN 33 -7.982 -9.684 5.103 291 HA ASN 33 HA ASN 33 -8.242 -10.097 2.167 292 HB2 ASN 33 2HB ASN 33 -9.447 -11.784 4.429 293 HB3 ASN 33 3HB ASN 33 -9.495 -12.155 2.708 294 HD21 ASN 33 1HD2 ASN 33 -7.479 -12.006 5.559 295 HD22 ASN 33 2HD2 ASN 33 -6.206 -13.007 4.949 296 H ASP 34 H ASP 34 -10.064 -9.598 5.160 297 HA ASP 34 HA ASP 34 -12.468 -8.747 3.648 298 HB2 ASP 34 2HB ASP 34 -12.759 -10.846 4.919 299 HB3 ASP 34 3HB ASP 34 -12.228 -10.049 6.395 300 H SER 35 H SER 35 -13.837 -7.166 4.659 301 HA SER 35 HA SER 35 -12.618 -4.752 5.329 302 HB2 SER 35 2HB SER 35 -15.509 -5.557 5.869 303 HB3 SER 35 3HB SER 35 -14.896 -3.918 5.637 304 HG SER 35 HG SER 35 -14.803 -4.228 3.531 305 H ASP 36 H ASP 36 -13.779 -7.329 7.414 306 HA ASP 36 HA ASP 36 -13.820 -6.108 9.923 307 HB2 ASP 36 2HB ASP 36 -14.626 -8.341 9.874 308 HB3 ASP 36 3HB ASP 36 -13.212 -8.944 9.020 309 H GLU 37 H GLU 37 -11.095 -7.782 8.333 310 HA GLU 37 HA GLU 37 -9.159 -7.331 10.327 311 HB2 GLU 37 2HB GLU 37 -8.804 -7.777 7.337 312 HB3 GLU 37 3HB GLU 37 -7.515 -7.924 8.531 313 HG2 GLU 37 2HG GLU 37 -8.533 -9.840 9.539 314 HG3 GLU 37 3HG GLU 37 -10.041 -9.602 8.651 315 H LEU 38 H LEU 38 -10.121 -5.448 7.502 316 HA LEU 38 HA LEU 38 -8.174 -3.464 7.415 317 HB2 LEU 38 2HB LEU 38 -9.901 -3.695 5.676 318 HB3 LEU 38 3HB LEU 38 -11.158 -3.282 6.830 319 HG LEU 38 HG LEU 38 -10.115 -0.974 7.040 320 HD11 LEU 38 1HD1 LEU 38 -7.865 -1.480 6.297 321 HD12 LEU 38 2HD1 LEU 38 -8.575 -0.205 5.313 322 HD13 LEU 38 3HD1 LEU 38 -8.452 -1.845 4.671 323 HD21 LEU 38 3HD2 LEU 38 -12.102 -1.339 5.655 324 HD22 LEU 38 1HD2 LEU 38 -11.083 -1.713 4.263 325 HD23 LEU 38 2HD2 LEU 38 -11.063 -0.094 4.968 326 H LYS 39 H LYS 39 -11.377 -3.240 9.083 327 HA LYS 39 HA LYS 39 -10.800 -0.716 10.237 328 HB2 LYS 39 2HB LYS 39 -12.900 -1.030 11.585 329 HB3 LYS 39 3HB LYS 39 -13.093 -1.209 9.854 330 HG2 LYS 39 2HG LYS 39 -14.449 -2.886 10.708 331 HG3 LYS 39 3HG LYS 39 -12.977 -3.751 10.275 332 HD2 LYS 39 2HD LYS 39 -12.280 -3.692 12.680 333 HD3 LYS 39 3HD LYS 39 -13.801 -2.881 13.076 334 HE2 LYS 39 2HE LYS 39 -15.083 -4.810 12.407 335 HE3 LYS 39 3HE LYS 39 -13.658 -5.594 11.728 336 HZ1 LYS 39 3HZ LYS 39 -12.796 -5.376 14.168 337 HZ2 LYS 39 1HZ LYS 39 -13.831 -6.643 13.728 338 HZ3 LYS 39 2HZ LYS 39 -14.443 -5.292 14.534 339 H LYS 40 H LYS 40 -10.291 -3.998 11.464 340 HA LYS 40 HA LYS 40 -9.831 -3.459 14.185 341 HB2 LYS 40 2HB LYS 40 -8.466 -5.504 12.407 342 HB3 LYS 40 3HB LYS 40 -8.291 -5.445 14.158 343 HG2 LYS 40 2HG LYS 40 -10.884 -5.645 14.193 344 HG3 LYS 40 3HG LYS 40 -10.711 -6.187 12.525 345 HD2 LYS 40 2HD LYS 40 -9.457 -7.447 14.980 346 HD3 LYS 40 3HD LYS 40 -10.827 -8.081 14.072 347 HE2 LYS 40 2HE LYS 40 -8.993 -9.384 13.359 348 HE3 LYS 40 3HE LYS 40 -9.200 -8.213 12.059 349 HZ1 LYS 40 3HZ LYS 40 -7.314 -6.995 12.823 350 HZ2 LYS 40 1HZ LYS 40 -6.856 -8.619 12.816 351 HZ3 LYS 40 2HZ LYS 40 -7.241 -7.862 14.274 352 H GLU 41 H GLU 41 -7.534 -3.482 11.439 353 HA GLU 41 HA GLU 41 -5.265 -2.739 12.968 354 HB2 GLU 41 2HB GLU 41 -5.575 -2.275 9.970 355 HB3 GLU 41 3HB GLU 41 -4.080 -2.446 10.882 356 HG2 GLU 41 2HG GLU 41 -6.060 -4.572 10.101 357 HG3 GLU 41 3HG GLU 41 -4.351 -4.477 9.715 358 H MET 42 H MET 42 -7.697 -0.879 11.178 359 HA MET 42 HA MET 42 -6.429 1.642 11.164 360 HB2 MET 42 2HB MET 42 -9.375 0.889 11.075 361 HB3 MET 42 3HB MET 42 -8.816 2.546 10.894 362 HG2 MET 42 2HG MET 42 -7.629 0.500 9.067 363 HG3 MET 42 3HG MET 42 -9.301 0.967 8.796 364 HE1 MET 42 3HE MET 42 -5.703 3.878 8.388 365 HE2 MET 42 1HE MET 42 -5.533 2.156 8.729 366 HE3 MET 42 2HE MET 42 -6.159 3.245 9.968 367 H LYS 43 H LYS 43 -8.627 0.170 13.573 368 HA LYS 43 HA LYS 43 -8.684 2.323 15.421 369 HB2 LYS 43 2HB LYS 43 -9.192 -0.648 15.657 370 HB3 LYS 43 3HB LYS 43 -8.988 0.269 17.136 371 HG2 LYS 43 2HG LYS 43 -11.342 -0.008 16.670 372 HG3 LYS 43 3HG LYS 43 -10.913 1.696 16.523 373 HD2 LYS 43 2HD LYS 43 -11.005 1.586 14.114 374 HD3 LYS 43 3HD LYS 43 -11.141 -0.172 14.147 375 HE2 LYS 43 2HE LYS 43 -13.303 0.867 13.651 376 HE3 LYS 43 3HE LYS 43 -13.368 0.006 15.187 377 HZ1 LYS 43 3HZ LYS 43 -13.154 2.105 16.345 378 HZ2 LYS 43 1HZ LYS 43 -14.453 2.179 15.267 379 HZ3 LYS 43 2HZ LYS 43 -12.997 2.938 14.883 380 H LYS 44 H LYS 44 -6.488 -0.480 15.078 381 HA LYS 44 HA LYS 44 -4.905 -0.036 17.369 382 HB2 LYS 44 2HB LYS 44 -4.133 -1.428 14.769 383 HB3 LYS 44 3HB LYS 44 -3.201 -1.510 16.256 384 HG2 LYS 44 2HG LYS 44 -6.072 -2.445 16.193 385 HG3 LYS 44 3HG LYS 44 -4.777 -3.478 15.607 386 HD2 LYS 44 2HD LYS 44 -5.219 -4.136 17.862 387 HD3 LYS 44 3HD LYS 44 -3.683 -3.277 17.880 388 HE2 LYS 44 2HE LYS 44 -5.118 -2.704 19.818 389 HE3 LYS 44 3HE LYS 44 -4.771 -1.296 18.817 390 HZ1 LYS 44 3HZ LYS 44 -7.289 -2.878 18.760 391 HZ2 LYS 44 1HZ LYS 44 -6.963 -1.513 17.818 392 HZ3 LYS 44 2HZ LYS 44 -7.089 -1.369 19.495 393 H LEU 45 H LEU 45 -4.655 1.288 14.091 394 HA LEU 45 HA LEU 45 -2.029 2.417 14.446 395 HB2 LEU 45 2HB LEU 45 -4.161 3.015 12.351 396 HB3 LEU 45 3HB LEU 45 -2.498 3.585 12.281 397 HG LEU 45 HG LEU 45 -3.361 0.667 12.182 398 HD11 LEU 45 1HD1 LEU 45 -2.340 2.430 9.944 399 HD12 LEU 45 2HD1 LEU 45 -3.983 1.813 10.135 400 HD13 LEU 45 3HD1 LEU 45 -2.656 0.695 9.835 401 HD21 LEU 45 3HD2 LEU 45 -1.017 0.151 11.647 402 HD22 LEU 45 1HD2 LEU 45 -1.180 0.873 13.247 403 HD23 LEU 45 2HD2 LEU 45 -0.583 1.843 11.898 404 H ALA 46 H ALA 46 -5.356 3.559 14.836 405 HA ALA 46 HA ALA 46 -4.728 6.303 15.378 406 HB1 ALA 46 3HB ALA 46 -7.053 6.452 16.184 407 HB2 ALA 46 1HB ALA 46 -7.187 4.689 16.150 408 HB3 ALA 46 2HB ALA 46 -6.963 5.588 14.650 409 H GLU 47 H GLU 47 -5.127 3.435 17.456 410 HA GLU 47 HA GLU 47 -5.150 4.920 19.951 411 HB2 GLU 47 2HB GLU 47 -5.103 1.922 19.376 412 HB3 GLU 47 3HB GLU 47 -5.241 2.614 20.990 413 HG2 GLU 47 2HG GLU 47 -7.394 3.611 20.437 414 HG3 GLU 47 3HG GLU 47 -7.245 3.088 18.760 415 H GLU 48 H GLU 48 -2.950 2.571 18.415 416 HA GLU 48 HA GLU 48 -1.023 2.656 20.562 417 HB2 GLU 48 2HB GLU 48 -0.835 1.362 17.803 418 HB3 GLU 48 3HB GLU 48 0.287 1.102 19.135 419 HG2 GLU 48 2HG GLU 48 -2.661 0.403 19.205 420 HG3 GLU 48 3HG GLU 48 -1.372 -0.741 18.835 421 H LYS 49 H LYS 49 1.382 2.871 19.843 422 HA LYS 49 HA LYS 49 1.751 5.668 19.560 423 HB2 LYS 49 2HB LYS 49 3.719 3.355 19.782 424 HB3 LYS 49 3HB LYS 49 4.251 5.023 19.637 425 HG2 LYS 49 2HG LYS 49 4.319 4.419 21.964 426 HG3 LYS 49 3HG LYS 49 3.010 5.577 21.735 427 HD2 LYS 49 2HD LYS 49 1.381 3.668 21.756 428 HD3 LYS 49 3HD LYS 49 2.720 2.564 22.085 429 HE2 LYS 49 2HE LYS 49 3.177 3.729 24.200 430 HE3 LYS 49 3HE LYS 49 1.889 4.886 23.857 431 HZ1 LYS 49 3HZ LYS 49 1.529 1.966 24.303 432 HZ2 LYS 49 1HZ LYS 49 0.295 3.058 23.929 433 HZ3 LYS 49 2HZ LYS 49 1.130 3.200 25.389 434 H ASN 50 H ASN 50 1.969 6.843 17.785 435 HA ASN 50 HA ASN 50 1.470 5.474 15.278 436 HB2 ASN 50 2HB ASN 50 0.171 7.492 16.316 437 HB3 ASN 50 3HB ASN 50 1.459 8.488 15.658 438 HD21 ASN 50 1HD2 ASN 50 -1.321 6.542 14.921 439 HD22 ASN 50 2HD2 ASN 50 -1.440 6.968 13.253 440 H PHE 51 H PHE 51 4.394 5.757 16.402 441 HA PHE 51 HA PHE 51 5.433 6.288 13.667 442 HB2 PHE 51 2HB PHE 51 6.665 7.593 15.401 443 HB3 PHE 51 3HB PHE 51 7.077 6.102 16.244 444 HD1 PHE 51 HD2 PHE 51 7.495 7.860 12.953 445 HD2 PHE 51 HD1 PHE 51 9.081 4.914 15.608 446 HE1 PHE 51 HE2 PHE 51 9.469 7.612 11.506 447 HE2 PHE 51 HE1 PHE 51 11.056 4.665 14.150 448 HZ PHE 51 HZ PHE 51 11.246 6.018 12.102 449 H GLU 52 H GLU 52 5.312 4.421 12.578 450 HA GLU 52 HA GLU 52 7.305 2.505 12.996 451 HB2 GLU 52 2HB GLU 52 4.612 1.617 13.947 452 HB3 GLU 52 3HB GLU 52 5.335 0.513 12.788 453 HG2 GLU 52 2HG GLU 52 6.464 1.342 15.479 454 HG3 GLU 52 3HG GLU 52 5.910 -0.257 14.986 455 H LYS 53 H LYS 53 7.584 1.117 11.205 456 HA LYS 53 HA LYS 53 6.236 2.026 8.731 457 HB2 LYS 53 2HB LYS 53 8.904 0.595 9.120 458 HB3 LYS 53 3HB LYS 53 8.233 1.091 7.570 459 HG2 LYS 53 2HG LYS 53 8.297 3.480 8.412 460 HG3 LYS 53 3HG LYS 53 9.191 2.894 9.816 461 HD2 LYS 53 2HD LYS 53 10.080 2.585 6.921 462 HD3 LYS 53 3HD LYS 53 10.661 3.829 8.028 463 HE2 LYS 53 2HE LYS 53 10.990 0.849 8.514 464 HE3 LYS 53 3HE LYS 53 12.208 1.872 7.757 465 HZ1 LYS 53 3HZ LYS 53 12.631 1.557 10.110 466 HZ2 LYS 53 1HZ LYS 53 11.139 2.261 10.497 467 HZ3 LYS 53 2HZ LYS 53 12.342 3.179 9.754 468 H ILE 54 H ILE 54 4.623 0.728 8.133 469 HA ILE 54 HA ILE 54 4.813 -2.213 8.521 470 HB ILE 54 HB ILE 54 2.268 -0.539 8.912 471 HG12 ILE 54 2HG1 ILE 54 3.969 -1.933 11.045 472 HG13 ILE 54 3HG1 ILE 54 3.885 -0.195 10.785 473 HG21 ILE 54 1HG2 ILE 54 1.805 -2.803 8.045 474 HG22 ILE 54 2HG2 ILE 54 1.241 -2.649 9.706 475 HG23 ILE 54 3HG2 ILE 54 2.737 -3.522 9.362 476 HD11 ILE 54 3HD1 ILE 54 1.607 -1.958 11.681 477 HD12 ILE 54 1HD1 ILE 54 1.516 -0.215 11.403 478 HD13 ILE 54 2HD1 ILE 54 2.550 -0.853 12.679 479 H LEU 55 H LEU 55 4.656 -3.212 6.617 480 HA LEU 55 HA LEU 55 3.370 -2.190 4.251 481 HB2 LEU 55 2HB LEU 55 5.318 -3.858 4.287 482 HB3 LEU 55 3HB LEU 55 4.204 -5.060 4.915 483 HG LEU 55 HG LEU 55 2.802 -4.617 2.759 484 HD11 LEU 55 1HD1 LEU 55 5.404 -3.331 1.924 485 HD12 LEU 55 2HD1 LEU 55 3.808 -2.580 2.022 486 HD13 LEU 55 3HD1 LEU 55 4.121 -3.828 0.823 487 HD21 LEU 55 3HD2 LEU 55 4.060 -6.238 1.441 488 HD22 LEU 55 1HD2 LEU 55 4.038 -6.715 3.138 489 HD23 LEU 55 2HD2 LEU 55 5.492 -5.995 2.444 490 H ILE 56 H ILE 56 1.177 -2.236 3.973 491 HA ILE 56 HA ILE 56 -0.416 -4.391 5.260 492 HB ILE 56 HB ILE 56 -1.446 -1.767 4.070 493 HG12 ILE 56 2HG1 ILE 56 -0.215 -1.382 6.218 494 HG13 ILE 56 3HG1 ILE 56 -1.930 -1.020 6.359 495 HG21 ILE 56 1HG2 ILE 56 -3.093 -3.557 3.844 496 HG22 ILE 56 2HG2 ILE 56 -3.630 -2.423 5.081 497 HG23 ILE 56 3HG2 ILE 56 -2.934 -3.975 5.552 498 HD11 ILE 56 3HD1 ILE 56 -1.077 -2.141 8.336 499 HD12 ILE 56 1HD1 ILE 56 -0.568 -3.519 7.362 500 HD13 ILE 56 2HD1 ILE 56 -2.285 -3.139 7.528 501 H LYS 57 H LYS 57 -0.664 -6.042 3.886 502 HA LYS 57 HA LYS 57 -0.980 -5.662 0.990 503 HB2 LYS 57 2HB LYS 57 0.408 -7.557 1.658 504 HB3 LYS 57 3HB LYS 57 -0.812 -8.158 2.768 505 HG2 LYS 57 2HG LYS 57 -1.463 -8.005 -0.180 506 HG3 LYS 57 3HG LYS 57 -0.421 -9.305 0.391 507 HD2 LYS 57 2HD LYS 57 -2.177 -10.143 1.862 508 HD3 LYS 57 3HD LYS 57 -3.208 -8.761 1.498 509 HE2 LYS 57 2HE LYS 57 -3.299 -9.537 -0.885 510 HE3 LYS 57 3HE LYS 57 -2.387 -10.972 -0.406 511 HZ1 LYS 57 3HZ LYS 57 -4.206 -11.492 1.168 512 HZ2 LYS 57 1HZ LYS 57 -4.708 -11.499 -0.446 513 HZ3 LYS 57 2HZ LYS 57 -5.093 -10.192 0.555 514 H SER 58 H SER 58 -2.941 -5.795 -0.014 515 HA SER 58 HA SER 58 -5.104 -7.363 1.010 516 HB2 SER 58 2HB SER 58 -5.618 -5.381 2.346 517 HB3 SER 58 3HB SER 58 -5.460 -4.332 0.942 518 HG SER 58 HG SER 58 -7.460 -4.772 0.433 519 H ASN 59 H ASN 59 -5.815 -8.336 -0.750 520 HA ASN 59 HA ASN 59 -5.097 -7.438 -3.389 521 HB2 ASN 59 2HB ASN 59 -6.206 -9.572 -4.171 522 HB3 ASN 59 3HB ASN 59 -4.886 -9.795 -3.035 523 HD21 ASN 59 1HD2 ASN 59 -7.523 -11.271 -3.804 524 HD22 ASN 59 2HD2 ASN 59 -8.149 -11.743 -2.265 525 H ASP 60 H ASP 60 -7.825 -6.937 -1.402 526 HA ASP 60 HA ASP 60 -9.532 -6.087 -3.653 527 HB2 ASP 60 2HB ASP 60 -10.608 -7.316 -1.749 528 HB3 ASP 60 3HB ASP 60 -10.114 -6.038 -0.642 529 H LYS 61 H LYS 61 -9.257 -4.064 -4.380 530 HA LYS 61 HA LYS 61 -7.488 -2.224 -3.022 531 HB2 LYS 61 2HB LYS 61 -8.193 -0.758 -5.202 532 HB3 LYS 61 3HB LYS 61 -6.953 -2.000 -5.233 533 HG2 LYS 61 2HG LYS 61 -8.604 -3.616 -6.095 534 HG3 LYS 61 3HG LYS 61 -9.834 -2.352 -6.093 535 HD2 LYS 61 2HD LYS 61 -8.854 -1.207 -7.897 536 HD3 LYS 61 3HD LYS 61 -7.263 -1.936 -7.633 537 HE2 LYS 61 2HE LYS 61 -8.500 -2.786 -9.667 538 HE3 LYS 61 3HE LYS 61 -7.971 -4.034 -8.544 539 HZ1 LYS 61 3HZ LYS 61 -10.217 -4.407 -9.350 540 HZ2 LYS 61 1HZ LYS 61 -10.726 -2.931 -8.702 541 HZ3 LYS 61 2HZ LYS 61 -10.207 -4.173 -7.677 542 H GLN 62 H GLN 62 -10.932 -2.563 -3.143 543 HA GLN 62 HA GLN 62 -11.631 0.189 -2.829 544 HB2 GLN 62 2HB GLN 62 -13.145 -2.317 -1.983 545 HB3 GLN 62 3HB GLN 62 -13.806 -0.685 -1.887 546 HG2 GLN 62 2HG GLN 62 -12.993 -2.161 -4.408 547 HG3 GLN 62 3HG GLN 62 -14.632 -1.782 -3.885 548 HE21 GLN 62 1HE2 GLN 62 -11.693 -0.488 -5.275 549 HE22 GLN 62 2HE2 GLN 62 -12.365 1.019 -5.787 550 H LEU 63 H LEU 63 -10.860 -2.429 -0.572 551 HA LEU 63 HA LEU 63 -11.261 -1.191 1.885 552 HB2 LEU 63 2HB LEU 63 -9.093 -3.195 1.123 553 HB3 LEU 63 3HB LEU 63 -9.512 -2.770 2.777 554 HG LEU 63 HG LEU 63 -11.310 -4.198 0.781 555 HD11 LEU 63 1HD1 LEU 63 -9.548 -5.639 1.669 556 HD12 LEU 63 2HD1 LEU 63 -11.122 -6.124 2.293 557 HD13 LEU 63 3HD1 LEU 63 -10.006 -5.222 3.324 558 HD21 LEU 63 3HD2 LEU 63 -12.656 -2.715 2.177 559 HD22 LEU 63 1HD2 LEU 63 -11.927 -3.388 3.639 560 HD23 LEU 63 2HD2 LEU 63 -12.944 -4.398 2.609 561 H LEU 64 H LEU 64 -8.578 -0.806 -0.377 562 HA LEU 64 HA LEU 64 -6.799 0.521 1.459 563 HB2 LEU 64 2HB LEU 64 -6.697 0.223 -1.572 564 HB3 LEU 64 3HB LEU 64 -5.501 1.134 -0.662 565 HG LEU 64 HG LEU 64 -4.942 -0.961 0.629 566 HD11 LEU 64 1HD1 LEU 64 -6.730 -2.310 -1.390 567 HD12 LEU 64 2HD1 LEU 64 -6.970 -2.220 0.356 568 HD13 LEU 64 3HD1 LEU 64 -5.614 -3.130 -0.301 569 HD21 LEU 64 3HD2 LEU 64 -4.569 -1.162 -2.370 570 HD22 LEU 64 1HD2 LEU 64 -3.615 -1.998 -1.139 571 HD23 LEU 64 2HD2 LEU 64 -3.561 -0.242 -1.253 572 H LYS 65 H LYS 65 -9.043 1.665 -1.128 573 HA LYS 65 HA LYS 65 -8.317 4.400 -0.967 574 HB2 LYS 65 2HB LYS 65 -9.591 3.171 -2.837 575 HB3 LYS 65 3HB LYS 65 -11.024 3.293 -1.826 576 HG2 LYS 65 2HG LYS 65 -10.815 5.775 -1.872 577 HG3 LYS 65 3HG LYS 65 -9.393 5.612 -2.908 578 HD2 LYS 65 2HD LYS 65 -11.239 6.100 -4.331 579 HD3 LYS 65 3HD LYS 65 -10.851 4.408 -4.592 580 HE2 LYS 65 2HE LYS 65 -13.276 4.749 -4.461 581 HE3 LYS 65 3HE LYS 65 -12.719 3.754 -3.115 582 HZ1 LYS 65 3HZ LYS 65 -14.318 5.453 -2.427 583 HZ2 LYS 65 1HZ LYS 65 -13.289 6.671 -2.978 584 HZ3 LYS 65 2HZ LYS 65 -12.823 5.695 -1.679 585 H GLU 66 H GLU 66 -10.903 2.460 0.500 586 HA GLU 66 HA GLU 66 -12.205 4.418 2.046 587 HB2 GLU 66 2HB GLU 66 -11.874 1.426 2.565 588 HB3 GLU 66 3HB GLU 66 -13.011 2.467 3.418 589 HG2 GLU 66 2HG GLU 66 -14.213 2.903 1.312 590 HG3 GLU 66 3HG GLU 66 -13.057 1.909 0.433 591 H MET 67 H MET 67 -9.385 2.389 2.675 592 HA MET 67 HA MET 67 -8.921 2.969 5.395 593 HB2 MET 67 2HB MET 67 -7.800 1.132 4.040 594 HB3 MET 67 3HB MET 67 -6.813 2.359 3.265 595 HG2 MET 67 2HG MET 67 -6.005 2.961 5.629 596 HG3 MET 67 3HG MET 67 -6.752 1.449 6.142 597 HE1 MET 67 3HE MET 67 -5.983 -0.995 4.941 598 HE2 MET 67 1HE MET 67 -4.660 -1.068 3.780 599 HE3 MET 67 2HE MET 67 -6.165 -0.256 3.349 600 H LEU 68 H LEU 68 -7.759 4.503 2.403 601 HA LEU 68 HA LEU 68 -6.078 6.467 3.559 602 HB2 LEU 68 2HB LEU 68 -7.490 6.375 0.861 603 HB3 LEU 68 3HB LEU 68 -6.298 7.594 1.290 604 HG LEU 68 HG LEU 68 -5.745 4.606 1.125 605 HD11 LEU 68 1HD1 LEU 68 -4.478 5.107 -0.910 606 HD12 LEU 68 2HD1 LEU 68 -4.974 6.801 -0.825 607 HD13 LEU 68 3HD1 LEU 68 -6.177 5.537 -1.090 608 HD21 LEU 68 3HD2 LEU 68 -4.304 5.680 2.764 609 HD22 LEU 68 1HD2 LEU 68 -3.836 6.914 1.589 610 HD23 LEU 68 2HD2 LEU 68 -3.377 5.227 1.338 611 H GLU 69 H GLU 69 -9.517 6.373 2.953 612 HA GLU 69 HA GLU 69 -10.070 9.160 3.422 613 HB2 GLU 69 2HB GLU 69 -11.866 6.696 3.452 614 HB3 GLU 69 3HB GLU 69 -12.466 8.348 3.601 615 HG2 GLU 69 2HG GLU 69 -11.706 8.910 1.382 616 HG3 GLU 69 3HG GLU 69 -10.836 7.386 1.232 617 H LEU 70 H LEU 70 -9.634 6.365 5.479 618 HA LEU 70 HA LEU 70 -10.515 7.723 7.903 619 HB2 LEU 70 2HB LEU 70 -8.988 5.094 7.608 620 HB3 LEU 70 3HB LEU 70 -9.815 5.663 9.051 621 HG LEU 70 HG LEU 70 -11.145 4.853 6.435 622 HD11 LEU 70 1HD1 LEU 70 -11.183 3.453 9.122 623 HD12 LEU 70 2HD1 LEU 70 -10.323 2.924 7.676 624 HD13 LEU 70 3HD1 LEU 70 -12.084 2.964 7.681 625 HD21 LEU 70 3HD2 LEU 70 -13.299 5.157 7.586 626 HD22 LEU 70 1HD2 LEU 70 -12.403 6.670 7.457 627 HD23 LEU 70 2HD2 LEU 70 -12.458 5.809 8.996 628 H ILE 71 H ILE 71 -7.538 7.027 6.195 629 HA ILE 71 HA ILE 71 -5.643 7.780 8.206 630 HB ILE 71 HB ILE 71 -5.407 7.319 5.194 631 HG12 ILE 71 2HG1 ILE 71 -4.366 5.695 7.564 632 HG13 ILE 71 3HG1 ILE 71 -5.835 5.336 6.668 633 HG21 ILE 71 1HG2 ILE 71 -2.950 7.405 5.390 634 HG22 ILE 71 2HG2 ILE 71 -3.087 7.925 7.069 635 HG23 ILE 71 3HG2 ILE 71 -3.674 8.967 5.771 636 HD11 ILE 71 3HD1 ILE 71 -4.086 3.872 5.967 637 HD12 ILE 71 1HD1 ILE 71 -3.017 5.230 5.618 638 HD13 ILE 71 2HD1 ILE 71 -4.466 4.974 4.644 639 H SER 72 H SER 72 -7.369 9.535 5.687 640 HA SER 72 HA SER 72 -5.842 11.880 5.547 641 HB2 SER 72 2HB SER 72 -7.963 12.936 4.710 642 HB3 SER 72 3HB SER 72 -7.609 11.392 3.933 643 HG SER 72 HG SER 72 -9.563 10.912 4.525 644 H LYS 73 H LYS 73 -8.144 10.774 7.938 645 HA LYS 73 HA LYS 73 -8.361 13.292 9.365 646 HB2 LYS 73 2HB LYS 73 -9.208 10.491 10.229 647 HB3 LYS 73 3HB LYS 73 -9.743 12.016 10.936 648 HG2 LYS 73 2HG LYS 73 -10.841 12.593 8.755 649 HG3 LYS 73 3HG LYS 73 -10.379 11.003 8.140 650 HD2 LYS 73 2HD LYS 73 -12.167 11.507 10.552 651 HD3 LYS 73 3HD LYS 73 -12.731 11.052 8.942 652 HE2 LYS 73 2HE LYS 73 -11.715 8.879 9.111 653 HE3 LYS 73 3HE LYS 73 -10.835 9.332 10.576 654 HZ1 LYS 73 3HZ LYS 73 -12.976 9.566 11.721 655 HZ2 LYS 73 1HZ LYS 73 -12.755 7.997 11.127 656 HZ3 LYS 73 2HZ LYS 73 -13.787 9.066 10.325 657 H LEU 74 H LEU 74 -6.445 10.345 9.546 658 HA LEU 74 HA LEU 74 -5.446 10.722 12.222 659 HB2 LEU 74 2HB LEU 74 -4.423 8.909 9.998 660 HB3 LEU 74 3HB LEU 74 -3.949 8.811 11.688 661 HG LEU 74 HG LEU 74 -6.736 8.262 10.587 662 HD11 LEU 74 1HD1 LEU 74 -6.323 5.918 11.190 663 HD12 LEU 74 2HD1 LEU 74 -4.678 6.326 11.690 664 HD13 LEU 74 3HD1 LEU 74 -5.157 6.497 10.001 665 HD21 LEU 74 3HD2 LEU 74 -6.900 9.234 12.817 666 HD22 LEU 74 1HD2 LEU 74 -5.741 8.061 13.450 667 HD23 LEU 74 2HD2 LEU 74 -7.320 7.525 12.869 668 H GLY 75 H GLY 75 -3.993 11.078 8.983 669 HA2 GLY 75 2HA GLY 75 -2.719 12.868 8.230 670 HA3 GLY 75 3HA GLY 75 -2.421 13.364 9.882 671 H TYR 76 H TYR 76 -1.633 10.706 7.583 672 HA TYR 76 HA TYR 76 1.178 11.170 8.047 673 HB2 TYR 76 2HB TYR 76 1.731 8.766 8.528 674 HB3 TYR 76 3HB TYR 76 0.915 9.615 9.824 675 HD1 TYR 76 HD2 TYR 76 0.333 7.124 7.081 676 HD2 TYR 76 HD1 TYR 76 -1.053 8.691 10.813 677 HE1 TYR 76 HE2 TYR 76 -1.227 5.240 7.295 678 HE2 TYR 76 HE1 TYR 76 -2.603 6.793 11.025 679 HH TYR 76 HH TYR 76 -2.426 4.032 9.037 680 H LYS 77 H LYS 77 2.565 9.688 6.713 681 HA LYS 77 HA LYS 77 1.719 9.997 3.960 682 HB2 LYS 77 2HB LYS 77 4.367 9.077 5.145 683 HB3 LYS 77 3HB LYS 77 4.099 9.393 3.438 684 HG2 LYS 77 2HG LYS 77 3.774 11.525 5.568 685 HG3 LYS 77 3HG LYS 77 5.311 11.179 4.789 686 HD2 LYS 77 2HD LYS 77 4.538 12.959 3.517 687 HD3 LYS 77 3HD LYS 77 4.005 11.585 2.553 688 HE2 LYS 77 2HE LYS 77 1.730 11.807 3.495 689 HE3 LYS 77 3HE LYS 77 2.276 13.141 4.514 690 HZ1 LYS 77 3HZ LYS 77 2.765 14.418 2.513 691 HZ2 LYS 77 1HZ LYS 77 1.139 13.954 2.552 692 HZ3 LYS 77 2HZ LYS 77 2.222 13.150 1.541 693 H VAL 78 H VAL 78 1.090 8.439 2.639 694 HA VAL 78 HA VAL 78 1.655 5.605 3.241 695 HB VAL 78 HB VAL 78 -1.028 6.663 2.209 696 HG11 VAL 78 1HG1 VAL 78 -0.158 3.840 2.945 697 HG12 VAL 78 2HG1 VAL 78 -0.484 4.446 1.317 698 HG13 VAL 78 3HG1 VAL 78 -1.793 4.331 2.491 699 HG21 VAL 78 3HG2 VAL 78 -0.362 5.514 4.951 700 HG22 VAL 78 1HG2 VAL 78 -1.967 5.983 4.377 701 HG23 VAL 78 2HG2 VAL 78 -0.719 7.207 4.597 702 H PHE 79 H PHE 79 2.267 4.419 1.526 703 HA PHE 79 HA PHE 79 2.560 5.743 -1.113 704 HB2 PHE 79 2HB PHE 79 4.350 3.656 0.239 705 HB3 PHE 79 3HB PHE 79 4.645 4.421 -1.316 706 HD1 PHE 79 HD1 PHE 79 5.105 6.931 -1.384 707 HD2 PHE 79 HD2 PHE 79 5.104 4.712 2.277 708 HE1 PHE 79 HE1 PHE 79 6.353 8.739 -0.281 709 HE2 PHE 79 HE2 PHE 79 6.359 6.534 3.370 710 HZ PHE 79 HZ PHE 79 6.979 8.545 2.091 711 H LEU 80 H LEU 80 1.121 4.836 -2.488 712 HA LEU 80 HA LEU 80 0.153 2.084 -2.082 713 HB2 LEU 80 2HB LEU 80 -1.597 3.792 -2.130 714 HB3 LEU 80 3HB LEU 80 -1.016 4.410 -3.667 715 HG LEU 80 HG LEU 80 -1.749 2.360 -4.823 716 HD11 LEU 80 1HD1 LEU 80 -1.374 0.704 -3.091 717 HD12 LEU 80 2HD1 LEU 80 -3.016 0.593 -3.713 718 HD13 LEU 80 3HD1 LEU 80 -2.716 1.347 -2.143 719 HD21 LEU 80 3HD2 LEU 80 -3.387 4.156 -4.610 720 HD22 LEU 80 1HD2 LEU 80 -3.968 3.481 -3.086 721 HD23 LEU 80 2HD2 LEU 80 -4.179 2.584 -4.594 722 H LEU 81 H LEU 81 0.344 0.535 -3.566 723 HA LEU 81 HA LEU 81 1.415 1.085 -6.263 724 HB2 LEU 81 2HB LEU 81 3.215 0.229 -4.745 725 HB3 LEU 81 3HB LEU 81 2.236 -1.184 -4.398 726 HG LEU 81 HG LEU 81 2.427 -1.915 -6.760 727 HD11 LEU 81 1HD1 LEU 81 4.163 0.535 -7.134 728 HD12 LEU 81 2HD1 LEU 81 2.603 0.207 -7.892 729 HD13 LEU 81 3HD1 LEU 81 4.000 -0.787 -8.291 730 HD21 LEU 81 3HD2 LEU 81 5.117 -1.349 -5.463 731 HD22 LEU 81 1HD2 LEU 81 4.799 -2.557 -6.711 732 HD23 LEU 81 2HD2 LEU 81 4.065 -2.725 -5.120 733 H LEU 82 H LEU 82 0.149 0.217 -7.782 734 HA LEU 82 HA LEU 82 -1.905 -1.836 -7.147 735 HB2 LEU 82 2HB LEU 82 -1.922 0.394 -9.245 736 HB3 LEU 82 3HB LEU 82 -3.191 -0.799 -9.044 737 HG LEU 82 HG LEU 82 -2.450 1.320 -6.988 738 HD11 LEU 82 1HD1 LEU 82 -4.824 1.225 -8.880 739 HD12 LEU 82 2HD1 LEU 82 -3.441 2.319 -8.988 740 HD13 LEU 82 3HD1 LEU 82 -4.539 2.428 -7.616 741 HD21 LEU 82 3HD2 LEU 82 -3.369 -0.676 -5.913 742 HD22 LEU 82 1HD2 LEU 82 -4.773 -0.639 -6.987 743 HD23 LEU 82 2HD2 LEU 82 -4.510 0.662 -5.821 744 H ALA 83 H ALA 83 -1.726 -3.741 -8.360 745 HA ALA 83 HA ALA 83 -0.371 -3.724 -10.966 746 HB1 ALA 83 3HB ALA 83 1.445 -4.092 -9.333 747 HB2 ALA 83 1HB ALA 83 1.203 -5.496 -10.368 748 HB3 ALA 83 2HB ALA 83 0.606 -5.508 -8.710 749 H ASP 84 H ASP 84 -1.801 -4.665 -12.242 750 HA ASP 84 HA ASP 84 -2.765 -7.343 -11.891 751 HB2 ASP 84 2HB ASP 84 -4.402 -6.332 -10.402 752 HB3 ASP 84 3HB ASP 84 -4.731 -5.027 -11.530 753 H GLN 85 H GLN 85 -3.808 -8.130 -13.778 754 HA GLN 85 HA GLN 85 -2.809 -7.206 -16.237 755 HB2 GLN 85 2HB GLN 85 -3.431 -9.552 -15.787 756 HB3 GLN 85 3HB GLN 85 -5.124 -9.103 -15.641 757 HG2 GLN 85 2HG GLN 85 -5.152 -8.465 -18.032 758 HG3 GLN 85 3HG GLN 85 -3.448 -8.906 -18.160 759 HE21 GLN 85 1HE2 GLN 85 -3.843 -10.475 -19.735 760 HE22 GLN 85 2HE2 GLN 85 -4.647 -11.967 -19.397 761 H ASP 86 H ASP 86 -5.942 -6.701 -14.648 762 HA ASP 86 HA ASP 86 -7.004 -5.094 -16.832 763 HB2 ASP 86 2HB ASP 86 -8.484 -6.521 -15.345 764 HB3 ASP 86 3HB ASP 86 -8.154 -5.409 -14.023 765 H GLU 87 H GLU 87 -5.315 -3.626 -16.947 766 HA GLU 87 HA GLU 87 -4.579 -1.868 -14.791 767 HB2 GLU 87 2HB GLU 87 -3.171 -0.766 -16.503 768 HB3 GLU 87 3HB GLU 87 -2.936 -2.510 -16.462 769 HG2 GLU 87 2HG GLU 87 -4.494 -2.689 -18.434 770 HG3 GLU 87 3HG GLU 87 -4.503 -0.926 -18.504 771 H ASN 88 H ASN 88 -7.146 -1.920 -17.026 772 HA ASN 88 HA ASN 88 -7.578 0.823 -17.567 773 HB2 ASN 88 2HB ASN 88 -8.597 -0.966 -18.904 774 HB3 ASN 88 3HB ASN 88 -9.542 -1.514 -17.522 775 HD21 ASN 88 1HD2 ASN 88 -11.410 -0.321 -16.939 776 HD22 ASN 88 2HD2 ASN 88 -12.082 0.898 -17.962 777 H GLU 89 H GLU 89 -9.209 -1.335 -15.193 778 HA GLU 89 HA GLU 89 -10.593 0.788 -13.861 779 HB2 GLU 89 2HB GLU 89 -11.401 -1.588 -13.875 780 HB3 GLU 89 3HB GLU 89 -10.053 -2.041 -12.836 781 HG2 GLU 89 2HG GLU 89 -10.925 -0.546 -11.069 782 HG3 GLU 89 3HG GLU 89 -12.270 -0.091 -12.115 783 H LEU 90 H LEU 90 -7.484 -0.874 -13.338 784 HA LEU 90 HA LEU 90 -6.747 0.285 -10.894 785 HB2 LEU 90 2HB LEU 90 -5.003 -0.454 -13.272 786 HB3 LEU 90 3HB LEU 90 -4.345 0.105 -11.745 787 HG LEU 90 HG LEU 90 -5.860 -2.487 -12.209 788 HD11 LEU 90 1HD1 LEU 90 -3.688 -3.521 -11.633 789 HD12 LEU 90 2HD1 LEU 90 -2.948 -1.922 -11.532 790 HD13 LEU 90 3HD1 LEU 90 -3.579 -2.513 -13.073 791 HD21 LEU 90 3HD2 LEU 90 -4.741 -1.378 -9.612 792 HD22 LEU 90 1HD2 LEU 90 -5.370 -3.010 -9.846 793 HD23 LEU 90 2HD2 LEU 90 -6.442 -1.623 -10.000 794 H GLU 91 H GLU 91 -6.513 1.568 -14.214 795 HA GLU 91 HA GLU 91 -4.936 3.854 -13.600 796 HB2 GLU 91 2HB GLU 91 -5.146 2.928 -15.925 797 HB3 GLU 91 3HB GLU 91 -6.812 3.493 -15.984 798 HG2 GLU 91 2HG GLU 91 -5.955 5.832 -15.622 799 HG3 GLU 91 3HG GLU 91 -4.313 5.216 -15.765 800 H GLU 92 H GLU 92 -8.425 3.317 -13.941 801 HA GLU 92 HA GLU 92 -9.210 6.025 -13.536 802 HB2 GLU 92 2HB GLU 92 -10.510 3.729 -14.381 803 HB3 GLU 92 3HB GLU 92 -11.179 3.901 -12.766 804 HG2 GLU 92 2HG GLU 92 -11.284 5.952 -15.002 805 HG3 GLU 92 3HG GLU 92 -12.619 4.964 -14.427 806 H PHE 93 H PHE 93 -8.658 3.293 -11.414 807 HA PHE 93 HA PHE 93 -9.729 4.350 -9.007 808 HB2 PHE 93 2HB PHE 93 -9.370 1.924 -9.391 809 HB3 PHE 93 3HB PHE 93 -7.629 2.167 -9.410 810 HD1 PHE 93 HD1 PHE 93 -10.661 2.289 -7.248 811 HD2 PHE 93 HD2 PHE 93 -6.389 2.241 -7.347 812 HE1 PHE 93 HE1 PHE 93 -10.596 1.925 -4.816 813 HE2 PHE 93 HE2 PHE 93 -6.334 1.877 -4.916 814 HZ PHE 93 HZ PHE 93 -8.438 1.722 -3.657 815 H LYS 94 H LYS 94 -6.373 4.269 -10.306 816 HA LYS 94 HA LYS 94 -5.161 5.414 -8.011 817 HB2 LYS 94 2HB LYS 94 -3.128 5.771 -9.458 818 HB3 LYS 94 3HB LYS 94 -3.722 4.129 -9.391 819 HG2 LYS 94 2HG LYS 94 -3.173 4.312 -11.616 820 HG3 LYS 94 3HG LYS 94 -4.886 4.711 -11.651 821 HD2 LYS 94 2HD LYS 94 -3.755 6.262 -13.088 822 HD3 LYS 94 3HD LYS 94 -4.240 7.157 -11.648 823 HE2 LYS 94 2HE LYS 94 -1.942 6.997 -10.764 824 HE3 LYS 94 3HE LYS 94 -1.460 6.042 -12.170 825 HZ1 LYS 94 3HZ LYS 94 -0.856 8.396 -12.378 826 HZ2 LYS 94 1HZ LYS 94 -2.486 8.834 -12.294 827 HZ3 LYS 94 2HZ LYS 94 -1.930 7.915 -13.593 828 H ARG 95 H ARG 95 -6.715 6.838 -10.779 829 HA ARG 95 HA ARG 95 -5.896 9.518 -10.561 830 HB2 ARG 95 2HB ARG 95 -8.498 8.244 -11.496 831 HB3 ARG 95 3HB ARG 95 -8.245 9.986 -11.566 832 HG2 ARG 95 2HG ARG 95 -6.511 9.789 -13.183 833 HG3 ARG 95 3HG ARG 95 -6.331 8.054 -12.906 834 HD2 ARG 95 2HD ARG 95 -7.513 8.687 -15.056 835 HD3 ARG 95 3HD ARG 95 -8.394 7.567 -14.020 836 HE ARG 95 HE ARG 95 -9.898 9.309 -13.438 837 HH11 ARG 95 1HH1 ARG 95 -7.694 10.251 -16.031 838 HH12 ARG 95 2HH1 ARG 95 -8.698 11.569 -16.552 839 HH21 ARG 95 1HH2 ARG 95 -11.155 11.063 -14.111 840 HH22 ARG 95 2HH2 ARG 95 -10.655 12.023 -15.466 841 H LYS 96 H LYS 96 -8.369 7.710 -8.803 842 HA LYS 96 HA LYS 96 -9.445 9.966 -7.370 843 HB2 LYS 96 2HB LYS 96 -9.891 6.975 -7.293 844 HB3 LYS 96 3HB LYS 96 -10.445 7.936 -5.930 845 HG2 LYS 96 2HG LYS 96 -12.226 7.506 -7.612 846 HG3 LYS 96 3HG LYS 96 -11.933 9.224 -7.334 847 HD2 LYS 96 2HD LYS 96 -10.558 9.289 -9.431 848 HD3 LYS 96 3HD LYS 96 -10.952 7.590 -9.711 849 HE2 LYS 96 2HE LYS 96 -12.975 9.852 -9.559 850 HE3 LYS 96 3HE LYS 96 -12.364 9.127 -11.048 851 HZ1 LYS 96 3HZ LYS 96 -14.519 8.233 -10.385 852 HZ2 LYS 96 1HZ LYS 96 -13.853 7.665 -8.938 853 HZ3 LYS 96 2HZ LYS 96 -13.327 7.033 -10.413 854 H ILE 97 H ILE 97 -6.868 7.651 -6.804 855 HA ILE 97 HA ILE 97 -6.455 8.269 -4.024 856 HB ILE 97 HB ILE 97 -4.408 7.119 -5.989 857 HG12 ILE 97 2HG1 ILE 97 -6.486 5.789 -6.116 858 HG13 ILE 97 3HG1 ILE 97 -5.202 4.861 -5.362 859 HG21 ILE 97 1HG2 ILE 97 -3.415 7.812 -3.863 860 HG22 ILE 97 2HG2 ILE 97 -3.425 6.053 -3.977 861 HG23 ILE 97 3HG2 ILE 97 -4.611 6.876 -2.963 862 HD11 ILE 97 3HD1 ILE 97 -6.222 5.247 -3.166 863 HD12 ILE 97 1HD1 ILE 97 -7.342 4.480 -4.289 864 HD13 ILE 97 2HD1 ILE 97 -7.502 6.196 -3.929 865 H GLU 98 H GLU 98 -5.194 9.419 -7.113 866 HA GLU 98 HA GLU 98 -3.309 11.339 -6.217 867 HB2 GLU 98 2HB GLU 98 -4.989 11.171 -8.753 868 HB3 GLU 98 3HB GLU 98 -3.757 12.403 -8.505 869 HG2 GLU 98 2HG GLU 98 -2.038 10.626 -8.345 870 HG3 GLU 98 3HG GLU 98 -3.286 9.411 -8.626 871 H SER 99 H SER 99 -6.811 11.442 -6.726 872 HA SER 99 HA SER 99 -7.196 14.217 -6.199 873 HB2 SER 99 2HB SER 99 -8.837 12.785 -7.435 874 HB3 SER 99 3HB SER 99 -9.223 11.942 -5.934 875 HG SER 99 HG SER 99 -9.578 14.382 -5.269 876 H GLN 100 H GLN 100 -7.098 11.316 -4.144 877 HA GLN 100 HA GLN 100 -7.726 12.670 -1.667 878 HB2 GLN 100 2HB GLN 100 -6.388 9.980 -2.210 879 HB3 GLN 100 3HB GLN 100 -6.847 10.549 -0.607 880 HG2 GLN 100 2HG GLN 100 -9.202 10.529 -1.228 881 HG3 GLN 100 3HG GLN 100 -8.795 10.098 -2.886 882 HE21 GLN 100 1HE2 GLN 100 -9.123 8.918 0.377 883 HE22 GLN 100 2HE2 GLN 100 -8.976 7.240 -0.009 884 H GLY 101 H GLY 101 -4.896 12.290 -3.630 885 HA2 GLY 101 2HA GLY 101 -2.977 13.559 -3.620 886 HA3 GLY 101 3HA GLY 101 -3.474 14.278 -2.097 887 H TYR 102 H TYR 102 -3.045 10.841 -2.811 888 HA TYR 102 HA TYR 102 -0.702 10.719 -0.983 889 HB2 TYR 102 2HB TYR 102 -2.671 8.543 -1.836 890 HB3 TYR 102 3HB TYR 102 -1.205 8.226 -0.914 891 HD1 TYR 102 HD2 TYR 102 -1.033 8.909 1.459 892 HD2 TYR 102 HD1 TYR 102 -4.611 9.625 -0.770 893 HE1 TYR 102 HE2 TYR 102 -2.257 9.329 3.553 894 HE2 TYR 102 HE1 TYR 102 -5.831 10.050 1.325 895 HH TYR 102 HH TYR 102 -5.642 9.488 3.719 896 H GLU 103 H GLU 103 1.102 9.433 -1.634 897 HA GLU 103 HA GLU 103 1.842 9.445 -4.371 898 HB2 GLU 103 2HB GLU 103 3.558 9.441 -2.617 899 HB3 GLU 103 3HB GLU 103 2.991 7.892 -2.004 900 HG2 GLU 103 2HG GLU 103 5.044 7.561 -3.245 901 HG3 GLU 103 3HG GLU 103 3.716 6.803 -4.118 902 H VAL 104 H VAL 104 1.282 8.056 -5.929 903 HA VAL 104 HA VAL 104 0.380 5.326 -5.320 904 HB VAL 104 HB VAL 104 -1.673 6.625 -5.257 905 HG11 VAL 104 1HG1 VAL 104 -1.009 7.655 -8.031 906 HG12 VAL 104 2HG1 VAL 104 -1.005 8.591 -6.534 907 HG13 VAL 104 3HG1 VAL 104 -2.521 7.935 -7.156 908 HG21 VAL 104 3HG2 VAL 104 -1.849 4.388 -6.230 909 HG22 VAL 104 1HG2 VAL 104 -1.515 5.034 -7.843 910 HG23 VAL 104 2HG2 VAL 104 -2.998 5.488 -6.997 911 H ARG 105 H ARG 105 0.959 3.877 -6.853 912 HA ARG 105 HA ARG 105 1.885 4.812 -9.505 913 HB2 ARG 105 2HB ARG 105 3.301 2.836 -7.658 914 HB3 ARG 105 3HB ARG 105 3.692 3.013 -9.365 915 HG2 ARG 105 2HG ARG 105 3.961 5.167 -7.249 916 HG3 ARG 105 3HG ARG 105 5.276 4.222 -7.941 917 HD2 ARG 105 2HD ARG 105 5.477 5.663 -9.676 918 HD3 ARG 105 3HD ARG 105 3.771 5.498 -10.092 919 HE ARG 105 HE ARG 105 4.031 7.182 -7.850 920 HH11 ARG 105 1HH1 ARG 105 4.626 7.243 -11.326 921 HH12 ARG 105 2HH1 ARG 105 4.427 8.965 -11.432 922 HH21 ARG 105 1HH2 ARG 105 3.807 9.415 -8.005 923 HH22 ARG 105 2HH2 ARG 105 3.962 10.196 -9.552 924 H LYS 106 H LYS 106 0.996 3.748 -11.137 925 HA LYS 106 HA LYS 106 -0.381 1.165 -10.706 926 HB2 LYS 106 2HB LYS 106 -1.537 3.261 -11.817 927 HB3 LYS 106 3HB LYS 106 -0.577 2.872 -13.233 928 HG2 LYS 106 2HG LYS 106 -2.559 0.981 -11.925 929 HG3 LYS 106 3HG LYS 106 -2.927 2.017 -13.290 930 HD2 LYS 106 2HD LYS 106 -0.791 -0.135 -13.365 931 HD3 LYS 106 3HD LYS 106 -2.465 -0.415 -13.828 932 HE2 LYS 106 2HE LYS 106 -1.238 -0.064 -15.845 933 HE3 LYS 106 3HE LYS 106 -2.183 1.397 -15.585 934 HZ1 LYS 106 3HZ LYS 106 -0.224 2.521 -14.812 935 HZ2 LYS 106 1HZ LYS 106 0.118 1.813 -16.308 936 HZ3 LYS 106 2HZ LYS 106 0.692 1.101 -14.886 937 H VAL 107 H VAL 107 0.785 -0.553 -11.274 938 HA VAL 107 HA VAL 107 2.771 -0.438 -13.462 939 HB VAL 107 HB VAL 107 4.286 -1.938 -12.243 940 HG11 VAL 107 1HG1 VAL 107 4.661 0.472 -11.956 941 HG12 VAL 107 2HG1 VAL 107 5.112 -0.399 -10.491 942 HG13 VAL 107 3HG1 VAL 107 3.591 0.499 -10.551 943 HG21 VAL 107 3HG2 VAL 107 2.678 -3.198 -10.905 944 HG22 VAL 107 1HG2 VAL 107 2.319 -1.772 -9.929 945 HG23 VAL 107 2HG2 VAL 107 3.917 -2.518 -9.853 946 H THR 108 H THR 108 3.169 -2.516 -14.494 947 HA THR 108 HA THR 108 1.043 -4.558 -14.163 948 HB THR 108 HB THR 108 0.991 -4.735 -16.733 949 HG1 THR 108 HG1 THR 108 2.701 -3.528 -17.396 950 HG21 THR 108 3HG2 THR 108 -0.094 -2.150 -15.533 951 HG22 THR 108 1HG2 THR 108 -0.896 -3.723 -15.474 952 HG23 THR 108 2HG2 THR 108 -0.648 -2.917 -17.024 953 H ASP 109 H ASP 109 4.287 -3.965 -14.149 954 HA ASP 109 HA ASP 109 4.956 -6.761 -14.922 955 HB2 ASP 109 2HB ASP 109 6.812 -4.331 -14.861 956 HB3 ASP 109 3HB ASP 109 7.295 -5.976 -15.255 957 H ASP 110 H ASP 110 6.229 -7.958 -13.437 958 HA ASP 110 HA ASP 110 5.878 -7.308 -10.675 959 HB2 ASP 110 2HB ASP 110 7.081 -9.390 -10.166 960 HB3 ASP 110 3HB ASP 110 5.897 -9.670 -11.431 961 H GLU 111 H GLU 111 8.665 -7.214 -12.884 962 HA GLU 111 HA GLU 111 10.648 -6.427 -11.029 963 HB2 GLU 111 2HB GLU 111 11.963 -5.693 -12.973 964 HB3 GLU 111 3HB GLU 111 11.187 -7.238 -13.311 965 HG2 GLU 111 2HG GLU 111 9.511 -6.170 -14.691 966 HG3 GLU 111 3HG GLU 111 10.084 -4.570 -14.242 967 H GLU 112 H GLU 112 8.247 -4.626 -12.846 968 HA GLU 112 HA GLU 112 9.278 -1.993 -12.368 969 HB2 GLU 112 2HB GLU 112 7.883 -2.587 -14.339 970 HB3 GLU 112 3HB GLU 112 6.512 -2.903 -13.286 971 HG2 GLU 112 2HG GLU 112 6.441 -0.531 -12.651 972 HG3 GLU 112 3HG GLU 112 7.857 -0.207 -13.651 973 H ALA 113 H ALA 113 6.895 -4.096 -10.813 974 HA ALA 113 HA ALA 113 5.962 -2.244 -8.877 975 HB1 ALA 113 3HB ALA 113 4.788 -4.348 -9.358 976 HB2 ALA 113 1HB ALA 113 5.180 -4.234 -7.644 977 HB3 ALA 113 2HB ALA 113 6.135 -5.281 -8.700 978 H LEU 114 H LEU 114 8.656 -4.600 -8.840 979 HA LEU 114 HA LEU 114 9.427 -4.339 -6.149 980 HB2 LEU 114 2HB LEU 114 11.110 -5.068 -8.578 981 HB3 LEU 114 3HB LEU 114 11.674 -5.217 -6.921 982 HG LEU 114 HG LEU 114 9.367 -6.772 -8.154 983 HD11 LEU 114 1HD1 LEU 114 11.560 -7.466 -9.011 984 HD12 LEU 114 2HD1 LEU 114 10.837 -8.713 -8.008 985 HD13 LEU 114 3HD1 LEU 114 12.142 -7.718 -7.362 986 HD21 LEU 114 3HD2 LEU 114 10.541 -6.976 -5.359 987 HD22 LEU 114 1HD2 LEU 114 9.333 -8.061 -6.055 988 HD23 LEU 114 2HD2 LEU 114 8.938 -6.366 -5.784 989 H LYS 115 H LYS 115 10.547 -2.539 -9.047 990 HA LYS 115 HA LYS 115 12.624 -1.106 -7.756 991 HB2 LYS 115 2HB LYS 115 12.658 0.387 -9.710 992 HB3 LYS 115 3HB LYS 115 12.559 -1.294 -10.218 993 HG2 LYS 115 2HG LYS 115 10.173 -1.031 -10.700 994 HG3 LYS 115 3HG LYS 115 10.219 0.637 -10.135 995 HD2 LYS 115 2HD LYS 115 11.833 -0.402 -12.502 996 HD3 LYS 115 3HD LYS 115 10.251 0.365 -12.648 997 HE2 LYS 115 2HE LYS 115 12.724 1.684 -11.475 998 HE3 LYS 115 3HE LYS 115 12.112 1.935 -13.110 999 HZ1 LYS 115 3HZ LYS 115 11.400 3.701 -11.667 1000 HZ2 LYS 115 1HZ LYS 115 10.687 2.613 -10.592 1001 HZ3 LYS 115 2HZ LYS 115 10.053 2.804 -12.149 1002 H ILE 116 H ILE 116 9.180 -0.467 -8.190 1003 HA ILE 116 HA ILE 116 9.125 2.195 -7.206 1004 HB ILE 116 HB ILE 116 6.918 0.083 -7.272 1005 HG12 ILE 116 2HG1 ILE 116 7.716 0.640 -9.518 1006 HG13 ILE 116 3HG1 ILE 116 6.108 1.299 -9.292 1007 HG21 ILE 116 1HG2 ILE 116 6.353 1.787 -5.620 1008 HG22 ILE 116 2HG2 ILE 116 5.318 1.945 -7.037 1009 HG23 ILE 116 3HG2 ILE 116 6.656 3.070 -6.795 1010 HD11 ILE 116 3HD1 ILE 116 7.103 3.520 -8.965 1011 HD12 ILE 116 1HD1 ILE 116 7.498 2.802 -10.526 1012 HD13 ILE 116 2HD1 ILE 116 8.705 2.823 -9.243 1013 H VAL 117 H VAL 117 8.759 -0.986 -5.606 1014 HA VAL 117 HA VAL 117 8.143 -0.078 -2.993 1015 HB VAL 117 HB VAL 117 9.581 -2.650 -3.842 1016 HG11 VAL 117 1HG1 VAL 117 8.907 -3.595 -1.652 1017 HG12 VAL 117 2HG1 VAL 117 8.266 -2.025 -1.161 1018 HG13 VAL 117 3HG1 VAL 117 9.995 -2.220 -1.452 1019 HG21 VAL 117 3HG2 VAL 117 7.371 -3.732 -3.632 1020 HG22 VAL 117 1HG2 VAL 117 7.335 -2.436 -4.828 1021 HG23 VAL 117 2HG2 VAL 117 6.635 -2.177 -3.231 1022 H ARG 118 H ARG 118 11.225 -0.657 -4.655 1023 HA ARG 118 HA ARG 118 13.017 -0.217 -2.495 1024 HB2 ARG 118 2HB ARG 118 13.445 0.179 -5.493 1025 HB3 ARG 118 3HB ARG 118 14.734 0.124 -4.290 1026 HG2 ARG 118 2HG ARG 118 14.130 -2.214 -3.750 1027 HG3 ARG 118 3HG ARG 118 12.845 -2.155 -4.958 1028 HD2 ARG 118 2HD ARG 118 14.820 -3.288 -5.851 1029 HD3 ARG 118 3HD ARG 118 14.528 -1.787 -6.734 1030 HE ARG 118 HE ARG 118 16.277 -0.883 -5.016 1031 HH11 ARG 118 1HH1 ARG 118 16.439 -4.004 -6.666 1032 HH12 ARG 118 2HH1 ARG 118 18.173 -4.068 -6.610 1033 HH21 ARG 118 1HH2 ARG 118 18.521 -1.004 -4.921 1034 HH22 ARG 118 2HH2 ARG 118 19.356 -2.360 -5.616 1035 H GLU 119 H GLU 119 11.596 1.942 -4.909 1036 HA GLU 119 HA GLU 119 12.950 4.333 -4.119 1037 HB2 GLU 119 2HB GLU 119 10.428 3.832 -5.744 1038 HB3 GLU 119 3HB GLU 119 11.123 5.436 -5.512 1039 HG2 GLU 119 2HG GLU 119 13.113 4.852 -6.716 1040 HG3 GLU 119 3HG GLU 119 12.683 3.142 -6.713 1041 H PHE 120 H PHE 120 9.866 2.839 -3.255 1042 HA PHE 120 HA PHE 120 8.759 4.864 -1.664 1043 HB2 PHE 120 2HB PHE 120 8.391 1.846 -1.690 1044 HB3 PHE 120 3HB PHE 120 7.591 2.823 -0.467 1045 HD1 PHE 120 HD2 PHE 120 7.481 5.012 -3.123 1046 HD2 PHE 120 HD1 PHE 120 5.869 1.212 -1.966 1047 HE1 PHE 120 HE2 PHE 120 5.533 5.378 -4.582 1048 HE2 PHE 120 HE1 PHE 120 3.927 1.600 -3.429 1049 HZ PHE 120 HZ PHE 120 3.755 3.683 -4.728 1050 H MET 121 H MET 121 11.278 2.526 -0.989 1051 HA MET 121 HA MET 121 11.378 2.863 1.853 1052 HB2 MET 121 2HB MET 121 13.599 1.943 -0.037 1053 HB3 MET 121 3HB MET 121 13.604 1.779 1.719 1054 HG2 MET 121 2HG MET 121 11.675 0.442 -0.175 1055 HG3 MET 121 3HG MET 121 13.036 -0.325 0.646 1056 HE1 MET 121 3HE MET 121 9.960 -1.340 0.707 1057 HE2 MET 121 1HE MET 121 9.852 -1.835 2.398 1058 HE3 MET 121 2HE MET 121 11.306 -2.196 1.466 1059 H GLN 122 H GLN 122 12.802 4.570 -0.889 1060 HA GLN 122 HA GLN 122 14.741 6.083 0.637 1061 HB2 GLN 122 2HB GLN 122 13.639 6.681 -2.152 1062 HB3 GLN 122 3HB GLN 122 15.096 7.362 -1.433 1063 HG2 GLN 122 2HG GLN 122 16.127 5.110 -1.418 1064 HG3 GLN 122 3HG GLN 122 14.673 4.453 -2.172 1065 HE21 GLN 122 1HE2 GLN 122 17.531 6.383 -2.667 1066 HE22 GLN 122 2HE2 GLN 122 17.428 6.463 -4.389 1067 H LYS 123 H LYS 123 11.555 6.640 -0.738 1068 HA LYS 123 HA LYS 123 11.126 9.326 0.032 1069 HB2 LYS 123 2HB LYS 123 9.155 7.059 -0.508 1070 HB3 LYS 123 3HB LYS 123 8.708 8.759 -0.388 1071 HG2 LYS 123 2HG LYS 123 9.910 9.308 -2.408 1072 HG3 LYS 123 3HG LYS 123 10.657 7.706 -2.470 1073 HD2 LYS 123 2HD LYS 123 8.504 6.655 -2.903 1074 HD3 LYS 123 3HD LYS 123 7.660 8.197 -2.694 1075 HE2 LYS 123 2HE LYS 123 7.829 7.710 -5.057 1076 HE3 LYS 123 3HE LYS 123 8.885 9.075 -4.704 1077 HZ1 LYS 123 3HZ LYS 123 9.724 6.253 -5.090 1078 HZ2 LYS 123 1HZ LYS 123 10.765 7.515 -4.665 1079 HZ3 LYS 123 2HZ LYS 123 9.980 7.529 -6.160 1080 H ALA 124 H ALA 124 10.408 6.220 1.602 1081 HA ALA 124 HA ALA 124 9.034 7.230 3.898 1082 HB1 ALA 124 3HB ALA 124 8.807 4.887 3.164 1083 HB2 ALA 124 1HB ALA 124 9.408 4.945 4.820 1084 HB3 ALA 124 2HB ALA 124 10.515 4.584 3.490 1085 H GLY 125 H GLY 125 12.421 6.432 3.153 1086 HA2 GLY 125 2HA GLY 125 13.542 6.816 5.730 1087 HA3 GLY 125 3HA GLY 125 14.414 6.851 4.203 1088 H SER 126 H SER 126 12.647 9.021 3.183 1089 HA SER 126 HA SER 126 14.126 11.307 3.958 1090 HB2 SER 126 2HB SER 126 11.471 11.143 2.490 1091 HB3 SER 126 3HB SER 126 12.499 12.574 2.572 1092 HG SER 126 HG SER 126 13.746 10.264 1.674 1093 H LEU 127 H LEU 127 11.160 9.894 5.086 1094 HA LEU 127 HA LEU 127 10.035 12.200 6.379 1095 HB2 LEU 127 2HB LEU 127 9.362 9.251 6.762 1096 HB3 LEU 127 3HB LEU 127 8.331 10.618 7.171 1097 HG LEU 127 HG LEU 127 9.192 9.905 4.343 1098 HD11 LEU 127 1HD1 LEU 127 6.923 9.067 3.994 1099 HD12 LEU 127 2HD1 LEU 127 6.546 9.325 5.700 1100 HD13 LEU 127 3HD1 LEU 127 7.773 8.144 5.231 1101 HD21 LEU 127 3HD2 LEU 127 7.463 11.501 3.629 1102 HD22 LEU 127 1HD2 LEU 127 8.721 12.281 4.588 1103 HD23 LEU 127 2HD2 LEU 127 7.152 11.927 5.314 1104 H GLU 128 H GLU 128 11.996 9.467 7.393 1105 HA GLU 128 HA GLU 128 11.433 9.615 10.181 1106 HB2 GLU 128 2HB GLU 128 13.638 8.151 8.675 1107 HB3 GLU 128 3HB GLU 128 13.277 7.932 10.384 1108 HG2 GLU 128 2HG GLU 128 10.990 7.158 9.779 1109 HG3 GLU 128 3HG GLU 128 11.418 7.317 8.075 1110 H HIS 129 H HIS 129 14.668 10.028 8.641 1111 HA HIS 129 HA HIS 129 15.389 12.234 10.408 1112 HB2 HIS 129 2HB HIS 129 15.520 9.979 11.743 1113 HB3 HIS 129 3HB HIS 129 16.913 9.606 10.742 1114 HD1 HIS 129 HD1 HIS 129 15.832 11.534 13.684 1115 HD2 HIS 129 HD2 HIS 129 19.238 11.258 11.322 1116 HE1 HIS 129 HE1 HIS 129 17.660 12.595 15.019 1117 HE2 HIS 129 HE2 HIS 129 19.643 12.603 13.496 1118 H HIS 130 H HIS 130 15.278 11.753 7.546 1119 HA HIS 130 HA HIS 130 17.776 11.219 6.349 1120 HB2 HIS 130 2HB HIS 130 15.614 11.217 5.129 1121 HB3 HIS 130 3HB HIS 130 15.499 12.963 5.313 1122 HD1 HIS 130 HD1 HIS 130 16.098 14.110 3.197 1123 HD2 HIS 130 HD2 HIS 130 18.281 10.606 3.680 1124 HE1 HIS 130 HE1 HIS 130 17.545 13.930 1.157 1125 HE2 HIS 130 HE2 HIS 130 18.938 11.879 1.536 1126 H HIS 131 H HIS 131 16.486 14.132 7.819 1127 HA HIS 131 HA HIS 131 18.585 15.914 7.002 1128 HB2 HIS 131 2HB HIS 131 16.605 16.012 9.320 1129 HB3 HIS 131 3HB HIS 131 17.784 17.282 9.026 1130 HD1 HIS 131 HD1 HIS 131 17.547 18.493 6.621 1131 HD2 HIS 131 HD2 HIS 131 14.236 16.361 7.950 1132 HE1 HIS 131 HE1 HIS 131 15.609 19.369 5.294 1133 HE2 HIS 131 HE2 HIS 131 13.600 18.232 6.285 1134 H HIS 132 H HIS 132 20.427 14.487 7.309 1135 HA HIS 132 HA HIS 132 21.145 13.655 10.008 1136 HB2 HIS 132 2HB HIS 132 23.196 12.691 8.942 1137 HB3 HIS 132 3HB HIS 132 21.697 12.104 8.245 1138 HD1 HIS 132 HD1 HIS 132 24.727 14.140 7.443 1139 HD2 HIS 132 HD2 HIS 132 21.339 12.710 5.502 1140 HE1 HIS 132 HE1 HIS 132 25.162 14.471 4.995 1141 HE2 HIS 132 HE2 HIS 132 23.193 13.425 3.847 1142 H HIS 133 H HIS 133 21.270 15.591 11.078 1143 HA HIS 133 HA HIS 133 23.869 16.897 11.020 1144 HB2 HIS 133 2HB HIS 133 23.100 19.161 10.790 1145 HB3 HIS 133 3HB HIS 133 22.340 18.275 9.475 1146 HD1 HIS 133 HD1 HIS 133 21.593 20.577 12.140 1147 HD2 HIS 133 HD2 HIS 133 19.489 17.585 10.160 1148 HE1 HIS 133 HE1 HIS 133 19.179 21.009 12.644 1149 HE2 HIS 133 HE2 HIS 133 17.920 19.268 11.339 1150 H HIS 134 H HIS 134 21.193 15.706 12.574 1151 HA HIS 134 HA HIS 134 22.068 16.116 15.246 1152 HB2 HIS 134 2HB HIS 134 21.055 18.349 15.020 1153 HB3 HIS 134 3HB HIS 134 19.601 17.674 14.301 1154 HD1 HIS 134 HD1 HIS 134 21.112 18.559 17.544 1155 HD2 HIS 134 HD2 HIS 134 17.891 16.285 16.221 1156 HE1 HIS 134 HE1 HIS 134 19.631 18.242 19.549 1157 HE2 HIS 134 HE2 HIS 134 17.822 16.688 18.764 Start of MODEL 16 1 H1 MET 1 1H MET 1 1.786 10.302 13.095 2 H2 MET 1 2H MET 1 2.460 11.831 12.858 3 H3 MET 1 3H MET 1 3.341 10.630 13.661 4 HA MET 1 HA MET 1 2.472 10.550 10.842 5 HB2 MET 1 2HB MET 1 4.248 12.216 11.165 6 HB3 MET 1 3HB MET 1 5.221 11.061 12.068 7 HG2 MET 1 2HG MET 1 6.030 11.398 9.751 8 HG3 MET 1 3HG MET 1 5.571 9.721 10.072 9 HE1 MET 1 3HE MET 1 5.478 9.145 7.499 10 HE2 MET 1 1HE MET 1 5.988 10.794 7.121 11 HE3 MET 1 2HE MET 1 4.582 10.100 6.316 12 H LYS 2 H LYS 2 2.476 8.591 9.973 13 HA LYS 2 HA LYS 2 4.181 6.407 11.035 14 HB2 LYS 2 2HB LYS 2 1.362 6.027 9.910 15 HB3 LYS 2 3HB LYS 2 2.409 4.777 10.577 16 HG2 LYS 2 2HG LYS 2 2.159 5.752 12.824 17 HG3 LYS 2 3HG LYS 2 1.175 7.057 12.162 18 HD2 LYS 2 2HD LYS 2 -0.313 5.434 13.157 19 HD3 LYS 2 3HD LYS 2 -0.508 5.344 11.405 20 HE2 LYS 2 2HE LYS 2 -0.459 3.093 12.333 21 HE3 LYS 2 3HE LYS 2 1.003 3.347 11.380 22 HZ1 LYS 2 3HZ LYS 2 0.764 3.420 14.341 23 HZ2 LYS 2 1HZ LYS 2 2.164 3.855 13.495 24 HZ3 LYS 2 2HZ LYS 2 1.579 2.273 13.409 25 H ILE 3 H ILE 3 5.004 5.026 9.321 26 HA ILE 3 HA ILE 3 4.604 6.048 6.548 27 HB ILE 3 HB ILE 3 6.967 4.432 7.628 28 HG12 ILE 3 2HG1 ILE 3 6.866 7.385 6.825 29 HG13 ILE 3 3HG1 ILE 3 6.955 6.785 8.478 30 HG21 ILE 3 1HG2 ILE 3 6.533 5.664 4.873 31 HG22 ILE 3 2HG2 ILE 3 6.519 3.942 5.259 32 HG23 ILE 3 3HG2 ILE 3 8.012 4.863 5.414 33 HD11 ILE 3 3HD1 ILE 3 9.118 7.557 7.729 34 HD12 ILE 3 1HD1 ILE 3 9.076 6.461 6.349 35 HD13 ILE 3 2HD1 ILE 3 9.168 5.815 7.990 36 H LEU 4 H LEU 4 3.006 4.826 5.733 37 HA LEU 4 HA LEU 4 3.073 1.883 6.094 38 HB2 LEU 4 2HB LEU 4 0.780 3.826 5.959 39 HB3 LEU 4 3HB LEU 4 0.532 2.227 5.282 40 HG LEU 4 HG LEU 4 1.029 1.196 7.477 41 HD11 LEU 4 1HD1 LEU 4 1.267 4.022 8.549 42 HD12 LEU 4 2HD1 LEU 4 2.560 2.825 8.431 43 HD13 LEU 4 3HD1 LEU 4 1.209 2.544 9.522 44 HD21 LEU 4 3HD2 LEU 4 -1.278 1.729 6.891 45 HD22 LEU 4 1HD2 LEU 4 -1.118 3.329 7.619 46 HD23 LEU 4 2HD2 LEU 4 -1.023 1.881 8.627 47 H ILE 5 H ILE 5 3.639 0.794 4.309 48 HA ILE 5 HA ILE 5 3.203 2.018 1.651 49 HB ILE 5 HB ILE 5 4.885 -0.431 2.351 50 HG12 ILE 5 2HG1 ILE 5 5.675 2.421 1.569 51 HG13 ILE 5 3HG1 ILE 5 5.979 1.628 3.112 52 HG21 ILE 5 1HG2 ILE 5 4.497 0.951 -0.343 53 HG22 ILE 5 2HG2 ILE 5 3.876 -0.639 0.104 54 HG23 ILE 5 3HG2 ILE 5 5.614 -0.384 -0.025 55 HD11 ILE 5 3HD1 ILE 5 7.238 0.936 0.453 56 HD12 ILE 5 1HD1 ILE 5 7.511 0.059 1.962 57 HD13 ILE 5 2HD1 ILE 5 8.008 1.744 1.818 58 H LEU 6 H LEU 6 1.288 1.589 0.903 59 HA LEU 6 HA LEU 6 -0.238 -0.769 1.588 60 HB2 LEU 6 2HB LEU 6 -0.851 1.923 0.980 61 HB3 LEU 6 3HB LEU 6 -1.394 1.053 -0.432 62 HG LEU 6 HG LEU 6 -2.317 0.643 2.421 63 HD11 LEU 6 1HD1 LEU 6 -3.798 1.676 -0.017 64 HD12 LEU 6 2HD1 LEU 6 -3.221 2.646 1.341 65 HD13 LEU 6 3HD1 LEU 6 -4.485 1.443 1.595 66 HD21 LEU 6 3HD2 LEU 6 -3.920 -1.019 1.517 67 HD22 LEU 6 1HD2 LEU 6 -2.248 -1.543 1.341 68 HD23 LEU 6 2HD2 LEU 6 -3.128 -0.919 -0.057 69 H ILE 7 H ILE 7 -0.158 -2.554 0.334 70 HA ILE 7 HA ILE 7 0.625 -2.348 -2.511 71 HB ILE 7 HB ILE 7 1.017 -4.682 -0.587 72 HG12 ILE 7 2HG1 ILE 7 2.637 -2.853 -0.239 73 HG13 ILE 7 3HG1 ILE 7 3.435 -4.272 -0.894 74 HG21 ILE 7 1HG2 ILE 7 2.191 -5.847 -2.451 75 HG22 ILE 7 2HG2 ILE 7 1.729 -4.541 -3.546 76 HG23 ILE 7 3HG2 ILE 7 0.488 -5.563 -2.820 77 HD11 ILE 7 3HD1 ILE 7 3.471 -3.209 -3.107 78 HD12 ILE 7 1HD1 ILE 7 4.300 -2.255 -1.878 79 HD13 ILE 7 2HD1 ILE 7 2.692 -1.779 -2.419 80 H ASN 8 H ASN 8 -0.915 -2.836 -3.895 81 HA ASN 8 HA ASN 8 -2.818 -5.004 -3.276 82 HB2 ASN 8 2HB ASN 8 -3.965 -2.750 -3.126 83 HB3 ASN 8 3HB ASN 8 -3.559 -2.464 -4.815 84 HD21 ASN 8 1HD2 ASN 8 -6.164 -2.534 -3.690 85 HD22 ASN 8 2HD2 ASN 8 -7.027 -3.819 -4.451 86 H THR 9 H THR 9 -1.858 -6.504 -4.494 87 HA THR 9 HA THR 9 -1.762 -6.003 -7.392 88 HB THR 9 HB THR 9 0.549 -6.128 -6.842 89 HG1 THR 9 HG1 THR 9 0.260 -7.305 -8.650 90 HG21 THR 9 3HG2 THR 9 0.442 -7.131 -4.603 91 HG22 THR 9 1HG2 THR 9 1.607 -7.977 -5.629 92 HG23 THR 9 2HG2 THR 9 0.024 -8.691 -5.318 93 H ASN 10 H ASN 10 -2.550 -7.530 -8.680 94 HA ASN 10 HA ASN 10 -4.466 -9.405 -7.618 95 HB2 ASN 10 2HB ASN 10 -4.802 -8.197 -9.762 96 HB3 ASN 10 3HB ASN 10 -3.419 -9.028 -10.458 97 HD21 ASN 10 1HD2 ASN 10 -4.554 -9.991 -12.100 98 HD22 ASN 10 2HD2 ASN 10 -5.738 -11.228 -11.855 99 H ASN 11 H ASN 11 -1.141 -9.531 -8.519 100 HA ASN 11 HA ASN 11 -0.994 -12.406 -8.945 101 HB2 ASN 11 2HB ASN 11 1.279 -10.384 -8.709 102 HB3 ASN 11 3HB ASN 11 1.369 -11.998 -9.406 103 HD21 ASN 11 1HD2 ASN 11 2.099 -9.486 -10.608 104 HD22 ASN 11 2HD2 ASN 11 1.125 -9.291 -12.020 105 H ASP 12 H ASP 12 -1.209 -13.630 -7.160 106 HA ASP 12 HA ASP 12 -0.876 -12.738 -4.491 107 HB2 ASP 12 2HB ASP 12 -2.443 -14.546 -5.147 108 HB3 ASP 12 3HB ASP 12 -1.085 -15.583 -5.570 109 H GLU 13 H GLU 13 1.223 -14.519 -6.673 110 HA GLU 13 HA GLU 13 3.210 -15.262 -4.739 111 HB2 GLU 13 2HB GLU 13 3.391 -15.119 -7.779 112 HB3 GLU 13 3HB GLU 13 4.539 -15.944 -6.720 113 HG2 GLU 13 2HG GLU 13 2.838 -17.537 -6.038 114 HG3 GLU 13 3HG GLU 13 1.599 -16.661 -6.935 115 H LEU 14 H LEU 14 2.694 -12.490 -6.858 116 HA LEU 14 HA LEU 14 5.214 -11.218 -6.518 117 HB2 LEU 14 2HB LEU 14 3.696 -10.569 -8.308 118 HB3 LEU 14 3HB LEU 14 2.470 -10.091 -7.150 119 HG LEU 14 HG LEU 14 3.807 -8.162 -6.443 120 HD11 LEU 14 1HD1 LEU 14 5.917 -9.142 -8.383 121 HD12 LEU 14 2HD1 LEU 14 6.054 -9.030 -6.628 122 HD13 LEU 14 3HD1 LEU 14 5.924 -7.562 -7.593 123 HD21 LEU 14 3HD2 LEU 14 3.744 -6.857 -8.533 124 HD22 LEU 14 1HD2 LEU 14 2.310 -7.856 -8.340 125 HD23 LEU 14 2HD2 LEU 14 3.578 -8.348 -9.462 126 H ILE 15 H ILE 15 2.181 -11.164 -4.649 127 HA ILE 15 HA ILE 15 2.807 -9.246 -2.708 128 HB ILE 15 HB ILE 15 1.263 -11.858 -2.350 129 HG12 ILE 15 2HG1 ILE 15 0.217 -9.037 -2.843 130 HG13 ILE 15 3HG1 ILE 15 0.342 -10.286 -4.075 131 HG21 ILE 15 1HG2 ILE 15 1.315 -9.436 -0.518 132 HG22 ILE 15 2HG2 ILE 15 1.985 -11.029 -0.161 133 HG23 ILE 15 3HG2 ILE 15 0.243 -10.830 -0.343 134 HD11 ILE 15 3HD1 ILE 15 -1.292 -11.641 -2.792 135 HD12 ILE 15 1HD1 ILE 15 -1.919 -10.090 -3.350 136 HD13 ILE 15 2HD1 ILE 15 -1.459 -10.293 -1.665 137 H LYS 16 H LYS 16 3.483 -12.743 -2.744 138 HA LYS 16 HA LYS 16 4.793 -13.099 -0.314 139 HB2 LYS 16 2HB LYS 16 5.434 -14.511 -2.946 140 HB3 LYS 16 3HB LYS 16 5.807 -15.118 -1.336 141 HG2 LYS 16 2HG LYS 16 2.985 -14.649 -2.358 142 HG3 LYS 16 3HG LYS 16 3.830 -16.195 -2.482 143 HD2 LYS 16 2HD LYS 16 3.160 -14.739 0.108 144 HD3 LYS 16 3HD LYS 16 2.278 -16.117 -0.557 145 HE2 LYS 16 2HE LYS 16 5.155 -16.116 0.423 146 HE3 LYS 16 3HE LYS 16 3.770 -16.871 1.211 147 HZ1 LYS 16 3HZ LYS 16 5.090 -18.493 0.028 148 HZ2 LYS 16 1HZ LYS 16 4.904 -17.648 -1.425 149 HZ3 LYS 16 2HZ LYS 16 3.567 -18.363 -0.684 150 H LYS 17 H LYS 17 6.053 -11.969 -3.415 151 HA LYS 17 HA LYS 17 8.838 -11.975 -2.740 152 HB2 LYS 17 2HB LYS 17 7.367 -10.496 -4.963 153 HB3 LYS 17 3HB LYS 17 9.117 -10.712 -4.858 154 HG2 LYS 17 2HG LYS 17 8.855 -13.136 -5.104 155 HG3 LYS 17 3HG LYS 17 7.100 -12.962 -5.128 156 HD2 LYS 17 2HD LYS 17 7.878 -13.249 -7.396 157 HD3 LYS 17 3HD LYS 17 7.301 -11.590 -7.214 158 HE2 LYS 17 2HE LYS 17 9.401 -11.674 -8.499 159 HE3 LYS 17 3HE LYS 17 9.632 -10.803 -6.985 160 HZ1 LYS 17 3HZ LYS 17 11.458 -12.314 -7.434 161 HZ2 LYS 17 1HZ LYS 17 10.402 -13.636 -7.480 162 HZ3 LYS 17 2HZ LYS 17 10.637 -12.787 -6.037 163 H ILE 18 H ILE 18 6.378 -9.398 -3.033 164 HA ILE 18 HA ILE 18 8.019 -7.183 -2.447 165 HB ILE 18 HB ILE 18 5.007 -7.576 -2.229 166 HG12 ILE 18 2HG1 ILE 18 6.696 -6.061 -4.282 167 HG13 ILE 18 3HG1 ILE 18 5.983 -7.652 -4.524 168 HG21 ILE 18 1HG2 ILE 18 6.508 -4.954 -1.879 169 HG22 ILE 18 2HG2 ILE 18 5.574 -5.802 -0.646 170 HG23 ILE 18 3HG2 ILE 18 4.756 -5.113 -2.045 171 HD11 ILE 18 3HD1 ILE 18 3.735 -6.642 -4.336 172 HD12 ILE 18 1HD1 ILE 18 4.690 -5.970 -5.659 173 HD13 ILE 18 2HD1 ILE 18 4.486 -5.051 -4.168 174 H LYS 19 H LYS 19 6.177 -9.338 -0.352 175 HA LYS 19 HA LYS 19 6.492 -8.059 2.126 176 HB2 LYS 19 2HB LYS 19 6.332 -11.023 1.441 177 HB3 LYS 19 3HB LYS 19 6.253 -10.392 3.088 178 HG2 LYS 19 2HG LYS 19 4.176 -9.222 2.598 179 HG3 LYS 19 3HG LYS 19 4.285 -9.658 0.893 180 HD2 LYS 19 2HD LYS 19 2.664 -11.098 2.015 181 HD3 LYS 19 3HD LYS 19 4.051 -12.057 1.486 182 HE2 LYS 19 2HE LYS 19 4.962 -11.937 3.811 183 HE3 LYS 19 3HE LYS 19 3.516 -11.060 4.304 184 HZ1 LYS 19 3HZ LYS 19 3.572 -13.803 3.207 185 HZ2 LYS 19 1HZ LYS 19 2.188 -12.968 3.703 186 HZ3 LYS 19 2HZ LYS 19 3.373 -13.394 4.833 187 H LYS 20 H LYS 20 8.535 -10.516 0.512 188 HA LYS 20 HA LYS 20 10.564 -10.605 2.498 189 HB2 LYS 20 2HB LYS 20 10.576 -11.453 -0.418 190 HB3 LYS 20 3HB LYS 20 11.920 -11.775 0.682 191 HG2 LYS 20 2HG LYS 20 9.065 -12.734 1.133 192 HG3 LYS 20 3HG LYS 20 10.336 -13.713 0.387 193 HD2 LYS 20 2HD LYS 20 11.612 -13.783 2.433 194 HD3 LYS 20 3HD LYS 20 10.652 -12.501 3.169 195 HE2 LYS 20 2HE LYS 20 9.582 -15.261 2.487 196 HE3 LYS 20 3HE LYS 20 10.144 -14.770 4.088 197 HZ1 LYS 20 3HZ LYS 20 7.876 -13.573 2.584 198 HZ2 LYS 20 1HZ LYS 20 8.449 -13.027 4.076 199 HZ3 LYS 20 2HZ LYS 20 7.762 -14.568 3.942 200 H GLU 21 H GLU 21 10.119 -8.530 -0.309 201 HA GLU 21 HA GLU 21 12.638 -7.274 -0.399 202 HB2 GLU 21 2HB GLU 21 9.881 -6.123 -1.054 203 HB3 GLU 21 3HB GLU 21 11.406 -5.334 -1.455 204 HG2 GLU 21 2HG GLU 21 10.464 -8.018 -2.529 205 HG3 GLU 21 3HG GLU 21 10.399 -6.482 -3.391 206 H VAL 22 H VAL 22 9.660 -6.341 1.364 207 HA VAL 22 HA VAL 22 10.914 -4.018 2.537 208 HB VAL 22 HB VAL 22 8.809 -3.567 3.649 209 HG11 VAL 22 1HG1 VAL 22 8.310 -4.548 0.820 210 HG12 VAL 22 2HG1 VAL 22 8.973 -2.974 1.269 211 HG13 VAL 22 3HG1 VAL 22 7.316 -3.388 1.708 212 HG21 VAL 22 3HG2 VAL 22 7.891 -6.323 2.739 213 HG22 VAL 22 1HG2 VAL 22 6.862 -5.102 3.492 214 HG23 VAL 22 2HG2 VAL 22 8.186 -5.820 4.404 215 H GLU 23 H GLU 23 10.274 -7.320 3.620 216 HA GLU 23 HA GLU 23 10.752 -7.033 6.382 217 HB2 GLU 23 2HB GLU 23 11.114 -9.392 4.493 218 HB3 GLU 23 3HB GLU 23 11.455 -9.528 6.216 219 HG2 GLU 23 2HG GLU 23 9.145 -9.002 6.765 220 HG3 GLU 23 3HG GLU 23 8.768 -8.726 5.064 221 H ASN 24 H ASN 24 12.894 -7.638 3.643 222 HA ASN 24 HA ASN 24 15.374 -7.765 4.970 223 HB2 ASN 24 2HB ASN 24 15.017 -8.476 2.622 224 HB3 ASN 24 3HB ASN 24 14.700 -6.813 2.152 225 HD21 ASN 24 1HD2 ASN 24 17.163 -9.038 3.295 226 HD22 ASN 24 2HD2 ASN 24 18.517 -8.132 2.715 227 H GLN 25 H GLN 25 13.462 -5.016 3.789 228 HA GLN 25 HA GLN 25 15.447 -3.003 4.466 229 HB2 GLN 25 2HB GLN 25 12.531 -2.666 3.655 230 HB3 GLN 25 3HB GLN 25 13.732 -1.379 3.727 231 HG2 GLN 25 2HG GLN 25 13.753 -3.749 1.827 232 HG3 GLN 25 3HG GLN 25 13.294 -2.099 1.417 233 HE21 GLN 25 1HE2 GLN 25 15.935 -4.284 2.006 234 HE22 GLN 25 2HE2 GLN 25 17.203 -3.222 1.519 235 H GLY 26 H GLY 26 13.010 -4.672 6.223 236 HA2 GLY 26 2HA GLY 26 12.953 -4.698 8.573 237 HA3 GLY 26 3HA GLY 26 13.631 -3.081 8.617 238 H TYR 27 H TYR 27 10.781 -4.174 6.798 239 HA TYR 27 HA TYR 27 9.043 -2.315 8.294 240 HB2 TYR 27 2HB TYR 27 8.775 -3.574 5.534 241 HB3 TYR 27 3HB TYR 27 7.399 -2.826 6.339 242 HD1 TYR 27 HD1 TYR 27 11.011 -1.895 5.686 243 HD2 TYR 27 HD2 TYR 27 6.909 -0.685 5.560 244 HE1 TYR 27 HE1 TYR 27 11.679 0.288 4.805 245 HE2 TYR 27 HE2 TYR 27 7.583 1.506 4.682 246 HH TYR 27 HH TYR 27 9.588 2.958 4.694 247 H GLN 28 H GLN 28 7.212 -3.012 9.302 248 HA GLN 28 HA GLN 28 6.868 -5.805 9.974 249 HB2 GLN 28 2HB GLN 28 6.430 -3.969 11.621 250 HB3 GLN 28 3HB GLN 28 5.153 -3.346 10.580 251 HG2 GLN 28 2HG GLN 28 4.002 -5.619 10.895 252 HG3 GLN 28 3HG GLN 28 5.174 -5.923 12.176 253 HE21 GLN 28 1HE2 GLN 28 5.114 -4.580 14.052 254 HE22 GLN 28 2HE2 GLN 28 3.692 -3.693 14.471 255 H VAL 29 H VAL 29 5.919 -7.137 8.446 256 HA VAL 29 HA VAL 29 4.029 -6.083 6.512 257 HB VAL 29 HB VAL 29 4.729 -9.011 7.007 258 HG11 VAL 29 1HG1 VAL 29 3.349 -7.636 4.656 259 HG12 VAL 29 2HG1 VAL 29 2.596 -8.745 5.808 260 HG13 VAL 29 3HG1 VAL 29 3.829 -9.333 4.697 261 HG21 VAL 29 3HG2 VAL 29 5.909 -7.066 4.976 262 HG22 VAL 29 1HG2 VAL 29 6.255 -8.797 5.064 263 HG23 VAL 29 2HG2 VAL 29 6.748 -7.732 6.380 264 H ARG 30 H ARG 30 1.982 -5.775 6.951 265 HA ARG 30 HA ARG 30 0.526 -7.441 8.905 266 HB2 ARG 30 2HB ARG 30 1.022 -5.041 9.613 267 HB3 ARG 30 3HB ARG 30 0.022 -4.503 8.268 268 HG2 ARG 30 2HG ARG 30 -1.915 -5.691 9.283 269 HG3 ARG 30 3HG ARG 30 -0.890 -6.155 10.642 270 HD2 ARG 30 2HD ARG 30 -1.548 -3.301 9.839 271 HD3 ARG 30 3HD ARG 30 -2.347 -4.201 11.131 272 HE ARG 30 HE ARG 30 0.573 -3.724 11.229 273 HH11 ARG 30 1HH1 ARG 30 -2.610 -3.279 12.676 274 HH12 ARG 30 2HH1 ARG 30 -1.974 -2.622 14.149 275 HH21 ARG 30 1HH2 ARG 30 1.376 -2.816 13.158 276 HH22 ARG 30 2HH2 ARG 30 0.276 -2.360 14.421 277 H ASP 31 H ASP 31 -1.481 -8.198 8.193 278 HA ASP 31 HA ASP 31 -1.756 -8.193 5.240 279 HB2 ASP 31 2HB ASP 31 -0.808 -10.263 6.018 280 HB3 ASP 31 3HB ASP 31 -1.964 -10.385 7.337 281 H VAL 32 H VAL 32 -3.584 -7.187 4.610 282 HA VAL 32 HA VAL 32 -6.133 -7.599 6.070 283 HB VAL 32 HB VAL 32 -5.652 -5.660 3.746 284 HG11 VAL 32 1HG1 VAL 32 -8.010 -6.263 4.085 285 HG12 VAL 32 2HG1 VAL 32 -7.746 -4.576 4.529 286 HG13 VAL 32 3HG1 VAL 32 -7.906 -5.806 5.788 287 HG21 VAL 32 3HG2 VAL 32 -4.190 -4.963 5.594 288 HG22 VAL 32 1HG2 VAL 32 -5.557 -4.988 6.711 289 HG23 VAL 32 2HG2 VAL 32 -5.516 -3.817 5.391 290 H ASN 33 H ASN 33 -7.391 -9.215 5.259 291 HA ASN 33 HA ASN 33 -7.329 -9.817 2.345 292 HB2 ASN 33 2HB ASN 33 -8.135 -11.639 4.651 293 HB3 ASN 33 3HB ASN 33 -8.187 -12.072 2.943 294 HD21 ASN 33 1HD2 ASN 33 -6.669 -13.220 5.192 295 HD22 ASN 33 2HD2 ASN 33 -5.007 -13.171 4.721 296 H ASP 34 H ASP 34 -9.334 -8.683 4.956 297 HA ASP 34 HA ASP 34 -11.794 -8.886 3.324 298 HB2 ASP 34 2HB ASP 34 -11.570 -10.977 4.756 299 HB3 ASP 34 3HB ASP 34 -11.596 -9.952 6.184 300 H SER 35 H SER 35 -13.650 -7.728 4.428 301 HA SER 35 HA SER 35 -12.962 -5.048 5.072 302 HB2 SER 35 2HB SER 35 -15.019 -5.626 3.838 303 HB3 SER 35 3HB SER 35 -15.643 -6.491 5.243 304 HG SER 35 HG SER 35 -16.357 -4.651 5.953 305 H ASP 36 H ASP 36 -14.052 -7.806 7.035 306 HA ASP 36 HA ASP 36 -14.342 -6.406 9.488 307 HB2 ASP 36 2HB ASP 36 -15.315 -8.670 9.124 308 HB3 ASP 36 3HB ASP 36 -13.696 -9.362 9.044 309 H GLU 37 H GLU 37 -11.712 -8.384 8.117 310 HA GLU 37 HA GLU 37 -9.717 -8.086 10.024 311 HB2 GLU 37 2HB GLU 37 -9.356 -8.140 6.992 312 HB3 GLU 37 3HB GLU 37 -8.075 -8.447 8.167 313 HG2 GLU 37 2HG GLU 37 -10.556 -10.141 7.713 314 HG3 GLU 37 3HG GLU 37 -8.917 -10.533 7.197 315 H LEU 38 H LEU 38 -10.576 -5.959 7.341 316 HA LEU 38 HA LEU 38 -8.559 -4.052 7.430 317 HB2 LEU 38 2HB LEU 38 -10.228 -4.240 5.622 318 HB3 LEU 38 3HB LEU 38 -11.495 -3.714 6.714 319 HG LEU 38 HG LEU 38 -10.250 -1.476 6.910 320 HD11 LEU 38 1HD1 LEU 38 -8.701 -2.565 4.548 321 HD12 LEU 38 2HD1 LEU 38 -8.054 -2.198 6.150 322 HD13 LEU 38 3HD1 LEU 38 -8.666 -0.896 5.131 323 HD21 LEU 38 3HD2 LEU 38 -12.267 -1.703 5.550 324 HD22 LEU 38 1HD2 LEU 38 -11.307 -2.260 4.176 325 HD23 LEU 38 2HD2 LEU 38 -11.119 -0.610 4.780 326 H LYS 39 H LYS 39 -11.847 -3.786 8.928 327 HA LYS 39 HA LYS 39 -11.279 -1.256 10.092 328 HB2 LYS 39 2HB LYS 39 -13.459 -1.465 11.240 329 HB3 LYS 39 3HB LYS 39 -13.553 -1.805 9.527 330 HG2 LYS 39 2HG LYS 39 -14.956 -3.440 10.380 331 HG3 LYS 39 3HG LYS 39 -13.436 -4.330 10.266 332 HD2 LYS 39 2HD LYS 39 -13.032 -3.986 12.676 333 HD3 LYS 39 3HD LYS 39 -14.498 -3.013 12.803 334 HE2 LYS 39 2HE LYS 39 -14.444 -5.945 12.012 335 HE3 LYS 39 3HE LYS 39 -14.763 -5.355 13.644 336 HZ1 LYS 39 3HZ LYS 39 -16.406 -4.780 11.233 337 HZ2 LYS 39 1HZ LYS 39 -16.693 -4.166 12.784 338 HZ3 LYS 39 2HZ LYS 39 -16.810 -5.826 12.499 339 H LYS 40 H LYS 40 -10.974 -4.533 11.320 340 HA LYS 40 HA LYS 40 -10.683 -4.029 14.072 341 HB2 LYS 40 2HB LYS 40 -9.477 -6.209 12.310 342 HB3 LYS 40 3HB LYS 40 -9.376 -6.226 14.067 343 HG2 LYS 40 2HG LYS 40 -12.008 -6.197 12.560 344 HG3 LYS 40 3HG LYS 40 -11.176 -7.682 13.019 345 HD2 LYS 40 2HD LYS 40 -12.002 -5.559 15.036 346 HD3 LYS 40 3HD LYS 40 -13.044 -6.909 14.569 347 HE2 LYS 40 2HE LYS 40 -10.298 -7.136 15.857 348 HE3 LYS 40 3HE LYS 40 -11.851 -7.440 16.637 349 HZ1 LYS 40 3HZ LYS 40 -10.610 -9.011 14.440 350 HZ2 LYS 40 1HZ LYS 40 -12.210 -9.228 14.953 351 HZ3 LYS 40 2HZ LYS 40 -10.931 -9.522 16.019 352 H GLU 41 H GLU 41 -8.102 -4.552 11.635 353 HA GLU 41 HA GLU 41 -6.025 -3.869 13.511 354 HB2 GLU 41 2HB GLU 41 -4.475 -4.368 11.678 355 HB3 GLU 41 3HB GLU 41 -5.691 -5.629 11.854 356 HG2 GLU 41 2HG GLU 41 -6.941 -4.487 9.930 357 HG3 GLU 41 3HG GLU 41 -5.478 -3.533 9.676 358 H MET 42 H MET 42 -7.809 -2.086 11.093 359 HA MET 42 HA MET 42 -5.956 0.075 10.756 360 HB2 MET 42 2HB MET 42 -8.862 -0.304 10.079 361 HB3 MET 42 3HB MET 42 -8.184 1.310 10.010 362 HG2 MET 42 2HG MET 42 -6.349 0.069 8.503 363 HG3 MET 42 3HG MET 42 -7.719 -1.014 8.209 364 HE1 MET 42 3HE MET 42 -7.798 3.532 7.453 365 HE2 MET 42 1HE MET 42 -6.365 2.664 8.008 366 HE3 MET 42 2HE MET 42 -7.773 2.824 9.063 367 H LYS 43 H LYS 43 -8.812 -0.418 12.821 368 HA LYS 43 HA LYS 43 -8.649 2.161 14.067 369 HB2 LYS 43 2HB LYS 43 -10.152 -0.389 14.606 370 HB3 LYS 43 3HB LYS 43 -10.102 0.838 15.862 371 HG2 LYS 43 2HG LYS 43 -11.431 2.316 14.703 372 HG3 LYS 43 3HG LYS 43 -10.853 1.791 13.127 373 HD2 LYS 43 2HD LYS 43 -13.282 1.293 13.598 374 HD3 LYS 43 3HD LYS 43 -12.325 -0.101 13.098 375 HE2 LYS 43 2HE LYS 43 -13.878 -0.651 14.932 376 HE3 LYS 43 3HE LYS 43 -12.199 -0.875 15.416 377 HZ1 LYS 43 3HZ LYS 43 -13.471 0.200 17.146 378 HZ2 LYS 43 1HZ LYS 43 -13.910 1.454 16.101 379 HZ3 LYS 43 2HZ LYS 43 -12.294 1.262 16.559 380 H LYS 44 H LYS 44 -6.965 -0.882 14.603 381 HA LYS 44 HA LYS 44 -5.794 -0.135 17.115 382 HB2 LYS 44 2HB LYS 44 -4.506 -1.968 15.059 383 HB3 LYS 44 3HB LYS 44 -4.203 -1.929 16.794 384 HG2 LYS 44 2HG LYS 44 -6.656 -2.951 15.355 385 HG3 LYS 44 3HG LYS 44 -5.475 -3.890 16.257 386 HD2 LYS 44 2HD LYS 44 -7.339 -1.833 17.509 387 HD3 LYS 44 3HD LYS 44 -7.703 -3.553 17.403 388 HE2 LYS 44 2HE LYS 44 -6.888 -3.258 19.593 389 HE3 LYS 44 3HE LYS 44 -5.509 -3.915 18.715 390 HZ1 LYS 44 3HZ LYS 44 -4.907 -2.080 20.172 391 HZ2 LYS 44 1HZ LYS 44 -5.944 -1.044 19.336 392 HZ3 LYS 44 2HZ LYS 44 -4.588 -1.697 18.563 393 H LEU 45 H LEU 45 -5.036 0.541 13.728 394 HA LEU 45 HA LEU 45 -2.457 1.738 14.154 395 HB2 LEU 45 2HB LEU 45 -4.419 2.063 11.850 396 HB3 LEU 45 3HB LEU 45 -2.758 2.648 11.838 397 HG LEU 45 HG LEU 45 -3.599 -0.268 12.000 398 HD11 LEU 45 1HD1 LEU 45 -2.391 1.238 9.673 399 HD12 LEU 45 2HD1 LEU 45 -4.057 0.663 9.794 400 HD13 LEU 45 3HD1 LEU 45 -2.729 -0.495 9.738 401 HD21 LEU 45 3HD2 LEU 45 -1.199 -0.758 11.672 402 HD22 LEU 45 1HD2 LEU 45 -1.527 0.057 13.198 403 HD23 LEU 45 2HD2 LEU 45 -0.834 0.961 11.845 404 H ALA 46 H ALA 46 -5.774 2.868 14.108 405 HA ALA 46 HA ALA 46 -5.216 5.678 14.079 406 HB1 ALA 46 3HB ALA 46 -7.633 5.929 14.482 407 HB2 ALA 46 1HB ALA 46 -7.766 4.200 14.816 408 HB3 ALA 46 2HB ALA 46 -7.326 4.756 13.199 409 H GLU 47 H GLU 47 -5.750 3.254 16.588 410 HA GLU 47 HA GLU 47 -5.662 5.093 18.822 411 HB2 GLU 47 2HB GLU 47 -5.179 2.072 18.775 412 HB3 GLU 47 3HB GLU 47 -5.442 3.050 20.221 413 HG2 GLU 47 2HG GLU 47 -7.728 3.537 19.504 414 HG3 GLU 47 3HG GLU 47 -7.471 2.683 18.001 415 H GLU 48 H GLU 48 -3.424 2.594 17.641 416 HA GLU 48 HA GLU 48 -1.126 3.698 19.038 417 HB2 GLU 48 2HB GLU 48 -1.366 1.219 17.285 418 HB3 GLU 48 3HB GLU 48 -0.002 1.616 18.331 419 HG2 GLU 48 2HG GLU 48 -1.223 1.165 20.302 420 HG3 GLU 48 3HG GLU 48 -2.780 1.288 19.480 421 H LYS 49 H LYS 49 -0.936 5.627 17.882 422 HA LYS 49 HA LYS 49 -0.389 5.625 15.002 423 HB2 LYS 49 2HB LYS 49 -0.629 7.896 17.019 424 HB3 LYS 49 3HB LYS 49 -0.369 8.115 15.290 425 HG2 LYS 49 2HG LYS 49 -2.531 7.062 14.806 426 HG3 LYS 49 3HG LYS 49 -2.800 6.776 16.527 427 HD2 LYS 49 2HD LYS 49 -2.440 9.556 15.335 428 HD3 LYS 49 3HD LYS 49 -4.013 8.777 15.503 429 HE2 LYS 49 2HE LYS 49 -3.720 10.265 17.375 430 HE3 LYS 49 3HE LYS 49 -3.598 8.617 17.982 431 HZ1 LYS 49 3HZ LYS 49 -1.940 10.184 18.899 432 HZ2 LYS 49 1HZ LYS 49 -1.260 10.343 17.361 433 HZ3 LYS 49 2HZ LYS 49 -1.237 8.844 18.148 434 H ASN 50 H ASN 50 1.458 4.519 17.142 435 HA ASN 50 HA ASN 50 3.839 5.824 17.461 436 HB2 ASN 50 2HB ASN 50 3.352 3.669 18.491 437 HB3 ASN 50 3HB ASN 50 3.285 2.870 16.927 438 HD21 ASN 50 1HD2 ASN 50 5.191 2.165 16.002 439 HD22 ASN 50 2HD2 ASN 50 6.731 2.279 16.771 440 H PHE 51 H PHE 51 5.521 6.407 16.184 441 HA PHE 51 HA PHE 51 5.407 6.382 13.361 442 HB2 PHE 51 2HB PHE 51 6.677 8.071 14.735 443 HB3 PHE 51 3HB PHE 51 7.861 6.832 15.131 444 HD1 PHE 51 HD2 PHE 51 6.522 8.985 12.421 445 HD2 PHE 51 HD1 PHE 51 9.571 6.170 13.479 446 HE1 PHE 51 HE2 PHE 51 7.770 9.550 10.380 447 HE2 PHE 51 HE1 PHE 51 10.807 6.753 11.436 448 HZ PHE 51 HZ PHE 51 9.905 8.437 9.885 449 H GLU 52 H GLU 52 5.223 4.402 12.501 450 HA GLU 52 HA GLU 52 7.365 2.426 12.816 451 HB2 GLU 52 2HB GLU 52 5.582 1.883 14.500 452 HB3 GLU 52 3HB GLU 52 4.401 1.799 13.198 453 HG2 GLU 52 2HG GLU 52 5.452 -0.174 12.270 454 HG3 GLU 52 3HG GLU 52 6.830 -0.009 13.360 455 H LYS 53 H LYS 53 7.742 1.291 11.002 456 HA LYS 53 HA LYS 53 6.418 2.180 8.542 457 HB2 LYS 53 2HB LYS 53 9.025 0.684 8.974 458 HB3 LYS 53 3HB LYS 53 8.407 1.229 7.414 459 HG2 LYS 53 2HG LYS 53 8.495 3.587 8.259 460 HG3 LYS 53 3HG LYS 53 9.244 2.984 9.743 461 HD2 LYS 53 2HD LYS 53 10.371 2.712 6.934 462 HD3 LYS 53 3HD LYS 53 10.905 3.874 8.150 463 HE2 LYS 53 2HE LYS 53 11.646 2.007 9.597 464 HE3 LYS 53 3HE LYS 53 11.111 0.851 8.373 465 HZ1 LYS 53 3HZ LYS 53 13.499 1.300 8.284 466 HZ2 LYS 53 1HZ LYS 53 13.187 2.929 7.944 467 HZ3 LYS 53 2HZ LYS 53 12.719 1.730 6.847 468 H ILE 54 H ILE 54 4.664 0.991 8.239 469 HA ILE 54 HA ILE 54 4.742 -1.946 8.599 470 HB ILE 54 HB ILE 54 2.286 -0.126 8.633 471 HG12 ILE 54 2HG1 ILE 54 3.727 -1.338 11.041 472 HG13 ILE 54 3HG1 ILE 54 3.855 0.349 10.554 473 HG21 ILE 54 1HG2 ILE 54 1.130 -2.088 9.598 474 HG22 ILE 54 2HG2 ILE 54 2.618 -3.033 9.480 475 HG23 ILE 54 3HG2 ILE 54 1.810 -2.467 8.015 476 HD11 ILE 54 3HD1 ILE 54 1.449 0.632 10.967 477 HD12 ILE 54 1HD1 ILE 54 2.332 0.103 12.399 478 HD13 ILE 54 2HD1 ILE 54 1.355 -1.052 11.495 479 H LEU 55 H LEU 55 4.664 -3.054 6.720 480 HA LEU 55 HA LEU 55 3.646 -1.956 4.245 481 HB2 LEU 55 2HB LEU 55 5.473 -3.692 4.311 482 HB3 LEU 55 3HB LEU 55 4.319 -4.842 4.956 483 HG LEU 55 HG LEU 55 2.939 -4.323 2.765 484 HD11 LEU 55 1HD1 LEU 55 4.386 -3.738 0.827 485 HD12 LEU 55 2HD1 LEU 55 5.679 -3.337 1.956 486 HD13 LEU 55 3HD1 LEU 55 4.166 -2.429 1.984 487 HD21 LEU 55 3HD2 LEU 55 3.938 -6.520 3.235 488 HD22 LEU 55 1HD2 LEU 55 5.476 -5.972 2.566 489 HD23 LEU 55 2HD2 LEU 55 4.057 -6.105 1.527 490 H ILE 56 H ILE 56 1.417 -1.572 4.286 491 HA ILE 56 HA ILE 56 -0.392 -3.587 5.433 492 HB ILE 56 HB ILE 56 -1.042 -0.937 4.057 493 HG12 ILE 56 2HG1 ILE 56 0.029 -0.628 6.273 494 HG13 ILE 56 3HG1 ILE 56 -1.655 -0.117 6.293 495 HG21 ILE 56 1HG2 ILE 56 -3.370 -1.290 4.878 496 HG22 ILE 56 2HG2 ILE 56 -2.916 -2.897 5.448 497 HG23 ILE 56 3HG2 ILE 56 -2.876 -2.529 3.723 498 HD11 ILE 56 3HD1 ILE 56 -0.578 -2.702 7.414 499 HD12 ILE 56 1HD1 ILE 56 -2.268 -2.185 7.437 500 HD13 ILE 56 2HD1 ILE 56 -1.052 -1.270 8.325 501 H LYS 57 H LYS 57 -0.508 -5.300 4.175 502 HA LYS 57 HA LYS 57 -0.578 -5.130 1.256 503 HB2 LYS 57 2HB LYS 57 0.900 -6.826 2.118 504 HB3 LYS 57 3HB LYS 57 -0.287 -7.400 3.277 505 HG2 LYS 57 2HG LYS 57 -0.869 -7.678 0.330 506 HG3 LYS 57 3HG LYS 57 0.278 -8.783 1.086 507 HD2 LYS 57 2HD LYS 57 -1.437 -9.529 2.680 508 HD3 LYS 57 3HD LYS 57 -2.585 -8.361 2.038 509 HE2 LYS 57 2HE LYS 57 -2.542 -9.556 -0.134 510 HE3 LYS 57 3HE LYS 57 -1.447 -10.751 0.568 511 HZ1 LYS 57 3HZ LYS 57 -3.618 -11.628 0.680 512 HZ2 LYS 57 1HZ LYS 57 -4.263 -10.204 1.326 513 HZ3 LYS 57 2HZ LYS 57 -3.228 -11.157 2.257 514 H SER 58 H SER 58 -2.353 -5.681 0.065 515 HA SER 58 HA SER 58 -4.641 -7.032 1.164 516 HB2 SER 58 2HB SER 58 -5.148 -4.667 1.756 517 HB3 SER 58 3HB SER 58 -4.963 -4.203 0.066 518 HG SER 58 HG SER 58 -7.141 -5.049 1.269 519 H ASN 59 H ASN 59 -6.320 -7.228 -0.651 520 HA ASN 59 HA ASN 59 -5.067 -7.586 -3.297 521 HB2 ASN 59 2HB ASN 59 -6.175 -9.901 -3.363 522 HB3 ASN 59 3HB ASN 59 -4.783 -9.753 -2.301 523 HD21 ASN 59 1HD2 ASN 59 -8.280 -10.025 -2.412 524 HD22 ASN 59 2HD2 ASN 59 -8.498 -10.512 -0.766 525 H ASP 60 H ASP 60 -7.267 -5.895 -1.872 526 HA ASP 60 HA ASP 60 -9.148 -5.920 -4.110 527 HB2 ASP 60 2HB ASP 60 -10.298 -7.438 -2.597 528 HB3 ASP 60 3HB ASP 60 -10.029 -6.360 -1.228 529 H LYS 61 H LYS 61 -9.314 -3.917 -4.768 530 HA LYS 61 HA LYS 61 -8.146 -1.703 -3.479 531 HB2 LYS 61 2HB LYS 61 -8.856 -0.366 -5.342 532 HB3 LYS 61 3HB LYS 61 -8.401 -1.946 -5.962 533 HG2 LYS 61 2HG LYS 61 -11.295 -1.186 -5.421 534 HG3 LYS 61 3HG LYS 61 -10.497 -0.844 -6.958 535 HD2 LYS 61 2HD LYS 61 -10.113 -3.233 -7.334 536 HD3 LYS 61 3HD LYS 61 -10.791 -3.630 -5.752 537 HE2 LYS 61 2HE LYS 61 -12.992 -2.943 -6.454 538 HE3 LYS 61 3HE LYS 61 -12.363 -2.249 -7.947 539 HZ1 LYS 61 3HZ LYS 61 -11.791 -4.413 -8.733 540 HZ2 LYS 61 1HZ LYS 61 -13.419 -4.422 -8.272 541 HZ3 LYS 61 2HZ LYS 61 -12.252 -5.135 -7.274 542 H GLN 62 H GLN 62 -11.360 -2.960 -3.138 543 HA GLN 62 HA GLN 62 -12.712 -0.499 -2.512 544 HB2 GLN 62 2HB GLN 62 -13.476 -3.367 -1.798 545 HB3 GLN 62 3HB GLN 62 -14.539 -1.966 -1.677 546 HG2 GLN 62 2HG GLN 62 -13.348 -3.053 -4.254 547 HG3 GLN 62 3HG GLN 62 -14.991 -3.355 -3.686 548 HE21 GLN 62 1HE2 GLN 62 -16.507 -1.663 -3.752 549 HE22 GLN 62 2HE2 GLN 62 -16.264 -0.242 -4.705 550 H LEU 63 H LEU 63 -11.135 -3.088 -0.665 551 HA LEU 63 HA LEU 63 -11.512 -2.161 1.960 552 HB2 LEU 63 2HB LEU 63 -9.052 -3.563 0.828 553 HB3 LEU 63 3HB LEU 63 -9.465 -3.443 2.536 554 HG LEU 63 HG LEU 63 -10.997 -4.992 0.412 555 HD11 LEU 63 1HD1 LEU 63 -10.328 -6.990 1.642 556 HD12 LEU 63 2HD1 LEU 63 -9.379 -6.005 2.759 557 HD13 LEU 63 3HD1 LEU 63 -8.927 -6.097 1.054 558 HD21 LEU 63 3HD2 LEU 63 -12.420 -5.810 2.259 559 HD22 LEU 63 1HD2 LEU 63 -12.584 -4.075 2.006 560 HD23 LEU 63 2HD2 LEU 63 -11.630 -4.681 3.364 561 H LEU 64 H LEU 64 -9.206 -1.200 -0.522 562 HA LEU 64 HA LEU 64 -7.542 0.449 1.122 563 HB2 LEU 64 2HB LEU 64 -7.871 0.144 -1.865 564 HB3 LEU 64 3HB LEU 64 -6.828 1.386 -1.199 565 HG LEU 64 HG LEU 64 -5.431 -0.347 -0.122 566 HD11 LEU 64 1HD1 LEU 64 -7.064 -2.121 0.208 567 HD12 LEU 64 2HD1 LEU 64 -5.668 -2.709 -0.692 568 HD13 LEU 64 3HD1 LEU 64 -7.179 -2.365 -1.537 569 HD21 LEU 64 3HD2 LEU 64 -4.356 -1.183 -2.130 570 HD22 LEU 64 1HD2 LEU 64 -4.854 0.495 -2.347 571 HD23 LEU 64 2HD2 LEU 64 -5.792 -0.804 -3.093 572 H LYS 65 H LYS 65 -10.398 1.075 -0.929 573 HA LYS 65 HA LYS 65 -10.367 3.892 -0.849 574 HB2 LYS 65 2HB LYS 65 -12.750 1.992 -0.976 575 HB3 LYS 65 3HB LYS 65 -12.854 3.734 -1.231 576 HG2 LYS 65 2HG LYS 65 -11.358 3.521 -3.192 577 HG3 LYS 65 3HG LYS 65 -11.295 1.775 -2.947 578 HD2 LYS 65 2HD LYS 65 -12.887 2.369 -4.724 579 HD3 LYS 65 3HD LYS 65 -13.706 1.610 -3.362 580 HE2 LYS 65 2HE LYS 65 -14.458 3.829 -2.568 581 HE3 LYS 65 3HE LYS 65 -13.611 4.597 -3.913 582 HZ1 LYS 65 3HZ LYS 65 -15.077 3.547 -5.448 583 HZ2 LYS 65 1HZ LYS 65 -16.016 4.305 -4.265 584 HZ3 LYS 65 2HZ LYS 65 -15.806 2.628 -4.229 585 H GLU 66 H GLU 66 -11.953 1.510 1.240 586 HA GLU 66 HA GLU 66 -13.070 3.340 3.112 587 HB2 GLU 66 2HB GLU 66 -12.364 0.423 3.623 588 HB3 GLU 66 3HB GLU 66 -13.593 1.384 4.442 589 HG2 GLU 66 2HG GLU 66 -13.657 0.471 1.548 590 HG3 GLU 66 3HG GLU 66 -14.584 -0.218 2.873 591 H MET 67 H MET 67 -9.973 1.727 2.874 592 HA MET 67 HA MET 67 -8.975 2.092 5.485 593 HB2 MET 67 2HB MET 67 -8.063 0.542 3.686 594 HB3 MET 67 3HB MET 67 -7.393 1.949 2.877 595 HG2 MET 67 2HG MET 67 -6.010 2.378 4.915 596 HG3 MET 67 3HG MET 67 -6.611 0.870 5.592 597 HE1 MET 67 3HE MET 67 -6.144 -1.553 4.417 598 HE2 MET 67 1HE MET 67 -5.157 -1.729 2.970 599 HE3 MET 67 2HE MET 67 -6.733 -0.943 2.867 600 H LEU 68 H LEU 68 -8.467 3.927 2.500 601 HA LEU 68 HA LEU 68 -6.753 5.868 3.663 602 HB2 LEU 68 2HB LEU 68 -8.112 5.722 0.961 603 HB3 LEU 68 3HB LEU 68 -6.945 6.970 1.390 604 HG LEU 68 HG LEU 68 -6.311 3.986 1.444 605 HD11 LEU 68 1HD1 LEU 68 -5.067 4.290 -0.628 606 HD12 LEU 68 2HD1 LEU 68 -5.646 5.954 -0.744 607 HD13 LEU 68 3HD1 LEU 68 -6.786 4.609 -0.847 608 HD21 LEU 68 3HD2 LEU 68 -4.459 6.390 1.575 609 HD22 LEU 68 1HD2 LEU 68 -3.965 4.691 1.568 610 HD23 LEU 68 2HD2 LEU 68 -4.885 5.335 2.924 611 H GLU 69 H GLU 69 -10.234 5.703 3.450 612 HA GLU 69 HA GLU 69 -10.921 8.417 3.815 613 HB2 GLU 69 2HB GLU 69 -12.260 5.958 5.028 614 HB3 GLU 69 3HB GLU 69 -12.965 7.572 5.000 615 HG2 GLU 69 2HG GLU 69 -12.403 5.769 2.636 616 HG3 GLU 69 3HG GLU 69 -13.976 6.216 3.282 617 H LEU 70 H LEU 70 -10.193 5.887 6.236 618 HA LEU 70 HA LEU 70 -10.397 7.597 8.529 619 HB2 LEU 70 2HB LEU 70 -8.994 4.902 8.303 620 HB3 LEU 70 3HB LEU 70 -9.501 5.689 9.792 621 HG LEU 70 HG LEU 70 -11.311 4.504 7.649 622 HD11 LEU 70 1HD1 LEU 70 -10.263 2.820 9.059 623 HD12 LEU 70 2HD1 LEU 70 -11.986 2.932 9.407 624 HD13 LEU 70 3HD1 LEU 70 -10.817 3.654 10.516 625 HD21 LEU 70 3HD2 LEU 70 -13.209 5.080 9.097 626 HD22 LEU 70 1HD2 LEU 70 -12.364 6.524 8.550 627 HD23 LEU 70 2HD2 LEU 70 -12.128 5.937 10.200 628 H ILE 71 H ILE 71 -7.751 6.466 6.470 629 HA ILE 71 HA ILE 71 -5.581 7.427 8.044 630 HB ILE 71 HB ILE 71 -5.745 6.739 5.080 631 HG12 ILE 71 2HG1 ILE 71 -4.616 5.208 7.475 632 HG13 ILE 71 3HG1 ILE 71 -6.083 4.815 6.584 633 HG21 ILE 71 1HG2 ILE 71 -3.218 7.321 6.679 634 HG22 ILE 71 2HG2 ILE 71 -3.902 8.350 5.420 635 HG23 ILE 71 3HG2 ILE 71 -3.288 6.755 5.007 636 HD11 ILE 71 3HD1 ILE 71 -4.701 4.326 4.592 637 HD12 ILE 71 1HD1 ILE 71 -4.307 3.313 5.981 638 HD13 ILE 71 2HD1 ILE 71 -3.250 4.654 5.546 639 H SER 72 H SER 72 -7.592 8.973 5.553 640 HA SER 72 HA SER 72 -6.142 11.322 5.101 641 HB2 SER 72 2HB SER 72 -9.150 10.859 5.130 642 HB3 SER 72 3HB SER 72 -8.406 12.357 4.567 643 HG SER 72 HG SER 72 -8.772 10.065 3.242 644 H LYS 73 H LYS 73 -8.276 10.425 7.743 645 HA LYS 73 HA LYS 73 -8.475 13.021 8.962 646 HB2 LYS 73 2HB LYS 73 -9.085 10.256 10.089 647 HB3 LYS 73 3HB LYS 73 -9.612 11.791 10.787 648 HG2 LYS 73 2HG LYS 73 -10.976 12.241 8.777 649 HG3 LYS 73 3HG LYS 73 -10.423 10.730 8.053 650 HD2 LYS 73 2HD LYS 73 -12.670 10.471 8.984 651 HD3 LYS 73 3HD LYS 73 -11.525 9.452 9.857 652 HE2 LYS 73 2HE LYS 73 -13.113 10.570 11.384 653 HE3 LYS 73 3HE LYS 73 -11.458 11.084 11.701 654 HZ1 LYS 73 3HZ LYS 73 -13.497 12.611 10.163 655 HZ2 LYS 73 1HZ LYS 73 -11.901 13.108 10.427 656 HZ3 LYS 73 2HZ LYS 73 -12.966 12.954 11.730 657 H LEU 74 H LEU 74 -6.416 10.193 9.364 658 HA LEU 74 HA LEU 74 -5.004 11.165 11.696 659 HB2 LEU 74 2HB LEU 74 -4.301 8.954 9.723 660 HB3 LEU 74 3HB LEU 74 -3.515 9.219 11.274 661 HG LEU 74 HG LEU 74 -6.439 8.432 10.908 662 HD11 LEU 74 1HD1 LEU 74 -4.112 6.714 11.812 663 HD12 LEU 74 2HD1 LEU 74 -4.957 6.598 10.265 664 HD13 LEU 74 3HD1 LEU 74 -5.812 6.232 11.761 665 HD21 LEU 74 3HD2 LEU 74 -6.451 8.065 13.344 666 HD22 LEU 74 1HD2 LEU 74 -6.116 9.748 12.947 667 HD23 LEU 74 2HD2 LEU 74 -4.801 8.684 13.455 668 H GLY 75 H GLY 75 -4.623 11.314 8.233 669 HA2 GLY 75 2HA GLY 75 -3.328 12.478 6.791 670 HA3 GLY 75 3HA GLY 75 -3.063 13.603 8.108 671 H TYR 76 H TYR 76 -1.842 10.621 6.574 672 HA TYR 76 HA TYR 76 0.877 11.568 6.993 673 HB2 TYR 76 2HB TYR 76 1.741 9.382 7.842 674 HB3 TYR 76 3HB TYR 76 0.706 10.211 8.984 675 HD1 TYR 76 HD1 TYR 76 -1.533 9.300 9.547 676 HD2 TYR 76 HD2 TYR 76 1.085 7.195 6.905 677 HE1 TYR 76 HE1 TYR 76 -2.832 7.253 9.881 678 HE2 TYR 76 HE2 TYR 76 -0.230 5.153 7.237 679 HH TYR 76 HH TYR 76 -3.285 5.126 8.695 680 H LYS 77 H LYS 77 2.487 10.178 5.853 681 HA LYS 77 HA LYS 77 1.642 9.928 3.116 682 HB2 LYS 77 2HB LYS 77 4.300 9.773 4.552 683 HB3 LYS 77 3HB LYS 77 4.185 9.298 2.862 684 HG2 LYS 77 2HG LYS 77 3.275 12.014 3.864 685 HG3 LYS 77 3HG LYS 77 4.925 11.691 3.312 686 HD2 LYS 77 2HD LYS 77 4.199 11.194 1.084 687 HD3 LYS 77 3HD LYS 77 2.501 11.099 1.566 688 HE2 LYS 77 2HE LYS 77 2.517 13.537 2.035 689 HE3 LYS 77 3HE LYS 77 4.200 13.616 1.513 690 HZ1 LYS 77 3HZ LYS 77 1.941 12.743 -0.205 691 HZ2 LYS 77 1HZ LYS 77 3.547 12.975 -0.687 692 HZ3 LYS 77 2HZ LYS 77 2.604 14.297 -0.206 693 H VAL 78 H VAL 78 0.415 8.176 2.794 694 HA VAL 78 HA VAL 78 1.529 5.495 3.238 695 HB VAL 78 HB VAL 78 -1.185 6.362 2.126 696 HG11 VAL 78 1HG1 VAL 78 -0.193 3.553 2.787 697 HG12 VAL 78 2HG1 VAL 78 -0.496 4.183 1.166 698 HG13 VAL 78 3HG1 VAL 78 -1.836 3.977 2.294 699 HG21 VAL 78 3HG2 VAL 78 -2.083 5.517 4.269 700 HG22 VAL 78 1HG2 VAL 78 -0.929 6.825 4.534 701 HG23 VAL 78 2HG2 VAL 78 -0.445 5.151 4.822 702 H PHE 79 H PHE 79 2.449 4.374 1.620 703 HA PHE 79 HA PHE 79 2.661 5.575 -1.062 704 HB2 PHE 79 2HB PHE 79 4.373 3.473 0.353 705 HB3 PHE 79 3HB PHE 79 4.648 4.063 -1.281 706 HD1 PHE 79 HD2 PHE 79 4.793 4.961 2.315 707 HD2 PHE 79 HD1 PHE 79 5.714 6.204 -1.673 708 HE1 PHE 79 HE2 PHE 79 6.225 6.751 3.190 709 HE2 PHE 79 HE1 PHE 79 7.146 7.984 -0.786 710 HZ PHE 79 HZ PHE 79 7.406 8.261 1.642 711 H LEU 80 H LEU 80 0.986 4.739 -2.212 712 HA LEU 80 HA LEU 80 0.168 1.963 -1.913 713 HB2 LEU 80 2HB LEU 80 -1.596 3.605 -1.787 714 HB3 LEU 80 3HB LEU 80 -1.096 4.335 -3.302 715 HG LEU 80 HG LEU 80 -1.879 2.402 -4.575 716 HD11 LEU 80 1HD1 LEU 80 -2.604 1.117 -1.930 717 HD12 LEU 80 2HD1 LEU 80 -1.304 0.616 -3.016 718 HD13 LEU 80 3HD1 LEU 80 -2.980 0.484 -3.538 719 HD21 LEU 80 3HD2 LEU 80 -3.996 3.260 -2.572 720 HD22 LEU 80 1HD2 LEU 80 -4.286 2.530 -4.155 721 HD23 LEU 80 2HD2 LEU 80 -3.546 4.124 -4.046 722 H LEU 81 H LEU 81 0.490 0.465 -3.389 723 HA LEU 81 HA LEU 81 1.505 1.149 -6.077 724 HB2 LEU 81 2HB LEU 81 3.245 0.067 -4.759 725 HB3 LEU 81 3HB LEU 81 2.165 -1.239 -4.321 726 HG LEU 81 HG LEU 81 2.119 -1.993 -6.698 727 HD11 LEU 81 1HD1 LEU 81 2.472 0.108 -7.849 728 HD12 LEU 81 2HD1 LEU 81 3.722 -1.038 -8.327 729 HD13 LEU 81 3HD1 LEU 81 4.098 0.249 -7.179 730 HD21 LEU 81 3HD2 LEU 81 3.749 -2.973 -5.161 731 HD22 LEU 81 1HD2 LEU 81 4.920 -1.712 -5.565 732 HD23 LEU 81 2HD2 LEU 81 4.404 -2.873 -6.790 733 H LEU 82 H LEU 82 0.258 0.489 -7.664 734 HA LEU 82 HA LEU 82 -1.785 -1.615 -7.228 735 HB2 LEU 82 2HB LEU 82 -1.768 0.751 -9.148 736 HB3 LEU 82 3HB LEU 82 -3.016 -0.485 -9.084 737 HG LEU 82 HG LEU 82 -2.370 1.505 -6.871 738 HD11 LEU 82 1HD1 LEU 82 -4.772 1.359 -8.705 739 HD12 LEU 82 2HD1 LEU 82 -3.473 2.553 -8.779 740 HD13 LEU 82 3HD1 LEU 82 -4.536 2.500 -7.375 741 HD21 LEU 82 3HD2 LEU 82 -3.128 -0.614 -5.905 742 HD22 LEU 82 1HD2 LEU 82 -4.541 -0.623 -6.967 743 HD23 LEU 82 2HD2 LEU 82 -4.370 0.621 -5.725 744 H ALA 83 H ALA 83 -0.770 -3.433 -7.948 745 HA ALA 83 HA ALA 83 0.545 -3.374 -10.613 746 HB1 ALA 83 3HB ALA 83 2.142 -3.830 -8.796 747 HB2 ALA 83 1HB ALA 83 1.965 -5.233 -9.856 748 HB3 ALA 83 2HB ALA 83 1.176 -5.209 -8.276 749 H ASP 84 H ASP 84 -0.855 -4.131 -12.022 750 HA ASP 84 HA ASP 84 -1.820 -6.791 -12.031 751 HB2 ASP 84 2HB ASP 84 -3.508 -5.994 -10.429 752 HB3 ASP 84 3HB ASP 84 -3.878 -4.608 -11.444 753 H GLN 85 H GLN 85 -2.545 -7.345 -14.067 754 HA GLN 85 HA GLN 85 -1.579 -5.634 -16.169 755 HB2 GLN 85 2HB GLN 85 -2.902 -8.378 -16.303 756 HB3 GLN 85 3HB GLN 85 -2.074 -7.575 -17.639 757 HG2 GLN 85 2HG GLN 85 0.037 -7.599 -16.320 758 HG3 GLN 85 3HG GLN 85 -0.794 -8.455 -15.022 759 HE21 GLN 85 1HE2 GLN 85 1.548 -9.279 -16.520 760 HE22 GLN 85 2HE2 GLN 85 1.146 -10.782 -17.277 761 H ASP 86 H ASP 86 -4.737 -6.313 -14.791 762 HA ASP 86 HA ASP 86 -6.140 -4.755 -16.819 763 HB2 ASP 86 2HB ASP 86 -7.353 -6.499 -15.455 764 HB3 ASP 86 3HB ASP 86 -7.088 -5.527 -14.013 765 H GLU 87 H GLU 87 -4.614 -3.049 -16.810 766 HA GLU 87 HA GLU 87 -4.049 -1.451 -14.476 767 HB2 GLU 87 2HB GLU 87 -2.702 -0.092 -16.008 768 HB3 GLU 87 3HB GLU 87 -2.348 -1.797 -16.214 769 HG2 GLU 87 2HG GLU 87 -3.474 -1.898 -18.298 770 HG3 GLU 87 3HG GLU 87 -4.285 -0.357 -18.037 771 H ASN 88 H ASN 88 -6.561 -1.517 -16.752 772 HA ASN 88 HA ASN 88 -7.203 1.199 -17.135 773 HB2 ASN 88 2HB ASN 88 -8.116 -0.642 -18.521 774 HB3 ASN 88 3HB ASN 88 -9.027 -1.247 -17.142 775 HD21 ASN 88 1HD2 ASN 88 -11.056 -0.996 -18.065 776 HD22 ASN 88 2HD2 ASN 88 -11.741 0.543 -18.452 777 H GLU 89 H GLU 89 -8.522 -1.186 -14.788 778 HA GLU 89 HA GLU 89 -10.124 0.739 -13.383 779 HB2 GLU 89 2HB GLU 89 -10.732 -1.650 -13.426 780 HB3 GLU 89 3HB GLU 89 -9.256 -2.057 -12.555 781 HG2 GLU 89 2HG GLU 89 -10.046 -0.815 -10.588 782 HG3 GLU 89 3HG GLU 89 -11.504 -0.332 -11.457 783 H LEU 90 H LEU 90 -6.841 -0.580 -12.953 784 HA LEU 90 HA LEU 90 -6.216 0.525 -10.440 785 HB2 LEU 90 2HB LEU 90 -4.341 0.239 -12.815 786 HB3 LEU 90 3HB LEU 90 -3.850 0.495 -11.144 787 HG LEU 90 HG LEU 90 -5.112 -1.995 -12.335 788 HD11 LEU 90 1HD1 LEU 90 -2.755 -1.754 -12.810 789 HD12 LEU 90 2HD1 LEU 90 -3.005 -3.052 -11.649 790 HD13 LEU 90 3HD1 LEU 90 -2.402 -1.490 -11.099 791 HD21 LEU 90 3HD2 LEU 90 -4.491 -1.457 -9.409 792 HD22 LEU 90 1HD2 LEU 90 -4.926 -3.029 -10.091 793 HD23 LEU 90 2HD2 LEU 90 -6.086 -1.706 -10.118 794 H GLU 91 H GLU 91 -6.103 1.945 -13.698 795 HA GLU 91 HA GLU 91 -4.896 4.414 -13.097 796 HB2 GLU 91 2HB GLU 91 -5.237 3.568 -15.436 797 HB3 GLU 91 3HB GLU 91 -6.968 3.848 -15.260 798 HG2 GLU 91 2HG GLU 91 -6.243 6.332 -14.729 799 HG3 GLU 91 3HG GLU 91 -4.729 5.865 -15.498 800 H GLU 92 H GLU 92 -8.337 3.504 -13.382 801 HA GLU 92 HA GLU 92 -9.570 5.923 -12.783 802 HB2 GLU 92 2HB GLU 92 -10.502 3.107 -12.066 803 HB3 GLU 92 3HB GLU 92 -11.532 4.539 -12.030 804 HG2 GLU 92 2HG GLU 92 -10.221 3.312 -14.474 805 HG3 GLU 92 3HG GLU 92 -11.929 3.219 -14.048 806 H PHE 93 H PHE 93 -8.618 3.315 -10.592 807 HA PHE 93 HA PHE 93 -9.604 4.409 -8.195 808 HB2 PHE 93 2HB PHE 93 -9.136 2.012 -8.460 809 HB3 PHE 93 3HB PHE 93 -7.420 2.344 -8.671 810 HD1 PHE 93 HD1 PHE 93 -9.948 3.514 -6.133 811 HD2 PHE 93 HD2 PHE 93 -6.254 1.481 -6.822 812 HE1 PHE 93 HE1 PHE 93 -9.590 3.304 -3.719 813 HE2 PHE 93 HE2 PHE 93 -5.920 1.282 -4.405 814 HZ PHE 93 HZ PHE 93 -7.586 2.201 -2.854 815 H LYS 94 H LYS 94 -6.243 4.439 -9.522 816 HA LYS 94 HA LYS 94 -5.094 5.761 -7.291 817 HB2 LYS 94 2HB LYS 94 -3.070 6.096 -8.680 818 HB3 LYS 94 3HB LYS 94 -3.655 4.448 -8.713 819 HG2 LYS 94 2HG LYS 94 -3.029 4.791 -10.910 820 HG3 LYS 94 3HG LYS 94 -4.759 5.078 -10.969 821 HD2 LYS 94 2HD LYS 94 -3.589 6.717 -12.334 822 HD3 LYS 94 3HD LYS 94 -4.347 7.527 -10.964 823 HE2 LYS 94 2HE LYS 94 -2.175 7.649 -9.813 824 HE3 LYS 94 3HE LYS 94 -1.413 6.758 -11.134 825 HZ1 LYS 94 3HZ LYS 94 -1.027 9.131 -11.314 826 HZ2 LYS 94 1HZ LYS 94 -2.690 9.431 -11.374 827 HZ3 LYS 94 2HZ LYS 94 -1.944 8.572 -12.625 828 H ARG 95 H ARG 95 -6.885 6.986 -9.969 829 HA ARG 95 HA ARG 95 -5.864 9.636 -9.992 830 HB2 ARG 95 2HB ARG 95 -8.327 8.310 -11.116 831 HB3 ARG 95 3HB ARG 95 -8.203 10.065 -11.159 832 HG2 ARG 95 2HG ARG 95 -6.350 10.040 -12.614 833 HG3 ARG 95 3HG ARG 95 -5.950 8.367 -12.231 834 HD2 ARG 95 2HD ARG 95 -6.898 8.651 -14.509 835 HD3 ARG 95 3HD ARG 95 -7.834 7.550 -13.493 836 HE ARG 95 HE ARG 95 -8.857 10.218 -13.384 837 HH11 ARG 95 1HH1 ARG 95 -8.861 7.329 -15.406 838 HH12 ARG 95 2HH1 ARG 95 -10.384 7.711 -16.135 839 HH21 ARG 95 1HH2 ARG 95 -10.870 10.669 -14.336 840 HH22 ARG 95 2HH2 ARG 95 -11.522 9.595 -15.537 841 H LYS 96 H LYS 96 -8.429 8.074 -8.088 842 HA LYS 96 HA LYS 96 -9.308 10.484 -6.783 843 HB2 LYS 96 2HB LYS 96 -9.558 7.577 -5.884 844 HB3 LYS 96 3HB LYS 96 -10.246 8.929 -5.001 845 HG2 LYS 96 2HG LYS 96 -12.079 8.123 -6.171 846 HG3 LYS 96 3HG LYS 96 -11.531 9.451 -7.193 847 HD2 LYS 96 2HD LYS 96 -10.427 7.867 -8.707 848 HD3 LYS 96 3HD LYS 96 -10.859 6.518 -7.656 849 HE2 LYS 96 2HE LYS 96 -13.263 6.974 -8.105 850 HE3 LYS 96 3HE LYS 96 -12.796 8.285 -9.193 851 HZ1 LYS 96 3HZ LYS 96 -11.619 6.647 -10.549 852 HZ2 LYS 96 1HZ LYS 96 -13.267 6.283 -10.425 853 HZ3 LYS 96 2HZ LYS 96 -12.138 5.412 -9.520 854 H ILE 97 H ILE 97 -6.839 8.065 -6.157 855 HA ILE 97 HA ILE 97 -6.397 8.745 -3.400 856 HB ILE 97 HB ILE 97 -4.674 7.019 -5.234 857 HG12 ILE 97 2HG1 ILE 97 -6.885 6.068 -5.361 858 HG13 ILE 97 3HG1 ILE 97 -5.984 5.057 -4.243 859 HG21 ILE 97 1HG2 ILE 97 -4.893 7.036 -2.206 860 HG22 ILE 97 2HG2 ILE 97 -3.525 7.603 -3.164 861 HG23 ILE 97 3HG2 ILE 97 -3.941 5.890 -3.158 862 HD11 ILE 97 3HD1 ILE 97 -8.219 5.369 -3.438 863 HD12 ILE 97 1HD1 ILE 97 -8.071 7.123 -3.557 864 HD13 ILE 97 2HD1 ILE 97 -7.116 6.237 -2.368 865 H GLU 98 H GLU 98 -4.668 9.314 -6.421 866 HA GLU 98 HA GLU 98 -2.384 10.639 -5.374 867 HB2 GLU 98 2HB GLU 98 -2.457 9.492 -7.591 868 HB3 GLU 98 3HB GLU 98 -3.566 10.718 -8.182 869 HG2 GLU 98 2HG GLU 98 -1.829 12.432 -7.970 870 HG3 GLU 98 3HG GLU 98 -0.719 11.243 -7.279 871 H SER 99 H SER 99 -5.569 11.670 -6.427 872 HA SER 99 HA SER 99 -5.188 14.462 -6.518 873 HB2 SER 99 2HB SER 99 -7.185 13.399 -7.484 874 HB3 SER 99 3HB SER 99 -7.691 12.839 -5.891 875 HG SER 99 HG SER 99 -7.549 15.507 -6.834 876 H GLN 100 H GLN 100 -5.781 12.231 -3.875 877 HA GLN 100 HA GLN 100 -6.323 14.254 -1.869 878 HB2 GLN 100 2HB GLN 100 -5.816 11.259 -1.631 879 HB3 GLN 100 3HB GLN 100 -6.342 12.293 -0.301 880 HG2 GLN 100 2HG GLN 100 -8.454 12.732 -1.423 881 HG3 GLN 100 3HG GLN 100 -7.930 11.852 -2.853 882 HE21 GLN 100 1HE2 GLN 100 -7.871 9.578 -2.792 883 HE22 GLN 100 2HE2 GLN 100 -8.668 8.667 -1.561 884 H GLY 101 H GLY 101 -3.495 13.260 -3.350 885 HA2 GLY 101 2HA GLY 101 -1.393 14.166 -2.944 886 HA3 GLY 101 3HA GLY 101 -1.870 14.579 -1.306 887 H TYR 102 H TYR 102 -2.668 11.366 -1.994 888 HA TYR 102 HA TYR 102 -0.509 10.232 -0.448 889 HB2 TYR 102 2HB TYR 102 -2.737 8.926 -2.073 890 HB3 TYR 102 3HB TYR 102 -1.558 8.013 -1.138 891 HD1 TYR 102 HD2 TYR 102 -1.478 8.335 1.382 892 HD2 TYR 102 HD1 TYR 102 -4.694 9.830 -1.005 893 HE1 TYR 102 HE2 TYR 102 -2.883 8.497 3.379 894 HE2 TYR 102 HE1 TYR 102 -6.107 9.994 0.997 895 HH TYR 102 HH TYR 102 -6.273 9.107 3.209 896 H GLU 103 H GLU 103 1.105 8.812 -1.219 897 HA GLU 103 HA GLU 103 2.032 9.370 -3.933 898 HB2 GLU 103 2HB GLU 103 3.627 9.484 -2.004 899 HB3 GLU 103 3HB GLU 103 3.365 7.772 -1.693 900 HG2 GLU 103 2HG GLU 103 5.466 8.162 -2.921 901 HG3 GLU 103 3HG GLU 103 4.337 7.184 -3.860 902 H VAL 104 H VAL 104 0.890 8.144 -5.371 903 HA VAL 104 HA VAL 104 0.797 5.225 -4.939 904 HB VAL 104 HB VAL 104 -1.456 5.937 -4.542 905 HG11 VAL 104 1HG1 VAL 104 -1.397 7.468 -7.168 906 HG12 VAL 104 2HG1 VAL 104 -1.409 8.174 -5.549 907 HG13 VAL 104 3HG1 VAL 104 -2.806 7.261 -6.122 908 HG21 VAL 104 3HG2 VAL 104 -2.697 4.732 -6.298 909 HG22 VAL 104 1HG2 VAL 104 -1.200 3.885 -5.898 910 HG23 VAL 104 2HG2 VAL 104 -1.306 4.837 -7.382 911 H ARG 105 H ARG 105 2.005 4.267 -6.352 912 HA ARG 105 HA ARG 105 2.299 5.311 -9.103 913 HB2 ARG 105 2HB ARG 105 3.884 3.147 -7.657 914 HB3 ARG 105 3HB ARG 105 4.173 3.691 -9.307 915 HG2 ARG 105 2HG ARG 105 4.531 5.344 -6.780 916 HG3 ARG 105 3HG ARG 105 5.814 4.627 -7.752 917 HD2 ARG 105 2HD ARG 105 5.832 6.851 -8.464 918 HD3 ARG 105 3HD ARG 105 4.827 6.085 -9.694 919 HE ARG 105 HE ARG 105 3.317 7.158 -7.488 920 HH11 ARG 105 1HH1 ARG 105 4.809 8.046 -10.546 921 HH12 ARG 105 2HH1 ARG 105 3.771 9.410 -10.780 922 HH21 ARG 105 1HH2 ARG 105 1.950 8.905 -7.836 923 HH22 ARG 105 2HH2 ARG 105 2.140 9.898 -9.239 924 H LYS 106 H LYS 106 1.556 4.209 -10.776 925 HA LYS 106 HA LYS 106 -0.084 1.787 -10.332 926 HB2 LYS 106 2HB LYS 106 -1.495 3.682 -10.778 927 HB3 LYS 106 3HB LYS 106 -0.461 4.257 -12.073 928 HG2 LYS 106 2HG LYS 106 -1.817 1.596 -12.420 929 HG3 LYS 106 3HG LYS 106 -2.800 3.059 -12.544 930 HD2 LYS 106 2HD LYS 106 -1.253 3.924 -14.307 931 HD3 LYS 106 3HD LYS 106 -0.316 2.435 -14.200 932 HE2 LYS 106 2HE LYS 106 -2.380 1.180 -14.868 933 HE3 LYS 106 3HE LYS 106 -3.178 2.733 -15.133 934 HZ1 LYS 106 3HZ LYS 106 -0.701 1.834 -16.499 935 HZ2 LYS 106 1HZ LYS 106 -1.543 3.268 -16.791 936 HZ3 LYS 106 2HZ LYS 106 -2.253 1.785 -17.172 937 H VAL 107 H VAL 107 0.740 0.048 -11.249 938 HA VAL 107 HA VAL 107 2.245 0.113 -13.779 939 HB VAL 107 HB VAL 107 3.991 -1.398 -12.933 940 HG11 VAL 107 1HG1 VAL 107 4.465 1.005 -12.720 941 HG12 VAL 107 2HG1 VAL 107 5.233 0.098 -11.416 942 HG13 VAL 107 3HG1 VAL 107 3.757 1.017 -11.102 943 HG21 VAL 107 3HG2 VAL 107 4.198 -1.975 -10.523 944 HG22 VAL 107 1HG2 VAL 107 2.730 -2.642 -11.242 945 HG23 VAL 107 2HG2 VAL 107 2.636 -1.210 -10.215 946 H THR 108 H THR 108 2.769 -2.505 -14.163 947 HA THR 108 HA THR 108 0.187 -3.934 -13.847 948 HB THR 108 HB THR 108 0.751 -5.024 -16.104 949 HG1 THR 108 HG1 THR 108 2.488 -4.383 -17.157 950 HG21 THR 108 3HG2 THR 108 0.259 -2.029 -16.105 951 HG22 THR 108 1HG2 THR 108 -0.973 -3.286 -15.954 952 HG23 THR 108 2HG2 THR 108 -0.059 -3.121 -17.453 953 H ASP 109 H ASP 109 3.607 -4.552 -14.735 954 HA ASP 109 HA ASP 109 3.280 -7.355 -14.029 955 HB2 ASP 109 2HB ASP 109 5.601 -5.880 -15.328 956 HB3 ASP 109 3HB ASP 109 5.536 -7.623 -15.080 957 H ASP 110 H ASP 110 5.339 -8.421 -13.159 958 HA ASP 110 HA ASP 110 5.247 -7.795 -10.378 959 HB2 ASP 110 2HB ASP 110 6.902 -9.955 -11.749 960 HB3 ASP 110 3HB ASP 110 6.356 -9.929 -10.070 961 H GLU 111 H GLU 111 7.875 -8.072 -12.766 962 HA GLU 111 HA GLU 111 10.068 -7.481 -11.146 963 HB2 GLU 111 2HB GLU 111 11.240 -6.885 -13.277 964 HB3 GLU 111 3HB GLU 111 10.360 -8.407 -13.375 965 HG2 GLU 111 2HG GLU 111 8.542 -7.293 -14.621 966 HG3 GLU 111 3HG GLU 111 9.388 -5.751 -14.493 967 H GLU 112 H GLU 112 7.839 -5.311 -12.806 968 HA GLU 112 HA GLU 112 9.285 -2.877 -12.280 969 HB2 GLU 112 2HB GLU 112 7.711 -3.197 -14.217 970 HB3 GLU 112 3HB GLU 112 6.366 -3.297 -13.095 971 HG2 GLU 112 2HG GLU 112 6.367 -1.090 -14.028 972 HG3 GLU 112 3HG GLU 112 6.889 -0.964 -12.345 973 H ALA 113 H ALA 113 6.525 -4.590 -10.784 974 HA ALA 113 HA ALA 113 5.748 -2.622 -8.930 975 HB1 ALA 113 3HB ALA 113 4.372 -4.583 -9.451 976 HB2 ALA 113 1HB ALA 113 4.655 -4.463 -7.711 977 HB3 ALA 113 2HB ALA 113 5.554 -5.639 -8.676 978 H LEU 114 H LEU 114 8.209 -5.157 -8.746 979 HA LEU 114 HA LEU 114 8.940 -5.018 -6.044 980 HB2 LEU 114 2HB LEU 114 10.631 -5.703 -8.475 981 HB3 LEU 114 3HB LEU 114 11.109 -6.027 -6.811 982 HG LEU 114 HG LEU 114 8.645 -7.231 -8.128 983 HD11 LEU 114 1HD1 LEU 114 10.662 -7.999 -9.276 984 HD12 LEU 114 2HD1 LEU 114 9.900 -9.297 -8.365 985 HD13 LEU 114 3HD1 LEU 114 11.354 -8.519 -7.735 986 HD21 LEU 114 3HD2 LEU 114 10.043 -7.918 -5.519 987 HD22 LEU 114 1HD2 LEU 114 8.670 -8.788 -6.219 988 HD23 LEU 114 2HD2 LEU 114 8.475 -7.121 -5.690 989 H LYS 115 H LYS 115 10.369 -3.331 -8.870 990 HA LYS 115 HA LYS 115 12.378 -1.970 -7.378 991 HB2 LYS 115 2HB LYS 115 12.725 -0.606 -9.457 992 HB3 LYS 115 3HB LYS 115 12.751 -2.339 -9.739 993 HG2 LYS 115 2HG LYS 115 10.534 -2.291 -10.675 994 HG3 LYS 115 3HG LYS 115 10.353 -0.582 -10.281 995 HD2 LYS 115 2HD LYS 115 12.479 -1.644 -12.182 996 HD3 LYS 115 3HD LYS 115 10.874 -1.128 -12.710 997 HE2 LYS 115 2HE LYS 115 12.985 0.600 -11.378 998 HE3 LYS 115 3HE LYS 115 12.420 0.692 -13.047 999 HZ1 LYS 115 3HZ LYS 115 10.796 1.264 -10.631 1000 HZ2 LYS 115 1HZ LYS 115 10.235 1.317 -12.223 1001 HZ3 LYS 115 2HZ LYS 115 11.418 2.403 -11.699 1002 H ILE 116 H ILE 116 9.064 -1.149 -8.271 1003 HA ILE 116 HA ILE 116 9.089 1.612 -7.616 1004 HB ILE 116 HB ILE 116 6.758 -0.360 -7.537 1005 HG12 ILE 116 2HG1 ILE 116 7.754 -0.146 -9.800 1006 HG13 ILE 116 3HG1 ILE 116 6.140 0.537 -9.758 1007 HG21 ILE 116 1HG2 ILE 116 5.282 1.629 -7.648 1008 HG22 ILE 116 2HG2 ILE 116 6.694 2.677 -7.492 1009 HG23 ILE 116 3HG2 ILE 116 6.244 1.598 -6.172 1010 HD11 ILE 116 3HD1 ILE 116 7.652 1.864 -11.096 1011 HD12 ILE 116 1HD1 ILE 116 8.734 2.065 -9.719 1012 HD13 ILE 116 2HD1 ILE 116 7.118 2.779 -9.686 1013 H VAL 117 H VAL 117 8.342 -1.304 -5.699 1014 HA VAL 117 HA VAL 117 7.695 -0.142 -3.234 1015 HB VAL 117 HB VAL 117 9.170 -2.773 -3.754 1016 HG11 VAL 117 1HG1 VAL 117 7.818 -1.842 -1.183 1017 HG12 VAL 117 2HG1 VAL 117 9.558 -2.024 -1.423 1018 HG13 VAL 117 3HG1 VAL 117 8.510 -3.445 -1.461 1019 HG21 VAL 117 3HG2 VAL 117 6.218 -2.251 -3.207 1020 HG22 VAL 117 1HG2 VAL 117 6.966 -3.833 -3.449 1021 HG23 VAL 117 2HG2 VAL 117 6.916 -2.670 -4.771 1022 H ARG 118 H ARG 118 10.848 -1.145 -4.530 1023 HA ARG 118 HA ARG 118 12.414 -0.444 -2.271 1024 HB2 ARG 118 2HB ARG 118 13.300 -0.713 -5.175 1025 HB3 ARG 118 3HB ARG 118 14.354 -0.748 -3.758 1026 HG2 ARG 118 2HG ARG 118 13.196 -2.808 -2.982 1027 HG3 ARG 118 3HG ARG 118 12.203 -2.780 -4.439 1028 HD2 ARG 118 2HD ARG 118 13.971 -4.365 -4.791 1029 HD3 ARG 118 3HD ARG 118 14.313 -2.952 -5.792 1030 HE ARG 118 HE ARG 118 16.049 -2.320 -4.298 1031 HH11 ARG 118 1HH1 ARG 118 14.694 -5.486 -3.520 1032 HH12 ARG 118 2HH1 ARG 118 16.066 -5.960 -2.566 1033 HH21 ARG 118 1HH2 ARG 118 17.818 -2.977 -3.037 1034 HH22 ARG 118 2HH2 ARG 118 17.830 -4.544 -2.294 1035 H GLU 119 H GLU 119 11.251 1.421 -5.005 1036 HA GLU 119 HA GLU 119 12.832 3.770 -4.529 1037 HB2 GLU 119 2HB GLU 119 10.292 3.303 -6.131 1038 HB3 GLU 119 3HB GLU 119 11.107 4.864 -6.062 1039 HG2 GLU 119 2HG GLU 119 13.096 3.911 -7.096 1040 HG3 GLU 119 3HG GLU 119 12.369 2.305 -7.088 1041 H PHE 120 H PHE 120 9.607 2.666 -3.459 1042 HA PHE 120 HA PHE 120 8.599 4.985 -2.312 1043 HB2 PHE 120 2HB PHE 120 8.267 2.099 -1.457 1044 HB3 PHE 120 3HB PHE 120 7.419 3.400 -0.633 1045 HD1 PHE 120 HD2 PHE 120 6.885 5.041 -3.255 1046 HD2 PHE 120 HD1 PHE 120 6.279 0.949 -2.171 1047 HE1 PHE 120 HE2 PHE 120 4.994 4.906 -4.810 1048 HE2 PHE 120 HE1 PHE 120 4.393 0.831 -3.709 1049 HZ PHE 120 HZ PHE 120 3.737 2.798 -5.039 1050 H MET 121 H MET 121 10.677 2.554 -0.688 1051 HA MET 121 HA MET 121 10.835 4.027 1.755 1052 HB2 MET 121 2HB MET 121 12.857 2.530 2.297 1053 HB3 MET 121 3HB MET 121 11.285 1.781 2.130 1054 HG2 MET 121 2HG MET 121 13.132 1.798 -0.233 1055 HG3 MET 121 3HG MET 121 13.401 0.650 1.078 1056 HE1 MET 121 3HE MET 121 11.528 -1.199 1.819 1057 HE2 MET 121 1HE MET 121 9.967 -1.342 1.010 1058 HE3 MET 121 2HE MET 121 10.321 0.075 1.998 1059 H GLN 122 H GLN 122 12.585 4.389 -1.249 1060 HA GLN 122 HA GLN 122 14.777 5.899 -0.221 1061 HB2 GLN 122 2HB GLN 122 13.485 5.906 -2.976 1062 HB3 GLN 122 3HB GLN 122 14.936 6.830 -2.585 1063 HG2 GLN 122 2HG GLN 122 16.100 4.709 -1.995 1064 HG3 GLN 122 3HG GLN 122 14.649 3.812 -2.448 1065 HE21 GLN 122 1HE2 GLN 122 17.315 5.756 -3.661 1066 HE22 GLN 122 2HE2 GLN 122 17.166 5.266 -5.311 1067 H LYS 123 H LYS 123 11.530 6.886 -1.427 1068 HA LYS 123 HA LYS 123 11.869 9.674 -0.772 1069 HB2 LYS 123 2HB LYS 123 9.341 8.076 -1.350 1070 HB3 LYS 123 3HB LYS 123 9.318 9.787 -0.954 1071 HG2 LYS 123 2HG LYS 123 9.171 9.742 -3.289 1072 HG3 LYS 123 3HG LYS 123 10.856 10.152 -2.959 1073 HD2 LYS 123 2HD LYS 123 11.541 7.839 -3.430 1074 HD3 LYS 123 3HD LYS 123 9.857 7.363 -3.669 1075 HE2 LYS 123 2HE LYS 123 9.738 8.944 -5.609 1076 HE3 LYS 123 3HE LYS 123 11.459 9.286 -5.393 1077 HZ1 LYS 123 3HZ LYS 123 10.221 6.678 -6.090 1078 HZ2 LYS 123 1HZ LYS 123 11.862 6.883 -5.725 1079 HZ3 LYS 123 2HZ LYS 123 11.198 7.646 -7.079 1080 H ALA 124 H ALA 124 10.741 6.847 0.952 1081 HA ALA 124 HA ALA 124 9.530 8.188 3.178 1082 HB1 ALA 124 3HB ALA 124 10.524 5.321 2.992 1083 HB2 ALA 124 1HB ALA 124 8.906 5.875 2.554 1084 HB3 ALA 124 2HB ALA 124 9.447 5.970 4.231 1085 H GLY 125 H GLY 125 12.796 7.606 2.267 1086 HA2 GLY 125 2HA GLY 125 14.148 7.587 4.738 1087 HA3 GLY 125 3HA GLY 125 14.780 8.220 3.222 1088 H SER 126 H SER 126 12.927 10.263 2.745 1089 HA SER 126 HA SER 126 13.803 12.441 4.279 1090 HB2 SER 126 2HB SER 126 11.325 12.161 2.514 1091 HB3 SER 126 3HB SER 126 11.958 13.694 3.123 1092 HG SER 126 HG SER 126 13.957 13.106 2.043 1093 H LEU 127 H LEU 127 11.164 10.214 4.767 1094 HA LEU 127 HA LEU 127 9.666 11.905 6.606 1095 HB2 LEU 127 2HB LEU 127 9.280 8.975 5.901 1096 HB3 LEU 127 3HB LEU 127 8.121 10.014 6.723 1097 HG LEU 127 HG LEU 127 9.041 10.338 3.838 1098 HD11 LEU 127 1HD1 LEU 127 7.670 8.356 4.098 1099 HD12 LEU 127 2HD1 LEU 127 6.795 9.608 3.222 1100 HD13 LEU 127 3HD1 LEU 127 6.418 9.295 4.918 1101 HD21 LEU 127 3HD2 LEU 127 8.459 12.501 4.828 1102 HD22 LEU 127 1HD2 LEU 127 6.904 11.860 5.371 1103 HD23 LEU 127 2HD2 LEU 127 7.249 12.015 3.647 1104 H GLU 128 H GLU 128 11.815 9.093 6.702 1105 HA GLU 128 HA GLU 128 11.760 8.393 9.410 1106 HB2 GLU 128 2HB GLU 128 12.974 7.117 7.645 1107 HB3 GLU 128 3HB GLU 128 14.145 8.423 7.506 1108 HG2 GLU 128 2HG GLU 128 14.740 8.012 9.941 1109 HG3 GLU 128 3HG GLU 128 13.718 6.576 9.875 1110 H HIS 129 H HIS 129 13.852 10.663 7.663 1111 HA HIS 129 HA HIS 129 15.040 11.820 10.033 1112 HB2 HIS 129 2HB HIS 129 16.227 11.576 7.794 1113 HB3 HIS 129 3HB HIS 129 15.174 12.832 7.152 1114 HD1 HIS 129 HD1 HIS 129 17.060 14.479 6.726 1115 HD2 HIS 129 HD2 HIS 129 16.881 13.230 10.676 1116 HE1 HIS 129 HE1 HIS 129 18.667 15.945 7.968 1117 HE2 HIS 129 HE2 HIS 129 18.372 15.310 10.382 1118 H HIS 130 H HIS 130 13.603 12.882 11.269 1119 HA HIS 130 HA HIS 130 11.119 13.870 10.535 1120 HB2 HIS 130 2HB HIS 130 12.785 14.687 12.955 1121 HB3 HIS 130 3HB HIS 130 11.044 14.910 12.785 1122 HD1 HIS 130 HD1 HIS 130 13.447 12.628 14.151 1123 HD2 HIS 130 HD2 HIS 130 9.687 12.249 12.423 1124 HE1 HIS 130 HE1 HIS 130 12.586 10.395 14.889 1125 HE2 HIS 130 HE2 HIS 130 10.230 10.280 14.002 1126 H HIS 131 H HIS 131 10.377 15.688 9.709 1127 HA HIS 131 HA HIS 131 11.934 17.192 8.054 1128 HB2 HIS 131 2HB HIS 131 9.946 18.643 7.672 1129 HB3 HIS 131 3HB HIS 131 9.592 16.925 7.615 1130 HD1 HIS 131 HD1 HIS 131 7.948 19.795 8.621 1131 HD2 HIS 131 HD2 HIS 131 8.713 16.209 10.571 1132 HE1 HIS 131 HE1 HIS 131 6.192 19.603 10.404 1133 HE2 HIS 131 HE2 HIS 131 6.729 17.467 11.626 1134 H HIS 132 H HIS 132 13.567 18.393 8.636 1135 HA HIS 132 HA HIS 132 13.685 20.230 10.843 1136 HB2 HIS 132 2HB HIS 132 15.710 19.092 10.149 1137 HB3 HIS 132 3HB HIS 132 15.515 19.600 8.482 1138 HD1 HIS 132 HD1 HIS 132 16.390 21.066 11.882 1139 HD2 HIS 132 HD2 HIS 132 16.856 21.900 7.842 1140 HE1 HIS 132 HE1 HIS 132 17.968 23.010 11.771 1141 HE2 HIS 132 HE2 HIS 132 18.175 23.548 9.317 1142 H HIS 133 H HIS 133 11.772 21.437 10.324 1143 HA HIS 133 HA HIS 133 12.179 23.658 8.422 1144 HB2 HIS 133 2HB HIS 133 9.762 21.796 8.487 1145 HB3 HIS 133 3HB HIS 133 9.653 23.424 7.834 1146 HD1 HIS 133 HD1 HIS 133 10.617 23.839 5.515 1147 HD2 HIS 133 HD2 HIS 133 11.373 19.998 6.907 1148 HE1 HIS 133 HE1 HIS 133 11.560 22.584 3.554 1149 HE2 HIS 133 HE2 HIS 133 11.779 20.215 4.371 1150 H HIS 134 H HIS 134 12.800 24.116 10.821 1151 HA HIS 134 HA HIS 134 11.027 26.094 11.781 1152 HB2 HIS 134 2HB HIS 134 10.622 25.166 14.089 1153 HB3 HIS 134 3HB HIS 134 9.768 24.297 12.832 1154 HD1 HIS 134 HD1 HIS 134 10.720 21.899 12.204 1155 HD2 HIS 134 HD2 HIS 134 12.283 23.597 15.658 1156 HE1 HIS 134 HE1 HIS 134 11.871 20.026 13.412 1157 HE2 HIS 134 HE2 HIS 134 12.614 21.036 15.597 Start of MODEL 17 1 H1 MET 1 1H MET 1 1.553 9.855 13.326 2 H2 MET 1 2H MET 1 2.104 11.421 13.032 3 H3 MET 1 3H MET 1 3.109 10.300 13.798 4 HA MET 1 HA MET 1 2.117 10.149 11.026 5 HB2 MET 1 2HB MET 1 3.811 11.881 11.247 6 HB3 MET 1 3HB MET 1 4.854 10.818 12.175 7 HG2 MET 1 2HG MET 1 5.677 11.127 9.888 8 HG3 MET 1 3HG MET 1 5.256 9.441 10.194 9 HE1 MET 1 3HE MET 1 5.719 10.133 7.293 10 HE2 MET 1 1HE MET 1 4.262 9.568 6.477 11 HE3 MET 1 2HE MET 1 4.984 8.597 7.761 12 H LYS 2 H LYS 2 2.718 8.303 9.870 13 HA LYS 2 HA LYS 2 4.178 6.109 11.035 14 HB2 LYS 2 2HB LYS 2 1.617 6.170 11.914 15 HB3 LYS 2 3HB LYS 2 1.293 5.438 10.350 16 HG2 LYS 2 2HG LYS 2 2.867 3.591 10.923 17 HG3 LYS 2 3HG LYS 2 3.136 4.330 12.500 18 HD2 LYS 2 2HD LYS 2 0.584 3.073 11.442 19 HD3 LYS 2 3HD LYS 2 1.562 2.542 12.808 20 HE2 LYS 2 2HE LYS 2 -0.154 5.046 12.665 21 HE3 LYS 2 3HE LYS 2 -0.455 3.605 13.633 22 HZ1 LYS 2 3HZ LYS 2 1.582 4.094 14.887 23 HZ2 LYS 2 1HZ LYS 2 0.448 5.347 14.998 24 HZ3 LYS 2 2HZ LYS 2 1.794 5.513 13.993 25 H ILE 3 H ILE 3 4.651 4.516 9.357 26 HA ILE 3 HA ILE 3 4.039 5.452 6.602 27 HB ILE 3 HB ILE 3 6.506 3.979 7.649 28 HG12 ILE 3 2HG1 ILE 3 6.178 6.782 6.474 29 HG13 ILE 3 3HG1 ILE 3 6.456 6.410 8.169 30 HG21 ILE 3 1HG2 ILE 3 7.409 4.102 5.349 31 HG22 ILE 3 2HG2 ILE 3 5.885 4.783 4.787 32 HG23 ILE 3 3HG2 ILE 3 5.935 3.133 5.403 33 HD11 ILE 3 3HD1 ILE 3 8.387 5.955 5.899 34 HD12 ILE 3 1HD1 ILE 3 8.666 5.512 7.588 35 HD13 ILE 3 2HD1 ILE 3 8.467 7.204 7.140 36 H LEU 4 H LEU 4 2.308 4.267 6.018 37 HA LEU 4 HA LEU 4 2.437 1.307 6.187 38 HB2 LEU 4 2HB LEU 4 0.098 3.230 5.929 39 HB3 LEU 4 3HB LEU 4 -0.062 1.568 5.392 40 HG LEU 4 HG LEU 4 0.460 0.786 7.719 41 HD11 LEU 4 1HD1 LEU 4 0.301 3.706 8.487 42 HD12 LEU 4 2HD1 LEU 4 1.738 2.683 8.546 43 HD13 LEU 4 3HD1 LEU 4 0.373 2.339 9.603 44 HD21 LEU 4 3HD2 LEU 4 -1.852 0.944 6.974 45 HD22 LEU 4 1HD2 LEU 4 -1.928 2.638 7.471 46 HD23 LEU 4 2HD2 LEU 4 -1.733 1.367 8.681 47 H ILE 5 H ILE 5 2.836 0.236 4.337 48 HA ILE 5 HA ILE 5 2.386 1.573 1.740 49 HB ILE 5 HB ILE 5 4.210 -0.812 2.340 50 HG12 ILE 5 2HG1 ILE 5 4.834 2.115 1.765 51 HG13 ILE 5 3HG1 ILE 5 5.253 1.196 3.203 52 HG21 ILE 5 1HG2 ILE 5 4.936 -0.655 -0.012 53 HG22 ILE 5 2HG2 ILE 5 3.795 0.660 -0.293 54 HG23 ILE 5 3HG2 ILE 5 3.199 -0.959 0.079 55 HD11 ILE 5 3HD1 ILE 5 7.202 1.576 1.863 56 HD12 ILE 5 1HD1 ILE 5 6.439 0.852 0.447 57 HD13 ILE 5 2HD1 ILE 5 6.823 -0.143 1.855 58 H LEU 6 H LEU 6 0.521 1.000 0.883 59 HA LEU 6 HA LEU 6 -0.825 -1.513 1.533 60 HB2 LEU 6 2HB LEU 6 -1.723 0.804 -0.239 61 HB3 LEU 6 3HB LEU 6 -2.720 -0.559 0.251 62 HG LEU 6 HG LEU 6 -1.632 1.629 2.032 63 HD11 LEU 6 1HD1 LEU 6 -3.975 2.233 2.401 64 HD12 LEU 6 2HD1 LEU 6 -4.489 0.970 1.279 65 HD13 LEU 6 3HD1 LEU 6 -3.543 2.341 0.695 66 HD21 LEU 6 3HD2 LEU 6 -2.843 0.578 3.883 67 HD22 LEU 6 1HD2 LEU 6 -1.550 -0.447 3.268 68 HD23 LEU 6 2HD2 LEU 6 -3.229 -0.802 2.850 69 H ILE 7 H ILE 7 -0.939 -3.190 0.172 70 HA ILE 7 HA ILE 7 0.022 -2.925 -2.619 71 HB ILE 7 HB ILE 7 0.487 -5.285 -0.726 72 HG12 ILE 7 2HG1 ILE 7 2.034 -3.424 -0.273 73 HG13 ILE 7 3HG1 ILE 7 2.906 -4.767 -0.999 74 HG21 ILE 7 1HG2 ILE 7 0.059 -6.131 -2.984 75 HG22 ILE 7 2HG2 ILE 7 1.765 -6.331 -2.582 76 HG23 ILE 7 3HG2 ILE 7 1.260 -5.026 -3.658 77 HD11 ILE 7 3HD1 ILE 7 2.907 -3.585 -3.154 78 HD12 ILE 7 1HD1 ILE 7 3.667 -2.645 -1.870 79 HD13 ILE 7 2HD1 ILE 7 2.039 -2.242 -2.406 80 H ASN 8 H ASN 8 -1.710 -3.127 -3.875 81 HA ASN 8 HA ASN 8 -3.334 -5.570 -3.542 82 HB2 ASN 8 2HB ASN 8 -4.831 -3.676 -3.100 83 HB3 ASN 8 3HB ASN 8 -4.328 -2.878 -4.583 84 HD21 ASN 8 1HD2 ASN 8 -5.097 -6.314 -4.061 85 HD22 ASN 8 2HD2 ASN 8 -6.423 -6.351 -5.159 86 H THR 9 H THR 9 -2.196 -6.794 -4.895 87 HA THR 9 HA THR 9 -2.343 -6.120 -7.762 88 HB THR 9 HB THR 9 0.012 -6.072 -7.360 89 HG1 THR 9 HG1 THR 9 -0.182 -7.300 -9.149 90 HG21 THR 9 3HG2 THR 9 0.097 -7.069 -5.123 91 HG22 THR 9 1HG2 THR 9 1.276 -7.830 -6.202 92 HG23 THR 9 2HG2 THR 9 -0.231 -8.660 -5.815 93 H ASN 10 H ASN 10 -3.160 -7.748 -9.059 94 HA ASN 10 HA ASN 10 -4.923 -9.600 -7.750 95 HB2 ASN 10 2HB ASN 10 -5.582 -8.551 -9.857 96 HB3 ASN 10 3HB ASN 10 -4.207 -9.267 -10.685 97 HD21 ASN 10 1HD2 ASN 10 -4.295 -11.423 -11.297 98 HD22 ASN 10 2HD2 ASN 10 -5.758 -12.344 -11.278 99 H ASN 11 H ASN 11 -1.896 -9.887 -9.552 100 HA ASN 11 HA ASN 11 -1.698 -12.743 -9.165 101 HB2 ASN 11 2HB ASN 11 0.664 -12.432 -10.070 102 HB3 ASN 11 3HB ASN 11 -0.635 -11.977 -11.155 103 HD21 ASN 11 1HD2 ASN 11 2.322 -11.072 -10.092 104 HD22 ASN 11 2HD2 ASN 11 2.247 -9.383 -10.443 105 H ASP 12 H ASP 12 -1.744 -13.271 -7.116 106 HA ASP 12 HA ASP 12 -0.835 -11.757 -4.907 107 HB2 ASP 12 2HB ASP 12 -2.744 -13.228 -4.721 108 HB3 ASP 12 3HB ASP 12 -1.797 -14.625 -5.201 109 H GLU 13 H GLU 13 0.781 -14.105 -6.868 110 HA GLU 13 HA GLU 13 2.821 -14.941 -5.074 111 HB2 GLU 13 2HB GLU 13 2.861 -14.824 -8.115 112 HB3 GLU 13 3HB GLU 13 4.002 -15.716 -7.111 113 HG2 GLU 13 2HG GLU 13 2.121 -17.122 -6.273 114 HG3 GLU 13 3HG GLU 13 1.029 -16.256 -7.358 115 H LEU 14 H LEU 14 2.483 -12.131 -7.195 116 HA LEU 14 HA LEU 14 5.119 -11.129 -7.107 117 HB2 LEU 14 2HB LEU 14 3.545 -10.209 -8.682 118 HB3 LEU 14 3HB LEU 14 2.445 -9.732 -7.404 119 HG LEU 14 HG LEU 14 3.978 -7.948 -6.685 120 HD11 LEU 14 1HD1 LEU 14 6.010 -7.379 -7.967 121 HD12 LEU 14 2HD1 LEU 14 5.847 -8.883 -8.874 122 HD13 LEU 14 3HD1 LEU 14 6.138 -8.926 -7.136 123 HD21 LEU 14 3HD2 LEU 14 2.334 -7.415 -8.409 124 HD22 LEU 14 1HD2 LEU 14 3.485 -7.859 -9.673 125 HD23 LEU 14 2HD2 LEU 14 3.805 -6.472 -8.628 126 H ILE 15 H ILE 15 2.447 -10.902 -4.817 127 HA ILE 15 HA ILE 15 3.361 -8.851 -3.135 128 HB ILE 15 HB ILE 15 1.706 -11.300 -2.359 129 HG12 ILE 15 2HG1 ILE 15 0.799 -8.524 -3.239 130 HG13 ILE 15 3HG1 ILE 15 0.776 -9.954 -4.256 131 HG21 ILE 15 1HG2 ILE 15 1.908 -8.618 -0.932 132 HG22 ILE 15 2HG2 ILE 15 2.665 -10.116 -0.386 133 HG23 ILE 15 3HG2 ILE 15 0.913 -9.993 -0.453 134 HD11 ILE 15 3HD1 ILE 15 -0.870 -10.963 -2.716 135 HD12 ILE 15 1HD1 ILE 15 -1.421 -9.477 -3.487 136 HD13 ILE 15 2HD1 ILE 15 -0.890 -9.452 -1.810 137 H LYS 16 H LYS 16 4.192 -12.296 -3.269 138 HA LYS 16 HA LYS 16 5.485 -12.500 -0.749 139 HB2 LYS 16 2HB LYS 16 6.359 -14.181 -3.126 140 HB3 LYS 16 3HB LYS 16 6.293 -14.635 -1.428 141 HG2 LYS 16 2HG LYS 16 4.001 -14.345 -3.371 142 HG3 LYS 16 3HG LYS 16 4.572 -15.823 -2.600 143 HD2 LYS 16 2HD LYS 16 3.731 -15.020 -0.417 144 HD3 LYS 16 3HD LYS 16 3.245 -13.488 -1.156 145 HE2 LYS 16 2HE LYS 16 1.748 -14.857 -2.708 146 HE3 LYS 16 3HE LYS 16 2.082 -16.244 -1.668 147 HZ1 LYS 16 3HZ LYS 16 1.078 -15.118 0.166 148 HZ2 LYS 16 1HZ LYS 16 0.002 -15.060 -1.136 149 HZ3 LYS 16 2HZ LYS 16 0.901 -13.690 -0.719 150 H LYS 17 H LYS 17 6.571 -11.469 -3.932 151 HA LYS 17 HA LYS 17 9.381 -11.301 -3.353 152 HB2 LYS 17 2HB LYS 17 7.840 -9.899 -5.576 153 HB3 LYS 17 3HB LYS 17 9.570 -10.226 -5.534 154 HG2 LYS 17 2HG LYS 17 9.051 -12.683 -5.630 155 HG3 LYS 17 3HG LYS 17 7.342 -12.273 -5.799 156 HD2 LYS 17 2HD LYS 17 8.236 -12.720 -8.019 157 HD3 LYS 17 3HD LYS 17 7.909 -10.990 -7.895 158 HE2 LYS 17 2HE LYS 17 10.306 -10.576 -7.466 159 HE3 LYS 17 3HE LYS 17 10.628 -12.304 -7.576 160 HZ1 LYS 17 3HZ LYS 17 11.174 -11.126 -9.618 161 HZ2 LYS 17 1HZ LYS 17 9.568 -10.622 -9.783 162 HZ3 LYS 17 2HZ LYS 17 9.957 -12.261 -9.877 163 H ILE 18 H ILE 18 6.679 -8.984 -3.520 164 HA ILE 18 HA ILE 18 8.051 -6.574 -3.001 165 HB ILE 18 HB ILE 18 5.142 -7.349 -2.474 166 HG12 ILE 18 2HG1 ILE 18 6.373 -5.724 -4.753 167 HG13 ILE 18 3HG1 ILE 18 5.813 -7.387 -4.874 168 HG21 ILE 18 1HG2 ILE 18 5.704 -5.476 -1.001 169 HG22 ILE 18 2HG2 ILE 18 4.635 -4.931 -2.292 170 HG23 ILE 18 3HG2 ILE 18 6.359 -4.569 -2.366 171 HD11 ILE 18 3HD1 ILE 18 4.211 -5.884 -5.853 172 HD12 ILE 18 1HD1 ILE 18 4.094 -4.960 -4.354 173 HD13 ILE 18 2HD1 ILE 18 3.520 -6.629 -4.412 174 H LYS 19 H LYS 19 6.591 -9.002 -0.889 175 HA LYS 19 HA LYS 19 6.831 -7.786 1.617 176 HB2 LYS 19 2HB LYS 19 6.903 -10.703 0.769 177 HB3 LYS 19 3HB LYS 19 7.054 -10.239 2.460 178 HG2 LYS 19 2HG LYS 19 4.830 -9.208 2.401 179 HG3 LYS 19 3HG LYS 19 4.683 -9.596 0.687 180 HD2 LYS 19 2HD LYS 19 3.426 -11.242 1.902 181 HD3 LYS 19 3HD LYS 19 4.870 -12.037 1.281 182 HE2 LYS 19 2HE LYS 19 4.533 -11.037 4.132 183 HE3 LYS 19 3HE LYS 19 4.270 -12.695 3.612 184 HZ1 LYS 19 3HZ LYS 19 6.867 -11.238 3.573 185 HZ2 LYS 19 1HZ LYS 19 6.627 -12.798 2.973 186 HZ3 LYS 19 2HZ LYS 19 6.420 -12.487 4.612 187 H LYS 20 H LYS 20 9.106 -9.898 -0.165 188 HA LYS 20 HA LYS 20 11.128 -9.884 1.808 189 HB2 LYS 20 2HB LYS 20 11.285 -10.482 -1.177 190 HB3 LYS 20 3HB LYS 20 12.619 -10.747 -0.056 191 HG2 LYS 20 2HG LYS 20 9.907 -12.109 0.003 192 HG3 LYS 20 3HG LYS 20 11.449 -12.849 -0.441 193 HD2 LYS 20 2HD LYS 20 12.274 -12.616 1.852 194 HD3 LYS 20 3HD LYS 20 10.838 -11.701 2.316 195 HE2 LYS 20 2HE LYS 20 9.476 -13.773 1.753 196 HE3 LYS 20 3HE LYS 20 11.008 -14.645 1.616 197 HZ1 LYS 20 3HZ LYS 20 10.015 -14.859 3.821 198 HZ2 LYS 20 1HZ LYS 20 10.069 -13.179 4.026 199 HZ3 LYS 20 2HZ LYS 20 11.505 -14.067 3.903 200 H GLU 21 H GLU 21 10.497 -7.706 -0.898 201 HA GLU 21 HA GLU 21 12.886 -6.193 -0.767 202 HB2 GLU 21 2HB GLU 21 10.116 -5.376 -1.725 203 HB3 GLU 21 3HB GLU 21 11.567 -4.412 -1.969 204 HG2 GLU 21 2HG GLU 21 10.974 -7.143 -3.124 205 HG3 GLU 21 3HG GLU 21 11.052 -5.616 -3.997 206 H VAL 22 H VAL 22 9.726 -5.747 0.882 207 HA VAL 22 HA VAL 22 10.581 -3.347 2.246 208 HB VAL 22 HB VAL 22 8.488 -3.311 3.413 209 HG11 VAL 22 1HG1 VAL 22 6.851 -3.359 1.585 210 HG12 VAL 22 2HG1 VAL 22 7.974 -4.293 0.593 211 HG13 VAL 22 3HG1 VAL 22 8.378 -2.642 1.067 212 HG21 VAL 22 3HG2 VAL 22 6.809 -5.116 3.361 213 HG22 VAL 22 1HG2 VAL 22 8.306 -5.645 4.132 214 HG23 VAL 22 2HG2 VAL 22 7.939 -6.147 2.482 215 H GLU 23 H GLU 23 10.664 -6.782 2.921 216 HA GLU 23 HA GLU 23 11.194 -6.699 5.722 217 HB2 GLU 23 2HB GLU 23 11.682 -8.824 3.589 218 HB3 GLU 23 3HB GLU 23 12.196 -9.071 5.255 219 HG2 GLU 23 2HG GLU 23 9.891 -8.933 6.030 220 HG3 GLU 23 3HG GLU 23 9.332 -8.527 4.413 221 H ASN 24 H ASN 24 13.224 -6.511 2.833 222 HA ASN 24 HA ASN 24 15.784 -6.446 4.016 223 HB2 ASN 24 2HB ASN 24 14.808 -4.947 1.533 224 HB3 ASN 24 3HB ASN 24 16.497 -5.160 1.978 225 HD21 ASN 24 1HD2 ASN 24 15.030 -5.996 -0.423 226 HD22 ASN 24 2HD2 ASN 24 15.296 -7.694 -0.552 227 H GLN 25 H GLN 25 13.301 -3.973 3.681 228 HA GLN 25 HA GLN 25 14.996 -1.816 4.719 229 HB2 GLN 25 2HB GLN 25 12.040 -1.694 3.981 230 HB3 GLN 25 3HB GLN 25 13.147 -0.341 4.177 231 HG2 GLN 25 2HG GLN 25 13.210 -2.410 1.963 232 HG3 GLN 25 3HG GLN 25 12.673 -0.741 1.820 233 HE21 GLN 25 1HE2 GLN 25 15.410 -2.860 1.969 234 HE22 GLN 25 2HE2 GLN 25 16.618 -1.682 1.604 235 H GLY 26 H GLY 26 12.947 -4.227 5.964 236 HA2 GLY 26 2HA GLY 26 12.763 -4.796 8.202 237 HA3 GLY 26 3HA GLY 26 13.308 -3.197 8.663 238 H TYR 27 H TYR 27 10.618 -3.699 6.464 239 HA TYR 27 HA TYR 27 8.689 -2.516 8.285 240 HB2 TYR 27 2HB TYR 27 8.450 -3.640 5.457 241 HB3 TYR 27 3HB TYR 27 7.054 -3.071 6.359 242 HD1 TYR 27 HD1 TYR 27 10.510 -1.688 5.694 243 HD2 TYR 27 HD2 TYR 27 6.288 -1.036 5.549 244 HE1 TYR 27 HE1 TYR 27 10.891 0.580 4.809 245 HE2 TYR 27 HE2 TYR 27 6.665 1.223 4.674 246 HH TYR 27 HH TYR 27 9.576 2.257 3.404 247 H GLN 28 H GLN 28 7.006 -3.599 9.299 248 HA GLN 28 HA GLN 28 6.941 -6.498 9.422 249 HB2 GLN 28 2HB GLN 28 5.069 -4.361 10.544 250 HB3 GLN 28 3HB GLN 28 4.751 -6.081 10.713 251 HG2 GLN 28 2HG GLN 28 5.693 -5.358 12.759 252 HG3 GLN 28 3HG GLN 28 6.938 -6.290 11.939 253 HE21 GLN 28 1HE2 GLN 28 6.145 -2.951 11.094 254 HE22 GLN 28 2HE2 GLN 28 7.616 -2.275 11.678 255 H VAL 29 H VAL 29 5.005 -7.732 8.749 256 HA VAL 29 HA VAL 29 3.472 -6.512 6.523 257 HB VAL 29 HB VAL 29 4.588 -9.358 6.383 258 HG11 VAL 29 1HG1 VAL 29 3.811 -9.253 4.023 259 HG12 VAL 29 2HG1 VAL 29 3.134 -7.655 4.332 260 HG13 VAL 29 3HG1 VAL 29 2.488 -9.064 5.176 261 HG21 VAL 29 3HG2 VAL 29 6.152 -8.579 4.627 262 HG22 VAL 29 1HG2 VAL 29 6.484 -7.796 6.177 263 HG23 VAL 29 2HG2 VAL 29 5.639 -6.912 4.906 264 H ARG 30 H ARG 30 1.379 -6.603 7.095 265 HA ARG 30 HA ARG 30 0.268 -9.191 7.982 266 HB2 ARG 30 2HB ARG 30 0.263 -7.438 9.886 267 HB3 ARG 30 3HB ARG 30 -0.902 -6.523 8.923 268 HG2 ARG 30 2HG ARG 30 -2.367 -8.568 8.888 269 HG3 ARG 30 3HG ARG 30 -1.231 -9.342 9.984 270 HD2 ARG 30 2HD ARG 30 -1.742 -7.612 11.692 271 HD3 ARG 30 3HD ARG 30 -2.921 -6.893 10.581 272 HE ARG 30 HE ARG 30 -3.248 -9.269 12.167 273 HH11 ARG 30 1HH1 ARG 30 -4.330 -7.745 9.177 274 HH12 ARG 30 2HH1 ARG 30 -5.790 -8.669 9.105 275 HH21 ARG 30 1HH2 ARG 30 -5.136 -10.520 11.991 276 HH22 ARG 30 2HH2 ARG 30 -6.245 -10.232 10.692 277 H ASP 31 H ASP 31 -2.043 -9.452 7.288 278 HA ASP 31 HA ASP 31 -2.680 -7.919 4.837 279 HB2 ASP 31 2HB ASP 31 -3.345 -9.994 3.729 280 HB3 ASP 31 3HB ASP 31 -1.670 -10.091 4.240 281 H VAL 32 H VAL 32 -4.727 -7.307 4.597 282 HA VAL 32 HA VAL 32 -6.798 -8.049 6.563 283 HB VAL 32 HB VAL 32 -6.758 -5.803 4.484 284 HG11 VAL 32 1HG1 VAL 32 -8.776 -6.336 6.693 285 HG12 VAL 32 2HG1 VAL 32 -9.049 -6.521 4.958 286 HG13 VAL 32 3HG1 VAL 32 -8.751 -4.921 5.637 287 HG21 VAL 32 3HG2 VAL 32 -6.348 -5.620 7.487 288 HG22 VAL 32 1HG2 VAL 32 -6.472 -4.251 6.378 289 HG23 VAL 32 2HG2 VAL 32 -5.116 -5.374 6.247 290 H ASN 33 H ASN 33 -8.058 -9.722 5.896 291 HA ASN 33 HA ASN 33 -8.476 -10.292 3.053 292 HB2 ASN 33 2HB ASN 33 -9.446 -11.825 5.504 293 HB3 ASN 33 3HB ASN 33 -9.627 -12.356 3.835 294 HD21 ASN 33 1HD2 ASN 33 -7.391 -11.885 6.471 295 HD22 ASN 33 2HD2 ASN 33 -6.079 -12.769 5.789 296 H ASP 34 H ASP 34 -10.242 -8.938 5.775 297 HA ASP 34 HA ASP 34 -12.577 -8.377 4.065 298 HB2 ASP 34 2HB ASP 34 -13.038 -10.567 5.181 299 HB3 ASP 34 3HB ASP 34 -12.809 -9.815 6.751 300 H SER 35 H SER 35 -14.078 -6.847 5.033 301 HA SER 35 HA SER 35 -12.915 -4.494 5.910 302 HB2 SER 35 2HB SER 35 -15.067 -4.637 4.700 303 HB3 SER 35 3HB SER 35 -15.837 -5.327 6.128 304 HG SER 35 HG SER 35 -15.361 -3.378 7.228 305 H ASP 36 H ASP 36 -14.284 -7.127 7.813 306 HA ASP 36 HA ASP 36 -14.572 -5.911 10.304 307 HB2 ASP 36 2HB ASP 36 -15.441 -8.157 10.000 308 HB3 ASP 36 3HB ASP 36 -13.848 -8.790 9.599 309 H GLU 37 H GLU 37 -11.783 -7.710 8.992 310 HA GLU 37 HA GLU 37 -10.022 -7.288 11.148 311 HB2 GLU 37 2HB GLU 37 -9.306 -7.774 8.225 312 HB3 GLU 37 3HB GLU 37 -8.223 -7.971 9.604 313 HG2 GLU 37 2HG GLU 37 -9.850 -9.716 10.488 314 HG3 GLU 37 3HG GLU 37 -10.665 -9.623 8.923 315 H LEU 38 H LEU 38 -10.575 -5.511 8.153 316 HA LEU 38 HA LEU 38 -8.585 -3.636 8.086 317 HB2 LEU 38 2HB LEU 38 -10.277 -3.863 6.327 318 HB3 LEU 38 3HB LEU 38 -11.534 -3.312 7.419 319 HG LEU 38 HG LEU 38 -10.404 -1.050 7.493 320 HD11 LEU 38 1HD1 LEU 38 -8.757 -0.484 5.776 321 HD12 LEU 38 2HD1 LEU 38 -8.679 -2.177 5.281 322 HD13 LEU 38 3HD1 LEU 38 -8.149 -1.700 6.896 323 HD21 LEU 38 3HD2 LEU 38 -11.207 -0.307 5.298 324 HD22 LEU 38 1HD2 LEU 38 -12.341 -1.433 6.046 325 HD23 LEU 38 2HD2 LEU 38 -11.282 -1.982 4.744 326 H LYS 39 H LYS 39 -11.798 -3.105 9.620 327 HA LYS 39 HA LYS 39 -10.968 -0.624 10.761 328 HB2 LYS 39 2HB LYS 39 -13.220 -0.680 11.917 329 HB3 LYS 39 3HB LYS 39 -13.241 -0.763 10.167 330 HG2 LYS 39 2HG LYS 39 -14.856 -2.315 10.694 331 HG3 LYS 39 3HG LYS 39 -13.440 -3.345 10.531 332 HD2 LYS 39 2HD LYS 39 -13.194 -3.433 12.984 333 HD3 LYS 39 3HD LYS 39 -14.567 -2.336 13.177 334 HE2 LYS 39 2HE LYS 39 -16.057 -4.003 12.155 335 HE3 LYS 39 3HE LYS 39 -14.687 -5.081 11.896 336 HZ1 LYS 39 3HZ LYS 39 -14.401 -5.223 14.289 337 HZ2 LYS 39 1HZ LYS 39 -15.937 -5.737 13.821 338 HZ3 LYS 39 2HZ LYS 39 -15.736 -4.216 14.532 339 H LYS 40 H LYS 40 -11.065 -3.928 12.007 340 HA LYS 40 HA LYS 40 -10.876 -3.406 14.766 341 HB2 LYS 40 2HB LYS 40 -9.877 -5.726 13.080 342 HB3 LYS 40 3HB LYS 40 -9.654 -5.704 14.821 343 HG2 LYS 40 2HG LYS 40 -12.425 -5.415 13.649 344 HG3 LYS 40 3HG LYS 40 -11.667 -6.998 13.773 345 HD2 LYS 40 2HD LYS 40 -12.966 -6.817 15.731 346 HD3 LYS 40 3HD LYS 40 -11.323 -6.489 16.267 347 HE2 LYS 40 2HE LYS 40 -11.811 -4.084 16.333 348 HE3 LYS 40 3HE LYS 40 -13.433 -4.381 15.699 349 HZ1 LYS 40 3HZ LYS 40 -13.483 -4.104 18.094 350 HZ2 LYS 40 1HZ LYS 40 -12.379 -5.369 18.304 351 HZ3 LYS 40 2HZ LYS 40 -13.924 -5.685 17.688 352 H GLU 41 H GLU 41 -8.263 -3.902 12.357 353 HA GLU 41 HA GLU 41 -6.204 -3.330 14.311 354 HB2 GLU 41 2HB GLU 41 -4.595 -3.765 12.535 355 HB3 GLU 41 3HB GLU 41 -5.804 -5.037 12.608 356 HG2 GLU 41 2HG GLU 41 -6.963 -3.710 10.664 357 HG3 GLU 41 3HG GLU 41 -5.389 -2.939 10.483 358 H MET 42 H MET 42 -7.937 -1.510 11.835 359 HA MET 42 HA MET 42 -6.127 0.688 11.660 360 HB2 MET 42 2HB MET 42 -9.054 0.384 10.932 361 HB3 MET 42 3HB MET 42 -8.321 1.985 10.927 362 HG2 MET 42 2HG MET 42 -7.398 -0.382 9.279 363 HG3 MET 42 3HG MET 42 -8.301 1.015 8.688 364 HE1 MET 42 3HE MET 42 -5.624 3.903 9.125 365 HE2 MET 42 1HE MET 42 -6.838 3.431 10.314 366 HE3 MET 42 2HE MET 42 -7.263 3.516 8.603 367 H LYS 43 H LYS 43 -8.702 -0.092 13.937 368 HA LYS 43 HA LYS 43 -8.708 2.375 15.359 369 HB2 LYS 43 2HB LYS 43 -9.737 -0.390 15.889 370 HB3 LYS 43 3HB LYS 43 -9.406 0.571 17.321 371 HG2 LYS 43 2HG LYS 43 -11.746 0.771 16.729 372 HG3 LYS 43 3HG LYS 43 -10.945 2.327 16.494 373 HD2 LYS 43 2HD LYS 43 -10.845 1.921 14.065 374 HD3 LYS 43 3HD LYS 43 -11.598 0.340 14.289 375 HE2 LYS 43 2HE LYS 43 -13.264 1.920 13.521 376 HE3 LYS 43 3HE LYS 43 -13.627 1.480 15.190 377 HZ1 LYS 43 3HZ LYS 43 -13.856 3.853 14.831 378 HZ2 LYS 43 1HZ LYS 43 -12.256 3.966 14.302 379 HZ3 LYS 43 2HZ LYS 43 -12.592 3.557 15.907 380 H LYS 44 H LYS 44 -6.776 -0.601 15.626 381 HA LYS 44 HA LYS 44 -5.370 0.060 18.017 382 HB2 LYS 44 2HB LYS 44 -4.367 -1.780 15.801 383 HB3 LYS 44 3HB LYS 44 -3.926 -1.830 17.504 384 HG2 LYS 44 2HG LYS 44 -6.632 -2.507 16.331 385 HG3 LYS 44 3HG LYS 44 -5.435 -3.669 16.881 386 HD2 LYS 44 2HD LYS 44 -6.700 -1.630 18.748 387 HD3 LYS 44 3HD LYS 44 -7.436 -3.196 18.423 388 HE2 LYS 44 2HE LYS 44 -6.203 -3.385 20.473 389 HE3 LYS 44 3HE LYS 44 -5.325 -4.290 19.245 390 HZ1 LYS 44 3HZ LYS 44 -3.863 -2.965 20.648 391 HZ2 LYS 44 1HZ LYS 44 -4.648 -1.548 20.171 392 HZ3 LYS 44 2HZ LYS 44 -3.777 -2.457 19.042 393 H LEU 45 H LEU 45 -4.731 0.570 14.584 394 HA LEU 45 HA LEU 45 -2.077 1.584 14.749 395 HB2 LEU 45 2HB LEU 45 -4.205 2.014 12.604 396 HB3 LEU 45 3HB LEU 45 -2.506 2.420 12.418 397 HG LEU 45 HG LEU 45 -3.613 -0.391 12.768 398 HD11 LEU 45 1HD1 LEU 45 -4.186 0.534 10.581 399 HD12 LEU 45 2HD1 LEU 45 -3.010 -0.767 10.436 400 HD13 LEU 45 3HD1 LEU 45 -2.488 0.914 10.277 401 HD21 LEU 45 3HD2 LEU 45 -0.769 0.493 12.242 402 HD22 LEU 45 1HD2 LEU 45 -1.353 -1.173 12.276 403 HD23 LEU 45 2HD2 LEU 45 -1.392 -0.201 13.743 404 H ALA 46 H ALA 46 -5.284 3.100 14.630 405 HA ALA 46 HA ALA 46 -4.492 5.803 14.518 406 HB1 ALA 46 3HB ALA 46 -7.070 4.610 15.598 407 HB2 ALA 46 1HB ALA 46 -6.749 5.050 13.920 408 HB3 ALA 46 2HB ALA 46 -6.821 6.305 15.159 409 H GLU 47 H GLU 47 -5.353 3.719 17.276 410 HA GLU 47 HA GLU 47 -5.152 5.748 19.267 411 HB2 GLU 47 2HB GLU 47 -5.215 2.716 19.492 412 HB3 GLU 47 3HB GLU 47 -5.277 3.801 20.876 413 HG2 GLU 47 2HG GLU 47 -7.322 3.671 18.643 414 HG3 GLU 47 3HG GLU 47 -7.508 2.968 20.246 415 H GLU 48 H GLU 48 -3.039 2.843 18.820 416 HA GLU 48 HA GLU 48 -0.680 4.288 19.774 417 HB2 GLU 48 2HB GLU 48 -1.901 3.718 21.867 418 HB3 GLU 48 3HB GLU 48 -1.943 2.029 21.395 419 HG2 GLU 48 2HG GLU 48 -0.208 2.070 22.949 420 HG3 GLU 48 3HG GLU 48 0.661 2.179 21.423 421 H LYS 49 H LYS 49 0.659 3.612 18.145 422 HA LYS 49 HA LYS 49 1.764 0.990 18.425 423 HB2 LYS 49 2HB LYS 49 -0.157 0.563 16.806 424 HB3 LYS 49 3HB LYS 49 0.663 1.596 15.641 425 HG2 LYS 49 2HG LYS 49 2.403 0.059 15.294 426 HG3 LYS 49 3HG LYS 49 2.142 -0.743 16.843 427 HD2 LYS 49 2HD LYS 49 0.049 -1.743 15.962 428 HD3 LYS 49 3HD LYS 49 0.338 -0.958 14.406 429 HE2 LYS 49 2HE LYS 49 1.032 -3.366 14.457 430 HE3 LYS 49 3HE LYS 49 2.353 -2.268 14.054 431 HZ1 LYS 49 3HZ LYS 49 1.855 -3.439 16.743 432 HZ2 LYS 49 1HZ LYS 49 3.142 -2.426 16.333 433 HZ3 LYS 49 2HZ LYS 49 3.032 -3.966 15.651 434 H ASN 50 H ASN 50 2.080 4.180 17.928 435 HA ASN 50 HA ASN 50 3.842 5.579 17.734 436 HB2 ASN 50 2HB ASN 50 4.945 3.536 18.981 437 HB3 ASN 50 3HB ASN 50 5.719 3.197 17.445 438 HD21 ASN 50 1HD2 ASN 50 6.900 3.876 20.025 439 HD22 ASN 50 2HD2 ASN 50 7.867 5.285 19.758 440 H PHE 51 H PHE 51 5.603 6.325 16.104 441 HA PHE 51 HA PHE 51 5.006 6.053 13.388 442 HB2 PHE 51 2HB PHE 51 6.441 7.847 14.252 443 HB3 PHE 51 3HB PHE 51 7.660 6.688 14.758 444 HD1 PHE 51 HD2 PHE 51 6.113 8.352 11.813 445 HD2 PHE 51 HD1 PHE 51 9.301 5.842 13.178 446 HE1 PHE 51 HE2 PHE 51 7.266 8.616 9.653 447 HE2 PHE 51 HE1 PHE 51 10.444 6.113 11.018 448 HZ PHE 51 HZ PHE 51 9.425 7.499 9.255 449 H GLU 52 H GLU 52 4.860 4.092 12.397 450 HA GLU 52 HA GLU 52 7.030 2.137 12.701 451 HB2 GLU 52 2HB GLU 52 5.206 1.569 14.333 452 HB3 GLU 52 3HB GLU 52 4.082 1.394 12.988 453 HG2 GLU 52 2HG GLU 52 4.898 -0.788 13.771 454 HG3 GLU 52 3HG GLU 52 5.396 -0.485 12.108 455 H LYS 53 H LYS 53 7.341 0.804 11.015 456 HA LYS 53 HA LYS 53 6.258 1.605 8.401 457 HB2 LYS 53 2HB LYS 53 8.624 -0.193 9.073 458 HB3 LYS 53 3HB LYS 53 8.273 0.563 7.523 459 HG2 LYS 53 2HG LYS 53 8.925 2.710 8.273 460 HG3 LYS 53 3HG LYS 53 8.824 2.249 9.974 461 HD2 LYS 53 2HD LYS 53 10.912 1.331 7.965 462 HD3 LYS 53 3HD LYS 53 11.162 2.433 9.322 463 HE2 LYS 53 2HE LYS 53 10.467 -0.526 9.511 464 HE3 LYS 53 3HE LYS 53 12.021 0.211 9.878 465 HZ1 LYS 53 3HZ LYS 53 10.975 1.411 11.702 466 HZ2 LYS 53 1HZ LYS 53 10.804 -0.261 11.886 467 HZ3 LYS 53 2HZ LYS 53 9.493 0.671 11.369 468 H ILE 54 H ILE 54 4.459 0.405 7.945 469 HA ILE 54 HA ILE 54 4.442 -2.521 8.459 470 HB ILE 54 HB ILE 54 2.023 -0.644 8.607 471 HG12 ILE 54 2HG1 ILE 54 3.480 -2.006 10.921 472 HG13 ILE 54 3HG1 ILE 54 3.638 -0.306 10.509 473 HG21 ILE 54 1HG2 ILE 54 2.242 -3.601 9.298 474 HG22 ILE 54 2HG2 ILE 54 1.422 -2.927 7.887 475 HG23 ILE 54 3HG2 ILE 54 0.802 -2.598 9.507 476 HD11 ILE 54 3HD1 ILE 54 2.157 -0.605 12.379 477 HD12 ILE 54 1HD1 ILE 54 1.114 -1.670 11.435 478 HD13 ILE 54 2HD1 ILE 54 1.271 0.034 10.997 479 H LEU 55 H LEU 55 3.629 -3.785 6.815 480 HA LEU 55 HA LEU 55 2.872 -2.523 4.247 481 HB2 LEU 55 2HB LEU 55 4.983 -3.933 4.241 482 HB3 LEU 55 3HB LEU 55 4.024 -5.312 4.743 483 HG LEU 55 HG LEU 55 2.642 -4.870 2.542 484 HD11 LEU 55 1HD1 LEU 55 3.943 -3.847 0.729 485 HD12 LEU 55 2HD1 LEU 55 5.167 -3.348 1.895 486 HD13 LEU 55 3HD1 LEU 55 3.526 -2.705 2.001 487 HD21 LEU 55 3HD2 LEU 55 5.460 -5.963 2.314 488 HD22 LEU 55 1HD2 LEU 55 4.126 -6.269 1.198 489 HD23 LEU 55 2HD2 LEU 55 4.042 -6.859 2.854 490 H ILE 56 H ILE 56 0.663 -2.597 4.091 491 HA ILE 56 HA ILE 56 -0.805 -4.919 5.178 492 HB ILE 56 HB ILE 56 -1.855 -2.202 4.291 493 HG12 ILE 56 2HG1 ILE 56 -0.656 -2.130 6.472 494 HG13 ILE 56 3HG1 ILE 56 -2.375 -1.824 6.682 495 HG21 ILE 56 1HG2 ILE 56 -3.399 -4.570 5.405 496 HG22 ILE 56 2HG2 ILE 56 -3.530 -3.899 3.779 497 HG23 ILE 56 3HG2 ILE 56 -4.063 -2.950 5.166 498 HD11 ILE 56 3HD1 ILE 56 -1.498 -3.231 8.446 499 HD12 ILE 56 1HD1 ILE 56 -0.953 -4.423 7.268 500 HD13 ILE 56 2HD1 ILE 56 -2.682 -4.122 7.490 501 H LYS 57 H LYS 57 -1.219 -6.471 3.804 502 HA LYS 57 HA LYS 57 -1.437 -6.036 0.906 503 HB2 LYS 57 2HB LYS 57 0.079 -7.792 1.535 504 HB3 LYS 57 3HB LYS 57 -1.062 -8.487 2.671 505 HG2 LYS 57 2HG LYS 57 -1.905 -8.444 -0.198 506 HG3 LYS 57 3HG LYS 57 -0.581 -9.522 0.214 507 HD2 LYS 57 2HD LYS 57 -1.979 -10.682 1.857 508 HD3 LYS 57 3HD LYS 57 -3.299 -9.547 1.577 509 HE2 LYS 57 2HE LYS 57 -3.559 -10.374 -0.709 510 HE3 LYS 57 3HE LYS 57 -2.175 -11.451 -0.502 511 HZ1 LYS 57 3HZ LYS 57 -4.670 -11.602 1.104 512 HZ2 LYS 57 1HZ LYS 57 -3.371 -12.685 1.144 513 HZ3 LYS 57 2HZ LYS 57 -4.333 -12.572 -0.237 514 H SER 58 H SER 58 -3.323 -6.459 -0.233 515 HA SER 58 HA SER 58 -5.449 -8.085 0.854 516 HB2 SER 58 2HB SER 58 -6.104 -5.899 1.821 517 HB3 SER 58 3HB SER 58 -6.019 -5.150 0.227 518 HG SER 58 HG SER 58 -8.126 -5.620 0.449 519 H ASN 59 H ASN 59 -7.049 -8.626 -0.739 520 HA ASN 59 HA ASN 59 -6.114 -8.527 -3.523 521 HB2 ASN 59 2HB ASN 59 -7.661 -10.318 -3.960 522 HB3 ASN 59 3HB ASN 59 -6.921 -10.697 -2.412 523 HD21 ASN 59 1HD2 ASN 59 -8.198 -10.356 -0.481 524 HD22 ASN 59 2HD2 ASN 59 -9.920 -10.393 -0.566 525 H ASP 60 H ASP 60 -8.346 -6.992 -1.446 526 HA ASP 60 HA ASP 60 -10.030 -5.951 -3.649 527 HB2 ASP 60 2HB ASP 60 -11.252 -7.263 -1.946 528 HB3 ASP 60 3HB ASP 60 -10.581 -6.272 -0.658 529 H LYS 61 H LYS 61 -9.519 -3.903 -4.205 530 HA LYS 61 HA LYS 61 -7.803 -2.227 -2.604 531 HB2 LYS 61 2HB LYS 61 -7.859 -0.608 -4.458 532 HB3 LYS 61 3HB LYS 61 -7.442 -2.212 -5.014 533 HG2 LYS 61 2HG LYS 61 -10.295 -1.259 -5.254 534 HG3 LYS 61 3HG LYS 61 -9.084 -0.688 -6.403 535 HD2 LYS 61 2HD LYS 61 -8.572 -3.045 -7.005 536 HD3 LYS 61 3HD LYS 61 -9.827 -3.592 -5.891 537 HE2 LYS 61 2HE LYS 61 -10.241 -1.885 -8.364 538 HE3 LYS 61 3HE LYS 61 -10.659 -3.589 -8.190 539 HZ1 LYS 61 3HZ LYS 61 -12.269 -2.964 -6.474 540 HZ2 LYS 61 1HZ LYS 61 -12.600 -2.190 -7.940 541 HZ3 LYS 61 2HZ LYS 61 -11.876 -1.331 -6.679 542 H GLN 62 H GLN 62 -11.155 -2.625 -2.585 543 HA GLN 62 HA GLN 62 -11.949 0.139 -2.216 544 HB2 GLN 62 2HB GLN 62 -13.547 -2.356 -1.501 545 HB3 GLN 62 3HB GLN 62 -14.173 -0.728 -1.724 546 HG2 GLN 62 2HG GLN 62 -13.008 -2.510 -3.878 547 HG3 GLN 62 3HG GLN 62 -14.715 -2.150 -3.634 548 HE21 GLN 62 1HE2 GLN 62 -15.466 -0.041 -4.117 549 HE22 GLN 62 2HE2 GLN 62 -14.589 1.008 -5.174 550 H LEU 63 H LEU 63 -11.113 -2.627 -0.171 551 HA LEU 63 HA LEU 63 -11.624 -1.566 2.390 552 HB2 LEU 63 2HB LEU 63 -9.394 -3.461 1.527 553 HB3 LEU 63 3HB LEU 63 -9.864 -3.166 3.195 554 HG LEU 63 HG LEU 63 -11.557 -4.516 1.060 555 HD11 LEU 63 1HD1 LEU 63 -9.765 -5.947 1.886 556 HD12 LEU 63 2HD1 LEU 63 -11.334 -6.530 2.434 557 HD13 LEU 63 3HD1 LEU 63 -10.278 -5.665 3.553 558 HD21 LEU 63 3HD2 LEU 63 -13.004 -3.206 2.510 559 HD22 LEU 63 1HD2 LEU 63 -12.266 -3.923 3.946 560 HD23 LEU 63 2HD2 LEU 63 -13.211 -4.922 2.839 561 H LEU 64 H LEU 64 -8.936 -1.215 0.168 562 HA LEU 64 HA LEU 64 -7.155 0.233 1.845 563 HB2 LEU 64 2HB LEU 64 -7.325 -0.124 -1.169 564 HB3 LEU 64 3HB LEU 64 -6.104 0.897 -0.434 565 HG LEU 64 HG LEU 64 -5.139 -1.054 0.754 566 HD11 LEU 64 1HD1 LEU 64 -7.161 -2.426 1.010 567 HD12 LEU 64 2HD1 LEU 64 -5.822 -3.329 0.306 568 HD13 LEU 64 3HD1 LEU 64 -7.142 -2.765 -0.724 569 HD21 LEU 64 3HD2 LEU 64 -5.452 -1.524 -2.218 570 HD22 LEU 64 1HD2 LEU 64 -4.202 -2.226 -1.185 571 HD23 LEU 64 2HD2 LEU 64 -4.259 -0.484 -1.438 572 H LYS 65 H LYS 65 -9.827 1.194 -0.307 573 HA LYS 65 HA LYS 65 -9.349 3.997 -0.310 574 HB2 LYS 65 2HB LYS 65 -12.003 2.513 -0.586 575 HB3 LYS 65 3HB LYS 65 -11.769 4.228 -0.910 576 HG2 LYS 65 2HG LYS 65 -10.124 3.576 -2.711 577 HG3 LYS 65 3HG LYS 65 -10.597 1.894 -2.445 578 HD2 LYS 65 2HD LYS 65 -11.849 2.781 -4.344 579 HD3 LYS 65 3HD LYS 65 -12.961 2.500 -3.006 580 HE2 LYS 65 2HE LYS 65 -12.976 4.889 -2.475 581 HE3 LYS 65 3HE LYS 65 -11.770 5.203 -3.726 582 HZ1 LYS 65 3HZ LYS 65 -14.488 4.112 -4.240 583 HZ2 LYS 65 1HZ LYS 65 -13.344 4.550 -5.404 584 HZ3 LYS 65 2HZ LYS 65 -14.052 5.732 -4.425 585 H GLU 66 H GLU 66 -11.523 1.955 1.638 586 HA GLU 66 HA GLU 66 -12.574 4.014 3.261 587 HB2 GLU 66 2HB GLU 66 -12.431 1.040 3.926 588 HB3 GLU 66 3HB GLU 66 -13.564 2.214 4.592 589 HG2 GLU 66 2HG GLU 66 -13.454 1.205 1.735 590 HG3 GLU 66 3HG GLU 66 -14.688 0.843 2.930 591 H MET 67 H MET 67 -9.706 2.053 3.500 592 HA MET 67 HA MET 67 -8.913 2.630 6.157 593 HB2 MET 67 2HB MET 67 -7.940 0.844 4.615 594 HB3 MET 67 3HB MET 67 -7.102 2.124 3.751 595 HG2 MET 67 2HG MET 67 -5.988 2.723 5.938 596 HG3 MET 67 3HG MET 67 -6.691 1.257 6.616 597 HE1 MET 67 3HE MET 67 -4.955 -1.436 4.206 598 HE2 MET 67 1HE MET 67 -6.501 -0.633 3.935 599 HE3 MET 67 2HE MET 67 -6.097 -1.257 5.536 600 H LEU 68 H LEU 68 -8.095 4.133 3.011 601 HA LEU 68 HA LEU 68 -6.398 6.176 4.018 602 HB2 LEU 68 2HB LEU 68 -7.854 5.914 1.360 603 HB3 LEU 68 3HB LEU 68 -6.688 7.185 1.700 604 HG LEU 68 HG LEU 68 -6.039 4.208 1.710 605 HD11 LEU 68 1HD1 LEU 68 -5.392 6.277 -0.411 606 HD12 LEU 68 2HD1 LEU 68 -6.569 4.968 -0.555 607 HD13 LEU 68 3HD1 LEU 68 -4.855 4.592 -0.393 608 HD21 LEU 68 3HD2 LEU 68 -4.591 5.475 3.214 609 HD22 LEU 68 1HD2 LEU 68 -4.197 6.605 1.914 610 HD23 LEU 68 2HD2 LEU 68 -3.697 4.916 1.803 611 H GLU 69 H GLU 69 -9.866 6.024 3.589 612 HA GLU 69 HA GLU 69 -10.493 8.775 3.816 613 HB2 GLU 69 2HB GLU 69 -12.107 6.340 4.694 614 HB3 GLU 69 3HB GLU 69 -12.747 7.975 4.567 615 HG2 GLU 69 2HG GLU 69 -11.685 6.300 2.278 616 HG3 GLU 69 3HG GLU 69 -13.381 6.605 2.639 617 H LEU 70 H LEU 70 -9.848 6.254 6.205 618 HA LEU 70 HA LEU 70 -10.379 7.882 8.526 619 HB2 LEU 70 2HB LEU 70 -8.853 5.255 8.291 620 HB3 LEU 70 3HB LEU 70 -9.436 5.966 9.788 621 HG LEU 70 HG LEU 70 -11.167 4.880 7.529 622 HD11 LEU 70 1HD1 LEU 70 -11.814 3.123 9.110 623 HD12 LEU 70 2HD1 LEU 70 -10.693 3.771 10.310 624 HD13 LEU 70 3HD1 LEU 70 -10.078 3.102 8.796 625 HD21 LEU 70 3HD2 LEU 70 -12.281 6.780 8.570 626 HD22 LEU 70 1HD2 LEU 70 -12.034 6.087 10.176 627 HD23 LEU 70 2HD2 LEU 70 -13.093 5.282 9.014 628 H ILE 71 H ILE 71 -7.554 6.903 6.665 629 HA ILE 71 HA ILE 71 -5.505 7.808 8.405 630 HB ILE 71 HB ILE 71 -5.501 7.112 5.437 631 HG12 ILE 71 2HG1 ILE 71 -4.444 5.615 7.879 632 HG13 ILE 71 3HG1 ILE 71 -5.931 5.245 7.018 633 HG21 ILE 71 1HG2 ILE 71 -3.035 7.103 5.488 634 HG22 ILE 71 2HG2 ILE 71 -3.058 7.736 7.133 635 HG23 ILE 71 3HG2 ILE 71 -3.673 8.716 5.802 636 HD11 ILE 71 3HD1 ILE 71 -4.596 4.669 5.027 637 HD12 ILE 71 1HD1 ILE 71 -4.227 3.673 6.434 638 HD13 ILE 71 2HD1 ILE 71 -3.125 4.963 5.960 639 H SER 72 H SER 72 -7.335 9.405 5.842 640 HA SER 72 HA SER 72 -5.703 11.667 5.459 641 HB2 SER 72 2HB SER 72 -7.779 12.739 4.544 642 HB3 SER 72 3HB SER 72 -7.489 11.128 3.893 643 HG SER 72 HG SER 72 -9.252 10.434 4.807 644 H LYS 73 H LYS 73 -8.019 10.894 7.987 645 HA LYS 73 HA LYS 73 -7.940 13.560 9.178 646 HB2 LYS 73 2HB LYS 73 -9.186 10.990 10.244 647 HB3 LYS 73 3HB LYS 73 -9.411 12.602 10.918 648 HG2 LYS 73 2HG LYS 73 -10.453 13.269 8.684 649 HG3 LYS 73 3HG LYS 73 -10.397 11.563 8.246 650 HD2 LYS 73 2HD LYS 73 -12.597 11.840 9.032 651 HD3 LYS 73 3HD LYS 73 -11.760 11.154 10.422 652 HE2 LYS 73 2HE LYS 73 -12.441 14.084 10.007 653 HE3 LYS 73 3HE LYS 73 -13.265 12.970 11.093 654 HZ1 LYS 73 3HZ LYS 73 -10.482 13.987 11.341 655 HZ2 LYS 73 1HZ LYS 73 -11.116 12.750 12.308 656 HZ3 LYS 73 2HZ LYS 73 -11.787 14.296 12.369 657 H LEU 74 H LEU 74 -6.398 10.421 9.593 658 HA LEU 74 HA LEU 74 -5.194 10.944 12.147 659 HB2 LEU 74 2HB LEU 74 -4.473 8.911 10.005 660 HB3 LEU 74 3HB LEU 74 -3.791 8.933 11.625 661 HG LEU 74 HG LEU 74 -6.720 8.446 10.947 662 HD11 LEU 74 1HD1 LEU 74 -6.335 6.140 11.637 663 HD12 LEU 74 2HD1 LEU 74 -4.630 6.487 11.943 664 HD13 LEU 74 3HD1 LEU 74 -5.270 6.573 10.300 665 HD21 LEU 74 3HD2 LEU 74 -5.338 8.386 13.653 666 HD22 LEU 74 1HD2 LEU 74 -7.009 7.906 13.331 667 HD23 LEU 74 2HD2 LEU 74 -6.516 9.581 13.103 668 H GLY 75 H GLY 75 -4.324 11.621 8.839 669 HA2 GLY 75 2HA GLY 75 -2.855 13.119 7.961 670 HA3 GLY 75 3HA GLY 75 -2.491 13.650 9.590 671 H TYR 76 H TYR 76 -1.892 10.737 7.552 672 HA TYR 76 HA TYR 76 0.963 11.257 7.703 673 HB2 TYR 76 2HB TYR 76 1.609 9.005 8.441 674 HB3 TYR 76 3HB TYR 76 0.700 9.848 9.675 675 HD1 TYR 76 HD2 TYR 76 0.477 7.113 7.133 676 HD2 TYR 76 HD1 TYR 76 -1.292 8.869 10.607 677 HE1 TYR 76 HE2 TYR 76 -0.924 5.117 7.430 678 HE2 TYR 76 HE1 TYR 76 -2.681 6.865 10.906 679 HH TYR 76 HH TYR 76 -2.164 3.963 9.130 680 H LYS 77 H LYS 77 2.237 9.898 6.287 681 HA LYS 77 HA LYS 77 0.991 9.792 3.685 682 HB2 LYS 77 2HB LYS 77 3.843 9.467 4.667 683 HB3 LYS 77 3HB LYS 77 3.420 9.220 2.977 684 HG2 LYS 77 2HG LYS 77 2.815 11.800 4.445 685 HG3 LYS 77 3HG LYS 77 4.343 11.514 3.604 686 HD2 LYS 77 2HD LYS 77 3.180 11.217 1.485 687 HD3 LYS 77 3HD LYS 77 1.607 11.348 2.285 688 HE2 LYS 77 2HE LYS 77 2.178 13.686 2.940 689 HE3 LYS 77 3HE LYS 77 3.691 13.547 2.038 690 HZ1 LYS 77 3HZ LYS 77 2.068 14.630 0.683 691 HZ2 LYS 77 1HZ LYS 77 0.936 13.398 0.932 692 HZ3 LYS 77 2HZ LYS 77 2.336 13.096 0.035 693 H VAL 78 H VAL 78 0.600 8.071 2.465 694 HA VAL 78 HA VAL 78 1.369 5.357 3.324 695 HB VAL 78 HB VAL 78 -1.354 6.211 2.231 696 HG11 VAL 78 1HG1 VAL 78 -0.709 4.006 1.336 697 HG12 VAL 78 2HG1 VAL 78 -2.041 3.861 2.485 698 HG13 VAL 78 3HG1 VAL 78 -0.401 3.425 2.974 699 HG21 VAL 78 3HG2 VAL 78 -2.241 5.472 4.402 700 HG22 VAL 78 1HG2 VAL 78 -1.055 6.761 4.612 701 HG23 VAL 78 2HG2 VAL 78 -0.608 5.087 4.951 702 H PHE 79 H PHE 79 1.818 3.923 1.655 703 HA PHE 79 HA PHE 79 2.310 5.101 -1.010 704 HB2 PHE 79 2HB PHE 79 3.967 3.000 0.466 705 HB3 PHE 79 3HB PHE 79 4.362 3.742 -1.083 706 HD1 PHE 79 HD2 PHE 79 4.208 4.293 2.581 707 HD2 PHE 79 HD1 PHE 79 5.256 6.002 -1.196 708 HE1 PHE 79 HE2 PHE 79 5.370 6.137 3.725 709 HE2 PHE 79 HE1 PHE 79 6.400 7.831 -0.038 710 HZ PHE 79 HZ PHE 79 6.465 7.901 2.410 711 H LEU 80 H LEU 80 0.856 4.186 -2.379 712 HA LEU 80 HA LEU 80 -0.005 1.384 -1.914 713 HB2 LEU 80 2HB LEU 80 -1.868 2.881 -1.764 714 HB3 LEU 80 3HB LEU 80 -1.393 3.749 -3.213 715 HG LEU 80 HG LEU 80 -2.074 1.855 -4.631 716 HD11 LEU 80 1HD1 LEU 80 -2.819 0.398 -2.090 717 HD12 LEU 80 2HD1 LEU 80 -1.505 -0.016 -3.193 718 HD13 LEU 80 3HD1 LEU 80 -3.176 -0.136 -3.736 719 HD21 LEU 80 3HD2 LEU 80 -4.497 1.906 -4.262 720 HD22 LEU 80 1HD2 LEU 80 -3.790 3.508 -4.061 721 HD23 LEU 80 2HD2 LEU 80 -4.254 2.565 -2.642 722 H LEU 81 H LEU 81 0.398 -0.127 -3.406 723 HA LEU 81 HA LEU 81 1.286 0.670 -6.116 724 HB2 LEU 81 2HB LEU 81 3.183 -0.203 -4.770 725 HB3 LEU 81 3HB LEU 81 2.306 -1.692 -4.494 726 HG LEU 81 HG LEU 81 2.423 -2.243 -6.906 727 HD11 LEU 81 1HD1 LEU 81 2.383 -0.009 -7.865 728 HD12 LEU 81 2HD1 LEU 81 3.768 -0.916 -8.466 729 HD13 LEU 81 3HD1 LEU 81 3.997 0.324 -7.228 730 HD21 LEU 81 3HD2 LEU 81 4.220 -3.042 -5.450 731 HD22 LEU 81 1HD2 LEU 81 5.142 -1.564 -5.738 732 HD23 LEU 81 2HD2 LEU 81 4.835 -2.691 -7.063 733 H LEU 82 H LEU 82 0.027 -0.054 -7.620 734 HA LEU 82 HA LEU 82 -1.780 -2.363 -7.226 735 HB2 LEU 82 2HB LEU 82 -1.966 -0.017 -9.163 736 HB3 LEU 82 3HB LEU 82 -3.159 -1.296 -8.999 737 HG LEU 82 HG LEU 82 -2.478 0.684 -6.789 738 HD11 LEU 82 1HD1 LEU 82 -4.841 0.767 -8.684 739 HD12 LEU 82 2HD1 LEU 82 -3.447 1.851 -8.720 740 HD13 LEU 82 3HD1 LEU 82 -4.526 1.859 -7.331 741 HD21 LEU 82 3HD2 LEU 82 -3.397 -1.413 -5.937 742 HD22 LEU 82 1HD2 LEU 82 -4.778 -1.286 -7.034 743 HD23 LEU 82 2HD2 LEU 82 -4.557 -0.103 -5.740 744 H ALA 83 H ALA 83 -1.558 -4.078 -8.679 745 HA ALA 83 HA ALA 83 -0.149 -3.693 -11.214 746 HB1 ALA 83 3HB ALA 83 1.466 -5.502 -10.863 747 HB2 ALA 83 1HB ALA 83 0.883 -5.737 -9.212 748 HB3 ALA 83 2HB ALA 83 1.693 -4.234 -9.658 749 H ASP 84 H ASP 84 -1.190 -4.752 -12.757 750 HA ASP 84 HA ASP 84 -2.105 -7.417 -12.646 751 HB2 ASP 84 2HB ASP 84 -3.901 -6.472 -11.189 752 HB3 ASP 84 3HB ASP 84 -4.330 -5.328 -12.453 753 H GLN 85 H GLN 85 -3.252 -8.049 -14.618 754 HA GLN 85 HA GLN 85 -2.285 -6.776 -16.980 755 HB2 GLN 85 2HB GLN 85 -4.287 -9.053 -16.674 756 HB3 GLN 85 3HB GLN 85 -3.457 -8.598 -18.165 757 HG2 GLN 85 2HG GLN 85 -1.270 -9.129 -17.076 758 HG3 GLN 85 3HG GLN 85 -2.137 -9.668 -15.640 759 HE21 GLN 85 1HE2 GLN 85 -1.311 -10.416 -18.941 760 HE22 GLN 85 2HE2 GLN 85 -1.844 -12.058 -18.906 761 H ASP 86 H ASP 86 -5.415 -6.789 -15.288 762 HA ASP 86 HA ASP 86 -6.584 -4.924 -17.230 763 HB2 ASP 86 2HB ASP 86 -8.036 -6.641 -16.035 764 HB3 ASP 86 3HB ASP 86 -7.734 -5.787 -14.536 765 H GLU 87 H GLU 87 -4.518 -3.757 -16.795 766 HA GLU 87 HA GLU 87 -4.155 -2.260 -14.375 767 HB2 GLU 87 2HB GLU 87 -2.254 -1.219 -15.685 768 HB3 GLU 87 3HB GLU 87 -2.209 -2.970 -15.582 769 HG2 GLU 87 2HG GLU 87 -1.579 -2.504 -17.793 770 HG3 GLU 87 3HG GLU 87 -3.261 -3.005 -17.912 771 H ASN 88 H ASN 88 -6.034 -1.833 -17.152 772 HA ASN 88 HA ASN 88 -5.997 0.939 -17.618 773 HB2 ASN 88 2HB ASN 88 -6.879 -0.679 -19.238 774 HB3 ASN 88 3HB ASN 88 -8.177 -1.127 -18.140 775 HD21 ASN 88 1HD2 ASN 88 -7.009 1.310 -20.365 776 HD22 ASN 88 2HD2 ASN 88 -8.497 2.177 -20.489 777 H GLU 89 H GLU 89 -8.206 -1.020 -15.558 778 HA GLU 89 HA GLU 89 -9.740 1.143 -14.545 779 HB2 GLU 89 2HB GLU 89 -10.563 -1.148 -14.354 780 HB3 GLU 89 3HB GLU 89 -9.184 -1.607 -13.360 781 HG2 GLU 89 2HG GLU 89 -9.963 -0.032 -11.593 782 HG3 GLU 89 3HG GLU 89 -11.369 0.358 -12.579 783 H LEU 90 H LEU 90 -6.926 -0.594 -13.261 784 HA LEU 90 HA LEU 90 -6.660 0.802 -10.817 785 HB2 LEU 90 2HB LEU 90 -4.570 -0.696 -12.438 786 HB3 LEU 90 3HB LEU 90 -4.329 -0.146 -10.789 787 HG LEU 90 HG LEU 90 -6.343 -2.245 -11.678 788 HD11 LEU 90 1HD1 LEU 90 -4.035 -3.060 -11.804 789 HD12 LEU 90 2HD1 LEU 90 -4.920 -3.859 -10.509 790 HD13 LEU 90 3HD1 LEU 90 -3.756 -2.586 -10.126 791 HD21 LEU 90 3HD2 LEU 90 -7.205 -1.003 -9.758 792 HD22 LEU 90 1HD2 LEU 90 -5.700 -1.275 -8.873 793 HD23 LEU 90 2HD2 LEU 90 -6.749 -2.636 -9.284 794 H GLU 91 H GLU 91 -5.738 1.616 -14.050 795 HA GLU 91 HA GLU 91 -3.666 3.480 -13.599 796 HB2 GLU 91 2HB GLU 91 -4.141 2.436 -15.810 797 HB3 GLU 91 3HB GLU 91 -5.657 3.320 -15.908 798 HG2 GLU 91 2HG GLU 91 -4.049 4.426 -17.313 799 HG3 GLU 91 3HG GLU 91 -4.357 5.460 -15.922 800 H GLU 92 H GLU 92 -7.210 3.838 -13.781 801 HA GLU 92 HA GLU 92 -7.117 6.709 -13.346 802 HB2 GLU 92 2HB GLU 92 -8.898 5.751 -14.747 803 HB3 GLU 92 3HB GLU 92 -9.483 4.791 -13.388 804 HG2 GLU 92 2HG GLU 92 -10.054 6.856 -12.165 805 HG3 GLU 92 3HG GLU 92 -9.434 7.826 -13.495 806 H PHE 93 H PHE 93 -7.666 3.781 -11.469 807 HA PHE 93 HA PHE 93 -8.782 4.812 -9.124 808 HB2 PHE 93 2HB PHE 93 -8.551 2.355 -9.695 809 HB3 PHE 93 3HB PHE 93 -6.837 2.459 -9.313 810 HD1 PHE 93 HD1 PHE 93 -10.251 2.457 -7.912 811 HD2 PHE 93 HD2 PHE 93 -6.083 2.617 -6.967 812 HE1 PHE 93 HE1 PHE 93 -10.752 1.991 -5.553 813 HE2 PHE 93 HE2 PHE 93 -6.593 2.148 -4.613 814 HZ PHE 93 HZ PHE 93 -8.925 1.833 -3.906 815 H LYS 94 H LYS 94 -5.378 4.319 -10.017 816 HA LYS 94 HA LYS 94 -4.261 5.246 -7.596 817 HB2 LYS 94 2HB LYS 94 -2.098 5.186 -8.758 818 HB3 LYS 94 3HB LYS 94 -3.036 3.740 -9.065 819 HG2 LYS 94 2HG LYS 94 -2.122 4.143 -11.149 820 HG3 LYS 94 3HG LYS 94 -3.693 4.921 -11.307 821 HD2 LYS 94 2HD LYS 94 -1.902 6.295 -12.291 822 HD3 LYS 94 3HD LYS 94 -2.649 7.126 -10.925 823 HE2 LYS 94 2HE LYS 94 -0.735 6.408 -9.490 824 HE3 LYS 94 3HE LYS 94 0.004 5.644 -10.901 825 HZ1 LYS 94 3HZ LYS 94 0.088 7.812 -11.978 826 HZ2 LYS 94 1HZ LYS 94 0.938 7.827 -10.518 827 HZ3 LYS 94 2HZ LYS 94 -0.588 8.544 -10.611 828 H ARG 95 H ARG 95 -5.368 6.951 -10.449 829 HA ARG 95 HA ARG 95 -4.000 9.421 -10.043 830 HB2 ARG 95 2HB ARG 95 -6.624 8.821 -11.478 831 HB3 ARG 95 3HB ARG 95 -5.815 10.388 -11.520 832 HG2 ARG 95 2HG ARG 95 -3.879 9.396 -12.634 833 HG3 ARG 95 3HG ARG 95 -4.613 7.792 -12.532 834 HD2 ARG 95 2HD ARG 95 -4.908 8.707 -14.773 835 HD3 ARG 95 3HD ARG 95 -6.474 8.566 -13.971 836 HE ARG 95 HE ARG 95 -5.641 11.137 -13.475 837 HH11 ARG 95 1HH1 ARG 95 -6.303 9.267 -16.396 838 HH12 ARG 95 2HH1 ARG 95 -6.754 10.660 -17.318 839 HH21 ARG 95 1HH2 ARG 95 -6.200 12.949 -14.707 840 HH22 ARG 95 2HH2 ARG 95 -6.698 12.758 -16.361 841 H LYS 96 H LYS 96 -7.168 8.201 -8.976 842 HA LYS 96 HA LYS 96 -8.082 10.516 -7.641 843 HB2 LYS 96 2HB LYS 96 -8.803 7.590 -7.497 844 HB3 LYS 96 3HB LYS 96 -9.384 8.639 -6.211 845 HG2 LYS 96 2HG LYS 96 -11.124 8.452 -7.829 846 HG3 LYS 96 3HG LYS 96 -10.469 10.086 -7.935 847 HD2 LYS 96 2HD LYS 96 -9.149 9.380 -9.941 848 HD3 LYS 96 3HD LYS 96 -9.895 7.782 -9.838 849 HE2 LYS 96 2HE LYS 96 -11.342 10.410 -10.335 850 HE3 LYS 96 3HE LYS 96 -11.040 9.139 -11.522 851 HZ1 LYS 96 3HZ LYS 96 -12.764 8.924 -9.111 852 HZ2 LYS 96 1HZ LYS 96 -12.417 7.645 -10.164 853 HZ3 LYS 96 2HZ LYS 96 -13.282 8.986 -10.720 854 H ILE 97 H ILE 97 -6.283 7.677 -6.448 855 HA ILE 97 HA ILE 97 -6.172 8.419 -3.716 856 HB ILE 97 HB ILE 97 -4.301 6.586 -5.289 857 HG12 ILE 97 2HG1 ILE 97 -6.606 5.814 -5.512 858 HG13 ILE 97 3HG1 ILE 97 -5.749 4.717 -4.443 859 HG21 ILE 97 1HG2 ILE 97 -4.738 6.745 -2.289 860 HG22 ILE 97 2HG2 ILE 97 -3.269 7.179 -3.164 861 HG23 ILE 97 3HG2 ILE 97 -3.800 5.496 -3.114 862 HD11 ILE 97 3HD1 ILE 97 -7.990 5.102 -3.647 863 HD12 ILE 97 1HD1 ILE 97 -7.734 6.846 -3.625 864 HD13 ILE 97 2HD1 ILE 97 -6.847 5.809 -2.506 865 H GLU 98 H GLU 98 -4.109 9.105 -6.478 866 HA GLU 98 HA GLU 98 -1.918 10.338 -5.129 867 HB2 GLU 98 2HB GLU 98 -1.832 9.368 -7.433 868 HB3 GLU 98 3HB GLU 98 -2.855 10.677 -8.014 869 HG2 GLU 98 2HG GLU 98 -1.105 12.307 -7.465 870 HG3 GLU 98 3HG GLU 98 -0.094 11.021 -6.805 871 H SER 99 H SER 99 -4.979 11.490 -6.396 872 HA SER 99 HA SER 99 -4.437 14.310 -6.126 873 HB2 SER 99 2HB SER 99 -6.065 13.408 -7.780 874 HB3 SER 99 3HB SER 99 -7.103 12.864 -6.463 875 HG SER 99 HG SER 99 -6.349 15.555 -7.009 876 H GLN 100 H GLN 100 -5.288 11.813 -3.942 877 HA GLN 100 HA GLN 100 -6.360 13.569 -1.850 878 HB2 GLN 100 2HB GLN 100 -5.646 10.602 -1.798 879 HB3 GLN 100 3HB GLN 100 -6.517 11.470 -0.538 880 HG2 GLN 100 2HG GLN 100 -8.425 11.789 -1.975 881 HG3 GLN 100 3HG GLN 100 -7.540 11.172 -3.367 882 HE21 GLN 100 1HE2 GLN 100 -7.558 9.744 -0.106 883 HE22 GLN 100 2HE2 GLN 100 -8.332 8.280 -0.576 884 H GLY 101 H GLY 101 -3.330 12.949 -3.055 885 HA2 GLY 101 2HA GLY 101 -1.326 13.840 -2.298 886 HA3 GLY 101 3HA GLY 101 -2.022 14.064 -0.702 887 H TYR 102 H TYR 102 -2.228 10.950 -2.294 888 HA TYR 102 HA TYR 102 -0.199 9.853 -0.433 889 HB2 TYR 102 2HB TYR 102 -2.505 8.449 -1.851 890 HB3 TYR 102 3HB TYR 102 -1.308 7.636 -0.844 891 HD1 TYR 102 HD2 TYR 102 -1.070 8.542 1.625 892 HD2 TYR 102 HD1 TYR 102 -4.507 9.216 -0.830 893 HE1 TYR 102 HE2 TYR 102 -2.410 9.015 3.628 894 HE2 TYR 102 HE1 TYR 102 -5.846 9.693 1.178 895 HH TYR 102 HH TYR 102 -4.443 10.208 4.245 896 H GLU 103 H GLU 103 1.491 8.669 -1.176 897 HA GLU 103 HA GLU 103 2.302 8.991 -3.926 898 HB2 GLU 103 2HB GLU 103 3.949 9.243 -2.129 899 HB3 GLU 103 3HB GLU 103 3.622 7.618 -1.543 900 HG2 GLU 103 2HG GLU 103 5.747 7.713 -2.755 901 HG3 GLU 103 3HG GLU 103 4.598 6.660 -3.579 902 H VAL 104 H VAL 104 1.290 7.697 -5.355 903 HA VAL 104 HA VAL 104 0.981 4.817 -4.787 904 HB VAL 104 HB VAL 104 -1.163 5.733 -4.244 905 HG11 VAL 104 1HG1 VAL 104 -2.498 7.128 -5.766 906 HG12 VAL 104 2HG1 VAL 104 -1.154 7.180 -6.910 907 HG13 VAL 104 3HG1 VAL 104 -0.987 7.918 -5.313 908 HG21 VAL 104 3HG2 VAL 104 -1.233 3.632 -5.537 909 HG22 VAL 104 1HG2 VAL 104 -1.354 4.548 -7.041 910 HG23 VAL 104 2HG2 VAL 104 -2.659 4.621 -5.853 911 H ARG 105 H ARG 105 1.444 3.541 -6.431 912 HA ARG 105 HA ARG 105 1.740 4.605 -9.173 913 HB2 ARG 105 2HB ARG 105 3.649 2.705 -7.730 914 HB3 ARG 105 3HB ARG 105 3.761 3.148 -9.431 915 HG2 ARG 105 2HG ARG 105 4.041 5.065 -7.092 916 HG3 ARG 105 3HG ARG 105 5.371 4.395 -8.039 917 HD2 ARG 105 2HD ARG 105 4.735 5.607 -9.986 918 HD3 ARG 105 3HD ARG 105 3.155 6.019 -9.315 919 HE ARG 105 HE ARG 105 4.368 7.407 -7.674 920 HH11 ARG 105 1HH1 ARG 105 5.963 6.694 -10.740 921 HH12 ARG 105 2HH1 ARG 105 6.939 8.123 -10.676 922 HH21 ARG 105 1HH2 ARG 105 5.606 9.257 -7.630 923 HH22 ARG 105 2HH2 ARG 105 6.734 9.581 -8.906 924 H LYS 106 H LYS 106 1.576 3.015 -10.803 925 HA LYS 106 HA LYS 106 0.367 0.430 -10.128 926 HB2 LYS 106 2HB LYS 106 -1.470 2.054 -10.577 927 HB3 LYS 106 3HB LYS 106 -0.775 2.427 -12.142 928 HG2 LYS 106 2HG LYS 106 -1.670 -0.379 -11.450 929 HG3 LYS 106 3HG LYS 106 -2.813 0.834 -12.019 930 HD2 LYS 106 2HD LYS 106 -0.376 -0.166 -13.536 931 HD3 LYS 106 3HD LYS 106 -2.055 -0.597 -13.859 932 HE2 LYS 106 2HE LYS 106 -2.583 1.645 -14.543 933 HE3 LYS 106 3HE LYS 106 -1.021 2.252 -13.992 934 HZ1 LYS 106 3HZ LYS 106 -1.459 0.366 -16.239 935 HZ2 LYS 106 1HZ LYS 106 0.044 0.920 -15.701 936 HZ3 LYS 106 2HZ LYS 106 -1.062 2.006 -16.370 937 H VAL 107 H VAL 107 1.184 -1.168 -11.325 938 HA VAL 107 HA VAL 107 2.728 -0.665 -13.784 939 HB VAL 107 HB VAL 107 4.514 -2.251 -12.995 940 HG11 VAL 107 1HG1 VAL 107 5.703 -0.703 -11.486 941 HG12 VAL 107 2HG1 VAL 107 4.203 0.186 -11.200 942 HG13 VAL 107 3HG1 VAL 107 4.924 0.166 -12.811 943 HG21 VAL 107 3HG2 VAL 107 3.226 -3.493 -11.320 944 HG22 VAL 107 1HG2 VAL 107 3.130 -2.057 -10.296 945 HG23 VAL 107 2HG2 VAL 107 4.689 -2.826 -10.598 946 H THR 108 H THR 108 3.481 -2.991 -14.562 947 HA THR 108 HA THR 108 1.287 -4.963 -14.399 948 HB THR 108 HB THR 108 1.865 -5.438 -16.887 949 HG1 THR 108 HG1 THR 108 2.961 -3.905 -17.987 950 HG21 THR 108 3HG2 THR 108 -0.263 -4.370 -16.257 951 HG22 THR 108 1HG2 THR 108 0.375 -3.699 -17.759 952 HG23 THR 108 2HG2 THR 108 0.526 -2.790 -16.256 953 H ASP 109 H ASP 109 4.691 -4.270 -15.101 954 HA ASP 109 HA ASP 109 5.532 -7.033 -15.159 955 HB2 ASP 109 2HB ASP 109 7.180 -4.463 -15.006 956 HB3 ASP 109 3HB ASP 109 7.843 -6.071 -15.275 957 H ASP 110 H ASP 110 6.344 -8.187 -13.532 958 HA ASP 110 HA ASP 110 5.927 -7.472 -10.803 959 HB2 ASP 110 2HB ASP 110 6.730 -9.724 -10.307 960 HB3 ASP 110 3HB ASP 110 5.684 -9.797 -11.716 961 H GLU 111 H GLU 111 8.740 -7.757 -12.905 962 HA GLU 111 HA GLU 111 10.797 -7.247 -11.040 963 HB2 GLU 111 2HB GLU 111 12.133 -6.588 -13.102 964 HB3 GLU 111 3HB GLU 111 11.399 -8.186 -13.159 965 HG2 GLU 111 2HG GLU 111 9.547 -7.254 -14.551 966 HG3 GLU 111 3HG GLU 111 10.371 -5.697 -14.560 967 H GLU 112 H GLU 112 8.771 -5.115 -13.009 968 HA GLU 112 HA GLU 112 10.105 -2.690 -12.303 969 HB2 GLU 112 2HB GLU 112 8.728 -2.971 -14.373 970 HB3 GLU 112 3HB GLU 112 7.279 -3.096 -13.385 971 HG2 GLU 112 2HG GLU 112 7.432 -0.871 -14.335 972 HG3 GLU 112 3HG GLU 112 7.642 -0.774 -12.588 973 H ALA 113 H ALA 113 7.374 -4.515 -10.956 974 HA ALA 113 HA ALA 113 6.330 -2.607 -9.192 975 HB1 ALA 113 3HB ALA 113 6.491 -5.621 -8.793 976 HB2 ALA 113 1HB ALA 113 5.229 -4.760 -9.676 977 HB3 ALA 113 2HB ALA 113 5.407 -4.518 -7.938 978 H LEU 114 H LEU 114 9.054 -4.870 -8.739 979 HA LEU 114 HA LEU 114 9.423 -4.391 -5.955 980 HB2 LEU 114 2HB LEU 114 11.454 -5.462 -7.953 981 HB3 LEU 114 3HB LEU 114 11.609 -5.530 -6.204 982 HG LEU 114 HG LEU 114 9.772 -7.126 -8.001 983 HD11 LEU 114 1HD1 LEU 114 11.918 -8.124 -7.578 984 HD12 LEU 114 2HD1 LEU 114 10.694 -9.024 -6.688 985 HD13 LEU 114 3HD1 LEU 114 11.745 -7.895 -5.835 986 HD21 LEU 114 3HD2 LEU 114 8.279 -6.268 -6.280 987 HD22 LEU 114 1HD2 LEU 114 9.387 -6.795 -5.009 988 HD23 LEU 114 2HD2 LEU 114 8.573 -7.982 -6.029 989 H LYS 115 H LYS 115 10.901 -2.945 -8.835 990 HA LYS 115 HA LYS 115 12.801 -1.371 -7.357 991 HB2 LYS 115 2HB LYS 115 13.283 -0.283 -9.566 992 HB3 LYS 115 3HB LYS 115 13.397 -2.036 -9.607 993 HG2 LYS 115 2HG LYS 115 11.044 -2.045 -10.550 994 HG3 LYS 115 3HG LYS 115 11.210 -0.305 -10.761 995 HD2 LYS 115 2HD LYS 115 13.082 -2.368 -12.001 996 HD3 LYS 115 3HD LYS 115 11.676 -1.688 -12.821 997 HE2 LYS 115 2HE LYS 115 14.129 -0.173 -11.894 998 HE3 LYS 115 3HE LYS 115 13.661 -0.541 -13.554 999 HZ1 LYS 115 3HZ LYS 115 13.124 1.728 -12.953 1000 HZ2 LYS 115 1HZ LYS 115 12.132 1.180 -11.697 1001 HZ3 LYS 115 2HZ LYS 115 11.725 0.838 -13.297 1002 H ILE 116 H ILE 116 9.473 -0.953 -8.358 1003 HA ILE 116 HA ILE 116 9.301 1.868 -7.816 1004 HB ILE 116 HB ILE 116 7.136 -0.278 -7.981 1005 HG12 ILE 116 2HG1 ILE 116 8.219 0.150 -10.134 1006 HG13 ILE 116 3HG1 ILE 116 6.587 0.789 -10.168 1007 HG21 ILE 116 1HG2 ILE 116 6.744 2.721 -7.744 1008 HG22 ILE 116 2HG2 ILE 116 6.307 1.508 -6.539 1009 HG23 ILE 116 3HG2 ILE 116 5.475 1.545 -8.091 1010 HD11 ILE 116 3HD1 ILE 116 7.497 3.050 -9.846 1011 HD12 ILE 116 1HD1 ILE 116 8.127 2.249 -11.284 1012 HD13 ILE 116 2HD1 ILE 116 9.130 2.369 -9.843 1013 H VAL 117 H VAL 117 8.706 -1.081 -5.898 1014 HA VAL 117 HA VAL 117 7.838 0.008 -3.480 1015 HB VAL 117 HB VAL 117 9.642 -2.420 -3.922 1016 HG11 VAL 117 1HG1 VAL 117 9.834 -1.712 -1.581 1017 HG12 VAL 117 2HG1 VAL 117 8.917 -3.215 -1.691 1018 HG13 VAL 117 3HG1 VAL 117 8.076 -1.685 -1.420 1019 HG21 VAL 117 3HG2 VAL 117 7.562 -3.742 -3.697 1020 HG22 VAL 117 1HG2 VAL 117 7.464 -2.610 -5.045 1021 HG23 VAL 117 2HG2 VAL 117 6.629 -2.252 -3.535 1022 H ARG 118 H ARG 118 11.064 -0.230 -4.826 1023 HA ARG 118 HA ARG 118 12.525 0.689 -2.545 1024 HB2 ARG 118 2HB ARG 118 13.333 0.568 -5.479 1025 HB3 ARG 118 3HB ARG 118 14.443 0.789 -4.126 1026 HG2 ARG 118 2HG ARG 118 13.982 -1.435 -3.293 1027 HG3 ARG 118 3HG ARG 118 12.678 -1.660 -4.458 1028 HD2 ARG 118 2HD ARG 118 14.390 -1.498 -6.296 1029 HD3 ARG 118 3HD ARG 118 15.647 -1.461 -5.053 1030 HE ARG 118 HE ARG 118 14.177 -3.699 -4.477 1031 HH11 ARG 118 1HH1 ARG 118 15.933 -2.624 -7.342 1032 HH12 ARG 118 2HH1 ARG 118 16.287 -4.238 -7.870 1033 HH21 ARG 118 1HH2 ARG 118 14.652 -5.790 -5.173 1034 HH22 ARG 118 2HH2 ARG 118 15.555 -6.041 -6.632 1035 H GLU 119 H GLU 119 10.979 2.306 -5.300 1036 HA GLU 119 HA GLU 119 12.077 4.903 -4.845 1037 HB2 GLU 119 2HB GLU 119 9.435 4.180 -6.186 1038 HB3 GLU 119 3HB GLU 119 10.235 5.746 -6.273 1039 HG2 GLU 119 2HG GLU 119 11.268 3.136 -7.408 1040 HG3 GLU 119 3HG GLU 119 10.580 4.472 -8.322 1041 H PHE 120 H PHE 120 9.081 3.285 -3.753 1042 HA PHE 120 HA PHE 120 7.914 5.302 -2.251 1043 HB2 PHE 120 2HB PHE 120 7.981 2.319 -1.630 1044 HB3 PHE 120 3HB PHE 120 6.929 3.471 -0.813 1045 HD1 PHE 120 HD2 PHE 120 6.003 5.150 -3.116 1046 HD2 PHE 120 HD1 PHE 120 6.470 0.914 -2.763 1047 HE1 PHE 120 HE2 PHE 120 4.240 4.810 -4.803 1048 HE2 PHE 120 HE1 PHE 120 4.719 0.587 -4.441 1049 HZ PHE 120 HZ PHE 120 3.593 2.525 -5.464 1050 H MET 121 H MET 121 10.692 3.313 -1.468 1051 HA MET 121 HA MET 121 10.866 3.940 1.321 1052 HB2 MET 121 2HB MET 121 13.072 2.949 -0.531 1053 HB3 MET 121 3HB MET 121 13.076 2.882 1.229 1054 HG2 MET 121 2HG MET 121 11.239 1.372 -0.623 1055 HG3 MET 121 3HG MET 121 12.569 0.704 0.327 1056 HE1 MET 121 3HE MET 121 10.738 -1.137 1.154 1057 HE2 MET 121 1HE MET 121 9.459 -0.306 0.267 1058 HE3 MET 121 2HE MET 121 9.240 -0.696 1.973 1059 H GLN 122 H GLN 122 11.969 5.523 -1.586 1060 HA GLN 122 HA GLN 122 13.900 7.292 -0.424 1061 HB2 GLN 122 2HB GLN 122 12.261 7.722 -2.968 1062 HB3 GLN 122 3HB GLN 122 13.752 8.553 -2.529 1063 HG2 GLN 122 2HG GLN 122 14.959 6.370 -2.661 1064 HG3 GLN 122 3HG GLN 122 13.464 5.611 -3.209 1065 HE21 GLN 122 1HE2 GLN 122 16.043 5.845 -4.589 1066 HE22 GLN 122 2HE2 GLN 122 15.702 6.639 -6.082 1067 H LYS 123 H LYS 123 10.487 7.641 -1.379 1068 HA LYS 123 HA LYS 123 10.121 10.288 -0.405 1069 HB2 LYS 123 2HB LYS 123 8.079 8.119 -1.065 1070 HB3 LYS 123 3HB LYS 123 7.618 9.727 -0.527 1071 HG2 LYS 123 2HG LYS 123 7.381 9.741 -2.888 1072 HG3 LYS 123 3HG LYS 123 8.853 10.655 -2.547 1073 HD2 LYS 123 2HD LYS 123 10.188 8.604 -3.102 1074 HD3 LYS 123 3HD LYS 123 8.689 7.779 -3.521 1075 HE2 LYS 123 2HE LYS 123 9.736 10.269 -4.915 1076 HE3 LYS 123 3HE LYS 123 9.939 8.621 -5.502 1077 HZ1 LYS 123 3HZ LYS 123 7.362 10.047 -5.139 1078 HZ2 LYS 123 1HZ LYS 123 7.513 8.435 -5.622 1079 HZ3 LYS 123 2HZ LYS 123 8.107 9.671 -6.609 1080 H ALA 124 H ALA 124 9.658 7.084 1.011 1081 HA ALA 124 HA ALA 124 8.473 7.897 3.487 1082 HB1 ALA 124 3HB ALA 124 9.948 5.322 2.772 1083 HB2 ALA 124 1HB ALA 124 8.216 5.608 2.601 1084 HB3 ALA 124 2HB ALA 124 8.945 5.570 4.206 1085 H GLY 125 H GLY 125 11.720 7.589 2.256 1086 HA2 GLY 125 2HA GLY 125 13.228 7.421 4.619 1087 HA3 GLY 125 3HA GLY 125 13.797 8.022 3.071 1088 H SER 126 H SER 126 12.167 10.232 2.727 1089 HA SER 126 HA SER 126 13.397 12.256 4.247 1090 HB2 SER 126 2HB SER 126 10.746 12.439 2.760 1091 HB3 SER 126 3HB SER 126 11.876 13.758 3.098 1092 HG SER 126 HG SER 126 11.845 12.092 1.017 1093 H LEU 127 H LEU 127 10.522 10.371 4.803 1094 HA LEU 127 HA LEU 127 9.246 12.177 6.698 1095 HB2 LEU 127 2HB LEU 127 8.537 9.318 5.941 1096 HB3 LEU 127 3HB LEU 127 7.490 10.467 6.767 1097 HG LEU 127 HG LEU 127 8.506 10.843 3.925 1098 HD11 LEU 127 1HD1 LEU 127 6.313 10.171 3.141 1099 HD12 LEU 127 2HD1 LEU 127 5.799 9.818 4.793 1100 HD13 LEU 127 3HD1 LEU 127 7.080 8.867 4.042 1101 HD21 LEU 127 3HD2 LEU 127 7.925 12.944 5.031 1102 HD22 LEU 127 1HD2 LEU 127 6.327 12.312 5.434 1103 HD23 LEU 127 2HD2 LEU 127 6.782 12.566 3.746 1104 H GLU 128 H GLU 128 11.710 9.916 6.854 1105 HA GLU 128 HA GLU 128 11.363 8.921 9.528 1106 HB2 GLU 128 2HB GLU 128 12.724 7.893 7.598 1107 HB3 GLU 128 3HB GLU 128 13.948 9.107 7.910 1108 HG2 GLU 128 2HG GLU 128 13.026 7.079 9.969 1109 HG3 GLU 128 3HG GLU 128 14.358 6.790 8.860 1110 H HIS 129 H HIS 129 12.533 11.841 8.066 1111 HA HIS 129 HA HIS 129 13.301 13.837 8.777 1112 HB2 HIS 129 2HB HIS 129 12.721 12.900 11.630 1113 HB3 HIS 129 3HB HIS 129 13.087 14.550 11.153 1114 HD1 HIS 129 HD1 HIS 129 11.085 16.005 10.763 1115 HD2 HIS 129 HD2 HIS 129 10.164 11.964 10.427 1116 HE1 HIS 129 HE1 HIS 129 8.589 15.894 10.528 1117 HE2 HIS 129 HE2 HIS 129 8.064 13.449 10.286 1118 H HIS 130 H HIS 130 15.400 13.530 8.033 1119 HA HIS 130 HA HIS 130 17.438 12.348 9.839 1120 HB2 HIS 130 2HB HIS 130 17.600 13.149 6.890 1121 HB3 HIS 130 3HB HIS 130 18.892 12.372 7.802 1122 HD1 HIS 130 HD1 HIS 130 18.883 9.850 7.828 1123 HD2 HIS 130 HD2 HIS 130 15.269 11.435 6.518 1124 HE1 HIS 130 HE1 HIS 130 17.551 7.902 6.973 1125 HE2 HIS 130 HE2 HIS 130 15.469 8.915 6.021 1126 H HIS 131 H HIS 131 19.616 13.977 8.518 1127 HA HIS 131 HA HIS 131 19.769 16.343 9.987 1128 HB2 HIS 131 2HB HIS 131 21.740 15.402 8.859 1129 HB3 HIS 131 3HB HIS 131 21.008 15.660 7.278 1130 HD1 HIS 131 HD1 HIS 131 22.206 17.766 10.247 1131 HD2 HIS 131 HD2 HIS 131 21.761 18.026 6.117 1132 HE1 HIS 131 HE1 HIS 131 23.187 19.982 9.590 1133 HE2 HIS 131 HE2 HIS 131 22.828 20.149 7.112 1134 H HIS 132 H HIS 132 18.361 15.715 6.824 1135 HA HIS 132 HA HIS 132 17.173 18.374 6.570 1136 HB2 HIS 132 2HB HIS 132 17.967 17.278 4.540 1137 HB3 HIS 132 3HB HIS 132 17.038 15.829 4.892 1138 HD1 HIS 132 HD1 HIS 132 14.817 15.682 3.797 1139 HD2 HIS 132 HD2 HIS 132 16.260 19.573 3.852 1140 HE1 HIS 132 HE1 HIS 132 13.232 17.007 2.378 1141 HE2 HIS 132 HE2 HIS 132 13.980 19.383 2.665 1142 H HIS 133 H HIS 133 15.200 18.834 7.352 1143 HA HIS 133 HA HIS 133 13.440 16.656 8.337 1144 HB2 HIS 133 2HB HIS 133 13.674 19.481 9.465 1145 HB3 HIS 133 3HB HIS 133 12.643 18.198 10.088 1146 HD1 HIS 133 HD1 HIS 133 13.621 16.881 11.983 1147 HD2 HIS 133 HD2 HIS 133 16.539 18.825 9.754 1148 HE1 HIS 133 HE1 HIS 133 15.791 16.447 13.169 1149 HE2 HIS 133 HE2 HIS 133 17.546 17.461 11.693 1150 H HIS 134 H HIS 134 13.192 20.154 7.498 1151 HA HIS 134 HA HIS 134 10.597 19.791 6.251 1152 HB2 HIS 134 2HB HIS 134 11.164 21.898 7.494 1153 HB3 HIS 134 3HB HIS 134 12.402 22.269 6.299 1154 HD1 HIS 134 HD1 HIS 134 8.714 22.399 6.882 1155 HD2 HIS 134 HD2 HIS 134 11.375 23.178 3.776 1156 HE1 HIS 134 HE1 HIS 134 7.388 23.628 5.136 1157 HE2 HIS 134 HE2 HIS 134 8.968 23.928 3.210 Start of MODEL 18 1 H1 MET 1 1H MET 1 2.759 11.476 13.405 2 H2 MET 1 2H MET 1 3.578 10.129 14.022 3 H3 MET 1 3H MET 1 1.951 10.001 13.589 4 HA MET 1 HA MET 1 2.452 10.328 11.299 5 HB2 MET 1 2HB MET 1 4.345 11.861 11.491 6 HB3 MET 1 3HB MET 1 5.311 10.653 12.323 7 HG2 MET 1 2HG MET 1 6.055 10.973 10.000 8 HG3 MET 1 3HG MET 1 5.468 9.328 10.259 9 HE1 MET 1 3HE MET 1 4.424 9.995 6.548 10 HE2 MET 1 1HE MET 1 5.290 8.923 7.648 11 HE3 MET 1 2HE MET 1 5.894 10.555 7.346 12 H LYS 2 H LYS 2 2.455 8.388 10.204 13 HA LYS 2 HA LYS 2 4.043 6.112 11.125 14 HB2 LYS 2 2HB LYS 2 1.892 5.993 12.417 15 HB3 LYS 2 3HB LYS 2 0.995 5.958 10.901 16 HG2 LYS 2 2HG LYS 2 1.931 3.777 10.333 17 HG3 LYS 2 3HG LYS 2 3.020 3.836 11.722 18 HD2 LYS 2 2HD LYS 2 -0.025 3.734 11.882 19 HD3 LYS 2 3HD LYS 2 1.052 2.359 12.132 20 HE2 LYS 2 2HE LYS 2 2.051 3.488 14.083 21 HE3 LYS 2 3HE LYS 2 1.001 4.880 13.828 22 HZ1 LYS 2 3HZ LYS 2 0.103 2.140 14.485 23 HZ2 LYS 2 1HZ LYS 2 -0.896 3.482 14.258 24 HZ3 LYS 2 2HZ LYS 2 0.181 3.444 15.554 25 H ILE 3 H ILE 3 4.768 5.017 9.373 26 HA ILE 3 HA ILE 3 3.992 5.981 6.711 27 HB ILE 3 HB ILE 3 6.323 4.230 7.615 28 HG12 ILE 3 2HG1 ILE 3 6.283 7.169 6.786 29 HG13 ILE 3 3HG1 ILE 3 6.478 6.576 8.432 30 HG21 ILE 3 1HG2 ILE 3 5.814 5.436 4.869 31 HG22 ILE 3 2HG2 ILE 3 5.683 3.725 5.280 32 HG23 ILE 3 3HG2 ILE 3 7.250 4.528 5.350 33 HD11 ILE 3 3HD1 ILE 3 8.598 5.512 7.770 34 HD12 ILE 3 1HD1 ILE 3 8.596 7.258 7.528 35 HD13 ILE 3 2HD1 ILE 3 8.407 6.182 6.146 36 H LEU 4 H LEU 4 2.577 4.817 5.556 37 HA LEU 4 HA LEU 4 2.475 1.861 5.833 38 HB2 LEU 4 2HB LEU 4 0.305 3.871 5.187 39 HB3 LEU 4 3HB LEU 4 0.169 2.227 4.588 40 HG LEU 4 HG LEU 4 0.289 1.404 6.965 41 HD11 LEU 4 1HD1 LEU 4 1.407 3.260 8.049 42 HD12 LEU 4 2HD1 LEU 4 -0.155 2.981 8.811 43 HD13 LEU 4 3HD1 LEU 4 0.054 4.331 7.694 44 HD21 LEU 4 3HD2 LEU 4 -2.028 1.925 7.475 45 HD22 LEU 4 1HD2 LEU 4 -1.831 1.629 5.750 46 HD23 LEU 4 2HD2 LEU 4 -2.002 3.283 6.350 47 H ILE 5 H ILE 5 2.795 0.650 4.011 48 HA ILE 5 HA ILE 5 2.593 1.987 1.375 49 HB ILE 5 HB ILE 5 4.349 -0.432 2.025 50 HG12 ILE 5 2HG1 ILE 5 5.118 2.459 1.408 51 HG13 ILE 5 3HG1 ILE 5 5.422 1.584 2.903 52 HG21 ILE 5 1HG2 ILE 5 3.992 1.054 -0.609 53 HG22 ILE 5 2HG2 ILE 5 3.387 -0.563 -0.248 54 HG23 ILE 5 3HG2 ILE 5 5.124 -0.272 -0.328 55 HD11 ILE 5 3HD1 ILE 5 6.987 0.112 1.699 56 HD12 ILE 5 1HD1 ILE 5 7.451 1.812 1.619 57 HD13 ILE 5 2HD1 ILE 5 6.704 1.038 0.221 58 H LEU 6 H LEU 6 0.667 1.443 0.592 59 HA LEU 6 HA LEU 6 -0.673 -1.060 1.270 60 HB2 LEU 6 2HB LEU 6 -1.609 1.269 -0.453 61 HB3 LEU 6 3HB LEU 6 -2.587 -0.115 0.013 62 HG LEU 6 HG LEU 6 -1.535 2.071 1.812 63 HD11 LEU 6 1HD1 LEU 6 -3.500 2.707 0.519 64 HD12 LEU 6 2HD1 LEU 6 -3.901 2.563 2.227 65 HD13 LEU 6 3HD1 LEU 6 -4.374 1.285 1.100 66 HD21 LEU 6 3HD2 LEU 6 -2.638 0.964 3.689 67 HD22 LEU 6 1HD2 LEU 6 -1.359 -0.045 3.019 68 HD23 LEU 6 2HD2 LEU 6 -3.052 -0.410 2.658 69 H ILE 7 H ILE 7 -0.423 -2.768 0.050 70 HA ILE 7 HA ILE 7 0.358 -2.546 -2.798 71 HB ILE 7 HB ILE 7 0.756 -4.842 -0.831 72 HG12 ILE 7 2HG1 ILE 7 2.356 -2.989 -0.505 73 HG13 ILE 7 3HG1 ILE 7 3.178 -4.404 -1.148 74 HG21 ILE 7 1HG2 ILE 7 0.256 -5.786 -3.043 75 HG22 ILE 7 2HG2 ILE 7 1.962 -6.024 -2.660 76 HG23 ILE 7 3HG2 ILE 7 1.482 -4.754 -3.785 77 HD11 ILE 7 3HD1 ILE 7 3.995 -2.368 -2.158 78 HD12 ILE 7 1HD1 ILE 7 2.377 -1.953 -2.717 79 HD13 ILE 7 2HD1 ILE 7 3.204 -3.372 -3.373 80 H ASN 8 H ASN 8 -1.333 -2.737 -4.067 81 HA ASN 8 HA ASN 8 -3.254 -4.947 -3.630 82 HB2 ASN 8 2HB ASN 8 -4.439 -2.811 -3.561 83 HB3 ASN 8 3HB ASN 8 -3.671 -2.279 -5.050 84 HD21 ASN 8 1HD2 ASN 8 -5.899 -4.620 -3.688 85 HD22 ASN 8 2HD2 ASN 8 -6.784 -4.916 -5.144 86 H THR 9 H THR 9 -2.157 -6.515 -4.723 87 HA THR 9 HA THR 9 -2.165 -6.193 -7.647 88 HB THR 9 HB THR 9 0.191 -6.282 -7.105 89 HG1 THR 9 HG1 THR 9 -0.270 -7.437 -8.947 90 HG21 THR 9 3HG2 THR 9 0.143 -7.327 -4.906 91 HG22 THR 9 1HG2 THR 9 1.245 -8.184 -5.987 92 HG23 THR 9 2HG2 THR 9 -0.347 -8.861 -5.636 93 H ASN 10 H ASN 10 -2.929 -7.906 -8.809 94 HA ASN 10 HA ASN 10 -4.801 -9.656 -7.485 95 HB2 ASN 10 2HB ASN 10 -5.224 -8.778 -9.738 96 HB3 ASN 10 3HB ASN 10 -3.800 -9.600 -10.358 97 HD21 ASN 10 1HD2 ASN 10 -5.164 -10.571 -11.929 98 HD22 ASN 10 2HD2 ASN 10 -6.183 -11.911 -11.534 99 H ASN 11 H ASN 11 -1.438 -9.907 -8.243 100 HA ASN 11 HA ASN 11 -1.325 -12.839 -8.046 101 HB2 ASN 11 2HB ASN 11 0.873 -10.772 -8.511 102 HB3 ASN 11 3HB ASN 11 1.119 -12.518 -8.511 103 HD21 ASN 11 1HD2 ASN 11 1.499 -10.492 -10.608 104 HD22 ASN 11 2HD2 ASN 11 0.589 -11.053 -11.957 105 H ASP 12 H ASP 12 -1.689 -13.422 -5.958 106 HA ASP 12 HA ASP 12 -0.791 -12.106 -3.616 107 HB2 ASP 12 2HB ASP 12 -1.471 -15.065 -3.914 108 HB3 ASP 12 3HB ASP 12 -1.434 -14.152 -2.407 109 H GLU 13 H GLU 13 0.692 -14.439 -5.732 110 HA GLU 13 HA GLU 13 2.869 -15.253 -4.079 111 HB2 GLU 13 2HB GLU 13 2.433 -15.404 -7.091 112 HB3 GLU 13 3HB GLU 13 3.873 -16.040 -6.306 113 HG2 GLU 13 2HG GLU 13 2.263 -17.832 -6.764 114 HG3 GLU 13 3HG GLU 13 2.528 -17.638 -5.033 115 H LEU 14 H LEU 14 2.406 -12.630 -6.428 116 HA LEU 14 HA LEU 14 5.059 -11.657 -6.523 117 HB2 LEU 14 2HB LEU 14 3.409 -10.913 -8.144 118 HB3 LEU 14 3HB LEU 14 2.396 -10.242 -6.880 119 HG LEU 14 HG LEU 14 4.105 -8.489 -6.423 120 HD11 LEU 14 1HD1 LEU 14 6.021 -8.169 -7.930 121 HD12 LEU 14 2HD1 LEU 14 5.652 -9.699 -8.728 122 HD13 LEU 14 3HD1 LEU 14 6.130 -9.680 -7.029 123 HD21 LEU 14 3HD2 LEU 14 2.301 -7.985 -7.988 124 HD22 LEU 14 1HD2 LEU 14 3.256 -8.617 -9.333 125 HD23 LEU 14 2HD2 LEU 14 3.786 -7.169 -8.472 126 H ILE 15 H ILE 15 2.367 -11.065 -4.293 127 HA ILE 15 HA ILE 15 3.476 -8.986 -2.747 128 HB ILE 15 HB ILE 15 1.553 -11.147 -1.768 129 HG12 ILE 15 2HG1 ILE 15 0.915 -8.434 -3.008 130 HG13 ILE 15 3HG1 ILE 15 0.754 -9.980 -3.827 131 HG21 ILE 15 1HG2 ILE 15 2.559 -9.856 0.081 132 HG22 ILE 15 2HG2 ILE 15 0.846 -9.479 -0.082 133 HG23 ILE 15 3HG2 ILE 15 2.057 -8.345 -0.682 134 HD11 ILE 15 3HD1 ILE 15 -0.974 -10.620 -2.166 135 HD12 ILE 15 1HD1 ILE 15 -1.393 -9.214 -3.147 136 HD13 ILE 15 2HD1 ILE 15 -0.856 -8.994 -1.485 137 H LYS 16 H LYS 16 3.801 -12.520 -2.525 138 HA LYS 16 HA LYS 16 5.077 -12.802 -0.057 139 HB2 LYS 16 2HB LYS 16 5.594 -14.431 -2.582 140 HB3 LYS 16 3HB LYS 16 6.017 -14.919 -0.939 141 HG2 LYS 16 2HG LYS 16 3.592 -14.878 -0.347 142 HG3 LYS 16 3HG LYS 16 3.218 -14.510 -2.036 143 HD2 LYS 16 2HD LYS 16 4.239 -16.666 -2.731 144 HD3 LYS 16 3HD LYS 16 4.640 -17.024 -1.047 145 HE2 LYS 16 2HE LYS 16 2.194 -16.961 -0.515 146 HE3 LYS 16 3HE LYS 16 1.859 -16.748 -2.234 147 HZ1 LYS 16 3HZ LYS 16 3.291 -19.072 -1.074 148 HZ2 LYS 16 1HZ LYS 16 2.796 -18.878 -2.677 149 HZ3 LYS 16 2HZ LYS 16 1.644 -19.048 -1.455 150 H LYS 17 H LYS 17 6.393 -11.839 -3.176 151 HA LYS 17 HA LYS 17 9.164 -11.820 -2.381 152 HB2 LYS 17 2HB LYS 17 7.833 -10.490 -4.776 153 HB3 LYS 17 3HB LYS 17 9.559 -10.800 -4.577 154 HG2 LYS 17 2HG LYS 17 9.081 -13.253 -4.559 155 HG3 LYS 17 3HG LYS 17 7.376 -12.898 -4.843 156 HD2 LYS 17 2HD LYS 17 8.457 -13.533 -6.935 157 HD3 LYS 17 3HD LYS 17 7.970 -11.837 -7.005 158 HE2 LYS 17 2HE LYS 17 10.246 -12.275 -7.963 159 HE3 LYS 17 3HE LYS 17 10.261 -11.111 -6.640 160 HZ1 LYS 17 3HZ LYS 17 12.063 -12.691 -6.452 161 HZ2 LYS 17 1HZ LYS 17 10.974 -13.985 -6.416 162 HZ3 LYS 17 2HZ LYS 17 10.998 -12.860 -5.154 163 H ILE 18 H ILE 18 6.587 -9.388 -2.818 164 HA ILE 18 HA ILE 18 8.036 -7.015 -2.359 165 HB ILE 18 HB ILE 18 5.085 -7.636 -1.872 166 HG12 ILE 18 2HG1 ILE 18 6.462 -6.264 -4.231 167 HG13 ILE 18 3HG1 ILE 18 5.848 -7.910 -4.230 168 HG21 ILE 18 1HG2 ILE 18 4.671 -5.188 -1.917 169 HG22 ILE 18 2HG2 ILE 18 6.411 -4.900 -1.967 170 HG23 ILE 18 3HG2 ILE 18 5.683 -5.657 -0.548 171 HD11 ILE 18 3HD1 ILE 18 4.353 -6.466 -5.416 172 HD12 ILE 18 1HD1 ILE 18 4.211 -5.386 -4.028 173 HD13 ILE 18 2HD1 ILE 18 3.566 -7.028 -3.942 174 H LYS 19 H LYS 19 6.457 -9.231 -0.115 175 HA LYS 19 HA LYS 19 6.641 -7.859 2.320 176 HB2 LYS 19 2HB LYS 19 6.756 -10.857 1.746 177 HB3 LYS 19 3HB LYS 19 6.577 -10.173 3.360 178 HG2 LYS 19 2HG LYS 19 4.403 -9.297 2.848 179 HG3 LYS 19 3HG LYS 19 4.600 -9.609 1.132 180 HD2 LYS 19 2HD LYS 19 3.079 -11.252 2.146 181 HD3 LYS 19 3HD LYS 19 4.534 -12.031 1.530 182 HE2 LYS 19 2HE LYS 19 3.937 -13.012 3.668 183 HE3 LYS 19 3HE LYS 19 5.434 -12.103 3.861 184 HZ1 LYS 19 3HZ LYS 19 4.186 -10.311 4.852 185 HZ2 LYS 19 1HZ LYS 19 3.891 -11.748 5.686 186 HZ3 LYS 19 2HZ LYS 19 2.725 -11.134 4.620 187 H LYS 20 H LYS 20 8.845 -10.204 0.788 188 HA LYS 20 HA LYS 20 10.860 -10.071 2.788 189 HB2 LYS 20 2HB LYS 20 10.754 -11.222 -0.013 190 HB3 LYS 20 3HB LYS 20 12.255 -11.246 0.909 191 HG2 LYS 20 2HG LYS 20 9.650 -12.447 1.904 192 HG3 LYS 20 3HG LYS 20 10.897 -13.368 1.054 193 HD2 LYS 20 2HD LYS 20 12.505 -12.976 2.832 194 HD3 LYS 20 3HD LYS 20 11.436 -11.819 3.629 195 HE2 LYS 20 2HE LYS 20 10.829 -14.782 3.315 196 HE3 LYS 20 3HE LYS 20 11.509 -14.041 4.767 197 HZ1 LYS 20 3HZ LYS 20 9.524 -12.638 4.904 198 HZ2 LYS 20 1HZ LYS 20 9.143 -14.286 4.994 199 HZ3 LYS 20 2HZ LYS 20 8.869 -13.431 3.565 200 H GLU 21 H GLU 21 10.304 -8.147 -0.118 201 HA GLU 21 HA GLU 21 12.817 -6.860 -0.306 202 HB2 GLU 21 2HB GLU 21 10.041 -5.750 -0.964 203 HB3 GLU 21 3HB GLU 21 11.556 -5.001 -1.455 204 HG2 GLU 21 2HG GLU 21 10.562 -7.727 -2.338 205 HG3 GLU 21 3HG GLU 21 10.476 -6.251 -3.292 206 H VAL 22 H VAL 22 9.830 -5.888 1.408 207 HA VAL 22 HA VAL 22 11.014 -3.473 2.429 208 HB VAL 22 HB VAL 22 8.874 -3.091 3.573 209 HG11 VAL 22 1HG1 VAL 22 7.410 -2.971 1.598 210 HG12 VAL 22 2HG1 VAL 22 8.485 -4.070 0.728 211 HG13 VAL 22 3HG1 VAL 22 9.059 -2.470 1.207 212 HG21 VAL 22 3HG2 VAL 22 8.069 -5.863 2.620 213 HG22 VAL 22 1HG2 VAL 22 6.998 -4.688 3.391 214 HG23 VAL 22 2HG2 VAL 22 8.344 -5.380 4.296 215 H GLU 23 H GLU 23 10.614 -6.722 3.740 216 HA GLU 23 HA GLU 23 10.739 -6.100 6.504 217 HB2 GLU 23 2HB GLU 23 11.305 -8.674 4.992 218 HB3 GLU 23 3HB GLU 23 11.417 -8.579 6.749 219 HG2 GLU 23 2HG GLU 23 9.052 -7.919 6.895 220 HG3 GLU 23 3HG GLU 23 8.922 -7.939 5.139 221 H ASN 24 H ASN 24 13.278 -6.287 4.119 222 HA ASN 24 HA ASN 24 15.555 -6.532 5.747 223 HB2 ASN 24 2HB ASN 24 15.179 -4.925 3.178 224 HB3 ASN 24 3HB ASN 24 16.745 -5.148 3.958 225 HD21 ASN 24 1HD2 ASN 24 14.259 -6.644 2.066 226 HD22 ASN 24 2HD2 ASN 24 15.126 -8.096 1.728 227 H GLN 25 H GLN 25 13.555 -3.701 5.014 228 HA GLN 25 HA GLN 25 15.231 -1.904 6.622 229 HB2 GLN 25 2HB GLN 25 12.724 -1.292 4.997 230 HB3 GLN 25 3HB GLN 25 13.813 -0.107 5.723 231 HG2 GLN 25 2HG GLN 25 14.560 -2.061 3.529 232 HG3 GLN 25 3HG GLN 25 14.149 -0.367 3.288 233 HE21 GLN 25 1HE2 GLN 25 15.630 0.636 5.608 234 HE22 GLN 25 2HE2 GLN 25 17.304 0.482 5.205 235 H GLY 26 H GLY 26 12.967 -4.103 7.392 236 HA2 GLY 26 2HA GLY 26 12.160 -4.516 9.499 237 HA3 GLY 26 3HA GLY 26 12.592 -2.888 9.988 238 H TYR 27 H TYR 27 10.571 -3.390 7.159 239 HA TYR 27 HA TYR 27 8.307 -2.046 8.281 240 HB2 TYR 27 2HB TYR 27 8.650 -3.677 5.735 241 HB3 TYR 27 3HB TYR 27 7.099 -2.977 6.184 242 HD1 TYR 27 HD1 TYR 27 10.683 -1.965 5.611 243 HD2 TYR 27 HD2 TYR 27 6.567 -0.838 5.375 244 HE1 TYR 27 HE1 TYR 27 11.318 0.090 4.442 245 HE2 TYR 27 HE2 TYR 27 7.211 1.230 4.221 246 HH TYR 27 HH TYR 27 9.165 2.662 3.982 247 H GLN 28 H GLN 28 6.739 -2.891 9.540 248 HA GLN 28 HA GLN 28 6.428 -5.717 10.032 249 HB2 GLN 28 2HB GLN 28 5.985 -4.039 11.808 250 HB3 GLN 28 3HB GLN 28 4.714 -3.316 10.833 251 HG2 GLN 28 2HG GLN 28 3.481 -5.513 10.966 252 HG3 GLN 28 3HG GLN 28 4.708 -6.072 12.100 253 HE21 GLN 28 1HE2 GLN 28 3.416 -2.778 12.020 254 HE22 GLN 28 2HE2 GLN 28 2.588 -2.888 13.523 255 H VAL 29 H VAL 29 5.525 -6.902 8.400 256 HA VAL 29 HA VAL 29 3.511 -5.766 6.612 257 HB VAL 29 HB VAL 29 4.584 -8.623 6.594 258 HG11 VAL 29 1HG1 VAL 29 2.393 -8.249 5.444 259 HG12 VAL 29 2HG1 VAL 29 3.664 -8.742 4.335 260 HG13 VAL 29 3HG1 VAL 29 3.170 -7.051 4.403 261 HG21 VAL 29 3HG2 VAL 29 6.109 -7.944 4.774 262 HG22 VAL 29 1HG2 VAL 29 6.473 -7.061 6.260 263 HG23 VAL 29 2HG2 VAL 29 5.591 -6.266 4.953 264 H ARG 30 H ARG 30 1.421 -5.827 7.304 265 HA ARG 30 HA ARG 30 0.510 -8.352 8.552 266 HB2 ARG 30 2HB ARG 30 0.244 -6.053 9.862 267 HB3 ARG 30 3HB ARG 30 -1.145 -5.831 8.804 268 HG2 ARG 30 2HG ARG 30 -0.749 -8.295 10.542 269 HG3 ARG 30 3HG ARG 30 -1.630 -6.868 11.079 270 HD2 ARG 30 2HD ARG 30 -3.325 -7.198 9.375 271 HD3 ARG 30 3HD ARG 30 -2.395 -8.490 8.621 272 HE ARG 30 HE ARG 30 -2.721 -9.714 10.785 273 HH11 ARG 30 1HH1 ARG 30 -5.122 -7.374 9.713 274 HH12 ARG 30 2HH1 ARG 30 -6.415 -8.160 10.554 275 HH21 ARG 30 1HH2 ARG 30 -4.410 -10.723 11.844 276 HH22 ARG 30 2HH2 ARG 30 -6.011 -10.062 11.758 277 H ASP 31 H ASP 31 -0.762 -9.524 7.403 278 HA ASP 31 HA ASP 31 -1.473 -8.720 4.693 279 HB2 ASP 31 2HB ASP 31 -1.531 -11.468 6.042 280 HB3 ASP 31 3HB ASP 31 -1.705 -11.144 4.321 281 H VAL 32 H VAL 32 -3.447 -7.874 4.437 282 HA VAL 32 HA VAL 32 -5.629 -8.407 6.312 283 HB VAL 32 HB VAL 32 -5.379 -6.401 4.020 284 HG11 VAL 32 1HG1 VAL 32 -7.521 -5.415 4.779 285 HG12 VAL 32 2HG1 VAL 32 -7.716 -6.715 5.955 286 HG13 VAL 32 3HG1 VAL 32 -7.758 -7.077 4.228 287 HG21 VAL 32 3HG2 VAL 32 -5.414 -6.019 7.044 288 HG22 VAL 32 1HG2 VAL 32 -5.320 -4.723 5.846 289 HG23 VAL 32 2HG2 VAL 32 -3.997 -5.881 5.996 290 H ASN 33 H ASN 33 -6.980 -10.007 5.950 291 HA ASN 33 HA ASN 33 -7.196 -11.270 3.300 292 HB2 ASN 33 2HB ASN 33 -8.119 -12.282 6.019 293 HB3 ASN 33 3HB ASN 33 -8.078 -13.219 4.526 294 HD21 ASN 33 1HD2 ASN 33 -6.794 -13.847 7.003 295 HD22 ASN 33 2HD2 ASN 33 -5.095 -13.900 6.707 296 H ASP 34 H ASP 34 -9.021 -9.215 5.371 297 HA ASP 34 HA ASP 34 -11.424 -9.371 3.767 298 HB2 ASP 34 2HB ASP 34 -11.579 -11.402 5.309 299 HB3 ASP 34 3HB ASP 34 -11.593 -10.306 6.686 300 H SER 35 H SER 35 -13.169 -7.898 4.732 301 HA SER 35 HA SER 35 -12.253 -5.335 5.412 302 HB2 SER 35 2HB SER 35 -14.423 -5.735 4.319 303 HB3 SER 35 3HB SER 35 -15.025 -6.557 5.755 304 HG SER 35 HG SER 35 -15.035 -3.967 5.183 305 H ASP 36 H ASP 36 -13.236 -8.058 7.421 306 HA ASP 36 HA ASP 36 -13.274 -6.912 9.976 307 HB2 ASP 36 2HB ASP 36 -13.973 -9.223 9.645 308 HB3 ASP 36 3HB ASP 36 -12.397 -9.676 9.005 309 H GLU 37 H GLU 37 -10.582 -8.378 8.156 310 HA GLU 37 HA GLU 37 -8.537 -7.799 10.039 311 HB2 GLU 37 2HB GLU 37 -8.363 -8.466 7.072 312 HB3 GLU 37 3HB GLU 37 -6.994 -8.478 8.186 313 HG2 GLU 37 2HG GLU 37 -9.449 -10.229 8.560 314 HG3 GLU 37 3HG GLU 37 -8.034 -10.728 7.635 315 H LEU 38 H LEU 38 -10.022 -5.906 7.541 316 HA LEU 38 HA LEU 38 -8.042 -3.895 7.213 317 HB2 LEU 38 2HB LEU 38 -9.863 -4.167 5.597 318 HB3 LEU 38 3HB LEU 38 -11.058 -3.817 6.834 319 HG LEU 38 HG LEU 38 -10.138 -1.474 7.011 320 HD11 LEU 38 1HD1 LEU 38 -7.876 -1.884 6.235 321 HD12 LEU 38 2HD1 LEU 38 -8.647 -0.626 5.276 322 HD13 LEU 38 3HD1 LEU 38 -8.470 -2.252 4.612 323 HD21 LEU 38 3HD2 LEU 38 -11.098 -2.243 4.237 324 HD22 LEU 38 1HD2 LEU 38 -11.123 -0.619 4.935 325 HD23 LEU 38 2HD2 LEU 38 -12.120 -1.893 5.635 326 H LYS 39 H LYS 39 -11.083 -3.952 9.165 327 HA LYS 39 HA LYS 39 -10.571 -1.449 10.402 328 HB2 LYS 39 2HB LYS 39 -12.551 -1.916 11.802 329 HB3 LYS 39 3HB LYS 39 -12.849 -2.216 10.102 330 HG2 LYS 39 2HG LYS 39 -13.942 -4.013 11.071 331 HG3 LYS 39 3HG LYS 39 -12.369 -4.728 10.709 332 HD2 LYS 39 2HD LYS 39 -11.678 -4.291 13.092 333 HD3 LYS 39 3HD LYS 39 -13.303 -3.683 13.420 334 HE2 LYS 39 2HE LYS 39 -14.222 -5.907 12.845 335 HE3 LYS 39 3HE LYS 39 -12.581 -6.500 12.563 336 HZ1 LYS 39 3HZ LYS 39 -13.683 -5.497 15.128 337 HZ2 LYS 39 1HZ LYS 39 -12.072 -5.958 14.890 338 HZ3 LYS 39 2HZ LYS 39 -13.311 -7.100 14.750 339 H LYS 40 H LYS 40 -9.797 -4.749 11.295 340 HA LYS 40 HA LYS 40 -8.855 -4.505 13.900 341 HB2 LYS 40 2HB LYS 40 -7.947 -6.207 11.549 342 HB3 LYS 40 3HB LYS 40 -7.195 -6.371 13.132 343 HG2 LYS 40 2HG LYS 40 -10.200 -6.644 12.831 344 HG3 LYS 40 3HG LYS 40 -9.136 -8.000 12.449 345 HD2 LYS 40 2HD LYS 40 -9.200 -6.554 15.129 346 HD3 LYS 40 3HD LYS 40 -10.049 -8.065 14.778 347 HE2 LYS 40 2HE LYS 40 -7.032 -7.649 14.702 348 HE3 LYS 40 3HE LYS 40 -7.939 -8.538 15.928 349 HZ1 LYS 40 3HZ LYS 40 -6.923 -10.015 14.311 350 HZ2 LYS 40 1HZ LYS 40 -7.773 -9.277 13.050 351 HZ3 LYS 40 2HZ LYS 40 -8.602 -10.128 14.250 352 H GLU 41 H GLU 41 -7.246 -3.781 10.823 353 HA GLU 41 HA GLU 41 -4.799 -2.939 12.089 354 HB2 GLU 41 2HB GLU 41 -5.690 -2.851 9.189 355 HB3 GLU 41 3HB GLU 41 -4.097 -2.329 9.744 356 HG2 GLU 41 2HG GLU 41 -5.274 -5.114 9.827 357 HG3 GLU 41 3HG GLU 41 -3.853 -4.565 8.935 358 H MET 42 H MET 42 -7.735 -1.364 11.016 359 HA MET 42 HA MET 42 -6.699 1.295 10.990 360 HB2 MET 42 2HB MET 42 -9.559 0.388 11.534 361 HB3 MET 42 3HB MET 42 -9.056 2.047 11.214 362 HG2 MET 42 2HG MET 42 -9.009 -0.294 9.303 363 HG3 MET 42 3HG MET 42 -9.959 1.185 9.176 364 HE1 MET 42 3HE MET 42 -8.790 3.592 8.815 365 HE2 MET 42 1HE MET 42 -7.124 3.813 8.283 366 HE3 MET 42 2HE MET 42 -7.467 3.373 9.956 367 H LYS 43 H LYS 43 -7.833 -0.827 13.578 368 HA LYS 43 HA LYS 43 -7.640 1.021 15.735 369 HB2 LYS 43 2HB LYS 43 -7.617 -1.972 15.474 370 HB3 LYS 43 3HB LYS 43 -6.936 -1.325 16.952 371 HG2 LYS 43 2HG LYS 43 -9.219 -1.925 17.361 372 HG3 LYS 43 3HG LYS 43 -9.078 -0.175 17.433 373 HD2 LYS 43 2HD LYS 43 -10.040 -1.549 14.900 374 HD3 LYS 43 3HD LYS 43 -11.151 -1.252 16.234 375 HE2 LYS 43 2HE LYS 43 -10.672 1.178 16.068 376 HE3 LYS 43 3HE LYS 43 -9.590 0.865 14.713 377 HZ1 LYS 43 3HZ LYS 43 -11.750 1.590 13.983 378 HZ2 LYS 43 1HZ LYS 43 -12.492 0.301 14.781 379 HZ3 LYS 43 2HZ LYS 43 -11.463 0.004 13.472 380 H LYS 44 H LYS 44 -5.283 -1.119 14.205 381 HA LYS 44 HA LYS 44 -3.039 -0.520 15.823 382 HB2 LYS 44 2HB LYS 44 -3.160 -1.518 12.942 383 HB3 LYS 44 3HB LYS 44 -1.726 -1.566 13.959 384 HG2 LYS 44 2HG LYS 44 -4.205 -2.954 14.959 385 HG3 LYS 44 3HG LYS 44 -3.320 -3.711 13.635 386 HD2 LYS 44 2HD LYS 44 -2.068 -2.923 16.302 387 HD3 LYS 44 3HD LYS 44 -2.677 -4.538 15.920 388 HE2 LYS 44 2HE LYS 44 -0.426 -3.103 14.460 389 HE3 LYS 44 3HE LYS 44 -0.245 -4.436 15.601 390 HZ1 LYS 44 3HZ LYS 44 -1.707 -4.594 13.016 391 HZ2 LYS 44 1HZ LYS 44 -1.454 -5.868 14.099 392 HZ3 LYS 44 2HZ LYS 44 -0.144 -5.172 13.291 393 H LEU 45 H LEU 45 -4.501 1.228 13.158 394 HA LEU 45 HA LEU 45 -2.195 2.976 12.777 395 HB2 LEU 45 2HB LEU 45 -4.980 3.157 11.588 396 HB3 LEU 45 3HB LEU 45 -3.580 4.088 11.076 397 HG LEU 45 HG LEU 45 -3.975 1.094 10.763 398 HD11 LEU 45 1HD1 LEU 45 -3.920 1.519 8.366 399 HD12 LEU 45 2HD1 LEU 45 -3.807 3.257 8.663 400 HD13 LEU 45 3HD1 LEU 45 -5.250 2.364 9.154 401 HD21 LEU 45 3HD2 LEU 45 -1.530 2.724 10.015 402 HD22 LEU 45 1HD2 LEU 45 -1.816 1.031 9.600 403 HD23 LEU 45 2HD2 LEU 45 -1.633 1.500 11.285 404 H ALA 46 H ALA 46 -5.434 3.207 14.270 405 HA ALA 46 HA ALA 46 -5.184 6.118 14.489 406 HB1 ALA 46 3HB ALA 46 -7.197 5.208 13.452 407 HB2 ALA 46 1HB ALA 46 -7.590 6.126 14.908 408 HB3 ALA 46 2HB ALA 46 -7.604 4.360 14.944 409 H GLU 47 H GLU 47 -5.567 3.314 16.696 410 HA GLU 47 HA GLU 47 -6.190 4.683 19.073 411 HB2 GLU 47 2HB GLU 47 -4.588 2.104 18.767 412 HB3 GLU 47 3HB GLU 47 -5.204 2.714 20.304 413 HG2 GLU 47 2HG GLU 47 -7.522 2.506 19.475 414 HG3 GLU 47 3HG GLU 47 -6.917 1.917 17.924 415 H GLU 48 H GLU 48 -3.001 3.784 17.798 416 HA GLU 48 HA GLU 48 -1.945 6.256 19.026 417 HB2 GLU 48 2HB GLU 48 0.358 4.878 19.049 418 HB3 GLU 48 3HB GLU 48 -0.761 4.813 20.396 419 HG2 GLU 48 2HG GLU 48 0.145 2.597 19.887 420 HG3 GLU 48 3HG GLU 48 -1.604 2.635 19.656 421 H LYS 49 H LYS 49 -0.754 7.492 17.665 422 HA LYS 49 HA LYS 49 -0.632 6.698 14.805 423 HB2 LYS 49 2HB LYS 49 -2.120 8.606 15.487 424 HB3 LYS 49 3HB LYS 49 -0.719 9.442 16.137 425 HG2 LYS 49 2HG LYS 49 0.220 9.614 13.835 426 HG3 LYS 49 3HG LYS 49 -1.213 8.792 13.206 427 HD2 LYS 49 2HD LYS 49 -1.302 11.300 12.967 428 HD3 LYS 49 3HD LYS 49 -2.653 10.633 13.889 429 HE2 LYS 49 2HE LYS 49 -1.495 11.270 16.005 430 HE3 LYS 49 3HE LYS 49 -0.169 11.947 15.063 431 HZ1 LYS 49 3HZ LYS 49 -1.759 13.602 15.863 432 HZ2 LYS 49 1HZ LYS 49 -2.976 12.879 14.941 433 HZ3 LYS 49 2HZ LYS 49 -1.646 13.588 14.177 434 H ASN 50 H ASN 50 1.253 6.110 17.053 435 HA ASN 50 HA ASN 50 3.594 7.713 16.971 436 HB2 ASN 50 2HB ASN 50 2.943 6.297 18.899 437 HB3 ASN 50 3HB ASN 50 3.142 4.845 17.930 438 HD21 ASN 50 1HD2 ASN 50 5.378 7.634 17.991 439 HD22 ASN 50 2HD2 ASN 50 6.689 6.750 18.685 440 H PHE 51 H PHE 51 5.734 7.053 16.146 441 HA PHE 51 HA PHE 51 5.570 6.489 13.402 442 HB2 PHE 51 2HB PHE 51 7.297 7.981 14.197 443 HB3 PHE 51 3HB PHE 51 8.007 6.717 15.199 444 HD1 PHE 51 HD2 PHE 51 7.186 7.478 11.612 445 HD2 PHE 51 HD1 PHE 51 9.805 5.423 14.323 446 HE1 PHE 51 HE2 PHE 51 8.563 6.710 9.735 447 HE2 PHE 51 HE1 PHE 51 11.159 4.665 12.422 448 HZ PHE 51 HZ PHE 51 10.534 5.302 10.136 449 H GLU 52 H GLU 52 5.702 4.722 12.247 450 HA GLU 52 HA GLU 52 7.456 2.552 12.704 451 HB2 GLU 52 2HB GLU 52 5.663 1.881 14.306 452 HB3 GLU 52 3HB GLU 52 4.478 1.929 13.006 453 HG2 GLU 52 2HG GLU 52 5.637 0.075 11.860 454 HG3 GLU 52 3HG GLU 52 6.873 0.048 13.118 455 H LYS 53 H LYS 53 7.744 1.388 10.815 456 HA LYS 53 HA LYS 53 6.323 2.193 8.379 457 HB2 LYS 53 2HB LYS 53 8.622 0.218 8.735 458 HB3 LYS 53 3HB LYS 53 8.026 0.853 7.206 459 HG2 LYS 53 2HG LYS 53 8.855 3.086 7.782 460 HG3 LYS 53 3HG LYS 53 9.389 2.498 9.365 461 HD2 LYS 53 2HD LYS 53 10.882 0.843 8.148 462 HD3 LYS 53 3HD LYS 53 10.446 1.646 6.637 463 HE2 LYS 53 2HE LYS 53 12.607 2.439 7.418 464 HE3 LYS 53 3HE LYS 53 11.432 3.753 7.514 465 HZ1 LYS 53 3HZ LYS 53 11.226 3.378 9.869 466 HZ2 LYS 53 1HZ LYS 53 12.858 3.586 9.485 467 HZ3 LYS 53 2HZ LYS 53 12.250 2.038 9.796 468 H ILE 54 H ILE 54 4.559 1.006 7.765 469 HA ILE 54 HA ILE 54 4.344 -1.859 8.477 470 HB ILE 54 HB ILE 54 2.001 0.108 8.377 471 HG12 ILE 54 2HG1 ILE 54 3.282 -1.221 10.812 472 HG13 ILE 54 3HG1 ILE 54 3.339 0.496 10.427 473 HG21 ILE 54 1HG2 ILE 54 2.037 -2.836 9.142 474 HG22 ILE 54 2HG2 ILE 54 1.372 -2.168 7.651 475 HG23 ILE 54 3HG2 ILE 54 0.622 -1.780 9.201 476 HD11 ILE 54 3HD1 ILE 54 0.885 0.615 10.730 477 HD12 ILE 54 1HD1 ILE 54 1.739 0.086 12.181 478 HD13 ILE 54 2HD1 ILE 54 0.877 -1.091 11.189 479 H LEU 55 H LEU 55 4.324 -3.074 6.638 480 HA LEU 55 HA LEU 55 3.242 -2.032 4.116 481 HB2 LEU 55 2HB LEU 55 5.322 -3.487 4.144 482 HB3 LEU 55 3HB LEU 55 4.332 -4.816 4.725 483 HG LEU 55 HG LEU 55 2.902 -4.434 2.544 484 HD11 LEU 55 1HD1 LEU 55 4.151 -3.494 0.645 485 HD12 LEU 55 2HD1 LEU 55 5.429 -2.976 1.746 486 HD13 LEU 55 3HD1 LEU 55 3.802 -2.303 1.895 487 HD21 LEU 55 3HD2 LEU 55 4.280 -5.920 1.210 488 HD22 LEU 55 1HD2 LEU 55 4.301 -6.433 2.896 489 HD23 LEU 55 2HD2 LEU 55 5.689 -5.583 2.218 490 H ILE 56 H ILE 56 1.040 -2.104 3.984 491 HA ILE 56 HA ILE 56 -0.430 -4.438 5.081 492 HB ILE 56 HB ILE 56 -1.431 -1.686 4.238 493 HG12 ILE 56 2HG1 ILE 56 -0.388 -1.787 6.514 494 HG13 ILE 56 3HG1 ILE 56 -2.103 -1.403 6.588 495 HG21 ILE 56 1HG2 ILE 56 -3.076 -4.096 5.087 496 HG22 ILE 56 2HG2 ILE 56 -3.105 -3.298 3.515 497 HG23 ILE 56 3HG2 ILE 56 -3.710 -2.454 4.940 498 HD11 ILE 56 3HD1 ILE 56 -2.592 -3.719 7.236 499 HD12 ILE 56 1HD1 ILE 56 -1.459 -2.942 8.341 500 HD13 ILE 56 2HD1 ILE 56 -0.867 -4.100 7.153 501 H LYS 57 H LYS 57 -0.997 -5.964 3.652 502 HA LYS 57 HA LYS 57 -1.187 -5.269 0.776 503 HB2 LYS 57 2HB LYS 57 -0.462 -7.426 0.198 504 HB3 LYS 57 3HB LYS 57 0.549 -7.009 1.565 505 HG2 LYS 57 2HG LYS 57 0.030 -9.103 2.293 506 HG3 LYS 57 3HG LYS 57 -1.461 -8.359 2.863 507 HD2 LYS 57 2HD LYS 57 -2.629 -9.067 0.802 508 HD3 LYS 57 3HD LYS 57 -1.128 -9.719 0.154 509 HE2 LYS 57 2HE LYS 57 -1.082 -11.346 2.058 510 HE3 LYS 57 3HE LYS 57 -2.672 -10.755 2.543 511 HZ1 LYS 57 3HZ LYS 57 -3.494 -11.438 0.328 512 HZ2 LYS 57 1HZ LYS 57 -2.904 -12.737 1.240 513 HZ3 LYS 57 2HZ LYS 57 -1.972 -12.096 -0.013 514 H SER 58 H SER 58 -2.927 -6.007 -0.384 515 HA SER 58 HA SER 58 -4.937 -7.751 0.518 516 HB2 SER 58 2HB SER 58 -5.707 -5.888 1.913 517 HB3 SER 58 3HB SER 58 -5.697 -4.796 0.536 518 HG SER 58 HG SER 58 -7.621 -5.473 0.069 519 H ASN 59 H ASN 59 -5.497 -8.723 -1.292 520 HA ASN 59 HA ASN 59 -4.961 -7.783 -3.918 521 HB2 ASN 59 2HB ASN 59 -6.107 -9.840 -4.664 522 HB3 ASN 59 3HB ASN 59 -5.019 -10.193 -3.330 523 HD21 ASN 59 1HD2 ASN 59 -7.328 -11.721 -4.261 524 HD22 ASN 59 2HD2 ASN 59 -8.398 -11.855 -2.911 525 H ASP 60 H ASP 60 -7.710 -7.499 -1.808 526 HA ASP 60 HA ASP 60 -9.601 -6.590 -3.822 527 HB2 ASP 60 2HB ASP 60 -10.268 -7.871 -1.741 528 HB3 ASP 60 3HB ASP 60 -9.766 -6.496 -0.769 529 H LYS 61 H LYS 61 -9.481 -4.518 -4.620 530 HA LYS 61 HA LYS 61 -7.657 -2.591 -3.470 531 HB2 LYS 61 2HB LYS 61 -8.183 -1.181 -5.415 532 HB3 LYS 61 3HB LYS 61 -7.791 -2.822 -5.909 533 HG2 LYS 61 2HG LYS 61 -10.122 -3.316 -6.371 534 HG3 LYS 61 3HG LYS 61 -10.638 -1.786 -5.659 535 HD2 LYS 61 2HD LYS 61 -10.695 -1.657 -8.110 536 HD3 LYS 61 3HD LYS 61 -9.491 -0.543 -7.460 537 HE2 LYS 61 2HE LYS 61 -8.569 -1.628 -9.419 538 HE3 LYS 61 3HE LYS 61 -7.714 -2.238 -8.003 539 HZ1 LYS 61 3HZ LYS 61 -9.091 -4.224 -8.089 540 HZ2 LYS 61 1HZ LYS 61 -8.263 -4.000 -9.546 541 HZ3 LYS 61 2HZ LYS 61 -9.911 -3.627 -9.445 542 H GLN 62 H GLN 62 -11.059 -3.146 -3.138 543 HA GLN 62 HA GLN 62 -11.871 -0.405 -2.799 544 HB2 GLN 62 2HB GLN 62 -13.355 -2.938 -1.985 545 HB3 GLN 62 3HB GLN 62 -14.045 -1.319 -2.053 546 HG2 GLN 62 2HG GLN 62 -13.054 -2.955 -4.407 547 HG3 GLN 62 3HG GLN 62 -14.733 -2.638 -3.993 548 HE21 GLN 62 1HE2 GLN 62 -15.551 -0.513 -4.320 549 HE22 GLN 62 2HE2 GLN 62 -14.797 0.580 -5.426 550 H LEU 63 H LEU 63 -10.858 -3.033 -0.663 551 HA LEU 63 HA LEU 63 -11.416 -1.919 1.850 552 HB2 LEU 63 2HB LEU 63 -9.055 -3.680 1.068 553 HB3 LEU 63 3HB LEU 63 -9.534 -3.334 2.724 554 HG LEU 63 HG LEU 63 -11.110 -4.934 0.675 555 HD11 LEU 63 1HD1 LEU 63 -9.804 -5.802 3.269 556 HD12 LEU 63 2HD1 LEU 63 -9.248 -6.173 1.634 557 HD13 LEU 63 3HD1 LEU 63 -10.783 -6.821 2.205 558 HD21 LEU 63 3HD2 LEU 63 -12.777 -5.332 2.449 559 HD22 LEU 63 1HD2 LEU 63 -12.684 -3.630 2.002 560 HD23 LEU 63 2HD2 LEU 63 -11.935 -4.190 3.501 561 H LEU 64 H LEU 64 -8.726 -1.332 -0.360 562 HA LEU 64 HA LEU 64 -7.091 0.195 1.428 563 HB2 LEU 64 2HB LEU 64 -7.084 -0.043 -1.603 564 HB3 LEU 64 3HB LEU 64 -5.945 0.966 -0.726 565 HG LEU 64 HG LEU 64 -5.117 -1.097 0.485 566 HD11 LEU 64 1HD1 LEU 64 -6.826 -2.592 -1.507 567 HD12 LEU 64 2HD1 LEU 64 -7.031 -2.563 0.246 568 HD13 LEU 64 3HD1 LEU 64 -5.601 -3.313 -0.461 569 HD21 LEU 64 3HD2 LEU 64 -4.865 -1.142 -2.524 570 HD22 LEU 64 1HD2 LEU 64 -3.794 -1.970 -1.386 571 HD23 LEU 64 2HD2 LEU 64 -3.880 -0.211 -1.393 572 H LYS 65 H LYS 65 -9.636 1.005 -0.935 573 HA LYS 65 HA LYS 65 -9.414 3.811 -0.974 574 HB2 LYS 65 2HB LYS 65 -12.007 2.196 -1.121 575 HB3 LYS 65 3HB LYS 65 -11.754 3.834 -1.723 576 HG2 LYS 65 2HG LYS 65 -10.158 2.961 -3.384 577 HG3 LYS 65 3HG LYS 65 -10.436 1.326 -2.791 578 HD2 LYS 65 2HD LYS 65 -11.726 1.597 -4.795 579 HD3 LYS 65 3HD LYS 65 -12.858 1.574 -3.446 580 HE2 LYS 65 2HE LYS 65 -11.870 4.169 -4.669 581 HE3 LYS 65 3HE LYS 65 -13.261 3.300 -5.310 582 HZ1 LYS 65 3HZ LYS 65 -13.959 5.014 -3.806 583 HZ2 LYS 65 1HZ LYS 65 -13.009 4.384 -2.557 584 HZ3 LYS 65 2HZ LYS 65 -14.327 3.504 -3.145 585 H GLU 66 H GLU 66 -11.491 1.701 0.949 586 HA GLU 66 HA GLU 66 -12.716 3.691 2.548 587 HB2 GLU 66 2HB GLU 66 -12.482 0.687 3.015 588 HB3 GLU 66 3HB GLU 66 -13.662 1.765 3.772 589 HG2 GLU 66 2HG GLU 66 -14.707 2.216 1.615 590 HG3 GLU 66 3HG GLU 66 -13.459 1.304 0.776 591 H MET 67 H MET 67 -9.788 1.832 2.903 592 HA MET 67 HA MET 67 -9.199 2.291 5.636 593 HB2 MET 67 2HB MET 67 -8.013 0.649 4.123 594 HB3 MET 67 3HB MET 67 -7.234 2.003 3.318 595 HG2 MET 67 2HG MET 67 -6.272 2.622 5.610 596 HG3 MET 67 3HG MET 67 -6.837 1.043 6.157 597 HE1 MET 67 3HE MET 67 -4.789 -1.217 3.531 598 HE2 MET 67 1HE MET 67 -6.381 -0.509 3.265 599 HE3 MET 67 2HE MET 67 -6.006 -1.293 4.803 600 H LEU 68 H LEU 68 -8.246 3.973 2.634 601 HA LEU 68 HA LEU 68 -6.693 6.019 3.808 602 HB2 LEU 68 2HB LEU 68 -8.025 5.829 1.083 603 HB3 LEU 68 3HB LEU 68 -6.938 7.138 1.530 604 HG LEU 68 HG LEU 68 -6.146 4.194 1.454 605 HD11 LEU 68 1HD1 LEU 68 -6.599 5.000 -0.804 606 HD12 LEU 68 2HD1 LEU 68 -4.875 4.727 -0.564 607 HD13 LEU 68 3HD1 LEU 68 -5.516 6.374 -0.554 608 HD21 LEU 68 3HD2 LEU 68 -4.444 6.675 1.844 609 HD22 LEU 68 1HD2 LEU 68 -3.846 5.022 1.682 610 HD23 LEU 68 2HD2 LEU 68 -4.830 5.466 3.074 611 H GLU 69 H GLU 69 -10.137 5.800 3.075 612 HA GLU 69 HA GLU 69 -10.868 8.502 3.398 613 HB2 GLU 69 2HB GLU 69 -12.487 5.982 3.953 614 HB3 GLU 69 3HB GLU 69 -13.169 7.607 3.886 615 HG2 GLU 69 2HG GLU 69 -11.824 6.149 1.584 616 HG3 GLU 69 3HG GLU 69 -13.558 6.366 1.798 617 H LEU 70 H LEU 70 -10.303 5.934 5.747 618 HA LEU 70 HA LEU 70 -11.063 7.582 8.035 619 HB2 LEU 70 2HB LEU 70 -9.732 4.857 7.926 620 HB3 LEU 70 3HB LEU 70 -10.411 5.612 9.362 621 HG LEU 70 HG LEU 70 -11.981 4.671 6.923 622 HD11 LEU 70 1HD1 LEU 70 -11.889 3.502 9.718 623 HD12 LEU 70 2HD1 LEU 70 -11.149 2.809 8.272 624 HD13 LEU 70 3HD1 LEU 70 -12.901 2.946 8.381 625 HD21 LEU 70 3HD2 LEU 70 -13.033 5.895 9.500 626 HD22 LEU 70 1HD2 LEU 70 -14.014 5.201 8.205 627 HD23 LEU 70 2HD2 LEU 70 -13.052 6.645 7.902 628 H ILE 71 H ILE 71 -8.140 6.648 6.310 629 HA ILE 71 HA ILE 71 -6.191 7.427 8.242 630 HB ILE 71 HB ILE 71 -6.047 6.918 5.249 631 HG12 ILE 71 2HG1 ILE 71 -4.864 5.440 7.643 632 HG13 ILE 71 3HG1 ILE 71 -6.256 4.932 6.692 633 HG21 ILE 71 1HG2 ILE 71 -3.663 7.737 6.943 634 HG22 ILE 71 2HG2 ILE 71 -4.378 8.677 5.632 635 HG23 ILE 71 3HG2 ILE 71 -3.584 7.142 5.282 636 HD11 ILE 71 3HD1 ILE 71 -4.771 4.665 4.731 637 HD12 ILE 71 1HD1 ILE 71 -4.335 3.630 6.090 638 HD13 ILE 71 2HD1 ILE 71 -3.391 5.079 5.754 639 H SER 72 H SER 72 -8.032 9.220 5.844 640 HA SER 72 HA SER 72 -6.479 11.531 5.542 641 HB2 SER 72 2HB SER 72 -8.597 12.633 4.845 642 HB3 SER 72 3HB SER 72 -8.415 11.035 4.116 643 HG SER 72 HG SER 72 -10.306 10.662 4.944 644 H LYS 73 H LYS 73 -8.410 10.490 8.230 645 HA LYS 73 HA LYS 73 -8.647 12.963 9.641 646 HB2 LYS 73 2HB LYS 73 -8.668 10.108 10.716 647 HB3 LYS 73 3HB LYS 73 -9.272 11.535 11.558 648 HG2 LYS 73 2HG LYS 73 -11.032 11.798 9.839 649 HG3 LYS 73 3HG LYS 73 -10.423 10.364 8.999 650 HD2 LYS 73 2HD LYS 73 -10.939 8.981 10.991 651 HD3 LYS 73 3HD LYS 73 -11.534 10.411 11.837 652 HE2 LYS 73 2HE LYS 73 -13.306 10.648 10.100 653 HE3 LYS 73 3HE LYS 73 -12.731 9.159 9.344 654 HZ1 LYS 73 3HZ LYS 73 -13.771 9.388 12.118 655 HZ2 LYS 73 1HZ LYS 73 -13.263 7.966 11.356 656 HZ3 LYS 73 2HZ LYS 73 -14.631 8.783 10.791 657 H LEU 74 H LEU 74 -6.304 10.296 9.640 658 HA LEU 74 HA LEU 74 -4.723 11.266 11.855 659 HB2 LEU 74 2HB LEU 74 -4.147 9.087 9.808 660 HB3 LEU 74 3HB LEU 74 -3.215 9.368 11.272 661 HG LEU 74 HG LEU 74 -6.147 8.522 11.225 662 HD11 LEU 74 1HD1 LEU 74 -4.708 6.724 10.392 663 HD12 LEU 74 2HD1 LEU 74 -5.391 6.323 11.966 664 HD13 LEU 74 3HD1 LEU 74 -3.704 6.835 11.841 665 HD21 LEU 74 3HD2 LEU 74 -5.857 8.121 13.644 666 HD22 LEU 74 1HD2 LEU 74 -5.616 9.816 13.230 667 HD23 LEU 74 2HD2 LEU 74 -4.223 8.785 13.566 668 H GLY 75 H GLY 75 -4.405 11.271 8.318 669 HA2 GLY 75 2HA GLY 75 -3.296 12.628 6.871 670 HA3 GLY 75 3HA GLY 75 -3.007 13.724 8.209 671 H TYR 76 H TYR 76 -1.751 10.862 6.496 672 HA TYR 76 HA TYR 76 0.961 11.819 6.906 673 HB2 TYR 76 2HB TYR 76 1.804 9.537 7.694 674 HB3 TYR 76 3HB TYR 76 0.933 10.489 8.877 675 HD1 TYR 76 HD2 TYR 76 0.050 7.858 6.285 676 HD2 TYR 76 HD1 TYR 76 -0.439 9.242 10.304 677 HE1 TYR 76 HE2 TYR 76 -1.336 5.899 6.796 678 HE2 TYR 76 HE1 TYR 76 -1.814 7.273 10.807 679 HH TYR 76 HH TYR 76 -2.051 4.587 8.698 680 H LYS 77 H LYS 77 2.581 10.341 5.787 681 HA LYS 77 HA LYS 77 1.860 10.069 3.039 682 HB2 LYS 77 2HB LYS 77 4.376 9.347 4.576 683 HB3 LYS 77 3HB LYS 77 4.234 9.115 2.838 684 HG2 LYS 77 2HG LYS 77 3.901 11.803 4.197 685 HG3 LYS 77 3HG LYS 77 5.438 11.205 3.569 686 HD2 LYS 77 2HD LYS 77 4.471 11.067 1.296 687 HD3 LYS 77 3HD LYS 77 2.916 11.647 1.909 688 HE2 LYS 77 2HE LYS 77 3.997 13.781 2.566 689 HE3 LYS 77 3HE LYS 77 5.534 13.196 1.923 690 HZ1 LYS 77 3HZ LYS 77 3.066 13.504 0.318 691 HZ2 LYS 77 1HZ LYS 77 4.608 13.136 -0.253 692 HZ3 LYS 77 2HZ LYS 77 4.291 14.660 0.402 693 H VAL 78 H VAL 78 0.596 8.455 2.440 694 HA VAL 78 HA VAL 78 1.280 5.665 3.117 695 HB VAL 78 HB VAL 78 -1.273 6.705 1.794 696 HG11 VAL 78 1HG1 VAL 78 -2.158 4.439 2.249 697 HG12 VAL 78 2HG1 VAL 78 -0.599 3.965 2.922 698 HG13 VAL 78 3HG1 VAL 78 -0.730 4.371 1.211 699 HG21 VAL 78 3HG2 VAL 78 -1.143 7.519 4.123 700 HG22 VAL 78 1HG2 VAL 78 -0.869 5.871 4.693 701 HG23 VAL 78 2HG2 VAL 78 -2.414 6.304 3.951 702 H PHE 79 H PHE 79 2.071 4.402 1.481 703 HA PHE 79 HA PHE 79 2.463 5.599 -1.196 704 HB2 PHE 79 2HB PHE 79 4.059 3.413 0.229 705 HB3 PHE 79 3HB PHE 79 4.436 4.101 -1.346 706 HD1 PHE 79 HD2 PHE 79 4.377 4.818 2.315 707 HD2 PHE 79 HD1 PHE 79 5.605 6.208 -1.537 708 HE1 PHE 79 HE2 PHE 79 5.776 6.536 3.371 709 HE2 PHE 79 HE1 PHE 79 7.000 7.914 -0.470 710 HZ PHE 79 HZ PHE 79 7.092 8.082 1.978 711 H LEU 80 H LEU 80 0.958 4.750 -2.562 712 HA LEU 80 HA LEU 80 -0.118 2.048 -2.126 713 HB2 LEU 80 2HB LEU 80 -1.818 3.770 -2.033 714 HB3 LEU 80 3HB LEU 80 -1.258 4.486 -3.531 715 HG LEU 80 HG LEU 80 -2.090 2.545 -4.824 716 HD11 LEU 80 1HD1 LEU 80 -3.404 0.763 -3.787 717 HD12 LEU 80 2HD1 LEU 80 -3.033 1.407 -2.185 718 HD13 LEU 80 3HD1 LEU 80 -1.740 0.770 -3.207 719 HD21 LEU 80 3HD2 LEU 80 -4.231 3.635 -2.975 720 HD22 LEU 80 1HD2 LEU 80 -4.499 2.856 -4.539 721 HD23 LEU 80 2HD2 LEU 80 -3.645 4.396 -4.456 722 H LEU 81 H LEU 81 -0.004 0.542 -3.708 723 HA LEU 81 HA LEU 81 1.117 1.228 -6.343 724 HB2 LEU 81 2HB LEU 81 2.913 0.330 -4.836 725 HB3 LEU 81 3HB LEU 81 1.983 -1.146 -4.651 726 HG LEU 81 HG LEU 81 2.225 -1.608 -7.094 727 HD11 LEU 81 1HD1 LEU 81 3.779 -0.288 -8.472 728 HD12 LEU 81 2HD1 LEU 81 3.964 0.877 -7.159 729 HD13 LEU 81 3HD1 LEU 81 2.396 0.669 -7.944 730 HD21 LEU 81 3HD2 LEU 81 3.831 -2.563 -5.518 731 HD22 LEU 81 1HD2 LEU 81 4.866 -1.142 -5.685 732 HD23 LEU 81 2HD2 LEU 81 4.593 -2.207 -7.065 733 H LEU 82 H LEU 82 0.097 0.241 -7.983 734 HA LEU 82 HA LEU 82 -2.028 -1.757 -7.418 735 HB2 LEU 82 2HB LEU 82 -2.007 0.513 -9.453 736 HB3 LEU 82 3HB LEU 82 -3.324 -0.624 -9.210 737 HG LEU 82 HG LEU 82 -2.369 1.410 -7.148 738 HD11 LEU 82 1HD1 LEU 82 -4.860 1.477 -8.867 739 HD12 LEU 82 2HD1 LEU 82 -3.444 2.520 -9.030 740 HD13 LEU 82 3HD1 LEU 82 -4.442 2.616 -7.582 741 HD21 LEU 82 3HD2 LEU 82 -4.742 -0.487 -7.059 742 HD22 LEU 82 1HD2 LEU 82 -4.378 0.772 -5.875 743 HD23 LEU 82 2HD2 LEU 82 -3.278 -0.587 -6.076 744 H ALA 83 H ALA 83 -1.560 -3.692 -8.428 745 HA ALA 83 HA ALA 83 0.023 -3.658 -10.935 746 HB1 ALA 83 3HB ALA 83 0.552 -5.509 -8.602 747 HB2 ALA 83 1HB ALA 83 1.549 -4.142 -9.068 748 HB3 ALA 83 2HB ALA 83 1.389 -5.526 -10.149 749 H ASP 84 H ASP 84 -1.347 -4.334 -12.372 750 HA ASP 84 HA ASP 84 -1.798 -7.042 -12.799 751 HB2 ASP 84 2HB ASP 84 -3.655 -6.777 -11.088 752 HB3 ASP 84 3HB ASP 84 -4.400 -5.571 -12.128 753 H GLN 85 H GLN 85 -3.244 -7.276 -14.876 754 HA GLN 85 HA GLN 85 -2.455 -5.240 -16.781 755 HB2 GLN 85 2HB GLN 85 -3.958 -7.850 -17.241 756 HB3 GLN 85 3HB GLN 85 -3.190 -6.857 -18.479 757 HG2 GLN 85 2HG GLN 85 -1.665 -8.201 -16.219 758 HG3 GLN 85 3HG GLN 85 -1.916 -8.940 -17.796 759 HE21 GLN 85 1HE2 GLN 85 0.351 -9.063 -18.028 760 HE22 GLN 85 2HE2 GLN 85 1.306 -7.690 -18.453 761 H ASP 86 H ASP 86 -5.092 -5.424 -14.728 762 HA ASP 86 HA ASP 86 -7.109 -4.386 -16.583 763 HB2 ASP 86 2HB ASP 86 -8.690 -4.567 -14.844 764 HB3 ASP 86 3HB ASP 86 -7.617 -5.920 -14.545 765 H GLU 87 H GLU 87 -4.913 -2.886 -16.738 766 HA GLU 87 HA GLU 87 -4.270 -1.016 -14.790 767 HB2 GLU 87 2HB GLU 87 -2.892 0.056 -16.511 768 HB3 GLU 87 3HB GLU 87 -2.731 -1.693 -16.597 769 HG2 GLU 87 2HG GLU 87 -4.097 -1.809 -18.570 770 HG3 GLU 87 3HG GLU 87 -4.584 -0.122 -18.413 771 H ASN 88 H ASN 88 -6.814 -0.889 -17.158 772 HA ASN 88 HA ASN 88 -7.203 1.891 -17.457 773 HB2 ASN 88 2HB ASN 88 -8.303 0.172 -18.892 774 HB3 ASN 88 3HB ASN 88 -9.288 -0.345 -17.528 775 HD21 ASN 88 1HD2 ASN 88 -10.977 1.057 -16.793 776 HD22 ASN 88 2HD2 ASN 88 -11.579 2.334 -17.785 777 H GLU 89 H GLU 89 -8.705 -0.442 -15.206 778 HA GLU 89 HA GLU 89 -10.224 1.444 -13.711 779 HB2 GLU 89 2HB GLU 89 -10.857 -0.920 -13.808 780 HB3 GLU 89 3HB GLU 89 -9.349 -1.392 -13.032 781 HG2 GLU 89 2HG GLU 89 -10.020 -0.373 -10.943 782 HG3 GLU 89 3HG GLU 89 -11.437 0.364 -11.694 783 H LEU 90 H LEU 90 -7.077 -0.151 -13.228 784 HA LEU 90 HA LEU 90 -6.413 0.922 -10.707 785 HB2 LEU 90 2HB LEU 90 -4.541 0.123 -12.968 786 HB3 LEU 90 3HB LEU 90 -4.069 0.341 -11.289 787 HG LEU 90 HG LEU 90 -5.917 -1.839 -12.349 788 HD11 LEU 90 1HD1 LEU 90 -4.094 -3.392 -11.831 789 HD12 LEU 90 2HD1 LEU 90 -3.059 -2.044 -11.348 790 HD13 LEU 90 3HD1 LEU 90 -3.593 -2.195 -13.025 791 HD21 LEU 90 3HD2 LEU 90 -5.815 -2.805 -10.099 792 HD22 LEU 90 1HD2 LEU 90 -6.536 -1.200 -10.063 793 HD23 LEU 90 2HD2 LEU 90 -4.872 -1.429 -9.526 794 H GLU 91 H GLU 91 -6.177 2.263 -13.945 795 HA GLU 91 HA GLU 91 -4.339 4.395 -13.417 796 HB2 GLU 91 2HB GLU 91 -4.717 3.471 -15.698 797 HB3 GLU 91 3HB GLU 91 -6.376 4.052 -15.664 798 HG2 GLU 91 2HG GLU 91 -4.971 5.503 -17.036 799 HG3 GLU 91 3HG GLU 91 -5.587 6.376 -15.632 800 H GLU 92 H GLU 92 -7.879 4.202 -13.765 801 HA GLU 92 HA GLU 92 -8.461 6.918 -13.191 802 HB2 GLU 92 2HB GLU 92 -10.182 4.421 -12.906 803 HB3 GLU 92 3HB GLU 92 -10.790 6.075 -12.821 804 HG2 GLU 92 2HG GLU 92 -10.075 6.476 -15.146 805 HG3 GLU 92 3HG GLU 92 -9.436 4.831 -15.239 806 H PHE 93 H PHE 93 -8.267 4.016 -11.193 807 HA PHE 93 HA PHE 93 -9.195 5.006 -8.740 808 HB2 PHE 93 2HB PHE 93 -8.988 2.605 -9.203 809 HB3 PHE 93 3HB PHE 93 -7.245 2.746 -9.358 810 HD1 PHE 93 HD1 PHE 93 -9.014 4.459 -6.574 811 HD2 PHE 93 HD2 PHE 93 -6.891 0.936 -7.750 812 HE1 PHE 93 HE1 PHE 93 -8.752 3.820 -4.227 813 HE2 PHE 93 HE2 PHE 93 -6.637 0.317 -5.388 814 HZ PHE 93 HZ PHE 93 -7.558 1.757 -3.627 815 H LYS 94 H LYS 94 -5.810 4.765 -9.994 816 HA LYS 94 HA LYS 94 -4.622 5.835 -7.664 817 HB2 LYS 94 2HB LYS 94 -2.535 6.023 -8.929 818 HB3 LYS 94 3HB LYS 94 -3.303 4.477 -9.197 819 HG2 LYS 94 2HG LYS 94 -2.462 5.018 -11.293 820 HG3 LYS 94 3HG LYS 94 -4.153 5.489 -11.418 821 HD2 LYS 94 2HD LYS 94 -2.647 7.148 -12.471 822 HD3 LYS 94 3HD LYS 94 -3.541 7.859 -11.128 823 HE2 LYS 94 2HE LYS 94 -1.553 7.677 -9.690 824 HE3 LYS 94 3HE LYS 94 -0.669 6.873 -10.990 825 HZ1 LYS 94 3HZ LYS 94 -1.751 9.633 -11.142 826 HZ2 LYS 94 1HZ LYS 94 -0.803 8.852 -12.305 827 HZ3 LYS 94 2HZ LYS 94 -0.144 9.240 -10.799 828 H ARG 95 H ARG 95 -6.118 7.387 -10.411 829 HA ARG 95 HA ARG 95 -4.986 9.983 -10.069 830 HB2 ARG 95 2HB ARG 95 -7.505 9.035 -11.498 831 HB3 ARG 95 3HB ARG 95 -6.983 10.723 -11.510 832 HG2 ARG 95 2HG ARG 95 -4.896 10.127 -12.594 833 HG3 ARG 95 3HG ARG 95 -5.272 8.412 -12.477 834 HD2 ARG 95 2HD ARG 95 -7.203 8.760 -14.011 835 HD3 ARG 95 3HD ARG 95 -6.743 10.464 -14.168 836 HE ARG 95 HE ARG 95 -4.509 8.849 -14.761 837 HH11 ARG 95 1HH1 ARG 95 -7.612 9.622 -16.211 838 HH12 ARG 95 2HH1 ARG 95 -7.058 9.333 -17.830 839 HH21 ARG 95 1HH2 ARG 95 -3.805 8.485 -16.859 840 HH22 ARG 95 2HH2 ARG 95 -4.893 8.689 -18.197 841 H LYS 96 H LYS 96 -7.876 8.413 -8.712 842 HA LYS 96 HA LYS 96 -8.977 10.691 -7.400 843 HB2 LYS 96 2HB LYS 96 -9.363 7.715 -7.120 844 HB3 LYS 96 3HB LYS 96 -9.930 8.721 -5.808 845 HG2 LYS 96 2HG LYS 96 -11.832 8.381 -7.098 846 HG3 LYS 96 3HG LYS 96 -11.304 9.993 -7.560 847 HD2 LYS 96 2HD LYS 96 -10.435 7.629 -9.237 848 HD3 LYS 96 3HD LYS 96 -12.091 8.205 -9.382 849 HE2 LYS 96 2HE LYS 96 -11.236 10.452 -9.989 850 HE3 LYS 96 3HE LYS 96 -9.584 9.840 -9.876 851 HZ1 LYS 96 3HZ LYS 96 -11.672 8.880 -11.750 852 HZ2 LYS 96 1HZ LYS 96 -10.097 8.277 -11.647 853 HZ3 LYS 96 2HZ LYS 96 -10.366 9.869 -12.149 854 H ILE 97 H ILE 97 -6.704 8.192 -6.402 855 HA ILE 97 HA ILE 97 -6.511 8.917 -3.645 856 HB ILE 97 HB ILE 97 -4.654 7.221 -5.379 857 HG12 ILE 97 2HG1 ILE 97 -6.884 6.270 -5.449 858 HG13 ILE 97 3HG1 ILE 97 -5.929 5.265 -4.368 859 HG21 ILE 97 1HG2 ILE 97 -4.864 7.320 -2.354 860 HG22 ILE 97 2HG2 ILE 97 -3.502 7.874 -3.328 861 HG23 ILE 97 3HG2 ILE 97 -3.900 6.157 -3.269 862 HD11 ILE 97 3HD1 ILE 97 -6.996 6.429 -2.438 863 HD12 ILE 97 1HD1 ILE 97 -8.129 5.558 -3.472 864 HD13 ILE 97 2HD1 ILE 97 -8.009 7.311 -3.586 865 H GLU 98 H GLU 98 -4.608 9.590 -6.510 866 HA GLU 98 HA GLU 98 -2.488 11.095 -5.366 867 HB2 GLU 98 2HB GLU 98 -2.435 9.964 -7.578 868 HB3 GLU 98 3HB GLU 98 -3.632 11.094 -8.192 869 HG2 GLU 98 2HG GLU 98 -2.052 12.935 -8.021 870 HG3 GLU 98 3HG GLU 98 -0.866 11.890 -7.231 871 H SER 99 H SER 99 -5.706 11.907 -6.557 872 HA SER 99 HA SER 99 -5.470 14.741 -6.561 873 HB2 SER 99 2HB SER 99 -7.243 13.469 -7.792 874 HB3 SER 99 3HB SER 99 -7.996 13.059 -6.250 875 HG SER 99 HG SER 99 -8.271 15.328 -5.900 876 H GLN 100 H GLN 100 -5.967 12.402 -4.033 877 HA GLN 100 HA GLN 100 -6.684 14.439 -2.027 878 HB2 GLN 100 2HB GLN 100 -6.445 11.405 -1.805 879 HB3 GLN 100 3HB GLN 100 -6.959 12.475 -0.501 880 HG2 GLN 100 2HG GLN 100 -8.914 13.163 -1.860 881 HG3 GLN 100 3HG GLN 100 -8.411 12.050 -3.131 882 HE21 GLN 100 1HE2 GLN 100 -8.634 9.803 -2.779 883 HE22 GLN 100 2HE2 GLN 100 -9.644 9.178 -1.523 884 H GLY 101 H GLY 101 -3.895 13.616 -3.445 885 HA2 GLY 101 2HA GLY 101 -1.827 14.470 -2.898 886 HA3 GLY 101 3HA GLY 101 -2.345 14.718 -1.242 887 H TYR 102 H TYR 102 -3.124 11.564 -1.847 888 HA TYR 102 HA TYR 102 -0.938 10.503 -0.334 889 HB2 TYR 102 2HB TYR 102 -3.094 9.068 -1.941 890 HB3 TYR 102 3HB TYR 102 -1.944 8.253 -0.889 891 HD1 TYR 102 HD2 TYR 102 -2.033 8.670 1.604 892 HD2 TYR 102 HD1 TYR 102 -5.086 10.094 -1.030 893 HE1 TYR 102 HE2 TYR 102 -3.554 8.945 3.511 894 HE2 TYR 102 HE1 TYR 102 -6.604 10.369 0.880 895 HH TYR 102 HH TYR 102 -6.907 9.513 3.133 896 H GLU 103 H GLU 103 0.821 9.311 -0.992 897 HA GLU 103 HA GLU 103 1.839 9.605 -3.654 898 HB2 GLU 103 2HB GLU 103 3.304 9.541 -1.620 899 HB3 GLU 103 3HB GLU 103 2.844 7.864 -1.355 900 HG2 GLU 103 2HG GLU 103 5.065 8.029 -2.395 901 HG3 GLU 103 3HG GLU 103 3.921 7.205 -3.464 902 H VAL 104 H VAL 104 1.200 8.352 -5.304 903 HA VAL 104 HA VAL 104 0.740 5.482 -4.921 904 HB VAL 104 HB VAL 104 -1.496 6.490 -4.802 905 HG11 VAL 104 1HG1 VAL 104 -2.511 7.723 -6.674 906 HG12 VAL 104 2HG1 VAL 104 -0.985 7.665 -7.559 907 HG13 VAL 104 3HG1 VAL 104 -1.097 8.577 -6.050 908 HG21 VAL 104 3HG2 VAL 104 -2.624 5.173 -6.546 909 HG22 VAL 104 1HG2 VAL 104 -1.274 4.267 -5.857 910 HG23 VAL 104 2HG2 VAL 104 -1.109 5.027 -7.441 911 H ARG 105 H ARG 105 1.356 4.235 -6.609 912 HA ARG 105 HA ARG 105 1.882 5.386 -9.272 913 HB2 ARG 105 2HB ARG 105 3.715 3.519 -7.702 914 HB3 ARG 105 3HB ARG 105 3.822 3.684 -9.452 915 HG2 ARG 105 2HG ARG 105 4.160 5.999 -7.516 916 HG3 ARG 105 3HG ARG 105 5.499 5.037 -8.148 917 HD2 ARG 105 2HD ARG 105 3.564 6.690 -9.818 918 HD3 ARG 105 3HD ARG 105 5.219 7.147 -9.392 919 HE ARG 105 HE ARG 105 5.326 4.650 -10.649 920 HH11 ARG 105 1HH1 ARG 105 4.557 7.965 -11.564 921 HH12 ARG 105 2HH1 ARG 105 5.024 7.734 -13.213 922 HH21 ARG 105 1HH2 ARG 105 5.875 4.365 -12.827 923 HH22 ARG 105 2HH2 ARG 105 5.767 5.693 -13.933 924 H LYS 106 H LYS 106 1.529 3.922 -10.970 925 HA LYS 106 HA LYS 106 0.116 1.403 -10.312 926 HB2 LYS 106 2HB LYS 106 -1.357 3.132 -11.381 927 HB3 LYS 106 3HB LYS 106 -0.276 3.166 -12.772 928 HG2 LYS 106 2HG LYS 106 -0.765 0.633 -12.994 929 HG3 LYS 106 3HG LYS 106 -2.070 0.906 -11.845 930 HD2 LYS 106 2HD LYS 106 -3.159 1.045 -13.913 931 HD3 LYS 106 3HD LYS 106 -2.878 2.735 -13.506 932 HE2 LYS 106 2HE LYS 106 -1.093 1.109 -15.345 933 HE3 LYS 106 3HE LYS 106 -2.414 2.131 -15.904 934 HZ1 LYS 106 3HZ LYS 106 -0.298 3.243 -16.076 935 HZ2 LYS 106 1HZ LYS 106 -0.017 3.059 -14.420 936 HZ3 LYS 106 2HZ LYS 106 -1.287 4.036 -14.960 937 H VAL 107 H VAL 107 0.793 -0.385 -11.342 938 HA VAL 107 HA VAL 107 2.794 -0.306 -13.497 939 HB VAL 107 HB VAL 107 4.001 -2.248 -12.446 940 HG11 VAL 107 1HG1 VAL 107 3.933 0.208 -10.658 941 HG12 VAL 107 2HG1 VAL 107 4.902 0.023 -12.123 942 HG13 VAL 107 3HG1 VAL 107 5.227 -0.996 -10.718 943 HG21 VAL 107 3HG2 VAL 107 2.203 -3.121 -11.041 944 HG22 VAL 107 1HG2 VAL 107 2.243 -1.668 -10.039 945 HG23 VAL 107 2HG2 VAL 107 3.619 -2.769 -10.055 946 H THR 108 H THR 108 2.881 -2.353 -14.645 947 HA THR 108 HA THR 108 0.329 -3.866 -14.667 948 HB THR 108 HB THR 108 0.660 -4.062 -17.163 949 HG1 THR 108 HG1 THR 108 2.957 -3.570 -17.134 950 HG21 THR 108 3HG2 THR 108 0.461 -1.193 -16.158 951 HG22 THR 108 1HG2 THR 108 -0.883 -2.337 -16.285 952 HG23 THR 108 2HG2 THR 108 -0.065 -1.770 -17.741 953 H ASP 109 H ASP 109 3.620 -4.033 -14.155 954 HA ASP 109 HA ASP 109 3.795 -6.901 -14.880 955 HB2 ASP 109 2HB ASP 109 6.047 -4.839 -14.946 956 HB3 ASP 109 3HB ASP 109 6.229 -6.559 -15.281 957 H ASP 110 H ASP 110 5.248 -8.136 -13.575 958 HA ASP 110 HA ASP 110 4.637 -7.858 -10.806 959 HB2 ASP 110 2HB ASP 110 6.314 -9.870 -12.370 960 HB3 ASP 110 3HB ASP 110 6.046 -10.006 -10.635 961 H GLU 111 H GLU 111 7.730 -8.026 -12.549 962 HA GLU 111 HA GLU 111 9.362 -7.592 -10.236 963 HB2 GLU 111 2HB GLU 111 10.197 -7.353 -13.155 964 HB3 GLU 111 3HB GLU 111 11.238 -7.692 -11.766 965 HG2 GLU 111 2HG GLU 111 10.049 -9.828 -11.415 966 HG3 GLU 111 3HG GLU 111 9.040 -9.494 -12.819 967 H GLU 112 H GLU 112 7.981 -5.626 -12.685 968 HA GLU 112 HA GLU 112 9.267 -3.153 -12.255 969 HB2 GLU 112 2HB GLU 112 7.861 -3.604 -14.213 970 HB3 GLU 112 3HB GLU 112 6.444 -3.795 -13.185 971 HG2 GLU 112 2HG GLU 112 6.619 -1.397 -12.541 972 HG3 GLU 112 3HG GLU 112 8.002 -1.227 -13.622 973 H ALA 113 H ALA 113 6.360 -4.628 -10.774 974 HA ALA 113 HA ALA 113 5.615 -2.551 -9.043 975 HB1 ALA 113 3HB ALA 113 4.410 -4.275 -7.751 976 HB2 ALA 113 1HB ALA 113 5.310 -5.550 -8.581 977 HB3 ALA 113 2HB ALA 113 4.189 -4.529 -9.482 978 H LEU 114 H LEU 114 7.697 -5.377 -8.454 979 HA LEU 114 HA LEU 114 8.544 -4.983 -5.846 980 HB2 LEU 114 2HB LEU 114 10.121 -6.042 -8.228 981 HB3 LEU 114 3HB LEU 114 10.622 -6.239 -6.555 982 HG LEU 114 HG LEU 114 8.026 -7.370 -7.674 983 HD11 LEU 114 1HD1 LEU 114 10.632 -8.850 -7.220 984 HD12 LEU 114 2HD1 LEU 114 9.966 -8.407 -8.792 985 HD13 LEU 114 3HD1 LEU 114 9.099 -9.541 -7.762 986 HD21 LEU 114 3HD2 LEU 114 7.990 -8.710 -5.631 987 HD22 LEU 114 1HD2 LEU 114 8.019 -6.993 -5.242 988 HD23 LEU 114 2HD2 LEU 114 9.489 -7.956 -5.078 989 H LYS 115 H LYS 115 9.818 -3.571 -8.823 990 HA LYS 115 HA LYS 115 12.113 -2.281 -7.807 991 HB2 LYS 115 2HB LYS 115 11.805 -2.884 -10.146 992 HB3 LYS 115 3HB LYS 115 10.391 -1.847 -10.268 993 HG2 LYS 115 2HG LYS 115 11.838 0.148 -9.994 994 HG3 LYS 115 3HG LYS 115 13.257 -0.908 -9.898 995 HD2 LYS 115 2HD LYS 115 11.344 -0.810 -12.267 996 HD3 LYS 115 3HD LYS 115 12.872 0.075 -12.196 997 HE2 LYS 115 2HE LYS 115 14.126 -2.023 -12.096 998 HE3 LYS 115 3HE LYS 115 12.631 -2.954 -11.995 999 HZ1 LYS 115 3HZ LYS 115 13.574 -2.987 -14.210 1000 HZ2 LYS 115 1HZ LYS 115 13.461 -1.302 -14.322 1001 HZ3 LYS 115 2HZ LYS 115 12.060 -2.242 -14.208 1002 H ILE 116 H ILE 116 8.746 -1.200 -8.286 1003 HA ILE 116 HA ILE 116 9.239 1.552 -7.578 1004 HB ILE 116 HB ILE 116 6.558 0.108 -7.747 1005 HG12 ILE 116 2HG1 ILE 116 7.715 -0.094 -9.898 1006 HG13 ILE 116 3HG1 ILE 116 6.397 1.052 -10.059 1007 HG21 ILE 116 1HG2 ILE 116 6.386 2.237 -6.532 1008 HG22 ILE 116 2HG2 ILE 116 5.598 2.368 -8.106 1009 HG23 ILE 116 3HG2 ILE 116 7.194 3.079 -7.858 1010 HD11 ILE 116 3HD1 ILE 116 9.328 1.714 -9.818 1011 HD12 ILE 116 1HD1 ILE 116 8.019 2.897 -9.941 1012 HD13 ILE 116 2HD1 ILE 116 8.333 1.781 -11.269 1013 H VAL 117 H VAL 117 8.199 -1.351 -5.856 1014 HA VAL 117 HA VAL 117 7.437 -0.275 -3.374 1015 HB VAL 117 HB VAL 117 8.840 -2.920 -4.005 1016 HG11 VAL 117 1HG1 VAL 117 8.106 -3.720 -1.772 1017 HG12 VAL 117 2HG1 VAL 117 7.514 -2.101 -1.392 1018 HG13 VAL 117 3HG1 VAL 117 9.240 -2.373 -1.638 1019 HG21 VAL 117 3HG2 VAL 117 6.605 -2.683 -5.021 1020 HG22 VAL 117 1HG2 VAL 117 5.911 -2.327 -3.439 1021 HG23 VAL 117 2HG2 VAL 117 6.596 -3.923 -3.766 1022 H ARG 118 H ARG 118 10.631 -1.176 -4.649 1023 HA ARG 118 HA ARG 118 12.166 -0.601 -2.334 1024 HB2 ARG 118 2HB ARG 118 13.058 -0.685 -5.244 1025 HB3 ARG 118 3HB ARG 118 14.130 -0.718 -3.842 1026 HG2 ARG 118 2HG ARG 118 13.140 -2.866 -3.130 1027 HG3 ARG 118 3HG ARG 118 12.058 -2.828 -4.520 1028 HD2 ARG 118 2HD ARG 118 13.872 -4.308 -5.042 1029 HD3 ARG 118 3HD ARG 118 14.081 -2.844 -6.005 1030 HE ARG 118 HE ARG 118 15.823 -2.153 -4.498 1031 HH11 ARG 118 1HH1 ARG 118 14.864 -5.516 -4.150 1032 HH12 ARG 118 2HH1 ARG 118 16.353 -5.986 -3.400 1033 HH21 ARG 118 1HH2 ARG 118 17.781 -2.795 -3.527 1034 HH22 ARG 118 2HH2 ARG 118 18.008 -4.444 -3.044 1035 H GLU 119 H GLU 119 11.165 1.360 -5.105 1036 HA GLU 119 HA GLU 119 12.574 3.733 -4.505 1037 HB2 GLU 119 2HB GLU 119 9.973 3.223 -5.988 1038 HB3 GLU 119 3HB GLU 119 10.638 4.844 -5.817 1039 HG2 GLU 119 2HG GLU 119 12.079 2.517 -7.134 1040 HG3 GLU 119 3HG GLU 119 11.176 3.761 -8.001 1041 H PHE 120 H PHE 120 9.267 2.671 -3.622 1042 HA PHE 120 HA PHE 120 8.465 4.854 -2.075 1043 HB2 PHE 120 2HB PHE 120 7.663 1.921 -1.940 1044 HB3 PHE 120 3HB PHE 120 6.906 3.147 -0.928 1045 HD1 PHE 120 HD2 PHE 120 6.933 5.358 -3.190 1046 HD2 PHE 120 HD1 PHE 120 5.595 1.284 -3.042 1047 HE1 PHE 120 HE2 PHE 120 5.242 5.843 -4.904 1048 HE2 PHE 120 HE1 PHE 120 3.909 1.796 -4.748 1049 HZ PHE 120 HZ PHE 120 3.723 4.063 -5.674 1050 H MET 121 H MET 121 10.414 2.054 -1.213 1051 HA MET 121 HA MET 121 10.512 2.381 1.589 1052 HB2 MET 121 2HB MET 121 12.423 1.049 -0.374 1053 HB3 MET 121 3HB MET 121 12.634 0.960 1.373 1054 HG2 MET 121 2HG MET 121 10.726 -0.381 1.662 1055 HG3 MET 121 3HG MET 121 10.036 0.086 0.110 1056 HE1 MET 121 3HE MET 121 13.597 -2.835 0.505 1057 HE2 MET 121 1HE MET 121 12.749 -2.173 1.902 1058 HE3 MET 121 2HE MET 121 13.734 -1.117 0.881 1059 H GLN 122 H GLN 122 12.448 3.813 -1.035 1060 HA GLN 122 HA GLN 122 14.458 5.021 0.618 1061 HB2 GLN 122 2HB GLN 122 13.611 5.920 -2.171 1062 HB3 GLN 122 3HB GLN 122 15.138 6.277 -1.367 1063 HG2 GLN 122 2HG GLN 122 14.187 3.610 -2.429 1064 HG3 GLN 122 3HG GLN 122 15.518 4.587 -3.032 1065 HE21 GLN 122 1HE2 GLN 122 14.507 2.290 -0.635 1066 HE22 GLN 122 2HE2 GLN 122 16.064 2.017 0.066 1067 H LYS 123 H LYS 123 11.465 6.182 -0.888 1068 HA LYS 123 HA LYS 123 11.621 8.883 -0.041 1069 HB2 LYS 123 2HB LYS 123 9.330 7.170 -1.059 1070 HB3 LYS 123 3HB LYS 123 9.022 8.794 -0.461 1071 HG2 LYS 123 2HG LYS 123 9.194 8.838 -2.872 1072 HG3 LYS 123 3HG LYS 123 10.539 9.729 -2.158 1073 HD2 LYS 123 2HD LYS 123 12.051 7.836 -2.596 1074 HD3 LYS 123 3HD LYS 123 10.706 6.886 -3.229 1075 HE2 LYS 123 2HE LYS 123 10.432 8.517 -5.065 1076 HE3 LYS 123 3HE LYS 123 11.796 9.446 -4.435 1077 HZ1 LYS 123 3HZ LYS 123 13.228 7.565 -4.824 1078 HZ2 LYS 123 1HZ LYS 123 12.430 7.981 -6.253 1079 HZ3 LYS 123 2HZ LYS 123 11.929 6.633 -5.375 1080 H ALA 124 H ALA 124 10.254 5.984 1.394 1081 HA ALA 124 HA ALA 124 8.948 7.212 3.611 1082 HB1 ALA 124 3HB ALA 124 9.882 4.357 3.198 1083 HB2 ALA 124 1HB ALA 124 8.280 5.003 2.829 1084 HB3 ALA 124 2HB ALA 124 8.827 4.904 4.505 1085 H GLY 125 H GLY 125 12.172 5.813 3.085 1086 HA2 GLY 125 2HA GLY 125 13.156 5.852 5.725 1087 HA3 GLY 125 3HA GLY 125 14.129 5.894 4.266 1088 H SER 126 H SER 126 13.268 8.272 3.153 1089 HA SER 126 HA SER 126 14.801 10.186 4.598 1090 HB2 SER 126 2HB SER 126 14.144 11.731 2.697 1091 HB3 SER 126 3HB SER 126 14.917 10.232 2.198 1092 HG SER 126 HG SER 126 12.514 9.545 2.125 1093 H LEU 127 H LEU 127 11.401 9.405 4.686 1094 HA LEU 127 HA LEU 127 10.335 11.911 5.528 1095 HB2 LEU 127 2HB LEU 127 9.429 9.079 6.158 1096 HB3 LEU 127 3HB LEU 127 8.507 10.512 6.592 1097 HG LEU 127 HG LEU 127 9.175 9.683 3.748 1098 HD11 LEU 127 1HD1 LEU 127 6.822 9.056 3.555 1099 HD12 LEU 127 2HD1 LEU 127 6.574 9.408 5.267 1100 HD13 LEU 127 3HD1 LEU 127 7.647 8.092 4.779 1101 HD21 LEU 127 3HD2 LEU 127 8.915 12.113 3.974 1102 HD22 LEU 127 1HD2 LEU 127 7.357 11.890 4.776 1103 HD23 LEU 127 2HD2 LEU 127 7.560 11.419 3.087 1104 H GLU 128 H GLU 128 11.812 9.208 7.259 1105 HA GLU 128 HA GLU 128 11.265 9.918 9.932 1106 HB2 GLU 128 2HB GLU 128 13.862 8.575 9.082 1107 HB3 GLU 128 3HB GLU 128 12.939 8.330 10.563 1108 HG2 GLU 128 2HG GLU 128 11.258 7.069 9.352 1109 HG3 GLU 128 3HG GLU 128 12.040 7.433 7.808 1110 H HIS 129 H HIS 129 14.322 10.168 8.206 1111 HA HIS 129 HA HIS 129 15.234 12.374 9.933 1112 HB2 HIS 129 2HB HIS 129 17.545 11.592 9.109 1113 HB3 HIS 129 3HB HIS 129 16.697 10.506 10.193 1114 HD1 HIS 129 HD1 HIS 129 15.911 8.229 9.242 1115 HD2 HIS 129 HD2 HIS 129 17.984 10.557 6.493 1116 HE1 HIS 129 HE1 HIS 129 16.508 6.686 7.360 1117 HE2 HIS 129 HE2 HIS 129 17.568 8.168 5.629 1118 H HIS 130 H HIS 130 13.787 13.671 8.572 1119 HA HIS 130 HA HIS 130 14.372 13.976 5.773 1120 HB2 HIS 130 2HB HIS 130 12.555 15.745 5.833 1121 HB3 HIS 130 3HB HIS 130 12.072 14.122 6.286 1122 HD1 HIS 130 HD1 HIS 130 11.635 13.709 8.886 1123 HD2 HIS 130 HD2 HIS 130 11.998 17.687 7.727 1124 HE1 HIS 130 HE1 HIS 130 10.680 15.057 10.769 1125 HE2 HIS 130 HE2 HIS 130 11.005 17.459 10.090 1126 H HIS 131 H HIS 131 16.505 14.480 5.928 1127 HA HIS 131 HA HIS 131 17.246 17.182 5.560 1128 HB2 HIS 131 2HB HIS 131 18.082 15.923 8.204 1129 HB3 HIS 131 3HB HIS 131 19.183 17.026 7.404 1130 HD1 HIS 131 HD1 HIS 131 17.481 17.311 10.206 1131 HD2 HIS 131 HD2 HIS 131 16.998 19.399 6.647 1132 HE1 HIS 131 HE1 HIS 131 16.358 19.468 10.826 1133 HE2 HIS 131 HE2 HIS 131 16.149 20.741 8.667 1134 H HIS 132 H HIS 132 18.144 13.821 6.191 1135 HA HIS 132 HA HIS 132 20.562 14.031 4.474 1136 HB2 HIS 132 2HB HIS 132 19.991 12.182 6.839 1137 HB3 HIS 132 3HB HIS 132 21.391 12.018 5.784 1138 HD1 HIS 132 HD1 HIS 132 20.650 13.276 8.976 1139 HD2 HIS 132 HD2 HIS 132 22.786 14.789 5.750 1140 HE1 HIS 132 HE1 HIS 132 22.195 15.002 9.936 1141 HE2 HIS 132 HE2 HIS 132 23.597 15.761 7.992 1142 H HIS 133 H HIS 133 20.857 12.605 2.845 1143 HA HIS 133 HA HIS 133 18.824 10.504 2.262 1144 HB2 HIS 133 2HB HIS 133 20.095 12.535 0.381 1145 HB3 HIS 133 3HB HIS 133 19.451 11.018 -0.228 1146 HD1 HIS 133 HD1 HIS 133 17.740 12.340 -1.635 1147 HD2 HIS 133 HD2 HIS 133 17.320 12.862 2.459 1148 HE1 HIS 133 HE1 HIS 133 15.507 13.423 -1.317 1149 HE2 HIS 133 HE2 HIS 133 15.360 13.873 1.150 1150 H HIS 134 H HIS 134 19.661 8.740 0.854 1151 HA HIS 134 HA HIS 134 22.148 7.715 1.783 1152 HB2 HIS 134 2HB HIS 134 21.728 5.743 0.466 1153 HB3 HIS 134 3HB HIS 134 20.201 6.250 1.157 1154 HD1 HIS 134 HD1 HIS 134 18.280 6.630 -0.454 1155 HD2 HIS 134 HD2 HIS 134 21.917 6.127 -2.398 1156 HE1 HIS 134 HE1 HIS 134 17.721 6.353 -2.887 1157 HE2 HIS 134 HE2 HIS 134 19.920 5.844 -3.994 Start of MODEL 19 1 H1 MET 1 1H MET 1 3.957 9.159 14.108 2 H2 MET 1 2H MET 1 4.715 10.662 13.960 3 H3 MET 1 3H MET 1 5.639 9.247 14.024 4 HA MET 1 HA MET 1 3.719 9.918 11.888 5 HB2 MET 1 2HB MET 1 5.606 11.435 11.721 6 HB3 MET 1 3HB MET 1 6.758 10.128 11.986 7 HG2 MET 1 2HG MET 1 6.643 10.878 9.616 8 HG3 MET 1 3HG MET 1 6.256 9.167 9.824 9 HE1 MET 1 3HE MET 1 3.813 9.874 6.932 10 HE2 MET 1 1HE MET 1 5.015 8.780 7.614 11 HE3 MET 1 2HE MET 1 5.486 10.400 7.096 12 H LYS 2 H LYS 2 2.886 8.016 11.166 13 HA LYS 2 HA LYS 2 4.580 5.586 11.184 14 HB2 LYS 2 2HB LYS 2 2.331 5.587 12.420 15 HB3 LYS 2 3HB LYS 2 1.549 5.673 10.843 16 HG2 LYS 2 2HG LYS 2 2.752 3.548 10.209 17 HG3 LYS 2 3HG LYS 2 3.356 3.447 11.862 18 HD2 LYS 2 2HD LYS 2 0.466 3.281 10.942 19 HD3 LYS 2 3HD LYS 2 1.440 1.985 11.636 20 HE2 LYS 2 2HE LYS 2 0.467 4.476 13.065 21 HE3 LYS 2 3HE LYS 2 -0.129 2.833 13.288 22 HZ1 LYS 2 3HZ LYS 2 1.420 3.583 15.027 23 HZ2 LYS 2 1HZ LYS 2 2.656 3.674 13.880 24 HZ3 LYS 2 2HZ LYS 2 1.937 2.185 14.239 25 H ILE 3 H ILE 3 5.070 4.600 9.320 26 HA ILE 3 HA ILE 3 4.250 5.774 6.739 27 HB ILE 3 HB ILE 3 6.717 4.115 7.484 28 HG12 ILE 3 2HG1 ILE 3 6.496 7.091 6.799 29 HG13 ILE 3 3HG1 ILE 3 6.768 6.433 8.407 30 HG21 ILE 3 1HG2 ILE 3 7.545 4.590 5.200 31 HG22 ILE 3 2HG2 ILE 3 6.027 5.400 4.815 32 HG23 ILE 3 3HG2 ILE 3 6.039 3.671 5.159 33 HD11 ILE 3 3HD1 ILE 3 8.815 7.282 7.488 34 HD12 ILE 3 1HD1 ILE 3 8.652 6.255 6.065 35 HD13 ILE 3 2HD1 ILE 3 8.923 5.529 7.652 36 H LEU 4 H LEU 4 2.796 4.567 5.629 37 HA LEU 4 HA LEU 4 2.809 1.602 5.878 38 HB2 LEU 4 2HB LEU 4 0.531 3.541 5.311 39 HB3 LEU 4 3HB LEU 4 0.423 1.858 4.829 40 HG LEU 4 HG LEU 4 0.657 1.176 7.232 41 HD11 LEU 4 1HD1 LEU 4 0.314 2.826 9.014 42 HD12 LEU 4 2HD1 LEU 4 0.445 4.133 7.833 43 HD13 LEU 4 3HD1 LEU 4 1.828 3.087 8.151 44 HD21 LEU 4 3HD2 LEU 4 -1.671 3.030 6.628 45 HD22 LEU 4 1HD2 LEU 4 -1.631 1.787 7.883 46 HD23 LEU 4 2HD2 LEU 4 -1.547 1.324 6.188 47 H ILE 5 H ILE 5 3.202 0.446 4.052 48 HA ILE 5 HA ILE 5 2.894 1.777 1.418 49 HB ILE 5 HB ILE 5 4.671 -0.634 2.065 50 HG12 ILE 5 2HG1 ILE 5 5.415 2.241 1.323 51 HG13 ILE 5 3HG1 ILE 5 5.668 1.476 2.888 52 HG21 ILE 5 1HG2 ILE 5 4.262 0.815 -0.591 53 HG22 ILE 5 2HG2 ILE 5 3.687 -0.808 -0.200 54 HG23 ILE 5 3HG2 ILE 5 5.416 -0.489 -0.298 55 HD11 ILE 5 3HD1 ILE 5 7.037 0.742 0.303 56 HD12 ILE 5 1HD1 ILE 5 7.264 -0.079 1.852 57 HD13 ILE 5 2HD1 ILE 5 7.731 1.610 1.671 58 H LEU 6 H LEU 6 0.942 1.299 0.757 59 HA LEU 6 HA LEU 6 -0.412 -1.207 1.307 60 HB2 LEU 6 2HB LEU 6 -1.199 1.484 0.931 61 HB3 LEU 6 3HB LEU 6 -1.730 0.710 -0.545 62 HG LEU 6 HG LEU 6 -2.549 -0.023 2.285 63 HD11 LEU 6 1HD1 LEU 6 -4.774 0.760 1.622 64 HD12 LEU 6 2HD1 LEU 6 -4.163 1.212 0.029 65 HD13 LEU 6 3HD1 LEU 6 -3.575 2.045 1.472 66 HD21 LEU 6 3HD2 LEU 6 -3.414 -1.337 -0.314 67 HD22 LEU 6 1HD2 LEU 6 -4.107 -1.651 1.281 68 HD23 LEU 6 2HD2 LEU 6 -2.427 -2.068 0.955 69 H ILE 7 H ILE 7 -0.296 -2.900 -0.080 70 HA ILE 7 HA ILE 7 0.453 -2.485 -2.915 71 HB ILE 7 HB ILE 7 0.828 -4.984 -1.183 72 HG12 ILE 7 2HG1 ILE 7 2.446 -3.198 -0.612 73 HG13 ILE 7 3HG1 ILE 7 3.250 -4.563 -1.374 74 HG21 ILE 7 1HG2 ILE 7 2.057 -5.926 -3.121 75 HG22 ILE 7 2HG2 ILE 7 1.612 -4.517 -4.087 76 HG23 ILE 7 3HG2 ILE 7 0.362 -5.617 -3.501 77 HD11 ILE 7 3HD1 ILE 7 4.164 -2.449 -2.132 78 HD12 ILE 7 1HD1 ILE 7 2.576 -1.934 -2.700 79 HD13 ILE 7 2HD1 ILE 7 3.392 -3.297 -3.471 80 H ASN 8 H ASN 8 -1.312 -2.561 -4.126 81 HA ASN 8 HA ASN 8 -3.344 -4.679 -3.704 82 HB2 ASN 8 2HB ASN 8 -4.271 -2.392 -3.681 83 HB3 ASN 8 3HB ASN 8 -3.508 -2.032 -5.220 84 HD21 ASN 8 1HD2 ASN 8 -6.072 -3.832 -3.646 85 HD22 ASN 8 2HD2 ASN 8 -7.005 -4.120 -5.074 86 H THR 9 H THR 9 -2.444 -6.359 -4.779 87 HA THR 9 HA THR 9 -1.921 -6.021 -7.656 88 HB THR 9 HB THR 9 0.291 -6.227 -6.696 89 HG1 THR 9 HG1 THR 9 0.121 -7.309 -8.616 90 HG21 THR 9 3HG2 THR 9 1.025 -8.208 -5.450 91 HG22 THR 9 1HG2 THR 9 -0.629 -8.819 -5.427 92 HG23 THR 9 2HG2 THR 9 -0.225 -7.330 -4.565 93 H ASN 10 H ASN 10 -2.491 -7.677 -8.969 94 HA ASN 10 HA ASN 10 -4.614 -9.409 -8.115 95 HB2 ASN 10 2HB ASN 10 -4.473 -8.410 -10.397 96 HB3 ASN 10 3HB ASN 10 -3.047 -9.383 -10.733 97 HD21 ASN 10 1HD2 ASN 10 -4.075 -10.342 -12.513 98 HD22 ASN 10 2HD2 ASN 10 -5.321 -11.526 -12.340 99 H ASN 11 H ASN 11 -1.155 -9.751 -8.263 100 HA ASN 11 HA ASN 11 -1.184 -12.693 -8.478 101 HB2 ASN 11 2HB ASN 11 1.227 -10.829 -8.418 102 HB3 ASN 11 3HB ASN 11 1.202 -12.517 -8.916 103 HD21 ASN 11 1HD2 ASN 11 2.174 -10.242 -10.381 104 HD22 ASN 11 2HD2 ASN 11 1.238 -10.134 -11.827 105 H ASP 12 H ASP 12 -1.141 -13.881 -6.643 106 HA ASP 12 HA ASP 12 -0.435 -12.923 -4.041 107 HB2 ASP 12 2HB ASP 12 -0.795 -15.763 -5.097 108 HB3 ASP 12 3HB ASP 12 -0.523 -15.384 -3.398 109 H GLU 13 H GLU 13 1.263 -14.693 -6.561 110 HA GLU 13 HA GLU 13 3.576 -15.510 -5.237 111 HB2 GLU 13 2HB GLU 13 4.639 -15.532 -7.517 112 HB3 GLU 13 3HB GLU 13 3.061 -16.314 -7.475 113 HG2 GLU 13 2HG GLU 13 2.019 -14.318 -8.459 114 HG3 GLU 13 3HG GLU 13 3.575 -13.497 -8.460 115 H LEU 14 H LEU 14 2.823 -12.419 -6.807 116 HA LEU 14 HA LEU 14 5.350 -11.176 -6.527 117 HB2 LEU 14 2HB LEU 14 3.693 -10.426 -8.160 118 HB3 LEU 14 3HB LEU 14 2.563 -10.015 -6.881 119 HG LEU 14 HG LEU 14 4.042 -8.178 -6.139 120 HD11 LEU 14 1HD1 LEU 14 5.843 -8.886 -8.475 121 HD12 LEU 14 2HD1 LEU 14 6.231 -9.068 -6.761 122 HD13 LEU 14 3HD1 LEU 14 5.986 -7.462 -7.437 123 HD21 LEU 14 3HD2 LEU 14 3.408 -8.045 -9.100 124 HD22 LEU 14 1HD2 LEU 14 3.686 -6.669 -8.029 125 HD23 LEU 14 2HD2 LEU 14 2.289 -7.709 -7.777 126 H ILE 15 H ILE 15 2.420 -11.195 -4.499 127 HA ILE 15 HA ILE 15 3.054 -9.281 -2.576 128 HB ILE 15 HB ILE 15 1.491 -11.889 -2.220 129 HG12 ILE 15 2HG1 ILE 15 0.472 -9.054 -2.705 130 HG13 ILE 15 3HG1 ILE 15 0.646 -10.271 -3.959 131 HG21 ILE 15 1HG2 ILE 15 2.200 -11.059 -0.013 132 HG22 ILE 15 2HG2 ILE 15 0.461 -10.863 -0.218 133 HG23 ILE 15 3HG2 ILE 15 1.528 -9.466 -0.375 134 HD11 ILE 15 3HD1 ILE 15 -1.025 -11.655 -2.815 135 HD12 ILE 15 1HD1 ILE 15 -1.642 -10.074 -3.291 136 HD13 ILE 15 2HD1 ILE 15 -1.222 -10.383 -1.609 137 H LYS 16 H LYS 16 3.775 -12.762 -2.591 138 HA LYS 16 HA LYS 16 4.962 -12.986 -0.050 139 HB2 LYS 16 2HB LYS 16 5.522 -14.657 -2.536 140 HB3 LYS 16 3HB LYS 16 5.848 -15.146 -0.877 141 HG2 LYS 16 2HG LYS 16 3.092 -14.593 -2.016 142 HG3 LYS 16 3HG LYS 16 3.803 -16.193 -1.847 143 HD2 LYS 16 2HD LYS 16 3.208 -14.300 0.461 144 HD3 LYS 16 3HD LYS 16 2.178 -15.641 -0.041 145 HE2 LYS 16 2HE LYS 16 4.014 -17.227 0.454 146 HE3 LYS 16 3HE LYS 16 5.026 -15.882 0.982 147 HZ1 LYS 16 3HZ LYS 16 4.015 -16.982 2.864 148 HZ2 LYS 16 1HZ LYS 16 2.465 -16.736 2.231 149 HZ3 LYS 16 2HZ LYS 16 3.394 -15.416 2.725 150 H LYS 17 H LYS 17 6.271 -11.952 -3.112 151 HA LYS 17 HA LYS 17 9.066 -12.111 -2.357 152 HB2 LYS 17 2HB LYS 17 7.705 -10.854 -4.781 153 HB3 LYS 17 3HB LYS 17 9.439 -11.143 -4.615 154 HG2 LYS 17 2HG LYS 17 9.098 -13.552 -4.582 155 HG3 LYS 17 3HG LYS 17 7.347 -13.341 -4.540 156 HD2 LYS 17 2HD LYS 17 8.048 -13.976 -6.786 157 HD3 LYS 17 3HD LYS 17 7.419 -12.328 -6.804 158 HE2 LYS 17 2HE LYS 17 9.706 -11.438 -6.837 159 HE3 LYS 17 3HE LYS 17 10.357 -13.079 -6.735 160 HZ1 LYS 17 3HZ LYS 17 10.396 -12.315 -8.993 161 HZ2 LYS 17 1HZ LYS 17 8.744 -11.967 -8.962 162 HZ3 LYS 17 2HZ LYS 17 9.274 -13.565 -8.856 163 H ILE 18 H ILE 18 6.630 -9.545 -2.834 164 HA ILE 18 HA ILE 18 8.224 -7.286 -2.244 165 HB ILE 18 HB ILE 18 5.204 -7.703 -1.944 166 HG12 ILE 18 2HG1 ILE 18 6.857 -6.327 -4.117 167 HG13 ILE 18 3HG1 ILE 18 6.009 -7.858 -4.274 168 HG21 ILE 18 1HG2 ILE 18 6.722 -5.068 -1.776 169 HG22 ILE 18 2HG2 ILE 18 5.888 -5.870 -0.445 170 HG23 ILE 18 3HG2 ILE 18 4.965 -5.243 -1.808 171 HD11 ILE 18 3HD1 ILE 18 4.804 -6.113 -5.395 172 HD12 ILE 18 1HD1 ILE 18 4.749 -5.144 -3.923 173 HD13 ILE 18 2HD1 ILE 18 3.869 -6.671 -4.008 174 H LYS 19 H LYS 19 6.468 -9.576 -0.219 175 HA LYS 19 HA LYS 19 6.648 -8.340 2.280 176 HB2 LYS 19 2HB LYS 19 6.676 -11.288 1.521 177 HB3 LYS 19 3HB LYS 19 6.639 -10.738 3.194 178 HG2 LYS 19 2HG LYS 19 4.483 -9.607 2.777 179 HG3 LYS 19 3HG LYS 19 4.527 -10.152 1.102 180 HD2 LYS 19 2HD LYS 19 3.068 -11.651 2.262 181 HD3 LYS 19 3HD LYS 19 4.560 -12.537 1.965 182 HE2 LYS 19 2HE LYS 19 3.791 -11.229 4.599 183 HE3 LYS 19 3HE LYS 19 3.626 -12.939 4.228 184 HZ1 LYS 19 3HZ LYS 19 5.580 -12.637 5.505 185 HZ2 LYS 19 1HZ LYS 19 6.155 -11.410 4.495 186 HZ3 LYS 19 2HZ LYS 19 6.075 -12.998 3.934 187 H LYS 20 H LYS 20 8.928 -10.645 0.724 188 HA LYS 20 HA LYS 20 10.807 -10.522 2.873 189 HB2 LYS 20 2HB LYS 20 11.157 -11.603 0.043 190 HB3 LYS 20 3HB LYS 20 12.324 -11.809 1.347 191 HG2 LYS 20 2HG LYS 20 9.504 -12.909 1.243 192 HG3 LYS 20 3HG LYS 20 11.007 -13.831 1.152 193 HD2 LYS 20 2HD LYS 20 11.540 -13.272 3.473 194 HD3 LYS 20 3HD LYS 20 10.145 -12.197 3.573 195 HE2 LYS 20 2HE LYS 20 8.684 -14.231 3.157 196 HE3 LYS 20 3HE LYS 20 10.132 -15.220 3.365 197 HZ1 LYS 20 3HZ LYS 20 10.388 -14.387 5.583 198 HZ2 LYS 20 1HZ LYS 20 8.808 -14.956 5.416 199 HZ3 LYS 20 2HZ LYS 20 9.117 -13.294 5.391 200 H GLU 21 H GLU 21 10.401 -8.587 -0.031 201 HA GLU 21 HA GLU 21 12.863 -7.188 0.069 202 HB2 GLU 21 2HB GLU 21 10.105 -6.168 -0.757 203 HB3 GLU 21 3HB GLU 21 11.610 -5.302 -1.041 204 HG2 GLU 21 2HG GLU 21 10.780 -7.951 -2.245 205 HG3 GLU 21 3HG GLU 21 10.902 -6.403 -3.077 206 H VAL 22 H VAL 22 9.691 -6.431 1.561 207 HA VAL 22 HA VAL 22 10.633 -4.021 2.777 208 HB VAL 22 HB VAL 22 8.437 -3.756 3.743 209 HG11 VAL 22 1HG1 VAL 22 7.021 -3.844 1.738 210 HG12 VAL 22 2HG1 VAL 22 8.189 -4.905 0.949 211 HG13 VAL 22 3HG1 VAL 22 8.637 -3.253 1.363 212 HG21 VAL 22 3HG2 VAL 22 7.844 -6.627 2.947 213 HG22 VAL 22 1HG2 VAL 22 6.671 -5.481 3.599 214 HG23 VAL 22 2HG2 VAL 22 8.026 -6.013 4.591 215 H GLU 23 H GLU 23 10.366 -7.334 3.884 216 HA GLU 23 HA GLU 23 10.460 -6.909 6.689 217 HB2 GLU 23 2HB GLU 23 11.212 -9.295 4.948 218 HB3 GLU 23 3HB GLU 23 11.362 -9.343 6.702 219 HG2 GLU 23 2HG GLU 23 8.968 -9.032 6.983 220 HG3 GLU 23 3HG GLU 23 8.762 -8.752 5.255 221 H ASN 24 H ASN 24 13.008 -7.385 4.250 222 HA ASN 24 HA ASN 24 15.163 -7.025 6.154 223 HB2 ASN 24 2HB ASN 24 15.131 -7.205 3.115 224 HB3 ASN 24 3HB ASN 24 16.605 -6.885 4.021 225 HD21 ASN 24 1HD2 ASN 24 14.348 -9.304 3.071 226 HD22 ASN 24 2HD2 ASN 24 15.139 -10.646 3.808 227 H GLN 25 H GLN 25 13.084 -4.866 4.491 228 HA GLN 25 HA GLN 25 14.893 -2.567 4.741 229 HB2 GLN 25 2HB GLN 25 11.957 -2.594 3.911 230 HB3 GLN 25 3HB GLN 25 13.068 -1.236 3.772 231 HG2 GLN 25 2HG GLN 25 13.190 -3.832 2.231 232 HG3 GLN 25 3HG GLN 25 12.717 -2.268 1.600 233 HE21 GLN 25 1HE2 GLN 25 15.384 -4.280 2.573 234 HE22 GLN 25 2HE2 GLN 25 16.633 -3.290 1.912 235 H GLY 26 H GLY 26 12.670 -4.255 6.714 236 HA2 GLY 26 2HA GLY 26 12.506 -3.888 9.040 237 HA3 GLY 26 3HA GLY 26 12.892 -2.191 8.809 238 H TYR 27 H TYR 27 10.400 -4.042 7.084 239 HA TYR 27 HA TYR 27 8.260 -2.424 8.358 240 HB2 TYR 27 2HB TYR 27 8.314 -3.788 5.630 241 HB3 TYR 27 3HB TYR 27 6.860 -3.096 6.337 242 HD1 TYR 27 HD1 TYR 27 10.389 -2.076 5.519 243 HD2 TYR 27 HD2 TYR 27 6.274 -0.930 5.641 244 HE1 TYR 27 HE1 TYR 27 10.954 0.076 4.505 245 HE2 TYR 27 HE2 TYR 27 6.850 1.236 4.628 246 HH TYR 27 HH TYR 27 9.871 1.858 3.201 247 H GLN 28 H GLN 28 6.740 -3.483 9.510 248 HA GLN 28 HA GLN 28 6.616 -6.380 9.632 249 HB2 GLN 28 2HB GLN 28 4.969 -4.191 10.967 250 HB3 GLN 28 3HB GLN 28 4.603 -5.903 11.143 251 HG2 GLN 28 2HG GLN 28 5.821 -5.489 13.048 252 HG3 GLN 28 3HG GLN 28 7.059 -6.118 11.983 253 HE21 GLN 28 1HE2 GLN 28 7.369 -4.437 14.351 254 HE22 GLN 28 2HE2 GLN 28 8.185 -3.004 13.838 255 H VAL 29 H VAL 29 4.995 -7.640 8.728 256 HA VAL 29 HA VAL 29 3.538 -6.324 6.501 257 HB VAL 29 HB VAL 29 4.115 -9.316 6.811 258 HG11 VAL 29 1HG1 VAL 29 3.451 -9.435 4.424 259 HG12 VAL 29 2HG1 VAL 29 3.071 -7.713 4.434 260 HG13 VAL 29 3HG1 VAL 29 2.134 -8.830 5.428 261 HG21 VAL 29 3HG2 VAL 29 6.230 -8.073 6.545 262 HG22 VAL 29 1HG2 VAL 29 5.596 -7.267 5.106 263 HG23 VAL 29 2HG2 VAL 29 5.872 -9.012 5.095 264 H ARG 30 H ARG 30 1.455 -5.956 6.837 265 HA ARG 30 HA ARG 30 -0.213 -7.880 8.342 266 HB2 ARG 30 2HB ARG 30 -0.402 -5.646 9.274 267 HB3 ARG 30 3HB ARG 30 -0.596 -4.930 7.682 268 HG2 ARG 30 2HG ARG 30 -2.730 -4.889 8.733 269 HG3 ARG 30 3HG ARG 30 -2.802 -6.123 7.482 270 HD2 ARG 30 2HD ARG 30 -2.442 -6.639 10.452 271 HD3 ARG 30 3HD ARG 30 -3.956 -6.795 9.560 272 HE ARG 30 HE ARG 30 -2.910 -8.634 8.296 273 HH11 ARG 30 1HH1 ARG 30 -1.583 -7.813 11.459 274 HH12 ARG 30 2HH1 ARG 30 -0.893 -9.382 11.715 275 HH21 ARG 30 1HH2 ARG 30 -1.918 -10.667 8.616 276 HH22 ARG 30 2HH2 ARG 30 -1.084 -10.996 10.102 277 H ASP 31 H ASP 31 -1.020 -9.333 6.910 278 HA ASP 31 HA ASP 31 -2.033 -8.472 4.297 279 HB2 ASP 31 2HB ASP 31 -2.503 -10.859 3.905 280 HB3 ASP 31 3HB ASP 31 -0.835 -10.630 4.404 281 H VAL 32 H VAL 32 -3.967 -7.524 4.265 282 HA VAL 32 HA VAL 32 -6.014 -7.974 6.275 283 HB VAL 32 HB VAL 32 -6.339 -6.402 3.668 284 HG11 VAL 32 1HG1 VAL 32 -8.096 -5.182 4.887 285 HG12 VAL 32 2HG1 VAL 32 -7.808 -6.163 6.326 286 HG13 VAL 32 3HG1 VAL 32 -8.440 -6.912 4.858 287 HG21 VAL 32 3HG2 VAL 32 -5.704 -4.361 4.886 288 HG22 VAL 32 1HG2 VAL 32 -4.372 -5.519 4.853 289 HG23 VAL 32 2HG2 VAL 32 -5.329 -5.315 6.324 290 H ASN 33 H ASN 33 -7.111 -9.816 6.166 291 HA ASN 33 HA ASN 33 -7.636 -11.240 3.667 292 HB2 ASN 33 2HB ASN 33 -8.304 -11.917 6.577 293 HB3 ASN 33 3HB ASN 33 -8.667 -12.968 5.213 294 HD21 ASN 33 1HD2 ASN 33 -6.088 -11.602 7.160 295 HD22 ASN 33 2HD2 ASN 33 -4.874 -12.728 6.666 296 H ASP 34 H ASP 34 -9.323 -9.191 5.934 297 HA ASP 34 HA ASP 34 -11.909 -9.528 4.635 298 HB2 ASP 34 2HB ASP 34 -11.740 -11.490 6.155 299 HB3 ASP 34 3HB ASP 34 -11.415 -10.427 7.517 300 H SER 35 H SER 35 -13.603 -8.129 5.748 301 HA SER 35 HA SER 35 -12.695 -5.489 6.156 302 HB2 SER 35 2HB SER 35 -14.955 -6.115 5.296 303 HB3 SER 35 3HB SER 35 -15.410 -6.644 6.915 304 HG SER 35 HG SER 35 -14.793 -4.030 6.002 305 H ASP 36 H ASP 36 -13.430 -8.083 8.438 306 HA ASP 36 HA ASP 36 -13.352 -6.644 10.866 307 HB2 ASP 36 2HB ASP 36 -14.167 -8.909 10.927 308 HB3 ASP 36 3HB ASP 36 -12.690 -9.548 10.219 309 H GLU 37 H GLU 37 -10.781 -8.305 9.047 310 HA GLU 37 HA GLU 37 -8.538 -7.735 10.592 311 HB2 GLU 37 2HB GLU 37 -8.785 -7.794 7.556 312 HB3 GLU 37 3HB GLU 37 -7.265 -7.879 8.429 313 HG2 GLU 37 2HG GLU 37 -9.450 -9.931 8.814 314 HG3 GLU 37 3HG GLU 37 -8.256 -10.060 7.526 315 H LEU 38 H LEU 38 -10.033 -5.879 7.991 316 HA LEU 38 HA LEU 38 -8.285 -3.757 7.756 317 HB2 LEU 38 2HB LEU 38 -10.037 -4.281 6.110 318 HB3 LEU 38 3HB LEU 38 -11.282 -3.830 7.267 319 HG LEU 38 HG LEU 38 -10.360 -1.472 7.245 320 HD11 LEU 38 1HD1 LEU 38 -8.889 -0.785 5.417 321 HD12 LEU 38 2HD1 LEU 38 -8.673 -2.471 4.941 322 HD13 LEU 38 3HD1 LEU 38 -8.096 -1.911 6.514 323 HD21 LEU 38 3HD2 LEU 38 -12.343 -2.042 5.946 324 HD22 LEU 38 1HD2 LEU 38 -11.337 -2.527 4.579 325 HD23 LEU 38 2HD2 LEU 38 -11.366 -0.843 5.104 326 H LYS 39 H LYS 39 -11.393 -3.759 9.617 327 HA LYS 39 HA LYS 39 -10.951 -1.111 10.538 328 HB2 LYS 39 2HB LYS 39 -12.917 -1.525 12.085 329 HB3 LYS 39 3HB LYS 39 -13.205 -1.686 10.366 330 HG2 LYS 39 2HG LYS 39 -14.441 -3.417 11.293 331 HG3 LYS 39 3HG LYS 39 -12.984 -4.223 10.719 332 HD2 LYS 39 2HD LYS 39 -12.146 -4.490 12.936 333 HD3 LYS 39 3HD LYS 39 -13.303 -3.332 13.596 334 HE2 LYS 39 2HE LYS 39 -15.148 -4.871 13.201 335 HE3 LYS 39 3HE LYS 39 -14.076 -6.007 12.383 336 HZ1 LYS 39 3HZ LYS 39 -13.002 -6.529 14.375 337 HZ2 LYS 39 1HZ LYS 39 -14.644 -6.517 14.754 338 HZ3 LYS 39 2HZ LYS 39 -13.670 -5.215 15.205 339 H LYS 40 H LYS 40 -10.227 -4.264 11.991 340 HA LYS 40 HA LYS 40 -9.668 -3.362 14.607 341 HB2 LYS 40 2HB LYS 40 -8.680 -5.790 13.070 342 HB3 LYS 40 3HB LYS 40 -8.189 -5.486 14.732 343 HG2 LYS 40 2HG LYS 40 -11.030 -5.913 13.761 344 HG3 LYS 40 3HG LYS 40 -10.042 -7.081 14.636 345 HD2 LYS 40 2HD LYS 40 -10.950 -4.392 15.734 346 HD3 LYS 40 3HD LYS 40 -11.709 -5.941 16.095 347 HE2 LYS 40 2HE LYS 40 -9.709 -6.722 17.221 348 HE3 LYS 40 3HE LYS 40 -8.815 -5.281 16.727 349 HZ1 LYS 40 3HZ LYS 40 -11.079 -5.420 18.639 350 HZ2 LYS 40 1HZ LYS 40 -10.468 -3.970 18.025 351 HZ3 LYS 40 2HZ LYS 40 -9.485 -4.969 18.963 352 H GLU 41 H GLU 41 -7.470 -3.804 11.796 353 HA GLU 41 HA GLU 41 -5.154 -2.862 13.191 354 HB2 GLU 41 2HB GLU 41 -4.041 -2.905 11.024 355 HB3 GLU 41 3HB GLU 41 -5.036 -4.348 11.201 356 HG2 GLU 41 2HG GLU 41 -6.821 -3.149 9.850 357 HG3 GLU 41 3HG GLU 41 -5.623 -1.903 9.525 358 H MET 42 H MET 42 -7.691 -1.296 11.264 359 HA MET 42 HA MET 42 -6.405 1.156 10.709 360 HB2 MET 42 2HB MET 42 -9.307 0.306 10.799 361 HB3 MET 42 3HB MET 42 -8.936 2.014 10.638 362 HG2 MET 42 2HG MET 42 -7.587 0.171 8.708 363 HG3 MET 42 3HG MET 42 -9.319 0.423 8.524 364 HE1 MET 42 3HE MET 42 -6.636 3.074 9.811 365 HE2 MET 42 1HE MET 42 -6.300 3.941 8.318 366 HE3 MET 42 2HE MET 42 -5.763 2.274 8.503 367 H LYS 43 H LYS 43 -8.409 0.173 13.448 368 HA LYS 43 HA LYS 43 -8.436 2.627 14.835 369 HB2 LYS 43 2HB LYS 43 -8.900 -0.251 15.603 370 HB3 LYS 43 3HB LYS 43 -8.670 0.912 16.899 371 HG2 LYS 43 2HG LYS 43 -11.039 0.569 16.490 372 HG3 LYS 43 3HG LYS 43 -10.588 2.224 16.076 373 HD2 LYS 43 2HD LYS 43 -10.507 1.547 13.665 374 HD3 LYS 43 3HD LYS 43 -11.061 -0.063 14.135 375 HE2 LYS 43 2HE LYS 43 -12.930 1.245 13.309 376 HE3 LYS 43 3HE LYS 43 -13.139 0.943 15.035 377 HZ1 LYS 43 3HZ LYS 43 -12.392 3.160 15.505 378 HZ2 LYS 43 1HZ LYS 43 -13.648 3.236 14.378 379 HZ3 LYS 43 2HZ LYS 43 -12.050 3.447 13.875 380 H LYS 44 H LYS 44 -6.079 -0.051 14.820 381 HA LYS 44 HA LYS 44 -4.332 1.028 16.812 382 HB2 LYS 44 2HB LYS 44 -3.718 -0.924 14.555 383 HB3 LYS 44 3HB LYS 44 -2.651 -0.595 15.910 384 HG2 LYS 44 2HG LYS 44 -5.432 -1.669 16.376 385 HG3 LYS 44 3HG LYS 44 -4.120 -2.741 15.904 386 HD2 LYS 44 2HD LYS 44 -4.267 -2.862 18.284 387 HD3 LYS 44 3HD LYS 44 -2.825 -1.917 17.927 388 HE2 LYS 44 2HE LYS 44 -4.027 0.147 18.475 389 HE3 LYS 44 3HE LYS 44 -5.511 -0.765 18.750 390 HZ1 LYS 44 3HZ LYS 44 -4.429 -1.907 20.582 391 HZ2 LYS 44 1HZ LYS 44 -4.394 -0.234 20.820 392 HZ3 LYS 44 2HZ LYS 44 -3.001 -1.045 20.314 393 H LEU 45 H LEU 45 -4.511 1.367 13.287 394 HA LEU 45 HA LEU 45 -2.003 2.694 12.916 395 HB2 LEU 45 2HB LEU 45 -4.478 2.644 11.136 396 HB3 LEU 45 3HB LEU 45 -2.889 3.203 10.634 397 HG LEU 45 HG LEU 45 -3.513 0.346 11.486 398 HD11 LEU 45 1HD1 LEU 45 -4.691 0.845 9.416 399 HD12 LEU 45 2HD1 LEU 45 -3.368 -0.279 9.122 400 HD13 LEU 45 3HD1 LEU 45 -3.197 1.421 8.674 401 HD21 LEU 45 3HD2 LEU 45 -1.010 1.485 10.221 402 HD22 LEU 45 1HD2 LEU 45 -1.318 -0.223 10.555 403 HD23 LEU 45 2HD2 LEU 45 -1.185 0.923 11.886 404 H ALA 46 H ALA 46 -5.179 3.701 13.860 405 HA ALA 46 HA ALA 46 -4.732 6.545 13.565 406 HB1 ALA 46 3HB ALA 46 -6.916 6.766 14.668 407 HB2 ALA 46 1HB ALA 46 -6.922 5.038 15.042 408 HB3 ALA 46 2HB ALA 46 -6.983 5.582 13.364 409 H GLU 47 H GLU 47 -4.836 4.247 16.322 410 HA GLU 47 HA GLU 47 -4.452 6.319 18.291 411 HB2 GLU 47 2HB GLU 47 -4.363 3.293 18.651 412 HB3 GLU 47 3HB GLU 47 -4.410 4.478 19.951 413 HG2 GLU 47 2HG GLU 47 -6.600 3.718 18.022 414 HG3 GLU 47 3HG GLU 47 -6.622 3.696 19.781 415 H GLU 48 H GLU 48 -2.403 3.615 17.155 416 HA GLU 48 HA GLU 48 -0.092 4.405 18.653 417 HB2 GLU 48 2HB GLU 48 -0.070 2.688 16.127 418 HB3 GLU 48 3HB GLU 48 1.099 2.684 17.437 419 HG2 GLU 48 2HG GLU 48 -1.732 1.616 17.513 420 HG3 GLU 48 3HG GLU 48 -0.245 0.679 17.550 421 H LYS 49 H LYS 49 0.553 6.504 18.246 422 HA LYS 49 HA LYS 49 0.651 7.471 15.448 423 HB2 LYS 49 2HB LYS 49 0.697 9.019 18.074 424 HB3 LYS 49 3HB LYS 49 0.731 9.746 16.466 425 HG2 LYS 49 2HG LYS 49 -1.486 8.857 15.963 426 HG3 LYS 49 3HG LYS 49 -1.523 8.005 17.510 427 HD2 LYS 49 2HD LYS 49 -1.427 10.204 18.689 428 HD3 LYS 49 3HD LYS 49 -1.480 11.021 17.122 429 HE2 LYS 49 2HE LYS 49 -3.637 9.197 18.245 430 HE3 LYS 49 3HE LYS 49 -3.705 10.958 18.170 431 HZ1 LYS 49 3HZ LYS 49 -3.594 10.795 15.741 432 HZ2 LYS 49 1HZ LYS 49 -4.939 9.984 16.367 433 HZ3 LYS 49 2HZ LYS 49 -3.594 9.108 15.849 434 H ASN 50 H ASN 50 2.763 6.231 17.751 435 HA ASN 50 HA ASN 50 5.097 7.815 17.203 436 HB2 ASN 50 2HB ASN 50 4.846 4.988 18.336 437 HB3 ASN 50 3HB ASN 50 6.359 5.891 18.237 438 HD21 ASN 50 1HD2 ASN 50 6.711 5.947 20.452 439 HD22 ASN 50 2HD2 ASN 50 5.725 6.848 21.548 440 H PHE 51 H PHE 51 7.114 6.631 16.272 441 HA PHE 51 HA PHE 51 6.605 6.267 13.511 442 HB2 PHE 51 2HB PHE 51 8.726 7.244 14.487 443 HB3 PHE 51 3HB PHE 51 9.203 5.621 14.969 444 HD1 PHE 51 HD2 PHE 51 8.614 7.868 12.082 445 HD2 PHE 51 HD1 PHE 51 10.036 4.022 13.309 446 HE1 PHE 51 HE2 PHE 51 9.584 7.504 9.853 447 HE2 PHE 51 HE1 PHE 51 10.997 3.670 11.073 448 HZ PHE 51 HZ PHE 51 10.768 5.407 9.349 449 H GLU 52 H GLU 52 6.385 4.488 12.301 450 HA GLU 52 HA GLU 52 7.217 1.854 13.005 451 HB2 GLU 52 2HB GLU 52 5.229 1.967 14.476 452 HB3 GLU 52 3HB GLU 52 4.219 2.466 13.125 453 HG2 GLU 52 2HG GLU 52 4.556 0.270 12.052 454 HG3 GLU 52 3HG GLU 52 5.608 -0.221 13.380 455 H LYS 53 H LYS 53 7.068 0.484 11.208 456 HA LYS 53 HA LYS 53 6.027 1.645 8.683 457 HB2 LYS 53 2HB LYS 53 8.537 -0.020 9.156 458 HB3 LYS 53 3HB LYS 53 7.878 0.334 7.566 459 HG2 LYS 53 2HG LYS 53 8.248 2.742 7.927 460 HG3 LYS 53 3HG LYS 53 8.912 2.398 9.533 461 HD2 LYS 53 2HD LYS 53 10.758 1.145 8.563 462 HD3 LYS 53 3HD LYS 53 10.050 1.273 6.951 463 HE2 LYS 53 2HE LYS 53 10.381 3.703 6.986 464 HE3 LYS 53 3HE LYS 53 11.073 3.585 8.611 465 HZ1 LYS 53 3HZ LYS 53 12.175 2.162 6.272 466 HZ2 LYS 53 1HZ LYS 53 12.885 2.347 7.788 467 HZ3 LYS 53 2HZ LYS 53 12.714 3.678 6.768 468 H ILE 54 H ILE 54 4.385 0.447 7.908 469 HA ILE 54 HA ILE 54 4.442 -2.494 8.260 470 HB ILE 54 HB ILE 54 1.893 -0.803 8.471 471 HG12 ILE 54 2HG1 ILE 54 3.391 -2.360 10.640 472 HG13 ILE 54 3HG1 ILE 54 3.248 -0.610 10.535 473 HG21 ILE 54 1HG2 ILE 54 0.754 -2.945 8.994 474 HG22 ILE 54 2HG2 ILE 54 2.267 -3.820 8.757 475 HG23 ILE 54 3HG2 ILE 54 1.498 -3.002 7.396 476 HD11 ILE 54 3HD1 ILE 54 1.773 -1.498 12.220 477 HD12 ILE 54 1HD1 ILE 54 0.990 -2.543 11.037 478 HD13 ILE 54 2HD1 ILE 54 0.832 -0.790 10.910 479 H LEU 55 H LEU 55 4.409 -3.521 6.369 480 HA LEU 55 HA LEU 55 3.404 -2.363 3.906 481 HB2 LEU 55 2HB LEU 55 5.308 -4.018 3.952 482 HB3 LEU 55 3HB LEU 55 4.197 -5.244 4.543 483 HG LEU 55 HG LEU 55 2.831 -4.788 2.364 484 HD11 LEU 55 1HD1 LEU 55 3.841 -2.731 1.677 485 HD12 LEU 55 2HD1 LEU 55 4.167 -3.958 0.458 486 HD13 LEU 55 3HD1 LEU 55 5.436 -3.480 1.581 487 HD21 LEU 55 3HD2 LEU 55 5.534 -6.144 2.095 488 HD22 LEU 55 1HD2 LEU 55 4.135 -6.379 1.044 489 HD23 LEU 55 2HD2 LEU 55 4.064 -6.886 2.730 490 H ILE 56 H ILE 56 1.212 -2.138 3.789 491 HA ILE 56 HA ILE 56 -0.578 -4.163 4.939 492 HB ILE 56 HB ILE 56 -1.291 -1.584 3.448 493 HG12 ILE 56 2HG1 ILE 56 -0.050 -1.146 5.604 494 HG13 ILE 56 3HG1 ILE 56 -1.692 -0.522 5.597 495 HG21 ILE 56 1HG2 ILE 56 -3.094 -3.227 3.372 496 HG22 ILE 56 2HG2 ILE 56 -3.537 -1.917 4.464 497 HG23 ILE 56 3HG2 ILE 56 -3.006 -3.465 5.121 498 HD11 ILE 56 3HD1 ILE 56 -1.111 -1.499 7.740 499 HD12 ILE 56 1HD1 ILE 56 -0.771 -3.048 6.969 500 HD13 ILE 56 2HD1 ILE 56 -2.416 -2.409 6.981 501 H LYS 57 H LYS 57 -0.846 -5.907 3.659 502 HA LYS 57 HA LYS 57 -1.043 -5.724 0.746 503 HB2 LYS 57 2HB LYS 57 0.159 -7.655 1.646 504 HB3 LYS 57 3HB LYS 57 -1.165 -8.071 2.717 505 HG2 LYS 57 2HG LYS 57 -1.663 -8.094 -0.255 506 HG3 LYS 57 3HG LYS 57 -0.724 -9.405 0.447 507 HD2 LYS 57 2HD LYS 57 -2.594 -10.039 1.892 508 HD3 LYS 57 3HD LYS 57 -3.531 -8.639 1.360 509 HE2 LYS 57 2HE LYS 57 -3.565 -9.564 -0.939 510 HE3 LYS 57 3HE LYS 57 -2.667 -10.974 -0.380 511 HZ1 LYS 57 3HZ LYS 57 -5.071 -11.352 -0.582 512 HZ2 LYS 57 1HZ LYS 57 -5.355 -10.193 0.616 513 HZ3 LYS 57 2HZ LYS 57 -4.505 -11.604 0.990 514 H SER 58 H SER 58 -2.930 -5.447 -0.235 515 HA SER 58 HA SER 58 -5.355 -6.699 0.662 516 HB2 SER 58 2HB SER 58 -5.432 -4.607 2.015 517 HB3 SER 58 3HB SER 58 -5.234 -3.648 0.546 518 HG SER 58 HG SER 58 -7.428 -5.228 1.337 519 H ASN 59 H ASN 59 -6.041 -7.564 -1.176 520 HA ASN 59 HA ASN 59 -5.409 -6.356 -3.789 521 HB2 ASN 59 2HB ASN 59 -6.094 -8.576 -4.723 522 HB3 ASN 59 3HB ASN 59 -4.803 -8.722 -3.539 523 HD21 ASN 59 1HD2 ASN 59 -8.151 -9.446 -4.205 524 HD22 ASN 59 2HD2 ASN 59 -8.389 -10.480 -2.843 525 H ASP 60 H ASP 60 -8.019 -6.699 -1.583 526 HA ASP 60 HA ASP 60 -10.124 -6.328 -3.579 527 HB2 ASP 60 2HB ASP 60 -10.630 -7.795 -1.710 528 HB3 ASP 60 3HB ASP 60 -10.184 -6.555 -0.541 529 H LYS 61 H LYS 61 -10.450 -4.336 -4.359 530 HA LYS 61 HA LYS 61 -9.211 -1.994 -3.480 531 HB2 LYS 61 2HB LYS 61 -10.621 -0.819 -5.157 532 HB3 LYS 61 3HB LYS 61 -9.879 -2.284 -5.792 533 HG2 LYS 61 2HG LYS 61 -12.015 -3.503 -5.487 534 HG3 LYS 61 3HG LYS 61 -12.767 -2.021 -4.885 535 HD2 LYS 61 2HD LYS 61 -12.391 -0.927 -7.058 536 HD3 LYS 61 3HD LYS 61 -11.573 -2.368 -7.666 537 HE2 LYS 61 2HE LYS 61 -13.677 -3.647 -7.436 538 HE3 LYS 61 3HE LYS 61 -14.490 -2.198 -6.836 539 HZ1 LYS 61 3HZ LYS 61 -14.118 -1.124 -8.943 540 HZ2 LYS 61 1HZ LYS 61 -14.878 -2.610 -9.211 541 HZ3 LYS 61 2HZ LYS 61 -13.224 -2.439 -9.517 542 H GLN 62 H GLN 62 -12.269 -3.320 -2.421 543 HA GLN 62 HA GLN 62 -13.475 -0.877 -1.501 544 HB2 GLN 62 2HB GLN 62 -14.019 -3.804 -0.906 545 HB3 GLN 62 3HB GLN 62 -14.905 -2.528 -0.086 546 HG2 GLN 62 2HG GLN 62 -14.832 -2.824 -3.102 547 HG3 GLN 62 3HG GLN 62 -16.064 -3.562 -2.074 548 HE21 GLN 62 1HE2 GLN 62 -17.585 -2.226 -1.050 549 HE22 GLN 62 2HE2 GLN 62 -17.847 -0.581 -1.511 550 H LEU 63 H LEU 63 -11.463 -3.400 -0.020 551 HA LEU 63 HA LEU 63 -11.405 -2.418 2.617 552 HB2 LEU 63 2HB LEU 63 -9.280 -3.972 1.089 553 HB3 LEU 63 3HB LEU 63 -9.252 -3.709 2.824 554 HG LEU 63 HG LEU 63 -11.399 -5.273 1.338 555 HD11 LEU 63 1HD1 LEU 63 -10.425 -7.287 2.338 556 HD12 LEU 63 2HD1 LEU 63 -9.129 -6.324 3.046 557 HD13 LEU 63 3HD1 LEU 63 -9.265 -6.466 1.295 558 HD21 LEU 63 3HD2 LEU 63 -10.986 -4.917 4.320 559 HD22 LEU 63 1HD2 LEU 63 -12.181 -5.972 3.558 560 HD23 LEU 63 2HD2 LEU 63 -12.293 -4.225 3.355 561 H LEU 64 H LEU 64 -9.427 -1.601 -0.240 562 HA LEU 64 HA LEU 64 -7.616 0.159 1.098 563 HB2 LEU 64 2HB LEU 64 -8.358 -0.028 -1.849 564 HB3 LEU 64 3HB LEU 64 -7.165 1.103 -1.230 565 HG LEU 64 HG LEU 64 -5.981 -1.040 -0.257 566 HD11 LEU 64 1HD1 LEU 64 -7.751 -2.636 -0.730 567 HD12 LEU 64 2HD1 LEU 64 -6.267 -3.058 -1.578 568 HD13 LEU 64 3HD1 LEU 64 -7.604 -2.315 -2.461 569 HD21 LEU 64 3HD2 LEU 64 -5.051 0.411 -1.996 570 HD22 LEU 64 1HD2 LEU 64 -5.921 -0.505 -3.230 571 HD23 LEU 64 2HD2 LEU 64 -4.663 -1.287 -2.260 572 H LYS 65 H LYS 65 -10.693 0.696 -0.609 573 HA LYS 65 HA LYS 65 -10.684 3.511 -0.608 574 HB2 LYS 65 2HB LYS 65 -12.953 1.481 -0.670 575 HB3 LYS 65 3HB LYS 65 -13.258 3.212 -0.750 576 HG2 LYS 65 2HG LYS 65 -11.606 1.628 -2.742 577 HG3 LYS 65 3HG LYS 65 -13.275 2.133 -2.976 578 HD2 LYS 65 2HD LYS 65 -10.941 4.057 -2.609 579 HD3 LYS 65 3HD LYS 65 -11.585 3.556 -4.168 580 HE2 LYS 65 2HE LYS 65 -12.543 5.689 -3.724 581 HE3 LYS 65 3HE LYS 65 -13.827 4.519 -3.429 582 HZ1 LYS 65 3HZ LYS 65 -13.535 4.767 -1.081 583 HZ2 LYS 65 1HZ LYS 65 -13.649 6.316 -1.747 584 HZ3 LYS 65 2HZ LYS 65 -12.145 5.704 -1.283 585 H GLU 66 H GLU 66 -12.334 1.256 1.604 586 HA GLU 66 HA GLU 66 -13.319 3.060 3.483 587 HB2 GLU 66 2HB GLU 66 -12.426 0.165 3.786 588 HB3 GLU 66 3HB GLU 66 -13.324 1.031 5.024 589 HG2 GLU 66 2HG GLU 66 -14.364 0.618 2.210 590 HG3 GLU 66 3HG GLU 66 -14.668 -0.509 3.527 591 H MET 67 H MET 67 -10.177 1.421 3.301 592 HA MET 67 HA MET 67 -9.085 2.096 5.794 593 HB2 MET 67 2HB MET 67 -8.166 0.416 4.121 594 HB3 MET 67 3HB MET 67 -7.542 1.760 3.182 595 HG2 MET 67 2HG MET 67 -6.175 2.409 5.199 596 HG3 MET 67 3HG MET 67 -6.695 0.905 5.957 597 HE1 MET 67 3HE MET 67 -5.240 -1.684 3.241 598 HE2 MET 67 1HE MET 67 -6.808 -0.885 3.137 599 HE3 MET 67 2HE MET 67 -6.254 -1.548 4.677 600 H LEU 68 H LEU 68 -8.613 3.666 2.630 601 HA LEU 68 HA LEU 68 -7.006 5.808 3.604 602 HB2 LEU 68 2HB LEU 68 -8.454 5.434 0.954 603 HB3 LEU 68 3HB LEU 68 -7.306 6.725 1.272 604 HG LEU 68 HG LEU 68 -6.631 3.754 1.324 605 HD11 LEU 68 1HD1 LEU 68 -7.126 4.503 -0.953 606 HD12 LEU 68 2HD1 LEU 68 -5.416 4.129 -0.764 607 HD13 LEU 68 3HD1 LEU 68 -5.951 5.813 -0.797 608 HD21 LEU 68 3HD2 LEU 68 -4.284 4.474 1.454 609 HD22 LEU 68 1HD2 LEU 68 -5.208 5.027 2.846 610 HD23 LEU 68 2HD2 LEU 68 -4.797 6.161 1.560 611 H GLU 69 H GLU 69 -10.432 5.367 3.336 612 HA GLU 69 HA GLU 69 -11.171 8.146 3.600 613 HB2 GLU 69 2HB GLU 69 -12.718 5.549 3.966 614 HB3 GLU 69 3HB GLU 69 -13.450 7.130 4.232 615 HG2 GLU 69 2HG GLU 69 -13.071 7.760 1.911 616 HG3 GLU 69 3HG GLU 69 -12.169 6.273 1.622 617 H LEU 70 H LEU 70 -10.524 5.472 5.852 618 HA LEU 70 HA LEU 70 -11.185 7.013 8.218 619 HB2 LEU 70 2HB LEU 70 -9.654 4.392 7.933 620 HB3 LEU 70 3HB LEU 70 -10.171 5.090 9.459 621 HG LEU 70 HG LEU 70 -12.025 4.096 7.255 622 HD11 LEU 70 1HD1 LEU 70 -11.453 2.880 9.974 623 HD12 LEU 70 2HD1 LEU 70 -10.925 2.246 8.415 624 HD13 LEU 70 3HD1 LEU 70 -12.642 2.296 8.804 625 HD21 LEU 70 3HD2 LEU 70 -13.874 4.493 8.820 626 HD22 LEU 70 1HD2 LEU 70 -13.030 5.992 8.436 627 HD23 LEU 70 2HD2 LEU 70 -12.752 5.197 9.987 628 H ILE 71 H ILE 71 -8.323 6.388 6.300 629 HA ILE 71 HA ILE 71 -6.400 7.638 8.049 630 HB ILE 71 HB ILE 71 -6.223 6.987 5.056 631 HG12 ILE 71 2HG1 ILE 71 -5.074 5.516 7.472 632 HG13 ILE 71 3HG1 ILE 71 -6.472 5.002 6.541 633 HG21 ILE 71 1HG2 ILE 71 -3.953 7.804 6.923 634 HG22 ILE 71 2HG2 ILE 71 -4.612 8.780 5.608 635 HG23 ILE 71 3HG2 ILE 71 -3.771 7.275 5.247 636 HD11 ILE 71 3HD1 ILE 71 -3.635 5.161 5.542 637 HD12 ILE 71 1HD1 ILE 71 -5.037 4.670 4.588 638 HD13 ILE 71 2HD1 ILE 71 -4.531 3.706 5.973 639 H SER 72 H SER 72 -8.751 8.791 5.745 640 HA SER 72 HA SER 72 -7.659 11.216 4.928 641 HB2 SER 72 2HB SER 72 -9.782 10.134 4.075 642 HB3 SER 72 3HB SER 72 -10.611 10.752 5.503 643 HG SER 72 HG SER 72 -10.025 12.875 4.809 644 H LYS 73 H LYS 73 -8.860 10.381 8.084 645 HA LYS 73 HA LYS 73 -9.014 13.131 9.047 646 HB2 LYS 73 2HB LYS 73 -9.154 10.482 10.553 647 HB3 LYS 73 3HB LYS 73 -9.461 12.069 11.254 648 HG2 LYS 73 2HG LYS 73 -11.384 12.340 9.646 649 HG3 LYS 73 3HG LYS 73 -11.117 10.672 9.128 650 HD2 LYS 73 2HD LYS 73 -11.508 9.900 11.466 651 HD3 LYS 73 3HD LYS 73 -11.809 11.570 11.955 652 HE2 LYS 73 2HE LYS 73 -13.921 10.405 11.650 653 HE3 LYS 73 3HE LYS 73 -13.755 11.645 10.408 654 HZ1 LYS 73 3HZ LYS 73 -14.582 9.652 9.430 655 HZ2 LYS 73 1HZ LYS 73 -13.323 8.726 10.075 656 HZ3 LYS 73 2HZ LYS 73 -13.001 9.877 8.881 657 H LEU 74 H LEU 74 -6.716 10.470 9.045 658 HA LEU 74 HA LEU 74 -5.010 11.538 11.149 659 HB2 LEU 74 2HB LEU 74 -4.553 9.175 9.271 660 HB3 LEU 74 3HB LEU 74 -3.716 9.483 10.787 661 HG LEU 74 HG LEU 74 -6.698 8.900 10.585 662 HD11 LEU 74 1HD1 LEU 74 -6.207 6.644 11.415 663 HD12 LEU 74 2HD1 LEU 74 -4.475 6.978 11.331 664 HD13 LEU 74 3HD1 LEU 74 -5.442 6.939 9.854 665 HD21 LEU 74 3HD2 LEU 74 -4.879 9.030 13.015 666 HD22 LEU 74 1HD2 LEU 74 -6.580 8.551 13.028 667 HD23 LEU 74 2HD2 LEU 74 -6.132 10.194 12.578 668 H GLY 75 H GLY 75 -4.575 10.768 7.690 669 HA2 GLY 75 2HA GLY 75 -3.688 11.974 5.974 670 HA3 GLY 75 3HA GLY 75 -3.428 13.312 7.074 671 H TYR 76 H TYR 76 -2.066 10.075 7.607 672 HA TYR 76 HA TYR 76 0.639 11.126 7.314 673 HB2 TYR 76 2HB TYR 76 1.376 8.824 8.059 674 HB3 TYR 76 3HB TYR 76 0.385 9.695 9.214 675 HD1 TYR 76 HD2 TYR 76 -0.019 7.126 6.464 676 HD2 TYR 76 HD1 TYR 76 -1.317 8.489 10.305 677 HE1 TYR 76 HE2 TYR 76 -1.472 5.157 6.678 678 HE2 TYR 76 HE1 TYR 76 -2.762 6.513 10.513 679 HH TYR 76 HH TYR 76 -2.542 3.827 8.446 680 H LYS 77 H LYS 77 2.254 9.656 6.150 681 HA LYS 77 HA LYS 77 1.543 9.712 3.370 682 HB2 LYS 77 2HB LYS 77 4.114 8.944 4.796 683 HB3 LYS 77 3HB LYS 77 3.960 8.993 3.046 684 HG2 LYS 77 2HG LYS 77 3.465 11.405 4.821 685 HG3 LYS 77 3HG LYS 77 5.038 11.018 4.120 686 HD2 LYS 77 2HD LYS 77 4.069 11.173 1.849 687 HD3 LYS 77 3HD LYS 77 2.492 11.563 2.549 688 HE2 LYS 77 2HE LYS 77 3.461 13.627 3.543 689 HE3 LYS 77 3HE LYS 77 5.018 13.240 2.802 690 HZ1 LYS 77 3HZ LYS 77 3.795 14.830 1.472 691 HZ2 LYS 77 1HZ LYS 77 2.482 13.772 1.347 692 HZ3 LYS 77 2HZ LYS 77 3.956 13.379 0.623 693 H VAL 78 H VAL 78 0.208 8.119 2.738 694 HA VAL 78 HA VAL 78 0.939 5.285 3.132 695 HB VAL 78 HB VAL 78 -1.486 6.436 1.651 696 HG11 VAL 78 1HG1 VAL 78 -0.934 4.127 0.987 697 HG12 VAL 78 2HG1 VAL 78 -2.440 4.161 1.901 698 HG13 VAL 78 3HG1 VAL 78 -0.952 3.615 2.677 699 HG21 VAL 78 3HG2 VAL 78 -2.809 5.955 3.674 700 HG22 VAL 78 1HG2 VAL 78 -1.541 7.134 4.013 701 HG23 VAL 78 2HG2 VAL 78 -1.347 5.457 4.530 702 H PHE 79 H PHE 79 1.909 4.148 1.514 703 HA PHE 79 HA PHE 79 2.379 5.431 -1.123 704 HB2 PHE 79 2HB PHE 79 4.070 3.385 0.407 705 HB3 PHE 79 3HB PHE 79 4.456 4.037 -1.180 706 HD1 PHE 79 HD1 PHE 79 5.208 6.390 -1.420 707 HD2 PHE 79 HD2 PHE 79 4.480 4.702 2.439 708 HE1 PHE 79 HE1 PHE 79 6.427 8.244 -0.370 709 HE2 PHE 79 HE2 PHE 79 5.707 6.567 3.477 710 HZ PHE 79 HZ PHE 79 6.679 8.337 2.073 711 H LEU 80 H LEU 80 1.010 4.496 -2.562 712 HA LEU 80 HA LEU 80 0.102 1.718 -2.141 713 HB2 LEU 80 2HB LEU 80 -1.703 3.346 -2.007 714 HB3 LEU 80 3HB LEU 80 -1.238 4.071 -3.535 715 HG LEU 80 HG LEU 80 -1.986 2.081 -4.765 716 HD11 LEU 80 1HD1 LEU 80 -3.107 0.194 -3.701 717 HD12 LEU 80 2HD1 LEU 80 -2.753 0.858 -2.104 718 HD13 LEU 80 3HD1 LEU 80 -1.439 0.329 -3.156 719 HD21 LEU 80 3HD2 LEU 80 -4.405 2.230 -4.370 720 HD22 LEU 80 1HD2 LEU 80 -3.656 3.824 -4.310 721 HD23 LEU 80 2HD2 LEU 80 -4.120 3.013 -2.813 722 H LEU 81 H LEU 81 0.216 0.243 -3.772 723 HA LEU 81 HA LEU 81 1.380 1.017 -6.374 724 HB2 LEU 81 2HB LEU 81 3.123 0.075 -4.827 725 HB3 LEU 81 3HB LEU 81 2.199 -1.409 -4.728 726 HG LEU 81 HG LEU 81 2.544 -1.795 -7.157 727 HD11 LEU 81 1HD1 LEU 81 2.700 0.495 -7.953 728 HD12 LEU 81 2HD1 LEU 81 4.134 -0.407 -8.433 729 HD13 LEU 81 3HD1 LEU 81 4.222 0.731 -7.086 730 HD21 LEU 81 3HD2 LEU 81 4.936 -2.352 -7.066 731 HD22 LEU 81 1HD2 LEU 81 4.132 -2.771 -5.556 732 HD23 LEU 81 2HD2 LEU 81 5.138 -1.324 -5.645 733 H LEU 82 H LEU 82 -0.136 0.564 -7.786 734 HA LEU 82 HA LEU 82 -2.008 -1.675 -7.495 735 HB2 LEU 82 2HB LEU 82 -1.907 0.581 -9.549 736 HB3 LEU 82 3HB LEU 82 -3.216 -0.572 -9.351 737 HG LEU 82 HG LEU 82 -2.413 1.503 -7.269 738 HD11 LEU 82 1HD1 LEU 82 -4.450 2.713 -7.900 739 HD12 LEU 82 2HD1 LEU 82 -4.763 1.547 -9.190 740 HD13 LEU 82 3HD1 LEU 82 -3.336 2.585 -9.260 741 HD21 LEU 82 3HD2 LEU 82 -4.802 -0.372 -7.334 742 HD22 LEU 82 1HD2 LEU 82 -4.529 0.909 -6.148 743 HD23 LEU 82 2HD2 LEU 82 -3.425 -0.461 -6.232 744 H ALA 83 H ALA 83 -0.757 -3.467 -8.017 745 HA ALA 83 HA ALA 83 0.754 -3.500 -10.559 746 HB1 ALA 83 3HB ALA 83 1.944 -5.430 -9.611 747 HB2 ALA 83 1HB ALA 83 0.930 -5.361 -8.167 748 HB3 ALA 83 2HB ALA 83 2.029 -4.036 -8.535 749 H ASP 84 H ASP 84 -0.467 -4.165 -12.168 750 HA ASP 84 HA ASP 84 -1.395 -6.787 -12.511 751 HB2 ASP 84 2HB ASP 84 -3.245 -6.214 -10.993 752 HB3 ASP 84 3HB ASP 84 -3.606 -4.758 -11.908 753 H GLN 85 H GLN 85 -2.380 -7.075 -14.652 754 HA GLN 85 HA GLN 85 -1.294 -5.247 -16.626 755 HB2 GLN 85 2HB GLN 85 -2.934 -7.794 -16.988 756 HB3 GLN 85 3HB GLN 85 -2.043 -6.954 -18.253 757 HG2 GLN 85 2HG GLN 85 0.076 -7.475 -17.071 758 HG3 GLN 85 3HG GLN 85 -0.840 -8.361 -15.854 759 HE21 GLN 85 1HE2 GLN 85 0.224 -8.365 -19.186 760 HE22 GLN 85 2HE2 GLN 85 -0.137 -10.022 -19.503 761 H ASP 86 H ASP 86 -3.063 -3.699 -15.385 762 HA ASP 86 HA ASP 86 -5.217 -3.292 -17.328 763 HB2 ASP 86 2HB ASP 86 -6.414 -4.445 -15.550 764 HB3 ASP 86 3HB ASP 86 -5.640 -3.459 -14.312 765 H GLU 87 H GLU 87 -4.793 -1.336 -18.089 766 HA GLU 87 HA GLU 87 -3.767 0.803 -16.373 767 HB2 GLU 87 2HB GLU 87 -3.650 2.218 -18.355 768 HB3 GLU 87 3HB GLU 87 -2.861 0.686 -18.667 769 HG2 GLU 87 2HG GLU 87 -5.641 1.399 -19.626 770 HG3 GLU 87 3HG GLU 87 -4.182 1.590 -20.589 771 H ASN 88 H ASN 88 -6.802 -0.267 -17.806 772 HA ASN 88 HA ASN 88 -8.032 2.223 -18.065 773 HB2 ASN 88 2HB ASN 88 -8.903 0.234 -19.195 774 HB3 ASN 88 3HB ASN 88 -9.311 -0.521 -17.654 775 HD21 ASN 88 1HD2 ASN 88 -11.140 0.262 -16.495 776 HD22 ASN 88 2HD2 ASN 88 -12.346 1.232 -17.258 777 H GLU 89 H GLU 89 -8.834 -0.154 -15.439 778 HA GLU 89 HA GLU 89 -10.235 1.945 -14.015 779 HB2 GLU 89 2HB GLU 89 -11.107 -0.385 -14.049 780 HB3 GLU 89 3HB GLU 89 -9.716 -0.916 -13.104 781 HG2 GLU 89 2HG GLU 89 -10.394 0.473 -11.232 782 HG3 GLU 89 3HG GLU 89 -11.710 1.176 -12.171 783 H LEU 90 H LEU 90 -7.124 0.222 -13.622 784 HA LEU 90 HA LEU 90 -6.529 1.179 -11.031 785 HB2 LEU 90 2HB LEU 90 -4.652 0.264 -13.241 786 HB3 LEU 90 3HB LEU 90 -4.114 0.654 -11.615 787 HG LEU 90 HG LEU 90 -5.951 -1.639 -12.413 788 HD11 LEU 90 1HD1 LEU 90 -3.578 -2.046 -12.884 789 HD12 LEU 90 2HD1 LEU 90 -4.145 -3.076 -11.575 790 HD13 LEU 90 3HD1 LEU 90 -3.158 -1.659 -11.212 791 HD21 LEU 90 3HD2 LEU 90 -5.107 -0.816 -9.607 792 HD22 LEU 90 1HD2 LEU 90 -5.979 -2.292 -10.032 793 HD23 LEU 90 2HD2 LEU 90 -6.738 -0.723 -10.274 794 H GLU 91 H GLU 91 -5.755 2.557 -14.238 795 HA GLU 91 HA GLU 91 -4.164 4.721 -13.230 796 HB2 GLU 91 2HB GLU 91 -4.135 3.726 -15.629 797 HB3 GLU 91 3HB GLU 91 -5.540 4.730 -15.938 798 HG2 GLU 91 2HG GLU 91 -4.194 6.744 -15.368 799 HG3 GLU 91 3HG GLU 91 -2.796 5.701 -15.139 800 H GLU 92 H GLU 92 -7.588 4.239 -13.601 801 HA GLU 92 HA GLU 92 -8.283 7.039 -13.234 802 HB2 GLU 92 2HB GLU 92 -9.921 4.469 -13.149 803 HB3 GLU 92 3HB GLU 92 -10.618 6.057 -12.851 804 HG2 GLU 92 2HG GLU 92 -9.263 5.191 -15.416 805 HG3 GLU 92 3HG GLU 92 -11.002 5.280 -15.156 806 H PHE 93 H PHE 93 -8.145 4.110 -11.257 807 HA PHE 93 HA PHE 93 -9.276 4.998 -8.865 808 HB2 PHE 93 2HB PHE 93 -8.804 2.612 -9.467 809 HB3 PHE 93 3HB PHE 93 -7.084 2.900 -9.261 810 HD1 PHE 93 HD1 PHE 93 -10.342 2.873 -7.405 811 HD2 PHE 93 HD2 PHE 93 -6.086 2.585 -7.106 812 HE1 PHE 93 HE1 PHE 93 -10.543 2.171 -5.057 813 HE2 PHE 93 HE2 PHE 93 -6.301 1.885 -4.756 814 HZ PHE 93 HZ PHE 93 -8.530 1.675 -3.728 815 H LYS 94 H LYS 94 -5.888 4.918 -9.898 816 HA LYS 94 HA LYS 94 -4.714 5.926 -7.554 817 HB2 LYS 94 2HB LYS 94 -2.679 6.294 -8.966 818 HB3 LYS 94 3HB LYS 94 -3.367 4.691 -9.106 819 HG2 LYS 94 2HG LYS 94 -2.790 5.157 -11.299 820 HG3 LYS 94 3HG LYS 94 -4.497 5.589 -11.265 821 HD2 LYS 94 2HD LYS 94 -3.306 7.277 -12.512 822 HD3 LYS 94 3HD LYS 94 -3.830 7.993 -10.987 823 HE2 LYS 94 2HE LYS 94 -1.550 7.661 -10.070 824 HE3 LYS 94 3HE LYS 94 -1.040 6.974 -11.617 825 HZ1 LYS 94 3HZ LYS 94 -0.421 9.264 -11.532 826 HZ2 LYS 94 1HZ LYS 94 -1.987 9.740 -11.131 827 HZ3 LYS 94 2HZ LYS 94 -1.667 9.104 -12.657 828 H ARG 95 H ARG 95 -6.325 7.623 -10.142 829 HA ARG 95 HA ARG 95 -5.172 10.201 -9.777 830 HB2 ARG 95 2HB ARG 95 -7.920 9.426 -10.858 831 HB3 ARG 95 3HB ARG 95 -7.210 11.036 -10.981 832 HG2 ARG 95 2HG ARG 95 -5.406 10.183 -12.384 833 HG3 ARG 95 3HG ARG 95 -5.997 8.533 -12.182 834 HD2 ARG 95 2HD ARG 95 -6.688 9.315 -14.346 835 HD3 ARG 95 3HD ARG 95 -8.127 9.223 -13.325 836 HE ARG 95 HE ARG 95 -7.118 11.820 -13.154 837 HH11 ARG 95 1HH1 ARG 95 -8.584 9.762 -15.621 838 HH12 ARG 95 2HH1 ARG 95 -9.243 11.104 -16.503 839 HH21 ARG 95 1HH2 ARG 95 -7.971 13.552 -14.312 840 HH22 ARG 95 2HH2 ARG 95 -8.894 13.271 -15.755 841 H LYS 96 H LYS 96 -7.872 8.524 -8.267 842 HA LYS 96 HA LYS 96 -8.832 10.794 -6.757 843 HB2 LYS 96 2HB LYS 96 -9.528 7.826 -6.696 844 HB3 LYS 96 3HB LYS 96 -10.256 8.988 -5.595 845 HG2 LYS 96 2HG LYS 96 -11.803 8.588 -7.389 846 HG3 LYS 96 3HG LYS 96 -11.178 10.227 -7.572 847 HD2 LYS 96 2HD LYS 96 -9.618 9.418 -9.329 848 HD3 LYS 96 3HD LYS 96 -10.265 7.788 -9.141 849 HE2 LYS 96 2HE LYS 96 -11.832 10.214 -10.069 850 HE3 LYS 96 3HE LYS 96 -11.219 8.924 -11.101 851 HZ1 LYS 96 3HZ LYS 96 -13.472 8.471 -10.697 852 HZ2 LYS 96 1HZ LYS 96 -13.326 8.729 -9.033 853 HZ3 LYS 96 2HZ LYS 96 -12.607 7.381 -9.742 854 H ILE 97 H ILE 97 -6.627 8.094 -6.218 855 HA ILE 97 HA ILE 97 -6.436 8.339 -3.362 856 HB ILE 97 HB ILE 97 -4.369 7.133 -5.263 857 HG12 ILE 97 2HG1 ILE 97 -6.438 6.020 -5.780 858 HG13 ILE 97 3HG1 ILE 97 -5.512 4.916 -4.784 859 HG21 ILE 97 1HG2 ILE 97 -4.877 6.582 -2.319 860 HG22 ILE 97 2HG2 ILE 97 -3.503 7.459 -2.996 861 HG23 ILE 97 3HG2 ILE 97 -3.704 5.740 -3.336 862 HD11 ILE 97 3HD1 ILE 97 -6.933 5.542 -2.848 863 HD12 ILE 97 1HD1 ILE 97 -7.835 4.830 -4.182 864 HD13 ILE 97 2HD1 ILE 97 -7.888 6.571 -3.916 865 H GLU 98 H GLU 98 -4.481 9.443 -6.105 866 HA GLU 98 HA GLU 98 -2.560 10.965 -4.667 867 HB2 GLU 98 2HB GLU 98 -2.201 10.070 -6.943 868 HB3 GLU 98 3HB GLU 98 -3.453 11.114 -7.582 869 HG2 GLU 98 2HG GLU 98 -1.056 12.349 -6.231 870 HG3 GLU 98 3HG GLU 98 -0.885 11.714 -7.860 871 H SER 99 H SER 99 -5.780 11.658 -5.902 872 HA SER 99 HA SER 99 -5.773 14.483 -5.736 873 HB2 SER 99 2HB SER 99 -7.514 13.232 -6.949 874 HB3 SER 99 3HB SER 99 -8.111 12.560 -5.433 875 HG SER 99 HG SER 99 -7.927 15.338 -5.608 876 H GLN 100 H GLN 100 -6.400 11.969 -3.351 877 HA GLN 100 HA GLN 100 -7.178 13.762 -1.212 878 HB2 GLN 100 2HB GLN 100 -6.441 10.812 -1.237 879 HB3 GLN 100 3HB GLN 100 -7.045 11.670 0.177 880 HG2 GLN 100 2HG GLN 100 -9.184 12.068 -0.900 881 HG3 GLN 100 3HG GLN 100 -8.590 11.386 -2.416 882 HE21 GLN 100 1HE2 GLN 100 -8.307 9.134 -2.577 883 HE22 GLN 100 2HE2 GLN 100 -9.048 8.035 -1.469 884 H GLY 101 H GLY 101 -4.221 13.019 -2.618 885 HA2 GLY 101 2HA GLY 101 -2.212 14.103 -2.099 886 HA3 GLY 101 3HA GLY 101 -2.765 14.339 -0.450 887 H TYR 102 H TYR 102 -3.116 11.154 -1.773 888 HA TYR 102 HA TYR 102 -0.930 10.165 -0.066 889 HB2 TYR 102 2HB TYR 102 -3.030 8.572 -1.599 890 HB3 TYR 102 3HB TYR 102 -1.894 7.928 -0.414 891 HD1 TYR 102 HD2 TYR 102 -2.045 9.641 1.887 892 HD2 TYR 102 HD1 TYR 102 -5.210 8.496 -0.753 893 HE1 TYR 102 HE2 TYR 102 -3.682 10.028 3.677 894 HE2 TYR 102 HE1 TYR 102 -6.844 8.889 1.043 895 HH TYR 102 HH TYR 102 -6.865 8.964 3.536 896 H GLU 103 H GLU 103 0.703 8.819 -0.871 897 HA GLU 103 HA GLU 103 1.577 9.249 -3.593 898 HB2 GLU 103 2HB GLU 103 2.780 8.447 -1.088 899 HB3 GLU 103 3HB GLU 103 3.081 7.144 -2.221 900 HG2 GLU 103 2HG GLU 103 3.827 10.054 -2.614 901 HG3 GLU 103 3HG GLU 103 4.926 8.759 -2.151 902 H VAL 104 H VAL 104 1.006 7.988 -5.289 903 HA VAL 104 HA VAL 104 0.453 5.128 -4.893 904 HB VAL 104 HB VAL 104 -1.755 6.188 -4.809 905 HG11 VAL 104 1HG1 VAL 104 -2.709 7.432 -6.690 906 HG12 VAL 104 2HG1 VAL 104 -1.173 7.337 -7.554 907 HG13 VAL 104 3HG1 VAL 104 -1.282 8.246 -6.043 908 HG21 VAL 104 3HG2 VAL 104 -2.891 4.886 -6.561 909 HG22 VAL 104 1HG2 VAL 104 -1.587 3.952 -5.827 910 HG23 VAL 104 2HG2 VAL 104 -1.364 4.674 -7.423 911 H ARG 105 H ARG 105 1.015 3.839 -6.616 912 HA ARG 105 HA ARG 105 2.027 5.063 -9.102 913 HB2 ARG 105 2HB ARG 105 3.495 2.912 -7.496 914 HB3 ARG 105 3HB ARG 105 3.985 3.520 -9.072 915 HG2 ARG 105 2HG ARG 105 3.860 5.161 -6.531 916 HG3 ARG 105 3HG ARG 105 5.325 4.458 -7.214 917 HD2 ARG 105 2HD ARG 105 5.261 5.916 -9.100 918 HD3 ARG 105 3HD ARG 105 3.600 6.416 -8.757 919 HE ARG 105 HE ARG 105 4.931 7.162 -6.534 920 HH11 ARG 105 1HH1 ARG 105 5.462 7.877 -9.929 921 HH12 ARG 105 2HH1 ARG 105 6.177 9.420 -9.600 922 HH21 ARG 105 1HH2 ARG 105 5.831 9.172 -6.129 923 HH22 ARG 105 2HH2 ARG 105 6.387 10.152 -7.454 924 H LYS 106 H LYS 106 1.663 3.857 -10.909 925 HA LYS 106 HA LYS 106 0.117 1.337 -10.690 926 HB2 LYS 106 2HB LYS 106 -0.847 3.388 -11.917 927 HB3 LYS 106 3HB LYS 106 0.425 3.211 -13.107 928 HG2 LYS 106 2HG LYS 106 -1.826 1.230 -12.567 929 HG3 LYS 106 3HG LYS 106 -1.709 2.340 -13.931 930 HD2 LYS 106 2HD LYS 106 0.539 1.066 -14.440 931 HD3 LYS 106 3HD LYS 106 -0.127 -0.173 -13.381 932 HE2 LYS 106 2HE LYS 106 -0.650 -0.795 -15.616 933 HE3 LYS 106 3HE LYS 106 -2.153 -0.222 -14.888 934 HZ1 LYS 106 3HZ LYS 106 -1.706 0.611 -17.166 935 HZ2 LYS 106 1HZ LYS 106 -0.383 1.471 -16.562 936 HZ3 LYS 106 2HZ LYS 106 -1.942 1.839 -16.025 937 H VAL 107 H VAL 107 1.150 -0.498 -11.279 938 HA VAL 107 HA VAL 107 3.172 -0.493 -13.420 939 HB VAL 107 HB VAL 107 4.500 -2.262 -12.243 940 HG11 VAL 107 1HG1 VAL 107 4.353 0.344 -10.683 941 HG12 VAL 107 2HG1 VAL 107 5.311 0.046 -12.136 942 HG13 VAL 107 3HG1 VAL 107 5.689 -0.814 -10.645 943 HG21 VAL 107 3HG2 VAL 107 2.743 -1.604 -9.852 944 HG22 VAL 107 1HG2 VAL 107 4.202 -2.597 -9.802 945 HG23 VAL 107 2HG2 VAL 107 2.806 -3.133 -10.730 946 H THR 108 H THR 108 3.464 -2.740 -14.284 947 HA THR 108 HA THR 108 0.999 -4.383 -14.158 948 HB THR 108 HB THR 108 1.572 -5.047 -16.567 949 HG1 THR 108 HG1 THR 108 3.604 -4.369 -16.926 950 HG21 THR 108 3HG2 THR 108 -0.255 -3.445 -16.120 951 HG22 THR 108 1HG2 THR 108 0.601 -3.045 -17.610 952 HG23 THR 108 2HG2 THR 108 0.903 -2.113 -16.143 953 H ASP 109 H ASP 109 4.529 -4.349 -14.706 954 HA ASP 109 HA ASP 109 4.697 -7.251 -14.762 955 HB2 ASP 109 2HB ASP 109 6.871 -5.127 -14.918 956 HB3 ASP 109 3HB ASP 109 7.127 -6.847 -15.170 957 H ASP 110 H ASP 110 6.230 -8.422 -13.478 958 HA ASP 110 HA ASP 110 5.722 -8.187 -10.689 959 HB2 ASP 110 2HB ASP 110 5.882 -10.383 -11.647 960 HB3 ASP 110 3HB ASP 110 7.432 -10.040 -12.402 961 H GLU 111 H GLU 111 8.808 -8.142 -12.527 962 HA GLU 111 HA GLU 111 10.448 -7.349 -10.352 963 HB2 GLU 111 2HB GLU 111 12.222 -7.025 -12.032 964 HB3 GLU 111 3HB GLU 111 11.349 -8.526 -12.315 965 HG2 GLU 111 2HG GLU 111 10.045 -7.387 -14.116 966 HG3 GLU 111 3HG GLU 111 11.019 -5.942 -13.863 967 H GLU 112 H GLU 112 8.618 -5.575 -12.717 968 HA GLU 112 HA GLU 112 9.697 -2.974 -12.306 969 HB2 GLU 112 2HB GLU 112 8.421 -3.573 -14.320 970 HB3 GLU 112 3HB GLU 112 6.985 -3.892 -13.353 971 HG2 GLU 112 2HG GLU 112 6.913 -1.485 -12.730 972 HG3 GLU 112 3HG GLU 112 8.312 -1.197 -13.764 973 H ALA 113 H ALA 113 7.009 -4.796 -10.818 974 HA ALA 113 HA ALA 113 6.109 -2.711 -9.107 975 HB1 ALA 113 3HB ALA 113 4.755 -4.717 -9.583 976 HB2 ALA 113 1HB ALA 113 4.965 -4.495 -7.846 977 HB3 ALA 113 2HB ALA 113 5.902 -5.727 -8.701 978 H LEU 114 H LEU 114 8.414 -5.373 -8.614 979 HA LEU 114 HA LEU 114 8.990 -5.029 -5.898 980 HB2 LEU 114 2HB LEU 114 10.714 -6.122 -8.152 981 HB3 LEU 114 3HB LEU 114 11.141 -6.264 -6.455 982 HG LEU 114 HG LEU 114 8.639 -7.486 -7.696 983 HD11 LEU 114 1HD1 LEU 114 9.774 -9.653 -7.529 984 HD12 LEU 114 2HD1 LEU 114 11.245 -8.862 -6.960 985 HD13 LEU 114 3HD1 LEU 114 10.655 -8.562 -8.596 986 HD21 LEU 114 3HD2 LEU 114 9.858 -7.867 -4.939 987 HD22 LEU 114 1HD2 LEU 114 8.467 -8.744 -5.585 988 HD23 LEU 114 2HD2 LEU 114 8.362 -7.008 -5.312 989 H LYS 115 H LYS 115 10.448 -3.463 -8.748 990 HA LYS 115 HA LYS 115 12.570 -2.185 -7.295 991 HB2 LYS 115 2HB LYS 115 13.113 -1.023 -9.338 992 HB3 LYS 115 3HB LYS 115 12.693 -2.677 -9.754 993 HG2 LYS 115 2HG LYS 115 10.479 -1.936 -10.507 994 HG3 LYS 115 3HG LYS 115 10.870 -0.277 -10.072 995 HD2 LYS 115 2HD LYS 115 12.356 -1.889 -12.189 996 HD3 LYS 115 3HD LYS 115 11.030 -0.779 -12.529 997 HE2 LYS 115 2HE LYS 115 12.979 0.464 -12.986 998 HE3 LYS 115 3HE LYS 115 12.461 1.039 -11.405 999 HZ1 LYS 115 3HZ LYS 115 14.636 -0.913 -11.939 1000 HZ2 LYS 115 1HZ LYS 115 14.141 -0.415 -10.403 1001 HZ3 LYS 115 2HZ LYS 115 14.831 0.695 -11.470 1002 H ILE 116 H ILE 116 9.247 -1.271 -8.117 1003 HA ILE 116 HA ILE 116 9.516 1.502 -7.363 1004 HB ILE 116 HB ILE 116 6.964 -0.142 -7.683 1005 HG12 ILE 116 2HG1 ILE 116 8.233 -0.055 -9.781 1006 HG13 ILE 116 3HG1 ILE 116 6.783 0.917 -9.920 1007 HG21 ILE 116 1HG2 ILE 116 5.803 2.034 -7.940 1008 HG22 ILE 116 2HG2 ILE 116 7.302 2.879 -7.545 1009 HG23 ILE 116 3HG2 ILE 116 6.521 1.855 -6.339 1010 HD11 ILE 116 3HD1 ILE 116 8.670 1.940 -11.013 1011 HD12 ILE 116 1HD1 ILE 116 9.578 1.956 -9.504 1012 HD13 ILE 116 2HD1 ILE 116 8.122 2.940 -9.668 1013 H VAL 117 H VAL 117 8.560 -1.471 -5.702 1014 HA VAL 117 HA VAL 117 7.749 -0.427 -3.220 1015 HB VAL 117 HB VAL 117 9.297 -3.006 -3.790 1016 HG11 VAL 117 1HG1 VAL 117 7.743 -2.266 -1.279 1017 HG12 VAL 117 2HG1 VAL 117 9.492 -2.456 -1.406 1018 HG13 VAL 117 3HG1 VAL 117 8.439 -3.852 -1.626 1019 HG21 VAL 117 3HG2 VAL 117 7.098 -4.125 -3.702 1020 HG22 VAL 117 1HG2 VAL 117 7.153 -2.912 -4.981 1021 HG23 VAL 117 2HG2 VAL 117 6.305 -2.563 -3.475 1022 H ARG 118 H ARG 118 10.963 -1.038 -4.568 1023 HA ARG 118 HA ARG 118 12.470 -0.264 -2.249 1024 HB2 ARG 118 2HB ARG 118 13.353 -0.473 -5.160 1025 HB3 ARG 118 3HB ARG 118 14.432 -0.335 -3.772 1026 HG2 ARG 118 2HG ARG 118 13.556 -2.509 -2.908 1027 HG3 ARG 118 3HG ARG 118 12.554 -2.647 -4.357 1028 HD2 ARG 118 2HD ARG 118 14.557 -3.990 -4.631 1029 HD3 ARG 118 3HD ARG 118 14.618 -2.626 -5.751 1030 HE ARG 118 HE ARG 118 16.190 -1.547 -4.226 1031 HH11 ARG 118 1HH1 ARG 118 15.775 -5.012 -3.783 1032 HH12 ARG 118 2HH1 ARG 118 17.314 -5.216 -3.009 1033 HH21 ARG 118 1HH2 ARG 118 18.195 -1.824 -3.205 1034 HH22 ARG 118 2HH2 ARG 118 18.687 -3.404 -2.682 1035 H GLU 119 H GLU 119 11.234 1.452 -5.096 1036 HA GLU 119 HA GLU 119 12.531 3.939 -4.683 1037 HB2 GLU 119 2HB GLU 119 9.857 3.289 -5.996 1038 HB3 GLU 119 3HB GLU 119 10.587 4.891 -6.027 1039 HG2 GLU 119 2HG GLU 119 11.741 2.369 -7.248 1040 HG3 GLU 119 3HG GLU 119 11.001 3.715 -8.117 1041 H PHE 120 H PHE 120 9.485 2.605 -3.433 1042 HA PHE 120 HA PHE 120 8.595 4.816 -1.945 1043 HB2 PHE 120 2HB PHE 120 8.169 1.844 -1.483 1044 HB3 PHE 120 3HB PHE 120 7.342 3.087 -0.556 1045 HD1 PHE 120 HD2 PHE 120 6.686 5.054 -2.739 1046 HD2 PHE 120 HD1 PHE 120 6.391 0.788 -2.624 1047 HE1 PHE 120 HE2 PHE 120 4.855 5.126 -4.379 1048 HE2 PHE 120 HE1 PHE 120 4.567 0.877 -4.259 1049 HZ PHE 120 HZ PHE 120 3.791 3.039 -5.138 1050 H MET 121 H MET 121 11.123 2.496 -1.247 1051 HA MET 121 HA MET 121 11.383 3.029 1.562 1052 HB2 MET 121 2HB MET 121 13.548 2.003 -0.336 1053 HB3 MET 121 3HB MET 121 13.539 1.871 1.422 1054 HG2 MET 121 2HG MET 121 11.693 0.492 -0.518 1055 HG3 MET 121 3HG MET 121 12.930 -0.251 0.504 1056 HE1 MET 121 3HE MET 121 9.381 -1.422 1.893 1057 HE2 MET 121 1HE MET 121 10.873 -1.969 1.130 1058 HE3 MET 121 2HE MET 121 9.722 -0.992 0.218 1059 H GLN 122 H GLN 122 12.544 4.561 -1.352 1060 HA GLN 122 HA GLN 122 14.496 6.270 -0.042 1061 HB2 GLN 122 2HB GLN 122 13.347 6.422 -2.865 1062 HB3 GLN 122 3HB GLN 122 14.756 7.299 -2.282 1063 HG2 GLN 122 2HG GLN 122 14.525 4.293 -2.592 1064 HG3 GLN 122 3HG GLN 122 15.408 5.381 -3.657 1065 HE21 GLN 122 1HE2 GLN 122 17.376 6.298 -2.899 1066 HE22 GLN 122 2HE2 GLN 122 18.238 5.626 -1.561 1067 H LYS 123 H LYS 123 11.192 6.480 -1.202 1068 HA LYS 123 HA LYS 123 10.728 9.270 -0.751 1069 HB2 LYS 123 2HB LYS 123 8.833 6.900 -1.040 1070 HB3 LYS 123 3HB LYS 123 8.307 8.581 -1.014 1071 HG2 LYS 123 2HG LYS 123 9.396 9.053 -3.106 1072 HG3 LYS 123 3HG LYS 123 10.254 7.507 -3.083 1073 HD2 LYS 123 2HD LYS 123 8.158 6.286 -3.379 1074 HD3 LYS 123 3HD LYS 123 7.229 7.788 -3.274 1075 HE2 LYS 123 2HE LYS 123 7.463 7.024 -5.604 1076 HE3 LYS 123 3HE LYS 123 8.250 8.583 -5.365 1077 HZ1 LYS 123 3HZ LYS 123 10.375 7.432 -5.218 1078 HZ2 LYS 123 1HZ LYS 123 9.608 7.119 -6.690 1079 HZ3 LYS 123 2HZ LYS 123 9.610 5.950 -5.472 1080 H ALA 124 H ALA 124 10.188 6.331 1.140 1081 HA ALA 124 HA ALA 124 9.055 7.613 3.456 1082 HB1 ALA 124 3HB ALA 124 9.338 5.398 4.522 1083 HB2 ALA 124 1HB ALA 124 10.290 4.845 3.139 1084 HB3 ALA 124 2HB ALA 124 8.585 5.254 2.934 1085 H GLY 125 H GLY 125 12.273 6.700 2.343 1086 HA2 GLY 125 2HA GLY 125 13.751 7.239 4.713 1087 HA3 GLY 125 3HA GLY 125 14.387 7.195 3.069 1088 H SER 126 H SER 126 12.341 9.307 2.295 1089 HA SER 126 HA SER 126 13.821 11.691 2.877 1090 HB2 SER 126 2HB SER 126 12.576 11.485 0.774 1091 HB3 SER 126 3HB SER 126 11.052 11.305 1.645 1092 HG SER 126 HG SER 126 12.670 13.591 1.299 1093 H LEU 127 H LEU 127 11.110 10.050 4.319 1094 HA LEU 127 HA LEU 127 10.131 12.260 5.919 1095 HB2 LEU 127 2HB LEU 127 9.551 9.273 6.135 1096 HB3 LEU 127 3HB LEU 127 8.620 10.563 6.889 1097 HG LEU 127 HG LEU 127 8.895 10.208 3.880 1098 HD11 LEU 127 1HD1 LEU 127 7.726 8.286 4.809 1099 HD12 LEU 127 2HD1 LEU 127 6.616 9.303 3.897 1100 HD13 LEU 127 3HD1 LEU 127 6.599 9.346 5.662 1101 HD21 LEU 127 3HD2 LEU 127 8.416 12.516 4.509 1102 HD22 LEU 127 1HD2 LEU 127 7.045 11.994 5.494 1103 HD23 LEU 127 2HD2 LEU 127 7.008 11.791 3.741 1104 H GLU 128 H GLU 128 12.190 9.439 6.359 1105 HA GLU 128 HA GLU 128 12.633 9.720 9.192 1106 HB2 GLU 128 2HB GLU 128 14.245 8.210 7.091 1107 HB3 GLU 128 3HB GLU 128 14.404 8.019 8.836 1108 HG2 GLU 128 2HG GLU 128 12.122 7.140 8.969 1109 HG3 GLU 128 3HG GLU 128 11.922 7.362 7.227 1110 H HIS 129 H HIS 129 14.623 10.261 6.313 1111 HA HIS 129 HA HIS 129 16.582 11.878 7.780 1112 HB2 HIS 129 2HB HIS 129 17.230 9.997 6.159 1113 HB3 HIS 129 3HB HIS 129 16.617 11.002 4.850 1114 HD1 HIS 129 HD1 HIS 129 18.418 12.285 3.711 1115 HD2 HIS 129 HD2 HIS 129 19.380 11.498 7.672 1116 HE1 HIS 129 HE1 HIS 129 20.740 13.175 4.028 1117 HE2 HIS 129 HE2 HIS 129 21.353 12.541 6.377 1118 H HIS 130 H HIS 130 14.015 12.908 7.578 1119 HA HIS 130 HA HIS 130 13.503 14.817 5.654 1120 HB2 HIS 130 2HB HIS 130 12.212 15.997 7.583 1121 HB3 HIS 130 3HB HIS 130 11.731 14.368 7.134 1122 HD1 HIS 130 HD1 HIS 130 10.601 14.300 9.539 1123 HD2 HIS 130 HD2 HIS 130 14.759 14.418 9.577 1124 HE1 HIS 130 HE1 HIS 130 11.290 13.592 11.850 1125 HE2 HIS 130 HE2 HIS 130 13.786 13.797 11.880 1126 H HIS 131 H HIS 131 14.365 16.704 5.132 1127 HA HIS 131 HA HIS 131 16.884 17.513 6.112 1128 HB2 HIS 131 2HB HIS 131 14.919 18.978 4.306 1129 HB3 HIS 131 3HB HIS 131 16.594 19.467 4.562 1130 HD1 HIS 131 HD1 HIS 131 14.553 17.443 2.360 1131 HD2 HIS 131 HD2 HIS 131 18.484 17.318 3.706 1132 HE1 HIS 131 HE1 HIS 131 15.759 15.911 0.776 1133 HE2 HIS 131 HE2 HIS 131 18.150 15.940 1.545 1134 H HIS 132 H HIS 132 17.387 18.697 7.803 1135 HA HIS 132 HA HIS 132 15.646 19.410 9.830 1136 HB2 HIS 132 2HB HIS 132 18.136 18.957 9.997 1137 HB3 HIS 132 3HB HIS 132 18.423 20.580 9.390 1138 HD1 HIS 132 HD1 HIS 132 18.124 22.525 11.052 1139 HD2 HIS 132 HD2 HIS 132 17.160 18.808 12.645 1140 HE1 HIS 132 HE1 HIS 132 17.951 22.878 13.529 1141 HE2 HIS 132 HE2 HIS 132 17.316 20.632 14.467 1142 H HIS 133 H HIS 133 17.024 21.442 7.294 1143 HA HIS 133 HA HIS 133 14.978 23.500 7.840 1144 HB2 HIS 133 2HB HIS 133 16.221 24.892 6.177 1145 HB3 HIS 133 3HB HIS 133 17.211 24.443 7.552 1146 HD1 HIS 133 HD1 HIS 133 19.233 22.858 7.083 1147 HD2 HIS 133 HD2 HIS 133 17.136 23.971 3.679 1148 HE1 HIS 133 HE1 HIS 133 20.713 22.252 5.150 1149 HE2 HIS 133 HE2 HIS 133 19.330 22.746 3.115 1150 H HIS 134 H HIS 134 13.088 23.052 6.872 1151 HA HIS 134 HA HIS 134 12.935 21.292 4.533 1152 HB2 HIS 134 2HB HIS 134 10.770 22.525 6.290 1153 HB3 HIS 134 3HB HIS 134 10.441 21.456 4.929 1154 HD1 HIS 134 HD1 HIS 134 11.453 21.459 8.484 1155 HD2 HIS 134 HD2 HIS 134 11.216 18.728 5.367 1156 HE1 HIS 134 HE1 HIS 134 11.631 19.209 9.557 1157 HE2 HIS 134 HE2 HIS 134 11.224 17.587 7.680 Start of MODEL 20 1 H1 MET 1 1H MET 1 1.828 9.635 14.017 2 H2 MET 1 2H MET 1 2.482 11.189 14.015 3 H3 MET 1 3H MET 1 3.414 9.873 14.514 4 HA MET 1 HA MET 1 2.338 10.241 11.792 5 HB2 MET 1 2HB MET 1 4.054 11.918 12.159 6 HB3 MET 1 3HB MET 1 5.120 10.750 12.927 7 HG2 MET 1 2HG MET 1 5.840 11.371 10.638 8 HG3 MET 1 3HG MET 1 5.525 9.644 10.811 9 HE1 MET 1 3HE MET 1 5.459 9.314 8.181 10 HE2 MET 1 1HE MET 1 5.824 11.029 7.973 11 HE3 MET 1 2HE MET 1 4.474 10.303 7.103 12 H LYS 2 H LYS 2 2.913 8.599 10.341 13 HA LYS 2 HA LYS 2 4.347 6.240 11.195 14 HB2 LYS 2 2HB LYS 2 1.717 6.282 11.975 15 HB3 LYS 2 3HB LYS 2 1.499 5.650 10.346 16 HG2 LYS 2 2HG LYS 2 2.982 3.761 10.860 17 HG3 LYS 2 3HG LYS 2 3.304 4.430 12.466 18 HD2 LYS 2 2HD LYS 2 0.820 4.218 12.956 19 HD3 LYS 2 3HD LYS 2 0.652 3.358 11.419 20 HE2 LYS 2 2HE LYS 2 0.819 1.778 13.287 21 HE3 LYS 2 3HE LYS 2 2.229 1.627 12.234 22 HZ1 LYS 2 3HZ LYS 2 3.467 3.020 13.810 23 HZ2 LYS 2 1HZ LYS 2 2.890 1.600 14.533 24 HZ3 LYS 2 2HZ LYS 2 2.114 3.078 14.823 25 H ILE 3 H ILE 3 4.684 4.786 9.369 26 HA ILE 3 HA ILE 3 4.203 5.999 6.695 27 HB ILE 3 HB ILE 3 6.609 4.316 7.571 28 HG12 ILE 3 2HG1 ILE 3 6.485 7.301 6.906 29 HG13 ILE 3 3HG1 ILE 3 6.726 6.617 8.512 30 HG21 ILE 3 1HG2 ILE 3 7.534 4.801 5.314 31 HG22 ILE 3 2HG2 ILE 3 6.040 5.635 4.883 32 HG23 ILE 3 3HG2 ILE 3 6.018 3.902 5.217 33 HD11 ILE 3 3HD1 ILE 3 8.807 7.399 7.605 34 HD12 ILE 3 1HD1 ILE 3 8.610 6.392 6.171 35 HD13 ILE 3 2HD1 ILE 3 8.851 5.643 7.753 36 H LEU 4 H LEU 4 2.544 4.786 5.867 37 HA LEU 4 HA LEU 4 2.708 1.821 6.045 38 HB2 LEU 4 2HB LEU 4 0.338 3.702 5.858 39 HB3 LEU 4 3HB LEU 4 0.198 2.070 5.227 40 HG LEU 4 HG LEU 4 0.767 1.163 7.495 41 HD11 LEU 4 1HD1 LEU 4 0.659 2.606 9.479 42 HD12 LEU 4 2HD1 LEU 4 0.578 4.033 8.445 43 HD13 LEU 4 3HD1 LEU 4 2.020 3.021 8.441 44 HD21 LEU 4 3HD2 LEU 4 -1.550 1.323 6.775 45 HD22 LEU 4 1HD2 LEU 4 -1.657 2.978 7.385 46 HD23 LEU 4 2HD2 LEU 4 -1.421 1.632 8.504 47 H ILE 5 H ILE 5 3.026 0.721 4.211 48 HA ILE 5 HA ILE 5 2.622 2.072 1.604 49 HB ILE 5 HB ILE 5 4.513 -0.261 2.202 50 HG12 ILE 5 2HG1 ILE 5 5.112 2.686 1.636 51 HG13 ILE 5 3HG1 ILE 5 5.438 1.818 3.131 52 HG21 ILE 5 1HG2 ILE 5 5.275 -0.005 -0.148 53 HG22 ILE 5 2HG2 ILE 5 4.068 1.256 -0.409 54 HG23 ILE 5 3HG2 ILE 5 3.556 -0.400 -0.076 55 HD11 ILE 5 3HD1 ILE 5 7.468 2.172 1.885 56 HD12 ILE 5 1HD1 ILE 5 6.791 1.362 0.472 57 HD13 ILE 5 2HD1 ILE 5 7.102 0.449 1.952 58 H LEU 6 H LEU 6 0.831 1.409 0.680 59 HA LEU 6 HA LEU 6 -0.479 -1.111 1.379 60 HB2 LEU 6 2HB LEU 6 -1.394 1.150 -0.453 61 HB3 LEU 6 3HB LEU 6 -2.374 -0.210 0.076 62 HG LEU 6 HG LEU 6 -1.314 2.027 1.822 63 HD11 LEU 6 1HD1 LEU 6 -3.178 2.744 0.399 64 HD12 LEU 6 2HD1 LEU 6 -3.672 2.676 2.087 65 HD13 LEU 6 3HD1 LEU 6 -4.164 1.395 0.975 66 HD21 LEU 6 3HD2 LEU 6 -2.568 1.035 3.661 67 HD22 LEU 6 1HD2 LEU 6 -1.342 -0.081 3.064 68 HD23 LEU 6 2HD2 LEU 6 -3.039 -0.324 2.634 69 H ILE 7 H ILE 7 -0.260 -2.844 0.133 70 HA ILE 7 HA ILE 7 0.539 -2.576 -2.719 71 HB ILE 7 HB ILE 7 0.966 -4.985 -0.883 72 HG12 ILE 7 2HG1 ILE 7 2.523 -3.137 -0.343 73 HG13 ILE 7 3HG1 ILE 7 3.384 -4.488 -1.065 74 HG21 ILE 7 1HG2 ILE 7 0.558 -5.712 -3.193 75 HG22 ILE 7 2HG2 ILE 7 2.255 -5.959 -2.780 76 HG23 ILE 7 3HG2 ILE 7 1.784 -4.591 -3.794 77 HD11 ILE 7 3HD1 ILE 7 4.217 -2.362 -1.874 78 HD12 ILE 7 1HD1 ILE 7 2.615 -1.928 -2.467 79 HD13 ILE 7 2HD1 ILE 7 3.492 -3.279 -3.194 80 H ASN 8 H ASN 8 -1.148 -2.809 -3.985 81 HA ASN 8 HA ASN 8 -3.147 -4.930 -3.470 82 HB2 ASN 8 2HB ASN 8 -4.179 -2.696 -3.222 83 HB3 ASN 8 3HB ASN 8 -3.579 -2.213 -4.800 84 HD21 ASN 8 1HD2 ASN 8 -5.739 -4.453 -3.145 85 HD22 ASN 8 2HD2 ASN 8 -6.823 -4.680 -4.474 86 H THR 9 H THR 9 -2.299 -6.500 -4.727 87 HA THR 9 HA THR 9 -2.304 -5.971 -7.616 88 HB THR 9 HB THR 9 0.065 -6.221 -6.953 89 HG1 THR 9 HG1 THR 9 0.481 -7.953 -8.500 90 HG21 THR 9 3HG2 THR 9 0.938 -8.394 -6.244 91 HG22 THR 9 1HG2 THR 9 -0.705 -9.031 -6.133 92 HG23 THR 9 2HG2 THR 9 -0.181 -7.744 -5.043 93 H ASN 10 H ASN 10 -3.083 -7.552 -8.909 94 HA ASN 10 HA ASN 10 -5.085 -9.284 -7.894 95 HB2 ASN 10 2HB ASN 10 -5.076 -8.300 -10.199 96 HB3 ASN 10 3HB ASN 10 -3.719 -9.341 -10.623 97 HD21 ASN 10 1HD2 ASN 10 -4.869 -10.393 -12.259 98 HD22 ASN 10 2HD2 ASN 10 -6.158 -11.493 -11.940 99 H ASN 11 H ASN 11 -1.716 -9.858 -8.964 100 HA ASN 11 HA ASN 11 -1.924 -12.736 -8.482 101 HB2 ASN 11 2HB ASN 11 0.505 -12.784 -9.307 102 HB3 ASN 11 3HB ASN 11 -0.714 -12.289 -10.468 103 HD21 ASN 11 1HD2 ASN 11 0.838 -11.291 -11.767 104 HD22 ASN 11 2HD2 ASN 11 1.607 -9.810 -11.319 105 H ASP 12 H ASP 12 -1.844 -13.382 -6.459 106 HA ASP 12 HA ASP 12 -0.933 -11.978 -4.207 107 HB2 ASP 12 2HB ASP 12 -2.643 -13.846 -4.309 108 HB3 ASP 12 3HB ASP 12 -1.324 -14.998 -4.463 109 H GLU 13 H GLU 13 0.702 -14.252 -6.275 110 HA GLU 13 HA GLU 13 2.838 -15.120 -4.678 111 HB2 GLU 13 2HB GLU 13 3.915 -15.768 -6.817 112 HB3 GLU 13 3HB GLU 13 2.223 -16.257 -6.750 113 HG2 GLU 13 2HG GLU 13 1.597 -14.325 -8.160 114 HG3 GLU 13 3HG GLU 13 3.285 -13.815 -8.209 115 H LEU 14 H LEU 14 2.441 -12.219 -6.621 116 HA LEU 14 HA LEU 14 5.109 -11.307 -6.684 117 HB2 LEU 14 2HB LEU 14 3.470 -10.407 -8.201 118 HB3 LEU 14 3HB LEU 14 2.443 -9.880 -6.883 119 HG LEU 14 HG LEU 14 3.972 -8.078 -6.308 120 HD11 LEU 14 1HD1 LEU 14 6.130 -9.090 -6.691 121 HD12 LEU 14 2HD1 LEU 14 6.025 -7.589 -7.606 122 HD13 LEU 14 3HD1 LEU 14 5.853 -9.138 -8.432 123 HD21 LEU 14 3HD2 LEU 14 3.494 -8.122 -9.307 124 HD22 LEU 14 1HD2 LEU 14 3.800 -6.692 -8.317 125 HD23 LEU 14 2HD2 LEU 14 2.327 -7.627 -8.074 126 H ILE 15 H ILE 15 2.453 -10.762 -4.355 127 HA ILE 15 HA ILE 15 3.791 -8.725 -2.895 128 HB ILE 15 HB ILE 15 1.666 -10.487 -1.587 129 HG12 ILE 15 2HG1 ILE 15 1.184 -8.076 -3.397 130 HG13 ILE 15 3HG1 ILE 15 0.826 -9.744 -3.821 131 HG21 ILE 15 1HG2 ILE 15 1.188 -8.327 -0.371 132 HG22 ILE 15 2HG2 ILE 15 2.531 -7.575 -1.225 133 HG23 ILE 15 3HG2 ILE 15 2.830 -8.907 -0.108 134 HD11 ILE 15 3HD1 ILE 15 -1.169 -8.523 -3.198 135 HD12 ILE 15 1HD1 ILE 15 -0.485 -8.165 -1.613 136 HD13 ILE 15 2HD1 ILE 15 -0.861 -9.833 -2.058 137 H LYS 16 H LYS 16 3.668 -12.255 -2.575 138 HA LYS 16 HA LYS 16 4.903 -12.800 -0.187 139 HB2 LYS 16 2HB LYS 16 5.454 -14.106 -2.886 140 HB3 LYS 16 3HB LYS 16 5.943 -14.796 -1.341 141 HG2 LYS 16 2HG LYS 16 3.592 -15.033 -0.680 142 HG3 LYS 16 3HG LYS 16 3.074 -14.288 -2.199 143 HD2 LYS 16 2HD LYS 16 3.991 -16.140 -3.488 144 HD3 LYS 16 3HD LYS 16 4.725 -16.847 -2.047 145 HE2 LYS 16 2HE LYS 16 1.729 -16.524 -2.439 146 HE3 LYS 16 3HE LYS 16 2.634 -17.997 -2.804 147 HZ1 LYS 16 3HZ LYS 16 2.501 -16.708 -0.134 148 HZ2 LYS 16 1HZ LYS 16 3.290 -18.158 -0.508 149 HZ3 LYS 16 2HZ LYS 16 1.606 -18.058 -0.610 150 H LYS 17 H LYS 17 6.426 -11.758 -3.193 151 HA LYS 17 HA LYS 17 9.149 -11.861 -2.239 152 HB2 LYS 17 2HB LYS 17 7.998 -10.615 -4.774 153 HB3 LYS 17 3HB LYS 17 9.703 -10.954 -4.464 154 HG2 LYS 17 2HG LYS 17 9.212 -13.376 -4.377 155 HG3 LYS 17 3HG LYS 17 7.503 -13.042 -4.670 156 HD2 LYS 17 2HD LYS 17 8.628 -13.759 -6.737 157 HD3 LYS 17 3HD LYS 17 8.050 -12.097 -6.880 158 HE2 LYS 17 2HE LYS 17 10.284 -11.228 -6.555 159 HE3 LYS 17 3HE LYS 17 10.910 -12.833 -6.170 160 HZ1 LYS 17 3HZ LYS 17 9.805 -11.990 -8.790 161 HZ2 LYS 17 1HZ LYS 17 10.396 -13.525 -8.413 162 HZ3 LYS 17 2HZ LYS 17 11.436 -12.206 -8.419 163 H ILE 18 H ILE 18 6.714 -9.335 -2.817 164 HA ILE 18 HA ILE 18 8.307 -7.038 -2.328 165 HB ILE 18 HB ILE 18 5.292 -7.448 -1.998 166 HG12 ILE 18 2HG1 ILE 18 6.917 -6.238 -4.292 167 HG13 ILE 18 3HG1 ILE 18 6.090 -7.791 -4.318 168 HG21 ILE 18 1HG2 ILE 18 6.823 -4.818 -2.025 169 HG22 ILE 18 2HG2 ILE 18 5.971 -5.513 -0.645 170 HG23 ILE 18 3HG2 ILE 18 5.065 -4.977 -2.059 171 HD11 ILE 18 3HD1 ILE 18 4.854 -6.142 -5.561 172 HD12 ILE 18 1HD1 ILE 18 4.783 -5.077 -4.157 173 HD13 ILE 18 2HD1 ILE 18 3.936 -6.626 -4.135 174 H LYS 19 H LYS 19 6.622 -9.252 -0.204 175 HA LYS 19 HA LYS 19 6.728 -7.769 2.219 176 HB2 LYS 19 2HB LYS 19 6.484 -10.770 1.722 177 HB3 LYS 19 3HB LYS 19 6.282 -10.006 3.299 178 HG2 LYS 19 2HG LYS 19 4.323 -8.806 2.536 179 HG3 LYS 19 3HG LYS 19 4.576 -9.341 0.885 180 HD2 LYS 19 2HD LYS 19 2.763 -10.617 1.938 181 HD3 LYS 19 3HD LYS 19 4.119 -11.672 1.535 182 HE2 LYS 19 2HE LYS 19 4.842 -11.686 3.866 183 HE3 LYS 19 3HE LYS 19 3.581 -10.529 4.296 184 HZ1 LYS 19 3HZ LYS 19 3.204 -13.314 3.378 185 HZ2 LYS 19 1HZ LYS 19 1.950 -12.204 3.572 186 HZ3 LYS 19 2HZ LYS 19 2.862 -12.676 4.901 187 H LYS 20 H LYS 20 8.747 -10.425 0.898 188 HA LYS 20 HA LYS 20 10.721 -10.531 2.893 189 HB2 LYS 20 2HB LYS 20 10.888 -11.163 -0.086 190 HB3 LYS 20 3HB LYS 20 12.180 -11.536 1.048 191 HG2 LYS 20 2HG LYS 20 9.365 -12.680 1.152 192 HG3 LYS 20 3HG LYS 20 10.795 -13.506 0.520 193 HD2 LYS 20 2HD LYS 20 11.835 -13.202 2.850 194 HD3 LYS 20 3HD LYS 20 10.234 -12.695 3.402 195 HE2 LYS 20 2HE LYS 20 10.909 -15.388 2.157 196 HE3 LYS 20 3HE LYS 20 10.680 -15.080 3.879 197 HZ1 LYS 20 3HZ LYS 20 8.606 -14.641 1.815 198 HZ2 LYS 20 1HZ LYS 20 8.411 -14.528 3.488 199 HZ3 LYS 20 2HZ LYS 20 8.723 -16.026 2.772 200 H GLU 21 H GLU 21 10.386 -8.462 0.077 201 HA GLU 21 HA GLU 21 12.909 -7.219 0.013 202 HB2 GLU 21 2HB GLU 21 11.286 -7.166 -1.870 203 HB3 GLU 21 3HB GLU 21 10.192 -6.177 -0.914 204 HG2 GLU 21 2HG GLU 21 11.318 -4.764 -2.501 205 HG3 GLU 21 3HG GLU 21 11.902 -4.366 -0.886 206 H VAL 22 H VAL 22 9.809 -6.119 1.483 207 HA VAL 22 HA VAL 22 10.946 -3.689 2.502 208 HB VAL 22 HB VAL 22 8.814 -3.288 3.621 209 HG11 VAL 22 1HG1 VAL 22 7.328 -3.267 1.652 210 HG12 VAL 22 2HG1 VAL 22 8.415 -4.377 0.812 211 HG13 VAL 22 3HG1 VAL 22 8.965 -2.755 1.239 212 HG21 VAL 22 3HG2 VAL 22 6.949 -4.910 3.526 213 HG22 VAL 22 1HG2 VAL 22 8.314 -5.539 4.450 214 HG23 VAL 22 2HG2 VAL 22 8.025 -6.109 2.804 215 H GLU 23 H GLU 23 10.564 -6.912 3.779 216 HA GLU 23 HA GLU 23 10.919 -6.398 6.551 217 HB2 GLU 23 2HB GLU 23 11.395 -8.894 4.874 218 HB3 GLU 23 3HB GLU 23 11.640 -8.867 6.620 219 HG2 GLU 23 2HG GLU 23 9.285 -8.280 6.967 220 HG3 GLU 23 3HG GLU 23 9.018 -8.252 5.226 221 H ASN 24 H ASN 24 13.204 -6.688 3.891 222 HA ASN 24 HA ASN 24 15.644 -6.828 5.281 223 HB2 ASN 24 2HB ASN 24 15.060 -5.297 2.700 224 HB3 ASN 24 3HB ASN 24 16.666 -5.742 3.275 225 HD21 ASN 24 1HD2 ASN 24 15.256 -6.415 0.795 226 HD22 ASN 24 2HD2 ASN 24 15.264 -8.140 0.704 227 H GLN 25 H GLN 25 13.459 -4.142 4.696 228 HA GLN 25 HA GLN 25 15.213 -2.182 6.012 229 HB2 GLN 25 2HB GLN 25 12.590 -1.883 4.491 230 HB3 GLN 25 3HB GLN 25 13.410 -0.545 5.287 231 HG2 GLN 25 2HG GLN 25 14.470 -2.186 2.969 232 HG3 GLN 25 3HG GLN 25 13.896 -0.519 2.912 233 HE21 GLN 25 1HE2 GLN 25 16.529 -2.611 3.841 234 HE22 GLN 25 2HE2 GLN 25 17.674 -1.360 4.166 235 H GLY 26 H GLY 26 13.310 -4.469 7.171 236 HA2 GLY 26 2HA GLY 26 12.680 -4.856 9.338 237 HA3 GLY 26 3HA GLY 26 13.085 -3.192 9.732 238 H TYR 27 H TYR 27 10.852 -3.745 7.116 239 HA TYR 27 HA TYR 27 8.759 -2.324 8.486 240 HB2 TYR 27 2HB TYR 27 8.857 -3.622 5.732 241 HB3 TYR 27 3HB TYR 27 7.423 -2.806 6.351 242 HD1 TYR 27 HD1 TYR 27 10.821 -1.449 7.049 243 HD2 TYR 27 HD2 TYR 27 7.407 -1.199 4.489 244 HE1 TYR 27 HE1 TYR 27 11.643 0.686 6.158 245 HE2 TYR 27 HE2 TYR 27 8.241 0.934 3.608 246 HH TYR 27 HH TYR 27 11.420 2.076 4.193 247 H GLN 28 H GLN 28 7.030 -3.108 9.481 248 HA GLN 28 HA GLN 28 6.686 -5.929 10.014 249 HB2 GLN 28 2HB GLN 28 6.227 -4.225 11.769 250 HB3 GLN 28 3HB GLN 28 5.014 -3.473 10.738 251 HG2 GLN 28 2HG GLN 28 3.768 -5.716 10.825 252 HG3 GLN 28 3HG GLN 28 4.870 -6.161 12.120 253 HE21 GLN 28 1HE2 GLN 28 4.916 -3.435 13.267 254 HE22 GLN 28 2HE2 GLN 28 3.381 -3.230 14.022 255 H VAL 29 H VAL 29 5.471 -7.246 8.675 256 HA VAL 29 HA VAL 29 3.649 -5.966 6.721 257 HB VAL 29 HB VAL 29 4.599 -8.867 6.606 258 HG11 VAL 29 1HG1 VAL 29 3.433 -7.023 4.478 259 HG12 VAL 29 2HG1 VAL 29 2.547 -8.294 5.325 260 HG13 VAL 29 3HG1 VAL 29 3.883 -8.714 4.262 261 HG21 VAL 29 3HG2 VAL 29 5.861 -6.460 5.222 262 HG22 VAL 29 1HG2 VAL 29 6.293 -8.151 4.935 263 HG23 VAL 29 2HG2 VAL 29 6.600 -7.413 6.510 264 H ARG 30 H ARG 30 1.524 -6.510 6.607 265 HA ARG 30 HA ARG 30 0.380 -8.602 8.361 266 HB2 ARG 30 2HB ARG 30 -0.165 -6.512 9.451 267 HB3 ARG 30 3HB ARG 30 -0.554 -5.730 7.919 268 HG2 ARG 30 2HG ARG 30 -2.533 -7.164 7.672 269 HG3 ARG 30 3HG ARG 30 -2.167 -7.963 9.204 270 HD2 ARG 30 2HD ARG 30 -2.579 -5.932 10.433 271 HD3 ARG 30 3HD ARG 30 -2.670 -4.985 8.940 272 HE ARG 30 HE ARG 30 -4.785 -5.793 8.525 273 HH11 ARG 30 1HH1 ARG 30 -3.507 -7.497 11.321 274 HH12 ARG 30 2HH1 ARG 30 -5.051 -8.138 11.773 275 HH21 ARG 30 1HH2 ARG 30 -6.783 -6.508 9.176 276 HH22 ARG 30 2HH2 ARG 30 -6.925 -7.572 10.548 277 H ASP 31 H ASP 31 -1.211 -9.825 7.372 278 HA ASP 31 HA ASP 31 -1.807 -9.348 4.502 279 HB2 ASP 31 2HB ASP 31 -1.895 -11.960 6.099 280 HB3 ASP 31 3HB ASP 31 -2.259 -11.799 4.382 281 H VAL 32 H VAL 32 -3.770 -8.601 4.155 282 HA VAL 32 HA VAL 32 -5.954 -8.938 6.127 283 HB VAL 32 HB VAL 32 -5.800 -6.882 3.862 284 HG11 VAL 32 1HG1 VAL 32 -7.570 -5.692 5.117 285 HG12 VAL 32 2HG1 VAL 32 -7.586 -6.971 6.334 286 HG13 VAL 32 3HG1 VAL 32 -8.091 -7.321 4.678 287 HG21 VAL 32 3HG2 VAL 32 -5.086 -5.222 5.538 288 HG22 VAL 32 1HG2 VAL 32 -3.908 -6.533 5.403 289 HG23 VAL 32 2HG2 VAL 32 -5.020 -6.478 6.778 290 H ASN 33 H ASN 33 -7.749 -10.059 5.518 291 HA ASN 33 HA ASN 33 -8.043 -10.993 2.707 292 HB2 ASN 33 2HB ASN 33 -9.199 -12.311 5.217 293 HB3 ASN 33 3HB ASN 33 -9.162 -12.981 3.590 294 HD21 ASN 33 1HD2 ASN 33 -7.276 -12.283 6.462 295 HD22 ASN 33 2HD2 ASN 33 -5.924 -13.280 6.059 296 H ASP 34 H ASP 34 -9.836 -9.927 5.605 297 HA ASP 34 HA ASP 34 -12.282 -9.488 3.976 298 HB2 ASP 34 2HB ASP 34 -12.433 -11.504 5.411 299 HB3 ASP 34 3HB ASP 34 -12.056 -10.543 6.833 300 H SER 35 H SER 35 -13.822 -7.975 4.874 301 HA SER 35 HA SER 35 -12.752 -5.407 5.364 302 HB2 SER 35 2HB SER 35 -15.256 -4.811 5.571 303 HB3 SER 35 3HB SER 35 -14.737 -5.562 4.060 304 HG SER 35 HG SER 35 -15.794 -7.354 4.549 305 H ASP 36 H ASP 36 -14.176 -7.810 7.566 306 HA ASP 36 HA ASP 36 -14.409 -6.089 9.825 307 HB2 ASP 36 2HB ASP 36 -14.204 -9.109 9.578 308 HB3 ASP 36 3HB ASP 36 -14.170 -8.341 11.165 309 H GLU 37 H GLU 37 -11.749 -8.100 8.599 310 HA GLU 37 HA GLU 37 -9.906 -7.570 10.705 311 HB2 GLU 37 2HB GLU 37 -9.336 -8.278 7.792 312 HB3 GLU 37 3HB GLU 37 -8.160 -8.333 9.110 313 HG2 GLU 37 2HG GLU 37 -9.552 -10.041 10.248 314 HG3 GLU 37 3HG GLU 37 -10.666 -10.023 8.878 315 H LEU 38 H LEU 38 -10.741 -5.888 7.729 316 HA LEU 38 HA LEU 38 -8.722 -3.950 7.626 317 HB2 LEU 38 2HB LEU 38 -10.309 -4.311 5.774 318 HB3 LEU 38 3HB LEU 38 -11.632 -3.729 6.774 319 HG LEU 38 HG LEU 38 -10.438 -1.469 6.878 320 HD11 LEU 38 1HD1 LEU 38 -8.752 -0.957 5.186 321 HD12 LEU 38 2HD1 LEU 38 -8.710 -2.652 4.693 322 HD13 LEU 38 3HD1 LEU 38 -8.188 -2.187 6.316 323 HD21 LEU 38 3HD2 LEU 38 -11.352 -2.424 4.148 324 HD22 LEU 38 1HD2 LEU 38 -11.212 -0.739 4.661 325 HD23 LEU 38 2HD2 LEU 38 -12.379 -1.803 5.442 326 H LYS 39 H LYS 39 -11.994 -3.719 9.151 327 HA LYS 39 HA LYS 39 -11.527 -1.104 10.157 328 HB2 LYS 39 2HB LYS 39 -13.642 -1.389 11.426 329 HB3 LYS 39 3HB LYS 39 -13.789 -1.803 9.732 330 HG2 LYS 39 2HG LYS 39 -15.036 -3.482 10.691 331 HG3 LYS 39 3HG LYS 39 -13.462 -4.266 10.570 332 HD2 LYS 39 2HD LYS 39 -13.027 -3.727 12.962 333 HD3 LYS 39 3HD LYS 39 -14.620 -2.971 13.074 334 HE2 LYS 39 2HE LYS 39 -14.104 -5.888 12.405 335 HE3 LYS 39 3HE LYS 39 -14.586 -5.275 13.987 336 HZ1 LYS 39 3HZ LYS 39 -16.193 -4.905 11.537 337 HZ2 LYS 39 1HZ LYS 39 -16.666 -4.612 13.130 338 HZ3 LYS 39 2HZ LYS 39 -16.408 -6.198 12.603 339 H LYS 40 H LYS 40 -10.965 -4.303 11.516 340 HA LYS 40 HA LYS 40 -10.438 -3.546 14.199 341 HB2 LYS 40 2HB LYS 40 -9.472 -5.921 12.567 342 HB3 LYS 40 3HB LYS 40 -9.098 -5.730 14.276 343 HG2 LYS 40 2HG LYS 40 -11.899 -5.918 13.123 344 HG3 LYS 40 3HG LYS 40 -11.012 -7.260 13.845 345 HD2 LYS 40 2HD LYS 40 -11.751 -4.700 15.330 346 HD3 LYS 40 3HD LYS 40 -12.708 -6.182 15.377 347 HE2 LYS 40 2HE LYS 40 -9.829 -5.922 16.314 348 HE3 LYS 40 3HE LYS 40 -11.243 -5.950 17.362 349 HZ1 LYS 40 3HZ LYS 40 -11.723 -8.195 16.552 350 HZ2 LYS 40 1HZ LYS 40 -10.204 -8.101 17.286 351 HZ3 LYS 40 2HZ LYS 40 -10.328 -8.161 15.605 352 H GLU 41 H GLU 41 -8.234 -3.893 11.365 353 HA GLU 41 HA GLU 41 -5.889 -3.242 12.873 354 HB2 GLU 41 2HB GLU 41 -4.686 -3.275 10.818 355 HB3 GLU 41 3HB GLU 41 -5.917 -4.523 10.673 356 HG2 GLU 41 2HG GLU 41 -7.297 -2.733 9.415 357 HG3 GLU 41 3HG GLU 41 -5.798 -1.825 9.318 358 H MET 42 H MET 42 -8.298 -1.351 11.082 359 HA MET 42 HA MET 42 -6.823 1.071 10.947 360 HB2 MET 42 2HB MET 42 -9.826 0.590 10.813 361 HB3 MET 42 3HB MET 42 -9.090 2.181 10.596 362 HG2 MET 42 2HG MET 42 -8.760 -0.257 8.844 363 HG3 MET 42 3HG MET 42 -9.471 1.298 8.414 364 HE1 MET 42 3HE MET 42 -6.190 3.571 8.399 365 HE2 MET 42 1HE MET 42 -7.335 3.337 9.721 366 HE3 MET 42 2HE MET 42 -7.922 3.563 8.071 367 H LYS 43 H LYS 43 -8.878 -0.324 13.451 368 HA LYS 43 HA LYS 43 -8.880 1.834 15.284 369 HB2 LYS 43 2HB LYS 43 -9.253 -1.137 15.477 370 HB3 LYS 43 3HB LYS 43 -8.760 -0.350 16.961 371 HG2 LYS 43 2HG LYS 43 -11.153 -0.606 16.947 372 HG3 LYS 43 3HG LYS 43 -10.743 1.104 16.881 373 HD2 LYS 43 2HD LYS 43 -11.416 -0.413 14.347 374 HD3 LYS 43 3HD LYS 43 -12.697 0.173 15.399 375 HE2 LYS 43 2HE LYS 43 -11.854 2.485 15.135 376 HE3 LYS 43 3HE LYS 43 -10.580 1.898 14.065 377 HZ1 LYS 43 3HZ LYS 43 -13.500 1.781 13.577 378 HZ2 LYS 43 1HZ LYS 43 -12.338 1.072 12.575 379 HZ3 LYS 43 2HZ LYS 43 -12.376 2.747 12.771 380 H LYS 44 H LYS 44 -6.586 -0.836 14.801 381 HA LYS 44 HA LYS 44 -4.750 -0.177 16.843 382 HB2 LYS 44 2HB LYS 44 -4.317 -1.765 14.271 383 HB3 LYS 44 3HB LYS 44 -3.190 -1.734 15.625 384 HG2 LYS 44 2HG LYS 44 -6.047 -2.753 15.757 385 HG3 LYS 44 3HG LYS 44 -4.615 -3.770 15.577 386 HD2 LYS 44 2HD LYS 44 -5.172 -1.947 17.962 387 HD3 LYS 44 3HD LYS 44 -5.471 -3.687 17.923 388 HE2 LYS 44 2HE LYS 44 -3.094 -4.139 17.641 389 HE3 LYS 44 3HE LYS 44 -2.744 -2.412 17.524 390 HZ1 LYS 44 3HZ LYS 44 -3.348 -2.107 19.772 391 HZ2 LYS 44 1HZ LYS 44 -2.290 -3.422 19.725 392 HZ3 LYS 44 2HZ LYS 44 -3.949 -3.674 19.913 393 H LEU 45 H LEU 45 -4.945 0.816 13.459 394 HA LEU 45 HA LEU 45 -2.334 2.018 13.300 395 HB2 LEU 45 2HB LEU 45 -4.744 2.252 11.438 396 HB3 LEU 45 3HB LEU 45 -3.126 2.831 11.062 397 HG LEU 45 HG LEU 45 -3.853 -0.091 11.519 398 HD11 LEU 45 1HD1 LEU 45 -4.916 0.717 9.488 399 HD12 LEU 45 2HD1 LEU 45 -3.613 -0.402 9.099 400 HD13 LEU 45 3HD1 LEU 45 -3.374 1.335 8.891 401 HD21 LEU 45 3HD2 LEU 45 -1.241 1.116 10.546 402 HD22 LEU 45 1HD2 LEU 45 -1.616 -0.609 10.634 403 HD23 LEU 45 2HD2 LEU 45 -1.526 0.344 12.111 404 H ALA 46 H ALA 46 -5.602 3.072 14.034 405 HA ALA 46 HA ALA 46 -5.176 5.897 13.980 406 HB1 ALA 46 3HB ALA 46 -7.322 6.043 15.185 407 HB2 ALA 46 1HB ALA 46 -7.279 4.301 15.489 408 HB3 ALA 46 2HB ALA 46 -7.434 4.906 13.840 409 H GLU 47 H GLU 47 -5.037 3.428 16.489 410 HA GLU 47 HA GLU 47 -4.533 5.182 18.699 411 HB2 GLU 47 2HB GLU 47 -4.181 2.169 18.395 412 HB3 GLU 47 3HB GLU 47 -4.027 3.038 19.923 413 HG2 GLU 47 2HG GLU 47 -6.383 3.718 19.794 414 HG3 GLU 47 3HG GLU 47 -6.545 2.911 18.236 415 H GLU 48 H GLU 48 -2.514 3.205 16.555 416 HA GLU 48 HA GLU 48 -0.156 3.517 18.198 417 HB2 GLU 48 2HB GLU 48 -0.868 1.436 16.723 418 HB3 GLU 48 3HB GLU 48 -0.074 2.312 15.422 419 HG2 GLU 48 2HG GLU 48 1.466 0.714 16.409 420 HG3 GLU 48 3HG GLU 48 2.027 2.355 16.736 421 H LYS 49 H LYS 49 0.047 5.727 18.185 422 HA LYS 49 HA LYS 49 0.520 7.362 15.886 423 HB2 LYS 49 2HB LYS 49 1.186 9.074 17.573 424 HB3 LYS 49 3HB LYS 49 -0.356 8.316 17.967 425 HG2 LYS 49 2HG LYS 49 0.758 6.875 19.629 426 HG3 LYS 49 3HG LYS 49 2.319 7.600 19.228 427 HD2 LYS 49 2HD LYS 49 1.552 9.783 20.065 428 HD3 LYS 49 3HD LYS 49 -0.059 9.122 20.377 429 HE2 LYS 49 2HE LYS 49 0.925 7.558 22.041 430 HE3 LYS 49 3HE LYS 49 2.517 8.267 21.753 431 HZ1 LYS 49 3HZ LYS 49 1.739 10.354 22.587 432 HZ2 LYS 49 1HZ LYS 49 1.388 9.153 23.724 433 HZ3 LYS 49 2HZ LYS 49 0.164 9.769 22.743 434 H ASN 50 H ASN 50 2.422 5.088 17.501 435 HA ASN 50 HA ASN 50 5.022 6.064 17.514 436 HB2 ASN 50 2HB ASN 50 3.969 3.231 17.132 437 HB3 ASN 50 3HB ASN 50 5.691 3.586 17.251 438 HD21 ASN 50 1HD2 ASN 50 5.867 2.338 19.095 439 HD22 ASN 50 2HD2 ASN 50 5.264 2.846 20.632 440 H PHE 51 H PHE 51 6.472 6.490 16.038 441 HA PHE 51 HA PHE 51 5.928 6.505 13.253 442 HB2 PHE 51 2HB PHE 51 7.448 8.095 14.582 443 HB3 PHE 51 3HB PHE 51 8.656 6.820 14.585 444 HD1 PHE 51 HD1 PHE 51 9.487 5.960 12.280 445 HD2 PHE 51 HD2 PHE 51 7.298 9.599 12.764 446 HE1 PHE 51 HE1 PHE 51 10.307 6.751 10.109 447 HE2 PHE 51 HE2 PHE 51 8.124 10.374 10.580 448 HZ PHE 51 HZ PHE 51 9.626 8.947 9.251 449 H GLU 52 H GLU 52 5.567 4.520 12.416 450 HA GLU 52 HA GLU 52 7.670 2.465 12.470 451 HB2 GLU 52 2HB GLU 52 6.202 1.888 14.332 452 HB3 GLU 52 3HB GLU 52 4.766 2.090 13.333 453 HG2 GLU 52 2HG GLU 52 5.398 0.112 12.007 454 HG3 GLU 52 3HG GLU 52 6.867 -0.075 12.965 455 H LYS 53 H LYS 53 7.681 1.156 10.675 456 HA LYS 53 HA LYS 53 6.097 2.117 8.381 457 HB2 LYS 53 2HB LYS 53 8.710 0.551 8.308 458 HB3 LYS 53 3HB LYS 53 7.885 1.307 6.952 459 HG2 LYS 53 2HG LYS 53 9.619 2.807 7.368 460 HG3 LYS 53 3HG LYS 53 8.272 3.542 8.238 461 HD2 LYS 53 2HD LYS 53 10.187 3.677 9.678 462 HD3 LYS 53 3HD LYS 53 9.135 2.431 10.347 463 HE2 LYS 53 2HE LYS 53 11.461 1.703 10.443 464 HE3 LYS 53 3HE LYS 53 10.579 0.688 9.300 465 HZ1 LYS 53 3HZ LYS 53 12.348 2.969 8.616 466 HZ2 LYS 53 1HZ LYS 53 11.499 2.038 7.496 467 HZ3 LYS 53 2HZ LYS 53 12.722 1.336 8.424 468 H ILE 54 H ILE 54 4.469 0.827 7.828 469 HA ILE 54 HA ILE 54 4.645 -2.095 8.300 470 HB ILE 54 HB ILE 54 2.175 -0.317 8.639 471 HG12 ILE 54 2HG1 ILE 54 3.818 -1.882 10.695 472 HG13 ILE 54 3HG1 ILE 54 3.709 -0.130 10.565 473 HG21 ILE 54 1HG2 ILE 54 1.555 -2.497 7.657 474 HG22 ILE 54 2HG2 ILE 54 0.973 -2.372 9.316 475 HG23 ILE 54 3HG2 ILE 54 2.405 -3.341 8.958 476 HD11 ILE 54 3HD1 ILE 54 1.334 -0.247 11.173 477 HD12 ILE 54 1HD1 ILE 54 2.390 -0.937 12.407 478 HD13 ILE 54 2HD1 ILE 54 1.475 -2.001 11.340 479 H LEU 55 H LEU 55 4.436 -3.261 6.492 480 HA LEU 55 HA LEU 55 3.297 -2.147 4.041 481 HB2 LEU 55 2HB LEU 55 5.402 -3.622 4.085 482 HB3 LEU 55 3HB LEU 55 4.360 -4.968 4.518 483 HG LEU 55 HG LEU 55 3.035 -4.347 2.322 484 HD11 LEU 55 1HD1 LEU 55 4.432 -3.317 0.570 485 HD12 LEU 55 2HD1 LEU 55 5.655 -2.937 1.778 486 HD13 LEU 55 3HD1 LEU 55 4.048 -2.213 1.885 487 HD21 LEU 55 3HD2 LEU 55 4.431 -5.794 0.946 488 HD22 LEU 55 1HD2 LEU 55 4.301 -6.439 2.581 489 HD23 LEU 55 2HD2 LEU 55 5.778 -5.619 2.070 490 H ILE 56 H ILE 56 1.113 -2.233 3.913 491 HA ILE 56 HA ILE 56 -0.390 -4.439 5.141 492 HB ILE 56 HB ILE 56 -1.412 -1.962 3.685 493 HG12 ILE 56 2HG1 ILE 56 -0.320 -1.402 5.867 494 HG13 ILE 56 3HG1 ILE 56 -2.052 -1.096 5.915 495 HG21 ILE 56 1HG2 ILE 56 -3.642 -2.606 4.595 496 HG22 ILE 56 2HG2 ILE 56 -2.947 -4.105 5.208 497 HG23 ILE 56 3HG2 ILE 56 -3.004 -3.805 3.470 498 HD11 ILE 56 3HD1 ILE 56 -0.635 -3.479 7.117 499 HD12 ILE 56 1HD1 ILE 56 -2.377 -3.189 7.167 500 HD13 ILE 56 2HD1 ILE 56 -1.274 -2.085 7.987 501 H LYS 57 H LYS 57 -0.683 -6.178 3.991 502 HA LYS 57 HA LYS 57 -0.563 -6.288 1.076 503 HB2 LYS 57 2HB LYS 57 0.735 -7.902 2.442 504 HB3 LYS 57 3HB LYS 57 -0.717 -8.424 3.271 505 HG2 LYS 57 2HG LYS 57 -0.431 -8.767 0.288 506 HG3 LYS 57 3HG LYS 57 0.321 -9.908 1.399 507 HD2 LYS 57 2HD LYS 57 -1.955 -10.367 2.371 508 HD3 LYS 57 3HD LYS 57 -2.655 -9.313 1.136 509 HE2 LYS 57 2HE LYS 57 -1.749 -10.780 -0.625 510 HE3 LYS 57 3HE LYS 57 -1.049 -11.835 0.606 511 HZ1 LYS 57 3HZ LYS 57 -3.271 -12.303 1.405 512 HZ2 LYS 57 1HZ LYS 57 -3.132 -12.690 -0.230 513 HZ3 LYS 57 2HZ LYS 57 -3.940 -11.284 0.236 514 H SER 58 H SER 58 -2.469 -6.113 -0.035 515 HA SER 58 HA SER 58 -4.878 -7.448 0.868 516 HB2 SER 58 2HB SER 58 -5.094 -5.324 2.107 517 HB3 SER 58 3HB SER 58 -4.809 -4.401 0.632 518 HG SER 58 HG SER 58 -7.042 -6.033 1.256 519 H ASN 59 H ASN 59 -5.555 -8.427 -0.909 520 HA ASN 59 HA ASN 59 -4.806 -7.556 -3.583 521 HB2 ASN 59 2HB ASN 59 -6.519 -9.942 -2.745 522 HB3 ASN 59 3HB ASN 59 -5.822 -9.674 -4.341 523 HD21 ASN 59 1HD2 ASN 59 -3.586 -10.111 -4.661 524 HD22 ASN 59 2HD2 ASN 59 -2.646 -10.941 -3.469 525 H ASP 60 H ASP 60 -7.422 -7.033 -1.475 526 HA ASP 60 HA ASP 60 -9.435 -6.599 -3.588 527 HB2 ASP 60 2HB ASP 60 -9.710 -6.661 -0.543 528 HB3 ASP 60 3HB ASP 60 -11.043 -6.390 -1.668 529 H LYS 61 H LYS 61 -9.299 -4.626 -4.459 530 HA LYS 61 HA LYS 61 -7.849 -2.454 -3.431 531 HB2 LYS 61 2HB LYS 61 -8.680 -1.197 -5.376 532 HB3 LYS 61 3HB LYS 61 -8.182 -2.824 -5.831 533 HG2 LYS 61 2HG LYS 61 -10.534 -3.549 -5.917 534 HG3 LYS 61 3HG LYS 61 -11.059 -1.940 -5.403 535 HD2 LYS 61 2HD LYS 61 -10.093 -0.964 -7.473 536 HD3 LYS 61 3HD LYS 61 -9.571 -2.574 -7.990 537 HE2 LYS 61 2HE LYS 61 -12.446 -1.698 -7.545 538 HE3 LYS 61 3HE LYS 61 -11.660 -1.892 -9.109 539 HZ1 LYS 61 3HZ LYS 61 -11.378 -4.246 -8.615 540 HZ2 LYS 61 1HZ LYS 61 -13.003 -3.800 -8.576 541 HZ3 LYS 61 2HZ LYS 61 -12.160 -4.051 -7.135 542 H GLN 62 H GLN 62 -11.182 -3.292 -2.938 543 HA GLN 62 HA GLN 62 -12.258 -0.691 -2.436 544 HB2 GLN 62 2HB GLN 62 -13.274 -3.430 -1.546 545 HB3 GLN 62 3HB GLN 62 -14.181 -1.923 -1.390 546 HG2 GLN 62 2HG GLN 62 -14.151 -1.651 -3.837 547 HG3 GLN 62 3HG GLN 62 -13.259 -3.163 -3.995 548 HE21 GLN 62 1HE2 GLN 62 -16.360 -1.726 -3.240 549 HE22 GLN 62 2HE2 GLN 62 -17.276 -3.182 -3.376 550 H LEU 63 H LEU 63 -10.738 -3.152 -0.452 551 HA LEU 63 HA LEU 63 -11.265 -2.137 2.120 552 HB2 LEU 63 2HB LEU 63 -8.827 -3.733 1.191 553 HB3 LEU 63 3HB LEU 63 -9.302 -3.493 2.868 554 HG LEU 63 HG LEU 63 -10.833 -5.086 0.771 555 HD11 LEU 63 1HD1 LEU 63 -9.377 -6.012 3.268 556 HD12 LEU 63 2HD1 LEU 63 -8.841 -6.239 1.599 557 HD13 LEU 63 3HD1 LEU 63 -10.308 -7.033 2.165 558 HD21 LEU 63 3HD2 LEU 63 -12.431 -3.967 2.247 559 HD22 LEU 63 1HD2 LEU 63 -11.581 -4.568 3.674 560 HD23 LEU 63 2HD2 LEU 63 -12.399 -5.694 2.584 561 H LEU 64 H LEU 64 -8.697 -1.447 -0.210 562 HA LEU 64 HA LEU 64 -7.077 0.170 1.501 563 HB2 LEU 64 2HB LEU 64 -7.142 0.010 -1.544 564 HB3 LEU 64 3HB LEU 64 -5.971 0.942 -0.622 565 HG LEU 64 HG LEU 64 -5.333 -1.304 0.521 566 HD11 LEU 64 1HD1 LEU 64 -6.747 -2.436 -1.900 567 HD12 LEU 64 2HD1 LEU 64 -7.216 -2.651 -0.212 568 HD13 LEU 64 3HD1 LEU 64 -5.700 -3.331 -0.795 569 HD21 LEU 64 3HD2 LEU 64 -3.874 -0.124 -1.038 570 HD22 LEU 64 1HD2 LEU 64 -4.666 -0.916 -2.401 571 HD23 LEU 64 2HD2 LEU 64 -3.748 -1.870 -1.230 572 H LYS 65 H LYS 65 -9.749 0.889 -0.744 573 HA LYS 65 HA LYS 65 -9.496 3.705 -0.785 574 HB2 LYS 65 2HB LYS 65 -12.083 2.094 -1.015 575 HB3 LYS 65 3HB LYS 65 -11.844 3.760 -1.539 576 HG2 LYS 65 2HG LYS 65 -10.103 2.892 -3.154 577 HG3 LYS 65 3HG LYS 65 -10.612 1.263 -2.720 578 HD2 LYS 65 2HD LYS 65 -12.280 3.407 -4.093 579 HD3 LYS 65 3HD LYS 65 -11.654 1.924 -4.811 580 HE2 LYS 65 2HE LYS 65 -13.890 1.388 -4.437 581 HE3 LYS 65 3HE LYS 65 -13.125 0.723 -2.996 582 HZ1 LYS 65 3HZ LYS 65 -13.827 2.664 -1.759 583 HZ2 LYS 65 1HZ LYS 65 -15.159 1.964 -2.525 584 HZ3 LYS 65 2HZ LYS 65 -14.468 3.367 -3.154 585 H GLU 66 H GLU 66 -11.481 1.547 1.231 586 HA GLU 66 HA GLU 66 -12.637 3.574 2.877 587 HB2 GLU 66 2HB GLU 66 -12.338 0.600 3.468 588 HB3 GLU 66 3HB GLU 66 -13.484 1.710 4.225 589 HG2 GLU 66 2HG GLU 66 -14.537 2.069 1.994 590 HG3 GLU 66 3HG GLU 66 -13.443 0.871 1.312 591 H MET 67 H MET 67 -9.706 1.699 3.068 592 HA MET 67 HA MET 67 -8.920 2.206 5.733 593 HB2 MET 67 2HB MET 67 -7.907 0.509 4.131 594 HB3 MET 67 3HB MET 67 -7.115 1.834 3.293 595 HG2 MET 67 2HG MET 67 -5.956 2.378 5.466 596 HG3 MET 67 3HG MET 67 -6.633 0.889 6.118 597 HE1 MET 67 3HE MET 67 -4.988 -1.744 3.607 598 HE2 MET 67 1HE MET 67 -6.530 -0.921 3.382 599 HE3 MET 67 2HE MET 67 -6.099 -1.574 4.965 600 H LEU 68 H LEU 68 -8.237 3.878 2.662 601 HA LEU 68 HA LEU 68 -6.575 5.928 3.728 602 HB2 LEU 68 2HB LEU 68 -8.003 5.629 1.063 603 HB3 LEU 68 3HB LEU 68 -6.991 7.020 1.428 604 HG LEU 68 HG LEU 68 -5.990 4.138 1.438 605 HD11 LEU 68 1HD1 LEU 68 -5.623 6.233 -0.729 606 HD12 LEU 68 2HD1 LEU 68 -6.627 4.785 -0.836 607 HD13 LEU 68 3HD1 LEU 68 -4.879 4.629 -0.686 608 HD21 LEU 68 3HD2 LEU 68 -3.743 5.143 1.511 609 HD22 LEU 68 1HD2 LEU 68 -4.696 5.603 2.920 610 HD23 LEU 68 2HD2 LEU 68 -4.452 6.759 1.606 611 H GLU 69 H GLU 69 -10.051 5.654 3.364 612 HA GLU 69 HA GLU 69 -10.878 8.317 3.699 613 HB2 GLU 69 2HB GLU 69 -12.125 5.718 4.705 614 HB3 GLU 69 3HB GLU 69 -12.929 7.279 4.843 615 HG2 GLU 69 2HG GLU 69 -12.124 5.926 2.254 616 HG3 GLU 69 3HG GLU 69 -13.754 5.974 2.930 617 H LEU 70 H LEU 70 -9.955 5.852 6.037 618 HA LEU 70 HA LEU 70 -10.489 7.528 8.351 619 HB2 LEU 70 2HB LEU 70 -9.274 4.752 8.248 620 HB3 LEU 70 3HB LEU 70 -9.985 5.544 9.649 621 HG LEU 70 HG LEU 70 -11.469 4.576 7.169 622 HD11 LEU 70 1HD1 LEU 70 -12.534 2.978 8.681 623 HD12 LEU 70 2HD1 LEU 70 -11.547 3.568 10.021 624 HD13 LEU 70 3HD1 LEU 70 -10.784 2.767 8.646 625 HD21 LEU 70 3HD2 LEU 70 -13.554 5.239 8.314 626 HD22 LEU 70 1HD2 LEU 70 -12.528 6.633 7.976 627 HD23 LEU 70 2HD2 LEU 70 -12.615 5.979 9.613 628 H ILE 71 H ILE 71 -7.717 6.432 6.492 629 HA ILE 71 HA ILE 71 -5.640 7.369 8.214 630 HB ILE 71 HB ILE 71 -5.678 6.868 5.196 631 HG12 ILE 71 2HG1 ILE 71 -4.433 5.261 7.485 632 HG13 ILE 71 3HG1 ILE 71 -5.905 4.834 6.621 633 HG21 ILE 71 1HG2 ILE 71 -3.239 7.532 6.892 634 HG22 ILE 71 2HG2 ILE 71 -3.962 8.579 5.668 635 HG23 ILE 71 3HG2 ILE 71 -3.220 7.055 5.194 636 HD11 ILE 71 3HD1 ILE 71 -4.582 4.549 4.562 637 HD12 ILE 71 1HD1 ILE 71 -4.067 3.482 5.869 638 HD13 ILE 71 2HD1 ILE 71 -3.116 4.913 5.478 639 H SER 72 H SER 72 -7.686 8.856 5.768 640 HA SER 72 HA SER 72 -6.437 11.361 5.491 641 HB2 SER 72 2HB SER 72 -8.198 10.503 3.973 642 HB3 SER 72 3HB SER 72 -9.392 10.645 5.261 643 HG SER 72 HG SER 72 -8.513 12.514 3.540 644 H LYS 73 H LYS 73 -8.386 10.039 8.063 645 HA LYS 73 HA LYS 73 -8.988 12.528 9.405 646 HB2 LYS 73 2HB LYS 73 -8.989 9.694 10.543 647 HB3 LYS 73 3HB LYS 73 -9.789 11.101 11.242 648 HG2 LYS 73 2HG LYS 73 -10.499 9.791 8.597 649 HG3 LYS 73 3HG LYS 73 -11.369 9.570 10.120 650 HD2 LYS 73 2HD LYS 73 -11.973 11.968 10.132 651 HD3 LYS 73 3HD LYS 73 -11.071 12.215 8.632 652 HE2 LYS 73 2HE LYS 73 -12.607 10.733 7.432 653 HE3 LYS 73 3HE LYS 73 -13.472 10.373 8.929 654 HZ1 LYS 73 3HZ LYS 73 -14.612 12.028 7.577 655 HZ2 LYS 73 1HZ LYS 73 -13.277 13.058 7.671 656 HZ3 LYS 73 2HZ LYS 73 -14.150 12.676 9.064 657 H LEU 74 H LEU 74 -6.480 10.062 9.528 658 HA LEU 74 HA LEU 74 -5.306 10.898 12.030 659 HB2 LEU 74 2HB LEU 74 -4.267 8.947 9.931 660 HB3 LEU 74 3HB LEU 74 -3.664 9.106 11.578 661 HG LEU 74 HG LEU 74 -6.463 8.170 10.813 662 HD11 LEU 74 1HD1 LEU 74 -4.782 6.503 10.221 663 HD12 LEU 74 2HD1 LEU 74 -5.766 5.947 11.573 664 HD13 LEU 74 3HD1 LEU 74 -4.129 6.543 11.863 665 HD21 LEU 74 3HD2 LEU 74 -5.177 8.339 13.565 666 HD22 LEU 74 1HD2 LEU 74 -6.748 7.617 13.201 667 HD23 LEU 74 2HD2 LEU 74 -6.499 9.343 12.961 668 H GLY 75 H GLY 75 -4.358 11.097 8.611 669 HA2 GLY 75 2HA GLY 75 -3.279 12.750 7.462 670 HA3 GLY 75 3HA GLY 75 -3.091 13.651 8.953 671 H TYR 76 H TYR 76 -1.802 10.790 7.218 672 HA TYR 76 HA TYR 76 0.918 11.736 7.692 673 HB2 TYR 76 2HB TYR 76 1.758 9.509 8.432 674 HB3 TYR 76 3HB TYR 76 0.654 10.221 9.591 675 HD1 TYR 76 HD2 TYR 76 0.989 7.520 7.033 676 HD2 TYR 76 HD1 TYR 76 -1.398 9.082 10.217 677 HE1 TYR 76 HE2 TYR 76 -0.299 5.430 7.102 678 HE2 TYR 76 HE1 TYR 76 -2.666 6.985 10.279 679 HH TYR 76 HH TYR 76 -3.207 5.116 8.793 680 H LYS 77 H LYS 77 2.475 10.070 6.534 681 HA LYS 77 HA LYS 77 1.730 10.196 3.738 682 HB2 LYS 77 2HB LYS 77 4.314 9.585 5.207 683 HB3 LYS 77 3HB LYS 77 4.187 9.345 3.466 684 HG2 LYS 77 2HG LYS 77 3.542 11.994 4.790 685 HG3 LYS 77 3HG LYS 77 5.173 11.571 4.254 686 HD2 LYS 77 2HD LYS 77 4.461 11.415 1.946 687 HD3 LYS 77 3HD LYS 77 2.758 11.520 2.398 688 HE2 LYS 77 2HE LYS 77 4.775 13.763 2.780 689 HE3 LYS 77 3HE LYS 77 3.644 13.635 1.429 690 HZ1 LYS 77 3HZ LYS 77 2.784 15.079 3.145 691 HZ2 LYS 77 1HZ LYS 77 2.892 13.841 4.289 692 HZ3 LYS 77 2HZ LYS 77 1.815 13.707 2.999 693 H VAL 78 H VAL 78 0.970 8.604 2.595 694 HA VAL 78 HA VAL 78 1.576 5.787 3.254 695 HB VAL 78 HB VAL 78 -1.069 6.841 2.122 696 HG11 VAL 78 1HG1 VAL 78 -1.862 4.496 2.283 697 HG12 VAL 78 2HG1 VAL 78 -0.249 3.982 2.788 698 HG13 VAL 78 3HG1 VAL 78 -0.499 4.637 1.168 699 HG21 VAL 78 3HG2 VAL 78 -0.842 7.307 4.524 700 HG22 VAL 78 1HG2 VAL 78 -0.452 5.612 4.836 701 HG23 VAL 78 2HG2 VAL 78 -2.059 6.058 4.251 702 H PHE 79 H PHE 79 2.285 4.577 1.593 703 HA PHE 79 HA PHE 79 2.581 5.771 -1.098 704 HB2 PHE 79 2HB PHE 79 4.272 3.653 0.312 705 HB3 PHE 79 3HB PHE 79 4.573 4.312 -1.291 706 HD1 PHE 79 HD1 PHE 79 5.366 6.661 -1.557 707 HD2 PHE 79 HD2 PHE 79 4.918 4.905 2.323 708 HE1 PHE 79 HE1 PHE 79 6.730 8.455 -0.579 709 HE2 PHE 79 HE2 PHE 79 6.293 6.710 3.287 710 HZ PHE 79 HZ PHE 79 7.198 8.483 1.836 711 H LEU 80 H LEU 80 1.133 4.868 -2.432 712 HA LEU 80 HA LEU 80 0.073 2.167 -1.936 713 HB2 LEU 80 2HB LEU 80 -1.627 3.904 -1.904 714 HB3 LEU 80 3HB LEU 80 -1.063 4.566 -3.427 715 HG LEU 80 HG LEU 80 -1.917 2.630 -4.663 716 HD11 LEU 80 1HD1 LEU 80 -2.787 1.466 -2.006 717 HD12 LEU 80 2HD1 LEU 80 -1.503 0.851 -3.053 718 HD13 LEU 80 3HD1 LEU 80 -3.175 0.819 -3.604 719 HD21 LEU 80 3HD2 LEU 80 -4.024 3.690 -2.751 720 HD22 LEU 80 1HD2 LEU 80 -4.329 2.910 -4.307 721 HD23 LEU 80 2HD2 LEU 80 -3.493 4.460 -4.249 722 H LEU 81 H LEU 81 0.445 0.606 -3.355 723 HA LEU 81 HA LEU 81 1.468 1.209 -6.059 724 HB2 LEU 81 2HB LEU 81 3.200 0.176 -4.545 725 HB3 LEU 81 3HB LEU 81 2.173 -1.229 -4.370 726 HG LEU 81 HG LEU 81 2.400 -1.753 -6.768 727 HD11 LEU 81 1HD1 LEU 81 4.149 0.721 -6.977 728 HD12 LEU 81 2HD1 LEU 81 2.558 0.490 -7.707 729 HD13 LEU 81 3HD1 LEU 81 3.919 -0.488 -8.246 730 HD21 LEU 81 3HD2 LEU 81 4.777 -2.378 -6.823 731 HD22 LEU 81 1HD2 LEU 81 4.077 -2.690 -5.235 732 HD23 LEU 81 2HD2 LEU 81 5.113 -1.281 -5.480 733 H LEU 82 H LEU 82 0.000 0.711 -7.443 734 HA LEU 82 HA LEU 82 -2.005 -1.405 -7.041 735 HB2 LEU 82 2HB LEU 82 -1.791 0.857 -9.084 736 HB3 LEU 82 3HB LEU 82 -3.143 -0.256 -8.945 737 HG LEU 82 HG LEU 82 -2.327 1.736 -6.789 738 HD11 LEU 82 1HD1 LEU 82 -4.284 3.050 -7.457 739 HD12 LEU 82 2HD1 LEU 82 -4.604 1.933 -8.787 740 HD13 LEU 82 3HD1 LEU 82 -3.131 2.907 -8.783 741 HD21 LEU 82 3HD2 LEU 82 -3.450 -0.238 -5.863 742 HD22 LEU 82 1HD2 LEU 82 -4.791 -0.038 -6.996 743 HD23 LEU 82 2HD2 LEU 82 -4.494 1.176 -5.746 744 H ALA 83 H ALA 83 -1.924 -3.230 -8.375 745 HA ALA 83 HA ALA 83 -0.201 -3.270 -10.746 746 HB1 ALA 83 3HB ALA 83 1.018 -5.281 -9.986 747 HB2 ALA 83 1HB ALA 83 0.218 -5.166 -8.421 748 HB3 ALA 83 2HB ALA 83 1.323 -3.901 -8.932 749 H ASP 84 H ASP 84 -1.550 -3.986 -12.253 750 HA ASP 84 HA ASP 84 -2.663 -6.597 -12.249 751 HB2 ASP 84 2HB ASP 84 -4.392 -5.508 -10.782 752 HB3 ASP 84 3HB ASP 84 -4.701 -4.322 -12.038 753 H GLN 85 H GLN 85 -3.343 -7.192 -14.300 754 HA GLN 85 HA GLN 85 -2.232 -5.682 -16.460 755 HB2 GLN 85 2HB GLN 85 -2.239 -8.215 -16.314 756 HB3 GLN 85 3HB GLN 85 -3.963 -8.186 -16.671 757 HG2 GLN 85 2HG GLN 85 -3.502 -7.141 -18.850 758 HG3 GLN 85 3HG GLN 85 -1.777 -7.099 -18.473 759 HE21 GLN 85 1HE2 GLN 85 -1.161 -8.365 -20.173 760 HE22 GLN 85 2HE2 GLN 85 -1.560 -10.039 -20.315 761 H ASP 86 H ASP 86 -5.518 -6.210 -15.205 762 HA ASP 86 HA ASP 86 -6.775 -4.497 -17.193 763 HB2 ASP 86 2HB ASP 86 -7.784 -5.343 -14.441 764 HB3 ASP 86 3HB ASP 86 -8.730 -4.476 -15.642 765 H GLU 87 H GLU 87 -4.985 -2.994 -16.963 766 HA GLU 87 HA GLU 87 -4.414 -1.577 -14.564 767 HB2 GLU 87 2HB GLU 87 -2.911 -0.243 -15.995 768 HB3 GLU 87 3HB GLU 87 -2.685 -1.973 -16.231 769 HG2 GLU 87 2HG GLU 87 -3.802 -1.925 -18.349 770 HG3 GLU 87 3HG GLU 87 -4.376 -0.275 -18.087 771 H ASN 88 H ASN 88 -6.678 -1.098 -17.118 772 HA ASN 88 HA ASN 88 -6.994 1.691 -17.228 773 HB2 ASN 88 2HB ASN 88 -7.966 0.098 -18.888 774 HB3 ASN 88 3HB ASN 88 -9.103 -0.470 -17.675 775 HD21 ASN 88 1HD2 ASN 88 -8.168 2.391 -19.571 776 HD22 ASN 88 2HD2 ASN 88 -9.728 3.132 -19.534 777 H GLU 89 H GLU 89 -8.424 -0.722 -15.105 778 HA GLU 89 HA GLU 89 -10.144 0.855 -13.543 779 HB2 GLU 89 2HB GLU 89 -10.190 -1.588 -13.461 780 HB3 GLU 89 3HB GLU 89 -8.530 -1.649 -12.894 781 HG2 GLU 89 2HG GLU 89 -10.153 -2.146 -11.105 782 HG3 GLU 89 3HG GLU 89 -9.168 -0.727 -10.742 783 H LEU 90 H LEU 90 -6.726 -0.021 -13.072 784 HA LEU 90 HA LEU 90 -6.480 1.433 -10.579 785 HB2 LEU 90 2HB LEU 90 -4.399 -0.049 -12.217 786 HB3 LEU 90 3HB LEU 90 -4.163 0.564 -10.584 787 HG LEU 90 HG LEU 90 -6.075 -1.663 -11.408 788 HD11 LEU 90 1HD1 LEU 90 -3.526 -1.756 -9.767 789 HD12 LEU 90 2HD1 LEU 90 -3.733 -2.349 -11.416 790 HD13 LEU 90 3HD1 LEU 90 -4.601 -3.118 -10.092 791 HD21 LEU 90 3HD2 LEU 90 -5.600 -0.497 -8.634 792 HD22 LEU 90 1HD2 LEU 90 -6.537 -1.953 -8.987 793 HD23 LEU 90 2HD2 LEU 90 -7.089 -0.388 -9.577 794 H GLU 91 H GLU 91 -6.141 2.223 -13.831 795 HA GLU 91 HA GLU 91 -4.103 4.278 -13.534 796 HB2 GLU 91 2HB GLU 91 -4.363 2.808 -15.612 797 HB3 GLU 91 3HB GLU 91 -5.847 3.680 -15.970 798 HG2 GLU 91 2HG GLU 91 -3.984 4.529 -17.302 799 HG3 GLU 91 3HG GLU 91 -4.588 5.769 -16.204 800 H GLU 92 H GLU 92 -7.581 3.951 -13.522 801 HA GLU 92 HA GLU 92 -8.012 6.821 -13.251 802 HB2 GLU 92 2HB GLU 92 -9.853 4.409 -13.059 803 HB3 GLU 92 3HB GLU 92 -10.394 6.039 -12.657 804 HG2 GLU 92 2HG GLU 92 -9.352 5.103 -15.342 805 HG3 GLU 92 3HG GLU 92 -11.025 5.483 -14.934 806 H PHE 93 H PHE 93 -7.884 3.934 -11.237 807 HA PHE 93 HA PHE 93 -8.807 4.861 -8.782 808 HB2 PHE 93 2HB PHE 93 -8.243 2.460 -9.491 809 HB3 PHE 93 3HB PHE 93 -6.561 2.827 -9.171 810 HD1 PHE 93 HD1 PHE 93 -6.000 3.623 -6.695 811 HD2 PHE 93 HD2 PHE 93 -9.570 1.536 -7.796 812 HE1 PHE 93 HE1 PHE 93 -6.271 2.859 -4.377 813 HE2 PHE 93 HE2 PHE 93 -9.829 0.784 -5.468 814 HZ PHE 93 HZ PHE 93 -8.179 1.438 -3.763 815 H LYS 94 H LYS 94 -5.514 4.884 -10.122 816 HA LYS 94 HA LYS 94 -4.106 5.976 -7.971 817 HB2 LYS 94 2HB LYS 94 -2.387 6.655 -9.611 818 HB3 LYS 94 3HB LYS 94 -2.950 5.018 -9.927 819 HG2 LYS 94 2HG LYS 94 -4.062 5.621 -11.892 820 HG3 LYS 94 3HG LYS 94 -4.226 7.305 -11.417 821 HD2 LYS 94 2HD LYS 94 -2.647 7.027 -13.278 822 HD3 LYS 94 3HD LYS 94 -1.865 7.711 -11.852 823 HE2 LYS 94 2HE LYS 94 -0.797 5.620 -11.350 824 HE3 LYS 94 3HE LYS 94 -1.755 4.771 -12.569 825 HZ1 LYS 94 3HZ LYS 94 0.237 6.896 -13.128 826 HZ2 LYS 94 1HZ LYS 94 -0.668 6.059 -14.283 827 HZ3 LYS 94 2HZ LYS 94 0.473 5.244 -13.344 828 H ARG 95 H ARG 95 -6.001 7.574 -10.507 829 HA ARG 95 HA ARG 95 -4.962 10.202 -10.160 830 HB2 ARG 95 2HB ARG 95 -7.596 9.302 -11.429 831 HB3 ARG 95 3HB ARG 95 -6.888 10.911 -11.589 832 HG2 ARG 95 2HG ARG 95 -4.961 9.982 -12.785 833 HG3 ARG 95 3HG ARG 95 -5.582 8.344 -12.561 834 HD2 ARG 95 2HD ARG 95 -6.056 9.087 -14.825 835 HD3 ARG 95 3HD ARG 95 -7.576 8.943 -13.933 836 HE ARG 95 HE ARG 95 -6.386 11.591 -13.960 837 HH11 ARG 95 1HH1 ARG 95 -8.684 9.451 -15.597 838 HH12 ARG 95 2HH1 ARG 95 -9.519 10.777 -16.345 839 HH21 ARG 95 1HH2 ARG 95 -7.518 13.276 -14.904 840 HH22 ARG 95 2HH2 ARG 95 -8.862 12.937 -15.955 841 H LYS 96 H LYS 96 -7.593 8.416 -8.713 842 HA LYS 96 HA LYS 96 -8.881 10.632 -7.409 843 HB2 LYS 96 2HB LYS 96 -9.204 7.613 -7.277 844 HB3 LYS 96 3HB LYS 96 -10.003 8.636 -6.087 845 HG2 LYS 96 2HG LYS 96 -11.513 8.059 -7.954 846 HG3 LYS 96 3HG LYS 96 -11.246 9.800 -7.819 847 HD2 LYS 96 2HD LYS 96 -9.541 9.612 -9.674 848 HD3 LYS 96 3HD LYS 96 -9.997 7.917 -9.859 849 HE2 LYS 96 2HE LYS 96 -12.269 8.578 -10.470 850 HE3 LYS 96 3HE LYS 96 -11.872 10.277 -10.192 851 HZ1 LYS 96 3HZ LYS 96 -10.259 10.159 -11.969 852 HZ2 LYS 96 1HZ LYS 96 -11.784 9.708 -12.529 853 HZ3 LYS 96 2HZ LYS 96 -10.613 8.529 -12.237 854 H ILE 97 H ILE 97 -6.514 8.170 -6.475 855 HA ILE 97 HA ILE 97 -6.411 8.922 -3.691 856 HB ILE 97 HB ILE 97 -4.412 7.251 -5.288 857 HG12 ILE 97 2HG1 ILE 97 -6.609 6.236 -5.501 858 HG13 ILE 97 3HG1 ILE 97 -5.676 5.267 -4.377 859 HG21 ILE 97 1HG2 ILE 97 -3.785 6.262 -3.104 860 HG22 ILE 97 2HG2 ILE 97 -4.873 7.384 -2.283 861 HG23 ILE 97 3HG2 ILE 97 -3.465 7.999 -3.153 862 HD11 ILE 97 3HD1 ILE 97 -6.915 6.348 -2.503 863 HD12 ILE 97 1HD1 ILE 97 -7.940 5.442 -3.614 864 HD13 ILE 97 2HD1 ILE 97 -7.897 7.202 -3.696 865 H GLU 98 H GLU 98 -4.639 9.749 -6.583 866 HA GLU 98 HA GLU 98 -2.525 11.279 -5.415 867 HB2 GLU 98 2HB GLU 98 -2.466 10.223 -7.705 868 HB3 GLU 98 3HB GLU 98 -3.674 11.370 -8.254 869 HG2 GLU 98 2HG GLU 98 -1.011 12.308 -7.165 870 HG3 GLU 98 3HG GLU 98 -1.163 11.764 -8.833 871 H SER 99 H SER 99 -5.793 11.933 -6.594 872 HA SER 99 HA SER 99 -5.814 14.758 -6.261 873 HB2 SER 99 2HB SER 99 -7.525 13.579 -7.598 874 HB3 SER 99 3HB SER 99 -8.129 12.769 -6.145 875 HG SER 99 HG SER 99 -8.951 15.040 -7.102 876 H GLN 100 H GLN 100 -6.383 12.028 -4.093 877 HA GLN 100 HA GLN 100 -7.252 13.561 -1.811 878 HB2 GLN 100 2HB GLN 100 -6.268 10.685 -2.068 879 HB3 GLN 100 3HB GLN 100 -6.867 11.380 -0.562 880 HG2 GLN 100 2HG GLN 100 -9.077 11.667 -1.492 881 HG3 GLN 100 3HG GLN 100 -8.514 11.204 -3.096 882 HE21 GLN 100 1HE2 GLN 100 -10.063 9.542 -3.199 883 HE22 GLN 100 2HE2 GLN 100 -9.892 8.071 -2.306 884 H GLY 101 H GLY 101 -4.219 13.201 -3.266 885 HA2 GLY 101 2HA GLY 101 -2.321 14.407 -2.704 886 HA3 GLY 101 3HA GLY 101 -2.974 14.694 -1.100 887 H TYR 102 H TYR 102 -2.759 11.465 -2.456 888 HA TYR 102 HA TYR 102 -0.544 10.783 -0.600 889 HB2 TYR 102 2HB TYR 102 -2.661 8.987 -1.862 890 HB3 TYR 102 3HB TYR 102 -1.327 8.404 -0.873 891 HD1 TYR 102 HD2 TYR 102 -1.200 9.231 1.591 892 HD2 TYR 102 HD1 TYR 102 -4.709 9.644 -0.830 893 HE1 TYR 102 HE2 TYR 102 -2.572 9.502 3.613 894 HE2 TYR 102 HE1 TYR 102 -6.071 9.918 1.202 895 HH TYR 102 HH TYR 102 -4.674 10.398 4.305 896 H GLU 103 H GLU 103 1.093 9.355 -1.359 897 HA GLU 103 HA GLU 103 1.788 9.610 -4.156 898 HB2 GLU 103 2HB GLU 103 3.596 9.719 -2.506 899 HB3 GLU 103 3HB GLU 103 3.160 8.142 -1.858 900 HG2 GLU 103 2HG GLU 103 5.162 7.983 -3.258 901 HG3 GLU 103 3HG GLU 103 3.837 7.063 -3.966 902 H VAL 104 H VAL 104 1.083 8.252 -5.662 903 HA VAL 104 HA VAL 104 0.589 5.418 -5.068 904 HB VAL 104 HB VAL 104 -1.614 6.339 -4.824 905 HG11 VAL 104 1HG1 VAL 104 -2.747 7.733 -6.499 906 HG12 VAL 104 2HG1 VAL 104 -1.286 7.751 -7.491 907 HG13 VAL 104 3HG1 VAL 104 -1.280 8.516 -5.900 908 HG21 VAL 104 3HG2 VAL 104 -1.495 4.210 -6.072 909 HG22 VAL 104 1HG2 VAL 104 -1.433 5.094 -7.601 910 HG23 VAL 104 2HG2 VAL 104 -2.878 5.174 -6.589 911 H ARG 105 H ARG 105 1.213 4.064 -6.676 912 HA ARG 105 HA ARG 105 1.848 5.127 -9.368 913 HB2 ARG 105 2HB ARG 105 3.586 3.227 -7.719 914 HB3 ARG 105 3HB ARG 105 3.888 3.669 -9.398 915 HG2 ARG 105 2HG ARG 105 3.900 5.593 -7.045 916 HG3 ARG 105 3HG ARG 105 5.336 4.895 -7.796 917 HD2 ARG 105 2HD ARG 105 5.040 6.149 -9.785 918 HD3 ARG 105 3HD ARG 105 3.357 6.530 -9.408 919 HE ARG 105 HE ARG 105 4.807 7.660 -7.385 920 HH11 ARG 105 1HH1 ARG 105 4.814 8.042 -10.884 921 HH12 ARG 105 2HH1 ARG 105 5.300 9.705 -10.808 922 HH21 ARG 105 1HH2 ARG 105 5.327 9.835 -7.303 923 HH22 ARG 105 2HH2 ARG 105 5.589 10.723 -8.772 924 H LYS 106 H LYS 106 1.524 3.672 -11.063 925 HA LYS 106 HA LYS 106 0.075 1.159 -10.412 926 HB2 LYS 106 2HB LYS 106 -1.252 2.987 -11.601 927 HB3 LYS 106 3HB LYS 106 -0.166 2.825 -12.967 928 HG2 LYS 106 2HG LYS 106 -1.867 0.533 -11.938 929 HG3 LYS 106 3HG LYS 106 -2.451 1.680 -13.136 930 HD2 LYS 106 2HD LYS 106 0.001 -0.086 -13.531 931 HD3 LYS 106 3HD LYS 106 -1.617 -0.527 -14.053 932 HE2 LYS 106 2HE LYS 106 -0.317 0.317 -15.938 933 HE3 LYS 106 3HE LYS 106 -1.646 1.418 -15.588 934 HZ1 LYS 106 3HZ LYS 106 -0.157 2.948 -14.604 935 HZ2 LYS 106 1HZ LYS 106 0.507 2.499 -16.083 936 HZ3 LYS 106 2HZ LYS 106 1.137 1.859 -14.652 937 H VAL 107 H VAL 107 0.937 -0.649 -11.136 938 HA VAL 107 HA VAL 107 2.856 -0.740 -13.355 939 HB VAL 107 HB VAL 107 4.186 -2.502 -12.161 940 HG11 VAL 107 1HG1 VAL 107 4.071 0.136 -10.647 941 HG12 VAL 107 2HG1 VAL 107 4.998 -0.180 -12.116 942 HG13 VAL 107 3HG1 VAL 107 5.413 -1.015 -10.616 943 HG21 VAL 107 3HG2 VAL 107 3.928 -2.799 -9.711 944 HG22 VAL 107 1HG2 VAL 107 2.491 -3.311 -10.595 945 HG23 VAL 107 2HG2 VAL 107 2.499 -1.767 -9.744 946 H THR 108 H THR 108 3.075 -3.167 -13.996 947 HA THR 108 HA THR 108 0.458 -4.540 -13.921 948 HB THR 108 HB THR 108 0.813 -4.983 -16.454 949 HG1 THR 108 HG1 THR 108 2.979 -3.411 -15.922 950 HG21 THR 108 3HG2 THR 108 -0.175 -2.834 -17.183 951 HG22 THR 108 1HG2 THR 108 0.222 -2.113 -15.623 952 HG23 THR 108 2HG2 THR 108 -0.960 -3.423 -15.716 953 H ASP 109 H ASP 109 3.935 -4.715 -14.107 954 HA ASP 109 HA ASP 109 3.840 -7.678 -14.232 955 HB2 ASP 109 2HB ASP 109 6.146 -5.817 -14.958 956 HB3 ASP 109 3HB ASP 109 6.198 -7.580 -15.017 957 H ASP 110 H ASP 110 5.541 -8.750 -13.058 958 HA ASP 110 HA ASP 110 5.403 -8.137 -10.290 959 HB2 ASP 110 2HB ASP 110 6.976 -10.293 -11.791 960 HB3 ASP 110 3HB ASP 110 6.820 -10.213 -10.034 961 H GLU 111 H GLU 111 8.187 -8.469 -12.488 962 HA GLU 111 HA GLU 111 10.144 -7.578 -10.676 963 HB2 GLU 111 2HB GLU 111 11.606 -7.360 -12.764 964 HB3 GLU 111 3HB GLU 111 10.879 -8.931 -12.479 965 HG2 GLU 111 2HG GLU 111 10.705 -8.604 -14.795 966 HG3 GLU 111 3HG GLU 111 9.089 -8.294 -14.169 967 H GLU 112 H GLU 112 8.018 -5.834 -12.801 968 HA GLU 112 HA GLU 112 9.262 -3.275 -12.763 969 HB2 GLU 112 2HB GLU 112 7.572 -3.961 -14.438 970 HB3 GLU 112 3HB GLU 112 6.347 -4.090 -13.177 971 HG2 GLU 112 2HG GLU 112 6.550 -1.654 -12.771 972 HG3 GLU 112 3HG GLU 112 7.742 -1.555 -14.066 973 H ALA 113 H ALA 113 6.691 -4.797 -10.823 974 HA ALA 113 HA ALA 113 6.052 -2.652 -9.124 975 HB1 ALA 113 3HB ALA 113 5.087 -4.347 -7.619 976 HB2 ALA 113 1HB ALA 113 5.927 -5.630 -8.502 977 HB3 ALA 113 2HB ALA 113 4.666 -4.685 -9.299 978 H LEU 114 H LEU 114 8.450 -5.240 -8.811 979 HA LEU 114 HA LEU 114 9.340 -4.782 -6.193 980 HB2 LEU 114 2HB LEU 114 10.801 -5.983 -8.576 981 HB3 LEU 114 3HB LEU 114 11.381 -6.080 -6.919 982 HG LEU 114 HG LEU 114 8.752 -7.282 -7.895 983 HD11 LEU 114 1HD1 LEU 114 10.653 -8.448 -8.908 984 HD12 LEU 114 2HD1 LEU 114 9.836 -9.470 -7.729 985 HD13 LEU 114 3HD1 LEU 114 11.370 -8.701 -7.312 986 HD21 LEU 114 3HD2 LEU 114 8.670 -6.700 -5.512 987 HD22 LEU 114 1HD2 LEU 114 10.165 -7.593 -5.218 988 HD23 LEU 114 2HD2 LEU 114 8.703 -8.449 -5.720 989 H LYS 115 H LYS 115 10.237 -3.204 -9.214 990 HA LYS 115 HA LYS 115 12.494 -1.718 -8.325 991 HB2 LYS 115 2HB LYS 115 10.420 -0.922 -10.427 992 HB3 LYS 115 3HB LYS 115 11.995 -0.160 -10.210 993 HG2 LYS 115 2HG LYS 115 13.110 -2.248 -10.870 994 HG3 LYS 115 3HG LYS 115 11.537 -3.039 -11.057 995 HD2 LYS 115 2HD LYS 115 10.941 -1.400 -12.836 996 HD3 LYS 115 3HD LYS 115 12.524 -0.636 -12.655 997 HE2 LYS 115 2HE LYS 115 12.517 -2.112 -14.594 998 HE3 LYS 115 3HE LYS 115 13.602 -2.761 -13.362 999 HZ1 LYS 115 3HZ LYS 115 11.854 -4.298 -12.701 1000 HZ2 LYS 115 1HZ LYS 115 12.240 -4.485 -14.338 1001 HZ3 LYS 115 2HZ LYS 115 10.829 -3.676 -13.892 1002 H ILE 116 H ILE 116 9.022 -1.014 -8.460 1003 HA ILE 116 HA ILE 116 9.254 1.697 -7.633 1004 HB ILE 116 HB ILE 116 6.709 0.028 -7.681 1005 HG12 ILE 116 2HG1 ILE 116 7.820 -0.136 -9.873 1006 HG13 ILE 116 3HG1 ILE 116 6.388 0.868 -10.006 1007 HG21 ILE 116 1HG2 ILE 116 5.572 2.199 -8.039 1008 HG22 ILE 116 2HG2 ILE 116 7.120 3.037 -7.897 1009 HG23 ILE 116 3HG2 ILE 116 6.454 2.173 -6.510 1010 HD11 ILE 116 3HD1 ILE 116 7.806 2.875 -10.047 1011 HD12 ILE 116 1HD1 ILE 116 8.207 1.739 -11.335 1012 HD13 ILE 116 2HD1 ILE 116 9.243 1.854 -9.915 1013 H VAL 117 H VAL 117 8.619 -1.295 -5.911 1014 HA VAL 117 HA VAL 117 7.808 -0.393 -3.390 1015 HB VAL 117 HB VAL 117 9.626 -2.766 -4.068 1016 HG11 VAL 117 1HG1 VAL 117 9.832 -2.240 -1.676 1017 HG12 VAL 117 2HG1 VAL 117 8.936 -3.744 -1.892 1018 HG13 VAL 117 3HG1 VAL 117 8.074 -2.253 -1.497 1019 HG21 VAL 117 3HG2 VAL 117 6.611 -2.674 -3.643 1020 HG22 VAL 117 1HG2 VAL 117 7.564 -4.130 -3.956 1021 HG23 VAL 117 2HG2 VAL 117 7.432 -2.876 -5.188 1022 H ARG 118 H ARG 118 11.043 -0.704 -4.791 1023 HA ARG 118 HA ARG 118 12.507 0.169 -2.480 1024 HB2 ARG 118 2HB ARG 118 13.339 -0.108 -5.398 1025 HB3 ARG 118 3HB ARG 118 14.453 0.296 -4.091 1026 HG2 ARG 118 2HG ARG 118 13.944 -1.868 -2.999 1027 HG3 ARG 118 3HG ARG 118 12.857 -2.280 -4.330 1028 HD2 ARG 118 2HD ARG 118 14.731 -2.238 -5.902 1029 HD3 ARG 118 3HD ARG 118 15.831 -1.725 -4.617 1030 HE ARG 118 HE ARG 118 14.666 -4.102 -3.782 1031 HH11 ARG 118 1HH1 ARG 118 16.774 -3.073 -6.399 1032 HH12 ARG 118 2HH1 ARG 118 17.562 -4.614 -6.530 1033 HH21 ARG 118 1HH2 ARG 118 15.693 -6.097 -3.935 1034 HH22 ARG 118 2HH2 ARG 118 16.942 -6.349 -5.119 1035 H GLU 119 H GLU 119 11.088 1.777 -5.285 1036 HA GLU 119 HA GLU 119 12.368 4.289 -5.026 1037 HB2 GLU 119 2HB GLU 119 9.545 3.799 -6.088 1038 HB3 GLU 119 3HB GLU 119 10.557 5.203 -6.414 1039 HG2 GLU 119 2HG GLU 119 11.018 2.362 -7.363 1040 HG3 GLU 119 3HG GLU 119 10.499 3.728 -8.344 1041 H PHE 120 H PHE 120 9.255 3.054 -3.749 1042 HA PHE 120 HA PHE 120 8.376 5.248 -2.287 1043 HB2 PHE 120 2HB PHE 120 8.046 2.298 -1.584 1044 HB3 PHE 120 3HB PHE 120 7.143 3.608 -0.827 1045 HD1 PHE 120 HD2 PHE 120 6.381 5.331 -3.091 1046 HD2 PHE 120 HD1 PHE 120 6.489 1.061 -2.810 1047 HE1 PHE 120 HE2 PHE 120 4.612 5.168 -4.798 1048 HE2 PHE 120 HE1 PHE 120 4.746 0.919 -4.512 1049 HZ PHE 120 HZ PHE 120 3.786 2.956 -5.504 1050 H MET 121 H MET 121 10.716 2.776 -1.392 1051 HA MET 121 HA MET 121 11.054 3.340 1.339 1052 HB2 MET 121 2HB MET 121 13.014 2.156 -0.666 1053 HB3 MET 121 3HB MET 121 13.298 2.207 1.072 1054 HG2 MET 121 2HG MET 121 11.337 0.822 1.461 1055 HG3 MET 121 3HG MET 121 10.991 0.800 -0.272 1056 HE1 MET 121 3HE MET 121 10.892 -1.840 -0.211 1057 HE2 MET 121 1HE MET 121 11.205 -1.759 1.524 1058 HE3 MET 121 2HE MET 121 12.157 -2.843 0.505 1059 H GLN 122 H GLN 122 12.476 4.811 -1.533 1060 HA GLN 122 HA GLN 122 14.547 6.336 -0.307 1061 HB2 GLN 122 2HB GLN 122 13.075 6.872 -2.933 1062 HB3 GLN 122 3HB GLN 122 14.628 7.570 -2.461 1063 HG2 GLN 122 2HG GLN 122 15.710 5.430 -2.555 1064 HG3 GLN 122 3HG GLN 122 14.170 4.593 -2.738 1065 HE21 GLN 122 1HE2 GLN 122 14.771 3.578 -4.651 1066 HE22 GLN 122 2HE2 GLN 122 14.932 4.432 -6.147 1067 H LYS 123 H LYS 123 11.224 7.153 -1.305 1068 HA LYS 123 HA LYS 123 11.306 9.867 -0.349 1069 HB2 LYS 123 2HB LYS 123 8.929 8.135 -1.197 1070 HB3 LYS 123 3HB LYS 123 8.783 9.822 -0.719 1071 HG2 LYS 123 2HG LYS 123 8.777 9.860 -3.088 1072 HG3 LYS 123 3HG LYS 123 10.401 10.379 -2.626 1073 HD2 LYS 123 2HD LYS 123 11.157 7.977 -2.996 1074 HD3 LYS 123 3HD LYS 123 9.556 7.649 -3.659 1075 HE2 LYS 123 2HE LYS 123 11.582 9.617 -4.766 1076 HE3 LYS 123 3HE LYS 123 11.199 8.032 -5.433 1077 HZ1 LYS 123 3HZ LYS 123 10.074 9.718 -6.653 1078 HZ2 LYS 123 1HZ LYS 123 9.385 10.357 -5.249 1079 HZ3 LYS 123 2HZ LYS 123 8.932 8.828 -5.790 1080 H ALA 124 H ALA 124 10.436 6.764 1.012 1081 HA ALA 124 HA ALA 124 9.248 7.728 3.453 1082 HB1 ALA 124 3HB ALA 124 8.739 5.459 2.603 1083 HB2 ALA 124 1HB ALA 124 9.431 5.387 4.225 1084 HB3 ALA 124 2HB ALA 124 10.426 4.985 2.819 1085 H GLY 125 H GLY 125 12.478 7.133 2.256 1086 HA2 GLY 125 2HA GLY 125 13.950 7.084 4.688 1087 HA3 GLY 125 3HA GLY 125 14.579 7.498 3.100 1088 H SER 126 H SER 126 12.845 9.701 2.564 1089 HA SER 126 HA SER 126 14.095 11.872 3.902 1090 HB2 SER 126 2HB SER 126 11.553 11.797 2.224 1091 HB3 SER 126 3HB SER 126 12.424 13.267 2.676 1092 HG SER 126 HG SER 126 14.190 11.612 1.613 1093 H LEU 127 H LEU 127 11.353 9.925 4.735 1094 HA LEU 127 HA LEU 127 10.241 11.775 6.711 1095 HB2 LEU 127 2HB LEU 127 9.579 8.864 6.091 1096 HB3 LEU 127 3HB LEU 127 8.673 9.889 7.197 1097 HG LEU 127 HG LEU 127 8.954 10.446 4.214 1098 HD11 LEU 127 1HD1 LEU 127 6.623 9.149 5.659 1099 HD12 LEU 127 2HD1 LEU 127 7.752 8.340 4.568 1100 HD13 LEU 127 3HD1 LEU 127 6.684 9.595 3.948 1101 HD21 LEU 127 3HD2 LEU 127 7.098 12.032 4.558 1102 HD22 LEU 127 1HD2 LEU 127 8.496 12.465 5.542 1103 HD23 LEU 127 2HD2 LEU 127 7.101 11.683 6.290 1104 H GLU 128 H GLU 128 12.132 8.772 6.554 1105 HA GLU 128 HA GLU 128 12.420 8.074 9.234 1106 HB2 GLU 128 2HB GLU 128 14.412 7.807 6.935 1107 HB3 GLU 128 3HB GLU 128 14.646 7.044 8.503 1108 HG2 GLU 128 2HG GLU 128 12.346 6.488 6.611 1109 HG3 GLU 128 3HG GLU 128 13.790 5.493 6.772 1110 H HIS 129 H HIS 129 14.595 10.032 7.244 1111 HA HIS 129 HA HIS 129 15.217 11.935 9.278 1112 HB2 HIS 129 2HB HIS 129 16.650 10.073 10.095 1113 HB3 HIS 129 3HB HIS 129 17.407 9.935 8.510 1114 HD1 HIS 129 HD1 HIS 129 19.524 11.204 8.248 1115 HD2 HIS 129 HD2 HIS 129 17.167 12.776 11.289 1116 HE1 HIS 129 HE1 HIS 129 20.868 13.071 9.253 1117 HE2 HIS 129 HE2 HIS 129 19.494 13.869 11.202 1118 H HIS 130 H HIS 130 15.874 13.764 8.327 1119 HA HIS 130 HA HIS 130 16.718 15.301 6.936 1120 HB2 HIS 130 2HB HIS 130 18.744 13.757 7.001 1121 HB3 HIS 130 3HB HIS 130 18.191 13.058 5.484 1122 HD1 HIS 130 HD1 HIS 130 20.032 15.900 6.908 1123 HD2 HIS 130 HD2 HIS 130 18.378 14.882 3.241 1124 HE1 HIS 130 HE1 HIS 130 21.026 17.502 5.261 1125 HE2 HIS 130 HE2 HIS 130 20.146 16.747 3.030 1126 H HIS 131 H HIS 131 14.682 15.787 6.132 1127 HA HIS 131 HA HIS 131 13.590 14.509 3.761 1128 HB2 HIS 131 2HB HIS 131 12.157 15.351 5.673 1129 HB3 HIS 131 3HB HIS 131 12.587 16.994 5.230 1130 HD1 HIS 131 HD1 HIS 131 11.522 17.943 3.042 1131 HD2 HIS 131 HD2 HIS 131 10.211 14.131 4.066 1132 HE1 HIS 131 HE1 HIS 131 9.439 17.556 1.689 1133 HE2 HIS 131 HE2 HIS 131 8.791 15.173 2.180 1134 H HIS 132 H HIS 132 15.594 14.988 2.581 1135 HA HIS 132 HA HIS 132 16.298 17.629 1.744 1136 HB2 HIS 132 2HB HIS 132 17.929 15.771 1.697 1137 HB3 HIS 132 3HB HIS 132 16.944 14.905 0.533 1138 HD1 HIS 132 HD1 HIS 132 19.527 17.564 0.802 1139 HD2 HIS 132 HD2 HIS 132 17.078 15.933 -2.141 1140 HE1 HIS 132 HE1 HIS 132 20.474 18.344 -1.390 1141 HE2 HIS 132 HE2 HIS 132 19.014 17.300 -3.145 1142 H HIS 133 H HIS 133 15.509 18.795 0.130 1143 HA HIS 133 HA HIS 133 13.136 18.177 -1.310 1144 HB2 HIS 133 2HB HIS 133 15.158 20.435 -1.776 1145 HB3 HIS 133 3HB HIS 133 13.555 20.345 -2.500 1146 HD1 HIS 133 HD1 HIS 133 12.738 22.504 -1.418 1147 HD2 HIS 133 HD2 HIS 133 14.012 19.684 1.357 1148 HE1 HIS 133 HE1 HIS 133 12.005 23.378 0.815 1149 HE2 HIS 133 HE2 HIS 133 12.934 21.735 2.480 1150 H HIS 134 H HIS 134 13.432 16.319 -2.498 1151 HA HIS 134 HA HIS 134 15.771 15.999 -4.236 1152 HB2 HIS 134 2HB HIS 134 15.068 14.171 -2.638 1153 HB3 HIS 134 3HB HIS 134 13.575 13.985 -3.553 1154 HD1 HIS 134 HD1 HIS 134 17.281 13.412 -3.787 1155 HD2 HIS 134 HD2 HIS 134 13.836 12.483 -5.918 1156 HE1 HIS 134 HE1 HIS 134 18.004 11.780 -5.553 1157 HE2 HIS 134 HE2 HIS 134 15.911 11.269 -6.849
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