NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
567142 | 2mcq | 19449 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 H MET 1 1.808 -0.000 0.855 2 HA MET 1 HA MET 1 1.444 0.353 -2.030 3 HB2 MET 1 1HB MET 1 2.937 1.938 -0.925 4 HB3 MET 1 2HB MET 1 3.915 0.613 -0.306 5 HG2 MET 1 1HG MET 1 5.032 1.577 -2.179 6 HG3 MET 1 2HG MET 1 4.449 -0.022 -2.635 7 HE1 MET 1 3HE MET 1 4.185 3.808 -3.135 8 HE2 MET 1 1HE MET 1 5.252 2.961 -4.255 9 HE3 MET 1 2HE MET 1 3.804 3.767 -4.857 10 H ALA 2 H ALA 2 1.499 -1.384 -3.280 11 HA ALA 2 HA ALA 2 1.941 -3.468 -4.084 12 HB1 ALA 2 1HB ALA 2 4.281 -2.362 -3.909 13 HB2 ALA 2 2HB ALA 2 4.523 -3.492 -2.576 14 HB3 ALA 2 3HB ALA 2 4.163 -4.099 -4.192 15 H ILE 3 H ILE 3 0.648 -3.150 -1.430 16 HA ILE 3 HA ILE 3 1.497 -5.094 0.391 17 HB ILE 3 HB ILE 3 -0.226 -3.343 0.848 18 HG12 ILE 3 1HG1 ILE 3 -1.550 -5.912 1.536 19 HG13 ILE 3 2HG1 ILE 3 0.126 -5.723 2.039 20 HG21 ILE 3 1HG2 ILE 3 -2.158 -3.234 -0.253 21 HG22 ILE 3 2HG2 ILE 3 -1.489 -4.429 -1.363 22 HG23 ILE 3 3HG2 ILE 3 -2.481 -4.949 -0.002 23 HD11 ILE 3 3HD1 ILE 3 -1.026 -4.958 3.871 24 HD12 ILE 3 1HD1 ILE 3 -0.695 -3.460 3.002 25 HD13 ILE 3 2HD1 ILE 3 -2.290 -4.207 2.898 26 H SER 4 H SER 4 0.727 -7.207 0.819 27 HA SER 4 HA SER 4 0.642 -8.930 -1.353 28 HB2 SER 4 1HB SER 4 -0.368 -9.336 1.470 29 HB3 SER 4 2HB SER 4 -0.206 -10.633 0.286 30 HG SER 4 HG SER 4 1.968 -10.412 0.324 31 H ALA 5 H ALA 5 -1.032 -10.180 -2.281 32 HA ALA 5 HA ALA 5 -3.414 -8.731 -2.813 33 HB1 ALA 5 1HB ALA 5 -2.299 -11.361 -3.623 34 HB2 ALA 5 2HB ALA 5 -4.028 -11.091 -3.845 35 HB3 ALA 5 3HB ALA 5 -2.861 -10.014 -4.613 36 H GLU 6 H GLU 6 -2.548 -11.105 -0.458 37 HA GLU 6 HA GLU 6 -5.161 -12.067 0.115 38 HB2 GLU 6 1HB GLU 6 -4.162 -12.983 2.154 39 HB3 GLU 6 2HB GLU 6 -3.159 -13.320 0.750 40 HG2 GLU 6 1HG GLU 6 -1.505 -11.859 1.410 41 HG3 GLU 6 2HG GLU 6 -2.596 -10.920 2.427 42 H GLU 7 H GLU 7 -3.492 -9.175 0.875 43 HA GLU 7 HA GLU 7 -5.140 -8.564 3.187 44 HB2 GLU 7 1HB GLU 7 -2.612 -7.882 2.628 45 HB3 GLU 7 2HB GLU 7 -3.425 -6.487 1.932 46 HG2 GLU 7 1HG GLU 7 -2.715 -6.111 4.247 47 HG3 GLU 7 2HG GLU 7 -4.461 -5.977 4.044 48 H LEU 8 H LEU 8 -5.104 -7.999 -0.211 49 HA LEU 8 HA LEU 8 -6.474 -5.626 -0.497 50 HB2 LEU 8 1HB LEU 8 -5.712 -6.632 -2.457 51 HB3 LEU 8 2HB LEU 8 -6.486 -8.169 -2.078 52 HG LEU 8 HG LEU 8 -8.686 -7.132 -2.530 53 HD11 LEU 8 1HD1 LEU 8 -7.439 -4.839 -3.906 54 HD12 LEU 8 2HD1 LEU 8 -7.494 -4.760 -2.146 55 HD13 LEU 8 3HD1 LEU 8 -8.985 -4.961 -3.066 56 HD21 LEU 8 3HD2 LEU 8 -6.540 -7.353 -4.576 57 HD22 LEU 8 1HD2 LEU 8 -8.097 -6.685 -5.064 58 HD23 LEU 8 2HD2 LEU 8 -8.012 -8.304 -4.370 59 H GLU 9 H GLU 9 -7.696 -8.771 0.446 60 HA GLU 9 HA GLU 9 -10.457 -8.126 0.185 61 HB2 GLU 9 1HB GLU 9 -10.852 -10.172 1.469 62 HB3 GLU 9 2HB GLU 9 -9.675 -10.444 0.192 63 HG2 GLU 9 1HG GLU 9 -8.018 -9.834 2.210 64 HG3 GLU 9 2HG GLU 9 -9.356 -10.535 3.119 65 H LYS 10 H LYS 10 -8.135 -7.996 2.837 66 HA LYS 10 HA LYS 10 -9.799 -7.519 4.981 67 HB2 LYS 10 1HB LYS 10 -7.269 -7.766 4.976 68 HB3 LYS 10 2HB LYS 10 -7.192 -6.062 4.550 69 HG2 LYS 10 1HG LYS 10 -6.967 -5.930 6.814 70 HG3 LYS 10 2HG LYS 10 -8.721 -5.794 6.669 71 HD2 LYS 10 1HD LYS 10 -8.609 -8.416 6.863 72 HD3 LYS 10 2HD LYS 10 -7.059 -8.074 7.636 73 HE2 LYS 10 1HE LYS 10 -8.113 -6.728 9.306 74 HE3 LYS 10 2HE LYS 10 -9.659 -6.795 8.462 75 HZ1 LYS 10 3HZ LYS 10 -9.812 -9.132 8.926 76 HZ2 LYS 10 1HZ LYS 10 -9.537 -8.308 10.378 77 HZ3 LYS 10 2HZ LYS 10 -8.274 -9.148 9.630 78 H ILE 11 H ILE 11 -8.933 -5.385 2.365 79 HA ILE 11 HA ILE 11 -9.935 -3.008 3.637 80 HB ILE 11 HB ILE 11 -9.252 -3.515 0.739 81 HG12 ILE 11 1HG1 ILE 11 -7.356 -1.816 1.739 82 HG13 ILE 11 2HG1 ILE 11 -7.664 -2.853 3.127 83 HG21 ILE 11 1HG2 ILE 11 -9.028 -0.921 0.858 84 HG22 ILE 11 2HG2 ILE 11 -10.613 -1.659 0.630 85 HG23 ILE 11 3HG2 ILE 11 -10.131 -1.080 2.225 86 HD11 ILE 11 3HD1 ILE 11 -7.438 -4.599 0.981 87 HD12 ILE 11 1HD1 ILE 11 -6.180 -3.390 0.720 88 HD13 ILE 11 2HD1 ILE 11 -6.238 -4.290 2.237 89 H LEU 12 H LEU 12 -11.081 -5.217 1.108 90 HA LEU 12 HA LEU 12 -13.470 -3.849 0.526 91 HB2 LEU 12 1HB LEU 12 -12.423 -6.590 0.081 92 HB3 LEU 12 2HB LEU 12 -14.158 -6.340 -0.099 93 HG LEU 12 HG LEU 12 -12.025 -4.851 -1.628 94 HD11 LEU 12 1HD1 LEU 12 -11.877 -6.841 -2.684 95 HD12 LEU 12 2HD1 LEU 12 -13.341 -6.267 -3.482 96 HD13 LEU 12 3HD1 LEU 12 -13.459 -7.384 -2.123 97 HD21 LEU 12 3HD2 LEU 12 -13.632 -3.465 -2.273 98 HD22 LEU 12 1HD2 LEU 12 -14.740 -4.254 -1.150 99 HD23 LEU 12 2HD2 LEU 12 -14.621 -4.821 -2.816 100 H LYS 13 H LYS 13 -12.537 -5.656 3.247 101 HA LYS 13 HA LYS 13 -15.107 -6.623 4.027 102 HB2 LYS 13 1HB LYS 13 -12.670 -6.116 5.743 103 HB3 LYS 13 2HB LYS 13 -14.056 -7.109 6.173 104 HG2 LYS 13 1HG LYS 13 -12.916 -7.973 3.674 105 HG3 LYS 13 2HG LYS 13 -11.698 -7.938 4.951 106 HD2 LYS 13 1HD LYS 13 -14.371 -9.335 5.087 107 HD3 LYS 13 2HD LYS 13 -12.805 -10.114 4.844 108 HE2 LYS 13 1HE LYS 13 -12.556 -8.500 7.137 109 HE3 LYS 13 2HE LYS 13 -14.094 -9.350 7.288 110 HZ1 LYS 13 3HZ LYS 13 -11.384 -10.500 7.014 111 HZ2 LYS 13 1HZ LYS 13 -12.771 -11.415 6.691 112 HZ3 LYS 13 2HZ LYS 13 -12.524 -10.769 8.235 113 H LYS 14 H LYS 14 -13.441 -3.607 4.324 114 HA LYS 14 HA LYS 14 -14.549 -2.437 6.542 115 HB2 LYS 14 1HB LYS 14 -13.819 -1.315 3.852 116 HB3 LYS 14 2HB LYS 14 -14.490 -0.281 5.106 117 HG2 LYS 14 1HG LYS 14 -11.985 -1.935 5.355 118 HG3 LYS 14 2HG LYS 14 -12.050 -0.196 5.055 119 HD2 LYS 14 1HD LYS 14 -13.617 -0.426 7.271 120 HD3 LYS 14 2HD LYS 14 -12.427 -1.701 7.548 121 HE2 LYS 14 1HE LYS 14 -11.223 0.765 6.589 122 HE3 LYS 14 2HE LYS 14 -12.109 0.990 8.096 123 HZ1 LYS 14 3HZ LYS 14 -10.387 -1.345 7.974 124 HZ2 LYS 14 1HZ LYS 14 -10.651 -0.257 9.243 125 HZ3 LYS 14 2HZ LYS 14 -9.593 0.149 7.987 126 H SER 15 H SER 15 -15.980 -2.652 3.299 127 HA SER 15 HA SER 15 -18.548 -1.789 4.454 128 HB2 SER 15 1HB SER 15 -17.175 -1.075 2.018 129 HB3 SER 15 2HB SER 15 -18.751 -1.771 1.645 130 HG SER 15 HG SER 15 -18.142 0.499 3.206 131 H PHE 16 H PHE 16 -16.871 -4.345 2.854 132 HA PHE 16 HA PHE 16 -19.326 -5.959 2.924 133 HB2 PHE 16 1HB PHE 16 -17.273 -6.314 0.752 134 HB3 PHE 16 2HB PHE 16 -18.930 -6.907 0.805 135 HD1 PHE 16 HD1 PHE 16 -20.676 -4.829 1.171 136 HD2 PHE 16 HD2 PHE 16 -16.896 -4.664 -0.780 137 HE1 PHE 16 HE1 PHE 16 -21.422 -2.860 -0.101 138 HE2 PHE 16 HE2 PHE 16 -17.636 -2.695 -2.055 139 HZ PHE 16 HZ PHE 16 -19.902 -1.789 -1.716 140 HA PRO 17 HA PRO 17 -15.870 -7.980 5.265 141 HB2 PRO 17 1HB PRO 17 -17.409 -8.669 7.392 142 HB3 PRO 17 2HB PRO 17 -16.615 -7.097 7.250 143 HG2 PRO 17 1HG PRO 17 -19.455 -7.844 6.668 144 HG3 PRO 17 2HG PRO 17 -18.823 -6.414 7.506 145 HD2 PRO 17 1HD PRO 17 -19.616 -6.354 4.918 146 HD3 PRO 17 2HD PRO 17 -18.300 -5.336 5.537 147 H SER 18 H SER 18 -19.269 -9.077 5.229 148 HA SER 18 HA SER 18 -18.628 -11.832 5.349 149 HB2 SER 18 1HB SER 18 -21.179 -10.732 4.179 150 HB3 SER 18 2HB SER 18 -20.939 -12.237 5.065 151 HG SER 18 HG SER 18 -20.838 -11.140 6.937 152 H SER 19 H SER 19 -18.830 -9.553 2.751 153 HA SER 19 HA SER 19 -19.355 -11.129 0.556 154 HB2 SER 19 1HB SER 19 -17.872 -8.620 1.030 155 HB3 SER 19 2HB SER 19 -17.443 -9.474 -0.452 156 HG SER 19 HG SER 19 -19.141 -8.373 -1.127 157 H VAL 20 H VAL 20 -18.033 -12.225 -0.961 158 HA VAL 20 HA VAL 20 -15.709 -13.509 0.279 159 HB VAL 20 HB VAL 20 -17.246 -14.316 -2.194 160 HG11 VAL 20 1HG1 VAL 20 -16.025 -16.527 -1.675 161 HG12 VAL 20 2HG1 VAL 20 -15.124 -15.232 -2.465 162 HG13 VAL 20 3HG1 VAL 20 -14.923 -15.521 -0.736 163 HG21 VAL 20 3HG2 VAL 20 -17.354 -15.351 0.636 164 HG22 VAL 20 1HG2 VAL 20 -18.647 -14.546 -0.254 165 HG23 VAL 20 2HG2 VAL 20 -18.101 -16.148 -0.748 166 H ILE 21 H ILE 21 -13.902 -12.375 -0.116 167 HA ILE 21 HA ILE 21 -13.474 -11.212 -2.764 168 HB ILE 21 HB ILE 21 -11.737 -10.953 -0.309 169 HG12 ILE 21 1HG1 ILE 21 -12.885 -8.525 -0.586 170 HG13 ILE 21 2HG1 ILE 21 -14.199 -9.542 -1.167 171 HG21 ILE 21 1HG2 ILE 21 -11.227 -10.336 -2.973 172 HG22 ILE 21 2HG2 ILE 21 -11.640 -8.794 -2.223 173 HG23 ILE 21 3HG2 ILE 21 -10.330 -9.772 -1.563 174 HD11 ILE 21 3HD1 ILE 21 -14.786 -9.815 0.947 175 HD12 ILE 21 1HD1 ILE 21 -13.325 -10.779 1.160 176 HD13 ILE 21 2HD1 ILE 21 -13.303 -9.052 1.522 177 H LYS 22 H LYS 22 -12.065 -11.999 -4.208 178 HA LYS 22 HA LYS 22 -9.977 -13.847 -3.381 179 HB2 LYS 22 1HB LYS 22 -11.992 -15.246 -3.838 180 HB3 LYS 22 2HB LYS 22 -12.004 -14.627 -5.484 181 HG2 LYS 22 1HG LYS 22 -10.886 -16.574 -5.821 182 HG3 LYS 22 2HG LYS 22 -9.518 -15.518 -5.462 183 HD2 LYS 22 1HD LYS 22 -9.105 -17.356 -4.111 184 HD3 LYS 22 2HD LYS 22 -9.920 -16.247 -3.006 185 HE2 LYS 22 1HE LYS 22 -12.018 -17.414 -3.338 186 HE3 LYS 22 2HE LYS 22 -11.268 -18.476 -4.528 187 HZ1 LYS 22 3HZ LYS 22 -11.287 -19.704 -2.566 188 HZ2 LYS 22 1HZ LYS 22 -10.824 -18.388 -1.608 189 HZ3 LYS 22 2HZ LYS 22 -9.703 -19.115 -2.646 190 H ILE 23 H ILE 23 -8.185 -13.703 -4.624 191 HA ILE 23 HA ILE 23 -8.331 -11.905 -6.948 192 HB ILE 23 HB ILE 23 -5.944 -12.610 -5.237 193 HG12 ILE 23 1HG1 ILE 23 -6.224 -9.978 -4.898 194 HG13 ILE 23 2HG1 ILE 23 -7.908 -10.369 -5.230 195 HG21 ILE 23 1HG2 ILE 23 -5.123 -10.474 -6.581 196 HG22 ILE 23 2HG2 ILE 23 -4.917 -12.110 -7.204 197 HG23 ILE 23 3HG2 ILE 23 -6.253 -11.111 -7.777 198 HD11 ILE 23 3HD1 ILE 23 -8.065 -11.757 -3.347 199 HD12 ILE 23 1HD1 ILE 23 -6.314 -11.812 -3.141 200 HD13 ILE 23 2HD1 ILE 23 -7.196 -10.321 -2.806 201 H THR 24 H THR 24 -7.423 -12.475 -8.895 202 HA THR 24 HA THR 24 -6.201 -15.129 -9.128 203 HB THR 24 HB THR 24 -8.489 -14.177 -10.863 204 HG1 THR 24 HG1 THR 24 -9.374 -14.987 -9.024 205 HG21 THR 24 3HG2 THR 24 -6.435 -16.228 -11.226 206 HG22 THR 24 1HG2 THR 24 -7.526 -15.498 -12.404 207 HG23 THR 24 2HG2 THR 24 -8.081 -16.837 -11.398 208 H ASP 25 H ASP 25 -4.653 -15.302 -10.690 209 HA ASP 25 HA ASP 25 -3.748 -12.814 -11.880 210 HB2 ASP 25 1HB ASP 25 -1.755 -14.128 -12.536 211 HB3 ASP 25 2HB ASP 25 -2.090 -14.236 -10.810 212 H LEU 26 H LEU 26 -4.008 -12.241 -13.942 213 HA LEU 26 HA LEU 26 -5.295 -14.158 -15.749 214 HB2 LEU 26 1HB LEU 26 -5.255 -11.194 -15.520 215 HB3 LEU 26 2HB LEU 26 -5.484 -11.900 -17.119 216 HG LEU 26 HG LEU 26 -7.234 -12.556 -14.756 217 HD11 LEU 26 1HD1 LEU 26 -7.495 -10.216 -15.129 218 HD12 LEU 26 2HD1 LEU 26 -8.879 -11.031 -15.855 219 HD13 LEU 26 3HD1 LEU 26 -7.567 -10.444 -16.876 220 HD21 LEU 26 3HD2 LEU 26 -8.757 -13.019 -16.864 221 HD22 LEU 26 1HD2 LEU 26 -7.632 -14.232 -16.253 222 HD23 LEU 26 2HD2 LEU 26 -7.192 -13.245 -17.647 223 H VAL 27 H VAL 27 -2.551 -11.948 -15.523 224 HA VAL 27 HA VAL 27 -1.428 -13.201 -17.945 225 HB VAL 27 HB VAL 27 0.006 -11.113 -18.080 226 HG11 VAL 27 1HG1 VAL 27 -2.881 -11.346 -18.663 227 HG12 VAL 27 2HG1 VAL 27 -2.180 -9.731 -18.792 228 HG13 VAL 27 3HG1 VAL 27 -1.521 -11.059 -19.749 229 HG21 VAL 27 3HG2 VAL 27 -0.462 -9.229 -16.833 230 HG22 VAL 27 1HG2 VAL 27 -2.098 -9.761 -16.448 231 HG23 VAL 27 2HG2 VAL 27 -0.716 -10.507 -15.646 232 H GLY 28 H GLY 28 -0.933 -12.375 -14.607 233 HA2 GLY 28 1HA GLY 28 0.722 -12.921 -13.114 234 HA3 GLY 28 2HA GLY 28 1.058 -14.278 -14.179 235 H ASP 29 H ASP 29 1.339 -10.894 -15.087 236 HA ASP 29 HA ASP 29 4.267 -11.151 -15.050 237 HB2 ASP 29 1HB ASP 29 2.519 -10.296 -17.348 238 HB3 ASP 29 2HB ASP 29 4.205 -9.798 -17.239 239 H GLN 30 H GLN 30 1.683 -8.787 -15.738 240 HA GLN 30 HA GLN 30 3.277 -6.727 -14.403 241 HB2 GLN 30 1HB GLN 30 1.642 -5.144 -15.382 242 HB3 GLN 30 2HB GLN 30 2.453 -6.125 -16.595 243 HG2 GLN 30 1HG GLN 30 0.560 -7.315 -17.103 244 HG3 GLN 30 2HG GLN 30 -0.174 -7.028 -15.526 245 HE21 GLN 30 2HE2 GLN 30 -1.324 -5.160 -15.170 246 HE22 GLN 30 1HE2 GLN 30 -1.783 -4.083 -16.441 247 H ASP 31 H ASP 31 1.547 -4.990 -13.416 248 HA ASP 31 HA ASP 31 0.539 -6.323 -11.079 249 HB2 ASP 31 1HB ASP 31 0.124 -3.423 -11.802 250 HB3 ASP 31 2HB ASP 31 0.140 -4.149 -10.197 251 H HIS 32 H HIS 32 -0.936 -7.605 -12.638 252 HA HIS 32 HA HIS 32 -3.506 -6.183 -12.888 253 HB2 HIS 32 1HB HIS 32 -2.309 -7.070 -15.008 254 HB3 HIS 32 2HB HIS 32 -2.820 -8.660 -14.448 255 HD1 HIS 32 HD1 HIS 32 -4.136 -8.456 -16.858 256 HD2 HIS 32 HD2 HIS 32 -5.565 -6.184 -13.687 257 HE1 HIS 32 HE1 HIS 32 -6.490 -7.831 -17.486 258 H TYR 33 H TYR 33 -4.547 -6.686 -11.037 259 HA TYR 33 HA TYR 33 -4.666 -9.516 -10.245 260 HB2 TYR 33 1HB TYR 33 -5.066 -6.972 -8.675 261 HB3 TYR 33 2HB TYR 33 -5.537 -8.550 -8.052 262 HD1 TYR 33 HD1 TYR 33 -3.510 -10.372 -8.471 263 HD2 TYR 33 HD2 TYR 33 -3.073 -6.187 -7.843 264 HE1 TYR 33 HE1 TYR 33 -1.219 -10.740 -7.655 265 HE2 TYR 33 HE2 TYR 33 -0.781 -6.542 -7.026 266 HH TYR 33 HH TYR 33 1.002 -9.039 -7.578 267 H ALA 34 H ALA 34 -6.513 -10.597 -10.457 268 HA ALA 34 HA ALA 34 -8.878 -9.166 -11.381 269 HB1 ALA 34 1HB ALA 34 -9.526 -11.085 -12.396 270 HB2 ALA 34 2HB ALA 34 -7.802 -11.440 -12.277 271 HB3 ALA 34 3HB ALA 34 -8.924 -12.110 -11.093 272 H LEU 35 H LEU 35 -9.961 -8.283 -9.704 273 HA LEU 35 HA LEU 35 -10.256 -9.651 -7.188 274 HB2 LEU 35 1HB LEU 35 -10.308 -7.032 -7.951 275 HB3 LEU 35 2HB LEU 35 -12.022 -7.375 -7.726 276 HG LEU 35 HG LEU 35 -9.820 -7.521 -5.679 277 HD11 LEU 35 1HD1 LEU 35 -11.236 -5.919 -4.492 278 HD12 LEU 35 2HD1 LEU 35 -12.388 -5.948 -5.826 279 HD13 LEU 35 3HD1 LEU 35 -10.763 -5.314 -6.080 280 HD21 LEU 35 3HD2 LEU 35 -11.095 -9.449 -5.227 281 HD22 LEU 35 1HD2 LEU 35 -12.614 -8.627 -5.587 282 HD23 LEU 35 2HD2 LEU 35 -11.710 -8.210 -4.131 283 H GLU 36 H GLU 36 -12.026 -10.694 -6.401 284 HA GLU 36 HA GLU 36 -14.405 -10.850 -8.119 285 HB2 GLU 36 1HB GLU 36 -13.259 -13.258 -6.713 286 HB3 GLU 36 2HB GLU 36 -14.539 -13.217 -7.917 287 HG2 GLU 36 1HG GLU 36 -12.965 -12.607 -9.636 288 HG3 GLU 36 2HG GLU 36 -11.667 -12.492 -8.449 289 H ILE 37 H ILE 37 -15.945 -9.925 -6.932 290 HA ILE 37 HA ILE 37 -16.060 -10.514 -4.053 291 HB ILE 37 HB ILE 37 -15.940 -8.115 -4.730 292 HG12 ILE 37 1HG1 ILE 37 -18.399 -7.756 -3.505 293 HG13 ILE 37 2HG1 ILE 37 -17.926 -9.373 -2.997 294 HG21 ILE 37 1HG2 ILE 37 -18.776 -8.123 -5.550 295 HG22 ILE 37 2HG2 ILE 37 -17.439 -7.110 -6.092 296 HG23 ILE 37 3HG2 ILE 37 -17.617 -8.747 -6.723 297 HD11 ILE 37 3HD1 ILE 37 -16.172 -8.621 -1.768 298 HD12 ILE 37 1HD1 ILE 37 -15.904 -7.216 -2.799 299 HD13 ILE 37 2HD1 ILE 37 -17.236 -7.220 -1.643 300 H SER 38 H SER 38 -17.767 -11.543 -3.177 301 HA SER 38 HA SER 38 -20.135 -12.011 -4.851 302 HB2 SER 38 1HB SER 38 -18.310 -13.961 -4.608 303 HB3 SER 38 2HB SER 38 -19.225 -14.260 -3.130 304 HG SER 38 HG SER 38 -21.130 -14.171 -4.592 305 H ASP 39 H ASP 39 -21.947 -11.515 -3.820 306 HA ASP 39 HA ASP 39 -22.489 -12.201 -1.130 307 HB2 ASP 39 1HB ASP 39 -22.702 -9.837 -0.269 308 HB3 ASP 39 2HB ASP 39 -21.050 -10.404 -0.496 309 H ALA 40 H ALA 40 -24.479 -10.618 -0.394 310 HA ALA 40 HA ALA 40 -26.349 -10.728 -2.667 311 HB1 ALA 40 1HB ALA 40 -26.570 -12.103 -0.379 312 HB2 ALA 40 2HB ALA 40 -27.420 -10.628 0.084 313 HB3 ALA 40 3HB ALA 40 -27.961 -11.555 -1.315 314 H GLN 41 H GLN 41 -24.559 -8.483 -1.827 315 HA GLN 41 HA GLN 41 -26.606 -6.467 -1.189 316 HB2 GLN 41 1HB GLN 41 -23.603 -6.240 -0.928 317 HB3 GLN 41 2HB GLN 41 -24.784 -5.035 -0.432 318 HG2 GLN 41 1HG GLN 41 -25.425 -6.216 1.418 319 HG3 GLN 41 2HG GLN 41 -24.972 -7.769 0.717 320 HE21 GLN 41 2HE2 GLN 41 -23.073 -8.625 1.251 321 HE22 GLN 41 1HE2 GLN 41 -21.830 -7.822 2.141 322 H PHE 42 H PHE 42 -24.584 -7.654 -3.639 323 HA PHE 42 HA PHE 42 -24.578 -5.138 -5.123 324 HB2 PHE 42 1HB PHE 42 -23.137 -7.742 -5.384 325 HB3 PHE 42 2HB PHE 42 -23.341 -6.745 -6.820 326 HD1 PHE 42 HD1 PHE 42 -22.661 -5.837 -3.273 327 HD2 PHE 42 HD2 PHE 42 -21.299 -5.799 -7.305 328 HE1 PHE 42 HE1 PHE 42 -20.720 -4.481 -2.601 329 HE2 PHE 42 HE2 PHE 42 -19.356 -4.444 -6.640 330 HZ PHE 42 HZ PHE 42 -19.064 -3.784 -4.285 331 H ASN 43 H ASN 43 -27.014 -6.786 -4.579 332 HA ASN 43 HA ASN 43 -27.757 -7.704 -7.245 333 HB2 ASN 43 1HB ASN 43 -28.895 -8.012 -4.503 334 HB3 ASN 43 2HB ASN 43 -29.991 -8.140 -5.875 335 HD21 ASN 43 2HD2 ASN 43 -27.157 -9.491 -4.339 336 HD22 ASN 43 1HD2 ASN 43 -27.232 -11.031 -5.118 337 H GLY 44 H GLY 44 -28.709 -6.398 -8.654 338 HA2 GLY 44 1HA GLY 44 -30.535 -4.968 -9.262 339 HA3 GLY 44 2HA GLY 44 -30.490 -4.285 -7.643 340 H LEU 45 H LEU 45 -27.485 -4.145 -7.834 341 HA LEU 45 HA LEU 45 -27.346 -1.473 -8.808 342 HB2 LEU 45 1HB LEU 45 -25.286 -3.428 -7.831 343 HB3 LEU 45 2HB LEU 45 -24.851 -1.823 -8.417 344 HG LEU 45 HG LEU 45 -26.886 -2.031 -6.254 345 HD11 LEU 45 1HD1 LEU 45 -25.509 -3.248 -4.980 346 HD12 LEU 45 2HD1 LEU 45 -24.562 -1.766 -4.851 347 HD13 LEU 45 3HD1 LEU 45 -24.131 -2.987 -6.048 348 HD21 LEU 45 3HD2 LEU 45 -24.591 -0.118 -6.514 349 HD22 LEU 45 1HD2 LEU 45 -26.129 0.099 -5.677 350 HD23 LEU 45 2HD2 LEU 45 -26.078 0.095 -7.441 351 H SER 46 H SER 46 -25.650 -0.768 -10.385 352 HA SER 46 HA SER 46 -25.796 -2.479 -12.761 353 HB2 SER 46 1HB SER 46 -26.674 -0.188 -12.982 354 HB3 SER 46 2HB SER 46 -25.098 0.459 -12.526 355 HG SER 46 HG SER 46 -25.884 -0.080 -14.928 356 H LEU 47 H LEU 47 -23.880 -2.375 -14.250 357 HA LEU 47 HA LEU 47 -21.614 -3.416 -13.023 358 HB2 LEU 47 1HB LEU 47 -22.161 -2.278 -15.730 359 HB3 LEU 47 2HB LEU 47 -20.514 -2.717 -15.284 360 HG LEU 47 HG LEU 47 -21.557 -4.497 -16.556 361 HD11 LEU 47 1HD1 LEU 47 -20.902 -6.266 -15.209 362 HD12 LEU 47 2HD1 LEU 47 -21.482 -5.493 -13.735 363 HD13 LEU 47 3HD1 LEU 47 -20.019 -4.903 -14.523 364 HD21 LEU 47 3HD2 LEU 47 -23.542 -5.585 -15.940 365 HD22 LEU 47 1HD2 LEU 47 -23.899 -3.866 -15.767 366 HD23 LEU 47 2HD2 LEU 47 -23.555 -4.843 -14.339 367 H ILE 48 H ILE 48 -22.533 -0.129 -13.584 368 HA ILE 48 HA ILE 48 -19.882 0.946 -13.208 369 HB ILE 48 HB ILE 48 -22.545 2.370 -13.211 370 HG12 ILE 48 1HG1 ILE 48 -22.105 1.242 -15.340 371 HG13 ILE 48 2HG1 ILE 48 -21.971 2.988 -15.523 372 HG21 ILE 48 1HG2 ILE 48 -19.718 3.400 -13.367 373 HG22 ILE 48 2HG2 ILE 48 -21.150 4.373 -13.700 374 HG23 ILE 48 3HG2 ILE 48 -20.897 3.700 -12.090 375 HD11 ILE 48 3HD1 ILE 48 -19.665 1.079 -15.220 376 HD12 ILE 48 1HD1 ILE 48 -20.218 1.801 -16.731 377 HD13 ILE 48 2HD1 ILE 48 -19.552 2.823 -15.457 378 H ASN 49 H ASN 49 -22.838 0.618 -11.296 379 HA ASN 49 HA ASN 49 -21.882 2.048 -9.038 380 HB2 ASN 49 1HB ASN 49 -24.027 -0.084 -9.093 381 HB3 ASN 49 2HB ASN 49 -23.818 1.177 -7.881 382 HD21 ASN 49 2HD2 ASN 49 -26.183 0.723 -9.315 383 HD22 ASN 49 1HD2 ASN 49 -26.490 2.106 -10.303 384 H GLN 50 H GLN 50 -21.909 -1.371 -9.927 385 HA GLN 50 HA GLN 50 -20.927 -2.351 -7.462 386 HB2 GLN 50 1HB GLN 50 -20.709 -3.552 -10.228 387 HB3 GLN 50 2HB GLN 50 -20.411 -4.406 -8.720 388 HG2 GLN 50 1HG GLN 50 -22.610 -4.611 -8.237 389 HG3 GLN 50 2HG GLN 50 -23.034 -3.079 -8.998 390 HE21 GLN 50 2HE2 GLN 50 -24.777 -4.833 -9.573 391 HE22 GLN 50 1HE2 GLN 50 -24.564 -5.559 -11.126 392 H HIS 51 H HIS 51 -19.347 -1.288 -10.432 393 HA HIS 51 HA HIS 51 -16.719 -2.031 -9.564 394 HB2 HIS 51 1HB HIS 51 -17.712 -1.581 -11.992 395 HB3 HIS 51 2HB HIS 51 -17.115 0.044 -11.668 396 HD1 HIS 51 HD1 HIS 51 -14.512 0.285 -11.311 397 HD2 HIS 51 HD2 HIS 51 -15.782 -3.450 -12.613 398 HE1 HIS 51 HE1 HIS 51 -12.440 -0.882 -12.128 399 H LYS 52 H LYS 52 -18.747 0.769 -9.255 400 HA LYS 52 HA LYS 52 -16.607 2.544 -8.493 401 HB2 LYS 52 1HB LYS 52 -18.778 3.240 -9.619 402 HB3 LYS 52 2HB LYS 52 -19.562 2.976 -8.066 403 HG2 LYS 52 1HG LYS 52 -17.708 4.590 -7.185 404 HG3 LYS 52 2HG LYS 52 -17.620 5.085 -8.877 405 HD2 LYS 52 1HD LYS 52 -20.290 4.909 -7.561 406 HD3 LYS 52 2HD LYS 52 -19.248 6.286 -7.196 407 HE2 LYS 52 1HE LYS 52 -19.020 6.543 -9.733 408 HE3 LYS 52 2HE LYS 52 -20.397 5.448 -9.842 409 HZ1 LYS 52 3HZ LYS 52 -20.285 8.188 -8.786 410 HZ2 LYS 52 1HZ LYS 52 -21.449 7.118 -8.181 411 HZ3 LYS 52 2HZ LYS 52 -21.415 7.486 -9.832 412 H LEU 53 H LEU 53 -19.172 0.744 -6.851 413 HA LEU 53 HA LEU 53 -18.920 1.716 -4.286 414 HB2 LEU 53 1HB LEU 53 -19.724 -0.888 -5.456 415 HB3 LEU 53 2HB LEU 53 -19.401 -0.844 -3.724 416 HG LEU 53 HG LEU 53 -21.427 0.865 -5.168 417 HD11 LEU 53 1HD1 LEU 53 -21.595 -1.750 -3.756 418 HD12 LEU 53 2HD1 LEU 53 -22.434 -1.191 -5.202 419 HD13 LEU 53 3HD1 LEU 53 -22.937 -0.615 -3.613 420 HD21 LEU 53 3HD2 LEU 53 -21.063 2.153 -3.349 421 HD22 LEU 53 1HD2 LEU 53 -20.353 0.833 -2.419 422 HD23 LEU 53 2HD2 LEU 53 -22.106 0.962 -2.570 423 H VAL 54 H VAL 54 -17.188 -1.086 -5.654 424 HA VAL 54 HA VAL 54 -15.586 -1.697 -3.490 425 HB VAL 54 HB VAL 54 -13.961 -2.628 -5.126 426 HG11 VAL 54 1HG1 VAL 54 -16.574 -3.426 -4.599 427 HG12 VAL 54 2HG1 VAL 54 -16.384 -3.620 -6.343 428 HG13 VAL 54 3HG1 VAL 54 -15.269 -4.424 -5.238 429 HG21 VAL 54 3HG2 VAL 54 -14.169 -0.918 -6.854 430 HG22 VAL 54 1HG2 VAL 54 -14.486 -2.522 -7.515 431 HG23 VAL 54 2HG2 VAL 54 -15.827 -1.428 -7.173 432 H LYS 55 H LYS 55 -15.221 0.855 -5.862 433 HA LYS 55 HA LYS 55 -12.566 1.570 -5.002 434 HB2 LYS 55 1HB LYS 55 -14.546 2.958 -6.814 435 HB3 LYS 55 2HB LYS 55 -12.920 3.549 -6.500 436 HG2 LYS 55 1HG LYS 55 -13.454 0.813 -7.616 437 HG3 LYS 55 2HG LYS 55 -13.261 2.242 -8.635 438 HD2 LYS 55 1HD LYS 55 -11.093 1.567 -8.607 439 HD3 LYS 55 2HD LYS 55 -11.079 2.514 -7.117 440 HE2 LYS 55 1HE LYS 55 -10.913 0.682 -5.797 441 HE3 LYS 55 2HE LYS 55 -11.908 -0.309 -6.863 442 HZ1 LYS 55 3HZ LYS 55 -9.088 0.452 -7.399 443 HZ2 LYS 55 1HZ LYS 55 -10.047 -0.572 -8.345 444 HZ3 LYS 55 2HZ LYS 55 -9.587 -1.044 -6.787 445 H ASN 56 H ASN 56 -15.834 2.493 -4.240 446 HA ASN 56 HA ASN 56 -15.113 4.916 -2.874 447 HB2 ASN 56 1HB ASN 56 -17.694 3.368 -2.610 448 HB3 ASN 56 2HB ASN 56 -17.431 5.078 -2.281 449 HD21 ASN 56 2HD2 ASN 56 -19.251 3.614 -4.135 450 HD22 ASN 56 1HD2 ASN 56 -18.971 4.329 -5.683 451 H ALA 57 H ALA 57 -15.703 1.571 -1.992 452 HA ALA 57 HA ALA 57 -15.879 1.896 0.794 453 HB1 ALA 57 1HB ALA 57 -16.438 -0.166 -0.575 454 HB2 ALA 57 2HB ALA 57 -14.710 -0.519 -0.559 455 HB3 ALA 57 3HB ALA 57 -15.607 -0.437 0.957 456 H LEU 58 H LEU 58 -13.236 2.235 -1.326 457 HA LEU 58 HA LEU 58 -11.357 2.115 0.941 458 HB2 LEU 58 1HB LEU 58 -9.595 1.741 -0.797 459 HB3 LEU 58 2HB LEU 58 -10.743 0.420 -0.589 460 HG LEU 58 HG LEU 58 -11.955 1.510 -2.620 461 HD11 LEU 58 1HD1 LEU 58 -9.240 2.773 -2.696 462 HD12 LEU 58 2HD1 LEU 58 -10.820 3.516 -2.938 463 HD13 LEU 58 3HD1 LEU 58 -10.145 2.458 -4.177 464 HD21 LEU 58 3HD2 LEU 58 -11.244 -0.523 -3.241 465 HD22 LEU 58 1HD2 LEU 58 -9.690 -0.337 -2.427 466 HD23 LEU 58 2HD2 LEU 58 -9.932 0.353 -4.032 467 H SER 59 H SER 59 -12.967 4.158 -1.102 468 HA SER 59 HA SER 59 -10.826 6.110 -1.376 469 HB2 SER 59 1HB SER 59 -12.341 5.829 -3.265 470 HB3 SER 59 2HB SER 59 -13.727 6.199 -2.240 471 HG SER 59 HG SER 59 -13.354 8.223 -2.603 472 H GLU 60 H GLU 60 -12.907 5.223 1.013 473 HA GLU 60 HA GLU 60 -13.236 7.961 2.032 474 HB2 GLU 60 1HB GLU 60 -14.831 6.869 3.659 475 HB3 GLU 60 2HB GLU 60 -15.332 6.848 1.974 476 HG2 GLU 60 1HG GLU 60 -14.547 4.533 1.781 477 HG3 GLU 60 2HG GLU 60 -14.091 4.559 3.484 478 H ILE 61 H ILE 61 -12.151 4.720 2.970 479 HA ILE 61 HA ILE 61 -10.989 5.770 5.429 480 HB ILE 61 HB ILE 61 -10.994 2.938 4.377 481 HG12 ILE 61 1HG1 ILE 61 -12.624 3.600 6.730 482 HG13 ILE 61 2HG1 ILE 61 -13.170 4.370 5.244 483 HG21 ILE 61 1HG2 ILE 61 -9.305 2.855 5.898 484 HG22 ILE 61 2HG2 ILE 61 -9.915 4.230 6.817 485 HG23 ILE 61 3HG2 ILE 61 -10.667 2.646 6.998 486 HD11 ILE 61 3HD1 ILE 61 -12.614 1.678 4.626 487 HD12 ILE 61 1HD1 ILE 61 -13.551 1.694 6.120 488 HD13 ILE 61 2HD1 ILE 61 -14.178 2.491 4.676 489 H LEU 62 H LEU 62 -10.064 4.998 2.223 490 HA LEU 62 HA LEU 62 -8.075 5.010 1.120 491 HB2 LEU 62 1HB LEU 62 -7.488 6.722 3.504 492 HB3 LEU 62 2HB LEU 62 -6.219 6.342 2.342 493 HG LEU 62 HG LEU 62 -7.156 8.514 1.863 494 HD11 LEU 62 1HD1 LEU 62 -6.587 6.751 0.032 495 HD12 LEU 62 2HD1 LEU 62 -7.385 8.260 -0.413 496 HD13 LEU 62 3HD1 LEU 62 -8.327 6.776 -0.262 497 HD21 LEU 62 3HD2 LEU 62 -9.808 7.116 1.532 498 HD22 LEU 62 1HD2 LEU 62 -9.481 8.832 1.287 499 HD23 LEU 62 2HD2 LEU 62 -9.361 8.134 2.902 500 H ASN 63 H ASN 63 -8.616 2.715 2.628 501 HA ASN 63 HA ASN 63 -6.544 1.868 4.306 502 HB2 ASN 63 1HB ASN 63 -8.677 0.543 2.725 503 HB3 ASN 63 2HB ASN 63 -7.321 -0.469 3.214 504 HD21 ASN 63 2HD2 ASN 63 -9.791 -1.034 4.144 505 HD22 ASN 63 1HD2 ASN 63 -9.902 -0.659 5.827 506 H LYS 64 H LYS 64 -6.987 1.333 0.813 507 HA LYS 64 HA LYS 64 -4.106 0.739 0.634 508 HB2 LYS 64 1HB LYS 64 -6.094 -0.970 -0.031 509 HB3 LYS 64 2HB LYS 64 -5.879 -0.138 -1.566 510 HG2 LYS 64 1HG LYS 64 -3.400 -1.033 -0.263 511 HG3 LYS 64 2HG LYS 64 -4.484 -2.316 -0.808 512 HD2 LYS 64 1HD LYS 64 -3.855 -2.002 -2.918 513 HD3 LYS 64 2HD LYS 64 -4.298 -0.295 -2.830 514 HE2 LYS 64 1HE LYS 64 -2.098 0.028 -3.191 515 HE3 LYS 64 2HE LYS 64 -1.973 -0.270 -1.458 516 HZ1 LYS 64 3HZ LYS 64 -1.140 -1.931 -3.686 517 HZ2 LYS 64 1HZ LYS 64 -1.865 -2.755 -2.399 518 HZ3 LYS 64 2HZ LYS 64 -0.494 -1.803 -2.128 519 H LYS 65 H LYS 65 -3.005 1.457 -1.281 520 HA LYS 65 HA LYS 65 -3.525 4.118 -1.964 521 HB2 LYS 65 1HB LYS 65 -1.795 2.002 -3.231 522 HB3 LYS 65 2HB LYS 65 -1.876 3.639 -3.868 523 HG2 LYS 65 1HG LYS 65 -1.238 3.174 -0.986 524 HG3 LYS 65 2HG LYS 65 0.011 3.009 -2.222 525 HD2 LYS 65 1HD LYS 65 -1.710 5.457 -2.124 526 HD3 LYS 65 2HD LYS 65 -0.321 5.298 -1.046 527 HE2 LYS 65 1HE LYS 65 0.983 4.715 -3.201 528 HE3 LYS 65 2HE LYS 65 -0.387 5.442 -4.038 529 HZ1 LYS 65 3HZ LYS 65 0.094 7.341 -2.287 530 HZ2 LYS 65 1HZ LYS 65 0.894 7.273 -3.776 531 HZ3 LYS 65 2HZ LYS 65 1.657 6.700 -2.379 532 H LEU 66 H LEU 66 -3.674 4.818 -4.365 533 HA LEU 66 HA LEU 66 -6.103 3.601 -5.432 534 HB2 LEU 66 1HB LEU 66 -4.770 6.242 -5.675 535 HB3 LEU 66 2HB LEU 66 -5.764 5.699 -7.025 536 HG LEU 66 HG LEU 66 -7.666 5.447 -5.422 537 HD11 LEU 66 1HD1 LEU 66 -6.943 7.170 -3.380 538 HD12 LEU 66 2HD1 LEU 66 -5.560 6.088 -3.541 539 HD13 LEU 66 3HD1 LEU 66 -7.169 5.425 -3.255 540 HD21 LEU 66 3HD2 LEU 66 -7.638 7.378 -6.797 541 HD22 LEU 66 1HD2 LEU 66 -6.383 8.141 -5.820 542 HD23 LEU 66 2HD2 LEU 66 -8.006 7.930 -5.162 543 H HIS 67 H HIS 67 -5.907 2.084 -6.931 544 HA HIS 67 HA HIS 67 -3.937 2.449 -9.069 545 HB2 HIS 67 1HB HIS 67 -4.322 -0.078 -7.456 546 HB3 HIS 67 2HB HIS 67 -3.440 -0.012 -8.979 547 HD1 HIS 67 HD1 HIS 67 -2.511 -0.480 -5.795 548 HD2 HIS 67 HD2 HIS 67 -1.580 2.601 -8.423 549 HE1 HIS 67 HE1 HIS 67 -0.371 0.519 -4.930 550 H SER 68 H SER 68 -4.363 0.458 -10.703 551 HA SER 68 HA SER 68 -7.275 0.403 -11.162 552 HB2 SER 68 1HB SER 68 -5.189 0.377 -13.346 553 HB3 SER 68 2HB SER 68 -6.925 0.636 -13.509 554 HG SER 68 HG SER 68 -6.556 2.567 -12.179 555 H ILE 69 H ILE 69 -8.152 -1.552 -11.240 556 HA ILE 69 HA ILE 69 -6.675 -3.804 -12.320 557 HB ILE 69 HB ILE 69 -7.216 -5.231 -10.326 558 HG12 ILE 69 1HG1 ILE 69 -7.660 -2.542 -9.012 559 HG13 ILE 69 2HG1 ILE 69 -8.899 -3.755 -9.311 560 HG21 ILE 69 1HG2 ILE 69 -4.956 -4.399 -10.777 561 HG22 ILE 69 2HG2 ILE 69 -5.308 -2.948 -9.840 562 HG23 ILE 69 3HG2 ILE 69 -5.271 -4.522 -9.046 563 HD11 ILE 69 3HD1 ILE 69 -6.640 -3.818 -7.354 564 HD12 ILE 69 1HD1 ILE 69 -8.368 -4.025 -7.070 565 HD13 ILE 69 2HD1 ILE 69 -7.448 -5.298 -7.871 566 H SER 70 H SER 70 -8.093 -5.821 -12.292 567 HA SER 70 HA SER 70 -10.678 -5.081 -13.340 568 HB2 SER 70 1HB SER 70 -9.385 -6.786 -14.502 569 HB3 SER 70 2HB SER 70 -9.340 -7.782 -13.047 570 HG SER 70 HG SER 70 -11.673 -7.040 -14.488 571 H ILE 71 H ILE 71 -12.587 -5.227 -12.342 572 HA ILE 71 HA ILE 71 -12.693 -6.636 -9.755 573 HB ILE 71 HB ILE 71 -14.142 -4.098 -10.515 574 HG12 ILE 71 1HG1 ILE 71 -12.315 -4.253 -8.179 575 HG13 ILE 71 2HG1 ILE 71 -11.564 -4.260 -9.771 576 HG21 ILE 71 1HG2 ILE 71 -14.763 -6.104 -8.583 577 HG22 ILE 71 2HG2 ILE 71 -14.308 -4.619 -7.749 578 HG23 ILE 71 3HG2 ILE 71 -15.614 -4.600 -8.933 579 HD11 ILE 71 3HD1 ILE 71 -11.999 -2.098 -10.113 580 HD12 ILE 71 1HD1 ILE 71 -13.615 -2.207 -9.416 581 HD13 ILE 71 2HD1 ILE 71 -12.210 -2.038 -8.364 582 H LYS 72 H LYS 72 -13.708 -8.493 -10.280 583 HA LYS 72 HA LYS 72 -15.962 -8.504 -12.099 584 HB2 LYS 72 1HB LYS 72 -14.376 -10.347 -12.196 585 HB3 LYS 72 2HB LYS 72 -14.665 -10.719 -10.501 586 HG2 LYS 72 1HG LYS 72 -17.077 -11.137 -11.146 587 HG3 LYS 72 2HG LYS 72 -16.533 -11.074 -12.825 588 HD2 LYS 72 1HD LYS 72 -15.020 -12.920 -12.443 589 HD3 LYS 72 2HD LYS 72 -15.423 -12.935 -10.724 590 HE2 LYS 72 1HE LYS 72 -17.861 -13.265 -11.592 591 HE3 LYS 72 2HE LYS 72 -17.062 -13.802 -13.069 592 HZ1 LYS 72 3HZ LYS 72 -17.173 -15.768 -11.981 593 HZ2 LYS 72 1HZ LYS 72 -17.156 -15.067 -10.442 594 HZ3 LYS 72 2HZ LYS 72 -15.716 -15.225 -11.314 595 H THR 73 H THR 73 -18.077 -8.726 -11.572 596 HA THR 73 HA THR 73 -18.737 -8.563 -8.713 597 HB THR 73 HB THR 73 -20.809 -7.530 -9.320 598 HG1 THR 73 HG1 THR 73 -21.426 -8.605 -11.156 599 HG21 THR 73 3HG2 THR 73 -20.024 -5.562 -10.640 600 HG22 THR 73 1HG2 THR 73 -18.518 -6.426 -10.946 601 HG23 THR 73 2HG2 THR 73 -18.964 -5.989 -9.297 602 H ILE 74 H ILE 74 -19.851 -10.137 -7.733 603 HA ILE 74 HA ILE 74 -21.250 -12.121 -9.390 604 HB ILE 74 HB ILE 74 -19.444 -12.778 -7.060 605 HG12 ILE 74 1HG1 ILE 74 -18.454 -14.202 -9.107 606 HG13 ILE 74 2HG1 ILE 74 -19.112 -12.844 -10.014 607 HG21 ILE 74 1HG2 ILE 74 -21.128 -14.562 -8.812 608 HG22 ILE 74 2HG2 ILE 74 -19.952 -15.122 -7.624 609 HG23 ILE 74 3HG2 ILE 74 -21.379 -14.229 -7.098 610 HD11 ILE 74 3HD1 ILE 74 -16.644 -12.837 -9.126 611 HD12 ILE 74 1HD1 ILE 74 -17.614 -11.364 -9.147 612 HD13 ILE 74 2HD1 ILE 74 -17.418 -12.269 -7.646 613 H SER 75 H SER 75 -23.216 -12.684 -8.667 614 HA SER 75 HA SER 75 -23.957 -11.904 -5.924 615 HB2 SER 75 1HB SER 75 -26.209 -11.318 -6.785 616 HB3 SER 75 2HB SER 75 -24.943 -10.306 -7.479 617 HG SER 75 HG SER 75 -26.612 -11.301 -8.934 618 H ILE 76 H ILE 76 -25.733 -13.120 -4.999 619 HA ILE 76 HA ILE 76 -26.727 -15.078 -4.398 620 HB ILE 76 HB ILE 76 -26.774 -15.622 -7.369 621 HG12 ILE 76 1HG1 ILE 76 -29.268 -14.816 -6.823 622 HG13 ILE 76 2HG1 ILE 76 -28.417 -13.893 -5.589 623 HG21 ILE 76 1HG2 ILE 76 -27.910 -16.986 -5.013 624 HG22 ILE 76 2HG2 ILE 76 -28.985 -16.797 -6.397 625 HG23 ILE 76 3HG2 ILE 76 -27.443 -17.632 -6.585 626 HD11 ILE 76 3HD1 ILE 76 -27.888 -12.375 -7.098 627 HD12 ILE 76 1HD1 ILE 76 -27.012 -13.590 -8.028 628 HD13 ILE 76 2HD1 ILE 76 -28.726 -13.309 -8.337 629 HA PRO 77 HA PRO 77 -22.686 -17.329 -4.820 630 HB2 PRO 77 1HB PRO 77 -22.299 -17.613 -2.147 631 HB3 PRO 77 2HB PRO 77 -21.777 -16.184 -3.047 632 HG2 PRO 77 1HG PRO 77 -24.225 -16.575 -1.370 633 HG3 PRO 77 2HG PRO 77 -23.132 -15.181 -1.445 634 HD2 PRO 77 1HD PRO 77 -25.518 -15.234 -2.726 635 HD3 PRO 77 2HD PRO 77 -24.111 -14.359 -3.364 Start of MODEL 2 1 H1 MET 1 H MET 1 6.789 -0.328 -2.066 2 HA MET 1 HA MET 1 7.087 -2.693 -3.664 3 HB2 MET 1 1HB MET 1 6.640 -2.324 -0.697 4 HB3 MET 1 2HB MET 1 6.964 -3.872 -1.467 5 HG2 MET 1 1HG MET 1 8.835 -1.539 -1.697 6 HG3 MET 1 2HG MET 1 8.919 -2.698 -0.373 7 HE1 MET 1 3HE MET 1 11.385 -2.711 -1.177 8 HE2 MET 1 1HE MET 1 11.050 -4.370 -0.682 9 HE3 MET 1 2HE MET 1 11.938 -4.057 -2.173 10 H ALA 2 H ALA 2 5.644 -4.568 -3.476 11 HA ALA 2 HA ALA 2 2.848 -3.709 -3.605 12 HB1 ALA 2 1HB ALA 2 2.986 -6.376 -4.392 13 HB2 ALA 2 2HB ALA 2 2.873 -4.962 -5.441 14 HB3 ALA 2 3HB ALA 2 4.452 -5.634 -5.034 15 H ILE 3 H ILE 3 1.182 -4.893 -2.564 16 HA ILE 3 HA ILE 3 2.088 -6.212 -0.100 17 HB ILE 3 HB ILE 3 0.632 -4.201 0.126 18 HG12 ILE 3 1HG1 ILE 3 -0.996 -6.479 1.145 19 HG13 ILE 3 2HG1 ILE 3 0.689 -6.390 1.648 20 HG21 ILE 3 1HG2 ILE 3 -1.721 -5.810 -0.714 21 HG22 ILE 3 2HG2 ILE 3 -1.490 -4.063 -0.708 22 HG23 ILE 3 3HG2 ILE 3 -0.740 -5.046 -1.964 23 HD11 ILE 3 3HD1 ILE 3 -0.591 -5.312 3.311 24 HD12 ILE 3 1HD1 ILE 3 0.226 -4.041 2.401 25 HD13 ILE 3 2HD1 ILE 3 -1.483 -4.372 2.116 26 H SER 4 H SER 4 1.089 -8.130 0.622 27 HA SER 4 HA SER 4 0.721 -10.121 -1.256 28 HB2 SER 4 1HB SER 4 -0.225 -9.913 1.603 29 HB3 SER 4 2HB SER 4 -0.435 -11.376 0.642 30 HG SER 4 HG SER 4 1.843 -10.315 1.777 31 H ALA 5 H ALA 5 -0.978 -10.978 -2.347 32 HA ALA 5 HA ALA 5 -3.184 -9.382 -2.968 33 HB1 ALA 5 1HB ALA 5 -2.735 -10.912 -4.613 34 HB2 ALA 5 2HB ALA 5 -2.460 -12.227 -3.470 35 HB3 ALA 5 3HB ALA 5 -4.104 -11.691 -3.819 36 H GLU 6 H GLU 6 -2.686 -11.658 -0.404 37 HA GLU 6 HA GLU 6 -5.388 -12.223 0.202 38 HB2 GLU 6 1HB GLU 6 -4.588 -13.134 2.254 39 HB3 GLU 6 2HB GLU 6 -3.384 -13.501 1.027 40 HG2 GLU 6 1HG GLU 6 -2.317 -11.253 1.897 41 HG3 GLU 6 2HG GLU 6 -3.230 -11.660 3.349 42 H GLU 7 H GLU 7 -3.367 -9.491 0.803 43 HA GLU 7 HA GLU 7 -4.946 -8.434 2.965 44 HB2 GLU 7 1HB GLU 7 -2.493 -7.975 2.634 45 HB3 GLU 7 2HB GLU 7 -2.930 -6.975 1.255 46 HG2 GLU 7 1HG GLU 7 -4.186 -6.433 3.900 47 HG3 GLU 7 2HG GLU 7 -2.528 -5.912 3.603 48 H LEU 8 H LEU 8 -5.003 -8.307 -0.482 49 HA LEU 8 HA LEU 8 -6.252 -5.907 -1.017 50 HB2 LEU 8 1HB LEU 8 -5.522 -7.333 -2.792 51 HB3 LEU 8 2HB LEU 8 -6.631 -8.608 -2.292 52 HG LEU 8 HG LEU 8 -8.529 -7.262 -3.001 53 HD11 LEU 8 1HD1 LEU 8 -6.664 -5.137 -2.844 54 HD12 LEU 8 2HD1 LEU 8 -8.392 -5.061 -3.190 55 HD13 LEU 8 3HD1 LEU 8 -7.235 -5.234 -4.510 56 HD21 LEU 8 3HD2 LEU 8 -7.545 -6.943 -5.505 57 HD22 LEU 8 1HD2 LEU 8 -8.068 -8.485 -4.829 58 HD23 LEU 8 2HD2 LEU 8 -6.358 -8.052 -4.817 59 H GLU 9 H GLU 9 -7.634 -8.886 0.240 60 HA GLU 9 HA GLU 9 -10.352 -8.046 0.021 61 HB2 GLU 9 1HB GLU 9 -10.901 -10.015 1.246 62 HB3 GLU 9 2HB GLU 9 -9.571 -10.432 0.175 63 HG2 GLU 9 1HG GLU 9 -8.190 -9.738 2.369 64 HG3 GLU 9 2HG GLU 9 -9.677 -10.320 3.115 65 H LYS 10 H LYS 10 -7.864 -7.772 2.465 66 HA LYS 10 HA LYS 10 -9.343 -7.166 4.716 67 HB2 LYS 10 1HB LYS 10 -6.754 -7.334 4.318 68 HB3 LYS 10 2HB LYS 10 -6.870 -5.592 4.104 69 HG2 LYS 10 1HG LYS 10 -6.285 -6.001 6.366 70 HG3 LYS 10 2HG LYS 10 -7.969 -5.472 6.345 71 HD2 LYS 10 1HD LYS 10 -8.753 -7.699 6.663 72 HD3 LYS 10 2HD LYS 10 -7.143 -8.369 6.392 73 HE2 LYS 10 1HE LYS 10 -7.451 -8.427 8.721 74 HE3 LYS 10 2HE LYS 10 -6.415 -7.031 8.428 75 HZ1 LYS 10 3HZ LYS 10 -8.291 -5.581 8.662 76 HZ2 LYS 10 1HZ LYS 10 -8.224 -6.591 10.019 77 HZ3 LYS 10 2HZ LYS 10 -9.357 -6.887 8.798 78 H ILE 11 H ILE 11 -8.740 -5.221 1.891 79 HA ILE 11 HA ILE 11 -9.721 -2.787 3.111 80 HB ILE 11 HB ILE 11 -9.069 -3.384 0.222 81 HG12 ILE 11 1HG1 ILE 11 -7.137 -1.710 0.985 82 HG13 ILE 11 2HG1 ILE 11 -7.472 -2.435 2.553 83 HG21 ILE 11 1HG2 ILE 11 -10.522 -1.561 0.158 84 HG22 ILE 11 2HG2 ILE 11 -9.877 -0.875 1.648 85 HG23 ILE 11 3HG2 ILE 11 -8.921 -0.821 0.167 86 HD11 ILE 11 3HD1 ILE 11 -7.237 -4.440 0.491 87 HD12 ILE 11 1HD1 ILE 11 -5.800 -3.422 0.583 88 HD13 ILE 11 2HD1 ILE 11 -6.368 -4.278 2.017 89 H LEU 12 H LEU 12 -10.934 -5.364 1.088 90 HA LEU 12 HA LEU 12 -13.390 -3.974 0.458 91 HB2 LEU 12 1HB LEU 12 -12.312 -6.711 -0.112 92 HB3 LEU 12 2HB LEU 12 -14.003 -6.319 -0.421 93 HG LEU 12 HG LEU 12 -11.621 -4.959 -1.681 94 HD11 LEU 12 1HD1 LEU 12 -13.109 -6.124 -3.667 95 HD12 LEU 12 2HD1 LEU 12 -13.168 -7.328 -2.380 96 HD13 LEU 12 3HD1 LEU 12 -11.612 -6.766 -2.991 97 HD21 LEU 12 3HD2 LEU 12 -14.587 -4.601 -2.087 98 HD22 LEU 12 1HD2 LEU 12 -13.342 -3.933 -3.143 99 HD23 LEU 12 2HD2 LEU 12 -13.446 -3.410 -1.462 100 H LYS 13 H LYS 13 -12.209 -5.670 3.091 101 HA LYS 13 HA LYS 13 -14.669 -6.928 3.901 102 HB2 LYS 13 1HB LYS 13 -12.003 -6.495 5.231 103 HB3 LYS 13 2HB LYS 13 -13.369 -7.170 6.109 104 HG2 LYS 13 1HG LYS 13 -13.360 -8.743 3.909 105 HG3 LYS 13 2HG LYS 13 -11.638 -8.388 4.076 106 HD2 LYS 13 1HD LYS 13 -12.107 -10.386 5.310 107 HD3 LYS 13 2HD LYS 13 -11.803 -9.089 6.468 108 HE2 LYS 13 1HE LYS 13 -14.138 -8.836 6.902 109 HE3 LYS 13 2HE LYS 13 -14.558 -9.921 5.578 110 HZ1 LYS 13 3HZ LYS 13 -13.543 -11.742 6.777 111 HZ2 LYS 13 1HZ LYS 13 -14.727 -11.009 7.737 112 HZ3 LYS 13 2HZ LYS 13 -13.090 -10.708 8.037 113 H LYS 14 H LYS 14 -13.166 -3.840 4.296 114 HA LYS 14 HA LYS 14 -14.287 -2.905 6.645 115 HB2 LYS 14 1HB LYS 14 -13.587 -1.522 4.066 116 HB3 LYS 14 2HB LYS 14 -14.247 -0.631 5.431 117 HG2 LYS 14 1HG LYS 14 -11.720 -2.269 5.466 118 HG3 LYS 14 2HG LYS 14 -11.811 -0.510 5.353 119 HD2 LYS 14 1HD LYS 14 -13.302 -0.896 7.552 120 HD3 LYS 14 2HD LYS 14 -12.229 -2.292 7.675 121 HE2 LYS 14 1HE LYS 14 -10.387 -1.014 8.042 122 HE3 LYS 14 2HE LYS 14 -10.973 0.311 7.038 123 HZ1 LYS 14 3HZ LYS 14 -12.303 1.118 8.762 124 HZ2 LYS 14 1HZ LYS 14 -10.848 0.709 9.522 125 HZ3 LYS 14 2HZ LYS 14 -12.190 -0.311 9.660 126 H SER 15 H SER 15 -15.672 -2.845 3.373 127 HA SER 15 HA SER 15 -18.267 -2.118 4.553 128 HB2 SER 15 1HB SER 15 -16.909 -1.401 2.054 129 HB3 SER 15 2HB SER 15 -18.591 -1.883 1.830 130 HG SER 15 HG SER 15 -17.790 -0.002 3.787 131 H PHE 16 H PHE 16 -16.582 -4.485 2.621 132 HA PHE 16 HA PHE 16 -19.039 -6.109 2.536 133 HB2 PHE 16 1HB PHE 16 -16.741 -6.529 0.649 134 HB3 PHE 16 2HB PHE 16 -18.428 -6.994 0.458 135 HD1 PHE 16 HD2 PHE 16 -20.083 -4.866 0.539 136 HD2 PHE 16 HD1 PHE 16 -16.002 -4.815 -0.668 137 HE1 PHE 16 HE2 PHE 16 -20.498 -2.823 -0.767 138 HE2 PHE 16 HE1 PHE 16 -16.410 -2.771 -1.975 139 HZ PHE 16 HZ PHE 16 -18.661 -1.773 -2.027 140 HA PRO 17 HA PRO 17 -15.839 -8.214 5.207 141 HB2 PRO 17 1HB PRO 17 -17.511 -8.666 7.297 142 HB3 PRO 17 2HB PRO 17 -16.579 -7.175 7.118 143 HG2 PRO 17 1HG PRO 17 -19.449 -7.708 6.452 144 HG3 PRO 17 2HG PRO 17 -18.729 -6.297 7.250 145 HD2 PRO 17 1HD PRO 17 -19.415 -6.297 4.630 146 HD3 PRO 17 2HD PRO 17 -18.041 -5.364 5.257 147 H SER 18 H SER 18 -19.315 -9.019 5.065 148 HA SER 18 HA SER 18 -18.907 -11.813 5.330 149 HB2 SER 18 1HB SER 18 -21.327 -10.536 4.060 150 HB3 SER 18 2HB SER 18 -21.241 -12.041 4.975 151 HG SER 18 HG SER 18 -21.137 -10.934 6.826 152 H SER 19 H SER 19 -18.897 -9.634 2.633 153 HA SER 19 HA SER 19 -19.414 -11.421 0.540 154 HB2 SER 19 1HB SER 19 -18.628 -9.752 -0.907 155 HB3 SER 19 2HB SER 19 -19.171 -8.838 0.501 156 HG SER 19 HG SER 19 -16.524 -9.519 -0.232 157 H VAL 20 H VAL 20 -18.075 -12.633 -0.798 158 HA VAL 20 HA VAL 20 -15.615 -13.550 0.475 159 HB VAL 20 HB VAL 20 -17.094 -14.668 -1.911 160 HG11 VAL 20 1HG1 VAL 20 -15.653 -16.707 -1.310 161 HG12 VAL 20 2HG1 VAL 20 -14.883 -15.371 -2.170 162 HG13 VAL 20 3HG1 VAL 20 -14.642 -15.559 -0.433 163 HG21 VAL 20 3HG2 VAL 20 -16.987 -15.647 0.941 164 HG22 VAL 20 1HG2 VAL 20 -18.357 -14.831 0.189 165 HG23 VAL 20 2HG2 VAL 20 -17.845 -16.415 -0.395 166 H ILE 21 H ILE 21 -13.858 -12.403 -0.028 167 HA ILE 21 HA ILE 21 -13.561 -11.290 -2.712 168 HB ILE 21 HB ILE 21 -11.811 -10.927 -0.276 169 HG12 ILE 21 1HG1 ILE 21 -12.939 -8.505 -0.754 170 HG13 ILE 21 2HG1 ILE 21 -14.249 -9.569 -1.254 171 HG21 ILE 21 1HG2 ILE 21 -10.337 -9.930 -1.600 172 HG22 ILE 21 2HG2 ILE 21 -11.303 -10.401 -2.997 173 HG23 ILE 21 3HG2 ILE 21 -11.582 -8.845 -2.216 174 HD11 ILE 21 3HD1 ILE 21 -13.156 -9.032 1.424 175 HD12 ILE 21 1HD1 ILE 21 -14.803 -9.409 0.918 176 HD13 ILE 21 2HD1 ILE 21 -13.615 -10.701 1.090 177 H LYS 22 H LYS 22 -12.314 -12.180 -4.219 178 HA LYS 22 HA LYS 22 -10.099 -13.920 -3.437 179 HB2 LYS 22 1HB LYS 22 -12.386 -15.139 -4.020 180 HB3 LYS 22 2HB LYS 22 -11.836 -14.869 -5.668 181 HG2 LYS 22 1HG LYS 22 -9.646 -15.959 -4.918 182 HG3 LYS 22 2HG LYS 22 -10.559 -16.510 -3.511 183 HD2 LYS 22 1HD LYS 22 -11.660 -16.970 -6.249 184 HD3 LYS 22 2HD LYS 22 -10.372 -18.015 -5.646 185 HE2 LYS 22 1HE LYS 22 -12.881 -17.475 -4.080 186 HE3 LYS 22 2HE LYS 22 -12.766 -18.784 -5.254 187 HZ1 LYS 22 3HZ LYS 22 -10.745 -19.519 -3.954 188 HZ2 LYS 22 1HZ LYS 22 -12.242 -19.734 -3.195 189 HZ3 LYS 22 2HZ LYS 22 -11.241 -18.448 -2.742 190 H ILE 23 H ILE 23 -8.372 -13.850 -4.804 191 HA ILE 23 HA ILE 23 -8.598 -11.988 -7.070 192 HB ILE 23 HB ILE 23 -6.103 -12.845 -5.599 193 HG12 ILE 23 1HG1 ILE 23 -6.316 -10.245 -5.015 194 HG13 ILE 23 2HG1 ILE 23 -8.029 -10.609 -5.201 195 HG21 ILE 23 1HG2 ILE 23 -5.574 -12.229 -7.845 196 HG22 ILE 23 2HG2 ILE 23 -6.590 -10.791 -7.747 197 HG23 ILE 23 3HG2 ILE 23 -5.108 -10.890 -6.796 198 HD11 ILE 23 3HD1 ILE 23 -6.213 -12.187 -3.406 199 HD12 ILE 23 1HD1 ILE 23 -7.106 -10.765 -2.869 200 HD13 ILE 23 2HD1 ILE 23 -7.976 -12.186 -3.448 201 H THR 24 H THR 24 -7.735 -12.505 -9.075 202 HA THR 24 HA THR 24 -7.039 -15.345 -9.457 203 HB THR 24 HB THR 24 -8.245 -13.724 -11.667 204 HG1 THR 24 HG1 THR 24 -9.886 -15.240 -9.941 205 HG21 THR 24 3HG2 THR 24 -9.208 -16.042 -12.156 206 HG22 THR 24 1HG2 THR 24 -8.088 -16.637 -10.931 207 HG23 THR 24 2HG2 THR 24 -7.471 -15.832 -12.374 208 H ASP 25 H ASP 25 -5.231 -15.813 -10.581 209 HA ASP 25 HA ASP 25 -3.586 -13.555 -11.458 210 HB2 ASP 25 1HB ASP 25 -1.779 -15.360 -11.563 211 HB3 ASP 25 2HB ASP 25 -2.389 -14.941 -9.965 212 H LEU 26 H LEU 26 -4.522 -13.109 -13.457 213 HA LEU 26 HA LEU 26 -4.293 -15.234 -15.482 214 HB2 LEU 26 1HB LEU 26 -5.881 -12.706 -15.786 215 HB3 LEU 26 2HB LEU 26 -6.002 -14.194 -16.723 216 HG LEU 26 HG LEU 26 -6.752 -14.048 -13.812 217 HD11 LEU 26 1HD1 LEU 26 -8.081 -12.422 -15.115 218 HD12 LEU 26 2HD1 LEU 26 -9.047 -13.752 -14.478 219 HD13 LEU 26 3HD1 LEU 26 -8.590 -13.732 -16.180 220 HD21 LEU 26 3HD2 LEU 26 -6.318 -16.272 -14.726 221 HD22 LEU 26 1HD2 LEU 26 -7.473 -15.969 -16.024 222 HD23 LEU 26 2HD2 LEU 26 -8.029 -16.057 -14.352 223 H VAL 27 H VAL 27 -3.228 -12.093 -14.524 224 HA VAL 27 HA VAL 27 -2.177 -11.314 -17.077 225 HB VAL 27 HB VAL 27 -1.604 -10.238 -14.312 226 HG11 VAL 27 1HG1 VAL 27 -0.652 -9.435 -17.024 227 HG12 VAL 27 2HG1 VAL 27 -0.913 -8.200 -15.792 228 HG13 VAL 27 3HG1 VAL 27 0.230 -9.511 -15.500 229 HG21 VAL 27 3HG2 VAL 27 -3.113 -8.630 -16.253 230 HG22 VAL 27 1HG2 VAL 27 -3.938 -10.084 -15.689 231 HG23 VAL 27 2HG2 VAL 27 -3.383 -8.877 -14.528 232 H GLY 28 H GLY 28 -0.367 -11.718 -14.038 233 HA2 GLY 28 1HA GLY 28 1.317 -13.565 -13.983 234 HA3 GLY 28 2HA GLY 28 1.743 -13.063 -15.613 235 H ASP 29 H ASP 29 1.505 -11.776 -12.304 236 HA ASP 29 HA ASP 29 2.887 -10.417 -11.112 237 HB2 ASP 29 1HB ASP 29 4.609 -12.043 -12.225 238 HB3 ASP 29 2HB ASP 29 5.016 -10.642 -13.212 239 H GLN 30 H GLN 30 1.283 -8.794 -11.853 240 HA GLN 30 HA GLN 30 2.654 -6.510 -12.936 241 HB2 GLN 30 1HB GLN 30 1.568 -8.022 -14.854 242 HB3 GLN 30 2HB GLN 30 0.136 -7.107 -14.400 243 HG2 GLN 30 1HG GLN 30 2.627 -5.580 -14.872 244 HG3 GLN 30 2HG GLN 30 1.830 -6.292 -16.274 245 HE21 GLN 30 2HE2 GLN 30 -0.759 -6.025 -15.841 246 HE22 GLN 30 1HE2 GLN 30 -1.210 -4.369 -15.644 247 H ASP 31 H ASP 31 1.260 -4.551 -12.898 248 HA ASP 31 HA ASP 31 -0.021 -4.264 -10.437 249 HB2 ASP 31 1HB ASP 31 -0.343 -2.556 -12.915 250 HB3 ASP 31 2HB ASP 31 -0.775 -2.078 -11.275 251 H HIS 32 H HIS 32 -1.219 -5.387 -13.474 252 HA HIS 32 HA HIS 32 -3.996 -4.936 -12.892 253 HB2 HIS 32 1HB HIS 32 -2.984 -5.106 -15.212 254 HB3 HIS 32 2HB HIS 32 -2.858 -6.841 -14.940 255 HD1 HIS 32 HD1 HIS 32 -5.820 -4.717 -13.946 256 HD2 HIS 32 HD2 HIS 32 -4.799 -7.655 -16.700 257 HE1 HIS 32 HE1 HIS 32 -7.977 -5.372 -15.060 258 H TYR 33 H TYR 33 -5.459 -6.307 -12.017 259 HA TYR 33 HA TYR 33 -4.787 -9.092 -11.556 260 HB2 TYR 33 1HB TYR 33 -4.917 -7.047 -9.388 261 HB3 TYR 33 2HB TYR 33 -5.576 -8.646 -9.061 262 HD1 TYR 33 HD2 TYR 33 -3.925 -10.619 -9.900 263 HD2 TYR 33 HD1 TYR 33 -2.729 -6.694 -8.772 264 HE1 TYR 33 HE2 TYR 33 -1.664 -11.454 -9.413 265 HE2 TYR 33 HE1 TYR 33 -0.464 -7.519 -8.283 266 HH TYR 33 HH TYR 33 0.297 -10.935 -8.328 267 H ALA 34 H ALA 34 -6.591 -10.385 -11.004 268 HA ALA 34 HA ALA 34 -9.147 -9.154 -11.737 269 HB1 ALA 34 1HB ALA 34 -7.920 -11.736 -12.197 270 HB2 ALA 34 2HB ALA 34 -9.553 -11.888 -11.549 271 HB3 ALA 34 3HB ALA 34 -9.272 -10.965 -13.025 272 H LEU 35 H LEU 35 -10.200 -8.382 -10.012 273 HA LEU 35 HA LEU 35 -10.181 -9.927 -7.519 274 HB2 LEU 35 1HB LEU 35 -9.579 -7.712 -7.084 275 HB3 LEU 35 2HB LEU 35 -10.799 -7.071 -8.182 276 HG LEU 35 HG LEU 35 -12.548 -7.791 -6.568 277 HD11 LEU 35 1HD1 LEU 35 -12.090 -8.736 -4.536 278 HD12 LEU 35 2HD1 LEU 35 -10.448 -8.097 -4.482 279 HD13 LEU 35 3HD1 LEU 35 -10.824 -9.473 -5.518 280 HD21 LEU 35 3HD2 LEU 35 -10.812 -6.085 -4.922 281 HD22 LEU 35 1HD2 LEU 35 -12.442 -5.799 -5.531 282 HD23 LEU 35 2HD2 LEU 35 -11.050 -5.535 -6.582 283 H GLU 36 H GLU 36 -11.807 -11.296 -7.249 284 HA GLU 36 HA GLU 36 -14.435 -10.606 -8.387 285 HB2 GLU 36 1HB GLU 36 -14.857 -13.117 -8.146 286 HB3 GLU 36 2HB GLU 36 -13.748 -12.607 -9.411 287 HG2 GLU 36 1HG GLU 36 -11.884 -13.381 -8.270 288 HG3 GLU 36 2HG GLU 36 -12.722 -13.402 -6.719 289 H ILE 37 H ILE 37 -15.845 -9.916 -6.932 290 HA ILE 37 HA ILE 37 -15.670 -10.968 -4.185 291 HB ILE 37 HB ILE 37 -15.281 -8.558 -4.302 292 HG12 ILE 37 1HG1 ILE 37 -18.033 -9.010 -3.151 293 HG13 ILE 37 2HG1 ILE 37 -16.582 -9.673 -2.407 294 HG21 ILE 37 1HG2 ILE 37 -18.048 -8.395 -5.490 295 HG22 ILE 37 2HG2 ILE 37 -17.028 -7.029 -5.043 296 HG23 ILE 37 3HG2 ILE 37 -16.538 -8.104 -6.353 297 HD11 ILE 37 3HD1 ILE 37 -17.696 -7.211 -1.908 298 HD12 ILE 37 1HD1 ILE 37 -16.067 -7.728 -1.472 299 HD13 ILE 37 2HD1 ILE 37 -16.339 -6.840 -2.972 300 H SER 38 H SER 38 -17.518 -11.670 -3.148 301 HA SER 38 HA SER 38 -19.950 -11.854 -4.802 302 HB2 SER 38 1HB SER 38 -19.023 -14.010 -2.898 303 HB3 SER 38 2HB SER 38 -20.325 -14.104 -4.083 304 HG SER 38 HG SER 38 -17.715 -14.629 -4.405 305 H ASP 39 H ASP 39 -21.227 -10.376 -3.842 306 HA ASP 39 HA ASP 39 -21.798 -10.763 -0.982 307 HB2 ASP 39 1HB ASP 39 -20.426 -8.613 -1.817 308 HB3 ASP 39 2HB ASP 39 -22.062 -8.018 -2.088 309 H ALA 40 H ALA 40 -23.936 -10.128 -0.317 310 HA ALA 40 HA ALA 40 -25.890 -10.541 -2.450 311 HB1 ALA 40 1HB ALA 40 -25.695 -11.363 0.267 312 HB2 ALA 40 2HB ALA 40 -27.159 -10.398 0.075 313 HB3 ALA 40 3HB ALA 40 -26.898 -11.815 -0.941 314 H GLN 41 H GLN 41 -24.465 -7.954 -1.907 315 HA GLN 41 HA GLN 41 -26.789 -6.263 -1.279 316 HB2 GLN 41 1HB GLN 41 -23.828 -5.824 -1.039 317 HB3 GLN 41 2HB GLN 41 -24.931 -4.457 -1.124 318 HG2 GLN 41 1HG GLN 41 -25.780 -4.828 0.943 319 HG3 GLN 41 2HG GLN 41 -25.556 -6.573 0.844 320 HE21 GLN 41 2HE2 GLN 41 -23.612 -7.473 1.453 321 HE22 GLN 41 1HE2 GLN 41 -22.400 -6.588 2.309 322 H PHE 42 H PHE 42 -24.700 -7.275 -3.778 323 HA PHE 42 HA PHE 42 -25.325 -4.971 -5.465 324 HB2 PHE 42 1HB PHE 42 -23.646 -7.363 -6.215 325 HB3 PHE 42 2HB PHE 42 -23.660 -5.773 -6.970 326 HD1 PHE 42 HD2 PHE 42 -23.485 -3.980 -4.678 327 HD2 PHE 42 HD1 PHE 42 -21.502 -7.673 -5.418 328 HE1 PHE 42 HE2 PHE 42 -21.632 -3.272 -3.223 329 HE2 PHE 42 HE1 PHE 42 -19.646 -6.971 -3.962 330 HZ PHE 42 HZ PHE 42 -19.709 -4.768 -2.864 331 H ASN 43 H ASN 43 -27.339 -6.976 -4.627 332 HA ASN 43 HA ASN 43 -27.955 -8.433 -7.060 333 HB2 ASN 43 1HB ASN 43 -29.108 -8.322 -4.298 334 HB3 ASN 43 2HB ASN 43 -30.091 -8.959 -5.614 335 HD21 ASN 43 2HD2 ASN 43 -28.575 -10.068 -3.169 336 HD22 ASN 43 1HD2 ASN 43 -27.780 -11.463 -3.806 337 H GLY 44 H GLY 44 -27.928 -5.967 -7.897 338 HA2 GLY 44 1HA GLY 44 -30.261 -5.420 -9.137 339 HA3 GLY 44 2HA GLY 44 -30.484 -4.647 -7.575 340 H LEU 45 H LEU 45 -27.481 -4.149 -7.536 341 HA LEU 45 HA LEU 45 -27.555 -1.500 -8.476 342 HB2 LEU 45 1HB LEU 45 -25.306 -3.315 -7.661 343 HB3 LEU 45 2HB LEU 45 -25.024 -1.659 -8.192 344 HG LEU 45 HG LEU 45 -26.635 -2.506 -5.785 345 HD11 LEU 45 1HD1 LEU 45 -23.927 -2.435 -6.018 346 HD12 LEU 45 2HD1 LEU 45 -24.818 -2.186 -4.517 347 HD13 LEU 45 3HD1 LEU 45 -24.279 -0.798 -5.462 348 HD21 LEU 45 3HD2 LEU 45 -26.334 0.076 -5.392 349 HD22 LEU 45 1HD2 LEU 45 -27.669 -0.546 -6.363 350 HD23 LEU 45 2HD2 LEU 45 -26.235 0.108 -7.154 351 H SER 46 H SER 46 -25.652 -0.718 -9.970 352 HA SER 46 HA SER 46 -25.933 -2.217 -12.482 353 HB2 SER 46 1HB SER 46 -26.673 -0.137 -13.069 354 HB3 SER 46 2HB SER 46 -25.741 0.667 -11.806 355 HG SER 46 HG SER 46 -25.151 0.483 -14.364 356 H LEU 47 H LEU 47 -24.086 -2.278 -13.939 357 HA LEU 47 HA LEU 47 -21.798 -3.327 -12.806 358 HB2 LEU 47 1HB LEU 47 -22.396 -2.140 -15.482 359 HB3 LEU 47 2HB LEU 47 -20.748 -2.624 -15.087 360 HG LEU 47 HG LEU 47 -21.887 -4.355 -16.357 361 HD11 LEU 47 1HD1 LEU 47 -21.720 -5.427 -13.573 362 HD12 LEU 47 2HD1 LEU 47 -20.276 -4.813 -14.377 363 HD13 LEU 47 3HD1 LEU 47 -21.179 -6.150 -15.089 364 HD21 LEU 47 3HD2 LEU 47 -23.861 -5.420 -15.665 365 HD22 LEU 47 1HD2 LEU 47 -24.178 -3.697 -15.458 366 HD23 LEU 47 2HD2 LEU 47 -23.790 -4.697 -14.058 367 H ILE 48 H ILE 48 -22.610 0.001 -13.457 368 HA ILE 48 HA ILE 48 -19.949 1.009 -13.099 369 HB ILE 48 HB ILE 48 -22.589 2.474 -13.010 370 HG12 ILE 48 1HG1 ILE 48 -22.220 1.402 -15.169 371 HG13 ILE 48 2HG1 ILE 48 -22.017 3.144 -15.321 372 HG21 ILE 48 1HG2 ILE 48 -21.209 4.001 -12.033 373 HG22 ILE 48 2HG2 ILE 48 -19.762 3.352 -12.804 374 HG23 ILE 48 3HG2 ILE 48 -20.874 4.363 -13.726 375 HD11 ILE 48 3HD1 ILE 48 -19.845 1.070 -15.190 376 HD12 ILE 48 1HD1 ILE 48 -20.312 2.046 -16.583 377 HD13 ILE 48 2HD1 ILE 48 -19.566 2.811 -15.179 378 H ASN 49 H ASN 49 -22.893 0.948 -11.106 379 HA ASN 49 HA ASN 49 -21.818 2.270 -8.875 380 HB2 ASN 49 1HB ASN 49 -23.992 0.166 -8.873 381 HB3 ASN 49 2HB ASN 49 -23.717 1.395 -7.642 382 HD21 ASN 49 2HD2 ASN 49 -26.137 0.999 -9.018 383 HD22 ASN 49 1HD2 ASN 49 -26.458 2.414 -9.955 384 H GLN 50 H GLN 50 -21.885 -1.143 -9.770 385 HA GLN 50 HA GLN 50 -20.860 -2.153 -7.341 386 HB2 GLN 50 1HB GLN 50 -20.937 -3.225 -10.151 387 HB3 GLN 50 2HB GLN 50 -20.164 -4.119 -8.848 388 HG2 GLN 50 1HG GLN 50 -22.124 -4.667 -7.870 389 HG3 GLN 50 2HG GLN 50 -22.909 -3.161 -8.342 390 HE21 GLN 50 2HE2 GLN 50 -24.542 -5.056 -8.660 391 HE22 GLN 50 1HE2 GLN 50 -24.644 -5.652 -10.278 392 H HIS 51 H HIS 51 -19.296 -1.162 -10.361 393 HA HIS 51 HA HIS 51 -16.666 -1.860 -9.502 394 HB2 HIS 51 1HB HIS 51 -17.701 -1.380 -11.919 395 HB3 HIS 51 2HB HIS 51 -17.055 0.225 -11.591 396 HD1 HIS 51 HD1 HIS 51 -16.106 -2.977 -12.930 397 HD2 HIS 51 HD2 HIS 51 -14.161 0.089 -10.912 398 HE1 HIS 51 HE1 HIS 51 -13.655 -3.337 -13.363 399 H LYS 52 H LYS 52 -18.703 0.917 -9.128 400 HA LYS 52 HA LYS 52 -16.567 2.716 -8.415 401 HB2 LYS 52 1HB LYS 52 -18.911 3.269 -9.424 402 HB3 LYS 52 2HB LYS 52 -19.453 3.196 -7.753 403 HG2 LYS 52 1HG LYS 52 -17.839 4.933 -7.155 404 HG3 LYS 52 2HG LYS 52 -17.305 5.009 -8.836 405 HD2 LYS 52 1HD LYS 52 -20.203 5.355 -8.240 406 HD3 LYS 52 2HD LYS 52 -19.103 6.691 -7.893 407 HE2 LYS 52 1HE LYS 52 -18.258 6.115 -10.346 408 HE3 LYS 52 2HE LYS 52 -19.906 5.507 -10.494 409 HZ1 LYS 52 3HZ LYS 52 -20.795 7.585 -10.228 410 HZ2 LYS 52 1HZ LYS 52 -19.364 7.974 -11.042 411 HZ3 LYS 52 2HZ LYS 52 -19.467 8.183 -9.367 412 H LEU 53 H LEU 53 -19.103 0.933 -6.690 413 HA LEU 53 HA LEU 53 -18.706 1.874 -4.129 414 HB2 LEU 53 1HB LEU 53 -19.546 -0.785 -5.210 415 HB3 LEU 53 2HB LEU 53 -19.343 -0.559 -3.474 416 HG LEU 53 HG LEU 53 -21.239 1.000 -5.230 417 HD11 LEU 53 1HD1 LEU 53 -22.976 -0.249 -3.957 418 HD12 LEU 53 2HD1 LEU 53 -21.696 -1.273 -3.306 419 HD13 LEU 53 3HD1 LEU 53 -22.013 -1.255 -5.041 420 HD21 LEU 53 3HD2 LEU 53 -20.696 1.036 -2.269 421 HD22 LEU 53 1HD2 LEU 53 -22.155 1.708 -2.997 422 HD23 LEU 53 2HD2 LEU 53 -20.575 2.375 -3.411 423 H VAL 54 H VAL 54 -17.137 -0.969 -5.605 424 HA VAL 54 HA VAL 54 -15.469 -1.666 -3.516 425 HB VAL 54 HB VAL 54 -13.946 -2.627 -5.240 426 HG11 VAL 54 1HG1 VAL 54 -15.308 -4.384 -5.271 427 HG12 VAL 54 2HG1 VAL 54 -16.564 -3.347 -4.590 428 HG13 VAL 54 3HG1 VAL 54 -16.443 -3.556 -6.337 429 HG21 VAL 54 3HG2 VAL 54 -14.105 -0.995 -6.981 430 HG22 VAL 54 1HG2 VAL 54 -14.733 -2.518 -7.611 431 HG23 VAL 54 2HG2 VAL 54 -15.845 -1.239 -7.125 432 H LYS 55 H LYS 55 -15.109 0.895 -5.880 433 HA LYS 55 HA LYS 55 -12.395 1.502 -5.129 434 HB2 LYS 55 1HB LYS 55 -14.385 3.037 -6.811 435 HB3 LYS 55 2HB LYS 55 -12.693 3.473 -6.611 436 HG2 LYS 55 1HG LYS 55 -13.481 0.780 -7.656 437 HG3 LYS 55 2HG LYS 55 -13.387 2.187 -8.717 438 HD2 LYS 55 1HD LYS 55 -11.245 1.484 -8.949 439 HD3 LYS 55 2HD LYS 55 -11.026 2.422 -7.470 440 HE2 LYS 55 1HE LYS 55 -10.735 0.580 -6.188 441 HE3 LYS 55 2HE LYS 55 -11.885 -0.380 -7.118 442 HZ1 LYS 55 3HZ LYS 55 -10.062 -0.294 -8.919 443 HZ2 LYS 55 1HZ LYS 55 -9.878 -1.361 -7.619 444 HZ3 LYS 55 2HZ LYS 55 -9.027 0.101 -7.640 445 H ASN 56 H ASN 56 -15.587 2.523 -4.201 446 HA ASN 56 HA ASN 56 -14.730 4.913 -2.859 447 HB2 ASN 56 1HB ASN 56 -17.332 3.420 -2.487 448 HB3 ASN 56 2HB ASN 56 -17.011 5.112 -2.119 449 HD21 ASN 56 2HD2 ASN 56 -18.972 3.785 -3.909 450 HD22 ASN 56 1HD2 ASN 56 -18.746 4.529 -5.452 451 H ALA 57 H ALA 57 -15.504 1.602 -1.918 452 HA ALA 57 HA ALA 57 -15.444 1.932 0.861 453 HB1 ALA 57 1HB ALA 57 -14.397 -0.597 -0.275 454 HB2 ALA 57 2HB ALA 57 -15.600 -0.332 0.987 455 HB3 ALA 57 3HB ALA 57 -16.041 -0.128 -0.708 456 H LEU 58 H LEU 58 -12.915 2.001 -1.450 457 HA LEU 58 HA LEU 58 -10.892 1.697 0.664 458 HB2 LEU 58 1HB LEU 58 -9.287 1.355 -1.176 459 HB3 LEU 58 2HB LEU 58 -10.566 0.144 -1.132 460 HG LEU 58 HG LEU 58 -11.683 1.681 -2.929 461 HD11 LEU 58 1HD1 LEU 58 -10.429 3.521 -3.269 462 HD12 LEU 58 2HD1 LEU 58 -9.529 2.450 -4.343 463 HD13 LEU 58 3HD1 LEU 58 -8.947 2.750 -2.706 464 HD21 LEU 58 3HD2 LEU 58 -10.205 -0.647 -2.991 465 HD22 LEU 58 1HD2 LEU 58 -9.442 0.359 -4.222 466 HD23 LEU 58 2HD2 LEU 58 -11.168 0.011 -4.314 467 H SER 59 H SER 59 -12.303 3.886 -1.594 468 HA SER 59 HA SER 59 -10.143 5.801 -1.484 469 HB2 SER 59 1HB SER 59 -11.401 5.735 -3.525 470 HB3 SER 59 2HB SER 59 -12.926 5.917 -2.659 471 HG SER 59 HG SER 59 -12.644 7.994 -2.665 472 H GLU 60 H GLU 60 -13.084 5.149 0.230 473 HA GLU 60 HA GLU 60 -13.106 7.760 1.513 474 HB2 GLU 60 1HB GLU 60 -15.179 7.128 2.476 475 HB3 GLU 60 2HB GLU 60 -15.208 6.533 0.822 476 HG2 GLU 60 1HG GLU 60 -14.370 4.320 1.841 477 HG3 GLU 60 2HG GLU 60 -14.925 4.998 3.370 478 H ILE 61 H ILE 61 -12.237 4.443 2.203 479 HA ILE 61 HA ILE 61 -11.745 5.018 5.012 480 HB ILE 61 HB ILE 61 -11.119 2.464 3.536 481 HG12 ILE 61 1HG1 ILE 61 -13.489 2.991 3.239 482 HG13 ILE 61 2HG1 ILE 61 -13.295 1.636 4.346 483 HG21 ILE 61 1HG2 ILE 61 -10.340 1.762 5.490 484 HG22 ILE 61 2HG2 ILE 61 -10.648 3.354 6.180 485 HG23 ILE 61 3HG2 ILE 61 -11.893 2.107 6.249 486 HD11 ILE 61 3HD1 ILE 61 -13.848 4.489 5.123 487 HD12 ILE 61 1HD1 ILE 61 -15.010 3.163 5.119 488 HD13 ILE 61 2HD1 ILE 61 -13.646 3.138 6.238 489 H LEU 62 H LEU 62 -10.059 5.122 2.066 490 HA LEU 62 HA LEU 62 -7.886 5.489 1.507 491 HB2 LEU 62 1HB LEU 62 -8.005 6.504 4.319 492 HB3 LEU 62 2HB LEU 62 -6.474 6.480 3.446 493 HG LEU 62 HG LEU 62 -7.466 8.680 3.328 494 HD11 LEU 62 1HD1 LEU 62 -7.402 9.012 0.959 495 HD12 LEU 62 2HD1 LEU 62 -7.769 7.313 0.660 496 HD13 LEU 62 3HD1 LEU 62 -6.223 7.768 1.375 497 HD21 LEU 62 3HD2 LEU 62 -9.826 7.364 1.988 498 HD22 LEU 62 1HD2 LEU 62 -9.609 9.087 2.296 499 HD23 LEU 62 2HD2 LEU 62 -9.811 7.969 3.645 500 H ASN 63 H ASN 63 -8.650 2.857 2.448 501 HA ASN 63 HA ASN 63 -6.544 1.819 4.085 502 HB2 ASN 63 1HB ASN 63 -8.897 0.728 2.653 503 HB3 ASN 63 2HB ASN 63 -7.561 -0.391 2.907 504 HD21 ASN 63 2HD2 ASN 63 -9.769 -1.099 4.091 505 HD22 ASN 63 1HD2 ASN 63 -9.740 -0.781 5.790 506 H LYS 64 H LYS 64 -6.999 2.367 0.700 507 HA LYS 64 HA LYS 64 -4.288 1.929 0.082 508 HB2 LYS 64 1HB LYS 64 -5.411 -0.463 0.351 509 HB3 LYS 64 2HB LYS 64 -5.939 -0.139 -1.295 510 HG2 LYS 64 1HG LYS 64 -3.986 -1.141 -1.796 511 HG3 LYS 64 2HG LYS 64 -3.351 0.486 -1.544 512 HD2 LYS 64 1HD LYS 64 -3.578 -1.276 0.832 513 HD3 LYS 64 2HD LYS 64 -2.317 -1.656 -0.343 514 HE2 LYS 64 1HE LYS 64 -2.719 1.040 0.950 515 HE3 LYS 64 2HE LYS 64 -1.545 -0.165 1.478 516 HZ1 LYS 64 3HZ LYS 64 -0.135 0.542 -0.055 517 HZ2 LYS 64 1HZ LYS 64 -1.215 1.775 -0.475 518 HZ3 LYS 64 2HZ LYS 64 -1.263 0.295 -1.291 519 H LYS 65 H LYS 65 -3.782 2.421 -2.109 520 HA LYS 65 HA LYS 65 -6.035 3.504 -3.667 521 HB2 LYS 65 1HB LYS 65 -3.440 4.783 -2.912 522 HB3 LYS 65 2HB LYS 65 -4.168 5.189 -4.461 523 HG2 LYS 65 1HG LYS 65 -5.713 5.373 -1.898 524 HG3 LYS 65 2HG LYS 65 -4.690 6.693 -2.471 525 HD2 LYS 65 1HD LYS 65 -6.706 5.473 -4.310 526 HD3 LYS 65 2HD LYS 65 -7.228 6.635 -3.089 527 HE2 LYS 65 1HE LYS 65 -6.791 8.070 -4.806 528 HE3 LYS 65 2HE LYS 65 -5.194 8.019 -4.062 529 HZ1 LYS 65 3HZ LYS 65 -4.324 6.930 -5.805 530 HZ2 LYS 65 1HZ LYS 65 -5.643 7.569 -6.650 531 HZ3 LYS 65 2HZ LYS 65 -5.702 5.984 -6.063 532 H LEU 66 H LEU 66 -5.933 1.425 -4.764 533 HA LEU 66 HA LEU 66 -3.621 0.616 -6.204 534 HB2 LEU 66 1HB LEU 66 -6.506 -0.152 -6.220 535 HB3 LEU 66 2HB LEU 66 -5.451 -0.715 -7.515 536 HG LEU 66 HG LEU 66 -5.712 -2.405 -5.778 537 HD11 LEU 66 1HD1 LEU 66 -2.925 -1.297 -5.595 538 HD12 LEU 66 2HD1 LEU 66 -3.549 -2.063 -7.055 539 HD13 LEU 66 3HD1 LEU 66 -3.442 -2.983 -5.555 540 HD21 LEU 66 3HD2 LEU 66 -4.239 -0.633 -3.864 541 HD22 LEU 66 1HD2 LEU 66 -5.172 -2.095 -3.540 542 HD23 LEU 66 2HD2 LEU 66 -6.000 -0.595 -3.961 543 H HIS 67 H HIS 67 -3.163 0.767 -8.405 544 HA HIS 67 HA HIS 67 -3.822 3.212 -9.646 545 HB2 HIS 67 1HB HIS 67 -1.729 1.851 -10.023 546 HB3 HIS 67 2HB HIS 67 -2.697 0.766 -11.017 547 HD1 HIS 67 HD1 HIS 67 -1.166 1.418 -13.048 548 HD2 HIS 67 HD2 HIS 67 -3.413 4.538 -11.472 549 HE1 HIS 67 HE1 HIS 67 -1.078 3.247 -14.771 550 H SER 68 H SER 68 -4.587 -0.096 -10.750 551 HA SER 68 HA SER 68 -7.305 0.361 -11.219 552 HB2 SER 68 1HB SER 68 -7.231 0.431 -13.751 553 HB3 SER 68 2HB SER 68 -6.721 1.913 -12.942 554 HG SER 68 HG SER 68 -5.334 1.130 -14.696 555 H ILE 69 H ILE 69 -8.114 -1.615 -11.088 556 HA ILE 69 HA ILE 69 -6.771 -3.805 -12.509 557 HB ILE 69 HB ILE 69 -7.253 -5.320 -10.592 558 HG12 ILE 69 1HG1 ILE 69 -7.582 -2.825 -8.936 559 HG13 ILE 69 2HG1 ILE 69 -8.968 -3.676 -9.610 560 HG21 ILE 69 1HG2 ILE 69 -5.300 -4.756 -9.365 561 HG22 ILE 69 2HG2 ILE 69 -5.027 -4.237 -11.028 562 HG23 ILE 69 3HG2 ILE 69 -5.446 -3.051 -9.792 563 HD11 ILE 69 3HD1 ILE 69 -8.202 -5.720 -8.421 564 HD12 ILE 69 1HD1 ILE 69 -6.960 -4.739 -7.643 565 HD13 ILE 69 2HD1 ILE 69 -8.666 -4.390 -7.360 566 H SER 70 H SER 70 -8.199 -5.774 -12.639 567 HA SER 70 HA SER 70 -10.799 -4.954 -13.567 568 HB2 SER 70 1HB SER 70 -9.546 -6.594 -14.858 569 HB3 SER 70 2HB SER 70 -9.483 -7.679 -13.469 570 HG SER 70 HG SER 70 -11.213 -7.915 -15.218 571 H ILE 71 H ILE 71 -12.589 -4.923 -12.394 572 HA ILE 71 HA ILE 71 -12.694 -6.557 -9.944 573 HB ILE 71 HB ILE 71 -14.128 -3.967 -10.540 574 HG12 ILE 71 1HG1 ILE 71 -12.204 -4.322 -8.288 575 HG13 ILE 71 2HG1 ILE 71 -11.551 -4.134 -9.912 576 HG21 ILE 71 1HG2 ILE 71 -15.604 -4.655 -9.022 577 HG22 ILE 71 2HG2 ILE 71 -14.624 -6.059 -8.602 578 HG23 ILE 71 3HG2 ILE 71 -14.314 -4.504 -7.828 579 HD11 ILE 71 3HD1 ILE 71 -11.966 -1.952 -9.929 580 HD12 ILE 71 1HD1 ILE 71 -13.595 -2.168 -9.290 581 HD13 ILE 71 2HD1 ILE 71 -12.217 -2.108 -8.190 582 H LYS 72 H LYS 72 -13.881 -8.317 -10.275 583 HA LYS 72 HA LYS 72 -16.115 -8.259 -12.144 584 HB2 LYS 72 1HB LYS 72 -14.491 -10.139 -12.180 585 HB3 LYS 72 2HB LYS 72 -14.994 -10.573 -10.551 586 HG2 LYS 72 1HG LYS 72 -17.330 -10.832 -11.485 587 HG3 LYS 72 2HG LYS 72 -16.598 -10.711 -13.086 588 HD2 LYS 72 1HD LYS 72 -15.241 -12.656 -12.666 589 HD3 LYS 72 2HD LYS 72 -15.797 -12.730 -10.992 590 HE2 LYS 72 1HE LYS 72 -17.882 -13.513 -11.580 591 HE3 LYS 72 2HE LYS 72 -17.801 -12.822 -13.200 592 HZ1 LYS 72 3HZ LYS 72 -17.091 -15.423 -12.340 593 HZ2 LYS 72 1HZ LYS 72 -15.754 -14.669 -13.051 594 HZ3 LYS 72 2HZ LYS 72 -17.201 -14.815 -13.914 595 H THR 73 H THR 73 -18.238 -8.547 -11.598 596 HA THR 73 HA THR 73 -18.861 -8.303 -8.735 597 HB THR 73 HB THR 73 -20.922 -7.269 -9.324 598 HG1 THR 73 HG1 THR 73 -21.829 -7.455 -11.271 599 HG21 THR 73 3HG2 THR 73 -20.200 -5.358 -10.712 600 HG22 THR 73 1HG2 THR 73 -18.747 -6.251 -11.157 601 HG23 THR 73 2HG2 THR 73 -19.011 -5.777 -9.479 602 H ILE 74 H ILE 74 -19.798 -9.941 -7.707 603 HA ILE 74 HA ILE 74 -21.288 -11.933 -9.278 604 HB ILE 74 HB ILE 74 -19.384 -12.558 -7.018 605 HG12 ILE 74 1HG1 ILE 74 -18.434 -13.962 -9.094 606 HG13 ILE 74 2HG1 ILE 74 -19.149 -12.621 -9.983 607 HG21 ILE 74 1HG2 ILE 74 -21.401 -14.167 -8.503 608 HG22 ILE 74 2HG2 ILE 74 -19.904 -14.944 -7.990 609 HG23 ILE 74 3HG2 ILE 74 -20.966 -14.200 -6.795 610 HD11 ILE 74 3HD1 ILE 74 -17.824 -11.178 -8.245 611 HD12 ILE 74 1HD1 ILE 74 -16.850 -12.641 -8.102 612 HD13 ILE 74 2HD1 ILE 74 -17.027 -11.848 -9.668 613 H SER 75 H SER 75 -23.243 -12.411 -8.500 614 HA SER 75 HA SER 75 -23.823 -11.904 -5.671 615 HB2 SER 75 1HB SER 75 -25.676 -10.550 -6.077 616 HB3 SER 75 2HB SER 75 -24.536 -9.989 -7.300 617 HG SER 75 HG SER 75 -26.278 -10.354 -8.492 618 H ILE 76 H ILE 76 -25.407 -13.210 -4.774 619 HA ILE 76 HA ILE 76 -26.789 -15.123 -6.484 620 HB ILE 76 HB ILE 76 -26.099 -16.986 -4.874 621 HG12 ILE 76 1HG1 ILE 76 -23.663 -15.276 -4.431 622 HG13 ILE 76 2HG1 ILE 76 -25.016 -15.240 -3.306 623 HG21 ILE 76 1HG2 ILE 76 -24.571 -17.701 -6.395 624 HG22 ILE 76 2HG2 ILE 76 -25.225 -16.338 -7.301 625 HG23 ILE 76 3HG2 ILE 76 -23.709 -16.163 -6.417 626 HD11 ILE 76 3HD1 ILE 76 -23.200 -16.750 -2.611 627 HD12 ILE 76 1HD1 ILE 76 -24.741 -17.577 -2.829 628 HD13 ILE 76 2HD1 ILE 76 -23.484 -17.716 -4.059 629 HA PRO 77 HA PRO 77 -30.050 -14.661 -3.582 630 HB2 PRO 77 1HB PRO 77 -31.231 -17.102 -3.705 631 HB3 PRO 77 2HB PRO 77 -31.344 -15.914 -5.009 632 HG2 PRO 77 1HG PRO 77 -29.543 -18.292 -4.764 633 HG3 PRO 77 2HG PRO 77 -30.444 -17.713 -6.176 634 HD2 PRO 77 1HD PRO 77 -27.800 -17.237 -5.840 635 HD3 PRO 77 2HD PRO 77 -28.878 -16.096 -6.670 Start of MODEL 3 1 H1 MET 1 H MET 1 5.881 -4.320 -5.608 2 HA MET 1 HA MET 1 7.465 -6.548 -4.627 3 HB2 MET 1 1HB MET 1 6.777 -5.992 -2.242 4 HB3 MET 1 2HB MET 1 8.052 -5.002 -2.940 5 HG2 MET 1 1HG MET 1 6.644 -3.160 -3.198 6 HG3 MET 1 2HG MET 1 5.188 -4.135 -3.011 7 HE1 MET 1 3HE MET 1 4.661 -2.031 -1.830 8 HE2 MET 1 1HE MET 1 4.506 -2.143 -0.076 9 HE3 MET 1 2HE MET 1 5.858 -1.261 -0.787 10 H ALA 2 H ALA 2 6.098 -7.998 -3.205 11 HA ALA 2 HA ALA 2 3.315 -7.970 -4.178 12 HB1 ALA 2 1HB ALA 2 4.590 -9.810 -5.123 13 HB2 ALA 2 2HB ALA 2 5.044 -10.348 -3.506 14 HB3 ALA 2 3HB ALA 2 3.358 -10.417 -4.016 15 H ILE 3 H ILE 3 1.677 -8.745 -2.757 16 HA ILE 3 HA ILE 3 2.417 -8.947 0.073 17 HB ILE 3 HB ILE 3 1.734 -6.595 -0.412 18 HG12 ILE 3 1HG1 ILE 3 -0.463 -7.576 1.296 19 HG13 ILE 3 2HG1 ILE 3 1.137 -8.167 1.732 20 HG21 ILE 3 1HG2 ILE 3 -0.050 -7.529 -2.108 21 HG22 ILE 3 2HG2 ILE 3 -1.089 -7.493 -0.684 22 HG23 ILE 3 3HG2 ILE 3 -0.315 -6.013 -1.248 23 HD11 ILE 3 3HD1 ILE 3 1.940 -5.870 1.891 24 HD12 ILE 3 1HD1 ILE 3 0.335 -5.280 1.459 25 HD13 ILE 3 2HD1 ILE 3 0.575 -6.161 2.969 26 H SER 4 H SER 4 0.923 -10.071 1.377 27 HA SER 4 HA SER 4 -0.325 -12.262 0.185 28 HB2 SER 4 1HB SER 4 -0.628 -11.020 2.919 29 HB3 SER 4 2HB SER 4 -1.478 -12.494 2.455 30 HG SER 4 HG SER 4 1.194 -12.091 3.023 31 H ALA 5 H ALA 5 -2.334 -12.665 -0.557 32 HA ALA 5 HA ALA 5 -3.994 -10.628 -1.439 33 HB1 ALA 5 1HB ALA 5 -4.316 -13.563 -1.085 34 HB2 ALA 5 2HB ALA 5 -5.753 -12.597 -1.423 35 HB3 ALA 5 3HB ALA 5 -4.396 -12.583 -2.550 36 H GLU 6 H GLU 6 -3.873 -12.216 1.654 37 HA GLU 6 HA GLU 6 -6.432 -11.583 2.612 38 HB2 GLU 6 1HB GLU 6 -5.597 -12.074 4.786 39 HB3 GLU 6 2HB GLU 6 -4.768 -13.153 3.672 40 HG2 GLU 6 1HG GLU 6 -2.885 -11.447 3.669 41 HG3 GLU 6 2HG GLU 6 -3.693 -10.721 5.057 42 H GLU 7 H GLU 7 -3.701 -9.607 2.011 43 HA GLU 7 HA GLU 7 -4.420 -7.512 3.853 44 HB2 GLU 7 1HB GLU 7 -2.075 -7.905 3.183 45 HB3 GLU 7 2HB GLU 7 -2.486 -7.472 1.530 46 HG2 GLU 7 1HG GLU 7 -1.631 -5.496 2.253 47 HG3 GLU 7 2HG GLU 7 -3.328 -5.258 2.666 48 H LEU 8 H LEU 8 -5.002 -8.288 0.498 49 HA LEU 8 HA LEU 8 -5.979 -5.708 -0.243 50 HB2 LEU 8 1HB LEU 8 -5.121 -7.148 -1.945 51 HB3 LEU 8 2HB LEU 8 -6.248 -8.429 -1.502 52 HG LEU 8 HG LEU 8 -8.111 -7.066 -2.331 53 HD11 LEU 8 1HD1 LEU 8 -7.930 -4.892 -2.723 54 HD12 LEU 8 2HD1 LEU 8 -6.593 -5.154 -3.842 55 HD13 LEU 8 3HD1 LEU 8 -6.275 -4.965 -2.118 56 HD21 LEU 8 3HD2 LEU 8 -7.561 -8.423 -4.048 57 HD22 LEU 8 1HD2 LEU 8 -5.861 -7.954 -4.017 58 HD23 LEU 8 2HD2 LEU 8 -7.048 -6.910 -4.798 59 H GLU 9 H GLU 9 -7.439 -8.691 0.926 60 HA GLU 9 HA GLU 9 -10.134 -7.904 0.501 61 HB2 GLU 9 1HB GLU 9 -10.679 -9.767 2.046 62 HB3 GLU 9 2HB GLU 9 -9.590 -10.242 0.751 63 HG2 GLU 9 1HG GLU 9 -7.693 -10.063 2.291 64 HG3 GLU 9 2HG GLU 9 -8.802 -9.621 3.589 65 H LYS 10 H LYS 10 -7.847 -7.455 3.111 66 HA LYS 10 HA LYS 10 -9.476 -6.789 5.224 67 HB2 LYS 10 1HB LYS 10 -6.762 -5.892 4.358 68 HB3 LYS 10 2HB LYS 10 -7.537 -5.050 5.694 69 HG2 LYS 10 1HG LYS 10 -7.072 -8.023 5.585 70 HG3 LYS 10 2HG LYS 10 -6.027 -6.867 6.413 71 HD2 LYS 10 1HD LYS 10 -8.249 -6.153 7.593 72 HD3 LYS 10 2HD LYS 10 -8.797 -7.755 7.096 73 HE2 LYS 10 1HE LYS 10 -6.947 -8.786 8.268 74 HE3 LYS 10 2HE LYS 10 -6.296 -7.203 8.689 75 HZ1 LYS 10 3HZ LYS 10 -8.994 -8.085 9.532 76 HZ2 LYS 10 1HZ LYS 10 -8.088 -6.785 10.127 77 HZ3 LYS 10 2HZ LYS 10 -7.612 -8.372 10.465 78 H ILE 11 H ILE 11 -8.751 -4.925 2.360 79 HA ILE 11 HA ILE 11 -9.759 -2.440 3.314 80 HB ILE 11 HB ILE 11 -9.435 -3.415 0.473 81 HG12 ILE 11 1HG1 ILE 11 -7.496 -1.518 0.979 82 HG13 ILE 11 2HG1 ILE 11 -7.569 -2.409 2.495 83 HG21 ILE 11 1HG2 ILE 11 -9.226 -0.748 0.298 84 HG22 ILE 11 2HG2 ILE 11 -10.746 -1.614 0.087 85 HG23 ILE 11 3HG2 ILE 11 -10.366 -0.867 1.638 86 HD11 ILE 11 3HD1 ILE 11 -5.885 -3.305 0.972 87 HD12 ILE 11 1HD1 ILE 11 -7.148 -4.484 1.322 88 HD13 ILE 11 2HD1 ILE 11 -7.142 -3.630 -0.221 89 H LEU 12 H LEU 12 -11.114 -4.498 0.736 90 HA LEU 12 HA LEU 12 -13.634 -3.371 0.671 91 HB2 LEU 12 1HB LEU 12 -12.759 -6.195 0.108 92 HB3 LEU 12 2HB LEU 12 -14.381 -5.597 -0.235 93 HG LEU 12 HG LEU 12 -11.809 -4.646 -1.494 94 HD11 LEU 12 1HD1 LEU 12 -13.180 -5.473 -3.553 95 HD12 LEU 12 2HD1 LEU 12 -14.022 -6.453 -2.353 96 HD13 LEU 12 3HD1 LEU 12 -12.280 -6.625 -2.566 97 HD21 LEU 12 3HD2 LEU 12 -14.381 -3.365 -1.221 98 HD22 LEU 12 1HD2 LEU 12 -13.993 -3.665 -2.916 99 HD23 LEU 12 2HD2 LEU 12 -12.879 -2.742 -1.907 100 H LYS 13 H LYS 13 -12.333 -5.758 2.870 101 HA LYS 13 HA LYS 13 -14.643 -6.800 3.983 102 HB2 LYS 13 1HB LYS 13 -11.876 -6.329 4.988 103 HB3 LYS 13 2HB LYS 13 -13.114 -6.770 6.157 104 HG2 LYS 13 1HG LYS 13 -13.517 -8.607 4.174 105 HG3 LYS 13 2HG LYS 13 -11.765 -8.396 4.145 106 HD2 LYS 13 1HD LYS 13 -12.241 -10.159 5.675 107 HD3 LYS 13 2HD LYS 13 -11.779 -8.749 6.631 108 HE2 LYS 13 1HE LYS 13 -14.271 -8.261 6.813 109 HE3 LYS 13 2HE LYS 13 -14.526 -9.889 6.186 110 HZ1 LYS 13 3HZ LYS 13 -14.078 -9.164 8.811 111 HZ2 LYS 13 1HZ LYS 13 -12.653 -9.926 8.310 112 HZ3 LYS 13 2HZ LYS 13 -14.134 -10.733 8.181 113 H LYS 14 H LYS 14 -13.238 -3.647 4.354 114 HA LYS 14 HA LYS 14 -14.325 -2.779 6.741 115 HB2 LYS 14 1HB LYS 14 -13.758 -1.345 4.158 116 HB3 LYS 14 2HB LYS 14 -14.411 -0.493 5.551 117 HG2 LYS 14 1HG LYS 14 -11.823 -2.033 5.498 118 HG3 LYS 14 2HG LYS 14 -11.983 -0.278 5.400 119 HD2 LYS 14 1HD LYS 14 -13.343 -0.618 7.633 120 HD3 LYS 14 2HD LYS 14 -12.393 -2.103 7.720 121 HE2 LYS 14 1HE LYS 14 -10.883 0.336 7.054 122 HE3 LYS 14 2HE LYS 14 -11.572 0.291 8.676 123 HZ1 LYS 14 3HZ LYS 14 -9.251 -0.930 7.814 124 HZ2 LYS 14 1HZ LYS 14 -10.357 -2.188 8.049 125 HZ3 LYS 14 2HZ LYS 14 -10.008 -1.121 9.314 126 H SER 15 H SER 15 -15.847 -3.027 3.569 127 HA SER 15 HA SER 15 -18.405 -2.214 4.780 128 HB2 SER 15 1HB SER 15 -17.847 -0.780 2.934 129 HB3 SER 15 2HB SER 15 -17.472 -2.161 1.904 130 HG SER 15 HG SER 15 -19.874 -0.997 2.441 131 H PHE 16 H PHE 16 -16.975 -4.536 2.500 132 HA PHE 16 HA PHE 16 -19.244 -6.336 3.036 133 HB2 PHE 16 1HB PHE 16 -17.386 -6.503 0.664 134 HB3 PHE 16 2HB PHE 16 -18.941 -7.301 0.878 135 HD1 PHE 16 HD1 PHE 16 -20.720 -5.211 1.716 136 HD2 PHE 16 HD2 PHE 16 -17.545 -5.060 -1.115 137 HE1 PHE 16 HE1 PHE 16 -21.836 -3.342 0.570 138 HE2 PHE 16 HE2 PHE 16 -18.656 -3.191 -2.266 139 HZ PHE 16 HZ PHE 16 -20.804 -2.329 -1.424 140 HA PRO 17 HA PRO 17 -15.527 -8.256 5.026 141 HB2 PRO 17 1HB PRO 17 -16.854 -9.058 7.254 142 HB3 PRO 17 2HB PRO 17 -16.144 -7.448 7.086 143 HG2 PRO 17 1HG PRO 17 -18.987 -8.312 6.718 144 HG3 PRO 17 2HG PRO 17 -18.352 -6.872 7.536 145 HD2 PRO 17 1HD PRO 17 -19.356 -6.796 5.023 146 HD3 PRO 17 2HD PRO 17 -18.040 -5.732 5.558 147 H SER 18 H SER 18 -18.876 -9.482 5.148 148 HA SER 18 HA SER 18 -18.168 -12.210 5.244 149 HB2 SER 18 1HB SER 18 -20.417 -12.618 5.260 150 HB3 SER 18 2HB SER 18 -20.481 -10.891 5.612 151 HG SER 18 HG SER 18 -21.492 -10.635 3.800 152 H SER 19 H SER 19 -18.472 -9.950 2.630 153 HA SER 19 HA SER 19 -18.920 -11.585 0.453 154 HB2 SER 19 1HB SER 19 -18.763 -9.533 -0.449 155 HB3 SER 19 2HB SER 19 -17.799 -8.942 0.905 156 HG SER 19 HG SER 19 -16.090 -9.125 -0.290 157 H VAL 20 H VAL 20 -17.434 -12.435 -1.157 158 HA VAL 20 HA VAL 20 -15.115 -13.692 0.121 159 HB VAL 20 HB VAL 20 -16.507 -14.383 -2.471 160 HG11 VAL 20 1HG1 VAL 20 -14.447 -15.249 -2.881 161 HG12 VAL 20 2HG1 VAL 20 -14.037 -15.377 -1.169 162 HG13 VAL 20 3HG1 VAL 20 -15.100 -16.571 -1.914 163 HG21 VAL 20 3HG2 VAL 20 -16.754 -16.511 -0.734 164 HG22 VAL 20 1HG2 VAL 20 -16.993 -15.105 0.304 165 HG23 VAL 20 2HG2 VAL 20 -18.010 -15.334 -1.119 166 H ILE 21 H ILE 21 -13.519 -12.155 -0.030 167 HA ILE 21 HA ILE 21 -12.949 -10.922 -2.605 168 HB ILE 21 HB ILE 21 -11.431 -10.592 -0.018 169 HG12 ILE 21 1HG1 ILE 21 -12.868 -8.292 -0.335 170 HG13 ILE 21 2HG1 ILE 21 -14.012 -9.494 -0.925 171 HG21 ILE 21 1HG2 ILE 21 -10.060 -9.298 -1.185 172 HG22 ILE 21 2HG2 ILE 21 -10.938 -9.715 -2.656 173 HG23 ILE 21 3HG2 ILE 21 -11.416 -8.303 -1.715 174 HD11 ILE 21 3HD1 ILE 21 -13.969 -8.811 1.589 175 HD12 ILE 21 1HD1 ILE 21 -14.223 -10.493 1.122 176 HD13 ILE 21 2HD1 ILE 21 -12.633 -9.959 1.670 177 H LYS 22 H LYS 22 -11.851 -12.112 -4.020 178 HA LYS 22 HA LYS 22 -9.424 -13.484 -3.091 179 HB2 LYS 22 1HB LYS 22 -11.551 -14.955 -3.646 180 HB3 LYS 22 2HB LYS 22 -11.023 -14.697 -5.304 181 HG2 LYS 22 1HG LYS 22 -8.833 -15.644 -4.744 182 HG3 LYS 22 2HG LYS 22 -9.386 -15.924 -3.092 183 HD2 LYS 22 1HD LYS 22 -10.977 -17.029 -5.361 184 HD3 LYS 22 2HD LYS 22 -9.482 -17.839 -4.887 185 HE2 LYS 22 1HE LYS 22 -11.726 -17.171 -2.987 186 HE3 LYS 22 2HE LYS 22 -11.541 -18.731 -3.788 187 HZ1 LYS 22 3HZ LYS 22 -10.254 -19.307 -2.094 188 HZ2 LYS 22 1HZ LYS 22 -10.222 -17.732 -1.477 189 HZ3 LYS 22 2HZ LYS 22 -9.097 -18.205 -2.648 190 H ILE 23 H ILE 23 -7.744 -13.650 -4.633 191 HA ILE 23 HA ILE 23 -8.025 -11.777 -6.890 192 HB ILE 23 HB ILE 23 -5.524 -12.488 -5.352 193 HG12 ILE 23 1HG1 ILE 23 -5.747 -9.878 -4.956 194 HG13 ILE 23 2HG1 ILE 23 -7.453 -10.209 -5.234 195 HG21 ILE 23 1HG2 ILE 23 -4.766 -10.376 -6.741 196 HG22 ILE 23 2HG2 ILE 23 -4.667 -12.003 -7.412 197 HG23 ILE 23 3HG2 ILE 23 -6.012 -10.950 -7.848 198 HD11 ILE 23 3HD1 ILE 23 -7.671 -10.902 -3.151 199 HD12 ILE 23 1HD1 ILE 23 -6.438 -12.137 -3.408 200 HD13 ILE 23 2HD1 ILE 23 -5.972 -10.526 -2.862 201 H THR 24 H THR 24 -7.534 -12.450 -8.900 202 HA THR 24 HA THR 24 -6.223 -15.062 -9.221 203 HB THR 24 HB THR 24 -8.679 -14.159 -10.738 204 HG1 THR 24 HG1 THR 24 -8.320 -16.285 -8.869 205 HG21 THR 24 3HG2 THR 24 -8.498 -16.664 -11.469 206 HG22 THR 24 1HG2 THR 24 -6.794 -16.458 -11.064 207 HG23 THR 24 2HG2 THR 24 -7.538 -15.435 -12.293 208 H ASP 25 H ASP 25 -4.875 -15.264 -10.969 209 HA ASP 25 HA ASP 25 -3.981 -12.808 -12.178 210 HB2 ASP 25 1HB ASP 25 -2.207 -14.146 -13.148 211 HB3 ASP 25 2HB ASP 25 -2.403 -14.584 -11.453 212 H LEU 26 H LEU 26 -4.420 -12.057 -14.160 213 HA LEU 26 HA LEU 26 -6.275 -13.596 -15.816 214 HB2 LEU 26 1HB LEU 26 -5.598 -10.722 -15.510 215 HB3 LEU 26 2HB LEU 26 -6.159 -11.265 -17.090 216 HG LEU 26 HG LEU 26 -7.722 -11.783 -14.573 217 HD11 LEU 26 1HD1 LEU 26 -7.838 -9.523 -14.447 218 HD12 LEU 26 2HD1 LEU 26 -9.081 -9.773 -15.673 219 HD13 LEU 26 3HD1 LEU 26 -7.453 -9.294 -16.153 220 HD21 LEU 26 3HD2 LEU 26 -8.615 -13.122 -16.210 221 HD22 LEU 26 1HD2 LEU 26 -8.193 -12.006 -17.509 222 HD23 LEU 26 2HD2 LEU 26 -9.552 -11.646 -16.444 223 H VAL 27 H VAL 27 -3.338 -11.620 -16.257 224 HA VAL 27 HA VAL 27 -2.705 -13.265 -18.620 225 HB VAL 27 HB VAL 27 -1.266 -11.294 -19.314 226 HG11 VAL 27 1HG1 VAL 27 -3.159 -11.562 -20.608 227 HG12 VAL 27 2HG1 VAL 27 -4.254 -11.279 -19.253 228 HG13 VAL 27 3HG1 VAL 27 -3.380 -9.929 -19.981 229 HG21 VAL 27 3HG2 VAL 27 -2.896 -9.934 -17.171 230 HG22 VAL 27 1HG2 VAL 27 -1.144 -10.133 -17.201 231 HG23 VAL 27 2HG2 VAL 27 -1.934 -9.097 -18.390 232 H GLY 28 H GLY 28 -1.393 -11.661 -15.758 233 HA2 GLY 28 1HA GLY 28 0.406 -12.245 -14.440 234 HA3 GLY 28 2HA GLY 28 0.573 -13.705 -15.404 235 H ASP 29 H ASP 29 0.685 -10.357 -16.533 236 HA ASP 29 HA ASP 29 3.487 -10.815 -17.325 237 HB2 ASP 29 1HB ASP 29 1.579 -10.562 -19.117 238 HB3 ASP 29 2HB ASP 29 1.744 -8.846 -18.755 239 H GLN 30 H GLN 30 1.131 -8.472 -16.149 240 HA GLN 30 HA GLN 30 3.372 -6.802 -15.219 241 HB2 GLN 30 1HB GLN 30 1.905 -4.833 -15.488 242 HB3 GLN 30 2HB GLN 30 2.219 -5.647 -17.015 243 HG2 GLN 30 1HG GLN 30 0.012 -5.462 -17.300 244 HG3 GLN 30 2HG GLN 30 -0.062 -6.877 -16.252 245 HE21 GLN 30 2HE2 GLN 30 -1.419 -6.727 -14.630 246 HE22 GLN 30 1HE2 GLN 30 -1.939 -5.270 -13.861 247 H ASP 31 H ASP 31 2.099 -8.953 -13.799 248 HA ASP 31 HA ASP 31 1.324 -9.426 -11.714 249 HB2 ASP 31 1HB ASP 31 1.510 -6.508 -11.010 250 HB3 ASP 31 2HB ASP 31 1.772 -7.911 -9.978 251 H HIS 32 H HIS 32 -0.614 -9.184 -13.585 252 HA HIS 32 HA HIS 32 -2.672 -7.346 -12.903 253 HB2 HIS 32 1HB HIS 32 -2.258 -8.782 -15.085 254 HB3 HIS 32 2HB HIS 32 -3.294 -9.938 -14.253 255 HD1 HIS 32 HD1 HIS 32 -5.394 -8.114 -13.044 256 HD2 HIS 32 HD2 HIS 32 -3.922 -7.654 -16.902 257 HE1 HIS 32 HE1 HIS 32 -7.168 -6.842 -14.294 258 H TYR 33 H TYR 33 -4.358 -7.517 -11.527 259 HA TYR 33 HA TYR 33 -4.688 -10.052 -10.067 260 HB2 TYR 33 1HB TYR 33 -4.814 -7.285 -8.851 261 HB3 TYR 33 2HB TYR 33 -5.061 -8.805 -8.000 262 HD1 TYR 33 HD2 TYR 33 -2.928 -10.513 -8.763 263 HD2 TYR 33 HD1 TYR 33 -2.840 -6.298 -8.194 264 HE1 TYR 33 HE2 TYR 33 -0.520 -10.635 -8.275 265 HE2 TYR 33 HE1 TYR 33 -0.431 -6.408 -7.706 266 HH TYR 33 HH TYR 33 1.147 -8.737 -6.748 267 H ALA 34 H ALA 34 -6.686 -10.819 -10.164 268 HA ALA 34 HA ALA 34 -8.841 -9.041 -11.049 269 HB1 ALA 34 1HB ALA 34 -8.587 -12.041 -11.030 270 HB2 ALA 34 2HB ALA 34 -10.072 -11.190 -11.458 271 HB3 ALA 34 3HB ALA 34 -8.616 -10.965 -12.428 272 H LEU 35 H LEU 35 -9.651 -8.043 -9.274 273 HA LEU 35 HA LEU 35 -10.062 -9.452 -6.794 274 HB2 LEU 35 1HB LEU 35 -9.458 -7.185 -6.582 275 HB3 LEU 35 2HB LEU 35 -10.678 -6.671 -7.745 276 HG LEU 35 HG LEU 35 -12.418 -7.365 -6.059 277 HD11 LEU 35 1HD1 LEU 35 -10.257 -8.515 -4.772 278 HD12 LEU 35 2HD1 LEU 35 -11.873 -8.282 -4.107 279 HD13 LEU 35 3HD1 LEU 35 -10.616 -7.082 -3.808 280 HD21 LEU 35 3HD2 LEU 35 -12.399 -5.139 -5.913 281 HD22 LEU 35 1HD2 LEU 35 -10.641 -5.062 -6.029 282 HD23 LEU 35 2HD2 LEU 35 -11.409 -5.354 -4.469 283 H GLU 36 H GLU 36 -11.634 -10.940 -6.771 284 HA GLU 36 HA GLU 36 -14.192 -10.320 -8.068 285 HB2 GLU 36 1HB GLU 36 -14.657 -12.770 -7.693 286 HB3 GLU 36 2HB GLU 36 -13.334 -12.416 -8.795 287 HG2 GLU 36 1HG GLU 36 -11.708 -12.979 -7.162 288 HG3 GLU 36 2HG GLU 36 -12.925 -13.062 -5.890 289 H ILE 37 H ILE 37 -15.946 -9.859 -6.907 290 HA ILE 37 HA ILE 37 -15.907 -10.464 -4.022 291 HB ILE 37 HB ILE 37 -15.633 -8.077 -4.320 292 HG12 ILE 37 1HG1 ILE 37 -18.475 -8.029 -3.591 293 HG13 ILE 37 2HG1 ILE 37 -17.554 -9.281 -2.766 294 HG21 ILE 37 1HG2 ILE 37 -17.131 -6.702 -5.550 295 HG22 ILE 37 2HG2 ILE 37 -16.667 -8.034 -6.607 296 HG23 ILE 37 3HG2 ILE 37 -18.244 -8.044 -5.817 297 HD11 ILE 37 3HD1 ILE 37 -17.597 -7.295 -1.424 298 HD12 ILE 37 1HD1 ILE 37 -15.958 -7.557 -2.018 299 HD13 ILE 37 2HD1 ILE 37 -16.981 -6.330 -2.765 300 H SER 38 H SER 38 -17.503 -11.730 -3.357 301 HA SER 38 HA SER 38 -19.965 -11.853 -4.975 302 HB2 SER 38 1HB SER 38 -19.103 -13.967 -5.331 303 HB3 SER 38 2HB SER 38 -18.301 -14.021 -3.762 304 HG SER 38 HG SER 38 -20.127 -15.400 -3.844 305 H ASP 39 H ASP 39 -21.555 -10.888 -3.908 306 HA ASP 39 HA ASP 39 -22.158 -11.701 -1.193 307 HB2 ASP 39 1HB ASP 39 -22.383 -9.302 -0.442 308 HB3 ASP 39 2HB ASP 39 -20.728 -9.858 -0.677 309 H ALA 40 H ALA 40 -24.222 -10.449 -0.450 310 HA ALA 40 HA ALA 40 -26.107 -10.590 -2.691 311 HB1 ALA 40 1HB ALA 40 -27.756 -11.201 -1.196 312 HB2 ALA 40 2HB ALA 40 -26.322 -11.937 -0.478 313 HB3 ALA 40 3HB ALA 40 -26.954 -10.423 0.169 314 H GLN 41 H GLN 41 -24.361 -8.254 -2.029 315 HA GLN 41 HA GLN 41 -26.454 -6.257 -1.482 316 HB2 GLN 41 1HB GLN 41 -23.454 -6.033 -1.187 317 HB3 GLN 41 2HB GLN 41 -24.595 -4.726 -0.899 318 HG2 GLN 41 1HG GLN 41 -25.369 -5.642 1.052 319 HG3 GLN 41 2HG GLN 41 -24.937 -7.284 0.579 320 HE21 GLN 41 2HE2 GLN 41 -22.897 -8.043 0.980 321 HE22 GLN 41 1HE2 GLN 41 -21.744 -7.193 1.944 322 H PHE 42 H PHE 42 -24.399 -7.527 -3.866 323 HA PHE 42 HA PHE 42 -24.477 -5.101 -5.493 324 HB2 PHE 42 1HB PHE 42 -22.981 -7.696 -5.670 325 HB3 PHE 42 2HB PHE 42 -23.151 -6.679 -7.097 326 HD1 PHE 42 HD1 PHE 42 -22.721 -4.042 -6.400 327 HD2 PHE 42 HD2 PHE 42 -20.961 -7.488 -4.628 328 HE1 PHE 42 HE1 PHE 42 -20.810 -2.680 -5.658 329 HE2 PHE 42 HE2 PHE 42 -19.048 -6.133 -3.882 330 HZ PHE 42 HZ PHE 42 -18.971 -3.725 -4.396 331 H ASN 43 H ASN 43 -26.868 -6.750 -4.861 332 HA ASN 43 HA ASN 43 -27.569 -7.827 -7.488 333 HB2 ASN 43 1HB ASN 43 -28.694 -8.113 -4.731 334 HB3 ASN 43 2HB ASN 43 -29.749 -8.393 -6.113 335 HD21 ASN 43 2HD2 ASN 43 -27.126 -9.572 -4.234 336 HD22 ASN 43 1HD2 ASN 43 -26.952 -11.094 -5.032 337 H GLY 44 H GLY 44 -28.701 -6.676 -8.906 338 HA2 GLY 44 1HA GLY 44 -30.491 -5.312 -9.604 339 HA3 GLY 44 2HA GLY 44 -30.646 -4.712 -7.959 340 H LEU 45 H LEU 45 -27.455 -4.782 -9.155 341 HA LEU 45 HA LEU 45 -27.565 -1.872 -9.595 342 HB2 LEU 45 1HB LEU 45 -25.436 -3.662 -8.475 343 HB3 LEU 45 2HB LEU 45 -25.048 -2.064 -9.108 344 HG LEU 45 HG LEU 45 -27.149 -2.352 -7.000 345 HD11 LEU 45 1HD1 LEU 45 -24.227 -2.756 -6.679 346 HD12 LEU 45 2HD1 LEU 45 -25.575 -3.450 -5.778 347 HD13 LEU 45 3HD1 LEU 45 -25.066 -1.791 -5.465 348 HD21 LEU 45 3HD2 LEU 45 -25.198 -0.166 -6.948 349 HD22 LEU 45 1HD2 LEU 45 -26.957 -0.125 -6.822 350 HD23 LEU 45 2HD2 LEU 45 -26.188 -0.226 -8.407 351 H SER 46 H SER 46 -25.538 -1.161 -10.955 352 HA SER 46 HA SER 46 -25.586 -2.793 -13.401 353 HB2 SER 46 1HB SER 46 -26.476 -0.465 -13.563 354 HB3 SER 46 2HB SER 46 -24.878 0.138 -13.122 355 HG SER 46 HG SER 46 -25.355 0.012 -15.436 356 H LEU 47 H LEU 47 -23.526 -2.309 -14.799 357 HA LEU 47 HA LEU 47 -21.338 -3.473 -13.469 358 HB2 LEU 47 1HB LEU 47 -21.711 -2.164 -16.130 359 HB3 LEU 47 2HB LEU 47 -20.097 -2.622 -15.591 360 HG LEU 47 HG LEU 47 -21.012 -4.321 -17.051 361 HD11 LEU 47 1HD1 LEU 47 -20.384 -6.138 -15.801 362 HD12 LEU 47 2HD1 LEU 47 -21.213 -5.569 -14.352 363 HD13 LEU 47 3HD1 LEU 47 -19.692 -4.825 -14.847 364 HD21 LEU 47 3HD2 LEU 47 -23.013 -5.551 -16.524 365 HD22 LEU 47 1HD2 LEU 47 -23.397 -3.831 -16.599 366 HD23 LEU 47 2HD2 LEU 47 -23.233 -4.630 -15.035 367 H ILE 48 H ILE 48 -22.253 -0.158 -14.014 368 HA ILE 48 HA ILE 48 -19.674 0.908 -13.270 369 HB ILE 48 HB ILE 48 -22.296 2.381 -13.531 370 HG12 ILE 48 1HG1 ILE 48 -21.782 1.236 -15.621 371 HG13 ILE 48 2HG1 ILE 48 -21.517 2.966 -15.804 372 HG21 ILE 48 1HG2 ILE 48 -19.437 3.337 -13.577 373 HG22 ILE 48 2HG2 ILE 48 -20.853 4.341 -13.884 374 HG23 ILE 48 3HG2 ILE 48 -20.616 3.615 -12.295 375 HD11 ILE 48 3HD1 ILE 48 -19.702 0.799 -16.217 376 HD12 ILE 48 1HD1 ILE 48 -19.498 2.514 -16.574 377 HD13 ILE 48 2HD1 ILE 48 -19.066 1.887 -14.983 378 H ASN 49 H ASN 49 -22.860 0.542 -11.779 379 HA ASN 49 HA ASN 49 -22.274 1.943 -9.398 380 HB2 ASN 49 1HB ASN 49 -24.262 -0.310 -9.753 381 HB3 ASN 49 2HB ASN 49 -24.285 0.934 -8.506 382 HD21 ASN 49 2HD2 ASN 49 -26.412 0.369 -10.248 383 HD22 ASN 49 1HD2 ASN 49 -26.675 1.756 -11.244 384 H GLN 50 H GLN 50 -21.747 -1.364 -10.415 385 HA GLN 50 HA GLN 50 -21.068 -2.324 -7.797 386 HB2 GLN 50 1HB GLN 50 -20.831 -3.469 -10.569 387 HB3 GLN 50 2HB GLN 50 -20.148 -4.294 -9.175 388 HG2 GLN 50 1HG GLN 50 -22.147 -4.982 -8.439 389 HG3 GLN 50 2HG GLN 50 -22.938 -3.462 -8.855 390 HE21 GLN 50 2HE2 GLN 50 -24.606 -5.128 -9.459 391 HE22 GLN 50 1HE2 GLN 50 -24.574 -5.708 -11.086 392 H HIS 51 H HIS 51 -19.329 -1.053 -10.564 393 HA HIS 51 HA HIS 51 -16.735 -1.712 -9.495 394 HB2 HIS 51 1HB HIS 51 -17.497 -1.360 -11.997 395 HB3 HIS 51 2HB HIS 51 -17.112 0.324 -11.653 396 HD1 HIS 51 HD1 HIS 51 -15.573 -2.927 -12.429 397 HD2 HIS 51 HD2 HIS 51 -14.346 0.785 -11.024 398 HE1 HIS 51 HE1 HIS 51 -13.071 -2.908 -12.679 399 H LYS 52 H LYS 52 -18.910 1.009 -9.445 400 HA LYS 52 HA LYS 52 -16.937 2.865 -8.457 401 HB2 LYS 52 1HB LYS 52 -18.584 4.485 -8.589 402 HB3 LYS 52 2HB LYS 52 -19.108 3.351 -9.827 403 HG2 LYS 52 1HG LYS 52 -20.637 2.333 -8.133 404 HG3 LYS 52 2HG LYS 52 -20.207 3.653 -7.044 405 HD2 LYS 52 1HD LYS 52 -21.512 3.908 -9.753 406 HD3 LYS 52 2HD LYS 52 -22.283 4.164 -8.185 407 HE2 LYS 52 1HE LYS 52 -20.024 5.805 -8.175 408 HE3 LYS 52 2HE LYS 52 -20.716 5.983 -9.786 409 HZ1 LYS 52 3HZ LYS 52 -22.801 6.051 -7.923 410 HZ2 LYS 52 1HZ LYS 52 -22.262 7.294 -8.935 411 HZ3 LYS 52 2HZ LYS 52 -21.602 7.117 -7.388 412 H LEU 53 H LEU 53 -19.331 0.708 -7.121 413 HA LEU 53 HA LEU 53 -19.520 1.801 -4.538 414 HB2 LEU 53 1HB LEU 53 -20.107 -0.811 -5.800 415 HB3 LEU 53 2HB LEU 53 -19.939 -0.795 -4.046 416 HG LEU 53 HG LEU 53 -21.872 0.932 -5.589 417 HD11 LEU 53 1HD1 LEU 53 -22.669 -1.237 -5.915 418 HD12 LEU 53 2HD1 LEU 53 -23.550 -0.662 -4.500 419 HD13 LEU 53 3HD1 LEU 53 -22.183 -1.759 -4.302 420 HD21 LEU 53 3HD2 LEU 53 -20.915 1.433 -3.149 421 HD22 LEU 53 1HD2 LEU 53 -22.192 0.296 -2.715 422 HD23 LEU 53 2HD2 LEU 53 -22.586 1.768 -3.605 423 H VAL 54 H VAL 54 -17.520 -0.900 -5.730 424 HA VAL 54 HA VAL 54 -16.147 -1.495 -3.416 425 HB VAL 54 HB VAL 54 -14.264 -2.233 -4.903 426 HG11 VAL 54 1HG1 VAL 54 -15.386 -4.140 -5.143 427 HG12 VAL 54 2HG1 VAL 54 -16.822 -3.278 -4.586 428 HG13 VAL 54 3HG1 VAL 54 -16.491 -3.419 -6.313 429 HG21 VAL 54 3HG2 VAL 54 -14.452 -0.553 -6.638 430 HG22 VAL 54 1HG2 VAL 54 -14.653 -2.159 -7.338 431 HG23 VAL 54 2HG2 VAL 54 -16.062 -1.134 -7.064 432 H LYS 55 H LYS 55 -15.559 1.101 -5.719 433 HA LYS 55 HA LYS 55 -13.085 1.932 -4.554 434 HB2 LYS 55 1HB LYS 55 -14.986 3.427 -6.371 435 HB3 LYS 55 2HB LYS 55 -13.347 3.931 -5.977 436 HG2 LYS 55 1HG LYS 55 -13.901 1.274 -7.246 437 HG3 LYS 55 2HG LYS 55 -13.741 2.747 -8.206 438 HD2 LYS 55 1HD LYS 55 -11.568 2.047 -8.232 439 HD3 LYS 55 2HD LYS 55 -11.539 3.011 -6.754 440 HE2 LYS 55 1HE LYS 55 -11.414 1.178 -5.399 441 HE3 LYS 55 2HE LYS 55 -12.295 0.148 -6.527 442 HZ1 LYS 55 3HZ LYS 55 -9.587 0.185 -6.135 443 HZ2 LYS 55 1HZ LYS 55 -9.796 1.003 -7.601 444 HZ3 LYS 55 2HZ LYS 55 -10.404 -0.564 -7.414 445 H ASN 56 H ASN 56 -16.460 2.786 -4.117 446 HA ASN 56 HA ASN 56 -16.035 5.123 -2.575 447 HB2 ASN 56 1HB ASN 56 -18.409 3.245 -2.600 448 HB3 ASN 56 2HB ASN 56 -18.394 4.867 -1.915 449 HD21 ASN 56 2HD2 ASN 56 -19.964 3.644 -4.110 450 HD22 ASN 56 1HD2 ASN 56 -19.722 4.683 -5.470 451 H ALA 57 H ALA 57 -16.606 1.734 -1.698 452 HA ALA 57 HA ALA 57 -16.714 2.042 1.072 453 HB1 ALA 57 1HB ALA 57 -17.030 -0.049 -0.553 454 HB2 ALA 57 2HB ALA 57 -15.396 -0.390 0.018 455 HB3 ALA 57 3HB ALA 57 -16.717 -0.223 1.174 456 H LEU 58 H LEU 58 -14.053 2.294 -1.085 457 HA LEU 58 HA LEU 58 -12.187 2.307 1.196 458 HB2 LEU 58 1HB LEU 58 -10.415 1.807 -0.469 459 HB3 LEU 58 2HB LEU 58 -11.606 0.524 -0.272 460 HG LEU 58 HG LEU 58 -12.697 1.704 -2.375 461 HD11 LEU 58 1HD1 LEU 58 -11.401 3.464 -2.955 462 HD12 LEU 58 2HD1 LEU 58 -10.506 2.213 -3.816 463 HD13 LEU 58 3HD1 LEU 58 -9.944 2.772 -2.241 464 HD21 LEU 58 3HD2 LEU 58 -11.876 -0.035 -3.643 465 HD22 LEU 58 1HD2 LEU 58 -11.610 -0.638 -2.007 466 HD23 LEU 58 2HD2 LEU 58 -10.269 0.053 -2.920 467 H SER 59 H SER 59 -13.892 4.465 -0.060 468 HA SER 59 HA SER 59 -11.891 6.272 -1.157 469 HB2 SER 59 1HB SER 59 -14.880 6.397 -0.835 470 HB3 SER 59 2HB SER 59 -13.951 7.846 -1.219 471 HG SER 59 HG SER 59 -14.070 7.166 -3.197 472 H GLU 60 H GLU 60 -14.275 6.375 1.497 473 HA GLU 60 HA GLU 60 -13.139 8.667 2.718 474 HB2 GLU 60 1HB GLU 60 -14.579 8.066 4.652 475 HB3 GLU 60 2HB GLU 60 -15.449 8.113 3.125 476 HG2 GLU 60 1HG GLU 60 -14.813 5.522 3.166 477 HG3 GLU 60 2HG GLU 60 -14.849 5.833 4.901 478 H ILE 61 H ILE 61 -12.844 5.194 3.347 479 HA ILE 61 HA ILE 61 -11.149 5.498 5.619 480 HB ILE 61 HB ILE 61 -11.528 3.092 3.831 481 HG12 ILE 61 1HG1 ILE 61 -12.839 2.530 6.141 482 HG13 ILE 61 2HG1 ILE 61 -13.103 4.267 6.040 483 HG21 ILE 61 1HG2 ILE 61 -10.655 1.804 5.714 484 HG22 ILE 61 2HG2 ILE 61 -9.470 2.975 5.136 485 HG23 ILE 61 3HG2 ILE 61 -10.379 3.297 6.612 486 HD11 ILE 61 3HD1 ILE 61 -14.264 2.100 4.484 487 HD12 ILE 61 1HD1 ILE 61 -14.856 3.735 4.778 488 HD13 ILE 61 2HD1 ILE 61 -13.677 3.440 3.500 489 H LEU 62 H LEU 62 -10.539 4.619 2.225 490 HA LEU 62 HA LEU 62 -8.677 4.764 0.928 491 HB2 LEU 62 1HB LEU 62 -8.702 7.061 2.365 492 HB3 LEU 62 2HB LEU 62 -7.137 6.397 2.829 493 HG LEU 62 HG LEU 62 -6.717 7.859 1.031 494 HD11 LEU 62 1HD1 LEU 62 -6.867 5.059 -0.076 495 HD12 LEU 62 2HD1 LEU 62 -5.537 5.739 0.861 496 HD13 LEU 62 3HD1 LEU 62 -5.906 6.381 -0.740 497 HD21 LEU 62 3HD2 LEU 62 -9.059 8.047 0.270 498 HD22 LEU 62 1HD2 LEU 62 -8.904 6.477 -0.520 499 HD23 LEU 62 2HD2 LEU 62 -7.921 7.838 -1.063 500 H ASN 63 H ASN 63 -8.872 2.572 2.617 501 HA ASN 63 HA ASN 63 -6.747 1.984 4.269 502 HB2 ASN 63 1HB ASN 63 -8.732 0.472 2.773 503 HB3 ASN 63 2HB ASN 63 -7.205 -0.396 2.896 504 HD21 ASN 63 2HD2 ASN 63 -9.930 -0.699 4.158 505 HD22 ASN 63 1HD2 ASN 63 -9.597 -0.850 5.847 506 H LYS 64 H LYS 64 -6.947 1.429 0.758 507 HA LYS 64 HA LYS 64 -4.020 1.118 0.717 508 HB2 LYS 64 1HB LYS 64 -5.449 -0.780 -0.138 509 HB3 LYS 64 2HB LYS 64 -5.970 0.287 -1.435 510 HG2 LYS 64 1HG LYS 64 -4.225 -1.123 -2.256 511 HG3 LYS 64 2HG LYS 64 -3.600 0.522 -2.125 512 HD2 LYS 64 1HD LYS 64 -1.958 -1.056 -1.297 513 HD3 LYS 64 2HD LYS 64 -2.567 -0.069 0.034 514 HE2 LYS 64 1HE LYS 64 -3.831 -1.823 0.912 515 HE3 LYS 64 2HE LYS 64 -3.787 -2.733 -0.597 516 HZ1 LYS 64 3HZ LYS 64 -1.471 -2.261 1.202 517 HZ2 LYS 64 1HZ LYS 64 -1.431 -3.136 -0.245 518 HZ3 LYS 64 2HZ LYS 64 -2.334 -3.709 1.065 519 H LYS 65 H LYS 65 -2.814 2.150 -0.941 520 HA LYS 65 HA LYS 65 -4.190 4.397 -2.254 521 HB2 LYS 65 1HB LYS 65 -1.451 4.492 -0.977 522 HB3 LYS 65 2HB LYS 65 -2.238 5.813 -1.830 523 HG2 LYS 65 1HG LYS 65 -3.631 6.288 -0.101 524 HG3 LYS 65 2HG LYS 65 -3.688 4.615 0.459 525 HD2 LYS 65 1HD LYS 65 -2.469 5.714 2.117 526 HD3 LYS 65 2HD LYS 65 -1.225 4.968 1.111 527 HE2 LYS 65 1HE LYS 65 -2.152 7.788 0.656 528 HE3 LYS 65 2HE LYS 65 -0.886 7.405 1.823 529 HZ1 LYS 65 3HZ LYS 65 -0.826 7.271 -1.096 530 HZ2 LYS 65 1HZ LYS 65 0.068 6.114 -0.246 531 HZ3 LYS 65 2HZ LYS 65 0.376 7.760 -0.011 532 H LEU 66 H LEU 66 -3.499 4.934 -4.305 533 HA LEU 66 HA LEU 66 -2.735 4.493 -6.406 534 HB2 LEU 66 1HB LEU 66 -0.342 4.122 -4.659 535 HB3 LEU 66 2HB LEU 66 -0.223 3.772 -6.383 536 HG LEU 66 HG LEU 66 0.598 6.002 -5.906 537 HD11 LEU 66 1HD1 LEU 66 -0.226 6.744 -7.832 538 HD12 LEU 66 2HD1 LEU 66 -1.857 6.864 -7.172 539 HD13 LEU 66 3HD1 LEU 66 -1.282 5.331 -7.828 540 HD21 LEU 66 3HD2 LEU 66 -1.185 6.134 -3.920 541 HD22 LEU 66 1HD2 LEU 66 -2.074 7.026 -5.155 542 HD23 LEU 66 2HD2 LEU 66 -0.469 7.566 -4.661 543 H HIS 67 H HIS 67 -4.303 2.598 -6.177 544 HA HIS 67 HA HIS 67 -2.855 0.168 -6.931 545 HB2 HIS 67 1HB HIS 67 -4.450 -1.210 -5.600 546 HB3 HIS 67 2HB HIS 67 -3.395 -0.208 -4.607 547 HD1 HIS 67 HD1 HIS 67 -4.592 2.152 -3.827 548 HD2 HIS 67 HD2 HIS 67 -7.070 -0.983 -4.963 549 HE1 HIS 67 HE1 HIS 67 -6.849 2.695 -2.861 550 H SER 68 H SER 68 -3.503 -0.313 -8.914 551 HA SER 68 HA SER 68 -6.338 0.108 -9.607 552 HB2 SER 68 1HB SER 68 -5.172 1.675 -10.923 553 HB3 SER 68 2HB SER 68 -3.844 0.557 -11.235 554 HG SER 68 HG SER 68 -4.940 0.340 -13.048 555 H ILE 69 H ILE 69 -7.401 -1.713 -9.964 556 HA ILE 69 HA ILE 69 -6.161 -3.878 -11.446 557 HB ILE 69 HB ILE 69 -6.877 -5.583 -9.762 558 HG12 ILE 69 1HG1 ILE 69 -7.031 -3.217 -7.884 559 HG13 ILE 69 2HG1 ILE 69 -8.437 -4.048 -8.542 560 HG21 ILE 69 1HG2 ILE 69 -4.542 -4.953 -9.995 561 HG22 ILE 69 2HG2 ILE 69 -4.775 -3.612 -8.874 562 HG23 ILE 69 3HG2 ILE 69 -4.927 -5.274 -8.304 563 HD11 ILE 69 3HD1 ILE 69 -7.114 -6.136 -7.497 564 HD12 ILE 69 1HD1 ILE 69 -6.583 -4.855 -6.407 565 HD13 ILE 69 2HD1 ILE 69 -8.304 -5.184 -6.610 566 H SER 70 H SER 70 -7.797 -5.697 -11.782 567 HA SER 70 HA SER 70 -10.246 -4.496 -12.709 568 HB2 SER 70 1HB SER 70 -9.473 -6.063 -14.236 569 HB3 SER 70 2HB SER 70 -8.958 -7.187 -12.979 570 HG SER 70 HG SER 70 -11.132 -7.359 -14.336 571 H ILE 71 H ILE 71 -12.307 -4.870 -11.987 572 HA ILE 71 HA ILE 71 -12.547 -6.358 -9.453 573 HB ILE 71 HB ILE 71 -14.076 -3.889 -10.286 574 HG12 ILE 71 1HG1 ILE 71 -12.486 -3.903 -7.803 575 HG13 ILE 71 2HG1 ILE 71 -11.540 -3.995 -9.285 576 HG21 ILE 71 1HG2 ILE 71 -15.039 -3.996 -8.020 577 HG22 ILE 71 2HG2 ILE 71 -15.484 -5.384 -9.011 578 HG23 ILE 71 3HG2 ILE 71 -14.238 -5.548 -7.774 579 HD11 ILE 71 3HD1 ILE 71 -13.629 -1.970 -9.378 580 HD12 ILE 71 1HD1 ILE 71 -12.444 -1.705 -8.099 581 HD13 ILE 71 2HD1 ILE 71 -11.914 -1.857 -9.775 582 H LYS 72 H LYS 72 -13.541 -8.217 -9.900 583 HA LYS 72 HA LYS 72 -15.533 -8.384 -12.000 584 HB2 LYS 72 1HB LYS 72 -13.891 -10.186 -11.742 585 HB3 LYS 72 2HB LYS 72 -14.470 -10.492 -10.110 586 HG2 LYS 72 1HG LYS 72 -16.736 -10.952 -11.173 587 HG3 LYS 72 2HG LYS 72 -15.872 -10.998 -12.712 588 HD2 LYS 72 1HD LYS 72 -14.308 -12.631 -11.257 589 HD3 LYS 72 2HD LYS 72 -15.858 -12.915 -10.462 590 HE2 LYS 72 1HE LYS 72 -16.011 -14.478 -12.109 591 HE3 LYS 72 2HE LYS 72 -16.682 -13.099 -12.977 592 HZ1 LYS 72 3HZ LYS 72 -15.054 -13.247 -14.449 593 HZ2 LYS 72 1HZ LYS 72 -14.466 -14.627 -13.666 594 HZ3 LYS 72 2HZ LYS 72 -13.879 -13.099 -13.242 595 H THR 73 H THR 73 -17.690 -8.533 -11.733 596 HA THR 73 HA THR 73 -18.728 -8.146 -9.027 597 HB THR 73 HB THR 73 -20.744 -7.349 -10.008 598 HG1 THR 73 HG1 THR 73 -19.734 -8.212 -12.532 599 HG21 THR 73 3HG2 THR 73 -18.690 -6.300 -11.926 600 HG22 THR 73 1HG2 THR 73 -18.582 -5.942 -10.203 601 HG23 THR 73 2HG2 THR 73 -20.001 -5.438 -11.121 602 H ILE 74 H ILE 74 -19.638 -9.751 -7.932 603 HA ILE 74 HA ILE 74 -20.840 -11.985 -9.422 604 HB ILE 74 HB ILE 74 -19.190 -12.318 -6.916 605 HG12 ILE 74 1HG1 ILE 74 -17.812 -13.678 -8.778 606 HG13 ILE 74 2HG1 ILE 74 -18.486 -12.414 -9.801 607 HG21 ILE 74 1HG2 ILE 74 -20.353 -14.364 -8.801 608 HG22 ILE 74 2HG2 ILE 74 -19.404 -14.696 -7.353 609 HG23 ILE 74 3HG2 ILE 74 -20.998 -13.954 -7.211 610 HD11 ILE 74 3HD1 ILE 74 -16.564 -12.189 -7.533 611 HD12 ILE 74 1HD1 ILE 74 -16.463 -11.524 -9.163 612 HD13 ILE 74 2HD1 ILE 74 -17.568 -10.812 -7.987 613 H SER 75 H SER 75 -22.849 -12.441 -8.809 614 HA SER 75 HA SER 75 -23.763 -11.455 -6.185 615 HB2 SER 75 1HB SER 75 -26.011 -11.214 -7.213 616 HB3 SER 75 2HB SER 75 -24.802 -10.191 -7.990 617 HG SER 75 HG SER 75 -26.345 -11.663 -9.283 618 H ILE 76 H ILE 76 -25.224 -12.736 -5.014 619 HA ILE 76 HA ILE 76 -26.307 -15.172 -5.880 620 HB ILE 76 HB ILE 76 -24.065 -16.029 -5.987 621 HG12 ILE 76 1HG1 ILE 76 -24.964 -17.118 -3.354 622 HG13 ILE 76 2HG1 ILE 76 -26.039 -17.280 -4.739 623 HG21 ILE 76 1HG2 ILE 76 -22.504 -15.047 -4.741 624 HG22 ILE 76 2HG2 ILE 76 -23.705 -14.406 -3.620 625 HG23 ILE 76 3HG2 ILE 76 -23.073 -16.037 -3.398 626 HD11 ILE 76 3HD1 ILE 76 -23.750 -18.163 -5.825 627 HD12 ILE 76 1HD1 ILE 76 -23.496 -18.630 -4.143 628 HD13 ILE 76 2HD1 ILE 76 -24.919 -19.205 -5.014 629 HA PRO 77 HA PRO 77 -27.881 -13.436 -1.892 630 HB2 PRO 77 1HB PRO 77 -30.494 -13.548 -2.621 631 HB3 PRO 77 2HB PRO 77 -29.446 -12.178 -3.008 632 HG2 PRO 77 1HG PRO 77 -30.262 -14.484 -4.733 633 HG3 PRO 77 2HG PRO 77 -30.154 -12.763 -5.144 634 HD2 PRO 77 1HD PRO 77 -28.232 -14.546 -5.822 635 HD3 PRO 77 2HD PRO 77 -27.871 -12.849 -5.445 Start of MODEL 4 1 H1 MET 1 H MET 1 2.731 -0.761 -5.911 2 HA MET 1 HA MET 1 5.007 -1.999 -4.602 3 HB2 MET 1 1HB MET 1 3.137 -0.110 -3.248 4 HB3 MET 1 2HB MET 1 3.688 -1.519 -2.351 5 HG2 MET 1 1HG MET 1 5.602 0.342 -3.714 6 HG3 MET 1 2HG MET 1 5.001 0.640 -2.085 7 HE1 MET 1 3HE MET 1 8.022 0.457 -2.811 8 HE2 MET 1 1HE MET 1 7.566 0.613 -1.114 9 HE3 MET 1 2HE MET 1 8.713 -0.633 -1.608 10 H ALA 2 H ALA 2 4.620 -4.098 -4.346 11 HA ALA 2 HA ALA 2 1.898 -5.081 -4.714 12 HB1 ALA 2 1HB ALA 2 3.410 -6.209 -6.101 13 HB2 ALA 2 2HB ALA 2 4.599 -6.388 -4.810 14 HB3 ALA 2 3HB ALA 2 3.109 -7.331 -4.774 15 H ILE 3 H ILE 3 0.701 -6.001 -3.154 16 HA ILE 3 HA ILE 3 1.991 -6.537 -0.559 17 HB ILE 3 HB ILE 3 0.603 -4.464 -0.519 18 HG12 ILE 3 1HG1 ILE 3 -0.818 -6.450 1.197 19 HG13 ILE 3 2HG1 ILE 3 0.922 -6.271 1.398 20 HG21 ILE 3 1HG2 ILE 3 -1.513 -4.381 -1.239 21 HG22 ILE 3 2HG2 ILE 3 -1.154 -5.906 -2.047 22 HG23 ILE 3 3HG2 ILE 3 -1.931 -5.909 -0.465 23 HD11 ILE 3 3HD1 ILE 3 0.359 -3.737 1.559 24 HD12 ILE 3 1HD1 ILE 3 -1.260 -4.320 1.945 25 HD13 ILE 3 2HD1 ILE 3 0.111 -4.792 2.950 26 H SER 4 H SER 4 1.098 -8.225 0.695 27 HA SER 4 HA SER 4 0.426 -10.540 -0.646 28 HB2 SER 4 1HB SER 4 -0.209 -9.770 2.211 29 HB3 SER 4 2HB SER 4 -0.323 -11.408 1.570 30 HG SER 4 HG SER 4 1.775 -11.586 1.660 31 H ALA 5 H ALA 5 -1.440 -11.572 -1.211 32 HA ALA 5 HA ALA 5 -3.694 -10.049 -1.862 33 HB1 ALA 5 1HB ALA 5 -4.023 -11.850 -3.112 34 HB2 ALA 5 2HB ALA 5 -2.834 -12.757 -2.178 35 HB3 ALA 5 3HB ALA 5 -4.522 -12.731 -1.668 36 H GLU 6 H GLU 6 -2.884 -11.840 1.020 37 HA GLU 6 HA GLU 6 -5.458 -12.059 2.135 38 HB2 GLU 6 1HB GLU 6 -4.333 -12.462 4.246 39 HB3 GLU 6 2HB GLU 6 -3.494 -13.310 2.955 40 HG2 GLU 6 1HG GLU 6 -1.716 -11.769 2.958 41 HG3 GLU 6 2HG GLU 6 -2.615 -10.618 3.945 42 H GLU 7 H GLU 7 -3.292 -9.391 1.828 43 HA GLU 7 HA GLU 7 -4.591 -7.817 3.887 44 HB2 GLU 7 1HB GLU 7 -2.087 -7.746 3.131 45 HB3 GLU 7 2HB GLU 7 -2.690 -6.682 1.868 46 HG2 GLU 7 1HG GLU 7 -1.839 -5.432 3.778 47 HG3 GLU 7 2HG GLU 7 -3.561 -5.152 3.529 48 H LEU 8 H LEU 8 -4.820 -8.324 0.476 49 HA LEU 8 HA LEU 8 -6.049 -5.896 -0.268 50 HB2 LEU 8 1HB LEU 8 -5.194 -7.206 -2.008 51 HB3 LEU 8 2HB LEU 8 -6.022 -8.655 -1.441 52 HG LEU 8 HG LEU 8 -8.146 -7.782 -2.211 53 HD11 LEU 8 1HD1 LEU 8 -6.601 -5.295 -2.436 54 HD12 LEU 8 2HD1 LEU 8 -8.318 -5.545 -2.124 55 HD13 LEU 8 3HD1 LEU 8 -7.702 -5.619 -3.775 56 HD21 LEU 8 3HD2 LEU 8 -7.393 -8.928 -3.997 57 HD22 LEU 8 1HD2 LEU 8 -5.839 -8.095 -4.011 58 HD23 LEU 8 2HD2 LEU 8 -7.258 -7.325 -4.721 59 H GLU 9 H GLU 9 -7.393 -9.024 0.734 60 HA GLU 9 HA GLU 9 -10.101 -8.373 0.401 61 HB2 GLU 9 1HB GLU 9 -10.590 -10.301 1.708 62 HB3 GLU 9 2HB GLU 9 -9.139 -10.669 0.788 63 HG2 GLU 9 1HG GLU 9 -7.978 -9.762 2.996 64 HG3 GLU 9 2HG GLU 9 -9.500 -10.301 3.701 65 H LYS 10 H LYS 10 -7.854 -7.742 3.010 66 HA LYS 10 HA LYS 10 -9.527 -7.129 5.103 67 HB2 LYS 10 1HB LYS 10 -7.032 -5.613 4.313 68 HB3 LYS 10 2HB LYS 10 -7.770 -5.625 5.909 69 HG2 LYS 10 1HG LYS 10 -6.918 -8.196 4.659 70 HG3 LYS 10 2HG LYS 10 -5.718 -7.137 5.403 71 HD2 LYS 10 1HD LYS 10 -7.305 -7.123 7.432 72 HD3 LYS 10 2HD LYS 10 -8.051 -8.532 6.674 73 HE2 LYS 10 1HE LYS 10 -6.489 -9.517 8.054 74 HE3 LYS 10 2HE LYS 10 -5.601 -9.408 6.535 75 HZ1 LYS 10 3HZ LYS 10 -4.440 -8.649 8.659 76 HZ2 LYS 10 1HZ LYS 10 -5.417 -7.271 8.564 77 HZ3 LYS 10 2HZ LYS 10 -4.342 -7.634 7.310 78 H ILE 11 H ILE 11 -8.879 -5.268 2.214 79 HA ILE 11 HA ILE 11 -10.104 -2.856 3.143 80 HB ILE 11 HB ILE 11 -9.411 -3.800 0.362 81 HG12 ILE 11 1HG1 ILE 11 -7.756 -1.810 0.697 82 HG13 ILE 11 2HG1 ILE 11 -8.091 -2.045 2.409 83 HG21 ILE 11 1HG2 ILE 11 -9.683 -1.248 -0.087 84 HG22 ILE 11 2HG2 ILE 11 -11.097 -2.300 -0.103 85 HG23 ILE 11 3HG2 ILE 11 -10.752 -1.309 1.314 86 HD11 ILE 11 3HD1 ILE 11 -7.126 -4.161 2.427 87 HD12 ILE 11 1HD1 ILE 11 -7.210 -4.317 0.672 88 HD13 ILE 11 2HD1 ILE 11 -6.052 -3.206 1.405 89 H LEU 12 H LEU 12 -11.139 -5.456 0.943 90 HA LEU 12 HA LEU 12 -13.743 -4.389 0.539 91 HB2 LEU 12 1HB LEU 12 -12.485 -7.063 0.033 92 HB3 LEU 12 2HB LEU 12 -14.202 -6.789 -0.253 93 HG LEU 12 HG LEU 12 -11.925 -5.355 -1.618 94 HD11 LEU 12 1HD1 LEU 12 -11.931 -7.406 -2.641 95 HD12 LEU 12 2HD1 LEU 12 -13.133 -6.554 -3.611 96 HD13 LEU 12 3HD1 LEU 12 -13.650 -7.671 -2.348 97 HD21 LEU 12 3HD2 LEU 12 -14.671 -4.638 -1.270 98 HD22 LEU 12 1HD2 LEU 12 -14.370 -5.006 -2.969 99 HD23 LEU 12 2HD2 LEU 12 -13.400 -3.784 -2.146 100 H LYS 13 H LYS 13 -12.326 -5.919 3.167 101 HA LYS 13 HA LYS 13 -14.752 -7.201 4.120 102 HB2 LYS 13 1HB LYS 13 -11.957 -6.949 5.212 103 HB3 LYS 13 2HB LYS 13 -13.271 -7.605 6.180 104 HG2 LYS 13 1HG LYS 13 -13.445 -9.005 3.805 105 HG3 LYS 13 2HG LYS 13 -11.709 -8.848 4.083 106 HD2 LYS 13 1HD LYS 13 -12.378 -10.851 5.157 107 HD3 LYS 13 2HD LYS 13 -12.139 -9.659 6.437 108 HE2 LYS 13 1HE LYS 13 -14.391 -9.475 6.870 109 HE3 LYS 13 2HE LYS 13 -14.852 -9.979 5.244 110 HZ1 LYS 13 3HZ LYS 13 -15.337 -11.886 6.308 111 HZ2 LYS 13 1HZ LYS 13 -14.273 -11.591 7.590 112 HZ3 LYS 13 2HZ LYS 13 -13.683 -12.193 6.124 113 H LYS 14 H LYS 14 -12.715 -4.426 4.947 114 HA LYS 14 HA LYS 14 -13.981 -3.587 7.263 115 HB2 LYS 14 1HB LYS 14 -12.575 -2.075 5.074 116 HB3 LYS 14 2HB LYS 14 -13.253 -1.243 6.468 117 HG2 LYS 14 1HG LYS 14 -11.179 -3.424 6.570 118 HG3 LYS 14 2HG LYS 14 -10.869 -1.695 6.741 119 HD2 LYS 14 1HD LYS 14 -12.583 -1.810 8.669 120 HD3 LYS 14 2HD LYS 14 -12.304 -3.552 8.609 121 HE2 LYS 14 1HE LYS 14 -10.112 -3.357 9.298 122 HE3 LYS 14 2HE LYS 14 -9.969 -1.696 8.724 123 HZ1 LYS 14 3HZ LYS 14 -10.490 -0.964 10.731 124 HZ2 LYS 14 1HZ LYS 14 -10.521 -2.556 11.304 125 HZ3 LYS 14 2HZ LYS 14 -11.940 -1.835 10.733 126 H SER 15 H SER 15 -15.016 -3.340 3.951 127 HA SER 15 HA SER 15 -17.344 -1.746 4.794 128 HB2 SER 15 1HB SER 15 -15.997 -0.711 3.012 129 HB3 SER 15 2HB SER 15 -16.214 -2.147 2.012 130 HG SER 15 HG SER 15 -17.800 -0.048 2.186 131 H PHE 16 H PHE 16 -16.398 -4.475 2.722 132 HA PHE 16 HA PHE 16 -19.151 -5.496 2.950 133 HB2 PHE 16 1HB PHE 16 -17.156 -6.302 0.836 134 HB3 PHE 16 2HB PHE 16 -18.896 -6.570 0.843 135 HD1 PHE 16 HD1 PHE 16 -19.934 -3.934 1.548 136 HD2 PHE 16 HD2 PHE 16 -16.726 -5.014 -1.033 137 HE1 PHE 16 HE1 PHE 16 -20.260 -1.852 0.277 138 HE2 PHE 16 HE2 PHE 16 -17.046 -2.934 -2.307 139 HZ PHE 16 HZ PHE 16 -18.815 -1.350 -1.653 140 HA PRO 17 HA PRO 17 -16.449 -8.367 5.387 141 HB2 PRO 17 1HB PRO 17 -18.209 -8.650 7.434 142 HB3 PRO 17 2HB PRO 17 -17.030 -7.335 7.356 143 HG2 PRO 17 1HG PRO 17 -19.937 -7.317 6.641 144 HG3 PRO 17 2HG PRO 17 -18.996 -6.106 7.532 145 HD2 PRO 17 1HD PRO 17 -19.628 -5.823 4.914 146 HD3 PRO 17 2HD PRO 17 -18.123 -5.186 5.607 147 H SER 18 H SER 18 -19.778 -8.421 4.333 148 HA SER 18 HA SER 18 -19.956 -11.314 4.681 149 HB2 SER 18 1HB SER 18 -21.879 -9.812 5.282 150 HB3 SER 18 2HB SER 18 -22.047 -9.431 3.568 151 HG SER 18 HG SER 18 -22.058 -12.097 4.497 152 H SER 19 H SER 19 -18.260 -9.794 2.642 153 HA SER 19 HA SER 19 -19.325 -11.077 0.214 154 HB2 SER 19 1HB SER 19 -18.364 -9.402 -1.090 155 HB3 SER 19 2HB SER 19 -18.871 -8.506 0.342 156 HG SER 19 HG SER 19 -16.618 -9.025 1.092 157 H VAL 20 H VAL 20 -18.100 -12.516 -0.902 158 HA VAL 20 HA VAL 20 -15.793 -13.606 0.463 159 HB VAL 20 HB VAL 20 -17.008 -14.506 -2.151 160 HG11 VAL 20 1HG1 VAL 20 -15.878 -16.580 -1.762 161 HG12 VAL 20 2HG1 VAL 20 -14.695 -15.279 -1.621 162 HG13 VAL 20 3HG1 VAL 20 -15.340 -16.047 -0.170 163 HG21 VAL 20 3HG2 VAL 20 -17.920 -16.326 -0.458 164 HG22 VAL 20 1HG2 VAL 20 -17.808 -14.976 0.672 165 HG23 VAL 20 2HG2 VAL 20 -18.804 -14.833 -0.777 166 H ILE 21 H ILE 21 -13.897 -12.623 0.179 167 HA ILE 21 HA ILE 21 -13.258 -11.408 -2.401 168 HB ILE 21 HB ILE 21 -11.746 -11.308 0.213 169 HG12 ILE 21 1HG1 ILE 21 -12.872 -8.827 -0.838 170 HG13 ILE 21 2HG1 ILE 21 -14.105 -10.028 -0.472 171 HG21 ILE 21 1HG2 ILE 21 -10.028 -10.592 -1.000 172 HG22 ILE 21 2HG2 ILE 21 -10.995 -10.604 -2.474 173 HG23 ILE 21 3HG2 ILE 21 -10.994 -9.181 -1.432 174 HD11 ILE 21 3HD1 ILE 21 -13.764 -8.613 1.434 175 HD12 ILE 21 1HD1 ILE 21 -13.174 -10.234 1.801 176 HD13 ILE 21 2HD1 ILE 21 -12.032 -8.945 1.417 177 H LYS 22 H LYS 22 -11.853 -12.252 -3.808 178 HA LYS 22 HA LYS 22 -9.910 -14.241 -2.932 179 HB2 LYS 22 1HB LYS 22 -12.043 -15.428 -3.617 180 HB3 LYS 22 2HB LYS 22 -11.759 -14.827 -5.245 181 HG2 LYS 22 1HG LYS 22 -10.789 -16.868 -5.433 182 HG3 LYS 22 2HG LYS 22 -9.396 -15.951 -4.854 183 HD2 LYS 22 1HD LYS 22 -9.438 -17.892 -3.530 184 HD3 LYS 22 2HD LYS 22 -10.133 -16.630 -2.509 185 HE2 LYS 22 1HE LYS 22 -12.386 -17.402 -3.130 186 HE3 LYS 22 2HE LYS 22 -11.665 -18.687 -4.098 187 HZ1 LYS 22 3HZ LYS 22 -11.136 -19.884 -2.279 188 HZ2 LYS 22 1HZ LYS 22 -12.408 -19.016 -1.579 189 HZ3 LYS 22 2HZ LYS 22 -10.809 -18.528 -1.323 190 H ILE 23 H ILE 23 -8.049 -14.211 -4.095 191 HA ILE 23 HA ILE 23 -7.912 -12.249 -6.281 192 HB ILE 23 HB ILE 23 -5.684 -13.347 -4.562 193 HG12 ILE 23 1HG1 ILE 23 -5.679 -10.765 -3.969 194 HG13 ILE 23 2HG1 ILE 23 -7.370 -10.883 -4.445 195 HG21 ILE 23 1HG2 ILE 23 -4.462 -12.769 -6.364 196 HG22 ILE 23 2HG2 ILE 23 -5.724 -11.725 -7.016 197 HG23 ILE 23 3HG2 ILE 23 -4.670 -11.137 -5.730 198 HD11 ILE 23 3HD1 ILE 23 -6.548 -12.998 -2.626 199 HD12 ILE 23 1HD1 ILE 23 -6.362 -11.379 -1.951 200 HD13 ILE 23 2HD1 ILE 23 -7.933 -11.908 -2.554 201 H THR 24 H THR 24 -7.154 -12.791 -8.266 202 HA THR 24 HA THR 24 -6.065 -15.478 -8.684 203 HB THR 24 HB THR 24 -8.292 -14.376 -10.403 204 HG1 THR 24 HG1 THR 24 -8.558 -16.597 -8.678 205 HG21 THR 24 3HG2 THR 24 -7.201 -15.850 -11.781 206 HG22 THR 24 1HG2 THR 24 -8.290 -16.962 -10.952 207 HG23 THR 24 2HG2 THR 24 -6.607 -16.832 -10.442 208 H ASP 25 H ASP 25 -4.477 -15.560 -10.173 209 HA ASP 25 HA ASP 25 -3.666 -13.051 -11.404 210 HB2 ASP 25 1HB ASP 25 -2.171 -15.643 -11.672 211 HB3 ASP 25 2HB ASP 25 -1.542 -13.997 -11.671 212 H LEU 26 H LEU 26 -3.810 -12.588 -13.516 213 HA LEU 26 HA LEU 26 -4.957 -14.644 -15.275 214 HB2 LEU 26 1HB LEU 26 -5.117 -11.666 -15.195 215 HB3 LEU 26 2HB LEU 26 -5.349 -12.503 -16.729 216 HG LEU 26 HG LEU 26 -6.976 -13.188 -14.299 217 HD11 LEU 26 1HD1 LEU 26 -7.759 -11.083 -14.390 218 HD12 LEU 26 2HD1 LEU 26 -8.654 -11.681 -15.786 219 HD13 LEU 26 3HD1 LEU 26 -7.139 -10.808 -16.018 220 HD21 LEU 26 3HD2 LEU 26 -8.155 -13.346 -16.961 221 HD22 LEU 26 1HD2 LEU 26 -8.105 -14.544 -15.668 222 HD23 LEU 26 2HD2 LEU 26 -6.734 -14.373 -16.764 223 H VAL 27 H VAL 27 -2.512 -12.070 -15.202 224 HA VAL 27 HA VAL 27 -1.043 -13.533 -17.295 225 HB VAL 27 HB VAL 27 -0.215 -11.351 -18.148 226 HG11 VAL 27 1HG1 VAL 27 -1.936 -12.376 -19.402 227 HG12 VAL 27 2HG1 VAL 27 -3.169 -11.913 -18.228 228 HG13 VAL 27 3HG1 VAL 27 -2.400 -10.683 -19.232 229 HG21 VAL 27 3HG2 VAL 27 -2.409 -10.126 -16.485 230 HG22 VAL 27 1HG2 VAL 27 -0.704 -10.097 -16.037 231 HG23 VAL 27 2HG2 VAL 27 -1.242 -9.291 -17.511 232 H GLY 28 H GLY 28 1.259 -13.310 -17.238 233 HA2 GLY 28 1HA GLY 28 2.250 -12.605 -14.546 234 HA3 GLY 28 2HA GLY 28 2.939 -13.867 -15.557 235 H ASP 29 H ASP 29 1.980 -10.693 -16.714 236 HA ASP 29 HA ASP 29 4.814 -9.949 -16.961 237 HB2 ASP 29 1HB ASP 29 4.135 -8.924 -19.222 238 HB3 ASP 29 2HB ASP 29 4.348 -10.671 -19.147 239 H GLN 30 H GLN 30 1.450 -8.833 -17.138 240 HA GLN 30 HA GLN 30 2.334 -6.131 -16.422 241 HB2 GLN 30 1HB GLN 30 0.715 -6.659 -18.374 242 HB3 GLN 30 2HB GLN 30 -0.489 -6.891 -17.114 243 HG2 GLN 30 1HG GLN 30 0.262 -4.548 -16.310 244 HG3 GLN 30 2HG GLN 30 0.929 -4.397 -17.935 245 HE21 GLN 30 2HE2 GLN 30 -2.034 -5.114 -16.161 246 HE22 GLN 30 1HE2 GLN 30 -3.114 -4.496 -17.359 247 H ASP 31 H ASP 31 1.301 -4.979 -14.713 248 HA ASP 31 HA ASP 31 0.799 -6.626 -12.412 249 HB2 ASP 31 1HB ASP 31 0.509 -4.407 -11.254 250 HB3 ASP 31 2HB ASP 31 2.063 -4.627 -12.054 251 H HIS 32 H HIS 32 -1.129 -7.502 -13.825 252 HA HIS 32 HA HIS 32 -3.537 -5.905 -13.297 253 HB2 HIS 32 1HB HIS 32 -2.914 -6.917 -15.631 254 HB3 HIS 32 2HB HIS 32 -3.543 -8.411 -14.942 255 HD1 HIS 32 HD1 HIS 32 -4.672 -6.054 -17.137 256 HD2 HIS 32 HD2 HIS 32 -6.253 -7.457 -13.561 257 HE1 HIS 32 HE1 HIS 32 -7.131 -5.536 -17.240 258 H TYR 33 H TYR 33 -4.659 -6.397 -11.542 259 HA TYR 33 HA TYR 33 -4.507 -9.143 -10.492 260 HB2 TYR 33 1HB TYR 33 -5.352 -6.692 -8.946 261 HB3 TYR 33 2HB TYR 33 -4.902 -8.270 -8.308 262 HD1 TYR 33 HD1 TYR 33 -2.410 -8.879 -9.654 263 HD2 TYR 33 HD2 TYR 33 -3.814 -5.155 -8.152 264 HE1 TYR 33 HE1 TYR 33 -0.087 -8.115 -9.394 265 HE2 TYR 33 HE2 TYR 33 -1.495 -4.380 -7.888 266 HH TYR 33 HH TYR 33 1.236 -6.357 -8.959 267 H ALA 34 H ALA 34 -6.274 -10.354 -10.577 268 HA ALA 34 HA ALA 34 -8.797 -9.136 -11.380 269 HB1 ALA 34 1HB ALA 34 -8.643 -12.055 -10.970 270 HB2 ALA 34 2HB ALA 34 -9.351 -11.127 -12.292 271 HB3 ALA 34 3HB ALA 34 -7.608 -11.385 -12.231 272 H LEU 35 H LEU 35 -9.846 -8.267 -9.678 273 HA LEU 35 HA LEU 35 -9.894 -9.607 -7.110 274 HB2 LEU 35 1HB LEU 35 -9.701 -7.222 -7.093 275 HB3 LEU 35 2HB LEU 35 -11.130 -7.050 -8.109 276 HG LEU 35 HG LEU 35 -12.529 -7.864 -6.264 277 HD11 LEU 35 1HD1 LEU 35 -10.596 -7.553 -4.150 278 HD12 LEU 35 2HD1 LEU 35 -10.126 -8.845 -5.253 279 HD13 LEU 35 3HD1 LEU 35 -11.707 -8.884 -4.473 280 HD21 LEU 35 3HD2 LEU 35 -10.950 -5.417 -6.232 281 HD22 LEU 35 1HD2 LEU 35 -11.560 -5.869 -4.641 282 HD23 LEU 35 2HD2 LEU 35 -12.680 -5.654 -5.986 283 H GLU 36 H GLU 36 -11.469 -10.884 -6.367 284 HA GLU 36 HA GLU 36 -13.983 -11.011 -7.900 285 HB2 GLU 36 1HB GLU 36 -12.406 -13.243 -6.618 286 HB3 GLU 36 2HB GLU 36 -14.066 -13.430 -7.167 287 HG2 GLU 36 1HG GLU 36 -13.114 -14.123 -9.065 288 HG3 GLU 36 2HG GLU 36 -12.922 -12.400 -9.386 289 H ILE 37 H ILE 37 -15.565 -10.155 -6.732 290 HA ILE 37 HA ILE 37 -15.625 -10.708 -3.836 291 HB ILE 37 HB ILE 37 -15.249 -8.340 -4.239 292 HG12 ILE 37 1HG1 ILE 37 -18.141 -8.560 -3.448 293 HG13 ILE 37 2HG1 ILE 37 -16.879 -9.257 -2.437 294 HG21 ILE 37 1HG2 ILE 37 -16.181 -7.215 -5.914 295 HG22 ILE 37 2HG2 ILE 37 -16.917 -8.728 -6.441 296 HG23 ILE 37 3HG2 ILE 37 -17.804 -7.641 -5.371 297 HD11 ILE 37 3HD1 ILE 37 -16.044 -7.214 -1.837 298 HD12 ILE 37 1HD1 ILE 37 -16.638 -6.419 -3.294 299 HD13 ILE 37 2HD1 ILE 37 -17.760 -6.843 -2.001 300 H SER 38 H SER 38 -17.321 -11.811 -3.109 301 HA SER 38 HA SER 38 -19.717 -11.974 -4.819 302 HB2 SER 38 1HB SER 38 -18.286 -14.084 -4.597 303 HB3 SER 38 2HB SER 38 -18.826 -14.143 -2.919 304 HG SER 38 HG SER 38 -20.864 -14.522 -3.570 305 H ASP 39 H ASP 39 -21.050 -10.531 -3.860 306 HA ASP 39 HA ASP 39 -21.718 -11.024 -1.035 307 HB2 ASP 39 1HB ASP 39 -22.327 -8.464 -1.110 308 HB3 ASP 39 2HB ASP 39 -20.669 -8.979 -0.810 309 H ALA 40 H ALA 40 -23.888 -9.655 -0.599 310 HA ALA 40 HA ALA 40 -25.755 -10.281 -2.790 311 HB1 ALA 40 1HB ALA 40 -27.391 -11.050 -1.157 312 HB2 ALA 40 2HB ALA 40 -25.908 -12.001 -1.059 313 HB3 ALA 40 3HB ALA 40 -26.241 -10.758 0.148 314 H GLN 41 H GLN 41 -24.521 -7.747 -2.109 315 HA GLN 41 HA GLN 41 -26.893 -6.236 -1.233 316 HB2 GLN 41 1HB GLN 41 -25.342 -4.445 -0.556 317 HB3 GLN 41 2HB GLN 41 -25.031 -5.947 0.304 318 HG2 GLN 41 1HG GLN 41 -23.280 -6.341 -1.582 319 HG3 GLN 41 2HG GLN 41 -23.405 -4.595 -1.795 320 HE21 GLN 41 2HE2 GLN 41 -22.597 -7.149 0.463 321 HE22 GLN 41 1HE2 GLN 41 -21.612 -6.181 1.500 322 H PHE 42 H PHE 42 -24.615 -6.779 -3.747 323 HA PHE 42 HA PHE 42 -24.779 -4.355 -5.145 324 HB2 PHE 42 1HB PHE 42 -23.763 -5.467 -6.937 325 HB3 PHE 42 2HB PHE 42 -23.223 -6.383 -5.533 326 HD1 PHE 42 HD2 PHE 42 -25.121 -8.274 -4.880 327 HD2 PHE 42 HD1 PHE 42 -24.238 -6.757 -8.758 328 HE1 PHE 42 HE2 PHE 42 -26.007 -10.338 -5.885 329 HE2 PHE 42 HE1 PHE 42 -25.124 -8.818 -9.769 330 HZ PHE 42 HZ PHE 42 -26.009 -10.612 -8.332 331 H ASN 43 H ASN 43 -27.094 -6.819 -4.671 332 HA ASN 43 HA ASN 43 -28.616 -6.799 -6.966 333 HB2 ASN 43 1HB ASN 43 -29.156 -7.289 -4.098 334 HB3 ASN 43 2HB ASN 43 -30.565 -6.930 -5.090 335 HD21 ASN 43 2HD2 ASN 43 -28.263 -9.255 -4.193 336 HD22 ASN 43 1HD2 ASN 43 -28.771 -10.516 -5.259 337 H GLY 44 H GLY 44 -29.415 -5.153 -8.084 338 HA2 GLY 44 1HA GLY 44 -31.072 -3.416 -8.255 339 HA3 GLY 44 2HA GLY 44 -30.689 -2.947 -6.605 340 H LEU 45 H LEU 45 -27.997 -3.676 -8.579 341 HA LEU 45 HA LEU 45 -27.555 -0.811 -9.098 342 HB2 LEU 45 1HB LEU 45 -25.595 -2.860 -8.087 343 HB3 LEU 45 2HB LEU 45 -25.120 -1.283 -8.713 344 HG LEU 45 HG LEU 45 -26.953 -1.637 -6.348 345 HD11 LEU 45 1HD1 LEU 45 -24.049 -0.933 -6.152 346 HD12 LEU 45 2HD1 LEU 45 -24.584 -2.613 -6.119 347 HD13 LEU 45 3HD1 LEU 45 -25.151 -1.483 -4.890 348 HD21 LEU 45 3HD2 LEU 45 -25.547 0.756 -6.200 349 HD22 LEU 45 1HD2 LEU 45 -27.241 0.548 -6.644 350 HD23 LEU 45 2HD2 LEU 45 -26.002 0.610 -7.898 351 H SER 46 H SER 46 -25.482 -0.665 -10.625 352 HA SER 46 HA SER 46 -25.964 -2.536 -12.852 353 HB2 SER 46 1HB SER 46 -26.752 -0.214 -13.289 354 HB3 SER 46 2HB SER 46 -25.102 0.360 -13.052 355 HG SER 46 HG SER 46 -24.718 -0.175 -15.035 356 H LEU 47 H LEU 47 -24.031 -2.427 -14.465 357 HA LEU 47 HA LEU 47 -21.807 -3.561 -13.228 358 HB2 LEU 47 1HB LEU 47 -22.341 -2.452 -15.945 359 HB3 LEU 47 2HB LEU 47 -20.693 -2.896 -15.507 360 HG LEU 47 HG LEU 47 -21.758 -4.689 -16.739 361 HD11 LEU 47 1HD1 LEU 47 -21.298 -6.496 -15.244 362 HD12 LEU 47 2HD1 LEU 47 -21.543 -5.464 -13.836 363 HD13 LEU 47 3HD1 LEU 47 -20.159 -5.195 -14.896 364 HD21 LEU 47 3HD2 LEU 47 -23.775 -4.841 -14.505 365 HD22 LEU 47 1HD2 LEU 47 -23.722 -5.817 -15.973 366 HD23 LEU 47 2HD2 LEU 47 -24.088 -4.095 -16.072 367 H ILE 48 H ILE 48 -22.619 -0.252 -13.768 368 HA ILE 48 HA ILE 48 -19.932 0.746 -13.462 369 HB ILE 48 HB ILE 48 -22.544 2.256 -13.328 370 HG12 ILE 48 1HG1 ILE 48 -22.281 1.120 -15.480 371 HG13 ILE 48 2HG1 ILE 48 -22.081 2.858 -15.672 372 HG21 ILE 48 1HG2 ILE 48 -19.676 3.128 -13.533 373 HG22 ILE 48 2HG2 ILE 48 -21.017 4.174 -13.995 374 HG23 ILE 48 3HG2 ILE 48 -20.882 3.595 -12.335 375 HD11 ILE 48 3HD1 ILE 48 -20.298 0.751 -16.371 376 HD12 ILE 48 1HD1 ILE 48 -20.156 2.480 -16.684 377 HD13 ILE 48 2HD1 ILE 48 -19.523 1.800 -15.184 378 H ASN 49 H ASN 49 -22.896 0.814 -11.486 379 HA ASN 49 HA ASN 49 -21.741 2.050 -9.242 380 HB2 ASN 49 1HB ASN 49 -24.156 0.261 -9.538 381 HB3 ASN 49 2HB ASN 49 -23.710 1.015 -8.010 382 HD21 ASN 49 2HD2 ASN 49 -26.025 1.328 -9.897 383 HD22 ASN 49 1HD2 ASN 49 -26.130 3.031 -10.170 384 H GLN 50 H GLN 50 -21.954 -1.314 -10.229 385 HA GLN 50 HA GLN 50 -21.097 -2.443 -7.775 386 HB2 GLN 50 1HB GLN 50 -21.020 -3.495 -10.604 387 HB3 GLN 50 2HB GLN 50 -20.565 -4.451 -9.200 388 HG2 GLN 50 1HG GLN 50 -22.694 -4.769 -8.554 389 HG3 GLN 50 2HG GLN 50 -23.200 -3.155 -9.052 390 HE21 GLN 50 2HE2 GLN 50 -25.081 -4.444 -9.793 391 HE22 GLN 50 1HE2 GLN 50 -25.024 -5.110 -11.386 392 H HIS 51 H HIS 51 -19.382 -1.498 -10.728 393 HA HIS 51 HA HIS 51 -16.825 -2.346 -9.749 394 HB2 HIS 51 1HB HIS 51 -17.733 -1.915 -12.224 395 HB3 HIS 51 2HB HIS 51 -17.018 -0.332 -11.932 396 HD1 HIS 51 HD1 HIS 51 -16.184 -3.630 -13.105 397 HD2 HIS 51 HD2 HIS 51 -14.165 -0.587 -11.124 398 HE1 HIS 51 HE1 HIS 51 -13.740 -4.130 -13.418 399 H LYS 52 H LYS 52 -18.728 0.533 -9.539 400 HA LYS 52 HA LYS 52 -16.528 2.253 -8.823 401 HB2 LYS 52 1HB LYS 52 -19.476 2.544 -9.107 402 HB3 LYS 52 2HB LYS 52 -18.646 3.690 -8.063 403 HG2 LYS 52 1HG LYS 52 -17.065 4.047 -10.055 404 HG3 LYS 52 2HG LYS 52 -18.322 3.252 -11.006 405 HD2 LYS 52 1HD LYS 52 -19.902 4.972 -9.859 406 HD3 LYS 52 2HD LYS 52 -18.411 5.863 -9.546 407 HE2 LYS 52 1HE LYS 52 -18.899 4.855 -12.301 408 HE3 LYS 52 2HE LYS 52 -19.835 6.242 -11.746 409 HZ1 LYS 52 3HZ LYS 52 -17.366 6.937 -10.996 410 HZ2 LYS 52 1HZ LYS 52 -18.064 7.383 -12.471 411 HZ3 LYS 52 2HZ LYS 52 -17.021 6.054 -12.397 412 H LEU 53 H LEU 53 -19.198 0.652 -7.127 413 HA LEU 53 HA LEU 53 -18.900 1.661 -4.595 414 HB2 LEU 53 1HB LEU 53 -19.842 -0.897 -5.723 415 HB3 LEU 53 2HB LEU 53 -19.431 -0.916 -4.009 416 HG LEU 53 HG LEU 53 -21.455 0.904 -5.313 417 HD11 LEU 53 1HD1 LEU 53 -22.039 -1.544 -5.154 418 HD12 LEU 53 2HD1 LEU 53 -23.134 -0.437 -4.326 419 HD13 LEU 53 3HD1 LEU 53 -21.953 -1.364 -3.402 420 HD21 LEU 53 3HD2 LEU 53 -21.986 1.031 -2.693 421 HD22 LEU 53 1HD2 LEU 53 -20.905 2.159 -3.512 422 HD23 LEU 53 2HD2 LEU 53 -20.240 0.790 -2.620 423 H VAL 54 H VAL 54 -17.260 -1.237 -5.874 424 HA VAL 54 HA VAL 54 -15.681 -1.828 -3.685 425 HB VAL 54 HB VAL 54 -14.089 -2.871 -5.290 426 HG11 VAL 54 1HG1 VAL 54 -16.725 -3.565 -4.719 427 HG12 VAL 54 2HG1 VAL 54 -16.548 -3.837 -6.454 428 HG13 VAL 54 3HG1 VAL 54 -15.453 -4.628 -5.320 429 HG21 VAL 54 3HG2 VAL 54 -14.680 -2.855 -7.688 430 HG22 VAL 54 1HG2 VAL 54 -15.918 -1.644 -7.351 431 HG23 VAL 54 2HG2 VAL 54 -14.216 -1.261 -7.093 432 H LYS 55 H LYS 55 -15.248 0.638 -6.128 433 HA LYS 55 HA LYS 55 -12.557 1.280 -5.324 434 HB2 LYS 55 1HB LYS 55 -14.513 2.727 -7.118 435 HB3 LYS 55 2HB LYS 55 -12.843 3.220 -6.867 436 HG2 LYS 55 1HG LYS 55 -13.500 0.469 -7.845 437 HG3 LYS 55 2HG LYS 55 -13.430 1.840 -8.954 438 HD2 LYS 55 1HD LYS 55 -11.258 1.186 -9.094 439 HD3 LYS 55 2HD LYS 55 -11.120 2.228 -7.677 440 HE2 LYS 55 1HE LYS 55 -10.602 0.510 -6.349 441 HE3 LYS 55 2HE LYS 55 -11.917 -0.477 -6.985 442 HZ1 LYS 55 3HZ LYS 55 -10.408 -1.675 -8.046 443 HZ2 LYS 55 1HZ LYS 55 -9.159 -0.656 -7.531 444 HZ3 LYS 55 2HZ LYS 55 -9.982 -0.323 -8.970 445 H ASN 56 H ASN 56 -15.781 2.355 -4.550 446 HA ASN 56 HA ASN 56 -14.917 4.753 -3.210 447 HB2 ASN 56 1HB ASN 56 -17.587 3.329 -3.235 448 HB3 ASN 56 2HB ASN 56 -17.295 4.894 -2.481 449 HD21 ASN 56 2HD2 ASN 56 -18.524 3.478 -5.124 450 HD22 ASN 56 1HD2 ASN 56 -18.300 4.739 -6.283 451 H ALA 57 H ALA 57 -15.534 1.439 -2.361 452 HA ALA 57 HA ALA 57 -15.837 1.767 0.430 453 HB1 ALA 57 1HB ALA 57 -14.569 -0.724 -0.479 454 HB2 ALA 57 2HB ALA 57 -16.022 -0.473 0.489 455 HB3 ALA 57 3HB ALA 57 -16.096 -0.325 -1.267 456 H LEU 58 H LEU 58 -13.146 2.148 -1.587 457 HA LEU 58 HA LEU 58 -11.323 1.923 0.718 458 HB2 LEU 58 1HB LEU 58 -9.520 1.579 -0.969 459 HB3 LEU 58 2HB LEU 58 -10.701 0.275 -0.871 460 HG LEU 58 HG LEU 58 -11.778 1.666 -2.885 461 HD11 LEU 58 1HD1 LEU 58 -9.701 3.238 -2.592 462 HD12 LEU 58 2HD1 LEU 58 -10.299 2.822 -4.198 463 HD13 LEU 58 3HD1 LEU 58 -8.890 1.991 -3.539 464 HD21 LEU 58 3HD2 LEU 58 -9.490 -0.283 -3.150 465 HD22 LEU 58 1HD2 LEU 58 -10.680 0.096 -4.396 466 HD23 LEU 58 2HD2 LEU 58 -11.186 -0.705 -2.908 467 H SER 59 H SER 59 -12.854 4.042 -1.321 468 HA SER 59 HA SER 59 -10.693 5.988 -1.447 469 HB2 SER 59 1HB SER 59 -13.527 5.986 -2.494 470 HB3 SER 59 2HB SER 59 -12.470 7.395 -2.600 471 HG SER 59 HG SER 59 -12.591 5.396 -4.274 472 H GLU 60 H GLU 60 -13.624 5.355 0.339 473 HA GLU 60 HA GLU 60 -13.475 7.942 1.685 474 HB2 GLU 60 1HB GLU 60 -15.601 7.309 2.722 475 HB3 GLU 60 2HB GLU 60 -15.681 7.162 0.972 476 HG2 GLU 60 1HG GLU 60 -14.971 4.661 1.566 477 HG3 GLU 60 2HG GLU 60 -15.805 5.079 3.061 478 H ILE 61 H ILE 61 -13.108 4.501 2.333 479 HA ILE 61 HA ILE 61 -12.691 4.847 5.151 480 HB ILE 61 HB ILE 61 -11.910 2.444 3.507 481 HG12 ILE 61 1HG1 ILE 61 -14.245 3.010 3.024 482 HG13 ILE 61 2HG1 ILE 61 -14.147 1.545 3.995 483 HG21 ILE 61 1HG2 ILE 61 -11.114 2.655 5.879 484 HG22 ILE 61 2HG2 ILE 61 -12.804 2.603 6.376 485 HG23 ILE 61 3HG2 ILE 61 -12.089 1.225 5.541 486 HD11 ILE 61 3HD1 ILE 61 -15.950 3.088 4.682 487 HD12 ILE 61 1HD1 ILE 61 -14.791 2.742 5.965 488 HD13 ILE 61 2HD1 ILE 61 -14.720 4.280 5.104 489 H LEU 62 H LEU 62 -10.699 4.853 2.309 490 HA LEU 62 HA LEU 62 -8.477 5.195 1.971 491 HB2 LEU 62 1HB LEU 62 -8.929 6.477 4.634 492 HB3 LEU 62 2HB LEU 62 -7.303 6.385 3.959 493 HG LEU 62 HG LEU 62 -8.275 8.551 3.506 494 HD11 LEU 62 1HD1 LEU 62 -8.493 7.389 0.816 495 HD12 LEU 62 2HD1 LEU 62 -7.019 6.986 1.697 496 HD13 LEU 62 3HD1 LEU 62 -7.447 8.674 1.421 497 HD21 LEU 62 3HD2 LEU 62 -10.636 7.891 3.602 498 HD22 LEU 62 1HD2 LEU 62 -10.459 7.055 2.060 499 HD23 LEU 62 2HD2 LEU 62 -10.269 8.806 2.139 500 H ASN 63 H ASN 63 -8.855 2.653 2.426 501 HA ASN 63 HA ASN 63 -7.193 1.751 4.643 502 HB2 ASN 63 1HB ASN 63 -8.929 0.324 2.633 503 HB3 ASN 63 2HB ASN 63 -7.834 -0.548 3.702 504 HD21 ASN 63 2HD2 ASN 63 -10.482 -1.072 3.804 505 HD22 ASN 63 1HD2 ASN 63 -11.159 -0.464 5.273 506 H LYS 64 H LYS 64 -7.271 1.539 1.099 507 HA LYS 64 HA LYS 64 -4.358 1.198 1.128 508 HB2 LYS 64 1HB LYS 64 -5.699 -0.997 0.786 509 HB3 LYS 64 2HB LYS 64 -6.048 -0.353 -0.813 510 HG2 LYS 64 1HG LYS 64 -4.193 -1.613 -1.249 511 HG3 LYS 64 2HG LYS 64 -3.452 -0.044 -0.924 512 HD2 LYS 64 1HD LYS 64 -3.870 -1.928 1.346 513 HD3 LYS 64 2HD LYS 64 -2.550 -2.241 0.217 514 HE2 LYS 64 1HE LYS 64 -2.020 0.294 0.617 515 HE3 LYS 64 2HE LYS 64 -2.948 0.045 2.095 516 HZ1 LYS 64 3HZ LYS 64 -0.393 -1.178 1.288 517 HZ2 LYS 64 1HZ LYS 64 -1.397 -1.972 2.394 518 HZ3 LYS 64 2HZ LYS 64 -0.803 -0.428 2.748 519 H LYS 65 H LYS 65 -3.280 1.983 -0.715 520 HA LYS 65 HA LYS 65 -4.283 4.313 -1.843 521 HB2 LYS 65 1HB LYS 65 -1.906 2.710 -2.084 522 HB3 LYS 65 2HB LYS 65 -2.407 3.269 -3.675 523 HG2 LYS 65 1HG LYS 65 -1.426 5.202 -3.238 524 HG3 LYS 65 2HG LYS 65 -2.638 5.489 -1.987 525 HD2 LYS 65 1HD LYS 65 -1.242 4.810 -0.290 526 HD3 LYS 65 2HD LYS 65 -0.282 3.775 -1.349 527 HE2 LYS 65 1HE LYS 65 0.960 5.765 -0.613 528 HE3 LYS 65 2HE LYS 65 0.749 5.718 -2.363 529 HZ1 LYS 65 3HZ LYS 65 -1.157 7.202 -0.675 530 HZ2 LYS 65 1HZ LYS 65 -0.781 7.427 -2.310 531 HZ3 LYS 65 2HZ LYS 65 0.317 7.907 -1.116 532 H LEU 66 H LEU 66 -4.912 4.820 -4.011 533 HA LEU 66 HA LEU 66 -6.747 2.895 -5.102 534 HB2 LEU 66 1HB LEU 66 -6.003 5.719 -5.749 535 HB3 LEU 66 2HB LEU 66 -6.973 4.776 -6.879 536 HG LEU 66 HG LEU 66 -8.574 4.404 -4.921 537 HD11 LEU 66 1HD1 LEU 66 -6.590 6.189 -3.711 538 HD12 LEU 66 2HD1 LEU 66 -7.741 5.088 -2.956 539 HD13 LEU 66 3HD1 LEU 66 -8.266 6.687 -3.482 540 HD21 LEU 66 3HD2 LEU 66 -8.167 7.121 -6.159 541 HD22 LEU 66 1HD2 LEU 66 -9.610 6.650 -5.261 542 HD23 LEU 66 2HD2 LEU 66 -9.188 5.810 -6.754 543 H HIS 67 H HIS 67 -6.793 2.417 -7.458 544 HA HIS 67 HA HIS 67 -4.549 2.671 -9.117 545 HB2 HIS 67 1HB HIS 67 -3.850 0.211 -9.044 546 HB3 HIS 67 2HB HIS 67 -3.305 1.233 -7.718 547 HD1 HIS 67 HD1 HIS 67 -6.716 -0.383 -8.011 548 HD2 HIS 67 HD2 HIS 67 -3.268 -0.614 -5.704 549 HE1 HIS 67 HE1 HIS 67 -7.272 -1.952 -6.126 550 H SER 68 H SER 68 -4.630 0.875 -10.914 551 HA SER 68 HA SER 68 -7.469 0.552 -11.611 552 HB2 SER 68 1HB SER 68 -6.660 0.419 -13.964 553 HB3 SER 68 2HB SER 68 -6.255 1.948 -13.184 554 HG SER 68 HG SER 68 -4.614 0.079 -14.234 555 H ILE 69 H ILE 69 -8.279 -1.424 -11.514 556 HA ILE 69 HA ILE 69 -6.716 -3.704 -12.397 557 HB ILE 69 HB ILE 69 -7.285 -5.021 -10.347 558 HG12 ILE 69 1HG1 ILE 69 -7.890 -2.282 -9.210 559 HG13 ILE 69 2HG1 ILE 69 -9.069 -3.556 -9.498 560 HG21 ILE 69 1HG2 ILE 69 -5.477 -2.639 -9.962 561 HG22 ILE 69 2HG2 ILE 69 -5.447 -4.115 -8.998 562 HG23 ILE 69 3HG2 ILE 69 -5.038 -4.173 -10.713 563 HD11 ILE 69 3HD1 ILE 69 -6.770 -3.678 -7.561 564 HD12 ILE 69 1HD1 ILE 69 -8.468 -3.430 -7.154 565 HD13 ILE 69 2HD1 ILE 69 -7.942 -4.963 -7.852 566 H SER 70 H SER 70 -8.095 -5.750 -12.284 567 HA SER 70 HA SER 70 -10.700 -5.097 -13.391 568 HB2 SER 70 1HB SER 70 -9.642 -6.693 -14.719 569 HB3 SER 70 2HB SER 70 -8.981 -7.556 -13.331 570 HG SER 70 HG SER 70 -10.790 -8.600 -14.414 571 H ILE 71 H ILE 71 -12.554 -5.246 -12.318 572 HA ILE 71 HA ILE 71 -12.587 -6.769 -9.794 573 HB ILE 71 HB ILE 71 -14.167 -4.287 -10.477 574 HG12 ILE 71 1HG1 ILE 71 -12.308 -4.375 -8.170 575 HG13 ILE 71 2HG1 ILE 71 -11.564 -4.354 -9.765 576 HG21 ILE 71 1HG2 ILE 71 -14.277 -4.835 -7.728 577 HG22 ILE 71 2HG2 ILE 71 -15.590 -4.932 -8.900 578 HG23 ILE 71 3HG2 ILE 71 -14.617 -6.359 -8.547 579 HD11 ILE 71 3HD1 ILE 71 -12.118 -2.217 -10.131 580 HD12 ILE 71 1HD1 ILE 71 -13.699 -2.384 -9.368 581 HD13 ILE 71 2HD1 ILE 71 -12.259 -2.154 -8.374 582 H LYS 72 H LYS 72 -13.772 -8.544 -9.938 583 HA LYS 72 HA LYS 72 -15.950 -8.673 -11.891 584 HB2 LYS 72 1HB LYS 72 -14.293 -10.472 -11.963 585 HB3 LYS 72 2HB LYS 72 -14.614 -10.854 -10.277 586 HG2 LYS 72 1HG LYS 72 -17.034 -11.253 -11.042 587 HG3 LYS 72 2HG LYS 72 -16.354 -11.303 -12.670 588 HD2 LYS 72 1HD LYS 72 -14.677 -12.928 -11.158 589 HD3 LYS 72 2HD LYS 72 -16.301 -13.306 -10.579 590 HE2 LYS 72 1HE LYS 72 -16.924 -14.239 -12.542 591 HE3 LYS 72 2HE LYS 72 -15.992 -13.093 -13.504 592 HZ1 LYS 72 3HZ LYS 72 -14.139 -14.615 -12.148 593 HZ2 LYS 72 1HZ LYS 72 -14.520 -14.705 -13.794 594 HZ3 LYS 72 2HZ LYS 72 -15.300 -15.720 -12.689 595 H THR 73 H THR 73 -18.050 -8.891 -11.338 596 HA THR 73 HA THR 73 -18.697 -8.669 -8.489 597 HB THR 73 HB THR 73 -20.814 -7.782 -9.117 598 HG1 THR 73 HG1 THR 73 -21.695 -8.067 -11.073 599 HG21 THR 73 3HG2 THR 73 -19.026 -6.169 -9.319 600 HG22 THR 73 1HG2 THR 73 -20.198 -5.894 -10.606 601 HG23 THR 73 2HG2 THR 73 -18.676 -6.711 -10.960 602 H ILE 74 H ILE 74 -19.232 -10.468 -7.455 603 HA ILE 74 HA ILE 74 -20.590 -12.608 -8.959 604 HB ILE 74 HB ILE 74 -18.932 -12.896 -6.451 605 HG12 ILE 74 1HG1 ILE 74 -17.549 -14.272 -8.276 606 HG13 ILE 74 2HG1 ILE 74 -18.279 -13.084 -9.351 607 HG21 ILE 74 1HG2 ILE 74 -20.653 -14.578 -6.583 608 HG22 ILE 74 2HG2 ILE 74 -20.221 -14.939 -8.253 609 HG23 ILE 74 3HG2 ILE 74 -19.094 -15.314 -6.950 610 HD11 ILE 74 3HD1 ILE 74 -16.002 -12.517 -8.473 611 HD12 ILE 74 1HD1 ILE 74 -17.243 -11.291 -8.214 612 HD13 ILE 74 2HD1 ILE 74 -16.743 -12.335 -6.883 613 H SER 75 H SER 75 -22.347 -13.662 -8.026 614 HA SER 75 HA SER 75 -23.523 -12.301 -5.689 615 HB2 SER 75 1HB SER 75 -25.587 -12.229 -6.689 616 HB3 SER 75 2HB SER 75 -24.584 -12.152 -8.137 617 HG SER 75 HG SER 75 -26.159 -13.740 -8.391 618 H ILE 76 H ILE 76 -24.586 -13.552 -4.157 619 HA ILE 76 HA ILE 76 -24.405 -16.468 -4.472 620 HB ILE 76 HB ILE 76 -22.501 -15.891 -3.125 621 HG12 ILE 76 1HG1 ILE 76 -24.437 -16.746 -1.018 622 HG13 ILE 76 2HG1 ILE 76 -24.253 -17.763 -2.443 623 HG21 ILE 76 1HG2 ILE 76 -22.465 -14.093 -1.828 624 HG22 ILE 76 2HG2 ILE 76 -24.171 -13.820 -2.178 625 HG23 ILE 76 3HG2 ILE 76 -23.702 -14.795 -0.786 626 HD11 ILE 76 3HD1 ILE 76 -22.833 -18.331 -0.431 627 HD12 ILE 76 1HD1 ILE 76 -21.996 -18.187 -1.976 628 HD13 ILE 76 2HD1 ILE 76 -21.909 -16.875 -0.800 629 HA PRO 77 HA PRO 77 -28.631 -15.195 -3.087 630 HB2 PRO 77 1HB PRO 77 -29.929 -16.925 -4.728 631 HB3 PRO 77 2HB PRO 77 -29.419 -15.312 -5.242 632 HG2 PRO 77 1HG PRO 77 -28.101 -17.957 -5.719 633 HG3 PRO 77 2HG PRO 77 -28.342 -16.608 -6.844 634 HD2 PRO 77 1HD PRO 77 -25.982 -17.061 -5.596 635 HD3 PRO 77 2HD PRO 77 -26.544 -15.429 -6.013 Start of MODEL 5 1 H1 MET 1 H MET 1 3.413 -5.033 -7.001 2 HA MET 1 HA MET 1 2.513 -7.131 -5.192 3 HB2 MET 1 1HB MET 1 3.950 -7.583 -7.226 4 HB3 MET 1 2HB MET 1 5.265 -6.779 -6.379 5 HG2 MET 1 1HG MET 1 5.587 -9.076 -6.036 6 HG3 MET 1 2HG MET 1 4.931 -8.451 -4.524 7 HE1 MET 1 3HE MET 1 3.255 -8.998 -3.430 8 HE2 MET 1 1HE MET 1 1.654 -9.334 -4.090 9 HE3 MET 1 2HE MET 1 2.665 -10.658 -3.513 10 H ALA 2 H ALA 2 2.278 -5.044 -3.707 11 HA ALA 2 HA ALA 2 4.788 -4.633 -2.236 12 HB1 ALA 2 1HB ALA 2 3.139 -2.745 -3.138 13 HB2 ALA 2 2HB ALA 2 2.382 -3.040 -1.572 14 HB3 ALA 2 3HB ALA 2 4.076 -2.558 -1.655 15 H ILE 3 H ILE 3 1.315 -4.887 -1.444 16 HA ILE 3 HA ILE 3 2.048 -6.183 1.080 17 HB ILE 3 HB ILE 3 0.508 -4.219 1.129 18 HG12 ILE 3 1HG1 ILE 3 -1.192 -6.437 2.092 19 HG13 ILE 3 2HG1 ILE 3 0.478 -6.469 2.647 20 HG21 ILE 3 1HG2 ILE 3 -1.756 -5.878 0.209 21 HG22 ILE 3 2HG2 ILE 3 -1.480 -4.144 0.051 22 HG23 ILE 3 3HG2 ILE 3 -0.667 -5.268 -1.037 23 HD11 ILE 3 3HD1 ILE 3 0.111 -4.047 3.341 24 HD12 ILE 3 1HD1 ILE 3 -1.607 -4.372 3.112 25 HD13 ILE 3 2HD1 ILE 3 -0.684 -5.300 4.294 26 H SER 4 H SER 4 1.038 -8.116 1.762 27 HA SER 4 HA SER 4 0.905 -10.157 -0.099 28 HB2 SER 4 1HB SER 4 -0.290 -9.932 2.665 29 HB3 SER 4 2HB SER 4 -0.354 -11.420 1.722 30 HG SER 4 HG SER 4 1.574 -10.708 3.268 31 H ALA 5 H ALA 5 -0.693 -11.148 -1.254 32 HA ALA 5 HA ALA 5 -2.887 -9.627 -2.109 33 HB1 ALA 5 1HB ALA 5 -1.778 -12.249 -2.661 34 HB2 ALA 5 2HB ALA 5 -3.541 -12.241 -2.732 35 HB3 ALA 5 3HB ALA 5 -2.613 -11.125 -3.734 36 H GLU 6 H GLU 6 -2.512 -11.804 0.554 37 HA GLU 6 HA GLU 6 -5.242 -12.448 0.953 38 HB2 GLU 6 1HB GLU 6 -4.574 -13.277 3.101 39 HB3 GLU 6 2HB GLU 6 -3.314 -13.688 1.946 40 HG2 GLU 6 1HG GLU 6 -2.077 -11.647 2.731 41 HG3 GLU 6 2HG GLU 6 -3.268 -11.521 4.025 42 H GLU 7 H GLU 7 -3.324 -9.669 1.690 43 HA GLU 7 HA GLU 7 -5.110 -8.621 3.690 44 HB2 GLU 7 1HB GLU 7 -2.553 -8.163 3.332 45 HB3 GLU 7 2HB GLU 7 -3.126 -6.934 2.213 46 HG2 GLU 7 1HG GLU 7 -2.996 -5.673 4.085 47 HG3 GLU 7 2HG GLU 7 -4.639 -6.280 4.282 48 H LEU 8 H LEU 8 -4.925 -8.597 0.266 49 HA LEU 8 HA LEU 8 -6.108 -6.200 -0.436 50 HB2 LEU 8 1HB LEU 8 -5.258 -7.681 -2.109 51 HB3 LEU 8 2HB LEU 8 -6.403 -8.940 -1.650 52 HG LEU 8 HG LEU 8 -8.236 -7.681 -2.571 53 HD11 LEU 8 1HD1 LEU 8 -7.048 -5.568 -3.954 54 HD12 LEU 8 2HD1 LEU 8 -6.397 -5.483 -2.318 55 HD13 LEU 8 3HD1 LEU 8 -8.142 -5.465 -2.575 56 HD21 LEU 8 3HD2 LEU 8 -5.853 -8.289 -4.199 57 HD22 LEU 8 1HD2 LEU 8 -7.085 -7.289 -4.969 58 HD23 LEU 8 2HD2 LEU 8 -7.510 -8.880 -4.339 59 H GLU 9 H GLU 9 -7.538 -9.034 1.003 60 HA GLU 9 HA GLU 9 -10.252 -8.295 0.476 61 HB2 GLU 9 1HB GLU 9 -10.858 -10.134 1.889 62 HB3 GLU 9 2HB GLU 9 -9.487 -10.636 0.910 63 HG2 GLU 9 1HG GLU 9 -8.152 -9.773 3.036 64 HG3 GLU 9 2HG GLU 9 -9.674 -10.180 3.826 65 H LYS 10 H LYS 10 -7.966 -7.755 3.075 66 HA LYS 10 HA LYS 10 -9.601 -6.959 5.139 67 HB2 LYS 10 1HB LYS 10 -6.969 -5.717 4.316 68 HB3 LYS 10 2HB LYS 10 -7.729 -5.538 5.892 69 HG2 LYS 10 1HG LYS 10 -6.980 -8.218 4.764 70 HG3 LYS 10 2HG LYS 10 -5.860 -7.233 5.708 71 HD2 LYS 10 1HD LYS 10 -8.594 -7.877 6.753 72 HD3 LYS 10 2HD LYS 10 -7.269 -9.031 6.919 73 HE2 LYS 10 1HE LYS 10 -5.949 -7.371 8.108 74 HE3 LYS 10 2HE LYS 10 -7.227 -6.176 7.893 75 HZ1 LYS 10 3HZ LYS 10 -8.440 -8.351 9.061 76 HZ2 LYS 10 1HZ LYS 10 -8.049 -6.885 9.810 77 HZ3 LYS 10 2HZ LYS 10 -6.971 -8.185 9.882 78 H ILE 11 H ILE 11 -8.810 -5.250 2.198 79 HA ILE 11 HA ILE 11 -9.793 -2.706 3.036 80 HB ILE 11 HB ILE 11 -9.315 -3.823 0.272 81 HG12 ILE 11 1HG1 ILE 11 -7.428 -2.004 0.506 82 HG13 ILE 11 2HG1 ILE 11 -7.691 -2.242 2.230 83 HG21 ILE 11 1HG2 ILE 11 -9.235 -1.113 0.010 84 HG22 ILE 11 2HG2 ILE 11 -10.617 -2.128 -0.402 85 HG23 ILE 11 3HG2 ILE 11 -10.549 -1.324 1.166 86 HD11 ILE 11 3HD1 ILE 11 -7.449 -4.769 0.884 87 HD12 ILE 11 1HD1 ILE 11 -6.061 -3.735 0.544 88 HD13 ILE 11 2HD1 ILE 11 -6.499 -4.104 2.213 89 H LEU 12 H LEU 12 -11.093 -4.856 0.504 90 HA LEU 12 HA LEU 12 -13.588 -3.699 0.290 91 HB2 LEU 12 1HB LEU 12 -12.560 -6.457 -0.208 92 HB3 LEU 12 2HB LEU 12 -14.287 -6.137 -0.348 93 HG LEU 12 HG LEU 12 -12.118 -4.766 -1.936 94 HD11 LEU 12 1HD1 LEU 12 -12.253 -6.992 -2.709 95 HD12 LEU 12 2HD1 LEU 12 -13.215 -6.028 -3.830 96 HD13 LEU 12 3HD1 LEU 12 -14.013 -7.004 -2.597 97 HD21 LEU 12 3HD2 LEU 12 -13.770 -3.196 -1.967 98 HD22 LEU 12 1HD2 LEU 12 -15.050 -4.374 -1.680 99 HD23 LEU 12 2HD2 LEU 12 -14.333 -4.225 -3.284 100 H LYS 13 H LYS 13 -12.417 -6.002 2.652 101 HA LYS 13 HA LYS 13 -14.777 -6.938 3.741 102 HB2 LYS 13 1HB LYS 13 -12.044 -6.441 4.825 103 HB3 LYS 13 2HB LYS 13 -13.332 -6.803 5.966 104 HG2 LYS 13 1HG LYS 13 -13.663 -8.735 4.045 105 HG3 LYS 13 2HG LYS 13 -11.909 -8.556 4.133 106 HD2 LYS 13 1HD LYS 13 -12.374 -10.177 5.743 107 HD3 LYS 13 2HD LYS 13 -12.239 -8.690 6.684 108 HE2 LYS 13 1HE LYS 13 -14.631 -8.482 6.795 109 HE3 LYS 13 2HE LYS 13 -14.843 -9.843 5.695 110 HZ1 LYS 13 3HZ LYS 13 -13.343 -10.895 7.684 111 HZ2 LYS 13 1HZ LYS 13 -15.023 -11.044 7.548 112 HZ3 LYS 13 2HZ LYS 13 -14.358 -9.837 8.528 113 H LYS 14 H LYS 14 -13.311 -3.795 4.029 114 HA LYS 14 HA LYS 14 -14.603 -2.832 6.308 115 HB2 LYS 14 1HB LYS 14 -13.742 -1.369 3.807 116 HB3 LYS 14 2HB LYS 14 -14.261 -0.574 5.287 117 HG2 LYS 14 1HG LYS 14 -11.859 -2.357 4.952 118 HG3 LYS 14 2HG LYS 14 -11.858 -0.607 5.178 119 HD2 LYS 14 1HD LYS 14 -12.821 -2.667 7.163 120 HD3 LYS 14 2HD LYS 14 -11.326 -1.734 7.266 121 HE2 LYS 14 1HE LYS 14 -14.148 -0.681 7.395 122 HE3 LYS 14 2HE LYS 14 -12.971 -0.734 8.706 123 HZ1 LYS 14 3HZ LYS 14 -11.592 0.828 7.484 124 HZ2 LYS 14 1HZ LYS 14 -13.132 1.476 7.748 125 HZ3 LYS 14 2HZ LYS 14 -12.718 0.876 6.223 126 H SER 15 H SER 15 -15.762 -3.307 3.057 127 HA SER 15 HA SER 15 -18.326 -2.059 3.790 128 HB2 SER 15 1HB SER 15 -17.742 -0.960 1.848 129 HB3 SER 15 2HB SER 15 -16.864 -2.346 1.201 130 HG SER 15 HG SER 15 -19.670 -1.965 1.319 131 H PHE 16 H PHE 16 -16.975 -4.827 2.003 132 HA PHE 16 HA PHE 16 -19.452 -6.307 2.597 133 HB2 PHE 16 1HB PHE 16 -17.470 -7.015 0.437 134 HB3 PHE 16 2HB PHE 16 -19.127 -7.583 0.621 135 HD1 PHE 16 HD2 PHE 16 -21.012 -6.083 0.111 136 HD2 PHE 16 HD1 PHE 16 -16.977 -4.955 -0.635 137 HE1 PHE 16 HE2 PHE 16 -21.793 -4.285 -1.376 138 HE2 PHE 16 HE1 PHE 16 -17.751 -3.155 -2.123 139 HZ PHE 16 HZ PHE 16 -20.162 -2.819 -2.496 140 HA PRO 17 HA PRO 17 -16.121 -8.270 5.141 141 HB2 PRO 17 1HB PRO 17 -17.698 -8.646 7.318 142 HB3 PRO 17 2HB PRO 17 -16.821 -7.141 7.015 143 HG2 PRO 17 1HG PRO 17 -19.696 -7.796 6.496 144 HG3 PRO 17 2HG PRO 17 -18.991 -6.320 7.180 145 HD2 PRO 17 1HD PRO 17 -19.775 -6.496 4.595 146 HD3 PRO 17 2HD PRO 17 -18.408 -5.488 5.111 147 H SER 18 H SER 18 -19.573 -9.183 5.185 148 HA SER 18 HA SER 18 -19.105 -11.932 5.630 149 HB2 SER 18 1HB SER 18 -21.550 -10.891 4.221 150 HB3 SER 18 2HB SER 18 -21.418 -12.229 5.361 151 HG SER 18 HG SER 18 -21.749 -9.544 5.829 152 H SER 19 H SER 19 -18.996 -9.976 2.797 153 HA SER 19 HA SER 19 -19.523 -11.888 0.817 154 HB2 SER 19 1HB SER 19 -18.057 -9.289 0.906 155 HB3 SER 19 2HB SER 19 -17.828 -10.323 -0.504 156 HG SER 19 HG SER 19 -20.337 -9.453 0.504 157 H VAL 20 H VAL 20 -17.784 -12.624 -0.784 158 HA VAL 20 HA VAL 20 -15.559 -13.795 0.753 159 HB VAL 20 HB VAL 20 -16.887 -14.851 -1.748 160 HG11 VAL 20 1HG1 VAL 20 -14.540 -15.801 -0.137 161 HG12 VAL 20 2HG1 VAL 20 -15.495 -16.910 -1.124 162 HG13 VAL 20 3HG1 VAL 20 -14.659 -15.551 -1.879 163 HG21 VAL 20 3HG2 VAL 20 -17.272 -15.360 1.141 164 HG22 VAL 20 1HG2 VAL 20 -18.423 -15.451 -0.192 165 HG23 VAL 20 2HG2 VAL 20 -17.279 -16.766 0.077 166 H ILE 21 H ILE 21 -13.970 -12.288 0.425 167 HA ILE 21 HA ILE 21 -13.412 -11.280 -2.230 168 HB ILE 21 HB ILE 21 -11.912 -10.875 0.360 169 HG12 ILE 21 1HG1 ILE 21 -13.369 -8.639 -0.890 170 HG13 ILE 21 2HG1 ILE 21 -14.394 -9.931 -0.275 171 HG21 ILE 21 1HG2 ILE 21 -10.297 -9.943 -0.841 172 HG22 ILE 21 2HG2 ILE 21 -11.165 -10.324 -2.327 173 HG23 ILE 21 3HG2 ILE 21 -11.456 -8.792 -1.504 174 HD11 ILE 21 3HD1 ILE 21 -12.480 -8.185 1.226 175 HD12 ILE 21 1HD1 ILE 21 -14.209 -8.416 1.486 176 HD13 ILE 21 2HD1 ILE 21 -13.076 -9.705 1.893 177 H LYS 22 H LYS 22 -12.010 -12.113 -3.631 178 HA LYS 22 HA LYS 22 -9.754 -13.698 -2.715 179 HB2 LYS 22 1HB LYS 22 -11.722 -15.264 -3.025 180 HB3 LYS 22 2HB LYS 22 -11.668 -14.864 -4.737 181 HG2 LYS 22 1HG LYS 22 -9.604 -15.908 -5.039 182 HG3 LYS 22 2HG LYS 22 -9.253 -15.917 -3.309 183 HD2 LYS 22 1HD LYS 22 -11.559 -17.448 -4.483 184 HD3 LYS 22 2HD LYS 22 -9.937 -18.134 -4.370 185 HE2 LYS 22 1HE LYS 22 -11.283 -16.936 -1.974 186 HE3 LYS 22 2HE LYS 22 -11.618 -18.595 -2.467 187 HZ1 LYS 22 3HZ LYS 22 -9.777 -19.219 -1.439 188 HZ2 LYS 22 1HZ LYS 22 -9.431 -17.621 -1.006 189 HZ3 LYS 22 2HZ LYS 22 -8.849 -18.246 -2.466 190 H ILE 23 H ILE 23 -8.150 -14.036 -4.353 191 HA ILE 23 HA ILE 23 -8.385 -12.116 -6.575 192 HB ILE 23 HB ILE 23 -5.825 -13.138 -5.348 193 HG12 ILE 23 1HG1 ILE 23 -5.887 -10.563 -4.597 194 HG13 ILE 23 2HG1 ILE 23 -7.617 -10.888 -4.598 195 HG21 ILE 23 1HG2 ILE 23 -6.452 -10.953 -7.321 196 HG22 ILE 23 2HG2 ILE 23 -4.895 -11.114 -6.509 197 HG23 ILE 23 3HG2 ILE 23 -5.468 -12.394 -7.577 198 HD11 ILE 23 3HD1 ILE 23 -5.510 -11.839 -2.786 199 HD12 ILE 23 1HD1 ILE 23 -7.213 -11.505 -2.479 200 HD13 ILE 23 2HD1 ILE 23 -6.735 -13.027 -3.231 201 H THR 24 H THR 24 -7.596 -12.686 -8.621 202 HA THR 24 HA THR 24 -7.105 -15.565 -9.021 203 HB THR 24 HB THR 24 -8.551 -13.828 -11.018 204 HG1 THR 24 HG1 THR 24 -9.745 -14.021 -9.017 205 HG21 THR 24 3HG2 THR 24 -9.357 -16.100 -11.776 206 HG22 THR 24 1HG2 THR 24 -8.163 -16.799 -10.683 207 HG23 THR 24 2HG2 THR 24 -7.641 -15.781 -12.025 208 H ASP 25 H ASP 25 -5.494 -16.131 -10.407 209 HA ASP 25 HA ASP 25 -3.719 -13.991 -11.272 210 HB2 ASP 25 1HB ASP 25 -2.171 -15.902 -11.824 211 HB3 ASP 25 2HB ASP 25 -2.628 -15.783 -10.127 212 H LEU 26 H LEU 26 -4.817 -13.128 -13.041 213 HA LEU 26 HA LEU 26 -4.856 -14.867 -15.417 214 HB2 LEU 26 1HB LEU 26 -6.900 -12.902 -14.454 215 HB3 LEU 26 2HB LEU 26 -6.754 -13.275 -16.170 216 HG LEU 26 HG LEU 26 -7.214 -15.402 -14.094 217 HD11 LEU 26 1HD1 LEU 26 -9.165 -13.582 -15.440 218 HD12 LEU 26 2HD1 LEU 26 -9.114 -14.130 -13.765 219 HD13 LEU 26 3HD1 LEU 26 -9.622 -15.238 -15.040 220 HD21 LEU 26 3HD2 LEU 26 -8.333 -15.828 -16.710 221 HD22 LEU 26 1HD2 LEU 26 -7.168 -16.804 -15.815 222 HD23 LEU 26 2HD2 LEU 26 -6.610 -15.469 -16.824 223 H VAL 27 H VAL 27 -2.807 -13.025 -14.393 224 HA VAL 27 HA VAL 27 -2.548 -11.389 -16.809 225 HB VAL 27 HB VAL 27 -1.863 -10.256 -14.103 226 HG11 VAL 27 1HG1 VAL 27 -1.665 -9.365 -16.895 227 HG12 VAL 27 2HG1 VAL 27 -2.311 -8.167 -15.771 228 HG13 VAL 27 3HG1 VAL 27 -0.727 -8.888 -15.480 229 HG21 VAL 27 3HG2 VAL 27 -4.272 -10.649 -14.177 230 HG22 VAL 27 1HG2 VAL 27 -3.910 -8.925 -14.247 231 HG23 VAL 27 2HG2 VAL 27 -4.372 -9.789 -15.713 232 H GLY 28 H GLY 28 -0.356 -10.761 -17.289 233 HA2 GLY 28 1HA GLY 28 1.543 -12.782 -16.387 234 HA3 GLY 28 2HA GLY 28 1.755 -11.684 -17.744 235 H ASP 29 H ASP 29 0.954 -10.964 -14.364 236 HA ASP 29 HA ASP 29 1.907 -9.533 -12.869 237 HB2 ASP 29 1HB ASP 29 3.614 -11.481 -13.118 238 HB3 ASP 29 2HB ASP 29 4.593 -10.294 -13.976 239 H GLN 30 H GLN 30 1.155 -7.608 -13.799 240 HA GLN 30 HA GLN 30 3.245 -5.851 -14.714 241 HB2 GLN 30 1HB GLN 30 1.916 -5.134 -16.741 242 HB3 GLN 30 2HB GLN 30 2.696 -6.706 -16.859 243 HG2 GLN 30 1HG GLN 30 0.757 -7.639 -17.345 244 HG3 GLN 30 2HG GLN 30 0.103 -7.106 -15.797 245 HE21 GLN 30 2HE2 GLN 30 -1.493 -5.676 -15.813 246 HE22 GLN 30 1HE2 GLN 30 -2.007 -4.758 -17.183 247 H ASP 31 H ASP 31 1.839 -5.765 -12.383 248 HA ASP 31 HA ASP 31 0.699 -4.324 -11.041 249 HB2 ASP 31 1HB ASP 31 0.418 -2.393 -13.324 250 HB3 ASP 31 2HB ASP 31 0.642 -2.057 -11.610 251 H HIS 32 H HIS 32 -0.852 -6.261 -11.856 252 HA HIS 32 HA HIS 32 -3.452 -5.050 -12.005 253 HB2 HIS 32 1HB HIS 32 -2.713 -5.177 -14.411 254 HB3 HIS 32 2HB HIS 32 -2.677 -6.930 -14.241 255 HD1 HIS 32 HD1 HIS 32 -5.357 -4.556 -12.983 256 HD2 HIS 32 HD2 HIS 32 -4.853 -7.655 -15.705 257 HE1 HIS 32 HE1 HIS 32 -7.656 -5.048 -13.875 258 H TYR 33 H TYR 33 -5.173 -6.570 -11.621 259 HA TYR 33 HA TYR 33 -4.550 -9.319 -11.055 260 HB2 TYR 33 1HB TYR 33 -4.796 -7.306 -8.868 261 HB3 TYR 33 2HB TYR 33 -5.504 -8.897 -8.613 262 HD1 TYR 33 HD1 TYR 33 -3.802 -10.867 -9.455 263 HD2 TYR 33 HD2 TYR 33 -2.685 -7.026 -8.005 264 HE1 TYR 33 HE1 TYR 33 -1.595 -11.753 -8.827 265 HE2 TYR 33 HE2 TYR 33 -0.474 -7.901 -7.374 266 HH TYR 33 HH TYR 33 0.229 -11.228 -7.287 267 H ALA 34 H ALA 34 -6.410 -10.589 -10.626 268 HA ALA 34 HA ALA 34 -8.891 -9.302 -11.514 269 HB1 ALA 34 1HB ALA 34 -7.718 -11.972 -11.834 270 HB2 ALA 34 2HB ALA 34 -9.452 -11.958 -11.509 271 HB3 ALA 34 3HB ALA 34 -8.806 -11.072 -12.891 272 H LEU 35 H LEU 35 -9.865 -8.468 -9.735 273 HA LEU 35 HA LEU 35 -9.986 -9.962 -7.260 274 HB2 LEU 35 1HB LEU 35 -10.021 -7.291 -7.884 275 HB3 LEU 35 2HB LEU 35 -11.709 -7.615 -7.499 276 HG LEU 35 HG LEU 35 -9.313 -7.948 -5.705 277 HD11 LEU 35 1HD1 LEU 35 -10.583 -6.373 -4.286 278 HD12 LEU 35 2HD1 LEU 35 -11.783 -6.227 -5.569 279 HD13 LEU 35 3HD1 LEU 35 -10.127 -5.686 -5.845 280 HD21 LEU 35 3HD2 LEU 35 -10.588 -9.823 -5.162 281 HD22 LEU 35 1HD2 LEU 35 -12.114 -8.981 -5.431 282 HD23 LEU 35 2HD2 LEU 35 -11.134 -8.597 -4.016 283 H GLU 36 H GLU 36 -11.763 -10.944 -6.385 284 HA GLU 36 HA GLU 36 -14.268 -10.890 -7.905 285 HB2 GLU 36 1HB GLU 36 -14.420 -13.409 -7.505 286 HB3 GLU 36 2HB GLU 36 -13.322 -12.864 -8.765 287 HG2 GLU 36 1HG GLU 36 -11.434 -13.350 -7.510 288 HG3 GLU 36 2HG GLU 36 -12.327 -13.358 -5.990 289 H ILE 37 H ILE 37 -15.822 -10.307 -6.556 290 HA ILE 37 HA ILE 37 -15.656 -11.192 -3.749 291 HB ILE 37 HB ILE 37 -15.394 -8.763 -3.955 292 HG12 ILE 37 1HG1 ILE 37 -18.097 -9.497 -2.814 293 HG13 ILE 37 2HG1 ILE 37 -16.562 -9.769 -1.997 294 HG21 ILE 37 1HG2 ILE 37 -18.150 -8.221 -4.744 295 HG22 ILE 37 2HG2 ILE 37 -16.649 -7.458 -5.266 296 HG23 ILE 37 3HG2 ILE 37 -17.183 -8.961 -6.020 297 HD11 ILE 37 3HD1 ILE 37 -16.956 -7.018 -2.889 298 HD12 ILE 37 1HD1 ILE 37 -18.138 -7.573 -1.703 299 HD13 ILE 37 2HD1 ILE 37 -16.415 -7.646 -1.332 300 H SER 38 H SER 38 -17.491 -11.981 -2.765 301 HA SER 38 HA SER 38 -19.784 -12.473 -4.551 302 HB2 SER 38 1HB SER 38 -19.102 -14.235 -2.211 303 HB3 SER 38 2HB SER 38 -20.068 -14.615 -3.637 304 HG SER 38 HG SER 38 -17.339 -13.969 -3.886 305 H ASP 39 H ASP 39 -21.180 -10.892 -3.971 306 HA ASP 39 HA ASP 39 -21.991 -10.813 -1.140 307 HB2 ASP 39 1HB ASP 39 -22.206 -8.489 -1.173 308 HB3 ASP 39 2HB ASP 39 -20.734 -8.758 -2.103 309 H ALA 40 H ALA 40 -24.246 -9.769 -0.934 310 HA ALA 40 HA ALA 40 -25.978 -10.725 -3.117 311 HB1 ALA 40 1HB ALA 40 -27.465 -11.751 -1.634 312 HB2 ALA 40 2HB ALA 40 -25.870 -12.216 -1.039 313 HB3 ALA 40 3HB ALA 40 -26.773 -10.934 -0.232 314 H GLN 41 H GLN 41 -24.914 -8.032 -2.009 315 HA GLN 41 HA GLN 41 -27.502 -6.715 -1.577 316 HB2 GLN 41 1HB GLN 41 -24.713 -5.632 -1.148 317 HB3 GLN 41 2HB GLN 41 -26.215 -4.813 -0.740 318 HG2 GLN 41 1HG GLN 41 -26.590 -6.108 1.095 319 HG3 GLN 41 2HG GLN 41 -25.724 -7.493 0.433 320 HE21 GLN 41 2HE2 GLN 41 -23.565 -7.708 0.800 321 HE22 GLN 41 1HE2 GLN 41 -22.663 -6.665 1.841 322 H PHE 42 H PHE 42 -24.951 -7.095 -3.842 323 HA PHE 42 HA PHE 42 -25.111 -4.716 -5.290 324 HB2 PHE 42 1HB PHE 42 -23.933 -5.816 -6.995 325 HB3 PHE 42 2HB PHE 42 -23.455 -6.676 -5.536 326 HD1 PHE 42 HD2 PHE 42 -25.343 -8.623 -4.974 327 HD2 PHE 42 HD1 PHE 42 -24.190 -7.179 -8.808 328 HE1 PHE 42 HE2 PHE 42 -26.066 -10.745 -5.987 329 HE2 PHE 42 HE1 PHE 42 -24.912 -9.299 -9.827 330 HZ PHE 42 HZ PHE 42 -25.851 -11.086 -8.416 331 H ASN 43 H ASN 43 -27.330 -7.328 -5.041 332 HA ASN 43 HA ASN 43 -28.670 -7.299 -7.448 333 HB2 ASN 43 1HB ASN 43 -29.433 -7.906 -4.641 334 HB3 ASN 43 2HB ASN 43 -30.750 -7.661 -5.786 335 HD21 ASN 43 2HD2 ASN 43 -28.528 -9.838 -4.548 336 HD22 ASN 43 1HD2 ASN 43 -28.729 -11.101 -5.709 337 H GLY 44 H GLY 44 -29.304 -5.553 -8.542 338 HA2 GLY 44 1HA GLY 44 -31.173 -3.962 -8.712 339 HA3 GLY 44 2HA GLY 44 -30.804 -3.481 -7.063 340 H LEU 45 H LEU 45 -27.848 -3.844 -8.079 341 HA LEU 45 HA LEU 45 -27.596 -1.047 -8.879 342 HB2 LEU 45 1HB LEU 45 -25.621 -3.089 -7.893 343 HB3 LEU 45 2HB LEU 45 -25.134 -1.509 -8.505 344 HG LEU 45 HG LEU 45 -26.928 -1.963 -6.121 345 HD11 LEU 45 1HD1 LEU 45 -25.007 -1.261 -4.790 346 HD12 LEU 45 2HD1 LEU 45 -24.015 -1.196 -6.246 347 HD13 LEU 45 3HD1 LEU 45 -24.660 -2.740 -5.687 348 HD21 LEU 45 3HD2 LEU 45 -27.436 0.139 -7.098 349 HD22 LEU 45 1HD2 LEU 45 -25.730 0.506 -7.360 350 HD23 LEU 45 2HD2 LEU 45 -26.381 0.461 -5.721 351 H SER 46 H SER 46 -25.666 -0.645 -10.430 352 HA SER 46 HA SER 46 -26.070 -2.388 -12.764 353 HB2 SER 46 1HB SER 46 -26.710 0.026 -12.980 354 HB3 SER 46 2HB SER 46 -25.018 0.450 -12.727 355 HG SER 46 HG SER 46 -25.091 0.304 -14.862 356 H LEU 47 H LEU 47 -24.158 -2.484 -14.278 357 HA LEU 47 HA LEU 47 -21.994 -3.710 -13.042 358 HB2 LEU 47 1HB LEU 47 -22.448 -2.570 -15.764 359 HB3 LEU 47 2HB LEU 47 -20.841 -3.140 -15.317 360 HG LEU 47 HG LEU 47 -22.031 -4.847 -16.553 361 HD11 LEU 47 1HD1 LEU 47 -21.129 -6.452 -15.303 362 HD12 LEU 47 2HD1 LEU 47 -22.236 -6.143 -13.966 363 HD13 LEU 47 3HD1 LEU 47 -20.760 -5.192 -14.126 364 HD21 LEU 47 3HD2 LEU 47 -24.311 -3.992 -15.765 365 HD22 LEU 47 1HD2 LEU 47 -24.053 -5.001 -14.341 366 HD23 LEU 47 2HD2 LEU 47 -24.107 -5.736 -15.944 367 H ILE 48 H ILE 48 -22.599 -0.358 -13.660 368 HA ILE 48 HA ILE 48 -19.857 0.464 -13.291 369 HB ILE 48 HB ILE 48 -22.378 2.128 -13.352 370 HG12 ILE 48 1HG1 ILE 48 -21.982 0.920 -15.455 371 HG13 ILE 48 2HG1 ILE 48 -21.729 2.650 -15.659 372 HG21 ILE 48 1HG2 ILE 48 -20.121 3.608 -14.153 373 HG22 ILE 48 2HG2 ILE 48 -21.105 3.826 -12.707 374 HG23 ILE 48 3HG2 ILE 48 -19.684 2.783 -12.657 375 HD11 ILE 48 3HD1 ILE 48 -20.022 1.450 -16.833 376 HD12 ILE 48 1HD1 ILE 48 -19.298 2.273 -15.451 377 HD13 ILE 48 2HD1 ILE 48 -19.608 0.538 -15.381 378 H ASN 49 H ASN 49 -22.850 0.507 -11.399 379 HA ASN 49 HA ASN 49 -21.808 1.888 -9.170 380 HB2 ASN 49 1HB ASN 49 -24.127 -0.038 -9.406 381 HB3 ASN 49 2HB ASN 49 -23.772 0.897 -7.957 382 HD21 ASN 49 2HD2 ASN 49 -26.149 0.980 -9.550 383 HD22 ASN 49 1HD2 ASN 49 -26.301 2.593 -10.149 384 H GLN 50 H GLN 50 -21.960 -1.534 -10.005 385 HA GLN 50 HA GLN 50 -21.090 -2.538 -7.513 386 HB2 GLN 50 1HB GLN 50 -20.984 -3.677 -10.304 387 HB3 GLN 50 2HB GLN 50 -20.443 -4.572 -8.889 388 HG2 GLN 50 1HG GLN 50 -22.538 -4.967 -8.165 389 HG3 GLN 50 2HG GLN 50 -23.142 -3.407 -8.721 390 HE21 GLN 50 2HE2 GLN 50 -24.648 -3.618 -10.197 391 HE22 GLN 50 1HE2 GLN 50 -24.708 -4.819 -11.437 392 H HIS 51 H HIS 51 -19.365 -1.524 -10.420 393 HA HIS 51 HA HIS 51 -16.795 -2.304 -9.379 394 HB2 HIS 51 1HB HIS 51 -17.684 -1.976 -11.891 395 HB3 HIS 51 2HB HIS 51 -16.976 -0.383 -11.638 396 HD1 HIS 51 HD1 HIS 51 -14.372 -0.369 -11.024 397 HD2 HIS 51 HD2 HIS 51 -15.890 -3.969 -12.437 398 HE1 HIS 51 HE1 HIS 51 -12.365 -1.727 -11.697 399 H LYS 52 H LYS 52 -18.803 0.506 -9.305 400 HA LYS 52 HA LYS 52 -16.684 2.342 -8.640 401 HB2 LYS 52 1HB LYS 52 -19.625 2.487 -8.995 402 HB3 LYS 52 2HB LYS 52 -18.907 3.676 -7.916 403 HG2 LYS 52 1HG LYS 52 -17.260 4.105 -9.856 404 HG3 LYS 52 2HG LYS 52 -18.467 3.279 -10.846 405 HD2 LYS 52 1HD LYS 52 -20.142 4.922 -9.770 406 HD3 LYS 52 2HD LYS 52 -18.710 5.853 -9.325 407 HE2 LYS 52 1HE LYS 52 -18.994 4.933 -12.142 408 HE3 LYS 52 2HE LYS 52 -19.988 6.282 -11.595 409 HZ1 LYS 52 3HZ LYS 52 -17.030 6.116 -11.631 410 HZ2 LYS 52 1HZ LYS 52 -17.872 7.327 -10.803 411 HZ3 LYS 52 2HZ LYS 52 -18.018 7.193 -12.483 412 H LEU 53 H LEU 53 -19.304 0.709 -6.891 413 HA LEU 53 HA LEU 53 -18.998 1.826 -4.391 414 HB2 LEU 53 1HB LEU 53 -19.913 -0.815 -5.388 415 HB3 LEU 53 2HB LEU 53 -19.602 -0.656 -3.661 416 HG LEU 53 HG LEU 53 -21.545 1.017 -5.254 417 HD11 LEU 53 1HD1 LEU 53 -22.240 -1.332 -4.994 418 HD12 LEU 53 2HD1 LEU 53 -23.276 -0.216 -4.106 419 HD13 LEU 53 3HD1 LEU 53 -22.068 -1.170 -3.246 420 HD21 LEU 53 3HD2 LEU 53 -22.289 1.531 -2.820 421 HD22 LEU 53 1HD2 LEU 53 -20.913 2.392 -3.508 422 HD23 LEU 53 2HD2 LEU 53 -20.646 1.044 -2.403 423 H VAL 54 H VAL 54 -17.364 -1.087 -5.635 424 HA VAL 54 HA VAL 54 -15.786 -1.633 -3.415 425 HB VAL 54 HB VAL 54 -14.228 -2.762 -4.999 426 HG11 VAL 54 1HG1 VAL 54 -16.874 -3.392 -4.367 427 HG12 VAL 54 2HG1 VAL 54 -16.701 -3.764 -6.083 428 HG13 VAL 54 3HG1 VAL 54 -15.612 -4.499 -4.906 429 HG21 VAL 54 3HG2 VAL 54 -16.055 -1.537 -7.059 430 HG22 VAL 54 1HG2 VAL 54 -14.318 -1.290 -6.881 431 HG23 VAL 54 2HG2 VAL 54 -14.937 -2.859 -7.393 432 H LYS 55 H LYS 55 -15.351 0.721 -5.966 433 HA LYS 55 HA LYS 55 -12.642 1.358 -5.223 434 HB2 LYS 55 1HB LYS 55 -14.590 2.784 -7.044 435 HB3 LYS 55 2HB LYS 55 -12.894 3.209 -6.856 436 HG2 LYS 55 1HG LYS 55 -13.689 0.448 -7.688 437 HG3 LYS 55 2HG LYS 55 -13.608 1.763 -8.863 438 HD2 LYS 55 1HD LYS 55 -11.478 0.917 -9.020 439 HD3 LYS 55 2HD LYS 55 -11.246 2.157 -7.785 440 HE2 LYS 55 1HE LYS 55 -10.960 0.634 -6.116 441 HE3 LYS 55 2HE LYS 55 -12.030 -0.550 -6.865 442 HZ1 LYS 55 3HZ LYS 55 -9.513 0.040 -8.225 443 HZ2 LYS 55 1HZ LYS 55 -10.359 -1.420 -8.100 444 HZ3 LYS 55 2HZ LYS 55 -9.429 -0.867 -6.800 445 H ASN 56 H ASN 56 -15.835 2.475 -4.421 446 HA ASN 56 HA ASN 56 -14.949 4.943 -3.232 447 HB2 ASN 56 1HB ASN 56 -17.602 3.495 -3.099 448 HB3 ASN 56 2HB ASN 56 -17.303 5.093 -2.422 449 HD21 ASN 56 2HD2 ASN 56 -18.781 3.699 -4.851 450 HD22 ASN 56 1HD2 ASN 56 -18.540 4.855 -6.112 451 H ALA 57 H ALA 57 -15.829 1.719 -2.113 452 HA ALA 57 HA ALA 57 -15.847 2.257 0.648 453 HB1 ALA 57 1HB ALA 57 -16.485 0.110 -0.827 454 HB2 ALA 57 2HB ALA 57 -14.912 -0.407 -0.218 455 HB3 ALA 57 3HB ALA 57 -16.192 0.039 0.911 456 H LEU 58 H LEU 58 -13.281 2.134 -1.583 457 HA LEU 58 HA LEU 58 -11.320 1.852 0.598 458 HB2 LEU 58 1HB LEU 58 -9.694 1.301 -1.202 459 HB3 LEU 58 2HB LEU 58 -10.995 0.127 -1.007 460 HG LEU 58 HG LEU 58 -12.111 1.418 -2.965 461 HD11 LEU 58 1HD1 LEU 58 -10.768 3.299 -3.236 462 HD12 LEU 58 2HD1 LEU 58 -10.248 2.227 -4.535 463 HD13 LEU 58 3HD1 LEU 58 -9.274 2.376 -3.072 464 HD21 LEU 58 3HD2 LEU 58 -10.845 -0.909 -2.822 465 HD22 LEU 58 1HD2 LEU 58 -9.713 -0.070 -3.883 466 HD23 LEU 58 2HD2 LEU 58 -11.404 -0.240 -4.356 467 H SER 59 H SER 59 -12.728 4.015 -1.568 468 HA SER 59 HA SER 59 -10.443 5.753 -1.868 469 HB2 SER 59 1HB SER 59 -12.075 5.685 -3.662 470 HB3 SER 59 2HB SER 59 -13.367 6.139 -2.551 471 HG SER 59 HG SER 59 -12.735 8.160 -2.626 472 H GLU 60 H GLU 60 -13.077 5.359 0.339 473 HA GLU 60 HA GLU 60 -12.665 7.996 1.519 474 HB2 GLU 60 1HB GLU 60 -14.556 5.894 2.545 475 HB3 GLU 60 2HB GLU 60 -14.644 7.638 2.747 476 HG2 GLU 60 1HG GLU 60 -14.731 7.294 0.010 477 HG3 GLU 60 2HG GLU 60 -15.691 5.954 0.635 478 H ILE 61 H ILE 61 -12.285 4.575 2.303 479 HA ILE 61 HA ILE 61 -11.344 5.068 4.967 480 HB ILE 61 HB ILE 61 -10.945 2.538 3.380 481 HG12 ILE 61 1HG1 ILE 61 -13.296 3.101 3.227 482 HG13 ILE 61 2HG1 ILE 61 -13.098 1.781 4.374 483 HG21 ILE 61 1HG2 ILE 61 -9.728 2.779 5.520 484 HG22 ILE 61 2HG2 ILE 61 -11.273 2.991 6.342 485 HG23 ILE 61 3HG2 ILE 61 -10.904 1.465 5.539 486 HD11 ILE 61 3HD1 ILE 61 -12.944 4.078 5.920 487 HD12 ILE 61 1HD1 ILE 61 -14.228 4.403 4.756 488 HD13 ILE 61 2HD1 ILE 61 -14.312 2.974 5.788 489 H LEU 62 H LEU 62 -9.911 4.852 1.820 490 HA LEU 62 HA LEU 62 -7.779 5.078 1.063 491 HB2 LEU 62 1HB LEU 62 -7.675 6.488 3.700 492 HB3 LEU 62 2HB LEU 62 -6.215 6.303 2.730 493 HG LEU 62 HG LEU 62 -7.178 8.485 2.364 494 HD11 LEU 62 1HD1 LEU 62 -7.137 8.506 0.029 495 HD12 LEU 62 2HD1 LEU 62 -7.831 6.890 -0.090 496 HD13 LEU 62 3HD1 LEU 62 -6.171 7.097 0.467 497 HD21 LEU 62 3HD2 LEU 62 -9.492 7.939 2.965 498 HD22 LEU 62 1HD2 LEU 62 -9.663 7.033 1.462 499 HD23 LEU 62 2HD2 LEU 62 -9.396 8.776 1.415 500 H ASN 63 H ASN 63 -8.439 2.595 2.226 501 HA ASN 63 HA ASN 63 -6.080 1.801 3.753 502 HB2 ASN 63 1HB ASN 63 -7.306 -0.442 3.811 503 HB3 ASN 63 2HB ASN 63 -8.064 0.896 4.669 504 HD21 ASN 63 2HD2 ASN 63 -9.986 -0.433 4.477 505 HD22 ASN 63 1HD2 ASN 63 -10.926 -0.348 3.030 506 H LYS 64 H LYS 64 -5.635 2.584 1.077 507 HA LYS 64 HA LYS 64 -4.187 0.315 0.137 508 HB2 LYS 64 1HB LYS 64 -6.854 0.756 -0.901 509 HB3 LYS 64 2HB LYS 64 -5.653 0.885 -2.180 510 HG2 LYS 64 1HG LYS 64 -5.513 -1.428 -0.313 511 HG3 LYS 64 2HG LYS 64 -6.746 -1.416 -1.576 512 HD2 LYS 64 1HD LYS 64 -5.106 -2.367 -2.804 513 HD3 LYS 64 2HD LYS 64 -4.585 -0.694 -3.017 514 HE2 LYS 64 1HE LYS 64 -2.785 -0.940 -1.657 515 HE3 LYS 64 2HE LYS 64 -3.604 -2.091 -0.602 516 HZ1 LYS 64 3HZ LYS 64 -3.387 -3.704 -2.524 517 HZ2 LYS 64 1HZ LYS 64 -1.961 -3.314 -1.701 518 HZ3 LYS 64 2HZ LYS 64 -2.291 -2.608 -3.202 519 H LYS 65 H LYS 65 -3.318 0.863 -2.202 520 HA LYS 65 HA LYS 65 -2.436 3.667 -2.095 521 HB2 LYS 65 1HB LYS 65 -1.131 1.254 -3.366 522 HB3 LYS 65 2HB LYS 65 -0.501 2.894 -3.451 523 HG2 LYS 65 1HG LYS 65 -0.138 2.943 -1.084 524 HG3 LYS 65 2HG LYS 65 -0.945 1.387 -0.884 525 HD2 LYS 65 1HD LYS 65 1.330 0.856 -0.824 526 HD3 LYS 65 2HD LYS 65 0.849 0.476 -2.479 527 HE2 LYS 65 1HE LYS 65 1.815 2.489 -3.304 528 HE3 LYS 65 2HE LYS 65 2.062 3.111 -1.673 529 HZ1 LYS 65 3HZ LYS 65 4.144 2.346 -2.324 530 HZ2 LYS 65 1HZ LYS 65 3.526 0.952 -3.059 531 HZ3 LYS 65 2HZ LYS 65 3.549 1.080 -1.372 532 H LEU 66 H LEU 66 -2.001 4.719 -4.190 533 HA LEU 66 HA LEU 66 -4.255 4.682 -5.855 534 HB2 LEU 66 1HB LEU 66 -1.515 5.867 -6.131 535 HB3 LEU 66 2HB LEU 66 -2.705 6.011 -7.423 536 HG LEU 66 HG LEU 66 -4.220 7.035 -5.590 537 HD11 LEU 66 1HD1 LEU 66 -1.504 7.175 -4.315 538 HD12 LEU 66 2HD1 LEU 66 -3.013 6.581 -3.624 539 HD13 LEU 66 3HD1 LEU 66 -2.798 8.307 -3.918 540 HD21 LEU 66 3HD2 LEU 66 -3.164 9.268 -5.971 541 HD22 LEU 66 1HD2 LEU 66 -3.447 8.332 -7.438 542 HD23 LEU 66 2HD2 LEU 66 -1.823 8.436 -6.759 543 H HIS 67 H HIS 67 -4.707 2.717 -6.760 544 HA HIS 67 HA HIS 67 -2.971 1.905 -8.958 545 HB2 HIS 67 1HB HIS 67 -2.734 0.553 -6.624 546 HB3 HIS 67 2HB HIS 67 -4.043 -0.354 -7.377 547 HD1 HIS 67 HD1 HIS 67 -0.547 0.840 -8.292 548 HD2 HIS 67 HD2 HIS 67 -3.170 -2.290 -9.052 549 HE1 HIS 67 HE1 HIS 67 0.739 -0.783 -9.719 550 H SER 68 H SER 68 -4.170 -0.158 -10.019 551 HA SER 68 HA SER 68 -7.056 0.176 -10.002 552 HB2 SER 68 1HB SER 68 -7.219 0.619 -12.393 553 HB3 SER 68 2HB SER 68 -6.248 1.874 -11.622 554 HG SER 68 HG SER 68 -4.470 1.109 -12.567 555 H ILE 69 H ILE 69 -7.896 -1.791 -9.998 556 HA ILE 69 HA ILE 69 -6.610 -3.892 -11.603 557 HB ILE 69 HB ILE 69 -7.176 -5.532 -9.800 558 HG12 ILE 69 1HG1 ILE 69 -7.577 -3.019 -8.162 559 HG13 ILE 69 2HG1 ILE 69 -8.834 -4.166 -8.609 560 HG21 ILE 69 1HG2 ILE 69 -5.211 -3.356 -9.098 561 HG22 ILE 69 2HG2 ILE 69 -5.239 -4.970 -8.390 562 HG23 ILE 69 3HG2 ILE 69 -4.899 -4.767 -10.109 563 HD11 ILE 69 3HD1 ILE 69 -7.453 -5.903 -7.363 564 HD12 ILE 69 1HD1 ILE 69 -6.561 -4.536 -6.695 565 HD13 ILE 69 2HD1 ILE 69 -8.294 -4.687 -6.402 566 H SER 70 H SER 70 -8.102 -5.846 -11.802 567 HA SER 70 HA SER 70 -10.655 -4.895 -12.746 568 HB2 SER 70 1HB SER 70 -9.828 -6.468 -14.220 569 HB3 SER 70 2HB SER 70 -9.121 -7.453 -12.938 570 HG SER 70 HG SER 70 -11.715 -7.432 -13.951 571 H ILE 71 H ILE 71 -12.644 -5.299 -11.909 572 HA ILE 71 HA ILE 71 -12.764 -6.843 -9.402 573 HB ILE 71 HB ILE 71 -14.251 -4.285 -10.010 574 HG12 ILE 71 1HG1 ILE 71 -12.495 -4.515 -7.643 575 HG13 ILE 71 2HG1 ILE 71 -11.671 -4.496 -9.198 576 HG21 ILE 71 1HG2 ILE 71 -15.767 -5.102 -8.590 577 HG22 ILE 71 2HG2 ILE 71 -14.711 -6.422 -8.090 578 HG23 ILE 71 3HG2 ILE 71 -14.559 -4.836 -7.334 579 HD11 ILE 71 3HD1 ILE 71 -12.431 -2.301 -7.760 580 HD12 ILE 71 1HD1 ILE 71 -12.035 -2.320 -9.478 581 HD13 ILE 71 2HD1 ILE 71 -13.716 -2.441 -8.959 582 H LYS 72 H LYS 72 -13.806 -8.656 -9.952 583 HA LYS 72 HA LYS 72 -16.010 -8.575 -11.851 584 HB2 LYS 72 1HB LYS 72 -14.322 -10.367 -12.012 585 HB3 LYS 72 2HB LYS 72 -14.765 -10.919 -10.402 586 HG2 LYS 72 1HG LYS 72 -17.151 -11.119 -11.433 587 HG3 LYS 72 2HG LYS 72 -16.272 -11.143 -12.964 588 HD2 LYS 72 1HD LYS 72 -15.036 -13.078 -12.305 589 HD3 LYS 72 2HD LYS 72 -15.650 -12.977 -10.654 590 HE2 LYS 72 1HE LYS 72 -16.993 -14.625 -11.535 591 HE3 LYS 72 2HE LYS 72 -17.979 -13.190 -11.816 592 HZ1 LYS 72 3HZ LYS 72 -17.520 -13.209 -14.060 593 HZ2 LYS 72 1HZ LYS 72 -17.618 -14.864 -13.722 594 HZ3 LYS 72 2HZ LYS 72 -16.107 -14.123 -13.889 595 H THR 73 H THR 73 -18.114 -8.741 -11.339 596 HA THR 73 HA THR 73 -18.815 -8.746 -8.505 597 HB THR 73 HB THR 73 -20.905 -7.825 -9.101 598 HG1 THR 73 HG1 THR 73 -21.873 -8.376 -10.898 599 HG21 THR 73 3HG2 THR 73 -19.083 -6.230 -9.352 600 HG22 THR 73 1HG2 THR 73 -20.339 -5.912 -10.548 601 HG23 THR 73 2HG2 THR 73 -18.851 -6.729 -11.027 602 H ILE 74 H ILE 74 -19.502 -10.525 -7.530 603 HA ILE 74 HA ILE 74 -20.920 -12.557 -9.116 604 HB ILE 74 HB ILE 74 -18.910 -13.195 -6.956 605 HG12 ILE 74 1HG1 ILE 74 -17.835 -14.254 -9.184 606 HG13 ILE 74 2HG1 ILE 74 -18.644 -12.861 -9.894 607 HG21 ILE 74 1HG2 ILE 74 -19.201 -15.486 -8.253 608 HG22 ILE 74 2HG2 ILE 74 -20.278 -15.017 -6.938 609 HG23 ILE 74 3HG2 ILE 74 -20.783 -14.794 -8.612 610 HD11 ILE 74 3HD1 ILE 74 -16.257 -13.003 -8.215 611 HD12 ILE 74 1HD1 ILE 74 -16.745 -11.797 -9.405 612 HD13 ILE 74 2HD1 ILE 74 -17.394 -11.732 -7.766 613 H SER 75 H SER 75 -22.496 -13.753 -8.019 614 HA SER 75 HA SER 75 -23.348 -12.563 -5.464 615 HB2 SER 75 1HB SER 75 -25.521 -12.659 -6.149 616 HB3 SER 75 2HB SER 75 -24.781 -12.627 -7.750 617 HG SER 75 HG SER 75 -26.274 -14.326 -7.591 618 H ILE 76 H ILE 76 -24.041 -13.890 -3.784 619 HA ILE 76 HA ILE 76 -22.657 -16.226 -3.311 620 HB ILE 76 HB ILE 76 -24.481 -16.716 -1.594 621 HG12 ILE 76 1HG1 ILE 76 -25.432 -13.933 -2.206 622 HG13 ILE 76 2HG1 ILE 76 -26.156 -15.319 -3.014 623 HG21 ILE 76 1HG2 ILE 76 -22.331 -15.075 -1.536 624 HG22 ILE 76 2HG2 ILE 76 -23.614 -13.955 -1.079 625 HG23 ILE 76 3HG2 ILE 76 -23.350 -15.424 -0.139 626 HD11 ILE 76 3HD1 ILE 76 -26.015 -14.944 -0.033 627 HD12 ILE 76 1HD1 ILE 76 -27.417 -14.584 -1.039 628 HD13 ILE 76 2HD1 ILE 76 -26.836 -16.244 -0.896 629 HA PRO 77 HA PRO 77 -24.654 -19.482 -5.475 630 HB2 PRO 77 1HB PRO 77 -24.385 -21.537 -3.722 631 HB3 PRO 77 2HB PRO 77 -23.029 -20.877 -4.643 632 HG2 PRO 77 1HG PRO 77 -23.834 -20.340 -1.810 633 HG3 PRO 77 2HG PRO 77 -22.215 -20.615 -2.481 634 HD2 PRO 77 1HD PRO 77 -23.153 -18.141 -1.905 635 HD3 PRO 77 2HD PRO 77 -22.025 -18.447 -3.241 Start of MODEL 6 1 H1 MET 1 H MET 1 4.221 -5.011 -5.851 2 HA MET 1 HA MET 1 4.505 -5.538 -3.439 3 HB2 MET 1 1HB MET 1 6.191 -3.308 -4.577 4 HB3 MET 1 2HB MET 1 6.564 -4.120 -3.063 5 HG2 MET 1 1HG MET 1 6.213 -5.659 -5.606 6 HG3 MET 1 2HG MET 1 7.748 -4.899 -5.193 7 HE1 MET 1 3HE MET 1 9.291 -6.196 -4.871 8 HE2 MET 1 1HE MET 1 9.567 -6.650 -3.189 9 HE3 MET 1 2HE MET 1 9.235 -7.894 -4.394 10 H ALA 2 H ALA 2 2.164 -4.001 -3.437 11 HA ALA 2 HA ALA 2 2.648 -1.722 -1.693 12 HB1 ALA 2 1HB ALA 2 -0.089 -2.074 -1.846 13 HB2 ALA 2 2HB ALA 2 0.884 -0.988 -2.838 14 HB3 ALA 2 3HB ALA 2 0.494 -2.605 -3.424 15 H ILE 3 H ILE 3 0.609 -4.651 -1.565 16 HA ILE 3 HA ILE 3 1.357 -5.125 1.179 17 HB ILE 3 HB ILE 3 -0.460 -3.415 1.361 18 HG12 ILE 3 1HG1 ILE 3 -1.572 -5.953 2.470 19 HG13 ILE 3 2HG1 ILE 3 0.049 -5.474 2.960 20 HG21 ILE 3 1HG2 ILE 3 -1.666 -4.908 -0.627 21 HG22 ILE 3 2HG2 ILE 3 -2.614 -5.280 0.812 22 HG23 ILE 3 3HG2 ILE 3 -2.411 -3.605 0.299 23 HD11 ILE 3 3HD1 ILE 3 -1.117 -3.182 3.447 24 HD12 ILE 3 1HD1 ILE 3 -2.566 -4.184 3.529 25 HD13 ILE 3 2HD1 ILE 3 -1.205 -4.511 4.603 26 H SER 4 H SER 4 0.690 -7.177 1.953 27 HA SER 4 HA SER 4 0.725 -9.241 0.115 28 HB2 SER 4 1HB SER 4 -0.291 -9.159 2.957 29 HB3 SER 4 2HB SER 4 -0.191 -10.653 2.025 30 HG SER 4 HG SER 4 1.938 -10.607 2.146 31 H ALA 5 H ALA 5 -0.769 -10.397 -0.991 32 HA ALA 5 HA ALA 5 -3.222 -9.254 -1.663 33 HB1 ALA 5 1HB ALA 5 -2.500 -10.711 -3.269 34 HB2 ALA 5 2HB ALA 5 -1.974 -11.919 -2.096 35 HB3 ALA 5 3HB ALA 5 -3.690 -11.723 -2.450 36 H GLU 6 H GLU 6 -2.358 -11.383 0.941 37 HA GLU 6 HA GLU 6 -4.932 -12.385 1.539 38 HB2 GLU 6 1HB GLU 6 -4.005 -13.098 3.630 39 HB3 GLU 6 2HB GLU 6 -2.779 -13.327 2.392 40 HG2 GLU 6 1HG GLU 6 -1.871 -11.057 3.117 41 HG3 GLU 6 2HG GLU 6 -2.901 -11.238 4.535 42 H GLU 7 H GLU 7 -3.480 -9.320 2.009 43 HA GLU 7 HA GLU 7 -5.313 -8.546 4.132 44 HB2 GLU 7 1HB GLU 7 -2.852 -7.817 3.947 45 HB3 GLU 7 2HB GLU 7 -3.407 -6.714 2.695 46 HG2 GLU 7 1HG GLU 7 -3.224 -5.639 4.889 47 HG3 GLU 7 2HG GLU 7 -4.868 -5.604 4.254 48 H LEU 8 H LEU 8 -5.103 -8.445 0.718 49 HA LEU 8 HA LEU 8 -6.484 -6.164 0.018 50 HB2 LEU 8 1HB LEU 8 -5.534 -7.548 -1.668 51 HB3 LEU 8 2HB LEU 8 -6.532 -8.919 -1.189 52 HG LEU 8 HG LEU 8 -8.514 -7.801 -2.052 53 HD11 LEU 8 1HD1 LEU 8 -6.677 -5.607 -2.990 54 HD12 LEU 8 2HD1 LEU 8 -7.722 -5.487 -1.575 55 HD13 LEU 8 3HD1 LEU 8 -8.429 -5.695 -3.177 56 HD21 LEU 8 3HD2 LEU 8 -7.693 -9.106 -3.732 57 HD22 LEU 8 1HD2 LEU 8 -6.143 -8.266 -3.781 58 HD23 LEU 8 2HD2 LEU 8 -7.570 -7.527 -4.508 59 H GLU 9 H GLU 9 -7.686 -9.107 1.450 60 HA GLU 9 HA GLU 9 -10.446 -8.620 0.918 61 HB2 GLU 9 1HB GLU 9 -10.851 -10.398 2.581 62 HB3 GLU 9 2HB GLU 9 -9.668 -10.873 1.371 63 HG2 GLU 9 1HG GLU 9 -7.968 -9.981 3.170 64 HG3 GLU 9 2HG GLU 9 -9.307 -10.320 4.265 65 H LYS 10 H LYS 10 -8.320 -8.042 3.689 66 HA LYS 10 HA LYS 10 -10.174 -7.171 5.547 67 HB2 LYS 10 1HB LYS 10 -7.287 -6.652 5.069 68 HB3 LYS 10 2HB LYS 10 -8.122 -5.566 6.172 69 HG2 LYS 10 1HG LYS 10 -7.175 -7.267 7.498 70 HG3 LYS 10 2HG LYS 10 -8.905 -7.611 7.415 71 HD2 LYS 10 1HD LYS 10 -8.610 -9.472 6.116 72 HD3 LYS 10 2HD LYS 10 -7.128 -8.858 5.381 73 HE2 LYS 10 1HE LYS 10 -5.956 -9.230 7.524 74 HE3 LYS 10 2HE LYS 10 -7.436 -9.921 8.188 75 HZ1 LYS 10 3HZ LYS 10 -5.495 -11.097 6.414 76 HZ2 LYS 10 1HZ LYS 10 -7.095 -11.333 5.916 77 HZ3 LYS 10 2HZ LYS 10 -6.604 -11.842 7.453 78 H ILE 11 H ILE 11 -8.952 -5.553 2.721 79 HA ILE 11 HA ILE 11 -9.802 -2.927 3.451 80 HB ILE 11 HB ILE 11 -9.208 -4.065 0.717 81 HG12 ILE 11 1HG1 ILE 11 -7.359 -2.196 2.094 82 HG13 ILE 11 2HG1 ILE 11 -7.437 -3.836 2.730 83 HG21 ILE 11 1HG2 ILE 11 -10.182 -2.169 0.023 84 HG22 ILE 11 2HG2 ILE 11 -10.122 -1.438 1.626 85 HG23 ILE 11 3HG2 ILE 11 -8.701 -1.391 0.582 86 HD11 ILE 11 3HD1 ILE 11 -7.225 -4.227 0.020 87 HD12 ILE 11 1HD1 ILE 11 -6.191 -2.829 0.313 88 HD13 ILE 11 2HD1 ILE 11 -5.914 -4.332 1.194 89 H LEU 12 H LEU 12 -11.074 -5.256 1.063 90 HA LEU 12 HA LEU 12 -13.444 -3.811 0.551 91 HB2 LEU 12 1HB LEU 12 -12.537 -6.612 0.046 92 HB3 LEU 12 2HB LEU 12 -14.219 -6.172 -0.243 93 HG LEU 12 HG LEU 12 -11.820 -4.911 -1.572 94 HD11 LEU 12 1HD1 LEU 12 -13.233 -6.056 -3.552 95 HD12 LEU 12 2HD1 LEU 12 -13.545 -7.202 -2.249 96 HD13 LEU 12 3HD1 LEU 12 -11.887 -6.843 -2.729 97 HD21 LEU 12 3HD2 LEU 12 -13.169 -3.302 -2.292 98 HD22 LEU 12 1HD2 LEU 12 -14.410 -3.909 -1.196 99 HD23 LEU 12 2HD2 LEU 12 -14.350 -4.482 -2.863 100 H LYS 13 H LYS 13 -12.508 -5.845 3.137 101 HA LYS 13 HA LYS 13 -15.085 -6.752 3.929 102 HB2 LYS 13 1HB LYS 13 -12.388 -6.626 5.216 103 HB3 LYS 13 2HB LYS 13 -13.796 -6.961 6.216 104 HG2 LYS 13 1HG LYS 13 -14.111 -8.676 4.083 105 HG3 LYS 13 2HG LYS 13 -12.369 -8.684 4.368 106 HD2 LYS 13 1HD LYS 13 -13.283 -10.409 5.715 107 HD3 LYS 13 2HD LYS 13 -12.889 -9.078 6.806 108 HE2 LYS 13 1HE LYS 13 -15.182 -8.405 6.917 109 HE3 LYS 13 2HE LYS 13 -15.631 -9.539 5.644 110 HZ1 LYS 13 3HZ LYS 13 -15.971 -11.077 7.178 111 HZ2 LYS 13 1HZ LYS 13 -15.555 -9.984 8.400 112 HZ3 LYS 13 2HZ LYS 13 -14.366 -10.962 7.700 113 H LYS 14 H LYS 14 -13.425 -3.768 4.233 114 HA LYS 14 HA LYS 14 -14.434 -2.697 6.575 115 HB2 LYS 14 1HB LYS 14 -13.738 -1.444 3.930 116 HB3 LYS 14 2HB LYS 14 -14.320 -0.473 5.275 117 HG2 LYS 14 1HG LYS 14 -11.873 -2.228 5.313 118 HG3 LYS 14 2HG LYS 14 -11.883 -0.472 5.133 119 HD2 LYS 14 1HD LYS 14 -13.240 -0.541 7.365 120 HD3 LYS 14 2HD LYS 14 -12.513 -2.141 7.532 121 HE2 LYS 14 1HE LYS 14 -10.401 -1.304 7.784 122 HE3 LYS 14 2HE LYS 14 -10.737 0.132 6.817 123 HZ1 LYS 14 3HZ LYS 14 -10.432 0.496 9.271 124 HZ2 LYS 14 1HZ LYS 14 -11.911 -0.292 9.503 125 HZ3 LYS 14 2HZ LYS 14 -11.848 1.143 8.609 126 H SER 15 H SER 15 -15.854 -2.410 3.315 127 HA SER 15 HA SER 15 -18.405 -1.666 4.564 128 HB2 SER 15 1HB SER 15 -17.124 -1.070 1.948 129 HB3 SER 15 2HB SER 15 -18.880 -1.237 1.957 130 HG SER 15 HG SER 15 -18.976 0.382 3.532 131 H PHE 16 H PHE 16 -16.822 -4.143 2.762 132 HA PHE 16 HA PHE 16 -19.387 -5.555 2.433 133 HB2 PHE 16 1HB PHE 16 -16.888 -6.235 0.904 134 HB3 PHE 16 2HB PHE 16 -18.558 -6.626 0.510 135 HD1 PHE 16 HD1 PHE 16 -19.879 -4.031 0.780 136 HD2 PHE 16 HD2 PHE 16 -16.095 -5.023 -0.898 137 HE1 PHE 16 HE1 PHE 16 -20.003 -2.045 -0.667 138 HE2 PHE 16 HE2 PHE 16 -16.213 -3.038 -2.346 139 HZ PHE 16 HZ PHE 16 -18.168 -1.545 -2.232 140 HA PRO 17 HA PRO 17 -16.875 -7.821 5.629 141 HB2 PRO 17 1HB PRO 17 -18.930 -8.129 7.375 142 HB3 PRO 17 2HB PRO 17 -17.893 -6.698 7.356 143 HG2 PRO 17 1HG PRO 17 -20.616 -7.080 6.172 144 HG3 PRO 17 2HG PRO 17 -19.972 -5.696 7.074 145 HD2 PRO 17 1HD PRO 17 -20.159 -5.715 4.372 146 HD3 PRO 17 2HD PRO 17 -18.871 -4.849 5.234 147 H SER 18 H SER 18 -19.993 -8.353 4.121 148 HA SER 18 HA SER 18 -19.801 -11.234 4.627 149 HB2 SER 18 1HB SER 18 -21.954 -9.834 4.999 150 HB3 SER 18 2HB SER 18 -22.109 -9.887 3.243 151 HG SER 18 HG SER 18 -23.207 -11.634 4.034 152 H SER 19 H SER 19 -18.204 -9.587 2.648 153 HA SER 19 HA SER 19 -19.052 -10.843 0.137 154 HB2 SER 19 1HB SER 19 -17.502 -8.421 0.840 155 HB3 SER 19 2HB SER 19 -16.940 -9.303 -0.580 156 HG SER 19 HG SER 19 -18.511 -7.753 -1.138 157 H VAL 20 H VAL 20 -17.590 -12.046 -1.137 158 HA VAL 20 HA VAL 20 -15.521 -13.394 0.446 159 HB VAL 20 HB VAL 20 -16.809 -14.232 -2.156 160 HG11 VAL 20 1HG1 VAL 20 -14.679 -15.469 -0.448 161 HG12 VAL 20 2HG1 VAL 20 -15.715 -16.461 -1.475 162 HG13 VAL 20 3HG1 VAL 20 -14.696 -15.212 -2.193 163 HG21 VAL 20 3HG2 VAL 20 -17.643 -16.100 -0.534 164 HG22 VAL 20 1HG2 VAL 20 -17.344 -14.884 0.708 165 HG23 VAL 20 2HG2 VAL 20 -18.481 -14.550 -0.598 166 H ILE 21 H ILE 21 -13.732 -12.111 0.253 167 HA ILE 21 HA ILE 21 -12.905 -11.060 -2.303 168 HB ILE 21 HB ILE 21 -11.305 -11.109 0.253 169 HG12 ILE 21 1HG1 ILE 21 -12.287 -8.591 0.129 170 HG13 ILE 21 2HG1 ILE 21 -13.641 -9.481 -0.559 171 HG21 ILE 21 1HG2 ILE 21 -10.816 -10.133 -2.393 172 HG22 ILE 21 2HG2 ILE 21 -10.853 -8.784 -1.259 173 HG23 ILE 21 3HG2 ILE 21 -9.748 -10.131 -0.990 174 HD11 ILE 21 3HD1 ILE 21 -12.806 -9.237 2.180 175 HD12 ILE 21 1HD1 ILE 21 -14.306 -9.879 1.511 176 HD13 ILE 21 2HD1 ILE 21 -12.901 -10.930 1.696 177 H LYS 22 H LYS 22 -11.788 -12.155 -3.762 178 HA LYS 22 HA LYS 22 -9.816 -14.133 -2.880 179 HB2 LYS 22 1HB LYS 22 -11.812 -15.424 -3.399 180 HB3 LYS 22 2HB LYS 22 -11.949 -14.633 -4.963 181 HG2 LYS 22 1HG LYS 22 -11.031 -16.863 -5.200 182 HG3 LYS 22 2HG LYS 22 -9.839 -15.647 -5.663 183 HD2 LYS 22 1HD LYS 22 -8.780 -17.370 -4.332 184 HD3 LYS 22 2HD LYS 22 -8.806 -15.852 -3.431 185 HE2 LYS 22 1HE LYS 22 -11.087 -17.707 -3.046 186 HE3 LYS 22 2HE LYS 22 -9.536 -18.181 -2.356 187 HZ1 LYS 22 3HZ LYS 22 -9.724 -15.612 -1.599 188 HZ2 LYS 22 1HZ LYS 22 -10.191 -16.927 -0.642 189 HZ3 LYS 22 2HZ LYS 22 -11.347 -16.085 -1.546 190 H ILE 23 H ILE 23 -7.986 -14.194 -4.092 191 HA ILE 23 HA ILE 23 -7.747 -12.169 -6.184 192 HB ILE 23 HB ILE 23 -5.603 -13.795 -4.811 193 HG12 ILE 23 1HG1 ILE 23 -5.120 -11.308 -3.995 194 HG13 ILE 23 2HG1 ILE 23 -6.850 -11.138 -4.274 195 HG21 ILE 23 1HG2 ILE 23 -4.742 -13.211 -6.914 196 HG22 ILE 23 2HG2 ILE 23 -5.490 -11.615 -6.872 197 HG23 ILE 23 3HG2 ILE 23 -4.125 -11.977 -5.816 198 HD11 ILE 23 3HD1 ILE 23 -5.891 -13.448 -2.672 199 HD12 ILE 23 1HD1 ILE 23 -5.909 -11.846 -1.935 200 HD13 ILE 23 2HD1 ILE 23 -7.401 -12.544 -2.565 201 H THR 24 H THR 24 -7.111 -12.598 -8.266 202 HA THR 24 HA THR 24 -6.571 -15.357 -9.048 203 HB THR 24 HB THR 24 -8.760 -13.748 -10.375 204 HG1 THR 24 HG1 THR 24 -9.018 -16.108 -8.802 205 HG21 THR 24 3HG2 THR 24 -8.014 -15.114 -12.062 206 HG22 THR 24 1HG2 THR 24 -9.165 -16.196 -11.280 207 HG23 THR 24 2HG2 THR 24 -7.440 -16.357 -10.950 208 H ASP 25 H ASP 25 -5.177 -15.520 -10.723 209 HA ASP 25 HA ASP 25 -3.978 -13.078 -11.704 210 HB2 ASP 25 1HB ASP 25 -2.419 -14.688 -12.879 211 HB3 ASP 25 2HB ASP 25 -2.442 -14.805 -11.121 212 H LEU 26 H LEU 26 -4.346 -12.145 -13.611 213 HA LEU 26 HA LEU 26 -6.110 -13.534 -15.504 214 HB2 LEU 26 1HB LEU 26 -5.648 -10.690 -14.790 215 HB3 LEU 26 2HB LEU 26 -6.107 -11.052 -16.453 216 HG LEU 26 HG LEU 26 -7.719 -11.935 -14.066 217 HD11 LEU 26 1HD1 LEU 26 -7.932 -9.427 -15.716 218 HD12 LEU 26 2HD1 LEU 26 -7.699 -9.558 -13.973 219 HD13 LEU 26 3HD1 LEU 26 -9.232 -10.045 -14.697 220 HD21 LEU 26 3HD2 LEU 26 -9.372 -11.645 -16.235 221 HD22 LEU 26 1HD2 LEU 26 -8.691 -13.166 -15.658 222 HD23 LEU 26 2HD2 LEU 26 -7.893 -12.280 -16.958 223 H VAL 27 H VAL 27 -3.193 -11.503 -15.409 224 HA VAL 27 HA VAL 27 -2.387 -12.706 -17.978 225 HB VAL 27 HB VAL 27 -1.141 -10.648 -18.477 226 HG11 VAL 27 1HG1 VAL 27 -2.933 -9.871 -19.545 227 HG12 VAL 27 2HG1 VAL 27 -3.888 -11.042 -18.633 228 HG13 VAL 27 3HG1 VAL 27 -3.708 -9.393 -18.035 229 HG21 VAL 27 3HG2 VAL 27 -2.165 -8.677 -16.899 230 HG22 VAL 27 1HG2 VAL 27 -1.959 -9.991 -15.740 231 HG23 VAL 27 2HG2 VAL 27 -0.580 -9.420 -16.681 232 H GLY 28 H GLY 28 -1.398 -11.610 -14.792 233 HA2 GLY 28 1HA GLY 28 0.303 -12.482 -13.469 234 HA3 GLY 28 2HA GLY 28 0.824 -13.461 -14.832 235 H ASP 29 H ASP 29 1.721 -12.040 -16.710 236 HA ASP 29 HA ASP 29 4.111 -10.920 -15.904 237 HB2 ASP 29 1HB ASP 29 2.577 -10.230 -18.419 238 HB3 ASP 29 2HB ASP 29 4.307 -10.020 -18.164 239 H GLN 30 H GLN 30 1.468 -8.991 -17.320 240 HA GLN 30 HA GLN 30 2.450 -6.523 -16.440 241 HB2 GLN 30 1HB GLN 30 0.556 -7.173 -18.167 242 HB3 GLN 30 2HB GLN 30 -0.490 -6.922 -16.776 243 HG2 GLN 30 1HG GLN 30 0.855 -4.671 -16.589 244 HG3 GLN 30 2HG GLN 30 1.141 -4.966 -18.304 245 HE21 GLN 30 2HE2 GLN 30 -1.489 -4.937 -15.927 246 HE22 GLN 30 1HE2 GLN 30 -2.667 -4.241 -16.982 247 H ASP 31 H ASP 31 1.596 -5.082 -14.823 248 HA ASP 31 HA ASP 31 1.159 -6.430 -12.315 249 HB2 ASP 31 1HB ASP 31 1.516 -3.551 -13.116 250 HB3 ASP 31 2HB ASP 31 1.046 -3.991 -11.476 251 H HIS 32 H HIS 32 -0.941 -7.251 -13.526 252 HA HIS 32 HA HIS 32 -3.147 -5.447 -12.774 253 HB2 HIS 32 1HB HIS 32 -2.759 -6.271 -15.259 254 HB3 HIS 32 2HB HIS 32 -3.574 -7.717 -14.669 255 HD1 HIS 32 HD1 HIS 32 -4.223 -3.961 -14.556 256 HD2 HIS 32 HD2 HIS 32 -6.240 -7.562 -15.028 257 HE1 HIS 32 HE1 HIS 32 -6.628 -3.338 -14.948 258 H TYR 33 H TYR 33 -4.517 -6.112 -11.244 259 HA TYR 33 HA TYR 33 -4.377 -8.934 -10.404 260 HB2 TYR 33 1HB TYR 33 -5.075 -6.579 -8.645 261 HB3 TYR 33 2HB TYR 33 -4.786 -8.239 -8.138 262 HD1 TYR 33 HD2 TYR 33 -3.201 -5.144 -9.336 263 HD2 TYR 33 HD1 TYR 33 -2.551 -9.086 -7.873 264 HE1 TYR 33 HE2 TYR 33 -0.824 -4.617 -8.987 265 HE2 TYR 33 HE1 TYR 33 -0.173 -8.570 -7.519 266 HH TYR 33 HH TYR 33 1.076 -5.777 -7.216 267 H ALA 34 H ALA 34 -6.185 -10.067 -10.604 268 HA ALA 34 HA ALA 34 -8.666 -8.695 -11.267 269 HB1 ALA 34 1HB ALA 34 -9.268 -10.562 -12.370 270 HB2 ALA 34 2HB ALA 34 -7.548 -10.939 -12.275 271 HB3 ALA 34 3HB ALA 34 -8.668 -11.632 -11.103 272 H LEU 35 H LEU 35 -9.710 -7.947 -9.513 273 HA LEU 35 HA LEU 35 -9.844 -9.568 -7.093 274 HB2 LEU 35 1HB LEU 35 -9.384 -7.323 -6.621 275 HB3 LEU 35 2HB LEU 35 -10.589 -6.744 -7.768 276 HG LEU 35 HG LEU 35 -12.363 -7.582 -6.240 277 HD11 LEU 35 1HD1 LEU 35 -10.667 -9.200 -5.128 278 HD12 LEU 35 2HD1 LEU 35 -11.928 -8.453 -4.148 279 HD13 LEU 35 3HD1 LEU 35 -10.285 -7.814 -4.107 280 HD21 LEU 35 3HD2 LEU 35 -10.802 -5.275 -6.059 281 HD22 LEU 35 1HD2 LEU 35 -11.007 -5.832 -4.398 282 HD23 LEU 35 2HD2 LEU 35 -12.422 -5.524 -5.405 283 H GLU 36 H GLU 36 -11.426 -10.992 -6.863 284 HA GLU 36 HA GLU 36 -13.985 -10.499 -8.230 285 HB2 GLU 36 1HB GLU 36 -14.320 -13.000 -7.824 286 HB3 GLU 36 2HB GLU 36 -13.122 -12.537 -9.024 287 HG2 GLU 36 1HG GLU 36 -11.336 -13.098 -7.635 288 HG3 GLU 36 2HG GLU 36 -12.344 -13.099 -6.189 289 H ILE 37 H ILE 37 -15.565 -9.796 -6.972 290 HA ILE 37 HA ILE 37 -15.599 -10.637 -4.147 291 HB ILE 37 HB ILE 37 -15.247 -8.192 -4.523 292 HG12 ILE 37 1HG1 ILE 37 -17.898 -8.251 -3.248 293 HG13 ILE 37 2HG1 ILE 37 -16.779 -9.471 -2.649 294 HG21 ILE 37 1HG2 ILE 37 -16.652 -8.025 -6.550 295 HG22 ILE 37 2HG2 ILE 37 -18.083 -8.243 -5.544 296 HG23 ILE 37 3HG2 ILE 37 -17.061 -6.821 -5.328 297 HD11 ILE 37 3HD1 ILE 37 -15.721 -7.964 -1.432 298 HD12 ILE 37 1HD1 ILE 37 -15.449 -6.945 -2.845 299 HD13 ILE 37 2HD1 ILE 37 -16.938 -6.781 -1.914 300 H SER 38 H SER 38 -17.401 -11.565 -3.338 301 HA SER 38 HA SER 38 -19.788 -11.669 -5.058 302 HB2 SER 38 1HB SER 38 -18.702 -13.992 -3.449 303 HB3 SER 38 2HB SER 38 -20.109 -14.013 -4.511 304 HG SER 38 HG SER 38 -17.993 -14.813 -5.358 305 H ASP 39 H ASP 39 -21.634 -11.165 -4.068 306 HA ASP 39 HA ASP 39 -22.126 -11.718 -1.304 307 HB2 ASP 39 1HB ASP 39 -20.716 -9.422 -1.666 308 HB3 ASP 39 2HB ASP 39 -22.366 -8.812 -1.766 309 H ALA 40 H ALA 40 -24.272 -10.668 -0.617 310 HA ALA 40 HA ALA 40 -26.132 -10.979 -2.856 311 HB1 ALA 40 1HB ALA 40 -26.628 -11.001 0.118 312 HB2 ALA 40 2HB ALA 40 -27.852 -11.266 -1.124 313 HB3 ALA 40 3HB ALA 40 -26.522 -12.410 -0.937 314 H GLN 41 H GLN 41 -24.618 -8.530 -2.533 315 HA GLN 41 HA GLN 41 -26.806 -6.649 -1.935 316 HB2 GLN 41 1HB GLN 41 -25.098 -4.973 -1.433 317 HB3 GLN 41 2HB GLN 41 -24.905 -6.391 -0.411 318 HG2 GLN 41 1HG GLN 41 -23.235 -7.103 -2.329 319 HG3 GLN 41 2HG GLN 41 -23.167 -5.360 -2.581 320 HE21 GLN 41 2HE2 GLN 41 -23.374 -7.425 0.298 321 HE22 GLN 41 1HE2 GLN 41 -21.998 -6.747 1.093 322 H PHE 42 H PHE 42 -24.498 -7.747 -4.258 323 HA PHE 42 HA PHE 42 -25.045 -5.500 -6.045 324 HB2 PHE 42 1HB PHE 42 -23.228 -7.846 -6.593 325 HB3 PHE 42 2HB PHE 42 -23.225 -6.269 -7.377 326 HD1 PHE 42 HD2 PHE 42 -22.809 -4.240 -5.742 327 HD2 PHE 42 HD1 PHE 42 -21.661 -8.266 -4.973 328 HE1 PHE 42 HE2 PHE 42 -21.117 -3.448 -4.141 329 HE2 PHE 42 HE1 PHE 42 -19.967 -7.480 -3.370 330 HZ PHE 42 HZ PHE 42 -19.693 -5.069 -2.953 331 H ASN 43 H ASN 43 -27.100 -7.475 -5.368 332 HA ASN 43 HA ASN 43 -27.434 -9.177 -7.659 333 HB2 ASN 43 1HB ASN 43 -29.152 -8.491 -5.284 334 HB3 ASN 43 2HB ASN 43 -29.786 -9.446 -6.621 335 HD21 ASN 43 2HD2 ASN 43 -29.912 -10.742 -4.421 336 HD22 ASN 43 1HD2 ASN 43 -28.638 -11.893 -4.221 337 H GLY 44 H GLY 44 -28.348 -5.954 -6.771 338 HA2 GLY 44 1HA GLY 44 -29.961 -5.771 -9.242 339 HA3 GLY 44 2HA GLY 44 -30.324 -4.852 -7.789 340 H LEU 45 H LEU 45 -27.320 -4.496 -7.427 341 HA LEU 45 HA LEU 45 -27.070 -1.923 -8.380 342 HB2 LEU 45 1HB LEU 45 -25.114 -4.010 -7.551 343 HB3 LEU 45 2HB LEU 45 -24.511 -2.530 -8.293 344 HG LEU 45 HG LEU 45 -24.738 -2.806 -5.668 345 HD11 LEU 45 1HD1 LEU 45 -25.363 -0.321 -7.252 346 HD12 LEU 45 2HD1 LEU 45 -23.778 -0.878 -6.717 347 HD13 LEU 45 3HD1 LEU 45 -24.967 -0.337 -5.533 348 HD21 LEU 45 3HD2 LEU 45 -26.776 -1.895 -4.799 349 HD22 LEU 45 1HD2 LEU 45 -27.181 -3.266 -5.833 350 HD23 LEU 45 2HD2 LEU 45 -27.404 -1.619 -6.425 351 H SER 46 H SER 46 -25.479 -1.103 -10.004 352 HA SER 46 HA SER 46 -25.779 -2.628 -12.495 353 HB2 SER 46 1HB SER 46 -26.749 -0.440 -12.655 354 HB3 SER 46 2HB SER 46 -25.304 0.313 -11.979 355 HG SER 46 HG SER 46 -25.856 -0.264 -14.534 356 H LEU 47 H LEU 47 -23.990 -2.463 -14.076 357 HA LEU 47 HA LEU 47 -21.617 -3.482 -13.104 358 HB2 LEU 47 1HB LEU 47 -22.373 -2.141 -15.662 359 HB3 LEU 47 2HB LEU 47 -20.687 -2.561 -15.364 360 HG LEU 47 HG LEU 47 -21.790 -4.257 -16.715 361 HD11 LEU 47 1HD1 LEU 47 -20.051 -4.789 -14.905 362 HD12 LEU 47 2HD1 LEU 47 -20.988 -6.124 -15.575 363 HD13 LEU 47 3HD1 LEU 47 -21.406 -5.459 -13.996 364 HD21 LEU 47 3HD2 LEU 47 -23.637 -5.547 -15.927 365 HD22 LEU 47 1HD2 LEU 47 -24.076 -3.845 -15.789 366 HD23 LEU 47 2HD2 LEU 47 -23.596 -4.750 -14.354 367 H ILE 48 H ILE 48 -22.492 -0.128 -13.734 368 HA ILE 48 HA ILE 48 -19.870 0.902 -13.215 369 HB ILE 48 HB ILE 48 -22.533 2.326 -13.283 370 HG12 ILE 48 1HG1 ILE 48 -21.988 1.308 -15.425 371 HG13 ILE 48 2HG1 ILE 48 -21.787 3.053 -15.532 372 HG21 ILE 48 1HG2 ILE 48 -21.160 3.770 -12.097 373 HG22 ILE 48 2HG2 ILE 48 -19.720 3.303 -13.000 374 HG23 ILE 48 3HG2 ILE 48 -20.949 4.312 -13.762 375 HD11 ILE 48 3HD1 ILE 48 -19.754 2.718 -16.321 376 HD12 ILE 48 1HD1 ILE 48 -19.295 2.021 -14.767 377 HD13 ILE 48 2HD1 ILE 48 -19.899 0.980 -16.057 378 H ASN 49 H ASN 49 -22.898 0.722 -11.371 379 HA ASN 49 HA ASN 49 -22.057 2.101 -9.095 380 HB2 ASN 49 1HB ASN 49 -23.969 -0.241 -9.119 381 HB3 ASN 49 2HB ASN 49 -23.915 1.081 -7.956 382 HD21 ASN 49 2HD2 ASN 49 -26.242 0.452 -9.217 383 HD22 ASN 49 1HD2 ASN 49 -26.665 1.702 -10.332 384 H GLN 50 H GLN 50 -22.004 -1.398 -9.750 385 HA GLN 50 HA GLN 50 -20.890 -2.244 -7.355 386 HB2 GLN 50 1HB GLN 50 -20.736 -3.343 -10.150 387 HB3 GLN 50 2HB GLN 50 -19.934 -4.146 -8.807 388 HG2 GLN 50 1HG GLN 50 -21.855 -4.930 -7.952 389 HG3 GLN 50 2HG GLN 50 -22.754 -3.468 -8.354 390 HE21 GLN 50 2HE2 GLN 50 -24.335 -5.252 -8.865 391 HE22 GLN 50 1HE2 GLN 50 -24.333 -5.851 -10.486 392 H HIS 51 H HIS 51 -19.266 -1.185 -10.324 393 HA HIS 51 HA HIS 51 -16.633 -1.618 -9.346 394 HB2 HIS 51 1HB HIS 51 -17.847 -0.740 -11.780 395 HB3 HIS 51 2HB HIS 51 -16.604 0.422 -11.326 396 HD1 HIS 51 HD1 HIS 51 -14.189 -0.285 -11.596 397 HD2 HIS 51 HD2 HIS 51 -16.875 -3.385 -12.256 398 HE1 HIS 51 HE1 HIS 51 -12.823 -2.166 -12.555 399 H LYS 52 H LYS 52 -18.939 0.914 -8.958 400 HA LYS 52 HA LYS 52 -17.024 2.929 -8.200 401 HB2 LYS 52 1HB LYS 52 -19.446 3.195 -9.191 402 HB3 LYS 52 2HB LYS 52 -19.929 3.096 -7.503 403 HG2 LYS 52 1HG LYS 52 -18.608 5.024 -6.953 404 HG3 LYS 52 2HG LYS 52 -17.936 5.076 -8.585 405 HD2 LYS 52 1HD LYS 52 -20.896 5.204 -8.209 406 HD3 LYS 52 2HD LYS 52 -19.921 6.647 -7.920 407 HE2 LYS 52 1HE LYS 52 -18.988 6.457 -10.179 408 HE3 LYS 52 2HE LYS 52 -19.972 5.022 -10.463 409 HZ1 LYS 52 3HZ LYS 52 -20.899 7.133 -11.373 410 HZ2 LYS 52 1HZ LYS 52 -21.116 7.673 -9.784 411 HZ3 LYS 52 2HZ LYS 52 -21.945 6.305 -10.333 412 H LEU 53 H LEU 53 -19.375 0.873 -6.511 413 HA LEU 53 HA LEU 53 -19.051 1.796 -3.932 414 HB2 LEU 53 1HB LEU 53 -19.541 -0.992 -4.950 415 HB3 LEU 53 2HB LEU 53 -19.598 -0.568 -3.241 416 HG LEU 53 HG LEU 53 -21.400 0.551 -5.388 417 HD11 LEU 53 1HD1 LEU 53 -21.713 -1.653 -3.388 418 HD12 LEU 53 2HD1 LEU 53 -22.132 -1.629 -5.101 419 HD13 LEU 53 3HD1 LEU 53 -23.112 -0.732 -3.942 420 HD21 LEU 53 3HD2 LEU 53 -21.242 2.220 -3.767 421 HD22 LEU 53 1HD2 LEU 53 -21.142 1.058 -2.444 422 HD23 LEU 53 2HD2 LEU 53 -22.671 1.303 -3.287 423 H VAL 54 H VAL 54 -17.251 -0.869 -5.473 424 HA VAL 54 HA VAL 54 -15.524 -1.475 -3.406 425 HB VAL 54 HB VAL 54 -13.913 -2.221 -5.177 426 HG11 VAL 54 1HG1 VAL 54 -16.436 -3.227 -4.495 427 HG12 VAL 54 2HG1 VAL 54 -16.296 -3.420 -6.243 428 HG13 VAL 54 3HG1 VAL 54 -15.074 -4.115 -5.177 429 HG21 VAL 54 3HG2 VAL 54 -14.811 -2.171 -7.529 430 HG22 VAL 54 1HG2 VAL 54 -15.990 -0.983 -6.971 431 HG23 VAL 54 2HG2 VAL 54 -14.266 -0.618 -6.895 432 H LYS 55 H LYS 55 -15.393 1.177 -5.692 433 HA LYS 55 HA LYS 55 -12.740 1.995 -4.922 434 HB2 LYS 55 1HB LYS 55 -14.857 3.414 -6.550 435 HB3 LYS 55 2HB LYS 55 -13.200 3.968 -6.349 436 HG2 LYS 55 1HG LYS 55 -13.805 1.258 -7.473 437 HG3 LYS 55 2HG LYS 55 -13.809 2.702 -8.489 438 HD2 LYS 55 1HD LYS 55 -11.631 2.050 -8.741 439 HD3 LYS 55 2HD LYS 55 -11.469 3.098 -7.330 440 HE2 LYS 55 1HE LYS 55 -11.066 1.363 -5.921 441 HE3 LYS 55 2HE LYS 55 -12.102 0.253 -6.816 442 HZ1 LYS 55 3HZ LYS 55 -10.204 -0.620 -7.548 443 HZ2 LYS 55 1HZ LYS 55 -9.278 0.704 -7.048 444 HZ3 LYS 55 2HZ LYS 55 -10.070 0.743 -8.542 445 H ASN 56 H ASN 56 -16.015 2.734 -3.991 446 HA ASN 56 HA ASN 56 -15.356 5.136 -2.564 447 HB2 ASN 56 1HB ASN 56 -17.832 3.436 -2.229 448 HB3 ASN 56 2HB ASN 56 -17.646 5.147 -1.854 449 HD21 ASN 56 2HD2 ASN 56 -19.487 3.663 -3.658 450 HD22 ASN 56 1HD2 ASN 56 -19.321 4.435 -5.195 451 H ALA 57 H ALA 57 -15.794 1.738 -1.755 452 HA ALA 57 HA ALA 57 -15.825 1.955 1.035 453 HB1 ALA 57 1HB ALA 57 -15.468 -0.354 1.102 454 HB2 ALA 57 2HB ALA 57 -16.298 -0.089 -0.432 455 HB3 ALA 57 3HB ALA 57 -14.554 -0.349 -0.406 456 H LEU 58 H LEU 58 -13.279 2.429 -1.207 457 HA LEU 58 HA LEU 58 -11.324 2.446 0.998 458 HB2 LEU 58 1HB LEU 58 -9.598 2.054 -0.758 459 HB3 LEU 58 2HB LEU 58 -10.711 0.712 -0.502 460 HG LEU 58 HG LEU 58 -11.971 1.808 -2.542 461 HD11 LEU 58 1HD1 LEU 58 -9.164 2.854 -2.763 462 HD12 LEU 58 2HD1 LEU 58 -10.680 3.744 -2.885 463 HD13 LEU 58 3HD1 LEU 58 -10.207 2.631 -4.167 464 HD21 LEU 58 3HD2 LEU 58 -9.540 0.417 -3.442 465 HD22 LEU 58 1HD2 LEU 58 -11.239 0.027 -3.707 466 HD23 LEU 58 2HD2 LEU 58 -10.463 -0.406 -2.183 467 H SER 59 H SER 59 -13.173 4.478 -0.542 468 HA SER 59 HA SER 59 -11.173 6.416 -1.388 469 HB2 SER 59 1HB SER 59 -13.121 6.252 -2.796 470 HB3 SER 59 2HB SER 59 -14.198 6.473 -1.416 471 HG SER 59 HG SER 59 -14.023 8.433 -2.437 472 H GLU 60 H GLU 60 -13.452 5.868 1.220 473 HA GLU 60 HA GLU 60 -12.869 8.449 2.428 474 HB2 GLU 60 1HB GLU 60 -14.453 7.637 4.210 475 HB3 GLU 60 2HB GLU 60 -15.146 7.775 2.600 476 HG2 GLU 60 1HG GLU 60 -15.744 5.650 2.621 477 HG3 GLU 60 2HG GLU 60 -14.089 5.144 2.956 478 H ILE 61 H ILE 61 -12.165 5.043 2.911 479 HA ILE 61 HA ILE 61 -10.721 5.581 5.380 480 HB ILE 61 HB ILE 61 -11.014 2.969 3.892 481 HG12 ILE 61 1HG1 ILE 61 -12.484 3.200 6.380 482 HG13 ILE 61 2HG1 ILE 61 -12.989 4.432 5.229 483 HG21 ILE 61 1HG2 ILE 61 -9.841 3.743 6.528 484 HG22 ILE 61 2HG2 ILE 61 -10.550 2.143 6.315 485 HG23 ILE 61 3HG2 ILE 61 -9.207 2.655 5.294 486 HD11 ILE 61 3HD1 ILE 61 -12.734 1.750 4.092 487 HD12 ILE 61 1HD1 ILE 61 -13.969 1.909 5.340 488 HD13 ILE 61 2HD1 ILE 61 -14.017 2.948 3.915 489 H LEU 62 H LEU 62 -10.097 5.400 2.040 490 HA LEU 62 HA LEU 62 -8.200 5.482 0.788 491 HB2 LEU 62 1HB LEU 62 -7.308 6.590 3.414 492 HB3 LEU 62 2HB LEU 62 -6.123 6.307 2.140 493 HG LEU 62 HG LEU 62 -6.823 8.626 2.150 494 HD11 LEU 62 1HD1 LEU 62 -6.586 7.085 -0.026 495 HD12 LEU 62 2HD1 LEU 62 -6.921 8.815 -0.099 496 HD13 LEU 62 3HD1 LEU 62 -8.240 7.655 -0.252 497 HD21 LEU 62 3HD2 LEU 62 -9.024 8.352 3.157 498 HD22 LEU 62 1HD2 LEU 62 -9.607 7.554 1.696 499 HD23 LEU 62 2HD2 LEU 62 -9.135 9.253 1.644 500 H ASN 63 H ASN 63 -8.892 3.042 2.414 501 HA ASN 63 HA ASN 63 -6.683 1.712 3.394 502 HB2 ASN 63 1HB ASN 63 -9.289 0.921 2.268 503 HB3 ASN 63 2HB ASN 63 -8.044 -0.321 2.186 504 HD21 ASN 63 2HD2 ASN 63 -10.062 -0.998 3.663 505 HD22 ASN 63 1HD2 ASN 63 -9.733 -0.854 5.353 506 H LYS 64 H LYS 64 -8.000 1.127 0.132 507 HA LYS 64 HA LYS 64 -5.814 -0.233 -0.884 508 HB2 LYS 64 1HB LYS 64 -8.140 0.103 -1.912 509 HB3 LYS 64 2HB LYS 64 -7.506 1.610 -2.561 510 HG2 LYS 64 1HG LYS 64 -7.203 0.136 -4.308 511 HG3 LYS 64 2HG LYS 64 -5.621 0.131 -3.525 512 HD2 LYS 64 1HD LYS 64 -7.600 -1.859 -2.575 513 HD3 LYS 64 2HD LYS 64 -6.921 -2.110 -4.185 514 HE2 LYS 64 1HE LYS 64 -4.669 -1.568 -2.846 515 HE3 LYS 64 2HE LYS 64 -5.624 -2.241 -1.526 516 HZ1 LYS 64 3HZ LYS 64 -5.860 -3.837 -3.861 517 HZ2 LYS 64 1HZ LYS 64 -5.322 -4.274 -2.317 518 HZ3 LYS 64 2HZ LYS 64 -4.232 -3.641 -3.445 519 H LYS 65 H LYS 65 -4.075 0.374 -2.228 520 HA LYS 65 HA LYS 65 -3.303 3.211 -2.024 521 HB2 LYS 65 1HB LYS 65 -1.715 0.719 -1.540 522 HB3 LYS 65 2HB LYS 65 -0.900 2.163 -2.126 523 HG2 LYS 65 1HG LYS 65 -2.217 3.270 -0.110 524 HG3 LYS 65 2HG LYS 65 -2.144 1.618 0.508 525 HD2 LYS 65 1HD LYS 65 0.243 1.604 0.387 526 HD3 LYS 65 2HD LYS 65 0.263 3.139 -0.483 527 HE2 LYS 65 1HE LYS 65 0.857 3.526 1.819 528 HE3 LYS 65 2HE LYS 65 -0.729 4.229 1.506 529 HZ1 LYS 65 3HZ LYS 65 -0.595 1.492 2.548 530 HZ2 LYS 65 1HZ LYS 65 -1.773 2.682 2.792 531 HZ3 LYS 65 2HZ LYS 65 -0.297 2.771 3.614 532 H LEU 66 H LEU 66 -3.259 0.268 -3.934 533 HA LEU 66 HA LEU 66 -1.707 1.025 -6.085 534 HB2 LEU 66 1HB LEU 66 -4.008 -0.805 -5.713 535 HB3 LEU 66 2HB LEU 66 -3.569 -0.388 -7.368 536 HG LEU 66 HG LEU 66 -2.575 -2.513 -6.615 537 HD11 LEU 66 1HD1 LEU 66 -0.114 -1.049 -6.840 538 HD12 LEU 66 2HD1 LEU 66 -1.326 -0.388 -7.936 539 HD13 LEU 66 3HD1 LEU 66 -0.906 -2.099 -8.015 540 HD21 LEU 66 3HD2 LEU 66 -0.809 -2.512 -4.947 541 HD22 LEU 66 1HD2 LEU 66 -2.321 -1.938 -4.244 542 HD23 LEU 66 2HD2 LEU 66 -1.051 -0.788 -4.664 543 H HIS 67 H HIS 67 -2.582 1.488 -8.348 544 HA HIS 67 HA HIS 67 -4.081 3.959 -8.207 545 HB2 HIS 67 1HB HIS 67 -1.994 3.411 -9.684 546 HB3 HIS 67 2HB HIS 67 -3.178 2.698 -10.775 547 HD1 HIS 67 HD1 HIS 67 -3.177 5.983 -8.840 548 HD2 HIS 67 HD2 HIS 67 -3.649 4.524 -12.701 549 HE1 HIS 67 HE1 HIS 67 -3.699 7.993 -10.258 550 H SER 68 H SER 68 -4.362 1.026 -10.224 551 HA SER 68 HA SER 68 -7.221 0.953 -9.820 552 HB2 SER 68 1HB SER 68 -6.694 2.622 -11.735 553 HB3 SER 68 2HB SER 68 -6.302 1.182 -12.676 554 HG SER 68 HG SER 68 -8.457 1.656 -12.993 555 H ILE 69 H ILE 69 -8.185 -0.994 -10.555 556 HA ILE 69 HA ILE 69 -6.506 -3.017 -11.775 557 HB ILE 69 HB ILE 69 -7.066 -4.665 -9.927 558 HG12 ILE 69 1HG1 ILE 69 -7.555 -2.095 -8.406 559 HG13 ILE 69 2HG1 ILE 69 -8.769 -3.309 -8.793 560 HG21 ILE 69 1HG2 ILE 69 -5.260 -2.609 -8.783 561 HG22 ILE 69 2HG2 ILE 69 -5.015 -4.342 -8.995 562 HG23 ILE 69 3HG2 ILE 69 -4.864 -3.255 -10.375 563 HD11 ILE 69 3HD1 ILE 69 -6.519 -3.450 -6.835 564 HD12 ILE 69 1HD1 ILE 69 -8.237 -3.762 -6.591 565 HD13 ILE 69 2HD1 ILE 69 -7.248 -4.919 -7.481 566 H SER 70 H SER 70 -7.770 -5.130 -11.981 567 HA SER 70 HA SER 70 -10.349 -4.488 -13.089 568 HB2 SER 70 1HB SER 70 -9.357 -6.042 -14.453 569 HB3 SER 70 2HB SER 70 -8.524 -6.839 -13.119 570 HG SER 70 HG SER 70 -10.522 -7.823 -14.270 571 H ILE 71 H ILE 71 -12.206 -4.562 -12.028 572 HA ILE 71 HA ILE 71 -12.377 -6.229 -9.604 573 HB ILE 71 HB ILE 71 -13.920 -3.720 -10.271 574 HG12 ILE 71 1HG1 ILE 71 -12.121 -3.980 -7.906 575 HG13 ILE 71 2HG1 ILE 71 -11.381 -3.741 -9.486 576 HG21 ILE 71 1HG2 ILE 71 -14.284 -5.818 -8.244 577 HG22 ILE 71 2HG2 ILE 71 -14.354 -4.163 -7.641 578 HG23 ILE 71 3HG2 ILE 71 -15.447 -4.681 -8.925 579 HD11 ILE 71 3HD1 ILE 71 -13.549 -1.894 -9.078 580 HD12 ILE 71 1HD1 ILE 71 -12.367 -1.790 -7.774 581 HD13 ILE 71 2HD1 ILE 71 -11.854 -1.581 -9.449 582 H LYS 72 H LYS 72 -13.405 -8.061 -10.075 583 HA LYS 72 HA LYS 72 -15.501 -8.119 -12.085 584 HB2 LYS 72 1HB LYS 72 -13.843 -9.924 -12.035 585 HB3 LYS 72 2HB LYS 72 -14.322 -10.330 -10.392 586 HG2 LYS 72 1HG LYS 72 -16.659 -10.708 -11.376 587 HG3 LYS 72 2HG LYS 72 -15.843 -10.720 -12.941 588 HD2 LYS 72 1HD LYS 72 -14.519 -12.595 -12.331 589 HD3 LYS 72 2HD LYS 72 -15.009 -12.474 -10.640 590 HE2 LYS 72 1HE LYS 72 -16.413 -14.140 -11.281 591 HE3 LYS 72 2HE LYS 72 -17.418 -12.764 -11.733 592 HZ1 LYS 72 3HZ LYS 72 -15.786 -14.496 -13.485 593 HZ2 LYS 72 1HZ LYS 72 -16.305 -12.968 -13.992 594 HZ3 LYS 72 2HZ LYS 72 -17.439 -14.155 -13.585 595 H THR 73 H THR 73 -17.638 -8.302 -11.704 596 HA THR 73 HA THR 73 -18.508 -8.150 -8.908 597 HB THR 73 HB THR 73 -20.570 -7.219 -9.692 598 HG1 THR 73 HG1 THR 73 -19.678 -8.189 -12.180 599 HG21 THR 73 3HG2 THR 73 -18.778 -5.613 -9.583 600 HG22 THR 73 1HG2 THR 73 -19.772 -5.252 -10.994 601 HG23 THR 73 2HG2 THR 73 -18.219 -6.065 -11.193 602 H ILE 74 H ILE 74 -19.410 -9.848 -7.956 603 HA ILE 74 HA ILE 74 -20.656 -11.914 -9.649 604 HB ILE 74 HB ILE 74 -19.050 -12.368 -7.131 605 HG12 ILE 74 1HG1 ILE 74 -17.857 -13.852 -9.062 606 HG13 ILE 74 2HG1 ILE 74 -18.428 -12.491 -10.021 607 HG21 ILE 74 1HG2 ILE 74 -20.458 -14.122 -6.957 608 HG22 ILE 74 2HG2 ILE 74 -20.922 -14.055 -8.657 609 HG23 ILE 74 3HG2 ILE 74 -19.403 -14.818 -8.187 610 HD11 ILE 74 3HD1 ILE 74 -16.060 -12.457 -8.939 611 HD12 ILE 74 1HD1 ILE 74 -17.049 -10.998 -8.967 612 HD13 ILE 74 2HD1 ILE 74 -16.945 -11.965 -7.495 613 H SER 75 H SER 75 -22.759 -12.047 -9.278 614 HA SER 75 HA SER 75 -23.820 -11.174 -6.691 615 HB2 SER 75 1HB SER 75 -25.126 -10.081 -8.216 616 HB3 SER 75 2HB SER 75 -24.888 -11.309 -9.459 617 HG SER 75 HG SER 75 -26.966 -11.543 -8.820 618 H ILE 76 H ILE 76 -25.528 -12.422 -5.672 619 HA ILE 76 HA ILE 76 -25.267 -15.312 -6.194 620 HB ILE 76 HB ILE 76 -25.757 -14.014 -3.513 621 HG12 ILE 76 1HG1 ILE 76 -23.249 -15.358 -4.540 622 HG13 ILE 76 2HG1 ILE 76 -23.466 -13.615 -4.417 623 HG21 ILE 76 1HG2 ILE 76 -25.176 -16.358 -2.722 624 HG22 ILE 76 2HG2 ILE 76 -26.748 -16.146 -3.491 625 HG23 ILE 76 3HG2 ILE 76 -25.415 -16.865 -4.394 626 HD11 ILE 76 3HD1 ILE 76 -22.554 -15.426 -2.450 627 HD12 ILE 76 1HD1 ILE 76 -22.765 -13.680 -2.326 628 HD13 ILE 76 2HD1 ILE 76 -24.093 -14.761 -1.902 629 HA PRO 77 HA PRO 77 -29.718 -14.094 -6.720 630 HB2 PRO 77 1HB PRO 77 -30.090 -15.549 -8.981 631 HB3 PRO 77 2HB PRO 77 -29.470 -13.894 -8.995 632 HG2 PRO 77 1HG PRO 77 -27.972 -16.478 -9.191 633 HG3 PRO 77 2HG PRO 77 -27.746 -14.981 -10.114 634 HD2 PRO 77 1HD PRO 77 -26.162 -15.658 -8.026 635 HD3 PRO 77 2HD PRO 77 -26.547 -13.972 -8.424 Start of MODEL 7 1 H1 MET 1 H MET 1 -0.399 0.101 -3.118 2 HA MET 1 HA MET 1 2.076 0.170 -3.427 3 HB2 MET 1 1HB MET 1 0.808 1.000 -1.296 4 HB3 MET 1 2HB MET 1 1.549 -0.401 -0.532 5 HG2 MET 1 1HG MET 1 3.731 0.599 -1.627 6 HG3 MET 1 2HG MET 1 2.794 2.090 -1.552 7 HE1 MET 1 3HE MET 1 4.271 3.225 1.640 8 HE2 MET 1 1HE MET 1 5.023 2.886 0.081 9 HE3 MET 1 2HE MET 1 3.419 3.616 0.146 10 H ALA 2 H ALA 2 1.471 -2.446 -4.205 11 HA ALA 2 HA ALA 2 2.360 -4.540 -4.309 12 HB1 ALA 2 1HB ALA 2 4.735 -3.510 -2.793 13 HB2 ALA 2 2HB ALA 2 4.675 -4.734 -4.061 14 HB3 ALA 2 3HB ALA 2 4.428 -3.035 -4.463 15 H ILE 3 H ILE 3 0.530 -4.498 -2.422 16 HA ILE 3 HA ILE 3 1.735 -5.665 -0.006 17 HB ILE 3 HB ILE 3 0.174 -3.740 0.299 18 HG12 ILE 3 1HG1 ILE 3 -1.214 -6.061 1.536 19 HG13 ILE 3 2HG1 ILE 3 0.510 -5.897 1.852 20 HG21 ILE 3 1HG2 ILE 3 -1.971 -5.671 -0.563 21 HG22 ILE 3 2HG2 ILE 3 -2.171 -3.986 -0.086 22 HG23 ILE 3 3HG2 ILE 3 -1.333 -4.384 -1.586 23 HD11 ILE 3 3HD1 ILE 3 -1.655 -3.908 2.473 24 HD12 ILE 3 1HD1 ILE 3 -0.684 -4.836 3.615 25 HD13 ILE 3 2HD1 ILE 3 0.070 -3.578 2.636 26 H SER 4 H SER 4 0.907 -7.614 0.853 27 HA SER 4 HA SER 4 0.523 -9.684 -0.931 28 HB2 SER 4 1HB SER 4 -0.205 -9.426 1.985 29 HB3 SER 4 2HB SER 4 -0.435 -10.929 1.092 30 HG SER 4 HG SER 4 1.703 -11.167 0.902 31 H ALA 5 H ALA 5 -1.211 -10.734 -1.806 32 HA ALA 5 HA ALA 5 -3.537 -9.282 -2.358 33 HB1 ALA 5 1HB ALA 5 -2.402 -11.727 -3.169 34 HB2 ALA 5 2HB ALA 5 -4.045 -12.082 -2.634 35 HB3 ALA 5 3HB ALA 5 -3.768 -10.872 -3.887 36 H GLU 6 H GLU 6 -2.723 -11.336 0.302 37 HA GLU 6 HA GLU 6 -5.334 -12.021 1.142 38 HB2 GLU 6 1HB GLU 6 -4.326 -12.681 3.221 39 HB3 GLU 6 2HB GLU 6 -3.246 -13.144 1.914 40 HG2 GLU 6 1HG GLU 6 -2.025 -10.954 2.378 41 HG3 GLU 6 2HG GLU 6 -2.944 -10.905 3.881 42 H GLU 7 H GLU 7 -3.457 -9.136 1.414 43 HA GLU 7 HA GLU 7 -5.078 -8.034 3.552 44 HB2 GLU 7 1HB GLU 7 -2.540 -7.617 3.073 45 HB3 GLU 7 2HB GLU 7 -3.140 -6.429 1.924 46 HG2 GLU 7 1HG GLU 7 -2.941 -5.079 3.719 47 HG3 GLU 7 2HG GLU 7 -4.566 -5.683 4.037 48 H LEU 8 H LEU 8 -4.904 -7.954 0.087 49 HA LEU 8 HA LEU 8 -6.202 -5.599 -0.535 50 HB2 LEU 8 1HB LEU 8 -5.348 -6.849 -2.318 51 HB3 LEU 8 2HB LEU 8 -6.208 -8.306 -1.823 52 HG LEU 8 HG LEU 8 -8.324 -7.283 -2.540 53 HD11 LEU 8 1HD1 LEU 8 -7.475 -4.919 -2.167 54 HD12 LEU 8 2HD1 LEU 8 -8.451 -5.195 -3.609 55 HD13 LEU 8 3HD1 LEU 8 -6.698 -5.063 -3.744 56 HD21 LEU 8 3HD2 LEU 8 -7.480 -8.626 -4.207 57 HD22 LEU 8 1HD2 LEU 8 -6.048 -7.622 -4.441 58 HD23 LEU 8 2HD2 LEU 8 -7.614 -7.080 -5.046 59 H GLU 9 H GLU 9 -7.507 -8.552 0.785 60 HA GLU 9 HA GLU 9 -10.253 -7.836 0.310 61 HB2 GLU 9 1HB GLU 9 -10.817 -9.842 1.470 62 HB3 GLU 9 2HB GLU 9 -9.411 -10.199 0.477 63 HG2 GLU 9 1HG GLU 9 -8.180 -9.513 2.752 64 HG3 GLU 9 2HG GLU 9 -9.695 -10.128 3.410 65 H LYS 10 H LYS 10 -7.946 -7.546 2.928 66 HA LYS 10 HA LYS 10 -9.614 -7.005 5.069 67 HB2 LYS 10 1HB LYS 10 -6.961 -5.682 4.468 68 HB3 LYS 10 2HB LYS 10 -7.735 -5.778 6.044 69 HG2 LYS 10 1HG LYS 10 -7.155 -8.303 4.582 70 HG3 LYS 10 2HG LYS 10 -5.828 -7.441 5.364 71 HD2 LYS 10 1HD LYS 10 -8.362 -8.038 6.849 72 HD3 LYS 10 2HD LYS 10 -7.092 -9.255 6.700 73 HE2 LYS 10 1HE LYS 10 -6.389 -6.503 7.617 74 HE3 LYS 10 2HE LYS 10 -7.147 -7.622 8.749 75 HZ1 LYS 10 3HZ LYS 10 -5.000 -8.833 7.302 76 HZ2 LYS 10 1HZ LYS 10 -5.259 -8.747 8.972 77 HZ3 LYS 10 2HZ LYS 10 -4.486 -7.474 8.169 78 H ILE 11 H ILE 11 -8.815 -5.017 2.330 79 HA ILE 11 HA ILE 11 -9.851 -2.591 3.503 80 HB ILE 11 HB ILE 11 -9.090 -3.189 0.641 81 HG12 ILE 11 1HG1 ILE 11 -7.224 -1.450 1.606 82 HG13 ILE 11 2HG1 ILE 11 -7.565 -2.408 3.043 83 HG21 ILE 11 1HG2 ILE 11 -8.884 -0.577 0.715 84 HG22 ILE 11 2HG2 ILE 11 -10.441 -1.348 0.417 85 HG23 ILE 11 3HG2 ILE 11 -10.056 -0.732 2.024 86 HD11 ILE 11 3HD1 ILE 11 -5.957 -3.057 0.782 87 HD12 ILE 11 1HD1 ILE 11 -6.184 -3.953 2.283 88 HD13 ILE 11 2HD1 ILE 11 -7.272 -4.224 0.921 89 H LEU 12 H LEU 12 -10.974 -5.115 1.342 90 HA LEU 12 HA LEU 12 -13.404 -3.720 0.657 91 HB2 LEU 12 1HB LEU 12 -12.286 -6.436 0.083 92 HB3 LEU 12 2HB LEU 12 -13.980 -6.081 -0.252 93 HG LEU 12 HG LEU 12 -11.642 -4.584 -1.435 94 HD11 LEU 12 1HD1 LEU 12 -13.029 -5.940 -3.432 95 HD12 LEU 12 2HD1 LEU 12 -12.829 -7.116 -2.134 96 HD13 LEU 12 3HD1 LEU 12 -11.418 -6.307 -2.816 97 HD21 LEU 12 3HD2 LEU 12 -13.112 -3.167 -2.330 98 HD22 LEU 12 1HD2 LEU 12 -14.268 -3.794 -1.154 99 HD23 LEU 12 2HD2 LEU 12 -14.215 -4.467 -2.783 100 H LYS 13 H LYS 13 -12.331 -5.580 3.265 101 HA LYS 13 HA LYS 13 -14.829 -6.793 3.970 102 HB2 LYS 13 1HB LYS 13 -12.223 -6.387 5.421 103 HB3 LYS 13 2HB LYS 13 -13.626 -7.077 6.226 104 HG2 LYS 13 1HG LYS 13 -13.503 -8.596 3.978 105 HG3 LYS 13 2HG LYS 13 -11.795 -8.266 4.276 106 HD2 LYS 13 1HD LYS 13 -12.373 -10.289 5.420 107 HD3 LYS 13 2HD LYS 13 -12.134 -9.026 6.630 108 HE2 LYS 13 1HE LYS 13 -14.476 -8.766 6.939 109 HE3 LYS 13 2HE LYS 13 -14.838 -9.760 5.528 110 HZ1 LYS 13 3HZ LYS 13 -13.798 -11.646 6.728 111 HZ2 LYS 13 1HZ LYS 13 -15.197 -11.057 7.474 112 HZ3 LYS 13 2HZ LYS 13 -13.676 -10.668 8.103 113 H LYS 14 H LYS 14 -13.370 -3.705 4.444 114 HA LYS 14 HA LYS 14 -14.538 -2.790 6.769 115 HB2 LYS 14 1HB LYS 14 -13.826 -1.407 4.197 116 HB3 LYS 14 2HB LYS 14 -14.553 -0.518 5.528 117 HG2 LYS 14 1HG LYS 14 -11.979 -2.075 5.659 118 HG3 LYS 14 2HG LYS 14 -12.122 -0.321 5.523 119 HD2 LYS 14 1HD LYS 14 -13.536 -0.493 7.674 120 HD3 LYS 14 2HD LYS 14 -12.824 -2.100 7.835 121 HE2 LYS 14 1HE LYS 14 -10.664 -1.247 8.070 122 HE3 LYS 14 2HE LYS 14 -11.106 0.315 7.382 123 HZ1 LYS 14 3HZ LYS 14 -12.319 -0.591 9.910 124 HZ2 LYS 14 1HZ LYS 14 -12.112 0.985 9.332 125 HZ3 LYS 14 2HZ LYS 14 -10.782 0.114 9.910 126 H SER 15 H SER 15 -15.872 -2.493 3.474 127 HA SER 15 HA SER 15 -18.507 -1.965 4.659 128 HB2 SER 15 1HB SER 15 -17.750 -0.281 3.062 129 HB3 SER 15 2HB SER 15 -17.501 -1.524 1.837 130 HG SER 15 HG SER 15 -19.560 -0.266 1.816 131 H PHE 16 H PHE 16 -16.731 -4.190 2.653 132 HA PHE 16 HA PHE 16 -19.159 -5.837 2.375 133 HB2 PHE 16 1HB PHE 16 -16.737 -6.158 0.626 134 HB3 PHE 16 2HB PHE 16 -18.399 -6.645 0.311 135 HD1 PHE 16 HD2 PHE 16 -19.908 -4.223 0.850 136 HD2 PHE 16 HD1 PHE 16 -16.138 -4.712 -1.065 137 HE1 PHE 16 HE2 PHE 16 -20.280 -2.140 -0.405 138 HE2 PHE 16 HE1 PHE 16 -16.504 -2.629 -2.323 139 HZ PHE 16 HZ PHE 16 -18.577 -1.341 -1.994 140 HA PRO 17 HA PRO 17 -16.174 -8.043 5.187 141 HB2 PRO 17 1HB PRO 17 -18.033 -8.679 7.062 142 HB3 PRO 17 2HB PRO 17 -17.142 -7.152 7.071 143 HG2 PRO 17 1HG PRO 17 -19.908 -7.726 6.080 144 HG3 PRO 17 2HG PRO 17 -19.324 -6.349 7.032 145 HD2 PRO 17 1HD PRO 17 -19.740 -6.200 4.361 146 HD3 PRO 17 2HD PRO 17 -18.471 -5.270 5.183 147 H SER 18 H SER 18 -19.587 -8.942 4.643 148 HA SER 18 HA SER 18 -19.108 -11.733 4.777 149 HB2 SER 18 1HB SER 18 -21.431 -10.455 3.339 150 HB3 SER 18 2HB SER 18 -21.383 -12.008 4.175 151 HG SER 18 HG SER 18 -22.289 -9.890 5.203 152 H SER 19 H SER 19 -18.857 -9.388 2.246 153 HA SER 19 HA SER 19 -19.174 -10.899 -0.041 154 HB2 SER 19 1HB SER 19 -17.627 -8.472 0.669 155 HB3 SER 19 2HB SER 19 -17.135 -9.303 -0.807 156 HG SER 19 HG SER 19 -19.823 -8.606 -0.253 157 H VAL 20 H VAL 20 -17.725 -12.030 -1.399 158 HA VAL 20 HA VAL 20 -15.579 -13.377 0.081 159 HB VAL 20 HB VAL 20 -16.944 -14.176 -2.494 160 HG11 VAL 20 1HG1 VAL 20 -15.758 -16.413 -1.770 161 HG12 VAL 20 2HG1 VAL 20 -14.904 -15.194 -2.718 162 HG13 VAL 20 3HG1 VAL 20 -14.643 -15.301 -0.977 163 HG21 VAL 20 3HG2 VAL 20 -18.554 -14.620 -0.926 164 HG22 VAL 20 1HG2 VAL 20 -17.625 -16.118 -0.849 165 HG23 VAL 20 2HG2 VAL 20 -17.382 -14.866 0.369 166 H ILE 21 H ILE 21 -13.855 -11.994 -0.139 167 HA ILE 21 HA ILE 21 -13.121 -10.940 -2.729 168 HB ILE 21 HB ILE 21 -11.510 -10.830 -0.181 169 HG12 ILE 21 1HG1 ILE 21 -12.622 -8.369 -0.388 170 HG13 ILE 21 2HG1 ILE 21 -13.930 -9.355 -1.033 171 HG21 ILE 21 1HG2 ILE 21 -10.786 -10.162 -2.724 172 HG22 ILE 21 2HG2 ILE 21 -11.385 -8.625 -2.101 173 HG23 ILE 21 3HG2 ILE 21 -10.088 -9.473 -1.258 174 HD11 ILE 21 3HD1 ILE 21 -13.118 -10.691 1.257 175 HD12 ILE 21 1HD1 ILE 21 -13.072 -8.982 1.692 176 HD13 ILE 21 2HD1 ILE 21 -14.559 -9.693 1.061 177 H LYS 22 H LYS 22 -12.165 -12.208 -4.171 178 HA LYS 22 HA LYS 22 -9.979 -13.952 -3.270 179 HB2 LYS 22 1HB LYS 22 -12.247 -15.126 -3.811 180 HB3 LYS 22 2HB LYS 22 -11.802 -14.826 -5.486 181 HG2 LYS 22 1HG LYS 22 -10.980 -16.942 -5.158 182 HG3 LYS 22 2HG LYS 22 -9.558 -15.956 -4.809 183 HD2 LYS 22 1HD LYS 22 -9.615 -17.488 -3.050 184 HD3 LYS 22 2HD LYS 22 -10.357 -16.040 -2.365 185 HE2 LYS 22 1HE LYS 22 -11.680 -17.927 -1.724 186 HE3 LYS 22 2HE LYS 22 -12.586 -17.005 -2.923 187 HZ1 LYS 22 3HZ LYS 22 -11.653 -19.700 -3.040 188 HZ2 LYS 22 1HZ LYS 22 -11.154 -18.810 -4.390 189 HZ3 LYS 22 2HZ LYS 22 -12.798 -18.917 -4.007 190 H ILE 23 H ILE 23 -8.192 -13.936 -4.533 191 HA ILE 23 HA ILE 23 -8.183 -12.057 -6.769 192 HB ILE 23 HB ILE 23 -5.873 -13.410 -5.370 193 HG12 ILE 23 1HG1 ILE 23 -5.574 -10.827 -4.762 194 HG13 ILE 23 2HG1 ILE 23 -7.323 -10.841 -4.956 195 HG21 ILE 23 1HG2 ILE 23 -4.971 -12.916 -7.417 196 HG22 ILE 23 2HG2 ILE 23 -6.048 -11.546 -7.683 197 HG23 ILE 23 3HG2 ILE 23 -4.688 -11.395 -6.570 198 HD11 ILE 23 3HD1 ILE 23 -6.455 -11.194 -2.624 199 HD12 ILE 23 1HD1 ILE 23 -7.596 -12.402 -3.213 200 HD13 ILE 23 2HD1 ILE 23 -5.870 -12.766 -3.171 201 H THR 24 H THR 24 -7.576 -12.586 -8.839 202 HA THR 24 HA THR 24 -7.027 -15.414 -9.415 203 HB THR 24 HB THR 24 -9.046 -13.707 -10.884 204 HG1 THR 24 HG1 THR 24 -10.298 -15.741 -10.155 205 HG21 THR 24 3HG2 THR 24 -7.847 -16.393 -11.479 206 HG22 THR 24 1HG2 THR 24 -8.071 -15.016 -12.557 207 HG23 THR 24 2HG2 THR 24 -9.463 -15.972 -12.047 208 H ASP 25 H ASP 25 -5.708 -15.804 -11.174 209 HA ASP 25 HA ASP 25 -4.215 -13.486 -12.131 210 HB2 ASP 25 1HB ASP 25 -3.191 -15.691 -11.195 211 HB3 ASP 25 2HB ASP 25 -3.536 -16.333 -12.798 212 H LEU 26 H LEU 26 -5.082 -12.533 -13.862 213 HA LEU 26 HA LEU 26 -6.238 -14.208 -15.978 214 HB2 LEU 26 1HB LEU 26 -7.024 -11.884 -16.806 215 HB3 LEU 26 2HB LEU 26 -7.835 -12.643 -15.438 216 HG LEU 26 HG LEU 26 -6.511 -11.213 -13.911 217 HD11 LEU 26 1HD1 LEU 26 -5.506 -10.057 -16.500 218 HD12 LEU 26 2HD1 LEU 26 -4.563 -10.753 -15.183 219 HD13 LEU 26 3HD1 LEU 26 -5.397 -9.217 -14.952 220 HD21 LEU 26 3HD2 LEU 26 -8.798 -10.628 -15.002 221 HD22 LEU 26 1HD2 LEU 26 -7.865 -9.410 -15.872 222 HD23 LEU 26 2HD2 LEU 26 -7.913 -9.389 -14.109 223 H VAL 27 H VAL 27 -3.373 -12.803 -15.216 224 HA VAL 27 HA VAL 27 -2.597 -12.651 -18.043 225 HB VAL 27 HB VAL 27 -1.113 -10.717 -17.520 226 HG11 VAL 27 1HG1 VAL 27 -3.343 -9.204 -17.029 227 HG12 VAL 27 2HG1 VAL 27 -2.824 -9.778 -18.615 228 HG13 VAL 27 3HG1 VAL 27 -4.027 -10.685 -17.697 229 HG21 VAL 27 3HG2 VAL 27 -2.588 -10.849 -14.906 230 HG22 VAL 27 1HG2 VAL 27 -0.848 -10.794 -15.188 231 HG23 VAL 27 2HG2 VAL 27 -1.834 -9.362 -15.482 232 H GLY 28 H GLY 28 -0.218 -12.778 -18.341 233 HA2 GLY 28 1HA GLY 28 0.853 -14.825 -16.581 234 HA3 GLY 28 2HA GLY 28 1.547 -14.288 -18.104 235 H ASP 29 H ASP 29 0.859 -12.959 -14.866 236 HA ASP 29 HA ASP 29 2.128 -11.725 -13.437 237 HB2 ASP 29 1HB ASP 29 3.757 -13.646 -13.971 238 HB3 ASP 29 2HB ASP 29 4.567 -12.493 -15.027 239 H GLN 30 H GLN 30 0.933 -10.048 -14.856 240 HA GLN 30 HA GLN 30 2.890 -8.330 -16.226 241 HB2 GLN 30 1HB GLN 30 0.831 -9.148 -17.477 242 HB3 GLN 30 2HB GLN 30 -0.112 -8.113 -16.413 243 HG2 GLN 30 1HG GLN 30 1.908 -6.471 -17.383 244 HG3 GLN 30 2HG GLN 30 1.410 -7.442 -18.767 245 HE21 GLN 30 2HE2 GLN 30 -0.348 -6.081 -16.004 246 HE22 GLN 30 1HE2 GLN 30 -1.511 -5.220 -16.948 247 H ASP 31 H ASP 31 2.461 -8.528 -13.315 248 HA ASP 31 HA ASP 31 2.362 -7.152 -11.506 249 HB2 ASP 31 1HB ASP 31 2.363 -4.792 -13.372 250 HB3 ASP 31 2HB ASP 31 3.065 -4.921 -11.762 251 H HIS 32 H HIS 32 -0.095 -7.933 -13.031 252 HA HIS 32 HA HIS 32 -1.887 -5.809 -12.049 253 HB2 HIS 32 1HB HIS 32 -1.726 -6.742 -14.614 254 HB3 HIS 32 2HB HIS 32 -3.013 -7.748 -13.956 255 HD1 HIS 32 HD1 HIS 32 -5.279 -6.744 -13.983 256 HD2 HIS 32 HD2 HIS 32 -2.298 -3.861 -14.234 257 HE1 HIS 32 HE1 HIS 32 -6.481 -4.563 -14.335 258 H TYR 33 H TYR 33 -4.171 -6.762 -11.603 259 HA TYR 33 HA TYR 33 -4.139 -9.445 -10.509 260 HB2 TYR 33 1HB TYR 33 -4.467 -7.009 -8.749 261 HB3 TYR 33 2HB TYR 33 -4.890 -8.645 -8.254 262 HD1 TYR 33 HD2 TYR 33 -3.028 -10.403 -8.263 263 HD2 TYR 33 HD1 TYR 33 -2.279 -6.221 -8.494 264 HE1 TYR 33 HE2 TYR 33 -0.713 -10.782 -7.523 265 HE2 TYR 33 HE1 TYR 33 0.038 -6.589 -7.756 266 HH TYR 33 HH TYR 33 1.683 -8.311 -7.641 267 H ALA 34 H ALA 34 -6.165 -10.328 -10.298 268 HA ALA 34 HA ALA 34 -8.374 -8.674 -11.316 269 HB1 ALA 34 1HB ALA 34 -8.907 -11.520 -11.224 270 HB2 ALA 34 2HB ALA 34 -8.991 -10.398 -12.582 271 HB3 ALA 34 3HB ALA 34 -7.454 -11.148 -12.151 272 H LEU 35 H LEU 35 -9.898 -8.069 -9.936 273 HA LEU 35 HA LEU 35 -10.066 -9.369 -7.328 274 HB2 LEU 35 1HB LEU 35 -10.115 -6.751 -8.044 275 HB3 LEU 35 2HB LEU 35 -11.838 -7.098 -7.914 276 HG LEU 35 HG LEU 35 -9.747 -7.281 -5.755 277 HD11 LEU 35 1HD1 LEU 35 -11.023 -5.602 -4.664 278 HD12 LEU 35 2HD1 LEU 35 -12.334 -5.745 -5.835 279 HD13 LEU 35 3HD1 LEU 35 -10.782 -5.067 -6.328 280 HD21 LEU 35 3HD2 LEU 35 -12.540 -8.381 -5.847 281 HD22 LEU 35 1HD2 LEU 35 -11.752 -7.952 -4.329 282 HD23 LEU 35 2HD2 LEU 35 -11.049 -9.192 -5.367 283 H GLU 36 H GLU 36 -11.799 -10.498 -6.614 284 HA GLU 36 HA GLU 36 -14.175 -10.628 -8.337 285 HB2 GLU 36 1HB GLU 36 -12.633 -12.964 -7.206 286 HB3 GLU 36 2HB GLU 36 -14.263 -13.102 -7.849 287 HG2 GLU 36 1HG GLU 36 -12.884 -13.765 -9.602 288 HG3 GLU 36 2HG GLU 36 -13.326 -12.105 -9.995 289 H ILE 37 H ILE 37 -15.618 -9.637 -7.046 290 HA ILE 37 HA ILE 37 -15.790 -10.480 -4.235 291 HB ILE 37 HB ILE 37 -15.531 -8.052 -4.640 292 HG12 ILE 37 1HG1 ILE 37 -18.266 -8.080 -3.605 293 HG13 ILE 37 2HG1 ILE 37 -17.255 -9.338 -2.902 294 HG21 ILE 37 1HG2 ILE 37 -18.304 -7.760 -5.591 295 HG22 ILE 37 2HG2 ILE 37 -16.859 -6.833 -5.994 296 HG23 ILE 37 3HG2 ILE 37 -17.150 -8.392 -6.766 297 HD11 ILE 37 3HD1 ILE 37 -17.420 -6.888 -1.895 298 HD12 ILE 37 1HD1 ILE 37 -15.951 -7.859 -1.799 299 HD13 ILE 37 2HD1 ILE 37 -16.109 -6.618 -3.043 300 H SER 38 H SER 38 -17.529 -11.536 -3.482 301 HA SER 38 HA SER 38 -19.927 -11.689 -5.173 302 HB2 SER 38 1HB SER 38 -19.064 -13.762 -5.716 303 HB3 SER 38 2HB SER 38 -18.237 -13.942 -4.169 304 HG SER 38 HG SER 38 -20.052 -15.319 -4.323 305 H ASP 39 H ASP 39 -21.784 -11.440 -4.094 306 HA ASP 39 HA ASP 39 -22.286 -12.307 -1.469 307 HB2 ASP 39 1HB ASP 39 -20.659 -10.253 -1.219 308 HB3 ASP 39 2HB ASP 39 -22.123 -9.319 -1.510 309 H ALA 40 H ALA 40 -24.345 -11.219 -0.579 310 HA ALA 40 HA ALA 40 -26.220 -11.022 -2.808 311 HB1 ALA 40 1HB ALA 40 -26.905 -11.176 0.117 312 HB2 ALA 40 2HB ALA 40 -27.934 -11.551 -1.266 313 HB3 ALA 40 3HB ALA 40 -26.573 -12.600 -0.870 314 H GLN 41 H GLN 41 -24.565 -8.779 -2.438 315 HA GLN 41 HA GLN 41 -26.483 -6.786 -1.424 316 HB2 GLN 41 1HB GLN 41 -24.548 -5.311 -1.021 317 HB3 GLN 41 2HB GLN 41 -24.455 -6.798 -0.088 318 HG2 GLN 41 1HG GLN 41 -23.039 -7.605 -2.156 319 HG3 GLN 41 2HG GLN 41 -22.785 -5.872 -2.360 320 HE21 GLN 41 2HE2 GLN 41 -23.006 -8.002 0.470 321 HE22 GLN 41 1HE2 GLN 41 -21.496 -7.526 1.160 322 H PHE 42 H PHE 42 -24.456 -7.794 -4.056 323 HA PHE 42 HA PHE 42 -25.009 -5.363 -5.572 324 HB2 PHE 42 1HB PHE 42 -23.451 -7.775 -6.502 325 HB3 PHE 42 2HB PHE 42 -23.404 -6.141 -7.158 326 HD1 PHE 42 HD2 PHE 42 -22.326 -4.326 -5.857 327 HD2 PHE 42 HD1 PHE 42 -22.112 -8.405 -4.661 328 HE1 PHE 42 HE2 PHE 42 -20.426 -3.791 -4.388 329 HE2 PHE 42 HE1 PHE 42 -20.212 -7.877 -3.189 330 HZ PHE 42 HZ PHE 42 -19.365 -5.568 -3.052 331 H ASN 43 H ASN 43 -27.283 -6.838 -4.974 332 HA ASN 43 HA ASN 43 -27.944 -8.400 -7.341 333 HB2 ASN 43 1HB ASN 43 -29.236 -7.927 -4.685 334 HB3 ASN 43 2HB ASN 43 -30.233 -8.468 -6.031 335 HD21 ASN 43 2HD2 ASN 43 -28.656 -9.533 -3.437 336 HD22 ASN 43 1HD2 ASN 43 -28.240 -11.130 -3.948 337 H GLY 44 H GLY 44 -28.444 -5.238 -6.020 338 HA2 GLY 44 1HA GLY 44 -30.433 -4.652 -8.116 339 HA3 GLY 44 2HA GLY 44 -30.223 -3.722 -6.640 340 H LEU 45 H LEU 45 -27.211 -3.995 -7.100 341 HA LEU 45 HA LEU 45 -26.925 -1.513 -8.505 342 HB2 LEU 45 1HB LEU 45 -24.876 -3.438 -7.420 343 HB3 LEU 45 2HB LEU 45 -24.503 -1.853 -8.093 344 HG LEU 45 HG LEU 45 -26.431 -1.948 -5.842 345 HD11 LEU 45 1HD1 LEU 45 -24.469 -1.896 -4.254 346 HD12 LEU 45 2HD1 LEU 45 -23.497 -2.547 -5.574 347 HD13 LEU 45 3HD1 LEU 45 -24.863 -3.470 -4.947 348 HD21 LEU 45 3HD2 LEU 45 -25.548 0.165 -5.346 349 HD22 LEU 45 1HD2 LEU 45 -25.605 0.110 -7.108 350 HD23 LEU 45 2HD2 LEU 45 -24.074 -0.137 -6.267 351 H SER 46 H SER 46 -25.267 -1.261 -10.252 352 HA SER 46 HA SER 46 -25.523 -3.470 -12.185 353 HB2 SER 46 1HB SER 46 -26.668 -1.311 -12.776 354 HB3 SER 46 2HB SER 46 -25.081 -0.544 -12.816 355 HG SER 46 HG SER 46 -25.135 -1.181 -14.827 356 H LEU 47 H LEU 47 -23.722 -3.162 -13.982 357 HA LEU 47 HA LEU 47 -21.297 -3.913 -12.859 358 HB2 LEU 47 1HB LEU 47 -22.097 -2.922 -15.562 359 HB3 LEU 47 2HB LEU 47 -20.394 -3.187 -15.194 360 HG LEU 47 HG LEU 47 -21.316 -5.099 -16.358 361 HD11 LEU 47 1HD1 LEU 47 -21.163 -6.412 -13.792 362 HD12 LEU 47 2HD1 LEU 47 -19.921 -5.171 -13.954 363 HD13 LEU 47 3HD1 LEU 47 -20.041 -6.460 -15.152 364 HD21 LEU 47 3HD2 LEU 47 -23.670 -4.690 -15.530 365 HD22 LEU 47 1HD2 LEU 47 -23.191 -5.506 -14.041 366 HD23 LEU 47 2HD2 LEU 47 -23.145 -6.374 -15.576 367 H ILE 48 H ILE 48 -22.575 -0.755 -13.485 368 HA ILE 48 HA ILE 48 -20.028 0.587 -13.255 369 HB ILE 48 HB ILE 48 -22.830 1.716 -13.262 370 HG12 ILE 48 1HG1 ILE 48 -22.286 0.624 -15.368 371 HG13 ILE 48 2HG1 ILE 48 -22.280 2.371 -15.588 372 HG21 ILE 48 1HG2 ILE 48 -21.744 3.490 -12.381 373 HG22 ILE 48 2HG2 ILE 48 -20.166 2.941 -12.944 374 HG23 ILE 48 3HG2 ILE 48 -21.267 3.752 -14.058 375 HD11 ILE 48 3HD1 ILE 48 -19.853 0.626 -15.246 376 HD12 ILE 48 1HD1 ILE 48 -20.430 1.326 -16.758 377 HD13 ILE 48 2HD1 ILE 48 -19.844 2.375 -15.467 378 H ASN 49 H ASN 49 -23.034 0.637 -11.328 379 HA ASN 49 HA ASN 49 -22.009 2.033 -9.145 380 HB2 ASN 49 1HB ASN 49 -24.143 -0.101 -8.987 381 HB3 ASN 49 2HB ASN 49 -23.941 1.292 -7.929 382 HD21 ASN 49 2HD2 ASN 49 -26.334 0.754 -9.159 383 HD22 ASN 49 1HD2 ASN 49 -26.659 1.971 -10.342 384 H GLN 50 H GLN 50 -21.571 -1.251 -10.102 385 HA GLN 50 HA GLN 50 -20.741 -2.190 -7.508 386 HB2 GLN 50 1HB GLN 50 -20.752 -3.376 -10.269 387 HB3 GLN 50 2HB GLN 50 -19.923 -4.181 -8.943 388 HG2 GLN 50 1HG GLN 50 -21.839 -4.822 -7.952 389 HG3 GLN 50 2HG GLN 50 -22.697 -3.352 -8.411 390 HE21 GLN 50 2HE2 GLN 50 -24.334 -5.158 -8.742 391 HE22 GLN 50 1HE2 GLN 50 -24.418 -5.827 -10.333 392 H HIS 51 H HIS 51 -19.226 -0.880 -10.368 393 HA HIS 51 HA HIS 51 -16.555 -1.595 -9.557 394 HB2 HIS 51 1HB HIS 51 -17.527 -1.142 -11.967 395 HB3 HIS 51 2HB HIS 51 -17.106 0.526 -11.593 396 HD1 HIS 51 HD1 HIS 51 -14.555 1.047 -11.249 397 HD2 HIS 51 HD2 HIS 51 -15.397 -2.801 -12.570 398 HE1 HIS 51 HE1 HIS 51 -12.364 0.121 -12.063 399 H LYS 52 H LYS 52 -18.696 1.125 -9.194 400 HA LYS 52 HA LYS 52 -16.633 2.942 -8.328 401 HB2 LYS 52 1HB LYS 52 -18.331 4.548 -8.105 402 HB3 LYS 52 2HB LYS 52 -18.842 3.564 -9.469 403 HG2 LYS 52 1HG LYS 52 -20.390 2.352 -8.043 404 HG3 LYS 52 2HG LYS 52 -19.851 3.285 -6.645 405 HD2 LYS 52 1HD LYS 52 -21.959 4.147 -7.551 406 HD3 LYS 52 2HD LYS 52 -20.661 5.336 -7.682 407 HE2 LYS 52 1HE LYS 52 -20.645 5.264 -9.943 408 HE3 LYS 52 2HE LYS 52 -21.010 3.541 -9.997 409 HZ1 LYS 52 3HZ LYS 52 -23.235 4.914 -8.970 410 HZ2 LYS 52 1HZ LYS 52 -23.117 4.021 -10.402 411 HZ3 LYS 52 2HZ LYS 52 -22.756 5.673 -10.403 412 H LEU 53 H LEU 53 -18.957 0.787 -6.836 413 HA LEU 53 HA LEU 53 -18.875 1.743 -4.214 414 HB2 LEU 53 1HB LEU 53 -19.635 -0.749 -5.557 415 HB3 LEU 53 2HB LEU 53 -19.132 -0.952 -3.880 416 HG LEU 53 HG LEU 53 -21.364 0.830 -4.856 417 HD11 LEU 53 1HD1 LEU 53 -21.549 -1.674 -3.199 418 HD12 LEU 53 2HD1 LEU 53 -21.749 -1.654 -4.950 419 HD13 LEU 53 3HD1 LEU 53 -22.864 -0.750 -3.925 420 HD21 LEU 53 3HD2 LEU 53 -21.807 0.757 -2.280 421 HD22 LEU 53 1HD2 LEU 53 -20.654 1.909 -2.954 422 HD23 LEU 53 2HD2 LEU 53 -20.076 0.425 -2.195 423 H VAL 54 H VAL 54 -16.959 -0.887 -5.676 424 HA VAL 54 HA VAL 54 -15.358 -1.506 -3.514 425 HB VAL 54 HB VAL 54 -13.645 -2.239 -5.175 426 HG11 VAL 54 1HG1 VAL 54 -16.171 -3.265 -4.672 427 HG12 VAL 54 2HG1 VAL 54 -16.011 -3.344 -6.427 428 HG13 VAL 54 3HG1 VAL 54 -14.812 -4.124 -5.394 429 HG21 VAL 54 3HG2 VAL 54 -13.991 -0.473 -6.830 430 HG22 VAL 54 1HG2 VAL 54 -14.163 -2.071 -7.557 431 HG23 VAL 54 2HG2 VAL 54 -15.596 -1.113 -7.183 432 H LYS 55 H LYS 55 -15.108 1.175 -5.755 433 HA LYS 55 HA LYS 55 -12.511 2.002 -4.835 434 HB2 LYS 55 1HB LYS 55 -14.572 3.416 -6.536 435 HB3 LYS 55 2HB LYS 55 -12.954 4.026 -6.218 436 HG2 LYS 55 1HG LYS 55 -13.369 1.325 -7.439 437 HG3 LYS 55 2HG LYS 55 -13.393 2.790 -8.423 438 HD2 LYS 55 1HD LYS 55 -11.174 2.430 -8.571 439 HD3 LYS 55 2HD LYS 55 -11.137 3.188 -6.978 440 HE2 LYS 55 1HE LYS 55 -10.522 1.287 -5.980 441 HE3 LYS 55 2HE LYS 55 -11.729 0.344 -6.853 442 HZ1 LYS 55 3HZ LYS 55 -9.364 1.244 -8.323 443 HZ2 LYS 55 1HZ LYS 55 -10.272 -0.173 -8.501 444 HZ3 LYS 55 2HZ LYS 55 -9.172 -0.029 -7.224 445 H ASN 56 H ASN 56 -15.835 2.712 -4.050 446 HA ASN 56 HA ASN 56 -15.288 5.084 -2.549 447 HB2 ASN 56 1HB ASN 56 -17.702 3.261 -2.455 448 HB3 ASN 56 2HB ASN 56 -17.611 4.890 -1.790 449 HD21 ASN 56 2HD2 ASN 56 -19.286 3.625 -3.921 450 HD22 ASN 56 1HD2 ASN 56 -19.110 4.666 -5.289 451 H ALA 57 H ALA 57 -15.823 1.680 -1.734 452 HA ALA 57 HA ALA 57 -15.804 1.928 1.052 453 HB1 ALA 57 1HB ALA 57 -16.246 -0.118 -0.590 454 HB2 ALA 57 2HB ALA 57 -14.582 -0.494 -0.141 455 HB3 ALA 57 3HB ALA 57 -15.819 -0.343 1.107 456 H LEU 58 H LEU 58 -13.259 2.213 -1.231 457 HA LEU 58 HA LEU 58 -11.241 1.980 0.897 458 HB2 LEU 58 1HB LEU 58 -9.602 1.812 -0.942 459 HB3 LEU 58 2HB LEU 58 -10.793 0.513 -0.942 460 HG LEU 58 HG LEU 58 -12.011 1.996 -2.704 461 HD11 LEU 58 1HD1 LEU 58 -10.156 3.116 -4.119 462 HD12 LEU 58 2HD1 LEU 58 -9.264 3.171 -2.599 463 HD13 LEU 58 3HD1 LEU 58 -10.824 3.981 -2.734 464 HD21 LEU 58 3HD2 LEU 58 -11.259 0.531 -4.241 465 HD22 LEU 58 1HD2 LEU 58 -10.481 -0.221 -2.848 466 HD23 LEU 58 2HD2 LEU 58 -9.563 0.867 -3.889 467 H SER 59 H SER 59 -12.922 4.195 -1.032 468 HA SER 59 HA SER 59 -10.845 6.232 -0.947 469 HB2 SER 59 1HB SER 59 -12.193 6.096 -2.971 470 HB3 SER 59 2HB SER 59 -13.671 6.303 -2.032 471 HG SER 59 HG SER 59 -13.371 8.356 -2.290 472 H GLU 60 H GLU 60 -13.818 5.372 0.670 473 HA GLU 60 HA GLU 60 -13.886 7.876 2.152 474 HB2 GLU 60 1HB GLU 60 -15.973 7.106 3.059 475 HB3 GLU 60 2HB GLU 60 -15.981 6.798 1.329 476 HG2 GLU 60 1HG GLU 60 -15.082 4.442 2.096 477 HG3 GLU 60 2HG GLU 60 -15.890 4.889 3.598 478 H ILE 61 H ILE 61 -13.105 4.489 2.632 479 HA ILE 61 HA ILE 61 -12.749 4.777 5.481 480 HB ILE 61 HB ILE 61 -11.946 2.490 3.679 481 HG12 ILE 61 1HG1 ILE 61 -14.356 2.884 3.599 482 HG13 ILE 61 2HG1 ILE 61 -14.008 1.409 4.493 483 HG21 ILE 61 1HG2 ILE 61 -10.864 1.758 5.482 484 HG22 ILE 61 2HG2 ILE 61 -11.548 3.027 6.496 485 HG23 ILE 61 3HG2 ILE 61 -12.445 1.532 6.230 486 HD11 ILE 61 3HD1 ILE 61 -14.720 4.087 5.662 487 HD12 ILE 61 1HD1 ILE 61 -15.745 2.654 5.596 488 HD13 ILE 61 2HD1 ILE 61 -14.292 2.653 6.595 489 H LEU 62 H LEU 62 -10.849 5.229 2.667 490 HA LEU 62 HA LEU 62 -8.671 5.781 2.320 491 HB2 LEU 62 1HB LEU 62 -9.109 6.632 5.154 492 HB3 LEU 62 2HB LEU 62 -7.508 6.759 4.428 493 HG LEU 62 HG LEU 62 -8.645 8.889 4.322 494 HD11 LEU 62 1HD1 LEU 62 -8.817 7.949 1.507 495 HD12 LEU 62 2HD1 LEU 62 -7.267 7.833 2.340 496 HD13 LEU 62 3HD1 LEU 62 -8.064 9.398 2.174 497 HD21 LEU 62 3HD2 LEU 62 -10.704 9.187 3.063 498 HD22 LEU 62 1HD2 LEU 62 -10.948 8.048 4.388 499 HD23 LEU 62 2HD2 LEU 62 -10.774 7.455 2.736 500 H ASN 63 H ASN 63 -8.872 3.171 2.432 501 HA ASN 63 HA ASN 63 -6.918 2.171 4.375 502 HB2 ASN 63 1HB ASN 63 -9.149 0.962 2.846 503 HB3 ASN 63 2HB ASN 63 -7.732 -0.057 3.083 504 HD21 ASN 63 2HD2 ASN 63 -10.115 -0.777 4.162 505 HD22 ASN 63 1HD2 ASN 63 -10.061 -0.616 5.881 506 H LYS 64 H LYS 64 -7.365 2.835 1.008 507 HA LYS 64 HA LYS 64 -4.666 1.781 0.471 508 HB2 LYS 64 1HB LYS 64 -6.438 0.424 -0.620 509 HB3 LYS 64 2HB LYS 64 -6.980 1.863 -1.474 510 HG2 LYS 64 1HG LYS 64 -5.598 0.456 -2.896 511 HG3 LYS 64 2HG LYS 64 -4.829 2.018 -2.605 512 HD2 LYS 64 1HD LYS 64 -3.205 0.208 -2.444 513 HD3 LYS 64 2HD LYS 64 -3.419 0.997 -0.879 514 HE2 LYS 64 1HE LYS 64 -4.918 -0.801 -0.177 515 HE3 LYS 64 2HE LYS 64 -4.727 -1.582 -1.746 516 HZ1 LYS 64 3HZ LYS 64 -3.264 -2.209 0.366 517 HZ2 LYS 64 1HZ LYS 64 -2.280 -0.995 -0.284 518 HZ3 LYS 64 2HZ LYS 64 -2.686 -2.345 -1.218 519 H LYS 65 H LYS 65 -3.423 2.934 -1.098 520 HA LYS 65 HA LYS 65 -3.980 5.787 -1.058 521 HB2 LYS 65 1HB LYS 65 -1.579 4.162 -1.888 522 HB3 LYS 65 2HB LYS 65 -1.673 5.901 -2.132 523 HG2 LYS 65 1HG LYS 65 -1.915 4.534 0.539 524 HG3 LYS 65 2HG LYS 65 -0.434 5.254 -0.097 525 HD2 LYS 65 1HD LYS 65 -1.694 7.420 -0.293 526 HD3 LYS 65 2HD LYS 65 -3.015 6.652 0.590 527 HE2 LYS 65 1HE LYS 65 -1.791 7.789 2.231 528 HE3 LYS 65 2HE LYS 65 -1.270 6.111 2.375 529 HZ1 LYS 65 3HZ LYS 65 0.642 6.744 0.902 530 HZ2 LYS 65 1HZ LYS 65 0.663 7.431 2.449 531 HZ3 LYS 65 2HZ LYS 65 0.191 8.360 1.117 532 H LEU 66 H LEU 66 -2.586 3.773 -3.638 533 HA LEU 66 HA LEU 66 -4.686 4.504 -5.482 534 HB2 LEU 66 1HB LEU 66 -1.912 5.622 -5.676 535 HB3 LEU 66 2HB LEU 66 -2.899 5.384 -7.116 536 HG LEU 66 HG LEU 66 -4.617 6.807 -5.610 537 HD11 LEU 66 1HD1 LEU 66 -3.687 7.927 -3.939 538 HD12 LEU 66 2HD1 LEU 66 -2.421 8.544 -5.000 539 HD13 LEU 66 3HD1 LEU 66 -2.209 6.996 -4.183 540 HD21 LEU 66 3HD2 LEU 66 -2.439 8.120 -7.218 541 HD22 LEU 66 1HD2 LEU 66 -4.107 8.651 -7.003 542 HD23 LEU 66 2HD2 LEU 66 -3.758 7.204 -7.949 543 H HIS 67 H HIS 67 -4.996 2.915 -6.911 544 HA HIS 67 HA HIS 67 -2.893 1.365 -8.037 545 HB2 HIS 67 1HB HIS 67 -3.318 0.463 -5.602 546 HB3 HIS 67 2HB HIS 67 -4.714 -0.307 -6.349 547 HD1 HIS 67 HD1 HIS 67 -3.829 -2.684 -6.153 548 HD2 HIS 67 HD2 HIS 67 -1.264 -0.138 -8.202 549 HE1 HIS 67 HE1 HIS 67 -2.087 -4.174 -7.187 550 H SER 68 H SER 68 -3.547 0.396 -9.890 551 HA SER 68 HA SER 68 -6.431 0.500 -10.483 552 HB2 SER 68 1HB SER 68 -5.559 0.504 -12.925 553 HB3 SER 68 2HB SER 68 -5.416 1.989 -11.984 554 HG SER 68 HG SER 68 -3.259 1.566 -11.666 555 H ILE 69 H ILE 69 -7.408 -1.395 -10.649 556 HA ILE 69 HA ILE 69 -6.056 -3.633 -11.926 557 HB ILE 69 HB ILE 69 -6.748 -5.195 -10.100 558 HG12 ILE 69 1HG1 ILE 69 -7.141 -2.623 -8.555 559 HG13 ILE 69 2HG1 ILE 69 -8.413 -3.745 -9.025 560 HG21 ILE 69 1HG2 ILE 69 -4.850 -4.679 -8.643 561 HG22 ILE 69 2HG2 ILE 69 -4.435 -4.477 -10.344 562 HG23 ILE 69 3HG2 ILE 69 -4.756 -3.063 -9.341 563 HD11 ILE 69 3HD1 ILE 69 -7.008 -5.469 -7.681 564 HD12 ILE 69 1HD1 ILE 69 -6.311 -4.031 -6.935 565 HD13 ILE 69 2HD1 ILE 69 -8.048 -4.322 -6.837 566 H SER 70 H SER 70 -7.610 -5.540 -12.125 567 HA SER 70 HA SER 70 -10.078 -4.535 -13.219 568 HB2 SER 70 1HB SER 70 -9.056 -6.227 -14.518 569 HB3 SER 70 2HB SER 70 -8.797 -7.263 -13.114 570 HG SER 70 HG SER 70 -11.210 -6.694 -14.468 571 H ILE 71 H ILE 71 -12.117 -4.810 -12.456 572 HA ILE 71 HA ILE 71 -12.400 -6.174 -9.858 573 HB ILE 71 HB ILE 71 -13.837 -3.681 -10.779 574 HG12 ILE 71 1HG1 ILE 71 -12.204 -3.750 -8.301 575 HG13 ILE 71 2HG1 ILE 71 -11.322 -3.779 -9.824 576 HG21 ILE 71 1HG2 ILE 71 -14.836 -3.678 -8.536 577 HG22 ILE 71 2HG2 ILE 71 -15.296 -5.106 -9.462 578 HG23 ILE 71 3HG2 ILE 71 -14.069 -5.231 -8.202 579 HD11 ILE 71 3HD1 ILE 71 -11.732 -1.629 -10.225 580 HD12 ILE 71 1HD1 ILE 71 -13.421 -1.761 -9.736 581 HD13 ILE 71 2HD1 ILE 71 -12.165 -1.541 -8.518 582 H LYS 72 H LYS 72 -13.661 -7.897 -9.988 583 HA LYS 72 HA LYS 72 -15.655 -8.055 -12.134 584 HB2 LYS 72 1HB LYS 72 -13.993 -9.881 -11.963 585 HB3 LYS 72 2HB LYS 72 -14.574 -10.239 -10.342 586 HG2 LYS 72 1HG LYS 72 -16.808 -10.724 -11.310 587 HG3 LYS 72 2HG LYS 72 -16.111 -10.504 -12.917 588 HD2 LYS 72 1HD LYS 72 -14.593 -12.343 -12.560 589 HD3 LYS 72 2HD LYS 72 -15.126 -12.506 -10.885 590 HE2 LYS 72 1HE LYS 72 -16.161 -14.205 -12.280 591 HE3 LYS 72 2HE LYS 72 -17.376 -13.085 -11.665 592 HZ1 LYS 72 3HZ LYS 72 -16.426 -12.129 -14.126 593 HZ2 LYS 72 1HZ LYS 72 -17.986 -12.651 -13.732 594 HZ3 LYS 72 2HZ LYS 72 -16.848 -13.756 -14.319 595 H THR 73 H THR 73 -17.805 -8.511 -11.735 596 HA THR 73 HA THR 73 -18.661 -8.147 -8.941 597 HB THR 73 HB THR 73 -20.683 -7.154 -9.713 598 HG1 THR 73 HG1 THR 73 -21.461 -7.512 -11.661 599 HG21 THR 73 3HG2 THR 73 -18.787 -5.635 -9.727 600 HG22 THR 73 1HG2 THR 73 -19.874 -5.248 -11.059 601 HG23 THR 73 2HG2 THR 73 -18.377 -6.125 -11.371 602 H ILE 74 H ILE 74 -19.668 -9.777 -7.966 603 HA ILE 74 HA ILE 74 -20.992 -11.817 -9.623 604 HB ILE 74 HB ILE 74 -19.272 -12.370 -7.202 605 HG12 ILE 74 1HG1 ILE 74 -18.199 -13.827 -9.216 606 HG13 ILE 74 2HG1 ILE 74 -18.788 -12.437 -10.122 607 HG21 ILE 74 1HG2 ILE 74 -19.802 -14.761 -8.472 608 HG22 ILE 74 2HG2 ILE 74 -20.553 -14.181 -6.986 609 HG23 ILE 74 3HG2 ILE 74 -21.343 -13.906 -8.538 610 HD11 ILE 74 3HD1 ILE 74 -16.570 -11.941 -9.570 611 HD12 ILE 74 1HD1 ILE 74 -17.548 -11.006 -8.438 612 HD13 ILE 74 2HD1 ILE 74 -16.769 -12.498 -7.909 613 H SER 75 H SER 75 -23.009 -12.272 -9.021 614 HA SER 75 HA SER 75 -23.862 -11.506 -6.306 615 HB2 SER 75 1HB SER 75 -26.074 -10.929 -7.269 616 HB3 SER 75 2HB SER 75 -24.779 -9.923 -7.919 617 HG SER 75 HG SER 75 -25.921 -10.575 -9.666 618 H ILE 76 H ILE 76 -24.788 -13.063 -5.141 619 HA ILE 76 HA ILE 76 -25.873 -15.414 -6.543 620 HB ILE 76 HB ILE 76 -23.730 -16.080 -5.663 621 HG12 ILE 76 1HG1 ILE 76 -24.408 -17.934 -4.255 622 HG13 ILE 76 2HG1 ILE 76 -25.894 -17.101 -3.812 623 HG21 ILE 76 1HG2 ILE 76 -24.155 -15.866 -2.848 624 HG22 ILE 76 2HG2 ILE 76 -22.859 -15.186 -3.830 625 HG23 ILE 76 3HG2 ILE 76 -24.351 -14.277 -3.587 626 HD11 ILE 76 3HD1 ILE 76 -25.251 -17.871 -6.639 627 HD12 ILE 76 1HD1 ILE 76 -26.099 -18.939 -5.521 628 HD13 ILE 76 2HD1 ILE 76 -26.805 -17.384 -5.963 629 HA PRO 77 HA PRO 77 -29.086 -13.708 -3.710 630 HB2 PRO 77 1HB PRO 77 -31.147 -14.211 -5.404 631 HB3 PRO 77 2HB PRO 77 -30.169 -12.742 -5.491 632 HG2 PRO 77 1HG PRO 77 -29.984 -15.241 -7.129 633 HG3 PRO 77 2HG PRO 77 -29.881 -13.551 -7.653 634 HD2 PRO 77 1HD PRO 77 -27.690 -15.103 -7.303 635 HD3 PRO 77 2HD PRO 77 -27.677 -13.353 -7.006 Start of MODEL 8 1 H1 MET 1 H MET 1 7.623 -2.489 2.832 2 HA MET 1 HA MET 1 8.573 -4.464 1.090 3 HB2 MET 1 1HB MET 1 9.308 -5.470 3.279 4 HB3 MET 1 2HB MET 1 7.609 -5.608 3.713 5 HG2 MET 1 1HG MET 1 7.216 -7.094 1.850 6 HG3 MET 1 2HG MET 1 8.883 -6.898 1.312 7 HE1 MET 1 3HE MET 1 7.193 -10.089 2.878 8 HE2 MET 1 1HE MET 1 7.007 -9.367 4.476 9 HE3 MET 1 2HE MET 1 6.369 -8.539 3.056 10 H ALA 2 H ALA 2 6.943 -5.203 -0.176 11 HA ALA 2 HA ALA 2 4.464 -3.965 -0.173 12 HB1 ALA 2 1HB ALA 2 4.374 -6.614 -1.368 13 HB2 ALA 2 2HB ALA 2 4.194 -5.026 -2.116 14 HB3 ALA 2 3HB ALA 2 5.803 -5.697 -1.847 15 H ILE 3 H ILE 3 2.315 -5.154 -0.075 16 HA ILE 3 HA ILE 3 2.217 -6.653 2.450 17 HB ILE 3 HB ILE 3 0.925 -4.526 2.315 18 HG12 ILE 3 1HG1 ILE 3 -1.200 -6.561 2.558 19 HG13 ILE 3 2HG1 ILE 3 0.250 -6.879 3.505 20 HG21 ILE 3 1HG2 ILE 3 -1.272 -5.639 0.781 21 HG22 ILE 3 2HG2 ILE 3 -0.490 -4.064 0.656 22 HG23 ILE 3 3HG2 ILE 3 0.194 -5.457 -0.182 23 HD11 ILE 3 3HD1 ILE 3 -1.626 -4.552 3.680 24 HD12 ILE 3 1HD1 ILE 3 -1.163 -5.700 4.936 25 HD13 ILE 3 2HD1 ILE 3 -0.003 -4.498 4.369 26 H SER 4 H SER 4 0.903 -8.503 2.648 27 HA SER 4 HA SER 4 1.000 -10.290 0.491 28 HB2 SER 4 1HB SER 4 -0.466 -10.333 3.123 29 HB3 SER 4 2HB SER 4 -0.632 -11.646 1.957 30 HG SER 4 HG SER 4 1.291 -12.326 2.468 31 H ALA 5 H ALA 5 -0.580 -11.116 -0.874 32 HA ALA 5 HA ALA 5 -2.487 -9.290 -1.848 33 HB1 ALA 5 1HB ALA 5 -2.822 -10.773 -3.529 34 HB2 ALA 5 2HB ALA 5 -1.319 -11.447 -2.898 35 HB3 ALA 5 3HB ALA 5 -2.865 -12.163 -2.445 36 H GLU 6 H GLU 6 -2.642 -11.692 0.632 37 HA GLU 6 HA GLU 6 -5.418 -12.168 0.656 38 HB2 GLU 6 1HB GLU 6 -5.066 -12.943 2.970 39 HB3 GLU 6 2HB GLU 6 -3.878 -13.609 1.859 40 HG2 GLU 6 1HG GLU 6 -2.498 -11.494 2.665 41 HG3 GLU 6 2HG GLU 6 -3.533 -11.681 4.079 42 H GLU 7 H GLU 7 -3.504 -9.505 1.751 43 HA GLU 7 HA GLU 7 -5.383 -8.428 3.601 44 HB2 GLU 7 1HB GLU 7 -2.992 -7.849 3.657 45 HB3 GLU 7 2HB GLU 7 -3.149 -7.054 2.097 46 HG2 GLU 7 1HG GLU 7 -5.015 -6.109 4.151 47 HG3 GLU 7 2HG GLU 7 -3.312 -5.807 4.493 48 H LEU 8 H LEU 8 -5.166 -8.460 0.185 49 HA LEU 8 HA LEU 8 -6.382 -6.079 -0.552 50 HB2 LEU 8 1HB LEU 8 -5.464 -7.498 -2.221 51 HB3 LEU 8 2HB LEU 8 -6.524 -8.829 -1.761 52 HG LEU 8 HG LEU 8 -8.455 -7.447 -2.581 53 HD11 LEU 8 1HD1 LEU 8 -8.190 -5.358 -3.284 54 HD12 LEU 8 2HD1 LEU 8 -6.857 -5.816 -4.343 55 HD13 LEU 8 3HD1 LEU 8 -6.545 -5.425 -2.652 56 HD21 LEU 8 3HD2 LEU 8 -8.051 -9.014 -4.148 57 HD22 LEU 8 1HD2 LEU 8 -6.323 -8.667 -4.204 58 HD23 LEU 8 2HD2 LEU 8 -7.456 -7.640 -5.081 59 H GLU 9 H GLU 9 -7.735 -8.883 0.966 60 HA GLU 9 HA GLU 9 -10.469 -8.259 0.337 61 HB2 GLU 9 1HB GLU 9 -11.050 -10.110 1.719 62 HB3 GLU 9 2HB GLU 9 -9.603 -10.570 0.833 63 HG2 GLU 9 1HG GLU 9 -8.439 -9.611 3.021 64 HG3 GLU 9 2HG GLU 9 -9.986 -10.080 3.723 65 H LYS 10 H LYS 10 -8.257 -7.637 2.987 66 HA LYS 10 HA LYS 10 -9.985 -6.846 4.986 67 HB2 LYS 10 1HB LYS 10 -7.333 -5.576 4.278 68 HB3 LYS 10 2HB LYS 10 -8.153 -5.445 5.828 69 HG2 LYS 10 1HG LYS 10 -7.307 -8.081 4.663 70 HG3 LYS 10 2HG LYS 10 -6.256 -7.104 5.691 71 HD2 LYS 10 1HD LYS 10 -7.878 -7.211 7.494 72 HD3 LYS 10 2HD LYS 10 -8.996 -8.108 6.464 73 HE2 LYS 10 1HE LYS 10 -6.229 -9.111 7.066 74 HE3 LYS 10 2HE LYS 10 -7.592 -9.442 8.134 75 HZ1 LYS 10 3HZ LYS 10 -6.864 -10.845 5.868 76 HZ2 LYS 10 1HZ LYS 10 -8.280 -10.018 5.450 77 HZ3 LYS 10 2HZ LYS 10 -8.268 -11.049 6.790 78 H ILE 11 H ILE 11 -9.029 -5.130 2.090 79 HA ILE 11 HA ILE 11 -10.074 -2.595 2.867 80 HB ILE 11 HB ILE 11 -9.525 -3.674 0.099 81 HG12 ILE 11 1HG1 ILE 11 -7.570 -1.859 0.611 82 HG13 ILE 11 2HG1 ILE 11 -7.829 -2.514 2.224 83 HG21 ILE 11 1HG2 ILE 11 -9.295 -1.108 -0.305 84 HG22 ILE 11 2HG2 ILE 11 -10.888 -1.863 -0.311 85 HG23 ILE 11 3HG2 ILE 11 -10.334 -0.986 1.115 86 HD11 ILE 11 3HD1 ILE 11 -6.382 -3.628 0.043 87 HD12 ILE 11 1HD1 ILE 11 -6.540 -4.225 1.694 88 HD13 ILE 11 2HD1 ILE 11 -7.711 -4.706 0.466 89 H LEU 12 H LEU 12 -11.264 -5.022 0.535 90 HA LEU 12 HA LEU 12 -13.742 -3.798 0.070 91 HB2 LEU 12 1HB LEU 12 -12.737 -6.604 -0.234 92 HB3 LEU 12 2HB LEU 12 -14.420 -6.204 -0.571 93 HG LEU 12 HG LEU 12 -12.009 -5.052 -1.975 94 HD11 LEU 12 1HD1 LEU 12 -13.734 -7.373 -2.470 95 HD12 LEU 12 2HD1 LEU 12 -12.106 -7.020 -3.047 96 HD13 LEU 12 3HD1 LEU 12 -13.502 -6.309 -3.857 97 HD21 LEU 12 3HD2 LEU 12 -13.713 -3.391 -1.928 98 HD22 LEU 12 1HD2 LEU 12 -14.963 -4.574 -2.314 99 HD23 LEU 12 2HD2 LEU 12 -13.757 -4.139 -3.525 100 H LYS 13 H LYS 13 -12.605 -5.717 2.700 101 HA LYS 13 HA LYS 13 -15.052 -6.706 3.677 102 HB2 LYS 13 1HB LYS 13 -12.358 -6.191 4.869 103 HB3 LYS 13 2HB LYS 13 -13.704 -6.563 5.938 104 HG2 LYS 13 1HG LYS 13 -13.938 -8.518 4.056 105 HG3 LYS 13 2HG LYS 13 -12.189 -8.301 4.144 106 HD2 LYS 13 1HD LYS 13 -12.596 -9.903 5.776 107 HD3 LYS 13 2HD LYS 13 -12.542 -8.402 6.704 108 HE2 LYS 13 1HE LYS 13 -14.914 -8.311 6.847 109 HE3 LYS 13 2HE LYS 13 -15.099 -9.608 5.667 110 HZ1 LYS 13 3HZ LYS 13 -14.593 -9.761 8.499 111 HZ2 LYS 13 1HZ LYS 13 -13.596 -10.769 7.576 112 HZ3 LYS 13 2HZ LYS 13 -15.277 -10.906 7.458 113 H LYS 14 H LYS 14 -13.461 -3.607 4.003 114 HA LYS 14 HA LYS 14 -14.772 -2.509 6.166 115 HB2 LYS 14 1HB LYS 14 -13.994 -1.150 3.579 116 HB3 LYS 14 2HB LYS 14 -14.418 -0.312 5.067 117 HG2 LYS 14 1HG LYS 14 -12.074 -2.162 4.675 118 HG3 LYS 14 2HG LYS 14 -12.014 -0.402 4.784 119 HD2 LYS 14 1HD LYS 14 -11.840 -0.563 6.993 120 HD3 LYS 14 2HD LYS 14 -13.425 -1.339 7.050 121 HE2 LYS 14 1HE LYS 14 -12.524 -3.468 7.077 122 HE3 LYS 14 2HE LYS 14 -11.011 -2.948 6.338 123 HZ1 LYS 14 3HZ LYS 14 -11.347 -1.644 8.812 124 HZ2 LYS 14 1HZ LYS 14 -10.125 -2.713 8.337 125 HZ3 LYS 14 2HZ LYS 14 -11.543 -3.309 9.038 126 H SER 15 H SER 15 -15.967 -3.098 2.937 127 HA SER 15 HA SER 15 -18.534 -1.858 3.674 128 HB2 SER 15 1HB SER 15 -17.892 -0.793 1.706 129 HB3 SER 15 2HB SER 15 -17.148 -2.248 1.042 130 HG SER 15 HG SER 15 -19.883 -1.576 1.210 131 H PHE 16 H PHE 16 -17.300 -4.571 1.710 132 HA PHE 16 HA PHE 16 -19.669 -6.116 2.531 133 HB2 PHE 16 1HB PHE 16 -17.947 -6.763 0.148 134 HB3 PHE 16 2HB PHE 16 -19.598 -7.278 0.480 135 HD1 PHE 16 HD1 PHE 16 -21.176 -5.053 0.926 136 HD2 PHE 16 HD2 PHE 16 -17.772 -5.325 -1.616 137 HE1 PHE 16 HE1 PHE 16 -22.031 -3.176 -0.414 138 HE2 PHE 16 HE2 PHE 16 -18.622 -3.447 -2.959 139 HZ PHE 16 HZ PHE 16 -20.754 -2.370 -2.359 140 HA PRO 17 HA PRO 17 -16.070 -8.125 4.621 141 HB2 PRO 17 1HB PRO 17 -17.422 -8.663 6.913 142 HB3 PRO 17 2HB PRO 17 -16.618 -7.118 6.612 143 HG2 PRO 17 1HG PRO 17 -19.511 -7.834 6.329 144 HG3 PRO 17 2HG PRO 17 -18.782 -6.375 7.025 145 HD2 PRO 17 1HD PRO 17 -19.805 -6.440 4.518 146 HD3 PRO 17 2HD PRO 17 -18.421 -5.418 4.959 147 H SER 18 H SER 18 -19.483 -9.136 4.883 148 HA SER 18 HA SER 18 -18.983 -11.871 5.227 149 HB2 SER 18 1HB SER 18 -21.162 -11.270 5.763 150 HB3 SER 18 2HB SER 18 -21.351 -10.274 4.321 151 HG SER 18 HG SER 18 -21.929 -12.894 4.688 152 H SER 19 H SER 19 -18.939 -9.877 2.405 153 HA SER 19 HA SER 19 -19.421 -11.731 0.388 154 HB2 SER 19 1HB SER 19 -18.551 -10.161 -1.088 155 HB3 SER 19 2HB SER 19 -18.969 -9.148 0.293 156 HG SER 19 HG SER 19 -16.419 -10.117 -0.459 157 H VAL 20 H VAL 20 -17.738 -12.570 -1.167 158 HA VAL 20 HA VAL 20 -15.550 -13.802 0.371 159 HB VAL 20 HB VAL 20 -16.910 -14.778 -2.144 160 HG11 VAL 20 1HG1 VAL 20 -15.553 -16.863 -1.660 161 HG12 VAL 20 2HG1 VAL 20 -14.660 -15.477 -2.289 162 HG13 VAL 20 3HG1 VAL 20 -14.591 -15.866 -0.570 163 HG21 VAL 20 3HG2 VAL 20 -17.012 -15.729 0.715 164 HG22 VAL 20 1HG2 VAL 20 -18.340 -15.080 -0.248 165 HG23 VAL 20 2HG2 VAL 20 -17.639 -16.646 -0.656 166 H ILE 21 H ILE 21 -13.901 -12.357 0.083 167 HA ILE 21 HA ILE 21 -13.285 -11.288 -2.528 168 HB ILE 21 HB ILE 21 -11.658 -11.104 0.008 169 HG12 ILE 21 1HG1 ILE 21 -12.771 -8.662 -0.265 170 HG13 ILE 21 2HG1 ILE 21 -14.060 -9.650 -0.944 171 HG21 ILE 21 1HG2 ILE 21 -11.432 -8.893 -1.821 172 HG22 ILE 21 2HG2 ILE 21 -10.173 -9.931 -1.156 173 HG23 ILE 21 3HG2 ILE 21 -11.027 -10.412 -2.621 174 HD11 ILE 21 3HD1 ILE 21 -13.309 -10.949 1.400 175 HD12 ILE 21 1HD1 ILE 21 -13.321 -9.231 1.800 176 HD13 ILE 21 2HD1 ILE 21 -14.763 -9.990 1.124 177 H LYS 22 H LYS 22 -11.838 -12.041 -3.949 178 HA LYS 22 HA LYS 22 -9.748 -13.877 -3.112 179 HB2 LYS 22 1HB LYS 22 -12.014 -15.074 -3.823 180 HB3 LYS 22 2HB LYS 22 -11.377 -14.787 -5.437 181 HG2 LYS 22 1HG LYS 22 -9.464 -16.106 -5.023 182 HG3 LYS 22 2HG LYS 22 -9.787 -16.158 -3.289 183 HD2 LYS 22 1HD LYS 22 -11.856 -17.225 -5.141 184 HD3 LYS 22 2HD LYS 22 -10.398 -18.184 -4.876 185 HE2 LYS 22 1HE LYS 22 -11.959 -17.074 -2.570 186 HE3 LYS 22 2HE LYS 22 -12.444 -18.578 -3.351 187 HZ1 LYS 22 3HZ LYS 22 -10.400 -19.584 -2.784 188 HZ2 LYS 22 1HZ LYS 22 -10.949 -18.820 -1.377 189 HZ3 LYS 22 2HZ LYS 22 -9.714 -18.117 -2.294 190 H ILE 23 H ILE 23 -7.994 -13.926 -4.495 191 HA ILE 23 HA ILE 23 -8.023 -11.872 -6.590 192 HB ILE 23 HB ILE 23 -5.674 -13.199 -5.232 193 HG12 ILE 23 1HG1 ILE 23 -5.531 -10.560 -4.600 194 HG13 ILE 23 2HG1 ILE 23 -7.276 -10.783 -4.661 195 HG21 ILE 23 1HG2 ILE 23 -4.664 -12.571 -7.151 196 HG22 ILE 23 2HG2 ILE 23 -5.910 -11.387 -7.546 197 HG23 ILE 23 3HG2 ILE 23 -4.656 -10.989 -6.372 198 HD11 ILE 23 3HD1 ILE 23 -5.344 -11.665 -2.679 199 HD12 ILE 23 1HD1 ILE 23 -7.087 -11.434 -2.545 200 HD13 ILE 23 2HD1 ILE 23 -6.445 -12.942 -3.197 201 H THR 24 H THR 24 -7.370 -12.287 -8.675 202 HA THR 24 HA THR 24 -6.845 -15.102 -9.364 203 HB THR 24 HB THR 24 -8.406 -13.315 -11.205 204 HG1 THR 24 HG1 THR 24 -9.747 -15.122 -9.525 205 HG21 THR 24 3HG2 THR 24 -8.844 -15.214 -12.383 206 HG22 THR 24 1HG2 THR 24 -8.857 -16.235 -10.946 207 HG23 THR 24 2HG2 THR 24 -7.323 -15.718 -11.647 208 H ASP 25 H ASP 25 -5.201 -15.456 -10.744 209 HA ASP 25 HA ASP 25 -3.700 -13.126 -11.668 210 HB2 ASP 25 1HB ASP 25 -1.921 -14.833 -12.178 211 HB3 ASP 25 2HB ASP 25 -2.373 -14.725 -10.479 212 H LEU 26 H LEU 26 -4.080 -12.396 -13.645 213 HA LEU 26 HA LEU 26 -5.326 -14.071 -15.644 214 HB2 LEU 26 1HB LEU 26 -4.373 -11.215 -15.804 215 HB3 LEU 26 2HB LEU 26 -5.354 -12.043 -17.012 216 HG LEU 26 HG LEU 26 -6.999 -12.339 -14.965 217 HD11 LEU 26 1HD1 LEU 26 -6.789 -9.930 -13.830 218 HD12 LEU 26 2HD1 LEU 26 -5.079 -10.267 -14.097 219 HD13 LEU 26 3HD1 LEU 26 -6.058 -11.382 -13.144 220 HD21 LEU 26 3HD2 LEU 26 -7.673 -9.799 -15.638 221 HD22 LEU 26 1HD2 LEU 26 -8.036 -11.222 -16.614 222 HD23 LEU 26 2HD2 LEU 26 -6.619 -10.240 -16.982 223 H VAL 27 H VAL 27 -2.281 -12.251 -15.354 224 HA VAL 27 HA VAL 27 -1.123 -14.059 -17.374 225 HB VAL 27 HB VAL 27 0.425 -12.131 -17.943 226 HG11 VAL 27 1HG1 VAL 27 -2.367 -11.360 -18.640 227 HG12 VAL 27 2HG1 VAL 27 -0.937 -11.472 -19.668 228 HG13 VAL 27 3HG1 VAL 27 -1.767 -12.939 -19.146 229 HG21 VAL 27 3HG2 VAL 27 -1.675 -10.600 -16.413 230 HG22 VAL 27 1HG2 VAL 27 0.043 -10.718 -16.033 231 HG23 VAL 27 2HG2 VAL 27 -0.482 -9.866 -17.485 232 H GLY 28 H GLY 28 -0.548 -12.080 -14.503 233 HA2 GLY 28 1HA GLY 28 0.727 -12.933 -12.664 234 HA3 GLY 28 2HA GLY 28 1.656 -13.897 -13.802 235 H ASP 29 H ASP 29 2.962 -12.593 -15.409 236 HA ASP 29 HA ASP 29 4.852 -11.058 -14.105 237 HB2 ASP 29 1HB ASP 29 4.127 -11.499 -16.957 238 HB3 ASP 29 2HB ASP 29 5.193 -10.143 -16.597 239 H GLN 30 H GLN 30 2.577 -9.723 -16.508 240 HA GLN 30 HA GLN 30 2.986 -7.051 -15.913 241 HB2 GLN 30 1HB GLN 30 1.579 -8.257 -17.792 242 HB3 GLN 30 2HB GLN 30 0.247 -7.966 -16.680 243 HG2 GLN 30 1HG GLN 30 1.212 -5.524 -16.677 244 HG3 GLN 30 2HG GLN 30 1.889 -6.031 -18.224 245 HE21 GLN 30 2HE2 GLN 30 -1.191 -6.382 -16.488 246 HE22 GLN 30 1HE2 GLN 30 -2.190 -5.945 -17.828 247 H ASP 31 H ASP 31 1.690 -5.512 -14.761 248 HA ASP 31 HA ASP 31 0.927 -6.463 -12.160 249 HB2 ASP 31 1HB ASP 31 0.576 -3.668 -13.247 250 HB3 ASP 31 2HB ASP 31 0.696 -4.159 -11.560 251 H HIS 32 H HIS 32 -0.767 -7.832 -13.481 252 HA HIS 32 HA HIS 32 -3.283 -6.314 -13.639 253 HB2 HIS 32 1HB HIS 32 -2.307 -7.748 -15.622 254 HB3 HIS 32 2HB HIS 32 -3.010 -9.090 -14.723 255 HD1 HIS 32 HD1 HIS 32 -3.954 -7.883 -17.562 256 HD2 HIS 32 HD2 HIS 32 -5.788 -7.367 -13.870 257 HE1 HIS 32 HE1 HIS 32 -6.355 -7.336 -18.074 258 H TYR 33 H TYR 33 -4.649 -6.559 -12.010 259 HA TYR 33 HA TYR 33 -4.618 -9.098 -10.514 260 HB2 TYR 33 1HB TYR 33 -4.540 -6.288 -9.560 261 HB3 TYR 33 2HB TYR 33 -5.553 -7.404 -8.650 262 HD1 TYR 33 HD1 TYR 33 -2.101 -7.139 -10.050 263 HD2 TYR 33 HD2 TYR 33 -4.593 -8.647 -6.949 264 HE1 TYR 33 HE1 TYR 33 -0.112 -7.963 -8.861 265 HE2 TYR 33 HE2 TYR 33 -2.611 -9.474 -5.751 266 HH TYR 33 HH TYR 33 0.658 -8.840 -6.948 267 H ALA 34 H ALA 34 -6.426 -10.176 -10.905 268 HA ALA 34 HA ALA 34 -8.866 -8.738 -11.608 269 HB1 ALA 34 1HB ALA 34 -8.840 -10.427 -13.090 270 HB2 ALA 34 2HB ALA 34 -7.813 -11.440 -12.075 271 HB3 ALA 34 3HB ALA 34 -9.547 -11.354 -11.767 272 H LEU 35 H LEU 35 -9.805 -7.970 -9.782 273 HA LEU 35 HA LEU 35 -9.969 -9.574 -7.386 274 HB2 LEU 35 1HB LEU 35 -9.657 -7.244 -7.070 275 HB3 LEU 35 2HB LEU 35 -11.008 -6.853 -8.133 276 HG LEU 35 HG LEU 35 -12.552 -7.814 -6.446 277 HD11 LEU 35 1HD1 LEU 35 -10.388 -9.069 -5.431 278 HD12 LEU 35 2HD1 LEU 35 -11.882 -8.793 -4.536 279 HD13 LEU 35 3HD1 LEU 35 -10.515 -7.698 -4.328 280 HD21 LEU 35 3HD2 LEU 35 -11.262 -5.883 -4.747 281 HD22 LEU 35 1HD2 LEU 35 -12.762 -5.746 -5.665 282 HD23 LEU 35 2HD2 LEU 35 -11.222 -5.354 -6.430 283 H GLU 36 H GLU 36 -11.528 -10.976 -6.939 284 HA GLU 36 HA GLU 36 -14.108 -10.699 -8.337 285 HB2 GLU 36 1HB GLU 36 -14.241 -13.239 -8.033 286 HB3 GLU 36 2HB GLU 36 -13.144 -12.628 -9.263 287 HG2 GLU 36 1HG GLU 36 -11.254 -13.122 -8.000 288 HG3 GLU 36 2HG GLU 36 -12.173 -13.243 -6.501 289 H ILE 37 H ILE 37 -15.618 -10.071 -6.952 290 HA ILE 37 HA ILE 37 -15.551 -11.157 -4.212 291 HB ILE 37 HB ILE 37 -15.183 -8.744 -4.224 292 HG12 ILE 37 1HG1 ILE 37 -17.996 -9.275 -3.268 293 HG13 ILE 37 2HG1 ILE 37 -16.576 -9.910 -2.443 294 HG21 ILE 37 1HG2 ILE 37 -17.153 -8.795 -6.271 295 HG22 ILE 37 2HG2 ILE 37 -17.735 -7.765 -4.965 296 HG23 ILE 37 3HG2 ILE 37 -16.174 -7.437 -5.717 297 HD11 ILE 37 3HD1 ILE 37 -16.075 -7.932 -1.525 298 HD12 ILE 37 1HD1 ILE 37 -16.513 -7.027 -2.974 299 HD13 ILE 37 2HD1 ILE 37 -17.767 -7.564 -1.855 300 H SER 38 H SER 38 -17.460 -11.881 -3.293 301 HA SER 38 HA SER 38 -19.796 -12.026 -5.081 302 HB2 SER 38 1HB SER 38 -19.959 -14.286 -4.908 303 HB3 SER 38 2HB SER 38 -18.235 -14.185 -4.553 304 HG SER 38 HG SER 38 -18.908 -14.016 -2.290 305 H ASP 39 H ASP 39 -21.563 -11.201 -4.199 306 HA ASP 39 HA ASP 39 -22.050 -11.496 -1.340 307 HB2 ASP 39 1HB ASP 39 -22.806 -8.954 -1.478 308 HB3 ASP 39 2HB ASP 39 -21.149 -9.401 -1.080 309 H ALA 40 H ALA 40 -24.291 -10.364 -0.857 310 HA ALA 40 HA ALA 40 -26.124 -11.079 -3.053 311 HB1 ALA 40 1HB ALA 40 -27.727 -11.841 -1.355 312 HB2 ALA 40 2HB ALA 40 -26.222 -12.761 -1.307 313 HB3 ALA 40 3HB ALA 40 -26.533 -11.515 -0.098 314 H GLN 41 H GLN 41 -24.973 -8.462 -2.293 315 HA GLN 41 HA GLN 41 -27.490 -7.053 -1.690 316 HB2 GLN 41 1HB GLN 41 -26.100 -5.235 -0.732 317 HB3 GLN 41 2HB GLN 41 -25.959 -6.749 0.152 318 HG2 GLN 41 1HG GLN 41 -23.891 -7.094 -1.436 319 HG3 GLN 41 2HG GLN 41 -23.959 -5.335 -1.527 320 HE21 GLN 41 2HE2 GLN 41 -22.969 -8.015 0.278 321 HE22 GLN 41 1HE2 GLN 41 -22.437 -7.177 1.691 322 H PHE 42 H PHE 42 -24.597 -7.209 -3.644 323 HA PHE 42 HA PHE 42 -24.911 -4.777 -5.033 324 HB2 PHE 42 1HB PHE 42 -23.207 -5.519 -6.445 325 HB3 PHE 42 2HB PHE 42 -22.886 -6.399 -4.954 326 HD1 PHE 42 HD1 PHE 42 -24.605 -8.644 -4.959 327 HD2 PHE 42 HD2 PHE 42 -22.668 -6.794 -8.267 328 HE1 PHE 42 HE1 PHE 42 -24.692 -10.770 -6.195 329 HE2 PHE 42 HE2 PHE 42 -22.753 -8.916 -9.509 330 HZ PHE 42 HZ PHE 42 -23.766 -10.908 -8.473 331 H ASN 43 H ASN 43 -26.696 -7.658 -5.135 332 HA ASN 43 HA ASN 43 -27.484 -7.931 -7.759 333 HB2 ASN 43 1HB ASN 43 -28.826 -8.447 -5.140 334 HB3 ASN 43 2HB ASN 43 -29.786 -8.566 -6.612 335 HD21 ASN 43 2HD2 ASN 43 -28.041 -10.299 -4.489 336 HD22 ASN 43 1HD2 ASN 43 -27.561 -11.620 -5.495 337 H GLY 44 H GLY 44 -28.407 -5.489 -5.437 338 HA2 GLY 44 1HA GLY 44 -30.440 -4.418 -7.251 339 HA3 GLY 44 2HA GLY 44 -30.146 -3.894 -5.599 340 H LEU 45 H LEU 45 -27.816 -4.253 -8.243 341 HA LEU 45 HA LEU 45 -27.606 -1.371 -8.537 342 HB2 LEU 45 1HB LEU 45 -25.334 -3.084 -7.549 343 HB3 LEU 45 2HB LEU 45 -25.134 -1.451 -8.180 344 HG LEU 45 HG LEU 45 -26.886 -2.043 -5.809 345 HD11 LEU 45 1HD1 LEU 45 -24.002 -1.193 -5.686 346 HD12 LEU 45 2HD1 LEU 45 -24.541 -2.855 -5.447 347 HD13 LEU 45 3HD1 LEU 45 -25.074 -1.588 -4.343 348 HD21 LEU 45 3HD2 LEU 45 -27.386 0.103 -6.182 349 HD22 LEU 45 1HD2 LEU 45 -26.032 0.320 -7.291 350 HD23 LEU 45 2HD2 LEU 45 -25.776 0.453 -5.551 351 H SER 46 H SER 46 -25.477 -1.044 -10.054 352 HA SER 46 HA SER 46 -25.777 -2.982 -12.254 353 HB2 SER 46 1HB SER 46 -26.851 -0.751 -12.684 354 HB3 SER 46 2HB SER 46 -25.252 -0.019 -12.565 355 HG SER 46 HG SER 46 -24.822 -0.694 -14.506 356 H LEU 47 H LEU 47 -23.887 -2.640 -13.898 357 HA LEU 47 HA LEU 47 -21.528 -3.476 -12.683 358 HB2 LEU 47 1HB LEU 47 -22.199 -2.411 -15.391 359 HB3 LEU 47 2HB LEU 47 -20.514 -2.688 -14.958 360 HG LEU 47 HG LEU 47 -21.409 -4.565 -16.213 361 HD11 LEU 47 1HD1 LEU 47 -21.191 -5.570 -13.409 362 HD12 LEU 47 2HD1 LEU 47 -19.809 -4.790 -14.178 363 HD13 LEU 47 3HD1 LEU 47 -20.517 -6.235 -14.897 364 HD21 LEU 47 3HD2 LEU 47 -23.316 -5.082 -13.949 365 HD22 LEU 47 1HD2 LEU 47 -23.259 -5.847 -15.538 366 HD23 LEU 47 2HD2 LEU 47 -23.783 -4.170 -15.385 367 H ILE 48 H ILE 48 -22.727 -0.281 -13.293 368 HA ILE 48 HA ILE 48 -20.203 1.050 -12.987 369 HB ILE 48 HB ILE 48 -22.975 2.223 -12.741 370 HG12 ILE 48 1HG1 ILE 48 -22.677 1.101 -14.904 371 HG13 ILE 48 2HG1 ILE 48 -22.727 2.849 -15.104 372 HG21 ILE 48 1HG2 ILE 48 -20.386 3.319 -12.341 373 HG22 ILE 48 2HG2 ILE 48 -21.066 4.029 -13.804 374 HG23 ILE 48 3HG2 ILE 48 -21.949 4.135 -12.282 375 HD11 ILE 48 3HD1 ILE 48 -20.024 2.133 -14.754 376 HD12 ILE 48 1HD1 ILE 48 -20.722 1.008 -15.919 377 HD13 ILE 48 2HD1 ILE 48 -20.818 2.745 -16.205 378 H ASN 49 H ASN 49 -23.122 0.829 -10.946 379 HA ASN 49 HA ASN 49 -21.995 2.117 -8.711 380 HB2 ASN 49 1HB ASN 49 -24.327 0.230 -9.014 381 HB3 ASN 49 2HB ASN 49 -23.882 0.928 -7.459 382 HD21 ASN 49 2HD2 ASN 49 -26.289 1.249 -9.127 383 HD22 ASN 49 1HD2 ASN 49 -26.453 2.951 -9.377 384 H GLN 50 H GLN 50 -21.961 -1.212 -9.784 385 HA GLN 50 HA GLN 50 -21.047 -2.349 -7.349 386 HB2 GLN 50 1HB GLN 50 -20.985 -3.297 -10.208 387 HB3 GLN 50 2HB GLN 50 -20.324 -4.253 -8.889 388 HG2 GLN 50 1HG GLN 50 -22.352 -4.833 -8.111 389 HG3 GLN 50 2HG GLN 50 -23.068 -3.269 -8.496 390 HE21 GLN 50 2HE2 GLN 50 -24.846 -4.725 -9.168 391 HE22 GLN 50 1HE2 GLN 50 -24.833 -5.321 -10.789 392 H HIS 51 H HIS 51 -19.407 -1.173 -10.255 393 HA HIS 51 HA HIS 51 -16.795 -1.874 -9.280 394 HB2 HIS 51 1HB HIS 51 -17.720 -1.496 -11.758 395 HB3 HIS 51 2HB HIS 51 -17.119 0.132 -11.455 396 HD1 HIS 51 HD1 HIS 51 -14.505 0.260 -10.786 397 HD2 HIS 51 HD2 HIS 51 -15.811 -3.296 -12.492 398 HE1 HIS 51 HE1 HIS 51 -12.422 -0.920 -11.558 399 H LYS 52 H LYS 52 -18.901 0.862 -9.074 400 HA LYS 52 HA LYS 52 -16.831 2.728 -8.330 401 HB2 LYS 52 1HB LYS 52 -19.827 2.840 -8.486 402 HB3 LYS 52 2HB LYS 52 -18.934 4.113 -7.663 403 HG2 LYS 52 1HG LYS 52 -17.662 4.530 -9.722 404 HG3 LYS 52 2HG LYS 52 -18.609 3.286 -10.541 405 HD2 LYS 52 1HD LYS 52 -20.582 4.548 -10.415 406 HD3 LYS 52 2HD LYS 52 -19.919 5.622 -9.181 407 HE2 LYS 52 1HE LYS 52 -18.320 6.493 -10.849 408 HE3 LYS 52 2HE LYS 52 -19.068 5.467 -12.072 409 HZ1 LYS 52 3HZ LYS 52 -20.989 6.719 -12.070 410 HZ2 LYS 52 1HZ LYS 52 -19.805 7.909 -11.865 411 HZ3 LYS 52 2HZ LYS 52 -20.706 7.375 -10.537 412 H LEU 53 H LEU 53 -19.432 0.978 -6.666 413 HA LEU 53 HA LEU 53 -19.193 1.994 -4.127 414 HB2 LEU 53 1HB LEU 53 -20.085 -0.547 -5.295 415 HB3 LEU 53 2HB LEU 53 -19.604 -0.645 -3.602 416 HG LEU 53 HG LEU 53 -21.732 1.171 -4.735 417 HD11 LEU 53 1HD1 LEU 53 -22.105 -1.391 -4.526 418 HD12 LEU 53 2HD1 LEU 53 -23.324 -0.278 -3.908 419 HD13 LEU 53 3HD1 LEU 53 -22.196 -1.054 -2.797 420 HD21 LEU 53 3HD2 LEU 53 -21.133 2.383 -2.920 421 HD22 LEU 53 1HD2 LEU 53 -20.384 1.007 -2.110 422 HD23 LEU 53 2HD2 LEU 53 -22.138 1.194 -2.089 423 H VAL 54 H VAL 54 -17.418 -0.808 -5.435 424 HA VAL 54 HA VAL 54 -15.842 -1.367 -3.229 425 HB VAL 54 HB VAL 54 -14.193 -2.324 -4.838 426 HG11 VAL 54 1HG1 VAL 54 -16.581 -3.417 -6.014 427 HG12 VAL 54 2HG1 VAL 54 -15.479 -4.138 -4.839 428 HG13 VAL 54 3HG1 VAL 54 -16.816 -3.127 -4.290 429 HG21 VAL 54 3HG2 VAL 54 -14.853 -2.341 -7.244 430 HG22 VAL 54 1HG2 VAL 54 -16.065 -1.115 -6.869 431 HG23 VAL 54 2HG2 VAL 54 -14.352 -0.759 -6.647 432 H LYS 55 H LYS 55 -15.497 1.145 -5.637 433 HA LYS 55 HA LYS 55 -12.835 1.880 -4.818 434 HB2 LYS 55 1HB LYS 55 -14.830 3.319 -6.576 435 HB3 LYS 55 2HB LYS 55 -13.152 3.795 -6.353 436 HG2 LYS 55 1HG LYS 55 -13.856 1.064 -7.355 437 HG3 LYS 55 2HG LYS 55 -13.787 2.451 -8.445 438 HD2 LYS 55 1HD LYS 55 -11.628 1.749 -8.630 439 HD3 LYS 55 2HD LYS 55 -11.451 2.801 -7.224 440 HE2 LYS 55 1HE LYS 55 -11.205 1.052 -5.776 441 HE3 LYS 55 2HE LYS 55 -12.192 -0.035 -6.750 442 HZ1 LYS 55 3HZ LYS 55 -10.382 -0.844 -7.708 443 HZ2 LYS 55 1HZ LYS 55 -9.438 0.062 -6.634 444 HZ3 LYS 55 2HZ LYS 55 -9.840 0.697 -8.149 445 H ASN 56 H ASN 56 -16.101 2.821 -4.044 446 HA ASN 56 HA ASN 56 -15.344 5.237 -2.678 447 HB2 ASN 56 1HB ASN 56 -17.940 3.685 -2.729 448 HB3 ASN 56 2HB ASN 56 -17.728 5.235 -1.921 449 HD21 ASN 56 2HD2 ASN 56 -18.841 3.826 -4.636 450 HD22 ASN 56 1HD2 ASN 56 -18.699 5.145 -5.742 451 H ALA 57 H ALA 57 -16.021 1.905 -1.808 452 HA ALA 57 HA ALA 57 -16.281 2.164 0.953 453 HB1 ALA 57 1HB ALA 57 -16.470 0.091 -0.675 454 HB2 ALA 57 2HB ALA 57 -14.820 -0.191 -0.120 455 HB3 ALA 57 3HB ALA 57 -16.141 -0.111 1.046 456 H LEU 58 H LEU 58 -13.499 2.488 -1.057 457 HA LEU 58 HA LEU 58 -11.792 2.637 1.341 458 HB2 LEU 58 1HB LEU 58 -9.905 1.993 -0.055 459 HB3 LEU 58 2HB LEU 58 -11.167 0.762 -0.071 460 HG LEU 58 HG LEU 58 -11.845 2.107 -2.288 461 HD11 LEU 58 1HD1 LEU 58 -10.294 3.563 -2.918 462 HD12 LEU 58 2HD1 LEU 58 -9.200 2.203 -3.165 463 HD13 LEU 58 3HD1 LEU 58 -9.210 3.056 -1.622 464 HD21 LEU 58 3HD2 LEU 58 -11.036 -0.364 -1.754 465 HD22 LEU 58 1HD2 LEU 58 -9.597 0.198 -2.606 466 HD23 LEU 58 2HD2 LEU 58 -11.169 0.243 -3.405 467 H SER 59 H SER 59 -13.438 4.661 -0.240 468 HA SER 59 HA SER 59 -11.371 6.449 -1.242 469 HB2 SER 59 1HB SER 59 -13.505 6.216 -2.479 470 HB3 SER 59 2HB SER 59 -14.368 6.856 -1.081 471 HG SER 59 HG SER 59 -14.016 8.584 -2.377 472 H GLU 60 H GLU 60 -13.206 5.912 1.611 473 HA GLU 60 HA GLU 60 -12.600 8.585 2.646 474 HB2 GLU 60 1HB GLU 60 -14.051 7.872 4.569 475 HB3 GLU 60 2HB GLU 60 -14.870 7.949 3.015 476 HG2 GLU 60 1HG GLU 60 -14.711 5.538 2.787 477 HG3 GLU 60 2HG GLU 60 -13.835 5.438 4.314 478 H ILE 61 H ILE 61 -12.009 5.165 3.277 479 HA ILE 61 HA ILE 61 -10.314 5.767 5.555 480 HB ILE 61 HB ILE 61 -10.736 3.083 4.246 481 HG12 ILE 61 1HG1 ILE 61 -12.220 3.247 6.634 482 HG13 ILE 61 2HG1 ILE 61 -12.590 4.715 5.736 483 HG21 ILE 61 1HG2 ILE 61 -9.748 3.925 6.963 484 HG22 ILE 61 2HG2 ILE 61 -10.156 2.265 6.531 485 HG23 ILE 61 3HG2 ILE 61 -8.840 3.095 5.700 486 HD11 ILE 61 3HD1 ILE 61 -14.115 3.476 4.699 487 HD12 ILE 61 1HD1 ILE 61 -12.760 2.785 3.807 488 HD13 ILE 61 2HD1 ILE 61 -13.386 1.964 5.238 489 H LEU 62 H LEU 62 -10.007 5.101 2.172 490 HA LEU 62 HA LEU 62 -8.226 4.980 0.764 491 HB2 LEU 62 1HB LEU 62 -7.126 6.576 3.046 492 HB3 LEU 62 2HB LEU 62 -6.096 6.129 1.687 493 HG LEU 62 HG LEU 62 -6.918 8.382 1.400 494 HD11 LEU 62 1HD1 LEU 62 -8.639 7.208 -0.611 495 HD12 LEU 62 2HD1 LEU 62 -7.106 6.349 -0.469 496 HD13 LEU 62 3HD1 LEU 62 -7.118 8.082 -0.794 497 HD21 LEU 62 3HD2 LEU 62 -9.148 9.017 1.456 498 HD22 LEU 62 1HD2 LEU 62 -9.040 7.854 2.777 499 HD23 LEU 62 2HD2 LEU 62 -9.730 7.367 1.228 500 H ASN 63 H ASN 63 -8.712 2.733 2.449 501 HA ASN 63 HA ASN 63 -6.536 1.652 3.752 502 HB2 ASN 63 1HB ASN 63 -8.906 0.553 2.360 503 HB3 ASN 63 2HB ASN 63 -7.573 -0.570 2.607 504 HD21 ASN 63 2HD2 ASN 63 -10.068 -0.876 3.790 505 HD22 ASN 63 1HD2 ASN 63 -9.898 -0.689 5.499 506 H LYS 64 H LYS 64 -7.389 1.128 0.327 507 HA LYS 64 HA LYS 64 -4.714 0.102 -0.189 508 HB2 LYS 64 1HB LYS 64 -6.881 -0.910 -1.117 509 HB3 LYS 64 2HB LYS 64 -6.908 0.459 -2.221 510 HG2 LYS 64 1HG LYS 64 -5.798 -0.981 -3.550 511 HG3 LYS 64 2HG LYS 64 -4.405 -0.383 -2.644 512 HD2 LYS 64 1HD LYS 64 -5.970 -2.769 -1.712 513 HD3 LYS 64 2HD LYS 64 -4.681 -2.925 -2.908 514 HE2 LYS 64 1HE LYS 64 -3.317 -1.540 -1.142 515 HE3 LYS 64 2HE LYS 64 -4.527 -2.170 -0.026 516 HZ1 LYS 64 3HZ LYS 64 -2.272 -3.474 -1.077 517 HZ2 LYS 64 1HZ LYS 64 -3.654 -4.291 -1.609 518 HZ3 LYS 64 2HZ LYS 64 -3.396 -4.055 0.046 519 H LYS 65 H LYS 65 -3.315 0.974 -1.767 520 HA LYS 65 HA LYS 65 -3.063 3.764 -1.746 521 HB2 LYS 65 1HB LYS 65 -1.854 1.811 -3.713 522 HB3 LYS 65 2HB LYS 65 -1.289 3.447 -3.398 523 HG2 LYS 65 1HG LYS 65 -0.323 2.883 -1.412 524 HG3 LYS 65 2HG LYS 65 -1.453 1.561 -1.110 525 HD2 LYS 65 1HD LYS 65 0.536 1.421 -3.352 526 HD3 LYS 65 2HD LYS 65 0.989 0.983 -1.703 527 HE2 LYS 65 1HE LYS 65 -0.380 -0.861 -1.673 528 HE3 LYS 65 2HE LYS 65 -1.484 -0.195 -2.875 529 HZ1 LYS 65 3HZ LYS 65 1.185 -0.669 -3.856 530 HZ2 LYS 65 1HZ LYS 65 -0.308 -1.065 -4.545 531 HZ3 LYS 65 2HZ LYS 65 0.376 -2.073 -3.372 532 H LEU 66 H LEU 66 -2.563 4.734 -4.182 533 HA LEU 66 HA LEU 66 -5.221 4.901 -5.347 534 HB2 LEU 66 1HB LEU 66 -2.701 6.492 -5.594 535 HB3 LEU 66 2HB LEU 66 -3.978 6.662 -6.797 536 HG LEU 66 HG LEU 66 -4.133 8.428 -5.153 537 HD11 LEU 66 1HD1 LEU 66 -6.427 6.929 -4.200 538 HD12 LEU 66 2HD1 LEU 66 -6.195 6.772 -5.941 539 HD13 LEU 66 3HD1 LEU 66 -6.357 8.371 -5.214 540 HD21 LEU 66 3HD2 LEU 66 -3.054 6.962 -3.338 541 HD22 LEU 66 1HD2 LEU 66 -4.694 6.396 -3.022 542 HD23 LEU 66 2HD2 LEU 66 -4.304 8.107 -2.851 543 H HIS 67 H HIS 67 -4.449 2.457 -5.898 544 HA HIS 67 HA HIS 67 -3.166 2.433 -8.529 545 HB2 HIS 67 1HB HIS 67 -3.801 0.288 -6.516 546 HB3 HIS 67 2HB HIS 67 -3.367 -0.114 -8.175 547 HD1 HIS 67 HD1 HIS 67 -1.015 -0.852 -8.186 548 HD2 HIS 67 HD2 HIS 67 -1.602 2.369 -5.629 549 HE1 HIS 67 HE1 HIS 67 1.263 -0.287 -7.283 550 H SER 68 H SER 68 -4.215 0.418 -9.859 551 HA SER 68 HA SER 68 -7.125 0.662 -9.864 552 HB2 SER 68 1HB SER 68 -5.738 0.951 -12.498 553 HB3 SER 68 2HB SER 68 -7.333 1.517 -12.004 554 HG SER 68 HG SER 68 -6.467 3.334 -11.419 555 H ILE 69 H ILE 69 -7.943 -1.311 -9.968 556 HA ILE 69 HA ILE 69 -6.604 -3.324 -11.638 557 HB ILE 69 HB ILE 69 -7.073 -5.056 -9.942 558 HG12 ILE 69 1HG1 ILE 69 -8.851 -3.449 -8.840 559 HG13 ILE 69 2HG1 ILE 69 -7.978 -4.624 -7.862 560 HG21 ILE 69 1HG2 ILE 69 -5.342 -4.189 -8.244 561 HG22 ILE 69 2HG2 ILE 69 -4.857 -4.349 -9.932 562 HG23 ILE 69 3HG2 ILE 69 -5.264 -2.763 -9.278 563 HD11 ILE 69 3HD1 ILE 69 -6.827 -1.904 -8.158 564 HD12 ILE 69 1HD1 ILE 69 -8.230 -2.122 -7.111 565 HD13 ILE 69 2HD1 ILE 69 -6.748 -3.028 -6.801 566 H SER 70 H SER 70 -8.067 -5.294 -11.924 567 HA SER 70 HA SER 70 -10.621 -4.343 -12.860 568 HB2 SER 70 1HB SER 70 -9.455 -5.890 -14.279 569 HB3 SER 70 2HB SER 70 -9.285 -7.054 -12.965 570 HG SER 70 HG SER 70 -11.727 -6.223 -14.154 571 H ILE 71 H ILE 71 -12.588 -4.690 -11.993 572 HA ILE 71 HA ILE 71 -12.731 -6.347 -9.560 573 HB ILE 71 HB ILE 71 -14.214 -3.772 -10.100 574 HG12 ILE 71 1HG1 ILE 71 -12.460 -4.109 -7.734 575 HG13 ILE 71 2HG1 ILE 71 -11.648 -3.981 -9.291 576 HG21 ILE 71 1HG2 ILE 71 -14.608 -5.944 -8.155 577 HG22 ILE 71 2HG2 ILE 71 -14.634 -4.312 -7.488 578 HG23 ILE 71 3HG2 ILE 71 -15.751 -4.754 -8.778 579 HD11 ILE 71 3HD1 ILE 71 -12.044 -1.798 -9.430 580 HD12 ILE 71 1HD1 ILE 71 -13.722 -1.977 -8.920 581 HD13 ILE 71 2HD1 ILE 71 -12.438 -1.891 -7.714 582 H LYS 72 H LYS 72 -13.712 -8.156 -10.264 583 HA LYS 72 HA LYS 72 -15.953 -7.991 -12.113 584 HB2 LYS 72 1HB LYS 72 -14.230 -9.729 -12.429 585 HB3 LYS 72 2HB LYS 72 -14.632 -10.403 -10.854 586 HG2 LYS 72 1HG LYS 72 -17.032 -10.583 -11.857 587 HG3 LYS 72 2HG LYS 72 -16.180 -10.480 -13.400 588 HD2 LYS 72 1HD LYS 72 -14.690 -12.352 -12.493 589 HD3 LYS 72 2HD LYS 72 -15.926 -12.565 -11.251 590 HE2 LYS 72 1HE LYS 72 -17.606 -12.937 -12.990 591 HE3 LYS 72 2HE LYS 72 -16.376 -12.712 -14.232 592 HZ1 LYS 72 3HZ LYS 72 -15.632 -14.688 -12.302 593 HZ2 LYS 72 1HZ LYS 72 -15.680 -14.795 -13.990 594 HZ3 LYS 72 2HZ LYS 72 -17.080 -15.079 -13.085 595 H THR 73 H THR 73 -18.046 -8.283 -11.591 596 HA THR 73 HA THR 73 -18.693 -8.498 -8.748 597 HB THR 73 HB THR 73 -20.792 -7.551 -9.222 598 HG1 THR 73 HG1 THR 73 -21.674 -7.496 -11.293 599 HG21 THR 73 3HG2 THR 73 -18.987 -5.927 -9.449 600 HG22 THR 73 1HG2 THR 73 -20.300 -5.548 -10.562 601 HG23 THR 73 2HG2 THR 73 -18.831 -6.318 -11.161 602 H ILE 74 H ILE 74 -19.612 -10.244 -7.867 603 HA ILE 74 HA ILE 74 -20.841 -12.244 -9.634 604 HB ILE 74 HB ILE 74 -19.022 -12.967 -7.338 605 HG12 ILE 74 1HG1 ILE 74 -17.699 -13.869 -9.495 606 HG13 ILE 74 2HG1 ILE 74 -18.470 -12.460 -10.213 607 HG21 ILE 74 1HG2 ILE 74 -20.360 -14.595 -9.492 608 HG22 ILE 74 2HG2 ILE 74 -19.134 -15.220 -8.390 609 HG23 ILE 74 3HG2 ILE 74 -20.678 -14.649 -7.758 610 HD11 ILE 74 3HD1 ILE 74 -16.179 -12.065 -9.331 611 HD12 ILE 74 1HD1 ILE 74 -17.414 -11.002 -8.659 612 HD13 ILE 74 2HD1 ILE 74 -16.809 -12.361 -7.711 613 H SER 75 H SER 75 -22.455 -13.534 -8.680 614 HA SER 75 HA SER 75 -23.548 -12.408 -6.190 615 HB2 SER 75 1HB SER 75 -25.281 -12.061 -7.639 616 HB3 SER 75 2HB SER 75 -24.791 -13.376 -8.707 617 HG SER 75 HG SER 75 -25.820 -14.812 -7.441 618 H ILE 76 H ILE 76 -24.694 -13.896 -4.762 619 HA ILE 76 HA ILE 76 -23.502 -16.592 -4.821 620 HB ILE 76 HB ILE 76 -23.928 -16.529 -2.297 621 HG12 ILE 76 1HG1 ILE 76 -23.843 -13.544 -2.730 622 HG13 ILE 76 2HG1 ILE 76 -25.354 -14.422 -2.518 623 HG21 ILE 76 1HG2 ILE 76 -21.860 -14.523 -2.713 624 HG22 ILE 76 2HG2 ILE 76 -21.734 -16.171 -2.100 625 HG23 ILE 76 3HG2 ILE 76 -21.748 -15.876 -3.839 626 HD11 ILE 76 3HD1 ILE 76 -24.953 -14.848 -0.310 627 HD12 ILE 76 1HD1 ILE 76 -23.202 -14.765 -0.497 628 HD13 ILE 76 2HD1 ILE 76 -24.160 -13.284 -0.493 629 HA PRO 77 HA PRO 77 -27.500 -18.404 -4.821 630 HB2 PRO 77 1HB PRO 77 -27.093 -20.612 -3.295 631 HB3 PRO 77 2HB PRO 77 -26.450 -20.445 -4.933 632 HG2 PRO 77 1HG PRO 77 -25.074 -20.028 -2.308 633 HG3 PRO 77 2HG PRO 77 -24.481 -20.846 -3.765 634 HD2 PRO 77 1HD PRO 77 -23.771 -18.313 -3.124 635 HD3 PRO 77 2HD PRO 77 -23.928 -18.864 -4.804 Start of MODEL 9 1 H1 MET 1 H MET 1 5.560 0.507 -3.484 2 HA MET 1 HA MET 1 6.234 -2.317 -3.989 3 HB2 MET 1 1HB MET 1 7.437 -1.088 -2.066 4 HB3 MET 1 2HB MET 1 5.888 -1.157 -1.236 5 HG2 MET 1 1HG MET 1 5.898 -3.562 -1.318 6 HG3 MET 1 2HG MET 1 7.374 -3.554 -2.280 7 HE1 MET 1 3HE MET 1 9.985 -4.020 0.068 8 HE2 MET 1 1HE MET 1 9.331 -3.987 -1.570 9 HE3 MET 1 2HE MET 1 9.962 -2.509 -0.843 10 H ALA 2 H ALA 2 4.447 -3.384 -4.518 11 HA ALA 2 HA ALA 2 1.834 -2.484 -3.743 12 HB1 ALA 2 1HB ALA 2 2.948 -4.351 -5.638 13 HB2 ALA 2 2HB ALA 2 1.579 -5.057 -4.778 14 HB3 ALA 2 3HB ALA 2 1.384 -3.536 -5.648 15 H ILE 3 H ILE 3 0.297 -3.688 -2.518 16 HA ILE 3 HA ILE 3 1.525 -5.108 -0.288 17 HB ILE 3 HB ILE 3 -0.112 -3.272 0.126 18 HG12 ILE 3 1HG1 ILE 3 -1.388 -5.741 1.203 19 HG13 ILE 3 2HG1 ILE 3 0.314 -5.474 1.566 20 HG21 ILE 3 1HG2 ILE 3 -2.128 -3.220 -0.813 21 HG22 ILE 3 2HG2 ILE 3 -1.603 -4.568 -1.820 22 HG23 ILE 3 3HG2 ILE 3 -2.476 -4.876 -0.319 23 HD11 ILE 3 3HD1 ILE 3 -0.804 -4.541 3.371 24 HD12 ILE 3 1HD1 ILE 3 -0.426 -3.152 2.353 25 HD13 ILE 3 2HD1 ILE 3 -2.055 -3.829 2.353 26 H SER 4 H SER 4 0.791 -7.138 0.452 27 HA SER 4 HA SER 4 0.470 -9.106 -1.464 28 HB2 SER 4 1HB SER 4 -0.197 -9.078 1.478 29 HB3 SER 4 2HB SER 4 -0.369 -10.528 0.490 30 HG SER 4 HG SER 4 1.735 -10.738 0.420 31 H ALA 5 H ALA 5 -1.254 -10.247 -2.294 32 HA ALA 5 HA ALA 5 -3.656 -8.853 -2.719 33 HB1 ALA 5 1HB ALA 5 -4.395 -10.757 -3.928 34 HB2 ALA 5 2HB ALA 5 -2.658 -10.622 -4.201 35 HB3 ALA 5 3HB ALA 5 -3.281 -11.819 -3.066 36 H GLU 6 H GLU 6 -2.664 -11.010 -0.208 37 HA GLU 6 HA GLU 6 -5.220 -11.863 0.659 38 HB2 GLU 6 1HB GLU 6 -4.130 -12.679 2.608 39 HB3 GLU 6 2HB GLU 6 -3.004 -12.901 1.276 40 HG2 GLU 6 1HG GLU 6 -2.142 -10.539 2.077 41 HG3 GLU 6 2HG GLU 6 -2.863 -11.060 3.598 42 H GLU 7 H GLU 7 -3.452 -8.927 1.052 43 HA GLU 7 HA GLU 7 -5.061 -8.032 3.301 44 HB2 GLU 7 1HB GLU 7 -2.525 -7.507 2.742 45 HB3 GLU 7 2HB GLU 7 -3.239 -6.201 1.808 46 HG2 GLU 7 1HG GLU 7 -2.968 -5.111 3.767 47 HG3 GLU 7 2HG GLU 7 -4.557 -5.808 4.073 48 H LEU 8 H LEU 8 -4.984 -7.761 -0.144 49 HA LEU 8 HA LEU 8 -6.317 -5.388 -0.612 50 HB2 LEU 8 1HB LEU 8 -5.504 -6.534 -2.480 51 HB3 LEU 8 2HB LEU 8 -6.327 -8.027 -2.034 52 HG LEU 8 HG LEU 8 -8.490 -6.934 -2.598 53 HD11 LEU 8 1HD1 LEU 8 -7.817 -4.892 -4.283 54 HD12 LEU 8 2HD1 LEU 8 -6.710 -4.642 -2.933 55 HD13 LEU 8 3HD1 LEU 8 -8.449 -4.700 -2.647 56 HD21 LEU 8 3HD2 LEU 8 -6.324 -7.540 -4.509 57 HD22 LEU 8 1HD2 LEU 8 -7.723 -6.687 -5.161 58 HD23 LEU 8 2HD2 LEU 8 -7.936 -8.241 -4.355 59 H GLU 9 H GLU 9 -7.548 -8.405 0.619 60 HA GLU 9 HA GLU 9 -10.312 -7.792 0.208 61 HB2 GLU 9 1HB GLU 9 -10.768 -9.756 1.531 62 HB3 GLU 9 2HB GLU 9 -9.445 -10.108 0.428 63 HG2 GLU 9 1HG GLU 9 -8.009 -9.351 2.530 64 HG3 GLU 9 2HG GLU 9 -9.454 -9.899 3.378 65 H LYS 10 H LYS 10 -8.014 -7.383 2.835 66 HA LYS 10 HA LYS 10 -9.707 -6.787 4.937 67 HB2 LYS 10 1HB LYS 10 -7.049 -5.491 4.304 68 HB3 LYS 10 2HB LYS 10 -7.846 -5.475 5.872 69 HG2 LYS 10 1HG LYS 10 -7.238 -8.087 4.573 70 HG3 LYS 10 2HG LYS 10 -5.944 -7.185 5.366 71 HD2 LYS 10 1HD LYS 10 -8.550 -7.750 6.749 72 HD3 LYS 10 2HD LYS 10 -7.225 -8.916 6.758 73 HE2 LYS 10 1HE LYS 10 -5.755 -7.123 7.681 74 HE3 LYS 10 2HE LYS 10 -7.179 -6.091 7.811 75 HZ1 LYS 10 3HZ LYS 10 -6.483 -7.372 9.868 76 HZ2 LYS 10 1HZ LYS 10 -7.066 -8.756 9.089 77 HZ3 LYS 10 2HZ LYS 10 -8.114 -7.471 9.427 78 H ILE 11 H ILE 11 -8.888 -4.869 2.152 79 HA ILE 11 HA ILE 11 -9.886 -2.396 3.210 80 HB ILE 11 HB ILE 11 -9.308 -3.189 0.354 81 HG12 ILE 11 1HG1 ILE 11 -7.370 -1.437 1.011 82 HG13 ILE 11 2HG1 ILE 11 -7.654 -2.158 2.591 83 HG21 ILE 11 1HG2 ILE 11 -10.843 -1.349 0.372 84 HG22 ILE 11 2HG2 ILE 11 -9.889 -0.504 1.589 85 HG23 ILE 11 3HG2 ILE 11 -9.243 -0.731 -0.036 86 HD11 ILE 11 3HD1 ILE 11 -6.138 -3.168 0.424 87 HD12 ILE 11 1HD1 ILE 11 -6.388 -3.872 2.022 88 HD13 ILE 11 2HD1 ILE 11 -7.496 -4.258 0.704 89 H LEU 12 H LEU 12 -11.120 -4.886 1.012 90 HA LEU 12 HA LEU 12 -13.598 -3.534 0.540 91 HB2 LEU 12 1HB LEU 12 -12.512 -6.250 -0.078 92 HB3 LEU 12 2HB LEU 12 -14.230 -5.918 -0.292 93 HG LEU 12 HG LEU 12 -12.017 -4.385 -1.652 94 HD11 LEU 12 1HD1 LEU 12 -11.861 -6.016 -3.142 95 HD12 LEU 12 2HD1 LEU 12 -13.594 -5.916 -3.451 96 HD13 LEU 12 3HD1 LEU 12 -12.984 -6.991 -2.193 97 HD21 LEU 12 3HD2 LEU 12 -13.599 -3.089 -2.579 98 HD22 LEU 12 1HD2 LEU 12 -14.576 -3.598 -1.202 99 HD23 LEU 12 2HD2 LEU 12 -14.738 -4.425 -2.752 100 H LYS 13 H LYS 13 -12.375 -5.493 3.046 101 HA LYS 13 HA LYS 13 -14.850 -6.619 3.928 102 HB2 LYS 13 1HB LYS 13 -12.121 -6.325 5.154 103 HB3 LYS 13 2HB LYS 13 -13.476 -6.929 6.100 104 HG2 LYS 13 1HG LYS 13 -13.660 -8.490 3.897 105 HG3 LYS 13 2HG LYS 13 -11.916 -8.232 3.985 106 HD2 LYS 13 1HD LYS 13 -12.407 -10.197 5.240 107 HD3 LYS 13 2HD LYS 13 -12.033 -8.918 6.397 108 HE2 LYS 13 1HE LYS 13 -14.634 -8.549 6.331 109 HE3 LYS 13 2HE LYS 13 -14.642 -10.220 5.771 110 HZ1 LYS 13 3HZ LYS 13 -13.161 -10.641 7.800 111 HZ2 LYS 13 1HZ LYS 13 -14.816 -10.406 8.058 112 HZ3 LYS 13 2HZ LYS 13 -13.726 -9.149 8.362 113 H LYS 14 H LYS 14 -13.289 -3.573 4.307 114 HA LYS 14 HA LYS 14 -14.244 -2.650 6.726 115 HB2 LYS 14 1HB LYS 14 -13.840 -1.189 4.115 116 HB3 LYS 14 2HB LYS 14 -14.224 -0.371 5.624 117 HG2 LYS 14 1HG LYS 14 -11.823 -2.144 5.246 118 HG3 LYS 14 2HG LYS 14 -11.805 -0.392 5.031 119 HD2 LYS 14 1HD LYS 14 -12.949 -1.390 7.567 120 HD3 LYS 14 2HD LYS 14 -11.211 -1.609 7.354 121 HE2 LYS 14 1HE LYS 14 -11.525 0.956 6.523 122 HE3 LYS 14 2HE LYS 14 -12.779 0.845 7.758 123 HZ1 LYS 14 3HZ LYS 14 -9.864 0.482 8.061 124 HZ2 LYS 14 1HZ LYS 14 -10.944 -0.143 9.202 125 HZ3 LYS 14 2HZ LYS 14 -10.894 1.521 8.909 126 H SER 15 H SER 15 -15.846 -2.401 3.553 127 HA SER 15 HA SER 15 -18.359 -1.782 4.947 128 HB2 SER 15 1HB SER 15 -17.567 -0.165 3.214 129 HB3 SER 15 2HB SER 15 -17.720 -1.442 2.008 130 HG SER 15 HG SER 15 -19.832 -0.468 3.637 131 H PHE 16 H PHE 16 -16.770 -4.097 2.919 132 HA PHE 16 HA PHE 16 -19.268 -5.649 2.739 133 HB2 PHE 16 1HB PHE 16 -16.892 -6.173 0.984 134 HB3 PHE 16 2HB PHE 16 -18.589 -6.538 0.691 135 HD1 PHE 16 HD2 PHE 16 -19.943 -4.037 1.104 136 HD2 PHE 16 HD1 PHE 16 -16.154 -4.781 -0.688 137 HE1 PHE 16 HE2 PHE 16 -20.162 -1.968 -0.209 138 HE2 PHE 16 HE1 PHE 16 -16.367 -2.713 -2.003 139 HZ PHE 16 HZ PHE 16 -18.373 -1.304 -1.766 140 HA PRO 17 HA PRO 17 -16.381 -7.894 5.612 141 HB2 PRO 17 1HB PRO 17 -18.274 -8.421 7.486 142 HB3 PRO 17 2HB PRO 17 -17.334 -6.924 7.464 143 HG2 PRO 17 1HG PRO 17 -20.109 -7.433 6.465 144 HG3 PRO 17 2HG PRO 17 -19.488 -6.052 7.387 145 HD2 PRO 17 1HD PRO 17 -19.879 -5.958 4.709 146 HD3 PRO 17 2HD PRO 17 -18.586 -5.048 5.518 147 H SER 18 H SER 18 -19.818 -8.695 5.062 148 HA SER 18 HA SER 18 -19.440 -11.494 5.276 149 HB2 SER 18 1HB SER 18 -21.691 -10.196 3.749 150 HB3 SER 18 2HB SER 18 -21.712 -11.705 4.661 151 HG SER 18 HG SER 18 -22.176 -9.174 5.510 152 H SER 19 H SER 19 -19.385 -9.245 2.581 153 HA SER 19 HA SER 19 -19.558 -10.959 0.427 154 HB2 SER 19 1HB SER 19 -18.628 -9.250 -0.874 155 HB3 SER 19 2HB SER 19 -19.297 -8.374 0.503 156 HG SER 19 HG SER 19 -17.067 -8.681 1.406 157 H VAL 20 H VAL 20 -18.045 -12.074 -0.843 158 HA VAL 20 HA VAL 20 -15.702 -12.996 0.661 159 HB VAL 20 HB VAL 20 -17.060 -14.209 -1.751 160 HG11 VAL 20 1HG1 VAL 20 -14.647 -15.032 -0.165 161 HG12 VAL 20 2HG1 VAL 20 -15.599 -16.199 -1.085 162 HG13 VAL 20 3HG1 VAL 20 -14.812 -14.853 -1.911 163 HG21 VAL 20 3HG2 VAL 20 -17.374 -14.548 1.162 164 HG22 VAL 20 1HG2 VAL 20 -18.530 -14.806 -0.144 165 HG23 VAL 20 2HG2 VAL 20 -17.315 -16.033 0.213 166 H ILE 21 H ILE 21 -13.856 -12.008 0.195 167 HA ILE 21 HA ILE 21 -13.452 -10.823 -2.439 168 HB ILE 21 HB ILE 21 -11.624 -10.704 -0.040 169 HG12 ILE 21 1HG1 ILE 21 -12.696 -8.240 -0.161 170 HG13 ILE 21 2HG1 ILE 21 -14.062 -9.172 -0.765 171 HG21 ILE 21 1HG2 ILE 21 -10.272 -9.370 -1.234 172 HG22 ILE 21 2HG2 ILE 21 -11.067 -10.094 -2.631 173 HG23 ILE 21 3HG2 ILE 21 -11.618 -8.538 -2.013 174 HD11 ILE 21 3HD1 ILE 21 -14.609 -9.458 1.365 175 HD12 ILE 21 1HD1 ILE 21 -13.261 -10.593 1.447 176 HD13 ILE 21 2HD1 ILE 21 -13.030 -8.912 1.930 177 H LYS 22 H LYS 22 -12.163 -11.646 -3.963 178 HA LYS 22 HA LYS 22 -10.165 -13.657 -3.236 179 HB2 LYS 22 1HB LYS 22 -12.491 -14.600 -4.057 180 HB3 LYS 22 2HB LYS 22 -11.858 -14.180 -5.643 181 HG2 LYS 22 1HG LYS 22 -11.122 -16.318 -5.521 182 HG3 LYS 22 2HG LYS 22 -9.754 -15.517 -4.746 183 HD2 LYS 22 1HD LYS 22 -10.262 -17.310 -3.326 184 HD3 LYS 22 2HD LYS 22 -11.005 -15.911 -2.548 185 HE2 LYS 22 1HE LYS 22 -12.545 -17.765 -2.497 186 HE3 LYS 22 2HE LYS 22 -13.161 -16.525 -3.588 187 HZ1 LYS 22 3HZ LYS 22 -12.826 -19.173 -4.173 188 HZ2 LYS 22 1HZ LYS 22 -11.522 -18.424 -4.947 189 HZ3 LYS 22 2HZ LYS 22 -13.104 -17.932 -5.288 190 H ILE 23 H ILE 23 -8.380 -13.716 -4.566 191 HA ILE 23 HA ILE 23 -8.320 -11.714 -6.730 192 HB ILE 23 HB ILE 23 -6.003 -12.492 -4.957 193 HG12 ILE 23 1HG1 ILE 23 -6.379 -9.917 -4.369 194 HG13 ILE 23 2HG1 ILE 23 -8.041 -10.325 -4.781 195 HG21 ILE 23 1HG2 ILE 23 -6.307 -10.763 -7.346 196 HG22 ILE 23 2HG2 ILE 23 -5.228 -10.208 -6.067 197 HG23 ILE 23 3HG2 ILE 23 -4.950 -11.769 -6.840 198 HD11 ILE 23 3HD1 ILE 23 -6.447 -11.918 -2.804 199 HD12 ILE 23 1HD1 ILE 23 -7.379 -10.494 -2.345 200 HD13 ILE 23 2HD1 ILE 23 -8.193 -11.893 -3.046 201 H THR 24 H THR 24 -7.297 -12.248 -8.627 202 HA THR 24 HA THR 24 -6.037 -14.882 -8.840 203 HB THR 24 HB THR 24 -8.120 -14.010 -10.840 204 HG1 THR 24 HG1 THR 24 -9.530 -15.436 -9.770 205 HG21 THR 24 3HG2 THR 24 -6.729 -16.631 -10.289 206 HG22 THR 24 1HG2 THR 24 -6.531 -15.603 -11.707 207 HG23 THR 24 2HG2 THR 24 -8.063 -16.430 -11.424 208 H ASP 25 H ASP 25 -4.270 -14.857 -10.085 209 HA ASP 25 HA ASP 25 -3.711 -12.417 -11.617 210 HB2 ASP 25 1HB ASP 25 -1.899 -14.559 -10.498 211 HB3 ASP 25 2HB ASP 25 -1.335 -13.288 -11.580 212 H LEU 26 H LEU 26 -4.217 -12.554 -13.699 213 HA LEU 26 HA LEU 26 -3.645 -15.076 -15.113 214 HB2 LEU 26 1HB LEU 26 -5.798 -13.047 -15.691 215 HB3 LEU 26 2HB LEU 26 -5.454 -14.472 -16.670 216 HG LEU 26 HG LEU 26 -5.918 -15.701 -14.362 217 HD11 LEU 26 1HD1 LEU 26 -7.753 -14.603 -13.166 218 HD12 LEU 26 2HD1 LEU 26 -7.547 -13.172 -14.174 219 HD13 LEU 26 3HD1 LEU 26 -6.259 -13.669 -13.078 220 HD21 LEU 26 3HD2 LEU 26 -7.904 -16.376 -15.278 221 HD22 LEU 26 1HD2 LEU 26 -7.131 -15.669 -16.696 222 HD23 LEU 26 2HD2 LEU 26 -8.343 -14.750 -15.803 223 H VAL 27 H VAL 27 -1.915 -12.722 -14.658 224 HA VAL 27 HA VAL 27 -1.195 -12.281 -17.453 225 HB VAL 27 HB VAL 27 -1.492 -10.000 -15.494 226 HG11 VAL 27 1HG1 VAL 27 0.175 -9.174 -16.774 227 HG12 VAL 27 2HG1 VAL 27 -0.152 -10.283 -18.106 228 HG13 VAL 27 3HG1 VAL 27 -1.143 -8.838 -17.897 229 HG21 VAL 27 3HG2 VAL 27 -3.668 -10.555 -16.197 230 HG22 VAL 27 1HG2 VAL 27 -3.175 -9.220 -17.239 231 HG23 VAL 27 2HG2 VAL 27 -3.142 -10.874 -17.850 232 H GLY 28 H GLY 28 0.884 -12.759 -17.680 233 HA2 GLY 28 1HA GLY 28 2.621 -12.658 -15.313 234 HA3 GLY 28 2HA GLY 28 2.929 -13.586 -16.773 235 H ASP 29 H ASP 29 1.864 -10.293 -17.008 236 HA ASP 29 HA ASP 29 4.576 -9.528 -17.872 237 HB2 ASP 29 1HB ASP 29 2.984 -9.527 -19.723 238 HB3 ASP 29 2HB ASP 29 1.903 -8.472 -18.817 239 H GLN 30 H GLN 30 1.602 -7.830 -16.872 240 HA GLN 30 HA GLN 30 3.271 -6.033 -15.259 241 HB2 GLN 30 1HB GLN 30 1.522 -5.300 -17.108 242 HB3 GLN 30 2HB GLN 30 0.385 -5.484 -15.780 243 HG2 GLN 30 1HG GLN 30 2.847 -3.895 -15.308 244 HG3 GLN 30 2HG GLN 30 1.566 -3.188 -16.291 245 HE21 GLN 30 2HE2 GLN 30 -0.699 -3.929 -15.154 246 HE22 GLN 30 1HE2 GLN 30 -0.802 -3.387 -13.517 247 H ASP 31 H ASP 31 2.380 -5.294 -13.183 248 HA ASP 31 HA ASP 31 1.526 -7.534 -11.609 249 HB2 ASP 31 1HB ASP 31 2.170 -4.660 -10.984 250 HB3 ASP 31 2HB ASP 31 1.503 -5.737 -9.760 251 H HIS 32 H HIS 32 -0.523 -7.833 -12.799 252 HA HIS 32 HA HIS 32 -2.619 -5.934 -12.013 253 HB2 HIS 32 1HB HIS 32 -2.294 -7.861 -14.256 254 HB3 HIS 32 2HB HIS 32 -3.928 -7.586 -13.660 255 HD1 HIS 32 HD1 HIS 32 -3.721 -4.545 -13.112 256 HD2 HIS 32 HD2 HIS 32 -2.377 -6.416 -16.569 257 HE1 HIS 32 HE1 HIS 32 -3.689 -2.754 -14.877 258 H TYR 33 H TYR 33 -4.754 -6.919 -11.434 259 HA TYR 33 HA TYR 33 -4.613 -9.546 -10.192 260 HB2 TYR 33 1HB TYR 33 -5.145 -7.018 -8.621 261 HB3 TYR 33 2HB TYR 33 -5.484 -8.639 -8.022 262 HD1 TYR 33 HD2 TYR 33 -3.519 -10.271 -7.849 263 HD2 TYR 33 HD1 TYR 33 -3.018 -6.078 -8.367 264 HE1 TYR 33 HE2 TYR 33 -1.211 -10.450 -7.018 265 HE2 TYR 33 HE1 TYR 33 -0.708 -6.245 -7.539 266 HH TYR 33 HH TYR 33 1.062 -7.990 -7.363 267 H ALA 34 H ALA 34 -6.589 -10.536 -9.978 268 HA ALA 34 HA ALA 34 -8.873 -9.069 -11.118 269 HB1 ALA 34 1HB ALA 34 -8.350 -12.039 -11.068 270 HB2 ALA 34 2HB ALA 34 -9.764 -11.254 -11.773 271 HB3 ALA 34 3HB ALA 34 -8.165 -10.971 -12.459 272 H LEU 35 H LEU 35 -10.001 -8.267 -9.436 273 HA LEU 35 HA LEU 35 -10.317 -9.729 -6.975 274 HB2 LEU 35 1HB LEU 35 -10.139 -7.349 -6.848 275 HB3 LEU 35 2HB LEU 35 -11.473 -7.137 -7.980 276 HG LEU 35 HG LEU 35 -12.909 -8.283 -6.176 277 HD11 LEU 35 1HD1 LEU 35 -12.152 -8.241 -3.951 278 HD12 LEU 35 2HD1 LEU 35 -10.724 -7.293 -4.368 279 HD13 LEU 35 3HD1 LEU 35 -10.843 -8.978 -4.876 280 HD21 LEU 35 3HD2 LEU 35 -13.590 -6.224 -5.470 281 HD22 LEU 35 1HD2 LEU 35 -12.604 -5.743 -6.852 282 HD23 LEU 35 2HD2 LEU 35 -11.944 -5.641 -5.220 283 H GLU 36 H GLU 36 -12.171 -10.681 -6.181 284 HA GLU 36 HA GLU 36 -14.491 -10.839 -7.969 285 HB2 GLU 36 1HB GLU 36 -13.386 -13.280 -6.589 286 HB3 GLU 36 2HB GLU 36 -14.632 -13.206 -7.828 287 HG2 GLU 36 1HG GLU 36 -12.993 -12.536 -9.479 288 HG3 GLU 36 2HG GLU 36 -11.733 -12.513 -8.246 289 H ILE 37 H ILE 37 -15.989 -9.852 -6.758 290 HA ILE 37 HA ILE 37 -16.177 -10.526 -3.906 291 HB ILE 37 HB ILE 37 -16.036 -8.117 -4.532 292 HG12 ILE 37 1HG1 ILE 37 -18.642 -7.964 -3.392 293 HG13 ILE 37 2HG1 ILE 37 -17.860 -9.406 -2.755 294 HG21 ILE 37 1HG2 ILE 37 -17.751 -8.758 -6.542 295 HG22 ILE 37 2HG2 ILE 37 -18.838 -7.998 -5.380 296 HG23 ILE 37 3HG2 ILE 37 -17.431 -7.118 -5.978 297 HD11 ILE 37 3HD1 ILE 37 -17.607 -7.022 -1.628 298 HD12 ILE 37 1HD1 ILE 37 -16.315 -8.223 -1.603 299 HD13 ILE 37 2HD1 ILE 37 -16.277 -6.910 -2.780 300 H SER 38 H SER 38 -17.910 -11.548 -3.070 301 HA SER 38 HA SER 38 -20.257 -11.972 -4.782 302 HB2 SER 38 1HB SER 38 -19.120 -14.221 -3.133 303 HB3 SER 38 2HB SER 38 -20.287 -14.305 -4.453 304 HG SER 38 HG SER 38 -18.204 -14.971 -5.117 305 H ASP 39 H ASP 39 -22.054 -11.434 -3.752 306 HA ASP 39 HA ASP 39 -22.726 -12.245 -1.150 307 HB2 ASP 39 1HB ASP 39 -20.935 -10.308 -0.873 308 HB3 ASP 39 2HB ASP 39 -22.343 -9.285 -1.144 309 H ALA 40 H ALA 40 -24.701 -10.935 -0.329 310 HA ALA 40 HA ALA 40 -26.432 -10.483 -2.655 311 HB1 ALA 40 1HB ALA 40 -28.297 -10.929 -1.176 312 HB2 ALA 40 2HB ALA 40 -27.113 -12.232 -1.062 313 HB3 ALA 40 3HB ALA 40 -27.209 -11.015 0.210 314 H GLN 41 H GLN 41 -24.704 -8.401 -2.024 315 HA GLN 41 HA GLN 41 -26.515 -6.410 -0.824 316 HB2 GLN 41 1HB GLN 41 -24.503 -5.092 -0.288 317 HB3 GLN 41 2HB GLN 41 -24.488 -6.669 0.489 318 HG2 GLN 41 1HG GLN 41 -23.119 -7.344 -1.651 319 HG3 GLN 41 2HG GLN 41 -22.780 -5.615 -1.700 320 HE21 GLN 41 2HE2 GLN 41 -23.093 -7.976 0.930 321 HE22 GLN 41 1HE2 GLN 41 -21.558 -7.639 1.645 322 H PHE 42 H PHE 42 -24.647 -7.312 -3.584 323 HA PHE 42 HA PHE 42 -25.016 -4.700 -4.842 324 HB2 PHE 42 1HB PHE 42 -23.541 -7.160 -5.805 325 HB3 PHE 42 2HB PHE 42 -23.598 -5.617 -6.650 326 HD1 PHE 42 HD1 PHE 42 -22.417 -3.672 -5.771 327 HD2 PHE 42 HD2 PHE 42 -22.161 -7.474 -3.873 328 HE1 PHE 42 HE1 PHE 42 -20.451 -2.905 -4.506 329 HE2 PHE 42 HE2 PHE 42 -20.195 -6.712 -2.605 330 HZ PHE 42 HZ PHE 42 -19.338 -4.425 -2.920 331 H ASN 43 H ASN 43 -27.234 -6.595 -4.277 332 HA ASN 43 HA ASN 43 -28.059 -7.560 -6.877 333 HB2 ASN 43 1HB ASN 43 -29.085 -7.763 -4.092 334 HB3 ASN 43 2HB ASN 43 -30.259 -7.917 -5.395 335 HD21 ASN 43 2HD2 ASN 43 -29.399 -9.912 -3.495 336 HD22 ASN 43 1HD2 ASN 43 -28.741 -11.218 -4.414 337 H GLY 44 H GLY 44 -29.003 -6.307 -8.339 338 HA2 GLY 44 1HA GLY 44 -30.776 -4.922 -9.084 339 HA3 GLY 44 2HA GLY 44 -30.932 -4.288 -7.452 340 H LEU 45 H LEU 45 -27.742 -4.512 -8.678 341 HA LEU 45 HA LEU 45 -27.714 -1.596 -9.075 342 HB2 LEU 45 1HB LEU 45 -25.607 -3.517 -8.130 343 HB3 LEU 45 2HB LEU 45 -25.216 -1.886 -8.669 344 HG LEU 45 HG LEU 45 -27.041 -2.551 -6.361 345 HD11 LEU 45 1HD1 LEU 45 -24.640 -1.170 -5.644 346 HD12 LEU 45 2HD1 LEU 45 -24.238 -2.661 -6.494 347 HD13 LEU 45 3HD1 LEU 45 -25.258 -2.714 -5.056 348 HD21 LEU 45 3HD2 LEU 45 -25.922 0.060 -7.374 349 HD22 LEU 45 1HD2 LEU 45 -26.788 -0.146 -5.851 350 HD23 LEU 45 2HD2 LEU 45 -27.614 -0.441 -7.381 351 H SER 46 H SER 46 -25.860 -0.882 -10.561 352 HA SER 46 HA SER 46 -26.033 -2.491 -13.011 353 HB2 SER 46 1HB SER 46 -26.846 -0.131 -13.088 354 HB3 SER 46 2HB SER 46 -25.208 0.407 -12.716 355 HG SER 46 HG SER 46 -26.229 -0.728 -15.058 356 H LEU 47 H LEU 47 -24.123 -2.546 -14.420 357 HA LEU 47 HA LEU 47 -21.894 -3.612 -13.192 358 HB2 LEU 47 1HB LEU 47 -22.412 -2.456 -15.887 359 HB3 LEU 47 2HB LEU 47 -20.753 -2.847 -15.439 360 HG LEU 47 HG LEU 47 -21.740 -4.651 -16.722 361 HD11 LEU 47 1HD1 LEU 47 -21.113 -6.438 -15.339 362 HD12 LEU 47 2HD1 LEU 47 -21.597 -5.586 -13.873 363 HD13 LEU 47 3HD1 LEU 47 -20.167 -5.064 -14.764 364 HD21 LEU 47 3HD2 LEU 47 -23.652 -5.900 -15.930 365 HD22 LEU 47 1HD2 LEU 47 -24.091 -4.203 -16.125 366 HD23 LEU 47 2HD2 LEU 47 -23.786 -4.856 -14.515 367 H ILE 48 H ILE 48 -22.647 -0.275 -13.874 368 HA ILE 48 HA ILE 48 -19.994 0.703 -13.374 369 HB ILE 48 HB ILE 48 -22.618 2.198 -13.458 370 HG12 ILE 48 1HG1 ILE 48 -22.126 1.119 -15.585 371 HG13 ILE 48 2HG1 ILE 48 -21.881 2.856 -15.728 372 HG21 ILE 48 1HG2 ILE 48 -21.038 3.502 -12.246 373 HG22 ILE 48 2HG2 ILE 48 -19.764 3.155 -13.413 374 HG23 ILE 48 3HG2 ILE 48 -21.129 4.172 -13.875 375 HD11 ILE 48 3HD1 ILE 48 -19.412 2.318 -15.238 376 HD12 ILE 48 1HD1 ILE 48 -19.853 0.665 -15.664 377 HD13 ILE 48 2HD1 ILE 48 -20.062 1.965 -16.838 378 H ASN 49 H ASN 49 -23.033 0.583 -11.547 379 HA ASN 49 HA ASN 49 -22.127 1.959 -9.271 380 HB2 ASN 49 1HB ASN 49 -24.285 -0.138 -9.576 381 HB3 ASN 49 2HB ASN 49 -24.028 0.803 -8.110 382 HD21 ASN 49 2HD2 ASN 49 -26.425 0.819 -9.478 383 HD22 ASN 49 1HD2 ASN 49 -26.674 2.385 -10.164 384 H GLN 50 H GLN 50 -22.109 -1.484 -10.093 385 HA GLN 50 HA GLN 50 -21.145 -2.421 -7.618 386 HB2 GLN 50 1HB GLN 50 -21.092 -3.543 -10.408 387 HB3 GLN 50 2HB GLN 50 -20.340 -4.395 -9.065 388 HG2 GLN 50 1HG GLN 50 -22.316 -4.981 -8.145 389 HG3 GLN 50 2HG GLN 50 -23.123 -3.502 -8.664 390 HE21 GLN 50 2HE2 GLN 50 -24.786 -4.030 -9.881 391 HE22 GLN 50 1HE2 GLN 50 -24.787 -5.199 -11.153 392 H HIS 51 H HIS 51 -19.491 -1.384 -10.565 393 HA HIS 51 HA HIS 51 -16.878 -2.022 -9.581 394 HB2 HIS 51 1HB HIS 51 -17.833 -1.623 -12.058 395 HB3 HIS 51 2HB HIS 51 -17.196 -0.011 -11.745 396 HD1 HIS 51 HD1 HIS 51 -16.187 -3.391 -12.715 397 HD2 HIS 51 HD2 HIS 51 -14.348 0.007 -11.188 398 HE1 HIS 51 HE1 HIS 51 -13.725 -3.730 -13.097 399 H LYS 52 H LYS 52 -19.011 0.689 -9.355 400 HA LYS 52 HA LYS 52 -16.965 2.587 -8.634 401 HB2 LYS 52 1HB LYS 52 -19.228 3.094 -9.743 402 HB3 LYS 52 2HB LYS 52 -19.918 2.908 -8.136 403 HG2 LYS 52 1HG LYS 52 -18.193 4.655 -7.403 404 HG3 LYS 52 2HG LYS 52 -18.005 4.988 -9.126 405 HD2 LYS 52 1HD LYS 52 -20.733 4.929 -7.902 406 HD3 LYS 52 2HD LYS 52 -19.716 6.360 -7.721 407 HE2 LYS 52 1HE LYS 52 -19.635 6.721 -10.046 408 HE3 LYS 52 2HE LYS 52 -20.249 5.108 -10.400 409 HZ1 LYS 52 3HZ LYS 52 -22.251 6.022 -10.512 410 HZ2 LYS 52 1HZ LYS 52 -21.689 7.510 -9.935 411 HZ3 LYS 52 2HZ LYS 52 -22.177 6.310 -8.847 412 H LEU 53 H LEU 53 -19.472 0.747 -6.929 413 HA LEU 53 HA LEU 53 -19.181 1.771 -4.384 414 HB2 LEU 53 1HB LEU 53 -19.973 -0.881 -5.472 415 HB3 LEU 53 2HB LEU 53 -19.685 -0.743 -3.739 416 HG LEU 53 HG LEU 53 -21.692 0.872 -5.312 417 HD11 LEU 53 1HD1 LEU 53 -23.288 -0.496 -3.848 418 HD12 LEU 53 2HD1 LEU 53 -21.929 -1.597 -3.626 419 HD13 LEU 53 3HD1 LEU 53 -22.561 -1.292 -5.244 420 HD21 LEU 53 3HD2 LEU 53 -22.469 1.217 -2.824 421 HD22 LEU 53 1HD2 LEU 53 -21.224 2.243 -3.538 422 HD23 LEU 53 2HD2 LEU 53 -20.766 0.907 -2.481 423 H VAL 54 H VAL 54 -17.474 -1.052 -5.741 424 HA VAL 54 HA VAL 54 -15.837 -1.631 -3.592 425 HB VAL 54 HB VAL 54 -14.236 -2.582 -5.251 426 HG11 VAL 54 1HG1 VAL 54 -16.657 -3.642 -6.386 427 HG12 VAL 54 2HG1 VAL 54 -15.535 -4.385 -5.244 428 HG13 VAL 54 3HG1 VAL 54 -16.853 -3.371 -4.655 429 HG21 VAL 54 3HG2 VAL 54 -14.422 -0.995 -7.037 430 HG22 VAL 54 1HG2 VAL 54 -14.952 -2.565 -7.641 431 HG23 VAL 54 2HG2 VAL 54 -16.143 -1.332 -7.225 432 H LYS 55 H LYS 55 -15.503 0.873 -6.022 433 HA LYS 55 HA LYS 55 -12.834 1.598 -5.218 434 HB2 LYS 55 1HB LYS 55 -14.834 3.002 -6.999 435 HB3 LYS 55 2HB LYS 55 -13.171 3.523 -6.760 436 HG2 LYS 55 1HG LYS 55 -13.798 0.768 -7.748 437 HG3 LYS 55 2HG LYS 55 -13.739 2.147 -8.848 438 HD2 LYS 55 1HD LYS 55 -11.566 1.459 -8.987 439 HD3 LYS 55 2HD LYS 55 -11.432 2.565 -7.617 440 HE2 LYS 55 1HE LYS 55 -11.022 0.901 -6.155 441 HE3 LYS 55 2HE LYS 55 -12.172 -0.193 -6.922 442 HZ1 LYS 55 3HZ LYS 55 -9.740 -0.821 -7.041 443 HZ2 LYS 55 1HZ LYS 55 -9.556 0.444 -8.150 444 HZ3 LYS 55 2HZ LYS 55 -10.593 -0.846 -8.502 445 H ASN 56 H ASN 56 -16.083 2.530 -4.402 446 HA ASN 56 HA ASN 56 -15.356 4.990 -3.115 447 HB2 ASN 56 1HB ASN 56 -17.897 3.387 -2.765 448 HB3 ASN 56 2HB ASN 56 -17.661 5.095 -2.405 449 HD21 ASN 56 2HD2 ASN 56 -19.525 3.678 -4.221 450 HD22 ASN 56 1HD2 ASN 56 -19.296 4.414 -5.767 451 H ALA 57 H ALA 57 -16.088 1.695 -2.055 452 HA ALA 57 HA ALA 57 -16.046 2.134 0.706 453 HB1 ALA 57 1HB ALA 57 -16.494 -0.021 -0.881 454 HB2 ALA 57 2HB ALA 57 -14.930 -0.432 -0.176 455 HB3 ALA 57 3HB ALA 57 -16.306 -0.090 0.871 456 H LEU 58 H LEU 58 -13.493 2.107 -1.592 457 HA LEU 58 HA LEU 58 -11.491 1.961 0.561 458 HB2 LEU 58 1HB LEU 58 -9.862 1.490 -1.222 459 HB3 LEU 58 2HB LEU 58 -11.145 0.285 -1.125 460 HG LEU 58 HG LEU 58 -12.223 1.707 -3.039 461 HD11 LEU 58 1HD1 LEU 58 -9.627 2.227 -4.152 462 HD12 LEU 58 2HD1 LEU 58 -9.844 3.125 -2.651 463 HD13 LEU 58 3HD1 LEU 58 -11.004 3.312 -3.965 464 HD21 LEU 58 3HD2 LEU 58 -11.593 0.043 -4.428 465 HD22 LEU 58 1HD2 LEU 58 -10.942 -0.654 -2.945 466 HD23 LEU 58 2HD2 LEU 58 -9.880 0.224 -4.046 467 H SER 59 H SER 59 -13.108 4.102 -1.428 468 HA SER 59 HA SER 59 -10.906 5.985 -1.695 469 HB2 SER 59 1HB SER 59 -12.393 5.836 -3.587 470 HB3 SER 59 2HB SER 59 -13.802 6.112 -2.563 471 HG SER 59 HG SER 59 -13.406 8.081 -3.343 472 H GLU 60 H GLU 60 -12.879 5.120 0.747 473 HA GLU 60 HA GLU 60 -13.153 7.859 1.788 474 HB2 GLU 60 1HB GLU 60 -14.746 6.790 3.433 475 HB3 GLU 60 2HB GLU 60 -15.280 6.804 1.758 476 HG2 GLU 60 1HG GLU 60 -14.535 4.468 1.530 477 HG3 GLU 60 2HG GLU 60 -14.093 4.467 3.236 478 H ILE 61 H ILE 61 -12.154 4.576 2.678 479 HA ILE 61 HA ILE 61 -10.882 5.588 5.103 480 HB ILE 61 HB ILE 61 -11.085 2.748 4.095 481 HG12 ILE 61 1HG1 ILE 61 -12.590 3.572 6.490 482 HG13 ILE 61 2HG1 ILE 61 -13.152 4.295 4.986 483 HG21 ILE 61 1HG2 ILE 61 -9.602 3.971 6.249 484 HG22 ILE 61 2HG2 ILE 61 -10.738 2.767 6.855 485 HG23 ILE 61 3HG2 ILE 61 -9.543 2.318 5.639 486 HD11 ILE 61 3HD1 ILE 61 -13.844 1.822 5.984 487 HD12 ILE 61 1HD1 ILE 61 -14.115 2.405 4.342 488 HD13 ILE 61 2HD1 ILE 61 -12.676 1.454 4.714 489 H LEU 62 H LEU 62 -10.096 4.604 1.895 490 HA LEU 62 HA LEU 62 -8.125 4.270 0.789 491 HB2 LEU 62 1HB LEU 62 -7.192 6.376 2.733 492 HB3 LEU 62 2HB LEU 62 -6.443 5.977 1.188 493 HG LEU 62 HG LEU 62 -8.953 6.625 0.389 494 HD11 LEU 62 1HD1 LEU 62 -9.524 7.255 2.735 495 HD12 LEU 62 2HD1 LEU 62 -9.723 8.555 1.561 496 HD13 LEU 62 3HD1 LEU 62 -8.318 8.538 2.626 497 HD21 LEU 62 3HD2 LEU 62 -6.690 8.574 0.810 498 HD22 LEU 62 1HD2 LEU 62 -7.997 8.709 -0.367 499 HD23 LEU 62 2HD2 LEU 62 -6.801 7.422 -0.522 500 H ASN 63 H ASN 63 -8.448 2.293 2.619 501 HA ASN 63 HA ASN 63 -6.532 1.904 4.565 502 HB2 ASN 63 1HB ASN 63 -8.248 0.172 2.919 503 HB3 ASN 63 2HB ASN 63 -6.791 -0.615 3.518 504 HD21 ASN 63 2HD2 ASN 63 -9.775 -0.703 4.167 505 HD22 ASN 63 1HD2 ASN 63 -9.814 -0.610 5.892 506 H LYS 64 H LYS 64 -6.300 0.345 1.371 507 HA LYS 64 HA LYS 64 -3.721 1.312 0.768 508 HB2 LYS 64 1HB LYS 64 -3.575 -0.534 2.761 509 HB3 LYS 64 2HB LYS 64 -3.427 -1.567 1.345 510 HG2 LYS 64 1HG LYS 64 -1.241 -1.098 1.596 511 HG3 LYS 64 2HG LYS 64 -1.675 0.346 0.678 512 HD2 LYS 64 1HD LYS 64 -2.003 0.470 3.621 513 HD3 LYS 64 2HD LYS 64 -0.351 0.447 2.998 514 HE2 LYS 64 1HE LYS 64 -2.485 2.357 2.059 515 HE3 LYS 64 2HE LYS 64 -1.315 2.732 3.323 516 HZ1 LYS 64 3HZ LYS 64 -0.919 2.476 0.441 517 HZ2 LYS 64 1HZ LYS 64 0.342 1.957 1.442 518 HZ3 LYS 64 2HZ LYS 64 -0.212 3.552 1.539 519 H LYS 65 H LYS 65 -2.641 -0.530 -0.816 520 HA LYS 65 HA LYS 65 -2.786 -1.354 -2.936 521 HB2 LYS 65 1HB LYS 65 -4.232 -2.983 -1.289 522 HB3 LYS 65 2HB LYS 65 -5.425 -2.592 -2.520 523 HG2 LYS 65 1HG LYS 65 -2.734 -3.421 -3.441 524 HG3 LYS 65 2HG LYS 65 -3.781 -4.657 -2.740 525 HD2 LYS 65 1HD LYS 65 -4.485 -4.812 -4.894 526 HD3 LYS 65 2HD LYS 65 -5.545 -3.499 -4.376 527 HE2 LYS 65 1HE LYS 65 -4.712 -2.454 -6.188 528 HE3 LYS 65 2HE LYS 65 -3.357 -2.101 -5.117 529 HZ1 LYS 65 3HZ LYS 65 -2.034 -3.630 -6.134 530 HZ2 LYS 65 1HZ LYS 65 -2.993 -3.189 -7.456 531 HZ3 LYS 65 2HZ LYS 65 -3.320 -4.618 -6.613 532 H LEU 66 H LEU 66 -3.761 1.265 -2.659 533 HA LEU 66 HA LEU 66 -6.131 1.347 -4.383 534 HB2 LEU 66 1HB LEU 66 -4.819 3.753 -3.184 535 HB3 LEU 66 2HB LEU 66 -6.499 3.528 -3.665 536 HG LEU 66 HG LEU 66 -5.233 2.164 -1.293 537 HD11 LEU 66 1HD1 LEU 66 -5.976 3.837 0.100 538 HD12 LEU 66 2HD1 LEU 66 -7.153 4.437 -1.068 539 HD13 LEU 66 3HD1 LEU 66 -5.436 4.763 -1.300 540 HD21 LEU 66 3HD2 LEU 66 -7.351 1.273 -2.525 541 HD22 LEU 66 1HD2 LEU 66 -8.154 2.618 -1.714 542 HD23 LEU 66 2HD2 LEU 66 -7.334 1.379 -0.764 543 H HIS 67 H HIS 67 -5.117 0.770 -6.334 544 HA HIS 67 HA HIS 67 -3.628 2.972 -7.562 545 HB2 HIS 67 1HB HIS 67 -2.752 0.106 -7.385 546 HB3 HIS 67 2HB HIS 67 -2.268 1.097 -8.758 547 HD1 HIS 67 HD1 HIS 67 -1.471 3.690 -7.538 548 HD2 HIS 67 HD2 HIS 67 -0.623 0.046 -5.731 549 HE1 HIS 67 HE1 HIS 67 0.472 4.136 -6.004 550 H SER 68 H SER 68 -4.478 -0.309 -8.636 551 HA SER 68 HA SER 68 -6.751 0.359 -10.116 552 HB2 SER 68 1HB SER 68 -5.608 0.144 -12.437 553 HB3 SER 68 2HB SER 68 -5.540 1.699 -11.608 554 HG SER 68 HG SER 68 -3.483 1.299 -12.233 555 H ILE 69 H ILE 69 -7.760 -1.523 -10.237 556 HA ILE 69 HA ILE 69 -6.378 -3.876 -11.225 557 HB ILE 69 HB ILE 69 -7.206 -5.287 -9.332 558 HG12 ILE 69 1HG1 ILE 69 -7.355 -2.822 -7.649 559 HG13 ILE 69 2HG1 ILE 69 -8.761 -3.272 -8.607 560 HG21 ILE 69 1HG2 ILE 69 -5.200 -3.143 -8.646 561 HG22 ILE 69 2HG2 ILE 69 -5.382 -4.680 -7.802 562 HG23 ILE 69 3HG2 ILE 69 -4.868 -4.655 -9.489 563 HD11 ILE 69 3HD1 ILE 69 -8.860 -4.112 -6.305 564 HD12 ILE 69 1HD1 ILE 69 -8.875 -5.409 -7.499 565 HD13 ILE 69 2HD1 ILE 69 -7.399 -5.053 -6.602 566 H SER 70 H SER 70 -7.920 -5.737 -11.480 567 HA SER 70 HA SER 70 -10.368 -4.742 -12.653 568 HB2 SER 70 1HB SER 70 -9.291 -6.368 -13.980 569 HB3 SER 70 2HB SER 70 -9.011 -7.432 -12.602 570 HG SER 70 HG SER 70 -11.322 -7.039 -14.117 571 H ILE 71 H ILE 71 -12.413 -5.061 -11.937 572 HA ILE 71 HA ILE 71 -12.729 -6.505 -9.386 573 HB ILE 71 HB ILE 71 -14.237 -4.052 -10.299 574 HG12 ILE 71 1HG1 ILE 71 -12.745 -3.957 -7.778 575 HG13 ILE 71 2HG1 ILE 71 -11.718 -4.182 -9.189 576 HG21 ILE 71 1HG2 ILE 71 -14.883 -6.088 -8.388 577 HG22 ILE 71 2HG2 ILE 71 -14.649 -4.546 -7.567 578 HG23 ILE 71 3HG2 ILE 71 -15.823 -4.679 -8.877 579 HD11 ILE 71 3HD1 ILE 71 -12.100 -2.104 -9.960 580 HD12 ILE 71 1HD1 ILE 71 -13.775 -2.087 -9.409 581 HD13 ILE 71 2HD1 ILE 71 -12.466 -1.787 -8.265 582 H LYS 72 H LYS 72 -13.976 -8.237 -9.534 583 HA LYS 72 HA LYS 72 -15.866 -8.447 -11.768 584 HB2 LYS 72 1HB LYS 72 -14.202 -10.244 -11.548 585 HB3 LYS 72 2HB LYS 72 -14.784 -10.586 -9.924 586 HG2 LYS 72 1HG LYS 72 -17.022 -11.092 -10.940 587 HG3 LYS 72 2HG LYS 72 -16.247 -10.976 -12.521 588 HD2 LYS 72 1HD LYS 72 -14.818 -12.816 -12.048 589 HD3 LYS 72 2HD LYS 72 -15.276 -12.816 -10.343 590 HE2 LYS 72 1HE LYS 72 -16.567 -14.542 -11.120 591 HE3 LYS 72 2HE LYS 72 -17.683 -13.194 -11.326 592 HZ1 LYS 72 3HZ LYS 72 -17.468 -14.742 -13.270 593 HZ2 LYS 72 1HZ LYS 72 -15.900 -14.145 -13.493 594 HZ3 LYS 72 2HZ LYS 72 -17.228 -13.105 -13.623 595 H THR 73 H THR 73 -18.025 -8.811 -11.471 596 HA THR 73 HA THR 73 -19.012 -8.469 -8.722 597 HB THR 73 HB THR 73 -21.020 -7.553 -9.609 598 HG1 THR 73 HG1 THR 73 -20.060 -8.303 -12.189 599 HG21 THR 73 3HG2 THR 73 -18.659 -6.524 -11.184 600 HG22 THR 73 1HG2 THR 73 -19.190 -5.971 -9.597 601 HG23 THR 73 2HG2 THR 73 -20.198 -5.681 -11.015 602 H ILE 74 H ILE 74 -20.186 -10.014 -7.762 603 HA ILE 74 HA ILE 74 -21.396 -12.125 -9.391 604 HB ILE 74 HB ILE 74 -19.593 -12.669 -7.029 605 HG12 ILE 74 1HG1 ILE 74 -18.601 -14.123 -9.098 606 HG13 ILE 74 2HG1 ILE 74 -19.211 -12.715 -9.959 607 HG21 ILE 74 1HG2 ILE 74 -21.021 -14.400 -6.783 608 HG22 ILE 74 2HG2 ILE 74 -21.611 -14.290 -8.440 609 HG23 ILE 74 3HG2 ILE 74 -20.075 -15.086 -8.103 610 HD11 ILE 74 3HD1 ILE 74 -17.566 -12.236 -7.546 611 HD12 ILE 74 1HD1 ILE 74 -16.755 -12.830 -8.994 612 HD13 ILE 74 2HD1 ILE 74 -17.670 -11.323 -9.051 613 H SER 75 H SER 75 -23.442 -12.370 -8.815 614 HA SER 75 HA SER 75 -24.216 -11.704 -6.050 615 HB2 SER 75 1HB SER 75 -26.373 -11.005 -6.880 616 HB3 SER 75 2HB SER 75 -25.129 -10.185 -7.823 617 HG SER 75 HG SER 75 -26.918 -12.185 -8.579 618 H ILE 76 H ILE 76 -25.164 -13.236 -4.859 619 HA ILE 76 HA ILE 76 -26.466 -15.501 -6.157 620 HB ILE 76 HB ILE 76 -25.255 -17.053 -4.524 621 HG12 ILE 76 1HG1 ILE 76 -23.109 -14.942 -4.623 622 HG13 ILE 76 2HG1 ILE 76 -24.257 -15.024 -3.292 623 HG21 ILE 76 1HG2 ILE 76 -23.839 -17.687 -6.192 624 HG22 ILE 76 2HG2 ILE 76 -24.872 -16.586 -7.101 625 HG23 ILE 76 3HG2 ILE 76 -23.302 -16.039 -6.515 626 HD11 ILE 76 3HD1 ILE 76 -23.030 -17.590 -3.860 627 HD12 ILE 76 1HD1 ILE 76 -21.852 -16.342 -3.456 628 HD13 ILE 76 2HD1 ILE 76 -23.168 -16.708 -2.339 629 HA PRO 77 HA PRO 77 -29.303 -15.211 -2.820 630 HB2 PRO 77 1HB PRO 77 -30.075 -17.799 -2.542 631 HB3 PRO 77 2HB PRO 77 -30.568 -16.791 -3.908 632 HG2 PRO 77 1HG PRO 77 -28.386 -18.835 -3.752 633 HG3 PRO 77 2HG PRO 77 -29.565 -18.554 -5.046 634 HD2 PRO 77 1HD PRO 77 -27.014 -17.657 -5.181 635 HD3 PRO 77 2HD PRO 77 -28.372 -16.787 -5.922 Start of MODEL 10 1 H1 MET 1 H MET 1 6.860 -3.575 -4.742 2 HA MET 1 HA MET 1 7.820 -6.210 -3.835 3 HB2 MET 1 1HB MET 1 7.086 -3.740 -2.342 4 HB3 MET 1 2HB MET 1 6.694 -5.287 -1.603 5 HG2 MET 1 1HG MET 1 9.443 -4.569 -2.583 6 HG3 MET 1 2HG MET 1 8.889 -4.290 -0.933 7 HE1 MET 1 3HE MET 1 11.236 -5.398 -1.045 8 HE2 MET 1 1HE MET 1 11.263 -6.956 -0.217 9 HE3 MET 1 2HE MET 1 11.503 -6.881 -1.963 10 H ALA 2 H ALA 2 6.166 -7.485 -2.631 11 HA ALA 2 HA ALA 2 3.469 -7.036 -3.733 12 HB1 ALA 2 1HB ALA 2 4.882 -9.675 -3.367 13 HB2 ALA 2 2HB ALA 2 3.210 -9.474 -3.892 14 HB3 ALA 2 3HB ALA 2 4.529 -8.879 -4.901 15 H ILE 3 H ILE 3 1.789 -7.177 -2.349 16 HA ILE 3 HA ILE 3 2.429 -7.729 0.463 17 HB ILE 3 HB ILE 3 1.443 -5.509 -0.103 18 HG12 ILE 3 1HG1 ILE 3 -0.656 -6.810 1.531 19 HG13 ILE 3 2HG1 ILE 3 1.002 -7.070 2.060 20 HG21 ILE 3 1HG2 ILE 3 -1.270 -6.546 -0.379 21 HG22 ILE 3 2HG2 ILE 3 -0.452 -5.259 -1.262 22 HG23 ILE 3 3HG2 ILE 3 -0.222 -6.940 -1.741 23 HD11 ILE 3 3HD1 ILE 3 -0.253 -4.377 1.587 24 HD12 ILE 3 1HD1 ILE 3 -0.076 -5.156 3.159 25 HD13 ILE 3 2HD1 ILE 3 1.355 -4.694 2.237 26 H SER 4 H SER 4 1.051 -9.021 1.741 27 HA SER 4 HA SER 4 0.215 -11.412 0.618 28 HB2 SER 4 1HB SER 4 -0.537 -10.071 3.216 29 HB3 SER 4 2HB SER 4 -1.098 -11.688 2.791 30 HG SER 4 HG SER 4 0.775 -11.932 3.945 31 H ALA 5 H ALA 5 -1.680 -12.207 -0.159 32 HA ALA 5 HA ALA 5 -3.517 -10.494 -1.368 33 HB1 ALA 5 1HB ALA 5 -4.840 -12.936 -0.968 34 HB2 ALA 5 2HB ALA 5 -3.952 -12.411 -2.398 35 HB3 ALA 5 3HB ALA 5 -3.128 -13.325 -1.135 36 H GLU 6 H GLU 6 -3.484 -11.913 1.824 37 HA GLU 6 HA GLU 6 -6.175 -11.582 2.518 38 HB2 GLU 6 1HB GLU 6 -5.487 -11.825 4.786 39 HB3 GLU 6 2HB GLU 6 -4.427 -12.842 3.821 40 HG2 GLU 6 1HG GLU 6 -2.735 -11.016 3.880 41 HG3 GLU 6 2HG GLU 6 -3.784 -10.155 5.005 42 H GLU 7 H GLU 7 -3.609 -9.287 2.185 43 HA GLU 7 HA GLU 7 -4.761 -7.222 3.780 44 HB2 GLU 7 1HB GLU 7 -2.349 -7.328 3.204 45 HB3 GLU 7 2HB GLU 7 -2.758 -6.987 1.529 46 HG2 GLU 7 1HG GLU 7 -2.252 -4.888 2.188 47 HG3 GLU 7 2HG GLU 7 -3.954 -4.900 2.644 48 H LEU 8 H LEU 8 -5.139 -8.282 0.490 49 HA LEU 8 HA LEU 8 -6.386 -5.896 -0.471 50 HB2 LEU 8 1HB LEU 8 -5.355 -7.279 -2.081 51 HB3 LEU 8 2HB LEU 8 -6.210 -8.710 -1.508 52 HG LEU 8 HG LEU 8 -8.289 -7.875 -2.439 53 HD11 LEU 8 1HD1 LEU 8 -8.403 -5.838 -3.720 54 HD12 LEU 8 2HD1 LEU 8 -6.690 -5.526 -3.443 55 HD13 LEU 8 3HD1 LEU 8 -7.825 -5.473 -2.094 56 HD21 LEU 8 3HD2 LEU 8 -6.033 -8.695 -3.901 57 HD22 LEU 8 1HD2 LEU 8 -6.800 -7.416 -4.842 58 HD23 LEU 8 2HD2 LEU 8 -7.730 -8.835 -4.360 59 H GLU 9 H GLU 9 -7.592 -9.074 0.571 60 HA GLU 9 HA GLU 9 -10.318 -8.557 0.147 61 HB2 GLU 9 1HB GLU 9 -10.697 -10.420 1.763 62 HB3 GLU 9 2HB GLU 9 -9.568 -10.814 0.474 63 HG2 GLU 9 1HG GLU 9 -7.697 -10.384 2.011 64 HG3 GLU 9 2HG GLU 9 -8.856 -10.068 3.301 65 H LYS 10 H LYS 10 -8.213 -7.930 2.898 66 HA LYS 10 HA LYS 10 -10.148 -7.256 4.795 67 HB2 LYS 10 1HB LYS 10 -7.276 -6.495 4.398 68 HB3 LYS 10 2HB LYS 10 -8.217 -5.720 5.666 69 HG2 LYS 10 1HG LYS 10 -7.919 -8.701 5.397 70 HG3 LYS 10 2HG LYS 10 -6.874 -7.691 6.400 71 HD2 LYS 10 1HD LYS 10 -9.033 -6.866 7.498 72 HD3 LYS 10 2HD LYS 10 -9.814 -8.237 6.708 73 HE2 LYS 10 1HE LYS 10 -7.361 -8.591 8.399 74 HE3 LYS 10 2HE LYS 10 -8.970 -8.537 9.117 75 HZ1 LYS 10 3HZ LYS 10 -7.686 -10.673 7.756 76 HZ2 LYS 10 1HZ LYS 10 -9.159 -10.299 7.012 77 HZ3 LYS 10 2HZ LYS 10 -9.117 -10.687 8.657 78 H ILE 11 H ILE 11 -8.942 -5.502 2.056 79 HA ILE 11 HA ILE 11 -9.757 -2.906 2.865 80 HB ILE 11 HB ILE 11 -9.345 -4.006 0.083 81 HG12 ILE 11 1HG1 ILE 11 -7.449 -2.207 1.558 82 HG13 ILE 11 2HG1 ILE 11 -7.419 -3.943 1.846 83 HG21 ILE 11 1HG2 ILE 11 -8.854 -1.231 0.202 84 HG22 ILE 11 2HG2 ILE 11 -10.126 -2.075 -0.679 85 HG23 ILE 11 3HG2 ILE 11 -10.417 -1.514 0.967 86 HD11 ILE 11 3HD1 ILE 11 -6.400 -2.403 -0.391 87 HD12 ILE 11 1HD1 ILE 11 -5.993 -4.032 0.147 88 HD13 ILE 11 2HD1 ILE 11 -7.394 -3.771 -0.893 89 H LEU 12 H LEU 12 -11.275 -5.381 0.818 90 HA LEU 12 HA LEU 12 -13.612 -3.869 0.271 91 HB2 LEU 12 1HB LEU 12 -12.789 -6.712 -0.038 92 HB3 LEU 12 2HB LEU 12 -14.503 -6.319 -0.152 93 HG LEU 12 HG LEU 12 -12.316 -5.184 -1.895 94 HD11 LEU 12 1HD1 LEU 12 -13.644 -6.489 -3.651 95 HD12 LEU 12 2HD1 LEU 12 -14.323 -7.377 -2.287 96 HD13 LEU 12 3HD1 LEU 12 -12.583 -7.400 -2.576 97 HD21 LEU 12 3HD2 LEU 12 -14.336 -4.413 -3.232 98 HD22 LEU 12 1HD2 LEU 12 -13.988 -3.538 -1.741 99 HD23 LEU 12 2HD2 LEU 12 -15.285 -4.733 -1.780 100 H LYS 13 H LYS 13 -12.668 -6.013 2.857 101 HA LYS 13 HA LYS 13 -15.090 -6.719 3.963 102 HB2 LYS 13 1HB LYS 13 -12.450 -6.046 5.250 103 HB3 LYS 13 2HB LYS 13 -13.828 -6.601 6.191 104 HG2 LYS 13 1HG LYS 13 -13.805 -8.538 4.383 105 HG3 LYS 13 2HG LYS 13 -12.103 -8.081 4.292 106 HD2 LYS 13 1HD LYS 13 -12.277 -9.811 5.916 107 HD3 LYS 13 2HD LYS 13 -12.015 -8.302 6.794 108 HE2 LYS 13 1HE LYS 13 -14.295 -8.172 7.427 109 HE3 LYS 13 2HE LYS 13 -14.753 -9.448 6.301 110 HZ1 LYS 13 3HZ LYS 13 -13.921 -11.073 7.662 111 HZ2 LYS 13 1HZ LYS 13 -14.467 -9.963 8.816 112 HZ3 LYS 13 2HZ LYS 13 -12.822 -10.045 8.433 113 H LYS 14 H LYS 14 -13.405 -3.645 4.134 114 HA LYS 14 HA LYS 14 -14.745 -2.384 6.187 115 HB2 LYS 14 1HB LYS 14 -13.557 -1.397 3.619 116 HB3 LYS 14 2HB LYS 14 -14.431 -0.281 4.659 117 HG2 LYS 14 1HG LYS 14 -12.204 -0.036 5.289 118 HG3 LYS 14 2HG LYS 14 -12.890 -1.091 6.527 119 HD2 LYS 14 1HD LYS 14 -11.990 -3.045 5.331 120 HD3 LYS 14 2HD LYS 14 -11.271 -1.966 4.134 121 HE2 LYS 14 1HE LYS 14 -10.223 -0.864 6.301 122 HE3 LYS 14 2HE LYS 14 -10.488 -2.479 6.957 123 HZ1 LYS 14 3HZ LYS 14 -8.936 -1.836 4.507 124 HZ2 LYS 14 1HZ LYS 14 -9.199 -3.390 5.123 125 HZ3 LYS 14 2HZ LYS 14 -8.284 -2.275 6.005 126 H SER 15 H SER 15 -15.852 -3.094 2.947 127 HA SER 15 HA SER 15 -18.402 -1.747 3.539 128 HB2 SER 15 1HB SER 15 -17.710 -0.792 1.545 129 HB3 SER 15 2HB SER 15 -16.916 -2.267 0.993 130 HG SER 15 HG SER 15 -19.277 -1.422 0.300 131 H PHE 16 H PHE 16 -17.187 -4.588 1.753 132 HA PHE 16 HA PHE 16 -19.637 -6.016 2.546 133 HB2 PHE 16 1HB PHE 16 -17.809 -6.771 0.267 134 HB3 PHE 16 2HB PHE 16 -19.446 -7.342 0.576 135 HD1 PHE 16 HD2 PHE 16 -21.071 -5.084 0.941 136 HD2 PHE 16 HD1 PHE 16 -17.700 -5.495 -1.626 137 HE1 PHE 16 HE2 PHE 16 -21.964 -3.309 -0.510 138 HE2 PHE 16 HE1 PHE 16 -18.587 -3.720 -3.080 139 HZ PHE 16 HZ PHE 16 -20.722 -2.625 -2.524 140 HA PRO 17 HA PRO 17 -16.244 -8.026 4.938 141 HB2 PRO 17 1HB PRO 17 -17.766 -8.460 7.143 142 HB3 PRO 17 2HB PRO 17 -16.915 -6.939 6.847 143 HG2 PRO 17 1HG PRO 17 -19.792 -7.621 6.381 144 HG3 PRO 17 2HG PRO 17 -19.090 -6.149 7.076 145 HD2 PRO 17 1HD PRO 17 -19.931 -6.289 4.506 146 HD3 PRO 17 2HD PRO 17 -18.565 -5.273 5.009 147 H SER 18 H SER 18 -19.545 -8.906 4.201 148 HA SER 18 HA SER 18 -19.127 -11.696 4.884 149 HB2 SER 18 1HB SER 18 -21.318 -11.127 5.365 150 HB3 SER 18 2HB SER 18 -21.456 -10.054 3.973 151 HG SER 18 HG SER 18 -21.837 -12.797 4.153 152 H SER 19 H SER 19 -18.852 -9.646 2.149 153 HA SER 19 HA SER 19 -19.339 -11.411 0.045 154 HB2 SER 19 1HB SER 19 -17.720 -8.929 0.379 155 HB3 SER 19 2HB SER 19 -17.438 -9.906 -1.062 156 HG SER 19 HG SER 19 -20.034 -9.128 -0.260 157 H VAL 20 H VAL 20 -17.702 -12.375 -1.420 158 HA VAL 20 HA VAL 20 -15.580 -13.670 0.158 159 HB VAL 20 HB VAL 20 -16.945 -14.634 -2.360 160 HG11 VAL 20 1HG1 VAL 20 -14.660 -15.716 -0.752 161 HG12 VAL 20 2HG1 VAL 20 -15.700 -16.789 -1.690 162 HG13 VAL 20 3HG1 VAL 20 -14.793 -15.509 -2.498 163 HG21 VAL 20 3HG2 VAL 20 -17.624 -16.498 -0.692 164 HG22 VAL 20 1HG2 VAL 20 -17.265 -15.291 0.542 165 HG23 VAL 20 2HG2 VAL 20 -18.502 -14.969 -0.673 166 H ILE 21 H ILE 21 -13.902 -12.241 -0.144 167 HA ILE 21 HA ILE 21 -13.210 -11.274 -2.770 168 HB ILE 21 HB ILE 21 -11.532 -11.102 -0.271 169 HG12 ILE 21 1HG1 ILE 21 -12.695 -8.660 -0.482 170 HG13 ILE 21 2HG1 ILE 21 -14.007 -9.685 -1.053 171 HG21 ILE 21 1HG2 ILE 21 -11.180 -10.236 -2.967 172 HG22 ILE 21 2HG2 ILE 21 -11.310 -8.824 -1.918 173 HG23 ILE 21 3HG2 ILE 21 -10.090 -10.055 -1.592 174 HD11 ILE 21 3HD1 ILE 21 -14.545 -10.022 1.064 175 HD12 ILE 21 1HD1 ILE 21 -13.050 -10.941 1.239 176 HD13 ILE 21 2HD1 ILE 21 -13.077 -9.219 1.623 177 H LYS 22 H LYS 22 -12.006 -12.309 -4.206 178 HA LYS 22 HA LYS 22 -10.007 -14.247 -3.263 179 HB2 LYS 22 1HB LYS 22 -12.317 -15.121 -4.304 180 HB3 LYS 22 2HB LYS 22 -11.430 -14.859 -5.800 181 HG2 LYS 22 1HG LYS 22 -9.942 -16.534 -5.378 182 HG3 LYS 22 2HG LYS 22 -10.091 -16.377 -3.626 183 HD2 LYS 22 1HD LYS 22 -12.449 -17.301 -5.202 184 HD3 LYS 22 2HD LYS 22 -11.131 -18.433 -4.891 185 HE2 LYS 22 1HE LYS 22 -11.374 -17.632 -2.432 186 HE3 LYS 22 2HE LYS 22 -12.964 -17.077 -2.953 187 HZ1 LYS 22 3HZ LYS 22 -13.742 -19.154 -3.035 188 HZ2 LYS 22 1HZ LYS 22 -12.408 -19.562 -2.077 189 HZ3 LYS 22 2HZ LYS 22 -12.341 -19.774 -3.753 190 H ILE 23 H ILE 23 -8.057 -13.832 -4.054 191 HA ILE 23 HA ILE 23 -7.755 -11.889 -6.187 192 HB ILE 23 HB ILE 23 -5.653 -13.317 -4.552 193 HG12 ILE 23 1HG1 ILE 23 -5.493 -10.818 -3.683 194 HG13 ILE 23 2HG1 ILE 23 -7.174 -10.769 -4.201 195 HG21 ILE 23 1HG2 ILE 23 -4.648 -12.638 -6.585 196 HG22 ILE 23 2HG2 ILE 23 -5.476 -11.082 -6.557 197 HG23 ILE 23 3HG2 ILE 23 -4.204 -11.425 -5.385 198 HD11 ILE 23 3HD1 ILE 23 -6.261 -11.599 -1.757 199 HD12 ILE 23 1HD1 ILE 23 -7.851 -11.941 -2.438 200 HD13 ILE 23 2HD1 ILE 23 -6.547 -13.117 -2.608 201 H THR 24 H THR 24 -7.331 -12.349 -8.245 202 HA THR 24 HA THR 24 -6.167 -14.950 -8.932 203 HB THR 24 HB THR 24 -8.630 -13.812 -10.269 204 HG1 THR 24 HG1 THR 24 -9.346 -16.043 -9.450 205 HG21 THR 24 3HG2 THR 24 -8.541 -16.153 -11.366 206 HG22 THR 24 1HG2 THR 24 -6.840 -16.134 -10.903 207 HG23 THR 24 2HG2 THR 24 -7.474 -14.891 -11.982 208 H ASP 25 H ASP 25 -4.781 -14.912 -10.637 209 HA ASP 25 HA ASP 25 -4.002 -12.307 -11.630 210 HB2 ASP 25 1HB ASP 25 -2.847 -15.066 -12.077 211 HB3 ASP 25 2HB ASP 25 -2.157 -13.585 -12.736 212 H LEU 26 H LEU 26 -4.140 -11.585 -13.716 213 HA LEU 26 HA LEU 26 -5.745 -13.237 -15.553 214 HB2 LEU 26 1HB LEU 26 -5.807 -10.349 -14.876 215 HB3 LEU 26 2HB LEU 26 -6.141 -10.801 -16.546 216 HG LEU 26 HG LEU 26 -7.666 -11.774 -14.130 217 HD11 LEU 26 1HD1 LEU 26 -8.336 -9.713 -16.224 218 HD12 LEU 26 2HD1 LEU 26 -8.113 -9.444 -14.496 219 HD13 LEU 26 3HD1 LEU 26 -9.490 -10.383 -15.071 220 HD21 LEU 26 3HD2 LEU 26 -7.714 -13.442 -15.842 221 HD22 LEU 26 1HD2 LEU 26 -8.036 -12.234 -17.085 222 HD23 LEU 26 2HD2 LEU 26 -9.261 -12.593 -15.867 223 H VAL 27 H VAL 27 -2.887 -11.319 -15.135 224 HA VAL 27 HA VAL 27 -2.215 -11.554 -17.979 225 HB VAL 27 HB VAL 27 -0.824 -10.007 -15.787 226 HG11 VAL 27 1HG1 VAL 27 -0.224 -10.413 -18.689 227 HG12 VAL 27 2HG1 VAL 27 0.235 -8.910 -17.885 228 HG13 VAL 27 3HG1 VAL 27 0.868 -10.451 -17.304 229 HG21 VAL 27 3HG2 VAL 27 -1.677 -8.083 -17.338 230 HG22 VAL 27 1HG2 VAL 27 -2.867 -9.285 -17.840 231 HG23 VAL 27 2HG2 VAL 27 -2.757 -8.805 -16.146 232 H GLY 28 H GLY 28 -0.332 -11.786 -14.954 233 HA2 GLY 28 1HA GLY 28 0.531 -14.118 -14.480 234 HA3 GLY 28 2HA GLY 28 1.076 -14.090 -16.151 235 H ASP 29 H ASP 29 2.215 -11.689 -16.472 236 HA ASP 29 HA ASP 29 4.428 -11.760 -14.536 237 HB2 ASP 29 1HB ASP 29 5.127 -12.259 -16.805 238 HB3 ASP 29 2HB ASP 29 4.354 -10.792 -17.400 239 H GLN 30 H GLN 30 2.391 -9.535 -16.403 240 HA GLN 30 HA GLN 30 3.389 -7.147 -15.325 241 HB2 GLN 30 1HB GLN 30 1.752 -7.594 -17.321 242 HB3 GLN 30 2HB GLN 30 0.507 -7.422 -16.091 243 HG2 GLN 30 1HG GLN 30 2.595 -5.322 -16.267 244 HG3 GLN 30 2HG GLN 30 1.354 -5.375 -17.518 245 HE21 GLN 30 2HE2 GLN 30 -0.903 -5.931 -16.345 246 HE22 GLN 30 1HE2 GLN 30 -1.297 -4.806 -15.095 247 H ASP 31 H ASP 31 2.366 -5.694 -13.801 248 HA ASP 31 HA ASP 31 1.580 -7.070 -11.402 249 HB2 ASP 31 1HB ASP 31 2.048 -4.177 -12.095 250 HB3 ASP 31 2HB ASP 31 1.400 -4.657 -10.529 251 H HIS 32 H HIS 32 -0.392 -7.968 -12.487 252 HA HIS 32 HA HIS 32 -2.619 -6.045 -12.463 253 HB2 HIS 32 1HB HIS 32 -2.011 -7.630 -14.498 254 HB3 HIS 32 2HB HIS 32 -2.930 -8.805 -13.561 255 HD1 HIS 32 HD1 HIS 32 -4.733 -8.799 -15.461 256 HD2 HIS 32 HD2 HIS 32 -4.257 -5.170 -13.494 257 HE1 HIS 32 HE1 HIS 32 -6.739 -7.422 -16.096 258 H TYR 33 H TYR 33 -4.738 -6.992 -11.721 259 HA TYR 33 HA TYR 33 -4.638 -9.171 -9.849 260 HB2 TYR 33 1HB TYR 33 -4.532 -6.347 -8.928 261 HB3 TYR 33 2HB TYR 33 -5.604 -7.435 -8.053 262 HD1 TYR 33 HD1 TYR 33 -4.292 -9.899 -7.772 263 HD2 TYR 33 HD2 TYR 33 -2.539 -6.022 -7.827 264 HE1 TYR 33 HE1 TYR 33 -2.379 -10.752 -6.483 265 HE2 TYR 33 HE2 TYR 33 -0.621 -6.865 -6.539 266 HH TYR 33 HH TYR 33 -0.624 -9.701 -4.880 267 H ALA 34 H ALA 34 -6.461 -10.189 -10.326 268 HA ALA 34 HA ALA 34 -8.809 -8.664 -11.162 269 HB1 ALA 34 1HB ALA 34 -7.739 -10.938 -12.166 270 HB2 ALA 34 2HB ALA 34 -8.981 -11.597 -11.101 271 HB3 ALA 34 3HB ALA 34 -9.424 -10.457 -12.371 272 H LEU 35 H LEU 35 -9.822 -7.883 -9.383 273 HA LEU 35 HA LEU 35 -10.187 -9.535 -7.032 274 HB2 LEU 35 1HB LEU 35 -9.734 -7.258 -6.595 275 HB3 LEU 35 2HB LEU 35 -10.961 -6.719 -7.739 276 HG LEU 35 HG LEU 35 -12.701 -7.618 -6.202 277 HD11 LEU 35 1HD1 LEU 35 -10.668 -9.008 -5.050 278 HD12 LEU 35 2HD1 LEU 35 -12.237 -8.711 -4.302 279 HD13 LEU 35 3HD1 LEU 35 -10.866 -7.670 -3.918 280 HD21 LEU 35 3HD2 LEU 35 -11.533 -5.829 -4.332 281 HD22 LEU 35 1HD2 LEU 35 -12.809 -5.516 -5.509 282 HD23 LEU 35 2HD2 LEU 35 -11.119 -5.276 -5.955 283 H GLU 36 H GLU 36 -11.748 -11.003 -6.977 284 HA GLU 36 HA GLU 36 -14.257 -10.450 -8.416 285 HB2 GLU 36 1HB GLU 36 -14.573 -12.980 -8.189 286 HB3 GLU 36 2HB GLU 36 -13.351 -12.419 -9.320 287 HG2 GLU 36 1HG GLU 36 -11.593 -12.961 -7.816 288 HG3 GLU 36 2HG GLU 36 -12.731 -13.275 -6.507 289 H ILE 37 H ILE 37 -15.956 -9.961 -7.211 290 HA ILE 37 HA ILE 37 -15.948 -10.722 -4.373 291 HB ILE 37 HB ILE 37 -16.155 -8.295 -4.947 292 HG12 ILE 37 1HG1 ILE 37 -18.728 -8.673 -3.680 293 HG13 ILE 37 2HG1 ILE 37 -17.555 -9.827 -3.056 294 HG21 ILE 37 1HG2 ILE 37 -17.825 -7.438 -6.210 295 HG22 ILE 37 2HG2 ILE 37 -17.797 -9.052 -6.920 296 HG23 ILE 37 3HG2 ILE 37 -18.993 -8.652 -5.688 297 HD11 ILE 37 3HD1 ILE 37 -16.788 -6.961 -3.266 298 HD12 ILE 37 1HD1 ILE 37 -17.846 -7.480 -1.954 299 HD13 ILE 37 2HD1 ILE 37 -16.244 -8.196 -2.132 300 H SER 38 H SER 38 -17.589 -11.881 -3.473 301 HA SER 38 HA SER 38 -19.811 -12.692 -5.219 302 HB2 SER 38 1HB SER 38 -17.763 -14.384 -4.742 303 HB3 SER 38 2HB SER 38 -18.775 -14.741 -3.342 304 HG SER 38 HG SER 38 -19.118 -15.906 -5.477 305 H ASP 39 H ASP 39 -21.607 -11.983 -4.292 306 HA ASP 39 HA ASP 39 -22.485 -12.833 -1.771 307 HB2 ASP 39 1HB ASP 39 -20.660 -10.905 -1.364 308 HB3 ASP 39 2HB ASP 39 -22.086 -9.896 -1.592 309 H ALA 40 H ALA 40 -24.321 -11.044 -1.022 310 HA ALA 40 HA ALA 40 -25.902 -10.575 -3.467 311 HB1 ALA 40 1HB ALA 40 -27.904 -10.879 -1.966 312 HB2 ALA 40 2HB ALA 40 -26.944 -12.329 -2.262 313 HB3 ALA 40 3HB ALA 40 -26.788 -11.466 -0.733 314 H GLN 41 H GLN 41 -24.052 -8.728 -2.120 315 HA GLN 41 HA GLN 41 -25.820 -6.749 -0.916 316 HB2 GLN 41 1HB GLN 41 -22.878 -7.150 -1.075 317 HB3 GLN 41 2HB GLN 41 -23.459 -5.497 -0.927 318 HG2 GLN 41 1HG GLN 41 -24.184 -5.790 1.196 319 HG3 GLN 41 2HG GLN 41 -24.600 -7.484 0.938 320 HE21 GLN 41 2HE2 GLN 41 -22.357 -8.651 0.157 321 HE22 GLN 41 1HE2 GLN 41 -21.111 -8.496 1.343 322 H PHE 42 H PHE 42 -24.968 -7.608 -3.970 323 HA PHE 42 HA PHE 42 -25.315 -4.856 -4.960 324 HB2 PHE 42 1HB PHE 42 -23.793 -5.217 -6.714 325 HB3 PHE 42 2HB PHE 42 -23.010 -5.944 -5.315 326 HD1 PHE 42 HD2 PHE 42 -23.565 -8.509 -4.976 327 HD2 PHE 42 HD1 PHE 42 -23.851 -6.412 -8.669 328 HE1 PHE 42 HE2 PHE 42 -23.360 -10.636 -6.195 329 HE2 PHE 42 HE1 PHE 42 -23.648 -8.536 -9.894 330 HZ PHE 42 HZ PHE 42 -23.401 -10.652 -8.657 331 H ASN 43 H ASN 43 -27.196 -7.156 -4.407 332 HA ASN 43 HA ASN 43 -28.117 -8.353 -6.730 333 HB2 ASN 43 1HB ASN 43 -29.103 -7.920 -4.048 334 HB3 ASN 43 2HB ASN 43 -30.411 -7.769 -5.217 335 HD21 ASN 43 2HD2 ASN 43 -29.644 -9.839 -3.170 336 HD22 ASN 43 1HD2 ASN 43 -29.674 -11.331 -4.041 337 H GLY 44 H GLY 44 -29.043 -5.220 -5.328 338 HA2 GLY 44 1HA GLY 44 -30.460 -4.598 -7.838 339 HA3 GLY 44 2HA GLY 44 -30.768 -3.826 -6.290 340 H LEU 45 H LEU 45 -27.926 -4.377 -8.378 341 HA LEU 45 HA LEU 45 -27.441 -1.486 -8.355 342 HB2 LEU 45 1HB LEU 45 -25.445 -3.627 -7.652 343 HB3 LEU 45 2HB LEU 45 -24.991 -1.978 -8.077 344 HG LEU 45 HG LEU 45 -26.647 -2.804 -5.693 345 HD11 LEU 45 1HD1 LEU 45 -23.884 -1.616 -5.745 346 HD12 LEU 45 2HD1 LEU 45 -24.193 -3.349 -5.642 347 HD13 LEU 45 3HD1 LEU 45 -24.759 -2.275 -4.363 348 HD21 LEU 45 3HD2 LEU 45 -25.652 -0.162 -5.499 349 HD22 LEU 45 1HD2 LEU 45 -27.330 -0.699 -5.573 350 HD23 LEU 45 2HD2 LEU 45 -26.461 -0.315 -7.059 351 H SER 46 H SER 46 -25.726 -0.881 -9.984 352 HA SER 46 HA SER 46 -26.105 -2.517 -12.398 353 HB2 SER 46 1HB SER 46 -26.949 -0.147 -12.418 354 HB3 SER 46 2HB SER 46 -25.277 0.389 -12.258 355 HG SER 46 HG SER 46 -25.496 0.348 -14.388 356 H LEU 47 H LEU 47 -24.270 -2.349 -14.006 357 HA LEU 47 HA LEU 47 -21.955 -3.465 -12.962 358 HB2 LEU 47 1HB LEU 47 -22.626 -2.164 -15.565 359 HB3 LEU 47 2HB LEU 47 -20.961 -2.634 -15.230 360 HG LEU 47 HG LEU 47 -22.086 -4.330 -16.552 361 HD11 LEU 47 1HD1 LEU 47 -20.394 -4.964 -14.834 362 HD12 LEU 47 2HD1 LEU 47 -21.540 -6.243 -15.232 363 HD13 LEU 47 3HD1 LEU 47 -21.724 -5.330 -13.734 364 HD21 LEU 47 3HD2 LEU 47 -23.985 -5.568 -15.701 365 HD22 LEU 47 1HD2 LEU 47 -24.380 -3.852 -15.799 366 HD23 LEU 47 2HD2 LEU 47 -24.005 -4.582 -14.238 367 H ILE 48 H ILE 48 -22.857 -0.138 -13.301 368 HA ILE 48 HA ILE 48 -20.160 0.849 -12.916 369 HB ILE 48 HB ILE 48 -22.751 2.399 -12.874 370 HG12 ILE 48 1HG1 ILE 48 -22.461 1.226 -15.011 371 HG13 ILE 48 2HG1 ILE 48 -22.250 2.962 -15.212 372 HG21 ILE 48 1HG2 ILE 48 -19.873 3.245 -13.149 373 HG22 ILE 48 2HG2 ILE 48 -21.250 4.306 -13.443 374 HG23 ILE 48 3HG2 ILE 48 -20.983 3.633 -11.835 375 HD11 ILE 48 3HD1 ILE 48 -20.452 0.828 -15.834 376 HD12 ILE 48 1HD1 ILE 48 -20.328 2.545 -16.216 377 HD13 ILE 48 2HD1 ILE 48 -19.702 1.936 -14.684 378 H ASN 49 H ASN 49 -23.156 0.579 -11.057 379 HA ASN 49 HA ASN 49 -22.243 1.953 -8.763 380 HB2 ASN 49 1HB ASN 49 -24.318 -0.242 -8.806 381 HB3 ASN 49 2HB ASN 49 -24.182 1.086 -7.657 382 HD21 ASN 49 2HD2 ASN 49 -26.523 0.538 -9.006 383 HD22 ASN 49 1HD2 ASN 49 -26.859 1.826 -10.108 384 H GLN 50 H GLN 50 -21.921 -1.350 -9.853 385 HA GLN 50 HA GLN 50 -21.009 -2.374 -7.335 386 HB2 GLN 50 1HB GLN 50 -20.857 -3.514 -10.129 387 HB3 GLN 50 2HB GLN 50 -20.386 -4.384 -8.675 388 HG2 GLN 50 1HG GLN 50 -22.487 -4.918 -8.191 389 HG3 GLN 50 2HG GLN 50 -23.058 -3.275 -8.479 390 HE21 GLN 50 2HE2 GLN 50 -24.929 -4.346 -9.386 391 HE22 GLN 50 1HE2 GLN 50 -24.885 -4.884 -11.027 392 H HIS 51 H HIS 51 -19.506 -1.120 -10.253 393 HA HIS 51 HA HIS 51 -16.840 -1.822 -9.415 394 HB2 HIS 51 1HB HIS 51 -17.820 -1.464 -11.842 395 HB3 HIS 51 2HB HIS 51 -17.363 0.210 -11.544 396 HD1 HIS 51 HD1 HIS 51 -16.005 -3.022 -12.567 397 HD2 HIS 51 HD2 HIS 51 -14.518 0.542 -11.035 398 HE1 HIS 51 HE1 HIS 51 -13.530 -3.082 -13.007 399 H LYS 52 H LYS 52 -18.948 0.947 -9.207 400 HA LYS 52 HA LYS 52 -16.863 2.767 -8.404 401 HB2 LYS 52 1HB LYS 52 -18.482 4.419 -8.410 402 HB3 LYS 52 2HB LYS 52 -19.135 3.286 -9.586 403 HG2 LYS 52 1HG LYS 52 -20.546 2.321 -7.779 404 HG3 LYS 52 2HG LYS 52 -19.973 3.607 -6.714 405 HD2 LYS 52 1HD LYS 52 -21.508 3.950 -9.290 406 HD3 LYS 52 2HD LYS 52 -22.123 4.210 -7.656 407 HE2 LYS 52 1HE LYS 52 -19.995 5.788 -9.092 408 HE3 LYS 52 2HE LYS 52 -21.595 6.343 -8.604 409 HZ1 LYS 52 3HZ LYS 52 -19.204 5.897 -6.964 410 HZ2 LYS 52 1HZ LYS 52 -20.725 5.692 -6.251 411 HZ3 LYS 52 2HZ LYS 52 -20.305 7.181 -6.934 412 H LEU 53 H LEU 53 -19.175 0.669 -6.849 413 HA LEU 53 HA LEU 53 -19.118 1.784 -4.269 414 HB2 LEU 53 1HB LEU 53 -19.992 -0.715 -5.509 415 HB3 LEU 53 2HB LEU 53 -19.470 -0.899 -3.836 416 HG LEU 53 HG LEU 53 -21.648 0.938 -4.831 417 HD11 LEU 53 1HD1 LEU 53 -23.180 -0.594 -4.158 418 HD12 LEU 53 2HD1 LEU 53 -22.132 -1.262 -2.908 419 HD13 LEU 53 3HD1 LEU 53 -21.879 -1.700 -4.597 420 HD21 LEU 53 3HD2 LEU 53 -20.622 1.992 -2.970 421 HD22 LEU 53 1HD2 LEU 53 -20.501 0.470 -2.088 422 HD23 LEU 53 2HD2 LEU 53 -22.080 1.205 -2.364 423 H VAL 54 H VAL 54 -17.289 -0.971 -5.605 424 HA VAL 54 HA VAL 54 -15.734 -1.576 -3.410 425 HB VAL 54 HB VAL 54 -14.011 -2.385 -5.043 426 HG11 VAL 54 1HG1 VAL 54 -16.378 -3.521 -6.247 427 HG12 VAL 54 2HG1 VAL 54 -15.205 -4.260 -5.156 428 HG13 VAL 54 3HG1 VAL 54 -16.566 -3.348 -4.503 429 HG21 VAL 54 3HG2 VAL 54 -14.306 -0.710 -6.774 430 HG22 VAL 54 1HG2 VAL 54 -14.593 -2.320 -7.436 431 HG23 VAL 54 2HG2 VAL 54 -15.955 -1.264 -7.061 432 H LYS 55 H LYS 55 -15.305 0.988 -5.778 433 HA LYS 55 HA LYS 55 -12.713 1.766 -4.851 434 HB2 LYS 55 1HB LYS 55 -14.755 3.087 -6.632 435 HB3 LYS 55 2HB LYS 55 -13.236 3.866 -6.207 436 HG2 LYS 55 1HG LYS 55 -13.435 1.180 -7.549 437 HG3 LYS 55 2HG LYS 55 -13.219 2.708 -8.405 438 HD2 LYS 55 1HD LYS 55 -11.024 2.371 -8.164 439 HD3 LYS 55 2HD LYS 55 -11.258 2.774 -6.461 440 HE2 LYS 55 1HE LYS 55 -10.466 0.742 -6.001 441 HE3 LYS 55 2HE LYS 55 -11.992 0.112 -6.618 442 HZ1 LYS 55 3HZ LYS 55 -10.779 0.280 -8.887 443 HZ2 LYS 55 1HZ LYS 55 -10.466 -1.032 -7.866 444 HZ3 LYS 55 2HZ LYS 55 -9.374 0.258 -7.945 445 H ASN 56 H ASN 56 -16.016 2.707 -4.136 446 HA ASN 56 HA ASN 56 -15.424 5.060 -2.687 447 HB2 ASN 56 1HB ASN 56 -17.796 3.196 -2.441 448 HB3 ASN 56 2HB ASN 56 -17.707 4.825 -1.776 449 HD21 ASN 56 2HD2 ASN 56 -19.509 3.613 -3.775 450 HD22 ASN 56 1HD2 ASN 56 -19.395 4.628 -5.168 451 H ALA 57 H ALA 57 -15.929 1.698 -1.673 452 HA ALA 57 HA ALA 57 -15.731 2.089 1.088 453 HB1 ALA 57 1HB ALA 57 -15.788 -0.170 1.260 454 HB2 ALA 57 2HB ALA 57 -16.282 -0.037 -0.429 455 HB3 ALA 57 3HB ALA 57 -14.606 -0.411 -0.027 456 H LEU 58 H LEU 58 -13.334 2.253 -1.352 457 HA LEU 58 HA LEU 58 -11.205 2.169 0.681 458 HB2 LEU 58 1HB LEU 58 -9.665 1.747 -1.222 459 HB3 LEU 58 2HB LEU 58 -10.841 0.464 -0.941 460 HG LEU 58 HG LEU 58 -12.191 1.671 -2.820 461 HD11 LEU 58 1HD1 LEU 58 -10.596 2.627 -4.518 462 HD12 LEU 58 2HD1 LEU 58 -9.401 2.719 -3.224 463 HD13 LEU 58 3HD1 LEU 58 -10.904 3.635 -3.104 464 HD21 LEU 58 3HD2 LEU 58 -11.540 -0.015 -4.169 465 HD22 LEU 58 1HD2 LEU 58 -10.682 -0.558 -2.727 466 HD23 LEU 58 2HD2 LEU 58 -9.824 0.347 -3.975 467 H SER 59 H SER 59 -13.076 4.314 -0.793 468 HA SER 59 HA SER 59 -11.015 6.198 -1.612 469 HB2 SER 59 1HB SER 59 -12.836 7.604 -2.365 470 HB3 SER 59 2HB SER 59 -13.138 5.955 -2.912 471 HG SER 59 HG SER 59 -14.649 7.514 -1.330 472 H GLU 60 H GLU 60 -13.390 5.756 0.951 473 HA GLU 60 HA GLU 60 -12.542 8.234 2.242 474 HB2 GLU 60 1HB GLU 60 -14.581 6.315 3.336 475 HB3 GLU 60 2HB GLU 60 -14.434 8.043 3.625 476 HG2 GLU 60 1HG GLU 60 -15.238 6.780 1.014 477 HG3 GLU 60 2HG GLU 60 -16.342 7.485 2.194 478 H ILE 61 H ILE 61 -12.406 4.753 2.665 479 HA ILE 61 HA ILE 61 -11.278 4.866 5.298 480 HB ILE 61 HB ILE 61 -11.153 2.532 3.393 481 HG12 ILE 61 1HG1 ILE 61 -13.468 3.262 3.519 482 HG13 ILE 61 2HG1 ILE 61 -13.270 1.779 4.446 483 HG21 ILE 61 1HG2 ILE 61 -10.087 1.568 5.086 484 HG22 ILE 61 2HG2 ILE 61 -10.345 2.976 6.114 485 HG23 ILE 61 3HG2 ILE 61 -11.566 1.707 6.034 486 HD11 ILE 61 3HD1 ILE 61 -12.836 3.845 6.265 487 HD12 ILE 61 1HD1 ILE 61 -14.216 4.353 5.291 488 HD13 ILE 61 2HD1 ILE 61 -14.255 2.806 6.137 489 H LEU 62 H LEU 62 -10.050 5.031 2.078 490 HA LEU 62 HA LEU 62 -7.953 5.183 1.207 491 HB2 LEU 62 1HB LEU 62 -7.628 6.303 3.961 492 HB3 LEU 62 2HB LEU 62 -6.231 6.141 2.900 493 HG LEU 62 HG LEU 62 -7.086 8.398 2.810 494 HD11 LEU 62 1HD1 LEU 62 -7.223 8.654 0.468 495 HD12 LEU 62 2HD1 LEU 62 -7.891 7.037 0.254 496 HD13 LEU 62 3HD1 LEU 62 -6.210 7.237 0.745 497 HD21 LEU 62 3HD2 LEU 62 -9.686 7.171 1.896 498 HD22 LEU 62 1HD2 LEU 62 -9.326 8.895 2.000 499 HD23 LEU 62 2HD2 LEU 62 -9.397 7.919 3.468 500 H ASN 63 H ASN 63 -8.482 2.639 1.695 501 HA ASN 63 HA ASN 63 -6.154 1.560 3.135 502 HB2 ASN 63 1HB ASN 63 -7.529 -0.637 2.883 503 HB3 ASN 63 2HB ASN 63 -8.023 0.547 4.090 504 HD21 ASN 63 2HD2 ASN 63 -10.133 -0.223 4.082 505 HD22 ASN 63 1HD2 ASN 63 -11.222 0.101 2.780 506 H LYS 64 H LYS 64 -6.250 2.660 0.364 507 HA LYS 64 HA LYS 64 -4.843 0.465 -0.902 508 HB2 LYS 64 1HB LYS 64 -7.331 0.330 -1.528 509 HB3 LYS 64 2HB LYS 64 -7.052 1.800 -2.452 510 HG2 LYS 64 1HG LYS 64 -6.757 0.209 -4.066 511 HG3 LYS 64 2HG LYS 64 -5.098 0.414 -3.500 512 HD2 LYS 64 1HD LYS 64 -6.820 -1.630 -2.182 513 HD3 LYS 64 2HD LYS 64 -6.158 -1.981 -3.780 514 HE2 LYS 64 1HE LYS 64 -3.920 -1.160 -2.684 515 HE3 LYS 64 2HE LYS 64 -4.749 -1.568 -1.183 516 HZ1 LYS 64 3HZ LYS 64 -5.000 -3.805 -1.893 517 HZ2 LYS 64 1HZ LYS 64 -3.380 -3.389 -2.149 518 HZ3 LYS 64 2HZ LYS 64 -4.454 -3.453 -3.454 519 H LYS 65 H LYS 65 -3.474 1.127 -2.608 520 HA LYS 65 HA LYS 65 -2.554 3.833 -2.361 521 HB2 LYS 65 1HB LYS 65 -1.682 1.607 -4.212 522 HB3 LYS 65 2HB LYS 65 -0.852 3.147 -4.030 523 HG2 LYS 65 1HG LYS 65 -1.307 1.265 -1.733 524 HG3 LYS 65 2HG LYS 65 0.121 1.193 -2.769 525 HD2 LYS 65 1HD LYS 65 0.481 3.637 -2.214 526 HD3 LYS 65 2HD LYS 65 -0.762 3.445 -0.976 527 HE2 LYS 65 1HE LYS 65 1.586 1.588 -1.096 528 HE3 LYS 65 2HE LYS 65 1.725 3.165 -0.320 529 HZ1 LYS 65 3HZ LYS 65 -0.457 2.332 0.861 530 HZ2 LYS 65 1HZ LYS 65 1.076 1.917 1.445 531 HZ3 LYS 65 2HZ LYS 65 0.200 0.813 0.510 532 H LEU 66 H LEU 66 -1.785 4.697 -4.756 533 HA LEU 66 HA LEU 66 -4.204 5.639 -5.922 534 HB2 LEU 66 1HB LEU 66 -1.564 6.459 -5.868 535 HB3 LEU 66 2HB LEU 66 -1.825 6.007 -7.551 536 HG LEU 66 HG LEU 66 -2.194 8.386 -7.219 537 HD11 LEU 66 1HD1 LEU 66 -4.974 7.502 -7.583 538 HD12 LEU 66 2HD1 LEU 66 -3.784 6.704 -8.610 539 HD13 LEU 66 3HD1 LEU 66 -3.935 8.460 -8.638 540 HD21 LEU 66 3HD2 LEU 66 -3.407 7.545 -4.815 541 HD22 LEU 66 1HD2 LEU 66 -4.658 8.331 -5.778 542 HD23 LEU 66 2HD2 LEU 66 -3.168 9.194 -5.397 543 H HIS 67 H HIS 67 -2.064 3.007 -6.589 544 HA HIS 67 HA HIS 67 -2.468 2.533 -9.278 545 HB2 HIS 67 1HB HIS 67 -1.851 0.266 -8.868 546 HB3 HIS 67 2HB HIS 67 -0.964 1.247 -7.705 547 HD1 HIS 67 HD1 HIS 67 -1.621 -1.800 -7.308 548 HD2 HIS 67 HD2 HIS 67 -3.753 1.366 -5.669 549 HE1 HIS 67 HE1 HIS 67 -2.781 -2.746 -5.288 550 H SER 68 H SER 68 -3.840 0.879 -10.317 551 HA SER 68 HA SER 68 -6.488 0.651 -9.053 552 HB2 SER 68 1HB SER 68 -7.587 1.184 -11.128 553 HB3 SER 68 2HB SER 68 -6.425 2.467 -10.792 554 HG SER 68 HG SER 68 -6.382 1.689 -12.984 555 H ILE 69 H ILE 69 -7.782 -1.127 -9.798 556 HA ILE 69 HA ILE 69 -6.403 -3.184 -11.347 557 HB ILE 69 HB ILE 69 -6.959 -4.932 -9.700 558 HG12 ILE 69 1HG1 ILE 69 -8.745 -3.321 -8.628 559 HG13 ILE 69 2HG1 ILE 69 -7.919 -4.521 -7.639 560 HG21 ILE 69 1HG2 ILE 69 -4.722 -4.152 -9.671 561 HG22 ILE 69 2HG2 ILE 69 -5.171 -2.689 -8.795 562 HG23 ILE 69 3HG2 ILE 69 -5.238 -4.255 -7.988 563 HD11 ILE 69 3HD1 ILE 69 -6.722 -2.959 -6.504 564 HD12 ILE 69 1HD1 ILE 69 -6.710 -1.823 -7.852 565 HD13 ILE 69 2HD1 ILE 69 -8.165 -2.016 -6.874 566 H SER 70 H SER 70 -7.914 -5.104 -11.712 567 HA SER 70 HA SER 70 -10.408 -4.063 -12.707 568 HB2 SER 70 1HB SER 70 -8.934 -6.656 -12.934 569 HB3 SER 70 2HB SER 70 -10.656 -6.624 -13.311 570 HG SER 70 HG SER 70 -8.622 -5.039 -14.498 571 H ILE 71 H ILE 71 -12.480 -4.689 -12.107 572 HA ILE 71 HA ILE 71 -12.707 -6.205 -9.595 573 HB ILE 71 HB ILE 71 -14.271 -3.712 -10.272 574 HG12 ILE 71 1HG1 ILE 71 -12.697 -3.675 -7.826 575 HG13 ILE 71 2HG1 ILE 71 -11.688 -3.921 -9.247 576 HG21 ILE 71 1HG2 ILE 71 -14.719 -5.868 -8.401 577 HG22 ILE 71 2HG2 ILE 71 -14.572 -4.316 -7.578 578 HG23 ILE 71 3HG2 ILE 71 -15.774 -4.530 -8.850 579 HD11 ILE 71 3HD1 ILE 71 -13.711 -1.779 -9.413 580 HD12 ILE 71 1HD1 ILE 71 -12.347 -1.513 -8.328 581 HD13 ILE 71 2HD1 ILE 71 -12.063 -1.841 -10.037 582 H LYS 72 H LYS 72 -14.049 -7.869 -9.745 583 HA LYS 72 HA LYS 72 -15.980 -7.921 -11.962 584 HB2 LYS 72 1HB LYS 72 -14.230 -9.716 -11.856 585 HB3 LYS 72 2HB LYS 72 -14.947 -10.255 -10.344 586 HG2 LYS 72 1HG LYS 72 -17.054 -10.703 -11.513 587 HG3 LYS 72 2HG LYS 72 -16.309 -10.191 -13.030 588 HD2 LYS 72 1HD LYS 72 -14.771 -12.010 -12.977 589 HD3 LYS 72 2HD LYS 72 -15.229 -12.429 -11.325 590 HE2 LYS 72 1HE LYS 72 -17.606 -12.716 -12.367 591 HE3 LYS 72 2HE LYS 72 -16.714 -12.869 -13.880 592 HZ1 LYS 72 3HZ LYS 72 -15.680 -14.794 -13.172 593 HZ2 LYS 72 1HZ LYS 72 -17.234 -14.973 -12.528 594 HZ3 LYS 72 2HZ LYS 72 -15.958 -14.483 -11.532 595 H THR 73 H THR 73 -18.106 -8.672 -11.605 596 HA THR 73 HA THR 73 -18.986 -8.490 -8.797 597 HB THR 73 HB THR 73 -21.020 -7.472 -9.475 598 HG1 THR 73 HG1 THR 73 -20.222 -8.284 -12.064 599 HG21 THR 73 3HG2 THR 73 -20.255 -5.462 -10.726 600 HG22 THR 73 1HG2 THR 73 -18.724 -6.280 -11.032 601 HG23 THR 73 2HG2 THR 73 -19.201 -5.892 -9.379 602 H ILE 74 H ILE 74 -19.642 -10.378 -8.024 603 HA ILE 74 HA ILE 74 -21.204 -12.153 -9.769 604 HB ILE 74 HB ILE 74 -19.054 -13.092 -7.867 605 HG12 ILE 74 1HG1 ILE 74 -18.544 -13.961 -10.497 606 HG13 ILE 74 2HG1 ILE 74 -18.946 -12.252 -10.625 607 HG21 ILE 74 1HG2 ILE 74 -20.899 -14.649 -7.977 608 HG22 ILE 74 2HG2 ILE 74 -20.864 -14.611 -9.739 609 HG23 ILE 74 3HG2 ILE 74 -19.514 -15.311 -8.845 610 HD11 ILE 74 3HD1 ILE 74 -17.107 -12.824 -8.449 611 HD12 ILE 74 1HD1 ILE 74 -16.483 -13.291 -10.031 612 HD13 ILE 74 2HD1 ILE 74 -17.003 -11.630 -9.743 613 H SER 75 H SER 75 -22.831 -13.316 -8.773 614 HA SER 75 HA SER 75 -23.338 -12.629 -5.951 615 HB2 SER 75 1HB SER 75 -24.895 -11.911 -8.096 616 HB3 SER 75 2HB SER 75 -25.681 -13.393 -7.552 617 HG SER 75 HG SER 75 -26.443 -12.317 -5.929 618 H ILE 76 H ILE 76 -24.447 -14.210 -4.675 619 HA ILE 76 HA ILE 76 -23.461 -16.822 -4.991 620 HB ILE 76 HB ILE 76 -24.955 -17.439 -3.134 621 HG12 ILE 76 1HG1 ILE 76 -26.144 -15.253 -2.157 622 HG13 ILE 76 2HG1 ILE 76 -26.205 -14.837 -3.866 623 HG21 ILE 76 1HG2 ILE 76 -23.703 -16.369 -1.565 624 HG22 ILE 76 2HG2 ILE 76 -22.766 -15.947 -2.997 625 HG23 ILE 76 3HG2 ILE 76 -23.908 -14.787 -2.318 626 HD11 ILE 76 3HD1 ILE 76 -27.887 -16.584 -2.384 627 HD12 ILE 76 1HD1 ILE 76 -28.011 -16.088 -4.072 628 HD13 ILE 76 2HD1 ILE 76 -27.062 -17.510 -3.637 629 HA PRO 77 HA PRO 77 -26.359 -18.823 -7.615 630 HB2 PRO 77 1HB PRO 77 -26.334 -21.334 -6.585 631 HB3 PRO 77 2HB PRO 77 -24.988 -20.664 -7.515 632 HG2 PRO 77 1HG PRO 77 -25.307 -20.903 -4.548 633 HG3 PRO 77 2HG PRO 77 -23.881 -21.230 -5.550 634 HD2 PRO 77 1HD PRO 77 -24.179 -18.934 -4.146 635 HD3 PRO 77 2HD PRO 77 -23.316 -19.000 -5.696
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