NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
26350 | 2kig | 16273 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 1H GLY 1 -15.085 17.150 -12.325 2 H2 GLY 1 2H GLY 1 -13.452 16.891 -11.935 3 H3 GLY 1 3H GLY 1 -14.676 16.236 -10.957 4 HA2 GLY 1 1HA GLY 1 -14.684 14.388 -12.148 5 HA3 GLY 1 2HA GLY 1 -15.101 15.340 -13.574 6 HA PRO 2 HA PRO 2 -10.188 15.321 -13.186 7 HB2 PRO 2 1HB PRO 2 -10.003 12.752 -11.649 8 HB3 PRO 2 2HB PRO 2 -8.979 14.199 -11.550 9 HG2 PRO 2 1HG PRO 2 -10.774 13.672 -9.664 10 HG3 PRO 2 2HG PRO 2 -10.492 15.336 -10.213 11 HD2 PRO 2 1HD PRO 2 -12.781 13.502 -10.855 12 HD3 PRO 2 2HD PRO 2 -12.784 15.264 -10.606 13 H LEU 3 H LEU 3 -12.051 12.298 -13.276 14 HA LEU 3 HA LEU 3 -12.164 10.596 -14.800 15 HB2 LEU 3 1HB LEU 3 -12.759 12.502 -16.299 16 HB3 LEU 3 2HB LEU 3 -11.057 12.654 -16.725 17 HG LEU 3 HG LEU 3 -11.081 10.302 -17.552 18 HD11 LEU 3 1HD1 LEU 3 -13.596 9.507 -17.995 19 HD12 LEU 3 2HD1 LEU 3 -13.906 10.462 -16.545 20 HD13 LEU 3 3HD1 LEU 3 -12.767 9.116 -16.490 21 HD21 LEU 3 3HD2 LEU 3 -12.240 10.796 -19.611 22 HD22 LEU 3 1HD2 LEU 3 -11.554 12.307 -19.014 23 HD23 LEU 3 2HD2 LEU 3 -13.274 11.976 -18.807 24 H GLY 4 H GLY 4 -10.903 8.865 -15.062 25 HA2 GLY 4 1HA GLY 4 -8.977 7.733 -15.909 26 HA3 GLY 4 2HA GLY 4 -8.039 9.209 -15.702 27 H SER 5 H SER 5 -9.417 9.533 -12.981 28 HA SER 5 HA SER 5 -8.298 7.325 -11.436 29 HB2 SER 5 1HB SER 5 -7.260 10.153 -11.128 30 HB3 SER 5 2HB SER 5 -6.848 8.786 -10.096 31 HG SER 5 HG SER 5 -6.417 8.935 -12.902 32 H MET 6 H MET 6 -9.188 7.154 -9.397 33 HA MET 6 HA MET 6 -11.669 8.538 -8.963 34 HB2 MET 6 1HB MET 6 -10.106 6.563 -7.289 35 HB3 MET 6 2HB MET 6 -11.680 7.207 -6.822 36 HG2 MET 6 1HG MET 6 -12.700 6.297 -8.839 37 HG3 MET 6 2HG MET 6 -11.129 5.758 -9.426 38 HE1 MET 6 3HE MET 6 -12.661 5.457 -5.624 39 HE2 MET 6 1HE MET 6 -13.699 4.090 -6.052 40 HE3 MET 6 2HE MET 6 -13.845 5.616 -6.920 41 H ASP 7 H ASP 7 -10.380 8.129 -5.948 42 HA ASP 7 HA ASP 7 -9.144 10.778 -5.718 43 HB2 ASP 7 1HB ASP 7 -10.646 11.338 -3.804 44 HB3 ASP 7 2HB ASP 7 -11.463 11.320 -5.366 45 H GLN 8 H GLN 8 -8.834 7.713 -5.244 46 HA GLN 8 HA GLN 8 -8.441 7.030 -2.612 47 HB2 GLN 8 1HB GLN 8 -6.471 6.461 -4.833 48 HB3 GLN 8 2HB GLN 8 -6.664 5.529 -3.342 49 HG2 GLN 8 1HG GLN 8 -8.665 5.819 -5.599 50 HG3 GLN 8 2HG GLN 8 -7.801 4.358 -5.120 51 HE21 GLN 8 2HE2 GLN 8 -8.606 3.159 -3.349 52 HE22 GLN 8 1HE2 GLN 8 -10.039 3.558 -2.541 53 H SER 9 H SER 9 -5.978 8.575 -4.658 54 HA SER 9 HA SER 9 -4.030 8.989 -2.735 55 HB2 SER 9 1HB SER 9 -4.730 10.861 -5.007 56 HB3 SER 9 2HB SER 9 -3.205 10.837 -4.126 57 HG SER 9 HG SER 9 -4.038 9.287 -6.168 58 H VAL 10 H VAL 10 -6.755 11.144 -3.556 59 HA VAL 10 HA VAL 10 -6.090 13.188 -1.719 60 HB VAL 10 HB VAL 10 -8.775 12.342 -2.831 61 HG11 VAL 10 1HG1 VAL 10 -9.229 13.683 -0.917 62 HG12 VAL 10 2HG1 VAL 10 -9.328 14.783 -2.292 63 HG13 VAL 10 3HG1 VAL 10 -7.889 14.774 -1.272 64 HG21 VAL 10 3HG2 VAL 10 -7.169 12.978 -4.563 65 HG22 VAL 10 1HG2 VAL 10 -6.771 14.454 -3.684 66 HG23 VAL 10 2HG2 VAL 10 -8.377 14.250 -4.384 67 H ALA 11 H ALA 11 -8.310 10.440 -1.474 68 HA ALA 11 HA ALA 11 -9.390 10.791 1.002 69 HB1 ALA 11 3HB ALA 11 -8.543 8.292 -0.440 70 HB2 ALA 11 1HB ALA 11 -10.166 8.907 -0.154 71 HB3 ALA 11 2HB ALA 11 -9.248 8.192 1.169 72 H ILE 12 H ILE 12 -6.236 9.232 0.336 73 HA ILE 12 HA ILE 12 -5.627 8.764 3.052 74 HB ILE 12 HB ILE 12 -3.700 9.181 0.762 75 HG12 ILE 12 1HG1 ILE 12 -5.332 7.481 0.157 76 HG13 ILE 12 2HG1 ILE 12 -3.814 6.688 0.560 77 HG21 ILE 12 1HG2 ILE 12 -2.375 7.492 2.211 78 HG22 ILE 12 2HG2 ILE 12 -3.470 7.961 3.513 79 HG23 ILE 12 3HG2 ILE 12 -2.434 9.169 2.752 80 HD11 ILE 12 3HD1 ILE 12 -5.353 5.381 1.726 81 HD12 ILE 12 1HD1 ILE 12 -6.386 6.756 2.108 82 HD13 ILE 12 2HD1 ILE 12 -4.867 6.525 2.973 83 H GLN 13 H GLN 13 -4.619 11.316 0.846 84 HA GLN 13 HA GLN 13 -2.981 12.812 2.430 85 HB2 GLN 13 1HB GLN 13 -3.772 13.292 0.018 86 HB3 GLN 13 2HB GLN 13 -5.095 14.182 0.772 87 HG2 GLN 13 1HG GLN 13 -3.444 15.825 0.452 88 HG3 GLN 13 2HG GLN 13 -3.248 15.369 2.141 89 HE21 GLN 13 2HE2 GLN 13 -1.082 14.982 2.706 90 HE22 GLN 13 1HE2 GLN 13 0.111 14.440 1.629 91 H GLU 14 H GLU 14 -6.565 13.018 2.373 92 HA GLU 14 HA GLU 14 -6.780 15.016 4.349 93 HB2 GLU 14 1HB GLU 14 -8.703 12.812 3.557 94 HB3 GLU 14 2HB GLU 14 -9.121 14.201 4.559 95 HG2 GLU 14 1HG GLU 14 -8.014 14.399 1.745 96 HG3 GLU 14 2HG GLU 14 -9.726 14.506 2.147 97 H THR 15 H THR 15 -6.920 11.482 4.548 98 HA THR 15 HA THR 15 -7.318 11.387 7.376 99 HB THR 15 HB THR 15 -6.858 8.994 7.175 100 HG1 THR 15 HG1 THR 15 -5.597 8.343 5.658 101 HG21 THR 15 3HG2 THR 15 -8.592 10.309 5.092 102 HG22 THR 15 1HG2 THR 15 -9.074 9.454 6.559 103 HG23 THR 15 2HG2 THR 15 -8.462 8.553 5.170 104 H LEU 16 H LEU 16 -4.468 11.415 5.322 105 HA LEU 16 HA LEU 16 -2.570 10.465 7.139 106 HB2 LEU 16 1HB LEU 16 -2.250 10.979 4.662 107 HB3 LEU 16 2HB LEU 16 -2.060 12.662 5.124 108 HG LEU 16 HG LEU 16 -0.204 11.894 6.708 109 HD11 LEU 16 1HD1 LEU 16 -0.488 9.573 6.969 110 HD12 LEU 16 2HD1 LEU 16 0.857 9.678 5.842 111 HD13 LEU 16 3HD1 LEU 16 -0.761 9.322 5.247 112 HD21 LEU 16 3HD2 LEU 16 1.404 11.500 4.730 113 HD22 LEU 16 1HD2 LEU 16 0.476 13.001 4.726 114 HD23 LEU 16 2HD2 LEU 16 -0.020 11.648 3.706 115 H VAL 17 H VAL 17 -1.343 13.457 6.516 116 HA VAL 17 HA VAL 17 -2.465 15.079 8.527 117 HB VAL 17 HB VAL 17 -1.568 13.552 10.148 118 HG11 VAL 17 1HG1 VAL 17 0.003 12.236 9.002 119 HG12 VAL 17 2HG1 VAL 17 1.014 13.186 10.088 120 HG13 VAL 17 3HG1 VAL 17 0.879 13.639 8.389 121 HG21 VAL 17 3HG2 VAL 17 -0.139 15.021 11.389 122 HG22 VAL 17 1HG2 VAL 17 -1.187 16.066 10.429 123 HG23 VAL 17 2HG2 VAL 17 0.476 15.777 9.919 124 H GLU 18 H GLU 18 -1.400 17.113 8.660 125 HA GLU 18 HA GLU 18 -0.279 18.028 6.295 126 HB2 GLU 18 1HB GLU 18 -0.108 19.145 9.095 127 HB3 GLU 18 2HB GLU 18 0.418 20.018 7.655 128 HG2 GLU 18 1HG GLU 18 -1.822 19.878 6.702 129 HG3 GLU 18 2HG GLU 18 -2.369 18.904 8.066 130 H GLY 19 H GLY 19 1.898 19.399 6.538 131 HA2 GLY 19 1HA GLY 19 4.189 19.362 6.495 132 HA3 GLY 19 2HA GLY 19 4.096 18.320 7.908 133 H GLU 20 H GLU 20 2.566 16.247 6.421 134 HA GLU 20 HA GLU 20 4.872 14.909 5.254 135 HB2 GLU 20 1HB GLU 20 2.101 14.043 6.053 136 HB3 GLU 20 2HB GLU 20 3.126 13.006 5.060 137 HG2 GLU 20 1HG GLU 20 3.423 12.448 7.426 138 HG3 GLU 20 2HG GLU 20 4.908 13.139 6.778 139 H TYR 21 H TYR 21 4.127 13.374 3.361 140 HA TYR 21 HA TYR 21 2.688 14.910 1.287 141 HB2 TYR 21 1HB TYR 21 5.185 15.376 1.244 142 HB3 TYR 21 2HB TYR 21 5.402 13.677 0.828 143 HD1 TYR 21 HD2 TYR 21 4.042 16.917 -0.305 144 HD2 TYR 21 HD1 TYR 21 4.769 12.812 -1.333 145 HE1 TYR 21 HE2 TYR 21 3.586 17.434 -2.688 146 HE2 TYR 21 HE1 TYR 21 4.317 13.327 -3.713 147 HH TYR 21 HH TYR 21 4.469 15.504 -5.182 148 H CYS 22 H CYS 22 1.267 13.638 0.300 149 HA CYS 22 HA CYS 22 1.625 10.712 0.383 150 HB2 CYS 22 1HB CYS 22 -0.617 11.988 0.927 151 HB3 CYS 22 2HB CYS 22 -0.779 12.063 -0.827 152 HG CYS 22 HG CYS 22 -1.355 9.638 0.795 153 H VAL 23 H VAL 23 1.969 9.527 -1.509 154 HA VAL 23 HA VAL 23 2.582 11.130 -3.924 155 HB VAL 23 HB VAL 23 3.638 8.448 -3.011 156 HG11 VAL 23 1HG1 VAL 23 4.085 10.123 -5.486 157 HG12 VAL 23 2HG1 VAL 23 3.641 8.418 -5.384 158 HG13 VAL 23 3HG1 VAL 23 5.269 8.934 -4.942 159 HG21 VAL 23 3HG2 VAL 23 5.724 9.648 -2.656 160 HG22 VAL 23 1HG2 VAL 23 4.448 10.434 -1.728 161 HG23 VAL 23 2HG2 VAL 23 5.004 11.144 -3.244 162 H ILE 24 H ILE 24 1.317 7.988 -2.869 163 HA ILE 24 HA ILE 24 -0.678 8.006 -4.956 164 HB ILE 24 HB ILE 24 1.322 7.282 -6.202 165 HG12 ILE 24 1HG1 ILE 24 0.415 5.143 -7.072 166 HG13 ILE 24 2HG1 ILE 24 -0.674 5.050 -5.695 167 HG21 ILE 24 1HG2 ILE 24 1.361 4.988 -4.226 168 HG22 ILE 24 2HG2 ILE 24 2.534 6.304 -4.290 169 HG23 ILE 24 3HG2 ILE 24 2.411 5.164 -5.627 170 HD11 ILE 24 3HD1 ILE 24 -1.998 6.810 -6.452 171 HD12 ILE 24 1HD1 ILE 24 -1.508 6.076 -7.976 172 HD13 ILE 24 2HD1 ILE 24 -0.692 7.527 -7.397 173 H ALA 25 H ALA 25 -2.216 6.348 -4.736 174 HA ALA 25 HA ALA 25 -2.006 4.338 -2.695 175 HB1 ALA 25 3HB ALA 25 -3.869 6.686 -2.252 176 HB2 ALA 25 1HB ALA 25 -2.432 6.330 -1.296 177 HB3 ALA 25 2HB ALA 25 -3.806 5.225 -1.269 178 H VAL 26 H VAL 26 -3.012 2.695 -3.716 179 HA VAL 26 HA VAL 26 -5.375 3.306 -5.404 180 HB VAL 26 HB VAL 26 -3.904 0.685 -5.494 181 HG11 VAL 26 1HG1 VAL 26 -6.081 1.627 -6.882 182 HG12 VAL 26 2HG1 VAL 26 -4.959 0.436 -7.535 183 HG13 VAL 26 3HG1 VAL 26 -4.782 2.138 -7.954 184 HG21 VAL 26 3HG2 VAL 26 -2.114 2.347 -5.568 185 HG22 VAL 26 1HG2 VAL 26 -2.999 3.284 -6.773 186 HG23 VAL 26 2HG2 VAL 26 -2.363 1.693 -7.183 187 H GLN 27 H GLN 27 -6.353 0.661 -5.516 188 HA GLN 27 HA GLN 27 -7.060 0.008 -2.739 189 HB2 GLN 27 1HB GLN 27 -8.769 1.541 -3.993 190 HB3 GLN 27 2HB GLN 27 -9.181 0.083 -4.884 191 HG2 GLN 27 1HG GLN 27 -9.121 0.080 -1.860 192 HG3 GLN 27 2HG GLN 27 -10.533 0.645 -2.736 193 HE21 GLN 27 2HE2 GLN 27 -11.084 -1.509 -1.250 194 HE22 GLN 27 1HE2 GLN 27 -11.154 -2.931 -2.171 195 H GLY 28 H GLY 28 -6.704 -2.045 -2.417 196 HA2 GLY 28 1HA GLY 28 -6.774 -3.924 -4.721 197 HA3 GLY 28 2HA GLY 28 -5.742 -4.104 -3.306 198 H VAL 29 H VAL 29 -6.848 -6.242 -3.557 199 HA VAL 29 HA VAL 29 -9.171 -6.318 -1.723 200 HB VAL 29 HB VAL 29 -8.868 -7.813 -4.331 201 HG11 VAL 29 1HG1 VAL 29 -10.547 -8.437 -1.906 202 HG12 VAL 29 2HG1 VAL 29 -9.574 -9.535 -2.885 203 HG13 VAL 29 3HG1 VAL 29 -11.090 -8.897 -3.521 204 HG21 VAL 29 3HG2 VAL 29 -9.946 -5.643 -4.515 205 HG22 VAL 29 1HG2 VAL 29 -11.003 -6.016 -3.155 206 HG23 VAL 29 2HG2 VAL 29 -11.174 -6.897 -4.673 207 H LEU 30 H LEU 30 -9.322 -8.268 -0.555 208 HA LEU 30 HA LEU 30 -6.912 -9.989 -0.498 209 HB2 LEU 30 1HB LEU 30 -7.019 -8.141 1.372 210 HB3 LEU 30 2HB LEU 30 -8.308 -9.120 2.053 211 HG LEU 30 HG LEU 30 -6.215 -9.769 3.086 212 HD11 LEU 30 1HD1 LEU 30 -6.350 -12.110 2.780 213 HD12 LEU 30 2HD1 LEU 30 -6.798 -11.956 1.089 214 HD13 LEU 30 3HD1 LEU 30 -7.953 -11.530 2.355 215 HD21 LEU 30 3HD2 LEU 30 -5.039 -9.117 0.648 216 HD22 LEU 30 1HD2 LEU 30 -4.913 -10.876 0.674 217 HD23 LEU 30 2HD2 LEU 30 -4.237 -9.917 1.989 218 H CYS 31 H CYS 31 -7.758 -12.028 -0.985 219 HA CYS 31 HA CYS 31 -10.521 -12.593 -0.139 220 HB2 CYS 31 1HB CYS 31 -10.548 -14.185 -1.919 221 HB3 CYS 31 2HB CYS 31 -9.829 -12.713 -2.576 222 HG CYS 31 HG CYS 31 -7.450 -13.994 -1.903 223 H LYS 32 H LYS 32 -10.890 -14.074 1.361 224 HA LYS 32 HA LYS 32 -8.881 -16.149 1.927 225 HB2 LYS 32 1HB LYS 32 -8.375 -14.533 3.633 226 HB3 LYS 32 2HB LYS 32 -10.085 -14.284 3.988 227 HG2 LYS 32 1HG LYS 32 -10.314 -16.465 4.930 228 HG3 LYS 32 2HG LYS 32 -8.767 -16.992 4.268 229 HD2 LYS 32 1HD LYS 32 -8.710 -16.484 6.721 230 HD3 LYS 32 2HD LYS 32 -7.559 -15.545 5.772 231 HE2 LYS 32 1HE LYS 32 -8.881 -13.585 5.903 232 HE3 LYS 32 2HE LYS 32 -10.308 -14.484 6.425 233 HZ1 LYS 32 3HZ LYS 32 -8.206 -14.991 8.213 234 HZ2 LYS 32 1HZ LYS 32 -9.687 -14.222 8.517 235 HZ3 LYS 32 2HZ LYS 32 -8.343 -13.309 8.017 236 H GLY 33 H GLY 33 -9.773 -18.092 2.235 237 HA2 GLY 33 1HA GLY 33 -11.408 -19.716 2.170 238 HA3 GLY 33 2HA GLY 33 -12.154 -18.753 3.442 239 H ASP 34 H ASP 34 -14.069 -17.849 3.039 240 HA ASP 34 HA ASP 34 -14.918 -17.389 0.245 241 HB2 ASP 34 1HB ASP 34 -16.412 -18.879 2.408 242 HB3 ASP 34 2HB ASP 34 -17.222 -18.176 1.010 243 H SER 35 H SER 35 -13.883 -15.725 2.465 244 HA SER 35 HA SER 35 -16.207 -13.891 2.793 245 HB2 SER 35 1HB SER 35 -15.492 -14.809 4.955 246 HB3 SER 35 2HB SER 35 -13.833 -14.309 4.634 247 HG SER 35 HG SER 35 -14.383 -12.437 5.389 248 H ARG 36 H ARG 36 -15.892 -12.471 1.141 249 HA ARG 36 HA ARG 36 -13.292 -11.665 0.279 250 HB2 ARG 36 1HB ARG 36 -15.558 -11.707 -1.035 251 HB3 ARG 36 2HB ARG 36 -15.803 -10.115 -0.325 252 HG2 ARG 36 1HG ARG 36 -14.714 -9.535 -2.306 253 HG3 ARG 36 2HG ARG 36 -13.340 -9.668 -1.210 254 HD2 ARG 36 1HD ARG 36 -12.916 -11.960 -1.983 255 HD3 ARG 36 2HD ARG 36 -14.336 -11.892 -3.021 256 HE ARG 36 HE ARG 36 -12.674 -9.743 -3.711 257 HH11 ARG 36 1HH2 ARG 36 -12.693 -13.205 -3.714 258 HH12 ARG 36 2HH2 ARG 36 -11.648 -13.347 -5.087 259 HH21 ARG 36 1HH1 ARG 36 -11.300 -9.923 -5.511 260 HH22 ARG 36 2HH1 ARG 36 -10.859 -11.489 -6.104 261 H GLN 37 H GLN 37 -12.140 -9.877 0.718 262 HA GLN 37 HA GLN 37 -13.230 -7.933 2.673 263 HB2 GLN 37 1HB GLN 37 -10.543 -9.318 2.688 264 HB3 GLN 37 2HB GLN 37 -10.915 -7.895 3.663 265 HG2 GLN 37 1HG GLN 37 -12.630 -9.051 4.863 266 HG3 GLN 37 2HG GLN 37 -12.601 -10.404 3.733 267 HE21 GLN 37 2HE2 GLN 37 -10.932 -11.988 3.967 268 HE22 GLN 37 1HE2 GLN 37 -9.863 -11.995 5.281 269 H SER 38 H SER 38 -12.353 -5.879 2.560 270 HA SER 38 HA SER 38 -10.927 -5.222 0.030 271 HB2 SER 38 1HB SER 38 -12.860 -3.350 1.378 272 HB3 SER 38 2HB SER 38 -12.202 -3.272 -0.257 273 HG SER 38 HG SER 38 -14.434 -4.405 0.502 274 H ARG 39 H ARG 39 -9.064 -4.241 0.236 275 HA ARG 39 HA ARG 39 -8.427 -2.842 2.778 276 HB2 ARG 39 1HB ARG 39 -6.712 -4.606 1.046 277 HB3 ARG 39 2HB ARG 39 -6.036 -3.524 2.263 278 HG2 ARG 39 1HG ARG 39 -7.452 -4.640 3.985 279 HG3 ARG 39 2HG ARG 39 -8.027 -5.761 2.750 280 HD2 ARG 39 1HD ARG 39 -5.702 -6.499 2.348 281 HD3 ARG 39 2HD ARG 39 -5.138 -5.397 3.595 282 HE ARG 39 HE ARG 39 -6.568 -7.914 4.004 283 HH11 ARG 39 1HH2 ARG 39 -5.392 -4.927 5.303 284 HH12 ARG 39 2HH2 ARG 39 -5.404 -5.478 6.943 285 HH21 ARG 39 1HH1 ARG 39 -6.581 -8.642 6.151 286 HH22 ARG 39 2HH1 ARG 39 -6.077 -7.581 7.424 287 H LEU 40 H LEU 40 -7.401 -0.925 2.653 288 HA LEU 40 HA LEU 40 -7.220 0.321 -0.036 289 HB2 LEU 40 1HB LEU 40 -8.725 1.219 1.898 290 HB3 LEU 40 2HB LEU 40 -7.224 1.805 2.588 291 HG LEU 40 HG LEU 40 -8.204 3.589 1.282 292 HD11 LEU 40 1HD1 LEU 40 -6.018 2.494 -0.481 293 HD12 LEU 40 2HD1 LEU 40 -5.681 3.124 1.134 294 HD13 LEU 40 3HD1 LEU 40 -6.378 4.174 -0.095 295 HD21 LEU 40 3HD2 LEU 40 -8.026 2.078 -1.302 296 HD22 LEU 40 1HD2 LEU 40 -9.113 3.379 -0.824 297 HD23 LEU 40 2HD2 LEU 40 -9.402 1.742 -0.250 298 H LEU 41 H LEU 41 -5.181 0.427 -0.843 299 HA LEU 41 HA LEU 41 -2.894 0.274 0.960 300 HB2 LEU 41 1HB LEU 41 -3.282 0.189 -2.028 301 HB3 LEU 41 2HB LEU 41 -1.675 0.357 -1.326 302 HG LEU 41 HG LEU 41 -2.097 -1.712 0.019 303 HD11 LEU 41 1HD1 LEU 41 -4.023 -3.152 -0.919 304 HD12 LEU 41 2HD1 LEU 41 -4.664 -1.647 -1.577 305 HD13 LEU 41 3HD1 LEU 41 -4.464 -1.833 0.166 306 HD21 LEU 41 3HD2 LEU 41 -0.836 -1.983 -1.994 307 HD22 LEU 41 1HD2 LEU 41 -2.273 -1.810 -3.002 308 HD23 LEU 41 2HD2 LEU 41 -2.052 -3.260 -2.023 309 H GLY 42 H GLY 42 -1.160 1.790 0.898 310 HA2 GLY 42 1HA GLY 42 -1.539 4.358 -0.398 311 HA3 GLY 42 2HA GLY 42 -1.656 4.399 1.359 312 H LEU 43 H LEU 43 0.343 5.462 -0.632 313 HA LEU 43 HA LEU 43 2.784 4.372 0.658 314 HB2 LEU 43 1HB LEU 43 2.770 3.649 -1.668 315 HB3 LEU 43 2HB LEU 43 2.440 5.290 -2.203 316 HG LEU 43 HG LEU 43 4.604 6.053 -1.409 317 HD11 LEU 43 1HD1 LEU 43 5.070 4.864 0.549 318 HD12 LEU 43 2HD1 LEU 43 6.205 4.141 -0.586 319 HD13 LEU 43 3HD1 LEU 43 4.707 3.301 -0.181 320 HD21 LEU 43 3HD2 LEU 43 4.364 4.819 -3.637 321 HD22 LEU 43 1HD2 LEU 43 5.061 3.418 -2.826 322 HD23 LEU 43 2HD2 LEU 43 5.997 4.904 -2.979 323 H VAL 44 H VAL 44 3.929 5.862 1.728 324 HA VAL 44 HA VAL 44 3.407 8.735 1.129 325 HB VAL 44 HB VAL 44 2.345 7.979 3.235 326 HG11 VAL 44 1HG1 VAL 44 4.208 6.241 3.649 327 HG12 VAL 44 2HG1 VAL 44 3.607 7.130 5.047 328 HG13 VAL 44 3HG1 VAL 44 5.141 7.586 4.309 329 HG21 VAL 44 3HG2 VAL 44 3.221 9.786 4.602 330 HG22 VAL 44 1HG2 VAL 44 3.240 10.304 2.918 331 HG23 VAL 44 2HG2 VAL 44 4.735 9.788 3.697 332 H ARG 45 H ARG 45 5.087 9.971 0.745 333 HA ARG 45 HA ARG 45 7.807 8.936 1.320 334 HB2 ARG 45 1HB ARG 45 7.371 9.311 -1.065 335 HB3 ARG 45 2HB ARG 45 6.892 10.975 -0.729 336 HG2 ARG 45 1HG ARG 45 9.117 11.518 0.054 337 HG3 ARG 45 2HG ARG 45 9.614 9.830 -0.047 338 HD2 ARG 45 1HD ARG 45 10.441 11.000 -2.009 339 HD3 ARG 45 2HD ARG 45 9.163 9.894 -2.505 340 HE ARG 45 HE ARG 45 8.111 12.487 -1.927 341 HH11 ARG 45 1HH2 ARG 45 9.867 10.616 -4.247 342 HH12 ARG 45 2HH2 ARG 45 9.390 11.589 -5.598 343 HH21 ARG 45 1HH1 ARG 45 7.482 13.769 -3.692 344 HH22 ARG 45 2HH1 ARG 45 8.040 13.375 -5.284 345 H TYR 46 H TYR 46 8.770 9.867 2.958 346 HA TYR 46 HA TYR 46 7.951 12.590 3.802 347 HB2 TYR 46 1HB TYR 46 7.457 10.816 5.422 348 HB3 TYR 46 2HB TYR 46 9.141 10.302 5.392 349 HD1 TYR 46 HD2 TYR 46 7.089 13.403 5.916 350 HD2 TYR 46 HD1 TYR 46 10.583 11.158 7.021 351 HE1 TYR 46 HE2 TYR 46 7.617 15.081 7.665 352 HE2 TYR 46 HE1 TYR 46 11.102 12.831 8.770 353 HH TYR 46 HH TYR 46 9.588 15.870 8.915 354 H ARG 47 H ARG 47 9.427 14.162 3.724 355 HA ARG 47 HA ARG 47 12.268 13.418 3.282 356 HB2 ARG 47 1HB ARG 47 12.501 15.416 1.921 357 HB3 ARG 47 2HB ARG 47 11.186 14.424 1.293 358 HG2 ARG 47 1HG ARG 47 9.550 15.848 2.491 359 HG3 ARG 47 2HG ARG 47 10.872 16.857 3.081 360 HD2 ARG 47 1HD ARG 47 11.506 17.387 0.754 361 HD3 ARG 47 2HD ARG 47 10.175 16.394 0.169 362 HE ARG 47 HE ARG 47 8.669 18.071 0.827 363 HH11 ARG 47 1HH2 ARG 47 11.897 18.714 1.907 364 HH12 ARG 47 2HH2 ARG 47 11.567 20.354 2.354 365 HH21 ARG 47 1HH1 ARG 47 8.233 20.220 1.415 366 HH22 ARG 47 2HH1 ARG 47 9.494 21.206 2.076 367 H LEU 48 H LEU 48 13.868 14.902 4.046 368 HA LEU 48 HA LEU 48 13.032 16.329 6.510 369 HB2 LEU 48 1HB LEU 48 15.704 15.095 5.797 370 HB3 LEU 48 2HB LEU 48 15.342 15.958 7.289 371 HG LEU 48 HG LEU 48 13.909 13.452 6.357 372 HD11 LEU 48 1HD1 LEU 48 15.158 12.514 8.429 373 HD12 LEU 48 2HD1 LEU 48 16.215 13.913 8.251 374 HD13 LEU 48 3HD1 LEU 48 16.080 12.737 6.944 375 HD21 LEU 48 3HD2 LEU 48 12.382 14.511 7.776 376 HD22 LEU 48 1HD2 LEU 48 13.643 15.281 8.738 377 HD23 LEU 48 2HD2 LEU 48 13.305 13.564 8.938 378 H GLU 49 H GLU 49 13.996 18.308 6.987 379 HA GLU 49 HA GLU 49 14.367 20.061 4.795 380 HB2 GLU 49 1HB GLU 49 14.956 20.347 7.746 381 HB3 GLU 49 2HB GLU 49 15.122 21.669 6.589 382 HG2 GLU 49 1HG GLU 49 12.769 21.489 5.984 383 HG3 GLU 49 2HG GLU 49 12.578 20.081 7.028 384 H ASN 50 H ASN 50 16.380 17.704 5.862 385 HA ASN 50 HA ASN 50 18.861 19.195 5.197 386 HB2 ASN 50 1HB ASN 50 20.049 17.454 6.442 387 HB3 ASN 50 2HB ASN 50 18.833 18.223 7.460 388 HD21 ASN 50 2HD2 ASN 50 18.348 16.425 8.827 389 HD22 ASN 50 1HD2 ASN 50 17.691 14.972 8.245 390 H ASP 51 H ASP 51 16.693 17.581 3.564 391 HA ASP 51 HA ASP 51 16.894 16.676 1.429 392 HB2 ASP 51 1HB ASP 51 19.643 15.597 2.041 393 HB3 ASP 51 2HB ASP 51 18.907 15.938 0.483 394 H ALA 52 H ALA 52 18.946 14.595 3.404 395 HA ALA 52 HA ALA 52 18.282 12.109 2.939 396 HB1 ALA 52 3HB ALA 52 19.585 12.886 4.935 397 HB2 ALA 52 1HB ALA 52 18.521 11.518 5.262 398 HB3 ALA 52 2HB ALA 52 18.054 13.141 5.772 399 H GLN 53 H GLN 53 16.478 11.213 2.273 400 HA GLN 53 HA GLN 53 13.916 11.819 3.648 401 HB2 GLN 53 1HB GLN 53 13.091 10.823 1.282 402 HB3 GLN 53 2HB GLN 53 13.453 12.531 1.501 403 HG2 GLN 53 1HG GLN 53 15.712 10.693 0.737 404 HG3 GLN 53 2HG GLN 53 14.551 11.162 -0.502 405 HE21 GLN 53 2HE2 GLN 53 13.996 13.809 0.158 406 HE22 GLN 53 1HE2 GLN 53 15.415 14.738 0.091 407 H GLU 54 H GLU 54 12.299 9.972 3.246 408 HA GLU 54 HA GLU 54 13.451 7.308 3.186 409 HB2 GLU 54 1HB GLU 54 12.176 6.842 5.450 410 HB3 GLU 54 2HB GLU 54 13.812 7.495 5.478 411 HG2 GLU 54 1HG GLU 54 11.379 9.288 5.498 412 HG3 GLU 54 2HG GLU 54 12.092 8.653 6.978 413 H HIS 55 H HIS 55 11.833 5.652 3.045 414 HA HIS 55 HA HIS 55 9.109 6.630 2.369 415 HB2 HIS 55 1HB HIS 55 10.710 4.548 0.867 416 HB3 HIS 55 2HB HIS 55 9.064 5.056 0.501 417 HD2 HIS 55 HD2 HIS 55 8.879 7.382 -1.033 418 HE1 HIS 55 HE1 HIS 55 12.990 8.347 -1.031 419 HE2 HIS 55 HE2 HIS 55 10.723 8.952 -2.007 420 H ALA 56 H ALA 56 7.428 5.079 2.614 421 HA ALA 56 HA ALA 56 7.984 2.494 3.789 422 HB1 ALA 56 3HB ALA 56 8.100 3.650 5.841 423 HB2 ALA 56 1HB ALA 56 6.424 3.103 5.768 424 HB3 ALA 56 2HB ALA 56 6.825 4.777 5.380 425 H LEU 57 H LEU 57 6.121 1.125 3.716 426 HA LEU 57 HA LEU 57 4.012 2.138 1.913 427 HB2 LEU 57 1HB LEU 57 5.263 0.066 1.301 428 HB3 LEU 57 2HB LEU 57 4.624 -0.706 2.745 429 HG LEU 57 HG LEU 57 2.313 -0.313 1.906 430 HD11 LEU 57 1HD1 LEU 57 3.842 1.000 -0.333 431 HD12 LEU 57 2HD1 LEU 57 2.356 1.521 0.459 432 HD13 LEU 57 3HD1 LEU 57 2.314 0.196 -0.695 433 HD21 LEU 57 3HD2 LEU 57 3.962 -1.705 -0.214 434 HD22 LEU 57 1HD2 LEU 57 2.347 -2.123 0.355 435 HD23 LEU 57 2HD2 LEU 57 3.744 -2.394 1.395 436 H PHE 58 H PHE 58 2.511 3.119 3.083 437 HA PHE 58 HA PHE 58 1.689 2.214 5.679 438 HB2 PHE 58 1HB PHE 58 0.921 4.445 3.820 439 HB3 PHE 58 2HB PHE 58 -0.126 4.061 5.183 440 HD1 PHE 58 HD1 PHE 58 3.566 3.570 5.367 441 HD2 PHE 58 HD2 PHE 58 0.271 6.173 6.314 442 HE1 PHE 58 HE1 PHE 58 5.012 4.842 6.900 443 HE2 PHE 58 HE2 PHE 58 1.735 7.442 7.857 444 HZ PHE 58 HZ PHE 58 4.104 6.777 8.150 445 H LEU 59 H LEU 59 -0.212 1.297 6.288 446 HA LEU 59 HA LEU 59 -1.882 0.130 4.128 447 HB2 LEU 59 1HB LEU 59 -0.509 -1.487 5.600 448 HB3 LEU 59 2HB LEU 59 -1.601 -1.022 6.904 449 HG LEU 59 HG LEU 59 -3.492 -1.583 5.120 450 HD11 LEU 59 1HD1 LEU 59 -1.144 -3.244 4.156 451 HD12 LEU 59 2HD1 LEU 59 -1.971 -1.989 3.234 452 HD13 LEU 59 3HD1 LEU 59 -2.819 -3.471 3.660 453 HD21 LEU 59 3HD2 LEU 59 -3.291 -2.804 7.200 454 HD22 LEU 59 1HD2 LEU 59 -1.856 -3.650 6.619 455 HD23 LEU 59 2HD2 LEU 59 -3.429 -3.982 5.895 456 H TYR 60 H TYR 60 -3.862 0.832 4.075 457 HA TYR 60 HA TYR 60 -5.043 2.139 6.471 458 HB2 TYR 60 1HB TYR 60 -5.323 2.670 3.511 459 HB3 TYR 60 2HB TYR 60 -6.409 3.348 4.708 460 HD1 TYR 60 HD1 TYR 60 -5.597 4.998 6.350 461 HD2 TYR 60 HD2 TYR 60 -3.041 3.431 3.281 462 HE1 TYR 60 HE1 TYR 60 -3.993 6.848 6.747 463 HE2 TYR 60 HE2 TYR 60 -1.435 5.277 3.675 464 HH TYR 60 HH TYR 60 -1.725 7.413 6.392 465 H THR 61 H THR 61 -6.910 1.211 7.245 466 HA THR 61 HA THR 61 -8.044 -1.023 5.717 467 HB THR 61 HB THR 61 -7.753 -1.251 8.178 468 HG1 THR 61 HG1 THR 61 -9.292 -2.547 7.421 469 HG21 THR 61 3HG2 THR 61 -8.322 1.168 8.673 470 HG22 THR 61 1HG2 THR 61 -9.132 -0.009 9.705 471 HG23 THR 61 2HG2 THR 61 -10.010 0.752 8.377 472 H HIS 62 H HIS 62 -10.466 -1.108 5.555 473 HA HIS 62 HA HIS 62 -11.960 1.281 5.654 474 HB2 HIS 62 1HB HIS 62 -12.008 2.061 3.463 475 HB3 HIS 62 2HB HIS 62 -10.323 1.569 3.605 476 HD2 HIS 62 HD2 HIS 62 -9.706 -0.906 2.233 477 HE1 HIS 62 HE1 HIS 62 -13.325 -1.013 0.072 478 HE2 HIS 62 HE2 HIS 62 -11.012 -2.042 0.284 479 H ARG 63 H ARG 63 -14.119 0.947 5.201 480 HA ARG 63 HA ARG 63 -15.061 -1.705 5.505 481 HB2 ARG 63 1HB ARG 63 -16.720 0.612 4.499 482 HB3 ARG 63 2HB ARG 63 -17.255 -0.791 5.425 483 HG2 ARG 63 1HG ARG 63 -15.849 -0.024 7.327 484 HG3 ARG 63 2HG ARG 63 -15.431 1.412 6.393 485 HD2 ARG 63 1HD ARG 63 -17.252 1.989 7.883 486 HD3 ARG 63 2HD ARG 63 -17.867 1.959 6.232 487 HE ARG 63 HE ARG 63 -19.148 0.083 6.777 488 HH11 ARG 63 1HH2 ARG 63 -16.881 0.842 9.286 489 HH12 ARG 63 2HH2 ARG 63 -17.594 -0.233 10.441 490 HH21 ARG 63 1HH1 ARG 63 -20.087 -1.322 8.293 491 HH22 ARG 63 2HH1 ARG 63 -19.407 -1.457 9.880 492 H ARG 64 H ARG 64 -17.246 -1.744 3.762 493 HA ARG 64 HA ARG 64 -16.072 -2.947 1.473 494 HB2 ARG 64 1HB ARG 64 -18.261 -3.628 2.446 495 HB3 ARG 64 2HB ARG 64 -18.947 -2.096 1.906 496 HG2 ARG 64 1HG ARG 64 -18.373 -2.671 -0.436 497 HG3 ARG 64 2HG ARG 64 -17.718 -4.214 0.116 498 HD2 ARG 64 1HD ARG 64 -19.965 -4.741 1.102 499 HD3 ARG 64 2HD ARG 64 -20.586 -3.272 0.359 500 HE ARG 64 HE ARG 64 -19.328 -4.818 -1.634 501 HH11 ARG 64 1HH2 ARG 64 -22.057 -4.863 0.496 502 HH12 ARG 64 2HH2 ARG 64 -23.047 -5.803 -0.569 503 HH21 ARG 64 1HH1 ARG 64 -20.621 -6.049 -3.036 504 HH22 ARG 64 2HH1 ARG 64 -22.234 -6.474 -2.569 505 H MET 65 H MET 65 -17.652 0.256 2.029 506 HA MET 65 HA MET 65 -16.585 1.104 -0.600 507 HB2 MET 65 1HB MET 65 -19.295 1.914 0.460 508 HB3 MET 65 2HB MET 65 -18.643 2.152 -1.161 509 HG2 MET 65 1HG MET 65 -18.647 -0.282 -1.533 510 HG3 MET 65 2HG MET 65 -19.282 -0.538 0.092 511 HE1 MET 65 3HE MET 65 -22.707 0.490 0.258 512 HE2 MET 65 1HE MET 65 -21.736 1.968 0.264 513 HE3 MET 65 2HE MET 65 -21.125 0.506 1.032 514 H ALA 66 H ALA 66 -15.849 1.481 2.320 515 HA ALA 66 HA ALA 66 -16.365 4.294 2.852 516 HB1 ALA 66 3HB ALA 66 -14.747 2.177 4.241 517 HB2 ALA 66 1HB ALA 66 -16.247 2.920 4.785 518 HB3 ALA 66 2HB ALA 66 -14.750 3.855 4.775 519 H ILE 67 H ILE 67 -14.944 3.481 0.430 520 HA ILE 67 HA ILE 67 -12.177 3.967 0.543 521 HB ILE 67 HB ILE 67 -14.221 4.333 -1.659 522 HG12 ILE 67 1HG1 ILE 67 -12.140 2.165 -1.263 523 HG13 ILE 67 2HG1 ILE 67 -13.800 2.024 -0.685 524 HG21 ILE 67 1HG2 ILE 67 -12.089 4.132 -3.117 525 HG22 ILE 67 2HG2 ILE 67 -11.216 4.602 -1.658 526 HG23 ILE 67 3HG2 ILE 67 -12.421 5.685 -2.354 527 HD11 ILE 67 3HD1 ILE 67 -14.652 2.310 -2.965 528 HD12 ILE 67 1HD1 ILE 67 -13.500 0.974 -2.922 529 HD13 ILE 67 2HD1 ILE 67 -13.010 2.540 -3.569 530 H THR 68 H THR 68 -14.906 6.104 0.017 531 HA THR 68 HA THR 68 -14.083 8.410 -0.908 532 HB THR 68 HB THR 68 -15.621 8.175 1.678 533 HG1 THR 68 HG1 THR 68 -16.239 7.194 -0.517 534 HG21 THR 68 3HG2 THR 68 -15.179 10.451 -0.263 535 HG22 THR 68 1HG2 THR 68 -14.939 10.450 1.485 536 HG23 THR 68 2HG2 THR 68 -16.572 10.396 0.819 537 H GLY 69 H GLY 69 -12.940 7.288 2.282 538 HA2 GLY 69 1HA GLY 69 -10.712 8.022 2.975 539 HA3 GLY 69 2HA GLY 69 -11.069 9.603 2.294 540 H ASP 70 H ASP 70 -13.898 8.961 3.332 541 HA ASP 70 HA ASP 70 -13.871 10.645 5.568 542 HB2 ASP 70 1HB ASP 70 -16.193 9.783 5.932 543 HB3 ASP 70 2HB ASP 70 -15.893 10.390 4.307 544 H ASP 71 H ASP 71 -14.253 7.071 5.393 545 HA ASP 71 HA ASP 71 -13.731 6.976 8.335 546 HB2 ASP 71 1HB ASP 71 -16.078 6.376 7.711 547 HB3 ASP 71 2HB ASP 71 -15.455 5.151 6.605 548 H VAL 72 H VAL 72 -11.457 6.905 6.884 549 HA VAL 72 HA VAL 72 -10.498 4.182 7.341 550 HB VAL 72 HB VAL 72 -10.953 3.894 5.061 551 HG11 VAL 72 1HG1 VAL 72 -11.640 6.039 4.369 552 HG12 VAL 72 2HG1 VAL 72 -10.190 5.750 3.410 553 HG13 VAL 72 3HG1 VAL 72 -10.111 6.783 4.837 554 HG21 VAL 72 3HG2 VAL 72 -8.853 3.437 4.182 555 HG22 VAL 72 1HG2 VAL 72 -8.358 3.774 5.840 556 HG23 VAL 72 2HG2 VAL 72 -8.204 5.020 4.608 557 H SER 73 H SER 73 -8.559 4.254 8.417 558 HA SER 73 HA SER 73 -6.676 6.405 7.853 559 HB2 SER 73 1HB SER 73 -8.135 7.264 9.664 560 HB3 SER 73 2HB SER 73 -7.761 5.835 10.621 561 HG SER 73 HG SER 73 -5.506 6.964 9.691 562 H LEU 74 H LEU 74 -4.609 5.917 9.152 563 HA LEU 74 HA LEU 74 -3.474 3.620 8.406 564 HB2 LEU 74 1HB LEU 74 -2.992 5.266 10.873 565 HB3 LEU 74 2HB LEU 74 -2.011 3.834 10.566 566 HG LEU 74 HG LEU 74 -2.417 6.005 8.499 567 HD11 LEU 74 1HD1 LEU 74 -0.252 5.741 10.605 568 HD12 LEU 74 2HD1 LEU 74 -1.394 7.071 10.418 569 HD13 LEU 74 3HD1 LEU 74 -0.142 6.808 9.205 570 HD21 LEU 74 3HD2 LEU 74 0.106 4.600 8.336 571 HD22 LEU 74 1HD2 LEU 74 -1.218 4.613 7.178 572 HD23 LEU 74 2HD2 LEU 74 -1.175 3.402 8.451 573 H ASP 75 H ASP 75 -3.539 1.571 8.739 574 HA ASP 75 HA ASP 75 -4.899 0.462 11.127 575 HB2 ASP 75 1HB ASP 75 -6.132 0.153 8.976 576 HB3 ASP 75 2HB ASP 75 -4.756 -0.766 8.368 577 H GLN 76 H GLN 76 -2.050 0.405 9.057 578 HA GLN 76 HA GLN 76 -0.663 -1.155 11.012 579 HB2 GLN 76 1HB GLN 76 -1.934 -2.750 9.220 580 HB3 GLN 76 2HB GLN 76 -0.446 -2.450 8.326 581 HG2 GLN 76 1HG GLN 76 0.803 -3.093 10.476 582 HG3 GLN 76 2HG GLN 76 -0.743 -3.673 11.080 583 HE21 GLN 76 2HE2 GLN 76 2.014 -4.776 9.613 584 HE22 GLN 76 1HE2 GLN 76 1.375 -6.106 8.775 585 H ILE 77 H ILE 77 1.569 -1.860 9.582 586 HA ILE 77 HA ILE 77 2.493 0.391 7.988 587 HB ILE 77 HB ILE 77 3.603 -0.222 10.745 588 HG12 ILE 77 1HG1 ILE 77 2.760 2.397 9.442 589 HG13 ILE 77 2HG1 ILE 77 1.767 1.466 10.554 590 HG21 ILE 77 1HG2 ILE 77 4.969 0.884 8.322 591 HG22 ILE 77 2HG2 ILE 77 5.638 -0.011 9.683 592 HG23 ILE 77 3HG2 ILE 77 5.290 1.702 9.847 593 HD11 ILE 77 3HD1 ILE 77 2.875 3.237 11.787 594 HD12 ILE 77 1HD1 ILE 77 4.448 2.699 11.197 595 HD13 ILE 77 2HD1 ILE 77 3.519 1.676 12.295 596 H VAL 78 H VAL 78 3.968 -0.248 6.540 597 HA VAL 78 HA VAL 78 5.415 -2.797 6.935 598 HB VAL 78 HB VAL 78 3.819 -2.001 4.492 599 HG11 VAL 78 1HG1 VAL 78 5.837 -4.209 4.961 600 HG12 VAL 78 2HG1 VAL 78 5.874 -2.968 3.708 601 HG13 VAL 78 3HG1 VAL 78 4.663 -4.248 3.645 602 HG21 VAL 78 3HG2 VAL 78 2.743 -4.233 4.959 603 HG22 VAL 78 1HG2 VAL 78 2.438 -3.016 6.198 604 HG23 VAL 78 2HG2 VAL 78 3.635 -4.280 6.480 605 HA PRO 79 HA PRO 79 8.213 0.506 5.389 606 HB2 PRO 79 1HB PRO 79 10.369 -0.044 6.933 607 HB3 PRO 79 2HB PRO 79 8.961 0.832 7.556 608 HG2 PRO 79 1HG PRO 79 9.749 -2.007 7.967 609 HG3 PRO 79 2HG PRO 79 8.966 -0.880 9.090 610 HD2 PRO 79 1HD PRO 79 7.643 -2.859 7.588 611 HD3 PRO 79 2HD PRO 79 6.859 -1.474 8.372 612 H LEU 80 H LEU 80 9.274 0.251 3.507 613 HA LEU 80 HA LEU 80 9.918 -2.195 2.386 614 HB2 LEU 80 1HB LEU 80 10.957 0.586 1.838 615 HB3 LEU 80 2HB LEU 80 11.313 -0.800 0.809 616 HG LEU 80 HG LEU 80 8.500 0.070 1.533 617 HD11 LEU 80 1HD1 LEU 80 9.505 1.881 0.300 618 HD12 LEU 80 2HD1 LEU 80 8.458 0.998 -0.811 619 HD13 LEU 80 3HD1 LEU 80 10.206 0.766 -0.872 620 HD21 LEU 80 3HD2 LEU 80 8.183 -1.256 -0.761 621 HD22 LEU 80 1HD2 LEU 80 8.280 -2.122 0.768 622 HD23 LEU 80 2HD2 LEU 80 9.695 -2.022 -0.279 623 H SER 81 H SER 81 11.413 -3.555 2.702 624 HA SER 81 HA SER 81 14.092 -2.758 3.669 625 HB2 SER 81 1HB SER 81 12.362 -4.931 4.866 626 HB3 SER 81 2HB SER 81 14.089 -4.769 5.173 627 HG SER 81 HG SER 81 12.003 -2.945 5.773 628 H LYS 82 H LYS 82 15.681 -4.579 3.416 629 HA LYS 82 HA LYS 82 15.725 -5.431 0.774 630 HB2 LYS 82 1HB LYS 82 17.755 -5.291 2.094 631 HB3 LYS 82 2HB LYS 82 17.187 -6.566 3.166 632 HG2 LYS 82 1HG LYS 82 18.819 -7.402 1.484 633 HG3 LYS 82 2HG LYS 82 17.253 -8.189 1.332 634 HD2 LYS 82 1HD LYS 82 16.688 -6.953 -0.607 635 HD3 LYS 82 2HD LYS 82 17.939 -5.743 -0.306 636 HE2 LYS 82 1HE LYS 82 19.677 -7.407 -0.776 637 HE3 LYS 82 2HE LYS 82 18.448 -8.652 -0.999 638 HZ1 LYS 82 3HZ LYS 82 17.562 -7.449 -2.858 639 HZ2 LYS 82 1HZ LYS 82 19.223 -7.684 -3.103 640 HZ3 LYS 82 2HZ LYS 82 18.647 -6.166 -2.608 641 H ASP 83 H ASP 83 14.742 -7.246 3.692 642 HA ASP 83 HA ASP 83 14.323 -9.720 2.463 643 HB2 ASP 83 1HB ASP 83 14.328 -9.125 4.949 644 HB3 ASP 83 2HB ASP 83 12.656 -8.618 4.720 645 H PHE 84 H PHE 84 12.778 -6.813 1.880 646 HA PHE 84 HA PHE 84 10.113 -7.735 1.376 647 HB2 PHE 84 1HB PHE 84 10.920 -5.325 1.812 648 HB3 PHE 84 2HB PHE 84 11.394 -5.313 0.115 649 HD1 PHE 84 HD2 PHE 84 9.520 -6.084 -1.596 650 HD2 PHE 84 HD1 PHE 84 8.744 -4.730 2.410 651 HE1 PHE 84 HE2 PHE 84 7.182 -5.542 -2.224 652 HE2 PHE 84 HE1 PHE 84 6.415 -4.181 1.778 653 HZ PHE 84 HZ PHE 84 5.632 -4.588 -0.539 654 H MET 85 H MET 85 9.220 -8.399 -0.531 655 HA MET 85 HA MET 85 10.534 -8.248 -3.046 656 HB2 MET 85 1HB MET 85 11.930 -10.034 -2.054 657 HB3 MET 85 2HB MET 85 10.479 -11.000 -1.777 658 HG2 MET 85 1HG MET 85 10.019 -11.063 -4.179 659 HG3 MET 85 2HG MET 85 11.394 -10.006 -4.495 660 HE1 MET 85 3HE MET 85 12.882 -13.015 -6.034 661 HE2 MET 85 1HE MET 85 11.832 -11.603 -6.212 662 HE3 MET 85 2HE MET 85 11.136 -13.187 -5.884 663 H LEU 86 H LEU 86 9.143 -8.678 -4.704 664 HA LEU 86 HA LEU 86 6.384 -9.440 -3.941 665 HB2 LEU 86 1HB LEU 86 6.099 -8.402 -6.438 666 HB3 LEU 86 2HB LEU 86 6.043 -7.415 -4.982 667 HG LEU 86 HG LEU 86 8.490 -6.961 -5.227 668 HD11 LEU 86 1HD1 LEU 86 8.090 -8.726 -7.642 669 HD12 LEU 86 2HD1 LEU 86 9.397 -8.750 -6.458 670 HD13 LEU 86 3HD1 LEU 86 9.329 -7.471 -7.665 671 HD21 LEU 86 3HD2 LEU 86 8.236 -5.488 -7.233 672 HD22 LEU 86 1HD2 LEU 86 6.883 -5.363 -6.108 673 HD23 LEU 86 2HD2 LEU 86 6.712 -6.300 -7.593 674 H GLU 87 H GLU 87 5.480 -11.280 -4.805 675 HA GLU 87 HA GLU 87 7.030 -12.696 -6.907 676 HB2 GLU 87 1HB GLU 87 5.571 -13.830 -4.512 677 HB3 GLU 87 2HB GLU 87 6.232 -14.795 -5.829 678 HG2 GLU 87 1HG GLU 87 8.480 -13.945 -5.362 679 HG3 GLU 87 2HG GLU 87 7.842 -12.913 -4.082 680 H GLU 88 H GLU 88 5.960 -13.191 -8.648 681 HA GLU 88 HA GLU 88 3.161 -12.543 -8.937 682 HB2 GLU 88 1HB GLU 88 5.137 -13.864 -10.813 683 HB3 GLU 88 2HB GLU 88 3.473 -13.473 -11.251 684 HG2 GLU 88 1HG GLU 88 3.880 -11.102 -10.795 685 HG3 GLU 88 2HG GLU 88 5.524 -11.465 -10.274 686 H VAL 89 H VAL 89 1.435 -13.992 -9.235 687 HA VAL 89 HA VAL 89 1.809 -16.587 -7.957 688 HB VAL 89 HB VAL 89 -0.718 -15.573 -9.236 689 HG11 VAL 89 1HG1 VAL 89 -0.747 -17.914 -8.598 690 HG12 VAL 89 2HG1 VAL 89 -1.732 -17.003 -7.455 691 HG13 VAL 89 3HG1 VAL 89 -0.109 -17.522 -7.001 692 HG21 VAL 89 3HG2 VAL 89 -1.285 -14.669 -6.985 693 HG22 VAL 89 1HG2 VAL 89 0.099 -13.839 -7.698 694 HG23 VAL 89 2HG2 VAL 89 0.348 -15.053 -6.443 695 H SER 90 H SER 90 1.634 -18.562 -8.910 696 HA SER 90 HA SER 90 2.638 -19.179 -11.323 697 HB2 SER 90 1HB SER 90 1.104 -21.223 -11.300 698 HB3 SER 90 2HB SER 90 2.129 -20.973 -9.888 699 HG SER 90 HG SER 90 -0.581 -20.962 -10.105 700 HA PRO 91 HA PRO 91 -0.294 -16.954 -14.055 701 HB2 PRO 91 1HB PRO 91 1.296 -18.555 -16.046 702 HB3 PRO 91 2HB PRO 91 0.805 -16.855 -16.113 703 HG2 PRO 91 1HG PRO 91 3.289 -17.531 -15.474 704 HG3 PRO 91 2HG PRO 91 2.476 -16.181 -14.661 705 HD2 PRO 91 1HD PRO 91 3.077 -18.919 -13.615 706 HD3 PRO 91 2HD PRO 91 2.970 -17.374 -12.741 707 H ASP 92 H ASP 92 0.581 -20.090 -15.466 708 HA ASP 92 HA ASP 92 -0.803 -21.694 -16.444 709 HB2 ASP 92 1HB ASP 92 -0.620 -22.347 -14.018 710 HB3 ASP 92 2HB ASP 92 -2.155 -21.523 -13.745 711 H GLY 93 H GLY 93 -1.596 -18.945 -16.864 712 HA2 GLY 93 1HA GLY 93 -4.549 -19.059 -16.871 713 HA3 GLY 93 2HA GLY 93 -3.572 -17.604 -17.055 714 H GLU 94 H GLU 94 -1.888 -18.029 -19.024 715 HA GLU 94 HA GLU 94 -2.571 -19.464 -21.284 716 HB2 GLU 94 1HB GLU 94 -3.695 -17.652 -22.674 717 HB3 GLU 94 2HB GLU 94 -4.717 -18.414 -21.465 718 HG2 GLU 94 1HG GLU 94 -4.333 -16.536 -19.926 719 HG3 GLU 94 2HG GLU 94 -3.236 -15.794 -21.086 720 H LEU 95 H LEU 95 -1.365 -16.494 -19.940 721 HA LEU 95 HA LEU 95 1.135 -16.533 -21.146 722 HB2 LEU 95 1HB LEU 95 0.055 -16.189 -23.316 723 HB3 LEU 95 2HB LEU 95 -0.835 -14.810 -22.688 724 HG LEU 95 HG LEU 95 1.243 -13.562 -22.400 725 HD11 LEU 95 1HD1 LEU 95 3.354 -14.708 -23.443 726 HD12 LEU 95 2HD1 LEU 95 2.486 -16.214 -23.142 727 HD13 LEU 95 3HD1 LEU 95 2.890 -15.145 -21.799 728 HD21 LEU 95 3HD2 LEU 95 1.130 -14.927 -25.107 729 HD22 LEU 95 1HD2 LEU 95 1.885 -13.371 -24.766 730 HD23 LEU 95 2HD2 LEU 95 0.136 -13.555 -24.617 731 H TYR 96 H TYR 96 -1.424 -14.916 -19.556 732 HA TYR 96 HA TYR 96 0.495 -13.197 -18.173 733 HB2 TYR 96 1HB TYR 96 -0.592 -11.128 -18.636 734 HB3 TYR 96 2HB TYR 96 -0.335 -11.914 -20.193 735 HD1 TYR 96 HD1 TYR 96 -2.841 -11.299 -17.529 736 HD2 TYR 96 HD2 TYR 96 -2.187 -12.505 -21.596 737 HE1 TYR 96 HE1 TYR 96 -5.265 -11.160 -17.948 738 HE2 TYR 96 HE2 TYR 96 -4.629 -12.374 -22.024 739 HH TYR 96 HH TYR 96 -6.628 -11.931 -21.161 740 H ILE 97 H ILE 97 -0.036 -12.765 -16.135 741 HA ILE 97 HA ILE 97 -2.372 -14.093 -15.008 742 HB ILE 97 HB ILE 97 -0.391 -12.498 -13.386 743 HG12 ILE 97 1HG1 ILE 97 0.798 -14.951 -13.409 744 HG13 ILE 97 2HG1 ILE 97 0.174 -14.923 -15.052 745 HG21 ILE 97 1HG2 ILE 97 -1.833 -15.134 -12.955 746 HG22 ILE 97 2HG2 ILE 97 -2.322 -13.576 -12.291 747 HG23 ILE 97 3HG2 ILE 97 -0.807 -14.316 -11.776 748 HD11 ILE 97 3HD1 ILE 97 1.262 -12.478 -15.043 749 HD12 ILE 97 1HD1 ILE 97 2.219 -13.913 -15.401 750 HD13 ILE 97 2HD1 ILE 97 2.264 -13.203 -13.790 751 H LEU 98 H LEU 98 -1.219 -10.882 -15.713 752 HA LEU 98 HA LEU 98 -3.176 -9.564 -14.047 753 HB2 LEU 98 1HB LEU 98 -1.326 -8.439 -16.159 754 HB3 LEU 98 2HB LEU 98 -2.276 -7.495 -15.023 755 HG LEU 98 HG LEU 98 -1.027 -8.920 -13.191 756 HD11 LEU 98 1HD1 LEU 98 0.146 -10.520 -14.487 757 HD12 LEU 98 2HD1 LEU 98 1.373 -9.357 -14.013 758 HD13 LEU 98 3HD1 LEU 98 0.704 -9.315 -15.640 759 HD21 LEU 98 3HD2 LEU 98 -0.767 -6.459 -13.599 760 HD22 LEU 98 1HD2 LEU 98 0.493 -6.827 -14.777 761 HD23 LEU 98 2HD2 LEU 98 0.729 -7.229 -13.076 762 H GLY 99 H GLY 99 -2.847 -7.962 -16.976 763 HA2 GLY 99 1HA GLY 99 -4.524 -7.203 -18.385 764 HA3 GLY 99 2HA GLY 99 -4.554 -8.899 -18.831 765 H SER 100 H SER 100 -6.202 -6.338 -17.322 766 HA SER 100 HA SER 100 -8.487 -6.146 -16.925 767 HB2 SER 100 1HB SER 100 -8.857 -9.101 -16.570 768 HB3 SER 100 2HB SER 100 -9.971 -7.903 -17.223 769 HG SER 100 HG SER 100 -8.703 -7.818 -19.084 770 H ASP 101 H ASP 101 -6.037 -7.473 -15.192 771 HA ASP 101 HA ASP 101 -7.006 -6.557 -12.691 772 HB2 ASP 101 1HB ASP 101 -7.298 -8.589 -11.484 773 HB3 ASP 101 2HB ASP 101 -8.252 -8.772 -12.953 774 H VAL 102 H VAL 102 -5.359 -7.317 -10.901 775 HA VAL 102 HA VAL 102 -2.685 -7.760 -12.095 776 HB VAL 102 HB VAL 102 -3.302 -5.723 -9.967 777 HG11 VAL 102 1HG1 VAL 102 -1.112 -6.479 -9.562 778 HG12 VAL 102 2HG1 VAL 102 -0.868 -5.069 -10.591 779 HG13 VAL 102 3HG1 VAL 102 -0.770 -6.690 -11.277 780 HG21 VAL 102 3HG2 VAL 102 -2.810 -5.517 -12.931 781 HG22 VAL 102 1HG2 VAL 102 -2.463 -4.164 -11.859 782 HG23 VAL 102 2HG2 VAL 102 -4.103 -4.791 -11.974 783 H THR 103 H THR 103 -2.016 -9.601 -11.274 784 HA THR 103 HA THR 103 -2.766 -10.298 -8.489 785 HB THR 103 HB THR 103 -1.432 -12.185 -10.432 786 HG1 THR 103 HG1 THR 103 -3.581 -11.005 -11.033 787 HG21 THR 103 3HG2 THR 103 -1.867 -12.583 -7.873 788 HG22 THR 103 1HG2 THR 103 -2.281 -13.856 -9.021 789 HG23 THR 103 2HG2 THR 103 -3.542 -12.806 -8.378 790 H VAL 104 H VAL 104 -1.363 -9.679 -7.050 791 HA VAL 104 HA VAL 104 1.517 -10.171 -7.497 792 HB VAL 104 HB VAL 104 0.809 -7.708 -7.836 793 HG11 VAL 104 1HG1 VAL 104 0.289 -6.402 -5.915 794 HG12 VAL 104 2HG1 VAL 104 0.676 -7.725 -4.815 795 HG13 VAL 104 3HG1 VAL 104 -0.768 -7.810 -5.823 796 HG21 VAL 104 3HG2 VAL 104 2.779 -6.899 -6.551 797 HG22 VAL 104 1HG2 VAL 104 3.136 -8.392 -7.420 798 HG23 VAL 104 2HG2 VAL 104 2.830 -8.433 -5.684 799 H GLN 105 H GLN 105 2.553 -11.008 -5.763 800 HA GLN 105 HA GLN 105 1.028 -11.276 -3.219 801 HB2 GLN 105 1HB GLN 105 1.373 -13.381 -4.711 802 HB3 GLN 105 2HB GLN 105 3.050 -13.302 -4.177 803 HG2 GLN 105 1HG GLN 105 0.663 -13.385 -2.308 804 HG3 GLN 105 2HG GLN 105 1.632 -14.787 -2.747 805 HE21 GLN 105 2HE2 GLN 105 1.467 -12.067 -0.609 806 HE22 GLN 105 1HE2 GLN 105 3.001 -12.262 0.090 807 H LEU 106 H LEU 106 2.003 -10.042 -1.654 808 HA LEU 106 HA LEU 106 4.781 -9.291 -1.915 809 HB2 LEU 106 1HB LEU 106 2.843 -8.789 0.352 810 HB3 LEU 106 2HB LEU 106 4.343 -7.921 0.030 811 HG LEU 106 HG LEU 106 1.953 -8.006 -1.833 812 HD11 LEU 106 1HD1 LEU 106 2.962 -5.645 -0.236 813 HD12 LEU 106 2HD1 LEU 106 1.719 -6.731 0.387 814 HD13 LEU 106 3HD1 LEU 106 1.427 -5.807 -1.086 815 HD21 LEU 106 3HD2 LEU 106 4.684 -6.720 -1.954 816 HD22 LEU 106 1HD2 LEU 106 3.319 -5.982 -2.794 817 HD23 LEU 106 2HD2 LEU 106 3.825 -7.617 -3.206 818 H ASN 107 H ASN 107 6.320 -10.564 -1.285 819 HA ASN 107 HA ASN 107 5.891 -12.430 1.002 820 HB2 ASN 107 1HB ASN 107 8.182 -12.614 -0.930 821 HB3 ASN 107 2HB ASN 107 7.511 -13.862 0.118 822 HD21 ASN 107 2HD2 ASN 107 6.117 -11.600 -2.305 823 HD22 ASN 107 1HD2 ASN 107 5.244 -12.796 -3.128 824 H THR 108 H THR 108 6.287 -10.211 2.240 825 HA THR 108 HA THR 108 9.050 -9.466 2.490 826 HB THR 108 HB THR 108 8.357 -7.883 4.065 827 HG1 THR 108 HG1 THR 108 6.447 -9.825 4.655 828 HG21 THR 108 3HG2 THR 108 7.303 -7.436 1.903 829 HG22 THR 108 1HG2 THR 108 6.225 -6.946 3.209 830 HG23 THR 108 2HG2 THR 108 5.927 -8.449 2.338 831 H ALA 109 H ALA 109 9.858 -9.357 4.869 832 HA ALA 109 HA ALA 109 10.793 -11.814 5.614 833 HB1 ALA 109 3HB ALA 109 11.371 -10.869 7.767 834 HB2 ALA 109 1HB ALA 109 10.179 -9.587 7.565 835 HB3 ALA 109 2HB ALA 109 11.601 -9.641 6.524 836 H GLU 110 H GLU 110 7.749 -10.331 6.662 837 HA GLU 110 HA GLU 110 6.938 -12.962 7.758 838 HB2 GLU 110 1HB GLU 110 5.843 -11.846 9.635 839 HB3 GLU 110 2HB GLU 110 7.569 -11.481 9.634 840 HG2 GLU 110 1HG GLU 110 7.060 -9.343 8.429 841 HG3 GLU 110 2HG GLU 110 5.342 -9.694 8.611 842 H LEU 111 H LEU 111 6.025 -9.846 6.377 843 HA LEU 111 HA LEU 111 3.247 -10.383 6.245 844 HB2 LEU 111 1HB LEU 111 4.626 -8.134 5.944 845 HB3 LEU 111 2HB LEU 111 4.618 -8.601 4.251 846 HG LEU 111 HG LEU 111 2.740 -7.137 4.669 847 HD11 LEU 111 1HD1 LEU 111 1.506 -9.873 4.503 848 HD12 LEU 111 2HD1 LEU 111 2.549 -9.283 3.209 849 HD13 LEU 111 3HD1 LEU 111 1.076 -8.408 3.626 850 HD21 LEU 111 3HD2 LEU 111 1.376 -9.057 6.520 851 HD22 LEU 111 1HD2 LEU 111 1.272 -7.301 6.434 852 HD23 LEU 111 2HD2 LEU 111 2.662 -8.062 7.202 853 H LYS 112 H LYS 112 2.185 -11.706 4.951 854 HA LYS 112 HA LYS 112 3.155 -12.299 2.281 855 HB2 LYS 112 1HB LYS 112 4.210 -14.002 3.834 856 HB3 LYS 112 2HB LYS 112 2.574 -14.585 4.149 857 HG2 LYS 112 1HG LYS 112 2.235 -15.043 1.777 858 HG3 LYS 112 2HG LYS 112 3.812 -14.355 1.390 859 HD2 LYS 112 1HD LYS 112 4.901 -16.098 2.763 860 HD3 LYS 112 2HD LYS 112 3.320 -16.800 3.112 861 HE2 LYS 112 1HE LYS 112 2.955 -17.197 0.711 862 HE3 LYS 112 2HE LYS 112 4.523 -16.473 0.346 863 HZ1 LYS 112 3HZ LYS 112 5.582 -18.187 1.678 864 HZ2 LYS 112 1HZ LYS 112 4.668 -18.879 0.429 865 HZ3 LYS 112 2HZ LYS 112 4.072 -18.885 2.021 866 H LEU 113 H LEU 113 1.353 -11.388 1.416 867 HA LEU 113 HA LEU 113 -1.181 -12.836 1.908 868 HB2 LEU 113 1HB LEU 113 -0.580 -10.025 2.532 869 HB3 LEU 113 2HB LEU 113 -1.987 -10.182 1.496 870 HG LEU 113 HG LEU 113 -2.717 -10.186 3.799 871 HD11 LEU 113 1HD1 LEU 113 -4.230 -11.851 3.572 872 HD12 LEU 113 2HD1 LEU 113 -3.011 -13.103 3.371 873 HD13 LEU 113 3HD1 LEU 113 -3.477 -12.106 2.000 874 HD21 LEU 113 3HD2 LEU 113 -1.398 -12.716 4.611 875 HD22 LEU 113 1HD2 LEU 113 -1.692 -11.245 5.531 876 HD23 LEU 113 2HD2 LEU 113 -0.311 -11.338 4.445 877 H VAL 114 H VAL 114 -2.883 -11.980 0.249 878 HA VAL 114 HA VAL 114 -1.601 -11.800 -2.425 879 HB VAL 114 HB VAL 114 -4.192 -13.194 -1.684 880 HG11 VAL 114 1HG1 VAL 114 -2.648 -12.839 -4.261 881 HG12 VAL 114 2HG1 VAL 114 -4.325 -12.406 -3.932 882 HG13 VAL 114 3HG1 VAL 114 -3.859 -14.103 -4.048 883 HG21 VAL 114 3HG2 VAL 114 -2.174 -14.371 -0.834 884 HG22 VAL 114 1HG2 VAL 114 -1.483 -14.336 -2.456 885 HG23 VAL 114 2HG2 VAL 114 -2.948 -15.268 -2.142 886 H PHE 115 H PHE 115 -2.009 -9.884 -3.329 887 HA PHE 115 HA PHE 115 -4.564 -8.524 -2.791 888 HB2 PHE 115 1HB PHE 115 -1.811 -7.438 -3.344 889 HB3 PHE 115 2HB PHE 115 -3.262 -6.453 -3.533 890 HD1 PHE 115 HD1 PHE 115 -1.222 -8.376 -1.102 891 HD2 PHE 115 HD2 PHE 115 -4.496 -5.645 -1.644 892 HE1 PHE 115 HE1 PHE 115 -1.271 -7.945 1.341 893 HE2 PHE 115 HE2 PHE 115 -4.544 -5.227 0.789 894 HZ PHE 115 HZ PHE 115 -2.935 -6.368 2.288 895 H GLN 116 H GLN 116 -5.836 -7.988 -4.420 896 HA GLN 116 HA GLN 116 -4.920 -8.498 -7.194 897 HB2 GLN 116 1HB GLN 116 -6.641 -10.097 -6.389 898 HB3 GLN 116 2HB GLN 116 -7.723 -8.746 -6.082 899 HG2 GLN 116 1HG GLN 116 -8.265 -9.717 -8.243 900 HG3 GLN 116 2HG GLN 116 -7.564 -8.122 -8.497 901 HE21 GLN 116 2HE2 GLN 116 -5.789 -8.012 -9.851 902 HE22 GLN 116 1HE2 GLN 116 -4.897 -9.354 -10.391 903 H LEU 117 H LEU 117 -4.265 -6.400 -7.660 904 HA LEU 117 HA LEU 117 -6.132 -4.173 -7.254 905 HB2 LEU 117 1HB LEU 117 -3.497 -3.899 -8.670 906 HB3 LEU 117 2HB LEU 117 -4.286 -2.784 -7.570 907 HG LEU 117 HG LEU 117 -2.992 -5.411 -6.788 908 HD11 LEU 117 1HD1 LEU 117 -1.339 -3.983 -5.676 909 HD12 LEU 117 2HD1 LEU 117 -2.170 -2.542 -6.264 910 HD13 LEU 117 3HD1 LEU 117 -1.388 -3.638 -7.405 911 HD21 LEU 117 3HD2 LEU 117 -3.370 -4.316 -4.451 912 HD22 LEU 117 1HD2 LEU 117 -4.751 -5.075 -5.242 913 HD23 LEU 117 2HD2 LEU 117 -4.570 -3.321 -5.275 914 HA PRO 118 HA PRO 118 -7.680 -4.390 -11.407 915 HB2 PRO 118 1HB PRO 118 -8.276 -1.794 -11.979 916 HB3 PRO 118 2HB PRO 118 -9.180 -2.739 -10.777 917 HG2 PRO 118 1HG PRO 118 -6.977 -0.765 -10.356 918 HG3 PRO 118 2HG PRO 118 -8.510 -0.938 -9.481 919 HD2 PRO 118 1HD PRO 118 -6.161 -1.920 -8.508 920 HD3 PRO 118 2HD PRO 118 -7.721 -2.701 -8.173 921 H PHE 119 H PHE 119 -6.844 -4.583 -13.394 922 HA PHE 119 HA PHE 119 -4.374 -4.412 -14.220 923 HB2 PHE 119 1HB PHE 119 -6.228 -5.286 -15.552 924 HB3 PHE 119 2HB PHE 119 -6.730 -3.642 -15.931 925 HD1 PHE 119 HD2 PHE 119 -3.770 -5.922 -16.102 926 HD2 PHE 119 HD1 PHE 119 -5.813 -2.549 -17.803 927 HE1 PHE 119 HE2 PHE 119 -2.133 -5.869 -17.964 928 HE2 PHE 119 HE1 PHE 119 -4.177 -2.494 -19.665 929 HZ PHE 119 HZ PHE 119 -2.336 -4.155 -19.746 930 H GLY 120 H GLY 120 -2.842 -2.985 -14.278 931 HA2 GLY 120 1HA GLY 120 -1.786 -0.918 -14.240 932 HA3 GLY 120 2HA GLY 120 -2.558 -0.809 -15.817 933 H SER 121 H SER 121 -3.828 0.874 -16.144 934 HA SER 121 HA SER 121 -4.959 2.834 -15.716 935 HB2 SER 121 1HB SER 121 -6.168 0.861 -13.782 936 HB3 SER 121 2HB SER 121 -6.759 2.516 -13.891 937 HG SER 121 HG SER 121 -6.965 2.096 -16.199 938 H HIS 122 H HIS 122 -5.635 2.404 -12.443 939 HA HIS 122 HA HIS 122 -3.762 4.519 -11.717 940 HB2 HIS 122 1HB HIS 122 -6.255 4.343 -11.024 941 HB3 HIS 122 2HB HIS 122 -5.697 3.164 -9.843 942 HD2 HIS 122 HD2 HIS 122 -5.059 4.420 -7.475 943 HE1 HIS 122 HE1 HIS 122 -3.942 8.176 -9.050 944 HE2 HIS 122 HE2 HIS 122 -4.234 6.835 -6.912 945 H THR 123 H THR 123 -3.769 1.117 -11.712 946 HA THR 123 HA THR 123 -2.278 0.711 -9.290 947 HB THR 123 HB THR 123 -2.480 -1.199 -11.613 948 HG1 THR 123 HG1 THR 123 -4.367 -1.916 -10.655 949 HG21 THR 123 3HG2 THR 123 -1.938 -2.859 -10.033 950 HG22 THR 123 1HG2 THR 123 -2.396 -1.844 -8.669 951 HG23 THR 123 2HG2 THR 123 -0.902 -1.524 -9.549 952 H ARG 124 H ARG 124 -1.471 1.077 -12.731 953 HA ARG 124 HA ARG 124 1.156 0.191 -12.670 954 HB2 ARG 124 1HB ARG 124 -0.111 0.781 -14.715 955 HB3 ARG 124 2HB ARG 124 0.023 2.485 -14.284 956 HG2 ARG 124 1HG ARG 124 2.506 2.267 -14.326 957 HG3 ARG 124 2HG ARG 124 2.320 0.593 -14.847 958 HD2 ARG 124 1HD ARG 124 1.188 2.975 -16.328 959 HD3 ARG 124 2HD ARG 124 2.712 2.192 -16.735 960 HE ARG 124 HE ARG 124 0.081 1.222 -17.355 961 HH11 ARG 124 1HH2 ARG 124 3.325 0.326 -16.551 962 HH12 ARG 124 2HH2 ARG 124 3.251 -1.201 -17.364 963 HH21 ARG 124 1HH1 ARG 124 -0.023 -0.779 -18.424 964 HH22 ARG 124 2HH1 ARG 124 1.357 -1.827 -18.425 965 H THR 125 H THR 125 -0.140 3.395 -11.936 966 HA THR 125 HA THR 125 2.261 4.775 -11.643 967 HB THR 125 HB THR 125 -0.324 5.120 -10.101 968 HG1 THR 125 HG1 THR 125 -0.677 5.403 -12.255 969 HG21 THR 125 3HG2 THR 125 2.120 6.864 -10.419 970 HG22 THR 125 1HG2 THR 125 1.389 6.287 -8.922 971 HG23 THR 125 2HG2 THR 125 0.557 7.495 -9.901 972 H PHE 126 H PHE 126 0.417 2.874 -9.291 973 HA PHE 126 HA PHE 126 2.001 3.352 -7.036 974 HB2 PHE 126 1HB PHE 126 -0.116 2.230 -6.799 975 HB3 PHE 126 2HB PHE 126 0.419 0.897 -7.818 976 HD1 PHE 126 HD1 PHE 126 1.634 2.755 -4.793 977 HD2 PHE 126 HD2 PHE 126 1.077 -1.051 -6.697 978 HE1 PHE 126 HE1 PHE 126 2.556 1.620 -2.794 979 HE2 PHE 126 HE2 PHE 126 2.003 -2.187 -4.698 980 HZ PHE 126 HZ PHE 126 2.743 -0.850 -2.746 981 H LEU 127 H LEU 127 2.278 0.646 -9.395 982 HA LEU 127 HA LEU 127 4.385 -0.707 -8.295 983 HB2 LEU 127 1HB LEU 127 4.176 -0.123 -11.257 984 HB3 LEU 127 2HB LEU 127 4.906 -1.533 -10.492 985 HG LEU 127 HG LEU 127 1.978 -0.786 -10.381 986 HD11 LEU 127 1HD1 LEU 127 3.414 -3.015 -11.852 987 HD12 LEU 127 2HD1 LEU 127 2.722 -1.576 -12.600 988 HD13 LEU 127 3HD1 LEU 127 1.668 -2.758 -11.823 989 HD21 LEU 127 3HD2 LEU 127 3.616 -3.015 -9.158 990 HD22 LEU 127 1HD2 LEU 127 1.897 -3.235 -9.489 991 HD23 LEU 127 2HD2 LEU 127 2.425 -1.972 -8.380 992 H GLN 128 H GLN 128 4.726 1.969 -10.700 993 HA GLN 128 HA GLN 128 7.485 2.035 -10.711 994 HB2 GLN 128 1HB GLN 128 5.427 4.174 -11.186 995 HB3 GLN 128 2HB GLN 128 7.144 4.356 -11.561 996 HG2 GLN 128 1HG GLN 128 7.080 2.485 -13.085 997 HG3 GLN 128 2HG GLN 128 5.436 2.078 -12.589 998 HE21 GLN 128 2HE2 GLN 128 3.703 3.430 -13.323 999 HE22 GLN 128 1HE2 GLN 128 3.924 4.534 -14.579 1000 H GLU 129 H GLU 129 5.226 3.844 -8.626 1001 HA GLU 129 HA GLU 129 7.141 5.484 -7.387 1002 HB2 GLU 129 1HB GLU 129 4.500 4.429 -6.363 1003 HB3 GLU 129 2HB GLU 129 5.461 5.645 -5.524 1004 HG2 GLU 129 1HG GLU 129 4.460 5.928 -8.370 1005 HG3 GLU 129 2HG GLU 129 3.671 6.635 -6.963 1006 H VAL 130 H VAL 130 6.104 2.191 -6.645 1007 HA VAL 130 HA VAL 130 7.363 1.977 -4.124 1008 HB VAL 130 HB VAL 130 6.695 -0.108 -6.213 1009 HG11 VAL 130 1HG1 VAL 130 8.422 -1.078 -4.869 1010 HG12 VAL 130 2HG1 VAL 130 6.901 -1.682 -4.212 1011 HG13 VAL 130 3HG1 VAL 130 7.759 -0.378 -3.392 1012 HG21 VAL 130 3HG2 VAL 130 5.371 0.466 -3.552 1013 HG22 VAL 130 1HG2 VAL 130 4.745 -0.499 -4.888 1014 HG23 VAL 130 2HG2 VAL 130 4.865 1.254 -5.046 1015 H ALA 131 H ALA 131 8.460 1.166 -7.375 1016 HA ALA 131 HA ALA 131 10.965 0.110 -6.814 1017 HB1 ALA 131 3HB ALA 131 9.919 0.160 -9.065 1018 HB2 ALA 131 1HB ALA 131 11.600 0.690 -9.080 1019 HB3 ALA 131 2HB ALA 131 10.299 1.878 -9.174 1020 H ARG 132 H ARG 132 10.161 3.553 -7.342 1021 HA ARG 132 HA ARG 132 12.884 4.391 -6.867 1022 HB2 ARG 132 1HB ARG 132 10.292 5.910 -7.176 1023 HB3 ARG 132 2HB ARG 132 11.849 6.695 -6.902 1024 HG2 ARG 132 1HG ARG 132 12.763 5.628 -8.917 1025 HG3 ARG 132 2HG ARG 132 11.227 4.806 -9.190 1026 HD2 ARG 132 1HD ARG 132 10.097 6.982 -9.422 1027 HD3 ARG 132 2HD ARG 132 11.626 7.810 -9.141 1028 HE ARG 132 HE ARG 132 11.752 5.938 -11.330 1029 HH11 ARG 132 1HH2 ARG 132 10.842 9.121 -10.321 1030 HH12 ARG 132 2HH2 ARG 132 11.019 9.820 -11.896 1031 HH21 ARG 132 1HH1 ARG 132 11.987 6.846 -13.396 1032 HH22 ARG 132 2HH1 ARG 132 11.669 8.532 -13.638 1033 H ALA 133 H ALA 133 10.053 3.873 -4.961 1034 HA ALA 133 HA ALA 133 10.294 5.516 -2.805 1035 HB1 ALA 133 3HB ALA 133 9.172 3.864 -1.502 1036 HB2 ALA 133 1HB ALA 133 9.778 2.557 -2.516 1037 HB3 ALA 133 2HB ALA 133 8.588 3.692 -3.154 1038 H CYS 134 H CYS 134 12.660 3.246 -3.817 1039 HA CYS 134 HA CYS 134 14.670 4.094 -2.197 1040 HB2 CYS 134 1HB CYS 134 12.815 2.410 -0.640 1041 HB3 CYS 134 2HB CYS 134 14.493 1.891 -0.523 1042 HG CYS 134 HG CYS 134 15.105 4.046 0.632 1043 HA PRO 135 HA PRO 135 15.574 -0.559 -3.557 1044 HB2 PRO 135 1HB PRO 135 13.549 -0.576 -5.770 1045 HB3 PRO 135 2HB PRO 135 14.113 -1.913 -4.745 1046 HG2 PRO 135 1HG PRO 135 11.743 -0.802 -4.329 1047 HG3 PRO 135 2HG PRO 135 12.769 -1.291 -2.967 1048 HD2 PRO 135 1HD PRO 135 12.242 1.468 -4.032 1049 HD3 PRO 135 2HD PRO 135 12.480 0.932 -2.356 1050 H GLY 136 H GLY 136 14.510 2.033 -5.734 1051 HA2 GLY 136 1HA GLY 136 15.396 2.716 -7.814 1052 HA3 GLY 136 2HA GLY 136 16.779 2.973 -6.755 1053 H PHE 137 H PHE 137 15.291 -0.032 -7.853 1054 HA PHE 137 HA PHE 137 16.418 -2.002 -8.455 1055 HB2 PHE 137 1HB PHE 137 16.911 -1.847 -10.878 1056 HB3 PHE 137 2HB PHE 137 15.366 -1.116 -10.449 1057 HD1 PHE 137 HD2 PHE 137 15.278 1.406 -10.066 1058 HD2 PHE 137 HD1 PHE 137 18.602 -0.564 -11.944 1059 HE1 PHE 137 HE2 PHE 137 16.021 3.570 -11.023 1060 HE2 PHE 137 HE1 PHE 137 19.347 1.601 -12.894 1061 HZ PHE 137 HZ PHE 137 18.055 3.667 -12.435 1062 H ASP 138 H ASP 138 18.173 -1.554 -6.770 1063 HA ASP 138 HA ASP 138 20.786 -1.090 -8.081 1064 HB2 ASP 138 1HB ASP 138 19.709 -0.516 -5.365 1065 HB3 ASP 138 2HB ASP 138 21.390 -1.041 -5.430 1066 HA PRO 139 HA PRO 139 21.356 -5.497 -7.514 1067 HB2 PRO 139 1HB PRO 139 24.016 -5.712 -8.079 1068 HB3 PRO 139 2HB PRO 139 22.795 -5.382 -9.326 1069 HG2 PRO 139 1HG PRO 139 24.633 -3.481 -7.934 1070 HG3 PRO 139 2HG PRO 139 24.185 -3.561 -9.649 1071 HD2 PRO 139 1HD PRO 139 23.046 -1.781 -7.891 1072 HD3 PRO 139 2HD PRO 139 22.201 -2.412 -9.322 1073 H GLU 140 H GLU 140 22.745 -3.130 -5.502 1074 HA GLU 140 HA GLU 140 23.585 -5.192 -3.529 1075 HB2 GLU 140 1HB GLU 140 24.877 -2.510 -4.079 1076 HB3 GLU 140 2HB GLU 140 25.348 -3.638 -2.804 1077 HG2 GLU 140 1HG GLU 140 25.262 -4.369 -5.731 1078 HG3 GLU 140 2HG GLU 140 26.728 -3.819 -4.920 1079 H THR 141 H THR 141 21.020 -3.950 -3.805 1080 HA THR 141 HA THR 141 20.688 -1.800 -1.958 1081 HB THR 141 HB THR 141 18.612 -3.845 -2.767 1082 HG1 THR 141 HG1 THR 141 18.273 -2.589 -4.548 1083 HG21 THR 141 3HG2 THR 141 18.305 -0.906 -2.115 1084 HG22 THR 141 1HG2 THR 141 18.115 -2.181 -0.911 1085 HG23 THR 141 2HG2 THR 141 17.028 -2.109 -2.297 1086 H ARG 142 H ARG 142 20.759 -1.844 0.200 1087 HA ARG 142 HA ARG 142 19.522 -3.797 1.812 1088 HB2 ARG 142 1HB ARG 142 21.434 -5.205 1.072 1089 HB3 ARG 142 2HB ARG 142 22.539 -4.015 1.754 1090 HG2 ARG 142 1HG ARG 142 21.610 -4.367 3.982 1091 HG3 ARG 142 2HG ARG 142 20.395 -5.466 3.331 1092 HD2 ARG 142 1HD ARG 142 22.161 -7.009 2.595 1093 HD3 ARG 142 2HD ARG 142 23.391 -5.902 3.198 1094 HE ARG 142 HE ARG 142 22.895 -6.589 5.380 1095 HH11 ARG 142 1HH2 ARG 142 20.582 -7.765 3.092 1096 HH12 ARG 142 2HH2 ARG 142 19.834 -8.864 4.203 1097 HH21 ARG 142 1HH1 ARG 142 21.918 -8.027 6.844 1098 HH22 ARG 142 2HH1 ARG 142 20.591 -9.011 6.327 1099 H ASP 143 H ASP 143 18.828 -1.663 2.512 1100 HA ASP 143 HA ASP 143 20.333 -0.780 4.816 1101 HB2 ASP 143 1HB ASP 143 20.384 1.623 4.028 1102 HB3 ASP 143 2HB ASP 143 21.527 0.545 3.227 1103 HA PRO 144 HA PRO 144 15.672 -0.371 4.898 1104 HB2 PRO 144 1HB PRO 144 16.115 -1.649 7.555 1105 HB3 PRO 144 2HB PRO 144 14.924 -2.046 6.300 1106 HG2 PRO 144 1HG PRO 144 17.020 -3.614 6.736 1107 HG3 PRO 144 2HG PRO 144 16.437 -3.308 5.088 1108 HD2 PRO 144 1HD PRO 144 18.806 -2.089 6.496 1109 HD3 PRO 144 2HD PRO 144 18.672 -2.669 4.819 1110 H GLU 145 H GLU 145 14.486 1.110 6.053 1111 HA GLU 145 HA GLU 145 15.715 2.547 8.299 1112 HB2 GLU 145 1HB GLU 145 15.130 4.749 7.217 1113 HB3 GLU 145 2HB GLU 145 16.471 3.894 6.457 1114 HG2 GLU 145 1HG GLU 145 14.918 2.996 4.750 1115 HG3 GLU 145 2HG GLU 145 13.596 3.891 5.496 1116 H PHE 146 H PHE 146 14.253 2.918 9.832 1117 HA PHE 146 HA PHE 146 11.466 3.414 9.174 1118 HB2 PHE 146 1HB PHE 146 10.868 1.470 10.857 1119 HB3 PHE 146 2HB PHE 146 11.170 1.106 9.158 1120 HD1 PHE 146 HD2 PHE 146 13.025 1.500 12.392 1121 HD2 PHE 146 HD1 PHE 146 12.759 -0.556 8.623 1122 HE1 PHE 146 HE2 PHE 146 14.909 0.033 13.054 1123 HE2 PHE 146 HE1 PHE 146 14.634 -2.023 9.298 1124 HZ PHE 146 HZ PHE 146 15.715 -1.729 11.505 1125 H GLU 147 H GLU 147 14.117 4.006 10.953 1126 HA GLU 147 HA GLU 147 13.300 4.229 13.610 1127 HB2 GLU 147 1HB GLU 147 15.626 4.459 12.802 1128 HB3 GLU 147 2HB GLU 147 15.213 6.028 12.115 1129 HG2 GLU 147 1HG GLU 147 14.661 6.897 14.322 1130 HG3 GLU 147 2HG GLU 147 14.929 5.313 15.046 1131 H TRP 148 H TRP 148 12.347 6.159 10.900 1132 HA TRP 148 HA TRP 148 11.488 8.406 12.571 1133 HB2 TRP 148 1HB TRP 148 10.827 9.463 10.461 1134 HB3 TRP 148 2HB TRP 148 12.501 8.916 10.410 1135 HD1 TRP 148 HD1 TRP 148 12.854 6.414 9.219 1136 HE1 TRP 148 HE1 TRP 148 11.683 5.479 7.124 1137 HE3 TRP 148 HE3 TRP 148 8.787 9.495 9.038 1138 HZ2 TRP 148 HZ2 TRP 148 9.333 5.977 5.570 1139 HZ3 TRP 148 HZ3 TRP 148 7.102 9.248 7.238 1140 HH2 TRP 148 HH2 TRP 148 7.367 7.495 5.504 1141 H LEU 149 H LEU 149 10.170 5.481 11.392 1142 HA LEU 149 HA LEU 149 7.449 6.252 11.122 1143 HB2 LEU 149 1HB LEU 149 8.853 3.643 11.607 1144 HB3 LEU 149 2HB LEU 149 7.105 3.720 11.783 1145 HG LEU 149 HG LEU 149 6.804 4.388 9.513 1146 HD11 LEU 149 1HD1 LEU 149 8.950 4.647 8.052 1147 HD12 LEU 149 2HD1 LEU 149 9.767 4.931 9.588 1148 HD13 LEU 149 3HD1 LEU 149 8.456 5.989 9.076 1149 HD21 LEU 149 3HD2 LEU 149 7.529 2.459 8.394 1150 HD22 LEU 149 1HD2 LEU 149 7.583 1.951 10.082 1151 HD23 LEU 149 2HD2 LEU 149 9.068 2.415 9.257 1152 H SER 150 H SER 150 9.425 5.345 13.910 1153 HA SER 150 HA SER 150 7.556 4.848 15.844 1154 HB2 SER 150 1HB SER 150 9.136 5.842 17.449 1155 HB3 SER 150 2HB SER 150 9.985 4.862 16.256 1156 HG SER 150 HG SER 150 10.934 6.598 15.540 1157 H ARG 151 H ARG 151 8.152 7.831 14.158 1158 HA ARG 151 HA ARG 151 6.987 9.675 15.935 1159 HB2 ARG 151 1HB ARG 151 6.830 11.133 14.054 1160 HB3 ARG 151 2HB ARG 151 8.244 10.132 13.739 1161 HG2 ARG 151 1HG ARG 151 6.719 8.593 12.398 1162 HG3 ARG 151 2HG ARG 151 5.473 9.828 12.545 1163 HD2 ARG 151 1HD ARG 151 8.214 10.301 11.356 1164 HD3 ARG 151 2HD ARG 151 6.747 10.020 10.422 1165 HE ARG 151 HE ARG 151 7.507 12.473 11.692 1166 HH11 ARG 151 1HH2 ARG 151 4.834 10.436 10.857 1167 HH12 ARG 151 2HH2 ARG 151 3.697 11.739 10.758 1168 HH21 ARG 151 1HH1 ARG 151 6.022 14.181 11.570 1169 HH22 ARG 151 2HH1 ARG 151 4.370 13.860 11.160 1170 H HIS 152 H HIS 152 5.647 7.574 13.463 1171 HA HIS 152 HA HIS 152 2.939 8.442 13.792 1172 HB2 HIS 152 1HB HIS 152 4.204 6.058 12.428 1173 HB3 HIS 152 2HB HIS 152 2.465 6.348 12.437 1174 HD2 HIS 152 HD2 HIS 152 5.606 7.562 10.535 1175 HE1 HIS 152 HE1 HIS 152 2.430 10.091 9.385 1176 HE2 HIS 152 HE2 HIS 152 4.826 9.422 8.878 1177 H THR 153 H THR 153 1.314 7.476 14.915 1178 HA THR 153 HA THR 153 2.047 5.295 16.797 1179 HB THR 153 HB THR 153 1.779 7.325 18.079 1180 HG1 THR 153 HG1 THR 153 -0.286 5.436 18.118 1181 HG21 THR 153 3HG2 THR 153 -0.991 7.631 16.913 1182 HG22 THR 153 1HG2 THR 153 0.408 8.478 16.252 1183 HG23 THR 153 2HG2 THR 153 -0.100 8.779 17.912 1184 H CYS 154 H CYS 154 0.287 6.227 14.195 1185 HA CYS 154 HA CYS 154 -1.498 5.356 13.050 1186 HB2 CYS 154 1HB CYS 154 -1.254 2.898 14.772 1187 HB3 CYS 154 2HB CYS 154 -1.701 3.017 13.070 1188 HG CYS 154 HG CYS 154 0.905 2.283 13.525 1189 H ALA 155 H ALA 155 -3.754 4.812 13.207 1190 HA ALA 155 HA ALA 155 -5.184 6.195 15.108 1191 HB1 ALA 155 3HB ALA 155 -6.040 3.719 13.590 1192 HB2 ALA 155 1HB ALA 155 -6.191 5.387 13.037 1193 HB3 ALA 155 2HB ALA 155 -7.133 4.827 14.418 1194 H GLU 156 H GLU 156 -6.677 5.342 16.786 1195 HA GLU 156 HA GLU 156 -5.248 3.879 18.741 1196 HB2 GLU 156 1HB GLU 156 -8.212 4.469 18.651 1197 HB3 GLU 156 2HB GLU 156 -7.274 4.034 20.080 1198 HG2 GLU 156 1HG GLU 156 -5.841 6.072 19.647 1199 HG3 GLU 156 2HG GLU 156 -7.001 6.541 18.405 1200 HA PRO 157 HA PRO 157 -6.498 -0.161 17.142 1201 HB2 PRO 157 1HB PRO 157 -5.246 -1.758 18.928 1202 HB3 PRO 157 2HB PRO 157 -4.340 -0.817 17.725 1203 HG2 PRO 157 1HG PRO 157 -4.832 -0.208 20.611 1204 HG3 PRO 157 2HG PRO 157 -3.329 -0.078 19.678 1205 HD2 PRO 157 1HD PRO 157 -4.952 2.080 20.208 1206 HD3 PRO 157 2HD PRO 157 -3.913 1.974 18.767 1207 H ASP 158 H ASP 158 -8.384 1.285 18.717 1208 HA ASP 158 HA ASP 158 -9.419 -0.603 20.703 1209 HB2 ASP 158 1HB ASP 158 -10.275 2.180 19.893 1210 HB3 ASP 158 2HB ASP 158 -11.106 1.209 21.108 1211 H ALA 159 H ALA 159 -9.433 -0.780 17.623 1212 HA ALA 159 HA ALA 159 -12.113 -0.704 16.738 1213 HB1 ALA 159 3HB ALA 159 -10.339 -0.799 15.118 1214 HB2 ALA 159 1HB ALA 159 -11.297 -2.270 14.944 1215 HB3 ALA 159 2HB ALA 159 -9.744 -2.322 15.779 1216 H GLU 160 H GLU 160 -10.195 -3.264 18.253 1217 HA GLU 160 HA GLU 160 -10.779 -5.342 19.059 1218 HB2 GLU 160 1HB GLU 160 -13.338 -3.815 19.593 1219 HB3 GLU 160 2HB GLU 160 -12.955 -5.393 20.278 1220 HG2 GLU 160 1HG GLU 160 -11.247 -2.913 20.633 1221 HG3 GLU 160 2HG GLU 160 -12.409 -3.500 21.820 1222 H SER 161 H SER 161 -11.182 -4.926 16.216 1223 HA SER 161 HA SER 161 -13.675 -6.041 15.395 1224 HB2 SER 161 1HB SER 161 -12.464 -6.392 13.215 1225 HB3 SER 161 2HB SER 161 -12.412 -4.737 13.818 1226 HG SER 161 HG SER 161 -10.330 -4.963 13.705 Start of MODEL 2 1 H1 GLY 1 1H GLY 1 -15.451 8.550 -16.525 2 H2 GLY 1 2H GLY 1 -16.493 8.165 -15.239 3 H3 GLY 1 3H GLY 1 -14.831 7.825 -15.124 4 HA2 GLY 1 1HA GLY 1 -14.283 9.908 -14.550 5 HA3 GLY 1 2HA GLY 1 -15.482 10.599 -15.645 6 HA PRO 2 HA PRO 2 -18.252 11.342 -12.321 7 HB2 PRO 2 1HB PRO 2 -20.694 10.519 -13.310 8 HB3 PRO 2 2HB PRO 2 -19.873 12.005 -13.829 9 HG2 PRO 2 1HG PRO 2 -19.954 9.330 -15.160 10 HG3 PRO 2 2HG PRO 2 -20.086 10.949 -15.875 11 HD2 PRO 2 1HD PRO 2 -17.771 9.524 -15.962 12 HD3 PRO 2 2HD PRO 2 -17.780 11.298 -15.841 13 H LEU 3 H LEU 3 -18.046 8.113 -13.570 14 HA LEU 3 HA LEU 3 -19.585 6.860 -11.476 15 HB2 LEU 3 1HB LEU 3 -17.621 5.665 -13.448 16 HB3 LEU 3 2HB LEU 3 -18.745 4.760 -12.434 17 HG LEU 3 HG LEU 3 -19.542 6.809 -14.528 18 HD11 LEU 3 1HD1 LEU 3 -20.212 4.948 -15.892 19 HD12 LEU 3 2HD1 LEU 3 -19.903 3.801 -14.587 20 HD13 LEU 3 3HD1 LEU 3 -18.556 4.629 -15.371 21 HD21 LEU 3 3HD2 LEU 3 -21.320 6.828 -13.003 22 HD22 LEU 3 1HD2 LEU 3 -21.071 5.148 -12.527 23 HD23 LEU 3 2HD2 LEU 3 -21.818 5.527 -14.080 24 H GLY 4 H GLY 4 -18.690 5.403 -9.876 25 HA2 GLY 4 1HA GLY 4 -17.254 4.865 -8.167 26 HA3 GLY 4 2HA GLY 4 -15.941 5.212 -9.288 27 H SER 5 H SER 5 -15.126 5.915 -7.016 28 HA SER 5 HA SER 5 -16.036 8.520 -6.123 29 HB2 SER 5 1HB SER 5 -14.070 8.295 -4.548 30 HB3 SER 5 2HB SER 5 -15.287 7.032 -4.411 31 HG SER 5 HG SER 5 -12.693 6.944 -5.457 32 H MET 6 H MET 6 -14.265 10.223 -5.739 33 HA MET 6 HA MET 6 -13.286 11.078 -8.254 34 HB2 MET 6 1HB MET 6 -12.392 11.988 -5.509 35 HB3 MET 6 2HB MET 6 -12.186 12.870 -7.021 36 HG2 MET 6 1HG MET 6 -14.116 13.862 -6.137 37 HG3 MET 6 2HG MET 6 -14.801 12.638 -7.204 38 HE1 MET 6 3HE MET 6 -14.926 14.056 -3.603 39 HE2 MET 6 1HE MET 6 -13.328 13.331 -3.832 40 HE3 MET 6 2HE MET 6 -14.448 12.650 -2.654 41 H ASP 7 H ASP 7 -11.593 9.770 -5.420 42 HA ASP 7 HA ASP 7 -9.772 8.200 -6.853 43 HB2 ASP 7 1HB ASP 7 -7.689 9.581 -6.429 44 HB3 ASP 7 2HB ASP 7 -8.729 10.154 -7.727 45 H GLN 8 H GLN 8 -7.738 7.752 -5.428 46 HA GLN 8 HA GLN 8 -8.721 7.315 -2.667 47 HB2 GLN 8 1HB GLN 8 -6.348 6.025 -3.989 48 HB3 GLN 8 2HB GLN 8 -7.179 5.496 -2.538 49 HG2 GLN 8 1HG GLN 8 -8.338 5.544 -5.337 50 HG3 GLN 8 2HG GLN 8 -7.812 4.106 -4.463 51 HE21 GLN 8 2HE2 GLN 8 -10.534 4.718 -5.438 52 HE22 GLN 8 1HE2 GLN 8 -11.539 4.722 -4.067 53 H SER 9 H SER 9 -6.179 8.766 -4.568 54 HA SER 9 HA SER 9 -4.181 9.158 -2.691 55 HB2 SER 9 1HB SER 9 -3.712 9.824 -4.910 56 HB3 SER 9 2HB SER 9 -5.112 10.894 -4.974 57 HG SER 9 HG SER 9 -4.011 12.044 -3.192 58 H VAL 10 H VAL 10 -7.021 11.272 -3.289 59 HA VAL 10 HA VAL 10 -6.367 13.193 -1.343 60 HB VAL 10 HB VAL 10 -8.733 13.820 -1.464 61 HG11 VAL 10 1HG1 VAL 10 -8.890 13.913 -4.036 62 HG12 VAL 10 2HG1 VAL 10 -7.355 13.047 -4.038 63 HG13 VAL 10 3HG1 VAL 10 -7.466 14.642 -3.294 64 HG21 VAL 10 3HG2 VAL 10 -8.972 11.090 -2.736 65 HG22 VAL 10 1HG2 VAL 10 -10.157 12.353 -3.072 66 HG23 VAL 10 2HG2 VAL 10 -9.929 11.779 -1.424 67 H ALA 11 H ALA 11 -8.436 10.335 -1.171 68 HA ALA 11 HA ALA 11 -9.418 10.424 1.358 69 HB1 ALA 11 3HB ALA 11 -9.520 8.024 1.353 70 HB2 ALA 11 1HB ALA 11 -8.194 7.915 0.198 71 HB3 ALA 11 2HB ALA 11 -9.754 8.563 -0.309 72 H ILE 12 H ILE 12 -6.188 9.191 0.474 73 HA ILE 12 HA ILE 12 -5.378 8.598 3.099 74 HB ILE 12 HB ILE 12 -3.634 9.448 0.781 75 HG12 ILE 12 1HG1 ILE 12 -5.085 7.621 0.080 76 HG13 ILE 12 2HG1 ILE 12 -3.461 6.994 0.336 77 HG21 ILE 12 1HG2 ILE 12 -2.048 7.806 2.007 78 HG22 ILE 12 2HG2 ILE 12 -3.121 8.023 3.389 79 HG23 ILE 12 3HG2 ILE 12 -2.274 9.409 2.704 80 HD11 ILE 12 3HD1 ILE 12 -4.332 6.459 2.757 81 HD12 ILE 12 1HD1 ILE 12 -4.780 5.398 1.424 82 HD13 ILE 12 2HD1 ILE 12 -5.924 6.601 2.016 83 H GLN 13 H GLN 13 -4.781 11.424 1.091 84 HA GLN 13 HA GLN 13 -3.244 12.931 2.811 85 HB2 GLN 13 1HB GLN 13 -4.378 13.403 0.359 86 HB3 GLN 13 2HB GLN 13 -5.293 14.527 1.358 87 HG2 GLN 13 1HG GLN 13 -3.413 15.779 0.682 88 HG3 GLN 13 2HG GLN 13 -2.993 15.245 2.306 89 HE21 GLN 13 2HE2 GLN 13 -0.818 14.597 2.348 90 HE22 GLN 13 1HE2 GLN 13 -0.049 13.733 1.106 91 H GLU 14 H GLU 14 -6.845 12.977 2.638 92 HA GLU 14 HA GLU 14 -7.203 14.770 4.771 93 HB2 GLU 14 1HB GLU 14 -8.978 12.578 3.677 94 HB3 GLU 14 2HB GLU 14 -9.506 13.769 4.867 95 HG2 GLU 14 1HG GLU 14 -9.026 15.590 3.318 96 HG3 GLU 14 2HG GLU 14 -8.368 14.454 2.142 97 H THR 15 H THR 15 -6.206 11.514 4.730 98 HA THR 15 HA THR 15 -6.822 11.160 7.616 99 HB THR 15 HB THR 15 -6.657 8.776 7.244 100 HG1 THR 15 HG1 THR 15 -5.195 9.512 5.218 101 HG21 THR 15 3HG2 THR 15 -8.410 8.561 5.321 102 HG22 THR 15 1HG2 THR 15 -8.404 10.323 5.336 103 HG23 THR 15 2HG2 THR 15 -8.860 9.431 6.786 104 H LEU 16 H LEU 16 -4.431 12.525 6.179 105 HA LEU 16 HA LEU 16 -2.260 10.821 7.236 106 HB2 LEU 16 1HB LEU 16 -2.295 11.779 4.822 107 HB3 LEU 16 2HB LEU 16 -1.896 13.316 5.582 108 HG LEU 16 HG LEU 16 0.102 12.227 6.637 109 HD11 LEU 16 1HD1 LEU 16 0.693 9.986 5.254 110 HD12 LEU 16 2HD1 LEU 16 -1.064 9.834 5.265 111 HD13 LEU 16 3HD1 LEU 16 -0.178 9.940 6.785 112 HD21 LEU 16 3HD2 LEU 16 1.330 11.911 4.402 113 HD22 LEU 16 1HD2 LEU 16 0.508 13.456 4.629 114 HD23 LEU 16 2HD2 LEU 16 -0.225 12.203 3.628 115 H VAL 17 H VAL 17 -0.868 13.685 7.033 116 HA VAL 17 HA VAL 17 -1.872 15.067 9.330 117 HB VAL 17 HB VAL 17 -0.647 13.074 10.334 118 HG11 VAL 17 1HG1 VAL 17 1.205 13.185 8.582 119 HG12 VAL 17 2HG1 VAL 17 1.740 13.011 10.252 120 HG13 VAL 17 3HG1 VAL 17 1.825 14.585 9.459 121 HG21 VAL 17 3HG2 VAL 17 -1.063 15.052 11.667 122 HG22 VAL 17 1HG2 VAL 17 0.280 15.905 10.903 123 HG23 VAL 17 2HG2 VAL 17 0.596 14.537 11.969 124 H GLU 18 H GLU 18 -1.106 17.182 9.351 125 HA GLU 18 HA GLU 18 0.053 18.199 7.031 126 HB2 GLU 18 1HB GLU 18 -0.138 19.362 9.814 127 HB3 GLU 18 2HB GLU 18 0.361 20.279 8.392 128 HG2 GLU 18 1HG GLU 18 -1.773 19.816 7.300 129 HG3 GLU 18 2HG GLU 18 -2.272 18.800 8.651 130 H GLY 19 H GLY 19 2.018 17.655 6.328 131 HA2 GLY 19 1HA GLY 19 4.382 18.620 6.912 132 HA3 GLY 19 2HA GLY 19 4.275 17.453 8.225 133 H GLU 20 H GLU 20 2.750 15.572 6.421 134 HA GLU 20 HA GLU 20 5.125 14.394 5.147 135 HB2 GLU 20 1HB GLU 20 2.441 13.278 5.936 136 HB3 GLU 20 2HB GLU 20 3.568 12.383 4.914 137 HG2 GLU 20 1HG GLU 20 5.289 12.500 6.631 138 HG3 GLU 20 2HG GLU 20 4.254 13.510 7.644 139 H TYR 21 H TYR 21 4.306 12.904 3.213 140 HA TYR 21 HA TYR 21 2.734 14.514 1.296 141 HB2 TYR 21 1HB TYR 21 5.183 15.070 1.115 142 HB3 TYR 21 2HB TYR 21 5.462 13.384 0.682 143 HD1 TYR 21 HD2 TYR 21 3.515 16.414 -0.325 144 HD2 TYR 21 HD1 TYR 21 5.193 12.652 -1.530 145 HE1 TYR 21 HE2 TYR 21 2.951 16.919 -2.687 146 HE2 TYR 21 HE1 TYR 21 4.630 13.153 -3.892 147 HH TYR 21 HH TYR 21 2.931 14.617 -5.104 148 H CYS 22 H CYS 22 1.327 13.297 0.255 149 HA CYS 22 HA CYS 22 1.688 10.372 0.193 150 HB2 CYS 22 1HB CYS 22 -0.544 11.590 0.819 151 HB3 CYS 22 2HB CYS 22 -0.699 11.840 -0.920 152 HG CYS 22 HG CYS 22 -1.024 9.164 0.525 153 H VAL 23 H VAL 23 1.933 9.276 -1.803 154 HA VAL 23 HA VAL 23 2.575 11.019 -4.112 155 HB VAL 23 HB VAL 23 3.554 8.224 -3.513 156 HG11 VAL 23 1HG1 VAL 23 4.447 10.312 -5.522 157 HG12 VAL 23 2HG1 VAL 23 3.554 8.842 -5.905 158 HG13 VAL 23 3HG1 VAL 23 5.199 8.736 -5.278 159 HG21 VAL 23 3HG2 VAL 23 4.456 9.694 -1.834 160 HG22 VAL 23 1HG2 VAL 23 4.800 10.937 -3.037 161 HG23 VAL 23 2HG2 VAL 23 5.718 9.433 -3.039 162 H ILE 24 H ILE 24 1.217 7.855 -3.225 163 HA ILE 24 HA ILE 24 -0.854 8.017 -5.184 164 HB ILE 24 HB ILE 24 0.940 7.593 -6.740 165 HG12 ILE 24 1HG1 ILE 24 0.264 5.405 -7.690 166 HG13 ILE 24 2HG1 ILE 24 -0.591 5.017 -6.202 167 HG21 ILE 24 1HG2 ILE 24 1.671 5.345 -4.853 168 HG22 ILE 24 2HG2 ILE 24 2.646 6.745 -5.283 169 HG23 ILE 24 3HG2 ILE 24 2.324 5.494 -6.483 170 HD11 ILE 24 3HD1 ILE 24 -2.207 6.711 -6.561 171 HD12 ILE 24 1HD1 ILE 24 -1.969 6.002 -8.155 172 HD13 ILE 24 2HD1 ILE 24 -1.203 7.538 -7.750 173 H ALA 25 H ALA 25 -2.433 6.510 -4.822 174 HA ALA 25 HA ALA 25 -1.874 4.190 -3.144 175 HB1 ALA 25 3HB ALA 25 -3.965 6.240 -2.384 176 HB2 ALA 25 1HB ALA 25 -2.430 6.007 -1.548 177 HB3 ALA 25 2HB ALA 25 -3.636 4.722 -1.547 178 H VAL 26 H VAL 26 -2.836 2.492 -4.076 179 HA VAL 26 HA VAL 26 -5.372 2.960 -5.555 180 HB VAL 26 HB VAL 26 -4.638 1.177 -7.088 181 HG11 VAL 26 1HG1 VAL 26 -3.281 3.798 -6.797 182 HG12 VAL 26 2HG1 VAL 26 -4.039 3.073 -8.215 183 HG13 VAL 26 3HG1 VAL 26 -2.392 2.642 -7.786 184 HG21 VAL 26 3HG2 VAL 26 -2.273 1.145 -5.215 185 HG22 VAL 26 1HG2 VAL 26 -2.027 0.733 -6.915 186 HG23 VAL 26 2HG2 VAL 26 -3.148 -0.204 -5.936 187 H GLN 27 H GLN 27 -6.975 2.101 -4.492 188 HA GLN 27 HA GLN 27 -6.777 0.178 -2.485 189 HB2 GLN 27 1HB GLN 27 -8.715 1.771 -2.999 190 HB3 GLN 27 2HB GLN 27 -9.220 0.592 -4.208 191 HG2 GLN 27 1HG GLN 27 -9.447 -1.133 -2.523 192 HG3 GLN 27 2HG GLN 27 -8.761 -0.077 -1.297 193 HE21 GLN 27 2HE2 GLN 27 -11.287 -1.151 -0.830 194 HE22 GLN 27 1HE2 GLN 27 -12.449 0.075 -0.947 195 H GLY 28 H GLY 28 -7.637 -1.978 -2.466 196 HA2 GLY 28 1HA GLY 28 -7.723 -3.418 -5.024 197 HA3 GLY 28 2HA GLY 28 -6.441 -3.869 -3.905 198 H VAL 29 H VAL 29 -7.404 -5.936 -3.934 199 HA VAL 29 HA VAL 29 -9.553 -6.214 -1.928 200 HB VAL 29 HB VAL 29 -9.424 -7.979 -4.373 201 HG11 VAL 29 1HG1 VAL 29 -11.790 -8.420 -3.690 202 HG12 VAL 29 2HG1 VAL 29 -11.517 -7.429 -2.258 203 HG13 VAL 29 3HG1 VAL 29 -10.607 -8.923 -2.484 204 HG21 VAL 29 3HG2 VAL 29 -11.031 -5.447 -3.934 205 HG22 VAL 29 1HG2 VAL 29 -11.392 -6.634 -5.188 206 HG23 VAL 29 2HG2 VAL 29 -9.864 -5.754 -5.221 207 H LEU 30 H LEU 30 -9.555 -8.348 -0.962 208 HA LEU 30 HA LEU 30 -7.108 -9.939 -1.257 209 HB2 LEU 30 1HB LEU 30 -6.783 -8.167 0.580 210 HB3 LEU 30 2HB LEU 30 -8.038 -9.010 1.481 211 HG LEU 30 HG LEU 30 -5.755 -10.660 0.412 212 HD11 LEU 30 1HD1 LEU 30 -5.544 -8.651 2.651 213 HD12 LEU 30 2HD1 LEU 30 -4.413 -8.959 1.332 214 HD13 LEU 30 3HD1 LEU 30 -4.567 -10.117 2.649 215 HD21 LEU 30 3HD2 LEU 30 -7.583 -11.766 1.616 216 HD22 LEU 30 1HD2 LEU 30 -7.377 -10.671 2.982 217 HD23 LEU 30 2HD2 LEU 30 -6.116 -11.836 2.582 218 H CYS 31 H CYS 31 -7.833 -12.022 -1.457 219 HA CYS 31 HA CYS 31 -10.512 -12.645 -0.375 220 HB2 CYS 31 1HB CYS 31 -10.352 -12.976 -2.748 221 HB3 CYS 31 2HB CYS 31 -8.848 -13.878 -2.576 222 HG CYS 31 HG CYS 31 -10.122 -15.887 -1.689 223 H LYS 32 H LYS 32 -10.766 -14.104 1.164 224 HA LYS 32 HA LYS 32 -8.492 -15.872 1.885 225 HB2 LYS 32 1HB LYS 32 -8.968 -13.983 3.550 226 HB3 LYS 32 2HB LYS 32 -10.505 -14.786 3.862 227 HG2 LYS 32 1HG LYS 32 -9.172 -15.785 5.496 228 HG3 LYS 32 2HG LYS 32 -8.980 -16.933 4.174 229 HD2 LYS 32 1HD LYS 32 -6.747 -16.593 4.731 230 HD3 LYS 32 2HD LYS 32 -6.946 -15.328 3.522 231 HE2 LYS 32 1HE LYS 32 -7.399 -13.684 5.301 232 HE3 LYS 32 2HE LYS 32 -7.228 -14.948 6.519 233 HZ1 LYS 32 3HZ LYS 32 -5.190 -13.651 6.239 234 HZ2 LYS 32 1HZ LYS 32 -5.107 -14.115 4.610 235 HZ3 LYS 32 2HZ LYS 32 -4.951 -15.284 5.834 236 H GLY 33 H GLY 33 -9.014 -17.931 1.502 237 HA2 GLY 33 1HA GLY 33 -10.264 -19.835 1.188 238 HA3 GLY 33 2HA GLY 33 -11.242 -19.248 2.530 239 H ASP 34 H ASP 34 -13.229 -18.436 2.145 240 HA ASP 34 HA ASP 34 -14.079 -17.988 -0.659 241 HB2 ASP 34 1HB ASP 34 -15.460 -19.595 1.497 242 HB3 ASP 34 2HB ASP 34 -16.312 -18.967 0.087 243 H SER 35 H SER 35 -13.212 -16.219 1.551 244 HA SER 35 HA SER 35 -15.680 -14.575 1.791 245 HB2 SER 35 1HB SER 35 -14.988 -15.577 3.976 246 HB3 SER 35 2HB SER 35 -13.427 -14.775 3.812 247 HG SER 35 HG SER 35 -15.376 -13.731 4.972 248 H ARG 36 H ARG 36 -15.440 -12.785 0.578 249 HA ARG 36 HA ARG 36 -12.789 -11.910 -0.210 250 HB2 ARG 36 1HB ARG 36 -14.967 -11.974 -1.658 251 HB3 ARG 36 2HB ARG 36 -15.345 -10.452 -0.857 252 HG2 ARG 36 1HG ARG 36 -14.172 -9.661 -2.707 253 HG3 ARG 36 2HG ARG 36 -12.851 -9.827 -1.552 254 HD2 ARG 36 1HD ARG 36 -12.093 -10.870 -3.565 255 HD3 ARG 36 2HD ARG 36 -12.522 -12.186 -2.478 256 HE ARG 36 HE ARG 36 -14.738 -11.449 -4.123 257 HH11 ARG 36 1HH2 ARG 36 -11.705 -13.114 -4.066 258 HH12 ARG 36 2HH2 ARG 36 -12.128 -14.217 -5.332 259 HH21 ARG 36 1HH1 ARG 36 -15.301 -12.895 -5.786 260 HH22 ARG 36 2HH1 ARG 36 -14.163 -14.093 -6.306 261 H GLN 37 H GLN 37 -11.785 -10.059 0.354 262 HA GLN 37 HA GLN 37 -13.061 -8.350 2.416 263 HB2 GLN 37 1HB GLN 37 -10.215 -9.392 2.369 264 HB3 GLN 37 2HB GLN 37 -10.849 -8.215 3.520 265 HG2 GLN 37 1HG GLN 37 -12.395 -9.807 4.431 266 HG3 GLN 37 2HG GLN 37 -12.074 -10.953 3.128 267 HE21 GLN 37 2HE2 GLN 37 -10.019 -12.105 3.155 268 HE22 GLN 37 1HE2 GLN 37 -9.078 -12.184 4.562 269 H SER 38 H SER 38 -12.488 -6.203 2.363 270 HA SER 38 HA SER 38 -10.997 -5.291 -0.048 271 HB2 SER 38 1HB SER 38 -13.245 -3.801 1.317 272 HB3 SER 38 2HB SER 38 -12.450 -3.396 -0.202 273 HG SER 38 HG SER 38 -14.025 -4.546 -1.006 274 H ARG 39 H ARG 39 -9.278 -4.103 0.302 275 HA ARG 39 HA ARG 39 -8.980 -2.638 2.853 276 HB2 ARG 39 1HB ARG 39 -7.031 -4.550 1.588 277 HB3 ARG 39 2HB ARG 39 -6.534 -3.343 2.772 278 HG2 ARG 39 1HG ARG 39 -8.114 -4.273 4.407 279 HG3 ARG 39 2HG ARG 39 -8.668 -5.454 3.222 280 HD2 ARG 39 1HD ARG 39 -6.438 -6.454 3.127 281 HD3 ARG 39 2HD ARG 39 -5.817 -5.227 4.226 282 HE ARG 39 HE ARG 39 -6.859 -6.333 6.007 283 HH11 ARG 39 1HH2 ARG 39 -7.800 -7.636 2.942 284 HH12 ARG 39 2HH2 ARG 39 -8.574 -9.030 3.619 285 HH21 ARG 39 1HH1 ARG 39 -7.870 -8.154 6.899 286 HH22 ARG 39 2HH1 ARG 39 -8.612 -9.325 5.860 287 H LEU 40 H LEU 40 -7.402 -0.968 2.784 288 HA LEU 40 HA LEU 40 -6.951 0.167 0.071 289 HB2 LEU 40 1HB LEU 40 -8.635 1.464 1.291 290 HB3 LEU 40 2HB LEU 40 -7.539 1.647 2.651 291 HG LEU 40 HG LEU 40 -5.937 2.847 1.138 292 HD11 LEU 40 1HD1 LEU 40 -8.204 2.403 -0.808 293 HD12 LEU 40 2HD1 LEU 40 -6.481 2.111 -1.048 294 HD13 LEU 40 3HD1 LEU 40 -7.094 3.758 -0.994 295 HD21 LEU 40 3HD2 LEU 40 -7.326 4.918 0.995 296 HD22 LEU 40 1HD2 LEU 40 -7.449 4.114 2.560 297 HD23 LEU 40 2HD2 LEU 40 -8.747 3.948 1.379 298 H LEU 41 H LEU 41 -4.842 0.414 -0.486 299 HA LEU 41 HA LEU 41 -2.875 0.929 1.656 300 HB2 LEU 41 1HB LEU 41 -1.454 -0.811 0.102 301 HB3 LEU 41 2HB LEU 41 -2.327 -1.296 1.549 302 HG LEU 41 HG LEU 41 -4.302 -1.873 0.151 303 HD11 LEU 41 1HD1 LEU 41 -3.723 -2.087 -2.376 304 HD12 LEU 41 2HD1 LEU 41 -2.440 -0.928 -2.039 305 HD13 LEU 41 3HD1 LEU 41 -4.123 -0.484 -1.768 306 HD21 LEU 41 3HD2 LEU 41 -1.617 -3.124 -0.456 307 HD22 LEU 41 1HD2 LEU 41 -3.123 -3.797 -1.078 308 HD23 LEU 41 2HD2 LEU 41 -2.857 -3.690 0.662 309 H GLY 42 H GLY 42 -1.132 2.196 1.010 310 HA2 GLY 42 1HA GLY 42 -0.782 2.695 -1.858 311 HA3 GLY 42 2HA GLY 42 -1.151 4.073 -0.822 312 H LEU 43 H LEU 43 0.882 4.973 -1.410 313 HA LEU 43 HA LEU 43 3.136 3.880 0.153 314 HB2 LEU 43 1HB LEU 43 3.526 3.244 -2.184 315 HB3 LEU 43 2HB LEU 43 3.302 4.914 -2.693 316 HG LEU 43 HG LEU 43 5.254 5.595 -1.382 317 HD11 LEU 43 1HD1 LEU 43 5.427 4.185 0.475 318 HD12 LEU 43 2HD1 LEU 43 6.702 3.534 -0.547 319 HD13 LEU 43 3HD1 LEU 43 5.136 2.727 -0.470 320 HD21 LEU 43 3HD2 LEU 43 5.813 5.030 -3.601 321 HD22 LEU 43 1HD2 LEU 43 5.585 3.304 -3.320 322 HD23 LEU 43 2HD2 LEU 43 6.979 4.137 -2.635 323 H VAL 44 H VAL 44 4.367 5.428 1.184 324 HA VAL 44 HA VAL 44 3.591 8.268 0.748 325 HB VAL 44 HB VAL 44 2.620 7.328 2.839 326 HG11 VAL 44 1HG1 VAL 44 3.985 6.533 4.597 327 HG12 VAL 44 2HG1 VAL 44 5.456 7.171 3.868 328 HG13 VAL 44 3HG1 VAL 44 4.658 5.767 3.162 329 HG21 VAL 44 3HG2 VAL 44 3.263 9.733 2.603 330 HG22 VAL 44 1HG2 VAL 44 4.839 9.348 3.294 331 HG23 VAL 44 2HG2 VAL 44 3.379 9.159 4.266 332 H ARG 45 H ARG 45 5.200 9.619 0.383 333 HA ARG 45 HA ARG 45 7.985 8.721 0.871 334 HB2 ARG 45 1HB ARG 45 7.413 9.162 -1.496 335 HB3 ARG 45 2HB ARG 45 6.953 10.810 -1.071 336 HG2 ARG 45 1HG ARG 45 9.264 11.220 -0.247 337 HG3 ARG 45 2HG ARG 45 9.708 9.582 -0.727 338 HD2 ARG 45 1HD ARG 45 9.016 10.148 -3.069 339 HD3 ARG 45 2HD ARG 45 8.754 11.809 -2.546 340 HE ARG 45 HE ARG 45 11.395 10.845 -1.914 341 HH11 ARG 45 1HH2 ARG 45 9.329 12.182 -4.342 342 HH12 ARG 45 2HH2 ARG 45 10.619 12.902 -5.245 343 HH21 ARG 45 1HH1 ARG 45 13.099 11.790 -3.095 344 HH22 ARG 45 2HH1 ARG 45 12.753 12.680 -4.538 345 H TYR 46 H TYR 46 9.076 9.743 2.391 346 HA TYR 46 HA TYR 46 8.157 12.412 3.313 347 HB2 TYR 46 1HB TYR 46 7.755 10.531 4.913 348 HB3 TYR 46 2HB TYR 46 9.491 10.238 4.946 349 HD1 TYR 46 HD1 TYR 46 7.106 13.133 5.264 350 HD2 TYR 46 HD2 TYR 46 10.690 11.232 6.688 351 HE1 TYR 46 HE1 TYR 46 7.345 14.881 7.005 352 HE2 TYR 46 HE2 TYR 46 10.921 12.981 8.428 353 HH TYR 46 HH TYR 46 9.603 14.591 9.598 354 H ARG 47 H ARG 47 9.615 14.003 3.207 355 HA ARG 47 HA ARG 47 12.358 13.332 2.359 356 HB2 ARG 47 1HB ARG 47 12.508 15.667 1.661 357 HB3 ARG 47 2HB ARG 47 11.076 14.910 0.967 358 HG2 ARG 47 1HG ARG 47 9.683 15.906 2.748 359 HG3 ARG 47 2HG ARG 47 11.113 16.668 3.443 360 HD2 ARG 47 1HD ARG 47 11.477 17.914 1.350 361 HD3 ARG 47 2HD ARG 47 10.057 17.148 0.644 362 HE ARG 47 HE ARG 47 8.693 18.528 1.958 363 HH11 ARG 47 1HH2 ARG 47 12.033 18.790 2.832 364 HH12 ARG 47 2HH2 ARG 47 11.808 20.199 3.812 365 HH21 ARG 47 1HH1 ARG 47 8.393 20.378 3.238 366 HH22 ARG 47 2HH1 ARG 47 9.747 21.098 4.043 367 H LEU 48 H LEU 48 14.172 14.074 3.390 368 HA LEU 48 HA LEU 48 13.788 15.118 6.144 369 HB2 LEU 48 1HB LEU 48 16.059 13.443 5.039 370 HB3 LEU 48 2HB LEU 48 15.917 14.025 6.695 371 HG LEU 48 HG LEU 48 13.963 12.156 5.319 372 HD11 LEU 48 1HD1 LEU 48 15.919 10.893 5.757 373 HD12 LEU 48 2HD1 LEU 48 14.887 10.584 7.152 374 HD13 LEU 48 3HD1 LEU 48 16.222 11.729 7.280 375 HD21 LEU 48 3HD2 LEU 48 13.275 11.909 7.857 376 HD22 LEU 48 1HD2 LEU 48 12.662 13.266 6.917 377 HD23 LEU 48 2HD2 LEU 48 14.020 13.501 8.018 378 H GLU 49 H GLU 49 15.127 16.731 6.878 379 HA GLU 49 HA GLU 49 16.058 18.578 4.880 380 HB2 GLU 49 1HB GLU 49 16.648 19.986 6.814 381 HB3 GLU 49 2HB GLU 49 15.005 19.358 6.956 382 HG2 GLU 49 1HG GLU 49 15.869 17.519 8.400 383 HG3 GLU 49 2HG GLU 49 17.474 18.240 8.319 384 H ASN 50 H ASN 50 17.396 15.838 6.161 385 HA ASN 50 HA ASN 50 20.165 16.846 6.197 386 HB2 ASN 50 1HB ASN 50 18.936 14.204 7.005 387 HB3 ASN 50 2HB ASN 50 20.667 14.529 7.025 388 HD21 ASN 50 2HD2 ASN 50 18.859 13.997 9.363 389 HD22 ASN 50 1HD2 ASN 50 19.009 15.359 10.367 390 H ASP 51 H ASP 51 18.086 15.908 3.904 391 HA ASP 51 HA ASP 51 18.362 15.268 1.715 392 HB2 ASP 51 1HB ASP 51 21.293 14.755 2.261 393 HB3 ASP 51 2HB ASP 51 20.510 15.087 0.723 394 H ALA 52 H ALA 52 17.052 13.549 2.565 395 HA ALA 52 HA ALA 52 18.036 10.997 1.848 396 HB1 ALA 52 3HB ALA 52 17.907 11.662 4.781 397 HB2 ALA 52 1HB ALA 52 19.198 10.860 3.891 398 HB3 ALA 52 2HB ALA 52 17.689 10.006 4.209 399 H GLN 53 H GLN 53 16.332 10.074 1.026 400 HA GLN 53 HA GLN 53 13.628 10.879 1.820 401 HB2 GLN 53 1HB GLN 53 14.616 9.129 -0.446 402 HB3 GLN 53 2HB GLN 53 12.941 9.620 -0.189 403 HG2 GLN 53 1HG GLN 53 15.245 11.547 -0.576 404 HG3 GLN 53 2HG GLN 53 14.142 11.051 -1.854 405 HE21 GLN 53 2HE2 GLN 53 14.650 13.596 0.143 406 HE22 GLN 53 1HE2 GLN 53 13.053 14.117 0.382 407 H GLU 54 H GLU 54 12.065 9.442 2.541 408 HA GLU 54 HA GLU 54 12.924 6.687 3.199 409 HB2 GLU 54 1HB GLU 54 11.585 8.679 5.041 410 HB3 GLU 54 2HB GLU 54 11.683 6.948 5.364 411 HG2 GLU 54 1HG GLU 54 14.107 7.020 5.341 412 HG3 GLU 54 2HG GLU 54 14.090 8.710 4.843 413 H HIS 55 H HIS 55 11.469 5.179 2.680 414 HA HIS 55 HA HIS 55 8.702 6.030 2.000 415 HB2 HIS 55 1HB HIS 55 10.514 4.050 0.610 416 HB3 HIS 55 2HB HIS 55 8.785 4.176 0.296 417 HD2 HIS 55 HD2 HIS 55 8.084 6.240 -1.440 418 HE1 HIS 55 HE1 HIS 55 11.882 8.068 -1.667 419 HE2 HIS 55 HE2 HIS 55 9.529 8.066 -2.622 420 H ALA 56 H ALA 56 7.033 4.622 2.505 421 HA ALA 56 HA ALA 56 7.587 2.062 3.776 422 HB1 ALA 56 3HB ALA 56 5.995 2.867 5.708 423 HB2 ALA 56 1HB ALA 56 6.543 4.477 5.232 424 HB3 ALA 56 2HB ALA 56 7.710 3.274 5.775 425 H LEU 57 H LEU 57 5.807 0.675 3.637 426 HA LEU 57 HA LEU 57 3.693 1.569 1.818 427 HB2 LEU 57 1HB LEU 57 4.996 -0.636 1.608 428 HB3 LEU 57 2HB LEU 57 4.042 -1.201 2.966 429 HG LEU 57 HG LEU 57 2.749 -0.046 0.481 430 HD11 LEU 57 1HD1 LEU 57 4.050 -1.878 -0.340 431 HD12 LEU 57 2HD1 LEU 57 2.401 -2.479 -0.167 432 HD13 LEU 57 3HD1 LEU 57 3.622 -2.887 1.040 433 HD21 LEU 57 3HD2 LEU 57 1.814 -1.665 2.861 434 HD22 LEU 57 1HD2 LEU 57 0.921 -1.717 1.343 435 HD23 LEU 57 2HD2 LEU 57 1.126 -0.189 2.189 436 H PHE 58 H PHE 58 2.364 2.838 3.051 437 HA PHE 58 HA PHE 58 1.444 2.078 5.642 438 HB2 PHE 58 1HB PHE 58 0.820 4.246 3.659 439 HB3 PHE 58 2HB PHE 58 -0.279 3.990 5.009 440 HD1 PHE 58 HD1 PHE 58 3.375 3.334 5.316 441 HD2 PHE 58 HD2 PHE 58 0.186 6.132 6.038 442 HE1 PHE 58 HE1 PHE 58 4.841 4.627 6.816 443 HE2 PHE 58 HE2 PHE 58 1.669 7.419 7.544 444 HZ PHE 58 HZ PHE 58 3.996 6.667 7.934 445 H LEU 59 H LEU 59 -0.384 1.077 6.258 446 HA LEU 59 HA LEU 59 -2.143 -0.020 4.130 447 HB2 LEU 59 1HB LEU 59 -0.796 -1.613 5.654 448 HB3 LEU 59 2HB LEU 59 -1.895 -1.099 6.935 449 HG LEU 59 HG LEU 59 -3.761 -1.667 5.108 450 HD11 LEU 59 1HD1 LEU 59 -1.789 -3.815 4.372 451 HD12 LEU 59 2HD1 LEU 59 -1.711 -2.272 3.529 452 HD13 LEU 59 3HD1 LEU 59 -3.194 -3.223 3.481 453 HD21 LEU 59 3HD2 LEU 59 -2.268 -3.698 6.799 454 HD22 LEU 59 1HD2 LEU 59 -3.818 -4.022 6.022 455 HD23 LEU 59 2HD2 LEU 59 -3.696 -2.773 7.258 456 H TYR 60 H TYR 60 -4.086 0.857 4.060 457 HA TYR 60 HA TYR 60 -5.188 2.173 6.487 458 HB2 TYR 60 1HB TYR 60 -5.551 2.720 3.536 459 HB3 TYR 60 2HB TYR 60 -6.600 3.410 4.769 460 HD1 TYR 60 HD1 TYR 60 -5.732 5.022 6.404 461 HD2 TYR 60 HD2 TYR 60 -3.237 3.475 3.264 462 HE1 TYR 60 HE1 TYR 60 -4.114 6.860 6.784 463 HE2 TYR 60 HE2 TYR 60 -1.622 5.316 3.646 464 HH TYR 60 HH TYR 60 -1.952 7.522 6.361 465 H THR 61 H THR 61 -6.986 1.239 7.351 466 HA THR 61 HA THR 61 -8.294 -0.904 5.846 467 HB THR 61 HB THR 61 -7.880 -1.216 8.279 468 HG1 THR 61 HG1 THR 61 -10.647 -0.955 7.899 469 HG21 THR 61 3HG2 THR 61 -9.986 0.910 8.698 470 HG22 THR 61 1HG2 THR 61 -8.259 1.254 8.812 471 HG23 THR 61 2HG2 THR 61 -9.005 0.105 9.922 472 H HIS 62 H HIS 62 -10.687 -0.864 5.711 473 HA HIS 62 HA HIS 62 -12.029 1.654 5.908 474 HB2 HIS 62 1HB HIS 62 -12.335 2.166 3.611 475 HB3 HIS 62 2HB HIS 62 -10.615 1.860 3.793 476 HD2 HIS 62 HD2 HIS 62 -9.687 -0.451 2.486 477 HE1 HIS 62 HE1 HIS 62 -13.367 -1.466 0.695 478 HE2 HIS 62 HE2 HIS 62 -10.881 -2.005 0.757 479 H ARG 63 H ARG 63 -14.275 1.488 5.292 480 HA ARG 63 HA ARG 63 -15.343 -1.071 6.027 481 HB2 ARG 63 1HB ARG 63 -16.715 1.476 5.145 482 HB3 ARG 63 2HB ARG 63 -17.562 0.028 5.683 483 HG2 ARG 63 1HG ARG 63 -16.399 0.128 7.844 484 HG3 ARG 63 2HG ARG 63 -15.528 1.567 7.314 485 HD2 ARG 63 1HD ARG 63 -17.434 2.224 8.691 486 HD3 ARG 63 2HD ARG 63 -17.693 2.750 7.031 487 HE ARG 63 HE ARG 63 -18.853 0.179 7.425 488 HH11 ARG 63 1HH2 ARG 63 -19.206 3.536 8.166 489 HH12 ARG 63 2HH2 ARG 63 -20.916 3.452 8.431 490 HH21 ARG 63 1HH1 ARG 63 -21.128 0.057 7.752 491 HH22 ARG 63 2HH1 ARG 63 -22.000 1.484 8.201 492 H ARG 64 H ARG 64 -17.553 -1.467 4.607 493 HA ARG 64 HA ARG 64 -16.564 -2.691 2.235 494 HB2 ARG 64 1HB ARG 64 -18.910 -3.349 1.884 495 HB3 ARG 64 2HB ARG 64 -18.398 -3.659 3.544 496 HG2 ARG 64 1HG ARG 64 -19.426 -1.517 4.252 497 HG3 ARG 64 2HG ARG 64 -19.977 -1.247 2.598 498 HD2 ARG 64 1HD ARG 64 -21.804 -2.212 3.862 499 HD3 ARG 64 2HD ARG 64 -21.221 -3.410 2.711 500 HE ARG 64 HE ARG 64 -19.865 -3.729 5.180 501 HH11 ARG 64 1HH2 ARG 64 -22.946 -4.124 3.664 502 HH12 ARG 64 2HH2 ARG 64 -23.438 -5.433 4.686 503 HH21 ARG 64 1HH1 ARG 64 -20.498 -5.446 6.527 504 HH22 ARG 64 2HH1 ARG 64 -22.051 -6.183 6.308 505 H MET 65 H MET 65 -17.857 0.453 2.952 506 HA MET 65 HA MET 65 -17.645 1.182 0.128 507 HB2 MET 65 1HB MET 65 -19.862 2.209 0.092 508 HB3 MET 65 2HB MET 65 -20.009 0.486 0.443 509 HG2 MET 65 1HG MET 65 -20.052 1.075 2.899 510 HG3 MET 65 2HG MET 65 -20.140 2.772 2.432 511 HE1 MET 65 3HE MET 65 -23.687 1.867 3.736 512 HE2 MET 65 1HE MET 65 -22.495 3.173 3.688 513 HE3 MET 65 2HE MET 65 -22.042 1.582 4.297 514 H ALA 66 H ALA 66 -16.166 1.763 2.600 515 HA ALA 66 HA ALA 66 -16.861 4.368 3.536 516 HB1 ALA 66 3HB ALA 66 -14.593 2.495 3.858 517 HB2 ALA 66 1HB ALA 66 -15.455 3.422 5.081 518 HB3 ALA 66 2HB ALA 66 -14.209 4.195 4.108 519 H ILE 67 H ILE 67 -14.366 3.239 1.275 520 HA ILE 67 HA ILE 67 -12.897 4.430 -0.085 521 HB ILE 67 HB ILE 67 -15.682 5.012 -1.111 522 HG12 ILE 67 1HG1 ILE 67 -13.691 2.897 -1.980 523 HG13 ILE 67 2HG1 ILE 67 -14.951 2.594 -0.784 524 HG21 ILE 67 1HG2 ILE 67 -12.948 5.356 -2.353 525 HG22 ILE 67 2HG2 ILE 67 -14.261 6.529 -2.261 526 HG23 ILE 67 3HG2 ILE 67 -14.393 5.141 -3.342 527 HD11 ILE 67 3HD1 ILE 67 -15.394 3.525 -3.637 528 HD12 ILE 67 1HD1 ILE 67 -16.667 3.290 -2.438 529 HD13 ILE 67 2HD1 ILE 67 -15.729 1.911 -3.011 530 H THR 68 H THR 68 -15.658 6.496 0.377 531 HA THR 68 HA THR 68 -14.988 8.898 -0.317 532 HB THR 68 HB THR 68 -16.041 8.409 2.461 533 HG1 THR 68 HG1 THR 68 -18.036 8.763 0.971 534 HG21 THR 68 3HG2 THR 68 -17.295 10.531 1.949 535 HG22 THR 68 1HG2 THR 68 -16.304 10.702 0.500 536 HG23 THR 68 2HG2 THR 68 -15.552 10.743 2.095 537 H GLY 69 H GLY 69 -13.452 7.384 2.506 538 HA2 GLY 69 1HA GLY 69 -11.191 7.955 3.097 539 HA3 GLY 69 2HA GLY 69 -11.461 9.593 2.509 540 H ASP 70 H ASP 70 -14.234 9.081 3.792 541 HA ASP 70 HA ASP 70 -13.876 10.635 6.116 542 HB2 ASP 70 1HB ASP 70 -16.165 8.929 5.126 543 HB3 ASP 70 2HB ASP 70 -16.266 9.890 6.602 544 H ASP 71 H ASP 71 -14.398 7.092 5.720 545 HA ASP 71 HA ASP 71 -13.821 6.829 8.636 546 HB2 ASP 71 1HB ASP 71 -16.113 6.175 7.803 547 HB3 ASP 71 2HB ASP 71 -15.332 4.877 6.909 548 H VAL 72 H VAL 72 -11.625 6.954 6.871 549 HA VAL 72 HA VAL 72 -10.607 4.195 7.218 550 HB VAL 72 HB VAL 72 -9.704 4.093 5.058 551 HG11 VAL 72 1HG1 VAL 72 -11.589 4.376 3.592 552 HG12 VAL 72 2HG1 VAL 72 -12.310 5.565 4.678 553 HG13 VAL 72 3HG1 VAL 72 -12.184 3.878 5.176 554 HG21 VAL 72 3HG2 VAL 72 -8.656 6.204 4.791 555 HG22 VAL 72 1HG2 VAL 72 -10.181 7.069 4.969 556 HG23 VAL 72 2HG2 VAL 72 -9.858 6.131 3.506 557 H SER 73 H SER 73 -8.743 4.199 8.408 558 HA SER 73 HA SER 73 -6.854 6.406 8.064 559 HB2 SER 73 1HB SER 73 -7.995 5.609 10.759 560 HB3 SER 73 2HB SER 73 -6.657 6.726 10.503 561 HG SER 73 HG SER 73 -8.744 7.745 10.726 562 H LEU 74 H LEU 74 -4.772 5.883 9.240 563 HA LEU 74 HA LEU 74 -3.643 3.609 8.331 564 HB2 LEU 74 1HB LEU 74 -2.996 5.256 10.762 565 HB3 LEU 74 2HB LEU 74 -2.024 3.837 10.373 566 HG LEU 74 HG LEU 74 -2.606 5.989 8.334 567 HD11 LEU 74 1HD1 LEU 74 -0.307 6.853 8.895 568 HD12 LEU 74 2HD1 LEU 74 -0.324 5.814 10.319 569 HD13 LEU 74 3HD1 LEU 74 -1.503 7.116 10.166 570 HD21 LEU 74 3HD2 LEU 74 -0.055 4.593 8.103 571 HD22 LEU 74 1HD2 LEU 74 -1.382 4.680 6.950 572 HD23 LEU 74 2HD2 LEU 74 -1.363 3.425 8.181 573 H ASP 75 H ASP 75 -3.610 1.568 8.676 574 HA ASP 75 HA ASP 75 -4.988 0.418 11.031 575 HB2 ASP 75 1HB ASP 75 -5.918 -0.185 8.843 576 HB3 ASP 75 2HB ASP 75 -4.352 -0.809 8.340 577 H GLN 76 H GLN 76 -2.285 -0.479 8.800 578 HA GLN 76 HA GLN 76 -0.552 -0.933 11.098 579 HB2 GLN 76 1HB GLN 76 -1.825 -3.104 10.634 580 HB3 GLN 76 2HB GLN 76 -0.954 -3.161 9.098 581 HG2 GLN 76 1HG GLN 76 1.180 -2.790 10.584 582 HG3 GLN 76 2HG GLN 76 0.144 -3.334 11.900 583 HE21 GLN 76 2HE2 GLN 76 1.960 -4.345 9.115 584 HE22 GLN 76 1HE2 GLN 76 1.606 -5.990 9.238 585 H ILE 77 H ILE 77 1.262 0.080 10.556 586 HA ILE 77 HA ILE 77 1.948 0.630 7.794 587 HB ILE 77 HB ILE 77 3.387 1.202 10.395 588 HG12 ILE 77 1HG1 ILE 77 1.795 3.058 8.604 589 HG13 ILE 77 2HG1 ILE 77 1.124 2.266 10.030 590 HG21 ILE 77 1HG2 ILE 77 4.202 3.045 8.416 591 HG22 ILE 77 2HG2 ILE 77 4.234 1.491 7.593 592 HG23 ILE 77 3HG2 ILE 77 5.170 1.726 9.067 593 HD11 ILE 77 3HD1 ILE 77 3.460 4.200 9.963 594 HD12 ILE 77 1HD1 ILE 77 2.975 3.291 11.393 595 HD13 ILE 77 2HD1 ILE 77 1.876 4.477 10.689 596 H VAL 78 H VAL 78 3.172 -0.560 6.541 597 HA VAL 78 HA VAL 78 4.868 -2.681 7.722 598 HB VAL 78 HB VAL 78 3.918 -2.513 4.868 599 HG11 VAL 78 1HG1 VAL 78 4.753 -4.901 6.523 600 HG12 VAL 78 2HG1 VAL 78 5.897 -3.967 5.558 601 HG13 VAL 78 3HG1 VAL 78 4.565 -4.813 4.771 602 HG21 VAL 78 3HG2 VAL 78 1.964 -2.581 6.409 603 HG22 VAL 78 1HG2 VAL 78 2.651 -4.008 7.186 604 HG23 VAL 78 2HG2 VAL 78 2.134 -4.080 5.501 605 HA PRO 79 HA PRO 79 7.770 0.489 6.015 606 HB2 PRO 79 1HB PRO 79 9.856 0.032 7.711 607 HB3 PRO 79 2HB PRO 79 8.460 1.035 8.149 608 HG2 PRO 79 1HG PRO 79 9.033 -1.810 8.848 609 HG3 PRO 79 2HG PRO 79 8.387 -0.511 9.868 610 HD2 PRO 79 1HD PRO 79 6.807 -2.424 8.731 611 HD3 PRO 79 2HD PRO 79 6.217 -0.782 9.072 612 H LEU 80 H LEU 80 9.349 0.311 4.519 613 HA LEU 80 HA LEU 80 9.864 -2.200 3.379 614 HB2 LEU 80 1HB LEU 80 11.127 0.520 3.028 615 HB3 LEU 80 2HB LEU 80 11.563 -0.872 2.039 616 HG LEU 80 HG LEU 80 8.718 0.129 2.353 617 HD11 LEU 80 1HD1 LEU 80 9.003 1.218 0.172 618 HD12 LEU 80 2HD1 LEU 80 10.689 0.700 0.118 619 HD13 LEU 80 3HD1 LEU 80 10.161 1.863 1.335 620 HD21 LEU 80 3HD2 LEU 80 8.517 -2.038 1.513 621 HD22 LEU 80 1HD2 LEU 80 10.074 -1.986 0.687 622 HD23 LEU 80 2HD2 LEU 80 8.685 -1.142 0.009 623 H SER 81 H SER 81 11.373 -3.580 3.627 624 HA SER 81 HA SER 81 13.786 -3.000 5.253 625 HB2 SER 81 1HB SER 81 13.550 -5.277 6.265 626 HB3 SER 81 2HB SER 81 12.276 -4.157 6.739 627 HG SER 81 HG SER 81 10.864 -5.230 5.530 628 H LYS 82 H LYS 82 15.560 -4.529 4.877 629 HA LYS 82 HA LYS 82 16.093 -4.878 2.164 630 HB2 LYS 82 1HB LYS 82 17.295 -6.258 4.570 631 HB3 LYS 82 2HB LYS 82 17.966 -6.341 2.939 632 HG2 LYS 82 1HG LYS 82 18.179 -3.890 2.891 633 HG3 LYS 82 2HG LYS 82 17.495 -3.794 4.514 634 HD2 LYS 82 1HD LYS 82 19.362 -5.141 5.386 635 HD3 LYS 82 2HD LYS 82 20.048 -5.240 3.765 636 HE2 LYS 82 1HE LYS 82 20.247 -2.779 3.696 637 HE3 LYS 82 2HE LYS 82 19.576 -2.683 5.325 638 HZ1 LYS 82 3HZ LYS 82 21.796 -2.686 5.782 639 HZ2 LYS 82 1HZ LYS 82 22.197 -3.656 4.449 640 HZ3 LYS 82 2HZ LYS 82 21.495 -4.358 5.828 641 H ASP 83 H ASP 83 14.854 -7.211 4.554 642 HA ASP 83 HA ASP 83 14.878 -9.422 2.762 643 HB2 ASP 83 1HB ASP 83 13.461 -8.873 5.368 644 HB3 ASP 83 2HB ASP 83 13.296 -10.398 4.501 645 H PHE 84 H PHE 84 13.190 -6.672 2.496 646 HA PHE 84 HA PHE 84 10.535 -7.612 1.954 647 HB2 PHE 84 1HB PHE 84 11.135 -5.239 2.564 648 HB3 PHE 84 2HB PHE 84 11.843 -5.070 0.957 649 HD1 PHE 84 HD1 PHE 84 10.360 -5.434 -1.079 650 HD2 PHE 84 HD2 PHE 84 8.798 -5.065 2.905 651 HE1 PHE 84 HE1 PHE 84 8.122 -4.904 -2.005 652 HE2 PHE 84 HE2 PHE 84 6.560 -4.540 1.980 653 HZ PHE 84 HZ PHE 84 6.222 -4.458 -0.475 654 H MET 85 H MET 85 9.606 -8.070 -0.014 655 HA MET 85 HA MET 85 10.941 -7.742 -2.500 656 HB2 MET 85 1HB MET 85 12.278 -9.641 -1.618 657 HB3 MET 85 2HB MET 85 10.796 -10.585 -1.466 658 HG2 MET 85 1HG MET 85 11.916 -11.165 -3.562 659 HG3 MET 85 2HG MET 85 10.414 -10.324 -3.922 660 HE1 MET 85 3HE MET 85 12.513 -9.165 -6.805 661 HE2 MET 85 1HE MET 85 11.516 -10.456 -6.119 662 HE3 MET 85 2HE MET 85 13.271 -10.526 -5.983 663 H LEU 86 H LEU 86 9.560 -8.068 -4.228 664 HA LEU 86 HA LEU 86 6.769 -8.768 -3.530 665 HB2 LEU 86 1HB LEU 86 6.141 -7.503 -5.510 666 HB3 LEU 86 2HB LEU 86 7.179 -6.517 -4.485 667 HG LEU 86 HG LEU 86 9.069 -7.716 -6.087 668 HD11 LEU 86 1HD1 LEU 86 8.356 -8.020 -8.290 669 HD12 LEU 86 2HD1 LEU 86 6.904 -7.043 -8.072 670 HD13 LEU 86 3HD1 LEU 86 6.984 -8.664 -7.392 671 HD21 LEU 86 3HD2 LEU 86 9.016 -5.338 -5.668 672 HD22 LEU 86 1HD2 LEU 86 7.518 -5.157 -6.586 673 HD23 LEU 86 2HD2 LEU 86 9.018 -5.573 -7.415 674 H GLU 87 H GLU 87 5.977 -10.682 -4.249 675 HA GLU 87 HA GLU 87 7.436 -12.059 -6.442 676 HB2 GLU 87 1HB GLU 87 5.962 -13.194 -4.056 677 HB3 GLU 87 2HB GLU 87 6.565 -14.159 -5.402 678 HG2 GLU 87 1HG GLU 87 8.851 -13.395 -4.960 679 HG3 GLU 87 2HG GLU 87 8.271 -12.370 -3.648 680 H GLU 88 H GLU 88 6.361 -12.350 -8.222 681 HA GLU 88 HA GLU 88 3.531 -11.754 -8.417 682 HB2 GLU 88 1HB GLU 88 5.551 -12.738 -10.447 683 HB3 GLU 88 2HB GLU 88 3.871 -12.366 -10.830 684 HG2 GLU 88 1HG GLU 88 4.176 -10.058 -10.087 685 HG3 GLU 88 2HG GLU 88 5.833 -10.412 -9.596 686 H VAL 89 H VAL 89 1.888 -13.256 -9.016 687 HA VAL 89 HA VAL 89 2.353 -15.936 -7.981 688 HB VAL 89 HB VAL 89 -0.140 -14.903 -9.307 689 HG11 VAL 89 1HG1 VAL 89 -0.135 -17.296 -9.034 690 HG12 VAL 89 2HG1 VAL 89 -1.176 -16.621 -7.781 691 HG13 VAL 89 3HG1 VAL 89 0.456 -17.155 -7.378 692 HG21 VAL 89 3HG2 VAL 89 0.689 -14.768 -6.392 693 HG22 VAL 89 1HG2 VAL 89 -0.905 -14.338 -7.013 694 HG23 VAL 89 2HG2 VAL 89 0.507 -13.386 -7.472 695 H SER 90 H SER 90 2.541 -17.757 -9.101 696 HA SER 90 HA SER 90 3.623 -17.955 -11.580 697 HB2 SER 90 1HB SER 90 1.824 -19.885 -10.137 698 HB3 SER 90 2HB SER 90 2.598 -20.288 -11.669 699 HG SER 90 HG SER 90 3.635 -20.294 -9.205 700 HA PRO 91 HA PRO 91 0.180 -16.257 -14.074 701 HB2 PRO 91 1HB PRO 91 1.923 -17.431 -16.224 702 HB3 PRO 91 2HB PRO 91 1.130 -15.849 -16.160 703 HG2 PRO 91 1HG PRO 91 3.734 -16.101 -15.686 704 HG3 PRO 91 2HG PRO 91 2.738 -14.943 -14.782 705 HD2 PRO 91 1HD PRO 91 3.891 -17.544 -13.867 706 HD3 PRO 91 2HD PRO 91 3.519 -16.079 -12.929 707 H ASP 92 H ASP 92 1.536 -19.116 -15.726 708 HA ASP 92 HA ASP 92 0.510 -21.012 -16.525 709 HB2 ASP 92 1HB ASP 92 -0.759 -20.745 -13.796 710 HB3 ASP 92 2HB ASP 92 -1.041 -22.130 -14.850 711 H GLY 93 H GLY 93 -0.578 -18.565 -17.439 712 HA2 GLY 93 1HA GLY 93 -3.498 -19.095 -17.585 713 HA3 GLY 93 2HA GLY 93 -2.740 -17.538 -17.868 714 H GLU 94 H GLU 94 -0.581 -18.548 -19.488 715 HA GLU 94 HA GLU 94 -0.181 -18.621 -21.757 716 HB2 GLU 94 1HB GLU 94 -0.796 -20.759 -22.771 717 HB3 GLU 94 2HB GLU 94 -0.214 -21.005 -21.129 718 HG2 GLU 94 1HG GLU 94 -2.450 -21.317 -20.298 719 HG3 GLU 94 2HG GLU 94 -3.161 -20.794 -21.823 720 H LEU 95 H LEU 95 -2.693 -17.222 -20.825 721 HA LEU 95 HA LEU 95 -3.639 -16.478 -23.374 722 HB2 LEU 95 1HB LEU 95 -4.760 -18.739 -23.119 723 HB3 LEU 95 2HB LEU 95 -5.633 -18.063 -21.745 724 HG LEU 95 HG LEU 95 -6.296 -16.150 -23.407 725 HD11 LEU 95 1HD1 LEU 95 -6.539 -17.084 -25.760 726 HD12 LEU 95 2HD1 LEU 95 -5.416 -18.357 -25.293 727 HD13 LEU 95 3HD1 LEU 95 -4.894 -16.674 -25.286 728 HD21 LEU 95 3HD2 LEU 95 -7.912 -17.724 -22.478 729 HD22 LEU 95 1HD2 LEU 95 -7.404 -18.968 -23.619 730 HD23 LEU 95 2HD2 LEU 95 -8.234 -17.526 -24.200 731 H TYR 96 H TYR 96 -2.685 -14.870 -21.669 732 HA TYR 96 HA TYR 96 -3.058 -12.933 -20.505 733 HB2 TYR 96 1HB TYR 96 -4.787 -11.774 -21.416 734 HB3 TYR 96 2HB TYR 96 -5.320 -13.268 -22.173 735 HD1 TYR 96 HD1 TYR 96 -5.503 -11.433 -18.911 736 HD2 TYR 96 HD2 TYR 96 -7.440 -14.134 -21.627 737 HE1 TYR 96 HE1 TYR 96 -7.534 -11.402 -17.489 738 HE2 TYR 96 HE2 TYR 96 -9.476 -14.104 -20.206 739 HH TYR 96 HH TYR 96 -10.524 -12.578 -18.540 740 H ILE 97 H ILE 97 -2.972 -12.669 -18.376 741 HA ILE 97 HA ILE 97 -4.623 -14.438 -16.652 742 HB ILE 97 HB ILE 97 -2.050 -13.224 -15.688 743 HG12 ILE 97 1HG1 ILE 97 -1.123 -15.602 -16.582 744 HG13 ILE 97 2HG1 ILE 97 -2.326 -15.309 -17.827 745 HG21 ILE 97 1HG2 ILE 97 -1.999 -15.219 -14.314 746 HG22 ILE 97 2HG2 ILE 97 -3.324 -15.936 -15.229 747 HG23 ILE 97 3HG2 ILE 97 -3.617 -14.524 -14.214 748 HD11 ILE 97 3HD1 ILE 97 -1.232 -12.911 -17.922 749 HD12 ILE 97 1HD1 ILE 97 -0.463 -14.265 -18.747 750 HD13 ILE 97 2HD1 ILE 97 0.141 -13.730 -17.181 751 H LEU 98 H LEU 98 -2.915 -11.296 -16.675 752 HA LEU 98 HA LEU 98 -4.396 -10.238 -14.488 753 HB2 LEU 98 1HB LEU 98 -2.554 -9.100 -16.580 754 HB3 LEU 98 2HB LEU 98 -3.450 -8.014 -15.522 755 HG LEU 98 HG LEU 98 -2.512 -9.234 -13.552 756 HD11 LEU 98 1HD1 LEU 98 -1.964 -11.379 -14.306 757 HD12 LEU 98 2HD1 LEU 98 -0.386 -10.613 -14.164 758 HD13 LEU 98 3HD1 LEU 98 -1.146 -10.777 -15.747 759 HD21 LEU 98 3HD2 LEU 98 -1.422 -7.195 -14.243 760 HD22 LEU 98 1HD2 LEU 98 -0.583 -8.028 -15.552 761 HD23 LEU 98 2HD2 LEU 98 -0.156 -8.365 -13.874 762 H GLY 99 H GLY 99 -4.384 -9.054 -17.853 763 HA2 GLY 99 1HA GLY 99 -6.087 -8.255 -19.187 764 HA3 GLY 99 2HA GLY 99 -7.205 -9.190 -18.193 765 H SER 100 H SER 100 -8.413 -8.177 -16.675 766 HA SER 100 HA SER 100 -8.003 -5.258 -16.304 767 HB2 SER 100 1HB SER 100 -10.471 -5.294 -15.699 768 HB3 SER 100 2HB SER 100 -10.098 -5.599 -17.392 769 HG SER 100 HG SER 100 -11.433 -7.136 -15.719 770 H ASP 101 H ASP 101 -6.476 -6.867 -14.817 771 HA ASP 101 HA ASP 101 -7.145 -6.182 -12.143 772 HB2 ASP 101 1HB ASP 101 -7.548 -9.046 -13.005 773 HB3 ASP 101 2HB ASP 101 -7.075 -8.663 -11.352 774 H VAL 102 H VAL 102 -5.386 -6.695 -10.681 775 HA VAL 102 HA VAL 102 -2.886 -7.546 -12.047 776 HB VAL 102 HB VAL 102 -3.180 -5.428 -9.923 777 HG11 VAL 102 1HG1 VAL 102 -1.062 -6.518 -9.673 778 HG12 VAL 102 2HG1 VAL 102 -0.748 -5.029 -10.563 779 HG13 VAL 102 3HG1 VAL 102 -0.814 -6.570 -11.418 780 HG21 VAL 102 3HG2 VAL 102 -2.275 -4.007 -11.900 781 HG22 VAL 102 1HG2 VAL 102 -3.979 -4.453 -11.906 782 HG23 VAL 102 2HG2 VAL 102 -2.828 -5.336 -12.914 783 H THR 103 H THR 103 -1.757 -9.080 -11.050 784 HA THR 103 HA THR 103 -2.648 -9.899 -8.318 785 HB THR 103 HB THR 103 -1.180 -11.700 -10.251 786 HG1 THR 103 HG1 THR 103 -3.888 -12.021 -10.029 787 HG21 THR 103 3HG2 THR 103 -1.485 -12.183 -7.745 788 HG22 THR 103 1HG2 THR 103 -2.026 -13.435 -8.863 789 HG23 THR 103 2HG2 THR 103 -3.202 -12.360 -8.107 790 H VAL 104 H VAL 104 -1.300 -9.170 -6.863 791 HA VAL 104 HA VAL 104 1.605 -9.524 -7.243 792 HB VAL 104 HB VAL 104 0.786 -7.104 -7.611 793 HG11 VAL 104 1HG1 VAL 104 0.099 -5.828 -5.740 794 HG12 VAL 104 2HG1 VAL 104 0.567 -7.087 -4.597 795 HG13 VAL 104 3HG1 VAL 104 -0.845 -7.313 -5.628 796 HG21 VAL 104 3HG2 VAL 104 2.746 -7.663 -5.356 797 HG22 VAL 104 1HG2 VAL 104 2.678 -6.190 -6.324 798 HG23 VAL 104 2HG2 VAL 104 3.132 -7.719 -7.076 799 H GLN 105 H GLN 105 2.647 -10.298 -5.472 800 HA GLN 105 HA GLN 105 1.077 -10.645 -2.967 801 HB2 GLN 105 1HB GLN 105 1.520 -12.731 -4.445 802 HB3 GLN 105 2HB GLN 105 3.195 -12.576 -3.921 803 HG2 GLN 105 1HG GLN 105 0.840 -12.753 -2.026 804 HG3 GLN 105 2HG GLN 105 1.834 -14.127 -2.494 805 HE21 GLN 105 2HE2 GLN 105 1.543 -11.636 -0.208 806 HE22 GLN 105 1HE2 GLN 105 3.115 -11.708 0.425 807 H LEU 106 H LEU 106 1.982 -9.327 -1.400 808 HA LEU 106 HA LEU 106 4.719 -8.478 -1.616 809 HB2 LEU 106 1HB LEU 106 2.758 -8.165 0.664 810 HB3 LEU 106 2HB LEU 106 4.226 -7.226 0.401 811 HG LEU 106 HG LEU 106 1.875 -7.315 -1.511 812 HD11 LEU 106 1HD1 LEU 106 2.716 -5.088 0.364 813 HD12 LEU 106 2HD1 LEU 106 1.414 -6.226 0.716 814 HD13 LEU 106 3HD1 LEU 106 1.282 -5.132 -0.662 815 HD21 LEU 106 3HD2 LEU 106 3.141 -5.152 -2.296 816 HD22 LEU 106 1HD2 LEU 106 3.753 -6.724 -2.803 817 HD23 LEU 106 2HD2 LEU 106 4.526 -5.866 -1.471 818 H ASN 107 H ASN 107 6.364 -9.607 -0.955 819 HA ASN 107 HA ASN 107 6.006 -11.687 1.143 820 HB2 ASN 107 1HB ASN 107 8.406 -11.477 -0.647 821 HB3 ASN 107 2HB ASN 107 7.763 -12.886 0.195 822 HD21 ASN 107 2HD2 ASN 107 6.696 -10.493 -2.276 823 HD22 ASN 107 1HD2 ASN 107 5.842 -11.620 -3.209 824 H THR 108 H THR 108 6.108 -9.724 2.701 825 HA THR 108 HA THR 108 8.701 -8.551 3.104 826 HB THR 108 HB THR 108 6.451 -8.674 5.115 827 HG1 THR 108 HG1 THR 108 5.391 -7.306 3.935 828 HG21 THR 108 3HG2 THR 108 8.393 -7.746 6.107 829 HG22 THR 108 1HG2 THR 108 7.432 -6.353 5.617 830 HG23 THR 108 2HG2 THR 108 8.816 -6.852 4.647 831 H ALA 109 H ALA 109 9.805 -8.759 5.257 832 HA ALA 109 HA ALA 109 10.934 -11.203 5.650 833 HB1 ALA 109 3HB ALA 109 10.363 -9.367 7.972 834 HB2 ALA 109 1HB ALA 109 11.555 -8.978 6.732 835 HB3 ALA 109 2HB ALA 109 11.759 -10.419 7.730 836 H GLU 110 H GLU 110 7.881 -10.082 7.042 837 HA GLU 110 HA GLU 110 7.359 -12.850 7.959 838 HB2 GLU 110 1HB GLU 110 6.315 -11.988 9.997 839 HB3 GLU 110 2HB GLU 110 8.008 -11.500 9.918 840 HG2 GLU 110 1HG GLU 110 7.279 -9.304 8.959 841 HG3 GLU 110 2HG GLU 110 5.603 -9.795 9.203 842 H LEU 111 H LEU 111 6.109 -9.727 6.899 843 HA LEU 111 HA LEU 111 3.378 -10.559 6.891 844 HB2 LEU 111 1HB LEU 111 4.627 -8.121 6.732 845 HB3 LEU 111 2HB LEU 111 4.172 -8.362 5.048 846 HG LEU 111 HG LEU 111 1.823 -9.011 6.067 847 HD11 LEU 111 1HD1 LEU 111 2.987 -7.258 8.251 848 HD12 LEU 111 2HD1 LEU 111 2.604 -8.971 8.421 849 HD13 LEU 111 3HD1 LEU 111 1.314 -7.802 8.142 850 HD21 LEU 111 3HD2 LEU 111 1.966 -7.121 4.644 851 HD22 LEU 111 1HD2 LEU 111 2.985 -6.239 5.778 852 HD23 LEU 111 2HD2 LEU 111 1.276 -6.485 6.136 853 H LYS 112 H LYS 112 2.161 -11.391 5.268 854 HA LYS 112 HA LYS 112 3.190 -11.612 2.588 855 HB2 LYS 112 1HB LYS 112 4.242 -13.548 3.853 856 HB3 LYS 112 2HB LYS 112 2.609 -14.192 4.032 857 HG2 LYS 112 1HG LYS 112 2.317 -14.249 1.611 858 HG3 LYS 112 2HG LYS 112 3.885 -13.481 1.373 859 HD2 LYS 112 1HD LYS 112 4.992 -15.415 2.439 860 HD3 LYS 112 2HD LYS 112 3.421 -16.191 2.649 861 HE2 LYS 112 1HE LYS 112 3.082 -16.182 0.208 862 HE3 LYS 112 2HE LYS 112 4.643 -15.390 -0.011 863 HZ1 LYS 112 3HZ LYS 112 5.336 -17.480 1.488 864 HZ2 LYS 112 1HZ LYS 112 5.363 -17.493 -0.207 865 HZ3 LYS 112 2HZ LYS 112 4.037 -18.154 0.624 866 H LEU 113 H LEU 113 1.468 -10.800 1.626 867 HA LEU 113 HA LEU 113 -1.121 -12.196 1.990 868 HB2 LEU 113 1HB LEU 113 -0.695 -9.209 2.097 869 HB3 LEU 113 2HB LEU 113 -2.273 -9.957 1.879 870 HG LEU 113 HG LEU 113 -0.421 -10.442 4.212 871 HD11 LEU 113 1HD1 LEU 113 -3.012 -8.896 4.229 872 HD12 LEU 113 2HD1 LEU 113 -1.439 -8.124 4.039 873 HD13 LEU 113 3HD1 LEU 113 -1.812 -9.008 5.518 874 HD21 LEU 113 3HD2 LEU 113 -1.709 -12.341 4.325 875 HD22 LEU 113 1HD2 LEU 113 -2.996 -11.658 3.340 876 HD23 LEU 113 2HD2 LEU 113 -2.887 -11.258 5.053 877 H VAL 114 H VAL 114 -2.720 -11.399 0.295 878 HA VAL 114 HA VAL 114 -1.339 -11.006 -2.312 879 HB VAL 114 HB VAL 114 -3.672 -12.813 -1.624 880 HG11 VAL 114 1HG1 VAL 114 -3.517 -13.377 -4.117 881 HG12 VAL 114 2HG1 VAL 114 -2.579 -11.894 -4.289 882 HG13 VAL 114 3HG1 VAL 114 -4.246 -11.822 -3.716 883 HG21 VAL 114 3HG2 VAL 114 -1.218 -13.546 -1.265 884 HG22 VAL 114 1HG2 VAL 114 -1.097 -13.539 -3.026 885 HG23 VAL 114 2HG2 VAL 114 -2.248 -14.606 -2.223 886 H PHE 115 H PHE 115 -2.078 -9.290 -3.454 887 HA PHE 115 HA PHE 115 -4.730 -8.179 -2.793 888 HB2 PHE 115 1HB PHE 115 -2.146 -6.729 -3.351 889 HB3 PHE 115 2HB PHE 115 -3.725 -5.947 -3.381 890 HD1 PHE 115 HD1 PHE 115 -5.116 -5.824 -1.329 891 HD2 PHE 115 HD2 PHE 115 -1.114 -7.379 -1.286 892 HE1 PHE 115 HE1 PHE 115 -5.069 -5.632 1.132 893 HE2 PHE 115 HE2 PHE 115 -1.059 -7.165 1.178 894 HZ PHE 115 HZ PHE 115 -3.030 -6.317 2.403 895 H GLN 116 H GLN 116 -6.007 -7.581 -4.429 896 HA GLN 116 HA GLN 116 -5.072 -8.069 -7.186 897 HB2 GLN 116 1HB GLN 116 -7.786 -8.364 -5.931 898 HB3 GLN 116 2HB GLN 116 -7.554 -8.328 -7.676 899 HG2 GLN 116 1HG GLN 116 -5.960 -10.215 -5.942 900 HG3 GLN 116 2HG GLN 116 -7.580 -10.641 -6.485 901 HE21 GLN 116 2HE2 GLN 116 -5.885 -8.617 -8.707 902 HE22 GLN 116 1HE2 GLN 116 -5.428 -9.834 -9.798 903 H LEU 117 H LEU 117 -4.308 -6.000 -7.644 904 HA LEU 117 HA LEU 117 -6.088 -3.695 -7.284 905 HB2 LEU 117 1HB LEU 117 -3.409 -3.540 -8.639 906 HB3 LEU 117 2HB LEU 117 -4.181 -2.376 -7.573 907 HG LEU 117 HG LEU 117 -2.979 -5.036 -6.753 908 HD11 LEU 117 1HD1 LEU 117 -2.131 -2.285 -5.855 909 HD12 LEU 117 2HD1 LEU 117 -1.474 -3.004 -7.324 910 HD13 LEU 117 3HD1 LEU 117 -1.233 -3.797 -5.768 911 HD21 LEU 117 3HD2 LEU 117 -4.674 -3.003 -5.305 912 HD22 LEU 117 1HD2 LEU 117 -3.443 -3.899 -4.413 913 HD23 LEU 117 2HD2 LEU 117 -4.739 -4.766 -5.234 914 HA PRO 118 HA PRO 118 -7.544 -3.864 -11.486 915 HB2 PRO 118 1HB PRO 118 -8.039 -1.241 -12.043 916 HB3 PRO 118 2HB PRO 118 -9.011 -2.172 -10.884 917 HG2 PRO 118 1HG PRO 118 -6.752 -0.283 -10.361 918 HG3 PRO 118 2HG PRO 118 -8.323 -0.401 -9.544 919 HD2 PRO 118 1HD PRO 118 -6.068 -1.483 -8.487 920 HD3 PRO 118 2HD PRO 118 -7.664 -2.226 -8.250 921 H PHE 119 H PHE 119 -6.618 -4.074 -13.469 922 HA PHE 119 HA PHE 119 -4.034 -3.754 -14.083 923 HB2 PHE 119 1HB PHE 119 -5.705 -5.044 -15.352 924 HB3 PHE 119 2HB PHE 119 -6.335 -3.534 -16.013 925 HD1 PHE 119 HD1 PHE 119 -3.258 -5.626 -15.753 926 HD2 PHE 119 HD2 PHE 119 -5.292 -2.489 -17.871 927 HE1 PHE 119 HE1 PHE 119 -1.506 -5.671 -17.509 928 HE2 PHE 119 HE2 PHE 119 -3.539 -2.537 -19.626 929 HZ PHE 119 HZ PHE 119 -1.646 -4.127 -19.444 930 H GLY 120 H GLY 120 -2.674 -2.330 -14.731 931 HA2 GLY 120 1HA GLY 120 -1.772 -0.222 -14.979 932 HA3 GLY 120 2HA GLY 120 -2.820 -0.229 -16.391 933 H SER 121 H SER 121 -3.714 1.717 -16.506 934 HA SER 121 HA SER 121 -4.857 3.620 -15.928 935 HB2 SER 121 1HB SER 121 -6.608 1.918 -15.482 936 HB3 SER 121 2HB SER 121 -6.043 1.799 -13.819 937 HG SER 121 HG SER 121 -7.372 3.399 -13.507 938 H HIS 122 H HIS 122 -5.512 3.103 -12.696 939 HA HIS 122 HA HIS 122 -3.534 5.084 -11.897 940 HB2 HIS 122 1HB HIS 122 -6.036 5.014 -11.219 941 HB3 HIS 122 2HB HIS 122 -5.542 3.775 -10.069 942 HD2 HIS 122 HD2 HIS 122 -5.114 5.039 -7.670 943 HE1 HIS 122 HE1 HIS 122 -3.342 8.581 -9.134 944 HE2 HIS 122 HE2 HIS 122 -4.030 7.332 -7.033 945 H THR 123 H THR 123 -3.674 1.711 -12.026 946 HA THR 123 HA THR 123 -2.176 1.192 -9.599 947 HB THR 123 HB THR 123 -2.862 -0.590 -11.943 948 HG1 THR 123 HG1 THR 123 -4.440 -1.327 -10.605 949 HG21 THR 123 3HG2 THR 123 -2.244 -2.399 -10.243 950 HG22 THR 123 1HG2 THR 123 -1.466 -1.123 -9.312 951 HG23 THR 123 2HG2 THR 123 -0.898 -1.505 -10.937 952 H ARG 124 H ARG 124 -1.447 1.674 -13.034 953 HA ARG 124 HA ARG 124 1.077 0.521 -13.168 954 HB2 ARG 124 1HB ARG 124 -0.188 1.441 -15.095 955 HB3 ARG 124 2HB ARG 124 0.149 3.068 -14.514 956 HG2 ARG 124 1HG ARG 124 2.574 2.632 -14.723 957 HG3 ARG 124 2HG ARG 124 2.225 1.008 -15.313 958 HD2 ARG 124 1HD ARG 124 1.221 3.538 -16.634 959 HD3 ARG 124 2HD ARG 124 2.679 2.686 -17.131 960 HE ARG 124 HE ARG 124 0.544 0.846 -17.080 961 HH11 ARG 124 1HH2 ARG 124 1.637 3.661 -18.767 962 HH12 ARG 124 2HH2 ARG 124 0.880 3.228 -20.264 963 HH21 ARG 124 1HH1 ARG 124 -0.451 0.269 -19.037 964 HH22 ARG 124 2HH1 ARG 124 -0.302 1.306 -20.417 965 H THR 125 H THR 125 0.205 3.818 -12.224 966 HA THR 125 HA THR 125 2.788 4.820 -11.875 967 HB THR 125 HB THR 125 1.121 6.463 -11.805 968 HG1 THR 125 HG1 THR 125 1.274 6.211 -9.045 969 HG21 THR 125 3HG2 THR 125 -0.806 6.281 -10.167 970 HG22 THR 125 1HG2 THR 125 -0.276 4.629 -9.852 971 HG23 THR 125 2HG2 THR 125 -0.815 5.089 -11.468 972 H PHE 126 H PHE 126 0.667 3.058 -9.664 973 HA PHE 126 HA PHE 126 2.183 3.315 -7.330 974 HB2 PHE 126 1HB PHE 126 -0.107 2.369 -7.447 975 HB3 PHE 126 2HB PHE 126 0.553 0.920 -8.199 976 HD1 PHE 126 HD1 PHE 126 1.084 3.110 -5.196 977 HD2 PHE 126 HD2 PHE 126 1.169 -0.867 -6.813 978 HE1 PHE 126 HE1 PHE 126 1.605 2.207 -2.952 979 HE2 PHE 126 HE2 PHE 126 1.703 -1.768 -4.566 980 HZ PHE 126 HZ PHE 126 1.920 -0.230 -2.634 981 H LEU 127 H LEU 127 2.273 0.623 -9.740 982 HA LEU 127 HA LEU 127 4.223 -0.906 -8.603 983 HB2 LEU 127 1HB LEU 127 4.153 -0.319 -11.571 984 HB3 LEU 127 2HB LEU 127 4.685 -1.800 -10.776 985 HG LEU 127 HG LEU 127 1.863 -0.710 -10.829 986 HD11 LEU 127 1HD1 LEU 127 3.224 -3.037 -12.198 987 HD12 LEU 127 2HD1 LEU 127 2.411 -1.666 -12.955 988 HD13 LEU 127 3HD1 LEU 127 1.471 -2.882 -12.086 989 HD21 LEU 127 3HD2 LEU 127 3.132 -3.066 -9.419 990 HD22 LEU 127 1HD2 LEU 127 1.413 -3.055 -9.815 991 HD23 LEU 127 2HD2 LEU 127 2.078 -1.826 -8.742 992 H GLN 128 H GLN 128 4.828 1.763 -10.961 993 HA GLN 128 HA GLN 128 7.599 1.561 -10.897 994 HB2 GLN 128 1HB GLN 128 5.759 3.854 -11.534 995 HB3 GLN 128 2HB GLN 128 7.496 3.844 -11.868 996 HG2 GLN 128 1HG GLN 128 7.267 1.878 -13.275 997 HG3 GLN 128 2HG GLN 128 5.560 1.734 -12.851 998 HE21 GLN 128 2HE2 GLN 128 4.070 3.233 -13.775 999 HE22 GLN 128 1HE2 GLN 128 4.506 4.228 -15.066 1000 H GLU 129 H GLU 129 5.393 3.586 -8.980 1001 HA GLU 129 HA GLU 129 7.367 5.145 -7.718 1002 HB2 GLU 129 1HB GLU 129 4.518 4.429 -7.108 1003 HB3 GLU 129 2HB GLU 129 5.466 5.249 -5.871 1004 HG2 GLU 129 1HG GLU 129 4.209 6.834 -7.326 1005 HG3 GLU 129 2HG GLU 129 5.951 7.086 -7.388 1006 H VAL 130 H VAL 130 5.890 2.048 -6.730 1007 HA VAL 130 HA VAL 130 7.232 1.879 -4.233 1008 HB VAL 130 HB VAL 130 6.054 -0.247 -6.036 1009 HG11 VAL 130 1HG1 VAL 130 7.633 -1.394 -4.657 1010 HG12 VAL 130 2HG1 VAL 130 6.072 -1.598 -3.863 1011 HG13 VAL 130 3HG1 VAL 130 7.225 -0.413 -3.250 1012 HG21 VAL 130 3HG2 VAL 130 5.050 0.995 -3.455 1013 HG22 VAL 130 1HG2 VAL 130 4.186 -0.158 -4.473 1014 HG23 VAL 130 2HG2 VAL 130 4.510 1.472 -5.065 1015 H ALA 131 H ALA 131 7.942 0.515 -7.415 1016 HA ALA 131 HA ALA 131 10.208 -0.963 -6.829 1017 HB1 ALA 131 3HB ALA 131 9.499 0.586 -9.321 1018 HB2 ALA 131 1HB ALA 131 9.241 -1.130 -9.006 1019 HB3 ALA 131 2HB ALA 131 10.878 -0.509 -9.223 1020 H ARG 132 H ARG 132 10.072 2.487 -7.723 1021 HA ARG 132 HA ARG 132 12.920 2.830 -7.509 1022 HB2 ARG 132 1HB ARG 132 10.645 4.813 -7.699 1023 HB3 ARG 132 2HB ARG 132 12.349 5.273 -7.680 1024 HG2 ARG 132 1HG ARG 132 12.767 3.947 -9.690 1025 HG3 ARG 132 2HG ARG 132 11.099 3.375 -9.689 1026 HD2 ARG 132 1HD ARG 132 11.325 5.204 -11.289 1027 HD3 ARG 132 2HD ARG 132 10.319 5.721 -9.939 1028 HE ARG 132 HE ARG 132 12.019 7.193 -9.274 1029 HH11 ARG 132 1HH2 ARG 132 13.049 5.077 -11.813 1030 HH12 ARG 132 2HH2 ARG 132 14.501 5.960 -12.146 1031 HH21 ARG 132 1HH1 ARG 132 13.918 8.357 -9.710 1032 HH22 ARG 132 2HH1 ARG 132 14.993 7.817 -10.956 1033 H ALA 133 H ALA 133 10.314 2.792 -5.303 1034 HA ALA 133 HA ALA 133 11.186 4.567 -3.318 1035 HB1 ALA 133 3HB ALA 133 8.954 3.302 -3.541 1036 HB2 ALA 133 1HB ALA 133 9.595 3.560 -1.920 1037 HB3 ALA 133 2HB ALA 133 9.770 1.987 -2.698 1038 H CYS 134 H CYS 134 12.447 1.497 -4.233 1039 HA CYS 134 HA CYS 134 14.824 1.511 -3.030 1040 HB2 CYS 134 1HB CYS 134 14.313 1.882 -0.809 1041 HB3 CYS 134 2HB CYS 134 12.780 1.027 -0.897 1042 HG CYS 134 HG CYS 134 15.478 -0.212 -0.163 1043 HA PRO 135 HA PRO 135 13.777 -3.242 -2.833 1044 HB2 PRO 135 1HB PRO 135 11.228 -3.780 -3.921 1045 HB3 PRO 135 2HB PRO 135 11.668 -3.847 -2.203 1046 HG2 PRO 135 1HG PRO 135 10.361 -1.645 -3.735 1047 HG3 PRO 135 2HG PRO 135 10.051 -2.209 -2.081 1048 HD2 PRO 135 1HD PRO 135 11.429 0.032 -2.495 1049 HD3 PRO 135 2HD PRO 135 11.927 -1.095 -1.210 1050 H GLY 136 H GLY 136 11.468 -2.354 -5.335 1051 HA2 GLY 136 1HA GLY 136 11.645 -3.484 -7.516 1052 HA3 GLY 136 2HA GLY 136 12.229 -1.830 -7.646 1053 H PHE 137 H PHE 137 14.193 -1.530 -8.410 1054 HA PHE 137 HA PHE 137 16.354 -3.373 -7.940 1055 HB2 PHE 137 1HB PHE 137 15.187 -3.112 -10.718 1056 HB3 PHE 137 2HB PHE 137 16.794 -3.760 -10.387 1057 HD1 PHE 137 HD1 PHE 137 17.049 -5.824 -8.986 1058 HD2 PHE 137 HD2 PHE 137 13.210 -4.404 -10.292 1059 HE1 PHE 137 HE1 PHE 137 16.053 -8.033 -8.460 1060 HE2 PHE 137 HE2 PHE 137 12.214 -6.616 -9.767 1061 HZ PHE 137 HZ PHE 137 13.636 -8.429 -8.851 1062 H ASP 138 H ASP 138 16.067 -0.723 -7.219 1063 HA ASP 138 HA ASP 138 17.638 0.824 -9.185 1064 HB2 ASP 138 1HB ASP 138 16.031 1.586 -6.750 1065 HB3 ASP 138 2HB ASP 138 17.103 2.723 -7.559 1066 HA PRO 139 HA PRO 139 21.298 0.343 -6.720 1067 HB2 PRO 139 1HB PRO 139 22.727 2.568 -7.377 1068 HB3 PRO 139 2HB PRO 139 22.442 1.246 -8.527 1069 HG2 PRO 139 1HG PRO 139 21.032 3.871 -8.281 1070 HG3 PRO 139 2HG PRO 139 21.577 3.017 -9.738 1071 HD2 PRO 139 1HD PRO 139 18.977 2.955 -8.867 1072 HD3 PRO 139 2HD PRO 139 19.721 1.625 -9.781 1073 H GLU 140 H GLU 140 18.914 2.381 -5.867 1074 HA GLU 140 HA GLU 140 20.376 3.809 -3.738 1075 HB2 GLU 140 1HB GLU 140 18.378 5.123 -3.467 1076 HB3 GLU 140 2HB GLU 140 18.718 5.020 -5.195 1077 HG2 GLU 140 1HG GLU 140 17.129 3.033 -5.264 1078 HG3 GLU 140 2HG GLU 140 16.657 3.458 -3.622 1079 H THR 141 H THR 141 18.859 0.895 -4.198 1080 HA THR 141 HA THR 141 17.179 0.440 -2.075 1081 HB THR 141 HB THR 141 19.275 -1.489 -3.102 1082 HG1 THR 141 HG1 THR 141 17.256 -2.001 -4.424 1083 HG21 THR 141 3HG2 THR 141 17.102 -2.998 -2.715 1084 HG22 THR 141 1HG2 THR 141 16.749 -1.767 -1.506 1085 HG23 THR 141 2HG2 THR 141 18.246 -2.698 -1.411 1086 H ARG 142 H ARG 142 18.010 -1.352 -0.304 1087 HA ARG 142 HA ARG 142 18.972 -1.608 1.752 1088 HB2 ARG 142 1HB ARG 142 21.308 -0.490 0.203 1089 HB3 ARG 142 2HB ARG 142 21.441 -0.996 1.886 1090 HG2 ARG 142 1HG ARG 142 20.664 -3.246 1.294 1091 HG3 ARG 142 2HG ARG 142 20.475 -2.751 -0.388 1092 HD2 ARG 142 1HD ARG 142 22.882 -2.268 -0.531 1093 HD3 ARG 142 2HD ARG 142 23.080 -2.722 1.160 1094 HE ARG 142 HE ARG 142 22.899 -4.972 0.544 1095 HH11 ARG 142 1HH2 ARG 142 22.068 -2.843 -2.052 1096 HH12 ARG 142 2HH2 ARG 142 22.057 -4.088 -3.256 1097 HH21 ARG 142 1HH1 ARG 142 22.889 -6.612 -1.028 1098 HH22 ARG 142 2HH1 ARG 142 22.522 -6.224 -2.675 1099 H ASP 143 H ASP 143 19.449 -0.573 3.676 1100 HA ASP 143 HA ASP 143 19.564 1.153 5.210 1101 HB2 ASP 143 1HB ASP 143 21.086 2.160 3.333 1102 HB3 ASP 143 2HB ASP 143 19.700 3.193 3.004 1103 HA PRO 144 HA PRO 144 15.063 1.812 3.790 1104 HB2 PRO 144 1HB PRO 144 13.975 0.491 5.992 1105 HB3 PRO 144 2HB PRO 144 14.293 -0.264 4.419 1106 HG2 PRO 144 1HG PRO 144 15.959 -0.303 6.900 1107 HG3 PRO 144 2HG PRO 144 15.587 -1.624 5.776 1108 HD2 PRO 144 1HD PRO 144 17.952 -0.374 5.676 1109 HD3 PRO 144 2HD PRO 144 17.137 -0.880 4.179 1110 H GLU 145 H GLU 145 16.429 1.843 7.064 1111 HA GLU 145 HA GLU 145 16.296 3.367 8.786 1112 HB2 GLU 145 1HB GLU 145 17.409 4.747 7.031 1113 HB3 GLU 145 2HB GLU 145 15.821 5.324 6.527 1114 HG2 GLU 145 1HG GLU 145 15.426 6.244 8.772 1115 HG3 GLU 145 2HG GLU 145 16.998 5.647 9.302 1116 H PHE 146 H PHE 146 14.269 2.348 9.476 1117 HA PHE 146 HA PHE 146 11.818 3.858 8.832 1118 HB2 PHE 146 1HB PHE 146 10.734 1.925 10.106 1119 HB3 PHE 146 2HB PHE 146 11.479 1.533 8.557 1120 HD1 PHE 146 HD2 PHE 146 11.891 1.359 12.235 1121 HD2 PHE 146 HD1 PHE 146 13.463 0.179 8.417 1122 HE1 PHE 146 HE2 PHE 146 13.397 -0.260 13.355 1123 HE2 PHE 146 HE1 PHE 146 14.969 -1.438 9.536 1124 HZ PHE 146 HZ PHE 146 14.939 -1.661 12.005 1125 H GLU 147 H GLU 147 14.214 4.200 10.923 1126 HA GLU 147 HA GLU 147 13.222 4.178 13.507 1127 HB2 GLU 147 1HB GLU 147 15.577 4.601 12.869 1128 HB3 GLU 147 2HB GLU 147 15.117 6.208 12.312 1129 HG2 GLU 147 1HG GLU 147 14.411 6.836 14.553 1130 HG3 GLU 147 2HG GLU 147 14.709 5.200 15.140 1131 H TRP 148 H TRP 148 12.267 6.250 10.937 1132 HA TRP 148 HA TRP 148 11.287 8.363 12.688 1133 HB2 TRP 148 1HB TRP 148 10.489 9.426 10.605 1134 HB3 TRP 148 2HB TRP 148 12.205 9.038 10.549 1135 HD1 TRP 148 HD1 TRP 148 12.764 6.573 9.307 1136 HE1 TRP 148 HE1 TRP 148 11.701 5.619 7.166 1137 HE3 TRP 148 HE3 TRP 148 8.497 9.377 9.123 1138 HZ2 TRP 148 HZ2 TRP 148 9.351 6.001 5.576 1139 HZ3 TRP 148 HZ3 TRP 148 6.869 9.066 7.280 1140 HH2 TRP 148 HH2 TRP 148 7.289 7.382 5.505 1141 H LEU 149 H LEU 149 10.095 5.413 11.395 1142 HA LEU 149 HA LEU 149 7.347 6.012 11.173 1143 HB2 LEU 149 1HB LEU 149 8.887 3.478 11.694 1144 HB3 LEU 149 2HB LEU 149 7.132 3.469 11.767 1145 HG LEU 149 HG LEU 149 8.167 2.857 9.522 1146 HD11 LEU 149 1HD1 LEU 149 6.395 3.766 8.318 1147 HD12 LEU 149 2HD1 LEU 149 6.420 5.288 9.201 1148 HD13 LEU 149 3HD1 LEU 149 5.777 3.835 9.965 1149 HD21 LEU 149 3HD2 LEU 149 8.578 5.822 9.223 1150 HD22 LEU 149 1HD2 LEU 149 9.122 4.536 8.152 1151 HD23 LEU 149 2HD2 LEU 149 9.884 4.755 9.725 1152 H SER 150 H SER 150 9.347 5.094 13.942 1153 HA SER 150 HA SER 150 7.483 4.483 15.847 1154 HB2 SER 150 1HB SER 150 9.965 6.187 16.131 1155 HB3 SER 150 2HB SER 150 9.036 5.573 17.494 1156 HG SER 150 HG SER 150 10.811 4.305 15.862 1157 H ARG 151 H ARG 151 7.995 7.518 14.258 1158 HA ARG 151 HA ARG 151 6.792 9.271 16.122 1159 HB2 ARG 151 1HB ARG 151 6.892 9.332 13.093 1160 HB3 ARG 151 2HB ARG 151 6.307 10.665 14.087 1161 HG2 ARG 151 1HG ARG 151 8.478 10.858 15.179 1162 HG3 ARG 151 2HG ARG 151 9.074 9.449 14.301 1163 HD2 ARG 151 1HD ARG 151 9.836 11.508 13.205 1164 HD3 ARG 151 2HD ARG 151 8.713 10.640 12.162 1165 HE ARG 151 HE ARG 151 7.148 12.354 12.466 1166 HH11 ARG 151 1HH2 ARG 151 9.873 12.684 14.575 1167 HH12 ARG 151 2HH2 ARG 151 9.454 14.283 15.091 1168 HH21 ARG 151 1HH1 ARG 151 6.587 14.443 13.146 1169 HH22 ARG 151 2HH1 ARG 151 7.592 15.280 14.282 1170 H HIS 152 H HIS 152 5.528 7.215 13.563 1171 HA HIS 152 HA HIS 152 2.793 8.031 13.956 1172 HB2 HIS 152 1HB HIS 152 4.065 5.764 12.406 1173 HB3 HIS 152 2HB HIS 152 2.329 6.077 12.429 1174 HD2 HIS 152 HD2 HIS 152 5.587 7.612 10.882 1175 HE1 HIS 152 HE1 HIS 152 2.299 9.863 9.489 1176 HE2 HIS 152 HE2 HIS 152 4.797 9.481 9.239 1177 H THR 153 H THR 153 1.187 6.887 14.962 1178 HA THR 153 HA THR 153 2.005 4.590 16.661 1179 HB THR 153 HB THR 153 1.670 6.527 18.098 1180 HG1 THR 153 HG1 THR 153 -0.306 4.533 18.039 1181 HG21 THR 153 3HG2 THR 153 0.213 7.743 16.420 1182 HG22 THR 153 1HG2 THR 153 -0.352 7.823 18.088 1183 HG23 THR 153 2HG2 THR 153 -1.122 6.719 16.950 1184 H CYS 154 H CYS 154 0.150 5.733 14.184 1185 HA CYS 154 HA CYS 154 -1.645 4.934 12.999 1186 HB2 CYS 154 1HB CYS 154 -1.122 2.307 14.387 1187 HB3 CYS 154 2HB CYS 154 -1.795 2.575 12.777 1188 HG CYS 154 HG CYS 154 0.631 2.152 12.201 1189 H ALA 155 H ALA 155 -3.839 4.057 13.170 1190 HA ALA 155 HA ALA 155 -5.361 5.180 15.136 1191 HB1 ALA 155 3HB ALA 155 -6.445 4.296 13.202 1192 HB2 ALA 155 1HB ALA 155 -7.086 3.405 14.582 1193 HB3 ALA 155 2HB ALA 155 -5.868 2.665 13.543 1194 H GLU 156 H GLU 156 -6.477 4.356 16.982 1195 HA GLU 156 HA GLU 156 -5.311 1.978 18.283 1196 HB2 GLU 156 1HB GLU 156 -5.331 3.459 20.433 1197 HB3 GLU 156 2HB GLU 156 -3.983 3.592 19.308 1198 HG2 GLU 156 1HG GLU 156 -4.822 5.602 18.365 1199 HG3 GLU 156 2HG GLU 156 -6.408 5.382 19.100 1200 HA PRO 157 HA PRO 157 -9.912 1.790 18.564 1201 HB2 PRO 157 1HB PRO 157 -9.143 -0.890 19.664 1202 HB3 PRO 157 2HB PRO 157 -10.395 -0.475 18.474 1203 HG2 PRO 157 1HG PRO 157 -8.121 -1.574 17.698 1204 HG3 PRO 157 2HG PRO 157 -8.874 -0.277 16.751 1205 HD2 PRO 157 1HD PRO 157 -6.493 -0.132 18.580 1206 HD3 PRO 157 2HD PRO 157 -6.780 0.697 17.030 1207 H ASP 158 H ASP 158 -11.365 1.530 20.350 1208 HA ASP 158 HA ASP 158 -10.101 2.115 22.973 1209 HB2 ASP 158 1HB ASP 158 -11.533 3.892 21.897 1210 HB3 ASP 158 2HB ASP 158 -12.906 2.804 22.092 1211 H ALA 159 H ALA 159 -9.997 0.224 24.048 1212 HA ALA 159 HA ALA 159 -11.871 -1.895 23.818 1213 HB1 ALA 159 3HB ALA 159 -9.554 -2.227 24.583 1214 HB2 ALA 159 1HB ALA 159 -10.712 -2.842 25.761 1215 HB3 ALA 159 2HB ALA 159 -9.905 -1.300 26.041 1216 H GLU 160 H GLU 160 -11.565 0.833 26.018 1217 HA GLU 160 HA GLU 160 -13.486 -0.006 27.928 1218 HB2 GLU 160 1HB GLU 160 -12.484 2.743 27.165 1219 HB3 GLU 160 2HB GLU 160 -13.556 2.434 28.532 1220 HG2 GLU 160 1HG GLU 160 -11.904 0.952 29.544 1221 HG3 GLU 160 2HG GLU 160 -10.847 1.127 28.145 1222 H SER 161 H SER 161 -13.736 1.701 24.868 1223 HA SER 161 HA SER 161 -16.397 2.630 25.159 1224 HB2 SER 161 1HB SER 161 -14.749 3.387 23.412 1225 HB3 SER 161 2HB SER 161 -15.023 1.859 22.579 1226 HG SER 161 HG SER 161 -16.933 2.536 21.971 Start of MODEL 3 1 H1 GLY 1 1H GLY 1 -21.449 17.949 -18.498 2 H2 GLY 1 2H GLY 1 -22.273 17.726 -17.029 3 H3 GLY 1 3H GLY 1 -21.074 16.623 -17.511 4 HA2 GLY 1 1HA GLY 1 -20.263 19.412 -17.275 5 HA3 GLY 1 2HA GLY 1 -20.600 18.547 -15.775 6 HA PRO 2 HA PRO 2 -16.311 17.542 -17.615 7 HB2 PRO 2 1HB PRO 2 -14.808 18.786 -15.657 8 HB3 PRO 2 2HB PRO 2 -15.293 19.570 -17.174 9 HG2 PRO 2 1HG PRO 2 -16.541 19.772 -14.463 10 HG3 PRO 2 2HG PRO 2 -16.218 21.049 -15.652 11 HD2 PRO 2 1HD PRO 2 -18.693 19.986 -15.353 12 HD3 PRO 2 2HD PRO 2 -18.091 20.505 -16.943 13 H LEU 3 H LEU 3 -15.157 15.783 -16.897 14 HA LEU 3 HA LEU 3 -16.268 14.228 -14.769 15 HB2 LEU 3 1HB LEU 3 -13.759 13.894 -16.425 16 HB3 LEU 3 2HB LEU 3 -14.325 12.698 -15.262 17 HG LEU 3 HG LEU 3 -16.002 13.728 -17.574 18 HD11 LEU 3 1HD1 LEU 3 -13.912 12.477 -18.269 19 HD12 LEU 3 2HD1 LEU 3 -15.422 11.725 -18.779 20 HD13 LEU 3 3HD1 LEU 3 -14.540 11.081 -17.394 21 HD21 LEU 3 3HD2 LEU 3 -16.377 11.642 -15.428 22 HD22 LEU 3 1HD2 LEU 3 -17.118 11.381 -17.006 23 HD23 LEU 3 2HD2 LEU 3 -17.536 12.807 -16.066 24 H GLY 4 H GLY 4 -15.669 14.062 -12.683 25 HA2 GLY 4 1HA GLY 4 -13.223 14.320 -11.499 26 HA3 GLY 4 2HA GLY 4 -13.815 15.977 -11.598 27 H SER 5 H SER 5 -13.452 13.769 -9.410 28 HA SER 5 HA SER 5 -15.626 14.683 -7.776 29 HB2 SER 5 1HB SER 5 -15.620 11.812 -8.729 30 HB3 SER 5 2HB SER 5 -16.544 12.382 -7.342 31 HG SER 5 HG SER 5 -17.377 14.008 -8.920 32 H MET 6 H MET 6 -15.013 11.638 -6.736 33 HA MET 6 HA MET 6 -13.054 12.559 -4.769 34 HB2 MET 6 1HB MET 6 -13.507 10.210 -3.806 35 HB3 MET 6 2HB MET 6 -14.831 11.374 -3.765 36 HG2 MET 6 1HG MET 6 -15.809 10.394 -5.778 37 HG3 MET 6 2HG MET 6 -14.442 9.292 -5.935 38 HE1 MET 6 3HE MET 6 -17.873 9.300 -2.957 39 HE2 MET 6 1HE MET 6 -17.281 10.601 -3.998 40 HE3 MET 6 2HE MET 6 -16.486 10.268 -2.463 41 H ASP 7 H ASP 7 -11.392 10.768 -4.092 42 HA ASP 7 HA ASP 7 -10.385 9.106 -6.201 43 HB2 ASP 7 1HB ASP 7 -9.628 11.459 -6.819 44 HB3 ASP 7 2HB ASP 7 -8.622 11.412 -5.372 45 H GLN 8 H GLN 8 -8.448 7.947 -5.516 46 HA GLN 8 HA GLN 8 -8.620 7.167 -2.760 47 HB2 GLN 8 1HB GLN 8 -6.480 6.468 -4.787 48 HB3 GLN 8 2HB GLN 8 -6.817 5.613 -3.284 49 HG2 GLN 8 1HG GLN 8 -8.755 5.904 -5.597 50 HG3 GLN 8 2HG GLN 8 -7.806 4.463 -5.241 51 HE21 GLN 8 2HE2 GLN 8 -10.619 4.296 -5.282 52 HE22 GLN 8 1HE2 GLN 8 -11.166 4.032 -3.700 53 H SER 9 H SER 9 -6.146 8.816 -4.698 54 HA SER 9 HA SER 9 -4.173 9.180 -2.791 55 HB2 SER 9 1HB SER 9 -3.454 11.141 -4.089 56 HB3 SER 9 2HB SER 9 -3.861 9.789 -5.139 57 HG SER 9 HG SER 9 -4.754 12.076 -5.506 58 H VAL 10 H VAL 10 -6.972 11.308 -3.429 59 HA VAL 10 HA VAL 10 -6.319 13.259 -1.498 60 HB VAL 10 HB VAL 10 -8.986 12.381 -2.636 61 HG11 VAL 10 1HG1 VAL 10 -8.239 14.694 -0.838 62 HG12 VAL 10 2HG1 VAL 10 -9.509 13.495 -0.595 63 HG13 VAL 10 3HG1 VAL 10 -9.682 14.718 -1.852 64 HG21 VAL 10 3HG2 VAL 10 -7.227 14.778 -3.242 65 HG22 VAL 10 1HG2 VAL 10 -8.725 14.341 -4.065 66 HG23 VAL 10 2HG2 VAL 10 -7.299 13.316 -4.226 67 H ALA 11 H ALA 11 -8.462 10.441 -1.338 68 HA ALA 11 HA ALA 11 -9.463 10.617 1.187 69 HB1 ALA 11 3HB ALA 11 -10.066 8.782 -0.300 70 HB2 ALA 11 1HB ALA 11 -9.504 8.132 1.240 71 HB3 ALA 11 2HB ALA 11 -8.444 8.108 -0.165 72 H ILE 12 H ILE 12 -6.296 9.212 0.327 73 HA ILE 12 HA ILE 12 -5.578 8.633 3.008 74 HB ILE 12 HB ILE 12 -3.733 9.123 0.665 75 HG12 ILE 12 1HG1 ILE 12 -5.378 7.458 0.016 76 HG13 ILE 12 2HG1 ILE 12 -3.867 6.631 0.379 77 HG21 ILE 12 1HG2 ILE 12 -2.319 7.454 1.948 78 HG22 ILE 12 2HG2 ILE 12 -3.437 7.657 3.296 79 HG23 ILE 12 3HG2 ILE 12 -2.496 9.030 2.717 80 HD11 ILE 12 3HD1 ILE 12 -6.416 6.702 1.978 81 HD12 ILE 12 1HD1 ILE 12 -4.882 6.385 2.790 82 HD13 ILE 12 2HD1 ILE 12 -5.441 5.311 1.510 83 H GLN 13 H GLN 13 -4.712 11.272 0.840 84 HA GLN 13 HA GLN 13 -2.982 12.695 2.415 85 HB2 GLN 13 1HB GLN 13 -3.992 13.203 0.013 86 HB3 GLN 13 2HB GLN 13 -5.079 14.251 0.925 87 HG2 GLN 13 1HG GLN 13 -3.288 15.681 0.442 88 HG3 GLN 13 2HG GLN 13 -2.899 15.120 2.063 89 HE21 GLN 13 2HE2 GLN 13 -0.785 14.356 2.296 90 HE22 GLN 13 1HE2 GLN 13 0.168 13.753 1.028 91 H GLU 14 H GLU 14 -6.565 12.975 2.465 92 HA GLU 14 HA GLU 14 -6.660 14.920 4.514 93 HB2 GLU 14 1HB GLU 14 -8.679 12.846 3.629 94 HB3 GLU 14 2HB GLU 14 -9.032 14.156 4.757 95 HG2 GLU 14 1HG GLU 14 -8.455 15.816 3.065 96 HG3 GLU 14 2HG GLU 14 -7.987 14.543 1.940 97 H THR 15 H THR 15 -6.978 11.401 4.582 98 HA THR 15 HA THR 15 -7.347 11.201 7.400 99 HB THR 15 HB THR 15 -6.945 8.805 7.095 100 HG1 THR 15 HG1 THR 15 -6.449 8.170 4.878 101 HG21 THR 15 3HG2 THR 15 -8.662 10.266 5.098 102 HG22 THR 15 1HG2 THR 15 -9.151 9.326 6.510 103 HG23 THR 15 2HG2 THR 15 -8.566 8.508 5.061 104 H LEU 16 H LEU 16 -4.484 11.296 5.360 105 HA LEU 16 HA LEU 16 -2.621 10.167 7.092 106 HB2 LEU 16 1HB LEU 16 -2.281 10.911 4.677 107 HB3 LEU 16 2HB LEU 16 -2.051 12.538 5.300 108 HG LEU 16 HG LEU 16 -0.147 11.748 6.673 109 HD11 LEU 16 1HD1 LEU 16 0.678 9.331 5.844 110 HD12 LEU 16 2HD1 LEU 16 -1.057 9.083 5.644 111 HD13 LEU 16 3HD1 LEU 16 -0.401 9.517 7.223 112 HD21 LEU 16 3HD2 LEU 16 0.447 12.599 4.529 113 HD22 LEU 16 1HD2 LEU 16 -0.123 11.144 3.709 114 HD23 LEU 16 2HD2 LEU 16 1.342 11.089 4.692 115 H VAL 17 H VAL 17 -1.342 13.203 6.780 116 HA VAL 17 HA VAL 17 -2.465 14.555 9.003 117 HB VAL 17 HB VAL 17 -1.422 12.836 10.351 118 HG11 VAL 17 1HG1 VAL 17 1.163 12.692 10.218 119 HG12 VAL 17 2HG1 VAL 17 0.986 13.419 8.621 120 HG13 VAL 17 3HG1 VAL 17 0.231 11.865 8.972 121 HG21 VAL 17 3HG2 VAL 17 0.375 15.276 10.402 122 HG22 VAL 17 1HG2 VAL 17 -0.072 14.243 11.760 123 HG23 VAL 17 2HG2 VAL 17 -1.281 15.284 11.009 124 H GLU 18 H GLU 18 -1.580 16.642 9.228 125 HA GLU 18 HA GLU 18 -0.374 17.660 6.892 126 HB2 GLU 18 1HB GLU 18 -0.797 18.856 9.630 127 HB3 GLU 18 2HB GLU 18 -0.188 19.768 8.248 128 HG2 GLU 18 1HG GLU 18 -2.213 19.264 6.978 129 HG3 GLU 18 2HG GLU 18 -2.815 18.256 8.294 130 H GLY 19 H GLY 19 1.652 17.206 6.308 131 HA2 GLY 19 1HA GLY 19 3.946 18.236 7.075 132 HA3 GLY 19 2HA GLY 19 3.777 17.038 8.352 133 H GLU 20 H GLU 20 2.475 15.110 6.488 134 HA GLU 20 HA GLU 20 4.958 14.060 5.314 135 HB2 GLU 20 1HB GLU 20 2.287 12.825 5.962 136 HB3 GLU 20 2HB GLU 20 3.496 11.989 4.985 137 HG2 GLU 20 1HG GLU 20 5.134 12.165 6.783 138 HG3 GLU 20 2HG GLU 20 4.008 13.109 7.757 139 H TYR 21 H TYR 21 4.306 12.564 3.296 140 HA TYR 21 HA TYR 21 2.790 14.191 1.346 141 HB2 TYR 21 1HB TYR 21 5.261 14.705 1.287 142 HB3 TYR 21 2HB TYR 21 5.524 13.022 0.832 143 HD1 TYR 21 HD2 TYR 21 4.153 16.269 -0.246 144 HD2 TYR 21 HD1 TYR 21 4.855 12.175 -1.337 145 HE1 TYR 21 HE2 TYR 21 3.691 16.822 -2.619 146 HE2 TYR 21 HE1 TYR 21 4.397 12.727 -3.709 147 HH TYR 21 HH TYR 21 2.899 14.753 -4.864 148 H CYS 22 H CYS 22 1.373 12.960 0.296 149 HA CYS 22 HA CYS 22 1.750 10.043 0.228 150 HB2 CYS 22 1HB CYS 22 -0.473 10.652 0.819 151 HB3 CYS 22 2HB CYS 22 -0.569 11.854 -0.463 152 HG CYS 22 HG CYS 22 -0.917 8.811 -0.825 153 H VAL 23 H VAL 23 2.096 8.929 -1.696 154 HA VAL 23 HA VAL 23 2.946 10.603 -3.974 155 HB VAL 23 HB VAL 23 3.566 7.704 -3.379 156 HG11 VAL 23 1HG1 VAL 23 5.334 8.030 -5.058 157 HG12 VAL 23 2HG1 VAL 23 4.813 9.696 -5.300 158 HG13 VAL 23 3HG1 VAL 23 3.754 8.365 -5.762 159 HG21 VAL 23 3HG2 VAL 23 5.095 10.253 -2.796 160 HG22 VAL 23 1HG2 VAL 23 5.817 8.645 -2.746 161 HG23 VAL 23 2HG2 VAL 23 4.521 9.064 -1.627 162 H ILE 24 H ILE 24 1.161 7.607 -3.225 163 HA ILE 24 HA ILE 24 -0.737 8.100 -5.304 164 HB ILE 24 HB ILE 24 0.992 7.447 -6.806 165 HG12 ILE 24 1HG1 ILE 24 0.118 5.406 -7.798 166 HG13 ILE 24 2HG1 ILE 24 -0.641 4.942 -6.286 167 HG21 ILE 24 1HG2 ILE 24 2.516 6.463 -5.125 168 HG22 ILE 24 2HG2 ILE 24 2.315 5.393 -6.511 169 HG23 ILE 24 3HG2 ILE 24 1.469 5.051 -5.007 170 HD11 ILE 24 3HD1 ILE 24 -2.078 6.097 -8.146 171 HD12 ILE 24 1HD1 ILE 24 -1.348 7.581 -7.537 172 HD13 ILE 24 2HD1 ILE 24 -2.310 6.562 -6.464 173 H ALA 25 H ALA 25 -2.562 7.277 -4.565 174 HA ALA 25 HA ALA 25 -2.481 5.060 -2.618 175 HB1 ALA 25 3HB ALA 25 -4.800 5.732 -2.115 176 HB2 ALA 25 1HB ALA 25 -4.695 6.977 -3.357 177 HB3 ALA 25 2HB ALA 25 -3.677 7.075 -1.922 178 H VAL 26 H VAL 26 -4.461 3.610 -2.785 179 HA VAL 26 HA VAL 26 -5.610 3.133 -5.352 180 HB VAL 26 HB VAL 26 -4.298 0.653 -5.039 181 HG11 VAL 26 1HG1 VAL 26 -4.870 1.708 -7.193 182 HG12 VAL 26 2HG1 VAL 26 -3.190 1.181 -7.149 183 HG13 VAL 26 3HG1 VAL 26 -3.581 2.888 -6.953 184 HG21 VAL 26 3HG2 VAL 26 -2.678 2.078 -3.554 185 HG22 VAL 26 1HG2 VAL 26 -2.122 2.729 -5.095 186 HG23 VAL 26 2HG2 VAL 26 -2.005 1.004 -4.772 187 H GLN 27 H GLN 27 -6.788 0.944 -5.299 188 HA GLN 27 HA GLN 27 -7.518 0.168 -2.548 189 HB2 GLN 27 1HB GLN 27 -9.136 1.862 -3.689 190 HB3 GLN 27 2HB GLN 27 -9.617 0.495 -4.689 191 HG2 GLN 27 1HG GLN 27 -9.611 0.343 -1.659 192 HG3 GLN 27 2HG GLN 27 -10.999 0.920 -2.572 193 HE21 GLN 27 2HE2 GLN 27 -11.255 -1.435 -1.035 194 HE22 GLN 27 1HE2 GLN 27 -11.411 -2.761 -2.085 195 H GLY 28 H GLY 28 -7.253 -1.922 -2.313 196 HA2 GLY 28 1HA GLY 28 -7.802 -3.724 -4.612 197 HA3 GLY 28 2HA GLY 28 -6.305 -3.871 -3.695 198 H VAL 29 H VAL 29 -8.013 -5.983 -3.950 199 HA VAL 29 HA VAL 29 -9.437 -6.182 -1.372 200 HB VAL 29 HB VAL 29 -9.496 -8.280 -3.543 201 HG11 VAL 29 1HG1 VAL 29 -11.761 -8.642 -2.620 202 HG12 VAL 29 2HG1 VAL 29 -11.517 -7.305 -1.499 203 HG13 VAL 29 3HG1 VAL 29 -10.541 -8.766 -1.355 204 HG21 VAL 29 3HG2 VAL 29 -11.051 -5.681 -3.446 205 HG22 VAL 29 1HG2 VAL 29 -11.533 -7.069 -4.420 206 HG23 VAL 29 2HG2 VAL 29 -10.005 -6.249 -4.746 207 H LEU 30 H LEU 30 -9.201 -8.299 -0.299 208 HA LEU 30 HA LEU 30 -6.645 -9.675 -0.698 209 HB2 LEU 30 1HB LEU 30 -6.113 -7.916 0.948 210 HB3 LEU 30 2HB LEU 30 -7.458 -8.434 1.957 211 HG LEU 30 HG LEU 30 -5.584 -10.627 1.210 212 HD11 LEU 30 1HD1 LEU 30 -3.970 -9.849 3.054 213 HD12 LEU 30 2HD1 LEU 30 -4.669 -8.250 2.834 214 HD13 LEU 30 3HD1 LEU 30 -3.848 -9.041 1.494 215 HD21 LEU 30 3HD2 LEU 30 -7.404 -10.928 2.853 216 HD22 LEU 30 1HD2 LEU 30 -6.711 -9.652 3.858 217 HD23 LEU 30 2HD2 LEU 30 -5.828 -11.157 3.612 218 H CYS 31 H CYS 31 -7.200 -11.807 -0.766 219 HA CYS 31 HA CYS 31 -9.694 -12.622 0.571 220 HB2 CYS 31 1HB CYS 31 -9.704 -13.133 -1.760 221 HB3 CYS 31 2HB CYS 31 -8.071 -13.795 -1.691 222 HG CYS 31 HG CYS 31 -9.091 -15.747 -0.147 223 H LYS 32 H LYS 32 -9.679 -13.940 2.233 224 HA LYS 32 HA LYS 32 -7.273 -15.565 2.797 225 HB2 LYS 32 1HB LYS 32 -7.499 -13.448 4.287 226 HB3 LYS 32 2HB LYS 32 -8.862 -14.286 5.029 227 HG2 LYS 32 1HG LYS 32 -7.301 -16.276 5.353 228 HG3 LYS 32 2HG LYS 32 -5.978 -15.205 4.898 229 HD2 LYS 32 1HD LYS 32 -7.895 -14.770 7.208 230 HD3 LYS 32 2HD LYS 32 -6.219 -15.300 7.344 231 HE2 LYS 32 1HE LYS 32 -5.625 -13.137 6.069 232 HE3 LYS 32 2HE LYS 32 -7.265 -12.619 6.461 233 HZ1 LYS 32 3HZ LYS 32 -5.653 -13.723 8.627 234 HZ2 LYS 32 1HZ LYS 32 -6.809 -12.483 8.661 235 HZ3 LYS 32 2HZ LYS 32 -5.245 -12.170 8.073 236 H GLY 33 H GLY 33 -7.771 -17.638 3.076 237 HA2 GLY 33 1HA GLY 33 -9.024 -19.557 3.304 238 HA3 GLY 33 2HA GLY 33 -9.993 -18.641 4.455 239 H ASP 34 H ASP 34 -12.079 -18.650 3.951 240 HA ASP 34 HA ASP 34 -12.892 -18.522 1.093 241 HB2 ASP 34 1HB ASP 34 -13.406 -20.703 2.212 242 HB3 ASP 34 2HB ASP 34 -14.393 -19.829 3.378 243 H SER 35 H SER 35 -12.285 -16.330 2.869 244 HA SER 35 HA SER 35 -14.918 -14.982 2.890 245 HB2 SER 35 1HB SER 35 -14.180 -15.720 5.219 246 HB3 SER 35 2HB SER 35 -12.829 -14.599 5.050 247 HG SER 35 HG SER 35 -14.932 -13.851 6.035 248 H ARG 36 H ARG 36 -14.834 -13.126 1.753 249 HA ARG 36 HA ARG 36 -12.231 -12.162 0.857 250 HB2 ARG 36 1HB ARG 36 -14.381 -12.435 -0.593 251 HB3 ARG 36 2HB ARG 36 -14.877 -10.914 0.144 252 HG2 ARG 36 1HG ARG 36 -13.750 -10.108 -1.724 253 HG3 ARG 36 2HG ARG 36 -12.431 -10.134 -0.557 254 HD2 ARG 36 1HD ARG 36 -11.559 -11.191 -2.502 255 HD3 ARG 36 2HD ARG 36 -11.939 -12.513 -1.400 256 HE ARG 36 HE ARG 36 -14.148 -11.934 -3.116 257 HH11 ARG 36 1HH2 ARG 36 -11.028 -13.424 -2.953 258 HH12 ARG 36 2HH2 ARG 36 -11.356 -14.567 -4.212 259 HH21 ARG 36 1HH1 ARG 36 -14.582 -13.422 -4.768 260 HH22 ARG 36 2HH1 ARG 36 -13.370 -14.566 -5.240 261 H GLN 37 H GLN 37 -11.407 -10.133 1.203 262 HA GLN 37 HA GLN 37 -12.749 -8.438 3.228 263 HB2 GLN 37 1HB GLN 37 -9.856 -9.325 3.160 264 HB3 GLN 37 2HB GLN 37 -10.469 -8.028 4.188 265 HG2 GLN 37 1HG GLN 37 -11.925 -9.519 5.361 266 HG3 GLN 37 2HG GLN 37 -11.657 -10.808 4.190 267 HE21 GLN 37 2HE2 GLN 37 -9.642 -11.997 4.301 268 HE22 GLN 37 1HE2 GLN 37 -8.604 -11.847 5.632 269 H SER 38 H SER 38 -12.321 -6.265 3.084 270 HA SER 38 HA SER 38 -11.175 -5.354 0.491 271 HB2 SER 38 1HB SER 38 -12.760 -3.669 0.362 272 HB3 SER 38 2HB SER 38 -13.693 -4.951 1.129 273 HG SER 38 HG SER 38 -13.907 -3.680 2.777 274 H ARG 39 H ARG 39 -9.392 -4.199 0.542 275 HA ARG 39 HA ARG 39 -8.689 -2.696 3.000 276 HB2 ARG 39 1HB ARG 39 -6.964 -4.592 1.408 277 HB3 ARG 39 2HB ARG 39 -6.285 -3.366 2.473 278 HG2 ARG 39 1HG ARG 39 -7.517 -4.295 4.376 279 HG3 ARG 39 2HG ARG 39 -8.274 -5.493 3.321 280 HD2 ARG 39 1HD ARG 39 -6.057 -6.398 2.762 281 HD3 ARG 39 2HD ARG 39 -5.297 -5.215 3.820 282 HE ARG 39 HE ARG 39 -6.728 -7.620 4.628 283 HH11 ARG 39 1HH2 ARG 39 -5.443 -4.527 5.495 284 HH12 ARG 39 2HH2 ARG 39 -5.334 -4.891 7.184 285 HH21 ARG 39 1HH1 ARG 39 -6.576 -8.110 6.843 286 HH22 ARG 39 2HH1 ARG 39 -5.973 -6.920 7.948 287 H LEU 40 H LEU 40 -7.354 -0.929 2.712 288 HA LEU 40 HA LEU 40 -7.286 0.166 -0.053 289 HB2 LEU 40 1HB LEU 40 -8.958 1.321 1.350 290 HB3 LEU 40 2HB LEU 40 -7.723 1.662 2.548 291 HG LEU 40 HG LEU 40 -6.464 2.868 0.603 292 HD11 LEU 40 1HD1 LEU 40 -7.891 3.738 -1.159 293 HD12 LEU 40 2HD1 LEU 40 -9.287 2.891 -0.498 294 HD13 LEU 40 3HD1 LEU 40 -7.956 1.985 -1.197 295 HD21 LEU 40 3HD2 LEU 40 -7.326 4.181 2.390 296 HD22 LEU 40 1HD2 LEU 40 -8.993 3.863 1.917 297 HD23 LEU 40 2HD2 LEU 40 -7.978 4.916 0.929 298 H LEU 41 H LEU 41 -5.292 0.615 -0.820 299 HA LEU 41 HA LEU 41 -3.019 0.487 1.022 300 HB2 LEU 41 1HB LEU 41 -3.315 0.432 -1.983 301 HB3 LEU 41 2HB LEU 41 -1.744 0.588 -1.201 302 HG LEU 41 HG LEU 41 -2.259 -1.512 0.095 303 HD11 LEU 41 1HD1 LEU 41 -4.615 -1.696 0.046 304 HD12 LEU 41 2HD1 LEU 41 -4.075 -2.948 -1.068 305 HD13 LEU 41 3HD1 LEU 41 -4.692 -1.419 -1.694 306 HD21 LEU 41 3HD2 LEU 41 -1.844 -3.005 -1.845 307 HD22 LEU 41 1HD2 LEU 41 -0.861 -1.544 -1.934 308 HD23 LEU 41 2HD2 LEU 41 -2.303 -1.698 -2.935 309 H GLY 42 H GLY 42 -1.271 2.049 0.829 310 HA2 GLY 42 1HA GLY 42 -1.693 4.577 -0.459 311 HA3 GLY 42 2HA GLY 42 -1.973 4.673 1.273 312 H LEU 43 H LEU 43 0.388 4.480 -1.224 313 HA LEU 43 HA LEU 43 2.634 3.905 0.518 314 HB2 LEU 43 1HB LEU 43 2.757 3.211 -1.802 315 HB3 LEU 43 2HB LEU 43 2.471 4.859 -2.354 316 HG LEU 43 HG LEU 43 4.597 5.580 -1.386 317 HD11 LEU 43 1HD1 LEU 43 6.125 3.602 -0.576 318 HD12 LEU 43 2HD1 LEU 43 4.596 2.769 -0.292 319 HD13 LEU 43 3HD1 LEU 43 4.944 4.282 0.540 320 HD21 LEU 43 3HD2 LEU 43 4.824 3.052 -3.044 321 HD22 LEU 43 1HD2 LEU 43 6.118 4.230 -2.826 322 HD23 LEU 43 2HD2 LEU 43 4.636 4.692 -3.664 323 H VAL 44 H VAL 44 3.932 5.362 1.524 324 HA VAL 44 HA VAL 44 3.440 8.245 1.008 325 HB VAL 44 HB VAL 44 2.299 7.390 3.087 326 HG11 VAL 44 1HG1 VAL 44 5.102 7.228 4.213 327 HG12 VAL 44 2HG1 VAL 44 4.255 5.805 3.607 328 HG13 VAL 44 3HG1 VAL 44 3.591 6.711 4.965 329 HG21 VAL 44 3HG2 VAL 44 4.527 9.427 3.388 330 HG22 VAL 44 1HG2 VAL 44 3.152 9.262 4.482 331 HG23 VAL 44 2HG2 VAL 44 2.894 9.751 2.807 332 H ARG 45 H ARG 45 5.159 9.497 0.819 333 HA ARG 45 HA ARG 45 7.833 8.359 1.431 334 HB2 ARG 45 1HB ARG 45 7.420 8.779 -0.990 335 HB3 ARG 45 2HB ARG 45 7.109 10.475 -0.619 336 HG2 ARG 45 1HG ARG 45 9.394 10.663 0.347 337 HG3 ARG 45 2HG ARG 45 9.698 8.980 -0.088 338 HD2 ARG 45 1HD ARG 45 8.916 11.126 -2.071 339 HD3 ARG 45 2HD ARG 45 10.578 10.635 -1.760 340 HE ARG 45 HE ARG 45 9.124 8.319 -2.346 341 HH11 ARG 45 1HH2 ARG 45 10.061 11.297 -3.829 342 HH12 ARG 45 2HH2 ARG 45 10.108 10.644 -5.434 343 HH21 ARG 45 1HH1 ARG 45 9.181 7.452 -4.443 344 HH22 ARG 45 2HH1 ARG 45 9.608 8.466 -5.781 345 H TYR 46 H TYR 46 9.055 9.443 2.835 346 HA TYR 46 HA TYR 46 8.189 12.148 3.713 347 HB2 TYR 46 1HB TYR 46 7.637 10.338 5.337 348 HB3 TYR 46 2HB TYR 46 9.350 9.936 5.427 349 HD1 TYR 46 HD1 TYR 46 7.088 12.916 5.667 350 HD2 TYR 46 HD2 TYR 46 10.616 10.943 7.121 351 HE1 TYR 46 HE1 TYR 46 7.381 14.693 7.369 352 HE2 TYR 46 HE2 TYR 46 10.909 12.722 8.823 353 HH TYR 46 HH TYR 46 8.912 14.513 9.967 354 H ARG 47 H ARG 47 9.748 13.676 3.681 355 HA ARG 47 HA ARG 47 12.448 12.872 2.845 356 HB2 ARG 47 1HB ARG 47 11.255 14.630 1.568 357 HB3 ARG 47 2HB ARG 47 11.216 15.631 3.020 358 HG2 ARG 47 1HG ARG 47 13.661 15.662 3.107 359 HG3 ARG 47 2HG ARG 47 13.746 14.579 1.723 360 HD2 ARG 47 1HD ARG 47 14.113 16.846 0.951 361 HD3 ARG 47 2HD ARG 47 12.545 16.303 0.364 362 HE ARG 47 HE ARG 47 12.219 17.619 2.850 363 HH11 ARG 47 1HH2 ARG 47 13.037 18.204 -0.462 364 HH12 ARG 47 2HH2 ARG 47 12.405 19.817 -0.475 365 HH21 ARG 47 1HH1 ARG 47 11.393 19.733 2.840 366 HH22 ARG 47 2HH1 ARG 47 11.474 20.682 1.392 367 H LEU 48 H LEU 48 14.303 13.429 3.927 368 HA LEU 48 HA LEU 48 13.975 14.273 6.753 369 HB2 LEU 48 1HB LEU 48 16.138 12.606 5.446 370 HB3 LEU 48 2HB LEU 48 16.150 13.127 7.128 371 HG LEU 48 HG LEU 48 13.976 11.431 5.860 372 HD11 LEU 48 1HD1 LEU 48 15.864 10.021 5.974 373 HD12 LEU 48 2HD1 LEU 48 15.020 9.692 7.485 374 HD13 LEU 48 3HD1 LEU 48 16.434 10.744 7.479 375 HD21 LEU 48 3HD2 LEU 48 12.916 12.455 7.668 376 HD22 LEU 48 1HD2 LEU 48 14.405 12.608 8.601 377 HD23 LEU 48 2HD2 LEU 48 13.602 11.045 8.463 378 H GLU 49 H GLU 49 15.320 15.813 7.605 379 HA GLU 49 HA GLU 49 16.296 17.782 5.752 380 HB2 GLU 49 1HB GLU 49 16.398 17.582 8.771 381 HB3 GLU 49 2HB GLU 49 16.981 18.976 7.855 382 HG2 GLU 49 1HG GLU 49 14.764 19.313 6.886 383 HG3 GLU 49 2HG GLU 49 14.162 17.873 7.706 384 H ASN 50 H ASN 50 17.591 14.957 6.982 385 HA ASN 50 HA ASN 50 20.370 15.907 7.047 386 HB2 ASN 50 1HB ASN 50 19.097 13.232 7.683 387 HB3 ASN 50 2HB ASN 50 20.830 13.548 7.769 388 HD21 ASN 50 2HD2 ASN 50 18.895 12.910 10.013 389 HD22 ASN 50 1HD2 ASN 50 19.042 14.207 11.099 390 H ASP 51 H ASP 51 18.258 15.062 4.709 391 HA ASP 51 HA ASP 51 18.555 14.571 2.480 392 HB2 ASP 51 1HB ASP 51 21.451 13.879 2.993 393 HB3 ASP 51 2HB ASP 51 20.696 14.410 1.497 394 H ALA 52 H ALA 52 17.169 12.844 3.171 395 HA ALA 52 HA ALA 52 18.090 10.307 2.349 396 HB1 ALA 52 3HB ALA 52 19.211 9.979 4.381 397 HB2 ALA 52 1HB ALA 52 17.652 9.206 4.664 398 HB3 ALA 52 2HB ALA 52 17.968 10.814 5.313 399 H GLN 53 H GLN 53 16.378 9.487 1.435 400 HA GLN 53 HA GLN 53 13.696 10.379 2.130 401 HB2 GLN 53 1HB GLN 53 14.702 8.472 0.002 402 HB3 GLN 53 2HB GLN 53 13.024 8.976 0.185 403 HG2 GLN 53 1HG GLN 53 15.331 10.894 -0.233 404 HG3 GLN 53 2HG GLN 53 14.290 10.304 -1.529 405 HE21 GLN 53 2HE2 GLN 53 14.674 13.039 0.056 406 HE22 GLN 53 1HE2 GLN 53 13.068 13.524 0.310 407 H GLU 54 H GLU 54 12.099 9.168 3.055 408 HA GLU 54 HA GLU 54 12.753 6.389 3.866 409 HB2 GLU 54 1HB GLU 54 11.386 8.533 5.514 410 HB3 GLU 54 2HB GLU 54 11.474 6.830 5.958 411 HG2 GLU 54 1HG GLU 54 13.880 8.599 5.447 412 HG3 GLU 54 2HG GLU 54 13.257 8.194 7.045 413 H HIS 55 H HIS 55 11.349 4.970 3.136 414 HA HIS 55 HA HIS 55 8.627 5.878 2.353 415 HB2 HIS 55 1HB HIS 55 10.302 3.634 1.202 416 HB3 HIS 55 2HB HIS 55 8.675 4.074 0.687 417 HD2 HIS 55 HD2 HIS 55 8.518 6.468 -0.854 418 HE1 HIS 55 HE1 HIS 55 12.691 7.016 -1.189 419 HE2 HIS 55 HE2 HIS 55 10.429 7.797 -2.036 420 H ALA 56 H ALA 56 6.874 4.669 2.977 421 HA ALA 56 HA ALA 56 7.286 2.125 4.377 422 HB1 ALA 56 3HB ALA 56 6.160 2.805 6.348 423 HB2 ALA 56 1HB ALA 56 5.593 4.303 5.608 424 HB3 ALA 56 2HB ALA 56 7.296 4.112 6.018 425 H LEU 57 H LEU 57 5.658 0.702 3.941 426 HA LEU 57 HA LEU 57 3.533 1.611 2.142 427 HB2 LEU 57 1HB LEU 57 4.743 -0.360 1.447 428 HB3 LEU 57 2HB LEU 57 4.426 -1.156 2.983 429 HG LEU 57 HG LEU 57 2.006 -1.158 2.498 430 HD11 LEU 57 1HD1 LEU 57 1.609 0.767 1.188 431 HD12 LEU 57 2HD1 LEU 57 1.432 -0.541 0.024 432 HD13 LEU 57 3HD1 LEU 57 2.927 0.396 0.075 433 HD21 LEU 57 3HD2 LEU 57 3.604 -2.194 0.144 434 HD22 LEU 57 1HD2 LEU 57 2.055 -2.808 0.726 435 HD23 LEU 57 2HD2 LEU 57 3.507 -3.002 1.710 436 H PHE 58 H PHE 58 2.003 2.604 3.333 437 HA PHE 58 HA PHE 58 1.057 1.514 5.842 438 HB2 PHE 58 1HB PHE 58 0.519 3.971 4.207 439 HB3 PHE 58 2HB PHE 58 -0.645 3.501 5.438 440 HD1 PHE 58 HD1 PHE 58 3.000 2.794 5.790 441 HD2 PHE 58 HD2 PHE 58 -0.239 5.418 6.853 442 HE1 PHE 58 HE1 PHE 58 4.391 3.795 7.557 443 HE2 PHE 58 HE2 PHE 58 1.168 6.418 8.626 444 HZ PHE 58 HZ PHE 58 3.483 5.607 8.980 445 H LEU 59 H LEU 59 -0.989 0.757 6.272 446 HA LEU 59 HA LEU 59 -2.637 -0.021 3.931 447 HB2 LEU 59 1HB LEU 59 -1.300 -1.905 5.164 448 HB3 LEU 59 2HB LEU 59 -2.503 -1.699 6.431 449 HG LEU 59 HG LEU 59 -3.235 -3.472 4.940 450 HD11 LEU 59 1HD1 LEU 59 -4.882 -1.692 5.821 451 HD12 LEU 59 2HD1 LEU 59 -5.429 -2.752 4.532 452 HD13 LEU 59 3HD1 LEU 59 -4.926 -1.106 4.159 453 HD21 LEU 59 3HD2 LEU 59 -3.177 -3.414 2.648 454 HD22 LEU 59 1HD2 LEU 59 -1.905 -2.232 2.934 455 HD23 LEU 59 2HD2 LEU 59 -3.540 -1.691 2.559 456 H TYR 60 H TYR 60 -4.394 1.071 3.995 457 HA TYR 60 HA TYR 60 -5.525 2.017 6.552 458 HB2 TYR 60 1HB TYR 60 -6.058 2.755 3.670 459 HB3 TYR 60 2HB TYR 60 -6.862 3.486 5.056 460 HD1 TYR 60 HD2 TYR 60 -3.569 3.007 3.379 461 HD2 TYR 60 HD1 TYR 60 -5.798 5.202 6.311 462 HE1 TYR 60 HE2 TYR 60 -1.703 4.630 3.582 463 HE2 TYR 60 HE1 TYR 60 -3.938 6.829 6.514 464 HH TYR 60 HH TYR 60 -1.830 7.461 4.557 465 H THR 61 H THR 61 -7.440 1.164 7.291 466 HA THR 61 HA THR 61 -8.669 -0.971 5.717 467 HB THR 61 HB THR 61 -8.470 -1.337 8.131 468 HG1 THR 61 HG1 THR 61 -10.210 -2.328 7.296 469 HG21 THR 61 3HG2 THR 61 -9.741 0.031 9.718 470 HG22 THR 61 1HG2 THR 61 -10.305 1.059 8.401 471 HG23 THR 61 2HG2 THR 61 -8.596 1.042 8.835 472 H HIS 62 H HIS 62 -11.021 -0.952 5.410 473 HA HIS 62 HA HIS 62 -12.467 1.488 5.533 474 HB2 HIS 62 1HB HIS 62 -12.520 2.173 3.283 475 HB3 HIS 62 2HB HIS 62 -10.819 1.848 3.597 476 HD2 HIS 62 HD2 HIS 62 -9.847 -0.593 2.398 477 HE1 HIS 62 HE1 HIS 62 -13.191 -1.099 -0.121 478 HE2 HIS 62 HE2 HIS 62 -10.832 -1.906 0.366 479 H ARG 63 H ARG 63 -14.603 1.276 4.712 480 HA ARG 63 HA ARG 63 -15.647 -1.386 5.043 481 HB2 ARG 63 1HB ARG 63 -17.164 1.094 4.197 482 HB3 ARG 63 2HB ARG 63 -17.826 -0.368 4.924 483 HG2 ARG 63 1HG ARG 63 -16.487 0.072 6.966 484 HG3 ARG 63 2HG ARG 63 -15.911 1.567 6.233 485 HD2 ARG 63 1HD ARG 63 -17.750 2.136 7.688 486 HD3 ARG 63 2HD ARG 63 -18.301 2.312 6.027 487 HE ARG 63 HE ARG 63 -19.704 0.447 6.321 488 HH11 ARG 63 1HH2 ARG 63 -17.607 0.957 9.035 489 HH12 ARG 63 2HH2 ARG 63 -18.457 -0.140 10.071 490 HH21 ARG 63 1HH1 ARG 63 -20.825 -0.985 7.688 491 HH22 ARG 63 2HH1 ARG 63 -20.273 -1.238 9.310 492 H ARG 64 H ARG 64 -17.790 -1.369 3.322 493 HA ARG 64 HA ARG 64 -16.644 -2.434 0.962 494 HB2 ARG 64 1HB ARG 64 -19.499 -1.622 1.564 495 HB3 ARG 64 2HB ARG 64 -18.994 -2.625 0.207 496 HG2 ARG 64 1HG ARG 64 -18.238 -3.411 3.015 497 HG3 ARG 64 2HG ARG 64 -19.851 -3.773 2.409 498 HD2 ARG 64 1HD ARG 64 -18.903 -5.044 0.542 499 HD3 ARG 64 2HD ARG 64 -17.272 -4.628 1.052 500 HE ARG 64 HE ARG 64 -17.442 -6.182 2.794 501 HH11 ARG 64 1HH2 ARG 64 -20.476 -5.675 1.208 502 HH12 ARG 64 2HH2 ARG 64 -21.245 -7.042 1.941 503 HH21 ARG 64 1HH1 ARG 64 -18.441 -7.976 3.757 504 HH22 ARG 64 2HH1 ARG 64 -20.092 -8.347 3.387 505 H MET 65 H MET 65 -18.114 0.728 1.739 506 HA MET 65 HA MET 65 -17.094 1.724 -0.846 507 HB2 MET 65 1HB MET 65 -19.346 3.055 -0.919 508 HB3 MET 65 2HB MET 65 -19.320 1.383 -1.473 509 HG2 MET 65 1HG MET 65 -20.154 0.614 0.702 510 HG3 MET 65 2HG MET 65 -20.116 2.266 1.319 511 HE1 MET 65 3HE MET 65 -23.889 1.625 1.090 512 HE2 MET 65 1HE MET 65 -22.606 2.425 2.009 513 HE3 MET 65 2HE MET 65 -22.534 0.689 1.716 514 H ALA 66 H ALA 66 -16.258 1.981 1.970 515 HA ALA 66 HA ALA 66 -16.871 4.762 2.669 516 HB1 ALA 66 3HB ALA 66 -15.203 4.198 4.560 517 HB2 ALA 66 1HB ALA 66 -15.350 2.546 3.982 518 HB3 ALA 66 2HB ALA 66 -16.773 3.395 4.568 519 H ILE 67 H ILE 67 -15.397 4.060 0.229 520 HA ILE 67 HA ILE 67 -12.642 4.535 0.390 521 HB ILE 67 HB ILE 67 -14.671 5.067 -1.790 522 HG12 ILE 67 1HG1 ILE 67 -12.607 2.867 -1.537 523 HG13 ILE 67 2HG1 ILE 67 -14.264 2.699 -0.954 524 HG21 ILE 67 1HG2 ILE 67 -12.616 5.000 -3.283 525 HG22 ILE 67 2HG2 ILE 67 -11.649 5.199 -1.821 526 HG23 ILE 67 3HG2 ILE 67 -12.788 6.456 -2.306 527 HD11 ILE 67 3HD1 ILE 67 -13.396 3.252 -3.805 528 HD12 ILE 67 1HD1 ILE 67 -15.072 3.276 -3.258 529 HD13 ILE 67 2HD1 ILE 67 -14.146 1.777 -3.198 530 H THR 68 H THR 68 -15.345 6.702 0.010 531 HA THR 68 HA THR 68 -14.552 9.077 -0.766 532 HB THR 68 HB THR 68 -16.064 10.171 0.732 533 HG1 THR 68 HG1 THR 68 -16.319 9.518 2.706 534 HG21 THR 68 3HG2 THR 68 -16.916 8.488 -0.961 535 HG22 THR 68 1HG2 THR 68 -18.012 8.820 0.379 536 HG23 THR 68 2HG2 THR 68 -17.055 7.338 0.368 537 H GLY 69 H GLY 69 -13.315 7.735 2.301 538 HA2 GLY 69 1HA GLY 69 -11.085 8.409 2.999 539 HA3 GLY 69 2HA GLY 69 -11.451 10.045 2.446 540 H ASP 70 H ASP 70 -14.264 9.266 3.521 541 HA ASP 70 HA ASP 70 -14.150 10.783 5.887 542 HB2 ASP 70 1HB ASP 70 -16.265 9.004 4.680 543 HB3 ASP 70 2HB ASP 70 -16.530 9.896 6.177 544 H ASP 71 H ASP 71 -14.536 7.217 5.445 545 HA ASP 71 HA ASP 71 -13.960 6.929 8.354 546 HB2 ASP 71 1HB ASP 71 -16.275 6.365 7.720 547 HB3 ASP 71 2HB ASP 71 -15.659 5.132 6.620 548 H VAL 72 H VAL 72 -11.709 6.994 6.836 549 HA VAL 72 HA VAL 72 -10.780 4.211 7.020 550 HB VAL 72 HB VAL 72 -9.877 4.115 4.840 551 HG11 VAL 72 1HG1 VAL 72 -12.517 5.539 4.543 552 HG12 VAL 72 2HG1 VAL 72 -12.347 3.835 4.962 553 HG13 VAL 72 3HG1 VAL 72 -11.794 4.420 3.392 554 HG21 VAL 72 3HG2 VAL 72 -10.397 7.081 4.770 555 HG22 VAL 72 1HG2 VAL 72 -10.136 6.165 3.285 556 HG23 VAL 72 2HG2 VAL 72 -8.870 6.237 4.509 557 H SER 73 H SER 73 -9.017 4.205 8.266 558 HA SER 73 HA SER 73 -7.007 6.320 7.914 559 HB2 SER 73 1HB SER 73 -8.420 7.049 9.781 560 HB3 SER 73 2HB SER 73 -8.178 5.500 10.580 561 HG SER 73 HG SER 73 -6.007 5.971 10.776 562 H LEU 74 H LEU 74 -4.933 5.679 9.017 563 HA LEU 74 HA LEU 74 -3.949 3.362 8.062 564 HB2 LEU 74 1HB LEU 74 -2.596 5.172 9.145 565 HB3 LEU 74 2HB LEU 74 -3.059 4.514 10.713 566 HG LEU 74 HG LEU 74 -2.055 2.329 10.081 567 HD11 LEU 74 1HD1 LEU 74 -0.384 2.723 7.965 568 HD12 LEU 74 2HD1 LEU 74 -1.731 3.746 7.476 569 HD13 LEU 74 3HD1 LEU 74 -1.999 2.036 7.805 570 HD21 LEU 74 3HD2 LEU 74 0.306 3.980 9.565 571 HD22 LEU 74 1HD2 LEU 74 -0.114 3.037 10.988 572 HD23 LEU 74 2HD2 LEU 74 -0.695 4.689 10.828 573 H ASP 75 H ASP 75 -4.236 1.325 8.317 574 HA ASP 75 HA ASP 75 -5.564 0.252 10.729 575 HB2 ASP 75 1HB ASP 75 -6.532 -0.160 8.430 576 HB3 ASP 75 2HB ASP 75 -5.116 -1.150 8.094 577 H GLN 76 H GLN 76 -2.514 0.246 9.014 578 HA GLN 76 HA GLN 76 -1.291 -1.247 11.110 579 HB2 GLN 76 1HB GLN 76 -2.379 -2.934 9.299 580 HB3 GLN 76 2HB GLN 76 -0.840 -2.637 8.495 581 HG2 GLN 76 1HG GLN 76 0.310 -3.217 10.687 582 HG3 GLN 76 2HG GLN 76 -1.264 -3.686 11.311 583 HE21 GLN 76 2HE2 GLN 76 1.346 -4.663 9.137 584 HE22 GLN 76 1HE2 GLN 76 0.697 -6.187 8.766 585 H ILE 77 H ILE 77 1.022 -2.048 9.663 586 HA ILE 77 HA ILE 77 2.048 0.225 8.200 587 HB ILE 77 HB ILE 77 3.086 -0.404 10.990 588 HG12 ILE 77 1HG1 ILE 77 1.866 2.058 9.697 589 HG13 ILE 77 2HG1 ILE 77 1.201 1.113 11.028 590 HG21 ILE 77 1HG2 ILE 77 4.967 -0.060 9.384 591 HG22 ILE 77 2HG2 ILE 77 4.854 1.264 10.526 592 HG23 ILE 77 3HG2 ILE 77 4.240 1.463 8.885 593 HD11 ILE 77 3HD1 ILE 77 3.605 2.925 11.085 594 HD12 ILE 77 1HD1 ILE 77 3.297 1.728 12.345 595 HD13 ILE 77 2HD1 ILE 77 2.134 3.022 12.053 596 H VAL 78 H VAL 78 3.483 -0.501 6.762 597 HA VAL 78 HA VAL 78 4.944 -3.009 7.321 598 HB VAL 78 HB VAL 78 3.524 -2.318 4.746 599 HG11 VAL 78 1HG1 VAL 78 5.546 -3.385 4.126 600 HG12 VAL 78 2HG1 VAL 78 4.369 -4.700 4.182 601 HG13 VAL 78 3HG1 VAL 78 5.501 -4.470 5.516 602 HG21 VAL 78 3HG2 VAL 78 2.461 -4.637 5.361 603 HG22 VAL 78 1HG2 VAL 78 1.875 -3.188 6.172 604 HG23 VAL 78 2HG2 VAL 78 3.002 -4.261 6.997 605 HA PRO 79 HA PRO 79 7.889 0.141 5.840 606 HB2 PRO 79 1HB PRO 79 10.094 -0.705 7.161 607 HB3 PRO 79 2HB PRO 79 8.797 0.186 7.984 608 HG2 PRO 79 1HG PRO 79 9.388 -2.736 7.993 609 HG3 PRO 79 2HG PRO 79 8.814 -1.700 9.312 610 HD2 PRO 79 1HD PRO 79 7.185 -3.371 7.766 611 HD3 PRO 79 2HD PRO 79 6.592 -1.989 8.718 612 H LEU 80 H LEU 80 8.561 -0.135 3.768 613 HA LEU 80 HA LEU 80 8.889 -2.197 2.183 614 HB2 LEU 80 1HB LEU 80 10.580 0.256 2.500 615 HB3 LEU 80 2HB LEU 80 11.066 -0.939 1.302 616 HG LEU 80 HG LEU 80 9.618 0.877 0.377 617 HD11 LEU 80 1HD1 LEU 80 8.567 -0.512 -1.095 618 HD12 LEU 80 2HD1 LEU 80 7.894 -1.549 0.158 619 HD13 LEU 80 3HD1 LEU 80 9.581 -1.724 -0.321 620 HD21 LEU 80 3HD2 LEU 80 7.306 1.051 1.038 621 HD22 LEU 80 1HD2 LEU 80 8.294 1.122 2.496 622 HD23 LEU 80 2HD2 LEU 80 7.446 -0.367 2.079 623 H SER 81 H SER 81 11.960 -1.065 3.410 624 HA SER 81 HA SER 81 13.720 -2.163 4.470 625 HB2 SER 81 1HB SER 81 11.786 -3.646 5.464 626 HB3 SER 81 2HB SER 81 12.333 -4.823 4.272 627 HG SER 81 HG SER 81 14.379 -3.610 5.601 628 H LYS 82 H LYS 82 15.554 -3.095 3.576 629 HA LYS 82 HA LYS 82 15.735 -3.225 0.819 630 HB2 LYS 82 1HB LYS 82 17.928 -4.248 1.180 631 HB3 LYS 82 2HB LYS 82 17.657 -2.935 2.330 632 HG2 LYS 82 1HG LYS 82 16.922 -4.610 4.019 633 HG3 LYS 82 2HG LYS 82 17.309 -5.898 2.877 634 HD2 LYS 82 1HD LYS 82 19.646 -5.038 2.764 635 HD3 LYS 82 2HD LYS 82 19.239 -3.871 4.023 636 HE2 LYS 82 1HE LYS 82 18.925 -6.869 4.324 637 HE3 LYS 82 2HE LYS 82 20.317 -5.958 4.910 638 HZ1 LYS 82 3HZ LYS 82 19.125 -5.029 6.569 639 HZ2 LYS 82 1HZ LYS 82 18.184 -6.427 6.394 640 HZ3 LYS 82 2HZ LYS 82 17.683 -4.971 5.673 641 H ASP 83 H ASP 83 14.972 -5.788 3.139 642 HA ASP 83 HA ASP 83 15.265 -7.912 1.243 643 HB2 ASP 83 1HB ASP 83 13.937 -7.760 3.955 644 HB3 ASP 83 2HB ASP 83 14.070 -9.246 3.014 645 H PHE 84 H PHE 84 13.251 -5.499 0.980 646 HA PHE 84 HA PHE 84 10.676 -6.740 0.728 647 HB2 PHE 84 1HB PHE 84 11.106 -4.276 1.067 648 HB3 PHE 84 2HB PHE 84 11.639 -4.203 -0.604 649 HD1 PHE 84 HD2 PHE 84 9.990 -4.694 -2.446 650 HD2 PHE 84 HD1 PHE 84 8.822 -4.434 1.672 651 HE1 PHE 84 HE2 PHE 84 7.628 -4.363 -3.130 652 HE2 PHE 84 HE1 PHE 84 6.467 -4.087 0.997 653 HZ PHE 84 HZ PHE 84 5.870 -4.050 -1.412 654 H MET 85 H MET 85 9.662 -7.460 -1.097 655 HA MET 85 HA MET 85 10.767 -7.268 -3.715 656 HB2 MET 85 1HB MET 85 12.314 -8.968 -2.760 657 HB3 MET 85 2HB MET 85 10.923 -10.001 -2.422 658 HG2 MET 85 1HG MET 85 10.351 -10.036 -4.821 659 HG3 MET 85 2HG MET 85 11.716 -8.978 -5.166 660 HE1 MET 85 3HE MET 85 11.607 -13.340 -3.946 661 HE2 MET 85 1HE MET 85 10.399 -12.071 -3.705 662 HE3 MET 85 2HE MET 85 11.740 -12.242 -2.574 663 H LEU 86 H LEU 86 9.293 -7.895 -5.274 664 HA LEU 86 HA LEU 86 6.650 -8.799 -4.267 665 HB2 LEU 86 1HB LEU 86 5.985 -7.747 -6.611 666 HB3 LEU 86 2HB LEU 86 6.201 -6.717 -5.198 667 HG LEU 86 HG LEU 86 8.621 -7.298 -6.892 668 HD11 LEU 86 1HD1 LEU 86 6.944 -6.726 -8.571 669 HD12 LEU 86 2HD1 LEU 86 8.038 -5.359 -8.351 670 HD13 LEU 86 3HD1 LEU 86 6.432 -5.328 -7.623 671 HD21 LEU 86 3HD2 LEU 86 8.464 -5.872 -4.691 672 HD22 LEU 86 1HD2 LEU 86 7.773 -4.636 -5.743 673 HD23 LEU 86 2HD2 LEU 86 9.398 -5.253 -6.049 674 H GLU 87 H GLU 87 5.822 -10.674 -5.087 675 HA GLU 87 HA GLU 87 7.315 -11.981 -7.291 676 HB2 GLU 87 1HB GLU 87 5.801 -13.151 -4.953 677 HB3 GLU 87 2HB GLU 87 6.399 -14.102 -6.312 678 HG2 GLU 87 1HG GLU 87 8.692 -13.382 -5.841 679 HG3 GLU 87 2HG GLU 87 8.118 -12.359 -4.524 680 H GLU 88 H GLU 88 6.268 -12.201 -9.117 681 HA GLU 88 HA GLU 88 3.511 -11.495 -9.430 682 HB2 GLU 88 1HB GLU 88 5.486 -12.835 -11.291 683 HB3 GLU 88 2HB GLU 88 3.847 -12.386 -11.767 684 HG2 GLU 88 1HG GLU 88 4.307 -10.039 -11.246 685 HG3 GLU 88 2HG GLU 88 5.922 -10.461 -10.678 686 H VAL 89 H VAL 89 1.711 -12.821 -9.697 687 HA VAL 89 HA VAL 89 2.123 -15.742 -9.450 688 HB VAL 89 HB VAL 89 0.081 -14.191 -7.872 689 HG11 VAL 89 1HG1 VAL 89 -0.726 -16.387 -8.387 690 HG12 VAL 89 2HG1 VAL 89 -0.131 -16.443 -6.727 691 HG13 VAL 89 3HG1 VAL 89 0.846 -17.108 -8.037 692 HG21 VAL 89 3HG2 VAL 89 2.669 -15.524 -7.025 693 HG22 VAL 89 1HG2 VAL 89 1.474 -14.856 -5.915 694 HG23 VAL 89 2HG2 VAL 89 2.351 -13.791 -7.016 695 H SER 90 H SER 90 0.715 -16.966 -10.566 696 HA SER 90 HA SER 90 -0.714 -15.745 -12.701 697 HB2 SER 90 1HB SER 90 -0.594 -18.591 -11.709 698 HB3 SER 90 2HB SER 90 -1.490 -18.106 -13.144 699 HG SER 90 HG SER 90 0.360 -17.623 -14.154 700 HA PRO 91 HA PRO 91 -4.542 -15.164 -10.417 701 HB2 PRO 91 1HB PRO 91 -6.243 -14.626 -12.497 702 HB3 PRO 91 2HB PRO 91 -5.050 -13.457 -11.894 703 HG2 PRO 91 1HG PRO 91 -4.900 -15.257 -14.271 704 HG3 PRO 91 2HG PRO 91 -4.395 -13.565 -14.106 705 HD2 PRO 91 1HD PRO 91 -2.627 -15.651 -14.006 706 HD3 PRO 91 2HD PRO 91 -2.363 -14.126 -13.134 707 H ASP 92 H ASP 92 -4.127 -17.580 -12.867 708 HA ASP 92 HA ASP 92 -5.145 -19.602 -13.269 709 HB2 ASP 92 1HB ASP 92 -5.875 -19.180 -10.365 710 HB3 ASP 92 2HB ASP 92 -6.331 -20.632 -11.251 711 H GLY 93 H GLY 93 -6.499 -17.092 -13.859 712 HA2 GLY 93 1HA GLY 93 -9.235 -17.108 -13.263 713 HA3 GLY 93 2HA GLY 93 -8.519 -16.373 -14.694 714 H GLU 94 H GLU 94 -9.640 -17.047 -16.430 715 HA GLU 94 HA GLU 94 -9.637 -19.791 -17.199 716 HB2 GLU 94 1HB GLU 94 -12.148 -20.045 -17.244 717 HB3 GLU 94 2HB GLU 94 -11.425 -20.088 -15.636 718 HG2 GLU 94 1HG GLU 94 -12.461 -17.513 -16.826 719 HG3 GLU 94 2HG GLU 94 -13.527 -18.618 -15.964 720 H LEU 95 H LEU 95 -9.321 -16.809 -18.028 721 HA LEU 95 HA LEU 95 -10.083 -17.245 -20.773 722 HB2 LEU 95 1HB LEU 95 -12.225 -16.438 -19.909 723 HB3 LEU 95 2HB LEU 95 -11.433 -15.029 -19.208 724 HG LEU 95 HG LEU 95 -10.778 -14.248 -21.447 725 HD11 LEU 95 1HD1 LEU 95 -10.447 -16.145 -22.786 726 HD12 LEU 95 2HD1 LEU 95 -11.976 -15.529 -23.404 727 HD13 LEU 95 3HD1 LEU 95 -11.964 -16.891 -22.283 728 HD21 LEU 95 3HD2 LEU 95 -12.943 -13.529 -20.585 729 HD22 LEU 95 1HD2 LEU 95 -13.708 -14.992 -21.207 730 HD23 LEU 95 2HD2 LEU 95 -13.064 -13.788 -22.325 731 H TYR 96 H TYR 96 -9.305 -14.574 -18.526 732 HA TYR 96 HA TYR 96 -6.944 -13.938 -20.189 733 HB2 TYR 96 1HB TYR 96 -7.452 -11.544 -20.031 734 HB3 TYR 96 2HB TYR 96 -8.770 -12.402 -20.826 735 HD1 TYR 96 HD2 TYR 96 -7.673 -11.016 -17.537 736 HD2 TYR 96 HD1 TYR 96 -10.978 -12.347 -19.941 737 HE1 TYR 96 HE2 TYR 96 -9.247 -10.140 -15.844 738 HE2 TYR 96 HE1 TYR 96 -12.560 -11.462 -18.245 739 HH TYR 96 HH TYR 96 -11.701 -9.313 -15.872 740 H ILE 97 H ILE 97 -5.196 -13.200 -19.091 741 HA ILE 97 HA ILE 97 -4.833 -13.911 -16.399 742 HB ILE 97 HB ILE 97 -2.789 -12.210 -16.765 743 HG12 ILE 97 1HG1 ILE 97 -3.554 -12.877 -19.614 744 HG13 ILE 97 2HG1 ILE 97 -4.053 -11.360 -18.867 745 HG21 ILE 97 1HG2 ILE 97 -2.290 -14.506 -16.600 746 HG22 ILE 97 2HG2 ILE 97 -1.713 -14.071 -18.211 747 HG23 ILE 97 3HG2 ILE 97 -3.256 -14.908 -18.022 748 HD11 ILE 97 3HD1 ILE 97 -1.167 -12.251 -18.817 749 HD12 ILE 97 1HD1 ILE 97 -1.823 -10.629 -18.593 750 HD13 ILE 97 2HD1 ILE 97 -1.834 -11.368 -20.192 751 H LEU 98 H LEU 98 -3.912 -10.640 -17.168 752 HA LEU 98 HA LEU 98 -5.004 -9.644 -14.719 753 HB2 LEU 98 1HB LEU 98 -3.515 -8.431 -17.041 754 HB3 LEU 98 2HB LEU 98 -4.266 -7.379 -15.837 755 HG LEU 98 HG LEU 98 -3.007 -8.486 -14.058 756 HD11 LEU 98 1HD1 LEU 98 -1.198 -10.093 -14.694 757 HD12 LEU 98 2HD1 LEU 98 -1.875 -10.137 -16.318 758 HD13 LEU 98 3HD1 LEU 98 -2.821 -10.728 -14.951 759 HD21 LEU 98 3HD2 LEU 98 -1.165 -7.765 -16.345 760 HD22 LEU 98 1HD2 LEU 98 -0.831 -7.609 -14.621 761 HD23 LEU 98 2HD2 LEU 98 -2.039 -6.576 -15.382 762 H GLY 99 H GLY 99 -5.489 -8.341 -18.000 763 HA2 GLY 99 1HA GLY 99 -7.364 -7.499 -19.047 764 HA3 GLY 99 2HA GLY 99 -8.308 -8.585 -18.035 765 H SER 100 H SER 100 -9.241 -7.843 -16.153 766 HA SER 100 HA SER 100 -8.986 -4.941 -15.585 767 HB2 SER 100 1HB SER 100 -11.410 -5.207 -14.758 768 HB3 SER 100 2HB SER 100 -11.142 -5.153 -16.497 769 HG SER 100 HG SER 100 -12.444 -6.892 -16.103 770 H ASP 101 H ASP 101 -7.343 -6.834 -14.458 771 HA ASP 101 HA ASP 101 -7.785 -6.416 -11.654 772 HB2 ASP 101 1HB ASP 101 -8.164 -9.173 -12.824 773 HB3 ASP 101 2HB ASP 101 -7.597 -8.963 -11.171 774 H VAL 102 H VAL 102 -5.863 -6.642 -10.502 775 HA VAL 102 HA VAL 102 -3.481 -7.525 -12.043 776 HB VAL 102 HB VAL 102 -3.740 -5.233 -10.092 777 HG11 VAL 102 1HG1 VAL 102 -1.325 -6.578 -11.304 778 HG12 VAL 102 2HG1 VAL 102 -1.640 -6.223 -9.606 779 HG13 VAL 102 3HG1 VAL 102 -1.276 -4.912 -10.726 780 HG21 VAL 102 3HG2 VAL 102 -2.707 -5.149 -12.924 781 HG22 VAL 102 1HG2 VAL 102 -3.348 -3.828 -11.945 782 HG23 VAL 102 2HG2 VAL 102 -4.435 -5.058 -12.592 783 H THR 103 H THR 103 -2.246 -8.980 -11.128 784 HA THR 103 HA THR 103 -2.857 -9.785 -8.321 785 HB THR 103 HB THR 103 -1.497 -11.567 -10.345 786 HG1 THR 103 HG1 THR 103 -3.947 -10.584 -10.520 787 HG21 THR 103 3HG2 THR 103 -2.294 -13.318 -8.898 788 HG22 THR 103 1HG2 THR 103 -3.321 -12.189 -8.011 789 HG23 THR 103 2HG2 THR 103 -1.565 -12.089 -7.862 790 H VAL 104 H VAL 104 -1.423 -9.099 -6.946 791 HA VAL 104 HA VAL 104 1.458 -9.319 -7.557 792 HB VAL 104 HB VAL 104 0.544 -6.930 -7.729 793 HG11 VAL 104 1HG1 VAL 104 -0.079 -5.778 -5.751 794 HG12 VAL 104 2HG1 VAL 104 0.493 -7.085 -4.714 795 HG13 VAL 104 3HG1 VAL 104 -0.964 -7.302 -5.682 796 HG21 VAL 104 3HG2 VAL 104 2.638 -7.461 -5.595 797 HG22 VAL 104 1HG2 VAL 104 2.480 -5.999 -6.569 798 HG23 VAL 104 2HG2 VAL 104 2.943 -7.520 -7.332 799 H GLN 105 H GLN 105 2.624 -10.223 -5.953 800 HA GLN 105 HA GLN 105 1.263 -10.780 -3.368 801 HB2 GLN 105 1HB GLN 105 1.723 -12.710 -5.048 802 HB3 GLN 105 2HB GLN 105 3.408 -12.530 -4.570 803 HG2 GLN 105 1HG GLN 105 1.108 -12.992 -2.656 804 HG3 GLN 105 2HG GLN 105 2.214 -14.241 -3.209 805 HE21 GLN 105 2HE2 GLN 105 1.721 -11.963 -0.743 806 HE22 GLN 105 1HE2 GLN 105 3.303 -11.923 -0.128 807 H LEU 106 H LEU 106 2.183 -9.548 -1.782 808 HA LEU 106 HA LEU 106 4.840 -8.530 -2.076 809 HB2 LEU 106 1HB LEU 106 2.863 -8.457 0.210 810 HB3 LEU 106 2HB LEU 106 4.383 -7.572 0.174 811 HG LEU 106 HG LEU 106 2.538 -6.113 -0.465 812 HD11 LEU 106 1HD1 LEU 106 3.915 -6.621 -3.082 813 HD12 LEU 106 2HD1 LEU 106 4.877 -6.140 -1.685 814 HD13 LEU 106 3HD1 LEU 106 3.580 -5.095 -2.262 815 HD21 LEU 106 3HD2 LEU 106 2.027 -7.721 -2.954 816 HD22 LEU 106 1HD2 LEU 106 0.989 -6.554 -2.138 817 HD23 LEU 106 2HD2 LEU 106 1.218 -8.156 -1.444 818 H ASN 107 H ASN 107 6.597 -9.474 -1.468 819 HA ASN 107 HA ASN 107 6.505 -11.676 0.547 820 HB2 ASN 107 1HB ASN 107 8.616 -11.275 -1.556 821 HB3 ASN 107 2HB ASN 107 8.324 -12.700 -0.561 822 HD21 ASN 107 2HD2 ASN 107 6.644 -10.644 -2.993 823 HD22 ASN 107 1HD2 ASN 107 5.746 -11.921 -3.659 824 H THR 108 H THR 108 6.659 -9.668 2.078 825 HA THR 108 HA THR 108 9.255 -8.451 2.259 826 HB THR 108 HB THR 108 7.532 -8.538 4.686 827 HG1 THR 108 HG1 THR 108 5.841 -8.227 3.467 828 HG21 THR 108 3HG2 THR 108 9.564 -7.077 4.386 829 HG22 THR 108 1HG2 THR 108 8.089 -6.193 4.782 830 HG23 THR 108 2HG2 THR 108 8.684 -6.221 3.125 831 H ALA 109 H ALA 109 10.515 -8.623 4.331 832 HA ALA 109 HA ALA 109 11.737 -11.053 4.597 833 HB1 ALA 109 3HB ALA 109 12.658 -10.250 6.691 834 HB2 ALA 109 1HB ALA 109 11.359 -9.066 6.842 835 HB3 ALA 109 2HB ALA 109 12.551 -8.906 5.554 836 H GLU 110 H GLU 110 8.813 -9.968 6.265 837 HA GLU 110 HA GLU 110 8.441 -12.727 7.280 838 HB2 GLU 110 1HB GLU 110 7.403 -11.656 9.342 839 HB3 GLU 110 2HB GLU 110 9.160 -11.540 9.220 840 HG2 GLU 110 1HG GLU 110 8.957 -9.274 8.292 841 HG3 GLU 110 2HG GLU 110 7.203 -9.386 8.383 842 H LEU 111 H LEU 111 6.967 -9.610 6.385 843 HA LEU 111 HA LEU 111 4.298 -10.640 6.544 844 HB2 LEU 111 1HB LEU 111 5.471 -8.104 5.435 845 HB3 LEU 111 2HB LEU 111 3.773 -8.489 5.232 846 HG LEU 111 HG LEU 111 5.101 -8.526 7.950 847 HD11 LEU 111 1HD1 LEU 111 5.500 -6.305 7.417 848 HD12 LEU 111 2HD1 LEU 111 3.878 -6.187 8.096 849 HD13 LEU 111 3HD1 LEU 111 4.102 -6.194 6.347 850 HD21 LEU 111 3HD2 LEU 111 2.982 -9.559 8.123 851 HD22 LEU 111 1HD2 LEU 111 2.255 -8.491 6.924 852 HD23 LEU 111 2HD2 LEU 111 2.622 -7.888 8.536 853 H LYS 112 H LYS 112 2.963 -11.260 4.926 854 HA LYS 112 HA LYS 112 3.803 -11.284 2.207 855 HB2 LYS 112 1HB LYS 112 5.058 -13.236 3.137 856 HB3 LYS 112 2HB LYS 112 3.508 -13.964 3.561 857 HG2 LYS 112 1HG LYS 112 2.819 -13.925 1.205 858 HG3 LYS 112 2HG LYS 112 4.330 -13.134 0.762 859 HD2 LYS 112 1HD LYS 112 5.598 -15.093 1.571 860 HD3 LYS 112 2HD LYS 112 4.085 -15.892 2.000 861 HE2 LYS 112 1HE LYS 112 3.368 -15.806 -0.362 862 HE3 LYS 112 2HE LYS 112 4.883 -15.012 -0.793 863 HZ1 LYS 112 3HZ LYS 112 5.354 -17.206 -1.213 864 HZ2 LYS 112 1HZ LYS 112 4.420 -17.781 0.081 865 HZ3 LYS 112 2HZ LYS 112 5.925 -17.054 0.379 866 H LEU 113 H LEU 113 2.015 -10.583 1.315 867 HA LEU 113 HA LEU 113 -0.493 -12.062 1.872 868 HB2 LEU 113 1HB LEU 113 -0.071 -9.102 2.102 869 HB3 LEU 113 2HB LEU 113 -1.666 -9.759 1.754 870 HG LEU 113 HG LEU 113 0.057 -10.448 4.135 871 HD11 LEU 113 1HD1 LEU 113 -1.994 -9.263 5.296 872 HD12 LEU 113 2HD1 LEU 113 -2.168 -8.489 3.719 873 HD13 LEU 113 3HD1 LEU 113 -0.667 -8.312 4.629 874 HD21 LEU 113 3HD2 LEU 113 -2.473 -11.610 3.073 875 HD22 LEU 113 1HD2 LEU 113 -2.463 -11.289 4.810 876 HD23 LEU 113 2HD2 LEU 113 -1.247 -12.345 4.098 877 H VAL 114 H VAL 114 -2.249 -11.375 0.294 878 HA VAL 114 HA VAL 114 -1.065 -10.933 -2.398 879 HB VAL 114 HB VAL 114 -3.550 -12.593 -2.022 880 HG11 VAL 114 1HG1 VAL 114 -2.941 -13.511 -4.124 881 HG12 VAL 114 2HG1 VAL 114 -1.273 -12.954 -3.978 882 HG13 VAL 114 3HG1 VAL 114 -2.566 -11.791 -4.263 883 HG21 VAL 114 3HG2 VAL 114 -0.733 -13.434 -1.370 884 HG22 VAL 114 1HG2 VAL 114 -1.860 -14.602 -2.058 885 HG23 VAL 114 2HG2 VAL 114 -2.228 -13.813 -0.526 886 H PHE 115 H PHE 115 -1.931 -9.213 -3.451 887 HA PHE 115 HA PHE 115 -4.592 -8.220 -2.611 888 HB2 PHE 115 1HB PHE 115 -2.110 -6.685 -3.386 889 HB3 PHE 115 2HB PHE 115 -3.712 -5.951 -3.322 890 HD1 PHE 115 HD2 PHE 115 -1.011 -7.490 -1.380 891 HD2 PHE 115 HD1 PHE 115 -4.861 -5.595 -1.169 892 HE1 PHE 115 HE2 PHE 115 -0.755 -7.241 1.062 893 HE2 PHE 115 HE1 PHE 115 -4.609 -5.365 1.284 894 HZ PHE 115 HZ PHE 115 -2.544 -6.208 2.413 895 H GLN 116 H GLN 116 -6.025 -7.729 -4.164 896 HA GLN 116 HA GLN 116 -5.266 -8.240 -6.978 897 HB2 GLN 116 1HB GLN 116 -6.994 -9.740 -5.884 898 HB3 GLN 116 2HB GLN 116 -8.046 -8.326 -5.803 899 HG2 GLN 116 1HG GLN 116 -8.585 -9.516 -7.824 900 HG3 GLN 116 2HG GLN 116 -7.731 -8.048 -8.283 901 HE21 GLN 116 2HE2 GLN 116 -6.054 -8.352 -9.712 902 HE22 GLN 116 1HE2 GLN 116 -5.238 -9.817 -9.975 903 H LEU 117 H LEU 117 -4.585 -6.095 -7.441 904 HA LEU 117 HA LEU 117 -6.434 -3.887 -6.988 905 HB2 LEU 117 1HB LEU 117 -3.625 -4.115 -8.061 906 HB3 LEU 117 2HB LEU 117 -4.495 -2.590 -8.061 907 HG LEU 117 HG LEU 117 -4.262 -4.226 -5.529 908 HD11 LEU 117 1HD1 LEU 117 -1.966 -3.920 -6.353 909 HD12 LEU 117 2HD1 LEU 117 -2.260 -2.908 -4.940 910 HD13 LEU 117 3HD1 LEU 117 -2.257 -2.190 -6.550 911 HD21 LEU 117 3HD2 LEU 117 -4.347 -1.884 -4.547 912 HD22 LEU 117 1HD2 LEU 117 -5.807 -2.385 -5.388 913 HD23 LEU 117 2HD2 LEU 117 -4.674 -1.294 -6.174 914 HA PRO 118 HA PRO 118 -8.034 -4.074 -11.114 915 HB2 PRO 118 1HB PRO 118 -8.882 -1.541 -11.561 916 HB3 PRO 118 2HB PRO 118 -9.646 -2.591 -10.348 917 HG2 PRO 118 1HG PRO 118 -7.652 -0.401 -9.967 918 HG3 PRO 118 2HG PRO 118 -9.086 -0.795 -9.003 919 HD2 PRO 118 1HD PRO 118 -6.510 -1.530 -8.299 920 HD3 PRO 118 2HD PRO 118 -7.971 -2.395 -7.762 921 H PHE 119 H PHE 119 -7.280 -4.031 -13.163 922 HA PHE 119 HA PHE 119 -4.697 -3.150 -13.776 923 HB2 PHE 119 1HB PHE 119 -5.879 -5.051 -14.834 924 HB3 PHE 119 2HB PHE 119 -6.932 -3.902 -15.654 925 HD1 PHE 119 HD2 PHE 119 -3.313 -4.644 -15.122 926 HD2 PHE 119 HD1 PHE 119 -6.314 -3.093 -17.771 927 HE1 PHE 119 HE2 PHE 119 -1.609 -4.400 -16.909 928 HE2 PHE 119 HE1 PHE 119 -4.612 -2.849 -19.561 929 HZ PHE 119 HZ PHE 119 -2.258 -3.503 -19.129 930 H GLY 120 H GLY 120 -3.875 -1.583 -15.012 931 HA2 GLY 120 1HA GLY 120 -4.702 0.167 -16.782 932 HA3 GLY 120 2HA GLY 120 -5.521 0.830 -15.371 933 H SER 121 H SER 121 -3.849 2.484 -16.583 934 HA SER 121 HA SER 121 -1.139 2.378 -15.788 935 HB2 SER 121 1HB SER 121 -1.134 4.804 -16.306 936 HB3 SER 121 2HB SER 121 -1.879 3.849 -17.586 937 HG SER 121 HG SER 121 -3.782 4.670 -17.103 938 H HIS 122 H HIS 122 -4.053 3.158 -14.127 939 HA HIS 122 HA HIS 122 -3.009 4.847 -12.112 940 HB2 HIS 122 1HB HIS 122 -5.439 4.546 -12.577 941 HB3 HIS 122 2HB HIS 122 -5.335 2.922 -11.901 942 HD2 HIS 122 HD2 HIS 122 -5.538 2.830 -9.127 943 HE1 HIS 122 HE1 HIS 122 -5.204 6.974 -8.394 944 HE2 HIS 122 HE2 HIS 122 -5.666 4.717 -7.328 945 H THR 123 H THR 123 -3.476 1.289 -12.210 946 HA THR 123 HA THR 123 -2.321 0.949 -9.604 947 HB THR 123 HB THR 123 -2.965 -1.058 -11.757 948 HG1 THR 123 HG1 THR 123 -4.729 -1.445 -10.386 949 HG21 THR 123 3HG2 THR 123 -1.301 -2.074 -10.394 950 HG22 THR 123 1HG2 THR 123 -2.836 -2.642 -9.737 951 HG23 THR 123 2HG2 THR 123 -1.953 -1.350 -8.923 952 H ARG 124 H ARG 124 -1.217 0.483 -12.932 953 HA ARG 124 HA ARG 124 1.228 -0.741 -12.425 954 HB2 ARG 124 1HB ARG 124 0.298 -0.543 -14.682 955 HB3 ARG 124 2HB ARG 124 0.499 1.200 -14.625 956 HG2 ARG 124 1HG ARG 124 2.323 0.095 -15.888 957 HG3 ARG 124 2HG ARG 124 2.924 0.972 -14.489 958 HD2 ARG 124 1HD ARG 124 3.802 -1.449 -14.935 959 HD3 ARG 124 2HD ARG 124 3.379 -0.990 -13.289 960 HE ARG 124 HE ARG 124 1.059 -2.029 -14.221 961 HH11 ARG 124 1HH2 ARG 124 4.346 -3.093 -14.255 962 HH12 ARG 124 2HH2 ARG 124 3.945 -4.778 -14.210 963 HH21 ARG 124 1HH1 ARG 124 0.519 -4.223 -14.157 964 HH22 ARG 124 2HH1 ARG 124 1.772 -5.418 -14.155 965 H THR 125 H THR 125 0.337 2.655 -12.284 966 HA THR 125 HA THR 125 2.922 3.763 -12.211 967 HB THR 125 HB THR 125 0.399 4.736 -10.848 968 HG1 THR 125 HG1 THR 125 0.834 4.387 -13.334 969 HG21 THR 125 3HG2 THR 125 3.031 6.064 -11.530 970 HG22 THR 125 1HG2 THR 125 2.319 5.866 -9.928 971 HG23 THR 125 2HG2 THR 125 1.575 6.960 -11.096 972 H PHE 126 H PHE 126 0.829 2.495 -9.656 973 HA PHE 126 HA PHE 126 2.322 3.247 -7.430 974 HB2 PHE 126 1HB PHE 126 0.060 2.193 -7.364 975 HB3 PHE 126 2HB PHE 126 0.810 0.647 -7.759 976 HD1 PHE 126 HD1 PHE 126 2.502 -0.358 -6.177 977 HD2 PHE 126 HD2 PHE 126 0.182 3.102 -5.166 978 HE1 PHE 126 HE1 PHE 126 3.043 -0.691 -3.781 979 HE2 PHE 126 HE2 PHE 126 0.707 2.771 -2.778 980 HZ PHE 126 HZ PHE 126 2.143 0.871 -2.080 981 H LEU 127 H LEU 127 2.613 0.237 -9.371 982 HA LEU 127 HA LEU 127 4.543 -1.054 -7.881 983 HB2 LEU 127 1HB LEU 127 4.549 -0.993 -10.903 984 HB3 LEU 127 2HB LEU 127 5.084 -2.300 -9.849 985 HG LEU 127 HG LEU 127 2.254 -1.312 -10.238 986 HD11 LEU 127 1HD1 LEU 127 1.852 -3.380 -11.308 987 HD12 LEU 127 2HD1 LEU 127 3.315 -4.110 -10.650 988 HD13 LEU 127 3HD1 LEU 127 3.432 -2.900 -11.925 989 HD21 LEU 127 3HD2 LEU 127 2.328 -1.864 -7.947 990 HD22 LEU 127 1HD2 LEU 127 3.487 -3.167 -8.197 991 HD23 LEU 127 2HD2 LEU 127 1.806 -3.372 -8.692 992 H GLN 128 H GLN 128 5.064 1.384 -10.472 993 HA GLN 128 HA GLN 128 7.840 1.208 -10.558 994 HB2 GLN 128 1HB GLN 128 6.178 3.690 -11.017 995 HB3 GLN 128 2HB GLN 128 7.745 3.303 -11.729 996 HG2 GLN 128 1HG GLN 128 5.143 1.817 -12.206 997 HG3 GLN 128 2HG GLN 128 5.980 2.842 -13.356 998 HE21 GLN 128 2HE2 GLN 128 5.376 -0.254 -13.183 999 HE22 GLN 128 1HE2 GLN 128 6.875 -0.938 -13.585 1000 H GLU 129 H GLU 129 5.749 3.219 -8.490 1001 HA GLU 129 HA GLU 129 7.826 4.771 -7.364 1002 HB2 GLU 129 1HB GLU 129 5.111 4.019 -6.266 1003 HB3 GLU 129 2HB GLU 129 6.184 5.208 -5.525 1004 HG2 GLU 129 1HG GLU 129 5.153 5.362 -8.375 1005 HG3 GLU 129 2HG GLU 129 4.465 6.246 -7.014 1006 H VAL 130 H VAL 130 6.586 1.579 -6.588 1007 HA VAL 130 HA VAL 130 7.679 1.337 -4.001 1008 HB VAL 130 HB VAL 130 7.105 -0.738 -6.127 1009 HG11 VAL 130 1HG1 VAL 130 8.029 -1.017 -3.274 1010 HG12 VAL 130 2HG1 VAL 130 8.675 -1.802 -4.710 1011 HG13 VAL 130 3HG1 VAL 130 7.106 -2.288 -4.068 1012 HG21 VAL 130 3HG2 VAL 130 5.067 -1.098 -4.901 1013 HG22 VAL 130 1HG2 VAL 130 5.217 0.644 -5.139 1014 HG23 VAL 130 2HG2 VAL 130 5.615 -0.070 -3.576 1015 H ALA 131 H ALA 131 8.987 0.443 -7.160 1016 HA ALA 131 HA ALA 131 11.432 -0.659 -6.412 1017 HB1 ALA 131 3HB ALA 131 12.168 -0.277 -8.635 1018 HB2 ALA 131 1HB ALA 131 11.114 1.123 -8.828 1019 HB3 ALA 131 2HB ALA 131 10.422 -0.498 -8.751 1020 H ARG 132 H ARG 132 10.632 2.777 -6.838 1021 HA ARG 132 HA ARG 132 13.338 3.654 -6.403 1022 HB2 ARG 132 1HB ARG 132 10.689 5.111 -6.441 1023 HB3 ARG 132 2HB ARG 132 12.232 5.921 -6.165 1024 HG2 ARG 132 1HG ARG 132 13.081 5.099 -8.312 1025 HG3 ARG 132 2HG ARG 132 11.580 4.219 -8.590 1026 HD2 ARG 132 1HD ARG 132 10.325 6.331 -8.595 1027 HD3 ARG 132 2HD ARG 132 11.806 7.225 -8.273 1028 HE ARG 132 HE ARG 132 12.448 6.910 -10.501 1029 HH11 ARG 132 1HH2 ARG 132 9.670 5.014 -9.676 1030 HH12 ARG 132 2HH2 ARG 132 9.302 4.590 -11.314 1031 HH21 ARG 132 1HH1 ARG 132 11.973 6.355 -12.649 1032 HH22 ARG 132 2HH1 ARG 132 10.605 5.350 -12.999 1033 H ALA 133 H ALA 133 10.659 2.835 -4.394 1034 HA ALA 133 HA ALA 133 11.172 4.328 -2.095 1035 HB1 ALA 133 3HB ALA 133 9.777 2.806 -0.955 1036 HB2 ALA 133 1HB ALA 133 10.210 1.476 -2.027 1037 HB3 ALA 133 2HB ALA 133 9.195 2.788 -2.619 1038 H CYS 134 H CYS 134 12.864 1.516 -3.346 1039 HA CYS 134 HA CYS 134 15.164 1.895 -1.911 1040 HB2 CYS 134 1HB CYS 134 13.086 0.648 -0.242 1041 HB3 CYS 134 2HB CYS 134 14.599 -0.256 -0.256 1042 HG CYS 134 HG CYS 134 15.066 2.721 0.201 1043 HA PRO 135 HA PRO 135 14.901 -2.820 -3.408 1044 HB2 PRO 135 1HB PRO 135 12.743 -2.321 -5.429 1045 HB3 PRO 135 2HB PRO 135 13.076 -3.778 -4.473 1046 HG2 PRO 135 1HG PRO 135 11.055 -2.157 -3.851 1047 HG3 PRO 135 2HG PRO 135 12.025 -2.948 -2.593 1048 HD2 PRO 135 1HD PRO 135 12.072 -0.093 -3.482 1049 HD3 PRO 135 2HD PRO 135 12.349 -0.775 -1.870 1050 H GLY 136 H GLY 136 14.008 -0.174 -5.653 1051 HA2 GLY 136 1HA GLY 136 15.575 -1.002 -7.829 1052 HA3 GLY 136 2HA GLY 136 15.043 0.651 -7.534 1053 H PHE 137 H PHE 137 17.218 -1.524 -5.793 1054 HA PHE 137 HA PHE 137 19.228 -1.019 -4.712 1055 HB2 PHE 137 1HB PHE 137 19.733 -0.624 -7.665 1056 HB3 PHE 137 2HB PHE 137 21.017 -0.761 -6.462 1057 HD1 PHE 137 HD1 PHE 137 18.264 -2.538 -8.167 1058 HD2 PHE 137 HD2 PHE 137 21.478 -2.866 -5.336 1059 HE1 PHE 137 HE1 PHE 137 18.076 -5.011 -8.239 1060 HE2 PHE 137 HE2 PHE 137 21.289 -5.338 -5.407 1061 HZ PHE 137 HZ PHE 137 19.589 -6.410 -6.859 1062 H ASP 138 H ASP 138 17.891 1.134 -4.037 1063 HA ASP 138 HA ASP 138 18.580 3.624 -5.047 1064 HB2 ASP 138 1HB ASP 138 17.216 2.598 -2.789 1065 HB3 ASP 138 2HB ASP 138 18.438 3.665 -2.118 1066 HA PRO 139 HA PRO 139 22.742 4.663 -4.024 1067 HB2 PRO 139 1HB PRO 139 21.928 6.409 -1.723 1068 HB3 PRO 139 2HB PRO 139 22.963 6.790 -3.114 1069 HG2 PRO 139 1HG PRO 139 20.480 7.698 -3.003 1070 HG3 PRO 139 2HG PRO 139 21.155 7.106 -4.535 1071 HD2 PRO 139 1HD PRO 139 19.221 5.758 -2.679 1072 HD3 PRO 139 2HD PRO 139 19.265 5.746 -4.457 1073 H GLU 140 H GLU 140 20.808 4.021 -1.113 1074 HA GLU 140 HA GLU 140 23.159 2.731 0.168 1075 HB2 GLU 140 1HB GLU 140 20.602 3.847 1.345 1076 HB3 GLU 140 2HB GLU 140 21.811 2.955 2.270 1077 HG2 GLU 140 1HG GLU 140 23.519 4.613 1.678 1078 HG3 GLU 140 2HG GLU 140 22.348 5.488 0.694 1079 H THR 141 H THR 141 19.607 2.320 0.104 1080 HA THR 141 HA THR 141 18.295 0.437 0.044 1081 HB THR 141 HB THR 141 20.682 -0.752 -1.397 1082 HG1 THR 141 HG1 THR 141 19.911 0.192 -3.156 1083 HG21 THR 141 3HG2 THR 141 18.562 -1.912 -2.542 1084 HG22 THR 141 1HG2 THR 141 17.853 -1.635 -0.951 1085 HG23 THR 141 2HG2 THR 141 19.319 -2.604 -1.108 1086 H ARG 142 H ARG 142 20.640 0.771 2.117 1087 HA ARG 142 HA ARG 142 21.213 -1.918 2.933 1088 HB2 ARG 142 1HB ARG 142 21.553 0.728 4.354 1089 HB3 ARG 142 2HB ARG 142 22.164 -0.816 4.951 1090 HG2 ARG 142 1HG ARG 142 23.532 -1.088 2.936 1091 HG3 ARG 142 2HG ARG 142 22.890 0.418 2.278 1092 HD2 ARG 142 1HD ARG 142 24.370 0.231 4.910 1093 HD3 ARG 142 2HD ARG 142 25.138 0.664 3.386 1094 HE ARG 142 HE ARG 142 22.919 2.349 3.744 1095 HH11 ARG 142 1HH2 ARG 142 25.975 1.623 5.192 1096 HH12 ARG 142 2HH2 ARG 142 26.226 3.225 5.799 1097 HH21 ARG 142 1HH1 ARG 142 23.240 4.456 4.536 1098 HH22 ARG 142 2HH1 ARG 142 24.677 4.829 5.427 1099 H ASP 143 H ASP 143 20.922 -1.952 5.602 1100 HA ASP 143 HA ASP 143 18.593 -3.117 6.199 1101 HB2 ASP 143 1HB ASP 143 20.427 -1.408 7.854 1102 HB3 ASP 143 2HB ASP 143 18.957 -2.027 8.593 1103 HA PRO 144 HA PRO 144 15.246 -0.258 5.945 1104 HB2 PRO 144 1HB PRO 144 13.843 -0.859 8.284 1105 HB3 PRO 144 2HB PRO 144 13.763 -1.804 6.785 1106 HG2 PRO 144 1HG PRO 144 15.438 -2.274 9.216 1107 HG3 PRO 144 2HG PRO 144 14.507 -3.437 8.252 1108 HD2 PRO 144 1HD PRO 144 17.134 -3.259 7.958 1109 HD3 PRO 144 2HD PRO 144 16.096 -3.467 6.529 1110 H GLU 145 H GLU 145 13.873 1.152 7.753 1111 HA GLU 145 HA GLU 145 15.484 2.437 9.751 1112 HB2 GLU 145 1HB GLU 145 16.426 3.445 7.669 1113 HB3 GLU 145 2HB GLU 145 14.821 4.057 7.278 1114 HG2 GLU 145 1HG GLU 145 15.976 5.853 8.367 1115 HG3 GLU 145 2HG GLU 145 14.840 5.217 9.551 1116 H PHE 146 H PHE 146 13.460 1.539 10.680 1117 HA PHE 146 HA PHE 146 11.022 3.073 10.159 1118 HB2 PHE 146 1HB PHE 146 10.052 1.475 11.849 1119 HB3 PHE 146 2HB PHE 146 10.705 0.715 10.397 1120 HD1 PHE 146 HD1 PHE 146 12.876 -0.459 10.456 1121 HD2 PHE 146 HD2 PHE 146 11.100 1.189 13.998 1122 HE1 PHE 146 HE1 PHE 146 14.416 -1.805 11.853 1123 HE2 PHE 146 HE2 PHE 146 12.639 -0.154 15.398 1124 HZ PHE 146 HZ PHE 146 14.301 -1.654 14.326 1125 H GLU 147 H GLU 147 13.529 4.116 11.488 1126 HA GLU 147 HA GLU 147 13.132 4.546 14.226 1127 HB2 GLU 147 1HB GLU 147 15.240 4.987 12.994 1128 HB3 GLU 147 2HB GLU 147 14.481 6.393 12.247 1129 HG2 GLU 147 1HG GLU 147 14.123 7.399 14.457 1130 HG3 GLU 147 2HG GLU 147 14.825 5.978 15.230 1131 H TRP 148 H TRP 148 11.886 6.351 11.434 1132 HA TRP 148 HA TRP 148 10.757 8.418 13.139 1133 HB2 TRP 148 1HB TRP 148 9.848 9.343 11.016 1134 HB3 TRP 148 2HB TRP 148 11.597 9.128 11.000 1135 HD1 TRP 148 HD1 TRP 148 12.439 6.723 9.841 1136 HE1 TRP 148 HE1 TRP 148 11.506 5.579 7.733 1137 HE3 TRP 148 HE3 TRP 148 7.881 9.009 9.538 1138 HZ2 TRP 148 HZ2 TRP 148 9.149 5.631 6.122 1139 HZ3 TRP 148 HZ3 TRP 148 6.315 8.446 7.700 1140 HH2 TRP 148 HH2 TRP 148 6.941 6.760 5.989 1141 H LEU 149 H LEU 149 9.706 5.378 11.839 1142 HA LEU 149 HA LEU 149 6.924 5.818 11.714 1143 HB2 LEU 149 1HB LEU 149 8.665 3.399 12.118 1144 HB3 LEU 149 2HB LEU 149 6.925 3.247 12.351 1145 HG LEU 149 HG LEU 149 6.477 3.957 10.097 1146 HD11 LEU 149 1HD1 LEU 149 8.571 4.388 8.593 1147 HD12 LEU 149 2HD1 LEU 149 9.386 4.740 10.117 1148 HD13 LEU 149 3HD1 LEU 149 7.978 5.679 9.631 1149 HD21 LEU 149 3HD2 LEU 149 8.879 2.119 9.932 1150 HD22 LEU 149 1HD2 LEU 149 7.465 2.142 8.877 1151 HD23 LEU 149 2HD2 LEU 149 7.311 1.590 10.546 1152 H SER 150 H SER 150 9.068 5.003 14.427 1153 HA SER 150 HA SER 150 7.259 4.360 16.395 1154 HB2 SER 150 1HB SER 150 9.638 6.206 16.705 1155 HB3 SER 150 2HB SER 150 8.849 5.304 17.996 1156 HG SER 150 HG SER 150 10.264 4.303 15.750 1157 H ARG 151 H ARG 151 7.935 7.507 14.977 1158 HA ARG 151 HA ARG 151 6.329 8.991 16.866 1159 HB2 ARG 151 1HB ARG 151 7.401 9.756 14.140 1160 HB3 ARG 151 2HB ARG 151 6.727 10.871 15.329 1161 HG2 ARG 151 1HG ARG 151 8.497 10.332 16.904 1162 HG3 ARG 151 2HG ARG 151 9.130 9.095 15.814 1163 HD2 ARG 151 1HD ARG 151 10.464 11.095 15.529 1164 HD3 ARG 151 2HD ARG 151 9.475 10.866 14.088 1165 HE ARG 151 HE ARG 151 8.098 12.528 15.926 1166 HH11 ARG 151 1HH2 ARG 151 10.816 12.482 13.770 1167 HH12 ARG 151 2HH2 ARG 151 10.767 14.184 13.458 1168 HH21 ARG 151 1HH1 ARG 151 8.031 14.755 15.510 1169 HH22 ARG 151 2HH1 ARG 151 9.193 15.471 14.443 1170 H HIS 152 H HIS 152 5.340 6.704 15.112 1171 HA HIS 152 HA HIS 152 2.779 7.937 14.423 1172 HB2 HIS 152 1HB HIS 152 4.416 6.257 12.502 1173 HB3 HIS 152 2HB HIS 152 2.744 6.752 12.244 1174 HD2 HIS 152 HD2 HIS 152 6.257 8.133 11.604 1175 HE1 HIS 152 HE1 HIS 152 3.636 11.433 11.342 1176 HE2 HIS 152 HE2 HIS 152 6.005 10.633 10.891 1177 H THR 153 H THR 153 1.102 6.423 14.299 1178 HA THR 153 HA THR 153 1.626 3.671 15.188 1179 HB THR 153 HB THR 153 -0.462 5.361 16.555 1180 HG1 THR 153 HG1 THR 153 2.068 4.719 17.625 1181 HG21 THR 153 3HG2 THR 153 -0.224 2.658 16.483 1182 HG22 THR 153 1HG2 THR 153 -0.815 3.519 17.903 1183 HG23 THR 153 2HG2 THR 153 0.868 3.011 17.819 1184 H CYS 154 H CYS 154 -1.464 3.909 15.781 1185 HA CYS 154 HA CYS 154 -2.471 4.037 13.029 1186 HB2 CYS 154 1HB CYS 154 -3.136 1.602 14.667 1187 HB3 CYS 154 2HB CYS 154 -3.237 1.832 12.921 1188 HG CYS 154 HG CYS 154 -0.376 2.098 13.593 1189 H ALA 155 H ALA 155 -4.700 4.395 12.909 1190 HA ALA 155 HA ALA 155 -5.872 5.471 15.375 1191 HB1 ALA 155 3HB ALA 155 -6.980 5.517 12.566 1192 HB2 ALA 155 1HB ALA 155 -5.897 6.750 13.210 1193 HB3 ALA 155 2HB ALA 155 -7.490 6.511 13.929 1194 H GLU 156 H GLU 156 -6.417 3.584 16.501 1195 HA GLU 156 HA GLU 156 -8.436 1.801 15.261 1196 HB2 GLU 156 1HB GLU 156 -6.570 1.414 17.610 1197 HB3 GLU 156 2HB GLU 156 -7.856 0.286 17.176 1198 HG2 GLU 156 1HG GLU 156 -6.858 -0.185 15.055 1199 HG3 GLU 156 2HG GLU 156 -5.740 1.168 15.208 1200 HA PRO 157 HA PRO 157 -11.084 4.470 17.946 1201 HB2 PRO 157 1HB PRO 157 -13.082 2.560 16.772 1202 HB3 PRO 157 2HB PRO 157 -13.190 4.322 16.971 1203 HG2 PRO 157 1HG PRO 157 -12.689 3.286 14.602 1204 HG3 PRO 157 2HG PRO 157 -11.829 4.738 15.145 1205 HD2 PRO 157 1HD PRO 157 -10.831 1.910 14.982 1206 HD3 PRO 157 2HD PRO 157 -9.970 3.433 14.657 1207 H ASP 158 H ASP 158 -13.221 3.501 19.243 1208 HA ASP 158 HA ASP 158 -12.057 1.523 21.085 1209 HB2 ASP 158 1HB ASP 158 -13.784 2.291 22.643 1210 HB3 ASP 158 2HB ASP 158 -12.842 3.647 22.023 1211 H ALA 159 H ALA 159 -12.435 -0.343 19.807 1212 HA ALA 159 HA ALA 159 -14.924 -1.071 18.714 1213 HB1 ALA 159 3HB ALA 159 -12.566 -2.714 19.645 1214 HB2 ALA 159 1HB ALA 159 -12.981 -2.254 17.993 1215 HB3 ALA 159 2HB ALA 159 -13.977 -3.422 18.860 1216 H GLU 160 H GLU 160 -13.507 -1.627 21.917 1217 HA GLU 160 HA GLU 160 -16.188 -2.270 22.953 1218 HB2 GLU 160 1HB GLU 160 -15.238 -4.165 24.252 1219 HB3 GLU 160 2HB GLU 160 -15.188 -4.441 22.511 1220 HG2 GLU 160 1HG GLU 160 -12.836 -3.732 22.447 1221 HG3 GLU 160 2HG GLU 160 -12.872 -3.418 24.182 1222 H SER 161 H SER 161 -13.082 -0.871 23.300 1223 HA SER 161 HA SER 161 -13.066 -0.598 26.149 1224 HB2 SER 161 1HB SER 161 -11.332 1.187 25.638 1225 HB3 SER 161 2HB SER 161 -10.966 -0.431 25.043 1226 HG SER 161 HG SER 161 -12.064 1.751 23.592 Start of MODEL 4 1 H1 GLY 1 1H GLY 1 -19.349 -3.508 -13.328 2 H2 GLY 1 2H GLY 1 -19.817 -4.893 -12.462 3 H3 GLY 1 3H GLY 1 -19.122 -5.046 -14.005 4 HA2 GLY 1 1HA GLY 1 -17.682 -5.471 -11.912 5 HA3 GLY 1 2HA GLY 1 -17.010 -4.583 -13.280 6 HA PRO 2 HA PRO 2 -17.003 -2.071 -9.222 7 HB2 PRO 2 1HB PRO 2 -14.256 -1.994 -8.900 8 HB3 PRO 2 2HB PRO 2 -15.304 -3.213 -8.149 9 HG2 PRO 2 1HG PRO 2 -13.665 -3.413 -10.642 10 HG3 PRO 2 2HG PRO 2 -13.880 -4.598 -9.338 11 HD2 PRO 2 1HD PRO 2 -15.221 -4.817 -11.681 12 HD3 PRO 2 2HD PRO 2 -15.963 -5.300 -10.137 13 H LEU 3 H LEU 3 -16.729 0.131 -9.261 14 HA LEU 3 HA LEU 3 -15.899 1.309 -11.814 15 HB2 LEU 3 1HB LEU 3 -16.738 3.448 -10.398 16 HB3 LEU 3 2HB LEU 3 -17.859 2.384 -11.242 17 HG LEU 3 HG LEU 3 -17.071 1.679 -8.422 18 HD11 LEU 3 1HD1 LEU 3 -19.148 3.761 -9.161 19 HD12 LEU 3 2HD1 LEU 3 -17.650 4.063 -8.284 20 HD13 LEU 3 3HD1 LEU 3 -18.917 3.079 -7.552 21 HD21 LEU 3 3HD2 LEU 3 -18.617 0.345 -10.111 22 HD22 LEU 3 1HD2 LEU 3 -19.834 1.522 -9.620 23 HD23 LEU 3 2HD2 LEU 3 -19.079 0.478 -8.417 24 H GLY 4 H GLY 4 -13.822 1.805 -12.035 25 HA2 GLY 4 1HA GLY 4 -11.917 1.980 -10.002 26 HA3 GLY 4 2HA GLY 4 -11.730 2.677 -11.610 27 H SER 5 H SER 5 -10.671 3.900 -9.341 28 HA SER 5 HA SER 5 -11.985 6.490 -9.481 29 HB2 SER 5 1HB SER 5 -12.530 6.730 -7.221 30 HB3 SER 5 2HB SER 5 -13.022 5.072 -7.552 31 HG SER 5 HG SER 5 -10.545 5.922 -6.441 32 H MET 6 H MET 6 -10.683 8.184 -8.418 33 HA MET 6 HA MET 6 -7.823 7.435 -8.148 34 HB2 MET 6 1HB MET 6 -9.016 9.817 -9.581 35 HB3 MET 6 2HB MET 6 -7.300 9.641 -9.206 36 HG2 MET 6 1HG MET 6 -7.217 7.549 -10.495 37 HG3 MET 6 2HG MET 6 -8.939 7.685 -10.844 38 HE1 MET 6 3HE MET 6 -6.176 10.801 -10.963 39 HE2 MET 6 1HE MET 6 -5.416 10.077 -12.385 40 HE3 MET 6 2HE MET 6 -5.578 9.146 -10.898 41 H ASP 7 H ASP 7 -10.502 8.727 -6.644 42 HA ASP 7 HA ASP 7 -9.383 10.908 -5.208 43 HB2 ASP 7 1HB ASP 7 -11.704 9.068 -4.638 44 HB3 ASP 7 2HB ASP 7 -11.279 10.423 -3.594 45 H GLN 8 H GLN 8 -8.982 7.541 -4.967 46 HA GLN 8 HA GLN 8 -8.579 6.859 -2.373 47 HB2 GLN 8 1HB GLN 8 -6.582 6.322 -4.577 48 HB3 GLN 8 2HB GLN 8 -6.792 5.369 -3.104 49 HG2 GLN 8 1HG GLN 8 -8.842 5.748 -5.306 50 HG3 GLN 8 2HG GLN 8 -7.920 4.281 -4.984 51 HE21 GLN 8 2HE2 GLN 8 -8.683 2.882 -3.369 52 HE22 GLN 8 1HE2 GLN 8 -10.062 3.190 -2.438 53 H SER 9 H SER 9 -6.043 8.388 -4.356 54 HA SER 9 HA SER 9 -4.137 8.794 -2.386 55 HB2 SER 9 1HB SER 9 -3.227 10.556 -3.792 56 HB3 SER 9 2HB SER 9 -3.792 9.232 -4.807 57 HG SER 9 HG SER 9 -4.948 11.760 -4.332 58 H VAL 10 H VAL 10 -6.843 10.935 -3.264 59 HA VAL 10 HA VAL 10 -6.196 12.992 -1.423 60 HB VAL 10 HB VAL 10 -8.852 12.179 -2.633 61 HG11 VAL 10 1HG1 VAL 10 -8.032 14.580 -0.985 62 HG12 VAL 10 2HG1 VAL 10 -9.364 13.464 -0.681 63 HG13 VAL 10 3HG1 VAL 10 -9.447 14.588 -2.039 64 HG21 VAL 10 3HG2 VAL 10 -8.406 14.047 -4.160 65 HG22 VAL 10 1HG2 VAL 10 -7.078 12.887 -4.225 66 HG23 VAL 10 2HG2 VAL 10 -6.893 14.391 -3.322 67 H ALA 11 H ALA 11 -8.432 10.251 -1.217 68 HA ALA 11 HA ALA 11 -9.596 10.584 1.206 69 HB1 ALA 11 3HB ALA 11 -8.453 7.956 0.235 70 HB2 ALA 11 1HB ALA 11 -9.991 8.642 -0.286 71 HB3 ALA 11 2HB ALA 11 -9.762 8.164 1.396 72 H ILE 12 H ILE 12 -6.311 9.267 0.683 73 HA ILE 12 HA ILE 12 -5.781 8.674 3.372 74 HB ILE 12 HB ILE 12 -3.837 9.587 1.245 75 HG12 ILE 12 1HG1 ILE 12 -5.184 7.735 0.411 76 HG13 ILE 12 2HG1 ILE 12 -3.566 7.151 0.787 77 HG21 ILE 12 1HG2 ILE 12 -2.338 7.963 2.612 78 HG22 ILE 12 2HG2 ILE 12 -3.527 8.192 3.893 79 HG23 ILE 12 3HG2 ILE 12 -2.639 9.576 3.259 80 HD11 ILE 12 3HD1 ILE 12 -4.622 6.563 3.129 81 HD12 ILE 12 1HD1 ILE 12 -4.910 5.502 1.751 82 HD13 ILE 12 2HD1 ILE 12 -6.146 6.654 2.250 83 H GLN 13 H GLN 13 -4.846 11.492 1.475 84 HA GLN 13 HA GLN 13 -3.655 12.985 3.465 85 HB2 GLN 13 1HB GLN 13 -4.854 13.618 0.870 86 HB3 GLN 13 2HB GLN 13 -5.002 14.962 2.001 87 HG2 GLN 13 1HG GLN 13 -2.402 13.494 1.453 88 HG3 GLN 13 2HG GLN 13 -2.870 15.000 0.662 89 HE21 GLN 13 2HE2 GLN 13 -1.247 13.750 3.428 90 HE22 GLN 13 1HE2 GLN 13 -1.231 15.186 4.328 91 H GLU 14 H GLU 14 -7.154 12.922 2.694 92 HA GLU 14 HA GLU 14 -8.051 14.730 4.582 93 HB2 GLU 14 1HB GLU 14 -9.310 12.124 3.685 94 HB3 GLU 14 2HB GLU 14 -10.160 13.414 4.538 95 HG2 GLU 14 1HG GLU 14 -8.731 13.773 1.890 96 HG3 GLU 14 2HG GLU 14 -10.466 13.503 2.049 97 H THR 15 H THR 15 -6.307 11.935 5.141 98 HA THR 15 HA THR 15 -7.229 11.777 7.968 99 HB THR 15 HB THR 15 -6.751 9.437 8.003 100 HG1 THR 15 HG1 THR 15 -5.524 10.022 5.551 101 HG21 THR 15 3HG2 THR 15 -8.226 8.597 6.165 102 HG22 THR 15 1HG2 THR 15 -8.218 10.211 5.468 103 HG23 THR 15 2HG2 THR 15 -8.924 9.944 7.061 104 H LEU 16 H LEU 16 -4.510 12.028 5.780 105 HA LEU 16 HA LEU 16 -2.532 11.438 7.780 106 HB2 LEU 16 1HB LEU 16 -2.197 11.154 5.290 107 HB3 LEU 16 2HB LEU 16 -2.136 12.909 5.173 108 HG LEU 16 HG LEU 16 -0.203 12.961 6.700 109 HD11 LEU 16 1HD1 LEU 16 0.890 10.528 6.947 110 HD12 LEU 16 2HD1 LEU 16 -0.797 10.022 6.871 111 HD13 LEU 16 3HD1 LEU 16 -0.264 11.134 8.131 112 HD21 LEU 16 3HD2 LEU 16 -0.135 11.325 4.168 113 HD22 LEU 16 1HD2 LEU 16 1.345 11.519 5.105 114 HD23 LEU 16 2HD2 LEU 16 0.513 12.936 4.472 115 H VAL 17 H VAL 17 -1.386 12.821 9.057 116 HA VAL 17 HA VAL 17 -2.518 15.289 9.761 117 HB VAL 17 HB VAL 17 -1.078 13.775 11.214 118 HG11 VAL 17 1HG1 VAL 17 0.734 13.669 9.376 119 HG12 VAL 17 2HG1 VAL 17 1.280 13.855 11.043 120 HG13 VAL 17 3HG1 VAL 17 1.239 15.252 9.967 121 HG21 VAL 17 3HG2 VAL 17 -1.720 16.163 11.768 122 HG22 VAL 17 1HG2 VAL 17 -0.166 16.664 11.102 123 HG23 VAL 17 2HG2 VAL 17 -0.220 15.616 12.517 124 H GLU 18 H GLU 18 -1.357 17.375 9.705 125 HA GLU 18 HA GLU 18 -0.585 17.958 6.991 126 HB2 GLU 18 1HB GLU 18 -0.852 19.681 9.459 127 HB3 GLU 18 2HB GLU 18 -0.457 20.304 7.856 128 HG2 GLU 18 1HG GLU 18 -2.546 19.433 6.954 129 HG3 GLU 18 2HG GLU 18 -2.932 18.678 8.501 130 H GLY 19 H GLY 19 1.402 17.790 6.244 131 HA2 GLY 19 1HA GLY 19 3.653 19.013 6.674 132 HA3 GLY 19 2HA GLY 19 3.703 17.978 8.095 133 H GLU 20 H GLU 20 2.375 15.756 6.546 134 HA GLU 20 HA GLU 20 4.851 14.684 5.424 135 HB2 GLU 20 1HB GLU 20 2.170 13.466 6.068 136 HB3 GLU 20 2HB GLU 20 3.408 12.585 5.175 137 HG2 GLU 20 1HG GLU 20 3.789 11.961 7.416 138 HG3 GLU 20 2HG GLU 20 4.994 13.209 7.133 139 H TYR 21 H TYR 21 4.199 13.019 3.516 140 HA TYR 21 HA TYR 21 2.744 14.496 1.412 141 HB2 TYR 21 1HB TYR 21 5.235 15.048 1.429 142 HB3 TYR 21 2HB TYR 21 5.509 13.364 0.989 143 HD1 TYR 21 HD1 TYR 21 3.851 16.516 -0.082 144 HD2 TYR 21 HD2 TYR 21 5.147 12.586 -1.232 145 HE1 TYR 21 HE1 TYR 21 3.410 17.066 -2.459 146 HE2 TYR 21 HE2 TYR 21 4.705 13.136 -3.609 147 HH TYR 21 HH TYR 21 3.284 16.261 -4.538 148 H CYS 22 H CYS 22 1.406 13.163 0.389 149 HA CYS 22 HA CYS 22 1.969 10.255 0.404 150 HB2 CYS 22 1HB CYS 22 -0.219 10.651 1.276 151 HB3 CYS 22 2HB CYS 22 -0.586 11.835 0.022 152 HG CYS 22 HG CYS 22 -1.169 10.000 -1.556 153 H VAL 23 H VAL 23 2.271 9.187 -1.563 154 HA VAL 23 HA VAL 23 2.563 10.946 -3.919 155 HB VAL 23 HB VAL 23 3.699 8.216 -3.273 156 HG11 VAL 23 1HG1 VAL 23 3.929 9.971 -5.729 157 HG12 VAL 23 2HG1 VAL 23 3.368 8.300 -5.651 158 HG13 VAL 23 3HG1 VAL 23 5.066 8.674 -5.368 159 HG21 VAL 23 3HG2 VAL 23 5.785 9.339 -3.013 160 HG22 VAL 23 1HG2 VAL 23 4.616 10.298 -2.103 161 HG23 VAL 23 2HG2 VAL 23 5.147 10.834 -3.697 162 H ILE 24 H ILE 24 1.124 7.918 -2.817 163 HA ILE 24 HA ILE 24 -0.960 8.062 -4.776 164 HB ILE 24 HB ILE 24 0.877 7.323 -6.224 165 HG12 ILE 24 1HG1 ILE 24 -0.959 4.982 -5.659 166 HG13 ILE 24 2HG1 ILE 24 -1.485 6.435 -6.510 167 HG21 ILE 24 1HG2 ILE 24 2.153 6.229 -4.336 168 HG22 ILE 24 2HG2 ILE 24 2.071 5.280 -5.820 169 HG23 ILE 24 3HG2 ILE 24 1.029 4.874 -4.458 170 HD11 ILE 24 3HD1 ILE 24 -0.694 4.500 -7.975 171 HD12 ILE 24 1HD1 ILE 24 0.928 4.830 -7.367 172 HD13 ILE 24 2HD1 ILE 24 0.064 6.062 -8.286 173 H ALA 25 H ALA 25 -2.418 6.189 -4.660 174 HA ALA 25 HA ALA 25 -2.088 4.239 -2.583 175 HB1 ALA 25 3HB ALA 25 -4.068 6.489 -2.161 176 HB2 ALA 25 1HB ALA 25 -2.636 6.181 -1.184 177 HB3 ALA 25 2HB ALA 25 -3.973 5.031 -1.182 178 H VAL 26 H VAL 26 -2.970 2.515 -3.567 179 HA VAL 26 HA VAL 26 -5.380 2.911 -5.247 180 HB VAL 26 HB VAL 26 -4.759 0.811 -6.325 181 HG11 VAL 26 1HG1 VAL 26 -2.290 2.547 -6.095 182 HG12 VAL 26 2HG1 VAL 26 -3.731 3.068 -6.968 183 HG13 VAL 26 3HG1 VAL 26 -2.845 1.639 -7.500 184 HG21 VAL 26 3HG2 VAL 26 -2.523 0.856 -4.281 185 HG22 VAL 26 1HG2 VAL 26 -2.506 -0.176 -5.710 186 HG23 VAL 26 2HG2 VAL 26 -3.756 -0.387 -4.483 187 H GLN 27 H GLN 27 -6.264 0.284 -5.299 188 HA GLN 27 HA GLN 27 -6.781 -0.474 -2.509 189 HB2 GLN 27 1HB GLN 27 -8.553 1.137 -3.166 190 HB3 GLN 27 2HB GLN 27 -8.981 0.085 -4.513 191 HG2 GLN 27 1HG GLN 27 -9.462 -1.742 -2.922 192 HG3 GLN 27 2HG GLN 27 -9.039 -0.677 -1.590 193 HE21 GLN 27 2HE2 GLN 27 -11.478 -1.554 -1.276 194 HE22 GLN 27 1HE2 GLN 27 -12.652 -0.449 -1.782 195 H GLY 28 H GLY 28 -7.503 -2.619 -2.270 196 HA2 GLY 28 1HA GLY 28 -7.752 -4.270 -4.684 197 HA3 GLY 28 2HA GLY 28 -6.412 -4.634 -3.603 198 H VAL 29 H VAL 29 -7.087 -6.591 -2.942 199 HA VAL 29 HA VAL 29 -9.304 -6.650 -1.023 200 HB VAL 29 HB VAL 29 -10.442 -8.466 -1.967 201 HG11 VAL 29 1HG1 VAL 29 -10.748 -6.311 -3.185 202 HG12 VAL 29 2HG1 VAL 29 -11.053 -7.725 -4.194 203 HG13 VAL 29 3HG1 VAL 29 -9.538 -6.837 -4.354 204 HG21 VAL 29 3HG2 VAL 29 -7.868 -8.939 -3.447 205 HG22 VAL 29 1HG2 VAL 29 -9.362 -9.492 -4.205 206 HG23 VAL 29 2HG2 VAL 29 -8.904 -10.089 -2.611 207 H LEU 30 H LEU 30 -9.258 -8.712 0.223 208 HA LEU 30 HA LEU 30 -6.609 -10.034 0.247 209 HB2 LEU 30 1HB LEU 30 -6.928 -8.088 2.037 210 HB3 LEU 30 2HB LEU 30 -7.924 -9.273 2.872 211 HG LEU 30 HG LEU 30 -5.694 -9.496 3.731 212 HD11 LEU 30 1HD1 LEU 30 -7.004 -11.596 3.109 213 HD12 LEU 30 2HD1 LEU 30 -5.269 -11.801 3.327 214 HD13 LEU 30 3HD1 LEU 30 -5.947 -11.724 1.703 215 HD21 LEU 30 3HD2 LEU 30 -4.183 -10.293 1.391 216 HD22 LEU 30 1HD2 LEU 30 -3.891 -8.963 2.502 217 HD23 LEU 30 2HD2 LEU 30 -4.903 -8.717 1.091 218 H CYS 31 H CYS 31 -7.147 -12.214 -0.009 219 HA CYS 31 HA CYS 31 -9.798 -13.081 0.933 220 HB2 CYS 31 1HB CYS 31 -9.597 -14.829 -0.688 221 HB3 CYS 31 2HB CYS 31 -9.114 -13.331 -1.487 222 HG CYS 31 HG CYS 31 -7.300 -15.717 -0.977 223 H LYS 32 H LYS 32 -9.975 -14.454 2.564 224 HA LYS 32 HA LYS 32 -7.580 -15.965 3.465 225 HB2 LYS 32 1HB LYS 32 -9.805 -14.797 5.168 226 HB3 LYS 32 2HB LYS 32 -8.481 -15.802 5.761 227 HG2 LYS 32 1HG LYS 32 -6.860 -14.119 4.888 228 HG3 LYS 32 2HG LYS 32 -8.218 -13.102 4.413 229 HD2 LYS 32 1HD LYS 32 -8.974 -13.077 6.798 230 HD3 LYS 32 2HD LYS 32 -7.516 -13.971 7.225 231 HE2 LYS 32 1HE LYS 32 -6.115 -12.168 6.351 232 HE3 LYS 32 2HE LYS 32 -7.550 -11.276 5.850 233 HZ1 LYS 32 3HZ LYS 32 -8.215 -11.505 8.308 234 HZ2 LYS 32 1HZ LYS 32 -7.050 -10.346 7.885 235 HZ3 LYS 32 2HZ LYS 32 -6.567 -11.823 8.573 236 H GLY 33 H GLY 33 -7.906 -18.007 2.839 237 HA2 GLY 33 1HA GLY 33 -8.911 -20.060 2.551 238 HA3 GLY 33 2HA GLY 33 -10.036 -19.580 3.819 239 H ASP 34 H ASP 34 -12.063 -18.909 3.286 240 HA ASP 34 HA ASP 34 -12.753 -18.609 0.417 241 HB2 ASP 34 1HB ASP 34 -14.151 -20.241 2.544 242 HB3 ASP 34 2HB ASP 34 -14.956 -19.727 1.062 243 H SER 35 H SER 35 -12.147 -16.695 2.535 244 HA SER 35 HA SER 35 -14.732 -15.230 2.646 245 HB2 SER 35 1HB SER 35 -12.495 -15.196 4.692 246 HB3 SER 35 2HB SER 35 -13.970 -14.236 4.760 247 HG SER 35 HG SER 35 -14.561 -15.960 5.880 248 H ARG 36 H ARG 36 -14.631 -13.490 1.348 249 HA ARG 36 HA ARG 36 -12.012 -12.361 0.652 250 HB2 ARG 36 1HB ARG 36 -14.764 -11.728 -0.441 251 HB3 ARG 36 2HB ARG 36 -13.227 -11.180 -1.103 252 HG2 ARG 36 1HG ARG 36 -13.861 -14.117 -0.790 253 HG3 ARG 36 2HG ARG 36 -14.332 -13.218 -2.230 254 HD2 ARG 36 1HD ARG 36 -11.940 -12.547 -2.531 255 HD3 ARG 36 2HD ARG 36 -11.510 -13.583 -1.176 256 HE ARG 36 HE ARG 36 -12.347 -14.454 -3.836 257 HH11 ARG 36 1HH2 ARG 36 -11.681 -15.252 -0.524 258 HH12 ARG 36 2HH2 ARG 36 -11.442 -16.937 -0.840 259 HH21 ARG 36 1HH1 ARG 36 -12.032 -16.658 -4.245 260 HH22 ARG 36 2HH1 ARG 36 -11.641 -17.732 -2.944 261 H GLN 37 H GLN 37 -11.401 -10.313 1.043 262 HA GLN 37 HA GLN 37 -13.184 -8.593 2.666 263 HB2 GLN 37 1HB GLN 37 -10.277 -9.264 3.171 264 HB3 GLN 37 2HB GLN 37 -11.159 -7.975 3.995 265 HG2 GLN 37 1HG GLN 37 -12.715 -9.538 4.948 266 HG3 GLN 37 2HG GLN 37 -12.091 -10.853 3.953 267 HE21 GLN 37 2HE2 GLN 37 -10.043 -11.801 4.537 268 HE22 GLN 37 1HE2 GLN 37 -9.321 -11.496 6.037 269 H SER 38 H SER 38 -12.434 -6.354 2.706 270 HA SER 38 HA SER 38 -11.108 -5.556 0.160 271 HB2 SER 38 1HB SER 38 -13.268 -4.010 1.602 272 HB3 SER 38 2HB SER 38 -12.543 -3.634 0.043 273 HG SER 38 HG SER 38 -13.533 -5.366 -0.846 274 H ARG 39 H ARG 39 -9.323 -4.394 0.357 275 HA ARG 39 HA ARG 39 -8.856 -2.871 2.863 276 HB2 ARG 39 1HB ARG 39 -6.870 -4.543 1.324 277 HB3 ARG 39 2HB ARG 39 -6.474 -3.521 2.699 278 HG2 ARG 39 1HG ARG 39 -8.557 -5.699 2.910 279 HG3 ARG 39 2HG ARG 39 -6.847 -6.045 3.148 280 HD2 ARG 39 1HD ARG 39 -6.795 -4.244 4.902 281 HD3 ARG 39 2HD ARG 39 -8.540 -4.097 4.744 282 HE ARG 39 HE ARG 39 -7.082 -6.330 5.948 283 HH11 ARG 39 1HH2 ARG 39 -10.058 -5.032 4.742 284 HH12 ARG 39 2HH2 ARG 39 -11.056 -6.114 5.652 285 HH21 ARG 39 1HH1 ARG 39 -8.390 -7.752 7.142 286 HH22 ARG 39 2HH1 ARG 39 -10.115 -7.653 7.010 287 H LEU 40 H LEU 40 -7.601 -1.038 2.667 288 HA LEU 40 HA LEU 40 -7.428 0.062 -0.089 289 HB2 LEU 40 1HB LEU 40 -9.011 1.237 1.389 290 HB3 LEU 40 2HB LEU 40 -7.730 1.507 2.556 291 HG LEU 40 HG LEU 40 -6.470 2.767 0.753 292 HD11 LEU 40 1HD1 LEU 40 -9.084 2.279 -0.682 293 HD12 LEU 40 2HD1 LEU 40 -7.448 2.024 -1.277 294 HD13 LEU 40 3HD1 LEU 40 -8.062 3.658 -1.076 295 HD21 LEU 40 3HD2 LEU 40 -7.688 3.962 2.482 296 HD22 LEU 40 1HD2 LEU 40 -9.203 3.750 1.603 297 HD23 LEU 40 2HD2 LEU 40 -7.937 4.782 0.941 298 H LEU 41 H LEU 41 -5.407 0.180 -0.889 299 HA LEU 41 HA LEU 41 -3.118 0.024 0.892 300 HB2 LEU 41 1HB LEU 41 -3.485 0.019 -2.105 301 HB3 LEU 41 2HB LEU 41 -1.889 0.120 -1.369 302 HG LEU 41 HG LEU 41 -2.434 -1.978 -0.078 303 HD11 LEU 41 1HD1 LEU 41 -4.307 -3.355 -1.189 304 HD12 LEU 41 2HD1 LEU 41 -4.883 -1.823 -1.841 305 HD13 LEU 41 3HD1 LEU 41 -4.805 -2.066 -0.096 306 HD21 LEU 41 3HD2 LEU 41 -1.050 -2.126 -2.057 307 HD22 LEU 41 1HD2 LEU 41 -2.464 -2.041 -3.108 308 HD23 LEU 41 2HD2 LEU 41 -2.197 -3.465 -2.101 309 H GLY 42 H GLY 42 -1.430 1.553 0.958 310 HA2 GLY 42 1HA GLY 42 -1.831 4.169 -0.285 311 HA3 GLY 42 2HA GLY 42 -1.844 4.116 1.471 312 H LEU 43 H LEU 43 0.066 5.130 -0.763 313 HA LEU 43 HA LEU 43 2.555 4.039 0.448 314 HB2 LEU 43 1HB LEU 43 2.406 3.314 -1.871 315 HB3 LEU 43 2HB LEU 43 2.074 4.959 -2.393 316 HG LEU 43 HG LEU 43 4.288 5.682 -1.693 317 HD11 LEU 43 1HD1 LEU 43 5.894 3.720 -0.993 318 HD12 LEU 43 2HD1 LEU 43 4.402 2.904 -0.521 319 HD13 LEU 43 3HD1 LEU 43 4.843 4.443 0.220 320 HD21 LEU 43 3HD2 LEU 43 4.220 3.149 -3.351 321 HD22 LEU 43 1HD2 LEU 43 5.664 4.147 -3.191 322 HD23 LEU 43 2HD2 LEU 43 4.209 4.815 -3.929 323 H VAL 44 H VAL 44 3.701 5.530 1.541 324 HA VAL 44 HA VAL 44 3.329 8.400 0.802 325 HB VAL 44 HB VAL 44 3.571 7.379 3.620 326 HG11 VAL 44 1HG1 VAL 44 4.216 9.786 2.973 327 HG12 VAL 44 2HG1 VAL 44 3.053 9.591 4.281 328 HG13 VAL 44 3HG1 VAL 44 2.497 10.026 2.667 329 HG21 VAL 44 3HG2 VAL 44 1.118 7.911 3.763 330 HG22 VAL 44 1HG2 VAL 44 1.495 6.514 2.753 331 HG23 VAL 44 2HG2 VAL 44 1.111 8.066 2.006 332 H ARG 45 H ARG 45 5.097 9.571 0.667 333 HA ARG 45 HA ARG 45 7.679 8.384 1.516 334 HB2 ARG 45 1HB ARG 45 7.444 8.736 -0.933 335 HB3 ARG 45 2HB ARG 45 7.152 10.450 -0.638 336 HG2 ARG 45 1HG ARG 45 9.365 10.647 0.439 337 HG3 ARG 45 2HG ARG 45 9.658 8.932 0.151 338 HD2 ARG 45 1HD ARG 45 9.350 9.361 -2.303 339 HD3 ARG 45 2HD ARG 45 9.248 11.082 -1.942 340 HE ARG 45 HE ARG 45 11.631 9.864 -0.877 341 HH11 ARG 45 1HH2 ARG 45 10.093 11.211 -3.666 342 HH12 ARG 45 2HH2 ARG 45 11.575 11.672 -4.434 343 HH21 ARG 45 1HH1 ARG 45 13.584 10.464 -1.878 344 HH22 ARG 45 2HH1 ARG 45 13.552 11.249 -3.422 345 H TYR 46 H TYR 46 8.675 9.379 3.114 346 HA TYR 46 HA TYR 46 7.750 12.049 3.980 347 HB2 TYR 46 1HB TYR 46 7.618 10.221 5.616 348 HB3 TYR 46 2HB TYR 46 9.338 9.908 5.417 349 HD1 TYR 46 HD2 TYR 46 7.063 12.827 6.085 350 HD2 TYR 46 HD1 TYR 46 10.761 10.842 7.012 351 HE1 TYR 46 HE2 TYR 46 7.559 14.545 7.804 352 HE2 TYR 46 HE1 TYR 46 11.250 12.549 8.731 353 HH TYR 46 HH TYR 46 9.660 14.196 10.197 354 H ARG 47 H ARG 47 8.997 13.751 3.513 355 HA ARG 47 HA ARG 47 11.858 13.303 2.867 356 HB2 ARG 47 1HB ARG 47 10.460 14.184 1.019 357 HB3 ARG 47 2HB ARG 47 10.062 15.583 2.017 358 HG2 ARG 47 1HG ARG 47 12.378 16.271 2.098 359 HG3 ARG 47 2HG ARG 47 12.898 14.784 1.306 360 HD2 ARG 47 1HD ARG 47 11.045 16.819 0.039 361 HD3 ARG 47 2HD ARG 47 12.786 16.770 -0.230 362 HE ARG 47 HE ARG 47 11.836 14.217 -0.791 363 HH11 ARG 47 1HH2 ARG 47 11.367 17.464 -1.896 364 HH12 ARG 47 2HH2 ARG 47 11.000 17.003 -3.525 365 HH21 ARG 47 1HH1 ARG 47 11.357 13.606 -2.925 366 HH22 ARG 47 2HH1 ARG 47 10.994 14.819 -4.108 367 H LEU 48 H LEU 48 13.390 14.915 3.495 368 HA LEU 48 HA LEU 48 12.594 16.652 5.744 369 HB2 LEU 48 1HB LEU 48 14.934 14.729 5.709 370 HB3 LEU 48 2HB LEU 48 14.715 16.003 6.907 371 HG LEU 48 HG LEU 48 12.742 13.757 6.376 372 HD11 LEU 48 1HD1 LEU 48 13.558 12.697 8.333 373 HD12 LEU 48 2HD1 LEU 48 14.448 14.132 8.842 374 HD13 LEU 48 3HD1 LEU 48 15.013 13.184 7.467 375 HD21 LEU 48 3HD2 LEU 48 12.030 14.722 8.791 376 HD22 LEU 48 1HD2 LEU 48 11.391 15.407 7.301 377 HD23 LEU 48 2HD2 LEU 48 12.729 16.197 8.134 378 H GLU 49 H GLU 49 14.602 18.042 6.350 379 HA GLU 49 HA GLU 49 15.428 19.402 3.893 380 HB2 GLU 49 1HB GLU 49 15.664 20.109 6.826 381 HB3 GLU 49 2HB GLU 49 16.267 21.126 5.514 382 HG2 GLU 49 1HG GLU 49 14.025 21.305 4.571 383 HG3 GLU 49 2HG GLU 49 13.395 20.193 5.786 384 H ASN 50 H ASN 50 16.954 18.172 6.862 385 HA ASN 50 HA ASN 50 19.615 18.574 6.285 386 HB2 ASN 50 1HB ASN 50 18.340 16.186 7.640 387 HB3 ASN 50 2HB ASN 50 20.067 16.537 7.663 388 HD21 ASN 50 2HD2 ASN 50 17.980 16.562 9.908 389 HD22 ASN 50 1HD2 ASN 50 18.148 18.097 10.612 390 H ASP 51 H ASP 51 17.415 16.630 4.597 391 HA ASP 51 HA ASP 51 17.738 15.593 2.536 392 HB2 ASP 51 1HB ASP 51 20.130 16.745 2.635 393 HB3 ASP 51 2HB ASP 51 20.665 15.122 3.051 394 H ALA 52 H ALA 52 16.492 14.196 4.026 395 HA ALA 52 HA ALA 52 17.598 11.538 4.016 396 HB1 ALA 52 3HB ALA 52 18.567 12.062 6.098 397 HB2 ALA 52 1HB ALA 52 17.052 11.274 6.536 398 HB3 ALA 52 2HB ALA 52 17.185 13.033 6.600 399 H GLN 53 H GLN 53 15.914 10.720 2.930 400 HA GLN 53 HA GLN 53 13.168 11.209 3.932 401 HB2 GLN 53 1HB GLN 53 12.554 10.304 1.600 402 HB3 GLN 53 2HB GLN 53 13.269 11.912 1.672 403 HG2 GLN 53 1HG GLN 53 14.988 9.461 1.303 404 HG3 GLN 53 2HG GLN 53 14.225 10.257 -0.072 405 HE21 GLN 53 2HE2 GLN 53 14.452 12.978 0.809 406 HE22 GLN 53 1HE2 GLN 53 16.098 13.387 0.843 407 H GLU 54 H GLU 54 11.665 9.319 3.596 408 HA GLU 54 HA GLU 54 12.938 6.690 3.652 409 HB2 GLU 54 1HB GLU 54 11.173 7.656 5.921 410 HB3 GLU 54 2HB GLU 54 11.784 6.016 5.706 411 HG2 GLU 54 1HG GLU 54 13.501 8.484 6.105 412 HG3 GLU 54 2HG GLU 54 13.157 7.266 7.323 413 H HIS 55 H HIS 55 11.512 4.994 3.166 414 HA HIS 55 HA HIS 55 8.834 5.838 2.180 415 HB2 HIS 55 1HB HIS 55 10.754 3.854 0.941 416 HB3 HIS 55 2HB HIS 55 9.115 4.183 0.378 417 HD2 HIS 55 HD2 HIS 55 8.904 6.406 -1.290 418 HE1 HIS 55 HE1 HIS 55 12.828 7.867 -0.751 419 HE2 HIS 55 HE2 HIS 55 10.678 8.155 -2.071 420 H ALA 56 H ALA 56 7.154 4.340 2.335 421 HA ALA 56 HA ALA 56 7.549 1.718 3.435 422 HB1 ALA 56 3HB ALA 56 5.891 2.425 5.400 423 HB2 ALA 56 1HB ALA 56 6.657 3.995 5.160 424 HB3 ALA 56 2HB ALA 56 7.636 2.594 5.580 425 H LEU 57 H LEU 57 5.606 0.493 3.398 426 HA LEU 57 HA LEU 57 3.584 1.569 1.542 427 HB2 LEU 57 1HB LEU 57 4.628 -0.565 0.905 428 HB3 LEU 57 2HB LEU 57 4.113 -1.282 2.430 429 HG LEU 57 HG LEU 57 1.756 -0.952 1.816 430 HD11 LEU 57 1HD1 LEU 57 1.420 -0.309 -0.714 431 HD12 LEU 57 2HD1 LEU 57 2.989 0.477 -0.533 432 HD13 LEU 57 3HD1 LEU 57 1.632 0.967 0.480 433 HD21 LEU 57 3HD2 LEU 57 1.733 -2.493 -0.186 434 HD22 LEU 57 1HD2 LEU 57 2.744 -3.046 1.149 435 HD23 LEU 57 2HD2 LEU 57 3.485 -2.305 -0.270 436 H PHE 58 H PHE 58 2.127 2.675 2.719 437 HA PHE 58 HA PHE 58 1.265 1.850 5.322 438 HB2 PHE 58 1HB PHE 58 0.342 3.993 3.406 439 HB3 PHE 58 2HB PHE 58 -0.409 3.726 4.977 440 HD1 PHE 58 HD1 PHE 58 3.062 4.032 3.533 441 HD2 PHE 58 HD2 PHE 58 0.389 5.021 6.741 442 HE1 PHE 58 HE1 PHE 58 4.849 5.345 4.622 443 HE2 PHE 58 HE2 PHE 58 2.180 6.329 7.835 444 HZ PHE 58 HZ PHE 58 4.415 6.492 6.777 445 H LEU 59 H LEU 59 -0.692 1.037 5.965 446 HA LEU 59 HA LEU 59 -2.469 -0.045 3.850 447 HB2 LEU 59 1HB LEU 59 -1.546 -1.289 6.436 448 HB3 LEU 59 2HB LEU 59 -3.044 -1.798 5.667 449 HG LEU 59 HG LEU 59 -0.419 -1.716 4.153 450 HD11 LEU 59 1HD1 LEU 59 -0.031 -3.190 6.021 451 HD12 LEU 59 2HD1 LEU 59 -0.335 -4.195 4.605 452 HD13 LEU 59 3HD1 LEU 59 -1.605 -3.957 5.807 453 HD21 LEU 59 3HD2 LEU 59 -3.143 -2.960 3.704 454 HD22 LEU 59 1HD2 LEU 59 -1.716 -3.612 2.905 455 HD23 LEU 59 2HD2 LEU 59 -2.203 -1.949 2.609 456 H TYR 60 H TYR 60 -4.479 0.579 3.934 457 HA TYR 60 HA TYR 60 -5.512 1.934 6.376 458 HB2 TYR 60 1HB TYR 60 -5.888 2.535 3.439 459 HB3 TYR 60 2HB TYR 60 -6.907 3.216 4.691 460 HD1 TYR 60 HD2 TYR 60 -3.482 3.122 3.284 461 HD2 TYR 60 HD1 TYR 60 -6.089 4.933 6.184 462 HE1 TYR 60 HE2 TYR 60 -1.834 4.937 3.645 463 HE2 TYR 60 HE1 TYR 60 -4.431 6.741 6.543 464 HH TYR 60 HH TYR 60 -1.563 6.725 6.070 465 H THR 61 H THR 61 -7.424 1.148 7.163 466 HA THR 61 HA THR 61 -8.656 -1.100 5.745 467 HB THR 61 HB THR 61 -9.912 -1.510 7.700 468 HG1 THR 61 HG1 THR 61 -9.672 1.164 8.000 469 HG21 THR 61 3HG2 THR 61 -8.248 -1.999 9.223 470 HG22 THR 61 1HG2 THR 61 -7.527 -0.398 9.091 471 HG23 THR 61 2HG2 THR 61 -7.239 -1.603 7.834 472 H HIS 62 H HIS 62 -11.011 -1.116 5.454 473 HA HIS 62 HA HIS 62 -12.492 1.299 5.528 474 HB2 HIS 62 1HB HIS 62 -12.647 1.905 3.265 475 HB3 HIS 62 2HB HIS 62 -10.922 1.691 3.552 476 HD2 HIS 62 HD2 HIS 62 -9.866 -0.790 2.417 477 HE1 HIS 62 HE1 HIS 62 -13.221 -1.426 -0.064 478 HE2 HIS 62 HE2 HIS 62 -10.835 -2.167 0.419 479 H ARG 63 H ARG 63 -14.630 1.062 4.583 480 HA ARG 63 HA ARG 63 -15.567 -1.655 4.969 481 HB2 ARG 63 1HB ARG 63 -16.628 0.793 5.632 482 HB3 ARG 63 2HB ARG 63 -17.540 0.412 4.170 483 HG2 ARG 63 1HG ARG 63 -18.043 -1.831 5.130 484 HG3 ARG 63 2HG ARG 63 -17.241 -1.333 6.615 485 HD2 ARG 63 1HD ARG 63 -19.627 -1.002 6.891 486 HD3 ARG 63 2HD ARG 63 -18.853 0.576 6.782 487 HE ARG 63 HE ARG 63 -19.664 -0.250 4.198 488 HH11 ARG 63 1HH2 ARG 63 -20.910 0.757 7.262 489 HH12 ARG 63 2HH2 ARG 63 -22.346 1.468 6.603 490 HH21 ARG 63 1HH1 ARG 63 -21.545 0.676 3.322 491 HH22 ARG 63 2HH1 ARG 63 -22.706 1.421 4.369 492 H ARG 64 H ARG 64 -17.863 -1.468 3.322 493 HA ARG 64 HA ARG 64 -16.896 -2.648 0.960 494 HB2 ARG 64 1HB ARG 64 -19.589 -1.466 1.662 495 HB3 ARG 64 2HB ARG 64 -19.272 -2.353 0.170 496 HG2 ARG 64 1HG ARG 64 -18.593 -4.327 1.458 497 HG3 ARG 64 2HG ARG 64 -18.837 -3.443 2.967 498 HD2 ARG 64 1HD ARG 64 -21.016 -3.909 0.916 499 HD3 ARG 64 2HD ARG 64 -20.769 -4.927 2.333 500 HE ARG 64 HE ARG 64 -20.942 -2.306 3.261 501 HH11 ARG 64 1HH2 ARG 64 -22.877 -4.585 1.519 502 HH12 ARG 64 2HH2 ARG 64 -24.383 -3.962 2.104 503 HH21 ARG 64 1HH1 ARG 64 -22.914 -1.483 4.032 504 HH22 ARG 64 2HH1 ARG 64 -24.403 -2.206 3.528 505 H MET 65 H MET 65 -18.053 0.663 1.651 506 HA MET 65 HA MET 65 -16.612 1.618 -0.717 507 HB2 MET 65 1HB MET 65 -18.762 3.035 -1.206 508 HB3 MET 65 2HB MET 65 -18.691 1.365 -1.769 509 HG2 MET 65 1HG MET 65 -19.957 0.602 0.165 510 HG3 MET 65 2HG MET 65 -19.934 2.225 0.857 511 HE1 MET 65 3HE MET 65 -22.234 2.040 1.265 512 HE2 MET 65 1HE MET 65 -22.845 0.664 0.335 513 HE3 MET 65 2HE MET 65 -23.554 2.262 0.120 514 H ALA 66 H ALA 66 -16.509 1.818 2.294 515 HA ALA 66 HA ALA 66 -17.101 4.650 2.766 516 HB1 ALA 66 3HB ALA 66 -16.812 4.223 5.023 517 HB2 ALA 66 1HB ALA 66 -15.715 2.869 4.750 518 HB3 ALA 66 2HB ALA 66 -17.443 2.692 4.439 519 H ILE 67 H ILE 67 -15.006 3.688 0.897 520 HA ILE 67 HA ILE 67 -12.416 4.239 1.938 521 HB ILE 67 HB ILE 67 -11.822 4.381 -0.491 522 HG12 ILE 67 1HG1 ILE 67 -14.809 3.961 -0.875 523 HG13 ILE 67 2HG1 ILE 67 -13.961 5.469 -1.210 524 HG21 ILE 67 1HG2 ILE 67 -13.719 2.092 0.079 525 HG22 ILE 67 2HG2 ILE 67 -12.111 2.203 0.794 526 HG23 ILE 67 3HG2 ILE 67 -12.291 2.072 -0.955 527 HD11 ILE 67 3HD1 ILE 67 -12.489 4.205 -2.809 528 HD12 ILE 67 1HD1 ILE 67 -14.184 4.275 -3.292 529 HD13 ILE 67 2HD1 ILE 67 -13.533 2.803 -2.573 530 H THR 68 H THR 68 -14.930 6.165 0.580 531 HA THR 68 HA THR 68 -13.888 8.414 -0.411 532 HB THR 68 HB THR 68 -16.189 8.517 -0.307 533 HG1 THR 68 HG1 THR 68 -15.740 10.538 0.243 534 HG21 THR 68 3HG2 THR 68 -15.873 7.733 2.588 535 HG22 THR 68 1HG2 THR 68 -16.615 6.798 1.291 536 HG23 THR 68 2HG2 THR 68 -17.415 8.246 1.906 537 H GLY 69 H GLY 69 -13.555 7.599 3.022 538 HA2 GLY 69 1HA GLY 69 -11.477 8.702 3.981 539 HA3 GLY 69 2HA GLY 69 -12.224 10.215 3.482 540 H ASP 70 H ASP 70 -14.845 8.639 4.078 541 HA ASP 70 HA ASP 70 -15.475 9.897 6.493 542 HB2 ASP 70 1HB ASP 70 -17.536 8.519 6.407 543 HB3 ASP 70 2HB ASP 70 -17.149 9.236 4.844 544 H ASP 71 H ASP 71 -14.934 6.358 5.976 545 HA ASP 71 HA ASP 71 -14.325 6.178 8.884 546 HB2 ASP 71 1HB ASP 71 -16.069 4.491 7.138 547 HB3 ASP 71 2HB ASP 71 -15.328 3.753 8.569 548 H VAL 72 H VAL 72 -12.316 6.465 6.797 549 HA VAL 72 HA VAL 72 -10.925 3.871 7.145 550 HB VAL 72 HB VAL 72 -11.553 3.804 4.883 551 HG11 VAL 72 1HG1 VAL 72 -10.724 6.707 4.739 552 HG12 VAL 72 2HG1 VAL 72 -12.366 6.070 4.635 553 HG13 VAL 72 3HG1 VAL 72 -11.207 5.742 3.345 554 HG21 VAL 72 3HG2 VAL 72 -8.906 5.114 4.376 555 HG22 VAL 72 1HG2 VAL 72 -9.489 3.522 3.891 556 HG23 VAL 72 2HG2 VAL 72 -8.915 3.789 5.531 557 H SER 73 H SER 73 -9.166 4.058 8.280 558 HA SER 73 HA SER 73 -7.378 6.342 7.862 559 HB2 SER 73 1HB SER 73 -8.452 5.468 10.557 560 HB3 SER 73 2HB SER 73 -7.167 6.647 10.306 561 HG SER 73 HG SER 73 -9.786 7.044 10.283 562 H LEU 74 H LEU 74 -5.271 5.931 8.927 563 HA LEU 74 HA LEU 74 -4.008 3.789 7.983 564 HB2 LEU 74 1HB LEU 74 -3.451 5.737 10.066 565 HB3 LEU 74 2HB LEU 74 -2.694 4.200 10.472 566 HG LEU 74 HG LEU 74 -2.394 5.631 7.817 567 HD11 LEU 74 1HD1 LEU 74 -0.293 5.273 9.967 568 HD12 LEU 74 2HD1 LEU 74 -1.328 6.698 9.898 569 HD13 LEU 74 3HD1 LEU 74 -0.242 6.335 8.561 570 HD21 LEU 74 3HD2 LEU 74 -0.373 3.631 8.401 571 HD22 LEU 74 1HD2 LEU 74 -1.495 3.696 7.051 572 HD23 LEU 74 2HD2 LEU 74 -1.955 2.892 8.545 573 H ASP 75 H ASP 75 -3.466 1.747 8.456 574 HA ASP 75 HA ASP 75 -4.926 0.396 10.648 575 HB2 ASP 75 1HB ASP 75 -5.430 -0.164 8.186 576 HB3 ASP 75 2HB ASP 75 -3.835 -0.903 8.151 577 H GLN 76 H GLN 76 -2.040 -0.265 8.595 578 HA GLN 76 HA GLN 76 -0.324 -0.374 10.926 579 HB2 GLN 76 1HB GLN 76 -1.437 -2.667 10.760 580 HB3 GLN 76 2HB GLN 76 -0.559 -2.870 9.242 581 HG2 GLN 76 1HG GLN 76 1.548 -2.190 10.627 582 HG3 GLN 76 2HG GLN 76 0.552 -2.562 12.032 583 HE21 GLN 76 2HE2 GLN 76 2.777 -3.930 9.965 584 HE22 GLN 76 1HE2 GLN 76 2.335 -5.555 10.134 585 H ILE 77 H ILE 77 1.515 0.523 10.334 586 HA ILE 77 HA ILE 77 2.198 0.854 7.534 587 HB ILE 77 HB ILE 77 3.632 1.743 10.053 588 HG12 ILE 77 1HG1 ILE 77 1.914 3.340 8.142 589 HG13 ILE 77 2HG1 ILE 77 1.303 2.648 9.646 590 HG21 ILE 77 1HG2 ILE 77 4.075 2.242 7.106 591 HG22 ILE 77 2HG2 ILE 77 5.253 1.794 8.338 592 HG23 ILE 77 3HG2 ILE 77 4.592 3.427 8.305 593 HD11 ILE 77 3HD1 ILE 77 3.679 4.520 9.502 594 HD12 ILE 77 1HD1 ILE 77 2.860 3.952 10.957 595 HD13 ILE 77 2HD1 ILE 77 2.035 5.052 9.852 596 H VAL 78 H VAL 78 3.681 -0.295 6.422 597 HA VAL 78 HA VAL 78 5.427 -2.169 7.926 598 HB VAL 78 HB VAL 78 3.964 -2.576 5.313 599 HG11 VAL 78 1HG1 VAL 78 5.182 -4.858 5.412 600 HG12 VAL 78 2HG1 VAL 78 6.313 -4.062 6.508 601 HG13 VAL 78 3HG1 VAL 78 6.122 -3.473 4.856 602 HG21 VAL 78 3HG2 VAL 78 2.892 -4.366 6.463 603 HG22 VAL 78 1HG2 VAL 78 2.899 -3.035 7.616 604 HG23 VAL 78 2HG2 VAL 78 4.077 -4.340 7.768 605 HA PRO 79 HA PRO 79 8.399 0.367 5.633 606 HB2 PRO 79 1HB PRO 79 10.690 -0.489 6.821 607 HB3 PRO 79 2HB PRO 79 9.558 0.607 7.635 608 HG2 PRO 79 1HG PRO 79 9.915 -2.336 7.975 609 HG3 PRO 79 2HG PRO 79 9.611 -1.091 9.199 610 HD2 PRO 79 1HD PRO 79 7.648 -2.756 8.167 611 HD3 PRO 79 2HD PRO 79 7.318 -1.158 8.875 612 H LEU 80 H LEU 80 8.843 -0.185 3.550 613 HA LEU 80 HA LEU 80 8.955 -2.570 2.328 614 HB2 LEU 80 1HB LEU 80 10.812 -0.231 1.837 615 HB3 LEU 80 2HB LEU 80 10.494 -1.523 0.685 616 HG LEU 80 HG LEU 80 8.292 0.196 1.847 617 HD11 LEU 80 1HD1 LEU 80 8.420 1.469 -0.308 618 HD12 LEU 80 2HD1 LEU 80 9.921 0.618 -0.678 619 HD13 LEU 80 3HD1 LEU 80 9.837 1.695 0.717 620 HD21 LEU 80 3HD2 LEU 80 7.248 -0.517 -0.417 621 HD22 LEU 80 1HD2 LEU 80 7.359 -1.743 0.844 622 HD23 LEU 80 2HD2 LEU 80 8.525 -1.729 -0.477 623 H SER 81 H SER 81 12.004 -0.944 3.120 624 HA SER 81 HA SER 81 14.018 -1.733 3.871 625 HB2 SER 81 1HB SER 81 14.024 -3.411 5.457 626 HB3 SER 81 2HB SER 81 12.300 -3.047 5.446 627 HG SER 81 HG SER 81 12.714 -5.285 5.208 628 H LYS 82 H LYS 82 15.749 -3.050 3.109 629 HA LYS 82 HA LYS 82 15.728 -3.637 0.424 630 HB2 LYS 82 1HB LYS 82 17.806 -4.809 0.798 631 HB3 LYS 82 2HB LYS 82 17.738 -3.417 1.875 632 HG2 LYS 82 1HG LYS 82 16.892 -4.921 3.688 633 HG3 LYS 82 2HG LYS 82 17.149 -6.296 2.613 634 HD2 LYS 82 1HD LYS 82 19.533 -5.720 2.429 635 HD3 LYS 82 2HD LYS 82 19.284 -4.346 3.507 636 HE2 LYS 82 1HE LYS 82 18.522 -5.886 5.284 637 HE3 LYS 82 2HE LYS 82 18.809 -7.255 4.211 638 HZ1 LYS 82 3HZ LYS 82 20.632 -6.552 5.867 639 HZ2 LYS 82 1HZ LYS 82 20.962 -5.323 4.747 640 HZ3 LYS 82 2HZ LYS 82 21.075 -6.950 4.277 641 H ASP 83 H ASP 83 14.846 -5.743 3.131 642 HA ASP 83 HA ASP 83 14.764 -8.170 1.695 643 HB2 ASP 83 1HB ASP 83 13.271 -7.217 4.139 644 HB3 ASP 83 2HB ASP 83 13.128 -8.857 3.507 645 H PHE 84 H PHE 84 12.952 -5.427 1.197 646 HA PHE 84 HA PHE 84 10.363 -6.445 0.669 647 HB2 PHE 84 1HB PHE 84 10.974 -4.021 0.877 648 HB3 PHE 84 2HB PHE 84 11.742 -4.122 -0.698 649 HD1 PHE 84 HD1 PHE 84 8.513 -4.521 1.106 650 HD2 PHE 84 HD2 PHE 84 10.439 -3.987 -2.694 651 HE1 PHE 84 HE1 PHE 84 6.317 -4.036 0.069 652 HE2 PHE 84 HE2 PHE 84 8.238 -3.519 -3.740 653 HZ PHE 84 HZ PHE 84 6.178 -3.540 -2.359 654 H MET 85 H MET 85 9.531 -7.474 -1.060 655 HA MET 85 HA MET 85 10.889 -7.515 -3.616 656 HB2 MET 85 1HB MET 85 12.139 -9.269 -2.371 657 HB3 MET 85 2HB MET 85 10.617 -10.117 -2.087 658 HG2 MET 85 1HG MET 85 10.270 -10.380 -4.493 659 HG3 MET 85 2HG MET 85 11.721 -9.439 -4.833 660 HE1 MET 85 3HE MET 85 13.004 -12.770 -5.990 661 HE2 MET 85 1HE MET 85 12.235 -11.226 -6.381 662 HE3 MET 85 2HE MET 85 11.249 -12.621 -5.953 663 H LEU 86 H LEU 86 9.384 -7.544 -5.138 664 HA LEU 86 HA LEU 86 6.635 -8.328 -4.422 665 HB2 LEU 86 1HB LEU 86 6.290 -7.292 -6.836 666 HB3 LEU 86 2HB LEU 86 6.515 -6.241 -5.442 667 HG LEU 86 HG LEU 86 8.987 -7.157 -6.891 668 HD11 LEU 86 1HD1 LEU 86 8.735 -5.187 -8.447 669 HD12 LEU 86 2HD1 LEU 86 7.053 -5.073 -7.933 670 HD13 LEU 86 3HD1 LEU 86 7.622 -6.517 -8.770 671 HD21 LEU 86 3HD2 LEU 86 8.320 -4.371 -5.925 672 HD22 LEU 86 1HD2 LEU 86 9.900 -5.141 -6.079 673 HD23 LEU 86 2HD2 LEU 86 8.807 -5.617 -4.781 674 H GLU 87 H GLU 87 5.925 -10.307 -4.998 675 HA GLU 87 HA GLU 87 7.263 -11.689 -7.261 676 HB2 GLU 87 1HB GLU 87 5.980 -12.786 -4.755 677 HB3 GLU 87 2HB GLU 87 6.501 -13.780 -6.113 678 HG2 GLU 87 1HG GLU 87 8.798 -12.969 -5.861 679 HG3 GLU 87 2HG GLU 87 8.296 -11.909 -4.545 680 H GLU 88 H GLU 88 6.060 -11.849 -8.993 681 HA GLU 88 HA GLU 88 3.248 -11.325 -9.037 682 HB2 GLU 88 1HB GLU 88 3.387 -12.038 -11.406 683 HB3 GLU 88 2HB GLU 88 4.650 -10.877 -10.998 684 HG2 GLU 88 1HG GLU 88 6.247 -12.735 -10.672 685 HG3 GLU 88 2HG GLU 88 4.988 -13.889 -11.105 686 H VAL 89 H VAL 89 1.535 -12.838 -9.488 687 HA VAL 89 HA VAL 89 2.142 -15.571 -8.500 688 HB VAL 89 HB VAL 89 -0.585 -14.346 -8.785 689 HG11 VAL 89 1HG1 VAL 89 -0.216 -16.851 -8.493 690 HG12 VAL 89 2HG1 VAL 89 -1.271 -16.078 -7.310 691 HG13 VAL 89 3HG1 VAL 89 0.394 -16.469 -6.882 692 HG21 VAL 89 3HG2 VAL 89 -0.409 -13.806 -6.348 693 HG22 VAL 89 1HG2 VAL 89 0.708 -12.859 -7.333 694 HG23 VAL 89 2HG2 VAL 89 1.299 -14.242 -6.411 695 H SER 90 H SER 90 1.897 -17.252 -9.773 696 HA SER 90 HA SER 90 1.861 -17.239 -12.494 697 HB2 SER 90 1HB SER 90 1.508 -19.547 -12.411 698 HB3 SER 90 2HB SER 90 2.186 -19.184 -10.828 699 HG SER 90 HG SER 90 0.346 -20.459 -10.597 700 HA PRO 91 HA PRO 91 -2.393 -15.557 -13.036 701 HB2 PRO 91 1HB PRO 91 -1.629 -16.004 -15.901 702 HB3 PRO 91 2HB PRO 91 -2.366 -14.579 -15.140 703 HG2 PRO 91 1HG PRO 91 0.199 -14.581 -15.821 704 HG3 PRO 91 2HG PRO 91 -0.346 -13.809 -14.319 705 HD2 PRO 91 1HD PRO 91 1.073 -16.428 -14.684 706 HD3 PRO 91 2HD PRO 91 1.229 -15.228 -13.382 707 H ASP 92 H ASP 92 -1.088 -18.247 -14.978 708 HA ASP 92 HA ASP 92 -2.006 -20.244 -15.643 709 HB2 ASP 92 1HB ASP 92 -3.600 -19.748 -13.122 710 HB3 ASP 92 2HB ASP 92 -3.773 -21.210 -14.087 711 H GLY 93 H GLY 93 -2.970 -17.796 -16.785 712 HA2 GLY 93 1HA GLY 93 -5.370 -18.794 -18.040 713 HA3 GLY 93 2HA GLY 93 -5.646 -17.367 -17.045 714 H GLU 94 H GLU 94 -6.228 -17.023 -19.617 715 HA GLU 94 HA GLU 94 -4.105 -15.220 -20.560 716 HB2 GLU 94 1HB GLU 94 -4.245 -16.056 -22.847 717 HB3 GLU 94 2HB GLU 94 -3.760 -17.357 -21.761 718 HG2 GLU 94 1HG GLU 94 -6.177 -18.063 -21.654 719 HG3 GLU 94 2HG GLU 94 -6.521 -16.874 -22.908 720 H LEU 95 H LEU 95 -7.438 -16.395 -20.954 721 HA LEU 95 HA LEU 95 -8.270 -13.940 -22.279 722 HB2 LEU 95 1HB LEU 95 -9.248 -16.207 -22.802 723 HB3 LEU 95 2HB LEU 95 -9.992 -16.184 -21.205 724 HG LEU 95 HG LEU 95 -10.809 -13.738 -22.107 725 HD11 LEU 95 1HD1 LEU 95 -9.691 -14.125 -24.310 726 HD12 LEU 95 2HD1 LEU 95 -11.427 -13.845 -24.442 727 HD13 LEU 95 3HD1 LEU 95 -10.785 -15.482 -24.583 728 HD21 LEU 95 3HD2 LEU 95 -12.395 -15.282 -21.230 729 HD22 LEU 95 1HD2 LEU 95 -12.067 -16.462 -22.500 730 HD23 LEU 95 2HD2 LEU 95 -12.931 -14.973 -22.883 731 H TYR 96 H TYR 96 -7.171 -13.238 -19.976 732 HA TYR 96 HA TYR 96 -9.221 -11.801 -18.648 733 HB2 TYR 96 1HB TYR 96 -9.449 -14.210 -17.719 734 HB3 TYR 96 2HB TYR 96 -7.943 -13.877 -16.870 735 HD1 TYR 96 HD2 TYR 96 -11.447 -12.746 -17.326 736 HD2 TYR 96 HD1 TYR 96 -7.882 -12.455 -14.961 737 HE1 TYR 96 HE2 TYR 96 -12.711 -11.519 -15.581 738 HE2 TYR 96 HE1 TYR 96 -9.130 -11.214 -13.221 739 HH TYR 96 HH TYR 96 -11.413 -10.937 -12.449 740 H ILE 97 H ILE 97 -6.507 -11.572 -19.840 741 HA ILE 97 HA ILE 97 -4.367 -11.173 -18.233 742 HB ILE 97 HB ILE 97 -3.924 -9.062 -19.625 743 HG12 ILE 97 1HG1 ILE 97 -6.235 -9.972 -21.330 744 HG13 ILE 97 2HG1 ILE 97 -6.577 -8.910 -19.966 745 HG21 ILE 97 1HG2 ILE 97 -3.099 -11.329 -20.205 746 HG22 ILE 97 2HG2 ILE 97 -3.490 -10.377 -21.636 747 HG23 ILE 97 3HG2 ILE 97 -4.599 -11.631 -21.084 748 HD11 ILE 97 3HD1 ILE 97 -6.166 -7.611 -22.014 749 HD12 ILE 97 1HD1 ILE 97 -4.568 -8.346 -22.159 750 HD13 ILE 97 2HD1 ILE 97 -4.933 -7.291 -20.793 751 H LEU 98 H LEU 98 -5.242 -10.763 -16.111 752 HA LEU 98 HA LEU 98 -5.568 -9.432 -14.283 753 HB2 LEU 98 1HB LEU 98 -4.984 -7.053 -16.049 754 HB3 LEU 98 2HB LEU 98 -4.773 -7.189 -14.309 755 HG LEU 98 HG LEU 98 -3.243 -9.026 -16.149 756 HD11 LEU 98 1HD1 LEU 98 -1.358 -7.298 -15.917 757 HD12 LEU 98 2HD1 LEU 98 -2.625 -6.148 -15.497 758 HD13 LEU 98 3HD1 LEU 98 -2.636 -6.932 -17.074 759 HD21 LEU 98 3HD2 LEU 98 -1.801 -9.295 -14.306 760 HD22 LEU 98 1HD2 LEU 98 -3.392 -9.210 -13.555 761 HD23 LEU 98 2HD2 LEU 98 -2.339 -7.799 -13.549 762 H GLY 99 H GLY 99 -6.865 -7.954 -17.242 763 HA2 GLY 99 1HA GLY 99 -8.966 -7.167 -17.765 764 HA3 GLY 99 2HA GLY 99 -9.567 -8.199 -16.470 765 H SER 100 H SER 100 -10.491 -7.204 -14.846 766 HA SER 100 HA SER 100 -9.950 -4.348 -14.332 767 HB2 SER 100 1HB SER 100 -12.167 -4.379 -13.196 768 HB3 SER 100 2HB SER 100 -12.260 -4.750 -14.916 769 HG SER 100 HG SER 100 -12.346 -6.533 -12.714 770 H ASP 101 H ASP 101 -8.234 -6.411 -13.477 771 HA ASP 101 HA ASP 101 -7.945 -5.788 -10.722 772 HB2 ASP 101 1HB ASP 101 -9.127 -8.469 -11.427 773 HB3 ASP 101 2HB ASP 101 -8.115 -8.288 -9.999 774 H VAL 102 H VAL 102 -5.827 -5.951 -10.246 775 HA VAL 102 HA VAL 102 -4.077 -7.551 -12.028 776 HB VAL 102 HB VAL 102 -3.606 -5.023 -10.438 777 HG11 VAL 102 1HG1 VAL 102 -1.636 -6.217 -9.913 778 HG12 VAL 102 2HG1 VAL 102 -1.183 -5.318 -11.361 779 HG13 VAL 102 3HG1 VAL 102 -1.599 -7.026 -11.478 780 HG21 VAL 102 3HG2 VAL 102 -3.324 -4.010 -12.504 781 HG22 VAL 102 1HG2 VAL 102 -4.433 -5.289 -12.988 782 HG23 VAL 102 2HG2 VAL 102 -2.706 -5.474 -13.266 783 H THR 103 H THR 103 -2.845 -9.101 -11.210 784 HA THR 103 HA THR 103 -3.149 -9.741 -8.338 785 HB THR 103 HB THR 103 -1.966 -11.503 -10.488 786 HG1 THR 103 HG1 THR 103 -3.928 -11.677 -11.174 787 HG21 THR 103 3HG2 THR 103 -1.441 -12.175 -8.209 788 HG22 THR 103 1HG2 THR 103 -2.660 -13.270 -8.860 789 HG23 THR 103 2HG2 THR 103 -3.131 -11.998 -7.734 790 H VAL 104 H VAL 104 -1.646 -9.093 -7.017 791 HA VAL 104 HA VAL 104 1.196 -9.383 -7.739 792 HB VAL 104 HB VAL 104 0.393 -6.991 -8.112 793 HG11 VAL 104 1HG1 VAL 104 -1.094 -7.059 -6.036 794 HG12 VAL 104 2HG1 VAL 104 -0.091 -5.622 -6.220 795 HG13 VAL 104 3HG1 VAL 104 0.384 -6.888 -5.088 796 HG21 VAL 104 3HG2 VAL 104 2.545 -7.564 -6.050 797 HG22 VAL 104 1HG2 VAL 104 2.370 -6.036 -6.912 798 HG23 VAL 104 2HG2 VAL 104 2.755 -7.509 -7.800 799 H GLN 105 H GLN 105 2.495 -9.980 -6.025 800 HA GLN 105 HA GLN 105 1.188 -10.301 -3.382 801 HB2 GLN 105 1HB GLN 105 1.494 -12.417 -4.873 802 HB3 GLN 105 2HB GLN 105 3.200 -12.271 -4.457 803 HG2 GLN 105 1HG GLN 105 0.967 -12.380 -2.409 804 HG3 GLN 105 2HG GLN 105 1.916 -13.777 -2.913 805 HE21 GLN 105 2HE2 GLN 105 1.789 -11.267 -0.652 806 HE22 GLN 105 1HE2 GLN 105 3.400 -11.326 -0.125 807 H LEU 106 H LEU 106 2.203 -9.210 -1.857 808 HA LEU 106 HA LEU 106 4.944 -8.284 -2.256 809 HB2 LEU 106 1HB LEU 106 4.515 -6.813 -0.418 810 HB3 LEU 106 2HB LEU 106 3.078 -6.823 -1.433 811 HG LEU 106 HG LEU 106 2.375 -8.839 0.204 812 HD11 LEU 106 1HD1 LEU 106 4.741 -8.033 1.478 813 HD12 LEU 106 2HD1 LEU 106 3.454 -8.990 2.185 814 HD13 LEU 106 3HD1 LEU 106 3.477 -7.246 2.418 815 HD21 LEU 106 3HD2 LEU 106 2.109 -5.862 0.620 816 HD22 LEU 106 1HD2 LEU 106 1.301 -7.014 1.681 817 HD23 LEU 106 2HD2 LEU 106 0.930 -6.993 -0.044 818 H ASN 107 H ASN 107 6.606 -9.265 -1.524 819 HA ASN 107 HA ASN 107 6.357 -11.241 0.696 820 HB2 ASN 107 1HB ASN 107 8.599 -11.083 -1.303 821 HB3 ASN 107 2HB ASN 107 8.226 -12.394 -0.185 822 HD21 ASN 107 2HD2 ASN 107 6.210 -10.503 -2.504 823 HD22 ASN 107 1HD2 ASN 107 5.560 -11.871 -3.267 824 H THR 108 H THR 108 6.462 -9.065 1.998 825 HA THR 108 HA THR 108 9.071 -7.911 2.298 826 HB THR 108 HB THR 108 7.063 -7.739 4.515 827 HG1 THR 108 HG1 THR 108 6.741 -6.272 2.135 828 HG21 THR 108 3HG2 THR 108 9.086 -6.408 4.684 829 HG22 THR 108 1HG2 THR 108 7.726 -5.330 4.383 830 HG23 THR 108 2HG2 THR 108 8.828 -5.742 3.073 831 H ALA 109 H ALA 109 10.081 -7.906 4.582 832 HA ALA 109 HA ALA 109 11.057 -10.473 5.121 833 HB1 ALA 109 3HB ALA 109 12.440 -8.694 5.760 834 HB2 ALA 109 1HB ALA 109 11.858 -9.322 7.302 835 HB3 ALA 109 2HB ALA 109 11.140 -7.867 6.613 836 H GLU 110 H GLU 110 8.486 -8.617 6.756 837 HA GLU 110 HA GLU 110 7.709 -11.102 8.193 838 HB2 GLU 110 1HB GLU 110 7.207 -9.832 10.164 839 HB3 GLU 110 2HB GLU 110 8.841 -9.389 9.677 840 HG2 GLU 110 1HG GLU 110 7.826 -7.420 8.438 841 HG3 GLU 110 2HG GLU 110 6.294 -7.809 9.220 842 H LEU 111 H LEU 111 6.814 -9.695 5.686 843 HA LEU 111 HA LEU 111 3.954 -9.638 6.376 844 HB2 LEU 111 1HB LEU 111 5.299 -7.291 5.939 845 HB3 LEU 111 2HB LEU 111 4.768 -7.668 4.310 846 HG LEU 111 HG LEU 111 3.043 -6.337 5.243 847 HD11 LEU 111 1HD1 LEU 111 2.416 -8.708 4.229 848 HD12 LEU 111 2HD1 LEU 111 1.188 -7.652 4.909 849 HD13 LEU 111 3HD1 LEU 111 1.810 -8.996 5.858 850 HD21 LEU 111 3HD2 LEU 111 3.898 -6.816 7.668 851 HD22 LEU 111 1HD2 LEU 111 2.724 -8.131 7.645 852 HD23 LEU 111 2HD2 LEU 111 2.192 -6.466 7.427 853 H LYS 112 H LYS 112 2.804 -10.842 5.127 854 HA LYS 112 HA LYS 112 3.560 -11.333 2.343 855 HB2 LYS 112 1HB LYS 112 4.677 -13.120 3.781 856 HB3 LYS 112 2HB LYS 112 3.052 -13.691 4.163 857 HG2 LYS 112 1HG LYS 112 2.575 -14.075 1.811 858 HG3 LYS 112 2HG LYS 112 4.114 -13.358 1.341 859 HD2 LYS 112 1HD LYS 112 5.305 -15.147 2.584 860 HD3 LYS 112 2HD LYS 112 3.751 -15.889 2.968 861 HE2 LYS 112 1HE LYS 112 4.715 -15.350 0.144 862 HE3 LYS 112 2HE LYS 112 4.880 -16.906 0.962 863 HZ1 LYS 112 3HZ LYS 112 2.891 -17.227 -0.047 864 HZ2 LYS 112 1HZ LYS 112 2.484 -15.580 -0.053 865 HZ3 LYS 112 2HZ LYS 112 2.322 -16.488 1.374 866 H LEU 113 H LEU 113 1.818 -10.677 1.401 867 HA LEU 113 HA LEU 113 -0.764 -11.944 2.044 868 HB2 LEU 113 1HB LEU 113 -0.211 -8.998 2.174 869 HB3 LEU 113 2HB LEU 113 -1.825 -9.587 1.811 870 HG LEU 113 HG LEU 113 -0.229 -10.411 4.253 871 HD11 LEU 113 1HD1 LEU 113 -1.314 -8.798 5.543 872 HD12 LEU 113 2HD1 LEU 113 -2.586 -8.553 4.355 873 HD13 LEU 113 3HD1 LEU 113 -0.972 -7.915 4.059 874 HD21 LEU 113 3HD2 LEU 113 -2.952 -11.083 3.192 875 HD22 LEU 113 1HD2 LEU 113 -2.793 -10.895 4.937 876 HD23 LEU 113 2HD2 LEU 113 -1.822 -12.091 4.088 877 H VAL 114 H VAL 114 -2.469 -11.291 0.427 878 HA VAL 114 HA VAL 114 -1.307 -10.917 -2.279 879 HB VAL 114 HB VAL 114 -3.469 -12.846 -1.376 880 HG11 VAL 114 1HG1 VAL 114 -2.680 -11.888 -4.134 881 HG12 VAL 114 2HG1 VAL 114 -4.291 -11.945 -3.417 882 HG13 VAL 114 3HG1 VAL 114 -3.476 -13.440 -3.876 883 HG21 VAL 114 3HG2 VAL 114 -1.987 -14.558 -2.056 884 HG22 VAL 114 1HG2 VAL 114 -0.927 -13.402 -1.246 885 HG23 VAL 114 2HG2 VAL 114 -0.999 -13.453 -3.009 886 H PHE 115 H PHE 115 -2.161 -9.212 -3.303 887 HA PHE 115 HA PHE 115 -4.847 -8.261 -2.592 888 HB2 PHE 115 1HB PHE 115 -2.372 -6.634 -3.160 889 HB3 PHE 115 2HB PHE 115 -3.997 -5.957 -3.080 890 HD1 PHE 115 HD2 PHE 115 -5.301 -6.087 -0.929 891 HD2 PHE 115 HD1 PHE 115 -1.154 -7.184 -1.179 892 HE1 PHE 115 HE2 PHE 115 -5.101 -5.948 1.541 893 HE2 PHE 115 HE1 PHE 115 -0.974 -7.016 1.287 894 HZ PHE 115 HZ PHE 115 -2.939 -6.413 2.644 895 H GLN 116 H GLN 116 -6.144 -7.576 -4.182 896 HA GLN 116 HA GLN 116 -5.272 -8.064 -6.966 897 HB2 GLN 116 1HB GLN 116 -7.963 -8.208 -5.620 898 HB3 GLN 116 2HB GLN 116 -7.825 -8.066 -7.367 899 HG2 GLN 116 1HG GLN 116 -6.256 -10.181 -5.891 900 HG3 GLN 116 2HG GLN 116 -7.944 -10.458 -6.315 901 HE21 GLN 116 2HE2 GLN 116 -4.726 -10.555 -7.541 902 HE22 GLN 116 1HE2 GLN 116 -5.123 -10.784 -9.177 903 H LEU 117 H LEU 117 -4.268 -5.965 -7.090 904 HA LEU 117 HA LEU 117 -5.725 -3.571 -6.595 905 HB2 LEU 117 1HB LEU 117 -3.374 -3.763 -8.465 906 HB3 LEU 117 2HB LEU 117 -3.820 -2.444 -7.387 907 HG LEU 117 HG LEU 117 -2.746 -5.157 -6.583 908 HD11 LEU 117 1HD1 LEU 117 -0.967 -3.698 -7.227 909 HD12 LEU 117 2HD1 LEU 117 -1.029 -3.625 -5.467 910 HD13 LEU 117 3HD1 LEU 117 -1.714 -2.317 -6.426 911 HD21 LEU 117 3HD2 LEU 117 -4.416 -4.614 -4.945 912 HD22 LEU 117 1HD2 LEU 117 -3.963 -2.912 -4.951 913 HD23 LEU 117 2HD2 LEU 117 -2.880 -4.110 -4.244 914 HA PRO 118 HA PRO 118 -8.038 -2.875 -10.283 915 HB2 PRO 118 1HB PRO 118 -6.498 -0.425 -11.039 916 HB3 PRO 118 2HB PRO 118 -8.235 -0.612 -10.713 917 HG2 PRO 118 1HG PRO 118 -6.672 0.578 -8.947 918 HG3 PRO 118 2HG PRO 118 -7.935 -0.547 -8.409 919 HD2 PRO 118 1HD PRO 118 -4.984 -1.044 -8.709 920 HD3 PRO 118 2HD PRO 118 -6.055 -1.483 -7.361 921 H PHE 119 H PHE 119 -7.367 -1.605 -12.720 922 HA PHE 119 HA PHE 119 -5.807 -3.730 -13.991 923 HB2 PHE 119 1HB PHE 119 -8.022 -3.290 -14.826 924 HB3 PHE 119 2HB PHE 119 -7.631 -1.605 -15.094 925 HD1 PHE 119 HD1 PHE 119 -6.122 -4.958 -15.902 926 HD2 PHE 119 HD2 PHE 119 -7.168 -1.029 -17.306 927 HE1 PHE 119 HE1 PHE 119 -5.246 -5.520 -18.153 928 HE2 PHE 119 HE2 PHE 119 -6.294 -1.597 -19.552 929 HZ PHE 119 HZ PHE 119 -5.334 -3.842 -19.977 930 H GLY 120 H GLY 120 -3.650 -3.300 -14.105 931 HA2 GLY 120 1HA GLY 120 -1.687 -2.022 -14.319 932 HA3 GLY 120 2HA GLY 120 -2.351 -1.917 -15.943 933 H SER 121 H SER 121 -1.669 0.119 -16.475 934 HA SER 121 HA SER 121 -1.359 2.426 -16.292 935 HB2 SER 121 1HB SER 121 -4.328 2.090 -15.807 936 HB3 SER 121 2HB SER 121 -3.543 3.566 -16.360 937 HG SER 121 HG SER 121 -4.008 1.151 -17.681 938 H HIS 122 H HIS 122 -4.072 2.393 -14.071 939 HA HIS 122 HA HIS 122 -2.934 4.181 -12.242 940 HB2 HIS 122 1HB HIS 122 -5.387 3.587 -12.494 941 HB3 HIS 122 2HB HIS 122 -5.041 2.115 -11.587 942 HD2 HIS 122 HD2 HIS 122 -5.259 2.495 -8.860 943 HE1 HIS 122 HE1 HIS 122 -4.763 6.688 -8.792 944 HE2 HIS 122 HE2 HIS 122 -5.232 4.637 -7.368 945 H THR 123 H THR 123 -2.777 0.663 -12.465 946 HA THR 123 HA THR 123 -1.483 0.426 -9.854 947 HB THR 123 HB THR 123 -2.096 -1.657 -11.964 948 HG1 THR 123 HG1 THR 123 -3.884 -2.001 -10.856 949 HG21 THR 123 3HG2 THR 123 -0.254 -2.445 -10.670 950 HG22 THR 123 1HG2 THR 123 -1.683 -3.201 -9.970 951 HG23 THR 123 2HG2 THR 123 -0.939 -1.815 -9.174 952 H ARG 124 H ARG 124 -0.656 0.304 -13.298 953 HA ARG 124 HA ARG 124 1.891 -0.830 -13.078 954 HB2 ARG 124 1HB ARG 124 0.754 -0.501 -15.228 955 HB3 ARG 124 2HB ARG 124 0.904 1.244 -15.051 956 HG2 ARG 124 1HG ARG 124 2.659 0.348 -16.532 957 HG3 ARG 124 2HG ARG 124 3.365 1.043 -15.080 958 HD2 ARG 124 1HD ARG 124 3.922 -1.044 -14.194 959 HD3 ARG 124 2HD ARG 124 2.687 -1.887 -15.128 960 HE ARG 124 HE ARG 124 4.405 -0.921 -17.026 961 HH11 ARG 124 1HH2 ARG 124 4.693 -2.786 -14.135 962 HH12 ARG 124 2HH2 ARG 124 6.058 -3.697 -14.688 963 HH21 ARG 124 1HH1 ARG 124 6.199 -2.106 -17.769 964 HH22 ARG 124 2HH1 ARG 124 6.913 -3.312 -16.750 965 H THR 125 H THR 125 0.895 2.565 -12.896 966 HA THR 125 HA THR 125 3.475 3.676 -12.697 967 HB THR 125 HB THR 125 1.401 4.980 -13.154 968 HG1 THR 125 HG1 THR 125 2.057 6.437 -11.105 969 HG21 THR 125 3HG2 THR 125 0.060 3.745 -11.394 970 HG22 THR 125 1HG2 THR 125 -0.136 5.497 -11.386 971 HG23 THR 125 2HG2 THR 125 0.893 4.719 -10.183 972 H PHE 126 H PHE 126 1.263 2.348 -10.310 973 HA PHE 126 HA PHE 126 2.526 3.220 -7.976 974 HB2 PHE 126 1HB PHE 126 0.321 2.069 -8.068 975 HB3 PHE 126 2HB PHE 126 1.159 0.554 -8.401 976 HD1 PHE 126 HD1 PHE 126 2.583 -0.505 -6.704 977 HD2 PHE 126 HD2 PHE 126 0.415 3.105 -5.873 978 HE1 PHE 126 HE1 PHE 126 2.965 -0.833 -4.277 979 HE2 PHE 126 HE2 PHE 126 0.794 2.776 -3.447 980 HZ PHE 126 HZ PHE 126 2.074 0.811 -2.653 981 H LEU 127 H LEU 127 3.086 0.191 -9.826 982 HA LEU 127 HA LEU 127 4.969 -0.986 -8.206 983 HB2 LEU 127 1HB LEU 127 5.175 -0.943 -11.223 984 HB3 LEU 127 2HB LEU 127 5.721 -2.207 -10.125 985 HG LEU 127 HG LEU 127 2.848 -1.382 -10.602 986 HD11 LEU 127 1HD1 LEU 127 2.662 -3.639 -11.610 987 HD12 LEU 127 2HD1 LEU 127 4.389 -3.885 -11.353 988 HD13 LEU 127 3HD1 LEU 127 3.833 -2.640 -12.471 989 HD21 LEU 127 3HD2 LEU 127 2.493 -3.577 -9.248 990 HD22 LEU 127 1HD2 LEU 127 2.933 -2.124 -8.354 991 HD23 LEU 127 2HD2 LEU 127 4.155 -3.344 -8.708 992 H GLN 128 H GLN 128 5.570 1.421 -10.797 993 HA GLN 128 HA GLN 128 8.354 1.392 -10.619 994 HB2 GLN 128 1HB GLN 128 6.705 3.804 -11.350 995 HB3 GLN 128 2HB GLN 128 8.281 3.324 -11.978 996 HG2 GLN 128 1HG GLN 128 5.613 1.991 -12.486 997 HG3 GLN 128 2HG GLN 128 6.661 2.771 -13.663 998 HE21 GLN 128 2HE2 GLN 128 5.663 -0.191 -13.156 999 HE22 GLN 128 1HE2 GLN 128 7.088 -1.089 -13.352 1000 H GLU 129 H GLU 129 5.970 3.368 -8.864 1001 HA GLU 129 HA GLU 129 7.798 5.154 -7.685 1002 HB2 GLU 129 1HB GLU 129 4.987 4.327 -7.222 1003 HB3 GLU 129 2HB GLU 129 5.796 4.973 -5.797 1004 HG2 GLU 129 1HG GLU 129 4.714 6.801 -6.967 1005 HG3 GLU 129 2HG GLU 129 6.456 6.981 -7.149 1006 H VAL 130 H VAL 130 6.600 1.992 -6.543 1007 HA VAL 130 HA VAL 130 7.952 2.067 -4.057 1008 HB VAL 130 HB VAL 130 7.011 -0.260 -5.746 1009 HG11 VAL 130 1HG1 VAL 130 7.115 -1.468 -3.509 1010 HG12 VAL 130 2HG1 VAL 130 8.082 -0.116 -2.919 1011 HG13 VAL 130 3HG1 VAL 130 8.678 -1.113 -4.247 1012 HG21 VAL 130 3HG2 VAL 130 5.155 1.095 -5.063 1013 HG22 VAL 130 1HG2 VAL 130 5.828 1.321 -3.448 1014 HG23 VAL 130 2HG2 VAL 130 5.212 -0.257 -3.932 1015 H ALA 131 H ALA 131 8.797 0.685 -7.196 1016 HA ALA 131 HA ALA 131 11.189 -0.561 -6.597 1017 HB1 ALA 131 3HB ALA 131 10.816 1.038 -9.122 1018 HB2 ALA 131 1HB ALA 131 9.958 -0.475 -8.831 1019 HB3 ALA 131 2HB ALA 131 11.720 -0.458 -8.899 1020 H ARG 132 H ARG 132 10.779 2.875 -7.515 1021 HA ARG 132 HA ARG 132 13.594 3.422 -7.170 1022 HB2 ARG 132 1HB ARG 132 11.204 5.213 -7.626 1023 HB3 ARG 132 2HB ARG 132 12.851 5.821 -7.456 1024 HG2 ARG 132 1HG ARG 132 13.567 4.398 -9.351 1025 HG3 ARG 132 2HG ARG 132 11.912 3.817 -9.532 1026 HD2 ARG 132 1HD ARG 132 12.706 6.734 -9.705 1027 HD3 ARG 132 2HD ARG 132 12.514 5.686 -11.106 1028 HE ARG 132 HE ARG 132 10.384 6.769 -9.439 1029 HH11 ARG 132 1HH2 ARG 132 11.391 4.454 -11.807 1030 HH12 ARG 132 2HH2 ARG 132 9.793 4.162 -12.404 1031 HH21 ARG 132 1HH1 ARG 132 8.282 6.386 -10.208 1032 HH22 ARG 132 2HH1 ARG 132 8.029 5.251 -11.493 1033 H ALA 133 H ALA 133 10.892 3.234 -5.107 1034 HA ALA 133 HA ALA 133 11.506 5.158 -3.158 1035 HB1 ALA 133 3HB ALA 133 9.973 4.030 -1.769 1036 HB2 ALA 133 1HB ALA 133 10.270 2.480 -2.548 1037 HB3 ALA 133 2HB ALA 133 9.394 3.750 -3.402 1038 H CYS 134 H CYS 134 13.127 2.234 -3.940 1039 HA CYS 134 HA CYS 134 15.271 2.726 -2.244 1040 HB2 CYS 134 1HB CYS 134 13.045 1.557 -0.823 1041 HB3 CYS 134 2HB CYS 134 14.391 0.426 -0.804 1042 HG CYS 134 HG CYS 134 15.410 1.873 0.917 1043 HA PRO 135 HA PRO 135 15.533 -1.939 -3.742 1044 HB2 PRO 135 1HB PRO 135 13.381 -1.771 -5.824 1045 HB3 PRO 135 2HB PRO 135 13.855 -3.142 -4.799 1046 HG2 PRO 135 1HG PRO 135 11.646 -1.756 -4.288 1047 HG3 PRO 135 2HG PRO 135 12.676 -2.353 -2.973 1048 HD2 PRO 135 1HD PRO 135 12.420 0.437 -4.042 1049 HD3 PRO 135 2HD PRO 135 12.683 -0.113 -2.378 1050 H GLY 136 H GLY 136 14.345 0.451 -6.125 1051 HA2 GLY 136 1HA GLY 136 15.208 1.008 -8.229 1052 HA3 GLY 136 2HA GLY 136 16.614 1.373 -7.234 1053 H PHE 137 H PHE 137 15.048 -1.613 -8.421 1054 HA PHE 137 HA PHE 137 16.117 -3.645 -8.916 1055 HB2 PHE 137 1HB PHE 137 16.849 -3.499 -11.277 1056 HB3 PHE 137 2HB PHE 137 15.316 -2.681 -10.985 1057 HD1 PHE 137 HD2 PHE 137 15.349 -0.160 -10.558 1058 HD2 PHE 137 HD1 PHE 137 18.694 -2.314 -12.177 1059 HE1 PHE 137 HE2 PHE 137 16.302 1.964 -11.412 1060 HE2 PHE 137 HE1 PHE 137 19.648 -0.190 -13.031 1061 HZ PHE 137 HZ PHE 137 18.450 1.949 -12.649 1062 H ASP 138 H ASP 138 17.706 -3.725 -7.206 1063 HA ASP 138 HA ASP 138 20.451 -3.678 -8.270 1064 HB2 ASP 138 1HB ASP 138 19.361 -2.036 -6.048 1065 HB3 ASP 138 2HB ASP 138 20.882 -2.840 -5.687 1066 HA PRO 139 HA PRO 139 20.800 -7.627 -6.384 1067 HB2 PRO 139 1HB PRO 139 23.307 -7.542 -5.196 1068 HB3 PRO 139 2HB PRO 139 23.031 -7.753 -6.937 1069 HG2 PRO 139 1HG PRO 139 23.688 -5.259 -5.421 1070 HG3 PRO 139 2HG PRO 139 24.340 -5.843 -6.965 1071 HD2 PRO 139 1HD PRO 139 22.462 -3.927 -6.908 1072 HD3 PRO 139 2HD PRO 139 22.446 -5.175 -8.170 1073 H GLU 140 H GLU 140 22.175 -5.233 -4.074 1074 HA GLU 140 HA GLU 140 20.574 -6.511 -1.920 1075 HB2 GLU 140 1HB GLU 140 23.363 -5.345 -1.826 1076 HB3 GLU 140 2HB GLU 140 22.437 -5.812 -0.398 1077 HG2 GLU 140 1HG GLU 140 22.270 -8.111 -1.224 1078 HG3 GLU 140 2HG GLU 140 23.120 -7.662 -2.700 1079 H THR 141 H THR 141 22.139 -3.474 -2.963 1080 HA THR 141 HA THR 141 21.785 -1.298 -2.223 1081 HB THR 141 HB THR 141 20.375 -1.234 -4.086 1082 HG1 THR 141 HG1 THR 141 18.349 -0.303 -3.173 1083 HG21 THR 141 3HG2 THR 141 18.121 -2.294 -4.098 1084 HG22 THR 141 1HG2 THR 141 18.456 -2.969 -2.511 1085 HG23 THR 141 2HG2 THR 141 19.418 -3.466 -3.903 1086 H ARG 142 H ARG 142 22.032 -2.550 0.060 1087 HA ARG 142 HA ARG 142 19.977 -2.854 1.840 1088 HB2 ARG 142 1HB ARG 142 22.712 -1.671 2.305 1089 HB3 ARG 142 2HB ARG 142 21.598 -2.089 3.608 1090 HG2 ARG 142 1HG ARG 142 21.530 -4.415 2.826 1091 HG3 ARG 142 2HG ARG 142 22.617 -4.008 1.497 1092 HD2 ARG 142 1HD ARG 142 24.350 -3.336 3.117 1093 HD3 ARG 142 2HD ARG 142 23.264 -3.740 4.443 1094 HE ARG 142 HE ARG 142 23.629 -6.016 4.018 1095 HH11 ARG 142 1HH2 ARG 142 25.023 -3.986 1.580 1096 HH12 ARG 142 2HH2 ARG 142 25.942 -5.262 0.854 1097 HH21 ARG 142 1HH1 ARG 142 24.823 -7.688 3.062 1098 HH22 ARG 142 2HH1 ARG 142 25.828 -7.356 1.691 1099 H ASP 143 H ASP 143 18.928 -1.547 3.352 1100 HA ASP 143 HA ASP 143 19.197 1.102 3.913 1101 HB2 ASP 143 1HB ASP 143 17.280 2.020 2.348 1102 HB3 ASP 143 2HB ASP 143 18.932 1.943 1.752 1103 HA PRO 144 HA PRO 144 15.390 -1.008 5.548 1104 HB2 PRO 144 1HB PRO 144 16.268 -2.069 7.892 1105 HB3 PRO 144 2HB PRO 144 16.389 -2.932 6.346 1106 HG2 PRO 144 1HG PRO 144 18.505 -1.596 7.922 1107 HG3 PRO 144 2HG PRO 144 18.617 -2.964 6.799 1108 HD2 PRO 144 1HD PRO 144 19.282 -0.234 6.236 1109 HD3 PRO 144 2HD PRO 144 19.197 -1.572 5.076 1110 H GLU 145 H GLU 145 14.157 0.598 6.241 1111 HA GLU 145 HA GLU 145 15.083 2.296 8.499 1112 HB2 GLU 145 1HB GLU 145 13.484 4.013 7.579 1113 HB3 GLU 145 2HB GLU 145 14.879 3.691 6.550 1114 HG2 GLU 145 1HG GLU 145 12.259 2.231 6.181 1115 HG3 GLU 145 2HG GLU 145 12.582 3.777 5.399 1116 H PHE 146 H PHE 146 13.597 2.751 10.128 1117 HA PHE 146 HA PHE 146 10.887 1.875 10.056 1118 HB2 PHE 146 1HB PHE 146 11.213 0.066 11.813 1119 HB3 PHE 146 2HB PHE 146 11.739 -0.341 10.178 1120 HD1 PHE 146 HD1 PHE 146 12.899 0.761 13.525 1121 HD2 PHE 146 HD2 PHE 146 14.049 -0.721 9.661 1122 HE1 PHE 146 HE1 PHE 146 15.198 0.372 14.357 1123 HE2 PHE 146 HE2 PHE 146 16.349 -1.111 10.495 1124 HZ PHE 146 HZ PHE 146 16.928 -0.566 12.844 1125 H GLU 147 H GLU 147 13.567 3.309 11.508 1126 HA GLU 147 HA GLU 147 12.661 3.663 14.161 1127 HB2 GLU 147 1HB GLU 147 14.562 5.265 12.453 1128 HB3 GLU 147 2HB GLU 147 14.282 5.593 14.166 1129 HG2 GLU 147 1HG GLU 147 14.957 3.324 14.743 1130 HG3 GLU 147 2HG GLU 147 15.164 2.927 13.037 1131 H TRP 148 H TRP 148 12.111 5.586 11.244 1132 HA TRP 148 HA TRP 148 10.858 7.726 12.699 1133 HB2 TRP 148 1HB TRP 148 10.289 8.651 10.511 1134 HB3 TRP 148 2HB TRP 148 11.982 8.174 10.576 1135 HD1 TRP 148 HD1 TRP 148 12.485 5.624 9.522 1136 HE1 TRP 148 HE1 TRP 148 11.469 4.576 7.400 1137 HE3 TRP 148 HE3 TRP 148 8.359 8.579 8.958 1138 HZ2 TRP 148 HZ2 TRP 148 9.209 4.935 5.693 1139 HZ3 TRP 148 HZ3 TRP 148 6.795 8.207 7.076 1140 HH2 TRP 148 HH2 TRP 148 7.216 6.391 5.441 1141 H LEU 149 H LEU 149 9.781 4.673 11.509 1142 HA LEU 149 HA LEU 149 7.045 5.245 11.078 1143 HB2 LEU 149 1HB LEU 149 8.597 2.764 11.706 1144 HB3 LEU 149 2HB LEU 149 6.848 2.709 11.875 1145 HG LEU 149 HG LEU 149 6.553 3.401 9.569 1146 HD11 LEU 149 1HD1 LEU 149 8.320 4.913 9.191 1147 HD12 LEU 149 2HD1 LEU 149 8.686 3.551 8.139 1148 HD13 LEU 149 3HD1 LEU 149 9.548 3.745 9.666 1149 HD21 LEU 149 3HD2 LEU 149 6.925 0.999 10.023 1150 HD22 LEU 149 1HD2 LEU 149 8.659 1.229 9.800 1151 HD23 LEU 149 2HD2 LEU 149 7.557 1.454 8.443 1152 H SER 150 H SER 150 8.875 4.484 14.040 1153 HA SER 150 HA SER 150 6.703 4.094 15.768 1154 HB2 SER 150 1HB SER 150 8.273 4.735 17.550 1155 HB3 SER 150 2HB SER 150 9.041 3.655 16.387 1156 HG SER 150 HG SER 150 9.592 5.829 15.338 1157 H ARG 151 H ARG 151 8.533 7.110 15.164 1158 HA ARG 151 HA ARG 151 6.621 8.689 16.647 1159 HB2 ARG 151 1HB ARG 151 8.038 10.596 15.841 1160 HB3 ARG 151 2HB ARG 151 8.937 9.354 16.714 1161 HG2 ARG 151 1HG ARG 151 9.641 8.345 14.592 1162 HG3 ARG 151 2HG ARG 151 8.716 9.549 13.697 1163 HD2 ARG 151 1HD ARG 151 11.027 10.257 13.753 1164 HD3 ARG 151 2HD ARG 151 10.096 11.329 14.794 1165 HE ARG 151 HE ARG 151 11.124 9.168 16.320 1166 HH11 ARG 151 1HH2 ARG 151 12.051 12.049 14.648 1167 HH12 ARG 151 2HH2 ARG 151 13.427 12.357 15.656 1168 HH21 ARG 151 1HH1 ARG 151 12.926 9.563 17.648 1169 HH22 ARG 151 2HH1 ARG 151 13.922 10.950 17.354 1170 H HIS 152 H HIS 152 5.601 7.193 14.399 1171 HA HIS 152 HA HIS 152 4.648 9.396 12.658 1172 HB2 HIS 152 1HB HIS 152 6.020 7.067 11.942 1173 HB3 HIS 152 2HB HIS 152 4.350 6.678 11.562 1174 HD2 HIS 152 HD2 HIS 152 6.990 9.482 10.631 1175 HE1 HIS 152 HE1 HIS 152 4.028 9.350 7.621 1176 HE2 HIS 152 HE2 HIS 152 6.217 10.433 8.321 1177 H THR 153 H THR 153 3.886 6.965 14.918 1178 HA THR 153 HA THR 153 1.922 6.107 15.718 1179 HB THR 153 HB THR 153 0.847 8.778 14.787 1180 HG1 THR 153 HG1 THR 153 2.850 8.637 16.154 1181 HG21 THR 153 3HG2 THR 153 -0.073 6.685 16.747 1182 HG22 THR 153 1HG2 THR 153 -1.010 7.580 15.552 1183 HG23 THR 153 2HG2 THR 153 -0.465 8.379 17.023 1184 H CYS 154 H CYS 154 -0.489 5.760 15.160 1185 HA CYS 154 HA CYS 154 -1.091 5.711 12.315 1186 HB2 CYS 154 1HB CYS 154 -1.491 3.246 12.323 1187 HB3 CYS 154 2HB CYS 154 0.212 3.674 12.497 1188 HG CYS 154 HG CYS 154 -0.152 3.306 15.149 1189 H ALA 155 H ALA 155 -3.286 5.071 11.903 1190 HA ALA 155 HA ALA 155 -5.530 5.223 12.316 1191 HB1 ALA 155 3HB ALA 155 -4.565 3.786 14.786 1192 HB2 ALA 155 1HB ALA 155 -5.355 3.101 13.367 1193 HB3 ALA 155 2HB ALA 155 -6.274 4.103 14.490 1194 H GLU 156 H GLU 156 -4.132 7.571 12.804 1195 HA GLU 156 HA GLU 156 -4.291 8.912 15.158 1196 HB2 GLU 156 1HB GLU 156 -5.169 9.928 12.452 1197 HB3 GLU 156 2HB GLU 156 -4.833 10.954 13.849 1198 HG2 GLU 156 1HG GLU 156 -2.530 10.049 13.947 1199 HG3 GLU 156 2HG GLU 156 -2.867 9.063 12.525 1200 HA PRO 157 HA PRO 157 -8.719 7.990 16.051 1201 HB2 PRO 157 1HB PRO 157 -7.998 9.674 18.432 1202 HB3 PRO 157 2HB PRO 157 -8.884 8.135 18.366 1203 HG2 PRO 157 1HG PRO 157 -6.370 8.190 19.175 1204 HG3 PRO 157 2HG PRO 157 -6.946 6.884 18.122 1205 HD2 PRO 157 1HD PRO 157 -5.264 9.269 17.413 1206 HD3 PRO 157 2HD PRO 157 -5.163 7.599 16.814 1207 H ASP 158 H ASP 158 -7.157 11.152 16.516 1208 HA ASP 158 HA ASP 158 -9.629 12.494 15.554 1209 HB2 ASP 158 1HB ASP 158 -7.467 13.420 17.450 1210 HB3 ASP 158 2HB ASP 158 -8.658 14.508 16.739 1211 H ALA 159 H ALA 159 -9.510 13.668 13.743 1212 HA ALA 159 HA ALA 159 -7.272 13.534 12.037 1213 HB1 ALA 159 3HB ALA 159 -9.640 15.418 11.979 1214 HB2 ALA 159 1HB ALA 159 -9.545 13.843 11.192 1215 HB3 ALA 159 2HB ALA 159 -8.509 15.164 10.649 1216 H GLU 160 H GLU 160 -8.397 16.033 14.268 1217 HA GLU 160 HA GLU 160 -6.608 18.069 13.450 1218 HB2 GLU 160 1HB GLU 160 -7.972 17.568 16.106 1219 HB3 GLU 160 2HB GLU 160 -7.091 19.041 15.706 1220 HG2 GLU 160 1HG GLU 160 -9.436 17.971 14.110 1221 HG3 GLU 160 2HG GLU 160 -9.563 19.233 15.332 1222 H SER 161 H SER 161 -6.345 15.463 15.831 1223 HA SER 161 HA SER 161 -4.574 14.757 17.131 1224 HB2 SER 161 1HB SER 161 -3.832 13.992 14.928 1225 HB3 SER 161 2HB SER 161 -3.103 15.564 14.610 1226 HG SER 161 HG SER 161 -2.417 14.150 16.937 Start of MODEL 5 1 H1 GLY 1 1H GLY 1 -15.674 26.726 -6.834 2 H2 GLY 1 2H GLY 1 -14.042 26.823 -7.301 3 H3 GLY 1 3H GLY 1 -14.693 27.969 -6.229 4 HA2 GLY 1 1HA GLY 1 -13.284 25.852 -5.441 5 HA3 GLY 1 2HA GLY 1 -14.507 26.641 -4.444 6 HA PRO 2 HA PRO 2 -16.982 23.034 -6.406 7 HB2 PRO 2 1HB PRO 2 -15.699 21.416 -8.231 8 HB3 PRO 2 2HB PRO 2 -16.600 22.877 -8.682 9 HG2 PRO 2 1HG PRO 2 -13.655 22.512 -8.322 10 HG3 PRO 2 2HG PRO 2 -14.535 23.406 -9.577 11 HD2 PRO 2 1HD PRO 2 -13.369 24.660 -7.458 12 HD3 PRO 2 2HD PRO 2 -14.860 25.268 -8.212 13 H LEU 3 H LEU 3 -13.650 22.690 -5.536 14 HA LEU 3 HA LEU 3 -12.512 21.176 -4.245 15 HB2 LEU 3 1HB LEU 3 -14.257 21.880 -2.609 16 HB3 LEU 3 2HB LEU 3 -15.273 20.548 -3.162 17 HG LEU 3 HG LEU 3 -13.481 18.943 -2.512 18 HD11 LEU 3 1HD1 LEU 3 -12.073 21.505 -1.815 19 HD12 LEU 3 2HD1 LEU 3 -11.431 20.037 -2.553 20 HD13 LEU 3 3HD1 LEU 3 -11.764 20.077 -0.827 21 HD21 LEU 3 3HD2 LEU 3 -13.786 19.189 -0.062 22 HD22 LEU 3 1HD2 LEU 3 -15.297 19.455 -0.935 23 HD23 LEU 3 2HD2 LEU 3 -14.383 20.831 -0.311 24 H GLY 4 H GLY 4 -11.850 19.821 -5.929 25 HA2 GLY 4 1HA GLY 4 -13.528 17.495 -6.601 26 HA3 GLY 4 2HA GLY 4 -12.064 18.002 -7.438 27 H SER 5 H SER 5 -13.337 16.330 -4.634 28 HA SER 5 HA SER 5 -10.856 14.789 -4.426 29 HB2 SER 5 1HB SER 5 -10.714 15.158 -1.986 30 HB3 SER 5 2HB SER 5 -10.481 16.654 -2.884 31 HG SER 5 HG SER 5 -12.255 17.408 -2.043 32 H MET 6 H MET 6 -11.400 12.704 -4.287 33 HA MET 6 HA MET 6 -13.350 11.688 -2.499 34 HB2 MET 6 1HB MET 6 -14.868 10.789 -4.402 35 HB3 MET 6 2HB MET 6 -15.075 12.464 -3.891 36 HG2 MET 6 1HG MET 6 -13.667 13.234 -5.750 37 HG3 MET 6 2HG MET 6 -13.392 11.568 -6.250 38 HE1 MET 6 3HE MET 6 -16.462 10.383 -7.933 39 HE2 MET 6 1HE MET 6 -16.002 9.977 -6.275 40 HE3 MET 6 2HE MET 6 -14.765 10.184 -7.511 41 H ASP 7 H ASP 7 -10.867 11.417 -4.715 42 HA ASP 7 HA ASP 7 -11.017 8.616 -5.329 43 HB2 ASP 7 1HB ASP 7 -8.766 10.619 -5.480 44 HB3 ASP 7 2HB ASP 7 -8.601 8.936 -5.975 45 H GLN 8 H GLN 8 -8.655 7.560 -4.803 46 HA GLN 8 HA GLN 8 -8.806 7.018 -1.938 47 HB2 GLN 8 1HB GLN 8 -6.717 5.480 -2.823 48 HB3 GLN 8 2HB GLN 8 -8.396 4.971 -2.886 49 HG2 GLN 8 1HG GLN 8 -7.155 6.554 -5.139 50 HG3 GLN 8 2HG GLN 8 -7.026 4.797 -5.065 51 HE21 GLN 8 2HE2 GLN 8 -9.425 3.882 -4.303 52 HE22 GLN 8 1HE2 GLN 8 -10.673 4.430 -5.312 53 H SER 9 H SER 9 -6.447 8.257 -4.279 54 HA SER 9 HA SER 9 -4.266 8.590 -2.593 55 HB2 SER 9 1HB SER 9 -5.124 10.424 -4.838 56 HB3 SER 9 2HB SER 9 -3.523 10.392 -4.103 57 HG SER 9 HG SER 9 -4.021 7.923 -4.687 58 H VAL 10 H VAL 10 -6.914 10.893 -3.166 59 HA VAL 10 HA VAL 10 -5.908 12.866 -1.378 60 HB VAL 10 HB VAL 10 -8.137 13.856 -1.564 61 HG11 VAL 10 1HG1 VAL 10 -7.275 12.660 -4.212 62 HG12 VAL 10 2HG1 VAL 10 -6.486 14.038 -3.445 63 HG13 VAL 10 3HG1 VAL 10 -8.165 14.165 -3.973 64 HG21 VAL 10 3HG2 VAL 10 -9.613 11.998 -1.403 65 HG22 VAL 10 1HG2 VAL 10 -8.811 11.147 -2.725 66 HG23 VAL 10 2HG2 VAL 10 -9.799 12.572 -3.060 67 H ALA 11 H ALA 11 -8.339 10.315 -1.063 68 HA ALA 11 HA ALA 11 -9.375 10.695 1.398 69 HB1 ALA 11 3HB ALA 11 -9.728 8.697 -0.183 70 HB2 ALA 11 1HB ALA 11 -9.821 8.380 1.551 71 HB3 ALA 11 2HB ALA 11 -8.364 7.953 0.650 72 H ILE 12 H ILE 12 -6.160 9.340 0.748 73 HA ILE 12 HA ILE 12 -5.526 8.715 3.411 74 HB ILE 12 HB ILE 12 -3.675 9.547 1.172 75 HG12 ILE 12 1HG1 ILE 12 -5.075 7.674 0.495 76 HG13 ILE 12 2HG1 ILE 12 -3.448 7.088 0.818 77 HG21 ILE 12 1HG2 ILE 12 -2.343 9.601 3.093 78 HG22 ILE 12 2HG2 ILE 12 -2.125 7.944 2.535 79 HG23 ILE 12 3HG2 ILE 12 -3.228 8.292 3.866 80 HD11 ILE 12 3HD1 ILE 12 -4.412 6.644 3.243 81 HD12 ILE 12 1HD1 ILE 12 -4.714 5.497 1.943 82 HD13 ILE 12 2HD1 ILE 12 -5.960 6.657 2.395 83 H GLN 13 H GLN 13 -4.666 11.542 1.506 84 HA GLN 13 HA GLN 13 -3.275 12.980 3.382 85 HB2 GLN 13 1HB GLN 13 -3.991 13.590 0.902 86 HB3 GLN 13 2HB GLN 13 -5.266 14.498 1.715 87 HG2 GLN 13 1HG GLN 13 -3.433 16.007 1.466 88 HG3 GLN 13 2HG GLN 13 -3.433 15.516 3.158 89 HE21 GLN 13 2HE2 GLN 13 -1.506 14.497 3.954 90 HE22 GLN 13 1HE2 GLN 13 -0.222 14.037 2.943 91 H GLU 14 H GLU 14 -6.835 12.972 2.965 92 HA GLU 14 HA GLU 14 -7.420 14.725 5.072 93 HB2 GLU 14 1HB GLU 14 -8.988 12.427 3.878 94 HB3 GLU 14 2HB GLU 14 -9.661 13.594 5.017 95 HG2 GLU 14 1HG GLU 14 -9.146 15.432 3.473 96 HG3 GLU 14 2HG GLU 14 -8.412 14.293 2.344 97 H THR 15 H THR 15 -6.207 11.543 5.073 98 HA THR 15 HA THR 15 -6.929 11.136 7.932 99 HB THR 15 HB THR 15 -6.611 8.768 7.584 100 HG1 THR 15 HG1 THR 15 -6.364 8.525 5.011 101 HG21 THR 15 3HG2 THR 15 -8.828 9.342 7.053 102 HG22 THR 15 1HG2 THR 15 -8.295 8.432 5.641 103 HG23 THR 15 2HG2 THR 15 -8.358 10.190 5.580 104 H LEU 16 H LEU 16 -4.573 12.641 6.616 105 HA LEU 16 HA LEU 16 -2.470 11.273 8.185 106 HB2 LEU 16 1HB LEU 16 -2.179 10.889 5.728 107 HB3 LEU 16 2HB LEU 16 -2.062 12.631 5.509 108 HG LEU 16 HG LEU 16 -0.101 12.670 7.045 109 HD11 LEU 16 1HD1 LEU 16 0.945 10.246 7.326 110 HD12 LEU 16 2HD1 LEU 16 -0.736 9.730 7.202 111 HD13 LEU 16 3HD1 LEU 16 -0.243 10.838 8.483 112 HD21 LEU 16 3HD2 LEU 16 0.603 12.621 4.824 113 HD22 LEU 16 1HD2 LEU 16 -0.129 11.043 4.509 114 HD23 LEU 16 2HD2 LEU 16 1.367 11.149 5.430 115 H VAL 17 H VAL 17 -1.037 12.628 9.265 116 HA VAL 17 HA VAL 17 -2.025 15.165 10.023 117 HB VAL 17 HB VAL 17 0.711 13.919 10.470 118 HG11 VAL 17 1HG1 VAL 17 0.515 15.492 12.561 119 HG12 VAL 17 2HG1 VAL 17 -0.666 16.364 11.580 120 HG13 VAL 17 3HG1 VAL 17 0.994 16.188 11.014 121 HG21 VAL 17 3HG2 VAL 17 -1.022 12.488 11.389 122 HG22 VAL 17 1HG2 VAL 17 -1.844 13.873 12.112 123 HG23 VAL 17 2HG2 VAL 17 -0.272 13.363 12.725 124 H GLU 18 H GLU 18 -0.427 17.093 9.950 125 HA GLU 18 HA GLU 18 -0.066 17.750 7.197 126 HB2 GLU 18 1HB GLU 18 0.759 19.899 8.072 127 HB3 GLU 18 2HB GLU 18 -0.751 19.419 8.847 128 HG2 GLU 18 1HG GLU 18 0.552 18.477 10.744 129 HG3 GLU 18 2HG GLU 18 2.036 19.049 9.985 130 H GLY 19 H GLY 19 2.131 19.189 6.960 131 HA2 GLY 19 1HA GLY 19 4.383 19.140 6.511 132 HA3 GLY 19 2HA GLY 19 4.549 18.104 7.922 133 H GLU 20 H GLU 20 2.822 15.969 6.913 134 HA GLU 20 HA GLU 20 4.812 14.547 5.449 135 HB2 GLU 20 1HB GLU 20 1.970 13.931 6.233 136 HB3 GLU 20 2HB GLU 20 2.909 12.834 5.219 137 HG2 GLU 20 1HG GLU 20 3.190 12.114 7.500 138 HG3 GLU 20 2HG GLU 20 4.707 12.852 6.998 139 H TYR 21 H TYR 21 3.862 13.164 3.525 140 HA TYR 21 HA TYR 21 2.580 14.916 1.526 141 HB2 TYR 21 1HB TYR 21 5.086 15.167 1.446 142 HB3 TYR 21 2HB TYR 21 5.175 13.456 1.031 143 HD1 TYR 21 HD1 TYR 21 3.989 16.778 -0.094 144 HD2 TYR 21 HD2 TYR 21 4.551 12.655 -1.133 145 HE1 TYR 21 HE1 TYR 21 3.566 17.323 -2.476 146 HE2 TYR 21 HE2 TYR 21 4.125 13.192 -3.516 147 HH TYR 21 HH TYR 21 3.944 14.888 -5.013 148 H CYS 22 H CYS 22 1.067 13.838 0.425 149 HA CYS 22 HA CYS 22 1.035 10.901 0.505 150 HB2 CYS 22 1HB CYS 22 -1.071 12.179 0.921 151 HB3 CYS 22 2HB CYS 22 -0.982 12.802 -0.728 152 HG CYS 22 HG CYS 22 -1.642 9.875 0.063 153 H VAL 23 H VAL 23 1.385 9.632 -1.327 154 HA VAL 23 HA VAL 23 2.350 11.075 -3.731 155 HB VAL 23 HB VAL 23 3.188 8.384 -2.639 156 HG11 VAL 23 1HG1 VAL 23 3.389 8.422 -5.051 157 HG12 VAL 23 2HG1 VAL 23 5.000 8.643 -4.371 158 HG13 VAL 23 3HG1 VAL 23 4.117 10.028 -5.010 159 HG21 VAL 23 3HG2 VAL 23 3.928 10.358 -1.296 160 HG22 VAL 23 1HG2 VAL 23 4.688 11.010 -2.750 161 HG23 VAL 23 2HG2 VAL 23 5.269 9.499 -2.053 162 H ILE 24 H ILE 24 1.123 7.874 -2.758 163 HA ILE 24 HA ILE 24 -0.892 7.941 -4.832 164 HB ILE 24 HB ILE 24 1.117 7.350 -6.113 165 HG12 ILE 24 1HG1 ILE 24 0.326 5.284 -7.143 166 HG13 ILE 24 2HG1 ILE 24 -0.661 4.921 -5.731 167 HG21 ILE 24 1HG2 ILE 24 1.310 5.047 -4.161 168 HG22 ILE 24 2HG2 ILE 24 2.456 6.372 -4.340 169 HG23 ILE 24 3HG2 ILE 24 2.263 5.194 -5.637 170 HD11 ILE 24 3HD1 ILE 24 -1.762 6.047 -7.833 171 HD12 ILE 24 1HD1 ILE 24 -1.054 7.527 -7.182 172 HD13 ILE 24 2HD1 ILE 24 -2.208 6.600 -6.222 173 H ALA 25 H ALA 25 -2.547 6.592 -4.444 174 HA ALA 25 HA ALA 25 -2.283 4.414 -2.502 175 HB1 ALA 25 3HB ALA 25 -4.550 6.342 -2.083 176 HB2 ALA 25 1HB ALA 25 -2.965 6.738 -1.422 177 HB3 ALA 25 2HB ALA 25 -3.781 5.251 -0.933 178 H VAL 26 H VAL 26 -3.041 2.780 -3.680 179 HA VAL 26 HA VAL 26 -5.341 3.238 -5.470 180 HB VAL 26 HB VAL 26 -4.733 1.060 -6.436 181 HG11 VAL 26 1HG1 VAL 26 -2.282 2.815 -6.157 182 HG12 VAL 26 2HG1 VAL 26 -3.664 3.240 -7.163 183 HG13 VAL 26 3HG1 VAL 26 -2.722 1.797 -7.528 184 HG21 VAL 26 3HG2 VAL 26 -3.817 0.020 -4.380 185 HG22 VAL 26 1HG2 VAL 26 -2.459 1.146 -4.423 186 HG23 VAL 26 2HG2 VAL 26 -2.650 -0.051 -5.702 187 H GLN 27 H GLN 27 -6.445 0.786 -5.603 188 HA GLN 27 HA GLN 27 -7.180 0.024 -2.851 189 HB2 GLN 27 1HB GLN 27 -8.900 1.571 -3.434 190 HB3 GLN 27 2HB GLN 27 -9.053 0.904 -5.051 191 HG2 GLN 27 1HG GLN 27 -10.383 -0.834 -4.357 192 HG3 GLN 27 2HG GLN 27 -9.469 -1.079 -2.871 193 HE21 GLN 27 2HE2 GLN 27 -10.934 -0.915 -1.226 194 HE22 GLN 27 1HE2 GLN 27 -12.042 0.348 -1.034 195 H GLY 28 H GLY 28 -7.237 -2.087 -2.587 196 HA2 GLY 28 1HA GLY 28 -7.622 -3.844 -4.950 197 HA3 GLY 28 2HA GLY 28 -6.303 -4.118 -3.815 198 H VAL 29 H VAL 29 -7.036 -6.126 -3.282 199 HA VAL 29 HA VAL 29 -9.087 -6.193 -1.226 200 HB VAL 29 HB VAL 29 -10.238 -8.154 -2.249 201 HG11 VAL 29 1HG1 VAL 29 -11.669 -6.842 -3.639 202 HG12 VAL 29 2HG1 VAL 29 -10.361 -5.737 -4.064 203 HG13 VAL 29 3HG1 VAL 29 -11.027 -5.727 -2.430 204 HG21 VAL 29 3HG2 VAL 29 -8.488 -8.853 -3.788 205 HG22 VAL 29 1HG2 VAL 29 -8.597 -7.320 -4.655 206 HG23 VAL 29 2HG2 VAL 29 -9.943 -8.461 -4.707 207 H LEU 30 H LEU 30 -9.196 -8.427 -0.275 208 HA LEU 30 HA LEU 30 -6.696 -9.939 -0.587 209 HB2 LEU 30 1HB LEU 30 -6.666 -8.175 1.414 210 HB3 LEU 30 2HB LEU 30 -7.664 -9.375 2.223 211 HG LEU 30 HG LEU 30 -5.451 -9.914 2.847 212 HD11 LEU 30 1HD1 LEU 30 -5.097 -12.108 1.983 213 HD12 LEU 30 2HD1 LEU 30 -5.888 -11.733 0.461 214 HD13 LEU 30 3HD1 LEU 30 -6.828 -11.839 1.943 215 HD21 LEU 30 3HD2 LEU 30 -3.823 -10.328 0.675 216 HD22 LEU 30 1HD2 LEU 30 -3.893 -8.831 1.597 217 HD23 LEU 30 2HD2 LEU 30 -4.794 -8.978 0.105 218 H CYS 31 H CYS 31 -7.348 -12.032 -0.898 219 HA CYS 31 HA CYS 31 -10.010 -12.799 0.116 220 HB2 CYS 31 1HB CYS 31 -9.812 -13.025 -2.266 221 HB3 CYS 31 2HB CYS 31 -8.273 -13.871 -2.110 222 HG CYS 31 HG CYS 31 -9.466 -15.969 -1.337 223 H LYS 32 H LYS 32 -10.228 -14.326 1.566 224 HA LYS 32 HA LYS 32 -7.947 -16.111 2.182 225 HB2 LYS 32 1HB LYS 32 -9.749 -14.684 4.152 226 HB3 LYS 32 2HB LYS 32 -8.685 -16.028 4.574 227 HG2 LYS 32 1HG LYS 32 -6.734 -14.764 3.809 228 HG3 LYS 32 2HG LYS 32 -7.774 -13.447 3.285 229 HD2 LYS 32 1HD LYS 32 -7.018 -12.711 5.385 230 HD3 LYS 32 2HD LYS 32 -8.605 -13.393 5.744 231 HE2 LYS 32 1HE LYS 32 -7.598 -15.465 6.521 232 HE3 LYS 32 2HE LYS 32 -5.999 -14.926 6.013 233 HZ1 LYS 32 3HZ LYS 32 -7.368 -13.096 7.768 234 HZ2 LYS 32 1HZ LYS 32 -5.769 -13.662 7.823 235 HZ3 LYS 32 2HZ LYS 32 -7.026 -14.602 8.476 236 H GLY 33 H GLY 33 -8.497 -18.142 1.897 237 HA2 GLY 33 1HA GLY 33 -9.763 -20.027 1.561 238 HA3 GLY 33 2HA GLY 33 -10.733 -19.438 2.908 239 H ASP 34 H ASP 34 -12.737 -18.656 2.530 240 HA ASP 34 HA ASP 34 -13.583 -18.172 -0.266 241 HB2 ASP 34 1HB ASP 34 -15.716 -19.292 0.229 242 HB3 ASP 34 2HB ASP 34 -14.364 -20.406 0.409 243 H SER 35 H SER 35 -12.749 -16.455 1.986 244 HA SER 35 HA SER 35 -15.231 -14.850 2.312 245 HB2 SER 35 1HB SER 35 -14.459 -15.814 4.464 246 HB3 SER 35 2HB SER 35 -12.882 -15.067 4.220 247 HG SER 35 HG SER 35 -14.549 -13.136 3.864 248 H ARG 36 H ARG 36 -15.064 -13.121 0.978 249 HA ARG 36 HA ARG 36 -12.437 -12.100 0.232 250 HB2 ARG 36 1HB ARG 36 -15.209 -11.217 -0.602 251 HB3 ARG 36 2HB ARG 36 -13.696 -10.677 -1.322 252 HG2 ARG 36 1HG ARG 36 -14.386 -13.615 -1.190 253 HG3 ARG 36 2HG ARG 36 -14.996 -12.602 -2.496 254 HD2 ARG 36 1HD ARG 36 -12.621 -11.913 -2.979 255 HD3 ARG 36 2HD ARG 36 -12.092 -13.097 -1.788 256 HE ARG 36 HE ARG 36 -12.648 -14.811 -3.272 257 HH11 ARG 36 1HH2 ARG 36 -13.749 -11.720 -4.373 258 HH12 ARG 36 2HH2 ARG 36 -14.147 -12.274 -5.965 259 HH21 ARG 36 1HH1 ARG 36 -13.169 -15.545 -5.358 260 HH22 ARG 36 2HH1 ARG 36 -13.819 -14.440 -6.522 261 H GLN 37 H GLN 37 -11.664 -10.083 0.628 262 HA GLN 37 HA GLN 37 -13.144 -8.369 2.532 263 HB2 GLN 37 1HB GLN 37 -10.260 -9.273 2.726 264 HB3 GLN 37 2HB GLN 37 -10.967 -7.981 3.701 265 HG2 GLN 37 1HG GLN 37 -12.534 -9.490 4.716 266 HG3 GLN 37 2HG GLN 37 -12.117 -10.776 3.586 267 HE21 GLN 37 2HE2 GLN 37 -10.104 -11.912 3.897 268 HE22 GLN 37 1HE2 GLN 37 -9.223 -11.772 5.337 269 H SER 38 H SER 38 -12.319 -6.188 2.597 270 HA SER 38 HA SER 38 -11.080 -5.335 0.028 271 HB2 SER 38 1HB SER 38 -13.024 -3.664 1.609 272 HB3 SER 38 2HB SER 38 -12.461 -3.430 -0.044 273 HG SER 38 HG SER 38 -14.029 -5.590 0.929 274 H ARG 39 H ARG 39 -9.252 -4.315 0.188 275 HA ARG 39 HA ARG 39 -8.522 -2.960 2.725 276 HB2 ARG 39 1HB ARG 39 -6.791 -4.650 0.915 277 HB3 ARG 39 2HB ARG 39 -6.180 -3.683 2.255 278 HG2 ARG 39 1HG ARG 39 -8.358 -5.731 2.688 279 HG3 ARG 39 2HG ARG 39 -6.662 -6.206 2.671 280 HD2 ARG 39 1HD ARG 39 -6.211 -4.505 4.451 281 HD3 ARG 39 2HD ARG 39 -7.940 -4.179 4.530 282 HE ARG 39 HE ARG 39 -8.238 -6.194 5.646 283 HH11 ARG 39 1HH2 ARG 39 -5.055 -5.960 4.293 284 HH12 ARG 39 2HH2 ARG 39 -4.470 -7.386 5.083 285 HH21 ARG 39 1HH1 ARG 39 -7.475 -8.057 6.677 286 HH22 ARG 39 2HH1 ARG 39 -5.840 -8.573 6.433 287 H LEU 40 H LEU 40 -7.334 -1.124 2.577 288 HA LEU 40 HA LEU 40 -7.168 0.098 -0.121 289 HB2 LEU 40 1HB LEU 40 -8.768 1.043 1.705 290 HB3 LEU 40 2HB LEU 40 -7.303 1.651 2.460 291 HG LEU 40 HG LEU 40 -8.300 3.374 1.036 292 HD11 LEU 40 1HD1 LEU 40 -6.346 4.051 -0.061 293 HD12 LEU 40 2HD1 LEU 40 -5.901 2.409 -0.489 294 HD13 LEU 40 3HD1 LEU 40 -5.736 2.961 1.177 295 HD21 LEU 40 3HD2 LEU 40 -9.178 1.395 -0.586 296 HD22 LEU 40 1HD2 LEU 40 -7.733 1.867 -1.482 297 HD23 LEU 40 2HD2 LEU 40 -8.986 3.058 -1.142 298 H LEU 41 H LEU 41 -5.156 0.356 -0.880 299 HA LEU 41 HA LEU 41 -2.876 0.158 0.923 300 HB2 LEU 41 1HB LEU 41 -3.184 0.280 -2.081 301 HB3 LEU 41 2HB LEU 41 -1.616 0.281 -1.279 302 HG LEU 41 HG LEU 41 -2.303 -1.853 -0.110 303 HD11 LEU 41 1HD1 LEU 41 -4.672 -1.484 -1.949 304 HD12 LEU 41 2HD1 LEU 41 -4.655 -1.923 -0.240 305 HD13 LEU 41 3HD1 LEU 41 -4.161 -3.097 -1.453 306 HD21 LEU 41 3HD2 LEU 41 -2.209 -1.819 -3.144 307 HD22 LEU 41 1HD2 LEU 41 -1.947 -3.253 -2.151 308 HD23 LEU 41 2HD2 LEU 41 -0.824 -1.896 -2.054 309 H GLY 42 H GLY 42 -1.177 1.711 0.947 310 HA2 GLY 42 1HA GLY 42 -1.608 4.323 -0.261 311 HA3 GLY 42 2HA GLY 42 -1.699 4.294 1.500 312 H LEU 43 H LEU 43 0.251 5.472 -0.471 313 HA LEU 43 HA LEU 43 2.724 4.388 0.754 314 HB2 LEU 43 1HB LEU 43 2.713 3.683 -1.563 315 HB3 LEU 43 2HB LEU 43 2.319 5.312 -2.098 316 HG LEU 43 HG LEU 43 4.468 6.143 -1.313 317 HD11 LEU 43 1HD1 LEU 43 4.989 4.918 0.622 318 HD12 LEU 43 2HD1 LEU 43 6.147 4.290 -0.547 319 HD13 LEU 43 3HD1 LEU 43 4.697 3.364 -0.161 320 HD21 LEU 43 3HD2 LEU 43 4.275 5.036 -3.559 321 HD22 LEU 43 1HD2 LEU 43 4.883 3.551 -2.827 322 HD23 LEU 43 2HD2 LEU 43 5.904 4.989 -2.884 323 H VAL 44 H VAL 44 3.935 5.867 1.770 324 HA VAL 44 HA VAL 44 3.407 8.739 1.202 325 HB VAL 44 HB VAL 44 3.719 9.111 3.671 326 HG11 VAL 44 1HG1 VAL 44 1.390 7.402 2.745 327 HG12 VAL 44 2HG1 VAL 44 1.506 9.158 2.623 328 HG13 VAL 44 3HG1 VAL 44 1.400 8.392 4.207 329 HG21 VAL 44 3HG2 VAL 44 4.795 6.973 4.223 330 HG22 VAL 44 1HG2 VAL 44 3.360 6.094 3.697 331 HG23 VAL 44 2HG2 VAL 44 3.286 7.128 5.120 332 H ARG 45 H ARG 45 5.091 9.994 0.968 333 HA ARG 45 HA ARG 45 7.785 8.937 1.618 334 HB2 ARG 45 1HB ARG 45 7.352 9.307 -0.808 335 HB3 ARG 45 2HB ARG 45 7.019 11.004 -0.459 336 HG2 ARG 45 1HG ARG 45 9.285 11.282 0.450 337 HG3 ARG 45 2HG ARG 45 9.627 9.576 0.144 338 HD2 ARG 45 1HD ARG 45 9.125 9.988 -2.285 339 HD3 ARG 45 2HD ARG 45 9.007 11.707 -1.919 340 HE ARG 45 HE ARG 45 11.488 10.514 -1.040 341 HH11 ARG 45 1HH2 ARG 45 9.732 11.955 -3.652 342 HH12 ARG 45 2HH2 ARG 45 11.150 12.468 -4.505 343 HH21 ARG 45 1HH1 ARG 45 13.351 11.180 -2.156 344 HH22 ARG 45 2HH1 ARG 45 13.198 12.029 -3.658 345 H TYR 46 H TYR 46 8.904 10.016 3.060 346 HA TYR 46 HA TYR 46 8.074 12.759 3.837 347 HB2 TYR 46 1HB TYR 46 7.305 11.098 5.479 348 HB3 TYR 46 2HB TYR 46 8.948 10.481 5.635 349 HD1 TYR 46 HD1 TYR 46 6.802 13.475 6.134 350 HD2 TYR 46 HD2 TYR 46 10.553 11.575 6.998 351 HE1 TYR 46 HE1 TYR 46 7.292 15.217 7.831 352 HE2 TYR 46 HE2 TYR 46 11.046 13.313 8.692 353 HH TYR 46 HH TYR 46 8.798 15.299 9.992 354 H ARG 47 H ARG 47 9.716 14.224 3.948 355 HA ARG 47 HA ARG 47 12.401 13.307 3.225 356 HB2 ARG 47 1HB ARG 47 11.399 15.233 2.038 357 HB3 ARG 47 2HB ARG 47 11.343 16.124 3.559 358 HG2 ARG 47 1HG ARG 47 13.795 15.959 3.762 359 HG3 ARG 47 2HG ARG 47 13.863 15.037 2.264 360 HD2 ARG 47 1HD ARG 47 12.764 17.851 2.503 361 HD3 ARG 47 2HD ARG 47 14.391 17.460 1.949 362 HE ARG 47 HE ARG 47 11.914 17.098 0.465 363 HH11 ARG 47 1HH2 ARG 47 15.263 16.299 0.837 364 HH12 ARG 47 2HH2 ARG 47 15.463 15.784 -0.804 365 HH21 ARG 47 1HH1 ARG 47 12.171 16.422 -1.685 366 HH22 ARG 47 2HH1 ARG 47 13.714 15.854 -2.231 367 H LEU 48 H LEU 48 14.225 13.558 4.439 368 HA LEU 48 HA LEU 48 13.811 14.072 7.319 369 HB2 LEU 48 1HB LEU 48 16.107 12.780 5.832 370 HB3 LEU 48 2HB LEU 48 16.056 13.033 7.574 371 HG LEU 48 HG LEU 48 14.015 11.427 6.007 372 HD11 LEU 48 1HD1 LEU 48 15.159 9.514 7.333 373 HD12 LEU 48 2HD1 LEU 48 16.497 10.640 7.541 374 HD13 LEU 48 3HD1 LEU 48 16.003 10.149 5.921 375 HD21 LEU 48 3HD2 LEU 48 13.665 10.593 8.511 376 HD22 LEU 48 1HD2 LEU 48 12.877 12.059 7.944 377 HD23 LEU 48 2HD2 LEU 48 14.350 12.165 8.909 378 H GLU 49 H GLU 49 14.770 15.686 8.374 379 HA GLU 49 HA GLU 49 15.579 18.017 7.117 380 HB2 GLU 49 1HB GLU 49 16.340 16.978 9.862 381 HB3 GLU 49 2HB GLU 49 16.553 18.642 9.323 382 HG2 GLU 49 1HG GLU 49 14.487 18.729 10.433 383 HG3 GLU 49 2HG GLU 49 14.004 18.543 8.750 384 H ASN 50 H ASN 50 17.262 15.090 7.388 385 HA ASN 50 HA ASN 50 19.931 16.254 7.243 386 HB2 ASN 50 1HB ASN 50 18.920 13.406 7.121 387 HB3 ASN 50 2HB ASN 50 20.623 13.852 7.028 388 HD21 ASN 50 2HD2 ASN 50 18.759 12.502 9.205 389 HD22 ASN 50 1HD2 ASN 50 19.227 13.305 10.625 390 H ASP 51 H ASP 51 17.435 15.726 5.112 391 HA ASP 51 HA ASP 51 17.420 16.197 2.829 392 HB2 ASP 51 1HB ASP 51 19.951 16.909 3.214 393 HB3 ASP 51 2HB ASP 51 20.287 15.343 2.488 394 H ALA 52 H ALA 52 18.335 13.510 4.570 395 HA ALA 52 HA ALA 52 18.528 11.534 2.533 396 HB1 ALA 52 3HB ALA 52 19.457 10.962 4.626 397 HB2 ALA 52 1HB ALA 52 17.992 9.986 4.520 398 HB3 ALA 52 2HB ALA 52 18.008 11.454 5.499 399 H GLN 53 H GLN 53 17.031 10.155 1.741 400 HA GLN 53 HA GLN 53 14.190 10.907 2.080 401 HB2 GLN 53 1HB GLN 53 15.608 9.386 -0.121 402 HB3 GLN 53 2HB GLN 53 13.873 9.707 -0.072 403 HG2 GLN 53 1HG GLN 53 15.995 11.865 0.016 404 HG3 GLN 53 2HG GLN 53 15.169 11.359 -1.458 405 HE21 GLN 53 2HE2 GLN 53 15.083 13.888 0.484 406 HE22 GLN 53 1HE2 GLN 53 13.416 14.180 0.603 407 H GLU 54 H GLU 54 12.641 9.413 2.587 408 HA GLU 54 HA GLU 54 13.403 6.607 2.959 409 HB2 GLU 54 1HB GLU 54 12.318 8.371 5.171 410 HB3 GLU 54 2HB GLU 54 12.304 6.610 5.233 411 HG2 GLU 54 1HG GLU 54 14.794 8.311 4.889 412 HG3 GLU 54 2HG GLU 54 14.276 7.573 6.401 413 H HIS 55 H HIS 55 11.726 5.184 2.765 414 HA HIS 55 HA HIS 55 9.040 6.296 2.144 415 HB2 HIS 55 1HB HIS 55 10.556 4.148 0.637 416 HB3 HIS 55 2HB HIS 55 8.868 4.575 0.358 417 HD2 HIS 55 HD2 HIS 55 8.473 6.983 -1.068 418 HE1 HIS 55 HE1 HIS 55 12.564 7.844 -1.655 419 HE2 HIS 55 HE2 HIS 55 10.198 8.509 -2.298 420 H ALA 56 H ALA 56 7.286 4.878 2.533 421 HA ALA 56 HA ALA 56 7.769 2.314 3.820 422 HB1 ALA 56 3HB ALA 56 6.248 3.029 5.739 423 HB2 ALA 56 1HB ALA 56 6.535 4.691 5.221 424 HB3 ALA 56 2HB ALA 56 7.882 3.695 5.765 425 H LEU 57 H LEU 57 6.004 0.953 3.589 426 HA LEU 57 HA LEU 57 3.896 1.909 1.775 427 HB2 LEU 57 1HB LEU 57 5.276 -0.241 1.413 428 HB3 LEU 57 2HB LEU 57 4.306 -0.944 2.702 429 HG LEU 57 HG LEU 57 3.019 0.400 0.303 430 HD11 LEU 57 1HD1 LEU 57 2.803 -1.874 -0.687 431 HD12 LEU 57 2HD1 LEU 57 3.864 -2.498 0.578 432 HD13 LEU 57 3HD1 LEU 57 4.480 -1.333 -0.593 433 HD21 LEU 57 3HD2 LEU 57 1.228 -1.364 0.933 434 HD22 LEU 57 1HD2 LEU 57 1.411 0.018 2.007 435 HD23 LEU 57 2HD2 LEU 57 2.112 -1.539 2.447 436 H PHE 58 H PHE 58 2.424 2.980 2.962 437 HA PHE 58 HA PHE 58 1.532 2.056 5.529 438 HB2 PHE 58 1HB PHE 58 0.848 4.338 3.696 439 HB3 PHE 58 2HB PHE 58 -0.244 3.948 5.023 440 HD1 PHE 58 HD2 PHE 58 3.428 3.389 5.259 441 HD2 PHE 58 HD1 PHE 58 0.162 6.011 6.247 442 HE1 PHE 58 HE2 PHE 58 4.867 4.584 6.853 443 HE2 PHE 58 HE1 PHE 58 1.626 7.206 7.849 444 HZ PHE 58 HZ PHE 58 3.977 6.493 8.154 445 H LEU 59 H LEU 59 -0.316 1.101 6.090 446 HA LEU 59 HA LEU 59 -2.048 0.059 3.918 447 HB2 LEU 59 1HB LEU 59 -0.686 -1.662 5.238 448 HB3 LEU 59 2HB LEU 59 -1.668 -1.222 6.633 449 HG LEU 59 HG LEU 59 -3.699 -1.648 5.000 450 HD11 LEU 59 1HD1 LEU 59 -3.149 -3.543 3.416 451 HD12 LEU 59 2HD1 LEU 59 -1.445 -3.182 3.669 452 HD13 LEU 59 3HD1 LEU 59 -2.504 -1.979 2.932 453 HD21 LEU 59 3HD2 LEU 59 -3.517 -4.164 5.567 454 HD22 LEU 59 1HD2 LEU 59 -3.486 -3.027 6.914 455 HD23 LEU 59 2HD2 LEU 59 -1.986 -3.748 6.337 456 H TYR 60 H TYR 60 -4.015 0.789 3.944 457 HA TYR 60 HA TYR 60 -5.133 2.039 6.403 458 HB2 TYR 60 1HB TYR 60 -5.478 2.633 3.460 459 HB3 TYR 60 2HB TYR 60 -6.553 3.288 4.687 460 HD1 TYR 60 HD2 TYR 60 -5.741 4.949 6.302 461 HD2 TYR 60 HD1 TYR 60 -3.170 3.390 3.233 462 HE1 TYR 60 HE2 TYR 60 -4.137 6.795 6.707 463 HE2 TYR 60 HE1 TYR 60 -1.575 5.246 3.632 464 HH TYR 60 HH TYR 60 -1.019 6.922 5.024 465 H THR 61 H THR 61 -6.999 1.056 7.189 466 HA THR 61 HA THR 61 -8.145 -1.119 5.586 467 HB THR 61 HB THR 61 -7.839 -1.423 8.047 468 HG1 THR 61 HG1 THR 61 -10.374 -1.490 6.823 469 HG21 THR 61 3HG2 THR 61 -8.503 1.043 8.491 470 HG22 THR 61 1HG2 THR 61 -9.078 -0.182 9.620 471 HG23 THR 61 2HG2 THR 61 -10.165 0.460 8.389 472 H HIS 62 H HIS 62 -10.557 -1.183 5.380 473 HA HIS 62 HA HIS 62 -12.011 1.256 5.571 474 HB2 HIS 62 1HB HIS 62 -12.186 1.931 3.345 475 HB3 HIS 62 2HB HIS 62 -10.470 1.571 3.528 476 HD2 HIS 62 HD2 HIS 62 -9.705 -1.000 2.319 477 HE1 HIS 62 HE1 HIS 62 -13.192 -1.229 -0.047 478 HE2 HIS 62 HE2 HIS 62 -10.884 -2.224 0.338 479 H ARG 63 H ARG 63 -14.223 1.037 4.762 480 HA ARG 63 HA ARG 63 -15.115 -1.706 5.139 481 HB2 ARG 63 1HB ARG 63 -16.184 0.769 5.846 482 HB3 ARG 63 2HB ARG 63 -17.209 0.279 4.499 483 HG2 ARG 63 1HG ARG 63 -17.505 -1.941 5.604 484 HG3 ARG 63 2HG ARG 63 -16.587 -1.332 6.980 485 HD2 ARG 63 1HD ARG 63 -19.128 -0.055 5.933 486 HD3 ARG 63 2HD ARG 63 -19.072 -1.173 7.292 487 HE ARG 63 HE ARG 63 -17.227 0.870 7.806 488 HH11 ARG 63 1HH2 ARG 63 -20.637 0.426 7.375 489 HH12 ARG 63 2HH2 ARG 63 -21.076 1.731 8.425 490 HH21 ARG 63 1HH1 ARG 63 -17.798 2.576 9.177 491 HH22 ARG 63 2HH1 ARG 63 -19.469 2.949 9.445 492 H ARG 64 H ARG 64 -17.483 -1.570 3.639 493 HA ARG 64 HA ARG 64 -16.650 -2.675 1.205 494 HB2 ARG 64 1HB ARG 64 -18.854 -3.087 2.267 495 HB3 ARG 64 2HB ARG 64 -19.329 -1.434 1.873 496 HG2 ARG 64 1HG ARG 64 -19.064 -1.888 -0.512 497 HG3 ARG 64 2HG ARG 64 -18.485 -3.516 -0.160 498 HD2 ARG 64 1HD ARG 64 -20.845 -3.613 -0.763 499 HD3 ARG 64 2HD ARG 64 -20.657 -4.020 0.939 500 HE ARG 64 HE ARG 64 -21.134 -1.235 0.668 501 HH11 ARG 64 1HH2 ARG 64 -22.657 -4.329 0.372 502 HH12 ARG 64 2HH2 ARG 64 -24.239 -3.741 0.760 503 HH21 ARG 64 1HH1 ARG 64 -23.207 -0.458 1.179 504 HH22 ARG 64 2HH1 ARG 64 -24.551 -1.551 1.217 505 H MET 65 H MET 65 -17.867 0.600 1.983 506 HA MET 65 HA MET 65 -16.537 1.628 -0.422 507 HB2 MET 65 1HB MET 65 -18.713 3.002 -0.815 508 HB3 MET 65 2HB MET 65 -18.672 1.328 -1.362 509 HG2 MET 65 1HG MET 65 -19.836 0.593 0.653 510 HG3 MET 65 2HG MET 65 -19.791 2.230 1.309 511 HE1 MET 65 3HE MET 65 -22.506 2.751 1.525 512 HE2 MET 65 1HE MET 65 -22.204 1.008 1.536 513 HE3 MET 65 2HE MET 65 -23.517 1.671 0.568 514 H ALA 66 H ALA 66 -16.099 1.810 2.500 515 HA ALA 66 HA ALA 66 -16.774 4.618 3.092 516 HB1 ALA 66 3HB ALA 66 -16.260 4.155 5.339 517 HB2 ALA 66 1HB ALA 66 -15.291 2.740 4.926 518 HB3 ALA 66 2HB ALA 66 -17.048 2.682 4.770 519 H ILE 67 H ILE 67 -14.809 3.780 1.052 520 HA ILE 67 HA ILE 67 -12.153 4.308 1.978 521 HB ILE 67 HB ILE 67 -11.665 4.448 -0.474 522 HG12 ILE 67 1HG1 ILE 67 -14.661 4.003 -0.732 523 HG13 ILE 67 2HG1 ILE 67 -13.839 5.519 -1.101 524 HG21 ILE 67 1HG2 ILE 67 -11.921 2.267 0.857 525 HG22 ILE 67 2HG2 ILE 67 -12.071 2.140 -0.894 526 HG23 ILE 67 3HG2 ILE 67 -13.516 2.132 0.117 527 HD11 ILE 67 3HD1 ILE 67 -14.160 4.295 -3.171 528 HD12 ILE 67 1HD1 ILE 67 -13.425 2.851 -2.478 529 HD13 ILE 67 2HD1 ILE 67 -12.439 4.282 -2.779 530 H THR 68 H THR 68 -14.756 6.231 0.850 531 HA THR 68 HA THR 68 -13.725 8.484 -0.218 532 HB THR 68 HB THR 68 -16.128 8.038 0.216 533 HG1 THR 68 HG1 THR 68 -14.825 10.457 0.633 534 HG21 THR 68 3HG2 THR 68 -15.648 9.304 2.913 535 HG22 THR 68 1HG2 THR 68 -15.671 7.552 2.703 536 HG23 THR 68 2HG2 THR 68 -17.105 8.503 2.323 537 H GLY 69 H GLY 69 -13.080 7.576 3.132 538 HA2 GLY 69 1HA GLY 69 -11.129 8.832 4.064 539 HA3 GLY 69 2HA GLY 69 -11.990 10.299 3.606 540 H ASP 70 H ASP 70 -14.524 8.703 4.229 541 HA ASP 70 HA ASP 70 -15.124 9.834 6.690 542 HB2 ASP 70 1HB ASP 70 -16.808 9.068 5.066 543 HB3 ASP 70 2HB ASP 70 -16.384 7.395 5.427 544 H ASP 71 H ASP 71 -14.863 6.257 6.209 545 HA ASP 71 HA ASP 71 -13.864 6.167 9.024 546 HB2 ASP 71 1HB ASP 71 -16.201 5.176 8.459 547 HB3 ASP 71 2HB ASP 71 -15.306 3.914 7.658 548 H VAL 72 H VAL 72 -11.999 6.434 6.986 549 HA VAL 72 HA VAL 72 -10.611 3.830 7.197 550 HB VAL 72 HB VAL 72 -11.244 3.854 4.930 551 HG11 VAL 72 1HG1 VAL 72 -10.452 6.782 4.889 552 HG12 VAL 72 2HG1 VAL 72 -12.102 6.160 4.864 553 HG13 VAL 72 3HG1 VAL 72 -11.028 5.867 3.500 554 HG21 VAL 72 3HG2 VAL 72 -8.621 5.292 4.587 555 HG22 VAL 72 1HG2 VAL 72 -9.172 3.778 3.865 556 HG23 VAL 72 2HG2 VAL 72 -8.631 3.816 5.542 557 H SER 73 H SER 73 -8.751 4.040 8.304 558 HA SER 73 HA SER 73 -7.056 6.376 7.901 559 HB2 SER 73 1HB SER 73 -8.587 6.969 9.790 560 HB3 SER 73 2HB SER 73 -8.046 5.525 10.641 561 HG SER 73 HG SER 73 -6.593 7.846 9.936 562 H LEU 74 H LEU 74 -4.940 5.946 9.160 563 HA LEU 74 HA LEU 74 -3.695 3.746 8.255 564 HB2 LEU 74 1HB LEU 74 -3.191 5.494 10.615 565 HB3 LEU 74 2HB LEU 74 -2.223 4.026 10.494 566 HG LEU 74 HG LEU 74 -2.536 5.972 8.201 567 HD11 LEU 74 1HD1 LEU 74 -1.474 6.989 10.285 568 HD12 LEU 74 2HD1 LEU 74 -0.472 6.999 8.837 569 HD13 LEU 74 3HD1 LEU 74 -0.181 5.799 10.094 570 HD21 LEU 74 3HD2 LEU 74 -0.075 4.427 8.252 571 HD22 LEU 74 1HD2 LEU 74 -1.350 4.431 7.038 572 HD23 LEU 74 2HD2 LEU 74 -1.438 3.330 8.407 573 H ASP 75 H ASP 75 -3.536 1.682 8.547 574 HA ASP 75 HA ASP 75 -4.889 0.385 10.834 575 HB2 ASP 75 1HB ASP 75 -5.710 -0.231 8.583 576 HB3 ASP 75 2HB ASP 75 -4.083 -0.750 8.142 577 H GLN 76 H GLN 76 -2.077 -0.304 8.656 578 HA GLN 76 HA GLN 76 -0.329 -0.595 10.947 579 HB2 GLN 76 1HB GLN 76 -1.508 -2.848 10.649 580 HB3 GLN 76 2HB GLN 76 -0.634 -2.984 9.121 581 HG2 GLN 76 1HG GLN 76 1.472 -2.390 10.608 582 HG3 GLN 76 2HG GLN 76 0.449 -2.943 11.932 583 HE21 GLN 76 2HE2 GLN 76 2.802 -4.027 9.904 584 HE22 GLN 76 1HE2 GLN 76 2.373 -5.658 9.806 585 H ILE 77 H ILE 77 1.463 0.388 10.370 586 HA ILE 77 HA ILE 77 2.154 0.897 7.605 587 HB ILE 77 HB ILE 77 3.532 1.574 10.226 588 HG12 ILE 77 1HG1 ILE 77 2.034 3.362 8.287 589 HG13 ILE 77 2HG1 ILE 77 1.294 2.641 9.716 590 HG21 ILE 77 1HG2 ILE 77 5.241 1.537 8.541 591 HG22 ILE 77 2HG2 ILE 77 4.794 3.227 8.762 592 HG23 ILE 77 3HG2 ILE 77 4.194 2.328 7.365 593 HD11 ILE 77 3HD1 ILE 77 2.817 3.807 11.182 594 HD12 ILE 77 1HD1 ILE 77 2.154 4.996 10.060 595 HD13 ILE 77 2HD1 ILE 77 3.784 4.369 9.817 596 H VAL 78 H VAL 78 3.541 -0.221 6.389 597 HA VAL 78 HA VAL 78 5.190 -2.315 7.677 598 HB VAL 78 HB VAL 78 4.103 -2.265 4.861 599 HG11 VAL 78 1HG1 VAL 78 5.618 -4.367 6.447 600 HG12 VAL 78 2HG1 VAL 78 6.244 -3.466 5.068 601 HG13 VAL 78 3HG1 VAL 78 4.928 -4.615 4.843 602 HG21 VAL 78 3HG2 VAL 78 3.330 -4.069 7.166 603 HG22 VAL 78 1HG2 VAL 78 2.525 -3.910 5.606 604 HG23 VAL 78 2HG2 VAL 78 2.443 -2.597 6.780 605 HA PRO 79 HA PRO 79 8.205 0.611 5.898 606 HB2 PRO 79 1HB PRO 79 10.327 -0.020 7.461 607 HB3 PRO 79 2HB PRO 79 8.975 0.962 8.053 608 HG2 PRO 79 1HG PRO 79 9.541 -1.928 8.507 609 HG3 PRO 79 2HG PRO 79 8.933 -0.708 9.641 610 HD2 PRO 79 1HD PRO 79 7.332 -2.547 8.334 611 HD3 PRO 79 2HD PRO 79 6.739 -0.983 8.953 612 H LEU 80 H LEU 80 9.486 0.361 4.160 613 HA LEU 80 HA LEU 80 9.955 -2.210 3.082 614 HB2 LEU 80 1HB LEU 80 11.106 0.483 2.326 615 HB3 LEU 80 2HB LEU 80 11.136 -0.966 1.321 616 HG LEU 80 HG LEU 80 8.612 0.371 2.345 617 HD11 LEU 80 1HD1 LEU 80 9.721 0.378 -0.472 618 HD12 LEU 80 2HD1 LEU 80 9.975 1.699 0.669 619 HD13 LEU 80 3HD1 LEU 80 8.342 1.290 0.143 620 HD21 LEU 80 3HD2 LEU 80 9.183 -2.046 0.630 621 HD22 LEU 80 1HD2 LEU 80 7.711 -1.113 0.351 622 HD23 LEU 80 2HD2 LEU 80 7.996 -1.853 1.920 623 H SER 81 H SER 81 11.519 -3.517 3.341 624 HA SER 81 HA SER 81 14.139 -2.617 4.416 625 HB2 SER 81 1HB SER 81 12.486 -4.996 5.270 626 HB3 SER 81 2HB SER 81 14.206 -4.847 5.623 627 HG SER 81 HG SER 81 13.738 -2.895 6.696 628 H LYS 82 H LYS 82 15.887 -4.210 3.978 629 HA LYS 82 HA LYS 82 16.101 -4.750 1.266 630 HB2 LYS 82 1HB LYS 82 18.101 -5.968 1.809 631 HB3 LYS 82 2HB LYS 82 17.973 -4.608 2.924 632 HG2 LYS 82 1HG LYS 82 16.895 -6.168 4.587 633 HG3 LYS 82 2HG LYS 82 17.272 -7.501 3.495 634 HD2 LYS 82 1HD LYS 82 19.678 -6.838 3.583 635 HD3 LYS 82 2HD LYS 82 19.258 -5.636 4.806 636 HE2 LYS 82 1HE LYS 82 18.683 -8.602 5.063 637 HE3 LYS 82 2HE LYS 82 20.074 -7.794 5.788 638 HZ1 LYS 82 3HZ LYS 82 18.818 -6.897 7.384 639 HZ2 LYS 82 1HZ LYS 82 17.677 -8.084 6.974 640 HZ3 LYS 82 2HZ LYS 82 17.542 -6.518 6.327 641 H ASP 83 H ASP 83 15.101 -6.924 3.907 642 HA ASP 83 HA ASP 83 14.943 -9.264 2.326 643 HB2 ASP 83 1HB ASP 83 13.591 -8.438 4.897 644 HB3 ASP 83 2HB ASP 83 13.395 -10.038 4.185 645 H PHE 84 H PHE 84 13.169 -6.454 2.138 646 HA PHE 84 HA PHE 84 10.548 -7.426 1.581 647 HB2 PHE 84 1HB PHE 84 11.210 -5.032 2.143 648 HB3 PHE 84 2HB PHE 84 11.786 -4.900 0.484 649 HD1 PHE 84 HD2 PHE 84 10.060 -5.535 -1.397 650 HD2 PHE 84 HD1 PHE 84 8.967 -4.586 2.649 651 HE1 PHE 84 HE2 PHE 84 7.760 -4.991 -2.139 652 HE2 PHE 84 HE1 PHE 84 6.669 -4.044 1.901 653 HZ PHE 84 HZ PHE 84 6.067 -4.242 -0.494 654 H MET 85 H MET 85 9.642 -8.059 -0.319 655 HA MET 85 HA MET 85 10.837 -7.695 -2.870 656 HB2 MET 85 1HB MET 85 12.376 -9.453 -2.017 657 HB3 MET 85 2HB MET 85 10.987 -10.516 -1.774 658 HG2 MET 85 1HG MET 85 10.467 -10.445 -4.163 659 HG3 MET 85 2HG MET 85 11.772 -9.293 -4.439 660 HE1 MET 85 3HE MET 85 11.847 -12.666 -2.080 661 HE2 MET 85 1HE MET 85 11.975 -13.741 -3.477 662 HE3 MET 85 2HE MET 85 10.616 -12.627 -3.340 663 H LEU 86 H LEU 86 9.446 -8.378 -4.559 664 HA LEU 86 HA LEU 86 6.770 -9.305 -3.653 665 HB2 LEU 86 1HB LEU 86 6.166 -8.170 -5.982 666 HB3 LEU 86 2HB LEU 86 6.303 -7.204 -4.518 667 HG LEU 86 HG LEU 86 8.809 -7.660 -6.119 668 HD11 LEU 86 1HD1 LEU 86 7.443 -7.036 -7.940 669 HD12 LEU 86 2HD1 LEU 86 8.152 -5.512 -7.409 670 HD13 LEU 86 3HD1 LEU 86 6.494 -5.918 -6.964 671 HD21 LEU 86 3HD2 LEU 86 8.530 -6.346 -3.877 672 HD22 LEU 86 1HD2 LEU 86 7.813 -5.086 -4.879 673 HD23 LEU 86 2HD2 LEU 86 9.474 -5.606 -5.165 674 H GLU 87 H GLU 87 5.912 -11.106 -4.646 675 HA GLU 87 HA GLU 87 7.543 -12.346 -6.793 676 HB2 GLU 87 1HB GLU 87 5.926 -13.621 -4.576 677 HB3 GLU 87 2HB GLU 87 6.618 -14.507 -5.932 678 HG2 GLU 87 1HG GLU 87 8.866 -13.782 -5.308 679 HG3 GLU 87 2HG GLU 87 8.211 -12.805 -3.996 680 H GLU 88 H GLU 88 6.590 -12.592 -8.661 681 HA GLU 88 HA GLU 88 3.834 -11.894 -9.076 682 HB2 GLU 88 1HB GLU 88 5.907 -13.118 -10.912 683 HB3 GLU 88 2HB GLU 88 4.293 -12.637 -11.431 684 HG2 GLU 88 1HG GLU 88 4.734 -10.323 -10.751 685 HG3 GLU 88 2HG GLU 88 6.328 -10.785 -10.156 686 H VAL 89 H VAL 89 2.109 -13.277 -9.613 687 HA VAL 89 HA VAL 89 2.589 -16.190 -9.321 688 HB VAL 89 HB VAL 89 0.302 -14.683 -8.060 689 HG11 VAL 89 1HG1 VAL 89 1.108 -17.592 -8.116 690 HG12 VAL 89 2HG1 VAL 89 -0.403 -16.882 -8.683 691 HG13 VAL 89 3HG1 VAL 89 -0.047 -16.937 -6.954 692 HG21 VAL 89 3HG2 VAL 89 2.491 -14.300 -6.925 693 HG22 VAL 89 1HG2 VAL 89 2.688 -16.047 -6.776 694 HG23 VAL 89 2HG2 VAL 89 1.377 -15.232 -5.924 695 H SER 90 H SER 90 1.269 -17.500 -10.514 696 HA SER 90 HA SER 90 0.196 -16.385 -12.902 697 HB2 SER 90 1HB SER 90 0.027 -19.184 -11.781 698 HB3 SER 90 2HB SER 90 -0.474 -18.726 -13.407 699 HG SER 90 HG SER 90 1.866 -17.729 -13.242 700 HA PRO 91 HA PRO 91 -3.905 -15.656 -11.200 701 HB2 PRO 91 1HB PRO 91 -5.266 -15.115 -13.511 702 HB3 PRO 91 2HB PRO 91 -4.142 -13.963 -12.757 703 HG2 PRO 91 1HG PRO 91 -3.695 -15.811 -15.062 704 HG3 PRO 91 2HG PRO 91 -3.180 -14.127 -14.852 705 HD2 PRO 91 1HD PRO 91 -1.495 -16.248 -14.462 706 HD3 PRO 91 2HD PRO 91 -1.323 -14.712 -13.582 707 H ASP 92 H ASP 92 -3.336 -18.006 -13.745 708 HA ASP 92 HA ASP 92 -4.381 -19.971 -14.301 709 HB2 ASP 92 1HB ASP 92 -3.944 -20.401 -11.845 710 HB3 ASP 92 2HB ASP 92 -5.595 -19.870 -11.531 711 H GLY 93 H GLY 93 -5.649 -17.405 -14.823 712 HA2 GLY 93 1HA GLY 93 -8.395 -17.296 -14.341 713 HA3 GLY 93 2HA GLY 93 -7.600 -16.606 -15.758 714 H GLU 94 H GLU 94 -8.675 -17.214 -17.510 715 HA GLU 94 HA GLU 94 -8.739 -19.886 -18.380 716 HB2 GLU 94 1HB GLU 94 -11.269 -20.172 -18.328 717 HB3 GLU 94 2HB GLU 94 -10.439 -20.376 -16.790 718 HG2 GLU 94 1HG GLU 94 -10.977 -18.032 -16.194 719 HG3 GLU 94 2HG GLU 94 -11.825 -17.847 -17.729 720 H LEU 95 H LEU 95 -8.892 -16.716 -18.879 721 HA LEU 95 HA LEU 95 -8.751 -16.192 -21.383 722 HB2 LEU 95 1HB LEU 95 -10.296 -17.859 -22.165 723 HB3 LEU 95 2HB LEU 95 -11.592 -17.224 -21.135 724 HG LEU 95 HG LEU 95 -11.638 -15.170 -22.468 725 HD11 LEU 95 1HD1 LEU 95 -9.404 -14.846 -23.177 726 HD12 LEU 95 2HD1 LEU 95 -10.249 -15.287 -24.661 727 HD13 LEU 95 3HD1 LEU 95 -9.274 -16.486 -23.813 728 HD21 LEU 95 3HD2 LEU 95 -12.615 -16.152 -24.446 729 HD22 LEU 95 1HD2 LEU 95 -12.886 -17.296 -23.129 730 HD23 LEU 95 2HD2 LEU 95 -11.598 -17.587 -24.297 731 H TYR 96 H TYR 96 -8.306 -14.168 -20.583 732 HA TYR 96 HA TYR 96 -10.321 -12.228 -20.704 733 HB2 TYR 96 1HB TYR 96 -10.680 -11.594 -18.444 734 HB3 TYR 96 2HB TYR 96 -10.940 -13.320 -18.498 735 HD1 TYR 96 HD1 TYR 96 -8.300 -14.530 -18.467 736 HD2 TYR 96 HD2 TYR 96 -9.721 -11.037 -16.403 737 HE1 TYR 96 HE1 TYR 96 -6.543 -14.823 -16.760 738 HE2 TYR 96 HE2 TYR 96 -7.979 -11.343 -14.689 739 HH TYR 96 HH TYR 96 -6.366 -12.675 -13.922 740 H ILE 97 H ILE 97 -7.196 -13.175 -19.574 741 HA ILE 97 HA ILE 97 -5.125 -12.172 -19.650 742 HB ILE 97 HB ILE 97 -6.459 -10.056 -21.321 743 HG12 ILE 97 1HG1 ILE 97 -6.999 -12.258 -22.205 744 HG13 ILE 97 2HG1 ILE 97 -5.844 -11.452 -23.259 745 HG21 ILE 97 1HG2 ILE 97 -4.276 -9.656 -22.235 746 HG22 ILE 97 2HG2 ILE 97 -3.607 -11.058 -21.399 747 HG23 ILE 97 3HG2 ILE 97 -4.110 -9.642 -20.480 748 HD11 ILE 97 3HD1 ILE 97 -4.985 -13.639 -23.064 749 HD12 ILE 97 1HD1 ILE 97 -5.377 -13.737 -21.348 750 HD13 ILE 97 2HD1 ILE 97 -4.034 -12.735 -21.893 751 H LEU 98 H LEU 98 -5.969 -11.783 -17.341 752 HA LEU 98 HA LEU 98 -5.999 -10.425 -15.462 753 HB2 LEU 98 1HB LEU 98 -4.269 -8.952 -17.402 754 HB3 LEU 98 2HB LEU 98 -4.835 -8.052 -16.001 755 HG LEU 98 HG LEU 98 -3.909 -9.786 -14.511 756 HD11 LEU 98 1HD1 LEU 98 -4.039 -11.776 -15.825 757 HD12 LEU 98 2HD1 LEU 98 -2.316 -11.455 -15.620 758 HD13 LEU 98 3HD1 LEU 98 -3.114 -11.051 -17.140 759 HD21 LEU 98 3HD2 LEU 98 -1.835 -8.915 -16.537 760 HD22 LEU 98 1HD2 LEU 98 -1.597 -9.192 -14.813 761 HD23 LEU 98 2HD2 LEU 98 -2.555 -7.816 -15.361 762 H GLY 99 H GLY 99 -6.281 -7.973 -18.010 763 HA2 GLY 99 1HA GLY 99 -8.026 -6.590 -18.619 764 HA3 GLY 99 2HA GLY 99 -9.103 -7.607 -17.659 765 H SER 100 H SER 100 -8.898 -7.379 -15.286 766 HA SER 100 HA SER 100 -7.847 -4.870 -14.273 767 HB2 SER 100 1HB SER 100 -10.068 -4.190 -13.337 768 HB3 SER 100 2HB SER 100 -9.980 -4.092 -15.092 769 HG SER 100 HG SER 100 -11.227 -5.849 -15.271 770 H ASP 101 H ASP 101 -7.128 -7.471 -13.820 771 HA ASP 101 HA ASP 101 -7.591 -7.705 -10.941 772 HB2 ASP 101 1HB ASP 101 -8.287 -9.848 -12.939 773 HB3 ASP 101 2HB ASP 101 -7.860 -10.252 -11.280 774 H VAL 102 H VAL 102 -5.333 -6.834 -11.305 775 HA VAL 102 HA VAL 102 -3.355 -8.608 -12.392 776 HB VAL 102 HB VAL 102 -3.284 -5.987 -12.037 777 HG11 VAL 102 1HG1 VAL 102 -1.817 -6.851 -9.541 778 HG12 VAL 102 2HG1 VAL 102 -3.507 -6.361 -9.487 779 HG13 VAL 102 3HG1 VAL 102 -2.276 -5.226 -10.041 780 HG21 VAL 102 3HG2 VAL 102 -0.915 -7.833 -11.595 781 HG22 VAL 102 1HG2 VAL 102 -0.779 -6.119 -11.983 782 HG23 VAL 102 2HG2 VAL 102 -1.506 -7.231 -13.145 783 H THR 103 H THR 103 -1.752 -9.717 -11.225 784 HA THR 103 HA THR 103 -2.554 -10.456 -8.439 785 HB THR 103 HB THR 103 -1.033 -12.277 -10.309 786 HG1 THR 103 HG1 THR 103 -2.945 -11.926 -11.336 787 HG21 THR 103 3HG2 THR 103 -1.913 -13.989 -8.773 788 HG22 THR 103 1HG2 THR 103 -2.772 -12.741 -7.866 789 HG23 THR 103 2HG2 THR 103 -1.009 -12.763 -7.883 790 H VAL 104 H VAL 104 -1.209 -9.679 -7.009 791 HA VAL 104 HA VAL 104 1.703 -9.813 -7.487 792 HB VAL 104 HB VAL 104 0.705 -7.458 -7.738 793 HG11 VAL 104 1HG1 VAL 104 -0.877 -7.816 -5.766 794 HG12 VAL 104 2HG1 VAL 104 0.012 -6.294 -5.774 795 HG13 VAL 104 3HG1 VAL 104 0.530 -7.610 -4.721 796 HG21 VAL 104 3HG2 VAL 104 2.543 -6.447 -6.433 797 HG22 VAL 104 1HG2 VAL 104 3.094 -7.884 -7.295 798 HG23 VAL 104 2HG2 VAL 104 2.762 -7.967 -5.564 799 H GLN 105 H GLN 105 2.808 -10.692 -5.818 800 HA GLN 105 HA GLN 105 1.332 -11.235 -3.292 801 HB2 GLN 105 1HB GLN 105 1.921 -13.175 -4.952 802 HB3 GLN 105 2HB GLN 105 3.558 -12.989 -4.326 803 HG2 GLN 105 1HG GLN 105 1.083 -13.474 -2.643 804 HG3 GLN 105 2HG GLN 105 2.287 -14.691 -3.053 805 HE21 GLN 105 2HE2 GLN 105 1.437 -12.414 -0.698 806 HE22 GLN 105 1HE2 GLN 105 2.935 -12.308 0.096 807 H LEU 106 H LEU 106 2.177 -9.991 -1.660 808 HA LEU 106 HA LEU 106 4.840 -8.961 -1.830 809 HB2 LEU 106 1HB LEU 106 2.680 -8.856 0.286 810 HB3 LEU 106 2HB LEU 106 4.228 -8.031 0.436 811 HG LEU 106 HG LEU 106 2.479 -6.515 -0.392 812 HD11 LEU 106 1HD1 LEU 106 5.000 -6.607 -1.269 813 HD12 LEU 106 2HD1 LEU 106 3.840 -5.456 -1.925 814 HD13 LEU 106 3HD1 LEU 106 4.199 -6.937 -2.808 815 HD21 LEU 106 3HD2 LEU 106 1.221 -6.890 -2.334 816 HD22 LEU 106 1HD2 LEU 106 1.286 -8.495 -1.612 817 HD23 LEU 106 2HD2 LEU 106 2.351 -8.084 -2.962 818 H ASN 107 H ASN 107 6.565 -9.935 -1.151 819 HA ASN 107 HA ASN 107 6.334 -12.096 0.901 820 HB2 ASN 107 1HB ASN 107 8.563 -11.810 -1.092 821 HB3 ASN 107 2HB ASN 107 8.152 -13.206 -0.099 822 HD21 ASN 107 2HD2 ASN 107 6.653 -11.102 -2.591 823 HD22 ASN 107 1HD2 ASN 107 5.785 -12.352 -3.336 824 H THR 108 H THR 108 6.494 -9.930 2.297 825 HA THR 108 HA THR 108 9.172 -8.949 2.611 826 HB THR 108 HB THR 108 7.202 -8.640 4.834 827 HG1 THR 108 HG1 THR 108 6.733 -7.989 2.186 828 HG21 THR 108 3HG2 THR 108 9.091 -6.801 3.344 829 HG22 THR 108 1HG2 THR 108 9.221 -7.364 5.009 830 HG23 THR 108 2HG2 THR 108 7.949 -6.233 4.556 831 H ALA 109 H ALA 109 10.034 -8.970 4.974 832 HA ALA 109 HA ALA 109 10.951 -11.560 5.498 833 HB1 ALA 109 3HB ALA 109 10.960 -9.000 7.073 834 HB2 ALA 109 1HB ALA 109 12.304 -9.813 6.273 835 HB3 ALA 109 2HB ALA 109 11.628 -10.482 7.756 836 H GLU 110 H GLU 110 8.326 -9.718 7.075 837 HA GLU 110 HA GLU 110 7.392 -12.257 8.299 838 HB2 GLU 110 1HB GLU 110 6.921 -11.143 10.371 839 HB3 GLU 110 2HB GLU 110 8.596 -10.778 9.956 840 HG2 GLU 110 1HG GLU 110 7.760 -8.637 8.888 841 HG3 GLU 110 2HG GLU 110 6.180 -8.978 9.594 842 H LEU 111 H LEU 111 6.632 -10.601 5.911 843 HA LEU 111 HA LEU 111 3.763 -10.416 6.559 844 HB2 LEU 111 1HB LEU 111 5.105 -8.129 6.503 845 HB3 LEU 111 2HB LEU 111 4.962 -8.332 4.764 846 HG LEU 111 HG LEU 111 2.616 -8.397 6.680 847 HD11 LEU 111 1HD1 LEU 111 3.176 -6.162 4.737 848 HD12 LEU 111 2HD1 LEU 111 3.939 -6.155 6.329 849 HD13 LEU 111 3HD1 LEU 111 2.184 -6.150 6.194 850 HD21 LEU 111 3HD2 LEU 111 2.923 -8.668 3.695 851 HD22 LEU 111 1HD2 LEU 111 1.469 -7.902 4.336 852 HD23 LEU 111 2HD2 LEU 111 1.868 -9.552 4.797 853 H LYS 112 H LYS 112 2.579 -11.430 5.151 854 HA LYS 112 HA LYS 112 3.428 -11.728 2.388 855 HB2 LYS 112 1HB LYS 112 4.345 -13.709 3.666 856 HB3 LYS 112 2HB LYS 112 2.670 -14.180 3.966 857 HG2 LYS 112 1HG LYS 112 2.235 -14.289 1.562 858 HG3 LYS 112 2HG LYS 112 3.869 -13.721 1.217 859 HD2 LYS 112 1HD LYS 112 4.797 -15.721 2.327 860 HD3 LYS 112 2HD LYS 112 3.161 -16.296 2.652 861 HE2 LYS 112 1HE LYS 112 2.699 -16.350 0.225 862 HE3 LYS 112 2HE LYS 112 4.342 -15.790 -0.097 863 HZ1 LYS 112 3HZ LYS 112 4.951 -17.825 1.389 864 HZ2 LYS 112 1HZ LYS 112 4.608 -18.040 -0.259 865 HZ3 LYS 112 2HZ LYS 112 3.422 -18.390 0.907 866 H LEU 113 H LEU 113 1.789 -10.956 1.308 867 HA LEU 113 HA LEU 113 -0.920 -11.979 1.901 868 HB2 LEU 113 1HB LEU 113 -0.037 -9.114 1.975 869 HB3 LEU 113 2HB LEU 113 -1.689 -9.501 1.504 870 HG LEU 113 HG LEU 113 -0.376 -10.416 4.079 871 HD11 LEU 113 1HD1 LEU 113 -0.803 -7.879 3.782 872 HD12 LEU 113 2HD1 LEU 113 -1.463 -8.653 5.221 873 HD13 LEU 113 3HD1 LEU 113 -2.517 -8.302 3.853 874 HD21 LEU 113 3HD2 LEU 113 -3.032 -10.591 4.560 875 HD22 LEU 113 1HD2 LEU 113 -2.115 -11.923 3.865 876 HD23 LEU 113 2HD2 LEU 113 -3.057 -10.860 2.818 877 H VAL 114 H VAL 114 -2.468 -11.535 0.185 878 HA VAL 114 HA VAL 114 -1.176 -11.248 -2.481 879 HB VAL 114 HB VAL 114 -3.703 -12.842 -2.055 880 HG11 VAL 114 1HG1 VAL 114 -2.894 -14.006 -4.061 881 HG12 VAL 114 2HG1 VAL 114 -1.406 -13.058 -4.029 882 HG13 VAL 114 3HG1 VAL 114 -2.951 -12.267 -4.346 883 HG21 VAL 114 3HG2 VAL 114 -2.054 -14.865 -1.994 884 HG22 VAL 114 1HG2 VAL 114 -2.353 -13.974 -0.502 885 HG23 VAL 114 2HG2 VAL 114 -0.878 -13.686 -1.420 886 H PHE 115 H PHE 115 -1.851 -9.439 -3.473 887 HA PHE 115 HA PHE 115 -4.558 -8.397 -2.910 888 HB2 PHE 115 1HB PHE 115 -1.999 -6.941 -3.606 889 HB3 PHE 115 2HB PHE 115 -3.589 -6.179 -3.605 890 HD1 PHE 115 HD2 PHE 115 -4.852 -5.875 -1.493 891 HD2 PHE 115 HD1 PHE 115 -0.905 -7.581 -1.546 892 HE1 PHE 115 HE2 PHE 115 -4.671 -5.555 0.960 893 HE2 PHE 115 HE1 PHE 115 -0.730 -7.237 0.897 894 HZ PHE 115 HZ PHE 115 -2.609 -6.241 2.157 895 H GLN 116 H GLN 116 -5.881 -8.040 -4.532 896 HA GLN 116 HA GLN 116 -4.978 -8.511 -7.302 897 HB2 GLN 116 1HB GLN 116 -7.603 -9.008 -5.929 898 HB3 GLN 116 2HB GLN 116 -7.510 -8.888 -7.676 899 HG2 GLN 116 1HG GLN 116 -5.655 -10.725 -6.163 900 HG3 GLN 116 2HG GLN 116 -7.293 -11.239 -6.558 901 HE21 GLN 116 2HE2 GLN 116 -6.248 -9.087 -8.956 902 HE22 GLN 116 1HE2 GLN 116 -5.710 -10.225 -10.089 903 H LEU 117 H LEU 117 -4.347 -6.385 -7.758 904 HA LEU 117 HA LEU 117 -6.311 -4.225 -7.407 905 HB2 LEU 117 1HB LEU 117 -3.435 -4.186 -8.365 906 HB3 LEU 117 2HB LEU 117 -4.410 -2.765 -8.041 907 HG LEU 117 HG LEU 117 -4.106 -4.829 -5.864 908 HD11 LEU 117 1HD1 LEU 117 -2.076 -3.592 -5.068 909 HD12 LEU 117 2HD1 LEU 117 -2.029 -2.753 -6.619 910 HD13 LEU 117 3HD1 LEU 117 -1.806 -4.502 -6.555 911 HD21 LEU 117 3HD2 LEU 117 -4.372 -2.887 -4.430 912 HD22 LEU 117 1HD2 LEU 117 -5.621 -2.836 -5.668 913 HD23 LEU 117 2HD2 LEU 117 -4.212 -1.799 -5.808 914 HA PRO 118 HA PRO 118 -7.586 -4.405 -11.657 915 HB2 PRO 118 1HB PRO 118 -8.111 -1.768 -12.219 916 HB3 PRO 118 2HB PRO 118 -9.162 -2.779 -11.207 917 HG2 PRO 118 1HG PRO 118 -7.049 -0.837 -10.381 918 HG3 PRO 118 2HG PRO 118 -8.688 -1.053 -9.734 919 HD2 PRO 118 1HD PRO 118 -6.536 -2.071 -8.465 920 HD3 PRO 118 2HD PRO 118 -8.086 -2.937 -8.481 921 H PHE 119 H PHE 119 -6.179 -4.905 -13.209 922 HA PHE 119 HA PHE 119 -3.632 -4.267 -13.602 923 HB2 PHE 119 1HB PHE 119 -4.822 -5.952 -14.885 924 HB3 PHE 119 2HB PHE 119 -5.707 -4.695 -15.745 925 HD1 PHE 119 HD1 PHE 119 -2.156 -5.563 -14.889 926 HD2 PHE 119 HD2 PHE 119 -4.891 -4.068 -17.846 927 HE1 PHE 119 HE1 PHE 119 -0.297 -5.387 -16.519 928 HE2 PHE 119 HE2 PHE 119 -3.027 -3.889 -19.477 929 HZ PHE 119 HZ PHE 119 -0.732 -4.550 -18.811 930 H GLY 120 H GLY 120 -2.384 -2.918 -14.759 931 HA2 GLY 120 1HA GLY 120 -1.684 -0.773 -15.272 932 HA3 GLY 120 2HA GLY 120 -2.833 -1.000 -16.577 933 H SER 121 H SER 121 -3.594 1.070 -16.717 934 HA SER 121 HA SER 121 -4.854 2.914 -16.197 935 HB2 SER 121 1HB SER 121 -6.053 1.101 -14.094 936 HB3 SER 121 2HB SER 121 -6.787 2.545 -14.780 937 HG SER 121 HG SER 121 -6.096 1.052 -16.810 938 H HIS 122 H HIS 122 -5.634 2.457 -12.999 939 HA HIS 122 HA HIS 122 -3.750 4.509 -12.152 940 HB2 HIS 122 1HB HIS 122 -6.207 4.528 -11.569 941 HB3 HIS 122 2HB HIS 122 -5.896 3.149 -10.515 942 HD2 HIS 122 HD2 HIS 122 -5.655 4.168 -7.971 943 HE1 HIS 122 HE1 HIS 122 -3.469 7.657 -8.902 944 HE2 HIS 122 HE2 HIS 122 -4.471 6.289 -7.012 945 H THR 123 H THR 123 -3.787 1.130 -12.200 946 HA THR 123 HA THR 123 -2.439 0.678 -9.693 947 HB THR 123 HB THR 123 -2.845 -1.124 -12.087 948 HG1 THR 123 HG1 THR 123 -4.465 -1.955 -10.851 949 HG21 THR 123 3HG2 THR 123 -2.263 -2.901 -10.319 950 HG22 THR 123 1HG2 THR 123 -1.589 -1.573 -9.375 951 HG23 THR 123 2HG2 THR 123 -0.921 -1.955 -10.963 952 H ARG 124 H ARG 124 -1.462 1.035 -13.087 953 HA ARG 124 HA ARG 124 1.159 0.123 -12.888 954 HB2 ARG 124 1HB ARG 124 0.015 0.696 -15.009 955 HB3 ARG 124 2HB ARG 124 0.125 2.398 -14.593 956 HG2 ARG 124 1HG ARG 124 2.597 2.196 -14.524 957 HG3 ARG 124 2HG ARG 124 2.450 0.502 -14.996 958 HD2 ARG 124 1HD ARG 124 1.374 2.825 -16.611 959 HD3 ARG 124 2HD ARG 124 2.919 2.040 -16.920 960 HE ARG 124 HE ARG 124 0.279 0.967 -17.506 961 HH11 ARG 124 1HH2 ARG 124 3.651 0.369 -17.018 962 HH12 ARG 124 2HH2 ARG 124 3.658 -1.119 -17.905 963 HH21 ARG 124 1HH1 ARG 124 0.282 -0.985 -18.676 964 HH22 ARG 124 2HH1 ARG 124 1.751 -1.885 -18.843 965 H THR 125 H THR 125 -0.168 3.339 -12.256 966 HA THR 125 HA THR 125 2.220 4.727 -11.919 967 HB THR 125 HB THR 125 -0.400 5.078 -10.436 968 HG1 THR 125 HG1 THR 125 -0.834 5.459 -12.504 969 HG21 THR 125 3HG2 THR 125 0.475 7.455 -10.228 970 HG22 THR 125 1HG2 THR 125 2.049 6.825 -10.713 971 HG23 THR 125 2HG2 THR 125 1.291 6.253 -9.227 972 H PHE 126 H PHE 126 0.346 2.822 -9.607 973 HA PHE 126 HA PHE 126 1.859 3.329 -7.310 974 HB2 PHE 126 1HB PHE 126 -0.312 2.164 -7.287 975 HB3 PHE 126 2HB PHE 126 0.435 0.764 -8.058 976 HD1 PHE 126 HD1 PHE 126 0.761 2.994 -5.069 977 HD2 PHE 126 HD2 PHE 126 1.437 -0.907 -6.727 978 HE1 PHE 126 HE1 PHE 126 1.481 2.174 -2.846 979 HE2 PHE 126 HE2 PHE 126 2.160 -1.728 -4.504 980 HZ PHE 126 HZ PHE 126 2.183 -0.187 -2.561 981 H LEU 127 H LEU 127 2.221 0.616 -9.651 982 HA LEU 127 HA LEU 127 4.255 -0.751 -8.460 983 HB2 LEU 127 1HB LEU 127 4.183 -0.146 -11.422 984 HB3 LEU 127 2HB LEU 127 4.875 -1.563 -10.640 985 HG LEU 127 HG LEU 127 1.945 -0.805 -10.674 986 HD11 LEU 127 1HD1 LEU 127 2.764 -1.629 -12.835 987 HD12 LEU 127 2HD1 LEU 127 1.734 -2.842 -12.077 988 HD13 LEU 127 3HD1 LEU 127 3.488 -3.028 -12.045 989 HD21 LEU 127 3HD2 LEU 127 2.276 -1.962 -8.633 990 HD22 LEU 127 1HD2 LEU 127 3.506 -3.019 -9.326 991 HD23 LEU 127 2HD2 LEU 127 1.807 -3.240 -9.746 992 H GLN 128 H GLN 128 4.702 1.952 -10.780 993 HA GLN 128 HA GLN 128 7.480 1.970 -10.683 994 HB2 GLN 128 1HB GLN 128 5.728 4.384 -11.131 995 HB3 GLN 128 2HB GLN 128 7.311 4.040 -11.830 996 HG2 GLN 128 1HG GLN 128 4.729 2.575 -12.388 997 HG3 GLN 128 2HG GLN 128 5.628 3.568 -13.510 998 HE21 GLN 128 2HE2 GLN 128 4.924 0.526 -13.380 999 HE22 GLN 128 1HE2 GLN 128 6.416 -0.219 -13.693 1000 H GLU 129 H GLU 129 5.116 3.754 -8.695 1001 HA GLU 129 HA GLU 129 6.990 5.413 -7.397 1002 HB2 GLU 129 1HB GLU 129 4.300 4.374 -6.474 1003 HB3 GLU 129 2HB GLU 129 5.229 5.595 -5.610 1004 HG2 GLU 129 1HG GLU 129 4.351 5.854 -8.497 1005 HG3 GLU 129 2HG GLU 129 3.497 6.569 -7.132 1006 H VAL 130 H VAL 130 5.803 2.161 -6.587 1007 HA VAL 130 HA VAL 130 7.109 2.020 -4.065 1008 HB VAL 130 HB VAL 130 6.151 -0.129 -5.971 1009 HG11 VAL 130 1HG1 VAL 130 7.314 -0.285 -3.187 1010 HG12 VAL 130 2HG1 VAL 130 7.778 -1.206 -4.618 1011 HG13 VAL 130 3HG1 VAL 130 6.242 -1.536 -3.818 1012 HG21 VAL 130 3HG2 VAL 130 4.999 1.208 -3.507 1013 HG22 VAL 130 1HG2 VAL 130 4.372 -0.309 -4.147 1014 HG23 VAL 130 2HG2 VAL 130 4.311 1.154 -5.130 1015 H ALA 131 H ALA 131 7.975 0.851 -7.284 1016 HA ALA 131 HA ALA 131 10.412 -0.364 -6.655 1017 HB1 ALA 131 3HB ALA 131 9.196 -0.523 -8.844 1018 HB2 ALA 131 1HB ALA 131 10.933 -0.259 -8.995 1019 HB3 ALA 131 2HB ALA 131 9.814 1.081 -9.238 1020 H ARG 132 H ARG 132 9.849 2.995 -7.718 1021 HA ARG 132 HA ARG 132 12.580 3.752 -7.659 1022 HB2 ARG 132 1HB ARG 132 10.102 5.475 -7.375 1023 HB3 ARG 132 2HB ARG 132 11.719 6.058 -7.760 1024 HG2 ARG 132 1HG ARG 132 10.401 3.945 -9.464 1025 HG3 ARG 132 2HG ARG 132 10.054 5.650 -9.721 1026 HD2 ARG 132 1HD ARG 132 12.486 6.076 -9.982 1027 HD3 ARG 132 2HD ARG 132 12.795 4.356 -9.815 1028 HE ARG 132 HE ARG 132 11.589 5.685 -12.116 1029 HH11 ARG 132 1HH2 ARG 132 12.345 2.750 -10.435 1030 HH12 ARG 132 2HH2 ARG 132 12.198 1.750 -11.840 1031 HH21 ARG 132 1HH1 ARG 132 11.392 4.377 -13.953 1032 HH22 ARG 132 2HH1 ARG 132 11.656 2.670 -13.831 1033 H ALA 133 H ALA 133 10.240 3.308 -5.206 1034 HA ALA 133 HA ALA 133 11.254 5.075 -3.245 1035 HB1 ALA 133 3HB ALA 133 9.877 2.473 -2.636 1036 HB2 ALA 133 1HB ALA 133 9.003 3.851 -3.308 1037 HB3 ALA 133 2HB ALA 133 9.806 3.990 -1.745 1038 H CYS 134 H CYS 134 12.130 1.772 -4.137 1039 HA CYS 134 HA CYS 134 14.719 1.848 -3.260 1040 HB2 CYS 134 1HB CYS 134 14.399 2.148 -1.001 1041 HB3 CYS 134 2HB CYS 134 12.855 1.320 -0.988 1042 HG CYS 134 HG CYS 134 14.042 -0.925 -0.756 1043 HA PRO 135 HA PRO 135 13.621 -2.791 -3.672 1044 HB2 PRO 135 1HB PRO 135 11.031 -3.567 -3.992 1045 HB3 PRO 135 2HB PRO 135 11.747 -3.303 -2.396 1046 HG2 PRO 135 1HG PRO 135 10.030 -1.464 -4.020 1047 HG3 PRO 135 2HG PRO 135 9.922 -1.871 -2.292 1048 HD2 PRO 135 1HD PRO 135 11.106 0.416 -3.170 1049 HD3 PRO 135 2HD PRO 135 11.644 -0.429 -1.707 1050 H GLY 136 H GLY 136 14.048 -0.841 -5.691 1051 HA2 GLY 136 1HA GLY 136 12.533 -1.854 -8.025 1052 HA3 GLY 136 2HA GLY 136 13.414 -0.333 -7.962 1053 H PHE 137 H PHE 137 13.556 -3.665 -8.728 1054 HA PHE 137 HA PHE 137 15.293 -5.092 -9.284 1055 HB2 PHE 137 1HB PHE 137 15.767 -2.643 -10.994 1056 HB3 PHE 137 2HB PHE 137 16.416 -4.249 -11.326 1057 HD1 PHE 137 HD1 PHE 137 13.340 -2.210 -11.118 1058 HD2 PHE 137 HD2 PHE 137 14.987 -6.052 -12.116 1059 HE1 PHE 137 HE1 PHE 137 11.210 -2.837 -12.227 1060 HE2 PHE 137 HE2 PHE 137 12.856 -6.678 -13.223 1061 HZ PHE 137 HZ PHE 137 10.968 -5.071 -13.278 1062 H ASP 138 H ASP 138 16.402 -4.971 -7.179 1063 HA ASP 138 HA ASP 138 19.158 -4.021 -7.527 1064 HB2 ASP 138 1HB ASP 138 17.272 -3.161 -5.332 1065 HB3 ASP 138 2HB ASP 138 19.012 -3.203 -5.063 1066 HA PRO 139 HA PRO 139 19.979 -7.987 -5.764 1067 HB2 PRO 139 1HB PRO 139 22.344 -7.577 -4.416 1068 HB3 PRO 139 2HB PRO 139 22.228 -7.674 -6.183 1069 HG2 PRO 139 1HG PRO 139 22.353 -5.256 -4.430 1070 HG3 PRO 139 2HG PRO 139 23.199 -5.584 -5.956 1071 HD2 PRO 139 1HD PRO 139 20.993 -4.017 -5.872 1072 HD3 PRO 139 2HD PRO 139 21.332 -5.067 -7.261 1073 H GLU 140 H GLU 140 20.692 -5.443 -3.358 1074 HA GLU 140 HA GLU 140 19.098 -6.955 -1.368 1075 HB2 GLU 140 1HB GLU 140 21.863 -5.792 -0.960 1076 HB3 GLU 140 2HB GLU 140 20.826 -6.395 0.335 1077 HG2 GLU 140 1HG GLU 140 20.765 -8.611 -0.700 1078 HG3 GLU 140 2HG GLU 140 21.738 -8.026 -2.049 1079 H THR 141 H THR 141 20.183 -3.940 -2.684 1080 HA THR 141 HA THR 141 19.805 -1.730 -2.043 1081 HB THR 141 HB THR 141 17.947 -1.974 -3.429 1082 HG1 THR 141 HG1 THR 141 17.407 -0.314 -2.161 1083 HG21 THR 141 3HG2 THR 141 16.748 -3.759 -1.299 1084 HG22 THR 141 1HG2 THR 141 17.379 -4.277 -2.862 1085 HG23 THR 141 2HG2 THR 141 15.929 -3.280 -2.779 1086 H ARG 142 H ARG 142 20.838 -2.545 0.176 1087 HA ARG 142 HA ARG 142 19.047 -2.594 2.419 1088 HB2 ARG 142 1HB ARG 142 22.045 -2.237 2.274 1089 HB3 ARG 142 2HB ARG 142 21.125 -2.454 3.765 1090 HG2 ARG 142 1HG ARG 142 20.284 -4.616 2.929 1091 HG3 ARG 142 2HG ARG 142 21.219 -4.400 1.451 1092 HD2 ARG 142 1HD ARG 142 23.295 -4.338 2.776 1093 HD3 ARG 142 2HD ARG 142 22.358 -4.560 4.251 1094 HE ARG 142 HE ARG 142 21.868 -6.619 2.298 1095 HH11 ARG 142 1HH2 ARG 142 23.956 -5.486 4.810 1096 HH12 ARG 142 2HH2 ARG 142 24.545 -7.063 5.221 1097 HH21 ARG 142 1HH1 ARG 142 22.628 -8.687 2.830 1098 HH22 ARG 142 2HH1 ARG 142 23.791 -8.877 4.098 1099 H ASP 143 H ASP 143 18.637 -1.051 3.892 1100 HA ASP 143 HA ASP 143 19.780 1.341 4.442 1101 HB2 ASP 143 1HB ASP 143 18.169 2.892 3.062 1102 HB3 ASP 143 2HB ASP 143 19.624 2.273 2.306 1103 HA PRO 144 HA PRO 144 15.439 0.366 6.194 1104 HB2 PRO 144 1HB PRO 144 16.036 -1.220 8.326 1105 HB3 PRO 144 2HB PRO 144 15.698 -1.878 6.719 1106 HG2 PRO 144 1HG PRO 144 18.329 -1.371 8.043 1107 HG3 PRO 144 2HG PRO 144 17.784 -2.792 7.118 1108 HD2 PRO 144 1HD PRO 144 19.346 -0.862 5.981 1109 HD3 PRO 144 2HD PRO 144 18.107 -1.761 5.069 1110 H GLU 145 H GLU 145 14.627 1.543 7.872 1111 HA GLU 145 HA GLU 145 16.342 2.617 9.955 1112 HB2 GLU 145 1HB GLU 145 15.058 4.444 7.902 1113 HB3 GLU 145 2HB GLU 145 15.666 4.991 9.462 1114 HG2 GLU 145 1HG GLU 145 17.332 3.635 7.318 1115 HG3 GLU 145 2HG GLU 145 17.320 5.354 7.665 1116 H PHE 146 H PHE 146 13.204 3.143 8.335 1117 HA PHE 146 HA PHE 146 11.103 3.505 9.228 1118 HB2 PHE 146 1HB PHE 146 10.457 1.677 10.872 1119 HB3 PHE 146 2HB PHE 146 11.102 1.125 9.329 1120 HD1 PHE 146 HD2 PHE 146 11.880 1.636 12.915 1121 HD2 PHE 146 HD1 PHE 146 13.234 0.009 9.177 1122 HE1 PHE 146 HE2 PHE 146 13.720 0.457 14.089 1123 HE2 PHE 146 HE1 PHE 146 15.064 -1.165 10.360 1124 HZ PHE 146 HZ PHE 146 15.324 -0.943 12.794 1125 H GLU 147 H GLU 147 13.629 4.590 10.730 1126 HA GLU 147 HA GLU 147 12.929 4.873 13.447 1127 HB2 GLU 147 1HB GLU 147 15.220 5.137 12.453 1128 HB3 GLU 147 2HB GLU 147 14.705 6.700 11.821 1129 HG2 GLU 147 1HG GLU 147 15.813 7.121 13.909 1130 HG3 GLU 147 2HG GLU 147 14.089 7.344 14.192 1131 H TRP 148 H TRP 148 12.283 6.910 10.626 1132 HA TRP 148 HA TRP 148 11.223 9.066 12.198 1133 HB2 TRP 148 1HB TRP 148 10.564 10.038 10.044 1134 HB3 TRP 148 2HB TRP 148 12.241 9.496 10.016 1135 HD1 TRP 148 HD1 TRP 148 12.702 7.077 8.824 1136 HE1 TRP 148 HE1 TRP 148 11.510 5.993 6.812 1137 HE3 TRP 148 HE3 TRP 148 8.381 9.811 8.769 1138 HZ2 TRP 148 HZ2 TRP 148 9.061 6.251 5.368 1139 HZ3 TRP 148 HZ3 TRP 148 6.639 9.367 7.063 1140 HH2 TRP 148 HH2 TRP 148 6.972 7.592 5.364 1141 H LEU 149 H LEU 149 9.963 6.077 11.060 1142 HA LEU 149 HA LEU 149 7.221 6.849 10.821 1143 HB2 LEU 149 1HB LEU 149 8.447 4.143 11.387 1144 HB3 LEU 149 2HB LEU 149 6.751 4.416 10.997 1145 HG LEU 149 HG LEU 149 9.052 5.228 9.191 1146 HD11 LEU 149 1HD1 LEU 149 8.726 2.705 9.596 1147 HD12 LEU 149 2HD1 LEU 149 8.686 3.260 7.922 1148 HD13 LEU 149 3HD1 LEU 149 7.182 2.893 8.766 1149 HD21 LEU 149 3HD2 LEU 149 7.203 6.546 8.556 1150 HD22 LEU 149 1HD2 LEU 149 6.040 5.283 8.958 1151 HD23 LEU 149 2HD2 LEU 149 7.037 5.141 7.509 1152 H SER 150 H SER 150 9.295 5.975 13.492 1153 HA SER 150 HA SER 150 7.525 5.187 15.452 1154 HB2 SER 150 1HB SER 150 9.946 6.986 15.667 1155 HB3 SER 150 2HB SER 150 9.117 6.282 17.051 1156 HG SER 150 HG SER 150 10.661 5.076 15.055 1157 H ARG 151 H ARG 151 8.004 8.315 14.024 1158 HA ARG 151 HA ARG 151 6.761 9.959 15.957 1159 HB2 ARG 151 1HB ARG 151 7.207 10.103 12.994 1160 HB3 ARG 151 2HB ARG 151 6.095 11.254 13.711 1161 HG2 ARG 151 1HG ARG 151 8.263 12.280 13.674 1162 HG3 ARG 151 2HG ARG 151 7.917 11.866 15.350 1163 HD2 ARG 151 1HD ARG 151 9.248 9.793 15.100 1164 HD3 ARG 151 2HD ARG 151 9.610 10.236 13.432 1165 HE ARG 151 HE ARG 151 10.733 11.444 15.837 1166 HH11 ARG 151 1HH2 ARG 151 10.174 11.622 12.427 1167 HH12 ARG 151 2HH2 ARG 151 11.471 12.729 12.132 1168 HH21 ARG 151 1HH1 ARG 151 12.430 12.907 15.460 1169 HH22 ARG 151 2HH1 ARG 151 12.749 13.458 13.849 1170 H HIS 152 H HIS 152 5.528 8.019 13.308 1171 HA HIS 152 HA HIS 152 2.788 8.781 13.725 1172 HB2 HIS 152 1HB HIS 152 4.067 6.549 12.124 1173 HB3 HIS 152 2HB HIS 152 2.338 6.900 12.129 1174 HD2 HIS 152 HD2 HIS 152 5.684 8.609 10.885 1175 HE1 HIS 152 HE1 HIS 152 2.412 10.626 9.141 1176 HE2 HIS 152 HE2 HIS 152 4.944 10.435 9.172 1177 H THR 153 H THR 153 1.190 7.557 14.661 1178 HA THR 153 HA THR 153 2.032 5.220 16.288 1179 HB THR 153 HB THR 153 1.709 7.273 17.710 1180 HG1 THR 153 HG1 THR 153 0.434 6.150 19.185 1181 HG21 THR 153 3HG2 THR 153 -0.374 8.333 17.903 1182 HG22 THR 153 1HG2 THR 153 -1.235 6.984 17.162 1183 HG23 THR 153 2HG2 THR 153 -0.251 8.057 16.166 1184 H CYS 154 H CYS 154 0.245 6.360 13.819 1185 HA CYS 154 HA CYS 154 -1.500 5.534 12.582 1186 HB2 CYS 154 1HB CYS 154 -1.302 3.062 14.309 1187 HB3 CYS 154 2HB CYS 154 -1.914 3.182 12.660 1188 HG CYS 154 HG CYS 154 0.522 2.376 12.399 1189 H ALA 155 H ALA 155 -3.772 5.243 12.649 1190 HA ALA 155 HA ALA 155 -4.968 5.999 15.243 1191 HB1 ALA 155 3HB ALA 155 -5.307 7.364 13.078 1192 HB2 ALA 155 1HB ALA 155 -6.736 6.971 14.031 1193 HB3 ALA 155 2HB ALA 155 -6.368 6.049 12.573 1194 H GLU 156 H GLU 156 -4.958 3.860 16.131 1195 HA GLU 156 HA GLU 156 -5.818 1.498 15.094 1196 HB2 GLU 156 1HB GLU 156 -6.395 2.687 17.815 1197 HB3 GLU 156 2HB GLU 156 -6.778 1.017 17.402 1198 HG2 GLU 156 1HG GLU 156 -4.012 2.172 17.017 1199 HG3 GLU 156 2HG GLU 156 -4.510 1.423 18.531 1200 HA PRO 157 HA PRO 157 -10.016 2.122 13.790 1201 HB2 PRO 157 1HB PRO 157 -11.085 -0.380 14.077 1202 HB3 PRO 157 2HB PRO 157 -9.907 0.022 12.809 1203 HG2 PRO 157 1HG PRO 157 -9.434 -1.259 15.476 1204 HG3 PRO 157 2HG PRO 157 -8.835 -1.749 13.878 1205 HD2 PRO 157 1HD PRO 157 -7.267 -0.354 15.572 1206 HD3 PRO 157 2HD PRO 157 -7.214 -0.055 13.818 1207 H ASP 158 H ASP 158 -12.370 1.399 14.565 1208 HA ASP 158 HA ASP 158 -12.559 1.649 17.511 1209 HB2 ASP 158 1HB ASP 158 -12.878 3.865 16.401 1210 HB3 ASP 158 2HB ASP 158 -14.241 3.182 15.518 1211 H ALA 159 H ALA 159 -12.756 -0.778 16.407 1212 HA ALA 159 HA ALA 159 -15.275 -1.566 15.427 1213 HB1 ALA 159 3HB ALA 159 -13.358 -3.217 17.090 1214 HB2 ALA 159 1HB ALA 159 -13.196 -2.949 15.352 1215 HB3 ALA 159 2HB ALA 159 -14.592 -3.822 15.985 1216 H GLU 160 H GLU 160 -14.048 -1.131 18.701 1217 HA GLU 160 HA GLU 160 -16.176 -2.391 20.077 1218 HB2 GLU 160 1HB GLU 160 -14.270 -0.199 20.916 1219 HB3 GLU 160 2HB GLU 160 -15.393 -1.000 22.015 1220 HG2 GLU 160 1HG GLU 160 -14.363 -3.159 21.574 1221 HG3 GLU 160 2HG GLU 160 -13.312 -2.445 20.351 1222 H SER 161 H SER 161 -15.688 0.940 18.960 1223 HA SER 161 HA SER 161 -17.095 2.755 18.907 1224 HB2 SER 161 1HB SER 161 -18.217 1.023 17.375 1225 HB3 SER 161 2HB SER 161 -19.343 0.760 18.701 1226 HG SER 161 HG SER 161 -20.116 2.368 17.308 Start of MODEL 6 1 H1 GLY 1 1H GLY 1 -24.912 12.626 -16.305 2 H2 GLY 1 2H GLY 1 -24.087 11.470 -15.371 3 H3 GLY 1 3H GLY 1 -23.259 12.350 -16.566 4 HA2 GLY 1 1HA GLY 1 -22.780 13.964 -15.151 5 HA3 GLY 1 2HA GLY 1 -24.492 14.144 -14.769 6 HA PRO 2 HA PRO 2 -23.152 10.691 -11.724 7 HB2 PRO 2 1HB PRO 2 -20.543 9.796 -11.865 8 HB3 PRO 2 2HB PRO 2 -21.883 9.060 -12.767 9 HG2 PRO 2 1HG PRO 2 -19.842 11.037 -13.698 10 HG3 PRO 2 2HG PRO 2 -20.478 9.602 -14.526 11 HD2 PRO 2 1HD PRO 2 -21.356 12.099 -15.125 12 HD3 PRO 2 2HD PRO 2 -22.436 10.687 -15.192 13 H LEU 3 H LEU 3 -22.506 11.124 -9.640 14 HA LEU 3 HA LEU 3 -20.514 13.280 -9.208 15 HB2 LEU 3 1HB LEU 3 -23.185 12.938 -7.815 16 HB3 LEU 3 2HB LEU 3 -21.950 14.113 -7.361 17 HG LEU 3 HG LEU 3 -23.236 13.962 -10.105 18 HD11 LEU 3 1HD1 LEU 3 -24.928 14.627 -8.522 19 HD12 LEU 3 2HD1 LEU 3 -24.385 16.080 -9.360 20 HD13 LEU 3 3HD1 LEU 3 -23.820 15.742 -7.724 21 HD21 LEU 3 3HD2 LEU 3 -22.249 16.434 -10.023 22 HD22 LEU 3 1HD2 LEU 3 -21.219 15.078 -10.467 23 HD23 LEU 3 2HD2 LEU 3 -21.156 15.731 -8.833 24 H GLY 4 H GLY 4 -19.364 13.190 -7.243 25 HA2 GLY 4 1HA GLY 4 -18.652 12.222 -5.221 26 HA3 GLY 4 2HA GLY 4 -19.688 10.833 -5.530 27 H SER 5 H SER 5 -17.233 12.335 -7.608 28 HA SER 5 HA SER 5 -16.139 9.869 -8.442 29 HB2 SER 5 1HB SER 5 -15.914 11.916 -9.766 30 HB3 SER 5 2HB SER 5 -14.906 12.628 -8.509 31 HG SER 5 HG SER 5 -13.520 10.728 -8.844 32 H MET 6 H MET 6 -15.006 12.236 -6.110 33 HA MET 6 HA MET 6 -13.367 12.137 -4.473 34 HB2 MET 6 1HB MET 6 -14.516 9.340 -4.352 35 HB3 MET 6 2HB MET 6 -13.427 10.006 -3.138 36 HG2 MET 6 1HG MET 6 -16.086 11.234 -3.925 37 HG3 MET 6 2HG MET 6 -15.841 10.219 -2.507 38 HE1 MET 6 3HE MET 6 -12.805 11.396 -1.364 39 HE2 MET 6 1HE MET 6 -14.243 10.510 -0.839 40 HE3 MET 6 2HE MET 6 -13.824 12.047 -0.084 41 H ASP 7 H ASP 7 -11.440 10.603 -3.637 42 HA ASP 7 HA ASP 7 -10.184 9.086 -5.768 43 HB2 ASP 7 1HB ASP 7 -9.584 11.438 -6.306 44 HB3 ASP 7 2HB ASP 7 -8.863 11.592 -4.703 45 H GLN 8 H GLN 8 -8.817 7.603 -4.986 46 HA GLN 8 HA GLN 8 -8.864 6.912 -2.256 47 HB2 GLN 8 1HB GLN 8 -6.713 6.111 -4.210 48 HB3 GLN 8 2HB GLN 8 -7.273 5.207 -2.807 49 HG2 GLN 8 1HG GLN 8 -8.824 5.798 -5.336 50 HG3 GLN 8 2HG GLN 8 -8.239 4.223 -4.802 51 HE21 GLN 8 2HE2 GLN 8 -11.055 5.094 -5.295 52 HE22 GLN 8 1HE2 GLN 8 -11.878 4.835 -3.835 53 H SER 9 H SER 9 -6.238 8.313 -4.193 54 HA SER 9 HA SER 9 -4.324 8.614 -2.199 55 HB2 SER 9 1HB SER 9 -4.827 10.495 -4.513 56 HB3 SER 9 2HB SER 9 -3.356 10.423 -3.546 57 HG SER 9 HG SER 9 -3.095 8.273 -4.229 58 H VAL 10 H VAL 10 -6.942 10.861 -3.069 59 HA VAL 10 HA VAL 10 -6.213 12.956 -1.349 60 HB VAL 10 HB VAL 10 -8.895 12.020 -2.388 61 HG11 VAL 10 1HG1 VAL 10 -8.186 14.396 -0.663 62 HG12 VAL 10 2HG1 VAL 10 -9.471 13.214 -0.417 63 HG13 VAL 10 3HG1 VAL 10 -9.604 14.402 -1.714 64 HG21 VAL 10 3HG2 VAL 10 -8.646 13.807 -3.965 65 HG22 VAL 10 1HG2 VAL 10 -7.107 12.946 -3.948 66 HG23 VAL 10 2HG2 VAL 10 -7.272 14.475 -3.085 67 H ALA 11 H ALA 11 -8.452 10.251 -0.823 68 HA ALA 11 HA ALA 11 -9.327 10.762 1.704 69 HB1 ALA 11 3HB ALA 11 -9.835 8.480 1.968 70 HB2 ALA 11 1HB ALA 11 -8.448 7.966 1.001 71 HB3 ALA 11 2HB ALA 11 -9.839 8.715 0.217 72 H ILE 12 H ILE 12 -6.200 9.257 0.855 73 HA ILE 12 HA ILE 12 -5.369 8.651 3.443 74 HB ILE 12 HB ILE 12 -3.618 9.601 1.176 75 HG12 ILE 12 1HG1 ILE 12 -5.129 7.883 0.342 76 HG13 ILE 12 2HG1 ILE 12 -3.529 7.178 0.548 77 HG21 ILE 12 1HG2 ILE 12 -3.161 7.968 3.671 78 HG22 ILE 12 2HG2 ILE 12 -2.270 9.376 3.097 79 HG23 ILE 12 3HG2 ILE 12 -2.088 7.824 2.280 80 HD11 ILE 12 3HD1 ILE 12 -4.427 6.501 2.919 81 HD12 ILE 12 1HD1 ILE 12 -4.917 5.560 1.512 82 HD13 ILE 12 2HD1 ILE 12 -6.011 6.765 2.195 83 H GLN 13 H GLN 13 -4.518 11.448 1.506 84 HA GLN 13 HA GLN 13 -3.079 12.940 3.312 85 HB2 GLN 13 1HB GLN 13 -4.906 13.760 1.080 86 HB3 GLN 13 2HB GLN 13 -4.309 15.015 2.166 87 HG2 GLN 13 1HG GLN 13 -2.465 13.006 0.864 88 HG3 GLN 13 2HG GLN 13 -2.869 14.548 0.107 89 HE21 GLN 13 2HE2 GLN 13 -0.458 13.201 1.895 90 HE22 GLN 13 1HE2 GLN 13 0.053 14.557 2.775 91 H GLU 14 H GLU 14 -6.640 12.894 3.048 92 HA GLU 14 HA GLU 14 -7.212 14.777 5.012 93 HB2 GLU 14 1HB GLU 14 -8.690 12.268 4.188 94 HB3 GLU 14 2HB GLU 14 -9.373 13.524 5.221 95 HG2 GLU 14 1HG GLU 14 -9.125 15.180 3.461 96 HG3 GLU 14 2HG GLU 14 -8.280 14.020 2.437 97 H THR 15 H THR 15 -7.302 11.243 5.418 98 HA THR 15 HA THR 15 -7.441 11.310 8.256 99 HB THR 15 HB THR 15 -8.196 9.364 6.958 100 HG1 THR 15 HG1 THR 15 -6.258 8.069 8.270 101 HG21 THR 15 3HG2 THR 15 -5.244 8.914 6.442 102 HG22 THR 15 1HG2 THR 15 -6.408 9.491 5.259 103 HG23 THR 15 2HG2 THR 15 -6.567 7.872 5.924 104 H LEU 16 H LEU 16 -4.722 11.305 6.041 105 HA LEU 16 HA LEU 16 -2.758 10.369 7.820 106 HB2 LEU 16 1HB LEU 16 -2.486 10.682 5.334 107 HB3 LEU 16 2HB LEU 16 -2.346 12.412 5.622 108 HG LEU 16 HG LEU 16 -0.372 11.963 7.096 109 HD11 LEU 16 1HD1 LEU 16 -1.080 9.130 6.397 110 HD12 LEU 16 2HD1 LEU 16 -0.547 9.797 7.940 111 HD13 LEU 16 3HD1 LEU 16 0.615 9.549 6.642 112 HD21 LEU 16 3HD2 LEU 16 -0.327 10.934 4.257 113 HD22 LEU 16 1HD2 LEU 16 1.139 11.165 5.208 114 HD23 LEU 16 2HD2 LEU 16 0.110 12.547 4.823 115 H VAL 17 H VAL 17 -1.682 13.402 6.906 116 HA VAL 17 HA VAL 17 -2.665 15.058 8.948 117 HB VAL 17 HB VAL 17 -1.277 13.322 10.282 118 HG11 VAL 17 1HG1 VAL 17 1.031 14.994 9.291 119 HG12 VAL 17 2HG1 VAL 17 0.626 13.435 8.580 120 HG13 VAL 17 3HG1 VAL 17 1.086 13.534 10.278 121 HG21 VAL 17 3HG2 VAL 17 -0.408 15.088 11.771 122 HG22 VAL 17 1HG2 VAL 17 -2.023 15.492 11.187 123 HG23 VAL 17 2HG2 VAL 17 -0.609 16.275 10.484 124 H GLU 18 H GLU 18 -1.411 17.111 9.033 125 HA GLU 18 HA GLU 18 -0.476 17.771 6.384 126 HB2 GLU 18 1HB GLU 18 -0.232 20.086 7.560 127 HB3 GLU 18 2HB GLU 18 -1.847 19.423 7.311 128 HG2 GLU 18 1HG GLU 18 -1.980 18.655 9.579 129 HG3 GLU 18 2HG GLU 18 -0.273 18.992 9.861 130 H GLY 19 H GLY 19 1.542 17.546 5.758 131 HA2 GLY 19 1HA GLY 19 3.796 18.699 6.359 132 HA3 GLY 19 2HA GLY 19 3.739 17.614 7.740 133 H GLU 20 H GLU 20 2.444 15.490 6.034 134 HA GLU 20 HA GLU 20 4.956 14.413 4.990 135 HB2 GLU 20 1HB GLU 20 2.256 13.195 5.545 136 HB3 GLU 20 2HB GLU 20 3.520 12.324 4.680 137 HG2 GLU 20 1HG GLU 20 3.837 11.677 6.923 138 HG3 GLU 20 2HG GLU 20 5.044 12.933 6.694 139 H TYR 21 H TYR 21 4.336 12.773 3.046 140 HA TYR 21 HA TYR 21 2.987 14.340 0.923 141 HB2 TYR 21 1HB TYR 21 5.514 14.709 1.014 142 HB3 TYR 21 2HB TYR 21 5.671 13.010 0.565 143 HD1 TYR 21 HD2 TYR 21 4.678 12.195 -1.582 144 HD2 TYR 21 HD1 TYR 21 4.908 16.368 -0.600 145 HE1 TYR 21 HE2 TYR 21 4.329 12.773 -3.965 146 HE2 TYR 21 HE1 TYR 21 4.556 16.949 -2.986 147 HH TYR 21 HH TYR 21 4.498 14.470 -5.487 148 H CYS 22 H CYS 22 1.588 13.106 -0.134 149 HA CYS 22 HA CYS 22 1.942 10.163 -0.117 150 HB2 CYS 22 1HB CYS 22 -0.527 11.767 -0.847 151 HB3 CYS 22 2HB CYS 22 -0.416 10.015 -0.684 152 HG CYS 22 HG CYS 22 -0.249 10.237 1.847 153 H VAL 23 H VAL 23 2.203 9.066 -2.059 154 HA VAL 23 HA VAL 23 2.706 10.779 -4.399 155 HB VAL 23 HB VAL 23 3.492 7.895 -3.990 156 HG11 VAL 23 1HG1 VAL 23 5.280 8.554 -5.615 157 HG12 VAL 23 2HG1 VAL 23 4.505 10.131 -5.771 158 HG13 VAL 23 3HG1 VAL 23 3.654 8.675 -6.286 159 HG21 VAL 23 3HG2 VAL 23 4.976 10.420 -3.222 160 HG22 VAL 23 1HG2 VAL 23 5.693 8.810 -3.270 161 HG23 VAL 23 2HG2 VAL 23 4.398 9.163 -2.127 162 H ILE 24 H ILE 24 1.050 7.804 -3.382 163 HA ILE 24 HA ILE 24 -1.001 8.119 -5.342 164 HB ILE 24 HB ILE 24 0.728 7.419 -6.869 165 HG12 ILE 24 1HG1 ILE 24 -0.957 4.967 -6.305 166 HG13 ILE 24 2HG1 ILE 24 -1.596 6.415 -7.081 167 HG21 ILE 24 1HG2 ILE 24 2.314 6.414 -5.378 168 HG22 ILE 24 2HG2 ILE 24 1.832 5.176 -6.533 169 HG23 ILE 24 3HG2 ILE 24 1.167 5.162 -4.902 170 HD11 ILE 24 3HD1 ILE 24 -0.174 6.180 -8.962 171 HD12 ILE 24 1HD1 ILE 24 -0.722 4.534 -8.632 172 HD13 ILE 24 2HD1 ILE 24 0.887 5.046 -8.127 173 H ALA 25 H ALA 25 -2.497 6.275 -5.350 174 HA ALA 25 HA ALA 25 -2.313 4.218 -3.370 175 HB1 ALA 25 3HB ALA 25 -3.956 4.977 -1.813 176 HB2 ALA 25 1HB ALA 25 -4.359 6.369 -2.811 177 HB3 ALA 25 2HB ALA 25 -2.806 6.302 -1.981 178 H VAL 26 H VAL 26 -3.417 2.600 -4.257 179 HA VAL 26 HA VAL 26 -5.933 3.201 -5.708 180 HB VAL 26 HB VAL 26 -3.845 1.187 -6.519 181 HG11 VAL 26 1HG1 VAL 26 -6.500 2.028 -7.642 182 HG12 VAL 26 2HG1 VAL 26 -5.890 0.404 -7.337 183 HG13 VAL 26 3HG1 VAL 26 -5.261 1.339 -8.692 184 HG21 VAL 26 3HG2 VAL 26 -2.796 3.202 -7.073 185 HG22 VAL 26 1HG2 VAL 26 -4.320 4.024 -7.406 186 HG23 VAL 26 2HG2 VAL 26 -3.684 2.842 -8.549 187 H GLN 27 H GLN 27 -7.516 2.151 -4.838 188 HA GLN 27 HA GLN 27 -7.296 0.362 -2.727 189 HB2 GLN 27 1HB GLN 27 -9.329 1.640 -3.168 190 HB3 GLN 27 2HB GLN 27 -9.586 0.739 -4.661 191 HG2 GLN 27 1HG GLN 27 -9.954 -1.308 -3.468 192 HG3 GLN 27 2HG GLN 27 -9.409 -0.593 -1.953 193 HE21 GLN 27 2HE2 GLN 27 -11.794 -1.587 -1.561 194 HE22 GLN 27 1HE2 GLN 27 -13.024 -0.425 -1.651 195 H GLY 28 H GLY 28 -7.689 -1.858 -2.544 196 HA2 GLY 28 1HA GLY 28 -7.615 -3.496 -4.991 197 HA3 GLY 28 2HA GLY 28 -6.311 -3.685 -3.821 198 H VAL 29 H VAL 29 -7.646 -5.867 -4.346 199 HA VAL 29 HA VAL 29 -9.617 -6.230 -2.155 200 HB VAL 29 HB VAL 29 -9.116 -8.175 -4.403 201 HG11 VAL 29 1HG1 VAL 29 -11.464 -8.802 -3.875 202 HG12 VAL 29 2HG1 VAL 29 -11.463 -7.608 -2.576 203 HG13 VAL 29 3HG1 VAL 29 -10.386 -9.003 -2.494 204 HG21 VAL 29 3HG2 VAL 29 -10.879 -5.720 -4.365 205 HG22 VAL 29 1HG2 VAL 29 -11.168 -7.076 -5.456 206 HG23 VAL 29 2HG2 VAL 29 -9.664 -6.159 -5.566 207 H LEU 30 H LEU 30 -9.458 -8.241 -0.977 208 HA LEU 30 HA LEU 30 -6.823 -9.563 -0.976 209 HB2 LEU 30 1HB LEU 30 -6.657 -7.780 0.744 210 HB3 LEU 30 2HB LEU 30 -8.136 -8.373 1.500 211 HG LEU 30 HG LEU 30 -7.005 -10.595 1.839 212 HD11 LEU 30 1HD1 LEU 30 -4.335 -10.170 1.759 213 HD12 LEU 30 2HD1 LEU 30 -4.820 -9.161 0.401 214 HD13 LEU 30 3HD1 LEU 30 -5.234 -10.876 0.421 215 HD21 LEU 30 3HD2 LEU 30 -5.462 -9.754 3.654 216 HD22 LEU 30 1HD2 LEU 30 -7.095 -9.091 3.702 217 HD23 LEU 30 2HD2 LEU 30 -5.768 -8.120 3.060 218 H CYS 31 H CYS 31 -7.291 -11.742 -1.090 219 HA CYS 31 HA CYS 31 -9.959 -12.597 -0.201 220 HB2 CYS 31 1HB CYS 31 -7.916 -14.113 -1.833 221 HB3 CYS 31 2HB CYS 31 -9.629 -14.484 -1.632 222 HG CYS 31 HG CYS 31 -10.183 -12.846 -3.405 223 H LYS 32 H LYS 32 -10.137 -13.568 1.654 224 HA LYS 32 HA LYS 32 -7.857 -15.156 2.702 225 HB2 LYS 32 1HB LYS 32 -8.380 -12.975 3.969 226 HB3 LYS 32 2HB LYS 32 -9.865 -13.779 4.485 227 HG2 LYS 32 1HG LYS 32 -8.424 -15.711 5.272 228 HG3 LYS 32 2HG LYS 32 -7.016 -14.696 4.967 229 HD2 LYS 32 1HD LYS 32 -9.298 -14.041 6.848 230 HD3 LYS 32 2HD LYS 32 -7.684 -14.562 7.326 231 HE2 LYS 32 1HE LYS 32 -6.852 -12.521 5.946 232 HE3 LYS 32 2HE LYS 32 -8.520 -11.964 6.060 233 HZ1 LYS 32 3HZ LYS 32 -8.413 -11.867 8.368 234 HZ2 LYS 32 1HZ LYS 32 -6.931 -11.218 7.862 235 HZ3 LYS 32 2HZ LYS 32 -7.002 -12.812 8.446 236 H GLY 33 H GLY 33 -8.332 -17.215 2.839 237 HA2 GLY 33 1HA GLY 33 -9.516 -19.180 2.993 238 HA3 GLY 33 2HA GLY 33 -10.665 -18.286 3.986 239 H ASP 34 H ASP 34 -12.654 -18.475 3.228 240 HA ASP 34 HA ASP 34 -13.126 -18.413 0.296 241 HB2 ASP 34 1HB ASP 34 -14.509 -19.986 2.475 242 HB3 ASP 34 2HB ASP 34 -15.235 -19.721 0.890 243 H SER 35 H SER 35 -12.888 -16.178 2.065 244 HA SER 35 HA SER 35 -15.606 -15.026 1.800 245 HB2 SER 35 1HB SER 35 -15.084 -15.600 4.204 246 HB3 SER 35 2HB SER 35 -13.723 -14.482 4.115 247 HG SER 35 HG SER 35 -16.069 -13.817 4.785 248 H ARG 36 H ARG 36 -15.558 -13.177 0.611 249 HA ARG 36 HA ARG 36 -12.974 -12.081 -0.149 250 HB2 ARG 36 1HB ARG 36 -15.784 -11.305 -0.974 251 HB3 ARG 36 2HB ARG 36 -14.297 -10.708 -1.707 252 HG2 ARG 36 1HG ARG 36 -14.768 -13.679 -1.542 253 HG3 ARG 36 2HG ARG 36 -15.572 -12.746 -2.803 254 HD2 ARG 36 1HD ARG 36 -12.576 -12.747 -2.313 255 HD3 ARG 36 2HD ARG 36 -13.390 -13.690 -3.553 256 HE ARG 36 HE ARG 36 -14.129 -10.972 -3.811 257 HH11 ARG 36 1HH2 ARG 36 -11.449 -13.124 -4.192 258 HH12 ARG 36 2HH2 ARG 36 -10.703 -12.193 -5.449 259 HH21 ARG 36 1HH1 ARG 36 -13.161 -9.748 -5.458 260 HH22 ARG 36 2HH1 ARG 36 -11.672 -10.282 -6.166 261 H GLN 37 H GLN 37 -12.204 -10.095 0.312 262 HA GLN 37 HA GLN 37 -13.751 -8.360 2.142 263 HB2 GLN 37 1HB GLN 37 -10.887 -9.285 2.452 264 HB3 GLN 37 2HB GLN 37 -11.609 -7.967 3.380 265 HG2 GLN 37 1HG GLN 37 -13.227 -9.425 4.365 266 HG3 GLN 37 2HG GLN 37 -12.816 -10.734 3.260 267 HE21 GLN 37 2HE2 GLN 37 -10.854 -11.938 3.651 268 HE22 GLN 37 1HE2 GLN 37 -10.009 -11.808 5.111 269 H SER 38 H SER 38 -12.969 -6.171 2.189 270 HA SER 38 HA SER 38 -11.601 -5.350 -0.321 271 HB2 SER 38 1HB SER 38 -12.956 -3.287 -0.252 272 HB3 SER 38 2HB SER 38 -13.956 -4.729 -0.394 273 HG SER 38 HG SER 38 -14.893 -3.672 1.230 274 H ARG 39 H ARG 39 -9.789 -4.324 -0.080 275 HA ARG 39 HA ARG 39 -9.227 -2.879 2.440 276 HB2 ARG 39 1HB ARG 39 -8.089 -5.185 2.142 277 HB3 ARG 39 2HB ARG 39 -7.133 -4.390 0.895 278 HG2 ARG 39 1HG ARG 39 -5.776 -4.035 2.753 279 HG3 ARG 39 2HG ARG 39 -6.744 -2.566 2.788 280 HD2 ARG 39 1HD ARG 39 -6.709 -3.477 5.023 281 HD3 ARG 39 2HD ARG 39 -8.321 -3.741 4.374 282 HE ARG 39 HE ARG 39 -6.491 -5.949 3.956 283 HH11 ARG 39 1HH2 ARG 39 -8.856 -4.458 6.008 284 HH12 ARG 39 2HH2 ARG 39 -9.238 -5.921 6.853 285 HH21 ARG 39 1HH1 ARG 39 -6.988 -7.860 5.065 286 HH22 ARG 39 2HH1 ARG 39 -8.180 -7.845 6.321 287 H LEU 40 H LEU 40 -7.876 -1.119 2.271 288 HA LEU 40 HA LEU 40 -7.455 -0.065 -0.481 289 HB2 LEU 40 1HB LEU 40 -9.301 1.024 0.737 290 HB3 LEU 40 2HB LEU 40 -8.175 1.529 1.994 291 HG LEU 40 HG LEU 40 -7.521 2.229 -0.863 292 HD11 LEU 40 1HD1 LEU 40 -9.769 2.952 -0.920 293 HD12 LEU 40 2HD1 LEU 40 -8.891 4.396 -0.418 294 HD13 LEU 40 3HD1 LEU 40 -9.755 3.432 0.777 295 HD21 LEU 40 3HD2 LEU 40 -5.924 2.897 0.869 296 HD22 LEU 40 1HD2 LEU 40 -7.215 3.645 1.808 297 HD23 LEU 40 2HD2 LEU 40 -6.734 4.334 0.264 298 H LEU 41 H LEU 41 -5.368 0.429 -0.974 299 HA LEU 41 HA LEU 41 -3.401 0.542 1.229 300 HB2 LEU 41 1HB LEU 41 -3.043 0.044 -1.737 301 HB3 LEU 41 2HB LEU 41 -1.752 0.069 -0.538 302 HG LEU 41 HG LEU 41 -3.180 -1.744 0.697 303 HD11 LEU 41 1HD1 LEU 41 -4.335 -3.221 -1.087 304 HD12 LEU 41 2HD1 LEU 41 -4.386 -1.764 -2.075 305 HD13 LEU 41 3HD1 LEU 41 -5.208 -1.802 -0.517 306 HD21 LEU 41 3HD2 LEU 41 -2.095 -3.527 -0.704 307 HD22 LEU 41 1HD2 LEU 41 -0.996 -2.225 -0.248 308 HD23 LEU 41 2HD2 LEU 41 -1.669 -2.282 -1.877 309 H GLY 42 H GLY 42 -1.424 1.918 0.607 310 HA2 GLY 42 1HA GLY 42 -1.767 4.156 -1.114 311 HA3 GLY 42 2HA GLY 42 -2.124 4.621 0.540 312 H LEU 43 H LEU 43 0.295 4.269 -1.760 313 HA LEU 43 HA LEU 43 2.493 3.772 0.068 314 HB2 LEU 43 1HB LEU 43 2.727 2.975 -2.191 315 HB3 LEU 43 2HB LEU 43 2.378 4.569 -2.850 316 HG LEU 43 HG LEU 43 4.465 5.444 -1.870 317 HD11 LEU 43 1HD1 LEU 43 4.781 4.173 0.108 318 HD12 LEU 43 2HD1 LEU 43 6.077 3.638 -0.959 319 HD13 LEU 43 3HD1 LEU 43 4.634 2.642 -0.757 320 HD21 LEU 43 3HD2 LEU 43 5.965 4.372 -3.384 321 HD22 LEU 43 1HD2 LEU 43 4.369 4.243 -4.126 322 HD23 LEU 43 2HD2 LEU 43 5.072 2.853 -3.302 323 H VAL 44 H VAL 44 3.744 5.288 1.068 324 HA VAL 44 HA VAL 44 3.380 8.133 0.302 325 HB VAL 44 HB VAL 44 3.354 7.127 3.137 326 HG11 VAL 44 1HG1 VAL 44 2.439 9.817 2.123 327 HG12 VAL 44 2HG1 VAL 44 4.130 9.531 2.523 328 HG13 VAL 44 3HG1 VAL 44 2.892 9.356 3.762 329 HG21 VAL 44 3HG2 VAL 44 0.911 7.773 3.030 330 HG22 VAL 44 1HG2 VAL 44 1.335 6.338 2.098 331 HG23 VAL 44 2HG2 VAL 44 1.091 7.881 1.279 332 H ARG 45 H ARG 45 5.113 9.365 0.425 333 HA ARG 45 HA ARG 45 7.621 8.190 1.497 334 HB2 ARG 45 1HB ARG 45 8.832 9.452 -0.185 335 HB3 ARG 45 2HB ARG 45 7.612 8.460 -0.981 336 HG2 ARG 45 1HG ARG 45 6.098 10.412 -1.093 337 HG3 ARG 45 2HG ARG 45 7.330 11.412 -0.323 338 HD2 ARG 45 1HD ARG 45 8.870 10.980 -2.173 339 HD3 ARG 45 2HD ARG 45 7.676 9.946 -2.948 340 HE ARG 45 HE ARG 45 6.467 12.430 -2.505 341 HH11 ARG 45 1HH2 ARG 45 9.089 11.038 -4.271 342 HH12 ARG 45 2HH2 ARG 45 9.028 12.203 -5.552 343 HH21 ARG 45 1HH1 ARG 45 6.374 13.962 -4.177 344 HH22 ARG 45 2HH1 ARG 45 7.490 13.860 -5.499 345 H TYR 46 H TYR 46 8.830 9.447 2.821 346 HA TYR 46 HA TYR 46 7.887 12.190 3.417 347 HB2 TYR 46 1HB TYR 46 6.934 10.743 5.101 348 HB3 TYR 46 2HB TYR 46 8.489 9.955 5.365 349 HD1 TYR 46 HD1 TYR 46 7.061 13.423 5.265 350 HD2 TYR 46 HD2 TYR 46 9.735 10.676 7.202 351 HE1 TYR 46 HE1 TYR 46 7.629 15.158 6.942 352 HE2 TYR 46 HE2 TYR 46 10.303 12.410 8.876 353 HH TYR 46 HH TYR 46 10.073 14.534 9.460 354 H ARG 47 H ARG 47 9.529 13.660 3.664 355 HA ARG 47 HA ARG 47 12.265 12.662 3.254 356 HB2 ARG 47 1HB ARG 47 12.821 14.977 2.711 357 HB3 ARG 47 2HB ARG 47 11.434 14.444 1.765 358 HG2 ARG 47 1HG ARG 47 9.914 15.563 3.358 359 HG3 ARG 47 2HG ARG 47 11.297 16.097 4.310 360 HD2 ARG 47 1HD ARG 47 12.153 17.344 2.352 361 HD3 ARG 47 2HD ARG 47 10.746 16.837 1.423 362 HE ARG 47 HE ARG 47 10.019 18.146 3.876 363 HH11 ARG 47 1HH2 ARG 47 11.082 18.616 0.615 364 HH12 ARG 47 2HH2 ARG 47 10.356 20.180 0.461 365 HH21 ARG 47 1HH1 ARG 47 9.066 20.193 3.679 366 HH22 ARG 47 2HH1 ARG 47 9.214 21.072 2.195 367 H LEU 48 H LEU 48 14.015 13.286 4.542 368 HA LEU 48 HA LEU 48 13.299 13.981 7.327 369 HB2 LEU 48 1HB LEU 48 15.790 12.698 6.187 370 HB3 LEU 48 2HB LEU 48 15.538 13.070 7.888 371 HG LEU 48 HG LEU 48 13.737 11.257 6.253 372 HD11 LEU 48 1HD1 LEU 48 14.832 9.467 7.724 373 HD12 LEU 48 2HD1 LEU 48 16.064 10.674 8.101 374 HD13 LEU 48 3HD1 LEU 48 15.837 10.133 6.436 375 HD21 LEU 48 3HD2 LEU 48 13.813 12.133 9.141 376 HD22 LEU 48 1HD2 LEU 48 13.167 10.544 8.727 377 HD23 LEU 48 2HD2 LEU 48 12.432 11.993 8.055 378 H GLU 49 H GLU 49 14.140 15.703 8.334 379 HA GLU 49 HA GLU 49 14.906 17.977 6.960 380 HB2 GLU 49 1HB GLU 49 15.696 18.827 9.137 381 HB3 GLU 49 2HB GLU 49 14.143 18.004 9.288 382 HG2 GLU 49 1HG GLU 49 15.330 15.938 9.997 383 HG3 GLU 49 2HG GLU 49 16.860 16.806 9.910 384 H ASN 50 H ASN 50 16.690 15.160 7.378 385 HA ASN 50 HA ASN 50 19.319 16.422 7.363 386 HB2 ASN 50 1HB ASN 50 18.425 13.534 7.223 387 HB3 ASN 50 2HB ASN 50 20.110 14.051 7.241 388 HD21 ASN 50 2HD2 ASN 50 18.324 12.573 9.315 389 HD22 ASN 50 1HD2 ASN 50 18.595 13.441 10.748 390 H ASP 51 H ASP 51 16.962 15.829 5.113 391 HA ASP 51 HA ASP 51 17.067 16.270 2.817 392 HB2 ASP 51 1HB ASP 51 19.568 17.005 3.332 393 HB3 ASP 51 2HB ASP 51 19.955 15.428 2.652 394 H ALA 52 H ALA 52 17.863 13.607 4.655 395 HA ALA 52 HA ALA 52 18.095 11.632 2.578 396 HB1 ALA 52 3HB ALA 52 17.772 10.052 4.543 397 HB2 ALA 52 1HB ALA 52 17.688 11.484 5.566 398 HB3 ALA 52 2HB ALA 52 19.157 11.137 4.653 399 H GLN 53 H GLN 53 16.552 10.396 1.690 400 HA GLN 53 HA GLN 53 13.743 11.060 2.274 401 HB2 GLN 53 1HB GLN 53 14.999 9.522 -0.010 402 HB3 GLN 53 2HB GLN 53 13.293 9.947 0.124 403 HG2 GLN 53 1HG GLN 53 15.570 11.948 0.078 404 HG3 GLN 53 2HG GLN 53 14.565 11.542 -1.313 405 HE21 GLN 53 2HE2 GLN 53 12.124 11.267 0.477 406 HE22 GLN 53 1HE2 GLN 53 11.671 12.863 0.834 407 H GLU 54 H GLU 54 12.176 9.457 2.602 408 HA GLU 54 HA GLU 54 13.057 6.700 3.056 409 HB2 GLU 54 1HB GLU 54 11.756 8.402 5.203 410 HB3 GLU 54 2HB GLU 54 11.904 6.647 5.285 411 HG2 GLU 54 1HG GLU 54 14.227 8.591 5.049 412 HG3 GLU 54 2HG GLU 54 13.726 7.780 6.526 413 H HIS 55 H HIS 55 11.449 5.187 2.862 414 HA HIS 55 HA HIS 55 8.751 6.162 2.085 415 HB2 HIS 55 1HB HIS 55 10.427 4.047 0.710 416 HB3 HIS 55 2HB HIS 55 8.733 4.375 0.356 417 HD2 HIS 55 HD2 HIS 55 8.391 6.338 -1.556 418 HE1 HIS 55 HE1 HIS 55 12.242 8.058 -1.335 419 HE2 HIS 55 HE2 HIS 55 10.016 8.121 -2.556 420 H ALA 56 H ALA 56 7.044 4.661 2.408 421 HA ALA 56 HA ALA 56 7.557 2.149 3.745 422 HB1 ALA 56 3HB ALA 56 7.613 3.443 5.721 423 HB2 ALA 56 1HB ALA 56 5.944 2.881 5.632 424 HB3 ALA 56 2HB ALA 56 6.348 4.527 5.150 425 H LEU 57 H LEU 57 5.758 0.772 3.619 426 HA LEU 57 HA LEU 57 3.669 1.666 1.733 427 HB2 LEU 57 1HB LEU 57 4.825 -0.365 1.084 428 HB3 LEU 57 2HB LEU 57 4.494 -1.110 2.644 429 HG LEU 57 HG LEU 57 2.082 -1.077 2.167 430 HD11 LEU 57 1HD1 LEU 57 2.997 0.420 -0.290 431 HD12 LEU 57 2HD1 LEU 57 1.702 0.831 0.835 432 HD13 LEU 57 3HD1 LEU 57 1.486 -0.494 -0.304 433 HD21 LEU 57 3HD2 LEU 57 3.323 -3.035 1.431 434 HD22 LEU 57 1HD2 LEU 57 3.788 -2.221 -0.063 435 HD23 LEU 57 2HD2 LEU 57 2.101 -2.649 0.221 436 H PHE 58 H PHE 58 2.217 2.771 2.948 437 HA PHE 58 HA PHE 58 1.324 1.845 5.507 438 HB2 PHE 58 1HB PHE 58 0.444 4.050 3.659 439 HB3 PHE 58 2HB PHE 58 -0.373 3.727 5.182 440 HD1 PHE 58 HD2 PHE 58 2.838 4.678 3.612 441 HD2 PHE 58 HD1 PHE 58 0.622 4.366 7.273 442 HE1 PHE 58 HE2 PHE 58 4.589 5.995 4.773 443 HE2 PHE 58 HE1 PHE 58 2.383 5.687 8.443 444 HZ PHE 58 HZ PHE 58 4.363 6.497 7.190 445 H LEU 59 H LEU 59 -0.613 0.961 6.069 446 HA LEU 59 HA LEU 59 -2.293 -0.121 3.870 447 HB2 LEU 59 1HB LEU 59 -1.062 -1.862 5.218 448 HB3 LEU 59 2HB LEU 59 -1.959 -1.309 6.632 449 HG LEU 59 HG LEU 59 -4.089 -1.763 5.405 450 HD11 LEU 59 1HD1 LEU 59 -2.145 -2.570 3.272 451 HD12 LEU 59 2HD1 LEU 59 -3.721 -1.794 3.123 452 HD13 LEU 59 3HD1 LEU 59 -3.617 -3.523 3.436 453 HD21 LEU 59 3HD2 LEU 59 -3.882 -4.277 5.550 454 HD22 LEU 59 1HD2 LEU 59 -3.294 -3.424 6.976 455 HD23 LEU 59 2HD2 LEU 59 -2.150 -4.064 5.798 456 H TYR 60 H TYR 60 -4.289 0.569 3.828 457 HA TYR 60 HA TYR 60 -5.419 1.966 6.199 458 HB2 TYR 60 1HB TYR 60 -5.867 2.455 3.247 459 HB3 TYR 60 2HB TYR 60 -6.648 3.334 4.553 460 HD1 TYR 60 HD1 TYR 60 -3.474 2.777 2.737 461 HD2 TYR 60 HD2 TYR 60 -5.419 4.962 5.868 462 HE1 TYR 60 HE1 TYR 60 -1.604 4.379 2.785 463 HE2 TYR 60 HE2 TYR 60 -3.528 6.562 5.935 464 HH TYR 60 HH TYR 60 -1.400 6.918 5.235 465 H THR 61 H THR 61 -7.385 1.121 6.934 466 HA THR 61 HA THR 61 -8.540 -1.085 5.393 467 HB THR 61 HB THR 61 -8.529 -1.410 7.791 468 HG1 THR 61 HG1 THR 61 -10.917 -1.416 8.082 469 HG21 THR 61 3HG2 THR 61 -8.428 0.920 8.515 470 HG22 THR 61 1HG2 THR 61 -9.817 0.135 9.268 471 HG23 THR 61 2HG2 THR 61 -10.051 1.209 7.890 472 H HIS 62 H HIS 62 -10.874 -1.045 4.886 473 HA HIS 62 HA HIS 62 -12.220 1.491 4.795 474 HB2 HIS 62 1HB HIS 62 -11.351 2.235 2.824 475 HB3 HIS 62 2HB HIS 62 -10.498 0.718 2.593 476 HD2 HIS 62 HD2 HIS 62 -11.499 -0.804 0.518 477 HE1 HIS 62 HE1 HIS 62 -15.299 1.011 0.219 478 HE2 HIS 62 HE2 HIS 62 -13.782 -0.768 -0.760 479 H ARG 63 H ARG 63 -14.372 1.284 4.183 480 HA ARG 63 HA ARG 63 -15.354 -1.412 3.529 481 HB2 ARG 63 1HB ARG 63 -16.556 0.345 5.662 482 HB3 ARG 63 2HB ARG 63 -17.032 -1.297 5.227 483 HG2 ARG 63 1HG ARG 63 -15.668 -1.867 6.998 484 HG3 ARG 63 2HG ARG 63 -14.402 -1.741 5.786 485 HD2 ARG 63 1HD ARG 63 -13.660 -0.460 7.667 486 HD3 ARG 63 2HD ARG 63 -14.182 0.706 6.449 487 HE ARG 63 HE ARG 63 -16.003 1.267 7.809 488 HH11 ARG 63 1HH2 ARG 63 -14.293 -1.497 9.006 489 HH12 ARG 63 2HH2 ARG 63 -15.082 -1.486 10.548 490 HH21 ARG 63 1HH1 ARG 63 -17.036 1.283 9.826 491 HH22 ARG 63 2HH1 ARG 63 -16.636 0.088 11.011 492 H ARG 64 H ARG 64 -17.989 -0.931 3.632 493 HA ARG 64 HA ARG 64 -18.474 0.433 1.218 494 HB2 ARG 64 1HB ARG 64 -19.856 -1.408 2.438 495 HB3 ARG 64 2HB ARG 64 -20.595 -0.064 3.305 496 HG2 ARG 64 1HG ARG 64 -22.052 -0.189 1.502 497 HG3 ARG 64 2HG ARG 64 -20.863 0.930 0.831 498 HD2 ARG 64 1HD ARG 64 -21.318 -0.820 -0.801 499 HD3 ARG 64 2HD ARG 64 -19.679 -1.022 -0.188 500 HE ARG 64 HE ARG 64 -21.604 -2.557 1.301 501 HH11 ARG 64 1HH2 ARG 64 -19.667 -2.399 -1.560 502 HH12 ARG 64 2HH2 ARG 64 -19.588 -4.116 -1.771 503 HH21 ARG 64 1HH1 ARG 64 -21.504 -4.813 1.035 504 HH22 ARG 64 2HH1 ARG 64 -20.629 -5.482 -0.301 505 H MET 65 H MET 65 -17.229 1.961 3.564 506 HA MET 65 HA MET 65 -18.650 4.442 3.106 507 HB2 MET 65 1HB MET 65 -18.773 4.758 5.713 508 HB3 MET 65 2HB MET 65 -20.048 3.860 4.888 509 HG2 MET 65 1HG MET 65 -19.015 1.748 5.452 510 HG3 MET 65 2HG MET 65 -17.616 2.572 6.107 511 HE1 MET 65 3HE MET 65 -17.914 0.952 7.863 512 HE2 MET 65 1HE MET 65 -19.582 0.386 8.016 513 HE3 MET 65 2HE MET 65 -18.819 1.256 9.344 514 H ALA 66 H ALA 66 -16.221 4.043 2.245 515 HA ALA 66 HA ALA 66 -14.310 5.052 4.274 516 HB1 ALA 66 3HB ALA 66 -13.474 3.122 3.175 517 HB2 ALA 66 1HB ALA 66 -12.596 4.497 2.506 518 HB3 ALA 66 2HB ALA 66 -13.901 3.751 1.584 519 H ILE 67 H ILE 67 -16.278 6.114 1.767 520 HA ILE 67 HA ILE 67 -14.751 8.102 0.481 521 HB ILE 67 HB ILE 67 -17.016 9.082 -0.031 522 HG12 ILE 67 1HG1 ILE 67 -17.946 6.792 1.738 523 HG13 ILE 67 2HG1 ILE 67 -18.060 8.502 2.146 524 HG21 ILE 67 1HG2 ILE 67 -17.698 7.256 -1.421 525 HG22 ILE 67 2HG2 ILE 67 -16.980 6.068 -0.333 526 HG23 ILE 67 3HG2 ILE 67 -15.945 7.129 -1.287 527 HD11 ILE 67 3HD1 ILE 67 -19.449 7.079 -0.138 528 HD12 ILE 67 1HD1 ILE 67 -19.455 8.829 0.078 529 HD13 ILE 67 2HD1 ILE 67 -20.207 7.788 1.287 530 H THR 68 H THR 68 -16.240 8.009 3.543 531 HA THR 68 HA THR 68 -16.805 10.619 4.187 532 HB THR 68 HB THR 68 -15.491 8.717 6.125 533 HG1 THR 68 HG1 THR 68 -17.129 7.630 5.083 534 HG21 THR 68 3HG2 THR 68 -17.568 10.907 6.417 535 HG22 THR 68 1HG2 THR 68 -15.884 11.015 6.929 536 HG23 THR 68 2HG2 THR 68 -16.976 9.881 7.722 537 H GLY 69 H GLY 69 -13.684 9.193 5.238 538 HA2 GLY 69 1HA GLY 69 -11.734 10.726 4.320 539 HA3 GLY 69 2HA GLY 69 -12.546 11.904 5.354 540 H ASP 70 H ASP 70 -13.367 9.621 7.147 541 HA ASP 70 HA ASP 70 -10.827 9.448 8.651 542 HB2 ASP 70 1HB ASP 70 -12.694 10.683 9.730 543 HB3 ASP 70 2HB ASP 70 -13.657 9.203 9.711 544 H ASP 71 H ASP 71 -13.807 7.529 8.293 545 HA ASP 71 HA ASP 71 -13.260 5.150 9.364 546 HB2 ASP 71 1HB ASP 71 -15.352 5.677 8.095 547 HB3 ASP 71 2HB ASP 71 -14.465 5.520 6.578 548 H VAL 72 H VAL 72 -11.570 6.471 6.631 549 HA VAL 72 HA VAL 72 -10.034 3.955 6.325 550 HB VAL 72 HB VAL 72 -11.109 4.867 4.286 551 HG11 VAL 72 1HG1 VAL 72 -10.647 7.339 5.219 552 HG12 VAL 72 2HG1 VAL 72 -10.783 7.010 3.496 553 HG13 VAL 72 3HG1 VAL 72 -9.191 7.173 4.232 554 HG21 VAL 72 3HG2 VAL 72 -8.087 5.144 4.236 555 HG22 VAL 72 1HG2 VAL 72 -9.135 4.748 2.873 556 HG23 VAL 72 2HG2 VAL 72 -8.947 3.609 4.198 557 H SER 73 H SER 73 -8.416 4.047 7.808 558 HA SER 73 HA SER 73 -6.411 6.145 7.531 559 HB2 SER 73 1HB SER 73 -8.056 6.861 9.334 560 HB3 SER 73 2HB SER 73 -7.570 5.430 10.235 561 HG SER 73 HG SER 73 -5.460 6.890 9.277 562 H LEU 74 H LEU 74 -4.471 5.445 9.005 563 HA LEU 74 HA LEU 74 -3.388 3.151 8.157 564 HB2 LEU 74 1HB LEU 74 -2.957 4.837 10.543 565 HB3 LEU 74 2HB LEU 74 -2.302 3.209 10.686 566 HG LEU 74 HG LEU 74 -1.007 3.474 8.680 567 HD11 LEU 74 1HD1 LEU 74 -2.072 4.695 7.084 568 HD12 LEU 74 2HD1 LEU 74 -1.136 6.023 7.751 569 HD13 LEU 74 3HD1 LEU 74 -2.812 5.800 8.247 570 HD21 LEU 74 3HD2 LEU 74 -0.486 6.133 9.927 571 HD22 LEU 74 1HD2 LEU 74 0.611 4.798 9.602 572 HD23 LEU 74 2HD2 LEU 74 -0.447 4.739 11.004 573 H ASP 75 H ASP 75 -3.640 1.107 8.250 574 HA ASP 75 HA ASP 75 -5.250 -0.123 10.405 575 HB2 ASP 75 1HB ASP 75 -6.228 -0.279 8.121 576 HB3 ASP 75 2HB ASP 75 -4.775 -1.119 7.586 577 H GLN 76 H GLN 76 -2.218 -0.228 8.562 578 HA GLN 76 HA GLN 76 -0.837 -1.610 10.565 579 HB2 GLN 76 1HB GLN 76 -2.336 -3.488 9.551 580 HB3 GLN 76 2HB GLN 76 -1.229 -3.417 8.185 581 HG2 GLN 76 1HG GLN 76 0.554 -3.487 10.290 582 HG3 GLN 76 2HG GLN 76 -0.765 -4.453 10.939 583 HE21 GLN 76 2HE2 GLN 76 1.999 -4.565 8.999 584 HE22 GLN 76 1HE2 GLN 76 1.707 -6.046 8.233 585 H ILE 77 H ILE 77 0.883 -0.308 10.237 586 HA ILE 77 HA ILE 77 1.907 0.400 7.649 587 HB ILE 77 HB ILE 77 3.194 0.662 10.385 588 HG12 ILE 77 1HG1 ILE 77 1.444 2.639 8.895 589 HG13 ILE 77 2HG1 ILE 77 0.931 1.686 10.284 590 HG21 ILE 77 1HG2 ILE 77 4.763 2.059 9.434 591 HG22 ILE 77 2HG2 ILE 77 3.656 2.663 8.204 592 HG23 ILE 77 3HG2 ILE 77 4.434 1.097 8.002 593 HD11 ILE 77 3HD1 ILE 77 1.576 3.633 11.379 594 HD12 ILE 77 1HD1 ILE 77 2.817 4.012 10.183 595 HD13 ILE 77 2HD1 ILE 77 3.111 2.768 11.396 596 H VAL 78 H VAL 78 3.450 -0.556 6.513 597 HA VAL 78 HA VAL 78 5.119 -2.666 7.740 598 HB VAL 78 HB VAL 78 3.580 -2.877 5.143 599 HG11 VAL 78 1HG1 VAL 78 5.819 -4.531 6.331 600 HG12 VAL 78 2HG1 VAL 78 5.734 -3.824 4.718 601 HG13 VAL 78 3HG1 VAL 78 4.700 -5.191 5.140 602 HG21 VAL 78 3HG2 VAL 78 2.513 -4.768 6.235 603 HG22 VAL 78 1HG2 VAL 78 2.391 -3.379 7.319 604 HG23 VAL 78 2HG2 VAL 78 3.596 -4.629 7.619 605 HA PRO 79 HA PRO 79 7.660 0.341 5.365 606 HB2 PRO 79 1HB PRO 79 9.884 0.273 6.909 607 HB3 PRO 79 2HB PRO 79 8.434 1.188 7.378 608 HG2 PRO 79 1HG PRO 79 9.338 -1.511 8.287 609 HG3 PRO 79 2HG PRO 79 8.680 -0.171 9.242 610 HD2 PRO 79 1HD PRO 79 7.179 -2.318 8.437 611 HD3 PRO 79 2HD PRO 79 6.481 -0.707 8.715 612 H LEU 80 H LEU 80 9.355 0.144 3.923 613 HA LEU 80 HA LEU 80 9.853 -2.494 2.995 614 HB2 LEU 80 1HB LEU 80 10.740 0.272 2.184 615 HB3 LEU 80 2HB LEU 80 11.453 -1.156 1.429 616 HG LEU 80 HG LEU 80 9.225 -1.937 0.765 617 HD11 LEU 80 1HD1 LEU 80 8.353 0.514 2.294 618 HD12 LEU 80 2HD1 LEU 80 7.791 -1.147 2.477 619 HD13 LEU 80 3HD1 LEU 80 7.325 -0.211 1.056 620 HD21 LEU 80 3HD2 LEU 80 10.349 -0.529 -0.831 621 HD22 LEU 80 1HD2 LEU 80 9.879 0.927 0.045 622 HD23 LEU 80 2HD2 LEU 80 8.659 -0.029 -0.794 623 H SER 81 H SER 81 11.433 -3.765 3.343 624 HA SER 81 HA SER 81 13.967 -2.841 4.562 625 HB2 SER 81 1HB SER 81 13.940 -4.890 5.994 626 HB3 SER 81 2HB SER 81 12.669 -3.743 6.400 627 HG SER 81 HG SER 81 11.194 -5.073 5.601 628 H LYS 82 H LYS 82 15.676 -4.564 4.383 629 HA LYS 82 HA LYS 82 16.179 -5.227 1.772 630 HB2 LYS 82 1HB LYS 82 17.097 -6.623 4.288 631 HB3 LYS 82 2HB LYS 82 17.773 -6.927 2.688 632 HG2 LYS 82 1HG LYS 82 18.448 -4.603 2.467 633 HG3 LYS 82 2HG LYS 82 17.656 -4.194 3.987 634 HD2 LYS 82 1HD LYS 82 19.930 -4.433 4.588 635 HD3 LYS 82 2HD LYS 82 19.204 -5.967 5.058 636 HE2 LYS 82 1HE LYS 82 20.043 -7.057 3.077 637 HE3 LYS 82 2HE LYS 82 20.577 -5.524 2.392 638 HZ1 LYS 82 3HZ LYS 82 21.598 -6.625 4.949 639 HZ2 LYS 82 1HZ LYS 82 22.203 -5.294 4.089 640 HZ3 LYS 82 2HZ LYS 82 22.364 -6.861 3.449 641 H ASP 83 H ASP 83 14.500 -7.213 4.202 642 HA ASP 83 HA ASP 83 14.280 -9.541 2.611 643 HB2 ASP 83 1HB ASP 83 12.343 -10.038 4.193 644 HB3 ASP 83 2HB ASP 83 13.914 -9.761 4.945 645 H PHE 84 H PHE 84 12.725 -6.495 2.434 646 HA PHE 84 HA PHE 84 10.193 -7.118 1.405 647 HB2 PHE 84 1HB PHE 84 11.075 -4.829 2.011 648 HB3 PHE 84 2HB PHE 84 11.959 -4.838 0.491 649 HD1 PHE 84 HD1 PHE 84 8.558 -4.949 1.998 650 HD2 PHE 84 HD2 PHE 84 10.865 -4.360 -1.579 651 HE1 PHE 84 HE1 PHE 84 6.542 -4.078 0.841 652 HE2 PHE 84 HE2 PHE 84 8.846 -3.502 -2.738 653 HZ PHE 84 HZ PHE 84 6.688 -3.362 -1.529 654 H MET 85 H MET 85 9.521 -7.939 -0.470 655 HA MET 85 HA MET 85 10.973 -7.717 -2.922 656 HB2 MET 85 1HB MET 85 12.297 -9.535 -1.851 657 HB3 MET 85 2HB MET 85 10.819 -10.486 -1.695 658 HG2 MET 85 1HG MET 85 10.530 -10.499 -4.128 659 HG3 MET 85 2HG MET 85 11.946 -9.466 -4.323 660 HE1 MET 85 3HE MET 85 13.016 -12.964 -5.723 661 HE2 MET 85 1HE MET 85 12.897 -11.232 -6.059 662 HE3 MET 85 2HE MET 85 11.440 -12.182 -5.797 663 H LEU 86 H LEU 86 9.608 -7.981 -4.619 664 HA LEU 86 HA LEU 86 6.825 -8.756 -3.988 665 HB2 LEU 86 1HB LEU 86 6.589 -7.788 -6.459 666 HB3 LEU 86 2HB LEU 86 6.693 -6.705 -5.075 667 HG LEU 86 HG LEU 86 9.266 -7.576 -6.362 668 HD11 LEU 86 1HD1 LEU 86 7.447 -5.435 -7.495 669 HD12 LEU 86 2HD1 LEU 86 7.878 -6.950 -8.286 670 HD13 LEU 86 3HD1 LEU 86 9.113 -5.725 -7.993 671 HD21 LEU 86 3HD2 LEU 86 10.109 -5.579 -5.462 672 HD22 LEU 86 1HD2 LEU 86 8.897 -6.023 -4.262 673 HD23 LEU 86 2HD2 LEU 86 8.532 -4.790 -5.467 674 H GLU 87 H GLU 87 6.213 -10.790 -4.497 675 HA GLU 87 HA GLU 87 7.735 -12.232 -6.589 676 HB2 GLU 87 1HB GLU 87 6.097 -13.224 -4.247 677 HB3 GLU 87 2HB GLU 87 6.775 -14.266 -5.497 678 HG2 GLU 87 1HG GLU 87 9.035 -13.519 -4.949 679 HG3 GLU 87 2HG GLU 87 8.397 -12.385 -3.758 680 H GLU 88 H GLU 88 6.766 -12.426 -8.461 681 HA GLU 88 HA GLU 88 4.026 -11.812 -8.926 682 HB2 GLU 88 1HB GLU 88 6.036 -13.308 -10.636 683 HB3 GLU 88 2HB GLU 88 4.456 -12.762 -11.194 684 HG2 GLU 88 1HG GLU 88 5.874 -11.019 -11.882 685 HG3 GLU 88 2HG GLU 88 5.230 -10.410 -10.360 686 H VAL 89 H VAL 89 2.252 -13.191 -9.246 687 HA VAL 89 HA VAL 89 2.440 -15.756 -7.887 688 HB VAL 89 HB VAL 89 0.125 -14.443 -9.302 689 HG11 VAL 89 1HG1 VAL 89 -1.158 -16.112 -7.800 690 HG12 VAL 89 2HG1 VAL 89 0.380 -16.964 -7.674 691 HG13 VAL 89 3HG1 VAL 89 -0.380 -16.745 -9.249 692 HG21 VAL 89 3HG2 VAL 89 -0.620 -14.161 -6.843 693 HG22 VAL 89 1HG2 VAL 89 0.669 -13.097 -7.409 694 HG23 VAL 89 2HG2 VAL 89 1.057 -14.511 -6.428 695 H SER 90 H SER 90 2.076 -17.762 -8.791 696 HA SER 90 HA SER 90 3.271 -18.477 -11.121 697 HB2 SER 90 1HB SER 90 0.878 -19.755 -9.799 698 HB3 SER 90 2HB SER 90 1.792 -20.518 -11.094 699 HG SER 90 HG SER 90 3.666 -19.978 -9.607 700 HA PRO 91 HA PRO 91 0.580 -17.023 -14.363 701 HB2 PRO 91 1HB PRO 91 1.287 -18.634 -16.428 702 HB3 PRO 91 2HB PRO 91 2.373 -17.392 -15.782 703 HG2 PRO 91 1HG PRO 91 2.333 -20.332 -15.249 704 HG3 PRO 91 2HG PRO 91 3.717 -19.266 -15.565 705 HD2 PRO 91 1HD PRO 91 2.992 -20.067 -13.041 706 HD3 PRO 91 2HD PRO 91 3.800 -18.514 -13.369 707 H ASP 92 H ASP 92 -0.619 -18.915 -12.546 708 HA ASP 92 HA ASP 92 -2.030 -20.923 -14.035 709 HB2 ASP 92 1HB ASP 92 -3.345 -21.244 -12.005 710 HB3 ASP 92 2HB ASP 92 -1.631 -21.148 -11.613 711 H GLY 93 H GLY 93 -2.191 -18.123 -15.016 712 HA2 GLY 93 1HA GLY 93 -4.717 -16.964 -14.552 713 HA3 GLY 93 2HA GLY 93 -3.727 -16.718 -15.987 714 H GLU 94 H GLU 94 -5.263 -16.854 -17.555 715 HA GLU 94 HA GLU 94 -6.258 -19.492 -18.203 716 HB2 GLU 94 1HB GLU 94 -8.628 -18.868 -18.240 717 HB3 GLU 94 2HB GLU 94 -7.970 -18.717 -16.613 718 HG2 GLU 94 1HG GLU 94 -7.656 -16.285 -16.978 719 HG3 GLU 94 2HG GLU 94 -8.370 -16.444 -18.583 720 H LEU 95 H LEU 95 -5.291 -16.379 -19.009 721 HA LEU 95 HA LEU 95 -5.244 -16.906 -21.787 722 HB2 LEU 95 1HB LEU 95 -7.654 -16.500 -21.697 723 HB3 LEU 95 2HB LEU 95 -7.385 -14.968 -20.872 724 HG LEU 95 HG LEU 95 -6.217 -14.074 -22.843 725 HD11 LEU 95 1HD1 LEU 95 -5.120 -15.878 -23.867 726 HD12 LEU 95 2HD1 LEU 95 -6.446 -15.567 -24.986 727 HD13 LEU 95 3HD1 LEU 95 -6.559 -16.899 -23.836 728 HD21 LEU 95 3HD2 LEU 95 -8.879 -15.386 -23.464 729 HD22 LEU 95 1HD2 LEU 95 -8.144 -14.112 -24.439 730 HD23 LEU 95 2HD2 LEU 95 -8.629 -13.782 -22.775 731 H TYR 96 H TYR 96 -5.915 -13.933 -19.915 732 HA TYR 96 HA TYR 96 -3.387 -12.812 -20.939 733 HB2 TYR 96 1HB TYR 96 -4.452 -10.599 -20.205 734 HB3 TYR 96 2HB TYR 96 -5.123 -11.392 -21.629 735 HD1 TYR 96 HD1 TYR 96 -5.569 -11.205 -17.906 736 HD2 TYR 96 HD2 TYR 96 -7.423 -11.858 -21.729 737 HE1 TYR 96 HE1 TYR 96 -7.793 -11.275 -16.815 738 HE2 TYR 96 HE2 TYR 96 -9.648 -11.929 -20.633 739 HH TYR 96 HH TYR 96 -10.312 -12.558 -17.857 740 H ILE 97 H ILE 97 -5.106 -13.662 -18.092 741 HA ILE 97 HA ILE 97 -4.280 -14.057 -15.959 742 HB ILE 97 HB ILE 97 -1.837 -12.492 -16.811 743 HG12 ILE 97 1HG1 ILE 97 -1.769 -15.481 -16.576 744 HG13 ILE 97 2HG1 ILE 97 -2.565 -14.831 -18.001 745 HG21 ILE 97 1HG2 ILE 97 -2.456 -12.964 -14.276 746 HG22 ILE 97 2HG2 ILE 97 -0.806 -13.161 -14.847 747 HG23 ILE 97 3HG2 ILE 97 -1.841 -14.569 -14.653 748 HD11 ILE 97 3HD1 ILE 97 -0.138 -15.268 -18.347 749 HD12 ILE 97 1HD1 ILE 97 0.218 -14.064 -17.107 750 HD13 ILE 97 2HD1 ILE 97 -0.579 -13.579 -18.601 751 H LEU 98 H LEU 98 -3.208 -10.840 -17.081 752 HA LEU 98 HA LEU 98 -4.197 -9.609 -14.647 753 HB2 LEU 98 1HB LEU 98 -2.773 -8.588 -17.102 754 HB3 LEU 98 2HB LEU 98 -3.448 -7.477 -15.911 755 HG LEU 98 HG LEU 98 -2.108 -8.589 -14.141 756 HD11 LEU 98 1HD1 LEU 98 -1.786 -10.806 -14.917 757 HD12 LEU 98 2HD1 LEU 98 -0.189 -10.069 -15.056 758 HD13 LEU 98 3HD1 LEU 98 -1.201 -10.258 -16.488 759 HD21 LEU 98 3HD2 LEU 98 0.047 -7.670 -14.829 760 HD22 LEU 98 1HD2 LEU 98 -1.243 -6.615 -15.407 761 HD23 LEU 98 2HD2 LEU 98 -0.444 -7.722 -16.521 762 H GLY 99 H GLY 99 -4.637 -8.513 -17.987 763 HA2 GLY 99 1HA GLY 99 -6.485 -7.758 -19.132 764 HA3 GLY 99 2HA GLY 99 -7.444 -8.844 -18.134 765 H SER 100 H SER 100 -8.607 -8.043 -16.444 766 HA SER 100 HA SER 100 -8.461 -5.121 -15.955 767 HB2 SER 100 1HB SER 100 -10.854 -5.265 -15.375 768 HB3 SER 100 2HB SER 100 -10.549 -5.766 -17.035 769 HG SER 100 HG SER 100 -10.276 -7.920 -15.608 770 H ASP 101 H ASP 101 -6.767 -6.892 -14.684 771 HA ASP 101 HA ASP 101 -7.224 -6.296 -11.938 772 HB2 ASP 101 1HB ASP 101 -7.346 -8.584 -11.069 773 HB3 ASP 101 2HB ASP 101 -8.735 -8.241 -12.098 774 H VAL 102 H VAL 102 -5.363 -6.843 -10.632 775 HA VAL 102 HA VAL 102 -2.990 -7.751 -12.156 776 HB VAL 102 HB VAL 102 -3.232 -5.359 -10.332 777 HG11 VAL 102 1HG1 VAL 102 -0.797 -6.911 -11.231 778 HG12 VAL 102 2HG1 VAL 102 -1.215 -6.400 -9.596 779 HG13 VAL 102 3HG1 VAL 102 -0.692 -5.208 -10.787 780 HG21 VAL 102 3HG2 VAL 102 -3.684 -5.317 -12.886 781 HG22 VAL 102 1HG2 VAL 102 -1.945 -5.535 -13.055 782 HG23 VAL 102 2HG2 VAL 102 -2.579 -4.112 -12.227 783 H THR 103 H THR 103 -1.795 -9.223 -11.179 784 HA THR 103 HA THR 103 -2.519 -9.956 -8.383 785 HB THR 103 HB THR 103 -1.079 -11.816 -10.271 786 HG1 THR 103 HG1 THR 103 -2.885 -12.250 -11.283 787 HG21 THR 103 3HG2 THR 103 -1.942 -13.492 -8.832 788 HG22 THR 103 1HG2 THR 103 -3.170 -12.410 -8.175 789 HG23 THR 103 2HG2 THR 103 -1.476 -12.190 -7.739 790 H VAL 104 H VAL 104 -1.123 -9.370 -6.929 791 HA VAL 104 HA VAL 104 1.768 -9.643 -7.424 792 HB VAL 104 HB VAL 104 0.927 -7.238 -7.749 793 HG11 VAL 104 1HG1 VAL 104 -0.650 -7.433 -5.743 794 HG12 VAL 104 2HG1 VAL 104 0.326 -5.966 -5.825 795 HG13 VAL 104 3HG1 VAL 104 0.782 -7.268 -4.728 796 HG21 VAL 104 3HG2 VAL 104 3.280 -7.708 -7.362 797 HG22 VAL 104 1HG2 VAL 104 2.997 -7.912 -5.634 798 HG23 VAL 104 2HG2 VAL 104 2.825 -6.321 -6.375 799 H GLN 105 H GLN 105 2.901 -10.344 -5.650 800 HA GLN 105 HA GLN 105 1.348 -10.812 -3.157 801 HB2 GLN 105 1HB GLN 105 1.984 -12.833 -4.678 802 HB3 GLN 105 2HB GLN 105 3.619 -12.575 -4.077 803 HG2 GLN 105 1HG GLN 105 1.205 -12.951 -2.283 804 HG3 GLN 105 2HG GLN 105 2.299 -14.248 -2.745 805 HE21 GLN 105 2HE2 GLN 105 1.778 -11.814 -0.422 806 HE22 GLN 105 1HE2 GLN 105 3.328 -11.815 0.270 807 H LEU 106 H LEU 106 2.113 -9.436 -1.602 808 HA LEU 106 HA LEU 106 4.792 -8.400 -1.724 809 HB2 LEU 106 1HB LEU 106 2.718 -8.164 0.472 810 HB3 LEU 106 2HB LEU 106 4.117 -7.121 0.218 811 HG LEU 106 HG LEU 106 1.808 -7.453 -1.716 812 HD11 LEU 106 1HD1 LEU 106 2.555 -5.056 -0.015 813 HD12 LEU 106 2HD1 LEU 106 1.312 -6.222 0.439 814 HD13 LEU 106 3HD1 LEU 106 1.117 -5.246 -1.018 815 HD21 LEU 106 3HD2 LEU 106 2.993 -5.287 -2.639 816 HD22 LEU 106 1HD2 LEU 106 3.643 -6.869 -3.062 817 HD23 LEU 106 2HD2 LEU 106 4.405 -5.914 -1.790 818 H ASN 107 H ASN 107 6.479 -9.355 -0.911 819 HA ASN 107 HA ASN 107 6.146 -11.389 1.253 820 HB2 ASN 107 1HB ASN 107 8.487 -11.147 -0.623 821 HB3 ASN 107 2HB ASN 107 8.091 -12.483 0.455 822 HD21 ASN 107 2HD2 ASN 107 6.428 -10.617 -2.139 823 HD22 ASN 107 1HD2 ASN 107 5.737 -11.980 -2.870 824 H THR 108 H THR 108 6.157 -9.180 2.565 825 HA THR 108 HA THR 108 8.767 -8.068 2.985 826 HB THR 108 HB THR 108 6.503 -7.842 4.960 827 HG1 THR 108 HG1 THR 108 5.572 -7.486 2.964 828 HG21 THR 108 3HG2 THR 108 8.850 -6.140 4.119 829 HG22 THR 108 1HG2 THR 108 8.342 -6.617 5.741 830 HG23 THR 108 2HG2 THR 108 7.434 -5.402 4.853 831 H ALA 109 H ALA 109 9.399 -7.950 5.442 832 HA ALA 109 HA ALA 109 10.635 -10.300 6.126 833 HB1 ALA 109 3HB ALA 109 10.808 -7.855 7.116 834 HB2 ALA 109 1HB ALA 109 11.304 -9.245 8.082 835 HB3 ALA 109 2HB ALA 109 9.727 -8.498 8.349 836 H GLU 110 H GLU 110 7.407 -9.223 7.121 837 HA GLU 110 HA GLU 110 6.871 -11.966 8.112 838 HB2 GLU 110 1HB GLU 110 5.511 -11.000 9.921 839 HB3 GLU 110 2HB GLU 110 7.194 -10.486 10.048 840 HG2 GLU 110 1HG GLU 110 6.605 -8.370 8.881 841 HG3 GLU 110 2HG GLU 110 4.917 -8.875 8.859 842 H LEU 111 H LEU 111 5.643 -8.970 6.701 843 HA LEU 111 HA LEU 111 2.972 -9.851 6.387 844 HB2 LEU 111 1HB LEU 111 4.086 -7.451 6.161 845 HB3 LEU 111 2HB LEU 111 4.242 -7.912 4.472 846 HG LEU 111 HG LEU 111 2.169 -6.701 4.748 847 HD11 LEU 111 1HD1 LEU 111 0.721 -8.177 3.662 848 HD12 LEU 111 2HD1 LEU 111 1.267 -9.564 4.595 849 HD13 LEU 111 3HD1 LEU 111 2.301 -8.884 3.338 850 HD21 LEU 111 3HD2 LEU 111 0.621 -7.021 6.426 851 HD22 LEU 111 1HD2 LEU 111 2.060 -7.546 7.294 852 HD23 LEU 111 2HD2 LEU 111 0.967 -8.740 6.590 853 H LYS 112 H LYS 112 2.145 -11.239 4.994 854 HA LYS 112 HA LYS 112 3.371 -11.697 2.405 855 HB2 LYS 112 1HB LYS 112 4.522 -13.281 4.026 856 HB3 LYS 112 2HB LYS 112 2.955 -14.071 4.214 857 HG2 LYS 112 1HG LYS 112 2.851 -14.532 1.821 858 HG3 LYS 112 2HG LYS 112 4.349 -13.638 1.556 859 HD2 LYS 112 1HD LYS 112 5.554 -15.240 2.996 860 HD3 LYS 112 2HD LYS 112 4.059 -16.148 3.226 861 HE2 LYS 112 1HE LYS 112 3.923 -16.581 0.815 862 HE3 LYS 112 2HE LYS 112 5.383 -15.625 0.548 863 HZ1 LYS 112 3HZ LYS 112 5.474 -17.836 2.474 864 HZ2 LYS 112 1HZ LYS 112 6.707 -17.207 1.495 865 HZ3 LYS 112 2HZ LYS 112 5.511 -18.203 0.816 866 H LEU 113 H LEU 113 1.500 -10.917 1.521 867 HA LEU 113 HA LEU 113 -0.826 -12.741 1.703 868 HB2 LEU 113 1HB LEU 113 -0.697 -9.987 2.690 869 HB3 LEU 113 2HB LEU 113 -1.952 -10.152 1.472 870 HG LEU 113 HG LEU 113 -2.888 -10.563 3.679 871 HD11 LEU 113 1HD1 LEU 113 -3.274 -12.203 1.515 872 HD12 LEU 113 2HD1 LEU 113 -4.201 -12.294 3.003 873 HD13 LEU 113 3HD1 LEU 113 -2.839 -13.381 2.749 874 HD21 LEU 113 3HD2 LEU 113 -1.945 -11.862 5.309 875 HD22 LEU 113 1HD2 LEU 113 -0.462 -11.565 4.408 876 HD23 LEU 113 2HD2 LEU 113 -1.353 -13.068 4.173 877 H VAL 114 H VAL 114 -2.553 -11.764 0.018 878 HA VAL 114 HA VAL 114 -1.128 -11.158 -2.511 879 HB VAL 114 HB VAL 114 -3.375 -13.135 -2.028 880 HG11 VAL 114 1HG1 VAL 114 -3.924 -12.091 -4.078 881 HG12 VAL 114 2HG1 VAL 114 -3.025 -13.531 -4.554 882 HG13 VAL 114 3HG1 VAL 114 -2.234 -11.955 -4.561 883 HG21 VAL 114 3HG2 VAL 114 -0.879 -13.739 -1.596 884 HG22 VAL 114 1HG2 VAL 114 -0.719 -13.673 -3.353 885 HG23 VAL 114 2HG2 VAL 114 -1.834 -14.819 -2.612 886 H PHE 115 H PHE 115 -1.956 -9.418 -3.553 887 HA PHE 115 HA PHE 115 -4.692 -8.522 -2.870 888 HB2 PHE 115 1HB PHE 115 -2.191 -6.885 -3.332 889 HB3 PHE 115 2HB PHE 115 -3.816 -6.199 -3.412 890 HD1 PHE 115 HD1 PHE 115 -1.474 -8.062 -1.177 891 HD2 PHE 115 HD2 PHE 115 -5.008 -5.637 -1.461 892 HE1 PHE 115 HE1 PHE 115 -1.528 -7.848 1.295 893 HE2 PHE 115 HE2 PHE 115 -5.061 -5.417 1.004 894 HZ PHE 115 HZ PHE 115 -3.324 -6.528 2.385 895 H GLN 116 H GLN 116 -5.984 -7.874 -4.504 896 HA GLN 116 HA GLN 116 -5.025 -8.363 -7.258 897 HB2 GLN 116 1HB GLN 116 -6.889 -9.811 -6.333 898 HB3 GLN 116 2HB GLN 116 -7.888 -8.360 -6.327 899 HG2 GLN 116 1HG GLN 116 -8.307 -9.512 -8.400 900 HG3 GLN 116 2HG GLN 116 -7.358 -8.076 -8.770 901 HE21 GLN 116 2HE2 GLN 116 -5.517 -8.423 -9.990 902 HE22 GLN 116 1HE2 GLN 116 -4.763 -9.931 -10.208 903 H LEU 117 H LEU 117 -4.211 -6.218 -7.555 904 HA LEU 117 HA LEU 117 -5.963 -3.948 -7.187 905 HB2 LEU 117 1HB LEU 117 -3.179 -4.371 -8.240 906 HB3 LEU 117 2HB LEU 117 -3.977 -2.821 -8.468 907 HG LEU 117 HG LEU 117 -2.517 -3.014 -6.402 908 HD11 LEU 117 1HD1 LEU 117 -3.896 -1.629 -5.115 909 HD12 LEU 117 2HD1 LEU 117 -5.364 -2.488 -5.565 910 HD13 LEU 117 3HD1 LEU 117 -4.570 -1.432 -6.729 911 HD21 LEU 117 3HD2 LEU 117 -4.795 -4.674 -5.307 912 HD22 LEU 117 1HD2 LEU 117 -3.252 -4.296 -4.541 913 HD23 LEU 117 2HD2 LEU 117 -3.304 -5.386 -5.926 914 HA PRO 118 HA PRO 118 -7.719 -4.140 -11.269 915 HB2 PRO 118 1HB PRO 118 -8.582 -1.604 -11.653 916 HB3 PRO 118 2HB PRO 118 -9.309 -2.673 -10.437 917 HG2 PRO 118 1HG PRO 118 -7.328 -0.478 -10.081 918 HG3 PRO 118 2HG PRO 118 -8.720 -0.914 -9.074 919 HD2 PRO 118 1HD PRO 118 -6.090 -1.621 -8.500 920 HD3 PRO 118 2HD PRO 118 -7.521 -2.487 -7.888 921 H PHE 119 H PHE 119 -6.618 -4.379 -13.126 922 HA PHE 119 HA PHE 119 -4.183 -3.277 -13.765 923 HB2 PHE 119 1HB PHE 119 -5.107 -5.350 -14.715 924 HB3 PHE 119 2HB PHE 119 -6.314 -4.405 -15.577 925 HD1 PHE 119 HD2 PHE 119 -2.631 -4.753 -15.141 926 HD2 PHE 119 HD1 PHE 119 -5.846 -3.572 -17.726 927 HE1 PHE 119 HE2 PHE 119 -1.016 -4.407 -16.989 928 HE2 PHE 119 HE1 PHE 119 -4.234 -3.223 -19.577 929 HZ PHE 119 HZ PHE 119 -1.817 -3.640 -19.207 930 H GLY 120 H GLY 120 -3.445 -1.742 -15.065 931 HA2 GLY 120 1HA GLY 120 -4.332 -0.239 -17.028 932 HA3 GLY 120 2HA GLY 120 -5.257 0.478 -15.711 933 H SER 121 H SER 121 -3.742 2.207 -16.911 934 HA SER 121 HA SER 121 -1.032 2.382 -16.141 935 HB2 SER 121 1HB SER 121 -1.230 4.750 -16.754 936 HB3 SER 121 2HB SER 121 -2.024 3.732 -17.951 937 HG SER 121 HG SER 121 -3.099 5.489 -16.069 938 H HIS 122 H HIS 122 -3.983 2.939 -14.434 939 HA HIS 122 HA HIS 122 -3.000 4.739 -12.469 940 HB2 HIS 122 1HB HIS 122 -5.456 4.134 -13.032 941 HB3 HIS 122 2HB HIS 122 -5.212 2.745 -11.975 942 HD2 HIS 122 HD2 HIS 122 -6.080 3.436 -9.437 943 HE1 HIS 122 HE1 HIS 122 -4.960 7.503 -9.488 944 HE2 HIS 122 HE2 HIS 122 -6.027 5.671 -8.094 945 H THR 123 H THR 123 -3.242 1.166 -12.571 946 HA THR 123 HA THR 123 -2.117 0.874 -9.941 947 HB THR 123 HB THR 123 -2.697 -1.140 -12.119 948 HG1 THR 123 HG1 THR 123 -4.378 -1.672 -10.682 949 HG21 THR 123 3HG2 THR 123 -0.925 -2.086 -10.842 950 HG22 THR 123 1HG2 THR 123 -2.397 -2.770 -10.160 951 HG23 THR 123 2HG2 THR 123 -1.572 -1.451 -9.330 952 H ARG 124 H ARG 124 -0.957 0.548 -13.269 953 HA ARG 124 HA ARG 124 1.503 -0.639 -12.791 954 HB2 ARG 124 1HB ARG 124 0.692 -0.352 -15.038 955 HB3 ARG 124 2HB ARG 124 0.680 1.401 -14.867 956 HG2 ARG 124 1HG ARG 124 3.171 1.353 -14.590 957 HG3 ARG 124 2HG ARG 124 3.134 -0.390 -14.844 958 HD2 ARG 124 1HD ARG 124 3.687 1.008 -16.857 959 HD3 ARG 124 2HD ARG 124 2.350 -0.121 -17.075 960 HE ARG 124 HE ARG 124 0.879 1.711 -17.204 961 HH11 ARG 124 1HH2 ARG 124 4.071 2.664 -16.260 962 HH12 ARG 124 2HH2 ARG 124 3.783 4.356 -16.494 963 HH21 ARG 124 1HH1 ARG 124 0.499 3.929 -17.515 964 HH22 ARG 124 2HH1 ARG 124 1.761 5.073 -17.203 965 H THR 125 H THR 125 0.587 2.760 -12.665 966 HA THR 125 HA THR 125 3.147 3.828 -12.417 967 HB THR 125 HB THR 125 0.546 4.813 -11.203 968 HG1 THR 125 HG1 THR 125 0.354 5.926 -13.069 969 HG21 THR 125 3HG2 THR 125 3.253 6.116 -11.549 970 HG22 THR 125 1HG2 THR 125 2.320 5.930 -10.064 971 HG23 THR 125 2HG2 THR 125 1.773 7.045 -11.315 972 H PHE 126 H PHE 126 0.940 2.493 -10.014 973 HA PHE 126 HA PHE 126 2.272 3.209 -7.671 974 HB2 PHE 126 1HB PHE 126 0.019 2.155 -7.769 975 HB3 PHE 126 2HB PHE 126 0.788 0.625 -8.182 976 HD1 PHE 126 HD2 PHE 126 2.139 -0.601 -6.546 977 HD2 PHE 126 HD1 PHE 126 0.234 3.112 -5.539 978 HE1 PHE 126 HE2 PHE 126 2.532 -1.050 -4.137 979 HE2 PHE 126 HE1 PHE 126 0.627 2.667 -3.132 980 HZ PHE 126 HZ PHE 126 1.780 0.585 -2.431 981 H LEU 127 H LEU 127 2.672 0.216 -9.625 982 HA LEU 127 HA LEU 127 4.501 -1.089 -8.068 983 HB2 LEU 127 1HB LEU 127 4.704 -0.916 -11.084 984 HB3 LEU 127 2HB LEU 127 5.215 -2.244 -10.046 985 HG LEU 127 HG LEU 127 2.357 -1.309 -10.418 986 HD11 LEU 127 1HD1 LEU 127 3.084 -2.416 -12.412 987 HD12 LEU 127 2HD1 LEU 127 2.167 -3.611 -11.495 988 HD13 LEU 127 3HD1 LEU 127 3.931 -3.661 -11.492 989 HD21 LEU 127 3HD2 LEU 127 2.458 -2.231 -8.239 990 HD22 LEU 127 1HD2 LEU 127 3.671 -3.425 -8.699 991 HD23 LEU 127 2HD2 LEU 127 2.002 -3.615 -9.229 992 H GLN 128 H GLN 128 5.245 1.311 -10.621 993 HA GLN 128 HA GLN 128 8.005 1.189 -10.422 994 HB2 GLN 128 1HB GLN 128 6.416 3.658 -11.111 995 HB3 GLN 128 2HB GLN 128 7.999 3.179 -11.721 996 HG2 GLN 128 1HG GLN 128 5.350 1.814 -12.269 997 HG3 GLN 128 2HG GLN 128 6.345 2.686 -13.430 998 HE21 GLN 128 2HE2 GLN 128 5.487 -0.327 -13.085 999 HE22 GLN 128 1HE2 GLN 128 6.948 -1.151 -13.307 1000 H GLU 129 H GLU 129 5.692 3.211 -8.631 1001 HA GLU 129 HA GLU 129 7.566 4.898 -7.395 1002 HB2 GLU 129 1HB GLU 129 4.880 3.930 -6.392 1003 HB3 GLU 129 2HB GLU 129 5.812 5.234 -5.658 1004 HG2 GLU 129 1HG GLU 129 4.901 5.213 -8.544 1005 HG3 GLU 129 2HG GLU 129 4.058 6.050 -7.244 1006 H VAL 130 H VAL 130 6.373 1.690 -6.465 1007 HA VAL 130 HA VAL 130 7.594 1.646 -3.908 1008 HB VAL 130 HB VAL 130 6.719 -0.568 -5.776 1009 HG11 VAL 130 1HG1 VAL 130 6.822 -1.939 -3.598 1010 HG12 VAL 130 2HG1 VAL 130 7.870 -0.661 -2.980 1011 HG13 VAL 130 3HG1 VAL 130 8.358 -1.600 -4.393 1012 HG21 VAL 130 3HG2 VAL 130 4.959 0.917 -4.842 1013 HG22 VAL 130 1HG2 VAL 130 5.542 0.559 -3.215 1014 HG23 VAL 130 2HG2 VAL 130 4.839 -0.723 -4.202 1015 H ALA 131 H ALA 131 8.610 0.459 -7.067 1016 HA ALA 131 HA ALA 131 11.024 -0.755 -6.374 1017 HB1 ALA 131 3HB ALA 131 9.847 -0.742 -8.642 1018 HB2 ALA 131 1HB ALA 131 11.609 -0.669 -8.663 1019 HB3 ALA 131 2HB ALA 131 10.663 0.794 -8.933 1020 H ARG 132 H ARG 132 10.530 2.633 -7.400 1021 HA ARG 132 HA ARG 132 13.281 3.338 -7.061 1022 HB2 ARG 132 1HB ARG 132 10.792 5.040 -7.293 1023 HB3 ARG 132 2HB ARG 132 12.437 5.681 -7.279 1024 HG2 ARG 132 1HG ARG 132 12.998 4.360 -9.265 1025 HG3 ARG 132 2HG ARG 132 11.385 3.646 -9.266 1026 HD2 ARG 132 1HD ARG 132 11.467 5.472 -10.885 1027 HD3 ARG 132 2HD ARG 132 10.407 5.914 -9.549 1028 HE ARG 132 HE ARG 132 13.014 6.829 -8.975 1029 HH11 ARG 132 1HH2 ARG 132 10.394 7.350 -11.174 1030 HH12 ARG 132 2HH2 ARG 132 10.749 9.028 -11.415 1031 HH21 ARG 132 1HH1 ARG 132 13.483 9.027 -9.281 1032 HH22 ARG 132 2HH1 ARG 132 12.499 9.978 -10.343 1033 H ALA 133 H ALA 133 10.634 2.992 -4.941 1034 HA ALA 133 HA ALA 133 11.141 4.842 -2.942 1035 HB1 ALA 133 3HB ALA 133 9.780 3.537 -1.555 1036 HB2 ALA 133 1HB ALA 133 10.283 2.031 -2.315 1037 HB3 ALA 133 2HB ALA 133 9.222 3.144 -3.178 1038 H CYS 134 H CYS 134 13.047 2.152 -3.862 1039 HA CYS 134 HA CYS 134 15.345 2.673 -2.624 1040 HB2 CYS 134 1HB CYS 134 14.724 2.879 -0.407 1041 HB3 CYS 134 2HB CYS 134 13.447 1.681 -0.530 1042 HG CYS 134 HG CYS 134 15.048 0.039 0.388 1043 HA PRO 135 HA PRO 135 14.939 -2.222 -2.857 1044 HB2 PRO 135 1HB PRO 135 12.775 -2.256 -4.919 1045 HB3 PRO 135 2HB PRO 135 13.084 -3.381 -3.579 1046 HG2 PRO 135 1HG PRO 135 11.107 -1.603 -3.450 1047 HG3 PRO 135 2HG PRO 135 12.080 -1.999 -2.018 1048 HD2 PRO 135 1HD PRO 135 12.210 0.437 -3.771 1049 HD3 PRO 135 2HD PRO 135 12.411 0.304 -2.013 1050 H GLY 136 H GLY 136 14.007 -0.370 -5.775 1051 HA2 GLY 136 1HA GLY 136 14.922 -1.322 -7.944 1052 HA3 GLY 136 2HA GLY 136 15.594 0.239 -7.485 1053 H PHE 137 H PHE 137 16.099 -3.223 -7.444 1054 HA PHE 137 HA PHE 137 18.226 -4.034 -6.312 1055 HB2 PHE 137 1HB PHE 137 19.087 -5.123 -8.378 1056 HB3 PHE 137 2HB PHE 137 17.340 -5.272 -8.187 1057 HD1 PHE 137 HD1 PHE 137 15.830 -3.619 -9.412 1058 HD2 PHE 137 HD2 PHE 137 20.013 -4.057 -10.283 1059 HE1 PHE 137 HE1 PHE 137 15.488 -2.519 -11.609 1060 HE2 PHE 137 HE2 PHE 137 19.672 -2.954 -12.476 1061 HZ PHE 137 HZ PHE 137 17.410 -2.185 -13.140 1062 H ASP 138 H ASP 138 19.243 -2.111 -5.485 1063 HA ASP 138 HA ASP 138 21.647 -1.426 -7.023 1064 HB2 ASP 138 1HB ASP 138 21.363 0.979 -6.562 1065 HB3 ASP 138 2HB ASP 138 20.066 0.351 -7.567 1066 HA PRO 139 HA PRO 139 23.401 -1.855 -2.963 1067 HB2 PRO 139 1HB PRO 139 25.781 -0.541 -3.235 1068 HB3 PRO 139 2HB PRO 139 25.454 -2.102 -4.017 1069 HG2 PRO 139 1HG PRO 139 25.377 0.646 -5.181 1070 HG3 PRO 139 2HG PRO 139 25.999 -0.857 -5.884 1071 HD2 PRO 139 1HD PRO 139 23.533 0.192 -6.512 1072 HD3 PRO 139 2HD PRO 139 23.910 -1.543 -6.604 1073 H GLU 140 H GLU 140 21.910 0.809 -3.893 1074 HA GLU 140 HA GLU 140 22.991 2.779 -2.075 1075 HB2 GLU 140 1HB GLU 140 20.470 2.688 -3.746 1076 HB3 GLU 140 2HB GLU 140 20.936 4.069 -2.749 1077 HG2 GLU 140 1HG GLU 140 23.049 4.276 -3.984 1078 HG3 GLU 140 2HG GLU 140 22.635 2.865 -4.956 1079 H THR 141 H THR 141 20.183 0.629 -2.170 1080 HA THR 141 HA THR 141 18.836 1.502 0.102 1081 HB THR 141 HB THR 141 17.830 -0.035 -1.462 1082 HG1 THR 141 HG1 THR 141 17.949 -1.796 0.616 1083 HG21 THR 141 3HG2 THR 141 20.177 -1.301 -1.690 1084 HG22 THR 141 1HG2 THR 141 18.652 -2.120 -2.035 1085 HG23 THR 141 2HG2 THR 141 19.446 -2.348 -0.477 1086 H ARG 142 H ARG 142 20.928 -1.389 -0.067 1087 HA ARG 142 HA ARG 142 21.807 -2.627 1.691 1088 HB2 ARG 142 1HB ARG 142 23.078 0.088 1.918 1089 HB3 ARG 142 2HB ARG 142 23.679 -1.356 2.735 1090 HG2 ARG 142 1HG ARG 142 23.995 -2.489 0.605 1091 HG3 ARG 142 2HG ARG 142 23.278 -1.128 -0.258 1092 HD2 ARG 142 1HD ARG 142 25.720 -0.985 -0.379 1093 HD3 ARG 142 2HD ARG 142 25.087 0.341 0.594 1094 HE ARG 142 HE ARG 142 26.077 -0.615 2.487 1095 HH11 ARG 142 1HH2 ARG 142 26.162 -2.746 -0.238 1096 HH12 ARG 142 2HH2 ARG 142 27.260 -3.866 0.497 1097 HH21 ARG 142 1HH1 ARG 142 27.514 -2.081 3.460 1098 HH22 ARG 142 2HH1 ARG 142 28.025 -3.490 2.593 1099 H ASP 143 H ASP 143 21.990 0.399 3.368 1100 HA ASP 143 HA ASP 143 20.742 -0.803 5.724 1101 HB2 ASP 143 1HB ASP 143 22.953 0.360 5.859 1102 HB3 ASP 143 2HB ASP 143 22.117 1.869 5.486 1103 HA PRO 144 HA PRO 144 17.187 1.780 4.486 1104 HB2 PRO 144 1HB PRO 144 15.258 0.430 5.846 1105 HB3 PRO 144 2HB PRO 144 15.945 -0.175 4.327 1106 HG2 PRO 144 1HG PRO 144 16.508 -1.026 7.124 1107 HG3 PRO 144 2HG PRO 144 16.417 -1.996 5.643 1108 HD2 PRO 144 1HD PRO 144 18.787 -1.131 6.842 1109 HD3 PRO 144 2HD PRO 144 18.636 -1.654 5.151 1110 H GLU 145 H GLU 145 15.113 2.171 6.311 1111 HA GLU 145 HA GLU 145 15.880 2.883 8.925 1112 HB2 GLU 145 1HB GLU 145 17.260 4.594 7.763 1113 HB3 GLU 145 2HB GLU 145 15.805 5.223 7.001 1114 HG2 GLU 145 1HG GLU 145 14.847 5.712 9.225 1115 HG3 GLU 145 2HG GLU 145 16.306 5.088 9.988 1116 H PHE 146 H PHE 146 14.095 3.591 10.115 1117 HA PHE 146 HA PHE 146 11.652 4.387 8.751 1118 HB2 PHE 146 1HB PHE 146 10.437 2.417 9.977 1119 HB3 PHE 146 2HB PHE 146 11.254 2.099 8.447 1120 HD1 PHE 146 HD1 PHE 146 13.441 0.964 8.386 1121 HD2 PHE 146 HD2 PHE 146 11.322 1.574 12.072 1122 HE1 PHE 146 HE1 PHE 146 14.907 -0.694 9.503 1123 HE2 PHE 146 HE2 PHE 146 12.787 -0.085 13.190 1124 HZ PHE 146 HZ PHE 146 14.580 -1.222 11.904 1125 H GLU 147 H GLU 147 13.705 4.908 11.080 1126 HA GLU 147 HA GLU 147 12.395 4.875 13.529 1127 HB2 GLU 147 1HB GLU 147 14.470 6.769 12.427 1128 HB3 GLU 147 2HB GLU 147 13.930 6.802 14.105 1129 HG2 GLU 147 1HG GLU 147 14.594 4.455 14.382 1130 HG3 GLU 147 2HG GLU 147 15.110 4.394 12.697 1131 H TRP 148 H TRP 148 11.701 6.879 10.814 1132 HA TRP 148 HA TRP 148 10.513 9.018 12.354 1133 HB2 TRP 148 1HB TRP 148 9.739 9.848 10.124 1134 HB3 TRP 148 2HB TRP 148 11.481 9.599 10.228 1135 HD1 TRP 148 HD1 TRP 148 12.379 7.186 9.213 1136 HE1 TRP 148 HE1 TRP 148 11.547 5.903 7.142 1137 HE3 TRP 148 HE3 TRP 148 7.799 9.372 8.602 1138 HZ2 TRP 148 HZ2 TRP 148 9.255 5.823 5.441 1139 HZ3 TRP 148 HZ3 TRP 148 6.318 8.673 6.742 1140 HH2 TRP 148 HH2 TRP 148 7.039 6.903 5.163 1141 H LEU 149 H LEU 149 9.501 5.924 11.331 1142 HA LEU 149 HA LEU 149 6.726 6.402 10.967 1143 HB2 LEU 149 1HB LEU 149 8.378 3.978 11.598 1144 HB3 LEU 149 2HB LEU 149 6.629 3.875 11.742 1145 HG LEU 149 HG LEU 149 7.579 3.195 9.489 1146 HD11 LEU 149 1HD1 LEU 149 5.183 4.270 10.007 1147 HD12 LEU 149 2HD1 LEU 149 5.693 3.931 8.356 1148 HD13 LEU 149 3HD1 LEU 149 5.804 5.571 8.996 1149 HD21 LEU 149 3HD2 LEU 149 9.256 5.183 9.585 1150 HD22 LEU 149 1HD2 LEU 149 7.907 6.140 8.977 1151 HD23 LEU 149 2HD2 LEU 149 8.520 4.787 8.035 1152 H SER 150 H SER 150 8.736 5.905 13.810 1153 HA SER 150 HA SER 150 6.891 5.263 15.749 1154 HB2 SER 150 1HB SER 150 9.195 7.212 15.917 1155 HB3 SER 150 2HB SER 150 8.354 6.535 17.308 1156 HG SER 150 HG SER 150 10.186 5.304 16.812 1157 H ARG 151 H ARG 151 7.480 8.351 14.182 1158 HA ARG 151 HA ARG 151 5.915 10.008 15.859 1159 HB2 ARG 151 1HB ARG 151 6.565 10.149 12.906 1160 HB3 ARG 151 2HB ARG 151 5.720 11.429 13.774 1161 HG2 ARG 151 1HG ARG 151 7.610 11.735 15.268 1162 HG3 ARG 151 2HG ARG 151 8.445 10.357 14.546 1163 HD2 ARG 151 1HD ARG 151 9.336 12.410 13.584 1164 HD3 ARG 151 2HD ARG 151 8.424 11.541 12.355 1165 HE ARG 151 HE ARG 151 6.748 13.405 13.709 1166 HH11 ARG 151 1HH2 ARG 151 9.300 13.135 11.380 1167 HH12 ARG 151 2HH2 ARG 151 8.868 14.587 10.541 1168 HH21 ARG 151 1HH1 ARG 151 6.183 15.301 12.618 1169 HH22 ARG 151 2HH1 ARG 151 7.102 15.815 11.244 1170 H HIS 152 H HIS 152 5.177 8.017 13.065 1171 HA HIS 152 HA HIS 152 2.378 8.709 13.036 1172 HB2 HIS 152 1HB HIS 152 4.003 6.624 11.554 1173 HB3 HIS 152 2HB HIS 152 2.275 6.876 11.311 1174 HD2 HIS 152 HD2 HIS 152 5.667 8.642 10.433 1175 HE1 HIS 152 HE1 HIS 152 2.541 10.893 8.705 1176 HE2 HIS 152 HE2 HIS 152 5.063 10.610 8.824 1177 H THR 153 H THR 153 0.716 7.404 13.671 1178 HA THR 153 HA THR 153 1.327 4.908 15.112 1179 HB THR 153 HB THR 153 -0.056 7.323 16.266 1180 HG1 THR 153 HG1 THR 153 1.290 6.601 18.055 1181 HG21 THR 153 3HG2 THR 153 -0.458 4.407 16.942 1182 HG22 THR 153 1HG2 THR 153 -1.683 5.654 16.714 1183 HG23 THR 153 2HG2 THR 153 -0.678 5.659 18.164 1184 H CYS 154 H CYS 154 -0.051 3.356 14.580 1185 HA CYS 154 HA CYS 154 -2.346 4.012 12.882 1186 HB2 CYS 154 1HB CYS 154 -2.378 1.604 12.415 1187 HB3 CYS 154 2HB CYS 154 -0.765 2.267 12.151 1188 HG CYS 154 HG CYS 154 -0.061 0.462 13.703 1189 H ALA 155 H ALA 155 -4.179 2.246 13.287 1190 HA ALA 155 HA ALA 155 -5.840 2.939 15.248 1191 HB1 ALA 155 3HB ALA 155 -5.338 0.030 14.582 1192 HB2 ALA 155 1HB ALA 155 -6.275 1.135 13.577 1193 HB3 ALA 155 2HB ALA 155 -6.834 0.728 15.202 1194 H GLU 156 H GLU 156 -6.222 2.546 17.424 1195 HA GLU 156 HA GLU 156 -4.213 2.535 19.235 1196 HB2 GLU 156 1HB GLU 156 -6.768 2.708 19.604 1197 HB3 GLU 156 2HB GLU 156 -6.700 0.966 19.865 1198 HG2 GLU 156 1HG GLU 156 -4.822 1.435 21.529 1199 HG3 GLU 156 2HG GLU 156 -5.278 3.132 21.410 1200 HA PRO 157 HA PRO 157 -2.827 -1.752 18.506 1201 HB2 PRO 157 1HB PRO 157 -0.203 -1.442 19.041 1202 HB3 PRO 157 2HB PRO 157 -0.919 -0.813 17.545 1203 HG2 PRO 157 1HG PRO 157 -0.169 0.654 20.032 1204 HG3 PRO 157 2HG PRO 157 -0.007 1.149 18.337 1205 HD2 PRO 157 1HD PRO 157 -2.093 1.939 20.043 1206 HD3 PRO 157 2HD PRO 157 -2.140 2.019 18.270 1207 H ASP 158 H ASP 158 -0.415 -0.939 20.779 1208 HA ASP 158 HA ASP 158 0.103 -1.955 22.814 1209 HB2 ASP 158 1HB ASP 158 -2.570 -0.619 23.251 1210 HB3 ASP 158 2HB ASP 158 -1.618 -1.305 24.567 1211 H ALA 159 H ALA 159 0.157 -4.142 22.480 1212 HA ALA 159 HA ALA 159 -1.916 -5.892 21.986 1213 HB1 ALA 159 3HB ALA 159 -0.474 -7.635 22.699 1214 HB2 ALA 159 1HB ALA 159 0.363 -6.580 23.837 1215 HB3 ALA 159 2HB ALA 159 0.597 -6.367 22.103 1216 H GLU 160 H GLU 160 -0.611 -5.035 25.197 1217 HA GLU 160 HA GLU 160 -2.610 -6.474 26.635 1218 HB2 GLU 160 1HB GLU 160 -0.713 -4.273 27.473 1219 HB3 GLU 160 2HB GLU 160 -1.757 -5.152 28.590 1220 HG2 GLU 160 1HG GLU 160 -0.706 -7.268 27.966 1221 HG3 GLU 160 2HG GLU 160 0.287 -6.445 26.764 1222 H SER 161 H SER 161 -2.252 -3.105 25.641 1223 HA SER 161 HA SER 161 -3.684 -1.301 25.772 1224 HB2 SER 161 1HB SER 161 -6.040 -1.846 25.137 1225 HB3 SER 161 2HB SER 161 -4.843 -2.555 24.055 1226 HG SER 161 HG SER 161 -6.700 -3.768 25.559 Start of MODEL 7 1 H1 GLY 1 1H GLY 1 -19.539 3.349 -4.998 2 H2 GLY 1 2H GLY 1 -18.200 2.323 -4.793 3 H3 GLY 1 3H GLY 1 -19.633 1.727 -5.485 4 HA2 GLY 1 1HA GLY 1 -19.045 2.365 -7.511 5 HA3 GLY 1 2HA GLY 1 -18.675 3.986 -6.922 6 HA PRO 2 HA PRO 2 -14.611 1.604 -5.968 7 HB2 PRO 2 1HB PRO 2 -14.508 -1.068 -6.684 8 HB3 PRO 2 2HB PRO 2 -14.994 -0.493 -5.076 9 HG2 PRO 2 1HG PRO 2 -16.706 -1.334 -7.376 10 HG3 PRO 2 2HG PRO 2 -16.892 -1.685 -5.647 11 HD2 PRO 2 1HD PRO 2 -18.361 0.232 -6.878 12 HD3 PRO 2 2HD PRO 2 -17.835 0.403 -5.188 13 H LEU 3 H LEU 3 -16.468 0.941 -8.829 14 HA LEU 3 HA LEU 3 -14.426 0.286 -10.637 15 HB2 LEU 3 1HB LEU 3 -17.118 1.604 -10.945 16 HB3 LEU 3 2HB LEU 3 -16.061 1.410 -12.340 17 HG LEU 3 HG LEU 3 -17.729 -0.466 -12.013 18 HD11 LEU 3 1HD1 LEU 3 -15.005 -1.687 -11.680 19 HD12 LEU 3 2HD1 LEU 3 -15.277 -0.630 -13.064 20 HD13 LEU 3 3HD1 LEU 3 -16.275 -2.060 -12.839 21 HD21 LEU 3 3HD2 LEU 3 -17.462 -2.005 -10.192 22 HD22 LEU 3 1HD2 LEU 3 -17.490 -0.391 -9.478 23 HD23 LEU 3 2HD2 LEU 3 -15.956 -1.239 -9.681 24 H GLY 4 H GLY 4 -15.712 3.464 -9.662 25 HA2 GLY 4 1HA GLY 4 -13.597 4.817 -11.209 26 HA3 GLY 4 2HA GLY 4 -15.006 5.580 -10.478 27 H SER 5 H SER 5 -14.928 4.654 -7.915 28 HA SER 5 HA SER 5 -13.999 5.109 -5.860 29 HB2 SER 5 1HB SER 5 -11.336 4.716 -7.221 30 HB3 SER 5 2HB SER 5 -11.728 4.455 -5.524 31 HG SER 5 HG SER 5 -13.012 3.073 -7.636 32 H MET 6 H MET 6 -13.739 7.088 -8.406 33 HA MET 6 HA MET 6 -13.162 9.300 -8.731 34 HB2 MET 6 1HB MET 6 -13.471 9.253 -5.721 35 HB3 MET 6 2HB MET 6 -13.261 10.730 -6.662 36 HG2 MET 6 1HG MET 6 -15.278 10.145 -7.991 37 HG3 MET 6 2HG MET 6 -15.510 8.720 -6.983 38 HE1 MET 6 3HE MET 6 -16.633 9.847 -3.651 39 HE2 MET 6 1HE MET 6 -14.892 9.712 -3.927 40 HE3 MET 6 2HE MET 6 -16.001 8.592 -4.712 41 H ASP 7 H ASP 7 -11.589 9.409 -5.604 42 HA ASP 7 HA ASP 7 -8.939 9.027 -6.771 43 HB2 ASP 7 1HB ASP 7 -9.463 11.453 -6.994 44 HB3 ASP 7 2HB ASP 7 -9.722 11.534 -5.251 45 H GLN 8 H GLN 8 -7.699 7.932 -5.439 46 HA GLN 8 HA GLN 8 -8.636 7.379 -2.703 47 HB2 GLN 8 1HB GLN 8 -6.734 6.087 -4.627 48 HB3 GLN 8 2HB GLN 8 -6.507 5.781 -2.906 49 HG2 GLN 8 1HG GLN 8 -7.957 4.093 -4.009 50 HG3 GLN 8 2HG GLN 8 -8.780 4.957 -2.713 51 HE21 GLN 8 2HE2 GLN 8 -8.420 4.895 -6.269 52 HE22 GLN 8 1HE2 GLN 8 -9.927 5.600 -6.587 53 H SER 9 H SER 9 -5.965 8.787 -4.457 54 HA SER 9 HA SER 9 -4.119 9.101 -2.371 55 HB2 SER 9 1HB SER 9 -3.338 9.611 -4.545 56 HB3 SER 9 2HB SER 9 -4.633 10.773 -4.824 57 HG SER 9 HG SER 9 -3.050 11.239 -2.605 58 H VAL 10 H VAL 10 -6.613 11.453 -3.435 59 HA VAL 10 HA VAL 10 -6.030 13.351 -1.422 60 HB VAL 10 HB VAL 10 -8.543 12.775 -3.011 61 HG11 VAL 10 1HG1 VAL 10 -7.897 14.977 -1.045 62 HG12 VAL 10 2HG1 VAL 10 -9.325 13.944 -1.101 63 HG13 VAL 10 3HG1 VAL 10 -9.092 15.192 -2.324 64 HG21 VAL 10 3HG2 VAL 10 -6.357 13.566 -4.129 65 HG22 VAL 10 1HG2 VAL 10 -6.617 15.091 -3.280 66 HG23 VAL 10 2HG2 VAL 10 -7.808 14.515 -4.446 67 H ALA 11 H ALA 11 -8.493 10.826 -1.631 68 HA ALA 11 HA ALA 11 -9.889 11.139 0.659 69 HB1 ALA 11 3HB ALA 11 -8.960 8.614 -0.693 70 HB2 ALA 11 1HB ALA 11 -10.556 9.362 -0.735 71 HB3 ALA 11 2HB ALA 11 -9.995 8.563 0.733 72 H ILE 12 H ILE 12 -6.735 9.522 0.406 73 HA ILE 12 HA ILE 12 -6.594 8.843 3.154 74 HB ILE 12 HB ILE 12 -4.475 9.201 1.041 75 HG12 ILE 12 1HG1 ILE 12 -5.527 6.625 2.226 76 HG13 ILE 12 2HG1 ILE 12 -6.366 7.413 0.882 77 HG21 ILE 12 1HG2 ILE 12 -3.284 9.377 3.082 78 HG22 ILE 12 2HG2 ILE 12 -3.180 7.662 2.683 79 HG23 ILE 12 3HG2 ILE 12 -4.332 8.216 3.899 80 HD11 ILE 12 3HD1 ILE 12 -3.402 6.843 0.779 81 HD12 ILE 12 1HD1 ILE 12 -4.501 7.220 -0.550 82 HD13 ILE 12 2HD1 ILE 12 -4.604 5.661 0.267 83 H GLN 13 H GLN 13 -5.186 11.460 1.251 84 HA GLN 13 HA GLN 13 -3.663 12.750 3.075 85 HB2 GLN 13 1HB GLN 13 -4.642 13.445 0.600 86 HB3 GLN 13 2HB GLN 13 -5.421 14.652 1.619 87 HG2 GLN 13 1HG GLN 13 -3.369 15.655 1.046 88 HG3 GLN 13 2HG GLN 13 -3.067 14.997 2.653 89 HE21 GLN 13 2HE2 GLN 13 -0.897 14.262 2.590 90 HE22 GLN 13 1HE2 GLN 13 -0.283 13.250 1.373 91 H GLU 14 H GLU 14 -7.223 13.039 2.806 92 HA GLU 14 HA GLU 14 -7.486 14.905 4.919 93 HB2 GLU 14 1HB GLU 14 -9.407 12.862 3.786 94 HB3 GLU 14 2HB GLU 14 -9.866 14.096 4.960 95 HG2 GLU 14 1HG GLU 14 -9.186 15.865 3.414 96 HG3 GLU 14 2HG GLU 14 -8.621 14.664 2.254 97 H THR 15 H THR 15 -7.621 11.386 4.819 98 HA THR 15 HA THR 15 -8.210 11.078 7.610 99 HB THR 15 HB THR 15 -7.855 8.712 7.232 100 HG1 THR 15 HG1 THR 15 -7.257 8.304 4.869 101 HG21 THR 15 3HG2 THR 15 -9.987 9.216 6.437 102 HG22 THR 15 1HG2 THR 15 -9.246 8.536 4.989 103 HG23 THR 15 2HG2 THR 15 -9.381 10.282 5.168 104 H LEU 16 H LEU 16 -5.259 11.129 5.684 105 HA LEU 16 HA LEU 16 -3.533 9.960 7.536 106 HB2 LEU 16 1HB LEU 16 -3.031 10.572 5.106 107 HB3 LEU 16 2HB LEU 16 -2.749 12.213 5.670 108 HG LEU 16 HG LEU 16 -0.943 11.419 7.145 109 HD11 LEU 16 1HD1 LEU 16 -1.970 8.741 6.296 110 HD12 LEU 16 2HD1 LEU 16 -1.342 9.260 7.856 111 HD13 LEU 16 3HD1 LEU 16 -0.229 8.899 6.541 112 HD21 LEU 16 3HD2 LEU 16 -0.270 12.058 4.927 113 HD22 LEU 16 1HD2 LEU 16 -0.808 10.518 4.258 114 HD23 LEU 16 2HD2 LEU 16 0.600 10.575 5.318 115 H VAL 17 H VAL 17 -2.055 12.890 7.170 116 HA VAL 17 HA VAL 17 -3.222 14.364 9.317 117 HB VAL 17 HB VAL 17 -1.095 14.198 10.764 118 HG11 VAL 17 1HG1 VAL 17 -3.438 13.046 11.162 119 HG12 VAL 17 2HG1 VAL 17 -2.050 12.564 12.132 120 HG13 VAL 17 3HG1 VAL 17 -2.558 11.565 10.776 121 HG21 VAL 17 3HG2 VAL 17 0.081 12.892 8.847 122 HG22 VAL 17 1HG2 VAL 17 -0.789 11.490 9.469 123 HG23 VAL 17 2HG2 VAL 17 0.347 12.351 10.504 124 H GLU 18 H GLU 18 -2.299 16.466 9.447 125 HA GLU 18 HA GLU 18 -1.047 17.347 7.074 126 HB2 GLU 18 1HB GLU 18 -1.510 18.690 9.743 127 HB3 GLU 18 2HB GLU 18 -0.908 19.524 8.309 128 HG2 GLU 18 1HG GLU 18 -3.498 17.956 8.367 129 HG3 GLU 18 2HG GLU 18 -3.409 19.694 8.643 130 H GLY 19 H GLY 19 0.994 17.012 6.544 131 HA2 GLY 19 1HA GLY 19 3.256 18.051 7.323 132 HA3 GLY 19 2HA GLY 19 3.086 16.894 8.636 133 H GLU 20 H GLU 20 1.792 14.962 6.676 134 HA GLU 20 HA GLU 20 4.336 13.924 5.580 135 HB2 GLU 20 1HB GLU 20 3.133 12.445 7.120 136 HB3 GLU 20 2HB GLU 20 1.726 12.480 6.059 137 HG2 GLU 20 1HG GLU 20 2.965 11.430 4.269 138 HG3 GLU 20 2HG GLU 20 4.475 11.572 5.168 139 H TYR 21 H TYR 21 4.363 12.947 3.518 140 HA TYR 21 HA TYR 21 2.595 14.304 1.567 141 HB2 TYR 21 1HB TYR 21 5.110 14.748 1.595 142 HB3 TYR 21 2HB TYR 21 5.306 13.088 1.036 143 HD1 TYR 21 HD1 TYR 21 4.488 12.395 -1.171 144 HD2 TYR 21 HD2 TYR 21 4.171 16.465 0.157 145 HE1 TYR 21 HE1 TYR 21 4.056 13.113 -3.497 146 HE2 TYR 21 HE2 TYR 21 3.732 17.189 -2.174 147 HH TYR 21 HH TYR 21 4.242 15.139 -4.857 148 H CYS 22 H CYS 22 1.202 13.104 0.478 149 HA CYS 22 HA CYS 22 1.594 10.175 0.350 150 HB2 CYS 22 1HB CYS 22 -0.651 11.348 1.092 151 HB3 CYS 22 2HB CYS 22 -0.887 11.559 -0.643 152 HG CYS 22 HG CYS 22 -0.156 8.688 0.199 153 H VAL 23 H VAL 23 1.916 9.169 -1.639 154 HA VAL 23 HA VAL 23 2.421 10.987 -3.912 155 HB VAL 23 HB VAL 23 3.438 8.202 -3.325 156 HG11 VAL 23 1HG1 VAL 23 3.945 10.136 -5.605 157 HG12 VAL 23 2HG1 VAL 23 3.286 8.503 -5.716 158 HG13 VAL 23 3HG1 VAL 23 4.971 8.743 -5.264 159 HG21 VAL 23 3HG2 VAL 23 4.867 10.879 -3.344 160 HG22 VAL 23 1HG2 VAL 23 5.571 9.315 -2.930 161 HG23 VAL 23 2HG2 VAL 23 4.347 10.034 -1.884 162 H ILE 24 H ILE 24 0.955 7.887 -3.025 163 HA ILE 24 HA ILE 24 -1.090 8.146 -5.015 164 HB ILE 24 HB ILE 24 0.701 7.538 -6.511 165 HG12 ILE 24 1HG1 ILE 24 -0.827 4.969 -6.038 166 HG13 ILE 24 2HG1 ILE 24 -1.612 6.408 -6.695 167 HG21 ILE 24 1HG2 ILE 24 1.953 5.432 -6.191 168 HG22 ILE 24 2HG2 ILE 24 1.136 5.187 -4.649 169 HG23 ILE 24 3HG2 ILE 24 2.225 6.559 -4.863 170 HD11 ILE 24 3HD1 ILE 24 -0.804 4.891 -8.484 171 HD12 ILE 24 1HD1 ILE 24 0.838 5.069 -7.872 172 HD13 ILE 24 2HD1 ILE 24 -0.006 6.464 -8.545 173 H ALA 25 H ALA 25 -2.426 6.099 -5.152 174 HA ALA 25 HA ALA 25 -2.184 4.115 -3.125 175 HB1 ALA 25 3HB ALA 25 -2.871 5.888 -1.615 176 HB2 ALA 25 1HB ALA 25 -4.237 4.801 -1.863 177 HB3 ALA 25 2HB ALA 25 -4.179 6.350 -2.699 178 H VAL 26 H VAL 26 -2.897 2.446 -4.307 179 HA VAL 26 HA VAL 26 -5.381 2.819 -5.891 180 HB VAL 26 HB VAL 26 -4.564 1.102 -7.369 181 HG11 VAL 26 1HG1 VAL 26 -2.115 2.369 -7.738 182 HG12 VAL 26 2HG1 VAL 26 -3.020 3.579 -6.844 183 HG13 VAL 26 3HG1 VAL 26 -3.651 2.949 -8.362 184 HG21 VAL 26 3HG2 VAL 26 -3.327 -0.470 -6.193 185 HG22 VAL 26 1HG2 VAL 26 -2.522 0.742 -5.197 186 HG23 VAL 26 2HG2 VAL 26 -1.988 0.464 -6.854 187 H GLN 27 H GLN 27 -7.013 2.061 -4.747 188 HA GLN 27 HA GLN 27 -6.884 0.167 -2.703 189 HB2 GLN 27 1HB GLN 27 -8.764 1.732 -3.068 190 HB3 GLN 27 2HB GLN 27 -9.229 0.818 -4.504 191 HG2 GLN 27 1HG GLN 27 -9.681 -1.156 -3.187 192 HG3 GLN 27 2HG GLN 27 -9.003 -0.403 -1.745 193 HE21 GLN 27 2HE2 GLN 27 -11.475 -1.202 -1.228 194 HE22 GLN 27 1HE2 GLN 27 -12.617 0.045 -1.344 195 H GLY 28 H GLY 28 -7.683 -1.967 -2.626 196 HA2 GLY 28 1HA GLY 28 -7.859 -3.473 -5.148 197 HA3 GLY 28 2HA GLY 28 -6.535 -3.890 -4.064 198 H VAL 29 H VAL 29 -7.500 -5.966 -4.026 199 HA VAL 29 HA VAL 29 -9.580 -6.196 -1.942 200 HB VAL 29 HB VAL 29 -9.496 -8.071 -4.307 201 HG11 VAL 29 1HG1 VAL 29 -10.652 -8.896 -2.334 202 HG12 VAL 29 2HG1 VAL 29 -11.845 -8.481 -3.563 203 HG13 VAL 29 3HG1 VAL 29 -11.569 -7.395 -2.202 204 HG21 VAL 29 3HG2 VAL 29 -11.483 -6.753 -5.142 205 HG22 VAL 29 1HG2 VAL 29 -9.944 -5.903 -5.271 206 HG23 VAL 29 2HG2 VAL 29 -11.065 -5.500 -3.972 207 H LEU 30 H LEU 30 -9.537 -8.265 -0.890 208 HA LEU 30 HA LEU 30 -7.105 -9.866 -1.167 209 HB2 LEU 30 1HB LEU 30 -6.740 -8.021 0.583 210 HB3 LEU 30 2HB LEU 30 -7.985 -8.814 1.543 211 HG LEU 30 HG LEU 30 -5.805 -10.613 0.526 212 HD11 LEU 30 1HD1 LEU 30 -4.216 -9.944 2.218 213 HD12 LEU 30 2HD1 LEU 30 -5.290 -8.684 2.802 214 HD13 LEU 30 3HD1 LEU 30 -4.561 -8.554 1.200 215 HD21 LEU 30 3HD2 LEU 30 -6.790 -10.370 3.363 216 HD22 LEU 30 1HD2 LEU 30 -6.234 -11.797 2.492 217 HD23 LEU 30 2HD2 LEU 30 -7.820 -11.115 2.143 218 H CYS 31 H CYS 31 -7.798 -11.958 -1.246 219 HA CYS 31 HA CYS 31 -10.420 -12.572 -0.030 220 HB2 CYS 31 1HB CYS 31 -10.427 -12.931 -2.400 221 HB3 CYS 31 2HB CYS 31 -8.893 -13.794 -2.331 222 HG CYS 31 HG CYS 31 -10.213 -15.636 -0.847 223 H LYS 32 H LYS 32 -10.594 -14.079 1.466 224 HA LYS 32 HA LYS 32 -8.246 -15.775 2.100 225 HB2 LYS 32 1HB LYS 32 -8.711 -13.917 3.804 226 HB3 LYS 32 2HB LYS 32 -10.224 -14.755 4.152 227 HG2 LYS 32 1HG LYS 32 -8.832 -15.761 5.730 228 HG3 LYS 32 2HG LYS 32 -8.646 -16.880 4.384 229 HD2 LYS 32 1HD LYS 32 -6.412 -16.499 4.902 230 HD3 LYS 32 2HD LYS 32 -6.662 -15.233 3.701 231 HE2 LYS 32 1HE LYS 32 -7.118 -13.608 5.503 232 HE3 LYS 32 2HE LYS 32 -6.887 -14.876 6.707 233 HZ1 LYS 32 3HZ LYS 32 -4.711 -14.556 6.623 234 HZ2 LYS 32 1HZ LYS 32 -4.941 -13.268 5.545 235 HZ3 LYS 32 2HZ LYS 32 -4.686 -14.838 4.948 236 H GLY 33 H GLY 33 -8.717 -17.836 1.713 237 HA2 GLY 33 1HA GLY 33 -9.896 -19.781 1.450 238 HA3 GLY 33 2HA GLY 33 -10.862 -19.226 2.815 239 H ASP 34 H ASP 34 -12.882 -18.460 2.482 240 HA ASP 34 HA ASP 34 -13.821 -18.085 -0.302 241 HB2 ASP 34 1HB ASP 34 -15.106 -19.707 1.905 242 HB3 ASP 34 2HB ASP 34 -15.994 -19.139 0.492 243 H SER 35 H SER 35 -12.951 -16.285 1.884 244 HA SER 35 HA SER 35 -15.450 -14.694 2.161 245 HB2 SER 35 1HB SER 35 -14.778 -15.606 4.351 246 HB3 SER 35 2HB SER 35 -13.162 -14.936 4.140 247 HG SER 35 HG SER 35 -14.096 -12.871 4.099 248 H ARG 36 H ARG 36 -15.274 -12.884 0.947 249 HA ARG 36 HA ARG 36 -12.651 -11.942 0.121 250 HB2 ARG 36 1HB ARG 36 -15.397 -10.839 -0.507 251 HB3 ARG 36 2HB ARG 36 -13.891 -10.423 -1.323 252 HG2 ARG 36 1HG ARG 36 -15.001 -13.241 -1.224 253 HG3 ARG 36 2HG ARG 36 -15.340 -12.120 -2.540 254 HD2 ARG 36 1HD ARG 36 -12.835 -11.891 -2.850 255 HD3 ARG 36 2HD ARG 36 -12.640 -13.221 -1.712 256 HE ARG 36 HE ARG 36 -13.671 -13.407 -4.434 257 HH11 ARG 36 1HH2 ARG 36 -13.260 -14.863 -1.315 258 HH12 ARG 36 2HH2 ARG 36 -13.446 -16.483 -1.898 259 HH21 ARG 36 1HH1 ARG 36 -13.912 -15.526 -5.198 260 HH22 ARG 36 2HH1 ARG 36 -13.816 -16.858 -4.096 261 H GLN 37 H GLN 37 -11.714 -10.050 0.631 262 HA GLN 37 HA GLN 37 -13.016 -8.342 2.672 263 HB2 GLN 37 1HB GLN 37 -10.192 -9.435 2.675 264 HB3 GLN 37 2HB GLN 37 -10.759 -8.154 3.749 265 HG2 GLN 37 1HG GLN 37 -12.363 -9.607 4.784 266 HG3 GLN 37 2HG GLN 37 -12.124 -10.849 3.556 267 HE21 GLN 37 2HE2 GLN 37 -9.687 -11.593 3.421 268 HE22 GLN 37 1HE2 GLN 37 -8.921 -11.848 4.910 269 H SER 38 H SER 38 -12.887 -6.261 2.282 270 HA SER 38 HA SER 38 -11.344 -5.343 -0.072 271 HB2 SER 38 1HB SER 38 -13.342 -3.699 1.460 272 HB3 SER 38 2HB SER 38 -12.765 -3.485 -0.191 273 HG SER 38 HG SER 38 -14.021 -5.885 0.549 274 H ARG 39 H ARG 39 -9.534 -4.286 0.154 275 HA ARG 39 HA ARG 39 -8.945 -2.862 2.692 276 HB2 ARG 39 1HB ARG 39 -7.209 -4.738 1.111 277 HB3 ARG 39 2HB ARG 39 -6.546 -3.609 2.294 278 HG2 ARG 39 1HG ARG 39 -7.984 -4.607 4.040 279 HG3 ARG 39 2HG ARG 39 -8.642 -5.733 2.852 280 HD2 ARG 39 1HD ARG 39 -6.366 -6.632 2.462 281 HD3 ARG 39 2HD ARG 39 -5.730 -5.531 3.680 282 HE ARG 39 HE ARG 39 -7.275 -7.955 4.157 283 HH11 ARG 39 1HH2 ARG 39 -6.078 -4.941 5.375 284 HH12 ARG 39 2HH2 ARG 39 -6.173 -5.421 7.036 285 HH21 ARG 39 1HH1 ARG 39 -7.393 -8.588 6.332 286 HH22 ARG 39 2HH1 ARG 39 -6.916 -7.483 7.578 287 H LEU 40 H LEU 40 -7.574 -1.095 2.520 288 HA LEU 40 HA LEU 40 -7.214 0.006 -0.224 289 HB2 LEU 40 1HB LEU 40 -9.045 1.071 1.161 290 HB3 LEU 40 2HB LEU 40 -7.799 1.625 2.276 291 HG LEU 40 HG LEU 40 -7.359 2.247 -0.636 292 HD11 LEU 40 1HD1 LEU 40 -9.442 3.651 1.059 293 HD12 LEU 40 2HD1 LEU 40 -9.733 2.760 -0.435 294 HD13 LEU 40 3HD1 LEU 40 -8.809 4.262 -0.471 295 HD21 LEU 40 3HD2 LEU 40 -6.575 4.393 0.349 296 HD22 LEU 40 1HD2 LEU 40 -5.749 3.007 1.057 297 HD23 LEU 40 2HD2 LEU 40 -7.042 3.812 1.944 298 H LEU 41 H LEU 41 -5.144 0.544 -0.765 299 HA LEU 41 HA LEU 41 -3.138 0.587 1.419 300 HB2 LEU 41 1HB LEU 41 -2.706 0.231 -1.558 301 HB3 LEU 41 2HB LEU 41 -1.518 0.022 -0.273 302 HG LEU 41 HG LEU 41 -3.398 -1.723 0.620 303 HD11 LEU 41 1HD1 LEU 41 -4.940 -1.313 -1.260 304 HD12 LEU 41 2HD1 LEU 41 -4.324 -2.962 -1.314 305 HD13 LEU 41 3HD1 LEU 41 -3.670 -1.742 -2.405 306 HD21 LEU 41 3HD2 LEU 41 -1.269 -2.197 -1.483 307 HD22 LEU 41 1HD2 LEU 41 -2.114 -3.503 -0.651 308 HD23 LEU 41 2HD2 LEU 41 -1.112 -2.378 0.264 309 H GLY 42 H GLY 42 -1.128 1.925 0.677 310 HA2 GLY 42 1HA GLY 42 -1.442 4.188 -0.956 311 HA3 GLY 42 2HA GLY 42 -1.841 4.649 0.689 312 H LEU 43 H LEU 43 0.604 4.434 -1.546 313 HA LEU 43 HA LEU 43 2.788 3.901 0.295 314 HB2 LEU 43 1HB LEU 43 3.021 3.192 -2.022 315 HB3 LEU 43 2HB LEU 43 2.743 4.836 -2.587 316 HG LEU 43 HG LEU 43 4.803 5.591 -1.503 317 HD11 LEU 43 1HD1 LEU 43 4.820 2.765 -0.446 318 HD12 LEU 43 2HD1 LEU 43 5.080 4.273 0.428 319 HD13 LEU 43 3HD1 LEU 43 6.335 3.648 -0.635 320 HD21 LEU 43 3HD2 LEU 43 6.329 4.585 -3.013 321 HD22 LEU 43 1HD2 LEU 43 4.762 4.453 -3.811 322 HD23 LEU 43 2HD2 LEU 43 5.458 3.051 -2.998 323 H VAL 44 H VAL 44 4.044 5.417 1.292 324 HA VAL 44 HA VAL 44 3.508 8.286 0.722 325 HB VAL 44 HB VAL 44 3.550 8.705 3.163 326 HG11 VAL 44 1HG1 VAL 44 1.427 6.689 2.385 327 HG12 VAL 44 2HG1 VAL 44 1.435 8.354 1.807 328 HG13 VAL 44 3HG1 VAL 44 1.271 8.021 3.531 329 HG21 VAL 44 3HG2 VAL 44 3.539 5.673 3.255 330 HG22 VAL 44 1HG2 VAL 44 3.153 6.698 4.637 331 HG23 VAL 44 2HG2 VAL 44 4.766 6.750 3.923 332 H ARG 45 H ARG 45 5.186 9.605 0.757 333 HA ARG 45 HA ARG 45 7.829 8.513 1.578 334 HB2 ARG 45 1HB ARG 45 8.844 9.890 -0.122 335 HB3 ARG 45 2HB ARG 45 7.582 8.923 -0.877 336 HG2 ARG 45 1HG ARG 45 6.819 10.908 -1.731 337 HG3 ARG 45 2HG ARG 45 6.160 11.184 -0.123 338 HD2 ARG 45 1HD ARG 45 7.444 13.130 -0.745 339 HD3 ARG 45 2HD ARG 45 8.343 12.276 0.505 340 HE ARG 45 HE ARG 45 9.980 11.747 -1.081 341 HH11 ARG 45 1HH2 ARG 45 7.144 13.098 -2.537 342 HH12 ARG 45 2HH2 ARG 45 7.867 13.285 -4.100 343 HH21 ARG 45 1HH1 ARG 45 10.931 11.977 -3.131 344 HH22 ARG 45 2HH1 ARG 45 10.012 12.649 -4.436 345 H TYR 46 H TYR 46 9.091 9.797 2.845 346 HA TYR 46 HA TYR 46 8.004 12.422 3.703 347 HB2 TYR 46 1HB TYR 46 7.415 10.607 5.320 348 HB3 TYR 46 2HB TYR 46 9.133 10.288 5.537 349 HD1 TYR 46 HD1 TYR 46 6.416 12.738 6.070 350 HD2 TYR 46 HD2 TYR 46 10.545 11.798 6.781 351 HE1 TYR 46 HE1 TYR 46 6.535 14.545 7.765 352 HE2 TYR 46 HE2 TYR 46 10.666 13.604 8.472 353 HH TYR 46 HH TYR 46 8.376 14.832 10.010 354 H ARG 47 H ARG 47 9.533 14.003 3.971 355 HA ARG 47 HA ARG 47 12.285 13.319 3.189 356 HB2 ARG 47 1HB ARG 47 11.278 15.150 1.967 357 HB3 ARG 47 2HB ARG 47 10.877 15.988 3.466 358 HG2 ARG 47 1HG ARG 47 13.228 16.307 3.988 359 HG3 ARG 47 2HG ARG 47 13.710 15.294 2.630 360 HD2 ARG 47 1HD ARG 47 12.719 16.919 1.065 361 HD3 ARG 47 2HD ARG 47 12.213 17.921 2.424 362 HE ARG 47 HE ARG 47 14.430 18.626 2.690 363 HH11 ARG 47 1HH2 ARG 47 14.170 15.980 0.471 364 HH12 ARG 47 2HH2 ARG 47 15.792 16.132 -0.116 365 HH21 ARG 47 1HH1 ARG 47 16.562 18.828 1.924 366 HH22 ARG 47 2HH1 ARG 47 17.146 17.743 0.706 367 H LEU 48 H LEU 48 14.021 13.489 4.483 368 HA LEU 48 HA LEU 48 13.553 14.109 7.331 369 HB2 LEU 48 1HB LEU 48 15.851 12.712 5.942 370 HB3 LEU 48 2HB LEU 48 15.758 13.010 7.674 371 HG LEU 48 HG LEU 48 13.684 11.442 6.110 372 HD11 LEU 48 1HD1 LEU 48 14.773 9.488 7.385 373 HD12 LEU 48 2HD1 LEU 48 16.136 10.573 7.652 374 HD13 LEU 48 3HD1 LEU 48 15.668 10.135 6.010 375 HD21 LEU 48 3HD2 LEU 48 12.613 12.146 8.076 376 HD22 LEU 48 1HD2 LEU 48 14.100 12.125 9.023 377 HD23 LEU 48 2HD2 LEU 48 13.303 10.614 8.593 378 H GLU 49 H GLU 49 14.518 15.749 8.345 379 HA GLU 49 HA GLU 49 15.432 17.994 6.989 380 HB2 GLU 49 1HB GLU 49 15.965 17.086 9.826 381 HB3 GLU 49 2HB GLU 49 16.348 18.698 9.217 382 HG2 GLU 49 1HG GLU 49 14.003 19.087 8.662 383 HG3 GLU 49 2HG GLU 49 13.588 17.446 9.153 384 H ASN 50 H ASN 50 17.034 15.053 7.568 385 HA ASN 50 HA ASN 50 19.733 16.108 7.534 386 HB2 ASN 50 1HB ASN 50 18.614 13.306 7.357 387 HB3 ASN 50 2HB ASN 50 20.339 13.673 7.350 388 HD21 ASN 50 2HD2 ASN 50 18.370 12.381 9.440 389 HD22 ASN 50 1HD2 ASN 50 18.778 13.187 10.877 390 H ASP 51 H ASP 51 17.416 15.836 5.232 391 HA ASP 51 HA ASP 51 17.569 16.256 2.950 392 HB2 ASP 51 1HB ASP 51 20.433 15.318 2.866 393 HB3 ASP 51 2HB ASP 51 19.603 16.457 1.816 394 H ALA 52 H ALA 52 18.327 13.519 4.723 395 HA ALA 52 HA ALA 52 18.521 11.593 2.630 396 HB1 ALA 52 3HB ALA 52 19.422 11.137 4.853 397 HB2 ALA 52 1HB ALA 52 18.168 9.959 4.461 398 HB3 ALA 52 2HB ALA 52 17.813 11.293 5.559 399 H GLN 53 H GLN 53 16.964 10.058 2.017 400 HA GLN 53 HA GLN 53 14.138 10.856 2.437 401 HB2 GLN 53 1HB GLN 53 15.551 9.818 -0.029 402 HB3 GLN 53 2HB GLN 53 13.795 9.831 0.135 403 HG2 GLN 53 1HG GLN 53 15.511 12.296 0.509 404 HG3 GLN 53 2HG GLN 53 14.769 11.863 -1.033 405 HE21 GLN 53 2HE2 GLN 53 14.210 14.138 1.006 406 HE22 GLN 53 1HE2 GLN 53 12.533 14.045 1.247 407 H GLU 54 H GLU 54 12.589 9.167 2.511 408 HA GLU 54 HA GLU 54 13.456 6.407 2.482 409 HB2 GLU 54 1HB GLU 54 12.254 6.259 4.918 410 HB3 GLU 54 2HB GLU 54 13.993 6.443 4.715 411 HG2 GLU 54 1HG GLU 54 13.232 8.078 6.324 412 HG3 GLU 54 2HG GLU 54 13.709 8.932 4.864 413 H HIS 55 H HIS 55 11.646 4.919 2.656 414 HA HIS 55 HA HIS 55 8.986 6.147 2.206 415 HB2 HIS 55 1HB HIS 55 10.358 4.050 0.522 416 HB3 HIS 55 2HB HIS 55 8.632 4.396 0.428 417 HD2 HIS 55 HD2 HIS 55 7.983 6.633 -1.095 418 HE1 HIS 55 HE1 HIS 55 11.924 7.991 -1.758 419 HE2 HIS 55 HE2 HIS 55 9.485 8.345 -2.371 420 H ALA 56 H ALA 56 7.200 4.702 2.569 421 HA ALA 56 HA ALA 56 7.726 2.146 3.876 422 HB1 ALA 56 3HB ALA 56 7.849 3.510 5.815 423 HB2 ALA 56 1HB ALA 56 6.191 2.905 5.796 424 HB3 ALA 56 2HB ALA 56 6.536 4.550 5.263 425 H LEU 57 H LEU 57 5.975 0.755 3.671 426 HA LEU 57 HA LEU 57 3.876 1.632 1.836 427 HB2 LEU 57 1HB LEU 57 4.975 -0.484 1.362 428 HB3 LEU 57 2HB LEU 57 4.570 -1.091 2.964 429 HG LEU 57 HG LEU 57 2.178 -1.004 2.426 430 HD11 LEU 57 1HD1 LEU 57 1.893 0.819 0.964 431 HD12 LEU 57 2HD1 LEU 57 1.661 -0.565 -0.100 432 HD13 LEU 57 3HD1 LEU 57 3.200 0.296 -0.098 433 HD21 LEU 57 3HD2 LEU 57 2.129 -2.804 0.801 434 HD22 LEU 57 1HD2 LEU 57 3.578 -3.002 1.786 435 HD23 LEU 57 2HD2 LEU 57 3.702 -2.329 0.161 436 H PHE 58 H PHE 58 2.500 2.896 3.039 437 HA PHE 58 HA PHE 58 1.536 2.085 5.618 438 HB2 PHE 58 1HB PHE 58 1.015 4.341 3.719 439 HB3 PHE 58 2HB PHE 58 -0.147 4.051 4.999 440 HD1 PHE 58 HD2 PHE 58 3.496 3.335 5.360 441 HD2 PHE 58 HD1 PHE 58 0.301 6.093 6.204 442 HE1 PHE 58 HE2 PHE 58 4.938 4.520 6.962 443 HE2 PHE 58 HE1 PHE 58 1.772 7.277 7.810 444 HZ PHE 58 HZ PHE 58 4.083 6.490 8.192 445 H LEU 59 H LEU 59 -0.361 1.180 6.179 446 HA LEU 59 HA LEU 59 -2.084 0.164 3.983 447 HB2 LEU 59 1HB LEU 59 -0.713 -1.448 5.586 448 HB3 LEU 59 2HB LEU 59 -2.019 -1.106 6.710 449 HG LEU 59 HG LEU 59 -2.635 -3.099 5.499 450 HD11 LEU 59 1HD1 LEU 59 -4.372 -1.207 5.797 451 HD12 LEU 59 2HD1 LEU 59 -4.752 -2.500 4.663 452 HD13 LEU 59 3HD1 LEU 59 -4.178 -0.949 4.062 453 HD21 LEU 59 3HD2 LEU 59 -2.327 -3.459 3.243 454 HD22 LEU 59 1HD2 LEU 59 -1.044 -2.275 3.474 455 HD23 LEU 59 2HD2 LEU 59 -2.597 -1.775 2.811 456 H TYR 60 H TYR 60 -4.013 0.986 3.936 457 HA TYR 60 HA TYR 60 -5.135 2.339 6.330 458 HB2 TYR 60 1HB TYR 60 -5.545 2.769 3.366 459 HB3 TYR 60 2HB TYR 60 -6.457 3.591 4.613 460 HD1 TYR 60 HD1 TYR 60 -3.135 3.224 3.044 461 HD2 TYR 60 HD2 TYR 60 -5.478 5.349 5.952 462 HE1 TYR 60 HE1 TYR 60 -1.367 4.953 3.203 463 HE2 TYR 60 HE2 TYR 60 -3.705 7.076 6.115 464 HH TYR 60 HH TYR 60 -0.784 6.902 4.074 465 H THR 61 H THR 61 -6.942 1.355 7.186 466 HA THR 61 HA THR 61 -8.200 -0.798 5.656 467 HB THR 61 HB THR 61 -7.865 -1.177 8.050 468 HG1 THR 61 HG1 THR 61 -9.839 -1.841 6.851 469 HG21 THR 61 3HG2 THR 61 -8.005 1.235 8.714 470 HG22 THR 61 1HG2 THR 61 -8.986 0.175 9.725 471 HG23 THR 61 2HG2 THR 61 -9.750 1.156 8.473 472 H HIS 62 H HIS 62 -10.614 -0.794 5.500 473 HA HIS 62 HA HIS 62 -11.948 1.742 5.630 474 HB2 HIS 62 1HB HIS 62 -12.171 2.255 3.354 475 HB3 HIS 62 2HB HIS 62 -10.486 1.784 3.499 476 HD2 HIS 62 HD2 HIS 62 -9.864 -0.763 2.362 477 HE1 HIS 62 HE1 HIS 62 -13.564 -1.237 0.398 478 HE2 HIS 62 HE2 HIS 62 -11.206 -2.158 0.611 479 H ARG 63 H ARG 63 -14.193 1.582 5.117 480 HA ARG 63 HA ARG 63 -15.280 -0.955 5.878 481 HB2 ARG 63 1HB ARG 63 -16.607 1.609 4.978 482 HB3 ARG 63 2HB ARG 63 -17.494 0.181 5.499 483 HG2 ARG 63 1HG ARG 63 -16.343 0.244 7.666 484 HG3 ARG 63 2HG ARG 63 -15.440 1.666 7.149 485 HD2 ARG 63 1HD ARG 63 -17.557 2.907 6.874 486 HD3 ARG 63 2HD ARG 63 -18.456 1.490 7.410 487 HE ARG 63 HE ARG 63 -16.896 3.298 9.083 488 HH11 ARG 63 1HH2 ARG 63 -18.446 0.224 8.714 489 HH12 ARG 63 2HH2 ARG 63 -18.602 -0.058 10.415 490 HH21 ARG 63 1HH1 ARG 63 -17.095 2.932 11.318 491 HH22 ARG 63 2HH1 ARG 63 -17.836 1.476 11.891 492 H ARG 64 H ARG 64 -17.273 -1.730 4.587 493 HA ARG 64 HA ARG 64 -16.356 -2.854 2.191 494 HB2 ARG 64 1HB ARG 64 -19.190 -2.473 3.181 495 HB3 ARG 64 2HB ARG 64 -18.709 -3.540 1.860 496 HG2 ARG 64 1HG ARG 64 -17.300 -4.839 3.362 497 HG3 ARG 64 2HG ARG 64 -17.647 -3.728 4.689 498 HD2 ARG 64 1HD ARG 64 -19.071 -5.688 4.917 499 HD3 ARG 64 2HD ARG 64 -20.068 -4.304 4.480 500 HE ARG 64 HE ARG 64 -19.247 -5.678 2.135 501 HH11 ARG 64 1HH2 ARG 64 -21.316 -5.936 4.897 502 HH12 ARG 64 2HH2 ARG 64 -22.483 -6.939 4.101 503 HH21 ARG 64 1HH1 ARG 64 -20.774 -6.990 1.085 504 HH22 ARG 64 2HH1 ARG 64 -22.176 -7.534 1.944 505 H MET 65 H MET 65 -17.954 0.208 2.849 506 HA MET 65 HA MET 65 -17.786 0.860 -0.027 507 HB2 MET 65 1HB MET 65 -20.024 2.128 0.400 508 HB3 MET 65 2HB MET 65 -20.083 0.386 0.133 509 HG2 MET 65 1HG MET 65 -20.184 -0.029 2.539 510 HG3 MET 65 2HG MET 65 -19.997 1.693 2.869 511 HE1 MET 65 3HE MET 65 -23.554 1.440 3.985 512 HE2 MET 65 1HE MET 65 -21.832 1.507 4.383 513 HE3 MET 65 2HE MET 65 -22.603 -0.042 4.049 514 H ALA 66 H ALA 66 -16.148 1.504 2.350 515 HA ALA 66 HA ALA 66 -16.712 4.125 3.290 516 HB1 ALA 66 3HB ALA 66 -14.449 2.237 3.342 517 HB2 ALA 66 1HB ALA 66 -15.064 3.261 4.633 518 HB3 ALA 66 2HB ALA 66 -13.960 3.929 3.437 519 H ILE 67 H ILE 67 -14.464 3.027 0.784 520 HA ILE 67 HA ILE 67 -13.199 4.229 -0.755 521 HB ILE 67 HB ILE 67 -16.094 4.764 -1.465 522 HG12 ILE 67 1HG1 ILE 67 -14.181 2.665 -2.522 523 HG13 ILE 67 2HG1 ILE 67 -15.326 2.361 -1.215 524 HG21 ILE 67 1HG2 ILE 67 -15.147 4.955 -3.812 525 HG22 ILE 67 2HG2 ILE 67 -13.546 5.046 -3.083 526 HG23 ILE 67 3HG2 ILE 67 -14.741 6.298 -2.746 527 HD11 ILE 67 3HD1 ILE 67 -16.044 3.275 -4.021 528 HD12 ILE 67 1HD1 ILE 67 -17.196 3.006 -2.710 529 HD13 ILE 67 2HD1 ILE 67 -16.278 1.652 -3.371 530 H THR 68 H THR 68 -15.954 6.275 -0.137 531 HA THR 68 HA THR 68 -15.296 8.665 -0.862 532 HB THR 68 HB THR 68 -16.397 8.048 1.866 533 HG1 THR 68 HG1 THR 68 -18.027 8.931 -0.143 534 HG21 THR 68 3HG2 THR 68 -15.782 10.339 1.920 535 HG22 THR 68 1HG2 THR 68 -17.495 10.334 1.501 536 HG23 THR 68 2HG2 THR 68 -16.281 10.595 0.246 537 H GLY 69 H GLY 69 -13.708 7.209 1.964 538 HA2 GLY 69 1HA GLY 69 -11.426 7.849 2.517 539 HA3 GLY 69 2HA GLY 69 -11.780 9.479 1.950 540 H ASP 70 H ASP 70 -14.533 8.865 3.237 541 HA ASP 70 HA ASP 70 -14.159 10.426 5.554 542 HB2 ASP 70 1HB ASP 70 -16.269 10.353 4.306 543 HB3 ASP 70 2HB ASP 70 -16.493 8.677 4.799 544 H ASP 71 H ASP 71 -14.758 6.834 5.225 545 HA ASP 71 HA ASP 71 -14.102 6.622 8.140 546 HB2 ASP 71 1HB ASP 71 -15.606 4.704 6.375 547 HB3 ASP 71 2HB ASP 71 -15.375 4.495 8.110 548 H VAL 72 H VAL 72 -11.788 6.833 6.682 549 HA VAL 72 HA VAL 72 -10.740 4.118 7.023 550 HB VAL 72 HB VAL 72 -11.038 3.794 4.760 551 HG11 VAL 72 1HG1 VAL 72 -10.931 5.680 3.105 552 HG12 VAL 72 2HG1 VAL 72 -10.717 6.789 4.461 553 HG13 VAL 72 3HG1 VAL 72 -12.209 5.857 4.309 554 HG21 VAL 72 3HG2 VAL 72 -8.510 4.049 5.362 555 HG22 VAL 72 1HG2 VAL 72 -8.597 5.528 4.416 556 HG23 VAL 72 2HG2 VAL 72 -8.969 3.977 3.663 557 H SER 73 H SER 73 -8.889 4.198 8.119 558 HA SER 73 HA SER 73 -7.082 6.450 7.740 559 HB2 SER 73 1HB SER 73 -8.184 5.627 10.447 560 HB3 SER 73 2HB SER 73 -6.946 6.844 10.156 561 HG SER 73 HG SER 73 -9.374 7.078 8.785 562 H LEU 74 H LEU 74 -5.007 5.948 8.876 563 HA LEU 74 HA LEU 74 -3.884 3.679 7.984 564 HB2 LEU 74 1HB LEU 74 -3.237 5.495 10.243 565 HB3 LEU 74 2HB LEU 74 -2.336 3.985 10.169 566 HG LEU 74 HG LEU 74 -2.604 5.900 7.840 567 HD11 LEU 74 1HD1 LEU 74 -1.367 6.836 9.853 568 HD12 LEU 74 2HD1 LEU 74 -0.423 6.747 8.369 569 HD13 LEU 74 3HD1 LEU 74 -0.192 5.539 9.633 570 HD21 LEU 74 3HD2 LEU 74 -1.725 4.180 6.668 571 HD22 LEU 74 1HD2 LEU 74 -1.614 3.169 8.105 572 HD23 LEU 74 2HD2 LEU 74 -0.284 4.235 7.672 573 H ASP 75 H ASP 75 -3.592 1.661 8.448 574 HA ASP 75 HA ASP 75 -5.011 0.453 10.748 575 HB2 ASP 75 1HB ASP 75 -5.785 -0.245 8.493 576 HB3 ASP 75 2HB ASP 75 -4.159 -0.821 8.136 577 H GLN 76 H GLN 76 -2.136 -0.223 8.656 578 HA GLN 76 HA GLN 76 -0.464 -0.503 11.012 579 HB2 GLN 76 1HB GLN 76 -1.587 -2.765 10.700 580 HB3 GLN 76 2HB GLN 76 -0.716 -2.883 9.168 581 HG2 GLN 76 1HG GLN 76 1.401 -2.324 10.590 582 HG3 GLN 76 2HG GLN 76 0.400 -2.773 11.968 583 HE21 GLN 76 2HE2 GLN 76 1.660 -4.039 8.853 584 HE22 GLN 76 1HE2 GLN 76 1.598 -5.656 9.328 585 H ILE 77 H ILE 77 1.355 0.461 10.507 586 HA ILE 77 HA ILE 77 2.140 0.959 7.755 587 HB ILE 77 HB ILE 77 3.377 1.700 10.419 588 HG12 ILE 77 1HG1 ILE 77 2.027 3.439 8.329 589 HG13 ILE 77 2HG1 ILE 77 1.178 2.771 9.726 590 HG21 ILE 77 1HG2 ILE 77 4.718 3.312 8.941 591 HG22 ILE 77 2HG2 ILE 77 4.233 2.298 7.582 592 HG23 ILE 77 3HG2 ILE 77 5.201 1.617 8.889 593 HD11 ILE 77 3HD1 ILE 77 2.540 4.002 11.258 594 HD12 ILE 77 1HD1 ILE 77 2.091 5.148 9.995 595 HD13 ILE 77 2HD1 ILE 77 3.700 4.426 10.001 596 H VAL 78 H VAL 78 3.595 -0.135 6.612 597 HA VAL 78 HA VAL 78 5.342 -2.088 7.996 598 HB VAL 78 HB VAL 78 3.930 -2.358 5.344 599 HG11 VAL 78 1HG1 VAL 78 6.158 -3.955 6.629 600 HG12 VAL 78 2HG1 VAL 78 6.099 -3.284 4.998 601 HG13 VAL 78 3HG1 VAL 78 5.081 -4.656 5.423 602 HG21 VAL 78 3HG2 VAL 78 2.712 -2.845 7.538 603 HG22 VAL 78 1HG2 VAL 78 3.875 -4.148 7.790 604 HG23 VAL 78 2HG2 VAL 78 2.795 -4.188 6.397 605 HA PRO 79 HA PRO 79 8.085 0.803 5.759 606 HB2 PRO 79 1HB PRO 79 10.317 0.484 7.248 607 HB3 PRO 79 2HB PRO 79 8.927 1.426 7.833 608 HG2 PRO 79 1HG PRO 79 9.719 -1.383 8.487 609 HG3 PRO 79 2HG PRO 79 9.130 -0.100 9.560 610 HD2 PRO 79 1HD PRO 79 7.526 -2.110 8.574 611 HD3 PRO 79 2HD PRO 79 6.908 -0.511 9.052 612 H LEU 80 H LEU 80 9.567 0.546 4.147 613 HA LEU 80 HA LEU 80 9.943 -2.045 3.096 614 HB2 LEU 80 1HB LEU 80 11.306 0.566 2.411 615 HB3 LEU 80 2HB LEU 80 11.347 -0.894 1.424 616 HG LEU 80 HG LEU 80 8.835 0.620 2.205 617 HD11 LEU 80 1HD1 LEU 80 10.463 1.717 0.544 618 HD12 LEU 80 2HD1 LEU 80 8.802 1.494 -0.009 619 HD13 LEU 80 3HD1 LEU 80 10.067 0.390 -0.548 620 HD21 LEU 80 3HD2 LEU 80 8.015 -0.922 0.191 621 HD22 LEU 80 1HD2 LEU 80 8.063 -1.547 1.835 622 HD23 LEU 80 2HD2 LEU 80 9.360 -1.938 0.707 623 H SER 81 H SER 81 11.391 -3.446 3.385 624 HA SER 81 HA SER 81 14.026 -2.781 4.581 625 HB2 SER 81 1HB SER 81 13.866 -4.866 5.937 626 HB3 SER 81 2HB SER 81 12.679 -3.650 6.400 627 HG SER 81 HG SER 81 12.267 -5.888 4.695 628 H LYS 82 H LYS 82 15.614 -4.595 4.298 629 HA LYS 82 HA LYS 82 15.881 -5.238 1.607 630 HB2 LYS 82 1HB LYS 82 17.085 -6.522 4.061 631 HB3 LYS 82 2HB LYS 82 17.581 -6.912 2.412 632 HG2 LYS 82 1HG LYS 82 18.162 -4.557 2.012 633 HG3 LYS 82 2HG LYS 82 17.628 -4.141 3.642 634 HD2 LYS 82 1HD LYS 82 19.353 -5.565 4.614 635 HD3 LYS 82 2HD LYS 82 19.847 -6.106 3.009 636 HE2 LYS 82 1HE LYS 82 21.363 -4.343 3.801 637 HE3 LYS 82 2HE LYS 82 20.432 -3.767 2.417 638 HZ1 LYS 82 3HZ LYS 82 19.468 -3.326 5.167 639 HZ2 LYS 82 1HZ LYS 82 19.093 -2.465 3.755 640 HZ3 LYS 82 2HZ LYS 82 20.619 -2.282 4.479 641 H ASP 83 H ASP 83 14.565 -7.232 4.270 642 HA ASP 83 HA ASP 83 14.218 -9.581 2.780 643 HB2 ASP 83 1HB ASP 83 14.007 -9.183 5.323 644 HB3 ASP 83 2HB ASP 83 12.351 -8.694 4.976 645 H PHE 84 H PHE 84 12.817 -6.601 2.294 646 HA PHE 84 HA PHE 84 10.152 -7.321 1.564 647 HB2 PHE 84 1HB PHE 84 10.945 -4.982 2.087 648 HB3 PHE 84 2HB PHE 84 11.767 -4.984 0.526 649 HD1 PHE 84 HD1 PHE 84 10.494 -4.961 -1.570 650 HD2 PHE 84 HD2 PHE 84 8.520 -4.922 2.243 651 HE1 PHE 84 HE1 PHE 84 8.385 -4.258 -2.668 652 HE2 PHE 84 HE2 PHE 84 6.410 -4.225 1.146 653 HZ PHE 84 HZ PHE 84 6.341 -3.893 -1.312 654 H MET 85 H MET 85 9.348 -7.995 -0.342 655 HA MET 85 HA MET 85 10.763 -7.848 -2.810 656 HB2 MET 85 1HB MET 85 12.060 -9.684 -1.771 657 HB3 MET 85 2HB MET 85 10.571 -10.611 -1.578 658 HG2 MET 85 1HG MET 85 10.223 -10.629 -3.997 659 HG3 MET 85 2HG MET 85 11.632 -9.597 -4.231 660 HE1 MET 85 3HE MET 85 10.164 -12.622 -2.805 661 HE2 MET 85 1HE MET 85 11.493 -12.960 -1.689 662 HE3 MET 85 2HE MET 85 11.271 -13.951 -3.127 663 H LEU 86 H LEU 86 9.403 -8.148 -4.503 664 HA LEU 86 HA LEU 86 6.603 -8.844 -3.866 665 HB2 LEU 86 1HB LEU 86 6.482 -7.813 -6.390 666 HB3 LEU 86 2HB LEU 86 6.373 -6.823 -4.938 667 HG LEU 86 HG LEU 86 8.853 -6.454 -5.042 668 HD11 LEU 86 1HD1 LEU 86 9.821 -6.960 -7.412 669 HD12 LEU 86 2HD1 LEU 86 8.520 -8.143 -7.524 670 HD13 LEU 86 3HD1 LEU 86 9.735 -8.283 -6.253 671 HD21 LEU 86 3HD2 LEU 86 7.258 -4.839 -6.009 672 HD22 LEU 86 1HD2 LEU 86 7.318 -5.702 -7.546 673 HD23 LEU 86 2HD2 LEU 86 8.759 -4.891 -6.933 674 H GLU 87 H GLU 87 5.786 -10.752 -4.595 675 HA GLU 87 HA GLU 87 7.296 -12.204 -6.695 676 HB2 GLU 87 1HB GLU 87 5.757 -13.249 -4.308 677 HB3 GLU 87 2HB GLU 87 6.400 -14.265 -5.597 678 HG2 GLU 87 1HG GLU 87 8.075 -12.397 -3.899 679 HG3 GLU 87 2HG GLU 87 7.908 -14.127 -3.602 680 H GLU 88 H GLU 88 6.258 -12.629 -8.470 681 HA GLU 88 HA GLU 88 3.476 -11.941 -8.804 682 HB2 GLU 88 1HB GLU 88 3.800 -12.612 -11.127 683 HB3 GLU 88 2HB GLU 88 5.156 -11.611 -10.608 684 HG2 GLU 88 1HG GLU 88 6.436 -13.712 -10.106 685 HG3 GLU 88 2HG GLU 88 5.108 -14.635 -10.807 686 H VAL 89 H VAL 89 1.739 -13.343 -9.074 687 HA VAL 89 HA VAL 89 2.186 -16.093 -8.110 688 HB VAL 89 HB VAL 89 -0.466 -14.770 -8.613 689 HG11 VAL 89 1HG1 VAL 89 -0.271 -17.274 -8.291 690 HG12 VAL 89 2HG1 VAL 89 -1.303 -16.452 -7.122 691 HG13 VAL 89 3HG1 VAL 89 0.328 -16.942 -6.664 692 HG21 VAL 89 3HG2 VAL 89 0.706 -13.306 -7.085 693 HG22 VAL 89 1HG2 VAL 89 1.294 -14.680 -6.148 694 HG23 VAL 89 2HG2 VAL 89 -0.423 -14.273 -6.137 695 H SER 90 H SER 90 1.833 -17.837 -9.335 696 HA SER 90 HA SER 90 2.121 -17.943 -12.013 697 HB2 SER 90 1HB SER 90 0.325 -19.788 -10.425 698 HB3 SER 90 2HB SER 90 1.064 -20.152 -11.984 699 HG SER 90 HG SER 90 3.002 -19.311 -10.444 700 HA PRO 91 HA PRO 91 -1.731 -16.060 -13.437 701 HB2 PRO 91 1HB PRO 91 -1.334 -16.225 -16.129 702 HB3 PRO 91 2HB PRO 91 -0.481 -15.052 -15.105 703 HG2 PRO 91 1HG PRO 91 0.479 -17.661 -16.192 704 HG3 PRO 91 2HG PRO 91 1.341 -16.119 -16.045 705 HD2 PRO 91 1HD PRO 91 1.652 -18.207 -14.271 706 HD3 PRO 91 2HD PRO 91 1.918 -16.503 -13.836 707 H ASP 92 H ASP 92 -0.702 -18.838 -15.429 708 HA ASP 92 HA ASP 92 -1.823 -20.696 -16.178 709 HB2 ASP 92 1HB ASP 92 -3.436 -20.169 -13.670 710 HB3 ASP 92 2HB ASP 92 -3.712 -21.550 -14.724 711 H GLY 93 H GLY 93 -2.430 -18.151 -17.258 712 HA2 GLY 93 1HA GLY 93 -5.272 -18.522 -18.065 713 HA3 GLY 93 2HA GLY 93 -4.545 -16.932 -17.842 714 H GLU 94 H GLU 94 -5.673 -18.607 -20.202 715 HA GLU 94 HA GLU 94 -3.380 -18.598 -22.029 716 HB2 GLU 94 1HB GLU 94 -5.396 -19.352 -23.625 717 HB3 GLU 94 2HB GLU 94 -4.619 -20.480 -22.517 718 HG2 GLU 94 1HG GLU 94 -7.008 -18.846 -21.658 719 HG3 GLU 94 2HG GLU 94 -7.196 -20.385 -22.494 720 H LEU 95 H LEU 95 -6.661 -17.686 -22.948 721 HA LEU 95 HA LEU 95 -5.772 -15.542 -24.580 722 HB2 LEU 95 1HB LEU 95 -7.857 -16.714 -25.064 723 HB3 LEU 95 2HB LEU 95 -8.532 -16.202 -23.521 724 HG LEU 95 HG LEU 95 -8.457 -13.857 -24.224 725 HD11 LEU 95 1HD1 LEU 95 -6.998 -15.023 -26.591 726 HD12 LEU 95 2HD1 LEU 95 -6.577 -13.619 -25.610 727 HD13 LEU 95 3HD1 LEU 95 -7.902 -13.517 -26.766 728 HD21 LEU 95 3HD2 LEU 95 -9.636 -15.482 -26.488 729 HD22 LEU 95 1HD2 LEU 95 -10.203 -13.936 -25.859 730 HD23 LEU 95 2HD2 LEU 95 -10.376 -15.398 -24.889 731 H TYR 96 H TYR 96 -7.285 -15.687 -21.408 732 HA TYR 96 HA TYR 96 -7.453 -12.875 -21.018 733 HB2 TYR 96 1HB TYR 96 -8.601 -14.873 -19.719 734 HB3 TYR 96 2HB TYR 96 -7.195 -14.730 -18.669 735 HD1 TYR 96 HD2 TYR 96 -9.844 -12.654 -20.296 736 HD2 TYR 96 HD1 TYR 96 -7.204 -13.133 -16.943 737 HE1 TYR 96 HE2 TYR 96 -10.888 -10.696 -19.198 738 HE2 TYR 96 HE1 TYR 96 -8.248 -11.174 -15.839 739 HH TYR 96 HH TYR 96 -10.298 -9.015 -17.484 740 H ILE 97 H ILE 97 -6.157 -11.458 -19.832 741 HA ILE 97 HA ILE 97 -3.545 -12.378 -18.881 742 HB ILE 97 HB ILE 97 -2.604 -10.299 -20.078 743 HG12 ILE 97 1HG1 ILE 97 -4.761 -10.769 -22.118 744 HG13 ILE 97 2HG1 ILE 97 -5.146 -9.745 -20.737 745 HG21 ILE 97 1HG2 ILE 97 -2.085 -12.669 -20.677 746 HG22 ILE 97 2HG2 ILE 97 -2.077 -11.593 -22.072 747 HG23 ILE 97 3HG2 ILE 97 -3.458 -12.654 -21.786 748 HD11 ILE 97 3HD1 ILE 97 -2.786 -9.347 -22.593 749 HD12 ILE 97 1HD1 ILE 97 -3.206 -8.329 -21.216 750 HD13 ILE 97 2HD1 ILE 97 -4.279 -8.406 -22.616 751 H LEU 98 H LEU 98 -4.478 -11.903 -16.815 752 HA LEU 98 HA LEU 98 -4.856 -10.588 -14.964 753 HB2 LEU 98 1HB LEU 98 -3.386 -8.563 -16.681 754 HB3 LEU 98 2HB LEU 98 -3.892 -8.246 -15.031 755 HG LEU 98 HG LEU 98 -1.541 -8.961 -15.109 756 HD11 LEU 98 1HD1 LEU 98 -2.890 -11.373 -13.951 757 HD12 LEU 98 2HD1 LEU 98 -3.351 -9.799 -13.312 758 HD13 LEU 98 3HD1 LEU 98 -1.669 -10.311 -13.251 759 HD21 LEU 98 3HD2 LEU 98 -2.450 -11.679 -16.058 760 HD22 LEU 98 1HD2 LEU 98 -0.821 -11.007 -16.029 761 HD23 LEU 98 2HD2 LEU 98 -1.989 -10.425 -17.211 762 H GLY 99 H GLY 99 -5.453 -8.676 -17.930 763 HA2 GLY 99 1HA GLY 99 -7.306 -7.501 -18.628 764 HA3 GLY 99 2HA GLY 99 -8.254 -8.536 -17.563 765 H SER 100 H SER 100 -8.640 -7.899 -15.442 766 HA SER 100 HA SER 100 -7.780 -5.209 -14.606 767 HB2 SER 100 1HB SER 100 -9.915 -4.779 -15.641 768 HB3 SER 100 2HB SER 100 -10.652 -6.151 -14.820 769 HG SER 100 HG SER 100 -9.392 -4.146 -13.315 770 H ASP 101 H ASP 101 -6.824 -7.639 -13.768 771 HA ASP 101 HA ASP 101 -7.524 -7.597 -10.928 772 HB2 ASP 101 1HB ASP 101 -7.792 -10.042 -12.686 773 HB3 ASP 101 2HB ASP 101 -7.554 -10.161 -10.944 774 H VAL 102 H VAL 102 -5.366 -6.595 -10.991 775 HA VAL 102 HA VAL 102 -3.066 -8.041 -11.855 776 HB VAL 102 HB VAL 102 -3.258 -5.807 -9.827 777 HG11 VAL 102 1HG1 VAL 102 -0.969 -7.084 -11.316 778 HG12 VAL 102 2HG1 VAL 102 -1.126 -6.796 -9.584 779 HG13 VAL 102 3HG1 VAL 102 -0.859 -5.442 -10.681 780 HG21 VAL 102 3HG2 VAL 102 -4.224 -5.250 -12.045 781 HG22 VAL 102 1HG2 VAL 102 -2.713 -5.749 -12.803 782 HG23 VAL 102 2HG2 VAL 102 -2.739 -4.349 -11.730 783 H THR 103 H THR 103 -1.906 -9.532 -10.829 784 HA THR 103 HA THR 103 -2.678 -10.211 -8.026 785 HB THR 103 HB THR 103 -1.222 -12.157 -9.813 786 HG1 THR 103 HG1 THR 103 -3.271 -11.080 -10.727 787 HG21 THR 103 3HG2 THR 103 -3.343 -12.412 -7.656 788 HG22 THR 103 1HG2 THR 103 -1.615 -12.706 -7.444 789 HG23 THR 103 2HG2 THR 103 -2.569 -13.759 -8.490 790 H VAL 104 H VAL 104 -1.291 -9.420 -6.655 791 HA VAL 104 HA VAL 104 1.609 -9.748 -7.131 792 HB VAL 104 HB VAL 104 0.768 -7.352 -7.505 793 HG11 VAL 104 1HG1 VAL 104 0.522 -7.346 -4.487 794 HG12 VAL 104 2HG1 VAL 104 -0.872 -7.516 -5.554 795 HG13 VAL 104 3HG1 VAL 104 0.109 -6.053 -5.613 796 HG21 VAL 104 3HG2 VAL 104 2.613 -6.391 -6.080 797 HG22 VAL 104 1HG2 VAL 104 3.110 -7.780 -7.046 798 HG23 VAL 104 2HG2 VAL 104 2.783 -7.976 -5.324 799 H GLN 105 H GLN 105 2.677 -10.589 -5.435 800 HA GLN 105 HA GLN 105 1.205 -10.905 -2.862 801 HB2 GLN 105 1HB GLN 105 1.646 -12.980 -4.377 802 HB3 GLN 105 2HB GLN 105 3.323 -12.813 -3.860 803 HG2 GLN 105 1HG GLN 105 0.974 -13.034 -1.959 804 HG3 GLN 105 2HG GLN 105 1.998 -14.384 -2.426 805 HE21 GLN 105 2HE2 GLN 105 1.669 -11.839 -0.170 806 HE22 GLN 105 1HE2 GLN 105 3.238 -11.902 0.475 807 H LEU 106 H LEU 106 2.134 -9.531 -1.353 808 HA LEU 106 HA LEU 106 4.879 -8.711 -1.642 809 HB2 LEU 106 1HB LEU 106 2.940 -8.260 0.632 810 HB3 LEU 106 2HB LEU 106 4.400 -7.335 0.288 811 HG LEU 106 HG LEU 106 1.991 -7.532 -1.545 812 HD11 LEU 106 1HD1 LEU 106 2.956 -5.323 0.296 813 HD12 LEU 106 2HD1 LEU 106 1.455 -6.234 0.442 814 HD13 LEU 106 3HD1 LEU 106 1.685 -5.129 -0.912 815 HD21 LEU 106 3HD2 LEU 106 3.828 -7.110 -2.951 816 HD22 LEU 106 1HD2 LEU 106 4.675 -6.155 -1.733 817 HD23 LEU 106 2HD2 LEU 106 3.270 -5.485 -2.566 818 H ASN 107 H ASN 107 6.532 -9.725 -0.844 819 HA ASN 107 HA ASN 107 6.127 -11.715 1.350 820 HB2 ASN 107 1HB ASN 107 8.401 -11.648 -0.617 821 HB3 ASN 107 2HB ASN 107 7.990 -12.933 0.514 822 HD21 ASN 107 2HD2 ASN 107 6.325 -11.053 -2.077 823 HD22 ASN 107 1HD2 ASN 107 5.521 -12.397 -2.726 824 H THR 108 H THR 108 6.319 -9.616 2.744 825 HA THR 108 HA THR 108 9.021 -8.645 3.084 826 HB THR 108 HB THR 108 8.150 -7.189 4.706 827 HG1 THR 108 HG1 THR 108 7.035 -8.377 6.086 828 HG21 THR 108 3HG2 THR 108 5.791 -7.680 2.882 829 HG22 THR 108 1HG2 THR 108 7.276 -6.900 2.341 830 HG23 THR 108 2HG2 THR 108 6.295 -6.152 3.602 831 H ALA 109 H ALA 109 9.726 -8.548 5.504 832 HA ALA 109 HA ALA 109 10.732 -10.997 6.224 833 HB1 ALA 109 3HB ALA 109 11.435 -8.774 7.139 834 HB2 ALA 109 1HB ALA 109 11.282 -10.037 8.360 835 HB3 ALA 109 2HB ALA 109 10.018 -8.818 8.191 836 H GLU 110 H GLU 110 7.669 -9.554 7.340 837 HA GLU 110 HA GLU 110 6.911 -12.219 8.415 838 HB2 GLU 110 1HB GLU 110 5.679 -11.069 10.202 839 HB3 GLU 110 2HB GLU 110 7.397 -10.673 10.269 840 HG2 GLU 110 1HG GLU 110 6.933 -8.574 9.010 841 HG3 GLU 110 2HG GLU 110 5.213 -8.956 9.053 842 H LEU 111 H LEU 111 5.917 -9.211 6.877 843 HA LEU 111 HA LEU 111 3.166 -9.928 6.658 844 HB2 LEU 111 1HB LEU 111 4.546 -7.594 6.326 845 HB3 LEU 111 2HB LEU 111 4.322 -8.056 4.644 846 HG LEU 111 HG LEU 111 1.815 -8.466 5.389 847 HD11 LEU 111 1HD1 LEU 111 1.120 -6.844 7.145 848 HD12 LEU 111 2HD1 LEU 111 2.820 -6.518 7.483 849 HD13 LEU 111 3HD1 LEU 111 2.153 -8.124 7.777 850 HD21 LEU 111 3HD2 LEU 111 2.134 -6.824 3.747 851 HD22 LEU 111 1HD2 LEU 111 3.198 -5.859 4.768 852 HD23 LEU 111 2HD2 LEU 111 1.461 -5.871 5.067 853 H LYS 112 H LYS 112 2.204 -11.196 5.221 854 HA LYS 112 HA LYS 112 3.354 -11.711 2.621 855 HB2 LYS 112 1HB LYS 112 4.519 -13.356 4.092 856 HB3 LYS 112 2HB LYS 112 2.939 -14.037 4.495 857 HG2 LYS 112 1HG LYS 112 2.519 -14.544 2.141 858 HG3 LYS 112 2HG LYS 112 4.043 -13.784 1.680 859 HD2 LYS 112 1HD LYS 112 5.274 -15.450 3.032 860 HD3 LYS 112 2HD LYS 112 3.746 -16.219 3.463 861 HE2 LYS 112 1HE LYS 112 3.299 -16.691 1.090 862 HE3 LYS 112 2HE LYS 112 4.810 -15.898 0.641 863 HZ1 LYS 112 3HZ LYS 112 5.386 -17.763 2.631 864 HZ2 LYS 112 1HZ LYS 112 5.858 -17.798 1.002 865 HZ3 LYS 112 2HZ LYS 112 4.411 -18.547 1.482 866 H LEU 113 H LEU 113 1.517 -10.904 1.730 867 HA LEU 113 HA LEU 113 -0.892 -12.596 2.016 868 HB2 LEU 113 1HB LEU 113 -0.605 -9.814 2.910 869 HB3 LEU 113 2HB LEU 113 -1.926 -9.987 1.768 870 HG LEU 113 HG LEU 113 -2.796 -10.277 4.010 871 HD11 LEU 113 1HD1 LEU 113 -2.792 -13.152 3.272 872 HD12 LEU 113 2HD1 LEU 113 -3.270 -12.057 1.978 873 HD13 LEU 113 3HD1 LEU 113 -4.139 -12.042 3.509 874 HD21 LEU 113 3HD2 LEU 113 -0.339 -11.282 4.710 875 HD22 LEU 113 1HD2 LEU 113 -1.306 -12.758 4.667 876 HD23 LEU 113 2HD2 LEU 113 -1.789 -11.418 5.697 877 H VAL 114 H VAL 114 -2.633 -11.561 0.372 878 HA VAL 114 HA VAL 114 -1.262 -11.098 -2.220 879 HB VAL 114 HB VAL 114 -3.596 -12.928 -1.598 880 HG11 VAL 114 1HG1 VAL 114 -3.420 -13.401 -4.115 881 HG12 VAL 114 2HG1 VAL 114 -2.497 -11.902 -4.221 882 HG13 VAL 114 3HG1 VAL 114 -4.167 -11.873 -3.650 883 HG21 VAL 114 3HG2 VAL 114 -2.177 -14.702 -2.261 884 HG22 VAL 114 1HG2 VAL 114 -1.151 -13.687 -1.251 885 HG23 VAL 114 2HG2 VAL 114 -1.013 -13.611 -3.009 886 H PHE 115 H PHE 115 -2.081 -9.425 -3.381 887 HA PHE 115 HA PHE 115 -4.707 -8.307 -2.607 888 HB2 PHE 115 1HB PHE 115 -2.114 -6.878 -3.184 889 HB3 PHE 115 2HB PHE 115 -3.677 -6.068 -3.289 890 HD1 PHE 115 HD1 PHE 115 -1.310 -7.772 -0.998 891 HD2 PHE 115 HD2 PHE 115 -4.980 -5.564 -1.344 892 HE1 PHE 115 HE1 PHE 115 -1.356 -7.456 1.463 893 HE2 PHE 115 HE2 PHE 115 -5.024 -5.259 1.103 894 HZ PHE 115 HZ PHE 115 -3.215 -6.199 2.517 895 H GLN 116 H GLN 116 -6.019 -7.670 -4.216 896 HA GLN 116 HA GLN 116 -5.191 -8.281 -6.979 897 HB2 GLN 116 1HB GLN 116 -7.159 -9.524 -5.812 898 HB3 GLN 116 2HB GLN 116 -8.047 -8.029 -6.094 899 HG2 GLN 116 1HG GLN 116 -8.479 -9.429 -7.983 900 HG3 GLN 116 2HG GLN 116 -7.350 -8.189 -8.526 901 HE21 GLN 116 2HE2 GLN 116 -5.532 -8.950 -9.574 902 HE22 GLN 116 1HE2 GLN 116 -4.925 -10.531 -9.457 903 H LEU 117 H LEU 117 -4.301 -6.254 -7.504 904 HA LEU 117 HA LEU 117 -5.971 -3.861 -7.222 905 HB2 LEU 117 1HB LEU 117 -3.269 -3.871 -8.546 906 HB3 LEU 117 2HB LEU 117 -4.010 -2.634 -7.542 907 HG LEU 117 HG LEU 117 -2.951 -5.304 -6.584 908 HD11 LEU 117 1HD1 LEU 117 -1.149 -3.771 -7.047 909 HD12 LEU 117 2HD1 LEU 117 -1.386 -3.805 -5.301 910 HD13 LEU 117 3HD1 LEU 117 -2.000 -2.448 -6.245 911 HD21 LEU 117 3HD2 LEU 117 -4.696 -4.921 -5.093 912 HD22 LEU 117 1HD2 LEU 117 -4.625 -3.169 -5.278 913 HD23 LEU 117 2HD2 LEU 117 -3.416 -4.002 -4.302 914 HA PRO 118 HA PRO 118 -7.302 -4.067 -11.459 915 HB2 PRO 118 1HB PRO 118 -7.788 -1.474 -12.079 916 HB3 PRO 118 2HB PRO 118 -8.765 -2.360 -10.888 917 HG2 PRO 118 1HG PRO 118 -6.525 -0.436 -10.440 918 HG3 PRO 118 2HG PRO 118 -8.079 -0.564 -9.595 919 HD2 PRO 118 1HD PRO 118 -5.737 -1.595 -8.592 920 HD3 PRO 118 2HD PRO 118 -7.333 -2.271 -8.208 921 H PHE 119 H PHE 119 -6.356 -4.289 -13.413 922 HA PHE 119 HA PHE 119 -3.750 -4.016 -13.982 923 HB2 PHE 119 1HB PHE 119 -5.395 -5.303 -15.274 924 HB3 PHE 119 2HB PHE 119 -6.014 -3.793 -15.946 925 HD1 PHE 119 HD2 PHE 119 -3.126 -6.092 -15.837 926 HD2 PHE 119 HD1 PHE 119 -4.774 -2.539 -17.596 927 HE1 PHE 119 HE2 PHE 119 -1.355 -6.131 -17.573 928 HE2 PHE 119 HE1 PHE 119 -3.005 -2.578 -19.333 929 HZ PHE 119 HZ PHE 119 -1.295 -4.374 -19.322 930 H GLY 120 H GLY 120 -2.361 -2.631 -14.682 931 HA2 GLY 120 1HA GLY 120 -1.436 -0.544 -14.958 932 HA3 GLY 120 2HA GLY 120 -2.483 -0.554 -16.366 933 H SER 121 H SER 121 -3.315 1.425 -16.500 934 HA SER 121 HA SER 121 -4.434 3.347 -15.946 935 HB2 SER 121 1HB SER 121 -6.378 3.087 -14.581 936 HB3 SER 121 2HB SER 121 -6.168 1.572 -15.453 937 HG SER 121 HG SER 121 -6.160 2.039 -12.802 938 H HIS 122 H HIS 122 -5.134 2.919 -12.719 939 HA HIS 122 HA HIS 122 -3.126 4.875 -11.937 940 HB2 HIS 122 1HB HIS 122 -5.592 4.922 -11.273 941 HB3 HIS 122 2HB HIS 122 -5.216 3.599 -10.172 942 HD2 HIS 122 HD2 HIS 122 -4.896 4.766 -7.706 943 HE1 HIS 122 HE1 HIS 122 -2.699 8.164 -8.903 944 HE2 HIS 122 HE2 HIS 122 -3.634 6.908 -6.905 945 H THR 123 H THR 123 -3.312 1.501 -12.006 946 HA THR 123 HA THR 123 -1.870 0.973 -9.565 947 HB THR 123 HB THR 123 -2.495 -0.815 -11.919 948 HG1 THR 123 HG1 THR 123 -4.066 -1.602 -10.490 949 HG21 THR 123 3HG2 THR 123 -1.991 -2.613 -10.158 950 HG22 THR 123 1HG2 THR 123 -1.225 -1.328 -9.222 951 HG23 THR 123 2HG2 THR 123 -0.599 -1.752 -10.816 952 H ARG 124 H ARG 124 -1.055 1.311 -13.002 953 HA ARG 124 HA ARG 124 1.500 0.200 -12.971 954 HB2 ARG 124 1HB ARG 124 0.280 0.925 -15.005 955 HB3 ARG 124 2HB ARG 124 0.562 2.600 -14.555 956 HG2 ARG 124 1HG ARG 124 3.005 2.186 -14.637 957 HG3 ARG 124 2HG ARG 124 2.688 0.524 -15.133 958 HD2 ARG 124 1HD ARG 124 1.397 1.446 -17.090 959 HD3 ARG 124 2HD ARG 124 1.954 3.051 -16.622 960 HE ARG 124 HE ARG 124 4.112 1.172 -16.939 961 HH11 ARG 124 1HH2 ARG 124 1.922 3.324 -18.533 962 HH12 ARG 124 2HH2 ARG 124 2.965 3.603 -19.887 963 HH21 ARG 124 1HH1 ARG 124 5.483 1.528 -18.708 964 HH22 ARG 124 2HH1 ARG 124 4.983 2.584 -19.985 965 H THR 125 H THR 125 0.480 3.510 -12.261 966 HA THR 125 HA THR 125 3.012 4.647 -11.975 967 HB THR 125 HB THR 125 0.427 5.323 -10.549 968 HG1 THR 125 HG1 THR 125 1.622 6.680 -12.703 969 HG21 THR 125 3HG2 THR 125 3.062 6.774 -10.783 970 HG22 THR 125 1HG2 THR 125 2.205 6.321 -9.311 971 HG23 THR 125 2HG2 THR 125 1.557 7.588 -10.353 972 H PHE 126 H PHE 126 0.927 3.029 -9.622 973 HA PHE 126 HA PHE 126 2.426 3.439 -7.315 974 HB2 PHE 126 1HB PHE 126 0.173 2.387 -7.396 975 HB3 PHE 126 2HB PHE 126 0.916 0.918 -8.029 976 HD1 PHE 126 HD2 PHE 126 2.506 -0.387 -6.634 977 HD2 PHE 126 HD1 PHE 126 0.387 3.011 -5.086 978 HE1 PHE 126 HE2 PHE 126 3.064 -1.091 -4.322 979 HE2 PHE 126 HE1 PHE 126 0.945 2.307 -2.775 980 HZ PHE 126 HZ PHE 126 2.282 0.255 -2.393 981 H LEU 127 H LEU 127 2.686 0.683 -9.617 982 HA LEU 127 HA LEU 127 4.634 -0.765 -8.356 983 HB2 LEU 127 1HB LEU 127 4.644 -0.246 -11.335 984 HB3 LEU 127 2HB LEU 127 5.227 -1.682 -10.493 985 HG LEU 127 HG LEU 127 2.360 -0.733 -10.623 986 HD11 LEU 127 1HD1 LEU 127 3.803 -3.071 -11.902 987 HD12 LEU 127 2HD1 LEU 127 3.107 -1.679 -12.735 988 HD13 LEU 127 3HD1 LEU 127 2.054 -2.843 -11.927 989 HD21 LEU 127 3HD2 LEU 127 2.548 -1.816 -8.537 990 HD22 LEU 127 1HD2 LEU 127 3.729 -2.979 -9.140 991 HD23 LEU 127 2HD2 LEU 127 2.035 -3.115 -9.610 992 H GLN 128 H GLN 128 5.197 1.950 -10.660 993 HA GLN 128 HA GLN 128 7.976 1.826 -10.535 994 HB2 GLN 128 1HB GLN 128 6.081 4.060 -11.199 995 HB3 GLN 128 2HB GLN 128 7.826 4.126 -11.468 996 HG2 GLN 128 1HG GLN 128 7.739 2.207 -12.935 997 HG3 GLN 128 2HG GLN 128 6.039 1.934 -12.546 998 HE21 GLN 128 2HE2 GLN 128 4.466 3.318 -13.484 999 HE22 GLN 128 1HE2 GLN 128 4.849 4.382 -14.734 1000 H GLU 129 H GLU 129 5.663 3.760 -8.628 1001 HA GLU 129 HA GLU 129 7.518 5.400 -7.330 1002 HB2 GLU 129 1HB GLU 129 4.865 4.336 -6.341 1003 HB3 GLU 129 2HB GLU 129 5.789 5.606 -5.541 1004 HG2 GLU 129 1HG GLU 129 4.891 5.764 -8.424 1005 HG3 GLU 129 2HG GLU 129 3.984 6.454 -7.083 1006 H VAL 130 H VAL 130 6.128 2.315 -6.152 1007 HA VAL 130 HA VAL 130 7.729 2.241 -3.817 1008 HB VAL 130 HB VAL 130 5.653 0.954 -4.022 1009 HG11 VAL 130 1HG1 VAL 130 7.167 -0.829 -5.940 1010 HG12 VAL 130 2HG1 VAL 130 6.004 0.394 -6.451 1011 HG13 VAL 130 3HG1 VAL 130 5.475 -0.962 -5.461 1012 HG21 VAL 130 3HG2 VAL 130 7.624 0.228 -2.545 1013 HG22 VAL 130 1HG2 VAL 130 7.957 -0.988 -3.779 1014 HG23 VAL 130 2HG2 VAL 130 6.420 -1.008 -2.913 1015 H ALA 131 H ALA 131 8.073 0.778 -7.002 1016 HA ALA 131 HA ALA 131 10.296 -0.824 -6.638 1017 HB1 ALA 131 3HB ALA 131 9.006 -0.730 -8.727 1018 HB2 ALA 131 1HB ALA 131 10.730 -0.537 -9.037 1019 HB3 ALA 131 2HB ALA 131 9.666 0.869 -9.068 1020 H ARG 132 H ARG 132 10.347 2.626 -7.591 1021 HA ARG 132 HA ARG 132 13.227 2.729 -7.479 1022 HB2 ARG 132 1HB ARG 132 12.983 5.067 -8.026 1023 HB3 ARG 132 2HB ARG 132 11.841 4.150 -9.008 1024 HG2 ARG 132 1HG ARG 132 10.079 4.645 -7.274 1025 HG3 ARG 132 2HG ARG 132 11.232 5.716 -6.487 1026 HD2 ARG 132 1HD ARG 132 11.445 7.007 -8.598 1027 HD3 ARG 132 2HD ARG 132 10.218 5.974 -9.327 1028 HE ARG 132 HE ARG 132 9.149 7.012 -6.952 1029 HH11 ARG 132 1HH2 ARG 132 10.283 8.073 -10.045 1030 HH12 ARG 132 2HH2 ARG 132 9.232 9.448 -10.111 1031 HH21 ARG 132 1HH1 ARG 132 7.772 8.810 -7.030 1032 HH22 ARG 132 2HH1 ARG 132 7.809 9.866 -8.402 1033 H ALA 133 H ALA 133 10.740 2.940 -5.183 1034 HA ALA 133 HA ALA 133 11.752 4.821 -3.369 1035 HB1 ALA 133 3HB ALA 133 10.260 3.891 -1.789 1036 HB2 ALA 133 1HB ALA 133 10.276 2.317 -2.575 1037 HB3 ALA 133 2HB ALA 133 9.480 3.686 -3.352 1038 H CYS 134 H CYS 134 13.053 1.800 -4.255 1039 HA CYS 134 HA CYS 134 15.401 1.966 -2.954 1040 HB2 CYS 134 1HB CYS 134 13.321 1.271 -0.968 1041 HB3 CYS 134 2HB CYS 134 14.724 0.212 -0.933 1042 HG CYS 134 HG CYS 134 15.273 3.268 -0.889 1043 HA PRO 135 HA PRO 135 14.429 -2.818 -3.564 1044 HB2 PRO 135 1HB PRO 135 12.167 -2.457 -5.488 1045 HB3 PRO 135 2HB PRO 135 12.414 -3.713 -4.259 1046 HG2 PRO 135 1HG PRO 135 10.655 -1.751 -3.879 1047 HG3 PRO 135 2HG PRO 135 11.647 -2.368 -2.542 1048 HD2 PRO 135 1HD PRO 135 11.957 0.184 -4.089 1049 HD3 PRO 135 2HD PRO 135 12.242 -0.132 -2.369 1050 H GLY 136 H GLY 136 13.508 -0.695 -6.295 1051 HA2 GLY 136 1HA GLY 136 14.211 -1.482 -8.579 1052 HA3 GLY 136 2HA GLY 136 15.106 -0.077 -8.019 1053 H PHE 137 H PHE 137 15.150 -3.589 -8.197 1054 HA PHE 137 HA PHE 137 17.255 -4.707 -7.318 1055 HB2 PHE 137 1HB PHE 137 16.713 -4.629 -10.290 1056 HB3 PHE 137 2HB PHE 137 17.792 -5.785 -9.511 1057 HD1 PHE 137 HD2 PHE 137 16.908 -7.495 -7.958 1058 HD2 PHE 137 HD1 PHE 137 14.298 -4.760 -10.003 1059 HE1 PHE 137 HE2 PHE 137 14.961 -8.924 -7.389 1060 HE2 PHE 137 HE1 PHE 137 12.355 -6.191 -9.433 1061 HZ PHE 137 HZ PHE 137 12.686 -8.272 -8.126 1062 H ASP 138 H ASP 138 18.583 -2.951 -6.547 1063 HA ASP 138 HA ASP 138 20.955 -2.624 -8.230 1064 HB2 ASP 138 1HB ASP 138 19.327 -0.284 -7.215 1065 HB3 ASP 138 2HB ASP 138 20.986 -0.138 -7.783 1066 HA PRO 139 HA PRO 139 22.803 -3.111 -4.221 1067 HB2 PRO 139 1HB PRO 139 25.275 -1.994 -4.605 1068 HB3 PRO 139 2HB PRO 139 24.798 -3.550 -5.314 1069 HG2 PRO 139 1HG PRO 139 24.873 -0.843 -6.578 1070 HG3 PRO 139 2HG PRO 139 25.387 -2.408 -7.237 1071 HD2 PRO 139 1HD PRO 139 22.993 -1.266 -7.885 1072 HD3 PRO 139 2HD PRO 139 23.223 -3.025 -7.825 1073 H GLU 140 H GLU 140 21.610 -0.281 -5.231 1074 HA GLU 140 HA GLU 140 22.885 1.626 -3.524 1075 HB2 GLU 140 1HB GLU 140 20.193 1.618 -4.903 1076 HB3 GLU 140 2HB GLU 140 20.845 3.000 -4.021 1077 HG2 GLU 140 1HG GLU 140 22.791 3.070 -5.497 1078 HG3 GLU 140 2HG GLU 140 22.229 1.629 -6.343 1079 H THR 141 H THR 141 19.931 -0.320 -3.268 1080 HA THR 141 HA THR 141 18.952 0.692 -0.857 1081 HB THR 141 HB THR 141 17.418 -0.697 -1.900 1082 HG1 THR 141 HG1 THR 141 18.723 -2.588 -0.249 1083 HG21 THR 141 3HG2 THR 141 19.814 -2.402 -2.559 1084 HG22 THR 141 1HG2 THR 141 18.642 -1.653 -3.645 1085 HG23 THR 141 2HG2 THR 141 18.178 -3.059 -2.688 1086 H ARG 142 H ARG 142 20.173 0.930 0.909 1087 HA ARG 142 HA ARG 142 21.132 -1.434 2.297 1088 HB2 ARG 142 1HB ARG 142 23.446 -0.738 2.489 1089 HB3 ARG 142 2HB ARG 142 23.029 -0.882 0.780 1090 HG2 ARG 142 1HG ARG 142 22.562 1.593 0.760 1091 HG3 ARG 142 2HG ARG 142 23.190 1.677 2.404 1092 HD2 ARG 142 1HD ARG 142 25.343 0.757 1.633 1093 HD3 ARG 142 2HD ARG 142 24.722 0.692 -0.015 1094 HE ARG 142 HE ARG 142 24.388 3.317 0.890 1095 HH11 ARG 142 1HH2 ARG 142 26.915 1.042 0.268 1096 HH12 ARG 142 2HH2 ARG 142 28.084 2.246 -0.159 1097 HH21 ARG 142 1HH1 ARG 142 25.908 4.904 0.332 1098 HH22 ARG 142 2HH1 ARG 142 27.513 4.438 -0.122 1099 H ASP 143 H ASP 143 19.320 0.949 2.539 1100 HA ASP 143 HA ASP 143 19.822 1.474 5.324 1101 HB2 ASP 143 1HB ASP 143 21.313 3.101 3.986 1102 HB3 ASP 143 2HB ASP 143 19.811 3.927 3.581 1103 HA PRO 144 HA PRO 144 15.411 1.603 3.623 1104 HB2 PRO 144 1HB PRO 144 14.407 0.013 5.699 1105 HB3 PRO 144 2HB PRO 144 14.909 -0.594 4.109 1106 HG2 PRO 144 1HG PRO 144 16.419 -0.552 6.685 1107 HG3 PRO 144 2HG PRO 144 16.326 -1.828 5.453 1108 HD2 PRO 144 1HD PRO 144 18.470 -0.239 5.611 1109 HD3 PRO 144 2HD PRO 144 17.844 -0.744 4.028 1110 H GLU 145 H GLU 145 16.817 1.966 6.803 1111 HA GLU 145 HA GLU 145 16.277 3.317 8.619 1112 HB2 GLU 145 1HB GLU 145 15.460 5.091 6.300 1113 HB3 GLU 145 2HB GLU 145 15.638 5.644 7.965 1114 HG2 GLU 145 1HG GLU 145 18.001 4.958 7.955 1115 HG3 GLU 145 2HG GLU 145 17.824 4.368 6.302 1116 H PHE 146 H PHE 146 14.609 2.309 9.715 1117 HA PHE 146 HA PHE 146 11.833 2.915 8.842 1118 HB2 PHE 146 1HB PHE 146 11.381 0.948 10.533 1119 HB3 PHE 146 2HB PHE 146 11.965 0.588 8.909 1120 HD1 PHE 146 HD2 PHE 146 14.390 0.117 8.524 1121 HD2 PHE 146 HD1 PHE 146 12.745 0.551 12.469 1122 HE1 PHE 146 HE2 PHE 146 16.407 -0.960 9.484 1123 HE2 PHE 146 HE1 PHE 146 14.764 -0.526 13.427 1124 HZ PHE 146 HZ PHE 146 16.595 -1.281 11.933 1125 H GLU 147 H GLU 147 14.185 3.690 11.092 1126 HA GLU 147 HA GLU 147 12.750 3.963 13.489 1127 HB2 GLU 147 1HB GLU 147 15.208 4.067 13.312 1128 HB3 GLU 147 2HB GLU 147 15.072 5.628 12.504 1129 HG2 GLU 147 1HG GLU 147 14.000 6.596 14.475 1130 HG3 GLU 147 2HG GLU 147 14.018 5.029 15.283 1131 H TRP 148 H TRP 148 12.925 6.113 10.685 1132 HA TRP 148 HA TRP 148 11.887 8.408 11.986 1133 HB2 TRP 148 1HB TRP 148 11.467 9.268 9.729 1134 HB3 TRP 148 2HB TRP 148 13.070 8.545 9.844 1135 HD1 TRP 148 HD1 TRP 148 13.398 6.110 8.736 1136 HE1 TRP 148 HE1 TRP 148 12.162 4.986 6.774 1137 HE3 TRP 148 HE3 TRP 148 9.218 9.034 8.531 1138 HZ2 TRP 148 HZ2 TRP 148 9.728 5.288 5.307 1139 HZ3 TRP 148 HZ3 TRP 148 7.456 8.594 6.844 1140 HH2 TRP 148 HH2 TRP 148 7.704 6.724 5.233 1141 H LEU 149 H LEU 149 10.363 5.540 10.744 1142 HA LEU 149 HA LEU 149 7.745 6.592 10.393 1143 HB2 LEU 149 1HB LEU 149 7.065 4.404 10.027 1144 HB3 LEU 149 2HB LEU 149 8.783 4.289 9.666 1145 HG LEU 149 HG LEU 149 8.984 3.700 12.250 1146 HD11 LEU 149 1HD1 LEU 149 6.432 2.267 12.117 1147 HD12 LEU 149 2HD1 LEU 149 6.180 4.008 12.087 1148 HD13 LEU 149 3HD1 LEU 149 7.094 3.274 13.398 1149 HD21 LEU 149 3HD2 LEU 149 8.927 1.368 11.714 1150 HD22 LEU 149 1HD2 LEU 149 9.429 2.190 10.238 1151 HD23 LEU 149 2HD2 LEU 149 7.767 1.629 10.414 1152 H SER 150 H SER 150 9.532 5.448 13.184 1153 HA SER 150 HA SER 150 7.533 4.980 15.016 1154 HB2 SER 150 1HB SER 150 10.204 6.346 15.419 1155 HB3 SER 150 2HB SER 150 9.180 5.771 16.732 1156 HG SER 150 HG SER 150 10.521 4.312 14.718 1157 H ARG 151 H ARG 151 8.831 8.050 13.869 1158 HA ARG 151 HA ARG 151 7.523 9.761 15.693 1159 HB2 ARG 151 1HB ARG 151 8.378 10.142 12.815 1160 HB3 ARG 151 2HB ARG 151 7.781 11.448 13.840 1161 HG2 ARG 151 1HG ARG 151 9.598 11.081 15.430 1162 HG3 ARG 151 2HG ARG 151 10.169 9.697 14.497 1163 HD2 ARG 151 1HD ARG 151 10.586 11.180 12.562 1164 HD3 ARG 151 2HD ARG 151 10.032 12.559 13.509 1165 HE ARG 151 HE ARG 151 12.056 11.340 14.984 1166 HH11 ARG 151 1HH2 ARG 151 11.625 12.883 11.913 1167 HH12 ARG 151 2HH2 ARG 151 13.252 13.469 11.827 1168 HH21 ARG 151 1HH1 ARG 151 14.187 12.101 14.872 1169 HH22 ARG 151 2HH1 ARG 151 14.702 13.027 13.502 1170 H HIS 152 H HIS 152 6.581 8.279 12.666 1171 HA HIS 152 HA HIS 152 4.004 9.571 12.573 1172 HB2 HIS 152 1HB HIS 152 5.209 7.282 10.998 1173 HB3 HIS 152 2HB HIS 152 3.610 7.962 10.690 1174 HD2 HIS 152 HD2 HIS 152 7.375 8.903 10.149 1175 HE1 HIS 152 HE1 HIS 152 5.014 11.993 8.498 1176 HE2 HIS 152 HE2 HIS 152 7.377 11.088 8.716 1177 H THR 153 H THR 153 2.034 8.593 12.987 1178 HA THR 153 HA THR 153 2.138 6.135 14.651 1179 HB THR 153 HB THR 153 1.406 8.231 15.828 1180 HG1 THR 153 HG1 THR 153 -0.320 7.186 16.782 1181 HG21 THR 153 3HG2 THR 153 -0.578 9.346 15.240 1182 HG22 THR 153 1HG2 THR 153 -1.136 8.019 14.224 1183 HG23 THR 153 2HG2 THR 153 0.184 9.053 13.678 1184 H CYS 154 H CYS 154 -0.605 5.662 14.674 1185 HA CYS 154 HA CYS 154 -1.041 4.811 11.870 1186 HB2 CYS 154 1HB CYS 154 -2.260 3.667 14.393 1187 HB3 CYS 154 2HB CYS 154 -2.384 3.011 12.762 1188 HG CYS 154 HG CYS 154 -0.338 2.034 14.417 1189 H ALA 155 H ALA 155 -3.805 4.232 13.462 1190 HA ALA 155 HA ALA 155 -5.040 6.774 12.562 1191 HB1 ALA 155 3HB ALA 155 -6.076 3.948 12.764 1192 HB2 ALA 155 1HB ALA 155 -6.016 5.001 11.351 1193 HB3 ALA 155 2HB ALA 155 -7.167 5.330 12.643 1194 H GLU 156 H GLU 156 -3.787 6.872 15.008 1195 HA GLU 156 HA GLU 156 -5.569 6.244 17.167 1196 HB2 GLU 156 1HB GLU 156 -3.329 8.262 17.247 1197 HB3 GLU 156 2HB GLU 156 -3.986 7.307 18.576 1198 HG2 GLU 156 1HG GLU 156 -3.243 5.241 17.233 1199 HG3 GLU 156 2HG GLU 156 -2.300 6.363 16.256 1200 HA PRO 157 HA PRO 157 -8.373 9.718 16.211 1201 HB2 PRO 157 1HB PRO 157 -8.998 9.284 19.117 1202 HB3 PRO 157 2HB PRO 157 -10.110 9.542 17.756 1203 HG2 PRO 157 1HG PRO 157 -9.737 7.115 18.744 1204 HG3 PRO 157 2HG PRO 157 -9.886 7.372 16.995 1205 HD2 PRO 157 1HD PRO 157 -7.435 6.749 18.601 1206 HD3 PRO 157 2HD PRO 157 -7.838 6.300 16.928 1207 H ASP 158 H ASP 158 -8.832 11.872 17.215 1208 HA ASP 158 HA ASP 158 -8.076 13.918 17.936 1209 HB2 ASP 158 1HB ASP 158 -8.240 12.777 20.136 1210 HB3 ASP 158 2HB ASP 158 -6.562 12.264 19.970 1211 H ALA 159 H ALA 159 -6.724 15.088 16.764 1212 HA ALA 159 HA ALA 159 -4.270 14.012 15.725 1213 HB1 ALA 159 3HB ALA 159 -4.015 16.300 14.743 1214 HB2 ALA 159 1HB ALA 159 -5.479 16.782 15.598 1215 HB3 ALA 159 2HB ALA 159 -5.555 15.533 14.354 1216 H GLU 160 H GLU 160 -5.109 15.514 18.633 1217 HA GLU 160 HA GLU 160 -3.896 16.426 20.361 1218 HB2 GLU 160 1HB GLU 160 -1.760 14.761 19.015 1219 HB3 GLU 160 2HB GLU 160 -1.550 15.549 20.578 1220 HG2 GLU 160 1HG GLU 160 -3.446 14.301 21.495 1221 HG3 GLU 160 2HG GLU 160 -3.737 13.554 19.925 1222 H SER 161 H SER 161 -4.070 17.915 17.806 1223 HA SER 161 HA SER 161 -1.763 19.148 16.963 1224 HB2 SER 161 1HB SER 161 -3.134 21.044 16.343 1225 HB3 SER 161 2HB SER 161 -4.062 19.572 16.076 1226 HG SER 161 HG SER 161 -4.948 19.948 18.216 Start of MODEL 8 1 H1 GLY 1 1H GLY 1 -8.973 14.687 -11.831 2 H2 GLY 1 2H GLY 1 -10.099 14.035 -12.921 3 H3 GLY 1 3H GLY 1 -10.567 14.391 -11.328 4 HA2 GLY 1 1HA GLY 1 -9.547 16.749 -12.341 5 HA3 GLY 1 2HA GLY 1 -10.574 16.071 -13.605 6 HA PRO 2 HA PRO 2 -13.197 18.503 -10.563 7 HB2 PRO 2 1HB PRO 2 -14.631 18.933 -13.159 8 HB3 PRO 2 2HB PRO 2 -14.258 20.097 -11.871 9 HG2 PRO 2 1HG PRO 2 -12.885 20.096 -14.147 10 HG3 PRO 2 2HG PRO 2 -12.081 20.402 -12.597 11 HD2 PRO 2 1HD PRO 2 -12.048 17.914 -14.277 12 HD3 PRO 2 2HD PRO 2 -10.750 18.624 -13.290 13 H LEU 3 H LEU 3 -14.051 16.302 -13.208 14 HA LEU 3 HA LEU 3 -16.640 15.613 -12.592 15 HB2 LEU 3 1HB LEU 3 -14.318 14.025 -13.664 16 HB3 LEU 3 2HB LEU 3 -15.838 13.199 -13.322 17 HG LEU 3 HG LEU 3 -17.030 14.802 -14.784 18 HD11 LEU 3 1HD1 LEU 3 -15.708 16.775 -14.615 19 HD12 LEU 3 2HD1 LEU 3 -15.505 16.228 -16.281 20 HD13 LEU 3 3HD1 LEU 3 -14.239 15.924 -15.091 21 HD21 LEU 3 3HD2 LEU 3 -16.088 13.999 -16.922 22 HD22 LEU 3 1HD2 LEU 3 -16.128 12.698 -15.730 23 HD23 LEU 3 2HD2 LEU 3 -14.610 13.518 -16.090 24 H GLY 4 H GLY 4 -13.699 14.092 -11.203 25 HA2 GLY 4 1HA GLY 4 -13.372 13.394 -9.006 26 HA3 GLY 4 2HA GLY 4 -15.062 13.742 -8.659 27 H SER 5 H SER 5 -13.391 11.356 -8.075 28 HA SER 5 HA SER 5 -15.330 9.363 -8.894 29 HB2 SER 5 1HB SER 5 -12.450 9.198 -9.804 30 HB3 SER 5 2HB SER 5 -13.589 7.855 -9.857 31 HG SER 5 HG SER 5 -13.998 8.702 -11.755 32 H MET 6 H MET 6 -12.617 7.655 -8.367 33 HA MET 6 HA MET 6 -13.359 6.838 -5.764 34 HB2 MET 6 1HB MET 6 -10.793 6.443 -7.312 35 HB3 MET 6 2HB MET 6 -11.141 5.658 -5.771 36 HG2 MET 6 1HG MET 6 -13.182 4.654 -6.755 37 HG3 MET 6 2HG MET 6 -12.794 5.409 -8.302 38 HE1 MET 6 3HE MET 6 -13.182 2.206 -8.246 39 HE2 MET 6 1HE MET 6 -11.895 1.968 -9.436 40 HE3 MET 6 2HE MET 6 -12.935 3.388 -9.529 41 H ASP 7 H ASP 7 -10.594 8.772 -6.862 42 HA ASP 7 HA ASP 7 -9.277 10.337 -5.807 43 HB2 ASP 7 1HB ASP 7 -11.766 10.586 -4.109 44 HB3 ASP 7 2HB ASP 7 -10.351 11.606 -3.902 45 H GLN 8 H GLN 8 -8.581 7.834 -5.244 46 HA GLN 8 HA GLN 8 -8.526 7.091 -2.505 47 HB2 GLN 8 1HB GLN 8 -6.540 6.445 -4.685 48 HB3 GLN 8 2HB GLN 8 -6.702 5.584 -3.146 49 HG2 GLN 8 1HG GLN 8 -8.865 5.814 -5.252 50 HG3 GLN 8 2HG GLN 8 -7.821 4.414 -5.029 51 HE21 GLN 8 2HE2 GLN 8 -10.537 4.004 -4.782 52 HE22 GLN 8 1HE2 GLN 8 -10.925 3.736 -3.160 53 H SER 9 H SER 9 -6.064 8.697 -4.528 54 HA SER 9 HA SER 9 -4.060 9.030 -2.663 55 HB2 SER 9 1HB SER 9 -4.894 11.053 -4.750 56 HB3 SER 9 2HB SER 9 -3.329 10.992 -3.943 57 HG SER 9 HG SER 9 -3.728 9.879 -6.116 58 H VAL 10 H VAL 10 -6.884 11.140 -3.168 59 HA VAL 10 HA VAL 10 -6.167 13.119 -1.288 60 HB VAL 10 HB VAL 10 -8.897 12.179 -2.192 61 HG11 VAL 10 1HG1 VAL 10 -9.477 14.604 -1.494 62 HG12 VAL 10 2HG1 VAL 10 -7.993 14.538 -0.545 63 HG13 VAL 10 3HG1 VAL 10 -9.302 13.403 -0.216 64 HG21 VAL 10 3HG2 VAL 10 -6.965 14.295 -3.162 65 HG22 VAL 10 1HG2 VAL 10 -8.677 14.319 -3.589 66 HG23 VAL 10 2HG2 VAL 10 -7.664 12.960 -4.080 67 H ALA 11 H ALA 11 -8.204 10.236 -0.977 68 HA ALA 11 HA ALA 11 -9.174 10.326 1.521 69 HB1 ALA 11 3HB ALA 11 -9.364 8.352 0.002 70 HB2 ALA 11 1HB ALA 11 -9.014 7.913 1.672 71 HB3 ALA 11 2HB ALA 11 -7.731 7.882 0.470 72 H ILE 12 H ILE 12 -5.797 9.450 0.760 73 HA ILE 12 HA ILE 12 -4.999 8.907 3.384 74 HB ILE 12 HB ILE 12 -3.318 10.126 1.187 75 HG12 ILE 12 1HG1 ILE 12 -4.465 8.196 0.281 76 HG13 ILE 12 2HG1 ILE 12 -2.797 7.746 0.621 77 HG21 ILE 12 1HG2 ILE 12 -2.047 10.111 3.183 78 HG22 ILE 12 2HG2 ILE 12 -1.564 8.638 2.341 79 HG23 ILE 12 3HG2 ILE 12 -2.701 8.551 3.687 80 HD11 ILE 12 3HD1 ILE 12 -5.299 6.964 2.094 81 HD12 ILE 12 1HD1 ILE 12 -3.748 6.953 2.930 82 HD13 ILE 12 2HD1 ILE 12 -3.990 5.938 1.512 83 H GLN 13 H GLN 13 -4.612 11.846 1.499 84 HA GLN 13 HA GLN 13 -3.483 13.432 3.518 85 HB2 GLN 13 1HB GLN 13 -4.647 13.934 0.891 86 HB3 GLN 13 2HB GLN 13 -5.045 15.243 2.001 87 HG2 GLN 13 1HG GLN 13 -2.238 14.161 1.580 88 HG3 GLN 13 2HG GLN 13 -2.877 15.603 0.790 89 HE21 GLN 13 2HE2 GLN 13 -1.075 14.650 3.511 90 HE22 GLN 13 1HE2 GLN 13 -1.392 16.003 4.485 91 H GLU 14 H GLU 14 -6.954 13.274 2.594 92 HA GLU 14 HA GLU 14 -7.960 14.919 4.568 93 HB2 GLU 14 1HB GLU 14 -9.115 12.392 3.363 94 HB3 GLU 14 2HB GLU 14 -10.039 13.527 4.348 95 HG2 GLU 14 1HG GLU 14 -8.555 14.293 1.817 96 HG3 GLU 14 2HG GLU 14 -10.275 13.915 1.873 97 H THR 15 H THR 15 -6.312 11.994 4.940 98 HA THR 15 HA THR 15 -7.331 11.642 7.717 99 HB THR 15 HB THR 15 -6.680 9.307 7.556 100 HG1 THR 15 HG1 THR 15 -6.184 9.039 4.992 101 HG21 THR 15 3HG2 THR 15 -8.883 9.447 6.807 102 HG22 THR 15 1HG2 THR 15 -8.102 8.739 5.394 103 HG23 THR 15 2HG2 THR 15 -8.464 10.460 5.425 104 H LEU 16 H LEU 16 -4.515 12.135 5.721 105 HA LEU 16 HA LEU 16 -2.635 11.505 7.831 106 HB2 LEU 16 1HB LEU 16 -2.266 11.262 5.281 107 HB3 LEU 16 2HB LEU 16 -1.971 12.996 5.300 108 HG LEU 16 HG LEU 16 -0.256 12.581 7.134 109 HD11 LEU 16 1HD1 LEU 16 -0.975 9.736 6.434 110 HD12 LEU 16 2HD1 LEU 16 -0.642 10.444 8.014 111 HD13 LEU 16 3HD1 LEU 16 0.680 10.117 6.907 112 HD21 LEU 16 3HD2 LEU 16 0.674 13.067 5.040 113 HD22 LEU 16 1HD2 LEU 16 0.018 11.610 4.292 114 HD23 LEU 16 2HD2 LEU 16 1.385 11.493 5.395 115 H VAL 17 H VAL 17 -1.274 12.991 8.899 116 HA VAL 17 HA VAL 17 -2.536 15.525 9.466 117 HB VAL 17 HB VAL 17 -0.698 15.796 11.093 118 HG11 VAL 17 1HG1 VAL 17 -1.281 13.915 12.527 119 HG12 VAL 17 2HG1 VAL 17 -1.850 12.990 11.137 120 HG13 VAL 17 3HG1 VAL 17 -2.722 14.435 11.652 121 HG21 VAL 17 3HG2 VAL 17 0.319 13.311 9.702 122 HG22 VAL 17 1HG2 VAL 17 0.834 13.742 11.332 123 HG23 VAL 17 2HG2 VAL 17 1.171 14.828 9.985 124 H GLU 18 H GLU 18 -0.676 17.364 9.752 125 HA GLU 18 HA GLU 18 0.029 18.018 7.048 126 HB2 GLU 18 1HB GLU 18 0.896 20.107 8.058 127 HB3 GLU 18 2HB GLU 18 -0.755 19.746 8.568 128 HG2 GLU 18 1HG GLU 18 0.102 18.748 10.652 129 HG3 GLU 18 2HG GLU 18 1.752 19.110 10.152 130 H GLY 19 H GLY 19 2.324 19.354 7.167 131 HA2 GLY 19 1HA GLY 19 4.606 19.172 7.006 132 HA3 GLY 19 2HA GLY 19 4.519 18.106 8.402 133 H GLU 20 H GLU 20 2.896 16.047 7.184 134 HA GLU 20 HA GLU 20 5.014 14.662 5.808 135 HB2 GLU 20 1HB GLU 20 2.204 13.919 6.591 136 HB3 GLU 20 2HB GLU 20 3.236 12.845 5.643 137 HG2 GLU 20 1HG GLU 20 4.905 12.790 7.380 138 HG3 GLU 20 2HG GLU 20 4.059 14.036 8.302 139 H TYR 21 H TYR 21 4.243 13.252 3.879 140 HA TYR 21 HA TYR 21 2.766 14.860 1.886 141 HB2 TYR 21 1HB TYR 21 5.251 15.342 1.797 142 HB3 TYR 21 2HB TYR 21 5.475 13.647 1.358 143 HD1 TYR 21 HD1 TYR 21 4.040 16.884 0.272 144 HD2 TYR 21 HD2 TYR 21 4.857 12.806 -0.796 145 HE1 TYR 21 HE1 TYR 21 3.544 17.405 -2.102 146 HE2 TYR 21 HE2 TYR 21 4.360 13.324 -3.168 147 HH TYR 21 HH TYR 21 2.704 15.879 -4.175 148 H CYS 22 H CYS 22 1.329 13.608 0.895 149 HA CYS 22 HA CYS 22 1.672 10.690 0.922 150 HB2 CYS 22 1HB CYS 22 -0.540 11.690 1.527 151 HB3 CYS 22 2HB CYS 22 -0.657 12.336 -0.110 152 HG CYS 22 HG CYS 22 -0.770 9.311 0.628 153 H VAL 23 H VAL 23 1.919 9.489 -1.008 154 HA VAL 23 HA VAL 23 2.683 11.110 -3.368 155 HB VAL 23 HB VAL 23 3.511 8.325 -2.527 156 HG11 VAL 23 1HG1 VAL 23 4.239 10.052 -4.908 157 HG12 VAL 23 2HG1 VAL 23 3.506 8.448 -4.932 158 HG13 VAL 23 3HG1 VAL 23 5.176 8.644 -4.409 159 HG21 VAL 23 3HG2 VAL 23 5.151 10.864 -2.693 160 HG22 VAL 23 1HG2 VAL 23 5.638 9.313 -2.006 161 HG23 VAL 23 2HG2 VAL 23 4.409 10.289 -1.199 162 H ILE 24 H ILE 24 1.146 8.040 -2.421 163 HA ILE 24 HA ILE 24 -0.875 8.298 -4.442 164 HB ILE 24 HB ILE 24 0.979 7.649 -5.875 165 HG12 ILE 24 1HG1 ILE 24 -0.742 5.194 -5.456 166 HG13 ILE 24 2HG1 ILE 24 -1.347 6.666 -6.220 167 HG21 ILE 24 1HG2 ILE 24 2.342 6.558 -4.111 168 HG22 ILE 24 2HG2 ILE 24 2.175 5.549 -5.548 169 HG23 ILE 24 3HG2 ILE 24 1.217 5.199 -4.108 170 HD11 ILE 24 3HD1 ILE 24 0.037 6.432 -8.076 171 HD12 ILE 24 1HD1 ILE 24 -0.311 4.747 -7.705 172 HD13 ILE 24 2HD1 ILE 24 1.222 5.458 -7.208 173 H ALA 25 H ALA 25 -2.306 6.392 -4.503 174 HA ALA 25 HA ALA 25 -2.100 4.333 -2.540 175 HB1 ALA 25 3HB ALA 25 -3.963 6.654 -1.984 176 HB2 ALA 25 1HB ALA 25 -2.624 6.118 -0.976 177 HB3 ALA 25 2HB ALA 25 -4.047 5.096 -1.162 178 H VAL 26 H VAL 26 -3.074 2.713 -3.624 179 HA VAL 26 HA VAL 26 -5.377 3.371 -5.368 180 HB VAL 26 HB VAL 26 -3.767 0.809 -5.285 181 HG11 VAL 26 1HG1 VAL 26 -5.986 1.855 -6.973 182 HG12 VAL 26 2HG1 VAL 26 -5.491 0.193 -6.673 183 HG13 VAL 26 3HG1 VAL 26 -4.643 1.153 -7.875 184 HG21 VAL 26 3HG2 VAL 26 -3.178 3.467 -6.564 185 HG22 VAL 26 1HG2 VAL 26 -2.762 2.006 -7.457 186 HG23 VAL 26 2HG2 VAL 26 -2.073 2.289 -5.860 187 H GLN 27 H GLN 27 -6.596 0.918 -5.519 188 HA GLN 27 HA GLN 27 -7.321 0.194 -2.765 189 HB2 GLN 27 1HB GLN 27 -8.923 1.878 -3.928 190 HB3 GLN 27 2HB GLN 27 -9.394 0.511 -4.932 191 HG2 GLN 27 1HG GLN 27 -9.435 0.399 -1.905 192 HG3 GLN 27 2HG GLN 27 -10.821 0.910 -2.862 193 HE21 GLN 27 2HE2 GLN 27 -10.887 -1.457 -1.235 194 HE22 GLN 27 1HE2 GLN 27 -11.040 -2.792 -2.270 195 H GLY 28 H GLY 28 -7.061 -1.893 -2.499 196 HA2 GLY 28 1HA GLY 28 -7.531 -3.711 -4.816 197 HA3 GLY 28 2HA GLY 28 -6.139 -3.899 -3.755 198 H VAL 29 H VAL 29 -7.991 -5.919 -4.213 199 HA VAL 29 HA VAL 29 -9.619 -6.056 -1.763 200 HB VAL 29 HB VAL 29 -9.557 -8.115 -3.976 201 HG11 VAL 29 1HG1 VAL 29 -11.632 -7.225 -1.947 202 HG12 VAL 29 2HG1 VAL 29 -10.742 -8.746 -1.939 203 HG13 VAL 29 3HG1 VAL 29 -11.921 -8.423 -3.206 204 HG21 VAL 29 3HG2 VAL 29 -11.592 -6.813 -4.853 205 HG22 VAL 29 1HG2 VAL 29 -10.010 -6.111 -5.185 206 HG23 VAL 29 2HG2 VAL 29 -11.007 -5.463 -3.884 207 H LEU 30 H LEU 30 -9.585 -8.167 -0.657 208 HA LEU 30 HA LEU 30 -7.036 -9.634 -0.796 209 HB2 LEU 30 1HB LEU 30 -6.692 -7.916 0.961 210 HB3 LEU 30 2HB LEU 30 -8.174 -8.433 1.763 211 HG LEU 30 HG LEU 30 -7.207 -10.683 2.091 212 HD11 LEU 30 1HD1 LEU 30 -4.966 -9.491 0.493 213 HD12 LEU 30 2HD1 LEU 30 -5.686 -11.100 0.390 214 HD13 LEU 30 3HD1 LEU 30 -4.594 -10.710 1.713 215 HD21 LEU 30 3HD2 LEU 30 -5.229 -8.629 3.078 216 HD22 LEU 30 1HD2 LEU 30 -5.772 -10.100 3.886 217 HD23 LEU 30 2HD2 LEU 30 -6.873 -8.735 3.715 218 H CYS 31 H CYS 31 -7.684 -11.745 -1.014 219 HA CYS 31 HA CYS 31 -10.326 -12.495 0.063 220 HB2 CYS 31 1HB CYS 31 -10.136 -12.927 -2.282 221 HB3 CYS 31 2HB CYS 31 -8.552 -13.674 -2.080 222 HG CYS 31 HG CYS 31 -11.178 -15.111 -1.773 223 H LYS 32 H LYS 32 -10.480 -13.813 1.715 224 HA LYS 32 HA LYS 32 -8.126 -15.444 2.501 225 HB2 LYS 32 1HB LYS 32 -8.681 -13.518 4.086 226 HB3 LYS 32 2HB LYS 32 -10.191 -14.363 4.426 227 HG2 LYS 32 1HG LYS 32 -8.839 -15.263 6.097 228 HG3 LYS 32 2HG LYS 32 -8.579 -16.443 4.819 229 HD2 LYS 32 1HD LYS 32 -6.373 -15.992 5.380 230 HD3 LYS 32 2HD LYS 32 -6.611 -14.769 4.135 231 HE2 LYS 32 1HE LYS 32 -7.200 -13.120 5.896 232 HE3 LYS 32 2HE LYS 32 -6.892 -14.344 7.126 233 HZ1 LYS 32 3HZ LYS 32 -4.622 -14.512 5.849 234 HZ2 LYS 32 1HZ LYS 32 -4.868 -13.336 7.045 235 HZ3 LYS 32 2HZ LYS 32 -5.000 -12.916 5.405 236 H GLY 33 H GLY 33 -8.536 -17.506 2.172 237 HA2 GLY 33 1HA GLY 33 -9.660 -19.496 1.948 238 HA3 GLY 33 2HA GLY 33 -10.650 -18.930 3.292 239 H ASP 34 H ASP 34 -12.714 -18.350 2.919 240 HA ASP 34 HA ASP 34 -13.637 -18.052 0.116 241 HB2 ASP 34 1HB ASP 34 -14.859 -19.656 2.368 242 HB3 ASP 34 2HB ASP 34 -15.780 -19.156 0.951 243 H SER 35 H SER 35 -12.846 -16.160 2.254 244 HA SER 35 HA SER 35 -15.391 -14.635 2.454 245 HB2 SER 35 1HB SER 35 -13.168 -14.880 4.500 246 HB3 SER 35 2HB SER 35 -14.451 -13.675 4.578 247 HG SER 35 HG SER 35 -14.555 -16.454 4.904 248 H ARG 36 H ARG 36 -15.213 -12.942 1.086 249 HA ARG 36 HA ARG 36 -12.608 -11.936 0.321 250 HB2 ARG 36 1HB ARG 36 -15.373 -10.927 -0.395 251 HB3 ARG 36 2HB ARG 36 -13.865 -10.479 -1.186 252 HG2 ARG 36 1HG ARG 36 -14.803 -13.349 -1.029 253 HG3 ARG 36 2HG ARG 36 -15.278 -12.282 -2.346 254 HD2 ARG 36 1HD ARG 36 -12.836 -11.863 -2.793 255 HD3 ARG 36 2HD ARG 36 -12.452 -13.094 -1.596 256 HE ARG 36 HE ARG 36 -13.573 -13.545 -4.247 257 HH11 ARG 36 1HH2 ARG 36 -12.898 -14.768 -1.077 258 HH12 ARG 36 2HH2 ARG 36 -12.942 -16.431 -1.563 259 HH21 ARG 36 1HH1 ARG 36 -13.635 -15.719 -4.884 260 HH22 ARG 36 2HH1 ARG 36 -13.360 -16.968 -3.717 261 H GLN 37 H GLN 37 -11.718 -10.008 0.788 262 HA GLN 37 HA GLN 37 -13.089 -8.276 2.764 263 HB2 GLN 37 1HB GLN 37 -10.221 -9.246 2.802 264 HB3 GLN 37 2HB GLN 37 -10.857 -7.971 3.842 265 HG2 GLN 37 1HG GLN 37 -12.403 -9.468 4.887 266 HG3 GLN 37 2HG GLN 37 -12.090 -10.725 3.692 267 HE21 GLN 37 2HE2 GLN 37 -10.155 -12.006 3.926 268 HE22 GLN 37 1HE2 GLN 37 -9.171 -11.903 5.302 269 H SER 38 H SER 38 -12.474 -6.111 2.715 270 HA SER 38 HA SER 38 -11.204 -5.230 0.170 271 HB2 SER 38 1HB SER 38 -13.253 -3.689 1.775 272 HB3 SER 38 2HB SER 38 -12.606 -3.280 0.188 273 HG SER 38 HG SER 38 -13.976 -4.615 -0.669 274 H ARG 39 H ARG 39 -9.399 -4.175 0.324 275 HA ARG 39 HA ARG 39 -8.732 -2.688 2.792 276 HB2 ARG 39 1HB ARG 39 -7.055 -4.693 1.311 277 HB3 ARG 39 2HB ARG 39 -6.332 -3.476 2.358 278 HG2 ARG 39 1HG ARG 39 -7.696 -4.286 4.245 279 HG3 ARG 39 2HG ARG 39 -8.430 -5.501 3.199 280 HD2 ARG 39 1HD ARG 39 -6.255 -6.543 2.828 281 HD3 ARG 39 2HD ARG 39 -5.461 -5.294 3.783 282 HE ARG 39 HE ARG 39 -7.529 -6.694 5.230 283 HH11 ARG 39 1HH2 ARG 39 -4.203 -6.704 4.230 284 HH12 ARG 39 2HH2 ARG 39 -3.682 -7.731 5.523 285 HH21 ARG 39 1HH1 ARG 39 -6.841 -8.039 6.916 286 HH22 ARG 39 2HH1 ARG 39 -5.173 -8.488 7.040 287 H LEU 40 H LEU 40 -7.260 -1.006 2.547 288 HA LEU 40 HA LEU 40 -7.040 0.065 -0.219 289 HB2 LEU 40 1HB LEU 40 -8.681 1.333 1.110 290 HB3 LEU 40 2HB LEU 40 -7.484 1.586 2.373 291 HG LEU 40 HG LEU 40 -6.061 2.714 0.481 292 HD11 LEU 40 1HD1 LEU 40 -7.700 1.905 -1.316 293 HD12 LEU 40 2HD1 LEU 40 -7.232 3.591 -1.382 294 HD13 LEU 40 3HD1 LEU 40 -8.799 3.135 -0.712 295 HD21 LEU 40 3HD2 LEU 40 -7.096 3.912 2.376 296 HD22 LEU 40 1HD2 LEU 40 -8.607 4.014 1.476 297 HD23 LEU 40 2HD2 LEU 40 -7.173 4.861 0.896 298 H LEU 41 H LEU 41 -5.013 0.370 -0.930 299 HA LEU 41 HA LEU 41 -2.801 0.168 0.976 300 HB2 LEU 41 1HB LEU 41 -3.000 0.148 -2.037 301 HB3 LEU 41 2HB LEU 41 -1.454 0.228 -1.199 302 HG LEU 41 HG LEU 41 -2.129 -1.858 0.067 303 HD11 LEU 41 1HD1 LEU 41 -4.431 -1.665 -1.882 304 HD12 LEU 41 2HD1 LEU 41 -4.483 -1.941 -0.142 305 HD13 LEU 41 3HD1 LEU 41 -3.918 -3.214 -1.218 306 HD21 LEU 41 3HD2 LEU 41 -1.814 -3.342 -2.002 307 HD22 LEU 41 1HD2 LEU 41 -0.577 -2.116 -1.729 308 HD23 LEU 41 2HD2 LEU 41 -1.828 -1.852 -2.945 309 H GLY 42 H GLY 42 -1.018 1.673 0.895 310 HA2 GLY 42 1HA GLY 42 -1.417 4.259 -0.345 311 HA3 GLY 42 2HA GLY 42 -1.523 4.277 1.408 312 H LEU 43 H LEU 43 0.437 5.384 -0.593 313 HA LEU 43 HA LEU 43 2.908 4.292 0.646 314 HB2 LEU 43 1HB LEU 43 2.905 3.654 -1.690 315 HB3 LEU 43 2HB LEU 43 2.513 5.295 -2.178 316 HG LEU 43 HG LEU 43 4.664 6.098 -1.368 317 HD11 LEU 43 1HD1 LEU 43 4.883 3.279 -0.310 318 HD12 LEU 43 2HD1 LEU 43 5.166 4.803 0.534 319 HD13 LEU 43 3HD1 LEU 43 6.332 4.226 -0.652 320 HD21 LEU 43 3HD2 LEU 43 4.416 4.986 -3.645 321 HD22 LEU 43 1HD2 LEU 43 5.141 3.548 -2.926 322 HD23 LEU 43 2HD2 LEU 43 6.061 5.050 -3.012 323 H VAL 44 H VAL 44 4.040 5.750 1.769 324 HA VAL 44 HA VAL 44 3.557 8.641 1.220 325 HB VAL 44 HB VAL 44 3.811 7.373 3.939 326 HG11 VAL 44 1HG1 VAL 44 3.224 9.562 4.798 327 HG12 VAL 44 2HG1 VAL 44 3.009 10.183 3.167 328 HG13 VAL 44 3HG1 VAL 44 4.617 9.743 3.734 329 HG21 VAL 44 3HG2 VAL 44 1.699 6.760 2.846 330 HG22 VAL 44 1HG2 VAL 44 1.383 8.462 2.507 331 HG23 VAL 44 2HG2 VAL 44 1.417 7.887 4.173 332 H ARG 45 H ARG 45 5.262 9.899 1.157 333 HA ARG 45 HA ARG 45 7.912 8.784 1.885 334 HB2 ARG 45 1HB ARG 45 7.601 9.299 -0.536 335 HB3 ARG 45 2HB ARG 45 7.263 10.976 -0.105 336 HG2 ARG 45 1HG ARG 45 9.492 11.148 0.958 337 HG3 ARG 45 2HG ARG 45 9.831 9.478 0.502 338 HD2 ARG 45 1HD ARG 45 10.832 10.949 -1.149 339 HD3 ARG 45 2HD ARG 45 9.472 10.110 -1.889 340 HE ARG 45 HE ARG 45 8.595 12.579 -0.798 341 HH11 ARG 45 1HH2 ARG 45 10.470 11.214 -3.365 342 HH12 ARG 45 2HH2 ARG 45 10.185 12.529 -4.455 343 HH21 ARG 45 1HH1 ARG 45 8.216 14.305 -2.222 344 HH22 ARG 45 2HH1 ARG 45 8.910 14.279 -3.809 345 H TYR 46 H TYR 46 8.884 9.723 3.519 346 HA TYR 46 HA TYR 46 7.954 12.372 4.478 347 HB2 TYR 46 1HB TYR 46 7.465 10.614 6.050 348 HB3 TYR 46 2HB TYR 46 9.110 9.991 5.942 349 HD1 TYR 46 HD1 TYR 46 7.266 13.165 6.701 350 HD2 TYR 46 HD2 TYR 46 10.661 10.678 7.547 351 HE1 TYR 46 HE1 TYR 46 7.942 14.708 8.516 352 HE2 TYR 46 HE2 TYR 46 11.337 12.214 9.361 353 HH TYR 46 HH TYR 46 9.274 14.769 10.479 354 H ARG 47 H ARG 47 9.391 14.002 4.457 355 HA ARG 47 HA ARG 47 12.121 13.460 3.563 356 HB2 ARG 47 1HB ARG 47 10.556 16.011 3.942 357 HB3 ARG 47 2HB ARG 47 12.262 15.982 3.495 358 HG2 ARG 47 1HG ARG 47 11.682 14.561 1.533 359 HG3 ARG 47 2HG ARG 47 9.975 14.736 1.946 360 HD2 ARG 47 1HD ARG 47 11.836 17.072 1.472 361 HD3 ARG 47 2HD ARG 47 10.809 16.383 0.214 362 HE ARG 47 HE ARG 47 9.957 18.037 2.447 363 HH11 ARG 47 1HH2 ARG 47 9.085 15.754 -0.009 364 HH12 ARG 47 2HH2 ARG 47 7.408 16.188 -0.007 365 HH21 ARG 47 1HH1 ARG 47 7.763 18.613 2.446 366 HH22 ARG 47 2HH1 ARG 47 6.660 17.804 1.383 367 H LEU 48 H LEU 48 13.935 13.705 4.711 368 HA LEU 48 HA LEU 48 13.662 14.292 7.586 369 HB2 LEU 48 1HB LEU 48 15.670 12.780 5.938 370 HB3 LEU 48 2HB LEU 48 16.139 13.405 7.513 371 HG LEU 48 HG LEU 48 15.264 11.011 7.466 372 HD11 LEU 48 1HD1 LEU 48 13.548 12.733 9.236 373 HD12 LEU 48 2HD1 LEU 48 15.281 12.615 9.495 374 HD13 LEU 48 3HD1 LEU 48 14.277 11.171 9.584 375 HD21 LEU 48 3HD2 LEU 48 12.543 12.291 7.237 376 HD22 LEU 48 1HD2 LEU 48 12.966 10.581 7.149 377 HD23 LEU 48 2HD2 LEU 48 13.400 11.665 5.831 378 H GLU 49 H GLU 49 14.454 16.020 8.474 379 HA GLU 49 HA GLU 49 15.211 18.301 7.103 380 HB2 GLU 49 1HB GLU 49 15.867 17.450 9.933 381 HB3 GLU 49 2HB GLU 49 16.146 19.073 9.303 382 HG2 GLU 49 1HG GLU 49 13.762 19.310 8.788 383 HG3 GLU 49 2HG GLU 49 13.461 17.665 9.348 384 H ASN 50 H ASN 50 16.982 15.455 7.548 385 HA ASN 50 HA ASN 50 19.619 16.689 7.451 386 HB2 ASN 50 1HB ASN 50 18.702 13.805 7.333 387 HB3 ASN 50 2HB ASN 50 20.393 14.309 7.315 388 HD21 ASN 50 2HD2 ASN 50 18.472 12.920 9.422 389 HD22 ASN 50 1HD2 ASN 50 18.845 13.754 10.851 390 H ASP 51 H ASP 51 17.223 16.167 5.242 391 HA ASP 51 HA ASP 51 17.297 16.608 2.955 392 HB2 ASP 51 1HB ASP 51 19.830 17.277 3.434 393 HB3 ASP 51 2HB ASP 51 20.158 15.700 2.719 394 H ALA 52 H ALA 52 18.208 13.916 4.740 395 HA ALA 52 HA ALA 52 18.397 11.938 2.716 396 HB1 ALA 52 3HB ALA 52 17.840 10.398 4.698 397 HB2 ALA 52 1HB ALA 52 17.845 11.866 5.679 398 HB3 ALA 52 2HB ALA 52 19.305 11.372 4.824 399 H GLN 53 H GLN 53 16.875 10.288 2.252 400 HA GLN 53 HA GLN 53 14.026 11.057 2.592 401 HB2 GLN 53 1HB GLN 53 15.343 9.861 0.136 402 HB3 GLN 53 2HB GLN 53 13.624 10.216 0.316 403 HG2 GLN 53 1HG GLN 53 15.846 12.270 0.499 404 HG3 GLN 53 2HG GLN 53 14.825 12.013 -0.914 405 HE21 GLN 53 2HE2 GLN 53 15.131 14.091 1.601 406 HE22 GLN 53 1HE2 GLN 53 13.505 14.503 1.850 407 H GLU 54 H GLU 54 12.524 9.339 2.662 408 HA GLU 54 HA GLU 54 13.494 6.597 2.717 409 HB2 GLU 54 1HB GLU 54 13.843 7.589 5.057 410 HB3 GLU 54 2HB GLU 54 12.086 7.658 5.171 411 HG2 GLU 54 1HG GLU 54 12.818 5.573 6.164 412 HG3 GLU 54 2HG GLU 54 12.022 5.196 4.639 413 H HIS 55 H HIS 55 11.794 5.053 2.664 414 HA HIS 55 HA HIS 55 9.094 6.143 2.073 415 HB2 HIS 55 1HB HIS 55 10.650 4.064 0.517 416 HB3 HIS 55 2HB HIS 55 8.934 4.392 0.289 417 HD2 HIS 55 HD2 HIS 55 8.378 6.631 -1.282 418 HE1 HIS 55 HE1 HIS 55 12.352 7.997 -1.686 419 HE2 HIS 55 HE2 HIS 55 9.959 8.338 -2.464 420 H ALA 56 H ALA 56 7.352 4.689 2.439 421 HA ALA 56 HA ALA 56 7.851 2.117 3.678 422 HB1 ALA 56 3HB ALA 56 6.763 4.497 5.175 423 HB2 ALA 56 1HB ALA 56 8.000 3.346 5.682 424 HB3 ALA 56 2HB ALA 56 6.308 2.854 5.629 425 H LEU 57 H LEU 57 6.037 0.777 3.539 426 HA LEU 57 HA LEU 57 3.925 1.744 1.741 427 HB2 LEU 57 1HB LEU 57 4.970 -0.294 1.019 428 HB3 LEU 57 2HB LEU 57 4.768 -1.035 2.600 429 HG LEU 57 HG LEU 57 2.313 -1.014 2.316 430 HD11 LEU 57 1HD1 LEU 57 1.519 -0.429 -0.081 431 HD12 LEU 57 2HD1 LEU 57 3.051 0.430 -0.238 432 HD13 LEU 57 3HD1 LEU 57 1.891 0.911 0.998 433 HD21 LEU 57 3HD2 LEU 57 3.715 -2.130 -0.128 434 HD22 LEU 57 1HD2 LEU 57 2.174 -2.671 0.536 435 HD23 LEU 57 2HD2 LEU 57 3.663 -2.922 1.447 436 H PHE 58 H PHE 58 2.544 2.874 2.991 437 HA PHE 58 HA PHE 58 1.640 1.951 5.548 438 HB2 PHE 58 1HB PHE 58 1.036 4.278 3.752 439 HB3 PHE 58 2HB PHE 58 -0.067 3.910 5.072 440 HD1 PHE 58 HD1 PHE 58 3.590 3.223 5.301 441 HD2 PHE 58 HD2 PHE 58 0.393 5.914 6.318 442 HE1 PHE 58 HE1 PHE 58 5.061 4.356 6.924 443 HE2 PHE 58 HE2 PHE 58 1.878 7.048 7.944 444 HZ PHE 58 HZ PHE 58 4.209 6.270 8.248 445 H LEU 59 H LEU 59 -0.290 1.132 6.123 446 HA LEU 59 HA LEU 59 -2.054 0.146 3.949 447 HB2 LEU 59 1HB LEU 59 -1.105 -1.144 6.485 448 HB3 LEU 59 2HB LEU 59 -2.703 -1.556 5.877 449 HG LEU 59 HG LEU 59 -0.840 -3.073 5.095 450 HD11 LEU 59 1HD1 LEU 59 -3.073 -2.447 3.784 451 HD12 LEU 59 2HD1 LEU 59 -1.842 -3.471 3.057 452 HD13 LEU 59 3HD1 LEU 59 -1.928 -1.766 2.628 453 HD21 LEU 59 3HD2 LEU 59 0.721 -0.996 4.802 454 HD22 LEU 59 1HD2 LEU 59 -0.032 -0.876 3.213 455 HD23 LEU 59 2HD2 LEU 59 0.849 -2.333 3.661 456 H TYR 60 H TYR 60 -4.023 0.836 3.974 457 HA TYR 60 HA TYR 60 -5.101 2.225 6.373 458 HB2 TYR 60 1HB TYR 60 -5.405 2.767 3.415 459 HB3 TYR 60 2HB TYR 60 -6.432 3.506 4.632 460 HD1 TYR 60 HD1 TYR 60 -3.018 3.353 3.230 461 HD2 TYR 60 HD2 TYR 60 -5.570 5.214 6.141 462 HE1 TYR 60 HE1 TYR 60 -1.330 5.140 3.575 463 HE2 TYR 60 HE2 TYR 60 -3.875 6.987 6.498 464 HH TYR 60 HH TYR 60 -1.479 7.331 6.196 465 H THR 61 H THR 61 -6.983 1.332 7.166 466 HA THR 61 HA THR 61 -8.242 -0.816 5.621 467 HB THR 61 HB THR 61 -8.003 -1.163 8.041 468 HG1 THR 61 HG1 THR 61 -9.751 -2.165 7.220 469 HG21 THR 61 3HG2 THR 61 -8.164 1.266 8.659 470 HG22 THR 61 1HG2 THR 61 -9.194 0.219 9.637 471 HG23 THR 61 2HG2 THR 61 -9.896 1.181 8.336 472 H HIS 62 H HIS 62 -10.628 -0.762 5.342 473 HA HIS 62 HA HIS 62 -11.987 1.736 5.488 474 HB2 HIS 62 1HB HIS 62 -12.026 2.435 3.249 475 HB3 HIS 62 2HB HIS 62 -10.350 1.978 3.504 476 HD2 HIS 62 HD2 HIS 62 -9.610 -0.533 2.291 477 HE1 HIS 62 HE1 HIS 62 -13.049 -0.776 -0.136 478 HE2 HIS 62 HE2 HIS 62 -10.748 -1.764 0.289 479 H ARG 63 H ARG 63 -14.181 1.590 4.743 480 HA ARG 63 HA ARG 63 -15.292 -0.992 5.228 481 HB2 ARG 63 1HB ARG 63 -16.580 1.562 4.236 482 HB3 ARG 63 2HB ARG 63 -17.466 0.104 4.677 483 HG2 ARG 63 1HG ARG 63 -16.544 0.207 6.948 484 HG3 ARG 63 2HG ARG 63 -15.617 1.642 6.520 485 HD2 ARG 63 1HD ARG 63 -17.649 2.318 7.686 486 HD3 ARG 63 2HD ARG 63 -17.743 2.823 6.002 487 HE ARG 63 HE ARG 63 -19.452 1.253 5.656 488 HH11 ARG 63 1HH2 ARG 63 -17.983 0.912 8.777 489 HH12 ARG 63 2HH2 ARG 63 -19.209 -0.149 9.386 490 HH21 ARG 63 1HH1 ARG 63 -21.063 -0.130 6.457 491 HH22 ARG 63 2HH1 ARG 63 -20.951 -0.737 8.076 492 H ARG 64 H ARG 64 -17.224 -1.549 3.599 493 HA ARG 64 HA ARG 64 -15.960 -2.617 1.308 494 HB2 ARG 64 1HB ARG 64 -18.888 -2.290 2.013 495 HB3 ARG 64 2HB ARG 64 -18.294 -3.224 0.638 496 HG2 ARG 64 1HG ARG 64 -17.005 -4.666 2.143 497 HG3 ARG 64 2HG ARG 64 -17.532 -3.711 3.529 498 HD2 ARG 64 1HD ARG 64 -19.878 -4.300 3.054 499 HD3 ARG 64 2HD ARG 64 -19.362 -5.251 1.664 500 HE ARG 64 HE ARG 64 -17.979 -6.218 3.901 501 HH11 ARG 64 1HH2 ARG 64 -21.220 -5.912 2.717 502 HH12 ARG 64 2HH2 ARG 64 -21.799 -7.325 3.532 503 HH21 ARG 64 1HH1 ARG 64 -18.734 -8.074 4.972 504 HH22 ARG 64 2HH1 ARG 64 -20.392 -8.549 4.808 505 H MET 65 H MET 65 -17.620 0.425 1.920 506 HA MET 65 HA MET 65 -17.079 1.230 -0.864 507 HB2 MET 65 1HB MET 65 -19.386 2.468 -0.644 508 HB3 MET 65 2HB MET 65 -19.362 0.764 -1.092 509 HG2 MET 65 1HG MET 65 -19.805 0.098 1.211 510 HG3 MET 65 2HG MET 65 -19.703 1.775 1.747 511 HE1 MET 65 3HE MET 65 -22.272 1.665 2.867 512 HE2 MET 65 1HE MET 65 -21.854 -0.019 2.514 513 HE3 MET 65 2HE MET 65 -23.439 0.613 2.071 514 H ALA 66 H ALA 66 -15.818 1.734 1.777 515 HA ALA 66 HA ALA 66 -16.552 4.314 2.722 516 HB1 ALA 66 3HB ALA 66 -14.317 2.437 3.136 517 HB2 ALA 66 1HB ALA 66 -15.184 3.413 4.316 518 HB3 ALA 66 2HB ALA 66 -13.881 4.128 3.371 519 H ILE 67 H ILE 67 -13.894 3.310 0.603 520 HA ILE 67 HA ILE 67 -12.382 4.573 -0.630 521 HB ILE 67 HB ILE 67 -15.103 5.061 -1.871 522 HG12 ILE 67 1HG1 ILE 67 -12.964 3.039 -2.598 523 HG13 ILE 67 2HG1 ILE 67 -14.309 2.669 -1.519 524 HG21 ILE 67 1HG2 ILE 67 -13.704 5.314 -3.988 525 HG22 ILE 67 2HG2 ILE 67 -12.299 5.475 -2.935 526 HG23 ILE 67 3HG2 ILE 67 -13.605 6.658 -2.852 527 HD11 ILE 67 3HD1 ILE 67 -15.897 3.343 -3.319 528 HD12 ILE 67 1HD1 ILE 67 -14.881 1.983 -3.798 529 HD13 ILE 67 2HD1 ILE 67 -14.526 3.603 -4.398 530 H THR 68 H THR 68 -15.253 6.523 -0.342 531 HA THR 68 HA THR 68 -14.642 8.958 -0.964 532 HB THR 68 HB THR 68 -16.092 9.826 0.801 533 HG1 THR 68 HG1 THR 68 -15.110 8.420 2.434 534 HG21 THR 68 3HG2 THR 68 -16.932 8.375 -1.165 535 HG22 THR 68 1HG2 THR 68 -18.025 8.600 0.199 536 HG23 THR 68 2HG2 THR 68 -17.124 7.095 0.033 537 H GLY 69 H GLY 69 -13.262 7.528 2.014 538 HA2 GLY 69 1HA GLY 69 -11.063 8.265 2.743 539 HA3 GLY 69 2HA GLY 69 -11.455 9.884 2.174 540 H ASP 70 H ASP 70 -14.274 9.103 3.225 541 HA ASP 70 HA ASP 70 -14.186 10.624 5.591 542 HB2 ASP 70 1HB ASP 70 -16.290 8.828 4.397 543 HB3 ASP 70 2HB ASP 70 -16.554 9.741 5.881 544 H ASP 71 H ASP 71 -14.576 7.032 5.174 545 HA ASP 71 HA ASP 71 -13.959 6.830 8.100 546 HB2 ASP 71 1HB ASP 71 -15.625 5.053 6.325 547 HB3 ASP 71 2HB ASP 71 -15.306 4.752 8.028 548 H VAL 72 H VAL 72 -11.745 6.955 6.669 549 HA VAL 72 HA VAL 72 -10.660 4.261 6.978 550 HB VAL 72 HB VAL 72 -11.073 4.075 4.680 551 HG11 VAL 72 1HG1 VAL 72 -10.420 6.055 3.138 552 HG12 VAL 72 2HG1 VAL 72 -10.410 7.017 4.616 553 HG13 VAL 72 3HG1 VAL 72 -11.889 6.204 4.101 554 HG21 VAL 72 3HG2 VAL 72 -8.393 5.400 4.336 555 HG22 VAL 72 1HG2 VAL 72 -8.941 3.822 3.786 556 HG23 VAL 72 2HG2 VAL 72 -8.486 4.059 5.468 557 H SER 73 H SER 73 -8.766 4.332 8.040 558 HA SER 73 HA SER 73 -6.933 6.556 7.645 559 HB2 SER 73 1HB SER 73 -8.040 5.826 10.371 560 HB3 SER 73 2HB SER 73 -6.759 6.992 10.053 561 HG SER 73 HG SER 73 -8.529 7.878 8.542 562 H LEU 74 H LEU 74 -4.862 6.036 8.944 563 HA LEU 74 HA LEU 74 -3.680 3.803 8.061 564 HB2 LEU 74 1HB LEU 74 -3.192 5.494 10.465 565 HB3 LEU 74 2HB LEU 74 -2.308 3.972 10.393 566 HG LEU 74 HG LEU 74 -2.377 5.971 8.123 567 HD11 LEU 74 1HD1 LEU 74 -0.254 6.798 8.865 568 HD12 LEU 74 2HD1 LEU 74 -0.128 5.550 10.104 569 HD13 LEU 74 3HD1 LEU 74 -1.320 6.840 10.266 570 HD21 LEU 74 3HD2 LEU 74 -1.452 3.238 8.338 571 HD22 LEU 74 1HD2 LEU 74 -0.044 4.282 8.146 572 HD23 LEU 74 2HD2 LEU 74 -1.343 4.326 6.963 573 H ASP 75 H ASP 75 -3.685 1.733 8.286 574 HA ASP 75 HA ASP 75 -5.190 0.472 10.498 575 HB2 ASP 75 1HB ASP 75 -6.016 -0.036 8.249 576 HB3 ASP 75 2HB ASP 75 -4.418 -0.599 7.771 577 H GLN 76 H GLN 76 -2.424 -0.450 8.346 578 HA GLN 76 HA GLN 76 -0.953 -1.314 10.757 579 HB2 GLN 76 1HB GLN 76 -1.964 -3.124 9.015 580 HB3 GLN 76 2HB GLN 76 -0.433 -2.790 8.208 581 HG2 GLN 76 1HG GLN 76 0.706 -3.178 10.458 582 HG3 GLN 76 2HG GLN 76 -0.846 -3.749 11.054 583 HE21 GLN 76 2HE2 GLN 76 2.005 -4.929 9.956 584 HE22 GLN 76 1HE2 GLN 76 1.472 -6.366 9.224 585 H ILE 77 H ILE 77 1.370 -2.106 9.290 586 HA ILE 77 HA ILE 77 2.333 0.163 7.782 587 HB ILE 77 HB ILE 77 3.388 -0.395 10.581 588 HG12 ILE 77 1HG1 ILE 77 2.098 2.023 9.269 589 HG13 ILE 77 2HG1 ILE 77 1.461 1.076 10.610 590 HG21 ILE 77 1HG2 ILE 77 5.250 -0.020 8.965 591 HG22 ILE 77 2HG2 ILE 77 5.109 1.305 10.096 592 HG23 ILE 77 3HG2 ILE 77 4.487 1.483 8.458 593 HD11 ILE 77 3HD1 ILE 77 3.808 2.957 10.637 594 HD12 ILE 77 1HD1 ILE 77 3.574 1.740 11.893 595 HD13 ILE 77 2HD1 ILE 77 2.357 2.990 11.638 596 H VAL 78 H VAL 78 3.567 -0.665 6.268 597 HA VAL 78 HA VAL 78 5.118 -3.138 6.816 598 HB VAL 78 HB VAL 78 3.745 -2.259 4.267 599 HG11 VAL 78 1HG1 VAL 78 5.762 -4.438 4.841 600 HG12 VAL 78 2HG1 VAL 78 5.840 -3.195 3.594 601 HG13 VAL 78 3HG1 VAL 78 4.675 -4.512 3.455 602 HG21 VAL 78 3HG2 VAL 78 2.428 -4.249 4.555 603 HG22 VAL 78 1HG2 VAL 78 2.408 -3.402 6.102 604 HG23 VAL 78 2HG2 VAL 78 3.454 -4.805 5.879 605 HA PRO 79 HA PRO 79 8.071 0.171 5.650 606 HB2 PRO 79 1HB PRO 79 10.076 -0.465 7.349 607 HB3 PRO 79 2HB PRO 79 8.615 0.380 7.894 608 HG2 PRO 79 1HG PRO 79 9.365 -2.482 8.213 609 HG3 PRO 79 2HG PRO 79 8.504 -1.410 9.332 610 HD2 PRO 79 1HD PRO 79 7.287 -3.289 7.628 611 HD3 PRO 79 2HD PRO 79 6.452 -1.932 8.414 612 H LEU 80 H LEU 80 9.366 0.033 3.922 613 HA LEU 80 HA LEU 80 10.063 -2.380 2.715 614 HB2 LEU 80 1HB LEU 80 11.208 0.399 2.381 615 HB3 LEU 80 2HB LEU 80 11.508 -0.941 1.277 616 HG LEU 80 HG LEU 80 8.728 0.033 1.985 617 HD11 LEU 80 1HD1 LEU 80 10.344 0.713 -0.486 618 HD12 LEU 80 2HD1 LEU 80 10.105 1.810 0.874 619 HD13 LEU 80 3HD1 LEU 80 8.725 1.285 -0.090 620 HD21 LEU 80 3HD2 LEU 80 9.872 -1.938 0.003 621 HD22 LEU 80 1HD2 LEU 80 8.363 -1.108 -0.367 622 HD23 LEU 80 2HD2 LEU 80 8.479 -2.115 1.069 623 H SER 81 H SER 81 11.553 -3.741 3.060 624 HA SER 81 HA SER 81 14.126 -2.979 4.315 625 HB2 SER 81 1HB SER 81 14.009 -5.097 5.662 626 HB3 SER 81 2HB SER 81 12.841 -3.873 6.146 627 HG SER 81 HG SER 81 11.266 -4.979 5.000 628 H LYS 82 H LYS 82 15.787 -4.734 4.045 629 HA LYS 82 HA LYS 82 16.118 -5.396 1.376 630 HB2 LYS 82 1HB LYS 82 17.976 -6.733 2.087 631 HB3 LYS 82 2HB LYS 82 17.881 -5.356 3.179 632 HG2 LYS 82 1HG LYS 82 16.543 -6.822 4.754 633 HG3 LYS 82 2HG LYS 82 16.953 -8.186 3.710 634 HD2 LYS 82 1HD LYS 82 19.332 -7.781 4.044 635 HD3 LYS 82 2HD LYS 82 18.969 -6.366 5.032 636 HE2 LYS 82 1HE LYS 82 19.431 -8.301 6.472 637 HE3 LYS 82 2HE LYS 82 17.746 -7.804 6.631 638 HZ1 LYS 82 3HZ LYS 82 17.223 -9.884 6.127 639 HZ2 LYS 82 1HZ LYS 82 18.816 -10.270 5.688 640 HZ3 LYS 82 2HZ LYS 82 17.765 -9.580 4.545 641 H ASP 83 H ASP 83 14.838 -7.427 4.023 642 HA ASP 83 HA ASP 83 14.553 -9.778 2.495 643 HB2 ASP 83 1HB ASP 83 13.133 -8.770 4.961 644 HB3 ASP 83 2HB ASP 83 12.857 -10.374 4.286 645 H PHE 84 H PHE 84 12.983 -6.837 2.202 646 HA PHE 84 HA PHE 84 10.347 -7.659 1.500 647 HB2 PHE 84 1HB PHE 84 11.129 -5.293 2.064 648 HB3 PHE 84 2HB PHE 84 11.778 -5.226 0.426 649 HD1 PHE 84 HD1 PHE 84 10.198 -5.602 -1.535 650 HD2 PHE 84 HD2 PHE 84 8.821 -4.961 2.481 651 HE1 PHE 84 HE1 PHE 84 7.968 -4.953 -2.403 652 HE2 PHE 84 HE2 PHE 84 6.590 -4.323 1.617 653 HZ PHE 84 HZ PHE 84 6.165 -4.312 -0.825 654 H MET 85 H MET 85 9.518 -8.294 -0.417 655 HA MET 85 HA MET 85 10.852 -8.019 -2.918 656 HB2 MET 85 1HB MET 85 12.227 -9.858 -1.940 657 HB3 MET 85 2HB MET 85 10.761 -10.830 -1.792 658 HG2 MET 85 1HG MET 85 10.407 -10.694 -4.228 659 HG3 MET 85 2HG MET 85 11.846 -9.688 -4.386 660 HE1 MET 85 3HE MET 85 11.602 -13.198 -2.025 661 HE2 MET 85 1HE MET 85 11.338 -14.076 -3.538 662 HE3 MET 85 2HE MET 85 10.291 -12.728 -3.103 663 H LEU 86 H LEU 86 9.436 -8.311 -4.577 664 HA LEU 86 HA LEU 86 6.686 -9.128 -3.849 665 HB2 LEU 86 1HB LEU 86 6.015 -7.913 -5.867 666 HB3 LEU 86 2HB LEU 86 6.959 -6.879 -4.800 667 HG LEU 86 HG LEU 86 8.964 -7.951 -6.358 668 HD11 LEU 86 1HD1 LEU 86 8.337 -8.265 -8.578 669 HD12 LEU 86 2HD1 LEU 86 6.847 -7.339 -8.410 670 HD13 LEU 86 3HD1 LEU 86 6.951 -8.964 -7.743 671 HD21 LEU 86 3HD2 LEU 86 8.755 -5.579 -5.894 672 HD22 LEU 86 1HD2 LEU 86 7.298 -5.467 -6.880 673 HD23 LEU 86 2HD2 LEU 86 8.854 -5.790 -7.642 674 H GLU 87 H GLU 87 5.918 -11.049 -4.586 675 HA GLU 87 HA GLU 87 7.436 -12.409 -6.737 676 HB2 GLU 87 1HB GLU 87 5.793 -13.522 -4.453 677 HB3 GLU 87 2HB GLU 87 6.471 -14.494 -5.755 678 HG2 GLU 87 1HG GLU 87 8.110 -12.718 -3.931 679 HG3 GLU 87 2HG GLU 87 7.904 -14.452 -3.700 680 H GLU 88 H GLU 88 6.450 -12.597 -8.590 681 HA GLU 88 HA GLU 88 3.726 -11.862 -9.017 682 HB2 GLU 88 1HB GLU 88 4.117 -12.688 -11.325 683 HB3 GLU 88 2HB GLU 88 5.389 -11.593 -10.788 684 HG2 GLU 88 1HG GLU 88 6.581 -13.380 -11.760 685 HG3 GLU 88 2HG GLU 88 6.643 -13.736 -10.037 686 H VAL 89 H VAL 89 1.917 -13.169 -9.362 687 HA VAL 89 HA VAL 89 2.156 -15.912 -8.326 688 HB VAL 89 HB VAL 89 -0.377 -14.470 -9.067 689 HG11 VAL 89 1HG1 VAL 89 0.307 -16.844 -7.323 690 HG12 VAL 89 2HG1 VAL 89 -0.723 -16.813 -8.755 691 HG13 VAL 89 3HG1 VAL 89 -1.259 -16.035 -7.267 692 HG21 VAL 89 3HG2 VAL 89 1.290 -14.349 -6.553 693 HG22 VAL 89 1HG2 VAL 89 -0.448 -14.052 -6.508 694 HG23 VAL 89 2HG2 VAL 89 0.602 -13.008 -7.469 695 H SER 90 H SER 90 1.832 -17.676 -9.511 696 HA SER 90 HA SER 90 2.270 -17.799 -12.200 697 HB2 SER 90 1HB SER 90 0.683 -19.664 -10.447 698 HB3 SER 90 2HB SER 90 1.094 -20.038 -12.117 699 HG SER 90 HG SER 90 3.252 -19.943 -11.585 700 HA PRO 91 HA PRO 91 -1.661 -16.127 -13.698 701 HB2 PRO 91 1HB PRO 91 -1.185 -16.247 -16.383 702 HB3 PRO 91 2HB PRO 91 -0.439 -15.026 -15.331 703 HG2 PRO 91 1HG PRO 91 0.727 -17.545 -16.422 704 HG3 PRO 91 2HG PRO 91 1.474 -15.953 -16.220 705 HD2 PRO 91 1HD PRO 91 1.867 -18.055 -14.471 706 HD3 PRO 91 2HD PRO 91 2.025 -16.346 -14.008 707 H ASP 92 H ASP 92 -0.491 -18.719 -15.870 708 HA ASP 92 HA ASP 92 -1.492 -20.626 -16.655 709 HB2 ASP 92 1HB ASP 92 -1.712 -21.115 -14.183 710 HB3 ASP 92 2HB ASP 92 -3.336 -20.435 -14.261 711 H GLY 93 H GLY 93 -2.333 -18.069 -17.580 712 HA2 GLY 93 1HA GLY 93 -5.121 -18.684 -18.401 713 HA3 GLY 93 2HA GLY 93 -4.651 -17.055 -17.922 714 H GLU 94 H GLU 94 -5.380 -18.689 -20.574 715 HA GLU 94 HA GLU 94 -3.152 -17.995 -22.279 716 HB2 GLU 94 1HB GLU 94 -4.347 -20.023 -22.756 717 HB3 GLU 94 2HB GLU 94 -5.890 -19.177 -22.778 718 HG2 GLU 94 1HG GLU 94 -5.097 -19.637 -25.048 719 HG3 GLU 94 2HG GLU 94 -5.173 -17.911 -24.752 720 H LEU 95 H LEU 95 -6.607 -17.291 -22.794 721 HA LEU 95 HA LEU 95 -6.097 -14.952 -24.294 722 HB2 LEU 95 1HB LEU 95 -8.202 -16.170 -24.521 723 HB3 LEU 95 2HB LEU 95 -8.610 -15.833 -22.842 724 HG LEU 95 HG LEU 95 -8.718 -13.426 -23.320 725 HD11 LEU 95 1HD1 LEU 95 -7.706 -14.319 -26.017 726 HD12 LEU 95 2HD1 LEU 95 -7.130 -12.999 -24.997 727 HD13 LEU 95 3HD1 LEU 95 -8.651 -12.836 -25.870 728 HD21 LEU 95 3HD2 LEU 95 -10.264 -15.147 -25.284 729 HD22 LEU 95 1HD2 LEU 95 -10.654 -13.467 -24.909 730 HD23 LEU 95 2HD2 LEU 95 -10.767 -14.700 -23.653 731 H TYR 96 H TYR 96 -6.993 -15.453 -20.932 732 HA TYR 96 HA TYR 96 -7.114 -12.655 -20.315 733 HB2 TYR 96 1HB TYR 96 -8.193 -14.717 -19.078 734 HB3 TYR 96 2HB TYR 96 -6.660 -14.754 -18.206 735 HD1 TYR 96 HD2 TYR 96 -9.366 -12.401 -19.261 736 HD2 TYR 96 HD1 TYR 96 -6.363 -13.330 -16.331 737 HE1 TYR 96 HE2 TYR 96 -10.166 -10.525 -17.858 738 HE2 TYR 96 HE1 TYR 96 -7.164 -11.445 -14.923 739 HH TYR 96 HH TYR 96 -8.607 -9.059 -15.693 740 H ILE 97 H ILE 97 -5.543 -11.286 -19.634 741 HA ILE 97 HA ILE 97 -2.965 -12.318 -18.713 742 HB ILE 97 HB ILE 97 -1.895 -10.585 -20.279 743 HG12 ILE 97 1HG1 ILE 97 -4.336 -11.072 -21.981 744 HG13 ILE 97 2HG1 ILE 97 -4.304 -9.715 -20.853 745 HG21 ILE 97 1HG2 ILE 97 -1.820 -12.216 -22.143 746 HG22 ILE 97 2HG2 ILE 97 -3.164 -13.088 -21.403 747 HG23 ILE 97 3HG2 ILE 97 -1.612 -12.991 -20.570 748 HD11 ILE 97 3HD1 ILE 97 -2.257 -10.249 -23.020 749 HD12 ILE 97 1HD1 ILE 97 -2.220 -8.903 -21.882 750 HD13 ILE 97 2HD1 ILE 97 -3.517 -9.015 -23.072 751 H LEU 98 H LEU 98 -4.876 -11.150 -17.138 752 HA LEU 98 HA LEU 98 -5.232 -9.426 -15.637 753 HB2 LEU 98 1HB LEU 98 -2.395 -8.665 -16.385 754 HB3 LEU 98 2HB LEU 98 -3.258 -8.165 -14.949 755 HG LEU 98 HG LEU 98 -1.861 -9.922 -14.220 756 HD11 LEU 98 1HD1 LEU 98 -3.357 -11.556 -13.385 757 HD12 LEU 98 2HD1 LEU 98 -4.430 -11.413 -14.774 758 HD13 LEU 98 3HD1 LEU 98 -4.336 -10.107 -13.590 759 HD21 LEU 98 3HD2 LEU 98 -2.850 -11.872 -16.295 760 HD22 LEU 98 1HD2 LEU 98 -1.352 -11.889 -15.369 761 HD23 LEU 98 2HD2 LEU 98 -1.548 -10.757 -16.700 762 H GLY 99 H GLY 99 -6.663 -8.744 -17.529 763 HA2 GLY 99 1HA GLY 99 -5.783 -6.322 -18.920 764 HA3 GLY 99 2HA GLY 99 -7.278 -7.205 -19.201 765 H SER 100 H SER 100 -8.185 -7.336 -16.489 766 HA SER 100 HA SER 100 -8.568 -4.489 -15.767 767 HB2 SER 100 1HB SER 100 -10.792 -6.536 -15.761 768 HB3 SER 100 2HB SER 100 -10.922 -4.792 -15.534 769 HG SER 100 HG SER 100 -11.412 -5.663 -17.703 770 H ASP 101 H ASP 101 -6.879 -6.645 -14.760 771 HA ASP 101 HA ASP 101 -7.249 -6.274 -11.973 772 HB2 ASP 101 1HB ASP 101 -7.623 -8.624 -11.328 773 HB3 ASP 101 2HB ASP 101 -9.007 -7.964 -12.205 774 H VAL 102 H VAL 102 -5.443 -6.997 -10.794 775 HA VAL 102 HA VAL 102 -3.300 -8.317 -12.357 776 HB VAL 102 HB VAL 102 -2.729 -5.965 -12.384 777 HG11 VAL 102 1HG1 VAL 102 -3.642 -6.097 -9.548 778 HG12 VAL 102 2HG1 VAL 102 -3.787 -4.783 -10.714 779 HG13 VAL 102 3HG1 VAL 102 -2.267 -5.046 -9.870 780 HG21 VAL 102 3HG2 VAL 102 -0.962 -7.724 -11.869 781 HG22 VAL 102 1HG2 VAL 102 -1.099 -7.253 -10.174 782 HG23 VAL 102 2HG2 VAL 102 -0.550 -6.082 -11.375 783 H THR 103 H THR 103 -1.809 -9.425 -11.127 784 HA THR 103 HA THR 103 -2.711 -10.107 -8.364 785 HB THR 103 HB THR 103 -1.181 -12.127 -9.984 786 HG1 THR 103 HG1 THR 103 -2.693 -11.846 -11.458 787 HG21 THR 103 3HG2 THR 103 -1.819 -12.481 -7.586 788 HG22 THR 103 1HG2 THR 103 -2.537 -13.677 -8.669 789 HG23 THR 103 2HG2 THR 103 -3.515 -12.343 -8.052 790 H VAL 104 H VAL 104 -1.368 -9.428 -6.905 791 HA VAL 104 HA VAL 104 1.548 -9.640 -7.341 792 HB VAL 104 HB VAL 104 0.611 -7.263 -7.593 793 HG11 VAL 104 1HG1 VAL 104 0.390 -7.418 -4.582 794 HG12 VAL 104 2HG1 VAL 104 -1.005 -7.604 -5.646 795 HG13 VAL 104 3HG1 VAL 104 -0.094 -6.094 -5.642 796 HG21 VAL 104 3HG2 VAL 104 2.989 -7.765 -7.101 797 HG22 VAL 104 1HG2 VAL 104 2.616 -7.813 -5.377 798 HG23 VAL 104 2HG2 VAL 104 2.460 -6.301 -6.273 799 H GLN 105 H GLN 105 2.636 -10.501 -5.646 800 HA GLN 105 HA GLN 105 1.138 -10.992 -3.122 801 HB2 GLN 105 1HB GLN 105 1.609 -12.982 -4.715 802 HB3 GLN 105 2HB GLN 105 3.286 -12.815 -4.209 803 HG2 GLN 105 1HG GLN 105 0.954 -13.168 -2.305 804 HG3 GLN 105 2HG GLN 105 2.003 -14.474 -2.843 805 HE21 GLN 105 2HE2 GLN 105 1.619 -12.127 -0.422 806 HE22 GLN 105 1HE2 GLN 105 3.201 -12.153 0.193 807 H LEU 106 H LEU 106 2.030 -9.718 -1.539 808 HA LEU 106 HA LEU 106 4.742 -8.789 -1.736 809 HB2 LEU 106 1HB LEU 106 2.773 -8.580 0.550 810 HB3 LEU 106 2HB LEU 106 4.209 -7.590 0.300 811 HG LEU 106 HG LEU 106 1.830 -7.710 -1.579 812 HD11 LEU 106 1HD1 LEU 106 1.531 -6.601 0.729 813 HD12 LEU 106 2HD1 LEU 106 1.156 -5.613 -0.684 814 HD13 LEU 106 3HD1 LEU 106 2.687 -5.394 0.165 815 HD21 LEU 106 3HD2 LEU 106 3.060 -5.539 -2.395 816 HD22 LEU 106 1HD2 LEU 106 3.671 -7.106 -2.917 817 HD23 LEU 106 2HD2 LEU 106 4.470 -6.242 -1.603 818 H ASN 107 H ASN 107 6.396 -9.940 -1.142 819 HA ASN 107 HA ASN 107 6.091 -12.047 0.943 820 HB2 ASN 107 1HB ASN 107 8.402 -11.780 -0.958 821 HB3 ASN 107 2HB ASN 107 7.925 -13.179 0.001 822 HD21 ASN 107 2HD2 ASN 107 6.395 -10.987 -2.403 823 HD22 ASN 107 1HD2 ASN 107 5.598 -12.223 -3.243 824 H THR 108 H THR 108 6.218 -9.952 2.414 825 HA THR 108 HA THR 108 8.846 -8.897 2.799 826 HB THR 108 HB THR 108 6.775 -8.848 4.978 827 HG1 THR 108 HG1 THR 108 6.017 -8.437 2.630 828 HG21 THR 108 3HG2 THR 108 7.558 -6.454 5.077 829 HG22 THR 108 1HG2 THR 108 8.750 -6.850 3.840 830 HG23 THR 108 2HG2 THR 108 8.816 -7.640 5.414 831 H ALA 109 H ALA 109 9.826 -9.046 5.028 832 HA ALA 109 HA ALA 109 10.984 -11.472 5.453 833 HB1 ALA 109 3HB ALA 109 10.367 -9.711 7.812 834 HB2 ALA 109 1HB ALA 109 11.483 -9.185 6.552 835 HB3 ALA 109 2HB ALA 109 11.825 -10.645 7.478 836 H GLU 110 H GLU 110 7.886 -10.390 6.744 837 HA GLU 110 HA GLU 110 7.369 -13.160 7.655 838 HB2 GLU 110 1HB GLU 110 6.265 -12.322 9.658 839 HB3 GLU 110 2HB GLU 110 7.938 -11.765 9.621 840 HG2 GLU 110 1HG GLU 110 7.132 -9.611 8.608 841 HG3 GLU 110 2HG GLU 110 5.479 -10.167 8.858 842 H LEU 111 H LEU 111 6.128 -10.053 6.553 843 HA LEU 111 HA LEU 111 3.400 -10.838 6.445 844 HB2 LEU 111 1HB LEU 111 4.584 -8.450 6.311 845 HB3 LEU 111 2HB LEU 111 4.508 -8.759 4.584 846 HG LEU 111 HG LEU 111 2.533 -7.526 5.221 847 HD11 LEU 111 1HD1 LEU 111 2.400 -9.608 3.646 848 HD12 LEU 111 2HD1 LEU 111 0.911 -8.850 4.205 849 HD13 LEU 111 3HD1 LEU 111 1.481 -10.330 4.969 850 HD21 LEU 111 3HD2 LEU 111 2.720 -8.580 7.685 851 HD22 LEU 111 1HD2 LEU 111 1.504 -9.680 7.034 852 HD23 LEU 111 2HD2 LEU 111 1.201 -7.949 7.058 853 H LYS 112 H LYS 112 2.323 -11.937 4.941 854 HA LYS 112 HA LYS 112 3.351 -12.246 2.255 855 HB2 LYS 112 1HB LYS 112 4.428 -14.083 3.660 856 HB3 LYS 112 2HB LYS 112 2.803 -14.746 3.844 857 HG2 LYS 112 1HG LYS 112 2.561 -14.946 1.429 858 HG3 LYS 112 2HG LYS 112 4.122 -14.163 1.177 859 HD2 LYS 112 1HD LYS 112 5.234 -16.010 2.386 860 HD3 LYS 112 2HD LYS 112 3.672 -16.802 2.594 861 HE2 LYS 112 1HE LYS 112 3.398 -16.928 0.149 862 HE3 LYS 112 2HE LYS 112 4.954 -16.121 -0.069 863 HZ1 LYS 112 3HZ LYS 112 5.121 -18.366 1.693 864 HZ2 LYS 112 1HZ LYS 112 6.040 -18.007 0.314 865 HZ3 LYS 112 2HZ LYS 112 4.552 -18.811 0.156 866 H LEU 113 H LEU 113 1.538 -11.316 1.452 867 HA LEU 113 HA LEU 113 -0.989 -12.825 1.808 868 HB2 LEU 113 1HB LEU 113 -0.423 -10.070 2.639 869 HB3 LEU 113 2HB LEU 113 -1.777 -10.141 1.519 870 HG LEU 113 HG LEU 113 -2.921 -11.761 2.946 871 HD11 LEU 113 1HD1 LEU 113 -1.768 -11.920 5.369 872 HD12 LEU 113 2HD1 LEU 113 -0.306 -11.754 4.401 873 HD13 LEU 113 3HD1 LEU 113 -1.423 -13.085 4.096 874 HD21 LEU 113 3HD2 LEU 113 -3.562 -10.250 4.644 875 HD22 LEU 113 1HD2 LEU 113 -2.971 -9.208 3.349 876 HD23 LEU 113 2HD2 LEU 113 -1.948 -9.545 4.746 877 H VAL 114 H VAL 114 -2.653 -11.997 0.152 878 HA VAL 114 HA VAL 114 -1.337 -11.469 -2.458 879 HB VAL 114 HB VAL 114 -3.561 -13.415 -1.780 880 HG11 VAL 114 1HG1 VAL 114 -3.434 -13.849 -4.329 881 HG12 VAL 114 2HG1 VAL 114 -2.669 -12.262 -4.425 882 HG13 VAL 114 3HG1 VAL 114 -4.307 -12.414 -3.792 883 HG21 VAL 114 3HG2 VAL 114 -1.072 -14.041 -1.554 884 HG22 VAL 114 1HG2 VAL 114 -1.003 -13.912 -3.312 885 HG23 VAL 114 2HG2 VAL 114 -2.071 -15.095 -2.556 886 H PHE 115 H PHE 115 -2.181 -9.742 -3.517 887 HA PHE 115 HA PHE 115 -4.848 -8.725 -2.733 888 HB2 PHE 115 1HB PHE 115 -2.288 -7.237 -3.358 889 HB3 PHE 115 2HB PHE 115 -3.867 -6.457 -3.417 890 HD1 PHE 115 HD2 PHE 115 -1.432 -8.184 -1.218 891 HD2 PHE 115 HD1 PHE 115 -5.081 -5.913 -1.400 892 HE1 PHE 115 HE2 PHE 115 -1.395 -7.915 1.247 893 HE2 PHE 115 HE1 PHE 115 -5.032 -5.671 1.060 894 HZ PHE 115 HZ PHE 115 -3.214 -6.688 2.387 895 H GLN 116 H GLN 116 -6.193 -8.156 -4.324 896 HA GLN 116 HA GLN 116 -5.387 -8.643 -7.135 897 HB2 GLN 116 1HB GLN 116 -7.205 -10.089 -6.132 898 HB3 GLN 116 2HB GLN 116 -8.188 -8.631 -5.984 899 HG2 GLN 116 1HG GLN 116 -8.815 -9.623 -8.057 900 HG3 GLN 116 2HG GLN 116 -7.777 -8.265 -8.473 901 HE21 GLN 116 2HE2 GLN 116 -6.046 -8.732 -9.815 902 HE22 GLN 116 1HE2 GLN 116 -5.461 -10.292 -10.139 903 H LEU 117 H LEU 117 -4.573 -6.506 -7.436 904 HA LEU 117 HA LEU 117 -6.364 -4.227 -7.030 905 HB2 LEU 117 1HB LEU 117 -3.478 -4.595 -7.835 906 HB3 LEU 117 2HB LEU 117 -4.254 -3.031 -7.998 907 HG LEU 117 HG LEU 117 -4.496 -4.492 -5.375 908 HD11 LEU 117 1HD1 LEU 117 -2.100 -4.632 -5.880 909 HD12 LEU 117 2HD1 LEU 117 -2.388 -3.454 -4.600 910 HD13 LEU 117 3HD1 LEU 117 -2.062 -2.906 -6.245 911 HD21 LEU 117 3HD2 LEU 117 -5.662 -2.303 -5.906 912 HD22 LEU 117 1HD2 LEU 117 -4.070 -1.556 -5.990 913 HD23 LEU 117 2HD2 LEU 117 -4.633 -2.264 -4.477 914 HA PRO 118 HA PRO 118 -7.733 -4.148 -11.250 915 HB2 PRO 118 1HB PRO 118 -8.052 -1.482 -11.746 916 HB3 PRO 118 2HB PRO 118 -9.126 -2.394 -10.662 917 HG2 PRO 118 1HG PRO 118 -6.812 -0.636 -9.985 918 HG3 PRO 118 2HG PRO 118 -8.409 -0.732 -9.220 919 HD2 PRO 118 1HD PRO 118 -6.210 -1.933 -8.153 920 HD3 PRO 118 2HD PRO 118 -7.839 -2.610 -7.964 921 H PHE 119 H PHE 119 -6.485 -4.633 -12.968 922 HA PHE 119 HA PHE 119 -3.885 -4.204 -13.395 923 HB2 PHE 119 1HB PHE 119 -5.301 -5.746 -14.660 924 HB3 PHE 119 2HB PHE 119 -6.042 -4.383 -15.498 925 HD1 PHE 119 HD1 PHE 119 -2.681 -5.849 -14.743 926 HD2 PHE 119 HD2 PHE 119 -5.108 -3.659 -17.529 927 HE1 PHE 119 HE1 PHE 119 -0.832 -5.897 -16.392 928 HE2 PHE 119 HE2 PHE 119 -3.253 -3.703 -19.178 929 HZ PHE 119 HZ PHE 119 -1.115 -4.823 -18.608 930 H GLY 120 H GLY 120 -2.561 -2.884 -14.438 931 HA2 GLY 120 1HA GLY 120 -1.727 -0.780 -14.934 932 HA3 GLY 120 2HA GLY 120 -2.885 -0.923 -16.248 933 H SER 121 H SER 121 -3.714 1.076 -16.421 934 HA SER 121 HA SER 121 -4.865 2.991 -15.888 935 HB2 SER 121 1HB SER 121 -6.575 1.274 -15.295 936 HB3 SER 121 2HB SER 121 -5.961 1.274 -13.647 937 HG SER 121 HG SER 121 -7.806 2.784 -14.466 938 H HIS 122 H HIS 122 -5.445 2.683 -12.639 939 HA HIS 122 HA HIS 122 -3.416 4.667 -11.980 940 HB2 HIS 122 1HB HIS 122 -5.854 4.801 -11.261 941 HB3 HIS 122 2HB HIS 122 -5.497 3.491 -10.136 942 HD2 HIS 122 HD2 HIS 122 -4.890 4.582 -7.688 943 HE1 HIS 122 HE1 HIS 122 -2.963 8.093 -9.024 944 HE2 HIS 122 HE2 HIS 122 -3.662 6.772 -6.970 945 H THR 123 H THR 123 -3.604 1.296 -11.909 946 HA THR 123 HA THR 123 -2.172 0.862 -9.445 947 HB THR 123 HB THR 123 -2.748 -0.983 -11.767 948 HG1 THR 123 HG1 THR 123 -4.274 -1.794 -10.283 949 HG21 THR 123 3HG2 THR 123 -1.446 -1.420 -9.080 950 HG22 THR 123 1HG2 THR 123 -0.842 -1.876 -10.673 951 HG23 THR 123 2HG2 THR 123 -2.215 -2.730 -9.973 952 H ARG 124 H ARG 124 -1.332 1.112 -12.882 953 HA ARG 124 HA ARG 124 1.245 0.076 -12.796 954 HB2 ARG 124 1HB ARG 124 0.029 0.709 -14.865 955 HB3 ARG 124 2HB ARG 124 0.257 2.407 -14.459 956 HG2 ARG 124 1HG ARG 124 2.721 2.051 -14.485 957 HG3 ARG 124 2HG ARG 124 2.447 0.379 -14.972 958 HD2 ARG 124 1HD ARG 124 1.465 2.794 -16.507 959 HD3 ARG 124 2HD ARG 124 2.929 1.896 -16.898 960 HE ARG 124 HE ARG 124 0.192 1.046 -17.377 961 HH11 ARG 124 1HH2 ARG 124 3.509 0.144 -16.991 962 HH12 ARG 124 2HH2 ARG 124 3.355 -1.335 -17.879 963 HH21 ARG 124 1HH1 ARG 124 -0.018 -0.890 -18.549 964 HH22 ARG 124 2HH1 ARG 124 1.357 -1.921 -18.761 965 H THR 125 H THR 125 0.114 3.352 -12.137 966 HA THR 125 HA THR 125 2.594 4.597 -11.838 967 HB THR 125 HB THR 125 0.159 5.234 -10.164 968 HG1 THR 125 HG1 THR 125 0.630 5.461 -12.898 969 HG21 THR 125 3HG2 THR 125 2.362 6.921 -11.370 970 HG22 THR 125 1HG2 THR 125 2.220 6.473 -9.670 971 HG23 THR 125 2HG2 THR 125 1.017 7.529 -10.406 972 H PHE 126 H PHE 126 0.584 2.851 -9.505 973 HA PHE 126 HA PHE 126 2.093 3.310 -7.201 974 HB2 PHE 126 1HB PHE 126 -0.133 2.218 -7.228 975 HB3 PHE 126 2HB PHE 126 0.605 0.777 -7.930 976 HD1 PHE 126 HD2 PHE 126 0.731 3.052 -4.976 977 HD2 PHE 126 HD1 PHE 126 1.682 -0.825 -6.553 978 HE1 PHE 126 HE2 PHE 126 1.357 2.281 -2.710 979 HE2 PHE 126 HE1 PHE 126 2.320 -1.594 -4.286 980 HZ PHE 126 HZ PHE 126 2.156 -0.039 -2.361 981 H LEU 127 H LEU 127 2.357 0.546 -9.488 982 HA LEU 127 HA LEU 127 4.380 -0.849 -8.286 983 HB2 LEU 127 1HB LEU 127 4.288 -0.343 -11.269 984 HB3 LEU 127 2HB LEU 127 4.932 -1.757 -10.438 985 HG LEU 127 HG LEU 127 2.034 -0.894 -10.448 986 HD11 LEU 127 1HD1 LEU 127 2.706 -1.757 -12.615 987 HD12 LEU 127 2HD1 LEU 127 1.746 -2.988 -11.791 988 HD13 LEU 127 3HD1 LEU 127 3.503 -3.137 -11.857 989 HD21 LEU 127 3HD2 LEU 127 2.376 -2.041 -8.401 990 HD22 LEU 127 1HD2 LEU 127 3.549 -3.146 -9.113 991 HD23 LEU 127 2HD2 LEU 127 1.834 -3.314 -9.490 992 H GLN 128 H GLN 128 4.862 1.785 -10.711 993 HA GLN 128 HA GLN 128 7.625 1.746 -10.673 994 HB2 GLN 128 1HB GLN 128 5.644 3.934 -11.245 995 HB3 GLN 128 2HB GLN 128 7.375 4.068 -11.569 996 HG2 GLN 128 1HG GLN 128 7.317 2.178 -13.066 997 HG3 GLN 128 2HG GLN 128 5.650 1.812 -12.617 998 HE21 GLN 128 2HE2 GLN 128 3.967 3.199 -13.420 999 HE22 GLN 128 1HE2 GLN 128 4.253 4.275 -14.687 1000 H GLU 129 H GLU 129 5.371 3.627 -8.654 1001 HA GLU 129 HA GLU 129 7.300 5.246 -7.404 1002 HB2 GLU 129 1HB GLU 129 4.620 4.264 -6.406 1003 HB3 GLU 129 2HB GLU 129 5.597 5.470 -5.575 1004 HG2 GLU 129 1HG GLU 129 4.664 5.736 -8.443 1005 HG3 GLU 129 2HG GLU 129 3.840 6.462 -7.065 1006 H VAL 130 H VAL 130 6.077 2.021 -6.543 1007 HA VAL 130 HA VAL 130 7.436 1.859 -4.054 1008 HB VAL 130 HB VAL 130 6.425 -0.281 -5.941 1009 HG11 VAL 130 1HG1 VAL 130 6.544 -1.679 -3.775 1010 HG12 VAL 130 2HG1 VAL 130 7.661 -0.446 -3.190 1011 HG13 VAL 130 3HG1 VAL 130 8.058 -1.386 -4.629 1012 HG21 VAL 130 3HG2 VAL 130 5.331 0.865 -3.348 1013 HG22 VAL 130 1HG2 VAL 130 4.581 -0.416 -4.302 1014 HG23 VAL 130 2HG2 VAL 130 4.711 1.215 -4.961 1015 H ALA 131 H ALA 131 8.240 0.709 -7.296 1016 HA ALA 131 HA ALA 131 10.682 -0.530 -6.700 1017 HB1 ALA 131 3HB ALA 131 11.204 -0.286 -9.090 1018 HB2 ALA 131 1HB ALA 131 9.872 0.859 -9.259 1019 HB3 ALA 131 2HB ALA 131 9.543 -0.822 -8.841 1020 H ARG 132 H ARG 132 10.162 2.799 -7.893 1021 HA ARG 132 HA ARG 132 12.923 3.505 -7.763 1022 HB2 ARG 132 1HB ARG 132 10.413 5.184 -7.930 1023 HB3 ARG 132 2HB ARG 132 12.045 5.851 -8.011 1024 HG2 ARG 132 1HG ARG 132 12.546 4.499 -9.981 1025 HG3 ARG 132 2HG ARG 132 10.973 3.709 -9.871 1026 HD2 ARG 132 1HD ARG 132 10.864 5.461 -11.558 1027 HD3 ARG 132 2HD ARG 132 9.879 5.930 -10.176 1028 HE ARG 132 HE ARG 132 12.507 6.958 -9.875 1029 HH11 ARG 132 1HH2 ARG 132 9.600 7.319 -11.717 1030 HH12 ARG 132 2HH2 ARG 132 9.841 9.007 -12.024 1031 HH21 ARG 132 1HH1 ARG 132 12.831 9.168 -10.273 1032 HH22 ARG 132 2HH1 ARG 132 11.671 10.055 -11.205 1033 H ALA 133 H ALA 133 10.360 3.413 -5.453 1034 HA ALA 133 HA ALA 133 11.366 5.303 -3.595 1035 HB1 ALA 133 3HB ALA 133 9.889 3.942 -1.974 1036 HB2 ALA 133 1HB ALA 133 9.433 3.008 -3.397 1037 HB3 ALA 133 2HB ALA 133 9.105 4.737 -3.338 1038 H CYS 134 H CYS 134 12.354 2.079 -4.357 1039 HA CYS 134 HA CYS 134 14.716 2.113 -3.001 1040 HB2 CYS 134 1HB CYS 134 13.979 2.281 -0.829 1041 HB3 CYS 134 2HB CYS 134 12.463 1.462 -1.158 1042 HG CYS 134 HG CYS 134 13.575 -0.782 -0.758 1043 HA PRO 135 HA PRO 135 13.895 -2.581 -3.691 1044 HB2 PRO 135 1HB PRO 135 11.345 -3.360 -4.380 1045 HB3 PRO 135 2HB PRO 135 11.916 -3.263 -2.703 1046 HG2 PRO 135 1HG PRO 135 10.377 -1.230 -4.277 1047 HG3 PRO 135 2HG PRO 135 10.055 -1.859 -2.645 1048 HD2 PRO 135 1HD PRO 135 11.292 0.498 -2.940 1049 HD3 PRO 135 2HD PRO 135 11.829 -0.650 -1.691 1050 H GLY 136 H GLY 136 14.594 -0.603 -5.504 1051 HA2 GLY 136 1HA GLY 136 13.268 -0.988 -8.028 1052 HA3 GLY 136 2HA GLY 136 14.767 -0.103 -7.766 1053 H PHE 137 H PHE 137 13.379 -3.334 -8.110 1054 HA PHE 137 HA PHE 137 14.445 -5.407 -8.430 1055 HB2 PHE 137 1HB PHE 137 15.264 -3.735 -10.816 1056 HB3 PHE 137 2HB PHE 137 15.183 -5.496 -10.769 1057 HD1 PHE 137 HD1 PHE 137 13.199 -2.376 -10.647 1058 HD2 PHE 137 HD2 PHE 137 13.066 -6.666 -10.826 1059 HE1 PHE 137 HE1 PHE 137 10.783 -2.278 -11.194 1060 HE2 PHE 137 HE2 PHE 137 10.647 -6.568 -11.370 1061 HZ PHE 137 HZ PHE 137 9.507 -4.374 -11.555 1062 H ASP 138 H ASP 138 16.030 -5.515 -6.752 1063 HA ASP 138 HA ASP 138 18.790 -5.417 -7.770 1064 HB2 ASP 138 1HB ASP 138 17.655 -3.612 -5.788 1065 HB3 ASP 138 2HB ASP 138 18.939 -4.563 -5.052 1066 HA PRO 139 HA PRO 139 19.235 -9.339 -5.867 1067 HB2 PRO 139 1HB PRO 139 21.586 -9.145 -4.391 1068 HB3 PRO 139 2HB PRO 139 21.523 -9.348 -6.154 1069 HG2 PRO 139 1HG PRO 139 21.873 -6.846 -4.556 1070 HG3 PRO 139 2HG PRO 139 22.718 -7.370 -6.025 1071 HD2 PRO 139 1HD PRO 139 20.744 -5.558 -6.152 1072 HD3 PRO 139 2HD PRO 139 20.928 -6.782 -7.424 1073 H GLU 140 H GLU 140 19.935 -6.756 -3.500 1074 HA GLU 140 HA GLU 140 18.213 -8.149 -1.536 1075 HB2 GLU 140 1HB GLU 140 20.961 -6.984 -1.018 1076 HB3 GLU 140 2HB GLU 140 19.854 -7.537 0.239 1077 HG2 GLU 140 1HG GLU 140 20.877 -9.274 -2.029 1078 HG3 GLU 140 2HG GLU 140 21.550 -9.267 -0.401 1079 H THR 141 H THR 141 19.736 -5.154 -2.608 1080 HA THR 141 HA THR 141 19.177 -2.950 -2.313 1081 HB THR 141 HB THR 141 16.342 -3.814 -1.781 1082 HG1 THR 141 HG1 THR 141 16.134 -4.556 -3.759 1083 HG21 THR 141 3HG2 THR 141 17.023 -1.829 -3.871 1084 HG22 THR 141 1HG2 THR 141 17.470 -1.339 -2.236 1085 HG23 THR 141 2HG2 THR 141 15.795 -1.744 -2.610 1086 H ARG 142 H ARG 142 20.392 -3.541 -0.144 1087 HA ARG 142 HA ARG 142 18.742 -3.425 2.227 1088 HB2 ARG 142 1HB ARG 142 20.909 -4.642 2.187 1089 HB3 ARG 142 2HB ARG 142 21.736 -3.102 1.965 1090 HG2 ARG 142 1HG ARG 142 20.770 -2.287 4.111 1091 HG3 ARG 142 2HG ARG 142 20.001 -3.857 4.339 1092 HD2 ARG 142 1HD ARG 142 22.985 -3.445 4.017 1093 HD3 ARG 142 2HD ARG 142 22.169 -3.628 5.570 1094 HE ARG 142 HE ARG 142 22.689 -5.723 3.621 1095 HH11 ARG 142 1HH2 ARG 142 20.864 -4.638 6.354 1096 HH12 ARG 142 2HH2 ARG 142 20.442 -6.233 6.880 1097 HH21 ARG 142 1HH1 ARG 142 22.136 -7.820 4.303 1098 HH22 ARG 142 2HH1 ARG 142 21.163 -8.035 5.720 1099 H ASP 143 H ASP 143 18.286 -1.739 3.463 1100 HA ASP 143 HA ASP 143 19.597 0.616 3.873 1101 HB2 ASP 143 1HB ASP 143 18.050 2.140 2.367 1102 HB3 ASP 143 2HB ASP 143 19.503 1.420 1.689 1103 HA PRO 144 HA PRO 144 15.227 -0.009 5.675 1104 HB2 PRO 144 1HB PRO 144 15.749 -1.399 7.952 1105 HB3 PRO 144 2HB PRO 144 15.415 -2.202 6.411 1106 HG2 PRO 144 1HG PRO 144 18.044 -1.639 7.723 1107 HG3 PRO 144 2HG PRO 144 17.471 -3.130 6.936 1108 HD2 PRO 144 1HD PRO 144 19.102 -1.362 5.641 1109 HD3 PRO 144 2HD PRO 144 17.863 -2.321 4.797 1110 H GLU 145 H GLU 145 14.440 1.373 7.234 1111 HA GLU 145 HA GLU 145 16.252 2.602 9.172 1112 HB2 GLU 145 1HB GLU 145 16.486 4.007 7.122 1113 HB3 GLU 145 2HB GLU 145 14.747 4.306 7.163 1114 HG2 GLU 145 1HG GLU 145 14.927 5.372 9.333 1115 HG3 GLU 145 2HG GLU 145 16.630 4.943 9.451 1116 H PHE 146 H PHE 146 13.059 3.223 7.704 1117 HA PHE 146 HA PHE 146 11.017 3.673 8.687 1118 HB2 PHE 146 1HB PHE 146 10.270 1.817 10.203 1119 HB3 PHE 146 2HB PHE 146 10.979 1.256 8.688 1120 HD1 PHE 146 HD2 PHE 146 11.681 1.847 12.290 1121 HD2 PHE 146 HD1 PHE 146 12.970 -0.057 8.664 1122 HE1 PHE 146 HE2 PHE 146 13.421 0.612 13.552 1123 HE2 PHE 146 HE1 PHE 146 14.702 -1.288 9.937 1124 HZ PHE 146 HZ PHE 146 14.944 -0.955 12.360 1125 H GLU 147 H GLU 147 13.646 4.543 10.158 1126 HA GLU 147 HA GLU 147 13.185 4.736 12.893 1127 HB2 GLU 147 1HB GLU 147 15.328 5.197 11.668 1128 HB3 GLU 147 2HB GLU 147 14.652 6.757 11.196 1129 HG2 GLU 147 1HG GLU 147 14.389 7.391 13.540 1130 HG3 GLU 147 2HG GLU 147 14.969 5.807 14.054 1131 H TRP 148 H TRP 148 11.808 6.582 10.285 1132 HA TRP 148 HA TRP 148 10.849 8.665 12.116 1133 HB2 TRP 148 1HB TRP 148 9.999 9.773 10.098 1134 HB3 TRP 148 2HB TRP 148 11.715 9.398 9.962 1135 HD1 TRP 148 HD1 TRP 148 12.387 7.280 8.435 1136 HE1 TRP 148 HE1 TRP 148 11.197 6.260 6.388 1137 HE3 TRP 148 HE3 TRP 148 7.739 9.313 9.008 1138 HZ2 TRP 148 HZ2 TRP 148 8.626 6.301 5.157 1139 HZ3 TRP 148 HZ3 TRP 148 5.938 8.803 7.385 1140 HH2 TRP 148 HH2 TRP 148 6.374 7.298 5.461 1141 H LEU 149 H LEU 149 9.763 5.676 10.847 1142 HA LEU 149 HA LEU 149 6.975 6.186 10.691 1143 HB2 LEU 149 1HB LEU 149 8.663 3.726 10.953 1144 HB3 LEU 149 2HB LEU 149 6.944 3.586 11.298 1145 HG LEU 149 HG LEU 149 6.350 4.335 9.103 1146 HD11 LEU 149 1HD1 LEU 149 7.758 6.074 8.516 1147 HD12 LEU 149 2HD1 LEU 149 8.383 4.800 7.478 1148 HD13 LEU 149 3HD1 LEU 149 9.223 5.209 8.974 1149 HD21 LEU 149 3HD2 LEU 149 7.174 2.535 7.809 1150 HD22 LEU 149 1HD2 LEU 149 7.329 1.960 9.470 1151 HD23 LEU 149 2HD2 LEU 149 8.745 2.567 8.609 1152 H SER 150 H SER 150 9.125 5.355 13.382 1153 HA SER 150 HA SER 150 7.358 4.625 15.350 1154 HB2 SER 150 1HB SER 150 8.922 5.622 16.938 1155 HB3 SER 150 2HB SER 150 9.811 4.829 15.641 1156 HG SER 150 HG SER 150 9.107 7.506 15.296 1157 H ARG 151 H ARG 151 7.654 7.683 13.757 1158 HA ARG 151 HA ARG 151 6.373 9.354 15.661 1159 HB2 ARG 151 1HB ARG 151 6.515 9.493 12.640 1160 HB3 ARG 151 2HB ARG 151 5.844 10.769 13.652 1161 HG2 ARG 151 1HG ARG 151 7.973 11.007 14.823 1162 HG3 ARG 151 2HG ARG 151 8.659 9.679 13.885 1163 HD2 ARG 151 1HD ARG 151 8.293 10.960 11.810 1164 HD3 ARG 151 2HD ARG 151 7.627 12.292 12.751 1165 HE ARG 151 HE ARG 151 10.435 11.561 12.517 1166 HH11 ARG 151 1HH2 ARG 151 7.974 13.262 14.249 1167 HH12 ARG 151 2HH2 ARG 151 9.071 14.381 14.987 1168 HH21 ARG 151 1HH1 ARG 151 11.886 13.017 13.488 1169 HH22 ARG 151 2HH1 ARG 151 11.286 14.242 14.556 1170 H HIS 152 H HIS 152 5.246 7.298 13.055 1171 HA HIS 152 HA HIS 152 2.473 7.979 13.376 1172 HB2 HIS 152 1HB HIS 152 3.917 5.793 11.865 1173 HB3 HIS 152 2HB HIS 152 2.161 5.961 11.869 1174 HD2 HIS 152 HD2 HIS 152 5.295 7.779 10.358 1175 HE1 HIS 152 HE1 HIS 152 1.834 9.725 8.924 1176 HE2 HIS 152 HE2 HIS 152 4.358 9.562 8.697 1177 H THR 153 H THR 153 0.898 6.802 14.382 1178 HA THR 153 HA THR 153 1.700 4.435 15.971 1179 HB THR 153 HB THR 153 1.672 6.087 17.645 1180 HG1 THR 153 HG1 THR 153 0.282 4.292 18.055 1181 HG21 THR 153 3HG2 THR 153 -0.075 7.807 17.838 1182 HG22 THR 153 1HG2 THR 153 -0.862 7.175 16.392 1183 HG23 THR 153 2HG2 THR 153 0.737 7.912 16.277 1184 H CYS 154 H CYS 154 -0.213 5.827 13.717 1185 HA CYS 154 HA CYS 154 -2.092 5.165 12.578 1186 HB2 CYS 154 1HB CYS 154 -1.940 2.586 14.137 1187 HB3 CYS 154 2HB CYS 154 -2.597 2.847 12.522 1188 HG CYS 154 HG CYS 154 0.436 2.751 13.220 1189 H ALA 155 H ALA 155 -4.399 4.763 12.836 1190 HA ALA 155 HA ALA 155 -6.405 5.197 13.882 1191 HB1 ALA 155 3HB ALA 155 -5.000 3.953 16.250 1192 HB2 ALA 155 1HB ALA 155 -5.838 3.062 14.981 1193 HB3 ALA 155 2HB ALA 155 -6.742 4.136 16.048 1194 H GLU 156 H GLU 156 -6.959 5.877 16.566 1195 HA GLU 156 HA GLU 156 -6.882 8.568 16.615 1196 HB2 GLU 156 1HB GLU 156 -7.935 6.920 18.300 1197 HB3 GLU 156 2HB GLU 156 -6.410 7.061 19.176 1198 HG2 GLU 156 1HG GLU 156 -6.695 9.548 19.162 1199 HG3 GLU 156 2HG GLU 156 -8.275 9.323 18.421 1200 HA PRO 157 HA PRO 157 -2.408 9.421 16.613 1201 HB2 PRO 157 1HB PRO 157 -3.420 12.023 17.733 1202 HB3 PRO 157 2HB PRO 157 -2.222 11.742 16.451 1203 HG2 PRO 157 1HG PRO 157 -4.689 12.488 15.849 1204 HG3 PRO 157 2HG PRO 157 -3.842 11.278 14.864 1205 HD2 PRO 157 1HD PRO 157 -6.058 10.880 16.840 1206 HD3 PRO 157 2HD PRO 157 -5.691 9.985 15.345 1207 H ASP 158 H ASP 158 -4.456 10.476 19.339 1208 HA ASP 158 HA ASP 158 -2.242 9.957 21.224 1209 HB2 ASP 158 1HB ASP 158 -4.840 11.479 21.442 1210 HB3 ASP 158 2HB ASP 158 -3.837 11.104 22.843 1211 H ALA 159 H ALA 159 -2.188 7.930 21.940 1212 HA ALA 159 HA ALA 159 -4.326 6.101 21.862 1213 HB1 ALA 159 3HB ALA 159 -2.052 5.306 21.965 1214 HB2 ALA 159 1HB ALA 159 -2.886 4.750 23.418 1215 HB3 ALA 159 2HB ALA 159 -1.786 6.127 23.502 1216 H GLU 160 H GLU 160 -3.066 8.119 24.498 1217 HA GLU 160 HA GLU 160 -4.820 7.113 26.496 1218 HB2 GLU 160 1HB GLU 160 -3.319 9.734 26.296 1219 HB3 GLU 160 2HB GLU 160 -4.169 9.181 27.740 1220 HG2 GLU 160 1HG GLU 160 -1.960 7.628 26.363 1221 HG3 GLU 160 2HG GLU 160 -1.719 8.654 27.775 1222 H SER 161 H SER 161 -5.039 9.783 24.199 1223 HA SER 161 HA SER 161 -7.885 9.808 24.294 1224 HB2 SER 161 1HB SER 161 -6.403 11.961 25.803 1225 HB3 SER 161 2HB SER 161 -8.039 12.194 25.187 1226 HG SER 161 HG SER 161 -8.593 11.243 26.978 Start of MODEL 9 1 H1 GLY 1 1H GLY 1 -13.464 10.929 -13.942 2 H2 GLY 1 2H GLY 1 -13.408 10.339 -15.534 3 H3 GLY 1 3H GLY 1 -14.400 9.585 -14.380 4 HA2 GLY 1 1HA GLY 1 -15.002 12.361 -14.606 5 HA3 GLY 1 2HA GLY 1 -15.161 11.526 -16.152 6 HA PRO 2 HA PRO 2 -19.021 9.824 -14.929 7 HB2 PRO 2 1HB PRO 2 -18.894 7.223 -15.827 8 HB3 PRO 2 2HB PRO 2 -19.080 8.622 -16.903 9 HG2 PRO 2 1HG PRO 2 -16.610 7.086 -16.218 10 HG3 PRO 2 2HG PRO 2 -17.152 7.702 -17.791 11 HD2 PRO 2 1HD PRO 2 -15.257 8.985 -16.319 12 HD3 PRO 2 2HD PRO 2 -16.406 9.867 -17.353 13 H LEU 3 H LEU 3 -16.131 8.292 -13.782 14 HA LEU 3 HA LEU 3 -17.331 6.429 -11.995 15 HB2 LEU 3 1HB LEU 3 -14.984 6.215 -12.673 16 HB3 LEU 3 2HB LEU 3 -14.603 7.745 -11.890 17 HG LEU 3 HG LEU 3 -15.210 6.807 -9.701 18 HD11 LEU 3 1HD1 LEU 3 -15.523 4.195 -9.729 19 HD12 LEU 3 2HD1 LEU 3 -16.049 4.455 -11.392 20 HD13 LEU 3 3HD1 LEU 3 -16.909 5.230 -10.060 21 HD21 LEU 3 3HD2 LEU 3 -13.320 5.350 -9.453 22 HD22 LEU 3 1HD2 LEU 3 -12.902 6.498 -10.726 23 HD23 LEU 3 2HD2 LEU 3 -13.398 4.857 -11.145 24 H GLY 4 H GLY 4 -15.499 9.364 -11.110 25 HA2 GLY 4 1HA GLY 4 -16.057 11.062 -9.627 26 HA3 GLY 4 2HA GLY 4 -17.630 10.306 -9.392 27 H SER 5 H SER 5 -17.304 10.756 -7.113 28 HA SER 5 HA SER 5 -16.915 10.009 -4.973 29 HB2 SER 5 1HB SER 5 -16.642 7.735 -4.639 30 HB3 SER 5 2HB SER 5 -17.187 7.724 -6.313 31 HG SER 5 HG SER 5 -14.677 8.075 -6.552 32 H MET 6 H MET 6 -15.374 10.628 -3.584 33 HA MET 6 HA MET 6 -13.015 11.824 -4.316 34 HB2 MET 6 1HB MET 6 -13.609 10.355 -1.732 35 HB3 MET 6 2HB MET 6 -12.295 11.507 -1.960 36 HG2 MET 6 1HG MET 6 -15.234 12.142 -2.341 37 HG3 MET 6 2HG MET 6 -14.300 12.550 -0.906 38 HE1 MET 6 3HE MET 6 -11.362 13.641 -2.206 39 HE2 MET 6 1HE MET 6 -12.375 13.831 -0.768 40 HE3 MET 6 2HE MET 6 -11.966 15.232 -1.751 41 H ASP 7 H ASP 7 -11.015 11.187 -4.876 42 HA ASP 7 HA ASP 7 -10.506 8.479 -5.547 43 HB2 ASP 7 1HB ASP 7 -8.741 10.920 -5.391 44 HB3 ASP 7 2HB ASP 7 -8.151 9.346 -5.923 45 H GLN 8 H GLN 8 -8.135 7.728 -4.839 46 HA GLN 8 HA GLN 8 -8.391 7.146 -1.987 47 HB2 GLN 8 1HB GLN 8 -6.742 6.065 -4.259 48 HB3 GLN 8 2HB GLN 8 -6.259 5.719 -2.598 49 HG2 GLN 8 1HG GLN 8 -7.628 3.900 -3.216 50 HG3 GLN 8 2HG GLN 8 -8.688 4.921 -2.256 51 HE21 GLN 8 2HE2 GLN 8 -10.215 3.435 -3.742 52 HE22 GLN 8 1HE2 GLN 8 -10.717 4.177 -5.180 53 H SER 9 H SER 9 -6.108 8.655 -4.215 54 HA SER 9 HA SER 9 -3.990 9.178 -2.512 55 HB2 SER 9 1HB SER 9 -3.497 11.128 -3.956 56 HB3 SER 9 2HB SER 9 -3.904 9.695 -4.896 57 HG SER 9 HG SER 9 -5.948 11.445 -4.120 58 H VAL 10 H VAL 10 -6.867 11.215 -3.022 59 HA VAL 10 HA VAL 10 -6.134 13.195 -1.118 60 HB VAL 10 HB VAL 10 -8.845 12.394 -2.199 61 HG11 VAL 10 1HG1 VAL 10 -9.434 14.759 -1.426 62 HG12 VAL 10 2HG1 VAL 10 -7.956 14.707 -0.465 63 HG13 VAL 10 3HG1 VAL 10 -9.253 13.554 -0.150 64 HG21 VAL 10 3HG2 VAL 10 -7.340 13.214 -3.924 65 HG22 VAL 10 1HG2 VAL 10 -6.864 14.577 -2.913 66 HG23 VAL 10 2HG2 VAL 10 -8.505 14.485 -3.551 67 H ALA 11 H ALA 11 -8.249 10.372 -0.940 68 HA ALA 11 HA ALA 11 -9.298 10.531 1.563 69 HB1 ALA 11 3HB ALA 11 -8.109 7.956 0.536 70 HB2 ALA 11 1HB ALA 11 -9.557 8.666 -0.174 71 HB3 ALA 11 2HB ALA 11 -9.556 8.174 1.520 72 H ILE 12 H ILE 12 -6.066 9.223 0.774 73 HA ILE 12 HA ILE 12 -5.364 8.615 3.435 74 HB ILE 12 HB ILE 12 -3.526 9.393 1.165 75 HG12 ILE 12 1HG1 ILE 12 -4.948 7.552 0.467 76 HG13 ILE 12 2HG1 ILE 12 -3.346 6.920 0.814 77 HG21 ILE 12 1HG2 ILE 12 -1.952 7.850 2.452 78 HG22 ILE 12 2HG2 ILE 12 -3.094 7.963 3.793 79 HG23 ILE 12 3HG2 ILE 12 -2.286 9.413 3.197 80 HD11 ILE 12 3HD1 ILE 12 -4.686 5.371 1.917 81 HD12 ILE 12 1HD1 ILE 12 -5.896 6.574 2.354 82 HD13 ILE 12 2HD1 ILE 12 -4.365 6.507 3.224 83 H GLN 13 H GLN 13 -4.542 11.400 1.442 84 HA GLN 13 HA GLN 13 -3.074 12.878 3.230 85 HB2 GLN 13 1HB GLN 13 -4.563 13.472 0.814 86 HB3 GLN 13 2HB GLN 13 -4.717 14.815 1.941 87 HG2 GLN 13 1HG GLN 13 -2.068 13.552 1.159 88 HG3 GLN 13 2HG GLN 13 -2.730 15.002 0.409 89 HE21 GLN 13 2HE2 GLN 13 -0.644 13.998 2.876 90 HE22 GLN 13 1HE2 GLN 13 -0.698 15.399 3.829 91 H GLU 14 H GLU 14 -6.667 12.846 3.025 92 HA GLU 14 HA GLU 14 -7.034 14.656 5.175 93 HB2 GLU 14 1HB GLU 14 -8.835 12.535 3.987 94 HB3 GLU 14 2HB GLU 14 -9.359 13.715 5.191 95 HG2 GLU 14 1HG GLU 14 -8.795 15.555 3.698 96 HG3 GLU 14 2HG GLU 14 -8.126 14.432 2.517 97 H THR 15 H THR 15 -6.629 11.191 4.975 98 HA THR 15 HA THR 15 -7.119 10.854 7.866 99 HB THR 15 HB THR 15 -7.118 8.481 7.432 100 HG1 THR 15 HG1 THR 15 -5.832 7.871 5.915 101 HG21 THR 15 3HG2 THR 15 -8.702 10.198 5.534 102 HG22 THR 15 1HG2 THR 15 -9.258 9.267 6.926 103 HG23 THR 15 2HG2 THR 15 -8.806 8.444 5.434 104 H LEU 16 H LEU 16 -4.603 12.033 6.411 105 HA LEU 16 HA LEU 16 -2.532 10.155 7.061 106 HB2 LEU 16 1HB LEU 16 -2.688 12.406 5.465 107 HB3 LEU 16 2HB LEU 16 -1.737 13.006 6.809 108 HG LEU 16 HG LEU 16 -1.110 10.494 5.226 109 HD11 LEU 16 1HD1 LEU 16 0.226 13.209 5.177 110 HD12 LEU 16 2HD1 LEU 16 -0.853 12.589 3.928 111 HD13 LEU 16 3HD1 LEU 16 0.692 11.797 4.227 112 HD21 LEU 16 3HD2 LEU 16 0.560 11.998 7.265 113 HD22 LEU 16 1HD2 LEU 16 1.002 10.509 6.437 114 HD23 LEU 16 2HD2 LEU 16 -0.312 10.504 7.604 115 H VAL 17 H VAL 17 -0.807 12.292 8.222 116 HA VAL 17 HA VAL 17 -1.948 12.726 10.882 117 HB VAL 17 HB VAL 17 0.697 11.284 10.558 118 HG11 VAL 17 1HG1 VAL 17 -1.084 11.507 12.985 119 HG12 VAL 17 2HG1 VAL 17 0.159 12.706 12.624 120 HG13 VAL 17 3HG1 VAL 17 0.611 11.027 12.917 121 HG21 VAL 17 3HG2 VAL 17 -0.950 9.743 9.781 122 HG22 VAL 17 1HG2 VAL 17 -2.072 10.194 11.066 123 HG23 VAL 17 2HG2 VAL 17 -0.601 9.306 11.454 124 H GLU 18 H GLU 18 1.486 12.706 10.357 125 HA GLU 18 HA GLU 18 1.710 15.490 10.942 126 HB2 GLU 18 1HB GLU 18 3.731 13.405 10.101 127 HB3 GLU 18 2HB GLU 18 4.152 15.065 10.526 128 HG2 GLU 18 1HG GLU 18 3.192 14.786 12.750 129 HG3 GLU 18 2HG GLU 18 2.644 13.162 12.339 130 H GLY 19 H GLY 19 3.713 16.414 9.363 131 HA2 GLY 19 1HA GLY 19 2.286 17.138 6.964 132 HA3 GLY 19 2HA GLY 19 3.885 17.704 7.442 133 H GLU 20 H GLU 20 2.258 14.711 6.355 134 HA GLU 20 HA GLU 20 4.749 13.918 4.987 135 HB2 GLU 20 1HB GLU 20 2.303 12.354 5.808 136 HB3 GLU 20 2HB GLU 20 3.526 11.700 4.719 137 HG2 GLU 20 1HG GLU 20 5.260 12.158 6.446 138 HG3 GLU 20 2HG GLU 20 3.998 12.734 7.532 139 H TYR 21 H TYR 21 4.772 13.302 2.918 140 HA TYR 21 HA TYR 21 2.829 14.645 1.153 141 HB2 TYR 21 1HB TYR 21 5.285 15.118 0.940 142 HB3 TYR 21 2HB TYR 21 5.501 13.449 0.425 143 HD1 TYR 21 HD1 TYR 21 4.077 16.731 -0.487 144 HD2 TYR 21 HD2 TYR 21 4.701 12.665 -1.725 145 HE1 TYR 21 HE1 TYR 21 3.475 17.345 -2.815 146 HE2 TYR 21 HE2 TYR 21 4.098 13.278 -4.049 147 HH TYR 21 HH TYR 21 2.459 15.691 -4.949 148 H CYS 22 H CYS 22 1.470 13.595 -0.114 149 HA CYS 22 HA CYS 22 1.589 10.651 -0.173 150 HB2 CYS 22 1HB CYS 22 -0.710 10.702 -0.797 151 HB3 CYS 22 2HB CYS 22 -0.546 11.922 0.465 152 HG CYS 22 HG CYS 22 -0.553 12.716 -2.563 153 H VAL 23 H VAL 23 1.963 9.576 -2.107 154 HA VAL 23 HA VAL 23 2.658 11.274 -4.440 155 HB VAL 23 HB VAL 23 3.633 8.504 -3.715 156 HG11 VAL 23 1HG1 VAL 23 4.408 10.457 -5.902 157 HG12 VAL 23 2HG1 VAL 23 3.651 8.878 -6.123 158 HG13 VAL 23 3HG1 VAL 23 5.298 8.988 -5.513 159 HG21 VAL 23 3HG2 VAL 23 5.726 9.590 -3.125 160 HG22 VAL 23 1HG2 VAL 23 4.428 10.330 -2.189 161 HG23 VAL 23 2HG2 VAL 23 5.086 11.165 -3.597 162 H ILE 24 H ILE 24 1.247 8.154 -3.514 163 HA ILE 24 HA ILE 24 -0.815 8.266 -5.446 164 HB ILE 24 HB ILE 24 0.902 7.920 -7.098 165 HG12 ILE 24 1HG1 ILE 24 0.204 5.789 -8.081 166 HG13 ILE 24 2HG1 ILE 24 -0.444 5.255 -6.536 167 HG21 ILE 24 1HG2 ILE 24 2.545 6.947 -5.354 168 HG22 ILE 24 2HG2 ILE 24 2.609 6.305 -6.991 169 HG23 ILE 24 3HG2 ILE 24 1.803 5.394 -5.723 170 HD11 ILE 24 3HD1 ILE 24 -2.077 6.295 -8.283 171 HD12 ILE 24 1HD1 ILE 24 -1.394 7.836 -7.767 172 HD13 ILE 24 2HD1 ILE 24 -2.213 6.797 -6.598 173 H ALA 25 H ALA 25 -2.276 7.415 -4.087 174 HA ALA 25 HA ALA 25 -1.685 4.803 -2.788 175 HB1 ALA 25 3HB ALA 25 -3.619 6.952 -1.906 176 HB2 ALA 25 1HB ALA 25 -2.029 6.672 -1.196 177 HB3 ALA 25 2HB ALA 25 -3.284 5.439 -1.066 178 H VAL 26 H VAL 26 -2.767 3.130 -3.568 179 HA VAL 26 HA VAL 26 -5.316 3.644 -4.993 180 HB VAL 26 HB VAL 26 -4.843 1.611 -6.261 181 HG11 VAL 26 1HG1 VAL 26 -3.890 3.893 -6.908 182 HG12 VAL 26 2HG1 VAL 26 -3.087 2.494 -7.620 183 HG13 VAL 26 3HG1 VAL 26 -2.354 3.329 -6.251 184 HG21 VAL 26 3HG2 VAL 26 -3.648 0.276 -4.672 185 HG22 VAL 26 1HG2 VAL 26 -2.409 1.512 -4.462 186 HG23 VAL 26 2HG2 VAL 26 -2.508 0.610 -5.974 187 H GLN 27 H GLN 27 -6.154 0.977 -5.100 188 HA GLN 27 HA GLN 27 -6.409 0.156 -2.286 189 HB2 GLN 27 1HB GLN 27 -8.332 1.638 -2.790 190 HB3 GLN 27 2HB GLN 27 -8.760 0.589 -4.142 191 HG2 GLN 27 1HG GLN 27 -9.111 -1.287 -2.657 192 HG3 GLN 27 2HG GLN 27 -8.507 -0.366 -1.287 193 HE21 GLN 27 2HE2 GLN 27 -11.070 -1.455 -1.137 194 HE22 GLN 27 1HE2 GLN 27 -12.211 -0.206 -1.212 195 H GLY 28 H GLY 28 -6.981 -2.043 -2.031 196 HA2 GLY 28 1HA GLY 28 -7.224 -3.689 -4.448 197 HA3 GLY 28 2HA GLY 28 -5.834 -3.962 -3.400 198 H VAL 29 H VAL 29 -7.708 -5.940 -3.903 199 HA VAL 29 HA VAL 29 -9.339 -6.084 -1.448 200 HB VAL 29 HB VAL 29 -9.369 -8.021 -3.767 201 HG11 VAL 29 1HG1 VAL 29 -10.556 -8.925 -1.936 202 HG12 VAL 29 2HG1 VAL 29 -11.814 -8.166 -2.911 203 HG13 VAL 29 3HG1 VAL 29 -11.217 -7.359 -1.465 204 HG21 VAL 29 3HG2 VAL 29 -11.345 -6.668 -4.576 205 HG22 VAL 29 1HG2 VAL 29 -9.791 -5.852 -4.746 206 HG23 VAL 29 2HG2 VAL 29 -10.880 -5.412 -3.429 207 H LEU 30 H LEU 30 -9.400 -8.286 -0.437 208 HA LEU 30 HA LEU 30 -6.858 -9.769 -0.646 209 HB2 LEU 30 1HB LEU 30 -6.935 -8.003 1.316 210 HB3 LEU 30 2HB LEU 30 -8.034 -9.148 2.078 211 HG LEU 30 HG LEU 30 -5.879 -9.708 2.892 212 HD11 LEU 30 1HD1 LEU 30 -6.260 -11.609 0.562 213 HD12 LEU 30 2HD1 LEU 30 -7.247 -11.645 2.023 214 HD13 LEU 30 3HD1 LEU 30 -5.517 -11.951 2.121 215 HD21 LEU 30 3HD2 LEU 30 -4.993 -8.801 0.245 216 HD22 LEU 30 1HD2 LEU 30 -4.206 -10.306 0.720 217 HD23 LEU 30 2HD2 LEU 30 -4.110 -8.889 1.761 218 H CYS 31 H CYS 31 -7.565 -11.850 -1.132 219 HA CYS 31 HA CYS 31 -10.246 -12.628 -0.214 220 HB2 CYS 31 1HB CYS 31 -9.942 -12.932 -2.558 221 HB3 CYS 31 2HB CYS 31 -8.374 -13.702 -2.325 222 HG CYS 31 HG CYS 31 -10.832 -15.246 -2.493 223 H LYS 32 H LYS 32 -10.493 -13.920 1.436 224 HA LYS 32 HA LYS 32 -8.298 -15.760 2.202 225 HB2 LYS 32 1HB LYS 32 -8.780 -13.769 3.804 226 HB3 LYS 32 2HB LYS 32 -10.267 -14.629 4.193 227 HG2 LYS 32 1HG LYS 32 -9.007 -16.605 4.858 228 HG3 LYS 32 2HG LYS 32 -7.496 -15.840 4.369 229 HD2 LYS 32 1HD LYS 32 -7.960 -14.024 6.056 230 HD3 LYS 32 2HD LYS 32 -9.327 -14.987 6.625 231 HE2 LYS 32 1HE LYS 32 -6.486 -16.005 6.465 232 HE3 LYS 32 2HE LYS 32 -7.223 -15.370 7.936 233 HZ1 LYS 32 3HZ LYS 32 -7.296 -17.880 7.548 234 HZ2 LYS 32 1HZ LYS 32 -8.495 -17.547 6.396 235 HZ3 LYS 32 2HZ LYS 32 -8.737 -17.115 8.021 236 H GLY 33 H GLY 33 -8.912 -17.809 1.914 237 HA2 GLY 33 1HA GLY 33 -10.933 -19.019 0.875 238 HA3 GLY 33 2HA GLY 33 -10.314 -19.683 2.380 239 H ASP 34 H ASP 34 -12.975 -18.240 0.804 240 HA ASP 34 HA ASP 34 -15.114 -17.715 1.466 241 HB2 ASP 34 1HB ASP 34 -14.321 -19.722 3.579 242 HB3 ASP 34 2HB ASP 34 -15.948 -19.061 3.445 243 H SER 35 H SER 35 -13.670 -15.634 1.976 244 HA SER 35 HA SER 35 -14.856 -14.218 4.025 245 HB2 SER 35 1HB SER 35 -13.847 -15.413 5.771 246 HB3 SER 35 2HB SER 35 -12.349 -15.647 4.873 247 HG SER 35 HG SER 35 -13.183 -13.038 5.448 248 H ARG 36 H ARG 36 -14.632 -13.037 1.895 249 HA ARG 36 HA ARG 36 -12.019 -12.036 1.214 250 HB2 ARG 36 1HB ARG 36 -13.984 -12.500 -0.366 251 HB3 ARG 36 2HB ARG 36 -14.667 -10.987 0.218 252 HG2 ARG 36 1HG ARG 36 -12.963 -9.684 -0.724 253 HG3 ARG 36 2HG ARG 36 -11.823 -11.021 -0.791 254 HD2 ARG 36 1HD ARG 36 -13.317 -12.099 -2.515 255 HD3 ARG 36 2HD ARG 36 -14.251 -10.603 -2.547 256 HE ARG 36 HE ARG 36 -11.417 -10.215 -2.966 257 HH11 ARG 36 1HH2 ARG 36 -14.471 -10.983 -4.402 258 HH12 ARG 36 2HH2 ARG 36 -14.014 -10.449 -5.985 259 HH21 ARG 36 1HH1 ARG 36 -10.811 -9.518 -5.036 260 HH22 ARG 36 2HH1 ARG 36 -11.942 -9.618 -6.343 261 H GLN 37 H GLN 37 -11.087 -10.181 1.827 262 HA GLN 37 HA GLN 37 -12.673 -8.242 3.426 263 HB2 GLN 37 1HB GLN 37 -9.847 -9.203 3.942 264 HB3 GLN 37 2HB GLN 37 -10.716 -7.992 4.885 265 HG2 GLN 37 1HG GLN 37 -12.287 -9.585 5.684 266 HG3 GLN 37 2HG GLN 37 -11.817 -10.772 4.472 267 HE21 GLN 37 2HE2 GLN 37 -9.893 -12.012 4.822 268 HE22 GLN 37 1HE2 GLN 37 -9.077 -12.020 6.308 269 H SER 38 H SER 38 -12.749 -6.426 2.306 270 HA SER 38 HA SER 38 -10.776 -5.689 0.342 271 HB2 SER 38 1HB SER 38 -12.859 -3.858 1.525 272 HB3 SER 38 2HB SER 38 -12.081 -3.749 -0.052 273 HG SER 38 HG SER 38 -14.241 -5.200 0.734 274 H ARG 39 H ARG 39 -9.049 -4.365 0.527 275 HA ARG 39 HA ARG 39 -8.615 -2.933 3.094 276 HB2 ARG 39 1HB ARG 39 -6.533 -4.490 1.547 277 HB3 ARG 39 2HB ARG 39 -6.262 -3.591 3.035 278 HG2 ARG 39 1HG ARG 39 -8.287 -5.830 2.891 279 HG3 ARG 39 2HG ARG 39 -6.591 -6.145 3.239 280 HD2 ARG 39 1HD ARG 39 -6.753 -4.493 5.138 281 HD3 ARG 39 2HD ARG 39 -8.487 -4.408 4.841 282 HE ARG 39 HE ARG 39 -7.340 -7.067 5.312 283 HH11 ARG 39 1HH2 ARG 39 -9.091 -4.316 6.504 284 HH12 ARG 39 2HH2 ARG 39 -9.807 -5.178 7.823 285 HH21 ARG 39 1HH1 ARG 39 -8.275 -8.188 7.053 286 HH22 ARG 39 2HH1 ARG 39 -9.346 -7.362 8.134 287 H LEU 40 H LEU 40 -7.287 -1.118 2.984 288 HA LEU 40 HA LEU 40 -6.903 0.048 0.275 289 HB2 LEU 40 1HB LEU 40 -8.758 1.147 1.460 290 HB3 LEU 40 2HB LEU 40 -7.718 1.453 2.839 291 HG LEU 40 HG LEU 40 -6.225 2.807 1.278 292 HD11 LEU 40 1HD1 LEU 40 -8.603 2.349 -0.538 293 HD12 LEU 40 2HD1 LEU 40 -6.917 1.979 -0.874 294 HD13 LEU 40 3HD1 LEU 40 -7.441 3.650 -0.774 295 HD21 LEU 40 3HD2 LEU 40 -9.098 3.620 1.770 296 HD22 LEU 40 1HD2 LEU 40 -7.853 4.739 1.214 297 HD23 LEU 40 2HD2 LEU 40 -7.699 3.961 2.790 298 H LEU 41 H LEU 41 -4.777 0.561 -0.235 299 HA LEU 41 HA LEU 41 -2.992 1.327 1.977 300 HB2 LEU 41 1HB LEU 41 -1.329 -0.361 0.618 301 HB3 LEU 41 2HB LEU 41 -2.230 -0.836 2.046 302 HG LEU 41 HG LEU 41 -4.060 -1.700 0.607 303 HD11 LEU 41 1HD1 LEU 41 -3.346 -1.992 -1.881 304 HD12 LEU 41 2HD1 LEU 41 -2.208 -0.685 -1.560 305 HD13 LEU 41 3HD1 LEU 41 -3.937 -0.411 -1.384 306 HD21 LEU 41 3HD2 LEU 41 -2.288 -3.224 1.330 307 HD22 LEU 41 1HD2 LEU 41 -1.278 -2.732 -0.029 308 HD23 LEU 41 2HD2 LEU 41 -2.771 -3.622 -0.319 309 H GLY 42 H GLY 42 -1.206 2.573 1.296 310 HA2 GLY 42 1HA GLY 42 -0.971 3.043 -1.601 311 HA3 GLY 42 2HA GLY 42 -1.244 4.415 -0.527 312 H LEU 43 H LEU 43 0.752 5.241 -1.313 313 HA LEU 43 HA LEU 43 3.093 4.144 0.112 314 HB2 LEU 43 1HB LEU 43 3.308 3.448 -2.224 315 HB3 LEU 43 2HB LEU 43 3.033 5.100 -2.766 316 HG LEU 43 HG LEU 43 5.091 5.837 -1.686 317 HD11 LEU 43 1HD1 LEU 43 6.619 3.877 -0.825 318 HD12 LEU 43 2HD1 LEU 43 5.095 3.011 -0.627 319 HD13 LEU 43 3HD1 LEU 43 5.374 4.518 0.244 320 HD21 LEU 43 3HD2 LEU 43 5.099 4.770 -3.996 321 HD22 LEU 43 1HD2 LEU 43 5.674 3.293 -3.221 322 HD23 LEU 43 2HD2 LEU 43 6.652 4.758 -3.160 323 H VAL 44 H VAL 44 4.319 5.673 1.111 324 HA VAL 44 HA VAL 44 3.621 8.530 0.627 325 HB VAL 44 HB VAL 44 3.900 8.935 3.016 326 HG11 VAL 44 1HG1 VAL 44 1.684 8.140 1.992 327 HG12 VAL 44 2HG1 VAL 44 1.845 7.971 3.740 328 HG13 VAL 44 3HG1 VAL 44 2.049 6.565 2.696 329 HG21 VAL 44 3HG2 VAL 44 5.491 7.314 3.708 330 HG22 VAL 44 1HG2 VAL 44 4.546 5.984 3.042 331 HG23 VAL 44 2HG2 VAL 44 3.993 6.815 4.494 332 H ARG 45 H ARG 45 5.262 9.824 0.192 333 HA ARG 45 HA ARG 45 8.028 8.837 0.637 334 HB2 ARG 45 1HB ARG 45 7.563 9.208 -1.722 335 HB3 ARG 45 2HB ARG 45 6.930 10.818 -1.381 336 HG2 ARG 45 1HG ARG 45 9.132 11.568 -0.623 337 HG3 ARG 45 2HG ARG 45 9.781 9.939 -0.817 338 HD2 ARG 45 1HD ARG 45 8.602 11.590 -3.065 339 HD3 ARG 45 2HD ARG 45 10.327 11.470 -2.722 340 HE ARG 45 HE ARG 45 9.305 8.864 -2.977 341 HH11 ARG 45 1HH2 ARG 45 9.823 11.735 -4.833 342 HH12 ARG 45 2HH2 ARG 45 10.037 10.895 -6.332 343 HH21 ARG 45 1HH1 ARG 45 9.585 7.752 -4.935 344 HH22 ARG 45 2HH1 ARG 45 9.903 8.637 -6.390 345 H TYR 46 H TYR 46 9.143 9.836 2.169 346 HA TYR 46 HA TYR 46 8.281 12.540 3.055 347 HB2 TYR 46 1HB TYR 46 7.911 10.740 4.712 348 HB3 TYR 46 2HB TYR 46 9.625 10.341 4.650 349 HD1 TYR 46 HD2 TYR 46 7.405 13.343 5.122 350 HD2 TYR 46 HD1 TYR 46 10.999 11.302 6.260 351 HE1 TYR 46 HE2 TYR 46 7.859 15.095 6.817 352 HE2 TYR 46 HE1 TYR 46 11.479 13.053 7.942 353 HH TYR 46 HH TYR 46 10.870 15.448 8.324 354 H ARG 47 H ARG 47 9.707 14.131 2.780 355 HA ARG 47 HA ARG 47 12.417 13.479 1.851 356 HB2 ARG 47 1HB ARG 47 11.029 15.081 0.551 357 HB3 ARG 47 2HB ARG 47 11.005 16.157 1.949 358 HG2 ARG 47 1HG ARG 47 13.481 16.287 1.888 359 HG3 ARG 47 2HG ARG 47 13.495 15.226 0.481 360 HD2 ARG 47 1HD ARG 47 12.082 17.904 0.595 361 HD3 ARG 47 2HD ARG 47 13.675 17.649 -0.109 362 HE ARG 47 HE ARG 47 11.125 16.869 -1.260 363 HH11 ARG 47 1HH2 ARG 47 14.555 16.421 -1.166 364 HH12 ARG 47 2HH2 ARG 47 14.653 15.770 -2.769 365 HH21 ARG 47 1HH1 ARG 47 11.245 16.015 -3.363 366 HH22 ARG 47 2HH1 ARG 47 12.779 15.540 -4.011 367 H LEU 48 H LEU 48 14.276 14.266 2.783 368 HA LEU 48 HA LEU 48 14.017 15.275 5.568 369 HB2 LEU 48 1HB LEU 48 15.922 13.353 4.270 370 HB3 LEU 48 2HB LEU 48 16.470 14.293 5.649 371 HG LEU 48 HG LEU 48 15.487 11.993 6.170 372 HD11 LEU 48 1HD1 LEU 48 14.683 12.704 8.240 373 HD12 LEU 48 2HD1 LEU 48 13.874 14.117 7.569 374 HD13 LEU 48 3HD1 LEU 48 15.628 14.104 7.744 375 HD21 LEU 48 3HD2 LEU 48 13.530 12.441 4.500 376 HD22 LEU 48 1HD2 LEU 48 12.788 13.285 5.856 377 HD23 LEU 48 2HD2 LEU 48 13.213 11.580 5.994 378 H GLU 49 H GLU 49 15.396 16.908 6.243 379 HA GLU 49 HA GLU 49 16.241 18.747 4.182 380 HB2 GLU 49 1HB GLU 49 16.380 18.823 7.204 381 HB3 GLU 49 2HB GLU 49 16.914 20.146 6.164 382 HG2 GLU 49 1HG GLU 49 14.673 20.331 5.199 383 HG3 GLU 49 2HG GLU 49 14.128 18.949 6.147 384 H ASN 50 H ASN 50 17.618 16.057 5.556 385 HA ASN 50 HA ASN 50 20.390 17.091 5.404 386 HB2 ASN 50 1HB ASN 50 19.241 14.579 6.640 387 HB3 ASN 50 2HB ASN 50 20.961 14.946 6.551 388 HD21 ASN 50 2HD2 ASN 50 19.281 14.692 9.006 389 HD22 ASN 50 1HD2 ASN 50 19.411 16.183 9.807 390 H ASP 51 H ASP 51 18.155 15.681 3.456 391 HA ASP 51 HA ASP 51 18.371 14.749 1.359 392 HB2 ASP 51 1HB ASP 51 20.784 15.809 1.516 393 HB3 ASP 51 2HB ASP 51 21.289 14.146 1.784 394 H ALA 52 H ALA 52 17.087 13.194 2.629 395 HA ALA 52 HA ALA 52 18.165 10.537 2.312 396 HB1 ALA 52 3HB ALA 52 17.673 9.885 4.690 397 HB2 ALA 52 1HB ALA 52 17.518 11.599 5.071 398 HB3 ALA 52 2HB ALA 52 19.061 10.957 4.511 399 H GLN 53 H GLN 53 16.490 9.853 1.101 400 HA GLN 53 HA GLN 53 13.765 10.623 1.689 401 HB2 GLN 53 1HB GLN 53 14.705 8.567 -0.313 402 HB3 GLN 53 2HB GLN 53 13.180 9.454 -0.306 403 HG2 GLN 53 1HG GLN 53 15.941 10.634 -0.711 404 HG3 GLN 53 2HG GLN 53 14.689 10.459 -1.937 405 HE21 GLN 53 2HE2 GLN 53 13.144 12.131 -2.096 406 HE22 GLN 53 1HE2 GLN 53 13.043 13.430 -1.011 407 H GLU 54 H GLU 54 12.204 9.411 2.602 408 HA GLU 54 HA GLU 54 12.851 6.650 3.461 409 HB2 GLU 54 1HB GLU 54 11.535 8.871 5.040 410 HB3 GLU 54 2HB GLU 54 11.533 7.176 5.524 411 HG2 GLU 54 1HG GLU 54 13.946 7.131 5.634 412 HG3 GLU 54 2HG GLU 54 14.051 8.755 4.957 413 H HIS 55 H HIS 55 11.387 5.218 2.786 414 HA HIS 55 HA HIS 55 8.662 6.172 2.059 415 HB2 HIS 55 1HB HIS 55 10.344 4.070 0.683 416 HB3 HIS 55 2HB HIS 55 8.684 4.488 0.264 417 HD2 HIS 55 HD2 HIS 55 8.397 7.121 -0.914 418 HE1 HIS 55 HE1 HIS 55 12.524 7.582 -1.679 419 HE2 HIS 55 HE2 HIS 55 10.214 8.514 -2.171 420 H ALA 56 H ALA 56 6.937 4.786 2.475 421 HA ALA 56 HA ALA 56 7.405 2.174 3.635 422 HB1 ALA 56 3HB ALA 56 7.613 3.364 5.668 423 HB2 ALA 56 1HB ALA 56 5.931 2.835 5.642 424 HB3 ALA 56 2HB ALA 56 6.338 4.501 5.229 425 H LEU 57 H LEU 57 5.561 0.864 3.555 426 HA LEU 57 HA LEU 57 3.394 1.923 1.854 427 HB2 LEU 57 1HB LEU 57 4.716 -0.185 1.264 428 HB3 LEU 57 2HB LEU 57 3.884 -0.963 2.599 429 HG LEU 57 HG LEU 57 2.290 0.488 0.478 430 HD11 LEU 57 1HD1 LEU 57 3.235 -2.387 0.305 431 HD12 LEU 57 2HD1 LEU 57 3.814 -1.063 -0.708 432 HD13 LEU 57 3HD1 LEU 57 2.132 -1.584 -0.814 433 HD21 LEU 57 3HD2 LEU 57 1.763 -1.754 2.451 434 HD22 LEU 57 1HD2 LEU 57 0.692 -1.452 1.086 435 HD23 LEU 57 2HD2 LEU 57 0.930 -0.208 2.305 436 H PHE 58 H PHE 58 1.986 2.900 3.152 437 HA PHE 58 HA PHE 58 1.253 1.896 5.734 438 HB2 PHE 58 1HB PHE 58 0.435 4.192 3.979 439 HB3 PHE 58 2HB PHE 58 -0.544 3.783 5.386 440 HD1 PHE 58 HD1 PHE 58 3.142 3.224 5.399 441 HD2 PHE 58 HD2 PHE 58 -0.061 5.872 6.505 442 HE1 PHE 58 HE1 PHE 58 4.670 4.456 6.886 443 HE2 PHE 58 HE2 PHE 58 1.482 7.102 7.994 444 HZ PHE 58 HZ PHE 58 3.845 6.392 8.187 445 H LEU 59 H LEU 59 -0.687 1.016 6.374 446 HA LEU 59 HA LEU 59 -2.425 -0.067 4.223 447 HB2 LEU 59 1HB LEU 59 -1.084 -1.770 5.510 448 HB3 LEU 59 2HB LEU 59 -1.961 -1.269 6.954 449 HG LEU 59 HG LEU 59 -4.075 -1.687 5.273 450 HD11 LEU 59 1HD1 LEU 59 -2.319 -4.003 4.515 451 HD12 LEU 59 2HD1 LEU 59 -2.219 -2.516 3.584 452 HD13 LEU 59 3HD1 LEU 59 -3.754 -3.370 3.710 453 HD21 LEU 59 3HD2 LEU 59 -2.628 -3.746 6.966 454 HD22 LEU 59 1HD2 LEU 59 -4.245 -3.984 6.303 455 HD23 LEU 59 2HD2 LEU 59 -3.952 -2.691 7.464 456 H TYR 60 H TYR 60 -4.398 0.724 4.235 457 HA TYR 60 HA TYR 60 -5.488 1.887 6.744 458 HB2 TYR 60 1HB TYR 60 -6.008 2.577 3.850 459 HB3 TYR 60 2HB TYR 60 -6.901 3.250 5.210 460 HD1 TYR 60 HD2 TYR 60 -3.609 3.084 3.521 461 HD2 TYR 60 HD1 TYR 60 -5.916 4.888 6.655 462 HE1 TYR 60 HE2 TYR 60 -1.872 4.831 3.792 463 HE2 TYR 60 HE1 TYR 60 -4.181 6.636 6.934 464 HH TYR 60 HH TYR 60 -1.933 7.084 6.452 465 H THR 61 H THR 61 -7.359 1.017 7.518 466 HA THR 61 HA THR 61 -8.537 -1.195 6.022 467 HB THR 61 HB THR 61 -8.170 -1.366 8.480 468 HG1 THR 61 HG1 THR 61 -10.611 -1.800 8.802 469 HG21 THR 61 3HG2 THR 61 -8.730 1.028 8.986 470 HG22 THR 61 1HG2 THR 61 -9.578 -0.127 10.012 471 HG23 THR 61 2HG2 THR 61 -10.425 0.648 8.673 472 H HIS 62 H HIS 62 -10.866 -1.280 5.698 473 HA HIS 62 HA HIS 62 -12.440 1.080 5.815 474 HB2 HIS 62 1HB HIS 62 -12.591 1.709 3.547 475 HB3 HIS 62 2HB HIS 62 -10.864 1.577 3.876 476 HD2 HIS 62 HD2 HIS 62 -9.634 -0.791 2.700 477 HE1 HIS 62 HE1 HIS 62 -12.918 -1.615 0.179 478 HE2 HIS 62 HE2 HIS 62 -10.499 -2.211 0.685 479 H ARG 63 H ARG 63 -14.550 0.784 4.755 480 HA ARG 63 HA ARG 63 -15.413 -1.971 5.113 481 HB2 ARG 63 1HB ARG 63 -16.551 0.451 5.766 482 HB3 ARG 63 2HB ARG 63 -17.427 0.044 4.292 483 HG2 ARG 63 1HG ARG 63 -17.924 -2.192 5.241 484 HG3 ARG 63 2HG ARG 63 -17.120 -1.707 6.732 485 HD2 ARG 63 1HD ARG 63 -19.513 -1.377 6.998 486 HD3 ARG 63 2HD ARG 63 -18.724 0.195 6.929 487 HE ARG 63 HE ARG 63 -19.522 -0.550 4.320 488 HH11 ARG 63 1HH2 ARG 63 -20.788 0.354 7.405 489 HH12 ARG 63 2HH2 ARG 63 -22.221 1.085 6.763 490 HH21 ARG 63 1HH1 ARG 63 -21.406 0.406 3.462 491 HH22 ARG 63 2HH1 ARG 63 -22.571 1.114 4.529 492 H ARG 64 H ARG 64 -17.654 -1.919 3.426 493 HA ARG 64 HA ARG 64 -16.560 -2.954 1.043 494 HB2 ARG 64 1HB ARG 64 -19.363 -2.107 1.776 495 HB3 ARG 64 2HB ARG 64 -18.954 -2.912 0.260 496 HG2 ARG 64 1HG ARG 64 -18.061 -4.830 1.466 497 HG3 ARG 64 2HG ARG 64 -18.330 -4.017 3.010 498 HD2 ARG 64 1HD ARG 64 -20.153 -5.587 2.588 499 HD3 ARG 64 2HD ARG 64 -20.763 -3.936 2.513 500 HE ARG 64 HE ARG 64 -19.969 -4.824 -0.074 501 HH11 ARG 64 1HH2 ARG 64 -22.400 -5.164 2.361 502 HH12 ARG 64 2HH2 ARG 64 -23.661 -5.565 1.244 503 HH21 ARG 64 1HH1 ARG 64 -21.611 -5.345 -1.547 504 HH22 ARG 64 2HH1 ARG 64 -23.213 -5.669 -0.973 505 H MET 65 H MET 65 -18.093 0.202 1.754 506 HA MET 65 HA MET 65 -16.878 1.277 -0.709 507 HB2 MET 65 1HB MET 65 -18.944 2.346 -1.355 508 HB3 MET 65 2HB MET 65 -19.271 0.626 -1.145 509 HG2 MET 65 1HG MET 65 -19.980 1.184 1.245 510 HG3 MET 65 2HG MET 65 -19.929 2.879 0.768 511 HE1 MET 65 3HE MET 65 -21.740 -0.317 0.953 512 HE2 MET 65 1HE MET 65 -21.217 -0.596 -0.714 513 HE3 MET 65 2HE MET 65 -22.924 -0.355 -0.349 514 H ALA 66 H ALA 66 -16.378 1.451 2.233 515 HA ALA 66 HA ALA 66 -17.043 4.259 2.828 516 HB1 ALA 66 3HB ALA 66 -16.485 3.800 5.051 517 HB2 ALA 66 1HB ALA 66 -15.499 2.403 4.624 518 HB3 ALA 66 2HB ALA 66 -17.257 2.324 4.502 519 H ILE 67 H ILE 67 -15.117 3.416 0.759 520 HA ILE 67 HA ILE 67 -12.446 3.944 1.584 521 HB ILE 67 HB ILE 67 -12.066 4.154 -0.870 522 HG12 ILE 67 1HG1 ILE 67 -15.087 3.844 -1.022 523 HG13 ILE 67 2HG1 ILE 67 -14.227 5.346 -1.346 524 HG21 ILE 67 1HG2 ILE 67 -12.852 1.883 -1.452 525 HG22 ILE 67 2HG2 ILE 67 -13.942 1.902 -0.069 526 HG23 ILE 67 3HG2 ILE 67 -12.196 1.913 0.184 527 HD11 ILE 67 3HD1 ILE 67 -12.926 4.125 -3.124 528 HD12 ILE 67 1HD1 ILE 67 -14.648 4.297 -3.462 529 HD13 ILE 67 2HD1 ILE 67 -14.012 2.756 -2.887 530 H THR 68 H THR 68 -15.119 5.903 0.684 531 HA THR 68 HA THR 68 -14.357 8.194 -0.380 532 HB THR 68 HB THR 68 -15.985 9.399 0.941 533 HG1 THR 68 HG1 THR 68 -16.651 7.427 2.646 534 HG21 THR 68 3HG2 THR 68 -17.871 8.002 0.516 535 HG22 THR 68 1HG2 THR 68 -16.919 6.534 0.730 536 HG23 THR 68 2HG2 THR 68 -16.663 7.553 -0.687 537 H GLY 69 H GLY 69 -13.189 7.181 2.780 538 HA2 GLY 69 1HA GLY 69 -10.996 8.125 3.446 539 HA3 GLY 69 2HA GLY 69 -11.596 9.695 2.938 540 H ASP 70 H ASP 70 -14.268 8.613 3.996 541 HA ASP 70 HA ASP 70 -14.338 10.087 6.381 542 HB2 ASP 70 1HB ASP 70 -16.239 8.128 5.117 543 HB3 ASP 70 2HB ASP 70 -16.623 8.997 6.602 544 H ASP 71 H ASP 71 -14.441 6.483 5.939 545 HA ASP 71 HA ASP 71 -13.908 6.247 8.860 546 HB2 ASP 71 1HB ASP 71 -15.437 4.499 6.942 547 HB3 ASP 71 2HB ASP 71 -14.975 3.967 8.557 548 H VAL 72 H VAL 72 -11.757 6.504 6.876 549 HA VAL 72 HA VAL 72 -10.488 3.843 7.289 550 HB VAL 72 HB VAL 72 -9.527 3.876 5.136 551 HG11 VAL 72 1HG1 VAL 72 -11.974 3.334 5.318 552 HG12 VAL 72 2HG1 VAL 72 -11.464 3.865 3.714 553 HG13 VAL 72 3HG1 VAL 72 -12.313 4.980 4.785 554 HG21 VAL 72 3HG2 VAL 72 -10.367 6.767 5.127 555 HG22 VAL 72 1HG2 VAL 72 -10.105 5.927 3.598 556 HG23 VAL 72 2HG2 VAL 72 -8.785 6.086 4.755 557 H SER 73 H SER 73 -8.776 4.010 8.595 558 HA SER 73 HA SER 73 -6.893 6.227 8.251 559 HB2 SER 73 1HB SER 73 -8.133 5.493 10.913 560 HB3 SER 73 2HB SER 73 -6.843 6.669 10.662 561 HG SER 73 HG SER 73 -9.305 6.818 9.285 562 H LEU 74 H LEU 74 -4.908 5.759 9.630 563 HA LEU 74 HA LEU 74 -3.608 3.553 8.867 564 HB2 LEU 74 1HB LEU 74 -3.375 5.080 11.448 565 HB3 LEU 74 2HB LEU 74 -2.281 3.745 11.092 566 HG LEU 74 HG LEU 74 -2.732 6.099 9.235 567 HD11 LEU 74 1HD1 LEU 74 -1.739 6.819 11.389 568 HD12 LEU 74 2HD1 LEU 74 -0.581 6.954 10.068 569 HD13 LEU 74 3HD1 LEU 74 -0.471 5.609 11.202 570 HD21 LEU 74 3HD2 LEU 74 -1.652 4.730 7.776 571 HD22 LEU 74 1HD2 LEU 74 -1.269 3.548 9.023 572 HD23 LEU 74 2HD2 LEU 74 -0.214 4.931 8.771 573 H ASP 75 H ASP 75 -3.817 1.508 9.005 574 HA ASP 75 HA ASP 75 -5.151 0.248 11.337 575 HB2 ASP 75 1HB ASP 75 -6.472 0.005 9.305 576 HB3 ASP 75 2HB ASP 75 -5.075 -0.638 8.443 577 H GLN 76 H GLN 76 -2.317 0.318 9.267 578 HA GLN 76 HA GLN 76 -0.903 -1.364 11.105 579 HB2 GLN 76 1HB GLN 76 -2.220 -2.686 9.011 580 HB3 GLN 76 2HB GLN 76 -0.564 -2.564 8.439 581 HG2 GLN 76 1HG GLN 76 -1.317 -3.632 11.181 582 HG3 GLN 76 2HG GLN 76 -1.084 -4.654 9.768 583 HE21 GLN 76 2HE2 GLN 76 1.087 -4.977 8.989 584 HE22 GLN 76 1HE2 GLN 76 2.445 -4.459 9.865 585 H ILE 77 H ILE 77 1.327 -1.967 9.614 586 HA ILE 77 HA ILE 77 2.196 0.340 8.081 587 HB ILE 77 HB ILE 77 3.290 -0.207 10.861 588 HG12 ILE 77 1HG1 ILE 77 2.406 2.352 9.469 589 HG13 ILE 77 2HG1 ILE 77 1.468 1.457 10.654 590 HG21 ILE 77 1HG2 ILE 77 5.367 0.038 9.912 591 HG22 ILE 77 2HG2 ILE 77 4.972 1.747 9.902 592 HG23 ILE 77 3HG2 ILE 77 4.739 0.789 8.449 593 HD11 ILE 77 3HD1 ILE 77 3.250 1.805 12.336 594 HD12 ILE 77 1HD1 ILE 77 2.567 3.324 11.757 595 HD13 ILE 77 2HD1 ILE 77 4.136 2.779 11.162 596 H VAL 78 H VAL 78 3.104 -0.651 6.412 597 HA VAL 78 HA VAL 78 4.859 -3.009 6.872 598 HB VAL 78 HB VAL 78 3.300 -2.326 4.370 599 HG11 VAL 78 1HG1 VAL 78 4.748 -4.867 5.171 600 HG12 VAL 78 2HG1 VAL 78 5.420 -3.651 4.087 601 HG13 VAL 78 3HG1 VAL 78 3.970 -4.537 3.624 602 HG21 VAL 78 3HG2 VAL 78 2.747 -4.321 6.583 603 HG22 VAL 78 1HG2 VAL 78 1.913 -4.305 5.030 604 HG23 VAL 78 2HG2 VAL 78 1.746 -2.941 6.135 605 HA PRO 79 HA PRO 79 7.405 0.400 5.122 606 HB2 PRO 79 1HB PRO 79 9.517 0.237 6.794 607 HB3 PRO 79 2HB PRO 79 8.002 1.026 7.274 608 HG2 PRO 79 1HG PRO 79 9.034 -1.675 7.991 609 HG3 PRO 79 2HG PRO 79 8.124 -0.517 8.977 610 HD2 PRO 79 1HD PRO 79 7.015 -2.734 7.659 611 HD3 PRO 79 2HD PRO 79 6.092 -1.343 8.255 612 H LEU 80 H LEU 80 9.055 0.312 3.632 613 HA LEU 80 HA LEU 80 9.718 -2.206 2.548 614 HB2 LEU 80 1HB LEU 80 10.861 0.555 2.092 615 HB3 LEU 80 2HB LEU 80 11.291 -0.854 1.123 616 HG LEU 80 HG LEU 80 8.445 0.123 1.507 617 HD11 LEU 80 1HD1 LEU 80 10.371 0.615 -0.784 618 HD12 LEU 80 2HD1 LEU 80 9.764 1.828 0.343 619 HD13 LEU 80 3HD1 LEU 80 8.660 1.043 -0.786 620 HD21 LEU 80 3HD2 LEU 80 8.330 -1.270 -0.764 621 HD22 LEU 80 1HD2 LEU 80 8.224 -2.086 0.792 622 HD23 LEU 80 2HD2 LEU 80 9.748 -2.072 -0.094 623 H SER 81 H SER 81 11.183 -3.560 3.039 624 HA SER 81 HA SER 81 13.641 -2.755 4.514 625 HB2 SER 81 1HB SER 81 13.459 -4.942 5.745 626 HB3 SER 81 2HB SER 81 12.205 -3.774 6.152 627 HG SER 81 HG SER 81 11.527 -6.010 5.664 628 H LYS 82 H LYS 82 15.405 -4.405 4.341 629 HA LYS 82 HA LYS 82 15.978 -4.945 1.671 630 HB2 LYS 82 1HB LYS 82 17.100 -6.178 4.193 631 HB3 LYS 82 2HB LYS 82 17.776 -6.443 2.584 632 HG2 LYS 82 1HG LYS 82 18.084 -4.011 2.313 633 HG3 LYS 82 2HG LYS 82 17.429 -3.749 3.927 634 HD2 LYS 82 1HD LYS 82 19.255 -5.022 4.919 635 HD3 LYS 82 2HD LYS 82 19.885 -5.418 3.320 636 HE2 LYS 82 1HE LYS 82 21.168 -3.558 4.220 637 HE3 LYS 82 2HE LYS 82 20.177 -2.969 2.885 638 HZ1 LYS 82 3HZ LYS 82 20.206 -1.673 5.096 639 HZ2 LYS 82 1HZ LYS 82 19.146 -2.880 5.641 640 HZ3 LYS 82 2HZ LYS 82 18.723 -1.919 4.306 641 H ASP 83 H ASP 83 14.667 -7.152 4.177 642 HA ASP 83 HA ASP 83 14.651 -9.426 2.482 643 HB2 ASP 83 1HB ASP 83 13.045 -10.318 4.206 644 HB3 ASP 83 2HB ASP 83 14.576 -9.735 4.859 645 H PHE 84 H PHE 84 12.953 -6.625 2.189 646 HA PHE 84 HA PHE 84 10.344 -7.617 1.529 647 HB2 PHE 84 1HB PHE 84 10.994 -5.231 2.242 648 HB3 PHE 84 2HB PHE 84 11.545 -5.015 0.581 649 HD1 PHE 84 HD2 PHE 84 9.856 -5.581 -1.311 650 HD2 PHE 84 HD1 PHE 84 8.725 -4.931 2.781 651 HE1 PHE 84 HE2 PHE 84 7.536 -5.092 -2.029 652 HE2 PHE 84 HE1 PHE 84 6.404 -4.445 2.064 653 HZ PHE 84 HZ PHE 84 5.809 -4.523 -0.342 654 H MET 85 H MET 85 9.510 -8.053 -0.490 655 HA MET 85 HA MET 85 10.950 -7.591 -2.911 656 HB2 MET 85 1HB MET 85 12.278 -9.495 -2.052 657 HB3 MET 85 2HB MET 85 10.806 -10.462 -1.953 658 HG2 MET 85 1HG MET 85 10.469 -10.277 -4.362 659 HG3 MET 85 2HG MET 85 11.854 -9.195 -4.502 660 HE1 MET 85 3HE MET 85 11.457 -11.888 -6.219 661 HE2 MET 85 1HE MET 85 13.165 -12.343 -6.262 662 HE3 MET 85 2HE MET 85 12.698 -10.647 -6.373 663 H LEU 86 H LEU 86 9.491 -7.488 -4.546 664 HA LEU 86 HA LEU 86 6.760 -8.426 -4.008 665 HB2 LEU 86 1HB LEU 86 6.484 -7.157 -6.331 666 HB3 LEU 86 2HB LEU 86 6.602 -6.252 -4.825 667 HG LEU 86 HG LEU 86 9.171 -6.934 -6.236 668 HD11 LEU 86 1HD1 LEU 86 7.290 -4.723 -7.119 669 HD12 LEU 86 2HD1 LEU 86 7.775 -6.123 -8.075 670 HD13 LEU 86 3HD1 LEU 86 8.965 -4.898 -7.640 671 HD21 LEU 86 3HD2 LEU 86 9.970 -4.987 -5.167 672 HD22 LEU 86 1HD2 LEU 86 8.852 -5.656 -3.981 673 HD23 LEU 86 2HD2 LEU 86 8.353 -4.303 -4.991 674 H GLU 87 H GLU 87 5.993 -10.264 -4.951 675 HA GLU 87 HA GLU 87 7.523 -11.403 -7.231 676 HB2 GLU 87 1HB GLU 87 6.146 -12.817 -4.939 677 HB3 GLU 87 2HB GLU 87 6.791 -13.625 -6.366 678 HG2 GLU 87 1HG GLU 87 9.033 -12.792 -5.868 679 HG3 GLU 87 2HG GLU 87 8.414 -11.888 -4.486 680 H GLU 88 H GLU 88 6.423 -11.595 -9.011 681 HA GLU 88 HA GLU 88 3.622 -11.035 -9.194 682 HB2 GLU 88 1HB GLU 88 5.586 -12.172 -11.199 683 HB3 GLU 88 2HB GLU 88 3.912 -11.772 -11.582 684 HG2 GLU 88 1HG GLU 88 4.287 -9.442 -10.953 685 HG3 GLU 88 2HG GLU 88 5.937 -9.816 -10.456 686 H VAL 89 H VAL 89 1.911 -12.478 -9.625 687 HA VAL 89 HA VAL 89 2.454 -15.272 -8.793 688 HB VAL 89 HB VAL 89 -0.193 -13.869 -9.089 689 HG11 VAL 89 1HG1 VAL 89 -0.925 -15.789 -7.623 690 HG12 VAL 89 2HG1 VAL 89 0.667 -16.503 -7.880 691 HG13 VAL 89 3HG1 VAL 89 -0.420 -16.261 -9.246 692 HG21 VAL 89 3HG2 VAL 89 -0.118 -13.820 -6.570 693 HG22 VAL 89 1HG2 VAL 89 1.085 -12.776 -7.328 694 HG23 VAL 89 2HG2 VAL 89 1.565 -14.336 -6.663 695 H SER 90 H SER 90 1.744 -17.007 -10.010 696 HA SER 90 HA SER 90 2.176 -17.223 -12.625 697 HB2 SER 90 1HB SER 90 0.399 -19.024 -12.701 698 HB3 SER 90 2HB SER 90 1.573 -19.174 -11.397 699 HG SER 90 HG SER 90 0.051 -18.765 -9.986 700 HA PRO 91 HA PRO 91 -0.971 -14.418 -14.291 701 HB2 PRO 91 1HB PRO 91 -0.187 -14.403 -16.901 702 HB3 PRO 91 2HB PRO 91 0.691 -13.524 -15.634 703 HG2 PRO 91 1HG PRO 91 1.329 -16.148 -16.902 704 HG3 PRO 91 2HG PRO 91 2.417 -14.827 -16.435 705 HD2 PRO 91 1HD PRO 91 2.044 -17.110 -14.922 706 HD3 PRO 91 2HD PRO 91 2.565 -15.553 -14.241 707 H ASP 92 H ASP 92 -0.145 -17.126 -16.462 708 HA ASP 92 HA ASP 92 -1.477 -18.907 -17.177 709 HB2 ASP 92 1HB ASP 92 -2.979 -18.249 -15.086 710 HB3 ASP 92 2HB ASP 92 -4.023 -17.549 -16.321 711 H GLY 93 H GLY 93 -1.214 -15.848 -18.048 712 HA2 GLY 93 1HA GLY 93 -3.181 -15.784 -20.223 713 HA3 GLY 93 2HA GLY 93 -2.066 -14.494 -19.780 714 H GLU 94 H GLU 94 -2.162 -14.868 -22.371 715 HA GLU 94 HA GLU 94 0.331 -16.332 -23.012 716 HB2 GLU 94 1HB GLU 94 -0.646 -17.082 -25.122 717 HB3 GLU 94 2HB GLU 94 -1.594 -17.680 -23.763 718 HG2 GLU 94 1HG GLU 94 -3.166 -15.765 -24.069 719 HG3 GLU 94 2HG GLU 94 -2.252 -15.282 -25.497 720 H LEU 95 H LEU 95 -1.748 -13.576 -23.501 721 HA LEU 95 HA LEU 95 0.282 -12.367 -25.304 722 HB2 LEU 95 1HB LEU 95 -1.857 -12.672 -26.447 723 HB3 LEU 95 2HB LEU 95 -2.701 -11.853 -25.136 724 HG LEU 95 HG LEU 95 -1.518 -9.764 -25.632 725 HD11 LEU 95 1HD1 LEU 95 -0.173 -9.806 -27.886 726 HD12 LEU 95 2HD1 LEU 95 -0.011 -11.530 -27.555 727 HD13 LEU 95 3HD1 LEU 95 0.618 -10.347 -26.408 728 HD21 LEU 95 3HD2 LEU 95 -2.829 -11.166 -27.967 729 HD22 LEU 95 1HD2 LEU 95 -2.365 -9.465 -28.031 730 HD23 LEU 95 2HD2 LEU 95 -3.551 -10.011 -26.845 731 H TYR 96 H TYR 96 -1.442 -12.165 -22.341 732 HA TYR 96 HA TYR 96 0.070 -9.778 -21.594 733 HB2 TYR 96 1HB TYR 96 -2.213 -9.128 -22.649 734 HB3 TYR 96 2HB TYR 96 -2.910 -9.726 -21.144 735 HD1 TYR 96 HD1 TYR 96 -1.942 -8.803 -18.934 736 HD2 TYR 96 HD2 TYR 96 -1.291 -6.964 -22.758 737 HE1 TYR 96 HE1 TYR 96 -1.345 -6.675 -17.809 738 HE2 TYR 96 HE2 TYR 96 -0.692 -4.838 -21.637 739 HH TYR 96 HH TYR 96 0.295 -4.286 -19.155 740 H ILE 97 H ILE 97 0.449 -9.588 -19.451 741 HA ILE 97 HA ILE 97 0.211 -11.917 -17.832 742 HB ILE 97 HB ILE 97 0.918 -9.122 -16.927 743 HG12 ILE 97 1HG1 ILE 97 2.195 -9.632 -18.923 744 HG13 ILE 97 2HG1 ILE 97 3.258 -9.779 -17.522 745 HG21 ILE 97 1HG2 ILE 97 2.167 -11.662 -15.905 746 HG22 ILE 97 2HG2 ILE 97 0.577 -11.205 -15.312 747 HG23 ILE 97 3HG2 ILE 97 1.945 -10.118 -15.086 748 HD11 ILE 97 3HD1 ILE 97 2.069 -11.939 -19.243 749 HD12 ILE 97 1HD1 ILE 97 2.552 -12.304 -17.587 750 HD13 ILE 97 2HD1 ILE 97 3.746 -11.718 -18.743 751 H LEU 98 H LEU 98 -0.733 -8.748 -16.594 752 HA LEU 98 HA LEU 98 -2.717 -9.775 -14.878 753 HB2 LEU 98 1HB LEU 98 -2.740 -6.954 -15.964 754 HB3 LEU 98 2HB LEU 98 -3.174 -7.525 -14.355 755 HG LEU 98 HG LEU 98 -0.395 -7.412 -15.552 756 HD11 LEU 98 1HD1 LEU 98 -1.339 -6.112 -13.014 757 HD12 LEU 98 2HD1 LEU 98 -1.559 -5.319 -14.569 758 HD13 LEU 98 3HD1 LEU 98 0.061 -5.715 -14.001 759 HD21 LEU 98 3HD2 LEU 98 0.226 -8.185 -13.161 760 HD22 LEU 98 1HD2 LEU 98 -0.402 -9.400 -14.269 761 HD23 LEU 98 2HD2 LEU 98 -1.451 -8.714 -13.040 762 H GLY 99 H GLY 99 -3.135 -7.693 -17.713 763 HA2 GLY 99 1HA GLY 99 -4.933 -7.394 -19.134 764 HA3 GLY 99 2HA GLY 99 -4.930 -9.155 -19.202 765 H SER 100 H SER 100 -6.104 -6.424 -17.226 766 HA SER 100 HA SER 100 -8.074 -6.124 -16.091 767 HB2 SER 100 1HB SER 100 -9.179 -8.604 -17.391 768 HB3 SER 100 2HB SER 100 -10.028 -7.143 -16.902 769 HG SER 100 HG SER 100 -8.054 -7.292 -18.942 770 H ASP 101 H ASP 101 -6.391 -6.972 -14.437 771 HA ASP 101 HA ASP 101 -7.435 -8.132 -12.294 772 HB2 ASP 101 1HB ASP 101 -6.874 -10.292 -14.294 773 HB3 ASP 101 2HB ASP 101 -6.460 -10.628 -12.617 774 H VAL 102 H VAL 102 -5.791 -6.740 -11.500 775 HA VAL 102 HA VAL 102 -3.012 -7.363 -12.037 776 HB VAL 102 HB VAL 102 -4.113 -5.530 -9.922 777 HG11 VAL 102 1HG1 VAL 102 -1.666 -4.660 -11.260 778 HG12 VAL 102 2HG1 VAL 102 -1.451 -6.283 -10.616 779 HG13 VAL 102 3HG1 VAL 102 -1.933 -4.971 -9.549 780 HG21 VAL 102 3HG2 VAL 102 -3.646 -5.068 -12.875 781 HG22 VAL 102 1HG2 VAL 102 -3.802 -3.752 -11.711 782 HG23 VAL 102 2HG2 VAL 102 -5.149 -4.860 -11.978 783 H THR 103 H THR 103 -1.853 -8.809 -10.976 784 HA THR 103 HA THR 103 -2.751 -9.624 -8.253 785 HB THR 103 HB THR 103 -1.284 -11.451 -10.160 786 HG1 THR 103 HG1 THR 103 -4.033 -11.591 -9.594 787 HG21 THR 103 3HG2 THR 103 -1.103 -12.120 -7.848 788 HG22 THR 103 1HG2 THR 103 -2.326 -13.155 -8.590 789 HG23 THR 103 2HG2 THR 103 -2.816 -11.810 -7.566 790 H VAL 104 H VAL 104 -1.455 -8.919 -6.806 791 HA VAL 104 HA VAL 104 1.470 -8.972 -7.247 792 HB VAL 104 HB VAL 104 -0.269 -6.832 -5.979 793 HG11 VAL 104 1HG1 VAL 104 2.010 -5.749 -5.478 794 HG12 VAL 104 2HG1 VAL 104 2.694 -7.362 -5.692 795 HG13 VAL 104 3HG1 VAL 104 1.506 -7.068 -4.420 796 HG21 VAL 104 3HG2 VAL 104 1.833 -6.798 -8.165 797 HG22 VAL 104 1HG2 VAL 104 0.961 -5.387 -7.566 798 HG23 VAL 104 2HG2 VAL 104 0.090 -6.673 -8.400 799 H GLN 105 H GLN 105 2.545 -10.081 -5.727 800 HA GLN 105 HA GLN 105 1.152 -10.755 -3.187 801 HB2 GLN 105 1HB GLN 105 1.281 -12.745 -4.466 802 HB3 GLN 105 2HB GLN 105 2.905 -12.377 -5.030 803 HG2 GLN 105 1HG GLN 105 2.741 -14.159 -3.236 804 HG3 GLN 105 2HG GLN 105 3.857 -12.841 -2.894 805 HE21 GLN 105 2HE2 GLN 105 0.517 -13.937 -2.220 806 HE22 GLN 105 1HE2 GLN 105 0.399 -13.161 -0.715 807 H LEU 106 H LEU 106 2.086 -9.609 -1.550 808 HA LEU 106 HA LEU 106 4.818 -8.681 -1.747 809 HB2 LEU 106 1HB LEU 106 2.858 -8.498 0.548 810 HB3 LEU 106 2HB LEU 106 4.333 -7.553 0.347 811 HG LEU 106 HG LEU 106 1.954 -7.506 -1.536 812 HD11 LEU 106 1HD1 LEU 106 1.467 -5.329 -0.604 813 HD12 LEU 106 2HD1 LEU 106 2.924 -5.375 0.389 814 HD13 LEU 106 3HD1 LEU 106 1.588 -6.473 0.732 815 HD21 LEU 106 3HD2 LEU 106 4.664 -6.178 -1.542 816 HD22 LEU 106 1HD2 LEU 106 3.286 -5.352 -2.269 817 HD23 LEU 106 2HD2 LEU 106 3.788 -6.926 -2.878 818 H ASN 107 H ASN 107 6.360 -10.059 -1.373 819 HA ASN 107 HA ASN 107 6.045 -12.174 0.685 820 HB2 ASN 107 1HB ASN 107 8.384 -11.954 -1.181 821 HB3 ASN 107 2HB ASN 107 7.735 -13.379 -0.374 822 HD21 ASN 107 2HD2 ASN 107 6.405 -10.813 -2.523 823 HD22 ASN 107 1HD2 ASN 107 5.579 -11.890 -3.537 824 H THR 108 H THR 108 6.278 -10.194 2.276 825 HA THR 108 HA THR 108 9.015 -9.348 2.717 826 HB THR 108 HB THR 108 6.970 -8.988 4.867 827 HG1 THR 108 HG1 THR 108 6.057 -7.268 3.585 828 HG21 THR 108 3HG2 THR 108 8.942 -7.152 3.478 829 HG22 THR 108 1HG2 THR 108 9.141 -7.903 5.061 830 HG23 THR 108 2HG2 THR 108 7.896 -6.679 4.816 831 H ALA 109 H ALA 109 9.904 -9.575 5.012 832 HA ALA 109 HA ALA 109 10.517 -12.252 5.511 833 HB1 ALA 109 3HB ALA 109 10.824 -9.736 7.127 834 HB2 ALA 109 1HB ALA 109 12.063 -10.691 6.314 835 HB3 ALA 109 2HB ALA 109 11.314 -11.297 7.790 836 H GLU 110 H GLU 110 8.040 -10.198 7.052 837 HA GLU 110 HA GLU 110 6.953 -12.641 8.351 838 HB2 GLU 110 1HB GLU 110 6.459 -11.400 10.340 839 HB3 GLU 110 2HB GLU 110 8.155 -11.102 9.961 840 HG2 GLU 110 1HG GLU 110 7.424 -8.996 8.762 841 HG3 GLU 110 2HG GLU 110 5.804 -9.265 9.408 842 H LEU 111 H LEU 111 6.333 -10.913 5.872 843 HA LEU 111 HA LEU 111 3.438 -10.719 6.429 844 HB2 LEU 111 1HB LEU 111 4.756 -8.442 6.439 845 HB3 LEU 111 2HB LEU 111 4.747 -8.640 4.692 846 HG LEU 111 HG LEU 111 2.240 -8.746 6.401 847 HD11 LEU 111 1HD1 LEU 111 3.094 -6.443 4.649 848 HD12 LEU 111 2HD1 LEU 111 3.516 -6.509 6.359 849 HD13 LEU 111 3HD1 LEU 111 1.823 -6.481 5.870 850 HD21 LEU 111 3HD2 LEU 111 2.819 -8.840 3.440 851 HD22 LEU 111 1HD2 LEU 111 1.299 -8.146 4.007 852 HD23 LEU 111 2HD2 LEU 111 1.700 -9.814 4.389 853 H LYS 112 H LYS 112 2.313 -11.792 5.028 854 HA LYS 112 HA LYS 112 3.187 -12.038 2.251 855 HB2 LYS 112 1HB LYS 112 4.064 -14.045 3.646 856 HB3 LYS 112 2HB LYS 112 2.377 -14.558 3.687 857 HG2 LYS 112 1HG LYS 112 2.274 -14.579 1.251 858 HG3 LYS 112 2HG LYS 112 3.910 -13.931 1.141 859 HD2 LYS 112 1HD LYS 112 4.778 -15.951 2.273 860 HD3 LYS 112 2HD LYS 112 3.141 -16.607 2.335 861 HE2 LYS 112 1HE LYS 112 3.009 -16.538 -0.126 862 HE3 LYS 112 2HE LYS 112 4.641 -15.868 -0.198 863 HZ1 LYS 112 3HZ LYS 112 3.782 -18.573 0.608 864 HZ2 LYS 112 1HZ LYS 112 5.260 -17.945 1.159 865 HZ3 LYS 112 2HZ LYS 112 4.979 -18.117 -0.509 866 H LEU 113 H LEU 113 1.511 -11.224 1.216 867 HA LEU 113 HA LEU 113 -1.144 -12.400 1.668 868 HB2 LEU 113 1HB LEU 113 -0.461 -9.493 2.013 869 HB3 LEU 113 2HB LEU 113 -2.080 -9.990 1.555 870 HG LEU 113 HG LEU 113 -0.618 -11.010 3.995 871 HD11 LEU 113 1HD1 LEU 113 -0.964 -8.670 4.340 872 HD12 LEU 113 2HD1 LEU 113 -2.248 -9.495 5.222 873 HD13 LEU 113 3HD1 LEU 113 -2.589 -8.746 3.663 874 HD21 LEU 113 3HD2 LEU 113 -3.333 -11.482 2.805 875 HD22 LEU 113 1HD2 LEU 113 -3.217 -11.411 4.562 876 HD23 LEU 113 2HD2 LEU 113 -2.280 -12.601 3.667 877 H VAL 114 H VAL 114 -2.711 -11.656 -0.008 878 HA VAL 114 HA VAL 114 -1.361 -11.091 -2.602 879 HB VAL 114 HB VAL 114 -3.639 -12.992 -1.977 880 HG11 VAL 114 1HG1 VAL 114 -4.277 -11.951 -4.012 881 HG12 VAL 114 2HG1 VAL 114 -3.463 -13.435 -4.506 882 HG13 VAL 114 3HG1 VAL 114 -2.615 -11.890 -4.597 883 HG21 VAL 114 3HG2 VAL 114 -0.874 -13.370 -3.164 884 HG22 VAL 114 1HG2 VAL 114 -2.095 -14.637 -3.047 885 HG23 VAL 114 2HG2 VAL 114 -1.421 -13.927 -1.580 886 H PHE 115 H PHE 115 -2.096 -9.277 -3.557 887 HA PHE 115 HA PHE 115 -4.740 -8.223 -2.804 888 HB2 PHE 115 1HB PHE 115 -2.214 -6.752 -3.548 889 HB3 PHE 115 2HB PHE 115 -3.792 -5.981 -3.385 890 HD1 PHE 115 HD1 PHE 115 -1.043 -7.643 -1.613 891 HD2 PHE 115 HD2 PHE 115 -4.885 -5.757 -1.194 892 HE1 PHE 115 HE1 PHE 115 -0.730 -7.542 0.839 893 HE2 PHE 115 HE2 PHE 115 -4.581 -5.694 1.262 894 HZ PHE 115 HZ PHE 115 -2.495 -6.582 2.283 895 H GLN 116 H GLN 116 -6.157 -7.709 -4.341 896 HA GLN 116 HA GLN 116 -5.371 -8.108 -7.167 897 HB2 GLN 116 1HB GLN 116 -7.864 -8.773 -5.647 898 HB3 GLN 116 2HB GLN 116 -8.025 -8.345 -7.349 899 HG2 GLN 116 1HG GLN 116 -6.074 -10.441 -6.369 900 HG3 GLN 116 2HG GLN 116 -7.716 -10.825 -6.875 901 HE21 GLN 116 2HE2 GLN 116 -4.519 -10.100 -8.001 902 HE22 GLN 116 1HE2 GLN 116 -4.869 -10.131 -9.669 903 H LEU 117 H LEU 117 -4.687 -5.990 -7.508 904 HA LEU 117 HA LEU 117 -6.449 -3.758 -6.977 905 HB2 LEU 117 1HB LEU 117 -4.051 -3.534 -8.763 906 HB3 LEU 117 2HB LEU 117 -4.634 -2.413 -7.543 907 HG LEU 117 HG LEU 117 -3.251 -5.061 -7.036 908 HD11 LEU 117 1HD1 LEU 117 -1.730 -3.283 -7.742 909 HD12 LEU 117 2HD1 LEU 117 -1.520 -3.591 -6.018 910 HD13 LEU 117 3HD1 LEU 117 -2.431 -2.180 -6.556 911 HD21 LEU 117 3HD2 LEU 117 -4.753 -4.867 -5.235 912 HD22 LEU 117 1HD2 LEU 117 -4.668 -3.106 -5.225 913 HD23 LEU 117 2HD2 LEU 117 -3.316 -4.058 -4.613 914 HA PRO 118 HA PRO 118 -8.396 -3.878 -10.989 915 HB2 PRO 118 1HB PRO 118 -9.196 -1.327 -11.355 916 HB3 PRO 118 2HB PRO 118 -9.872 -2.332 -10.054 917 HG2 PRO 118 1HG PRO 118 -7.761 -0.229 -9.912 918 HG3 PRO 118 2HG PRO 118 -9.106 -0.544 -8.803 919 HD2 PRO 118 1HD PRO 118 -6.504 -1.395 -8.361 920 HD3 PRO 118 2HD PRO 118 -7.936 -2.173 -7.650 921 H PHE 119 H PHE 119 -7.484 -4.074 -12.950 922 HA PHE 119 HA PHE 119 -5.003 -3.158 -13.704 923 HB2 PHE 119 1HB PHE 119 -6.134 -5.070 -14.701 924 HB3 PHE 119 2HB PHE 119 -7.345 -4.005 -15.408 925 HD1 PHE 119 HD2 PHE 119 -3.672 -4.656 -15.324 926 HD2 PHE 119 HD1 PHE 119 -6.978 -3.028 -17.525 927 HE1 PHE 119 HE2 PHE 119 -2.201 -4.325 -17.287 928 HE2 PHE 119 HE1 PHE 119 -5.508 -2.698 -19.493 929 HZ PHE 119 HZ PHE 119 -3.116 -3.348 -19.375 930 H GLY 120 H GLY 120 -4.205 -1.526 -14.881 931 HA2 GLY 120 1HA GLY 120 -5.217 0.198 -16.653 932 HA3 GLY 120 2HA GLY 120 -5.859 0.860 -15.153 933 H SER 121 H SER 121 -4.278 2.478 -16.564 934 HA SER 121 HA SER 121 -1.501 2.315 -15.973 935 HB2 SER 121 1HB SER 121 -1.446 4.686 -16.604 936 HB3 SER 121 2HB SER 121 -2.436 3.783 -17.747 937 HG SER 121 HG SER 121 -4.259 4.562 -16.760 938 H HIS 122 H HIS 122 -4.287 3.057 -14.152 939 HA HIS 122 HA HIS 122 -3.196 4.812 -12.215 940 HB2 HIS 122 1HB HIS 122 -5.650 4.380 -12.605 941 HB3 HIS 122 2HB HIS 122 -5.439 2.824 -11.801 942 HD2 HIS 122 HD2 HIS 122 -5.434 2.969 -9.004 943 HE1 HIS 122 HE1 HIS 122 -5.306 7.176 -8.687 944 HE2 HIS 122 HE2 HIS 122 -5.545 5.012 -7.382 945 H THR 123 H THR 123 -3.513 1.232 -12.323 946 HA THR 123 HA THR 123 -2.301 0.910 -9.744 947 HB THR 123 HB THR 123 -2.620 -1.192 -11.885 948 HG1 THR 123 HG1 THR 123 -4.554 -1.482 -10.296 949 HG21 THR 123 3HG2 THR 123 -1.223 -1.510 -9.672 950 HG22 THR 123 1HG2 THR 123 -2.382 -2.746 -10.146 951 HG23 THR 123 2HG2 THR 123 -2.806 -1.570 -8.905 952 H ARG 124 H ARG 124 -1.209 0.575 -13.106 953 HA ARG 124 HA ARG 124 1.301 -0.514 -12.633 954 HB2 ARG 124 1HB ARG 124 0.320 -0.368 -14.858 955 HB3 ARG 124 2HB ARG 124 0.411 1.390 -14.808 956 HG2 ARG 124 1HG ARG 124 2.269 0.374 -16.114 957 HG3 ARG 124 2HG ARG 124 2.847 1.306 -14.739 958 HD2 ARG 124 1HD ARG 124 3.449 -0.610 -13.532 959 HD3 ARG 124 2HD ARG 124 2.355 -1.651 -14.438 960 HE ARG 124 HE ARG 124 4.116 -0.889 -16.341 961 HH11 ARG 124 1HH2 ARG 124 4.500 -2.058 -13.103 962 HH12 ARG 124 2HH2 ARG 124 6.001 -2.859 -13.424 963 HH21 ARG 124 1HH1 ARG 124 6.086 -1.941 -16.764 964 HH22 ARG 124 2HH1 ARG 124 6.898 -2.793 -15.493 965 H THR 125 H THR 125 0.225 2.824 -12.471 966 HA THR 125 HA THR 125 2.748 4.072 -12.370 967 HB THR 125 HB THR 125 0.154 4.892 -11.032 968 HG1 THR 125 HG1 THR 125 1.363 5.599 -13.500 969 HG21 THR 125 3HG2 THR 125 1.967 6.090 -10.002 970 HG22 THR 125 1HG2 THR 125 1.227 7.183 -11.172 971 HG23 THR 125 2HG2 THR 125 2.742 6.370 -11.562 972 H PHE 126 H PHE 126 0.686 2.726 -9.810 973 HA PHE 126 HA PHE 126 2.212 3.489 -7.597 974 HB2 PHE 126 1HB PHE 126 -0.055 2.474 -7.474 975 HB3 PHE 126 2HB PHE 126 0.642 0.919 -7.922 976 HD1 PHE 126 HD1 PHE 126 0.514 3.529 -5.295 977 HD2 PHE 126 HD2 PHE 126 1.951 -0.374 -6.350 978 HE1 PHE 126 HE1 PHE 126 1.105 3.112 -2.929 979 HE2 PHE 126 HE2 PHE 126 2.543 -0.796 -3.981 980 HZ PHE 126 HZ PHE 126 2.121 0.948 -2.269 981 H LEU 127 H LEU 127 2.412 0.415 -9.475 982 HA LEU 127 HA LEU 127 4.375 -0.863 -8.044 983 HB2 LEU 127 1HB LEU 127 4.273 -0.827 -11.067 984 HB3 LEU 127 2HB LEU 127 4.870 -2.120 -10.029 985 HG LEU 127 HG LEU 127 2.004 -1.149 -10.156 986 HD11 LEU 127 1HD1 LEU 127 2.905 -2.430 -12.160 987 HD12 LEU 127 2HD1 LEU 127 1.526 -3.174 -11.351 988 HD13 LEU 127 3HD1 LEU 127 3.153 -3.798 -11.074 989 HD21 LEU 127 3HD2 LEU 127 2.337 -1.998 -7.965 990 HD22 LEU 127 1HD2 LEU 127 3.432 -3.260 -8.524 991 HD23 LEU 127 2HD2 LEU 127 1.703 -3.379 -8.852 992 H GLN 128 H GLN 128 4.895 1.460 -10.740 993 HA GLN 128 HA GLN 128 7.675 1.254 -10.783 994 HB2 GLN 128 1HB GLN 128 5.796 3.454 -11.599 995 HB3 GLN 128 2HB GLN 128 7.529 3.470 -11.944 996 HG2 GLN 128 1HG GLN 128 7.381 1.446 -13.224 997 HG3 GLN 128 2HG GLN 128 5.722 1.163 -12.696 998 HE21 GLN 128 2HE2 GLN 128 4.041 2.467 -13.615 999 HE22 GLN 128 1HE2 GLN 128 4.304 3.379 -15.009 1000 H GLU 129 H GLU 129 5.565 3.438 -8.948 1001 HA GLU 129 HA GLU 129 7.600 5.122 -7.969 1002 HB2 GLU 129 1HB GLU 129 5.137 5.592 -7.879 1003 HB3 GLU 129 2HB GLU 129 5.014 4.417 -6.568 1004 HG2 GLU 129 1HG GLU 129 5.233 6.594 -5.558 1005 HG3 GLU 129 2HG GLU 129 6.763 5.756 -5.323 1006 H VAL 130 H VAL 130 6.284 2.067 -6.740 1007 HA VAL 130 HA VAL 130 7.591 2.118 -4.238 1008 HB VAL 130 HB VAL 130 6.669 -0.196 -5.957 1009 HG11 VAL 130 1HG1 VAL 130 8.333 -1.109 -4.502 1010 HG12 VAL 130 2HG1 VAL 130 6.783 -1.445 -3.730 1011 HG13 VAL 130 3HG1 VAL 130 7.789 -0.119 -3.147 1012 HG21 VAL 130 3HG2 VAL 130 4.735 -0.192 -4.548 1013 HG22 VAL 130 1HG2 VAL 130 5.000 1.490 -5.010 1014 HG23 VAL 130 2HG2 VAL 130 5.484 0.928 -3.409 1015 H ALA 131 H ALA 131 8.512 0.692 -7.342 1016 HA ALA 131 HA ALA 131 10.877 -0.563 -6.676 1017 HB1 ALA 131 3HB ALA 131 9.808 -0.642 -8.911 1018 HB2 ALA 131 1HB ALA 131 11.538 -0.308 -9.001 1019 HB3 ALA 131 2HB ALA 131 10.374 1.001 -9.215 1020 H ARG 132 H ARG 132 10.433 2.884 -7.439 1021 HA ARG 132 HA ARG 132 13.258 3.452 -7.202 1022 HB2 ARG 132 1HB ARG 132 10.839 5.261 -7.379 1023 HB3 ARG 132 2HB ARG 132 12.509 5.832 -7.361 1024 HG2 ARG 132 1HG ARG 132 13.007 4.559 -9.385 1025 HG3 ARG 132 2HG ARG 132 11.382 3.874 -9.383 1026 HD2 ARG 132 1HD ARG 132 11.461 5.721 -10.965 1027 HD3 ARG 132 2HD ARG 132 10.450 6.177 -9.596 1028 HE ARG 132 HE ARG 132 13.130 7.001 -9.137 1029 HH11 ARG 132 1HH2 ARG 132 10.329 7.672 -11.054 1030 HH12 ARG 132 2HH2 ARG 132 10.691 9.355 -11.243 1031 HH21 ARG 132 1HH1 ARG 132 13.613 9.209 -9.382 1032 HH22 ARG 132 2HH1 ARG 132 12.549 10.225 -10.298 1033 H ALA 133 H ALA 133 10.620 3.142 -5.053 1034 HA ALA 133 HA ALA 133 11.281 4.939 -3.015 1035 HB1 ALA 133 3HB ALA 133 9.822 3.709 -1.639 1036 HB2 ALA 133 1HB ALA 133 10.136 2.204 -2.498 1037 HB3 ALA 133 2HB ALA 133 9.194 3.481 -3.267 1038 H CYS 134 H CYS 134 12.901 2.047 -3.983 1039 HA CYS 134 HA CYS 134 15.205 2.389 -2.609 1040 HB2 CYS 134 1HB CYS 134 13.113 1.486 -0.723 1041 HB3 CYS 134 2HB CYS 134 14.589 0.536 -0.652 1042 HG CYS 134 HG CYS 134 15.923 2.706 -0.109 1043 HA PRO 135 HA PRO 135 14.555 -2.448 -3.343 1044 HB2 PRO 135 1HB PRO 135 12.451 -2.095 -5.453 1045 HB3 PRO 135 2HB PRO 135 12.665 -3.412 -4.279 1046 HG2 PRO 135 1HG PRO 135 10.783 -1.572 -3.928 1047 HG3 PRO 135 2HG PRO 135 11.708 -2.203 -2.552 1048 HD2 PRO 135 1HD PRO 135 11.969 0.444 -3.939 1049 HD3 PRO 135 2HD PRO 135 12.173 0.047 -2.221 1050 H GLY 136 H GLY 136 13.870 -0.171 -6.012 1051 HA2 GLY 136 1HA GLY 136 14.858 -0.910 -8.264 1052 HA3 GLY 136 2HA GLY 136 15.514 0.570 -7.583 1053 H PHE 137 H PHE 137 15.998 -2.888 -7.872 1054 HA PHE 137 HA PHE 137 18.050 -3.946 -6.879 1055 HB2 PHE 137 1HB PHE 137 18.085 -3.319 -9.831 1056 HB3 PHE 137 2HB PHE 137 19.201 -4.448 -9.064 1057 HD1 PHE 137 HD2 PHE 137 15.669 -3.794 -9.914 1058 HD2 PHE 137 HD1 PHE 137 18.448 -6.599 -8.218 1059 HE1 PHE 137 HE2 PHE 137 13.940 -5.569 -10.011 1060 HE2 PHE 137 HE1 PHE 137 16.717 -8.373 -8.313 1061 HZ PHE 137 HZ PHE 137 14.462 -7.857 -9.211 1062 H ASP 138 H ASP 138 18.912 -2.186 -5.545 1063 HA ASP 138 HA ASP 138 21.093 -0.659 -6.807 1064 HB2 ASP 138 1HB ASP 138 19.264 -0.224 -4.543 1065 HB3 ASP 138 2HB ASP 138 20.932 0.152 -4.135 1066 HA PRO 139 HA PRO 139 24.380 -3.055 -5.104 1067 HB2 PRO 139 1HB PRO 139 25.257 -0.753 -3.396 1068 HB3 PRO 139 2HB PRO 139 26.192 -1.715 -4.558 1069 HG2 PRO 139 1HG PRO 139 25.382 0.747 -5.156 1070 HG3 PRO 139 2HG PRO 139 25.387 -0.540 -6.378 1071 HD2 PRO 139 1HD PRO 139 23.063 0.653 -4.908 1072 HD3 PRO 139 2HD PRO 139 23.164 0.050 -6.576 1073 H GLU 140 H GLU 140 22.884 -1.025 -2.555 1074 HA GLU 140 HA GLU 140 22.736 -3.415 -0.812 1075 HB2 GLU 140 1HB GLU 140 23.747 -0.671 -0.047 1076 HB3 GLU 140 2HB GLU 140 23.320 -1.929 1.118 1077 HG2 GLU 140 1HG GLU 140 24.963 -3.443 0.127 1078 HG3 GLU 140 2HG GLU 140 25.351 -2.247 -1.106 1079 H THR 141 H THR 141 20.788 -1.987 -2.506 1080 HA THR 141 HA THR 141 18.706 -0.976 -2.393 1081 HB THR 141 HB THR 141 17.167 -2.297 -1.205 1082 HG1 THR 141 HG1 THR 141 19.032 -2.124 0.697 1083 HG21 THR 141 3HG2 THR 141 18.566 -3.554 -2.863 1084 HG22 THR 141 1HG2 THR 141 17.901 -4.571 -1.586 1085 HG23 THR 141 2HG2 THR 141 19.594 -4.079 -1.530 1086 H ARG 142 H ARG 142 20.887 0.238 -0.634 1087 HA ARG 142 HA ARG 142 20.924 2.203 0.585 1088 HB2 ARG 142 1HB ARG 142 18.445 2.395 -0.333 1089 HB3 ARG 142 2HB ARG 142 18.017 1.972 1.321 1090 HG2 ARG 142 1HG ARG 142 18.110 4.289 1.501 1091 HG3 ARG 142 2HG ARG 142 19.767 3.874 1.937 1092 HD2 ARG 142 1HD ARG 142 20.428 4.225 -0.454 1093 HD3 ARG 142 2HD ARG 142 18.784 4.752 -0.795 1094 HE ARG 142 HE ARG 142 19.815 6.276 1.355 1095 HH11 ARG 142 1HH2 ARG 142 20.191 5.742 -2.039 1096 HH12 ARG 142 2HH2 ARG 142 20.749 7.347 -2.375 1097 HH21 ARG 142 1HH1 ARG 142 20.552 8.397 0.921 1098 HH22 ARG 142 2HH1 ARG 142 20.954 8.847 -0.703 1099 H ASP 143 H ASP 143 19.058 2.520 2.889 1100 HA ASP 143 HA ASP 143 19.647 0.297 4.671 1101 HB2 ASP 143 1HB ASP 143 21.751 1.734 4.544 1102 HB3 ASP 143 2HB ASP 143 20.818 2.991 5.352 1103 HA PRO 144 HA PRO 144 15.644 2.435 5.615 1104 HB2 PRO 144 1HB PRO 144 15.377 -0.116 7.173 1105 HB3 PRO 144 2HB PRO 144 14.195 0.692 6.123 1106 HG2 PRO 144 1HG PRO 144 15.485 -1.478 5.300 1107 HG3 PRO 144 2HG PRO 144 15.151 -0.135 4.188 1108 HD2 PRO 144 1HD PRO 144 17.743 -0.889 5.501 1109 HD3 PRO 144 2HD PRO 144 17.458 -0.206 3.885 1110 H GLU 145 H GLU 145 14.555 1.911 8.137 1111 HA GLU 145 HA GLU 145 16.325 2.010 10.302 1112 HB2 GLU 145 1HB GLU 145 16.256 4.385 10.914 1113 HB3 GLU 145 2HB GLU 145 17.066 4.174 9.366 1114 HG2 GLU 145 1HG GLU 145 14.920 4.728 8.216 1115 HG3 GLU 145 2HG GLU 145 14.195 5.041 9.791 1116 H PHE 146 H PHE 146 13.273 3.178 8.950 1117 HA PHE 146 HA PHE 146 11.133 3.196 9.788 1118 HB2 PHE 146 1HB PHE 146 11.974 1.116 11.796 1119 HB3 PHE 146 2HB PHE 146 10.449 1.263 10.918 1120 HD1 PHE 146 HD2 PHE 146 10.952 1.434 8.191 1121 HD2 PHE 146 HD1 PHE 146 13.269 -0.707 11.104 1122 HE1 PHE 146 HE2 PHE 146 11.811 -0.057 6.415 1123 HE2 PHE 146 HE1 PHE 146 14.130 -2.194 9.325 1124 HZ PHE 146 HZ PHE 146 13.399 -1.875 6.978 1125 H GLU 147 H GLU 147 13.671 4.324 11.369 1126 HA GLU 147 HA GLU 147 12.842 4.647 14.045 1127 HB2 GLU 147 1HB GLU 147 15.163 4.961 13.258 1128 HB3 GLU 147 2HB GLU 147 14.662 6.424 12.411 1129 HG2 GLU 147 1HG GLU 147 13.983 7.454 14.522 1130 HG3 GLU 147 2HG GLU 147 14.373 5.974 15.395 1131 H TRP 148 H TRP 148 12.321 6.687 11.173 1132 HA TRP 148 HA TRP 148 11.141 8.817 12.672 1133 HB2 TRP 148 1HB TRP 148 10.491 9.740 10.505 1134 HB3 TRP 148 2HB TRP 148 12.176 9.230 10.492 1135 HD1 TRP 148 HD1 TRP 148 12.619 6.719 9.384 1136 HE1 TRP 148 HE1 TRP 148 11.491 5.677 7.311 1137 HE3 TRP 148 HE3 TRP 148 8.406 9.593 9.131 1138 HZ2 TRP 148 HZ2 TRP 148 9.119 6.018 5.754 1139 HZ3 TRP 148 HZ3 TRP 148 6.729 9.213 7.345 1140 HH2 TRP 148 HH2 TRP 148 7.076 7.426 5.654 1141 H LEU 149 H LEU 149 9.965 5.837 11.386 1142 HA LEU 149 HA LEU 149 7.224 6.558 11.185 1143 HB2 LEU 149 1HB LEU 149 8.532 3.870 11.634 1144 HB3 LEU 149 2HB LEU 149 6.810 4.092 11.340 1145 HG LEU 149 HG LEU 149 8.977 5.080 9.459 1146 HD11 LEU 149 1HD1 LEU 149 8.892 2.565 9.733 1147 HD12 LEU 149 2HD1 LEU 149 8.560 3.140 8.100 1148 HD13 LEU 149 3HD1 LEU 149 7.233 2.625 9.141 1149 HD21 LEU 149 3HD2 LEU 149 6.856 4.908 7.882 1150 HD22 LEU 149 1HD2 LEU 149 7.053 6.313 8.921 1151 HD23 LEU 149 2HD2 LEU 149 5.959 5.015 9.394 1152 H SER 150 H SER 150 9.266 5.488 13.865 1153 HA SER 150 HA SER 150 7.424 4.718 15.738 1154 HB2 SER 150 1HB SER 150 8.995 5.535 17.426 1155 HB3 SER 150 2HB SER 150 9.865 4.755 16.108 1156 HG SER 150 HG SER 150 9.657 7.468 16.785 1157 H ARG 151 H ARG 151 7.898 7.884 14.381 1158 HA ARG 151 HA ARG 151 6.695 9.450 16.417 1159 HB2 ARG 151 1HB ARG 151 7.087 9.780 13.457 1160 HB3 ARG 151 2HB ARG 151 5.963 10.863 14.264 1161 HG2 ARG 151 1HG ARG 151 8.192 11.863 14.220 1162 HG3 ARG 151 2HG ARG 151 7.738 11.481 15.880 1163 HD2 ARG 151 1HD ARG 151 9.048 9.407 15.780 1164 HD3 ARG 151 2HD ARG 151 9.473 9.742 14.103 1165 HE ARG 151 HE ARG 151 10.602 10.998 16.463 1166 HH11 ARG 151 1HH2 ARG 151 10.013 11.142 13.059 1167 HH12 ARG 151 2HH2 ARG 151 11.289 12.270 12.744 1168 HH21 ARG 151 1HH1 ARG 151 12.278 12.475 16.064 1169 HH22 ARG 151 2HH1 ARG 151 12.572 13.027 14.448 1170 H HIS 152 H HIS 152 5.401 7.540 13.782 1171 HA HIS 152 HA HIS 152 2.664 8.294 14.176 1172 HB2 HIS 152 1HB HIS 152 3.759 5.818 12.822 1173 HB3 HIS 152 2HB HIS 152 2.175 6.555 12.574 1174 HD2 HIS 152 HD2 HIS 152 3.657 9.704 12.448 1175 HE1 HIS 152 HE1 HIS 152 5.231 8.122 8.867 1176 HE2 HIS 152 HE2 HIS 152 4.804 10.255 10.170 1177 H THR 153 H THR 153 1.077 7.223 15.286 1178 HA THR 153 HA THR 153 1.910 4.976 17.047 1179 HB THR 153 HB THR 153 1.526 7.041 18.343 1180 HG1 THR 153 HG1 THR 153 -0.136 6.149 19.679 1181 HG21 THR 153 3HG2 THR 153 -1.271 6.927 17.182 1182 HG22 THR 153 1HG2 THR 153 -0.044 8.120 16.759 1183 HG23 THR 153 2HG2 THR 153 -0.696 8.067 18.396 1184 H CYS 154 H CYS 154 0.164 5.882 14.454 1185 HA CYS 154 HA CYS 154 -1.573 5.013 13.256 1186 HB2 CYS 154 1HB CYS 154 -1.605 2.702 13.082 1187 HB3 CYS 154 2HB CYS 154 -0.037 2.947 13.844 1188 HG CYS 154 HG CYS 154 -0.848 1.649 15.786 1189 H ALA 155 H ALA 155 -3.811 4.537 13.307 1190 HA ALA 155 HA ALA 155 -5.215 5.709 15.435 1191 HB1 ALA 155 3HB ALA 155 -6.355 3.703 13.481 1192 HB2 ALA 155 1HB ALA 155 -6.046 5.391 13.068 1193 HB3 ALA 155 2HB ALA 155 -7.214 4.990 14.327 1194 H GLU 156 H GLU 156 -7.113 4.402 16.498 1195 HA GLU 156 HA GLU 156 -6.161 1.786 17.487 1196 HB2 GLU 156 1HB GLU 156 -6.993 4.127 19.209 1197 HB3 GLU 156 2HB GLU 156 -6.716 2.486 19.796 1198 HG2 GLU 156 1HG GLU 156 -4.390 2.622 18.828 1199 HG3 GLU 156 2HG GLU 156 -4.691 4.327 18.498 1200 HA PRO 157 HA PRO 157 -10.552 1.366 16.180 1201 HB2 PRO 157 1HB PRO 157 -9.915 -1.398 17.167 1202 HB3 PRO 157 2HB PRO 157 -10.781 -0.898 15.697 1203 HG2 PRO 157 1HG PRO 157 -8.272 -1.731 15.562 1204 HG3 PRO 157 2HG PRO 157 -8.833 -0.370 14.573 1205 HD2 PRO 157 1HD PRO 157 -7.114 -0.327 17.029 1206 HD3 PRO 157 2HD PRO 157 -7.071 0.737 15.605 1207 H ASP 158 H ASP 158 -12.487 0.435 17.331 1208 HA ASP 158 HA ASP 158 -12.252 0.425 20.273 1209 HB2 ASP 158 1HB ASP 158 -12.782 2.752 19.572 1210 HB3 ASP 158 2HB ASP 158 -14.223 2.152 18.753 1211 H ALA 159 H ALA 159 -12.556 -1.897 19.252 1212 HA ALA 159 HA ALA 159 -15.094 -2.698 18.328 1213 HB1 ALA 159 3HB ALA 159 -13.074 -4.326 19.888 1214 HB2 ALA 159 1HB ALA 159 -13.050 -4.086 18.141 1215 HB3 ALA 159 2HB ALA 159 -14.382 -4.964 18.893 1216 H GLU 160 H GLU 160 -13.766 -2.330 21.572 1217 HA GLU 160 HA GLU 160 -15.834 -3.620 22.988 1218 HB2 GLU 160 1HB GLU 160 -13.965 -1.385 23.801 1219 HB3 GLU 160 2HB GLU 160 -15.038 -2.229 24.919 1220 HG2 GLU 160 1HG GLU 160 -13.963 -4.363 24.383 1221 HG3 GLU 160 2HG GLU 160 -12.926 -3.563 23.203 1222 H SER 161 H SER 161 -15.465 -0.287 21.846 1223 HA SER 161 HA SER 161 -16.929 1.484 21.800 1224 HB2 SER 161 1HB SER 161 -18.132 0.046 20.256 1225 HB3 SER 161 2HB SER 161 -18.886 -0.818 21.593 1226 HG SER 161 HG SER 161 -19.791 1.249 22.209 Start of MODEL 10 1 H1 GLY 1 1H GLY 1 -19.113 15.921 -9.292 2 H2 GLY 1 2H GLY 1 -20.314 16.915 -9.964 3 H3 GLY 1 3H GLY 1 -19.549 17.365 -8.516 4 HA2 GLY 1 1HA GLY 1 -18.853 18.265 -10.952 5 HA3 GLY 1 2HA GLY 1 -17.785 18.240 -9.547 6 HA PRO 2 HA PRO 2 -15.060 15.387 -11.451 7 HB2 PRO 2 1HB PRO 2 -14.692 13.397 -9.568 8 HB3 PRO 2 2HB PRO 2 -13.980 15.017 -9.441 9 HG2 PRO 2 1HG PRO 2 -16.449 13.936 -8.146 10 HG3 PRO 2 2HG PRO 2 -15.170 14.953 -7.456 11 HD2 PRO 2 1HD PRO 2 -17.539 16.000 -8.247 12 HD3 PRO 2 2HD PRO 2 -16.017 16.907 -8.419 13 H LEU 3 H LEU 3 -15.059 13.617 -12.809 14 HA LEU 3 HA LEU 3 -17.512 12.398 -13.472 15 HB2 LEU 3 1HB LEU 3 -14.660 11.698 -14.187 16 HB3 LEU 3 2HB LEU 3 -16.056 10.871 -14.874 17 HG LEU 3 HG LEU 3 -15.659 13.876 -15.001 18 HD11 LEU 3 1HD1 LEU 3 -13.864 13.003 -16.277 19 HD12 LEU 3 2HD1 LEU 3 -15.127 13.328 -17.463 20 HD13 LEU 3 3HD1 LEU 3 -14.845 11.678 -16.908 21 HD21 LEU 3 3HD2 LEU 3 -17.284 13.375 -17.050 22 HD22 LEU 3 1HD2 LEU 3 -17.932 13.536 -15.423 23 HD23 LEU 3 2HD2 LEU 3 -17.680 11.935 -16.115 24 H GLY 4 H GLY 4 -14.766 11.300 -11.543 25 HA2 GLY 4 1HA GLY 4 -16.432 9.045 -10.554 26 HA3 GLY 4 2HA GLY 4 -14.729 8.827 -10.953 27 H SER 5 H SER 5 -16.766 9.213 -8.452 28 HA SER 5 HA SER 5 -15.325 11.082 -6.818 29 HB2 SER 5 1HB SER 5 -16.785 10.269 -5.013 30 HB3 SER 5 2HB SER 5 -17.717 10.631 -6.462 31 HG SER 5 HG SER 5 -17.678 8.387 -5.148 32 H MET 6 H MET 6 -15.890 8.532 -4.828 33 HA MET 6 HA MET 6 -14.518 7.129 -3.634 34 HB2 MET 6 1HB MET 6 -13.346 6.785 -6.403 35 HB3 MET 6 2HB MET 6 -12.871 5.811 -5.014 36 HG2 MET 6 1HG MET 6 -15.154 5.012 -4.730 37 HG3 MET 6 2HG MET 6 -15.716 6.072 -6.022 38 HE1 MET 6 3HE MET 6 -12.272 3.752 -6.089 39 HE2 MET 6 1HE MET 6 -13.235 2.274 -6.216 40 HE3 MET 6 2HE MET 6 -13.488 3.379 -4.869 41 H ASP 7 H ASP 7 -12.048 8.214 -5.939 42 HA ASP 7 HA ASP 7 -10.011 9.199 -5.623 43 HB2 ASP 7 1HB ASP 7 -11.677 10.791 -3.663 44 HB3 ASP 7 2HB ASP 7 -10.044 11.217 -4.165 45 H GLN 8 H GLN 8 -9.093 7.291 -4.783 46 HA GLN 8 HA GLN 8 -9.052 6.653 -1.997 47 HB2 GLN 8 1HB GLN 8 -7.560 5.748 -4.436 48 HB3 GLN 8 2HB GLN 8 -6.819 5.407 -2.872 49 HG2 GLN 8 1HG GLN 8 -8.299 3.577 -3.713 50 HG3 GLN 8 2HG GLN 8 -8.768 4.198 -2.135 51 HE21 GLN 8 2HE2 GLN 8 -9.432 5.968 -5.138 52 HE22 GLN 8 1HE2 GLN 8 -11.108 5.754 -5.089 53 H SER 9 H SER 9 -6.675 8.202 -4.136 54 HA SER 9 HA SER 9 -4.655 8.700 -2.308 55 HB2 SER 9 1HB SER 9 -3.970 10.566 -3.735 56 HB3 SER 9 2HB SER 9 -4.439 9.176 -4.706 57 HG SER 9 HG SER 9 -5.312 11.372 -5.247 58 H VAL 10 H VAL 10 -7.538 10.694 -2.913 59 HA VAL 10 HA VAL 10 -6.852 12.821 -1.207 60 HB VAL 10 HB VAL 10 -9.560 11.690 -1.952 61 HG11 VAL 10 1HG1 VAL 10 -9.934 13.007 -0.019 62 HG12 VAL 10 2HG1 VAL 10 -10.285 14.081 -1.371 63 HG13 VAL 10 3HG1 VAL 10 -8.748 14.216 -0.514 64 HG21 VAL 10 3HG2 VAL 10 -8.052 14.093 -3.031 65 HG22 VAL 10 1HG2 VAL 10 -9.571 13.437 -3.643 66 HG23 VAL 10 2HG2 VAL 10 -8.077 12.512 -3.816 67 H ALA 11 H ALA 11 -8.775 9.907 -0.601 68 HA ALA 11 HA ALA 11 -9.539 10.261 1.988 69 HB1 ALA 11 3HB ALA 11 -9.717 7.910 2.222 70 HB2 ALA 11 1HB ALA 11 -8.402 7.620 1.080 71 HB3 ALA 11 2HB ALA 11 -9.955 8.224 0.502 72 H ILE 12 H ILE 12 -6.350 9.049 0.929 73 HA ILE 12 HA ILE 12 -5.315 8.591 3.490 74 HB ILE 12 HB ILE 12 -3.796 9.490 1.043 75 HG12 ILE 12 1HG1 ILE 12 -5.228 7.602 0.472 76 HG13 ILE 12 2HG1 ILE 12 -3.565 7.040 0.598 77 HG21 ILE 12 1HG2 ILE 12 -2.355 9.529 2.946 78 HG22 ILE 12 2HG2 ILE 12 -2.023 8.008 2.119 79 HG23 ILE 12 3HG2 ILE 12 -3.024 8.020 3.569 80 HD11 ILE 12 3HD1 ILE 12 -4.703 5.403 1.808 81 HD12 ILE 12 1HD1 ILE 12 -5.875 6.551 2.452 82 HD13 ILE 12 2HD1 ILE 12 -4.237 6.510 3.096 83 H GLN 13 H GLN 13 -4.883 11.361 1.380 84 HA GLN 13 HA GLN 13 -3.378 13.003 3.032 85 HB2 GLN 13 1HB GLN 13 -5.181 13.468 0.735 86 HB3 GLN 13 2HB GLN 13 -5.018 14.870 1.789 87 HG2 GLN 13 1HG GLN 13 -2.654 13.315 0.711 88 HG3 GLN 13 2HG GLN 13 -3.307 14.756 -0.066 89 HE21 GLN 13 2HE2 GLN 13 -0.886 13.832 2.032 90 HE22 GLN 13 1HE2 GLN 13 -0.727 15.270 2.915 91 H GLU 14 H GLU 14 -6.945 12.837 2.916 92 HA GLU 14 HA GLU 14 -7.347 14.705 5.010 93 HB2 GLU 14 1HB GLU 14 -9.091 12.496 3.901 94 HB3 GLU 14 2HB GLU 14 -9.643 13.695 5.071 95 HG2 GLU 14 1HG GLU 14 -9.151 15.506 3.521 96 HG3 GLU 14 2HG GLU 14 -8.454 14.369 2.366 97 H THR 15 H THR 15 -6.441 11.397 4.950 98 HA THR 15 HA THR 15 -7.037 11.065 7.846 99 HB THR 15 HB THR 15 -6.951 8.693 7.495 100 HG1 THR 15 HG1 THR 15 -6.665 8.384 4.941 101 HG21 THR 15 3HG2 THR 15 -8.641 10.343 5.679 102 HG22 THR 15 1HG2 THR 15 -9.120 9.119 6.855 103 HG23 THR 15 2HG2 THR 15 -8.519 8.639 5.269 104 H LEU 16 H LEU 16 -4.586 12.321 6.319 105 HA LEU 16 HA LEU 16 -2.476 10.611 7.466 106 HB2 LEU 16 1HB LEU 16 -2.439 11.507 5.045 107 HB3 LEU 16 2HB LEU 16 -2.059 13.066 5.763 108 HG LEU 16 HG LEU 16 -0.106 11.979 6.934 109 HD11 LEU 16 1HD1 LEU 16 -0.470 9.676 7.027 110 HD12 LEU 16 2HD1 LEU 16 0.596 9.770 5.635 111 HD13 LEU 16 3HD1 LEU 16 -1.145 9.605 5.400 112 HD21 LEU 16 3HD2 LEU 16 -0.213 11.835 3.904 113 HD22 LEU 16 1HD2 LEU 16 1.272 11.824 4.854 114 HD23 LEU 16 2HD2 LEU 16 0.226 13.243 4.871 115 H VAL 17 H VAL 17 -1.118 13.524 7.190 116 HA VAL 17 HA VAL 17 -2.083 14.855 9.539 117 HB VAL 17 HB VAL 17 -0.867 13.242 10.785 118 HG11 VAL 17 1HG1 VAL 17 1.103 13.456 8.525 119 HG12 VAL 17 2HG1 VAL 17 0.442 12.020 9.297 120 HG13 VAL 17 3HG1 VAL 17 1.689 12.960 10.113 121 HG21 VAL 17 3HG2 VAL 17 0.749 14.579 11.898 122 HG22 VAL 17 1HG2 VAL 17 -0.363 15.751 11.190 123 HG23 VAL 17 2HG2 VAL 17 1.190 15.429 10.417 124 H GLU 18 H GLU 18 -1.427 16.989 9.536 125 HA GLU 18 HA GLU 18 -0.414 18.036 7.129 126 HB2 GLU 18 1HB GLU 18 -0.789 19.252 9.867 127 HB3 GLU 18 2HB GLU 18 -0.343 20.180 8.434 128 HG2 GLU 18 1HG GLU 18 -2.387 19.493 7.301 129 HG3 GLU 18 2HG GLU 18 -2.815 18.441 8.649 130 H GLY 19 H GLY 19 1.616 17.702 6.464 131 HA2 GLY 19 1HA GLY 19 3.850 18.920 6.994 132 HA3 GLY 19 2HA GLY 19 3.841 17.878 8.410 133 H GLU 20 H GLU 20 2.413 16.272 5.812 134 HA GLU 20 HA GLU 20 4.990 15.002 5.052 135 HB2 GLU 20 1HB GLU 20 2.355 13.704 5.752 136 HB3 GLU 20 2HB GLU 20 3.602 12.870 4.827 137 HG2 GLU 20 1HG GLU 20 4.041 12.240 7.059 138 HG3 GLU 20 2HG GLU 20 5.205 13.522 6.757 139 H TYR 21 H TYR 21 4.317 13.347 3.159 140 HA TYR 21 HA TYR 21 2.891 14.921 1.079 141 HB2 TYR 21 1HB TYR 21 5.418 15.168 1.031 142 HB3 TYR 21 2HB TYR 21 5.485 13.448 0.656 143 HD1 TYR 21 HD2 TYR 21 4.131 16.711 -0.520 144 HD2 TYR 21 HD1 TYR 21 5.072 12.645 -1.523 145 HE1 TYR 21 HE2 TYR 21 3.722 17.209 -2.915 146 HE2 TYR 21 HE1 TYR 21 4.665 13.136 -3.914 147 HH TYR 21 HH TYR 21 4.112 16.413 -5.046 148 H CYS 22 H CYS 22 1.404 13.772 0.069 149 HA CYS 22 HA CYS 22 1.487 10.828 0.225 150 HB2 CYS 22 1HB CYS 22 -0.818 10.839 -0.308 151 HB3 CYS 22 2HB CYS 22 -0.620 12.188 0.807 152 HG CYS 22 HG CYS 22 -0.834 13.841 -1.157 153 H VAL 23 H VAL 23 1.596 9.579 -1.685 154 HA VAL 23 HA VAL 23 2.397 11.078 -4.108 155 HB VAL 23 HB VAL 23 3.158 8.284 -3.231 156 HG11 VAL 23 1HG1 VAL 23 3.176 8.576 -5.667 157 HG12 VAL 23 2HG1 VAL 23 4.828 8.500 -5.058 158 HG13 VAL 23 3HG1 VAL 23 4.122 10.054 -5.500 159 HG21 VAL 23 3HG2 VAL 23 5.393 9.328 -2.838 160 HG22 VAL 23 1HG2 VAL 23 4.149 9.950 -1.753 161 HG23 VAL 23 2HG2 VAL 23 4.673 10.910 -3.137 162 H ILE 24 H ILE 24 0.788 8.106 -2.970 163 HA ILE 24 HA ILE 24 -1.257 8.305 -4.963 164 HB ILE 24 HB ILE 24 0.531 7.585 -6.424 165 HG12 ILE 24 1HG1 ILE 24 -1.123 5.119 -5.829 166 HG13 ILE 24 2HG1 ILE 24 -1.783 6.534 -6.649 167 HG21 ILE 24 1HG2 ILE 24 0.922 5.369 -4.398 168 HG22 ILE 24 2HG2 ILE 24 2.070 6.638 -4.825 169 HG23 ILE 24 3HG2 ILE 24 1.662 5.385 -5.999 170 HD11 ILE 24 3HD1 ILE 24 -0.773 4.564 -8.058 171 HD12 ILE 24 1HD1 ILE 24 0.771 5.299 -7.640 172 HD13 ILE 24 2HD1 ILE 24 -0.435 6.228 -8.528 173 H ALA 25 H ALA 25 -2.658 6.329 -4.970 174 HA ALA 25 HA ALA 25 -2.439 4.423 -2.848 175 HB1 ALA 25 3HB ALA 25 -4.173 5.156 -1.411 176 HB2 ALA 25 1HB ALA 25 -4.701 6.395 -2.547 177 HB3 ALA 25 2HB ALA 25 -3.179 6.587 -1.679 178 H VAL 26 H VAL 26 -3.117 2.716 -3.971 179 HA VAL 26 HA VAL 26 -5.616 2.963 -5.561 180 HB VAL 26 HB VAL 26 -4.725 1.298 -7.070 181 HG11 VAL 26 1HG1 VAL 26 -2.464 3.251 -6.621 182 HG12 VAL 26 2HG1 VAL 26 -4.036 3.798 -7.203 183 HG13 VAL 26 3HG1 VAL 26 -3.100 2.642 -8.148 184 HG21 VAL 26 3HG2 VAL 26 -3.407 -0.191 -5.848 185 HG22 VAL 26 1HG2 VAL 26 -2.583 1.092 -4.962 186 HG23 VAL 26 2HG2 VAL 26 -2.151 0.756 -6.639 187 H GLN 27 H GLN 27 -7.208 2.041 -4.501 188 HA GLN 27 HA GLN 27 -6.947 0.247 -2.397 189 HB2 GLN 27 1HB GLN 27 -8.973 1.570 -2.803 190 HB3 GLN 27 2HB GLN 27 -9.297 0.641 -4.267 191 HG2 GLN 27 1HG GLN 27 -9.583 -1.391 -2.975 192 HG3 GLN 27 2HG GLN 27 -9.076 -0.571 -1.502 193 HE21 GLN 27 2HE2 GLN 27 -11.409 -1.516 -0.952 194 HE22 GLN 27 1HE2 GLN 27 -12.690 -0.439 -1.209 195 H GLY 28 H GLY 28 -7.394 -1.964 -2.225 196 HA2 GLY 28 1HA GLY 28 -7.369 -3.580 -4.680 197 HA3 GLY 28 2HA GLY 28 -6.064 -3.802 -3.518 198 H VAL 29 H VAL 29 -7.587 -5.904 -4.148 199 HA VAL 29 HA VAL 29 -9.431 -6.284 -1.862 200 HB VAL 29 HB VAL 29 -9.263 -8.075 -4.285 201 HG11 VAL 29 1HG1 VAL 29 -11.652 -8.492 -3.630 202 HG12 VAL 29 2HG1 VAL 29 -11.379 -7.500 -2.199 203 HG13 VAL 29 3HG1 VAL 29 -10.481 -9.002 -2.416 204 HG21 VAL 29 3HG2 VAL 29 -10.803 -5.502 -3.931 205 HG22 VAL 29 1HG2 VAL 29 -11.276 -6.738 -5.095 206 HG23 VAL 29 2HG2 VAL 29 -9.713 -5.937 -5.247 207 H LEU 30 H LEU 30 -9.402 -8.537 -1.035 208 HA LEU 30 HA LEU 30 -6.856 -9.948 -1.272 209 HB2 LEU 30 1HB LEU 30 -6.776 -8.266 0.699 210 HB3 LEU 30 2HB LEU 30 -7.968 -9.303 1.472 211 HG LEU 30 HG LEU 30 -5.388 -10.445 0.377 212 HD11 LEU 30 1HD1 LEU 30 -5.826 -8.934 2.932 213 HD12 LEU 30 2HD1 LEU 30 -4.442 -8.915 1.836 214 HD13 LEU 30 3HD1 LEU 30 -4.703 -10.289 2.905 215 HD21 LEU 30 3HD2 LEU 30 -5.865 -12.052 2.342 216 HD22 LEU 30 1HD2 LEU 30 -6.913 -12.173 0.932 217 HD23 LEU 30 2HD2 LEU 30 -7.475 -11.337 2.379 218 H CYS 31 H CYS 31 -7.464 -12.017 -1.708 219 HA CYS 31 HA CYS 31 -10.134 -12.880 -0.824 220 HB2 CYS 31 1HB CYS 31 -9.809 -13.046 -3.199 221 HB3 CYS 31 2HB CYS 31 -8.267 -13.869 -2.983 222 HG CYS 31 HG CYS 31 -9.448 -16.018 -2.510 223 H LYS 32 H LYS 32 -10.420 -14.491 0.521 224 HA LYS 32 HA LYS 32 -8.139 -16.227 1.256 225 HB2 LYS 32 1HB LYS 32 -10.085 -14.837 3.097 226 HB3 LYS 32 2HB LYS 32 -9.205 -16.285 3.586 227 HG2 LYS 32 1HG LYS 32 -7.069 -15.133 3.027 228 HG3 LYS 32 2HG LYS 32 -7.985 -13.676 2.638 229 HD2 LYS 32 1HD LYS 32 -8.902 -13.683 4.960 230 HD3 LYS 32 2HD LYS 32 -7.868 -15.063 5.328 231 HE2 LYS 32 1HE LYS 32 -6.919 -12.333 4.415 232 HE3 LYS 32 2HE LYS 32 -6.775 -12.988 6.046 233 HZ1 LYS 32 3HZ LYS 32 -5.253 -13.605 3.654 234 HZ2 LYS 32 1HZ LYS 32 -5.668 -14.938 4.615 235 HZ3 LYS 32 2HZ LYS 32 -4.782 -13.652 5.286 236 H GLY 33 H GLY 33 -8.934 -17.687 -0.229 237 HA2 GLY 33 1HA GLY 33 -10.388 -19.276 -1.132 238 HA3 GLY 33 2HA GLY 33 -10.358 -19.828 0.538 239 H ASP 34 H ASP 34 -12.052 -17.622 -1.677 240 HA ASP 34 HA ASP 34 -14.338 -17.295 -1.938 241 HB2 ASP 34 1HB ASP 34 -14.450 -19.640 -0.705 242 HB3 ASP 34 2HB ASP 34 -14.976 -18.664 0.663 243 H SER 35 H SER 35 -13.257 -17.158 1.450 244 HA SER 35 HA SER 35 -14.932 -15.015 2.235 245 HB2 SER 35 1HB SER 35 -13.668 -16.581 3.771 246 HB3 SER 35 2HB SER 35 -12.212 -15.682 3.372 247 HG SER 35 HG SER 35 -14.532 -14.352 4.246 248 H ARG 36 H ARG 36 -14.817 -13.441 0.557 249 HA ARG 36 HA ARG 36 -12.273 -12.268 -0.118 250 HB2 ARG 36 1HB ARG 36 -14.570 -12.532 -1.513 251 HB3 ARG 36 2HB ARG 36 -14.826 -10.908 -0.885 252 HG2 ARG 36 1HG ARG 36 -13.665 -10.421 -2.848 253 HG3 ARG 36 2HG ARG 36 -12.322 -10.533 -1.709 254 HD2 ARG 36 1HD ARG 36 -11.754 -11.844 -3.661 255 HD3 ARG 36 2HD ARG 36 -12.081 -12.960 -2.335 256 HE ARG 36 HE ARG 36 -14.004 -13.675 -3.456 257 HH11 ARG 36 1HH2 ARG 36 -12.609 -10.876 -4.937 258 HH12 ARG 36 2HH2 ARG 36 -13.598 -10.964 -6.356 259 HH21 ARG 36 1HH1 ARG 36 -15.307 -13.795 -5.311 260 HH22 ARG 36 2HH1 ARG 36 -15.127 -12.618 -6.567 261 H GLN 37 H GLN 37 -11.495 -10.288 0.408 262 HA GLN 37 HA GLN 37 -12.967 -8.695 2.425 263 HB2 GLN 37 1HB GLN 37 -10.053 -9.525 2.512 264 HB3 GLN 37 2HB GLN 37 -10.804 -8.357 3.601 265 HG2 GLN 37 1HG GLN 37 -12.263 -10.010 4.525 266 HG3 GLN 37 2HG GLN 37 -11.859 -11.168 3.261 267 HE21 GLN 37 2HE2 GLN 37 -9.311 -11.564 3.161 268 HE22 GLN 37 1HE2 GLN 37 -8.590 -11.847 4.665 269 H SER 38 H SER 38 -12.506 -6.503 2.404 270 HA SER 38 HA SER 38 -11.177 -5.514 -0.071 271 HB2 SER 38 1HB SER 38 -13.260 -4.025 1.527 272 HB3 SER 38 2HB SER 38 -12.670 -3.674 -0.096 273 HG SER 38 HG SER 38 -14.738 -5.100 0.505 274 H ARG 39 H ARG 39 -9.360 -4.485 0.202 275 HA ARG 39 HA ARG 39 -8.832 -3.047 2.743 276 HB2 ARG 39 1HB ARG 39 -6.893 -4.696 1.115 277 HB3 ARG 39 2HB ARG 39 -6.489 -3.775 2.561 278 HG2 ARG 39 1HG ARG 39 -8.638 -5.897 2.612 279 HG3 ARG 39 2HG ARG 39 -6.941 -6.317 2.829 280 HD2 ARG 39 1HD ARG 39 -6.819 -4.665 4.702 281 HD3 ARG 39 2HD ARG 39 -8.548 -4.395 4.542 282 HE ARG 39 HE ARG 39 -7.248 -6.823 5.556 283 HH11 ARG 39 1HH2 ARG 39 -10.144 -5.150 4.615 284 HH12 ARG 39 2HH2 ARG 39 -11.195 -6.209 5.492 285 HH21 ARG 39 1HH1 ARG 39 -8.631 -8.206 6.696 286 HH22 ARG 39 2HH1 ARG 39 -10.341 -7.934 6.667 287 H LEU 40 H LEU 40 -7.555 -1.229 2.590 288 HA LEU 40 HA LEU 40 -7.256 -0.101 -0.140 289 HB2 LEU 40 1HB LEU 40 -8.995 0.922 1.411 290 HB3 LEU 40 2HB LEU 40 -7.659 1.466 2.415 291 HG LEU 40 HG LEU 40 -7.500 2.135 -0.513 292 HD11 LEU 40 1HD1 LEU 40 -8.877 4.291 0.187 293 HD12 LEU 40 2HD1 LEU 40 -9.601 3.193 1.360 294 HD13 LEU 40 3HD1 LEU 40 -9.711 2.839 -0.363 295 HD21 LEU 40 3HD2 LEU 40 -6.942 3.718 2.020 296 HD22 LEU 40 1HD2 LEU 40 -6.526 4.213 0.383 297 HD23 LEU 40 2HD2 LEU 40 -5.732 2.818 1.105 298 H LEU 41 H LEU 41 -5.187 0.183 -0.772 299 HA LEU 41 HA LEU 41 -3.066 0.198 1.268 300 HB2 LEU 41 1HB LEU 41 -3.029 -0.170 -1.735 301 HB3 LEU 41 2HB LEU 41 -1.588 -0.127 -0.726 302 HG LEU 41 HG LEU 41 -2.596 -2.025 0.623 303 HD11 LEU 41 1HD1 LEU 41 -4.273 -3.390 -0.859 304 HD12 LEU 41 2HD1 LEU 41 -4.628 -1.828 -1.595 305 HD13 LEU 41 3HD1 LEU 41 -4.884 -2.072 0.132 306 HD21 LEU 41 3HD2 LEU 41 -2.004 -3.729 -1.114 307 HD22 LEU 41 1HD2 LEU 41 -0.823 -2.423 -1.000 308 HD23 LEU 41 2HD2 LEU 41 -1.992 -2.440 -2.320 309 H GLY 42 H GLY 42 -1.183 1.624 0.825 310 HA2 GLY 42 1HA GLY 42 -1.580 4.015 -0.729 311 HA3 GLY 42 2HA GLY 42 -1.705 4.294 1.003 312 H LEU 43 H LEU 43 0.302 5.248 -0.925 313 HA LEU 43 HA LEU 43 2.735 4.158 0.390 314 HB2 LEU 43 1HB LEU 43 2.792 3.438 -1.909 315 HB3 LEU 43 2HB LEU 43 2.384 5.053 -2.482 316 HG LEU 43 HG LEU 43 4.516 5.919 -1.679 317 HD11 LEU 43 1HD1 LEU 43 4.988 4.713 0.302 318 HD12 LEU 43 2HD1 LEU 43 6.196 4.118 -0.832 319 HD13 LEU 43 3HD1 LEU 43 4.761 3.151 -0.485 320 HD21 LEU 43 3HD2 LEU 43 4.789 3.318 -3.213 321 HD22 LEU 43 1HD2 LEU 43 6.038 4.560 -3.114 322 HD23 LEU 43 2HD2 LEU 43 4.501 4.915 -3.904 323 H VAL 44 H VAL 44 3.862 5.636 1.506 324 HA VAL 44 HA VAL 44 3.370 8.512 0.918 325 HB VAL 44 HB VAL 44 2.244 7.818 2.983 326 HG11 VAL 44 1HG1 VAL 44 4.957 7.197 4.142 327 HG12 VAL 44 2HG1 VAL 44 3.968 5.940 3.399 328 HG13 VAL 44 3HG1 VAL 44 3.367 6.819 4.804 329 HG21 VAL 44 3HG2 VAL 44 3.055 9.590 4.332 330 HG22 VAL 44 1HG2 VAL 44 3.471 10.069 2.688 331 HG23 VAL 44 2HG2 VAL 44 4.706 9.387 3.746 332 H ARG 45 H ARG 45 5.074 9.696 0.530 333 HA ARG 45 HA ARG 45 7.763 8.671 1.252 334 HB2 ARG 45 1HB ARG 45 7.355 8.925 -1.183 335 HB3 ARG 45 2HB ARG 45 6.991 10.633 -0.926 336 HG2 ARG 45 1HG ARG 45 9.244 10.997 -0.024 337 HG3 ARG 45 2HG ARG 45 9.616 9.286 -0.216 338 HD2 ARG 45 1HD ARG 45 10.530 10.508 -2.112 339 HD3 ARG 45 2HD ARG 45 9.186 9.512 -2.663 340 HE ARG 45 HE ARG 45 7.952 11.456 -3.075 341 HH11 ARG 45 1HH2 ARG 45 10.867 12.113 -1.329 342 HH12 ARG 45 2HH2 ARG 45 10.759 13.830 -1.521 343 HH21 ARG 45 1HH1 ARG 45 7.800 13.707 -3.328 344 HH22 ARG 45 2HH1 ARG 45 9.021 14.733 -2.653 345 H TYR 46 H TYR 46 8.894 9.826 2.671 346 HA TYR 46 HA TYR 46 8.181 12.649 3.180 347 HB2 TYR 46 1HB TYR 46 7.004 11.386 4.862 348 HB3 TYR 46 2HB TYR 46 8.434 10.417 5.211 349 HD1 TYR 46 HD1 TYR 46 7.056 13.878 5.332 350 HD2 TYR 46 HD2 TYR 46 10.080 11.169 6.729 351 HE1 TYR 46 HE1 TYR 46 7.784 15.556 7.006 352 HE2 TYR 46 HE2 TYR 46 10.813 12.844 8.402 353 HH TYR 46 HH TYR 46 10.039 14.766 9.529 354 H ARG 47 H ARG 47 9.945 13.957 3.531 355 HA ARG 47 HA ARG 47 12.568 12.743 3.134 356 HB2 ARG 47 1HB ARG 47 11.914 14.781 1.886 357 HB3 ARG 47 2HB ARG 47 11.805 15.659 3.411 358 HG2 ARG 47 1HG ARG 47 14.175 15.227 3.864 359 HG3 ARG 47 2HG ARG 47 14.300 14.271 2.387 360 HD2 ARG 47 1HD ARG 47 13.715 16.260 1.048 361 HD3 ARG 47 2HD ARG 47 13.584 17.214 2.523 362 HE ARG 47 HE ARG 47 15.924 17.237 2.684 363 HH11 ARG 47 1HH2 ARG 47 14.809 15.096 0.201 364 HH12 ARG 47 2HH2 ARG 47 16.372 14.889 -0.515 365 HH21 ARG 47 1HH1 ARG 47 17.980 16.968 1.744 366 HH22 ARG 47 2HH1 ARG 47 18.166 15.949 0.357 367 H LEU 48 H LEU 48 14.323 12.973 4.526 368 HA LEU 48 HA LEU 48 13.604 13.329 7.368 369 HB2 LEU 48 1HB LEU 48 16.047 12.089 6.078 370 HB3 LEU 48 2HB LEU 48 15.763 12.195 7.810 371 HG LEU 48 HG LEU 48 13.858 10.817 5.895 372 HD11 LEU 48 1HD1 LEU 48 14.852 8.716 6.562 373 HD12 LEU 48 2HD1 LEU 48 15.921 9.529 7.706 374 HD13 LEU 48 3HD1 LEU 48 16.147 9.756 5.972 375 HD21 LEU 48 3HD2 LEU 48 12.674 11.305 7.885 376 HD22 LEU 48 1HD2 LEU 48 14.088 11.039 8.903 377 HD23 LEU 48 2HD2 LEU 48 13.260 9.670 8.163 378 H GLU 49 H GLU 49 14.554 14.808 8.654 379 HA GLU 49 HA GLU 49 15.477 17.217 7.620 380 HB2 GLU 49 1HB GLU 49 15.903 15.956 10.335 381 HB3 GLU 49 2HB GLU 49 16.329 17.625 9.957 382 HG2 GLU 49 1HG GLU 49 14.021 18.133 9.382 383 HG3 GLU 49 2HG GLU 49 13.560 16.446 9.598 384 H ASN 50 H ASN 50 17.122 14.243 7.942 385 HA ASN 50 HA ASN 50 19.791 15.319 8.129 386 HB2 ASN 50 1HB ASN 50 18.753 12.562 7.437 387 HB3 ASN 50 2HB ASN 50 20.459 12.960 7.633 388 HD21 ASN 50 2HD2 ASN 50 18.327 11.330 9.311 389 HD22 ASN 50 1HD2 ASN 50 18.611 11.885 10.890 390 H ASP 51 H ASP 51 17.531 15.230 5.713 391 HA ASP 51 HA ASP 51 17.715 15.984 3.516 392 HB2 ASP 51 1HB ASP 51 20.655 15.316 3.429 393 HB3 ASP 51 2HB ASP 51 19.758 16.512 2.505 394 H ALA 52 H ALA 52 17.957 13.157 4.905 395 HA ALA 52 HA ALA 52 18.581 11.517 2.550 396 HB1 ALA 52 3HB ALA 52 18.120 10.917 5.470 397 HB2 ALA 52 1HB ALA 52 19.585 10.672 4.520 398 HB3 ALA 52 2HB ALA 52 18.180 9.640 4.254 399 H GLN 53 H GLN 53 17.118 10.250 1.522 400 HA GLN 53 HA GLN 53 14.274 10.871 1.960 401 HB2 GLN 53 1HB GLN 53 15.791 9.582 -0.315 402 HB3 GLN 53 2HB GLN 53 14.032 9.706 -0.270 403 HG2 GLN 53 1HG GLN 53 15.792 12.134 0.107 404 HG3 GLN 53 2HG GLN 53 15.319 11.579 -1.499 405 HE21 GLN 53 2HE2 GLN 53 12.852 10.749 0.636 406 HE22 GLN 53 1HE2 GLN 53 11.846 12.094 0.397 407 H GLU 54 H GLU 54 12.682 9.248 2.131 408 HA GLU 54 HA GLU 54 13.435 6.470 2.290 409 HB2 GLU 54 1HB GLU 54 13.966 7.595 4.591 410 HB3 GLU 54 2HB GLU 54 12.216 7.593 4.809 411 HG2 GLU 54 1HG GLU 54 13.076 5.556 5.781 412 HG3 GLU 54 2HG GLU 54 12.239 5.116 4.297 413 H HIS 55 H HIS 55 11.550 5.075 2.644 414 HA HIS 55 HA HIS 55 8.928 6.349 2.203 415 HB2 HIS 55 1HB HIS 55 10.003 4.138 0.442 416 HB3 HIS 55 2HB HIS 55 8.450 4.957 0.291 417 HD2 HIS 55 HD2 HIS 55 8.595 6.928 -1.616 418 HE1 HIS 55 HE1 HIS 55 12.700 7.846 -1.245 419 HE2 HIS 55 HE2 HIS 55 10.567 8.387 -2.512 420 H ALA 56 H ALA 56 7.149 4.728 2.318 421 HA ALA 56 HA ALA 56 7.704 2.184 3.575 422 HB1 ALA 56 3HB ALA 56 6.475 4.491 5.087 423 HB2 ALA 56 1HB ALA 56 7.807 3.447 5.582 424 HB3 ALA 56 2HB ALA 56 6.162 2.812 5.531 425 H LEU 57 H LEU 57 5.869 0.824 3.525 426 HA LEU 57 HA LEU 57 3.727 1.747 1.710 427 HB2 LEU 57 1HB LEU 57 4.753 -0.220 0.878 428 HB3 LEU 57 2HB LEU 57 4.749 -0.995 2.454 429 HG LEU 57 HG LEU 57 2.307 -1.194 2.398 430 HD11 LEU 57 1HD1 LEU 57 1.198 -0.532 0.152 431 HD12 LEU 57 2HD1 LEU 57 2.631 0.463 -0.109 432 HD13 LEU 57 3HD1 LEU 57 1.591 0.762 1.282 433 HD21 LEU 57 3HD2 LEU 57 3.430 -3.030 1.357 434 HD22 LEU 57 1HD2 LEU 57 3.744 -2.094 -0.106 435 HD23 LEU 57 2HD2 LEU 57 2.099 -2.595 0.284 436 H PHE 58 H PHE 58 2.310 2.794 2.980 437 HA PHE 58 HA PHE 58 1.491 1.826 5.544 438 HB2 PHE 58 1HB PHE 58 0.734 4.118 3.755 439 HB3 PHE 58 2HB PHE 58 -0.307 3.712 5.115 440 HD1 PHE 58 HD2 PHE 58 3.384 3.177 5.225 441 HD2 PHE 58 HD1 PHE 58 0.128 5.758 6.337 442 HE1 PHE 58 HE2 PHE 58 4.861 4.374 6.786 443 HE2 PHE 58 HE1 PHE 58 1.625 6.952 7.905 444 HZ PHE 58 HZ PHE 58 3.991 6.260 8.131 445 H LEU 59 H LEU 59 -0.440 0.977 6.159 446 HA LEU 59 HA LEU 59 -2.145 -0.149 4.007 447 HB2 LEU 59 1HB LEU 59 -0.848 -1.844 5.393 448 HB3 LEU 59 2HB LEU 59 -1.788 -1.303 6.781 449 HG LEU 59 HG LEU 59 -3.879 -1.764 5.307 450 HD11 LEU 59 1HD1 LEU 59 -3.384 -3.727 3.704 451 HD12 LEU 59 2HD1 LEU 59 -1.715 -3.170 3.732 452 HD13 LEU 59 3HD1 LEU 59 -2.989 -2.108 3.138 453 HD21 LEU 59 3HD2 LEU 59 -3.438 -3.146 7.210 454 HD22 LEU 59 1HD2 LEU 59 -2.085 -3.940 6.406 455 HD23 LEU 59 2HD2 LEU 59 -3.736 -4.242 5.863 456 H TYR 60 H TYR 60 -4.097 0.626 3.961 457 HA TYR 60 HA TYR 60 -5.244 1.946 6.368 458 HB2 TYR 60 1HB TYR 60 -5.583 2.506 3.417 459 HB3 TYR 60 2HB TYR 60 -6.552 3.262 4.675 460 HD1 TYR 60 HD2 TYR 60 -5.527 4.872 6.252 461 HD2 TYR 60 HD1 TYR 60 -3.256 3.116 3.054 462 HE1 TYR 60 HE2 TYR 60 -3.778 6.608 6.537 463 HE2 TYR 60 HE1 TYR 60 -1.513 4.856 3.336 464 HH TYR 60 HH TYR 60 -1.446 7.256 4.264 465 H THR 61 H THR 61 -7.202 1.131 7.065 466 HA THR 61 HA THR 61 -8.397 -1.035 5.462 467 HB THR 61 HB THR 61 -8.135 -1.532 7.844 468 HG1 THR 61 HG1 THR 61 -10.150 -1.979 6.517 469 HG21 THR 61 3HG2 THR 61 -9.943 0.851 8.312 470 HG22 THR 61 1HG2 THR 61 -8.211 0.828 8.644 471 HG23 THR 61 2HG2 THR 61 -9.295 -0.229 9.547 472 H HIS 62 H HIS 62 -10.834 -0.997 5.360 473 HA HIS 62 HA HIS 62 -12.086 1.597 5.480 474 HB2 HIS 62 1HB HIS 62 -12.478 1.954 3.174 475 HB3 HIS 62 2HB HIS 62 -10.764 1.558 3.286 476 HD2 HIS 62 HD2 HIS 62 -10.139 -1.136 2.402 477 HE1 HIS 62 HE1 HIS 62 -13.813 -1.661 0.395 478 HE2 HIS 62 HE2 HIS 62 -11.474 -2.606 0.707 479 H ARG 63 H ARG 63 -14.371 1.488 4.930 480 HA ARG 63 HA ARG 63 -15.485 -1.062 5.794 481 HB2 ARG 63 1HB ARG 63 -16.859 1.548 5.104 482 HB3 ARG 63 2HB ARG 63 -17.631 0.136 5.829 483 HG2 ARG 63 1HG ARG 63 -16.091 0.286 7.744 484 HG3 ARG 63 2HG ARG 63 -15.348 1.703 7.011 485 HD2 ARG 63 1HD ARG 63 -16.957 2.391 8.700 486 HD3 ARG 63 2HD ARG 63 -17.526 2.877 7.094 487 HE ARG 63 HE ARG 63 -18.622 0.365 7.829 488 HH11 ARG 63 1HH2 ARG 63 -18.685 3.757 8.548 489 HH12 ARG 63 2HH2 ARG 63 -20.320 3.745 9.120 490 HH21 ARG 63 1HH1 ARG 63 -20.737 0.336 8.620 491 HH22 ARG 63 2HH1 ARG 63 -21.479 1.805 9.160 492 H ARG 64 H ARG 64 -17.918 -1.018 4.538 493 HA ARG 64 HA ARG 64 -17.364 -2.387 2.140 494 HB2 ARG 64 1HB ARG 64 -19.955 -1.185 3.153 495 HB3 ARG 64 2HB ARG 64 -19.817 -2.338 1.822 496 HG2 ARG 64 1HG ARG 64 -18.813 -3.989 3.328 497 HG3 ARG 64 2HG ARG 64 -18.890 -2.836 4.660 498 HD2 ARG 64 1HD ARG 64 -21.321 -3.778 3.113 499 HD3 ARG 64 2HD ARG 64 -20.788 -4.506 4.626 500 HE ARG 64 HE ARG 64 -21.009 -1.752 5.067 501 HH11 ARG 64 1HH2 ARG 64 -23.001 -4.452 4.211 502 HH12 ARG 64 2HH2 ARG 64 -24.428 -3.809 4.954 503 HH21 ARG 64 1HH1 ARG 64 -22.876 -0.907 6.043 504 HH22 ARG 64 2HH1 ARG 64 -24.357 -1.804 5.991 505 H MET 65 H MET 65 -18.277 0.975 2.857 506 HA MET 65 HA MET 65 -17.453 1.739 0.166 507 HB2 MET 65 1HB MET 65 -19.669 3.066 -0.046 508 HB3 MET 65 2HB MET 65 -19.709 1.334 -0.384 509 HG2 MET 65 1HG MET 65 -20.651 0.831 1.746 510 HG3 MET 65 2HG MET 65 -20.292 2.443 2.366 511 HE1 MET 65 3HE MET 65 -23.230 1.516 2.880 512 HE2 MET 65 1HE MET 65 -23.944 3.079 2.458 513 HE3 MET 65 2HE MET 65 -22.373 3.010 3.254 514 H ALA 66 H ALA 66 -16.367 2.263 2.782 515 HA ALA 66 HA ALA 66 -17.038 4.503 4.146 516 HB1 ALA 66 3HB ALA 66 -14.446 4.897 4.157 517 HB2 ALA 66 1HB ALA 66 -14.404 3.396 3.238 518 HB3 ALA 66 2HB ALA 66 -15.110 3.414 4.848 519 H ILE 67 H ILE 67 -14.407 5.019 1.852 520 HA ILE 67 HA ILE 67 -13.920 6.737 0.434 521 HB ILE 67 HB ILE 67 -16.938 6.896 0.160 522 HG12 ILE 67 1HG1 ILE 67 -14.925 5.484 -1.612 523 HG13 ILE 67 2HG1 ILE 67 -15.847 4.649 -0.360 524 HG21 ILE 67 1HG2 ILE 67 -16.262 7.841 -2.093 525 HG22 ILE 67 2HG2 ILE 67 -14.626 7.973 -1.450 526 HG23 ILE 67 3HG2 ILE 67 -15.943 8.884 -0.709 527 HD11 ILE 67 3HD1 ILE 67 -17.067 6.230 -2.649 528 HD12 ILE 67 1HD1 ILE 67 -17.952 5.309 -1.432 529 HD13 ILE 67 2HD1 ILE 67 -16.929 4.473 -2.600 530 H THR 68 H THR 68 -16.531 7.420 2.622 531 HA THR 68 HA THR 68 -17.061 9.918 2.844 532 HB THR 68 HB THR 68 -17.824 8.673 4.647 533 HG1 THR 68 HG1 THR 68 -16.649 9.662 6.524 534 HG21 THR 68 3HG2 THR 68 -16.183 7.622 6.289 535 HG22 THR 68 1HG2 THR 68 -14.930 7.937 5.097 536 HG23 THR 68 2HG2 THR 68 -16.271 6.871 4.697 537 H GLY 69 H GLY 69 -13.897 8.876 4.181 538 HA2 GLY 69 1HA GLY 69 -12.062 10.501 3.354 539 HA3 GLY 69 2HA GLY 69 -13.054 11.707 4.172 540 H ASP 70 H ASP 70 -13.819 9.520 6.147 541 HA ASP 70 HA ASP 70 -11.378 9.703 7.817 542 HB2 ASP 70 1HB ASP 70 -12.964 9.461 9.741 543 HB3 ASP 70 2HB ASP 70 -13.151 10.957 8.828 544 H ASP 71 H ASP 71 -14.311 7.622 7.712 545 HA ASP 71 HA ASP 71 -13.747 5.461 8.993 546 HB2 ASP 71 1HB ASP 71 -14.893 5.682 6.221 547 HB3 ASP 71 2HB ASP 71 -14.490 4.111 6.864 548 H VAL 72 H VAL 72 -11.978 6.277 6.122 549 HA VAL 72 HA VAL 72 -10.363 3.855 6.361 550 HB VAL 72 HB VAL 72 -10.253 6.149 4.413 551 HG11 VAL 72 1HG1 VAL 72 -8.882 4.667 3.027 552 HG12 VAL 72 2HG1 VAL 72 -8.910 3.450 4.291 553 HG13 VAL 72 3HG1 VAL 72 -8.107 4.990 4.572 554 HG21 VAL 72 3HG2 VAL 72 -11.966 3.746 4.568 555 HG22 VAL 72 1HG2 VAL 72 -11.143 3.912 3.017 556 HG23 VAL 72 2HG2 VAL 72 -12.178 5.207 3.607 557 H SER 73 H SER 73 -8.924 3.974 8.016 558 HA SER 73 HA SER 73 -6.959 6.159 7.930 559 HB2 SER 73 1HB SER 73 -8.390 5.141 10.399 560 HB3 SER 73 2HB SER 73 -7.011 6.238 10.413 561 HG SER 73 HG SER 73 -8.264 7.728 9.250 562 H LEU 74 H LEU 74 -4.952 5.496 9.126 563 HA LEU 74 HA LEU 74 -3.825 3.266 8.170 564 HB2 LEU 74 1HB LEU 74 -3.310 4.740 10.732 565 HB3 LEU 74 2HB LEU 74 -2.346 3.315 10.338 566 HG LEU 74 HG LEU 74 -2.729 5.620 8.416 567 HD11 LEU 74 1HD1 LEU 74 -0.407 6.291 9.156 568 HD12 LEU 74 2HD1 LEU 74 -0.573 5.156 10.499 569 HD13 LEU 74 3HD1 LEU 74 -1.659 6.541 10.374 570 HD21 LEU 74 3HD2 LEU 74 -0.245 4.154 8.145 571 HD22 LEU 74 1HD2 LEU 74 -1.565 4.299 6.993 572 HD23 LEU 74 2HD2 LEU 74 -1.563 2.996 8.173 573 H ASP 75 H ASP 75 -3.806 1.198 8.372 574 HA ASP 75 HA ASP 75 -5.253 -0.109 10.606 575 HB2 ASP 75 1HB ASP 75 -6.210 -0.369 8.286 576 HB3 ASP 75 2HB ASP 75 -4.738 -1.232 7.847 577 H GLN 76 H GLN 76 -2.238 0.109 8.811 578 HA GLN 76 HA GLN 76 -0.874 -1.376 10.819 579 HB2 GLN 76 1HB GLN 76 -1.963 -3.089 9.038 580 HB3 GLN 76 2HB GLN 76 -0.473 -2.719 8.174 581 HG2 GLN 76 1HG GLN 76 0.754 -3.216 10.375 582 HG3 GLN 76 2HG GLN 76 -0.766 -3.870 10.961 583 HE21 GLN 76 2HE2 GLN 76 2.064 -4.946 9.796 584 HE22 GLN 76 1HE2 GLN 76 1.547 -6.306 8.919 585 H ILE 77 H ILE 77 1.414 -2.084 9.302 586 HA ILE 77 HA ILE 77 2.314 0.201 7.785 587 HB ILE 77 HB ILE 77 3.475 -0.343 10.545 588 HG12 ILE 77 1HG1 ILE 77 2.004 2.018 9.323 589 HG13 ILE 77 2HG1 ILE 77 1.502 1.036 10.702 590 HG21 ILE 77 1HG2 ILE 77 5.158 1.296 10.074 591 HG22 ILE 77 2HG2 ILE 77 4.390 1.756 8.558 592 HG23 ILE 77 3HG2 ILE 77 5.187 0.197 8.706 593 HD11 ILE 77 3HD1 ILE 77 2.376 3.009 11.665 594 HD12 ILE 77 1HD1 ILE 77 3.769 3.015 10.585 595 HD13 ILE 77 2HD1 ILE 77 3.647 1.802 11.859 596 H VAL 78 H VAL 78 3.776 -0.466 6.351 597 HA VAL 78 HA VAL 78 5.368 -2.901 6.889 598 HB VAL 78 HB VAL 78 4.130 -2.368 4.191 599 HG11 VAL 78 1HG1 VAL 78 4.697 -4.676 3.789 600 HG12 VAL 78 2HG1 VAL 78 5.101 -4.927 5.488 601 HG13 VAL 78 3HG1 VAL 78 6.122 -3.901 4.480 602 HG21 VAL 78 3HG2 VAL 78 2.401 -4.028 4.778 603 HG22 VAL 78 1HG2 VAL 78 2.291 -2.607 5.816 604 HG23 VAL 78 2HG2 VAL 78 3.022 -4.090 6.429 605 HA PRO 79 HA PRO 79 8.003 0.460 5.231 606 HB2 PRO 79 1HB PRO 79 10.138 0.133 6.856 607 HB3 PRO 79 2HB PRO 79 8.654 0.938 7.407 608 HG2 PRO 79 1HG PRO 79 9.635 -1.814 7.975 609 HG3 PRO 79 2HG PRO 79 8.729 -0.703 9.014 610 HD2 PRO 79 1HD PRO 79 7.619 -2.843 7.541 611 HD3 PRO 79 2HD PRO 79 6.703 -1.512 8.275 612 H LEU 80 H LEU 80 9.376 0.328 3.545 613 HA LEU 80 HA LEU 80 10.102 -2.162 2.468 614 HB2 LEU 80 1HB LEU 80 11.239 0.572 1.839 615 HB3 LEU 80 2HB LEU 80 11.261 -0.847 0.790 616 HG LEU 80 HG LEU 80 8.756 0.532 1.800 617 HD11 LEU 80 1HD1 LEU 80 9.810 0.482 -1.033 618 HD12 LEU 80 2HD1 LEU 80 10.220 1.776 0.095 619 HD13 LEU 80 3HD1 LEU 80 8.539 1.502 -0.361 620 HD21 LEU 80 3HD2 LEU 80 8.123 -1.696 1.387 621 HD22 LEU 80 1HD2 LEU 80 9.277 -1.885 0.067 622 HD23 LEU 80 2HD2 LEU 80 7.810 -0.931 -0.166 623 H SER 81 H SER 81 11.722 -3.406 2.808 624 HA SER 81 HA SER 81 14.312 -2.422 3.739 625 HB2 SER 81 1HB SER 81 14.355 -4.187 5.548 626 HB3 SER 81 2HB SER 81 13.275 -2.831 5.860 627 HG SER 81 HG SER 81 12.272 -4.857 6.247 628 H LYS 82 H LYS 82 15.814 -4.467 3.990 629 HA LYS 82 HA LYS 82 16.153 -5.580 1.479 630 HB2 LYS 82 1HB LYS 82 16.977 -6.709 4.161 631 HB3 LYS 82 2HB LYS 82 17.609 -7.240 2.600 632 HG2 LYS 82 1HG LYS 82 18.505 -5.030 2.144 633 HG3 LYS 82 2HG LYS 82 17.739 -4.378 3.590 634 HD2 LYS 82 1HD LYS 82 19.951 -4.739 4.290 635 HD3 LYS 82 2HD LYS 82 19.116 -6.175 4.872 636 HE2 LYS 82 1HE LYS 82 19.889 -7.457 2.940 637 HE3 LYS 82 2HE LYS 82 20.627 -6.014 2.244 638 HZ1 LYS 82 3HZ LYS 82 21.414 -7.471 4.694 639 HZ2 LYS 82 1HZ LYS 82 21.948 -5.894 4.372 640 HZ3 LYS 82 2HZ LYS 82 22.347 -7.158 3.309 641 H ASP 83 H ASP 83 14.536 -7.067 4.321 642 HA ASP 83 HA ASP 83 13.922 -9.513 3.111 643 HB2 ASP 83 1HB ASP 83 12.623 -7.932 5.330 644 HB3 ASP 83 2HB ASP 83 12.025 -9.518 4.844 645 H PHE 84 H PHE 84 12.344 -6.381 2.963 646 HA PHE 84 HA PHE 84 9.869 -7.150 1.870 647 HB2 PHE 84 1HB PHE 84 10.613 -4.826 2.688 648 HB3 PHE 84 2HB PHE 84 11.334 -4.632 1.093 649 HD1 PHE 84 HD1 PHE 84 9.823 -4.988 -0.968 650 HD2 PHE 84 HD2 PHE 84 8.302 -4.424 3.007 651 HE1 PHE 84 HE1 PHE 84 7.627 -4.314 -1.900 652 HE2 PHE 84 HE2 PHE 84 6.106 -3.767 2.078 653 HZ PHE 84 HZ PHE 84 5.768 -3.702 -0.378 654 H MET 85 H MET 85 9.232 -7.716 -0.121 655 HA MET 85 HA MET 85 10.720 -7.207 -2.496 656 HB2 MET 85 1HB MET 85 12.141 -9.017 -1.589 657 HB3 MET 85 2HB MET 85 10.734 -10.081 -1.536 658 HG2 MET 85 1HG MET 85 10.462 -9.935 -3.945 659 HG3 MET 85 2HG MET 85 11.741 -8.725 -4.056 660 HE1 MET 85 3HE MET 85 10.629 -12.121 -3.164 661 HE2 MET 85 1HE MET 85 11.777 -12.183 -1.823 662 HE3 MET 85 2HE MET 85 12.020 -13.194 -3.246 663 H LEU 86 H LEU 86 9.370 -7.301 -4.219 664 HA LEU 86 HA LEU 86 6.635 -8.252 -3.746 665 HB2 LEU 86 1HB LEU 86 6.494 -7.230 -6.220 666 HB3 LEU 86 2HB LEU 86 6.465 -6.191 -4.799 667 HG LEU 86 HG LEU 86 9.143 -6.918 -5.972 668 HD11 LEU 86 1HD1 LEU 86 7.165 -4.963 -7.154 669 HD12 LEU 86 2HD1 LEU 86 8.060 -6.243 -7.974 670 HD13 LEU 86 3HD1 LEU 86 8.903 -4.804 -7.402 671 HD21 LEU 86 3HD2 LEU 86 8.593 -5.480 -3.815 672 HD22 LEU 86 1HD2 LEU 86 8.282 -4.202 -4.989 673 HD23 LEU 86 2HD2 LEU 86 9.868 -4.965 -4.914 674 H GLU 87 H GLU 87 6.126 -10.308 -4.300 675 HA GLU 87 HA GLU 87 7.708 -11.621 -6.436 676 HB2 GLU 87 1HB GLU 87 6.143 -12.786 -4.126 677 HB3 GLU 87 2HB GLU 87 6.892 -13.739 -5.405 678 HG2 GLU 87 1HG GLU 87 9.093 -12.760 -4.829 679 HG3 GLU 87 2HG GLU 87 8.333 -11.857 -3.518 680 H GLU 88 H GLU 88 6.731 -11.795 -8.299 681 HA GLU 88 HA GLU 88 3.930 -11.348 -8.677 682 HB2 GLU 88 1HB GLU 88 6.071 -12.461 -10.511 683 HB3 GLU 88 2HB GLU 88 4.412 -12.146 -11.021 684 HG2 GLU 88 1HG GLU 88 4.652 -9.779 -10.434 685 HG3 GLU 88 2HG GLU 88 6.285 -10.073 -9.839 686 H VAL 89 H VAL 89 2.302 -12.872 -9.170 687 HA VAL 89 HA VAL 89 2.906 -15.630 -8.262 688 HB VAL 89 HB VAL 89 0.186 -14.451 -8.720 689 HG11 VAL 89 1HG1 VAL 89 -0.453 -16.215 -7.092 690 HG12 VAL 89 2HG1 VAL 89 1.225 -16.754 -7.059 691 HG13 VAL 89 3HG1 VAL 89 0.288 -16.877 -8.548 692 HG21 VAL 89 3HG2 VAL 89 1.881 -14.403 -6.208 693 HG22 VAL 89 1HG2 VAL 89 0.160 -14.020 -6.252 694 HG23 VAL 89 2HG2 VAL 89 1.312 -12.999 -7.112 695 H SER 90 H SER 90 2.686 -17.318 -9.590 696 HA SER 90 HA SER 90 3.001 -17.311 -12.252 697 HB2 SER 90 1HB SER 90 1.263 -19.254 -10.729 698 HB3 SER 90 2HB SER 90 1.924 -19.534 -12.339 699 HG SER 90 HG SER 90 3.776 -18.687 -10.500 700 HA PRO 91 HA PRO 91 -0.940 -15.461 -13.544 701 HB2 PRO 91 1HB PRO 91 -0.347 -15.005 -16.161 702 HB3 PRO 91 2HB PRO 91 0.299 -14.000 -14.847 703 HG2 PRO 91 1HG PRO 91 1.624 -16.184 -16.383 704 HG3 PRO 91 2HG PRO 91 2.292 -14.648 -15.804 705 HD2 PRO 91 1HD PRO 91 2.671 -17.089 -14.532 706 HD3 PRO 91 2HD PRO 91 2.798 -15.512 -13.721 707 H ASP 92 H ASP 92 0.561 -17.649 -15.961 708 HA ASP 92 HA ASP 92 -0.273 -19.408 -17.152 709 HB2 ASP 92 1HB ASP 92 -2.096 -19.583 -14.744 710 HB3 ASP 92 2HB ASP 92 -2.151 -20.732 -16.073 711 H GLY 93 H GLY 93 -1.143 -16.735 -17.708 712 HA2 GLY 93 1HA GLY 93 -3.914 -17.162 -18.696 713 HA3 GLY 93 2HA GLY 93 -3.197 -15.590 -18.352 714 H GLU 94 H GLU 94 -4.271 -17.196 -20.832 715 HA GLU 94 HA GLU 94 -2.176 -16.207 -22.679 716 HB2 GLU 94 1HB GLU 94 -2.573 -18.210 -24.102 717 HB3 GLU 94 2HB GLU 94 -1.862 -18.608 -22.539 718 HG2 GLU 94 1HG GLU 94 -4.091 -19.195 -21.665 719 HG3 GLU 94 2HG GLU 94 -4.810 -18.793 -23.224 720 H LEU 95 H LEU 95 -4.425 -14.727 -22.025 721 HA LEU 95 HA LEU 95 -5.528 -14.187 -24.551 722 HB2 LEU 95 1HB LEU 95 -6.826 -16.243 -24.211 723 HB3 LEU 95 2HB LEU 95 -7.386 -15.652 -22.653 724 HG LEU 95 HG LEU 95 -8.547 -13.780 -23.757 725 HD11 LEU 95 1HD1 LEU 95 -7.162 -14.902 -26.188 726 HD12 LEU 95 2HD1 LEU 95 -7.321 -13.223 -25.673 727 HD13 LEU 95 3HD1 LEU 95 -8.702 -14.062 -26.374 728 HD21 LEU 95 3HD2 LEU 95 -9.161 -16.438 -25.087 729 HD22 LEU 95 1HD2 LEU 95 -10.282 -15.091 -24.882 730 HD23 LEU 95 2HD2 LEU 95 -9.694 -15.973 -23.472 731 H TYR 96 H TYR 96 -7.528 -14.172 -21.720 732 HA TYR 96 HA TYR 96 -8.219 -11.534 -21.735 733 HB2 TYR 96 1HB TYR 96 -9.011 -11.735 -19.528 734 HB3 TYR 96 2HB TYR 96 -9.102 -13.364 -20.194 735 HD1 TYR 96 HD1 TYR 96 -7.149 -14.966 -19.749 736 HD2 TYR 96 HD2 TYR 96 -7.723 -11.291 -17.605 737 HE1 TYR 96 HE1 TYR 96 -5.659 -15.786 -17.945 738 HE2 TYR 96 HE2 TYR 96 -6.245 -12.106 -15.804 739 HH TYR 96 HH TYR 96 -4.720 -13.695 -15.247 740 H ILE 97 H ILE 97 -5.623 -12.826 -19.720 741 HA ILE 97 HA ILE 97 -3.632 -11.951 -19.015 742 HB ILE 97 HB ILE 97 -4.166 -9.885 -21.133 743 HG12 ILE 97 1HG1 ILE 97 -2.211 -12.170 -21.305 744 HG13 ILE 97 2HG1 ILE 97 -3.910 -12.447 -21.694 745 HG21 ILE 97 1HG2 ILE 97 -1.717 -9.499 -21.014 746 HG22 ILE 97 2HG2 ILE 97 -1.646 -10.562 -19.611 747 HG23 ILE 97 3HG2 ILE 97 -2.539 -9.044 -19.524 748 HD11 ILE 97 3HD1 ILE 97 -2.617 -11.835 -23.702 749 HD12 ILE 97 1HD1 ILE 97 -2.163 -10.316 -22.930 750 HD13 ILE 97 2HD1 ILE 97 -3.851 -10.632 -23.325 751 H LEU 98 H LEU 98 -4.518 -11.523 -17.041 752 HA LEU 98 HA LEU 98 -5.038 -10.263 -15.188 753 HB2 LEU 98 1HB LEU 98 -3.672 -8.177 -16.902 754 HB3 LEU 98 2HB LEU 98 -4.194 -7.868 -15.250 755 HG LEU 98 HG LEU 98 -1.817 -8.497 -15.310 756 HD11 LEU 98 1HD1 LEU 98 -3.025 -10.973 -14.150 757 HD12 LEU 98 2HD1 LEU 98 -3.611 -9.435 -13.534 758 HD13 LEU 98 3HD1 LEU 98 -1.896 -9.819 -13.440 759 HD21 LEU 98 3HD2 LEU 98 -2.589 -11.255 -16.260 760 HD22 LEU 98 1HD2 LEU 98 -1.000 -10.493 -16.243 761 HD23 LEU 98 2HD2 LEU 98 -2.211 -9.981 -17.416 762 H GLY 99 H GLY 99 -5.598 -8.118 -17.963 763 HA2 GLY 99 1HA GLY 99 -7.480 -7.009 -18.681 764 HA3 GLY 99 2HA GLY 99 -8.423 -8.187 -17.767 765 H SER 100 H SER 100 -8.476 -7.867 -15.400 766 HA SER 100 HA SER 100 -7.987 -5.186 -14.395 767 HB2 SER 100 1HB SER 100 -10.818 -6.238 -14.529 768 HB3 SER 100 2HB SER 100 -10.295 -4.723 -13.792 769 HG SER 100 HG SER 100 -10.375 -5.476 -16.509 770 H ASP 101 H ASP 101 -6.813 -7.529 -13.691 771 HA ASP 101 HA ASP 101 -7.572 -7.758 -10.890 772 HB2 ASP 101 1HB ASP 101 -7.737 -10.072 -12.827 773 HB3 ASP 101 2HB ASP 101 -7.466 -10.325 -11.106 774 H VAL 102 H VAL 102 -5.424 -6.586 -11.076 775 HA VAL 102 HA VAL 102 -3.085 -7.936 -11.952 776 HB VAL 102 HB VAL 102 -3.404 -5.716 -9.946 777 HG11 VAL 102 1HG1 VAL 102 -1.254 -6.612 -9.560 778 HG12 VAL 102 2HG1 VAL 102 -0.969 -5.293 -10.692 779 HG13 VAL 102 3HG1 VAL 102 -0.996 -6.961 -11.267 780 HG21 VAL 102 3HG2 VAL 102 -2.761 -5.753 -12.900 781 HG22 VAL 102 1HG2 VAL 102 -2.755 -4.311 -11.882 782 HG23 VAL 102 2HG2 VAL 102 -4.262 -5.185 -12.169 783 H THR 103 H THR 103 -1.754 -9.326 -10.950 784 HA THR 103 HA THR 103 -2.535 -10.186 -8.207 785 HB THR 103 HB THR 103 -0.877 -11.846 -10.107 786 HG1 THR 103 HG1 THR 103 -2.945 -12.832 -10.601 787 HG21 THR 103 3HG2 THR 103 -2.670 -12.426 -7.729 788 HG22 THR 103 1HG2 THR 103 -0.918 -12.619 -7.814 789 HG23 THR 103 2HG2 THR 103 -1.974 -13.671 -8.759 790 H VAL 104 H VAL 104 -1.306 -9.360 -6.732 791 HA VAL 104 HA VAL 104 1.629 -9.357 -7.056 792 HB VAL 104 HB VAL 104 -0.168 -7.112 -6.104 793 HG11 VAL 104 1HG1 VAL 104 2.060 -6.010 -5.448 794 HG12 VAL 104 2HG1 VAL 104 2.746 -7.635 -5.470 795 HG13 VAL 104 3HG1 VAL 104 1.442 -7.244 -4.349 796 HG21 VAL 104 3HG2 VAL 104 0.671 -7.409 -8.531 797 HG22 VAL 104 1HG2 VAL 104 2.263 -7.000 -7.896 798 HG23 VAL 104 2HG2 VAL 104 0.938 -5.843 -7.768 799 H GLN 105 H GLN 105 2.703 -10.185 -5.371 800 HA GLN 105 HA GLN 105 1.181 -10.792 -2.884 801 HB2 GLN 105 1HB GLN 105 1.829 -12.740 -4.494 802 HB3 GLN 105 2HB GLN 105 3.467 -12.485 -3.896 803 HG2 GLN 105 1HG GLN 105 1.069 -12.960 -2.097 804 HG3 GLN 105 2HG GLN 105 2.186 -14.222 -2.604 805 HE21 GLN 105 2HE2 GLN 105 1.641 -11.833 -0.221 806 HE22 GLN 105 1HE2 GLN 105 3.191 -11.841 0.471 807 H LEU 106 H LEU 106 1.941 -9.556 -1.228 808 HA LEU 106 HA LEU 106 4.613 -8.449 -1.328 809 HB2 LEU 106 1HB LEU 106 2.552 -8.349 0.885 810 HB3 LEU 106 2HB LEU 106 3.947 -7.287 0.691 811 HG LEU 106 HG LEU 106 1.648 -7.520 -1.275 812 HD11 LEU 106 1HD1 LEU 106 1.212 -6.427 1.019 813 HD12 LEU 106 2HD1 LEU 106 0.836 -5.464 -0.410 814 HD13 LEU 106 3HD1 LEU 106 2.321 -5.161 0.489 815 HD21 LEU 106 3HD2 LEU 106 2.813 -5.285 -2.039 816 HD22 LEU 106 1HD2 LEU 106 3.489 -6.827 -2.558 817 HD23 LEU 106 2HD2 LEU 106 4.225 -5.948 -1.217 818 H ASN 107 H ASN 107 6.305 -9.532 -0.691 819 HA ASN 107 HA ASN 107 6.024 -11.654 1.387 820 HB2 ASN 107 1HB ASN 107 8.395 -11.308 -0.424 821 HB3 ASN 107 2HB ASN 107 7.894 -12.738 0.479 822 HD21 ASN 107 2HD2 ASN 107 6.331 -10.492 -1.855 823 HD22 ASN 107 1HD2 ASN 107 5.656 -11.718 -2.807 824 H THR 108 H THR 108 6.039 -9.515 2.822 825 HA THR 108 HA THR 108 8.663 -8.463 3.330 826 HB THR 108 HB THR 108 6.516 -8.260 5.406 827 HG1 THR 108 HG1 THR 108 5.413 -8.058 3.427 828 HG21 THR 108 3HG2 THR 108 8.556 -6.383 4.199 829 HG22 THR 108 1HG2 THR 108 8.472 -6.985 5.852 830 HG23 THR 108 2HG2 THR 108 7.275 -5.830 5.271 831 H ALA 109 H ALA 109 9.428 -8.515 5.697 832 HA ALA 109 HA ALA 109 10.382 -11.074 6.246 833 HB1 ALA 109 3HB ALA 109 11.321 -8.864 7.039 834 HB2 ALA 109 1HB ALA 109 11.300 -10.151 8.244 835 HB3 ALA 109 2HB ALA 109 10.081 -8.878 8.293 836 H GLU 110 H GLU 110 7.562 -9.393 7.630 837 HA GLU 110 HA GLU 110 6.710 -11.974 8.825 838 HB2 GLU 110 1HB GLU 110 5.967 -10.849 10.813 839 HB3 GLU 110 2HB GLU 110 7.646 -10.383 10.545 840 HG2 GLU 110 1HG GLU 110 6.786 -8.322 9.350 841 HG3 GLU 110 2HG GLU 110 5.168 -8.757 9.900 842 H LEU 111 H LEU 111 6.030 -10.436 6.327 843 HA LEU 111 HA LEU 111 3.108 -10.424 6.764 844 HB2 LEU 111 1HB LEU 111 4.283 -8.054 6.683 845 HB3 LEU 111 2HB LEU 111 4.332 -8.357 4.952 846 HG LEU 111 HG LEU 111 1.788 -8.562 6.584 847 HD11 LEU 111 1HD1 LEU 111 1.344 -6.294 5.371 848 HD12 LEU 111 2HD1 LEU 111 3.101 -6.208 5.237 849 HD13 LEU 111 3HD1 LEU 111 2.340 -6.301 6.826 850 HD21 LEU 111 3HD2 LEU 111 0.882 -8.073 4.173 851 HD22 LEU 111 1HD2 LEU 111 1.433 -9.700 4.552 852 HD23 LEU 111 2HD2 LEU 111 2.473 -8.609 3.638 853 H LYS 112 H LYS 112 2.128 -11.631 5.365 854 HA LYS 112 HA LYS 112 3.155 -11.944 2.646 855 HB2 LYS 112 1HB LYS 112 4.069 -13.815 4.217 856 HB3 LYS 112 2HB LYS 112 2.428 -14.457 4.131 857 HG2 LYS 112 1HG LYS 112 2.557 -14.577 1.697 858 HG3 LYS 112 2HG LYS 112 4.143 -13.807 1.708 859 HD2 LYS 112 1HD LYS 112 5.040 -15.708 3.022 860 HD3 LYS 112 2HD LYS 112 3.462 -16.492 2.934 861 HE2 LYS 112 1HE LYS 112 3.594 -16.538 0.486 862 HE3 LYS 112 2HE LYS 112 5.148 -15.702 0.539 863 HZ1 LYS 112 3HZ LYS 112 5.186 -18.219 0.339 864 HZ2 LYS 112 1HZ LYS 112 4.702 -18.255 1.963 865 HZ3 LYS 112 2HZ LYS 112 6.175 -17.526 1.533 866 H LEU 113 H LEU 113 1.482 -11.181 1.584 867 HA LEU 113 HA LEU 113 -1.118 -12.526 1.894 868 HB2 LEU 113 1HB LEU 113 -0.676 -9.549 2.103 869 HB3 LEU 113 2HB LEU 113 -2.250 -10.255 1.752 870 HG LEU 113 HG LEU 113 -0.574 -10.880 4.181 871 HD11 LEU 113 1HD1 LEU 113 -1.666 -8.505 3.926 872 HD12 LEU 113 2HD1 LEU 113 -1.796 -9.379 5.450 873 HD13 LEU 113 3HD1 LEU 113 -3.149 -9.367 4.325 874 HD21 LEU 113 3HD2 LEU 113 -3.092 -11.672 4.839 875 HD22 LEU 113 1HD2 LEU 113 -1.911 -12.749 4.100 876 HD23 LEU 113 2HD2 LEU 113 -3.129 -11.966 3.103 877 H VAL 114 H VAL 114 -2.628 -11.881 0.135 878 HA VAL 114 HA VAL 114 -1.168 -11.332 -2.405 879 HB VAL 114 HB VAL 114 -3.454 -13.255 -1.873 880 HG11 VAL 114 1HG1 VAL 114 -3.984 -12.263 -3.965 881 HG12 VAL 114 2HG1 VAL 114 -3.118 -13.742 -4.385 882 HG13 VAL 114 3HG1 VAL 114 -2.290 -12.184 -4.449 883 HG21 VAL 114 3HG2 VAL 114 -0.788 -13.838 -3.171 884 HG22 VAL 114 1HG2 VAL 114 -1.930 -14.972 -2.453 885 HG23 VAL 114 2HG2 VAL 114 -0.988 -13.901 -1.419 886 H PHE 115 H PHE 115 -1.813 -9.425 -3.249 887 HA PHE 115 HA PHE 115 -4.557 -8.479 -2.678 888 HB2 PHE 115 1HB PHE 115 -2.016 -6.968 -3.286 889 HB3 PHE 115 2HB PHE 115 -3.612 -6.218 -3.308 890 HD1 PHE 115 HD1 PHE 115 -4.947 -6.013 -1.244 891 HD2 PHE 115 HD2 PHE 115 -0.983 -7.668 -1.206 892 HE1 PHE 115 HE1 PHE 115 -4.881 -5.787 1.217 893 HE2 PHE 115 HE2 PHE 115 -0.907 -7.426 1.257 894 HZ PHE 115 HZ PHE 115 -2.849 -6.510 2.482 895 H GLN 116 H GLN 116 -5.911 -8.038 -4.280 896 HA GLN 116 HA GLN 116 -5.027 -8.499 -7.051 897 HB2 GLN 116 1HB GLN 116 -7.687 -8.878 -5.718 898 HB3 GLN 116 2HB GLN 116 -7.530 -8.815 -7.468 899 HG2 GLN 116 1HG GLN 116 -5.833 -10.670 -5.797 900 HG3 GLN 116 2HG GLN 116 -7.440 -11.139 -6.348 901 HE21 GLN 116 2HE2 GLN 116 -6.168 -9.041 -8.655 902 HE22 GLN 116 1HE2 GLN 116 -5.523 -10.195 -9.722 903 H LEU 117 H LEU 117 -4.271 -6.342 -7.337 904 HA LEU 117 HA LEU 117 -6.099 -4.121 -7.003 905 HB2 LEU 117 1HB LEU 117 -3.513 -3.920 -8.530 906 HB3 LEU 117 2HB LEU 117 -4.268 -2.744 -7.462 907 HG LEU 117 HG LEU 117 -2.991 -5.359 -6.584 908 HD11 LEU 117 1HD1 LEU 117 -1.435 -3.515 -7.346 909 HD12 LEU 117 2HD1 LEU 117 -1.232 -4.015 -5.667 910 HD13 LEU 117 3HD1 LEU 117 -2.092 -2.523 -6.044 911 HD21 LEU 117 3HD2 LEU 117 -4.518 -3.189 -5.149 912 HD22 LEU 117 1HD2 LEU 117 -3.300 -4.136 -4.295 913 HD23 LEU 117 2HD2 LEU 117 -4.694 -4.940 -5.016 914 HA PRO 118 HA PRO 118 -7.671 -4.372 -11.184 915 HB2 PRO 118 1HB PRO 118 -8.587 -1.861 -11.621 916 HB3 PRO 118 2HB PRO 118 -9.335 -2.939 -10.425 917 HG2 PRO 118 1HG PRO 118 -7.437 -0.682 -10.010 918 HG3 PRO 118 2HG PRO 118 -8.843 -1.159 -9.043 919 HD2 PRO 118 1HD PRO 118 -6.201 -1.780 -8.393 920 HD3 PRO 118 2HD PRO 118 -7.626 -2.670 -7.802 921 H PHE 119 H PHE 119 -6.508 -4.570 -13.003 922 HA PHE 119 HA PHE 119 -4.074 -3.355 -13.538 923 HB2 PHE 119 1HB PHE 119 -4.760 -5.488 -14.475 924 HB3 PHE 119 2HB PHE 119 -6.016 -4.686 -15.406 925 HD1 PHE 119 HD1 PHE 119 -2.330 -4.484 -14.802 926 HD2 PHE 119 HD2 PHE 119 -5.549 -4.049 -17.612 927 HE1 PHE 119 HE1 PHE 119 -0.692 -4.054 -16.609 928 HE2 PHE 119 HE2 PHE 119 -3.911 -3.614 -19.421 929 HZ PHE 119 HZ PHE 119 -1.481 -3.618 -18.919 930 H GLY 120 H GLY 120 -3.366 -1.876 -14.978 931 HA2 GLY 120 1HA GLY 120 -4.263 -0.447 -16.963 932 HA3 GLY 120 2HA GLY 120 -5.281 0.243 -15.702 933 H SER 121 H SER 121 -3.952 2.112 -16.749 934 HA SER 121 HA SER 121 -1.254 2.502 -16.011 935 HB2 SER 121 1HB SER 121 -3.370 4.621 -16.446 936 HB3 SER 121 2HB SER 121 -1.625 4.833 -16.569 937 HG SER 121 HG SER 121 -2.914 2.855 -18.095 938 H HIS 122 H HIS 122 -4.234 2.756 -14.262 939 HA HIS 122 HA HIS 122 -3.399 4.543 -12.226 940 HB2 HIS 122 1HB HIS 122 -5.782 3.763 -12.759 941 HB3 HIS 122 2HB HIS 122 -5.391 2.308 -11.844 942 HD2 HIS 122 HD2 HIS 122 -5.852 2.623 -9.116 943 HE1 HIS 122 HE1 HIS 122 -5.804 6.840 -8.995 944 HE2 HIS 122 HE2 HIS 122 -6.186 4.737 -7.627 945 H THR 123 H THR 123 -3.315 0.964 -12.447 946 HA THR 123 HA THR 123 -2.092 0.710 -9.857 947 HB THR 123 HB THR 123 -2.541 -1.316 -12.047 948 HG1 THR 123 HG1 THR 123 -4.204 -1.961 -10.682 949 HG21 THR 123 3HG2 THR 123 -1.425 -1.559 -9.244 950 HG22 THR 123 1HG2 THR 123 -0.701 -2.118 -10.750 951 HG23 THR 123 2HG2 THR 123 -2.123 -2.931 -10.101 952 H ARG 124 H ARG 124 -1.023 0.606 -13.227 953 HA ARG 124 HA ARG 124 1.551 -0.401 -12.835 954 HB2 ARG 124 1HB ARG 124 0.466 -0.094 -15.045 955 HB3 ARG 124 2HB ARG 124 0.670 1.648 -14.876 956 HG2 ARG 124 1HG ARG 124 3.128 1.315 -14.692 957 HG3 ARG 124 2HG ARG 124 2.885 -0.414 -14.952 958 HD2 ARG 124 1HD ARG 124 2.024 1.762 -16.873 959 HD3 ARG 124 2HD ARG 124 3.488 0.798 -17.046 960 HE ARG 124 HE ARG 124 0.761 -0.080 -17.550 961 HH11 ARG 124 1HH2 ARG 124 4.044 -0.948 -16.889 962 HH12 ARG 124 2HH2 ARG 124 3.908 -2.533 -17.571 963 HH21 ARG 124 1HH1 ARG 124 0.574 -2.159 -18.450 964 HH22 ARG 124 2HH1 ARG 124 1.944 -3.220 -18.454 965 H THR 125 H THR 125 0.343 2.927 -12.679 966 HA THR 125 HA THR 125 2.789 4.250 -12.444 967 HB THR 125 HB THR 125 0.143 4.910 -11.128 968 HG1 THR 125 HG1 THR 125 1.012 6.354 -13.277 969 HG21 THR 125 3HG2 THR 125 2.696 6.476 -11.507 970 HG22 THR 125 1HG2 THR 125 1.801 6.194 -10.013 971 HG23 THR 125 2HG2 THR 125 1.140 7.266 -11.247 972 H PHE 126 H PHE 126 0.762 2.715 -9.985 973 HA PHE 126 HA PHE 126 2.195 3.476 -7.706 974 HB2 PHE 126 1HB PHE 126 -0.014 2.323 -7.688 975 HB3 PHE 126 2HB PHE 126 0.800 0.830 -8.157 976 HD1 PHE 126 HD2 PHE 126 0.336 3.313 -5.475 977 HD2 PHE 126 HD1 PHE 126 2.259 -0.359 -6.602 978 HE1 PHE 126 HE2 PHE 126 0.892 2.878 -3.102 979 HE2 PHE 126 HE1 PHE 126 2.823 -0.790 -4.225 980 HZ PHE 126 HZ PHE 126 2.141 0.830 -2.475 981 H LEU 127 H LEU 127 2.605 0.513 -9.705 982 HA LEU 127 HA LEU 127 4.579 -0.730 -8.284 983 HB2 LEU 127 1HB LEU 127 4.624 -0.488 -11.297 984 HB3 LEU 127 2HB LEU 127 5.247 -1.814 -10.321 985 HG LEU 127 HG LEU 127 2.343 -1.002 -10.579 986 HD11 LEU 127 1HD1 LEU 127 2.131 -3.194 -11.717 987 HD12 LEU 127 2HD1 LEU 127 3.873 -3.428 -11.571 988 HD13 LEU 127 3HD1 LEU 127 3.239 -2.124 -12.575 989 HD21 LEU 127 3HD2 LEU 127 3.781 -3.040 -8.873 990 HD22 LEU 127 1HD2 LEU 127 2.100 -3.288 -9.347 991 HD23 LEU 127 2HD2 LEU 127 2.546 -1.874 -8.393 992 H GLN 128 H GLN 128 5.101 1.747 -10.843 993 HA GLN 128 HA GLN 128 7.881 1.742 -10.710 994 HB2 GLN 128 1HB GLN 128 6.137 4.113 -11.378 995 HB3 GLN 128 2HB GLN 128 7.749 3.749 -11.994 996 HG2 GLN 128 1HG GLN 128 5.207 2.190 -12.539 997 HG3 GLN 128 2HG GLN 128 6.117 3.149 -13.695 998 HE21 GLN 128 2HE2 GLN 128 5.495 0.088 -13.390 999 HE22 GLN 128 1HE2 GLN 128 7.010 -0.627 -13.634 1000 H GLU 129 H GLU 129 5.508 3.685 -8.894 1001 HA GLU 129 HA GLU 129 7.285 5.481 -7.714 1002 HB2 GLU 129 1HB GLU 129 4.728 4.293 -6.629 1003 HB3 GLU 129 2HB GLU 129 5.591 5.623 -5.861 1004 HG2 GLU 129 1HG GLU 129 4.622 5.673 -8.731 1005 HG3 GLU 129 2HG GLU 129 3.722 6.358 -7.380 1006 H VAL 130 H VAL 130 6.315 2.240 -6.628 1007 HA VAL 130 HA VAL 130 7.733 2.270 -4.184 1008 HB VAL 130 HB VAL 130 6.884 -0.016 -5.977 1009 HG11 VAL 130 1HG1 VAL 130 7.176 -1.337 -3.792 1010 HG12 VAL 130 2HG1 VAL 130 8.156 0.020 -3.234 1011 HG13 VAL 130 3HG1 VAL 130 8.651 -0.904 -4.653 1012 HG21 VAL 130 3HG2 VAL 130 5.128 -0.267 -4.217 1013 HG22 VAL 130 1HG2 VAL 130 5.037 1.292 -5.040 1014 HG23 VAL 130 2HG2 VAL 130 5.749 1.184 -3.430 1015 H ALA 131 H ALA 131 8.603 1.199 -7.420 1016 HA ALA 131 HA ALA 131 11.052 0.029 -6.988 1017 HB1 ALA 131 3HB ALA 131 10.550 1.910 -9.292 1018 HB2 ALA 131 1HB ALA 131 9.840 0.299 -9.197 1019 HB3 ALA 131 2HB ALA 131 11.591 0.487 -9.261 1020 H ARG 132 H ARG 132 10.526 3.530 -7.572 1021 HA ARG 132 HA ARG 132 13.311 4.129 -7.038 1022 HB2 ARG 132 1HB ARG 132 10.893 5.880 -7.516 1023 HB3 ARG 132 2HB ARG 132 12.518 6.512 -7.239 1024 HG2 ARG 132 1HG ARG 132 13.361 5.262 -9.174 1025 HG3 ARG 132 2HG ARG 132 11.761 4.569 -9.441 1026 HD2 ARG 132 1HD ARG 132 10.844 6.829 -9.815 1027 HD3 ARG 132 2HD ARG 132 12.441 7.521 -9.543 1028 HE ARG 132 HE ARG 132 13.102 6.755 -11.658 1029 HH11 ARG 132 1HH2 ARG 132 10.008 5.508 -10.727 1030 HH12 ARG 132 2HH2 ARG 132 9.623 4.906 -12.305 1031 HH21 ARG 132 1HH1 ARG 132 12.603 5.962 -13.729 1032 HH22 ARG 132 2HH1 ARG 132 11.090 5.162 -14.003 1033 H ALA 133 H ALA 133 10.494 3.718 -5.179 1034 HA ALA 133 HA ALA 133 10.902 5.539 -3.082 1035 HB1 ALA 133 3HB ALA 133 9.665 2.792 -2.840 1036 HB2 ALA 133 1HB ALA 133 8.825 4.198 -3.487 1037 HB3 ALA 133 2HB ALA 133 9.368 4.188 -1.819 1038 H CYS 134 H CYS 134 12.578 2.624 -3.865 1039 HA CYS 134 HA CYS 134 14.748 2.963 -2.271 1040 HB2 CYS 134 1HB CYS 134 12.468 2.081 -0.613 1041 HB3 CYS 134 2HB CYS 134 13.926 1.124 -0.383 1042 HG CYS 134 HG CYS 134 15.201 3.439 0.096 1043 HA PRO 135 HA PRO 135 14.587 -1.859 -2.801 1044 HB2 PRO 135 1HB PRO 135 12.367 -2.759 -4.261 1045 HB3 PRO 135 2HB PRO 135 12.539 -2.851 -2.497 1046 HG2 PRO 135 1HG PRO 135 11.133 -0.798 -4.151 1047 HG3 PRO 135 2HG PRO 135 10.623 -1.563 -2.633 1048 HD2 PRO 135 1HD PRO 135 11.619 0.909 -2.608 1049 HD3 PRO 135 2HD PRO 135 12.074 -0.240 -1.330 1050 H GLY 136 H GLY 136 12.611 -0.620 -5.515 1051 HA2 GLY 136 1HA GLY 136 13.013 -0.900 -7.821 1052 HA3 GLY 136 2HA GLY 136 14.312 0.208 -7.394 1053 H PHE 137 H PHE 137 13.561 -3.265 -7.262 1054 HA PHE 137 HA PHE 137 15.065 -5.065 -7.191 1055 HB2 PHE 137 1HB PHE 137 15.266 -3.813 -9.930 1056 HB3 PHE 137 2HB PHE 137 15.901 -5.412 -9.542 1057 HD1 PHE 137 HD2 PHE 137 14.336 -7.189 -8.665 1058 HD2 PHE 137 HD1 PHE 137 12.930 -3.465 -10.280 1059 HE1 PHE 137 HE2 PHE 137 12.073 -8.164 -8.944 1060 HE2 PHE 137 HE1 PHE 137 10.667 -4.440 -10.557 1061 HZ PHE 137 HZ PHE 137 10.239 -6.790 -9.889 1062 H ASP 138 H ASP 138 16.600 -4.207 -5.598 1063 HA ASP 138 HA ASP 138 19.254 -4.385 -6.485 1064 HB2 ASP 138 1HB ASP 138 18.100 -1.649 -6.300 1065 HB3 ASP 138 2HB ASP 138 19.706 -1.858 -5.613 1066 HA PRO 139 HA PRO 139 18.763 -5.200 -2.009 1067 HB2 PRO 139 1HB PRO 139 20.987 -6.749 -1.649 1068 HB3 PRO 139 2HB PRO 139 19.492 -7.363 -2.383 1069 HG2 PRO 139 1HG PRO 139 22.017 -6.476 -3.700 1070 HG3 PRO 139 2HG PRO 139 20.968 -7.851 -4.088 1071 HD2 PRO 139 1HD PRO 139 20.931 -5.481 -5.476 1072 HD3 PRO 139 2HD PRO 139 19.517 -6.555 -5.350 1073 H GLU 140 H GLU 140 21.314 -3.626 -3.637 1074 HA GLU 140 HA GLU 140 22.992 -2.963 -1.433 1075 HB2 GLU 140 1HB GLU 140 23.802 -1.127 -2.971 1076 HB3 GLU 140 2HB GLU 140 23.904 -2.762 -3.630 1077 HG2 GLU 140 1HG GLU 140 21.848 -2.442 -4.881 1078 HG3 GLU 140 2HG GLU 140 21.601 -0.861 -4.140 1079 H THR 141 H THR 141 20.072 -1.553 -2.759 1080 HA THR 141 HA THR 141 20.174 0.999 -1.583 1081 HB THR 141 HB THR 141 18.584 0.195 -3.376 1082 HG1 THR 141 HG1 THR 141 16.902 1.488 -2.575 1083 HG21 THR 141 3HG2 THR 141 16.865 -1.271 -2.934 1084 HG22 THR 141 1HG2 THR 141 16.687 -0.721 -1.270 1085 HG23 THR 141 2HG2 THR 141 17.975 -1.849 -1.692 1086 H ARG 142 H ARG 142 21.091 -0.782 0.400 1087 HA ARG 142 HA ARG 142 19.155 -1.565 2.287 1088 HB2 ARG 142 1HB ARG 142 22.063 -0.813 2.614 1089 HB3 ARG 142 2HB ARG 142 21.080 -1.535 3.888 1090 HG2 ARG 142 1HG ARG 142 20.623 -3.477 2.441 1091 HG3 ARG 142 2HG ARG 142 21.609 -2.757 1.166 1092 HD2 ARG 142 1HD ARG 142 23.567 -2.785 2.677 1093 HD3 ARG 142 2HD ARG 142 22.581 -3.537 3.930 1094 HE ARG 142 HE ARG 142 22.535 -5.011 1.462 1095 HH11 ARG 142 1HH2 ARG 142 24.304 -4.352 4.360 1096 HH12 ARG 142 2HH2 ARG 142 25.115 -5.883 4.376 1097 HH21 ARG 142 1HH1 ARG 142 23.590 -7.015 1.474 1098 HH22 ARG 142 2HH1 ARG 142 24.710 -7.392 2.740 1099 H ASP 143 H ASP 143 19.732 -0.584 4.655 1100 HA ASP 143 HA ASP 143 19.527 1.163 6.149 1101 HB2 ASP 143 1HB ASP 143 19.444 3.179 3.921 1102 HB3 ASP 143 2HB ASP 143 20.095 3.343 5.548 1103 HA PRO 144 HA PRO 144 15.019 0.999 4.763 1104 HB2 PRO 144 1HB PRO 144 14.852 -0.042 7.573 1105 HB3 PRO 144 2HB PRO 144 14.024 -0.615 6.111 1106 HG2 PRO 144 1HG PRO 144 16.046 -1.987 7.117 1107 HG3 PRO 144 2HG PRO 144 15.887 -1.783 5.361 1108 HD2 PRO 144 1HD PRO 144 17.732 -0.352 7.261 1109 HD3 PRO 144 2HD PRO 144 18.061 -0.971 5.626 1110 H GLU 145 H GLU 145 16.649 2.044 7.683 1111 HA GLU 145 HA GLU 145 16.252 3.767 9.187 1112 HB2 GLU 145 1HB GLU 145 17.082 4.904 7.106 1113 HB3 GLU 145 2HB GLU 145 15.401 5.178 6.648 1114 HG2 GLU 145 1HG GLU 145 16.163 7.174 7.747 1115 HG3 GLU 145 2HG GLU 145 15.085 6.352 8.870 1116 H PHE 146 H PHE 146 14.369 2.437 9.987 1117 HA PHE 146 HA PHE 146 11.730 3.512 9.271 1118 HB2 PHE 146 1HB PHE 146 11.084 1.648 11.041 1119 HB3 PHE 146 2HB PHE 146 11.535 1.206 9.395 1120 HD1 PHE 146 HD1 PHE 146 13.187 1.958 12.682 1121 HD2 PHE 146 HD2 PHE 146 13.157 -0.467 9.135 1122 HE1 PHE 146 HE1 PHE 146 15.085 0.639 13.568 1123 HE2 PHE 146 HE2 PHE 146 15.057 -1.787 10.025 1124 HZ PHE 146 HZ PHE 146 16.022 -1.233 12.242 1125 H GLU 147 H GLU 147 14.020 4.699 11.037 1126 HA GLU 147 HA GLU 147 13.129 4.914 13.679 1127 HB2 GLU 147 1HB GLU 147 15.378 5.576 12.813 1128 HB3 GLU 147 2HB GLU 147 14.637 7.012 12.109 1129 HG2 GLU 147 1HG GLU 147 15.545 7.662 14.238 1130 HG3 GLU 147 2HG GLU 147 13.798 7.595 14.433 1131 H TRP 148 H TRP 148 12.144 6.720 10.819 1132 HA TRP 148 HA TRP 148 10.696 8.693 12.383 1133 HB2 TRP 148 1HB TRP 148 9.985 9.598 10.210 1134 HB3 TRP 148 2HB TRP 148 11.734 9.403 10.306 1135 HD1 TRP 148 HD1 TRP 148 12.678 7.004 9.200 1136 HE1 TRP 148 HE1 TRP 148 11.903 5.842 7.041 1137 HE3 TRP 148 HE3 TRP 148 8.129 9.242 8.588 1138 HZ2 TRP 148 HZ2 TRP 148 9.647 5.871 5.264 1139 HZ3 TRP 148 HZ3 TRP 148 6.692 8.665 6.654 1140 HH2 TRP 148 HH2 TRP 148 7.435 6.986 4.990 1141 H LEU 149 H LEU 149 9.991 5.577 11.081 1142 HA LEU 149 HA LEU 149 7.221 5.842 10.608 1143 HB2 LEU 149 1HB LEU 149 9.018 3.540 11.302 1144 HB3 LEU 149 2HB LEU 149 7.282 3.293 11.305 1145 HG LEU 149 HG LEU 149 8.515 2.756 9.125 1146 HD11 LEU 149 1HD1 LEU 149 6.434 4.884 8.645 1147 HD12 LEU 149 2HD1 LEU 149 5.987 3.370 9.427 1148 HD13 LEU 149 3HD1 LEU 149 6.682 3.351 7.812 1149 HD21 LEU 149 3HD2 LEU 149 9.900 4.932 9.341 1150 HD22 LEU 149 1HD2 LEU 149 8.476 5.734 8.686 1151 HD23 LEU 149 2HD2 LEU 149 9.300 4.497 7.743 1152 H SER 150 H SER 150 9.058 5.173 13.558 1153 HA SER 150 HA SER 150 7.078 4.461 15.322 1154 HB2 SER 150 1HB SER 150 8.439 5.477 17.069 1155 HB3 SER 150 2HB SER 150 9.489 4.703 15.885 1156 HG SER 150 HG SER 150 9.518 7.212 16.661 1157 H ARG 151 H ARG 151 7.764 7.621 13.955 1158 HA ARG 151 HA ARG 151 6.157 9.225 15.610 1159 HB2 ARG 151 1HB ARG 151 6.611 9.536 12.626 1160 HB3 ARG 151 2HB ARG 151 6.181 10.811 13.760 1161 HG2 ARG 151 1HG ARG 151 8.710 9.203 14.140 1162 HG3 ARG 151 2HG ARG 151 8.674 10.578 13.044 1163 HD2 ARG 151 1HD ARG 151 7.969 12.049 14.853 1164 HD3 ARG 151 2HD ARG 151 7.876 10.689 15.963 1165 HE ARG 151 HE ARG 151 10.213 10.659 16.092 1166 HH11 ARG 151 1HH2 ARG 151 9.053 12.854 13.679 1167 HH12 ARG 151 2HH2 ARG 151 10.590 13.610 13.432 1168 HH21 ARG 151 1HH1 ARG 151 12.231 11.638 15.765 1169 HH22 ARG 151 2HH1 ARG 151 12.391 12.920 14.611 1170 H HIS 152 H HIS 152 5.489 7.345 12.722 1171 HA HIS 152 HA HIS 152 2.694 8.058 12.656 1172 HB2 HIS 152 1HB HIS 152 4.300 5.961 11.177 1173 HB3 HIS 152 2HB HIS 152 2.594 6.294 10.882 1174 HD2 HIS 152 HD2 HIS 152 6.020 7.655 9.792 1175 HE1 HIS 152 HE1 HIS 152 3.178 10.561 8.664 1176 HE2 HIS 152 HE2 HIS 152 5.596 9.829 8.415 1177 H THR 153 H THR 153 0.985 6.764 13.234 1178 HA THR 153 HA THR 153 1.416 4.139 14.389 1179 HB THR 153 HB THR 153 1.877 5.455 16.365 1180 HG1 THR 153 HG1 THR 153 -0.160 3.803 16.099 1181 HG21 THR 153 3HG2 THR 153 0.484 7.207 17.160 1182 HG22 THR 153 1HG2 THR 153 -0.818 6.780 16.051 1183 HG23 THR 153 2HG2 THR 153 0.660 7.516 15.432 1184 H CYS 154 H CYS 154 -0.464 2.919 14.459 1185 HA CYS 154 HA CYS 154 -2.490 3.668 12.645 1186 HB2 CYS 154 1HB CYS 154 -3.616 1.563 13.597 1187 HB3 CYS 154 2HB CYS 154 -2.048 1.361 12.813 1188 HG CYS 154 HG CYS 154 -2.597 1.016 15.819 1189 H ALA 155 H ALA 155 -4.641 4.108 13.000 1190 HA ALA 155 HA ALA 155 -6.425 5.156 14.009 1191 HB1 ALA 155 3HB ALA 155 -5.377 3.994 16.592 1192 HB2 ALA 155 1HB ALA 155 -6.253 3.035 15.399 1193 HB3 ALA 155 2HB ALA 155 -7.044 4.401 16.184 1194 H GLU 156 H GLU 156 -6.898 6.566 16.172 1195 HA GLU 156 HA GLU 156 -4.727 8.588 16.279 1196 HB2 GLU 156 1HB GLU 156 -7.715 8.851 16.687 1197 HB3 GLU 156 2HB GLU 156 -6.552 10.153 16.937 1198 HG2 GLU 156 1HG GLU 156 -5.881 10.095 14.619 1199 HG3 GLU 156 2HG GLU 156 -6.827 8.637 14.330 1200 HA PRO 157 HA PRO 157 -4.439 6.700 20.482 1201 HB2 PRO 157 1HB PRO 157 -2.355 8.861 20.575 1202 HB3 PRO 157 2HB PRO 157 -2.266 7.186 21.160 1203 HG2 PRO 157 1HG PRO 157 -1.088 7.868 18.897 1204 HG3 PRO 157 2HG PRO 157 -1.956 6.326 19.033 1205 HD2 PRO 157 1HD PRO 157 -2.804 8.844 17.638 1206 HD3 PRO 157 2HD PRO 157 -3.098 7.151 17.184 1207 H ASP 158 H ASP 158 -4.324 7.798 22.700 1208 HA ASP 158 HA ASP 158 -6.547 9.535 22.966 1209 HB2 ASP 158 1HB ASP 158 -4.395 8.675 24.905 1210 HB3 ASP 158 2HB ASP 158 -5.764 9.684 25.367 1211 H ALA 159 H ALA 159 -6.687 11.698 23.400 1212 HA ALA 159 HA ALA 159 -4.776 13.425 22.286 1213 HB1 ALA 159 3HB ALA 159 -7.232 13.908 22.685 1214 HB2 ALA 159 1HB ALA 159 -6.127 15.218 23.099 1215 HB3 ALA 159 2HB ALA 159 -6.815 14.209 24.371 1216 H GLU 160 H GLU 160 -5.299 12.385 25.631 1217 HA GLU 160 HA GLU 160 -4.040 12.646 27.526 1218 HB2 GLU 160 1HB GLU 160 -1.875 12.902 25.429 1219 HB3 GLU 160 2HB GLU 160 -1.555 12.798 27.159 1220 HG2 GLU 160 1HG GLU 160 -2.644 10.629 27.280 1221 HG3 GLU 160 2HG GLU 160 -3.126 10.738 25.588 1222 H SER 161 H SER 161 -5.402 14.957 26.656 1223 HA SER 161 HA SER 161 -3.862 16.973 28.043 1224 HB2 SER 161 1HB SER 161 -3.598 18.525 26.301 1225 HB3 SER 161 2HB SER 161 -3.130 16.996 25.563 1226 HG SER 161 HG SER 161 -4.634 17.448 24.171 Start of MODEL 11 1 H1 GLY 1 1H GLY 1 -18.445 15.666 -7.163 2 H2 GLY 1 2H GLY 1 -19.017 16.918 -8.158 3 H3 GLY 1 3H GLY 1 -20.057 16.178 -7.036 4 HA2 GLY 1 1HA GLY 1 -19.499 18.177 -6.018 5 HA3 GLY 1 2HA GLY 1 -18.445 16.982 -5.260 6 HA PRO 2 HA PRO 2 -16.009 20.517 -7.307 7 HB2 PRO 2 1HB PRO 2 -14.931 21.548 -4.981 8 HB3 PRO 2 2HB PRO 2 -16.444 22.127 -5.707 9 HG2 PRO 2 1HG PRO 2 -16.047 20.216 -3.443 10 HG3 PRO 2 2HG PRO 2 -17.226 21.530 -3.614 11 HD2 PRO 2 1HD PRO 2 -17.902 18.931 -4.038 12 HD3 PRO 2 2HD PRO 2 -18.650 20.258 -4.956 13 H LEU 3 H LEU 3 -15.423 18.014 -4.961 14 HA LEU 3 HA LEU 3 -12.603 18.038 -4.903 15 HB2 LEU 3 1HB LEU 3 -14.696 15.925 -4.419 16 HB3 LEU 3 2HB LEU 3 -12.989 15.482 -4.433 17 HG LEU 3 HG LEU 3 -12.529 17.172 -2.695 18 HD11 LEU 3 1HD1 LEU 3 -14.569 18.186 -1.552 19 HD12 LEU 3 2HD1 LEU 3 -15.500 17.678 -2.962 20 HD13 LEU 3 3HD1 LEU 3 -14.183 18.837 -3.144 21 HD21 LEU 3 3HD2 LEU 3 -13.213 14.832 -2.076 22 HD22 LEU 3 1HD2 LEU 3 -14.872 15.410 -1.910 23 HD23 LEU 3 2HD2 LEU 3 -13.610 16.029 -0.842 24 H GLY 4 H GLY 4 -14.904 16.406 -7.065 25 HA2 GLY 4 1HA GLY 4 -14.455 16.163 -9.408 26 HA3 GLY 4 2HA GLY 4 -12.733 16.095 -9.049 27 H SER 5 H SER 5 -15.786 14.326 -8.671 28 HA SER 5 HA SER 5 -16.232 12.075 -8.462 29 HB2 SER 5 1HB SER 5 -15.499 11.952 -10.719 30 HB3 SER 5 2HB SER 5 -13.810 12.120 -10.253 31 HG SER 5 HG SER 5 -15.539 9.919 -10.029 32 H MET 6 H MET 6 -13.896 13.460 -6.789 33 HA MET 6 HA MET 6 -12.477 12.848 -5.080 34 HB2 MET 6 1HB MET 6 -14.462 10.562 -5.032 35 HB3 MET 6 2HB MET 6 -13.220 10.795 -3.803 36 HG2 MET 6 1HG MET 6 -14.125 13.016 -3.273 37 HG3 MET 6 2HG MET 6 -15.341 12.838 -4.539 38 HE1 MET 6 3HE MET 6 -16.377 13.576 -1.700 39 HE2 MET 6 1HE MET 6 -17.758 12.470 -1.669 40 HE3 MET 6 2HE MET 6 -17.293 13.265 -3.172 41 H ASP 7 H ASP 7 -11.196 10.745 -4.216 42 HA ASP 7 HA ASP 7 -10.443 8.799 -6.151 43 HB2 ASP 7 1HB ASP 7 -9.371 10.813 -7.163 44 HB3 ASP 7 2HB ASP 7 -8.430 11.010 -5.686 45 H GLN 8 H GLN 8 -8.397 7.664 -5.432 46 HA GLN 8 HA GLN 8 -8.637 7.081 -2.616 47 HB2 GLN 8 1HB GLN 8 -6.906 6.028 -4.843 48 HB3 GLN 8 2HB GLN 8 -6.611 5.565 -3.166 49 HG2 GLN 8 1HG GLN 8 -8.013 3.881 -4.059 50 HG3 GLN 8 2HG GLN 8 -9.061 4.881 -3.061 51 HE21 GLN 8 2HE2 GLN 8 -10.603 3.654 -4.737 52 HE22 GLN 8 1HE2 GLN 8 -10.965 4.534 -6.136 53 H SER 9 H SER 9 -6.138 8.492 -4.694 54 HA SER 9 HA SER 9 -4.129 8.850 -2.819 55 HB2 SER 9 1HB SER 9 -3.591 9.360 -5.065 56 HB3 SER 9 2HB SER 9 -4.910 10.519 -5.202 57 HG SER 9 HG SER 9 -3.757 11.686 -3.470 58 H VAL 10 H VAL 10 -6.789 11.093 -3.582 59 HA VAL 10 HA VAL 10 -6.039 13.026 -1.637 60 HB VAL 10 HB VAL 10 -8.716 12.462 -2.933 61 HG11 VAL 10 1HG1 VAL 10 -7.719 14.701 -1.167 62 HG12 VAL 10 2HG1 VAL 10 -9.202 13.757 -1.016 63 HG13 VAL 10 3HG1 VAL 10 -9.045 14.947 -2.305 64 HG21 VAL 10 3HG2 VAL 10 -8.099 14.214 -4.481 65 HG22 VAL 10 1HG2 VAL 10 -6.768 13.058 -4.434 66 HG23 VAL 10 2HG2 VAL 10 -6.643 14.584 -3.560 67 H ALA 11 H ALA 11 -8.406 10.398 -1.647 68 HA ALA 11 HA ALA 11 -9.684 10.680 0.721 69 HB1 ALA 11 3HB ALA 11 -9.652 8.130 0.889 70 HB2 ALA 11 1HB ALA 11 -8.651 8.157 -0.559 71 HB3 ALA 11 2HB ALA 11 -10.282 8.813 -0.611 72 H ILE 12 H ILE 12 -6.452 9.234 0.332 73 HA ILE 12 HA ILE 12 -6.079 8.613 3.051 74 HB ILE 12 HB ILE 12 -3.998 9.321 0.977 75 HG12 ILE 12 1HG1 ILE 12 -5.458 7.524 0.205 76 HG13 ILE 12 2HG1 ILE 12 -3.887 6.862 0.625 77 HG21 ILE 12 1HG2 ILE 12 -3.865 8.024 3.693 78 HG22 ILE 12 2HG2 ILE 12 -2.869 9.319 3.034 79 HG23 ILE 12 3HG2 ILE 12 -2.653 7.667 2.463 80 HD11 ILE 12 3HD1 ILE 12 -5.051 6.477 2.989 81 HD12 ILE 12 1HD1 ILE 12 -5.294 5.338 1.666 82 HD13 ILE 12 2HD1 ILE 12 -6.520 6.552 2.020 83 H GLN 13 H GLN 13 -5.002 11.384 1.181 84 HA GLN 13 HA GLN 13 -3.619 12.824 3.020 85 HB2 GLN 13 1HB GLN 13 -4.545 13.447 0.559 86 HB3 GLN 13 2HB GLN 13 -5.626 14.458 1.518 87 HG2 GLN 13 1HG GLN 13 -3.695 15.790 1.042 88 HG3 GLN 13 2HG GLN 13 -3.563 15.305 2.731 89 HE21 GLN 13 2HE2 GLN 13 -1.485 14.525 3.272 90 HE22 GLN 13 1HE2 GLN 13 -0.446 13.755 2.174 91 H GLU 14 H GLU 14 -7.175 12.787 2.757 92 HA GLU 14 HA GLU 14 -7.759 14.565 4.806 93 HB2 GLU 14 1HB GLU 14 -9.174 12.139 3.709 94 HB3 GLU 14 2HB GLU 14 -9.872 13.067 5.033 95 HG2 GLU 14 1HG GLU 14 -10.816 13.995 3.058 96 HG3 GLU 14 2HG GLU 14 -9.563 15.137 3.529 97 H THR 15 H THR 15 -6.448 11.395 4.926 98 HA THR 15 HA THR 15 -7.070 10.981 7.763 99 HB THR 15 HB THR 15 -6.174 8.824 7.530 100 HG1 THR 15 HG1 THR 15 -5.037 8.511 5.328 101 HG21 THR 15 3HG2 THR 15 -7.221 7.943 5.500 102 HG22 THR 15 1HG2 THR 15 -7.276 9.565 4.811 103 HG23 THR 15 2HG2 THR 15 -8.246 9.181 6.229 104 H LEU 16 H LEU 16 -4.425 12.123 5.798 105 HA LEU 16 HA LEU 16 -2.474 11.872 7.953 106 HB2 LEU 16 1HB LEU 16 -2.388 12.830 5.102 107 HB3 LEU 16 2HB LEU 16 -1.090 13.280 6.206 108 HG LEU 16 HG LEU 16 -0.634 10.938 6.695 109 HD11 LEU 16 1HD1 LEU 16 -2.700 9.823 6.597 110 HD12 LEU 16 2HD1 LEU 16 -1.879 9.238 5.151 111 HD13 LEU 16 3HD1 LEU 16 -3.102 10.503 5.022 112 HD21 LEU 16 3HD2 LEU 16 0.292 12.106 4.610 113 HD22 LEU 16 1HD2 LEU 16 -0.913 11.198 3.694 114 HD23 LEU 16 2HD2 LEU 16 0.338 10.342 4.595 115 H VAL 17 H VAL 17 -1.335 13.690 8.822 116 HA VAL 17 HA VAL 17 -3.095 16.000 9.264 117 HB VAL 17 HB VAL 17 -1.529 16.559 11.090 118 HG11 VAL 17 1HG1 VAL 17 -2.218 13.619 11.256 119 HG12 VAL 17 2HG1 VAL 17 -3.447 14.880 11.345 120 HG13 VAL 17 3HG1 VAL 17 -2.176 14.802 12.564 121 HG21 VAL 17 3HG2 VAL 17 0.535 15.689 10.080 122 HG22 VAL 17 1HG2 VAL 17 -0.092 14.044 10.184 123 HG23 VAL 17 2HG2 VAL 17 0.271 14.946 11.656 124 H GLU 18 H GLU 18 -1.517 18.077 9.678 125 HA GLU 18 HA GLU 18 -0.588 18.736 7.048 126 HB2 GLU 18 1HB GLU 18 -0.578 20.217 9.677 127 HB3 GLU 18 2HB GLU 18 -0.005 20.920 8.163 128 HG2 GLU 18 1HG GLU 18 -2.182 20.621 7.136 129 HG3 GLU 18 2HG GLU 18 -2.772 19.742 8.547 130 H GLY 19 H GLY 19 1.300 17.971 6.326 131 HA2 GLY 19 1HA GLY 19 3.761 18.791 6.763 132 HA3 GLY 19 2HA GLY 19 3.605 17.720 8.149 133 H GLU 20 H GLU 20 2.002 15.714 6.788 134 HA GLU 20 HA GLU 20 4.171 14.321 5.451 135 HB2 GLU 20 1HB GLU 20 1.378 13.480 6.228 136 HB3 GLU 20 2HB GLU 20 2.493 12.436 5.342 137 HG2 GLU 20 1HG GLU 20 4.136 12.610 7.135 138 HG3 GLU 20 2HG GLU 20 3.098 13.726 8.019 139 H TYR 21 H TYR 21 3.912 13.253 3.443 140 HA TYR 21 HA TYR 21 2.215 14.711 1.487 141 HB2 TYR 21 1HB TYR 21 4.644 15.314 1.413 142 HB3 TYR 21 2HB TYR 21 5.002 13.625 1.049 143 HD1 TYR 21 HD2 TYR 21 3.421 16.720 -0.206 144 HD2 TYR 21 HD1 TYR 21 4.491 12.658 -1.097 145 HE1 TYR 21 HE2 TYR 21 2.967 17.127 -2.610 146 HE2 TYR 21 HE1 TYR 21 4.038 13.064 -3.500 147 HH TYR 21 HH TYR 21 2.858 16.231 -4.635 148 H CYS 22 H CYS 22 0.841 13.449 0.417 149 HA CYS 22 HA CYS 22 1.214 10.537 0.428 150 HB2 CYS 22 1HB CYS 22 -1.044 11.741 0.840 151 HB3 CYS 22 2HB CYS 22 -1.058 12.016 -0.901 152 HG CYS 22 HG CYS 22 -0.727 9.285 -1.052 153 H VAL 23 H VAL 23 1.758 9.365 -1.409 154 HA VAL 23 HA VAL 23 2.548 10.981 -3.769 155 HB VAL 23 HB VAL 23 3.473 8.254 -2.841 156 HG11 VAL 23 1HG1 VAL 23 3.648 8.452 -5.254 157 HG12 VAL 23 2HG1 VAL 23 5.258 8.632 -4.561 158 HG13 VAL 23 3HG1 VAL 23 4.371 10.054 -5.111 159 HG21 VAL 23 3HG2 VAL 23 4.922 10.915 -2.812 160 HG22 VAL 23 1HG2 VAL 23 5.509 9.381 -2.170 161 HG23 VAL 23 2HG2 VAL 23 4.150 10.197 -1.401 162 H ILE 24 H ILE 24 1.243 7.778 -2.901 163 HA ILE 24 HA ILE 24 -0.704 7.902 -5.014 164 HB ILE 24 HB ILE 24 1.256 7.381 -6.345 165 HG12 ILE 24 1HG1 ILE 24 0.556 5.253 -7.354 166 HG13 ILE 24 2HG1 ILE 24 -0.432 4.889 -5.942 167 HG21 ILE 24 1HG2 ILE 24 2.572 5.348 -5.932 168 HG22 ILE 24 2HG2 ILE 24 1.618 5.017 -4.492 169 HG23 ILE 24 3HG2 ILE 24 2.645 6.447 -4.557 170 HD11 ILE 24 3HD1 ILE 24 -0.854 7.455 -7.470 171 HD12 ILE 24 1HD1 ILE 24 -1.990 6.573 -6.449 172 HD13 ILE 24 2HD1 ILE 24 -1.569 5.948 -8.042 173 H ALA 25 H ALA 25 -2.412 6.770 -4.451 174 HA ALA 25 HA ALA 25 -2.155 4.388 -2.747 175 HB1 ALA 25 3HB ALA 25 -2.524 6.397 -1.254 176 HB2 ALA 25 1HB ALA 25 -3.802 5.188 -1.168 177 HB3 ALA 25 2HB ALA 25 -4.051 6.656 -2.095 178 H VAL 26 H VAL 26 -3.300 2.840 -3.682 179 HA VAL 26 HA VAL 26 -5.664 3.600 -5.298 180 HB VAL 26 HB VAL 26 -3.668 2.503 -6.446 181 HG11 VAL 26 1HG1 VAL 26 -3.299 0.936 -4.457 182 HG12 VAL 26 2HG1 VAL 26 -3.188 0.212 -6.061 183 HG13 VAL 26 3HG1 VAL 26 -4.642 -0.013 -5.090 184 HG21 VAL 26 3HG2 VAL 26 -5.162 1.761 -8.014 185 HG22 VAL 26 1HG2 VAL 26 -6.441 2.150 -6.868 186 HG23 VAL 26 2HG2 VAL 26 -5.791 0.517 -6.941 187 H GLN 27 H GLN 27 -6.686 0.956 -5.495 188 HA GLN 27 HA GLN 27 -7.313 0.227 -2.721 189 HB2 GLN 27 1HB GLN 27 -9.039 1.800 -3.831 190 HB3 GLN 27 2HB GLN 27 -9.441 0.422 -4.849 191 HG2 GLN 27 1HG GLN 27 -9.412 0.267 -1.825 192 HG3 GLN 27 2HG GLN 27 -10.850 0.691 -2.749 193 HE21 GLN 27 2HE2 GLN 27 -10.641 -1.708 -1.144 194 HE22 GLN 27 1HE2 GLN 27 -10.740 -3.034 -2.198 195 H GLY 28 H GLY 28 -6.955 -1.839 -2.445 196 HA2 GLY 28 1HA GLY 28 -7.157 -3.677 -4.784 197 HA3 GLY 28 2HA GLY 28 -5.987 -3.860 -3.481 198 H VAL 29 H VAL 29 -7.030 -6.027 -3.584 199 HA VAL 29 HA VAL 29 -9.219 -6.151 -1.602 200 HB VAL 29 HB VAL 29 -9.006 -7.697 -4.192 201 HG11 VAL 29 1HG1 VAL 29 -11.068 -8.904 -3.276 202 HG12 VAL 29 2HG1 VAL 29 -10.600 -8.288 -1.693 203 HG13 VAL 29 3HG1 VAL 29 -9.522 -9.372 -2.569 204 HG21 VAL 29 3HG2 VAL 29 -11.380 -6.253 -3.012 205 HG22 VAL 29 1HG2 VAL 29 -11.127 -6.755 -4.684 206 HG23 VAL 29 2HG2 VAL 29 -10.191 -5.421 -4.014 207 H LEU 30 H LEU 30 -9.224 -8.081 -0.386 208 HA LEU 30 HA LEU 30 -6.784 -9.732 -0.501 209 HB2 LEU 30 1HB LEU 30 -6.721 -7.774 1.284 210 HB3 LEU 30 2HB LEU 30 -7.830 -8.800 2.187 211 HG LEU 30 HG LEU 30 -5.679 -9.396 2.972 212 HD11 LEU 30 1HD1 LEU 30 -5.415 -11.698 2.369 213 HD12 LEU 30 2HD1 LEU 30 -6.165 -11.454 0.801 214 HD13 LEU 30 3HD1 LEU 30 -7.136 -11.346 2.269 215 HD21 LEU 30 3HD2 LEU 30 -4.043 -10.183 0.873 216 HD22 LEU 30 1HD2 LEU 30 -3.964 -8.641 1.707 217 HD23 LEU 30 2HD2 LEU 30 -4.857 -8.767 0.208 218 H CYS 31 H CYS 31 -7.558 -11.808 -0.681 219 HA CYS 31 HA CYS 31 -10.159 -12.414 0.595 220 HB2 CYS 31 1HB CYS 31 -8.851 -13.806 -1.746 221 HB3 CYS 31 2HB CYS 31 -10.492 -14.032 -1.141 222 HG CYS 31 HG CYS 31 -9.521 -11.653 -2.852 223 H LYS 32 H LYS 32 -10.311 -14.126 1.868 224 HA LYS 32 HA LYS 32 -7.945 -15.869 2.252 225 HB2 LYS 32 1HB LYS 32 -9.677 -14.689 4.448 226 HB3 LYS 32 2HB LYS 32 -8.415 -15.903 4.679 227 HG2 LYS 32 1HG LYS 32 -6.745 -14.346 3.737 228 HG3 LYS 32 2HG LYS 32 -8.002 -13.127 3.535 229 HD2 LYS 32 1HD LYS 32 -8.411 -13.176 5.988 230 HD3 LYS 32 2HD LYS 32 -7.091 -14.336 6.162 231 HE2 LYS 32 1HE LYS 32 -5.536 -12.694 5.143 232 HE3 LYS 32 2HE LYS 32 -6.859 -11.534 5.035 233 HZ1 LYS 32 3HZ LYS 32 -5.385 -11.306 7.028 234 HZ2 LYS 32 1HZ LYS 32 -6.009 -12.781 7.585 235 HZ3 LYS 32 2HZ LYS 32 -7.043 -11.449 7.370 236 H GLY 33 H GLY 33 -8.473 -17.908 1.883 237 HA2 GLY 33 1HA GLY 33 -9.718 -19.799 1.544 238 HA3 GLY 33 2HA GLY 33 -10.611 -19.299 2.975 239 H ASP 34 H ASP 34 -12.586 -18.272 2.760 240 HA ASP 34 HA ASP 34 -13.636 -17.809 0.042 241 HB2 ASP 34 1HB ASP 34 -14.877 -19.524 2.204 242 HB3 ASP 34 2HB ASP 34 -15.811 -18.847 0.870 243 H SER 35 H SER 35 -12.652 -16.204 2.362 244 HA SER 35 HA SER 35 -15.098 -14.655 3.018 245 HB2 SER 35 1HB SER 35 -12.385 -14.680 4.380 246 HB3 SER 35 2HB SER 35 -13.781 -13.728 4.880 247 HG SER 35 HG SER 35 -13.245 -16.057 5.735 248 H ARG 36 H ARG 36 -15.338 -12.891 1.759 249 HA ARG 36 HA ARG 36 -12.996 -11.746 0.418 250 HB2 ARG 36 1HB ARG 36 -15.949 -11.120 0.157 251 HB3 ARG 36 2HB ARG 36 -14.670 -10.427 -0.838 252 HG2 ARG 36 1HG ARG 36 -15.028 -13.417 -0.622 253 HG3 ARG 36 2HG ARG 36 -15.965 -12.471 -1.777 254 HD2 ARG 36 1HD ARG 36 -13.812 -11.569 -2.694 255 HD3 ARG 36 2HD ARG 36 -12.938 -12.663 -1.631 256 HE ARG 36 HE ARG 36 -14.456 -13.396 -4.010 257 HH11 ARG 36 1HH2 ARG 36 -12.882 -14.369 -1.085 258 HH12 ARG 36 2HH2 ARG 36 -12.661 -16.011 -1.586 259 HH21 ARG 36 1HH1 ARG 36 -14.173 -15.549 -4.673 260 HH22 ARG 36 2HH1 ARG 36 -13.394 -16.679 -3.618 261 H GLN 37 H GLN 37 -12.045 -9.934 0.941 262 HA GLN 37 HA GLN 37 -13.353 -8.078 2.843 263 HB2 GLN 37 1HB GLN 37 -10.536 -9.185 2.965 264 HB3 GLN 37 2HB GLN 37 -11.107 -7.818 3.925 265 HG2 GLN 37 1HG GLN 37 -12.711 -9.161 5.070 266 HG3 GLN 37 2HG GLN 37 -12.516 -10.490 3.935 267 HE21 GLN 37 2HE2 GLN 37 -10.725 -11.915 4.206 268 HE22 GLN 37 1HE2 GLN 37 -9.700 -11.841 5.550 269 H SER 38 H SER 38 -12.540 -5.950 2.766 270 HA SER 38 HA SER 38 -11.183 -5.244 0.209 271 HB2 SER 38 1HB SER 38 -12.596 -3.435 -0.123 272 HB3 SER 38 2HB SER 38 -13.700 -4.636 0.544 273 HG SER 38 HG SER 38 -12.384 -2.532 1.927 274 H ARG 39 H ARG 39 -9.385 -4.177 0.353 275 HA ARG 39 HA ARG 39 -8.730 -2.683 2.825 276 HB2 ARG 39 1HB ARG 39 -7.190 -4.800 1.387 277 HB3 ARG 39 2HB ARG 39 -6.278 -3.482 2.123 278 HG2 ARG 39 1HG ARG 39 -7.408 -3.957 4.291 279 HG3 ARG 39 2HG ARG 39 -8.244 -5.314 3.537 280 HD2 ARG 39 1HD ARG 39 -6.115 -6.410 3.060 281 HD3 ARG 39 2HD ARG 39 -5.231 -5.023 3.680 282 HE ARG 39 HE ARG 39 -5.752 -5.698 5.862 283 HH11 ARG 39 1HH2 ARG 39 -7.398 -7.605 3.483 284 HH12 ARG 39 2HH2 ARG 39 -7.947 -8.790 4.621 285 HH21 ARG 39 1HH1 ARG 39 -6.469 -7.241 7.348 286 HH22 ARG 39 2HH1 ARG 39 -7.422 -8.583 6.809 287 H LEU 40 H LEU 40 -7.420 -0.929 2.606 288 HA LEU 40 HA LEU 40 -7.191 0.182 -0.144 289 HB2 LEU 40 1HB LEU 40 -8.857 1.318 1.330 290 HB3 LEU 40 2HB LEU 40 -7.563 1.692 2.457 291 HG LEU 40 HG LEU 40 -6.394 2.794 0.395 292 HD11 LEU 40 1HD1 LEU 40 -9.277 2.646 -0.530 293 HD12 LEU 40 2HD1 LEU 40 -7.863 2.010 -1.362 294 HD13 LEU 40 3HD1 LEU 40 -8.081 3.747 -1.209 295 HD21 LEU 40 3HD2 LEU 40 -7.193 4.105 2.275 296 HD22 LEU 40 1HD2 LEU 40 -8.858 3.966 1.708 297 HD23 LEU 40 2HD2 LEU 40 -7.689 4.907 0.784 298 H LEU 41 H LEU 41 -5.157 0.477 -0.853 299 HA LEU 41 HA LEU 41 -2.932 0.329 1.039 300 HB2 LEU 41 1HB LEU 41 -3.180 0.199 -1.967 301 HB3 LEU 41 2HB LEU 41 -1.614 0.336 -1.166 302 HG LEU 41 HG LEU 41 -2.069 -1.719 0.105 303 HD11 LEU 41 1HD1 LEU 41 -4.711 -1.540 -1.351 304 HD12 LEU 41 2HD1 LEU 41 -4.419 -1.778 0.372 305 HD13 LEU 41 3HD1 LEU 41 -4.098 -3.087 -0.762 306 HD21 LEU 41 3HD2 LEU 41 -1.804 -3.257 -1.733 307 HD22 LEU 41 1HD2 LEU 41 -1.039 -1.743 -2.214 308 HD23 LEU 41 2HD2 LEU 41 -2.634 -2.162 -2.839 309 H GLY 42 H GLY 42 -1.140 1.843 0.827 310 HA2 GLY 42 1HA GLY 42 -1.580 4.371 -0.508 311 HA3 GLY 42 2HA GLY 42 -1.677 4.475 1.242 312 H LEU 43 H LEU 43 0.277 5.577 -0.695 313 HA LEU 43 HA LEU 43 2.747 4.483 0.535 314 HB2 LEU 43 1HB LEU 43 2.733 3.791 -1.789 315 HB3 LEU 43 2HB LEU 43 2.350 5.429 -2.313 316 HG LEU 43 HG LEU 43 4.504 6.241 -1.545 317 HD11 LEU 43 1HD1 LEU 43 4.717 3.477 -0.353 318 HD12 LEU 43 2HD1 LEU 43 5.006 5.041 0.413 319 HD13 LEU 43 3HD1 LEU 43 6.172 4.398 -0.740 320 HD21 LEU 43 3HD2 LEU 43 4.243 4.964 -3.767 321 HD22 LEU 43 1HD2 LEU 43 5.061 3.629 -2.958 322 HD23 LEU 43 2HD2 LEU 43 5.884 5.176 -3.159 323 H VAL 44 H VAL 44 3.890 5.938 1.635 324 HA VAL 44 HA VAL 44 3.435 8.825 1.050 325 HB VAL 44 HB VAL 44 3.450 7.415 3.701 326 HG11 VAL 44 1HG1 VAL 44 4.796 9.306 4.153 327 HG12 VAL 44 2HG1 VAL 44 3.170 9.847 4.573 328 HG13 VAL 44 3HG1 VAL 44 3.890 10.322 3.035 329 HG21 VAL 44 3HG2 VAL 44 1.473 9.414 2.614 330 HG22 VAL 44 1HG2 VAL 44 1.252 8.266 3.935 331 HG23 VAL 44 2HG2 VAL 44 1.333 7.689 2.271 332 H ARG 45 H ARG 45 5.131 10.087 0.977 333 HA ARG 45 HA ARG 45 7.791 8.964 1.641 334 HB2 ARG 45 1HB ARG 45 7.420 9.580 -0.749 335 HB3 ARG 45 2HB ARG 45 7.093 11.236 -0.239 336 HG2 ARG 45 1HG ARG 45 9.358 11.330 0.801 337 HG3 ARG 45 2HG ARG 45 9.678 9.706 0.188 338 HD2 ARG 45 1HD ARG 45 8.927 12.067 -1.551 339 HD3 ARG 45 2HD ARG 45 10.579 11.520 -1.286 340 HE ARG 45 HE ARG 45 9.038 9.328 -2.162 341 HH11 ARG 45 1HH2 ARG 45 10.277 12.370 -3.251 342 HH12 ARG 45 2HH2 ARG 45 10.366 11.894 -4.914 343 HH21 ARG 45 1HH1 ARG 45 9.151 8.697 -4.340 344 HH22 ARG 45 2HH1 ARG 45 9.729 9.815 -5.531 345 H TYR 46 H TYR 46 8.436 9.661 3.520 346 HA TYR 46 HA TYR 46 7.513 12.187 4.651 347 HB2 TYR 46 1HB TYR 46 7.650 9.991 5.909 348 HB3 TYR 46 2HB TYR 46 9.404 10.154 5.845 349 HD1 TYR 46 HD2 TYR 46 6.377 12.209 6.691 350 HD2 TYR 46 HD1 TYR 46 10.447 11.216 7.645 351 HE1 TYR 46 HE2 TYR 46 6.285 13.716 8.656 352 HE2 TYR 46 HE1 TYR 46 10.354 12.721 9.607 353 HH TYR 46 HH TYR 46 8.684 14.982 10.107 354 H ARG 47 H ARG 47 8.678 14.028 4.606 355 HA ARG 47 HA ARG 47 11.381 13.953 3.435 356 HB2 ARG 47 1HB ARG 47 9.709 15.537 2.512 357 HB3 ARG 47 2HB ARG 47 9.629 16.341 4.080 358 HG2 ARG 47 1HG ARG 47 12.055 16.846 3.935 359 HG3 ARG 47 2HG ARG 47 12.115 16.059 2.360 360 HD2 ARG 47 1HD ARG 47 10.413 17.693 1.534 361 HD3 ARG 47 2HD ARG 47 10.507 18.521 3.086 362 HE ARG 47 HE ARG 47 13.117 18.310 2.090 363 HH11 ARG 47 1HH2 ARG 47 10.089 19.783 1.275 364 HH12 ARG 47 2HH2 ARG 47 10.809 21.143 0.481 365 HH21 ARG 47 1HH1 ARG 47 14.064 20.093 1.056 366 HH22 ARG 47 2HH1 ARG 47 13.059 21.318 0.356 367 H LEU 48 H LEU 48 13.164 14.126 4.609 368 HA LEU 48 HA LEU 48 12.957 14.903 7.452 369 HB2 LEU 48 1HB LEU 48 15.245 13.589 5.964 370 HB3 LEU 48 2HB LEU 48 15.163 13.877 7.697 371 HG LEU 48 HG LEU 48 13.205 12.152 6.148 372 HD11 LEU 48 1HD1 LEU 48 15.453 11.145 6.216 373 HD12 LEU 48 2HD1 LEU 48 14.353 10.263 7.275 374 HD13 LEU 48 3HD1 LEU 48 15.521 11.392 7.960 375 HD21 LEU 48 3HD2 LEU 48 12.056 12.883 8.058 376 HD22 LEU 48 1HD2 LEU 48 13.512 12.921 9.050 377 HD23 LEU 48 2HD2 LEU 48 12.777 11.377 8.613 378 H GLU 49 H GLU 49 13.845 16.689 8.222 379 HA GLU 49 HA GLU 49 14.582 18.839 6.614 380 HB2 GLU 49 1HB GLU 49 15.423 19.869 8.682 381 HB3 GLU 49 2HB GLU 49 13.881 19.060 8.965 382 HG2 GLU 49 1HG GLU 49 15.114 17.065 9.804 383 HG3 GLU 49 2HG GLU 49 16.630 17.940 9.599 384 H ASN 50 H ASN 50 16.316 16.031 7.306 385 HA ASN 50 HA ASN 50 18.972 17.181 7.153 386 HB2 ASN 50 1HB ASN 50 17.996 14.317 7.072 387 HB3 ASN 50 2HB ASN 50 19.692 14.798 7.112 388 HD21 ASN 50 2HD2 ASN 50 17.868 13.386 9.181 389 HD22 ASN 50 1HD2 ASN 50 18.116 14.280 10.603 390 H ASP 51 H ASP 51 16.625 16.802 4.932 391 HA ASP 51 HA ASP 51 16.716 17.134 2.639 392 HB2 ASP 51 1HB ASP 51 19.584 16.214 2.508 393 HB3 ASP 51 2HB ASP 51 18.719 17.316 1.448 394 H ALA 52 H ALA 52 17.622 14.462 4.474 395 HA ALA 52 HA ALA 52 17.712 12.469 2.419 396 HB1 ALA 52 3HB ALA 52 17.480 10.905 4.383 397 HB2 ALA 52 1HB ALA 52 17.374 12.329 5.418 398 HB3 ALA 52 2HB ALA 52 18.840 12.022 4.487 399 H GLN 53 H GLN 53 16.160 10.896 1.963 400 HA GLN 53 HA GLN 53 13.359 11.585 2.674 401 HB2 GLN 53 1HB GLN 53 14.316 10.326 0.094 402 HB3 GLN 53 2HB GLN 53 12.688 10.898 0.465 403 HG2 GLN 53 1HG GLN 53 15.181 12.610 0.271 404 HG3 GLN 53 2HG GLN 53 13.863 12.560 -0.898 405 HE21 GLN 53 2HE2 GLN 53 15.004 14.250 1.791 406 HE22 GLN 53 1HE2 GLN 53 13.555 15.001 2.253 407 H GLU 54 H GLU 54 11.876 9.811 2.797 408 HA GLU 54 HA GLU 54 12.999 7.114 2.888 409 HB2 GLU 54 1HB GLU 54 11.606 8.407 5.252 410 HB3 GLU 54 2HB GLU 54 11.982 6.690 5.117 411 HG2 GLU 54 1HG GLU 54 14.023 8.938 5.072 412 HG3 GLU 54 2HG GLU 54 13.692 7.889 6.443 413 H HIS 55 H HIS 55 11.495 5.506 2.556 414 HA HIS 55 HA HIS 55 8.726 6.379 1.907 415 HB2 HIS 55 1HB HIS 55 10.371 4.310 0.433 416 HB3 HIS 55 2HB HIS 55 8.738 4.838 0.035 417 HD2 HIS 55 HD2 HIS 55 8.607 7.228 -1.435 418 HE1 HIS 55 HE1 HIS 55 12.750 8.037 -1.439 419 HE2 HIS 55 HE2 HIS 55 10.506 8.743 -2.391 420 H ALA 56 H ALA 56 7.092 4.822 2.218 421 HA ALA 56 HA ALA 56 7.703 2.238 3.360 422 HB1 ALA 56 3HB ALA 56 6.413 4.438 4.989 423 HB2 ALA 56 1HB ALA 56 7.867 3.523 5.385 424 HB3 ALA 56 2HB ALA 56 6.293 2.729 5.404 425 H LEU 57 H LEU 57 5.867 0.863 3.302 426 HA LEU 57 HA LEU 57 3.697 1.847 1.567 427 HB2 LEU 57 1HB LEU 57 4.856 -0.141 0.765 428 HB3 LEU 57 2HB LEU 57 4.558 -0.974 2.285 429 HG LEU 57 HG LEU 57 2.127 -0.892 1.873 430 HD11 LEU 57 1HD1 LEU 57 3.007 0.708 -0.528 431 HD12 LEU 57 2HD1 LEU 57 1.733 1.067 0.636 432 HD13 LEU 57 3HD1 LEU 57 1.492 -0.195 -0.564 433 HD21 LEU 57 3HD2 LEU 57 2.046 -2.508 0.082 434 HD22 LEU 57 1HD2 LEU 57 3.565 -2.759 0.943 435 HD23 LEU 57 2HD2 LEU 57 3.556 -1.906 -0.602 436 H PHE 58 H PHE 58 2.195 2.780 2.800 437 HA PHE 58 HA PHE 58 1.435 1.701 5.375 438 HB2 PHE 58 1HB PHE 58 0.721 4.128 3.753 439 HB3 PHE 58 2HB PHE 58 -0.301 3.661 5.109 440 HD1 PHE 58 HD1 PHE 58 3.359 2.983 5.158 441 HD2 PHE 58 HD2 PHE 58 0.229 5.673 6.381 442 HE1 PHE 58 HE1 PHE 58 4.898 4.052 6.746 443 HE2 PHE 58 HE2 PHE 58 1.791 6.741 7.978 444 HZ PHE 58 HZ PHE 58 4.124 5.930 8.161 445 H LEU 59 H LEU 59 -0.537 0.942 5.951 446 HA LEU 59 HA LEU 59 -2.321 0.024 3.766 447 HB2 LEU 59 1HB LEU 59 -1.641 -1.371 6.361 448 HB3 LEU 59 2HB LEU 59 -2.935 -1.871 5.282 449 HG LEU 59 HG LEU 59 -0.024 -1.641 4.450 450 HD11 LEU 59 1HD1 LEU 59 -0.288 -3.422 6.117 451 HD12 LEU 59 2HD1 LEU 59 -0.023 -4.121 4.522 452 HD13 LEU 59 3HD1 LEU 59 -1.645 -4.090 5.213 453 HD21 LEU 59 3HD2 LEU 59 -2.568 -2.486 3.074 454 HD22 LEU 59 1HD2 LEU 59 -1.053 -3.266 2.618 455 HD23 LEU 59 2HD2 LEU 59 -1.228 -1.524 2.453 456 H TYR 60 H TYR 60 -4.258 0.811 3.851 457 HA TYR 60 HA TYR 60 -5.261 2.092 6.344 458 HB2 TYR 60 1HB TYR 60 -5.688 2.709 3.408 459 HB3 TYR 60 2HB TYR 60 -6.617 3.440 4.697 460 HD1 TYR 60 HD2 TYR 60 -3.258 3.163 3.191 461 HD2 TYR 60 HD1 TYR 60 -5.678 5.147 6.131 462 HE1 TYR 60 HE2 TYR 60 -1.485 4.867 3.507 463 HE2 TYR 60 HE1 TYR 60 -3.903 6.850 6.443 464 HH TYR 60 HH TYR 60 -0.844 6.664 4.614 465 H THR 61 H THR 61 -7.213 1.267 7.146 466 HA THR 61 HA THR 61 -8.446 -0.908 5.611 467 HB THR 61 HB THR 61 -8.204 -1.108 8.091 468 HG1 THR 61 HG1 THR 61 -10.883 -0.968 7.175 469 HG21 THR 61 3HG2 THR 61 -10.414 0.943 8.236 470 HG22 THR 61 1HG2 THR 61 -8.718 1.375 8.453 471 HG23 THR 61 2HG2 THR 61 -9.491 0.246 9.568 472 H HIS 62 H HIS 62 -10.860 -0.853 5.352 473 HA HIS 62 HA HIS 62 -12.200 1.641 5.427 474 HB2 HIS 62 1HB HIS 62 -12.210 2.327 3.180 475 HB3 HIS 62 2HB HIS 62 -10.536 1.888 3.469 476 HD2 HIS 62 HD2 HIS 62 -9.756 -0.627 2.291 477 HE1 HIS 62 HE1 HIS 62 -13.142 -0.897 -0.207 478 HE2 HIS 62 HE2 HIS 62 -10.847 -1.874 0.275 479 H ARG 63 H ARG 63 -14.377 1.504 4.587 480 HA ARG 63 HA ARG 63 -15.516 -1.061 5.076 481 HB2 ARG 63 1HB ARG 63 -16.786 1.429 3.908 482 HB3 ARG 63 2HB ARG 63 -17.661 0.009 4.477 483 HG2 ARG 63 1HG ARG 63 -15.738 1.432 6.315 484 HG3 ARG 63 2HG ARG 63 -17.370 2.056 6.093 485 HD2 ARG 63 1HD ARG 63 -16.678 -0.758 6.982 486 HD3 ARG 63 2HD ARG 63 -17.248 0.530 8.030 487 HE ARG 63 HE ARG 63 -18.837 -1.003 6.127 488 HH11 ARG 63 1HH2 ARG 63 -18.545 1.783 8.164 489 HH12 ARG 63 2HH2 ARG 63 -20.251 2.063 8.256 490 HH21 ARG 63 1HH1 ARG 63 -21.074 -0.640 6.246 491 HH22 ARG 63 2HH1 ARG 63 -21.682 0.693 7.170 492 H ARG 64 H ARG 64 -17.006 -2.127 3.572 493 HA ARG 64 HA ARG 64 -15.699 -3.006 1.279 494 HB2 ARG 64 1HB ARG 64 -17.558 -4.198 2.435 495 HB3 ARG 64 2HB ARG 64 -18.685 -3.005 1.794 496 HG2 ARG 64 1HG ARG 64 -18.125 -3.636 -0.491 497 HG3 ARG 64 2HG ARG 64 -16.890 -4.753 0.091 498 HD2 ARG 64 1HD ARG 64 -18.889 -6.024 -0.431 499 HD3 ARG 64 2HD ARG 64 -18.682 -6.003 1.318 500 HE ARG 64 HE ARG 64 -20.336 -3.837 0.514 501 HH11 ARG 64 1HH2 ARG 64 -20.271 -7.282 0.849 502 HH12 ARG 64 2HH2 ARG 64 -21.975 -7.425 1.124 503 HH21 ARG 64 1HH1 ARG 64 -22.572 -4.019 0.872 504 HH22 ARG 64 2HH1 ARG 64 -23.277 -5.578 1.137 505 H MET 65 H MET 65 -17.465 -0.069 1.804 506 HA MET 65 HA MET 65 -17.130 0.640 -1.014 507 HB2 MET 65 1HB MET 65 -19.524 1.633 -0.880 508 HB3 MET 65 2HB MET 65 -19.366 -0.101 -1.144 509 HG2 MET 65 1HG MET 65 -19.697 -0.525 1.253 510 HG3 MET 65 2HG MET 65 -19.804 1.209 1.557 511 HE1 MET 65 3HE MET 65 -21.602 -0.756 2.561 512 HE2 MET 65 1HE MET 65 -23.263 -0.737 1.952 513 HE3 MET 65 2HE MET 65 -22.573 0.707 2.688 514 H ALA 66 H ALA 66 -15.774 1.445 1.431 515 HA ALA 66 HA ALA 66 -16.684 3.802 2.586 516 HB1 ALA 66 3HB ALA 66 -14.531 2.368 3.023 517 HB2 ALA 66 1HB ALA 66 -14.517 4.089 3.392 518 HB3 ALA 66 2HB ALA 66 -13.772 3.496 1.904 519 H ILE 67 H ILE 67 -14.298 3.628 -0.053 520 HA ILE 67 HA ILE 67 -13.723 5.039 -1.746 521 HB ILE 67 HB ILE 67 -16.698 5.622 -1.647 522 HG12 ILE 67 1HG1 ILE 67 -15.127 3.774 -3.470 523 HG13 ILE 67 2HG1 ILE 67 -15.964 3.223 -2.020 524 HG21 ILE 67 1HG2 ILE 67 -15.689 7.379 -2.905 525 HG22 ILE 67 2HG2 ILE 67 -16.246 6.213 -4.103 526 HG23 ILE 67 3HG2 ILE 67 -14.541 6.278 -3.663 527 HD11 ILE 67 3HD1 ILE 67 -17.306 2.961 -4.138 528 HD12 ILE 67 1HD1 ILE 67 -17.325 4.718 -4.280 529 HD13 ILE 67 2HD1 ILE 67 -18.103 3.936 -2.904 530 H THR 68 H THR 68 -16.167 6.697 0.093 531 HA THR 68 HA THR 68 -15.698 9.269 -0.248 532 HB THR 68 HB THR 68 -17.399 8.509 1.263 533 HG1 THR 68 HG1 THR 68 -17.088 10.520 1.812 534 HG21 THR 68 3HG2 THR 68 -15.372 6.946 2.409 535 HG22 THR 68 1HG2 THR 68 -17.005 7.140 3.045 536 HG23 THR 68 2HG2 THR 68 -15.705 8.169 3.631 537 H GLY 69 H GLY 69 -13.693 7.430 2.145 538 HA2 GLY 69 1HA GLY 69 -11.360 7.893 2.486 539 HA3 GLY 69 2HA GLY 69 -11.601 9.499 1.802 540 H ASP 70 H ASP 70 -14.252 9.210 3.469 541 HA ASP 70 HA ASP 70 -13.275 10.751 5.716 542 HB2 ASP 70 1HB ASP 70 -15.393 11.275 4.432 543 HB3 ASP 70 2HB ASP 70 -16.112 9.855 5.188 544 H ASP 71 H ASP 71 -14.083 7.364 5.146 545 HA ASP 71 HA ASP 71 -14.286 6.934 8.090 546 HB2 ASP 71 1HB ASP 71 -15.379 5.430 5.713 547 HB3 ASP 71 2HB ASP 71 -15.344 4.745 7.313 548 H VAL 72 H VAL 72 -11.873 6.904 6.052 549 HA VAL 72 HA VAL 72 -10.803 4.324 7.066 550 HB VAL 72 HB VAL 72 -11.142 3.875 4.801 551 HG11 VAL 72 1HG1 VAL 72 -10.554 5.613 3.030 552 HG12 VAL 72 2HG1 VAL 72 -10.387 6.772 4.350 553 HG13 VAL 72 3HG1 VAL 72 -11.944 6.001 4.045 554 HG21 VAL 72 3HG2 VAL 72 -8.456 5.170 4.410 555 HG22 VAL 72 1HG2 VAL 72 -8.984 3.544 3.989 556 HG23 VAL 72 2HG2 VAL 72 -8.596 3.938 5.658 557 H SER 73 H SER 73 -8.863 4.400 8.069 558 HA SER 73 HA SER 73 -7.038 6.598 7.561 559 HB2 SER 73 1HB SER 73 -8.503 7.470 9.340 560 HB3 SER 73 2HB SER 73 -8.240 6.005 10.282 561 HG SER 73 HG SER 73 -5.882 6.681 9.906 562 H LEU 74 H LEU 74 -4.993 6.122 8.917 563 HA LEU 74 HA LEU 74 -3.840 3.814 8.183 564 HB2 LEU 74 1HB LEU 74 -3.357 5.646 10.470 565 HB3 LEU 74 2HB LEU 74 -2.493 4.112 10.501 566 HG LEU 74 HG LEU 74 -2.513 5.951 8.101 567 HD11 LEU 74 1HD1 LEU 74 -1.491 6.980 10.192 568 HD12 LEU 74 2HD1 LEU 74 -0.400 6.829 8.819 569 HD13 LEU 74 3HD1 LEU 74 -0.301 5.679 10.152 570 HD21 LEU 74 3HD2 LEU 74 -1.444 4.232 7.084 571 HD22 LEU 74 1HD2 LEU 74 -1.619 3.240 8.528 572 HD23 LEU 74 2HD2 LEU 74 -0.191 4.245 8.319 573 H ASP 75 H ASP 75 -3.931 1.783 8.515 574 HA ASP 75 HA ASP 75 -5.230 0.653 10.924 575 HB2 ASP 75 1HB ASP 75 -6.516 0.338 8.796 576 HB3 ASP 75 2HB ASP 75 -5.141 -0.560 8.154 577 H GLN 76 H GLN 76 -2.420 0.634 8.799 578 HA GLN 76 HA GLN 76 -0.984 -0.954 10.693 579 HB2 GLN 76 1HB GLN 76 -2.263 -2.392 8.605 580 HB3 GLN 76 2HB GLN 76 -0.568 -2.316 8.146 581 HG2 GLN 76 1HG GLN 76 -1.411 -3.159 10.928 582 HG3 GLN 76 2HG GLN 76 -1.284 -4.304 9.599 583 HE21 GLN 76 2HE2 GLN 76 0.859 -4.685 8.661 584 HE22 GLN 76 1HE2 GLN 76 2.266 -4.256 9.505 585 H ILE 77 H ILE 77 1.195 -1.688 9.194 586 HA ILE 77 HA ILE 77 2.128 0.515 7.565 587 HB ILE 77 HB ILE 77 3.320 0.076 10.332 588 HG12 ILE 77 1HG1 ILE 77 1.801 2.379 9.066 589 HG13 ILE 77 2HG1 ILE 77 1.345 1.448 10.492 590 HG21 ILE 77 1HG2 ILE 77 4.186 2.057 8.201 591 HG22 ILE 77 2HG2 ILE 77 5.008 0.531 8.493 592 HG23 ILE 77 3HG2 ILE 77 4.968 1.750 9.750 593 HD11 ILE 77 3HD1 ILE 77 3.494 2.282 11.566 594 HD12 ILE 77 1HD1 ILE 77 2.214 3.473 11.339 595 HD13 ILE 77 2HD1 ILE 77 3.588 3.434 10.234 596 H VAL 78 H VAL 78 3.503 -0.276 6.130 597 HA VAL 78 HA VAL 78 5.056 -2.724 6.760 598 HB VAL 78 HB VAL 78 3.712 -2.124 4.119 599 HG11 VAL 78 1HG1 VAL 78 5.663 -3.426 3.729 600 HG12 VAL 78 2HG1 VAL 78 4.341 -4.592 3.782 601 HG13 VAL 78 3HG1 VAL 78 5.401 -4.396 5.178 602 HG21 VAL 78 3HG2 VAL 78 2.967 -3.953 6.410 603 HG22 VAL 78 1HG2 VAL 78 2.336 -4.166 4.776 604 HG23 VAL 78 2HG2 VAL 78 1.981 -2.690 5.672 605 HA PRO 79 HA PRO 79 7.811 0.543 5.104 606 HB2 PRO 79 1HB PRO 79 9.889 0.215 6.795 607 HB3 PRO 79 2HB PRO 79 8.410 1.066 7.283 608 HG2 PRO 79 1HG PRO 79 9.304 -1.702 7.935 609 HG3 PRO 79 2HG PRO 79 8.420 -0.536 8.936 610 HD2 PRO 79 1HD PRO 79 7.257 -2.669 7.512 611 HD3 PRO 79 2HD PRO 79 6.378 -1.276 8.165 612 H LEU 80 H LEU 80 9.353 0.383 3.546 613 HA LEU 80 HA LEU 80 9.971 -2.089 2.420 614 HB2 LEU 80 1HB LEU 80 11.208 0.647 2.119 615 HB3 LEU 80 2HB LEU 80 11.656 -0.726 1.108 616 HG LEU 80 HG LEU 80 8.810 0.268 1.433 617 HD11 LEU 80 1HD1 LEU 80 9.079 1.405 -0.697 618 HD12 LEU 80 2HD1 LEU 80 10.731 0.808 -0.849 619 HD13 LEU 80 3HD1 LEU 80 10.328 1.976 0.410 620 HD21 LEU 80 3HD2 LEU 80 8.613 -1.907 0.593 621 HD22 LEU 80 1HD2 LEU 80 10.159 -1.838 -0.253 622 HD23 LEU 80 2HD2 LEU 80 8.755 -0.998 -0.906 623 H SER 81 H SER 81 11.320 -3.546 2.918 624 HA SER 81 HA SER 81 13.784 -2.929 4.456 625 HB2 SER 81 1HB SER 81 11.890 -5.250 4.852 626 HB3 SER 81 2HB SER 81 13.488 -5.137 5.584 627 HG SER 81 HG SER 81 12.661 -2.986 6.339 628 H LYS 82 H LYS 82 15.499 -4.529 4.172 629 HA LYS 82 HA LYS 82 16.020 -5.052 1.484 630 HB2 LYS 82 1HB LYS 82 17.739 -4.916 3.265 631 HB3 LYS 82 2HB LYS 82 17.197 -6.480 3.876 632 HG2 LYS 82 1HG LYS 82 17.747 -7.535 1.731 633 HG3 LYS 82 2HG LYS 82 18.234 -5.974 1.070 634 HD2 LYS 82 1HD LYS 82 19.993 -5.798 2.801 635 HD3 LYS 82 2HD LYS 82 19.513 -7.371 3.438 636 HE2 LYS 82 1HE LYS 82 20.040 -8.410 1.253 637 HE3 LYS 82 2HE LYS 82 20.541 -6.836 0.635 638 HZ1 LYS 82 3HZ LYS 82 22.543 -7.309 1.430 639 HZ2 LYS 82 1HZ LYS 82 21.980 -8.672 2.268 640 HZ3 LYS 82 2HZ LYS 82 21.901 -7.137 2.994 641 H ASP 83 H ASP 83 14.784 -7.237 4.015 642 HA ASP 83 HA ASP 83 14.709 -9.543 2.351 643 HB2 ASP 83 1HB ASP 83 13.322 -8.818 4.934 644 HB3 ASP 83 2HB ASP 83 13.128 -10.387 4.155 645 H PHE 84 H PHE 84 13.071 -6.755 1.993 646 HA PHE 84 HA PHE 84 10.391 -7.646 1.480 647 HB2 PHE 84 1HB PHE 84 11.104 -5.251 1.978 648 HB3 PHE 84 2HB PHE 84 11.731 -5.188 0.330 649 HD1 PHE 84 HD1 PHE 84 10.128 -5.607 -1.605 650 HD2 PHE 84 HD2 PHE 84 8.797 -4.984 2.433 651 HE1 PHE 84 HE1 PHE 84 7.855 -5.062 -2.435 652 HE2 PHE 84 HE2 PHE 84 6.526 -4.443 1.603 653 HZ PHE 84 HZ PHE 84 6.054 -4.482 -0.833 654 H MET 85 H MET 85 9.467 -8.199 -0.464 655 HA MET 85 HA MET 85 10.782 -7.994 -2.976 656 HB2 MET 85 1HB MET 85 12.147 -9.844 -2.059 657 HB3 MET 85 2HB MET 85 10.679 -10.786 -1.799 658 HG2 MET 85 1HG MET 85 10.202 -10.785 -4.192 659 HG3 MET 85 2HG MET 85 11.579 -9.727 -4.498 660 HE1 MET 85 3HE MET 85 11.164 -11.902 -6.107 661 HE2 MET 85 1HE MET 85 12.283 -13.269 -5.997 662 HE3 MET 85 2HE MET 85 12.898 -11.644 -6.280 663 H LEU 86 H LEU 86 9.365 -8.448 -4.681 664 HA LEU 86 HA LEU 86 6.592 -9.094 -3.853 665 HB2 LEU 86 1HB LEU 86 6.218 -8.164 -6.317 666 HB3 LEU 86 2HB LEU 86 6.430 -7.056 -4.964 667 HG LEU 86 HG LEU 86 8.911 -7.995 -6.376 668 HD11 LEU 86 1HD1 LEU 86 8.659 -6.136 -8.033 669 HD12 LEU 86 2HD1 LEU 86 6.989 -5.939 -7.503 670 HD13 LEU 86 3HD1 LEU 86 7.497 -7.443 -8.269 671 HD21 LEU 86 3HD2 LEU 86 9.800 -5.952 -5.623 672 HD22 LEU 86 1HD2 LEU 86 8.696 -6.383 -4.320 673 HD23 LEU 86 2HD2 LEU 86 8.217 -5.183 -5.518 674 H GLU 87 H GLU 87 5.799 -11.059 -4.428 675 HA GLU 87 HA GLU 87 7.235 -12.578 -6.535 676 HB2 GLU 87 1HB GLU 87 5.674 -13.576 -4.142 677 HB3 GLU 87 2HB GLU 87 6.396 -14.597 -5.381 678 HG2 GLU 87 1HG GLU 87 7.951 -12.638 -3.670 679 HG3 GLU 87 2HG GLU 87 7.832 -14.365 -3.345 680 H GLU 88 H GLU 88 6.171 -13.056 -8.284 681 HA GLU 88 HA GLU 88 3.399 -12.336 -8.623 682 HB2 GLU 88 1HB GLU 88 5.348 -13.788 -10.431 683 HB3 GLU 88 2HB GLU 88 3.707 -13.349 -10.903 684 HG2 GLU 88 1HG GLU 88 4.198 -10.983 -10.532 685 HG3 GLU 88 2HG GLU 88 5.817 -11.384 -9.963 686 H VAL 89 H VAL 89 1.624 -13.708 -8.748 687 HA VAL 89 HA VAL 89 2.068 -16.456 -7.733 688 HB VAL 89 HB VAL 89 -0.574 -15.056 -8.025 689 HG11 VAL 89 1HG1 VAL 89 -0.783 -17.425 -7.718 690 HG12 VAL 89 2HG1 VAL 89 -1.161 -16.663 -6.174 691 HG13 VAL 89 3HG1 VAL 89 0.412 -17.419 -6.421 692 HG21 VAL 89 3HG2 VAL 89 1.311 -15.074 -5.650 693 HG22 VAL 89 1HG2 VAL 89 -0.347 -14.472 -5.617 694 HG23 VAL 89 2HG2 VAL 89 0.867 -13.661 -6.607 695 H SER 90 H SER 90 1.572 -18.206 -8.900 696 HA SER 90 HA SER 90 0.598 -17.803 -11.672 697 HB2 SER 90 1HB SER 90 2.780 -18.753 -11.697 698 HB3 SER 90 2HB SER 90 2.371 -19.901 -10.426 699 HG SER 90 HG SER 90 0.924 -20.884 -11.872 700 HA PRO 91 HA PRO 91 -2.762 -20.289 -9.808 701 HB2 PRO 91 1HB PRO 91 -4.861 -19.160 -11.080 702 HB3 PRO 91 2HB PRO 91 -4.077 -18.382 -9.692 703 HG2 PRO 91 1HG PRO 91 -3.837 -17.761 -12.591 704 HG3 PRO 91 2HG PRO 91 -3.796 -16.670 -11.196 705 HD2 PRO 91 1HD PRO 91 -1.534 -17.634 -12.592 706 HD3 PRO 91 2HD PRO 91 -1.511 -16.863 -10.991 707 H ASP 92 H ASP 92 -1.126 -20.815 -12.307 708 HA ASP 92 HA ASP 92 -1.153 -22.655 -13.736 709 HB2 ASP 92 1HB ASP 92 -3.289 -23.372 -12.348 710 HB3 ASP 92 2HB ASP 92 -4.163 -22.768 -13.752 711 H GLY 93 H GLY 93 -1.342 -19.819 -14.212 712 HA2 GLY 93 1HA GLY 93 -3.044 -19.271 -16.454 713 HA3 GLY 93 2HA GLY 93 -1.666 -18.306 -15.947 714 H GLU 94 H GLU 94 -2.834 -20.633 -18.177 715 HA GLU 94 HA GLU 94 -0.327 -21.610 -19.129 716 HB2 GLU 94 1HB GLU 94 -1.610 -22.545 -20.970 717 HB3 GLU 94 2HB GLU 94 -2.463 -22.813 -19.452 718 HG2 GLU 94 1HG GLU 94 -3.857 -20.797 -19.917 719 HG3 GLU 94 2HG GLU 94 -3.053 -20.634 -21.478 720 H LEU 95 H LEU 95 -2.445 -18.927 -20.117 721 HA LEU 95 HA LEU 95 -0.398 -18.107 -22.103 722 HB2 LEU 95 1HB LEU 95 -2.591 -18.524 -23.104 723 HB3 LEU 95 2HB LEU 95 -3.354 -17.446 -21.937 724 HG LEU 95 HG LEU 95 -2.107 -15.533 -22.839 725 HD11 LEU 95 1HD1 LEU 95 -0.031 -16.350 -23.566 726 HD12 LEU 95 2HD1 LEU 95 -0.857 -16.040 -25.088 727 HD13 LEU 95 3HD1 LEU 95 -0.756 -17.684 -24.461 728 HD21 LEU 95 3HD2 LEU 95 -3.080 -15.537 -25.159 729 HD22 LEU 95 1HD2 LEU 95 -4.228 -15.999 -23.902 730 HD23 LEU 95 2HD2 LEU 95 -3.497 -17.235 -24.926 731 H TYR 96 H TYR 96 -2.724 -16.822 -19.760 732 HA TYR 96 HA TYR 96 -0.786 -14.726 -19.019 733 HB2 TYR 96 1HB TYR 96 -2.210 -12.916 -19.434 734 HB3 TYR 96 2HB TYR 96 -2.461 -13.949 -20.841 735 HD1 TYR 96 HD2 TYR 96 -3.838 -12.988 -17.538 736 HD2 TYR 96 HD1 TYR 96 -4.608 -14.933 -21.287 737 HE1 TYR 96 HE2 TYR 96 -6.240 -13.118 -16.968 738 HE2 TYR 96 HE1 TYR 96 -7.023 -15.066 -20.720 739 HH TYR 96 HH TYR 96 -8.364 -15.098 -18.400 740 H ILE 97 H ILE 97 -1.335 -13.585 -17.064 741 HA ILE 97 HA ILE 97 -2.951 -15.217 -15.179 742 HB ILE 97 HB ILE 97 -0.582 -13.492 -14.442 743 HG12 ILE 97 1HG1 ILE 97 0.460 -15.979 -14.266 744 HG13 ILE 97 2HG1 ILE 97 -0.659 -16.258 -15.596 745 HG21 ILE 97 1HG2 ILE 97 -1.698 -13.947 -12.457 746 HG22 ILE 97 2HG2 ILE 97 -0.631 -15.346 -12.541 747 HG23 ILE 97 3HG2 ILE 97 -2.318 -15.496 -13.023 748 HD11 ILE 97 3HD1 ILE 97 1.220 -15.547 -16.763 749 HD12 ILE 97 1HD1 ILE 97 1.736 -14.460 -15.476 750 HD13 ILE 97 2HD1 ILE 97 0.402 -14.001 -16.533 751 H LEU 98 H LEU 98 -1.856 -11.973 -16.039 752 HA LEU 98 HA LEU 98 -3.584 -10.666 -14.134 753 HB2 LEU 98 1HB LEU 98 -1.895 -9.651 -16.429 754 HB3 LEU 98 2HB LEU 98 -2.904 -8.590 -15.451 755 HG LEU 98 HG LEU 98 -1.673 -9.149 -13.455 756 HD11 LEU 98 1HD1 LEU 98 -1.199 -11.440 -13.642 757 HD12 LEU 98 2HD1 LEU 98 0.382 -10.672 -13.727 758 HD13 LEU 98 3HD1 LEU 98 -0.398 -11.240 -15.202 759 HD21 LEU 98 3HD2 LEU 98 0.571 -8.332 -14.067 760 HD22 LEU 98 1HD2 LEU 98 -0.677 -7.436 -14.935 761 HD23 LEU 98 2HD2 LEU 98 0.242 -8.695 -15.761 762 H GLY 99 H GLY 99 -3.707 -9.048 -17.062 763 HA2 GLY 99 1HA GLY 99 -5.303 -9.147 -18.848 764 HA3 GLY 99 2HA GLY 99 -6.324 -10.179 -17.849 765 H SER 100 H SER 100 -7.816 -9.267 -16.510 766 HA SER 100 HA SER 100 -8.023 -6.308 -16.537 767 HB2 SER 100 1HB SER 100 -10.457 -6.791 -15.993 768 HB3 SER 100 2HB SER 100 -9.929 -7.258 -17.607 769 HG SER 100 HG SER 100 -10.354 -8.881 -15.327 770 H ASP 101 H ASP 101 -6.269 -7.508 -14.800 771 HA ASP 101 HA ASP 101 -6.974 -6.422 -12.307 772 HB2 ASP 101 1HB ASP 101 -8.426 -8.558 -12.336 773 HB3 ASP 101 2HB ASP 101 -6.911 -9.442 -12.198 774 H VAL 102 H VAL 102 -5.265 -7.034 -10.620 775 HA VAL 102 HA VAL 102 -2.733 -7.875 -11.919 776 HB VAL 102 HB VAL 102 -3.057 -5.675 -9.884 777 HG11 VAL 102 1HG1 VAL 102 -0.925 -6.827 -9.659 778 HG12 VAL 102 2HG1 VAL 102 -0.657 -5.257 -10.416 779 HG13 VAL 102 3HG1 VAL 102 -0.654 -6.721 -11.397 780 HG21 VAL 102 3HG2 VAL 102 -3.882 -4.811 -11.914 781 HG22 VAL 102 1HG2 VAL 102 -2.691 -5.688 -12.877 782 HG23 VAL 102 2HG2 VAL 102 -2.194 -4.306 -11.901 783 H THR 103 H THR 103 -1.617 -9.369 -10.858 784 HA THR 103 HA THR 103 -2.491 -10.064 -8.093 785 HB THR 103 HB THR 103 -1.245 -11.948 -10.107 786 HG1 THR 103 HG1 THR 103 -3.194 -12.380 -10.783 787 HG21 THR 103 3HG2 THR 103 -0.904 -12.760 -7.902 788 HG22 THR 103 1HG2 THR 103 -2.334 -13.610 -8.485 789 HG23 THR 103 2HG2 THR 103 -2.508 -12.250 -7.377 790 H VAL 104 H VAL 104 -1.092 -9.358 -6.695 791 HA VAL 104 HA VAL 104 1.794 -9.824 -7.148 792 HB VAL 104 HB VAL 104 1.012 -7.385 -7.517 793 HG11 VAL 104 1HG1 VAL 104 -0.510 -7.529 -5.443 794 HG12 VAL 104 2HG1 VAL 104 0.456 -6.066 -5.632 795 HG13 VAL 104 3HG1 VAL 104 0.963 -7.317 -4.497 796 HG21 VAL 104 3HG2 VAL 104 3.361 -7.953 -7.165 797 HG22 VAL 104 1HG2 VAL 104 3.105 -8.072 -5.424 798 HG23 VAL 104 2HG2 VAL 104 2.979 -6.508 -6.228 799 H GLN 105 H GLN 105 2.859 -10.608 -5.394 800 HA GLN 105 HA GLN 105 1.367 -10.811 -2.829 801 HB2 GLN 105 1HB GLN 105 1.584 -12.953 -4.276 802 HB3 GLN 105 2HB GLN 105 3.284 -12.926 -3.814 803 HG2 GLN 105 1HG GLN 105 0.975 -12.882 -1.850 804 HG3 GLN 105 2HG GLN 105 1.872 -14.328 -2.296 805 HE21 GLN 105 2HE2 GLN 105 1.772 -11.790 -0.065 806 HE22 GLN 105 1HE2 GLN 105 3.353 -11.926 0.537 807 H LEU 106 H LEU 106 2.418 -9.583 -1.334 808 HA LEU 106 HA LEU 106 5.210 -8.937 -1.646 809 HB2 LEU 106 1HB LEU 106 4.832 -7.633 0.422 810 HB3 LEU 106 2HB LEU 106 3.644 -7.270 -0.828 811 HG LEU 106 HG LEU 106 2.534 -9.460 0.625 812 HD11 LEU 106 1HD1 LEU 106 4.107 -9.051 2.453 813 HD12 LEU 106 2HD1 LEU 106 2.483 -8.576 2.942 814 HD13 LEU 106 3HD1 LEU 106 3.661 -7.347 2.484 815 HD21 LEU 106 3HD2 LEU 106 1.865 -6.529 0.963 816 HD22 LEU 106 1HD2 LEU 106 0.803 -7.913 1.214 817 HD23 LEU 106 2HD2 LEU 106 1.352 -7.509 -0.412 818 H ASN 107 H ASN 107 6.747 -10.152 -0.961 819 HA ASN 107 HA ASN 107 6.288 -12.095 1.259 820 HB2 ASN 107 1HB ASN 107 8.569 -12.170 -0.691 821 HB3 ASN 107 2HB ASN 107 7.998 -13.448 0.381 822 HD21 ASN 107 2HD2 ASN 107 6.378 -11.257 -1.967 823 HD22 ASN 107 1HD2 ASN 107 5.546 -12.498 -2.767 824 H THR 108 H THR 108 6.612 -10.059 2.690 825 HA THR 108 HA THR 108 9.342 -9.171 2.952 826 HB THR 108 HB THR 108 8.581 -7.803 4.715 827 HG1 THR 108 HG1 THR 108 6.979 -9.924 5.174 828 HG21 THR 108 3HG2 THR 108 6.268 -8.219 2.800 829 HG22 THR 108 1HG2 THR 108 7.625 -7.115 2.580 830 HG23 THR 108 2HG2 THR 108 6.454 -6.830 3.866 831 H ALA 109 H ALA 109 10.342 -9.294 5.182 832 HA ALA 109 HA ALA 109 11.266 -11.791 5.728 833 HB1 ALA 109 3HB ALA 109 10.889 -9.444 7.581 834 HB2 ALA 109 1HB ALA 109 12.355 -9.947 6.743 835 HB3 ALA 109 2HB ALA 109 11.730 -10.913 8.079 836 H GLU 110 H GLU 110 8.287 -10.367 6.999 837 HA GLU 110 HA GLU 110 7.525 -13.038 8.021 838 HB2 GLU 110 1HB GLU 110 6.537 -11.983 10.015 839 HB3 GLU 110 2HB GLU 110 8.281 -11.730 9.947 840 HG2 GLU 110 1HG GLU 110 7.869 -9.496 8.899 841 HG3 GLU 110 2HG GLU 110 6.140 -9.747 9.132 842 H LEU 111 H LEU 111 6.543 -9.828 6.928 843 HA LEU 111 HA LEU 111 3.758 -10.381 6.927 844 HB2 LEU 111 1HB LEU 111 5.285 -8.109 6.639 845 HB3 LEU 111 2HB LEU 111 4.748 -8.366 4.984 846 HG LEU 111 HG LEU 111 2.372 -8.676 6.087 847 HD11 LEU 111 1HD1 LEU 111 2.035 -7.511 8.160 848 HD12 LEU 111 2HD1 LEU 111 3.695 -6.916 8.165 849 HD13 LEU 111 3HD1 LEU 111 3.371 -8.630 8.421 850 HD21 LEU 111 3HD2 LEU 111 2.784 -6.845 4.596 851 HD22 LEU 111 1HD2 LEU 111 3.834 -6.043 5.763 852 HD23 LEU 111 2HD2 LEU 111 2.097 -6.135 6.057 853 H LYS 112 H LYS 112 2.514 -11.337 5.462 854 HA LYS 112 HA LYS 112 3.445 -11.746 2.742 855 HB2 LYS 112 1HB LYS 112 4.362 -13.694 4.000 856 HB3 LYS 112 2HB LYS 112 2.709 -14.129 4.446 857 HG2 LYS 112 1HG LYS 112 2.095 -14.349 2.092 858 HG3 LYS 112 2HG LYS 112 3.703 -13.816 1.598 859 HD2 LYS 112 1HD LYS 112 4.693 -15.772 2.747 860 HD3 LYS 112 2HD LYS 112 3.073 -16.317 3.190 861 HE2 LYS 112 1HE LYS 112 3.997 -15.868 0.338 862 HE3 LYS 112 2HE LYS 112 3.963 -17.442 1.134 863 HZ1 LYS 112 3HZ LYS 112 1.809 -15.913 0.024 864 HZ2 LYS 112 1HZ LYS 112 1.491 -16.420 1.610 865 HZ3 LYS 112 2HZ LYS 112 1.877 -17.564 0.416 866 H LEU 113 H LEU 113 1.798 -10.955 1.662 867 HA LEU 113 HA LEU 113 -0.910 -11.988 2.222 868 HB2 LEU 113 1HB LEU 113 0.005 -9.342 2.915 869 HB3 LEU 113 2HB LEU 113 -1.173 -9.185 1.619 870 HG LEU 113 HG LEU 113 -2.765 -10.581 2.945 871 HD11 LEU 113 1HD1 LEU 113 -2.019 -10.632 5.517 872 HD12 LEU 113 2HD1 LEU 113 -0.411 -10.689 4.800 873 HD13 LEU 113 3HD1 LEU 113 -1.595 -11.938 4.416 874 HD21 LEU 113 3HD2 LEU 113 -1.945 -8.386 4.823 875 HD22 LEU 113 1HD2 LEU 113 -3.537 -8.773 4.172 876 HD23 LEU 113 2HD2 LEU 113 -2.354 -7.929 3.175 877 H VAL 114 H VAL 114 -2.460 -11.371 0.486 878 HA VAL 114 HA VAL 114 -1.137 -11.164 -2.167 879 HB VAL 114 HB VAL 114 -3.551 -12.828 -1.396 880 HG11 VAL 114 1HG1 VAL 114 -3.311 -13.672 -3.755 881 HG12 VAL 114 2HG1 VAL 114 -2.130 -12.393 -4.038 882 HG13 VAL 114 3HG1 VAL 114 -3.802 -11.982 -3.650 883 HG21 VAL 114 3HG2 VAL 114 -1.087 -13.572 -0.780 884 HG22 VAL 114 1HG2 VAL 114 -0.974 -13.928 -2.504 885 HG23 VAL 114 2HG2 VAL 114 -2.192 -14.729 -1.518 886 H PHE 115 H PHE 115 -1.722 -9.318 -3.097 887 HA PHE 115 HA PHE 115 -4.395 -8.177 -2.573 888 HB2 PHE 115 1HB PHE 115 -1.741 -6.870 -3.131 889 HB3 PHE 115 2HB PHE 115 -3.256 -6.017 -3.412 890 HD1 PHE 115 HD2 PHE 115 -4.828 -5.586 -1.543 891 HD2 PHE 115 HD1 PHE 115 -0.938 -7.285 -0.887 892 HE1 PHE 115 HE2 PHE 115 -4.983 -5.029 0.863 893 HE2 PHE 115 HE1 PHE 115 -1.112 -6.717 1.527 894 HZ PHE 115 HZ PHE 115 -3.132 -5.599 2.397 895 H GLN 116 H GLN 116 -5.693 -7.677 -4.188 896 HA GLN 116 HA GLN 116 -4.836 -8.281 -6.952 897 HB2 GLN 116 1HB GLN 116 -7.405 -8.735 -5.487 898 HB3 GLN 116 2HB GLN 116 -7.465 -8.467 -7.227 899 HG2 GLN 116 1HG GLN 116 -5.547 -10.484 -6.057 900 HG3 GLN 116 2HG GLN 116 -7.234 -10.913 -6.334 901 HE21 GLN 116 2HE2 GLN 116 -4.250 -9.878 -7.987 902 HE22 GLN 116 1HE2 GLN 116 -4.744 -10.361 -9.539 903 H LEU 117 H LEU 117 -4.137 -6.242 -7.570 904 HA LEU 117 HA LEU 117 -5.969 -3.960 -7.230 905 HB2 LEU 117 1HB LEU 117 -3.281 -3.812 -8.568 906 HB3 LEU 117 2HB LEU 117 -4.105 -2.596 -7.605 907 HG LEU 117 HG LEU 117 -2.855 -5.160 -6.579 908 HD11 LEU 117 1HD1 LEU 117 -2.155 -2.293 -5.918 909 HD12 LEU 117 2HD1 LEU 117 -1.359 -3.194 -7.210 910 HD13 LEU 117 3HD1 LEU 117 -1.233 -3.749 -5.540 911 HD21 LEU 117 3HD2 LEU 117 -3.434 -3.891 -4.324 912 HD22 LEU 117 1HD2 LEU 117 -4.662 -4.869 -5.122 913 HD23 LEU 117 2HD2 LEU 117 -4.672 -3.117 -5.310 914 HA PRO 118 HA PRO 118 -7.456 -4.318 -11.399 915 HB2 PRO 118 1HB PRO 118 -8.000 -1.721 -12.062 916 HB3 PRO 118 2HB PRO 118 -8.968 -2.642 -10.892 917 HG2 PRO 118 1HG PRO 118 -6.781 -0.671 -10.391 918 HG3 PRO 118 2HG PRO 118 -8.353 -0.830 -9.585 919 HD2 PRO 118 1HD PRO 118 -6.068 -1.799 -8.479 920 HD3 PRO 118 2HD PRO 118 -7.637 -2.595 -8.237 921 H PHE 119 H PHE 119 -6.626 -4.504 -13.414 922 HA PHE 119 HA PHE 119 -4.073 -4.319 -14.120 923 HB2 PHE 119 1HB PHE 119 -5.896 -5.367 -15.412 924 HB3 PHE 119 2HB PHE 119 -6.371 -3.765 -15.979 925 HD1 PHE 119 HD2 PHE 119 -3.417 -6.053 -15.775 926 HD2 PHE 119 HD1 PHE 119 -5.347 -2.849 -17.890 927 HE1 PHE 119 HE2 PHE 119 -1.692 -6.185 -17.551 928 HE2 PHE 119 HE1 PHE 119 -3.621 -2.982 -19.665 929 HZ PHE 119 HZ PHE 119 -1.794 -4.649 -19.496 930 H GLY 120 H GLY 120 -2.595 -2.897 -14.520 931 HA2 GLY 120 1HA GLY 120 -1.612 -0.798 -14.603 932 HA3 GLY 120 2HA GLY 120 -2.497 -0.763 -16.122 933 H SER 121 H SER 121 -3.570 1.065 -16.375 934 HA SER 121 HA SER 121 -4.724 2.999 -15.908 935 HB2 SER 121 1HB SER 121 -5.988 1.003 -14.031 936 HB3 SER 121 2HB SER 121 -6.584 2.653 -14.185 937 HG SER 121 HG SER 121 -6.123 1.106 -16.483 938 H HIS 122 H HIS 122 -5.469 2.436 -12.665 939 HA HIS 122 HA HIS 122 -3.651 4.552 -11.818 940 HB2 HIS 122 1HB HIS 122 -6.128 4.353 -11.154 941 HB3 HIS 122 2HB HIS 122 -5.609 3.066 -10.067 942 HD2 HIS 122 HD2 HIS 122 -4.943 4.082 -7.592 943 HE1 HIS 122 HE1 HIS 122 -3.855 7.979 -8.795 944 HE2 HIS 122 HE2 HIS 122 -4.127 6.432 -6.801 945 H THR 123 H THR 123 -3.551 1.181 -12.008 946 HA THR 123 HA THR 123 -2.028 0.757 -9.563 947 HB THR 123 HB THR 123 -2.611 -1.097 -11.881 948 HG1 THR 123 HG1 THR 123 -4.279 -1.729 -10.717 949 HG21 THR 123 3HG2 THR 123 -0.616 -1.876 -10.828 950 HG22 THR 123 1HG2 THR 123 -1.919 -2.831 -10.132 951 HG23 THR 123 2HG2 THR 123 -1.231 -1.492 -9.220 952 H ARG 124 H ARG 124 -1.363 1.227 -13.012 953 HA ARG 124 HA ARG 124 1.232 0.206 -13.107 954 HB2 ARG 124 1HB ARG 124 -0.103 0.895 -15.073 955 HB3 ARG 124 2HB ARG 124 0.106 2.577 -14.603 956 HG2 ARG 124 1HG ARG 124 2.562 2.313 -14.801 957 HG3 ARG 124 2HG ARG 124 2.323 0.644 -15.317 958 HD2 ARG 124 1HD ARG 124 1.152 3.051 -16.730 959 HD3 ARG 124 2HD ARG 124 2.635 2.240 -17.221 960 HE ARG 124 HE ARG 124 -0.043 1.331 -17.709 961 HH11 ARG 124 1HH2 ARG 124 3.213 0.353 -17.067 962 HH12 ARG 124 2HH2 ARG 124 3.059 -1.176 -17.868 963 HH21 ARG 124 1HH1 ARG 124 -0.252 -0.671 -18.766 964 HH22 ARG 124 2HH1 ARG 124 1.098 -1.755 -18.829 965 H THR 125 H THR 125 0.121 3.483 -12.343 966 HA THR 125 HA THR 125 2.616 4.704 -12.107 967 HB THR 125 HB THR 125 0.683 6.101 -12.083 968 HG1 THR 125 HG1 THR 125 0.904 6.990 -9.818 969 HG21 THR 125 3HG2 THR 125 -1.050 5.944 -10.371 970 HG22 THR 125 1HG2 THR 125 -0.175 4.645 -9.569 971 HG23 THR 125 2HG2 THR 125 -0.871 4.384 -11.167 972 H PHE 126 H PHE 126 0.711 2.901 -9.761 973 HA PHE 126 HA PHE 126 2.235 3.345 -7.474 974 HB2 PHE 126 1HB PHE 126 0.051 2.175 -7.490 975 HB3 PHE 126 2HB PHE 126 0.827 0.777 -8.234 976 HD1 PHE 126 HD2 PHE 126 0.836 2.950 -5.209 977 HD2 PHE 126 HD1 PHE 126 2.076 -0.778 -6.936 978 HE1 PHE 126 HE2 PHE 126 1.549 2.152 -2.974 979 HE2 PHE 126 HE1 PHE 126 2.791 -1.577 -4.702 980 HZ PHE 126 HZ PHE 126 2.529 -0.112 -2.720 981 H LEU 127 H LEU 127 2.594 0.692 -9.873 982 HA LEU 127 HA LEU 127 4.646 -0.691 -8.707 983 HB2 LEU 127 1HB LEU 127 4.543 -0.068 -11.663 984 HB3 LEU 127 2HB LEU 127 5.230 -1.495 -10.892 985 HG LEU 127 HG LEU 127 2.304 -0.717 -10.869 986 HD11 LEU 127 1HD1 LEU 127 3.799 -2.904 -12.341 987 HD12 LEU 127 2HD1 LEU 127 3.063 -1.477 -13.070 988 HD13 LEU 127 3HD1 LEU 127 2.047 -2.708 -12.321 989 HD21 LEU 127 3HD2 LEU 127 2.172 -3.177 -10.011 990 HD22 LEU 127 1HD2 LEU 127 2.671 -1.931 -8.871 991 HD23 LEU 127 2HD2 LEU 127 3.880 -2.975 -9.618 992 H GLN 128 H GLN 128 5.010 2.086 -10.957 993 HA GLN 128 HA GLN 128 7.780 2.134 -10.961 994 HB2 GLN 128 1HB GLN 128 6.006 4.558 -11.226 995 HB3 GLN 128 2HB GLN 128 7.542 4.229 -12.037 996 HG2 GLN 128 1HG GLN 128 4.893 2.841 -12.489 997 HG3 GLN 128 2HG GLN 128 5.781 3.825 -13.638 998 HE21 GLN 128 2HE2 GLN 128 4.972 0.788 -13.462 999 HE22 GLN 128 1HE2 GLN 128 6.407 -0.001 -13.894 1000 H GLU 129 H GLU 129 5.489 3.849 -8.833 1001 HA GLU 129 HA GLU 129 7.395 5.442 -7.514 1002 HB2 GLU 129 1HB GLU 129 4.656 4.437 -6.781 1003 HB3 GLU 129 2HB GLU 129 5.621 5.305 -5.588 1004 HG2 GLU 129 1HG GLU 129 4.127 6.823 -6.856 1005 HG3 GLU 129 2HG GLU 129 5.826 7.218 -7.086 1006 H VAL 130 H VAL 130 6.290 2.140 -6.857 1007 HA VAL 130 HA VAL 130 7.578 1.852 -4.360 1008 HB VAL 130 HB VAL 130 6.782 -0.170 -6.464 1009 HG11 VAL 130 1HG1 VAL 130 7.966 -0.525 -3.706 1010 HG12 VAL 130 2HG1 VAL 130 8.481 -1.272 -5.220 1011 HG13 VAL 130 3HG1 VAL 130 6.971 -1.773 -4.458 1012 HG21 VAL 130 3HG2 VAL 130 5.577 0.703 -3.818 1013 HG22 VAL 130 1HG2 VAL 130 4.968 -0.619 -4.811 1014 HG23 VAL 130 2HG2 VAL 130 4.922 1.034 -5.424 1015 H ALA 131 H ALA 131 8.599 1.036 -7.639 1016 HA ALA 131 HA ALA 131 11.070 -0.115 -7.113 1017 HB1 ALA 131 3HB ALA 131 10.314 1.650 -9.450 1018 HB2 ALA 131 1HB ALA 131 10.091 -0.097 -9.343 1019 HB3 ALA 131 2HB ALA 131 11.717 0.582 -9.393 1020 H ARG 132 H ARG 132 10.378 3.355 -7.603 1021 HA ARG 132 HA ARG 132 13.129 4.107 -7.185 1022 HB2 ARG 132 1HB ARG 132 10.569 5.701 -7.374 1023 HB3 ARG 132 2HB ARG 132 12.152 6.440 -7.120 1024 HG2 ARG 132 1HG ARG 132 12.985 5.408 -9.192 1025 HG3 ARG 132 2HG ARG 132 11.420 4.633 -9.443 1026 HD2 ARG 132 1HD ARG 132 10.339 6.836 -9.591 1027 HD3 ARG 132 2HD ARG 132 11.890 7.624 -9.308 1028 HE ARG 132 HE ARG 132 12.225 5.941 -11.509 1029 HH11 ARG 132 1HH2 ARG 132 10.339 8.683 -10.569 1030 HH12 ARG 132 2HH2 ARG 132 10.226 9.328 -12.172 1031 HH21 ARG 132 1HH1 ARG 132 12.084 6.779 -13.614 1032 HH22 ARG 132 2HH1 ARG 132 11.213 8.250 -13.897 1033 H ALA 133 H ALA 133 10.371 3.579 -5.195 1034 HA ALA 133 HA ALA 133 10.771 5.179 -3.005 1035 HB1 ALA 133 3HB ALA 133 10.046 2.261 -2.773 1036 HB2 ALA 133 1HB ALA 133 8.930 3.481 -3.382 1037 HB3 ALA 133 2HB ALA 133 9.543 3.589 -1.735 1038 H CYS 134 H CYS 134 12.855 2.663 -4.116 1039 HA CYS 134 HA CYS 134 15.030 3.310 -2.642 1040 HB2 CYS 134 1HB CYS 134 13.108 1.888 -0.916 1041 HB3 CYS 134 2HB CYS 134 14.726 1.199 -0.878 1042 HG CYS 134 HG CYS 134 15.657 3.506 -0.101 1043 HA PRO 135 HA PRO 135 15.357 -1.441 -3.889 1044 HB2 PRO 135 1HB PRO 135 13.207 -1.351 -5.966 1045 HB3 PRO 135 2HB PRO 135 13.697 -2.686 -4.904 1046 HG2 PRO 135 1HG PRO 135 11.480 -1.317 -4.414 1047 HG3 PRO 135 2HG PRO 135 12.538 -1.835 -3.083 1048 HD2 PRO 135 1HD PRO 135 12.238 0.899 -4.296 1049 HD3 PRO 135 2HD PRO 135 12.491 0.442 -2.598 1050 H GLY 136 H GLY 136 14.324 1.070 -6.185 1051 HA2 GLY 136 1HA GLY 136 15.230 0.784 -8.561 1052 HA3 GLY 136 2HA GLY 136 15.873 2.163 -7.676 1053 H PHE 137 H PHE 137 16.466 -1.023 -8.845 1054 HA PHE 137 HA PHE 137 18.792 -1.880 -7.761 1055 HB2 PHE 137 1HB PHE 137 17.920 -1.956 -10.650 1056 HB3 PHE 137 2HB PHE 137 19.324 -2.836 -10.048 1057 HD1 PHE 137 HD2 PHE 137 19.050 -4.630 -8.342 1058 HD2 PHE 137 HD1 PHE 137 15.671 -2.668 -10.129 1059 HE1 PHE 137 HE2 PHE 137 17.566 -6.446 -7.534 1060 HE2 PHE 137 HE1 PHE 137 14.189 -4.487 -9.320 1061 HZ PHE 137 HZ PHE 137 15.137 -6.374 -8.023 1062 H ASP 138 H ASP 138 19.696 0.307 -7.193 1063 HA ASP 138 HA ASP 138 21.242 1.589 -9.332 1064 HB2 ASP 138 1HB ASP 138 20.213 2.365 -6.720 1065 HB3 ASP 138 2HB ASP 138 21.924 2.759 -6.828 1066 HA PRO 139 HA PRO 139 25.184 -0.273 -8.689 1067 HB2 PRO 139 1HB PRO 139 26.312 2.271 -7.566 1068 HB3 PRO 139 2HB PRO 139 26.919 1.259 -8.893 1069 HG2 PRO 139 1HG PRO 139 25.686 3.555 -9.390 1070 HG3 PRO 139 2HG PRO 139 25.421 2.134 -10.421 1071 HD2 PRO 139 1HD PRO 139 23.611 3.320 -8.342 1072 HD3 PRO 139 2HD PRO 139 23.203 2.535 -9.884 1073 H GLU 140 H GLU 140 24.518 1.951 -5.964 1074 HA GLU 140 HA GLU 140 25.122 -0.251 -4.080 1075 HB2 GLU 140 1HB GLU 140 26.335 1.323 -2.638 1076 HB3 GLU 140 2HB GLU 140 27.112 1.189 -4.218 1077 HG2 GLU 140 1HG GLU 140 25.890 3.240 -4.949 1078 HG3 GLU 140 2HG GLU 140 25.242 3.400 -3.317 1079 H THR 141 H THR 141 22.598 0.834 -5.049 1080 HA THR 141 HA THR 141 20.739 2.120 -4.290 1081 HB THR 141 HB THR 141 20.907 0.026 -2.133 1082 HG1 THR 141 HG1 THR 141 21.248 -1.362 -3.641 1083 HG21 THR 141 3HG2 THR 141 18.912 1.708 -2.631 1084 HG22 THR 141 1HG2 THR 141 18.580 0.016 -2.257 1085 HG23 THR 141 2HG2 THR 141 18.567 0.568 -3.930 1086 H ARG 142 H ARG 142 20.183 1.494 -1.268 1087 HA ARG 142 HA ARG 142 21.874 3.504 0.024 1088 HB2 ARG 142 1HB ARG 142 18.882 3.823 -0.285 1089 HB3 ARG 142 2HB ARG 142 19.868 4.752 0.844 1090 HG2 ARG 142 1HG ARG 142 21.247 5.549 -1.069 1091 HG3 ARG 142 2HG ARG 142 20.165 4.697 -2.167 1092 HD2 ARG 142 1HD ARG 142 18.263 6.010 -1.319 1093 HD3 ARG 142 2HD ARG 142 19.355 6.893 -0.256 1094 HE ARG 142 HE ARG 142 19.131 7.179 -3.152 1095 HH11 ARG 142 1HH2 ARG 142 20.921 7.772 -0.248 1096 HH12 ARG 142 2HH2 ARG 142 21.811 9.103 -0.907 1097 HH21 ARG 142 1HH1 ARG 142 20.301 8.912 -4.024 1098 HH22 ARG 142 2HH1 ARG 142 21.460 9.749 -3.046 1099 H ASP 143 H ASP 143 19.039 3.377 1.654 1100 HA ASP 143 HA ASP 143 19.492 0.873 3.064 1101 HB2 ASP 143 1HB ASP 143 19.837 3.600 4.312 1102 HB3 ASP 143 2HB ASP 143 19.486 2.165 5.270 1103 HA PRO 144 HA PRO 144 15.078 1.132 3.287 1104 HB2 PRO 144 1HB PRO 144 14.581 -0.400 5.523 1105 HB3 PRO 144 2HB PRO 144 15.064 -1.080 3.955 1106 HG2 PRO 144 1HG PRO 144 16.749 -0.510 6.355 1107 HG3 PRO 144 2HG PRO 144 16.744 -1.937 5.298 1108 HD2 PRO 144 1HD PRO 144 18.607 0.011 5.051 1109 HD3 PRO 144 2HD PRO 144 17.988 -0.875 3.639 1110 H GLU 145 H GLU 145 16.555 1.389 6.510 1111 HA GLU 145 HA GLU 145 16.136 2.796 8.300 1112 HB2 GLU 145 1HB GLU 145 16.841 4.374 6.278 1113 HB3 GLU 145 2HB GLU 145 15.169 4.910 6.394 1114 HG2 GLU 145 1HG GLU 145 16.405 6.372 7.814 1115 HG3 GLU 145 2HG GLU 145 15.597 5.241 8.896 1116 H PHE 146 H PHE 146 14.423 2.081 9.463 1117 HA PHE 146 HA PHE 146 11.699 2.900 8.592 1118 HB2 PHE 146 1HB PHE 146 11.091 0.753 10.032 1119 HB3 PHE 146 2HB PHE 146 11.578 0.592 8.348 1120 HD1 PHE 146 HD2 PHE 146 12.650 0.207 11.851 1121 HD2 PHE 146 HD1 PHE 146 13.750 -0.307 7.732 1122 HE1 PHE 146 HE2 PHE 146 14.574 -1.193 12.540 1123 HE2 PHE 146 HE1 PHE 146 15.675 -1.708 8.422 1124 HZ PHE 146 HZ PHE 146 16.088 -2.153 10.826 1125 H GLU 147 H GLU 147 14.108 3.100 10.929 1126 HA GLU 147 HA GLU 147 12.691 3.180 13.340 1127 HB2 GLU 147 1HB GLU 147 14.608 4.334 14.236 1128 HB3 GLU 147 2HB GLU 147 15.161 3.107 13.101 1129 HG2 GLU 147 1HG GLU 147 15.321 4.865 11.338 1130 HG3 GLU 147 2HG GLU 147 14.893 6.075 12.544 1131 H TRP 148 H TRP 148 12.620 5.441 10.751 1132 HA TRP 148 HA TRP 148 11.948 7.716 12.394 1133 HB2 TRP 148 1HB TRP 148 11.612 8.897 10.283 1134 HB3 TRP 148 2HB TRP 148 13.146 8.026 10.284 1135 HD1 TRP 148 HD1 TRP 148 13.393 5.935 8.724 1136 HE1 TRP 148 HE1 TRP 148 12.031 5.115 6.688 1137 HE3 TRP 148 HE3 TRP 148 9.166 8.743 9.294 1138 HZ2 TRP 148 HZ2 TRP 148 9.483 5.571 5.482 1139 HZ3 TRP 148 HZ3 TRP 148 7.284 8.522 7.696 1140 HH2 TRP 148 HH2 TRP 148 7.435 6.939 5.790 1141 H LEU 149 H LEU 149 10.207 5.062 11.136 1142 HA LEU 149 HA LEU 149 7.674 6.405 10.832 1143 HB2 LEU 149 1HB LEU 149 6.739 4.278 10.401 1144 HB3 LEU 149 2HB LEU 149 8.352 4.229 9.706 1145 HG LEU 149 HG LEU 149 8.917 3.315 12.222 1146 HD11 LEU 149 1HD1 LEU 149 7.208 2.093 13.219 1147 HD12 LEU 149 2HD1 LEU 149 6.306 1.905 11.717 1148 HD13 LEU 149 3HD1 LEU 149 6.283 3.443 12.570 1149 HD21 LEU 149 3HD2 LEU 149 9.304 2.219 9.891 1150 HD22 LEU 149 1HD2 LEU 149 7.782 1.381 10.190 1151 HD23 LEU 149 2HD2 LEU 149 9.145 1.153 11.282 1152 H SER 150 H SER 150 9.441 4.943 13.449 1153 HA SER 150 HA SER 150 7.461 4.308 15.271 1154 HB2 SER 150 1HB SER 150 10.107 5.666 15.835 1155 HB3 SER 150 2HB SER 150 9.136 4.777 17.006 1156 HG SER 150 HG SER 150 9.398 2.930 15.673 1157 H ARG 151 H ARG 151 8.761 7.405 14.340 1158 HA ARG 151 HA ARG 151 7.536 9.008 16.344 1159 HB2 ARG 151 1HB ARG 151 8.515 9.553 13.538 1160 HB3 ARG 151 2HB ARG 151 7.740 10.815 14.491 1161 HG2 ARG 151 1HG ARG 151 10.014 11.136 14.955 1162 HG3 ARG 151 2HG ARG 151 9.484 10.178 16.331 1163 HD2 ARG 151 1HD ARG 151 10.296 8.130 15.190 1164 HD3 ARG 151 2HD ARG 151 10.844 9.118 13.844 1165 HE ARG 151 HE ARG 151 12.073 8.926 16.484 1166 HH11 ARG 151 1HH2 ARG 151 11.796 10.590 13.461 1167 HH12 ARG 151 2HH2 ARG 151 13.344 11.355 13.585 1168 HH21 ARG 151 1HH1 ARG 151 14.096 9.934 16.657 1169 HH22 ARG 151 2HH1 ARG 151 14.646 10.985 15.396 1170 H HIS 152 H HIS 152 6.524 7.822 13.223 1171 HA HIS 152 HA HIS 152 4.009 9.207 13.255 1172 HB2 HIS 152 1HB HIS 152 5.084 6.953 11.541 1173 HB3 HIS 152 2HB HIS 152 3.512 7.712 11.298 1174 HD2 HIS 152 HD2 HIS 152 7.334 8.711 11.022 1175 HE1 HIS 152 HE1 HIS 152 5.025 11.643 9.056 1176 HE2 HIS 152 HE2 HIS 152 7.390 10.857 9.540 1177 H THR 153 H THR 153 1.984 8.229 13.503 1178 HA THR 153 HA THR 153 1.987 5.740 15.122 1179 HB THR 153 HB THR 153 1.290 7.822 16.356 1180 HG1 THR 153 HG1 THR 153 -0.255 6.687 17.361 1181 HG21 THR 153 3HG2 THR 153 -1.207 7.680 14.656 1182 HG22 THR 153 1HG2 THR 153 0.114 8.787 14.282 1183 HG23 THR 153 2HG2 THR 153 -0.747 8.926 15.815 1184 H CYS 154 H CYS 154 -0.801 5.424 15.084 1185 HA CYS 154 HA CYS 154 -1.150 4.502 12.306 1186 HB2 CYS 154 1HB CYS 154 -2.601 3.720 14.845 1187 HB3 CYS 154 2HB CYS 154 -2.887 3.030 13.246 1188 HG CYS 154 HG CYS 154 -1.073 1.453 13.858 1189 H ALA 155 H ALA 155 -4.099 4.365 13.617 1190 HA ALA 155 HA ALA 155 -4.915 6.990 12.499 1191 HB1 ALA 155 3HB ALA 155 -7.191 5.833 12.360 1192 HB2 ALA 155 1HB ALA 155 -6.325 4.332 12.687 1193 HB3 ALA 155 2HB ALA 155 -5.947 5.274 11.244 1194 H GLU 156 H GLU 156 -3.964 7.165 15.036 1195 HA GLU 156 HA GLU 156 -6.397 7.771 16.566 1196 HB2 GLU 156 1HB GLU 156 -5.082 6.888 18.631 1197 HB3 GLU 156 2HB GLU 156 -5.925 5.738 17.599 1198 HG2 GLU 156 1HG GLU 156 -3.926 5.067 16.516 1199 HG3 GLU 156 2HG GLU 156 -3.029 6.453 17.133 1200 HA PRO 157 HA PRO 157 -3.303 11.188 16.775 1201 HB2 PRO 157 1HB PRO 157 -5.003 13.284 16.620 1202 HB3 PRO 157 2HB PRO 157 -4.542 12.347 15.182 1203 HG2 PRO 157 1HG PRO 157 -7.021 12.163 16.839 1204 HG3 PRO 157 2HG PRO 157 -6.850 12.157 15.073 1205 HD2 PRO 157 1HD PRO 157 -7.175 9.870 16.562 1206 HD3 PRO 157 2HD PRO 157 -6.318 9.893 15.003 1207 H ASP 158 H ASP 158 -2.870 12.797 18.407 1208 HA ASP 158 HA ASP 158 -2.600 13.220 20.681 1209 HB2 ASP 158 1HB ASP 158 -5.512 13.779 20.110 1210 HB3 ASP 158 2HB ASP 158 -4.731 14.222 21.627 1211 H ALA 159 H ALA 159 -2.315 10.736 20.829 1212 HA ALA 159 HA ALA 159 -4.240 8.989 21.759 1213 HB1 ALA 159 3HB ALA 159 -1.789 8.525 21.198 1214 HB2 ALA 159 1HB ALA 159 -2.467 7.638 22.564 1215 HB3 ALA 159 2HB ALA 159 -1.429 9.036 22.848 1216 H GLU 160 H GLU 160 -1.952 10.754 23.865 1217 HA GLU 160 HA GLU 160 -2.124 11.435 26.052 1218 HB2 GLU 160 1HB GLU 160 -5.003 11.735 25.185 1219 HB3 GLU 160 2HB GLU 160 -4.388 12.295 26.739 1220 HG2 GLU 160 1HG GLU 160 -2.758 13.731 25.594 1221 HG3 GLU 160 2HG GLU 160 -3.330 13.153 24.030 1222 H SER 161 H SER 161 -2.436 8.563 25.389 1223 HA SER 161 HA SER 161 -4.398 7.407 27.099 1224 HB2 SER 161 1HB SER 161 -1.847 6.289 25.923 1225 HB3 SER 161 2HB SER 161 -3.016 5.328 26.826 1226 HG SER 161 HG SER 161 -3.110 6.276 24.265 Start of MODEL 12 1 H1 GLY 1 1H GLY 1 -10.185 17.092 -9.961 2 H2 GLY 1 2H GLY 1 -11.550 16.086 -9.857 3 H3 GLY 1 3H GLY 1 -11.223 17.210 -8.625 4 HA2 GLY 1 1HA GLY 1 -11.932 18.997 -9.838 5 HA3 GLY 1 2HA GLY 1 -11.596 18.187 -11.368 6 HA PRO 2 HA PRO 2 -16.213 18.132 -10.523 7 HB2 PRO 2 1HB PRO 2 -16.103 18.339 -13.512 8 HB3 PRO 2 2HB PRO 2 -17.142 19.203 -12.360 9 HG2 PRO 2 1HG PRO 2 -15.092 20.428 -13.521 10 HG3 PRO 2 2HG PRO 2 -15.491 20.735 -11.819 11 HD2 PRO 2 1HD PRO 2 -13.272 19.060 -12.960 12 HD3 PRO 2 2HD PRO 2 -13.267 20.108 -11.522 13 H LEU 3 H LEU 3 -14.227 16.483 -12.960 14 HA LEU 3 HA LEU 3 -15.953 14.079 -12.696 15 HB2 LEU 3 1HB LEU 3 -15.531 15.299 -15.009 16 HB3 LEU 3 2HB LEU 3 -13.998 14.440 -14.954 17 HG LEU 3 HG LEU 3 -15.582 13.062 -16.158 18 HD11 LEU 3 1HD1 LEU 3 -15.390 11.033 -14.932 19 HD12 LEU 3 2HD1 LEU 3 -15.429 11.872 -13.384 20 HD13 LEU 3 3HD1 LEU 3 -14.015 12.016 -14.430 21 HD21 LEU 3 3HD2 LEU 3 -17.778 12.705 -15.562 22 HD22 LEU 3 1HD2 LEU 3 -17.568 14.234 -14.719 23 HD23 LEU 3 2HD2 LEU 3 -17.442 12.715 -13.833 24 H GLY 4 H GLY 4 -15.058 12.920 -11.105 25 HA2 GLY 4 1HA GLY 4 -12.134 12.388 -11.197 26 HA3 GLY 4 2HA GLY 4 -13.120 12.343 -9.738 27 H SER 5 H SER 5 -11.501 10.207 -10.525 28 HA SER 5 HA SER 5 -13.520 8.105 -10.784 29 HB2 SER 5 1HB SER 5 -11.085 8.093 -12.570 30 HB3 SER 5 2HB SER 5 -12.462 6.993 -12.612 31 HG SER 5 HG SER 5 -13.755 8.850 -13.137 32 H MET 6 H MET 6 -10.800 9.386 -9.397 33 HA MET 6 HA MET 6 -10.354 7.024 -7.800 34 HB2 MET 6 1HB MET 6 -7.770 7.226 -8.428 35 HB3 MET 6 2HB MET 6 -8.859 6.222 -9.382 36 HG2 MET 6 1HG MET 6 -9.162 7.985 -11.019 37 HG3 MET 6 2HG MET 6 -8.236 9.115 -10.033 38 HE1 MET 6 3HE MET 6 -5.931 9.435 -9.979 39 HE2 MET 6 1HE MET 6 -4.650 8.317 -10.463 40 HE3 MET 6 2HE MET 6 -5.649 7.960 -9.058 41 H ASP 7 H ASP 7 -10.881 8.403 -6.062 42 HA ASP 7 HA ASP 7 -9.050 10.655 -5.518 43 HB2 ASP 7 1HB ASP 7 -10.710 11.261 -3.783 44 HB3 ASP 7 2HB ASP 7 -11.394 11.252 -5.406 45 H GLN 8 H GLN 8 -8.660 7.668 -5.186 46 HA GLN 8 HA GLN 8 -8.648 6.912 -2.487 47 HB2 GLN 8 1HB GLN 8 -6.856 6.160 -4.791 48 HB3 GLN 8 2HB GLN 8 -6.623 5.475 -3.179 49 HG2 GLN 8 1HG GLN 8 -8.015 3.971 -4.477 50 HG3 GLN 8 2HG GLN 8 -8.996 4.711 -3.214 51 HE21 GLN 8 2HE2 GLN 8 -10.872 4.200 -4.673 52 HE22 GLN 8 1HE2 GLN 8 -11.232 5.261 -5.945 53 H SER 9 H SER 9 -6.028 8.399 -4.384 54 HA SER 9 HA SER 9 -4.143 8.662 -2.358 55 HB2 SER 9 1HB SER 9 -4.643 10.604 -4.621 56 HB3 SER 9 2HB SER 9 -3.171 10.501 -3.662 57 HG SER 9 HG SER 9 -2.578 8.873 -4.838 58 H VAL 10 H VAL 10 -6.716 10.964 -3.250 59 HA VAL 10 HA VAL 10 -6.031 12.944 -1.366 60 HB VAL 10 HB VAL 10 -8.720 12.202 -2.545 61 HG11 VAL 10 1HG1 VAL 10 -9.185 13.541 -0.643 62 HG12 VAL 10 2HG1 VAL 10 -9.185 14.668 -1.999 63 HG13 VAL 10 3HG1 VAL 10 -7.786 14.576 -0.929 64 HG21 VAL 10 3HG2 VAL 10 -6.517 14.108 -3.361 65 HG22 VAL 10 1HG2 VAL 10 -8.163 14.244 -3.981 66 HG23 VAL 10 2HG2 VAL 10 -7.217 12.791 -4.305 67 H ALA 11 H ALA 11 -8.391 10.305 -1.205 68 HA ALA 11 HA ALA 11 -9.533 10.619 1.224 69 HB1 ALA 11 3HB ALA 11 -8.465 7.902 0.481 70 HB2 ALA 11 1HB ALA 11 -9.768 8.657 -0.440 71 HB3 ALA 11 2HB ALA 11 -9.984 8.315 1.278 72 H ILE 12 H ILE 12 -6.303 9.244 0.678 73 HA ILE 12 HA ILE 12 -5.737 8.569 3.328 74 HB ILE 12 HB ILE 12 -3.811 9.529 1.202 75 HG12 ILE 12 1HG1 ILE 12 -5.180 7.685 0.372 76 HG13 ILE 12 2HG1 ILE 12 -3.547 7.111 0.687 77 HG21 ILE 12 1HG2 ILE 12 -2.325 7.824 2.562 78 HG22 ILE 12 2HG2 ILE 12 -3.465 8.170 3.861 79 HG23 ILE 12 3HG2 ILE 12 -2.525 9.477 3.143 80 HD11 ILE 12 3HD1 ILE 12 -4.816 5.426 1.670 81 HD12 ILE 12 1HD1 ILE 12 -6.082 6.537 2.187 82 HD13 ILE 12 2HD1 ILE 12 -4.550 6.481 3.055 83 H GLN 13 H GLN 13 -4.768 11.437 1.532 84 HA GLN 13 HA GLN 13 -3.543 12.878 3.549 85 HB2 GLN 13 1HB GLN 13 -5.163 13.806 1.188 86 HB3 GLN 13 2HB GLN 13 -4.515 14.977 2.338 87 HG2 GLN 13 1HG GLN 13 -2.807 12.855 1.034 88 HG3 GLN 13 2HG GLN 13 -3.018 14.463 0.343 89 HE21 GLN 13 2HE2 GLN 13 -0.692 12.922 1.939 90 HE22 GLN 13 1HE2 GLN 13 -0.161 14.127 3.005 91 H GLU 14 H GLU 14 -7.052 12.919 2.799 92 HA GLU 14 HA GLU 14 -7.804 14.648 4.846 93 HB2 GLU 14 1HB GLU 14 -9.335 14.126 3.083 94 HB3 GLU 14 2HB GLU 14 -9.240 12.400 3.423 95 HG2 GLU 14 1HG GLU 14 -10.370 12.673 5.515 96 HG3 GLU 14 2HG GLU 14 -10.279 14.429 5.403 97 H THR 15 H THR 15 -6.637 11.445 4.974 98 HA THR 15 HA THR 15 -7.690 11.052 7.730 99 HB THR 15 HB THR 15 -7.250 8.674 7.391 100 HG1 THR 15 HG1 THR 15 -5.532 8.695 6.025 101 HG21 THR 15 3HG2 THR 15 -9.436 9.192 6.723 102 HG22 THR 15 1HG2 THR 15 -8.782 8.387 5.296 103 HG23 THR 15 2HG2 THR 15 -8.895 10.144 5.339 104 H LEU 16 H LEU 16 -4.754 11.173 5.789 105 HA LEU 16 HA LEU 16 -3.000 10.088 7.688 106 HB2 LEU 16 1HB LEU 16 -2.487 10.518 5.251 107 HB3 LEU 16 2HB LEU 16 -2.325 12.225 5.644 108 HG LEU 16 HG LEU 16 -0.490 11.689 7.224 109 HD11 LEU 16 1HD1 LEU 16 0.422 9.211 6.837 110 HD12 LEU 16 2HD1 LEU 16 -1.280 8.882 6.518 111 HD13 LEU 16 3HD1 LEU 16 -0.785 9.553 8.072 112 HD21 LEU 16 3HD2 LEU 16 0.100 12.203 4.912 113 HD22 LEU 16 1HD2 LEU 16 -0.165 10.523 4.443 114 HD23 LEU 16 2HD2 LEU 16 1.168 10.938 5.518 115 H VAL 17 H VAL 17 -1.751 13.124 7.046 116 HA VAL 17 HA VAL 17 -2.883 14.668 9.125 117 HB VAL 17 HB VAL 17 -1.831 13.177 10.681 118 HG11 VAL 17 1HG1 VAL 17 0.798 12.989 10.461 119 HG12 VAL 17 2HG1 VAL 17 0.482 13.346 8.764 120 HG13 VAL 17 3HG1 VAL 17 -0.241 11.927 9.515 121 HG21 VAL 17 3HG2 VAL 17 0.133 15.461 10.410 122 HG22 VAL 17 1HG2 VAL 17 -0.474 14.713 11.887 123 HG23 VAL 17 2HG2 VAL 17 -1.533 15.736 10.916 124 H GLU 18 H GLU 18 -1.979 16.773 9.166 125 HA GLU 18 HA GLU 18 -0.797 17.572 6.714 126 HB2 GLU 18 1HB GLU 18 -1.307 19.028 9.307 127 HB3 GLU 18 2HB GLU 18 -0.697 19.814 7.849 128 HG2 GLU 18 1HG GLU 18 -2.682 19.150 6.607 129 HG3 GLU 18 2HG GLU 18 -3.272 18.220 7.984 130 H GLY 19 H GLY 19 1.254 17.371 6.162 131 HA2 GLY 19 1HA GLY 19 3.475 18.504 6.934 132 HA3 GLY 19 2HA GLY 19 3.357 17.337 8.244 133 H GLU 20 H GLU 20 2.063 15.510 6.044 134 HA GLU 20 HA GLU 20 4.663 14.515 5.010 135 HB2 GLU 20 1HB GLU 20 2.118 13.065 5.743 136 HB3 GLU 20 2HB GLU 20 3.402 12.317 4.794 137 HG2 GLU 20 1HG GLU 20 3.928 11.693 7.004 138 HG3 GLU 20 2HG GLU 20 4.987 13.070 6.721 139 H TYR 21 H TYR 21 4.615 13.399 2.985 140 HA TYR 21 HA TYR 21 2.948 14.833 1.009 141 HB2 TYR 21 1HB TYR 21 5.470 14.994 0.959 142 HB3 TYR 21 2HB TYR 21 5.491 13.280 0.555 143 HD1 TYR 21 HD2 TYR 21 4.559 16.649 -0.621 144 HD2 TYR 21 HD1 TYR 21 4.734 12.469 -1.578 145 HE1 TYR 21 HE2 TYR 21 4.168 17.180 -3.013 146 HE2 TYR 21 HE1 TYR 21 4.346 12.993 -3.964 147 HH TYR 21 HH TYR 21 4.871 15.511 -5.400 148 H CYS 22 H CYS 22 1.419 13.783 -0.049 149 HA CYS 22 HA CYS 22 1.285 10.854 0.093 150 HB2 CYS 22 1HB CYS 22 -0.894 11.321 -1.246 151 HB3 CYS 22 2HB CYS 22 -0.840 11.787 0.452 152 HG CYS 22 HG CYS 22 -1.593 13.718 -1.485 153 H VAL 23 H VAL 23 1.579 9.536 -1.692 154 HA VAL 23 HA VAL 23 2.598 10.867 -4.144 155 HB VAL 23 HB VAL 23 3.341 8.210 -2.905 156 HG11 VAL 23 1HG1 VAL 23 5.126 8.333 -4.752 157 HG12 VAL 23 2HG1 VAL 23 4.102 9.558 -5.501 158 HG13 VAL 23 3HG1 VAL 23 3.488 7.923 -5.261 159 HG21 VAL 23 3HG2 VAL 23 4.828 10.829 -3.245 160 HG22 VAL 23 1HG2 VAL 23 5.561 9.329 -2.688 161 HG23 VAL 23 2HG2 VAL 23 4.310 10.109 -1.721 162 H ILE 24 H ILE 24 1.207 7.763 -3.077 163 HA ILE 24 HA ILE 24 -0.815 7.851 -5.136 164 HB ILE 24 HB ILE 24 1.176 7.215 -6.430 165 HG12 ILE 24 1HG1 ILE 24 -0.991 5.136 -6.034 166 HG13 ILE 24 2HG1 ILE 24 -0.789 6.288 -7.352 167 HG21 ILE 24 1HG2 ILE 24 1.330 4.679 -4.810 168 HG22 ILE 24 2HG2 ILE 24 2.258 6.114 -4.367 169 HG23 ILE 24 3HG2 ILE 24 2.513 5.346 -5.932 170 HD11 ILE 24 3HD1 ILE 24 -0.114 4.198 -8.244 171 HD12 ILE 24 1HD1 ILE 24 0.796 3.788 -6.793 172 HD13 ILE 24 2HD1 ILE 24 1.391 5.042 -7.877 173 H ALA 25 H ALA 25 -2.420 6.353 -4.835 174 HA ALA 25 HA ALA 25 -2.146 4.203 -2.911 175 HB1 ALA 25 3HB ALA 25 -3.767 4.971 -1.344 176 HB2 ALA 25 1HB ALA 25 -4.212 6.337 -2.364 177 HB3 ALA 25 2HB ALA 25 -2.645 6.314 -1.558 178 H VAL 26 H VAL 26 -3.083 2.596 -3.999 179 HA VAL 26 HA VAL 26 -5.641 3.155 -5.424 180 HB VAL 26 HB VAL 26 -3.755 0.967 -6.261 181 HG11 VAL 26 1HG1 VAL 26 -4.839 1.311 -8.429 182 HG12 VAL 26 2HG1 VAL 26 -5.719 2.699 -7.785 183 HG13 VAL 26 3HG1 VAL 26 -6.060 1.080 -7.176 184 HG21 VAL 26 3HG2 VAL 26 -2.998 2.801 -8.018 185 HG22 VAL 26 1HG2 VAL 26 -2.203 2.703 -6.448 186 HG23 VAL 26 2HG2 VAL 26 -3.443 3.924 -6.734 187 H GLN 27 H GLN 27 -7.248 2.177 -4.466 188 HA GLN 27 HA GLN 27 -7.053 0.318 -2.414 189 HB2 GLN 27 1HB GLN 27 -9.045 1.692 -2.823 190 HB3 GLN 27 2HB GLN 27 -9.365 0.801 -4.310 191 HG2 GLN 27 1HG GLN 27 -9.699 -1.259 -3.064 192 HG3 GLN 27 2HG GLN 27 -9.218 -0.469 -1.567 193 HE21 GLN 27 2HE2 GLN 27 -11.602 -1.456 -1.177 194 HE22 GLN 27 1HE2 GLN 27 -12.853 -0.338 -1.413 195 H GLY 28 H GLY 28 -7.596 -1.878 -2.311 196 HA2 GLY 28 1HA GLY 28 -7.495 -3.430 -4.824 197 HA3 GLY 28 2HA GLY 28 -6.300 -3.749 -3.572 198 H VAL 29 H VAL 29 -7.372 -5.901 -3.929 199 HA VAL 29 HA VAL 29 -9.518 -6.218 -1.913 200 HB VAL 29 HB VAL 29 -9.321 -7.948 -4.380 201 HG11 VAL 29 1HG1 VAL 29 -11.695 -8.418 -3.761 202 HG12 VAL 29 2HG1 VAL 29 -11.486 -7.410 -2.328 203 HG13 VAL 29 3HG1 VAL 29 -10.552 -8.895 -2.505 204 HG21 VAL 29 3HG2 VAL 29 -11.302 -6.574 -5.186 205 HG22 VAL 29 1HG2 VAL 29 -9.748 -5.743 -5.241 206 HG23 VAL 29 2HG2 VAL 29 -10.887 -5.393 -3.943 207 H LEU 30 H LEU 30 -9.499 -8.290 -0.904 208 HA LEU 30 HA LEU 30 -7.078 -9.923 -1.195 209 HB2 LEU 30 1HB LEU 30 -6.695 -8.142 0.615 210 HB3 LEU 30 2HB LEU 30 -7.972 -8.933 1.530 211 HG LEU 30 HG LEU 30 -5.645 -10.546 0.466 212 HD11 LEU 30 1HD1 LEU 30 -4.713 -10.186 2.879 213 HD12 LEU 30 2HD1 LEU 30 -5.666 -8.707 2.842 214 HD13 LEU 30 3HD1 LEU 30 -4.396 -8.968 1.645 215 HD21 LEU 30 3HD2 LEU 30 -6.207 -11.762 2.709 216 HD22 LEU 30 1HD2 LEU 30 -7.296 -11.972 1.344 217 HD23 LEU 30 2HD2 LEU 30 -7.715 -10.859 2.643 218 H CYS 31 H CYS 31 -7.776 -11.999 -1.300 219 HA CYS 31 HA CYS 31 -10.389 -12.634 -0.058 220 HB2 CYS 31 1HB CYS 31 -10.549 -12.830 -2.436 221 HB3 CYS 31 2HB CYS 31 -9.017 -13.696 -2.529 222 HG CYS 31 HG CYS 31 -11.180 -15.341 -2.540 223 H LYS 32 H LYS 32 -10.563 -14.333 1.203 224 HA LYS 32 HA LYS 32 -8.176 -16.032 1.695 225 HB2 LYS 32 1HB LYS 32 -10.152 -14.954 3.720 226 HB3 LYS 32 2HB LYS 32 -8.972 -16.219 4.062 227 HG2 LYS 32 1HG LYS 32 -7.152 -14.682 3.376 228 HG3 LYS 32 2HG LYS 32 -8.345 -13.413 3.102 229 HD2 LYS 32 1HD LYS 32 -9.011 -13.499 5.464 230 HD3 LYS 32 2HD LYS 32 -7.859 -14.804 5.751 231 HE2 LYS 32 1HE LYS 32 -6.717 -12.850 6.442 232 HE3 LYS 32 2HE LYS 32 -6.071 -13.190 4.837 233 HZ1 LYS 32 3HZ LYS 32 -7.841 -11.043 5.715 234 HZ2 LYS 32 1HZ LYS 32 -8.105 -11.676 4.166 235 HZ3 LYS 32 2HZ LYS 32 -6.591 -11.020 4.564 236 H GLY 33 H GLY 33 -8.604 -17.998 0.930 237 HA2 GLY 33 1HA GLY 33 -9.721 -19.915 0.370 238 HA3 GLY 33 2HA GLY 33 -10.649 -19.647 1.842 239 H ASP 34 H ASP 34 -12.604 -18.433 1.727 240 HA ASP 34 HA ASP 34 -13.688 -17.885 -0.956 241 HB2 ASP 34 1HB ASP 34 -14.910 -19.703 1.129 242 HB3 ASP 34 2HB ASP 34 -15.851 -18.974 -0.173 243 H SER 35 H SER 35 -12.706 -16.428 1.495 244 HA SER 35 HA SER 35 -15.154 -14.921 2.218 245 HB2 SER 35 1HB SER 35 -13.628 -15.969 4.027 246 HB3 SER 35 2HB SER 35 -12.466 -14.717 3.594 247 HG SER 35 HG SER 35 -15.030 -13.799 3.925 248 H ARG 36 H ARG 36 -15.410 -13.056 1.145 249 HA ARG 36 HA ARG 36 -13.102 -11.854 -0.201 250 HB2 ARG 36 1HB ARG 36 -15.477 -12.270 -1.231 251 HB3 ARG 36 2HB ARG 36 -15.915 -10.796 -0.375 252 HG2 ARG 36 1HG ARG 36 -15.226 -9.933 -2.434 253 HG3 ARG 36 2HG ARG 36 -13.731 -9.826 -1.508 254 HD2 ARG 36 1HD ARG 36 -13.012 -12.014 -2.461 255 HD3 ARG 36 2HD ARG 36 -14.494 -12.066 -3.408 256 HE ARG 36 HE ARG 36 -13.269 -9.642 -4.005 257 HH11 ARG 36 1HH2 ARG 36 -12.566 -13.025 -4.198 258 HH12 ARG 36 2HH2 ARG 36 -11.550 -12.874 -5.593 259 HH21 ARG 36 1HH1 ARG 36 -11.940 -9.436 -5.830 260 HH22 ARG 36 2HH1 ARG 36 -11.196 -10.840 -6.518 261 H GLN 37 H GLN 37 -12.088 -10.119 0.465 262 HA GLN 37 HA GLN 37 -13.345 -8.374 2.509 263 HB2 GLN 37 1HB GLN 37 -10.513 -9.457 2.458 264 HB3 GLN 37 2HB GLN 37 -11.088 -8.205 3.560 265 HG2 GLN 37 1HG GLN 37 -12.587 -9.689 4.648 266 HG3 GLN 37 2HG GLN 37 -12.481 -10.878 3.354 267 HE21 GLN 37 2HE2 GLN 37 -10.081 -11.693 3.007 268 HE22 GLN 37 1HE2 GLN 37 -9.223 -12.040 4.426 269 H SER 38 H SER 38 -12.830 -6.238 2.390 270 HA SER 38 HA SER 38 -11.440 -5.356 -0.089 271 HB2 SER 38 1HB SER 38 -12.893 -3.551 -0.261 272 HB3 SER 38 2HB SER 38 -13.958 -4.828 0.320 273 HG SER 38 HG SER 38 -12.585 -3.248 2.183 274 H ARG 39 H ARG 39 -9.595 -4.374 0.146 275 HA ARG 39 HA ARG 39 -8.956 -3.007 2.708 276 HB2 ARG 39 1HB ARG 39 -7.083 -4.602 0.945 277 HB3 ARG 39 2HB ARG 39 -6.651 -3.789 2.447 278 HG2 ARG 39 1HG ARG 39 -8.830 -5.879 2.378 279 HG3 ARG 39 2HG ARG 39 -7.137 -6.337 2.541 280 HD2 ARG 39 1HD ARG 39 -8.681 -4.504 4.404 281 HD3 ARG 39 2HD ARG 39 -8.157 -6.144 4.751 282 HE ARG 39 HE ARG 39 -6.505 -3.761 4.775 283 HH11 ARG 39 1HH2 ARG 39 -6.642 -7.210 4.505 284 HH12 ARG 39 2HH2 ARG 39 -5.023 -7.455 5.072 285 HH21 ARG 39 1HH1 ARG 39 -4.385 -4.077 5.523 286 HH22 ARG 39 2HH1 ARG 39 -3.747 -5.683 5.649 287 H LEU 40 H LEU 40 -7.745 -1.174 2.582 288 HA LEU 40 HA LEU 40 -7.477 0.033 -0.123 289 HB2 LEU 40 1HB LEU 40 -9.143 1.017 1.560 290 HB3 LEU 40 2HB LEU 40 -7.745 1.546 2.484 291 HG LEU 40 HG LEU 40 -7.779 2.248 -0.445 292 HD11 LEU 40 1HD1 LEU 40 -10.090 2.737 0.268 293 HD12 LEU 40 2HD1 LEU 40 -9.185 4.218 -0.040 294 HD13 LEU 40 3HD1 LEU 40 -9.469 3.687 1.618 295 HD21 LEU 40 3HD2 LEU 40 -5.918 2.890 1.133 296 HD22 LEU 40 1HD2 LEU 40 -7.083 3.871 2.023 297 HD23 LEU 40 2HD2 LEU 40 -6.691 4.265 0.352 298 H LEU 41 H LEU 41 -5.420 0.298 -0.808 299 HA LEU 41 HA LEU 41 -3.240 0.159 1.148 300 HB2 LEU 41 1HB LEU 41 -3.358 -0.044 -1.869 301 HB3 LEU 41 2HB LEU 41 -1.850 -0.010 -0.963 302 HG LEU 41 HG LEU 41 -2.755 -1.986 0.378 303 HD11 LEU 41 1HD1 LEU 41 -4.454 -3.340 -1.029 304 HD12 LEU 41 2HD1 LEU 41 -4.837 -1.806 -1.805 305 HD13 LEU 41 3HD1 LEU 41 -5.078 -2.003 -0.069 306 HD21 LEU 41 3HD2 LEU 41 -1.040 -2.214 -1.377 307 HD22 LEU 41 1HD2 LEU 41 -2.305 -2.332 -2.601 308 HD23 LEU 41 2HD2 LEU 41 -2.131 -3.601 -1.386 309 H GLY 42 H GLY 42 -1.364 1.582 0.792 310 HA2 GLY 42 1HA GLY 42 -1.721 4.069 -0.614 311 HA3 GLY 42 2HA GLY 42 -1.849 4.249 1.132 312 H LEU 43 H LEU 43 0.169 5.289 -0.713 313 HA LEU 43 HA LEU 43 2.582 4.146 0.569 314 HB2 LEU 43 1HB LEU 43 2.582 3.415 -1.753 315 HB3 LEU 43 2HB LEU 43 2.287 5.059 -2.302 316 HG LEU 43 HG LEU 43 4.457 5.783 -1.465 317 HD11 LEU 43 1HD1 LEU 43 6.006 3.829 -0.636 318 HD12 LEU 43 2HD1 LEU 43 4.484 3.023 -0.252 319 HD13 LEU 43 3HD1 LEU 43 4.878 4.572 0.493 320 HD21 LEU 43 3HD2 LEU 43 4.692 3.161 -2.979 321 HD22 LEU 43 1HD2 LEU 43 5.904 4.441 -2.935 322 HD23 LEU 43 2HD2 LEU 43 4.348 4.730 -3.709 323 H VAL 44 H VAL 44 3.844 5.615 1.563 324 HA VAL 44 HA VAL 44 3.331 8.499 0.998 325 HB VAL 44 HB VAL 44 3.613 8.916 3.408 326 HG11 VAL 44 1HG1 VAL 44 1.416 8.207 4.028 327 HG12 VAL 44 2HG1 VAL 44 1.489 6.813 2.949 328 HG13 VAL 44 3HG1 VAL 44 1.370 8.439 2.280 329 HG21 VAL 44 3HG2 VAL 44 3.385 6.844 4.898 330 HG22 VAL 44 1HG2 VAL 44 4.953 7.064 4.124 331 HG23 VAL 44 2HG2 VAL 44 3.804 5.894 3.474 332 H ARG 45 H ARG 45 5.020 9.727 0.659 333 HA ARG 45 HA ARG 45 7.724 8.656 1.254 334 HB2 ARG 45 1HB ARG 45 7.246 8.953 -1.158 335 HB3 ARG 45 2HB ARG 45 6.900 10.659 -0.865 336 HG2 ARG 45 1HG ARG 45 9.204 10.955 0.007 337 HG3 ARG 45 2HG ARG 45 9.540 9.259 -0.337 338 HD2 ARG 45 1HD ARG 45 8.683 11.308 -2.397 339 HD3 ARG 45 2HD ARG 45 10.341 10.768 -2.146 340 HE ARG 45 HE ARG 45 8.775 8.484 -2.557 341 HH11 ARG 45 1HH2 ARG 45 9.764 11.352 -4.220 342 HH12 ARG 45 2HH2 ARG 45 9.690 10.631 -5.793 343 HH21 ARG 45 1HH1 ARG 45 8.672 7.533 -4.615 344 HH22 ARG 45 2HH1 ARG 45 9.070 8.469 -6.017 345 H TYR 46 H TYR 46 8.971 9.814 2.554 346 HA TYR 46 HA TYR 46 8.238 12.605 3.214 347 HB2 TYR 46 1HB TYR 46 7.260 11.121 4.917 348 HB3 TYR 46 2HB TYR 46 8.843 10.403 5.199 349 HD1 TYR 46 HD1 TYR 46 6.916 13.584 5.378 350 HD2 TYR 46 HD2 TYR 46 10.444 11.456 6.590 351 HE1 TYR 46 HE1 TYR 46 7.451 15.389 6.992 352 HE2 TYR 46 HE2 TYR 46 10.980 13.259 8.199 353 HH TYR 46 HH TYR 46 10.227 15.113 9.194 354 H ARG 47 H ARG 47 9.992 13.947 3.501 355 HA ARG 47 HA ARG 47 12.632 12.766 2.946 356 HB2 ARG 47 1HB ARG 47 13.334 15.009 2.385 357 HB3 ARG 47 2HB ARG 47 11.822 14.661 1.552 358 HG2 ARG 47 1HG ARG 47 10.597 15.832 3.404 359 HG3 ARG 47 2HG ARG 47 12.157 16.290 4.089 360 HD2 ARG 47 1HD ARG 47 11.222 16.986 1.292 361 HD3 ARG 47 2HD ARG 47 11.198 18.088 2.664 362 HE ARG 47 HE ARG 47 13.536 17.247 1.152 363 HH11 ARG 47 1HH2 ARG 47 12.258 18.627 4.057 364 HH12 ARG 47 2HH2 ARG 47 13.732 19.427 4.488 365 HH21 ARG 47 1HH1 ARG 47 15.471 18.293 1.712 366 HH22 ARG 47 2HH1 ARG 47 15.552 19.237 3.161 367 H LEU 48 H LEU 48 14.440 13.154 4.208 368 HA LEU 48 HA LEU 48 13.876 13.856 7.025 369 HB2 LEU 48 1HB LEU 48 16.222 12.379 5.802 370 HB3 LEU 48 2HB LEU 48 15.995 12.699 7.520 371 HG LEU 48 HG LEU 48 14.076 11.106 5.792 372 HD11 LEU 48 1HD1 LEU 48 16.334 10.309 7.640 373 HD12 LEU 48 2HD1 LEU 48 16.000 9.745 6.004 374 HD13 LEU 48 3HD1 LEU 48 14.978 9.221 7.341 375 HD21 LEU 48 3HD2 LEU 48 12.775 11.920 7.563 376 HD22 LEU 48 1HD2 LEU 48 14.124 11.922 8.697 377 HD23 LEU 48 2HD2 LEU 48 13.360 10.403 8.230 378 H GLU 49 H GLU 49 15.015 15.394 8.088 379 HA GLU 49 HA GLU 49 15.902 17.657 6.762 380 HB2 GLU 49 1HB GLU 49 16.622 16.610 9.508 381 HB3 GLU 49 2HB GLU 49 17.025 18.230 8.938 382 HG2 GLU 49 1HG GLU 49 14.667 18.742 8.592 383 HG3 GLU 49 2HG GLU 49 14.217 17.096 9.034 384 H ASN 50 H ASN 50 17.454 14.653 7.077 385 HA ASN 50 HA ASN 50 20.170 15.667 6.829 386 HB2 ASN 50 1HB ASN 50 19.033 12.865 6.708 387 HB3 ASN 50 2HB ASN 50 20.750 13.255 6.655 388 HD21 ASN 50 2HD2 ASN 50 19.886 15.618 8.595 389 HD22 ASN 50 1HD2 ASN 50 19.894 14.853 10.109 390 H ASP 51 H ASP 51 17.607 15.292 4.754 391 HA ASP 51 HA ASP 51 17.551 15.719 2.465 392 HB2 ASP 51 1HB ASP 51 20.404 14.802 2.126 393 HB3 ASP 51 2HB ASP 51 19.461 15.898 1.125 394 H ALA 52 H ALA 52 18.359 13.030 4.228 395 HA ALA 52 HA ALA 52 18.468 11.036 2.188 396 HB1 ALA 52 3HB ALA 52 17.949 9.514 4.194 397 HB2 ALA 52 1HB ALA 52 18.027 10.981 5.172 398 HB3 ALA 52 2HB ALA 52 19.442 10.451 4.262 399 H GLN 53 H GLN 53 16.879 9.715 1.417 400 HA GLN 53 HA GLN 53 14.088 10.581 1.882 401 HB2 GLN 53 1HB GLN 53 15.345 9.012 -0.383 402 HB3 GLN 53 2HB GLN 53 13.633 9.418 -0.264 403 HG2 GLN 53 1HG GLN 53 15.874 11.459 -0.275 404 HG3 GLN 53 2HG GLN 53 14.926 11.017 -1.695 405 HE21 GLN 53 2HE2 GLN 53 15.118 13.464 0.427 406 HE22 GLN 53 1HE2 GLN 53 13.480 13.880 0.580 407 H GLU 54 H GLU 54 12.485 9.116 2.391 408 HA GLU 54 HA GLU 54 13.189 6.294 2.751 409 HB2 GLU 54 1HB GLU 54 12.109 8.020 4.999 410 HB3 GLU 54 2HB GLU 54 12.266 6.266 5.052 411 HG2 GLU 54 1HG GLU 54 14.556 8.225 4.684 412 HG3 GLU 54 2HG GLU 54 14.174 7.362 6.167 413 H HIS 55 H HIS 55 11.448 4.911 2.672 414 HA HIS 55 HA HIS 55 8.777 6.098 2.156 415 HB2 HIS 55 1HB HIS 55 10.079 3.880 0.570 416 HB3 HIS 55 2HB HIS 55 8.474 4.555 0.293 417 HD2 HIS 55 HD2 HIS 55 8.456 6.899 -1.243 418 HE1 HIS 55 HE1 HIS 55 12.643 7.384 -1.489 419 HE2 HIS 55 HE2 HIS 55 10.411 8.244 -2.335 420 H ALA 56 H ALA 56 7.009 4.628 2.479 421 HA ALA 56 HA ALA 56 7.511 2.055 3.729 422 HB1 ALA 56 3HB ALA 56 7.633 3.396 5.693 423 HB2 ALA 56 1HB ALA 56 5.998 2.734 5.667 424 HB3 ALA 56 2HB ALA 56 6.283 4.404 5.174 425 H LEU 57 H LEU 57 5.735 0.690 3.511 426 HA LEU 57 HA LEU 57 3.628 1.641 1.699 427 HB2 LEU 57 1HB LEU 57 4.816 -0.436 1.123 428 HB3 LEU 57 2HB LEU 57 4.300 -1.162 2.642 429 HG LEU 57 HG LEU 57 1.924 -0.894 1.939 430 HD11 LEU 57 1HD1 LEU 57 1.851 0.915 0.443 431 HD12 LEU 57 2HD1 LEU 57 1.694 -0.461 -0.642 432 HD13 LEU 57 3HD1 LEU 57 3.252 0.350 -0.466 433 HD21 LEU 57 3HD2 LEU 57 1.955 -2.666 0.243 434 HD22 LEU 57 1HD2 LEU 57 3.181 -2.985 1.470 435 HD23 LEU 57 2HD2 LEU 57 3.653 -2.332 -0.099 436 H PHE 58 H PHE 58 2.136 2.719 2.863 437 HA PHE 58 HA PHE 58 1.240 1.813 5.446 438 HB2 PHE 58 1HB PHE 58 0.595 4.097 3.601 439 HB3 PHE 58 2HB PHE 58 -0.478 3.743 4.950 440 HD1 PHE 58 HD1 PHE 58 3.171 3.056 5.240 441 HD2 PHE 58 HD2 PHE 58 0.015 5.880 6.030 442 HE1 PHE 58 HE1 PHE 58 4.634 4.267 6.800 443 HE2 PHE 58 HE2 PHE 58 1.506 7.084 7.596 444 HZ PHE 58 HZ PHE 58 3.815 6.279 7.982 445 H LEU 59 H LEU 59 -0.645 0.912 6.006 446 HA LEU 59 HA LEU 59 -2.412 -0.070 3.834 447 HB2 LEU 59 1HB LEU 59 -1.579 -1.386 6.418 448 HB3 LEU 59 2HB LEU 59 -3.007 -1.893 5.530 449 HG LEU 59 HG LEU 59 -0.257 -1.720 4.266 450 HD11 LEU 59 1HD1 LEU 59 0.013 -3.353 5.962 451 HD12 LEU 59 2HD1 LEU 59 -0.360 -4.276 4.505 452 HD13 LEU 59 3HD1 LEU 59 -1.613 -3.994 5.715 453 HD21 LEU 59 3HD2 LEU 59 -1.520 -3.542 2.791 454 HD22 LEU 59 1HD2 LEU 59 -1.755 -1.825 2.487 455 HD23 LEU 59 2HD2 LEU 59 -2.959 -2.729 3.401 456 H TYR 60 H TYR 60 -4.389 0.638 3.898 457 HA TYR 60 HA TYR 60 -5.430 1.928 6.369 458 HB2 TYR 60 1HB TYR 60 -5.857 2.508 3.434 459 HB3 TYR 60 2HB TYR 60 -6.848 3.209 4.703 460 HD1 TYR 60 HD2 TYR 60 -3.493 3.143 3.151 461 HD2 TYR 60 HD1 TYR 60 -5.941 4.887 6.224 462 HE1 TYR 60 HE2 TYR 60 -1.818 4.938 3.473 463 HE2 TYR 60 HE1 TYR 60 -4.258 6.676 6.547 464 HH TYR 60 HH TYR 60 -1.164 6.622 4.827 465 H THR 61 H THR 61 -7.292 1.017 7.197 466 HA THR 61 HA THR 61 -8.529 -1.152 5.649 467 HB THR 61 HB THR 61 -8.105 -1.409 8.116 468 HG1 THR 61 HG1 THR 61 -9.849 -2.434 6.814 469 HG21 THR 61 3HG2 THR 61 -9.430 -0.220 9.701 470 HG22 THR 61 1HG2 THR 61 -10.455 0.462 8.439 471 HG23 THR 61 2HG2 THR 61 -8.785 1.004 8.609 472 H HIS 62 H HIS 62 -10.954 -1.172 5.583 473 HA HIS 62 HA HIS 62 -12.364 1.276 5.796 474 HB2 HIS 62 1HB HIS 62 -12.652 1.905 3.545 475 HB3 HIS 62 2HB HIS 62 -10.917 1.649 3.730 476 HD2 HIS 62 HD2 HIS 62 -10.009 -0.913 2.576 477 HE1 HIS 62 HE1 HIS 62 -13.462 -1.337 0.182 478 HE2 HIS 62 HE2 HIS 62 -11.113 -2.212 0.597 479 H ARG 63 H ARG 63 -14.574 1.092 4.879 480 HA ARG 63 HA ARG 63 -15.549 -1.601 5.370 481 HB2 ARG 63 1HB ARG 63 -16.542 0.860 6.064 482 HB3 ARG 63 2HB ARG 63 -17.509 0.516 4.630 483 HG2 ARG 63 1HG ARG 63 -17.998 -1.750 5.606 484 HG3 ARG 63 2HG ARG 63 -17.191 -1.223 7.079 485 HD2 ARG 63 1HD ARG 63 -19.592 0.142 5.833 486 HD3 ARG 63 2HD ARG 63 -19.655 -0.945 7.217 487 HE ARG 63 HE ARG 63 -18.727 1.801 7.216 488 HH11 ARG 63 1HH2 ARG 63 -18.684 -1.296 8.767 489 HH12 ARG 63 2HH2 ARG 63 -18.268 -0.661 10.323 490 HH21 ARG 63 1HH1 ARG 63 -18.183 2.636 9.251 491 HH22 ARG 63 2HH1 ARG 63 -17.985 1.565 10.598 492 H ARG 64 H ARG 64 -17.904 -1.404 3.819 493 HA ARG 64 HA ARG 64 -17.045 -2.614 1.429 494 HB2 ARG 64 1HB ARG 64 -19.706 -1.414 2.219 495 HB3 ARG 64 2HB ARG 64 -19.454 -2.381 0.766 496 HG2 ARG 64 1HG ARG 64 -18.659 -3.444 3.478 497 HG3 ARG 64 2HG ARG 64 -20.326 -3.568 2.922 498 HD2 ARG 64 1HD ARG 64 -19.475 -4.704 0.839 499 HD3 ARG 64 2HD ARG 64 -17.872 -4.713 1.563 500 HE ARG 64 HE ARG 64 -20.031 -5.938 3.117 501 HH11 ARG 64 1HH2 ARG 64 -17.302 -6.285 1.005 502 HH12 ARG 64 2HH2 ARG 64 -17.043 -7.951 1.395 503 HH21 ARG 64 1HH1 ARG 64 -19.697 -8.129 3.616 504 HH22 ARG 64 2HH1 ARG 64 -18.397 -8.995 2.866 505 H MET 65 H MET 65 -18.234 0.685 2.107 506 HA MET 65 HA MET 65 -16.970 1.588 -0.391 507 HB2 MET 65 1HB MET 65 -19.092 3.018 -0.743 508 HB3 MET 65 2HB MET 65 -19.180 1.308 -1.169 509 HG2 MET 65 1HG MET 65 -20.233 0.790 0.984 510 HG3 MET 65 2HG MET 65 -20.086 2.477 1.480 511 HE1 MET 65 3HE MET 65 -22.885 2.712 1.885 512 HE2 MET 65 1HE MET 65 -22.516 0.987 1.760 513 HE3 MET 65 2HE MET 65 -23.878 1.667 0.872 514 H ALA 66 H ALA 66 -16.364 1.836 2.477 515 HA ALA 66 HA ALA 66 -16.938 4.654 3.085 516 HB1 ALA 66 3HB ALA 66 -17.076 3.296 5.001 517 HB2 ALA 66 1HB ALA 66 -15.510 4.095 5.140 518 HB3 ALA 66 2HB ALA 66 -15.602 2.426 4.591 519 H ILE 67 H ILE 67 -15.263 3.854 0.798 520 HA ILE 67 HA ILE 67 -12.509 4.339 1.309 521 HB ILE 67 HB ILE 67 -12.418 4.646 -1.165 522 HG12 ILE 67 1HG1 ILE 67 -15.435 4.313 -0.970 523 HG13 ILE 67 2HG1 ILE 67 -14.622 5.829 -1.352 524 HG21 ILE 67 1HG2 ILE 67 -13.263 2.382 -1.718 525 HG22 ILE 67 2HG2 ILE 67 -14.144 2.348 -0.191 526 HG23 ILE 67 3HG2 ILE 67 -12.381 2.385 -0.190 527 HD11 ILE 67 3HD1 ILE 67 -14.476 3.272 -2.974 528 HD12 ILE 67 1HD1 ILE 67 -13.586 4.750 -3.336 529 HD13 ILE 67 2HD1 ILE 67 -15.347 4.739 -3.416 530 H THR 68 H THR 68 -15.227 6.376 0.780 531 HA THR 68 HA THR 68 -14.280 8.686 -0.275 532 HB THR 68 HB THR 68 -16.126 9.788 0.633 533 HG1 THR 68 HG1 THR 68 -16.251 9.741 2.716 534 HG21 THR 68 3HG2 THR 68 -16.584 7.584 -0.609 535 HG22 THR 68 1HG2 THR 68 -17.901 8.240 0.362 536 HG23 THR 68 2HG2 THR 68 -16.935 6.900 0.979 537 H GLY 69 H GLY 69 -13.625 7.670 3.102 538 HA2 GLY 69 1HA GLY 69 -11.447 8.635 3.919 539 HA3 GLY 69 2HA GLY 69 -12.115 10.204 3.475 540 H ASP 70 H ASP 70 -14.792 8.824 4.236 541 HA ASP 70 HA ASP 70 -15.144 10.069 6.721 542 HB2 ASP 70 1HB ASP 70 -16.979 9.526 5.165 543 HB3 ASP 70 2HB ASP 70 -16.752 7.813 5.509 544 H ASP 71 H ASP 71 -14.840 6.482 6.088 545 HA ASP 71 HA ASP 71 -14.002 6.255 8.936 546 HB2 ASP 71 1HB ASP 71 -15.955 4.638 7.311 547 HB3 ASP 71 2HB ASP 71 -15.160 3.951 8.697 548 H VAL 72 H VAL 72 -12.034 6.567 7.131 549 HA VAL 72 HA VAL 72 -10.773 3.926 7.270 550 HB VAL 72 HB VAL 72 -11.520 3.879 5.044 551 HG11 VAL 72 1HG1 VAL 72 -12.222 6.240 4.895 552 HG12 VAL 72 2HG1 VAL 72 -11.239 5.794 3.501 553 HG13 VAL 72 3HG1 VAL 72 -10.530 6.733 4.813 554 HG21 VAL 72 3HG2 VAL 72 -8.843 5.104 4.483 555 HG22 VAL 72 1HG2 VAL 72 -9.494 3.548 3.972 556 HG23 VAL 72 2HG2 VAL 72 -8.874 3.753 5.608 557 H SER 73 H SER 73 -8.918 4.085 8.303 558 HA SER 73 HA SER 73 -7.149 6.328 7.786 559 HB2 SER 73 1HB SER 73 -8.248 5.674 10.533 560 HB3 SER 73 2HB SER 73 -6.891 6.753 10.224 561 HG SER 73 HG SER 73 -9.610 7.046 9.491 562 H LEU 74 H LEU 74 -5.046 5.888 9.025 563 HA LEU 74 HA LEU 74 -3.853 3.643 8.177 564 HB2 LEU 74 1HB LEU 74 -3.320 5.389 10.543 565 HB3 LEU 74 2HB LEU 74 -2.363 3.920 10.379 566 HG LEU 74 HG LEU 74 -2.705 5.896 8.120 567 HD11 LEU 74 1HD1 LEU 74 -0.532 6.836 8.756 568 HD12 LEU 74 2HD1 LEU 74 -0.444 5.744 10.140 569 HD13 LEU 74 3HD1 LEU 74 -1.674 7.007 10.089 570 HD21 LEU 74 3HD2 LEU 74 -0.221 4.385 8.153 571 HD22 LEU 74 1HD2 LEU 74 -1.498 4.387 6.943 572 HD23 LEU 74 2HD2 LEU 74 -1.571 3.268 8.296 573 H ASP 75 H ASP 75 -3.708 1.595 8.538 574 HA ASP 75 HA ASP 75 -5.144 0.372 10.818 575 HB2 ASP 75 1HB ASP 75 -5.920 -0.275 8.551 576 HB3 ASP 75 2HB ASP 75 -4.299 -0.860 8.181 577 H GLN 76 H GLN 76 -2.274 -0.352 8.732 578 HA GLN 76 HA GLN 76 -0.595 -0.633 11.066 579 HB2 GLN 76 1HB GLN 76 -1.818 -2.873 10.803 580 HB3 GLN 76 2HB GLN 76 -0.891 -3.071 9.313 581 HG2 GLN 76 1HG GLN 76 1.180 -2.498 10.807 582 HG3 GLN 76 2HG GLN 76 0.114 -2.900 12.153 583 HE21 GLN 76 2HE2 GLN 76 2.420 -4.237 10.202 584 HE22 GLN 76 1HE2 GLN 76 1.927 -5.856 10.248 585 H ILE 77 H ILE 77 1.274 0.226 10.506 586 HA ILE 77 HA ILE 77 2.019 0.619 7.720 587 HB ILE 77 HB ILE 77 3.386 1.363 10.325 588 HG12 ILE 77 1HG1 ILE 77 1.927 3.113 8.322 589 HG13 ILE 77 2HG1 ILE 77 1.163 2.457 9.771 590 HG21 ILE 77 1HG2 ILE 77 4.627 2.971 8.735 591 HG22 ILE 77 2HG2 ILE 77 4.065 1.922 7.435 592 HG23 ILE 77 3HG2 ILE 77 5.111 1.281 8.695 593 HD11 ILE 77 3HD1 ILE 77 3.506 4.371 9.623 594 HD12 ILE 77 1HD1 ILE 77 3.039 3.541 11.106 595 HD13 ILE 77 2HD1 ILE 77 1.922 4.665 10.335 596 H VAL 78 H VAL 78 3.461 -0.529 6.597 597 HA VAL 78 HA VAL 78 5.034 -2.641 7.983 598 HB VAL 78 HB VAL 78 3.902 -2.655 5.174 599 HG11 VAL 78 1HG1 VAL 78 4.714 -5.043 5.250 600 HG12 VAL 78 2HG1 VAL 78 5.555 -4.650 6.749 601 HG13 VAL 78 3HG1 VAL 78 6.008 -3.845 5.246 602 HG21 VAL 78 3HG2 VAL 78 2.313 -2.982 7.178 603 HG22 VAL 78 1HG2 VAL 78 3.196 -4.480 7.482 604 HG23 VAL 78 2HG2 VAL 78 2.330 -4.258 5.962 605 HA PRO 79 HA PRO 79 7.938 0.520 6.206 606 HB2 PRO 79 1HB PRO 79 9.722 -0.804 8.218 607 HB3 PRO 79 2HB PRO 79 9.438 0.921 7.921 608 HG2 PRO 79 1HG PRO 79 8.403 -0.277 10.052 609 HG3 PRO 79 2HG PRO 79 7.473 0.935 9.156 610 HD2 PRO 79 1HD PRO 79 7.225 -2.057 9.081 611 HD3 PRO 79 2HD PRO 79 5.950 -0.825 9.084 612 H LEU 80 H LEU 80 9.300 0.225 4.544 613 HA LEU 80 HA LEU 80 9.716 -2.340 3.471 614 HB2 LEU 80 1HB LEU 80 10.942 0.353 2.859 615 HB3 LEU 80 2HB LEU 80 11.214 -1.087 1.879 616 HG LEU 80 HG LEU 80 8.457 -0.001 2.524 617 HD11 LEU 80 1HD1 LEU 80 9.614 1.702 1.269 618 HD12 LEU 80 2HD1 LEU 80 8.526 0.869 0.160 619 HD13 LEU 80 3HD1 LEU 80 10.253 0.509 0.138 620 HD21 LEU 80 3HD2 LEU 80 8.059 -1.352 0.282 621 HD22 LEU 80 1HD2 LEU 80 8.133 -2.208 1.816 622 HD23 LEU 80 2HD2 LEU 80 9.537 -2.188 0.749 623 H SER 81 H SER 81 11.202 -3.743 3.736 624 HA SER 81 HA SER 81 13.745 -3.051 5.114 625 HB2 SER 81 1HB SER 81 12.029 -5.510 5.512 626 HB3 SER 81 2HB SER 81 13.656 -5.311 6.157 627 HG SER 81 HG SER 81 11.266 -4.013 6.836 628 H LYS 82 H LYS 82 15.550 -4.461 4.603 629 HA LYS 82 HA LYS 82 15.961 -4.806 1.900 630 HB2 LYS 82 1HB LYS 82 17.729 -4.819 3.664 631 HB3 LYS 82 2HB LYS 82 17.240 -6.463 4.078 632 HG2 LYS 82 1HG LYS 82 17.757 -7.219 1.807 633 HG3 LYS 82 2HG LYS 82 18.171 -5.571 1.335 634 HD2 LYS 82 1HD LYS 82 19.981 -5.544 3.015 635 HD3 LYS 82 2HD LYS 82 19.578 -7.200 3.469 636 HE2 LYS 82 1HE LYS 82 20.066 -7.952 1.165 637 HE3 LYS 82 2HE LYS 82 20.477 -6.295 0.718 638 HZ1 LYS 82 3HZ LYS 82 21.893 -6.972 3.036 639 HZ2 LYS 82 1HZ LYS 82 22.505 -6.619 1.495 640 HZ3 LYS 82 2HZ LYS 82 22.116 -8.220 1.905 641 H ASP 83 H ASP 83 14.587 -7.093 4.229 642 HA ASP 83 HA ASP 83 14.577 -9.326 2.452 643 HB2 ASP 83 1HB ASP 83 13.054 -8.715 4.991 644 HB3 ASP 83 2HB ASP 83 12.903 -10.241 4.121 645 H PHE 84 H PHE 84 12.981 -6.487 2.208 646 HA PHE 84 HA PHE 84 10.316 -7.236 1.540 647 HB2 PHE 84 1HB PHE 84 10.999 -4.912 2.089 648 HB3 PHE 84 2HB PHE 84 11.908 -4.845 0.582 649 HD1 PHE 84 HD1 PHE 84 8.555 -5.006 2.106 650 HD2 PHE 84 HD2 PHE 84 10.755 -4.641 -1.562 651 HE1 PHE 84 HE1 PHE 84 6.491 -4.276 0.945 652 HE2 PHE 84 HE2 PHE 84 8.687 -3.915 -2.727 653 HZ PHE 84 HZ PHE 84 6.557 -3.734 -1.474 654 H MET 85 H MET 85 9.445 -7.890 -0.369 655 HA MET 85 HA MET 85 10.755 -7.677 -2.879 656 HB2 MET 85 1HB MET 85 12.140 -9.503 -1.925 657 HB3 MET 85 2HB MET 85 10.681 -10.460 -1.673 658 HG2 MET 85 1HG MET 85 11.735 -11.154 -3.762 659 HG3 MET 85 2HG MET 85 10.223 -10.330 -4.136 660 HE1 MET 85 3HE MET 85 10.696 -9.769 -6.527 661 HE2 MET 85 1HE MET 85 12.150 -10.768 -6.386 662 HE3 MET 85 2HE MET 85 12.238 -9.181 -7.145 663 H LEU 86 H LEU 86 9.352 -8.189 -4.570 664 HA LEU 86 HA LEU 86 6.598 -8.906 -3.737 665 HB2 LEU 86 1HB LEU 86 7.299 -7.642 -6.380 666 HB3 LEU 86 2HB LEU 86 5.796 -7.563 -5.462 667 HG LEU 86 HG LEU 86 7.460 -6.383 -3.660 668 HD11 LEU 86 1HD1 LEU 86 9.204 -5.157 -4.621 669 HD12 LEU 86 2HD1 LEU 86 8.528 -5.254 -6.245 670 HD13 LEU 86 3HD1 LEU 86 9.300 -6.665 -5.527 671 HD21 LEU 86 3HD2 LEU 86 6.675 -4.191 -4.600 672 HD22 LEU 86 1HD2 LEU 86 5.383 -5.381 -4.454 673 HD23 LEU 86 2HD2 LEU 86 6.101 -5.048 -6.030 674 H GLU 87 H GLU 87 5.774 -10.816 -4.460 675 HA GLU 87 HA GLU 87 7.269 -12.250 -6.588 676 HB2 GLU 87 1HB GLU 87 5.703 -13.325 -4.232 677 HB3 GLU 87 2HB GLU 87 6.393 -14.314 -5.516 678 HG2 GLU 87 1HG GLU 87 8.004 -12.439 -3.766 679 HG3 GLU 87 2HG GLU 87 7.851 -14.170 -3.481 680 H GLU 88 H GLU 88 6.235 -12.655 -8.371 681 HA GLU 88 HA GLU 88 3.469 -11.940 -8.731 682 HB2 GLU 88 1HB GLU 88 5.418 -13.375 -10.556 683 HB3 GLU 88 2HB GLU 88 3.805 -12.848 -11.036 684 HG2 GLU 88 1HG GLU 88 5.977 -11.010 -9.987 685 HG3 GLU 88 2HG GLU 88 5.580 -11.222 -11.690 686 H VAL 89 H VAL 89 1.691 -13.294 -8.936 687 HA VAL 89 HA VAL 89 2.098 -16.065 -7.965 688 HB VAL 89 HB VAL 89 -0.526 -14.658 -8.338 689 HG11 VAL 89 1HG1 VAL 89 -1.369 -16.322 -6.848 690 HG12 VAL 89 2HG1 VAL 89 0.257 -16.853 -6.422 691 HG13 VAL 89 3HG1 VAL 89 -0.383 -17.172 -8.036 692 HG21 VAL 89 3HG2 VAL 89 -0.386 -14.103 -5.914 693 HG22 VAL 89 1HG2 VAL 89 0.850 -13.270 -6.856 694 HG23 VAL 89 2HG2 VAL 89 1.276 -14.691 -5.901 695 H SER 90 H SER 90 1.776 -17.755 -9.230 696 HA SER 90 HA SER 90 1.760 -17.719 -11.975 697 HB2 SER 90 1HB SER 90 0.540 -19.846 -10.216 698 HB3 SER 90 2HB SER 90 1.044 -20.051 -11.892 699 HG SER 90 HG SER 90 3.090 -18.991 -10.714 700 HA PRO 91 HA PRO 91 -2.479 -16.015 -12.515 701 HB2 PRO 91 1HB PRO 91 -1.766 -16.624 -15.366 702 HB3 PRO 91 2HB PRO 91 -2.484 -15.154 -14.672 703 HG2 PRO 91 1HG PRO 91 0.069 -15.208 -15.383 704 HG3 PRO 91 2HG PRO 91 -0.445 -14.365 -13.908 705 HD2 PRO 91 1HD PRO 91 0.946 -17.011 -14.179 706 HD3 PRO 91 2HD PRO 91 1.127 -15.757 -12.933 707 H ASP 92 H ASP 92 -1.350 -18.758 -14.515 708 HA ASP 92 HA ASP 92 -2.387 -20.714 -15.146 709 HB2 ASP 92 1HB ASP 92 -2.246 -21.057 -12.657 710 HB3 ASP 92 2HB ASP 92 -3.889 -20.430 -12.533 711 H GLY 93 H GLY 93 -3.479 -18.304 -16.127 712 HA2 GLY 93 1HA GLY 93 -6.381 -18.931 -16.305 713 HA3 GLY 93 2HA GLY 93 -5.715 -17.307 -16.426 714 H GLU 94 H GLU 94 -7.333 -18.979 -18.295 715 HA GLU 94 HA GLU 94 -5.527 -19.334 -20.577 716 HB2 GLU 94 1HB GLU 94 -7.773 -20.027 -21.685 717 HB3 GLU 94 2HB GLU 94 -7.074 -21.095 -20.470 718 HG2 GLU 94 1HG GLU 94 -9.054 -18.956 -19.689 719 HG3 GLU 94 2HG GLU 94 -9.599 -20.519 -20.283 720 H LEU 95 H LEU 95 -5.053 -17.588 -21.716 721 HA LEU 95 HA LEU 95 -5.445 -15.863 -23.241 722 HB2 LEU 95 1HB LEU 95 -7.810 -16.769 -23.479 723 HB3 LEU 95 2HB LEU 95 -8.272 -15.683 -22.179 724 HG LEU 95 HG LEU 95 -7.361 -13.768 -23.508 725 HD11 LEU 95 1HD1 LEU 95 -5.911 -14.621 -25.133 726 HD12 LEU 95 2HD1 LEU 95 -7.373 -14.399 -26.085 727 HD13 LEU 95 3HD1 LEU 95 -6.947 -16.002 -25.490 728 HD21 LEU 95 3HD2 LEU 95 -9.752 -14.222 -23.405 729 HD22 LEU 95 1HD2 LEU 95 -9.609 -15.445 -24.670 730 HD23 LEU 95 2HD2 LEU 95 -9.337 -13.744 -25.053 731 H TYR 96 H TYR 96 -7.176 -15.459 -20.201 732 HA TYR 96 HA TYR 96 -6.951 -12.731 -19.848 733 HB2 TYR 96 1HB TYR 96 -7.999 -14.652 -18.330 734 HB3 TYR 96 2HB TYR 96 -6.486 -14.475 -17.447 735 HD1 TYR 96 HD1 TYR 96 -9.075 -12.279 -19.047 736 HD2 TYR 96 HD2 TYR 96 -6.510 -12.947 -15.665 737 HE1 TYR 96 HE1 TYR 96 -9.993 -10.260 -17.955 738 HE2 TYR 96 HE2 TYR 96 -7.432 -10.922 -14.566 739 HH TYR 96 HH TYR 96 -10.168 -9.545 -15.256 740 H ILE 97 H ILE 97 -5.396 -11.297 -19.123 741 HA ILE 97 HA ILE 97 -2.780 -12.277 -18.275 742 HB ILE 97 HB ILE 97 -1.791 -10.596 -19.961 743 HG12 ILE 97 1HG1 ILE 97 -4.279 -11.221 -21.545 744 HG13 ILE 97 2HG1 ILE 97 -4.222 -9.799 -20.506 745 HG21 ILE 97 1HG2 ILE 97 -1.758 -12.324 -21.758 746 HG22 ILE 97 2HG2 ILE 97 -3.025 -13.196 -20.893 747 HG23 ILE 97 3HG2 ILE 97 -1.434 -12.996 -20.159 748 HD11 ILE 97 3HD1 ILE 97 -2.176 -10.415 -22.652 749 HD12 ILE 97 1HD1 ILE 97 -2.283 -8.947 -21.682 750 HD13 ILE 97 2HD1 ILE 97 -3.540 -9.316 -22.863 751 H LEU 98 H LEU 98 -4.681 -11.024 -16.715 752 HA LEU 98 HA LEU 98 -5.043 -9.202 -15.324 753 HB2 LEU 98 1HB LEU 98 -2.095 -9.029 -15.958 754 HB3 LEU 98 2HB LEU 98 -2.872 -7.852 -14.903 755 HG LEU 98 HG LEU 98 -3.610 -9.616 -13.403 756 HD11 LEU 98 1HD1 LEU 98 -2.670 -11.973 -13.875 757 HD12 LEU 98 2HD1 LEU 98 -2.436 -11.411 -15.531 758 HD13 LEU 98 3HD1 LEU 98 -4.056 -11.455 -14.835 759 HD21 LEU 98 3HD2 LEU 98 -1.512 -10.115 -12.438 760 HD22 LEU 98 1HD2 LEU 98 -1.177 -8.669 -13.388 761 HD23 LEU 98 2HD2 LEU 98 -0.716 -10.252 -14.007 762 H GLY 99 H GLY 99 -6.400 -8.424 -17.249 763 HA2 GLY 99 1HA GLY 99 -5.251 -6.120 -18.678 764 HA3 GLY 99 2HA GLY 99 -6.778 -6.913 -19.039 765 H SER 100 H SER 100 -7.798 -6.929 -16.353 766 HA SER 100 HA SER 100 -8.135 -4.043 -15.774 767 HB2 SER 100 1HB SER 100 -10.486 -4.291 -15.597 768 HB3 SER 100 2HB SER 100 -10.057 -5.112 -17.093 769 HG SER 100 HG SER 100 -11.007 -6.116 -14.704 770 H ASP 101 H ASP 101 -6.504 -6.176 -14.638 771 HA ASP 101 HA ASP 101 -6.879 -5.655 -11.873 772 HB2 ASP 101 1HB ASP 101 -7.795 -8.330 -12.925 773 HB3 ASP 101 2HB ASP 101 -7.155 -8.179 -11.292 774 H VAL 102 H VAL 102 -5.112 -6.508 -10.605 775 HA VAL 102 HA VAL 102 -2.951 -7.784 -12.177 776 HB VAL 102 HB VAL 102 -2.698 -5.210 -11.732 777 HG11 VAL 102 1HG1 VAL 102 -1.610 -6.216 -9.106 778 HG12 VAL 102 2HG1 VAL 102 -3.245 -5.581 -9.237 779 HG13 VAL 102 3HG1 VAL 102 -1.867 -4.556 -9.625 780 HG21 VAL 102 3HG2 VAL 102 -0.587 -7.295 -11.144 781 HG22 VAL 102 1HG2 VAL 102 -0.218 -5.577 -11.300 782 HG23 VAL 102 2HG2 VAL 102 -0.886 -6.462 -12.669 783 H THR 103 H THR 103 -1.522 -9.054 -10.955 784 HA THR 103 HA THR 103 -2.543 -9.794 -8.253 785 HB THR 103 HB THR 103 -1.146 -11.700 -10.142 786 HG1 THR 103 HG1 THR 103 -3.213 -10.795 -10.909 787 HG21 THR 103 3HG2 THR 103 -2.787 -11.979 -7.609 788 HG22 THR 103 1HG2 THR 103 -1.105 -12.447 -7.865 789 HG23 THR 103 2HG2 THR 103 -2.403 -13.340 -8.659 790 H VAL 104 H VAL 104 -1.214 -9.073 -6.801 791 HA VAL 104 HA VAL 104 1.697 -9.494 -7.139 792 HB VAL 104 HB VAL 104 0.910 -7.057 -7.485 793 HG11 VAL 104 1HG1 VAL 104 0.242 -5.793 -5.588 794 HG12 VAL 104 2HG1 VAL 104 0.654 -7.097 -4.473 795 HG13 VAL 104 3HG1 VAL 104 -0.745 -7.253 -5.536 796 HG21 VAL 104 3HG2 VAL 104 2.879 -7.773 -5.287 797 HG22 VAL 104 1HG2 VAL 104 2.775 -6.185 -6.047 798 HG23 VAL 104 2HG2 VAL 104 3.238 -7.592 -7.004 799 H GLN 105 H GLN 105 2.677 -10.348 -5.381 800 HA GLN 105 HA GLN 105 1.074 -10.669 -2.894 801 HB2 GLN 105 1HB GLN 105 1.480 -12.751 -4.405 802 HB3 GLN 105 2HB GLN 105 3.142 -12.665 -3.822 803 HG2 GLN 105 1HG GLN 105 0.733 -12.748 -1.991 804 HG3 GLN 105 2HG GLN 105 1.637 -14.179 -2.472 805 HE21 GLN 105 2HE2 GLN 105 1.450 -11.742 -0.135 806 HE22 GLN 105 1HE2 GLN 105 3.000 -11.923 0.535 807 H LEU 106 H LEU 106 2.003 -9.496 -1.238 808 HA LEU 106 HA LEU 106 4.703 -8.593 -1.448 809 HB2 LEU 106 1HB LEU 106 2.529 -8.436 0.631 810 HB3 LEU 106 2HB LEU 106 4.135 -7.792 0.947 811 HG LEU 106 HG LEU 106 2.445 -6.127 0.085 812 HD11 LEU 106 1HD1 LEU 106 5.064 -6.065 -0.228 813 HD12 LEU 106 2HD1 LEU 106 4.055 -4.918 -1.098 814 HD13 LEU 106 3HD1 LEU 106 4.679 -6.339 -1.927 815 HD21 LEU 106 3HD2 LEU 106 1.442 -7.792 -1.551 816 HD22 LEU 106 1HD2 LEU 106 2.854 -7.511 -2.574 817 HD23 LEU 106 2HD2 LEU 106 1.754 -6.185 -2.202 818 H ASN 107 H ASN 107 6.430 -9.637 -0.831 819 HA ASN 107 HA ASN 107 6.172 -11.797 1.229 820 HB2 ASN 107 1HB ASN 107 8.373 -11.611 -0.809 821 HB3 ASN 107 2HB ASN 107 7.896 -12.992 0.176 822 HD21 ASN 107 2HD2 ASN 107 6.545 -10.800 -2.329 823 HD22 ASN 107 1HD2 ASN 107 5.573 -11.988 -3.050 824 H THR 108 H THR 108 6.434 -9.636 2.608 825 HA THR 108 HA THR 108 9.189 -8.781 2.856 826 HB THR 108 HB THR 108 8.447 -7.226 4.425 827 HG1 THR 108 HG1 THR 108 7.226 -7.912 5.957 828 HG21 THR 108 3HG2 THR 108 7.395 -7.013 2.136 829 HG22 THR 108 1HG2 THR 108 6.511 -6.209 3.434 830 HG23 THR 108 2HG2 THR 108 5.947 -7.758 2.807 831 H ALA 109 H ALA 109 9.897 -8.649 5.286 832 HA ALA 109 HA ALA 109 10.901 -11.103 6.000 833 HB1 ALA 109 3HB ALA 109 11.551 -8.823 6.913 834 HB2 ALA 109 1HB ALA 109 11.548 -10.149 8.076 835 HB3 ALA 109 2HB ALA 109 10.212 -8.998 8.045 836 H GLU 110 H GLU 110 7.842 -9.654 7.086 837 HA GLU 110 HA GLU 110 7.029 -12.320 8.087 838 HB2 GLU 110 1HB GLU 110 5.923 -11.248 9.998 839 HB3 GLU 110 2HB GLU 110 7.658 -10.931 10.022 840 HG2 GLU 110 1HG GLU 110 7.235 -8.733 8.919 841 HG3 GLU 110 2HG GLU 110 5.503 -9.043 9.024 842 H LEU 111 H LEU 111 6.119 -9.153 6.812 843 HA LEU 111 HA LEU 111 3.343 -9.693 6.669 844 HB2 LEU 111 1HB LEU 111 4.739 -7.432 6.445 845 HB3 LEU 111 2HB LEU 111 4.672 -7.824 4.738 846 HG LEU 111 HG LEU 111 2.805 -6.409 5.180 847 HD11 LEU 111 1HD1 LEU 111 1.023 -7.716 4.377 848 HD12 LEU 111 2HD1 LEU 111 1.579 -9.158 5.223 849 HD13 LEU 111 3HD1 LEU 111 2.466 -8.561 3.819 850 HD21 LEU 111 3HD2 LEU 111 1.380 -6.531 7.013 851 HD22 LEU 111 1HD2 LEU 111 2.874 -7.108 7.745 852 HD23 LEU 111 2HD2 LEU 111 1.634 -8.258 7.244 853 H LYS 112 H LYS 112 2.261 -10.922 5.295 854 HA LYS 112 HA LYS 112 3.243 -11.389 2.631 855 HB2 LYS 112 1HB LYS 112 4.315 -13.163 4.077 856 HB3 LYS 112 2HB LYS 112 2.686 -13.777 4.366 857 HG2 LYS 112 1HG LYS 112 2.344 -14.135 1.983 858 HG3 LYS 112 2HG LYS 112 3.897 -13.386 1.614 859 HD2 LYS 112 1HD LYS 112 5.052 -15.164 2.884 860 HD3 LYS 112 2HD LYS 112 3.497 -15.928 3.216 861 HE2 LYS 112 1HE LYS 112 4.542 -15.385 0.423 862 HE3 LYS 112 2HE LYS 112 4.727 -16.929 1.256 863 HZ1 LYS 112 3HZ LYS 112 2.258 -16.912 1.537 864 HZ2 LYS 112 1HZ LYS 112 2.788 -17.079 -0.064 865 HZ3 LYS 112 2HZ LYS 112 2.201 -15.582 0.483 866 H LEU 113 H LEU 113 1.546 -10.672 1.587 867 HA LEU 113 HA LEU 113 -1.037 -12.056 2.059 868 HB2 LEU 113 1HB LEU 113 -0.662 -9.059 2.144 869 HB3 LEU 113 2HB LEU 113 -2.230 -9.825 1.908 870 HG LEU 113 HG LEU 113 -0.410 -10.303 4.272 871 HD11 LEU 113 1HD1 LEU 113 -3.015 -8.809 4.355 872 HD12 LEU 113 2HD1 LEU 113 -1.495 -7.975 4.030 873 HD13 LEU 113 3HD1 LEU 113 -1.725 -8.833 5.554 874 HD21 LEU 113 3HD2 LEU 113 -2.926 -11.568 3.345 875 HD22 LEU 113 1HD2 LEU 113 -2.947 -11.086 5.041 876 HD23 LEU 113 2HD2 LEU 113 -1.706 -12.180 4.451 877 H VAL 114 H VAL 114 -2.685 -11.290 0.369 878 HA VAL 114 HA VAL 114 -1.337 -10.974 -2.271 879 HB VAL 114 HB VAL 114 -3.727 -12.689 -1.532 880 HG11 VAL 114 1HG1 VAL 114 -3.566 -13.295 -4.040 881 HG12 VAL 114 2HG1 VAL 114 -2.640 -11.804 -4.208 882 HG13 VAL 114 3HG1 VAL 114 -4.304 -11.747 -3.628 883 HG21 VAL 114 3HG2 VAL 114 -1.295 -13.511 -1.187 884 HG22 VAL 114 1HG2 VAL 114 -1.201 -13.543 -2.949 885 HG23 VAL 114 2HG2 VAL 114 -2.383 -14.544 -2.110 886 H PHE 115 H PHE 115 -2.007 -9.213 -3.374 887 HA PHE 115 HA PHE 115 -4.636 -8.034 -2.735 888 HB2 PHE 115 1HB PHE 115 -2.002 -6.653 -3.247 889 HB3 PHE 115 2HB PHE 115 -3.558 -5.826 -3.300 890 HD1 PHE 115 HD2 PHE 115 -5.038 -5.829 -1.255 891 HD2 PHE 115 HD1 PHE 115 -0.956 -7.164 -1.163 892 HE1 PHE 115 HE2 PHE 115 -5.021 -5.598 1.206 893 HE2 PHE 115 HE1 PHE 115 -0.936 -6.922 1.305 894 HZ PHE 115 HZ PHE 115 -2.963 -6.166 2.497 895 H GLN 116 H GLN 116 -5.868 -7.392 -4.379 896 HA GLN 116 HA GLN 116 -4.910 -7.848 -7.143 897 HB2 GLN 116 1HB GLN 116 -7.559 -8.312 -5.810 898 HB3 GLN 116 2HB GLN 116 -7.516 -7.986 -7.538 899 HG2 GLN 116 1HG GLN 116 -5.669 -10.072 -6.389 900 HG3 GLN 116 2HG GLN 116 -7.364 -10.475 -6.653 901 HE21 GLN 116 2HE2 GLN 116 -4.315 -9.937 -8.229 902 HE22 GLN 116 1HE2 GLN 116 -4.854 -10.197 -9.822 903 H LEU 117 H LEU 117 -4.156 -5.773 -7.561 904 HA LEU 117 HA LEU 117 -5.967 -3.519 -7.123 905 HB2 LEU 117 1HB LEU 117 -3.230 -3.265 -8.316 906 HB3 LEU 117 2HB LEU 117 -4.097 -2.137 -7.280 907 HG LEU 117 HG LEU 117 -2.920 -4.808 -6.444 908 HD11 LEU 117 1HD1 LEU 117 -1.284 -2.971 -6.825 909 HD12 LEU 117 2HD1 LEU 117 -1.371 -3.462 -5.133 910 HD13 LEU 117 3HD1 LEU 117 -2.166 -1.978 -5.663 911 HD21 LEU 117 3HD2 LEU 117 -4.784 -2.871 -5.104 912 HD22 LEU 117 1HD2 LEU 117 -3.554 -3.656 -4.112 913 HD23 LEU 117 2HD2 LEU 117 -4.722 -4.632 -5.001 914 HA PRO 118 HA PRO 118 -7.358 -3.423 -11.390 915 HB2 PRO 118 1HB PRO 118 -6.898 -0.464 -11.334 916 HB3 PRO 118 2HB PRO 118 -8.365 -1.370 -11.762 917 HG2 PRO 118 1HG PRO 118 -8.193 -0.120 -9.442 918 HG3 PRO 118 2HG PRO 118 -8.943 -1.724 -9.562 919 HD2 PRO 118 1HD PRO 118 -6.223 -0.993 -8.514 920 HD3 PRO 118 2HD PRO 118 -7.401 -2.176 -7.904 921 H PHE 119 H PHE 119 -6.136 -4.058 -13.087 922 HA PHE 119 HA PHE 119 -3.504 -3.931 -13.458 923 HB2 PHE 119 1HB PHE 119 -5.036 -5.253 -14.803 924 HB3 PHE 119 2HB PHE 119 -5.611 -3.793 -15.608 925 HD1 PHE 119 HD1 PHE 119 -2.393 -5.535 -14.797 926 HD2 PHE 119 HD2 PHE 119 -4.615 -3.219 -17.654 927 HE1 PHE 119 HE1 PHE 119 -0.535 -5.750 -16.417 928 HE2 PHE 119 HE2 PHE 119 -2.751 -3.433 -19.273 929 HZ PHE 119 HZ PHE 119 -0.707 -4.698 -18.656 930 H GLY 120 H GLY 120 -1.980 -2.745 -14.350 931 HA2 GLY 120 1HA GLY 120 -0.889 -0.713 -14.687 932 HA3 GLY 120 2HA GLY 120 -1.892 -0.754 -16.130 933 H SER 121 H SER 121 -2.534 1.307 -16.401 934 HA SER 121 HA SER 121 -3.493 3.355 -15.962 935 HB2 SER 121 1HB SER 121 -5.601 3.254 -14.782 936 HB3 SER 121 2HB SER 121 -5.435 1.788 -15.746 937 HG SER 121 HG SER 121 -4.290 1.421 -13.356 938 H HIS 122 H HIS 122 -4.783 3.538 -13.094 939 HA HIS 122 HA HIS 122 -2.849 5.225 -11.970 940 HB2 HIS 122 1HB HIS 122 -5.315 5.173 -11.430 941 HB3 HIS 122 2HB HIS 122 -4.999 3.749 -10.440 942 HD2 HIS 122 HD2 HIS 122 -5.298 5.002 -7.938 943 HE1 HIS 122 HE1 HIS 122 -2.329 7.950 -8.486 944 HE2 HIS 122 HE2 HIS 122 -3.921 6.910 -6.807 945 H THR 123 H THR 123 -3.289 1.754 -11.721 946 HA THR 123 HA THR 123 -1.676 1.381 -9.395 947 HB THR 123 HB THR 123 -2.233 -0.637 -11.569 948 HG1 THR 123 HG1 THR 123 -4.047 -1.140 -10.300 949 HG21 THR 123 3HG2 THR 123 -1.803 -1.026 -8.600 950 HG22 THR 123 1HG2 THR 123 -0.495 -1.133 -9.776 951 HG23 THR 123 2HG2 THR 123 -1.842 -2.258 -9.855 952 H ARG 124 H ARG 124 -0.987 1.537 -12.853 953 HA ARG 124 HA ARG 124 1.470 0.307 -12.988 954 HB2 ARG 124 1HB ARG 124 0.212 1.314 -14.897 955 HB3 ARG 124 2HB ARG 124 0.726 2.906 -14.347 956 HG2 ARG 124 1HG ARG 124 3.098 2.170 -14.559 957 HG3 ARG 124 2HG ARG 124 2.527 0.639 -15.218 958 HD2 ARG 124 1HD ARG 124 1.920 3.362 -16.392 959 HD3 ARG 124 2HD ARG 124 3.160 2.265 -16.995 960 HE ARG 124 HE ARG 124 0.281 1.986 -17.331 961 HH11 ARG 124 1HH2 ARG 124 3.406 0.505 -17.399 962 HH12 ARG 124 2HH2 ARG 124 2.925 -0.782 -18.453 963 HH21 ARG 124 1HH1 ARG 124 -0.357 0.304 -18.715 964 HH22 ARG 124 2HH1 ARG 124 0.795 -0.896 -19.198 965 H THR 125 H THR 125 0.775 3.622 -11.987 966 HA THR 125 HA THR 125 3.388 4.543 -11.679 967 HB THR 125 HB THR 125 2.266 5.998 -9.799 968 HG1 THR 125 HG1 THR 125 0.418 4.218 -10.187 969 HG21 THR 125 3HG2 THR 125 2.712 6.985 -11.904 970 HG22 THR 125 1HG2 THR 125 1.002 7.281 -11.586 971 HG23 THR 125 2HG2 THR 125 1.483 6.006 -12.708 972 H PHE 126 H PHE 126 1.364 2.578 -9.563 973 HA PHE 126 HA PHE 126 2.850 2.745 -7.209 974 HB2 PHE 126 1HB PHE 126 0.630 1.581 -7.503 975 HB3 PHE 126 2HB PHE 126 1.499 0.255 -8.269 976 HD1 PHE 126 HD2 PHE 126 1.778 2.383 -5.188 977 HD2 PHE 126 HD1 PHE 126 2.099 -1.542 -6.908 978 HE1 PHE 126 HE2 PHE 126 2.315 1.447 -2.962 979 HE2 PHE 126 HE1 PHE 126 2.633 -2.475 -4.676 980 HZ PHE 126 HZ PHE 126 2.743 -0.979 -2.702 981 H LEU 127 H LEU 127 3.136 0.248 -9.785 982 HA LEU 127 HA LEU 127 5.234 -1.176 -8.787 983 HB2 LEU 127 1HB LEU 127 5.103 -0.417 -11.710 984 HB3 LEU 127 2HB LEU 127 5.679 -1.923 -10.997 985 HG LEU 127 HG LEU 127 2.814 -0.925 -11.056 986 HD11 LEU 127 1HD1 LEU 127 2.495 -2.974 -12.433 987 HD12 LEU 127 2HD1 LEU 127 4.231 -3.276 -12.359 988 HD13 LEU 127 3HD1 LEU 127 3.621 -1.841 -13.183 989 HD21 LEU 127 3HD2 LEU 127 3.089 -2.078 -8.974 990 HD22 LEU 127 1HD2 LEU 127 4.129 -3.301 -9.704 991 HD23 LEU 127 2HD2 LEU 127 2.406 -3.268 -10.082 992 H GLN 128 H GLN 128 5.597 1.627 -11.050 993 HA GLN 128 HA GLN 128 8.364 1.676 -10.970 994 HB2 GLN 128 1HB GLN 128 6.342 3.827 -11.533 995 HB3 GLN 128 2HB GLN 128 8.067 3.946 -11.898 996 HG2 GLN 128 1HG GLN 128 7.928 1.948 -13.313 997 HG3 GLN 128 2HG GLN 128 6.217 1.768 -12.913 998 HE21 GLN 128 2HE2 GLN 128 4.715 3.286 -13.816 999 HE22 GLN 128 1HE2 GLN 128 5.154 4.295 -15.093 1000 H GLU 129 H GLU 129 5.984 3.478 -9.021 1001 HA GLU 129 HA GLU 129 7.861 5.111 -7.682 1002 HB2 GLU 129 1HB GLU 129 5.072 4.216 -6.943 1003 HB3 GLU 129 2HB GLU 129 6.008 5.337 -5.954 1004 HG2 GLU 129 1HG GLU 129 5.377 5.765 -8.887 1005 HG3 GLU 129 2HG GLU 129 4.462 6.476 -7.561 1006 H VAL 130 H VAL 130 6.538 1.921 -6.885 1007 HA VAL 130 HA VAL 130 7.680 1.745 -4.299 1008 HB VAL 130 HB VAL 130 6.813 -0.362 -6.283 1009 HG11 VAL 130 1HG1 VAL 130 8.413 -1.486 -4.922 1010 HG12 VAL 130 2HG1 VAL 130 6.852 -1.847 -4.184 1011 HG13 VAL 130 3HG1 VAL 130 7.900 -0.621 -3.472 1012 HG21 VAL 130 3HG2 VAL 130 5.157 1.248 -5.157 1013 HG22 VAL 130 1HG2 VAL 130 5.579 0.448 -3.642 1014 HG23 VAL 130 2HG2 VAL 130 4.844 -0.473 -4.951 1015 H ALA 131 H ALA 131 8.774 0.561 -7.443 1016 HA ALA 131 HA ALA 131 11.112 -0.718 -6.712 1017 HB1 ALA 131 3HB ALA 131 10.764 0.941 -9.212 1018 HB2 ALA 131 1HB ALA 131 10.129 -0.690 -9.001 1019 HB3 ALA 131 2HB ALA 131 11.870 -0.413 -8.984 1020 H ARG 132 H ARG 132 10.674 2.749 -7.339 1021 HA ARG 132 HA ARG 132 13.484 3.325 -6.930 1022 HB2 ARG 132 1HB ARG 132 11.054 5.084 -7.280 1023 HB3 ARG 132 2HB ARG 132 12.680 5.721 -7.021 1024 HG2 ARG 132 1HG ARG 132 13.487 4.527 -9.008 1025 HG3 ARG 132 2HG ARG 132 11.885 3.835 -9.259 1026 HD2 ARG 132 1HD ARG 132 10.948 6.093 -9.555 1027 HD3 ARG 132 2HD ARG 132 12.544 6.793 -9.293 1028 HE ARG 132 HE ARG 132 12.822 4.968 -11.374 1029 HH11 ARG 132 1HH2 ARG 132 11.027 7.836 -10.655 1030 HH12 ARG 132 2HH2 ARG 132 10.955 8.369 -12.301 1031 HH21 ARG 132 1HH1 ARG 132 12.733 5.660 -13.534 1032 HH22 ARG 132 2HH1 ARG 132 11.921 7.136 -13.932 1033 H ALA 133 H ALA 133 10.680 3.030 -4.986 1034 HA ALA 133 HA ALA 133 11.196 4.741 -2.864 1035 HB1 ALA 133 3HB ALA 133 10.077 1.983 -2.440 1036 HB2 ALA 133 1HB ALA 133 9.174 3.211 -3.323 1037 HB3 ALA 133 2HB ALA 133 9.632 3.493 -1.651 1038 H CYS 134 H CYS 134 12.937 1.925 -3.800 1039 HA CYS 134 HA CYS 134 15.149 2.288 -2.305 1040 HB2 CYS 134 1HB CYS 134 13.006 1.299 -0.524 1041 HB3 CYS 134 2HB CYS 134 14.507 0.392 -0.402 1042 HG CYS 134 HG CYS 134 15.405 3.156 -0.282 1043 HA PRO 135 HA PRO 135 14.735 -2.559 -3.126 1044 HB2 PRO 135 1HB PRO 135 12.684 -2.273 -5.287 1045 HB3 PRO 135 2HB PRO 135 12.924 -3.594 -4.125 1046 HG2 PRO 135 1HG PRO 135 10.946 -1.843 -3.809 1047 HG3 PRO 135 2HG PRO 135 11.857 -2.456 -2.411 1048 HD2 PRO 135 1HD PRO 135 12.037 0.223 -3.749 1049 HD3 PRO 135 2HD PRO 135 12.215 -0.198 -2.035 1050 H GLY 136 H GLY 136 14.116 -0.197 -5.723 1051 HA2 GLY 136 1HA GLY 136 15.081 -0.884 -7.997 1052 HA3 GLY 136 2HA GLY 136 15.796 0.545 -7.265 1053 H PHE 137 H PHE 137 16.134 -2.882 -7.770 1054 HA PHE 137 HA PHE 137 18.253 -3.847 -6.579 1055 HB2 PHE 137 1HB PHE 137 17.781 -3.910 -9.559 1056 HB3 PHE 137 2HB PHE 137 18.999 -4.898 -8.754 1057 HD1 PHE 137 HD1 PHE 137 15.388 -4.302 -9.184 1058 HD2 PHE 137 HD2 PHE 137 18.365 -6.713 -7.243 1059 HE1 PHE 137 HE1 PHE 137 13.647 -5.961 -8.574 1060 HE2 PHE 137 HE2 PHE 137 16.625 -8.372 -6.633 1061 HZ PHE 137 HZ PHE 137 14.266 -7.995 -7.298 1062 H ASP 138 H ASP 138 19.414 -2.002 -5.809 1063 HA ASP 138 HA ASP 138 21.791 -1.496 -7.444 1064 HB2 ASP 138 1HB ASP 138 20.009 0.722 -6.447 1065 HB3 ASP 138 2HB ASP 138 21.659 0.964 -7.018 1066 HA PRO 139 HA PRO 139 23.388 -2.432 -3.267 1067 HB2 PRO 139 1HB PRO 139 25.775 -1.036 -4.443 1068 HB3 PRO 139 2HB PRO 139 25.695 -2.559 -3.533 1069 HG2 PRO 139 1HG PRO 139 25.978 -2.526 -6.187 1070 HG3 PRO 139 2HG PRO 139 25.025 -3.773 -5.366 1071 HD2 PRO 139 1HD PRO 139 24.091 -1.490 -7.031 1072 HD3 PRO 139 2HD PRO 139 23.306 -3.053 -6.711 1073 H GLU 140 H GLU 140 23.277 0.625 -4.841 1074 HA GLU 140 HA GLU 140 24.295 2.340 -2.847 1075 HB2 GLU 140 1HB GLU 140 22.116 2.785 -4.896 1076 HB3 GLU 140 2HB GLU 140 22.785 4.067 -3.885 1077 HG2 GLU 140 1HG GLU 140 25.020 3.652 -4.778 1078 HG3 GLU 140 2HG GLU 140 24.417 2.297 -5.728 1079 H THR 141 H THR 141 20.998 1.123 -3.367 1080 HA THR 141 HA THR 141 19.613 2.447 -1.385 1081 HB THR 141 HB THR 141 18.070 0.541 -1.408 1082 HG1 THR 141 HG1 THR 141 18.774 -1.286 -2.715 1083 HG21 THR 141 3HG2 THR 141 19.261 1.539 -3.977 1084 HG22 THR 141 1HG2 THR 141 17.634 1.761 -3.332 1085 HG23 THR 141 2HG2 THR 141 18.096 0.219 -4.051 1086 H ARG 142 H ARG 142 19.631 -0.862 -0.583 1087 HA ARG 142 HA ARG 142 19.780 -1.836 1.509 1088 HB2 ARG 142 1HB ARG 142 22.042 -2.071 0.332 1089 HB3 ARG 142 2HB ARG 142 22.606 -0.790 1.406 1090 HG2 ARG 142 1HG ARG 142 21.878 -2.138 3.365 1091 HG3 ARG 142 2HG ARG 142 21.388 -3.427 2.269 1092 HD2 ARG 142 1HD ARG 142 23.744 -3.467 1.388 1093 HD3 ARG 142 2HD ARG 142 24.178 -2.341 2.670 1094 HE ARG 142 HE ARG 142 22.844 -4.685 3.670 1095 HH11 ARG 142 1HH2 ARG 142 25.846 -3.352 2.583 1096 HH12 ARG 142 2HH2 ARG 142 26.823 -4.442 3.507 1097 HH21 ARG 142 1HH1 ARG 142 24.116 -6.120 4.882 1098 HH22 ARG 142 2HH1 ARG 142 25.844 -6.012 4.810 1099 H ASP 143 H ASP 143 18.531 0.426 1.961 1100 HA ASP 143 HA ASP 143 19.429 1.177 4.612 1101 HB2 ASP 143 1HB ASP 143 19.433 3.600 4.159 1102 HB3 ASP 143 2HB ASP 143 20.709 2.754 3.288 1103 HA PRO 144 HA PRO 144 14.851 1.236 4.049 1104 HB2 PRO 144 1HB PRO 144 14.186 -0.184 6.282 1105 HB3 PRO 144 2HB PRO 144 14.684 -0.958 4.765 1106 HG2 PRO 144 1HG PRO 144 16.252 -0.501 7.255 1107 HG3 PRO 144 2HG PRO 144 16.260 -1.896 6.158 1108 HD2 PRO 144 1HD PRO 144 18.175 0.119 6.152 1109 HD3 PRO 144 2HD PRO 144 17.831 -0.930 4.759 1110 H GLU 145 H GLU 145 16.313 1.397 7.292 1111 HA GLU 145 HA GLU 145 16.029 2.885 9.042 1112 HB2 GLU 145 1HB GLU 145 15.660 4.746 6.688 1113 HB3 GLU 145 2HB GLU 145 15.836 5.289 8.354 1114 HG2 GLU 145 1HG GLU 145 18.045 4.234 8.490 1115 HG3 GLU 145 2HG GLU 145 17.862 3.606 6.852 1116 H PHE 146 H PHE 146 14.210 2.355 10.162 1117 HA PHE 146 HA PHE 146 11.601 3.386 9.181 1118 HB2 PHE 146 1HB PHE 146 10.770 1.561 10.896 1119 HB3 PHE 146 2HB PHE 146 11.304 1.079 9.288 1120 HD1 PHE 146 HD2 PHE 146 12.202 1.178 12.860 1121 HD2 PHE 146 HD1 PHE 146 13.416 -0.065 8.934 1122 HE1 PHE 146 HE2 PHE 146 13.973 -0.242 13.858 1123 HE2 PHE 146 HE1 PHE 146 15.186 -1.485 9.930 1124 HZ PHE 146 HZ PHE 146 15.465 -1.575 12.392 1125 H GLU 147 H GLU 147 13.967 4.228 11.178 1126 HA GLU 147 HA GLU 147 12.789 4.573 13.708 1127 HB2 GLU 147 1HB GLU 147 14.596 6.156 14.132 1128 HB3 GLU 147 2HB GLU 147 15.206 4.734 13.287 1129 HG2 GLU 147 1HG GLU 147 15.039 5.974 11.134 1130 HG3 GLU 147 2HG GLU 147 14.527 7.407 12.023 1131 H TRP 148 H TRP 148 12.678 6.637 10.833 1132 HA TRP 148 HA TRP 148 11.563 8.882 12.203 1133 HB2 TRP 148 1HB TRP 148 11.138 9.785 9.962 1134 HB3 TRP 148 2HB TRP 148 12.775 9.146 10.096 1135 HD1 TRP 148 HD1 TRP 148 13.209 6.688 9.009 1136 HE1 TRP 148 HE1 TRP 148 12.101 5.568 6.968 1137 HE3 TRP 148 HE3 TRP 148 9.022 9.579 8.584 1138 HZ2 TRP 148 HZ2 TRP 148 9.748 5.862 5.365 1139 HZ3 TRP 148 HZ3 TRP 148 7.366 9.142 6.793 1140 HH2 TRP 148 HH2 TRP 148 7.722 7.287 5.180 1141 H LEU 149 H LEU 149 10.212 5.989 10.796 1142 HA LEU 149 HA LEU 149 7.543 6.912 10.486 1143 HB2 LEU 149 1HB LEU 149 8.633 4.137 10.965 1144 HB3 LEU 149 2HB LEU 149 6.950 4.475 10.583 1145 HG LEU 149 HG LEU 149 9.237 5.378 8.807 1146 HD11 LEU 149 1HD1 LEU 149 7.490 3.008 8.166 1147 HD12 LEU 149 2HD1 LEU 149 8.924 2.785 9.167 1148 HD13 LEU 149 3HD1 LEU 149 9.081 3.423 7.534 1149 HD21 LEU 149 3HD2 LEU 149 7.285 5.309 7.107 1150 HD22 LEU 149 1HD2 LEU 149 7.265 6.613 8.283 1151 HD23 LEU 149 2HD2 LEU 149 6.225 5.215 8.511 1152 H SER 150 H SER 150 9.337 5.572 13.207 1153 HA SER 150 HA SER 150 7.376 4.915 14.992 1154 HB2 SER 150 1HB SER 150 8.930 5.582 16.769 1155 HB3 SER 150 2HB SER 150 9.800 4.775 15.466 1156 HG SER 150 HG SER 150 9.712 7.497 16.167 1157 H ARG 151 H ARG 151 8.008 7.972 13.609 1158 HA ARG 151 HA ARG 151 6.939 9.716 15.563 1159 HB2 ARG 151 1HB ARG 151 7.033 9.861 12.544 1160 HB3 ARG 151 2HB ARG 151 6.449 11.183 13.556 1161 HG2 ARG 151 1HG ARG 151 8.605 11.284 14.713 1162 HG3 ARG 151 2HG ARG 151 9.197 9.919 13.766 1163 HD2 ARG 151 1HD ARG 151 8.910 11.229 11.694 1164 HD3 ARG 151 2HD ARG 151 8.318 12.593 12.639 1165 HE ARG 151 HE ARG 151 10.905 11.694 13.513 1166 HH11 ARG 151 1HH2 ARG 151 9.177 13.580 11.176 1167 HH12 ARG 151 2HH2 ARG 151 10.509 14.641 10.851 1168 HH21 ARG 151 1HH1 ARG 151 12.646 13.078 13.090 1169 HH22 ARG 151 2HH1 ARG 151 12.471 14.356 11.934 1170 H HIS 152 H HIS 152 5.518 7.720 13.083 1171 HA HIS 152 HA HIS 152 2.832 8.666 13.508 1172 HB2 HIS 152 1HB HIS 152 3.981 6.371 11.900 1173 HB3 HIS 152 2HB HIS 152 2.266 6.776 11.952 1174 HD2 HIS 152 HD2 HIS 152 5.599 8.211 10.434 1175 HE1 HIS 152 HE1 HIS 152 2.393 10.561 9.013 1176 HE2 HIS 152 HE2 HIS 152 4.882 10.113 8.795 1177 H THR 153 H THR 153 1.215 7.506 14.478 1178 HA THR 153 HA THR 153 1.996 5.167 16.125 1179 HB THR 153 HB THR 153 0.537 7.669 16.929 1180 HG1 THR 153 HG1 THR 153 2.756 7.452 17.352 1181 HG21 THR 153 3HG2 THR 153 -0.000 6.340 19.081 1182 HG22 THR 153 1HG2 THR 153 0.289 4.893 18.116 1183 HG23 THR 153 2HG2 THR 153 -1.010 6.003 17.674 1184 H CYS 154 H CYS 154 0.142 6.409 13.711 1185 HA CYS 154 HA CYS 154 -1.719 5.694 12.585 1186 HB2 CYS 154 1HB CYS 154 -1.284 3.133 14.133 1187 HB3 CYS 154 2HB CYS 154 -2.161 3.314 12.616 1188 HG CYS 154 HG CYS 154 0.029 3.660 11.363 1189 H ALA 155 H ALA 155 -3.991 5.117 12.820 1190 HA ALA 155 HA ALA 155 -5.023 5.995 15.430 1191 HB1 ALA 155 3HB ALA 155 -7.132 6.324 14.263 1192 HB2 ALA 155 1HB ALA 155 -6.487 5.548 12.817 1193 HB3 ALA 155 2HB ALA 155 -5.833 7.095 13.353 1194 H GLU 156 H GLU 156 -3.932 3.456 15.526 1195 HA GLU 156 HA GLU 156 -5.390 1.230 14.992 1196 HB2 GLU 156 1HB GLU 156 -4.092 1.839 17.654 1197 HB3 GLU 156 2HB GLU 156 -4.484 0.238 17.027 1198 HG2 GLU 156 1HG GLU 156 -3.032 0.881 14.989 1199 HG3 GLU 156 2HG GLU 156 -2.433 2.199 15.996 1200 HA PRO 157 HA PRO 157 -9.351 2.597 16.880 1201 HB2 PRO 157 1HB PRO 157 -10.060 -0.197 16.053 1202 HB3 PRO 157 2HB PRO 157 -10.975 1.310 15.830 1203 HG2 PRO 157 1HG PRO 157 -9.683 0.233 13.800 1204 HG3 PRO 157 2HG PRO 157 -9.665 1.988 14.051 1205 HD2 PRO 157 1HD PRO 157 -7.497 -0.013 14.619 1206 HD3 PRO 157 2HD PRO 157 -7.371 1.642 13.975 1207 H ASP 158 H ASP 158 -10.644 1.874 18.659 1208 HA ASP 158 HA ASP 158 -10.869 1.123 20.824 1209 HB2 ASP 158 1HB ASP 158 -9.662 -1.301 19.488 1210 HB3 ASP 158 2HB ASP 158 -10.182 -1.305 21.172 1211 H ALA 159 H ALA 159 -9.327 2.760 21.483 1212 HA ALA 159 HA ALA 159 -6.579 2.511 21.653 1213 HB1 ALA 159 3HB ALA 159 -6.739 4.048 23.610 1214 HB2 ALA 159 1HB ALA 159 -8.485 3.804 23.614 1215 HB3 ALA 159 2HB ALA 159 -7.706 4.578 22.233 1216 H GLU 160 H GLU 160 -8.938 1.606 24.190 1217 HA GLU 160 HA GLU 160 -6.925 0.328 25.794 1218 HB2 GLU 160 1HB GLU 160 -9.946 0.338 25.928 1219 HB3 GLU 160 2HB GLU 160 -8.919 -0.477 27.108 1220 HG2 GLU 160 1HG GLU 160 -7.820 1.637 27.658 1221 HG3 GLU 160 2HG GLU 160 -8.765 2.473 26.427 1222 H SER 161 H SER 161 -6.271 -0.942 23.724 1223 HA SER 161 HA SER 161 -7.914 -3.229 23.078 1224 HB2 SER 161 1HB SER 161 -6.459 -2.209 21.383 1225 HB3 SER 161 2HB SER 161 -5.043 -2.591 22.357 1226 HG SER 161 HG SER 161 -5.983 -4.102 20.565 Start of MODEL 13 1 H1 GLY 1 1H GLY 1 -19.601 4.467 -9.549 2 H2 GLY 1 2H GLY 1 -18.509 5.043 -10.716 3 H3 GLY 1 3H GLY 1 -19.589 3.792 -11.106 4 HA2 GLY 1 1HA GLY 1 -21.378 5.169 -11.306 5 HA3 GLY 1 2HA GLY 1 -20.691 6.350 -10.191 6 HA PRO 2 HA PRO 2 -20.249 7.804 -14.660 7 HB2 PRO 2 1HB PRO 2 -20.825 10.355 -13.191 8 HB3 PRO 2 2HB PRO 2 -21.452 9.787 -14.753 9 HG2 PRO 2 1HG PRO 2 -22.974 9.731 -12.574 10 HG3 PRO 2 2HG PRO 2 -23.040 8.421 -13.768 11 HD2 PRO 2 1HD PRO 2 -21.725 8.442 -11.070 12 HD3 PRO 2 2HD PRO 2 -22.563 7.113 -11.905 13 H LEU 3 H LEU 3 -19.062 9.130 -11.586 14 HA LEU 3 HA LEU 3 -16.833 10.513 -12.722 15 HB2 LEU 3 1HB LEU 3 -17.243 9.531 -9.884 16 HB3 LEU 3 2HB LEU 3 -16.060 10.730 -10.405 17 HG LEU 3 HG LEU 3 -19.068 11.015 -10.693 18 HD11 LEU 3 1HD1 LEU 3 -19.016 12.488 -8.833 19 HD12 LEU 3 2HD1 LEU 3 -17.256 12.596 -8.862 20 HD13 LEU 3 3HD1 LEU 3 -18.038 11.109 -8.329 21 HD21 LEU 3 3HD2 LEU 3 -16.707 12.719 -11.485 22 HD22 LEU 3 1HD2 LEU 3 -18.234 13.492 -11.058 23 HD23 LEU 3 2HD2 LEU 3 -18.172 12.356 -12.399 24 H GLY 4 H GLY 4 -14.731 9.889 -12.971 25 HA2 GLY 4 1HA GLY 4 -14.195 7.145 -13.436 26 HA3 GLY 4 2HA GLY 4 -13.003 8.440 -13.425 27 H SER 5 H SER 5 -14.527 8.704 -10.549 28 HA SER 5 HA SER 5 -13.835 8.295 -8.392 29 HB2 SER 5 1HB SER 5 -14.938 6.212 -8.639 30 HB3 SER 5 2HB SER 5 -13.674 5.578 -9.688 31 HG SER 5 HG SER 5 -12.741 6.421 -7.266 32 H MET 6 H MET 6 -11.763 5.730 -8.688 33 HA MET 6 HA MET 6 -9.515 5.566 -8.190 34 HB2 MET 6 1HB MET 6 -9.550 7.464 -10.545 35 HB3 MET 6 2HB MET 6 -8.066 6.775 -9.886 36 HG2 MET 6 1HG MET 6 -8.942 4.501 -10.281 37 HG3 MET 6 2HG MET 6 -10.429 5.185 -10.937 38 HE1 MET 6 3HE MET 6 -9.393 3.230 -12.423 39 HE2 MET 6 1HE MET 6 -8.623 3.638 -13.963 40 HE3 MET 6 2HE MET 6 -10.248 4.219 -13.605 41 H ASP 7 H ASP 7 -11.137 7.826 -6.924 42 HA ASP 7 HA ASP 7 -9.101 9.863 -6.421 43 HB2 ASP 7 1HB ASP 7 -10.854 10.912 -5.030 44 HB3 ASP 7 2HB ASP 7 -11.388 10.630 -6.685 45 H GLN 8 H GLN 8 -8.079 7.576 -5.594 46 HA GLN 8 HA GLN 8 -8.638 7.149 -2.756 47 HB2 GLN 8 1HB GLN 8 -6.533 5.899 -4.520 48 HB3 GLN 8 2HB GLN 8 -7.030 5.328 -2.928 49 HG2 GLN 8 1HG GLN 8 -8.701 5.397 -5.458 50 HG3 GLN 8 2HG GLN 8 -8.107 3.962 -4.619 51 HE21 GLN 8 2HE2 GLN 8 -8.680 5.007 -1.918 52 HE22 GLN 8 1HE2 GLN 8 -10.364 5.005 -1.752 53 H SER 9 H SER 9 -6.048 8.361 -4.831 54 HA SER 9 HA SER 9 -4.047 8.740 -2.946 55 HB2 SER 9 1HB SER 9 -3.467 9.171 -5.194 56 HB3 SER 9 2HB SER 9 -4.772 10.335 -5.398 57 HG SER 9 HG SER 9 -2.258 10.716 -4.512 58 H VAL 10 H VAL 10 -6.694 10.975 -3.768 59 HA VAL 10 HA VAL 10 -5.910 13.007 -1.951 60 HB VAL 10 HB VAL 10 -8.117 13.925 -2.314 61 HG11 VAL 10 1HG1 VAL 10 -6.407 13.939 -4.181 62 HG12 VAL 10 2HG1 VAL 10 -8.079 14.101 -4.716 63 HG13 VAL 10 3HG1 VAL 10 -7.250 12.552 -4.870 64 HG21 VAL 10 3HG2 VAL 10 -8.735 11.123 -3.264 65 HG22 VAL 10 1HG2 VAL 10 -9.726 12.499 -3.748 66 HG23 VAL 10 2HG2 VAL 10 -9.581 12.075 -2.045 67 H ALA 11 H ALA 11 -8.247 10.362 -1.715 68 HA ALA 11 HA ALA 11 -9.383 10.774 0.715 69 HB1 ALA 11 3HB ALA 11 -9.912 8.843 -0.729 70 HB2 ALA 11 1HB ALA 11 -9.630 8.349 0.940 71 HB3 ALA 11 2HB ALA 11 -8.379 8.096 -0.278 72 H ILE 12 H ILE 12 -6.208 9.244 0.171 73 HA ILE 12 HA ILE 12 -5.682 8.773 2.905 74 HB ILE 12 HB ILE 12 -3.688 9.213 0.680 75 HG12 ILE 12 1HG1 ILE 12 -5.310 7.517 0.021 76 HG13 ILE 12 2HG1 ILE 12 -3.792 6.732 0.429 77 HG21 ILE 12 1HG2 ILE 12 -2.433 7.479 2.182 78 HG22 ILE 12 2HG2 ILE 12 -3.535 8.026 3.444 79 HG23 ILE 12 3HG2 ILE 12 -2.447 9.173 2.667 80 HD11 ILE 12 3HD1 ILE 12 -4.863 6.488 2.814 81 HD12 ILE 12 1HD1 ILE 12 -5.364 5.392 1.525 82 HD13 ILE 12 2HD1 ILE 12 -6.380 6.764 1.960 83 H GLN 13 H GLN 13 -4.673 11.343 0.733 84 HA GLN 13 HA GLN 13 -3.063 12.824 2.364 85 HB2 GLN 13 1HB GLN 13 -3.891 13.282 -0.094 86 HB3 GLN 13 2HB GLN 13 -5.086 14.307 0.700 87 HG2 GLN 13 1HG GLN 13 -3.282 15.770 0.299 88 HG3 GLN 13 2HG GLN 13 -3.076 15.310 1.986 89 HE21 GLN 13 2HE2 GLN 13 -0.910 14.812 2.445 90 HE22 GLN 13 1HE2 GLN 13 0.160 14.075 1.355 91 H GLU 14 H GLU 14 -6.647 13.033 2.227 92 HA GLU 14 HA GLU 14 -6.883 15.042 4.191 93 HB2 GLU 14 1HB GLU 14 -8.774 12.859 3.284 94 HB3 GLU 14 2HB GLU 14 -9.238 14.185 4.352 95 HG2 GLU 14 1HG GLU 14 -8.669 15.823 2.641 96 HG3 GLU 14 2HG GLU 14 -8.052 14.552 1.586 97 H THR 15 H THR 15 -7.006 11.515 4.374 98 HA THR 15 HA THR 15 -7.521 11.360 7.173 99 HB THR 15 HB THR 15 -6.963 8.994 6.961 100 HG1 THR 15 HG1 THR 15 -5.159 9.279 5.595 101 HG21 THR 15 3HG2 THR 15 -9.140 9.291 6.187 102 HG22 THR 15 1HG2 THR 15 -8.373 8.561 4.779 103 HG23 THR 15 2HG2 THR 15 -8.636 10.302 4.831 104 H LEU 16 H LEU 16 -4.563 11.576 5.285 105 HA LEU 16 HA LEU 16 -2.778 10.629 7.214 106 HB2 LEU 16 1HB LEU 16 -2.278 11.170 4.772 107 HB3 LEU 16 2HB LEU 16 -2.169 12.856 5.254 108 HG LEU 16 HG LEU 16 -0.320 12.320 6.798 109 HD11 LEU 16 1HD1 LEU 16 -0.563 10.160 7.610 110 HD12 LEU 16 2HD1 LEU 16 0.651 9.868 6.370 111 HD13 LEU 16 3HD1 LEU 16 -1.048 9.505 6.049 112 HD21 LEU 16 3HD2 LEU 16 0.376 12.905 4.589 113 HD22 LEU 16 1HD2 LEU 16 -0.071 11.323 3.953 114 HD23 LEU 16 2HD2 LEU 16 1.319 11.481 5.024 115 H VAL 17 H VAL 17 -1.581 13.662 6.711 116 HA VAL 17 HA VAL 17 -2.887 15.178 8.707 117 HB VAL 17 HB VAL 17 -1.893 13.618 10.278 118 HG11 VAL 17 1HG1 VAL 17 -0.103 12.603 9.116 119 HG12 VAL 17 2HG1 VAL 17 0.699 13.574 10.348 120 HG13 VAL 17 3HG1 VAL 17 0.620 14.151 8.685 121 HG21 VAL 17 3HG2 VAL 17 -0.146 16.086 10.282 122 HG22 VAL 17 1HG2 VAL 17 -0.768 15.192 11.669 123 HG23 VAL 17 2HG2 VAL 17 -1.863 16.155 10.675 124 H GLU 18 H GLU 18 -2.019 17.299 8.820 125 HA GLU 18 HA GLU 18 -0.682 18.138 6.476 126 HB2 GLU 18 1HB GLU 18 -0.691 20.358 7.598 127 HB3 GLU 18 2HB GLU 18 -2.270 19.568 7.609 128 HG2 GLU 18 1HG GLU 18 -1.445 18.624 9.953 129 HG3 GLU 18 2HG GLU 18 -0.349 20.000 9.887 130 H GLY 19 H GLY 19 1.387 17.810 6.061 131 HA2 GLY 19 1HA GLY 19 3.583 18.948 6.951 132 HA3 GLY 19 2HA GLY 19 3.373 17.781 8.250 133 H GLU 20 H GLU 20 2.218 15.853 6.192 134 HA GLU 20 HA GLU 20 4.834 14.868 5.217 135 HB2 GLU 20 1HB GLU 20 2.253 13.450 5.851 136 HB3 GLU 20 2HB GLU 20 3.564 12.679 4.956 137 HG2 GLU 20 1HG GLU 20 5.109 13.102 6.812 138 HG3 GLU 20 2HG GLU 20 3.836 13.940 7.701 139 H TYR 21 H TYR 21 4.256 13.199 3.285 140 HA TYR 21 HA TYR 21 2.722 14.667 1.218 141 HB2 TYR 21 1HB TYR 21 5.178 15.267 1.174 142 HB3 TYR 21 2HB TYR 21 5.507 13.575 0.807 143 HD1 TYR 21 HD2 TYR 21 3.747 16.619 -0.403 144 HD2 TYR 21 HD1 TYR 21 5.189 12.692 -1.373 145 HE1 TYR 21 HE2 TYR 21 3.291 17.044 -2.802 146 HE2 TYR 21 HE1 TYR 21 4.736 13.116 -3.772 147 HH TYR 21 HH TYR 21 4.443 14.948 -5.287 148 H CYS 22 H CYS 22 1.345 13.316 0.262 149 HA CYS 22 HA CYS 22 1.846 10.417 0.354 150 HB2 CYS 22 1HB CYS 22 -0.438 11.519 0.904 151 HB3 CYS 22 2HB CYS 22 -0.593 11.743 -0.840 152 HG CYS 22 HG CYS 22 -0.622 9.019 0.634 153 H VAL 23 H VAL 23 2.235 9.214 -1.514 154 HA VAL 23 HA VAL 23 2.873 10.809 -3.928 155 HB VAL 23 HB VAL 23 3.814 8.074 -3.041 156 HG11 VAL 23 1HG1 VAL 23 3.815 8.194 -5.457 157 HG12 VAL 23 2HG1 VAL 23 5.476 8.417 -4.907 158 HG13 VAL 23 3HG1 VAL 23 4.523 9.808 -5.425 159 HG21 VAL 23 3HG2 VAL 23 6.008 9.339 -2.829 160 HG22 VAL 23 1HG2 VAL 23 4.783 9.747 -1.627 161 HG23 VAL 23 2HG2 VAL 23 5.071 10.825 -2.993 162 H ILE 24 H ILE 24 1.415 7.724 -2.897 163 HA ILE 24 HA ILE 24 -0.565 7.857 -4.960 164 HB ILE 24 HB ILE 24 1.358 7.220 -6.325 165 HG12 ILE 24 1HG1 ILE 24 0.508 5.072 -7.246 166 HG13 ILE 24 2HG1 ILE 24 -0.544 4.898 -5.846 167 HG21 ILE 24 1HG2 ILE 24 2.570 5.141 -5.900 168 HG22 ILE 24 2HG2 ILE 24 1.584 4.838 -4.470 169 HG23 ILE 24 3HG2 ILE 24 2.688 6.213 -4.508 170 HD11 ILE 24 3HD1 ILE 24 -1.518 5.950 -8.024 171 HD12 ILE 24 1HD1 ILE 24 -0.649 7.400 -7.525 172 HD13 ILE 24 2HD1 ILE 24 -1.894 6.715 -6.481 173 H ALA 25 H ALA 25 -2.148 6.248 -4.761 174 HA ALA 25 HA ALA 25 -1.890 4.144 -2.772 175 HB1 ALA 25 3HB ALA 25 -2.463 6.178 -1.423 176 HB2 ALA 25 1HB ALA 25 -3.706 4.929 -1.366 177 HB3 ALA 25 2HB ALA 25 -3.932 6.350 -2.383 178 H VAL 26 H VAL 26 -2.760 2.485 -3.864 179 HA VAL 26 HA VAL 26 -5.253 2.954 -5.396 180 HB VAL 26 HB VAL 26 -4.508 1.381 -7.033 181 HG11 VAL 26 1HG1 VAL 26 -2.787 2.613 -8.035 182 HG12 VAL 26 2HG1 VAL 26 -1.961 2.906 -6.505 183 HG13 VAL 26 3HG1 VAL 26 -3.437 3.788 -6.892 184 HG21 VAL 26 3HG2 VAL 26 -3.424 -0.361 -5.902 185 HG22 VAL 26 1HG2 VAL 26 -2.400 0.734 -4.974 186 HG23 VAL 26 2HG2 VAL 26 -2.059 0.438 -6.681 187 H GLN 27 H GLN 27 -6.881 2.026 -4.398 188 HA GLN 27 HA GLN 27 -6.689 0.187 -2.312 189 HB2 GLN 27 1HB GLN 27 -8.666 1.582 -2.729 190 HB3 GLN 27 2HB GLN 27 -8.996 0.686 -4.207 191 HG2 GLN 27 1HG GLN 27 -9.450 -1.324 -3.008 192 HG3 GLN 27 2HG GLN 27 -8.798 -0.660 -1.515 193 HE21 GLN 27 2HE2 GLN 27 -11.392 -1.684 -1.467 194 HE22 GLN 27 1HE2 GLN 27 -12.503 -0.416 -1.322 195 H GLY 28 H GLY 28 -7.496 -2.015 -2.267 196 HA2 GLY 28 1HA GLY 28 -7.339 -3.541 -4.768 197 HA3 GLY 28 2HA GLY 28 -6.139 -3.908 -3.533 198 H VAL 29 H VAL 29 -7.275 -6.018 -3.871 199 HA VAL 29 HA VAL 29 -9.418 -6.293 -1.840 200 HB VAL 29 HB VAL 29 -9.306 -7.597 -4.567 201 HG11 VAL 29 1HG1 VAL 29 -10.945 -8.274 -2.116 202 HG12 VAL 29 2HG1 VAL 29 -9.907 -9.352 -3.049 203 HG13 VAL 29 3HG1 VAL 29 -11.417 -8.763 -3.741 204 HG21 VAL 29 3HG2 VAL 29 -11.517 -6.587 -4.825 205 HG22 VAL 29 1HG2 VAL 29 -10.337 -5.342 -4.412 206 HG23 VAL 29 2HG2 VAL 29 -11.440 -5.956 -3.180 207 H LEU 30 H LEU 30 -9.489 -8.447 -0.929 208 HA LEU 30 HA LEU 30 -7.100 -10.109 -1.275 209 HB2 LEU 30 1HB LEU 30 -6.733 -8.426 0.641 210 HB3 LEU 30 2HB LEU 30 -8.030 -9.264 1.484 211 HG LEU 30 HG LEU 30 -5.801 -10.956 0.374 212 HD11 LEU 30 1HD1 LEU 30 -4.618 -10.545 2.640 213 HD12 LEU 30 2HD1 LEU 30 -5.522 -9.037 2.677 214 HD13 LEU 30 3HD1 LEU 30 -4.394 -9.357 1.357 215 HD21 LEU 30 3HD2 LEU 30 -7.480 -11.005 2.905 216 HD22 LEU 30 1HD2 LEU 30 -6.216 -12.173 2.526 217 HD23 LEU 30 2HD2 LEU 30 -7.650 -12.066 1.506 218 H CYS 31 H CYS 31 -7.861 -12.159 -1.534 219 HA CYS 31 HA CYS 31 -10.507 -12.778 -0.362 220 HB2 CYS 31 1HB CYS 31 -9.138 -13.712 -2.887 221 HB3 CYS 31 2HB CYS 31 -10.578 -14.484 -2.224 222 HG CYS 31 HG CYS 31 -11.880 -12.237 -2.570 223 H LYS 32 H LYS 32 -10.776 -14.614 0.689 224 HA LYS 32 HA LYS 32 -8.576 -16.556 0.893 225 HB2 LYS 32 1HB LYS 32 -8.193 -15.181 2.848 226 HB3 LYS 32 2HB LYS 32 -9.905 -15.238 3.276 227 HG2 LYS 32 1HG LYS 32 -9.816 -17.503 3.893 228 HG3 LYS 32 2HG LYS 32 -8.340 -17.802 2.975 229 HD2 LYS 32 1HD LYS 32 -7.967 -17.712 5.449 230 HD3 LYS 32 2HD LYS 32 -7.030 -16.515 4.558 231 HE2 LYS 32 1HE LYS 32 -8.432 -14.743 5.221 232 HE3 LYS 32 2HE LYS 32 -9.741 -15.830 5.689 233 HZ1 LYS 32 3HZ LYS 32 -7.270 -15.169 7.115 234 HZ2 LYS 32 1HZ LYS 32 -7.927 -16.719 7.322 235 HZ3 LYS 32 2HZ LYS 32 -8.851 -15.347 7.712 236 H GLY 33 H GLY 33 -9.297 -18.622 0.987 237 HA2 GLY 33 1HA GLY 33 -11.879 -19.251 0.174 238 HA3 GLY 33 2HA GLY 33 -10.740 -20.393 0.877 239 H ASP 34 H ASP 34 -12.301 -17.552 2.301 240 HA ASP 34 HA ASP 34 -13.917 -19.219 4.088 241 HB2 ASP 34 1HB ASP 34 -11.764 -18.773 5.270 242 HB3 ASP 34 2HB ASP 34 -12.053 -17.043 5.084 243 H SER 35 H SER 35 -12.905 -15.832 3.616 244 HA SER 35 HA SER 35 -15.591 -15.043 2.814 245 HB2 SER 35 1HB SER 35 -15.632 -14.983 5.313 246 HB3 SER 35 2HB SER 35 -14.303 -13.828 5.264 247 HG SER 35 HG SER 35 -15.640 -12.413 4.134 248 H ARG 36 H ARG 36 -15.607 -12.973 1.775 249 HA ARG 36 HA ARG 36 -13.094 -12.238 0.621 250 HB2 ARG 36 1HB ARG 36 -15.767 -10.823 0.485 251 HB3 ARG 36 2HB ARG 36 -14.388 -10.535 -0.575 252 HG2 ARG 36 1HG ARG 36 -15.599 -13.289 -0.313 253 HG3 ARG 36 2HG ARG 36 -16.268 -12.105 -1.433 254 HD2 ARG 36 1HD ARG 36 -14.010 -11.875 -2.471 255 HD3 ARG 36 2HD ARG 36 -13.416 -13.150 -1.416 256 HE ARG 36 HE ARG 36 -15.226 -13.474 -3.689 257 HH11 ARG 36 1HH2 ARG 36 -13.735 -14.810 -0.860 258 HH12 ARG 36 2HH2 ARG 36 -13.982 -16.454 -1.341 259 HH21 ARG 36 1HH1 ARG 36 -15.558 -15.629 -4.315 260 HH22 ARG 36 2HH1 ARG 36 -15.016 -16.918 -3.294 261 H GLN 37 H GLN 37 -11.866 -10.446 0.915 262 HA GLN 37 HA GLN 37 -12.549 -8.648 3.171 263 HB2 GLN 37 1HB GLN 37 -9.908 -10.018 2.609 264 HB3 GLN 37 2HB GLN 37 -10.129 -8.729 3.795 265 HG2 GLN 37 1HG GLN 37 -11.648 -10.063 5.084 266 HG3 GLN 37 2HG GLN 37 -11.754 -11.279 3.816 267 HE21 GLN 37 2HE2 GLN 37 -9.888 -12.700 3.496 268 HE22 GLN 37 1HE2 GLN 37 -8.704 -12.866 4.697 269 H SER 38 H SER 38 -12.221 -6.572 2.788 270 HA SER 38 HA SER 38 -10.760 -5.775 0.316 271 HB2 SER 38 1HB SER 38 -13.081 -5.329 -0.045 272 HB3 SER 38 2HB SER 38 -13.245 -4.562 1.533 273 HG SER 38 HG SER 38 -11.815 -3.680 -0.746 274 H ARG 39 H ARG 39 -9.122 -4.479 0.561 275 HA ARG 39 HA ARG 39 -8.823 -2.913 3.062 276 HB2 ARG 39 1HB ARG 39 -6.767 -4.627 1.663 277 HB3 ARG 39 2HB ARG 39 -6.359 -3.436 2.895 278 HG2 ARG 39 1HG ARG 39 -7.808 -4.598 4.514 279 HG3 ARG 39 2HG ARG 39 -8.251 -5.778 3.280 280 HD2 ARG 39 1HD ARG 39 -5.892 -6.482 3.097 281 HD3 ARG 39 2HD ARG 39 -5.441 -5.299 4.321 282 HE ARG 39 HE ARG 39 -7.490 -7.108 5.229 283 HH11 ARG 39 1HH2 ARG 39 -4.081 -6.660 4.754 284 HH12 ARG 39 2HH2 ARG 39 -3.629 -7.819 5.961 285 HH21 ARG 39 1HH1 ARG 39 -6.894 -8.619 6.805 286 HH22 ARG 39 2HH1 ARG 39 -5.218 -8.927 7.118 287 H LEU 40 H LEU 40 -7.528 -1.063 2.890 288 HA LEU 40 HA LEU 40 -7.335 0.045 0.139 289 HB2 LEU 40 1HB LEU 40 -8.962 1.226 1.533 290 HB3 LEU 40 2HB LEU 40 -7.758 1.461 2.790 291 HG LEU 40 HG LEU 40 -6.383 2.773 1.128 292 HD11 LEU 40 1HD1 LEU 40 -7.171 2.054 -0.988 293 HD12 LEU 40 2HD1 LEU 40 -7.817 3.683 -0.818 294 HD13 LEU 40 3HD1 LEU 40 -8.857 2.289 -0.531 295 HD21 LEU 40 3HD2 LEU 40 -7.755 4.786 1.313 296 HD22 LEU 40 1HD2 LEU 40 -7.876 3.846 2.801 297 HD23 LEU 40 2HD2 LEU 40 -9.188 3.806 1.623 298 H LEU 41 H LEU 41 -5.292 0.252 -0.635 299 HA LEU 41 HA LEU 41 -3.046 0.169 1.227 300 HB2 LEU 41 1HB LEU 41 -3.267 0.051 -1.789 301 HB3 LEU 41 2HB LEU 41 -1.736 0.034 -0.918 302 HG LEU 41 HG LEU 41 -2.616 -1.973 0.371 303 HD11 LEU 41 1HD1 LEU 41 -4.814 -1.646 -1.670 304 HD12 LEU 41 2HD1 LEU 41 -4.944 -1.989 0.054 305 HD13 LEU 41 3HD1 LEU 41 -4.401 -3.245 -1.053 306 HD21 LEU 41 3HD2 LEU 41 -2.049 -3.528 -1.437 307 HD22 LEU 41 1HD2 LEU 41 -0.995 -2.117 -1.510 308 HD23 LEU 41 2HD2 LEU 41 -2.344 -2.269 -2.636 309 H GLY 42 H GLY 42 -1.270 1.675 0.988 310 HA2 GLY 42 1HA GLY 42 -1.693 4.163 -0.427 311 HA3 GLY 42 2HA GLY 42 -1.795 4.313 1.323 312 H LEU 43 H LEU 43 0.185 5.345 -0.647 313 HA LEU 43 HA LEU 43 2.637 4.269 0.625 314 HB2 LEU 43 1HB LEU 43 2.615 3.499 -1.680 315 HB3 LEU 43 2HB LEU 43 2.255 5.122 -2.256 316 HG LEU 43 HG LEU 43 4.414 5.937 -1.507 317 HD11 LEU 43 1HD1 LEU 43 6.050 4.078 -0.639 318 HD12 LEU 43 2HD1 LEU 43 4.568 3.227 -0.197 319 HD13 LEU 43 3HD1 LEU 43 4.912 4.819 0.480 320 HD21 LEU 43 3HD2 LEU 43 5.913 4.381 -2.857 321 HD22 LEU 43 1HD2 LEU 43 4.476 4.958 -3.699 322 HD23 LEU 43 2HD2 LEU 43 4.513 3.325 -3.037 323 H VAL 44 H VAL 44 3.790 5.762 1.674 324 HA VAL 44 HA VAL 44 3.316 8.628 0.999 325 HB VAL 44 HB VAL 44 3.480 7.321 3.702 326 HG11 VAL 44 1HG1 VAL 44 3.697 10.216 2.905 327 HG12 VAL 44 2HG1 VAL 44 4.769 9.298 3.957 328 HG13 VAL 44 3HG1 VAL 44 3.151 9.735 4.510 329 HG21 VAL 44 3HG2 VAL 44 1.286 7.326 2.512 330 HG22 VAL 44 1HG2 VAL 44 1.372 9.086 2.443 331 HG23 VAL 44 2HG2 VAL 44 1.263 8.267 4.003 332 H ARG 45 H ARG 45 5.016 9.856 0.757 333 HA ARG 45 HA ARG 45 7.692 8.792 1.457 334 HB2 ARG 45 1HB ARG 45 7.422 9.067 -0.949 335 HB3 ARG 45 2HB ARG 45 6.853 10.721 -0.724 336 HG2 ARG 45 1HG ARG 45 9.000 11.414 0.145 337 HG3 ARG 45 2HG ARG 45 9.580 9.751 0.173 338 HD2 ARG 45 1HD ARG 45 10.467 10.862 -1.801 339 HD3 ARG 45 2HD ARG 45 9.285 9.656 -2.304 340 HE ARG 45 HE ARG 45 8.034 12.191 -1.950 341 HH11 ARG 45 1HH2 ARG 45 10.122 10.379 -4.029 342 HH12 ARG 45 2HH2 ARG 45 9.697 11.263 -5.456 343 HH21 ARG 45 1HH1 ARG 45 7.471 13.355 -3.815 344 HH22 ARG 45 2HH1 ARG 45 8.196 12.949 -5.334 345 H TYR 46 H TYR 46 8.810 9.891 2.903 346 HA TYR 46 HA TYR 46 8.056 12.684 3.542 347 HB2 TYR 46 1HB TYR 46 7.101 11.154 5.211 348 HB3 TYR 46 2HB TYR 46 8.692 10.444 5.484 349 HD1 TYR 46 HD1 TYR 46 6.931 13.749 5.483 350 HD2 TYR 46 HD2 TYR 46 10.075 11.343 7.147 351 HE1 TYR 46 HE1 TYR 46 7.423 15.533 7.132 352 HE2 TYR 46 HE2 TYR 46 10.569 13.127 8.792 353 HH TYR 46 HH TYR 46 9.352 15.031 9.853 354 H ARG 47 H ARG 47 9.779 14.062 3.758 355 HA ARG 47 HA ARG 47 12.456 12.921 3.295 356 HB2 ARG 47 1HB ARG 47 13.107 15.190 2.668 357 HB3 ARG 47 2HB ARG 47 11.683 14.686 1.760 358 HG2 ARG 47 1HG ARG 47 10.240 15.909 3.361 359 HG3 ARG 47 2HG ARG 47 11.677 16.439 4.238 360 HD2 ARG 47 1HD ARG 47 12.501 17.567 2.204 361 HD3 ARG 47 2HD ARG 47 11.057 17.056 1.335 362 HE ARG 47 HE ARG 47 11.224 19.158 3.355 363 HH11 ARG 47 1HH2 ARG 47 9.265 17.034 1.445 364 HH12 ARG 47 2HH2 ARG 47 7.827 17.983 1.618 365 HH21 ARG 47 1HH1 ARG 47 9.338 20.401 3.592 366 HH22 ARG 47 2HH1 ARG 47 7.867 19.886 2.834 367 H LEU 48 H LEU 48 14.239 13.444 4.552 368 HA LEU 48 HA LEU 48 13.608 14.271 7.321 369 HB2 LEU 48 1HB LEU 48 16.020 12.822 6.196 370 HB3 LEU 48 2HB LEU 48 15.788 13.244 7.889 371 HG LEU 48 HG LEU 48 13.892 11.496 6.294 372 HD11 LEU 48 1HD1 LEU 48 15.948 10.284 6.510 373 HD12 LEU 48 2HD1 LEU 48 14.885 9.675 7.777 374 HD13 LEU 48 3HD1 LEU 48 16.166 10.822 8.176 375 HD21 LEU 48 3HD2 LEU 48 14.002 12.460 9.149 376 HD22 LEU 48 1HD2 LEU 48 13.300 10.879 8.798 377 HD23 LEU 48 2HD2 LEU 48 12.617 12.323 8.067 378 H GLU 49 H GLU 49 14.666 15.911 8.312 379 HA GLU 49 HA GLU 49 15.523 18.110 6.831 380 HB2 GLU 49 1HB GLU 49 16.112 17.352 9.700 381 HB3 GLU 49 2HB GLU 49 16.441 18.941 9.007 382 HG2 GLU 49 1HG GLU 49 13.707 17.637 8.995 383 HG3 GLU 49 2HG GLU 49 14.237 18.782 10.225 384 H ASN 50 H ASN 50 17.156 15.217 7.530 385 HA ASN 50 HA ASN 50 19.840 16.318 7.386 386 HB2 ASN 50 1HB ASN 50 18.796 13.478 7.416 387 HB3 ASN 50 2HB ASN 50 20.505 13.909 7.414 388 HD21 ASN 50 2HD2 ASN 50 18.568 12.684 9.556 389 HD22 ASN 50 1HD2 ASN 50 18.905 13.610 10.940 390 H ASP 51 H ASP 51 17.473 15.801 5.163 391 HA ASP 51 HA ASP 51 17.595 16.071 2.860 392 HB2 ASP 51 1HB ASP 51 19.577 16.364 1.737 393 HB3 ASP 51 2HB ASP 51 20.185 16.631 3.363 394 H ALA 52 H ALA 52 18.383 13.467 4.811 395 HA ALA 52 HA ALA 52 18.508 11.379 2.888 396 HB1 ALA 52 3HB ALA 52 17.975 9.938 4.904 397 HB2 ALA 52 1HB ALA 52 17.880 11.429 5.841 398 HB3 ALA 52 2HB ALA 52 19.397 10.969 5.067 399 H GLN 53 H GLN 53 16.946 10.190 1.961 400 HA GLN 53 HA GLN 53 14.146 11.027 2.374 401 HB2 GLN 53 1HB GLN 53 15.443 9.427 0.152 402 HB3 GLN 53 2HB GLN 53 13.748 9.914 0.211 403 HG2 GLN 53 1HG GLN 53 16.086 11.838 0.267 404 HG3 GLN 53 2HG GLN 53 15.143 11.453 -1.174 405 HE21 GLN 53 2HE2 GLN 53 15.394 13.764 1.193 406 HE22 GLN 53 1HE2 GLN 53 13.788 14.311 1.221 407 H GLU 54 H GLU 54 12.519 9.545 2.793 408 HA GLU 54 HA GLU 54 13.208 6.726 3.180 409 HB2 GLU 54 1HB GLU 54 12.136 8.484 5.406 410 HB3 GLU 54 2HB GLU 54 12.150 6.724 5.452 411 HG2 GLU 54 1HG GLU 54 14.612 8.474 5.147 412 HG3 GLU 54 2HG GLU 54 14.104 7.690 6.636 413 H HIS 55 H HIS 55 11.442 5.340 3.110 414 HA HIS 55 HA HIS 55 8.764 6.487 2.676 415 HB2 HIS 55 1HB HIS 55 9.781 4.437 0.724 416 HB3 HIS 55 2HB HIS 55 8.464 5.592 0.541 417 HD2 HIS 55 HD2 HIS 55 9.251 7.624 -1.126 418 HE1 HIS 55 HE1 HIS 55 13.364 7.643 -0.186 419 HE2 HIS 55 HE2 HIS 55 11.564 8.733 -1.608 420 H ALA 56 H ALA 56 7.105 4.717 2.482 421 HA ALA 56 HA ALA 56 7.736 2.086 3.400 422 HB1 ALA 56 3HB ALA 56 6.211 2.436 5.498 423 HB2 ALA 56 1HB ALA 56 6.664 4.130 5.323 424 HB3 ALA 56 2HB ALA 56 7.907 2.909 5.585 425 H LEU 57 H LEU 57 5.766 0.760 3.516 426 HA LEU 57 HA LEU 57 3.683 1.813 1.715 427 HB2 LEU 57 1HB LEU 57 4.786 -0.299 1.066 428 HB3 LEU 57 2HB LEU 57 4.236 -1.043 2.560 429 HG LEU 57 HG LEU 57 1.874 -0.595 1.873 430 HD11 LEU 57 1HD1 LEU 57 1.676 -0.164 -0.702 431 HD12 LEU 57 2HD1 LEU 57 3.286 0.536 -0.539 432 HD13 LEU 57 3HD1 LEU 57 1.934 1.208 0.370 433 HD21 LEU 57 3HD2 LEU 57 1.779 -2.394 0.239 434 HD22 LEU 57 1HD2 LEU 57 3.049 -2.760 1.406 435 HD23 LEU 57 2HD2 LEU 57 3.470 -2.142 -0.191 436 H PHE 58 H PHE 58 2.179 2.852 2.852 437 HA PHE 58 HA PHE 58 1.364 2.041 5.478 438 HB2 PHE 58 1HB PHE 58 0.605 4.228 3.561 439 HB3 PHE 58 2HB PHE 58 -0.438 3.894 4.942 440 HD1 PHE 58 HD2 PHE 58 3.264 3.421 5.022 441 HD2 PHE 58 HD1 PHE 58 -0.030 5.965 6.103 442 HE1 PHE 58 HE2 PHE 58 4.743 4.705 6.507 443 HE2 PHE 58 HE1 PHE 58 1.471 7.251 7.597 444 HZ PHE 58 HZ PHE 58 3.857 6.620 7.798 445 H LEU 59 H LEU 59 -0.493 1.114 6.122 446 HA LEU 59 HA LEU 59 -2.272 0.004 4.023 447 HB2 LEU 59 1HB LEU 59 -0.825 -1.665 5.379 448 HB3 LEU 59 2HB LEU 59 -1.869 -1.247 6.735 449 HG LEU 59 HG LEU 59 -3.831 -1.753 5.051 450 HD11 LEU 59 1HD1 LEU 59 -3.166 -3.623 3.478 451 HD12 LEU 59 2HD1 LEU 59 -1.485 -3.198 3.779 452 HD13 LEU 59 3HD1 LEU 59 -2.565 -2.034 3.015 453 HD21 LEU 59 3HD2 LEU 59 -3.478 -4.307 5.596 454 HD22 LEU 59 1HD2 LEU 59 -3.720 -3.162 6.914 455 HD23 LEU 59 2HD2 LEU 59 -2.095 -3.727 6.525 456 H TYR 60 H TYR 60 -4.153 0.922 4.058 457 HA TYR 60 HA TYR 60 -5.188 2.151 6.550 458 HB2 TYR 60 1HB TYR 60 -5.698 2.690 3.614 459 HB3 TYR 60 2HB TYR 60 -6.660 3.402 4.903 460 HD1 TYR 60 HD2 TYR 60 -5.700 5.065 6.412 461 HD2 TYR 60 HD1 TYR 60 -3.373 3.381 3.225 462 HE1 TYR 60 HE2 TYR 60 -4.037 6.886 6.671 463 HE2 TYR 60 HE1 TYR 60 -1.711 5.207 3.478 464 HH TYR 60 HH TYR 60 -1.095 6.980 4.659 465 H THR 61 H THR 61 -7.099 1.309 7.405 466 HA THR 61 HA THR 61 -8.319 -0.925 5.940 467 HB THR 61 HB THR 61 -7.991 -1.131 8.402 468 HG1 THR 61 HG1 THR 61 -9.835 -2.188 8.555 469 HG21 THR 61 3HG2 THR 61 -10.177 0.947 8.615 470 HG22 THR 61 1HG2 THR 61 -8.472 1.323 8.851 471 HG23 THR 61 2HG2 THR 61 -9.283 0.192 9.932 472 H HIS 62 H HIS 62 -10.753 -0.927 5.833 473 HA HIS 62 HA HIS 62 -12.100 1.584 5.865 474 HB2 HIS 62 1HB HIS 62 -12.339 2.033 3.559 475 HB3 HIS 62 2HB HIS 62 -10.631 1.667 3.760 476 HD2 HIS 62 HD2 HIS 62 -9.815 -0.819 2.655 477 HE1 HIS 62 HE1 HIS 62 -13.468 -1.618 0.704 478 HE2 HIS 62 HE2 HIS 62 -11.044 -2.352 0.932 479 H ARG 63 H ARG 63 -14.331 1.398 5.302 480 HA ARG 63 HA ARG 63 -15.417 -1.127 6.091 481 HB2 ARG 63 1HB ARG 63 -16.798 1.361 5.052 482 HB3 ARG 63 2HB ARG 63 -17.622 -0.043 5.727 483 HG2 ARG 63 1HG ARG 63 -16.405 0.258 7.847 484 HG3 ARG 63 2HG ARG 63 -15.592 1.668 7.175 485 HD2 ARG 63 1HD ARG 63 -17.471 2.422 8.522 486 HD3 ARG 63 2HD ARG 63 -17.827 2.736 6.825 487 HE ARG 63 HE ARG 63 -18.842 0.192 7.532 488 HH11 ARG 63 1HH2 ARG 63 -19.335 3.569 8.122 489 HH12 ARG 63 2HH2 ARG 63 -21.038 3.410 8.400 490 HH21 ARG 63 1HH1 ARG 63 -21.073 -0.018 7.896 491 HH22 ARG 63 2HH1 ARG 63 -22.020 1.382 8.272 492 H ARG 64 H ARG 64 -17.674 -1.391 4.559 493 HA ARG 64 HA ARG 64 -16.651 -2.819 2.310 494 HB2 ARG 64 1HB ARG 64 -19.467 -2.156 3.194 495 HB3 ARG 64 2HB ARG 64 -19.078 -3.216 1.836 496 HG2 ARG 64 1HG ARG 64 -17.824 -4.703 3.320 497 HG3 ARG 64 2HG ARG 64 -18.132 -3.627 4.685 498 HD2 ARG 64 1HD ARG 64 -20.561 -3.988 4.420 499 HD3 ARG 64 2HD ARG 64 -20.253 -5.073 3.065 500 HE ARG 64 HE ARG 64 -19.847 -5.656 5.895 501 HH11 ARG 64 1HH2 ARG 64 -19.239 -6.489 2.591 502 HH12 ARG 64 2HH2 ARG 64 -18.865 -8.145 2.933 503 HH21 ARG 64 1HH1 ARG 64 -19.360 -7.829 6.351 504 HH22 ARG 64 2HH1 ARG 64 -18.933 -8.903 5.061 505 H MET 65 H MET 65 -17.913 0.416 2.812 506 HA MET 65 HA MET 65 -17.446 1.009 -0.025 507 HB2 MET 65 1HB MET 65 -19.663 2.348 0.064 508 HB3 MET 65 2HB MET 65 -19.770 0.600 -0.151 509 HG2 MET 65 1HG MET 65 -20.200 0.290 2.235 510 HG3 MET 65 2HG MET 65 -19.986 2.016 2.524 511 HE1 MET 65 3HE MET 65 -22.424 0.433 3.509 512 HE2 MET 65 1HE MET 65 -23.798 1.462 3.078 513 HE3 MET 65 2HE MET 65 -22.324 2.179 3.724 514 H ALA 66 H ALA 66 -16.145 1.609 2.571 515 HA ALA 66 HA ALA 66 -16.746 4.303 3.324 516 HB1 ALA 66 3HB ALA 66 -14.173 4.059 4.133 517 HB2 ALA 66 1HB ALA 66 -14.573 2.363 3.876 518 HB3 ALA 66 2HB ALA 66 -15.520 3.323 5.005 519 H ILE 67 H ILE 67 -14.142 2.949 1.344 520 HA ILE 67 HA ILE 67 -12.489 4.049 0.088 521 HB ILE 67 HB ILE 67 -15.138 4.502 -1.299 522 HG12 ILE 67 1HG1 ILE 67 -13.042 2.363 -1.748 523 HG13 ILE 67 2HG1 ILE 67 -14.434 2.135 -0.689 524 HG21 ILE 67 1HG2 ILE 67 -13.574 5.952 -2.379 525 HG22 ILE 67 2HG2 ILE 67 -13.644 4.499 -3.374 526 HG23 ILE 67 3HG2 ILE 67 -12.287 4.749 -2.277 527 HD11 ILE 67 3HD1 ILE 67 -14.466 2.695 -3.668 528 HD12 ILE 67 1HD1 ILE 67 -15.910 2.754 -2.655 529 HD13 ILE 67 2HD1 ILE 67 -15.027 1.239 -2.847 530 H THR 68 H THR 68 -15.297 6.098 0.166 531 HA THR 68 HA THR 68 -14.678 8.458 -0.659 532 HB THR 68 HB THR 68 -15.869 8.025 2.074 533 HG1 THR 68 HG1 THR 68 -16.775 7.047 0.050 534 HG21 THR 68 3HG2 THR 68 -15.794 10.403 0.211 535 HG22 THR 68 1HG2 THR 68 -15.315 10.336 1.906 536 HG23 THR 68 2HG2 THR 68 -17.019 10.228 1.468 537 H GLY 69 H GLY 69 -13.138 7.233 2.325 538 HA2 GLY 69 1HA GLY 69 -10.904 8.000 2.887 539 HA3 GLY 69 2HA GLY 69 -11.309 9.579 2.217 540 H ASP 70 H ASP 70 -14.070 8.927 3.467 541 HA ASP 70 HA ASP 70 -13.833 10.611 5.715 542 HB2 ASP 70 1HB ASP 70 -16.037 8.790 4.756 543 HB3 ASP 70 2HB ASP 70 -16.203 9.806 6.184 544 H ASP 71 H ASP 71 -14.248 7.016 5.550 545 HA ASP 71 HA ASP 71 -13.571 6.974 8.462 546 HB2 ASP 71 1HB ASP 71 -15.439 5.243 6.834 547 HB3 ASP 71 2HB ASP 71 -14.853 4.791 8.437 548 H VAL 72 H VAL 72 -11.434 6.975 6.737 549 HA VAL 72 HA VAL 72 -10.392 4.248 7.177 550 HB VAL 72 HB VAL 72 -9.509 4.049 5.006 551 HG11 VAL 72 1HG1 VAL 72 -12.151 5.446 4.564 552 HG12 VAL 72 2HG1 VAL 72 -12.014 3.805 5.191 553 HG13 VAL 72 3HG1 VAL 72 -11.432 4.180 3.569 554 HG21 VAL 72 3HG2 VAL 72 -10.071 6.998 4.785 555 HG22 VAL 72 1HG2 VAL 72 -9.783 6.012 3.353 556 HG23 VAL 72 2HG2 VAL 72 -8.529 6.165 4.583 557 H SER 73 H SER 73 -8.599 4.383 8.409 558 HA SER 73 HA SER 73 -6.650 6.514 7.923 559 HB2 SER 73 1HB SER 73 -8.131 7.413 9.672 560 HB3 SER 73 2HB SER 73 -7.912 5.945 10.622 561 HG SER 73 HG SER 73 -5.519 6.632 10.188 562 H LEU 74 H LEU 74 -4.626 5.990 9.282 563 HA LEU 74 HA LEU 74 -3.500 3.674 8.575 564 HB2 LEU 74 1HB LEU 74 -3.058 5.311 11.053 565 HB3 LEU 74 2HB LEU 74 -2.079 3.875 10.752 566 HG LEU 74 HG LEU 74 -2.434 6.107 8.737 567 HD11 LEU 74 1HD1 LEU 74 -0.246 5.663 10.785 568 HD12 LEU 74 2HD1 LEU 74 -1.353 7.032 10.705 569 HD13 LEU 74 3HD1 LEU 74 -0.137 6.804 9.447 570 HD21 LEU 74 3HD2 LEU 74 -1.432 4.608 7.364 571 HD22 LEU 74 1HD2 LEU 74 -1.178 3.456 8.672 572 HD23 LEU 74 2HD2 LEU 74 0.012 4.718 8.360 573 H ASP 75 H ASP 75 -3.702 1.629 8.846 574 HA ASP 75 HA ASP 75 -4.999 0.529 11.275 575 HB2 ASP 75 1HB ASP 75 -6.390 0.322 9.219 576 HB3 ASP 75 2HB ASP 75 -5.093 -0.608 8.472 577 H GLN 76 H GLN 76 -2.325 0.344 8.975 578 HA GLN 76 HA GLN 76 -0.900 -1.378 10.803 579 HB2 GLN 76 1HB GLN 76 -2.267 -2.607 8.647 580 HB3 GLN 76 2HB GLN 76 -0.582 -2.560 8.145 581 HG2 GLN 76 1HG GLN 76 -1.480 -3.608 10.848 582 HG3 GLN 76 2HG GLN 76 -1.244 -4.633 9.435 583 HE21 GLN 76 2HE2 GLN 76 0.966 -4.893 8.617 584 HE22 GLN 76 1HE2 GLN 76 2.305 -4.481 9.573 585 H ILE 77 H ILE 77 1.292 -2.005 9.477 586 HA ILE 77 HA ILE 77 2.287 0.232 7.902 587 HB ILE 77 HB ILE 77 3.250 -0.343 10.714 588 HG12 ILE 77 1HG1 ILE 77 2.521 2.247 9.295 589 HG13 ILE 77 2HG1 ILE 77 1.470 1.364 10.395 590 HG21 ILE 77 1HG2 ILE 77 4.807 0.625 8.358 591 HG22 ILE 77 2HG2 ILE 77 5.359 -0.172 9.826 592 HG23 ILE 77 3HG2 ILE 77 5.021 1.549 9.846 593 HD11 ILE 77 3HD1 ILE 77 2.556 3.165 11.610 594 HD12 ILE 77 1HD1 ILE 77 4.141 2.567 11.118 595 HD13 ILE 77 2HD1 ILE 77 3.133 1.609 12.203 596 H VAL 78 H VAL 78 3.623 -0.527 6.414 597 HA VAL 78 HA VAL 78 5.206 -2.970 6.923 598 HB VAL 78 HB VAL 78 3.628 -2.457 4.391 599 HG11 VAL 78 1HG1 VAL 78 5.675 -3.708 3.994 600 HG12 VAL 78 2HG1 VAL 78 4.315 -4.828 3.928 601 HG13 VAL 78 3HG1 VAL 78 5.337 -4.767 5.363 602 HG21 VAL 78 3HG2 VAL 78 2.187 -3.032 6.346 603 HG22 VAL 78 1HG2 VAL 78 3.157 -4.483 6.603 604 HG23 VAL 78 2HG2 VAL 78 2.205 -4.310 5.129 605 HA PRO 79 HA PRO 79 7.689 0.364 4.976 606 HB2 PRO 79 1HB PRO 79 9.873 0.223 6.553 607 HB3 PRO 79 2HB PRO 79 8.388 1.041 7.080 608 HG2 PRO 79 1HG PRO 79 9.435 -1.649 7.825 609 HG3 PRO 79 2HG PRO 79 8.571 -0.459 8.817 610 HD2 PRO 79 1HD PRO 79 7.396 -2.706 7.612 611 HD3 PRO 79 2HD PRO 79 6.509 -1.290 8.203 612 H LEU 80 H LEU 80 9.167 0.197 3.357 613 HA LEU 80 HA LEU 80 9.809 -2.307 2.307 614 HB2 LEU 80 1HB LEU 80 10.921 0.453 1.799 615 HB3 LEU 80 2HB LEU 80 11.355 -0.955 0.829 616 HG LEU 80 HG LEU 80 8.489 -0.086 1.294 617 HD11 LEU 80 1HD1 LEU 80 8.560 0.995 -0.878 618 HD12 LEU 80 2HD1 LEU 80 10.245 0.523 -1.101 619 HD13 LEU 80 3HD1 LEU 80 9.812 1.693 0.149 620 HD21 LEU 80 3HD2 LEU 80 8.381 -1.405 -1.017 621 HD22 LEU 80 1HD2 LEU 80 8.361 -2.277 0.510 622 HD23 LEU 80 2HD2 LEU 80 9.857 -2.158 -0.416 623 H SER 81 H SER 81 11.258 -3.685 2.784 624 HA SER 81 HA SER 81 13.818 -2.878 4.053 625 HB2 SER 81 1HB SER 81 13.700 -4.679 5.616 626 HB3 SER 81 2HB SER 81 12.153 -3.843 5.715 627 HG SER 81 HG SER 81 12.600 -6.050 4.002 628 H LYS 82 H LYS 82 15.497 -4.591 3.841 629 HA LYS 82 HA LYS 82 15.871 -5.316 1.189 630 HB2 LYS 82 1HB LYS 82 17.661 -5.197 2.907 631 HB3 LYS 82 2HB LYS 82 17.049 -6.698 3.604 632 HG2 LYS 82 1HG LYS 82 17.461 -7.878 1.495 633 HG3 LYS 82 2HG LYS 82 18.010 -6.376 0.747 634 HD2 LYS 82 1HD LYS 82 19.838 -6.221 2.401 635 HD3 LYS 82 2HD LYS 82 19.299 -7.734 3.132 636 HE2 LYS 82 1HE LYS 82 19.698 -8.916 1.008 637 HE3 LYS 82 2HE LYS 82 20.221 -7.405 0.263 638 HZ1 LYS 82 3HZ LYS 82 21.610 -9.126 2.140 639 HZ2 LYS 82 1HZ LYS 82 21.766 -7.462 2.428 640 HZ3 LYS 82 2HZ LYS 82 22.231 -8.110 0.928 641 H ASP 83 H ASP 83 14.558 -7.286 3.866 642 HA ASP 83 HA ASP 83 14.326 -9.680 2.388 643 HB2 ASP 83 1HB ASP 83 12.580 -10.201 4.199 644 HB3 ASP 83 2HB ASP 83 14.224 -9.865 4.740 645 H PHE 84 H PHE 84 12.752 -6.769 1.977 646 HA PHE 84 HA PHE 84 10.098 -7.593 1.338 647 HB2 PHE 84 1HB PHE 84 10.879 -5.215 1.797 648 HB3 PHE 84 2HB PHE 84 11.588 -5.224 0.184 649 HD1 PHE 84 HD2 PHE 84 10.144 -5.412 -1.825 650 HD2 PHE 84 HD1 PHE 84 8.495 -5.034 2.121 651 HE1 PHE 84 HE2 PHE 84 7.968 -4.738 -2.795 652 HE2 PHE 84 HE1 PHE 84 6.315 -4.362 1.150 653 HZ PHE 84 HZ PHE 84 6.051 -4.223 -1.317 654 H MET 85 H MET 85 9.242 -8.269 -0.583 655 HA MET 85 HA MET 85 10.603 -8.131 -3.074 656 HB2 MET 85 1HB MET 85 11.938 -9.954 -2.045 657 HB3 MET 85 2HB MET 85 10.456 -10.886 -1.817 658 HG2 MET 85 1HG MET 85 10.056 -10.897 -4.240 659 HG3 MET 85 2HG MET 85 11.488 -9.897 -4.494 660 HE1 MET 85 3HE MET 85 9.963 -12.884 -3.052 661 HE2 MET 85 1HE MET 85 11.282 -13.222 -1.925 662 HE3 MET 85 2HE MET 85 11.053 -14.237 -3.345 663 H LEU 86 H LEU 86 9.170 -8.476 -4.736 664 HA LEU 86 HA LEU 86 6.418 -9.220 -3.944 665 HB2 LEU 86 1HB LEU 86 7.028 -7.993 -6.615 666 HB3 LEU 86 2HB LEU 86 5.631 -7.772 -5.561 667 HG LEU 86 HG LEU 86 7.467 -6.667 -3.952 668 HD11 LEU 86 1HD1 LEU 86 9.362 -5.811 -4.955 669 HD12 LEU 86 2HD1 LEU 86 8.612 -5.681 -6.543 670 HD13 LEU 86 3HD1 LEU 86 9.171 -7.246 -5.960 671 HD21 LEU 86 3HD2 LEU 86 5.540 -5.431 -4.672 672 HD22 LEU 86 1HD2 LEU 86 6.112 -5.381 -6.340 673 HD23 LEU 86 2HD2 LEU 86 6.942 -4.446 -5.094 674 H GLU 87 H GLU 87 5.544 -11.093 -4.721 675 HA GLU 87 HA GLU 87 7.038 -12.520 -6.853 676 HB2 GLU 87 1HB GLU 87 5.552 -13.613 -4.456 677 HB3 GLU 87 2HB GLU 87 6.175 -14.601 -5.776 678 HG2 GLU 87 1HG GLU 87 8.452 -13.805 -5.326 679 HG3 GLU 87 2HG GLU 87 7.846 -12.769 -4.034 680 H GLU 88 H GLU 88 5.966 -12.853 -8.634 681 HA GLU 88 HA GLU 88 3.193 -12.167 -8.921 682 HB2 GLU 88 1HB GLU 88 5.124 -13.586 -10.780 683 HB3 GLU 88 2HB GLU 88 3.486 -13.111 -11.230 684 HG2 GLU 88 1HG GLU 88 5.612 -11.190 -10.235 685 HG3 GLU 88 2HG GLU 88 5.221 -11.448 -11.933 686 H VAL 89 H VAL 89 1.427 -13.557 -9.195 687 HA VAL 89 HA VAL 89 1.904 -16.394 -8.408 688 HB VAL 89 HB VAL 89 -0.730 -15.002 -8.063 689 HG11 VAL 89 1HG1 VAL 89 0.601 -17.223 -6.502 690 HG12 VAL 89 2HG1 VAL 89 -0.507 -17.489 -7.849 691 HG13 VAL 89 3HG1 VAL 89 -1.079 -16.698 -6.382 692 HG21 VAL 89 3HG2 VAL 89 0.798 -13.548 -6.896 693 HG22 VAL 89 1HG2 VAL 89 1.657 -14.926 -6.207 694 HG23 VAL 89 2HG2 VAL 89 0.011 -14.563 -5.688 695 H SER 90 H SER 90 1.296 -17.903 -9.767 696 HA SER 90 HA SER 90 0.681 -17.560 -12.411 697 HB2 SER 90 1HB SER 90 -0.015 -19.826 -10.555 698 HB3 SER 90 2HB SER 90 -0.306 -19.891 -12.292 699 HG SER 90 HG SER 90 2.178 -18.973 -11.724 700 HA PRO 91 HA PRO 91 -3.492 -15.715 -11.825 701 HB2 PRO 91 1HB PRO 91 -3.420 -15.985 -14.813 702 HB3 PRO 91 2HB PRO 91 -3.905 -14.596 -13.817 703 HG2 PRO 91 1HG PRO 91 -1.564 -14.623 -15.060 704 HG3 PRO 91 2HG PRO 91 -1.720 -13.945 -13.429 705 HD2 PRO 91 1HD PRO 91 -0.528 -16.565 -14.274 706 HD3 PRO 91 2HD PRO 91 -0.047 -15.472 -12.958 707 H ASP 92 H ASP 92 -2.830 -18.306 -14.189 708 HA ASP 92 HA ASP 92 -3.988 -20.216 -14.742 709 HB2 ASP 92 1HB ASP 92 -3.694 -20.652 -12.289 710 HB3 ASP 92 2HB ASP 92 -5.268 -19.908 -12.012 711 H GLY 93 H GLY 93 -5.027 -17.631 -15.474 712 HA2 GLY 93 1HA GLY 93 -7.926 -17.782 -15.201 713 HA3 GLY 93 2HA GLY 93 -7.011 -16.525 -16.025 714 H GLU 94 H GLU 94 -9.220 -18.793 -16.592 715 HA GLU 94 HA GLU 94 -8.282 -20.263 -18.795 716 HB2 GLU 94 1HB GLU 94 -10.616 -20.727 -19.267 717 HB3 GLU 94 2HB GLU 94 -10.358 -20.776 -17.524 718 HG2 GLU 94 1HG GLU 94 -11.157 -18.404 -17.394 719 HG3 GLU 94 2HG GLU 94 -11.546 -18.482 -19.112 720 H LEU 95 H LEU 95 -9.780 -17.054 -18.592 721 HA LEU 95 HA LEU 95 -8.783 -16.459 -21.278 722 HB2 LEU 95 1HB LEU 95 -11.149 -17.318 -21.527 723 HB3 LEU 95 2HB LEU 95 -11.674 -15.956 -20.539 724 HG LEU 95 HG LEU 95 -10.319 -14.512 -22.286 725 HD11 LEU 95 1HD1 LEU 95 -9.280 -16.315 -23.530 726 HD12 LEU 95 2HD1 LEU 95 -10.459 -15.533 -24.577 727 HD13 LEU 95 3HD1 LEU 95 -10.842 -17.078 -23.819 728 HD21 LEU 95 3HD2 LEU 95 -12.363 -14.424 -23.749 729 HD22 LEU 95 1HD2 LEU 95 -12.727 -14.324 -22.027 730 HD23 LEU 95 2HD2 LEU 95 -12.980 -15.838 -22.893 731 H TYR 96 H TYR 96 -7.546 -15.466 -19.238 732 HA TYR 96 HA TYR 96 -8.366 -12.646 -19.177 733 HB2 TYR 96 1HB TYR 96 -8.653 -14.427 -16.943 734 HB3 TYR 96 2HB TYR 96 -7.364 -13.296 -16.543 735 HD1 TYR 96 HD2 TYR 96 -10.936 -13.655 -17.364 736 HD2 TYR 96 HD1 TYR 96 -7.799 -10.900 -16.353 737 HE1 TYR 96 HE2 TYR 96 -12.625 -11.899 -16.897 738 HE2 TYR 96 HE1 TYR 96 -9.488 -9.142 -15.892 739 HH TYR 96 HH TYR 96 -12.462 -9.589 -15.228 740 H ILE 97 H ILE 97 -6.729 -11.214 -19.203 741 HA ILE 97 HA ILE 97 -3.952 -12.225 -19.018 742 HB ILE 97 HB ILE 97 -3.485 -10.426 -20.763 743 HG12 ILE 97 1HG1 ILE 97 -6.458 -10.710 -21.251 744 HG13 ILE 97 2HG1 ILE 97 -5.727 -9.323 -20.448 745 HG21 ILE 97 1HG2 ILE 97 -3.334 -12.704 -21.444 746 HG22 ILE 97 2HG2 ILE 97 -4.365 -11.930 -22.645 747 HG23 ILE 97 3HG2 ILE 97 -5.082 -12.916 -21.372 748 HD11 ILE 97 3HD1 ILE 97 -4.335 -8.905 -22.453 749 HD12 ILE 97 1HD1 ILE 97 -6.055 -8.846 -22.835 750 HD13 ILE 97 2HD1 ILE 97 -5.105 -10.271 -23.261 751 H LEU 98 H LEU 98 -5.737 -10.869 -17.046 752 HA LEU 98 HA LEU 98 -5.649 -9.144 -15.495 753 HB2 LEU 98 1HB LEU 98 -2.800 -9.586 -16.338 754 HB3 LEU 98 2HB LEU 98 -3.154 -8.174 -15.348 755 HG LEU 98 HG LEU 98 -4.212 -9.619 -13.657 756 HD11 LEU 98 1HD1 LEU 98 -5.037 -11.432 -15.006 757 HD12 LEU 98 2HD1 LEU 98 -3.848 -12.111 -13.896 758 HD13 LEU 98 3HD1 LEU 98 -3.415 -11.816 -15.581 759 HD21 LEU 98 3HD2 LEU 98 -1.501 -10.762 -14.366 760 HD22 LEU 98 1HD2 LEU 98 -2.184 -10.502 -12.760 761 HD23 LEU 98 2HD2 LEU 98 -1.690 -9.124 -13.744 762 H GLY 99 H GLY 99 -6.979 -8.091 -17.345 763 HA2 GLY 99 1HA GLY 99 -5.587 -5.746 -18.504 764 HA3 GLY 99 2HA GLY 99 -7.109 -6.423 -19.075 765 H SER 100 H SER 100 -7.893 -6.686 -16.117 766 HA SER 100 HA SER 100 -8.388 -3.857 -15.455 767 HB2 SER 100 1HB SER 100 -10.735 -4.199 -15.184 768 HB3 SER 100 2HB SER 100 -10.328 -4.845 -16.771 769 HG SER 100 HG SER 100 -9.951 -6.813 -15.123 770 H ASP 101 H ASP 101 -6.795 -6.248 -14.553 771 HA ASP 101 HA ASP 101 -7.011 -5.810 -11.735 772 HB2 ASP 101 1HB ASP 101 -7.431 -8.213 -11.145 773 HB3 ASP 101 2HB ASP 101 -8.832 -7.392 -11.831 774 H VAL 102 H VAL 102 -5.234 -6.783 -10.583 775 HA VAL 102 HA VAL 102 -3.188 -8.099 -12.259 776 HB VAL 102 HB VAL 102 -2.780 -5.570 -12.007 777 HG11 VAL 102 1HG1 VAL 102 -1.803 -6.347 -9.260 778 HG12 VAL 102 2HG1 VAL 102 -3.413 -5.676 -9.505 779 HG13 VAL 102 3HG1 VAL 102 -1.990 -4.738 -9.946 780 HG21 VAL 102 3HG2 VAL 102 -0.729 -7.591 -11.057 781 HG22 VAL 102 1HG2 VAL 102 -0.348 -5.951 -11.589 782 HG23 VAL 102 2HG2 VAL 102 -1.033 -7.110 -12.726 783 H THR 103 H THR 103 -1.837 -9.462 -11.152 784 HA THR 103 HA THR 103 -2.702 -10.119 -8.373 785 HB THR 103 HB THR 103 -1.317 -12.016 -10.278 786 HG1 THR 103 HG1 THR 103 -3.296 -11.355 -11.170 787 HG21 THR 103 3HG2 THR 103 -2.479 -13.667 -8.747 788 HG22 THR 103 1HG2 THR 103 -2.893 -12.306 -7.705 789 HG23 THR 103 2HG2 THR 103 -1.201 -12.719 -7.984 790 H VAL 104 H VAL 104 -1.345 -9.355 -6.958 791 HA VAL 104 HA VAL 104 1.566 -9.729 -7.369 792 HB VAL 104 HB VAL 104 0.757 -7.320 -7.708 793 HG11 VAL 104 1HG1 VAL 104 0.036 -6.058 -5.826 794 HG12 VAL 104 2HG1 VAL 104 0.458 -7.349 -4.701 795 HG13 VAL 104 3HG1 VAL 104 -0.922 -7.538 -5.782 796 HG21 VAL 104 3HG2 VAL 104 2.577 -6.398 -6.246 797 HG22 VAL 104 1HG2 VAL 104 3.088 -7.800 -7.187 798 HG23 VAL 104 2HG2 VAL 104 2.705 -7.979 -5.474 799 H GLN 105 H GLN 105 2.588 -10.615 -5.667 800 HA GLN 105 HA GLN 105 1.065 -10.951 -3.123 801 HB2 GLN 105 1HB GLN 105 1.503 -13.004 -4.644 802 HB3 GLN 105 2HB GLN 105 3.173 -12.874 -4.106 803 HG2 GLN 105 1HG GLN 105 0.789 -13.089 -2.247 804 HG3 GLN 105 2HG GLN 105 1.811 -14.442 -2.715 805 HE21 GLN 105 2HE2 GLN 105 1.540 -11.772 -0.526 806 HE22 GLN 105 1HE2 GLN 105 3.077 -11.930 0.180 807 H LEU 106 H LEU 106 1.980 -9.642 -1.547 808 HA LEU 106 HA LEU 106 4.721 -8.808 -1.772 809 HB2 LEU 106 1HB LEU 106 2.761 -8.475 0.502 810 HB3 LEU 106 2HB LEU 106 4.217 -7.525 0.213 811 HG LEU 106 HG LEU 106 1.813 -7.652 -1.632 812 HD11 LEU 106 1HD1 LEU 106 1.435 -5.324 -0.902 813 HD12 LEU 106 2HD1 LEU 106 2.798 -5.448 0.210 814 HD13 LEU 106 3HD1 LEU 106 1.358 -6.436 0.465 815 HD21 LEU 106 3HD2 LEU 106 3.645 -7.177 -3.032 816 HD22 LEU 106 1HD2 LEU 106 4.498 -6.275 -1.780 817 HD23 LEU 106 2HD2 LEU 106 3.091 -5.568 -2.580 818 H ASN 107 H ASN 107 6.318 -10.018 -1.174 819 HA ASN 107 HA ASN 107 5.970 -12.026 0.999 820 HB2 ASN 107 1HB ASN 107 8.200 -11.887 -1.015 821 HB3 ASN 107 2HB ASN 107 7.840 -13.205 0.098 822 HD21 ASN 107 2HD2 ASN 107 6.093 -11.267 -2.374 823 HD22 ASN 107 1HD2 ASN 107 5.260 -12.585 -3.031 824 H THR 108 H THR 108 6.205 -9.909 2.418 825 HA THR 108 HA THR 108 8.976 -9.113 2.776 826 HB THR 108 HB THR 108 6.889 -8.410 4.807 827 HG1 THR 108 HG1 THR 108 6.044 -8.366 2.517 828 HG21 THR 108 3HG2 THR 108 9.080 -6.907 3.349 829 HG22 THR 108 1HG2 THR 108 9.052 -7.386 5.045 830 HG23 THR 108 2HG2 THR 108 7.947 -6.146 4.462 831 H ALA 109 H ALA 109 9.666 -9.052 5.181 832 HA ALA 109 HA ALA 109 10.250 -11.662 5.974 833 HB1 ALA 109 3HB ALA 109 10.434 -8.999 7.352 834 HB2 ALA 109 1HB ALA 109 11.731 -10.012 6.724 835 HB3 ALA 109 2HB ALA 109 10.884 -10.481 8.198 836 H GLU 110 H GLU 110 7.720 -9.458 7.190 837 HA GLU 110 HA GLU 110 6.511 -11.770 8.613 838 HB2 GLU 110 1HB GLU 110 5.889 -10.338 10.432 839 HB3 GLU 110 2HB GLU 110 7.612 -10.093 10.148 840 HG2 GLU 110 1HG GLU 110 6.971 -8.122 8.672 841 HG3 GLU 110 2HG GLU 110 5.329 -8.299 9.287 842 H LEU 111 H LEU 111 6.075 -10.457 5.930 843 HA LEU 111 HA LEU 111 3.167 -10.085 6.252 844 HB2 LEU 111 1HB LEU 111 4.599 -7.877 5.977 845 HB3 LEU 111 2HB LEU 111 4.670 -8.371 4.291 846 HG LEU 111 HG LEU 111 2.800 -6.859 4.600 847 HD11 LEU 111 1HD1 LEU 111 1.523 -9.576 4.381 848 HD12 LEU 111 2HD1 LEU 111 2.637 -9.004 3.138 849 HD13 LEU 111 3HD1 LEU 111 1.162 -8.103 3.484 850 HD21 LEU 111 3HD2 LEU 111 1.230 -6.986 6.279 851 HD22 LEU 111 1HD2 LEU 111 2.566 -7.756 7.131 852 HD23 LEU 111 2HD2 LEU 111 1.304 -8.740 6.388 853 H LYS 112 H LYS 112 2.166 -11.461 5.041 854 HA LYS 112 HA LYS 112 3.116 -12.072 2.348 855 HB2 LYS 112 1HB LYS 112 4.078 -13.785 4.040 856 HB3 LYS 112 2HB LYS 112 2.424 -14.392 4.137 857 HG2 LYS 112 1HG LYS 112 2.383 -14.771 1.721 858 HG3 LYS 112 2HG LYS 112 3.992 -14.066 1.556 859 HD2 LYS 112 1HD LYS 112 4.914 -15.845 2.999 860 HD3 LYS 112 2HD LYS 112 3.309 -16.563 3.130 861 HE2 LYS 112 1HE LYS 112 3.247 -16.864 0.678 862 HE3 LYS 112 2HE LYS 112 4.861 -16.161 0.556 863 HZ1 LYS 112 3HZ LYS 112 4.044 -18.781 1.522 864 HZ2 LYS 112 1HZ LYS 112 5.297 -18.029 2.381 865 HZ3 LYS 112 2HZ LYS 112 5.463 -18.313 0.714 866 H LEU 113 H LEU 113 1.397 -11.318 1.322 867 HA LEU 113 HA LEU 113 -1.151 -12.703 1.717 868 HB2 LEU 113 1HB LEU 113 -0.786 -9.740 2.120 869 HB3 LEU 113 2HB LEU 113 -2.342 -10.415 1.657 870 HG LEU 113 HG LEU 113 -0.745 -11.159 4.109 871 HD11 LEU 113 1HD1 LEU 113 -2.914 -10.111 5.189 872 HD12 LEU 113 2HD1 LEU 113 -2.990 -9.240 3.658 873 HD13 LEU 113 3HD1 LEU 113 -1.568 -9.091 4.690 874 HD21 LEU 113 3HD2 LEU 113 -3.259 -12.123 4.591 875 HD22 LEU 113 1HD2 LEU 113 -1.975 -13.094 3.876 876 HD23 LEU 113 2HD2 LEU 113 -3.178 -12.332 2.844 877 H VAL 114 H VAL 114 -2.799 -11.805 0.046 878 HA VAL 114 HA VAL 114 -1.387 -11.314 -2.530 879 HB VAL 114 HB VAL 114 -3.756 -13.116 -1.946 880 HG11 VAL 114 1HG1 VAL 114 -2.643 -12.050 -4.546 881 HG12 VAL 114 2HG1 VAL 114 -4.317 -12.049 -3.989 882 HG13 VAL 114 3HG1 VAL 114 -3.552 -13.562 -4.478 883 HG21 VAL 114 3HG2 VAL 114 -1.331 -13.914 -1.594 884 HG22 VAL 114 1HG2 VAL 114 -1.159 -13.788 -3.344 885 HG23 VAL 114 2HG2 VAL 114 -2.346 -14.895 -2.654 886 H PHE 115 H PHE 115 -2.127 -9.580 -3.654 887 HA PHE 115 HA PHE 115 -4.740 -8.433 -2.916 888 HB2 PHE 115 1HB PHE 115 -2.149 -6.999 -3.475 889 HB3 PHE 115 2HB PHE 115 -3.720 -6.198 -3.448 890 HD1 PHE 115 HD2 PHE 115 -4.983 -5.934 -1.368 891 HD2 PHE 115 HD1 PHE 115 -1.158 -7.893 -1.429 892 HE1 PHE 115 HE2 PHE 115 -4.874 -5.796 1.096 893 HE2 PHE 115 HE1 PHE 115 -1.041 -7.736 1.037 894 HZ PHE 115 HZ PHE 115 -2.891 -6.716 2.316 895 H GLN 116 H GLN 116 -5.999 -7.658 -4.512 896 HA GLN 116 HA GLN 116 -5.140 -8.114 -7.307 897 HB2 GLN 116 1HB GLN 116 -7.735 -8.593 -5.896 898 HB3 GLN 116 2HB GLN 116 -7.784 -8.169 -7.603 899 HG2 GLN 116 1HG GLN 116 -5.949 -10.354 -6.620 900 HG3 GLN 116 2HG GLN 116 -7.651 -10.689 -6.938 901 HE21 GLN 116 2HE2 GLN 116 -4.564 -9.963 -8.440 902 HE22 GLN 116 1HE2 GLN 116 -5.089 -10.150 -10.050 903 H LEU 117 H LEU 117 -4.305 -6.033 -7.603 904 HA LEU 117 HA LEU 117 -6.044 -3.710 -7.167 905 HB2 LEU 117 1HB LEU 117 -3.342 -3.567 -8.490 906 HB3 LEU 117 2HB LEU 117 -4.091 -2.438 -7.375 907 HG LEU 117 HG LEU 117 -2.991 -5.165 -6.656 908 HD11 LEU 117 1HD1 LEU 117 -2.039 -2.330 -6.222 909 HD12 LEU 117 2HD1 LEU 117 -1.176 -3.665 -6.985 910 HD13 LEU 117 3HD1 LEU 117 -1.460 -3.679 -5.245 911 HD21 LEU 117 3HD2 LEU 117 -4.729 -4.889 -5.118 912 HD22 LEU 117 1HD2 LEU 117 -4.631 -3.130 -5.155 913 HD23 LEU 117 2HD2 LEU 117 -3.420 -4.061 -4.277 914 HA PRO 118 HA PRO 118 -7.474 -3.573 -11.377 915 HB2 PRO 118 1HB PRO 118 -7.587 -0.889 -11.916 916 HB3 PRO 118 2HB PRO 118 -8.730 -1.709 -10.830 917 HG2 PRO 118 1HG PRO 118 -6.282 -0.145 -10.155 918 HG3 PRO 118 2HG PRO 118 -7.887 -0.086 -9.408 919 HD2 PRO 118 1HD PRO 118 -5.852 -1.444 -8.274 920 HD3 PRO 118 2HD PRO 118 -7.523 -2.030 -8.158 921 H PHE 119 H PHE 119 -6.214 -4.284 -13.013 922 HA PHE 119 HA PHE 119 -3.662 -4.098 -13.551 923 HB2 PHE 119 1HB PHE 119 -5.247 -5.400 -14.856 924 HB3 PHE 119 2HB PHE 119 -5.866 -3.923 -15.593 925 HD1 PHE 119 HD1 PHE 119 -2.573 -5.612 -14.976 926 HD2 PHE 119 HD2 PHE 119 -5.006 -3.343 -17.695 927 HE1 PHE 119 HE1 PHE 119 -0.788 -5.747 -16.689 928 HE2 PHE 119 HE2 PHE 119 -3.221 -3.480 -19.406 929 HZ PHE 119 HZ PHE 119 -1.109 -4.680 -18.904 930 H GLY 120 H GLY 120 -2.164 -2.845 -14.317 931 HA2 GLY 120 1HA GLY 120 -1.130 -0.776 -14.612 932 HA3 GLY 120 2HA GLY 120 -2.019 -0.904 -16.123 933 H SER 121 H SER 121 -2.863 1.031 -16.560 934 HA SER 121 HA SER 121 -3.922 3.058 -16.282 935 HB2 SER 121 1HB SER 121 -6.058 2.913 -15.199 936 HB3 SER 121 2HB SER 121 -5.762 1.354 -15.961 937 HG SER 121 HG SER 121 -5.498 0.451 -14.041 938 H HIS 122 H HIS 122 -5.083 2.759 -13.154 939 HA HIS 122 HA HIS 122 -3.313 4.827 -12.192 940 HB2 HIS 122 1HB HIS 122 -5.792 4.693 -11.709 941 HB3 HIS 122 2HB HIS 122 -5.432 3.342 -10.632 942 HD2 HIS 122 HD2 HIS 122 -5.345 4.383 -8.092 943 HE1 HIS 122 HE1 HIS 122 -3.341 7.996 -8.969 944 HE2 HIS 122 HE2 HIS 122 -4.329 6.580 -7.105 945 H THR 123 H THR 123 -3.148 1.457 -12.268 946 HA THR 123 HA THR 123 -1.741 1.160 -9.725 947 HB THR 123 HB THR 123 -2.306 -0.848 -11.915 948 HG1 THR 123 HG1 THR 123 -3.921 -1.510 -10.572 949 HG21 THR 123 3HG2 THR 123 -0.408 -1.657 -10.774 950 HG22 THR 123 1HG2 THR 123 -1.754 -2.430 -9.942 951 HG23 THR 123 2HG2 THR 123 -0.961 -1.033 -9.221 952 H ARG 124 H ARG 124 -1.007 1.313 -13.183 953 HA ARG 124 HA ARG 124 1.576 0.283 -13.186 954 HB2 ARG 124 1HB ARG 124 0.307 0.927 -15.215 955 HB3 ARG 124 2HB ARG 124 0.536 2.622 -14.798 956 HG2 ARG 124 1HG ARG 124 2.990 2.315 -14.921 957 HG3 ARG 124 2HG ARG 124 2.746 0.624 -15.357 958 HD2 ARG 124 1HD ARG 124 1.620 2.952 -16.923 959 HD3 ARG 124 2HD ARG 124 3.135 2.146 -17.320 960 HE ARG 124 HE ARG 124 1.113 0.190 -17.124 961 HH11 ARG 124 1HH2 ARG 124 2.058 2.903 -19.052 962 HH12 ARG 124 2HH2 ARG 124 1.355 2.287 -20.511 963 HH21 ARG 124 1HH1 ARG 124 0.188 -0.626 -19.037 964 HH22 ARG 124 2HH1 ARG 124 0.297 0.292 -20.502 965 H THR 125 H THR 125 0.470 3.559 -12.466 966 HA THR 125 HA THR 125 2.971 4.782 -12.227 967 HB THR 125 HB THR 125 0.405 5.374 -10.727 968 HG1 THR 125 HG1 THR 125 0.963 7.150 -12.567 969 HG21 THR 125 3HG2 THR 125 1.440 7.664 -10.533 970 HG22 THR 125 1HG2 THR 125 2.955 6.957 -11.092 971 HG23 THR 125 2HG2 THR 125 2.239 6.421 -9.573 972 H PHE 126 H PHE 126 0.987 3.052 -9.857 973 HA PHE 126 HA PHE 126 2.498 3.521 -7.568 974 HB2 PHE 126 1HB PHE 126 0.299 2.397 -7.567 975 HB3 PHE 126 2HB PHE 126 1.042 0.973 -8.293 976 HD1 PHE 126 HD1 PHE 126 2.773 -0.318 -7.045 977 HD2 PHE 126 HD2 PHE 126 0.570 2.892 -5.237 978 HE1 PHE 126 HE1 PHE 126 3.459 -1.112 -4.800 979 HE2 PHE 126 HE2 PHE 126 1.259 2.102 -2.991 980 HZ PHE 126 HZ PHE 126 2.706 0.099 -2.774 981 H LEU 127 H LEU 127 2.807 0.725 -9.826 982 HA LEU 127 HA LEU 127 4.808 -0.639 -8.606 983 HB2 LEU 127 1HB LEU 127 4.798 -0.101 -11.584 984 HB3 LEU 127 2HB LEU 127 5.404 -1.532 -10.752 985 HG LEU 127 HG LEU 127 2.506 -0.644 -10.824 986 HD11 LEU 127 1HD1 LEU 127 2.267 -2.725 -12.228 987 HD12 LEU 127 2HD1 LEU 127 4.026 -2.809 -12.300 988 HD13 LEU 127 3HD1 LEU 127 3.181 -1.430 -13.002 989 HD21 LEU 127 3HD2 LEU 127 2.820 -1.863 -8.805 990 HD22 LEU 127 1HD2 LEU 127 3.969 -2.971 -9.551 991 HD23 LEU 127 2HD2 LEU 127 2.255 -3.078 -9.951 992 H GLN 128 H GLN 128 5.288 2.056 -10.936 993 HA GLN 128 HA GLN 128 8.054 2.051 -10.877 994 HB2 GLN 128 1HB GLN 128 6.067 4.251 -11.373 995 HB3 GLN 128 2HB GLN 128 7.801 4.393 -11.691 996 HG2 GLN 128 1HG GLN 128 7.735 2.544 -13.247 997 HG3 GLN 128 2HG GLN 128 6.059 2.189 -12.822 998 HE21 GLN 128 2HE2 GLN 128 4.405 3.568 -13.638 999 HE22 GLN 128 1HE2 GLN 128 4.712 4.701 -14.846 1000 H GLU 129 H GLU 129 5.747 3.716 -8.752 1001 HA GLU 129 HA GLU 129 7.626 5.351 -7.421 1002 HB2 GLU 129 1HB GLU 129 4.970 4.254 -6.472 1003 HB3 GLU 129 2HB GLU 129 5.902 5.480 -5.614 1004 HG2 GLU 129 1HG GLU 129 4.916 5.754 -8.466 1005 HG3 GLU 129 2HG GLU 129 4.127 6.464 -7.061 1006 H VAL 130 H VAL 130 6.819 1.983 -7.033 1007 HA VAL 130 HA VAL 130 7.748 1.618 -4.392 1008 HB VAL 130 HB VAL 130 7.665 -0.277 -6.750 1009 HG11 VAL 130 1HG1 VAL 130 8.303 -0.749 -3.836 1010 HG12 VAL 130 2HG1 VAL 130 9.267 -1.198 -5.242 1011 HG13 VAL 130 3HG1 VAL 130 7.751 -2.034 -4.909 1012 HG21 VAL 130 3HG2 VAL 130 5.861 0.070 -4.336 1013 HG22 VAL 130 1HG2 VAL 130 5.648 -1.119 -5.620 1014 HG23 VAL 130 2HG2 VAL 130 5.483 0.601 -5.976 1015 H ALA 131 H ALA 131 9.384 1.242 -7.494 1016 HA ALA 131 HA ALA 131 11.905 0.439 -6.631 1017 HB1 ALA 131 3HB ALA 131 11.240 2.245 -8.963 1018 HB2 ALA 131 1HB ALA 131 11.318 0.482 -8.987 1019 HB3 ALA 131 2HB ALA 131 12.784 1.426 -8.723 1020 H ARG 132 H ARG 132 10.656 3.749 -6.874 1021 HA ARG 132 HA ARG 132 13.166 4.923 -6.027 1022 HB2 ARG 132 1HB ARG 132 10.411 6.099 -6.434 1023 HB3 ARG 132 2HB ARG 132 11.827 7.042 -5.963 1024 HG2 ARG 132 1HG ARG 132 13.003 6.364 -7.992 1025 HG3 ARG 132 2HG ARG 132 11.657 5.321 -8.452 1026 HD2 ARG 132 1HD ARG 132 11.500 7.422 -9.678 1027 HD3 ARG 132 2HD ARG 132 10.175 7.317 -8.523 1028 HE ARG 132 HE ARG 132 12.395 8.654 -7.352 1029 HH11 ARG 132 1HH2 ARG 132 9.865 9.005 -9.685 1030 HH12 ARG 132 2HH2 ARG 132 9.753 10.725 -9.510 1031 HH21 ARG 132 1HH1 ARG 132 12.254 10.908 -7.115 1032 HH22 ARG 132 2HH1 ARG 132 11.107 11.803 -8.053 1033 H ALA 133 H ALA 133 10.228 3.848 -4.540 1034 HA ALA 133 HA ALA 133 10.180 5.265 -2.169 1035 HB1 ALA 133 3HB ALA 133 8.932 3.407 -1.231 1036 HB2 ALA 133 1HB ALA 133 9.539 2.333 -2.491 1037 HB3 ALA 133 2HB ALA 133 8.448 3.653 -2.909 1038 H CYS 134 H CYS 134 12.384 2.722 -3.114 1039 HA CYS 134 HA CYS 134 14.241 3.384 -1.133 1040 HB2 CYS 134 1HB CYS 134 12.179 1.564 -0.187 1041 HB3 CYS 134 2HB CYS 134 13.772 0.823 -0.056 1042 HG CYS 134 HG CYS 134 14.051 2.233 1.960 1043 HA PRO 135 HA PRO 135 15.493 -0.989 -3.159 1044 HB2 PRO 135 1HB PRO 135 13.591 -0.619 -5.455 1045 HB3 PRO 135 2HB PRO 135 14.214 -2.117 -4.739 1046 HG2 PRO 135 1HG PRO 135 11.758 -1.226 -4.211 1047 HG3 PRO 135 2HG PRO 135 12.743 -2.023 -2.970 1048 HD2 PRO 135 1HD PRO 135 12.034 0.861 -3.229 1049 HD3 PRO 135 2HD PRO 135 12.442 -0.075 -1.780 1050 H GLY 136 H GLY 136 15.011 -0.434 -6.330 1051 HA2 GLY 136 1HA GLY 136 16.321 0.444 -8.002 1052 HA3 GLY 136 2HA GLY 136 16.334 1.916 -7.030 1053 H PHE 137 H PHE 137 17.501 -1.092 -5.814 1054 HA PHE 137 HA PHE 137 19.545 -1.554 -4.793 1055 HB2 PHE 137 1HB PHE 137 20.213 -1.020 -7.688 1056 HB3 PHE 137 2HB PHE 137 21.354 -1.733 -6.548 1057 HD1 PHE 137 HD2 PHE 137 20.902 -3.939 -5.520 1058 HD2 PHE 137 HD1 PHE 137 18.302 -2.264 -8.500 1059 HE1 PHE 137 HE2 PHE 137 19.849 -6.160 -5.850 1060 HE2 PHE 137 HE1 PHE 137 17.249 -4.485 -8.830 1061 HZ PHE 137 HZ PHE 137 18.023 -6.432 -7.504 1062 H ASP 138 H ASP 138 19.381 0.544 -3.526 1063 HA ASP 138 HA ASP 138 21.378 2.536 -4.354 1064 HB2 ASP 138 1HB ASP 138 18.914 2.584 -2.754 1065 HB3 ASP 138 2HB ASP 138 20.236 3.430 -1.959 1066 HA PRO 139 HA PRO 139 24.450 1.252 -1.470 1067 HB2 PRO 139 1HB PRO 139 24.496 3.866 -0.034 1068 HB3 PRO 139 2HB PRO 139 25.787 3.062 -0.949 1069 HG2 PRO 139 1HG PRO 139 24.548 5.209 -1.918 1070 HG3 PRO 139 2HG PRO 139 25.029 3.870 -2.977 1071 HD2 PRO 139 1HD PRO 139 22.301 4.504 -1.870 1072 HD3 PRO 139 2HD PRO 139 22.765 4.000 -3.509 1073 H GLU 140 H GLU 140 22.566 3.505 0.579 1074 HA GLU 140 HA GLU 140 22.712 1.673 2.826 1075 HB2 GLU 140 1HB GLU 140 21.480 4.414 2.487 1076 HB3 GLU 140 2HB GLU 140 21.473 3.507 4.003 1077 HG2 GLU 140 1HG GLU 140 23.925 3.420 3.982 1078 HG3 GLU 140 2HG GLU 140 23.953 4.275 2.442 1079 H THR 141 H THR 141 21.278 0.647 0.610 1080 HA THR 141 HA THR 141 18.443 0.736 1.462 1081 HB THR 141 HB THR 141 19.239 1.137 -0.974 1082 HG1 THR 141 HG1 THR 141 17.309 -0.886 -0.651 1083 HG21 THR 141 3HG2 THR 141 19.801 -0.698 -2.308 1084 HG22 THR 141 1HG2 THR 141 19.073 -1.852 -1.195 1085 HG23 THR 141 2HG2 THR 141 20.622 -1.108 -0.803 1086 H ARG 142 H ARG 142 20.974 -0.951 2.423 1087 HA ARG 142 HA ARG 142 19.676 -3.615 2.281 1088 HB2 ARG 142 1HB ARG 142 22.532 -2.818 2.856 1089 HB3 ARG 142 2HB ARG 142 21.918 -4.471 2.931 1090 HG2 ARG 142 1HG ARG 142 21.270 -4.366 0.573 1091 HG3 ARG 142 2HG ARG 142 21.806 -2.686 0.487 1092 HD2 ARG 142 1HD ARG 142 23.620 -4.986 1.250 1093 HD3 ARG 142 2HD ARG 142 23.488 -4.352 -0.388 1094 HE ARG 142 HE ARG 142 24.015 -2.175 1.270 1095 HH11 ARG 142 1HH2 ARG 142 25.484 -5.171 0.351 1096 HH12 ARG 142 2HH2 ARG 142 27.106 -4.590 0.533 1097 HH21 ARG 142 1HH1 ARG 142 26.136 -1.406 1.511 1098 HH22 ARG 142 2HH1 ARG 142 27.475 -2.459 1.190 1099 H ASP 143 H ASP 143 20.766 -1.115 4.382 1100 HA ASP 143 HA ASP 143 20.313 -2.751 6.785 1101 HB2 ASP 143 1HB ASP 143 22.373 -1.434 6.676 1102 HB3 ASP 143 2HB ASP 143 21.424 0.042 6.514 1103 HA PRO 144 HA PRO 144 16.096 -0.949 6.673 1104 HB2 PRO 144 1HB PRO 144 16.175 -2.186 9.414 1105 HB3 PRO 144 2HB PRO 144 14.896 -2.246 8.187 1106 HG2 PRO 144 1HG PRO 144 16.471 -4.325 8.573 1107 HG3 PRO 144 2HG PRO 144 15.983 -3.848 6.935 1108 HD2 PRO 144 1HD PRO 144 18.630 -3.475 8.291 1109 HD3 PRO 144 2HD PRO 144 18.268 -3.782 6.577 1110 H GLU 145 H GLU 145 14.905 0.517 8.119 1111 HA GLU 145 HA GLU 145 16.451 1.971 10.136 1112 HB2 GLU 145 1HB GLU 145 15.538 4.163 8.855 1113 HB3 GLU 145 2HB GLU 145 17.121 3.471 8.514 1114 HG2 GLU 145 1HG GLU 145 14.659 2.593 6.999 1115 HG3 GLU 145 2HG GLU 145 15.610 3.988 6.498 1116 H PHE 146 H PHE 146 13.645 3.142 8.350 1117 HA PHE 146 HA PHE 146 11.514 3.626 9.054 1118 HB2 PHE 146 1HB PHE 146 11.641 1.232 10.871 1119 HB3 PHE 146 2HB PHE 146 10.310 1.789 9.857 1120 HD1 PHE 146 HD1 PHE 146 11.926 2.251 7.282 1121 HD2 PHE 146 HD2 PHE 146 11.857 -1.021 10.078 1122 HE1 PHE 146 HE1 PHE 146 12.659 0.710 5.503 1123 HE2 PHE 146 HE2 PHE 146 12.581 -2.555 8.284 1124 HZ PHE 146 HZ PHE 146 12.990 -1.692 5.999 1125 H GLU 147 H GLU 147 14.053 4.100 10.863 1126 HA GLU 147 HA GLU 147 13.288 4.272 13.537 1127 HB2 GLU 147 1HB GLU 147 15.591 4.568 12.692 1128 HB3 GLU 147 2HB GLU 147 15.129 6.135 12.029 1129 HG2 GLU 147 1HG GLU 147 14.606 6.969 14.262 1130 HG3 GLU 147 2HG GLU 147 14.936 5.384 14.960 1131 H TRP 148 H TRP 148 12.189 6.178 10.894 1132 HA TRP 148 HA TRP 148 11.336 8.399 12.627 1133 HB2 TRP 148 1HB TRP 148 10.586 9.460 10.519 1134 HB3 TRP 148 2HB TRP 148 12.299 9.043 10.504 1135 HD1 TRP 148 HD1 TRP 148 12.855 6.572 9.312 1136 HE1 TRP 148 HE1 TRP 148 11.821 5.585 7.173 1137 HE3 TRP 148 HE3 TRP 148 8.609 9.396 9.000 1138 HZ2 TRP 148 HZ2 TRP 148 9.506 5.948 5.535 1139 HZ3 TRP 148 HZ3 TRP 148 7.012 9.058 7.135 1140 HH2 TRP 148 HH2 TRP 148 7.455 7.339 5.404 1141 H LEU 149 H LEU 149 10.062 5.480 11.367 1142 HA LEU 149 HA LEU 149 7.334 6.202 11.129 1143 HB2 LEU 149 1HB LEU 149 8.787 3.609 11.568 1144 HB3 LEU 149 2HB LEU 149 7.038 3.645 11.726 1145 HG LEU 149 HG LEU 149 7.963 3.034 9.418 1146 HD11 LEU 149 1HD1 LEU 149 5.607 4.006 9.980 1147 HD12 LEU 149 2HD1 LEU 149 6.145 4.012 8.306 1148 HD13 LEU 149 3HD1 LEU 149 6.221 5.494 9.252 1149 HD21 LEU 149 3HD2 LEU 149 8.377 6.000 9.086 1150 HD22 LEU 149 1HD2 LEU 149 8.906 4.692 8.035 1151 HD23 LEU 149 2HD2 LEU 149 9.699 4.952 9.584 1152 H SER 150 H SER 150 9.318 5.240 13.884 1153 HA SER 150 HA SER 150 7.450 4.666 15.804 1154 HB2 SER 150 1HB SER 150 9.985 6.291 15.993 1155 HB3 SER 150 2HB SER 150 9.049 5.821 17.409 1156 HG SER 150 HG SER 150 10.603 4.298 15.680 1157 H ARG 151 H ARG 151 8.003 7.670 14.199 1158 HA ARG 151 HA ARG 151 6.881 9.492 16.023 1159 HB2 ARG 151 1HB ARG 151 6.674 10.968 14.151 1160 HB3 ARG 151 2HB ARG 151 8.098 9.982 13.823 1161 HG2 ARG 151 1HG ARG 151 6.572 8.424 12.495 1162 HG3 ARG 151 2HG ARG 151 5.322 9.649 12.652 1163 HD2 ARG 151 1HD ARG 151 8.045 10.253 11.501 1164 HD3 ARG 151 2HD ARG 151 6.670 9.767 10.514 1165 HE ARG 151 HE ARG 151 5.875 11.906 12.162 1166 HH11 ARG 151 1HH2 ARG 151 7.986 11.164 9.527 1167 HH12 ARG 151 2HH2 ARG 151 7.924 12.756 8.848 1168 HH21 ARG 151 1HH1 ARG 151 5.786 13.991 11.285 1169 HH22 ARG 151 2HH1 ARG 151 6.678 14.360 9.848 1170 H HIS 152 H HIS 152 5.497 7.417 13.559 1171 HA HIS 152 HA HIS 152 2.804 8.300 13.973 1172 HB2 HIS 152 1HB HIS 152 3.985 5.924 12.519 1173 HB3 HIS 152 2HB HIS 152 2.261 6.287 12.551 1174 HD2 HIS 152 HD2 HIS 152 5.346 7.274 10.511 1175 HE1 HIS 152 HE1 HIS 152 2.423 10.209 9.699 1176 HE2 HIS 152 HE2 HIS 152 4.675 9.278 8.979 1177 H THR 153 H THR 153 1.183 7.258 15.049 1178 HA THR 153 HA THR 153 1.957 5.032 16.857 1179 HB THR 153 HB THR 153 1.721 7.138 18.145 1180 HG1 THR 153 HG1 THR 153 0.989 5.791 19.554 1181 HG21 THR 153 3HG2 THR 153 -1.184 7.106 17.315 1182 HG22 THR 153 1HG2 THR 153 0.017 8.117 16.510 1183 HG23 THR 153 2HG2 THR 153 -0.328 8.350 18.223 1184 H CYS 154 H CYS 154 0.148 6.053 14.322 1185 HA CYS 154 HA CYS 154 -1.637 5.196 13.178 1186 HB2 CYS 154 1HB CYS 154 -1.482 2.786 14.983 1187 HB3 CYS 154 2HB CYS 154 -1.994 2.866 13.295 1188 HG CYS 154 HG CYS 154 0.937 2.848 14.286 1189 H ALA 155 H ALA 155 -3.917 4.832 13.329 1190 HA ALA 155 HA ALA 155 -5.339 6.327 15.084 1191 HB1 ALA 155 3HB ALA 155 -7.293 5.116 14.450 1192 HB2 ALA 155 1HB ALA 155 -6.364 3.652 14.126 1193 HB3 ALA 155 2HB ALA 155 -6.206 5.050 13.062 1194 H GLU 156 H GLU 156 -6.494 5.987 17.020 1195 HA GLU 156 HA GLU 156 -5.268 3.987 18.796 1196 HB2 GLU 156 1HB GLU 156 -6.907 6.456 19.368 1197 HB3 GLU 156 2HB GLU 156 -6.339 5.334 20.606 1198 HG2 GLU 156 1HG GLU 156 -4.466 6.637 18.623 1199 HG3 GLU 156 2HG GLU 156 -4.849 7.366 20.181 1200 HA PRO 157 HA PRO 157 -9.328 1.972 18.140 1201 HB2 PRO 157 1HB PRO 157 -8.658 -0.544 18.870 1202 HB3 PRO 157 2HB PRO 157 -8.151 0.142 17.312 1203 HG2 PRO 157 1HG PRO 157 -6.601 -0.121 19.853 1204 HG3 PRO 157 2HG PRO 157 -6.093 -0.468 18.188 1205 HD2 PRO 157 1HD PRO 157 -5.465 1.863 19.494 1206 HD3 PRO 157 2HD PRO 157 -5.635 1.765 17.724 1207 H ASP 158 H ASP 158 -10.938 1.065 19.535 1208 HA ASP 158 HA ASP 158 -10.385 0.893 22.400 1209 HB2 ASP 158 1HB ASP 158 -12.111 2.522 22.989 1210 HB3 ASP 158 2HB ASP 158 -10.853 3.289 22.021 1211 H ALA 159 H ALA 159 -10.907 -1.329 21.537 1212 HA ALA 159 HA ALA 159 -13.514 -2.008 20.670 1213 HB1 ALA 159 3HB ALA 159 -11.472 -3.701 22.129 1214 HB2 ALA 159 1HB ALA 159 -11.584 -3.500 20.382 1215 HB3 ALA 159 2HB ALA 159 -12.880 -4.312 21.260 1216 H GLU 160 H GLU 160 -12.051 -1.747 23.875 1217 HA GLU 160 HA GLU 160 -14.169 -2.921 25.340 1218 HB2 GLU 160 1HB GLU 160 -12.063 -0.898 26.124 1219 HB3 GLU 160 2HB GLU 160 -13.177 -1.645 27.270 1220 HG2 GLU 160 1HG GLU 160 -12.344 -3.862 26.697 1221 HG3 GLU 160 2HG GLU 160 -11.303 -3.180 25.449 1222 H SER 161 H SER 161 -13.531 0.411 24.321 1223 HA SER 161 HA SER 161 -15.425 1.794 25.775 1224 HB2 SER 161 1HB SER 161 -13.953 3.017 24.351 1225 HB3 SER 161 2HB SER 161 -14.511 2.155 22.920 1226 HG SER 161 HG SER 161 -16.524 3.144 23.177 Start of MODEL 14 1 H1 GLY 1 1H GLY 1 -13.703 18.641 -17.736 2 H2 GLY 1 2H GLY 1 -12.820 17.241 -17.350 3 H3 GLY 1 3H GLY 1 -13.726 18.035 -16.153 4 HA2 GLY 1 1HA GLY 1 -15.644 17.558 -17.934 5 HA3 GLY 1 2HA GLY 1 -14.584 16.173 -18.204 6 HA PRO 2 HA PRO 2 -15.577 14.059 -14.465 7 HB2 PRO 2 1HB PRO 2 -13.233 15.143 -12.936 8 HB3 PRO 2 2HB PRO 2 -13.731 13.457 -13.190 9 HG2 PRO 2 1HG PRO 2 -11.669 14.472 -14.516 10 HG3 PRO 2 2HG PRO 2 -12.807 13.370 -15.314 11 HD2 PRO 2 1HD PRO 2 -12.582 16.352 -15.574 12 HD3 PRO 2 2HD PRO 2 -12.981 15.141 -16.815 13 H LEU 3 H LEU 3 -14.457 17.349 -13.768 14 HA LEU 3 HA LEU 3 -15.114 18.878 -12.140 15 HB2 LEU 3 1HB LEU 3 -17.739 17.880 -13.266 16 HB3 LEU 3 2HB LEU 3 -17.575 19.338 -12.292 17 HG LEU 3 HG LEU 3 -16.060 18.851 -14.878 18 HD11 LEU 3 1HD1 LEU 3 -17.662 20.189 -16.015 19 HD12 LEU 3 2HD1 LEU 3 -18.413 20.712 -14.508 20 HD13 LEU 3 3HD1 LEU 3 -18.617 19.052 -15.064 21 HD21 LEU 3 3HD2 LEU 3 -14.831 20.490 -13.747 22 HD22 LEU 3 1HD2 LEU 3 -16.248 21.137 -12.919 23 HD23 LEU 3 2HD2 LEU 3 -15.980 21.492 -14.624 24 H GLY 4 H GLY 4 -14.277 17.177 -10.544 25 HA2 GLY 4 1HA GLY 4 -14.551 16.576 -8.303 26 HA3 GLY 4 2HA GLY 4 -16.280 16.875 -8.453 27 H SER 5 H SER 5 -14.021 14.507 -8.017 28 HA SER 5 HA SER 5 -15.949 12.399 -8.585 29 HB2 SER 5 1HB SER 5 -14.746 12.596 -10.721 30 HB3 SER 5 2HB SER 5 -13.208 12.423 -9.878 31 HG SER 5 HG SER 5 -15.018 10.535 -10.636 32 H MET 6 H MET 6 -15.001 10.231 -7.860 33 HA MET 6 HA MET 6 -13.882 10.600 -5.211 34 HB2 MET 6 1HB MET 6 -14.767 8.136 -6.728 35 HB3 MET 6 2HB MET 6 -14.172 8.112 -5.068 36 HG2 MET 6 1HG MET 6 -15.975 9.675 -4.406 37 HG3 MET 6 2HG MET 6 -16.578 9.671 -6.062 38 HE1 MET 6 3HE MET 6 -19.360 7.612 -4.473 39 HE2 MET 6 1HE MET 6 -18.918 8.879 -5.625 40 HE3 MET 6 2HE MET 6 -18.567 9.080 -3.909 41 H ASP 7 H ASP 7 -11.983 9.457 -4.424 42 HA ASP 7 HA ASP 7 -10.158 8.212 -6.226 43 HB2 ASP 7 1HB ASP 7 -8.365 9.869 -6.095 44 HB3 ASP 7 2HB ASP 7 -9.787 10.571 -6.866 45 H GLN 8 H GLN 8 -8.096 7.696 -5.093 46 HA GLN 8 HA GLN 8 -8.620 7.184 -2.224 47 HB2 GLN 8 1HB GLN 8 -6.903 5.860 -4.312 48 HB3 GLN 8 2HB GLN 8 -6.610 5.570 -2.595 49 HG2 GLN 8 1HG GLN 8 -8.061 3.831 -3.319 50 HG3 GLN 8 2HG GLN 8 -9.088 4.959 -2.437 51 HE21 GLN 8 2HE2 GLN 8 -10.794 3.813 -3.896 52 HE22 GLN 8 1HE2 GLN 8 -11.056 4.483 -5.429 53 H SER 9 H SER 9 -6.333 8.585 -4.472 54 HA SER 9 HA SER 9 -4.127 9.009 -2.842 55 HB2 SER 9 1HB SER 9 -3.602 10.958 -4.260 56 HB3 SER 9 2HB SER 9 -4.117 9.577 -5.223 57 HG SER 9 HG SER 9 -5.203 11.414 -5.916 58 H VAL 10 H VAL 10 -6.939 11.168 -3.226 59 HA VAL 10 HA VAL 10 -6.068 13.074 -1.306 60 HB VAL 10 HB VAL 10 -8.817 12.407 -2.383 61 HG11 VAL 10 1HG1 VAL 10 -9.352 14.741 -1.466 62 HG12 VAL 10 2HG1 VAL 10 -7.893 14.577 -0.490 63 HG13 VAL 10 3HG1 VAL 10 -9.228 13.446 -0.276 64 HG21 VAL 10 3HG2 VAL 10 -8.474 14.267 -3.830 65 HG22 VAL 10 1HG2 VAL 10 -6.953 13.376 -3.876 66 HG23 VAL 10 2HG2 VAL 10 -7.091 14.839 -2.898 67 H ALA 11 H ALA 11 -8.287 10.331 -1.117 68 HA ALA 11 HA ALA 11 -9.271 10.463 1.398 69 HB1 ALA 11 3HB ALA 11 -9.538 8.110 1.379 70 HB2 ALA 11 1HB ALA 11 -8.116 7.876 0.361 71 HB3 ALA 11 2HB ALA 11 -9.579 8.592 -0.318 72 H ILE 12 H ILE 12 -6.041 9.227 0.551 73 HA ILE 12 HA ILE 12 -5.308 8.604 3.210 74 HB ILE 12 HB ILE 12 -3.503 9.293 0.892 75 HG12 ILE 12 1HG1 ILE 12 -5.025 7.513 0.244 76 HG13 ILE 12 2HG1 ILE 12 -3.441 6.813 0.549 77 HG21 ILE 12 1HG2 ILE 12 -3.075 7.990 3.573 78 HG22 ILE 12 2HG2 ILE 12 -2.133 9.261 2.795 79 HG23 ILE 12 3HG2 ILE 12 -2.021 7.601 2.213 80 HD11 ILE 12 3HD1 ILE 12 -4.392 6.437 2.979 81 HD12 ILE 12 1HD1 ILE 12 -4.847 5.333 1.683 82 HD13 ILE 12 2HD1 ILE 12 -5.954 6.611 2.185 83 H GLN 13 H GLN 13 -4.628 11.388 1.171 84 HA GLN 13 HA GLN 13 -2.994 12.836 2.822 85 HB2 GLN 13 1HB GLN 13 -4.029 13.394 0.443 86 HB3 GLN 13 2HB GLN 13 -5.174 14.336 1.395 87 HG2 GLN 13 1HG GLN 13 -3.452 15.876 0.959 88 HG3 GLN 13 2HG GLN 13 -3.069 15.297 2.577 89 HE21 GLN 13 2HE2 GLN 13 -0.886 14.746 2.811 90 HE22 GLN 13 1HE2 GLN 13 0.102 14.172 1.559 91 H GLU 14 H GLU 14 -6.591 12.892 2.857 92 HA GLU 14 HA GLU 14 -6.820 14.717 4.993 93 HB2 GLU 14 1HB GLU 14 -8.684 12.518 4.060 94 HB3 GLU 14 2HB GLU 14 -9.130 13.808 5.176 95 HG2 GLU 14 1HG GLU 14 -8.070 14.272 2.374 96 HG3 GLU 14 2HG GLU 14 -9.780 14.280 2.800 97 H THR 15 H THR 15 -6.864 11.178 4.911 98 HA THR 15 HA THR 15 -7.182 10.836 7.726 99 HB THR 15 HB THR 15 -6.637 8.488 7.317 100 HG1 THR 15 HG1 THR 15 -5.475 7.958 5.669 101 HG21 THR 15 3HG2 THR 15 -8.888 9.003 6.799 102 HG22 THR 15 1HG2 THR 15 -8.302 8.119 5.391 103 HG23 THR 15 2HG2 THR 15 -8.439 9.875 5.334 104 H LEU 16 H LEU 16 -4.368 11.150 5.635 105 HA LEU 16 HA LEU 16 -2.433 10.097 7.353 106 HB2 LEU 16 1HB LEU 16 -2.121 10.786 4.928 107 HB3 LEU 16 2HB LEU 16 -2.008 12.449 5.491 108 HG LEU 16 HG LEU 16 -0.055 11.825 6.899 109 HD11 LEU 16 1HD1 LEU 16 -0.180 9.590 7.491 110 HD12 LEU 16 2HD1 LEU 16 0.944 9.467 6.142 111 HD13 LEU 16 3HD1 LEU 16 -0.764 9.089 5.903 112 HD21 LEU 16 3HD2 LEU 16 0.462 12.677 4.724 113 HD22 LEU 16 1HD2 LEU 16 0.048 11.142 3.958 114 HD23 LEU 16 2HD2 LEU 16 1.495 11.266 4.958 115 H VAL 17 H VAL 17 -1.321 13.186 6.948 116 HA VAL 17 HA VAL 17 -2.460 14.537 9.160 117 HB VAL 17 HB VAL 17 -1.296 12.925 10.534 118 HG11 VAL 17 1HG1 VAL 17 1.311 12.930 10.303 119 HG12 VAL 17 2HG1 VAL 17 1.000 13.512 8.668 120 HG13 VAL 17 3HG1 VAL 17 0.359 11.954 9.188 121 HG21 VAL 17 3HG2 VAL 17 0.016 14.430 11.860 122 HG22 VAL 17 1HG2 VAL 17 -1.229 15.413 11.089 123 HG23 VAL 17 2HG2 VAL 17 0.419 15.419 10.459 124 H GLU 18 H GLU 18 -1.640 16.654 9.337 125 HA GLU 18 HA GLU 18 -0.548 17.689 6.935 126 HB2 GLU 18 1HB GLU 18 -0.558 19.844 8.169 127 HB3 GLU 18 2HB GLU 18 -2.093 18.984 8.276 128 HG2 GLU 18 1HG GLU 18 -1.108 17.978 10.483 129 HG3 GLU 18 2HG GLU 18 0.032 19.319 10.392 130 H GLY 19 H GLY 19 1.498 17.541 6.316 131 HA2 GLY 19 1HA GLY 19 3.712 18.695 7.082 132 HA3 GLY 19 2HA GLY 19 3.655 17.471 8.343 133 H GLU 20 H GLU 20 2.420 15.555 6.330 134 HA GLU 20 HA GLU 20 4.984 14.699 5.143 135 HB2 GLU 20 1HB GLU 20 2.456 13.216 5.841 136 HB3 GLU 20 2HB GLU 20 3.680 12.516 4.781 137 HG2 GLU 20 1HG GLU 20 5.384 12.785 6.514 138 HG3 GLU 20 2HG GLU 20 4.216 13.573 7.574 139 H TYR 21 H TYR 21 4.343 13.146 3.151 140 HA TYR 21 HA TYR 21 2.811 14.784 1.204 141 HB2 TYR 21 1HB TYR 21 5.325 15.110 1.098 142 HB3 TYR 21 2HB TYR 21 5.434 13.410 0.642 143 HD1 TYR 21 HD1 TYR 21 4.132 16.728 -0.388 144 HD2 TYR 21 HD2 TYR 21 4.811 12.644 -1.527 145 HE1 TYR 21 HE1 TYR 21 3.651 17.306 -2.752 146 HE2 TYR 21 HE2 TYR 21 4.329 13.218 -3.886 147 HH TYR 21 HH TYR 21 3.630 14.801 -5.285 148 H CYS 22 H CYS 22 1.309 13.650 0.197 149 HA CYS 22 HA CYS 22 1.436 10.715 0.214 150 HB2 CYS 22 1HB CYS 22 -0.704 12.186 0.642 151 HB3 CYS 22 2HB CYS 22 -0.757 12.285 -1.118 152 HG CYS 22 HG CYS 22 -1.241 9.737 0.552 153 H VAL 23 H VAL 23 1.535 9.514 -1.750 154 HA VAL 23 HA VAL 23 2.429 11.057 -4.117 155 HB VAL 23 HB VAL 23 3.398 8.353 -3.172 156 HG11 VAL 23 1HG1 VAL 23 3.539 8.444 -5.554 157 HG12 VAL 23 2HG1 VAL 23 5.153 8.842 -4.963 158 HG13 VAL 23 3HG1 VAL 23 4.080 10.123 -5.528 159 HG21 VAL 23 3HG2 VAL 23 5.463 9.498 -2.601 160 HG22 VAL 23 1HG2 VAL 23 4.131 10.304 -1.771 161 HG23 VAL 23 2HG2 VAL 23 4.832 11.024 -3.220 162 H ILE 24 H ILE 24 1.287 7.818 -3.164 163 HA ILE 24 HA ILE 24 -0.795 7.867 -5.163 164 HB ILE 24 HB ILE 24 1.149 7.365 -6.562 165 HG12 ILE 24 1HG1 ILE 24 0.388 5.257 -7.550 166 HG13 ILE 24 2HG1 ILE 24 -0.519 4.872 -6.089 167 HG21 ILE 24 1HG2 ILE 24 2.463 5.331 -6.181 168 HG22 ILE 24 2HG2 ILE 24 1.537 4.989 -4.724 169 HG23 ILE 24 3HG2 ILE 24 2.578 6.411 -4.794 170 HD11 ILE 24 3HD1 ILE 24 -1.743 5.961 -8.146 171 HD12 ILE 24 1HD1 ILE 24 -1.059 7.463 -7.522 172 HD13 ILE 24 2HD1 ILE 24 -2.138 6.496 -6.514 173 H ALA 25 H ALA 25 -2.417 6.562 -4.630 174 HA ALA 25 HA ALA 25 -2.017 4.214 -2.950 175 HB1 ALA 25 3HB ALA 25 -3.808 6.482 -2.041 176 HB2 ALA 25 1HB ALA 25 -2.231 6.121 -1.338 177 HB3 ALA 25 2HB ALA 25 -3.545 4.951 -1.210 178 H VAL 26 H VAL 26 -3.331 2.683 -3.701 179 HA VAL 26 HA VAL 26 -5.807 3.493 -5.124 180 HB VAL 26 HB VAL 26 -4.496 0.842 -5.631 181 HG11 VAL 26 1HG1 VAL 26 -5.718 0.875 -7.592 182 HG12 VAL 26 2HG1 VAL 26 -5.571 2.622 -7.789 183 HG13 VAL 26 3HG1 VAL 26 -6.740 1.962 -6.650 184 HG21 VAL 26 3HG2 VAL 26 -3.406 3.541 -6.420 185 HG22 VAL 26 1HG2 VAL 26 -3.244 2.184 -7.534 186 HG23 VAL 26 2HG2 VAL 26 -2.542 2.087 -5.923 187 H GLN 27 H GLN 27 -6.838 0.875 -5.318 188 HA GLN 27 HA GLN 27 -7.236 0.059 -2.515 189 HB2 GLN 27 1HB GLN 27 -9.073 1.625 -3.442 190 HB3 GLN 27 2HB GLN 27 -9.529 0.269 -4.470 191 HG2 GLN 27 1HG GLN 27 -9.269 0.029 -1.460 192 HG3 GLN 27 2HG GLN 27 -10.781 0.437 -2.264 193 HE21 GLN 27 2HE2 GLN 27 -10.356 -2.012 -0.740 194 HE22 GLN 27 1HE2 GLN 27 -10.517 -3.305 -1.825 195 H GLY 28 H GLY 28 -6.815 -2.011 -2.339 196 HA2 GLY 28 1HA GLY 28 -7.146 -3.785 -4.698 197 HA3 GLY 28 2HA GLY 28 -5.894 -3.970 -3.475 198 H VAL 29 H VAL 29 -7.729 -5.957 -4.277 199 HA VAL 29 HA VAL 29 -9.565 -6.225 -1.987 200 HB VAL 29 HB VAL 29 -9.256 -8.143 -4.304 201 HG11 VAL 29 1HG1 VAL 29 -10.543 -8.981 -2.412 202 HG12 VAL 29 2HG1 VAL 29 -11.650 -8.599 -3.728 203 HG13 VAL 29 3HG1 VAL 29 -11.494 -7.496 -2.361 204 HG21 VAL 29 3HG2 VAL 29 -9.698 -6.004 -5.328 205 HG22 VAL 29 1HG2 VAL 29 -10.911 -5.613 -4.109 206 HG23 VAL 29 2HG2 VAL 29 -11.224 -6.888 -5.286 207 H LEU 30 H LEU 30 -9.585 -8.291 -0.902 208 HA LEU 30 HA LEU 30 -7.022 -9.765 -0.863 209 HB2 LEU 30 1HB LEU 30 -7.317 -7.939 1.035 210 HB3 LEU 30 2HB LEU 30 -8.433 -9.108 1.732 211 HG LEU 30 HG LEU 30 -6.271 -9.535 2.693 212 HD11 LEU 30 1HD1 LEU 30 -5.985 -11.839 2.159 213 HD12 LEU 30 2HD1 LEU 30 -6.556 -11.609 0.513 214 HD13 LEU 30 3HD1 LEU 30 -7.683 -11.500 1.867 215 HD21 LEU 30 3HD2 LEU 30 -5.268 -8.612 0.194 216 HD22 LEU 30 1HD2 LEU 30 -4.724 -10.281 0.338 217 HD23 LEU 30 2HD2 LEU 30 -4.342 -9.119 1.601 218 H CYS 31 H CYS 31 -7.645 -11.847 -1.343 219 HA CYS 31 HA CYS 31 -10.333 -12.719 -0.497 220 HB2 CYS 31 1HB CYS 31 -9.535 -12.784 -2.950 221 HB3 CYS 31 2HB CYS 31 -8.529 -14.141 -2.446 222 HG CYS 31 HG CYS 31 -10.905 -15.179 -1.505 223 H LYS 32 H LYS 32 -10.541 -14.175 1.031 224 HA LYS 32 HA LYS 32 -8.322 -16.020 1.631 225 HB2 LYS 32 1HB LYS 32 -8.388 -14.002 3.251 226 HB3 LYS 32 2HB LYS 32 -9.870 -14.727 3.877 227 HG2 LYS 32 1HG LYS 32 -8.577 -16.887 4.160 228 HG3 LYS 32 2HG LYS 32 -7.115 -15.985 3.771 229 HD2 LYS 32 1HD LYS 32 -8.995 -15.419 6.081 230 HD3 LYS 32 2HD LYS 32 -7.393 -16.138 6.201 231 HE2 LYS 32 1HE LYS 32 -6.567 -13.989 5.001 232 HE3 LYS 32 2HE LYS 32 -8.132 -13.314 5.460 233 HZ1 LYS 32 3HZ LYS 32 -5.836 -13.835 7.081 234 HZ2 LYS 32 1HZ LYS 32 -7.241 -14.532 7.726 235 HZ3 LYS 32 2HZ LYS 32 -7.194 -12.865 7.403 236 H GLY 33 H GLY 33 -9.002 -18.048 1.946 237 HA2 GLY 33 1HA GLY 33 -10.442 -19.846 1.931 238 HA3 GLY 33 2HA GLY 33 -11.364 -18.913 3.109 239 H ASP 34 H ASP 34 -13.416 -18.680 2.552 240 HA ASP 34 HA ASP 34 -14.129 -18.288 -0.305 241 HB2 ASP 34 1HB ASP 34 -14.815 -20.523 0.632 242 HB3 ASP 34 2HB ASP 34 -15.817 -19.663 1.799 243 H SER 35 H SER 35 -13.455 -16.373 1.794 244 HA SER 35 HA SER 35 -15.994 -14.841 1.891 245 HB2 SER 35 1HB SER 35 -13.846 -14.995 4.026 246 HB3 SER 35 2HB SER 35 -15.228 -13.901 4.052 247 HG SER 35 HG SER 35 -16.587 -15.658 4.178 248 H ARG 36 H ARG 36 -15.780 -13.076 0.639 249 HA ARG 36 HA ARG 36 -13.158 -12.150 -0.145 250 HB2 ARG 36 1HB ARG 36 -15.384 -12.239 -1.544 251 HB3 ARG 36 2HB ARG 36 -15.714 -10.691 -0.774 252 HG2 ARG 36 1HG ARG 36 -14.580 -9.988 -2.691 253 HG3 ARG 36 2HG ARG 36 -13.245 -10.113 -1.550 254 HD2 ARG 36 1HD ARG 36 -12.695 -12.348 -2.401 255 HD3 ARG 36 2HD ARG 36 -14.081 -12.300 -3.481 256 HE ARG 36 HE ARG 36 -12.605 -10.068 -4.128 257 HH11 ARG 36 1HH2 ARG 36 -12.059 -13.479 -3.901 258 HH12 ARG 36 2HH2 ARG 36 -10.854 -13.508 -5.145 259 HH21 ARG 36 1HH1 ARG 36 -11.026 -10.098 -5.755 260 HH22 ARG 36 2HH1 ARG 36 -10.270 -11.592 -6.195 261 H GLN 37 H GLN 37 -12.168 -10.269 0.385 262 HA GLN 37 HA GLN 37 -13.433 -8.554 2.446 263 HB2 GLN 37 1HB GLN 37 -10.607 -9.640 2.410 264 HB3 GLN 37 2HB GLN 37 -11.186 -8.390 3.513 265 HG2 GLN 37 1HG GLN 37 -12.787 -9.880 4.498 266 HG3 GLN 37 2HG GLN 37 -12.509 -11.099 3.255 267 HE21 GLN 37 2HE2 GLN 37 -10.587 -12.407 3.409 268 HE22 GLN 37 1HE2 GLN 37 -9.611 -12.405 4.792 269 H SER 38 H SER 38 -12.581 -6.434 2.535 270 HA SER 38 HA SER 38 -11.331 -5.507 -0.004 271 HB2 SER 38 1HB SER 38 -13.234 -3.837 1.625 272 HB3 SER 38 2HB SER 38 -12.677 -3.581 -0.027 273 HG SER 38 HG SER 38 -14.536 -4.562 -0.402 274 H ARG 39 H ARG 39 -9.484 -4.500 0.178 275 HA ARG 39 HA ARG 39 -8.782 -3.161 2.726 276 HB2 ARG 39 1HB ARG 39 -7.095 -5.026 1.074 277 HB3 ARG 39 2HB ARG 39 -6.418 -3.955 2.301 278 HG2 ARG 39 1HG ARG 39 -8.011 -5.002 3.961 279 HG3 ARG 39 2HG ARG 39 -8.447 -6.170 2.712 280 HD2 ARG 39 1HD ARG 39 -6.736 -7.196 4.056 281 HD3 ARG 39 2HD ARG 39 -5.985 -6.744 2.532 282 HE ARG 39 HE ARG 39 -5.694 -4.628 4.397 283 HH11 ARG 39 1HH2 ARG 39 -4.569 -7.826 3.672 284 HH12 ARG 39 2HH2 ARG 39 -3.046 -7.614 4.471 285 HH21 ARG 39 1HH1 ARG 39 -3.706 -4.355 5.448 286 HH22 ARG 39 2HH1 ARG 39 -2.558 -5.653 5.475 287 H LEU 40 H LEU 40 -7.356 -1.444 2.560 288 HA LEU 40 HA LEU 40 -7.076 -0.271 -0.163 289 HB2 LEU 40 1HB LEU 40 -8.827 0.769 1.371 290 HB3 LEU 40 2HB LEU 40 -7.498 1.310 2.387 291 HG LEU 40 HG LEU 40 -7.307 1.951 -0.551 292 HD11 LEU 40 1HD1 LEU 40 -8.684 4.004 -0.191 293 HD12 LEU 40 2HD1 LEU 40 -9.190 3.351 1.366 294 HD13 LEU 40 3HD1 LEU 40 -9.631 2.518 -0.125 295 HD21 LEU 40 3HD2 LEU 40 -5.545 2.632 1.066 296 HD22 LEU 40 1HD2 LEU 40 -6.748 3.547 1.968 297 HD23 LEU 40 2HD2 LEU 40 -6.325 4.024 0.328 298 H LEU 41 H LEU 41 -5.026 0.187 -0.773 299 HA LEU 41 HA LEU 41 -2.915 0.125 1.287 300 HB2 LEU 41 1HB LEU 41 -2.920 -0.267 -1.710 301 HB3 LEU 41 2HB LEU 41 -1.434 -0.063 -0.788 302 HG LEU 41 HG LEU 41 -2.165 -1.997 0.666 303 HD11 LEU 41 1HD1 LEU 41 -4.370 -2.046 -1.396 304 HD12 LEU 41 2HD1 LEU 41 -4.492 -2.182 0.357 305 HD13 LEU 41 3HD1 LEU 41 -3.859 -3.528 -0.586 306 HD21 LEU 41 3HD2 LEU 41 -1.512 -3.691 -0.994 307 HD22 LEU 41 1HD2 LEU 41 -0.534 -2.235 -1.185 308 HD23 LEU 41 2HD2 LEU 41 -1.861 -2.558 -2.299 309 H GLY 42 H GLY 42 -1.008 1.559 0.758 310 HA2 GLY 42 1HA GLY 42 -1.491 3.998 -0.676 311 HA3 GLY 42 2HA GLY 42 -1.555 4.224 1.067 312 H LEU 43 H LEU 43 0.341 5.284 -0.868 313 HA LEU 43 HA LEU 43 2.852 4.194 0.282 314 HB2 LEU 43 1HB LEU 43 2.757 3.538 -2.060 315 HB3 LEU 43 2HB LEU 43 2.372 5.187 -2.540 316 HG LEU 43 HG LEU 43 4.553 5.968 -1.793 317 HD11 LEU 43 1HD1 LEU 43 5.125 4.710 0.098 318 HD12 LEU 43 2HD1 LEU 43 6.223 4.058 -1.114 319 HD13 LEU 43 3HD1 LEU 43 4.758 3.172 -0.683 320 HD21 LEU 43 3HD2 LEU 43 4.830 3.411 -3.400 321 HD22 LEU 43 1HD2 LEU 43 5.963 4.763 -3.394 322 HD23 LEU 43 2HD2 LEU 43 4.344 4.971 -4.062 323 H VAL 44 H VAL 44 4.096 5.666 1.286 324 HA VAL 44 HA VAL 44 3.531 8.545 0.787 325 HB VAL 44 HB VAL 44 3.807 8.934 3.209 326 HG11 VAL 44 1HG1 VAL 44 1.665 6.992 2.308 327 HG12 VAL 44 2HG1 VAL 44 1.559 8.751 2.370 328 HG13 VAL 44 3HG1 VAL 44 1.625 7.817 3.866 329 HG21 VAL 44 3HG2 VAL 44 3.538 6.821 4.647 330 HG22 VAL 44 1HG2 VAL 44 5.125 7.083 3.930 331 HG23 VAL 44 2HG2 VAL 44 4.015 5.913 3.216 332 H ARG 45 H ARG 45 5.211 9.785 0.480 333 HA ARG 45 HA ARG 45 7.921 8.742 1.080 334 HB2 ARG 45 1HB ARG 45 7.435 9.054 -1.345 335 HB3 ARG 45 2HB ARG 45 7.102 10.757 -1.032 336 HG2 ARG 45 1HG ARG 45 9.403 11.028 -0.136 337 HG3 ARG 45 2HG ARG 45 9.730 9.335 -0.506 338 HD2 ARG 45 1HD ARG 45 8.869 11.384 -2.560 339 HD3 ARG 45 2HD ARG 45 10.544 10.927 -2.267 340 HE ARG 45 HE ARG 45 9.045 8.587 -2.739 341 HH11 ARG 45 1HH2 ARG 45 10.166 11.449 -4.326 342 HH12 ARG 45 2HH2 ARG 45 10.232 10.720 -5.894 343 HH21 ARG 45 1HH1 ARG 45 9.127 7.623 -4.792 344 HH22 ARG 45 2HH1 ARG 45 9.643 8.554 -6.159 345 H TYR 46 H TYR 46 9.167 9.934 2.364 346 HA TYR 46 HA TYR 46 8.147 12.560 3.302 347 HB2 TYR 46 1HB TYR 46 8.136 10.732 4.977 348 HB3 TYR 46 2HB TYR 46 9.871 10.531 4.748 349 HD1 TYR 46 HD2 TYR 46 7.394 13.281 5.403 350 HD2 TYR 46 HD1 TYR 46 11.269 11.637 6.248 351 HE1 TYR 46 HE2 TYR 46 7.807 15.094 7.044 352 HE2 TYR 46 HE1 TYR 46 11.685 13.449 7.882 353 HH TYR 46 HH TYR 46 10.909 15.307 8.796 354 H ARG 47 H ARG 47 9.355 14.261 2.726 355 HA ARG 47 HA ARG 47 12.050 13.820 1.640 356 HB2 ARG 47 1HB ARG 47 10.411 15.164 0.345 357 HB3 ARG 47 2HB ARG 47 10.380 16.345 1.656 358 HG2 ARG 47 1HG ARG 47 12.783 16.756 1.380 359 HG3 ARG 47 2HG ARG 47 12.867 15.523 0.122 360 HD2 ARG 47 1HD ARG 47 12.728 17.709 -0.931 361 HD3 ARG 47 2HD ARG 47 11.225 16.839 -1.220 362 HE ARG 47 HE ARG 47 11.024 18.427 1.137 363 HH11 ARG 47 1HH2 ARG 47 11.111 18.580 -2.321 364 HH12 ARG 47 2HH2 ARG 47 10.155 20.022 -2.417 365 HH21 ARG 47 1HH1 ARG 47 9.775 20.315 1.017 366 HH22 ARG 47 2HH1 ARG 47 9.399 21.004 -0.527 367 H LEU 48 H LEU 48 13.878 14.959 2.319 368 HA LEU 48 HA LEU 48 13.698 16.199 5.015 369 HB2 LEU 48 1HB LEU 48 15.666 14.219 3.899 370 HB3 LEU 48 2HB LEU 48 16.187 15.347 5.144 371 HG LEU 48 HG LEU 48 15.438 13.196 6.098 372 HD11 LEU 48 1HD1 LEU 48 14.472 14.156 7.930 373 HD12 LEU 48 2HD1 LEU 48 13.280 15.049 6.989 374 HD13 LEU 48 3HD1 LEU 48 14.937 15.643 7.106 375 HD21 LEU 48 3HD2 LEU 48 13.563 13.116 4.151 376 HD22 LEU 48 1HD2 LEU 48 12.574 13.742 5.471 377 HD23 LEU 48 2HD2 LEU 48 13.425 12.210 5.653 378 H GLU 49 H GLU 49 15.219 17.825 5.481 379 HA GLU 49 HA GLU 49 15.707 19.610 3.301 380 HB2 GLU 49 1HB GLU 49 16.724 21.037 5.039 381 HB3 GLU 49 2HB GLU 49 15.155 20.420 5.554 382 HG2 GLU 49 1HG GLU 49 16.286 18.617 6.821 383 HG3 GLU 49 2HG GLU 49 17.851 19.261 6.330 384 H ASN 50 H ASN 50 17.124 16.858 3.628 385 HA ASN 50 HA ASN 50 19.753 17.805 2.733 386 HB2 ASN 50 1HB ASN 50 19.296 15.925 5.059 387 HB3 ASN 50 2HB ASN 50 20.842 16.087 4.228 388 HD21 ASN 50 2HD2 ASN 50 19.679 16.981 7.042 389 HD22 ASN 50 1HD2 ASN 50 20.248 18.575 7.173 390 H ASP 51 H ASP 51 17.443 16.592 1.451 391 HA ASP 51 HA ASP 51 16.977 15.010 -0.138 392 HB2 ASP 51 1HB ASP 51 18.729 14.208 -1.419 393 HB3 ASP 51 2HB ASP 51 19.554 15.512 -0.580 394 H ALA 52 H ALA 52 19.217 13.610 2.230 395 HA ALA 52 HA ALA 52 18.651 11.019 2.365 396 HB1 ALA 52 3HB ALA 52 20.098 12.233 3.970 397 HB2 ALA 52 1HB ALA 52 19.032 11.080 4.771 398 HB3 ALA 52 2HB ALA 52 18.657 12.803 4.810 399 H GLN 53 H GLN 53 16.571 10.598 1.542 400 HA GLN 53 HA GLN 53 14.311 11.092 3.388 401 HB2 GLN 53 1HB GLN 53 12.883 10.750 1.398 402 HB3 GLN 53 2HB GLN 53 14.008 12.092 1.178 403 HG2 GLN 53 1HG GLN 53 15.563 10.538 -0.004 404 HG3 GLN 53 2HG GLN 53 14.344 9.270 0.124 405 HE21 GLN 53 2HE2 GLN 53 14.641 12.667 -1.075 406 HE22 GLN 53 1HE2 GLN 53 13.607 12.435 -2.402 407 H GLU 54 H GLU 54 12.519 9.303 2.694 408 HA GLU 54 HA GLU 54 13.626 6.656 2.395 409 HB2 GLU 54 1HB GLU 54 14.034 7.134 4.811 410 HB3 GLU 54 2HB GLU 54 12.298 7.365 5.023 411 HG2 GLU 54 1HG GLU 54 11.838 5.088 4.413 412 HG3 GLU 54 2HG GLU 54 13.495 4.833 3.872 413 H HIS 55 H HIS 55 11.915 5.010 2.353 414 HA HIS 55 HA HIS 55 9.224 6.122 1.740 415 HB2 HIS 55 1HB HIS 55 10.701 3.979 0.189 416 HB3 HIS 55 2HB HIS 55 9.068 4.560 -0.133 417 HD2 HIS 55 HD2 HIS 55 8.939 6.985 -1.548 418 HE1 HIS 55 HE1 HIS 55 13.104 7.633 -1.789 419 HE2 HIS 55 HE2 HIS 55 10.837 8.439 -2.598 420 H ALA 56 H ALA 56 7.482 4.683 2.065 421 HA ALA 56 HA ALA 56 7.949 2.059 3.209 422 HB1 ALA 56 3HB ALA 56 8.129 3.194 5.260 423 HB2 ALA 56 1HB ALA 56 6.421 2.757 5.197 424 HB3 ALA 56 2HB ALA 56 6.928 4.399 4.803 425 H LEU 57 H LEU 57 6.116 0.757 3.056 426 HA LEU 57 HA LEU 57 3.982 1.812 1.315 427 HB2 LEU 57 1HB LEU 57 5.290 -0.383 0.890 428 HB3 LEU 57 2HB LEU 57 4.285 -1.068 2.162 429 HG LEU 57 HG LEU 57 3.255 0.287 -0.356 430 HD11 LEU 57 1HD1 LEU 57 2.774 -1.872 -1.197 431 HD12 LEU 57 2HD1 LEU 57 2.996 -2.630 0.377 432 HD13 LEU 57 3HD1 LEU 57 4.393 -2.034 -0.519 433 HD21 LEU 57 3HD2 LEU 57 1.090 -0.931 0.505 434 HD22 LEU 57 1HD2 LEU 57 1.546 0.604 1.232 435 HD23 LEU 57 2HD2 LEU 57 1.903 -0.907 2.067 436 H PHE 58 H PHE 58 2.622 2.926 2.660 437 HA PHE 58 HA PHE 58 1.806 1.946 5.204 438 HB2 PHE 58 1HB PHE 58 1.033 4.231 3.414 439 HB3 PHE 58 2HB PHE 58 0.006 3.840 4.788 440 HD1 PHE 58 HD2 PHE 58 3.695 3.299 4.848 441 HD2 PHE 58 HD1 PHE 58 0.459 5.894 5.995 442 HE1 PHE 58 HE2 PHE 58 5.203 4.505 6.378 443 HE2 PHE 58 HE1 PHE 58 1.990 7.103 7.524 444 HZ PHE 58 HZ PHE 58 4.356 6.406 7.718 445 H LEU 59 H LEU 59 -0.002 0.937 5.832 446 HA LEU 59 HA LEU 59 -1.823 -0.092 3.728 447 HB2 LEU 59 1HB LEU 59 -0.779 -1.337 6.261 448 HB3 LEU 59 2HB LEU 59 -2.327 -1.857 5.605 449 HG LEU 59 HG LEU 59 0.069 -1.728 3.774 450 HD11 LEU 59 1HD1 LEU 59 0.956 -3.004 5.610 451 HD12 LEU 59 2HD1 LEU 59 0.477 -4.156 4.364 452 HD13 LEU 59 3HD1 LEU 59 -0.546 -3.912 5.780 453 HD21 LEU 59 3HD2 LEU 59 -1.148 -3.266 2.475 454 HD22 LEU 59 1HD2 LEU 59 -2.423 -2.241 3.130 455 HD23 LEU 59 2HD2 LEU 59 -2.107 -3.820 3.845 456 H TYR 60 H TYR 60 -3.843 0.485 3.843 457 HA TYR 60 HA TYR 60 -4.871 1.803 6.301 458 HB2 TYR 60 1HB TYR 60 -5.345 2.360 3.372 459 HB3 TYR 60 2HB TYR 60 -6.332 3.044 4.651 460 HD1 TYR 60 HD1 TYR 60 -5.404 4.692 6.220 461 HD2 TYR 60 HD2 TYR 60 -3.040 3.103 2.997 462 HE1 TYR 60 HE1 TYR 60 -3.766 6.528 6.514 463 HE2 TYR 60 HE2 TYR 60 -1.408 4.942 3.295 464 HH TYR 60 HH TYR 60 -0.729 6.585 4.724 465 H THR 61 H THR 61 -6.649 0.781 7.179 466 HA THR 61 HA THR 61 -7.865 -1.398 5.650 467 HB THR 61 HB THR 61 -7.435 -1.648 8.102 468 HG1 THR 61 HG1 THR 61 -9.016 -2.919 7.214 469 HG21 THR 61 3HG2 THR 61 -9.747 0.271 8.435 470 HG22 THR 61 1HG2 THR 61 -8.062 0.764 8.613 471 HG23 THR 61 2HG2 THR 61 -8.748 -0.445 9.700 472 H HIS 62 H HIS 62 -10.226 -1.484 5.398 473 HA HIS 62 HA HIS 62 -11.800 0.844 5.717 474 HB2 HIS 62 1HB HIS 62 -11.671 1.927 3.691 475 HB3 HIS 62 2HB HIS 62 -10.085 1.177 3.624 476 HD2 HIS 62 HD2 HIS 62 -10.063 -1.312 2.050 477 HE1 HIS 62 HE1 HIS 62 -13.599 -0.325 -0.035 478 HE2 HIS 62 HE2 HIS 62 -11.604 -1.896 0.024 479 H ARG 63 H ARG 63 -13.955 0.419 5.384 480 HA ARG 63 HA ARG 63 -14.787 -2.264 5.402 481 HB2 ARG 63 1HB ARG 63 -16.459 0.126 4.588 482 HB3 ARG 63 2HB ARG 63 -17.036 -1.408 5.240 483 HG2 ARG 63 1HG ARG 63 -15.771 -0.966 7.329 484 HG3 ARG 63 2HG ARG 63 -15.292 0.598 6.674 485 HD2 ARG 63 1HD ARG 63 -17.662 1.252 6.498 486 HD3 ARG 63 2HD ARG 63 -18.143 -0.300 7.175 487 HE ARG 63 HE ARG 63 -16.937 1.938 8.614 488 HH11 ARG 63 1HH2 ARG 63 -17.868 -1.395 8.579 489 HH12 ARG 63 2HH2 ARG 63 -17.875 -1.547 10.304 490 HH21 ARG 63 1HH1 ARG 63 -16.937 1.742 10.867 491 HH22 ARG 63 2HH1 ARG 63 -17.347 0.228 11.602 492 H ARG 64 H ARG 64 -16.949 -2.238 3.605 493 HA ARG 64 HA ARG 64 -15.719 -3.279 1.272 494 HB2 ARG 64 1HB ARG 64 -18.583 -2.518 1.883 495 HB3 ARG 64 2HB ARG 64 -18.076 -3.349 0.412 496 HG2 ARG 64 1HG ARG 64 -17.143 -5.184 1.742 497 HG3 ARG 64 2HG ARG 64 -17.594 -4.348 3.229 498 HD2 ARG 64 1HD ARG 64 -19.965 -4.458 2.591 499 HD3 ARG 64 2HD ARG 64 -19.534 -5.257 1.081 500 HE ARG 64 HE ARG 64 -18.565 -6.659 3.408 501 HH11 ARG 64 1HH2 ARG 64 -21.269 -6.072 1.327 502 HH12 ARG 64 2HH2 ARG 64 -22.025 -7.596 1.652 503 HH21 ARG 64 1HH1 ARG 64 -19.554 -8.662 3.836 504 HH22 ARG 64 2HH1 ARG 64 -21.055 -9.061 3.070 505 H MET 65 H MET 65 -17.212 -0.137 2.051 506 HA MET 65 HA MET 65 -16.137 0.918 -0.500 507 HB2 MET 65 1HB MET 65 -18.364 2.315 -0.514 508 HB3 MET 65 2HB MET 65 -18.371 0.666 -1.138 509 HG2 MET 65 1HG MET 65 -19.238 -0.191 0.965 510 HG3 MET 65 2HG MET 65 -19.104 1.403 1.709 511 HE1 MET 65 3HE MET 65 -22.072 -0.308 1.547 512 HE2 MET 65 1HE MET 65 -22.810 1.295 1.672 513 HE3 MET 65 2HE MET 65 -21.303 0.946 2.516 514 H ALA 66 H ALA 66 -15.269 1.088 2.322 515 HA ALA 66 HA ALA 66 -15.910 3.782 3.198 516 HB1 ALA 66 3HB ALA 66 -15.436 2.194 4.922 517 HB2 ALA 66 1HB ALA 66 -14.090 3.330 4.889 518 HB3 ALA 66 2HB ALA 66 -13.919 1.736 4.159 519 H ILE 67 H ILE 67 -14.720 3.374 0.544 520 HA ILE 67 HA ILE 67 -12.004 4.121 0.425 521 HB ILE 67 HB ILE 67 -14.309 4.489 -1.501 522 HG12 ILE 67 1HG1 ILE 67 -12.008 2.517 -1.546 523 HG13 ILE 67 2HG1 ILE 67 -13.571 2.156 -0.816 524 HG21 ILE 67 1HG2 ILE 67 -12.678 6.086 -2.180 525 HG22 ILE 67 2HG2 ILE 67 -12.413 4.675 -3.204 526 HG23 ILE 67 3HG2 ILE 67 -11.346 4.984 -1.833 527 HD11 ILE 67 3HD1 ILE 67 -13.006 2.814 -3.718 528 HD12 ILE 67 1HD1 ILE 67 -14.634 2.764 -3.042 529 HD13 ILE 67 2HD1 ILE 67 -13.644 1.306 -3.063 530 H THR 68 H THR 68 -14.950 6.008 0.357 531 HA THR 68 HA THR 68 -14.365 8.477 -0.358 532 HB THR 68 HB THR 68 -15.754 7.944 2.263 533 HG1 THR 68 HG1 THR 68 -17.104 8.273 -0.135 534 HG21 THR 68 3HG2 THR 68 -15.355 10.296 1.959 535 HG22 THR 68 1HG2 THR 68 -17.038 9.995 1.521 536 HG23 THR 68 2HG2 THR 68 -15.822 10.211 0.260 537 H GLY 69 H GLY 69 -12.923 7.086 2.571 538 HA2 GLY 69 1HA GLY 69 -10.801 7.975 3.353 539 HA3 GLY 69 2HA GLY 69 -11.324 9.576 2.847 540 H ASP 70 H ASP 70 -14.060 8.617 3.856 541 HA ASP 70 HA ASP 70 -14.075 10.066 6.256 542 HB2 ASP 70 1HB ASP 70 -16.030 8.160 4.992 543 HB3 ASP 70 2HB ASP 70 -16.383 8.988 6.507 544 H ASP 71 H ASP 71 -14.297 6.528 5.748 545 HA ASP 71 HA ASP 71 -13.838 6.148 8.669 546 HB2 ASP 71 1HB ASP 71 -16.054 5.619 7.683 547 HB3 ASP 71 2HB ASP 71 -15.319 4.403 6.683 548 H VAL 72 H VAL 72 -11.544 6.395 7.075 549 HA VAL 72 HA VAL 72 -10.342 3.728 7.346 550 HB VAL 72 HB VAL 72 -10.851 3.646 5.037 551 HG11 VAL 72 1HG1 VAL 72 -11.585 5.829 4.528 552 HG12 VAL 72 2HG1 VAL 72 -10.134 5.641 3.545 553 HG13 VAL 72 3HG1 VAL 72 -10.069 6.560 5.050 554 HG21 VAL 72 3HG2 VAL 72 -8.276 3.488 5.819 555 HG22 VAL 72 1HG2 VAL 72 -8.120 4.866 4.731 556 HG23 VAL 72 2HG2 VAL 72 -8.737 3.330 4.124 557 H SER 73 H SER 73 -8.383 3.823 8.292 558 HA SER 73 HA SER 73 -6.700 6.186 7.993 559 HB2 SER 73 1HB SER 73 -7.730 5.185 10.664 560 HB3 SER 73 2HB SER 73 -6.451 6.379 10.461 561 HG SER 73 HG SER 73 -8.142 7.673 10.533 562 H LEU 74 H LEU 74 -4.557 5.720 9.123 563 HA LEU 74 HA LEU 74 -3.311 3.588 8.053 564 HB2 LEU 74 1HB LEU 74 -2.743 5.258 10.453 565 HB3 LEU 74 2HB LEU 74 -1.774 3.796 10.271 566 HG LEU 74 HG LEU 74 -2.152 5.814 8.052 567 HD11 LEU 74 1HD1 LEU 74 0.210 5.565 9.934 568 HD12 LEU 74 2HD1 LEU 74 -1.038 6.798 10.085 569 HD13 LEU 74 3HD1 LEU 74 -0.011 6.757 8.656 570 HD21 LEU 74 3HD2 LEU 74 0.304 4.276 7.956 571 HD22 LEU 74 1HD2 LEU 74 -1.029 4.300 6.808 572 HD23 LEU 74 2HD2 LEU 74 -1.044 3.164 8.149 573 H ASP 75 H ASP 75 -2.895 1.546 8.362 574 HA ASP 75 HA ASP 75 -4.264 0.097 10.548 575 HB2 ASP 75 1HB ASP 75 -4.988 -0.510 8.263 576 HB3 ASP 75 2HB ASP 75 -3.323 -0.904 7.844 577 H GLN 76 H GLN 76 -1.340 -0.310 8.454 578 HA GLN 76 HA GLN 76 0.368 -0.507 10.759 579 HB2 GLN 76 1HB GLN 76 -0.720 -2.822 10.529 580 HB3 GLN 76 2HB GLN 76 0.200 -2.979 9.031 581 HG2 GLN 76 1HG GLN 76 2.256 -2.292 10.470 582 HG3 GLN 76 2HG GLN 76 1.237 -2.688 11.850 583 HE21 GLN 76 2HE2 GLN 76 3.549 -4.009 9.880 584 HE22 GLN 76 1HE2 GLN 76 3.122 -5.645 10.004 585 H ILE 77 H ILE 77 2.240 0.349 10.201 586 HA ILE 77 HA ILE 77 2.880 0.860 7.417 587 HB ILE 77 HB ILE 77 4.284 1.590 9.994 588 HG12 ILE 77 1HG1 ILE 77 2.787 3.329 8.019 589 HG13 ILE 77 2HG1 ILE 77 2.037 2.643 9.460 590 HG21 ILE 77 1HG2 ILE 77 4.888 2.292 7.109 591 HG22 ILE 77 2HG2 ILE 77 5.959 1.493 8.261 592 HG23 ILE 77 3HG2 ILE 77 5.537 3.187 8.482 593 HD11 ILE 77 3HD1 ILE 77 3.642 3.797 10.896 594 HD12 ILE 77 1HD1 ILE 77 2.859 4.967 9.833 595 HD13 ILE 77 2HD1 ILE 77 4.497 4.413 9.483 596 H VAL 78 H VAL 78 4.570 -0.005 6.260 597 HA VAL 78 HA VAL 78 6.241 -2.056 7.581 598 HB VAL 78 HB VAL 78 5.111 -2.424 4.805 599 HG11 VAL 78 1HG1 VAL 78 5.858 -4.689 5.094 600 HG12 VAL 78 2HG1 VAL 78 6.161 -4.435 6.813 601 HG13 VAL 78 3HG1 VAL 78 7.194 -3.659 5.612 602 HG21 VAL 78 3HG2 VAL 78 4.036 -3.392 7.472 603 HG22 VAL 78 1HG2 VAL 78 3.512 -4.014 5.909 604 HG23 VAL 78 2HG2 VAL 78 3.213 -2.328 6.332 605 HA PRO 79 HA PRO 79 9.018 0.722 5.277 606 HB2 PRO 79 1HB PRO 79 11.318 0.187 6.594 607 HB3 PRO 79 2HB PRO 79 10.030 1.178 7.316 608 HG2 PRO 79 1HG PRO 79 10.693 -1.698 7.782 609 HG3 PRO 79 2HG PRO 79 10.228 -0.446 8.951 610 HD2 PRO 79 1HD PRO 79 8.471 -2.329 7.937 611 HD3 PRO 79 2HD PRO 79 7.964 -0.746 8.561 612 H LEU 80 H LEU 80 10.322 0.492 3.534 613 HA LEU 80 HA LEU 80 10.616 -2.131 2.457 614 HB2 LEU 80 1HB LEU 80 11.568 0.572 1.496 615 HB3 LEU 80 2HB LEU 80 11.623 -0.915 0.547 616 HG LEU 80 HG LEU 80 9.088 0.287 1.707 617 HD11 LEU 80 1HD1 LEU 80 9.887 0.244 -1.205 618 HD12 LEU 80 2HD1 LEU 80 10.300 1.601 -0.157 619 HD13 LEU 80 3HD1 LEU 80 8.610 1.184 -0.437 620 HD21 LEU 80 3HD2 LEU 80 9.710 -2.158 0.060 621 HD22 LEU 80 1HD2 LEU 80 8.174 -1.328 -0.193 622 HD23 LEU 80 2HD2 LEU 80 8.576 -1.970 1.396 623 H SER 81 H SER 81 12.309 -3.323 2.287 624 HA SER 81 HA SER 81 14.994 -2.840 2.202 625 HB2 SER 81 1HB SER 81 15.228 -1.757 4.255 626 HB3 SER 81 2HB SER 81 13.937 -2.689 5.007 627 HG SER 81 HG SER 81 16.566 -3.143 5.016 628 H LYS 82 H LYS 82 16.247 -4.912 3.525 629 HA LYS 82 HA LYS 82 15.565 -7.188 2.240 630 HB2 LYS 82 1HB LYS 82 16.712 -8.344 4.190 631 HB3 LYS 82 2HB LYS 82 17.623 -7.040 3.431 632 HG2 LYS 82 1HG LYS 82 17.219 -5.538 5.200 633 HG3 LYS 82 2HG LYS 82 15.841 -6.462 5.800 634 HD2 LYS 82 1HD LYS 82 17.358 -8.292 6.449 635 HD3 LYS 82 2HD LYS 82 18.737 -7.348 5.886 636 HE2 LYS 82 1HE LYS 82 16.813 -6.373 8.012 637 HE3 LYS 82 2HE LYS 82 18.310 -7.223 8.384 638 HZ1 LYS 82 3HZ LYS 82 18.737 -4.902 8.478 639 HZ2 LYS 82 1HZ LYS 82 18.025 -4.637 6.961 640 HZ3 LYS 82 2HZ LYS 82 19.487 -5.496 7.073 641 H ASP 83 H ASP 83 13.650 -5.685 4.550 642 HA ASP 83 HA ASP 83 12.404 -8.092 5.616 643 HB2 ASP 83 1HB ASP 83 11.832 -5.139 5.934 644 HB3 ASP 83 2HB ASP 83 10.828 -6.398 6.654 645 H PHE 84 H PHE 84 11.348 -5.282 3.692 646 HA PHE 84 HA PHE 84 8.938 -6.593 2.788 647 HB2 PHE 84 1HB PHE 84 9.382 -4.030 3.080 648 HB3 PHE 84 2HB PHE 84 10.105 -4.147 1.478 649 HD1 PHE 84 HD1 PHE 84 8.660 -5.289 -0.388 650 HD2 PHE 84 HD2 PHE 84 7.047 -3.767 3.290 651 HE1 PHE 84 HE1 PHE 84 6.407 -5.174 -1.418 652 HE2 PHE 84 HE2 PHE 84 4.797 -3.652 2.256 653 HZ PHE 84 HZ PHE 84 4.481 -4.353 -0.100 654 H MET 85 H MET 85 8.510 -7.430 0.790 655 HA MET 85 HA MET 85 10.391 -7.346 -1.383 656 HB2 MET 85 1HB MET 85 11.449 -9.063 0.097 657 HB3 MET 85 2HB MET 85 9.978 -10.027 -0.042 658 HG2 MET 85 1HG MET 85 10.254 -10.159 -2.470 659 HG3 MET 85 2HG MET 85 11.683 -9.130 -2.385 660 HE1 MET 85 3HE MET 85 11.757 -11.377 -3.915 661 HE2 MET 85 1HE MET 85 12.735 -12.750 -3.383 662 HE3 MET 85 2HE MET 85 13.462 -11.154 -3.535 663 H LEU 86 H LEU 86 9.025 -7.139 -3.076 664 HA LEU 86 HA LEU 86 6.368 -8.369 -2.948 665 HB2 LEU 86 1HB LEU 86 6.211 -7.069 -5.217 666 HB3 LEU 86 2HB LEU 86 6.186 -6.160 -3.708 667 HG LEU 86 HG LEU 86 8.880 -6.699 -4.926 668 HD11 LEU 86 1HD1 LEU 86 6.918 -4.661 -6.018 669 HD12 LEU 86 2HD1 LEU 86 7.632 -6.012 -6.897 670 HD13 LEU 86 3HD1 LEU 86 8.646 -4.670 -6.367 671 HD21 LEU 86 3HD2 LEU 86 8.325 -5.395 -2.739 672 HD22 LEU 86 1HD2 LEU 86 7.806 -4.101 -3.816 673 HD23 LEU 86 2HD2 LEU 86 9.472 -4.674 -3.864 674 H GLU 87 H GLU 87 5.682 -9.965 -4.399 675 HA GLU 87 HA GLU 87 7.686 -10.981 -6.330 676 HB2 GLU 87 1HB GLU 87 6.080 -12.624 -4.359 677 HB3 GLU 87 2HB GLU 87 7.015 -13.289 -5.695 678 HG2 GLU 87 1HG GLU 87 9.070 -12.325 -4.783 679 HG3 GLU 87 2HG GLU 87 8.158 -11.576 -3.473 680 H GLU 88 H GLU 88 6.892 -11.551 -8.229 681 HA GLU 88 HA GLU 88 4.157 -10.937 -8.890 682 HB2 GLU 88 1HB GLU 88 6.418 -12.148 -10.506 683 HB3 GLU 88 2HB GLU 88 4.830 -11.764 -11.172 684 HG2 GLU 88 1HG GLU 88 6.608 -9.739 -9.783 685 HG3 GLU 88 2HG GLU 88 6.563 -9.966 -11.530 686 H VAL 89 H VAL 89 2.480 -12.356 -9.250 687 HA VAL 89 HA VAL 89 3.038 -15.255 -9.092 688 HB VAL 89 HB VAL 89 0.830 -13.908 -7.552 689 HG11 VAL 89 1HG1 VAL 89 0.243 -16.152 -8.138 690 HG12 VAL 89 2HG1 VAL 89 0.769 -16.190 -6.455 691 HG13 VAL 89 3HG1 VAL 89 1.855 -16.742 -7.730 692 HG21 VAL 89 3HG2 VAL 89 2.248 -14.673 -5.555 693 HG22 VAL 89 1HG2 VAL 89 2.856 -13.278 -6.446 694 HG23 VAL 89 2HG2 VAL 89 3.570 -14.869 -6.706 695 H SER 90 H SER 90 1.697 -16.509 -10.277 696 HA SER 90 HA SER 90 0.423 -15.423 -12.514 697 HB2 SER 90 1HB SER 90 -0.085 -17.620 -13.097 698 HB3 SER 90 2HB SER 90 1.268 -17.846 -11.994 699 HG SER 90 HG SER 90 -1.505 -18.091 -11.461 700 HA PRO 91 HA PRO 91 -3.529 -14.250 -10.803 701 HB2 PRO 91 1HB PRO 91 -5.095 -14.272 -13.047 702 HB3 PRO 91 2HB PRO 91 -3.880 -13.020 -12.730 703 HG2 PRO 91 1HG PRO 91 -3.703 -15.422 -14.497 704 HG3 PRO 91 2HG PRO 91 -3.122 -13.770 -14.778 705 HD2 PRO 91 1HD PRO 91 -1.468 -15.812 -13.984 706 HD3 PRO 91 2HD PRO 91 -1.170 -14.106 -13.575 707 H ASP 92 H ASP 92 -2.772 -17.274 -11.471 708 HA ASP 92 HA ASP 92 -3.744 -19.340 -11.142 709 HB2 ASP 92 1HB ASP 92 -5.789 -17.615 -9.717 710 HB3 ASP 92 2HB ASP 92 -5.860 -19.372 -9.750 711 H GLY 93 H GLY 93 -4.324 -17.632 -13.509 712 HA2 GLY 93 1HA GLY 93 -6.889 -18.856 -14.395 713 HA3 GLY 93 2HA GLY 93 -6.301 -17.296 -14.967 714 H GLU 94 H GLU 94 -6.810 -18.735 -17.022 715 HA GLU 94 HA GLU 94 -4.202 -19.613 -18.019 716 HB2 GLU 94 1HB GLU 94 -5.135 -21.666 -18.980 717 HB3 GLU 94 2HB GLU 94 -5.280 -21.678 -17.223 718 HG2 GLU 94 1HG GLU 94 -7.626 -20.878 -17.438 719 HG3 GLU 94 2HG GLU 94 -7.474 -20.971 -19.193 720 H LEU 95 H LEU 95 -7.331 -18.251 -18.444 721 HA LEU 95 HA LEU 95 -6.628 -17.489 -21.207 722 HB2 LEU 95 1HB LEU 95 -8.240 -19.378 -21.341 723 HB3 LEU 95 2HB LEU 95 -9.375 -18.458 -20.355 724 HG LEU 95 HG LEU 95 -9.385 -16.664 -22.094 725 HD11 LEU 95 1HD1 LEU 95 -7.424 -18.545 -23.388 726 HD12 LEU 95 2HD1 LEU 95 -7.372 -16.787 -23.272 727 HD13 LEU 95 3HD1 LEU 95 -8.475 -17.558 -24.407 728 HD21 LEU 95 3HD2 LEU 95 -10.092 -19.481 -22.966 729 HD22 LEU 95 1HD2 LEU 95 -10.611 -18.034 -23.832 730 HD23 LEU 95 2HD2 LEU 95 -11.149 -18.312 -22.174 731 H TYR 96 H TYR 96 -6.000 -15.527 -20.050 732 HA TYR 96 HA TYR 96 -8.076 -13.582 -20.135 733 HB2 TYR 96 1HB TYR 96 -8.056 -14.883 -17.729 734 HB3 TYR 96 2HB TYR 96 -6.936 -13.565 -17.385 735 HD1 TYR 96 HD2 TYR 96 -10.345 -14.287 -18.754 736 HD2 TYR 96 HD1 TYR 96 -7.729 -11.404 -16.939 737 HE1 TYR 96 HE2 TYR 96 -12.253 -12.725 -18.482 738 HE2 TYR 96 HE1 TYR 96 -9.634 -9.844 -16.668 739 HH TYR 96 HH TYR 96 -12.567 -10.527 -16.578 740 H ILE 97 H ILE 97 -7.291 -11.408 -19.773 741 HA ILE 97 HA ILE 97 -4.339 -11.145 -19.929 742 HB ILE 97 HB ILE 97 -4.912 -9.044 -21.260 743 HG12 ILE 97 1HG1 ILE 97 -7.516 -10.435 -21.864 744 HG13 ILE 97 2HG1 ILE 97 -7.420 -9.321 -20.503 745 HG21 ILE 97 1HG2 ILE 97 -5.334 -11.851 -22.259 746 HG22 ILE 97 2HG2 ILE 97 -3.944 -10.795 -22.486 747 HG23 ILE 97 3HG2 ILE 97 -5.443 -10.476 -23.355 748 HD11 ILE 97 3HD1 ILE 97 -8.145 -8.279 -22.702 749 HD12 ILE 97 1HD1 ILE 97 -6.511 -8.582 -23.291 750 HD13 ILE 97 2HD1 ILE 97 -6.767 -7.507 -21.918 751 H LEU 98 H LEU 98 -5.568 -11.120 -17.459 752 HA LEU 98 HA LEU 98 -5.757 -9.874 -15.523 753 HB2 LEU 98 1HB LEU 98 -4.075 -8.040 -17.236 754 HB3 LEU 98 2HB LEU 98 -4.593 -7.571 -15.624 755 HG LEU 98 HG LEU 98 -3.467 -9.447 -14.625 756 HD11 LEU 98 1HD1 LEU 98 -3.859 -11.206 -16.194 757 HD12 LEU 98 2HD1 LEU 98 -2.111 -10.978 -16.164 758 HD13 LEU 98 3HD1 LEU 98 -3.063 -10.320 -17.494 759 HD21 LEU 98 3HD2 LEU 98 -1.108 -9.031 -15.445 760 HD22 LEU 98 1HD2 LEU 98 -2.010 -7.566 -15.053 761 HD23 LEU 98 2HD2 LEU 98 -1.797 -8.048 -16.736 762 H GLY 99 H GLY 99 -5.964 -7.355 -18.022 763 HA2 GLY 99 1HA GLY 99 -7.688 -5.967 -18.668 764 HA3 GLY 99 2HA GLY 99 -8.807 -7.042 -17.832 765 H SER 100 H SER 100 -8.729 -6.924 -15.424 766 HA SER 100 HA SER 100 -7.833 -4.409 -14.268 767 HB2 SER 100 1HB SER 100 -9.952 -3.666 -15.098 768 HB3 SER 100 2HB SER 100 -10.761 -5.127 -14.534 769 HG SER 100 HG SER 100 -11.023 -4.133 -12.713 770 H ASP 101 H ASP 101 -6.996 -6.995 -13.867 771 HA ASP 101 HA ASP 101 -7.646 -7.387 -11.032 772 HB2 ASP 101 1HB ASP 101 -7.945 -9.493 -13.177 773 HB3 ASP 101 2HB ASP 101 -7.690 -9.913 -11.486 774 H VAL 102 H VAL 102 -5.446 -6.297 -11.190 775 HA VAL 102 HA VAL 102 -3.222 -7.779 -12.174 776 HB VAL 102 HB VAL 102 -3.430 -5.222 -11.579 777 HG11 VAL 102 1HG1 VAL 102 -2.146 -6.179 -9.025 778 HG12 VAL 102 2HG1 VAL 102 -3.872 -5.842 -9.112 779 HG13 VAL 102 3HG1 VAL 102 -2.705 -4.562 -9.433 780 HG21 VAL 102 3HG2 VAL 102 -0.928 -6.824 -10.980 781 HG22 VAL 102 1HG2 VAL 102 -0.971 -5.101 -11.350 782 HG23 VAL 102 2HG2 VAL 102 -1.440 -6.277 -12.577 783 H THR 103 H THR 103 -1.816 -9.100 -11.127 784 HA THR 103 HA THR 103 -2.668 -10.036 -8.424 785 HB THR 103 HB THR 103 -0.984 -11.660 -10.327 786 HG1 THR 103 HG1 THR 103 -2.805 -11.239 -11.490 787 HG21 THR 103 3HG2 THR 103 -1.152 -12.393 -7.984 788 HG22 THR 103 1HG2 THR 103 -2.009 -13.513 -9.043 789 HG23 THR 103 2HG2 THR 103 -2.914 -12.337 -8.086 790 H VAL 104 H VAL 104 -1.448 -9.204 -6.917 791 HA VAL 104 HA VAL 104 1.497 -9.296 -7.217 792 HB VAL 104 HB VAL 104 0.469 -6.946 -7.484 793 HG11 VAL 104 1HG1 VAL 104 -0.293 -5.815 -5.528 794 HG12 VAL 104 2HG1 VAL 104 0.175 -7.153 -4.482 795 HG13 VAL 104 3HG1 VAL 104 -1.185 -7.334 -5.588 796 HG21 VAL 104 3HG2 VAL 104 2.439 -7.441 -5.227 797 HG22 VAL 104 1HG2 VAL 104 2.251 -5.932 -6.122 798 HG23 VAL 104 2HG2 VAL 104 2.850 -7.375 -6.941 799 H GLN 105 H GLN 105 2.549 -10.103 -5.456 800 HA GLN 105 HA GLN 105 0.925 -10.676 -3.028 801 HB2 GLN 105 1HB GLN 105 1.508 -12.647 -4.633 802 HB3 GLN 105 2HB GLN 105 3.144 -12.476 -4.004 803 HG2 GLN 105 1HG GLN 105 0.692 -12.845 -2.253 804 HG3 GLN 105 2HG GLN 105 1.748 -14.160 -2.760 805 HE21 GLN 105 2HE2 GLN 105 1.288 -11.815 -0.334 806 HE22 GLN 105 1HE2 GLN 105 2.829 -11.904 0.374 807 H LEU 106 H LEU 106 1.723 -9.518 -1.328 808 HA LEU 106 HA LEU 106 4.425 -8.511 -1.390 809 HB2 LEU 106 1HB LEU 106 2.416 -8.386 0.865 810 HB3 LEU 106 2HB LEU 106 3.789 -7.315 0.586 811 HG LEU 106 HG LEU 106 1.341 -7.585 -1.179 812 HD11 LEU 106 1HD1 LEU 106 2.288 -5.141 0.321 813 HD12 LEU 106 2HD1 LEU 106 1.211 -6.322 1.069 814 HD13 LEU 106 3HD1 LEU 106 0.699 -5.450 -0.378 815 HD21 LEU 106 3HD2 LEU 106 2.497 -5.480 -2.236 816 HD22 LEU 106 1HD2 LEU 106 3.069 -7.084 -2.688 817 HD23 LEU 106 2HD2 LEU 106 3.963 -6.128 -1.506 818 H ASN 107 H ASN 107 6.006 -9.792 -0.862 819 HA ASN 107 HA ASN 107 5.656 -11.904 1.198 820 HB2 ASN 107 1HB ASN 107 8.071 -11.631 -0.568 821 HB3 ASN 107 2HB ASN 107 7.451 -13.063 0.253 822 HD21 ASN 107 2HD2 ASN 107 6.095 -10.612 -1.991 823 HD22 ASN 107 1HD2 ASN 107 5.362 -11.742 -3.014 824 H THR 108 H THR 108 5.758 -9.808 2.700 825 HA THR 108 HA THR 108 8.395 -8.814 3.206 826 HB THR 108 HB THR 108 6.006 -8.777 5.047 827 HG1 THR 108 HG1 THR 108 6.777 -7.117 2.903 828 HG21 THR 108 3HG2 THR 108 8.648 -7.347 4.981 829 HG22 THR 108 1HG2 THR 108 7.774 -8.016 6.358 830 HG23 THR 108 2HG2 THR 108 7.236 -6.510 5.620 831 H ALA 109 H ALA 109 9.219 -8.997 5.569 832 HA ALA 109 HA ALA 109 10.127 -11.606 5.980 833 HB1 ALA 109 3HB ALA 109 10.830 -10.740 8.237 834 HB2 ALA 109 1HB ALA 109 9.989 -9.241 7.848 835 HB3 ALA 109 2HB ALA 109 11.359 -9.763 6.869 836 H GLU 110 H GLU 110 7.410 -9.903 7.564 837 HA GLU 110 HA GLU 110 6.526 -12.517 8.671 838 HB2 GLU 110 1HB GLU 110 5.867 -11.452 10.715 839 HB3 GLU 110 2HB GLU 110 7.537 -10.979 10.406 840 HG2 GLU 110 1HG GLU 110 6.615 -8.891 9.283 841 HG3 GLU 110 2HG GLU 110 5.035 -9.335 9.924 842 H LEU 111 H LEU 111 5.820 -10.892 6.256 843 HA LEU 111 HA LEU 111 2.920 -10.918 6.706 844 HB2 LEU 111 1HB LEU 111 4.334 -8.511 6.596 845 HB3 LEU 111 2HB LEU 111 3.716 -8.684 4.958 846 HG LEU 111 HG LEU 111 2.085 -8.754 7.515 847 HD11 LEU 111 1HD1 LEU 111 3.007 -6.531 6.618 848 HD12 LEU 111 2HD1 LEU 111 1.264 -6.621 6.854 849 HD13 LEU 111 3HD1 LEU 111 1.943 -6.777 5.234 850 HD21 LEU 111 3HD2 LEU 111 1.435 -9.424 4.657 851 HD22 LEU 111 1HD2 LEU 111 0.213 -8.580 5.610 852 HD23 LEU 111 2HD2 LEU 111 0.822 -10.141 6.146 853 H LYS 112 H LYS 112 1.874 -11.884 5.159 854 HA LYS 112 HA LYS 112 2.924 -12.026 2.444 855 HB2 LYS 112 1HB LYS 112 3.895 -13.991 3.733 856 HB3 LYS 112 2HB LYS 112 2.241 -14.597 3.847 857 HG2 LYS 112 1HG LYS 112 2.035 -14.607 1.412 858 HG3 LYS 112 2HG LYS 112 3.639 -13.892 1.248 859 HD2 LYS 112 1HD LYS 112 4.628 -15.876 2.339 860 HD3 LYS 112 2HD LYS 112 3.024 -16.596 2.466 861 HE2 LYS 112 1HE LYS 112 2.794 -16.556 0.018 862 HE3 LYS 112 2HE LYS 112 4.385 -15.805 -0.126 863 HZ1 LYS 112 3HZ LYS 112 5.448 -17.714 0.527 864 HZ2 LYS 112 1HZ LYS 112 4.142 -18.362 -0.342 865 HZ3 LYS 112 2HZ LYS 112 4.098 -18.328 1.357 866 H LEU 113 H LEU 113 1.202 -11.030 1.581 867 HA LEU 113 HA LEU 113 -1.418 -12.386 1.868 868 HB2 LEU 113 1HB LEU 113 -0.688 -9.559 2.388 869 HB3 LEU 113 2HB LEU 113 -2.134 -9.765 1.415 870 HG LEU 113 HG LEU 113 -2.709 -9.619 3.789 871 HD11 LEU 113 1HD1 LEU 113 -3.717 -11.448 2.053 872 HD12 LEU 113 2HD1 LEU 113 -4.338 -11.205 3.680 873 HD13 LEU 113 3HD1 LEU 113 -3.211 -12.519 3.357 874 HD21 LEU 113 3HD2 LEU 113 -1.689 -10.773 5.473 875 HD22 LEU 113 1HD2 LEU 113 -0.367 -10.899 4.320 876 HD23 LEU 113 2HD2 LEU 113 -1.495 -12.238 4.515 877 H VAL 114 H VAL 114 -2.927 -11.897 0.102 878 HA VAL 114 HA VAL 114 -1.525 -11.540 -2.494 879 HB VAL 114 HB VAL 114 -4.030 -13.141 -1.905 880 HG11 VAL 114 1HG1 VAL 114 -3.635 -13.994 -4.209 881 HG12 VAL 114 2HG1 VAL 114 -2.304 -12.849 -4.381 882 HG13 VAL 114 3HG1 VAL 114 -3.952 -12.260 -4.183 883 HG21 VAL 114 3HG2 VAL 114 -1.918 -14.096 -0.923 884 HG22 VAL 114 1HG2 VAL 114 -1.236 -14.130 -2.549 885 HG23 VAL 114 2HG2 VAL 114 -2.645 -15.116 -2.164 886 H PHE 115 H PHE 115 -1.972 -9.521 -3.180 887 HA PHE 115 HA PHE 115 -4.648 -8.374 -2.731 888 HB2 PHE 115 1HB PHE 115 -1.976 -7.133 -3.378 889 HB3 PHE 115 2HB PHE 115 -3.490 -6.238 -3.508 890 HD1 PHE 115 HD1 PHE 115 -4.931 -5.914 -1.509 891 HD2 PHE 115 HD2 PHE 115 -0.999 -7.616 -1.231 892 HE1 PHE 115 HE1 PHE 115 -4.900 -5.462 0.919 893 HE2 PHE 115 HE2 PHE 115 -0.974 -7.151 1.211 894 HZ PHE 115 HZ PHE 115 -2.929 -6.075 2.283 895 H GLN 116 H GLN 116 -6.021 -8.147 -4.329 896 HA GLN 116 HA GLN 116 -5.121 -8.480 -7.127 897 HB2 GLN 116 1HB GLN 116 -6.685 -10.230 -6.171 898 HB3 GLN 116 2HB GLN 116 -7.897 -8.958 -6.034 899 HG2 GLN 116 1HG GLN 116 -8.348 -9.961 -8.128 900 HG3 GLN 116 2HG GLN 116 -7.442 -8.507 -8.532 901 HE21 GLN 116 2HE2 GLN 116 -5.696 -8.815 -9.866 902 HE22 GLN 116 1HE2 GLN 116 -4.904 -10.300 -10.123 903 H LEU 117 H LEU 117 -4.707 -6.236 -7.505 904 HA LEU 117 HA LEU 117 -6.969 -4.401 -7.111 905 HB2 LEU 117 1HB LEU 117 -4.228 -3.544 -8.008 906 HB3 LEU 117 2HB LEU 117 -5.418 -2.660 -7.056 907 HG LEU 117 HG LEU 117 -4.939 -4.797 -5.393 908 HD11 LEU 117 1HD1 LEU 117 -2.315 -4.194 -6.778 909 HD12 LEU 117 2HD1 LEU 117 -3.188 -5.722 -6.845 910 HD13 LEU 117 3HD1 LEU 117 -2.506 -5.166 -5.321 911 HD21 LEU 117 3HD2 LEU 117 -4.856 -2.364 -4.811 912 HD22 LEU 117 1HD2 LEU 117 -3.224 -2.300 -5.476 913 HD23 LEU 117 2HD2 LEU 117 -3.561 -3.300 -4.063 914 HA PRO 118 HA PRO 118 -7.674 -4.087 -11.482 915 HB2 PRO 118 1HB PRO 118 -7.655 -1.143 -11.571 916 HB3 PRO 118 2HB PRO 118 -9.032 -2.254 -11.692 917 HG2 PRO 118 1HG PRO 118 -8.630 -0.671 -9.549 918 HG3 PRO 118 2HG PRO 118 -9.380 -2.274 -9.432 919 HD2 PRO 118 1HD PRO 118 -6.539 -1.483 -8.828 920 HD3 PRO 118 2HD PRO 118 -7.648 -2.504 -7.887 921 H PHE 119 H PHE 119 -6.385 -4.352 -13.222 922 HA PHE 119 HA PHE 119 -3.690 -3.761 -13.298 923 HB2 PHE 119 1HB PHE 119 -4.724 -5.547 -14.559 924 HB3 PHE 119 2HB PHE 119 -5.636 -4.386 -15.516 925 HD1 PHE 119 HD1 PHE 119 -2.123 -5.258 -14.561 926 HD2 PHE 119 HD2 PHE 119 -4.728 -3.589 -17.539 927 HE1 PHE 119 HE1 PHE 119 -0.212 -5.070 -16.125 928 HE2 PHE 119 HE2 PHE 119 -2.814 -3.400 -19.106 929 HZ PHE 119 HZ PHE 119 -0.555 -4.141 -18.398 930 H GLY 120 H GLY 120 -2.456 -2.502 -14.641 931 HA2 GLY 120 1HA GLY 120 -1.767 -0.393 -15.283 932 HA3 GLY 120 2HA GLY 120 -3.022 -0.630 -16.490 933 H SER 121 H SER 121 -3.676 1.496 -16.600 934 HA SER 121 HA SER 121 -4.875 3.365 -16.028 935 HB2 SER 121 1HB SER 121 -5.992 1.695 -13.773 936 HB3 SER 121 2HB SER 121 -6.762 3.046 -14.601 937 HG SER 121 HG SER 121 -6.952 1.797 -16.421 938 H HIS 122 H HIS 122 -5.554 3.140 -12.841 939 HA HIS 122 HA HIS 122 -3.526 5.075 -12.127 940 HB2 HIS 122 1HB HIS 122 -5.977 5.127 -11.417 941 HB3 HIS 122 2HB HIS 122 -5.577 3.828 -10.297 942 HD2 HIS 122 HD2 HIS 122 -4.751 4.809 -7.861 943 HE1 HIS 122 HE1 HIS 122 -3.410 8.600 -9.147 944 HE2 HIS 122 HE2 HIS 122 -3.746 7.104 -7.125 945 H THR 123 H THR 123 -3.920 1.653 -11.848 946 HA THR 123 HA THR 123 -2.342 1.289 -9.485 947 HB THR 123 HB THR 123 -2.995 -0.659 -11.701 948 HG1 THR 123 HG1 THR 123 -4.556 -1.337 -10.190 949 HG21 THR 123 3HG2 THR 123 -2.560 -2.281 -9.733 950 HG22 THR 123 1HG2 THR 123 -1.688 -0.938 -8.999 951 HG23 THR 123 2HG2 THR 123 -1.160 -1.590 -10.550 952 H ARG 124 H ARG 124 -1.624 1.612 -12.896 953 HA ARG 124 HA ARG 124 0.879 0.419 -13.055 954 HB2 ARG 124 1HB ARG 124 -0.385 1.387 -14.969 955 HB3 ARG 124 2HB ARG 124 0.025 2.996 -14.393 956 HG2 ARG 124 1HG ARG 124 2.433 2.431 -14.602 957 HG3 ARG 124 2HG ARG 124 1.985 0.852 -15.242 958 HD2 ARG 124 1HD ARG 124 1.139 3.486 -16.469 959 HD3 ARG 124 2HD ARG 124 2.523 2.544 -17.016 960 HE ARG 124 HE ARG 124 0.290 0.846 -17.006 961 HH11 ARG 124 1HH2 ARG 124 1.450 3.712 -18.557 962 HH12 ARG 124 2HH2 ARG 124 0.612 3.414 -20.043 963 HH21 ARG 124 1HH1 ARG 124 -0.818 0.450 -18.953 964 HH22 ARG 124 2HH1 ARG 124 -0.672 1.568 -20.267 965 H THR 125 H THR 125 0.091 3.754 -12.128 966 HA THR 125 HA THR 125 2.678 4.715 -11.790 967 HB THR 125 HB THR 125 1.568 6.223 -10.003 968 HG1 THR 125 HG1 THR 125 -0.888 5.651 -10.933 969 HG21 THR 125 3HG2 THR 125 0.528 6.036 -12.836 970 HG22 THR 125 1HG2 THR 125 1.879 7.007 -12.252 971 HG23 THR 125 2HG2 THR 125 0.232 7.407 -11.766 972 H PHE 126 H PHE 126 0.633 2.860 -9.585 973 HA PHE 126 HA PHE 126 2.194 3.083 -7.281 974 HB2 PHE 126 1HB PHE 126 -0.101 2.037 -7.499 975 HB3 PHE 126 2HB PHE 126 0.702 0.601 -8.133 976 HD1 PHE 126 HD1 PHE 126 0.497 2.872 -5.202 977 HD2 PHE 126 HD2 PHE 126 1.825 -0.932 -6.685 978 HE1 PHE 126 HE1 PHE 126 0.987 2.140 -2.886 979 HE2 PHE 126 HE2 PHE 126 2.317 -1.664 -4.370 980 HZ PHE 126 HZ PHE 126 1.896 -0.126 -2.470 981 H LEU 127 H LEU 127 2.280 0.434 -9.742 982 HA LEU 127 HA LEU 127 4.295 -1.062 -8.700 983 HB2 LEU 127 1HB LEU 127 4.247 -0.441 -11.659 984 HB3 LEU 127 2HB LEU 127 4.658 -1.956 -10.857 985 HG LEU 127 HG LEU 127 1.921 -0.687 -11.077 986 HD11 LEU 127 1HD1 LEU 127 3.131 -3.264 -12.122 987 HD12 LEU 127 2HD1 LEU 127 2.628 -1.870 -13.078 988 HD13 LEU 127 3HD1 LEU 127 1.421 -2.845 -12.241 989 HD21 LEU 127 3HD2 LEU 127 1.981 -1.645 -8.895 990 HD22 LEU 127 1HD2 LEU 127 2.936 -3.023 -9.439 991 HD23 LEU 127 2HD2 LEU 127 1.241 -2.883 -9.907 992 H GLN 128 H GLN 128 4.797 1.680 -11.005 993 HA GLN 128 HA GLN 128 7.590 1.518 -10.905 994 HB2 GLN 128 1HB GLN 128 5.750 3.769 -11.672 995 HB3 GLN 128 2HB GLN 128 7.474 3.666 -12.059 996 HG2 GLN 128 1HG GLN 128 7.105 1.557 -13.246 997 HG3 GLN 128 2HG GLN 128 5.392 1.608 -12.834 998 HE21 GLN 128 2HE2 GLN 128 4.998 1.601 -15.183 999 HE22 GLN 128 1HE2 GLN 128 5.152 3.047 -16.042 1000 H GLU 129 H GLU 129 5.252 3.572 -9.169 1001 HA GLU 129 HA GLU 129 7.084 5.304 -7.941 1002 HB2 GLU 129 1HB GLU 129 4.318 4.378 -7.189 1003 HB3 GLU 129 2HB GLU 129 5.213 5.499 -6.165 1004 HG2 GLU 129 1HG GLU 129 4.684 5.963 -9.110 1005 HG3 GLU 129 2HG GLU 129 3.681 6.614 -7.816 1006 H VAL 130 H VAL 130 5.638 2.292 -6.630 1007 HA VAL 130 HA VAL 130 7.139 2.402 -4.218 1008 HB VAL 130 HB VAL 130 5.022 1.085 -4.582 1009 HG11 VAL 130 1HG1 VAL 130 6.855 -0.967 -5.831 1010 HG12 VAL 130 2HG1 VAL 130 5.860 0.132 -6.782 1011 HG13 VAL 130 3HG1 VAL 130 5.096 -1.021 -5.693 1012 HG21 VAL 130 3HG2 VAL 130 6.322 0.671 -2.595 1013 HG22 VAL 130 1HG2 VAL 130 7.487 -0.301 -3.494 1014 HG23 VAL 130 2HG2 VAL 130 5.846 -0.897 -3.246 1015 H ALA 131 H ALA 131 7.594 0.696 -7.281 1016 HA ALA 131 HA ALA 131 9.864 -0.825 -6.696 1017 HB1 ALA 131 3HB ALA 131 10.320 -0.735 -9.133 1018 HB2 ALA 131 1HB ALA 131 9.099 0.527 -9.292 1019 HB3 ALA 131 2HB ALA 131 8.632 -1.092 -8.769 1020 H ARG 132 H ARG 132 9.772 2.510 -8.006 1021 HA ARG 132 HA ARG 132 12.632 2.750 -7.990 1022 HB2 ARG 132 1HB ARG 132 10.414 4.779 -8.297 1023 HB3 ARG 132 2HB ARG 132 12.125 5.198 -8.376 1024 HG2 ARG 132 1HG ARG 132 12.445 3.602 -10.223 1025 HG3 ARG 132 2HG ARG 132 10.740 3.161 -10.143 1026 HD2 ARG 132 1HD ARG 132 10.117 5.494 -10.665 1027 HD3 ARG 132 2HD ARG 132 11.823 5.926 -10.763 1028 HE ARG 132 HE ARG 132 10.293 4.404 -12.728 1029 HH11 ARG 132 1HH2 ARG 132 13.380 5.385 -11.505 1030 HH12 ARG 132 2HH2 ARG 132 14.220 5.069 -12.987 1031 HH21 ARG 132 1HH1 ARG 132 11.390 3.982 -14.669 1032 HH22 ARG 132 2HH1 ARG 132 13.094 4.273 -14.777 1033 H ALA 133 H ALA 133 10.280 2.882 -5.580 1034 HA ALA 133 HA ALA 133 11.354 4.889 -3.890 1035 HB1 ALA 133 3HB ALA 133 9.781 4.176 -2.320 1036 HB2 ALA 133 1HB ALA 133 9.845 2.500 -2.864 1037 HB3 ALA 133 2HB ALA 133 9.035 3.718 -3.850 1038 H CYS 134 H CYS 134 12.543 1.820 -4.705 1039 HA CYS 134 HA CYS 134 14.930 1.872 -3.502 1040 HB2 CYS 134 1HB CYS 134 14.434 2.156 -1.274 1041 HB3 CYS 134 2HB CYS 134 12.890 1.336 -1.387 1042 HG CYS 134 HG CYS 134 14.316 -0.960 -1.476 1043 HA PRO 135 HA PRO 135 13.532 -2.856 -3.737 1044 HB2 PRO 135 1HB PRO 135 11.345 -2.389 -5.731 1045 HB3 PRO 135 2HB PRO 135 11.460 -3.604 -4.441 1046 HG2 PRO 135 1HG PRO 135 9.893 -1.479 -4.171 1047 HG3 PRO 135 2HG PRO 135 10.822 -2.109 -2.797 1048 HD2 PRO 135 1HD PRO 135 11.367 0.318 -4.477 1049 HD3 PRO 135 2HD PRO 135 11.617 0.073 -2.742 1050 H GLY 136 H GLY 136 12.816 -0.891 -6.661 1051 HA2 GLY 136 1HA GLY 136 13.582 -2.073 -8.804 1052 HA3 GLY 136 2HA GLY 136 14.353 -0.533 -8.452 1053 H PHE 137 H PHE 137 14.639 -4.016 -8.127 1054 HA PHE 137 HA PHE 137 16.556 -5.181 -7.236 1055 HB2 PHE 137 1HB PHE 137 16.901 -4.428 -10.137 1056 HB3 PHE 137 2HB PHE 137 17.870 -5.661 -9.330 1057 HD1 PHE 137 HD2 PHE 137 14.461 -4.737 -10.438 1058 HD2 PHE 137 HD1 PHE 137 16.923 -7.799 -8.696 1059 HE1 PHE 137 HE2 PHE 137 12.652 -6.399 -10.794 1060 HE2 PHE 137 HE1 PHE 137 15.112 -9.458 -9.051 1061 HZ PHE 137 HZ PHE 137 12.978 -8.758 -10.099 1062 H ASP 138 H ASP 138 17.447 -3.605 -5.710 1063 HA ASP 138 HA ASP 138 19.722 -2.045 -6.734 1064 HB2 ASP 138 1HB ASP 138 17.934 -1.879 -4.360 1065 HB3 ASP 138 2HB ASP 138 19.602 -1.390 -4.092 1066 HA PRO 139 HA PRO 139 22.866 -4.781 -5.288 1067 HB2 PRO 139 1HB PRO 139 23.938 -2.651 -3.471 1068 HB3 PRO 139 2HB PRO 139 24.775 -3.592 -4.724 1069 HG2 PRO 139 1HG PRO 139 24.117 -1.057 -5.142 1070 HG3 PRO 139 2HG PRO 139 23.977 -2.259 -6.438 1071 HD2 PRO 139 1HD PRO 139 21.807 -1.027 -4.768 1072 HD3 PRO 139 2HD PRO 139 21.801 -1.474 -6.489 1073 H GLU 140 H GLU 140 21.524 -2.825 -2.618 1074 HA GLU 140 HA GLU 140 21.350 -5.282 -0.971 1075 HB2 GLU 140 1HB GLU 140 22.441 -2.594 -0.119 1076 HB3 GLU 140 2HB GLU 140 22.011 -3.888 1.003 1077 HG2 GLU 140 1HG GLU 140 23.601 -5.395 -0.072 1078 HG3 GLU 140 2HG GLU 140 23.986 -4.167 -1.275 1079 H THR 141 H THR 141 19.368 -3.772 -2.551 1080 HA THR 141 HA THR 141 17.273 -2.836 -2.354 1081 HB THR 141 HB THR 141 15.842 -4.008 -0.799 1082 HG1 THR 141 HG1 THR 141 16.904 -5.468 0.693 1083 HG21 THR 141 3HG2 THR 141 16.533 -5.269 -2.756 1084 HG22 THR 141 1HG2 THR 141 16.471 -6.355 -1.368 1085 HG23 THR 141 2HG2 THR 141 18.024 -5.759 -1.952 1086 H ARG 142 H ARG 142 19.408 -1.305 -1.056 1087 HA ARG 142 HA ARG 142 19.602 0.596 0.209 1088 HB2 ARG 142 1HB ARG 142 17.316 1.060 -0.812 1089 HB3 ARG 142 2HB ARG 142 16.628 0.460 0.698 1090 HG2 ARG 142 1HG ARG 142 17.848 2.146 1.973 1091 HG3 ARG 142 2HG ARG 142 18.635 2.723 0.504 1092 HD2 ARG 142 1HD ARG 142 16.767 4.188 1.023 1093 HD3 ARG 142 2HD ARG 142 16.387 3.272 -0.433 1094 HE ARG 142 HE ARG 142 15.412 1.896 1.850 1095 HH11 ARG 142 1HH2 ARG 142 14.890 4.697 -0.111 1096 HH12 ARG 142 2HH2 ARG 142 13.186 4.766 0.199 1097 HH21 ARG 142 1HH1 ARG 142 13.182 1.976 2.260 1098 HH22 ARG 142 2HH1 ARG 142 12.218 3.224 1.542 1099 H ASP 143 H ASP 143 19.728 1.292 2.350 1100 HA ASP 143 HA ASP 143 19.793 -0.845 4.265 1101 HB2 ASP 143 1HB ASP 143 20.462 2.078 4.653 1102 HB3 ASP 143 2HB ASP 143 20.922 0.741 5.705 1103 HA PRO 144 HA PRO 144 15.814 0.227 5.989 1104 HB2 PRO 144 1HB PRO 144 15.989 -1.066 8.394 1105 HB3 PRO 144 2HB PRO 144 15.762 -1.920 6.853 1106 HG2 PRO 144 1HG PRO 144 18.273 -1.485 8.414 1107 HG3 PRO 144 2HG PRO 144 17.694 -2.950 7.596 1108 HD2 PRO 144 1HD PRO 144 19.575 -1.309 6.513 1109 HD3 PRO 144 2HD PRO 144 18.427 -2.238 5.520 1110 H GLU 145 H GLU 145 14.882 1.650 7.425 1111 HA GLU 145 HA GLU 145 16.329 2.886 9.592 1112 HB2 GLU 145 1HB GLU 145 17.279 4.108 7.648 1113 HB3 GLU 145 2HB GLU 145 15.649 4.578 7.168 1114 HG2 GLU 145 1HG GLU 145 15.345 5.743 9.325 1115 HG3 GLU 145 2HG GLU 145 16.965 5.262 9.815 1116 H PHE 146 H PHE 146 14.506 2.131 10.728 1117 HA PHE 146 HA PHE 146 11.888 3.308 10.044 1118 HB2 PHE 146 1HB PHE 146 11.230 1.689 12.024 1119 HB3 PHE 146 2HB PHE 146 11.558 1.037 10.418 1120 HD1 PHE 146 HD2 PHE 146 13.629 -0.173 9.933 1121 HD2 PHE 146 HD1 PHE 146 12.844 1.419 13.844 1122 HE1 PHE 146 HE2 PHE 146 15.475 -1.542 10.861 1123 HE2 PHE 146 HE1 PHE 146 14.689 0.049 14.772 1124 HZ PHE 146 HZ PHE 146 16.006 -1.432 13.281 1125 H GLU 147 H GLU 147 14.276 4.655 11.349 1126 HA GLU 147 HA GLU 147 13.806 5.157 14.060 1127 HB2 GLU 147 1HB GLU 147 15.868 5.770 12.839 1128 HB3 GLU 147 2HB GLU 147 14.976 7.043 12.007 1129 HG2 GLU 147 1HG GLU 147 14.492 8.144 14.134 1130 HG3 GLU 147 2HG GLU 147 15.282 6.837 15.016 1131 H TRP 148 H TRP 148 12.500 6.822 11.199 1132 HA TRP 148 HA TRP 148 11.091 8.752 12.831 1133 HB2 TRP 148 1HB TRP 148 10.162 9.563 10.693 1134 HB3 TRP 148 2HB TRP 148 11.920 9.458 10.662 1135 HD1 TRP 148 HD1 TRP 148 12.894 7.069 9.557 1136 HE1 TRP 148 HE1 TRP 148 12.033 5.837 7.473 1137 HE3 TRP 148 HE3 TRP 148 8.211 9.084 9.208 1138 HZ2 TRP 148 HZ2 TRP 148 9.685 5.727 5.853 1139 HZ3 TRP 148 HZ3 TRP 148 6.685 8.399 7.376 1140 HH2 TRP 148 HH2 TRP 148 7.411 6.721 5.695 1141 H LEU 149 H LEU 149 10.408 5.590 11.564 1142 HA LEU 149 HA LEU 149 7.617 5.729 11.334 1143 HB2 LEU 149 1HB LEU 149 9.219 3.799 10.713 1144 HB3 LEU 149 2HB LEU 149 9.068 3.303 12.395 1145 HG LEU 149 HG LEU 149 6.675 3.763 10.584 1146 HD11 LEU 149 1HD1 LEU 149 6.625 1.221 10.494 1147 HD12 LEU 149 2HD1 LEU 149 8.276 1.254 11.108 1148 HD13 LEU 149 3HD1 LEU 149 7.899 1.995 9.554 1149 HD21 LEU 149 3HD2 LEU 149 7.054 2.866 13.408 1150 HD22 LEU 149 1HD2 LEU 149 5.895 1.927 12.465 1151 HD23 LEU 149 2HD2 LEU 149 5.679 3.661 12.649 1152 H SER 150 H SER 150 9.687 5.098 14.164 1153 HA SER 150 HA SER 150 7.865 4.337 16.056 1154 HB2 SER 150 1HB SER 150 9.314 5.454 17.700 1155 HB3 SER 150 2HB SER 150 10.275 4.613 16.486 1156 HG SER 150 HG SER 150 9.853 6.971 15.494 1157 H ARG 151 H ARG 151 8.299 7.509 14.617 1158 HA ARG 151 HA ARG 151 6.799 9.060 16.425 1159 HB2 ARG 151 1HB ARG 151 6.985 9.353 13.412 1160 HB3 ARG 151 2HB ARG 151 6.536 10.617 14.557 1161 HG2 ARG 151 1HG ARG 151 9.203 9.177 14.572 1162 HG3 ARG 151 2HG ARG 151 8.932 10.747 13.818 1163 HD2 ARG 151 1HD ARG 151 9.708 11.391 15.916 1164 HD3 ARG 151 2HD ARG 151 7.973 11.382 16.206 1165 HE ARG 151 HE ARG 151 9.272 8.852 16.759 1166 HH11 ARG 151 1HH2 ARG 151 8.372 11.980 17.931 1167 HH12 ARG 151 2HH2 ARG 151 8.388 11.512 19.598 1168 HH21 ARG 151 1HH1 ARG 151 9.290 8.228 18.938 1169 HH22 ARG 151 2HH1 ARG 151 8.907 9.385 20.170 1170 H HIS 152 H HIS 152 5.928 7.133 13.618 1171 HA HIS 152 HA HIS 152 3.117 7.731 13.816 1172 HB2 HIS 152 1HB HIS 152 4.687 5.719 12.194 1173 HB3 HIS 152 2HB HIS 152 2.937 5.901 12.088 1174 HD2 HIS 152 HD2 HIS 152 6.075 7.483 10.567 1175 HE1 HIS 152 HE1 HIS 152 2.920 10.189 9.827 1176 HE2 HIS 152 HE2 HIS 152 5.327 9.612 9.253 1177 H THR 153 H THR 153 1.522 6.404 14.576 1178 HA THR 153 HA THR 153 2.281 3.890 15.927 1179 HB THR 153 HB THR 153 2.266 5.512 17.721 1180 HG1 THR 153 HG1 THR 153 1.346 3.686 18.411 1181 HG21 THR 153 3HG2 THR 153 0.120 6.770 18.199 1182 HG22 THR 153 1HG2 THR 153 -0.418 6.317 16.582 1183 HG23 THR 153 2HG2 THR 153 1.014 7.328 16.786 1184 H CYS 154 H CYS 154 0.558 5.384 13.697 1185 HA CYS 154 HA CYS 154 -1.152 4.645 12.353 1186 HB2 CYS 154 1HB CYS 154 -1.786 2.439 12.452 1187 HB3 CYS 154 2HB CYS 154 -0.427 2.335 13.563 1188 HG CYS 154 HG CYS 154 -2.405 2.823 15.474 1189 H ALA 155 H ALA 155 -3.104 5.564 12.173 1190 HA ALA 155 HA ALA 155 -4.824 6.978 12.841 1191 HB1 ALA 155 3HB ALA 155 -6.572 5.741 13.935 1192 HB2 ALA 155 1HB ALA 155 -5.410 4.604 14.618 1193 HB3 ALA 155 2HB ALA 155 -5.707 4.620 12.881 1194 H GLU 156 H GLU 156 -2.590 7.786 14.195 1195 HA GLU 156 HA GLU 156 -2.722 7.774 16.985 1196 HB2 GLU 156 1HB GLU 156 -1.281 9.772 16.877 1197 HB3 GLU 156 2HB GLU 156 -0.741 8.506 15.775 1198 HG2 GLU 156 1HG GLU 156 -2.292 9.790 14.039 1199 HG3 GLU 156 2HG GLU 156 -2.048 11.141 15.145 1200 HA PRO 157 HA PRO 157 -6.383 10.471 17.091 1201 HB2 PRO 157 1HB PRO 157 -7.163 10.035 19.633 1202 HB3 PRO 157 2HB PRO 157 -7.367 8.797 18.376 1203 HG2 PRO 157 1HG PRO 157 -5.257 9.023 20.476 1204 HG3 PRO 157 2HG PRO 157 -6.147 7.589 19.928 1205 HD2 PRO 157 1HD PRO 157 -3.596 8.233 19.069 1206 HD3 PRO 157 2HD PRO 157 -4.733 7.247 18.121 1207 H ASP 158 H ASP 158 -6.923 12.489 18.057 1208 HA ASP 158 HA ASP 158 -4.647 14.007 18.967 1209 HB2 ASP 158 1HB ASP 158 -7.540 14.692 18.440 1210 HB3 ASP 158 2HB ASP 158 -6.381 15.871 19.051 1211 H ALA 159 H ALA 159 -4.051 14.247 21.010 1212 HA ALA 159 HA ALA 159 -5.445 13.137 23.199 1213 HB1 ALA 159 3HB ALA 159 -3.027 13.476 23.236 1214 HB2 ALA 159 1HB ALA 159 -3.778 14.336 24.581 1215 HB3 ALA 159 2HB ALA 159 -3.252 15.223 23.150 1216 H GLU 160 H GLU 160 -5.222 16.452 21.969 1217 HA GLU 160 HA GLU 160 -6.569 17.740 24.082 1218 HB2 GLU 160 1HB GLU 160 -6.366 18.431 21.143 1219 HB3 GLU 160 2HB GLU 160 -7.055 19.505 22.362 1220 HG2 GLU 160 1HG GLU 160 -4.953 19.539 23.588 1221 HG3 GLU 160 2HG GLU 160 -4.252 18.356 22.484 1222 H SER 161 H SER 161 -7.918 17.000 20.854 1223 HA SER 161 HA SER 161 -10.621 17.199 21.875 1224 HB2 SER 161 1HB SER 161 -11.173 16.502 19.474 1225 HB3 SER 161 2HB SER 161 -10.327 18.033 19.677 1226 HG SER 161 HG SER 161 -8.552 17.176 18.854 Start of MODEL 15 1 H1 GLY 1 1H GLY 1 -18.426 18.944 -15.986 2 H2 GLY 1 2H GLY 1 -17.285 17.847 -16.603 3 H3 GLY 1 3H GLY 1 -16.786 19.373 -16.047 4 HA2 GLY 1 1HA GLY 1 -16.632 17.147 -14.589 5 HA3 GLY 1 2HA GLY 1 -16.777 18.765 -13.902 6 HA PRO 2 HA PRO 2 -21.343 17.290 -13.949 7 HB2 PRO 2 1HB PRO 2 -21.882 14.808 -15.034 8 HB3 PRO 2 2HB PRO 2 -21.918 16.319 -15.965 9 HG2 PRO 2 1HG PRO 2 -19.751 14.270 -15.777 10 HG3 PRO 2 2HG PRO 2 -20.355 15.141 -17.198 11 HD2 PRO 2 1HD PRO 2 -18.058 15.867 -15.942 12 HD3 PRO 2 2HD PRO 2 -19.127 17.063 -16.709 13 H LEU 3 H LEU 3 -18.765 15.016 -13.393 14 HA LEU 3 HA LEU 3 -20.079 14.164 -10.880 15 HB2 LEU 3 1HB LEU 3 -20.188 12.326 -12.549 16 HB3 LEU 3 2HB LEU 3 -18.432 12.370 -12.690 17 HG LEU 3 HG LEU 3 -18.245 11.869 -10.257 18 HD11 LEU 3 1HD1 LEU 3 -20.163 12.621 -9.184 19 HD12 LEU 3 2HD1 LEU 3 -20.539 10.907 -9.305 20 HD13 LEU 3 3HD1 LEU 3 -21.239 12.044 -10.457 21 HD21 LEU 3 3HD2 LEU 3 -18.275 10.042 -11.975 22 HD22 LEU 3 1HD2 LEU 3 -20.010 9.871 -11.709 23 HD23 LEU 3 2HD2 LEU 3 -18.880 9.526 -10.401 24 H GLY 4 H GLY 4 -18.927 14.684 -9.169 25 HA2 GLY 4 1HA GLY 4 -16.301 15.789 -9.356 26 HA3 GLY 4 2HA GLY 4 -17.158 15.406 -7.866 27 H SER 5 H SER 5 -17.502 12.768 -7.870 28 HA SER 5 HA SER 5 -16.465 10.745 -7.480 29 HB2 SER 5 1HB SER 5 -15.143 9.936 -9.196 30 HB3 SER 5 2HB SER 5 -15.833 11.338 -10.008 31 HG SER 5 HG SER 5 -13.977 12.423 -9.741 32 H MET 6 H MET 6 -15.220 10.135 -5.798 33 HA MET 6 HA MET 6 -13.038 11.956 -4.940 34 HB2 MET 6 1HB MET 6 -14.836 10.098 -3.366 35 HB3 MET 6 2HB MET 6 -13.427 10.908 -2.683 36 HG2 MET 6 1HG MET 6 -14.390 13.103 -3.294 37 HG3 MET 6 2HG MET 6 -15.805 12.294 -3.968 38 HE1 MET 6 3HE MET 6 -16.352 14.368 -2.384 39 HE2 MET 6 1HE MET 6 -16.992 14.088 -0.758 40 HE3 MET 6 2HE MET 6 -17.786 13.368 -2.157 41 H ASP 7 H ASP 7 -11.171 11.159 -5.732 42 HA ASP 7 HA ASP 7 -10.625 8.423 -6.206 43 HB2 ASP 7 1HB ASP 7 -8.811 10.824 -5.909 44 HB3 ASP 7 2HB ASP 7 -8.227 9.216 -6.333 45 H GLN 8 H GLN 8 -8.338 7.713 -5.171 46 HA GLN 8 HA GLN 8 -8.885 7.454 -2.276 47 HB2 GLN 8 1HB GLN 8 -6.885 5.640 -2.773 48 HB3 GLN 8 2HB GLN 8 -8.600 5.265 -2.914 49 HG2 GLN 8 1HG GLN 8 -7.041 6.411 -5.227 50 HG3 GLN 8 2HG GLN 8 -7.111 4.679 -4.911 51 HE21 GLN 8 2HE2 GLN 8 -9.652 4.112 -4.255 52 HE22 GLN 8 1HE2 GLN 8 -10.747 4.630 -5.439 53 H SER 9 H SER 9 -6.414 8.415 -4.595 54 HA SER 9 HA SER 9 -4.231 8.662 -2.896 55 HB2 SER 9 1HB SER 9 -4.951 10.497 -5.189 56 HB3 SER 9 2HB SER 9 -3.356 10.334 -4.460 57 HG SER 9 HG SER 9 -3.197 8.303 -5.249 58 H VAL 10 H VAL 10 -6.685 11.133 -3.638 59 HA VAL 10 HA VAL 10 -5.607 13.092 -1.887 60 HB VAL 10 HB VAL 10 -7.166 13.646 -3.702 61 HG11 VAL 10 1HG1 VAL 10 -9.364 12.436 -2.018 62 HG12 VAL 10 2HG1 VAL 10 -8.551 11.515 -3.285 63 HG13 VAL 10 3HG1 VAL 10 -9.444 12.982 -3.691 64 HG21 VAL 10 3HG2 VAL 10 -6.965 15.102 -1.668 65 HG22 VAL 10 1HG2 VAL 10 -8.363 14.270 -0.985 66 HG23 VAL 10 2HG2 VAL 10 -8.537 15.223 -2.459 67 H ALA 11 H ALA 11 -8.242 10.764 -1.527 68 HA ALA 11 HA ALA 11 -9.272 11.312 0.900 69 HB1 ALA 11 3HB ALA 11 -9.898 9.045 1.136 70 HB2 ALA 11 1HB ALA 11 -8.483 8.476 0.250 71 HB3 ALA 11 2HB ALA 11 -9.784 9.304 -0.604 72 H ILE 12 H ILE 12 -6.173 9.686 0.350 73 HA ILE 12 HA ILE 12 -5.630 9.108 3.046 74 HB ILE 12 HB ILE 12 -3.712 9.676 0.784 75 HG12 ILE 12 1HG1 ILE 12 -5.252 7.862 0.263 76 HG13 ILE 12 2HG1 ILE 12 -3.658 7.204 0.579 77 HG21 ILE 12 1HG2 ILE 12 -2.381 9.778 2.709 78 HG22 ILE 12 2HG2 ILE 12 -2.262 8.079 2.249 79 HG23 ILE 12 3HG2 ILE 12 -3.344 8.568 3.551 80 HD11 ILE 12 3HD1 ILE 12 -4.616 6.985 3.054 81 HD12 ILE 12 1HD1 ILE 12 -4.964 5.761 1.837 82 HD13 ILE 12 2HD1 ILE 12 -6.158 7.002 2.208 83 H GLN 13 H GLN 13 -4.574 11.785 1.051 84 HA GLN 13 HA GLN 13 -3.030 13.179 2.813 85 HB2 GLN 13 1HB GLN 13 -4.299 13.821 0.381 86 HB3 GLN 13 2HB GLN 13 -4.793 15.101 1.487 87 HG2 GLN 13 1HG GLN 13 -1.935 14.212 0.959 88 HG3 GLN 13 2HG GLN 13 -2.685 15.697 0.371 89 HE21 GLN 13 2HE2 GLN 13 -0.972 14.307 3.085 90 HE22 GLN 13 1HE2 GLN 13 -1.198 15.620 4.134 91 H GLU 14 H GLU 14 -6.589 13.342 2.664 92 HA GLU 14 HA GLU 14 -6.926 15.182 4.743 93 HB2 GLU 14 1HB GLU 14 -8.672 12.900 3.784 94 HB3 GLU 14 2HB GLU 14 -9.214 14.161 4.892 95 HG2 GLU 14 1HG GLU 14 -8.113 14.668 2.110 96 HG3 GLU 14 2HG GLU 14 -9.828 14.629 2.512 97 H THR 15 H THR 15 -6.736 11.652 4.741 98 HA THR 15 HA THR 15 -7.117 11.319 7.559 99 HB THR 15 HB THR 15 -6.384 9.016 7.203 100 HG1 THR 15 HG1 THR 15 -4.772 9.076 5.798 101 HG21 THR 15 3HG2 THR 15 -8.249 10.247 5.181 102 HG22 THR 15 1HG2 THR 15 -8.641 9.278 6.602 103 HG23 THR 15 2HG2 THR 15 -7.930 8.514 5.180 104 H LEU 16 H LEU 16 -4.305 11.850 5.523 105 HA LEU 16 HA LEU 16 -2.430 11.207 7.648 106 HB2 LEU 16 1HB LEU 16 -2.053 10.889 5.112 107 HB3 LEU 16 2HB LEU 16 -1.749 12.622 5.075 108 HG LEU 16 HG LEU 16 -0.002 12.287 6.868 109 HD11 LEU 16 1HD1 LEU 16 -0.871 9.434 6.483 110 HD12 LEU 16 2HD1 LEU 16 -0.358 10.263 7.952 111 HD13 LEU 16 3HD1 LEU 16 0.839 9.742 6.776 112 HD21 LEU 16 3HD2 LEU 16 0.209 11.000 4.141 113 HD22 LEU 16 1HD2 LEU 16 1.596 11.050 5.224 114 HD23 LEU 16 2HD2 LEU 16 0.852 12.552 4.677 115 H VAL 17 H VAL 17 -0.967 12.721 8.584 116 HA VAL 17 HA VAL 17 -2.208 15.268 9.159 117 HB VAL 17 HB VAL 17 -0.321 15.538 10.744 118 HG11 VAL 17 1HG1 VAL 17 -0.818 13.517 12.164 119 HG12 VAL 17 2HG1 VAL 17 -1.721 12.847 10.805 120 HG13 VAL 17 3HG1 VAL 17 -2.260 14.342 11.572 121 HG21 VAL 17 3HG2 VAL 17 1.472 14.477 9.546 122 HG22 VAL 17 1HG2 VAL 17 0.595 12.948 9.470 123 HG23 VAL 17 2HG2 VAL 17 1.211 13.535 11.015 124 H GLU 18 H GLU 18 -0.382 17.117 9.327 125 HA GLU 18 HA GLU 18 0.289 17.703 6.611 126 HB2 GLU 18 1HB GLU 18 1.146 19.810 7.529 127 HB3 GLU 18 2HB GLU 18 -0.449 19.433 8.185 128 HG2 GLU 18 1HG GLU 18 0.635 18.457 10.199 129 HG3 GLU 18 2HG GLU 18 2.209 18.925 9.559 130 H GLY 19 H GLY 19 2.606 19.023 6.654 131 HA2 GLY 19 1HA GLY 19 4.880 18.817 6.425 132 HA3 GLY 19 2HA GLY 19 4.826 17.781 7.844 133 H GLU 20 H GLU 20 3.060 15.786 6.598 134 HA GLU 20 HA GLU 20 5.126 14.312 5.191 135 HB2 GLU 20 1HB GLU 20 2.356 13.565 6.123 136 HB3 GLU 20 2HB GLU 20 3.408 12.476 5.218 137 HG2 GLU 20 1HG GLU 20 5.113 12.602 6.942 138 HG3 GLU 20 2HG GLU 20 4.189 13.823 7.816 139 H TYR 21 H TYR 21 4.437 12.994 3.300 140 HA TYR 21 HA TYR 21 2.685 14.439 1.404 141 HB2 TYR 21 1HB TYR 21 5.068 15.233 1.191 142 HB3 TYR 21 2HB TYR 21 5.506 13.582 0.750 143 HD1 TYR 21 HD1 TYR 21 3.580 16.568 -0.266 144 HD2 TYR 21 HD2 TYR 21 4.944 12.656 -1.393 145 HE1 TYR 21 HE1 TYR 21 2.911 17.013 -2.612 146 HE2 TYR 21 HE2 TYR 21 4.272 13.097 -3.739 147 HH TYR 21 HH TYR 21 2.436 14.753 -4.841 148 H CYS 22 H CYS 22 1.334 13.034 0.500 149 HA CYS 22 HA CYS 22 2.067 10.180 0.365 150 HB2 CYS 22 1HB CYS 22 -0.133 10.471 1.235 151 HB3 CYS 22 2HB CYS 22 -0.549 11.662 0.002 152 HG CYS 22 HG CYS 22 -0.114 8.628 -0.654 153 H VAL 23 H VAL 23 2.351 9.126 -1.611 154 HA VAL 23 HA VAL 23 2.695 10.898 -3.946 155 HB VAL 23 HB VAL 23 3.673 8.089 -3.395 156 HG11 VAL 23 1HG1 VAL 23 5.181 8.575 -5.339 157 HG12 VAL 23 2HG1 VAL 23 4.255 10.046 -5.636 158 HG13 VAL 23 3HG1 VAL 23 3.478 8.469 -5.781 159 HG21 VAL 23 3HG2 VAL 23 5.885 9.269 -3.178 160 HG22 VAL 23 1HG2 VAL 23 4.737 9.658 -1.898 161 HG23 VAL 23 2HG2 VAL 23 5.011 10.800 -3.212 162 H ILE 24 H ILE 24 1.209 7.830 -2.951 163 HA ILE 24 HA ILE 24 -0.873 8.115 -4.904 164 HB ILE 24 HB ILE 24 0.947 7.388 -6.359 165 HG12 ILE 24 1HG1 ILE 24 -0.073 5.307 -7.275 166 HG13 ILE 24 2HG1 ILE 24 -1.103 5.203 -5.850 167 HG21 ILE 24 1HG2 ILE 24 1.881 5.073 -6.023 168 HG22 ILE 24 2HG2 ILE 24 1.149 5.081 -4.420 169 HG23 ILE 24 3HG2 ILE 24 2.393 6.261 -4.826 170 HD11 ILE 24 3HD1 ILE 24 -2.327 7.118 -6.449 171 HD12 ILE 24 1HD1 ILE 24 -2.039 6.344 -8.006 172 HD13 ILE 24 2HD1 ILE 24 -1.055 7.721 -7.512 173 H ALA 25 H ALA 25 -2.568 6.706 -4.599 174 HA ALA 25 HA ALA 25 -2.363 4.586 -2.605 175 HB1 ALA 25 3HB ALA 25 -4.649 6.467 -2.199 176 HB2 ALA 25 1HB ALA 25 -3.066 7.008 -1.647 177 HB3 ALA 25 2HB ALA 25 -3.755 5.512 -1.016 178 H VAL 26 H VAL 26 -3.080 2.929 -3.744 179 HA VAL 26 HA VAL 26 -5.347 3.359 -5.561 180 HB VAL 26 HB VAL 26 -4.761 1.182 -6.469 181 HG11 VAL 26 1HG1 VAL 26 -3.617 3.242 -7.282 182 HG12 VAL 26 2HG1 VAL 26 -2.613 1.803 -7.451 183 HG13 VAL 26 3HG1 VAL 26 -2.311 2.939 -6.137 184 HG21 VAL 26 3HG2 VAL 26 -2.713 1.189 -4.236 185 HG22 VAL 26 1HG2 VAL 26 -2.593 0.124 -5.640 186 HG23 VAL 26 2HG2 VAL 26 -3.969 -0.012 -4.544 187 H GLN 27 H GLN 27 -6.549 0.963 -5.655 188 HA GLN 27 HA GLN 27 -7.308 0.303 -2.885 189 HB2 GLN 27 1HB GLN 27 -8.856 2.025 -4.127 190 HB3 GLN 27 2HB GLN 27 -9.415 0.613 -5.020 191 HG2 GLN 27 1HG GLN 27 -9.345 0.682 -1.992 192 HG3 GLN 27 2HG GLN 27 -10.736 1.225 -2.921 193 HE21 GLN 27 2HE2 GLN 27 -11.010 -0.990 -1.215 194 HE22 GLN 27 1HE2 GLN 27 -11.216 -2.392 -2.148 195 H GLY 28 H GLY 28 -7.133 -1.785 -2.592 196 HA2 GLY 28 1HA GLY 28 -7.607 -3.614 -4.905 197 HA3 GLY 28 2HA GLY 28 -6.292 -3.851 -3.761 198 H VAL 29 H VAL 29 -7.257 -5.943 -3.524 199 HA VAL 29 HA VAL 29 -9.232 -5.960 -1.342 200 HB VAL 29 HB VAL 29 -9.448 -7.765 -3.765 201 HG11 VAL 29 1HG1 VAL 29 -11.664 -8.310 -2.633 202 HG12 VAL 29 2HG1 VAL 29 -11.025 -7.505 -1.200 203 HG13 VAL 29 3HG1 VAL 29 -10.224 -8.942 -1.837 204 HG21 VAL 29 3HG2 VAL 29 -11.604 -6.519 -4.110 205 HG22 VAL 29 1HG2 VAL 29 -10.165 -5.530 -4.360 206 HG23 VAL 29 2HG2 VAL 29 -11.087 -5.383 -2.864 207 H LEU 30 H LEU 30 -9.258 -8.026 -0.240 208 HA LEU 30 HA LEU 30 -6.877 -9.709 -0.599 209 HB2 LEU 30 1HB LEU 30 -6.294 -7.964 1.089 210 HB3 LEU 30 2HB LEU 30 -7.657 -8.492 2.073 211 HG LEU 30 HG LEU 30 -5.793 -10.672 1.212 212 HD11 LEU 30 1HD1 LEU 30 -4.901 -8.374 2.933 213 HD12 LEU 30 2HD1 LEU 30 -4.005 -9.266 1.704 214 HD13 LEU 30 3HD1 LEU 30 -4.320 -9.998 3.270 215 HD21 LEU 30 3HD2 LEU 30 -7.697 -11.078 2.736 216 HD22 LEU 30 1HD2 LEU 30 -7.046 -9.900 3.872 217 HD23 LEU 30 2HD2 LEU 30 -6.170 -11.397 3.551 218 H CYS 31 H CYS 31 -7.611 -11.803 -0.623 219 HA CYS 31 HA CYS 31 -10.232 -12.324 0.634 220 HB2 CYS 31 1HB CYS 31 -8.853 -14.139 -1.329 221 HB3 CYS 31 2HB CYS 31 -10.578 -13.969 -0.986 222 HG CYS 31 HG CYS 31 -8.907 -11.878 -2.602 223 H LYS 32 H LYS 32 -10.362 -13.595 2.305 224 HA LYS 32 HA LYS 32 -8.156 -15.484 2.884 225 HB2 LYS 32 1HB LYS 32 -8.169 -13.424 4.404 226 HB3 LYS 32 2HB LYS 32 -9.690 -14.044 5.056 227 HG2 LYS 32 1HG LYS 32 -8.478 -16.255 5.437 228 HG3 LYS 32 2HG LYS 32 -6.981 -15.398 5.071 229 HD2 LYS 32 1HD LYS 32 -8.931 -14.661 7.266 230 HD3 LYS 32 2HD LYS 32 -7.385 -15.478 7.499 231 HE2 LYS 32 1HE LYS 32 -6.348 -13.454 6.272 232 HE3 LYS 32 2HE LYS 32 -7.890 -12.657 6.575 233 HZ1 LYS 32 3HZ LYS 32 -6.532 -12.109 8.377 234 HZ2 LYS 32 1HZ LYS 32 -5.956 -13.693 8.552 235 HZ3 LYS 32 2HZ LYS 32 -7.563 -13.324 8.966 236 H GLY 33 H GLY 33 -8.861 -17.489 3.000 237 HA2 GLY 33 1HA GLY 33 -10.256 -19.298 3.168 238 HA3 GLY 33 2HA GLY 33 -11.171 -18.353 4.336 239 H ASP 34 H ASP 34 -13.217 -18.065 3.817 240 HA ASP 34 HA ASP 34 -13.996 -17.857 0.959 241 HB2 ASP 34 1HB ASP 34 -16.109 -18.952 1.548 242 HB3 ASP 34 2HB ASP 34 -14.745 -19.996 1.937 243 H SER 35 H SER 35 -13.200 -15.723 2.643 244 HA SER 35 HA SER 35 -15.689 -14.135 2.688 245 HB2 SER 35 1HB SER 35 -15.126 -14.911 5.026 246 HB3 SER 35 2HB SER 35 -13.596 -14.045 4.882 247 HG SER 35 HG SER 35 -15.751 -12.544 4.136 248 H ARG 36 H ARG 36 -15.391 -12.260 1.591 249 HA ARG 36 HA ARG 36 -12.692 -11.576 0.722 250 HB2 ARG 36 1HB ARG 36 -14.865 -11.605 -0.727 251 HB3 ARG 36 2HB ARG 36 -15.178 -10.034 0.003 252 HG2 ARG 36 1HG ARG 36 -13.964 -9.371 -1.871 253 HG3 ARG 36 2HG ARG 36 -12.649 -9.555 -0.711 254 HD2 ARG 36 1HD ARG 36 -12.013 -10.692 -2.751 255 HD3 ARG 36 2HD ARG 36 -12.351 -11.919 -1.536 256 HE ARG 36 HE ARG 36 -14.235 -12.568 -2.760 257 HH11 ARG 36 1HH2 ARG 36 -12.862 -9.627 -3.955 258 HH12 ARG 36 2HH2 ARG 36 -13.815 -9.606 -5.400 259 HH21 ARG 36 1HH1 ARG 36 -15.490 -12.549 -4.652 260 HH22 ARG 36 2HH1 ARG 36 -15.303 -11.261 -5.796 261 H GLN 37 H GLN 37 -11.626 -9.701 1.150 262 HA GLN 37 HA GLN 37 -12.804 -7.861 3.155 263 HB2 GLN 37 1HB GLN 37 -9.999 -9.009 3.151 264 HB3 GLN 37 2HB GLN 37 -10.607 -7.786 4.267 265 HG2 GLN 37 1HG GLN 37 -12.234 -9.312 5.178 266 HG3 GLN 37 2HG GLN 37 -11.889 -10.509 3.934 267 HE21 GLN 37 2HE2 GLN 37 -9.941 -11.766 4.118 268 HE22 GLN 37 1HE2 GLN 37 -9.025 -11.788 5.541 269 H SER 38 H SER 38 -12.815 -5.895 2.432 270 HA SER 38 HA SER 38 -11.152 -5.101 0.148 271 HB2 SER 38 1HB SER 38 -13.093 -3.307 1.589 272 HB3 SER 38 2HB SER 38 -12.538 -3.222 -0.081 273 HG SER 38 HG SER 38 -14.078 -4.540 -0.593 274 H ARG 39 H ARG 39 -9.332 -4.053 0.310 275 HA ARG 39 HA ARG 39 -8.664 -2.580 2.788 276 HB2 ARG 39 1HB ARG 39 -6.977 -4.552 1.268 277 HB3 ARG 39 2HB ARG 39 -6.298 -3.409 2.426 278 HG2 ARG 39 1HG ARG 39 -7.840 -4.331 4.169 279 HG3 ARG 39 2HG ARG 39 -8.394 -5.528 3.000 280 HD2 ARG 39 1HD ARG 39 -6.080 -6.370 2.777 281 HD3 ARG 39 2HD ARG 39 -5.541 -5.196 3.971 282 HE ARG 39 HE ARG 39 -7.073 -7.631 4.486 283 HH11 ARG 39 1HH2 ARG 39 -5.920 -4.568 5.648 284 HH12 ARG 39 2HH2 ARG 39 -6.061 -5.003 7.319 285 HH21 ARG 39 1HH1 ARG 39 -7.256 -8.191 6.670 286 HH22 ARG 39 2HH1 ARG 39 -6.815 -7.048 7.895 287 H LEU 40 H LEU 40 -7.124 -0.930 2.548 288 HA LEU 40 HA LEU 40 -6.666 0.026 -0.219 289 HB2 LEU 40 1HB LEU 40 -8.593 1.179 0.979 290 HB3 LEU 40 2HB LEU 40 -7.407 1.844 2.099 291 HG LEU 40 HG LEU 40 -6.914 2.187 -0.854 292 HD11 LEU 40 1HD1 LEU 40 -9.265 2.789 -0.647 293 HD12 LEU 40 2HD1 LEU 40 -8.291 4.245 -0.845 294 HD13 LEU 40 3HD1 LEU 40 -8.903 3.806 0.748 295 HD21 LEU 40 3HD2 LEU 40 -6.509 3.955 1.575 296 HD22 LEU 40 1HD2 LEU 40 -6.022 4.364 -0.067 297 HD23 LEU 40 2HD2 LEU 40 -5.254 3.019 0.766 298 H LEU 41 H LEU 41 -4.599 0.659 -0.640 299 HA LEU 41 HA LEU 41 -2.833 1.401 1.595 300 HB2 LEU 41 1HB LEU 41 -1.108 -0.217 0.693 301 HB3 LEU 41 2HB LEU 41 -2.463 -0.946 1.549 302 HG LEU 41 HG LEU 41 -3.440 -0.912 -1.045 303 HD11 LEU 41 1HD1 LEU 41 -1.138 -0.103 -1.780 304 HD12 LEU 41 2HD1 LEU 41 -1.738 -1.552 -2.585 305 HD13 LEU 41 3HD1 LEU 41 -0.532 -1.689 -1.306 306 HD21 LEU 41 3HD2 LEU 41 -2.787 -3.334 -1.089 307 HD22 LEU 41 1HD2 LEU 41 -3.575 -2.829 0.406 308 HD23 LEU 41 2HD2 LEU 41 -1.826 -3.047 0.362 309 H GLY 42 H GLY 42 -1.001 2.621 0.938 310 HA2 GLY 42 1HA GLY 42 -0.679 3.116 -1.946 311 HA3 GLY 42 2HA GLY 42 -0.988 4.477 -0.863 312 H LEU 43 H LEU 43 1.070 5.308 -1.498 313 HA LEU 43 HA LEU 43 3.287 4.160 0.064 314 HB2 LEU 43 1HB LEU 43 3.689 3.536 -2.259 315 HB3 LEU 43 2HB LEU 43 3.446 5.198 -2.782 316 HG LEU 43 HG LEU 43 5.405 5.914 -1.518 317 HD11 LEU 43 1HD1 LEU 43 6.866 3.857 -0.642 318 HD12 LEU 43 2HD1 LEU 43 5.281 3.105 -0.468 319 HD13 LEU 43 3HD1 LEU 43 5.644 4.610 0.374 320 HD21 LEU 43 3HD2 LEU 43 7.136 4.413 -2.722 321 HD22 LEU 43 1HD2 LEU 43 5.979 5.298 -3.704 322 HD23 LEU 43 2HD2 LEU 43 5.734 3.580 -3.396 323 H VAL 44 H VAL 44 4.438 5.634 1.212 324 HA VAL 44 HA VAL 44 3.782 8.503 0.781 325 HB VAL 44 HB VAL 44 4.135 7.053 3.392 326 HG11 VAL 44 1HG1 VAL 44 3.397 9.286 4.319 327 HG12 VAL 44 2HG1 VAL 44 3.665 9.949 2.711 328 HG13 VAL 44 3HG1 VAL 44 5.016 9.273 3.618 329 HG21 VAL 44 3HG2 VAL 44 1.976 6.532 2.533 330 HG22 VAL 44 1HG2 VAL 44 1.746 8.171 1.925 331 HG23 VAL 44 2HG2 VAL 44 1.720 7.862 3.662 332 H ARG 45 H ARG 45 5.384 9.870 0.684 333 HA ARG 45 HA ARG 45 8.132 8.932 1.272 334 HB2 ARG 45 1HB ARG 45 7.674 9.518 -1.107 335 HB3 ARG 45 2HB ARG 45 7.226 11.144 -0.590 336 HG2 ARG 45 1HG ARG 45 9.479 11.469 0.363 337 HG3 ARG 45 2HG ARG 45 9.930 9.841 -0.146 338 HD2 ARG 45 1HD ARG 45 10.729 11.457 -1.795 339 HD3 ARG 45 2HD ARG 45 9.451 10.472 -2.503 340 HE ARG 45 HE ARG 45 8.356 12.834 -1.353 341 HH11 ARG 45 1HH2 ARG 45 10.202 11.643 -4.026 342 HH12 ARG 45 2HH2 ARG 45 9.718 12.910 -5.105 343 HH21 ARG 45 1HH1 ARG 45 7.716 14.499 -2.760 344 HH22 ARG 45 2HH1 ARG 45 8.312 14.526 -4.387 345 H TYR 46 H TYR 46 9.058 9.831 2.929 346 HA TYR 46 HA TYR 46 8.010 12.377 4.016 347 HB2 TYR 46 1HB TYR 46 7.660 10.496 5.506 348 HB3 TYR 46 2HB TYR 46 9.350 10.021 5.362 349 HD1 TYR 46 HD1 TYR 46 7.414 13.166 6.094 350 HD2 TYR 46 HD2 TYR 46 10.685 10.601 7.171 351 HE1 TYR 46 HE1 TYR 46 7.996 14.689 7.950 352 HE2 TYR 46 HE2 TYR 46 11.264 12.121 9.027 353 HH TYR 46 HH TYR 46 9.558 14.039 10.435 354 H ARG 47 H ARG 47 9.397 14.076 4.195 355 HA ARG 47 HA ARG 47 12.143 13.679 3.193 356 HB2 ARG 47 1HB ARG 47 10.725 15.408 2.116 357 HB3 ARG 47 2HB ARG 47 10.626 16.257 3.659 358 HG2 ARG 47 1HG ARG 47 13.082 16.520 3.686 359 HG3 ARG 47 2HG ARG 47 13.194 15.648 2.158 360 HD2 ARG 47 1HD ARG 47 11.722 17.404 1.129 361 HD3 ARG 47 2HD ARG 47 11.814 18.303 2.642 362 HE ARG 47 HE ARG 47 13.940 17.986 0.671 363 HH11 ARG 47 1HH2 ARG 47 12.997 18.878 3.882 364 HH12 ARG 47 2HH2 ARG 47 14.408 19.839 4.175 365 HH21 ARG 47 1HH1 ARG 47 15.790 19.239 1.052 366 HH22 ARG 47 2HH1 ARG 47 15.989 20.044 2.574 367 H LEU 48 H LEU 48 13.895 13.842 4.413 368 HA LEU 48 HA LEU 48 13.586 14.533 7.250 369 HB2 LEU 48 1HB LEU 48 15.706 13.089 5.670 370 HB3 LEU 48 2HB LEU 48 16.042 13.683 7.289 371 HG LEU 48 HG LEU 48 15.242 11.266 7.121 372 HD11 LEU 48 1HD1 LEU 48 15.092 12.829 9.179 373 HD12 LEU 48 2HD1 LEU 48 14.087 11.385 9.174 374 HD13 LEU 48 3HD1 LEU 48 13.380 12.947 8.797 375 HD21 LEU 48 3HD2 LEU 48 13.472 11.859 5.384 376 HD22 LEU 48 1HD2 LEU 48 12.524 12.530 6.712 377 HD23 LEU 48 2HD2 LEU 48 12.940 10.818 6.699 378 H GLU 49 H GLU 49 14.394 16.275 8.155 379 HA GLU 49 HA GLU 49 15.057 18.564 6.789 380 HB2 GLU 49 1HB GLU 49 15.942 17.657 9.537 381 HB3 GLU 49 2HB GLU 49 16.159 19.300 8.930 382 HG2 GLU 49 1HG GLU 49 13.749 19.549 8.630 383 HG3 GLU 49 2HG GLU 49 13.489 17.876 9.120 384 H ASN 50 H ASN 50 16.939 15.754 7.175 385 HA ASN 50 HA ASN 50 19.527 17.001 6.888 386 HB2 ASN 50 1HB ASN 50 18.633 14.120 6.615 387 HB3 ASN 50 2HB ASN 50 20.313 14.657 6.577 388 HD21 ASN 50 2HD2 ASN 50 18.532 13.065 8.635 389 HD22 ASN 50 1HD2 ASN 50 18.926 13.808 10.110 390 H ASP 51 H ASP 51 17.061 16.871 4.825 391 HA ASP 51 HA ASP 51 16.945 17.368 2.580 392 HB2 ASP 51 1HB ASP 51 19.510 18.032 2.991 393 HB3 ASP 51 2HB ASP 51 19.788 16.569 2.050 394 H ALA 52 H ALA 52 17.522 14.624 4.147 395 HA ALA 52 HA ALA 52 17.660 12.815 1.855 396 HB1 ALA 52 3HB ALA 52 17.799 12.438 4.845 397 HB2 ALA 52 1HB ALA 52 19.056 12.136 3.647 398 HB3 ALA 52 2HB ALA 52 17.649 11.077 3.733 399 H GLN 53 H GLN 53 16.143 11.117 1.644 400 HA GLN 53 HA GLN 53 13.419 11.719 2.665 401 HB2 GLN 53 1HB GLN 53 14.268 10.823 -0.098 402 HB3 GLN 53 2HB GLN 53 12.598 10.831 0.463 403 HG2 GLN 53 1HG GLN 53 12.822 12.910 -0.633 404 HG3 GLN 53 2HG GLN 53 13.023 13.322 1.067 405 HE21 GLN 53 2HE2 GLN 53 14.834 14.518 1.543 406 HE22 GLN 53 1HE2 GLN 53 16.226 14.616 0.574 407 H GLU 54 H GLU 54 11.957 9.882 2.687 408 HA GLU 54 HA GLU 54 13.193 7.224 2.669 409 HB2 GLU 54 1HB GLU 54 13.461 8.097 5.003 410 HB3 GLU 54 2HB GLU 54 11.708 8.244 5.106 411 HG2 GLU 54 1HG GLU 54 12.315 6.131 6.098 412 HG3 GLU 54 2HG GLU 54 11.551 5.781 4.553 413 H HIS 55 H HIS 55 11.748 5.558 2.334 414 HA HIS 55 HA HIS 55 8.932 6.323 1.764 415 HB2 HIS 55 1HB HIS 55 10.749 4.431 0.251 416 HB3 HIS 55 2HB HIS 55 9.015 4.586 -0.031 417 HD2 HIS 55 HD2 HIS 55 8.335 6.669 -1.735 418 HE1 HIS 55 HE1 HIS 55 12.080 8.617 -1.754 419 HE2 HIS 55 HE2 HIS 55 9.754 8.599 -2.774 420 H ALA 56 H ALA 56 7.352 4.753 2.179 421 HA ALA 56 HA ALA 56 8.059 2.178 3.287 422 HB1 ALA 56 3HB ALA 56 8.331 3.362 5.323 423 HB2 ALA 56 1HB ALA 56 6.697 2.704 5.402 424 HB3 ALA 56 2HB ALA 56 6.946 4.403 4.995 425 H LEU 57 H LEU 57 6.228 0.786 3.366 426 HA LEU 57 HA LEU 57 4.095 1.561 1.555 427 HB2 LEU 57 1HB LEU 57 5.081 -0.727 1.533 428 HB3 LEU 57 2HB LEU 57 4.449 -0.995 3.148 429 HG LEU 57 HG LEU 57 2.130 -0.522 2.207 430 HD11 LEU 57 1HD1 LEU 57 2.046 -0.997 -0.341 431 HD12 LEU 57 2HD1 LEU 57 3.749 -0.547 -0.343 432 HD13 LEU 57 3HD1 LEU 57 2.531 0.613 0.175 433 HD21 LEU 57 3HD2 LEU 57 1.829 -2.765 1.448 434 HD22 LEU 57 1HD2 LEU 57 3.173 -2.844 2.585 435 HD23 LEU 57 2HD2 LEU 57 3.483 -2.865 0.849 436 H PHE 58 H PHE 58 2.087 2.177 2.065 437 HA PHE 58 HA PHE 58 1.371 2.342 4.934 438 HB2 PHE 58 1HB PHE 58 0.983 4.159 2.584 439 HB3 PHE 58 2HB PHE 58 -0.273 4.131 3.814 440 HD1 PHE 58 HD1 PHE 58 3.474 3.864 4.023 441 HD2 PHE 58 HD2 PHE 58 -0.048 6.016 5.183 442 HE1 PHE 58 HE1 PHE 58 4.844 5.300 5.494 443 HE2 PHE 58 HE2 PHE 58 1.326 7.462 6.648 444 HZ PHE 58 HZ PHE 58 3.772 7.105 6.813 445 H LEU 59 H LEU 59 -0.204 1.133 5.602 446 HA LEU 59 HA LEU 59 -2.116 0.003 3.638 447 HB2 LEU 59 1HB LEU 59 -0.600 -1.469 5.259 448 HB3 LEU 59 2HB LEU 59 -1.855 -1.075 6.431 449 HG LEU 59 HG LEU 59 -2.225 -2.445 3.754 450 HD11 LEU 59 1HD1 LEU 59 -2.932 -3.436 6.524 451 HD12 LEU 59 2HD1 LEU 59 -1.379 -3.770 5.755 452 HD13 LEU 59 3HD1 LEU 59 -2.870 -4.363 5.023 453 HD21 LEU 59 3HD2 LEU 59 -4.152 -1.102 3.943 454 HD22 LEU 59 1HD2 LEU 59 -4.227 -1.293 5.693 455 HD23 LEU 59 2HD2 LEU 59 -4.655 -2.637 4.640 456 H TYR 60 H TYR 60 -4.005 0.924 3.640 457 HA TYR 60 HA TYR 60 -5.036 2.322 6.052 458 HB2 TYR 60 1HB TYR 60 -5.228 2.786 3.088 459 HB3 TYR 60 2HB TYR 60 -6.508 3.385 4.126 460 HD1 TYR 60 HD1 TYR 60 -5.958 5.005 5.954 461 HD2 TYR 60 HD2 TYR 60 -3.098 3.861 2.975 462 HE1 TYR 60 HE1 TYR 60 -4.575 6.975 6.539 463 HE2 TYR 60 HE2 TYR 60 -1.719 5.834 3.547 464 HH TYR 60 HH TYR 60 -2.589 7.977 6.244 465 H THR 61 H THR 61 -6.859 1.352 6.974 466 HA THR 61 HA THR 61 -8.128 -0.831 5.492 467 HB THR 61 HB THR 61 -7.892 -1.292 7.828 468 HG1 THR 61 HG1 THR 61 -9.831 -2.057 7.593 469 HG21 THR 61 3HG2 THR 61 -8.986 0.262 9.507 470 HG22 THR 61 1HG2 THR 61 -9.137 1.437 8.201 471 HG23 THR 61 2HG2 THR 61 -7.542 0.902 8.725 472 H HIS 62 H HIS 62 -10.546 -0.830 5.369 473 HA HIS 62 HA HIS 62 -11.963 1.609 5.546 474 HB2 HIS 62 1HB HIS 62 -12.165 2.286 3.297 475 HB3 HIS 62 2HB HIS 62 -10.441 2.020 3.537 476 HD2 HIS 62 HD2 HIS 62 -9.476 -0.467 2.359 477 HE1 HIS 62 HE1 HIS 62 -12.843 -0.918 -0.141 478 HE2 HIS 62 HE2 HIS 62 -10.492 -1.758 0.334 479 H ARG 63 H ARG 63 -14.168 1.426 4.537 480 HA ARG 63 HA ARG 63 -15.105 -1.292 4.960 481 HB2 ARG 63 1HB ARG 63 -16.199 1.136 5.628 482 HB3 ARG 63 2HB ARG 63 -17.087 0.776 4.147 483 HG2 ARG 63 1HG ARG 63 -17.647 -1.458 5.051 484 HG3 ARG 63 2HG ARG 63 -16.799 -1.049 6.539 485 HD2 ARG 63 1HD ARG 63 -19.178 -0.669 6.870 486 HD3 ARG 63 2HD ARG 63 -18.349 0.884 6.845 487 HE ARG 63 HE ARG 63 -19.236 0.216 4.229 488 HH11 ARG 63 1HH2 ARG 63 -20.369 1.214 7.351 489 HH12 ARG 63 2HH2 ARG 63 -21.757 2.043 6.731 490 HH21 ARG 63 1HH1 ARG 63 -21.057 1.299 3.418 491 HH22 ARG 63 2HH1 ARG 63 -22.146 2.091 4.508 492 H ARG 64 H ARG 64 -17.402 -1.108 3.307 493 HA ARG 64 HA ARG 64 -16.430 -2.308 0.955 494 HB2 ARG 64 1HB ARG 64 -19.120 -1.126 1.675 495 HB3 ARG 64 2HB ARG 64 -18.817 -1.974 0.158 496 HG2 ARG 64 1HG ARG 64 -18.122 -3.980 1.406 497 HG3 ARG 64 2HG ARG 64 -18.395 -3.132 2.929 498 HD2 ARG 64 1HD ARG 64 -20.777 -2.847 2.343 499 HD3 ARG 64 2HD ARG 64 -20.505 -3.696 0.825 500 HE ARG 64 HE ARG 64 -19.684 -5.258 3.089 501 HH11 ARG 64 1HH2 ARG 64 -22.389 -4.191 1.209 502 HH12 ARG 64 2HH2 ARG 64 -23.372 -5.564 1.595 503 HH21 ARG 64 1HH1 ARG 64 -20.970 -7.060 3.597 504 HH22 ARG 64 2HH1 ARG 64 -22.570 -7.187 2.945 505 H MET 65 H MET 65 -17.639 1.015 1.598 506 HA MET 65 HA MET 65 -16.235 1.932 -0.819 507 HB2 MET 65 1HB MET 65 -18.370 3.449 -1.129 508 HB3 MET 65 2HB MET 65 -18.377 1.799 -1.752 509 HG2 MET 65 1HG MET 65 -19.550 1.001 0.229 510 HG3 MET 65 2HG MET 65 -19.445 2.597 0.972 511 HE1 MET 65 3HE MET 65 -22.414 3.043 1.119 512 HE2 MET 65 1HE MET 65 -21.776 1.394 1.180 513 HE3 MET 65 2HE MET 65 -23.135 1.779 0.126 514 H ALA 66 H ALA 66 -15.925 2.100 2.185 515 HA ALA 66 HA ALA 66 -16.353 4.956 2.718 516 HB1 ALA 66 3HB ALA 66 -14.963 3.020 4.558 517 HB2 ALA 66 1HB ALA 66 -16.720 3.077 4.426 518 HB3 ALA 66 2HB ALA 66 -15.830 4.499 4.960 519 H ILE 67 H ILE 67 -14.469 4.000 0.659 520 HA ILE 67 HA ILE 67 -11.776 4.406 1.562 521 HB ILE 67 HB ILE 67 -11.293 4.413 -0.900 522 HG12 ILE 67 1HG1 ILE 67 -14.296 4.030 -1.157 523 HG13 ILE 67 2HG1 ILE 67 -13.474 5.547 -1.511 524 HG21 ILE 67 1HG2 ILE 67 -11.385 2.278 0.273 525 HG22 ILE 67 2HG2 ILE 67 -12.164 2.094 -1.298 526 HG23 ILE 67 3HG2 ILE 67 -13.145 2.252 0.157 527 HD11 ILE 67 3HD1 ILE 67 -12.099 4.399 -3.218 528 HD12 ILE 67 1HD1 ILE 67 -13.821 4.257 -3.572 529 HD13 ILE 67 2HD1 ILE 67 -12.948 2.892 -2.877 530 H THR 68 H THR 68 -14.305 6.438 0.559 531 HA THR 68 HA THR 68 -13.129 8.588 -0.660 532 HB THR 68 HB THR 68 -15.422 8.762 -0.600 533 HG1 THR 68 HG1 THR 68 -15.099 10.258 1.729 534 HG21 THR 68 3HG2 THR 68 -15.180 7.930 2.292 535 HG22 THR 68 1HG2 THR 68 -15.924 7.037 0.965 536 HG23 THR 68 2HG2 THR 68 -16.699 8.490 1.592 537 H GLY 69 H GLY 69 -12.916 7.898 2.860 538 HA2 GLY 69 1HA GLY 69 -10.798 9.095 3.718 539 HA3 GLY 69 2HA GLY 69 -11.672 10.549 3.242 540 H ASP 70 H ASP 70 -14.213 9.015 3.881 541 HA ASP 70 HA ASP 70 -14.774 10.165 6.345 542 HB2 ASP 70 1HB ASP 70 -16.490 9.457 4.744 543 HB3 ASP 70 2HB ASP 70 -16.104 7.769 5.071 544 H ASP 71 H ASP 71 -14.597 6.568 5.911 545 HA ASP 71 HA ASP 71 -13.570 6.433 8.720 546 HB2 ASP 71 1HB ASP 71 -15.896 5.668 8.361 547 HB3 ASP 71 2HB ASP 71 -15.318 4.483 7.209 548 H VAL 72 H VAL 72 -11.712 6.668 6.678 549 HA VAL 72 HA VAL 72 -10.457 3.989 6.777 550 HB VAL 72 HB VAL 72 -11.097 4.097 4.519 551 HG11 VAL 72 1HG1 VAL 72 -10.840 6.161 3.147 552 HG12 VAL 72 2HG1 VAL 72 -10.290 7.016 4.585 553 HG13 VAL 72 3HG1 VAL 72 -11.935 6.391 4.510 554 HG21 VAL 72 3HG2 VAL 72 -9.043 4.015 3.418 555 HG22 VAL 72 1HG2 VAL 72 -8.474 4.004 5.083 556 HG23 VAL 72 2HG2 VAL 72 -8.457 5.501 4.166 557 H SER 73 H SER 73 -8.673 4.162 8.055 558 HA SER 73 HA SER 73 -6.833 6.390 7.620 559 HB2 SER 73 1HB SER 73 -7.909 5.535 10.326 560 HB3 SER 73 2HB SER 73 -6.625 6.710 10.061 561 HG SER 73 HG SER 73 -9.006 7.106 8.680 562 H LEU 74 H LEU 74 -4.694 5.807 8.641 563 HA LEU 74 HA LEU 74 -3.654 3.522 7.724 564 HB2 LEU 74 1HB LEU 74 -2.876 5.116 10.151 565 HB3 LEU 74 2HB LEU 74 -1.925 3.721 9.643 566 HG LEU 74 HG LEU 74 -2.646 5.952 7.749 567 HD11 LEU 74 1HD1 LEU 74 -1.399 7.164 9.286 568 HD12 LEU 74 2HD1 LEU 74 -0.128 6.562 8.228 569 HD13 LEU 74 3HD1 LEU 74 -0.434 5.769 9.770 570 HD21 LEU 74 3HD2 LEU 74 -1.361 3.387 7.440 571 HD22 LEU 74 1HD2 LEU 74 -0.136 4.628 7.202 572 HD23 LEU 74 2HD2 LEU 74 -1.601 4.636 6.231 573 H ASP 75 H ASP 75 -3.352 1.476 8.182 574 HA ASP 75 HA ASP 75 -4.703 0.288 10.535 575 HB2 ASP 75 1HB ASP 75 -5.512 -0.363 8.221 576 HB3 ASP 75 2HB ASP 75 -3.931 -1.101 7.970 577 H GLN 76 H GLN 76 -1.917 -0.431 8.307 578 HA GLN 76 HA GLN 76 -0.163 -0.705 10.599 579 HB2 GLN 76 1HB GLN 76 -1.341 -2.978 10.237 580 HB3 GLN 76 2HB GLN 76 -0.378 -3.085 8.761 581 HG2 GLN 76 1HG GLN 76 1.615 -2.425 10.422 582 HG3 GLN 76 2HG GLN 76 0.531 -3.109 11.632 583 HE21 GLN 76 2HE2 GLN 76 3.071 -3.929 9.710 584 HE22 GLN 76 1HE2 GLN 76 2.753 -5.577 9.494 585 H ILE 77 H ILE 77 1.544 0.398 10.003 586 HA ILE 77 HA ILE 77 2.262 0.809 7.210 587 HB ILE 77 HB ILE 77 3.494 1.770 9.805 588 HG12 ILE 77 1HG1 ILE 77 1.910 3.275 7.698 589 HG13 ILE 77 2HG1 ILE 77 1.214 2.637 9.188 590 HG21 ILE 77 1HG2 ILE 77 5.316 1.867 8.339 591 HG22 ILE 77 2HG2 ILE 77 4.595 3.460 8.123 592 HG23 ILE 77 3HG2 ILE 77 4.301 2.191 6.935 593 HD11 ILE 77 3HD1 ILE 77 3.136 3.993 10.361 594 HD12 ILE 77 1HD1 ILE 77 1.711 4.853 9.778 595 HD13 ILE 77 2HD1 ILE 77 3.199 4.873 8.835 596 H VAL 78 H VAL 78 3.754 -0.301 6.111 597 HA VAL 78 HA VAL 78 5.593 -2.085 7.603 598 HB VAL 78 HB VAL 78 4.365 -2.534 4.882 599 HG11 VAL 78 1HG1 VAL 78 6.592 -3.458 4.926 600 HG12 VAL 78 2HG1 VAL 78 5.473 -4.797 5.184 601 HG13 VAL 78 3HG1 VAL 78 6.350 -4.105 6.549 602 HG21 VAL 78 3HG2 VAL 78 2.747 -2.908 6.652 603 HG22 VAL 78 1HG2 VAL 78 3.929 -3.818 7.594 604 HG23 VAL 78 2HG2 VAL 78 3.312 -4.479 6.081 605 HA PRO 79 HA PRO 79 8.228 0.843 5.308 606 HB2 PRO 79 1HB PRO 79 10.444 0.664 6.845 607 HB3 PRO 79 2HB PRO 79 8.997 1.551 7.379 608 HG2 PRO 79 1HG PRO 79 9.916 -1.193 8.125 609 HG3 PRO 79 2HG PRO 79 9.224 0.075 9.150 610 HD2 PRO 79 1HD PRO 79 7.777 -2.049 8.153 611 HD3 PRO 79 2HD PRO 79 7.049 -0.490 8.609 612 H LEU 80 H LEU 80 9.794 0.641 3.761 613 HA LEU 80 HA LEU 80 10.261 -1.899 2.683 614 HB2 LEU 80 1HB LEU 80 11.577 0.776 2.210 615 HB3 LEU 80 2HB LEU 80 11.886 -0.649 1.219 616 HG LEU 80 HG LEU 80 9.122 0.508 1.692 617 HD11 LEU 80 1HD1 LEU 80 9.290 1.575 -0.457 618 HD12 LEU 80 2HD1 LEU 80 10.847 0.814 -0.778 619 HD13 LEU 80 3HD1 LEU 80 10.711 2.054 0.469 620 HD21 LEU 80 3HD2 LEU 80 8.742 -1.682 0.977 621 HD22 LEU 80 1HD2 LEU 80 10.235 -1.756 0.039 622 HD23 LEU 80 2HD2 LEU 80 8.843 -0.864 -0.574 623 H SER 81 H SER 81 11.672 -3.332 3.030 624 HA SER 81 HA SER 81 14.223 -2.730 4.422 625 HB2 SER 81 1HB SER 81 12.734 -3.683 6.095 626 HB3 SER 81 2HB SER 81 12.336 -5.023 5.024 627 HG SER 81 HG SER 81 13.989 -5.937 5.953 628 H LYS 82 H LYS 82 15.843 -4.449 4.118 629 HA LYS 82 HA LYS 82 16.258 -5.010 1.433 630 HB2 LYS 82 1HB LYS 82 18.010 -5.044 3.195 631 HB3 LYS 82 2HB LYS 82 17.354 -6.575 3.776 632 HG2 LYS 82 1HG LYS 82 17.778 -7.604 1.575 633 HG3 LYS 82 2HG LYS 82 18.417 -6.071 0.979 634 HD2 LYS 82 1HD LYS 82 20.187 -6.142 2.706 635 HD3 LYS 82 2HD LYS 82 19.554 -7.685 3.283 636 HE2 LYS 82 1HE LYS 82 21.452 -8.065 1.772 637 HE3 LYS 82 2HE LYS 82 19.964 -8.675 1.045 638 HZ1 LYS 82 3HZ LYS 82 19.912 -7.001 -0.483 639 HZ2 LYS 82 1HZ LYS 82 21.592 -7.147 -0.293 640 HZ3 LYS 82 2HZ LYS 82 20.752 -5.904 0.506 641 H ASP 83 H ASP 83 14.843 -7.092 3.951 642 HA ASP 83 HA ASP 83 14.604 -9.410 2.350 643 HB2 ASP 83 1HB ASP 83 13.123 -8.460 4.806 644 HB3 ASP 83 2HB ASP 83 12.845 -10.035 4.068 645 H PHE 84 H PHE 84 13.205 -6.466 1.894 646 HA PHE 84 HA PHE 84 10.511 -7.107 1.197 647 HB2 PHE 84 1HB PHE 84 11.338 -4.788 1.647 648 HB3 PHE 84 2HB PHE 84 12.239 -4.857 0.132 649 HD1 PHE 84 HD1 PHE 84 8.842 -4.872 1.639 650 HD2 PHE 84 HD2 PHE 84 11.137 -4.561 -1.980 651 HE1 PHE 84 HE1 PHE 84 6.830 -4.067 0.435 652 HE2 PHE 84 HE2 PHE 84 9.120 -3.776 -3.191 653 HZ PHE 84 HZ PHE 84 6.970 -3.528 -1.985 654 H MET 85 H MET 85 9.669 -7.832 -0.695 655 HA MET 85 HA MET 85 11.058 -7.791 -3.173 656 HB2 MET 85 1HB MET 85 12.331 -9.638 -2.117 657 HB3 MET 85 2HB MET 85 10.823 -10.511 -1.842 658 HG2 MET 85 1HG MET 85 11.876 -11.357 -3.877 659 HG3 MET 85 2HG MET 85 10.411 -10.484 -4.318 660 HE1 MET 85 3HE MET 85 12.081 -9.287 -7.340 661 HE2 MET 85 1HE MET 85 10.581 -8.884 -6.493 662 HE3 MET 85 2HE MET 85 11.134 -10.556 -6.564 663 H LEU 86 H LEU 86 9.619 -8.093 -4.844 664 HA LEU 86 HA LEU 86 6.831 -8.706 -4.063 665 HB2 LEU 86 1HB LEU 86 7.868 -7.480 -6.636 666 HB3 LEU 86 2HB LEU 86 6.196 -7.556 -6.092 667 HG LEU 86 HG LEU 86 8.407 -6.086 -4.635 668 HD11 LEU 86 1HD1 LEU 86 6.174 -5.027 -6.411 669 HD12 LEU 86 2HD1 LEU 86 7.900 -4.978 -6.774 670 HD13 LEU 86 3HD1 LEU 86 7.253 -4.027 -5.436 671 HD21 LEU 86 3HD2 LEU 86 6.252 -5.031 -3.578 672 HD22 LEU 86 1HD2 LEU 86 6.785 -6.614 -3.021 673 HD23 LEU 86 2HD2 LEU 86 5.451 -6.481 -4.167 674 H GLU 87 H GLU 87 6.000 -10.683 -4.630 675 HA GLU 87 HA GLU 87 7.422 -12.230 -6.727 676 HB2 GLU 87 1HB GLU 87 5.940 -13.175 -4.262 677 HB3 GLU 87 2HB GLU 87 6.549 -14.237 -5.529 678 HG2 GLU 87 1HG GLU 87 8.835 -13.459 -5.125 679 HG3 GLU 87 2HG GLU 87 8.254 -12.330 -3.903 680 H GLU 88 H GLU 88 6.311 -12.811 -8.425 681 HA GLU 88 HA GLU 88 3.504 -12.093 -8.681 682 HB2 GLU 88 1HB GLU 88 5.444 -13.425 -10.594 683 HB3 GLU 88 2HB GLU 88 3.777 -13.016 -11.002 684 HG2 GLU 88 1HG GLU 88 4.215 -10.650 -10.575 685 HG3 GLU 88 2HG GLU 88 5.857 -11.022 -10.055 686 H VAL 89 H VAL 89 1.775 -13.549 -8.847 687 HA VAL 89 HA VAL 89 2.365 -16.327 -7.984 688 HB VAL 89 HB VAL 89 -0.301 -14.948 -7.897 689 HG11 VAL 89 1HG1 VAL 89 0.810 -17.315 -6.378 690 HG12 VAL 89 2HG1 VAL 89 -0.240 -17.429 -7.790 691 HG13 VAL 89 3HG1 VAL 89 -0.842 -16.705 -6.299 692 HG21 VAL 89 3HG2 VAL 89 0.237 -14.685 -5.420 693 HG22 VAL 89 1HG2 VAL 89 1.110 -13.601 -6.503 694 HG23 VAL 89 2HG2 VAL 89 1.915 -15.025 -5.842 695 H SER 90 H SER 90 1.791 -17.989 -9.215 696 HA SER 90 HA SER 90 1.542 -17.947 -11.896 697 HB2 SER 90 1HB SER 90 0.794 -20.178 -11.820 698 HB3 SER 90 2HB SER 90 1.704 -19.963 -10.328 699 HG SER 90 HG SER 90 -0.926 -19.242 -10.120 700 HA PRO 91 HA PRO 91 -2.534 -16.070 -12.421 701 HB2 PRO 91 1HB PRO 91 -2.674 -16.095 -15.147 702 HB3 PRO 91 2HB PRO 91 -1.658 -14.951 -14.246 703 HG2 PRO 91 1HG PRO 91 -0.881 -17.464 -15.656 704 HG3 PRO 91 2HG PRO 91 -0.032 -15.909 -15.571 705 HD2 PRO 91 1HD PRO 91 0.636 -18.103 -14.027 706 HD3 PRO 91 2HD PRO 91 0.975 -16.423 -13.554 707 H ASP 92 H ASP 92 -1.886 -18.730 -14.722 708 HA ASP 92 HA ASP 92 -3.154 -20.534 -15.374 709 HB2 ASP 92 1HB ASP 92 -4.103 -20.226 -12.521 710 HB3 ASP 92 2HB ASP 92 -4.666 -21.520 -13.573 711 H GLY 93 H GLY 93 -4.025 -17.914 -16.061 712 HA2 GLY 93 1HA GLY 93 -6.938 -18.389 -16.370 713 HA3 GLY 93 2HA GLY 93 -6.328 -16.801 -15.914 714 H GLU 94 H GLU 94 -7.226 -18.735 -18.518 715 HA GLU 94 HA GLU 94 -5.522 -17.366 -20.463 716 HB2 GLU 94 1HB GLU 94 -5.726 -19.750 -20.754 717 HB3 GLU 94 2HB GLU 94 -7.486 -19.658 -20.693 718 HG2 GLU 94 1HG GLU 94 -6.694 -19.846 -22.999 719 HG3 GLU 94 2HG GLU 94 -7.488 -18.307 -22.739 720 H LEU 95 H LEU 95 -8.973 -18.271 -20.588 721 HA LEU 95 HA LEU 95 -9.655 -16.016 -22.195 722 HB2 LEU 95 1HB LEU 95 -12.064 -16.738 -21.516 723 HB3 LEU 95 2HB LEU 95 -11.103 -17.840 -22.497 724 HG LEU 95 HG LEU 95 -10.799 -18.129 -19.530 725 HD11 LEU 95 1HD1 LEU 95 -13.347 -18.807 -21.013 726 HD12 LEU 95 2HD1 LEU 95 -13.170 -17.894 -19.515 727 HD13 LEU 95 3HD1 LEU 95 -12.872 -19.632 -19.527 728 HD21 LEU 95 3HD2 LEU 95 -9.769 -19.549 -21.485 729 HD22 LEU 95 1HD2 LEU 95 -11.360 -20.305 -21.550 730 HD23 LEU 95 2HD2 LEU 95 -10.403 -20.387 -20.070 731 H TYR 96 H TYR 96 -8.333 -14.867 -20.214 732 HA TYR 96 HA TYR 96 -10.331 -13.194 -18.962 733 HB2 TYR 96 1HB TYR 96 -9.737 -15.291 -17.465 734 HB3 TYR 96 2HB TYR 96 -8.319 -14.331 -17.057 735 HD1 TYR 96 HD2 TYR 96 -12.016 -14.426 -17.027 736 HD2 TYR 96 HD1 TYR 96 -8.507 -12.357 -15.674 737 HE1 TYR 96 HE2 TYR 96 -13.405 -13.107 -15.451 738 HE2 TYR 96 HE1 TYR 96 -9.898 -11.036 -14.099 739 HH TYR 96 HH TYR 96 -13.185 -10.794 -14.306 740 H ILE 97 H ILE 97 -6.934 -13.930 -18.456 741 HA ILE 97 HA ILE 97 -5.019 -12.662 -18.576 742 HB ILE 97 HB ILE 97 -6.648 -10.874 -20.380 743 HG12 ILE 97 1HG1 ILE 97 -4.970 -12.687 -21.870 744 HG13 ILE 97 2HG1 ILE 97 -5.897 -13.657 -20.731 745 HG21 ILE 97 1HG2 ILE 97 -3.720 -11.146 -19.780 746 HG22 ILE 97 2HG2 ILE 97 -4.668 -9.692 -20.085 747 HG23 ILE 97 3HG2 ILE 97 -4.202 -10.734 -21.424 748 HD11 ILE 97 3HD1 ILE 97 -7.159 -13.440 -22.787 749 HD12 ILE 97 1HD1 ILE 97 -7.009 -11.685 -22.743 750 HD13 ILE 97 2HD1 ILE 97 -7.976 -12.518 -21.528 751 H LEU 98 H LEU 98 -6.326 -12.259 -16.301 752 HA LEU 98 HA LEU 98 -6.572 -10.781 -14.537 753 HB2 LEU 98 1HB LEU 98 -4.694 -9.260 -16.350 754 HB3 LEU 98 2HB LEU 98 -5.285 -8.540 -14.860 755 HG LEU 98 HG LEU 98 -4.290 -10.273 -13.536 756 HD11 LEU 98 1HD1 LEU 98 -3.845 -11.645 -16.198 757 HD12 LEU 98 2HD1 LEU 98 -4.725 -12.256 -14.798 758 HD13 LEU 98 3HD1 LEU 98 -2.969 -12.114 -14.739 759 HD21 LEU 98 3HD2 LEU 98 -1.956 -9.944 -14.022 760 HD22 LEU 98 1HD2 LEU 98 -2.793 -8.472 -14.511 761 HD23 LEU 98 2HD2 LEU 98 -2.296 -9.647 -15.727 762 H GLY 99 H GLY 99 -6.541 -8.624 -17.372 763 HA2 GLY 99 1HA GLY 99 -8.125 -7.203 -18.245 764 HA3 GLY 99 2HA GLY 99 -9.349 -8.128 -17.376 765 H SER 100 H SER 100 -9.124 -7.817 -14.884 766 HA SER 100 HA SER 100 -8.292 -5.167 -14.051 767 HB2 SER 100 1HB SER 100 -10.565 -4.565 -13.209 768 HB3 SER 100 2HB SER 100 -10.465 -4.621 -14.966 769 HG SER 100 HG SER 100 -12.301 -5.727 -14.173 770 H ASP 101 H ASP 101 -7.556 -7.824 -13.458 771 HA ASP 101 HA ASP 101 -7.937 -7.832 -10.552 772 HB2 ASP 101 1HB ASP 101 -8.606 -10.151 -12.370 773 HB3 ASP 101 2HB ASP 101 -8.235 -10.366 -10.663 774 H VAL 102 H VAL 102 -5.725 -7.148 -10.548 775 HA VAL 102 HA VAL 102 -3.696 -8.868 -11.739 776 HB VAL 102 HB VAL 102 -3.335 -6.485 -9.903 777 HG11 VAL 102 1HG1 VAL 102 -1.494 -8.020 -11.750 778 HG12 VAL 102 2HG1 VAL 102 -1.321 -7.777 -10.011 779 HG13 VAL 102 3HG1 VAL 102 -1.107 -6.420 -11.116 780 HG21 VAL 102 3HG2 VAL 102 -4.632 -5.972 -11.977 781 HG22 VAL 102 1HG2 VAL 102 -3.301 -6.628 -12.927 782 HG23 VAL 102 2HG2 VAL 102 -3.054 -5.185 -11.946 783 H THR 103 H THR 103 -2.228 -10.098 -10.591 784 HA THR 103 HA THR 103 -2.949 -10.650 -7.745 785 HB THR 103 HB THR 103 -1.663 -12.641 -9.618 786 HG1 THR 103 HG1 THR 103 -3.719 -12.002 -10.403 787 HG21 THR 103 3HG2 THR 103 -2.510 -14.236 -7.947 788 HG22 THR 103 1HG2 THR 103 -3.228 -12.909 -7.034 789 HG23 THR 103 2HG2 THR 103 -1.474 -13.031 -7.180 790 H VAL 104 H VAL 104 -1.501 -9.768 -6.494 791 HA VAL 104 HA VAL 104 1.378 -10.144 -7.072 792 HB VAL 104 HB VAL 104 0.555 -7.784 -7.544 793 HG11 VAL 104 1HG1 VAL 104 -0.049 -6.366 -5.697 794 HG12 VAL 104 2HG1 VAL 104 0.312 -7.631 -4.526 795 HG13 VAL 104 3HG1 VAL 104 -1.077 -7.795 -5.602 796 HG21 VAL 104 3HG2 VAL 104 2.913 -8.314 -6.994 797 HG22 VAL 104 1HG2 VAL 104 2.545 -8.131 -5.279 798 HG23 VAL 104 2HG2 VAL 104 2.438 -6.739 -6.357 799 H GLN 105 H GLN 105 2.555 -10.853 -5.350 800 HA GLN 105 HA GLN 105 1.167 -11.041 -2.725 801 HB2 GLN 105 1HB GLN 105 1.595 -13.196 -4.122 802 HB3 GLN 105 2HB GLN 105 3.287 -12.969 -3.688 803 HG2 GLN 105 1HG GLN 105 1.041 -13.084 -1.661 804 HG3 GLN 105 2HG GLN 105 2.007 -14.477 -2.121 805 HE21 GLN 105 2HE2 GLN 105 1.851 -11.890 0.065 806 HE22 GLN 105 1HE2 GLN 105 3.460 -11.936 0.606 807 H LEU 106 H LEU 106 2.125 -9.535 -1.331 808 HA LEU 106 HA LEU 106 4.811 -8.663 -1.781 809 HB2 LEU 106 1HB LEU 106 2.961 -8.180 0.562 810 HB3 LEU 106 2HB LEU 106 4.345 -7.198 0.086 811 HG LEU 106 HG LEU 106 1.815 -7.615 -1.540 812 HD11 LEU 106 1HD1 LEU 106 1.577 -6.151 0.475 813 HD12 LEU 106 2HD1 LEU 106 1.344 -5.279 -1.043 814 HD13 LEU 106 3HD1 LEU 106 2.864 -5.126 -0.162 815 HD21 LEU 106 3HD2 LEU 106 4.410 -6.177 -2.090 816 HD22 LEU 106 1HD2 LEU 106 2.911 -5.658 -2.865 817 HD23 LEU 106 2HD2 LEU 106 3.520 -7.288 -3.132 818 H ASN 107 H ASN 107 6.553 -9.493 -0.951 819 HA ASN 107 HA ASN 107 6.338 -11.403 1.341 820 HB2 ASN 107 1HB ASN 107 8.533 -11.321 -0.709 821 HB3 ASN 107 2HB ASN 107 8.214 -12.574 0.488 822 HD21 ASN 107 2HD2 ASN 107 6.520 -10.903 -2.209 823 HD22 ASN 107 1HD2 ASN 107 5.698 -12.284 -2.742 824 H THR 108 H THR 108 6.477 -9.238 2.622 825 HA THR 108 HA THR 108 9.104 -8.079 2.737 826 HB THR 108 HB THR 108 6.989 -7.775 4.860 827 HG1 THR 108 HG1 THR 108 6.063 -6.187 3.564 828 HG21 THR 108 3HG2 THR 108 8.866 -6.543 5.503 829 HG22 THR 108 1HG2 THR 108 7.942 -5.344 4.611 830 HG23 THR 108 2HG2 THR 108 9.309 -6.141 3.845 831 H ALA 109 H ALA 109 9.910 -7.840 5.132 832 HA ALA 109 HA ALA 109 11.186 -10.187 5.830 833 HB1 ALA 109 3HB ALA 109 11.961 -9.075 7.756 834 HB2 ALA 109 1HB ALA 109 10.504 -8.088 7.878 835 HB3 ALA 109 2HB ALA 109 11.670 -7.784 6.589 836 H GLU 110 H GLU 110 8.146 -8.885 7.169 837 HA GLU 110 HA GLU 110 7.634 -11.553 8.375 838 HB2 GLU 110 1HB GLU 110 6.484 -10.419 10.220 839 HB3 GLU 110 2HB GLU 110 8.166 -9.900 10.125 840 HG2 GLU 110 1HG GLU 110 7.450 -7.890 8.847 841 HG3 GLU 110 2HG GLU 110 5.772 -8.394 9.032 842 H LEU 111 H LEU 111 6.390 -8.713 6.740 843 HA LEU 111 HA LEU 111 3.666 -9.582 6.748 844 HB2 LEU 111 1HB LEU 111 4.789 -7.182 6.299 845 HB3 LEU 111 2HB LEU 111 4.694 -7.723 4.631 846 HG LEU 111 HG LEU 111 2.684 -6.502 5.078 847 HD11 LEU 111 1HD1 LEU 111 1.066 -8.051 4.414 848 HD12 LEU 111 2HD1 LEU 111 1.748 -9.343 5.400 849 HD13 LEU 111 3HD1 LEU 111 2.568 -8.831 3.925 850 HD21 LEU 111 3HD2 LEU 111 1.879 -8.313 7.348 851 HD22 LEU 111 1HD2 LEU 111 1.362 -6.670 6.990 852 HD23 LEU 111 2HD2 LEU 111 2.960 -6.958 7.669 853 H LYS 112 H LYS 112 2.647 -10.877 5.359 854 HA LYS 112 HA LYS 112 3.700 -11.479 2.752 855 HB2 LYS 112 1HB LYS 112 5.023 -12.994 4.243 856 HB3 LYS 112 2HB LYS 112 3.502 -13.749 4.727 857 HG2 LYS 112 1HG LYS 112 3.030 -14.359 2.407 858 HG3 LYS 112 2HG LYS 112 4.495 -13.535 1.870 859 HD2 LYS 112 1HD LYS 112 5.859 -15.070 3.237 860 HD3 LYS 112 2HD LYS 112 4.393 -15.906 3.752 861 HE2 LYS 112 1HE LYS 112 3.896 -16.495 1.413 862 HE3 LYS 112 2HE LYS 112 5.352 -15.647 0.887 863 HZ1 LYS 112 3HZ LYS 112 6.501 -17.480 1.289 864 HZ2 LYS 112 1HZ LYS 112 5.111 -18.274 1.854 865 HZ3 LYS 112 2HZ LYS 112 6.082 -17.390 2.933 866 H LEU 113 H LEU 113 1.760 -10.757 1.985 867 HA LEU 113 HA LEU 113 -0.530 -12.560 2.458 868 HB2 LEU 113 1HB LEU 113 -0.335 -9.741 3.226 869 HB3 LEU 113 2HB LEU 113 -1.693 -10.006 2.142 870 HG LEU 113 HG LEU 113 -2.388 -10.251 4.479 871 HD11 LEU 113 1HD1 LEU 113 -2.425 -13.105 3.565 872 HD12 LEU 113 2HD1 LEU 113 -3.124 -11.900 2.483 873 HD13 LEU 113 3HD1 LEU 113 -3.744 -12.081 4.122 874 HD21 LEU 113 3HD2 LEU 113 -0.833 -12.751 4.919 875 HD22 LEU 113 1HD2 LEU 113 -1.315 -11.501 6.059 876 HD23 LEU 113 2HD2 LEU 113 0.074 -11.240 5.013 877 H VAL 114 H VAL 114 -2.404 -11.626 0.861 878 HA VAL 114 HA VAL 114 -1.161 -11.331 -1.820 879 HB VAL 114 HB VAL 114 -3.475 -13.092 -0.962 880 HG11 VAL 114 1HG1 VAL 114 -3.410 -13.711 -3.476 881 HG12 VAL 114 2HG1 VAL 114 -2.561 -12.179 -3.689 882 HG13 VAL 114 3HG1 VAL 114 -4.194 -12.199 -3.024 883 HG21 VAL 114 3HG2 VAL 114 -1.018 -13.858 -0.723 884 HG22 VAL 114 1HG2 VAL 114 -0.984 -13.873 -2.487 885 HG23 VAL 114 2HG2 VAL 114 -2.108 -14.917 -1.618 886 H PHE 115 H PHE 115 -1.996 -9.706 -3.039 887 HA PHE 115 HA PHE 115 -4.591 -8.529 -2.242 888 HB2 PHE 115 1HB PHE 115 -1.994 -7.141 -2.896 889 HB3 PHE 115 2HB PHE 115 -3.546 -6.316 -3.064 890 HD1 PHE 115 HD1 PHE 115 -1.386 -8.153 -0.635 891 HD2 PHE 115 HD2 PHE 115 -4.686 -5.455 -1.175 892 HE1 PHE 115 HE1 PHE 115 -1.413 -7.694 1.802 893 HE2 PHE 115 HE2 PHE 115 -4.713 -5.003 1.258 894 HZ PHE 115 HZ PHE 115 -3.079 -6.122 2.749 895 H GLN 116 H GLN 116 -5.942 -7.978 -3.826 896 HA GLN 116 HA GLN 116 -5.213 -8.709 -6.584 897 HB2 GLN 116 1HB GLN 116 -7.845 -8.638 -5.138 898 HB3 GLN 116 2HB GLN 116 -7.756 -8.721 -6.893 899 HG2 GLN 116 1HG GLN 116 -6.229 -10.670 -5.167 900 HG3 GLN 116 2HG GLN 116 -7.923 -10.949 -5.566 901 HE21 GLN 116 2HE2 GLN 116 -6.390 -9.221 -8.069 902 HE22 GLN 116 1HE2 GLN 116 -6.062 -10.531 -9.094 903 H LEU 117 H LEU 117 -4.292 -6.766 -7.278 904 HA LEU 117 HA LEU 117 -5.818 -4.287 -6.997 905 HB2 LEU 117 1HB LEU 117 -3.179 -4.656 -8.411 906 HB3 LEU 117 2HB LEU 117 -3.830 -3.181 -7.699 907 HG LEU 117 HG LEU 117 -2.829 -5.648 -6.249 908 HD11 LEU 117 1HD1 LEU 117 -1.180 -4.183 -5.327 909 HD12 LEU 117 2HD1 LEU 117 -2.019 -2.749 -5.918 910 HD13 LEU 117 3HD1 LEU 117 -1.219 -3.835 -7.056 911 HD21 LEU 117 3HD2 LEU 117 -4.523 -3.340 -5.286 912 HD22 LEU 117 1HD2 LEU 117 -3.423 -4.170 -4.182 913 HD23 LEU 117 2HD2 LEU 117 -4.720 -5.065 -4.974 914 HA PRO 118 HA PRO 118 -7.497 -4.667 -11.099 915 HB2 PRO 118 1HB PRO 118 -8.038 -2.083 -11.750 916 HB3 PRO 118 2HB PRO 118 -8.938 -2.955 -10.491 917 HG2 PRO 118 1HG PRO 118 -6.709 -0.991 -10.204 918 HG3 PRO 118 2HG PRO 118 -8.200 -1.146 -9.257 919 HD2 PRO 118 1HD PRO 118 -5.766 -2.116 -8.404 920 HD3 PRO 118 2HD PRO 118 -7.325 -2.807 -7.901 921 H PHE 119 H PHE 119 -6.752 -4.875 -13.153 922 HA PHE 119 HA PHE 119 -4.271 -4.786 -14.010 923 HB2 PHE 119 1HB PHE 119 -6.258 -5.609 -15.244 924 HB3 PHE 119 2HB PHE 119 -6.588 -3.942 -15.718 925 HD1 PHE 119 HD2 PHE 119 -3.976 -6.600 -15.836 926 HD2 PHE 119 HD1 PHE 119 -5.467 -2.956 -17.550 927 HE1 PHE 119 HE2 PHE 119 -2.352 -6.811 -17.697 928 HE2 PHE 119 HE1 PHE 119 -3.844 -3.166 -19.412 929 HZ PHE 119 HZ PHE 119 -2.286 -5.094 -19.486 930 H GLY 120 H GLY 120 -2.716 -3.423 -14.254 931 HA2 GLY 120 1HA GLY 120 -1.663 -1.337 -14.177 932 HA3 GLY 120 2HA GLY 120 -2.358 -1.310 -15.793 933 H SER 121 H SER 121 -3.040 0.726 -16.090 934 HA SER 121 HA SER 121 -4.148 2.715 -15.763 935 HB2 SER 121 1HB SER 121 -6.409 2.522 -14.952 936 HB3 SER 121 2HB SER 121 -6.048 1.065 -15.871 937 HG SER 121 HG SER 121 -5.768 -0.044 -13.974 938 H HIS 122 H HIS 122 -5.799 2.354 -12.938 939 HA HIS 122 HA HIS 122 -4.213 4.235 -11.526 940 HB2 HIS 122 1HB HIS 122 -6.708 3.833 -11.267 941 HB3 HIS 122 2HB HIS 122 -6.295 2.404 -10.321 942 HD2 HIS 122 HD2 HIS 122 -6.345 3.098 -7.657 943 HE1 HIS 122 HE1 HIS 122 -4.894 7.044 -8.016 944 HE2 HIS 122 HE2 HIS 122 -5.698 5.280 -6.378 945 H THR 123 H THR 123 -3.794 0.911 -12.003 946 HA THR 123 HA THR 123 -2.416 0.499 -9.430 947 HB THR 123 HB THR 123 -2.995 -1.441 -11.675 948 HG1 THR 123 HG1 THR 123 -4.560 -2.174 -10.301 949 HG21 THR 123 3HG2 THR 123 -1.664 -1.744 -8.979 950 HG22 THR 123 1HG2 THR 123 -1.005 -2.164 -10.559 951 HG23 THR 123 2HG2 THR 123 -2.323 -3.107 -9.880 952 H ARG 124 H ARG 124 -1.728 0.783 -12.897 953 HA ARG 124 HA ARG 124 0.853 -0.243 -12.949 954 HB2 ARG 124 1HB ARG 124 -0.283 0.318 -14.988 955 HB3 ARG 124 2HB ARG 124 -0.435 2.006 -14.510 956 HG2 ARG 124 1HG ARG 124 2.032 2.253 -14.611 957 HG3 ARG 124 2HG ARG 124 2.174 0.554 -15.062 958 HD2 ARG 124 1HD ARG 124 2.290 2.088 -16.982 959 HD3 ARG 124 2HD ARG 124 0.933 0.972 -17.106 960 HE ARG 124 HE ARG 124 0.091 3.376 -15.855 961 HH11 ARG 124 1HH2 ARG 124 1.132 2.096 -18.899 962 HH12 ARG 124 2HH2 ARG 124 0.221 3.225 -19.843 963 HH21 ARG 124 1HH1 ARG 124 -1.112 4.860 -17.093 964 HH22 ARG 124 2HH1 ARG 124 -1.049 4.788 -18.822 965 H THR 125 H THR 125 -0.209 3.053 -12.242 966 HA THR 125 HA THR 125 2.315 4.219 -12.121 967 HB THR 125 HB THR 125 0.369 5.638 -12.137 968 HG1 THR 125 HG1 THR 125 0.799 6.909 -10.285 969 HG21 THR 125 3HG2 THR 125 -0.383 4.506 -9.434 970 HG22 THR 125 1HG2 THR 125 -1.098 3.948 -10.943 971 HG23 THR 125 2HG2 THR 125 -1.322 5.617 -10.424 972 H PHE 126 H PHE 126 0.354 2.661 -9.631 973 HA PHE 126 HA PHE 126 1.932 3.163 -7.399 974 HB2 PHE 126 1HB PHE 126 -0.276 2.163 -7.209 975 HB3 PHE 126 2HB PHE 126 0.285 0.706 -8.029 976 HD1 PHE 126 HD1 PHE 126 1.361 2.894 -5.152 977 HD2 PHE 126 HD2 PHE 126 0.844 -1.101 -6.657 978 HE1 PHE 126 HE1 PHE 126 2.122 1.976 -2.986 979 HE2 PHE 126 HE2 PHE 126 1.615 -2.012 -4.484 980 HZ PHE 126 HZ PHE 126 2.252 -0.472 -2.649 981 H LEU 127 H LEU 127 2.129 0.347 -9.631 982 HA LEU 127 HA LEU 127 4.113 -1.046 -8.353 983 HB2 LEU 127 1HB LEU 127 3.963 -0.675 -11.349 984 HB3 LEU 127 2HB LEU 127 4.619 -2.058 -10.476 985 HG LEU 127 HG LEU 127 1.738 -1.156 -10.457 986 HD11 LEU 127 1HD1 LEU 127 1.317 -3.181 -11.757 987 HD12 LEU 127 2HD1 LEU 127 3.032 -3.593 -11.700 988 HD13 LEU 127 3HD1 LEU 127 2.496 -2.167 -12.590 989 HD21 LEU 127 3HD2 LEU 127 2.079 -2.191 -8.360 990 HD22 LEU 127 1HD2 LEU 127 3.234 -3.351 -9.021 991 HD23 LEU 127 2HD2 LEU 127 1.513 -3.518 -9.371 992 H GLN 128 H GLN 128 4.571 1.512 -10.850 993 HA GLN 128 HA GLN 128 7.338 1.385 -10.893 994 HB2 GLN 128 1HB GLN 128 5.403 3.600 -11.522 995 HB3 GLN 128 2HB GLN 128 7.128 3.655 -11.904 996 HG2 GLN 128 1HG GLN 128 6.949 1.686 -13.296 997 HG3 GLN 128 2HG GLN 128 5.282 1.420 -12.783 998 HE21 GLN 128 2HE2 GLN 128 3.634 2.741 -13.691 999 HE22 GLN 128 1HE2 GLN 128 3.931 3.773 -14.989 1000 H GLU 129 H GLU 129 5.171 3.397 -8.902 1001 HA GLU 129 HA GLU 129 7.144 5.053 -7.781 1002 HB2 GLU 129 1HB GLU 129 4.512 4.117 -6.615 1003 HB3 GLU 129 2HB GLU 129 5.510 5.394 -5.931 1004 HG2 GLU 129 1HG GLU 129 4.425 5.431 -8.749 1005 HG3 GLU 129 2HG GLU 129 3.674 6.257 -7.389 1006 H VAL 130 H VAL 130 5.861 1.945 -6.655 1007 HA VAL 130 HA VAL 130 7.359 1.855 -4.250 1008 HB VAL 130 HB VAL 130 6.164 -0.343 -5.943 1009 HG11 VAL 130 1HG1 VAL 130 7.542 -0.416 -3.250 1010 HG12 VAL 130 2HG1 VAL 130 7.883 -1.405 -4.670 1011 HG13 VAL 130 3HG1 VAL 130 6.397 -1.658 -3.756 1012 HG21 VAL 130 3HG2 VAL 130 4.633 1.336 -4.866 1013 HG22 VAL 130 1HG2 VAL 130 5.298 0.868 -3.301 1014 HG23 VAL 130 2HG2 VAL 130 4.410 -0.308 -4.268 1015 H ALA 131 H ALA 131 7.951 0.539 -7.470 1016 HA ALA 131 HA ALA 131 10.306 -0.854 -7.035 1017 HB1 ALA 131 3HB ALA 131 8.981 -0.774 -9.169 1018 HB2 ALA 131 1HB ALA 131 10.729 -0.672 -9.386 1019 HB3 ALA 131 2HB ALA 131 9.738 0.782 -9.509 1020 H ARG 132 H ARG 132 10.007 2.601 -7.882 1021 HA ARG 132 HA ARG 132 12.867 2.999 -7.776 1022 HB2 ARG 132 1HB ARG 132 12.372 5.321 -8.228 1023 HB3 ARG 132 2HB ARG 132 11.338 4.323 -9.250 1024 HG2 ARG 132 1HG ARG 132 9.494 4.581 -7.627 1025 HG3 ARG 132 2HG ARG 132 10.511 5.613 -6.626 1026 HD2 ARG 132 1HD ARG 132 10.772 7.148 -8.586 1027 HD3 ARG 132 2HD ARG 132 9.597 6.160 -9.451 1028 HE ARG 132 HE ARG 132 7.901 7.009 -8.067 1029 HH11 ARG 132 1HH2 ARG 132 11.062 7.933 -7.000 1030 HH12 ARG 132 2HH2 ARG 132 10.490 9.127 -5.885 1031 HH21 ARG 132 1HH1 ARG 132 7.143 8.577 -6.597 1032 HH22 ARG 132 2HH1 ARG 132 8.274 9.491 -5.655 1033 H ALA 133 H ALA 133 10.280 3.030 -5.528 1034 HA ALA 133 HA ALA 133 11.063 4.876 -3.630 1035 HB1 ALA 133 3HB ALA 133 9.685 3.720 -2.104 1036 HB2 ALA 133 1HB ALA 133 9.969 2.169 -2.893 1037 HB3 ALA 133 2HB ALA 133 8.988 3.396 -3.688 1038 H CYS 134 H CYS 134 12.797 2.136 -4.620 1039 HA CYS 134 HA CYS 134 15.074 2.625 -3.244 1040 HB2 CYS 134 1HB CYS 134 13.108 1.462 -1.389 1041 HB3 CYS 134 2HB CYS 134 14.624 0.572 -1.415 1042 HG CYS 134 HG CYS 134 14.235 3.237 -0.113 1043 HA PRO 135 HA PRO 135 15.043 -2.167 -4.314 1044 HB2 PRO 135 1HB PRO 135 12.685 -2.098 -6.159 1045 HB3 PRO 135 2HB PRO 135 13.237 -3.392 -5.072 1046 HG2 PRO 135 1HG PRO 135 11.138 -1.902 -4.444 1047 HG3 PRO 135 2HG PRO 135 12.309 -2.393 -3.201 1048 HD2 PRO 135 1HD PRO 135 11.989 0.282 -4.537 1049 HD3 PRO 135 2HD PRO 135 12.396 -0.098 -2.853 1050 H GLY 136 H GLY 136 13.787 0.180 -6.696 1051 HA2 GLY 136 1HA GLY 136 14.432 -0.209 -9.101 1052 HA3 GLY 136 2HA GLY 136 15.285 1.144 -8.369 1053 H PHE 137 H PHE 137 15.458 -2.262 -9.135 1054 HA PHE 137 HA PHE 137 17.404 -3.670 -8.764 1055 HB2 PHE 137 1HB PHE 137 17.504 -2.130 -11.356 1056 HB3 PHE 137 2HB PHE 137 18.480 -3.563 -11.036 1057 HD1 PHE 137 HD2 PHE 137 15.059 -2.288 -11.588 1058 HD2 PHE 137 HD1 PHE 137 17.458 -5.773 -10.834 1059 HE1 PHE 137 HE2 PHE 137 13.149 -3.742 -12.216 1060 HE2 PHE 137 HE1 PHE 137 15.547 -7.223 -11.461 1061 HZ PHE 137 HZ PHE 137 13.394 -6.209 -12.153 1062 H ASP 138 H ASP 138 18.258 -2.087 -6.954 1063 HA ASP 138 HA ASP 138 20.624 -0.572 -7.791 1064 HB2 ASP 138 1HB ASP 138 19.003 -0.814 -5.277 1065 HB3 ASP 138 2HB ASP 138 20.667 -0.243 -5.154 1066 HA PRO 139 HA PRO 139 23.357 -3.928 -6.897 1067 HB2 PRO 139 1HB PRO 139 25.667 -2.647 -6.184 1068 HB3 PRO 139 2HB PRO 139 25.050 -2.667 -7.848 1069 HG2 PRO 139 1HG PRO 139 24.834 -0.525 -5.780 1070 HG3 PRO 139 2HG PRO 139 25.171 -0.385 -7.514 1071 HD2 PRO 139 1HD PRO 139 22.687 0.090 -6.437 1072 HD3 PRO 139 2HD PRO 139 22.925 -0.502 -8.096 1073 H GLU 140 H GLU 140 23.823 -1.391 -4.416 1074 HA GLU 140 HA GLU 140 23.489 -3.445 -2.310 1075 HB2 GLU 140 1HB GLU 140 25.737 -1.433 -2.527 1076 HB3 GLU 140 2HB GLU 140 25.384 -2.376 -1.078 1077 HG2 GLU 140 1HG GLU 140 25.713 -4.460 -2.317 1078 HG3 GLU 140 2HG GLU 140 25.976 -3.557 -3.806 1079 H THR 141 H THR 141 21.642 -1.478 -3.288 1080 HA THR 141 HA THR 141 21.309 0.922 -2.140 1081 HB THR 141 HB THR 141 19.396 0.316 -3.274 1082 HG1 THR 141 HG1 THR 141 17.921 -0.574 -1.361 1083 HG21 THR 141 3HG2 THR 141 19.573 -2.379 -1.886 1084 HG22 THR 141 1HG2 THR 141 19.986 -2.033 -3.563 1085 HG23 THR 141 2HG2 THR 141 18.310 -1.926 -3.030 1086 H ARG 142 H ARG 142 19.472 -1.483 -0.396 1087 HA ARG 142 HA ARG 142 18.996 -1.708 1.840 1088 HB2 ARG 142 1HB ARG 142 22.008 -1.451 1.930 1089 HB3 ARG 142 2HB ARG 142 21.010 -1.974 3.287 1090 HG2 ARG 142 1HG ARG 142 20.154 -3.852 1.980 1091 HG3 ARG 142 2HG ARG 142 21.075 -3.316 0.574 1092 HD2 ARG 142 1HD ARG 142 22.337 -4.032 3.229 1093 HD3 ARG 142 2HD ARG 142 22.182 -5.160 1.884 1094 HE ARG 142 HE ARG 142 23.416 -2.840 0.908 1095 HH11 ARG 142 1HH2 ARG 142 23.977 -5.395 3.171 1096 HH12 ARG 142 2HH2 ARG 142 25.697 -5.366 2.986 1097 HH21 ARG 142 1HH1 ARG 142 25.668 -2.794 0.660 1098 HH22 ARG 142 2HH1 ARG 142 26.657 -3.891 1.564 1099 H ASP 143 H ASP 143 19.963 -0.765 4.101 1100 HA ASP 143 HA ASP 143 20.305 1.080 5.476 1101 HB2 ASP 143 1HB ASP 143 21.398 2.092 3.300 1102 HB3 ASP 143 2HB ASP 143 19.894 3.001 3.194 1103 HA PRO 144 HA PRO 144 15.674 1.570 4.838 1104 HB2 PRO 144 1HB PRO 144 14.768 -0.163 6.741 1105 HB3 PRO 144 2HB PRO 144 15.145 -0.674 5.082 1106 HG2 PRO 144 1HG PRO 144 16.799 -0.935 7.559 1107 HG3 PRO 144 2HG PRO 144 16.527 -2.112 6.257 1108 HD2 PRO 144 1HD PRO 144 18.795 -0.565 6.409 1109 HD3 PRO 144 2HD PRO 144 18.124 -1.145 4.867 1110 H GLU 145 H GLU 145 14.116 2.343 6.479 1111 HA GLU 145 HA GLU 145 15.074 3.177 9.075 1112 HB2 GLU 145 1HB GLU 145 16.052 4.918 7.528 1113 HB3 GLU 145 2HB GLU 145 14.407 5.349 7.071 1114 HG2 GLU 145 1HG GLU 145 13.881 5.879 9.422 1115 HG3 GLU 145 2HG GLU 145 15.522 5.440 9.891 1116 H PHE 146 H PHE 146 13.347 3.978 10.392 1117 HA PHE 146 HA PHE 146 10.703 4.338 9.328 1118 HB2 PHE 146 1HB PHE 146 9.895 2.260 10.759 1119 HB3 PHE 146 2HB PHE 146 10.467 2.034 9.110 1120 HD1 PHE 146 HD2 PHE 146 11.575 1.991 12.672 1121 HD2 PHE 146 HD1 PHE 146 12.351 0.678 8.656 1122 HE1 PHE 146 HE2 PHE 146 13.376 0.506 13.506 1123 HE2 PHE 146 HE1 PHE 146 14.152 -0.805 9.490 1124 HZ PHE 146 HZ PHE 146 14.665 -0.893 11.916 1125 H GLU 147 H GLU 147 13.026 4.536 11.688 1126 HA GLU 147 HA GLU 147 11.775 4.620 14.132 1127 HB2 GLU 147 1HB GLU 147 13.968 6.398 13.062 1128 HB3 GLU 147 2HB GLU 147 13.493 6.335 14.759 1129 HG2 GLU 147 1HG GLU 147 14.019 3.947 14.849 1130 HG3 GLU 147 2HG GLU 147 14.422 3.951 13.132 1131 H TRP 148 H TRP 148 11.053 6.658 11.498 1132 HA TRP 148 HA TRP 148 10.017 8.806 13.226 1133 HB2 TRP 148 1HB TRP 148 9.658 10.031 11.109 1134 HB3 TRP 148 2HB TRP 148 11.336 9.542 11.334 1135 HD1 TRP 148 HD1 TRP 148 12.176 7.390 9.933 1136 HE1 TRP 148 HE1 TRP 148 11.420 6.489 7.638 1137 HE3 TRP 148 HE3 TRP 148 7.690 9.786 9.478 1138 HZ2 TRP 148 HZ2 TRP 148 9.211 6.750 5.848 1139 HZ3 TRP 148 HZ3 TRP 148 6.281 9.444 7.466 1140 HH2 TRP 148 HH2 TRP 148 7.032 7.926 5.646 1141 H LEU 149 H LEU 149 8.884 6.234 11.053 1142 HA LEU 149 HA LEU 149 6.108 7.099 11.525 1143 HB2 LEU 149 1HB LEU 149 5.563 5.438 9.715 1144 HB3 LEU 149 2HB LEU 149 6.515 6.825 9.196 1145 HG LEU 149 HG LEU 149 8.591 5.413 9.483 1146 HD11 LEU 149 1HD1 LEU 149 6.496 3.364 10.175 1147 HD12 LEU 149 2HD1 LEU 149 8.076 3.638 10.903 1148 HD13 LEU 149 3HD1 LEU 149 7.960 2.839 9.346 1149 HD21 LEU 149 3HD2 LEU 149 6.821 3.945 7.546 1150 HD22 LEU 149 1HD2 LEU 149 8.454 4.568 7.326 1151 HD23 LEU 149 2HD2 LEU 149 7.080 5.665 7.291 1152 H SER 150 H SER 150 8.304 5.275 13.003 1153 HA SER 150 HA SER 150 7.075 2.753 13.328 1154 HB2 SER 150 1HB SER 150 8.984 4.301 15.078 1155 HB3 SER 150 2HB SER 150 8.512 2.632 15.379 1156 HG SER 150 HG SER 150 9.514 2.014 13.541 1157 H ARG 151 H ARG 151 7.141 5.647 15.512 1158 HA ARG 151 HA ARG 151 5.400 4.631 17.419 1159 HB2 ARG 151 1HB ARG 151 5.112 7.025 17.992 1160 HB3 ARG 151 2HB ARG 151 6.809 6.628 17.719 1161 HG2 ARG 151 1HG ARG 151 6.404 7.371 15.270 1162 HG3 ARG 151 2HG ARG 151 4.912 8.092 15.872 1163 HD2 ARG 151 1HD ARG 151 7.667 8.693 16.969 1164 HD3 ARG 151 2HD ARG 151 6.810 9.705 15.810 1165 HE ARG 151 HE ARG 151 6.237 9.450 18.648 1166 HH11 ARG 151 1HH2 ARG 151 5.123 10.352 15.498 1167 HH12 ARG 151 2HH2 ARG 151 3.911 11.440 16.087 1168 HH21 ARG 151 1HH1 ARG 151 4.653 10.875 19.427 1169 HH22 ARG 151 2HH1 ARG 151 3.644 11.737 18.314 1170 H HIS 152 H HIS 152 4.886 6.462 14.457 1171 HA HIS 152 HA HIS 152 2.184 7.013 14.669 1172 HB2 HIS 152 1HB HIS 152 4.045 6.499 12.374 1173 HB3 HIS 152 2HB HIS 152 2.323 6.591 12.028 1174 HD2 HIS 152 HD2 HIS 152 5.051 9.034 11.891 1175 HE1 HIS 152 HE1 HIS 152 1.858 11.258 13.504 1176 HE2 HIS 152 HE2 HIS 152 4.148 11.417 12.422 1177 H THR 153 H THR 153 2.630 4.802 12.102 1178 HA THR 153 HA THR 153 1.443 2.916 11.545 1179 HB THR 153 HB THR 153 2.559 2.297 14.262 1180 HG1 THR 153 HG1 THR 153 3.493 0.707 12.481 1181 HG21 THR 153 3HG2 THR 153 1.992 -0.130 13.643 1182 HG22 THR 153 1HG2 THR 153 0.847 0.558 12.489 1183 HG23 THR 153 2HG2 THR 153 0.655 0.874 14.213 1184 H CYS 154 H CYS 154 -0.635 3.188 11.289 1185 HA CYS 154 HA CYS 154 -2.876 3.375 11.702 1186 HB2 CYS 154 1HB CYS 154 -3.763 1.732 13.042 1187 HB3 CYS 154 2HB CYS 154 -2.119 1.122 12.865 1188 HG CYS 154 HG CYS 154 -2.630 2.924 15.329 1189 H ALA 155 H ALA 155 -4.153 4.943 12.440 1190 HA ALA 155 HA ALA 155 -3.211 7.063 13.971 1191 HB1 ALA 155 3HB ALA 155 -5.409 7.919 13.953 1192 HB2 ALA 155 1HB ALA 155 -6.132 6.311 13.936 1193 HB3 ALA 155 2HB ALA 155 -5.325 6.930 12.495 1194 H GLU 156 H GLU 156 -3.266 7.611 16.118 1195 HA GLU 156 HA GLU 156 -3.784 5.415 18.010 1196 HB2 GLU 156 1HB GLU 156 -2.280 8.014 18.284 1197 HB3 GLU 156 2HB GLU 156 -2.588 6.914 19.629 1198 HG2 GLU 156 1HG GLU 156 -1.374 5.133 18.555 1199 HG3 GLU 156 2HG GLU 156 -1.242 6.051 17.056 1200 HA PRO 157 HA PRO 157 -7.789 7.522 18.731 1201 HB2 PRO 157 1HB PRO 157 -7.684 5.631 21.068 1202 HB3 PRO 157 2HB PRO 157 -9.038 5.992 19.973 1203 HG2 PRO 157 1HG PRO 157 -7.676 3.763 19.680 1204 HG3 PRO 157 2HG PRO 157 -8.157 4.710 18.260 1205 HD2 PRO 157 1HD PRO 157 -5.448 4.482 19.538 1206 HD3 PRO 157 2HD PRO 157 -5.883 4.610 17.815 1207 H ASP 158 H ASP 158 -8.665 8.856 20.405 1208 HA ASP 158 HA ASP 158 -6.578 10.082 22.091 1209 HB2 ASP 158 1HB ASP 158 -7.839 11.537 20.557 1210 HB3 ASP 158 2HB ASP 158 -9.340 11.079 21.358 1211 H ALA 159 H ALA 159 -6.454 8.921 23.945 1212 HA ALA 159 HA ALA 159 -8.696 7.806 25.304 1213 HB1 ALA 159 3HB ALA 159 -7.021 7.581 27.198 1214 HB2 ALA 159 1HB ALA 159 -5.846 8.352 26.132 1215 HB3 ALA 159 2HB ALA 159 -6.565 6.809 25.679 1216 H GLU 160 H GLU 160 -6.852 10.806 25.663 1217 HA GLU 160 HA GLU 160 -8.249 11.638 28.036 1218 HB2 GLU 160 1HB GLU 160 -6.420 13.087 26.117 1219 HB3 GLU 160 2HB GLU 160 -7.112 13.838 27.553 1220 HG2 GLU 160 1HG GLU 160 -6.065 12.129 28.973 1221 HG3 GLU 160 2HG GLU 160 -5.403 11.332 27.546 1222 H SER 161 H SER 161 -10.306 11.021 26.540 1223 HA SER 161 HA SER 161 -11.619 13.552 26.089 1224 HB2 SER 161 1HB SER 161 -12.280 12.982 23.740 1225 HB3 SER 161 2HB SER 161 -10.569 13.352 23.926 1226 HG SER 161 HG SER 161 -10.219 11.067 24.071 Start of MODEL 16 1 H1 GLY 1 1H GLY 1 -5.971 12.341 -14.809 2 H2 GLY 1 2H GLY 1 -7.346 12.626 -13.852 3 H3 GLY 1 3H GLY 1 -6.103 11.618 -13.280 4 HA2 GLY 1 1HA GLY 1 -4.629 13.390 -12.963 5 HA3 GLY 1 2HA GLY 1 -5.641 14.469 -13.925 6 HA PRO 2 HA PRO 2 -6.473 15.110 -9.332 7 HB2 PRO 2 1HB PRO 2 -6.726 17.887 -10.434 8 HB3 PRO 2 2HB PRO 2 -5.926 17.332 -8.949 9 HG2 PRO 2 1HG PRO 2 -4.502 18.040 -11.077 10 HG3 PRO 2 2HG PRO 2 -4.016 16.660 -10.072 11 HD2 PRO 2 1HD PRO 2 -5.341 16.653 -12.768 12 HD3 PRO 2 2HD PRO 2 -4.109 15.548 -12.117 13 H LEU 3 H LEU 3 -8.047 16.275 -12.274 14 HA LEU 3 HA LEU 3 -10.538 16.975 -11.152 15 HB2 LEU 3 1HB LEU 3 -9.799 16.020 -13.924 16 HB3 LEU 3 2HB LEU 3 -11.398 16.621 -13.496 17 HG LEU 3 HG LEU 3 -8.845 18.204 -13.078 18 HD11 LEU 3 1HD1 LEU 3 -10.772 18.111 -15.403 19 HD12 LEU 3 2HD1 LEU 3 -9.014 17.958 -15.432 20 HD13 LEU 3 3HD1 LEU 3 -9.757 19.520 -15.088 21 HD21 LEU 3 3HD2 LEU 3 -10.711 20.088 -13.183 22 HD22 LEU 3 1HD2 LEU 3 -10.444 19.202 -11.686 23 HD23 LEU 3 2HD2 LEU 3 -11.789 18.767 -12.737 24 H GLY 4 H GLY 4 -9.298 13.909 -12.423 25 HA2 GLY 4 1HA GLY 4 -11.598 12.522 -11.154 26 HA3 GLY 4 2HA GLY 4 -11.005 12.067 -12.752 27 H SER 5 H SER 5 -10.445 9.972 -12.114 28 HA SER 5 HA SER 5 -9.217 8.307 -11.074 29 HB2 SER 5 1HB SER 5 -6.791 8.668 -11.292 30 HB3 SER 5 2HB SER 5 -7.647 9.198 -12.736 31 HG SER 5 HG SER 5 -7.602 11.236 -11.069 32 H MET 6 H MET 6 -6.606 9.370 -9.664 33 HA MET 6 HA MET 6 -6.013 9.330 -7.418 34 HB2 MET 6 1HB MET 6 -7.766 11.744 -7.842 35 HB3 MET 6 2HB MET 6 -7.073 11.422 -6.253 36 HG2 MET 6 1HG MET 6 -5.660 12.928 -7.702 37 HG3 MET 6 2HG MET 6 -4.827 11.479 -7.143 38 HE1 MET 6 3HE MET 6 -3.147 10.396 -9.102 39 HE2 MET 6 1HE MET 6 -3.170 12.115 -8.681 40 HE3 MET 6 2HE MET 6 -3.085 11.619 -10.368 41 H ASP 7 H ASP 7 -8.832 10.817 -6.240 42 HA ASP 7 HA ASP 7 -10.520 10.136 -4.858 43 HB2 ASP 7 1HB ASP 7 -11.117 8.753 -6.884 44 HB3 ASP 7 2HB ASP 7 -10.240 7.420 -6.139 45 H GLN 8 H GLN 8 -8.112 7.589 -5.183 46 HA GLN 8 HA GLN 8 -8.381 6.810 -2.396 47 HB2 GLN 8 1HB GLN 8 -6.897 5.824 -4.795 48 HB3 GLN 8 2HB GLN 8 -6.168 5.476 -3.234 49 HG2 GLN 8 1HG GLN 8 -7.592 3.635 -3.823 50 HG3 GLN 8 2HG GLN 8 -8.338 4.502 -2.487 51 HE21 GLN 8 2HE2 GLN 8 -9.350 2.893 -5.003 52 HE22 GLN 8 1HE2 GLN 8 -10.595 3.878 -5.584 53 H SER 9 H SER 9 -6.058 8.491 -4.449 54 HA SER 9 HA SER 9 -3.953 8.813 -2.647 55 HB2 SER 9 1HB SER 9 -3.567 9.542 -4.863 56 HB3 SER 9 2HB SER 9 -4.958 10.624 -4.837 57 HG SER 9 HG SER 9 -3.073 11.809 -4.502 58 H VAL 10 H VAL 10 -6.731 11.012 -3.111 59 HA VAL 10 HA VAL 10 -6.003 12.801 -1.050 60 HB VAL 10 HB VAL 10 -8.702 12.106 -2.230 61 HG11 VAL 10 1HG1 VAL 10 -9.303 14.403 -1.292 62 HG12 VAL 10 2HG1 VAL 10 -7.842 14.280 -0.311 63 HG13 VAL 10 3HG1 VAL 10 -9.145 13.107 -0.107 64 HG21 VAL 10 3HG2 VAL 10 -6.843 14.458 -2.699 65 HG22 VAL 10 1HG2 VAL 10 -8.358 14.136 -3.542 66 HG23 VAL 10 2HG2 VAL 10 -6.978 13.063 -3.770 67 H ALA 11 H ALA 11 -8.218 10.035 -1.094 68 HA ALA 11 HA ALA 11 -9.311 10.003 1.364 69 HB1 ALA 11 3HB ALA 11 -9.445 7.618 1.274 70 HB2 ALA 11 1HB ALA 11 -8.008 7.509 0.257 71 HB3 ALA 11 2HB ALA 11 -9.501 8.183 -0.398 72 H ILE 12 H ILE 12 -5.986 8.934 0.666 73 HA ILE 12 HA ILE 12 -5.365 8.198 3.317 74 HB ILE 12 HB ILE 12 -3.464 9.178 1.184 75 HG12 ILE 12 1HG1 ILE 12 -4.848 7.397 0.276 76 HG13 ILE 12 2HG1 ILE 12 -3.251 6.747 0.622 77 HG21 ILE 12 1HG2 ILE 12 -1.909 7.586 2.395 78 HG22 ILE 12 2HG2 ILE 12 -3.125 7.482 3.668 79 HG23 ILE 12 3HG2 ILE 12 -2.355 9.027 3.308 80 HD11 ILE 12 3HD1 ILE 12 -5.850 6.254 2.036 81 HD12 ILE 12 1HD1 ILE 12 -4.350 6.124 2.948 82 HD13 ILE 12 2HD1 ILE 12 -4.613 5.100 1.543 83 H GLN 13 H GLN 13 -4.781 11.150 1.511 84 HA GLN 13 HA GLN 13 -3.351 12.588 3.423 85 HB2 GLN 13 1HB GLN 13 -5.013 13.304 1.069 86 HB3 GLN 13 2HB GLN 13 -4.808 14.601 2.246 87 HG2 GLN 13 1HG GLN 13 -2.498 12.992 1.130 88 HG3 GLN 13 2HG GLN 13 -3.033 14.527 0.446 89 HE21 GLN 13 2HE2 GLN 13 -0.669 13.389 2.415 90 HE22 GLN 13 1HE2 GLN 13 -0.506 14.700 3.477 91 H GLU 14 H GLU 14 -6.916 12.672 2.952 92 HA GLU 14 HA GLU 14 -7.459 14.301 5.162 93 HB2 GLU 14 1HB GLU 14 -9.120 12.162 3.812 94 HB3 GLU 14 2HB GLU 14 -9.751 13.307 4.996 95 HG2 GLU 14 1HG GLU 14 -9.132 15.186 3.566 96 HG3 GLU 14 2HG GLU 14 -8.379 14.090 2.407 97 H THR 15 H THR 15 -6.370 11.093 5.001 98 HA THR 15 HA THR 15 -7.139 10.578 7.831 99 HB THR 15 HB THR 15 -7.044 8.201 7.331 100 HG1 THR 15 HG1 THR 15 -5.510 8.127 5.756 101 HG21 THR 15 3HG2 THR 15 -9.219 9.010 6.979 102 HG22 THR 15 1HG2 THR 15 -8.856 8.173 5.470 103 HG23 THR 15 2HG2 THR 15 -8.751 9.931 5.549 104 H LEU 16 H LEU 16 -4.642 11.894 6.540 105 HA LEU 16 HA LEU 16 -2.600 10.021 7.573 106 HB2 LEU 16 1HB LEU 16 -2.474 11.016 5.203 107 HB3 LEU 16 2HB LEU 16 -2.085 12.537 5.991 108 HG LEU 16 HG LEU 16 -0.195 11.332 7.182 109 HD11 LEU 16 1HD1 LEU 16 0.532 9.224 5.753 110 HD12 LEU 16 2HD1 LEU 16 -1.197 9.103 5.431 111 HD13 LEU 16 3HD1 LEU 16 -0.599 9.042 7.089 112 HD21 LEU 16 3HD2 LEU 16 0.373 12.731 5.341 113 HD22 LEU 16 1HD2 LEU 16 -0.278 11.582 4.173 114 HD23 LEU 16 2HD2 LEU 16 1.208 11.206 5.045 115 H VAL 17 H VAL 17 -1.154 12.914 7.448 116 HA VAL 17 HA VAL 17 -2.101 14.192 9.817 117 HB VAL 17 HB VAL 17 -0.870 12.154 10.719 118 HG11 VAL 17 1HG1 VAL 17 0.959 12.403 8.904 119 HG12 VAL 17 2HG1 VAL 17 1.483 12.009 10.539 120 HG13 VAL 17 3HG1 VAL 17 1.629 13.662 9.938 121 HG21 VAL 17 3HG2 VAL 17 0.357 13.512 12.413 122 HG22 VAL 17 1HG2 VAL 17 -1.260 14.139 12.090 123 HG23 VAL 17 2HG2 VAL 17 0.151 14.931 11.388 124 H GLU 18 H GLU 18 -1.369 16.289 9.855 125 HA GLU 18 HA GLU 18 -0.190 17.343 7.548 126 HB2 GLU 18 1HB GLU 18 -1.653 18.594 9.092 127 HB3 GLU 18 2HB GLU 18 -0.375 18.569 10.306 128 HG2 GLU 18 1HG GLU 18 1.111 19.806 8.789 129 HG3 GLU 18 2HG GLU 18 -0.140 19.800 7.547 130 H GLY 19 H GLY 19 1.829 17.059 6.893 131 HA2 GLY 19 1HA GLY 19 4.112 18.072 7.661 132 HA3 GLY 19 2HA GLY 19 4.008 16.799 8.871 133 H GLU 20 H GLU 20 2.576 15.195 6.574 134 HA GLU 20 HA GLU 20 5.106 14.226 5.360 135 HB2 GLU 20 1HB GLU 20 2.627 12.836 6.313 136 HB3 GLU 20 2HB GLU 20 3.512 12.127 4.964 137 HG2 GLU 20 1HG GLU 20 4.329 11.192 7.072 138 HG3 GLU 20 2HG GLU 20 5.592 12.169 6.328 139 H TYR 21 H TYR 21 4.456 12.835 3.314 140 HA TYR 21 HA TYR 21 2.725 14.458 1.541 141 HB2 TYR 21 1HB TYR 21 5.186 15.110 1.431 142 HB3 TYR 21 2HB TYR 21 5.478 13.498 0.780 143 HD1 TYR 21 HD1 TYR 21 3.802 16.738 0.180 144 HD2 TYR 21 HD2 TYR 21 4.806 12.890 -1.440 145 HE1 TYR 21 HE1 TYR 21 3.148 17.519 -2.081 146 HE2 TYR 21 HE2 TYR 21 4.152 13.669 -3.699 147 HH TYR 21 HH TYR 21 2.621 15.441 -4.655 148 H CYS 22 H CYS 22 1.341 13.194 0.508 149 HA CYS 22 HA CYS 22 1.851 10.316 0.316 150 HB2 CYS 22 1HB CYS 22 -0.540 12.038 -0.397 151 HB3 CYS 22 2HB CYS 22 -0.452 10.310 -0.736 152 HG CYS 22 HG CYS 22 -0.949 9.844 1.644 153 H VAL 23 H VAL 23 2.138 9.256 -1.686 154 HA VAL 23 HA VAL 23 2.882 11.053 -3.921 155 HB VAL 23 HB VAL 23 4.802 9.865 -3.163 156 HG11 VAL 23 1HG1 VAL 23 3.504 8.139 -1.855 157 HG12 VAL 23 2HG1 VAL 23 4.890 7.508 -2.739 158 HG13 VAL 23 3HG1 VAL 23 3.266 7.273 -3.373 159 HG21 VAL 23 3HG2 VAL 23 4.212 9.837 -5.682 160 HG22 VAL 23 1HG2 VAL 23 3.830 8.133 -5.431 161 HG23 VAL 23 2HG2 VAL 23 5.462 8.725 -5.123 162 H ILE 24 H ILE 24 1.506 7.838 -3.229 163 HA ILE 24 HA ILE 24 -0.500 8.144 -5.251 164 HB ILE 24 HB ILE 24 1.770 7.635 -6.427 165 HG12 ILE 24 1HG1 ILE 24 -0.304 7.617 -7.661 166 HG13 ILE 24 2HG1 ILE 24 0.615 6.184 -8.108 167 HG21 ILE 24 1HG2 ILE 24 2.283 5.730 -4.841 168 HG22 ILE 24 2HG2 ILE 24 2.451 5.362 -6.556 169 HG23 ILE 24 3HG2 ILE 24 1.031 4.805 -5.678 170 HD11 ILE 24 3HD1 ILE 24 -0.744 4.992 -6.248 171 HD12 ILE 24 1HD1 ILE 24 -1.559 5.357 -7.766 172 HD13 ILE 24 2HD1 ILE 24 -1.822 6.384 -6.361 173 H ALA 25 H ALA 25 -2.185 7.135 -4.444 174 HA ALA 25 HA ALA 25 -1.819 4.889 -2.567 175 HB1 ALA 25 3HB ALA 25 -4.212 6.616 -3.195 176 HB2 ALA 25 1HB ALA 25 -3.194 6.734 -1.763 177 HB3 ALA 25 2HB ALA 25 -4.194 5.304 -2.016 178 H VAL 26 H VAL 26 -3.581 3.241 -2.716 179 HA VAL 26 HA VAL 26 -4.663 2.701 -5.343 180 HB VAL 26 HB VAL 26 -3.504 0.474 -5.508 181 HG11 VAL 26 1HG1 VAL 26 -1.506 2.735 -5.579 182 HG12 VAL 26 2HG1 VAL 26 -2.825 2.626 -6.746 183 HG13 VAL 26 3HG1 VAL 26 -1.623 1.342 -6.653 184 HG21 VAL 26 3HG2 VAL 26 -2.030 1.638 -3.148 185 HG22 VAL 26 1HG2 VAL 26 -1.170 0.576 -4.259 186 HG23 VAL 26 2HG2 VAL 26 -2.594 -0.007 -3.407 187 H GLN 27 H GLN 27 -5.963 0.677 -5.337 188 HA GLN 27 HA GLN 27 -6.625 -0.357 -2.678 189 HB2 GLN 27 1HB GLN 27 -8.136 1.493 -2.811 190 HB3 GLN 27 2HB GLN 27 -8.570 1.098 -4.475 191 HG2 GLN 27 1HG GLN 27 -9.735 -0.867 -3.813 192 HG3 GLN 27 2HG GLN 27 -9.030 -0.831 -2.201 193 HE21 GLN 27 2HE2 GLN 27 -11.230 -0.807 -1.289 194 HE22 GLN 27 1HE2 GLN 27 -12.139 0.620 -1.294 195 H GLY 28 H GLY 28 -7.703 -2.327 -2.706 196 HA2 GLY 28 1HA GLY 28 -8.421 -3.584 -5.226 197 HA3 GLY 28 2HA GLY 28 -6.960 -4.237 -4.493 198 H VAL 29 H VAL 29 -7.591 -6.174 -3.849 199 HA VAL 29 HA VAL 29 -9.629 -6.318 -1.718 200 HB VAL 29 HB VAL 29 -9.499 -8.290 -4.016 201 HG11 VAL 29 1HG1 VAL 29 -11.264 -8.003 -1.569 202 HG12 VAL 29 2HG1 VAL 29 -10.245 -9.376 -2.002 203 HG13 VAL 29 3HG1 VAL 29 -11.690 -9.020 -2.946 204 HG21 VAL 29 3HG2 VAL 29 -11.688 -7.331 -4.654 205 HG22 VAL 29 1HG2 VAL 29 -10.417 -6.109 -4.726 206 HG23 VAL 29 2HG2 VAL 29 -11.537 -6.139 -3.363 207 H LEU 30 H LEU 30 -9.421 -8.245 -0.435 208 HA LEU 30 HA LEU 30 -6.827 -9.654 -0.611 209 HB2 LEU 30 1HB LEU 30 -6.501 -7.806 1.023 210 HB3 LEU 30 2HB LEU 30 -7.914 -8.357 1.924 211 HG LEU 30 HG LEU 30 -6.768 -10.581 2.238 212 HD11 LEU 30 1HD1 LEU 30 -4.617 -9.155 0.699 213 HD12 LEU 30 2HD1 LEU 30 -5.186 -10.817 0.550 214 HD13 LEU 30 3HD1 LEU 30 -4.165 -10.357 1.908 215 HD21 LEU 30 3HD2 LEU 30 -5.358 -8.110 3.257 216 HD22 LEU 30 1HD2 LEU 30 -5.079 -9.732 3.885 217 HD23 LEU 30 2HD2 LEU 30 -6.669 -8.992 4.042 218 H CYS 31 H CYS 31 -7.366 -11.810 -0.638 219 HA CYS 31 HA CYS 31 -9.941 -12.594 0.551 220 HB2 CYS 31 1HB CYS 31 -8.146 -14.179 -1.287 221 HB3 CYS 31 2HB CYS 31 -9.830 -14.509 -0.880 222 HG CYS 31 HG CYS 31 -10.530 -12.929 -2.650 223 H LYS 32 H LYS 32 -9.886 -13.426 2.482 224 HA LYS 32 HA LYS 32 -7.516 -15.002 3.346 225 HB2 LYS 32 1HB LYS 32 -9.519 -13.439 4.996 226 HB3 LYS 32 2HB LYS 32 -8.240 -14.460 5.653 227 HG2 LYS 32 1HG LYS 32 -6.522 -13.080 4.662 228 HG3 LYS 32 2HG LYS 32 -7.722 -12.149 3.765 229 HD2 LYS 32 1HD LYS 32 -7.189 -10.783 5.620 230 HD3 LYS 32 2HD LYS 32 -8.719 -11.542 6.058 231 HE2 LYS 32 1HE LYS 32 -7.578 -13.173 7.446 232 HE3 LYS 32 2HE LYS 32 -6.003 -12.611 6.890 233 HZ1 LYS 32 3HZ LYS 32 -6.019 -11.043 8.433 234 HZ2 LYS 32 1HZ LYS 32 -7.469 -11.673 9.048 235 HZ3 LYS 32 2HZ LYS 32 -7.508 -10.439 7.880 236 H GLY 33 H GLY 33 -7.927 -17.107 3.244 237 HA2 GLY 33 1HA GLY 33 -9.023 -19.120 3.356 238 HA3 GLY 33 2HA GLY 33 -9.986 -18.385 4.635 239 H ASP 34 H ASP 34 -12.083 -18.378 4.269 240 HA ASP 34 HA ASP 34 -13.092 -18.296 1.479 241 HB2 ASP 34 1HB ASP 34 -14.998 -19.579 2.222 242 HB3 ASP 34 2HB ASP 34 -13.536 -20.424 2.724 243 H SER 35 H SER 35 -12.359 -16.075 3.272 244 HA SER 35 HA SER 35 -14.992 -14.708 3.405 245 HB2 SER 35 1HB SER 35 -14.313 -15.080 5.687 246 HB3 SER 35 2HB SER 35 -12.661 -14.575 5.338 247 HG SER 35 HG SER 35 -14.480 -12.703 4.599 248 H ARG 36 H ARG 36 -15.035 -13.001 2.024 249 HA ARG 36 HA ARG 36 -12.457 -11.912 1.070 250 HB2 ARG 36 1HB ARG 36 -15.230 -11.640 -0.118 251 HB3 ARG 36 2HB ARG 36 -13.720 -11.104 -0.852 252 HG2 ARG 36 1HG ARG 36 -14.177 -13.991 -0.080 253 HG3 ARG 36 2HG ARG 36 -14.661 -13.364 -1.653 254 HD2 ARG 36 1HD ARG 36 -12.297 -12.591 -2.001 255 HD3 ARG 36 2HD ARG 36 -11.857 -13.396 -0.504 256 HE ARG 36 HE ARG 36 -12.573 -14.691 -3.019 257 HH11 ARG 36 1HH2 ARG 36 -11.939 -14.945 0.383 258 HH12 ARG 36 2HH2 ARG 36 -11.596 -16.640 0.327 259 HH21 ARG 36 1HH1 ARG 36 -12.130 -16.910 -3.088 260 HH22 ARG 36 2HH1 ARG 36 -11.705 -17.753 -1.635 261 H GLN 37 H GLN 37 -11.832 -9.974 1.615 262 HA GLN 37 HA GLN 37 -13.801 -7.962 2.483 263 HB2 GLN 37 1HB GLN 37 -11.534 -7.611 4.170 264 HB3 GLN 37 2HB GLN 37 -13.146 -8.132 4.650 265 HG2 GLN 37 1HG GLN 37 -11.479 -9.765 5.389 266 HG3 GLN 37 2HG GLN 37 -12.515 -10.484 4.158 267 HE21 GLN 37 2HE2 GLN 37 -10.808 -12.003 3.491 268 HE22 GLN 37 1HE2 GLN 37 -9.451 -11.463 2.629 269 H SER 38 H SER 38 -13.418 -6.043 1.699 270 HA SER 38 HA SER 38 -11.216 -5.637 -0.132 271 HB2 SER 38 1HB SER 38 -13.454 -4.766 -0.674 272 HB3 SER 38 2HB SER 38 -13.380 -3.701 0.728 273 HG SER 38 HG SER 38 -11.281 -3.683 -1.133 274 H ARG 39 H ARG 39 -9.565 -4.168 0.047 275 HA ARG 39 HA ARG 39 -9.178 -2.831 2.655 276 HB2 ARG 39 1HB ARG 39 -7.152 -4.531 1.207 277 HB3 ARG 39 2HB ARG 39 -6.797 -3.518 2.606 278 HG2 ARG 39 1HG ARG 39 -8.771 -4.869 3.726 279 HG3 ARG 39 2HG ARG 39 -8.434 -6.043 2.451 280 HD2 ARG 39 1HD ARG 39 -7.070 -6.729 4.261 281 HD3 ARG 39 2HD ARG 39 -5.974 -5.874 3.185 282 HE ARG 39 HE ARG 39 -5.831 -4.131 4.752 283 HH11 ARG 39 1HH2 ARG 39 -8.171 -6.526 5.652 284 HH12 ARG 39 2HH2 ARG 39 -8.381 -5.911 7.257 285 HH21 ARG 39 1HH1 ARG 39 -6.111 -3.324 6.855 286 HH22 ARG 39 2HH1 ARG 39 -7.219 -4.100 7.935 287 H LEU 40 H LEU 40 -7.569 -1.183 2.615 288 HA LEU 40 HA LEU 40 -7.119 0.022 -0.067 289 HB2 LEU 40 1HB LEU 40 -9.050 1.028 1.264 290 HB3 LEU 40 2HB LEU 40 -7.849 1.608 2.412 291 HG LEU 40 HG LEU 40 -7.345 2.234 -0.485 292 HD11 LEU 40 1HD1 LEU 40 -9.562 3.472 1.153 293 HD12 LEU 40 2HD1 LEU 40 -9.668 2.776 -0.464 294 HD13 LEU 40 3HD1 LEU 40 -8.815 4.299 -0.212 295 HD21 LEU 40 3HD2 LEU 40 -7.146 3.872 2.061 296 HD22 LEU 40 1HD2 LEU 40 -6.536 4.339 0.475 297 HD23 LEU 40 2HD2 LEU 40 -5.822 2.978 1.326 298 H LEU 41 H LEU 41 -5.048 0.732 -0.444 299 HA LEU 41 HA LEU 41 -3.168 0.664 1.841 300 HB2 LEU 41 1HB LEU 41 -2.510 0.491 -1.104 301 HB3 LEU 41 2HB LEU 41 -1.465 0.119 0.265 302 HG LEU 41 HG LEU 41 -3.475 -1.608 0.820 303 HD11 LEU 41 1HD1 LEU 41 -4.581 -0.724 -1.403 304 HD12 LEU 41 2HD1 LEU 41 -4.605 -2.447 -1.040 305 HD13 LEU 41 3HD1 LEU 41 -3.429 -1.804 -2.183 306 HD21 LEU 41 3HD2 LEU 41 -1.277 -2.109 -1.217 307 HD22 LEU 41 1HD2 LEU 41 -2.129 -3.352 -0.301 308 HD23 LEU 41 2HD2 LEU 41 -1.093 -2.195 0.534 309 H GLY 42 H GLY 42 -1.098 2.033 1.132 310 HA2 GLY 42 1HA GLY 42 -1.580 4.440 -0.310 311 HA3 GLY 42 2HA GLY 42 -1.747 4.728 1.414 312 H LEU 43 H LEU 43 0.394 4.687 -1.144 313 HA LEU 43 HA LEU 43 2.772 4.079 0.452 314 HB2 LEU 43 1HB LEU 43 2.676 3.301 -1.875 315 HB3 LEU 43 2HB LEU 43 2.481 4.959 -2.432 316 HG LEU 43 HG LEU 43 4.690 5.538 -1.488 317 HD11 LEU 43 1HD1 LEU 43 5.074 4.120 0.339 318 HD12 LEU 43 2HD1 LEU 43 6.125 3.415 -0.884 319 HD13 LEU 43 3HD1 LEU 43 4.559 2.679 -0.541 320 HD21 LEU 43 3HD2 LEU 43 6.012 4.367 -3.146 321 HD22 LEU 43 1HD2 LEU 43 4.411 4.652 -3.826 322 HD23 LEU 43 2HD2 LEU 43 4.837 3.053 -3.219 323 H VAL 44 H VAL 44 4.289 5.625 1.091 324 HA VAL 44 HA VAL 44 3.603 8.463 0.551 325 HB VAL 44 HB VAL 44 4.422 7.441 3.253 326 HG11 VAL 44 1HG1 VAL 44 3.859 9.608 4.025 327 HG12 VAL 44 2HG1 VAL 44 2.981 9.992 2.547 328 HG13 VAL 44 3HG1 VAL 44 4.742 9.890 2.525 329 HG21 VAL 44 3HG2 VAL 44 2.032 7.700 3.878 330 HG22 VAL 44 1HG2 VAL 44 2.270 6.431 2.678 331 HG23 VAL 44 2HG2 VAL 44 1.647 8.004 2.184 332 H ARG 45 H ARG 45 5.244 9.737 0.127 333 HA ARG 45 HA ARG 45 8.002 8.699 0.473 334 HB2 ARG 45 1HB ARG 45 7.482 8.989 -1.874 335 HB3 ARG 45 2HB ARG 45 6.851 10.607 -1.580 336 HG2 ARG 45 1HG ARG 45 9.067 11.403 -0.927 337 HG3 ARG 45 2HG ARG 45 9.724 9.771 -1.060 338 HD2 ARG 45 1HD ARG 45 10.253 11.068 -3.072 339 HD3 ARG 45 2HD ARG 45 9.145 9.757 -3.467 340 HE ARG 45 HE ARG 45 7.469 11.339 -3.883 341 HH11 ARG 45 1HH2 ARG 45 10.273 12.769 -2.441 342 HH12 ARG 45 2HH2 ARG 45 9.760 14.398 -2.735 343 HH21 ARG 45 1HH1 ARG 45 6.790 13.470 -4.263 344 HH22 ARG 45 2HH1 ARG 45 7.789 14.794 -3.764 345 H TYR 46 H TYR 46 9.350 9.849 1.664 346 HA TYR 46 HA TYR 46 8.589 12.594 2.501 347 HB2 TYR 46 1HB TYR 46 8.091 10.784 4.215 348 HB3 TYR 46 2HB TYR 46 9.831 10.515 4.313 349 HD1 TYR 46 HD1 TYR 46 7.382 13.369 4.343 350 HD2 TYR 46 HD2 TYR 46 11.001 11.698 5.951 351 HE1 TYR 46 HE1 TYR 46 7.573 15.276 5.909 352 HE2 TYR 46 HE2 TYR 46 11.176 13.605 7.519 353 HH TYR 46 HH TYR 46 9.461 15.279 8.582 354 H ARG 47 H ARG 47 10.233 14.058 2.361 355 HA ARG 47 HA ARG 47 12.921 13.033 1.634 356 HB2 ARG 47 1HB ARG 47 11.523 15.620 0.945 357 HB3 ARG 47 2HB ARG 47 13.232 15.321 0.631 358 HG2 ARG 47 1HG ARG 47 12.662 13.375 -0.750 359 HG3 ARG 47 2HG ARG 47 10.948 13.622 -0.410 360 HD2 ARG 47 1HD ARG 47 12.711 15.698 -1.732 361 HD3 ARG 47 2HD ARG 47 11.709 14.557 -2.625 362 HE ARG 47 HE ARG 47 10.094 15.875 -0.727 363 HH11 ARG 47 1HH2 ARG 47 11.902 16.486 -3.618 364 HH12 ARG 47 2HH2 ARG 47 10.876 17.777 -4.149 365 HH21 ARG 47 1HH1 ARG 47 8.751 17.565 -1.417 366 HH22 ARG 47 2HH1 ARG 47 9.092 18.386 -2.902 367 H LEU 48 H LEU 48 14.768 14.383 2.287 368 HA LEU 48 HA LEU 48 14.359 15.991 4.726 369 HB2 LEU 48 1HB LEU 48 16.223 13.625 4.525 370 HB3 LEU 48 2HB LEU 48 16.285 14.814 5.810 371 HG LEU 48 HG LEU 48 13.846 13.147 5.134 372 HD11 LEU 48 1HD1 LEU 48 15.841 11.850 6.009 373 HD12 LEU 48 2HD1 LEU 48 14.400 11.760 7.022 374 HD13 LEU 48 3HD1 LEU 48 15.737 12.816 7.480 375 HD21 LEU 48 3HD2 LEU 48 12.964 14.962 6.297 376 HD22 LEU 48 1HD2 LEU 48 14.470 15.294 7.153 377 HD23 LEU 48 2HD2 LEU 48 13.439 13.963 7.666 378 H GLU 49 H GLU 49 17.444 14.711 3.830 379 HA GLU 49 HA GLU 49 18.511 17.349 3.370 380 HB2 GLU 49 1HB GLU 49 19.797 14.618 3.104 381 HB3 GLU 49 2HB GLU 49 20.651 16.158 3.055 382 HG2 GLU 49 1HG GLU 49 18.952 15.236 5.389 383 HG3 GLU 49 2HG GLU 49 20.705 15.069 5.315 384 H ASN 50 H ASN 50 16.483 16.146 1.501 385 HA ASN 50 HA ASN 50 16.031 16.250 -0.747 386 HB2 ASN 50 1HB ASN 50 18.764 17.415 -1.229 387 HB3 ASN 50 2HB ASN 50 17.251 17.754 -2.066 388 HD21 ASN 50 2HD2 ASN 50 16.177 17.724 0.989 389 HD22 ASN 50 1HD2 ASN 50 16.487 19.318 1.467 390 H ASP 51 H ASP 51 18.448 14.490 0.647 391 HA ASP 51 HA ASP 51 18.644 12.686 -1.658 392 HB2 ASP 51 1HB ASP 51 20.971 13.906 -0.160 393 HB3 ASP 51 2HB ASP 51 21.117 12.424 -1.100 394 H ALA 52 H ALA 52 17.610 13.107 1.269 395 HA ALA 52 HA ALA 52 18.315 10.383 2.223 396 HB1 ALA 52 3HB ALA 52 19.581 11.780 3.653 397 HB2 ALA 52 1HB ALA 52 18.117 11.426 4.570 398 HB3 ALA 52 2HB ALA 52 18.295 12.982 3.756 399 H GLN 53 H GLN 53 16.189 10.208 0.926 400 HA GLN 53 HA GLN 53 13.818 11.040 2.426 401 HB2 GLN 53 1HB GLN 53 12.682 9.890 0.405 402 HB3 GLN 53 2HB GLN 53 13.557 11.392 0.110 403 HG2 GLN 53 1HG GLN 53 15.001 8.759 -0.126 404 HG3 GLN 53 2HG GLN 53 13.990 9.325 -1.452 405 HE21 GLN 53 2HE2 GLN 53 15.316 11.947 0.305 406 HE22 GLN 53 1HE2 GLN 53 16.608 12.291 -0.741 407 H GLU 54 H GLU 54 12.113 9.471 2.854 408 HA GLU 54 HA GLU 54 13.034 6.686 3.183 409 HB2 GLU 54 1HB GLU 54 11.672 8.337 5.330 410 HB3 GLU 54 2HB GLU 54 12.016 6.610 5.433 411 HG2 GLU 54 1HG GLU 54 14.102 8.783 5.071 412 HG3 GLU 54 2HG GLU 54 13.741 7.972 6.592 413 H HIS 55 H HIS 55 11.555 5.208 2.674 414 HA HIS 55 HA HIS 55 8.793 6.125 2.057 415 HB2 HIS 55 1HB HIS 55 10.561 4.110 0.672 416 HB3 HIS 55 2HB HIS 55 8.829 4.236 0.373 417 HD2 HIS 55 HD2 HIS 55 8.091 6.318 -1.329 418 HE1 HIS 55 HE1 HIS 55 11.907 8.088 -1.684 419 HE2 HIS 55 HE2 HIS 55 9.521 8.125 -2.553 420 H ALA 56 H ALA 56 7.098 4.833 2.668 421 HA ALA 56 HA ALA 56 7.561 2.211 3.820 422 HB1 ALA 56 3HB ALA 56 6.790 2.696 5.989 423 HB2 ALA 56 1HB ALA 56 6.138 4.262 5.508 424 HB3 ALA 56 2HB ALA 56 7.881 4.034 5.635 425 H LEU 57 H LEU 57 5.719 0.955 3.771 426 HA LEU 57 HA LEU 57 3.495 2.034 2.181 427 HB2 LEU 57 1HB LEU 57 4.427 -0.734 2.895 428 HB3 LEU 57 2HB LEU 57 2.751 -0.499 2.409 429 HG LEU 57 HG LEU 57 3.632 0.703 0.345 430 HD11 LEU 57 1HD1 LEU 57 6.226 -0.464 1.390 431 HD12 LEU 57 2HD1 LEU 57 5.869 1.240 1.108 432 HD13 LEU 57 3HD1 LEU 57 5.999 0.128 -0.256 433 HD21 LEU 57 3HD2 LEU 57 4.290 -2.206 0.848 434 HD22 LEU 57 1HD2 LEU 57 4.341 -1.461 -0.750 435 HD23 LEU 57 2HD2 LEU 57 2.817 -1.544 0.136 436 H PHE 58 H PHE 58 1.348 1.993 2.826 437 HA PHE 58 HA PHE 58 0.876 1.610 5.734 438 HB2 PHE 58 1HB PHE 58 -0.130 3.825 3.942 439 HB3 PHE 58 2HB PHE 58 -0.700 3.538 5.583 440 HD1 PHE 58 HD1 PHE 58 2.426 4.163 3.605 441 HD2 PHE 58 HD2 PHE 58 0.464 4.437 7.412 442 HE1 PHE 58 HE1 PHE 58 4.349 5.447 4.511 443 HE2 PHE 58 HE2 PHE 58 2.387 5.712 8.316 444 HZ PHE 58 HZ PHE 58 4.330 6.215 6.861 445 H LEU 59 H LEU 59 -0.922 0.554 6.293 446 HA LEU 59 HA LEU 59 -2.715 -0.388 4.124 447 HB2 LEU 59 1HB LEU 59 -1.526 -2.186 5.350 448 HB3 LEU 59 2HB LEU 59 -2.243 -1.616 6.855 449 HG LEU 59 HG LEU 59 -4.518 -2.006 5.870 450 HD11 LEU 59 1HD1 LEU 59 -2.841 -2.837 3.521 451 HD12 LEU 59 2HD1 LEU 59 -4.358 -1.940 3.555 452 HD13 LEU 59 3HD1 LEU 59 -4.362 -3.682 3.815 453 HD21 LEU 59 3HD2 LEU 59 -4.503 -4.377 6.212 454 HD22 LEU 59 1HD2 LEU 59 -3.236 -3.718 7.249 455 HD23 LEU 59 2HD2 LEU 59 -2.811 -4.502 5.726 456 H TYR 60 H TYR 60 -4.612 0.487 4.068 457 HA TYR 60 HA TYR 60 -5.754 1.769 6.494 458 HB2 TYR 60 1HB TYR 60 -5.838 2.435 3.560 459 HB3 TYR 60 2HB TYR 60 -7.069 3.039 4.642 460 HD1 TYR 60 HD2 TYR 60 -3.518 3.193 3.715 461 HD2 TYR 60 HD1 TYR 60 -6.549 4.680 6.363 462 HE1 TYR 60 HE2 TYR 60 -2.022 5.053 4.394 463 HE2 TYR 60 HE1 TYR 60 -5.053 6.534 7.043 464 HH TYR 60 HH TYR 60 -2.170 7.277 5.349 465 H THR 61 H THR 61 -7.606 0.773 7.260 466 HA THR 61 HA THR 61 -8.831 -1.311 5.651 467 HB THR 61 HB THR 61 -10.183 -1.793 7.509 468 HG1 THR 61 HG1 THR 61 -10.157 -0.146 9.287 469 HG21 THR 61 3HG2 THR 61 -8.651 -2.195 9.213 470 HG22 THR 61 1HG2 THR 61 -7.877 -0.625 9.015 471 HG23 THR 61 2HG2 THR 61 -7.575 -1.913 7.844 472 H HIS 62 H HIS 62 -11.118 -1.269 5.086 473 HA HIS 62 HA HIS 62 -12.568 1.185 5.203 474 HB2 HIS 62 1HB HIS 62 -12.182 2.121 3.142 475 HB3 HIS 62 2HB HIS 62 -10.666 1.241 3.255 476 HD2 HIS 62 HD2 HIS 62 -10.573 -1.162 1.690 477 HE1 HIS 62 HE1 HIS 62 -14.115 -0.366 -0.454 478 HE2 HIS 62 HE2 HIS 62 -12.069 -1.867 -0.329 479 H ARG 63 H ARG 63 -14.691 0.798 4.950 480 HA ARG 63 HA ARG 63 -15.650 -1.846 4.913 481 HB2 ARG 63 1HB ARG 63 -17.231 0.638 4.199 482 HB3 ARG 63 2HB ARG 63 -17.871 -0.893 4.809 483 HG2 ARG 63 1HG ARG 63 -16.531 -0.575 6.881 484 HG3 ARG 63 2HG ARG 63 -16.021 0.979 6.247 485 HD2 ARG 63 1HD ARG 63 -18.395 1.714 6.151 486 HD3 ARG 63 2HD ARG 63 -18.888 0.173 6.832 487 HE ARG 63 HE ARG 63 -17.692 2.413 8.259 488 HH11 ARG 63 1HH2 ARG 63 -18.539 -0.943 8.251 489 HH12 ARG 63 2HH2 ARG 63 -18.439 -1.109 9.973 490 HH21 ARG 63 1HH1 ARG 63 -17.510 2.198 10.488 491 HH22 ARG 63 2HH1 ARG 63 -17.851 0.679 11.248 492 H ARG 64 H ARG 64 -17.841 -1.650 3.160 493 HA ARG 64 HA ARG 64 -16.695 -2.689 0.791 494 HB2 ARG 64 1HB ARG 64 -19.513 -1.788 1.412 495 HB3 ARG 64 2HB ARG 64 -19.040 -2.666 -0.043 496 HG2 ARG 64 1HG ARG 64 -18.234 -4.536 1.303 497 HG3 ARG 64 2HG ARG 64 -18.597 -3.651 2.785 498 HD2 ARG 64 1HD ARG 64 -20.409 -5.221 2.325 499 HD3 ARG 64 2HD ARG 64 -20.995 -3.573 2.117 500 HE ARG 64 HE ARG 64 -20.051 -4.569 -0.366 501 HH11 ARG 64 1HH2 ARG 64 -22.610 -4.921 1.942 502 HH12 ARG 64 2HH2 ARG 64 -23.784 -5.411 0.767 503 HH21 ARG 64 1HH1 ARG 64 -21.589 -5.211 -1.908 504 HH22 ARG 64 2HH1 ARG 64 -23.207 -5.575 -1.411 505 H MET 65 H MET 65 -18.007 0.506 1.658 506 HA MET 65 HA MET 65 -16.951 1.551 -0.906 507 HB2 MET 65 1HB MET 65 -19.075 3.115 -0.727 508 HB3 MET 65 2HB MET 65 -19.219 1.510 -1.441 509 HG2 MET 65 1HG MET 65 -20.036 0.587 0.657 510 HG3 MET 65 2HG MET 65 -19.770 2.127 1.476 511 HE1 MET 65 3HE MET 65 -23.617 1.495 1.246 512 HE2 MET 65 1HE MET 65 -22.494 2.392 2.276 513 HE3 MET 65 2HE MET 65 -22.153 0.719 1.844 514 H ALA 66 H ALA 66 -15.940 1.570 1.884 515 HA ALA 66 HA ALA 66 -16.311 4.287 2.846 516 HB1 ALA 66 3HB ALA 66 -14.421 2.088 3.672 517 HB2 ALA 66 1HB ALA 66 -15.907 2.564 4.486 518 HB3 ALA 66 2HB ALA 66 -14.517 3.652 4.473 519 H ILE 67 H ILE 67 -15.263 3.814 0.136 520 HA ILE 67 HA ILE 67 -12.508 4.359 -0.083 521 HB ILE 67 HB ILE 67 -14.843 4.915 -1.927 522 HG12 ILE 67 1HG1 ILE 67 -12.707 2.769 -2.053 523 HG13 ILE 67 2HG1 ILE 67 -14.270 2.527 -1.274 524 HG21 ILE 67 1HG2 ILE 67 -13.101 6.381 -2.651 525 HG22 ILE 67 2HG2 ILE 67 -12.998 4.962 -3.692 526 HG23 ILE 67 3HG2 ILE 67 -11.859 5.162 -2.359 527 HD11 ILE 67 3HD1 ILE 67 -13.749 3.156 -4.191 528 HD12 ILE 67 1HD1 ILE 67 -15.353 3.226 -3.461 529 HD13 ILE 67 2HD1 ILE 67 -14.478 1.696 -3.521 530 H THR 68 H THR 68 -15.307 6.450 0.001 531 HA THR 68 HA THR 68 -14.404 8.880 -0.743 532 HB THR 68 HB THR 68 -16.068 9.894 0.687 533 HG1 THR 68 HG1 THR 68 -16.559 7.433 1.914 534 HG21 THR 68 3HG2 THR 68 -16.966 7.146 -0.209 535 HG22 THR 68 1HG2 THR 68 -16.749 8.521 -1.290 536 HG23 THR 68 2HG2 THR 68 -17.980 8.577 -0.027 537 H GLY 69 H GLY 69 -13.606 7.430 2.445 538 HA2 GLY 69 1HA GLY 69 -11.405 8.133 3.346 539 HA3 GLY 69 2HA GLY 69 -11.858 9.784 2.944 540 H ASP 70 H ASP 70 -14.690 8.768 3.665 541 HA ASP 70 HA ASP 70 -14.884 10.036 6.141 542 HB2 ASP 70 1HB ASP 70 -16.772 9.775 4.597 543 HB3 ASP 70 2HB ASP 70 -16.774 8.035 4.868 544 H ASP 71 H ASP 71 -15.094 6.523 5.451 545 HA ASP 71 HA ASP 71 -14.697 5.984 8.333 546 HB2 ASP 71 1HB ASP 71 -16.899 5.481 7.499 547 HB3 ASP 71 2HB ASP 71 -16.255 4.495 6.198 548 H VAL 72 H VAL 72 -12.341 6.333 6.952 549 HA VAL 72 HA VAL 72 -11.170 3.653 7.100 550 HB VAL 72 HB VAL 72 -11.556 3.709 4.758 551 HG11 VAL 72 1HG1 VAL 72 -12.229 6.061 4.588 552 HG12 VAL 72 2HG1 VAL 72 -11.012 5.690 3.367 553 HG13 VAL 72 3HG1 VAL 72 -10.557 6.570 4.824 554 HG21 VAL 72 3HG2 VAL 72 -9.008 3.553 5.693 555 HG22 VAL 72 1HG2 VAL 72 -8.826 4.943 4.627 556 HG23 VAL 72 2HG2 VAL 72 -9.395 3.404 3.980 557 H SER 73 H SER 73 -9.378 3.736 8.327 558 HA SER 73 HA SER 73 -7.646 6.101 8.189 559 HB2 SER 73 1HB SER 73 -8.885 4.975 10.713 560 HB3 SER 73 2HB SER 73 -7.525 6.095 10.694 561 HG SER 73 HG SER 73 -10.164 6.582 10.394 562 H LEU 74 H LEU 74 -5.529 5.624 9.222 563 HA LEU 74 HA LEU 74 -4.280 3.498 8.153 564 HB2 LEU 74 1HB LEU 74 -3.421 5.524 9.673 565 HB3 LEU 74 2HB LEU 74 -3.304 4.249 10.882 566 HG LEU 74 HG LEU 74 -2.059 4.123 8.115 567 HD11 LEU 74 1HD1 LEU 74 -0.712 5.692 9.134 568 HD12 LEU 74 2HD1 LEU 74 0.077 4.222 9.695 569 HD13 LEU 74 3HD1 LEU 74 -1.027 5.088 10.760 570 HD21 LEU 74 3HD2 LEU 74 -2.195 1.888 8.663 571 HD22 LEU 74 1HD2 LEU 74 -2.281 2.193 10.397 572 HD23 LEU 74 2HD2 LEU 74 -0.734 2.260 9.557 573 H ASP 75 H ASP 75 -3.927 1.427 8.447 574 HA ASP 75 HA ASP 75 -5.289 0.017 10.653 575 HB2 ASP 75 1HB ASP 75 -5.738 -0.513 8.170 576 HB3 ASP 75 2HB ASP 75 -4.134 -1.234 8.161 577 H GLN 76 H GLN 76 -2.251 -0.219 8.711 578 HA GLN 76 HA GLN 76 -0.614 -0.441 11.044 579 HB2 GLN 76 1HB GLN 76 -1.571 -2.738 11.003 580 HB3 GLN 76 2HB GLN 76 -0.925 -2.952 9.376 581 HG2 GLN 76 1HG GLN 76 1.375 -2.445 10.305 582 HG3 GLN 76 2HG GLN 76 0.661 -2.446 11.912 583 HE21 GLN 76 2HE2 GLN 76 2.280 -4.385 9.733 584 HE22 GLN 76 1HE2 GLN 76 1.784 -5.898 10.315 585 H ILE 77 H ILE 77 1.365 0.223 10.562 586 HA ILE 77 HA ILE 77 2.064 0.853 7.829 587 HB ILE 77 HB ILE 77 3.627 1.204 10.408 588 HG12 ILE 77 1HG1 ILE 77 2.009 3.207 8.812 589 HG13 ILE 77 2HG1 ILE 77 1.451 2.426 10.288 590 HG21 ILE 77 1HG2 ILE 77 4.012 2.488 7.684 591 HG22 ILE 77 2HG2 ILE 77 5.049 1.231 8.354 592 HG23 ILE 77 3HG2 ILE 77 4.969 2.810 9.127 593 HD11 ILE 77 3HD1 ILE 77 2.376 4.629 10.815 594 HD12 ILE 77 1HD1 ILE 77 3.897 4.195 10.034 595 HD13 ILE 77 2HD1 ILE 77 3.392 3.367 11.506 596 H VAL 78 H VAL 78 3.506 -0.178 6.554 597 HA VAL 78 HA VAL 78 4.931 -2.545 7.660 598 HB VAL 78 HB VAL 78 3.737 -2.153 4.904 599 HG11 VAL 78 1HG1 VAL 78 5.679 -3.400 4.492 600 HG12 VAL 78 2HG1 VAL 78 4.492 -4.668 4.792 601 HG13 VAL 78 3HG1 VAL 78 5.623 -4.200 6.063 602 HG21 VAL 78 3HG2 VAL 78 3.096 -4.117 7.131 603 HG22 VAL 78 1HG2 VAL 78 2.305 -4.047 5.557 604 HG23 VAL 78 2HG2 VAL 78 2.115 -2.716 6.698 605 HA PRO 79 HA PRO 79 8.009 0.619 6.198 606 HB2 PRO 79 1HB PRO 79 9.682 -0.902 8.154 607 HB3 PRO 79 2HB PRO 79 9.469 0.853 7.977 608 HG2 PRO 79 1HG PRO 79 8.337 -0.440 9.992 609 HG3 PRO 79 2HG PRO 79 7.467 0.855 9.150 610 HD2 PRO 79 1HD PRO 79 7.140 -2.122 8.857 611 HD3 PRO 79 2HD PRO 79 5.898 -0.857 8.941 612 H LEU 80 H LEU 80 9.437 0.389 4.584 613 HA LEU 80 HA LEU 80 9.757 -2.135 3.354 614 HB2 LEU 80 1HB LEU 80 11.035 0.560 2.881 615 HB3 LEU 80 2HB LEU 80 11.310 -0.838 1.843 616 HG LEU 80 HG LEU 80 8.561 0.266 2.484 617 HD11 LEU 80 1HD1 LEU 80 8.740 1.087 0.043 618 HD12 LEU 80 2HD1 LEU 80 10.481 0.881 0.236 619 HD13 LEU 80 3HD1 LEU 80 9.604 2.007 1.273 620 HD21 LEU 80 3HD2 LEU 80 8.197 -1.033 0.182 621 HD22 LEU 80 1HD2 LEU 80 8.169 -1.900 1.712 622 HD23 LEU 80 2HD2 LEU 80 9.619 -1.928 0.712 623 H SER 81 H SER 81 11.220 -3.567 3.501 624 HA SER 81 HA SER 81 13.784 -3.019 4.904 625 HB2 SER 81 1HB SER 81 11.966 -5.414 5.233 626 HB3 SER 81 2HB SER 81 13.625 -5.350 5.819 627 HG SER 81 HG SER 81 11.936 -4.709 7.348 628 H LYS 82 H LYS 82 15.510 -4.534 4.345 629 HA LYS 82 HA LYS 82 15.855 -4.773 1.599 630 HB2 LYS 82 1HB LYS 82 17.683 -4.794 3.263 631 HB3 LYS 82 2HB LYS 82 17.199 -6.413 3.758 632 HG2 LYS 82 1HG LYS 82 17.618 -6.101 0.824 633 HG3 LYS 82 2HG LYS 82 19.071 -5.889 1.796 634 HD2 LYS 82 1HD LYS 82 18.675 -8.064 2.882 635 HD3 LYS 82 2HD LYS 82 17.211 -8.283 1.923 636 HE2 LYS 82 1HE LYS 82 18.551 -8.191 -0.146 637 HE3 LYS 82 2HE LYS 82 20.016 -7.974 0.813 638 HZ1 LYS 82 3HZ LYS 82 19.149 -10.123 1.975 639 HZ2 LYS 82 1HZ LYS 82 20.024 -10.220 0.524 640 HZ3 LYS 82 2HZ LYS 82 18.330 -10.350 0.504 641 H ASP 83 H ASP 83 14.696 -7.213 3.932 642 HA ASP 83 HA ASP 83 14.605 -9.351 2.073 643 HB2 ASP 83 1HB ASP 83 13.198 -8.837 4.697 644 HB3 ASP 83 2HB ASP 83 13.008 -10.335 3.788 645 H PHE 84 H PHE 84 12.966 -6.522 1.988 646 HA PHE 84 HA PHE 84 10.293 -7.340 1.392 647 HB2 PHE 84 1HB PHE 84 10.945 -5.012 2.053 648 HB3 PHE 84 2HB PHE 84 11.723 -4.828 0.482 649 HD1 PHE 84 HD1 PHE 84 10.304 -5.068 -1.617 650 HD2 PHE 84 HD2 PHE 84 8.609 -4.732 2.312 651 HE1 PHE 84 HE1 PHE 84 8.134 -4.398 -2.604 652 HE2 PHE 84 HE2 PHE 84 6.434 -4.077 1.325 653 HZ PHE 84 HZ PHE 84 6.198 -3.911 -1.143 654 H MET 85 H MET 85 9.368 -7.841 -0.552 655 HA MET 85 HA MET 85 10.614 -7.456 -3.066 656 HB2 MET 85 1HB MET 85 12.041 -9.331 -2.209 657 HB3 MET 85 2HB MET 85 10.591 -10.328 -2.103 658 HG2 MET 85 1HG MET 85 11.691 -10.801 -4.218 659 HG3 MET 85 2HG MET 85 10.200 -9.926 -4.553 660 HE1 MET 85 3HE MET 85 11.862 -8.146 -7.312 661 HE2 MET 85 1HE MET 85 10.304 -8.219 -6.476 662 HE3 MET 85 2HE MET 85 11.177 -9.702 -6.851 663 H LEU 86 H LEU 86 9.205 -7.952 -4.773 664 HA LEU 86 HA LEU 86 6.471 -8.743 -3.924 665 HB2 LEU 86 1HB LEU 86 7.113 -7.305 -6.489 666 HB3 LEU 86 2HB LEU 86 5.610 -7.333 -5.571 667 HG LEU 86 HG LEU 86 7.212 -6.219 -3.694 668 HD11 LEU 86 1HD1 LEU 86 8.392 -5.395 -6.369 669 HD12 LEU 86 2HD1 LEU 86 9.237 -6.163 -5.026 670 HD13 LEU 86 3HD1 LEU 86 8.649 -4.510 -4.868 671 HD21 LEU 86 3HD2 LEU 86 5.740 -4.887 -5.979 672 HD22 LEU 86 1HD2 LEU 86 6.441 -3.959 -4.652 673 HD23 LEU 86 2HD2 LEU 86 5.178 -5.148 -4.328 674 H GLU 87 H GLU 87 5.640 -10.608 -4.768 675 HA GLU 87 HA GLU 87 7.155 -11.911 -6.957 676 HB2 GLU 87 1HB GLU 87 5.546 -13.079 -4.679 677 HB3 GLU 87 2HB GLU 87 6.174 -14.023 -6.029 678 HG2 GLU 87 1HG GLU 87 8.463 -13.351 -5.471 679 HG3 GLU 87 2HG GLU 87 7.862 -12.336 -4.159 680 H GLU 88 H GLU 88 6.153 -12.211 -8.796 681 HA GLU 88 HA GLU 88 3.410 -11.431 -9.182 682 HB2 GLU 88 1HB GLU 88 5.425 -12.758 -11.014 683 HB3 GLU 88 2HB GLU 88 3.807 -12.270 -11.519 684 HG2 GLU 88 1HG GLU 88 4.291 -9.943 -10.949 685 HG3 GLU 88 2HG GLU 88 5.878 -10.400 -10.334 686 H VAL 89 H VAL 89 1.618 -12.743 -9.396 687 HA VAL 89 HA VAL 89 2.008 -15.607 -8.721 688 HB VAL 89 HB VAL 89 -0.563 -14.058 -8.608 689 HG11 VAL 89 1HG1 VAL 89 -1.293 -15.882 -7.192 690 HG12 VAL 89 2HG1 VAL 89 0.325 -16.586 -7.205 691 HG13 VAL 89 3HG1 VAL 89 -0.637 -16.556 -8.684 692 HG21 VAL 89 3HG2 VAL 89 0.961 -12.941 -7.091 693 HG22 VAL 89 1HG2 VAL 89 1.546 -14.486 -6.474 694 HG23 VAL 89 2HG2 VAL 89 -0.100 -13.962 -6.122 695 H SER 90 H SER 90 1.305 -17.167 -10.029 696 HA SER 90 HA SER 90 1.107 -16.892 -12.737 697 HB2 SER 90 1HB SER 90 0.313 -19.115 -12.823 698 HB3 SER 90 2HB SER 90 1.295 -19.023 -11.363 699 HG SER 90 HG SER 90 -1.533 -18.811 -11.552 700 HA PRO 91 HA PRO 91 -2.987 -14.947 -12.929 701 HB2 PRO 91 1HB PRO 91 -3.064 -14.405 -15.601 702 HB3 PRO 91 2HB PRO 91 -2.093 -13.456 -14.458 703 HG2 PRO 91 1HG PRO 91 -1.234 -15.595 -16.350 704 HG3 PRO 91 2HG PRO 91 -0.414 -14.088 -15.900 705 HD2 PRO 91 1HD PRO 91 0.229 -16.578 -14.856 706 HD3 PRO 91 2HD PRO 91 0.574 -15.036 -14.039 707 H ASP 92 H ASP 92 -2.193 -17.126 -15.665 708 HA ASP 92 HA ASP 92 -3.322 -18.886 -16.579 709 HB2 ASP 92 1HB ASP 92 -3.540 -19.568 -14.121 710 HB3 ASP 92 2HB ASP 92 -5.166 -18.895 -14.198 711 H GLY 93 H GLY 93 -5.538 -16.708 -14.942 712 HA2 GLY 93 1HA GLY 93 -7.638 -15.895 -15.593 713 HA3 GLY 93 2HA GLY 93 -6.689 -15.364 -16.976 714 H GLU 94 H GLU 94 -8.122 -15.688 -18.639 715 HA GLU 94 HA GLU 94 -8.405 -18.139 -19.838 716 HB2 GLU 94 1HB GLU 94 -9.820 -19.075 -18.255 717 HB3 GLU 94 2HB GLU 94 -10.517 -17.518 -17.808 718 HG2 GLU 94 1HG GLU 94 -11.881 -17.454 -19.729 719 HG3 GLU 94 2HG GLU 94 -10.979 -18.744 -20.517 720 H LEU 95 H LEU 95 -10.542 -15.334 -19.142 721 HA LEU 95 HA LEU 95 -10.295 -14.418 -21.898 722 HB2 LEU 95 1HB LEU 95 -12.207 -16.068 -21.884 723 HB3 LEU 95 2HB LEU 95 -13.007 -15.041 -20.699 724 HG LEU 95 HG LEU 95 -12.567 -13.133 -22.505 725 HD11 LEU 95 1HD1 LEU 95 -12.566 -15.670 -24.166 726 HD12 LEU 95 2HD1 LEU 95 -11.241 -14.514 -24.027 727 HD13 LEU 95 3HD1 LEU 95 -12.747 -14.038 -24.808 728 HD21 LEU 95 3HD2 LEU 95 -14.710 -15.270 -22.653 729 HD22 LEU 95 1HD2 LEU 95 -14.765 -13.788 -23.607 730 HD23 LEU 95 2HD2 LEU 95 -14.802 -13.703 -21.846 731 H TYR 96 H TYR 96 -9.180 -12.977 -20.176 732 HA TYR 96 HA TYR 96 -10.619 -10.567 -19.962 733 HB2 TYR 96 1HB TYR 96 -11.679 -12.076 -18.098 734 HB3 TYR 96 2HB TYR 96 -10.178 -11.774 -17.232 735 HD1 TYR 96 HD1 TYR 96 -13.088 -10.128 -18.853 736 HD2 TYR 96 HD2 TYR 96 -9.767 -9.715 -16.171 737 HE1 TYR 96 HE1 TYR 96 -13.972 -7.935 -18.116 738 HE2 TYR 96 HE2 TYR 96 -10.634 -7.514 -15.424 739 HH TYR 96 HH TYR 96 -13.038 -5.823 -17.076 740 H ILE 97 H ILE 97 -8.280 -10.755 -21.013 741 HA ILE 97 HA ILE 97 -5.862 -10.882 -19.841 742 HB ILE 97 HB ILE 97 -6.561 -8.392 -21.395 743 HG12 ILE 97 1HG1 ILE 97 -6.057 -10.120 -23.397 744 HG13 ILE 97 2HG1 ILE 97 -6.759 -11.264 -22.253 745 HG21 ILE 97 1HG2 ILE 97 -4.209 -10.232 -21.796 746 HG22 ILE 97 2HG2 ILE 97 -4.195 -9.031 -20.507 747 HG23 ILE 97 3HG2 ILE 97 -4.357 -8.520 -22.186 748 HD11 ILE 97 3HD1 ILE 97 -8.688 -10.551 -23.312 749 HD12 ILE 97 1HD1 ILE 97 -8.033 -8.954 -23.662 750 HD13 ILE 97 2HD1 ILE 97 -8.615 -9.330 -22.044 751 H LEU 98 H LEU 98 -6.424 -10.493 -17.550 752 HA LEU 98 HA LEU 98 -6.356 -9.251 -15.604 753 HB2 LEU 98 1HB LEU 98 -4.747 -7.471 -17.457 754 HB3 LEU 98 2HB LEU 98 -4.941 -7.150 -15.737 755 HG LEU 98 HG LEU 98 -2.832 -8.345 -16.192 756 HD11 LEU 98 1HD1 LEU 98 -4.484 -10.447 -14.851 757 HD12 LEU 98 2HD1 LEU 98 -4.502 -8.834 -14.149 758 HD13 LEU 98 3HD1 LEU 98 -2.976 -9.692 -14.335 759 HD21 LEU 98 3HD2 LEU 98 -2.717 -10.436 -17.255 760 HD22 LEU 98 1HD2 LEU 98 -3.936 -9.593 -18.210 761 HD23 LEU 98 2HD2 LEU 98 -4.427 -10.776 -16.998 762 H GLY 99 H GLY 99 -6.544 -6.663 -18.031 763 HA2 GLY 99 1HA GLY 99 -8.188 -5.121 -18.492 764 HA3 GLY 99 2HA GLY 99 -9.313 -6.119 -17.576 765 H SER 100 H SER 100 -8.998 -6.072 -15.180 766 HA SER 100 HA SER 100 -7.770 -3.712 -14.047 767 HB2 SER 100 1HB SER 100 -9.976 -2.883 -14.904 768 HB3 SER 100 2HB SER 100 -10.776 -4.047 -13.853 769 HG SER 100 HG SER 100 -9.011 -2.797 -12.375 770 H ASP 101 H ASP 101 -7.246 -6.369 -13.749 771 HA ASP 101 HA ASP 101 -7.766 -6.759 -10.893 772 HB2 ASP 101 1HB ASP 101 -8.503 -8.759 -13.030 773 HB3 ASP 101 2HB ASP 101 -8.190 -9.237 -11.364 774 H VAL 102 H VAL 102 -5.457 -6.014 -11.144 775 HA VAL 102 HA VAL 102 -3.583 -7.885 -12.281 776 HB VAL 102 HB VAL 102 -3.418 -5.225 -11.764 777 HG11 VAL 102 1HG1 VAL 102 -1.727 -6.467 -9.592 778 HG12 VAL 102 2HG1 VAL 102 -3.314 -5.780 -9.271 779 HG13 VAL 102 3HG1 VAL 102 -2.019 -4.764 -9.894 780 HG21 VAL 102 3HG2 VAL 102 -1.141 -7.227 -11.866 781 HG22 VAL 102 1HG2 VAL 102 -0.935 -5.487 -12.064 782 HG23 VAL 102 2HG2 VAL 102 -1.884 -6.401 -13.235 783 H THR 103 H THR 103 -2.007 -9.016 -11.108 784 HA THR 103 HA THR 103 -2.865 -9.782 -8.353 785 HB THR 103 HB THR 103 -1.294 -11.727 -10.013 786 HG1 THR 103 HG1 THR 103 -3.547 -10.622 -10.856 787 HG21 THR 103 3HG2 THR 103 -2.757 -13.317 -8.799 788 HG22 THR 103 1HG2 THR 103 -3.623 -11.962 -8.075 789 HG23 THR 103 2HG2 THR 103 -1.924 -12.238 -7.680 790 H VAL 104 H VAL 104 -1.543 -8.943 -6.941 791 HA VAL 104 HA VAL 104 1.382 -9.103 -7.367 792 HB VAL 104 HB VAL 104 -0.301 -6.828 -6.289 793 HG11 VAL 104 1HG1 VAL 104 2.617 -7.452 -5.822 794 HG12 VAL 104 2HG1 VAL 104 1.390 -7.005 -4.637 795 HG13 VAL 104 3HG1 VAL 104 2.005 -5.799 -5.767 796 HG21 VAL 104 3HG2 VAL 104 0.784 -5.548 -7.981 797 HG22 VAL 104 1HG2 VAL 104 0.342 -7.067 -8.757 798 HG23 VAL 104 2HG2 VAL 104 2.005 -6.794 -8.244 799 H GLN 105 H GLN 105 2.469 -10.039 -5.733 800 HA GLN 105 HA GLN 105 1.056 -10.489 -3.156 801 HB2 GLN 105 1HB GLN 105 1.357 -12.507 -4.769 802 HB3 GLN 105 2HB GLN 105 3.061 -12.420 -4.328 803 HG2 GLN 105 1HG GLN 105 0.798 -12.639 -2.325 804 HG3 GLN 105 2HG GLN 105 1.746 -14.006 -2.902 805 HE21 GLN 105 2HE2 GLN 105 1.586 -11.648 -0.486 806 HE22 GLN 105 1HE2 GLN 105 3.186 -11.753 0.069 807 H LEU 106 H LEU 106 2.070 -9.248 -1.645 808 HA LEU 106 HA LEU 106 4.832 -8.491 -1.950 809 HB2 LEU 106 1HB LEU 106 4.429 -7.163 0.040 810 HB3 LEU 106 2HB LEU 106 3.069 -6.976 -1.066 811 HG LEU 106 HG LEU 106 2.207 -9.136 0.404 812 HD11 LEU 106 1HD1 LEU 106 3.327 -7.386 2.576 813 HD12 LEU 106 2HD1 LEU 106 4.369 -8.617 1.870 814 HD13 LEU 106 3HD1 LEU 106 2.850 -9.084 2.629 815 HD21 LEU 106 3HD2 LEU 106 0.706 -7.369 0.080 816 HD22 LEU 106 1HD2 LEU 106 1.804 -6.174 0.771 817 HD23 LEU 106 2HD2 LEU 106 0.976 -7.326 1.820 818 H ASN 107 H ASN 107 6.462 -9.534 -1.186 819 HA ASN 107 HA ASN 107 6.060 -11.633 0.902 820 HB2 ASN 107 1HB ASN 107 8.361 -11.503 -1.021 821 HB3 ASN 107 2HB ASN 107 7.844 -12.856 -0.017 822 HD21 ASN 107 2HD2 ASN 107 6.409 -10.686 -2.520 823 HD22 ASN 107 1HD2 ASN 107 5.545 -11.922 -3.294 824 H THR 108 H THR 108 6.268 -9.698 2.459 825 HA THR 108 HA THR 108 8.905 -8.611 2.770 826 HB THR 108 HB THR 108 7.003 -8.640 5.080 827 HG1 THR 108 HG1 THR 108 6.547 -7.230 2.666 828 HG21 THR 108 3HG2 THR 108 8.984 -7.294 5.303 829 HG22 THR 108 1HG2 THR 108 7.630 -6.194 5.062 830 HG23 THR 108 2HG2 THR 108 8.725 -6.546 3.730 831 H ALA 109 H ALA 109 9.919 -8.813 5.010 832 HA ALA 109 HA ALA 109 11.150 -11.220 5.320 833 HB1 ALA 109 3HB ALA 109 11.643 -9.013 6.504 834 HB2 ALA 109 1HB ALA 109 11.906 -10.486 7.440 835 HB3 ALA 109 2HB ALA 109 10.456 -9.518 7.707 836 H GLU 110 H GLU 110 8.042 -10.284 6.766 837 HA GLU 110 HA GLU 110 7.615 -13.121 7.500 838 HB2 GLU 110 1HB GLU 110 6.620 -12.464 9.613 839 HB3 GLU 110 2HB GLU 110 8.261 -11.821 9.523 840 HG2 GLU 110 1HG GLU 110 7.280 -9.658 8.670 841 HG3 GLU 110 2HG GLU 110 5.683 -10.319 9.016 842 H LEU 111 H LEU 111 6.276 -9.982 6.621 843 HA LEU 111 HA LEU 111 3.556 -10.880 6.598 844 HB2 LEU 111 1HB LEU 111 4.747 -8.485 5.174 845 HB3 LEU 111 2HB LEU 111 3.050 -8.749 5.540 846 HG LEU 111 HG LEU 111 5.225 -8.517 7.637 847 HD11 LEU 111 1HD1 LEU 111 3.322 -6.501 6.450 848 HD12 LEU 111 2HD1 LEU 111 5.059 -6.360 6.704 849 HD13 LEU 111 3HD1 LEU 111 3.963 -6.304 8.082 850 HD21 LEU 111 3HD2 LEU 111 3.455 -9.733 8.622 851 HD22 LEU 111 1HD2 LEU 111 2.223 -8.860 7.710 852 HD23 LEU 111 2HD2 LEU 111 3.060 -8.070 9.045 853 H LYS 112 H LYS 112 2.349 -11.618 4.940 854 HA LYS 112 HA LYS 112 3.356 -11.703 2.240 855 HB2 LYS 112 1HB LYS 112 4.474 -13.675 3.280 856 HB3 LYS 112 2HB LYS 112 2.878 -14.322 3.667 857 HG2 LYS 112 1HG LYS 112 2.277 -14.341 1.292 858 HG3 LYS 112 2HG LYS 112 3.835 -13.624 0.875 859 HD2 LYS 112 1HD LYS 112 4.992 -15.594 1.811 860 HD3 LYS 112 2HD LYS 112 3.432 -16.317 2.207 861 HE2 LYS 112 1HE LYS 112 2.811 -16.296 -0.180 862 HE3 LYS 112 2HE LYS 112 4.369 -15.571 -0.580 863 HZ1 LYS 112 3HZ LYS 112 3.734 -18.293 -0.099 864 HZ2 LYS 112 1HZ LYS 112 4.938 -17.771 0.977 865 HZ3 LYS 112 2HZ LYS 112 5.173 -17.617 -0.699 866 H LEU 113 H LEU 113 1.571 -10.730 1.488 867 HA LEU 113 HA LEU 113 -1.016 -12.144 1.856 868 HB2 LEU 113 1HB LEU 113 -0.327 -9.256 2.257 869 HB3 LEU 113 2HB LEU 113 -1.914 -9.643 1.596 870 HG LEU 113 HG LEU 113 -2.267 -11.190 3.557 871 HD11 LEU 113 1HD1 LEU 113 -0.573 -10.218 5.524 872 HD12 LEU 113 2HD1 LEU 113 0.509 -10.343 4.142 873 HD13 LEU 113 3HD1 LEU 113 -0.383 -11.756 4.697 874 HD21 LEU 113 3HD2 LEU 113 -1.680 -8.379 4.491 875 HD22 LEU 113 1HD2 LEU 113 -2.978 -9.455 5.002 876 HD23 LEU 113 2HD2 LEU 113 -3.018 -8.730 3.397 877 H VAL 114 H VAL 114 -2.643 -11.416 0.182 878 HA VAL 114 HA VAL 114 -1.345 -10.982 -2.457 879 HB VAL 114 HB VAL 114 -3.649 -12.804 -1.706 880 HG11 VAL 114 1HG1 VAL 114 -3.573 -13.334 -4.222 881 HG12 VAL 114 2HG1 VAL 114 -2.679 -11.823 -4.394 882 HG13 VAL 114 3HG1 VAL 114 -4.323 -11.806 -3.755 883 HG21 VAL 114 3HG2 VAL 114 -2.249 -14.585 -2.381 884 HG22 VAL 114 1HG2 VAL 114 -1.175 -13.531 -1.466 885 HG23 VAL 114 2HG2 VAL 114 -1.139 -13.510 -3.229 886 H PHE 115 H PHE 115 -2.087 -9.200 -3.481 887 HA PHE 115 HA PHE 115 -4.730 -8.115 -2.744 888 HB2 PHE 115 1HB PHE 115 -2.138 -6.673 -3.268 889 HB3 PHE 115 2HB PHE 115 -3.701 -5.859 -3.337 890 HD1 PHE 115 HD2 PHE 115 -1.304 -7.622 -1.149 891 HD2 PHE 115 HD1 PHE 115 -4.999 -5.431 -1.314 892 HE1 PHE 115 HE2 PHE 115 -1.304 -7.416 1.317 893 HE2 PHE 115 HE1 PHE 115 -4.988 -5.249 1.160 894 HZ PHE 115 HZ PHE 115 -3.152 -6.261 2.476 895 H GLN 116 H GLN 116 -6.063 -7.535 -4.323 896 HA GLN 116 HA GLN 116 -5.257 -8.011 -7.120 897 HB2 GLN 116 1HB GLN 116 -7.169 -9.346 -6.151 898 HB3 GLN 116 2HB GLN 116 -8.057 -7.832 -5.989 899 HG2 GLN 116 1HG GLN 116 -8.793 -8.624 -8.067 900 HG3 GLN 116 2HG GLN 116 -7.509 -7.514 -8.525 901 HE21 GLN 116 2HE2 GLN 116 -5.974 -8.337 -9.872 902 HE22 GLN 116 1HE2 GLN 116 -5.682 -9.988 -10.154 903 H LEU 117 H LEU 117 -4.351 -5.971 -7.558 904 HA LEU 117 HA LEU 117 -6.031 -3.584 -7.186 905 HB2 LEU 117 1HB LEU 117 -3.170 -3.755 -8.168 906 HB3 LEU 117 2HB LEU 117 -3.991 -2.329 -7.570 907 HG LEU 117 HG LEU 117 -3.675 -4.758 -5.801 908 HD11 LEU 117 1HD1 LEU 117 -1.671 -2.544 -6.278 909 HD12 LEU 117 2HD1 LEU 117 -1.418 -4.275 -6.497 910 HD13 LEU 117 3HD1 LEU 117 -1.638 -3.613 -4.876 911 HD21 LEU 117 3HD2 LEU 117 -3.917 -3.137 -4.026 912 HD22 LEU 117 1HD2 LEU 117 -5.212 -2.849 -5.182 913 HD23 LEU 117 2HD2 LEU 117 -3.798 -1.801 -5.165 914 HA PRO 118 HA PRO 118 -7.223 -3.564 -11.434 915 HB2 PRO 118 1HB PRO 118 -7.461 -0.893 -11.987 916 HB3 PRO 118 2HB PRO 118 -8.607 -1.775 -10.956 917 HG2 PRO 118 1HG PRO 118 -6.286 -0.071 -10.166 918 HG3 PRO 118 2HG PRO 118 -7.930 -0.102 -9.502 919 HD2 PRO 118 1HD PRO 118 -5.877 -1.349 -8.265 920 HD3 PRO 118 2HD PRO 118 -7.521 -2.015 -8.224 921 H PHE 119 H PHE 119 -6.080 -3.977 -13.239 922 HA PHE 119 HA PHE 119 -3.475 -3.829 -13.663 923 HB2 PHE 119 1HB PHE 119 -5.197 -4.921 -15.099 924 HB3 PHE 119 2HB PHE 119 -5.534 -3.346 -15.815 925 HD1 PHE 119 HD2 PHE 119 -2.958 -5.960 -15.357 926 HD2 PHE 119 HD1 PHE 119 -4.035 -2.344 -17.403 927 HE1 PHE 119 HE2 PHE 119 -1.039 -6.264 -16.901 928 HE2 PHE 119 HE1 PHE 119 -2.118 -2.646 -18.951 929 HZ PHE 119 HZ PHE 119 -0.620 -4.607 -18.699 930 H GLY 120 H GLY 120 -1.947 -2.530 -14.385 931 HA2 GLY 120 1HA GLY 120 -0.885 -0.458 -14.458 932 HA3 GLY 120 2HA GLY 120 -1.785 -0.423 -15.967 933 H SER 121 H SER 121 -2.415 1.648 -16.149 934 HA SER 121 HA SER 121 -3.442 3.650 -15.669 935 HB2 SER 121 1HB SER 121 -5.474 2.432 -15.730 936 HB3 SER 121 2HB SER 121 -5.134 1.632 -14.198 937 HG SER 121 HG SER 121 -5.125 4.362 -14.033 938 H HIS 122 H HIS 122 -4.731 2.989 -12.647 939 HA HIS 122 HA HIS 122 -2.979 4.877 -11.364 940 HB2 HIS 122 1HB HIS 122 -5.498 4.577 -10.954 941 HB3 HIS 122 2HB HIS 122 -5.054 3.175 -9.982 942 HD2 HIS 122 HD2 HIS 122 -4.743 3.929 -7.354 943 HE1 HIS 122 HE1 HIS 122 -3.416 7.886 -7.991 944 HE2 HIS 122 HE2 HIS 122 -3.992 6.159 -6.221 945 H THR 123 H THR 123 -2.759 1.581 -11.940 946 HA THR 123 HA THR 123 -1.323 0.966 -9.452 947 HB THR 123 HB THR 123 -2.055 -0.790 -11.803 948 HG1 THR 123 HG1 THR 123 -3.702 -1.417 -10.581 949 HG21 THR 123 3HG2 THR 123 -0.120 -1.751 -10.849 950 HG22 THR 123 1HG2 THR 123 -1.449 -2.580 -10.050 951 HG23 THR 123 2HG2 THR 123 -0.591 -1.295 -9.212 952 H ARG 124 H ARG 124 -0.703 1.538 -12.891 953 HA ARG 124 HA ARG 124 1.829 0.381 -13.108 954 HB2 ARG 124 1HB ARG 124 0.510 1.294 -15.004 955 HB3 ARG 124 2HB ARG 124 0.839 2.922 -14.423 956 HG2 ARG 124 1HG ARG 124 3.283 2.484 -14.671 957 HG3 ARG 124 2HG ARG 124 2.902 0.894 -15.334 958 HD2 ARG 124 1HD ARG 124 1.900 3.507 -16.485 959 HD3 ARG 124 2HD ARG 124 3.312 2.642 -17.085 960 HE ARG 124 HE ARG 124 0.523 1.895 -17.462 961 HH11 ARG 124 1HH2 ARG 124 3.849 0.943 -17.482 962 HH12 ARG 124 2HH2 ARG 124 3.605 -0.396 -18.552 963 HH21 ARG 124 1HH1 ARG 124 0.193 0.141 -18.871 964 HH22 ARG 124 2HH1 ARG 124 1.534 -0.850 -19.339 965 H THR 125 H THR 125 0.918 3.643 -12.086 966 HA THR 125 HA THR 125 3.502 4.677 -11.768 967 HB THR 125 HB THR 125 0.958 5.364 -10.273 968 HG1 THR 125 HG1 THR 125 0.760 6.919 -11.845 969 HG21 THR 125 3HG2 THR 125 2.180 7.567 -9.974 970 HG22 THR 125 1HG2 THR 125 3.641 6.731 -10.498 971 HG23 THR 125 2HG2 THR 125 2.811 6.218 -9.030 972 H PHE 126 H PHE 126 1.374 2.925 -9.557 973 HA PHE 126 HA PHE 126 2.831 3.157 -7.206 974 HB2 PHE 126 1HB PHE 126 0.587 2.109 -7.383 975 HB3 PHE 126 2HB PHE 126 1.333 0.705 -8.146 976 HD1 PHE 126 HD1 PHE 126 2.914 -0.729 -6.882 977 HD2 PHE 126 HD2 PHE 126 0.816 2.522 -5.021 978 HE1 PHE 126 HE1 PHE 126 3.468 -1.651 -4.648 979 HE2 PHE 126 HE2 PHE 126 1.369 1.601 -2.787 980 HZ PHE 126 HZ PHE 126 2.697 -0.485 -2.601 981 H LEU 127 H LEU 127 3.139 0.562 -9.698 982 HA LEU 127 HA LEU 127 5.071 -0.965 -8.519 983 HB2 LEU 127 1HB LEU 127 5.142 -0.211 -11.450 984 HB3 LEU 127 2HB LEU 127 5.700 -1.711 -10.713 985 HG LEU 127 HG LEU 127 2.842 -0.743 -10.836 986 HD11 LEU 127 1HD1 LEU 127 2.534 -2.669 -12.350 987 HD12 LEU 127 2HD1 LEU 127 4.257 -3.025 -12.237 988 HD13 LEU 127 3HD1 LEU 127 3.714 -1.527 -12.992 989 HD21 LEU 127 3HD2 LEU 127 2.505 -3.221 -10.038 990 HD22 LEU 127 1HD2 LEU 127 2.948 -2.002 -8.846 991 HD23 LEU 127 2HD2 LEU 127 4.175 -3.092 -9.487 992 H GLN 128 H GLN 128 5.632 1.952 -10.543 993 HA GLN 128 HA GLN 128 8.433 1.816 -10.361 994 HB2 GLN 128 1HB GLN 128 6.560 4.076 -11.008 995 HB3 GLN 128 2HB GLN 128 8.312 4.118 -11.245 996 HG2 GLN 128 1HG GLN 128 8.204 2.202 -12.737 997 HG3 GLN 128 2HG GLN 128 6.476 2.019 -12.425 998 HE21 GLN 128 2HE2 GLN 128 5.024 3.539 -13.371 999 HE22 GLN 128 1HE2 GLN 128 5.520 4.594 -14.586 1000 H GLU 129 H GLU 129 6.001 3.608 -8.477 1001 HA GLU 129 HA GLU 129 7.837 5.184 -7.005 1002 HB2 GLU 129 1HB GLU 129 5.026 4.291 -6.341 1003 HB3 GLU 129 2HB GLU 129 5.939 5.463 -5.394 1004 HG2 GLU 129 1HG GLU 129 5.333 5.760 -8.348 1005 HG3 GLU 129 2HG GLU 129 4.403 6.525 -7.062 1006 H VAL 130 H VAL 130 6.256 2.083 -6.203 1007 HA VAL 130 HA VAL 130 7.493 1.887 -3.640 1008 HB VAL 130 HB VAL 130 5.418 0.670 -4.298 1009 HG11 VAL 130 1HG1 VAL 130 5.486 -1.207 -5.743 1010 HG12 VAL 130 2HG1 VAL 130 7.248 -1.249 -5.742 1011 HG13 VAL 130 3HG1 VAL 130 6.394 0.046 -6.578 1012 HG21 VAL 130 3HG2 VAL 130 5.916 -1.293 -3.025 1013 HG22 VAL 130 1HG2 VAL 130 6.967 -0.026 -2.394 1014 HG23 VAL 130 2HG2 VAL 130 7.617 -1.246 -3.489 1015 H ALA 131 H ALA 131 8.180 0.409 -6.785 1016 HA ALA 131 HA ALA 131 10.413 -1.097 -6.054 1017 HB1 ALA 131 3HB ALA 131 10.965 -1.157 -8.417 1018 HB2 ALA 131 1HB ALA 131 9.927 0.236 -8.721 1019 HB3 ALA 131 2HB ALA 131 9.219 -1.297 -8.212 1020 H ARG 132 H ARG 132 10.280 2.266 -7.205 1021 HA ARG 132 HA ARG 132 13.157 2.554 -7.121 1022 HB2 ARG 132 1HB ARG 132 10.932 4.566 -7.498 1023 HB3 ARG 132 2HB ARG 132 12.651 4.955 -7.591 1024 HG2 ARG 132 1HG ARG 132 12.951 3.375 -9.427 1025 HG3 ARG 132 2HG ARG 132 11.266 2.866 -9.297 1026 HD2 ARG 132 1HD ARG 132 11.495 4.470 -11.123 1027 HD3 ARG 132 2HD ARG 132 10.550 5.185 -9.821 1028 HE ARG 132 HE ARG 132 13.296 5.820 -9.479 1029 HH11 ARG 132 1HH2 ARG 132 10.541 6.486 -11.461 1030 HH12 ARG 132 2HH2 ARG 132 11.045 8.094 -11.863 1031 HH21 ARG 132 1HH1 ARG 132 13.963 7.926 -9.995 1032 HH22 ARG 132 2HH1 ARG 132 12.984 8.909 -11.031 1033 H ALA 133 H ALA 133 10.568 2.885 -4.885 1034 HA ALA 133 HA ALA 133 11.649 4.831 -3.153 1035 HB1 ALA 133 3HB ALA 133 9.418 4.457 -2.702 1036 HB2 ALA 133 1HB ALA 133 10.116 3.400 -1.478 1037 HB3 ALA 133 2HB ALA 133 9.546 2.732 -2.995 1038 H CYS 134 H CYS 134 13.019 1.961 -3.944 1039 HA CYS 134 HA CYS 134 15.104 2.026 -2.216 1040 HB2 CYS 134 1HB CYS 134 12.753 1.058 -0.755 1041 HB3 CYS 134 2HB CYS 134 14.082 -0.089 -0.683 1042 HG CYS 134 HG CYS 134 14.516 1.582 1.231 1043 HA PRO 135 HA PRO 135 14.743 -2.679 -3.586 1044 HB2 PRO 135 1HB PRO 135 12.569 -2.261 -5.617 1045 HB3 PRO 135 2HB PRO 135 12.926 -3.691 -4.625 1046 HG2 PRO 135 1HG PRO 135 10.905 -2.098 -4.007 1047 HG3 PRO 135 2HG PRO 135 11.933 -2.788 -2.736 1048 HD2 PRO 135 1HD PRO 135 11.895 0.016 -3.805 1049 HD3 PRO 135 2HD PRO 135 12.194 -0.569 -2.159 1050 H GLY 136 H GLY 136 13.874 -0.161 -5.963 1051 HA2 GLY 136 1HA GLY 136 14.669 0.084 -8.187 1052 HA3 GLY 136 2HA GLY 136 16.075 0.528 -7.222 1053 H PHE 137 H PHE 137 14.523 -2.596 -7.843 1054 HA PHE 137 HA PHE 137 15.601 -4.656 -8.096 1055 HB2 PHE 137 1HB PHE 137 15.993 -3.102 -10.656 1056 HB3 PHE 137 2HB PHE 137 16.231 -4.845 -10.518 1057 HD1 PHE 137 HD1 PHE 137 14.314 -6.334 -9.922 1058 HD2 PHE 137 HD2 PHE 137 13.784 -2.136 -10.670 1059 HE1 PHE 137 HE1 PHE 137 11.874 -6.688 -10.193 1060 HE2 PHE 137 HE2 PHE 137 11.346 -2.493 -10.942 1061 HZ PHE 137 HZ PHE 137 10.390 -4.769 -10.704 1062 H ASP 138 H ASP 138 17.323 -4.506 -6.546 1063 HA ASP 138 HA ASP 138 19.813 -5.223 -7.408 1064 HB2 ASP 138 1HB ASP 138 19.423 -2.290 -7.538 1065 HB3 ASP 138 2HB ASP 138 20.880 -2.773 -6.679 1066 HA PRO 139 HA PRO 139 19.997 -5.729 -2.988 1067 HB2 PRO 139 1HB PRO 139 22.617 -6.360 -2.592 1068 HB3 PRO 139 2HB PRO 139 21.486 -7.458 -3.407 1069 HG2 PRO 139 1HG PRO 139 23.525 -5.626 -4.592 1070 HG3 PRO 139 2HG PRO 139 23.098 -7.284 -5.052 1071 HD2 PRO 139 1HD PRO 139 22.174 -5.058 -6.398 1072 HD3 PRO 139 2HD PRO 139 21.300 -6.605 -6.340 1073 H GLU 140 H GLU 140 21.252 -3.101 -4.490 1074 HA GLU 140 HA GLU 140 22.740 -1.949 -2.265 1075 HB2 GLU 140 1HB GLU 140 21.864 -0.824 -4.934 1076 HB3 GLU 140 2HB GLU 140 22.822 0.068 -3.749 1077 HG2 GLU 140 1HG GLU 140 24.574 -1.626 -3.833 1078 HG3 GLU 140 2HG GLU 140 23.608 -2.604 -4.936 1079 H THR 141 H THR 141 20.005 -2.717 -1.739 1080 HA THR 141 HA THR 141 18.765 -0.070 -1.181 1081 HB THR 141 HB THR 141 17.514 -1.606 -2.757 1082 HG1 THR 141 HG1 THR 141 16.107 -1.243 -0.346 1083 HG21 THR 141 3HG2 THR 141 18.197 -3.675 -1.397 1084 HG22 THR 141 1HG2 THR 141 16.519 -3.604 -1.934 1085 HG23 THR 141 2HG2 THR 141 16.929 -3.209 -0.264 1086 H ARG 142 H ARG 142 20.535 -2.338 0.310 1087 HA ARG 142 HA ARG 142 18.998 -2.964 2.629 1088 HB2 ARG 142 1HB ARG 142 21.185 -3.633 3.592 1089 HB3 ARG 142 2HB ARG 142 20.892 -4.334 1.998 1090 HG2 ARG 142 1HG ARG 142 22.247 -2.563 0.958 1091 HG3 ARG 142 2HG ARG 142 22.534 -1.843 2.542 1092 HD2 ARG 142 1HD ARG 142 24.444 -3.220 1.955 1093 HD3 ARG 142 2HD ARG 142 23.572 -3.984 3.282 1094 HE ARG 142 HE ARG 142 22.600 -4.976 0.811 1095 HH11 ARG 142 1HH2 ARG 142 25.353 -5.041 2.902 1096 HH12 ARG 142 2HH2 ARG 142 25.861 -6.622 2.412 1097 HH21 ARG 142 1HH1 ARG 142 23.255 -7.049 0.163 1098 HH22 ARG 142 2HH1 ARG 142 24.672 -7.760 0.860 1099 H ASP 143 H ASP 143 18.708 -0.281 2.165 1100 HA ASP 143 HA ASP 143 20.120 0.959 4.477 1101 HB2 ASP 143 1HB ASP 143 19.721 3.142 3.261 1102 HB3 ASP 143 2HB ASP 143 20.900 2.063 2.519 1103 HA PRO 144 HA PRO 144 15.417 1.145 4.938 1104 HB2 PRO 144 1HB PRO 144 15.105 -0.556 7.055 1105 HB3 PRO 144 2HB PRO 144 15.077 -1.109 5.366 1106 HG2 PRO 144 1HG PRO 144 17.326 -1.184 7.338 1107 HG3 PRO 144 2HG PRO 144 16.776 -2.440 6.211 1108 HD2 PRO 144 1HD PRO 144 18.923 -0.853 5.656 1109 HD3 PRO 144 2HD PRO 144 17.838 -1.463 4.385 1110 H GLU 145 H GLU 145 14.291 2.111 6.707 1111 HA GLU 145 HA GLU 145 15.618 2.901 9.129 1112 HB2 GLU 145 1HB GLU 145 16.634 4.488 7.460 1113 HB3 GLU 145 2HB GLU 145 15.013 5.099 7.138 1114 HG2 GLU 145 1HG GLU 145 15.989 6.570 8.768 1115 HG3 GLU 145 2HG GLU 145 14.811 5.583 9.622 1116 H PHE 146 H PHE 146 13.915 2.412 10.376 1117 HA PHE 146 HA PHE 146 11.234 3.436 9.625 1118 HB2 PHE 146 1HB PHE 146 10.620 1.646 11.500 1119 HB3 PHE 146 2HB PHE 146 10.924 1.149 9.838 1120 HD1 PHE 146 HD1 PHE 146 12.442 1.436 13.213 1121 HD2 PHE 146 HD2 PHE 146 12.842 -0.158 9.246 1122 HE1 PHE 146 HE1 PHE 146 14.336 0.028 13.970 1123 HE2 PHE 146 HE2 PHE 146 14.737 -1.566 10.002 1124 HZ PHE 146 HZ PHE 146 15.485 -1.474 12.363 1125 H GLU 147 H GLU 147 13.716 4.470 11.300 1126 HA GLU 147 HA GLU 147 12.854 4.848 13.949 1127 HB2 GLU 147 1HB GLU 147 15.175 5.169 13.144 1128 HB3 GLU 147 2HB GLU 147 14.660 6.633 12.307 1129 HG2 GLU 147 1HG GLU 147 13.965 7.631 14.441 1130 HG3 GLU 147 2HG GLU 147 14.421 6.157 15.291 1131 H TRP 148 H TRP 148 12.397 6.906 11.071 1132 HA TRP 148 HA TRP 148 11.145 9.014 12.541 1133 HB2 TRP 148 1HB TRP 148 10.551 9.934 10.345 1134 HB3 TRP 148 2HB TRP 148 12.246 9.456 10.408 1135 HD1 TRP 148 HD1 TRP 148 12.780 6.931 9.358 1136 HE1 TRP 148 HE1 TRP 148 11.747 5.816 7.279 1137 HE3 TRP 148 HE3 TRP 148 8.558 9.765 8.832 1138 HZ2 TRP 148 HZ2 TRP 148 9.445 6.087 5.607 1139 HZ3 TRP 148 HZ3 TRP 148 6.969 9.318 6.982 1140 HH2 TRP 148 HH2 TRP 148 7.404 7.482 5.365 1141 H LEU 149 H LEU 149 9.951 6.104 10.965 1142 HA LEU 149 HA LEU 149 7.227 6.823 10.801 1143 HB2 LEU 149 1HB LEU 149 8.520 4.117 11.173 1144 HB3 LEU 149 2HB LEU 149 6.812 4.351 10.821 1145 HG LEU 149 HG LEU 149 9.056 5.386 9.057 1146 HD11 LEU 149 1HD1 LEU 149 8.841 3.489 7.688 1147 HD12 LEU 149 2HD1 LEU 149 7.282 3.042 8.379 1148 HD13 LEU 149 3HD1 LEU 149 8.762 2.796 9.306 1149 HD21 LEU 149 3HD2 LEU 149 7.013 5.339 7.397 1150 HD22 LEU 149 1HD2 LEU 149 7.159 6.674 8.533 1151 HD23 LEU 149 2HD2 LEU 149 6.042 5.352 8.867 1152 H SER 150 H SER 150 9.150 5.401 13.414 1153 HA SER 150 HA SER 150 7.212 4.649 15.210 1154 HB2 SER 150 1HB SER 150 8.849 5.132 16.965 1155 HB3 SER 150 2HB SER 150 9.653 4.408 15.573 1156 HG SER 150 HG SER 150 10.709 6.304 16.413 1157 H ARG 151 H ARG 151 8.126 7.834 14.190 1158 HA ARG 151 HA ARG 151 7.000 9.358 16.297 1159 HB2 ARG 151 1HB ARG 151 7.183 10.096 13.365 1160 HB3 ARG 151 2HB ARG 151 7.087 11.208 14.726 1161 HG2 ARG 151 1HG ARG 151 9.357 9.229 14.403 1162 HG3 ARG 151 2HG ARG 151 9.416 10.854 13.731 1163 HD2 ARG 151 1HD ARG 151 9.123 10.118 16.655 1164 HD3 ARG 151 2HD ARG 151 10.511 10.873 15.885 1165 HE ARG 151 HE ARG 151 8.247 12.478 15.411 1166 HH11 ARG 151 1HH2 ARG 151 10.316 11.411 17.970 1167 HH12 ARG 151 2HH2 ARG 151 10.086 12.834 18.930 1168 HH21 ARG 151 1HH1 ARG 151 7.940 14.338 16.658 1169 HH22 ARG 151 2HH1 ARG 151 8.738 14.494 18.186 1170 H HIS 152 H HIS 152 5.761 8.008 13.324 1171 HA HIS 152 HA HIS 152 3.109 9.104 13.714 1172 HB2 HIS 152 1HB HIS 152 4.202 7.084 11.737 1173 HB3 HIS 152 2HB HIS 152 2.560 7.727 11.714 1174 HD2 HIS 152 HD2 HIS 152 5.857 8.582 10.115 1175 HE1 HIS 152 HE1 HIS 152 3.807 12.261 10.375 1176 HE2 HIS 152 HE2 HIS 152 5.789 11.068 9.325 1177 H THR 153 H THR 153 1.272 7.846 14.115 1178 HA THR 153 HA THR 153 1.765 5.236 15.449 1179 HB THR 153 HB THR 153 1.166 7.012 17.083 1180 HG1 THR 153 HG1 THR 153 0.486 5.056 17.702 1181 HG21 THR 153 3HG2 THR 153 -1.004 8.062 17.019 1182 HG22 THR 153 1HG2 THR 153 -1.483 7.101 15.621 1183 HG23 THR 153 2HG2 THR 153 -0.234 8.336 15.455 1184 H CYS 154 H CYS 154 -1.055 4.822 15.852 1185 HA CYS 154 HA CYS 154 -2.287 4.835 13.225 1186 HB2 CYS 154 1HB CYS 154 -2.500 2.412 13.053 1187 HB3 CYS 154 2HB CYS 154 -0.795 2.855 13.120 1188 HG CYS 154 HG CYS 154 -0.564 1.682 15.298 1189 H ALA 155 H ALA 155 -4.501 4.044 13.299 1190 HA ALA 155 HA ALA 155 -5.664 4.349 16.008 1191 HB1 ALA 155 3HB ALA 155 -7.712 5.019 14.867 1192 HB2 ALA 155 1HB ALA 155 -6.975 4.689 13.300 1193 HB3 ALA 155 2HB ALA 155 -6.365 6.006 14.300 1194 H GLU 156 H GLU 156 -4.607 1.880 15.542 1195 HA GLU 156 HA GLU 156 -6.305 0.026 14.312 1196 HB2 GLU 156 1HB GLU 156 -5.152 -1.654 15.789 1197 HB3 GLU 156 2HB GLU 156 -4.056 -0.615 14.877 1198 HG2 GLU 156 1HG GLU 156 -3.877 0.874 16.879 1199 HG3 GLU 156 2HG GLU 156 -4.863 -0.276 17.781 1200 HA PRO 157 HA PRO 157 -9.836 -0.307 16.997 1201 HB2 PRO 157 1HB PRO 157 -9.308 -3.262 17.105 1202 HB3 PRO 157 2HB PRO 157 -10.817 -2.396 16.734 1203 HG2 PRO 157 1HG PRO 157 -9.404 -3.491 14.797 1204 HG3 PRO 157 2HG PRO 157 -10.152 -1.897 14.582 1205 HD2 PRO 157 1HD PRO 157 -7.264 -2.568 15.070 1206 HD3 PRO 157 2HD PRO 157 -7.982 -1.302 14.046 1207 H ASP 158 H ASP 158 -10.474 -0.790 19.159 1208 HA ASP 158 HA ASP 158 -8.213 -0.841 21.024 1209 HB2 ASP 158 1HB ASP 158 -10.083 0.871 21.141 1210 HB3 ASP 158 2HB ASP 158 -11.132 -0.440 21.678 1211 H ALA 159 H ALA 159 -7.550 -2.747 21.745 1212 HA ALA 159 HA ALA 159 -8.954 -5.163 21.576 1213 HB1 ALA 159 3HB ALA 159 -6.555 -5.156 21.821 1214 HB2 ALA 159 1HB ALA 159 -7.243 -5.998 23.209 1215 HB3 ALA 159 2HB ALA 159 -6.670 -4.339 23.379 1216 H GLU 160 H GLU 160 -8.725 -2.811 24.207 1217 HA GLU 160 HA GLU 160 -9.881 -2.596 26.179 1218 HB2 GLU 160 1HB GLU 160 -11.915 -4.117 24.538 1219 HB3 GLU 160 2HB GLU 160 -12.256 -3.427 26.124 1220 HG2 GLU 160 1HG GLU 160 -11.712 -1.195 25.320 1221 HG3 GLU 160 2HG GLU 160 -11.228 -1.844 23.753 1222 H SER 161 H SER 161 -8.080 -4.187 26.857 1223 HA SER 161 HA SER 161 -9.223 -6.077 28.647 1224 HB2 SER 161 1HB SER 161 -9.529 -7.546 26.815 1225 HB3 SER 161 2HB SER 161 -7.965 -7.131 26.119 1226 HG SER 161 HG SER 161 -7.636 -7.994 28.631 Start of MODEL 17 1 H1 GLY 1 1H GLY 1 -17.567 10.108 -18.568 2 H2 GLY 1 2H GLY 1 -16.441 10.639 -19.724 3 H3 GLY 1 3H GLY 1 -16.600 11.463 -18.246 4 HA2 GLY 1 1HA GLY 1 -15.429 8.794 -18.744 5 HA3 GLY 1 2HA GLY 1 -14.669 10.197 -17.991 6 HA PRO 2 HA PRO 2 -16.194 7.201 -14.698 7 HB2 PRO 2 1HB PRO 2 -13.697 8.325 -13.474 8 HB3 PRO 2 2HB PRO 2 -14.287 6.650 -13.493 9 HG2 PRO 2 1HG PRO 2 -12.284 7.405 -15.068 10 HG3 PRO 2 2HG PRO 2 -13.516 6.262 -15.641 11 HD2 PRO 2 1HD PRO 2 -13.194 9.174 -16.302 12 HD3 PRO 2 2HD PRO 2 -13.747 7.837 -17.337 13 H LEU 3 H LEU 3 -14.913 10.498 -14.530 14 HA LEU 3 HA LEU 3 -15.374 12.246 -13.078 15 HB2 LEU 3 1HB LEU 3 -17.247 12.258 -14.739 16 HB3 LEU 3 2HB LEU 3 -18.199 11.287 -13.618 17 HG LEU 3 HG LEU 3 -17.967 13.087 -11.904 18 HD11 LEU 3 1HD1 LEU 3 -16.073 14.334 -12.310 19 HD12 LEU 3 2HD1 LEU 3 -17.253 15.382 -13.089 20 HD13 LEU 3 3HD1 LEU 3 -16.270 14.285 -14.060 21 HD21 LEU 3 3HD2 LEU 3 -19.439 14.752 -13.078 22 HD22 LEU 3 1HD2 LEU 3 -19.968 13.081 -13.275 23 HD23 LEU 3 2HD2 LEU 3 -19.122 13.899 -14.588 24 H GLY 4 H GLY 4 -14.423 10.880 -11.300 25 HA2 GLY 4 1HA GLY 4 -16.440 10.515 -9.156 26 HA3 GLY 4 2HA GLY 4 -15.213 9.285 -9.453 27 H SER 5 H SER 5 -15.970 11.906 -7.590 28 HA SER 5 HA SER 5 -13.275 12.960 -7.265 29 HB2 SER 5 1HB SER 5 -15.238 14.455 -7.120 30 HB3 SER 5 2HB SER 5 -15.825 13.541 -5.735 31 HG SER 5 HG SER 5 -14.068 14.204 -4.569 32 H MET 6 H MET 6 -12.965 13.352 -4.639 33 HA MET 6 HA MET 6 -11.987 12.264 -2.843 34 HB2 MET 6 1HB MET 6 -14.598 10.737 -2.974 35 HB3 MET 6 2HB MET 6 -13.567 10.929 -1.558 36 HG2 MET 6 1HG MET 6 -14.974 13.175 -3.038 37 HG3 MET 6 2HG MET 6 -15.459 12.515 -1.479 38 HE1 MET 6 3HE MET 6 -12.997 13.571 1.036 39 HE2 MET 6 1HE MET 6 -12.478 12.167 0.095 40 HE3 MET 6 2HE MET 6 -14.183 12.395 0.475 41 H ASP 7 H ASP 7 -10.526 11.319 -4.590 42 HA ASP 7 HA ASP 7 -10.853 8.504 -5.197 43 HB2 ASP 7 1HB ASP 7 -8.618 10.464 -5.724 44 HB3 ASP 7 2HB ASP 7 -8.548 8.765 -6.184 45 H GLN 8 H GLN 8 -8.552 7.331 -4.951 46 HA GLN 8 HA GLN 8 -8.337 6.775 -2.140 47 HB2 GLN 8 1HB GLN 8 -6.840 5.835 -4.580 48 HB3 GLN 8 2HB GLN 8 -6.347 5.348 -2.955 49 HG2 GLN 8 1HG GLN 8 -7.774 3.622 -3.696 50 HG3 GLN 8 2HG GLN 8 -8.784 4.593 -2.635 51 HE21 GLN 8 2HE2 GLN 8 -10.391 3.295 -4.192 52 HE22 GLN 8 1HE2 GLN 8 -10.885 4.159 -5.561 53 H SER 9 H SER 9 -6.177 8.259 -4.529 54 HA SER 9 HA SER 9 -3.977 8.732 -2.907 55 HB2 SER 9 1HB SER 9 -3.411 10.599 -4.410 56 HB3 SER 9 2HB SER 9 -3.946 9.185 -5.313 57 HG SER 9 HG SER 9 -5.588 11.377 -4.551 58 H VAL 10 H VAL 10 -6.747 10.913 -3.429 59 HA VAL 10 HA VAL 10 -5.859 12.871 -1.568 60 HB VAL 10 HB VAL 10 -7.474 13.437 -3.292 61 HG11 VAL 10 1HG1 VAL 10 -9.439 11.636 -1.855 62 HG12 VAL 10 2HG1 VAL 10 -8.546 11.148 -3.296 63 HG13 VAL 10 3HG1 VAL 10 -9.682 12.492 -3.375 64 HG21 VAL 10 3HG2 VAL 10 -8.981 14.715 -1.960 65 HG22 VAL 10 1HG2 VAL 10 -7.528 14.538 -0.976 66 HG23 VAL 10 2HG2 VAL 10 -8.940 13.535 -0.649 67 H ALA 11 H ALA 11 -8.125 10.177 -1.351 68 HA ALA 11 HA ALA 11 -9.223 10.452 1.105 69 HB1 ALA 11 3HB ALA 11 -8.104 7.860 0.006 70 HB2 ALA 11 1HB ALA 11 -9.700 8.522 -0.337 71 HB3 ALA 11 2HB ALA 11 -9.296 7.996 1.294 72 H ILE 12 H ILE 12 -5.975 9.154 0.470 73 HA ILE 12 HA ILE 12 -5.377 8.686 3.200 74 HB ILE 12 HB ILE 12 -3.468 9.171 0.914 75 HG12 ILE 12 1HG1 ILE 12 -5.006 7.386 0.341 76 HG13 ILE 12 2HG1 ILE 12 -3.457 6.674 0.759 77 HG21 ILE 12 1HG2 ILE 12 -3.172 8.012 3.680 78 HG22 ILE 12 2HG2 ILE 12 -2.201 9.259 2.899 79 HG23 ILE 12 3HG2 ILE 12 -2.056 7.578 2.385 80 HD11 ILE 12 3HD1 ILE 12 -4.519 6.515 3.173 81 HD12 ILE 12 1HD1 ILE 12 -4.920 5.318 1.946 82 HD13 ILE 12 2HD1 ILE 12 -6.036 6.636 2.284 83 H GLN 13 H GLN 13 -4.640 11.310 1.007 84 HA GLN 13 HA GLN 13 -2.986 12.836 2.583 85 HB2 GLN 13 1HB GLN 13 -4.196 13.263 0.173 86 HB3 GLN 13 2HB GLN 13 -5.051 14.443 1.162 87 HG2 GLN 13 1HG GLN 13 -2.060 14.216 0.741 88 HG3 GLN 13 2HG GLN 13 -3.109 15.555 0.282 89 HE21 GLN 13 2HE2 GLN 13 -0.777 14.962 2.469 90 HE22 GLN 13 1HE2 GLN 13 -1.378 15.811 3.809 91 H GLU 14 H GLU 14 -6.556 12.979 2.586 92 HA GLU 14 HA GLU 14 -6.751 14.914 4.626 93 HB2 GLU 14 1HB GLU 14 -8.666 12.739 3.745 94 HB3 GLU 14 2HB GLU 14 -9.094 14.077 4.812 95 HG2 GLU 14 1HG GLU 14 -7.955 14.444 2.025 96 HG3 GLU 14 2HG GLU 14 -9.681 14.456 2.383 97 H THR 15 H THR 15 -6.874 11.368 4.701 98 HA THR 15 HA THR 15 -7.257 11.175 7.530 99 HB THR 15 HB THR 15 -6.883 8.797 7.237 100 HG1 THR 15 HG1 THR 15 -5.785 8.041 5.608 101 HG21 THR 15 3HG2 THR 15 -9.063 9.320 6.550 102 HG22 THR 15 1HG2 THR 15 -8.418 8.458 5.156 103 HG23 THR 15 2HG2 THR 15 -8.510 10.215 5.135 104 H LEU 16 H LEU 16 -4.413 11.243 5.457 105 HA LEU 16 HA LEU 16 -2.551 10.177 7.262 106 HB2 LEU 16 1HB LEU 16 -2.141 10.655 4.821 107 HB3 LEU 16 2HB LEU 16 -2.011 12.360 5.229 108 HG LEU 16 HG LEU 16 -0.133 11.777 6.804 109 HD11 LEU 16 1HD1 LEU 16 0.916 9.440 6.176 110 HD12 LEU 16 2HD1 LEU 16 -0.748 9.035 5.763 111 HD13 LEU 16 3HD1 LEU 16 -0.344 9.542 7.402 112 HD21 LEU 16 3HD2 LEU 16 1.493 11.170 4.929 113 HD22 LEU 16 1HD2 LEU 16 0.508 12.612 4.669 114 HD23 LEU 16 2HD2 LEU 16 0.083 11.092 3.880 115 H VAL 17 H VAL 17 -1.334 13.199 6.635 116 HA VAL 17 HA VAL 17 -2.395 14.783 8.691 117 HB VAL 17 HB VAL 17 -1.447 13.215 10.262 118 HG11 VAL 17 1HG1 VAL 17 0.970 13.401 8.472 119 HG12 VAL 17 2HG1 VAL 17 0.148 11.966 9.084 120 HG13 VAL 17 3HG1 VAL 17 1.147 12.932 10.163 121 HG21 VAL 17 3HG2 VAL 17 0.502 15.526 10.033 122 HG22 VAL 17 1HG2 VAL 17 0.005 14.684 11.500 123 HG23 VAL 17 2HG2 VAL 17 -1.145 15.706 10.637 124 H GLU 18 H GLU 18 -1.141 16.763 8.955 125 HA GLU 18 HA GLU 18 -0.153 17.731 6.512 126 HB2 GLU 18 1HB GLU 18 0.148 18.786 9.330 127 HB3 GLU 18 2HB GLU 18 0.584 19.693 7.882 128 HG2 GLU 18 1HG GLU 18 -1.602 20.437 8.292 129 HG3 GLU 18 2HG GLU 18 -1.866 19.161 7.108 130 H GLY 19 H GLY 19 2.030 19.069 6.691 131 HA2 GLY 19 1HA GLY 19 4.324 19.033 6.587 132 HA3 GLY 19 2HA GLY 19 4.273 17.960 7.980 133 H GLU 20 H GLU 20 2.755 15.859 6.647 134 HA GLU 20 HA GLU 20 4.969 14.543 5.366 135 HB2 GLU 20 1HB GLU 20 2.153 13.656 5.978 136 HB3 GLU 20 2HB GLU 20 3.330 12.635 5.149 137 HG2 GLU 20 1HG GLU 20 4.868 12.822 7.050 138 HG3 GLU 20 2HG GLU 20 3.743 13.897 7.876 139 H TYR 21 H TYR 21 4.242 13.073 3.424 140 HA TYR 21 HA TYR 21 2.841 14.675 1.372 141 HB2 TYR 21 1HB TYR 21 5.333 15.148 1.376 142 HB3 TYR 21 2HB TYR 21 5.564 13.456 0.932 143 HD1 TYR 21 HD2 TYR 21 4.594 12.579 -1.191 144 HD2 TYR 21 HD1 TYR 21 4.589 16.762 -0.226 145 HE1 TYR 21 HE2 TYR 21 4.168 13.121 -3.567 146 HE2 TYR 21 HE1 TYR 21 4.159 17.309 -2.608 147 HH TYR 21 HH TYR 21 3.171 16.183 -4.600 148 H CYS 22 H CYS 22 1.464 13.438 0.286 149 HA CYS 22 HA CYS 22 1.863 10.504 0.272 150 HB2 CYS 22 1HB CYS 22 -0.626 11.761 -0.834 151 HB3 CYS 22 2HB CYS 22 -0.426 10.250 0.052 152 HG CYS 22 HG CYS 22 0.011 11.832 2.221 153 H VAL 23 H VAL 23 2.114 9.396 -1.697 154 HA VAL 23 HA VAL 23 2.656 11.132 -4.025 155 HB VAL 23 HB VAL 23 3.571 8.309 -3.473 156 HG11 VAL 23 1HG1 VAL 23 5.215 8.816 -5.248 157 HG12 VAL 23 2HG1 VAL 23 4.481 10.404 -5.473 158 HG13 VAL 23 3HG1 VAL 23 3.564 8.946 -5.852 159 HG21 VAL 23 3HG2 VAL 23 5.048 10.930 -3.100 160 HG22 VAL 23 1HG2 VAL 23 5.707 9.316 -2.837 161 HG23 VAL 23 2HG2 VAL 23 4.425 9.923 -1.793 162 H ILE 24 H ILE 24 1.252 7.998 -3.100 163 HA ILE 24 HA ILE 24 -0.895 8.229 -4.964 164 HB ILE 24 HB ILE 24 0.834 7.818 -6.596 165 HG12 ILE 24 1HG1 ILE 24 0.074 5.630 -7.565 166 HG13 ILE 24 2HG1 ILE 24 -0.842 5.332 -6.095 167 HG21 ILE 24 1HG2 ILE 24 2.076 5.568 -6.454 168 HG22 ILE 24 2HG2 ILE 24 1.594 5.559 -4.759 169 HG23 ILE 24 3HG2 ILE 24 2.599 6.863 -5.378 170 HD11 ILE 24 3HD1 ILE 24 -2.084 6.391 -8.096 171 HD12 ILE 24 1HD1 ILE 24 -1.223 7.871 -7.678 172 HD13 ILE 24 2HD1 ILE 24 -2.318 7.128 -6.511 173 H ALA 25 H ALA 25 -2.502 6.856 -4.508 174 HA ALA 25 HA ALA 25 -2.008 4.497 -2.848 175 HB1 ALA 25 3HB ALA 25 -3.600 5.113 -1.178 176 HB2 ALA 25 1HB ALA 25 -4.102 6.531 -2.099 177 HB3 ALA 25 2HB ALA 25 -2.506 6.486 -1.351 178 H VAL 26 H VAL 26 -3.139 2.826 -3.551 179 HA VAL 26 HA VAL 26 -5.548 3.361 -5.185 180 HB VAL 26 HB VAL 26 -5.025 1.405 -6.465 181 HG11 VAL 26 1HG1 VAL 26 -2.784 2.021 -7.378 182 HG12 VAL 26 2HG1 VAL 26 -2.579 3.126 -6.019 183 HG13 VAL 26 3HG1 VAL 26 -3.868 3.400 -7.191 184 HG21 VAL 26 3HG2 VAL 26 -2.757 0.236 -5.899 185 HG22 VAL 26 1HG2 VAL 26 -4.181 -0.172 -4.945 186 HG23 VAL 26 2HG2 VAL 26 -2.978 0.947 -4.301 187 H GLN 27 H GLN 27 -6.443 0.723 -5.301 188 HA GLN 27 HA GLN 27 -6.776 -0.194 -2.557 189 HB2 GLN 27 1HB GLN 27 -8.467 1.584 -2.782 190 HB3 GLN 27 2HB GLN 27 -9.124 0.777 -4.206 191 HG2 GLN 27 1HG GLN 27 -9.800 -1.123 -2.925 192 HG3 GLN 27 2HG GLN 27 -8.885 -0.580 -1.521 193 HE21 GLN 27 2HE2 GLN 27 -11.492 -1.068 -0.985 194 HE22 GLN 27 1HE2 GLN 27 -12.374 0.371 -0.845 195 H GLY 28 H GLY 28 -7.989 -2.207 -2.461 196 HA2 GLY 28 1HA GLY 28 -8.706 -3.651 -4.815 197 HA3 GLY 28 2HA GLY 28 -7.111 -4.135 -4.252 198 H VAL 29 H VAL 29 -8.443 -6.183 -4.121 199 HA VAL 29 HA VAL 29 -9.839 -6.394 -1.515 200 HB VAL 29 HB VAL 29 -10.768 -8.515 -2.399 201 HG11 VAL 29 1HG1 VAL 29 -12.026 -6.404 -2.639 202 HG12 VAL 29 2HG1 VAL 29 -12.322 -7.478 -4.005 203 HG13 VAL 29 3HG1 VAL 29 -11.231 -6.105 -4.184 204 HG21 VAL 29 3HG2 VAL 29 -9.368 -7.633 -4.937 205 HG22 VAL 29 1HG2 VAL 29 -10.523 -8.963 -4.832 206 HG23 VAL 29 2HG2 VAL 29 -8.985 -9.062 -3.973 207 H LEU 30 H LEU 30 -9.502 -8.522 -0.446 208 HA LEU 30 HA LEU 30 -6.894 -9.753 -0.922 209 HB2 LEU 30 1HB LEU 30 -6.314 -8.008 0.680 210 HB3 LEU 30 2HB LEU 30 -7.675 -8.448 1.710 211 HG LEU 30 HG LEU 30 -6.662 -10.666 2.113 212 HD11 LEU 30 1HD1 LEU 30 -5.450 -11.131 0.120 213 HD12 LEU 30 2HD1 LEU 30 -4.223 -10.907 1.351 214 HD13 LEU 30 3HD1 LEU 30 -4.568 -9.606 0.220 215 HD21 LEU 30 3HD2 LEU 30 -4.844 -8.293 2.593 216 HD22 LEU 30 1HD2 LEU 30 -4.640 -9.867 3.364 217 HD23 LEU 30 2HD2 LEU 30 -6.091 -8.916 3.673 218 H CYS 31 H CYS 31 -7.212 -11.973 -0.765 219 HA CYS 31 HA CYS 31 -9.715 -12.865 0.476 220 HB2 CYS 31 1HB CYS 31 -9.357 -13.713 -1.736 221 HB3 CYS 31 2HB CYS 31 -7.701 -14.183 -1.352 222 HG CYS 31 HG CYS 31 -10.213 -15.785 -0.652 223 H LYS 32 H LYS 32 -9.651 -13.514 2.475 224 HA LYS 32 HA LYS 32 -7.138 -14.601 3.592 225 HB2 LYS 32 1HB LYS 32 -7.901 -12.664 4.828 226 HB3 LYS 32 2HB LYS 32 -9.507 -13.349 4.987 227 HG2 LYS 32 1HG LYS 32 -8.269 -13.692 7.057 228 HG3 LYS 32 2HG LYS 32 -8.547 -15.248 6.296 229 HD2 LYS 32 1HD LYS 32 -6.313 -15.425 5.536 230 HD3 LYS 32 2HD LYS 32 -6.010 -13.700 5.761 231 HE2 LYS 32 1HE LYS 32 -4.930 -14.886 7.554 232 HE3 LYS 32 2HE LYS 32 -6.331 -14.056 8.226 233 HZ1 LYS 32 3HZ LYS 32 -7.228 -16.520 7.345 234 HZ2 LYS 32 1HZ LYS 32 -7.035 -16.014 8.952 235 HZ3 LYS 32 2HZ LYS 32 -5.771 -16.828 8.163 236 H GLY 33 H GLY 33 -7.104 -16.745 3.594 237 HA2 GLY 33 1HA GLY 33 -7.859 -18.902 3.527 238 HA3 GLY 33 2HA GLY 33 -8.623 -18.421 5.035 239 H ASP 34 H ASP 34 -9.373 -17.455 1.642 240 HA ASP 34 HA ASP 34 -11.174 -17.882 0.354 241 HB2 ASP 34 1HB ASP 34 -12.462 -19.579 2.472 242 HB3 ASP 34 2HB ASP 34 -12.541 -19.724 0.718 243 H SER 35 H SER 35 -10.918 -15.904 2.634 244 HA SER 35 HA SER 35 -13.786 -15.166 2.878 245 HB2 SER 35 1HB SER 35 -12.415 -15.650 5.011 246 HB3 SER 35 2HB SER 35 -11.561 -14.161 4.645 247 HG SER 35 HG SER 35 -13.485 -13.049 4.772 248 H ARG 36 H ARG 36 -14.341 -13.426 1.694 249 HA ARG 36 HA ARG 36 -12.216 -11.824 0.468 250 HB2 ARG 36 1HB ARG 36 -14.375 -12.809 -0.688 251 HB3 ARG 36 2HB ARG 36 -15.152 -11.375 -0.024 252 HG2 ARG 36 1HG ARG 36 -14.451 -10.556 -2.089 253 HG3 ARG 36 2HG ARG 36 -13.061 -10.126 -1.094 254 HD2 ARG 36 1HD ARG 36 -12.179 -11.181 -3.057 255 HD3 ARG 36 2HD ARG 36 -12.045 -12.371 -1.764 256 HE ARG 36 HE ARG 36 -14.524 -12.656 -3.149 257 HH11 ARG 36 1HH2 ARG 36 -11.117 -13.211 -3.371 258 HH12 ARG 36 2HH2 ARG 36 -11.267 -14.568 -4.436 259 HH21 ARG 36 1HH1 ARG 36 -14.731 -14.435 -4.544 260 HH22 ARG 36 2HH1 ARG 36 -13.315 -15.261 -5.101 261 H GLN 37 H GLN 37 -11.611 -9.919 1.133 262 HA GLN 37 HA GLN 37 -13.426 -8.280 2.799 263 HB2 GLN 37 1HB GLN 37 -10.515 -8.927 3.341 264 HB3 GLN 37 2HB GLN 37 -11.442 -7.694 4.198 265 HG2 GLN 37 1HG GLN 37 -12.955 -9.317 5.093 266 HG3 GLN 37 2HG GLN 37 -12.344 -10.576 4.026 267 HE21 GLN 37 2HE2 GLN 37 -10.332 -11.607 4.563 268 HE22 GLN 37 1HE2 GLN 37 -9.595 -11.386 6.064 269 H SER 38 H SER 38 -12.776 -6.042 2.881 270 HA SER 38 HA SER 38 -11.444 -5.162 0.371 271 HB2 SER 38 1HB SER 38 -12.923 -3.382 0.200 272 HB3 SER 38 2HB SER 38 -13.964 -4.624 0.889 273 HG SER 38 HG SER 38 -12.783 -3.490 2.915 274 H ARG 39 H ARG 39 -9.586 -4.216 0.559 275 HA ARG 39 HA ARG 39 -8.906 -2.747 3.043 276 HB2 ARG 39 1HB ARG 39 -7.268 -4.803 1.578 277 HB3 ARG 39 2HB ARG 39 -6.547 -3.646 2.695 278 HG2 ARG 39 1HG ARG 39 -8.077 -4.465 4.480 279 HG3 ARG 39 2HG ARG 39 -8.723 -5.657 3.353 280 HD2 ARG 39 1HD ARG 39 -6.501 -6.676 3.122 281 HD3 ARG 39 2HD ARG 39 -5.815 -5.463 4.200 282 HE ARG 39 HE ARG 39 -8.010 -6.955 5.357 283 HH11 ARG 39 1HH2 ARG 39 -4.586 -6.797 4.801 284 HH12 ARG 39 2HH2 ARG 39 -4.194 -7.852 6.119 285 HH21 ARG 39 1HH1 ARG 39 -7.489 -8.331 7.075 286 HH22 ARG 39 2HH1 ARG 39 -5.834 -8.717 7.402 287 H LEU 40 H LEU 40 -7.337 -1.138 2.800 288 HA LEU 40 HA LEU 40 -6.886 -0.196 0.023 289 HB2 LEU 40 1HB LEU 40 -8.741 1.003 1.276 290 HB3 LEU 40 2HB LEU 40 -7.506 1.619 2.370 291 HG LEU 40 HG LEU 40 -7.013 1.985 -0.577 292 HD11 LEU 40 1HD1 LEU 40 -9.284 2.667 -0.586 293 HD12 LEU 40 2HD1 LEU 40 -8.370 4.162 -0.394 294 HD13 LEU 40 3HD1 LEU 40 -9.150 3.418 1.001 295 HD21 LEU 40 3HD2 LEU 40 -5.401 2.791 1.137 296 HD22 LEU 40 1HD2 LEU 40 -6.672 3.795 1.831 297 HD23 LEU 40 2HD2 LEU 40 -6.078 4.119 0.204 298 H LEU 41 H LEU 41 -4.797 0.339 -0.441 299 HA LEU 41 HA LEU 41 -2.966 1.035 1.762 300 HB2 LEU 41 1HB LEU 41 -1.357 -0.660 0.340 301 HB3 LEU 41 2HB LEU 41 -2.256 -1.155 1.771 302 HG LEU 41 HG LEU 41 -4.136 -1.890 0.310 303 HD11 LEU 41 1HD1 LEU 41 -3.403 -2.172 -2.187 304 HD12 LEU 41 2HD1 LEU 41 -2.249 -0.887 -1.827 305 HD13 LEU 41 3HD1 LEU 41 -3.978 -0.594 -1.659 306 HD21 LEU 41 3HD2 LEU 41 -1.493 -3.099 -0.528 307 HD22 LEU 41 1HD2 LEU 41 -3.062 -3.902 -0.452 308 HD23 LEU 41 2HD2 LEU 41 -2.255 -3.399 1.034 309 H GLY 42 H GLY 42 -1.286 2.372 1.131 310 HA2 GLY 42 1HA GLY 42 -0.959 2.894 -1.745 311 HA3 GLY 42 2HA GLY 42 -1.322 4.247 -0.668 312 H LEU 43 H LEU 43 0.737 5.083 -1.460 313 HA LEU 43 HA LEU 43 3.016 4.035 0.114 314 HB2 LEU 43 1HB LEU 43 3.388 3.339 -2.183 315 HB3 LEU 43 2HB LEU 43 3.064 4.968 -2.769 316 HG LEU 43 HG LEU 43 5.036 5.815 -1.601 317 HD11 LEU 43 1HD1 LEU 43 6.601 3.917 -0.650 318 HD12 LEU 43 2HD1 LEU 43 5.094 3.014 -0.487 319 HD13 LEU 43 3HD1 LEU 43 5.300 4.549 0.350 320 HD21 LEU 43 3HD2 LEU 43 5.188 4.720 -3.888 321 HD22 LEU 43 1HD2 LEU 43 5.809 3.291 -3.065 322 HD23 LEU 43 2HD2 LEU 43 6.703 4.808 -2.989 323 H VAL 44 H VAL 44 4.136 5.560 1.208 324 HA VAL 44 HA VAL 44 3.614 8.414 0.586 325 HB VAL 44 HB VAL 44 3.594 7.247 3.359 326 HG11 VAL 44 1HG1 VAL 44 2.615 9.935 2.409 327 HG12 VAL 44 2HG1 VAL 44 4.269 9.692 2.962 328 HG13 VAL 44 3HG1 VAL 44 2.923 9.423 4.063 329 HG21 VAL 44 3HG2 VAL 44 1.151 7.629 3.283 330 HG22 VAL 44 1HG2 VAL 44 1.656 6.445 2.077 331 HG23 VAL 44 2HG2 VAL 44 1.291 8.099 1.589 332 H ARG 45 H ARG 45 5.258 9.744 0.794 333 HA ARG 45 HA ARG 45 7.831 8.672 1.827 334 HB2 ARG 45 1HB ARG 45 8.941 10.161 0.253 335 HB3 ARG 45 2HB ARG 45 7.825 9.108 -0.617 336 HG2 ARG 45 1HG ARG 45 6.122 10.928 -0.555 337 HG3 ARG 45 2HG ARG 45 7.316 11.986 0.196 338 HD2 ARG 45 1HD ARG 45 8.808 11.664 -1.751 339 HD3 ARG 45 2HD ARG 45 7.578 10.663 -2.514 340 HE ARG 45 HE ARG 45 6.588 13.261 -1.766 341 HH11 ARG 45 1HH2 ARG 45 8.327 11.419 -4.123 342 HH12 ARG 45 2HH2 ARG 45 7.977 12.502 -5.429 343 HH21 ARG 45 1HH1 ARG 45 6.124 14.685 -3.473 344 HH22 ARG 45 2HH1 ARG 45 6.730 14.351 -5.061 345 H TYR 46 H TYR 46 8.898 9.867 3.287 346 HA TYR 46 HA TYR 46 7.719 12.451 4.126 347 HB2 TYR 46 1HB TYR 46 7.119 10.700 5.709 348 HB3 TYR 46 2HB TYR 46 8.800 10.187 5.825 349 HD1 TYR 46 HD2 TYR 46 6.875 13.406 6.029 350 HD2 TYR 46 HD1 TYR 46 9.917 10.908 7.741 351 HE1 TYR 46 HE2 TYR 46 7.236 15.077 7.813 352 HE2 TYR 46 HE1 TYR 46 10.274 12.580 9.532 353 HH TYR 46 HH TYR 46 8.495 14.576 10.558 354 H ARG 47 H ARG 47 9.148 14.110 4.308 355 HA ARG 47 HA ARG 47 11.940 13.573 3.601 356 HB2 ARG 47 1HB ARG 47 10.709 15.371 2.433 357 HB3 ARG 47 2HB ARG 47 10.509 16.217 3.968 358 HG2 ARG 47 1HG ARG 47 12.952 16.393 4.214 359 HG3 ARG 47 2HG ARG 47 13.178 15.501 2.712 360 HD2 ARG 47 1HD ARG 47 11.885 17.300 1.528 361 HD3 ARG 47 2HD ARG 47 11.866 18.211 3.036 362 HE ARG 47 HE ARG 47 14.521 17.421 2.230 363 HH11 ARG 47 1HH2 ARG 47 11.970 19.729 1.829 364 HH12 ARG 47 2HH2 ARG 47 13.026 21.015 1.351 365 HH21 ARG 47 1HH1 ARG 47 15.907 19.103 1.607 366 HH22 ARG 47 2HH1 ARG 47 15.255 20.662 1.225 367 H LEU 48 H LEU 48 13.660 13.840 4.891 368 HA LEU 48 HA LEU 48 13.160 14.420 7.740 369 HB2 LEU 48 1HB LEU 48 15.523 13.155 6.334 370 HB3 LEU 48 2HB LEU 48 15.459 13.490 8.060 371 HG LEU 48 HG LEU 48 13.488 11.727 6.572 372 HD11 LEU 48 1HD1 LEU 48 15.295 10.308 6.577 373 HD12 LEU 48 2HD1 LEU 48 14.809 10.036 8.247 374 HD13 LEU 48 3HD1 LEU 48 16.111 11.163 7.886 375 HD21 LEU 48 3HD2 LEU 48 12.314 12.423 8.459 376 HD22 LEU 48 1HD2 LEU 48 13.769 12.632 9.431 377 HD23 LEU 48 2HD2 LEU 48 13.140 11.016 9.111 378 H GLU 49 H GLU 49 13.950 16.137 8.738 379 HA GLU 49 HA GLU 49 14.736 18.441 7.445 380 HB2 GLU 49 1HB GLU 49 15.388 17.498 10.246 381 HB3 GLU 49 2HB GLU 49 15.658 19.144 9.672 382 HG2 GLU 49 1HG GLU 49 13.273 19.389 9.167 383 HG3 GLU 49 2HG GLU 49 12.980 17.721 9.656 384 H ASN 50 H ASN 50 16.501 15.591 7.755 385 HA ASN 50 HA ASN 50 19.140 16.844 7.679 386 HB2 ASN 50 1HB ASN 50 18.247 13.954 7.564 387 HB3 ASN 50 2HB ASN 50 19.930 14.480 7.555 388 HD21 ASN 50 2HD2 ASN 50 17.773 13.212 9.635 389 HD22 ASN 50 1HD2 ASN 50 18.234 13.986 11.073 390 H ASP 51 H ASP 51 16.713 16.253 5.509 391 HA ASP 51 HA ASP 51 16.731 16.672 3.211 392 HB2 ASP 51 1HB ASP 51 19.242 17.445 3.659 393 HB3 ASP 51 2HB ASP 51 19.625 15.883 2.943 394 H ALA 52 H ALA 52 17.776 14.024 5.001 395 HA ALA 52 HA ALA 52 18.021 12.042 2.985 396 HB1 ALA 52 3HB ALA 52 18.111 10.500 4.765 397 HB2 ALA 52 1HB ALA 52 17.141 11.528 5.818 398 HB3 ALA 52 2HB ALA 52 18.802 11.976 5.438 399 H GLN 53 H GLN 53 16.572 10.625 2.174 400 HA GLN 53 HA GLN 53 13.706 11.245 2.568 401 HB2 GLN 53 1HB GLN 53 15.169 9.842 0.320 402 HB3 GLN 53 2HB GLN 53 13.421 10.065 0.396 403 HG2 GLN 53 1HG GLN 53 15.421 12.337 0.500 404 HG3 GLN 53 2HG GLN 53 14.602 11.813 -0.971 405 HE21 GLN 53 2HE2 GLN 53 14.402 14.294 1.024 406 HE22 GLN 53 1HE2 GLN 53 12.723 14.490 1.165 407 H GLU 54 H GLU 54 12.205 9.612 2.922 408 HA GLU 54 HA GLU 54 13.167 6.875 3.357 409 HB2 GLU 54 1HB GLU 54 11.821 8.583 5.457 410 HB3 GLU 54 2HB GLU 54 11.839 6.820 5.528 411 HG2 GLU 54 1HG GLU 54 14.277 6.799 5.528 412 HG3 GLU 54 2HG GLU 54 14.324 8.548 5.319 413 H HIS 55 H HIS 55 11.666 5.332 2.938 414 HA HIS 55 HA HIS 55 8.958 6.223 2.091 415 HB2 HIS 55 1HB HIS 55 10.756 4.155 0.805 416 HB3 HIS 55 2HB HIS 55 9.074 4.440 0.365 417 HD2 HIS 55 HD2 HIS 55 8.610 6.882 -1.049 418 HE1 HIS 55 HE1 HIS 55 12.693 7.848 -1.524 419 HE2 HIS 55 HE2 HIS 55 10.331 8.445 -2.239 420 H ALA 56 H ALA 56 7.262 4.766 2.446 421 HA ALA 56 HA ALA 56 7.741 2.210 3.710 422 HB1 ALA 56 3HB ALA 56 6.446 2.748 5.733 423 HB2 ALA 56 1HB ALA 56 6.315 4.427 5.210 424 HB3 ALA 56 2HB ALA 56 7.891 3.754 5.632 425 H LEU 57 H LEU 57 5.875 0.892 3.616 426 HA LEU 57 HA LEU 57 3.735 1.966 1.864 427 HB2 LEU 57 1HB LEU 57 5.130 -0.039 1.140 428 HB3 LEU 57 2HB LEU 57 4.344 -0.945 2.416 429 HG LEU 57 HG LEU 57 2.706 0.563 0.366 430 HD11 LEU 57 1HD1 LEU 57 2.564 -1.643 -0.874 431 HD12 LEU 57 2HD1 LEU 57 3.934 -2.190 0.094 432 HD13 LEU 57 3HD1 LEU 57 4.120 -0.818 -0.997 433 HD21 LEU 57 3HD2 LEU 57 2.223 -1.750 2.263 434 HD22 LEU 57 1HD2 LEU 57 1.166 -1.461 0.884 435 HD23 LEU 57 2HD2 LEU 57 1.333 -0.236 2.131 436 H PHE 58 H PHE 58 2.219 2.791 3.149 437 HA PHE 58 HA PHE 58 1.469 1.559 5.648 438 HB2 PHE 58 1HB PHE 58 0.491 3.976 4.130 439 HB3 PHE 58 2HB PHE 58 -0.235 3.443 5.646 440 HD1 PHE 58 HD2 PHE 58 1.155 3.362 7.723 441 HD2 PHE 58 HD1 PHE 58 2.608 5.094 4.080 442 HE1 PHE 58 HE2 PHE 58 2.951 4.510 8.995 443 HE2 PHE 58 HE1 PHE 58 4.408 6.248 5.345 444 HZ PHE 58 HZ PHE 58 4.579 5.954 7.803 445 H LEU 59 H LEU 59 -0.578 0.816 6.172 446 HA LEU 59 HA LEU 59 -2.256 -0.067 3.892 447 HB2 LEU 59 1HB LEU 59 -1.007 -1.924 5.149 448 HB3 LEU 59 2HB LEU 59 -2.029 -1.537 6.529 449 HG LEU 59 HG LEU 59 -3.399 -2.000 3.887 450 HD11 LEU 59 1HD1 LEU 59 -3.465 -4.461 4.396 451 HD12 LEU 59 2HD1 LEU 59 -2.192 -4.191 5.588 452 HD13 LEU 59 3HD1 LEU 59 -1.887 -3.865 3.881 453 HD21 LEU 59 3HD2 LEU 59 -4.035 -2.691 6.775 454 HD22 LEU 59 1HD2 LEU 59 -5.070 -3.080 5.403 455 HD23 LEU 59 2HD2 LEU 59 -4.760 -1.401 5.820 456 H TYR 60 H TYR 60 -4.199 0.725 3.921 457 HA TYR 60 HA TYR 60 -5.285 1.965 6.395 458 HB2 TYR 60 1HB TYR 60 -5.554 2.589 3.456 459 HB3 TYR 60 2HB TYR 60 -6.670 3.243 4.639 460 HD1 TYR 60 HD1 TYR 60 -3.146 3.213 3.494 461 HD2 TYR 60 HD2 TYR 60 -6.003 4.994 6.155 462 HE1 TYR 60 HE1 TYR 60 -1.557 5.048 3.979 463 HE2 TYR 60 HE2 TYR 60 -4.404 6.825 6.651 464 HH TYR 60 HH TYR 60 -1.125 6.802 5.286 465 H THR 61 H THR 61 -7.253 1.117 7.143 466 HA THR 61 HA THR 61 -8.482 -0.999 5.500 467 HB THR 61 HB THR 61 -8.175 -1.410 7.944 468 HG1 THR 61 HG1 THR 61 -9.814 -2.496 6.914 469 HG21 THR 61 3HG2 THR 61 -10.340 0.666 8.307 470 HG22 THR 61 1HG2 THR 61 -8.630 1.012 8.566 471 HG23 THR 61 2HG2 THR 61 -9.447 -0.192 9.564 472 H HIS 62 H HIS 62 -10.934 -0.934 5.400 473 HA HIS 62 HA HIS 62 -12.191 1.622 5.621 474 HB2 HIS 62 1HB HIS 62 -12.389 2.264 3.374 475 HB3 HIS 62 2HB HIS 62 -10.721 1.715 3.480 476 HD2 HIS 62 HD2 HIS 62 -10.249 -0.850 2.266 477 HE1 HIS 62 HE1 HIS 62 -13.953 -0.974 0.254 478 HE2 HIS 62 HE2 HIS 62 -11.663 -2.062 0.432 479 H ARG 63 H ARG 63 -14.435 1.517 5.220 480 HA ARG 63 HA ARG 63 -15.557 -1.056 5.745 481 HB2 ARG 63 1HB ARG 63 -17.046 1.470 4.980 482 HB3 ARG 63 2HB ARG 63 -17.696 0.058 5.807 483 HG2 ARG 63 1HG ARG 63 -16.122 0.452 7.683 484 HG3 ARG 63 2HG ARG 63 -15.559 1.912 6.872 485 HD2 ARG 63 1HD ARG 63 -17.836 2.856 6.969 486 HD3 ARG 63 2HD ARG 63 -18.410 1.399 7.771 487 HE ARG 63 HE ARG 63 -16.269 2.411 9.268 488 HH11 ARG 63 1HH2 ARG 63 -19.454 3.333 8.297 489 HH12 ARG 63 2HH2 ARG 63 -19.747 4.304 9.700 490 HH21 ARG 63 1HH1 ARG 63 -16.626 3.709 11.089 491 HH22 ARG 63 2HH1 ARG 63 -18.147 4.518 11.284 492 H ARG 64 H ARG 64 -17.934 -0.857 4.246 493 HA ARG 64 HA ARG 64 -17.155 -2.216 1.879 494 HB2 ARG 64 1HB ARG 64 -19.808 -1.092 2.800 495 HB3 ARG 64 2HB ARG 64 -19.608 -2.060 1.338 496 HG2 ARG 64 1HG ARG 64 -18.708 -3.917 2.663 497 HG3 ARG 64 2HG ARG 64 -18.847 -2.950 4.132 498 HD2 ARG 64 1HD ARG 64 -21.283 -2.811 3.828 499 HD3 ARG 64 2HD ARG 64 -21.162 -3.742 2.338 500 HE ARG 64 HE ARG 64 -20.037 -5.098 4.628 501 HH11 ARG 64 1HH2 ARG 64 -22.902 -4.370 2.823 502 HH12 ARG 64 2HH2 ARG 64 -23.756 -5.783 3.346 503 HH21 ARG 64 1HH1 ARG 64 -21.156 -6.953 5.316 504 HH22 ARG 64 2HH1 ARG 64 -22.769 -7.244 4.756 505 H MET 65 H MET 65 -18.179 1.119 2.571 506 HA MET 65 HA MET 65 -17.332 1.881 -0.154 507 HB2 MET 65 1HB MET 65 -19.326 3.254 -0.437 508 HB3 MET 65 2HB MET 65 -19.807 1.581 -0.144 509 HG2 MET 65 1HG MET 65 -20.051 2.178 2.302 510 HG3 MET 65 2HG MET 65 -19.804 3.864 1.851 511 HE1 MET 65 3HE MET 65 -23.432 1.194 1.185 512 HE2 MET 65 1HE MET 65 -22.067 0.989 2.290 513 HE3 MET 65 2HE MET 65 -21.862 0.696 0.565 514 H ALA 66 H ALA 66 -16.200 2.141 2.605 515 HA ALA 66 HA ALA 66 -16.503 4.887 3.398 516 HB1 ALA 66 3HB ALA 66 -14.526 2.747 4.110 517 HB2 ALA 66 1HB ALA 66 -15.809 3.419 5.106 518 HB3 ALA 66 2HB ALA 66 -14.385 4.386 4.737 519 H ILE 67 H ILE 67 -14.038 3.084 1.660 520 HA ILE 67 HA ILE 67 -11.900 4.186 0.984 521 HB ILE 67 HB ILE 67 -12.217 4.077 -1.423 522 HG12 ILE 67 1HG1 ILE 67 -15.143 4.383 -0.694 523 HG13 ILE 67 2HG1 ILE 67 -14.178 5.409 -1.754 524 HG21 ILE 67 1HG2 ILE 67 -13.066 1.854 -1.600 525 HG22 ILE 67 2HG2 ILE 67 -14.140 2.074 -0.220 526 HG23 ILE 67 3HG2 ILE 67 -12.397 1.967 0.028 527 HD11 ILE 67 3HD1 ILE 67 -15.462 4.099 -3.233 528 HD12 ILE 67 1HD1 ILE 67 -15.208 2.631 -2.293 529 HD13 ILE 67 2HD1 ILE 67 -13.879 3.323 -3.223 530 H THR 68 H THR 68 -14.814 5.924 0.194 531 HA THR 68 HA THR 68 -14.111 8.178 -0.987 532 HB THR 68 HB THR 68 -15.972 9.297 0.046 533 HG1 THR 68 HG1 THR 68 -15.844 9.012 2.159 534 HG21 THR 68 3HG2 THR 68 -17.674 7.699 -0.406 535 HG22 THR 68 1HG2 THR 68 -16.639 6.354 0.071 536 HG23 THR 68 2HG2 THR 68 -16.314 7.225 -1.426 537 H GLY 69 H GLY 69 -12.745 7.375 2.107 538 HA2 GLY 69 1HA GLY 69 -10.894 8.682 2.935 539 HA3 GLY 69 2HA GLY 69 -11.673 10.133 2.296 540 H ASP 70 H ASP 70 -14.307 9.015 3.175 541 HA ASP 70 HA ASP 70 -14.653 10.466 5.494 542 HB2 ASP 70 1HB ASP 70 -16.497 9.756 4.052 543 HB3 ASP 70 2HB ASP 70 -16.255 8.079 4.537 544 H ASP 71 H ASP 71 -14.849 6.924 5.468 545 HA ASP 71 HA ASP 71 -13.855 6.975 8.253 546 HB2 ASP 71 1HB ASP 71 -16.148 6.481 7.942 547 HB3 ASP 71 2HB ASP 71 -15.757 5.202 6.752 548 H VAL 72 H VAL 72 -11.722 6.893 6.876 549 HA VAL 72 HA VAL 72 -10.735 4.147 7.038 550 HB VAL 72 HB VAL 72 -11.222 4.134 4.724 551 HG11 VAL 72 1HG1 VAL 72 -10.494 6.131 3.272 552 HG12 VAL 72 2HG1 VAL 72 -10.336 7.022 4.785 553 HG13 VAL 72 3HG1 VAL 72 -11.901 6.368 4.307 554 HG21 VAL 72 3HG2 VAL 72 -8.457 5.291 4.461 555 HG22 VAL 72 1HG2 VAL 72 -9.112 3.791 3.799 556 HG23 VAL 72 2HG2 VAL 72 -8.661 3.885 5.498 557 H SER 73 H SER 73 -8.837 4.159 8.132 558 HA SER 73 HA SER 73 -6.940 6.350 7.784 559 HB2 SER 73 1HB SER 73 -8.111 5.586 10.478 560 HB3 SER 73 2HB SER 73 -6.775 6.704 10.222 561 HG SER 73 HG SER 73 -8.149 8.111 9.235 562 H LEU 74 H LEU 74 -4.894 5.723 9.115 563 HA LEU 74 HA LEU 74 -3.839 3.409 8.206 564 HB2 LEU 74 1HB LEU 74 -3.206 4.910 10.732 565 HB3 LEU 74 2HB LEU 74 -2.232 3.545 10.189 566 HG LEU 74 HG LEU 74 -2.872 5.917 8.417 567 HD11 LEU 74 1HD1 LEU 74 -1.648 6.931 10.145 568 HD12 LEU 74 2HD1 LEU 74 -0.395 6.497 8.983 569 HD13 LEU 74 3HD1 LEU 74 -0.651 5.501 10.416 570 HD21 LEU 74 3HD2 LEU 74 -2.111 4.222 6.993 571 HD22 LEU 74 1HD2 LEU 74 -1.091 3.491 8.225 572 HD23 LEU 74 2HD2 LEU 74 -0.585 4.975 7.426 573 H ASP 75 H ASP 75 -3.978 1.351 8.459 574 HA ASP 75 HA ASP 75 -5.289 0.212 10.864 575 HB2 ASP 75 1HB ASP 75 -6.447 -0.078 8.640 576 HB3 ASP 75 2HB ASP 75 -5.065 -1.042 8.126 577 H GLN 76 H GLN 76 -2.377 0.278 8.913 578 HA GLN 76 HA GLN 76 -1.020 -1.333 10.838 579 HB2 GLN 76 1HB GLN 76 -2.226 -2.903 8.975 580 HB3 GLN 76 2HB GLN 76 -0.710 -2.574 8.139 581 HG2 GLN 76 1HG GLN 76 0.498 -3.257 10.265 582 HG3 GLN 76 2HG GLN 76 -1.055 -3.789 10.892 583 HE21 GLN 76 2HE2 GLN 76 1.646 -5.025 9.535 584 HE22 GLN 76 1HE2 GLN 76 0.984 -6.339 8.690 585 H ILE 77 H ILE 77 1.223 -2.047 9.319 586 HA ILE 77 HA ILE 77 2.165 0.226 7.806 587 HB ILE 77 HB ILE 77 3.390 -0.396 10.520 588 HG12 ILE 77 1HG1 ILE 77 1.844 1.981 9.448 589 HG13 ILE 77 2HG1 ILE 77 1.401 0.940 10.799 590 HG21 ILE 77 1HG2 ILE 77 5.024 1.314 10.035 591 HG22 ILE 77 2HG2 ILE 77 4.204 1.756 8.539 592 HG23 ILE 77 3HG2 ILE 77 5.032 0.212 8.668 593 HD11 ILE 77 3HD1 ILE 77 3.583 3.001 10.679 594 HD12 ILE 77 1HD1 ILE 77 3.617 1.701 11.873 595 HD13 ILE 77 2HD1 ILE 77 2.272 2.844 11.849 596 H VAL 78 H VAL 78 3.432 -0.559 6.276 597 HA VAL 78 HA VAL 78 4.967 -3.059 6.766 598 HB VAL 78 HB VAL 78 3.639 -2.225 4.183 599 HG11 VAL 78 1HG1 VAL 78 4.270 -4.627 3.591 600 HG12 VAL 78 2HG1 VAL 78 5.296 -4.611 5.025 601 HG13 VAL 78 3HG1 VAL 78 5.611 -3.489 3.702 602 HG21 VAL 78 3HG2 VAL 78 1.902 -2.925 5.651 603 HG22 VAL 78 1HG2 VAL 78 2.893 -4.220 6.323 604 HG23 VAL 78 2HG2 VAL 78 2.284 -4.343 4.673 605 HA PRO 79 HA PRO 79 7.803 0.280 5.403 606 HB2 PRO 79 1HB PRO 79 9.840 -0.193 7.115 607 HB3 PRO 79 2HB PRO 79 8.359 0.640 7.620 608 HG2 PRO 79 1HG PRO 79 9.193 -2.176 8.101 609 HG3 PRO 79 2HG PRO 79 8.316 -1.063 9.165 610 HD2 PRO 79 1HD PRO 79 7.132 -3.069 7.593 611 HD3 PRO 79 2HD PRO 79 6.271 -1.690 8.304 612 H LEU 80 H LEU 80 9.219 0.150 3.755 613 HA LEU 80 HA LEU 80 9.923 -2.302 2.614 614 HB2 LEU 80 1HB LEU 80 11.168 0.423 2.206 615 HB3 LEU 80 2HB LEU 80 11.266 -0.944 1.094 616 HG LEU 80 HG LEU 80 8.693 0.413 1.960 617 HD11 LEU 80 1HD1 LEU 80 10.337 1.717 0.448 618 HD12 LEU 80 2HD1 LEU 80 8.678 1.539 -0.122 619 HD13 LEU 80 3HD1 LEU 80 9.951 0.514 -0.783 620 HD21 LEU 80 3HD2 LEU 80 8.060 -1.768 1.360 621 HD22 LEU 80 1HD2 LEU 80 9.344 -1.920 0.160 622 HD23 LEU 80 2HD2 LEU 80 7.927 -0.927 -0.181 623 H SER 81 H SER 81 11.413 -3.641 3.044 624 HA SER 81 HA SER 81 13.950 -2.817 4.329 625 HB2 SER 81 1HB SER 81 12.597 -3.700 6.135 626 HB3 SER 81 2HB SER 81 12.171 -5.117 5.180 627 HG SER 81 HG SER 81 14.225 -4.826 6.778 628 H LYS 82 H LYS 82 15.586 -4.623 4.186 629 HA LYS 82 HA LYS 82 16.039 -5.291 1.535 630 HB2 LYS 82 1HB LYS 82 17.767 -5.278 3.309 631 HB3 LYS 82 2HB LYS 82 17.076 -6.762 3.967 632 HG2 LYS 82 1HG LYS 82 17.513 -7.928 1.849 633 HG3 LYS 82 2HG LYS 82 18.156 -6.443 1.150 634 HD2 LYS 82 1HD LYS 82 19.929 -6.402 2.866 635 HD3 LYS 82 2HD LYS 82 19.291 -7.892 3.561 636 HE2 LYS 82 1HE LYS 82 21.036 -8.640 2.159 637 HE3 LYS 82 2HE LYS 82 19.591 -8.886 1.182 638 HZ1 LYS 82 3HZ LYS 82 21.803 -7.122 0.750 639 HZ2 LYS 82 1HZ LYS 82 20.314 -6.314 0.657 640 HZ3 LYS 82 2HZ LYS 82 20.615 -7.657 -0.341 641 H ASP 83 H ASP 83 14.601 -7.299 4.111 642 HA ASP 83 HA ASP 83 14.340 -9.652 2.586 643 HB2 ASP 83 1HB ASP 83 12.818 -8.575 4.960 644 HB3 ASP 83 2HB ASP 83 12.522 -10.177 4.283 645 H PHE 84 H PHE 84 12.778 -6.661 2.299 646 HA PHE 84 HA PHE 84 10.193 -7.439 1.401 647 HB2 PHE 84 1HB PHE 84 11.017 -5.086 2.075 648 HB3 PHE 84 2HB PHE 84 11.679 -4.987 0.446 649 HD1 PHE 84 HD1 PHE 84 10.127 -5.216 -1.540 650 HD2 PHE 84 HD2 PHE 84 8.684 -4.806 2.487 651 HE1 PHE 84 HE1 PHE 84 7.896 -4.558 -2.404 652 HE2 PHE 84 HE2 PHE 84 6.453 -4.154 1.620 653 HZ PHE 84 HZ PHE 84 6.061 -4.030 -0.824 654 H MET 85 H MET 85 9.484 -8.007 -0.595 655 HA MET 85 HA MET 85 10.988 -7.664 -2.986 656 HB2 MET 85 1HB MET 85 12.287 -9.551 -2.015 657 HB3 MET 85 2HB MET 85 10.810 -10.511 -1.959 658 HG2 MET 85 1HG MET 85 12.060 -11.082 -3.979 659 HG3 MET 85 2HG MET 85 10.587 -10.237 -4.440 660 HE1 MET 85 3HE MET 85 11.961 -10.133 -6.762 661 HE2 MET 85 1HE MET 85 12.328 -8.447 -7.148 662 HE3 MET 85 2HE MET 85 10.776 -8.872 -6.431 663 H LEU 86 H LEU 86 9.446 -7.337 -4.465 664 HA LEU 86 HA LEU 86 6.745 -8.321 -4.009 665 HB2 LEU 86 1HB LEU 86 6.464 -7.164 -6.359 666 HB3 LEU 86 2HB LEU 86 6.689 -6.170 -4.922 667 HG LEU 86 HG LEU 86 9.179 -7.069 -6.339 668 HD11 LEU 86 1HD1 LEU 86 9.010 -5.134 -7.912 669 HD12 LEU 86 2HD1 LEU 86 7.329 -4.925 -7.422 670 HD13 LEU 86 3HD1 LEU 86 7.831 -6.402 -8.243 671 HD21 LEU 86 3HD2 LEU 86 10.062 -5.043 -5.495 672 HD22 LEU 86 1HD2 LEU 86 8.969 -5.581 -4.221 673 HD23 LEU 86 2HD2 LEU 86 8.466 -4.308 -5.331 674 H GLU 87 H GLU 87 5.973 -10.213 -4.833 675 HA GLU 87 HA GLU 87 7.475 -11.473 -7.070 676 HB2 GLU 87 1HB GLU 87 6.136 -12.785 -4.693 677 HB3 GLU 87 2HB GLU 87 6.804 -13.649 -6.073 678 HG2 GLU 87 1HG GLU 87 9.026 -12.702 -5.613 679 HG3 GLU 87 2HG GLU 87 8.367 -11.803 -4.246 680 H GLU 88 H GLU 88 6.322 -11.742 -8.836 681 HA GLU 88 HA GLU 88 3.488 -11.269 -8.904 682 HB2 GLU 88 1HB GLU 88 5.006 -10.633 -10.774 683 HB3 GLU 88 2HB GLU 88 5.332 -12.342 -11.062 684 HG2 GLU 88 1HG GLU 88 2.965 -12.741 -11.507 685 HG3 GLU 88 2HG GLU 88 2.598 -11.055 -11.163 686 H VAL 89 H VAL 89 1.893 -12.848 -9.572 687 HA VAL 89 HA VAL 89 2.497 -15.540 -8.549 688 HB VAL 89 HB VAL 89 -0.133 -14.514 -9.584 689 HG11 VAL 89 1HG1 VAL 89 0.262 -17.007 -9.286 690 HG12 VAL 89 2HG1 VAL 89 -1.083 -16.339 -8.364 691 HG13 VAL 89 3HG1 VAL 89 0.448 -16.682 -7.563 692 HG21 VAL 89 3HG2 VAL 89 0.971 -14.464 -6.760 693 HG22 VAL 89 1HG2 VAL 89 -0.676 -14.032 -7.215 694 HG23 VAL 89 2HG2 VAL 89 0.679 -13.047 -7.770 695 H SER 90 H SER 90 2.625 -17.310 -9.775 696 HA SER 90 HA SER 90 3.488 -17.439 -12.302 697 HB2 SER 90 1HB SER 90 1.639 -19.350 -10.895 698 HB3 SER 90 2HB SER 90 2.307 -19.700 -12.487 699 HG SER 90 HG SER 90 4.334 -19.669 -11.638 700 HA PRO 91 HA PRO 91 0.022 -15.863 -14.699 701 HB2 PRO 91 1HB PRO 91 1.009 -16.270 -17.222 702 HB3 PRO 91 2HB PRO 91 1.574 -14.964 -16.160 703 HG2 PRO 91 1HG PRO 91 2.839 -17.595 -16.760 704 HG3 PRO 91 2HG PRO 91 3.590 -16.006 -16.547 705 HD2 PRO 91 1HD PRO 91 3.545 -17.945 -14.580 706 HD3 PRO 91 2HD PRO 91 3.661 -16.202 -14.246 707 H ASP 92 H ASP 92 1.391 -18.572 -16.570 708 HA ASP 92 HA ASP 92 0.421 -20.422 -17.508 709 HB2 ASP 92 1HB ASP 92 -1.176 -20.227 -14.950 710 HB3 ASP 92 2HB ASP 92 -1.388 -21.537 -16.107 711 H GLY 93 H GLY 93 -0.430 -17.842 -18.355 712 HA2 GLY 93 1HA GLY 93 -3.322 -18.152 -18.888 713 HA3 GLY 93 2HA GLY 93 -2.389 -16.676 -19.078 714 H GLU 94 H GLU 94 -4.058 -18.677 -20.848 715 HA GLU 94 HA GLU 94 -2.422 -19.678 -22.870 716 HB2 GLU 94 1HB GLU 94 -4.420 -19.750 -24.247 717 HB3 GLU 94 2HB GLU 94 -4.832 -20.206 -22.595 718 HG2 GLU 94 1HG GLU 94 -5.562 -17.849 -22.176 719 HG3 GLU 94 2HG GLU 94 -5.275 -17.497 -23.880 720 H LEU 95 H LEU 95 -3.778 -16.418 -22.464 721 HA LEU 95 HA LEU 95 -1.877 -15.444 -24.486 722 HB2 LEU 95 1HB LEU 95 -3.996 -15.738 -25.697 723 HB3 LEU 95 2HB LEU 95 -4.839 -14.795 -24.472 724 HG LEU 95 HG LEU 95 -3.512 -12.808 -25.042 725 HD11 LEU 95 1HD1 LEU 95 -1.396 -13.551 -25.723 726 HD12 LEU 95 2HD1 LEU 95 -2.116 -13.072 -27.256 727 HD13 LEU 95 3HD1 LEU 95 -2.059 -14.776 -26.803 728 HD21 LEU 95 3HD2 LEU 95 -4.527 -12.338 -27.149 729 HD22 LEU 95 1HD2 LEU 95 -5.603 -13.482 -26.350 730 HD23 LEU 95 2HD2 LEU 95 -4.511 -14.037 -27.619 731 H TYR 96 H TYR 96 -4.210 -14.729 -21.971 732 HA TYR 96 HA TYR 96 -2.460 -12.543 -21.004 733 HB2 TYR 96 1HB TYR 96 -4.028 -10.865 -21.156 734 HB3 TYR 96 2HB TYR 96 -4.580 -11.854 -22.503 735 HD1 TYR 96 HD1 TYR 96 -5.149 -11.068 -18.918 736 HD2 TYR 96 HD2 TYR 96 -6.691 -12.974 -22.443 737 HE1 TYR 96 HE1 TYR 96 -7.330 -11.368 -17.786 738 HE2 TYR 96 HE2 TYR 96 -8.882 -13.272 -21.322 739 HH TYR 96 HH TYR 96 -9.649 -11.726 -18.337 740 H ILE 97 H ILE 97 -2.910 -11.847 -18.836 741 HA ILE 97 HA ILE 97 -4.270 -13.879 -17.151 742 HB ILE 97 HB ILE 97 -1.820 -12.461 -16.140 743 HG12 ILE 97 1HG1 ILE 97 -0.599 -14.626 -17.077 744 HG13 ILE 97 2HG1 ILE 97 -1.867 -14.565 -18.289 745 HG21 ILE 97 1HG2 ILE 97 -3.446 -14.157 -14.901 746 HG22 ILE 97 2HG2 ILE 97 -1.705 -14.227 -14.633 747 HG23 ILE 97 3HG2 ILE 97 -2.471 -15.368 -15.737 748 HD11 ILE 97 3HD1 ILE 97 0.394 -12.683 -17.805 749 HD12 ILE 97 1HD1 ILE 97 -1.124 -11.972 -18.354 750 HD13 ILE 97 2HD1 ILE 97 -0.323 -13.205 -19.328 751 H LEU 98 H LEU 98 -2.762 -10.656 -17.017 752 HA LEU 98 HA LEU 98 -4.242 -9.723 -14.803 753 HB2 LEU 98 1HB LEU 98 -2.773 -8.305 -17.030 754 HB3 LEU 98 2HB LEU 98 -3.617 -7.412 -15.768 755 HG LEU 98 HG LEU 98 -2.235 -8.383 -14.055 756 HD11 LEU 98 1HD1 LEU 98 -1.233 -10.157 -16.273 757 HD12 LEU 98 2HD1 LEU 98 -1.972 -10.634 -14.742 758 HD13 LEU 98 3HD1 LEU 98 -0.348 -9.949 -14.762 759 HD21 LEU 98 3HD2 LEU 98 0.058 -7.697 -14.866 760 HD22 LEU 98 1HD2 LEU 98 -1.202 -6.493 -15.138 761 HD23 LEU 98 2HD2 LEU 98 -0.644 -7.503 -16.471 762 H GLY 99 H GLY 99 -4.606 -8.697 -18.202 763 HA2 GLY 99 1HA GLY 99 -6.443 -8.019 -19.402 764 HA3 GLY 99 2HA GLY 99 -7.386 -9.108 -18.387 765 H SER 100 H SER 100 -8.654 -8.286 -16.807 766 HA SER 100 HA SER 100 -8.592 -5.351 -16.373 767 HB2 SER 100 1HB SER 100 -10.884 -7.303 -16.513 768 HB3 SER 100 2HB SER 100 -11.048 -5.733 -15.732 769 HG SER 100 HG SER 100 -9.804 -5.407 -18.065 770 H ASP 101 H ASP 101 -6.913 -7.000 -14.972 771 HA ASP 101 HA ASP 101 -7.561 -6.383 -12.260 772 HB2 ASP 101 1HB ASP 101 -7.754 -9.253 -13.178 773 HB3 ASP 101 2HB ASP 101 -7.304 -8.855 -11.523 774 H VAL 102 H VAL 102 -5.729 -6.752 -10.858 775 HA VAL 102 HA VAL 102 -3.223 -7.481 -12.262 776 HB VAL 102 HB VAL 102 -3.722 -5.168 -10.392 777 HG11 VAL 102 1HG1 VAL 102 -1.185 -4.805 -10.800 778 HG12 VAL 102 2HG1 VAL 102 -1.153 -6.514 -11.235 779 HG13 VAL 102 3HG1 VAL 102 -1.658 -6.026 -9.618 780 HG21 VAL 102 3HG2 VAL 102 -3.210 -3.810 -12.230 781 HG22 VAL 102 1HG2 VAL 102 -4.089 -5.133 -12.996 782 HG23 VAL 102 2HG2 VAL 102 -2.327 -5.089 -13.063 783 H THR 103 H THR 103 -1.996 -8.924 -11.269 784 HA THR 103 HA THR 103 -2.737 -9.695 -8.487 785 HB THR 103 HB THR 103 -1.301 -11.472 -10.460 786 HG1 THR 103 HG1 THR 103 -3.741 -12.259 -10.308 787 HG21 THR 103 3HG2 THR 103 -1.368 -11.927 -7.947 788 HG22 THR 103 1HG2 THR 103 -1.982 -13.217 -8.979 789 HG23 THR 103 2HG2 THR 103 -3.106 -12.156 -8.133 790 H VAL 104 H VAL 104 -1.356 -8.998 -7.060 791 HA VAL 104 HA VAL 104 1.543 -9.205 -7.571 792 HB VAL 104 HB VAL 104 0.595 -6.820 -7.802 793 HG11 VAL 104 1HG1 VAL 104 0.504 -6.946 -4.784 794 HG12 VAL 104 2HG1 VAL 104 -0.939 -7.163 -5.774 795 HG13 VAL 104 3HG1 VAL 104 -0.045 -5.644 -5.839 796 HG21 VAL 104 3HG2 VAL 104 2.972 -7.216 -7.461 797 HG22 VAL 104 1HG2 VAL 104 2.718 -7.475 -5.734 798 HG23 VAL 104 2HG2 VAL 104 2.476 -5.873 -6.430 799 H GLN 105 H GLN 105 2.660 -10.081 -5.902 800 HA GLN 105 HA GLN 105 1.221 -10.532 -3.340 801 HB2 GLN 105 1HB GLN 105 1.593 -12.541 -4.950 802 HB3 GLN 105 2HB GLN 105 3.281 -12.429 -4.457 803 HG2 GLN 105 1HG GLN 105 0.948 -12.702 -2.540 804 HG3 GLN 105 2HG GLN 105 1.975 -14.036 -3.062 805 HE21 GLN 105 2HE2 GLN 105 1.615 -11.658 -0.681 806 HE22 GLN 105 1HE2 GLN 105 3.189 -11.707 -0.046 807 H LEU 106 H LEU 106 2.185 -9.467 -1.711 808 HA LEU 106 HA LEU 106 4.966 -8.627 -1.953 809 HB2 LEU 106 1HB LEU 106 4.493 -7.274 -0.006 810 HB3 LEU 106 2HB LEU 106 3.172 -7.100 -1.160 811 HG LEU 106 HG LEU 106 2.266 -9.249 0.304 812 HD11 LEU 106 1HD1 LEU 106 3.330 -7.453 2.467 813 HD12 LEU 106 2HD1 LEU 106 4.370 -8.716 1.836 814 HD13 LEU 106 3HD1 LEU 106 2.824 -9.137 2.562 815 HD21 LEU 106 3HD2 LEU 106 1.834 -6.286 0.608 816 HD22 LEU 106 1HD2 LEU 106 0.986 -7.427 1.653 817 HD23 LEU 106 2HD2 LEU 106 0.771 -7.503 -0.096 818 H ASN 107 H ASN 107 6.553 -9.713 -1.151 819 HA ASN 107 HA ASN 107 6.049 -11.799 0.925 820 HB2 ASN 107 1HB ASN 107 8.499 -11.638 -0.796 821 HB3 ASN 107 2HB ASN 107 7.860 -13.018 0.098 822 HD21 ASN 107 2HD2 ASN 107 6.499 -10.684 -2.284 823 HD22 ASN 107 1HD2 ASN 107 5.779 -11.874 -3.252 824 H THR 108 H THR 108 6.146 -9.747 2.426 825 HA THR 108 HA THR 108 8.781 -8.761 2.970 826 HB THR 108 HB THR 108 6.595 -8.668 5.027 827 HG1 THR 108 HG1 THR 108 5.940 -8.243 2.667 828 HG21 THR 108 3HG2 THR 108 8.662 -6.702 3.998 829 HG22 THR 108 1HG2 THR 108 8.655 -7.520 5.560 830 HG23 THR 108 2HG2 THR 108 7.434 -6.304 5.197 831 H ALA 109 H ALA 109 9.640 -8.976 5.254 832 HA ALA 109 HA ALA 109 10.460 -11.607 5.694 833 HB1 ALA 109 3HB ALA 109 11.131 -10.610 8.019 834 HB2 ALA 109 1HB ALA 109 10.576 -9.088 7.320 835 HB3 ALA 109 2HB ALA 109 11.890 -9.983 6.560 836 H GLU 110 H GLU 110 7.834 -9.768 7.239 837 HA GLU 110 HA GLU 110 6.884 -12.301 8.464 838 HB2 GLU 110 1HB GLU 110 6.298 -11.139 10.483 839 HB3 GLU 110 2HB GLU 110 7.984 -10.758 10.135 840 HG2 GLU 110 1HG GLU 110 7.180 -8.656 8.982 841 HG3 GLU 110 2HG GLU 110 5.563 -9.007 9.590 842 H LEU 111 H LEU 111 6.200 -10.758 6.000 843 HA LEU 111 HA LEU 111 3.306 -10.638 6.489 844 HB2 LEU 111 1HB LEU 111 4.749 -8.296 6.399 845 HB3 LEU 111 2HB LEU 111 4.320 -8.489 4.704 846 HG LEU 111 HG LEU 111 1.903 -8.939 5.630 847 HD11 LEU 111 1HD1 LEU 111 1.376 -8.004 7.754 848 HD12 LEU 111 2HD1 LEU 111 2.952 -7.228 7.891 849 HD13 LEU 111 3HD1 LEU 111 2.818 -8.979 8.035 850 HD21 LEU 111 3HD2 LEU 111 3.359 -6.327 5.313 851 HD22 LEU 111 1HD2 LEU 111 1.696 -6.287 5.900 852 HD23 LEU 111 2HD2 LEU 111 2.059 -7.012 4.341 853 H LYS 112 H LYS 112 2.204 -11.567 4.965 854 HA LYS 112 HA LYS 112 3.205 -11.795 2.241 855 HB2 LYS 112 1HB LYS 112 4.212 -13.745 3.503 856 HB3 LYS 112 2HB LYS 112 2.566 -14.336 3.736 857 HG2 LYS 112 1HG LYS 112 2.211 -14.423 1.323 858 HG3 LYS 112 2HG LYS 112 3.803 -13.716 1.037 859 HD2 LYS 112 1HD LYS 112 4.859 -15.664 2.128 860 HD3 LYS 112 2HD LYS 112 3.266 -16.375 2.390 861 HE2 LYS 112 1HE LYS 112 2.876 -16.426 -0.039 862 HE3 LYS 112 2HE LYS 112 4.456 -15.692 -0.315 863 HZ1 LYS 112 3HZ LYS 112 5.477 -17.597 0.787 864 HZ2 LYS 112 1HZ LYS 112 4.576 -18.077 -0.567 865 HZ3 LYS 112 2HZ LYS 112 3.948 -18.309 0.995 866 H LEU 113 H LEU 113 1.513 -10.910 1.323 867 HA LEU 113 HA LEU 113 -1.140 -12.189 1.719 868 HB2 LEU 113 1HB LEU 113 -0.534 -9.229 1.714 869 HB3 LEU 113 2HB LEU 113 -2.158 -9.881 1.561 870 HG LEU 113 HG LEU 113 -0.278 -10.365 3.870 871 HD11 LEU 113 1HD1 LEU 113 -1.859 -8.956 5.172 872 HD12 LEU 113 2HD1 LEU 113 -2.717 -8.590 3.676 873 HD13 LEU 113 3HD1 LEU 113 -1.050 -8.060 3.888 874 HD21 LEU 113 3HD2 LEU 113 -2.671 -11.097 4.859 875 HD22 LEU 113 1HD2 LEU 113 -1.627 -12.231 4.014 876 HD23 LEU 113 2HD2 LEU 113 -2.959 -11.468 3.164 877 H VAL 114 H VAL 114 -2.691 -11.516 -0.005 878 HA VAL 114 HA VAL 114 -1.352 -11.120 -2.636 879 HB VAL 114 HB VAL 114 -3.555 -13.077 -1.919 880 HG11 VAL 114 1HG1 VAL 114 -4.219 -12.146 -4.010 881 HG12 VAL 114 2HG1 VAL 114 -3.380 -13.644 -4.414 882 HG13 VAL 114 3HG1 VAL 114 -2.558 -12.096 -4.600 883 HG21 VAL 114 3HG2 VAL 114 -1.011 -13.607 -1.613 884 HG22 VAL 114 1HG2 VAL 114 -0.982 -13.680 -3.376 885 HG23 VAL 114 2HG2 VAL 114 -2.021 -14.773 -2.465 886 H PHE 115 H PHE 115 -2.057 -9.263 -3.483 887 HA PHE 115 HA PHE 115 -4.828 -8.361 -2.915 888 HB2 PHE 115 1HB PHE 115 -2.313 -6.787 -3.494 889 HB3 PHE 115 2HB PHE 115 -3.927 -6.080 -3.534 890 HD1 PHE 115 HD2 PHE 115 -5.292 -5.907 -1.472 891 HD2 PHE 115 HD1 PHE 115 -1.279 -7.440 -1.405 892 HE1 PHE 115 HE2 PHE 115 -5.234 -5.673 0.993 893 HE2 PHE 115 HE1 PHE 115 -1.232 -7.178 1.055 894 HZ PHE 115 HZ PHE 115 -3.199 -6.327 2.262 895 H GLN 116 H GLN 116 -6.144 -7.814 -4.528 896 HA GLN 116 HA GLN 116 -5.213 -8.240 -7.307 897 HB2 GLN 116 1HB GLN 116 -7.743 -8.978 -5.905 898 HB3 GLN 116 2HB GLN 116 -7.840 -8.582 -7.614 899 HG2 GLN 116 1HG GLN 116 -5.797 -10.551 -6.577 900 HG3 GLN 116 2HG GLN 116 -7.442 -11.059 -6.957 901 HE21 GLN 116 2HE2 GLN 116 -4.574 -9.479 -8.412 902 HE22 GLN 116 1HE2 GLN 116 -4.940 -9.933 -10.011 903 H LEU 117 H LEU 117 -4.606 -6.082 -7.673 904 HA LEU 117 HA LEU 117 -6.582 -3.972 -7.267 905 HB2 LEU 117 1HB LEU 117 -3.953 -3.588 -8.669 906 HB3 LEU 117 2HB LEU 117 -4.812 -2.483 -7.605 907 HG LEU 117 HG LEU 117 -3.373 -5.022 -6.781 908 HD11 LEU 117 1HD1 LEU 117 -2.023 -3.351 -5.441 909 HD12 LEU 117 2HD1 LEU 117 -2.836 -2.072 -6.344 910 HD13 LEU 117 3HD1 LEU 117 -1.813 -3.236 -7.187 911 HD21 LEU 117 3HD2 LEU 117 -5.154 -4.936 -5.261 912 HD22 LEU 117 1HD2 LEU 117 -5.262 -3.177 -5.323 913 HD23 LEU 117 2HD2 LEU 117 -3.952 -3.948 -4.433 914 HA PRO 118 HA PRO 118 -7.994 -4.168 -11.486 915 HB2 PRO 118 1HB PRO 118 -8.891 -1.657 -11.962 916 HB3 PRO 118 2HB PRO 118 -9.671 -2.731 -10.783 917 HG2 PRO 118 1HG PRO 118 -7.782 -0.473 -10.325 918 HG3 PRO 118 2HG PRO 118 -9.220 -0.942 -9.401 919 HD2 PRO 118 1HD PRO 118 -6.610 -1.565 -8.666 920 HD3 PRO 118 2HD PRO 118 -8.049 -2.457 -8.118 921 H PHE 119 H PHE 119 -7.125 -4.138 -13.493 922 HA PHE 119 HA PHE 119 -4.561 -3.174 -14.004 923 HB2 PHE 119 1HB PHE 119 -5.626 -5.140 -15.054 924 HB3 PHE 119 2HB PHE 119 -6.701 -4.055 -15.933 925 HD1 PHE 119 HD2 PHE 119 -3.083 -4.743 -15.317 926 HD2 PHE 119 HD1 PHE 119 -6.035 -3.154 -17.999 927 HE1 PHE 119 HE2 PHE 119 -1.340 -4.443 -17.054 928 HE2 PHE 119 HE1 PHE 119 -4.293 -2.850 -19.738 929 HZ PHE 119 HZ PHE 119 -1.945 -3.496 -19.265 930 H GLY 120 H GLY 120 -3.728 -1.599 -15.177 931 HA2 GLY 120 1HA GLY 120 -4.530 0.064 -17.058 932 HA3 GLY 120 2HA GLY 120 -5.426 0.737 -15.698 933 H SER 121 H SER 121 -3.791 2.439 -16.823 934 HA SER 121 HA SER 121 -1.096 2.439 -15.979 935 HB2 SER 121 1HB SER 121 -1.186 4.867 -16.462 936 HB3 SER 121 2HB SER 121 -1.900 3.910 -17.758 937 HG SER 121 HG SER 121 -3.814 4.392 -16.022 938 H HIS 122 H HIS 122 -4.044 3.017 -14.295 939 HA HIS 122 HA HIS 122 -3.087 4.733 -12.247 940 HB2 HIS 122 1HB HIS 122 -5.506 4.273 -12.774 941 HB3 HIS 122 2HB HIS 122 -5.308 2.691 -12.025 942 HD2 HIS 122 HD2 HIS 122 -5.337 2.717 -9.211 943 HE1 HIS 122 HE1 HIS 122 -5.568 6.908 -8.748 944 HE2 HIS 122 HE2 HIS 122 -5.683 4.685 -7.527 945 H THR 123 H THR 123 -3.353 1.160 -12.470 946 HA THR 123 HA THR 123 -2.244 0.768 -9.862 947 HB THR 123 HB THR 123 -2.715 -1.165 -12.129 948 HG1 THR 123 HG1 THR 123 -4.513 -1.672 -10.972 949 HG21 THR 123 3HG2 THR 123 -2.456 -2.863 -10.239 950 HG22 THR 123 1HG2 THR 123 -1.735 -1.565 -9.293 951 HG23 THR 123 2HG2 THR 123 -0.968 -2.105 -10.787 952 H ARG 124 H ARG 124 -0.993 0.578 -13.176 953 HA ARG 124 HA ARG 124 1.476 -0.569 -12.587 954 HB2 ARG 124 1HB ARG 124 0.642 -0.386 -14.862 955 HB3 ARG 124 2HB ARG 124 0.713 1.372 -14.777 956 HG2 ARG 124 1HG ARG 124 2.652 0.412 -15.982 957 HG3 ARG 124 2HG ARG 124 3.148 1.287 -14.540 958 HD2 ARG 124 1HD ARG 124 3.668 -0.673 -13.371 959 HD3 ARG 124 2HD ARG 124 2.608 -1.669 -14.364 960 HE ARG 124 HE ARG 124 4.766 -0.567 -15.891 961 HH11 ARG 124 1HH2 ARG 124 3.852 -3.001 -13.609 962 HH12 ARG 124 2HH2 ARG 124 5.081 -4.120 -14.101 963 HH21 ARG 124 1HH1 ARG 124 6.380 -2.028 -16.543 964 HH22 ARG 124 2HH1 ARG 124 6.512 -3.568 -15.762 965 H THR 125 H THR 125 0.443 2.793 -12.569 966 HA THR 125 HA THR 125 2.946 4.013 -12.316 967 HB THR 125 HB THR 125 0.316 4.836 -11.060 968 HG1 THR 125 HG1 THR 125 1.311 6.109 -13.282 969 HG21 THR 125 3HG2 THR 125 2.911 6.307 -11.550 970 HG22 THR 125 1HG2 THR 125 2.102 6.046 -10.006 971 HG23 THR 125 2HG2 THR 125 1.387 7.124 -11.205 972 H PHE 126 H PHE 126 0.779 2.701 -9.854 973 HA PHE 126 HA PHE 126 2.242 3.436 -7.579 974 HB2 PHE 126 1HB PHE 126 -0.066 2.522 -7.537 975 HB3 PHE 126 2HB PHE 126 0.584 0.933 -7.943 976 HD1 PHE 126 HD1 PHE 126 0.514 3.593 -5.368 977 HD2 PHE 126 HD2 PHE 126 1.740 -0.407 -6.304 978 HE1 PHE 126 HE1 PHE 126 1.013 3.193 -2.976 979 HE2 PHE 126 HE2 PHE 126 2.237 -0.816 -3.909 980 HZ PHE 126 HZ PHE 126 1.871 0.985 -2.245 981 H LEU 127 H LEU 127 2.410 0.383 -9.484 982 HA LEU 127 HA LEU 127 4.214 -0.981 -7.931 983 HB2 LEU 127 1HB LEU 127 4.275 -0.926 -10.953 984 HB3 LEU 127 2HB LEU 127 4.792 -2.240 -9.901 985 HG LEU 127 HG LEU 127 1.970 -1.193 -10.165 986 HD11 LEU 127 1HD1 LEU 127 1.507 -3.292 -11.299 987 HD12 LEU 127 2HD1 LEU 127 3.165 -3.835 -11.037 988 HD13 LEU 127 3HD1 LEU 127 2.842 -2.482 -12.120 989 HD21 LEU 127 3HD2 LEU 127 2.113 -2.011 -7.961 990 HD22 LEU 127 1HD2 LEU 127 3.257 -3.279 -8.402 991 HD23 LEU 127 2HD2 LEU 127 1.559 -3.422 -8.857 992 H GLN 128 H GLN 128 5.000 1.268 -10.626 993 HA GLN 128 HA GLN 128 7.756 0.960 -10.478 994 HB2 GLN 128 1HB GLN 128 6.208 3.414 -11.323 995 HB3 GLN 128 2HB GLN 128 7.824 2.945 -11.852 996 HG2 GLN 128 1HG GLN 128 5.266 1.417 -12.370 997 HG3 GLN 128 2HG GLN 128 6.169 2.332 -13.562 998 HE21 GLN 128 2HE2 GLN 128 5.532 -0.676 -13.218 999 HE22 GLN 128 1HE2 GLN 128 7.041 -1.421 -13.393 1000 H GLU 129 H GLU 129 5.629 3.275 -8.799 1001 HA GLU 129 HA GLU 129 7.649 4.900 -7.732 1002 HB2 GLU 129 1HB GLU 129 5.140 5.325 -7.716 1003 HB3 GLU 129 2HB GLU 129 5.065 4.252 -6.319 1004 HG2 GLU 129 1HG GLU 129 5.265 6.482 -5.461 1005 HG3 GLU 129 2HG GLU 129 6.829 5.704 -5.229 1006 H VAL 130 H VAL 130 6.183 1.928 -6.455 1007 HA VAL 130 HA VAL 130 7.502 1.979 -3.952 1008 HB VAL 130 HB VAL 130 6.355 -0.289 -5.595 1009 HG11 VAL 130 1HG1 VAL 130 6.438 -1.535 -3.383 1010 HG12 VAL 130 2HG1 VAL 130 7.535 -0.281 -2.806 1011 HG13 VAL 130 3HG1 VAL 130 8.000 -1.302 -4.166 1012 HG21 VAL 130 3HG2 VAL 130 4.860 1.540 -4.624 1013 HG22 VAL 130 1HG2 VAL 130 5.360 0.975 -3.029 1014 HG23 VAL 130 2HG2 VAL 130 4.478 -0.103 -4.110 1015 H ALA 131 H ALA 131 8.318 0.485 -7.034 1016 HA ALA 131 HA ALA 131 10.623 -0.898 -6.289 1017 HB1 ALA 131 3HB ALA 131 9.401 -0.952 -8.524 1018 HB2 ALA 131 1HB ALA 131 11.161 -1.026 -8.587 1019 HB3 ALA 131 2HB ALA 131 10.330 0.486 -8.949 1020 H ARG 132 H ARG 132 10.401 2.452 -7.525 1021 HA ARG 132 HA ARG 132 13.220 2.910 -7.293 1022 HB2 ARG 132 1HB ARG 132 10.891 4.812 -7.624 1023 HB3 ARG 132 2HB ARG 132 12.585 5.302 -7.673 1024 HG2 ARG 132 1HG ARG 132 12.987 3.760 -9.553 1025 HG3 ARG 132 2HG ARG 132 11.296 3.253 -9.501 1026 HD2 ARG 132 1HD ARG 132 12.189 6.112 -9.943 1027 HD3 ARG 132 2HD ARG 132 11.784 4.999 -11.245 1028 HE ARG 132 HE ARG 132 9.634 5.022 -9.444 1029 HH11 ARG 132 1HH2 ARG 132 11.322 7.137 -11.600 1030 HH12 ARG 132 2HH2 ARG 132 9.933 8.107 -11.957 1031 HH21 ARG 132 1HH1 ARG 132 7.807 6.290 -9.907 1032 HH22 ARG 132 2HH1 ARG 132 7.942 7.628 -10.999 1033 H ALA 133 H ALA 133 10.613 2.934 -5.091 1034 HA ALA 133 HA ALA 133 11.566 4.869 -3.243 1035 HB1 ALA 133 3HB ALA 133 9.869 4.074 -1.792 1036 HB2 ALA 133 1HB ALA 133 9.832 2.496 -2.573 1037 HB3 ALA 133 2HB ALA 133 9.218 3.915 -3.418 1038 H CYS 134 H CYS 134 12.523 1.620 -3.898 1039 HA CYS 134 HA CYS 134 14.839 1.649 -2.461 1040 HB2 CYS 134 1HB CYS 134 12.556 1.245 -0.651 1041 HB3 CYS 134 2HB CYS 134 13.802 0.012 -0.474 1042 HG CYS 134 HG CYS 134 14.047 2.707 0.667 1043 HA PRO 135 HA PRO 135 14.030 -2.996 -3.161 1044 HB2 PRO 135 1HB PRO 135 11.517 -3.897 -3.744 1045 HB3 PRO 135 2HB PRO 135 12.087 -3.667 -2.081 1046 HG2 PRO 135 1HG PRO 135 10.414 -1.852 -3.769 1047 HG3 PRO 135 2HG PRO 135 10.194 -2.326 -2.072 1048 HD2 PRO 135 1HD PRO 135 11.314 0.060 -2.773 1049 HD3 PRO 135 2HD PRO 135 11.797 -0.825 -1.306 1050 H GLY 136 H GLY 136 14.628 -1.082 -5.085 1051 HA2 GLY 136 1HA GLY 136 13.208 -1.714 -7.555 1052 HA3 GLY 136 2HA GLY 136 14.543 -0.579 -7.377 1053 H PHE 137 H PHE 137 13.685 -3.965 -7.588 1054 HA PHE 137 HA PHE 137 15.198 -5.837 -7.710 1055 HB2 PHE 137 1HB PHE 137 15.622 -6.028 -10.189 1056 HB3 PHE 137 2HB PHE 137 13.953 -5.682 -9.743 1057 HD1 PHE 137 HD2 PHE 137 13.138 -3.264 -9.816 1058 HD2 PHE 137 HD1 PHE 137 16.858 -4.526 -11.561 1059 HE1 PHE 137 HE2 PHE 137 13.202 -1.196 -11.183 1060 HE2 PHE 137 HE1 PHE 137 16.922 -2.457 -12.919 1061 HZ PHE 137 HZ PHE 137 15.093 -0.792 -12.735 1062 H ASP 138 H ASP 138 16.924 -4.786 -6.295 1063 HA ASP 138 HA ASP 138 19.464 -5.120 -7.516 1064 HB2 ASP 138 1HB ASP 138 18.674 -2.781 -8.316 1065 HB3 ASP 138 2HB ASP 138 18.985 -2.270 -6.660 1066 HA PRO 139 HA PRO 139 19.256 -5.980 -2.961 1067 HB2 PRO 139 1HB PRO 139 21.907 -7.188 -3.679 1068 HB3 PRO 139 2HB PRO 139 20.593 -7.858 -2.692 1069 HG2 PRO 139 1HG PRO 139 21.003 -8.701 -5.174 1070 HG3 PRO 139 2HG PRO 139 19.362 -8.506 -4.534 1071 HD2 PRO 139 1HD PRO 139 20.845 -6.775 -6.477 1072 HD3 PRO 139 2HD PRO 139 19.107 -7.145 -6.393 1073 H GLU 140 H GLU 140 21.437 -4.231 -4.877 1074 HA GLU 140 HA GLU 140 23.437 -3.453 -3.064 1075 HB2 GLU 140 1HB GLU 140 22.178 -1.861 -5.312 1076 HB3 GLU 140 2HB GLU 140 23.684 -1.438 -4.497 1077 HG2 GLU 140 1HG GLU 140 23.187 -4.059 -5.938 1078 HG3 GLU 140 2HG GLU 140 24.054 -2.691 -6.629 1079 H THR 141 H THR 141 20.116 -2.449 -3.335 1080 HA THR 141 HA THR 141 19.863 -0.033 -2.161 1081 HB THR 141 HB THR 141 17.858 -1.139 -2.660 1082 HG1 THR 141 HG1 THR 141 17.065 -0.301 -0.926 1083 HG21 THR 141 3HG2 THR 141 19.225 -3.471 -1.474 1084 HG22 THR 141 1HG2 THR 141 17.932 -3.421 -2.672 1085 HG23 THR 141 2HG2 THR 141 17.550 -3.331 -0.956 1086 H ARG 142 H ARG 142 19.272 -2.685 0.074 1087 HA ARG 142 HA ARG 142 19.711 -2.926 2.310 1088 HB2 ARG 142 1HB ARG 142 22.381 -1.976 1.270 1089 HB3 ARG 142 2HB ARG 142 22.132 -2.534 2.926 1090 HG2 ARG 142 1HG ARG 142 21.374 -4.701 2.139 1091 HG3 ARG 142 2HG ARG 142 21.464 -4.161 0.462 1092 HD2 ARG 142 1HD ARG 142 23.843 -4.213 2.330 1093 HD3 ARG 142 2HD ARG 142 23.445 -5.526 1.225 1094 HE ARG 142 HE ARG 142 23.524 -3.129 -0.248 1095 HH11 ARG 142 1HH2 ARG 142 25.588 -5.238 1.554 1096 HH12 ARG 142 2HH2 ARG 142 27.001 -4.879 0.619 1097 HH21 ARG 142 1HH1 ARG 142 25.367 -2.652 -1.478 1098 HH22 ARG 142 2HH1 ARG 142 26.875 -3.413 -1.100 1099 H ASP 143 H ASP 143 20.617 -1.827 4.278 1100 HA ASP 143 HA ASP 143 20.772 -0.027 5.723 1101 HB2 ASP 143 1HB ASP 143 20.337 1.915 3.469 1102 HB3 ASP 143 2HB ASP 143 21.304 2.100 4.928 1103 HA PRO 144 HA PRO 144 16.141 0.296 5.218 1104 HB2 PRO 144 1HB PRO 144 15.397 -1.245 7.343 1105 HB3 PRO 144 2HB PRO 144 15.741 -1.928 5.739 1106 HG2 PRO 144 1HG PRO 144 17.485 -1.826 8.164 1107 HG3 PRO 144 2HG PRO 144 17.239 -3.148 7.007 1108 HD2 PRO 144 1HD PRO 144 19.418 -1.474 6.918 1109 HD3 PRO 144 2HD PRO 144 18.751 -2.269 5.474 1110 H GLU 145 H GLU 145 14.673 1.374 6.622 1111 HA GLU 145 HA GLU 145 15.660 2.522 9.124 1112 HB2 GLU 145 1HB GLU 145 14.928 4.231 6.729 1113 HB3 GLU 145 2HB GLU 145 15.027 4.846 8.378 1114 HG2 GLU 145 1HG GLU 145 17.392 4.191 8.505 1115 HG3 GLU 145 2HG GLU 145 17.308 3.520 6.876 1116 H PHE 146 H PHE 146 13.970 3.228 10.473 1117 HA PHE 146 HA PHE 146 11.250 3.338 9.529 1118 HB2 PHE 146 1HB PHE 146 10.593 1.417 11.158 1119 HB3 PHE 146 2HB PHE 146 11.238 0.993 9.573 1120 HD1 PHE 146 HD2 PHE 146 12.150 1.436 13.155 1121 HD2 PHE 146 HD1 PHE 146 13.302 -0.176 9.343 1122 HE1 PHE 146 HE2 PHE 146 14.019 0.218 14.235 1123 HE2 PHE 146 HE1 PHE 146 15.171 -1.393 10.424 1124 HZ PHE 146 HZ PHE 146 15.530 -1.199 12.871 1125 H GLU 147 H GLU 147 13.617 4.272 11.505 1126 HA GLU 147 HA GLU 147 12.522 4.470 14.070 1127 HB2 GLU 147 1HB GLU 147 14.194 6.206 14.459 1128 HB3 GLU 147 2HB GLU 147 14.890 4.865 13.553 1129 HG2 GLU 147 1HG GLU 147 14.515 6.137 11.442 1130 HG3 GLU 147 2HG GLU 147 13.918 7.495 12.394 1131 H TRP 148 H TRP 148 11.987 6.493 11.248 1132 HA TRP 148 HA TRP 148 10.725 8.607 12.765 1133 HB2 TRP 148 1HB TRP 148 10.175 9.566 10.565 1134 HB3 TRP 148 2HB TRP 148 11.880 9.136 10.684 1135 HD1 TRP 148 HD1 TRP 148 12.569 6.711 9.571 1136 HE1 TRP 148 HE1 TRP 148 11.657 5.600 7.433 1137 HE3 TRP 148 HE3 TRP 148 8.181 9.286 9.025 1138 HZ2 TRP 148 HZ2 TRP 148 9.377 5.768 5.725 1139 HZ3 TRP 148 HZ3 TRP 148 6.665 8.785 7.134 1140 HH2 TRP 148 HH2 TRP 148 7.255 7.031 5.485 1141 H LEU 149 H LEU 149 9.688 5.597 11.420 1142 HA LEU 149 HA LEU 149 6.939 6.238 11.024 1143 HB2 LEU 149 1HB LEU 149 8.304 3.593 11.560 1144 HB3 LEU 149 2HB LEU 149 6.599 3.754 11.157 1145 HG LEU 149 HG LEU 149 8.792 4.884 9.394 1146 HD11 LEU 149 1HD1 LEU 149 7.378 2.235 9.005 1147 HD12 LEU 149 2HD1 LEU 149 8.985 2.370 9.722 1148 HD13 LEU 149 3HD1 LEU 149 8.715 2.892 8.060 1149 HD21 LEU 149 3HD2 LEU 149 6.875 4.494 7.672 1150 HD22 LEU 149 1HD2 LEU 149 6.712 5.851 8.779 1151 HD23 LEU 149 2HD2 LEU 149 5.825 4.359 9.079 1152 H SER 150 H SER 150 8.824 5.169 13.797 1153 HA SER 150 HA SER 150 6.840 4.364 15.554 1154 HB2 SER 150 1HB SER 150 9.271 4.250 16.017 1155 HB3 SER 150 2HB SER 150 9.305 6.001 16.201 1156 HG SER 150 HG SER 150 8.757 5.621 18.185 1157 H ARG 151 H ARG 151 7.501 7.462 14.270 1158 HA ARG 151 HA ARG 151 6.121 8.983 16.310 1159 HB2 ARG 151 1HB ARG 151 6.971 9.732 13.497 1160 HB3 ARG 151 2HB ARG 151 6.407 10.857 14.731 1161 HG2 ARG 151 1HG ARG 151 8.312 10.346 16.148 1162 HG3 ARG 151 2HG ARG 151 8.842 9.078 15.039 1163 HD2 ARG 151 1HD ARG 151 10.159 11.075 14.616 1164 HD3 ARG 151 2HD ARG 151 9.077 10.801 13.253 1165 HE ARG 151 HE ARG 151 7.883 12.724 13.850 1166 HH11 ARG 151 1HH2 ARG 151 10.217 11.840 16.251 1167 HH12 ARG 151 2HH2 ARG 151 10.051 13.310 17.150 1168 HH21 ARG 151 1HH1 ARG 151 7.654 14.647 15.029 1169 HH22 ARG 151 2HH1 ARG 151 8.598 14.900 16.459 1170 H HIS 152 H HIS 152 4.955 6.706 14.688 1171 HA HIS 152 HA HIS 152 2.372 7.980 14.230 1172 HB2 HIS 152 1HB HIS 152 3.793 6.317 12.130 1173 HB3 HIS 152 2HB HIS 152 2.118 6.867 12.037 1174 HD2 HIS 152 HD2 HIS 152 5.588 8.151 11.081 1175 HE1 HIS 152 HE1 HIS 152 3.082 11.546 11.159 1176 HE2 HIS 152 HE2 HIS 152 5.360 10.674 10.452 1177 H THR 153 H THR 153 0.710 6.361 13.934 1178 HA THR 153 HA THR 153 1.279 3.644 14.843 1179 HB THR 153 HB THR 153 -0.769 5.269 16.351 1180 HG1 THR 153 HG1 THR 153 1.116 6.205 16.900 1181 HG21 THR 153 3HG2 THR 153 -0.974 3.400 17.731 1182 HG22 THR 153 1HG2 THR 153 0.662 2.845 17.386 1183 HG23 THR 153 2HG2 THR 153 -0.616 2.608 16.198 1184 H CYS 154 H CYS 154 -1.811 4.007 15.588 1185 HA CYS 154 HA CYS 154 -2.916 4.032 12.874 1186 HB2 CYS 154 1HB CYS 154 -3.204 1.686 14.768 1187 HB3 CYS 154 2HB CYS 154 -4.076 1.885 13.248 1188 HG CYS 154 HG CYS 154 -1.908 0.446 12.802 1189 H ALA 155 H ALA 155 -5.120 4.486 12.816 1190 HA ALA 155 HA ALA 155 -7.195 5.134 13.586 1191 HB1 ALA 155 3HB ALA 155 -6.395 4.851 16.463 1192 HB2 ALA 155 1HB ALA 155 -6.565 3.394 15.485 1193 HB3 ALA 155 2HB ALA 155 -7.934 4.487 15.685 1194 H GLU 156 H GLU 156 -7.746 7.221 13.517 1195 HA GLU 156 HA GLU 156 -6.038 9.337 13.886 1196 HB2 GLU 156 1HB GLU 156 -9.048 9.245 14.180 1197 HB3 GLU 156 2HB GLU 156 -8.121 10.746 14.131 1198 HG2 GLU 156 1HG GLU 156 -7.193 10.071 11.923 1199 HG3 GLU 156 2HG GLU 156 -8.196 8.622 11.965 1200 HA PRO 157 HA PRO 157 -5.576 9.506 18.342 1201 HB2 PRO 157 1HB PRO 157 -4.731 12.095 18.658 1202 HB3 PRO 157 2HB PRO 157 -3.695 10.823 17.977 1203 HG2 PRO 157 1HG PRO 157 -5.338 12.873 16.543 1204 HG3 PRO 157 2HG PRO 157 -3.647 12.406 16.271 1205 HD2 PRO 157 1HD PRO 157 -5.614 11.438 14.712 1206 HD3 PRO 157 2HD PRO 157 -4.235 10.413 15.182 1207 H ASP 158 H ASP 158 -7.629 11.661 16.584 1208 HA ASP 158 HA ASP 158 -8.884 12.906 18.852 1209 HB2 ASP 158 1HB ASP 158 -8.769 13.905 16.547 1210 HB3 ASP 158 2HB ASP 158 -9.917 12.677 16.019 1211 H ALA 159 H ALA 159 -8.771 9.947 18.730 1212 HA ALA 159 HA ALA 159 -11.295 8.837 18.141 1213 HB1 ALA 159 3HB ALA 159 -9.205 7.947 20.142 1214 HB2 ALA 159 1HB ALA 159 -9.310 7.449 18.454 1215 HB3 ALA 159 2HB ALA 159 -10.567 6.970 19.594 1216 H GLU 160 H GLU 160 -9.992 10.307 21.084 1217 HA GLU 160 HA GLU 160 -10.990 10.950 23.051 1218 HB2 GLU 160 1HB GLU 160 -13.396 11.098 21.218 1219 HB3 GLU 160 2HB GLU 160 -13.339 11.759 22.850 1220 HG2 GLU 160 1HG GLU 160 -11.418 12.527 20.639 1221 HG3 GLU 160 2HG GLU 160 -12.851 13.457 21.072 1222 H SER 161 H SER 161 -10.542 8.474 23.389 1223 HA SER 161 HA SER 161 -12.452 6.506 23.414 1224 HB2 SER 161 1HB SER 161 -11.287 5.665 25.506 1225 HB3 SER 161 2HB SER 161 -10.242 5.965 24.120 1226 HG SER 161 HG SER 161 -10.304 7.165 26.566 Start of MODEL 18 1 H1 GLY 1 1H GLY 1 -20.884 18.703 -10.873 2 H2 GLY 1 2H GLY 1 -21.142 17.027 -10.994 3 H3 GLY 1 3H GLY 1 -20.917 17.960 -12.396 4 HA2 GLY 1 1HA GLY 1 -18.794 17.328 -12.293 5 HA3 GLY 1 2HA GLY 1 -18.678 18.510 -10.989 6 HA PRO 2 HA PRO 2 -19.543 14.169 -8.921 7 HB2 PRO 2 1HB PRO 2 -18.626 12.388 -11.140 8 HB3 PRO 2 2HB PRO 2 -20.019 12.205 -10.054 9 HG2 PRO 2 1HG PRO 2 -20.348 12.906 -12.602 10 HG3 PRO 2 2HG PRO 2 -21.357 13.606 -11.322 11 HD2 PRO 2 1HD PRO 2 -19.012 14.834 -12.753 12 HD3 PRO 2 2HD PRO 2 -20.549 15.585 -12.260 13 H LEU 3 H LEU 3 -17.955 13.302 -7.615 14 HA LEU 3 HA LEU 3 -15.305 14.232 -7.872 15 HB2 LEU 3 1HB LEU 3 -16.498 12.044 -6.155 16 HB3 LEU 3 2HB LEU 3 -14.838 12.615 -5.994 17 HG LEU 3 HG LEU 3 -17.269 14.416 -5.804 18 HD11 LEU 3 1HD1 LEU 3 -15.581 13.312 -3.543 19 HD12 LEU 3 2HD1 LEU 3 -17.170 12.691 -3.988 20 HD13 LEU 3 3HD1 LEU 3 -17.003 14.343 -3.397 21 HD21 LEU 3 3HD2 LEU 3 -14.299 14.815 -5.504 22 HD22 LEU 3 1HD2 LEU 3 -15.386 15.784 -4.510 23 HD23 LEU 3 2HD2 LEU 3 -15.497 15.861 -6.263 24 H GLY 4 H GLY 4 -16.786 11.083 -8.556 25 HA2 GLY 4 1HA GLY 4 -16.122 9.484 -10.103 26 HA3 GLY 4 2HA GLY 4 -14.729 10.485 -10.497 27 H SER 5 H SER 5 -14.907 7.588 -9.994 28 HA SER 5 HA SER 5 -13.882 6.888 -7.474 29 HB2 SER 5 1HB SER 5 -13.224 4.801 -8.517 30 HB3 SER 5 2HB SER 5 -14.792 5.284 -9.154 31 HG SER 5 HG SER 5 -13.781 5.017 -10.995 32 H MET 6 H MET 6 -11.523 5.394 -8.529 33 HA MET 6 HA MET 6 -9.240 5.710 -8.292 34 HB2 MET 6 1HB MET 6 -9.989 7.710 -10.436 35 HB3 MET 6 2HB MET 6 -8.324 7.278 -10.045 36 HG2 MET 6 1HG MET 6 -8.805 4.917 -10.553 37 HG3 MET 6 2HG MET 6 -10.480 5.331 -10.922 38 HE1 MET 6 3HE MET 6 -9.125 4.534 -14.426 39 HE2 MET 6 1HE MET 6 -10.597 4.541 -13.446 40 HE3 MET 6 2HE MET 6 -9.148 3.729 -12.859 41 H ASP 7 H ASP 7 -11.094 7.463 -6.619 42 HA ASP 7 HA ASP 7 -9.326 9.780 -6.119 43 HB2 ASP 7 1HB ASP 7 -12.167 9.144 -5.316 44 HB3 ASP 7 2HB ASP 7 -11.252 10.466 -4.592 45 H GLN 8 H GLN 8 -8.036 7.633 -5.354 46 HA GLN 8 HA GLN 8 -8.621 7.085 -2.512 47 HB2 GLN 8 1HB GLN 8 -6.904 5.761 -4.607 48 HB3 GLN 8 2HB GLN 8 -6.607 5.445 -2.896 49 HG2 GLN 8 1HG GLN 8 -8.077 3.737 -3.615 50 HG3 GLN 8 2HG GLN 8 -9.102 4.869 -2.744 51 HE21 GLN 8 2HE2 GLN 8 -10.674 3.538 -4.315 52 HE22 GLN 8 1HE2 GLN 8 -10.972 4.281 -5.810 53 H SER 9 H SER 9 -6.205 8.469 -4.649 54 HA SER 9 HA SER 9 -4.095 8.797 -2.876 55 HB2 SER 9 1HB SER 9 -3.689 9.374 -5.136 56 HB3 SER 9 2HB SER 9 -5.027 10.519 -5.167 57 HG SER 9 HG SER 9 -2.582 11.117 -4.717 58 H VAL 10 H VAL 10 -6.774 11.096 -3.459 59 HA VAL 10 HA VAL 10 -5.929 12.953 -1.483 60 HB VAL 10 HB VAL 10 -8.198 13.881 -1.721 61 HG11 VAL 10 1HG1 VAL 10 -8.126 14.109 -4.274 62 HG12 VAL 10 2HG1 VAL 10 -6.744 13.014 -4.225 63 HG13 VAL 10 3HG1 VAL 10 -6.662 14.574 -3.406 64 HG21 VAL 10 3HG2 VAL 10 -9.665 12.670 -3.481 65 HG22 VAL 10 1HG2 VAL 10 -9.614 11.982 -1.859 66 HG23 VAL 10 2HG2 VAL 10 -8.658 11.259 -3.153 67 H ALA 11 H ALA 11 -8.341 10.363 -1.476 68 HA ALA 11 HA ALA 11 -9.532 10.547 0.928 69 HB1 ALA 11 3HB ALA 11 -9.763 8.657 -0.771 70 HB2 ALA 11 1HB ALA 11 -9.867 8.193 0.929 71 HB3 ALA 11 2HB ALA 11 -8.383 7.902 0.024 72 H ILE 12 H ILE 12 -6.254 9.269 0.414 73 HA ILE 12 HA ILE 12 -5.796 8.556 3.103 74 HB ILE 12 HB ILE 12 -3.788 9.369 0.999 75 HG12 ILE 12 1HG1 ILE 12 -5.189 7.563 0.188 76 HG13 ILE 12 2HG1 ILE 12 -3.616 6.909 0.601 77 HG21 ILE 12 1HG2 ILE 12 -2.577 9.333 2.995 78 HG22 ILE 12 2HG2 ILE 12 -2.390 7.676 2.428 79 HG23 ILE 12 3HG2 ILE 12 -3.562 8.048 3.694 80 HD11 ILE 12 3HD1 ILE 12 -6.252 6.548 1.987 81 HD12 ILE 12 1HD1 ILE 12 -4.772 6.440 2.936 82 HD13 ILE 12 2HD1 ILE 12 -5.029 5.343 1.583 83 H GLN 13 H GLN 13 -4.866 11.419 1.280 84 HA GLN 13 HA GLN 13 -3.480 12.817 3.198 85 HB2 GLN 13 1HB GLN 13 -4.926 13.525 0.765 86 HB3 GLN 13 2HB GLN 13 -5.052 14.820 1.952 87 HG2 GLN 13 1HG GLN 13 -2.440 13.509 1.141 88 HG3 GLN 13 2HG GLN 13 -3.037 15.022 0.460 89 HE21 GLN 13 2HE2 GLN 13 -0.785 14.083 2.610 90 HE22 GLN 13 1HE2 GLN 13 -0.935 15.306 3.779 91 H GLU 14 H GLU 14 -7.032 12.875 2.776 92 HA GLU 14 HA GLU 14 -7.538 14.552 4.977 93 HB2 GLU 14 1HB GLU 14 -9.254 12.440 3.650 94 HB3 GLU 14 2HB GLU 14 -9.849 13.616 4.822 95 HG2 GLU 14 1HG GLU 14 -8.471 14.343 2.220 96 HG3 GLU 14 2HG GLU 14 -10.219 14.316 2.444 97 H THR 15 H THR 15 -6.665 11.247 4.753 98 HA THR 15 HA THR 15 -7.293 10.808 7.625 99 HB THR 15 HB THR 15 -7.365 8.426 7.137 100 HG1 THR 15 HG1 THR 15 -6.410 7.766 5.426 101 HG21 THR 15 3HG2 THR 15 -9.543 9.157 6.891 102 HG22 THR 15 1HG2 THR 15 -9.251 8.611 5.241 103 HG23 THR 15 2HG2 THR 15 -9.128 10.324 5.635 104 H LEU 16 H LEU 16 -4.779 11.876 6.063 105 HA LEU 16 HA LEU 16 -2.822 9.896 7.021 106 HB2 LEU 16 1HB LEU 16 -2.762 10.965 4.672 107 HB3 LEU 16 2HB LEU 16 -2.208 12.420 5.485 108 HG LEU 16 HG LEU 16 -0.298 11.134 6.441 109 HD11 LEU 16 1HD1 LEU 16 -1.737 8.875 5.123 110 HD12 LEU 16 2HD1 LEU 16 -0.774 8.890 6.597 111 HD13 LEU 16 3HD1 LEU 16 0.023 8.854 5.029 112 HD21 LEU 16 3HD2 LEU 16 -0.708 11.156 3.445 113 HD22 LEU 16 1HD2 LEU 16 0.838 10.740 4.181 114 HD23 LEU 16 2HD2 LEU 16 0.141 12.343 4.431 115 H VAL 17 H VAL 17 -1.152 12.633 6.901 116 HA VAL 17 HA VAL 17 -1.887 13.917 9.343 117 HB VAL 17 HB VAL 17 -0.743 11.746 10.086 118 HG11 VAL 17 1HG1 VAL 17 1.019 11.944 8.243 119 HG12 VAL 17 2HG1 VAL 17 1.619 11.556 9.856 120 HG13 VAL 17 3HG1 VAL 17 1.766 13.199 9.234 121 HG21 VAL 17 3HG2 VAL 17 0.490 12.894 11.855 122 HG22 VAL 17 1HG2 VAL 17 -0.988 13.790 11.498 123 HG23 VAL 17 2HG2 VAL 17 0.561 14.366 10.885 124 H GLU 18 H GLU 18 -1.014 15.940 9.409 125 HA GLU 18 HA GLU 18 -0.076 17.182 7.178 126 HB2 GLU 18 1HB GLU 18 0.521 17.821 10.071 127 HB3 GLU 18 2HB GLU 18 0.851 18.918 8.727 128 HG2 GLU 18 1HG GLU 18 -1.518 18.923 8.112 129 HG3 GLU 18 2HG GLU 18 -1.872 17.762 9.390 130 H GLY 19 H GLY 19 2.091 18.343 7.036 131 HA2 GLY 19 1HA GLY 19 4.352 18.275 6.637 132 HA3 GLY 19 2HA GLY 19 4.465 17.203 8.024 133 H GLU 20 H GLU 20 2.708 15.152 6.828 134 HA GLU 20 HA GLU 20 4.762 13.758 5.388 135 HB2 GLU 20 1HB GLU 20 3.198 12.660 7.000 136 HB3 GLU 20 2HB GLU 20 1.895 12.918 5.845 137 HG2 GLU 20 1HG GLU 20 3.018 11.558 4.182 138 HG3 GLU 20 2HG GLU 20 4.450 11.422 5.200 139 H TYR 21 H TYR 21 4.462 12.771 3.331 140 HA TYR 21 HA TYR 21 2.851 14.399 1.427 141 HB2 TYR 21 1HB TYR 21 5.371 14.720 1.418 142 HB3 TYR 21 2HB TYR 21 5.485 13.054 0.853 143 HD1 TYR 21 HD1 TYR 21 4.318 16.456 0.012 144 HD2 TYR 21 HD2 TYR 21 4.801 12.417 -1.361 145 HE1 TYR 21 HE1 TYR 21 3.881 17.195 -2.313 146 HE2 TYR 21 HE2 TYR 21 4.362 13.151 -3.686 147 HH TYR 21 HH TYR 21 4.692 15.838 -4.853 148 H CYS 22 H CYS 22 1.404 13.312 0.284 149 HA CYS 22 HA CYS 22 1.548 10.372 0.163 150 HB2 CYS 22 1HB CYS 22 -0.610 11.444 0.840 151 HB3 CYS 22 2HB CYS 22 -0.685 12.214 -0.745 152 HG CYS 22 HG CYS 22 -1.695 9.519 -0.282 153 H VAL 23 H VAL 23 1.826 9.301 -1.811 154 HA VAL 23 HA VAL 23 2.566 11.028 -4.099 155 HB VAL 23 HB VAL 23 3.515 8.247 -3.391 156 HG11 VAL 23 1HG1 VAL 23 4.217 10.191 -5.602 157 HG12 VAL 23 2HG1 VAL 23 3.599 8.549 -5.770 158 HG13 VAL 23 3HG1 VAL 23 5.235 8.817 -5.170 159 HG21 VAL 23 3HG2 VAL 23 4.316 10.014 -1.839 160 HG22 VAL 23 1HG2 VAL 23 4.934 10.920 -3.221 161 HG23 VAL 23 2HG2 VAL 23 5.624 9.348 -2.817 162 H ILE 24 H ILE 24 1.244 7.829 -3.280 163 HA ILE 24 HA ILE 24 -0.841 8.041 -5.219 164 HB ILE 24 HB ILE 24 0.974 7.697 -6.789 165 HG12 ILE 24 1HG1 ILE 24 0.283 5.553 -7.840 166 HG13 ILE 24 2HG1 ILE 24 -0.611 5.135 -6.384 167 HG21 ILE 24 1HG2 ILE 24 2.489 6.610 -5.049 168 HG22 ILE 24 2HG2 ILE 24 2.540 5.910 -6.665 169 HG23 ILE 24 3HG2 ILE 24 1.637 5.105 -5.388 170 HD11 ILE 24 3HD1 ILE 24 -2.183 6.864 -6.714 171 HD12 ILE 24 1HD1 ILE 24 -1.912 6.227 -8.337 172 HD13 ILE 24 2HD1 ILE 24 -1.129 7.727 -7.837 173 H ALA 25 H ALA 25 -2.436 7.054 -4.228 174 HA ALA 25 HA ALA 25 -1.962 4.465 -2.876 175 HB1 ALA 25 3HB ALA 25 -2.231 6.274 -1.203 176 HB2 ALA 25 1HB ALA 25 -3.548 5.101 -1.147 177 HB3 ALA 25 2HB ALA 25 -3.794 6.668 -1.921 178 H VAL 26 H VAL 26 -3.143 2.892 -3.638 179 HA VAL 26 HA VAL 26 -5.660 3.562 -5.057 180 HB VAL 26 HB VAL 26 -5.227 1.479 -6.355 181 HG11 VAL 26 1HG1 VAL 26 -3.680 2.490 -7.847 182 HG12 VAL 26 2HG1 VAL 26 -2.897 3.380 -6.541 183 HG13 VAL 26 3HG1 VAL 26 -4.522 3.827 -7.063 184 HG21 VAL 26 3HG2 VAL 26 -3.637 0.598 -4.501 185 HG22 VAL 26 1HG2 VAL 26 -2.418 1.604 -5.285 186 HG23 VAL 26 2HG2 VAL 26 -3.202 0.304 -6.181 187 H GLN 27 H GLN 27 -6.546 0.903 -5.307 188 HA GLN 27 HA GLN 27 -6.822 -0.071 -2.557 189 HB2 GLN 27 1HB GLN 27 -8.633 1.578 -2.841 190 HB3 GLN 27 2HB GLN 27 -9.178 0.731 -4.289 191 HG2 GLN 27 1HG GLN 27 -9.670 -1.263 -3.003 192 HG3 GLN 27 2HG GLN 27 -8.970 -0.542 -1.558 193 HE21 GLN 27 2HE2 GLN 27 -11.443 -1.274 -1.032 194 HE22 GLN 27 1HE2 GLN 27 -12.558 -0.000 -1.135 195 H GLY 28 H GLY 28 -7.642 -2.202 -2.440 196 HA2 GLY 28 1HA GLY 28 -8.198 -3.674 -4.884 197 HA3 GLY 28 2HA GLY 28 -6.652 -4.073 -4.140 198 H VAL 29 H VAL 29 -8.189 -6.126 -4.293 199 HA VAL 29 HA VAL 29 -9.797 -6.373 -1.828 200 HB VAL 29 HB VAL 29 -9.450 -8.189 -4.231 201 HG11 VAL 29 1HG1 VAL 29 -10.960 -8.579 -1.636 202 HG12 VAL 29 2HG1 VAL 29 -9.753 -9.646 -2.349 203 HG13 VAL 29 3HG1 VAL 29 -11.339 -9.483 -3.102 204 HG21 VAL 29 3HG2 VAL 29 -11.905 -6.768 -3.166 205 HG22 VAL 29 1HG2 VAL 29 -11.745 -7.615 -4.704 206 HG23 VAL 29 2HG2 VAL 29 -10.875 -6.105 -4.433 207 H LEU 30 H LEU 30 -9.446 -8.225 -0.460 208 HA LEU 30 HA LEU 30 -6.756 -9.436 -0.580 209 HB2 LEU 30 1HB LEU 30 -6.477 -7.530 0.942 210 HB3 LEU 30 2HB LEU 30 -7.913 -8.003 1.847 211 HG LEU 30 HG LEU 30 -6.818 -10.097 2.533 212 HD11 LEU 30 1HD1 LEU 30 -4.655 -9.099 0.690 213 HD12 LEU 30 2HD1 LEU 30 -5.402 -10.702 0.756 214 HD13 LEU 30 3HD1 LEU 30 -4.280 -10.205 2.008 215 HD21 LEU 30 3HD2 LEU 30 -6.459 -7.948 3.812 216 HD22 LEU 30 1HD2 LEU 30 -4.921 -7.782 2.968 217 HD23 LEU 30 2HD2 LEU 30 -5.195 -9.157 4.037 218 H CYS 31 H CYS 31 -7.085 -11.640 -0.396 219 HA CYS 31 HA CYS 31 -9.646 -12.529 0.728 220 HB2 CYS 31 1HB CYS 31 -7.588 -14.179 -0.727 221 HB3 CYS 31 2HB CYS 31 -9.302 -14.527 -0.490 222 HG CYS 31 HG CYS 31 -8.289 -12.201 -2.328 223 H LYS 32 H LYS 32 -9.504 -12.757 2.838 224 HA LYS 32 HA LYS 32 -7.136 -13.734 4.166 225 HB2 LYS 32 1HB LYS 32 -9.915 -13.006 5.074 226 HB3 LYS 32 2HB LYS 32 -8.816 -13.856 6.155 227 HG2 LYS 32 1HG LYS 32 -7.863 -11.374 4.733 228 HG3 LYS 32 2HG LYS 32 -8.886 -11.220 6.157 229 HD2 LYS 32 1HD LYS 32 -7.296 -12.573 7.459 230 HD3 LYS 32 2HD LYS 32 -6.263 -12.742 6.041 231 HE2 LYS 32 1HE LYS 32 -6.004 -10.291 5.940 232 HE3 LYS 32 2HE LYS 32 -7.018 -10.132 7.373 233 HZ1 LYS 32 3HZ LYS 32 -4.386 -11.476 7.176 234 HZ2 LYS 32 1HZ LYS 32 -5.398 -11.595 8.530 235 HZ3 LYS 32 2HZ LYS 32 -4.769 -10.085 8.072 236 H GLY 33 H GLY 33 -6.921 -15.744 5.199 237 HA2 GLY 33 1HA GLY 33 -7.490 -17.982 3.801 238 HA3 GLY 33 2HA GLY 33 -7.278 -17.991 5.548 239 H ASP 34 H ASP 34 -9.609 -17.914 2.930 240 HA ASP 34 HA ASP 34 -11.705 -18.877 2.824 241 HB2 ASP 34 1HB ASP 34 -11.821 -19.187 5.817 242 HB3 ASP 34 2HB ASP 34 -12.587 -20.156 4.569 243 H SER 35 H SER 35 -10.757 -16.184 4.561 244 HA SER 35 HA SER 35 -13.531 -15.168 4.839 245 HB2 SER 35 1HB SER 35 -12.612 -14.759 6.920 246 HB3 SER 35 2HB SER 35 -10.973 -14.693 6.296 247 HG SER 35 HG SER 35 -11.294 -12.619 6.533 248 H ARG 36 H ARG 36 -14.162 -13.497 3.602 249 HA ARG 36 HA ARG 36 -12.135 -12.274 1.796 250 HB2 ARG 36 1HB ARG 36 -14.027 -13.806 0.848 251 HB3 ARG 36 2HB ARG 36 -15.058 -12.403 1.109 252 HG2 ARG 36 1HG ARG 36 -14.327 -11.960 -1.060 253 HG3 ARG 36 2HG ARG 36 -13.078 -11.121 -0.145 254 HD2 ARG 36 1HD ARG 36 -11.957 -12.462 -1.800 255 HD3 ARG 36 2HD ARG 36 -11.711 -13.260 -0.248 256 HE ARG 36 HE ARG 36 -14.035 -14.305 -1.468 257 HH11 ARG 36 1HH2 ARG 36 -10.591 -14.218 -1.788 258 HH12 ARG 36 2HH2 ARG 36 -10.486 -15.767 -2.556 259 HH21 ARG 36 1HH1 ARG 36 -13.906 -16.333 -2.470 260 HH22 ARG 36 2HH1 ARG 36 -12.365 -16.965 -2.942 261 H GLN 37 H GLN 37 -11.771 -10.207 1.983 262 HA GLN 37 HA GLN 37 -13.887 -8.333 2.641 263 HB2 GLN 37 1HB GLN 37 -12.124 -7.429 4.507 264 HB3 GLN 37 2HB GLN 37 -13.452 -8.520 4.892 265 HG2 GLN 37 1HG GLN 37 -11.326 -9.335 5.833 266 HG3 GLN 37 2HG GLN 37 -11.959 -10.456 4.635 267 HE21 GLN 37 2HE2 GLN 37 -10.110 -11.310 3.642 268 HE22 GLN 37 1HE2 GLN 37 -8.850 -10.374 3.000 269 H SER 38 H SER 38 -13.500 -6.374 1.810 270 HA SER 38 HA SER 38 -11.239 -6.068 0.043 271 HB2 SER 38 1HB SER 38 -12.283 -3.815 -0.410 272 HB3 SER 38 2HB SER 38 -13.328 -5.195 -0.724 273 HG SER 38 HG SER 38 -14.111 -4.850 1.481 274 H ARG 39 H ARG 39 -9.613 -4.543 0.171 275 HA ARG 39 HA ARG 39 -9.244 -3.114 2.734 276 HB2 ARG 39 1HB ARG 39 -8.004 -5.418 2.477 277 HB3 ARG 39 2HB ARG 39 -6.936 -4.510 1.419 278 HG2 ARG 39 1HG ARG 39 -5.863 -4.228 3.472 279 HG3 ARG 39 2HG ARG 39 -6.872 -2.792 3.429 280 HD2 ARG 39 1HD ARG 39 -7.074 -3.872 5.613 281 HD3 ARG 39 2HD ARG 39 -8.605 -4.005 4.752 282 HE ARG 39 HE ARG 39 -6.881 -6.266 4.315 283 HH11 ARG 39 1HH2 ARG 39 -9.212 -4.790 6.406 284 HH12 ARG 39 2HH2 ARG 39 -9.707 -6.283 7.131 285 HH21 ARG 39 1HH1 ARG 39 -7.522 -8.220 5.260 286 HH22 ARG 39 2HH1 ARG 39 -8.748 -8.226 6.483 287 H LEU 40 H LEU 40 -7.600 -1.454 2.606 288 HA LEU 40 HA LEU 40 -7.146 -0.393 -0.128 289 HB2 LEU 40 1HB LEU 40 -9.082 0.677 1.202 290 HB3 LEU 40 2HB LEU 40 -7.840 1.389 2.223 291 HG LEU 40 HG LEU 40 -7.533 1.709 -0.759 292 HD11 LEU 40 1HD1 LEU 40 -9.523 3.213 0.947 293 HD12 LEU 40 2HD1 LEU 40 -9.865 2.239 -0.483 294 HD13 LEU 40 3HD1 LEU 40 -8.971 3.751 -0.638 295 HD21 LEU 40 3HD2 LEU 40 -5.853 2.578 0.896 296 HD22 LEU 40 1HD2 LEU 40 -7.109 3.622 1.556 297 HD23 LEU 40 2HD2 LEU 40 -6.564 3.837 -0.108 298 H LEU 41 H LEU 41 -5.056 0.304 -0.525 299 HA LEU 41 HA LEU 41 -3.316 0.948 1.744 300 HB2 LEU 41 1HB LEU 41 -1.631 -0.712 0.401 301 HB3 LEU 41 2HB LEU 41 -2.612 -1.248 1.753 302 HG LEU 41 HG LEU 41 -4.363 -2.019 0.197 303 HD11 LEU 41 1HD1 LEU 41 -3.533 -2.174 -2.283 304 HD12 LEU 41 2HD1 LEU 41 -2.460 -0.850 -1.833 305 HD13 LEU 41 3HD1 LEU 41 -4.205 -0.649 -1.715 306 HD21 LEU 41 3HD2 LEU 41 -2.784 -3.689 0.835 307 HD22 LEU 41 1HD2 LEU 41 -1.535 -3.011 -0.211 308 HD23 LEU 41 2HD2 LEU 41 -2.927 -3.831 -0.917 309 H GLY 42 H GLY 42 -1.471 2.169 1.134 310 HA2 GLY 42 1HA GLY 42 -1.176 2.746 -1.729 311 HA3 GLY 42 2HA GLY 42 -1.490 4.095 -0.627 312 H LEU 43 H LEU 43 0.561 4.927 -1.338 313 HA LEU 43 HA LEU 43 2.807 3.801 0.202 314 HB2 LEU 43 1HB LEU 43 3.167 3.034 -2.080 315 HB3 LEU 43 2HB LEU 43 2.929 4.665 -2.703 316 HG LEU 43 HG LEU 43 4.917 5.423 -1.442 317 HD11 LEU 43 1HD1 LEU 43 4.928 2.533 -0.559 318 HD12 LEU 43 2HD1 LEU 43 5.087 3.979 0.435 319 HD13 LEU 43 3HD1 LEU 43 6.422 3.474 -0.588 320 HD21 LEU 43 3HD2 LEU 43 6.541 4.443 -2.898 321 HD22 LEU 43 1HD2 LEU 43 5.020 4.477 -3.792 322 HD23 LEU 43 2HD2 LEU 43 5.585 2.970 -3.071 323 H VAL 44 H VAL 44 4.191 5.356 1.076 324 HA VAL 44 HA VAL 44 3.580 8.194 0.492 325 HB VAL 44 HB VAL 44 3.717 8.614 2.971 326 HG11 VAL 44 1HG1 VAL 44 1.481 6.804 2.008 327 HG12 VAL 44 2HG1 VAL 44 1.589 8.533 1.678 328 HG13 VAL 44 3HG1 VAL 44 1.382 7.964 3.334 329 HG21 VAL 44 3HG2 VAL 44 3.269 5.615 3.087 330 HG22 VAL 44 1HG2 VAL 44 3.334 6.723 4.454 331 HG23 VAL 44 2HG2 VAL 44 4.785 6.410 3.509 332 H ARG 45 H ARG 45 5.239 9.539 0.514 333 HA ARG 45 HA ARG 45 7.918 8.461 1.205 334 HB2 ARG 45 1HB ARG 45 7.614 9.045 -1.191 335 HB3 ARG 45 2HB ARG 45 7.206 10.694 -0.720 336 HG2 ARG 45 1HG ARG 45 9.422 10.934 0.356 337 HG3 ARG 45 2HG ARG 45 9.831 9.288 -0.126 338 HD2 ARG 45 1HD ARG 45 9.421 9.972 -2.514 339 HD3 ARG 45 2HD ARG 45 9.231 11.629 -1.949 340 HE ARG 45 HE ARG 45 11.708 10.427 -1.092 341 HH11 ARG 45 1HH2 ARG 45 10.022 12.049 -3.643 342 HH12 ARG 45 2HH2 ARG 45 11.459 12.684 -4.375 343 HH21 ARG 45 1HH1 ARG 45 13.593 11.251 -2.049 344 HH22 ARG 45 2HH1 ARG 45 13.481 12.231 -3.472 345 H TYR 46 H TYR 46 8.942 9.409 2.825 346 HA TYR 46 HA TYR 46 7.998 12.053 3.803 347 HB2 TYR 46 1HB TYR 46 7.283 10.158 5.242 348 HB3 TYR 46 2HB TYR 46 8.973 9.694 5.438 349 HD1 TYR 46 HD1 TYR 46 6.434 12.275 6.186 350 HD2 TYR 46 HD2 TYR 46 10.470 10.962 6.825 351 HE1 TYR 46 HE1 TYR 46 6.669 13.906 8.039 352 HE2 TYR 46 HE2 TYR 46 10.711 12.591 8.674 353 HH TYR 46 HH TYR 46 8.164 14.066 10.163 354 H ARG 47 H ARG 47 9.569 13.566 4.073 355 HA ARG 47 HA ARG 47 12.323 12.792 3.406 356 HB2 ARG 47 1HB ARG 47 12.721 15.181 3.122 357 HB3 ARG 47 2HB ARG 47 11.292 14.695 2.212 358 HG2 ARG 47 1HG ARG 47 9.855 15.497 4.071 359 HG3 ARG 47 2HG ARG 47 11.295 16.030 4.938 360 HD2 ARG 47 1HD ARG 47 11.865 17.514 3.021 361 HD3 ARG 47 2HD ARG 47 10.367 17.030 2.232 362 HE ARG 47 HE ARG 47 9.975 18.062 4.902 363 HH11 ARG 47 1HH2 ARG 47 10.367 18.822 1.545 364 HH12 ARG 47 2HH2 ARG 47 9.524 20.331 1.650 365 HH21 ARG 47 1HH1 ARG 47 8.875 20.039 5.043 366 HH22 ARG 47 2HH1 ARG 47 8.678 21.019 3.629 367 H LEU 48 H LEU 48 14.062 13.046 4.726 368 HA LEU 48 HA LEU 48 13.490 13.487 7.587 369 HB2 LEU 48 1HB LEU 48 15.954 12.354 6.236 370 HB3 LEU 48 2HB LEU 48 15.682 12.451 7.972 371 HG LEU 48 HG LEU 48 13.906 10.928 6.043 372 HD11 LEU 48 1HD1 LEU 48 14.962 8.927 7.236 373 HD12 LEU 48 2HD1 LEU 48 16.179 10.051 7.842 374 HD13 LEU 48 3HD1 LEU 48 16.007 9.788 6.107 375 HD21 LEU 48 3HD2 LEU 48 13.272 9.852 8.364 376 HD22 LEU 48 1HD2 LEU 48 12.559 11.395 7.907 377 HD23 LEU 48 2HD2 LEU 48 13.918 11.349 9.031 378 H GLU 49 H GLU 49 14.318 15.136 8.705 379 HA GLU 49 HA GLU 49 15.146 17.495 7.501 380 HB2 GLU 49 1HB GLU 49 15.692 16.467 10.295 381 HB3 GLU 49 2HB GLU 49 15.951 18.134 9.780 382 HG2 GLU 49 1HG GLU 49 13.296 16.684 9.595 383 HG3 GLU 49 2HG GLU 49 13.739 17.780 10.902 384 H ASN 50 H ASN 50 16.893 14.620 7.940 385 HA ASN 50 HA ASN 50 19.525 15.833 8.034 386 HB2 ASN 50 1HB ASN 50 18.622 12.971 7.623 387 HB3 ASN 50 2HB ASN 50 20.301 13.478 7.799 388 HD21 ASN 50 2HD2 ASN 50 18.377 11.844 9.617 389 HD22 ASN 50 1HD2 ASN 50 18.545 12.591 11.132 390 H ASP 51 H ASP 51 17.276 15.588 5.672 391 HA ASP 51 HA ASP 51 17.468 16.153 3.426 392 HB2 ASP 51 1HB ASP 51 20.356 15.275 3.343 393 HB3 ASP 51 2HB ASP 51 19.515 16.441 2.329 394 H ALA 52 H ALA 52 18.203 13.336 5.062 395 HA ALA 52 HA ALA 52 18.491 11.528 2.853 396 HB1 ALA 52 3HB ALA 52 19.423 10.813 4.908 397 HB2 ALA 52 1HB ALA 52 17.991 9.808 4.681 398 HB3 ALA 52 2HB ALA 52 17.941 11.176 5.796 399 H GLN 53 H GLN 53 16.985 10.116 2.003 400 HA GLN 53 HA GLN 53 14.135 10.817 2.454 401 HB2 GLN 53 1HB GLN 53 15.521 9.668 0.018 402 HB3 GLN 53 2HB GLN 53 13.788 9.964 0.152 403 HG2 GLN 53 1HG GLN 53 15.914 12.096 0.486 404 HG3 GLN 53 2HG GLN 53 15.016 11.816 -1.005 405 HE21 GLN 53 2HE2 GLN 53 15.028 13.849 1.581 406 HE22 GLN 53 1HE2 GLN 53 13.369 14.189 1.697 407 H GLU 54 H GLU 54 12.595 9.149 2.554 408 HA GLU 54 HA GLU 54 13.441 6.383 2.460 409 HB2 GLU 54 1HB GLU 54 13.972 7.314 4.834 410 HB3 GLU 54 2HB GLU 54 12.225 7.299 5.065 411 HG2 GLU 54 1HG GLU 54 13.095 5.196 5.880 412 HG3 GLU 54 2HG GLU 54 12.234 4.869 4.380 413 H HIS 55 H HIS 55 11.620 4.908 2.660 414 HA HIS 55 HA HIS 55 8.968 6.167 2.218 415 HB2 HIS 55 1HB HIS 55 10.230 3.955 0.585 416 HB3 HIS 55 2HB HIS 55 8.560 4.503 0.429 417 HD2 HIS 55 HD2 HIS 55 8.243 6.721 -1.216 418 HE1 HIS 55 HE1 HIS 55 12.329 7.705 -1.619 419 HE2 HIS 55 HE2 HIS 55 9.982 8.255 -2.417 420 H ALA 56 H ALA 56 7.168 4.755 2.631 421 HA ALA 56 HA ALA 56 7.647 2.195 3.908 422 HB1 ALA 56 3HB ALA 56 6.312 4.471 5.390 423 HB2 ALA 56 1HB ALA 56 7.906 3.819 5.758 424 HB3 ALA 56 2HB ALA 56 6.473 2.812 5.967 425 H LEU 57 H LEU 57 5.833 0.878 3.809 426 HA LEU 57 HA LEU 57 3.729 1.818 2.008 427 HB2 LEU 57 1HB LEU 57 4.970 -0.496 1.939 428 HB3 LEU 57 2HB LEU 57 3.830 -0.951 3.194 429 HG LEU 57 HG LEU 57 2.708 0.342 0.716 430 HD11 LEU 57 1HD1 LEU 57 4.295 -1.314 -0.169 431 HD12 LEU 57 2HD1 LEU 57 2.628 -1.835 -0.428 432 HD13 LEU 57 3HD1 LEU 57 3.586 -2.550 0.870 433 HD21 LEU 57 3HD2 LEU 57 0.774 -0.890 1.260 434 HD22 LEU 57 1HD2 LEU 57 1.421 -0.468 2.841 435 HD23 LEU 57 2HD2 LEU 57 1.679 -2.080 2.195 436 H PHE 58 H PHE 58 1.610 2.021 2.522 437 HA PHE 58 HA PHE 58 0.911 1.826 5.405 438 HB2 PHE 58 1HB PHE 58 0.507 3.990 3.384 439 HB3 PHE 58 2HB PHE 58 -0.782 3.731 4.550 440 HD1 PHE 58 HD1 PHE 58 2.989 3.770 4.648 441 HD2 PHE 58 HD2 PHE 58 -0.681 5.144 6.396 442 HE1 PHE 58 HE1 PHE 58 4.268 4.993 6.373 443 HE2 PHE 58 HE2 PHE 58 0.604 6.388 8.107 444 HZ PHE 58 HZ PHE 58 3.080 6.304 8.103 445 H LEU 59 H LEU 59 -0.846 0.757 5.942 446 HA LEU 59 HA LEU 59 -2.658 -0.221 3.811 447 HB2 LEU 59 1HB LEU 59 -1.531 -1.516 6.237 448 HB3 LEU 59 2HB LEU 59 -3.232 -1.842 5.932 449 HG LEU 59 HG LEU 59 -2.667 -2.591 3.646 450 HD11 LEU 59 1HD1 LEU 59 0.123 -1.905 4.565 451 HD12 LEU 59 2HD1 LEU 59 -0.714 -1.361 3.111 452 HD13 LEU 59 3HD1 LEU 59 -0.173 -3.036 3.245 453 HD21 LEU 59 3HD2 LEU 59 -1.274 -3.876 5.997 454 HD22 LEU 59 1HD2 LEU 59 -1.277 -4.622 4.398 455 HD23 LEU 59 2HD2 LEU 59 -2.799 -4.337 5.239 456 H TYR 60 H TYR 60 -4.564 0.588 3.789 457 HA TYR 60 HA TYR 60 -5.643 1.989 6.188 458 HB2 TYR 60 1HB TYR 60 -6.038 2.416 3.221 459 HB3 TYR 60 2HB TYR 60 -6.916 3.261 4.462 460 HD1 TYR 60 HD1 TYR 60 -5.637 4.697 6.134 461 HD2 TYR 60 HD2 TYR 60 -3.876 3.112 2.549 462 HE1 TYR 60 HE1 TYR 60 -3.821 6.383 6.277 463 HE2 TYR 60 HE2 TYR 60 -2.059 4.787 2.698 464 HH TYR 60 HH TYR 60 -1.008 6.150 4.864 465 H THR 61 H THR 61 -7.466 1.048 7.049 466 HA THR 61 HA THR 61 -8.764 -1.086 5.519 467 HB THR 61 HB THR 61 -8.419 -1.398 7.964 468 HG1 THR 61 HG1 THR 61 -10.750 -1.810 8.353 469 HG21 THR 61 3HG2 THR 61 -9.599 -0.060 9.564 470 HG22 THR 61 1HG2 THR 61 -10.510 0.761 8.297 471 HG23 THR 61 2HG2 THR 61 -8.784 1.070 8.481 472 H HIS 62 H HIS 62 -11.121 -1.044 5.252 473 HA HIS 62 HA HIS 62 -12.427 1.536 5.375 474 HB2 HIS 62 1HB HIS 62 -12.778 1.863 3.044 475 HB3 HIS 62 2HB HIS 62 -11.066 1.524 3.219 476 HD2 HIS 62 HD2 HIS 62 -10.255 -1.053 2.300 477 HE1 HIS 62 HE1 HIS 62 -13.875 -1.872 0.296 478 HE2 HIS 62 HE2 HIS 62 -11.473 -2.638 0.625 479 H ARG 63 H ARG 63 -14.685 1.409 4.683 480 HA ARG 63 HA ARG 63 -15.826 -1.085 5.619 481 HB2 ARG 63 1HB ARG 63 -17.084 1.531 4.782 482 HB3 ARG 63 2HB ARG 63 -18.000 0.129 5.323 483 HG2 ARG 63 1HG ARG 63 -16.768 0.131 7.458 484 HG3 ARG 63 2HG ARG 63 -15.846 1.537 6.930 485 HD2 ARG 63 1HD ARG 63 -17.917 2.856 6.782 486 HD3 ARG 63 2HD ARG 63 -18.858 1.448 7.267 487 HE ARG 63 HE ARG 63 -16.793 2.106 9.163 488 HH11 ARG 63 1HH2 ARG 63 -19.992 2.839 8.054 489 HH12 ARG 63 2HH2 ARG 63 -20.530 3.444 9.585 490 HH21 ARG 63 1HH1 ARG 63 -17.499 2.889 11.171 491 HH22 ARG 63 2HH1 ARG 63 -19.120 3.472 11.348 492 H ARG 64 H ARG 64 -18.120 -1.353 4.271 493 HA ARG 64 HA ARG 64 -17.226 -2.562 1.813 494 HB2 ARG 64 1HB ARG 64 -18.903 -3.624 3.311 495 HB3 ARG 64 2HB ARG 64 -20.019 -2.306 2.956 496 HG2 ARG 64 1HG ARG 64 -20.078 -2.902 0.611 497 HG3 ARG 64 2HG ARG 64 -18.809 -4.105 0.839 498 HD2 ARG 64 1HD ARG 64 -21.494 -4.195 2.234 499 HD3 ARG 64 2HD ARG 64 -21.125 -5.078 0.755 500 HE ARG 64 HE ARG 64 -19.140 -5.722 2.615 501 HH11 ARG 64 1HH2 ARG 64 -22.566 -6.013 2.212 502 HH12 ARG 64 2HH2 ARG 64 -22.686 -7.475 3.130 503 HH21 ARG 64 1HH1 ARG 64 -19.292 -7.640 3.818 504 HH22 ARG 64 2HH1 ARG 64 -20.835 -8.397 4.039 505 H MET 65 H MET 65 -18.530 0.522 2.712 506 HA MET 65 HA MET 65 -18.824 1.202 -0.141 507 HB2 MET 65 1HB MET 65 -20.894 2.585 0.699 508 HB3 MET 65 2HB MET 65 -21.088 0.870 0.353 509 HG2 MET 65 1HG MET 65 -20.829 0.319 2.724 510 HG3 MET 65 2HG MET 65 -20.519 2.013 3.107 511 HE1 MET 65 3HE MET 65 -24.026 1.307 4.647 512 HE2 MET 65 1HE MET 65 -22.398 1.938 4.931 513 HE3 MET 65 2HE MET 65 -22.631 0.236 4.538 514 H ALA 66 H ALA 66 -16.808 1.750 2.011 515 HA ALA 66 HA ALA 66 -17.155 4.491 2.781 516 HB1 ALA 66 3HB ALA 66 -15.032 2.411 3.115 517 HB2 ALA 66 1HB ALA 66 -15.826 3.400 4.338 518 HB3 ALA 66 2HB ALA 66 -14.570 4.101 3.326 519 H ILE 67 H ILE 67 -17.209 3.730 -0.099 520 HA ILE 67 HA ILE 67 -15.500 4.099 -1.908 521 HB ILE 67 HB ILE 67 -17.602 6.221 -1.445 522 HG12 ILE 67 1HG1 ILE 67 -17.715 3.737 -3.185 523 HG13 ILE 67 2HG1 ILE 67 -18.355 3.792 -1.542 524 HG21 ILE 67 1HG2 ILE 67 -16.067 7.023 -3.112 525 HG22 ILE 67 2HG2 ILE 67 -17.474 6.403 -3.965 526 HG23 ILE 67 3HG2 ILE 67 -15.999 5.441 -3.888 527 HD11 ILE 67 3HD1 ILE 67 -19.742 5.799 -2.265 528 HD12 ILE 67 1HD1 ILE 67 -20.199 4.268 -3.013 529 HD13 ILE 67 2HD1 ILE 67 -19.248 5.443 -3.921 530 H THR 68 H THR 68 -16.124 6.931 0.189 531 HA THR 68 HA THR 68 -13.823 8.285 -0.897 532 HB THR 68 HB THR 68 -15.789 9.579 -0.486 533 HG1 THR 68 HG1 THR 68 -13.617 10.374 0.213 534 HG21 THR 68 3HG2 THR 68 -16.636 9.784 1.911 535 HG22 THR 68 1HG2 THR 68 -15.652 8.366 2.272 536 HG23 THR 68 2HG2 THR 68 -16.958 8.254 1.096 537 H GLY 69 H GLY 69 -13.306 9.642 1.749 538 HA2 GLY 69 1HA GLY 69 -11.604 7.549 2.980 539 HA3 GLY 69 2HA GLY 69 -11.155 9.248 2.824 540 H ASP 70 H ASP 70 -14.435 8.704 3.508 541 HA ASP 70 HA ASP 70 -14.408 10.172 5.896 542 HB2 ASP 70 1HB ASP 70 -16.386 9.926 4.456 543 HB3 ASP 70 2HB ASP 70 -16.494 8.225 4.903 544 H ASP 71 H ASP 71 -14.910 6.592 5.506 545 HA ASP 71 HA ASP 71 -14.331 6.363 8.419 546 HB2 ASP 71 1HB ASP 71 -15.680 4.529 6.477 547 HB3 ASP 71 2HB ASP 71 -15.372 4.085 8.148 548 H VAL 72 H VAL 72 -12.450 6.380 5.873 549 HA VAL 72 HA VAL 72 -10.994 3.883 6.501 550 HB VAL 72 HB VAL 72 -10.429 5.933 4.368 551 HG11 VAL 72 1HG1 VAL 72 -8.661 4.632 3.787 552 HG12 VAL 72 2HG1 VAL 72 -9.607 3.158 3.889 553 HG13 VAL 72 3HG1 VAL 72 -8.872 3.817 5.339 554 HG21 VAL 72 3HG2 VAL 72 -12.487 5.190 3.618 555 HG22 VAL 72 1HG2 VAL 72 -12.386 3.664 4.492 556 HG23 VAL 72 2HG2 VAL 72 -11.500 3.877 2.987 557 H SER 73 H SER 73 -9.472 4.015 8.102 558 HA SER 73 HA SER 73 -7.720 6.381 8.201 559 HB2 SER 73 1HB SER 73 -9.141 5.045 10.521 560 HB3 SER 73 2HB SER 73 -7.828 6.204 10.702 561 HG SER 73 HG SER 73 -10.113 6.791 9.151 562 H LEU 74 H LEU 74 -5.642 5.881 9.177 563 HA LEU 74 HA LEU 74 -4.440 3.668 8.177 564 HB2 LEU 74 1HB LEU 74 -3.177 5.555 9.031 565 HB3 LEU 74 2HB LEU 74 -3.622 5.140 10.682 566 HG LEU 74 HG LEU 74 -2.418 3.004 10.493 567 HD11 LEU 74 1HD1 LEU 74 -2.180 3.864 7.629 568 HD12 LEU 74 2HD1 LEU 74 -2.550 2.283 8.304 569 HD13 LEU 74 3HD1 LEU 74 -0.899 2.875 8.332 570 HD21 LEU 74 3HD2 LEU 74 -0.279 4.732 9.442 571 HD22 LEU 74 1HD2 LEU 74 -0.448 3.979 11.023 572 HD23 LEU 74 2HD2 LEU 74 -1.241 5.516 10.694 573 H ASP 75 H ASP 75 -4.183 1.643 8.568 574 HA ASP 75 HA ASP 75 -5.390 0.414 10.963 575 HB2 ASP 75 1HB ASP 75 -6.163 -0.373 8.729 576 HB3 ASP 75 2HB ASP 75 -4.516 -0.884 8.368 577 H GLN 76 H GLN 76 -2.480 0.011 8.858 578 HA GLN 76 HA GLN 76 -0.707 -0.108 11.096 579 HB2 GLN 76 1HB GLN 76 -1.719 -2.399 11.208 580 HB3 GLN 76 2HB GLN 76 -1.109 -2.704 9.581 581 HG2 GLN 76 1HG GLN 76 1.212 -2.111 10.461 582 HG3 GLN 76 2HG GLN 76 0.512 -2.117 12.075 583 HE21 GLN 76 2HE2 GLN 76 2.155 -4.047 9.908 584 HE22 GLN 76 1HE2 GLN 76 1.685 -5.563 10.496 585 H ILE 77 H ILE 77 1.226 0.533 10.451 586 HA ILE 77 HA ILE 77 1.762 0.973 7.631 587 HB ILE 77 HB ILE 77 3.357 1.583 10.134 588 HG12 ILE 77 1HG1 ILE 77 1.818 3.441 8.300 589 HG13 ILE 77 2HG1 ILE 77 1.158 2.783 9.791 590 HG21 ILE 77 1HG2 ILE 77 4.422 3.246 8.317 591 HG22 ILE 77 2HG2 ILE 77 3.919 1.977 7.203 592 HG23 ILE 77 3HG2 ILE 77 5.036 1.609 8.521 593 HD11 ILE 77 3HD1 ILE 77 3.041 3.801 11.062 594 HD12 ILE 77 1HD1 ILE 77 2.102 5.021 10.201 595 HD13 ILE 77 2HD1 ILE 77 3.658 4.496 9.563 596 H VAL 78 H VAL 78 2.963 -0.282 6.360 597 HA VAL 78 HA VAL 78 4.564 -2.455 7.582 598 HB VAL 78 HB VAL 78 3.148 -2.339 4.913 599 HG11 VAL 78 1HG1 VAL 78 4.037 -4.757 4.784 600 HG12 VAL 78 2HG1 VAL 78 5.177 -4.278 6.039 601 HG13 VAL 78 3HG1 VAL 78 5.206 -3.471 4.472 602 HG21 VAL 78 3HG2 VAL 78 2.075 -4.432 5.908 603 HG22 VAL 78 1HG2 VAL 78 1.630 -2.910 6.685 604 HG23 VAL 78 2HG2 VAL 78 2.816 -3.974 7.441 605 HA PRO 79 HA PRO 79 7.541 0.381 5.550 606 HB2 PRO 79 1HB PRO 79 9.648 0.011 7.202 607 HB3 PRO 79 2HB PRO 79 8.262 1.023 7.655 608 HG2 PRO 79 1HG PRO 79 8.871 -1.800 8.425 609 HG3 PRO 79 2HG PRO 79 8.277 -0.468 9.434 610 HD2 PRO 79 1HD PRO 79 6.644 -2.417 8.389 611 HD3 PRO 79 2HD PRO 79 6.070 -0.775 8.770 612 H LEU 80 H LEU 80 9.292 0.087 4.198 613 HA LEU 80 HA LEU 80 9.585 -2.552 3.158 614 HB2 LEU 80 1HB LEU 80 10.677 0.169 2.483 615 HB3 LEU 80 2HB LEU 80 11.382 -1.265 1.730 616 HG LEU 80 HG LEU 80 9.181 -1.937 0.895 617 HD11 LEU 80 1HD1 LEU 80 7.303 -0.220 1.139 618 HD12 LEU 80 2HD1 LEU 80 8.281 0.527 2.401 619 HD13 LEU 80 3HD1 LEU 80 7.705 -1.128 2.595 620 HD21 LEU 80 3HD2 LEU 80 9.044 -0.358 -0.841 621 HD22 LEU 80 1HD2 LEU 80 10.699 -0.161 -0.273 622 HD23 LEU 80 2HD2 LEU 80 9.458 0.991 0.217 623 H SER 81 H SER 81 10.957 -4.010 3.665 624 HA SER 81 HA SER 81 13.324 -3.351 5.331 625 HB2 SER 81 1HB SER 81 13.125 -5.430 6.369 626 HB3 SER 81 2HB SER 81 11.441 -4.957 6.144 627 HG SER 81 HG SER 81 12.797 -6.385 4.134 628 H LYS 82 H LYS 82 15.306 -4.515 4.906 629 HA LYS 82 HA LYS 82 16.149 -4.479 2.287 630 HB2 LYS 82 1HB LYS 82 18.066 -5.805 3.030 631 HB3 LYS 82 2HB LYS 82 17.656 -4.598 4.248 632 HG2 LYS 82 1HG LYS 82 16.341 -6.341 5.464 633 HG3 LYS 82 2HG LYS 82 16.911 -7.537 4.297 634 HD2 LYS 82 1HD LYS 82 19.240 -7.049 4.919 635 HD3 LYS 82 2HD LYS 82 18.686 -5.832 6.069 636 HE2 LYS 82 1HE LYS 82 19.019 -7.735 7.412 637 HE3 LYS 82 2HE LYS 82 17.282 -7.755 7.106 638 HZ1 LYS 82 3HZ LYS 82 17.992 -9.169 5.060 639 HZ2 LYS 82 1HZ LYS 82 17.870 -9.897 6.587 640 HZ3 LYS 82 2HZ LYS 82 19.392 -9.462 5.974 641 H ASP 83 H ASP 83 14.576 -7.098 4.053 642 HA ASP 83 HA ASP 83 14.965 -8.996 1.880 643 HB2 ASP 83 1HB ASP 83 13.409 -9.151 4.472 644 HB3 ASP 83 2HB ASP 83 13.535 -10.476 3.315 645 H PHE 84 H PHE 84 13.159 -6.368 1.993 646 HA PHE 84 HA PHE 84 10.516 -7.214 1.363 647 HB2 PHE 84 1HB PHE 84 11.081 -4.913 2.083 648 HB3 PHE 84 2HB PHE 84 11.962 -4.666 0.578 649 HD1 PHE 84 HD2 PHE 84 10.663 -4.831 -1.628 650 HD2 PHE 84 HD1 PHE 84 8.739 -4.623 2.204 651 HE1 PHE 84 HE2 PHE 84 8.554 -4.117 -2.718 652 HE2 PHE 84 HE1 PHE 84 6.633 -3.911 1.112 653 HZ PHE 84 HZ PHE 84 6.542 -3.656 -1.353 654 H MET 85 H MET 85 9.572 -7.651 -0.601 655 HA MET 85 HA MET 85 10.835 -7.206 -3.105 656 HB2 MET 85 1HB MET 85 12.265 -9.093 -2.339 657 HB3 MET 85 2HB MET 85 10.818 -10.088 -2.171 658 HG2 MET 85 1HG MET 85 10.336 -9.846 -4.565 659 HG3 MET 85 2HG MET 85 11.720 -8.771 -4.756 660 HE1 MET 85 3HE MET 85 11.380 -10.678 -6.594 661 HE2 MET 85 1HE MET 85 12.408 -12.119 -6.604 662 HE3 MET 85 2HE MET 85 13.131 -10.514 -6.679 663 H LEU 86 H LEU 86 9.448 -7.729 -4.850 664 HA LEU 86 HA LEU 86 6.700 -8.472 -4.009 665 HB2 LEU 86 1HB LEU 86 7.397 -7.090 -6.590 666 HB3 LEU 86 2HB LEU 86 5.880 -7.087 -5.701 667 HG LEU 86 HG LEU 86 7.454 -5.937 -3.815 668 HD11 LEU 86 1HD1 LEU 86 9.510 -5.940 -5.100 669 HD12 LEU 86 2HD1 LEU 86 8.938 -4.278 -5.001 670 HD13 LEU 86 3HD1 LEU 86 8.703 -5.199 -6.480 671 HD21 LEU 86 3HD2 LEU 86 6.122 -4.588 -6.180 672 HD22 LEU 86 1HD2 LEU 86 6.714 -3.708 -4.770 673 HD23 LEU 86 2HD2 LEU 86 5.423 -4.895 -4.591 674 H GLU 87 H GLU 87 5.954 -10.402 -4.707 675 HA GLU 87 HA GLU 87 7.398 -11.733 -6.926 676 HB2 GLU 87 1HB GLU 87 5.869 -12.863 -4.577 677 HB3 GLU 87 2HB GLU 87 6.438 -13.830 -5.936 678 HG2 GLU 87 1HG GLU 87 8.751 -13.150 -5.488 679 HG3 GLU 87 2HG GLU 87 8.210 -12.125 -4.161 680 H GLU 88 H GLU 88 6.376 -11.889 -8.754 681 HA GLU 88 HA GLU 88 3.548 -11.317 -8.988 682 HB2 GLU 88 1HB GLU 88 5.577 -12.257 -11.035 683 HB3 GLU 88 2HB GLU 88 3.923 -11.770 -11.407 684 HG2 GLU 88 1HG GLU 88 5.986 -9.996 -10.068 685 HG3 GLU 88 2HG GLU 88 5.566 -9.932 -11.779 686 H VAL 89 H VAL 89 1.937 -12.807 -9.681 687 HA VAL 89 HA VAL 89 2.662 -15.675 -9.331 688 HB VAL 89 HB VAL 89 1.347 -14.998 -7.449 689 HG11 VAL 89 1HG1 VAL 89 -0.627 -13.933 -9.473 690 HG12 VAL 89 2HG1 VAL 89 0.365 -12.964 -8.382 691 HG13 VAL 89 3HG1 VAL 89 -0.894 -14.014 -7.731 692 HG21 VAL 89 3HG2 VAL 89 -0.594 -16.343 -9.328 693 HG22 VAL 89 1HG2 VAL 89 -0.410 -16.595 -7.591 694 HG23 VAL 89 2HG2 VAL 89 0.828 -17.178 -8.704 695 H SER 90 H SER 90 1.775 -17.138 -10.664 696 HA SER 90 HA SER 90 1.376 -16.521 -13.299 697 HB2 SER 90 1HB SER 90 1.788 -18.802 -12.526 698 HB3 SER 90 2HB SER 90 0.183 -18.854 -11.799 699 HG SER 90 HG SER 90 0.416 -18.145 -14.495 700 HA PRO 91 HA PRO 91 -2.735 -14.641 -12.971 701 HB2 PRO 91 1HB PRO 91 -3.127 -14.026 -15.609 702 HB3 PRO 91 2HB PRO 91 -2.061 -13.087 -14.545 703 HG2 PRO 91 1HG PRO 91 -1.359 -15.169 -16.565 704 HG3 PRO 91 2HG PRO 91 -0.545 -13.640 -16.194 705 HD2 PRO 91 1HD PRO 91 0.334 -16.076 -15.276 706 HD3 PRO 91 2HD PRO 91 0.637 -14.547 -14.414 707 H ASP 92 H ASP 92 -1.935 -17.352 -15.009 708 HA ASP 92 HA ASP 92 -3.166 -19.127 -15.782 709 HB2 ASP 92 1HB ASP 92 -4.964 -18.249 -13.523 710 HB3 ASP 92 2HB ASP 92 -5.272 -19.683 -14.497 711 H GLY 93 H GLY 93 -5.835 -17.060 -14.871 712 HA2 GLY 93 1HA GLY 93 -7.750 -16.520 -16.122 713 HA3 GLY 93 2HA GLY 93 -6.525 -15.616 -17.001 714 H GLU 94 H GLU 94 -8.685 -18.304 -17.064 715 HA GLU 94 HA GLU 94 -7.587 -19.650 -19.323 716 HB2 GLU 94 1HB GLU 94 -9.701 -20.873 -19.372 717 HB3 GLU 94 2HB GLU 94 -9.097 -20.754 -17.721 718 HG2 GLU 94 1HG GLU 94 -10.585 -18.755 -17.392 719 HG3 GLU 94 2HG GLU 94 -11.272 -19.069 -18.986 720 H LEU 95 H LEU 95 -10.109 -17.192 -18.938 721 HA LEU 95 HA LEU 95 -9.773 -16.449 -21.749 722 HB2 LEU 95 1HB LEU 95 -11.677 -18.119 -21.633 723 HB3 LEU 95 2HB LEU 95 -12.521 -16.982 -20.588 724 HG LEU 95 HG LEU 95 -12.184 -15.243 -22.443 725 HD11 LEU 95 1HD1 LEU 95 -11.332 -17.758 -23.881 726 HD12 LEU 95 2HD1 LEU 95 -10.570 -16.169 -23.889 727 HD13 LEU 95 3HD1 LEU 95 -12.077 -16.422 -24.758 728 HD21 LEU 95 3HD2 LEU 95 -14.091 -16.279 -23.817 729 HD22 LEU 95 1HD2 LEU 95 -14.381 -16.104 -22.086 730 HD23 LEU 95 2HD2 LEU 95 -13.953 -17.680 -22.754 731 H TYR 96 H TYR 96 -8.683 -14.862 -20.144 732 HA TYR 96 HA TYR 96 -10.336 -12.519 -20.078 733 HB2 TYR 96 1HB TYR 96 -10.781 -13.992 -17.909 734 HB3 TYR 96 2HB TYR 96 -9.295 -13.230 -17.353 735 HD1 TYR 96 HD2 TYR 96 -12.476 -12.298 -19.120 736 HD2 TYR 96 HD1 TYR 96 -9.512 -11.181 -16.219 737 HE1 TYR 96 HE2 TYR 96 -13.762 -10.246 -18.601 738 HE2 TYR 96 HE1 TYR 96 -10.804 -9.128 -15.702 739 HH TYR 96 HH TYR 96 -12.635 -7.955 -16.109 740 H ILE 97 H ILE 97 -9.156 -10.593 -19.612 741 HA ILE 97 HA ILE 97 -6.204 -10.905 -19.577 742 HB ILE 97 HB ILE 97 -7.648 -8.674 -21.006 743 HG12 ILE 97 1HG1 ILE 97 -6.969 -10.248 -23.078 744 HG13 ILE 97 2HG1 ILE 97 -7.245 -11.515 -21.885 745 HG21 ILE 97 1HG2 ILE 97 -5.386 -8.135 -20.784 746 HG22 ILE 97 2HG2 ILE 97 -5.449 -8.880 -22.381 747 HG23 ILE 97 3HG2 ILE 97 -4.851 -9.801 -21.005 748 HD11 ILE 97 3HD1 ILE 97 -9.473 -10.078 -21.434 749 HD12 ILE 97 1HD1 ILE 97 -9.392 -11.287 -22.717 750 HD13 ILE 97 2HD1 ILE 97 -9.179 -9.580 -23.099 751 H LEU 98 H LEU 98 -6.775 -10.648 -17.211 752 HA LEU 98 HA LEU 98 -6.710 -9.390 -15.284 753 HB2 LEU 98 1HB LEU 98 -5.874 -7.120 -17.116 754 HB3 LEU 98 2HB LEU 98 -5.660 -7.197 -15.377 755 HG LEU 98 HG LEU 98 -3.542 -7.771 -16.276 756 HD11 LEU 98 1HD1 LEU 98 -4.745 -10.498 -15.817 757 HD12 LEU 98 2HD1 LEU 98 -4.508 -9.340 -14.502 758 HD13 LEU 98 3HD1 LEU 98 -3.126 -9.930 -15.421 759 HD21 LEU 98 3HD2 LEU 98 -4.614 -9.997 -18.000 760 HD22 LEU 98 1HD2 LEU 98 -3.099 -9.113 -18.130 761 HD23 LEU 98 2HD2 LEU 98 -4.602 -8.342 -18.605 762 H GLY 99 H GLY 99 -7.993 -7.395 -17.931 763 HA2 GLY 99 1HA GLY 99 -9.840 -5.997 -18.009 764 HA3 GLY 99 2HA GLY 99 -10.638 -7.372 -17.248 765 H SER 100 H SER 100 -8.073 -5.365 -15.923 766 HA SER 100 HA SER 100 -8.086 -3.808 -14.222 767 HB2 SER 100 1HB SER 100 -10.996 -4.202 -13.645 768 HB3 SER 100 2HB SER 100 -10.024 -2.738 -13.557 769 HG SER 100 HG SER 100 -11.571 -3.235 -15.466 770 H ASP 101 H ASP 101 -7.415 -6.499 -13.957 771 HA ASP 101 HA ASP 101 -7.888 -6.882 -11.082 772 HB2 ASP 101 1HB ASP 101 -8.131 -9.159 -13.052 773 HB3 ASP 101 2HB ASP 101 -8.413 -9.212 -11.316 774 H VAL 102 H VAL 102 -5.682 -6.116 -10.979 775 HA VAL 102 HA VAL 102 -3.598 -7.700 -12.276 776 HB VAL 102 HB VAL 102 -3.439 -5.359 -10.369 777 HG11 VAL 102 1HG1 VAL 102 -1.054 -5.268 -11.172 778 HG12 VAL 102 2HG1 VAL 102 -1.300 -6.855 -11.904 779 HG13 VAL 102 3HG1 VAL 102 -1.414 -6.661 -10.156 780 HG21 VAL 102 3HG2 VAL 102 -4.391 -4.809 -12.549 781 HG22 VAL 102 1HG2 VAL 102 -3.046 -5.611 -13.358 782 HG23 VAL 102 2HG2 VAL 102 -2.757 -4.147 -12.414 783 H THR 103 H THR 103 -2.145 -8.981 -11.232 784 HA THR 103 HA THR 103 -2.839 -9.718 -8.420 785 HB THR 103 HB THR 103 -1.432 -11.746 -10.127 786 HG1 THR 103 HG1 THR 103 -2.916 -11.518 -11.603 787 HG21 THR 103 3HG2 THR 103 -2.800 -13.272 -8.848 788 HG22 THR 103 1HG2 THR 103 -3.826 -11.959 -8.277 789 HG23 THR 103 2HG2 THR 103 -2.159 -12.072 -7.722 790 H VAL 104 H VAL 104 -1.380 -9.183 -7.018 791 HA VAL 104 HA VAL 104 1.485 -9.471 -7.643 792 HB VAL 104 HB VAL 104 0.681 -7.062 -7.917 793 HG11 VAL 104 1HG1 VAL 104 0.100 -5.802 -5.986 794 HG12 VAL 104 2HG1 VAL 104 0.588 -7.100 -4.897 795 HG13 VAL 104 3HG1 VAL 104 -0.865 -7.274 -5.882 796 HG21 VAL 104 3HG2 VAL 104 2.749 -7.682 -5.784 797 HG22 VAL 104 1HG2 VAL 104 2.623 -6.164 -6.675 798 HG23 VAL 104 2HG2 VAL 104 3.039 -7.653 -7.524 799 H GLN 105 H GLN 105 2.683 -10.217 -5.937 800 HA GLN 105 HA GLN 105 1.233 -10.722 -3.390 801 HB2 GLN 105 1HB GLN 105 1.841 -12.698 -4.993 802 HB3 GLN 105 2HB GLN 105 3.489 -12.442 -4.423 803 HG2 GLN 105 1HG GLN 105 1.102 -12.922 -2.628 804 HG3 GLN 105 2HG GLN 105 2.282 -14.145 -3.074 805 HE21 GLN 105 2HE2 GLN 105 1.568 -11.796 -0.727 806 HE22 GLN 105 1HE2 GLN 105 3.110 -11.676 -0.027 807 H LEU 106 H LEU 106 2.060 -9.334 -1.841 808 HA LEU 106 HA LEU 106 4.732 -8.315 -2.047 809 HB2 LEU 106 1HB LEU 106 2.723 -8.119 0.209 810 HB3 LEU 106 2HB LEU 106 4.131 -7.088 -0.038 811 HG LEU 106 HG LEU 106 1.793 -7.323 -1.955 812 HD11 LEU 106 1HD1 LEU 106 1.006 -5.256 -1.099 813 HD12 LEU 106 2HD1 LEU 106 2.513 -4.942 -0.240 814 HD13 LEU 106 3HD1 LEU 106 1.414 -6.195 0.339 815 HD21 LEU 106 3HD2 LEU 106 3.633 -6.666 -3.268 816 HD22 LEU 106 1HD2 LEU 106 4.374 -5.754 -1.951 817 HD23 LEU 106 2HD2 LEU 106 2.955 -5.115 -2.779 818 H ASN 107 H ASN 107 6.460 -9.148 -1.199 819 HA ASN 107 HA ASN 107 6.221 -11.299 0.860 820 HB2 ASN 107 1HB ASN 107 8.574 -10.933 -0.972 821 HB3 ASN 107 2HB ASN 107 8.101 -12.357 -0.048 822 HD21 ASN 107 2HD2 ASN 107 6.795 -10.222 -2.638 823 HD22 ASN 107 1HD2 ASN 107 6.006 -11.476 -3.468 824 H THR 108 H THR 108 6.197 -9.387 2.437 825 HA THR 108 HA THR 108 8.670 -7.975 2.798 826 HB THR 108 HB THR 108 7.382 -7.770 5.224 827 HG1 THR 108 HG1 THR 108 5.163 -7.588 3.744 828 HG21 THR 108 3HG2 THR 108 7.942 -5.798 4.051 829 HG22 THR 108 1HG2 THR 108 6.179 -5.778 4.110 830 HG23 THR 108 2HG2 THR 108 7.004 -6.270 2.630 831 H ALA 109 H ALA 109 9.796 -8.107 4.932 832 HA ALA 109 HA ALA 109 11.223 -10.422 5.183 833 HB1 ALA 109 3HB ALA 109 11.834 -8.282 6.243 834 HB2 ALA 109 1HB ALA 109 11.923 -9.624 7.385 835 HB3 ALA 109 2HB ALA 109 10.553 -8.514 7.432 836 H GLU 110 H GLU 110 8.154 -9.652 6.767 837 HA GLU 110 HA GLU 110 7.958 -12.480 7.618 838 HB2 GLU 110 1HB GLU 110 6.791 -11.633 9.698 839 HB3 GLU 110 2HB GLU 110 8.530 -11.346 9.636 840 HG2 GLU 110 1HG GLU 110 8.128 -9.058 8.821 841 HG3 GLU 110 2HG GLU 110 6.392 -9.341 8.883 842 H LEU 111 H LEU 111 6.343 -9.455 6.768 843 HA LEU 111 HA LEU 111 3.719 -10.614 6.766 844 HB2 LEU 111 1HB LEU 111 4.906 -7.964 6.277 845 HB3 LEU 111 2HB LEU 111 3.542 -8.306 5.218 846 HG LEU 111 HG LEU 111 2.199 -8.900 7.267 847 HD11 LEU 111 1HD1 LEU 111 4.077 -9.435 8.766 848 HD12 LEU 111 2HD1 LEU 111 3.075 -8.156 9.453 849 HD13 LEU 111 3HD1 LEU 111 4.617 -7.755 8.695 850 HD21 LEU 111 3HD2 LEU 111 1.789 -6.743 6.431 851 HD22 LEU 111 1HD2 LEU 111 3.403 -6.167 6.848 852 HD23 LEU 111 2HD2 LEU 111 2.205 -6.429 8.116 853 H LYS 112 H LYS 112 2.472 -11.161 5.040 854 HA LYS 112 HA LYS 112 3.471 -11.139 2.367 855 HB2 LYS 112 1HB LYS 112 4.726 -13.078 3.288 856 HB3 LYS 112 2HB LYS 112 3.190 -13.845 3.694 857 HG2 LYS 112 1HG LYS 112 2.528 -13.822 1.333 858 HG3 LYS 112 2HG LYS 112 4.020 -12.984 0.905 859 HD2 LYS 112 1HD LYS 112 5.335 -14.899 1.745 860 HD3 LYS 112 2HD LYS 112 3.841 -15.744 2.151 861 HE2 LYS 112 1HE LYS 112 3.160 -15.672 -0.225 862 HE3 LYS 112 2HE LYS 112 4.666 -14.848 -0.625 863 HZ1 LYS 112 3HZ LYS 112 5.898 -16.745 0.181 864 HZ2 LYS 112 1HZ LYS 112 4.803 -17.237 -1.015 865 HZ3 LYS 112 2HZ LYS 112 4.460 -17.534 0.623 866 H LEU 113 H LEU 113 1.710 -10.399 1.480 867 HA LEU 113 HA LEU 113 -0.817 -11.907 1.852 868 HB2 LEU 113 1HB LEU 113 -0.471 -8.913 1.987 869 HB3 LEU 113 2HB LEU 113 -2.031 -9.706 1.816 870 HG LEU 113 HG LEU 113 -0.082 -10.198 4.075 871 HD11 LEU 113 1HD1 LEU 113 -2.558 -8.478 3.897 872 HD12 LEU 113 2HD1 LEU 113 -0.923 -7.973 4.332 873 HD13 LEU 113 3HD1 LEU 113 -1.851 -8.991 5.432 874 HD21 LEU 113 3HD2 LEU 113 -2.404 -11.098 5.057 875 HD22 LEU 113 1HD2 LEU 113 -1.363 -12.131 4.086 876 HD23 LEU 113 2HD2 LEU 113 -2.754 -11.343 3.346 877 H VAL 114 H VAL 114 -2.483 -11.139 0.210 878 HA VAL 114 HA VAL 114 -1.191 -10.655 -2.425 879 HB VAL 114 HB VAL 114 -3.647 -12.392 -2.195 880 HG11 VAL 114 1HG1 VAL 114 -1.290 -12.418 -4.111 881 HG12 VAL 114 2HG1 VAL 114 -2.802 -11.558 -4.397 882 HG13 VAL 114 3HG1 VAL 114 -2.799 -13.319 -4.283 883 HG21 VAL 114 3HG2 VAL 114 -0.837 -13.144 -1.432 884 HG22 VAL 114 1HG2 VAL 114 -1.831 -14.331 -2.275 885 HG23 VAL 114 2HG2 VAL 114 -2.359 -13.667 -0.731 886 H PHE 115 H PHE 115 -2.064 -8.982 -3.529 887 HA PHE 115 HA PHE 115 -4.773 -8.063 -2.795 888 HB2 PHE 115 1HB PHE 115 -2.336 -6.394 -3.417 889 HB3 PHE 115 2HB PHE 115 -3.974 -5.757 -3.290 890 HD1 PHE 115 HD1 PHE 115 -5.206 -5.852 -1.154 891 HD2 PHE 115 HD2 PHE 115 -1.089 -7.026 -1.446 892 HE1 PHE 115 HE1 PHE 115 -4.991 -5.699 1.301 893 HE2 PHE 115 HE2 PHE 115 -0.871 -6.870 1.017 894 HZ PHE 115 HZ PHE 115 -2.824 -6.223 2.400 895 H GLN 116 H GLN 116 -6.125 -7.483 -4.410 896 HA GLN 116 HA GLN 116 -5.271 -8.037 -7.171 897 HB2 GLN 116 1HB GLN 116 -7.190 -9.327 -6.182 898 HB3 GLN 116 2HB GLN 116 -8.083 -7.810 -6.099 899 HG2 GLN 116 1HG GLN 116 -8.762 -8.724 -8.163 900 HG3 GLN 116 2HG GLN 116 -7.507 -7.582 -8.627 901 HE21 GLN 116 2HE2 GLN 116 -5.906 -8.422 -9.942 902 HE22 GLN 116 1HE2 GLN 116 -5.551 -10.072 -10.117 903 H LEU 117 H LEU 117 -4.342 -5.983 -7.616 904 HA LEU 117 HA LEU 117 -5.917 -3.582 -7.238 905 HB2 LEU 117 1HB LEU 117 -3.197 -4.136 -8.414 906 HB3 LEU 117 2HB LEU 117 -3.919 -2.529 -8.421 907 HG LEU 117 HG LEU 117 -2.392 -2.889 -6.491 908 HD11 LEU 117 1HD1 LEU 117 -5.113 -2.712 -5.243 909 HD12 LEU 117 2HD1 LEU 117 -4.672 -1.506 -6.448 910 HD13 LEU 117 3HD1 LEU 117 -3.692 -1.699 -4.998 911 HD21 LEU 117 3HD2 LEU 117 -3.094 -5.391 -6.350 912 HD22 LEU 117 1HD2 LEU 117 -4.430 -4.799 -5.356 913 HD23 LEU 117 2HD2 LEU 117 -2.762 -4.530 -4.851 914 HA PRO 118 HA PRO 118 -7.663 -3.766 -11.325 915 HB2 PRO 118 1HB PRO 118 -8.480 -1.219 -11.721 916 HB3 PRO 118 2HB PRO 118 -9.232 -2.270 -10.501 917 HG2 PRO 118 1HG PRO 118 -7.209 -0.108 -10.151 918 HG3 PRO 118 2HG PRO 118 -8.612 -0.512 -9.146 919 HD2 PRO 118 1HD PRO 118 -5.993 -1.270 -8.561 920 HD3 PRO 118 2HD PRO 118 -7.447 -2.099 -7.945 921 H PHE 119 H PHE 119 -6.600 -3.989 -13.207 922 HA PHE 119 HA PHE 119 -4.134 -2.950 -13.840 923 HB2 PHE 119 1HB PHE 119 -5.069 -4.974 -14.825 924 HB3 PHE 119 2HB PHE 119 -6.307 -4.025 -15.640 925 HD1 PHE 119 HD1 PHE 119 -2.587 -4.087 -15.238 926 HD2 PHE 119 HD2 PHE 119 -5.921 -3.430 -17.863 927 HE1 PHE 119 HE1 PHE 119 -1.028 -3.714 -17.127 928 HE2 PHE 119 HE2 PHE 119 -4.368 -3.059 -19.750 929 HZ PHE 119 HZ PHE 119 -1.916 -3.194 -19.384 930 H GLY 120 H GLY 120 -3.369 -1.475 -15.210 931 HA2 GLY 120 1HA GLY 120 -4.188 0.130 -17.081 932 HA3 GLY 120 2HA GLY 120 -5.095 0.848 -15.751 933 H SER 121 H SER 121 -3.528 2.557 -16.883 934 HA SER 121 HA SER 121 -0.813 2.643 -16.140 935 HB2 SER 121 1HB SER 121 -1.467 4.158 -17.820 936 HB3 SER 121 2HB SER 121 -2.831 4.753 -16.877 937 HG SER 121 HG SER 121 -0.157 5.432 -16.793 938 H HIS 122 H HIS 122 -3.758 3.627 -14.479 939 HA HIS 122 HA HIS 122 -2.648 5.144 -12.412 940 HB2 HIS 122 1HB HIS 122 -5.107 4.840 -12.924 941 HB3 HIS 122 2HB HIS 122 -5.009 3.269 -12.132 942 HD2 HIS 122 HD2 HIS 122 -5.519 3.451 -9.425 943 HE1 HIS 122 HE1 HIS 122 -4.572 7.532 -8.896 944 HE2 HIS 122 HE2 HIS 122 -5.443 5.444 -7.740 945 H THR 123 H THR 123 -3.174 1.600 -12.582 946 HA THR 123 HA THR 123 -2.043 1.176 -9.970 947 HB THR 123 HB THR 123 -2.770 -0.736 -12.189 948 HG1 THR 123 HG1 THR 123 -4.356 -1.246 -10.507 949 HG21 THR 123 3HG2 THR 123 -1.646 -1.222 -9.423 950 HG22 THR 123 1HG2 THR 123 -1.038 -1.836 -10.963 951 HG23 THR 123 2HG2 THR 123 -2.552 -2.449 -10.305 952 H ARG 124 H ARG 124 -0.927 0.832 -13.299 953 HA ARG 124 HA ARG 124 1.488 -0.474 -12.814 954 HB2 ARG 124 1HB ARG 124 0.513 -0.122 -15.067 955 HB3 ARG 124 2HB ARG 124 0.926 1.589 -14.958 956 HG2 ARG 124 1HG ARG 124 3.329 0.947 -14.668 957 HG3 ARG 124 2HG ARG 124 2.868 -0.739 -14.903 958 HD2 ARG 124 1HD ARG 124 2.331 1.477 -16.890 959 HD3 ARG 124 2HD ARG 124 3.694 0.366 -16.991 960 HE ARG 124 HE ARG 124 0.909 -0.245 -17.576 961 HH11 ARG 124 1HH2 ARG 124 4.073 -1.413 -16.804 962 HH12 ARG 124 2HH2 ARG 124 3.803 -2.990 -17.466 963 HH21 ARG 124 1HH1 ARG 124 0.549 -2.309 -18.453 964 HH22 ARG 124 2HH1 ARG 124 1.808 -3.499 -18.400 965 H THR 125 H THR 125 0.684 2.959 -12.662 966 HA THR 125 HA THR 125 3.287 3.983 -12.486 967 HB THR 125 HB THR 125 0.724 4.984 -11.214 968 HG1 THR 125 HG1 THR 125 0.329 5.765 -13.120 969 HG21 THR 125 3HG2 THR 125 2.515 6.078 -10.097 970 HG22 THR 125 1HG2 THR 125 2.007 7.201 -11.359 971 HG23 THR 125 2HG2 THR 125 3.456 6.220 -11.582 972 H PHE 126 H PHE 126 1.068 2.776 -10.007 973 HA PHE 126 HA PHE 126 2.528 3.427 -7.729 974 HB2 PHE 126 1HB PHE 126 0.227 2.504 -7.686 975 HB3 PHE 126 2HB PHE 126 0.863 0.929 -8.166 976 HD1 PHE 126 HD1 PHE 126 2.578 -0.214 -6.652 977 HD2 PHE 126 HD2 PHE 126 0.288 3.206 -5.408 978 HE1 PHE 126 HE1 PHE 126 3.114 -0.712 -4.287 979 HE2 PHE 126 HE2 PHE 126 0.832 2.707 -3.044 980 HZ PHE 126 HZ PHE 126 2.244 0.748 -2.483 981 H LEU 127 H LEU 127 2.730 0.436 -9.716 982 HA LEU 127 HA LEU 127 4.522 -1.001 -8.217 983 HB2 LEU 127 1HB LEU 127 4.670 -0.811 -11.231 984 HB3 LEU 127 2HB LEU 127 5.100 -2.184 -10.214 985 HG LEU 127 HG LEU 127 2.316 -1.044 -10.562 986 HD11 LEU 127 1HD1 LEU 127 3.258 -2.296 -12.515 987 HD12 LEU 127 2HD1 LEU 127 1.859 -3.089 -11.791 988 HD13 LEU 127 3HD1 LEU 127 3.484 -3.692 -11.461 989 HD21 LEU 127 3HD2 LEU 127 2.382 -1.939 -8.367 990 HD22 LEU 127 1HD2 LEU 127 3.466 -3.248 -8.841 991 HD23 LEU 127 2HD2 LEU 127 1.774 -3.277 -9.339 992 H GLN 128 H GLN 128 5.284 1.510 -10.646 993 HA GLN 128 HA GLN 128 8.072 1.186 -10.475 994 HB2 GLN 128 1HB GLN 128 6.611 3.703 -11.266 995 HB3 GLN 128 2HB GLN 128 8.174 3.119 -11.846 996 HG2 GLN 128 1HG GLN 128 5.453 1.910 -12.382 997 HG3 GLN 128 2HG GLN 128 6.538 2.635 -13.555 998 HE21 GLN 128 2HE2 GLN 128 5.432 -0.296 -12.992 999 HE22 GLN 128 1HE2 GLN 128 6.831 -1.241 -13.178 1000 H GLU 129 H GLU 129 5.825 3.356 -8.771 1001 HA GLU 129 HA GLU 129 7.750 5.018 -7.586 1002 HB2 GLU 129 1HB GLU 129 5.271 5.424 -7.619 1003 HB3 GLU 129 2HB GLU 129 5.109 4.195 -6.365 1004 HG2 GLU 129 1HG GLU 129 5.213 6.337 -5.262 1005 HG3 GLU 129 2HG GLU 129 6.745 5.522 -4.969 1006 H VAL 130 H VAL 130 6.212 2.052 -6.296 1007 HA VAL 130 HA VAL 130 7.665 2.074 -3.865 1008 HB VAL 130 HB VAL 130 5.632 0.788 -4.065 1009 HG11 VAL 130 1HG1 VAL 130 5.428 -1.125 -5.515 1010 HG12 VAL 130 2HG1 VAL 130 7.107 -0.985 -6.021 1011 HG13 VAL 130 3HG1 VAL 130 5.936 0.250 -6.487 1012 HG21 VAL 130 3HG2 VAL 130 7.549 0.003 -2.583 1013 HG22 VAL 130 1HG2 VAL 130 7.909 -1.188 -3.833 1014 HG23 VAL 130 2HG2 VAL 130 6.353 -1.222 -3.001 1015 H ALA 131 H ALA 131 8.200 0.452 -6.952 1016 HA ALA 131 HA ALA 131 10.416 -1.110 -6.352 1017 HB1 ALA 131 3HB ALA 131 9.155 -1.056 -8.522 1018 HB2 ALA 131 1HB ALA 131 10.908 -1.105 -8.700 1019 HB3 ALA 131 2HB ALA 131 10.041 0.413 -8.933 1020 H ARG 132 H ARG 132 10.430 2.306 -7.410 1021 HA ARG 132 HA ARG 132 13.309 2.469 -7.220 1022 HB2 ARG 132 1HB ARG 132 11.163 4.551 -7.644 1023 HB3 ARG 132 2HB ARG 132 12.886 4.928 -7.593 1024 HG2 ARG 132 1HG ARG 132 13.298 3.364 -9.447 1025 HG3 ARG 132 2HG ARG 132 11.582 2.957 -9.493 1026 HD2 ARG 132 1HD ARG 132 11.039 5.306 -10.013 1027 HD3 ARG 132 2HD ARG 132 12.753 5.712 -9.977 1028 HE ARG 132 HE ARG 132 11.351 4.256 -12.080 1029 HH11 ARG 132 1HH2 ARG 132 14.354 5.161 -10.610 1030 HH12 ARG 132 2HH2 ARG 132 15.297 4.863 -12.032 1031 HH21 ARG 132 1HH1 ARG 132 12.587 3.854 -13.944 1032 HH22 ARG 132 2HH1 ARG 132 14.297 4.122 -13.918 1033 H ALA 133 H ALA 133 10.744 2.654 -5.014 1034 HA ALA 133 HA ALA 133 11.724 4.581 -3.197 1035 HB1 ALA 133 3HB ALA 133 10.070 3.781 -1.724 1036 HB2 ALA 133 1HB ALA 133 10.089 2.174 -2.432 1037 HB3 ALA 133 2HB ALA 133 9.401 3.530 -3.327 1038 H CYS 134 H CYS 134 12.996 1.569 -4.003 1039 HA CYS 134 HA CYS 134 15.219 1.645 -2.478 1040 HB2 CYS 134 1HB CYS 134 12.948 0.913 -0.735 1041 HB3 CYS 134 2HB CYS 134 14.297 -0.210 -0.628 1042 HG CYS 134 HG CYS 134 14.825 2.851 -0.298 1043 HA PRO 135 HA PRO 135 14.331 -3.100 -3.423 1044 HB2 PRO 135 1HB PRO 135 12.162 -2.623 -5.440 1045 HB3 PRO 135 2HB PRO 135 12.376 -3.977 -4.310 1046 HG2 PRO 135 1HG PRO 135 10.572 -2.100 -3.831 1047 HG3 PRO 135 2HG PRO 135 11.547 -2.775 -2.510 1048 HD2 PRO 135 1HD PRO 135 11.838 -0.125 -3.898 1049 HD3 PRO 135 2HD PRO 135 12.058 -0.529 -2.189 1050 H GLY 136 H GLY 136 13.534 -0.809 -6.073 1051 HA2 GLY 136 1HA GLY 136 14.415 -1.536 -8.350 1052 HA3 GLY 136 2HA GLY 136 15.160 -0.080 -7.701 1053 H PHE 137 H PHE 137 15.464 -3.556 -7.997 1054 HA PHE 137 HA PHE 137 17.369 -4.857 -7.275 1055 HB2 PHE 137 1HB PHE 137 18.716 -4.995 -9.390 1056 HB3 PHE 137 2HB PHE 137 16.974 -5.138 -9.624 1057 HD1 PHE 137 HD2 PHE 137 15.657 -3.055 -10.275 1058 HD2 PHE 137 HD1 PHE 137 19.945 -3.263 -10.446 1059 HE1 PHE 137 HE2 PHE 137 15.692 -1.097 -11.796 1060 HE2 PHE 137 HE1 PHE 137 19.979 -1.302 -11.959 1061 HZ PHE 137 HZ PHE 137 17.853 -0.222 -12.639 1062 H ASP 138 H ASP 138 18.095 -3.342 -5.496 1063 HA ASP 138 HA ASP 138 20.521 -1.809 -6.179 1064 HB2 ASP 138 1HB ASP 138 18.576 -1.816 -3.891 1065 HB3 ASP 138 2HB ASP 138 20.210 -1.228 -3.602 1066 HA PRO 139 HA PRO 139 23.233 -4.947 -4.713 1067 HB2 PRO 139 1HB PRO 139 25.084 -3.470 -3.243 1068 HB3 PRO 139 2HB PRO 139 25.074 -3.591 -5.014 1069 HG2 PRO 139 1HG PRO 139 23.948 -1.444 -3.264 1070 HG3 PRO 139 2HG PRO 139 24.876 -1.296 -4.771 1071 HD2 PRO 139 1HD PRO 139 22.208 -0.999 -4.774 1072 HD3 PRO 139 2HD PRO 139 23.028 -1.837 -6.113 1073 H GLU 140 H GLU 140 22.728 -2.555 -2.091 1074 HA GLU 140 HA GLU 140 21.992 -4.771 -0.272 1075 HB2 GLU 140 1HB GLU 140 23.977 -2.553 0.284 1076 HB3 GLU 140 2HB GLU 140 23.300 -3.611 1.524 1077 HG2 GLU 140 1HG GLU 140 24.190 -5.576 0.382 1078 HG3 GLU 140 2HG GLU 140 24.804 -4.564 -0.925 1079 H THR 141 H THR 141 20.554 -2.595 -1.769 1080 HA THR 141 HA THR 141 19.111 -0.783 -1.354 1081 HB THR 141 HB THR 141 17.125 -1.714 -0.634 1082 HG1 THR 141 HG1 THR 141 17.078 -3.176 1.158 1083 HG21 THR 141 3HG2 THR 141 18.256 -3.339 -2.159 1084 HG22 THR 141 1HG2 THR 141 17.125 -4.108 -1.047 1085 HG23 THR 141 2HG2 THR 141 18.861 -4.195 -0.743 1086 H ARG 142 H ARG 142 21.450 -0.413 0.222 1087 HA ARG 142 HA ARG 142 22.244 0.547 2.167 1088 HB2 ARG 142 1HB ARG 142 19.737 2.156 1.643 1089 HB3 ARG 142 2HB ARG 142 21.034 2.636 2.742 1090 HG2 ARG 142 1HG ARG 142 22.648 2.567 0.881 1091 HG3 ARG 142 2HG ARG 142 21.345 2.109 -0.221 1092 HD2 ARG 142 1HD ARG 142 20.149 4.203 0.355 1093 HD3 ARG 142 2HD ARG 142 21.501 4.671 1.385 1094 HE ARG 142 HE ARG 142 21.438 4.708 -1.519 1095 HH11 ARG 142 1HH2 ARG 142 23.330 4.673 1.377 1096 HH12 ARG 142 2HH2 ARG 142 24.733 5.363 0.632 1097 HH21 ARG 142 1HH1 ARG 142 23.271 5.599 -2.506 1098 HH22 ARG 142 2HH1 ARG 142 24.699 5.888 -1.569 1099 H ASP 143 H ASP 143 19.713 1.906 3.695 1100 HA ASP 143 HA ASP 143 19.200 -0.415 5.429 1101 HB2 ASP 143 1HB ASP 143 19.223 1.216 7.349 1102 HB3 ASP 143 2HB ASP 143 20.793 0.967 6.589 1103 HA PRO 144 HA PRO 144 14.974 0.781 4.698 1104 HB2 PRO 144 1HB PRO 144 13.777 -0.348 6.905 1105 HB3 PRO 144 2HB PRO 144 14.354 -1.288 5.516 1106 HG2 PRO 144 1HG PRO 144 15.681 -0.823 8.146 1107 HG3 PRO 144 2HG PRO 144 15.554 -2.318 7.199 1108 HD2 PRO 144 1HD PRO 144 17.799 -0.794 7.216 1109 HD3 PRO 144 2HD PRO 144 17.290 -1.720 5.784 1110 H GLU 145 H GLU 145 16.664 1.651 7.581 1111 HA GLU 145 HA GLU 145 16.318 3.280 9.201 1112 HB2 GLU 145 1HB GLU 145 16.987 4.442 7.010 1113 HB3 GLU 145 2HB GLU 145 15.286 4.886 6.866 1114 HG2 GLU 145 1HG GLU 145 16.381 6.709 7.965 1115 HG3 GLU 145 2HG GLU 145 15.451 5.857 9.196 1116 H PHE 146 H PHE 146 14.634 2.484 10.476 1117 HA PHE 146 HA PHE 146 11.871 3.280 9.746 1118 HB2 PHE 146 1HB PHE 146 11.320 1.563 11.602 1119 HB3 PHE 146 2HB PHE 146 11.898 0.953 10.053 1120 HD1 PHE 146 HD1 PHE 146 12.790 1.590 13.571 1121 HD2 PHE 146 HD2 PHE 146 14.111 -0.012 9.812 1122 HE1 PHE 146 HE1 PHE 146 14.700 0.496 14.709 1123 HE2 PHE 146 HE2 PHE 146 16.024 -1.105 10.948 1124 HZ PHE 146 HZ PHE 146 16.319 -0.853 13.399 1125 H GLU 147 H GLU 147 14.291 4.590 11.308 1126 HA GLU 147 HA GLU 147 13.524 5.040 13.949 1127 HB2 GLU 147 1HB GLU 147 15.089 6.820 13.966 1128 HB3 GLU 147 2HB GLU 147 15.717 5.658 12.801 1129 HG2 GLU 147 1HG GLU 147 14.537 7.014 10.999 1130 HG3 GLU 147 2HG GLU 147 14.255 8.245 12.223 1131 H TRP 148 H TRP 148 12.507 6.748 11.014 1132 HA TRP 148 HA TRP 148 11.023 8.729 12.517 1133 HB2 TRP 148 1HB TRP 148 10.257 9.523 10.325 1134 HB3 TRP 148 2HB TRP 148 12.007 9.329 10.365 1135 HD1 TRP 148 HD1 TRP 148 12.939 6.933 9.315 1136 HE1 TRP 148 HE1 TRP 148 12.083 5.636 7.266 1137 HE3 TRP 148 HE3 TRP 148 8.292 8.997 8.856 1138 HZ2 TRP 148 HZ2 TRP 148 9.745 5.513 5.621 1139 HZ3 TRP 148 HZ3 TRP 148 6.773 8.277 7.035 1140 HH2 TRP 148 HH2 TRP 148 7.489 6.538 5.416 1141 H LEU 149 H LEU 149 10.295 5.589 11.059 1142 HA LEU 149 HA LEU 149 7.523 5.830 10.836 1143 HB2 LEU 149 1HB LEU 149 8.640 3.887 9.943 1144 HB3 LEU 149 2HB LEU 149 9.266 3.450 11.529 1145 HG LEU 149 HG LEU 149 6.993 2.994 12.337 1146 HD11 LEU 149 1HD1 LEU 149 6.235 4.039 9.611 1147 HD12 LEU 149 2HD1 LEU 149 5.631 4.540 11.190 1148 HD13 LEU 149 3HD1 LEU 149 5.162 2.985 10.527 1149 HD21 LEU 149 3HD2 LEU 149 7.258 1.650 9.650 1150 HD22 LEU 149 1HD2 LEU 149 6.598 0.989 11.144 1151 HD23 LEU 149 2HD2 LEU 149 8.332 1.270 10.997 1152 H SER 150 H SER 150 9.521 4.905 13.624 1153 HA SER 150 HA SER 150 7.544 4.213 15.428 1154 HB2 SER 150 1HB SER 150 10.099 5.735 15.975 1155 HB3 SER 150 2HB SER 150 9.135 4.886 17.179 1156 HG SER 150 HG SER 150 10.155 3.644 14.847 1157 H ARG 151 H ARG 151 8.656 7.384 14.396 1158 HA ARG 151 HA ARG 151 7.412 9.000 16.304 1159 HB2 ARG 151 1HB ARG 151 9.027 9.581 14.339 1160 HB3 ARG 151 2HB ARG 151 7.564 9.683 13.368 1161 HG2 ARG 151 1HG ARG 151 7.737 11.884 14.070 1162 HG3 ARG 151 2HG ARG 151 6.726 11.232 15.359 1163 HD2 ARG 151 1HD ARG 151 8.775 10.833 16.718 1164 HD3 ARG 151 2HD ARG 151 9.736 11.569 15.436 1165 HE ARG 151 HE ARG 151 7.740 13.399 16.112 1166 HH11 ARG 151 1HH2 ARG 151 10.449 11.815 17.573 1167 HH12 ARG 151 2HH2 ARG 151 10.779 13.107 18.677 1168 HH21 ARG 151 1HH1 ARG 151 8.165 15.089 17.548 1169 HH22 ARG 151 2HH1 ARG 151 9.483 14.963 18.664 1170 H HIS 152 H HIS 152 6.248 7.640 13.282 1171 HA HIS 152 HA HIS 152 3.608 8.744 13.544 1172 HB2 HIS 152 1HB HIS 152 4.735 6.609 11.717 1173 HB3 HIS 152 2HB HIS 152 3.116 7.289 11.586 1174 HD2 HIS 152 HD2 HIS 152 6.703 8.118 10.449 1175 HE1 HIS 152 HE1 HIS 152 4.395 11.591 9.779 1176 HE2 HIS 152 HE2 HIS 152 6.633 10.477 9.330 1177 H THR 153 H THR 153 1.749 7.579 13.962 1178 HA THR 153 HA THR 153 1.956 4.853 15.009 1179 HB THR 153 HB THR 153 1.151 7.245 16.662 1180 HG1 THR 153 HG1 THR 153 2.618 6.398 18.041 1181 HG21 THR 153 3HG2 THR 153 0.132 4.416 16.818 1182 HG22 THR 153 1HG2 THR 153 -0.726 5.927 17.115 1183 HG23 THR 153 2HG2 THR 153 0.409 5.307 18.314 1184 H CYS 154 H CYS 154 0.150 3.679 14.621 1185 HA CYS 154 HA CYS 154 -1.786 4.710 12.826 1186 HB2 CYS 154 1HB CYS 154 -2.118 2.170 14.407 1187 HB3 CYS 154 2HB CYS 154 -2.630 2.522 12.756 1188 HG CYS 154 HG CYS 154 -0.031 1.279 13.421 1189 H ALA 155 H ALA 155 -4.043 4.820 13.160 1190 HA ALA 155 HA ALA 155 -4.894 6.407 15.245 1191 HB1 ALA 155 3HB ALA 155 -6.439 4.440 13.554 1192 HB2 ALA 155 1HB ALA 155 -6.314 6.186 13.339 1193 HB3 ALA 155 2HB ALA 155 -7.217 5.528 14.706 1194 H GLU 156 H GLU 156 -6.661 5.760 16.878 1195 HA GLU 156 HA GLU 156 -6.133 3.142 18.130 1196 HB2 GLU 156 1HB GLU 156 -6.105 5.741 19.672 1197 HB3 GLU 156 2HB GLU 156 -5.786 4.123 20.299 1198 HG2 GLU 156 1HG GLU 156 -4.115 5.562 18.213 1199 HG3 GLU 156 2HG GLU 156 -3.679 5.347 19.905 1200 HA PRO 157 HA PRO 157 -10.689 3.664 17.886 1201 HB2 PRO 157 1HB PRO 157 -10.447 1.083 19.405 1202 HB3 PRO 157 2HB PRO 157 -11.529 1.503 18.057 1203 HG2 PRO 157 1HG PRO 157 -9.402 0.021 17.622 1204 HG3 PRO 157 2HG PRO 157 -9.854 1.302 16.483 1205 HD2 PRO 157 1HD PRO 157 -7.637 1.288 18.508 1206 HD3 PRO 157 2HD PRO 157 -7.673 1.996 16.876 1207 H ASP 158 H ASP 158 -12.396 3.816 19.469 1208 HA ASP 158 HA ASP 158 -11.394 4.768 22.083 1209 HB2 ASP 158 1HB ASP 158 -13.884 5.321 20.479 1210 HB3 ASP 158 2HB ASP 158 -13.746 5.781 22.177 1211 H ALA 159 H ALA 159 -11.360 3.118 23.501 1212 HA ALA 159 HA ALA 159 -13.135 0.921 23.502 1213 HB1 ALA 159 3HB ALA 159 -11.487 2.033 25.783 1214 HB2 ALA 159 1HB ALA 159 -10.902 0.899 24.565 1215 HB3 ALA 159 2HB ALA 159 -12.171 0.411 25.690 1216 H GLU 160 H GLU 160 -13.161 4.015 25.206 1217 HA GLU 160 HA GLU 160 -15.295 3.430 26.974 1218 HB2 GLU 160 1HB GLU 160 -14.257 6.046 25.870 1219 HB3 GLU 160 2HB GLU 160 -15.499 5.937 27.118 1220 HG2 GLU 160 1HG GLU 160 -13.974 4.735 28.591 1221 HG3 GLU 160 2HG GLU 160 -12.740 4.701 27.333 1222 H SER 161 H SER 161 -15.188 4.742 23.694 1223 HA SER 161 HA SER 161 -17.980 5.362 23.576 1224 HB2 SER 161 1HB SER 161 -17.591 5.958 21.340 1225 HB3 SER 161 2HB SER 161 -16.048 6.290 22.123 1226 HG SER 161 HG SER 161 -15.855 3.824 21.470 Start of MODEL 19 1 H1 GLY 1 1H GLY 1 -12.779 16.281 -6.026 2 H2 GLY 1 2H GLY 1 -13.934 16.066 -4.798 3 H3 GLY 1 3H GLY 1 -14.064 17.378 -5.869 4 HA2 GLY 1 1HA GLY 1 -15.266 14.913 -6.116 5 HA3 GLY 1 2HA GLY 1 -15.199 16.187 -7.335 6 HA PRO 2 HA PRO 2 -11.232 13.660 -8.349 7 HB2 PRO 2 1HB PRO 2 -10.706 11.475 -6.712 8 HB3 PRO 2 2HB PRO 2 -10.014 13.092 -6.473 9 HG2 PRO 2 1HG PRO 2 -12.361 11.826 -5.126 10 HG3 PRO 2 2HG PRO 2 -11.070 12.829 -4.435 11 HD2 PRO 2 1HD PRO 2 -13.515 13.855 -4.962 12 HD3 PRO 2 2HD PRO 2 -12.038 14.823 -5.171 13 H LEU 3 H LEU 3 -13.305 11.246 -6.703 14 HA LEU 3 HA LEU 3 -14.731 9.658 -7.565 15 HB2 LEU 3 1HB LEU 3 -15.014 11.549 -9.420 16 HB3 LEU 3 2HB LEU 3 -14.096 10.413 -10.403 17 HG LEU 3 HG LEU 3 -15.847 8.651 -9.470 18 HD11 LEU 3 1HD1 LEU 3 -17.335 11.286 -9.227 19 HD12 LEU 3 2HD1 LEU 3 -16.952 10.187 -7.905 20 HD13 LEU 3 3HD1 LEU 3 -18.085 9.692 -9.160 21 HD21 LEU 3 3HD2 LEU 3 -17.375 9.258 -11.400 22 HD22 LEU 3 1HD2 LEU 3 -15.670 9.129 -11.827 23 HD23 LEU 3 2HD2 LEU 3 -16.407 10.717 -11.620 24 H GLY 4 H GLY 4 -14.296 7.553 -7.775 25 HA2 GLY 4 1HA GLY 4 -12.995 5.650 -7.961 26 HA3 GLY 4 2HA GLY 4 -12.720 6.245 -9.595 27 H SER 5 H SER 5 -10.654 6.331 -10.092 28 HA SER 5 HA SER 5 -8.492 6.055 -8.354 29 HB2 SER 5 1HB SER 5 -7.097 6.783 -10.215 30 HB3 SER 5 2HB SER 5 -8.393 5.758 -10.826 31 HG SER 5 HG SER 5 -7.819 8.293 -11.446 32 H MET 6 H MET 6 -6.740 7.725 -7.978 33 HA MET 6 HA MET 6 -6.017 9.732 -7.140 34 HB2 MET 6 1HB MET 6 -8.506 10.963 -8.355 35 HB3 MET 6 2HB MET 6 -7.023 11.784 -7.892 36 HG2 MET 6 1HG MET 6 -5.767 10.512 -9.589 37 HG3 MET 6 2HG MET 6 -7.245 9.670 -10.057 38 HE1 MET 6 3HE MET 6 -5.402 11.343 -12.151 39 HE2 MET 6 1HE MET 6 -6.764 11.921 -13.120 40 HE3 MET 6 2HE MET 6 -6.790 10.296 -12.440 41 H ASP 7 H ASP 7 -9.522 9.256 -6.829 42 HA ASP 7 HA ASP 7 -10.075 10.719 -4.565 43 HB2 ASP 7 1HB ASP 7 -11.660 9.266 -5.987 44 HB3 ASP 7 2HB ASP 7 -11.171 7.934 -4.942 45 H GLN 8 H GLN 8 -8.325 7.761 -4.857 46 HA GLN 8 HA GLN 8 -8.350 7.069 -2.068 47 HB2 GLN 8 1HB GLN 8 -6.708 6.168 -4.426 48 HB3 GLN 8 2HB GLN 8 -6.343 5.620 -2.788 49 HG2 GLN 8 1HG GLN 8 -7.759 3.963 -3.724 50 HG3 GLN 8 2HG GLN 8 -8.780 4.893 -2.632 51 HE21 GLN 8 2HE2 GLN 8 -10.378 3.749 -4.301 52 HE22 GLN 8 1HE2 GLN 8 -10.806 4.705 -5.629 53 H SER 9 H SER 9 -5.982 8.603 -4.219 54 HA SER 9 HA SER 9 -3.892 8.934 -2.432 55 HB2 SER 9 1HB SER 9 -4.759 10.922 -4.542 56 HB3 SER 9 2HB SER 9 -3.171 10.845 -3.783 57 HG SER 9 HG SER 9 -2.746 9.495 -5.333 58 H VAL 10 H VAL 10 -6.637 11.142 -2.961 59 HA VAL 10 HA VAL 10 -5.833 13.032 -1.004 60 HB VAL 10 HB VAL 10 -8.551 12.399 -2.173 61 HG11 VAL 10 1HG1 VAL 10 -7.596 14.612 -0.348 62 HG12 VAL 10 2HG1 VAL 10 -8.968 13.530 -0.116 63 HG13 VAL 10 3HG1 VAL 10 -9.030 14.780 -1.359 64 HG21 VAL 10 3HG2 VAL 10 -6.667 13.226 -3.685 65 HG22 VAL 10 1HG2 VAL 10 -6.690 14.719 -2.745 66 HG23 VAL 10 2HG2 VAL 10 -8.117 14.229 -3.658 67 H ALA 11 H ALA 11 -8.081 10.311 -0.939 68 HA ALA 11 HA ALA 11 -9.188 10.494 1.532 69 HB1 ALA 11 3HB ALA 11 -8.262 8.068 0.014 70 HB2 ALA 11 1HB ALA 11 -9.901 8.654 0.250 71 HB3 ALA 11 2HB ALA 11 -9.028 7.904 1.584 72 H ILE 12 H ILE 12 -5.986 9.106 0.832 73 HA ILE 12 HA ILE 12 -5.401 8.493 3.535 74 HB ILE 12 HB ILE 12 -3.461 9.055 1.289 75 HG12 ILE 12 1HG1 ILE 12 -5.062 7.380 0.575 76 HG13 ILE 12 2HG1 ILE 12 -3.545 6.579 0.954 77 HG21 ILE 12 1HG2 ILE 12 -3.195 7.383 3.802 78 HG22 ILE 12 2HG2 ILE 12 -2.448 8.960 3.545 79 HG23 ILE 12 3HG2 ILE 12 -1.960 7.582 2.558 80 HD11 ILE 12 3HD1 ILE 12 -6.140 6.542 2.462 81 HD12 ILE 12 1HD1 ILE 12 -4.634 6.283 3.340 82 HD13 ILE 12 2HD1 ILE 12 -5.086 5.198 2.029 83 H GLN 13 H GLN 13 -4.534 11.199 1.473 84 HA GLN 13 HA GLN 13 -2.860 12.604 3.111 85 HB2 GLN 13 1HB GLN 13 -3.719 13.212 0.744 86 HB3 GLN 13 2HB GLN 13 -5.012 14.067 1.585 87 HG2 GLN 13 1HG GLN 13 -3.264 15.661 1.211 88 HG3 GLN 13 2HG GLN 13 -3.216 15.245 2.922 89 HE21 GLN 13 2HE2 GLN 13 -1.090 14.900 3.633 90 HE22 GLN 13 1HE2 GLN 13 0.147 14.229 2.687 91 H GLU 14 H GLU 14 -6.430 12.799 3.139 92 HA GLU 14 HA GLU 14 -6.588 14.652 5.263 93 HB2 GLU 14 1HB GLU 14 -8.527 12.561 4.249 94 HB3 GLU 14 2HB GLU 14 -8.943 13.793 5.439 95 HG2 GLU 14 1HG GLU 14 -8.393 15.567 3.841 96 HG3 GLU 14 2HG GLU 14 -7.878 14.366 2.658 97 H THR 15 H THR 15 -6.566 11.128 5.149 98 HA THR 15 HA THR 15 -6.861 10.873 8.042 99 HB THR 15 HB THR 15 -6.840 8.488 7.666 100 HG1 THR 15 HG1 THR 15 -5.933 9.257 5.107 101 HG21 THR 15 3HG2 THR 15 -8.467 10.156 5.758 102 HG22 THR 15 1HG2 THR 15 -8.991 9.257 7.180 103 HG23 THR 15 2HG2 THR 15 -8.570 8.399 5.699 104 H LEU 16 H LEU 16 -4.377 12.092 6.640 105 HA LEU 16 HA LEU 16 -2.358 10.285 7.833 106 HB2 LEU 16 1HB LEU 16 -2.197 10.862 5.363 107 HB3 LEU 16 2HB LEU 16 -1.879 12.520 5.848 108 HG LEU 16 HG LEU 16 0.102 11.716 7.154 109 HD11 LEU 16 1HD1 LEU 16 -0.237 9.486 7.732 110 HD12 LEU 16 2HD1 LEU 16 0.834 9.299 6.350 111 HD13 LEU 16 3HD1 LEU 16 -0.903 9.070 6.152 112 HD21 LEU 16 3HD2 LEU 16 0.027 10.916 4.232 113 HD22 LEU 16 1HD2 LEU 16 1.493 11.190 5.167 114 HD23 LEU 16 2HD2 LEU 16 0.386 12.525 4.854 115 H VAL 17 H VAL 17 -1.026 13.245 7.196 116 HA VAL 17 HA VAL 17 -1.849 14.696 9.513 117 HB VAL 17 HB VAL 17 -0.305 12.845 10.416 118 HG11 VAL 17 1HG1 VAL 17 1.322 13.255 8.410 119 HG12 VAL 17 2HG1 VAL 17 2.003 12.940 10.002 120 HG13 VAL 17 3HG1 VAL 17 1.929 14.589 9.386 121 HG21 VAL 17 3HG2 VAL 17 0.792 14.417 11.960 122 HG22 VAL 17 1HG2 VAL 17 -0.869 14.922 11.645 123 HG23 VAL 17 2HG2 VAL 17 0.471 15.748 10.850 124 H GLU 18 H GLU 18 -1.335 16.835 9.245 125 HA GLU 18 HA GLU 18 -0.509 17.734 6.732 126 HB2 GLU 18 1HB GLU 18 -0.620 19.136 9.407 127 HB3 GLU 18 2HB GLU 18 -0.377 19.961 7.867 128 HG2 GLU 18 1HG GLU 18 -2.760 18.203 8.520 129 HG3 GLU 18 2HG GLU 18 -2.765 19.962 8.608 130 H GLY 19 H GLY 19 1.426 17.674 5.845 131 HA2 GLY 19 1HA GLY 19 3.674 18.875 6.174 132 HA3 GLY 19 2HA GLY 19 3.842 17.811 7.564 133 H GLU 20 H GLU 20 2.300 15.772 5.715 134 HA GLU 20 HA GLU 20 4.753 14.815 4.347 135 HB2 GLU 20 1HB GLU 20 2.454 13.320 5.597 136 HB3 GLU 20 2HB GLU 20 3.568 12.555 4.465 137 HG2 GLU 20 1HG GLU 20 5.467 13.124 5.893 138 HG3 GLU 20 2HG GLU 20 4.403 13.985 7.006 139 H TYR 21 H TYR 21 3.957 13.053 2.656 140 HA TYR 21 HA TYR 21 1.883 14.220 0.908 141 HB2 TYR 21 1HB TYR 21 4.150 15.168 0.354 142 HB3 TYR 21 2HB TYR 21 4.674 13.531 -0.030 143 HD1 TYR 21 HD2 TYR 21 1.771 15.803 -0.772 144 HD2 TYR 21 HD1 TYR 21 4.557 12.893 -2.271 145 HE1 TYR 21 HE2 TYR 21 0.788 16.025 -3.033 146 HE2 TYR 21 HE1 TYR 21 3.581 13.124 -4.528 147 HH TYR 21 HH TYR 21 1.217 15.603 -5.269 148 H CYS 22 H CYS 22 0.548 12.639 0.250 149 HA CYS 22 HA CYS 22 1.413 9.846 0.403 150 HB2 CYS 22 1HB CYS 22 -0.797 10.213 1.231 151 HB3 CYS 22 2HB CYS 22 -1.241 11.173 -0.181 152 HG CYS 22 HG CYS 22 -1.951 9.061 -1.249 153 H VAL 23 H VAL 23 3.015 10.186 -1.267 154 HA VAL 23 HA VAL 23 2.906 11.044 -3.790 155 HB VAL 23 HB VAL 23 4.798 9.782 -2.915 156 HG11 VAL 23 1HG1 VAL 23 3.174 7.975 -1.945 157 HG12 VAL 23 2HG1 VAL 23 4.769 7.481 -2.500 158 HG13 VAL 23 3HG1 VAL 23 3.362 7.218 -3.523 159 HG21 VAL 23 3HG2 VAL 23 3.820 8.351 -5.387 160 HG22 VAL 23 1HG2 VAL 23 5.479 8.758 -4.953 161 HG23 VAL 23 2HG2 VAL 23 4.355 10.030 -5.433 162 H ILE 24 H ILE 24 1.518 7.923 -2.815 163 HA ILE 24 HA ILE 24 -0.570 8.152 -4.750 164 HB ILE 24 HB ILE 24 1.676 7.478 -5.968 165 HG12 ILE 24 1HG1 ILE 24 -0.447 7.613 -7.134 166 HG13 ILE 24 2HG1 ILE 24 0.378 6.133 -7.607 167 HG21 ILE 24 1HG2 ILE 24 0.714 4.737 -5.201 168 HG22 ILE 24 2HG2 ILE 24 1.988 5.563 -4.305 169 HG23 ILE 24 3HG2 ILE 24 2.209 5.195 -6.010 170 HD11 ILE 24 3HD1 ILE 24 -2.079 6.485 -5.941 171 HD12 ILE 24 1HD1 ILE 24 -1.047 5.091 -5.620 172 HD13 ILE 24 2HD1 ILE 24 -1.752 5.321 -7.217 173 H ALA 25 H ALA 25 -2.235 6.865 -4.229 174 HA ALA 25 HA ALA 25 -1.856 4.475 -2.589 175 HB1 ALA 25 3HB ALA 25 -3.682 6.731 -1.727 176 HB2 ALA 25 1HB ALA 25 -2.147 6.339 -0.959 177 HB3 ALA 25 2HB ALA 25 -3.477 5.181 -0.919 178 H VAL 26 H VAL 26 -3.093 2.949 -3.433 179 HA VAL 26 HA VAL 26 -5.514 3.746 -4.942 180 HB VAL 26 HB VAL 26 -3.564 2.707 -6.215 181 HG11 VAL 26 1HG1 VAL 26 -3.037 0.421 -5.926 182 HG12 VAL 26 2HG1 VAL 26 -4.479 0.119 -4.958 183 HG13 VAL 26 3HG1 VAL 26 -3.145 1.050 -4.282 184 HG21 VAL 26 3HG2 VAL 26 -6.358 2.355 -6.525 185 HG22 VAL 26 1HG2 VAL 26 -5.694 0.733 -6.709 186 HG23 VAL 26 2HG2 VAL 26 -5.130 2.040 -7.744 187 H GLN 27 H GLN 27 -6.521 1.105 -5.190 188 HA GLN 27 HA GLN 27 -7.028 0.290 -2.414 189 HB2 GLN 27 1HB GLN 27 -8.802 1.881 -3.335 190 HB3 GLN 27 2HB GLN 27 -9.210 0.605 -4.479 191 HG2 GLN 27 1HG GLN 27 -9.103 0.078 -1.505 192 HG3 GLN 27 2HG GLN 27 -10.555 0.699 -2.281 193 HE21 GLN 27 2HE2 GLN 27 -10.608 -1.848 -1.078 194 HE22 GLN 27 1HE2 GLN 27 -10.743 -3.028 -2.288 195 H GLY 28 H GLY 28 -6.644 -1.783 -2.231 196 HA2 GLY 28 1HA GLY 28 -7.000 -3.562 -4.591 197 HA3 GLY 28 2HA GLY 28 -5.703 -3.753 -3.417 198 H VAL 29 H VAL 29 -7.430 -5.800 -4.057 199 HA VAL 29 HA VAL 29 -9.228 -6.040 -1.719 200 HB VAL 29 HB VAL 29 -9.109 -7.984 -4.025 201 HG11 VAL 29 1HG1 VAL 29 -10.405 -8.605 -2.020 202 HG12 VAL 29 2HG1 VAL 29 -11.479 -8.313 -3.387 203 HG13 VAL 29 3HG1 VAL 29 -11.303 -7.091 -2.128 204 HG21 VAL 29 3HG2 VAL 29 -10.614 -5.356 -3.892 205 HG22 VAL 29 1HG2 VAL 29 -10.946 -6.631 -5.063 206 HG23 VAL 29 2HG2 VAL 29 -9.386 -5.809 -5.073 207 H LEU 30 H LEU 30 -9.249 -8.166 -0.693 208 HA LEU 30 HA LEU 30 -6.747 -9.707 -0.872 209 HB2 LEU 30 1HB LEU 30 -6.318 -8.104 0.943 210 HB3 LEU 30 2HB LEU 30 -7.846 -8.533 1.712 211 HG LEU 30 HG LEU 30 -7.035 -10.860 2.000 212 HD11 LEU 30 1HD1 LEU 30 -4.442 -11.074 1.668 213 HD12 LEU 30 2HD1 LEU 30 -4.659 -9.755 0.520 214 HD13 LEU 30 3HD1 LEU 30 -5.509 -11.283 0.284 215 HD21 LEU 30 3HD2 LEU 30 -6.578 -8.928 3.665 216 HD22 LEU 30 1HD2 LEU 30 -4.914 -9.019 3.091 217 HD23 LEU 30 2HD2 LEU 30 -5.659 -10.422 3.858 218 H CYS 31 H CYS 31 -7.422 -11.795 -1.149 219 HA CYS 31 HA CYS 31 -10.113 -12.506 -0.211 220 HB2 CYS 31 1HB CYS 31 -9.284 -12.884 -2.616 221 HB3 CYS 31 2HB CYS 31 -8.299 -14.181 -1.942 222 HG CYS 31 HG CYS 31 -11.374 -14.203 -2.187 223 H LYS 32 H LYS 32 -10.304 -13.525 1.616 224 HA LYS 32 HA LYS 32 -8.113 -15.309 2.537 225 HB2 LYS 32 1HB LYS 32 -8.440 -13.248 3.957 226 HB3 LYS 32 2HB LYS 32 -10.060 -13.845 4.327 227 HG2 LYS 32 1HG LYS 32 -9.122 -15.917 5.229 228 HG3 LYS 32 2HG LYS 32 -7.496 -15.388 4.802 229 HD2 LYS 32 1HD LYS 32 -7.733 -13.453 6.328 230 HD3 LYS 32 2HD LYS 32 -9.345 -14.015 6.775 231 HE2 LYS 32 1HE LYS 32 -8.397 -16.124 7.590 232 HE3 LYS 32 2HE LYS 32 -6.783 -15.581 7.130 233 HZ1 LYS 32 3HZ LYS 32 -6.865 -13.849 8.718 234 HZ2 LYS 32 1HZ LYS 32 -7.368 -15.253 9.523 235 HZ3 LYS 32 2HZ LYS 32 -8.516 -14.101 9.028 236 H GLY 33 H GLY 33 -8.685 -17.358 2.465 237 HA2 GLY 33 1HA GLY 33 -9.955 -19.264 2.421 238 HA3 GLY 33 2HA GLY 33 -10.958 -18.468 3.630 239 H ASP 34 H ASP 34 -13.008 -18.203 3.094 240 HA ASP 34 HA ASP 34 -13.757 -17.916 0.237 241 HB2 ASP 34 1HB ASP 34 -14.353 -20.157 1.212 242 HB3 ASP 34 2HB ASP 34 -15.375 -19.319 2.379 243 H SER 35 H SER 35 -13.132 -15.906 2.238 244 HA SER 35 HA SER 35 -15.731 -14.475 2.333 245 HB2 SER 35 1HB SER 35 -15.131 -15.196 4.612 246 HB3 SER 35 2HB SER 35 -13.538 -14.464 4.436 247 HG SER 35 HG SER 35 -15.989 -13.312 4.931 248 H ARG 36 H ARG 36 -15.586 -12.749 0.991 249 HA ARG 36 HA ARG 36 -12.999 -11.758 0.171 250 HB2 ARG 36 1HB ARG 36 -15.177 -12.008 -1.251 251 HB3 ARG 36 2HB ARG 36 -15.636 -10.474 -0.519 252 HG2 ARG 36 1HG ARG 36 -14.536 -9.726 -2.434 253 HG3 ARG 36 2HG ARG 36 -13.206 -9.727 -1.278 254 HD2 ARG 36 1HD ARG 36 -12.566 -12.006 -2.070 255 HD3 ARG 36 2HD ARG 36 -13.858 -11.932 -3.259 256 HE ARG 36 HE ARG 36 -11.332 -10.474 -3.335 257 HH11 ARG 36 1HH2 ARG 36 -14.560 -10.863 -4.517 258 HH12 ARG 36 2HH2 ARG 36 -14.261 -10.037 -6.009 259 HH21 ARG 36 1HH1 ARG 36 -10.933 -9.380 -5.287 260 HH22 ARG 36 2HH1 ARG 36 -12.208 -9.197 -6.444 261 H GLN 37 H GLN 37 -12.029 -9.911 0.718 262 HA GLN 37 HA GLN 37 -13.385 -8.100 2.635 263 HB2 GLN 37 1HB GLN 37 -10.552 -9.166 2.750 264 HB3 GLN 37 2HB GLN 37 -11.191 -7.891 3.790 265 HG2 GLN 37 1HG GLN 37 -12.811 -9.372 4.759 266 HG3 GLN 37 2HG GLN 37 -12.472 -10.621 3.563 267 HE21 GLN 37 2HE2 GLN 37 -10.550 -11.904 3.830 268 HE22 GLN 37 1HE2 GLN 37 -9.638 -11.869 5.256 269 H SER 38 H SER 38 -12.439 -5.981 2.714 270 HA SER 38 HA SER 38 -11.172 -5.167 0.145 271 HB2 SER 38 1HB SER 38 -12.561 -3.345 -0.040 272 HB3 SER 38 2HB SER 38 -13.656 -4.463 0.763 273 HG SER 38 HG SER 38 -12.633 -3.490 2.763 274 H ARG 39 H ARG 39 -9.282 -4.283 0.300 275 HA ARG 39 HA ARG 39 -8.412 -3.058 2.856 276 HB2 ARG 39 1HB ARG 39 -6.803 -4.669 0.871 277 HB3 ARG 39 2HB ARG 39 -6.142 -3.874 2.298 278 HG2 ARG 39 1HG ARG 39 -8.396 -5.872 2.523 279 HG3 ARG 39 2HG ARG 39 -6.717 -6.395 2.474 280 HD2 ARG 39 1HD ARG 39 -6.243 -4.875 4.413 281 HD3 ARG 39 2HD ARG 39 -7.966 -4.532 4.511 282 HE ARG 39 HE ARG 39 -7.165 -7.345 4.625 283 HH11 ARG 39 1HH2 ARG 39 -8.217 -4.467 6.259 284 HH12 ARG 39 2HH2 ARG 39 -8.697 -5.304 7.695 285 HH21 ARG 39 1HH1 ARG 39 -7.790 -8.429 6.509 286 HH22 ARG 39 2HH1 ARG 39 -8.455 -7.540 7.838 287 H LEU 40 H LEU 40 -7.379 -1.184 2.784 288 HA LEU 40 HA LEU 40 -7.080 0.128 0.129 289 HB2 LEU 40 1HB LEU 40 -8.829 1.076 1.673 290 HB3 LEU 40 2HB LEU 40 -7.553 1.456 2.817 291 HG LEU 40 HG LEU 40 -6.442 2.719 0.838 292 HD11 LEU 40 1HD1 LEU 40 -8.212 3.669 -0.719 293 HD12 LEU 40 2HD1 LEU 40 -9.287 2.394 -0.156 294 HD13 LEU 40 3HD1 LEU 40 -7.799 1.985 -1.007 295 HD21 LEU 40 3HD2 LEU 40 -8.986 3.675 2.183 296 HD22 LEU 40 1HD2 LEU 40 -7.894 4.734 1.292 297 HD23 LEU 40 2HD2 LEU 40 -7.335 3.916 2.747 298 H LEU 41 H LEU 41 -5.026 0.470 -0.494 299 HA LEU 41 HA LEU 41 -2.867 0.279 1.477 300 HB2 LEU 41 1HB LEU 41 -2.992 0.243 -1.538 301 HB3 LEU 41 2HB LEU 41 -1.464 0.374 -0.672 302 HG LEU 41 HG LEU 41 -2.054 -1.722 0.575 303 HD11 LEU 41 1HD1 LEU 41 -4.417 -1.856 0.439 304 HD12 LEU 41 2HD1 LEU 41 -3.855 -3.125 -0.646 305 HD13 LEU 41 3HD1 LEU 41 -4.418 -1.590 -1.305 306 HD21 LEU 41 3HD2 LEU 41 -0.629 -1.676 -1.490 307 HD22 LEU 41 1HD2 LEU 41 -2.073 -2.008 -2.447 308 HD23 LEU 41 2HD2 LEU 41 -1.494 -3.198 -1.281 309 H GLY 42 H GLY 42 -1.075 1.808 1.370 310 HA2 GLY 42 1HA GLY 42 -1.569 4.409 0.174 311 HA3 GLY 42 2HA GLY 42 -1.562 4.391 1.932 312 H LEU 43 H LEU 43 0.272 5.535 -0.197 313 HA LEU 43 HA LEU 43 2.798 4.504 0.957 314 HB2 LEU 43 1HB LEU 43 2.489 3.682 -1.383 315 HB3 LEU 43 2HB LEU 43 2.426 5.354 -1.927 316 HG LEU 43 HG LEU 43 4.699 5.717 -0.961 317 HD11 LEU 43 1HD1 LEU 43 5.033 4.139 0.737 318 HD12 LEU 43 2HD1 LEU 43 5.952 3.419 -0.579 319 HD13 LEU 43 3HD1 LEU 43 4.334 2.824 -0.210 320 HD21 LEU 43 3HD2 LEU 43 5.874 4.592 -2.747 321 HD22 LEU 43 1HD2 LEU 43 4.275 5.019 -3.357 322 HD23 LEU 43 2HD2 LEU 43 4.617 3.360 -2.865 323 H VAL 44 H VAL 44 4.221 6.056 1.618 324 HA VAL 44 HA VAL 44 3.500 8.883 1.017 325 HB VAL 44 HB VAL 44 4.416 7.707 3.637 326 HG11 VAL 44 1HG1 VAL 44 3.994 10.540 2.692 327 HG12 VAL 44 2HG1 VAL 44 5.402 9.859 3.500 328 HG13 VAL 44 3HG1 VAL 44 3.908 10.115 4.399 329 HG21 VAL 44 3HG2 VAL 44 1.837 9.149 2.998 330 HG22 VAL 44 1HG2 VAL 44 2.221 8.205 4.437 331 HG23 VAL 44 2HG2 VAL 44 1.985 7.396 2.887 332 H ARG 45 H ARG 45 5.030 10.002 0.127 333 HA ARG 45 HA ARG 45 7.837 9.099 0.303 334 HB2 ARG 45 1HB ARG 45 6.866 9.353 -1.966 335 HB3 ARG 45 2HB ARG 45 6.531 11.049 -1.616 336 HG2 ARG 45 1HG ARG 45 8.934 11.458 -1.265 337 HG3 ARG 45 2HG ARG 45 9.274 9.758 -1.584 338 HD2 ARG 45 1HD ARG 45 8.213 10.040 -3.844 339 HD3 ARG 45 2HD ARG 45 8.094 11.766 -3.518 340 HE ARG 45 HE ARG 45 10.765 10.944 -3.115 341 HH11 ARG 45 1HH2 ARG 45 8.397 11.363 -5.603 342 HH12 ARG 45 2HH2 ARG 45 9.559 11.675 -6.849 343 HH21 ARG 45 1HH1 ARG 45 12.294 11.351 -4.744 344 HH22 ARG 45 2HH1 ARG 45 11.766 11.669 -6.361 345 H TYR 46 H TYR 46 9.073 10.146 1.637 346 HA TYR 46 HA TYR 46 8.410 12.938 2.402 347 HB2 TYR 46 1HB TYR 46 8.203 11.007 4.118 348 HB3 TYR 46 2HB TYR 46 9.965 10.981 4.091 349 HD1 TYR 46 HD1 TYR 46 7.157 13.466 4.301 350 HD2 TYR 46 HD2 TYR 46 11.071 12.319 5.646 351 HE1 TYR 46 HE1 TYR 46 7.194 15.403 5.845 352 HE2 TYR 46 HE2 TYR 46 11.108 14.259 7.189 353 HH TYR 46 HH TYR 46 9.844 16.649 7.155 354 H ARG 47 H ARG 47 9.903 14.411 1.787 355 HA ARG 47 HA ARG 47 12.696 13.497 1.319 356 HB2 ARG 47 1HB ARG 47 11.482 13.841 -0.820 357 HB3 ARG 47 2HB ARG 47 11.168 15.511 -0.348 358 HG2 ARG 47 1HG ARG 47 13.581 15.959 -0.234 359 HG3 ARG 47 2HG ARG 47 13.926 14.277 -0.638 360 HD2 ARG 47 1HD ARG 47 14.120 15.641 -2.649 361 HD3 ARG 47 2HD ARG 47 12.722 14.581 -2.795 362 HE ARG 47 HE ARG 47 11.317 16.456 -2.641 363 HH11 ARG 47 1HH2 ARG 47 14.633 17.254 -2.035 364 HH12 ARG 47 2HH2 ARG 47 14.385 18.963 -2.156 365 HH21 ARG 47 1HH1 ARG 47 10.988 18.693 -2.800 366 HH22 ARG 47 2HH1 ARG 47 12.322 19.779 -2.588 367 H LEU 48 H LEU 48 14.110 14.509 2.547 368 HA LEU 48 HA LEU 48 13.407 16.945 3.963 369 HB2 LEU 48 1HB LEU 48 15.816 15.131 3.975 370 HB3 LEU 48 2HB LEU 48 15.802 16.647 4.857 371 HG LEU 48 HG LEU 48 15.138 14.539 6.164 372 HD11 LEU 48 1HD1 LEU 48 13.675 15.771 7.548 373 HD12 LEU 48 2HD1 LEU 48 12.941 16.618 6.191 374 HD13 LEU 48 3HD1 LEU 48 14.572 17.035 6.712 375 HD21 LEU 48 3HD2 LEU 48 13.644 13.697 4.269 376 HD22 LEU 48 1HD2 LEU 48 12.486 14.933 4.755 377 HD23 LEU 48 2HD2 LEU 48 12.943 13.654 5.878 378 H GLU 49 H GLU 49 15.680 18.330 4.157 379 HA GLU 49 HA GLU 49 15.915 19.554 1.516 380 HB2 GLU 49 1HB GLU 49 16.870 20.374 4.268 381 HB3 GLU 49 2HB GLU 49 17.168 21.310 2.802 382 HG2 GLU 49 1HG GLU 49 14.769 21.538 2.413 383 HG3 GLU 49 2HG GLU 49 14.419 20.512 3.803 384 H ASN 50 H ASN 50 18.096 18.403 4.090 385 HA ASN 50 HA ASN 50 20.502 18.644 2.682 386 HB2 ASN 50 1HB ASN 50 21.341 16.860 4.242 387 HB3 ASN 50 2HB ASN 50 20.542 18.208 5.052 388 HD21 ASN 50 2HD2 ASN 50 18.818 17.681 6.417 389 HD22 ASN 50 1HD2 ASN 50 18.056 16.165 6.462 390 H ASP 51 H ASP 51 18.290 15.869 2.935 391 HA ASP 51 HA ASP 51 18.271 14.874 0.455 392 HB2 ASP 51 1HB ASP 51 20.572 14.673 0.067 393 HB3 ASP 51 2HB ASP 51 20.919 14.227 1.735 394 H ALA 52 H ALA 52 19.433 13.585 3.560 395 HA ALA 52 HA ALA 52 18.508 11.170 3.901 396 HB1 ALA 52 3HB ALA 52 19.312 12.402 5.799 397 HB2 ALA 52 1HB ALA 52 17.717 11.770 6.208 398 HB3 ALA 52 2HB ALA 52 17.907 13.467 5.767 399 H GLN 53 H GLN 53 16.834 10.167 3.063 400 HA GLN 53 HA GLN 53 14.111 11.150 3.589 401 HB2 GLN 53 1HB GLN 53 13.450 10.669 1.252 402 HB3 GLN 53 2HB GLN 53 14.647 11.962 1.344 403 HG2 GLN 53 1HG GLN 53 16.435 10.257 0.914 404 HG3 GLN 53 2HG GLN 53 15.169 9.057 0.660 405 HE21 GLN 53 2HE2 GLN 53 15.489 12.486 -0.406 406 HE22 GLN 53 1HE2 GLN 53 15.248 12.148 -2.051 407 H GLU 54 H GLU 54 12.465 9.482 3.164 408 HA GLU 54 HA GLU 54 13.282 6.748 2.845 409 HB2 GLU 54 1HB GLU 54 13.902 7.211 5.243 410 HB3 GLU 54 2HB GLU 54 12.197 7.524 5.565 411 HG2 GLU 54 1HG GLU 54 11.583 5.276 5.016 412 HG3 GLU 54 2HG GLU 54 13.167 4.938 4.322 413 H HIS 55 H HIS 55 11.375 5.258 3.114 414 HA HIS 55 HA HIS 55 8.770 6.611 2.657 415 HB2 HIS 55 1HB HIS 55 9.836 4.304 1.015 416 HB3 HIS 55 2HB HIS 55 8.315 5.161 0.779 417 HD2 HIS 55 HD2 HIS 55 8.548 7.277 -0.982 418 HE1 HIS 55 HE1 HIS 55 12.744 7.705 -0.821 419 HE2 HIS 55 HE2 HIS 55 10.623 8.541 -1.937 420 H ALA 56 H ALA 56 6.940 5.201 3.005 421 HA ALA 56 HA ALA 56 7.410 2.649 4.356 422 HB1 ALA 56 3HB ALA 56 6.146 3.265 6.312 423 HB2 ALA 56 1HB ALA 56 5.752 4.840 5.626 424 HB3 ALA 56 2HB ALA 56 7.410 4.478 6.105 425 H LEU 57 H LEU 57 5.743 1.219 3.984 426 HA LEU 57 HA LEU 57 3.551 2.179 2.248 427 HB2 LEU 57 1HB LEU 57 5.082 0.253 1.562 428 HB3 LEU 57 2HB LEU 57 4.302 -0.696 2.817 429 HG LEU 57 HG LEU 57 2.814 0.693 0.562 430 HD11 LEU 57 1HD1 LEU 57 3.868 -2.127 0.846 431 HD12 LEU 57 2HD1 LEU 57 4.103 -1.003 -0.494 432 HD13 LEU 57 3HD1 LEU 57 2.523 -1.743 -0.227 433 HD21 LEU 57 3HD2 LEU 57 2.006 -1.078 2.863 434 HD22 LEU 57 1HD2 LEU 57 1.107 -1.190 1.350 435 HD23 LEU 57 2HD2 LEU 57 1.194 0.342 2.207 436 H PHE 58 H PHE 58 1.996 2.931 3.546 437 HA PHE 58 HA PHE 58 1.249 1.582 5.996 438 HB2 PHE 58 1HB PHE 58 0.174 4.024 4.578 439 HB3 PHE 58 2HB PHE 58 -0.451 3.426 6.113 440 HD1 PHE 58 HD1 PHE 58 1.102 3.301 8.117 441 HD2 PHE 58 HD2 PHE 58 2.186 5.280 4.466 442 HE1 PHE 58 HE1 PHE 58 2.905 4.514 9.314 443 HE2 PHE 58 HE2 PHE 58 3.997 6.490 5.659 444 HZ PHE 58 HZ PHE 58 4.356 6.107 8.084 445 H LEU 59 H LEU 59 -0.805 0.798 6.464 446 HA LEU 59 HA LEU 59 -2.467 0.011 4.138 447 HB2 LEU 59 1HB LEU 59 -1.228 -1.943 5.142 448 HB3 LEU 59 2HB LEU 59 -2.074 -1.634 6.656 449 HG LEU 59 HG LEU 59 -4.254 -1.850 5.398 450 HD11 LEU 59 1HD1 LEU 59 -3.846 -1.524 3.135 451 HD12 LEU 59 2HD1 LEU 59 -3.883 -3.281 3.195 452 HD13 LEU 59 3HD1 LEU 59 -2.336 -2.432 3.159 453 HD21 LEU 59 3HD2 LEU 59 -2.335 -4.197 5.468 454 HD22 LEU 59 1HD2 LEU 59 -4.061 -4.368 5.144 455 HD23 LEU 59 2HD2 LEU 59 -3.514 -3.737 6.698 456 H TYR 60 H TYR 60 -4.421 0.794 4.239 457 HA TYR 60 HA TYR 60 -5.505 1.812 6.815 458 HB2 TYR 60 1HB TYR 60 -5.844 2.635 3.931 459 HB3 TYR 60 2HB TYR 60 -6.970 3.166 5.176 460 HD1 TYR 60 HD1 TYR 60 -3.412 3.266 4.070 461 HD2 TYR 60 HD2 TYR 60 -6.379 4.894 6.721 462 HE1 TYR 60 HE1 TYR 60 -1.877 5.118 4.661 463 HE2 TYR 60 HE2 TYR 60 -4.834 6.738 7.317 464 HH TYR 60 HH TYR 60 -2.037 6.884 7.232 465 H THR 61 H THR 61 -7.463 0.891 7.521 466 HA THR 61 HA THR 61 -8.540 -1.278 5.895 467 HB THR 61 HB THR 61 -10.075 -1.668 7.704 468 HG1 THR 61 HG1 THR 61 -9.086 0.406 9.245 469 HG21 THR 61 3HG2 THR 61 -7.352 -1.942 7.955 470 HG22 THR 61 1HG2 THR 61 -8.518 -2.538 9.141 471 HG23 THR 61 2HG2 THR 61 -7.746 -0.974 9.379 472 H HIS 62 H HIS 62 -10.867 -1.323 5.347 473 HA HIS 62 HA HIS 62 -12.377 1.077 5.403 474 HB2 HIS 62 1HB HIS 62 -12.194 1.893 3.222 475 HB3 HIS 62 2HB HIS 62 -10.530 1.457 3.594 476 HD2 HIS 62 HD2 HIS 62 -9.693 -1.030 2.358 477 HE1 HIS 62 HE1 HIS 62 -12.873 -1.068 -0.411 478 HE2 HIS 62 HE2 HIS 62 -10.633 -2.123 0.178 479 H ARG 63 H ARG 63 -14.484 0.786 4.601 480 HA ARG 63 HA ARG 63 -15.386 -1.919 4.703 481 HB2 ARG 63 1HB ARG 63 -17.024 0.452 3.794 482 HB3 ARG 63 2HB ARG 63 -17.594 -1.048 4.520 483 HG2 ARG 63 1HG ARG 63 -16.435 -0.497 6.612 484 HG3 ARG 63 2HG ARG 63 -15.852 1.004 5.897 485 HD2 ARG 63 1HD ARG 63 -17.805 1.523 7.233 486 HD3 ARG 63 2HD ARG 63 -18.242 1.687 5.533 487 HE ARG 63 HE ARG 63 -18.820 -0.946 6.398 488 HH11 ARG 63 1HH2 ARG 63 -19.846 2.341 6.814 489 HH12 ARG 63 2HH2 ARG 63 -21.495 1.925 7.144 490 HH21 ARG 63 1HH1 ARG 63 -20.979 -1.488 6.835 491 HH22 ARG 63 2HH1 ARG 63 -22.135 -0.239 7.156 492 H ARG 64 H ARG 64 -17.446 -1.830 2.793 493 HA ARG 64 HA ARG 64 -16.102 -2.896 0.537 494 HB2 ARG 64 1HB ARG 64 -18.982 -2.063 0.955 495 HB3 ARG 64 2HB ARG 64 -18.397 -2.939 -0.460 496 HG2 ARG 64 1HG ARG 64 -17.612 -4.772 0.973 497 HG3 ARG 64 2HG ARG 64 -18.151 -3.891 2.405 498 HD2 ARG 64 1HD ARG 64 -20.473 -3.941 1.562 499 HD3 ARG 64 2HD ARG 64 -19.938 -4.829 0.140 500 HE ARG 64 HE ARG 64 -20.364 -5.910 2.779 501 HH11 ARG 64 1HH2 ARG 64 -18.612 -6.186 -0.192 502 HH12 ARG 64 2HH2 ARG 64 -18.315 -7.884 -0.021 503 HH21 ARG 64 1HH1 ARG 64 -19.978 -8.138 3.011 504 HH22 ARG 64 2HH1 ARG 64 -19.087 -8.988 1.793 505 H MET 65 H MET 65 -17.599 0.268 1.221 506 HA MET 65 HA MET 65 -16.362 1.317 -1.252 507 HB2 MET 65 1HB MET 65 -18.389 2.526 -1.797 508 HB3 MET 65 2HB MET 65 -18.783 0.814 -1.644 509 HG2 MET 65 1HG MET 65 -19.429 1.291 0.770 510 HG3 MET 65 2HG MET 65 -19.280 3.006 0.388 511 HE1 MET 65 3HE MET 65 -22.492 0.030 -0.857 512 HE2 MET 65 1HE MET 65 -21.331 -0.054 0.476 513 HE3 MET 65 2HE MET 65 -20.794 -0.310 -1.184 514 H ALA 66 H ALA 66 -15.672 1.462 1.638 515 HA ALA 66 HA ALA 66 -16.292 4.198 2.427 516 HB1 ALA 66 3HB ALA 66 -14.794 3.706 4.347 517 HB2 ALA 66 1HB ALA 66 -14.461 2.132 3.638 518 HB3 ALA 66 2HB ALA 66 -16.092 2.531 4.167 519 H ILE 67 H ILE 67 -14.876 3.712 -0.081 520 HA ILE 67 HA ILE 67 -12.122 4.236 0.016 521 HB ILE 67 HB ILE 67 -14.225 4.877 -2.070 522 HG12 ILE 67 1HG1 ILE 67 -12.124 2.694 -1.974 523 HG13 ILE 67 2HG1 ILE 67 -13.783 2.472 -1.424 524 HG21 ILE 67 1HG2 ILE 67 -12.184 4.926 -3.614 525 HG22 ILE 67 2HG2 ILE 67 -11.212 5.104 -2.156 526 HG23 ILE 67 3HG2 ILE 67 -12.404 6.332 -2.574 527 HD11 ILE 67 3HD1 ILE 67 -13.624 1.682 -3.714 528 HD12 ILE 67 1HD1 ILE 67 -12.892 3.203 -4.229 529 HD13 ILE 67 2HD1 ILE 67 -14.575 3.168 -3.702 530 H THR 68 H THR 68 -14.856 6.384 -0.144 531 HA THR 68 HA THR 68 -14.034 8.812 -0.750 532 HB THR 68 HB THR 68 -15.604 8.187 1.745 533 HG1 THR 68 HG1 THR 68 -16.908 7.551 0.228 534 HG21 THR 68 3HG2 THR 68 -14.963 10.452 1.968 535 HG22 THR 68 1HG2 THR 68 -16.543 10.529 1.190 536 HG23 THR 68 2HG2 THR 68 -15.077 10.747 0.233 537 H GLY 69 H GLY 69 -12.898 7.287 2.317 538 HA2 GLY 69 1HA GLY 69 -10.723 7.959 3.170 539 HA3 GLY 69 2HA GLY 69 -11.049 9.594 2.603 540 H ASP 70 H ASP 70 -13.936 8.883 3.492 541 HA ASP 70 HA ASP 70 -13.890 10.340 5.912 542 HB2 ASP 70 1HB ASP 70 -15.811 10.297 4.347 543 HB3 ASP 70 2HB ASP 70 -16.112 8.620 4.801 544 H ASP 71 H ASP 71 -14.344 6.797 5.287 545 HA ASP 71 HA ASP 71 -14.107 6.419 8.241 546 HB2 ASP 71 1HB ASP 71 -15.764 5.013 6.188 547 HB3 ASP 71 2HB ASP 71 -15.312 4.138 7.655 548 H VAL 72 H VAL 72 -11.746 6.585 6.764 549 HA VAL 72 HA VAL 72 -10.753 3.827 7.157 550 HB VAL 72 HB VAL 72 -9.589 3.793 5.109 551 HG11 VAL 72 1HG1 VAL 72 -12.221 5.152 4.495 552 HG12 VAL 72 2HG1 VAL 72 -12.058 3.454 4.943 553 HG13 VAL 72 3HG1 VAL 72 -11.333 4.046 3.448 554 HG21 VAL 72 3HG2 VAL 72 -9.735 5.888 3.576 555 HG22 VAL 72 1HG2 VAL 72 -8.610 5.938 4.933 556 HG23 VAL 72 2HG2 VAL 72 -10.169 6.752 5.052 557 H SER 73 H SER 73 -9.118 3.865 8.621 558 HA SER 73 HA SER 73 -7.264 6.166 8.612 559 HB2 SER 73 1HB SER 73 -8.659 4.924 11.001 560 HB3 SER 73 2HB SER 73 -7.296 6.032 11.118 561 HG SER 73 HG SER 73 -8.715 7.564 10.936 562 H LEU 74 H LEU 74 -5.174 5.565 9.589 563 HA LEU 74 HA LEU 74 -4.003 3.379 8.578 564 HB2 LEU 74 1HB LEU 74 -3.417 4.825 11.116 565 HB3 LEU 74 2HB LEU 74 -2.378 3.508 10.591 566 HG LEU 74 HG LEU 74 -3.098 5.836 8.802 567 HD11 LEU 74 1HD1 LEU 74 -1.055 6.936 9.456 568 HD12 LEU 74 2HD1 LEU 74 -0.569 5.563 10.448 569 HD13 LEU 74 3HD1 LEU 74 -1.932 6.568 10.938 570 HD21 LEU 74 3HD2 LEU 74 -2.213 4.143 7.446 571 HD22 LEU 74 1HD2 LEU 74 -1.133 3.552 8.700 572 HD23 LEU 74 2HD2 LEU 74 -0.766 5.049 7.852 573 H ASP 75 H ASP 75 -3.577 1.331 8.939 574 HA ASP 75 HA ASP 75 -5.051 -0.068 11.080 575 HB2 ASP 75 1HB ASP 75 -5.649 -0.489 8.619 576 HB3 ASP 75 2HB ASP 75 -4.086 -1.283 8.490 577 H GLN 76 H GLN 76 -2.216 -0.730 8.931 578 HA GLN 76 HA GLN 76 -0.700 -1.515 11.341 579 HB2 GLN 76 1HB GLN 76 -1.594 -3.391 9.583 580 HB3 GLN 76 2HB GLN 76 -0.058 -2.982 8.822 581 HG2 GLN 76 1HG GLN 76 1.103 -3.377 10.988 582 HG3 GLN 76 2HG GLN 76 -0.435 -3.817 11.720 583 HE21 GLN 76 2HE2 GLN 76 1.824 -4.795 9.110 584 HE22 GLN 76 1HE2 GLN 76 1.364 -6.428 9.124 585 H ILE 77 H ILE 77 1.643 -2.194 9.849 586 HA ILE 77 HA ILE 77 2.460 0.201 8.426 587 HB ILE 77 HB ILE 77 3.515 -0.531 11.166 588 HG12 ILE 77 1HG1 ILE 77 2.685 2.119 9.925 589 HG13 ILE 77 2HG1 ILE 77 1.677 1.133 10.973 590 HG21 ILE 77 1HG2 ILE 77 5.604 -0.251 10.230 591 HG22 ILE 77 2HG2 ILE 77 5.223 1.450 10.425 592 HG23 ILE 77 3HG2 ILE 77 4.997 0.677 8.862 593 HD11 ILE 77 3HD1 ILE 77 4.255 2.500 11.713 594 HD12 ILE 77 1HD1 ILE 77 3.486 1.277 12.725 595 HD13 ILE 77 2HD1 ILE 77 2.647 2.790 12.377 596 H VAL 78 H VAL 78 3.363 -0.671 6.691 597 HA VAL 78 HA VAL 78 5.136 -3.041 6.987 598 HB VAL 78 HB VAL 78 3.665 -2.141 4.506 599 HG11 VAL 78 1HG1 VAL 78 5.082 -4.728 5.209 600 HG12 VAL 78 2HG1 VAL 78 5.742 -3.468 4.167 601 HG13 VAL 78 3HG1 VAL 78 4.300 -4.356 3.673 602 HG21 VAL 78 3HG2 VAL 78 2.085 -2.851 6.268 603 HG22 VAL 78 1HG2 VAL 78 2.993 -4.349 6.472 604 HG23 VAL 78 2HG2 VAL 78 2.148 -4.029 4.958 605 HA PRO 79 HA PRO 79 7.744 0.466 5.559 606 HB2 PRO 79 1HB PRO 79 9.875 0.072 7.176 607 HB3 PRO 79 2HB PRO 79 8.388 0.853 7.755 608 HG2 PRO 79 1HG PRO 79 9.351 -1.934 8.187 609 HG3 PRO 79 2HG PRO 79 8.482 -0.857 9.294 610 HD2 PRO 79 1HD PRO 79 7.302 -2.905 7.776 611 HD3 PRO 79 2HD PRO 79 6.423 -1.555 8.519 612 H LEU 80 H LEU 80 9.158 0.413 3.895 613 HA LEU 80 HA LEU 80 9.841 -1.994 2.660 614 HB2 LEU 80 1HB LEU 80 10.793 0.847 2.357 615 HB3 LEU 80 2HB LEU 80 11.390 -0.449 1.322 616 HG LEU 80 HG LEU 80 8.432 0.075 1.713 617 HD11 LEU 80 1HD1 LEU 80 10.404 1.399 -0.137 618 HD12 LEU 80 2HD1 LEU 80 9.109 2.122 0.812 619 HD13 LEU 80 3HD1 LEU 80 8.722 1.196 -0.635 620 HD21 LEU 80 3HD2 LEU 80 8.529 -0.971 -0.707 621 HD22 LEU 80 1HD2 LEU 80 8.662 -2.031 0.692 622 HD23 LEU 80 2HD2 LEU 80 10.108 -1.560 -0.198 623 H SER 81 H SER 81 11.312 -3.347 2.999 624 HA SER 81 HA SER 81 13.899 -2.615 4.245 625 HB2 SER 81 1HB SER 81 13.787 -4.718 5.594 626 HB3 SER 81 2HB SER 81 12.586 -3.518 6.063 627 HG SER 81 HG SER 81 11.034 -4.670 4.994 628 H LYS 82 H LYS 82 15.513 -4.417 3.996 629 HA LYS 82 HA LYS 82 15.845 -5.020 1.302 630 HB2 LYS 82 1HB LYS 82 17.650 -5.009 3.014 631 HB3 LYS 82 2HB LYS 82 17.023 -6.534 3.641 632 HG2 LYS 82 1HG LYS 82 17.395 -7.612 1.473 633 HG3 LYS 82 2HG LYS 82 17.960 -6.084 0.793 634 HD2 LYS 82 1HD LYS 82 19.809 -6.043 2.437 635 HD3 LYS 82 2HD LYS 82 19.257 -7.586 3.088 636 HE2 LYS 82 1HE LYS 82 19.618 -8.647 0.891 637 HE3 LYS 82 2HE LYS 82 20.163 -7.105 0.234 638 HZ1 LYS 82 3HZ LYS 82 21.799 -7.201 2.228 639 HZ2 LYS 82 1HZ LYS 82 22.138 -8.079 0.817 640 HZ3 LYS 82 2HZ LYS 82 21.487 -8.869 2.174 641 H ASP 83 H ASP 83 14.582 -7.101 3.925 642 HA ASP 83 HA ASP 83 14.267 -9.428 2.380 643 HB2 ASP 83 1HB ASP 83 12.855 -8.403 4.843 644 HB3 ASP 83 2HB ASP 83 12.542 -9.997 4.159 645 H PHE 84 H PHE 84 12.726 -6.454 2.112 646 HA PHE 84 HA PHE 84 10.090 -7.260 1.344 647 HB2 PHE 84 1HB PHE 84 10.890 -4.907 2.050 648 HB3 PHE 84 2HB PHE 84 11.480 -4.753 0.396 649 HD1 PHE 84 HD1 PHE 84 9.830 -5.054 -1.526 650 HD2 PHE 84 HD2 PHE 84 8.587 -4.612 2.566 651 HE1 PHE 84 HE1 PHE 84 7.553 -4.426 -2.282 652 HE2 PHE 84 HE2 PHE 84 6.313 -3.979 1.809 653 HZ PHE 84 HZ PHE 84 5.795 -3.892 -0.616 654 H MET 85 H MET 85 9.301 -7.741 -0.649 655 HA MET 85 HA MET 85 10.728 -7.341 -3.081 656 HB2 MET 85 1HB MET 85 12.069 -9.237 -2.192 657 HB3 MET 85 2HB MET 85 10.601 -10.210 -2.118 658 HG2 MET 85 1HG MET 85 10.301 -10.040 -4.528 659 HG3 MET 85 2HG MET 85 11.660 -8.923 -4.653 660 HE1 MET 85 3HE MET 85 10.878 -12.890 -4.951 661 HE2 MET 85 1HE MET 85 10.353 -12.116 -3.449 662 HE3 MET 85 2HE MET 85 11.664 -13.291 -3.428 663 H LEU 86 H LEU 86 9.309 -7.383 -4.752 664 HA LEU 86 HA LEU 86 6.551 -8.245 -4.155 665 HB2 LEU 86 1HB LEU 86 5.948 -6.959 -6.151 666 HB3 LEU 86 2HB LEU 86 6.896 -5.971 -5.044 667 HG LEU 86 HG LEU 86 8.902 -7.062 -6.584 668 HD11 LEU 86 1HD1 LEU 86 6.849 -6.373 -8.672 669 HD12 LEU 86 2HD1 LEU 86 6.893 -8.008 -8.023 670 HD13 LEU 86 3HD1 LEU 86 8.315 -7.342 -8.816 671 HD21 LEU 86 3HD2 LEU 86 8.742 -4.854 -7.902 672 HD22 LEU 86 1HD2 LEU 86 8.870 -4.730 -6.147 673 HD23 LEU 86 2HD2 LEU 86 7.307 -4.519 -6.934 674 H GLU 87 H GLU 87 5.753 -10.124 -4.991 675 HA GLU 87 HA GLU 87 7.270 -11.406 -7.199 676 HB2 GLU 87 1HB GLU 87 5.813 -12.645 -4.858 677 HB3 GLU 87 2HB GLU 87 6.415 -13.556 -6.239 678 HG2 GLU 87 1HG GLU 87 8.697 -12.778 -5.784 679 HG3 GLU 87 2HG GLU 87 8.114 -11.827 -4.420 680 H GLU 88 H GLU 88 6.204 -11.646 -8.998 681 HA GLU 88 HA GLU 88 3.344 -11.140 -9.145 682 HB2 GLU 88 1HB GLU 88 5.373 -11.921 -11.264 683 HB3 GLU 88 2HB GLU 88 3.682 -11.546 -11.591 684 HG2 GLU 88 1HG GLU 88 4.739 -9.485 -11.980 685 HG3 GLU 88 2HG GLU 88 4.173 -9.313 -10.322 686 H VAL 89 H VAL 89 1.797 -12.691 -9.920 687 HA VAL 89 HA VAL 89 2.615 -15.518 -9.464 688 HB VAL 89 HB VAL 89 -0.147 -14.368 -9.228 689 HG11 VAL 89 1HG1 VAL 89 -0.495 -16.519 -7.944 690 HG12 VAL 89 2HG1 VAL 89 1.094 -17.024 -8.520 691 HG13 VAL 89 3HG1 VAL 89 -0.204 -16.716 -9.673 692 HG21 VAL 89 3HG2 VAL 89 0.202 -14.542 -6.770 693 HG22 VAL 89 1HG2 VAL 89 1.299 -13.374 -7.507 694 HG23 VAL 89 2HG2 VAL 89 1.885 -14.978 -7.066 695 H SER 90 H SER 90 2.251 -16.954 -11.012 696 HA SER 90 HA SER 90 1.980 -16.295 -13.667 697 HB2 SER 90 1HB SER 90 1.291 -18.874 -12.257 698 HB3 SER 90 2HB SER 90 1.326 -18.711 -14.011 699 HG SER 90 HG SER 90 3.455 -18.499 -13.959 700 HA PRO 91 HA PRO 91 -2.389 -15.337 -13.960 701 HB2 PRO 91 1HB PRO 91 -2.704 -15.376 -16.679 702 HB3 PRO 91 2HB PRO 91 -1.883 -14.059 -15.820 703 HG2 PRO 91 1HG PRO 91 -0.708 -16.376 -17.294 704 HG3 PRO 91 2HG PRO 91 -0.194 -14.680 -17.269 705 HD2 PRO 91 1HD PRO 91 1.045 -16.628 -15.789 706 HD3 PRO 91 2HD PRO 91 0.979 -14.925 -15.280 707 H ASP 92 H ASP 92 -1.204 -18.023 -15.977 708 HA ASP 92 HA ASP 92 -2.119 -20.064 -16.508 709 HB2 ASP 92 1HB ASP 92 -3.514 -19.552 -13.873 710 HB3 ASP 92 2HB ASP 92 -3.710 -21.044 -14.787 711 H GLY 93 H GLY 93 -3.232 -17.667 -17.618 712 HA2 GLY 93 1HA GLY 93 -6.000 -18.584 -18.191 713 HA3 GLY 93 2HA GLY 93 -5.629 -16.882 -17.936 714 H GLU 94 H GLU 94 -6.759 -18.146 -20.297 715 HA GLU 94 HA GLU 94 -4.632 -18.005 -22.311 716 HB2 GLU 94 1HB GLU 94 -6.831 -18.456 -23.794 717 HB3 GLU 94 2HB GLU 94 -6.003 -19.753 -22.936 718 HG2 GLU 94 1HG GLU 94 -8.221 -18.169 -21.635 719 HG3 GLU 94 2HG GLU 94 -8.556 -19.585 -22.627 720 H LEU 95 H LEU 95 -7.935 -16.835 -22.780 721 HA LEU 95 HA LEU 95 -7.124 -14.564 -24.249 722 HB2 LEU 95 1HB LEU 95 -9.369 -15.551 -24.473 723 HB3 LEU 95 2HB LEU 95 -9.746 -15.095 -22.816 724 HG LEU 95 HG LEU 95 -9.360 -12.679 -23.467 725 HD11 LEU 95 1HD1 LEU 95 -9.609 -12.349 -26.045 726 HD12 LEU 95 2HD1 LEU 95 -8.982 -13.993 -26.154 727 HD13 LEU 95 3HD1 LEU 95 -8.018 -12.731 -25.391 728 HD21 LEU 95 3HD2 LEU 95 -11.492 -12.547 -24.849 729 HD22 LEU 95 1HD2 LEU 95 -11.622 -13.424 -23.325 730 HD23 LEU 95 2HD2 LEU 95 -11.499 -14.312 -24.846 731 H TYR 96 H TYR 96 -8.115 -14.981 -20.903 732 HA TYR 96 HA TYR 96 -8.018 -12.224 -20.200 733 HB2 TYR 96 1HB TYR 96 -9.105 -14.244 -18.940 734 HB3 TYR 96 2HB TYR 96 -7.516 -14.414 -18.193 735 HD1 TYR 96 HD1 TYR 96 -10.185 -11.866 -18.882 736 HD2 TYR 96 HD2 TYR 96 -6.945 -13.084 -16.338 737 HE1 TYR 96 HE1 TYR 96 -10.735 -10.033 -17.307 738 HE2 TYR 96 HE2 TYR 96 -7.496 -11.251 -14.763 739 HH TYR 96 HH TYR 96 -9.970 -8.851 -15.516 740 H ILE 97 H ILE 97 -6.347 -10.921 -19.731 741 HA ILE 97 HA ILE 97 -3.729 -12.047 -19.006 742 HB ILE 97 HB ILE 97 -2.782 -10.219 -20.585 743 HG12 ILE 97 1HG1 ILE 97 -5.357 -10.687 -22.083 744 HG13 ILE 97 2HG1 ILE 97 -5.220 -9.354 -20.938 745 HG21 ILE 97 1HG2 ILE 97 -3.061 -11.817 -22.588 746 HG22 ILE 97 2HG2 ILE 97 -3.992 -12.828 -21.484 747 HG23 ILE 97 3HG2 ILE 97 -2.305 -12.461 -21.134 748 HD11 ILE 97 3HD1 ILE 97 -3.469 -9.825 -23.367 749 HD12 ILE 97 1HD1 ILE 97 -3.198 -8.557 -22.170 750 HD13 ILE 97 2HD1 ILE 97 -4.660 -8.542 -23.155 751 H LEU 98 H LEU 98 -5.586 -10.864 -17.282 752 HA LEU 98 HA LEU 98 -5.793 -9.195 -15.684 753 HB2 LEU 98 1HB LEU 98 -2.880 -8.993 -16.470 754 HB3 LEU 98 2HB LEU 98 -3.579 -7.920 -15.266 755 HG LEU 98 HG LEU 98 -4.237 -9.808 -13.893 756 HD11 LEU 98 1HD1 LEU 98 -4.817 -11.497 -15.462 757 HD12 LEU 98 2HD1 LEU 98 -3.395 -12.122 -14.628 758 HD13 LEU 98 3HD1 LEU 98 -3.235 -11.422 -16.238 759 HD21 LEU 98 3HD2 LEU 98 -2.079 -10.436 -13.137 760 HD22 LEU 98 1HD2 LEU 98 -1.794 -8.898 -13.953 761 HD23 LEU 98 2HD2 LEU 98 -1.407 -10.412 -14.768 762 H GLY 99 H GLY 99 -7.222 -8.266 -17.511 763 HA2 GLY 99 1HA GLY 99 -6.137 -5.852 -18.776 764 HA3 GLY 99 2HA GLY 99 -7.701 -6.593 -19.103 765 H SER 100 H SER 100 -8.426 -6.836 -16.290 766 HA SER 100 HA SER 100 -8.676 -4.018 -15.442 767 HB2 SER 100 1HB SER 100 -11.024 -4.162 -15.204 768 HB3 SER 100 2HB SER 100 -10.700 -4.872 -16.783 769 HG SER 100 HG SER 100 -12.047 -6.249 -15.677 770 H ASP 101 H ASP 101 -7.123 -6.389 -14.653 771 HA ASP 101 HA ASP 101 -7.368 -6.164 -11.814 772 HB2 ASP 101 1HB ASP 101 -8.324 -8.690 -13.155 773 HB3 ASP 101 2HB ASP 101 -7.655 -8.721 -11.528 774 H VAL 102 H VAL 102 -5.509 -6.938 -10.775 775 HA VAL 102 HA VAL 102 -3.471 -8.268 -12.449 776 HB VAL 102 HB VAL 102 -2.846 -5.953 -12.523 777 HG11 VAL 102 1HG1 VAL 102 -2.272 -4.984 -10.073 778 HG12 VAL 102 2HG1 VAL 102 -3.619 -6.028 -9.636 779 HG13 VAL 102 3HG1 VAL 102 -3.840 -4.748 -10.833 780 HG21 VAL 102 3HG2 VAL 102 -1.148 -7.193 -10.353 781 HG22 VAL 102 1HG2 VAL 102 -0.637 -6.119 -11.654 782 HG23 VAL 102 2HG2 VAL 102 -1.115 -7.776 -12.016 783 H THR 103 H THR 103 -1.826 -9.317 -11.220 784 HA THR 103 HA THR 103 -2.707 -10.049 -8.465 785 HB THR 103 HB THR 103 -1.198 -11.893 -10.326 786 HG1 THR 103 HG1 THR 103 -3.460 -11.114 -10.915 787 HG21 THR 103 3HG2 THR 103 -2.743 -12.223 -7.739 788 HG22 THR 103 1HG2 THR 103 -1.031 -12.536 -8.018 789 HG23 THR 103 2HG2 THR 103 -2.252 -13.581 -8.742 790 H VAL 104 H VAL 104 -1.403 -9.176 -7.069 791 HA VAL 104 HA VAL 104 1.525 -9.247 -7.539 792 HB VAL 104 HB VAL 104 0.808 -6.947 -7.738 793 HG11 VAL 104 1HG1 VAL 104 -0.570 -5.827 -6.105 794 HG12 VAL 104 2HG1 VAL 104 -0.549 -7.235 -5.047 795 HG13 VAL 104 3HG1 VAL 104 -1.408 -7.303 -6.584 796 HG21 VAL 104 3HG2 VAL 104 2.128 -5.949 -6.018 797 HG22 VAL 104 1HG2 VAL 104 2.819 -7.553 -6.262 798 HG23 VAL 104 2HG2 VAL 104 1.763 -7.249 -4.882 799 H GLN 105 H GLN 105 2.605 -10.335 -6.015 800 HA GLN 105 HA GLN 105 1.248 -10.904 -3.428 801 HB2 GLN 105 1HB GLN 105 1.722 -12.818 -5.122 802 HB3 GLN 105 2HB GLN 105 3.412 -12.611 -4.667 803 HG2 GLN 105 1HG GLN 105 1.175 -13.105 -2.684 804 HG3 GLN 105 2HG GLN 105 2.227 -14.363 -3.315 805 HE21 GLN 105 2HE2 GLN 105 1.905 -12.071 -0.816 806 HE22 GLN 105 1HE2 GLN 105 3.507 -12.108 -0.256 807 H LEU 106 H LEU 106 2.140 -9.622 -1.857 808 HA LEU 106 HA LEU 106 4.880 -8.715 -2.096 809 HB2 LEU 106 1HB LEU 106 4.337 -7.389 -0.136 810 HB3 LEU 106 2HB LEU 106 3.034 -7.259 -1.318 811 HG LEU 106 HG LEU 106 2.210 -9.463 0.149 812 HD11 LEU 106 1HD1 LEU 106 4.199 -8.820 1.727 813 HD12 LEU 106 2HD1 LEU 106 2.636 -9.204 2.440 814 HD13 LEU 106 3HD1 LEU 106 3.137 -7.522 2.261 815 HD21 LEU 106 3HD2 LEU 106 0.661 -7.766 -0.401 816 HD22 LEU 106 1HD2 LEU 106 1.583 -6.528 0.451 817 HD23 LEU 106 2HD2 LEU 106 0.716 -7.766 1.361 818 H ASN 107 H ASN 107 6.526 -9.648 -1.233 819 HA ASN 107 HA ASN 107 6.143 -11.707 0.903 820 HB2 ASN 107 1HB ASN 107 8.531 -11.530 -0.905 821 HB3 ASN 107 2HB ASN 107 7.997 -12.884 0.089 822 HD21 ASN 107 2HD2 ASN 107 6.358 -10.762 -2.319 823 HD22 ASN 107 1HD2 ASN 107 5.701 -12.046 -3.208 824 H THR 108 H THR 108 6.193 -9.691 2.379 825 HA THR 108 HA THR 108 8.778 -8.512 2.780 826 HB THR 108 HB THR 108 6.493 -8.523 4.757 827 HG1 THR 108 HG1 THR 108 6.571 -7.548 2.257 828 HG21 THR 108 3HG2 THR 108 8.898 -6.773 4.240 829 HG22 THR 108 1HG2 THR 108 8.359 -7.495 5.757 830 HG23 THR 108 2HG2 THR 108 7.480 -6.136 5.066 831 H ALA 109 H ALA 109 9.646 -8.574 5.097 832 HA ALA 109 HA ALA 109 10.835 -11.003 5.582 833 HB1 ALA 109 3HB ALA 109 10.212 -9.140 7.859 834 HB2 ALA 109 1HB ALA 109 11.318 -8.659 6.577 835 HB3 ALA 109 2HB ALA 109 11.676 -10.078 7.561 836 H GLU 110 H GLU 110 7.774 -9.805 6.934 837 HA GLU 110 HA GLU 110 7.255 -12.536 7.985 838 HB2 GLU 110 1HB GLU 110 6.044 -11.520 9.852 839 HB3 GLU 110 2HB GLU 110 7.713 -10.953 9.827 840 HG2 GLU 110 1HG GLU 110 6.955 -8.913 8.597 841 HG3 GLU 110 2HG GLU 110 5.291 -9.463 8.781 842 H LEU 111 H LEU 111 5.967 -9.576 6.564 843 HA LEU 111 HA LEU 111 3.289 -10.559 6.377 844 HB2 LEU 111 1HB LEU 111 4.543 -8.073 6.039 845 HB3 LEU 111 2HB LEU 111 4.009 -8.484 4.414 846 HG LEU 111 HG LEU 111 1.724 -9.047 5.547 847 HD11 LEU 111 1HD1 LEU 111 2.873 -8.806 7.873 848 HD12 LEU 111 2HD1 LEU 111 1.266 -8.117 7.659 849 HD13 LEU 111 3HD1 LEU 111 2.684 -7.071 7.615 850 HD21 LEU 111 3HD2 LEU 111 2.887 -6.301 5.077 851 HD22 LEU 111 1HD2 LEU 111 1.216 -6.475 5.619 852 HD23 LEU 111 2HD2 LEU 111 1.727 -7.198 4.097 853 H LYS 112 H LYS 112 2.344 -11.668 4.779 854 HA LYS 112 HA LYS 112 3.513 -11.941 2.174 855 HB2 LYS 112 1HB LYS 112 4.891 -13.549 3.483 856 HB3 LYS 112 2HB LYS 112 3.411 -14.419 3.896 857 HG2 LYS 112 1HG LYS 112 2.950 -14.814 1.521 858 HG3 LYS 112 2HG LYS 112 4.385 -13.891 1.073 859 HD2 LYS 112 1HD LYS 112 5.801 -15.505 2.291 860 HD3 LYS 112 2HD LYS 112 4.364 -16.436 2.719 861 HE2 LYS 112 1HE LYS 112 3.886 -16.802 0.325 862 HE3 LYS 112 2HE LYS 112 5.328 -15.878 -0.101 863 HZ1 LYS 112 3HZ LYS 112 5.849 -17.946 1.811 864 HZ2 LYS 112 1HZ LYS 112 6.639 -17.599 0.352 865 HZ3 LYS 112 2HZ LYS 112 5.235 -18.554 0.349 866 H LEU 113 H LEU 113 1.584 -11.306 1.356 867 HA LEU 113 HA LEU 113 -0.612 -13.265 1.553 868 HB2 LEU 113 1HB LEU 113 -0.634 -10.535 2.620 869 HB3 LEU 113 2HB LEU 113 -1.917 -10.762 1.440 870 HG LEU 113 HG LEU 113 -2.756 -11.301 3.651 871 HD11 LEU 113 1HD1 LEU 113 -3.046 -12.923 1.449 872 HD12 LEU 113 2HD1 LEU 113 -3.949 -13.104 2.946 873 HD13 LEU 113 3HD1 LEU 113 -2.514 -14.085 2.661 874 HD21 LEU 113 3HD2 LEU 113 -0.225 -12.131 4.282 875 HD22 LEU 113 1HD2 LEU 113 -1.030 -13.686 4.061 876 HD23 LEU 113 2HD2 LEU 113 -1.653 -12.530 5.230 877 H VAL 114 H VAL 114 -2.471 -12.181 -0.018 878 HA VAL 114 HA VAL 114 -1.143 -11.567 -2.594 879 HB VAL 114 HB VAL 114 -3.396 -13.513 -2.026 880 HG11 VAL 114 1HG1 VAL 114 -4.076 -12.365 -3.997 881 HG12 VAL 114 2HG1 VAL 114 -3.290 -13.834 -4.569 882 HG13 VAL 114 3HG1 VAL 114 -2.428 -12.298 -4.619 883 HG21 VAL 114 3HG2 VAL 114 -0.948 -14.225 -1.786 884 HG22 VAL 114 1HG2 VAL 114 -0.807 -13.959 -3.523 885 HG23 VAL 114 2HG2 VAL 114 -1.923 -15.173 -2.908 886 H PHE 115 H PHE 115 -1.992 -9.829 -3.626 887 HA PHE 115 HA PHE 115 -4.654 -8.844 -2.789 888 HB2 PHE 115 1HB PHE 115 -2.109 -7.311 -3.313 889 HB3 PHE 115 2HB PHE 115 -3.691 -6.547 -3.380 890 HD1 PHE 115 HD2 PHE 115 -1.596 -8.707 -1.151 891 HD2 PHE 115 HD1 PHE 115 -4.655 -5.690 -1.414 892 HE1 PHE 115 HE2 PHE 115 -1.600 -8.481 1.319 893 HE2 PHE 115 HE1 PHE 115 -4.654 -5.487 1.056 894 HZ PHE 115 HZ PHE 115 -3.138 -6.885 2.418 895 H GLN 116 H GLN 116 -5.989 -8.127 -4.343 896 HA GLN 116 HA GLN 116 -5.169 -8.500 -7.170 897 HB2 GLN 116 1HB GLN 116 -7.755 -9.022 -5.722 898 HB3 GLN 116 2HB GLN 116 -7.774 -8.687 -7.451 899 HG2 GLN 116 1HG GLN 116 -5.965 -10.791 -6.253 900 HG3 GLN 116 2HG GLN 116 -7.616 -11.152 -6.757 901 HE21 GLN 116 2HE2 GLN 116 -6.585 -8.721 -8.800 902 HE22 GLN 116 1HE2 GLN 116 -5.992 -9.670 -10.081 903 H LEU 117 H LEU 117 -4.425 -6.365 -7.448 904 HA LEU 117 HA LEU 117 -6.274 -4.143 -6.955 905 HB2 LEU 117 1HB LEU 117 -3.384 -4.442 -7.735 906 HB3 LEU 117 2HB LEU 117 -4.192 -2.917 -8.065 907 HG LEU 117 HG LEU 117 -4.890 -2.855 -5.636 908 HD11 LEU 117 1HD1 LEU 117 -3.547 -4.346 -4.112 909 HD12 LEU 117 2HD1 LEU 117 -3.066 -5.264 -5.538 910 HD13 LEU 117 3HD1 LEU 117 -4.765 -5.187 -5.069 911 HD21 LEU 117 3HD2 LEU 117 -2.737 -1.790 -6.642 912 HD22 LEU 117 1HD2 LEU 117 -1.885 -3.093 -5.814 913 HD23 LEU 117 2HD2 LEU 117 -2.850 -1.942 -4.892 914 HA PRO 118 HA PRO 118 -7.784 -4.000 -11.127 915 HB2 PRO 118 1HB PRO 118 -8.101 -1.321 -11.581 916 HB3 PRO 118 2HB PRO 118 -9.151 -2.243 -10.483 917 HG2 PRO 118 1HG PRO 118 -6.798 -0.521 -9.839 918 HG3 PRO 118 2HG PRO 118 -8.380 -0.599 -9.044 919 HD2 PRO 118 1HD PRO 118 -6.200 -1.844 -8.012 920 HD3 PRO 118 2HD PRO 118 -7.832 -2.524 -7.842 921 H PHE 119 H PHE 119 -6.569 -4.496 -12.878 922 HA PHE 119 HA PHE 119 -4.002 -4.133 -13.388 923 HB2 PHE 119 1HB PHE 119 -5.523 -5.554 -14.671 924 HB3 PHE 119 2HB PHE 119 -6.229 -4.123 -15.422 925 HD1 PHE 119 HD1 PHE 119 -2.894 -5.728 -14.836 926 HD2 PHE 119 HD2 PHE 119 -5.341 -3.374 -17.460 927 HE1 PHE 119 HE1 PHE 119 -1.099 -5.765 -16.540 928 HE2 PHE 119 HE2 PHE 119 -3.547 -3.411 -19.164 929 HZ PHE 119 HZ PHE 119 -1.421 -4.602 -18.705 930 H GLY 120 H GLY 120 -2.639 -2.807 -14.306 931 HA2 GLY 120 1HA GLY 120 -1.739 -0.708 -14.727 932 HA3 GLY 120 2HA GLY 120 -2.882 -0.771 -16.060 933 H SER 121 H SER 121 -3.667 1.251 -16.167 934 HA SER 121 HA SER 121 -4.789 3.165 -15.586 935 HB2 SER 121 1HB SER 121 -6.544 1.481 -15.063 936 HB3 SER 121 2HB SER 121 -5.942 1.401 -13.410 937 HG SER 121 HG SER 121 -6.462 3.566 -13.159 938 H HIS 122 H HIS 122 -5.413 2.790 -12.355 939 HA HIS 122 HA HIS 122 -3.345 4.717 -11.642 940 HB2 HIS 122 1HB HIS 122 -5.817 4.844 -10.954 941 HB3 HIS 122 2HB HIS 122 -5.437 3.572 -9.794 942 HD2 HIS 122 HD2 HIS 122 -4.683 4.681 -7.384 943 HE1 HIS 122 HE1 HIS 122 -3.065 8.296 -8.850 944 HE2 HIS 122 HE2 HIS 122 -3.576 6.961 -6.752 945 H THR 123 H THR 123 -3.625 1.346 -11.636 946 HA THR 123 HA THR 123 -2.236 0.827 -9.173 947 HB THR 123 HB THR 123 -2.788 -0.963 -11.548 948 HG1 THR 123 HG1 THR 123 -4.446 -1.700 -10.273 949 HG21 THR 123 3HG2 THR 123 -1.497 -1.425 -8.862 950 HG22 THR 123 1HG2 THR 123 -0.963 -1.963 -10.455 951 HG23 THR 123 2HG2 THR 123 -2.353 -2.722 -9.686 952 H ARG 124 H ARG 124 -1.326 1.130 -12.582 953 HA ARG 124 HA ARG 124 1.231 0.038 -12.473 954 HB2 ARG 124 1HB ARG 124 0.065 0.708 -14.548 955 HB3 ARG 124 2HB ARG 124 0.292 2.399 -14.118 956 HG2 ARG 124 1HG ARG 124 2.751 2.042 -14.118 957 HG3 ARG 124 2HG ARG 124 2.487 0.370 -14.610 958 HD2 ARG 124 1HD ARG 124 1.518 2.779 -16.164 959 HD3 ARG 124 2HD ARG 124 3.007 1.910 -16.519 960 HE ARG 124 HE ARG 124 0.305 1.017 -17.087 961 HH11 ARG 124 1HH2 ARG 124 3.619 0.163 -16.579 962 HH12 ARG 124 2HH2 ARG 124 3.518 -1.323 -17.464 963 HH21 ARG 124 1HH1 ARG 124 0.165 -0.931 -18.253 964 HH22 ARG 124 2HH1 ARG 124 1.562 -1.942 -18.411 965 H THR 125 H THR 125 0.156 3.332 -11.775 966 HA THR 125 HA THR 125 2.630 4.548 -11.466 967 HB THR 125 HB THR 125 0.226 5.104 -9.718 968 HG1 THR 125 HG1 THR 125 -0.748 5.530 -11.513 969 HG21 THR 125 3HG2 THR 125 2.300 6.294 -9.158 970 HG22 THR 125 1HG2 THR 125 1.097 7.401 -9.817 971 HG23 THR 125 2HG2 THR 125 2.435 6.851 -10.826 972 H PHE 126 H PHE 126 0.688 2.731 -9.132 973 HA PHE 126 HA PHE 126 2.309 3.081 -6.877 974 HB2 PHE 126 1HB PHE 126 0.077 2.114 -6.734 975 HB3 PHE 126 2HB PHE 126 0.614 0.702 -7.641 976 HD1 PHE 126 HD1 PHE 126 1.596 2.697 -4.613 977 HD2 PHE 126 HD2 PHE 126 1.304 -1.181 -6.431 978 HE1 PHE 126 HE1 PHE 126 2.366 1.653 -2.502 979 HE2 PHE 126 HE2 PHE 126 2.080 -2.224 -4.323 980 HZ PHE 126 HZ PHE 126 2.611 -0.808 -2.360 981 H LEU 127 H LEU 127 2.365 0.382 -9.247 982 HA LEU 127 HA LEU 127 4.351 -1.130 -8.157 983 HB2 LEU 127 1HB LEU 127 4.198 -0.495 -11.112 984 HB3 LEU 127 2HB LEU 127 4.809 -1.969 -10.365 985 HG LEU 127 HG LEU 127 1.948 -0.988 -10.252 986 HD11 LEU 127 1HD1 LEU 127 3.078 -3.408 -11.671 987 HD12 LEU 127 2HD1 LEU 127 2.813 -1.858 -12.469 988 HD13 LEU 127 3HD1 LEU 127 1.446 -2.749 -11.798 989 HD21 LEU 127 3HD2 LEU 127 2.308 -2.232 -8.261 990 HD22 LEU 127 1HD2 LEU 127 3.385 -3.372 -9.066 991 HD23 LEU 127 2HD2 LEU 127 1.650 -3.420 -9.384 992 H GLN 128 H GLN 128 4.874 1.547 -10.508 993 HA GLN 128 HA GLN 128 7.640 1.399 -10.514 994 HB2 GLN 128 1HB GLN 128 5.744 3.669 -11.053 995 HB3 GLN 128 2HB GLN 128 7.475 3.720 -11.408 996 HG2 GLN 128 1HG GLN 128 7.289 1.819 -12.895 997 HG3 GLN 128 2HG GLN 128 5.605 1.567 -12.433 998 HE21 GLN 128 2HE2 GLN 128 4.013 3.056 -13.230 999 HE22 GLN 128 1HE2 GLN 128 4.360 4.110 -14.499 1000 H GLU 129 H GLU 129 5.475 3.367 -8.472 1001 HA GLU 129 HA GLU 129 7.471 4.911 -7.242 1002 HB2 GLU 129 1HB GLU 129 4.759 4.032 -6.241 1003 HB3 GLU 129 2HB GLU 129 5.789 5.167 -5.370 1004 HG2 GLU 129 1HG GLU 129 4.897 5.562 -8.236 1005 HG3 GLU 129 2HG GLU 129 4.082 6.272 -6.849 1006 H VAL 130 H VAL 130 6.182 1.727 -6.389 1007 HA VAL 130 HA VAL 130 7.509 1.508 -3.898 1008 HB VAL 130 HB VAL 130 6.509 -0.582 -5.842 1009 HG11 VAL 130 1HG1 VAL 130 7.691 -0.837 -3.070 1010 HG12 VAL 130 2HG1 VAL 130 8.166 -1.696 -4.534 1011 HG13 VAL 130 3HG1 VAL 130 6.627 -2.064 -3.755 1012 HG21 VAL 130 3HG2 VAL 130 5.401 0.311 -3.168 1013 HG22 VAL 130 1HG2 VAL 130 4.612 -0.705 -4.372 1014 HG23 VAL 130 2HG2 VAL 130 4.882 1.005 -4.703 1015 H ALA 131 H ALA 131 8.368 0.437 -7.149 1016 HA ALA 131 HA ALA 131 10.758 -0.878 -6.602 1017 HB1 ALA 131 3HB ALA 131 11.365 -0.454 -8.937 1018 HB2 ALA 131 1HB ALA 131 10.109 0.779 -9.046 1019 HB3 ALA 131 2HB ALA 131 9.668 -0.912 -8.799 1020 H ARG 132 H ARG 132 10.347 2.581 -7.407 1021 HA ARG 132 HA ARG 132 13.143 3.159 -7.154 1022 HB2 ARG 132 1HB ARG 132 10.694 4.925 -7.249 1023 HB3 ARG 132 2HB ARG 132 12.342 5.553 -7.164 1024 HG2 ARG 132 1HG ARG 132 12.927 4.368 -9.228 1025 HG3 ARG 132 2HG ARG 132 11.307 3.675 -9.307 1026 HD2 ARG 132 1HD ARG 132 10.346 5.941 -9.483 1027 HD3 ARG 132 2HD ARG 132 11.967 6.630 -9.413 1028 HE ARG 132 HE ARG 132 11.995 4.809 -11.511 1029 HH11 ARG 132 1HH2 ARG 132 10.267 7.659 -10.587 1030 HH12 ARG 132 2HH2 ARG 132 9.992 8.187 -12.214 1031 HH21 ARG 132 1HH1 ARG 132 11.638 5.491 -13.646 1032 HH22 ARG 132 2HH1 ARG 132 10.768 6.959 -13.947 1033 H ALA 133 H ALA 133 10.549 2.831 -4.945 1034 HA ALA 133 HA ALA 133 11.254 4.548 -2.881 1035 HB1 ALA 133 3HB ALA 133 9.196 3.048 -3.101 1036 HB2 ALA 133 1HB ALA 133 9.878 3.239 -1.485 1037 HB3 ALA 133 2HB ALA 133 10.195 1.773 -2.409 1038 H CYS 134 H CYS 134 12.917 1.748 -3.986 1039 HA CYS 134 HA CYS 134 15.263 2.125 -2.713 1040 HB2 CYS 134 1HB CYS 134 13.308 1.108 -0.741 1041 HB3 CYS 134 2HB CYS 134 14.828 0.228 -0.759 1042 HG CYS 134 HG CYS 134 15.992 2.692 -0.519 1043 HA PRO 135 HA PRO 135 14.740 -2.724 -3.533 1044 HB2 PRO 135 1HB PRO 135 12.562 -2.363 -5.563 1045 HB3 PRO 135 2HB PRO 135 12.863 -3.721 -4.456 1046 HG2 PRO 135 1HG PRO 135 10.936 -1.973 -3.956 1047 HG3 PRO 135 2HG PRO 135 11.944 -2.615 -2.643 1048 HD2 PRO 135 1HD PRO 135 12.042 0.091 -3.938 1049 HD3 PRO 135 2HD PRO 135 12.335 -0.358 -2.245 1050 H GLY 136 H GLY 136 13.872 -0.440 -6.160 1051 HA2 GLY 136 1HA GLY 136 14.734 -1.055 -8.452 1052 HA3 GLY 136 2HA GLY 136 15.549 0.334 -7.747 1053 H PHE 137 H PHE 137 15.703 -3.162 -8.138 1054 HA PHE 137 HA PHE 137 17.569 -4.527 -7.458 1055 HB2 PHE 137 1HB PHE 137 17.890 -3.319 -10.201 1056 HB3 PHE 137 2HB PHE 137 18.812 -4.711 -9.637 1057 HD1 PHE 137 HD2 PHE 137 15.469 -3.478 -10.597 1058 HD2 PHE 137 HD1 PHE 137 17.731 -6.868 -9.236 1059 HE1 PHE 137 HE2 PHE 137 13.578 -4.975 -11.180 1060 HE2 PHE 137 HE1 PHE 137 15.840 -8.362 -9.819 1061 HZ PHE 137 HZ PHE 137 13.765 -7.417 -10.793 1062 H ASP 138 H ASP 138 18.470 -3.056 -5.732 1063 HA ASP 138 HA ASP 138 21.071 -1.926 -6.589 1064 HB2 ASP 138 1HB ASP 138 18.995 -0.924 -4.684 1065 HB3 ASP 138 2HB ASP 138 20.683 -0.594 -4.303 1066 HA PRO 139 HA PRO 139 23.191 -4.977 -4.161 1067 HB2 PRO 139 1HB PRO 139 24.496 -2.644 -2.785 1068 HB3 PRO 139 2HB PRO 139 25.237 -4.112 -3.454 1069 HG2 PRO 139 1HG PRO 139 25.323 -1.773 -4.755 1070 HG3 PRO 139 2HG PRO 139 25.184 -3.319 -5.612 1071 HD2 PRO 139 1HD PRO 139 23.131 -1.197 -5.247 1072 HD3 PRO 139 2HD PRO 139 23.247 -2.463 -6.491 1073 H GLU 140 H GLU 140 22.808 -2.163 -1.984 1074 HA GLU 140 HA GLU 140 21.151 -3.818 -0.178 1075 HB2 GLU 140 1HB GLU 140 23.620 -2.245 0.572 1076 HB3 GLU 140 2HB GLU 140 22.449 -2.855 1.744 1077 HG2 GLU 140 1HG GLU 140 22.832 -5.147 0.989 1078 HG3 GLU 140 2HG GLU 140 23.920 -4.577 -0.274 1079 H THR 141 H THR 141 21.686 -0.908 -1.782 1080 HA THR 141 HA THR 141 20.883 1.273 -1.483 1081 HB THR 141 HB THR 141 19.148 0.413 -2.800 1082 HG1 THR 141 HG1 THR 141 18.589 2.157 -1.168 1083 HG21 THR 141 3HG2 THR 141 17.384 -1.102 -1.887 1084 HG22 THR 141 1HG2 THR 141 18.252 -1.141 -0.354 1085 HG23 THR 141 2HG2 THR 141 18.994 -1.809 -1.808 1086 H ARG 142 H ARG 142 21.895 0.423 1.005 1087 HA ARG 142 HA ARG 142 21.809 0.900 3.239 1088 HB2 ARG 142 1HB ARG 142 19.897 3.005 2.216 1089 HB3 ARG 142 2HB ARG 142 20.471 2.924 3.882 1090 HG2 ARG 142 1HG ARG 142 22.800 3.076 3.099 1091 HG3 ARG 142 2HG ARG 142 22.235 3.155 1.429 1092 HD2 ARG 142 1HD ARG 142 21.388 5.129 3.557 1093 HD3 ARG 142 2HD ARG 142 22.755 5.400 2.481 1094 HE ARG 142 HE ARG 142 20.541 4.753 0.889 1095 HH11 ARG 142 1HH2 ARG 142 21.594 7.193 3.103 1096 HH12 ARG 142 2HH2 ARG 142 20.699 8.465 2.342 1097 HH21 ARG 142 1HH1 ARG 142 19.368 6.410 -0.117 1098 HH22 ARG 142 2HH1 ARG 142 19.437 8.022 0.517 1099 H ASP 143 H ASP 143 20.956 -0.228 4.796 1100 HA ASP 143 HA ASP 143 18.657 -1.780 4.608 1101 HB2 ASP 143 1HB ASP 143 19.025 -1.479 7.346 1102 HB3 ASP 143 2HB ASP 143 19.893 -2.632 6.335 1103 HA PRO 144 HA PRO 144 15.127 0.656 5.511 1104 HB2 PRO 144 1HB PRO 144 14.087 -0.630 7.793 1105 HB3 PRO 144 2HB PRO 144 13.792 -1.117 6.114 1106 HG2 PRO 144 1HG PRO 144 15.824 -2.158 8.046 1107 HG3 PRO 144 2HG PRO 144 14.791 -3.050 6.909 1108 HD2 PRO 144 1HD PRO 144 17.336 -2.643 6.312 1109 HD3 PRO 144 2HD PRO 144 16.104 -2.423 5.049 1110 H GLU 145 H GLU 145 13.936 1.542 7.692 1111 HA GLU 145 HA GLU 145 15.470 2.311 9.916 1112 HB2 GLU 145 1HB GLU 145 16.774 3.617 8.228 1113 HB3 GLU 145 2HB GLU 145 15.298 4.469 7.790 1114 HG2 GLU 145 1HG GLU 145 15.092 5.324 10.089 1115 HG3 GLU 145 2HG GLU 145 16.547 4.445 10.555 1116 H PHE 146 H PHE 146 13.262 1.550 10.481 1117 HA PHE 146 HA PHE 146 11.034 3.323 9.921 1118 HB2 PHE 146 1HB PHE 146 9.962 1.691 11.707 1119 HB3 PHE 146 2HB PHE 146 10.311 1.115 10.077 1120 HD1 PHE 146 HD2 PHE 146 11.396 1.052 13.597 1121 HD2 PHE 146 HD1 PHE 146 12.154 -0.401 9.627 1122 HE1 PHE 146 HE2 PHE 146 12.920 -0.672 14.519 1123 HE2 PHE 146 HE1 PHE 146 13.678 -2.125 10.549 1124 HZ PHE 146 HZ PHE 146 14.062 -2.263 12.995 1125 H GLU 147 H GLU 147 13.469 4.205 11.467 1126 HA GLU 147 HA GLU 147 12.860 4.548 14.192 1127 HB2 GLU 147 1HB GLU 147 15.105 4.839 13.197 1128 HB3 GLU 147 2HB GLU 147 14.551 6.317 12.414 1129 HG2 GLU 147 1HG GLU 147 14.044 7.296 14.634 1130 HG3 GLU 147 2HG GLU 147 14.620 5.819 15.406 1131 H TRP 148 H TRP 148 12.082 6.588 11.397 1132 HA TRP 148 HA TRP 148 10.955 8.660 13.093 1133 HB2 TRP 148 1HB TRP 148 10.450 9.819 10.979 1134 HB3 TRP 148 2HB TRP 148 12.139 9.325 11.071 1135 HD1 TRP 148 HD1 TRP 148 12.662 6.861 9.833 1136 HE1 TRP 148 HE1 TRP 148 11.749 6.002 7.592 1137 HE3 TRP 148 HE3 TRP 148 8.608 9.928 9.288 1138 HZ2 TRP 148 HZ2 TRP 148 9.606 6.547 5.786 1139 HZ3 TRP 148 HZ3 TRP 148 7.155 9.735 7.288 1140 HH2 TRP 148 HH2 TRP 148 7.647 8.048 5.536 1141 H LEU 149 H LEU 149 9.810 5.796 11.527 1142 HA LEU 149 HA LEU 149 7.099 6.517 11.134 1143 HB2 LEU 149 1HB LEU 149 8.562 3.913 11.471 1144 HB3 LEU 149 2HB LEU 149 6.803 3.911 11.545 1145 HG LEU 149 HG LEU 149 6.622 4.829 9.331 1146 HD11 LEU 149 1HD1 LEU 149 8.838 5.215 8.043 1147 HD12 LEU 149 2HD1 LEU 149 9.582 5.307 9.641 1148 HD13 LEU 149 3HD1 LEU 149 8.314 6.444 9.187 1149 HD21 LEU 149 3HD2 LEU 149 8.812 2.731 9.370 1150 HD22 LEU 149 1HD2 LEU 149 7.795 3.117 7.986 1151 HD23 LEU 149 2HD2 LEU 149 7.084 2.405 9.431 1152 H SER 150 H SER 150 8.858 5.301 13.939 1153 HA SER 150 HA SER 150 6.860 4.602 15.672 1154 HB2 SER 150 1HB SER 150 9.305 4.587 16.182 1155 HB3 SER 150 2HB SER 150 9.239 6.335 16.383 1156 HG SER 150 HG SER 150 7.509 5.847 17.957 1157 H ARG 151 H ARG 151 7.512 7.702 14.326 1158 HA ARG 151 HA ARG 151 6.285 9.391 16.228 1159 HB2 ARG 151 1HB ARG 151 6.560 9.585 13.215 1160 HB3 ARG 151 2HB ARG 151 5.949 10.892 14.229 1161 HG2 ARG 151 1HG ARG 151 8.052 10.948 15.481 1162 HG3 ARG 151 2HG ARG 151 8.669 9.588 14.542 1163 HD2 ARG 151 1HD ARG 151 8.506 10.935 12.482 1164 HD3 ARG 151 2HD ARG 151 7.887 12.294 13.415 1165 HE ARG 151 HE ARG 151 10.643 11.379 13.298 1166 HH11 ARG 151 1HH2 ARG 151 8.214 13.149 15.005 1167 HH12 ARG 151 2HH2 ARG 151 9.341 14.164 15.842 1168 HH21 ARG 151 1HH1 ARG 151 12.134 12.704 14.392 1169 HH22 ARG 151 2HH1 ARG 151 11.561 13.912 15.493 1170 H HIS 152 H HIS 152 5.120 7.494 13.515 1171 HA HIS 152 HA HIS 152 2.408 8.394 13.698 1172 HB2 HIS 152 1HB HIS 152 3.730 6.068 12.287 1173 HB3 HIS 152 2HB HIS 152 1.995 6.374 12.207 1174 HD2 HIS 152 HD2 HIS 152 5.346 8.048 10.957 1175 HE1 HIS 152 HE1 HIS 152 2.102 9.993 9.082 1176 HE2 HIS 152 HE2 HIS 152 4.633 9.801 9.159 1177 H THR 153 H THR 153 0.742 7.508 14.777 1178 HA THR 153 HA THR 153 1.339 5.245 16.608 1179 HB THR 153 HB THR 153 0.800 7.461 17.686 1180 HG1 THR 153 HG1 THR 153 -0.529 6.453 19.176 1181 HG21 THR 153 3HG2 THR 153 -2.014 6.898 16.733 1182 HG22 THR 153 1HG2 THR 153 -0.954 8.065 15.943 1183 HG23 THR 153 2HG2 THR 153 -1.437 8.308 17.621 1184 H CYS 154 H CYS 154 0.212 5.635 13.748 1185 HA CYS 154 HA CYS 154 -1.164 4.407 12.405 1186 HB2 CYS 154 1HB CYS 154 -2.121 2.925 14.859 1187 HB3 CYS 154 2HB CYS 154 -2.115 2.376 13.188 1188 HG CYS 154 HG CYS 154 0.015 1.590 14.830 1189 H ALA 155 H ALA 155 -3.664 3.457 14.276 1190 HA ALA 155 HA ALA 155 -5.142 6.008 14.057 1191 HB1 ALA 155 3HB ALA 155 -7.051 4.864 13.125 1192 HB2 ALA 155 1HB ALA 155 -6.236 3.307 13.249 1193 HB3 ALA 155 2HB ALA 155 -5.651 4.523 12.111 1194 H GLU 156 H GLU 156 -5.140 6.360 16.264 1195 HA GLU 156 HA GLU 156 -5.904 4.292 18.123 1196 HB2 GLU 156 1HB GLU 156 -5.358 7.242 18.417 1197 HB3 GLU 156 2HB GLU 156 -5.922 6.254 19.763 1198 HG2 GLU 156 1HG GLU 156 -3.492 5.535 18.111 1199 HG3 GLU 156 2HG GLU 156 -3.394 6.505 19.579 1200 HA PRO 157 HA PRO 157 -10.269 5.289 17.435 1201 HB2 PRO 157 1HB PRO 157 -11.406 3.416 19.022 1202 HB3 PRO 157 2HB PRO 157 -10.604 2.984 17.497 1203 HG2 PRO 157 1HG PRO 157 -9.553 2.824 20.290 1204 HG3 PRO 157 2HG PRO 157 -9.440 1.634 18.979 1205 HD2 PRO 157 1HD PRO 157 -7.393 3.349 19.613 1206 HD3 PRO 157 2HD PRO 157 -7.645 2.715 17.971 1207 H ASP 158 H ASP 158 -12.051 6.168 18.626 1208 HA ASP 158 HA ASP 158 -11.223 7.555 21.084 1209 HB2 ASP 158 1HB ASP 158 -13.531 7.955 19.172 1210 HB3 ASP 158 2HB ASP 158 -13.323 8.874 20.662 1211 H ALA 159 H ALA 159 -11.627 6.462 22.898 1212 HA ALA 159 HA ALA 159 -13.515 4.407 23.214 1213 HB1 ALA 159 3HB ALA 159 -13.076 4.642 25.618 1214 HB2 ALA 159 1HB ALA 159 -12.297 6.198 25.330 1215 HB3 ALA 159 2HB ALA 159 -11.573 4.719 24.697 1216 H GLU 160 H GLU 160 -13.742 7.883 23.701 1217 HA GLU 160 HA GLU 160 -15.519 9.261 24.165 1218 HB2 GLU 160 1HB GLU 160 -16.998 6.920 22.948 1219 HB3 GLU 160 2HB GLU 160 -17.751 8.467 23.330 1220 HG2 GLU 160 1HG GLU 160 -16.164 9.620 21.848 1221 HG3 GLU 160 2HG GLU 160 -15.380 8.084 21.480 1222 H SER 161 H SER 161 -14.573 7.825 26.358 1223 HA SER 161 HA SER 161 -16.733 6.571 27.780 1224 HB2 SER 161 1HB SER 161 -15.195 6.453 29.630 1225 HB3 SER 161 2HB SER 161 -14.304 6.072 28.159 1226 HG SER 161 HG SER 161 -13.043 7.593 28.935 Start of MODEL 20 1 H1 GLY 1 1H GLY 1 -8.139 21.105 -8.300 2 H2 GLY 1 2H GLY 1 -7.653 22.617 -8.905 3 H3 GLY 1 3H GLY 1 -9.301 22.205 -8.861 4 HA2 GLY 1 1HA GLY 1 -7.848 22.151 -6.329 5 HA3 GLY 1 2HA GLY 1 -8.206 23.731 -7.028 6 HA PRO 2 HA PRO 2 -12.346 23.522 -5.585 7 HB2 PRO 2 1HB PRO 2 -13.826 24.488 -7.694 8 HB3 PRO 2 2HB PRO 2 -12.788 25.510 -6.681 9 HG2 PRO 2 1HG PRO 2 -12.234 24.334 -9.371 10 HG3 PRO 2 2HG PRO 2 -11.862 25.954 -8.753 11 HD2 PRO 2 1HD PRO 2 -9.979 23.984 -8.897 12 HD3 PRO 2 2HD PRO 2 -9.948 25.235 -7.633 13 H LEU 3 H LEU 3 -11.514 21.748 -8.434 14 HA LEU 3 HA LEU 3 -13.949 20.430 -8.952 15 HB2 LEU 3 1HB LEU 3 -11.057 19.804 -9.488 16 HB3 LEU 3 2HB LEU 3 -12.296 18.611 -9.869 17 HG LEU 3 HG LEU 3 -11.685 20.141 -11.785 18 HD11 LEU 3 1HD1 LEU 3 -14.073 19.042 -11.278 19 HD12 LEU 3 2HD1 LEU 3 -13.831 20.130 -12.638 20 HD13 LEU 3 3HD1 LEU 3 -14.558 20.734 -11.153 21 HD21 LEU 3 3HD2 LEU 3 -11.455 22.146 -10.189 22 HD22 LEU 3 1HD2 LEU 3 -13.214 22.261 -10.268 23 HD23 LEU 3 2HD2 LEU 3 -12.250 22.446 -11.733 24 H GLY 4 H GLY 4 -11.267 19.676 -6.771 25 HA2 GLY 4 1HA GLY 4 -11.073 18.159 -5.051 26 HA3 GLY 4 2HA GLY 4 -12.805 18.399 -4.839 27 H SER 5 H SER 5 -10.345 16.269 -5.907 28 HA SER 5 HA SER 5 -12.083 14.492 -7.391 29 HB2 SER 5 1HB SER 5 -10.037 13.011 -7.337 30 HB3 SER 5 2HB SER 5 -9.795 14.585 -8.088 31 HG SER 5 HG SER 5 -8.398 13.589 -6.165 32 H MET 6 H MET 6 -12.056 12.106 -6.709 33 HA MET 6 HA MET 6 -12.229 11.782 -3.777 34 HB2 MET 6 1HB MET 6 -14.382 11.054 -5.774 35 HB3 MET 6 2HB MET 6 -14.370 10.543 -4.086 36 HG2 MET 6 1HG MET 6 -14.326 12.921 -3.380 37 HG3 MET 6 2HG MET 6 -14.395 13.416 -5.069 38 HE1 MET 6 3HE MET 6 -17.742 12.736 -6.356 39 HE2 MET 6 1HE MET 6 -16.695 11.313 -6.402 40 HE3 MET 6 2HE MET 6 -16.017 12.919 -6.646 41 H ASP 7 H ASP 7 -10.225 10.916 -5.667 42 HA ASP 7 HA ASP 7 -10.640 8.097 -6.167 43 HB2 ASP 7 1HB ASP 7 -8.414 8.093 -7.073 44 HB3 ASP 7 2HB ASP 7 -9.239 9.537 -7.651 45 H GLN 8 H GLN 8 -7.986 7.269 -5.546 46 HA GLN 8 HA GLN 8 -8.366 6.639 -2.711 47 HB2 GLN 8 1HB GLN 8 -6.523 5.582 -4.861 48 HB3 GLN 8 2HB GLN 8 -6.322 5.148 -3.166 49 HG2 GLN 8 1HG GLN 8 -7.663 3.433 -4.124 50 HG3 GLN 8 2HG GLN 8 -8.765 4.432 -3.189 51 HE21 GLN 8 2HE2 GLN 8 -10.388 3.399 -4.780 52 HE22 GLN 8 1HE2 GLN 8 -10.617 4.192 -6.259 53 H SER 9 H SER 9 -6.111 8.277 -4.843 54 HA SER 9 HA SER 9 -3.973 8.695 -3.116 55 HB2 SER 9 1HB SER 9 -3.413 10.665 -4.421 56 HB3 SER 9 2HB SER 9 -3.973 9.385 -5.493 57 HG SER 9 HG SER 9 -4.942 11.427 -5.938 58 H VAL 10 H VAL 10 -6.804 10.846 -3.518 59 HA VAL 10 HA VAL 10 -6.045 12.659 -1.489 60 HB VAL 10 HB VAL 10 -8.765 11.945 -2.609 61 HG11 VAL 10 1HG1 VAL 10 -9.167 12.956 -0.480 62 HG12 VAL 10 2HG1 VAL 10 -9.364 14.241 -1.672 63 HG13 VAL 10 3HG1 VAL 10 -7.881 14.138 -0.723 64 HG21 VAL 10 3HG2 VAL 10 -8.396 14.190 -3.755 65 HG22 VAL 10 1HG2 VAL 10 -7.347 12.883 -4.305 66 HG23 VAL 10 2HG2 VAL 10 -6.726 14.106 -3.198 67 H ALA 11 H ALA 11 -8.220 9.879 -1.465 68 HA ALA 11 HA ALA 11 -9.277 9.858 1.007 69 HB1 ALA 11 3HB ALA 11 -9.476 8.025 -0.742 70 HB2 ALA 11 1HB ALA 11 -9.394 7.476 0.933 71 HB3 ALA 11 2HB ALA 11 -7.969 7.367 -0.100 72 H ILE 12 H ILE 12 -5.965 8.759 0.270 73 HA ILE 12 HA ILE 12 -5.312 8.080 2.921 74 HB ILE 12 HB ILE 12 -3.446 8.995 0.730 75 HG12 ILE 12 1HG1 ILE 12 -4.842 7.192 -0.098 76 HG13 ILE 12 2HG1 ILE 12 -3.247 6.541 0.249 77 HG21 ILE 12 1HG2 ILE 12 -1.851 7.469 1.945 78 HG22 ILE 12 2HG2 ILE 12 -3.043 7.353 3.240 79 HG23 ILE 12 3HG2 ILE 12 -2.311 8.909 2.852 80 HD11 ILE 12 3HD1 ILE 12 -4.288 5.979 2.600 81 HD12 ILE 12 1HD1 ILE 12 -4.654 4.949 1.225 82 HD13 ILE 12 2HD1 ILE 12 -5.823 6.148 1.747 83 H GLN 13 H GLN 13 -4.799 10.982 1.060 84 HA GLN 13 HA GLN 13 -3.273 12.493 2.760 85 HB2 GLN 13 1HB GLN 13 -4.960 13.070 0.539 86 HB3 GLN 13 2HB GLN 13 -5.381 14.238 1.786 87 HG2 GLN 13 1HG GLN 13 -2.546 13.664 0.866 88 HG3 GLN 13 2HG GLN 13 -3.523 15.020 0.305 89 HE21 GLN 13 2HE2 GLN 13 -1.079 14.417 2.442 90 HE22 GLN 13 1HE2 GLN 13 -1.468 15.549 3.647 91 H GLU 14 H GLU 14 -6.851 12.272 2.920 92 HA GLU 14 HA GLU 14 -7.150 13.877 5.186 93 HB2 GLU 14 1HB GLU 14 -8.788 11.534 4.193 94 HB3 GLU 14 2HB GLU 14 -9.320 12.663 5.438 95 HG2 GLU 14 1HG GLU 14 -8.478 13.512 2.654 96 HG3 GLU 14 2HG GLU 14 -10.151 13.207 3.113 97 H THR 15 H THR 15 -6.654 10.396 4.867 98 HA THR 15 HA THR 15 -6.761 9.870 7.690 99 HB THR 15 HB THR 15 -6.021 7.627 7.112 100 HG1 THR 15 HG1 THR 15 -5.218 8.967 4.831 101 HG21 THR 15 3HG2 THR 15 -7.920 6.998 5.907 102 HG22 THR 15 1HG2 THR 15 -7.867 8.424 4.882 103 HG23 THR 15 2HG2 THR 15 -8.402 8.566 6.552 104 H LEU 16 H LEU 16 -4.184 10.573 5.403 105 HA LEU 16 HA LEU 16 -2.014 9.678 6.917 106 HB2 LEU 16 1HB LEU 16 -2.083 10.571 4.480 107 HB3 LEU 16 2HB LEU 16 -1.879 12.157 5.211 108 HG LEU 16 HG LEU 16 0.161 11.208 6.421 109 HD11 LEU 16 1HD1 LEU 16 -0.010 8.861 6.273 110 HD12 LEU 16 2HD1 LEU 16 1.188 9.241 5.047 111 HD13 LEU 16 3HD1 LEU 16 -0.475 8.911 4.573 112 HD21 LEU 16 3HD2 LEU 16 0.544 12.687 4.593 113 HD22 LEU 16 1HD2 LEU 16 0.029 11.479 3.414 114 HD23 LEU 16 2HD2 LEU 16 1.557 11.279 4.268 115 H VAL 17 H VAL 17 -0.935 12.660 6.670 116 HA VAL 17 HA VAL 17 -2.121 14.101 8.766 117 HB VAL 17 HB VAL 17 -1.269 12.348 10.231 118 HG11 VAL 17 1HG1 VAL 17 0.496 11.424 8.878 119 HG12 VAL 17 2HG1 VAL 17 1.215 12.007 10.378 120 HG13 VAL 17 3HG1 VAL 17 1.383 12.948 8.897 121 HG21 VAL 17 3HG2 VAL 17 0.041 13.734 11.733 122 HG22 VAL 17 1HG2 VAL 17 -1.165 14.752 10.945 123 HG23 VAL 17 2HG2 VAL 17 0.514 14.796 10.406 124 H GLU 18 H GLU 18 -1.018 16.094 9.141 125 HA GLU 18 HA GLU 18 0.157 17.239 6.910 126 HB2 GLU 18 1HB GLU 18 0.345 18.012 9.826 127 HB3 GLU 18 2HB GLU 18 0.890 19.039 8.498 128 HG2 GLU 18 1HG GLU 18 -1.347 19.103 7.558 129 HG3 GLU 18 2HG GLU 18 -1.923 17.938 8.752 130 H GLY 19 H GLY 19 2.369 18.526 7.341 131 HA2 GLY 19 1HA GLY 19 4.660 18.426 7.294 132 HA3 GLY 19 2HA GLY 19 4.525 17.262 8.606 133 H GLU 20 H GLU 20 2.762 15.882 6.220 134 HA GLU 20 HA GLU 20 5.119 14.440 5.126 135 HB2 GLU 20 1HB GLU 20 2.361 13.454 5.844 136 HB3 GLU 20 2HB GLU 20 3.453 12.543 4.798 137 HG2 GLU 20 1HG GLU 20 5.172 12.567 6.567 138 HG3 GLU 20 2HG GLU 20 4.080 13.470 7.616 139 H TYR 21 H TYR 21 4.175 13.081 3.133 140 HA TYR 21 HA TYR 21 2.761 14.907 1.288 141 HB2 TYR 21 1HB TYR 21 5.217 15.278 1.105 142 HB3 TYR 21 2HB TYR 21 5.406 13.574 0.696 143 HD1 TYR 21 HD1 TYR 21 3.892 16.782 -0.411 144 HD2 TYR 21 HD2 TYR 21 4.906 12.748 -1.479 145 HE1 TYR 21 HE1 TYR 21 3.392 17.285 -2.787 146 HE2 TYR 21 HE2 TYR 21 4.404 13.248 -3.854 147 HH TYR 21 HH TYR 21 4.287 16.139 -5.133 148 H CYS 22 H CYS 22 1.252 13.859 0.182 149 HA CYS 22 HA CYS 22 1.272 10.928 0.097 150 HB2 CYS 22 1HB CYS 22 -0.900 11.781 0.554 151 HB3 CYS 22 2HB CYS 22 -0.767 13.022 -0.693 152 HG CYS 22 HG CYS 22 -1.315 10.003 -1.219 153 H VAL 23 H VAL 23 1.599 9.766 -1.811 154 HA VAL 23 HA VAL 23 2.543 11.343 -4.133 155 HB VAL 23 HB VAL 23 4.389 10.201 -3.028 156 HG11 VAL 23 1HG1 VAL 23 3.172 7.510 -3.558 157 HG12 VAL 23 2HG1 VAL 23 2.693 8.380 -2.113 158 HG13 VAL 23 3HG1 VAL 23 4.382 7.975 -2.371 159 HG21 VAL 23 3HG2 VAL 23 5.240 8.997 -4.928 160 HG22 VAL 23 1HG2 VAL 23 4.195 10.263 -5.567 161 HG23 VAL 23 2HG2 VAL 23 3.616 8.601 -5.485 162 H ILE 24 H ILE 24 1.386 8.064 -3.307 163 HA ILE 24 HA ILE 24 -0.604 8.187 -5.412 164 HB ILE 24 HB ILE 24 1.469 7.616 -6.634 165 HG12 ILE 24 1HG1 ILE 24 0.652 5.606 -7.774 166 HG13 ILE 24 2HG1 ILE 24 -0.424 5.248 -6.427 167 HG21 ILE 24 1HG2 ILE 24 1.861 5.782 -4.378 168 HG22 ILE 24 2HG2 ILE 24 3.020 6.341 -5.564 169 HG23 ILE 24 3HG2 ILE 24 2.019 4.951 -5.911 170 HD11 ILE 24 3HD1 ILE 24 -1.325 6.516 -8.560 171 HD12 ILE 24 1HD1 ILE 24 -0.625 7.928 -7.767 172 HD13 ILE 24 2HD1 ILE 24 -1.870 6.985 -6.951 173 H ALA 25 H ALA 25 -2.168 6.589 -5.257 174 HA ALA 25 HA ALA 25 -1.966 4.646 -3.042 175 HB1 ALA 25 3HB ALA 25 -4.173 5.236 -2.248 176 HB2 ALA 25 1HB ALA 25 -4.360 6.431 -3.531 177 HB3 ALA 25 2HB ALA 25 -3.175 6.689 -2.249 178 H VAL 26 H VAL 26 -4.042 3.260 -3.154 179 HA VAL 26 HA VAL 26 -5.317 2.858 -5.645 180 HB VAL 26 HB VAL 26 -3.124 2.101 -6.383 181 HG11 VAL 26 1HG1 VAL 26 -3.263 0.048 -4.168 182 HG12 VAL 26 2HG1 VAL 26 -2.374 1.563 -4.016 183 HG13 VAL 26 3HG1 VAL 26 -1.905 0.384 -5.240 184 HG21 VAL 26 3HG2 VAL 26 -5.306 0.820 -6.962 185 HG22 VAL 26 1HG2 VAL 26 -4.692 -0.424 -5.865 186 HG23 VAL 26 2HG2 VAL 26 -3.765 0.033 -7.289 187 H GLN 27 H GLN 27 -6.399 0.585 -5.617 188 HA GLN 27 HA GLN 27 -7.624 0.307 -3.007 189 HB2 GLN 27 1HB GLN 27 -8.730 0.205 -5.384 190 HB3 GLN 27 2HB GLN 27 -8.178 -1.464 -5.384 191 HG2 GLN 27 1HG GLN 27 -10.468 -1.367 -4.559 192 HG3 GLN 27 2HG GLN 27 -9.417 -1.820 -3.236 193 HE21 GLN 27 2HE2 GLN 27 -10.625 -0.897 -1.502 194 HE22 GLN 27 1HE2 GLN 27 -10.937 0.766 -1.379 195 H GLY 28 H GLY 28 -8.076 -2.151 -2.420 196 HA2 GLY 28 1HA GLY 28 -5.993 -4.010 -2.954 197 HA3 GLY 28 2HA GLY 28 -5.877 -3.298 -1.350 198 H VAL 29 H VAL 29 -6.782 -5.995 -2.670 199 HA VAL 29 HA VAL 29 -9.128 -6.379 -0.888 200 HB VAL 29 HB VAL 29 -8.722 -7.853 -3.491 201 HG11 VAL 29 1HG1 VAL 29 -11.126 -7.471 -1.680 202 HG12 VAL 29 2HG1 VAL 29 -10.135 -8.926 -1.763 203 HG13 VAL 29 3HG1 VAL 29 -11.093 -8.431 -3.159 204 HG21 VAL 29 3HG2 VAL 29 -10.672 -6.331 -4.239 205 HG22 VAL 29 1HG2 VAL 29 -9.062 -5.613 -4.202 206 HG23 VAL 29 2HG2 VAL 29 -10.202 -5.286 -2.898 207 H LEU 30 H LEU 30 -9.262 -8.452 0.036 208 HA LEU 30 HA LEU 30 -6.889 -10.191 -0.235 209 HB2 LEU 30 1HB LEU 30 -7.092 -8.481 1.936 210 HB3 LEU 30 2HB LEU 30 -7.905 -9.901 2.565 211 HG LEU 30 HG LEU 30 -5.623 -10.167 3.141 212 HD11 LEU 30 1HD1 LEU 30 -6.881 -12.094 1.772 213 HD12 LEU 30 2HD1 LEU 30 -5.222 -12.279 2.309 214 HD13 LEU 30 3HD1 LEU 30 -5.554 -11.821 0.645 215 HD21 LEU 30 3HD2 LEU 30 -4.025 -10.156 0.892 216 HD22 LEU 30 1HD2 LEU 30 -4.212 -8.801 1.998 217 HD23 LEU 30 2HD2 LEU 30 -5.158 -8.863 0.518 218 H CYS 31 H CYS 31 -7.702 -12.186 -0.742 219 HA CYS 31 HA CYS 31 -10.401 -12.851 0.274 220 HB2 CYS 31 1HB CYS 31 -8.959 -13.938 -2.154 221 HB3 CYS 31 2HB CYS 31 -10.633 -14.242 -1.683 222 HG CYS 31 HG CYS 31 -10.671 -11.396 -1.910 223 H LYS 32 H LYS 32 -10.668 -14.668 1.365 224 HA LYS 32 HA LYS 32 -8.409 -16.571 1.629 225 HB2 LYS 32 1HB LYS 32 -10.171 -15.572 3.884 226 HB3 LYS 32 2HB LYS 32 -8.904 -16.795 4.013 227 HG2 LYS 32 1HG LYS 32 -7.212 -15.179 3.353 228 HG3 LYS 32 2HG LYS 32 -8.449 -13.947 3.097 229 HD2 LYS 32 1HD LYS 32 -9.097 -14.243 5.521 230 HD3 LYS 32 2HD LYS 32 -7.647 -15.232 5.710 231 HE2 LYS 32 1HE LYS 32 -7.640 -12.389 4.656 232 HE3 LYS 32 2HE LYS 32 -7.254 -12.833 6.318 233 HZ1 LYS 32 3HZ LYS 32 -5.492 -14.295 5.404 234 HZ2 LYS 32 1HZ LYS 32 -5.232 -12.647 5.096 235 HZ3 LYS 32 2HZ LYS 32 -5.810 -13.660 3.861 236 H GLY 33 H GLY 33 -9.083 -18.529 1.063 237 HA2 GLY 33 1HA GLY 33 -10.565 -20.130 0.251 238 HA3 GLY 33 2HA GLY 33 -11.091 -20.071 1.926 239 H ASP 34 H ASP 34 -12.751 -18.383 2.442 240 HA ASP 34 HA ASP 34 -14.395 -17.449 0.267 241 HB2 ASP 34 1HB ASP 34 -15.260 -19.646 2.151 242 HB3 ASP 34 2HB ASP 34 -16.431 -18.569 1.391 243 H SER 35 H SER 35 -13.855 -15.412 1.145 244 HA SER 35 HA SER 35 -15.593 -14.255 2.941 245 HB2 SER 35 1HB SER 35 -14.752 -15.365 4.829 246 HB3 SER 35 2HB SER 35 -13.100 -15.354 4.218 247 HG SER 35 HG SER 35 -12.858 -13.559 5.262 248 H ARG 36 H ARG 36 -15.443 -12.569 1.384 249 HA ARG 36 HA ARG 36 -12.933 -11.535 0.517 250 HB2 ARG 36 1HB ARG 36 -15.702 -10.320 0.360 251 HB3 ARG 36 2HB ARG 36 -14.293 -9.785 -0.551 252 HG2 ARG 36 1HG ARG 36 -15.226 -12.651 -0.715 253 HG3 ARG 36 2HG ARG 36 -15.983 -11.405 -1.705 254 HD2 ARG 36 1HD ARG 36 -13.714 -10.792 -2.578 255 HD3 ARG 36 2HD ARG 36 -13.043 -12.154 -1.686 256 HE ARG 36 HE ARG 36 -13.977 -13.602 -3.257 257 HH11 ARG 36 1HH2 ARG 36 -15.172 -10.373 -3.614 258 HH12 ARG 36 2HH2 ARG 36 -15.957 -10.683 -5.127 259 HH21 ARG 36 1HH1 ARG 36 -15.003 -14.014 -5.239 260 HH22 ARG 36 2HH1 ARG 36 -15.860 -12.745 -6.048 261 H GLN 37 H GLN 37 -11.795 -9.797 1.139 262 HA GLN 37 HA GLN 37 -12.777 -8.159 3.397 263 HB2 GLN 37 1HB GLN 37 -10.113 -9.566 3.158 264 HB3 GLN 37 2HB GLN 37 -10.436 -8.282 4.324 265 HG2 GLN 37 1HG GLN 37 -12.136 -9.564 5.406 266 HG3 GLN 37 2HG GLN 37 -12.160 -10.754 4.107 267 HE21 GLN 37 2HE2 GLN 37 -10.400 -12.296 3.983 268 HE22 GLN 37 1HE2 GLN 37 -9.343 -12.529 5.287 269 H SER 38 H SER 38 -12.932 -6.232 2.564 270 HA SER 38 HA SER 38 -11.232 -5.310 0.399 271 HB2 SER 38 1HB SER 38 -13.128 -3.559 1.942 272 HB3 SER 38 2HB SER 38 -12.616 -3.432 0.258 273 HG SER 38 HG SER 38 -14.302 -4.596 -0.172 274 H ARG 39 H ARG 39 -9.468 -4.157 0.546 275 HA ARG 39 HA ARG 39 -8.741 -2.809 3.067 276 HB2 ARG 39 1HB ARG 39 -7.034 -4.625 1.370 277 HB3 ARG 39 2HB ARG 39 -6.366 -3.529 2.579 278 HG2 ARG 39 1HG ARG 39 -7.762 -4.621 4.311 279 HG3 ARG 39 2HG ARG 39 -8.387 -5.733 3.095 280 HD2 ARG 39 1HD ARG 39 -6.074 -6.530 2.665 281 HD3 ARG 39 2HD ARG 39 -5.483 -5.452 3.924 282 HE ARG 39 HE ARG 39 -7.516 -7.073 5.016 283 HH11 ARG 39 1HH2 ARG 39 -4.277 -7.276 3.787 284 HH12 ARG 39 2HH2 ARG 39 -3.862 -8.659 4.744 285 HH21 ARG 39 1HH1 ARG 39 -6.969 -8.880 6.262 286 HH22 ARG 39 2HH1 ARG 39 -5.384 -9.567 6.142 287 H LEU 40 H LEU 40 -7.332 -1.077 2.863 288 HA LEU 40 HA LEU 40 -7.098 0.099 0.137 289 HB2 LEU 40 1HB LEU 40 -8.878 1.264 1.299 290 HB3 LEU 40 2HB LEU 40 -7.867 1.499 2.720 291 HG LEU 40 HG LEU 40 -6.355 2.938 1.444 292 HD11 LEU 40 1HD1 LEU 40 -7.232 3.618 -0.909 293 HD12 LEU 40 2HD1 LEU 40 -8.125 2.098 -0.850 294 HD13 LEU 40 3HD1 LEU 40 -6.366 2.095 -0.749 295 HD21 LEU 40 3HD2 LEU 40 -9.308 3.560 1.308 296 HD22 LEU 40 1HD2 LEU 40 -8.090 4.735 0.815 297 HD23 LEU 40 2HD2 LEU 40 -8.118 4.141 2.473 298 H LEU 41 H LEU 41 -5.066 0.745 -0.455 299 HA LEU 41 HA LEU 41 -2.979 0.739 1.648 300 HB2 LEU 41 1HB LEU 41 -2.837 0.340 -1.347 301 HB3 LEU 41 2HB LEU 41 -1.439 0.374 -0.274 302 HG LEU 41 HG LEU 41 -3.702 -1.521 0.351 303 HD11 LEU 41 1HD1 LEU 41 -2.523 -3.248 -1.044 304 HD12 LEU 41 2HD1 LEU 41 -1.542 -1.956 -1.735 305 HD13 LEU 41 3HD1 LEU 41 -3.286 -1.975 -1.996 306 HD21 LEU 41 3HD2 LEU 41 -1.861 -2.856 1.279 307 HD22 LEU 41 1HD2 LEU 41 -1.784 -1.216 1.920 308 HD23 LEU 41 2HD2 LEU 41 -0.682 -1.714 0.639 309 H GLY 42 H GLY 42 -1.035 2.127 0.868 310 HA2 GLY 42 1HA GLY 42 -1.432 4.425 -0.697 311 HA3 GLY 42 2HA GLY 42 -1.803 4.846 0.971 312 H LEU 43 H LEU 43 0.597 4.816 -1.291 313 HA LEU 43 HA LEU 43 2.820 4.278 0.542 314 HB2 LEU 43 1HB LEU 43 3.050 3.498 -1.739 315 HB3 LEU 43 2HB LEU 43 2.734 5.108 -2.363 316 HG LEU 43 HG LEU 43 4.797 5.932 -1.294 317 HD11 LEU 43 1HD1 LEU 43 6.386 4.008 -0.487 318 HD12 LEU 43 2HD1 LEU 43 4.896 3.093 -0.279 319 HD13 LEU 43 3HD1 LEU 43 5.143 4.582 0.616 320 HD21 LEU 43 3HD2 LEU 43 5.464 3.420 -2.832 321 HD22 LEU 43 1HD2 LEU 43 6.305 4.968 -2.856 322 HD23 LEU 43 2HD2 LEU 43 4.720 4.812 -3.612 323 H VAL 44 H VAL 44 4.287 5.865 1.247 324 HA VAL 44 HA VAL 44 3.551 8.679 0.716 325 HB VAL 44 HB VAL 44 2.524 7.831 2.860 326 HG11 VAL 44 1HG1 VAL 44 4.569 6.398 3.400 327 HG12 VAL 44 2HG1 VAL 44 3.926 7.359 4.730 328 HG13 VAL 44 3HG1 VAL 44 5.372 7.894 3.881 329 HG21 VAL 44 3HG2 VAL 44 2.851 10.198 2.554 330 HG22 VAL 44 1HG2 VAL 44 4.575 10.062 2.902 331 HG23 VAL 44 2HG2 VAL 44 3.394 9.803 4.185 332 H ARG 45 H ARG 45 5.187 10.051 0.527 333 HA ARG 45 HA ARG 45 7.941 9.036 0.962 334 HB2 ARG 45 1HB ARG 45 7.346 9.584 -1.399 335 HB3 ARG 45 2HB ARG 45 7.000 11.237 -0.895 336 HG2 ARG 45 1HG ARG 45 9.344 11.430 -0.045 337 HG3 ARG 45 2HG ARG 45 9.670 9.814 -0.671 338 HD2 ARG 45 1HD ARG 45 8.681 12.126 -2.355 339 HD3 ARG 45 2HD ARG 45 10.370 11.646 -2.232 340 HE ARG 45 HE ARG 45 8.875 9.380 -2.956 341 HH11 ARG 45 1HH2 ARG 45 9.778 12.492 -4.170 342 HH12 ARG 45 2HH2 ARG 45 9.717 12.013 -5.834 343 HH21 ARG 45 1HH1 ARG 45 8.792 8.746 -5.135 344 HH22 ARG 45 2HH1 ARG 45 9.158 9.894 -6.380 345 H TYR 46 H TYR 46 9.121 10.047 2.427 346 HA TYR 46 HA TYR 46 8.258 12.700 3.438 347 HB2 TYR 46 1HB TYR 46 7.679 10.889 5.007 348 HB3 TYR 46 2HB TYR 46 9.357 10.350 5.005 349 HD1 TYR 46 HD2 TYR 46 7.202 13.319 5.703 350 HD2 TYR 46 HD1 TYR 46 10.910 11.309 6.485 351 HE1 TYR 46 HE2 TYR 46 7.715 14.963 7.486 352 HE2 TYR 46 HE1 TYR 46 11.428 12.951 8.265 353 HH TYR 46 HH TYR 46 10.850 15.046 9.051 354 H ARG 47 H ARG 47 9.842 14.213 3.494 355 HA ARG 47 HA ARG 47 12.479 13.465 2.485 356 HB2 ARG 47 1HB ARG 47 11.196 16.135 3.068 357 HB3 ARG 47 2HB ARG 47 12.864 15.957 2.527 358 HG2 ARG 47 1HG ARG 47 12.052 14.724 0.523 359 HG3 ARG 47 2HG ARG 47 10.391 15.018 1.048 360 HD2 ARG 47 1HD ARG 47 12.406 17.226 0.596 361 HD3 ARG 47 2HD ARG 47 11.285 16.680 -0.650 362 HE ARG 47 HE ARG 47 10.641 18.269 1.694 363 HH11 ARG 47 1HH2 ARG 47 9.516 16.185 -0.835 364 HH12 ARG 47 2HH2 ARG 47 7.876 16.736 -0.744 365 HH21 ARG 47 1HH1 ARG 47 8.492 18.995 1.811 366 HH22 ARG 47 2HH1 ARG 47 7.298 18.324 0.752 367 H LEU 48 H LEU 48 14.358 13.479 3.579 368 HA LEU 48 HA LEU 48 14.233 13.858 6.497 369 HB2 LEU 48 1HB LEU 48 16.304 12.589 4.698 370 HB3 LEU 48 2HB LEU 48 16.551 12.845 6.416 371 HG LEU 48 HG LEU 48 14.188 11.317 5.287 372 HD11 LEU 48 1HD1 LEU 48 16.810 10.235 6.372 373 HD12 LEU 48 2HD1 LEU 48 16.311 10.200 4.681 374 HD13 LEU 48 3HD1 LEU 48 15.419 9.268 5.883 375 HD21 LEU 48 3HD2 LEU 48 15.257 11.896 8.048 376 HD22 LEU 48 1HD2 LEU 48 14.461 10.351 7.764 377 HD23 LEU 48 2HD2 LEU 48 13.591 11.855 7.480 378 H GLU 49 H GLU 49 15.098 15.525 7.471 379 HA GLU 49 HA GLU 49 15.895 17.869 6.283 380 HB2 GLU 49 1HB GLU 49 17.024 18.398 8.454 381 HB3 GLU 49 2HB GLU 49 15.381 17.790 8.644 382 HG2 GLU 49 1HG GLU 49 17.773 15.944 8.761 383 HG3 GLU 49 2HG GLU 49 17.184 16.787 10.189 384 H ASN 50 H ASN 50 17.586 14.938 6.347 385 HA ASN 50 HA ASN 50 20.251 16.093 6.125 386 HB2 ASN 50 1HB ASN 50 19.251 13.246 5.843 387 HB3 ASN 50 2HB ASN 50 20.946 13.731 5.834 388 HD21 ASN 50 2HD2 ASN 50 19.179 12.133 7.852 389 HD22 ASN 50 1HD2 ASN 50 19.537 12.866 9.341 390 H ASP 51 H ASP 51 17.663 15.790 4.088 391 HA ASP 51 HA ASP 51 17.554 16.351 1.835 392 HB2 ASP 51 1HB ASP 51 20.117 16.994 2.173 393 HB3 ASP 51 2HB ASP 51 20.386 15.479 1.316 394 H ALA 52 H ALA 52 18.541 13.556 3.382 395 HA ALA 52 HA ALA 52 18.576 11.714 1.208 396 HB1 ALA 52 3HB ALA 52 18.188 10.054 3.163 397 HB2 ALA 52 1HB ALA 52 18.361 11.469 4.201 398 HB3 ALA 52 2HB ALA 52 19.686 10.983 3.145 399 H GLN 53 H GLN 53 17.018 10.149 0.713 400 HA GLN 53 HA GLN 53 14.216 10.976 1.231 401 HB2 GLN 53 1HB GLN 53 15.370 9.411 -1.090 402 HB3 GLN 53 2HB GLN 53 13.682 9.891 -0.899 403 HG2 GLN 53 1HG GLN 53 16.015 11.822 -1.021 404 HG3 GLN 53 2HG GLN 53 14.959 11.442 -2.382 405 HE21 GLN 53 2HE2 GLN 53 15.410 13.782 -0.108 406 HE22 GLN 53 1HE2 GLN 53 13.811 14.315 0.085 407 H GLU 54 H GLU 54 12.712 9.472 1.875 408 HA GLU 54 HA GLU 54 13.441 6.655 2.068 409 HB2 GLU 54 1HB GLU 54 12.961 6.493 4.449 410 HB3 GLU 54 2HB GLU 54 14.274 7.640 4.189 411 HG2 GLU 54 1HG GLU 54 12.551 9.485 4.244 412 HG3 GLU 54 2HG GLU 54 11.367 8.277 4.743 413 H HIS 55 H HIS 55 11.645 5.287 2.333 414 HA HIS 55 HA HIS 55 8.970 6.557 2.091 415 HB2 HIS 55 1HB HIS 55 10.052 4.259 0.443 416 HB3 HIS 55 2HB HIS 55 8.394 4.856 0.398 417 HD2 HIS 55 HD2 HIS 55 8.031 7.209 -1.109 418 HE1 HIS 55 HE1 HIS 55 12.075 7.699 -2.216 419 HE2 HIS 55 HE2 HIS 55 9.710 8.536 -2.604 420 H ALA 56 H ALA 56 7.213 5.195 2.738 421 HA ALA 56 HA ALA 56 7.802 2.679 4.078 422 HB1 ALA 56 3HB ALA 56 6.985 5.222 5.445 423 HB2 ALA 56 1HB ALA 56 8.064 3.950 6.012 424 HB3 ALA 56 2HB ALA 56 6.319 3.698 6.041 425 H LEU 57 H LEU 57 6.053 1.313 4.011 426 HA LEU 57 HA LEU 57 3.813 2.153 2.347 427 HB2 LEU 57 1HB LEU 57 5.214 -0.176 2.448 428 HB3 LEU 57 2HB LEU 57 3.884 -0.595 3.509 429 HG LEU 57 HG LEU 57 3.308 -1.242 1.247 430 HD11 LEU 57 1HD1 LEU 57 1.607 -0.022 2.825 431 HD12 LEU 57 2HD1 LEU 57 1.169 -0.322 1.145 432 HD13 LEU 57 3HD1 LEU 57 1.716 1.276 1.635 433 HD21 LEU 57 3HD2 LEU 57 3.257 1.532 0.158 434 HD22 LEU 57 1HD2 LEU 57 3.676 0.015 -0.631 435 HD23 LEU 57 2HD2 LEU 57 4.860 0.835 0.381 436 H PHE 58 H PHE 58 1.716 2.284 2.990 437 HA PHE 58 HA PHE 58 1.136 1.946 5.876 438 HB2 PHE 58 1HB PHE 58 0.497 4.219 4.012 439 HB3 PHE 58 2HB PHE 58 -0.524 3.900 5.404 440 HD1 PHE 58 HD2 PHE 58 3.112 4.262 4.511 441 HD2 PHE 58 HD1 PHE 58 0.035 4.895 7.436 442 HE1 PHE 58 HE2 PHE 58 4.733 5.428 5.971 443 HE2 PHE 58 HE1 PHE 58 1.656 6.065 8.892 444 HZ PHE 58 HZ PHE 58 4.010 6.332 8.161 445 H LEU 59 H LEU 59 -0.668 0.923 6.379 446 HA LEU 59 HA LEU 59 -2.452 0.026 4.184 447 HB2 LEU 59 1HB LEU 59 -1.204 -1.807 5.363 448 HB3 LEU 59 2HB LEU 59 -2.005 -1.330 6.857 449 HG LEU 59 HG LEU 59 -4.228 -1.655 5.626 450 HD11 LEU 59 1HD1 LEU 59 -3.945 -3.403 3.712 451 HD12 LEU 59 2HD1 LEU 59 -2.316 -2.752 3.576 452 HD13 LEU 59 3HD1 LEU 59 -3.712 -1.700 3.339 453 HD21 LEU 59 3HD2 LEU 59 -2.360 -3.985 6.128 454 HD22 LEU 59 1HD2 LEU 59 -4.086 -4.177 5.817 455 HD23 LEU 59 2HD2 LEU 59 -3.541 -3.295 7.242 456 H TYR 60 H TYR 60 -4.457 0.683 4.266 457 HA TYR 60 HA TYR 60 -5.516 1.944 6.749 458 HB2 TYR 60 1HB TYR 60 -5.958 2.622 3.826 459 HB3 TYR 60 2HB TYR 60 -6.830 3.346 5.160 460 HD1 TYR 60 HD2 TYR 60 -5.740 4.900 6.710 461 HD2 TYR 60 HD1 TYR 60 -3.624 3.158 3.402 462 HE1 TYR 60 HE2 TYR 60 -3.931 6.584 6.977 463 HE2 TYR 60 HE1 TYR 60 -1.824 4.845 3.662 464 HH TYR 60 HH TYR 60 -1.686 7.248 4.656 465 H THR 61 H THR 61 -7.386 0.939 7.523 466 HA THR 61 HA THR 61 -8.587 -1.141 5.867 467 HB THR 61 HB THR 61 -8.397 -1.459 8.322 468 HG1 THR 61 HG1 THR 61 -10.715 -1.967 8.553 469 HG21 THR 61 3HG2 THR 61 -8.889 1.019 8.788 470 HG22 THR 61 1HG2 THR 61 -9.655 -0.155 9.859 471 HG23 THR 61 2HG2 THR 61 -10.589 0.601 8.568 472 H HIS 62 H HIS 62 -10.937 -1.118 5.435 473 HA HIS 62 HA HIS 62 -12.393 1.309 5.638 474 HB2 HIS 62 1HB HIS 62 -12.303 2.183 3.460 475 HB3 HIS 62 2HB HIS 62 -10.632 1.785 3.818 476 HD2 HIS 62 HD2 HIS 62 -9.775 -0.747 2.631 477 HE1 HIS 62 HE1 HIS 62 -12.767 -0.642 -0.344 478 HE2 HIS 62 HE2 HIS 62 -10.604 -1.768 0.372 479 H ARG 63 H ARG 63 -14.498 1.185 4.536 480 HA ARG 63 HA ARG 63 -15.544 -1.477 4.751 481 HB2 ARG 63 1HB ARG 63 -16.799 1.139 3.902 482 HB3 ARG 63 2HB ARG 63 -17.687 -0.384 3.998 483 HG2 ARG 63 1HG ARG 63 -17.072 -0.602 6.375 484 HG3 ARG 63 2HG ARG 63 -16.178 0.915 6.289 485 HD2 ARG 63 1HD ARG 63 -18.272 2.097 5.684 486 HD3 ARG 63 2HD ARG 63 -19.154 0.577 5.813 487 HE ARG 63 HE ARG 63 -17.680 1.208 8.204 488 HH11 ARG 63 1HH2 ARG 63 -20.585 1.787 6.405 489 HH12 ARG 63 2HH2 ARG 63 -21.525 2.202 7.801 490 HH21 ARG 63 1HH1 ARG 63 -18.908 1.753 10.028 491 HH22 ARG 63 2HH1 ARG 63 -20.576 2.182 9.850 492 H ARG 64 H ARG 64 -16.700 -2.581 3.085 493 HA ARG 64 HA ARG 64 -15.245 -2.938 0.726 494 HB2 ARG 64 1HB ARG 64 -17.145 -4.309 -0.006 495 HB3 ARG 64 2HB ARG 64 -16.781 -4.622 1.693 496 HG2 ARG 64 1HG ARG 64 -18.560 -2.977 2.330 497 HG3 ARG 64 2HG ARG 64 -18.977 -2.822 0.624 498 HD2 ARG 64 1HD ARG 64 -18.979 -5.456 2.109 499 HD3 ARG 64 2HD ARG 64 -20.411 -4.455 1.895 500 HE ARG 64 HE ARG 64 -19.272 -4.864 -0.635 501 HH11 ARG 64 1HH2 ARG 64 -20.749 -6.642 1.940 502 HH12 ARG 64 2HH2 ARG 64 -21.408 -7.864 0.903 503 HH21 ARG 64 1HH1 ARG 64 -20.135 -6.460 -2.000 504 HH22 ARG 64 2HH1 ARG 64 -21.060 -7.760 -1.327 505 H MET 65 H MET 65 -17.007 -0.247 1.533 506 HA MET 65 HA MET 65 -17.162 0.608 -1.239 507 HB2 MET 65 1HB MET 65 -19.554 1.391 -0.845 508 HB3 MET 65 2HB MET 65 -19.346 -0.344 -1.070 509 HG2 MET 65 1HG MET 65 -19.332 -0.643 1.403 510 HG3 MET 65 2HG MET 65 -19.608 1.088 1.594 511 HE1 MET 65 3HE MET 65 -22.007 0.663 3.007 512 HE2 MET 65 1HE MET 65 -21.184 -0.901 2.962 513 HE3 MET 65 2HE MET 65 -22.903 -0.795 2.588 514 H ALA 66 H ALA 66 -15.614 1.342 1.162 515 HA ALA 66 HA ALA 66 -16.628 3.666 2.392 516 HB1 ALA 66 3HB ALA 66 -14.448 4.001 3.236 517 HB2 ALA 66 1HB ALA 66 -13.701 3.172 1.870 518 HB3 ALA 66 2HB ALA 66 -14.603 2.252 3.076 519 H ILE 67 H ILE 67 -14.275 3.353 -0.255 520 HA ILE 67 HA ILE 67 -13.515 4.795 -1.858 521 HB ILE 67 HB ILE 67 -16.479 5.443 -1.906 522 HG12 ILE 67 1HG1 ILE 67 -14.880 3.537 -3.643 523 HG13 ILE 67 2HG1 ILE 67 -15.780 3.020 -2.218 524 HG21 ILE 67 1HG2 ILE 67 -15.287 7.158 -3.119 525 HG22 ILE 67 2HG2 ILE 67 -15.963 6.045 -4.307 526 HG23 ILE 67 3HG2 ILE 67 -14.250 5.960 -3.895 527 HD11 ILE 67 3HD1 ILE 67 -16.896 4.303 -4.727 528 HD12 ILE 67 1HD1 ILE 67 -17.837 4.081 -3.252 529 HD13 ILE 67 2HD1 ILE 67 -17.218 2.678 -4.121 530 H THR 68 H THR 68 -16.047 6.552 -0.270 531 HA THR 68 HA THR 68 -15.367 9.097 -0.621 532 HB THR 68 HB THR 68 -16.270 8.123 2.076 533 HG1 THR 68 HG1 THR 68 -18.313 8.118 1.181 534 HG21 THR 68 3HG2 THR 68 -15.731 10.521 1.926 535 HG22 THR 68 1HG2 THR 68 -17.470 10.282 2.094 536 HG23 THR 68 2HG2 THR 68 -16.782 10.671 0.517 537 H GLY 69 H GLY 69 -13.860 7.146 2.016 538 HA2 GLY 69 1HA GLY 69 -11.552 7.505 2.638 539 HA3 GLY 69 2HA GLY 69 -11.693 9.180 2.095 540 H ASP 70 H ASP 70 -14.529 8.776 3.377 541 HA ASP 70 HA ASP 70 -13.946 10.199 5.783 542 HB2 ASP 70 1HB ASP 70 -16.369 10.143 6.151 543 HB3 ASP 70 2HB ASP 70 -15.980 10.646 4.506 544 H ASP 71 H ASP 71 -14.892 6.769 5.113 545 HA ASP 71 HA ASP 71 -14.805 6.314 8.054 546 HB2 ASP 71 1HB ASP 71 -15.980 4.714 5.799 547 HB3 ASP 71 2HB ASP 71 -15.996 4.184 7.485 548 H VAL 72 H VAL 72 -12.324 6.576 6.672 549 HA VAL 72 HA VAL 72 -11.208 3.936 7.336 550 HB VAL 72 HB VAL 72 -11.335 3.656 5.015 551 HG11 VAL 72 1HG1 VAL 72 -10.625 5.511 3.441 552 HG12 VAL 72 2HG1 VAL 72 -10.576 6.581 4.842 553 HG13 VAL 72 3HG1 VAL 72 -12.098 5.834 4.354 554 HG21 VAL 72 3HG2 VAL 72 -8.657 5.005 4.958 555 HG22 VAL 72 1HG2 VAL 72 -9.106 3.390 4.429 556 HG23 VAL 72 2HG2 VAL 72 -8.875 3.724 6.140 557 H SER 73 H SER 73 -9.258 4.040 8.430 558 HA SER 73 HA SER 73 -7.653 6.460 8.274 559 HB2 SER 73 1HB SER 73 -8.816 5.370 10.850 560 HB3 SER 73 2HB SER 73 -7.591 6.631 10.741 561 HG SER 73 HG SER 73 -9.132 7.998 10.357 562 H LEU 74 H LEU 74 -5.540 6.032 9.417 563 HA LEU 74 HA LEU 74 -4.248 3.886 8.438 564 HB2 LEU 74 1HB LEU 74 -3.483 5.956 10.005 565 HB3 LEU 74 2HB LEU 74 -3.309 4.640 11.162 566 HG LEU 74 HG LEU 74 -2.080 4.711 8.395 567 HD11 LEU 74 1HD1 LEU 74 0.048 4.717 9.975 568 HD12 LEU 74 2HD1 LEU 74 -1.072 5.453 11.121 569 HD13 LEU 74 3HD1 LEU 74 -0.776 6.219 9.562 570 HD21 LEU 74 3HD2 LEU 74 -0.747 2.747 9.620 571 HD22 LEU 74 1HD2 LEU 74 -2.277 2.437 8.808 572 HD23 LEU 74 2HD2 LEU 74 -2.234 2.630 10.560 573 H ASP 75 H ASP 75 -3.963 1.811 8.745 574 HA ASP 75 HA ASP 75 -5.308 0.461 11.004 575 HB2 ASP 75 1HB ASP 75 -6.007 -0.130 8.681 576 HB3 ASP 75 2HB ASP 75 -4.363 -0.683 8.370 577 H GLN 76 H GLN 76 -2.373 0.024 8.933 578 HA GLN 76 HA GLN 76 -0.676 -0.276 11.234 579 HB2 GLN 76 1HB GLN 76 -1.816 -2.536 11.042 580 HB3 GLN 76 2HB GLN 76 -1.004 -2.723 9.487 581 HG2 GLN 76 1HG GLN 76 1.179 -2.198 10.742 582 HG3 GLN 76 2HG GLN 76 0.256 -2.434 12.222 583 HE21 GLN 76 2HE2 GLN 76 1.831 -4.070 9.572 584 HE22 GLN 76 1HE2 GLN 76 1.464 -5.641 10.077 585 H ILE 77 H ILE 77 1.244 0.477 10.697 586 HA ILE 77 HA ILE 77 1.942 1.067 7.938 587 HB ILE 77 HB ILE 77 3.548 1.439 10.491 588 HG12 ILE 77 1HG1 ILE 77 1.696 3.344 9.034 589 HG13 ILE 77 2HG1 ILE 77 1.362 2.582 10.583 590 HG21 ILE 77 1HG2 ILE 77 3.833 3.197 8.069 591 HG22 ILE 77 2HG2 ILE 77 4.570 1.601 7.998 592 HG23 ILE 77 3HG2 ILE 77 5.039 2.726 9.264 593 HD11 ILE 77 3HD1 ILE 77 2.187 4.709 11.197 594 HD12 ILE 77 1HD1 ILE 77 3.423 4.690 9.940 595 HD13 ILE 77 2HD1 ILE 77 3.598 3.663 11.363 596 H VAL 78 H VAL 78 3.239 -0.067 6.673 597 HA VAL 78 HA VAL 78 4.790 -2.321 7.821 598 HB VAL 78 HB VAL 78 3.418 -2.132 5.139 599 HG11 VAL 78 1HG1 VAL 78 5.395 -4.117 6.281 600 HG12 VAL 78 2HG1 VAL 78 5.513 -3.238 4.757 601 HG13 VAL 78 3HG1 VAL 78 4.320 -4.522 4.943 602 HG21 VAL 78 3HG2 VAL 78 2.257 -4.173 6.021 603 HG22 VAL 78 1HG2 VAL 78 1.912 -2.718 6.956 604 HG23 VAL 78 2HG2 VAL 78 3.062 -3.906 7.568 605 HA PRO 79 HA PRO 79 7.679 0.745 5.955 606 HB2 PRO 79 1HB PRO 79 9.801 0.292 7.593 607 HB3 PRO 79 2HB PRO 79 8.420 1.301 8.074 608 HG2 PRO 79 1HG PRO 79 8.999 -1.556 8.734 609 HG3 PRO 79 2HG PRO 79 8.425 -0.254 9.795 610 HD2 PRO 79 1HD PRO 79 6.760 -2.123 8.732 611 HD3 PRO 79 2HD PRO 79 6.219 -0.462 9.076 612 H LEU 80 H LEU 80 9.335 0.553 4.505 613 HA LEU 80 HA LEU 80 9.725 -1.972 3.314 614 HB2 LEU 80 1HB LEU 80 11.076 0.702 2.944 615 HB3 LEU 80 2HB LEU 80 11.417 -0.701 1.931 616 HG LEU 80 HG LEU 80 8.654 0.479 2.342 617 HD11 LEU 80 1HD1 LEU 80 8.896 1.563 0.218 618 HD12 LEU 80 2HD1 LEU 80 10.430 0.752 -0.094 619 HD13 LEU 80 3HD1 LEU 80 10.321 1.985 1.162 620 HD21 LEU 80 3HD2 LEU 80 9.757 -1.826 0.753 621 HD22 LEU 80 1HD2 LEU 80 8.444 -0.889 0.043 622 HD23 LEU 80 2HD2 LEU 80 8.216 -1.681 1.595 623 H SER 81 H SER 81 11.061 -3.463 3.709 624 HA SER 81 HA SER 81 13.534 -2.958 5.289 625 HB2 SER 81 1HB SER 81 11.633 -5.306 5.419 626 HB3 SER 81 2HB SER 81 13.239 -5.309 6.145 627 HG SER 81 HG SER 81 12.060 -3.057 6.852 628 H LYS 82 H LYS 82 15.282 -4.500 4.881 629 HA LYS 82 HA LYS 82 15.887 -4.730 2.179 630 HB2 LYS 82 1HB LYS 82 17.534 -4.806 4.029 631 HB3 LYS 82 2HB LYS 82 16.966 -6.425 4.433 632 HG2 LYS 82 1HG LYS 82 17.588 -7.205 2.169 633 HG3 LYS 82 2HG LYS 82 18.139 -5.582 1.767 634 HD2 LYS 82 1HD LYS 82 20.118 -6.697 2.389 635 HD3 LYS 82 2HD LYS 82 19.674 -5.804 3.838 636 HE2 LYS 82 1HE LYS 82 18.766 -7.773 4.875 637 HE3 LYS 82 2HE LYS 82 18.878 -8.690 3.374 638 HZ1 LYS 82 3HZ LYS 82 20.716 -9.314 4.674 639 HZ2 LYS 82 1HZ LYS 82 21.087 -7.710 5.080 640 HZ3 LYS 82 2HZ LYS 82 21.335 -8.260 3.494 641 H ASP 83 H ASP 83 14.544 -7.180 4.396 642 HA ASP 83 HA ASP 83 14.561 -9.289 2.488 643 HB2 ASP 83 1HB ASP 83 13.075 -8.844 5.074 644 HB3 ASP 83 2HB ASP 83 12.911 -10.319 4.124 645 H PHE 84 H PHE 84 12.975 -6.485 2.297 646 HA PHE 84 HA PHE 84 10.306 -7.301 1.600 647 HB2 PHE 84 1HB PHE 84 10.983 -4.975 2.348 648 HB3 PHE 84 2HB PHE 84 11.720 -4.753 0.764 649 HD1 PHE 84 HD1 PHE 84 10.122 -5.267 -1.313 650 HD2 PHE 84 HD2 PHE 84 8.752 -4.406 2.668 651 HE1 PHE 84 HE1 PHE 84 7.904 -4.640 -2.207 652 HE2 PHE 84 HE2 PHE 84 6.531 -3.784 1.768 653 HZ PHE 84 HZ PHE 84 6.108 -3.898 -0.670 654 H MET 85 H MET 85 9.463 -7.643 -0.423 655 HA MET 85 HA MET 85 10.899 -7.233 -2.845 656 HB2 MET 85 1HB MET 85 12.182 -9.190 -2.026 657 HB3 MET 85 2HB MET 85 10.685 -10.119 -1.955 658 HG2 MET 85 1HG MET 85 10.357 -9.840 -4.371 659 HG3 MET 85 2HG MET 85 11.800 -8.831 -4.468 660 HE1 MET 85 3HE MET 85 11.312 -11.109 -6.303 661 HE2 MET 85 1HE MET 85 12.729 -12.170 -6.279 662 HE3 MET 85 2HE MET 85 12.935 -10.421 -6.359 663 H LEU 86 H LEU 86 9.520 -7.330 -4.590 664 HA LEU 86 HA LEU 86 6.724 -8.091 -4.000 665 HB2 LEU 86 1HB LEU 86 6.164 -6.767 -5.981 666 HB3 LEU 86 2HB LEU 86 7.123 -5.811 -4.857 667 HG LEU 86 HG LEU 86 9.116 -6.931 -6.406 668 HD11 LEU 86 1HD1 LEU 86 7.047 -6.144 -8.452 669 HD12 LEU 86 2HD1 LEU 86 7.122 -7.804 -7.872 670 HD13 LEU 86 3HD1 LEU 86 8.523 -7.087 -8.662 671 HD21 LEU 86 3HD2 LEU 86 7.596 -4.345 -6.874 672 HD22 LEU 86 1HD2 LEU 86 9.165 -4.717 -7.589 673 HD23 LEU 86 2HD2 LEU 86 9.005 -4.570 -5.839 674 H GLU 87 H GLU 87 5.910 -9.943 -4.866 675 HA GLU 87 HA GLU 87 7.454 -11.249 -7.038 676 HB2 GLU 87 1HB GLU 87 5.871 -12.461 -4.763 677 HB3 GLU 87 2HB GLU 87 6.540 -13.375 -6.110 678 HG2 GLU 87 1HG GLU 87 8.800 -12.662 -5.520 679 HG3 GLU 87 2HG GLU 87 8.167 -11.654 -4.221 680 H GLU 88 H GLU 88 6.152 -12.742 -8.307 681 HA GLU 88 HA GLU 88 3.389 -11.747 -8.782 682 HB2 GLU 88 1HB GLU 88 5.433 -12.694 -10.816 683 HB3 GLU 88 2HB GLU 88 3.747 -12.324 -11.179 684 HG2 GLU 88 1HG GLU 88 5.729 -10.363 -9.984 685 HG3 GLU 88 2HG GLU 88 5.267 -10.413 -11.683 686 H VAL 89 H VAL 89 1.807 -13.279 -9.203 687 HA VAL 89 HA VAL 89 2.622 -16.106 -8.738 688 HB VAL 89 HB VAL 89 1.228 -15.355 -6.953 689 HG11 VAL 89 1HG1 VAL 89 -0.725 -14.485 -9.088 690 HG12 VAL 89 2HG1 VAL 89 0.241 -13.403 -8.083 691 HG13 VAL 89 3HG1 VAL 89 -1.003 -14.414 -7.346 692 HG21 VAL 89 3HG2 VAL 89 -0.459 -17.014 -7.034 693 HG22 VAL 89 1HG2 VAL 89 0.788 -17.617 -8.126 694 HG23 VAL 89 2HG2 VAL 89 -0.655 -16.842 -8.779 695 H SER 90 H SER 90 2.020 -17.618 -10.104 696 HA SER 90 HA SER 90 1.569 -17.167 -12.766 697 HB2 SER 90 1HB SER 90 2.172 -19.359 -11.797 698 HB3 SER 90 2HB SER 90 0.514 -19.540 -11.231 699 HG SER 90 HG SER 90 -0.105 -19.964 -13.205 700 HA PRO 91 HA PRO 91 -2.647 -15.365 -12.404 701 HB2 PRO 91 1HB PRO 91 -2.378 -15.562 -15.385 702 HB3 PRO 91 2HB PRO 91 -2.943 -14.201 -14.392 703 HG2 PRO 91 1HG PRO 91 -0.520 -14.179 -15.475 704 HG3 PRO 91 2HG PRO 91 -0.795 -13.542 -13.843 705 HD2 PRO 91 1HD PRO 91 0.487 -16.123 -14.666 706 HD3 PRO 91 2HD PRO 91 0.855 -15.065 -13.286 707 H ASP 92 H ASP 92 -1.769 -17.944 -14.688 708 HA ASP 92 HA ASP 92 -2.872 -19.849 -15.364 709 HB2 ASP 92 1HB ASP 92 -4.136 -19.467 -12.639 710 HB3 ASP 92 2HB ASP 92 -4.461 -20.862 -13.665 711 H GLY 93 H GLY 93 -3.823 -17.292 -16.220 712 HA2 GLY 93 1HA GLY 93 -6.701 -17.219 -16.138 713 HA3 GLY 93 2HA GLY 93 -5.656 -16.223 -17.144 714 H GLU 94 H GLU 94 -7.778 -18.863 -17.075 715 HA GLU 94 HA GLU 94 -6.842 -20.284 -19.368 716 HB2 GLU 94 1HB GLU 94 -9.411 -21.064 -19.252 717 HB3 GLU 94 2HB GLU 94 -8.204 -21.664 -18.120 718 HG2 GLU 94 1HG GLU 94 -9.718 -19.135 -17.492 719 HG3 GLU 94 2HG GLU 94 -10.460 -20.703 -17.192 720 H LEU 95 H LEU 95 -9.406 -17.845 -18.868 721 HA LEU 95 HA LEU 95 -9.193 -17.117 -21.699 722 HB2 LEU 95 1HB LEU 95 -11.050 -18.811 -21.505 723 HB3 LEU 95 2HB LEU 95 -11.866 -17.711 -20.400 724 HG LEU 95 HG LEU 95 -11.794 -15.950 -22.196 725 HD11 LEU 95 1HD1 LEU 95 -10.123 -16.500 -23.716 726 HD12 LEU 95 2HD1 LEU 95 -11.540 -17.087 -24.575 727 HD13 LEU 95 3HD1 LEU 95 -10.515 -18.219 -23.694 728 HD21 LEU 95 3HD2 LEU 95 -13.548 -17.141 -23.644 729 HD22 LEU 95 1HD2 LEU 95 -13.865 -17.107 -21.910 730 HD23 LEU 95 2HD2 LEU 95 -13.233 -18.572 -22.663 731 H TYR 96 H TYR 96 -8.068 -15.440 -20.270 732 HA TYR 96 HA TYR 96 -9.729 -13.133 -20.162 733 HB2 TYR 96 1HB TYR 96 -9.889 -14.682 -17.851 734 HB3 TYR 96 2HB TYR 96 -8.672 -13.477 -17.422 735 HD1 TYR 96 HD1 TYR 96 -12.200 -14.000 -18.413 736 HD2 TYR 96 HD2 TYR 96 -9.210 -11.139 -17.271 737 HE1 TYR 96 HE1 TYR 96 -13.969 -12.297 -18.042 738 HE2 TYR 96 HE2 TYR 96 -10.971 -9.441 -16.900 739 HH TYR 96 HH TYR 96 -13.413 -9.421 -16.371 740 H ILE 97 H ILE 97 -8.547 -11.197 -19.585 741 HA ILE 97 HA ILE 97 -5.598 -11.485 -19.593 742 HB ILE 97 HB ILE 97 -5.661 -9.329 -20.968 743 HG12 ILE 97 1HG1 ILE 97 -8.397 -10.281 -21.812 744 HG13 ILE 97 2HG1 ILE 97 -8.233 -9.150 -20.469 745 HG21 ILE 97 1HG2 ILE 97 -6.079 -10.620 -23.097 746 HG22 ILE 97 2HG2 ILE 97 -6.571 -11.982 -22.085 747 HG23 ILE 97 3HG2 ILE 97 -4.923 -11.356 -21.989 748 HD11 ILE 97 3HD1 ILE 97 -8.560 -8.127 -22.795 749 HD12 ILE 97 1HD1 ILE 97 -6.911 -8.654 -23.134 750 HD13 ILE 97 2HD1 ILE 97 -7.220 -7.504 -21.833 751 H LEU 98 H LEU 98 -6.790 -11.219 -17.208 752 HA LEU 98 HA LEU 98 -6.892 -9.926 -15.293 753 HB2 LEU 98 1HB LEU 98 -4.925 -8.427 -17.014 754 HB3 LEU 98 2HB LEU 98 -5.490 -7.693 -15.525 755 HG LEU 98 HG LEU 98 -4.660 -9.524 -14.209 756 HD11 LEU 98 1HD1 LEU 98 -3.404 -11.400 -15.439 757 HD12 LEU 98 2HD1 LEU 98 -4.221 -10.840 -16.897 758 HD13 LEU 98 3HD1 LEU 98 -5.163 -11.446 -15.538 759 HD21 LEU 98 3HD2 LEU 98 -2.314 -9.272 -14.581 760 HD22 LEU 98 1HD2 LEU 98 -3.047 -7.772 -15.150 761 HD23 LEU 98 2HD2 LEU 98 -2.547 -9.004 -16.308 762 H GLY 99 H GLY 99 -6.784 -7.431 -17.812 763 HA2 GLY 99 1HA GLY 99 -8.320 -5.862 -18.500 764 HA3 GLY 99 2HA GLY 99 -9.575 -6.819 -17.718 765 H SER 100 H SER 100 -9.204 -6.820 -15.196 766 HA SER 100 HA SER 100 -8.258 -4.325 -14.096 767 HB2 SER 100 1HB SER 100 -10.463 -3.661 -13.172 768 HB3 SER 100 2HB SER 100 -10.422 -3.582 -14.930 769 HG SER 100 HG SER 100 -11.161 -6.022 -13.891 770 H ASP 101 H ASP 101 -7.641 -7.049 -13.795 771 HA ASP 101 HA ASP 101 -8.057 -7.364 -10.904 772 HB2 ASP 101 1HB ASP 101 -8.748 -9.452 -12.974 773 HB3 ASP 101 2HB ASP 101 -8.448 -9.843 -11.283 774 H VAL 102 H VAL 102 -5.796 -6.685 -10.957 775 HA VAL 102 HA VAL 102 -3.887 -8.480 -12.232 776 HB VAL 102 HB VAL 102 -3.730 -5.844 -11.846 777 HG11 VAL 102 1HG1 VAL 102 -3.813 -6.272 -9.291 778 HG12 VAL 102 2HG1 VAL 102 -2.575 -5.170 -9.893 779 HG13 VAL 102 3HG1 VAL 102 -2.150 -6.824 -9.463 780 HG21 VAL 102 3HG2 VAL 102 -1.412 -7.785 -11.590 781 HG22 VAL 102 1HG2 VAL 102 -1.233 -6.067 -11.941 782 HG23 VAL 102 2HG2 VAL 102 -2.067 -7.120 -13.087 783 H THR 103 H THR 103 -2.262 -9.579 -11.059 784 HA THR 103 HA THR 103 -3.042 -10.272 -8.261 785 HB THR 103 HB THR 103 -1.532 -12.314 -9.852 786 HG1 THR 103 HG1 THR 103 -4.218 -12.491 -10.226 787 HG21 THR 103 3HG2 THR 103 -4.002 -12.528 -8.106 788 HG22 THR 103 1HG2 THR 103 -2.362 -12.555 -7.465 789 HG23 THR 103 2HG2 THR 103 -2.903 -13.825 -8.566 790 H VAL 104 H VAL 104 -1.652 -9.499 -6.898 791 HA VAL 104 HA VAL 104 1.242 -9.790 -7.394 792 HB VAL 104 HB VAL 104 0.381 -7.419 -7.831 793 HG11 VAL 104 1HG1 VAL 104 0.190 -7.329 -4.810 794 HG12 VAL 104 2HG1 VAL 104 -1.220 -7.505 -5.856 795 HG13 VAL 104 3HG1 VAL 104 -0.222 -6.055 -5.957 796 HG21 VAL 104 3HG2 VAL 104 2.261 -6.406 -6.528 797 HG22 VAL 104 1HG2 VAL 104 2.735 -7.865 -7.397 798 HG23 VAL 104 2HG2 VAL 104 2.437 -7.930 -5.660 799 H GLN 105 H GLN 105 2.385 -10.431 -5.612 800 HA GLN 105 HA GLN 105 0.902 -10.728 -3.057 801 HB2 GLN 105 1HB GLN 105 1.320 -12.854 -4.512 802 HB3 GLN 105 2HB GLN 105 2.998 -12.688 -3.998 803 HG2 GLN 105 1HG GLN 105 0.663 -12.791 -2.071 804 HG3 GLN 105 2HG GLN 105 1.613 -14.200 -2.527 805 HE21 GLN 105 2HE2 GLN 105 1.384 -11.730 -0.258 806 HE22 GLN 105 1HE2 GLN 105 2.970 -11.791 0.349 807 H LEU 106 H LEU 106 1.847 -9.363 -1.572 808 HA LEU 106 HA LEU 106 4.554 -8.477 -1.886 809 HB2 LEU 106 1HB LEU 106 2.654 -8.132 0.445 810 HB3 LEU 106 2HB LEU 106 4.063 -7.143 0.071 811 HG LEU 106 HG LEU 106 1.635 -7.425 -1.725 812 HD11 LEU 106 1HD1 LEU 106 0.939 -5.278 -0.937 813 HD12 LEU 106 2HD1 LEU 106 2.453 -5.032 -0.066 814 HD13 LEU 106 3HD1 LEU 106 1.293 -6.233 0.505 815 HD21 LEU 106 3HD2 LEU 106 2.758 -5.276 -2.690 816 HD22 LEU 106 1HD2 LEU 106 3.455 -6.839 -3.112 817 HD23 LEU 106 2HD2 LEU 106 4.208 -5.845 -1.864 818 H ASN 107 H ASN 107 6.277 -9.387 -1.071 819 HA ASN 107 HA ASN 107 5.985 -11.481 1.037 820 HB2 ASN 107 1HB ASN 107 8.344 -11.199 -0.801 821 HB3 ASN 107 2HB ASN 107 7.835 -12.599 0.143 822 HD21 ASN 107 2HD2 ASN 107 6.429 -10.425 -2.364 823 HD22 ASN 107 1HD2 ASN 107 5.664 -11.674 -3.218 824 H THR 108 H THR 108 6.022 -9.510 2.578 825 HA THR 108 HA THR 108 8.542 -8.191 2.892 826 HB THR 108 HB THR 108 6.696 -8.385 5.225 827 HG1 THR 108 HG1 THR 108 5.736 -8.090 2.795 828 HG21 THR 108 3HG2 THR 108 8.734 -6.738 4.705 829 HG22 THR 108 1HG2 THR 108 7.309 -6.183 5.583 830 HG23 THR 108 2HG2 THR 108 7.468 -5.845 3.866 831 H ALA 109 H ALA 109 9.554 -8.287 5.131 832 HA ALA 109 HA ALA 109 11.006 -10.572 5.460 833 HB1 ALA 109 3HB ALA 109 11.361 -8.343 6.607 834 HB2 ALA 109 1HB ALA 109 11.669 -9.764 7.604 835 HB3 ALA 109 2HB ALA 109 10.168 -8.859 7.800 836 H GLU 110 H GLU 110 7.856 -9.870 6.941 837 HA GLU 110 HA GLU 110 7.638 -12.734 7.675 838 HB2 GLU 110 1HB GLU 110 6.634 -12.150 9.805 839 HB3 GLU 110 2HB GLU 110 8.236 -11.418 9.693 840 HG2 GLU 110 1HG GLU 110 7.106 -9.316 8.849 841 HG3 GLU 110 2HG GLU 110 5.566 -10.063 9.264 842 H LEU 111 H LEU 111 6.109 -9.710 6.775 843 HA LEU 111 HA LEU 111 3.436 -10.762 6.823 844 HB2 LEU 111 1HB LEU 111 4.457 -8.295 5.398 845 HB3 LEU 111 2HB LEU 111 2.788 -8.668 5.768 846 HG LEU 111 HG LEU 111 4.956 -8.297 7.857 847 HD11 LEU 111 1HD1 LEU 111 2.705 -6.416 7.101 848 HD12 LEU 111 2HD1 LEU 111 4.373 -6.222 6.560 849 HD13 LEU 111 3HD1 LEU 111 3.985 -6.123 8.278 850 HD21 LEU 111 3HD2 LEU 111 1.998 -8.902 7.940 851 HD22 LEU 111 1HD2 LEU 111 2.739 -7.993 9.257 852 HD23 LEU 111 2HD2 LEU 111 3.305 -9.616 8.880 853 H LYS 112 H LYS 112 2.187 -11.417 5.097 854 HA LYS 112 HA LYS 112 3.240 -11.518 2.427 855 HB2 LYS 112 1HB LYS 112 4.355 -13.487 3.491 856 HB3 LYS 112 2HB LYS 112 2.753 -14.147 3.834 857 HG2 LYS 112 1HG LYS 112 2.210 -14.146 1.444 858 HG3 LYS 112 2HG LYS 112 3.773 -13.417 1.074 859 HD2 LYS 112 1HD LYS 112 4.918 -15.385 2.024 860 HD3 LYS 112 2HD LYS 112 3.353 -16.122 2.374 861 HE2 LYS 112 1HE LYS 112 2.794 -16.090 -0.027 862 HE3 LYS 112 2HE LYS 112 4.356 -15.348 -0.382 863 HZ1 LYS 112 3HZ LYS 112 5.160 -17.395 -0.512 864 HZ2 LYS 112 1HZ LYS 112 3.730 -18.081 0.091 865 HZ3 LYS 112 2HZ LYS 112 4.930 -17.540 1.166 866 H LEU 113 H LEU 113 1.465 -10.573 1.637 867 HA LEU 113 HA LEU 113 -1.123 -11.968 2.040 868 HB2 LEU 113 1HB LEU 113 -0.410 -9.069 2.297 869 HB3 LEU 113 2HB LEU 113 -2.001 -9.473 1.683 870 HG LEU 113 HG LEU 113 -2.110 -9.141 4.088 871 HD11 LEU 113 1HD1 LEU 113 -2.326 -12.110 4.038 872 HD12 LEU 113 2HD1 LEU 113 -3.233 -11.241 2.803 873 HD13 LEU 113 3HD1 LEU 113 -3.512 -10.890 4.504 874 HD21 LEU 113 3HD2 LEU 113 -0.630 -9.957 5.615 875 HD22 LEU 113 1HD2 LEU 113 0.440 -10.099 4.224 876 HD23 LEU 113 2HD2 LEU 113 -0.456 -11.503 4.800 877 H VAL 114 H VAL 114 -2.754 -11.325 0.359 878 HA VAL 114 HA VAL 114 -1.480 -11.035 -2.312 879 HB VAL 114 HB VAL 114 -3.810 -12.777 -1.457 880 HG11 VAL 114 1HG1 VAL 114 -3.719 -13.452 -3.941 881 HG12 VAL 114 2HG1 VAL 114 -2.808 -11.961 -4.187 882 HG13 VAL 114 3HG1 VAL 114 -4.456 -11.894 -3.563 883 HG21 VAL 114 3HG2 VAL 114 -2.436 -14.619 -1.996 884 HG22 VAL 114 1HG2 VAL 114 -1.339 -13.521 -1.160 885 HG23 VAL 114 2HG2 VAL 114 -1.313 -13.629 -2.922 886 H PHE 115 H PHE 115 -2.174 -9.277 -3.365 887 HA PHE 115 HA PHE 115 -4.796 -8.119 -2.699 888 HB2 PHE 115 1HB PHE 115 -2.210 -6.749 -3.415 889 HB3 PHE 115 2HB PHE 115 -3.771 -5.934 -3.427 890 HD1 PHE 115 HD2 PHE 115 -1.216 -7.529 -1.299 891 HD2 PHE 115 HD1 PHE 115 -4.964 -5.439 -1.382 892 HE1 PHE 115 HE2 PHE 115 -1.058 -7.140 1.146 893 HE2 PHE 115 HE1 PHE 115 -4.808 -5.058 1.057 894 HZ PHE 115 HZ PHE 115 -2.855 -5.904 2.325 895 H GLN 116 H GLN 116 -6.175 -7.719 -4.261 896 HA GLN 116 HA GLN 116 -5.390 -8.252 -7.059 897 HB2 GLN 116 1HB GLN 116 -8.004 -8.505 -5.585 898 HB3 GLN 116 2HB GLN 116 -7.953 -8.436 -7.341 899 HG2 GLN 116 1HG GLN 116 -6.202 -10.382 -5.836 900 HG3 GLN 116 2HG GLN 116 -7.887 -10.774 -6.170 901 HE21 GLN 116 2HE2 GLN 116 -6.736 -8.759 -8.636 902 HE22 GLN 116 1HE2 GLN 116 -6.330 -9.960 -9.766 903 H LEU 117 H LEU 117 -4.627 -6.201 -7.604 904 HA LEU 117 HA LEU 117 -6.431 -3.891 -7.258 905 HB2 LEU 117 1HB LEU 117 -3.662 -3.755 -8.444 906 HB3 LEU 117 2HB LEU 117 -4.520 -2.546 -7.501 907 HG LEU 117 HG LEU 117 -3.358 -5.146 -6.472 908 HD11 LEU 117 1HD1 LEU 117 -2.031 -3.519 -5.051 909 HD12 LEU 117 2HD1 LEU 117 -2.666 -2.224 -6.066 910 HD13 LEU 117 3HD1 LEU 117 -1.647 -3.480 -6.773 911 HD21 LEU 117 3HD2 LEU 117 -4.102 -3.794 -4.241 912 HD22 LEU 117 1HD2 LEU 117 -5.150 -4.969 -5.035 913 HD23 LEU 117 2HD2 LEU 117 -5.367 -3.250 -5.334 914 HA PRO 118 HA PRO 118 -7.683 -4.040 -11.519 915 HB2 PRO 118 1HB PRO 118 -8.002 -1.381 -12.129 916 HB3 PRO 118 2HB PRO 118 -9.125 -2.283 -11.092 917 HG2 PRO 118 1HG PRO 118 -6.872 -0.477 -10.311 918 HG3 PRO 118 2HG PRO 118 -8.518 -0.569 -9.655 919 HD2 PRO 118 1HD PRO 118 -6.420 -1.712 -8.393 920 HD3 PRO 118 2HD PRO 118 -8.035 -2.446 -8.349 921 H PHE 119 H PHE 119 -6.613 -4.340 -13.394 922 HA PHE 119 HA PHE 119 -3.974 -4.124 -13.805 923 HB2 PHE 119 1HB PHE 119 -5.461 -5.420 -15.205 924 HB3 PHE 119 2HB PHE 119 -6.192 -3.954 -15.839 925 HD1 PHE 119 HD1 PHE 119 -2.785 -5.450 -15.382 926 HD2 PHE 119 HD2 PHE 119 -5.408 -3.163 -17.899 927 HE1 PHE 119 HE1 PHE 119 -1.018 -5.330 -17.116 928 HE2 PHE 119 HE2 PHE 119 -3.640 -3.042 -19.633 929 HZ PHE 119 HZ PHE 119 -1.444 -4.125 -19.242 930 H GLY 120 H GLY 120 -2.541 -2.805 -14.670 931 HA2 GLY 120 1HA GLY 120 -1.559 -0.714 -14.898 932 HA3 GLY 120 2HA GLY 120 -2.594 -0.715 -16.318 933 H SER 121 H SER 121 -3.146 1.421 -16.379 934 HA SER 121 HA SER 121 -4.261 3.351 -15.832 935 HB2 SER 121 1HB SER 121 -6.111 1.645 -15.582 936 HB3 SER 121 2HB SER 121 -5.765 1.621 -13.857 937 HG SER 121 HG SER 121 -6.170 4.058 -15.199 938 H HIS 122 H HIS 122 -5.318 2.935 -12.752 939 HA HIS 122 HA HIS 122 -3.352 4.739 -11.679 940 HB2 HIS 122 1HB HIS 122 -5.860 4.690 -11.142 941 HB3 HIS 122 2HB HIS 122 -5.495 3.307 -10.110 942 HD2 HIS 122 HD2 HIS 122 -4.708 4.047 -7.580 943 HE1 HIS 122 HE1 HIS 122 -3.604 8.035 -8.427 944 HE2 HIS 122 HE2 HIS 122 -3.864 6.310 -6.579 945 H THR 123 H THR 123 -3.440 1.389 -12.037 946 HA THR 123 HA THR 123 -2.067 0.758 -9.543 947 HB THR 123 HB THR 123 -2.733 -0.949 -11.948 948 HG1 THR 123 HG1 THR 123 -4.350 -1.681 -10.666 949 HG21 THR 123 3HG2 THR 123 -1.336 -1.548 -9.344 950 HG22 THR 123 1HG2 THR 123 -0.834 -1.968 -10.982 951 HG23 THR 123 2HG2 THR 123 -2.197 -2.802 -10.236 952 H ARG 124 H ARG 124 -1.251 1.193 -12.969 953 HA ARG 124 HA ARG 124 1.306 0.078 -12.964 954 HB2 ARG 124 1HB ARG 124 0.087 0.841 -14.988 955 HB3 ARG 124 2HB ARG 124 0.366 2.507 -14.505 956 HG2 ARG 124 1HG ARG 124 2.824 2.076 -14.582 957 HG3 ARG 124 2HG ARG 124 2.486 0.442 -15.156 958 HD2 ARG 124 1HD ARG 124 1.222 1.444 -17.071 959 HD3 ARG 124 2HD ARG 124 1.741 3.034 -16.520 960 HE ARG 124 HE ARG 124 3.914 2.556 -17.264 961 HH11 ARG 124 1HH2 ARG 124 1.833 -0.206 -17.438 962 HH12 ARG 124 2HH2 ARG 124 2.921 -1.133 -18.414 963 HH21 ARG 124 1HH1 ARG 124 5.344 1.341 -18.542 964 HH22 ARG 124 2HH1 ARG 124 4.909 -0.260 -19.038 965 H THR 125 H THR 125 0.266 3.355 -12.151 966 HA THR 125 HA THR 125 2.795 4.509 -11.853 967 HB THR 125 HB THR 125 0.368 5.191 -10.180 968 HG1 THR 125 HG1 THR 125 -0.547 5.824 -11.944 969 HG21 THR 125 3HG2 THR 125 2.624 6.871 -11.297 970 HG22 THR 125 1HG2 THR 125 2.525 6.291 -9.635 971 HG23 THR 125 2HG2 THR 125 1.324 7.431 -10.244 972 H PHE 126 H PHE 126 0.737 2.777 -9.576 973 HA PHE 126 HA PHE 126 2.241 3.119 -7.255 974 HB2 PHE 126 1HB PHE 126 -0.029 2.091 -7.359 975 HB3 PHE 126 2HB PHE 126 0.709 0.630 -8.017 976 HD1 PHE 126 HD2 PHE 126 0.901 2.980 -5.102 977 HD2 PHE 126 HD1 PHE 126 1.613 -0.999 -6.565 978 HE1 PHE 126 HE2 PHE 126 1.452 2.227 -2.809 979 HE2 PHE 126 HE1 PHE 126 2.175 -1.743 -4.268 980 HZ PHE 126 HZ PHE 126 2.092 -0.128 -2.389 981 H LEU 127 H LEU 127 2.476 0.452 -9.654 982 HA LEU 127 HA LEU 127 4.440 -1.025 -8.409 983 HB2 LEU 127 1HB LEU 127 4.340 -0.531 -11.389 984 HB3 LEU 127 2HB LEU 127 4.949 -1.959 -10.558 985 HG LEU 127 HG LEU 127 2.086 -1.003 -10.584 986 HD11 LEU 127 1HD1 LEU 127 3.354 -3.461 -11.811 987 HD12 LEU 127 2HD1 LEU 127 2.924 -2.003 -12.706 988 HD13 LEU 127 3HD1 LEU 127 1.663 -2.974 -11.945 989 HD21 LEU 127 3HD2 LEU 127 1.786 -3.372 -9.536 990 HD22 LEU 127 1HD2 LEU 127 2.360 -2.073 -8.494 991 HD23 LEU 127 2HD2 LEU 127 3.501 -3.250 -9.143 992 H GLN 128 H GLN 128 4.941 1.664 -10.763 993 HA GLN 128 HA GLN 128 7.707 1.511 -10.804 994 HB2 GLN 128 1HB GLN 128 5.784 3.770 -11.291 995 HB3 GLN 128 2HB GLN 128 7.512 3.862 -11.645 996 HG2 GLN 128 1HG GLN 128 7.372 2.029 -13.197 997 HG3 GLN 128 2HG GLN 128 5.718 1.666 -12.705 998 HE21 GLN 128 2HE2 GLN 128 4.023 3.101 -13.417 999 HE22 GLN 128 1HE2 GLN 128 4.283 4.199 -14.669 1000 H GLU 129 H GLU 129 5.571 3.461 -8.712 1001 HA GLU 129 HA GLU 129 7.629 4.947 -7.490 1002 HB2 GLU 129 1HB GLU 129 5.060 5.328 -7.430 1003 HB3 GLU 129 2HB GLU 129 5.076 4.215 -6.063 1004 HG2 GLU 129 1HG GLU 129 5.287 6.435 -5.155 1005 HG3 GLU 129 2HG GLU 129 6.867 5.674 -5.022 1006 H VAL 130 H VAL 130 6.180 1.834 -6.665 1007 HA VAL 130 HA VAL 130 7.410 1.526 -4.136 1008 HB VAL 130 HB VAL 130 6.430 -0.503 -6.156 1009 HG11 VAL 130 1HG1 VAL 130 8.029 -1.677 -4.822 1010 HG12 VAL 130 2HG1 VAL 130 6.454 -2.039 -4.114 1011 HG13 VAL 130 3HG1 VAL 130 7.512 -0.851 -3.352 1012 HG21 VAL 130 3HG2 VAL 130 4.795 1.084 -5.045 1013 HG22 VAL 130 1HG2 VAL 130 5.272 0.384 -3.498 1014 HG23 VAL 130 2HG2 VAL 130 4.492 -0.623 -4.718 1015 H ALA 131 H ALA 131 8.370 0.487 -7.365 1016 HA ALA 131 HA ALA 131 10.703 -0.893 -6.789 1017 HB1 ALA 131 3HB ALA 131 11.465 -0.110 -9.098 1018 HB2 ALA 131 1HB ALA 131 9.964 0.812 -9.165 1019 HB3 ALA 131 2HB ALA 131 9.915 -0.945 -9.025 1020 H ARG 132 H ARG 132 10.347 2.625 -7.265 1021 HA ARG 132 HA ARG 132 13.178 3.092 -6.872 1022 HB2 ARG 132 1HB ARG 132 10.809 4.959 -7.068 1023 HB3 ARG 132 2HB ARG 132 12.478 5.504 -6.884 1024 HG2 ARG 132 1HG ARG 132 13.109 4.326 -8.947 1025 HG3 ARG 132 2HG ARG 132 11.455 3.738 -9.128 1026 HD2 ARG 132 1HD ARG 132 10.652 6.074 -9.270 1027 HD3 ARG 132 2HD ARG 132 12.313 6.645 -9.132 1028 HE ARG 132 HE ARG 132 11.086 5.411 -11.470 1029 HH11 ARG 132 1HH2 ARG 132 13.969 6.347 -9.800 1030 HH12 ARG 132 2HH2 ARG 132 14.953 6.369 -11.226 1031 HH21 ARG 132 1HH1 ARG 132 12.370 5.430 -13.342 1032 HH22 ARG 132 2HH1 ARG 132 14.048 5.849 -13.230 1033 H ALA 133 H ALA 133 10.383 2.823 -4.907 1034 HA ALA 133 HA ALA 133 10.977 4.428 -2.726 1035 HB1 ALA 133 3HB ALA 133 8.879 3.057 -3.162 1036 HB2 ALA 133 1HB ALA 133 9.441 3.120 -1.493 1037 HB3 ALA 133 2HB ALA 133 9.753 1.689 -2.470 1038 H CYS 134 H CYS 134 12.645 1.647 -3.801 1039 HA CYS 134 HA CYS 134 14.894 1.785 -2.391 1040 HB2 CYS 134 1HB CYS 134 14.165 1.846 -0.203 1041 HB3 CYS 134 2HB CYS 134 12.774 0.820 -0.517 1042 HG CYS 134 HG CYS 134 14.585 -0.532 0.861 1043 HA PRO 135 HA PRO 135 14.481 -3.050 -2.795 1044 HB2 PRO 135 1HB PRO 135 12.095 -3.830 -4.074 1045 HB3 PRO 135 2HB PRO 135 12.419 -3.945 -2.333 1046 HG2 PRO 135 1HG PRO 135 10.987 -1.799 -3.848 1047 HG3 PRO 135 2HG PRO 135 10.570 -2.552 -2.295 1048 HD2 PRO 135 1HD PRO 135 11.689 -0.146 -2.327 1049 HD3 PRO 135 2HD PRO 135 12.224 -1.347 -1.127 1050 H GLY 136 H GLY 136 12.495 -1.555 -5.354 1051 HA2 GLY 136 1HA GLY 136 12.880 -1.251 -7.598 1052 HA3 GLY 136 2HA GLY 136 14.594 -1.512 -7.274 1053 H PHE 137 H PHE 137 15.232 -3.800 -6.857 1054 HA PHE 137 HA PHE 137 13.536 -5.910 -7.843 1055 HB2 PHE 137 1HB PHE 137 15.843 -4.914 -9.522 1056 HB3 PHE 137 2HB PHE 137 15.120 -6.509 -9.719 1057 HD1 PHE 137 HD1 PHE 137 12.649 -6.684 -10.250 1058 HD2 PHE 137 HD2 PHE 137 14.801 -2.972 -10.423 1059 HE1 PHE 137 HE1 PHE 137 10.842 -5.702 -11.634 1060 HE2 PHE 137 HE2 PHE 137 12.994 -1.989 -11.809 1061 HZ PHE 137 HZ PHE 137 11.014 -3.354 -12.414 1062 H ASP 138 H ASP 138 16.818 -4.823 -7.055 1063 HA ASP 138 HA ASP 138 17.435 -7.520 -5.984 1064 HB2 ASP 138 1HB ASP 138 19.169 -5.284 -7.020 1065 HB3 ASP 138 2HB ASP 138 19.837 -6.557 -6.001 1066 HA PRO 139 HA PRO 139 17.140 -5.609 -1.942 1067 HB2 PRO 139 1HB PRO 139 18.354 -7.503 -0.397 1068 HB3 PRO 139 2HB PRO 139 16.750 -7.742 -1.119 1069 HG2 PRO 139 1HG PRO 139 19.409 -8.739 -2.053 1070 HG3 PRO 139 2HG PRO 139 17.849 -9.583 -1.985 1071 HD2 PRO 139 1HD PRO 139 18.849 -8.497 -4.300 1072 HD3 PRO 139 2HD PRO 139 17.107 -8.656 -3.981 1073 H GLU 140 H GLU 140 19.596 -5.206 -3.746 1074 HA GLU 140 HA GLU 140 21.717 -4.755 -1.759 1075 HB2 GLU 140 1HB GLU 140 21.654 -4.516 -4.772 1076 HB3 GLU 140 2HB GLU 140 23.059 -4.117 -3.783 1077 HG2 GLU 140 1HG GLU 140 23.124 -6.392 -2.892 1078 HG3 GLU 140 2HG GLU 140 21.662 -6.808 -3.786 1079 H THR 141 H THR 141 19.103 -3.105 -2.948 1080 HA THR 141 HA THR 141 19.942 -0.515 -3.510 1081 HB THR 141 HB THR 141 17.679 -0.788 -3.864 1082 HG1 THR 141 HG1 THR 141 17.665 0.165 -1.193 1083 HG21 THR 141 3HG2 THR 141 17.120 -2.854 -2.970 1084 HG22 THR 141 1HG2 THR 141 16.262 -1.802 -1.848 1085 HG23 THR 141 2HG2 THR 141 17.817 -2.485 -1.393 1086 H ARG 142 H ARG 142 21.827 -0.384 -2.018 1087 HA ARG 142 HA ARG 142 22.881 0.418 -0.138 1088 HB2 ARG 142 1HB ARG 142 20.301 1.985 0.034 1089 HB3 ARG 142 2HB ARG 142 21.768 2.359 0.932 1090 HG2 ARG 142 1HG ARG 142 21.901 2.106 -2.071 1091 HG3 ARG 142 2HG ARG 142 21.281 3.591 -1.351 1092 HD2 ARG 142 1HD ARG 142 23.975 2.354 -0.710 1093 HD3 ARG 142 2HD ARG 142 23.719 3.724 -1.780 1094 HE ARG 142 HE ARG 142 22.508 4.326 0.675 1095 HH11 ARG 142 1HH2 ARG 142 25.627 3.677 -0.661 1096 HH12 ARG 142 2HH2 ARG 142 26.473 4.686 0.463 1097 HH21 ARG 142 1HH1 ARG 142 23.604 5.650 2.158 1098 HH22 ARG 142 2HH1 ARG 142 25.327 5.805 2.062 1099 H ASP 143 H ASP 143 20.229 1.278 1.704 1100 HA ASP 143 HA ASP 143 19.950 -1.247 3.107 1101 HB2 ASP 143 1HB ASP 143 20.544 -0.002 5.309 1102 HB3 ASP 143 2HB ASP 143 21.864 -0.555 4.284 1103 HA PRO 144 HA PRO 144 15.949 0.509 3.751 1104 HB2 PRO 144 1HB PRO 144 15.117 -0.839 5.986 1105 HB3 PRO 144 2HB PRO 144 15.254 -1.607 4.389 1106 HG2 PRO 144 1HG PRO 144 17.174 -1.665 6.682 1107 HG3 PRO 144 2HG PRO 144 16.637 -2.991 5.633 1108 HD2 PRO 144 1HD PRO 144 19.019 -1.744 5.264 1109 HD3 PRO 144 2HD PRO 144 18.070 -2.382 3.904 1110 H GLU 145 H GLU 145 14.684 1.807 5.182 1111 HA GLU 145 HA GLU 145 15.926 2.912 7.589 1112 HB2 GLU 145 1HB GLU 145 16.811 4.306 5.704 1113 HB3 GLU 145 2HB GLU 145 15.148 4.725 5.288 1114 HG2 GLU 145 1HG GLU 145 14.815 5.712 7.510 1115 HG3 GLU 145 2HG GLU 145 16.454 5.253 7.975 1116 H PHE 146 H PHE 146 14.407 3.400 9.076 1117 HA PHE 146 HA PHE 146 11.723 4.165 8.339 1118 HB2 PHE 146 1HB PHE 146 10.679 2.181 9.477 1119 HB3 PHE 146 2HB PHE 146 11.488 1.811 7.953 1120 HD1 PHE 146 HD1 PHE 146 11.685 1.521 11.628 1121 HD2 PHE 146 HD2 PHE 146 13.558 0.553 7.886 1122 HE1 PHE 146 HE1 PHE 146 13.164 -0.096 12.784 1123 HE2 PHE 146 HE2 PHE 146 15.036 -1.062 9.041 1124 HZ PHE 146 HZ PHE 146 14.842 -1.390 11.492 1125 H GLU 147 H GLU 147 14.266 4.353 10.279 1126 HA GLU 147 HA GLU 147 13.393 4.235 12.917 1127 HB2 GLU 147 1HB GLU 147 15.746 4.529 12.156 1128 HB3 GLU 147 2HB GLU 147 15.373 6.205 11.759 1129 HG2 GLU 147 1HG GLU 147 14.844 6.700 14.071 1130 HG3 GLU 147 2HG GLU 147 15.000 5.000 14.513 1131 H TRP 148 H TRP 148 12.424 6.472 10.504 1132 HA TRP 148 HA TRP 148 11.716 8.563 12.406 1133 HB2 TRP 148 1HB TRP 148 10.882 9.772 10.406 1134 HB3 TRP 148 2HB TRP 148 12.571 9.292 10.272 1135 HD1 TRP 148 HD1 TRP 148 12.960 6.869 8.919 1136 HE1 TRP 148 HE1 TRP 148 11.778 6.054 6.782 1137 HE3 TRP 148 HE3 TRP 148 8.823 9.870 8.989 1138 HZ2 TRP 148 HZ2 TRP 148 9.409 6.598 5.293 1139 HZ3 TRP 148 HZ3 TRP 148 7.121 9.699 7.192 1140 HH2 TRP 148 HH2 TRP 148 7.405 8.064 5.344 1141 H LEU 149 H LEU 149 10.277 5.737 11.183 1142 HA LEU 149 HA LEU 149 7.563 6.558 11.083 1143 HB2 LEU 149 1HB LEU 149 8.946 3.911 11.381 1144 HB3 LEU 149 2HB LEU 149 7.204 4.002 11.618 1145 HG LEU 149 HG LEU 149 7.914 3.432 9.263 1146 HD11 LEU 149 1HD1 LEU 149 6.127 4.557 8.316 1147 HD12 LEU 149 2HD1 LEU 149 6.523 6.090 9.086 1148 HD13 LEU 149 3HD1 LEU 149 5.752 4.809 10.017 1149 HD21 LEU 149 3HD2 LEU 149 9.038 4.989 7.904 1150 HD22 LEU 149 1HD2 LEU 149 9.890 5.117 9.440 1151 HD23 LEU 149 2HD2 LEU 149 8.693 6.328 8.995 1152 H SER 150 H SER 150 9.683 5.594 13.714 1153 HA SER 150 HA SER 150 7.926 4.960 15.728 1154 HB2 SER 150 1HB SER 150 10.376 6.718 15.966 1155 HB3 SER 150 2HB SER 150 9.626 5.799 17.268 1156 HG SER 150 HG SER 150 10.034 3.909 15.935 1157 H ARG 151 H ARG 151 8.827 8.132 14.486 1158 HA ARG 151 HA ARG 151 7.503 9.726 16.408 1159 HB2 ARG 151 1HB ARG 151 8.297 10.124 13.529 1160 HB3 ARG 151 2HB ARG 151 7.355 11.353 14.361 1161 HG2 ARG 151 1HG ARG 151 9.658 11.956 14.592 1162 HG3 ARG 151 2HG ARG 151 9.129 11.361 16.162 1163 HD2 ARG 151 1HD ARG 151 10.157 9.190 15.720 1164 HD3 ARG 151 2HD ARG 151 10.593 9.701 14.091 1165 HE ARG 151 HE ARG 151 11.786 11.579 15.630 1166 HH11 ARG 151 1HH2 ARG 151 11.695 8.118 15.734 1167 HH12 ARG 151 2HH2 ARG 151 13.261 7.966 16.459 1168 HH21 ARG 151 1HH1 ARG 151 13.829 11.386 16.579 1169 HH22 ARG 151 2HH1 ARG 151 14.471 9.817 16.937 1170 H HIS 152 H HIS 152 6.473 8.122 13.483 1171 HA HIS 152 HA HIS 152 3.769 9.159 13.655 1172 HB2 HIS 152 1HB HIS 152 5.046 7.108 11.826 1173 HB3 HIS 152 2HB HIS 152 3.390 7.699 11.679 1174 HD2 HIS 152 HD2 HIS 152 7.047 8.966 10.998 1175 HE1 HIS 152 HE1 HIS 152 4.370 11.958 9.696 1176 HE2 HIS 152 HE2 HIS 152 6.799 11.221 9.704 1177 H THR 153 H THR 153 1.980 7.930 14.127 1178 HA THR 153 HA THR 153 2.293 5.187 15.085 1179 HB THR 153 HB THR 153 1.452 7.480 16.864 1180 HG1 THR 153 HG1 THR 153 3.043 5.297 17.578 1181 HG21 THR 153 3HG2 THR 153 0.730 4.552 17.004 1182 HG22 THR 153 1HG2 THR 153 -0.299 5.959 17.283 1183 HG23 THR 153 2HG2 THR 153 0.909 5.497 18.483 1184 H CYS 154 H CYS 154 0.483 3.993 14.785 1185 HA CYS 154 HA CYS 154 -1.753 5.311 13.401 1186 HB2 CYS 154 1HB CYS 154 -2.398 2.921 12.899 1187 HB3 CYS 154 2HB CYS 154 -0.842 3.425 12.242 1188 HG CYS 154 HG CYS 154 -1.219 1.206 14.233 1189 H ALA 155 H ALA 155 -3.862 3.829 13.870 1190 HA ALA 155 HA ALA 155 -4.922 4.686 16.279 1191 HB1 ALA 155 3HB ALA 155 -5.728 2.159 14.825 1192 HB2 ALA 155 1HB ALA 155 -6.215 3.781 14.334 1193 HB3 ALA 155 2HB ALA 155 -6.734 3.136 15.893 1194 H GLU 156 H GLU 156 -5.932 2.884 17.870 1195 HA GLU 156 HA GLU 156 -4.126 2.131 19.725 1196 HB2 GLU 156 1HB GLU 156 -6.562 0.564 18.871 1197 HB3 GLU 156 2HB GLU 156 -5.657 0.261 20.355 1198 HG2 GLU 156 1HG GLU 156 -6.106 2.516 21.152 1199 HG3 GLU 156 2HG GLU 156 -6.890 2.933 19.630 1200 HA PRO 157 HA PRO 157 -1.589 -0.617 17.042 1201 HB2 PRO 157 1HB PRO 157 -0.031 -0.735 19.603 1202 HB3 PRO 157 2HB PRO 157 0.548 -0.500 17.938 1203 HG2 PRO 157 1HG PRO 157 0.421 1.545 19.581 1204 HG3 PRO 157 2HG PRO 157 -0.102 1.716 17.894 1205 HD2 PRO 157 1HD PRO 157 -1.803 1.442 20.364 1206 HD3 PRO 157 2HD PRO 157 -2.030 2.494 18.946 1207 H ASP 158 H ASP 158 -1.172 -2.835 17.022 1208 HA ASP 158 HA ASP 158 -3.098 -4.455 18.308 1209 HB2 ASP 158 1HB ASP 158 -0.579 -5.113 16.784 1210 HB3 ASP 158 2HB ASP 158 -1.685 -6.346 17.390 1211 H ALA 159 H ALA 159 -2.952 -5.882 19.995 1212 HA ALA 159 HA ALA 159 -1.433 -5.244 22.218 1213 HB1 ALA 159 3HB ALA 159 -2.100 -7.413 23.123 1214 HB2 ALA 159 1HB ALA 159 -2.525 -7.978 21.508 1215 HB3 ALA 159 2HB ALA 159 -3.452 -6.679 22.260 1216 H GLU 160 H GLU 160 -0.822 -7.856 19.861 1217 HA GLU 160 HA GLU 160 1.623 -8.689 21.059 1218 HB2 GLU 160 1HB GLU 160 0.566 -9.074 18.246 1219 HB3 GLU 160 2HB GLU 160 1.958 -9.918 18.927 1220 HG2 GLU 160 1HG GLU 160 -0.830 -9.998 20.112 1221 HG3 GLU 160 2HG GLU 160 -0.164 -11.244 19.058 1222 H SER 161 H SER 161 2.254 -6.247 21.229 1223 HA SER 161 HA SER 161 3.383 -5.078 18.840 1224 HB2 SER 161 1HB SER 161 3.981 -3.246 20.214 1225 HB3 SER 161 2HB SER 161 2.445 -3.816 20.861 1226 HG SER 161 HG SER 161 4.090 -5.226 22.156
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