NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
492879 | 2oq3 | 15126 | cing | 1-original | 8 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H MET 1 H1 MET 1 1.384 -2.968 -1.636 2 HA MET 1 HA MET 1 2.075 -1.616 -3.454 3 HB2 MET 1 HB2 MET 1 1.287 0.537 -2.192 4 HB3 MET 1 HB3 MET 1 2.884 0.519 -1.442 5 HG2 MET 1 HG2 MET 1 2.819 1.994 -3.378 6 HG3 MET 1 HG3 MET 1 3.930 0.663 -3.690 7 HE1 MET 1 HE3 MET 1 2.237 1.723 -7.177 8 HE2 MET 1 HE1 MET 1 2.518 2.795 -5.788 9 HE3 MET 1 HE2 MET 1 3.772 1.633 -6.286 10 H ARG 2 H ARG 2 4.343 -1.779 -4.097 11 HA ARG 2 HA ARG 2 6.139 -3.230 -2.346 12 HB2 ARG 2 HB2 ARG 2 6.359 -1.846 -5.025 13 HB3 ARG 2 HB3 ARG 2 7.836 -2.061 -4.101 14 HG2 ARG 2 HG2 ARG 2 7.554 -3.884 -5.662 15 HG3 ARG 2 HG3 ARG 2 7.557 -4.457 -3.991 16 HD2 ARG 2 HD2 ARG 2 5.107 -4.677 -4.038 17 HD3 ARG 2 HD3 ARG 2 5.061 -4.055 -5.696 18 HE ARG 2 HE ARG 2 6.596 -6.035 -6.237 19 HH11 ARG 2 HH11 ARG 2 4.034 -6.238 -3.780 20 HH12 ARG 2 HH12 ARG 2 3.824 -7.941 -3.945 21 HH21 ARG 2 HH21 ARG 2 6.321 -8.293 -6.443 22 HH22 ARG 2 HH22 ARG 2 5.152 -9.129 -5.495 23 H LEU 3 H LEU 3 7.170 -2.454 -0.613 24 HA LEU 3 HA LEU 3 7.199 0.381 0.047 25 HB2 LEU 3 HB2 LEU 3 8.353 -2.157 1.206 26 HB3 LEU 3 HB3 LEU 3 9.090 -0.645 1.676 27 HG LEU 3 HG LEU 3 7.367 -1.502 3.245 28 HD11 LEU 3 HD11 LEU 3 8.079 0.867 3.224 29 HD12 LEU 3 HD12 LEU 3 6.770 1.258 2.088 30 HD13 LEU 3 HD13 LEU 3 6.395 0.665 3.718 31 HD21 LEU 3 HD23 LEU 3 5.011 -1.241 2.823 32 HD22 LEU 3 HD21 LEU 3 5.302 -0.597 1.198 33 HD23 LEU 3 HD22 LEU 3 5.678 -2.287 1.562 34 H SER 4 H SER 4 9.639 -1.971 -1.168 35 HA SER 4 HA SER 4 11.879 -0.466 -1.179 36 HB2 SER 4 HB2 SER 4 11.096 -2.325 -3.447 37 HB3 SER 4 HB3 SER 4 12.718 -2.029 -2.796 38 HG SER 4 HG SER 4 11.741 -3.991 -2.056 39 H ASP 5 H ASP 5 9.196 -0.029 -3.450 40 HA ASP 5 HA ASP 5 10.541 1.255 -5.579 41 HB2 ASP 5 HB2 ASP 5 8.218 0.444 -5.681 42 HB3 ASP 5 HB3 ASP 5 7.726 1.669 -4.507 43 H TYR 6 H TYR 6 9.659 2.454 -2.373 44 HA TYR 6 HA TYR 6 10.074 5.268 -3.148 45 HB2 TYR 6 HB2 TYR 6 9.278 3.969 -0.516 46 HB3 TYR 6 HB3 TYR 6 9.385 5.696 -0.813 47 HD1 TYR 6 HD2 TYR 6 7.791 6.863 -2.308 48 HD2 TYR 6 HD1 TYR 6 7.348 2.680 -1.351 49 HE1 TYR 6 HE2 TYR 6 5.460 6.926 -3.139 50 HE2 TYR 6 HE1 TYR 6 5.021 2.731 -2.182 51 HH TYR 6 HH TYR 6 3.523 5.700 -3.553 52 H PHE 7 H PHE 7 12.198 2.756 -2.224 53 HA PHE 7 HA PHE 7 13.834 4.557 -0.490 54 HB2 PHE 7 HB2 PHE 7 13.566 1.554 -0.627 55 HB3 PHE 7 HB3 PHE 7 14.927 2.344 0.149 56 HD1 PHE 7 HD1 PHE 7 11.202 2.154 0.205 57 HD2 PHE 7 HD2 PHE 7 14.756 3.187 2.390 58 HE1 PHE 7 HE1 PHE 7 9.838 2.482 2.246 59 HE2 PHE 7 HE2 PHE 7 13.389 3.574 4.417 60 HZ PHE 7 HZ PHE 7 10.929 3.221 4.360 61 HA PRO 8 HA PRO 8 16.023 4.668 -4.430 62 HB2 PRO 8 HB2 PRO 8 18.011 6.512 -3.744 63 HB3 PRO 8 HB3 PRO 8 16.364 6.887 -4.315 64 HG2 PRO 8 HG2 PRO 8 17.362 6.767 -1.461 65 HG3 PRO 8 HG3 PRO 8 16.312 8.005 -2.222 66 HD2 PRO 8 HD2 PRO 8 15.255 6.045 -0.718 67 HD3 PRO 8 HD3 PRO 8 14.442 6.544 -2.225 68 H GLU 9 H GLU 9 18.242 4.725 -1.548 69 HA GLU 9 HA GLU 9 19.428 2.220 -2.016 70 HB2 GLU 9 HB2 GLU 9 20.398 3.133 -4.084 71 HB3 GLU 9 HB3 GLU 9 21.023 4.538 -3.223 72 HG2 GLU 9 HG2 GLU 9 22.599 3.128 -1.993 73 HG3 GLU 9 HG3 GLU 9 21.825 1.663 -2.602 74 H SER 10 H SER 10 20.852 5.471 -1.318 75 HA SER 10 HA SER 10 22.182 4.631 1.040 76 HB2 SER 10 HB2 SER 10 21.503 7.484 0.248 77 HB3 SER 10 HB3 SER 10 22.938 6.902 1.109 78 HG SER 10 HG SER 10 23.576 5.847 -0.816 79 H SER 11 H SER 11 18.970 4.845 0.782 80 HA SER 11 HA SER 11 18.069 6.753 2.648 81 HB2 SER 11 HB2 SER 11 15.993 5.014 2.183 82 HB3 SER 11 HB3 SER 11 16.448 6.386 1.180 83 HG SER 11 HG SER 11 16.520 3.763 0.547 84 H ILE 12 H ILE 12 19.690 3.915 3.493 85 HA ILE 12 HA ILE 12 17.925 3.486 5.850 86 HB ILE 12 HB ILE 12 19.311 1.354 4.203 87 HG12 ILE 12 HG12 ILE 12 16.397 2.251 4.373 88 HG13 ILE 12 HG13 ILE 12 17.434 2.247 2.948 89 HG21 ILE 12 HG21 ILE 12 19.159 0.828 6.640 90 HG22 ILE 12 HG22 ILE 12 17.406 1.115 6.577 91 HG23 ILE 12 HG23 ILE 12 18.150 -0.231 5.675 92 HD11 ILE 12 HD13 ILE 12 15.904 0.448 2.720 93 HD12 ILE 12 HD11 ILE 12 17.496 -0.262 3.057 94 HD13 ILE 12 HD12 ILE 12 16.256 -0.165 4.341 95 H SER 13 H SER 13 18.937 3.707 7.757 96 HA SER 13 HA SER 13 21.904 3.519 7.919 97 HB2 SER 13 HB2 SER 13 20.159 5.832 8.846 98 HB3 SER 13 HB3 SER 13 21.906 5.679 9.097 99 HG SER 13 HG SER 13 21.396 6.991 7.290 100 H VAL 14 H VAL 14 22.719 2.978 9.929 101 HA VAL 14 HA VAL 14 20.885 2.875 12.255 102 HB VAL 14 HB VAL 14 23.050 0.830 11.581 103 HG11 VAL 14 HG11 VAL 14 23.108 1.318 13.995 104 HG12 VAL 14 HG12 VAL 14 21.343 1.129 14.101 105 HG13 VAL 14 HG13 VAL 14 22.380 -0.264 13.725 106 HG21 VAL 14 HG23 VAL 14 21.198 -0.812 11.736 107 HG22 VAL 14 HG21 VAL 14 20.051 0.507 11.991 108 HG23 VAL 14 HG22 VAL 14 20.908 0.358 10.440 109 H ILE 15 H ILE 15 21.733 3.958 13.965 110 HA ILE 15 HA ILE 15 24.419 5.215 13.751 111 HB ILE 15 HB ILE 15 21.652 6.491 14.016 112 HG12 ILE 15 HG12 ILE 15 23.876 6.805 11.948 113 HG13 ILE 15 HG13 ILE 15 22.308 6.028 11.703 114 HG21 ILE 15 HG21 ILE 15 23.140 7.574 15.629 115 HG22 ILE 15 HG22 ILE 15 24.341 7.886 14.350 116 HG23 ILE 15 HG23 ILE 15 22.742 8.669 14.332 117 HD11 ILE 15 HD13 ILE 15 22.179 8.143 10.671 118 HD12 ILE 15 HD11 ILE 15 21.201 8.245 12.154 119 HD13 ILE 15 HD12 ILE 15 22.828 8.972 12.091 120 H HIS 16 H HIS 16 25.328 5.598 15.828 121 HA HIS 16 HA HIS 16 24.350 3.894 17.911 122 HB2 HIS 16 HB2 HIS 16 26.756 4.581 17.409 123 HB3 HIS 16 HB3 HIS 16 26.403 6.131 18.172 124 HD1 HIS 16 HD1 HIS 16 25.766 2.422 19.247 125 HD2 HIS 16 HD2 HIS 16 27.422 6.072 20.576 126 HE1 HIS 16 HE1 HIS 16 26.658 1.999 21.602 127 H SER 17 H SER 17 24.492 7.478 17.605 128 HA SER 17 HA SER 17 21.856 7.786 18.730 129 HB2 SER 17 HB2 SER 17 22.748 9.479 20.459 130 HB3 SER 17 HB3 SER 17 22.900 7.765 20.853 131 HG SER 17 HG SER 17 24.812 8.950 21.302 132 H ALA 18 H ALA 18 21.027 9.847 18.046 133 HA ALA 18 HA ALA 18 22.557 11.277 15.990 134 HB1 ALA 18 HB3 ALA 18 20.621 12.847 16.055 135 HB2 ALA 18 HB1 ALA 18 20.136 11.174 15.748 136 HB3 ALA 18 HB2 ALA 18 19.903 11.895 17.367 137 H LYS 19 H LYS 19 23.402 13.399 16.282 138 HA LYS 19 HA LYS 19 24.680 13.906 18.757 139 HB2 LYS 19 HB2 LYS 19 25.494 14.700 16.585 140 HB3 LYS 19 HB3 LYS 19 24.096 15.782 16.429 141 HG2 LYS 19 HG2 LYS 19 24.847 17.153 18.271 142 HG3 LYS 19 HG3 LYS 19 26.079 15.968 18.732 143 HD2 LYS 19 HD2 LYS 19 27.068 17.907 17.591 144 HD3 LYS 19 HD3 LYS 19 27.350 16.401 16.703 145 HE2 LYS 19 HE2 LYS 19 25.481 16.958 15.162 146 HE3 LYS 19 HE3 LYS 19 25.184 18.459 16.050 147 HZ1 LYS 19 HZ3 LYS 19 26.521 18.783 14.052 148 HZ2 LYS 19 HZ1 LYS 19 27.377 19.217 15.373 149 HZ3 LYS 19 HZ2 LYS 19 27.692 17.803 14.611 150 H ASP 20 H ASP 20 21.605 15.202 17.418 151 HA ASP 20 HA ASP 20 20.597 15.801 20.037 152 HB2 ASP 20 HB2 ASP 20 20.436 18.109 19.972 153 HB3 ASP 20 HB3 ASP 20 22.067 17.875 19.366 154 H TRP 21 H TRP 21 18.363 17.060 19.598 155 HA TRP 21 HA TRP 21 16.731 15.359 18.075 156 HB2 TRP 21 HB2 TRP 21 15.034 17.277 18.395 157 HB3 TRP 21 HB3 TRP 21 15.648 16.400 19.774 158 HD1 TRP 21 HD1 TRP 21 17.556 19.384 18.270 159 HE1 TRP 21 HE1 TRP 21 17.760 21.234 19.960 160 HE3 TRP 21 HE3 TRP 21 14.541 17.439 21.915 161 HZ2 TRP 21 HZ2 TRP 21 16.678 21.881 22.562 162 HZ3 TRP 21 HZ3 TRP 21 14.118 18.721 23.983 163 HH2 TRP 21 HH2 TRP 21 15.179 20.946 24.323 164 H GLN 22 H GLN 22 18.467 18.281 16.948 165 HA GLN 22 HA GLN 22 16.797 18.517 14.554 166 HB2 GLN 22 HB2 GLN 22 19.437 19.776 15.401 167 HB3 GLN 22 HB3 GLN 22 18.640 20.143 13.885 168 HG2 GLN 22 HG2 GLN 22 16.775 21.171 14.931 169 HG3 GLN 22 HG3 GLN 22 17.156 20.507 16.508 170 HE21 GLN 22 HE22 GLN 22 19.516 21.122 17.327 171 HE22 GLN 22 HE21 GLN 22 19.881 22.836 17.170 172 H GLU 23 H GLU 23 20.084 17.255 15.403 173 HA GLU 23 HA GLU 23 20.722 16.473 12.762 174 HB2 GLU 23 HB2 GLU 23 22.227 16.690 14.891 175 HB3 GLU 23 HB3 GLU 23 21.713 15.040 15.240 176 HG2 GLU 23 HG2 GLU 23 23.711 14.730 14.105 177 HG3 GLU 23 HG3 GLU 23 22.549 14.528 12.800 178 H ALA 24 H ALA 24 18.748 14.844 15.257 179 HA ALA 24 HA ALA 24 18.586 12.306 13.954 180 HB1 ALA 24 HB3 ALA 24 16.509 12.007 15.237 181 HB2 ALA 24 HB1 ALA 24 17.791 12.685 16.254 182 HB3 ALA 24 HB2 ALA 24 16.491 13.734 15.649 183 H ILE 25 H ILE 25 16.722 15.356 13.444 184 HA ILE 25 HA ILE 25 14.972 14.166 11.465 185 HB ILE 25 HB ILE 25 15.700 17.111 11.714 186 HG12 ILE 25 HG12 ILE 25 13.952 15.383 13.429 187 HG13 ILE 25 HG13 ILE 25 14.940 16.786 13.830 188 HG21 ILE 25 HG21 ILE 25 14.517 16.331 9.613 189 HG22 ILE 25 HG22 ILE 25 13.165 15.826 10.630 190 HG23 ILE 25 HG23 ILE 25 13.656 17.537 10.547 191 HD11 ILE 25 HD13 ILE 25 12.679 17.387 14.217 192 HD12 ILE 25 HD11 ILE 25 13.165 18.231 12.734 193 HD13 ILE 25 HD12 ILE 25 12.164 16.758 12.648 194 H ASP 26 H ASP 26 18.103 15.969 11.365 195 HA ASP 26 HA ASP 26 18.315 16.083 8.548 196 HB2 ASP 26 HB2 ASP 26 19.789 17.334 10.069 197 HB3 ASP 26 HB3 ASP 26 20.560 15.828 10.576 198 H PHE 27 H PHE 27 19.548 13.494 10.787 199 HA PHE 27 HA PHE 27 20.491 11.851 8.654 200 HB2 PHE 27 HB2 PHE 27 19.742 11.280 11.535 201 HB3 PHE 27 HB3 PHE 27 20.260 10.010 10.440 202 HD1 PHE 27 HD1 PHE 27 22.467 10.759 8.944 203 HD2 PHE 27 HD2 PHE 27 21.504 11.939 12.984 204 HE1 PHE 27 HE1 PHE 27 24.873 11.093 9.421 205 HE2 PHE 27 HE2 PHE 27 23.923 12.239 13.461 206 HZ PHE 27 HZ PHE 27 25.609 11.826 11.681 207 H SER 28 H SER 28 17.210 12.400 9.759 208 HA SER 28 HA SER 28 16.181 9.942 8.520 209 HB2 SER 28 HB2 SER 28 14.712 12.416 9.511 210 HB3 SER 28 HB3 SER 28 14.003 10.854 9.073 211 HG SER 28 HG SER 28 15.788 11.429 11.221 212 H MET 29 H MET 29 17.358 12.910 7.310 213 HA MET 29 HA MET 29 15.538 12.851 4.928 214 HB2 MET 29 HB2 MET 29 16.748 15.146 6.507 215 HB3 MET 29 HB3 MET 29 15.848 15.330 5.006 216 HG2 MET 29 HG2 MET 29 14.576 14.042 7.447 217 HG3 MET 29 HG3 MET 29 14.678 15.778 7.240 218 HE1 MET 29 HE3 MET 29 11.654 13.027 5.251 219 HE2 MET 29 HE1 MET 29 13.357 12.542 5.143 220 HE3 MET 29 HE2 MET 29 12.591 12.751 6.736 221 H VAL 30 H VAL 30 18.900 13.187 6.048 222 HA VAL 30 HA VAL 30 19.952 14.547 3.918 223 HB VAL 30 HB VAL 30 21.068 14.127 6.035 224 HG11 VAL 30 HG11 VAL 30 20.548 11.693 6.322 225 HG12 VAL 30 HG12 VAL 30 21.736 11.320 5.057 226 HG13 VAL 30 HG13 VAL 30 22.254 12.087 6.568 227 HG21 VAL 30 HG23 VAL 30 23.345 13.922 5.225 228 HG22 VAL 30 HG21 VAL 30 22.780 13.219 3.696 229 HG23 VAL 30 HG22 VAL 30 22.380 14.900 4.107 230 H SER 31 H SER 31 19.369 10.990 4.053 231 HA SER 31 HA SER 31 20.662 10.388 1.626 232 HB2 SER 31 HB2 SER 31 18.232 9.024 2.841 233 HB3 SER 31 HB3 SER 31 19.452 8.314 1.763 234 HG SER 31 HG SER 31 20.384 7.789 3.566 235 H LEU 32 H LEU 32 17.558 11.954 2.166 236 HA LEU 32 HA LEU 32 16.635 11.474 -0.608 237 HB2 LEU 32 HB2 LEU 32 15.481 12.918 1.818 238 HB3 LEU 32 HB3 LEU 32 14.741 13.051 0.245 239 HG LEU 32 HG LEU 32 15.249 10.371 1.590 240 HD11 LEU 32 HD11 LEU 32 13.771 11.708 3.020 241 HD12 LEU 32 HD12 LEU 32 12.707 12.055 1.642 242 HD13 LEU 32 HD13 LEU 32 12.872 10.394 2.254 243 HD21 LEU 32 HD23 LEU 32 13.610 9.488 0.052 244 HD22 LEU 32 HD21 LEU 32 13.310 11.091 -0.645 245 HD23 LEU 32 HD22 LEU 32 14.872 10.273 -0.878 246 H LEU 33 H LEU 33 17.879 14.075 1.510 247 HA LEU 33 HA LEU 33 17.851 16.191 -0.366 248 HB2 LEU 33 HB2 LEU 33 18.270 16.390 2.095 249 HB3 LEU 33 HB3 LEU 33 19.824 15.589 1.875 250 HG LEU 33 HG LEU 33 20.593 17.485 0.438 251 HD11 LEU 33 HD11 LEU 33 18.445 18.366 -0.367 252 HD12 LEU 33 HD12 LEU 33 17.957 18.772 1.294 253 HD13 LEU 33 HD13 LEU 33 19.312 19.618 0.516 254 HD21 LEU 33 HD23 LEU 33 20.919 19.044 2.300 255 HD22 LEU 33 HD21 LEU 33 19.610 18.264 3.217 256 HD23 LEU 33 HD22 LEU 33 21.104 17.376 2.848 257 H ASP 34 H ASP 34 20.304 13.659 0.256 258 HA ASP 34 HA ASP 34 22.349 14.615 -1.373 259 HB2 ASP 34 HB2 ASP 34 22.586 12.826 0.295 260 HB3 ASP 34 HB3 ASP 34 21.619 11.740 -0.708 261 H LYS 35 H LYS 35 19.399 12.952 -2.388 262 HA LYS 35 HA LYS 35 20.457 12.849 -5.190 263 HB2 LYS 35 HB2 LYS 35 17.910 11.496 -4.494 264 HB3 LYS 35 HB3 LYS 35 19.079 11.091 -5.719 265 HG2 LYS 35 HG2 LYS 35 19.307 10.533 -2.738 266 HG3 LYS 35 HG3 LYS 35 18.875 9.370 -3.981 267 HD2 LYS 35 HD2 LYS 35 21.111 9.559 -4.999 268 HD3 LYS 35 HD3 LYS 35 21.565 10.780 -3.790 269 HE2 LYS 35 HE2 LYS 35 20.964 9.077 -1.992 270 HE3 LYS 35 HE3 LYS 35 20.807 7.866 -3.274 271 HZ1 LYS 35 HZ3 LYS 35 22.985 7.832 -2.246 272 HZ2 LYS 35 HZ1 LYS 35 23.152 8.286 -3.817 273 HZ3 LYS 35 HZ2 LYS 35 23.242 9.417 -2.613 274 H ASN 36 H ASN 36 19.181 15.109 -3.455 275 HA ASN 36 HA ASN 36 17.582 16.621 -3.452 276 HB2 ASN 36 HB2 ASN 36 17.322 17.976 -5.423 277 HB3 ASN 36 HB3 ASN 36 18.992 17.542 -5.142 278 HD21 ASN 36 HD22 ASN 36 20.111 16.276 -6.723 279 HD22 ASN 36 HD21 ASN 36 19.410 15.932 -8.281 280 H TYR 37 H TYR 37 16.367 14.154 -3.150 281 HA TYR 37 HA TYR 37 13.782 14.272 -4.523 282 HB2 TYR 37 HB2 TYR 37 14.710 13.050 -1.908 283 HB3 TYR 37 HB3 TYR 37 13.019 13.094 -2.365 284 HD1 TYR 37 HD2 TYR 37 16.284 11.559 -3.096 285 HD2 TYR 37 HD1 TYR 37 12.087 11.597 -3.996 286 HE1 TYR 37 HE2 TYR 37 16.565 9.509 -4.481 287 HE2 TYR 37 HE1 TYR 37 12.362 9.598 -5.438 288 HH TYR 37 HH TYR 37 15.532 8.026 -5.975 289 H ILE 38 H ILE 38 15.436 16.172 -2.107 290 HA ILE 38 HA ILE 38 13.089 17.882 -1.692 291 HB ILE 38 HB ILE 38 13.493 17.958 0.729 292 HG12 ILE 38 HG12 ILE 38 15.476 15.684 0.288 293 HG13 ILE 38 HG13 ILE 38 15.879 17.328 0.790 294 HG21 ILE 38 HG21 ILE 38 11.822 16.338 -0.253 295 HG22 ILE 38 HG22 ILE 38 13.040 15.058 -0.060 296 HG23 ILE 38 HG23 ILE 38 12.400 15.917 1.351 297 HD11 ILE 38 HD13 ILE 38 15.960 15.882 2.699 298 HD12 ILE 38 HD11 ILE 38 14.585 16.985 2.887 299 HD13 ILE 38 HD12 ILE 38 14.323 15.284 2.419 300 H SER 39 H SER 39 13.746 19.973 -0.797 301 HA SER 39 HA SER 39 16.553 20.803 -1.316 302 HB2 SER 39 HB2 SER 39 14.041 22.415 -0.666 303 HB3 SER 39 HB3 SER 39 15.617 23.072 -1.138 304 HG SER 39 HG SER 39 14.142 22.979 -2.885 305 H GLU 40 H GLU 40 17.523 22.228 0.425 306 HA GLU 40 HA GLU 40 17.604 20.962 2.911 307 HB2 GLU 40 HB2 GLU 40 18.373 23.800 2.133 308 HB3 GLU 40 HB3 GLU 40 18.765 23.057 3.690 309 HG2 GLU 40 HG2 GLU 40 20.010 21.256 2.532 310 HG3 GLU 40 HG3 GLU 40 19.663 22.012 0.973 311 H ASN 41 H ASN 41 15.573 23.704 1.901 312 HA ASN 41 HA ASN 41 14.676 24.562 4.423 313 HB2 ASN 41 HB2 ASN 41 14.262 25.745 2.262 314 HB3 ASN 41 HB3 ASN 41 13.077 24.507 1.824 315 HD21 ASN 41 HD22 ASN 41 10.941 24.654 2.749 316 HD22 ASN 41 HD21 ASN 41 10.501 25.954 3.831 317 H TYR 42 H TYR 42 13.701 21.702 2.571 318 HA TYR 42 HA TYR 42 11.173 21.227 3.783 319 HB2 TYR 42 HB2 TYR 42 12.075 20.143 1.716 320 HB3 TYR 42 HB3 TYR 42 13.223 19.255 2.706 321 HD1 TYR 42 HD1 TYR 42 9.628 19.629 1.840 322 HD2 TYR 42 HD2 TYR 42 12.559 17.300 3.986 323 HE1 TYR 42 HE1 TYR 42 7.995 17.784 2.068 324 HE2 TYR 42 HE2 TYR 42 10.936 15.440 4.177 325 HH TYR 42 HH TYR 42 8.862 14.621 3.544 326 H ILE 43 H ILE 43 14.513 20.224 4.703 327 HA ILE 43 HA ILE 43 13.705 18.638 6.961 328 HB ILE 43 HB ILE 43 16.370 20.068 6.497 329 HG12 ILE 43 HG12 ILE 43 16.928 17.481 5.887 330 HG13 ILE 43 HG13 ILE 43 15.252 17.527 5.332 331 HG21 ILE 43 HG21 ILE 43 15.977 19.224 8.817 332 HG22 ILE 43 HG22 ILE 43 15.740 17.596 8.160 333 HG23 ILE 43 HG23 ILE 43 17.312 18.405 7.995 334 HD11 ILE 43 HD13 ILE 43 16.915 17.996 3.548 335 HD12 ILE 43 HD11 ILE 43 15.844 19.382 3.796 336 HD13 ILE 43 HD12 ILE 43 17.498 19.394 4.462 337 H GLN 44 H GLN 44 14.776 22.060 6.558 338 HA GLN 44 HA GLN 44 14.758 22.594 9.327 339 HB2 GLN 44 HB2 GLN 44 15.911 23.910 7.456 340 HB3 GLN 44 HB3 GLN 44 14.351 24.676 7.149 341 HG2 GLN 44 HG2 GLN 44 15.743 26.090 8.595 342 HG3 GLN 44 HG3 GLN 44 14.317 25.553 9.468 343 HE21 GLN 44 HE22 GLN 44 14.931 25.283 11.617 344 HE22 GLN 44 HE21 GLN 44 16.390 24.481 12.141 345 H ALA 45 H ALA 45 12.088 22.756 6.959 346 HA ALA 45 HA ALA 45 10.225 24.133 8.587 347 HB1 ALA 45 HB3 ALA 45 8.520 23.049 7.182 348 HB2 ALA 45 HB1 ALA 45 9.875 23.619 6.188 349 HB3 ALA 45 HB2 ALA 45 9.718 21.890 6.575 350 H ILE 46 H ILE 46 11.105 20.635 8.513 351 HA ILE 46 HA ILE 46 9.089 19.857 10.419 352 HB ILE 46 HB ILE 46 11.731 18.440 9.943 353 HG12 ILE 46 HG12 ILE 46 9.197 17.898 8.364 354 HG13 ILE 46 HG13 ILE 46 10.500 18.886 7.743 355 HG21 ILE 46 HG21 ILE 46 10.229 17.690 11.861 356 HG22 ILE 46 HG22 ILE 46 8.970 17.335 10.674 357 HG23 ILE 46 HG23 ILE 46 10.504 16.438 10.656 358 HD11 ILE 46 HD13 ILE 46 10.725 16.660 6.858 359 HD12 ILE 46 HD11 ILE 46 12.090 17.015 7.935 360 HD13 ILE 46 HD12 ILE 46 10.773 15.958 8.483 361 H LYS 47 H LYS 47 12.586 20.725 10.682 362 HA LYS 47 HA LYS 47 12.849 20.323 13.488 363 HB2 LYS 47 HB2 LYS 47 14.233 22.305 11.631 364 HB3 LYS 47 HB3 LYS 47 14.705 22.034 13.305 365 HG2 LYS 47 HG2 LYS 47 15.356 19.746 12.855 366 HG3 LYS 47 HG3 LYS 47 14.718 19.826 11.201 367 HD2 LYS 47 HD2 LYS 47 16.333 21.549 10.596 368 HD3 LYS 47 HD3 LYS 47 16.936 21.636 12.258 369 HE2 LYS 47 HE2 LYS 47 17.808 19.347 12.096 370 HE3 LYS 47 HE3 LYS 47 17.115 19.149 10.495 371 HZ1 LYS 47 HZ3 LYS 47 19.478 19.735 10.390 372 HZ2 LYS 47 HZ1 LYS 47 18.594 20.916 9.695 373 HZ3 LYS 47 HZ2 LYS 47 19.222 21.133 11.184 374 H ASP 48 H ASP 48 11.969 23.320 11.690 375 HA ASP 48 HA ASP 48 11.710 24.961 13.980 376 HB2 ASP 48 HB2 ASP 48 11.915 25.846 11.716 377 HB3 ASP 48 HB3 ASP 48 10.369 25.125 11.256 378 H SER 49 H SER 49 9.251 22.958 12.266 379 HA SER 49 HA SER 49 7.037 23.736 13.900 380 HB2 SER 49 HB2 SER 49 7.537 21.087 12.478 381 HB3 SER 49 HB3 SER 49 5.983 21.730 13.033 382 HG SER 49 HG SER 49 7.674 22.670 10.951 383 H THR 50 H THR 50 9.458 21.115 14.204 384 HA THR 50 HA THR 50 8.333 19.835 16.466 385 HB THR 50 HB THR 50 11.180 19.985 15.402 386 HG1 THR 50 HG1 THR 50 9.828 19.081 13.954 387 HG21 THR 50 HG23 THR 50 11.520 17.828 16.588 388 HG22 THR 50 HG21 THR 50 11.348 19.212 17.666 389 HG23 THR 50 HG22 THR 50 9.980 18.089 17.452 390 H ILE 51 H ILE 51 10.759 22.498 16.207 391 HA ILE 51 HA ILE 51 11.105 22.799 19.029 392 HB ILE 51 HB ILE 51 11.545 24.637 16.645 393 HG12 ILE 51 HG12 ILE 51 13.598 23.233 18.418 394 HG13 ILE 51 HG13 ILE 51 12.930 22.462 16.993 395 HG21 ILE 51 HG21 ILE 51 11.245 26.094 18.606 396 HG22 ILE 51 HG22 ILE 51 12.403 25.117 19.535 397 HG23 ILE 51 HG23 ILE 51 12.935 26.071 18.134 398 HD11 ILE 51 HD13 ILE 51 15.039 23.429 16.397 399 HD12 ILE 51 HD11 ILE 51 13.758 24.338 15.572 400 HD13 ILE 51 HD12 ILE 51 14.568 25.022 17.004 401 H ASN 52 H ASN 52 8.798 24.315 16.706 402 HA ASN 52 HA ASN 52 7.767 26.200 18.592 403 HB2 ASN 52 HB2 ASN 52 6.879 25.196 15.884 404 HB3 ASN 52 HB3 ASN 52 5.718 26.059 16.874 405 HD21 ASN 52 HD22 ASN 52 8.908 26.382 15.326 406 HD22 ASN 52 HD21 ASN 52 8.914 28.131 15.314 407 H ASN 53 H ASN 53 6.781 22.856 17.866 408 HA ASN 53 HA ASN 53 4.634 23.061 19.953 409 HB2 ASN 53 HB2 ASN 53 3.550 23.433 17.809 410 HB3 ASN 53 HB3 ASN 53 4.400 22.072 17.081 411 HD21 ASN 53 HD22 ASN 53 2.914 20.432 16.727 412 HD22 ASN 53 HD21 ASN 53 1.705 19.928 17.875 413 H GLY 54 H GLY 54 6.168 20.715 17.670 414 HA2 GLY 54 HA2 GLY 54 7.523 19.024 19.265 415 HA3 GLY 54 HA3 GLY 54 5.849 18.516 19.567 416 HA PRO 55 HA PRO 55 7.478 16.708 15.483 417 HB2 PRO 55 HB2 PRO 55 7.379 14.031 16.158 418 HB3 PRO 55 HB3 PRO 55 8.820 15.066 16.358 419 HG2 PRO 55 HG2 PRO 55 6.767 14.305 18.452 420 HG3 PRO 55 HG3 PRO 55 8.550 14.317 18.600 421 HD2 PRO 55 HD2 PRO 55 6.984 16.358 19.520 422 HD3 PRO 55 HD3 PRO 55 8.597 16.669 18.817 423 H TYR 56 H TYR 56 5.822 16.542 14.013 424 HA TYR 56 HA TYR 56 3.094 16.405 14.796 425 HB2 TYR 56 HB2 TYR 56 4.337 15.797 12.076 426 HB3 TYR 56 HB3 TYR 56 2.632 16.041 12.383 427 HD1 TYR 56 HD1 TYR 56 1.760 18.296 13.093 428 HD2 TYR 56 HD2 TYR 56 5.768 17.656 11.617 429 HE1 TYR 56 HE1 TYR 56 1.886 20.674 12.412 430 HE2 TYR 56 HE2 TYR 56 5.895 20.019 10.919 431 HH TYR 56 HH TYR 56 4.835 22.095 10.936 432 H TYR 57 H TYR 57 5.271 13.917 13.382 433 HA TYR 57 HA TYR 57 3.005 11.984 13.356 434 HB2 TYR 57 HB2 TYR 57 5.506 12.199 11.661 435 HB3 TYR 57 HB3 TYR 57 4.358 10.871 11.602 436 HD1 TYR 57 HD1 TYR 57 2.209 13.650 11.945 437 HD2 TYR 57 HD2 TYR 57 4.887 11.763 9.139 438 HE1 TYR 57 HE1 TYR 57 1.063 14.786 10.092 439 HE2 TYR 57 HE2 TYR 57 3.673 12.797 7.271 440 HH TYR 57 HH TYR 57 1.973 14.305 6.654 441 H ILE 58 H ILE 58 3.229 11.248 15.441 442 HA ILE 58 HA ILE 58 5.538 9.422 15.925 443 HB ILE 58 HB ILE 58 3.683 10.794 17.924 444 HG12 ILE 58 HG12 ILE 58 5.314 12.406 17.204 445 HG13 ILE 58 HG13 ILE 58 5.723 11.864 18.815 446 HG21 ILE 58 HG21 ILE 58 4.162 8.573 18.740 447 HG22 ILE 58 HG22 ILE 58 5.892 8.748 18.405 448 HG23 ILE 58 HG23 ILE 58 5.119 9.726 19.670 449 HD11 ILE 58 HD13 ILE 58 7.789 11.983 17.651 450 HD12 ILE 58 HD11 ILE 58 7.414 10.254 17.684 451 HD13 ILE 58 HD12 ILE 58 7.125 11.199 16.213 452 H LEU 59 H LEU 59 4.931 7.300 15.936 453 HA LEU 59 HA LEU 59 2.026 6.766 15.367 454 HB2 LEU 59 HB2 LEU 59 4.517 5.392 14.270 455 HB3 LEU 59 HB3 LEU 59 2.873 4.851 14.022 456 HG LEU 59 HG LEU 59 3.481 5.888 12.050 457 HD11 LEU 59 HD11 LEU 59 1.200 6.478 12.827 458 HD12 LEU 59 HD12 LEU 59 1.832 8.014 13.465 459 HD13 LEU 59 HD13 LEU 59 1.899 7.676 11.725 460 HD21 LEU 59 HD23 LEU 59 4.424 8.053 11.732 461 HD22 LEU 59 HD21 LEU 59 4.299 8.459 13.441 462 HD23 LEU 59 HD22 LEU 59 5.433 7.200 12.911 463 H ALA 60 H ALA 60 4.805 5.786 17.290 464 HA ALA 60 HA ALA 60 3.110 4.257 19.045 465 HB1 ALA 60 HB3 ALA 60 4.508 2.183 18.918 466 HB2 ALA 60 HB1 ALA 60 3.686 2.486 17.381 467 HB3 ALA 60 HB2 ALA 60 5.410 2.877 17.562 468 HA PRO 61 HA PRO 61 6.208 5.807 21.928 469 HB2 PRO 61 HB2 PRO 61 6.459 2.940 22.871 470 HB3 PRO 61 HB3 PRO 61 6.331 4.442 23.838 471 HG2 PRO 61 HG2 PRO 61 4.159 2.879 23.490 472 HG3 PRO 61 HG3 PRO 61 4.011 4.662 23.343 473 HD2 PRO 61 HD2 PRO 61 4.232 2.603 21.142 474 HD3 PRO 61 HD3 PRO 61 3.153 4.028 21.253 475 H GLY 62 H GLY 62 8.135 6.396 21.071 476 HA2 GLY 62 HA2 GLY 62 10.402 6.122 20.698 477 HA3 GLY 62 HA3 GLY 62 10.209 4.378 20.578 478 H VAL 63 H VAL 63 7.870 5.835 18.522 479 HA VAL 63 HA VAL 63 9.672 5.445 16.179 480 HB VAL 63 HB VAL 63 6.809 4.482 16.509 481 HG11 VAL 63 HG11 VAL 63 7.359 4.968 14.174 482 HG12 VAL 63 HG12 VAL 63 8.856 4.024 14.297 483 HG13 VAL 63 HG13 VAL 63 7.270 3.228 14.415 484 HG21 VAL 63 HG23 VAL 63 7.815 2.179 16.499 485 HG22 VAL 63 HG21 VAL 63 9.419 2.917 16.695 486 HG23 VAL 63 HG22 VAL 63 8.183 3.100 17.951 487 H ALA 64 H ALA 64 9.630 7.037 14.717 488 HA ALA 64 HA ALA 64 7.357 8.957 14.645 489 HB1 ALA 64 HB3 ALA 64 8.965 10.794 14.516 490 HB2 ALA 64 HB1 ALA 64 9.287 9.860 15.989 491 HB3 ALA 64 HB2 ALA 64 10.325 9.655 14.558 492 H MET 65 H MET 65 7.451 10.325 12.633 493 HA MET 65 HA MET 65 8.854 9.045 10.358 494 HB2 MET 65 HB2 MET 65 6.572 8.074 10.571 495 HB3 MET 65 HB3 MET 65 5.902 9.693 10.399 496 HG2 MET 65 HG2 MET 65 7.566 9.456 8.168 497 HG3 MET 65 HG3 MET 65 6.962 7.822 8.377 498 HE1 MET 65 HE3 MET 65 2.984 8.642 8.198 499 HE2 MET 65 HE1 MET 65 4.180 7.504 8.844 500 HE3 MET 65 HE2 MET 65 3.860 9.040 9.682 501 HA PRO 66 HA PRO 66 9.285 13.721 10.506 502 HB2 PRO 66 HB2 PRO 66 11.879 12.850 9.213 503 HB3 PRO 66 HB3 PRO 66 11.569 14.214 10.333 504 HG2 PRO 66 HG2 PRO 66 12.645 11.930 11.286 505 HG3 PRO 66 HG3 PRO 66 11.326 12.730 12.196 506 HD2 PRO 66 HD2 PRO 66 11.133 10.372 10.303 507 HD3 PRO 66 HD3 PRO 66 10.407 10.580 11.925 508 H HIS 67 H HIS 67 8.250 14.820 8.939 509 HA HIS 67 HA HIS 67 8.697 14.517 6.082 510 HB2 HIS 67 HB2 HIS 67 7.233 12.620 6.383 511 HB3 HIS 67 HB3 HIS 67 6.229 13.481 7.537 512 HD1 HIS 67 HD1 HIS 67 4.393 15.195 6.534 513 HD2 HIS 67 HD2 HIS 67 6.660 13.010 3.751 514 HE1 HIS 67 HE1 HIS 67 3.175 15.373 4.303 515 H ALA 68 H ALA 68 7.507 16.260 4.968 516 HA ALA 68 HA ALA 68 5.980 18.175 6.574 517 HB1 ALA 68 HB3 ALA 68 7.216 20.099 5.607 518 HB2 ALA 68 HB1 ALA 68 8.256 19.135 6.654 519 HB3 ALA 68 HB2 ALA 68 8.401 18.990 4.890 520 H ARG 69 H ARG 69 4.842 19.730 4.931 521 HA ARG 69 HA ARG 69 3.549 18.079 2.988 522 HB2 ARG 69 HB2 ARG 69 3.579 21.131 3.127 523 HB3 ARG 69 HB3 ARG 69 2.451 20.136 2.204 524 HG2 ARG 69 HG2 ARG 69 1.763 19.060 4.446 525 HG3 ARG 69 HG3 ARG 69 2.676 20.371 5.224 526 HD2 ARG 69 HD2 ARG 69 1.280 22.005 3.845 527 HD3 ARG 69 HD3 ARG 69 0.292 20.615 3.349 528 HE ARG 69 HE ARG 69 0.574 20.808 6.224 529 HH11 ARG 69 HH11 ARG 69 -1.274 22.076 3.473 530 HH12 ARG 69 HH12 ARG 69 -2.597 22.629 4.428 531 HH21 ARG 69 HH21 ARG 69 -1.178 21.571 7.510 532 HH22 ARG 69 HH22 ARG 69 -2.537 22.334 6.777 533 HA PRO 70 HA PRO 70 6.126 18.169 -0.604 534 HB2 PRO 70 HB2 PRO 70 3.693 19.291 -2.038 535 HB3 PRO 70 HB3 PRO 70 4.836 18.043 -2.605 536 HG2 PRO 70 HG2 PRO 70 2.458 17.320 -1.526 537 HG3 PRO 70 HG3 PRO 70 3.941 16.434 -1.051 538 HD2 PRO 70 HD2 PRO 70 2.457 18.570 0.470 539 HD3 PRO 70 HD3 PRO 70 3.256 17.086 1.072 540 H GLU 71 H GLU 71 3.994 21.048 -0.374 541 HA GLU 71 HA GLU 71 5.682 22.805 -1.807 542 HB2 GLU 71 HB2 GLU 71 4.169 24.578 -0.780 543 HB3 GLU 71 HB3 GLU 71 3.426 23.321 -1.762 544 HG2 GLU 71 HG2 GLU 71 2.614 22.148 0.222 545 HG3 GLU 71 HG3 GLU 71 3.486 23.259 1.280 546 H CYS 72 H CYS 72 6.232 21.616 1.385 547 HA CYS 72 HA CYS 72 7.658 23.981 2.334 548 HB2 CYS 72 HB2 CYS 72 7.742 21.084 3.285 549 HB3 CYS 72 HB3 CYS 72 8.486 22.474 4.093 550 HG CYS 72 HG CYS 72 6.395 21.987 5.465 551 H GLY 73 H GLY 73 8.368 21.605 -0.059 552 HA2 GLY 73 HA2 GLY 73 10.366 22.524 -1.294 553 HA3 GLY 73 HA3 GLY 73 11.303 22.206 0.166 554 H ALA 74 H ALA 74 8.777 19.922 -0.975 555 HA ALA 74 HA ALA 74 10.853 17.876 -1.420 556 HB1 ALA 74 HB3 ALA 74 8.971 16.411 -1.938 557 HB2 ALA 74 HB1 ALA 74 8.667 17.237 -0.395 558 HB3 ALA 74 HB2 ALA 74 7.858 17.790 -1.886 559 H LEU 75 H LEU 75 11.122 16.911 -3.483 560 HA LEU 75 HA LEU 75 10.426 18.615 -5.850 561 HB2 LEU 75 HB2 LEU 75 13.064 17.271 -5.165 562 HB3 LEU 75 HB3 LEU 75 12.732 18.144 -6.651 563 HG LEU 75 HG LEU 75 12.773 19.405 -3.868 564 HD11 LEU 75 HD11 LEU 75 14.990 18.632 -4.505 565 HD12 LEU 75 HD12 LEU 75 14.858 19.427 -6.088 566 HD13 LEU 75 HD13 LEU 75 14.921 20.392 -4.597 567 HD21 LEU 75 HD23 LEU 75 12.822 21.552 -5.090 568 HD22 LEU 75 HD21 LEU 75 12.648 20.692 -6.637 569 HD23 LEU 75 HD22 LEU 75 11.336 20.667 -5.438 570 H LYS 76 H LYS 76 10.834 15.409 -4.467 571 HA LYS 76 HA LYS 76 9.657 14.115 -6.825 572 HB2 LYS 76 HB2 LYS 76 12.224 13.132 -5.557 573 HB3 LYS 76 HB3 LYS 76 11.354 12.352 -6.880 574 HG2 LYS 76 HG2 LYS 76 11.959 14.307 -8.340 575 HG3 LYS 76 HG3 LYS 76 12.861 14.994 -6.975 576 HD2 LYS 76 HD2 LYS 76 13.953 12.488 -7.022 577 HD3 LYS 76 HD3 LYS 76 13.546 12.675 -8.738 578 HE2 LYS 76 HE2 LYS 76 14.824 14.813 -8.794 579 HE3 LYS 76 HE3 LYS 76 15.127 14.677 -7.062 580 HZ1 LYS 76 HZ3 LYS 76 17.030 13.923 -8.173 581 HZ2 LYS 76 HZ1 LYS 76 16.354 12.610 -7.529 582 HZ3 LYS 76 HZ2 LYS 76 16.208 12.885 -9.147 583 H THR 77 H THR 77 9.738 11.490 -5.813 584 HA THR 77 HA THR 77 8.569 11.748 -3.093 585 HB THR 77 HB THR 77 7.602 10.040 -5.411 586 HG1 THR 77 HG1 THR 77 6.328 11.613 -5.887 587 HG21 THR 77 HG23 THR 77 5.631 9.579 -4.033 588 HG22 THR 77 HG21 THR 77 7.085 9.038 -3.196 589 HG23 THR 77 HG22 THR 77 6.295 10.542 -2.696 590 H GLY 78 H GLY 78 9.437 10.405 -1.565 591 HA2 GLY 78 HA2 GLY 78 10.520 7.808 -2.126 592 HA3 GLY 78 HA3 GLY 78 11.807 9.013 -2.000 593 H MET 79 H MET 79 12.158 7.296 -0.133 594 HA MET 79 HA MET 79 11.137 8.440 2.399 595 HB2 MET 79 HB2 MET 79 11.058 5.523 1.516 596 HB3 MET 79 HB3 MET 79 10.923 6.012 3.203 597 HG2 MET 79 HG2 MET 79 8.892 7.284 2.739 598 HG3 MET 79 HG3 MET 79 8.994 6.858 1.027 599 HE1 MET 79 HE3 MET 79 6.012 4.609 1.844 600 HE2 MET 79 HE1 MET 79 6.295 6.286 2.361 601 HE3 MET 79 HE2 MET 79 6.742 5.768 0.714 602 H SER 80 H SER 80 12.320 7.468 4.269 603 HA SER 80 HA SER 80 15.034 6.443 3.768 604 HB2 SER 80 HB2 SER 80 14.501 8.673 5.756 605 HB3 SER 80 HB3 SER 80 16.064 7.971 5.336 606 HG SER 80 HG SER 80 15.418 10.080 4.423 607 H LEU 81 H LEU 81 15.897 5.564 5.944 608 HA LEU 81 HA LEU 81 13.928 5.050 8.073 609 HB2 LEU 81 HB2 LEU 81 13.414 3.214 6.668 610 HB3 LEU 81 HB3 LEU 81 15.092 2.989 6.186 611 HG LEU 81 HG LEU 81 15.686 2.017 8.267 612 HD11 LEU 81 HD11 LEU 81 14.143 3.340 9.824 613 HD12 LEU 81 HD12 LEU 81 12.832 2.288 9.282 614 HD13 LEU 81 HD13 LEU 81 14.227 1.615 10.133 615 HD21 LEU 81 HD23 LEU 81 14.246 -0.012 8.183 616 HD22 LEU 81 HD21 LEU 81 13.039 0.891 7.270 617 HD23 LEU 81 HD22 LEU 81 14.636 0.579 6.557 618 H THR 82 H THR 82 15.022 5.481 9.899 619 HA THR 82 HA THR 82 17.959 5.059 10.024 620 HB THR 82 HB THR 82 16.380 7.534 10.849 621 HG1 THR 82 HG1 THR 82 17.710 8.432 9.075 622 HG21 THR 82 HG23 THR 82 18.541 8.570 11.247 623 HG22 THR 82 HG21 THR 82 18.432 7.098 12.212 624 HG23 THR 82 HG22 THR 82 19.399 7.096 10.724 625 H LEU 83 H LEU 83 18.525 3.996 11.858 626 HA LEU 83 HA LEU 83 16.602 3.933 14.149 627 HB2 LEU 83 HB2 LEU 83 16.925 1.725 12.936 628 HB3 LEU 83 HB3 LEU 83 18.641 1.831 13.343 629 HG LEU 83 HG LEU 83 17.867 1.984 15.827 630 HD11 LEU 83 HD11 LEU 83 15.431 2.414 15.286 631 HD12 LEU 83 HD12 LEU 83 15.333 0.769 14.643 632 HD13 LEU 83 HD13 LEU 83 15.703 1.039 16.362 633 HD21 LEU 83 HD23 LEU 83 17.680 -0.454 16.018 634 HD22 LEU 83 HD21 LEU 83 17.400 -0.581 14.271 635 HD23 LEU 83 HD22 LEU 83 18.962 0.003 14.887 636 H LEU 84 H LEU 84 17.423 4.514 16.096 637 HA LEU 84 HA LEU 84 20.287 5.349 16.318 638 HB2 LEU 84 HB2 LEU 84 17.695 6.447 17.441 639 HB3 LEU 84 HB3 LEU 84 19.243 6.747 18.227 640 HG LEU 84 HG LEU 84 20.081 8.030 16.417 641 HD11 LEU 84 HD11 LEU 84 19.255 6.955 14.435 642 HD12 LEU 84 HD12 LEU 84 17.564 7.285 14.882 643 HD13 LEU 84 HD13 LEU 84 18.659 8.615 14.428 644 HD21 LEU 84 HD23 LEU 84 18.381 9.872 16.446 645 HD22 LEU 84 HD21 LEU 84 17.185 8.739 17.087 646 HD23 LEU 84 HD22 LEU 84 18.626 9.144 18.042 647 H GLU 85 H GLU 85 21.331 3.819 17.599 648 HA GLU 85 HA GLU 85 19.978 1.743 18.931 649 HB2 GLU 85 HB2 GLU 85 22.793 2.798 19.434 650 HB3 GLU 85 HB3 GLU 85 22.146 1.288 20.067 651 HG2 GLU 85 HG2 GLU 85 21.732 0.511 17.720 652 HG3 GLU 85 HG3 GLU 85 22.545 1.961 17.126 653 H GLN 86 H GLN 86 21.229 4.821 20.300 654 HA GLN 86 HA GLN 86 19.971 4.135 22.910 655 HB2 GLN 86 HB2 GLN 86 21.818 6.432 22.180 656 HB3 GLN 86 HB3 GLN 86 21.241 6.007 23.790 657 HG2 GLN 86 HG2 GLN 86 22.402 3.761 23.538 658 HG3 GLN 86 HG3 GLN 86 23.103 4.357 22.031 659 HE21 GLN 86 HE22 GLN 86 25.314 4.759 22.504 660 HE22 GLN 86 HE21 GLN 86 25.840 5.678 23.880 661 H GLY 87 H GLY 87 18.918 5.594 20.119 662 HA2 GLY 87 HA2 GLY 87 17.212 7.013 19.601 663 HA3 GLY 87 HA3 GLY 87 16.676 6.903 21.275 664 H VAL 88 H VAL 88 16.089 9.223 20.430 665 HA VAL 88 HA VAL 88 17.785 10.890 22.057 666 HB VAL 88 HB VAL 88 18.303 11.028 19.313 667 HG11 VAL 88 HG11 VAL 88 16.198 12.216 18.824 668 HG12 VAL 88 HG12 VAL 88 16.667 13.507 19.959 669 HG13 VAL 88 HG13 VAL 88 17.637 13.201 18.510 670 HG21 VAL 88 HG23 VAL 88 19.661 12.969 19.859 671 HG22 VAL 88 HG21 VAL 88 18.792 13.179 21.396 672 HG23 VAL 88 HG22 VAL 88 19.789 11.732 21.114 673 H TYR 89 H TYR 89 16.579 12.733 22.874 674 HA TYR 89 HA TYR 89 13.700 12.140 22.954 675 HB2 TYR 89 HB2 TYR 89 15.313 12.573 24.952 676 HB3 TYR 89 HB3 TYR 89 15.132 14.269 24.547 677 HD1 TYR 89 HD2 TYR 89 12.674 15.209 24.478 678 HD2 TYR 89 HD1 TYR 89 13.759 11.448 26.293 679 HE1 TYR 89 HE2 TYR 89 10.587 15.251 25.796 680 HE2 TYR 89 HE1 TYR 89 11.695 11.509 27.661 681 HH TYR 89 HH TYR 89 9.278 14.143 27.369 682 H PHE 90 H PHE 90 12.306 13.175 21.622 683 HA PHE 90 HA PHE 90 13.102 15.682 20.256 684 HB2 PHE 90 HB2 PHE 90 10.844 13.680 19.944 685 HB3 PHE 90 HB3 PHE 90 10.661 15.320 19.356 686 HD1 PHE 90 HD2 PHE 90 13.417 12.694 19.175 687 HD2 PHE 90 HD1 PHE 90 10.977 15.588 17.095 688 HE1 PHE 90 HE2 PHE 90 14.571 12.160 17.055 689 HE2 PHE 90 HE1 PHE 90 12.121 15.028 14.980 690 HZ PHE 90 HZ PHE 90 13.939 13.331 14.952 691 HA PRO 91 HA PRO 91 11.234 18.025 23.441 692 HB2 PRO 91 HB2 PRO 91 10.394 20.330 22.209 693 HB3 PRO 91 HB3 PRO 91 12.117 19.923 22.462 694 HG2 PRO 91 HG2 PRO 91 10.447 19.524 19.976 695 HG3 PRO 91 HG3 PRO 91 12.100 20.207 20.098 696 HD2 PRO 91 HD2 PRO 91 11.598 17.591 19.414 697 HD3 PRO 91 HD3 PRO 91 13.046 18.063 20.336 698 H GLY 92 H GLY 92 9.296 18.044 24.477 699 HA2 GLY 92 HA2 GLY 92 7.051 18.046 24.866 700 HA3 GLY 92 HA3 GLY 92 6.771 18.420 23.161 701 H ASN 93 H ASN 93 8.591 15.628 22.942 702 HA ASN 93 HA ASN 93 6.193 13.947 22.700 703 HB2 ASN 93 HB2 ASN 93 8.171 13.767 21.102 704 HB3 ASN 93 HB3 ASN 93 9.087 13.050 22.437 705 HD21 ASN 93 HD22 ASN 93 9.062 10.743 22.203 706 HD22 ASN 93 HD21 ASN 93 7.646 9.865 21.672 707 H ASP 94 H ASP 94 6.129 11.790 23.848 708 HA ASP 94 HA ASP 94 6.366 12.274 26.680 709 HB2 ASP 94 HB2 ASP 94 4.470 11.098 25.627 710 HB3 ASP 94 HB3 ASP 94 5.547 9.791 25.129 711 H GLU 95 H GLU 95 8.416 10.542 24.361 712 HA GLU 95 HA GLU 95 10.345 9.847 26.426 713 HB2 GLU 95 HB2 GLU 95 10.230 7.467 26.187 714 HB3 GLU 95 HB3 GLU 95 8.630 8.024 26.559 715 HG2 GLU 95 HG2 GLU 95 7.899 7.709 24.252 716 HG3 GLU 95 HG3 GLU 95 9.550 7.361 23.732 717 HA PRO 96 HA PRO 96 12.925 10.339 22.900 718 HB2 PRO 96 HB2 PRO 96 15.001 8.549 23.023 719 HB3 PRO 96 HB3 PRO 96 14.816 9.921 24.158 720 HG2 PRO 96 HG2 PRO 96 13.998 7.038 24.570 721 HG3 PRO 96 HG3 PRO 96 14.881 8.112 25.701 722 HD2 PRO 96 HD2 PRO 96 12.213 7.661 25.868 723 HD3 PRO 96 HD3 PRO 96 12.901 9.249 26.298 724 H ILE 97 H ILE 97 13.326 9.762 20.794 725 HA ILE 97 HA ILE 97 11.711 7.505 19.756 726 HB ILE 97 HB ILE 97 13.080 9.863 18.390 727 HG12 ILE 97 HG12 ILE 97 11.252 10.724 19.713 728 HG13 ILE 97 HG13 ILE 97 10.805 10.763 18.021 729 HG21 ILE 97 HG21 ILE 97 12.891 8.006 16.831 730 HG22 ILE 97 HG22 ILE 97 11.176 7.784 17.223 731 HG23 ILE 97 HG23 ILE 97 11.731 9.262 16.414 732 HD11 ILE 97 HD13 ILE 97 8.922 10.058 19.391 733 HD12 ILE 97 HD11 ILE 97 9.399 8.714 18.346 734 HD13 ILE 97 HD12 ILE 97 9.840 8.714 20.073 735 H LYS 98 H LYS 98 12.687 5.739 18.854 736 HA LYS 98 HA LYS 98 15.675 5.745 18.582 737 HB2 LYS 98 HB2 LYS 98 13.731 3.508 19.275 738 HB3 LYS 98 HB3 LYS 98 15.328 3.205 18.584 739 HG2 LYS 98 HG2 LYS 98 16.349 4.535 20.457 740 HG3 LYS 98 HG3 LYS 98 14.754 4.653 21.202 741 HD2 LYS 98 HD2 LYS 98 16.147 2.905 22.214 742 HD3 LYS 98 HD3 LYS 98 14.687 2.209 21.491 743 HE2 LYS 98 HE2 LYS 98 15.871 1.245 19.691 744 HE3 LYS 98 HE3 LYS 98 17.249 2.339 19.878 745 HZ1 LYS 98 HZ3 LYS 98 17.616 0.012 20.655 746 HZ2 LYS 98 HZ1 LYS 98 18.004 1.177 21.722 747 HZ3 LYS 98 HZ2 LYS 98 16.615 0.295 21.914 748 H LEU 99 H LEU 99 12.589 5.341 16.907 749 HA LEU 99 HA LEU 99 14.066 4.389 14.483 750 HB2 LEU 99 HB2 LEU 99 12.814 2.582 15.531 751 HB3 LEU 99 HB3 LEU 99 11.386 3.606 15.682 752 HG LEU 99 HG LEU 99 11.133 3.655 13.218 753 HD11 LEU 99 HD11 LEU 99 13.462 3.346 12.480 754 HD12 LEU 99 HD12 LEU 99 13.508 1.732 13.220 755 HD13 LEU 99 HD13 LEU 99 12.444 2.057 11.837 756 HD21 LEU 99 HD23 LEU 99 10.383 1.336 12.998 757 HD22 LEU 99 HD21 LEU 99 11.389 0.849 14.386 758 HD23 LEU 99 HD22 LEU 99 10.007 1.932 14.610 759 H LEU 100 H LEU 100 13.833 5.704 12.765 760 HA LEU 100 HA LEU 100 11.503 7.546 12.634 761 HB2 LEU 100 HB2 LEU 100 14.354 8.335 11.905 762 HB3 LEU 100 HB3 LEU 100 12.909 9.324 11.862 763 HG LEU 100 HG LEU 100 12.889 8.633 14.499 764 HD11 LEU 100 HD11 LEU 100 15.062 7.388 14.319 765 HD12 LEU 100 HD12 LEU 100 15.843 8.883 13.776 766 HD13 LEU 100 HD13 LEU 100 15.167 8.773 15.415 767 HD21 LEU 100 HD23 LEU 100 13.870 10.807 15.011 768 HD22 LEU 100 HD21 LEU 100 14.455 10.959 13.341 769 HD23 LEU 100 HD22 LEU 100 12.710 10.921 13.684 770 H ILE 101 H ILE 101 10.654 7.661 10.556 771 HA ILE 101 HA ILE 101 12.263 6.522 8.334 772 HB ILE 101 HB ILE 101 9.505 5.753 9.229 773 HG12 ILE 101 HG12 ILE 101 11.665 4.312 7.634 774 HG13 ILE 101 HG13 ILE 101 11.651 4.366 9.391 775 HG21 ILE 101 HG21 ILE 101 9.002 6.806 7.039 776 HG22 ILE 101 HG22 ILE 101 10.252 5.813 6.267 777 HG23 ILE 101 HG23 ILE 101 8.811 5.061 6.966 778 HD11 ILE 101 HD13 ILE 101 10.794 2.239 8.314 779 HD12 ILE 101 HD11 ILE 101 9.776 2.961 9.555 780 HD13 ILE 101 HD12 ILE 101 9.354 3.130 7.828 781 H GLY 102 H GLY 102 12.521 7.886 6.732 782 HA2 GLY 102 HA2 GLY 102 11.333 10.590 6.943 783 HA3 GLY 102 HA3 GLY 102 12.642 10.090 5.859 784 H LEU 103 H LEU 103 10.167 11.478 5.120 785 HA LEU 103 HA LEU 103 9.379 9.733 2.888 786 HB2 LEU 103 HB2 LEU 103 7.762 9.466 4.909 787 HB3 LEU 103 HB3 LEU 103 7.318 11.130 4.638 788 HG LEU 103 HG LEU 103 6.800 8.691 2.921 789 HD11 LEU 103 HD11 LEU 103 5.250 9.341 4.802 790 HD12 LEU 103 HD12 LEU 103 4.908 10.847 3.949 791 HD13 LEU 103 HD13 LEU 103 4.479 9.287 3.213 792 HD21 LEU 103 HD23 LEU 103 5.555 10.252 1.322 793 HD22 LEU 103 HD21 LEU 103 6.496 11.571 1.999 794 HD23 LEU 103 HD22 LEU 103 7.298 10.189 1.181 795 H SER 104 H SER 104 9.214 11.077 1.058 796 HA SER 104 HA SER 104 8.391 13.863 1.394 797 HB2 SER 104 HB2 SER 104 10.062 14.607 -0.297 798 HB3 SER 104 HB3 SER 104 10.797 14.105 1.237 799 HG SER 104 HG SER 104 11.853 13.275 -0.662 800 H ALA 105 H ALA 105 7.377 14.678 -0.602 801 HA ALA 105 HA ALA 105 6.795 12.722 -2.694 802 HB1 ALA 105 HB3 ALA 105 4.362 12.959 -2.382 803 HB2 ALA 105 HB1 ALA 105 5.109 12.183 -0.970 804 HB3 ALA 105 HB2 ALA 105 4.639 13.903 -0.907 805 H ALA 106 H ALA 106 6.352 13.730 -4.609 806 HA ALA 106 HA ALA 106 6.798 16.584 -4.770 807 HB1 ALA 106 HB3 ALA 106 6.510 16.224 -7.194 808 HB2 ALA 106 HB1 ALA 106 7.584 15.004 -6.497 809 HB3 ALA 106 HB2 ALA 106 5.901 14.582 -6.894 810 H ASP 107 H ASP 107 3.903 14.721 -4.247 811 HA ASP 107 HA ASP 107 2.160 17.037 -4.683 812 HB2 ASP 107 HB2 ASP 107 2.300 15.982 -6.939 813 HB3 ASP 107 HB3 ASP 107 1.839 14.429 -6.239 814 H ALA 108 H ALA 108 0.046 16.659 -3.703 815 HA ALA 108 HA ALA 108 0.160 15.283 -1.258 816 HB1 ALA 108 HB3 ALA 108 -2.228 15.841 -1.085 817 HB2 ALA 108 HB1 ALA 108 -1.289 17.223 -1.682 818 HB3 ALA 108 HB2 ALA 108 -2.272 16.257 -2.811 819 H ASP 109 H ASP 109 -1.111 14.147 -4.455 820 HA ASP 109 HA ASP 109 -2.448 11.837 -3.283 821 HB2 ASP 109 HB2 ASP 109 -3.114 12.711 -5.477 822 HB3 ASP 109 HB3 ASP 109 -1.508 12.353 -6.128 823 H SER 110 H SER 110 0.788 12.477 -4.699 824 HA SER 110 HA SER 110 1.768 9.806 -4.505 825 HB2 SER 110 HB2 SER 110 3.337 12.410 -4.327 826 HB3 SER 110 HB3 SER 110 3.938 10.819 -4.818 827 HG SER 110 HG SER 110 3.479 12.107 -6.631 828 H HIS 111 H HIS 111 1.682 12.557 -2.190 829 HA HIS 111 HA HIS 111 3.060 11.283 -0.049 830 HB2 HIS 111 HB2 HIS 111 2.745 13.566 0.256 831 HB3 HIS 111 HB3 HIS 111 1.087 13.536 -0.286 832 HD1 HIS 111 HD1 HIS 111 3.128 12.980 2.909 833 HD2 HIS 111 HD2 HIS 111 -0.836 13.071 1.483 834 HE1 HIS 111 HE1 HIS 111 1.622 12.875 4.952 835 H ILE 112 H ILE 112 -0.506 11.284 -0.833 836 HA ILE 112 HA ILE 112 -1.191 9.605 1.347 837 HB ILE 112 HB ILE 112 -2.491 10.074 -1.355 838 HG12 ILE 112 HG12 ILE 112 -2.495 11.984 0.224 839 HG13 ILE 112 HG13 ILE 112 -4.098 11.406 -0.172 840 HG21 ILE 112 HG21 ILE 112 -3.267 7.880 -0.780 841 HG22 ILE 112 HG22 ILE 112 -3.575 8.351 0.903 842 HG23 ILE 112 HG23 ILE 112 -4.565 9.017 -0.418 843 HD11 ILE 112 HD13 ILE 112 -3.911 12.015 2.193 844 HD12 ILE 112 HD11 ILE 112 -4.264 10.290 2.036 845 HD13 ILE 112 HD12 ILE 112 -2.617 10.836 2.437 846 H GLY 113 H GLY 113 -0.233 8.679 -2.019 847 HA2 GLY 113 HA2 GLY 113 -0.520 5.890 -1.697 848 HA3 GLY 113 HA3 GLY 113 0.621 6.692 -2.796 849 H ALA 114 H ALA 114 2.350 7.980 -1.077 850 HA ALA 114 HA ALA 114 4.099 5.921 -0.217 851 HB1 ALA 114 HB3 ALA 114 5.384 7.815 0.767 852 HB2 ALA 114 HB1 ALA 114 4.863 8.152 -0.893 853 HB3 ALA 114 HB2 ALA 114 3.997 8.884 0.473 854 H ILE 115 H ILE 115 1.896 8.066 1.715 855 HA ILE 115 HA ILE 115 2.576 7.028 4.265 856 HB ILE 115 HB ILE 115 0.047 8.276 3.141 857 HG12 ILE 115 HG12 ILE 115 2.081 9.729 3.422 858 HG13 ILE 115 HG13 ILE 115 0.645 10.246 4.286 859 HG21 ILE 115 HG21 ILE 115 -0.813 6.921 4.926 860 HG22 ILE 115 HG22 ILE 115 0.496 7.404 6.019 861 HG23 ILE 115 HG23 ILE 115 -0.736 8.583 5.510 862 HD11 ILE 115 HD13 ILE 115 2.743 10.541 5.580 863 HD12 ILE 115 HD11 ILE 115 1.579 9.503 6.413 864 HD13 ILE 115 HD12 ILE 115 2.980 8.786 5.582 865 H GLN 116 H GLN 116 -0.028 5.969 1.960 866 HA GLN 116 HA GLN 116 -0.948 3.869 3.618 867 HB2 GLN 116 HB2 GLN 116 -1.023 4.253 0.597 868 HB3 GLN 116 HB3 GLN 116 -1.805 2.896 1.403 869 HG2 GLN 116 HG2 GLN 116 -2.417 5.834 1.950 870 HG3 GLN 116 HG3 GLN 116 -3.378 4.767 0.939 871 HE21 GLN 116 HE22 GLN 116 -3.526 6.185 3.863 872 HE22 GLN 116 HE21 GLN 116 -4.334 4.947 4.787 873 H ALA 117 H ALA 117 1.811 3.913 1.331 874 HA ALA 117 HA ALA 117 2.333 1.098 1.502 875 HB1 ALA 117 HB3 ALA 117 4.533 1.651 0.617 876 HB2 ALA 117 HB1 ALA 117 3.294 2.586 -0.248 877 HB3 ALA 117 HB2 ALA 117 4.305 3.366 0.980 878 H LEU 118 H LEU 118 3.812 3.898 3.351 879 HA LEU 118 HA LEU 118 5.269 1.981 4.944 880 HB2 LEU 118 HB2 LEU 118 6.147 3.780 6.248 881 HB3 LEU 118 HB3 LEU 118 6.363 3.970 4.522 882 HG LEU 118 HG LEU 118 4.611 5.712 4.465 883 HD11 LEU 118 HD11 LEU 118 3.173 5.171 6.371 884 HD12 LEU 118 HD12 LEU 118 4.532 5.389 7.494 885 HD13 LEU 118 HD13 LEU 118 3.861 6.762 6.583 886 HD21 LEU 118 HD23 LEU 118 5.959 7.419 5.572 887 HD22 LEU 118 HD21 LEU 118 6.750 6.192 6.566 888 HD23 LEU 118 HD22 LEU 118 7.023 6.234 4.810 889 H SER 119 H SER 119 2.021 3.215 5.405 890 HA SER 119 HA SER 119 1.789 2.612 8.151 891 HB2 SER 119 HB2 SER 119 -0.215 2.255 5.888 892 HB3 SER 119 HB3 SER 119 -0.603 2.164 7.617 893 HG SER 119 HG SER 119 -0.976 4.252 6.778 894 H GLU 120 H GLU 120 2.186 0.387 5.387 895 HA GLU 120 HA GLU 120 1.294 -1.983 6.737 896 HB2 GLU 120 HB2 GLU 120 3.356 -1.657 4.520 897 HB3 GLU 120 HB3 GLU 120 2.611 -3.170 4.996 898 HG2 GLU 120 HG2 GLU 120 1.081 -0.799 3.842 899 HG3 GLU 120 HG3 GLU 120 1.642 -2.187 2.930 900 H LEU 121 H LEU 121 3.988 0.034 7.353 901 HA LEU 121 HA LEU 121 5.443 -2.166 8.757 902 HB2 LEU 121 HB2 LEU 121 6.506 0.550 7.871 903 HB3 LEU 121 HB3 LEU 121 7.419 -0.725 8.654 904 HG LEU 121 HG LEU 121 6.241 -0.791 5.842 905 HD11 LEU 121 HD11 LEU 121 8.198 0.665 6.087 906 HD12 LEU 121 HD12 LEU 121 9.110 -0.646 6.866 907 HD13 LEU 121 HD13 LEU 121 8.627 -0.783 5.164 908 HD21 LEU 121 HD23 LEU 121 7.416 -2.904 5.491 909 HD22 LEU 121 HD21 LEU 121 7.979 -2.918 7.169 910 HD23 LEU 121 HD22 LEU 121 6.246 -3.092 6.797 911 H LEU 122 H LEU 122 4.511 1.338 8.976 912 HA LEU 122 HA LEU 122 5.403 1.458 11.687 913 HB2 LEU 122 HB2 LEU 122 3.547 3.420 10.294 914 HB3 LEU 122 HB3 LEU 122 4.452 3.674 11.782 915 HG LEU 122 HG LEU 122 5.507 3.537 8.953 916 HD11 LEU 122 HD11 LEU 122 4.715 5.695 9.973 917 HD12 LEU 122 HD12 LEU 122 5.992 5.533 11.198 918 HD13 LEU 122 HD13 LEU 122 6.419 5.708 9.483 919 HD21 LEU 122 HD23 LEU 122 7.796 3.776 9.914 920 HD22 LEU 122 HD21 LEU 122 7.166 3.285 11.499 921 HD23 LEU 122 HD22 LEU 122 7.116 2.159 10.117 922 H CYS 123 H CYS 123 2.347 0.414 10.373 923 HA CYS 123 HA CYS 123 1.052 0.707 13.038 924 HB2 CYS 123 HB2 CYS 123 -0.228 0.244 10.318 925 HB3 CYS 123 HB3 CYS 123 -1.055 0.556 11.846 926 HG CYS 123 HG CYS 123 -1.203 2.697 10.371 927 H GLU 124 H GLU 124 3.033 -1.459 12.090 928 HA GLU 124 HA GLU 124 1.345 -3.799 12.825 929 HB2 GLU 124 HB2 GLU 124 3.487 -3.597 10.669 930 HB3 GLU 124 HB3 GLU 124 2.958 -5.127 11.361 931 HG2 GLU 124 HG2 GLU 124 1.212 -3.138 9.849 932 HG3 GLU 124 HG3 GLU 124 1.841 -4.659 9.226 933 H GLU 125 H GLU 125 1.912 -3.870 14.936 934 HA GLU 125 HA GLU 125 4.321 -3.012 16.032 935 HB2 GLU 125 HB2 GLU 125 3.615 -4.143 18.071 936 HB3 GLU 125 HB3 GLU 125 2.283 -3.277 17.308 937 HG2 GLU 125 HG2 GLU 125 1.465 -5.455 16.343 938 HG3 GLU 125 HG3 GLU 125 2.755 -6.291 17.208 939 H GLU 126 H GLU 126 3.603 -6.142 14.578 940 HA GLU 126 HA GLU 126 5.843 -7.593 15.612 941 HB2 GLU 126 HB2 GLU 126 4.393 -7.886 12.939 942 HB3 GLU 126 HB3 GLU 126 5.487 -9.071 13.664 943 HG2 GLU 126 HG2 GLU 126 3.928 -9.223 15.639 944 HG3 GLU 126 HG3 GLU 126 2.795 -8.174 14.782 945 H ILE 127 H ILE 127 5.467 -5.324 12.874 946 HA ILE 127 HA ILE 127 8.179 -5.824 11.860 947 HB ILE 127 HB ILE 127 5.869 -4.026 11.082 948 HG12 ILE 127 HG12 ILE 127 6.289 -4.963 8.847 949 HG13 ILE 127 HG13 ILE 127 7.691 -5.852 9.444 950 HG21 ILE 127 HG21 ILE 127 7.651 -2.436 10.989 951 HG22 ILE 127 HG22 ILE 127 8.764 -3.621 10.265 952 HG23 ILE 127 HG23 ILE 127 7.389 -3.000 9.346 953 HD11 ILE 127 HD13 ILE 127 5.654 -7.249 9.103 954 HD12 ILE 127 HD11 ILE 127 6.249 -7.314 10.768 955 HD13 ILE 127 HD12 ILE 127 4.823 -6.320 10.365 956 H LEU 128 H LEU 128 6.429 -3.398 13.884 957 HA LEU 128 HA LEU 128 8.581 -1.592 14.144 958 HB2 LEU 128 HB2 LEU 128 6.469 -2.314 16.219 959 HB3 LEU 128 HB3 LEU 128 7.597 -0.979 16.362 960 HG LEU 128 HG LEU 128 5.408 -1.242 14.262 961 HD11 LEU 128 HD11 LEU 128 4.648 -0.644 16.532 962 HD12 LEU 128 HD12 LEU 128 5.830 0.678 16.590 963 HD13 LEU 128 HD13 LEU 128 4.486 0.728 15.428 964 HD21 LEU 128 HD23 LEU 128 6.119 1.164 13.730 965 HD22 LEU 128 HD21 LEU 128 7.639 0.805 14.571 966 HD23 LEU 128 HD22 LEU 128 7.175 -0.117 13.122 967 H GLU 129 H GLU 129 7.876 -4.527 16.138 968 HA GLU 129 HA GLU 129 10.099 -4.235 17.878 969 HB2 GLU 129 HB2 GLU 129 8.529 -6.635 16.877 970 HB3 GLU 129 HB3 GLU 129 9.985 -6.852 17.854 971 HG2 GLU 129 HG2 GLU 129 9.026 -5.380 19.619 972 HG3 GLU 129 HG3 GLU 129 7.531 -5.256 18.689 973 H GLN 130 H GLN 130 9.900 -5.951 14.701 974 HA GLN 130 HA GLN 130 12.610 -6.836 14.780 975 HB2 GLN 130 HB2 GLN 130 10.633 -6.475 12.494 976 HB3 GLN 130 HB3 GLN 130 12.227 -7.218 12.297 977 HG2 GLN 130 HG2 GLN 130 11.710 -9.013 13.810 978 HG3 GLN 130 HG3 GLN 130 10.201 -8.259 14.317 979 HE21 GLN 130 HE22 GLN 130 8.388 -8.277 12.921 980 HE22 GLN 130 HE21 GLN 130 8.275 -9.380 11.560 981 H LEU 131 H LEU 131 11.177 -3.805 13.546 982 HA LEU 131 HA LEU 131 13.611 -2.846 12.295 983 HB2 LEU 131 HB2 LEU 131 11.121 -1.460 13.365 984 HB3 LEU 131 HB3 LEU 131 12.465 -0.572 12.655 985 HG LEU 131 HG LEU 131 10.956 -2.735 11.149 986 HD11 LEU 131 HD11 LEU 131 9.432 -0.862 11.766 987 HD12 LEU 131 HD12 LEU 131 10.547 0.279 10.975 988 HD13 LEU 131 HD13 LEU 131 9.720 -0.966 10.022 989 HD21 LEU 131 HD23 LEU 131 11.928 -1.629 9.148 990 HD22 LEU 131 HD21 LEU 131 12.780 -0.480 10.195 991 HD23 LEU 131 HD22 LEU 131 13.203 -2.203 10.225 992 H LEU 132 H LEU 132 12.112 -2.410 15.553 993 HA LEU 132 HA LEU 132 14.116 -0.629 16.501 994 HB2 LEU 132 HB2 LEU 132 12.102 -2.431 17.879 995 HB3 LEU 132 HB3 LEU 132 13.223 -1.447 18.806 996 HG LEU 132 HG LEU 132 11.380 -0.218 16.716 997 HD11 LEU 132 HD11 LEU 132 10.001 -1.361 18.406 998 HD12 LEU 132 HD12 LEU 132 10.886 -0.539 19.709 999 HD13 LEU 132 HD13 LEU 132 9.883 0.396 18.576 1000 HD21 LEU 132 HD23 LEU 132 11.782 1.856 17.984 1001 HD22 LEU 132 HD21 LEU 132 12.846 0.984 19.108 1002 HD23 LEU 132 HD22 LEU 132 13.311 1.185 17.407 1003 H THR 133 H THR 133 13.978 -4.236 16.564 1004 HA THR 133 HA THR 133 16.428 -4.329 18.154 1005 HB THR 133 HB THR 133 16.147 -6.786 17.889 1006 HG1 THR 133 HG1 THR 133 14.359 -7.576 16.860 1007 HG21 THR 133 HG23 THR 133 14.135 -6.991 19.261 1008 HG22 THR 133 HG21 THR 133 15.086 -5.589 19.773 1009 HG23 THR 133 HG22 THR 133 13.614 -5.354 18.808 1010 H ALA 134 H ALA 134 16.004 -3.571 14.920 1011 HA ALA 134 HA ALA 134 17.515 -5.445 13.558 1012 HB1 ALA 134 HB3 ALA 134 17.816 -3.706 11.821 1013 HB2 ALA 134 HB1 ALA 134 16.146 -3.785 12.420 1014 HB3 ALA 134 HB2 ALA 134 17.238 -2.485 12.963 1015 H SER 135 H SER 135 19.574 -6.095 13.793 1016 HA SER 135 HA SER 135 21.477 -4.621 15.327 1017 HB2 SER 135 HB2 SER 135 21.911 -6.993 13.465 1018 HB3 SER 135 HB3 SER 135 22.967 -6.476 14.793 1019 HG SER 135 HG SER 135 21.593 -8.198 15.409 1020 H SER 136 H SER 136 20.697 -4.498 11.894 1021 HA SER 136 HA SER 136 23.020 -2.784 11.341 1022 HB2 SER 136 HB2 SER 136 23.716 -4.289 9.478 1023 HB3 SER 136 HB3 SER 136 23.881 -5.064 11.058 1024 HG SER 136 HG SER 136 22.888 -6.506 9.693 1025 H GLU 137 H GLU 137 22.929 -1.899 9.162 1026 HA GLU 137 HA GLU 137 20.399 -0.984 8.252 1027 HB2 GLU 137 HB2 GLU 137 23.090 -1.271 6.851 1028 HB3 GLU 137 HB3 GLU 137 21.702 -0.397 6.172 1029 HG2 GLU 137 HG2 GLU 137 21.705 1.181 8.001 1030 HG3 GLU 137 HG3 GLU 137 22.966 0.294 8.853 1031 H LYS 138 H LYS 138 22.234 -3.958 7.539 1032 HA LYS 138 HA LYS 138 20.765 -4.686 5.202 1033 HB2 LYS 138 HB2 LYS 138 22.983 -5.655 5.979 1034 HB3 LYS 138 HB3 LYS 138 22.114 -6.513 7.248 1035 HG2 LYS 138 HG2 LYS 138 22.553 -8.015 5.434 1036 HG3 LYS 138 HG3 LYS 138 20.808 -7.746 5.497 1037 HD2 LYS 138 HD2 LYS 138 20.929 -6.228 3.567 1038 HD3 LYS 138 HD3 LYS 138 22.702 -6.247 3.634 1039 HE2 LYS 138 HE2 LYS 138 22.153 -8.938 3.448 1040 HE3 LYS 138 HE3 LYS 138 20.779 -8.275 2.561 1041 HZ1 LYS 138 HZ3 LYS 138 22.647 -8.707 1.100 1042 HZ2 LYS 138 HZ1 LYS 138 22.391 -7.098 1.141 1043 HZ3 LYS 138 HZ2 LYS 138 23.639 -7.757 1.968 1044 H GLN 139 H GLN 139 20.250 -5.415 8.709 1045 HA GLN 139 HA GLN 139 17.952 -7.066 8.198 1046 HB2 GLN 139 HB2 GLN 139 19.349 -7.122 10.257 1047 HB3 GLN 139 HB3 GLN 139 18.699 -5.549 10.736 1048 HG2 GLN 139 HG2 GLN 139 16.421 -6.504 10.841 1049 HG3 GLN 139 HG3 GLN 139 17.013 -8.047 10.218 1050 HE21 GLN 139 HE22 GLN 139 15.631 -8.311 12.480 1051 HE22 GLN 139 HE21 GLN 139 16.667 -8.526 13.867 1052 H LEU 140 H LEU 140 18.368 -3.544 8.820 1053 HA LEU 140 HA LEU 140 15.569 -2.902 8.840 1054 HB2 LEU 140 HB2 LEU 140 18.014 -1.311 7.964 1055 HB3 LEU 140 HB3 LEU 140 16.401 -0.641 8.009 1056 HG LEU 140 HG LEU 140 17.980 -1.655 10.400 1057 HD11 LEU 140 HD11 LEU 140 18.740 0.516 9.432 1058 HD12 LEU 140 HD12 LEU 140 17.108 1.166 9.641 1059 HD13 LEU 140 HD13 LEU 140 18.048 0.698 11.050 1060 HD21 LEU 140 HD23 LEU 140 16.142 -0.651 11.774 1061 HD22 LEU 140 HD21 LEU 140 15.199 -0.413 10.293 1062 HD23 LEU 140 HD22 LEU 140 15.600 -2.048 10.845 1063 H ALA 141 H ALA 141 17.929 -3.112 6.124 1064 HA ALA 141 HA ALA 141 16.115 -2.373 4.094 1065 HB1 ALA 141 HB3 ALA 141 17.759 -3.343 2.556 1066 HB2 ALA 141 HB1 ALA 141 18.580 -2.413 3.824 1067 HB3 ALA 141 HB2 ALA 141 18.557 -4.190 3.895 1068 H ASP 142 H ASP 142 16.840 -5.636 5.454 1069 HA ASP 142 HA ASP 142 15.340 -7.163 3.625 1070 HB2 ASP 142 HB2 ASP 142 16.719 -8.224 5.321 1071 HB3 ASP 142 HB3 ASP 142 15.725 -7.554 6.617 1072 H ILE 143 H ILE 143 14.217 -5.379 6.527 1073 HA ILE 143 HA ILE 143 11.517 -6.315 6.360 1074 HB ILE 143 HB ILE 143 12.783 -3.918 7.735 1075 HG12 ILE 143 HG12 ILE 143 11.767 -6.524 8.964 1076 HG13 ILE 143 HG13 ILE 143 13.419 -6.364 8.395 1077 HG21 ILE 143 HG21 ILE 143 10.403 -3.427 7.453 1078 HG22 ILE 143 HG22 ILE 143 9.962 -5.040 8.059 1079 HG23 ILE 143 HG23 ILE 143 10.719 -3.843 9.129 1080 HD11 ILE 143 HD13 ILE 143 13.437 -5.969 10.735 1081 HD12 ILE 143 HD11 ILE 143 13.776 -4.436 9.927 1082 HD13 ILE 143 HD12 ILE 143 12.162 -4.743 10.623 1083 H ILE 144 H ILE 144 13.218 -3.547 4.824 1084 HA ILE 144 HA ILE 144 10.806 -2.410 3.690 1085 HB ILE 144 HB ILE 144 13.724 -2.199 2.842 1086 HG12 ILE 144 HG12 ILE 144 13.495 -1.153 4.969 1087 HG13 ILE 144 HG13 ILE 144 13.529 0.127 3.774 1088 HG21 ILE 144 HG21 ILE 144 12.331 -1.740 0.895 1089 HG22 ILE 144 HG22 ILE 144 11.369 -0.573 1.823 1090 HG23 ILE 144 HG23 ILE 144 13.082 -0.261 1.491 1091 HD11 ILE 144 HD13 ILE 144 11.850 0.731 5.353 1092 HD12 ILE 144 HD11 ILE 144 10.950 0.170 3.940 1093 HD13 ILE 144 HD12 ILE 144 11.142 -0.890 5.355 1094 H SER 145 H SER 145 13.285 -4.743 2.380 1095 HA SER 145 HA SER 145 12.008 -5.174 -0.071 1096 HB2 SER 145 HB2 SER 145 13.618 -7.152 1.590 1097 HB3 SER 145 HB3 SER 145 13.308 -7.254 -0.152 1098 HG SER 145 HG SER 145 15.347 -6.316 0.315 1099 H ARG 146 H ARG 146 11.245 -6.564 3.099 1100 HA ARG 146 HA ARG 146 9.542 -8.654 2.223 1101 HB2 ARG 146 HB2 ARG 146 10.621 -8.092 4.535 1102 HB3 ARG 146 HB3 ARG 146 9.184 -7.105 4.813 1103 HG2 ARG 146 HG2 ARG 146 7.773 -9.155 4.448 1104 HG3 ARG 146 HG3 ARG 146 9.252 -10.103 4.220 1105 HD2 ARG 146 HD2 ARG 146 8.415 -8.590 6.728 1106 HD3 ARG 146 HD3 ARG 146 8.387 -10.347 6.498 1107 HE ARG 146 HE ARG 146 11.036 -9.387 6.030 1108 HH11 ARG 146 HH11 ARG 146 8.780 -9.974 8.706 1109 HH12 ARG 146 HH12 ARG 146 10.038 -10.021 9.913 1110 HH21 ARG 146 HH21 ARG 146 12.677 -9.492 7.614 1111 HH22 ARG 146 HH22 ARG 146 12.261 -9.787 9.282 1112 H GLY 147 H GLY 147 8.991 -5.196 2.233 1113 HA2 GLY 147 HA2 GLY 147 6.065 -5.358 2.442 1114 HA3 GLY 147 HA3 GLY 147 7.072 -3.923 2.197 Start of MODEL 2 1 H MET 1 H1 MET 1 1.891 -1.195 -0.419 2 HA MET 1 HA MET 1 2.212 -1.430 -3.359 3 HB2 MET 1 HB2 MET 1 1.972 1.036 -2.229 4 HB3 MET 1 HB3 MET 1 3.687 0.741 -1.871 5 HG2 MET 1 HG2 MET 1 3.320 1.978 -3.970 6 HG3 MET 1 HG3 MET 1 4.201 0.476 -4.210 7 HE1 MET 1 HE3 MET 1 3.847 0.711 -6.813 8 HE2 MET 1 HE1 MET 1 2.264 0.961 -7.581 9 HE3 MET 1 HE2 MET 1 2.958 2.229 -6.547 10 H ARG 2 H ARG 2 4.421 -1.666 -4.097 11 HA ARG 2 HA ARG 2 5.982 -3.334 -2.293 12 HB2 ARG 2 HB2 ARG 2 6.598 -2.164 -5.027 13 HB3 ARG 2 HB3 ARG 2 7.716 -3.189 -4.105 14 HG2 ARG 2 HG2 ARG 2 4.948 -3.941 -5.076 15 HG3 ARG 2 HG3 ARG 2 6.501 -4.540 -5.707 16 HD2 ARG 2 HD2 ARG 2 6.870 -5.490 -3.337 17 HD3 ARG 2 HD3 ARG 2 5.150 -5.111 -3.053 18 HE ARG 2 HE ARG 2 5.380 -6.600 -5.457 19 HH11 ARG 2 HH11 ARG 2 5.692 -7.072 -1.927 20 HH12 ARG 2 HH12 ARG 2 5.303 -8.759 -2.005 21 HH21 ARG 2 HH21 ARG 2 4.855 -8.835 -5.524 22 HH22 ARG 2 HH22 ARG 2 4.811 -9.773 -4.081 23 H LEU 3 H LEU 3 6.947 -2.534 -0.689 24 HA LEU 3 HA LEU 3 7.088 0.245 -0.079 25 HB2 LEU 3 HB2 LEU 3 8.217 -2.276 1.122 26 HB3 LEU 3 HB3 LEU 3 8.962 -0.765 1.604 27 HG LEU 3 HG LEU 3 7.202 -1.584 3.135 28 HD11 LEU 3 HD11 LEU 3 6.689 1.161 1.893 29 HD12 LEU 3 HD12 LEU 3 6.203 0.616 3.504 30 HD13 LEU 3 HD13 LEU 3 7.916 0.766 3.119 31 HD21 LEU 3 HD23 LEU 3 4.861 -1.342 2.658 32 HD22 LEU 3 HD21 LEU 3 5.187 -0.741 1.027 33 HD23 LEU 3 HD22 LEU 3 5.565 -2.416 1.446 34 H SER 4 H SER 4 9.626 -2.031 -1.206 35 HA SER 4 HA SER 4 11.806 -0.429 -1.008 36 HB2 SER 4 HB2 SER 4 11.447 -2.236 -3.405 37 HB3 SER 4 HB3 SER 4 12.866 -2.036 -2.358 38 HG SER 4 HG SER 4 11.658 -4.012 -2.073 39 H ASP 5 H ASP 5 9.191 0.015 -3.346 40 HA ASP 5 HA ASP 5 10.607 1.375 -5.402 41 HB2 ASP 5 HB2 ASP 5 8.277 0.552 -5.606 42 HB3 ASP 5 HB3 ASP 5 7.751 1.757 -4.425 43 H TYR 6 H TYR 6 9.574 2.361 -2.186 44 HA TYR 6 HA TYR 6 9.963 5.220 -2.755 45 HB2 TYR 6 HB2 TYR 6 9.006 3.747 -0.269 46 HB3 TYR 6 HB3 TYR 6 9.127 5.491 -0.432 47 HD1 TYR 6 HD2 TYR 6 7.671 6.785 -1.894 48 HD2 TYR 6 HD1 TYR 6 7.097 2.522 -1.366 49 HE1 TYR 6 HE2 TYR 6 5.492 6.927 -3.061 50 HE2 TYR 6 HE1 TYR 6 4.910 2.690 -2.460 51 HH TYR 6 HH TYR 6 3.623 5.756 -3.818 52 H PHE 7 H PHE 7 12.043 2.650 -1.701 53 HA PHE 7 HA PHE 7 13.690 4.557 -0.070 54 HB2 PHE 7 HB2 PHE 7 13.468 1.550 0.136 55 HB3 PHE 7 HB3 PHE 7 14.634 2.531 1.004 56 HD1 PHE 7 HD1 PHE 7 10.995 2.001 0.510 57 HD2 PHE 7 HD2 PHE 7 14.025 3.397 3.245 58 HE1 PHE 7 HE1 PHE 7 9.254 2.466 2.192 59 HE2 PHE 7 HE2 PHE 7 12.250 3.994 4.856 60 HZ PHE 7 HZ PHE 7 9.880 3.501 4.369 61 HA PRO 8 HA PRO 8 15.474 3.980 -4.228 62 HB2 PRO 8 HB2 PRO 8 17.383 6.069 -4.035 63 HB3 PRO 8 HB3 PRO 8 15.752 6.116 -4.760 64 HG2 PRO 8 HG2 PRO 8 16.607 6.931 -1.988 65 HG3 PRO 8 HG3 PRO 8 15.406 7.719 -3.040 66 HD2 PRO 8 HD2 PRO 8 14.602 6.152 -1.029 67 HD3 PRO 8 HD3 PRO 8 13.782 6.057 -2.615 68 H GLU 9 H GLU 9 17.900 4.684 -1.670 69 HA GLU 9 HA GLU 9 19.178 2.129 -2.046 70 HB2 GLU 9 HB2 GLU 9 19.941 3.402 -4.122 71 HB3 GLU 9 HB3 GLU 9 20.632 4.604 -3.057 72 HG2 GLU 9 HG2 GLU 9 22.427 3.175 -3.731 73 HG3 GLU 9 HG3 GLU 9 22.077 2.735 -2.062 74 H SER 10 H SER 10 20.735 5.204 -1.237 75 HA SER 10 HA SER 10 21.837 4.262 1.177 76 HB2 SER 10 HB2 SER 10 21.338 7.183 0.549 77 HB3 SER 10 HB3 SER 10 22.758 6.448 1.304 78 HG SER 10 HG SER 10 23.345 5.622 -0.714 79 H SER 11 H SER 11 18.793 4.213 0.888 80 HA SER 11 HA SER 11 17.598 6.281 2.511 81 HB2 SER 11 HB2 SER 11 16.463 3.711 1.366 82 HB3 SER 11 HB3 SER 11 15.568 5.198 1.749 83 HG SER 11 HG SER 11 16.731 6.241 0.105 84 H ILE 12 H ILE 12 19.436 3.833 3.640 85 HA ILE 12 HA ILE 12 17.678 3.105 5.883 86 HB ILE 12 HB ILE 12 19.704 1.380 4.391 87 HG12 ILE 12 HG12 ILE 12 17.986 1.839 2.684 88 HG13 ILE 12 HG13 ILE 12 18.138 0.173 3.138 89 HG21 ILE 12 HG21 ILE 12 19.106 0.805 6.704 90 HG22 ILE 12 HG22 ILE 12 17.394 0.765 6.268 91 HG23 ILE 12 HG23 ILE 12 18.531 -0.434 5.588 92 HD11 ILE 12 HD13 ILE 12 16.074 0.226 4.412 93 HD12 ILE 12 HD11 ILE 12 15.916 1.981 4.151 94 HD13 ILE 12 HD12 ILE 12 15.802 0.858 2.781 95 H SER 13 H SER 13 18.841 3.460 7.836 96 HA SER 13 HA SER 13 21.770 3.187 7.836 97 HB2 SER 13 HB2 SER 13 20.336 5.790 8.555 98 HB3 SER 13 HB3 SER 13 22.025 5.433 8.954 99 HG SER 13 HG SER 13 21.415 4.976 6.329 100 H VAL 14 H VAL 14 22.596 2.769 9.837 101 HA VAL 14 HA VAL 14 20.811 2.822 12.201 102 HB VAL 14 HB VAL 14 22.779 0.636 11.418 103 HG11 VAL 14 HG11 VAL 14 23.069 1.100 13.822 104 HG12 VAL 14 HG12 VAL 14 21.309 1.043 14.071 105 HG13 VAL 14 HG13 VAL 14 22.204 -0.422 13.612 106 HG21 VAL 14 HG23 VAL 14 20.806 -0.857 11.706 107 HG22 VAL 14 HG21 VAL 14 19.803 0.550 12.083 108 HG23 VAL 14 HG22 VAL 14 20.507 0.369 10.464 109 H ILE 15 H ILE 15 21.790 3.837 13.871 110 HA ILE 15 HA ILE 15 24.542 4.925 13.555 111 HB ILE 15 HB ILE 15 21.883 6.360 14.002 112 HG12 ILE 15 HG12 ILE 15 23.787 6.532 11.656 113 HG13 ILE 15 HG13 ILE 15 22.110 5.961 11.670 114 HG21 ILE 15 HG21 ILE 15 23.702 7.293 15.401 115 HG22 ILE 15 HG22 ILE 15 24.661 7.620 13.942 116 HG23 ILE 15 HG23 ILE 15 23.108 8.444 14.272 117 HD11 ILE 15 HD13 ILE 15 23.081 8.819 12.107 118 HD12 ILE 15 HD11 ILE 15 22.049 8.199 10.799 119 HD13 ILE 15 HD12 ILE 15 21.434 8.299 12.471 120 H HIS 16 H HIS 16 25.484 5.323 15.695 121 HA HIS 16 HA HIS 16 24.326 3.784 17.823 122 HB2 HIS 16 HB2 HIS 16 26.788 4.324 17.499 123 HB3 HIS 16 HB3 HIS 16 26.444 5.943 18.122 124 HD1 HIS 16 HD1 HIS 16 25.674 2.298 19.316 125 HD2 HIS 16 HD2 HIS 16 26.900 6.092 20.702 126 HE1 HIS 16 HE1 HIS 16 26.093 2.056 21.826 127 H SER 17 H SER 17 24.283 7.313 17.034 128 HA SER 17 HA SER 17 21.938 7.790 18.588 129 HB2 SER 17 HB2 SER 17 23.551 9.649 19.879 130 HB3 SER 17 HB3 SER 17 22.844 8.218 20.594 131 HG SER 17 HG SER 17 25.461 8.473 19.520 132 H ALA 18 H ALA 18 21.148 9.897 18.081 133 HA ALA 18 HA ALA 18 22.442 11.213 15.769 134 HB1 ALA 18 HB3 ALA 18 19.957 11.060 15.830 135 HB2 ALA 18 HB1 ALA 18 19.953 11.955 17.369 136 HB3 ALA 18 HB2 ALA 18 20.516 12.738 15.882 137 H LYS 19 H LYS 19 23.198 13.429 15.992 138 HA LYS 19 HA LYS 19 24.681 13.962 18.347 139 HB2 LYS 19 HB2 LYS 19 24.913 14.854 15.889 140 HB3 LYS 19 HB3 LYS 19 23.745 16.060 16.373 141 HG2 LYS 19 HG2 LYS 19 25.889 17.062 16.615 142 HG3 LYS 19 HG3 LYS 19 25.238 16.802 18.229 143 HD2 LYS 19 HD2 LYS 19 27.627 16.291 18.133 144 HD3 LYS 19 HD3 LYS 19 26.710 14.837 18.534 145 HE2 LYS 19 HE2 LYS 19 26.858 14.081 16.173 146 HE3 LYS 19 HE3 LYS 19 27.707 15.567 15.739 147 HZ1 LYS 19 HZ3 LYS 19 29.522 14.880 17.200 148 HZ2 LYS 19 HZ1 LYS 19 28.737 13.504 17.606 149 HZ3 LYS 19 HZ2 LYS 19 29.244 13.737 16.076 150 H ASP 20 H ASP 20 21.494 15.071 17.272 151 HA ASP 20 HA ASP 20 20.407 15.240 19.872 152 HB2 ASP 20 HB2 ASP 20 19.878 17.486 20.085 153 HB3 ASP 20 HB3 ASP 20 21.606 17.542 19.715 154 H TRP 21 H TRP 21 18.031 16.430 19.409 155 HA TRP 21 HA TRP 21 16.801 14.871 17.459 156 HB2 TRP 21 HB2 TRP 21 14.794 16.195 17.936 157 HB3 TRP 21 HB3 TRP 21 15.605 15.611 19.380 158 HD1 TRP 21 HD1 TRP 21 16.562 17.418 21.053 159 HE1 TRP 21 HE1 TRP 21 16.376 19.950 21.257 160 HE3 TRP 21 HE3 TRP 21 14.405 18.422 16.513 161 HZ2 TRP 21 HZ2 TRP 21 15.507 22.176 19.602 162 HZ3 TRP 21 HZ3 TRP 21 13.910 20.766 15.857 163 HH2 TRP 21 HH2 TRP 21 14.516 22.640 17.371 164 H GLN 22 H GLN 22 18.088 18.232 17.102 165 HA GLN 22 HA GLN 22 16.851 18.838 14.551 166 HB2 GLN 22 HB2 GLN 22 19.524 19.695 15.680 167 HB3 GLN 22 HB3 GLN 22 18.763 20.338 14.238 168 HG2 GLN 22 HG2 GLN 22 16.934 21.283 15.460 169 HG3 GLN 22 HG3 GLN 22 17.346 20.390 16.926 170 HE21 GLN 22 HE22 GLN 22 19.466 20.819 17.928 171 HE22 GLN 22 HE21 GLN 22 20.060 22.487 17.938 172 H GLU 23 H GLU 23 20.048 17.318 15.466 173 HA GLU 23 HA GLU 23 20.767 16.594 12.830 174 HB2 GLU 23 HB2 GLU 23 22.169 16.550 15.003 175 HB3 GLU 23 HB3 GLU 23 21.413 14.972 15.307 176 HG2 GLU 23 HG2 GLU 23 23.356 14.309 14.255 177 HG3 GLU 23 HG3 GLU 23 22.292 14.384 12.883 178 H ALA 24 H ALA 24 18.712 14.912 15.191 179 HA ALA 24 HA ALA 24 18.607 12.430 13.806 180 HB1 ALA 24 HB3 ALA 24 16.494 13.633 15.629 181 HB2 ALA 24 HB1 ALA 24 16.786 11.911 15.302 182 HB3 ALA 24 HB2 ALA 24 17.997 12.879 16.179 183 H ILE 25 H ILE 25 16.737 15.455 13.383 184 HA ILE 25 HA ILE 25 14.896 14.326 11.449 185 HB ILE 25 HB ILE 25 15.844 17.204 11.620 186 HG12 ILE 25 HG12 ILE 25 14.403 15.814 13.665 187 HG13 ILE 25 HG13 ILE 25 14.866 17.505 13.564 188 HG21 ILE 25 HG21 ILE 25 14.682 16.545 9.535 189 HG22 ILE 25 HG22 ILE 25 13.283 16.023 10.470 190 HG23 ILE 25 HG23 ILE 25 13.787 17.736 10.444 191 HD11 ILE 25 HD13 ILE 25 12.285 16.259 12.583 192 HD12 ILE 25 HD11 ILE 25 12.506 17.269 14.024 193 HD13 ILE 25 HD12 ILE 25 12.708 17.989 12.420 194 H ASP 26 H ASP 26 18.058 16.085 11.232 195 HA ASP 26 HA ASP 26 18.261 16.031 8.411 196 HB2 ASP 26 HB2 ASP 26 19.777 17.358 9.780 197 HB3 ASP 26 HB3 ASP 26 20.490 15.900 10.471 198 H PHE 27 H PHE 27 19.382 13.590 10.808 199 HA PHE 27 HA PHE 27 20.190 11.702 8.821 200 HB2 PHE 27 HB2 PHE 27 19.656 11.549 11.803 201 HB3 PHE 27 HB3 PHE 27 19.972 10.103 10.868 202 HD1 PHE 27 HD2 PHE 27 22.048 10.530 9.053 203 HD2 PHE 27 HD1 PHE 27 21.681 12.180 13.051 204 HE1 PHE 27 HE2 PHE 27 24.505 10.703 9.223 205 HE2 PHE 27 HE1 PHE 27 24.132 12.280 13.206 206 HZ PHE 27 HZ PHE 27 25.557 11.569 11.304 207 H SER 28 H SER 28 16.946 12.563 9.889 208 HA SER 28 HA SER 28 15.805 10.034 8.901 209 HB2 SER 28 HB2 SER 28 14.407 12.687 9.555 210 HB3 SER 28 HB3 SER 28 13.629 11.157 9.210 211 HG SER 28 HG SER 28 15.455 11.672 11.346 212 H MET 29 H MET 29 16.910 13.078 7.510 213 HA MET 29 HA MET 29 15.275 12.532 5.066 214 HB2 MET 29 HB2 MET 29 16.446 15.129 6.031 215 HB3 MET 29 HB3 MET 29 15.206 14.872 4.790 216 HG2 MET 29 HG2 MET 29 14.508 14.124 7.605 217 HG3 MET 29 HG3 MET 29 14.663 15.818 7.185 218 HE1 MET 29 HE3 MET 29 13.137 12.571 5.507 219 HE2 MET 29 HE1 MET 29 12.565 12.746 7.193 220 HE3 MET 29 HE2 MET 29 11.414 12.939 5.849 221 H VAL 30 H VAL 30 18.648 12.945 6.102 222 HA VAL 30 HA VAL 30 19.607 14.242 3.883 223 HB VAL 30 HB VAL 30 20.905 13.906 5.904 224 HG11 VAL 30 HG11 VAL 30 21.392 11.032 4.996 225 HG12 VAL 30 HG12 VAL 30 22.114 11.844 6.398 226 HG13 VAL 30 HG13 VAL 30 20.377 11.509 6.376 227 HG21 VAL 30 HG23 VAL 30 22.025 14.521 3.774 228 HG22 VAL 30 HG21 VAL 30 23.094 13.622 4.869 229 HG23 VAL 30 HG22 VAL 30 22.368 12.814 3.460 230 H SER 31 H SER 31 19.037 10.686 4.125 231 HA SER 31 HA SER 31 20.309 10.013 1.731 232 HB2 SER 31 HB2 SER 31 17.764 8.758 2.844 233 HB3 SER 31 HB3 SER 31 19.019 7.977 1.867 234 HG SER 31 HG SER 31 19.905 7.496 3.673 235 H LEU 32 H LEU 32 17.309 11.741 2.192 236 HA LEU 32 HA LEU 32 16.445 11.330 -0.616 237 HB2 LEU 32 HB2 LEU 32 15.226 12.737 1.806 238 HB3 LEU 32 HB3 LEU 32 14.517 12.841 0.217 239 HG LEU 32 HG LEU 32 15.027 10.197 1.652 240 HD11 LEU 32 HD11 LEU 32 13.449 11.564 2.930 241 HD12 LEU 32 HD12 LEU 32 12.461 11.820 1.478 242 HD13 LEU 32 HD13 LEU 32 12.630 10.197 2.175 243 HD21 LEU 32 HD23 LEU 32 13.249 10.821 -0.750 244 HD22 LEU 32 HD21 LEU 32 14.828 10.002 -0.846 245 HD23 LEU 32 HD22 LEU 32 13.517 9.239 0.007 246 H LEU 33 H LEU 33 17.667 13.852 1.641 247 HA LEU 33 HA LEU 33 17.629 16.031 -0.080 248 HB2 LEU 33 HB2 LEU 33 18.210 16.042 2.354 249 HB3 LEU 33 HB3 LEU 33 19.764 15.316 1.955 250 HG LEU 33 HG LEU 33 20.400 17.333 0.664 251 HD11 LEU 33 HD11 LEU 33 17.744 18.485 1.606 252 HD12 LEU 33 HD12 LEU 33 19.058 19.382 0.816 253 HD13 LEU 33 HD13 LEU 33 18.207 18.138 -0.074 254 HD21 LEU 33 HD23 LEU 33 19.487 17.947 3.490 255 HD22 LEU 33 HD21 LEU 33 20.951 17.049 3.054 256 HD23 LEU 33 HD22 LEU 33 20.797 18.735 2.579 257 H ASP 34 H ASP 34 20.062 13.479 0.318 258 HA ASP 34 HA ASP 34 22.096 14.563 -1.253 259 HB2 ASP 34 HB2 ASP 34 22.516 12.869 0.433 260 HB3 ASP 34 HB3 ASP 34 21.404 11.737 -0.326 261 H LYS 35 H LYS 35 19.312 12.798 -2.349 262 HA LYS 35 HA LYS 35 20.496 12.882 -5.110 263 HB2 LYS 35 HB2 LYS 35 18.167 11.128 -4.385 264 HB3 LYS 35 HB3 LYS 35 19.065 11.190 -5.882 265 HG2 LYS 35 HG2 LYS 35 19.846 9.252 -4.946 266 HG3 LYS 35 HG3 LYS 35 21.117 10.404 -4.493 267 HD2 LYS 35 HD2 LYS 35 20.223 10.552 -2.225 268 HD3 LYS 35 HD3 LYS 35 18.744 9.717 -2.705 269 HE2 LYS 35 HE2 LYS 35 20.121 8.289 -1.391 270 HE3 LYS 35 HE3 LYS 35 19.959 7.643 -3.028 271 HZ1 LYS 35 HZ3 LYS 35 22.271 7.614 -2.016 272 HZ2 LYS 35 HZ1 LYS 35 22.187 8.299 -3.506 273 HZ3 LYS 35 HZ2 LYS 35 22.315 9.251 -2.181 274 H ASN 36 H ASN 36 19.154 15.003 -3.429 275 HA ASN 36 HA ASN 36 17.694 16.663 -3.650 276 HB2 ASN 36 HB2 ASN 36 17.737 16.177 -6.630 277 HB3 ASN 36 HB3 ASN 36 17.244 17.646 -5.802 278 HD21 ASN 36 HD22 ASN 36 19.938 15.595 -6.607 279 HD22 ASN 36 HD21 ASN 36 21.221 16.740 -6.254 280 H TYR 37 H TYR 37 16.376 14.108 -3.037 281 HA TYR 37 HA TYR 37 13.800 14.164 -4.452 282 HB2 TYR 37 HB2 TYR 37 14.782 12.857 -1.904 283 HB3 TYR 37 HB3 TYR 37 13.082 12.894 -2.303 284 HD1 TYR 37 HD2 TYR 37 16.364 11.383 -3.184 285 HD2 TYR 37 HD1 TYR 37 12.125 11.486 -3.985 286 HE1 TYR 37 HE2 TYR 37 16.609 9.463 -4.724 287 HE2 TYR 37 HE1 TYR 37 12.373 9.565 -5.534 288 HH TYR 37 HH TYR 37 15.545 8.052 -6.247 289 H ILE 38 H ILE 38 15.377 16.012 -2.004 290 HA ILE 38 HA ILE 38 13.018 17.717 -1.607 291 HB ILE 38 HB ILE 38 13.482 17.799 0.839 292 HG12 ILE 38 HG12 ILE 38 15.344 15.452 0.296 293 HG13 ILE 38 HG13 ILE 38 15.846 17.086 0.751 294 HG21 ILE 38 HG21 ILE 38 12.375 15.734 1.467 295 HG22 ILE 38 HG22 ILE 38 11.696 16.315 -0.042 296 HG23 ILE 38 HG23 ILE 38 12.849 14.960 -0.051 297 HD11 ILE 38 HD13 ILE 38 14.729 16.817 2.934 298 HD12 ILE 38 HD11 ILE 38 14.329 15.129 2.498 299 HD13 ILE 38 HD12 ILE 38 16.019 15.633 2.613 300 H SER 39 H SER 39 13.803 19.691 -0.335 301 HA SER 39 HA SER 39 16.522 20.583 -1.177 302 HB2 SER 39 HB2 SER 39 14.147 22.329 -0.429 303 HB3 SER 39 HB3 SER 39 15.605 22.786 -1.323 304 HG SER 39 HG SER 39 13.477 21.089 -2.168 305 H GLU 40 H GLU 40 17.597 22.010 0.505 306 HA GLU 40 HA GLU 40 17.639 20.733 3.012 307 HB2 GLU 40 HB2 GLU 40 18.644 23.499 2.240 308 HB3 GLU 40 HB3 GLU 40 19.069 22.632 3.724 309 HG2 GLU 40 HG2 GLU 40 20.047 20.786 2.358 310 HG3 GLU 40 HG3 GLU 40 19.680 21.677 0.890 311 H ASN 41 H ASN 41 15.732 23.551 2.013 312 HA ASN 41 HA ASN 41 14.869 24.441 4.564 313 HB2 ASN 41 HB2 ASN 41 14.404 25.649 2.445 314 HB3 ASN 41 HB3 ASN 41 13.309 24.357 1.935 315 HD21 ASN 41 HD22 ASN 41 11.175 24.223 2.913 316 HD22 ASN 41 HD21 ASN 41 10.590 25.500 3.956 317 H TYR 42 H TYR 42 13.867 21.574 2.699 318 HA TYR 42 HA TYR 42 11.349 21.140 3.948 319 HB2 TYR 42 HB2 TYR 42 12.209 20.095 1.834 320 HB3 TYR 42 HB3 TYR 42 13.328 19.136 2.798 321 HD1 TYR 42 HD1 TYR 42 9.745 19.725 2.041 322 HD2 TYR 42 HD2 TYR 42 12.625 17.156 3.966 323 HE1 TYR 42 HE1 TYR 42 8.035 17.918 2.207 324 HE2 TYR 42 HE2 TYR 42 10.938 15.355 4.115 325 HH TYR 42 HH TYR 42 8.801 14.664 3.556 326 H ILE 43 H ILE 43 14.659 19.996 4.741 327 HA ILE 43 HA ILE 43 13.972 18.449 7.034 328 HB ILE 43 HB ILE 43 16.539 19.969 6.330 329 HG12 ILE 43 HG12 ILE 43 17.119 17.310 6.018 330 HG13 ILE 43 HG13 ILE 43 15.419 17.309 5.534 331 HG21 ILE 43 HG21 ILE 43 16.411 19.421 8.757 332 HG22 ILE 43 HG22 ILE 43 16.162 17.710 8.342 333 HG23 ILE 43 HG23 ILE 43 17.683 18.523 7.923 334 HD11 ILE 43 HD13 ILE 43 17.616 19.064 4.386 335 HD12 ILE 43 HD11 ILE 43 16.984 17.582 3.653 336 HD13 ILE 43 HD12 ILE 43 15.929 19.000 3.805 337 H GLN 44 H GLN 44 14.933 21.932 6.692 338 HA GLN 44 HA GLN 44 14.718 22.317 9.504 339 HB2 GLN 44 HB2 GLN 44 16.075 23.682 7.732 340 HB3 GLN 44 HB3 GLN 44 14.595 24.617 7.552 341 HG2 GLN 44 HG2 GLN 44 16.083 25.695 9.183 342 HG3 GLN 44 HG3 GLN 44 14.648 25.117 10.016 343 HE21 GLN 44 HE22 GLN 44 15.255 24.341 12.076 344 HE22 GLN 44 HE21 GLN 44 16.604 23.272 12.366 345 H ALA 45 H ALA 45 12.260 22.505 6.982 346 HA ALA 45 HA ALA 45 10.296 23.929 8.432 347 HB1 ALA 45 HB3 ALA 45 10.082 23.297 6.028 348 HB2 ALA 45 HB1 ALA 45 9.859 21.593 6.506 349 HB3 ALA 45 HB2 ALA 45 8.667 22.801 6.983 350 H ILE 46 H ILE 46 11.198 20.428 8.515 351 HA ILE 46 HA ILE 46 9.064 19.733 10.335 352 HB ILE 46 HB ILE 46 11.716 18.312 9.896 353 HG12 ILE 46 HG12 ILE 46 9.086 17.738 8.488 354 HG13 ILE 46 HG13 ILE 46 10.399 18.637 7.748 355 HG21 ILE 46 HG21 ILE 46 10.557 16.359 10.811 356 HG22 ILE 46 HG22 ILE 46 10.373 17.678 11.950 357 HG23 ILE 46 HG23 ILE 46 9.021 17.250 10.886 358 HD11 ILE 46 HD13 ILE 46 10.600 15.740 8.634 359 HD12 ILE 46 HD11 ILE 46 10.501 16.349 6.982 360 HD13 ILE 46 HD12 ILE 46 11.920 16.724 7.985 361 H LYS 47 H LYS 47 12.574 20.581 10.717 362 HA LYS 47 HA LYS 47 12.605 20.214 13.523 363 HB2 LYS 47 HB2 LYS 47 14.152 22.121 11.734 364 HB3 LYS 47 HB3 LYS 47 14.541 21.889 13.439 365 HG2 LYS 47 HG2 LYS 47 15.254 19.633 13.091 366 HG3 LYS 47 HG3 LYS 47 14.604 19.591 11.436 367 HD2 LYS 47 HD2 LYS 47 16.160 21.294 10.722 368 HD3 LYS 47 HD3 LYS 47 16.799 21.465 12.380 369 HE2 LYS 47 HE2 LYS 47 17.795 19.299 12.270 370 HE3 LYS 47 HE3 LYS 47 17.086 18.965 10.689 371 HZ1 LYS 47 HZ3 LYS 47 18.428 20.861 9.829 372 HZ2 LYS 47 HZ1 LYS 47 19.088 21.091 11.296 373 HZ3 LYS 47 HZ2 LYS 47 19.390 19.714 10.486 374 H ASP 48 H ASP 48 11.762 23.150 11.583 375 HA ASP 48 HA ASP 48 11.296 24.882 13.778 376 HB2 ASP 48 HB2 ASP 48 11.574 25.699 11.505 377 HB3 ASP 48 HB3 ASP 48 10.129 24.833 10.973 378 H SER 49 H SER 49 9.116 22.591 12.072 379 HA SER 49 HA SER 49 6.753 23.234 13.558 380 HB2 SER 49 HB2 SER 49 7.571 20.578 12.301 381 HB3 SER 49 HB3 SER 49 5.937 21.098 12.725 382 HG SER 49 HG SER 49 7.649 22.192 10.740 383 H THR 50 H THR 50 9.505 21.063 14.186 384 HA THR 50 HA THR 50 8.465 19.898 16.568 385 HB THR 50 HB THR 50 11.369 20.206 15.717 386 HG1 THR 50 HG1 THR 50 10.127 19.235 14.069 387 HG21 THR 50 HG23 THR 50 10.033 18.026 17.351 388 HG22 THR 50 HG21 THR 50 11.763 18.195 16.954 389 HG23 THR 50 HG22 THR 50 10.998 19.357 18.042 390 H ILE 51 H ILE 51 10.435 22.865 15.987 391 HA ILE 51 HA ILE 51 10.719 23.571 18.752 392 HB ILE 51 HB ILE 51 10.724 25.192 16.174 393 HG12 ILE 51 HG12 ILE 51 12.981 24.449 18.083 394 HG13 ILE 51 HG13 ILE 51 12.570 23.531 16.641 395 HG21 ILE 51 HG21 ILE 51 11.652 27.099 17.449 396 HG22 ILE 51 HG22 ILE 51 10.010 26.737 17.939 397 HG23 ILE 51 HG23 ILE 51 11.367 26.219 18.968 398 HD11 ILE 51 HD13 ILE 51 13.631 26.374 16.698 399 HD12 ILE 51 HD11 ILE 51 14.434 24.917 16.101 400 HD13 ILE 51 HD12 ILE 51 13.025 25.556 15.236 401 H ASN 52 H ASN 52 8.153 24.208 16.332 402 HA ASN 52 HA ASN 52 6.722 26.140 17.822 403 HB2 ASN 52 HB2 ASN 52 6.100 24.316 15.498 404 HB3 ASN 52 HB3 ASN 52 4.741 25.007 16.337 405 HD21 ASN 52 HD22 ASN 52 7.777 25.936 14.646 406 HD22 ASN 52 HD21 ASN 52 7.215 27.527 14.194 407 H ASN 53 H ASN 53 6.566 22.611 17.908 408 HA ASN 53 HA ASN 53 4.582 22.679 20.135 409 HB2 ASN 53 HB2 ASN 53 3.021 22.577 18.436 410 HB3 ASN 53 HB3 ASN 53 4.136 21.874 17.283 411 HD21 ASN 53 HD22 ASN 53 3.945 19.749 16.811 412 HD22 ASN 53 HD21 ASN 53 3.027 18.594 17.747 413 H GLY 54 H GLY 54 6.376 20.499 17.865 414 HA2 GLY 54 HA2 GLY 54 8.062 19.078 19.381 415 HA3 GLY 54 HA3 GLY 54 6.498 18.407 19.902 416 HA PRO 55 HA PRO 55 7.993 16.097 16.003 417 HB2 PRO 55 HB2 PRO 55 6.868 14.089 18.000 418 HB3 PRO 55 HB3 PRO 55 8.039 13.796 16.664 419 HG2 PRO 55 HG2 PRO 55 8.987 14.180 19.129 420 HG3 PRO 55 HG3 PRO 55 9.685 15.126 17.779 421 HD2 PRO 55 HD2 PRO 55 7.605 16.025 19.788 422 HD3 PRO 55 HD3 PRO 55 9.078 16.886 19.239 423 H TYR 56 H TYR 56 6.573 16.404 14.437 424 HA TYR 56 HA TYR 56 3.681 16.505 14.916 425 HB2 TYR 56 HB2 TYR 56 5.534 17.134 12.652 426 HB3 TYR 56 HB3 TYR 56 3.939 16.571 12.201 427 HD1 TYR 56 HD1 TYR 56 5.525 19.023 14.567 428 HD2 TYR 56 HD2 TYR 56 2.192 18.082 12.009 429 HE1 TYR 56 HE1 TYR 56 4.544 21.262 15.034 430 HE2 TYR 56 HE2 TYR 56 1.196 20.309 12.468 431 HH TYR 56 HH TYR 56 2.764 22.720 14.627 432 H TYR 57 H TYR 57 5.912 13.994 14.300 433 HA TYR 57 HA TYR 57 3.818 12.180 13.234 434 HB2 TYR 57 HB2 TYR 57 6.579 12.673 12.150 435 HB3 TYR 57 HB3 TYR 57 5.603 11.243 11.814 436 HD1 TYR 57 HD1 TYR 57 3.508 11.356 10.537 437 HD2 TYR 57 HD2 TYR 57 5.945 14.871 11.144 438 HE1 TYR 57 HE1 TYR 57 2.234 12.535 8.778 439 HE2 TYR 57 HE2 TYR 57 4.698 16.044 9.360 440 HH TYR 57 HH TYR 57 1.910 14.553 7.653 441 H ILE 58 H ILE 58 3.540 10.862 14.976 442 HA ILE 58 HA ILE 58 5.817 9.378 16.101 443 HB ILE 58 HB ILE 58 3.716 10.858 17.737 444 HG12 ILE 58 HG12 ILE 58 5.700 12.242 17.151 445 HG13 ILE 58 HG13 ILE 58 5.446 12.011 18.867 446 HG21 ILE 58 HG21 ILE 58 4.819 9.775 19.743 447 HG22 ILE 58 HG22 ILE 58 3.871 8.684 18.734 448 HG23 ILE 58 HG23 ILE 58 5.639 8.666 18.619 449 HD11 ILE 58 HD13 ILE 58 7.541 10.558 17.200 450 HD12 ILE 58 HD11 ILE 58 7.844 11.868 18.360 451 HD13 ILE 58 HD12 ILE 58 7.260 10.316 18.937 452 H LEU 59 H LEU 59 5.155 7.243 16.444 453 HA LEU 59 HA LEU 59 2.351 6.574 15.598 454 HB2 LEU 59 HB2 LEU 59 4.955 5.440 14.561 455 HB3 LEU 59 HB3 LEU 59 3.385 4.669 14.375 456 HG LEU 59 HG LEU 59 2.745 7.248 13.606 457 HD11 LEU 59 HD11 LEU 59 5.187 7.872 13.787 458 HD12 LEU 59 HD12 LEU 59 5.517 6.758 12.461 459 HD13 LEU 59 HD13 LEU 59 4.444 8.173 12.227 460 HD21 LEU 59 HD23 LEU 59 2.124 5.154 12.547 461 HD22 LEU 59 HD21 LEU 59 2.587 6.400 11.393 462 HD23 LEU 59 HD22 LEU 59 3.723 5.067 11.762 463 H ALA 60 H ALA 60 5.098 5.786 17.644 464 HA ALA 60 HA ALA 60 3.555 4.048 19.323 465 HB1 ALA 60 HB3 ALA 60 5.857 2.880 17.660 466 HB2 ALA 60 HB1 ALA 60 5.071 2.063 19.023 467 HB3 ALA 60 HB2 ALA 60 4.157 2.408 17.546 468 HA PRO 61 HA PRO 61 6.586 5.715 22.157 469 HB2 PRO 61 HB2 PRO 61 7.139 2.884 23.073 470 HB3 PRO 61 HB3 PRO 61 6.875 4.359 24.054 471 HG2 PRO 61 HG2 PRO 61 4.866 2.572 23.703 472 HG3 PRO 61 HG3 PRO 61 4.529 4.331 23.590 473 HD2 PRO 61 HD2 PRO 61 4.931 2.346 21.344 474 HD3 PRO 61 HD3 PRO 61 3.712 3.648 21.500 475 H GLY 62 H GLY 62 8.400 6.513 21.235 476 HA2 GLY 62 HA2 GLY 62 10.620 6.543 20.759 477 HA3 GLY 62 HA3 GLY 62 10.721 4.778 20.810 478 H VAL 63 H VAL 63 8.180 5.985 18.711 479 HA VAL 63 HA VAL 63 9.958 5.604 16.349 480 HB VAL 63 HB VAL 63 7.136 4.534 16.660 481 HG11 VAL 63 HG11 VAL 63 7.637 3.308 14.585 482 HG12 VAL 63 HG12 VAL 63 7.799 5.041 14.326 483 HG13 VAL 63 HG13 VAL 63 9.254 4.044 14.518 484 HG21 VAL 63 HG23 VAL 63 9.799 3.065 16.894 485 HG22 VAL 63 HG21 VAL 63 8.549 3.216 18.144 486 HG23 VAL 63 HG22 VAL 63 8.222 2.267 16.701 487 H ALA 64 H ALA 64 9.831 7.164 14.892 488 HA ALA 64 HA ALA 64 7.515 9.031 14.856 489 HB1 ALA 64 HB3 ALA 64 9.116 10.882 14.434 490 HB2 ALA 64 HB1 ALA 64 9.463 10.105 15.983 491 HB3 ALA 64 HB2 ALA 64 10.463 9.735 14.562 492 H MET 65 H MET 65 7.533 10.299 12.717 493 HA MET 65 HA MET 65 8.755 8.796 10.513 494 HB2 MET 65 HB2 MET 65 6.642 7.688 10.791 495 HB3 MET 65 HB3 MET 65 5.788 9.236 10.703 496 HG2 MET 65 HG2 MET 65 7.044 9.309 8.299 497 HG3 MET 65 HG3 MET 65 6.998 7.568 8.532 498 HE1 MET 65 HE3 MET 65 4.935 6.245 9.004 499 HE2 MET 65 HE1 MET 65 4.286 7.297 10.277 500 HE3 MET 65 HE2 MET 65 3.239 6.812 8.933 501 HA PRO 66 HA PRO 66 8.665 13.425 10.421 502 HB2 PRO 66 HB2 PRO 66 11.445 12.977 9.238 503 HB3 PRO 66 HB3 PRO 66 10.921 14.251 10.378 504 HG2 PRO 66 HG2 PRO 66 12.276 12.134 11.316 505 HG3 PRO 66 HG3 PRO 66 10.829 12.708 12.197 506 HD2 PRO 66 HD2 PRO 66 11.018 10.415 10.216 507 HD3 PRO 66 HD3 PRO 66 10.269 10.443 11.839 508 H HIS 67 H HIS 67 8.557 14.873 8.679 509 HA HIS 67 HA HIS 67 8.656 14.560 5.917 510 HB2 HIS 67 HB2 HIS 67 7.212 12.677 5.878 511 HB3 HIS 67 HB3 HIS 67 6.237 13.277 7.205 512 HD1 HIS 67 HD1 HIS 67 4.094 14.628 6.628 513 HD2 HIS 67 HD2 HIS 67 6.555 13.802 3.292 514 HE1 HIS 67 HE1 HIS 67 2.711 15.088 4.556 515 H ALA 68 H ALA 68 7.467 16.341 4.914 516 HA ALA 68 HA ALA 68 5.984 18.228 6.611 517 HB1 ALA 68 HB3 ALA 68 8.396 19.035 4.928 518 HB2 ALA 68 HB1 ALA 68 7.241 20.139 5.700 519 HB3 ALA 68 HB2 ALA 68 8.282 19.125 6.699 520 H ARG 69 H ARG 69 4.868 19.808 5.095 521 HA ARG 69 HA ARG 69 3.427 18.413 3.093 522 HB2 ARG 69 HB2 ARG 69 4.020 21.359 3.518 523 HB3 ARG 69 HB3 ARG 69 2.962 20.767 2.223 524 HG2 ARG 69 HG2 ARG 69 1.469 19.741 3.965 525 HG3 ARG 69 HG3 ARG 69 2.467 20.536 5.216 526 HD2 ARG 69 HD2 ARG 69 2.064 22.734 4.093 527 HD3 ARG 69 HD3 ARG 69 1.063 21.909 2.881 528 HE ARG 69 HE ARG 69 0.061 21.398 5.510 529 HH11 ARG 69 HH11 ARG 69 0.268 23.933 3.006 530 HH12 ARG 69 HH12 ARG 69 -1.173 24.747 3.529 531 HH21 ARG 69 HH21 ARG 69 -1.865 22.490 6.186 532 HH22 ARG 69 HH22 ARG 69 -2.408 23.904 5.368 533 HA PRO 70 HA PRO 70 6.205 18.146 -0.387 534 HB2 PRO 70 HB2 PRO 70 3.826 19.362 -1.879 535 HB3 PRO 70 HB3 PRO 70 4.915 18.068 -2.431 536 HG2 PRO 70 HG2 PRO 70 2.509 17.448 -1.364 537 HG3 PRO 70 HG3 PRO 70 3.950 16.514 -0.846 538 HD2 PRO 70 HD2 PRO 70 2.533 18.751 0.602 539 HD3 PRO 70 HD3 PRO 70 3.253 17.246 1.252 540 H GLU 71 H GLU 71 4.168 21.131 -0.152 541 HA GLU 71 HA GLU 71 5.752 22.836 -1.699 542 HB2 GLU 71 HB2 GLU 71 4.416 24.615 -0.862 543 HB3 GLU 71 HB3 GLU 71 3.375 23.203 -1.027 544 HG2 GLU 71 HG2 GLU 71 3.581 22.795 1.431 545 HG3 GLU 71 HG3 GLU 71 4.568 24.244 1.590 546 H CYS 72 H CYS 72 6.627 21.574 1.373 547 HA CYS 72 HA CYS 72 8.129 23.924 2.277 548 HB2 CYS 72 HB2 CYS 72 8.042 21.043 3.282 549 HB3 CYS 72 HB3 CYS 72 8.916 22.375 4.054 550 HG CYS 72 HG CYS 72 6.844 23.937 4.401 551 H GLY 73 H GLY 73 8.643 21.790 -0.241 552 HA2 GLY 73 HA2 GLY 73 10.685 22.515 -1.440 553 HA3 GLY 73 HA3 GLY 73 11.621 22.101 0.000 554 H ALA 74 H ALA 74 8.960 19.924 -0.806 555 HA ALA 74 HA ALA 74 10.812 17.749 -1.445 556 HB1 ALA 74 HB3 ALA 74 8.593 17.360 -0.360 557 HB2 ALA 74 HB1 ALA 74 7.829 17.923 -1.876 558 HB3 ALA 74 HB2 ALA 74 8.833 16.462 -1.875 559 H LEU 75 H LEU 75 11.158 16.849 -3.425 560 HA LEU 75 HA LEU 75 10.470 18.480 -5.837 561 HB2 LEU 75 HB2 LEU 75 13.111 17.179 -5.099 562 HB3 LEU 75 HB3 LEU 75 12.781 17.995 -6.621 563 HG LEU 75 HG LEU 75 12.829 19.329 -3.877 564 HD11 LEU 75 HD11 LEU 75 14.868 19.360 -6.140 565 HD12 LEU 75 HD12 LEU 75 14.947 20.339 -4.656 566 HD13 LEU 75 HD13 LEU 75 15.050 18.579 -4.555 567 HD21 LEU 75 HD23 LEU 75 12.625 20.552 -6.671 568 HD22 LEU 75 HD21 LEU 75 11.346 20.547 -5.438 569 HD23 LEU 75 HD22 LEU 75 12.830 21.456 -5.153 570 H LYS 76 H LYS 76 11.191 15.290 -4.423 571 HA LYS 76 HA LYS 76 9.780 13.992 -6.626 572 HB2 LYS 76 HB2 LYS 76 12.522 13.112 -5.670 573 HB3 LYS 76 HB3 LYS 76 11.512 12.252 -6.828 574 HG2 LYS 76 HG2 LYS 76 11.736 14.168 -8.401 575 HG3 LYS 76 HG3 LYS 76 12.789 15.003 -7.247 576 HD2 LYS 76 HD2 LYS 76 13.429 12.265 -8.410 577 HD3 LYS 76 HD3 LYS 76 13.949 13.788 -9.142 578 HE2 LYS 76 HE2 LYS 76 15.218 14.399 -7.117 579 HE3 LYS 76 HE3 LYS 76 14.666 12.931 -6.298 580 HZ1 LYS 76 HZ3 LYS 76 16.336 12.976 -8.743 581 HZ2 LYS 76 HZ1 LYS 76 16.879 12.740 -7.220 582 HZ3 LYS 76 HZ2 LYS 76 15.885 11.631 -7.918 583 H THR 77 H THR 77 8.972 11.833 -5.913 584 HA THR 77 HA THR 77 8.487 11.846 -3.087 585 HB THR 77 HB THR 77 7.447 10.241 -5.443 586 HG1 THR 77 HG1 THR 77 6.111 11.785 -5.728 587 HG21 THR 77 HG23 THR 77 6.296 10.514 -2.640 588 HG22 THR 77 HG21 THR 77 5.551 9.649 -4.011 589 HG23 THR 77 HG22 THR 77 7.059 9.053 -3.311 590 H GLY 78 H GLY 78 9.274 10.404 -1.567 591 HA2 GLY 78 HA2 GLY 78 10.417 7.848 -2.148 592 HA3 GLY 78 HA3 GLY 78 11.685 9.074 -1.987 593 H MET 79 H MET 79 11.996 7.344 -0.108 594 HA MET 79 HA MET 79 11.032 8.518 2.411 595 HB2 MET 79 HB2 MET 79 10.758 5.610 1.537 596 HB3 MET 79 HB3 MET 79 10.684 6.114 3.218 597 HG2 MET 79 HG2 MET 79 8.704 7.473 2.808 598 HG3 MET 79 HG3 MET 79 8.734 7.034 1.097 599 HE1 MET 79 HE3 MET 79 6.004 6.274 2.245 600 HE2 MET 79 HE1 MET 79 6.702 5.840 0.664 601 HE3 MET 79 HE2 MET 79 5.958 4.587 1.674 602 H SER 80 H SER 80 12.183 7.410 4.247 603 HA SER 80 HA SER 80 14.795 6.230 3.705 604 HB2 SER 80 HB2 SER 80 15.657 8.117 5.428 605 HB3 SER 80 HB3 SER 80 15.717 8.319 3.674 606 HG SER 80 HG SER 80 14.531 9.903 5.366 607 H LEU 81 H LEU 81 15.710 5.388 5.762 608 HA LEU 81 HA LEU 81 13.821 5.015 8.009 609 HB2 LEU 81 HB2 LEU 81 13.511 3.242 6.384 610 HB3 LEU 81 HB3 LEU 81 15.248 2.994 6.206 611 HG LEU 81 HG LEU 81 15.455 1.958 8.281 612 HD11 LEU 81 HD11 LEU 81 13.710 1.640 9.919 613 HD12 LEU 81 HD12 LEU 81 13.825 3.366 9.651 614 HD13 LEU 81 HD13 LEU 81 12.517 2.435 8.900 615 HD21 LEU 81 HD23 LEU 81 12.872 1.060 6.932 616 HD22 LEU 81 HD21 LEU 81 14.489 0.750 6.302 617 HD23 LEU 81 HD22 LEU 81 13.965 0.015 7.847 618 H THR 82 H THR 82 14.904 5.428 9.891 619 HA THR 82 HA THR 82 17.856 5.092 10.001 620 HB THR 82 HB THR 82 16.141 7.449 10.950 621 HG1 THR 82 HG1 THR 82 17.578 8.458 9.226 622 HG21 THR 82 HG23 THR 82 19.177 7.026 11.048 623 HG22 THR 82 HG21 THR 82 18.329 8.560 11.387 624 HG23 THR 82 HG22 THR 82 18.069 7.165 12.428 625 H LEU 83 H LEU 83 18.628 4.439 12.099 626 HA LEU 83 HA LEU 83 16.665 4.314 14.289 627 HB2 LEU 83 HB2 LEU 83 16.671 2.167 12.916 628 HB3 LEU 83 HB3 LEU 83 18.303 1.871 13.507 629 HG LEU 83 HG LEU 83 15.829 2.241 15.275 630 HD11 LEU 83 HD11 LEU 83 15.443 0.295 13.932 631 HD12 LEU 83 HD12 LEU 83 17.122 -0.263 14.163 632 HD13 LEU 83 HD13 LEU 83 15.982 -0.253 15.513 633 HD21 LEU 83 HD23 LEU 83 18.662 1.298 15.888 634 HD22 LEU 83 HD21 LEU 83 17.717 2.597 16.663 635 HD23 LEU 83 HD22 LEU 83 17.276 0.934 16.942 636 H LEU 84 H LEU 84 17.600 4.808 16.193 637 HA LEU 84 HA LEU 84 20.531 5.385 16.315 638 HB2 LEU 84 HB2 LEU 84 18.184 6.545 17.872 639 HB3 LEU 84 HB3 LEU 84 19.874 6.878 18.191 640 HG LEU 84 HG LEU 84 19.233 8.770 17.126 641 HD11 LEU 84 HD11 LEU 84 19.977 7.150 14.678 642 HD12 LEU 84 HD12 LEU 84 20.255 8.876 14.955 643 HD13 LEU 84 HD13 LEU 84 21.154 7.677 15.910 644 HD21 LEU 84 HD23 LEU 84 17.541 7.209 15.140 645 HD22 LEU 84 HD21 LEU 84 16.949 8.099 16.560 646 HD23 LEU 84 HD22 LEU 84 17.727 8.971 15.229 647 H GLU 85 H GLU 85 21.542 3.777 17.550 648 HA GLU 85 HA GLU 85 20.144 1.802 18.979 649 HB2 GLU 85 HB2 GLU 85 23.027 2.709 19.337 650 HB3 GLU 85 HB3 GLU 85 22.339 1.232 20.006 651 HG2 GLU 85 HG2 GLU 85 21.800 0.447 17.698 652 HG3 GLU 85 HG3 GLU 85 22.633 1.858 17.043 653 H GLN 86 H GLN 86 21.453 4.867 20.146 654 HA GLN 86 HA GLN 86 20.583 4.272 22.931 655 HB2 GLN 86 HB2 GLN 86 21.945 6.755 21.802 656 HB3 GLN 86 HB3 GLN 86 21.664 6.392 23.493 657 HG2 GLN 86 HG2 GLN 86 23.073 4.250 23.125 658 HG3 GLN 86 HG3 GLN 86 23.600 4.994 21.616 659 HE21 GLN 86 HE22 GLN 86 24.686 7.236 21.810 660 HE22 GLN 86 HE21 GLN 86 25.528 7.593 23.299 661 H GLY 87 H GLY 87 19.186 5.616 20.126 662 HA2 GLY 87 HA2 GLY 87 17.374 6.973 19.748 663 HA3 GLY 87 HA3 GLY 87 16.968 6.883 21.461 664 H VAL 88 H VAL 88 16.452 9.280 20.456 665 HA VAL 88 HA VAL 88 18.270 10.856 22.058 666 HB VAL 88 HB VAL 88 18.834 10.876 19.372 667 HG11 VAL 88 HG11 VAL 88 16.968 13.238 19.699 668 HG12 VAL 88 HG12 VAL 88 18.007 12.861 18.328 669 HG13 VAL 88 HG13 VAL 88 16.668 11.759 18.743 670 HG21 VAL 88 HG23 VAL 88 20.205 11.768 21.138 671 HG22 VAL 88 HG21 VAL 88 20.085 12.887 19.775 672 HG23 VAL 88 HG22 VAL 88 19.158 13.210 21.262 673 H TYR 89 H TYR 89 17.138 13.087 22.430 674 HA TYR 89 HA TYR 89 14.284 12.344 22.843 675 HB2 TYR 89 HB2 TYR 89 16.181 12.782 24.750 676 HB3 TYR 89 HB3 TYR 89 15.476 14.379 24.634 677 HD1 TYR 89 HD1 TYR 89 12.482 13.401 24.016 678 HD2 TYR 89 HD2 TYR 89 15.518 12.238 26.897 679 HE1 TYR 89 HE1 TYR 89 10.739 12.630 25.574 680 HE2 TYR 89 HE2 TYR 89 13.759 11.470 28.444 681 HH TYR 89 HH TYR 89 10.270 11.567 27.663 682 H PHE 90 H PHE 90 12.886 13.456 21.678 683 HA PHE 90 HA PHE 90 13.541 16.025 20.462 684 HB2 PHE 90 HB2 PHE 90 11.282 14.033 20.509 685 HB3 PHE 90 HB3 PHE 90 11.069 15.631 19.786 686 HD1 PHE 90 HD2 PHE 90 13.457 12.661 19.573 687 HD2 PHE 90 HD1 PHE 90 11.708 16.044 17.549 688 HE1 PHE 90 HE2 PHE 90 14.510 11.952 17.456 689 HE2 PHE 90 HE1 PHE 90 12.738 15.305 15.431 690 HZ PHE 90 HZ PHE 90 14.132 13.251 15.369 691 HA PRO 91 HA PRO 91 12.142 18.402 23.774 692 HB2 PRO 91 HB2 PRO 91 11.460 20.807 22.663 693 HB3 PRO 91 HB3 PRO 91 13.109 20.125 22.542 694 HG2 PRO 91 HG2 PRO 91 10.860 19.901 20.509 695 HG3 PRO 91 HG3 PRO 91 12.540 20.474 20.231 696 HD2 PRO 91 HD2 PRO 91 11.838 17.894 19.739 697 HD3 PRO 91 HD3 PRO 91 13.418 18.296 20.468 698 H GLY 92 H GLY 92 9.621 17.237 21.818 699 HA2 GLY 92 HA2 GLY 92 7.558 18.233 23.700 700 HA3 GLY 92 HA3 GLY 92 7.409 18.674 21.996 701 H ASN 93 H ASN 93 8.637 15.575 23.334 702 HA ASN 93 HA ASN 93 6.087 14.221 22.761 703 HB2 ASN 93 HB2 ASN 93 7.324 13.818 20.704 704 HB3 ASN 93 HB3 ASN 93 8.768 13.335 21.614 705 HD21 ASN 93 HD22 ASN 93 9.006 11.112 21.888 706 HD22 ASN 93 HD21 ASN 93 7.717 9.955 21.724 707 H ASP 94 H ASP 94 5.932 12.227 24.008 708 HA ASP 94 HA ASP 94 6.830 12.739 26.631 709 HB2 ASP 94 HB2 ASP 94 4.703 11.639 26.098 710 HB3 ASP 94 HB3 ASP 94 5.568 10.231 25.478 711 H GLU 95 H GLU 95 8.202 10.575 24.187 712 HA GLU 95 HA GLU 95 10.334 9.824 26.104 713 HB2 GLU 95 HB2 GLU 95 9.976 7.578 25.869 714 HB3 GLU 95 HB3 GLU 95 8.352 8.203 25.897 715 HG2 GLU 95 HG2 GLU 95 9.876 7.407 23.387 716 HG3 GLU 95 HG3 GLU 95 8.746 6.380 24.246 717 HA PRO 96 HA PRO 96 13.095 10.574 22.806 718 HB2 PRO 96 HB2 PRO 96 15.160 8.810 23.130 719 HB3 PRO 96 HB3 PRO 96 14.813 10.114 24.306 720 HG2 PRO 96 HG2 PRO 96 14.033 7.196 24.463 721 HG3 PRO 96 HG3 PRO 96 14.713 8.237 25.752 722 HD2 PRO 96 HD2 PRO 96 12.027 7.691 25.447 723 HD3 PRO 96 HD3 PRO 96 12.628 9.216 26.179 724 H ILE 97 H ILE 97 13.609 9.975 20.676 725 HA ILE 97 HA ILE 97 12.033 7.682 19.636 726 HB ILE 97 HB ILE 97 13.479 9.887 18.126 727 HG12 ILE 97 HG12 ILE 97 11.776 10.978 19.397 728 HG13 ILE 97 HG13 ILE 97 11.200 10.853 17.749 729 HG21 ILE 97 HG21 ILE 97 12.005 9.175 16.242 730 HG22 ILE 97 HG22 ILE 97 13.146 7.918 16.702 731 HG23 ILE 97 HG23 ILE 97 11.445 7.803 17.200 732 HD11 ILE 97 HD13 ILE 97 9.699 8.987 18.409 733 HD12 ILE 97 HD11 ILE 97 10.330 9.058 20.078 734 HD13 ILE 97 HD12 ILE 97 9.459 10.427 19.426 735 H LYS 98 H LYS 98 12.949 5.911 18.861 736 HA LYS 98 HA LYS 98 15.928 5.804 18.642 737 HB2 LYS 98 HB2 LYS 98 13.988 3.494 19.064 738 HB3 LYS 98 HB3 LYS 98 15.747 3.416 18.951 739 HG2 LYS 98 HG2 LYS 98 15.729 5.046 21.011 740 HG3 LYS 98 HG3 LYS 98 14.031 4.592 21.169 741 HD2 LYS 98 HD2 LYS 98 15.295 3.195 22.641 742 HD3 LYS 98 HD3 LYS 98 14.778 2.163 21.292 743 HE2 LYS 98 HE2 LYS 98 17.008 2.393 20.237 744 HE3 LYS 98 HE3 LYS 98 17.493 3.560 21.467 745 HZ1 LYS 98 HZ3 LYS 98 16.976 0.683 21.917 746 HZ2 LYS 98 HZ1 LYS 98 18.413 1.482 21.994 747 HZ3 LYS 98 HZ2 LYS 98 17.266 1.757 23.122 748 H LEU 99 H LEU 99 12.924 5.720 16.828 749 HA LEU 99 HA LEU 99 14.418 4.760 14.460 750 HB2 LEU 99 HB2 LEU 99 13.478 2.773 15.546 751 HB3 LEU 99 HB3 LEU 99 11.947 3.603 15.802 752 HG LEU 99 HG LEU 99 11.478 3.521 13.365 753 HD11 LEU 99 HD11 LEU 99 13.682 3.313 12.340 754 HD12 LEU 99 HD12 LEU 99 14.031 1.827 13.235 755 HD13 LEU 99 HD13 LEU 99 12.774 1.847 11.995 756 HD21 LEU 99 HD23 LEU 99 12.112 0.834 14.651 757 HD22 LEU 99 HD21 LEU 99 10.689 1.829 15.030 758 HD23 LEU 99 HD22 LEU 99 10.878 1.175 13.415 759 H LEU 100 H LEU 100 13.791 5.675 12.574 760 HA LEU 100 HA LEU 100 11.399 7.447 12.568 761 HB2 LEU 100 HB2 LEU 100 14.120 8.310 11.550 762 HB3 LEU 100 HB3 LEU 100 12.662 9.258 11.615 763 HG LEU 100 HG LEU 100 13.099 8.425 14.282 764 HD11 LEU 100 HD11 LEU 100 15.713 9.359 13.090 765 HD12 LEU 100 HD12 LEU 100 15.357 9.104 14.814 766 HD13 LEU 100 HD13 LEU 100 15.362 7.722 13.699 767 HD21 LEU 100 HD23 LEU 100 13.350 10.676 14.882 768 HD22 LEU 100 HD21 LEU 100 13.919 11.143 13.282 769 HD23 LEU 100 HD22 LEU 100 12.231 10.657 13.508 770 H ILE 101 H ILE 101 10.295 7.341 10.605 771 HA ILE 101 HA ILE 101 11.849 6.419 8.254 772 HB ILE 101 HB ILE 101 9.006 5.682 9.017 773 HG12 ILE 101 HG12 ILE 101 11.549 4.335 8.034 774 HG13 ILE 101 HG13 ILE 101 10.718 4.117 9.577 775 HG21 ILE 101 HG21 ILE 101 8.481 5.034 6.754 776 HG22 ILE 101 HG22 ILE 101 8.741 6.757 6.831 777 HG23 ILE 101 HG23 ILE 101 10.019 5.717 6.157 778 HD11 ILE 101 HD13 ILE 101 10.347 2.166 8.265 779 HD12 ILE 101 HD11 ILE 101 8.816 3.072 8.221 780 HD13 ILE 101 HD12 ILE 101 9.946 3.112 6.829 781 H GLY 102 H GLY 102 12.262 7.952 6.883 782 HA2 GLY 102 HA2 GLY 102 10.889 10.549 7.040 783 HA3 GLY 102 HA3 GLY 102 12.259 10.139 6.015 784 H LEU 103 H LEU 103 9.634 11.339 5.231 785 HA LEU 103 HA LEU 103 9.284 9.667 2.846 786 HB2 LEU 103 HB2 LEU 103 7.388 9.072 4.510 787 HB3 LEU 103 HB3 LEU 103 6.886 10.741 4.382 788 HG LEU 103 HG LEU 103 6.715 8.510 2.297 789 HD11 LEU 103 HD11 LEU 103 4.919 8.689 3.944 790 HD12 LEU 103 HD12 LEU 103 4.739 10.428 3.643 791 HD13 LEU 103 HD13 LEU 103 4.312 9.247 2.404 792 HD21 LEU 103 HD23 LEU 103 6.430 11.496 1.813 793 HD22 LEU 103 HD21 LEU 103 7.318 10.220 0.892 794 HD23 LEU 103 HD22 LEU 103 5.581 10.303 0.839 795 H SER 104 H SER 104 9.208 11.057 1.068 796 HA SER 104 HA SER 104 8.539 13.904 1.438 797 HB2 SER 104 HB2 SER 104 10.259 14.558 -0.140 798 HB3 SER 104 HB3 SER 104 11.001 13.776 1.267 799 HG SER 104 HG SER 104 10.831 12.935 -1.397 800 H ALA 105 H ALA 105 7.368 14.741 -0.432 801 HA ALA 105 HA ALA 105 6.853 12.825 -2.597 802 HB1 ALA 105 HB3 ALA 105 5.146 12.274 -0.900 803 HB2 ALA 105 HB1 ALA 105 4.645 13.989 -0.862 804 HB3 ALA 105 HB2 ALA 105 4.432 13.030 -2.339 805 H ALA 106 H ALA 106 6.495 13.839 -4.506 806 HA ALA 106 HA ALA 106 6.977 16.684 -4.593 807 HB1 ALA 106 HB3 ALA 106 6.788 16.373 -7.047 808 HB2 ALA 106 HB1 ALA 106 7.837 15.138 -6.333 809 HB3 ALA 106 HB2 ALA 106 6.171 14.725 -6.801 810 H ASP 107 H ASP 107 4.114 14.681 -4.421 811 HA ASP 107 HA ASP 107 2.399 17.095 -4.619 812 HB2 ASP 107 HB2 ASP 107 2.377 16.093 -6.881 813 HB3 ASP 107 HB3 ASP 107 1.928 14.531 -6.194 814 H ALA 108 H ALA 108 0.360 16.821 -3.510 815 HA ALA 108 HA ALA 108 0.616 15.457 -1.077 816 HB1 ALA 108 HB3 ALA 108 -0.788 17.456 -1.379 817 HB2 ALA 108 HB1 ALA 108 -1.904 16.527 -2.414 818 HB3 ALA 108 HB2 ALA 108 -1.729 16.115 -0.696 819 H ASP 109 H ASP 109 -0.896 14.337 -4.116 820 HA ASP 109 HA ASP 109 -2.172 12.046 -2.786 821 HB2 ASP 109 HB2 ASP 109 -3.203 12.970 -4.749 822 HB3 ASP 109 HB3 ASP 109 -1.724 12.707 -5.701 823 H SER 110 H SER 110 0.886 12.715 -4.467 824 HA SER 110 HA SER 110 1.811 9.988 -4.517 825 HB2 SER 110 HB2 SER 110 3.505 12.516 -4.309 826 HB3 SER 110 HB3 SER 110 3.993 10.923 -4.893 827 HG SER 110 HG SER 110 3.507 12.293 -6.630 828 H HIS 111 H HIS 111 1.905 12.613 -2.078 829 HA HIS 111 HA HIS 111 3.292 11.222 -0.016 830 HB2 HIS 111 HB2 HIS 111 3.040 13.365 0.657 831 HB3 HIS 111 HB3 HIS 111 1.579 13.590 -0.292 832 HD1 HIS 111 HD1 HIS 111 -0.691 13.491 0.911 833 HD2 HIS 111 HD2 HIS 111 2.625 12.392 3.252 834 HE1 HIS 111 HE1 HIS 111 -1.519 13.400 3.337 835 H ILE 112 H ILE 112 -0.237 11.356 -0.767 836 HA ILE 112 HA ILE 112 -1.037 9.630 1.328 837 HB ILE 112 HB ILE 112 -2.202 10.224 -1.422 838 HG12 ILE 112 HG12 ILE 112 -2.198 12.095 0.241 839 HG13 ILE 112 HG13 ILE 112 -3.778 11.630 -0.348 840 HG21 ILE 112 HG21 ILE 112 -3.051 8.080 -0.937 841 HG22 ILE 112 HG22 ILE 112 -3.400 8.520 0.753 842 HG23 ILE 112 HG23 ILE 112 -4.329 9.251 -0.590 843 HD11 ILE 112 HD13 ILE 112 -2.603 10.832 2.346 844 HD12 ILE 112 HD11 ILE 112 -3.748 12.158 2.047 845 HD13 ILE 112 HD12 ILE 112 -4.252 10.482 1.766 846 H GLY 113 H GLY 113 -0.148 8.765 -2.095 847 HA2 GLY 113 HA2 GLY 113 -0.505 5.989 -1.819 848 HA3 GLY 113 HA3 GLY 113 0.615 6.778 -2.946 849 H ALA 114 H ALA 114 2.321 8.013 -1.022 850 HA ALA 114 HA ALA 114 4.150 5.871 -0.411 851 HB1 ALA 114 HB3 ALA 114 5.453 7.785 0.562 852 HB2 ALA 114 HB1 ALA 114 4.899 8.100 -1.083 853 HB3 ALA 114 HB2 ALA 114 4.053 8.837 0.272 854 H ILE 115 H ILE 115 2.207 8.062 1.758 855 HA ILE 115 HA ILE 115 2.766 6.960 4.190 856 HB ILE 115 HB ILE 115 0.458 8.268 2.943 857 HG12 ILE 115 HG12 ILE 115 2.347 9.731 3.526 858 HG13 ILE 115 HG13 ILE 115 0.881 10.146 4.377 859 HG21 ILE 115 HG21 ILE 115 -0.629 8.496 5.189 860 HG22 ILE 115 HG22 ILE 115 -0.737 6.944 4.358 861 HG23 ILE 115 HG23 ILE 115 0.430 7.129 5.694 862 HD11 ILE 115 HD13 ILE 115 2.804 10.339 5.851 863 HD12 ILE 115 HD11 ILE 115 1.735 9.055 6.439 864 HD13 ILE 115 HD12 ILE 115 3.236 8.648 5.576 865 H GLN 116 H GLN 116 0.262 6.015 1.745 866 HA GLN 116 HA GLN 116 -0.852 3.866 3.255 867 HB2 GLN 116 HB2 GLN 116 -0.944 4.647 0.324 868 HB3 GLN 116 HB3 GLN 116 -1.815 3.243 0.940 869 HG2 GLN 116 HG2 GLN 116 -2.121 6.049 2.063 870 HG3 GLN 116 HG3 GLN 116 -3.162 5.385 0.807 871 HE21 GLN 116 HE22 GLN 116 -3.319 6.111 3.957 872 HE22 GLN 116 HE21 GLN 116 -4.280 4.789 4.564 873 H ALA 117 H ALA 117 2.213 3.992 1.840 874 HA ALA 117 HA ALA 117 2.353 1.082 1.558 875 HB1 ALA 117 HB3 ALA 117 4.529 1.412 0.498 876 HB2 ALA 117 HB1 ALA 117 3.337 2.452 -0.312 877 HB3 ALA 117 HB2 ALA 117 4.478 3.146 0.841 878 H LEU 118 H LEU 118 3.782 3.892 3.282 879 HA LEU 118 HA LEU 118 5.474 2.124 4.793 880 HB2 LEU 118 HB2 LEU 118 6.142 4.031 6.037 881 HB3 LEU 118 HB3 LEU 118 6.178 4.284 4.274 882 HG LEU 118 HG LEU 118 4.324 5.698 4.314 883 HD11 LEU 118 HD11 LEU 118 3.612 6.679 6.622 884 HD12 LEU 118 HD12 LEU 118 2.879 5.204 6.161 885 HD13 LEU 118 HD13 LEU 118 4.227 5.142 7.300 886 HD21 LEU 118 HD23 LEU 118 5.472 7.571 5.633 887 HD22 LEU 118 HD21 LEU 118 6.475 6.355 6.392 888 HD23 LEU 118 HD22 LEU 118 6.598 6.626 4.642 889 H SER 119 H SER 119 2.316 3.395 5.367 890 HA SER 119 HA SER 119 2.100 2.599 8.085 891 HB2 SER 119 HB2 SER 119 -0.405 2.472 7.581 892 HB3 SER 119 HB3 SER 119 0.405 4.018 7.293 893 HG SER 119 HG SER 119 0.383 3.677 5.139 894 H GLU 120 H GLU 120 2.314 0.574 5.231 895 HA GLU 120 HA GLU 120 1.073 -1.748 6.424 896 HB2 GLU 120 HB2 GLU 120 3.196 -1.711 4.242 897 HB3 GLU 120 HB3 GLU 120 2.135 -3.035 4.690 898 HG2 GLU 120 HG2 GLU 120 0.170 -1.433 4.073 899 HG3 GLU 120 HG3 GLU 120 1.404 -0.467 3.252 900 H LEU 121 H LEU 121 4.031 -0.019 6.760 901 HA LEU 121 HA LEU 121 5.386 -2.263 8.156 902 HB2 LEU 121 HB2 LEU 121 6.465 0.477 7.352 903 HB3 LEU 121 HB3 LEU 121 7.361 -0.788 8.166 904 HG LEU 121 HG LEU 121 6.287 -0.751 5.336 905 HD11 LEU 121 HD11 LEU 121 9.069 -1.124 6.538 906 HD12 LEU 121 HD12 LEU 121 8.694 -1.120 4.807 907 HD13 LEU 121 HD13 LEU 121 8.442 0.349 5.765 908 HD21 LEU 121 HD23 LEU 121 5.833 -3.047 6.085 909 HD22 LEU 121 HD21 LEU 121 7.270 -3.073 5.066 910 HD23 LEU 121 HD22 LEU 121 7.446 -3.169 6.827 911 H LEU 122 H LEU 122 5.077 1.304 8.847 912 HA LEU 122 HA LEU 122 5.734 0.682 11.576 913 HB2 LEU 122 HB2 LEU 122 4.578 3.256 10.422 914 HB3 LEU 122 HB3 LEU 122 5.187 3.061 12.061 915 HG LEU 122 HG LEU 122 6.773 3.049 9.485 916 HD11 LEU 122 HD11 LEU 122 8.000 4.863 10.747 917 HD12 LEU 122 HD12 LEU 122 6.290 5.231 10.461 918 HD13 LEU 122 HD13 LEU 122 6.841 4.691 12.061 919 HD21 LEU 122 HD23 LEU 122 7.751 1.224 10.821 920 HD22 LEU 122 HD21 LEU 122 8.818 2.624 10.822 921 HD23 LEU 122 HD22 LEU 122 7.823 2.292 12.249 922 H CYS 123 H CYS 123 2.603 0.415 10.106 923 HA CYS 123 HA CYS 123 1.349 0.666 12.786 924 HB2 CYS 123 HB2 CYS 123 -0.094 0.420 10.129 925 HB3 CYS 123 HB3 CYS 123 -0.780 0.812 11.700 926 HG CYS 123 HG CYS 123 -0.790 2.970 10.260 927 H GLU 124 H GLU 124 3.111 -1.510 11.989 928 HA GLU 124 HA GLU 124 1.363 -3.740 12.777 929 HB2 GLU 124 HB2 GLU 124 3.530 -3.750 10.650 930 HB3 GLU 124 HB3 GLU 124 3.075 -5.214 11.518 931 HG2 GLU 124 HG2 GLU 124 1.022 -3.531 10.055 932 HG3 GLU 124 HG3 GLU 124 2.002 -4.742 9.229 933 H GLU 125 H GLU 125 1.874 -3.972 14.818 934 HA GLU 125 HA GLU 125 4.250 -3.012 16.024 935 HB2 GLU 125 HB2 GLU 125 3.529 -4.171 18.026 936 HB3 GLU 125 HB3 GLU 125 2.172 -3.356 17.249 937 HG2 GLU 125 HG2 GLU 125 1.470 -5.562 16.252 938 HG3 GLU 125 HG3 GLU 125 2.779 -6.346 17.137 939 H GLU 126 H GLU 126 3.580 -6.038 14.409 940 HA GLU 126 HA GLU 126 5.749 -7.588 15.385 941 HB2 GLU 126 HB2 GLU 126 4.339 -7.595 12.684 942 HB3 GLU 126 HB3 GLU 126 5.477 -8.839 13.205 943 HG2 GLU 126 HG2 GLU 126 2.909 -8.136 14.676 944 HG3 GLU 126 HG3 GLU 126 3.041 -9.413 13.473 945 H ILE 127 H ILE 127 5.411 -5.386 12.610 946 HA ILE 127 HA ILE 127 8.116 -5.603 11.667 947 HB ILE 127 HB ILE 127 5.769 -3.867 11.154 948 HG12 ILE 127 HG12 ILE 127 6.083 -4.551 8.860 949 HG13 ILE 127 HG13 ILE 127 7.623 -5.327 9.254 950 HG21 ILE 127 HG21 ILE 127 8.597 -3.087 10.447 951 HG22 ILE 127 HG22 ILE 127 7.231 -2.603 9.446 952 HG23 ILE 127 HG23 ILE 127 7.281 -2.070 11.124 953 HD11 ILE 127 HD13 ILE 127 5.754 -6.922 8.892 954 HD12 ILE 127 HD11 ILE 127 6.465 -7.076 10.503 955 HD13 ILE 127 HD12 ILE 127 4.907 -6.233 10.290 956 H LEU 128 H LEU 128 6.399 -3.297 13.841 957 HA LEU 128 HA LEU 128 8.520 -1.504 14.133 958 HB2 LEU 128 HB2 LEU 128 6.421 -2.320 16.183 959 HB3 LEU 128 HB3 LEU 128 7.558 -1.008 16.433 960 HG LEU 128 HG LEU 128 5.446 -1.094 14.238 961 HD11 LEU 128 HD11 LEU 128 5.732 0.557 16.777 962 HD12 LEU 128 HD12 LEU 128 4.461 0.764 15.549 963 HD13 LEU 128 HD13 LEU 128 4.540 -0.726 16.496 964 HD21 LEU 128 HD23 LEU 128 7.298 0.133 13.342 965 HD22 LEU 128 HD21 LEU 128 6.154 1.334 13.945 966 HD23 LEU 128 HD22 LEU 128 7.607 0.944 14.891 967 H GLU 129 H GLU 129 8.012 -4.492 15.991 968 HA GLU 129 HA GLU 129 10.264 -4.035 17.689 969 HB2 GLU 129 HB2 GLU 129 8.422 -6.343 17.124 970 HB3 GLU 129 HB3 GLU 129 10.009 -6.721 17.808 971 HG2 GLU 129 HG2 GLU 129 9.662 -5.135 19.644 972 HG3 GLU 129 HG3 GLU 129 8.064 -4.716 19.009 973 H GLN 130 H GLN 130 9.857 -5.646 14.485 974 HA GLN 130 HA GLN 130 12.455 -6.872 14.603 975 HB2 GLN 130 HB2 GLN 130 10.373 -6.428 12.443 976 HB3 GLN 130 HB3 GLN 130 11.938 -7.205 12.107 977 HG2 GLN 130 HG2 GLN 130 11.543 -8.967 13.661 978 HG3 GLN 130 HG3 GLN 130 10.062 -8.212 14.260 979 HE21 GLN 130 HE22 GLN 130 8.190 -8.192 12.936 980 HE22 GLN 130 HE21 GLN 130 7.986 -9.328 11.606 981 H LEU 131 H LEU 131 11.160 -3.755 13.419 982 HA LEU 131 HA LEU 131 13.666 -2.872 12.239 983 HB2 LEU 131 HB2 LEU 131 11.427 -1.260 13.502 984 HB3 LEU 131 HB3 LEU 131 12.780 -0.586 12.596 985 HG LEU 131 HG LEU 131 10.842 -2.588 11.329 986 HD11 LEU 131 HD11 LEU 131 9.576 -0.739 12.386 987 HD12 LEU 131 HD12 LEU 131 10.482 0.424 11.387 988 HD13 LEU 131 HD13 LEU 131 9.426 -0.768 10.611 989 HD21 LEU 131 HD23 LEU 131 11.441 -1.480 9.238 990 HD22 LEU 131 HD21 LEU 131 12.439 -0.311 10.112 991 HD23 LEU 131 HD22 LEU 131 12.910 -2.026 10.062 992 H LEU 132 H LEU 132 11.986 -2.183 15.353 993 HA LEU 132 HA LEU 132 14.023 -0.657 16.494 994 HB2 LEU 132 HB2 LEU 132 11.910 -2.397 17.776 995 HB3 LEU 132 HB3 LEU 132 13.042 -1.499 18.765 996 HG LEU 132 HG LEU 132 11.300 -0.127 16.683 997 HD11 LEU 132 HD11 LEU 132 9.872 -1.239 18.352 998 HD12 LEU 132 HD12 LEU 132 10.789 -0.473 19.668 999 HD13 LEU 132 HD13 LEU 132 9.830 0.520 18.546 1000 HD21 LEU 132 HD23 LEU 132 13.284 1.183 17.385 1001 HD22 LEU 132 HD21 LEU 132 11.799 1.902 18.011 1002 HD23 LEU 132 HD22 LEU 132 12.842 0.952 19.087 1003 H THR 133 H THR 133 14.003 -4.170 16.283 1004 HA THR 133 HA THR 133 16.367 -4.326 18.046 1005 HB THR 133 HB THR 133 15.923 -6.760 17.992 1006 HG1 THR 133 HG1 THR 133 13.500 -6.073 16.701 1007 HG21 THR 133 HG23 THR 133 14.937 -5.357 19.777 1008 HG22 THR 133 HG21 THR 133 13.475 -5.109 18.800 1009 HG23 THR 133 HG22 THR 133 13.901 -6.733 19.370 1010 H ALA 134 H ALA 134 16.075 -3.560 14.895 1011 HA ALA 134 HA ALA 134 17.647 -5.389 13.456 1012 HB1 ALA 134 HB3 ALA 134 17.387 -2.367 13.103 1013 HB2 ALA 134 HB1 ALA 134 18.058 -3.494 11.914 1014 HB3 ALA 134 HB2 ALA 134 16.345 -3.614 12.368 1015 H SER 135 H SER 135 19.621 -6.106 14.086 1016 HA SER 135 HA SER 135 21.476 -4.611 15.604 1017 HB2 SER 135 HB2 SER 135 22.067 -6.956 13.754 1018 HB3 SER 135 HB3 SER 135 22.954 -6.481 15.212 1019 HG SER 135 HG SER 135 21.532 -8.239 15.590 1020 H SER 136 H SER 136 20.836 -4.632 12.147 1021 HA SER 136 HA SER 136 23.168 -2.912 11.584 1022 HB2 SER 136 HB2 SER 136 22.614 -5.519 10.094 1023 HB3 SER 136 HB3 SER 136 23.955 -4.403 9.810 1024 HG SER 136 HG SER 136 24.766 -4.950 11.871 1025 H GLU 137 H GLU 137 23.040 -1.937 9.499 1026 HA GLU 137 HA GLU 137 20.624 -0.855 8.633 1027 HB2 GLU 137 HB2 GLU 137 23.034 -0.166 8.210 1028 HB3 GLU 137 HB3 GLU 137 23.116 -1.432 6.978 1029 HG2 GLU 137 HG2 GLU 137 21.218 -0.266 5.784 1030 HG3 GLU 137 HG3 GLU 137 21.330 1.020 7.001 1031 H LYS 138 H LYS 138 22.264 -3.827 7.496 1032 HA LYS 138 HA LYS 138 20.634 -4.344 5.297 1033 HB2 LYS 138 HB2 LYS 138 22.764 -5.513 5.800 1034 HB3 LYS 138 HB3 LYS 138 22.004 -6.326 7.168 1035 HG2 LYS 138 HG2 LYS 138 22.218 -7.824 5.267 1036 HG3 LYS 138 HG3 LYS 138 20.518 -7.570 5.652 1037 HD2 LYS 138 HD2 LYS 138 20.306 -5.987 3.753 1038 HD3 LYS 138 HD3 LYS 138 22.043 -6.163 3.409 1039 HE2 LYS 138 HE2 LYS 138 21.696 -8.598 3.013 1040 HE3 LYS 138 HE3 LYS 138 19.971 -8.407 3.351 1041 HZ1 LYS 138 HZ3 LYS 138 20.417 -8.397 0.982 1042 HZ2 LYS 138 HZ1 LYS 138 19.822 -6.946 1.417 1043 HZ3 LYS 138 HZ2 LYS 138 21.419 -7.121 1.107 1044 H GLN 139 H GLN 139 19.826 -4.999 8.769 1045 HA GLN 139 HA GLN 139 17.650 -6.687 8.028 1046 HB2 GLN 139 HB2 GLN 139 19.032 -7.093 9.966 1047 HB3 GLN 139 HB3 GLN 139 18.777 -5.446 10.557 1048 HG2 GLN 139 HG2 GLN 139 17.505 -6.972 11.820 1049 HG3 GLN 139 HG3 GLN 139 16.471 -5.863 10.914 1050 HE21 GLN 139 HE22 GLN 139 15.187 -6.751 9.119 1051 HE22 GLN 139 HE21 GLN 139 14.981 -8.457 8.840 1052 H LEU 140 H LEU 140 18.183 -3.186 8.607 1053 HA LEU 140 HA LEU 140 15.353 -2.576 8.919 1054 HB2 LEU 140 HB2 LEU 140 17.809 -0.954 8.217 1055 HB3 LEU 140 HB3 LEU 140 16.202 -0.273 8.082 1056 HG LEU 140 HG LEU 140 17.423 -1.387 10.621 1057 HD11 LEU 140 HD11 LEU 140 18.314 0.841 9.722 1058 HD12 LEU 140 HD12 LEU 140 16.697 1.503 10.023 1059 HD13 LEU 140 HD13 LEU 140 17.651 0.856 11.357 1060 HD21 LEU 140 HD23 LEU 140 14.701 -0.250 10.147 1061 HD22 LEU 140 HD21 LEU 140 15.159 -1.778 10.929 1062 HD23 LEU 140 HD22 LEU 140 15.468 -0.250 11.746 1063 H ALA 141 H ALA 141 17.700 -2.414 6.206 1064 HA ALA 141 HA ALA 141 15.908 -2.010 4.097 1065 HB1 ALA 141 HB3 ALA 141 18.451 -3.689 4.041 1066 HB2 ALA 141 HB1 ALA 141 17.646 -2.931 2.651 1067 HB3 ALA 141 HB2 ALA 141 18.387 -1.921 3.902 1068 H ASP 142 H ASP 142 16.711 -5.155 5.662 1069 HA ASP 142 HA ASP 142 15.374 -6.810 3.820 1070 HB2 ASP 142 HB2 ASP 142 16.754 -7.827 5.477 1071 HB3 ASP 142 HB3 ASP 142 15.874 -7.047 6.787 1072 H ILE 143 H ILE 143 14.033 -5.019 6.676 1073 HA ILE 143 HA ILE 143 11.430 -6.159 6.413 1074 HB ILE 143 HB ILE 143 12.599 -3.765 7.869 1075 HG12 ILE 143 HG12 ILE 143 11.605 -6.484 8.882 1076 HG13 ILE 143 HG13 ILE 143 13.288 -6.139 8.519 1077 HG21 ILE 143 HG21 ILE 143 9.792 -4.917 8.046 1078 HG22 ILE 143 HG22 ILE 143 10.486 -3.751 9.197 1079 HG23 ILE 143 HG23 ILE 143 10.255 -3.281 7.513 1080 HD11 ILE 143 HD13 ILE 143 11.639 -4.966 10.763 1081 HD12 ILE 143 HD11 ILE 143 13.127 -5.927 10.823 1082 HD13 ILE 143 HD12 ILE 143 13.202 -4.270 10.231 1083 H ILE 144 H ILE 144 13.024 -3.256 5.100 1084 HA ILE 144 HA ILE 144 10.721 -2.197 3.741 1085 HB ILE 144 HB ILE 144 13.683 -2.127 2.994 1086 HG12 ILE 144 HG12 ILE 144 13.374 -0.895 4.994 1087 HG13 ILE 144 HG13 ILE 144 13.519 0.272 3.684 1088 HG21 ILE 144 HG21 ILE 144 13.153 -0.285 1.455 1089 HG22 ILE 144 HG22 ILE 144 12.487 -1.822 0.926 1090 HG23 ILE 144 HG23 ILE 144 11.418 -0.612 1.658 1091 HD11 ILE 144 HD13 ILE 144 11.735 1.070 5.013 1092 HD12 ILE 144 HD11 ILE 144 10.923 0.272 3.643 1093 HD13 ILE 144 HD12 ILE 144 11.055 -0.550 5.216 1094 H SER 145 H SER 145 13.217 -4.501 2.668 1095 HA SER 145 HA SER 145 12.160 -4.777 0.111 1096 HB2 SER 145 HB2 SER 145 13.828 -6.810 1.667 1097 HB3 SER 145 HB3 SER 145 13.656 -6.734 -0.094 1098 HG SER 145 HG SER 145 14.866 -4.827 1.642 1099 H ARG 146 H ARG 146 11.269 -6.463 3.095 1100 HA ARG 146 HA ARG 146 9.820 -8.610 2.127 1101 HB2 ARG 146 HB2 ARG 146 10.483 -7.479 4.570 1102 HB3 ARG 146 HB3 ARG 146 8.763 -7.102 4.504 1103 HG2 ARG 146 HG2 ARG 146 8.297 -9.506 4.074 1104 HG3 ARG 146 HG3 ARG 146 10.046 -9.836 4.135 1105 HD2 ARG 146 HD2 ARG 146 8.502 -8.540 6.417 1106 HD3 ARG 146 HD3 ARG 146 8.712 -10.299 6.272 1107 HE ARG 146 HE ARG 146 11.265 -9.031 6.102 1108 HH11 ARG 146 HH21 ARG 146 8.735 -9.827 8.469 1109 HH12 ARG 146 HH22 ARG 146 9.844 -9.896 9.811 1110 HH21 ARG 146 HH11 ARG 146 12.717 -9.151 7.896 1111 HH22 ARG 146 HH12 ARG 146 12.095 -9.521 9.482 1112 H GLY 147 H GLY 147 8.966 -5.205 2.012 1113 HA2 GLY 147 HA2 GLY 147 6.067 -5.679 1.907 1114 HA3 GLY 147 HA3 GLY 147 6.922 -4.130 1.821 Start of MODEL 3 1 H MET 1 H1 MET 1 2.063 -0.858 -1.026 2 HA MET 1 HA MET 1 2.658 -1.313 -3.872 3 HB2 MET 1 HB2 MET 1 2.504 1.195 -3.090 4 HB3 MET 1 HB3 MET 1 3.985 0.829 -2.170 5 HG2 MET 1 HG2 MET 1 4.336 1.899 -4.411 6 HG3 MET 1 HG3 MET 1 5.233 0.418 -4.139 7 HE1 MET 1 HE3 MET 1 4.684 0.344 -7.989 8 HE2 MET 1 HE1 MET 1 5.012 1.751 -6.955 9 HE3 MET 1 HE2 MET 1 5.857 0.213 -6.661 10 H ARG 2 H ARG 2 4.916 -1.905 -4.264 11 HA ARG 2 HA ARG 2 6.113 -3.467 -2.105 12 HB2 ARG 2 HB2 ARG 2 7.111 -2.545 -4.855 13 HB3 ARG 2 HB3 ARG 2 8.145 -3.379 -3.700 14 HG2 ARG 2 HG2 ARG 2 7.416 -5.005 -5.236 15 HG3 ARG 2 HG3 ARG 2 6.573 -5.330 -3.717 16 HD2 ARG 2 HD2 ARG 2 4.511 -4.332 -4.624 17 HD3 ARG 2 HD3 ARG 2 5.382 -3.797 -6.065 18 HE ARG 2 HE ARG 2 5.298 -5.905 -6.958 19 HH11 ARG 2 HH11 ARG 2 4.193 -6.122 -3.584 20 HH12 ARG 2 HH12 ARG 2 3.603 -7.734 -3.738 21 HH21 ARG 2 HH21 ARG 2 4.514 -8.048 -7.154 22 HH22 ARG 2 HH22 ARG 2 3.791 -8.848 -5.813 23 H LEU 3 H LEU 3 6.846 -2.366 -0.386 24 HA LEU 3 HA LEU 3 7.189 0.339 -0.079 25 HB2 LEU 3 HB2 LEU 3 8.434 -2.050 1.293 26 HB3 LEU 3 HB3 LEU 3 9.070 -0.465 1.674 27 HG LEU 3 HG LEU 3 7.340 -1.331 3.252 28 HD11 LEU 3 HD11 LEU 3 6.273 0.807 3.578 29 HD12 LEU 3 HD12 LEU 3 7.960 1.023 3.152 30 HD13 LEU 3 HD13 LEU 3 6.700 1.332 1.933 31 HD21 LEU 3 HD23 LEU 3 4.991 -1.192 2.689 32 HD22 LEU 3 HD21 LEU 3 5.351 -0.731 1.027 33 HD23 LEU 3 HD22 LEU 3 5.787 -2.349 1.624 34 H SER 4 H SER 4 9.734 -1.964 -1.089 35 HA SER 4 HA SER 4 11.943 -0.437 -1.187 36 HB2 SER 4 HB2 SER 4 11.335 -2.290 -3.481 37 HB3 SER 4 HB3 SER 4 12.807 -2.160 -2.502 38 HG SER 4 HG SER 4 11.501 -4.054 -2.125 39 H ASP 5 H ASP 5 9.160 0.027 -3.361 40 HA ASP 5 HA ASP 5 10.513 1.219 -5.556 41 HB2 ASP 5 HB2 ASP 5 8.160 0.480 -5.600 42 HB3 ASP 5 HB3 ASP 5 7.733 1.747 -4.443 43 H TYR 6 H TYR 6 9.757 2.426 -2.341 44 HA TYR 6 HA TYR 6 10.226 5.238 -3.136 45 HB2 TYR 6 HB2 TYR 6 9.225 3.980 -0.567 46 HB3 TYR 6 HB3 TYR 6 9.374 5.708 -0.844 47 HD1 TYR 6 HD1 TYR 6 7.311 2.697 -1.609 48 HD2 TYR 6 HD2 TYR 6 7.812 6.969 -2.113 49 HE1 TYR 6 HE1 TYR 6 5.006 2.885 -2.431 50 HE2 TYR 6 HE2 TYR 6 5.526 7.120 -3.056 51 HH TYR 6 HH TYR 6 3.574 5.964 -3.587 52 H PHE 7 H PHE 7 12.130 2.650 -1.742 53 HA PHE 7 HA PHE 7 13.744 4.588 -0.136 54 HB2 PHE 7 HB2 PHE 7 13.685 1.566 0.008 55 HB3 PHE 7 HB3 PHE 7 14.749 2.621 0.927 56 HD1 PHE 7 HD1 PHE 7 11.162 2.011 0.229 57 HD2 PHE 7 HD2 PHE 7 14.016 3.218 3.224 58 HE1 PHE 7 HE1 PHE 7 9.322 2.335 1.838 59 HE2 PHE 7 HE2 PHE 7 12.148 3.725 4.745 60 HZ PHE 7 HZ PHE 7 9.832 3.203 4.122 61 HA PRO 8 HA PRO 8 15.939 4.199 -4.089 62 HB2 PRO 8 HB2 PRO 8 17.872 6.164 -3.695 63 HB3 PRO 8 HB3 PRO 8 16.208 6.439 -4.284 64 HG2 PRO 8 HG2 PRO 8 17.223 6.647 -1.426 65 HG3 PRO 8 HG3 PRO 8 16.216 7.825 -2.326 66 HD2 PRO 8 HD2 PRO 8 15.028 6.112 -0.669 67 HD3 PRO 8 HD3 PRO 8 14.332 6.367 -2.291 68 H GLU 9 H GLU 9 18.045 4.719 -1.240 69 HA GLU 9 HA GLU 9 19.529 2.303 -1.599 70 HB2 GLU 9 HB2 GLU 9 20.302 3.567 -3.635 71 HB3 GLU 9 HB3 GLU 9 20.714 4.926 -2.606 72 HG2 GLU 9 HG2 GLU 9 22.527 3.519 -1.561 73 HG3 GLU 9 HG3 GLU 9 22.035 2.172 -2.590 74 H SER 10 H SER 10 21.140 5.313 -0.741 75 HA SER 10 HA SER 10 21.825 4.428 1.843 76 HB2 SER 10 HB2 SER 10 21.728 7.272 0.733 77 HB3 SER 10 HB3 SER 10 22.768 6.676 2.046 78 HG SER 10 HG SER 10 23.888 6.780 0.060 79 H SER 11 H SER 11 18.799 4.750 1.048 80 HA SER 11 HA SER 11 17.715 6.897 2.655 81 HB2 SER 11 HB2 SER 11 15.617 5.234 2.165 82 HB3 SER 11 HB3 SER 11 16.269 6.414 1.020 83 HG SER 11 HG SER 11 16.734 3.612 1.084 84 H ILE 12 H ILE 12 18.732 3.608 3.355 85 HA ILE 12 HA ILE 12 17.277 3.616 5.922 86 HB ILE 12 HB ILE 12 18.662 1.506 4.236 87 HG12 ILE 12 HG12 ILE 12 16.007 0.731 4.994 88 HG13 ILE 12 HG13 ILE 12 15.881 2.434 4.549 89 HG21 ILE 12 HG21 ILE 12 19.171 1.024 6.542 90 HG22 ILE 12 HG22 ILE 12 17.466 1.238 7.008 91 HG23 ILE 12 HG23 ILE 12 17.958 -0.110 5.935 92 HD11 ILE 12 HD13 ILE 12 15.490 1.043 2.638 93 HD12 ILE 12 HD11 ILE 12 17.002 1.959 2.416 94 HD13 ILE 12 HD12 ILE 12 17.063 0.235 2.862 95 H SER 13 H SER 13 18.519 3.772 7.837 96 HA SER 13 HA SER 13 21.436 3.539 7.713 97 HB2 SER 13 HB2 SER 13 20.030 6.178 8.349 98 HB3 SER 13 HB3 SER 13 21.731 5.845 8.720 99 HG SER 13 HG SER 13 21.016 5.253 6.135 100 H VAL 14 H VAL 14 22.409 3.590 9.824 101 HA VAL 14 HA VAL 14 20.589 3.382 12.145 102 HB VAL 14 HB VAL 14 22.948 1.580 11.514 103 HG11 VAL 14 HG11 VAL 14 22.827 1.987 13.935 104 HG12 VAL 14 HG12 VAL 14 21.087 1.619 13.940 105 HG13 VAL 14 HG13 VAL 14 22.281 0.348 13.596 106 HG21 VAL 14 HG23 VAL 14 20.969 0.837 10.237 107 HG22 VAL 14 HG21 VAL 14 21.272 -0.282 11.559 108 HG23 VAL 14 HG22 VAL 14 19.975 0.919 11.705 109 H ILE 15 H ILE 15 21.505 4.297 13.976 110 HA ILE 15 HA ILE 15 23.957 5.972 13.697 111 HB ILE 15 HB ILE 15 21.079 6.642 14.424 112 HG12 ILE 15 HG12 ILE 15 21.725 6.676 11.932 113 HG13 ILE 15 HG13 ILE 15 20.852 8.028 12.612 114 HG21 ILE 15 HG21 ILE 15 21.797 8.986 14.834 115 HG22 ILE 15 HG22 ILE 15 22.339 7.807 16.018 116 HG23 ILE 15 HG23 ILE 15 23.490 8.425 14.814 117 HD11 ILE 15 HD13 ILE 15 22.713 8.707 11.076 118 HD12 ILE 15 HD11 ILE 15 22.825 9.432 12.686 119 HD13 ILE 15 HD12 ILE 15 23.876 8.059 12.257 120 H HIS 16 H HIS 16 25.073 6.019 15.767 121 HA HIS 16 HA HIS 16 24.042 4.256 17.847 122 HB2 HIS 16 HB2 HIS 16 26.487 4.664 17.472 123 HB3 HIS 16 HB3 HIS 16 26.275 6.309 18.089 124 HD1 HIS 16 HD1 HIS 16 25.528 2.681 19.312 125 HD2 HIS 16 HD2 HIS 16 26.503 6.539 20.716 126 HE1 HIS 16 HE1 HIS 16 25.864 2.471 21.835 127 H SER 17 H SER 17 24.346 7.809 17.399 128 HA SER 17 HA SER 17 21.981 8.382 18.937 129 HB2 SER 17 HB2 SER 17 23.396 10.035 20.392 130 HB3 SER 17 HB3 SER 17 23.266 8.352 20.892 131 HG SER 17 HG SER 17 25.473 9.539 19.561 132 H ALA 18 H ALA 18 21.313 10.528 18.393 133 HA ALA 18 HA ALA 18 22.758 11.767 16.112 134 HB1 ALA 18 HB3 ALA 18 20.814 13.320 16.097 135 HB2 ALA 18 HB1 ALA 18 20.345 11.635 15.862 136 HB3 ALA 18 HB2 ALA 18 20.097 12.420 17.449 137 H LYS 19 H LYS 19 23.418 13.987 16.306 138 HA LYS 19 HA LYS 19 24.787 14.709 18.666 139 HB2 LYS 19 HB2 LYS 19 25.125 15.448 16.288 140 HB3 LYS 19 HB3 LYS 19 23.833 16.623 16.544 141 HG2 LYS 19 HG2 LYS 19 25.060 17.733 18.336 142 HG3 LYS 19 HG3 LYS 19 26.208 16.386 18.451 143 HD2 LYS 19 HD2 LYS 19 27.378 18.052 17.292 144 HD3 LYS 19 HD3 LYS 19 26.899 16.830 16.107 145 HE2 LYS 19 HE2 LYS 19 24.759 18.509 15.892 146 HE3 LYS 19 HE3 LYS 19 25.945 19.679 16.480 147 HZ1 LYS 19 HZ3 LYS 19 27.364 18.927 14.565 148 HZ2 LYS 19 HZ1 LYS 19 26.075 18.025 14.036 149 HZ3 LYS 19 HZ2 LYS 19 25.973 19.656 14.108 150 H ASP 20 H ASP 20 21.601 15.643 17.417 151 HA ASP 20 HA ASP 20 20.324 15.923 19.946 152 HB2 ASP 20 HB2 ASP 20 19.746 18.125 20.006 153 HB3 ASP 20 HB3 ASP 20 21.481 18.243 19.684 154 H TRP 21 H TRP 21 18.049 16.799 19.410 155 HA TRP 21 HA TRP 21 16.793 15.220 17.553 156 HB2 TRP 21 HB2 TRP 21 14.991 17.220 18.032 157 HB3 TRP 21 HB3 TRP 21 15.294 15.831 19.068 158 HD1 TRP 21 HD1 TRP 21 16.098 19.518 18.787 159 HE1 TRP 21 HE1 TRP 21 16.888 20.470 21.024 160 HE3 TRP 21 HE3 TRP 21 16.622 15.144 21.281 161 HZ2 TRP 21 HZ2 TRP 21 17.791 19.402 23.578 162 HZ3 TRP 21 HZ3 TRP 21 17.603 15.099 23.572 163 HH2 TRP 21 HH2 TRP 21 18.171 17.222 24.728 164 H GLN 22 H GLN 22 18.035 18.582 16.996 165 HA GLN 22 HA GLN 22 16.751 18.915 14.417 166 HB2 GLN 22 HB2 GLN 22 19.339 20.072 15.483 167 HB3 GLN 22 HB3 GLN 22 18.551 20.547 13.990 168 HG2 GLN 22 HG2 GLN 22 16.673 21.479 15.105 169 HG3 GLN 22 HG3 GLN 22 17.068 20.706 16.640 170 HE21 GLN 22 HE22 GLN 22 19.178 21.296 17.653 171 HE22 GLN 22 HE21 GLN 22 19.679 22.991 17.569 172 H GLU 23 H GLU 23 20.031 17.722 15.441 173 HA GLU 23 HA GLU 23 20.884 16.927 12.868 174 HB2 GLU 23 HB2 GLU 23 22.217 17.100 15.083 175 HB3 GLU 23 HB3 GLU 23 21.557 15.495 15.451 176 HG2 GLU 23 HG2 GLU 23 23.601 14.937 14.523 177 HG3 GLU 23 HG3 GLU 23 22.571 14.799 13.131 178 H ALA 24 H ALA 24 18.848 15.255 15.239 179 HA ALA 24 HA ALA 24 18.974 12.671 14.056 180 HB1 ALA 24 HB3 ALA 24 17.155 12.145 15.520 181 HB2 ALA 24 HB1 ALA 24 18.200 13.322 16.358 182 HB3 ALA 24 HB2 ALA 24 16.665 13.849 15.642 183 H ILE 25 H ILE 25 16.824 15.477 13.421 184 HA ILE 25 HA ILE 25 15.249 14.148 11.393 185 HB ILE 25 HB ILE 25 15.987 17.091 11.513 186 HG12 ILE 25 HG12 ILE 25 14.506 15.689 13.523 187 HG13 ILE 25 HG13 ILE 25 14.891 17.401 13.388 188 HG21 ILE 25 HG21 ILE 25 13.926 17.426 10.210 189 HG22 ILE 25 HG22 ILE 25 15.029 16.354 9.393 190 HG23 ILE 25 HG23 ILE 25 13.627 15.669 10.220 191 HD11 ILE 25 HD13 ILE 25 12.814 17.756 12.108 192 HD12 ILE 25 HD11 ILE 25 12.462 16.005 12.241 193 HD13 ILE 25 HD12 ILE 25 12.513 17.021 13.695 194 H ASP 26 H ASP 26 18.237 16.133 11.390 195 HA ASP 26 HA ASP 26 18.604 16.284 8.621 196 HB2 ASP 26 HB2 ASP 26 19.845 17.463 10.595 197 HB3 ASP 26 HB3 ASP 26 20.949 16.094 10.540 198 H PHE 27 H PHE 27 20.001 13.878 10.903 199 HA PHE 27 HA PHE 27 21.190 12.217 8.923 200 HB2 PHE 27 HB2 PHE 27 20.357 11.857 11.821 201 HB3 PHE 27 HB3 PHE 27 20.855 10.472 10.877 202 HD1 PHE 27 HD1 PHE 27 23.090 11.069 9.323 203 HD2 PHE 27 HD2 PHE 27 22.179 12.584 13.284 204 HE1 PHE 27 HE1 PHE 27 25.500 11.377 9.775 205 HE2 PHE 27 HE2 PHE 27 24.587 12.834 13.718 206 HZ PHE 27 HZ PHE 27 26.258 12.253 11.976 207 H SER 28 H SER 28 17.777 12.494 10.014 208 HA SER 28 HA SER 28 17.113 9.913 8.840 209 HB2 SER 28 HB2 SER 28 15.300 12.179 9.744 210 HB3 SER 28 HB3 SER 28 14.798 10.540 9.296 211 HG SER 28 HG SER 28 16.415 11.355 11.482 212 H MET 29 H MET 29 17.616 13.101 7.550 213 HA MET 29 HA MET 29 16.117 12.311 5.082 214 HB2 MET 29 HB2 MET 29 16.535 15.132 6.044 215 HB3 MET 29 HB3 MET 29 15.416 14.502 4.820 216 HG2 MET 29 HG2 MET 29 14.647 13.258 7.235 217 HG3 MET 29 HG3 MET 29 15.023 14.929 7.640 218 HE1 MET 29 HE3 MET 29 13.109 12.527 5.461 219 HE2 MET 29 HE1 MET 29 12.201 12.787 6.988 220 HE3 MET 29 HE2 MET 29 11.477 13.269 5.432 221 H VAL 30 H VAL 30 19.308 13.260 6.166 222 HA VAL 30 HA VAL 30 20.203 14.760 4.041 223 HB VAL 30 HB VAL 30 21.474 14.341 6.080 224 HG11 VAL 30 HG11 VAL 30 22.784 12.307 6.445 225 HG12 VAL 30 HG12 VAL 30 21.067 11.900 6.370 226 HG13 VAL 30 HG13 VAL 30 22.118 11.569 4.975 227 HG21 VAL 30 HG23 VAL 30 23.704 14.236 5.134 228 HG22 VAL 30 HG21 VAL 30 23.083 13.507 3.637 229 HG23 VAL 30 HG22 VAL 30 22.644 15.174 4.067 230 H SER 31 H SER 31 19.807 11.169 4.019 231 HA SER 31 HA SER 31 21.150 10.819 1.566 232 HB2 SER 31 HB2 SER 31 18.797 9.195 2.638 233 HB3 SER 31 HB3 SER 31 20.072 8.644 1.537 234 HG SER 31 HG SER 31 20.558 7.979 3.598 235 H LEU 32 H LEU 32 17.742 11.690 2.304 236 HA LEU 32 HA LEU 32 16.826 11.535 -0.452 237 HB2 LEU 32 HB2 LEU 32 15.733 12.915 2.042 238 HB3 LEU 32 HB3 LEU 32 14.911 12.934 0.498 239 HG LEU 32 HG LEU 32 15.567 10.397 2.059 240 HD11 LEU 32 HD11 LEU 32 12.947 11.931 1.823 241 HD12 LEU 32 HD12 LEU 32 13.166 10.350 2.612 242 HD13 LEU 32 HD13 LEU 32 13.960 11.784 3.273 243 HD21 LEU 32 HD23 LEU 32 15.337 9.943 -0.354 244 HD22 LEU 32 HD21 LEU 32 13.941 9.333 0.518 245 HD23 LEU 32 HD22 LEU 32 13.800 10.843 -0.393 246 H LEU 33 H LEU 33 18.189 14.035 1.715 247 HA LEU 33 HA LEU 33 17.808 16.248 0.061 248 HB2 LEU 33 HB2 LEU 33 18.557 16.261 2.425 249 HB3 LEU 33 HB3 LEU 33 20.132 15.672 1.930 250 HG LEU 33 HG LEU 33 20.497 17.739 0.591 251 HD11 LEU 33 HD11 LEU 33 18.152 18.382 0.182 252 HD12 LEU 33 HD12 LEU 33 17.924 18.668 1.923 253 HD13 LEU 33 HD13 LEU 33 19.042 19.669 0.965 254 HD21 LEU 33 HD23 LEU 33 21.044 19.116 2.477 255 HD22 LEU 33 HD21 LEU 33 19.909 18.229 3.522 256 HD23 LEU 33 HD22 LEU 33 21.360 17.433 2.884 257 H ASP 34 H ASP 34 20.645 14.048 0.320 258 HA ASP 34 HA ASP 34 22.257 15.283 -1.638 259 HB2 ASP 34 HB2 ASP 34 23.102 13.720 0.077 260 HB3 ASP 34 HB3 ASP 34 22.178 12.396 -0.641 261 H LYS 35 H LYS 35 19.758 12.844 -1.927 262 HA LYS 35 HA LYS 35 20.275 12.225 -4.757 263 HB2 LYS 35 HB2 LYS 35 18.088 11.643 -2.754 264 HB3 LYS 35 HB3 LYS 35 18.018 11.036 -4.419 265 HG2 LYS 35 HG2 LYS 35 20.201 10.341 -2.414 266 HG3 LYS 35 HG3 LYS 35 18.748 9.382 -2.722 267 HD2 LYS 35 HD2 LYS 35 19.508 9.201 -5.148 268 HD3 LYS 35 HD3 LYS 35 21.038 9.979 -4.640 269 HE2 LYS 35 HE2 LYS 35 21.249 8.234 -2.841 270 HE3 LYS 35 HE3 LYS 35 19.784 7.468 -3.464 271 HZ1 LYS 35 HZ3 LYS 35 22.285 7.838 -5.043 272 HZ2 LYS 35 HZ1 LYS 35 21.912 6.436 -4.313 273 HZ3 LYS 35 HZ2 LYS 35 20.972 7.003 -5.533 274 H ASN 36 H ASN 36 19.100 14.956 -3.284 275 HA ASN 36 HA ASN 36 17.685 16.555 -3.656 276 HB2 ASN 36 HB2 ASN 36 17.810 15.873 -6.609 277 HB3 ASN 36 HB3 ASN 36 17.214 17.373 -5.913 278 HD21 ASN 36 HD22 ASN 36 20.069 15.395 -6.392 279 HD22 ASN 36 HD21 ASN 36 21.255 16.652 -6.109 280 H TYR 37 H TYR 37 16.426 14.046 -2.905 281 HA TYR 37 HA TYR 37 13.819 13.978 -4.272 282 HB2 TYR 37 HB2 TYR 37 14.966 12.734 -1.755 283 HB3 TYR 37 HB3 TYR 37 13.231 12.811 -1.989 284 HD1 TYR 37 HD1 TYR 37 12.163 11.758 -3.959 285 HD2 TYR 37 HD2 TYR 37 16.204 10.876 -2.802 286 HE1 TYR 37 HE1 TYR 37 12.228 9.882 -5.600 287 HE2 TYR 37 HE2 TYR 37 16.281 9.012 -4.405 288 HH TYR 37 HH TYR 37 15.126 7.820 -6.057 289 H ILE 38 H ILE 38 15.407 15.867 -1.850 290 HA ILE 38 HA ILE 38 13.009 17.580 -1.464 291 HB ILE 38 HB ILE 38 13.505 17.644 0.960 292 HG12 ILE 38 HG12 ILE 38 15.473 15.380 0.366 293 HG13 ILE 38 HG13 ILE 38 15.897 17.025 0.858 294 HG21 ILE 38 HG21 ILE 38 12.541 15.525 1.617 295 HG22 ILE 38 HG22 ILE 38 11.757 16.098 0.151 296 HG23 ILE 38 HG23 ILE 38 12.974 14.792 0.071 297 HD11 ILE 38 HD13 ILE 38 14.488 14.956 2.551 298 HD12 ILE 38 HD11 ILE 38 16.144 15.568 2.672 299 HD13 ILE 38 HD12 ILE 38 14.765 16.660 3.006 300 H SER 39 H SER 39 13.656 19.690 -0.384 301 HA SER 39 HA SER 39 16.382 20.590 -1.112 302 HB2 SER 39 HB2 SER 39 15.442 22.814 -0.748 303 HB3 SER 39 HB3 SER 39 14.391 21.896 -1.838 304 HG SER 39 HG SER 39 13.171 22.935 -0.266 305 H GLU 40 H GLU 40 17.361 22.149 0.625 306 HA GLU 40 HA GLU 40 17.527 20.858 3.210 307 HB2 GLU 40 HB2 GLU 40 18.397 23.627 2.268 308 HB3 GLU 40 HB3 GLU 40 18.774 22.927 3.849 309 HG2 GLU 40 HG2 GLU 40 19.946 21.036 2.708 310 HG3 GLU 40 HG3 GLU 40 19.665 21.812 1.153 311 H ASN 41 H ASN 41 15.538 23.484 1.847 312 HA ASN 41 HA ASN 41 14.584 24.577 4.310 313 HB2 ASN 41 HB2 ASN 41 14.241 25.710 2.132 314 HB3 ASN 41 HB3 ASN 41 13.191 24.395 1.590 315 HD21 ASN 41 HD22 ASN 41 10.988 24.194 2.542 316 HD22 ASN 41 HD21 ASN 41 10.344 25.529 3.457 317 H TYR 42 H TYR 42 13.426 21.850 2.288 318 HA TYR 42 HA TYR 42 11.045 21.258 3.641 319 HB2 TYR 42 HB2 TYR 42 11.869 20.223 1.534 320 HB3 TYR 42 HB3 TYR 42 13.109 19.378 2.437 321 HD1 TYR 42 HD1 TYR 42 9.476 19.627 1.843 322 HD2 TYR 42 HD2 TYR 42 12.626 17.386 3.738 323 HE1 TYR 42 HE1 TYR 42 7.967 17.641 2.013 324 HE2 TYR 42 HE2 TYR 42 11.140 15.421 3.933 325 HH TYR 42 HH TYR 42 9.114 14.478 3.272 326 H ILE 43 H ILE 43 14.368 20.066 4.331 327 HA ILE 43 HA ILE 43 13.767 18.505 6.588 328 HB ILE 43 HB ILE 43 16.332 19.979 5.996 329 HG12 ILE 43 HG12 ILE 43 15.227 17.240 5.202 330 HG13 ILE 43 HG13 ILE 43 15.537 18.591 4.101 331 HG21 ILE 43 HG21 ILE 43 16.011 19.005 8.359 332 HG22 ILE 43 HG22 ILE 43 15.872 17.417 7.588 333 HG23 ILE 43 HG23 ILE 43 17.376 18.354 7.447 334 HD11 ILE 43 HD13 ILE 43 17.245 17.017 3.879 335 HD12 ILE 43 HD11 ILE 43 17.915 18.495 4.618 336 HD13 ILE 43 HD12 ILE 43 17.616 17.038 5.612 337 H GLN 44 H GLN 44 14.788 21.986 6.354 338 HA GLN 44 HA GLN 44 14.765 22.271 9.177 339 HB2 GLN 44 HB2 GLN 44 16.032 23.672 7.389 340 HB3 GLN 44 HB3 GLN 44 14.557 24.630 7.298 341 HG2 GLN 44 HG2 GLN 44 16.144 25.649 8.877 342 HG3 GLN 44 HG3 GLN 44 14.734 25.086 9.760 343 HE21 GLN 44 HE22 GLN 44 15.342 24.155 11.745 344 HE22 GLN 44 HE21 GLN 44 16.728 23.123 11.976 345 H ALA 45 H ALA 45 12.140 22.651 6.838 346 HA ALA 45 HA ALA 45 10.289 24.004 8.492 347 HB1 ALA 45 HB3 ALA 45 9.900 23.408 6.071 348 HB2 ALA 45 HB1 ALA 45 9.656 21.710 6.565 349 HB3 ALA 45 HB2 ALA 45 8.551 22.955 7.135 350 H ILE 46 H ILE 46 11.291 20.558 8.410 351 HA ILE 46 HA ILE 46 9.260 19.657 10.249 352 HB ILE 46 HB ILE 46 11.948 18.383 9.605 353 HG12 ILE 46 HG12 ILE 46 9.341 17.824 8.171 354 HG13 ILE 46 HG13 ILE 46 10.558 18.887 7.519 355 HG21 ILE 46 HG21 ILE 46 10.956 16.339 10.337 356 HG22 ILE 46 HG22 ILE 46 10.581 17.527 11.585 357 HG23 ILE 46 HG23 ILE 46 9.328 17.058 10.421 358 HD11 ILE 46 HD13 ILE 46 11.000 15.946 8.083 359 HD12 ILE 46 HD11 ILE 46 10.846 16.739 6.500 360 HD13 ILE 46 HD12 ILE 46 12.234 17.100 7.544 361 H LYS 47 H LYS 47 12.793 20.406 10.470 362 HA LYS 47 HA LYS 47 13.041 19.839 13.211 363 HB2 LYS 47 HB2 LYS 47 14.464 21.854 11.440 364 HB3 LYS 47 HB3 LYS 47 15.016 21.486 13.075 365 HG2 LYS 47 HG2 LYS 47 15.690 19.268 12.456 366 HG3 LYS 47 HG3 LYS 47 14.871 19.369 10.885 367 HD2 LYS 47 HD2 LYS 47 16.359 21.118 10.152 368 HD3 LYS 47 HD3 LYS 47 17.160 21.188 11.736 369 HE2 LYS 47 HE2 LYS 47 18.190 19.042 11.384 370 HE3 LYS 47 HE3 LYS 47 17.243 18.747 9.929 371 HZ1 LYS 47 HZ3 LYS 47 18.399 20.742 8.961 372 HZ2 LYS 47 HZ1 LYS 47 19.352 20.809 10.278 373 HZ3 LYS 47 HZ2 LYS 47 19.423 19.510 9.281 374 H ASP 48 H ASP 48 12.201 22.958 11.596 375 HA ASP 48 HA ASP 48 12.094 24.544 13.936 376 HB2 ASP 48 HB2 ASP 48 12.223 25.493 11.693 377 HB3 ASP 48 HB3 ASP 48 10.649 24.808 11.272 378 H SER 49 H SER 49 9.461 22.760 12.206 379 HA SER 49 HA SER 49 7.369 23.516 14.017 380 HB2 SER 49 HB2 SER 49 7.628 20.986 12.342 381 HB3 SER 49 HB3 SER 49 6.135 21.685 12.997 382 HG SER 49 HG SER 49 7.832 22.657 10.945 383 H THR 50 H THR 50 9.754 20.870 14.029 384 HA THR 50 HA THR 50 8.667 19.403 16.179 385 HB THR 50 HB THR 50 11.497 19.592 15.107 386 HG1 THR 50 HG1 THR 50 10.083 18.851 13.610 387 HG21 THR 50 HG23 THR 50 11.750 17.322 16.080 388 HG22 THR 50 HG21 THR 50 11.652 18.602 17.307 389 HG23 THR 50 HG22 THR 50 10.241 17.571 16.986 390 H ILE 51 H ILE 51 11.150 22.042 16.136 391 HA ILE 51 HA ILE 51 11.491 22.125 18.973 392 HB ILE 51 HB ILE 51 11.922 24.166 16.759 393 HG12 ILE 51 HG12 ILE 51 13.982 22.615 18.398 394 HG13 ILE 51 HG13 ILE 51 13.328 21.991 16.894 395 HG21 ILE 51 HG21 ILE 51 13.297 25.477 18.369 396 HG22 ILE 51 HG22 ILE 51 11.612 25.439 18.847 397 HG23 ILE 51 HG23 ILE 51 12.785 24.394 19.679 398 HD11 ILE 51 HD13 ILE 51 14.938 24.555 17.187 399 HD12 ILE 51 HD11 ILE 51 15.427 23.042 16.423 400 HD13 ILE 51 HD12 ILE 51 14.143 24.015 15.685 401 H ASN 52 H ASN 52 9.271 23.907 16.770 402 HA ASN 52 HA ASN 52 8.304 25.672 18.803 403 HB2 ASN 52 HB2 ASN 52 7.394 24.938 16.004 404 HB3 ASN 52 HB3 ASN 52 6.320 25.860 17.031 405 HD21 ASN 52 HD22 ASN 52 9.545 25.938 15.517 406 HD22 ASN 52 HD21 ASN 52 9.739 27.672 15.615 407 H ASN 53 H ASN 53 7.139 22.508 17.698 408 HA ASN 53 HA ASN 53 4.856 22.673 19.640 409 HB2 ASN 53 HB2 ASN 53 4.301 23.314 17.276 410 HB3 ASN 53 HB3 ASN 53 4.781 21.713 16.737 411 HD21 ASN 53 HD22 ASN 53 2.229 22.989 16.432 412 HD22 ASN 53 HD21 ASN 53 1.039 22.007 17.259 413 H GLY 54 H GLY 54 6.490 20.414 17.335 414 HA2 GLY 54 HA2 GLY 54 7.683 18.629 18.945 415 HA3 GLY 54 HA3 GLY 54 5.995 18.094 19.056 416 HA PRO 55 HA PRO 55 8.332 16.405 15.166 417 HB2 PRO 55 HB2 PRO 55 7.182 13.955 16.550 418 HB3 PRO 55 HB3 PRO 55 8.606 14.058 15.460 419 HG2 PRO 55 HG2 PRO 55 8.992 14.040 18.124 420 HG3 PRO 55 HG3 PRO 55 9.869 15.229 17.119 421 HD2 PRO 55 HD2 PRO 55 7.395 15.678 18.810 422 HD3 PRO 55 HD3 PRO 55 8.845 16.710 18.621 423 H TYR 56 H TYR 56 7.238 16.175 13.286 424 HA TYR 56 HA TYR 56 4.640 16.970 12.992 425 HB2 TYR 56 HB2 TYR 56 6.694 15.785 11.258 426 HB3 TYR 56 HB3 TYR 56 5.090 15.321 10.757 427 HD1 TYR 56 HD2 TYR 56 7.311 18.239 11.356 428 HD2 TYR 56 HD1 TYR 56 3.568 16.856 9.720 429 HE1 TYR 56 HE2 TYR 56 7.070 20.369 10.099 430 HE2 TYR 56 HE1 TYR 56 3.303 18.990 8.494 431 HH TYR 56 HH TYR 56 5.769 21.609 8.672 432 H TYR 57 H TYR 57 5.678 13.565 13.475 433 HA TYR 57 HA TYR 57 2.991 12.829 14.168 434 HB2 TYR 57 HB2 TYR 57 4.412 11.281 11.969 435 HB3 TYR 57 HB3 TYR 57 2.902 10.840 12.725 436 HD1 TYR 57 HD1 TYR 57 0.802 12.130 12.252 437 HD2 TYR 57 HD2 TYR 57 4.496 12.904 10.168 438 HE1 TYR 57 HE1 TYR 57 -0.445 13.393 10.522 439 HE2 TYR 57 HE2 TYR 57 3.271 14.205 8.455 440 HH TYR 57 HH TYR 57 1.183 14.968 7.729 441 H ILE 58 H ILE 58 3.058 10.739 15.200 442 HA ILE 58 HA ILE 58 5.617 9.627 16.083 443 HB ILE 58 HB ILE 58 3.510 10.839 17.894 444 HG12 ILE 58 HG12 ILE 58 5.229 12.436 17.367 445 HG13 ILE 58 HG13 ILE 58 5.346 11.951 19.046 446 HG21 ILE 58 HG21 ILE 58 3.892 8.612 18.796 447 HG22 ILE 58 HG22 ILE 58 5.644 8.765 18.624 448 HG23 ILE 58 HG23 ILE 58 4.766 9.751 19.817 449 HD11 ILE 58 HD13 ILE 58 7.187 11.144 16.769 450 HD12 ILE 58 HD11 ILE 58 7.590 12.100 18.204 451 HD13 ILE 58 HD12 ILE 58 7.245 10.377 18.362 452 H LEU 59 H LEU 59 5.283 7.389 16.386 453 HA LEU 59 HA LEU 59 2.715 6.484 15.164 454 HB2 LEU 59 HB2 LEU 59 5.404 5.079 15.177 455 HB3 LEU 59 HB3 LEU 59 3.980 4.682 14.230 456 HG LEU 59 HG LEU 59 5.810 7.093 13.930 457 HD11 LEU 59 HD11 LEU 59 5.562 5.733 11.479 458 HD12 LEU 59 HD12 LEU 59 6.949 5.784 12.551 459 HD13 LEU 59 HD13 LEU 59 5.782 4.464 12.697 460 HD21 LEU 59 HD23 LEU 59 3.692 8.031 13.473 461 HD22 LEU 59 HD21 LEU 59 4.382 7.664 11.914 462 HD23 LEU 59 HD22 LEU 59 3.140 6.602 12.596 463 H ALA 60 H ALA 60 5.064 5.777 17.746 464 HA ALA 60 HA ALA 60 3.267 4.136 19.287 465 HB1 ALA 60 HB3 ALA 60 4.553 2.013 18.975 466 HB2 ALA 60 HB1 ALA 60 3.862 2.521 17.430 467 HB3 ALA 60 HB2 ALA 60 5.579 2.798 17.769 468 HA PRO 61 HA PRO 61 6.413 5.186 22.366 469 HB2 PRO 61 HB2 PRO 61 6.584 2.201 22.895 470 HB3 PRO 61 HB3 PRO 61 6.545 3.545 24.071 471 HG2 PRO 61 HG2 PRO 61 4.294 2.144 23.557 472 HG3 PRO 61 HG3 PRO 61 4.213 3.935 23.642 473 HD2 PRO 61 HD2 PRO 61 4.340 2.170 21.193 474 HD3 PRO 61 HD3 PRO 61 3.310 3.602 21.496 475 H GLY 62 H GLY 62 8.303 5.860 21.481 476 HA2 GLY 62 HA2 GLY 62 10.548 5.632 21.007 477 HA3 GLY 62 HA3 GLY 62 10.369 3.896 20.806 478 H VAL 63 H VAL 63 7.997 5.523 18.840 479 HA VAL 63 HA VAL 63 9.826 5.348 16.482 480 HB VAL 63 HB VAL 63 7.033 4.176 16.651 481 HG11 VAL 63 HG11 VAL 63 7.927 4.839 14.369 482 HG12 VAL 63 HG12 VAL 63 9.210 3.642 14.589 483 HG13 VAL 63 HG13 VAL 63 7.507 3.140 14.542 484 HG21 VAL 63 HG23 VAL 63 8.338 2.763 18.104 485 HG22 VAL 63 HG21 VAL 63 8.181 1.917 16.567 486 HG23 VAL 63 HG22 VAL 63 9.701 2.741 16.967 487 H ALA 64 H ALA 64 9.566 6.937 15.006 488 HA ALA 64 HA ALA 64 7.169 8.690 15.087 489 HB1 ALA 64 HB3 ALA 64 9.088 9.740 16.324 490 HB2 ALA 64 HB1 ALA 64 10.072 9.593 14.847 491 HB3 ALA 64 HB2 ALA 64 8.641 10.638 14.861 492 H MET 65 H MET 65 7.060 10.054 13.084 493 HA MET 65 HA MET 65 8.660 9.177 10.834 494 HB2 MET 65 HB2 MET 65 6.826 7.574 10.677 495 HB3 MET 65 HB3 MET 65 5.662 8.915 10.729 496 HG2 MET 65 HG2 MET 65 6.567 9.782 8.597 497 HG3 MET 65 HG3 MET 65 7.756 8.482 8.574 498 HE1 MET 65 HE3 MET 65 4.038 7.572 9.754 499 HE2 MET 65 HE1 MET 65 3.892 9.137 8.902 500 HE3 MET 65 HE2 MET 65 3.227 7.640 8.178 501 HA PRO 66 HA PRO 66 7.760 13.618 11.484 502 HB2 PRO 66 HB2 PRO 66 10.507 13.877 10.207 503 HB3 PRO 66 HB3 PRO 66 9.784 14.760 11.597 504 HG2 PRO 66 HG2 PRO 66 11.537 12.749 11.997 505 HG3 PRO 66 HG3 PRO 66 10.063 12.870 13.017 506 HD2 PRO 66 HD2 PRO 66 10.511 11.133 10.570 507 HD3 PRO 66 HD3 PRO 66 9.852 10.678 12.167 508 H HIS 67 H HIS 67 9.774 13.763 8.611 509 HA HIS 67 HA HIS 67 9.564 14.840 6.735 510 HB2 HIS 67 HB2 HIS 67 8.616 13.853 5.102 511 HB3 HIS 67 HB3 HIS 67 8.489 12.537 6.247 512 HD1 HIS 67 HD1 HIS 67 5.732 13.233 7.587 513 HD2 HIS 67 HD2 HIS 67 6.626 13.660 3.473 514 HE1 HIS 67 HE1 HIS 67 3.504 13.030 6.319 515 H ALA 68 H ALA 68 7.802 16.023 5.097 516 HA ALA 68 HA ALA 68 6.245 17.976 6.694 517 HB1 ALA 68 HB3 ALA 68 8.409 19.055 6.500 518 HB2 ALA 68 HB1 ALA 68 8.465 18.724 4.759 519 HB3 ALA 68 HB2 ALA 68 7.252 19.830 5.431 520 H ARG 69 H ARG 69 4.966 19.338 5.079 521 HA ARG 69 HA ARG 69 3.523 17.632 3.263 522 HB2 ARG 69 HB2 ARG 69 3.649 20.626 3.761 523 HB3 ARG 69 HB3 ARG 69 2.594 19.945 2.517 524 HG2 ARG 69 HG2 ARG 69 1.221 18.829 4.042 525 HG3 ARG 69 HG3 ARG 69 2.417 18.846 5.338 526 HD2 ARG 69 HD2 ARG 69 1.067 21.358 4.278 527 HD3 ARG 69 HD3 ARG 69 0.480 20.425 5.652 528 HE ARG 69 HE ARG 69 2.555 20.843 6.834 529 HH11 ARG 69 HH11 ARG 69 1.912 23.096 4.110 530 HH12 ARG 69 HH12 ARG 69 2.863 24.356 4.821 531 HH21 ARG 69 HH21 ARG 69 3.938 22.431 7.599 532 HH22 ARG 69 HH22 ARG 69 4.034 23.978 6.835 533 HA PRO 70 HA PRO 70 6.003 17.671 -0.439 534 HB2 PRO 70 HB2 PRO 70 3.443 18.769 -1.699 535 HB3 PRO 70 HB3 PRO 70 4.570 17.576 -2.381 536 HG2 PRO 70 HG2 PRO 70 2.316 16.747 -1.155 537 HG3 PRO 70 HG3 PRO 70 3.856 15.914 -0.769 538 HD2 PRO 70 HD2 PRO 70 2.383 18.002 0.837 539 HD3 PRO 70 HD3 PRO 70 3.261 16.545 1.393 540 H GLU 71 H GLU 71 3.808 20.497 -0.075 541 HA GLU 71 HA GLU 71 5.147 22.321 -1.697 542 HB2 GLU 71 HB2 GLU 71 3.706 23.968 -0.724 543 HB3 GLU 71 HB3 GLU 71 2.803 22.455 -0.845 544 HG2 GLU 71 HG2 GLU 71 3.387 22.032 1.604 545 HG3 GLU 71 HG3 GLU 71 4.038 23.667 1.672 546 H CYS 72 H CYS 72 6.279 21.151 1.345 547 HA CYS 72 HA CYS 72 7.578 23.648 2.172 548 HB2 CYS 72 HB2 CYS 72 7.790 20.799 3.241 549 HB3 CYS 72 HB3 CYS 72 8.504 22.240 3.985 550 HG CYS 72 HG CYS 72 6.261 23.556 4.292 551 H GLY 73 H GLY 73 8.253 21.389 -0.252 552 HA2 GLY 73 HA2 GLY 73 10.275 22.222 -1.485 553 HA3 GLY 73 HA3 GLY 73 11.196 21.909 -0.015 554 H ALA 74 H ALA 74 8.651 19.590 -0.882 555 HA ALA 74 HA ALA 74 10.655 17.489 -1.375 556 HB1 ALA 74 HB3 ALA 74 8.424 16.951 -0.418 557 HB2 ALA 74 HB1 ALA 74 7.677 17.553 -1.925 558 HB3 ALA 74 HB2 ALA 74 8.733 16.127 -1.964 559 H LEU 75 H LEU 75 11.241 16.723 -3.374 560 HA LEU 75 HA LEU 75 10.584 18.438 -5.744 561 HB2 LEU 75 HB2 LEU 75 13.190 17.072 -5.021 562 HB3 LEU 75 HB3 LEU 75 12.911 18.051 -6.454 563 HG LEU 75 HG LEU 75 12.904 19.054 -3.573 564 HD11 LEU 75 HD11 LEU 75 15.135 18.403 -4.348 565 HD12 LEU 75 HD12 LEU 75 14.956 19.429 -5.786 566 HD13 LEU 75 HD13 LEU 75 15.012 20.157 -4.163 567 HD21 LEU 75 HD23 LEU 75 12.885 21.324 -4.570 568 HD22 LEU 75 HD21 LEU 75 12.687 20.615 -6.189 569 HD23 LEU 75 HD22 LEU 75 11.411 20.440 -4.964 570 H LYS 76 H LYS 76 11.212 15.187 -4.477 571 HA LYS 76 HA LYS 76 9.899 13.984 -6.794 572 HB2 LYS 76 HB2 LYS 76 12.609 13.161 -5.694 573 HB3 LYS 76 HB3 LYS 76 11.676 12.204 -6.848 574 HG2 LYS 76 HG2 LYS 76 11.871 14.081 -8.483 575 HG3 LYS 76 HG3 LYS 76 12.885 14.967 -7.331 576 HD2 LYS 76 HD2 LYS 76 13.581 12.208 -8.417 577 HD3 LYS 76 HD3 LYS 76 14.128 13.724 -9.144 578 HE2 LYS 76 HE2 LYS 76 15.326 14.353 -7.089 579 HE3 LYS 76 HE3 LYS 76 14.731 12.906 -6.264 580 HZ1 LYS 76 HZ3 LYS 76 16.975 12.652 -7.079 581 HZ2 LYS 76 HZ1 LYS 76 15.997 11.566 -7.825 582 HZ3 LYS 76 HZ2 LYS 76 16.512 12.898 -8.629 583 H THR 77 H THR 77 9.333 11.574 -6.106 584 HA THR 77 HA THR 77 8.571 11.626 -3.308 585 HB THR 77 HB THR 77 7.618 10.124 -5.758 586 HG1 THR 77 HG1 THR 77 6.127 11.554 -5.876 587 HG21 THR 77 HG23 THR 77 7.246 8.761 -3.776 588 HG22 THR 77 HG21 THR 77 6.489 10.140 -2.941 589 HG23 THR 77 HG22 THR 77 5.721 9.413 -4.384 590 H GLY 78 H GLY 78 9.585 10.337 -1.788 591 HA2 GLY 78 HA2 GLY 78 10.728 7.746 -2.341 592 HA3 GLY 78 HA3 GLY 78 11.964 9.003 -2.169 593 H MET 79 H MET 79 12.286 7.273 -0.199 594 HA MET 79 HA MET 79 11.035 8.377 2.256 595 HB2 MET 79 HB2 MET 79 10.913 5.514 1.226 596 HB3 MET 79 HB3 MET 79 10.713 5.893 2.933 597 HG2 MET 79 HG2 MET 79 8.760 7.208 2.550 598 HG3 MET 79 HG3 MET 79 8.946 7.096 0.800 599 HE1 MET 79 HE3 MET 79 6.800 6.325 0.222 600 HE2 MET 79 HE1 MET 79 5.958 4.868 0.782 601 HE3 MET 79 HE2 MET 79 6.113 6.282 1.854 602 H SER 80 H SER 80 11.969 7.276 4.255 603 HA SER 80 HA SER 80 14.610 6.134 3.949 604 HB2 SER 80 HB2 SER 80 15.555 7.820 5.642 605 HB3 SER 80 HB3 SER 80 15.375 8.362 3.972 606 HG SER 80 HG SER 80 14.644 9.765 5.762 607 H LEU 81 H LEU 81 15.446 5.530 6.234 608 HA LEU 81 HA LEU 81 13.360 4.854 8.164 609 HB2 LEU 81 HB2 LEU 81 13.103 3.118 6.464 610 HB3 LEU 81 HB3 LEU 81 14.842 2.848 6.379 611 HG LEU 81 HG LEU 81 14.845 1.845 8.552 612 HD11 LEU 81 HD11 LEU 81 13.081 3.153 9.680 613 HD12 LEU 81 HD12 LEU 81 11.866 2.260 8.718 614 HD13 LEU 81 HD13 LEU 81 12.886 1.424 9.892 615 HD21 LEU 81 HD23 LEU 81 13.708 -0.181 7.866 616 HD22 LEU 81 HD21 LEU 81 12.478 0.748 7.000 617 HD23 LEU 81 HD22 LEU 81 14.113 0.677 6.346 618 H THR 82 H THR 82 14.491 5.643 9.921 619 HA THR 82 HA THR 82 17.435 5.163 10.086 620 HB THR 82 HB THR 82 15.718 7.486 11.070 621 HG1 THR 82 HG1 THR 82 15.879 7.484 8.848 622 HG21 THR 82 HG23 THR 82 18.742 7.086 11.053 623 HG22 THR 82 HG21 THR 82 17.910 8.629 11.384 624 HG23 THR 82 HG22 THR 82 17.668 7.251 12.467 625 H LEU 83 H LEU 83 18.250 4.430 12.084 626 HA LEU 83 HA LEU 83 16.327 4.128 14.313 627 HB2 LEU 83 HB2 LEU 83 16.617 2.014 12.898 628 HB3 LEU 83 HB3 LEU 83 18.255 1.918 13.523 629 HG LEU 83 HG LEU 83 15.764 2.063 15.297 630 HD11 LEU 83 HD11 LEU 83 16.033 -0.417 15.514 631 HD12 LEU 83 HD12 LEU 83 15.445 0.125 13.951 632 HD13 LEU 83 HD13 LEU 83 17.154 -0.361 14.145 633 HD21 LEU 83 HD23 LEU 83 17.604 2.516 16.682 634 HD22 LEU 83 HD21 LEU 83 17.307 0.817 16.924 635 HD23 LEU 83 HD22 LEU 83 18.651 1.317 15.871 636 H LEU 84 H LEU 84 17.206 4.740 16.236 637 HA LEU 84 HA LEU 84 20.095 5.508 16.345 638 HB2 LEU 84 HB2 LEU 84 17.589 6.764 17.478 639 HB3 LEU 84 HB3 LEU 84 19.118 6.889 18.348 640 HG LEU 84 HG LEU 84 20.198 8.001 16.519 641 HD11 LEU 84 HD11 LEU 84 18.951 7.136 14.562 642 HD12 LEU 84 HD12 LEU 84 17.506 7.994 15.109 643 HD13 LEU 84 HD13 LEU 84 18.955 8.897 14.593 644 HD21 LEU 84 HD23 LEU 84 18.915 10.126 16.695 645 HD22 LEU 84 HD21 LEU 84 17.568 9.230 17.415 646 HD23 LEU 84 HD22 LEU 84 19.143 9.304 18.245 647 H GLU 85 H GLU 85 21.226 4.085 17.644 648 HA GLU 85 HA GLU 85 19.954 2.064 19.150 649 HB2 GLU 85 HB2 GLU 85 22.802 3.111 19.381 650 HB3 GLU 85 HB3 GLU 85 22.206 1.614 20.097 651 HG2 GLU 85 HG2 GLU 85 21.599 0.798 17.799 652 HG3 GLU 85 HG3 GLU 85 22.391 2.221 17.120 653 H GLN 86 H GLN 86 21.233 5.189 20.178 654 HA GLN 86 HA GLN 86 20.515 4.757 23.003 655 HB2 GLN 86 HB2 GLN 86 21.565 7.168 21.472 656 HB3 GLN 86 HB3 GLN 86 21.338 7.151 23.204 657 HG2 GLN 86 HG2 GLN 86 23.163 5.180 21.755 658 HG3 GLN 86 HG3 GLN 86 23.715 6.708 22.426 659 HE21 GLN 86 HE22 GLN 86 25.070 4.651 23.327 660 HE22 GLN 86 HE21 GLN 86 24.594 4.188 24.952 661 H GLY 87 H GLY 87 18.966 5.929 20.150 662 HA2 GLY 87 HA2 GLY 87 17.036 7.072 19.734 663 HA3 GLY 87 HA3 GLY 87 16.601 6.969 21.450 664 H VAL 88 H VAL 88 15.901 9.301 20.446 665 HA VAL 88 HA VAL 88 17.645 11.059 21.969 666 HB VAL 88 HB VAL 88 18.069 11.148 19.277 667 HG11 VAL 88 HG11 VAL 88 15.753 11.764 18.757 668 HG12 VAL 88 HG12 VAL 88 15.978 13.300 19.635 669 HG13 VAL 88 HG13 VAL 88 16.958 12.940 18.207 670 HG21 VAL 88 HG23 VAL 88 18.237 13.471 21.178 671 HG22 VAL 88 HG21 VAL 88 19.434 12.184 20.899 672 HG23 VAL 88 HG22 VAL 88 19.051 13.327 19.600 673 H TYR 89 H TYR 89 16.355 13.160 22.442 674 HA TYR 89 HA TYR 89 13.531 12.309 22.848 675 HB2 TYR 89 HB2 TYR 89 15.154 12.110 24.806 676 HB3 TYR 89 HB3 TYR 89 15.118 13.854 24.891 677 HD1 TYR 89 HD2 TYR 89 11.779 13.232 23.855 678 HD2 TYR 89 HD1 TYR 89 14.458 12.528 27.211 679 HE1 TYR 89 HE2 TYR 89 9.865 12.934 25.346 680 HE2 TYR 89 HE1 TYR 89 12.509 12.264 28.704 681 HH TYR 89 HH TYR 89 9.134 12.314 27.518 682 H PHE 90 H PHE 90 12.853 13.435 21.086 683 HA PHE 90 HA PHE 90 13.174 16.123 20.403 684 HB2 PHE 90 HB2 PHE 90 10.949 14.095 20.288 685 HB3 PHE 90 HB3 PHE 90 10.796 15.685 19.516 686 HD1 PHE 90 HD1 PHE 90 12.758 16.386 17.924 687 HD2 PHE 90 HD2 PHE 90 11.886 12.307 18.994 688 HE1 PHE 90 HE1 PHE 90 13.969 15.604 15.905 689 HE2 PHE 90 HE2 PHE 90 13.115 11.524 16.987 690 HZ PHE 90 HZ PHE 90 14.162 13.180 15.438 691 HA PRO 91 HA PRO 91 10.768 18.195 23.656 692 HB2 PRO 91 HB2 PRO 91 10.221 20.570 22.410 693 HB3 PRO 91 HB3 PRO 91 11.838 20.163 23.065 694 HG2 PRO 91 HG2 PRO 91 10.859 19.898 20.216 695 HG3 PRO 91 HG3 PRO 91 12.391 20.637 20.790 696 HD2 PRO 91 HD2 PRO 91 12.237 18.079 19.845 697 HD3 PRO 91 HD3 PRO 91 13.352 18.517 21.173 698 H GLY 92 H GLY 92 8.513 18.563 24.026 699 HA2 GLY 92 HA2 GLY 92 6.257 18.718 23.627 700 HA3 GLY 92 HA3 GLY 92 6.565 18.658 21.885 701 H ASN 93 H ASN 93 7.917 16.297 21.618 702 HA ASN 93 HA ASN 93 6.078 14.176 21.632 703 HB2 ASN 93 HB2 ASN 93 7.795 13.844 20.152 704 HB3 ASN 93 HB3 ASN 93 8.976 14.680 21.162 705 HD21 ASN 93 HD22 ASN 93 7.226 11.564 20.837 706 HD22 ASN 93 HD21 ASN 93 8.493 10.653 21.679 707 H ASP 94 H ASP 94 5.708 12.467 23.037 708 HA ASP 94 HA ASP 94 5.932 13.182 25.779 709 HB2 ASP 94 HB2 ASP 94 3.975 12.042 24.824 710 HB3 ASP 94 HB3 ASP 94 4.954 10.603 24.514 711 H GLU 95 H GLU 95 7.544 10.609 23.913 712 HA GLU 95 HA GLU 95 9.532 10.291 26.059 713 HB2 GLU 95 HB2 GLU 95 9.042 8.120 26.537 714 HB3 GLU 95 HB3 GLU 95 7.430 8.715 26.161 715 HG2 GLU 95 HG2 GLU 95 7.643 7.759 23.854 716 HG3 GLU 95 HG3 GLU 95 9.225 7.101 24.304 717 HA PRO 96 HA PRO 96 12.328 10.428 22.854 718 HB2 PRO 96 HB2 PRO 96 14.359 8.644 23.438 719 HB3 PRO 96 HB3 PRO 96 14.061 10.160 24.335 720 HG2 PRO 96 HG2 PRO 96 13.143 7.371 25.040 721 HG3 PRO 96 HG3 PRO 96 13.925 8.582 26.107 722 HD2 PRO 96 HD2 PRO 96 11.228 8.237 26.080 723 HD3 PRO 96 HD3 PRO 96 11.935 9.877 26.243 724 H ILE 97 H ILE 97 13.262 9.512 20.968 725 HA ILE 97 HA ILE 97 11.653 7.216 19.940 726 HB ILE 97 HB ILE 97 12.722 9.711 18.562 727 HG12 ILE 97 HG12 ILE 97 10.832 10.303 19.957 728 HG13 ILE 97 HG13 ILE 97 10.346 10.341 18.276 729 HG21 ILE 97 HG21 ILE 97 11.083 7.426 17.389 730 HG22 ILE 97 HG22 ILE 97 11.467 8.954 16.580 731 HG23 ILE 97 HG23 ILE 97 12.754 7.833 16.969 732 HD11 ILE 97 HD13 ILE 97 9.153 8.193 18.542 733 HD12 ILE 97 HD11 ILE 97 9.697 8.079 20.235 734 HD13 ILE 97 HD12 ILE 97 8.613 9.364 19.753 735 H LYS 98 H LYS 98 12.640 5.606 18.976 736 HA LYS 98 HA LYS 98 15.592 5.714 18.579 737 HB2 LYS 98 HB2 LYS 98 13.866 3.259 19.098 738 HB3 LYS 98 HB3 LYS 98 15.622 3.329 18.931 739 HG2 LYS 98 HG2 LYS 98 15.569 4.930 20.988 740 HG3 LYS 98 HG3 LYS 98 13.887 4.429 21.185 741 HD2 LYS 98 HD2 LYS 98 15.195 3.085 22.646 742 HD3 LYS 98 HD3 LYS 98 14.700 2.023 21.313 743 HE2 LYS 98 HE2 LYS 98 16.909 2.289 20.244 744 HE3 LYS 98 HE3 LYS 98 17.362 3.515 21.425 745 HZ1 LYS 98 HZ3 LYS 98 17.190 1.755 23.148 746 HZ2 LYS 98 HZ1 LYS 98 16.996 0.633 21.965 747 HZ3 LYS 98 HZ2 LYS 98 18.375 1.534 22.052 748 H LEU 99 H LEU 99 12.540 5.596 16.929 749 HA LEU 99 HA LEU 99 14.001 4.805 14.482 750 HB2 LEU 99 HB2 LEU 99 11.450 3.670 15.644 751 HB3 LEU 99 HB3 LEU 99 11.477 3.902 13.907 752 HG LEU 99 HG LEU 99 13.505 2.213 15.380 753 HD11 LEU 99 HD11 LEU 99 11.103 1.322 13.730 754 HD12 LEU 99 HD12 LEU 99 12.228 0.317 14.690 755 HD13 LEU 99 HD13 LEU 99 11.102 1.411 15.497 756 HD21 LEU 99 HD23 LEU 99 13.825 1.271 13.000 757 HD22 LEU 99 HD21 LEU 99 12.887 2.656 12.416 758 HD23 LEU 99 HD22 LEU 99 14.421 2.898 13.263 759 H LEU 100 H LEU 100 13.554 5.882 12.699 760 HA LEU 100 HA LEU 100 11.325 7.858 12.729 761 HB2 LEU 100 HB2 LEU 100 14.082 8.668 11.754 762 HB3 LEU 100 HB3 LEU 100 12.641 9.633 11.942 763 HG LEU 100 HG LEU 100 12.940 8.858 14.506 764 HD11 LEU 100 HD11 LEU 100 15.267 8.850 15.200 765 HD12 LEU 100 HD12 LEU 100 15.023 7.532 14.045 766 HD13 LEU 100 HD13 LEU 100 15.810 9.031 13.516 767 HD21 LEU 100 HD23 LEU 100 12.779 11.184 13.822 768 HD22 LEU 100 HD21 LEU 100 14.128 10.965 14.952 769 HD23 LEU 100 HD22 LEU 100 14.453 11.156 13.220 770 H ILE 101 H ILE 101 10.095 6.894 11.144 771 HA ILE 101 HA ILE 101 11.389 6.070 8.601 772 HB ILE 101 HB ILE 101 8.442 5.900 9.578 773 HG12 ILE 101 HG12 ILE 101 8.855 3.537 9.035 774 HG13 ILE 101 HG13 ILE 101 10.483 3.905 8.437 775 HG21 ILE 101 HG21 ILE 101 8.460 6.734 7.253 776 HG22 ILE 101 HG22 ILE 101 9.504 5.376 6.778 777 HG23 ILE 101 HG23 ILE 101 7.867 5.088 7.434 778 HD11 ILE 101 HD13 ILE 101 9.708 4.308 11.338 779 HD12 ILE 101 HD11 ILE 101 10.373 2.794 10.684 780 HD13 ILE 101 HD12 ILE 101 11.339 4.266 10.594 781 H GLY 102 H GLY 102 11.214 7.285 6.705 782 HA2 GLY 102 HA2 GLY 102 10.289 10.107 7.021 783 HA3 GLY 102 HA3 GLY 102 11.893 9.746 6.373 784 H LEU 103 H LEU 103 9.968 11.127 4.907 785 HA LEU 103 HA LEU 103 9.356 9.431 2.615 786 HB2 LEU 103 HB2 LEU 103 7.493 9.210 4.440 787 HB3 LEU 103 HB3 LEU 103 7.126 10.879 4.055 788 HG LEU 103 HG LEU 103 6.810 8.390 2.260 789 HD11 LEU 103 HD11 LEU 103 4.455 9.014 2.514 790 HD12 LEU 103 HD12 LEU 103 5.153 9.019 4.137 791 HD13 LEU 103 HD13 LEU 103 4.870 10.542 3.301 792 HD21 LEU 103 HD23 LEU 103 5.612 10.178 0.751 793 HD22 LEU 103 HD21 LEU 103 6.618 11.351 1.555 794 HD23 LEU 103 HD22 LEU 103 7.347 9.968 0.648 795 H SER 104 H SER 104 9.042 10.824 0.810 796 HA SER 104 HA SER 104 8.806 13.714 1.110 797 HB2 SER 104 HB2 SER 104 10.629 13.987 -0.654 798 HB3 SER 104 HB3 SER 104 11.172 13.564 0.985 799 HG SER 104 HG SER 104 11.122 11.322 0.203 800 H ALA 105 H ALA 105 7.524 14.482 -0.693 801 HA ALA 105 HA ALA 105 6.773 12.497 -2.735 802 HB1 ALA 105 HB3 ALA 105 4.865 13.650 -0.662 803 HB2 ALA 105 HB1 ALA 105 4.362 12.853 -2.164 804 HB3 ALA 105 HB2 ALA 105 5.249 11.929 -0.932 805 H ALA 106 H ALA 106 6.381 13.522 -4.620 806 HA ALA 106 HA ALA 106 6.897 16.348 -4.684 807 HB1 ALA 106 HB3 ALA 106 6.083 14.418 -6.914 808 HB2 ALA 106 HB1 ALA 106 6.728 16.057 -7.146 809 HB3 ALA 106 HB2 ALA 106 7.751 14.802 -6.423 810 H ASP 107 H ASP 107 4.002 14.374 -4.637 811 HA ASP 107 HA ASP 107 2.326 16.839 -4.820 812 HB2 ASP 107 HB2 ASP 107 2.275 15.790 -7.047 813 HB3 ASP 107 HB3 ASP 107 1.810 14.248 -6.329 814 H ALA 108 H ALA 108 0.232 16.609 -3.763 815 HA ALA 108 HA ALA 108 0.417 15.376 -1.252 816 HB1 ALA 108 HB3 ALA 108 -2.063 16.344 -2.730 817 HB2 ALA 108 HB1 ALA 108 -1.945 16.020 -0.989 818 HB3 ALA 108 HB2 ALA 108 -0.996 17.338 -1.705 819 H ASP 109 H ASP 109 -1.008 14.097 -4.272 820 HA ASP 109 HA ASP 109 -2.258 11.840 -2.864 821 HB2 ASP 109 HB2 ASP 109 -3.286 12.635 -4.867 822 HB3 ASP 109 HB3 ASP 109 -1.785 12.396 -5.794 823 H SER 110 H SER 110 0.810 12.496 -4.538 824 HA SER 110 HA SER 110 1.819 9.807 -4.455 825 HB2 SER 110 HB2 SER 110 3.475 12.362 -4.191 826 HB3 SER 110 HB3 SER 110 3.996 10.787 -4.767 827 HG SER 110 HG SER 110 2.628 11.039 -6.566 828 H HIS 111 H HIS 111 1.821 12.526 -2.113 829 HA HIS 111 HA HIS 111 3.166 11.255 0.031 830 HB2 HIS 111 HB2 HIS 111 2.888 13.448 0.537 831 HB3 HIS 111 HB3 HIS 111 1.405 13.575 -0.389 832 HD1 HIS 111 HD1 HIS 111 -0.843 13.492 0.852 833 HD2 HIS 111 HD2 HIS 111 2.531 12.602 3.200 834 HE1 HIS 111 HE1 HIS 111 -1.644 13.474 3.287 835 H ILE 112 H ILE 112 -0.357 11.280 -0.760 836 HA ILE 112 HA ILE 112 -1.164 9.722 1.467 837 HB ILE 112 HB ILE 112 -2.280 10.146 -1.336 838 HG12 ILE 112 HG12 ILE 112 -2.297 12.083 0.274 839 HG13 ILE 112 HG13 ILE 112 -3.852 11.628 -0.392 840 HG21 ILE 112 HG21 ILE 112 -3.550 8.542 0.877 841 HG22 ILE 112 HG22 ILE 112 -4.436 9.223 -0.520 842 HG23 ILE 112 HG23 ILE 112 -3.158 8.032 -0.784 843 HD11 ILE 112 HD13 ILE 112 -2.853 10.865 2.381 844 HD12 ILE 112 HD11 ILE 112 -3.926 12.232 1.993 845 HD13 ILE 112 HD12 ILE 112 -4.480 10.570 1.715 846 H GLY 113 H GLY 113 -0.345 8.604 -1.894 847 HA2 GLY 113 HA2 GLY 113 -0.737 5.852 -1.326 848 HA3 GLY 113 HA3 GLY 113 0.260 6.517 -2.640 849 H ALA 114 H ALA 114 2.124 7.945 -0.980 850 HA ALA 114 HA ALA 114 4.048 5.914 -0.367 851 HB1 ALA 114 HB3 ALA 114 5.317 7.915 0.478 852 HB2 ALA 114 HB1 ALA 114 4.668 8.160 -1.144 853 HB3 ALA 114 HB2 ALA 114 3.872 8.897 0.254 854 H ILE 115 H ILE 115 2.069 8.110 1.766 855 HA ILE 115 HA ILE 115 2.992 7.173 4.222 856 HB ILE 115 HB ILE 115 0.588 8.450 3.146 857 HG12 ILE 115 HG12 ILE 115 2.539 9.843 3.680 858 HG13 ILE 115 HG13 ILE 115 1.110 10.321 4.567 859 HG21 ILE 115 HG21 ILE 115 0.548 7.377 5.927 860 HG22 ILE 115 HG22 ILE 115 -0.494 8.717 5.339 861 HG23 ILE 115 HG23 ILE 115 -0.601 7.136 4.581 862 HD11 ILE 115 HD13 ILE 115 1.945 9.255 6.616 863 HD12 ILE 115 HD11 ILE 115 3.383 8.669 5.753 864 HD13 ILE 115 HD12 ILE 115 3.127 10.405 5.976 865 H GLN 116 H GLN 116 0.315 6.044 2.091 866 HA GLN 116 HA GLN 116 -0.497 3.938 3.838 867 HB2 GLN 116 HB2 GLN 116 -1.068 4.596 0.933 868 HB3 GLN 116 HB3 GLN 116 -1.840 3.239 1.766 869 HG2 GLN 116 HG2 GLN 116 -1.935 6.039 2.931 870 HG3 GLN 116 HG3 GLN 116 -3.039 5.541 1.660 871 HE21 GLN 116 HE22 GLN 116 -1.919 4.399 4.999 872 HE22 GLN 116 HE21 GLN 116 -3.495 3.805 5.415 873 H ALA 117 H ALA 117 2.350 4.049 1.980 874 HA ALA 117 HA ALA 117 2.410 1.135 1.696 875 HB1 ALA 117 HB3 ALA 117 4.606 1.492 0.615 876 HB2 ALA 117 HB1 ALA 117 3.380 2.482 -0.197 877 HB3 ALA 117 HB2 ALA 117 4.507 3.227 0.948 878 H LEU 118 H LEU 118 3.728 3.935 3.457 879 HA LEU 118 HA LEU 118 5.451 2.377 5.104 880 HB2 LEU 118 HB2 LEU 118 4.197 5.140 5.502 881 HB3 LEU 118 HB3 LEU 118 5.460 4.446 6.537 882 HG LEU 118 HG LEU 118 5.688 4.808 3.531 883 HD11 LEU 118 HD11 LEU 118 5.440 6.960 4.685 884 HD12 LEU 118 HD12 LEU 118 6.807 6.571 5.738 885 HD13 LEU 118 HD13 LEU 118 7.069 6.772 4.004 886 HD21 LEU 118 HD23 LEU 118 8.248 4.721 4.466 887 HD22 LEU 118 HD21 LEU 118 7.494 3.726 5.714 888 HD23 LEU 118 HD22 LEU 118 7.352 3.259 4.015 889 H SER 119 H SER 119 1.976 3.334 5.427 890 HA SER 119 HA SER 119 1.481 2.314 7.908 891 HB2 SER 119 HB2 SER 119 -0.261 1.776 5.472 892 HB3 SER 119 HB3 SER 119 -0.798 1.878 7.154 893 HG SER 119 HG SER 119 -0.171 4.092 7.131 894 H GLU 120 H GLU 120 2.448 0.288 5.160 895 HA GLU 120 HA GLU 120 1.344 -2.147 6.193 896 HB2 GLU 120 HB2 GLU 120 3.669 -1.722 4.308 897 HB3 GLU 120 HB3 GLU 120 2.868 -3.258 4.586 898 HG2 GLU 120 HG2 GLU 120 1.413 -0.805 3.530 899 HG3 GLU 120 HG3 GLU 120 2.165 -1.997 2.480 900 H LEU 121 H LEU 121 4.119 -0.225 6.904 901 HA LEU 121 HA LEU 121 5.433 -2.402 8.499 902 HB2 LEU 121 HB2 LEU 121 6.536 0.259 7.480 903 HB3 LEU 121 HB3 LEU 121 7.436 -0.927 8.414 904 HG LEU 121 HG LEU 121 6.394 -1.169 5.562 905 HD11 LEU 121 HD11 LEU 121 8.457 0.117 5.848 906 HD12 LEU 121 HD12 LEU 121 9.196 -1.215 6.763 907 HD13 LEU 121 HD13 LEU 121 8.812 -1.421 5.044 908 HD21 LEU 121 HD23 LEU 121 7.803 -3.380 7.111 909 HD22 LEU 121 HD21 LEU 121 6.107 -3.401 6.573 910 HD23 LEU 121 HD22 LEU 121 7.410 -3.386 5.388 911 H LEU 122 H LEU 122 5.002 1.147 8.649 912 HA LEU 122 HA LEU 122 5.299 1.640 11.365 913 HB2 LEU 122 HB2 LEU 122 5.242 3.588 10.627 914 HB3 LEU 122 HB3 LEU 122 4.936 2.978 9.042 915 HG LEU 122 HG LEU 122 2.458 3.218 9.459 916 HD11 LEU 122 HD11 LEU 122 2.042 3.412 11.750 917 HD12 LEU 122 HD12 LEU 122 3.527 4.301 12.038 918 HD13 LEU 122 HD13 LEU 122 2.099 5.101 11.296 919 HD21 LEU 122 HD23 LEU 122 4.509 5.456 9.468 920 HD22 LEU 122 HD21 LEU 122 3.677 4.721 8.096 921 HD23 LEU 122 HD22 LEU 122 2.738 5.731 9.190 922 H CYS 123 H CYS 123 2.280 0.506 9.796 923 HA CYS 123 HA CYS 123 0.979 0.808 12.441 924 HB2 CYS 123 HB2 CYS 123 -0.349 0.063 9.804 925 HB3 CYS 123 HB3 CYS 123 -1.142 0.464 11.319 926 HG CYS 123 HG CYS 123 -1.491 2.434 9.682 927 H GLU 124 H GLU 124 3.010 -1.246 11.887 928 HA GLU 124 HA GLU 124 1.411 -3.569 12.750 929 HB2 GLU 124 HB2 GLU 124 3.508 -3.605 10.561 930 HB3 GLU 124 HB3 GLU 124 3.011 -5.050 11.442 931 HG2 GLU 124 HG2 GLU 124 1.164 -3.235 9.865 932 HG3 GLU 124 HG3 GLU 124 1.843 -4.756 9.276 933 H GLU 125 H GLU 125 1.902 -3.568 14.756 934 HA GLU 125 HA GLU 125 4.323 -2.702 15.916 935 HB2 GLU 125 HB2 GLU 125 3.542 -3.697 17.980 936 HB3 GLU 125 HB3 GLU 125 2.229 -2.865 17.151 937 HG2 GLU 125 HG2 GLU 125 1.409 -5.083 16.293 938 HG3 GLU 125 HG3 GLU 125 2.684 -5.883 17.214 939 H GLU 126 H GLU 126 3.490 -5.823 14.537 940 HA GLU 126 HA GLU 126 5.627 -7.334 15.648 941 HB2 GLU 126 HB2 GLU 126 4.245 -7.705 12.951 942 HB3 GLU 126 HB3 GLU 126 5.232 -8.904 13.802 943 HG2 GLU 126 HG2 GLU 126 3.582 -8.751 15.728 944 HG3 GLU 126 HG3 GLU 126 2.564 -7.746 14.685 945 H ILE 127 H ILE 127 5.321 -5.345 12.712 946 HA ILE 127 HA ILE 127 8.011 -5.814 11.767 947 HB ILE 127 HB ILE 127 5.843 -3.880 11.085 948 HG12 ILE 127 HG12 ILE 127 5.954 -4.859 8.903 949 HG13 ILE 127 HG13 ILE 127 7.436 -5.741 9.294 950 HG21 ILE 127 HG21 ILE 127 7.447 -3.032 9.280 951 HG22 ILE 127 HG22 ILE 127 7.718 -2.437 10.917 952 HG23 ILE 127 HG23 ILE 127 8.742 -3.732 10.262 953 HD11 ILE 127 HD13 ILE 127 4.715 -6.328 10.509 954 HD12 ILE 127 HD11 ILE 127 5.432 -7.178 9.128 955 HD13 ILE 127 HD12 ILE 127 6.212 -7.281 10.710 956 H LEU 128 H LEU 128 6.396 -3.237 13.736 957 HA LEU 128 HA LEU 128 8.633 -1.590 13.935 958 HB2 LEU 128 HB2 LEU 128 6.494 -2.049 16.045 959 HB3 LEU 128 HB3 LEU 128 7.697 -0.774 16.106 960 HG LEU 128 HG LEU 128 5.499 -1.048 14.018 961 HD11 LEU 128 HD11 LEU 128 4.781 -0.235 16.235 962 HD12 LEU 128 HD12 LEU 128 6.019 1.035 16.171 963 HD13 LEU 128 HD13 LEU 128 4.676 1.034 15.008 964 HD21 LEU 128 HD23 LEU 128 7.850 0.870 14.166 965 HD22 LEU 128 HD21 LEU 128 7.316 -0.132 12.796 966 HD23 LEU 128 HD22 LEU 128 6.348 1.254 13.296 967 H GLU 129 H GLU 129 7.967 -4.489 15.893 968 HA GLU 129 HA GLU 129 10.226 -4.086 17.599 969 HB2 GLU 129 HB2 GLU 129 8.290 -6.305 17.101 970 HB3 GLU 129 HB3 GLU 129 9.897 -6.786 17.672 971 HG2 GLU 129 HG2 GLU 129 9.770 -5.254 19.559 972 HG3 GLU 129 HG3 GLU 129 8.170 -4.697 19.044 973 H GLN 130 H GLN 130 9.800 -5.688 14.401 974 HA GLN 130 HA GLN 130 12.353 -7.014 14.539 975 HB2 GLN 130 HB2 GLN 130 10.302 -6.507 12.364 976 HB3 GLN 130 HB3 GLN 130 11.836 -7.351 12.053 977 HG2 GLN 130 HG2 GLN 130 11.346 -9.082 13.625 978 HG3 GLN 130 HG3 GLN 130 9.908 -8.248 14.217 979 HE21 GLN 130 HE22 GLN 130 8.000 -8.265 12.984 980 HE22 GLN 130 HE21 GLN 130 7.767 -9.357 11.622 981 H LEU 131 H LEU 131 11.132 -3.902 13.287 982 HA LEU 131 HA LEU 131 13.649 -2.999 12.182 983 HB2 LEU 131 HB2 LEU 131 11.424 -1.408 13.495 984 HB3 LEU 131 HB3 LEU 131 12.776 -0.728 12.584 985 HG LEU 131 HG LEU 131 10.599 -2.541 11.409 986 HD11 LEU 131 HD11 LEU 131 9.754 -0.451 12.410 987 HD12 LEU 131 HD12 LEU 131 10.855 0.485 11.386 988 HD13 LEU 131 HD13 LEU 131 9.553 -0.480 10.641 989 HD21 LEU 131 HD23 LEU 131 11.353 -1.641 9.242 990 HD22 LEU 131 HD21 LEU 131 12.640 -0.743 10.062 991 HD23 LEU 131 HD22 LEU 131 12.663 -2.509 10.062 992 H LEU 132 H LEU 132 11.991 -2.344 15.324 993 HA LEU 132 HA LEU 132 14.073 -0.950 16.544 994 HB2 LEU 132 HB2 LEU 132 11.908 -2.682 17.743 995 HB3 LEU 132 HB3 LEU 132 13.071 -1.886 18.777 996 HG LEU 132 HG LEU 132 11.336 -0.368 16.816 997 HD11 LEU 132 HD11 LEU 132 9.965 0.263 18.760 998 HD12 LEU 132 HD12 LEU 132 9.932 -1.484 18.489 999 HD13 LEU 132 HD13 LEU 132 10.930 -0.812 19.798 1000 HD21 LEU 132 HD23 LEU 132 11.940 1.598 18.194 1001 HD22 LEU 132 HD21 LEU 132 13.014 0.582 19.178 1002 HD23 LEU 132 HD22 LEU 132 13.372 0.874 17.464 1003 H THR 133 H THR 133 14.220 -4.328 15.849 1004 HA THR 133 HA THR 133 16.431 -4.700 17.793 1005 HB THR 133 HB THR 133 15.893 -7.131 17.563 1006 HG1 THR 133 HG1 THR 133 13.456 -6.231 16.456 1007 HG21 THR 133 HG23 THR 133 13.552 -5.434 18.581 1008 HG22 THR 133 HG21 THR 133 13.900 -7.117 18.997 1009 HG23 THR 133 HG22 THR 133 15.022 -5.837 19.492 1010 H ALA 134 H ALA 134 16.099 -3.715 14.748 1011 HA ALA 134 HA ALA 134 17.680 -5.406 13.149 1012 HB1 ALA 134 HB3 ALA 134 17.215 -2.397 13.045 1013 HB2 ALA 134 HB1 ALA 134 17.953 -3.352 11.761 1014 HB3 ALA 134 HB2 ALA 134 16.262 -3.661 12.225 1015 H SER 135 H SER 135 19.770 -5.986 13.510 1016 HA SER 135 HA SER 135 21.583 -4.418 15.129 1017 HB2 SER 135 HB2 SER 135 22.096 -6.782 13.276 1018 HB3 SER 135 HB3 SER 135 23.167 -6.201 14.562 1019 HG SER 135 HG SER 135 21.582 -6.771 16.081 1020 H SER 136 H SER 136 20.671 -4.232 11.753 1021 HA SER 136 HA SER 136 22.960 -2.487 11.134 1022 HB2 SER 136 HB2 SER 136 23.520 -3.907 9.164 1023 HB3 SER 136 HB3 SER 136 23.788 -4.754 10.692 1024 HG SER 136 HG SER 136 22.700 -6.144 9.372 1025 H GLU 137 H GLU 137 22.733 -1.469 9.012 1026 HA GLU 137 HA GLU 137 20.144 -0.580 8.273 1027 HB2 GLU 137 HB2 GLU 137 22.683 -0.798 6.572 1028 HB3 GLU 137 HB3 GLU 137 21.238 0.136 6.193 1029 HG2 GLU 137 HG2 GLU 137 22.641 1.733 6.884 1030 HG3 GLU 137 HG3 GLU 137 21.614 1.453 8.275 1031 H LYS 138 H LYS 138 22.118 -3.381 7.219 1032 HA LYS 138 HA LYS 138 20.514 -4.153 5.038 1033 HB2 LYS 138 HB2 LYS 138 22.761 -5.084 5.479 1034 HB3 LYS 138 HB3 LYS 138 22.163 -5.880 6.934 1035 HG2 LYS 138 HG2 LYS 138 22.401 -7.472 5.118 1036 HG3 LYS 138 HG3 LYS 138 20.707 -7.339 5.589 1037 HD2 LYS 138 HD2 LYS 138 20.246 -5.914 3.617 1038 HD3 LYS 138 HD3 LYS 138 21.972 -5.945 3.182 1039 HE2 LYS 138 HE2 LYS 138 21.846 -8.422 2.947 1040 HE3 LYS 138 HE3 LYS 138 20.131 -8.375 3.369 1041 HZ1 LYS 138 HZ3 LYS 138 20.454 -8.469 0.981 1042 HZ2 LYS 138 HZ1 LYS 138 19.743 -7.056 1.366 1043 HZ3 LYS 138 HZ2 LYS 138 21.331 -7.098 0.979 1044 H GLN 139 H GLN 139 20.225 -5.131 8.506 1045 HA GLN 139 HA GLN 139 17.963 -6.709 8.100 1046 HB2 GLN 139 HB2 GLN 139 19.664 -6.219 10.164 1047 HB3 GLN 139 HB3 GLN 139 18.296 -5.231 10.696 1048 HG2 GLN 139 HG2 GLN 139 16.818 -7.210 10.341 1049 HG3 GLN 139 HG3 GLN 139 18.262 -8.140 9.870 1050 HE21 GLN 139 HE22 GLN 139 16.247 -8.355 12.260 1051 HE22 GLN 139 HE21 GLN 139 17.287 -8.408 13.660 1052 H LEU 140 H LEU 140 18.189 -3.148 8.536 1053 HA LEU 140 HA LEU 140 15.341 -2.773 8.941 1054 HB2 LEU 140 HB2 LEU 140 17.629 -1.000 8.074 1055 HB3 LEU 140 HB3 LEU 140 15.979 -0.406 8.049 1056 HG LEU 140 HG LEU 140 17.375 -1.477 10.518 1057 HD11 LEU 140 HD11 LEU 140 17.640 0.857 11.193 1058 HD12 LEU 140 HD12 LEU 140 18.444 0.593 9.646 1059 HD13 LEU 140 HD13 LEU 140 16.876 1.418 9.695 1060 HD21 LEU 140 HD23 LEU 140 15.600 -0.388 11.786 1061 HD22 LEU 140 HD21 LEU 140 14.786 0.076 10.284 1062 HD23 LEU 140 HD22 LEU 140 14.950 -1.642 10.741 1063 H ALA 141 H ALA 141 17.503 -2.403 6.086 1064 HA ALA 141 HA ALA 141 15.494 -2.031 4.163 1065 HB1 ALA 141 HB3 ALA 141 17.192 -2.478 2.550 1066 HB2 ALA 141 HB1 ALA 141 17.913 -1.570 3.896 1067 HB3 ALA 141 HB2 ALA 141 18.195 -3.330 3.764 1068 H ASP 142 H ASP 142 16.685 -5.123 5.545 1069 HA ASP 142 HA ASP 142 15.499 -6.862 3.657 1070 HB2 ASP 142 HB2 ASP 142 16.913 -7.743 5.425 1071 HB3 ASP 142 HB3 ASP 142 15.779 -7.200 6.665 1072 H ILE 143 H ILE 143 14.038 -5.226 6.530 1073 HA ILE 143 HA ILE 143 11.458 -6.385 6.194 1074 HB ILE 143 HB ILE 143 12.607 -4.028 7.721 1075 HG12 ILE 143 HG12 ILE 143 11.553 -6.713 8.732 1076 HG13 ILE 143 HG13 ILE 143 13.246 -6.444 8.331 1077 HG21 ILE 143 HG21 ILE 143 9.789 -5.126 7.902 1078 HG22 ILE 143 HG22 ILE 143 10.536 -3.946 9.011 1079 HG23 ILE 143 HG23 ILE 143 10.281 -3.511 7.325 1080 HD11 ILE 143 HD13 ILE 143 13.080 -6.234 10.664 1081 HD12 ILE 143 HD11 ILE 143 13.346 -4.616 10.034 1082 HD13 ILE 143 HD12 ILE 143 11.713 -5.108 10.585 1083 H ILE 144 H ILE 144 13.020 -3.421 4.966 1084 HA ILE 144 HA ILE 144 10.753 -2.337 3.595 1085 HB ILE 144 HB ILE 144 13.689 -2.336 2.746 1086 HG12 ILE 144 HG12 ILE 144 13.463 -1.181 4.840 1087 HG13 ILE 144 HG13 ILE 144 13.735 -0.019 3.548 1088 HG21 ILE 144 HG21 ILE 144 12.483 -1.929 0.746 1089 HG22 ILE 144 HG22 ILE 144 11.414 -0.760 1.535 1090 HG23 ILE 144 HG23 ILE 144 13.139 -0.396 1.312 1091 HD11 ILE 144 HD13 ILE 144 11.181 -0.622 5.028 1092 HD12 ILE 144 HD11 ILE 144 12.049 0.920 4.854 1093 HD13 ILE 144 HD12 ILE 144 11.171 0.240 3.472 1094 H SER 145 H SER 145 13.202 -4.673 2.502 1095 HA SER 145 HA SER 145 12.118 -4.915 -0.058 1096 HB2 SER 145 HB2 SER 145 13.799 -6.967 1.465 1097 HB3 SER 145 HB3 SER 145 13.615 -6.864 -0.293 1098 HG SER 145 HG SER 145 14.842 -4.982 1.463 1099 H ARG 146 H ARG 146 11.419 -6.758 2.950 1100 HA ARG 146 HA ARG 146 9.884 -8.801 1.994 1101 HB2 ARG 146 HB2 ARG 146 10.820 -7.970 4.369 1102 HB3 ARG 146 HB3 ARG 146 9.209 -7.257 4.530 1103 HG2 ARG 146 HG2 ARG 146 8.247 -9.473 3.998 1104 HG3 ARG 146 HG3 ARG 146 9.913 -10.120 3.892 1105 HD2 ARG 146 HD2 ARG 146 8.666 -8.819 6.349 1106 HD3 ARG 146 HD3 ARG 146 8.817 -10.575 6.115 1107 HE ARG 146 HE ARG 146 11.396 -9.442 5.830 1108 HH11 ARG 146 HH11 ARG 146 8.976 -9.964 8.362 1109 HH12 ARG 146 HH12 ARG 146 10.115 -9.934 9.666 1110 HH21 ARG 146 HH21 ARG 146 12.921 -9.397 7.518 1111 HH22 ARG 146 HH22 ARG 146 12.418 -9.647 9.168 1112 H GLY 147 H GLY 147 8.911 -5.497 2.821 1113 HA2 GLY 147 HA2 GLY 147 6.937 -4.359 2.679 1114 HA3 GLY 147 HA3 GLY 147 6.646 -5.253 1.165 Start of MODEL 4 1 H MET 1 H1 MET 1 2.157 -1.093 -0.883 2 HA MET 1 HA MET 1 2.615 -1.402 -3.780 3 HB2 MET 1 HB2 MET 1 2.410 1.054 -2.918 4 HB3 MET 1 HB3 MET 1 3.921 0.715 -2.035 5 HG2 MET 1 HG2 MET 1 4.120 1.889 -4.281 6 HG3 MET 1 HG3 MET 1 5.179 0.525 -3.984 7 HE1 MET 1 HE3 MET 1 4.735 0.331 -7.830 8 HE2 MET 1 HE1 MET 1 4.883 1.782 -6.813 9 HE3 MET 1 HE2 MET 1 5.879 0.348 -6.469 10 H ARG 2 H ARG 2 4.905 -1.769 -4.316 11 HA ARG 2 HA ARG 2 6.252 -3.480 -2.388 12 HB2 ARG 2 HB2 ARG 2 7.100 -2.225 -5.048 13 HB3 ARG 2 HB3 ARG 2 8.221 -3.109 -4.016 14 HG2 ARG 2 HG2 ARG 2 7.552 -4.647 -5.641 15 HG3 ARG 2 HG3 ARG 2 6.708 -5.124 -4.162 16 HD2 ARG 2 HD2 ARG 2 4.631 -4.106 -5.000 17 HD3 ARG 2 HD3 ARG 2 5.495 -3.483 -6.426 18 HE ARG 2 HE ARG 2 5.802 -6.324 -6.209 19 HH11 ARG 2 HH11 ARG 2 3.377 -3.899 -7.140 20 HH12 ARG 2 HH12 ARG 2 2.519 -4.958 -8.195 21 HH21 ARG 2 HH21 ARG 2 4.662 -7.731 -7.621 22 HH22 ARG 2 HH22 ARG 2 3.270 -7.183 -8.473 23 H LEU 3 H LEU 3 7.011 -2.580 -0.578 24 HA LEU 3 HA LEU 3 7.201 0.168 -0.059 25 HB2 LEU 3 HB2 LEU 3 8.328 -2.310 1.217 26 HB3 LEU 3 HB3 LEU 3 9.040 -0.782 1.697 27 HG LEU 3 HG LEU 3 7.229 -1.634 3.184 28 HD11 LEU 3 HD11 LEU 3 7.964 0.711 3.199 29 HD12 LEU 3 HD12 LEU 3 6.748 1.121 1.967 30 HD13 LEU 3 HD13 LEU 3 6.254 0.547 3.572 31 HD21 LEU 3 HD23 LEU 3 4.897 -1.348 2.603 32 HD22 LEU 3 HD21 LEU 3 5.309 -0.768 0.984 33 HD23 LEU 3 HD22 LEU 3 5.642 -2.442 1.432 34 H SER 4 H SER 4 9.734 -2.037 -1.267 35 HA SER 4 HA SER 4 11.969 -0.402 -1.051 36 HB2 SER 4 HB2 SER 4 12.662 -1.885 -3.114 37 HB3 SER 4 HB3 SER 4 12.389 -2.614 -1.526 38 HG SER 4 HG SER 4 11.337 -3.750 -3.231 39 H ASP 5 H ASP 5 9.243 0.049 -3.269 40 HA ASP 5 HA ASP 5 10.605 1.472 -5.319 41 HB2 ASP 5 HB2 ASP 5 8.270 0.657 -5.480 42 HB3 ASP 5 HB3 ASP 5 7.781 1.835 -4.255 43 H TYR 6 H TYR 6 9.786 2.350 -2.018 44 HA TYR 6 HA TYR 6 10.163 5.231 -2.559 45 HB2 TYR 6 HB2 TYR 6 9.107 3.764 -0.115 46 HB3 TYR 6 HB3 TYR 6 9.253 5.506 -0.269 47 HD1 TYR 6 HD2 TYR 6 7.835 6.833 -1.713 48 HD2 TYR 6 HD1 TYR 6 7.220 2.569 -1.270 49 HE1 TYR 6 HE2 TYR 6 5.641 7.019 -2.860 50 HE2 TYR 6 HE1 TYR 6 5.006 2.789 -2.301 51 HH TYR 6 HH TYR 6 3.456 4.217 -3.324 52 H PHE 7 H PHE 7 12.224 2.650 -1.507 53 HA PHE 7 HA PHE 7 13.810 4.554 0.189 54 HB2 PHE 7 HB2 PHE 7 13.710 1.544 0.421 55 HB3 PHE 7 HB3 PHE 7 14.737 2.634 1.342 56 HD1 PHE 7 HD2 PHE 7 11.159 1.930 0.594 57 HD2 PHE 7 HD1 PHE 7 13.957 3.308 3.567 58 HE1 PHE 7 HE2 PHE 7 9.295 2.294 2.163 59 HE2 PHE 7 HE1 PHE 7 12.063 3.745 5.098 60 HZ PHE 7 HZ PHE 7 9.747 3.227 4.430 61 HA PRO 8 HA PRO 8 15.725 3.952 -3.910 62 HB2 PRO 8 HB2 PRO 8 17.439 6.197 -3.810 63 HB3 PRO 8 HB3 PRO 8 15.782 6.120 -4.479 64 HG2 PRO 8 HG2 PRO 8 16.669 6.986 -1.722 65 HG3 PRO 8 HG3 PRO 8 15.441 7.745 -2.774 66 HD2 PRO 8 HD2 PRO 8 14.659 6.176 -0.777 67 HD3 PRO 8 HD3 PRO 8 13.875 6.021 -2.375 68 H GLU 9 H GLU 9 17.902 4.878 -1.208 69 HA GLU 9 HA GLU 9 19.712 2.705 -1.865 70 HB2 GLU 9 HB2 GLU 9 20.176 4.362 -3.710 71 HB3 GLU 9 HB3 GLU 9 20.520 5.583 -2.499 72 HG2 GLU 9 HG2 GLU 9 22.496 4.196 -1.742 73 HG3 GLU 9 HG3 GLU 9 22.099 3.017 -2.991 74 H SER 10 H SER 10 21.055 5.686 -0.596 75 HA SER 10 HA SER 10 21.877 4.449 1.801 76 HB2 SER 10 HB2 SER 10 21.573 7.442 1.386 77 HB3 SER 10 HB3 SER 10 22.856 6.584 2.253 78 HG SER 10 HG SER 10 23.688 5.912 0.283 79 H SER 11 H SER 11 18.866 4.584 1.180 80 HA SER 11 HA SER 11 17.590 6.565 2.782 81 HB2 SER 11 HB2 SER 11 16.572 3.864 1.834 82 HB3 SER 11 HB3 SER 11 15.595 5.306 2.178 83 HG SER 11 HG SER 11 16.603 6.342 0.456 84 H ILE 12 H ILE 12 18.942 3.403 3.563 85 HA ILE 12 HA ILE 12 17.492 3.322 6.137 86 HB ILE 12 HB ILE 12 18.832 1.272 4.352 87 HG12 ILE 12 HG12 ILE 12 16.157 0.522 5.129 88 HG13 ILE 12 HG13 ILE 12 16.081 2.219 4.634 89 HG21 ILE 12 HG21 ILE 12 19.367 0.690 6.626 90 HG22 ILE 12 HG22 ILE 12 17.681 0.928 7.139 91 HG23 ILE 12 HG23 ILE 12 18.122 -0.405 6.025 92 HD11 ILE 12 HD13 ILE 12 17.200 1.693 2.548 93 HD12 ILE 12 HD11 ILE 12 17.260 -0.027 3.015 94 HD13 ILE 12 HD12 ILE 12 15.679 0.778 2.765 95 H SER 13 H SER 13 18.751 3.729 7.962 96 HA SER 13 HA SER 13 21.658 3.305 7.765 97 HB2 SER 13 HB2 SER 13 20.408 5.924 8.739 98 HB3 SER 13 HB3 SER 13 22.133 5.529 8.738 99 HG SER 13 HG SER 13 21.508 6.835 6.953 100 H VAL 14 H VAL 14 22.601 2.741 9.665 101 HA VAL 14 HA VAL 14 20.936 2.744 12.140 102 HB VAL 14 HB VAL 14 23.070 0.764 11.254 103 HG11 VAL 14 HG11 VAL 14 21.569 0.961 13.915 104 HG12 VAL 14 HG12 VAL 14 22.603 -0.397 13.415 105 HG13 VAL 14 HG13 VAL 14 23.315 1.196 13.676 106 HG21 VAL 14 HG23 VAL 14 21.226 -0.894 11.514 107 HG22 VAL 14 HG21 VAL 14 20.101 0.423 11.886 108 HG23 VAL 14 HG22 VAL 14 20.843 0.305 10.277 109 H ILE 15 H ILE 15 21.863 3.859 13.814 110 HA ILE 15 HA ILE 15 24.505 5.176 13.339 111 HB ILE 15 HB ILE 15 21.809 6.383 14.048 112 HG12 ILE 15 HG12 ILE 15 23.483 6.681 11.530 113 HG13 ILE 15 HG13 ILE 15 21.851 6.011 11.677 114 HG21 ILE 15 HG21 ILE 15 24.453 7.857 13.734 115 HG22 ILE 15 HG22 ILE 15 22.871 8.560 14.174 116 HG23 ILE 15 HG23 ILE 15 23.635 7.481 15.267 117 HD11 ILE 15 HD13 ILE 15 21.600 8.219 10.793 118 HD12 ILE 15 HD11 ILE 15 21.097 8.305 12.504 119 HD13 ILE 15 HD12 ILE 15 22.686 8.909 12.019 120 H HIS 16 H HIS 16 25.636 5.637 15.231 121 HA HIS 16 HA HIS 16 25.168 4.159 17.599 122 HB2 HIS 16 HB2 HIS 16 27.371 4.921 16.963 123 HB3 HIS 16 HB3 HIS 16 26.855 6.604 16.931 124 HD1 HIS 16 HD1 HIS 16 26.680 7.881 19.299 125 HD2 HIS 16 HD2 HIS 16 28.003 3.879 19.396 126 HE1 HIS 16 HE1 HIS 16 27.813 7.558 21.554 127 H SER 17 H SER 17 24.352 7.630 16.833 128 HA SER 17 HA SER 17 22.283 7.733 18.814 129 HB2 SER 17 HB2 SER 17 23.408 9.552 20.168 130 HB3 SER 17 HB3 SER 17 24.080 7.941 20.438 131 HG SER 17 HG SER 17 25.573 9.798 20.092 132 H ALA 18 H ALA 18 21.133 9.832 18.566 133 HA ALA 18 HA ALA 18 21.927 11.288 16.083 134 HB1 ALA 18 HB3 ALA 18 19.892 12.631 16.434 135 HB2 ALA 18 HB1 ALA 18 19.527 10.912 16.260 136 HB3 ALA 18 HB2 ALA 18 19.487 11.664 17.859 137 H LYS 19 H LYS 19 22.708 13.410 16.183 138 HA LYS 19 HA LYS 19 24.247 13.991 18.525 139 HB2 LYS 19 HB2 LYS 19 24.586 14.523 15.925 140 HB3 LYS 19 HB3 LYS 19 23.722 15.992 16.310 141 HG2 LYS 19 HG2 LYS 19 26.076 16.445 16.399 142 HG3 LYS 19 HG3 LYS 19 25.423 16.581 18.027 143 HD2 LYS 19 HD2 LYS 19 27.640 15.459 17.930 144 HD3 LYS 19 HD3 LYS 19 26.403 14.435 18.662 145 HE2 LYS 19 HE2 LYS 19 26.111 13.223 16.520 146 HE3 LYS 19 HE3 LYS 19 27.287 14.284 15.743 147 HZ1 LYS 19 HZ3 LYS 19 27.894 12.421 17.972 148 HZ2 LYS 19 HZ1 LYS 19 28.296 12.193 16.409 149 HZ3 LYS 19 HZ2 LYS 19 28.981 13.405 17.250 150 H ASP 20 H ASP 20 21.103 15.070 17.425 151 HA ASP 20 HA ASP 20 20.394 16.513 19.823 152 HB2 ASP 20 HB2 ASP 20 21.754 18.225 18.341 153 HB3 ASP 20 HB3 ASP 20 20.381 18.042 17.224 154 H TRP 21 H TRP 21 18.124 17.448 19.285 155 HA TRP 21 HA TRP 21 16.535 15.449 17.901 156 HB2 TRP 21 HB2 TRP 21 14.769 17.331 18.362 157 HB3 TRP 21 HB3 TRP 21 15.340 16.263 19.618 158 HD1 TRP 21 HD1 TRP 21 16.069 19.746 18.305 159 HE1 TRP 21 HE1 TRP 21 16.485 21.383 20.228 160 HE3 TRP 21 HE3 TRP 21 16.153 16.403 22.149 161 HZ2 TRP 21 HZ2 TRP 21 16.696 21.249 23.117 162 HZ3 TRP 21 HZ3 TRP 21 16.460 17.169 24.476 163 HH2 TRP 21 HH2 TRP 21 16.723 19.590 24.980 164 H GLN 22 H GLN 22 17.901 18.686 17.153 165 HA GLN 22 HA GLN 22 16.675 19.052 14.563 166 HB2 GLN 22 HB2 GLN 22 19.378 19.855 15.694 167 HB3 GLN 22 HB3 GLN 22 18.789 20.344 14.104 168 HG2 GLN 22 HG2 GLN 22 16.976 21.603 15.006 169 HG3 GLN 22 HG3 GLN 22 17.151 20.892 16.608 170 HE21 GLN 22 HE22 GLN 22 19.179 21.319 17.810 171 HE22 GLN 22 HE21 GLN 22 19.932 22.906 17.633 172 H GLU 23 H GLU 23 19.697 17.326 15.631 173 HA GLU 23 HA GLU 23 20.421 16.503 13.013 174 HB2 GLU 23 HB2 GLU 23 21.831 16.483 15.239 175 HB3 GLU 23 HB3 GLU 23 21.063 14.906 15.497 176 HG2 GLU 23 HG2 GLU 23 22.994 14.265 14.405 177 HG3 GLU 23 HG3 GLU 23 21.916 14.371 13.050 178 H ALA 24 H ALA 24 18.343 15.019 15.475 179 HA ALA 24 HA ALA 24 18.181 12.460 14.275 180 HB1 ALA 24 HB3 ALA 24 17.546 13.121 16.627 181 HB2 ALA 24 HB1 ALA 24 16.090 13.896 15.982 182 HB3 ALA 24 HB2 ALA 24 16.308 12.138 15.804 183 H ILE 25 H ILE 25 16.316 15.465 13.675 184 HA ILE 25 HA ILE 25 14.616 14.321 11.623 185 HB ILE 25 HB ILE 25 15.612 17.180 11.823 186 HG12 ILE 25 HG12 ILE 25 14.094 15.924 13.856 187 HG13 ILE 25 HG13 ILE 25 14.498 17.618 13.658 188 HG21 ILE 25 HG21 ILE 25 13.146 16.003 10.489 189 HG22 ILE 25 HG22 ILE 25 13.581 17.728 10.556 190 HG23 ILE 25 HG23 ILE 25 14.598 16.623 9.683 191 HD11 ILE 25 HD13 ILE 25 12.020 16.238 12.598 192 HD12 ILE 25 HD11 ILE 25 12.124 17.281 14.030 193 HD13 ILE 25 HD12 ILE 25 12.402 17.978 12.425 194 H ASP 26 H ASP 26 17.769 16.038 11.673 195 HA ASP 26 HA ASP 26 18.128 16.306 8.922 196 HB2 ASP 26 HB2 ASP 26 19.509 17.217 10.940 197 HB3 ASP 26 HB3 ASP 26 20.460 15.740 10.776 198 H PHE 27 H PHE 27 19.131 13.579 11.037 199 HA PHE 27 HA PHE 27 20.144 11.968 8.900 200 HB2 PHE 27 HB2 PHE 27 19.329 11.435 11.774 201 HB3 PHE 27 HB3 PHE 27 19.764 10.124 10.690 202 HD1 PHE 27 HD1 PHE 27 21.997 10.750 9.178 203 HD2 PHE 27 HD2 PHE 27 21.199 12.029 13.245 204 HE1 PHE 27 HE1 PHE 27 24.422 10.945 9.606 205 HE2 PHE 27 HE2 PHE 27 23.624 12.126 13.663 206 HZ PHE 27 HZ PHE 27 25.245 11.618 11.855 207 H SER 28 H SER 28 16.830 12.417 10.214 208 HA SER 28 HA SER 28 15.669 10.149 8.884 209 HB2 SER 28 HB2 SER 28 14.306 12.813 9.545 210 HB3 SER 28 HB3 SER 28 13.527 11.293 9.192 211 HG SER 28 HG SER 28 15.263 11.816 11.413 212 H MET 29 H MET 29 16.833 13.237 7.693 213 HA MET 29 HA MET 29 15.319 12.817 5.146 214 HB2 MET 29 HB2 MET 29 16.430 15.343 6.346 215 HB3 MET 29 HB3 MET 29 15.340 15.175 4.949 216 HG2 MET 29 HG2 MET 29 14.347 14.276 7.634 217 HG3 MET 29 HG3 MET 29 14.504 15.987 7.293 218 HE1 MET 29 HE3 MET 29 12.437 12.927 6.965 219 HE2 MET 29 HE1 MET 29 11.474 13.137 5.481 220 HE3 MET 29 HE2 MET 29 13.231 12.795 5.365 221 H VAL 30 H VAL 30 18.679 13.302 6.314 222 HA VAL 30 HA VAL 30 19.651 14.521 4.040 223 HB VAL 30 HB VAL 30 20.899 14.296 6.128 224 HG11 VAL 30 HG11 VAL 30 21.563 11.442 5.271 225 HG12 VAL 30 HG12 VAL 30 22.182 12.306 6.693 226 HG13 VAL 30 HG13 VAL 30 20.468 11.871 6.601 227 HG21 VAL 30 HG23 VAL 30 22.454 13.240 3.723 228 HG22 VAL 30 HG21 VAL 30 22.028 14.932 4.008 229 HG23 VAL 30 HG22 VAL 30 23.120 14.098 5.132 230 H SER 31 H SER 31 19.125 10.962 4.414 231 HA SER 31 HA SER 31 20.524 10.232 2.096 232 HB2 SER 31 HB2 SER 31 17.972 8.963 3.190 233 HB3 SER 31 HB3 SER 31 19.243 8.181 2.230 234 HG SER 31 HG SER 31 19.968 7.694 4.132 235 H LEU 32 H LEU 32 17.357 11.734 2.441 236 HA LEU 32 HA LEU 32 16.607 11.304 -0.375 237 HB2 LEU 32 HB2 LEU 32 15.363 12.776 1.996 238 HB3 LEU 32 HB3 LEU 32 14.678 12.881 0.399 239 HG LEU 32 HG LEU 32 15.136 10.232 1.831 240 HD11 LEU 32 HD11 LEU 32 12.730 10.270 2.356 241 HD12 LEU 32 HD12 LEU 32 13.581 11.608 3.133 242 HD13 LEU 32 HD13 LEU 32 12.599 11.906 1.684 243 HD21 LEU 32 HD23 LEU 32 13.638 9.291 0.199 244 HD22 LEU 32 HD21 LEU 32 13.312 10.881 -0.524 245 HD23 LEU 32 HD22 LEU 32 14.905 10.106 -0.681 246 H LEU 33 H LEU 33 17.826 13.895 1.790 247 HA LEU 33 HA LEU 33 17.805 16.015 -0.016 248 HB2 LEU 33 HB2 LEU 33 18.394 16.042 2.453 249 HB3 LEU 33 HB3 LEU 33 19.976 15.416 2.016 250 HG LEU 33 HG LEU 33 20.363 17.468 0.617 251 HD11 LEU 33 HD11 LEU 33 17.811 18.471 1.941 252 HD12 LEU 33 HD12 LEU 33 18.956 19.439 0.987 253 HD13 LEU 33 HD13 LEU 33 18.046 18.169 0.203 254 HD21 LEU 33 HD23 LEU 33 20.940 18.861 2.484 255 HD22 LEU 33 HD21 LEU 33 19.823 17.976 3.550 256 HD23 LEU 33 HD22 LEU 33 21.260 17.179 2.885 257 H ASP 34 H ASP 34 20.219 13.450 0.493 258 HA ASP 34 HA ASP 34 22.266 14.478 -1.110 259 HB2 ASP 34 HB2 ASP 34 22.592 12.762 0.622 260 HB3 ASP 34 HB3 ASP 34 21.605 11.613 -0.278 261 H LYS 35 H LYS 35 19.460 12.595 -2.103 262 HA LYS 35 HA LYS 35 20.562 12.555 -4.890 263 HB2 LYS 35 HB2 LYS 35 17.964 11.306 -4.376 264 HB3 LYS 35 HB3 LYS 35 19.253 10.786 -5.431 265 HG2 LYS 35 HG2 LYS 35 19.034 10.382 -2.430 266 HG3 LYS 35 HG3 LYS 35 18.724 9.165 -3.656 267 HD2 LYS 35 HD2 LYS 35 21.036 9.038 -4.299 268 HD3 LYS 35 HD3 LYS 35 21.453 10.461 -3.317 269 HE2 LYS 35 HE2 LYS 35 20.623 9.266 -1.288 270 HE3 LYS 35 HE3 LYS 35 20.351 7.819 -2.270 271 HZ1 LYS 35 HZ3 LYS 35 22.981 9.165 -1.944 272 HZ2 LYS 35 HZ1 LYS 35 22.541 7.829 -1.097 273 HZ3 LYS 35 HZ2 LYS 35 22.712 7.699 -2.709 274 H ASN 36 H ASN 36 19.378 14.871 -3.235 275 HA ASN 36 HA ASN 36 17.815 16.358 -3.182 276 HB2 ASN 36 HB2 ASN 36 17.899 17.970 -4.670 277 HB3 ASN 36 HB3 ASN 36 19.364 17.076 -5.043 278 HD21 ASN 36 HD22 ASN 36 18.149 14.993 -6.634 279 HD22 ASN 36 HD21 ASN 36 17.663 15.748 -8.146 280 H TYR 37 H TYR 37 16.468 14.077 -2.834 281 HA TYR 37 HA TYR 37 13.939 14.156 -4.327 282 HB2 TYR 37 HB2 TYR 37 14.862 12.914 -1.718 283 HB3 TYR 37 HB3 TYR 37 13.162 12.980 -2.110 284 HD1 TYR 37 HD1 TYR 37 16.395 11.383 -2.962 285 HD2 TYR 37 HD2 TYR 37 12.149 11.498 -3.676 286 HE1 TYR 37 HE1 TYR 37 16.580 9.398 -4.458 287 HE2 TYR 37 HE2 TYR 37 12.338 9.532 -5.176 288 HH TYR 37 HH TYR 37 13.765 7.985 -6.160 289 H ILE 38 H ILE 38 15.442 16.105 -1.928 290 HA ILE 38 HA ILE 38 13.023 17.723 -1.499 291 HB ILE 38 HB ILE 38 13.602 17.830 0.941 292 HG12 ILE 38 HG12 ILE 38 15.430 15.462 0.333 293 HG13 ILE 38 HG13 ILE 38 15.962 17.101 0.729 294 HG21 ILE 38 HG21 ILE 38 11.769 16.344 0.198 295 HG22 ILE 38 HG22 ILE 38 12.930 14.992 0.097 296 HG23 ILE 38 HG23 ILE 38 12.575 15.764 1.650 297 HD11 ILE 38 HD13 ILE 38 14.867 16.893 2.940 298 HD12 ILE 38 HD11 ILE 38 14.523 15.178 2.569 299 HD13 ILE 38 HD12 ILE 38 16.194 15.737 2.625 300 H SER 39 H SER 39 13.764 19.735 -0.272 301 HA SER 39 HA SER 39 16.476 20.671 -1.094 302 HB2 SER 39 HB2 SER 39 14.061 22.375 -0.376 303 HB3 SER 39 HB3 SER 39 15.530 22.863 -1.236 304 HG SER 39 HG SER 39 13.458 21.126 -2.140 305 H GLU 40 H GLU 40 17.546 22.066 0.611 306 HA GLU 40 HA GLU 40 17.471 20.829 3.142 307 HB2 GLU 40 HB2 GLU 40 18.573 23.548 2.328 308 HB3 GLU 40 HB3 GLU 40 18.895 22.751 3.875 309 HG2 GLU 40 HG2 GLU 40 19.893 20.812 2.661 310 HG3 GLU 40 HG3 GLU 40 19.637 21.635 1.130 311 H ASN 41 H ASN 41 15.655 23.659 1.992 312 HA ASN 41 HA ASN 41 14.706 24.647 4.470 313 HB2 ASN 41 HB2 ASN 41 14.322 25.799 2.316 314 HB3 ASN 41 HB3 ASN 41 13.254 24.493 1.784 315 HD21 ASN 41 HD22 ASN 41 11.081 24.345 2.699 316 HD22 ASN 41 HD21 ASN 41 10.444 25.647 3.679 317 H TYR 42 H TYR 42 13.641 21.813 2.582 318 HA TYR 42 HA TYR 42 11.114 21.402 3.826 319 HB2 TYR 42 HB2 TYR 42 11.911 20.372 1.698 320 HB3 TYR 42 HB3 TYR 42 13.092 19.436 2.605 321 HD1 TYR 42 HD1 TYR 42 9.506 19.831 1.883 322 HD2 TYR 42 HD2 TYR 42 12.528 17.470 3.852 323 HE1 TYR 42 HE1 TYR 42 7.903 17.928 2.080 324 HE2 TYR 42 HE2 TYR 42 10.943 15.581 4.050 325 HH TYR 42 HH TYR 42 8.854 14.766 3.553 326 H ILE 43 H ILE 43 14.379 20.158 4.529 327 HA ILE 43 HA ILE 43 13.818 18.524 6.753 328 HB ILE 43 HB ILE 43 16.329 20.116 6.185 329 HG12 ILE 43 HG12 ILE 43 15.224 17.472 5.170 330 HG13 ILE 43 HG13 ILE 43 15.682 18.879 4.204 331 HG21 ILE 43 HG21 ILE 43 16.106 19.102 8.491 332 HG22 ILE 43 HG22 ILE 43 15.969 17.513 7.733 333 HG23 ILE 43 HG23 ILE 43 17.454 18.467 7.544 334 HD11 ILE 43 HD13 ILE 43 17.286 17.176 3.950 335 HD12 ILE 43 HD11 ILE 43 18.015 18.569 4.803 336 HD13 ILE 43 HD12 ILE 43 17.579 17.087 5.696 337 H GLN 44 H GLN 44 14.805 22.003 6.545 338 HA GLN 44 HA GLN 44 14.689 22.330 9.360 339 HB2 GLN 44 HB2 GLN 44 16.004 23.714 7.588 340 HB3 GLN 44 HB3 GLN 44 14.519 24.654 7.432 341 HG2 GLN 44 HG2 GLN 44 16.044 25.721 9.036 342 HG3 GLN 44 HG3 GLN 44 14.609 25.164 9.882 343 HE21 GLN 44 HE22 GLN 44 15.141 24.256 11.893 344 HE22 GLN 44 HE21 GLN 44 16.541 23.264 12.200 345 H ALA 45 H ALA 45 12.144 22.626 6.925 346 HA ALA 45 HA ALA 45 10.263 24.033 8.490 347 HB1 ALA 45 HB3 ALA 45 9.662 21.749 6.549 348 HB2 ALA 45 HB1 ALA 45 8.555 23.011 7.084 349 HB3 ALA 45 HB2 ALA 45 9.950 23.443 6.073 350 H ILE 46 H ILE 46 11.111 20.506 8.470 351 HA ILE 46 HA ILE 46 9.033 19.824 10.355 352 HB ILE 46 HB ILE 46 11.637 18.335 9.893 353 HG12 ILE 46 HG12 ILE 46 9.065 17.896 8.363 354 HG13 ILE 46 HG13 ILE 46 10.489 18.688 7.701 355 HG21 ILE 46 HG21 ILE 46 8.880 17.327 10.751 356 HG22 ILE 46 HG22 ILE 46 10.406 16.413 10.766 357 HG23 ILE 46 HG23 ILE 46 10.173 17.743 11.889 358 HD11 ILE 46 HD13 ILE 46 11.839 16.654 8.067 359 HD12 ILE 46 HD11 ILE 46 10.396 15.793 8.617 360 HD13 ILE 46 HD12 ILE 46 10.474 16.388 6.959 361 H LYS 47 H LYS 47 12.594 20.515 10.605 362 HA LYS 47 HA LYS 47 12.761 20.039 13.372 363 HB2 LYS 47 HB2 LYS 47 14.260 21.990 11.585 364 HB3 LYS 47 HB3 LYS 47 14.754 21.668 13.246 365 HG2 LYS 47 HG2 LYS 47 15.414 19.422 12.715 366 HG3 LYS 47 HG3 LYS 47 14.665 19.511 11.107 367 HD2 LYS 47 HD2 LYS 47 16.209 21.199 10.394 368 HD3 LYS 47 HD3 LYS 47 16.964 21.284 12.001 369 HE2 LYS 47 HE2 LYS 47 17.919 19.084 11.735 370 HE3 LYS 47 HE3 LYS 47 17.008 18.791 10.259 371 HZ1 LYS 47 HZ3 LYS 47 18.292 20.710 9.284 372 HZ2 LYS 47 HZ1 LYS 47 19.212 20.746 10.628 373 HZ3 LYS 47 HZ2 LYS 47 19.231 19.427 9.655 374 H ASP 48 H ASP 48 12.038 23.106 11.625 375 HA ASP 48 HA ASP 48 11.912 24.787 13.895 376 HB2 ASP 48 HB2 ASP 48 12.151 25.644 11.627 377 HB3 ASP 48 HB3 ASP 48 10.578 24.979 11.168 378 H SER 49 H SER 49 9.327 22.925 12.193 379 HA SER 49 HA SER 49 7.178 23.859 13.836 380 HB2 SER 49 HB2 SER 49 7.443 21.194 12.378 381 HB3 SER 49 HB3 SER 49 5.947 21.981 12.911 382 HG SER 49 HG SER 49 7.742 22.749 10.866 383 H THR 50 H THR 50 9.345 21.017 14.069 384 HA THR 50 HA THR 50 8.296 19.849 16.374 385 HB THR 50 HB THR 50 11.114 19.877 15.240 386 HG1 THR 50 HG1 THR 50 9.730 19.046 13.807 387 HG21 THR 50 HG23 THR 50 9.852 18.110 17.343 388 HG22 THR 50 HG21 THR 50 11.273 17.636 16.385 389 HG23 THR 50 HG22 THR 50 11.354 19.044 17.465 390 H ILE 51 H ILE 51 10.824 22.415 16.082 391 HA ILE 51 HA ILE 51 11.252 22.673 18.907 392 HB ILE 51 HB ILE 51 11.826 24.393 16.475 393 HG12 ILE 51 HG12 ILE 51 13.733 22.955 18.385 394 HG13 ILE 51 HG13 ILE 51 13.064 22.174 16.962 395 HG21 ILE 51 HG21 ILE 51 13.266 25.839 17.894 396 HG22 ILE 51 HG22 ILE 51 11.570 25.989 18.319 397 HG23 ILE 51 HG23 ILE 51 12.651 25.016 19.344 398 HD11 ILE 51 HD13 ILE 51 14.078 23.939 15.512 399 HD12 ILE 51 HD11 ILE 51 14.886 24.608 16.953 400 HD13 ILE 51 HD12 ILE 51 15.255 22.965 16.413 401 H ASN 52 H ASN 52 9.026 24.292 16.620 402 HA ASN 52 HA ASN 52 8.205 26.401 18.306 403 HB2 ASN 52 HB2 ASN 52 7.152 25.085 15.819 404 HB3 ASN 52 HB3 ASN 52 5.945 25.902 16.763 405 HD21 ASN 52 HD22 ASN 52 9.089 26.386 15.147 406 HD22 ASN 52 HD21 ASN 52 8.929 28.117 14.947 407 H ASN 53 H ASN 53 7.011 23.082 18.092 408 HA ASN 53 HA ASN 53 5.042 23.596 20.293 409 HB2 ASN 53 HB2 ASN 53 3.830 24.076 18.292 410 HB3 ASN 53 HB3 ASN 53 4.594 22.761 17.412 411 HD21 ASN 53 HD22 ASN 53 2.657 21.995 16.708 412 HD22 ASN 53 HD21 ASN 53 1.554 21.099 17.744 413 H GLY 54 H GLY 54 6.197 21.057 17.973 414 HA2 GLY 54 HA2 GLY 54 7.555 19.400 19.636 415 HA3 GLY 54 HA3 GLY 54 5.864 18.910 19.895 416 HA PRO 55 HA PRO 55 7.745 16.923 15.917 417 HB2 PRO 55 HB2 PRO 55 6.784 14.619 17.656 418 HB3 PRO 55 HB3 PRO 55 8.027 14.589 16.354 419 HG2 PRO 55 HG2 PRO 55 8.801 14.758 18.892 420 HG3 PRO 55 HG3 PRO 55 9.518 15.882 17.703 421 HD2 PRO 55 HD2 PRO 55 7.281 16.441 19.687 422 HD3 PRO 55 HD3 PRO 55 8.698 17.452 19.278 423 H TYR 56 H TYR 56 6.448 16.277 14.250 424 HA TYR 56 HA TYR 56 3.500 16.514 14.713 425 HB2 TYR 56 HB2 TYR 56 5.312 17.207 12.400 426 HB3 TYR 56 HB3 TYR 56 3.617 16.856 12.109 427 HD1 TYR 56 HD2 TYR 56 5.799 18.994 14.295 428 HD2 TYR 56 HD1 TYR 56 1.982 18.513 12.359 429 HE1 TYR 56 HE2 TYR 56 5.077 21.193 15.185 430 HE2 TYR 56 HE1 TYR 56 1.274 20.745 13.174 431 HH TYR 56 HH TYR 56 1.875 22.629 14.428 432 H TYR 57 H TYR 57 5.791 14.096 14.213 433 HA TYR 57 HA TYR 57 3.821 12.229 13.021 434 HB2 TYR 57 HB2 TYR 57 6.584 12.841 11.939 435 HB3 TYR 57 HB3 TYR 57 5.616 11.426 11.532 436 HD1 TYR 57 HD1 TYR 57 3.591 11.571 10.183 437 HD2 TYR 57 HD2 TYR 57 5.912 15.105 11.081 438 HE1 TYR 57 HE1 TYR 57 2.320 12.831 8.478 439 HE2 TYR 57 HE2 TYR 57 4.675 16.357 9.346 440 HH TYR 57 HH TYR 57 1.947 14.925 7.502 441 H ILE 58 H ILE 58 3.669 11.322 15.102 442 HA ILE 58 HA ILE 58 5.965 9.659 15.965 443 HB ILE 58 HB ILE 58 4.064 11.080 17.869 444 HG12 ILE 58 HG12 ILE 58 5.742 12.672 17.040 445 HG13 ILE 58 HG13 ILE 58 5.883 12.346 18.757 446 HG21 ILE 58 HG21 ILE 58 5.534 10.045 19.639 447 HG22 ILE 58 HG22 ILE 58 4.616 8.864 18.697 448 HG23 ILE 58 HG23 ILE 58 6.334 9.095 18.364 449 HD11 ILE 58 HD13 ILE 58 8.104 12.499 17.740 450 HD12 ILE 58 HD11 ILE 58 7.836 10.875 18.344 451 HD13 ILE 58 HD12 ILE 58 7.697 11.204 16.599 452 H LEU 59 H LEU 59 5.264 7.565 15.958 453 HA LEU 59 HA LEU 59 2.338 7.164 15.493 454 HB2 LEU 59 HB2 LEU 59 4.721 5.931 14.102 455 HB3 LEU 59 HB3 LEU 59 3.120 5.201 14.112 456 HG LEU 59 HG LEU 59 2.199 7.470 13.283 457 HD11 LEU 59 HD11 LEU 59 5.168 7.874 12.634 458 HD12 LEU 59 HD12 LEU 59 3.827 8.771 11.870 459 HD13 LEU 59 HD13 LEU 59 4.097 8.932 13.574 460 HD21 LEU 59 HD23 LEU 59 3.994 6.048 11.321 461 HD22 LEU 59 HD21 LEU 59 2.453 5.364 11.923 462 HD23 LEU 59 HD22 LEU 59 2.449 6.875 11.020 463 H ALA 60 H ALA 60 5.132 6.152 17.328 464 HA ALA 60 HA ALA 60 3.413 4.677 19.079 465 HB1 ALA 60 HB3 ALA 60 4.033 2.840 17.485 466 HB2 ALA 60 HB1 ALA 60 5.752 3.196 17.767 467 HB3 ALA 60 HB2 ALA 60 4.749 2.576 19.081 468 HA PRO 61 HA PRO 61 6.684 6.403 21.684 469 HB2 PRO 61 HB2 PRO 61 6.934 4.588 23.745 470 HB3 PRO 61 HB3 PRO 61 5.629 5.803 23.610 471 HG2 PRO 61 HG2 PRO 61 5.549 2.879 22.822 472 HG3 PRO 61 HG3 PRO 61 4.319 3.819 23.723 473 HD2 PRO 61 HD2 PRO 61 4.089 3.326 21.060 474 HD3 PRO 61 HD3 PRO 61 3.565 4.886 21.755 475 H GLY 62 H GLY 62 8.485 6.364 20.519 476 HA2 GLY 62 HA2 GLY 62 10.768 5.474 20.502 477 HA3 GLY 62 HA3 GLY 62 10.103 3.858 20.285 478 H VAL 63 H VAL 63 8.079 5.600 18.324 479 HA VAL 63 HA VAL 63 9.848 5.312 15.943 480 HB VAL 63 HB VAL 63 7.013 4.254 16.241 481 HG11 VAL 63 HG11 VAL 63 7.317 3.178 14.061 482 HG12 VAL 63 HG12 VAL 63 7.608 4.912 13.914 483 HG13 VAL 63 HG13 VAL 63 8.986 3.801 13.964 484 HG21 VAL 63 HG23 VAL 63 8.132 1.988 16.015 485 HG22 VAL 63 HG21 VAL 63 9.681 2.784 16.299 486 HG23 VAL 63 HG22 VAL 63 8.423 2.798 17.553 487 H ALA 64 H ALA 64 9.807 7.069 14.717 488 HA ALA 64 HA ALA 64 7.460 8.899 14.708 489 HB1 ALA 64 HB3 ALA 64 9.044 10.764 14.295 490 HB2 ALA 64 HB1 ALA 64 9.450 9.951 15.806 491 HB3 ALA 64 HB2 ALA 64 10.403 9.633 14.336 492 H MET 65 H MET 65 7.384 10.148 12.602 493 HA MET 65 HA MET 65 8.527 8.627 10.364 494 HB2 MET 65 HB2 MET 65 6.358 7.651 10.744 495 HB3 MET 65 HB3 MET 65 5.609 9.242 10.522 496 HG2 MET 65 HG2 MET 65 7.266 8.766 8.238 497 HG3 MET 65 HG3 MET 65 6.420 7.261 8.561 498 HE1 MET 65 HE3 MET 65 3.992 7.058 8.941 499 HE2 MET 65 HE1 MET 65 3.461 8.554 9.769 500 HE3 MET 65 HE2 MET 65 2.739 8.094 8.201 501 HA PRO 66 HA PRO 66 8.630 13.341 10.345 502 HB2 PRO 66 HB2 PRO 66 11.433 12.822 9.290 503 HB3 PRO 66 HB3 PRO 66 10.868 14.142 10.363 504 HG2 PRO 66 HG2 PRO 66 12.106 12.029 11.461 505 HG3 PRO 66 HG3 PRO 66 10.595 12.624 12.207 506 HD2 PRO 66 HD2 PRO 66 10.931 10.308 10.269 507 HD3 PRO 66 HD3 PRO 66 10.081 10.348 11.837 508 H HIS 67 H HIS 67 8.347 14.753 8.720 509 HA HIS 67 HA HIS 67 8.638 14.497 5.912 510 HB2 HIS 67 HB2 HIS 67 7.093 12.679 5.908 511 HB3 HIS 67 HB3 HIS 67 6.126 13.375 7.194 512 HD1 HIS 67 HD1 HIS 67 4.143 14.955 6.533 513 HD2 HIS 67 HD2 HIS 67 6.586 13.773 3.301 514 HE1 HIS 67 HE1 HIS 67 2.886 15.537 4.409 515 H ALA 68 H ALA 68 7.477 16.342 4.892 516 HA ALA 68 HA ALA 68 6.035 18.233 6.608 517 HB1 ALA 68 HB3 ALA 68 8.446 19.024 4.911 518 HB2 ALA 68 HB1 ALA 68 7.277 20.150 5.624 519 HB3 ALA 68 HB2 ALA 68 8.305 19.178 6.672 520 H ARG 69 H ARG 69 4.807 19.749 5.174 521 HA ARG 69 HA ARG 69 3.411 18.363 3.147 522 HB2 ARG 69 HB2 ARG 69 3.810 21.319 3.709 523 HB3 ARG 69 HB3 ARG 69 2.729 20.744 2.426 524 HG2 ARG 69 HG2 ARG 69 1.412 19.468 4.096 525 HG3 ARG 69 HG3 ARG 69 2.461 20.056 5.391 526 HD2 ARG 69 HD2 ARG 69 0.724 21.781 3.571 527 HD3 ARG 69 HD3 ARG 69 0.333 21.342 5.229 528 HE ARG 69 HE ARG 69 2.194 23.378 4.296 529 HH11 ARG 69 HH11 ARG 69 1.288 21.398 7.102 530 HH12 ARG 69 HH12 ARG 69 2.061 22.423 8.252 531 HH21 ARG 69 HH21 ARG 69 3.230 24.738 5.826 532 HH22 ARG 69 HH22 ARG 69 3.177 24.371 7.506 533 HA PRO 70 HA PRO 70 6.210 18.129 -0.303 534 HB2 PRO 70 HB2 PRO 70 3.790 19.219 -1.823 535 HB3 PRO 70 HB3 PRO 70 4.934 17.961 -2.347 536 HG2 PRO 70 HG2 PRO 70 2.559 17.256 -1.265 537 HG3 PRO 70 HG3 PRO 70 4.038 16.406 -0.713 538 HD2 PRO 70 HD2 PRO 70 2.506 18.601 0.669 539 HD3 PRO 70 HD3 PRO 70 3.320 17.163 1.357 540 H GLU 71 H GLU 71 4.117 21.054 -0.171 541 HA GLU 71 HA GLU 71 5.604 22.782 -1.797 542 HB2 GLU 71 HB2 GLU 71 3.800 23.405 0.584 543 HB3 GLU 71 HB3 GLU 71 4.284 24.568 -0.647 544 HG2 GLU 71 HG2 GLU 71 2.588 22.077 -1.119 545 HG3 GLU 71 HG3 GLU 71 2.000 23.726 -1.005 546 H CYS 72 H CYS 72 6.589 21.592 1.273 547 HA CYS 72 HA CYS 72 8.043 24.001 2.107 548 HB2 CYS 72 HB2 CYS 72 8.156 21.150 3.190 549 HB3 CYS 72 HB3 CYS 72 8.875 22.591 3.926 550 HG CYS 72 HG CYS 72 5.744 21.810 3.331 551 H GLY 73 H GLY 73 8.547 21.796 -0.372 552 HA2 GLY 73 HA2 GLY 73 10.535 22.487 -1.661 553 HA3 GLY 73 HA3 GLY 73 11.519 22.212 -0.222 554 H ALA 74 H ALA 74 8.905 19.912 -0.891 555 HA ALA 74 HA ALA 74 10.805 17.732 -1.374 556 HB1 ALA 74 HB3 ALA 74 8.841 16.401 -1.782 557 HB2 ALA 74 HB1 ALA 74 8.601 17.340 -0.297 558 HB3 ALA 74 HB2 ALA 74 7.819 17.854 -1.817 559 H LEU 75 H LEU 75 11.244 16.793 -3.327 560 HA LEU 75 HA LEU 75 10.534 18.328 -5.797 561 HB2 LEU 75 HB2 LEU 75 13.200 17.087 -5.031 562 HB3 LEU 75 HB3 LEU 75 12.850 17.890 -6.554 563 HG LEU 75 HG LEU 75 12.864 19.235 -3.816 564 HD11 LEU 75 HD11 LEU 75 14.945 20.312 -4.596 565 HD12 LEU 75 HD12 LEU 75 15.107 18.558 -4.493 566 HD13 LEU 75 HD13 LEU 75 14.900 19.329 -6.078 567 HD21 LEU 75 HD23 LEU 75 11.344 20.410 -5.371 568 HD22 LEU 75 HD21 LEU 75 12.803 21.360 -5.098 569 HD23 LEU 75 HD22 LEU 75 12.615 20.445 -6.611 570 H LYS 76 H LYS 76 11.254 15.184 -4.291 571 HA LYS 76 HA LYS 76 9.856 13.828 -6.475 572 HB2 LYS 76 HB2 LYS 76 12.586 13.054 -5.418 573 HB3 LYS 76 HB3 LYS 76 11.611 12.046 -6.491 574 HG2 LYS 76 HG2 LYS 76 11.788 13.814 -8.245 575 HG3 LYS 76 HG3 LYS 76 12.836 14.759 -7.172 576 HD2 LYS 76 HD2 LYS 76 13.466 11.942 -8.156 577 HD3 LYS 76 HD3 LYS 76 14.073 13.435 -8.888 578 HE2 LYS 76 HE2 LYS 76 15.160 14.058 -6.739 579 HE3 LYS 76 HE3 LYS 76 14.600 12.544 -6.012 580 HZ1 LYS 76 HZ3 LYS 76 16.404 12.682 -8.357 581 HZ2 LYS 76 HZ1 LYS 76 16.899 12.464 -6.816 582 HZ3 LYS 76 HZ2 LYS 76 15.967 11.325 -7.551 583 H THR 77 H THR 77 9.104 11.634 -5.714 584 HA THR 77 HA THR 77 8.545 11.727 -2.900 585 HB THR 77 HB THR 77 7.521 10.089 -5.241 586 HG1 THR 77 HG1 THR 77 6.178 11.637 -5.545 587 HG21 THR 77 HG23 THR 77 6.344 10.433 -2.459 588 HG22 THR 77 HG21 THR 77 5.634 9.513 -3.816 589 HG23 THR 77 HG22 THR 77 7.137 8.964 -3.072 590 H GLY 78 H GLY 78 9.449 10.375 -1.363 591 HA2 GLY 78 HA2 GLY 78 10.594 7.792 -1.906 592 HA3 GLY 78 HA3 GLY 78 11.841 9.043 -1.767 593 H MET 79 H MET 79 12.177 7.340 0.171 594 HA MET 79 HA MET 79 11.092 8.510 2.648 595 HB2 MET 79 HB2 MET 79 10.921 5.598 1.754 596 HB3 MET 79 HB3 MET 79 10.777 6.073 3.436 597 HG2 MET 79 HG2 MET 79 8.786 7.405 2.975 598 HG3 MET 79 HG3 MET 79 8.897 7.020 1.259 599 HE1 MET 79 HE3 MET 79 6.056 4.587 1.648 600 HE2 MET 79 HE1 MET 79 6.089 6.231 2.327 601 HE3 MET 79 HE2 MET 79 6.829 5.904 0.745 602 H SER 80 H SER 80 12.159 7.368 4.551 603 HA SER 80 HA SER 80 14.899 6.398 4.086 604 HB2 SER 80 HB2 SER 80 14.382 8.433 6.264 605 HB3 SER 80 HB3 SER 80 15.928 7.929 5.584 606 HG SER 80 HG SER 80 14.918 10.070 5.080 607 H LEU 81 H LEU 81 15.719 5.449 6.242 608 HA LEU 81 HA LEU 81 13.695 4.729 8.233 609 HB2 LEU 81 HB2 LEU 81 13.523 2.990 6.489 610 HB3 LEU 81 HB3 LEU 81 15.258 2.735 6.508 611 HG LEU 81 HG LEU 81 15.234 1.655 8.581 612 HD11 LEU 81 HD11 LEU 81 13.299 1.352 10.011 613 HD12 LEU 81 HD12 LEU 81 13.594 3.076 9.829 614 HD13 LEU 81 HD13 LEU 81 12.294 2.276 8.899 615 HD21 LEU 81 HD23 LEU 81 14.340 0.491 6.493 616 HD22 LEU 81 HD21 LEU 81 13.823 -0.257 8.030 617 HD23 LEU 81 HD22 LEU 81 12.717 0.779 7.118 618 H THR 82 H THR 82 14.987 6.106 9.589 619 HA THR 82 HA THR 82 17.855 5.456 9.991 620 HB THR 82 HB THR 82 16.023 7.518 11.310 621 HG1 THR 82 HG1 THR 82 16.378 7.782 9.029 622 HG21 THR 82 HG23 THR 82 18.170 8.653 11.897 623 HG22 THR 82 HG21 THR 82 17.977 7.094 12.702 624 HG23 THR 82 HG22 THR 82 19.060 7.229 11.295 625 H LEU 83 H LEU 83 18.581 4.400 11.893 626 HA LEU 83 HA LEU 83 16.640 4.059 14.070 627 HB2 LEU 83 HB2 LEU 83 16.604 1.964 12.714 628 HB3 LEU 83 HB3 LEU 83 18.298 1.692 13.127 629 HG LEU 83 HG LEU 83 16.171 2.147 15.269 630 HD11 LEU 83 HD11 LEU 83 15.999 -0.317 15.476 631 HD12 LEU 83 HD12 LEU 83 15.375 0.248 13.932 632 HD13 LEU 83 HD13 LEU 83 16.981 -0.496 14.011 633 HD21 LEU 83 HD23 LEU 83 18.848 0.689 15.309 634 HD22 LEU 83 HD21 LEU 83 18.457 2.242 16.063 635 HD23 LEU 83 HD22 LEU 83 17.697 0.788 16.668 636 H LEU 84 H LEU 84 17.574 4.991 15.783 637 HA LEU 84 HA LEU 84 20.533 5.320 15.975 638 HB2 LEU 84 HB2 LEU 84 18.287 6.239 17.826 639 HB3 LEU 84 HB3 LEU 84 19.998 6.555 18.026 640 HG LEU 84 HG LEU 84 19.210 8.538 17.381 641 HD11 LEU 84 HD11 LEU 84 21.124 7.799 15.917 642 HD12 LEU 84 HD12 LEU 84 19.932 7.352 14.666 643 HD13 LEU 84 HD13 LEU 84 20.112 9.037 15.153 644 HD21 LEU 84 HD23 LEU 84 16.929 7.889 16.761 645 HD22 LEU 84 HD21 LEU 84 17.620 9.029 15.597 646 HD23 LEU 84 HD22 LEU 84 17.503 7.304 15.188 647 H GLU 85 H GLU 85 21.680 3.871 17.302 648 HA GLU 85 HA GLU 85 20.372 1.850 18.855 649 HB2 GLU 85 HB2 GLU 85 23.206 2.974 18.953 650 HB3 GLU 85 HB3 GLU 85 22.653 1.575 19.882 651 HG2 GLU 85 HG2 GLU 85 22.047 0.416 17.757 652 HG3 GLU 85 HG3 GLU 85 22.679 1.780 16.837 653 H GLN 86 H GLN 86 21.368 5.161 19.429 654 HA GLN 86 HA GLN 86 20.155 5.184 22.149 655 HB2 GLN 86 HB2 GLN 86 22.662 6.595 21.214 656 HB3 GLN 86 HB3 GLN 86 21.911 6.805 22.794 657 HG2 GLN 86 HG2 GLN 86 22.427 4.548 23.451 658 HG3 GLN 86 HG3 GLN 86 22.857 4.082 21.803 659 HE21 GLN 86 HE22 GLN 86 24.682 5.239 20.756 660 HE22 GLN 86 HE21 GLN 86 26.115 5.463 21.738 661 H GLY 87 H GLY 87 18.297 5.624 20.851 662 HA2 GLY 87 HA2 GLY 87 17.723 7.810 19.250 663 HA3 GLY 87 HA3 GLY 87 16.600 7.015 20.357 664 H VAL 88 H VAL 88 16.461 9.676 19.686 665 HA VAL 88 HA VAL 88 17.197 11.143 22.166 666 HB VAL 88 HB VAL 88 17.459 11.901 19.218 667 HG11 VAL 88 HG11 VAL 88 18.293 14.097 19.930 668 HG12 VAL 88 HG12 VAL 88 16.571 13.880 20.136 669 HG13 VAL 88 HG13 VAL 88 17.648 13.804 21.566 670 HG21 VAL 88 HG23 VAL 88 19.818 12.363 19.979 671 HG22 VAL 88 HG21 VAL 88 19.399 11.710 21.569 672 HG23 VAL 88 HG22 VAL 88 19.336 10.664 20.131 673 H TYR 89 H TYR 89 15.721 12.782 22.732 674 HA TYR 89 HA TYR 89 12.919 12.299 21.834 675 HB2 TYR 89 HB2 TYR 89 12.129 12.665 23.891 676 HB3 TYR 89 HB3 TYR 89 13.611 11.844 24.313 677 HD1 TYR 89 HD1 TYR 89 15.503 13.143 25.351 678 HD2 TYR 89 HD2 TYR 89 11.755 14.976 24.303 679 HE1 TYR 89 HE1 TYR 89 16.080 15.099 26.774 680 HE2 TYR 89 HE2 TYR 89 12.296 16.941 25.737 681 HH TYR 89 HH TYR 89 13.873 17.915 27.163 682 H PHE 90 H PHE 90 11.676 14.495 22.365 683 HA PHE 90 HA PHE 90 13.114 16.629 20.787 684 HB2 PHE 90 HB2 PHE 90 10.426 15.293 20.673 685 HB3 PHE 90 HB3 PHE 90 10.780 16.776 19.765 686 HD1 PHE 90 HD2 PHE 90 12.669 16.800 18.069 687 HD2 PHE 90 HD1 PHE 90 11.140 13.129 19.735 688 HE1 PHE 90 HE2 PHE 90 13.707 15.531 16.212 689 HE2 PHE 90 HE1 PHE 90 12.210 11.866 17.883 690 HZ PHE 90 HZ PHE 90 13.480 13.058 16.117 691 HA PRO 91 HA PRO 91 11.736 19.469 23.788 692 HB2 PRO 91 HB2 PRO 91 11.143 21.773 22.353 693 HB3 PRO 91 HB3 PRO 91 12.787 21.147 22.674 694 HG2 PRO 91 HG2 PRO 91 11.069 20.702 20.218 695 HG3 PRO 91 HG3 PRO 91 12.788 21.223 20.286 696 HD2 PRO 91 HD2 PRO 91 12.144 18.649 19.839 697 HD3 PRO 91 HD3 PRO 91 13.500 19.055 20.928 698 H GLY 92 H GLY 92 9.373 18.159 21.771 699 HA2 GLY 92 HA2 GLY 92 7.314 18.964 23.712 700 HA3 GLY 92 HA3 GLY 92 6.950 19.251 22.008 701 H ASN 93 H ASN 93 8.930 16.443 22.977 702 HA ASN 93 HA ASN 93 6.678 14.671 23.345 703 HB2 ASN 93 HB2 ASN 93 6.786 14.625 20.861 704 HB3 ASN 93 HB3 ASN 93 8.491 14.152 20.959 705 HD21 ASN 93 HD22 ASN 93 9.022 11.961 21.647 706 HD22 ASN 93 HD21 ASN 93 7.776 10.747 21.647 707 H ASP 94 H ASP 94 7.524 14.212 25.294 708 HA ASP 94 HA ASP 94 10.250 14.262 25.957 709 HB2 ASP 94 HB2 ASP 94 8.410 14.729 27.507 710 HB3 ASP 94 HB3 ASP 94 7.871 13.052 27.403 711 H GLU 95 H GLU 95 8.426 11.531 24.637 712 HA GLU 95 HA GLU 95 10.095 9.485 25.756 713 HB2 GLU 95 HB2 GLU 95 7.717 9.170 25.279 714 HB3 GLU 95 HB3 GLU 95 7.933 9.761 23.636 715 HG2 GLU 95 HG2 GLU 95 7.728 7.500 23.443 716 HG3 GLU 95 HG3 GLU 95 9.424 7.882 23.165 717 HA PRO 96 HA PRO 96 13.053 10.291 22.436 718 HB2 PRO 96 HB2 PRO 96 14.867 8.329 22.859 719 HB3 PRO 96 HB3 PRO 96 14.660 9.703 23.996 720 HG2 PRO 96 HG2 PRO 96 13.493 6.905 24.206 721 HG3 PRO 96 HG3 PRO 96 14.327 7.849 25.481 722 HD2 PRO 96 HD2 PRO 96 11.556 7.739 25.179 723 HD3 PRO 96 HD3 PRO 96 12.411 9.146 25.893 724 H ILE 97 H ILE 97 13.641 9.399 20.412 725 HA ILE 97 HA ILE 97 11.941 7.103 19.524 726 HB ILE 97 HB ILE 97 12.862 9.596 18.051 727 HG12 ILE 97 HG12 ILE 97 11.084 10.197 19.596 728 HG13 ILE 97 HG13 ILE 97 10.495 10.246 17.949 729 HG21 ILE 97 HG21 ILE 97 11.483 8.793 16.197 730 HG22 ILE 97 HG22 ILE 97 12.769 7.645 16.535 731 HG23 ILE 97 HG23 ILE 97 11.120 7.301 17.066 732 HD11 ILE 97 HD13 ILE 97 9.251 8.169 18.258 733 HD12 ILE 97 HD11 ILE 97 9.943 7.957 19.888 734 HD13 ILE 97 HD12 ILE 97 8.857 9.299 19.564 735 H LYS 98 H LYS 98 13.020 5.402 18.844 736 HA LYS 98 HA LYS 98 15.924 5.668 18.217 737 HB2 LYS 98 HB2 LYS 98 14.152 3.208 18.564 738 HB3 LYS 98 HB3 LYS 98 15.836 3.182 18.015 739 HG2 LYS 98 HG2 LYS 98 16.517 4.344 20.142 740 HG3 LYS 98 HG3 LYS 98 14.843 4.251 20.696 741 HD2 LYS 98 HD2 LYS 98 16.071 2.484 21.735 742 HD3 LYS 98 HD3 LYS 98 14.967 1.753 20.560 743 HE2 LYS 98 HE2 LYS 98 16.840 1.524 18.939 744 HE3 LYS 98 HE3 LYS 98 17.929 2.331 20.068 745 HZ1 LYS 98 HZ3 LYS 98 18.158 -0.079 20.169 746 HZ2 LYS 98 HZ1 LYS 98 17.625 0.479 21.602 747 HZ3 LYS 98 HZ2 LYS 98 16.594 -0.270 20.577 748 H LEU 99 H LEU 99 12.702 5.099 16.716 749 HA LEU 99 HA LEU 99 14.128 4.612 14.149 750 HB2 LEU 99 HB2 LEU 99 11.670 3.496 15.453 751 HB3 LEU 99 HB3 LEU 99 11.578 3.707 13.714 752 HG LEU 99 HG LEU 99 13.960 2.280 14.902 753 HD11 LEU 99 HD11 LEU 99 11.329 0.944 14.172 754 HD12 LEU 99 HD12 LEU 99 12.822 0.179 14.798 755 HD13 LEU 99 HD13 LEU 99 11.881 1.260 15.824 756 HD21 LEU 99 HD23 LEU 99 12.473 2.071 12.234 757 HD22 LEU 99 HD21 LEU 99 13.993 2.931 12.492 758 HD23 LEU 99 HD22 LEU 99 13.943 1.175 12.643 759 H LEU 100 H LEU 100 13.826 5.859 12.454 760 HA LEU 100 HA LEU 100 11.497 7.735 12.492 761 HB2 LEU 100 HB2 LEU 100 14.285 8.694 11.782 762 HB3 LEU 100 HB3 LEU 100 12.788 9.596 11.873 763 HG LEU 100 HG LEU 100 12.840 8.671 14.390 764 HD11 LEU 100 HD11 LEU 100 15.022 7.446 14.096 765 HD12 LEU 100 HD12 LEU 100 15.792 9.003 13.751 766 HD13 LEU 100 HD13 LEU 100 15.070 8.692 15.347 767 HD21 LEU 100 HD23 LEU 100 12.666 11.041 13.773 768 HD22 LEU 100 HD21 LEU 100 13.722 10.775 15.169 769 HD23 LEU 100 HD22 LEU 100 14.429 11.107 13.575 770 H ILE 101 H ILE 101 10.365 6.973 10.800 771 HA ILE 101 HA ILE 101 11.815 6.229 8.352 772 HB ILE 101 HB ILE 101 8.927 5.859 9.222 773 HG12 ILE 101 HG12 ILE 101 9.541 3.500 8.497 774 HG13 ILE 101 HG13 ILE 101 11.182 4.055 8.226 775 HG21 ILE 101 HG21 ILE 101 8.742 6.675 6.937 776 HG22 ILE 101 HG22 ILE 101 10.026 5.572 6.392 777 HG23 ILE 101 HG23 ILE 101 8.471 4.937 6.955 778 HD11 ILE 101 HD13 ILE 101 11.580 4.343 10.547 779 HD12 ILE 101 HD11 ILE 101 9.835 4.343 10.942 780 HD13 ILE 101 HD12 ILE 101 10.645 2.849 10.443 781 H GLY 102 H GLY 102 12.359 7.790 6.992 782 HA2 GLY 102 HA2 GLY 102 11.100 10.463 7.120 783 HA3 GLY 102 HA3 GLY 102 12.400 9.965 6.033 784 H LEU 103 H LEU 103 9.793 11.309 5.341 785 HA LEU 103 HA LEU 103 9.319 9.645 2.976 786 HB2 LEU 103 HB2 LEU 103 7.437 9.089 4.684 787 HB3 LEU 103 HB3 LEU 103 6.949 10.758 4.520 788 HG LEU 103 HG LEU 103 6.746 8.465 2.505 789 HD11 LEU 103 HD11 LEU 103 4.949 9.062 4.262 790 HD12 LEU 103 HD12 LEU 103 4.774 10.622 3.474 791 HD13 LEU 103 HD13 LEU 103 4.391 9.131 2.599 792 HD21 LEU 103 HD23 LEU 103 7.455 10.091 1.036 793 HD22 LEU 103 HD21 LEU 103 5.718 10.194 0.930 794 HD23 LEU 103 HD22 LEU 103 6.558 11.427 1.856 795 H SER 104 H SER 104 9.312 11.025 1.210 796 HA SER 104 HA SER 104 8.647 13.878 1.534 797 HB2 SER 104 HB2 SER 104 10.362 14.505 -0.057 798 HB3 SER 104 HB3 SER 104 11.109 13.741 1.355 799 HG SER 104 HG SER 104 10.906 12.864 -1.293 800 H ALA 105 H ALA 105 7.461 14.678 -0.330 801 HA ALA 105 HA ALA 105 6.842 12.704 -2.422 802 HB1 ALA 105 HB3 ALA 105 5.188 12.205 -0.681 803 HB2 ALA 105 HB1 ALA 105 4.765 13.935 -0.574 804 HB3 ALA 105 HB2 ALA 105 4.416 13.025 -2.056 805 H ALA 106 H ALA 106 6.588 13.710 -4.349 806 HA ALA 106 HA ALA 106 7.003 16.557 -4.475 807 HB1 ALA 106 HB3 ALA 106 6.852 16.200 -6.925 808 HB2 ALA 106 HB1 ALA 106 7.914 14.998 -6.172 809 HB3 ALA 106 HB2 ALA 106 6.262 14.546 -6.656 810 H ASP 107 H ASP 107 4.141 14.515 -4.371 811 HA ASP 107 HA ASP 107 2.418 16.922 -4.630 812 HB2 ASP 107 HB2 ASP 107 2.507 15.932 -6.891 813 HB3 ASP 107 HB3 ASP 107 2.046 14.362 -6.236 814 H ALA 108 H ALA 108 0.279 16.591 -3.681 815 HA ALA 108 HA ALA 108 0.402 15.249 -1.219 816 HB1 ALA 108 HB3 ALA 108 -2.039 16.243 -2.750 817 HB2 ALA 108 HB1 ALA 108 -1.981 15.852 -1.019 818 HB3 ALA 108 HB2 ALA 108 -1.028 17.210 -1.645 819 H ASP 109 H ASP 109 -0.910 14.087 -4.350 820 HA ASP 109 HA ASP 109 -2.186 11.759 -3.086 821 HB2 ASP 109 HB2 ASP 109 -3.087 12.594 -5.140 822 HB3 ASP 109 HB3 ASP 109 -1.521 12.396 -5.964 823 H SER 110 H SER 110 0.972 12.520 -4.513 824 HA SER 110 HA SER 110 2.005 9.833 -4.407 825 HB2 SER 110 HB2 SER 110 3.605 12.401 -4.116 826 HB3 SER 110 HB3 SER 110 4.146 10.832 -4.713 827 HG SER 110 HG SER 110 2.799 11.100 -6.518 828 H HIS 111 H HIS 111 1.852 12.545 -2.033 829 HA HIS 111 HA HIS 111 3.185 11.237 0.119 830 HB2 HIS 111 HB2 HIS 111 2.780 13.525 0.448 831 HB3 HIS 111 HB3 HIS 111 1.119 13.421 -0.074 832 HD1 HIS 111 HD1 HIS 111 3.185 13.083 3.084 833 HD2 HIS 111 HD2 HIS 111 -0.764 12.733 1.682 834 HE1 HIS 111 HE1 HIS 111 1.709 12.891 5.145 835 H ILE 112 H ILE 112 -0.315 11.242 -0.777 836 HA ILE 112 HA ILE 112 -1.193 9.502 1.271 837 HB ILE 112 HB ILE 112 -2.161 9.975 -1.577 838 HG12 ILE 112 HG12 ILE 112 -2.316 11.889 0.065 839 HG13 ILE 112 HG13 ILE 112 -3.805 11.410 -0.726 840 HG21 ILE 112 HG21 ILE 112 -3.523 8.304 0.542 841 HG22 ILE 112 HG22 ILE 112 -4.325 8.958 -0.912 842 HG23 ILE 112 HG23 ILE 112 -2.999 7.808 -1.081 843 HD11 ILE 112 HD13 ILE 112 -4.081 11.980 1.648 844 HD12 ILE 112 HD11 ILE 112 -4.573 10.313 1.313 845 HD13 ILE 112 HD12 ILE 112 -3.007 10.639 2.108 846 H GLY 113 H GLY 113 -0.113 8.609 -2.095 847 HA2 GLY 113 HA2 GLY 113 -0.397 5.836 -1.769 848 HA3 GLY 113 HA3 GLY 113 0.728 6.632 -2.888 849 H ALA 114 H ALA 114 2.374 7.938 -0.962 850 HA ALA 114 HA ALA 114 4.232 5.852 -0.285 851 HB1 ALA 114 HB3 ALA 114 5.479 7.776 0.685 852 HB2 ALA 114 HB1 ALA 114 4.912 8.117 -0.952 853 HB3 ALA 114 HB2 ALA 114 4.052 8.806 0.423 854 H ILE 115 H ILE 115 2.209 8.023 1.816 855 HA ILE 115 HA ILE 115 2.793 6.979 4.274 856 HB ILE 115 HB ILE 115 0.488 8.251 2.989 857 HG12 ILE 115 HG12 ILE 115 2.372 9.709 3.659 858 HG13 ILE 115 HG13 ILE 115 0.861 10.124 4.450 859 HG21 ILE 115 HG21 ILE 115 -0.695 8.484 5.173 860 HG22 ILE 115 HG22 ILE 115 -0.764 6.929 4.352 861 HG23 ILE 115 HG23 ILE 115 0.337 7.126 5.743 862 HD11 ILE 115 HD13 ILE 115 2.727 10.313 5.978 863 HD12 ILE 115 HD11 ILE 115 1.592 9.066 6.522 864 HD13 ILE 115 HD12 ILE 115 3.124 8.607 5.733 865 H GLN 116 H GLN 116 0.301 5.956 1.851 866 HA GLN 116 HA GLN 116 -0.815 3.832 3.392 867 HB2 GLN 116 HB2 GLN 116 -0.889 4.545 0.442 868 HB3 GLN 116 HB3 GLN 116 -1.768 3.166 1.095 869 HG2 GLN 116 HG2 GLN 116 -2.089 6.004 2.131 870 HG3 GLN 116 HG3 GLN 116 -3.115 5.296 0.888 871 HE21 GLN 116 HE22 GLN 116 -3.251 6.090 4.044 872 HE22 GLN 116 HE21 GLN 116 -4.230 4.790 4.670 873 H ALA 117 H ALA 117 2.242 3.946 1.901 874 HA ALA 117 HA ALA 117 2.382 1.024 1.724 875 HB1 ALA 117 HB3 ALA 117 4.422 3.114 0.817 876 HB2 ALA 117 HB1 ALA 117 4.566 1.362 0.606 877 HB3 ALA 117 HB2 ALA 117 3.302 2.261 -0.256 878 H LEU 118 H LEU 118 3.767 3.888 3.393 879 HA LEU 118 HA LEU 118 5.527 2.123 4.836 880 HB2 LEU 118 HB2 LEU 118 6.224 4.033 6.048 881 HB3 LEU 118 HB3 LEU 118 6.189 4.283 4.291 882 HG LEU 118 HG LEU 118 4.276 5.641 4.426 883 HD11 LEU 118 HD11 LEU 118 4.486 5.322 7.459 884 HD12 LEU 118 HD12 LEU 118 3.664 6.681 6.656 885 HD13 LEU 118 HD13 LEU 118 3.036 5.105 6.447 886 HD21 LEU 118 HD23 LEU 118 6.546 6.623 4.533 887 HD22 LEU 118 HD21 LEU 118 5.479 7.562 5.586 888 HD23 LEU 118 HD22 LEU 118 6.579 6.396 6.289 889 H SER 119 H SER 119 2.359 3.385 5.442 890 HA SER 119 HA SER 119 2.101 2.558 8.128 891 HB2 SER 119 HB2 SER 119 -0.386 2.241 7.543 892 HB3 SER 119 HB3 SER 119 0.340 3.844 7.360 893 HG SER 119 HG SER 119 0.430 3.609 5.199 894 H GLU 120 H GLU 120 2.484 0.469 5.330 895 HA GLU 120 HA GLU 120 1.357 -1.896 6.493 896 HB2 GLU 120 HB2 GLU 120 3.590 -1.630 4.460 897 HB3 GLU 120 HB3 GLU 120 2.723 -3.107 4.830 898 HG2 GLU 120 HG2 GLU 120 1.314 -0.622 3.800 899 HG3 GLU 120 HG3 GLU 120 1.992 -1.834 2.721 900 H LEU 121 H LEU 121 4.153 -0.001 7.027 901 HA LEU 121 HA LEU 121 5.541 -2.104 8.632 902 HB2 LEU 121 HB2 LEU 121 6.591 0.582 7.652 903 HB3 LEU 121 HB3 LEU 121 7.513 -0.664 8.470 904 HG LEU 121 HG LEU 121 6.355 -0.693 5.658 905 HD11 LEU 121 HD11 LEU 121 8.732 -0.916 5.013 906 HD12 LEU 121 HD12 LEU 121 8.446 0.548 5.967 907 HD13 LEU 121 HD13 LEU 121 9.208 -0.870 6.722 908 HD21 LEU 121 HD23 LEU 121 7.395 -2.943 5.351 909 HD22 LEU 121 HD21 LEU 121 7.811 -3.000 7.070 910 HD23 LEU 121 HD22 LEU 121 6.110 -3.011 6.556 911 H LEU 122 H LEU 122 5.069 1.470 8.825 912 HA LEU 122 HA LEU 122 5.502 1.804 11.566 913 HB2 LEU 122 HB2 LEU 122 3.882 3.322 9.472 914 HB3 LEU 122 HB3 LEU 122 3.937 3.847 11.129 915 HG LEU 122 HG LEU 122 5.455 5.102 9.703 916 HD11 LEU 122 HD11 LEU 122 7.356 5.134 11.180 917 HD12 LEU 122 HD12 LEU 122 5.914 4.808 12.152 918 HD13 LEU 122 HD13 LEU 122 7.025 3.484 11.738 919 HD21 LEU 122 HD23 LEU 122 7.157 2.590 9.472 920 HD22 LEU 122 HD21 LEU 122 6.148 3.273 8.172 921 HD23 LEU 122 HD22 LEU 122 7.465 4.212 8.828 922 H CYS 123 H CYS 123 2.537 0.559 10.114 923 HA CYS 123 HA CYS 123 1.212 0.920 12.756 924 HB2 CYS 123 HB2 CYS 123 -0.168 0.581 10.068 925 HB3 CYS 123 HB3 CYS 123 -0.913 0.964 11.618 926 HG CYS 123 HG CYS 123 0.291 3.258 11.981 927 H GLU 124 H GLU 124 3.111 -1.153 12.008 928 HA GLU 124 HA GLU 124 1.370 -3.447 12.662 929 HB2 GLU 124 HB2 GLU 124 3.496 -3.406 10.503 930 HB3 GLU 124 HB3 GLU 124 2.976 -4.898 11.288 931 HG2 GLU 124 HG2 GLU 124 1.159 -2.965 9.818 932 HG3 GLU 124 HG3 GLU 124 1.806 -4.470 9.152 933 H GLU 125 H GLU 125 1.813 -3.651 14.674 934 HA GLU 125 HA GLU 125 4.222 -2.968 15.955 935 HB2 GLU 125 HB2 GLU 125 3.368 -4.100 17.909 936 HB3 GLU 125 HB3 GLU 125 2.098 -3.167 17.119 937 HG2 GLU 125 HG2 GLU 125 1.234 -5.282 16.074 938 HG3 GLU 125 HG3 GLU 125 2.469 -6.191 16.948 939 H GLU 126 H GLU 126 3.362 -5.908 14.261 940 HA GLU 126 HA GLU 126 5.386 -7.647 15.217 941 HB2 GLU 126 HB2 GLU 126 4.072 -7.445 12.476 942 HB3 GLU 126 HB3 GLU 126 5.075 -8.797 13.002 943 HG2 GLU 126 HG2 GLU 126 2.501 -7.902 14.344 944 HG3 GLU 126 HG3 GLU 126 2.615 -9.198 13.155 945 H ILE 127 H ILE 127 5.293 -5.245 12.588 946 HA ILE 127 HA ILE 127 7.993 -5.724 11.682 947 HB ILE 127 HB ILE 127 5.882 -3.700 11.095 948 HG12 ILE 127 HG12 ILE 127 6.068 -4.500 8.844 949 HG13 ILE 127 HG13 ILE 127 7.515 -5.442 9.224 950 HG21 ILE 127 HG21 ILE 127 7.546 -2.722 9.412 951 HG22 ILE 127 HG22 ILE 127 7.762 -2.262 11.102 952 HG23 ILE 127 HG23 ILE 127 8.807 -3.504 10.369 953 HD11 ILE 127 HD13 ILE 127 4.736 -6.053 10.288 954 HD12 ILE 127 HD11 ILE 127 5.483 -6.813 8.871 955 HD13 ILE 127 HD12 ILE 127 6.200 -7.058 10.468 956 H LEU 128 H LEU 128 6.426 -3.179 13.779 957 HA LEU 128 HA LEU 128 8.625 -1.661 14.241 958 HB2 LEU 128 HB2 LEU 128 6.282 -2.365 16.020 959 HB3 LEU 128 HB3 LEU 128 7.625 -1.451 16.682 960 HG LEU 128 HG LEU 128 7.423 0.181 14.821 961 HD11 LEU 128 HD11 LEU 128 5.375 0.456 13.604 962 HD12 LEU 128 HD12 LEU 128 6.087 -1.099 13.195 963 HD13 LEU 128 HD13 LEU 128 4.697 -1.021 14.308 964 HD21 LEU 128 HD23 LEU 128 5.528 1.386 15.869 965 HD22 LEU 128 HD21 LEU 128 4.965 -0.125 16.618 966 HD23 LEU 128 HD22 LEU 128 6.509 0.593 17.113 967 H GLU 129 H GLU 129 7.979 -4.707 16.006 968 HA GLU 129 HA GLU 129 10.239 -4.260 17.691 969 HB2 GLU 129 HB2 GLU 129 9.759 -6.156 18.804 970 HB3 GLU 129 HB3 GLU 129 8.175 -5.761 18.152 971 HG2 GLU 129 HG2 GLU 129 8.597 -7.442 16.313 972 HG3 GLU 129 HG3 GLU 129 10.140 -7.841 17.086 973 H GLN 130 H GLN 130 9.832 -5.766 14.488 974 HA GLN 130 HA GLN 130 12.352 -7.177 14.592 975 HB2 GLN 130 HB2 GLN 130 10.305 -6.605 12.424 976 HB3 GLN 130 HB3 GLN 130 11.823 -7.475 12.116 977 HG2 GLN 130 HG2 GLN 130 11.286 -9.181 13.731 978 HG3 GLN 130 HG3 GLN 130 9.805 -8.343 14.209 979 HE21 GLN 130 HE22 GLN 130 7.997 -8.340 12.791 980 HE22 GLN 130 HE21 GLN 130 7.855 -9.496 11.472 981 H LEU 131 H LEU 131 11.137 -4.019 13.441 982 HA LEU 131 HA LEU 131 13.639 -3.128 12.286 983 HB2 LEU 131 HB2 LEU 131 11.489 -1.525 13.712 984 HB3 LEU 131 HB3 LEU 131 12.794 -0.861 12.734 985 HG LEU 131 HG LEU 131 10.591 -2.641 11.610 986 HD11 LEU 131 HD11 LEU 131 9.490 -0.554 10.952 987 HD12 LEU 131 HD12 LEU 131 9.731 -0.609 12.717 988 HD13 LEU 131 HD13 LEU 131 10.791 0.393 11.713 989 HD21 LEU 131 HD23 LEU 131 12.600 -2.517 10.198 990 HD22 LEU 131 HD21 LEU 131 11.248 -1.640 9.457 991 HD23 LEU 131 HD22 LEU 131 12.546 -0.746 10.268 992 H LEU 132 H LEU 132 12.063 -2.610 15.489 993 HA LEU 132 HA LEU 132 14.150 -1.166 16.652 994 HB2 LEU 132 HB2 LEU 132 12.071 -2.989 17.882 995 HB3 LEU 132 HB3 LEU 132 13.256 -2.193 18.900 996 HG LEU 132 HG LEU 132 11.434 -0.641 17.028 997 HD11 LEU 132 HD11 LEU 132 10.078 -0.126 19.018 998 HD12 LEU 132 HD12 LEU 132 10.071 -1.858 18.665 999 HD13 LEU 132 HD13 LEU 132 11.073 -1.233 19.994 1000 HD21 LEU 132 HD23 LEU 132 12.029 1.270 18.489 1001 HD22 LEU 132 HD21 LEU 132 13.115 0.224 19.427 1002 HD23 LEU 132 HD22 LEU 132 13.470 0.596 17.727 1003 H THR 133 H THR 133 13.964 -4.681 16.355 1004 HA THR 133 HA THR 133 16.327 -5.065 18.042 1005 HB THR 133 HB THR 133 15.905 -7.487 17.488 1006 HG1 THR 133 HG1 THR 133 13.456 -6.558 16.450 1007 HG21 THR 133 HG23 THR 133 13.585 -5.879 18.659 1008 HG22 THR 133 HG21 THR 133 13.768 -7.636 18.787 1009 HG23 THR 133 HG22 THR 133 14.968 -6.562 19.534 1010 H ALA 134 H ALA 134 16.055 -3.976 14.888 1011 HA ALA 134 HA ALA 134 17.912 -5.555 13.473 1012 HB1 ALA 134 HB3 ALA 134 18.154 -3.629 11.996 1013 HB2 ALA 134 HB1 ALA 134 16.442 -3.848 12.407 1014 HB3 ALA 134 HB2 ALA 134 17.400 -2.560 13.185 1015 H SER 135 H SER 135 20.038 -5.601 13.374 1016 HA SER 135 HA SER 135 21.679 -3.705 14.993 1017 HB2 SER 135 HB2 SER 135 22.181 -6.673 14.536 1018 HB3 SER 135 HB3 SER 135 23.164 -5.569 15.511 1019 HG SER 135 HG SER 135 20.447 -6.293 15.986 1020 H SER 136 H SER 136 20.802 -4.213 11.914 1021 HA SER 136 HA SER 136 23.316 -3.179 10.883 1022 HB2 SER 136 HB2 SER 136 23.421 -4.859 9.055 1023 HB3 SER 136 HB3 SER 136 23.688 -5.589 10.643 1024 HG SER 136 HG SER 136 22.267 -6.883 9.561 1025 H GLU 137 H GLU 137 22.984 -2.080 8.884 1026 HA GLU 137 HA GLU 137 20.345 -1.070 8.325 1027 HB2 GLU 137 HB2 GLU 137 22.943 -1.095 6.729 1028 HB3 GLU 137 HB3 GLU 137 21.473 -0.214 6.218 1029 HG2 GLU 137 HG2 GLU 137 21.458 1.177 8.019 1030 HG3 GLU 137 HG3 GLU 137 22.696 0.275 8.909 1031 H LYS 138 H LYS 138 22.224 -3.864 7.174 1032 HA LYS 138 HA LYS 138 20.591 -4.577 5.010 1033 HB2 LYS 138 HB2 LYS 138 22.807 -5.578 5.470 1034 HB3 LYS 138 HB3 LYS 138 22.168 -6.355 6.919 1035 HG2 LYS 138 HG2 LYS 138 22.387 -7.950 5.108 1036 HG3 LYS 138 HG3 LYS 138 20.692 -7.774 5.554 1037 HD2 LYS 138 HD2 LYS 138 20.310 -6.304 3.592 1038 HD3 LYS 138 HD3 LYS 138 22.016 -6.424 3.146 1039 HE2 LYS 138 HE2 LYS 138 20.061 -8.767 3.332 1040 HE3 LYS 138 HE3 LYS 138 20.450 -7.905 1.842 1041 HZ1 LYS 138 HZ3 LYS 138 22.396 -9.445 3.458 1042 HZ2 LYS 138 HZ1 LYS 138 21.756 -9.903 2.035 1043 HZ3 LYS 138 HZ2 LYS 138 22.754 -8.619 2.090 1044 H GLN 139 H GLN 139 20.081 -5.332 8.540 1045 HA GLN 139 HA GLN 139 17.900 -7.050 7.983 1046 HB2 GLN 139 HB2 GLN 139 19.347 -7.306 9.883 1047 HB3 GLN 139 HB3 GLN 139 19.122 -5.624 10.370 1048 HG2 GLN 139 HG2 GLN 139 17.965 -7.007 11.829 1049 HG3 GLN 139 HG3 GLN 139 16.822 -6.036 10.896 1050 HE21 GLN 139 HE22 GLN 139 15.538 -7.209 9.172 1051 HE22 GLN 139 HE21 GLN 139 15.336 -8.946 9.272 1052 H LEU 140 H LEU 140 18.240 -3.504 8.497 1053 HA LEU 140 HA LEU 140 15.380 -3.073 8.852 1054 HB2 LEU 140 HB2 LEU 140 17.738 -1.326 8.134 1055 HB3 LEU 140 HB3 LEU 140 16.099 -0.690 8.085 1056 HG LEU 140 HG LEU 140 17.381 -1.922 10.542 1057 HD11 LEU 140 HD11 LEU 140 16.978 1.034 9.927 1058 HD12 LEU 140 HD12 LEU 140 17.742 0.312 11.356 1059 HD13 LEU 140 HD13 LEU 140 18.520 0.172 9.778 1060 HD21 LEU 140 HD23 LEU 140 14.853 -0.276 10.315 1061 HD22 LEU 140 HD21 LEU 140 14.943 -2.017 10.675 1062 HD23 LEU 140 HD22 LEU 140 15.598 -0.852 11.817 1063 H ALA 141 H ALA 141 17.645 -2.680 6.075 1064 HA ALA 141 HA ALA 141 15.777 -2.304 4.045 1065 HB1 ALA 141 HB3 ALA 141 18.237 -2.049 3.816 1066 HB2 ALA 141 HB1 ALA 141 18.415 -3.817 3.876 1067 HB3 ALA 141 HB2 ALA 141 17.539 -3.056 2.531 1068 H ASP 142 H ASP 142 16.754 -5.452 5.530 1069 HA ASP 142 HA ASP 142 15.397 -7.118 3.698 1070 HB2 ASP 142 HB2 ASP 142 16.829 -8.122 5.341 1071 HB3 ASP 142 HB3 ASP 142 15.901 -7.433 6.671 1072 H ILE 143 H ILE 143 14.139 -5.420 6.650 1073 HA ILE 143 HA ILE 143 11.515 -6.475 6.439 1074 HB ILE 143 HB ILE 143 12.764 -4.125 7.888 1075 HG12 ILE 143 HG12 ILE 143 11.714 -6.814 8.905 1076 HG13 ILE 143 HG13 ILE 143 13.404 -6.522 8.514 1077 HG21 ILE 143 HG21 ILE 143 10.431 -3.578 7.565 1078 HG22 ILE 143 HG22 ILE 143 9.933 -5.199 8.117 1079 HG23 ILE 143 HG23 ILE 143 10.694 -4.048 9.242 1080 HD11 ILE 143 HD13 ILE 143 13.437 -4.685 10.243 1081 HD12 ILE 143 HD11 ILE 143 11.824 -5.257 10.773 1082 HD13 ILE 143 HD12 ILE 143 13.228 -6.331 10.846 1083 H ILE 144 H ILE 144 13.087 -3.554 5.125 1084 HA ILE 144 HA ILE 144 10.800 -2.425 3.837 1085 HB ILE 144 HB ILE 144 13.715 -2.491 2.941 1086 HG12 ILE 144 HG12 ILE 144 13.506 -1.291 5.017 1087 HG13 ILE 144 HG13 ILE 144 13.828 -0.174 3.702 1088 HG21 ILE 144 HG21 ILE 144 13.176 -0.541 1.488 1089 HG22 ILE 144 HG22 ILE 144 12.517 -2.076 0.936 1090 HG23 ILE 144 HG23 ILE 144 11.451 -0.899 1.718 1091 HD11 ILE 144 HD13 ILE 144 12.185 0.873 4.985 1092 HD12 ILE 144 HD11 ILE 144 11.280 0.214 3.614 1093 HD13 ILE 144 HD12 ILE 144 11.233 -0.620 5.180 1094 H SER 145 H SER 145 13.073 -4.940 2.726 1095 HA SER 145 HA SER 145 12.002 -4.999 0.137 1096 HB2 SER 145 HB2 SER 145 13.607 -7.151 1.592 1097 HB3 SER 145 HB3 SER 145 13.385 -7.037 -0.161 1098 HG SER 145 HG SER 145 14.711 -5.191 1.560 1099 H ARG 146 H ARG 146 10.915 -6.747 3.025 1100 HA ARG 146 HA ARG 146 9.416 -8.762 1.681 1101 HB2 ARG 146 HB2 ARG 146 8.371 -7.579 4.246 1102 HB3 ARG 146 HB3 ARG 146 8.441 -9.268 3.732 1103 HG2 ARG 146 HG2 ARG 146 10.954 -9.135 4.117 1104 HG3 ARG 146 HG3 ARG 146 10.639 -7.481 4.731 1105 HD2 ARG 146 HD2 ARG 146 9.245 -8.300 6.503 1106 HD3 ARG 146 HD3 ARG 146 9.388 -9.974 5.907 1107 HE ARG 146 HE ARG 146 12.018 -9.067 6.335 1108 HH11 ARG 146 HH11 ARG 146 9.137 -9.711 8.336 1109 HH12 ARG 146 HH12 ARG 146 10.075 -10.042 9.764 1110 HH21 ARG 146 HH21 ARG 146 13.171 -9.567 8.079 1111 HH22 ARG 146 HH22 ARG 146 12.448 -10.015 9.625 1112 H GLY 147 H GLY 147 8.827 -5.390 2.433 1113 HA2 GLY 147 HA2 GLY 147 6.038 -5.410 2.621 1114 HA3 GLY 147 HA3 GLY 147 7.077 -4.008 2.315 Start of MODEL 5 1 H MET 1 H1 MET 1 2.028 -1.418 -0.028 2 HA MET 1 HA MET 1 2.052 -1.454 -2.993 3 HB2 MET 1 HB2 MET 1 1.935 0.870 -1.433 4 HB3 MET 1 HB3 MET 1 3.674 0.670 -1.702 5 HG2 MET 1 HG2 MET 1 2.672 2.038 -3.453 6 HG3 MET 1 HG3 MET 1 3.329 0.550 -4.117 7 HE1 MET 1 HE3 MET 1 0.236 2.799 -3.539 8 HE2 MET 1 HE1 MET 1 -1.146 1.726 -3.846 9 HE3 MET 1 HE2 MET 1 -0.178 1.521 -2.373 10 H ARG 2 H ARG 2 4.320 -1.272 -3.910 11 HA ARG 2 HA ARG 2 6.155 -3.159 -2.649 12 HB2 ARG 2 HB2 ARG 2 6.323 -1.206 -4.987 13 HB3 ARG 2 HB3 ARG 2 7.747 -2.047 -4.377 14 HG2 ARG 2 HG2 ARG 2 6.958 -3.237 -6.286 15 HG3 ARG 2 HG3 ARG 2 6.692 -4.225 -4.848 16 HD2 ARG 2 HD2 ARG 2 4.789 -4.380 -6.347 17 HD3 ARG 2 HD3 ARG 2 4.334 -3.594 -4.828 18 HE ARG 2 HE ARG 2 5.086 -1.787 -7.018 19 HH11 ARG 2 HH21 ARG 2 2.357 -3.564 -5.611 20 HH12 ARG 2 HH22 ARG 2 1.161 -2.456 -6.170 21 HH21 ARG 2 HH12 ARG 2 3.491 -0.317 -7.785 22 HH22 ARG 2 HH11 ARG 2 1.824 -0.580 -7.449 23 H LEU 3 H LEU 3 6.992 -2.506 -0.689 24 HA LEU 3 HA LEU 3 7.291 0.282 0.071 25 HB2 LEU 3 HB2 LEU 3 8.261 -2.357 1.156 26 HB3 LEU 3 HB3 LEU 3 9.107 -0.900 1.657 27 HG LEU 3 HG LEU 3 7.357 -1.666 3.238 28 HD11 LEU 3 HD11 LEU 3 8.184 0.650 3.216 29 HD12 LEU 3 HD12 LEU 3 6.885 1.120 2.090 30 HD13 LEU 3 HD13 LEU 3 6.504 0.542 3.725 31 HD21 LEU 3 HD23 LEU 3 5.333 -0.711 1.174 32 HD22 LEU 3 HD21 LEU 3 5.632 -2.398 1.590 33 HD23 LEU 3 HD22 LEU 3 5.006 -1.294 2.813 34 H SER 4 H SER 4 9.518 -2.204 -1.282 35 HA SER 4 HA SER 4 11.834 -0.762 -1.296 36 HB2 SER 4 HB2 SER 4 11.091 -2.539 -3.627 37 HB3 SER 4 HB3 SER 4 12.631 -2.430 -2.750 38 HG SER 4 HG SER 4 11.345 -4.322 -2.307 39 H ASP 5 H ASP 5 9.034 -0.149 -3.408 40 HA ASP 5 HA ASP 5 10.402 1.216 -5.496 41 HB2 ASP 5 HB2 ASP 5 8.047 0.431 -5.608 42 HB3 ASP 5 HB3 ASP 5 7.590 1.663 -4.425 43 H TYR 6 H TYR 6 9.725 2.143 -2.185 44 HA TYR 6 HA TYR 6 9.981 5.027 -2.814 45 HB2 TYR 6 HB2 TYR 6 8.904 3.538 -0.410 46 HB3 TYR 6 HB3 TYR 6 9.062 5.289 -0.471 47 HD1 TYR 6 HD1 TYR 6 7.695 6.695 -1.891 48 HD2 TYR 6 HD2 TYR 6 7.009 2.429 -1.601 49 HE1 TYR 6 HE1 TYR 6 5.505 6.963 -3.025 50 HE2 TYR 6 HE2 TYR 6 4.825 2.708 -2.684 51 HH TYR 6 HH TYR 6 3.308 4.207 -3.675 52 H PHE 7 H PHE 7 12.147 2.572 -1.606 53 HA PHE 7 HA PHE 7 13.557 4.652 0.050 54 HB2 PHE 7 HB2 PHE 7 13.519 1.655 0.426 55 HB3 PHE 7 HB3 PHE 7 14.569 2.771 1.282 56 HD1 PHE 7 HD1 PHE 7 10.961 2.052 0.633 57 HD2 PHE 7 HD2 PHE 7 13.828 3.583 3.455 58 HE1 PHE 7 HE1 PHE 7 9.136 2.501 2.227 59 HE2 PHE 7 HE2 PHE 7 11.972 4.091 5.020 60 HZ PHE 7 HZ PHE 7 9.636 3.563 4.423 61 HA PRO 8 HA PRO 8 15.784 4.381 -3.900 62 HB2 PRO 8 HB2 PRO 8 17.512 6.379 -2.431 63 HB3 PRO 8 HB3 PRO 8 17.028 6.347 -4.150 64 HG2 PRO 8 HG2 PRO 8 15.702 7.875 -2.313 65 HG3 PRO 8 HG3 PRO 8 14.822 7.018 -3.618 66 HD2 PRO 8 HD2 PRO 8 14.942 6.338 -0.727 67 HD3 PRO 8 HD3 PRO 8 13.690 6.036 -1.957 68 H GLU 9 H GLU 9 18.243 4.820 -1.344 69 HA GLU 9 HA GLU 9 19.435 2.202 -1.732 70 HB2 GLU 9 HB2 GLU 9 20.090 3.373 -3.870 71 HB3 GLU 9 HB3 GLU 9 20.826 4.640 -2.905 72 HG2 GLU 9 HG2 GLU 9 22.602 3.203 -3.587 73 HG3 GLU 9 HG3 GLU 9 22.335 2.847 -1.883 74 H SER 10 H SER 10 21.064 5.289 -1.092 75 HA SER 10 HA SER 10 22.204 4.459 1.347 76 HB2 SER 10 HB2 SER 10 21.661 7.354 0.650 77 HB3 SER 10 HB3 SER 10 23.102 6.653 1.395 78 HG SER 10 HG SER 10 23.641 5.767 -0.629 79 H SER 11 H SER 11 19.083 4.611 0.923 80 HA SER 11 HA SER 11 18.015 6.629 2.654 81 HB2 SER 11 HB2 SER 11 16.681 4.219 1.384 82 HB3 SER 11 HB3 SER 11 15.950 5.785 1.779 83 HG SER 11 HG SER 11 17.183 6.734 0.167 84 H ILE 12 H ILE 12 19.575 3.803 3.604 85 HA ILE 12 HA ILE 12 17.713 3.327 5.861 86 HB ILE 12 HB ILE 12 19.219 1.378 4.091 87 HG12 ILE 12 HG12 ILE 12 16.301 2.193 4.411 88 HG13 ILE 12 HG13 ILE 12 17.271 2.108 2.942 89 HG21 ILE 12 HG21 ILE 12 18.303 -0.343 5.604 90 HG22 ILE 12 HG22 ILE 12 19.316 0.797 6.481 91 HG23 ILE 12 HG23 ILE 12 17.549 0.942 6.596 92 HD11 ILE 12 HD13 ILE 12 17.324 -0.377 3.205 93 HD12 ILE 12 HD11 ILE 12 16.153 -0.171 4.549 94 HD13 ILE 12 HD12 ILE 12 15.723 0.326 2.896 95 H SER 13 H SER 13 18.822 3.559 7.826 96 HA SER 13 HA SER 13 21.700 3.003 7.878 97 HB2 SER 13 HB2 SER 13 22.111 5.255 8.994 98 HB3 SER 13 HB3 SER 13 21.768 5.315 7.261 99 HG SER 13 HG SER 13 20.581 6.892 8.342 100 H VAL 14 H VAL 14 22.576 2.863 9.954 101 HA VAL 14 HA VAL 14 20.745 2.805 12.254 102 HB VAL 14 HB VAL 14 22.863 0.708 11.609 103 HG11 VAL 14 HG11 VAL 14 22.819 1.217 14.029 104 HG12 VAL 14 HG12 VAL 14 21.053 1.021 14.058 105 HG13 VAL 14 HG13 VAL 14 22.109 -0.371 13.731 106 HG21 VAL 14 HG23 VAL 14 20.938 -0.900 11.724 107 HG22 VAL 14 HG21 VAL 14 19.834 0.475 11.846 108 HG23 VAL 14 HG22 VAL 14 20.795 0.229 10.373 109 H ILE 15 H ILE 15 21.691 3.914 13.914 110 HA ILE 15 HA ILE 15 24.401 5.103 13.517 111 HB ILE 15 HB ILE 15 21.689 6.370 14.103 112 HG12 ILE 15 HG12 ILE 15 23.551 6.685 11.724 113 HG13 ILE 15 HG13 ILE 15 21.901 6.041 11.741 114 HG21 ILE 15 HG21 ILE 15 24.378 7.786 14.066 115 HG22 ILE 15 HG22 ILE 15 22.774 8.525 14.358 116 HG23 ILE 15 HG23 ILE 15 23.382 7.393 15.491 117 HD11 ILE 15 HD13 ILE 15 21.752 8.281 10.892 118 HD12 ILE 15 HD11 ILE 15 21.128 8.338 12.562 119 HD13 ILE 15 HD12 ILE 15 22.757 8.927 12.207 120 H HIS 16 H HIS 16 25.467 5.538 15.542 121 HA HIS 16 HA HIS 16 24.671 3.986 17.810 122 HB2 HIS 16 HB2 HIS 16 27.000 4.646 17.381 123 HB3 HIS 16 HB3 HIS 16 26.585 6.348 17.606 124 HD1 HIS 16 HD1 HIS 16 26.034 7.115 20.181 125 HD2 HIS 16 HD2 HIS 16 27.293 3.135 19.587 126 HE1 HIS 16 HE1 HIS 16 26.642 6.200 22.483 127 H SER 17 H SER 17 24.259 7.504 17.022 128 HA SER 17 HA SER 17 22.073 7.854 18.847 129 HB2 SER 17 HB2 SER 17 23.422 9.676 20.144 130 HB3 SER 17 HB3 SER 17 23.554 7.995 20.646 131 HG SER 17 HG SER 17 25.439 9.459 19.118 132 H ALA 18 H ALA 18 21.166 10.068 18.360 133 HA ALA 18 HA ALA 18 22.361 11.315 15.935 134 HB1 ALA 18 HB3 ALA 18 19.900 11.160 15.936 135 HB2 ALA 18 HB1 ALA 18 19.825 12.102 17.437 136 HB3 ALA 18 HB2 ALA 18 20.454 12.839 15.967 137 H LYS 19 H LYS 19 23.208 13.440 16.042 138 HA LYS 19 HA LYS 19 24.695 14.103 18.365 139 HB2 LYS 19 HB2 LYS 19 25.315 14.662 16.084 140 HB3 LYS 19 HB3 LYS 19 23.944 15.725 15.919 141 HG2 LYS 19 HG2 LYS 19 25.930 16.250 18.140 142 HG3 LYS 19 HG3 LYS 19 26.390 16.645 16.488 143 HD2 LYS 19 HD2 LYS 19 23.839 17.686 17.770 144 HD3 LYS 19 HD3 LYS 19 25.377 18.548 17.828 145 HE2 LYS 19 HE2 LYS 19 25.462 18.799 15.440 146 HE3 LYS 19 HE3 LYS 19 24.133 17.663 15.195 147 HZ1 LYS 19 HZ3 LYS 19 23.836 20.291 16.516 148 HZ2 LYS 19 HZ1 LYS 19 23.406 19.953 14.978 149 HZ3 LYS 19 HZ2 LYS 19 22.625 19.214 16.212 150 H ASP 20 H ASP 20 21.544 15.283 17.230 151 HA ASP 20 HA ASP 20 20.534 15.825 19.827 152 HB2 ASP 20 HB2 ASP 20 20.263 18.069 19.912 153 HB3 ASP 20 HB3 ASP 20 21.951 17.981 19.396 154 H TRP 21 H TRP 21 18.369 17.128 19.402 155 HA TRP 21 HA TRP 21 16.877 15.403 17.756 156 HB2 TRP 21 HB2 TRP 21 15.138 17.402 18.414 157 HB3 TRP 21 HB3 TRP 21 15.555 16.034 19.439 158 HD1 TRP 21 HD1 TRP 21 16.426 19.672 18.908 159 HE1 TRP 21 HE1 TRP 21 17.366 20.744 21.034 160 HE3 TRP 21 HE3 TRP 21 16.805 15.474 21.744 161 HZ2 TRP 21 HZ2 TRP 21 18.267 19.833 23.641 162 HZ3 TRP 21 HZ3 TRP 21 17.797 15.568 24.012 163 HH2 TRP 21 HH2 TRP 21 18.522 17.742 24.976 164 H GLN 22 H GLN 22 18.263 18.644 17.050 165 HA GLN 22 HA GLN 22 16.828 19.089 14.539 166 HB2 GLN 22 HB2 GLN 22 19.590 19.958 15.453 167 HB3 GLN 22 HB3 GLN 22 18.782 20.500 13.995 168 HG2 GLN 22 HG2 GLN 22 17.086 21.654 15.178 169 HG3 GLN 22 HG3 GLN 22 17.462 20.858 16.710 170 HE21 GLN 22 HE22 GLN 22 19.718 21.206 17.570 171 HE22 GLN 22 HE21 GLN 22 20.368 22.846 17.458 172 H GLU 23 H GLU 23 20.026 17.549 15.433 173 HA GLU 23 HA GLU 23 20.666 16.688 12.836 174 HB2 GLU 23 HB2 GLU 23 22.083 16.637 15.036 175 HB3 GLU 23 HB3 GLU 23 21.301 15.071 15.310 176 HG2 GLU 23 HG2 GLU 23 23.206 14.372 14.221 177 HG3 GLU 23 HG3 GLU 23 22.142 14.516 12.855 178 H ALA 24 H ALA 24 18.636 15.136 15.300 179 HA ALA 24 HA ALA 24 18.448 12.601 14.068 180 HB1 ALA 24 HB3 ALA 24 16.565 12.259 15.564 181 HB2 ALA 24 HB1 ALA 24 17.813 13.219 16.404 182 HB3 ALA 24 HB2 ALA 24 16.354 14.011 15.774 183 H ILE 25 H ILE 25 16.648 15.629 13.438 184 HA ILE 25 HA ILE 25 14.857 14.412 11.489 185 HB ILE 25 HB ILE 25 15.690 17.323 11.706 186 HG12 ILE 25 HG12 ILE 25 14.279 15.865 13.696 187 HG13 ILE 25 HG13 ILE 25 14.623 17.581 13.611 188 HG21 ILE 25 HG21 ILE 25 13.609 17.763 10.484 189 HG22 ILE 25 HG22 ILE 25 14.623 16.668 9.581 190 HG23 ILE 25 HG23 ILE 25 13.233 16.021 10.452 191 HD11 ILE 25 HD13 ILE 25 12.466 17.924 12.439 192 HD12 ILE 25 HD11 ILE 25 12.158 16.167 12.551 193 HD13 ILE 25 HD12 ILE 25 12.274 17.150 14.019 194 H ASP 26 H ASP 26 17.964 16.260 11.368 195 HA ASP 26 HA ASP 26 18.244 16.313 8.564 196 HB2 ASP 26 HB2 ASP 26 19.720 17.573 10.059 197 HB3 ASP 26 HB3 ASP 26 20.442 16.073 10.646 198 H PHE 27 H PHE 27 19.310 13.742 10.863 199 HA PHE 27 HA PHE 27 20.253 11.993 8.816 200 HB2 PHE 27 HB2 PHE 27 19.508 11.659 11.731 201 HB3 PHE 27 HB3 PHE 27 19.814 10.252 10.730 202 HD1 PHE 27 HD2 PHE 27 21.993 10.569 9.100 203 HD2 PHE 27 HD1 PHE 27 21.493 12.292 13.049 204 HE1 PHE 27 HE2 PHE 27 24.446 10.651 9.390 205 HE2 PHE 27 HE1 PHE 27 23.937 12.303 13.327 206 HZ PHE 27 HZ PHE 27 25.426 11.508 11.510 207 H SER 28 H SER 28 16.953 12.526 10.134 208 HA SER 28 HA SER 28 15.765 10.231 8.876 209 HB2 SER 28 HB2 SER 28 14.431 12.918 9.513 210 HB3 SER 28 HB3 SER 28 13.625 11.404 9.189 211 HG SER 28 HG SER 28 15.412 11.921 11.368 212 H MET 29 H MET 29 16.947 13.278 7.566 213 HA MET 29 HA MET 29 15.380 12.830 5.067 214 HB2 MET 29 HB2 MET 29 16.597 15.334 6.233 215 HB3 MET 29 HB3 MET 29 15.475 15.215 4.869 216 HG2 MET 29 HG2 MET 29 14.496 14.330 7.564 217 HG3 MET 29 HG3 MET 29 14.722 16.038 7.241 218 HE1 MET 29 HE3 MET 29 12.661 12.988 6.840 219 HE2 MET 29 HE1 MET 29 11.562 13.298 5.473 220 HE3 MET 29 HE2 MET 29 13.291 12.942 5.170 221 H VAL 30 H VAL 30 18.753 13.235 6.179 222 HA VAL 30 HA VAL 30 19.706 14.542 3.964 223 HB VAL 30 HB VAL 30 20.981 14.235 6.013 224 HG11 VAL 30 HG11 VAL 30 22.231 12.208 6.527 225 HG12 VAL 30 HG12 VAL 30 20.508 11.817 6.455 226 HG13 VAL 30 HG13 VAL 30 21.575 11.383 5.101 227 HG21 VAL 30 HG23 VAL 30 22.514 13.199 3.591 228 HG22 VAL 30 HG21 VAL 30 22.126 14.896 3.917 229 HG23 VAL 30 HG22 VAL 30 23.195 14.008 5.021 230 H SER 31 H SER 31 19.228 10.970 4.210 231 HA SER 31 HA SER 31 20.545 10.404 1.790 232 HB2 SER 31 HB2 SER 31 18.215 8.914 3.052 233 HB3 SER 31 HB3 SER 31 19.414 8.265 1.914 234 HG SER 31 HG SER 31 20.362 7.738 3.716 235 H LEU 32 H LEU 32 17.457 11.935 2.304 236 HA LEU 32 HA LEU 32 16.574 11.498 -0.492 237 HB2 LEU 32 HB2 LEU 32 15.381 12.994 1.892 238 HB3 LEU 32 HB3 LEU 32 14.678 13.065 0.300 239 HG LEU 32 HG LEU 32 15.119 10.468 1.820 240 HD11 LEU 32 HD11 LEU 32 13.555 11.888 3.054 241 HD12 LEU 32 HD12 LEU 32 12.585 12.135 1.585 242 HD13 LEU 32 HD13 LEU 32 12.706 10.520 2.317 243 HD21 LEU 32 HD23 LEU 32 13.601 9.478 0.226 244 HD22 LEU 32 HD21 LEU 32 13.329 11.036 -0.581 245 HD23 LEU 32 HD22 LEU 32 14.906 10.214 -0.672 246 H LEU 33 H LEU 33 17.780 14.073 1.715 247 HA LEU 33 HA LEU 33 17.673 16.219 -0.031 248 HB2 LEU 33 HB2 LEU 33 18.221 16.286 2.407 249 HB3 LEU 33 HB3 LEU 33 19.812 15.629 2.040 250 HG LEU 33 HG LEU 33 20.370 17.660 0.733 251 HD11 LEU 33 HD11 LEU 33 17.650 18.696 1.621 252 HD12 LEU 33 HD12 LEU 33 18.930 19.646 0.839 253 HD13 LEU 33 HD13 LEU 33 18.155 18.352 -0.046 254 HD21 LEU 33 HD23 LEU 33 20.673 19.103 2.635 255 HD22 LEU 33 HD21 LEU 33 19.397 18.254 3.540 256 HD23 LEU 33 HD22 LEU 33 20.910 17.430 3.125 257 H ASP 34 H ASP 34 20.232 13.803 0.427 258 HA ASP 34 HA ASP 34 22.225 15.006 -1.123 259 HB2 ASP 34 HB2 ASP 34 22.735 13.375 0.602 260 HB3 ASP 34 HB3 ASP 34 21.710 12.161 -0.157 261 H LYS 35 H LYS 35 19.570 13.050 -2.234 262 HA LYS 35 HA LYS 35 20.746 13.300 -4.965 263 HB2 LYS 35 HB2 LYS 35 18.651 11.250 -4.317 264 HB3 LYS 35 HB3 LYS 35 19.613 11.398 -5.770 265 HG2 LYS 35 HG2 LYS 35 20.502 9.532 -4.750 266 HG3 LYS 35 HG3 LYS 35 21.656 10.797 -4.283 267 HD2 LYS 35 HD2 LYS 35 20.719 10.908 -2.056 268 HD3 LYS 35 HD3 LYS 35 19.276 10.024 -2.551 269 HE2 LYS 35 HE2 LYS 35 20.647 8.648 -1.176 270 HE3 LYS 35 HE3 LYS 35 20.556 7.972 -2.805 271 HZ1 LYS 35 HZ3 LYS 35 22.841 9.643 -1.888 272 HZ2 LYS 35 HZ1 LYS 35 22.818 7.991 -1.757 273 HZ3 LYS 35 HZ2 LYS 35 22.772 8.708 -3.229 274 H ASN 36 H ASN 36 19.273 15.200 -3.322 275 HA ASN 36 HA ASN 36 17.799 16.842 -3.729 276 HB2 ASN 36 HB2 ASN 36 19.263 16.751 -5.841 277 HB3 ASN 36 HB3 ASN 36 17.906 15.970 -6.652 278 HD21 ASN 36 HD22 ASN 36 18.557 18.734 -4.523 279 HD22 ASN 36 HD21 ASN 36 17.548 19.889 -5.379 280 H TYR 37 H TYR 37 16.564 14.187 -3.061 281 HA TYR 37 HA TYR 37 13.978 14.166 -4.412 282 HB2 TYR 37 HB2 TYR 37 14.985 12.953 -1.824 283 HB3 TYR 37 HB3 TYR 37 13.323 12.831 -2.335 284 HD1 TYR 37 HD2 TYR 37 16.785 11.548 -2.953 285 HD2 TYR 37 HD1 TYR 37 12.617 11.329 -4.057 286 HE1 TYR 37 HE2 TYR 37 17.240 9.566 -4.358 287 HE2 TYR 37 HE1 TYR 37 13.094 9.399 -5.515 288 HH TYR 37 HH TYR 37 14.741 7.985 -6.376 289 H ILE 38 H ILE 38 15.470 16.143 -1.977 290 HA ILE 38 HA ILE 38 12.995 17.688 -1.597 291 HB ILE 38 HB ILE 38 13.452 17.823 0.855 292 HG12 ILE 38 HG12 ILE 38 15.400 15.541 0.345 293 HG13 ILE 38 HG13 ILE 38 15.841 17.199 0.769 294 HG21 ILE 38 HG21 ILE 38 12.908 14.968 -0.042 295 HG22 ILE 38 HG22 ILE 38 12.437 15.698 1.496 296 HG23 ILE 38 HG23 ILE 38 11.712 16.285 0.014 297 HD11 ILE 38 HD13 ILE 38 16.069 15.803 2.659 298 HD12 ILE 38 HD11 ILE 38 14.723 16.933 2.955 299 HD13 ILE 38 HD12 ILE 38 14.402 15.221 2.556 300 H SER 39 H SER 39 13.562 19.744 -0.448 301 HA SER 39 HA SER 39 16.216 20.853 -1.222 302 HB2 SER 39 HB2 SER 39 13.749 22.352 -0.261 303 HB3 SER 39 HB3 SER 39 15.128 22.985 -1.173 304 HG SER 39 HG SER 39 13.115 21.178 -2.069 305 H GLU 40 H GLU 40 17.301 22.196 0.495 306 HA GLU 40 HA GLU 40 17.410 20.944 3.014 307 HB2 GLU 40 HB2 GLU 40 18.268 23.748 2.205 308 HB3 GLU 40 HB3 GLU 40 18.727 22.937 3.709 309 HG2 GLU 40 HG2 GLU 40 19.810 21.114 2.384 310 HG3 GLU 40 HG3 GLU 40 19.410 21.960 0.898 311 H ASN 41 H ASN 41 15.376 23.684 2.005 312 HA ASN 41 HA ASN 41 14.468 24.523 4.558 313 HB2 ASN 41 HB2 ASN 41 13.958 25.724 2.447 314 HB3 ASN 41 HB3 ASN 41 12.927 24.388 1.919 315 HD21 ASN 41 HD21 ASN 41 10.784 24.164 2.859 316 HD22 ASN 41 HD22 ASN 41 10.140 25.402 3.912 317 H TYR 42 H TYR 42 13.583 21.641 2.668 318 HA TYR 42 HA TYR 42 11.080 21.090 3.896 319 HB2 TYR 42 HB2 TYR 42 12.015 20.111 1.773 320 HB3 TYR 42 HB3 TYR 42 13.143 19.174 2.750 321 HD1 TYR 42 HD1 TYR 42 9.569 19.635 1.888 322 HD2 TYR 42 HD2 TYR 42 12.484 17.177 3.893 323 HE1 TYR 42 HE1 TYR 42 7.930 17.756 1.983 324 HE2 TYR 42 HE2 TYR 42 10.863 15.309 3.989 325 HH TYR 42 HH TYR 42 8.798 14.540 3.301 326 H ILE 43 H ILE 43 14.437 20.120 4.721 327 HA ILE 43 HA ILE 43 13.807 18.507 6.985 328 HB ILE 43 HB ILE 43 16.293 20.176 6.332 329 HG12 ILE 43 HG12 ILE 43 17.001 17.532 6.037 330 HG13 ILE 43 HG13 ILE 43 15.319 17.487 5.487 331 HG21 ILE 43 HG21 ILE 43 16.159 19.611 8.753 332 HG22 ILE 43 HG22 ILE 43 16.009 17.892 8.331 333 HG23 ILE 43 HG23 ILE 43 17.492 18.785 7.935 334 HD11 ILE 43 HD13 ILE 43 17.498 19.315 4.443 335 HD12 ILE 43 HD11 ILE 43 16.942 17.817 3.676 336 HD13 ILE 43 HD12 ILE 43 15.834 19.199 3.805 337 H GLN 44 H GLN 44 14.588 22.035 6.694 338 HA GLN 44 HA GLN 44 14.384 22.379 9.507 339 HB2 GLN 44 HB2 GLN 44 15.649 23.819 7.728 340 HB3 GLN 44 HB3 GLN 44 14.124 24.680 7.561 341 HG2 GLN 44 HG2 GLN 44 15.570 25.827 9.183 342 HG3 GLN 44 HG3 GLN 44 14.171 25.177 10.026 343 HE21 GLN 44 HE22 GLN 44 14.800 24.369 12.060 344 HE22 GLN 44 HE21 GLN 44 16.228 23.408 12.344 345 H ALA 45 H ALA 45 11.918 22.562 6.988 346 HA ALA 45 HA ALA 45 9.876 23.867 8.407 347 HB1 ALA 45 HB3 ALA 45 9.564 21.451 6.551 348 HB2 ALA 45 HB1 ALA 45 8.316 22.620 6.976 349 HB3 ALA 45 HB2 ALA 45 9.715 23.147 6.014 350 H ILE 46 H ILE 46 10.992 20.455 8.601 351 HA ILE 46 HA ILE 46 8.862 19.660 10.390 352 HB ILE 46 HB ILE 46 11.547 18.321 9.947 353 HG12 ILE 46 HG12 ILE 46 9.021 17.550 8.466 354 HG13 ILE 46 HG13 ILE 46 10.152 18.698 7.778 355 HG21 ILE 46 HG21 ILE 46 10.207 17.567 11.924 356 HG22 ILE 46 HG22 ILE 46 8.840 17.218 10.852 357 HG23 ILE 46 HG23 ILE 46 10.348 16.300 10.704 358 HD11 ILE 46 HD13 ILE 46 11.979 17.102 7.854 359 HD12 ILE 46 HD11 ILE 46 10.924 15.862 8.547 360 HD13 ILE 46 HD12 ILE 46 10.614 16.475 6.914 361 H LYS 47 H LYS 47 12.362 20.502 10.748 362 HA LYS 47 HA LYS 47 12.521 20.029 13.509 363 HB2 LYS 47 HB2 LYS 47 13.927 22.057 11.735 364 HB3 LYS 47 HB3 LYS 47 14.395 21.800 13.414 365 HG2 LYS 47 HG2 LYS 47 15.204 19.597 12.973 366 HG3 LYS 47 HG3 LYS 47 14.503 19.584 11.336 367 HD2 LYS 47 HD2 LYS 47 15.951 21.357 10.624 368 HD3 LYS 47 HD3 LYS 47 16.600 21.570 12.270 369 HE2 LYS 47 HE2 LYS 47 17.730 19.446 12.157 370 HE3 LYS 47 HE3 LYS 47 17.033 19.085 10.580 371 HZ1 LYS 47 HZ3 LYS 47 19.288 19.976 10.368 372 HZ2 LYS 47 HZ1 LYS 47 18.252 21.056 9.715 373 HZ3 LYS 47 HZ2 LYS 47 18.901 21.331 11.179 374 H ASP 48 H ASP 48 11.527 23.011 11.760 375 HA ASP 48 HA ASP 48 11.564 24.776 13.922 376 HB2 ASP 48 HB2 ASP 48 11.352 25.485 11.591 377 HB3 ASP 48 HB3 ASP 48 9.744 24.761 11.481 378 H SER 49 H SER 49 8.657 22.964 12.686 379 HA SER 49 HA SER 49 6.963 23.723 14.856 380 HB2 SER 49 HB2 SER 49 6.878 21.212 13.143 381 HB3 SER 49 HB3 SER 49 5.532 21.924 14.052 382 HG SER 49 HG SER 49 5.489 22.508 11.830 383 H THR 50 H THR 50 9.156 20.882 14.388 384 HA THR 50 HA THR 50 8.447 19.494 16.690 385 HB THR 50 HB THR 50 11.160 19.639 15.349 386 HG1 THR 50 HG1 THR 50 9.667 18.983 13.899 387 HG21 THR 50 HG23 THR 50 11.338 17.277 16.240 388 HG22 THR 50 HG21 THR 50 11.453 18.543 17.474 389 HG23 THR 50 HG22 THR 50 9.943 17.632 17.284 390 H ILE 51 H ILE 51 10.741 22.246 16.410 391 HA ILE 51 HA ILE 51 11.453 22.095 19.234 392 HB ILE 51 HB ILE 51 12.013 24.078 16.998 393 HG12 ILE 51 HG12 ILE 51 13.902 22.165 18.459 394 HG13 ILE 51 HG13 ILE 51 13.065 21.720 16.981 395 HG21 ILE 51 HG21 ILE 51 12.070 25.336 19.123 396 HG22 ILE 51 HG22 ILE 51 13.138 24.109 19.839 397 HG23 ILE 51 HG23 ILE 51 13.694 25.132 18.498 398 HD11 ILE 51 HD13 ILE 51 15.121 23.938 17.251 399 HD12 ILE 51 HD11 ILE 51 15.259 22.405 16.382 400 HD13 ILE 51 HD12 ILE 51 14.137 23.643 15.794 401 H ASN 52 H ASN 52 9.361 24.234 17.207 402 HA ASN 52 HA ASN 52 8.848 26.066 19.368 403 HB2 ASN 52 HB2 ASN 52 7.622 25.633 16.621 404 HB3 ASN 52 HB3 ASN 52 6.906 26.763 17.750 405 HD21 ASN 52 HD22 ASN 52 9.840 26.129 15.865 406 HD22 ASN 52 HD21 ASN 52 10.475 27.760 15.974 407 H ASN 53 H ASN 53 7.137 23.206 18.199 408 HA ASN 53 HA ASN 53 4.871 23.752 20.092 409 HB2 ASN 53 HB2 ASN 53 4.443 24.080 17.613 410 HB3 ASN 53 HB3 ASN 53 4.793 22.372 17.369 411 HD21 ASN 53 HD22 ASN 53 2.418 24.674 18.285 412 HD22 ASN 53 HD21 ASN 53 1.154 23.556 18.740 413 H GLY 54 H GLY 54 6.716 21.229 18.343 414 HA2 GLY 54 HA2 GLY 54 7.545 19.438 20.054 415 HA3 GLY 54 HA3 GLY 54 5.806 19.119 20.216 416 HA PRO 55 HA PRO 55 7.658 17.076 16.288 417 HB2 PRO 55 HB2 PRO 55 7.505 14.442 17.036 418 HB3 PRO 55 HB3 PRO 55 8.954 15.451 17.310 419 HG2 PRO 55 HG2 PRO 55 6.717 14.839 19.271 420 HG3 PRO 55 HG3 PRO 55 8.477 14.732 19.549 421 HD2 PRO 55 HD2 PRO 55 7.041 16.904 20.316 422 HD3 PRO 55 HD3 PRO 55 8.688 17.116 19.644 423 H TYR 56 H TYR 56 6.236 16.171 14.746 424 HA TYR 56 HA TYR 56 3.416 15.810 15.642 425 HB2 TYR 56 HB2 TYR 56 2.607 17.397 14.116 426 HB3 TYR 56 HB3 TYR 56 3.854 18.166 15.064 427 HD1 TYR 56 HD2 TYR 56 6.228 18.443 13.975 428 HD2 TYR 56 HD1 TYR 56 2.639 17.510 11.763 429 HE1 TYR 56 HE2 TYR 56 7.283 19.291 11.917 430 HE2 TYR 56 HE1 TYR 56 3.664 18.427 9.709 431 HH TYR 56 HH TYR 56 6.956 19.834 9.636 432 H TYR 57 H TYR 57 5.708 14.097 14.393 433 HA TYR 57 HA TYR 57 3.823 12.490 12.807 434 HB2 TYR 57 HB2 TYR 57 6.529 13.357 11.829 435 HB3 TYR 57 HB3 TYR 57 5.864 11.773 11.442 436 HD1 TYR 57 HD1 TYR 57 3.749 11.479 10.209 437 HD2 TYR 57 HD2 TYR 57 5.606 15.347 10.678 438 HE1 TYR 57 HE1 TYR 57 2.292 12.387 8.426 439 HE2 TYR 57 HE2 TYR 57 4.197 16.245 8.863 440 HH TYR 57 HH TYR 57 2.456 15.820 7.365 441 H ILE 58 H ILE 58 3.583 11.592 14.933 442 HA ILE 58 HA ILE 58 5.759 9.725 15.742 443 HB ILE 58 HB ILE 58 3.762 11.178 17.527 444 HG12 ILE 58 HG12 ILE 58 5.547 12.712 16.941 445 HG13 ILE 58 HG13 ILE 58 5.667 12.236 18.618 446 HG21 ILE 58 HG21 ILE 58 5.850 9.065 18.245 447 HG22 ILE 58 HG22 ILE 58 4.913 10.041 19.412 448 HG23 ILE 58 HG23 ILE 58 4.094 8.912 18.350 449 HD11 ILE 58 HD13 ILE 58 7.902 12.277 17.708 450 HD12 ILE 58 HD11 ILE 58 7.498 10.573 17.926 451 HD13 ILE 58 HD12 ILE 58 7.421 11.308 16.312 452 H LEU 59 H LEU 59 5.017 7.623 15.967 453 HA LEU 59 HA LEU 59 2.164 7.146 15.169 454 HB2 LEU 59 HB2 LEU 59 4.658 5.893 14.036 455 HB3 LEU 59 HB3 LEU 59 3.013 5.321 13.775 456 HG LEU 59 HG LEU 59 2.722 8.048 13.261 457 HD11 LEU 59 HD11 LEU 59 5.388 7.240 12.050 458 HD12 LEU 59 HD12 LEU 59 4.504 8.777 11.830 459 HD13 LEU 59 HD13 LEU 59 5.184 8.368 13.393 460 HD21 LEU 59 HD23 LEU 59 2.357 7.491 11.017 461 HD22 LEU 59 HD21 LEU 59 3.314 5.998 11.142 462 HD23 LEU 59 HD22 LEU 59 1.776 6.172 12.036 463 H ALA 60 H ALA 60 4.897 6.132 17.158 464 HA ALA 60 HA ALA 60 3.142 4.584 18.799 465 HB1 ALA 60 HB3 ALA 60 4.441 2.459 18.685 466 HB2 ALA 60 HB1 ALA 60 3.717 2.828 17.115 467 HB3 ALA 60 HB2 ALA 60 5.444 3.134 17.395 468 HA PRO 61 HA PRO 61 6.250 5.945 21.796 469 HB2 PRO 61 HB2 PRO 61 6.380 3.052 22.682 470 HB3 PRO 61 HB3 PRO 61 6.284 4.537 23.678 471 HG2 PRO 61 HG2 PRO 61 4.067 3.049 23.257 472 HG3 PRO 61 HG3 PRO 61 3.975 4.838 23.149 473 HD2 PRO 61 HD2 PRO 61 4.178 2.825 20.903 474 HD3 PRO 61 HD3 PRO 61 3.136 4.277 21.029 475 H GLY 62 H GLY 62 8.259 6.444 21.064 476 HA2 GLY 62 HA2 GLY 62 10.483 6.097 20.613 477 HA3 GLY 62 HA3 GLY 62 10.228 4.357 20.532 478 H VAL 63 H VAL 63 7.949 5.835 18.419 479 HA VAL 63 HA VAL 63 9.786 5.480 16.093 480 HB VAL 63 HB VAL 63 6.953 4.414 16.336 481 HG11 VAL 63 HG11 VAL 63 7.332 3.292 14.219 482 HG12 VAL 63 HG12 VAL 63 7.781 4.982 14.018 483 HG13 VAL 63 HG13 VAL 63 9.050 3.769 14.222 484 HG21 VAL 63 HG23 VAL 63 8.339 3.054 17.812 485 HG22 VAL 63 HG21 VAL 63 8.023 2.140 16.345 486 HG23 VAL 63 HG22 VAL 63 9.601 2.915 16.569 487 H ALA 64 H ALA 64 9.721 7.095 14.705 488 HA ALA 64 HA ALA 64 7.413 8.960 14.609 489 HB1 ALA 64 HB3 ALA 64 10.372 9.693 14.475 490 HB2 ALA 64 HB1 ALA 64 9.004 10.821 14.419 491 HB3 ALA 64 HB2 ALA 64 9.341 9.925 15.908 492 H MET 65 H MET 65 7.516 10.280 12.573 493 HA MET 65 HA MET 65 8.851 8.911 10.335 494 HB2 MET 65 HB2 MET 65 6.616 7.994 10.439 495 HB3 MET 65 HB3 MET 65 5.941 9.635 10.366 496 HG2 MET 65 HG2 MET 65 7.491 9.552 8.083 497 HG3 MET 65 HG3 MET 65 7.009 7.867 8.240 498 HE1 MET 65 HE3 MET 65 3.135 8.074 8.240 499 HE2 MET 65 HE1 MET 65 4.534 7.348 9.076 500 HE3 MET 65 HE2 MET 65 3.781 8.823 9.715 501 HA PRO 66 HA PRO 66 8.958 13.617 10.733 502 HB2 PRO 66 HB2 PRO 66 11.884 13.288 10.029 503 HB3 PRO 66 HB3 PRO 66 11.142 14.342 11.268 504 HG2 PRO 66 HG2 PRO 66 12.398 12.089 12.002 505 HG3 PRO 66 HG3 PRO 66 10.848 12.538 12.775 506 HD2 PRO 66 HD2 PRO 66 11.278 10.603 10.466 507 HD3 PRO 66 HD3 PRO 66 10.378 10.346 11.989 508 H HIS 67 H HIS 67 8.351 14.711 8.998 509 HA HIS 67 HA HIS 67 9.275 14.666 6.320 510 HB2 HIS 67 HB2 HIS 67 8.398 12.749 5.584 511 HB3 HIS 67 HB3 HIS 67 7.652 12.399 7.089 512 HD1 HIS 67 HD1 HIS 67 5.113 12.791 7.398 513 HD2 HIS 67 HD2 HIS 67 6.669 13.692 3.559 514 HE1 HIS 67 HE1 HIS 67 3.133 12.862 5.803 515 H ALA 68 H ALA 68 7.601 15.961 4.947 516 HA ALA 68 HA ALA 68 5.957 17.804 6.612 517 HB1 ALA 68 HB3 ALA 68 7.029 19.723 5.602 518 HB2 ALA 68 HB1 ALA 68 8.215 18.774 6.493 519 HB3 ALA 68 HB2 ALA 68 8.164 18.681 4.723 520 H ARG 69 H ARG 69 4.850 19.383 4.986 521 HA ARG 69 HA ARG 69 3.320 17.891 3.049 522 HB2 ARG 69 HB2 ARG 69 3.719 20.829 3.729 523 HB3 ARG 69 HB3 ARG 69 2.783 20.367 2.306 524 HG2 ARG 69 HG2 ARG 69 1.250 19.030 3.719 525 HG3 ARG 69 HG3 ARG 69 2.191 19.452 5.155 526 HD2 ARG 69 HD2 ARG 69 0.200 20.867 5.027 527 HD3 ARG 69 HD3 ARG 69 1.661 21.832 4.856 528 HE ARG 69 HE ARG 69 1.057 22.438 2.744 529 HH11 ARG 69 HH11 ARG 69 -1.048 19.744 3.704 530 HH12 ARG 69 HH12 ARG 69 -2.079 19.874 2.330 531 HH21 ARG 69 HH21 ARG 69 -0.318 22.613 0.913 532 HH22 ARG 69 HH22 ARG 69 -1.653 21.547 0.713 533 HA PRO 70 HA PRO 70 6.010 17.812 -0.447 534 HB2 PRO 70 HB2 PRO 70 4.373 18.708 -2.554 535 HB3 PRO 70 HB3 PRO 70 4.410 17.060 -1.903 536 HG2 PRO 70 HG2 PRO 70 2.450 19.243 -1.290 537 HG3 PRO 70 HG3 PRO 70 2.152 17.492 -1.509 538 HD2 PRO 70 HD2 PRO 70 2.270 18.643 0.951 539 HD3 PRO 70 HD3 PRO 70 2.898 17.000 0.677 540 H GLU 71 H GLU 71 3.893 20.706 -0.166 541 HA GLU 71 HA GLU 71 5.378 22.546 -1.680 542 HB2 GLU 71 HB2 GLU 71 3.482 22.987 0.672 543 HB3 GLU 71 HB3 GLU 71 3.988 24.241 -0.458 544 HG2 GLU 71 HG2 GLU 71 2.364 21.761 -1.172 545 HG3 GLU 71 HG3 GLU 71 1.736 23.385 -0.955 546 H CYS 72 H CYS 72 6.312 21.207 1.362 547 HA CYS 72 HA CYS 72 7.671 23.615 2.346 548 HB2 CYS 72 HB2 CYS 72 7.768 20.701 3.244 549 HB3 CYS 72 HB3 CYS 72 8.586 22.048 4.050 550 HG CYS 72 HG CYS 72 6.450 23.490 4.491 551 H GLY 73 H GLY 73 8.287 21.541 -0.223 552 HA2 GLY 73 HA2 GLY 73 10.258 22.366 -1.468 553 HA3 GLY 73 HA3 GLY 73 11.238 22.060 -0.033 554 H ALA 74 H ALA 74 8.684 19.724 -0.883 555 HA ALA 74 HA ALA 74 10.672 17.639 -1.382 556 HB1 ALA 74 HB3 ALA 74 8.412 17.121 -0.431 557 HB2 ALA 74 HB1 ALA 74 7.692 17.669 -1.970 558 HB3 ALA 74 HB2 ALA 74 8.756 16.254 -1.942 559 H LEU 75 H LEU 75 11.234 16.788 -3.359 560 HA LEU 75 HA LEU 75 10.545 18.400 -5.787 561 HB2 LEU 75 HB2 LEU 75 13.234 17.291 -4.930 562 HB3 LEU 75 HB3 LEU 75 12.919 18.107 -6.456 563 HG LEU 75 HG LEU 75 12.738 19.374 -3.691 564 HD11 LEU 75 HD11 LEU 75 14.823 19.684 -5.889 565 HD12 LEU 75 HD12 LEU 75 14.799 20.554 -4.339 566 HD13 LEU 75 HD13 LEU 75 15.039 18.802 -4.364 567 HD21 LEU 75 HD23 LEU 75 11.212 20.516 -5.264 568 HD22 LEU 75 HD21 LEU 75 12.613 21.532 -4.927 569 HD23 LEU 75 HD22 LEU 75 12.515 20.644 -6.465 570 H LYS 76 H LYS 76 11.342 15.224 -4.393 571 HA LYS 76 HA LYS 76 10.190 13.939 -6.739 572 HB2 LYS 76 HB2 LYS 76 12.787 12.917 -5.598 573 HB3 LYS 76 HB3 LYS 76 12.014 12.417 -7.086 574 HG2 LYS 76 HG2 LYS 76 12.741 14.515 -8.168 575 HG3 LYS 76 HG3 LYS 76 13.374 15.119 -6.621 576 HD2 LYS 76 HD2 LYS 76 14.939 13.169 -6.516 577 HD3 LYS 76 HD3 LYS 76 14.397 12.694 -8.138 578 HE2 LYS 76 HE2 LYS 76 15.176 14.888 -9.022 579 HE3 LYS 76 HE3 LYS 76 15.696 15.373 -7.401 580 HZ1 LYS 76 HZ3 LYS 76 17.293 13.569 -7.411 581 HZ2 LYS 76 HZ1 LYS 76 16.782 13.040 -8.882 582 HZ3 LYS 76 HZ2 LYS 76 17.522 14.483 -8.755 583 H THR 77 H THR 77 9.422 11.753 -6.162 584 HA THR 77 HA THR 77 8.811 11.568 -3.388 585 HB THR 77 HB THR 77 8.000 10.075 -5.898 586 HG1 THR 77 HG1 THR 77 6.424 11.435 -6.035 587 HG21 THR 77 HG23 THR 77 7.584 8.630 -3.991 588 HG22 THR 77 HG21 THR 77 6.807 9.964 -3.106 589 HG23 THR 77 HG22 THR 77 6.053 9.290 -4.581 590 H GLY 78 H GLY 78 9.553 10.254 -1.836 591 HA2 GLY 78 HA2 GLY 78 10.807 7.736 -2.253 592 HA3 GLY 78 HA3 GLY 78 12.034 9.000 -2.066 593 H MET 79 H MET 79 12.214 7.298 -0.138 594 HA MET 79 HA MET 79 11.189 8.545 2.307 595 HB2 MET 79 HB2 MET 79 10.783 5.615 1.491 596 HB3 MET 79 HB3 MET 79 10.699 6.188 3.152 597 HG2 MET 79 HG2 MET 79 9.008 7.903 2.309 598 HG3 MET 79 HG3 MET 79 8.806 6.886 0.904 599 HE1 MET 79 HE3 MET 79 6.792 5.407 0.896 600 HE2 MET 79 HE1 MET 79 7.926 4.117 1.369 601 HE3 MET 79 HE2 MET 79 6.378 4.266 2.192 602 H SER 80 H SER 80 12.251 7.333 4.227 603 HA SER 80 HA SER 80 14.717 5.961 3.679 604 HB2 SER 80 HB2 SER 80 14.792 8.727 4.961 605 HB3 SER 80 HB3 SER 80 16.121 7.556 5.069 606 HG SER 80 HG SER 80 15.127 7.968 2.523 607 H LEU 81 H LEU 81 15.717 5.273 5.834 608 HA LEU 81 HA LEU 81 13.716 4.875 7.973 609 HB2 LEU 81 HB2 LEU 81 13.521 3.124 6.230 610 HB3 LEU 81 HB3 LEU 81 15.246 2.799 6.306 611 HG LEU 81 HG LEU 81 15.084 1.787 8.438 612 HD11 LEU 81 HD11 LEU 81 12.134 2.461 8.487 613 HD12 LEU 81 HD12 LEU 81 13.013 1.516 9.694 614 HD13 LEU 81 HD13 LEU 81 13.377 3.227 9.524 615 HD21 LEU 81 HD23 LEU 81 12.731 0.945 6.686 616 HD22 LEU 81 HD21 LEU 81 14.412 0.536 6.352 617 HD23 LEU 81 HD22 LEU 81 13.611 -0.109 7.810 618 H THR 82 H THR 82 14.898 5.923 9.592 619 HA THR 82 HA THR 82 17.804 5.327 9.903 620 HB THR 82 HB THR 82 16.033 7.461 11.191 621 HG1 THR 82 HG1 THR 82 16.196 7.723 8.937 622 HG21 THR 82 HG23 THR 82 18.217 8.602 11.625 623 HG22 THR 82 HG21 THR 82 18.022 7.086 12.509 624 HG23 THR 82 HG22 THR 82 19.060 7.132 11.062 625 H LEU 83 H LEU 83 18.529 4.412 11.886 626 HA LEU 83 HA LEU 83 16.542 4.067 14.036 627 HB2 LEU 83 HB2 LEU 83 16.669 1.971 12.729 628 HB3 LEU 83 HB3 LEU 83 18.364 1.800 13.202 629 HG LEU 83 HG LEU 83 16.244 2.287 15.324 630 HD11 LEU 83 HD11 LEU 83 15.271 0.486 14.012 631 HD12 LEU 83 HD12 LEU 83 16.805 -0.398 14.044 632 HD13 LEU 83 HD13 LEU 83 15.893 -0.136 15.542 633 HD21 LEU 83 HD23 LEU 83 18.573 0.365 15.520 634 HD22 LEU 83 HD21 LEU 83 18.801 2.089 15.780 635 HD23 LEU 83 HD22 LEU 83 17.662 1.217 16.807 636 H LEU 84 H LEU 84 17.434 4.620 16.015 637 HA LEU 84 HA LEU 84 20.380 5.168 16.175 638 HB2 LEU 84 HB2 LEU 84 18.122 6.007 18.041 639 HB3 LEU 84 HB3 LEU 84 19.834 6.271 18.295 640 HG LEU 84 HG LEU 84 19.109 8.307 17.759 641 HD11 LEU 84 HD11 LEU 84 21.058 7.578 16.317 642 HD12 LEU 84 HD12 LEU 84 19.897 7.274 15.001 643 HD13 LEU 84 HD13 LEU 84 20.119 8.913 15.617 644 HD21 LEU 84 HD23 LEU 84 16.840 7.758 17.014 645 HD22 LEU 84 HD21 LEU 84 17.606 8.928 15.928 646 HD23 LEU 84 HD22 LEU 84 17.463 7.225 15.439 647 H GLU 85 H GLU 85 21.531 3.726 17.458 648 HA GLU 85 HA GLU 85 20.251 1.653 18.978 649 HB2 GLU 85 HB2 GLU 85 23.090 2.766 19.089 650 HB3 GLU 85 HB3 GLU 85 22.535 1.330 19.955 651 HG2 GLU 85 HG2 GLU 85 21.914 0.274 17.775 652 HG3 GLU 85 HG3 GLU 85 22.573 1.670 16.923 653 H GLN 86 H GLN 86 21.311 4.937 19.643 654 HA GLN 86 HA GLN 86 20.055 4.897 22.342 655 HB2 GLN 86 HB2 GLN 86 22.538 6.402 21.497 656 HB3 GLN 86 HB3 GLN 86 21.748 6.523 23.068 657 HG2 GLN 86 HG2 GLN 86 22.800 3.927 21.924 658 HG3 GLN 86 HG3 GLN 86 23.810 5.029 22.851 659 HE21 GLN 86 HE21 GLN 86 20.978 2.830 23.036 660 HE22 GLN 86 HE22 GLN 86 20.991 2.688 24.783 661 H GLY 87 H GLY 87 18.249 5.409 21.272 662 HA2 GLY 87 HA2 GLY 87 17.515 7.424 19.550 663 HA3 GLY 87 HA3 GLY 87 16.506 6.856 20.879 664 H VAL 88 H VAL 88 16.456 9.442 19.829 665 HA VAL 88 HA VAL 88 17.568 11.117 22.026 666 HB VAL 88 HB VAL 88 17.536 11.674 19.028 667 HG11 VAL 88 HG11 VAL 88 18.680 13.786 19.563 668 HG12 VAL 88 HG12 VAL 88 17.024 13.772 20.158 669 HG13 VAL 88 HG13 VAL 88 18.384 13.526 21.295 670 HG21 VAL 88 HG23 VAL 88 19.379 10.255 19.624 671 HG22 VAL 88 HG21 VAL 88 20.060 11.895 19.567 672 HG23 VAL 88 HG22 VAL 88 19.700 11.159 21.120 673 H TYR 89 H TYR 89 16.287 12.961 22.540 674 HA TYR 89 HA TYR 89 13.405 12.268 22.285 675 HB2 TYR 89 HB2 TYR 89 14.536 11.763 24.409 676 HB3 TYR 89 HB3 TYR 89 14.993 13.447 24.581 677 HD1 TYR 89 HD1 TYR 89 11.634 13.415 23.289 678 HD2 TYR 89 HD2 TYR 89 13.936 12.690 26.882 679 HE1 TYR 89 HE1 TYR 89 9.731 14.031 24.636 680 HE2 TYR 89 HE2 TYR 89 11.930 13.181 28.252 681 HH TYR 89 HH TYR 89 8.794 14.137 26.732 682 H PHE 90 H PHE 90 12.748 13.567 20.664 683 HA PHE 90 HA PHE 90 13.214 16.290 20.189 684 HB2 PHE 90 HB2 PHE 90 10.672 14.625 20.007 685 HB3 PHE 90 HB3 PHE 90 10.850 16.219 19.275 686 HD1 PHE 90 HD2 PHE 90 13.302 16.301 17.880 687 HD2 PHE 90 HD1 PHE 90 10.601 12.972 18.324 688 HE1 PHE 90 HE2 PHE 90 14.169 15.320 15.793 689 HE2 PHE 90 HE1 PHE 90 11.437 12.023 16.184 690 HZ PHE 90 HZ PHE 90 13.225 13.207 14.913 691 HA PRO 91 HA PRO 91 11.452 18.126 23.840 692 HB2 PRO 91 HB2 PRO 91 11.267 20.752 23.139 693 HB3 PRO 91 HB3 PRO 91 12.829 19.898 23.278 694 HG2 PRO 91 HG2 PRO 91 11.193 20.324 20.753 695 HG3 PRO 91 HG3 PRO 91 12.919 20.748 21.022 696 HD2 PRO 91 HD2 PRO 91 12.196 18.418 19.838 697 HD3 PRO 91 HD3 PRO 91 13.568 18.476 20.983 698 H GLY 92 H GLY 92 9.505 16.668 23.277 699 HA2 GLY 92 HA2 GLY 92 7.205 17.912 24.074 700 HA3 GLY 92 HA3 GLY 92 7.068 17.965 22.315 701 H ASN 93 H ASN 93 8.736 15.148 22.674 702 HA ASN 93 HA ASN 93 6.354 13.449 22.563 703 HB2 ASN 93 HB2 ASN 93 8.668 13.108 21.354 704 HB3 ASN 93 HB3 ASN 93 9.200 12.441 22.892 705 HD21 ASN 93 HD22 ASN 93 6.969 12.017 20.145 706 HD22 ASN 93 HD21 ASN 93 6.571 10.355 20.516 707 H ASP 94 H ASP 94 6.792 11.258 24.054 708 HA ASP 94 HA ASP 94 6.880 12.176 26.875 709 HB2 ASP 94 HB2 ASP 94 4.909 10.857 26.193 710 HB3 ASP 94 HB3 ASP 94 5.968 9.555 25.640 711 H GLU 95 H GLU 95 8.555 10.202 24.445 712 HA GLU 95 HA GLU 95 10.798 9.792 26.286 713 HB2 GLU 95 HB2 GLU 95 10.643 7.471 26.272 714 HB3 GLU 95 HB3 GLU 95 8.962 7.990 26.378 715 HG2 GLU 95 HG2 GLU 95 8.659 7.559 23.958 716 HG3 GLU 95 HG3 GLU 95 10.348 7.038 23.860 717 HA PRO 96 HA PRO 96 13.444 10.160 22.774 718 HB2 PRO 96 HB2 PRO 96 14.751 7.518 23.290 719 HB3 PRO 96 HB3 PRO 96 15.481 9.148 23.202 720 HG2 PRO 96 HG2 PRO 96 15.132 7.858 25.587 721 HG3 PRO 96 HG3 PRO 96 14.911 9.629 25.437 722 HD2 PRO 96 HD2 PRO 96 12.791 7.467 25.438 723 HD3 PRO 96 HD3 PRO 96 12.818 9.034 26.310 724 H ILE 97 H ILE 97 13.548 9.622 20.585 725 HA ILE 97 HA ILE 97 11.890 7.343 19.627 726 HB ILE 97 HB ILE 97 13.134 9.706 18.165 727 HG12 ILE 97 HG12 ILE 97 11.448 10.654 19.520 728 HG13 ILE 97 HG13 ILE 97 10.745 10.487 17.925 729 HG21 ILE 97 HG21 ILE 97 11.157 7.614 17.153 730 HG22 ILE 97 HG22 ILE 97 11.704 9.048 16.280 731 HG23 ILE 97 HG23 ILE 97 12.852 7.772 16.651 732 HD11 ILE 97 HD13 ILE 97 9.526 8.427 18.715 733 HD12 ILE 97 HD11 ILE 97 10.168 8.732 20.355 734 HD13 ILE 97 HD12 ILE 97 9.103 9.906 19.593 735 H LYS 98 H LYS 98 12.838 5.565 18.809 736 HA LYS 98 HA LYS 98 15.784 5.659 18.290 737 HB2 LYS 98 HB2 LYS 98 13.987 3.256 18.808 738 HB3 LYS 98 HB3 LYS 98 15.669 3.167 18.257 739 HG2 LYS 98 HG2 LYS 98 16.366 4.464 20.303 740 HG3 LYS 98 HG3 LYS 98 14.693 4.410 20.869 741 HD2 LYS 98 HD2 LYS 98 15.908 2.701 22.010 742 HD3 LYS 98 HD3 LYS 98 14.823 1.897 20.866 743 HE2 LYS 98 HE2 LYS 98 16.711 1.577 19.287 744 HE3 LYS 98 HE3 LYS 98 17.783 2.481 20.354 745 HZ1 LYS 98 HZ3 LYS 98 16.496 -0.097 21.056 746 HZ2 LYS 98 HZ1 LYS 98 18.056 0.094 20.627 747 HZ3 LYS 98 HZ2 LYS 98 17.519 0.744 22.017 748 H LEU 99 H LEU 99 12.631 5.500 16.686 749 HA LEU 99 HA LEU 99 14.109 4.803 14.189 750 HB2 LEU 99 HB2 LEU 99 11.619 3.640 15.407 751 HB3 LEU 99 HB3 LEU 99 11.575 3.889 13.674 752 HG LEU 99 HG LEU 99 13.969 2.464 14.818 753 HD11 LEU 99 HD11 LEU 99 12.836 0.345 14.789 754 HD12 LEU 99 HD12 LEU 99 11.963 1.436 15.863 755 HD13 LEU 99 HD13 LEU 99 11.308 1.103 14.252 756 HD21 LEU 99 HD23 LEU 99 13.880 3.055 12.393 757 HD22 LEU 99 HD21 LEU 99 13.867 1.310 12.592 758 HD23 LEU 99 HD22 LEU 99 12.366 2.173 12.222 759 H LEU 100 H LEU 100 13.785 5.959 12.451 760 HA LEU 100 HA LEU 100 11.553 7.941 12.467 761 HB2 LEU 100 HB2 LEU 100 14.391 8.745 11.762 762 HB3 LEU 100 HB3 LEU 100 12.958 9.731 11.904 763 HG LEU 100 HG LEU 100 13.027 8.724 14.409 764 HD11 LEU 100 HD11 LEU 100 15.159 7.458 13.965 765 HD12 LEU 100 HD12 LEU 100 15.965 9.014 13.697 766 HD13 LEU 100 HD13 LEU 100 15.258 8.628 15.286 767 HD21 LEU 100 HD23 LEU 100 14.093 10.766 15.206 768 HD22 LEU 100 HD21 LEU 100 14.600 11.152 13.548 769 HD23 LEU 100 HD22 LEU 100 12.870 11.074 13.971 770 H ILE 101 H ILE 101 10.416 7.329 10.691 771 HA ILE 101 HA ILE 101 11.884 6.533 8.266 772 HB ILE 101 HB ILE 101 8.991 6.236 9.152 773 HG12 ILE 101 HG12 ILE 101 9.526 3.897 8.355 774 HG13 ILE 101 HG13 ILE 101 11.175 4.418 8.049 775 HG21 ILE 101 HG21 ILE 101 9.994 5.966 6.286 776 HG22 ILE 101 HG22 ILE 101 8.427 5.400 6.906 777 HG23 ILE 101 HG23 ILE 101 8.777 7.121 6.876 778 HD11 ILE 101 HD13 ILE 101 11.652 4.632 10.354 779 HD12 ILE 101 HD11 ILE 101 9.922 4.664 10.810 780 HD13 ILE 101 HD12 ILE 101 10.678 3.164 10.244 781 H GLY 102 H GLY 102 12.396 7.941 6.764 782 HA2 GLY 102 HA2 GLY 102 11.282 10.692 6.775 783 HA3 GLY 102 HA3 GLY 102 12.599 10.091 5.760 784 H LEU 103 H LEU 103 10.106 11.490 4.915 785 HA LEU 103 HA LEU 103 9.583 9.772 2.636 786 HB2 LEU 103 HB2 LEU 103 7.745 9.182 4.365 787 HB3 LEU 103 HB3 LEU 103 7.246 10.854 4.260 788 HG LEU 103 HG LEU 103 6.929 8.589 2.252 789 HD11 LEU 103 HD11 LEU 103 4.621 9.027 2.684 790 HD12 LEU 103 HD12 LEU 103 5.368 9.247 4.269 791 HD13 LEU 103 HD13 LEU 103 4.937 10.653 3.323 792 HD21 LEU 103 HD23 LEU 103 7.366 10.261 0.685 793 HD22 LEU 103 HD21 LEU 103 5.634 10.375 0.861 794 HD23 LEU 103 HD22 LEU 103 6.613 11.568 1.678 795 H SER 104 H SER 104 9.243 11.057 0.814 796 HA SER 104 HA SER 104 8.406 13.837 1.111 797 HB2 SER 104 HB2 SER 104 10.147 14.646 -0.412 798 HB3 SER 104 HB3 SER 104 10.844 14.015 1.091 799 HG SER 104 HG SER 104 10.975 13.000 -1.528 800 H ALA 105 H ALA 105 7.104 14.429 -0.775 801 HA ALA 105 HA ALA 105 7.343 12.677 -3.064 802 HB1 ALA 105 HB3 ALA 105 4.533 13.103 -2.240 803 HB2 ALA 105 HB1 ALA 105 5.271 11.814 -3.182 804 HB3 ALA 105 HB2 ALA 105 5.448 11.802 -1.428 805 H ALA 106 H ALA 106 6.721 13.625 -5.005 806 HA ALA 106 HA ALA 106 6.946 16.506 -4.757 807 HB1 ALA 106 HB3 ALA 106 8.183 15.242 -6.523 808 HB2 ALA 106 HB1 ALA 106 6.639 14.752 -7.259 809 HB3 ALA 106 HB2 ALA 106 7.119 16.462 -7.244 810 H ASP 107 H ASP 107 4.315 14.306 -4.893 811 HA ASP 107 HA ASP 107 2.440 16.598 -5.250 812 HB2 ASP 107 HB2 ASP 107 2.515 15.355 -7.401 813 HB3 ASP 107 HB3 ASP 107 2.082 13.872 -6.548 814 H ALA 108 H ALA 108 0.440 16.339 -4.085 815 HA ALA 108 HA ALA 108 0.792 15.151 -1.549 816 HB1 ALA 108 HB3 ALA 108 -1.551 15.809 -1.161 817 HB2 ALA 108 HB1 ALA 108 -0.647 17.114 -1.951 818 HB3 ALA 108 HB2 ALA 108 -1.770 16.106 -2.898 819 H ASP 109 H ASP 109 -0.811 13.854 -4.478 820 HA ASP 109 HA ASP 109 -2.019 11.612 -3.015 821 HB2 ASP 109 HB2 ASP 109 -3.015 12.374 -5.082 822 HB3 ASP 109 HB3 ASP 109 -1.503 12.060 -5.963 823 H SER 110 H SER 110 1.059 12.275 -4.643 824 HA SER 110 HA SER 110 2.046 9.565 -4.444 825 HB2 SER 110 HB2 SER 110 3.613 12.171 -4.612 826 HB3 SER 110 HB3 SER 110 4.219 10.537 -4.903 827 HG SER 110 HG SER 110 3.663 11.568 -6.854 828 H HIS 111 H HIS 111 2.020 12.404 -2.197 829 HA HIS 111 HA HIS 111 3.504 11.093 -0.112 830 HB2 HIS 111 HB2 HIS 111 1.489 13.356 -0.080 831 HB3 HIS 111 HB3 HIS 111 1.984 12.587 1.409 832 HD1 HIS 111 HD1 HIS 111 4.372 13.189 2.371 833 HD2 HIS 111 HD2 HIS 111 3.321 14.966 -1.286 834 HE1 HIS 111 HE1 HIS 111 6.106 14.971 1.918 835 H ILE 112 H ILE 112 -0.035 11.145 -0.856 836 HA ILE 112 HA ILE 112 -0.841 9.470 1.276 837 HB ILE 112 HB ILE 112 -1.960 9.810 -1.532 838 HG12 ILE 112 HG12 ILE 112 -2.046 11.822 -0.060 839 HG13 ILE 112 HG13 ILE 112 -3.604 11.246 -0.617 840 HG21 ILE 112 HG21 ILE 112 -3.201 8.247 0.747 841 HG22 ILE 112 HG22 ILE 112 -4.081 8.824 -0.691 842 HG23 ILE 112 HG23 ILE 112 -2.767 7.665 -0.873 843 HD11 ILE 112 HD13 ILE 112 -3.639 11.987 1.720 844 HD12 ILE 112 HD11 ILE 112 -4.061 10.271 1.591 845 HD13 ILE 112 HD12 ILE 112 -2.439 10.750 2.154 846 H GLY 113 H GLY 113 0.162 8.475 -2.079 847 HA2 GLY 113 HA2 GLY 113 -0.119 5.717 -1.659 848 HA3 GLY 113 HA3 GLY 113 1.003 6.470 -2.814 849 H ALA 114 H ALA 114 2.678 7.838 -0.935 850 HA ALA 114 HA ALA 114 4.480 5.717 -0.211 851 HB1 ALA 114 HB3 ALA 114 5.203 7.992 -0.930 852 HB2 ALA 114 HB1 ALA 114 4.423 8.676 0.496 853 HB3 ALA 114 HB2 ALA 114 5.824 7.588 0.677 854 H ILE 115 H ILE 115 2.362 7.934 1.737 855 HA ILE 115 HA ILE 115 3.059 7.051 4.255 856 HB ILE 115 HB ILE 115 0.716 8.271 2.963 857 HG12 ILE 115 HG12 ILE 115 2.668 9.679 3.639 858 HG13 ILE 115 HG13 ILE 115 1.114 10.228 4.223 859 HG21 ILE 115 HG21 ILE 115 -0.454 8.554 5.171 860 HG22 ILE 115 HG22 ILE 115 -0.523 6.972 4.391 861 HG23 ILE 115 HG23 ILE 115 0.601 7.219 5.751 862 HD11 ILE 115 HD13 ILE 115 2.973 10.373 5.903 863 HD12 ILE 115 HD11 ILE 115 1.560 9.463 6.462 864 HD13 ILE 115 HD12 ILE 115 3.013 8.597 5.930 865 H GLN 116 H GLN 116 0.535 5.914 1.909 866 HA GLN 116 HA GLN 116 -0.568 3.900 3.613 867 HB2 GLN 116 HB2 GLN 116 -0.668 4.417 0.612 868 HB3 GLN 116 HB3 GLN 116 -1.549 3.089 1.362 869 HG2 GLN 116 HG2 GLN 116 -1.869 6.013 2.136 870 HG3 GLN 116 HG3 GLN 116 -2.913 5.167 1.003 871 HE21 GLN 116 HE22 GLN 116 -3.148 6.368 3.952 872 HE22 GLN 116 HE21 GLN 116 -4.040 5.121 4.782 873 H ALA 117 H ALA 117 2.450 3.954 2.044 874 HA ALA 117 HA ALA 117 2.623 1.038 1.911 875 HB1 ALA 117 HB3 ALA 117 3.484 2.397 -0.056 876 HB2 ALA 117 HB1 ALA 117 4.657 3.146 1.033 877 HB3 ALA 117 HB2 ALA 117 4.741 1.410 0.717 878 H LEU 118 H LEU 118 4.089 3.926 3.505 879 HA LEU 118 HA LEU 118 5.831 2.205 5.007 880 HB2 LEU 118 HB2 LEU 118 6.513 4.171 6.149 881 HB3 LEU 118 HB3 LEU 118 6.293 4.489 4.425 882 HG LEU 118 HG LEU 118 3.992 5.347 5.022 883 HD11 LEU 118 HD11 LEU 118 5.318 5.964 7.678 884 HD12 LEU 118 HD12 LEU 118 3.630 6.294 7.157 885 HD13 LEU 118 HD13 LEU 118 4.130 4.677 7.554 886 HD21 LEU 118 HD23 LEU 118 5.625 6.816 4.152 887 HD22 LEU 118 HD21 LEU 118 4.965 7.605 5.585 888 HD23 LEU 118 HD22 LEU 118 6.555 6.831 5.672 889 H SER 119 H SER 119 2.597 3.481 5.503 890 HA SER 119 HA SER 119 2.309 2.752 8.208 891 HB2 SER 119 HB2 SER 119 0.164 2.646 6.042 892 HB3 SER 119 HB3 SER 119 -0.119 2.683 7.793 893 HG SER 119 HG SER 119 1.019 4.676 6.132 894 H GLU 120 H GLU 120 2.667 0.543 5.493 895 HA GLU 120 HA GLU 120 1.450 -1.724 6.803 896 HB2 GLU 120 HB2 GLU 120 3.632 -1.700 4.679 897 HB3 GLU 120 HB3 GLU 120 2.640 -3.068 5.172 898 HG2 GLU 120 HG2 GLU 120 0.594 -1.692 4.430 899 HG3 GLU 120 HG3 GLU 120 1.741 -0.583 3.668 900 H LEU 121 H LEU 121 4.249 0.130 7.281 901 HA LEU 121 HA LEU 121 5.610 -1.981 8.893 902 HB2 LEU 121 HB2 LEU 121 6.772 0.615 7.831 903 HB3 LEU 121 HB3 LEU 121 7.642 -0.694 8.611 904 HG LEU 121 HG LEU 121 6.359 -0.657 5.849 905 HD11 LEU 121 HD11 LEU 121 8.505 0.487 6.024 906 HD12 LEU 121 HD12 LEU 121 9.244 -0.937 6.790 907 HD13 LEU 121 HD13 LEU 121 8.696 -1.014 5.105 908 HD21 LEU 121 HD23 LEU 121 6.070 -2.966 6.796 909 HD22 LEU 121 HD21 LEU 121 7.226 -2.932 5.465 910 HD23 LEU 121 HD22 LEU 121 7.811 -3.030 7.130 911 H LEU 122 H LEU 122 5.181 1.626 9.001 912 HA LEU 122 HA LEU 122 5.729 1.960 11.730 913 HB2 LEU 122 HB2 LEU 122 3.963 3.500 9.781 914 HB3 LEU 122 HB3 LEU 122 4.118 3.984 11.451 915 HG LEU 122 HG LEU 122 5.503 5.316 9.976 916 HD11 LEU 122 HD11 LEU 122 6.124 4.937 12.365 917 HD12 LEU 122 HD12 LEU 122 7.250 3.668 11.831 918 HD13 LEU 122 HD13 LEU 122 7.493 5.349 11.320 919 HD21 LEU 122 HD23 LEU 122 6.143 3.538 8.339 920 HD22 LEU 122 HD21 LEU 122 7.465 4.530 8.910 921 HD23 LEU 122 HD22 LEU 122 7.274 2.879 9.540 922 H CYS 123 H CYS 123 2.613 1.044 10.275 923 HA CYS 123 HA CYS 123 1.374 1.360 12.945 924 HB2 CYS 123 HB2 CYS 123 0.002 0.968 10.255 925 HB3 CYS 123 HB3 CYS 123 -0.756 1.406 11.786 926 HG CYS 123 HG CYS 123 -0.712 3.504 10.230 927 H GLU 124 H GLU 124 3.171 -0.835 12.251 928 HA GLU 124 HA GLU 124 1.374 -3.083 12.926 929 HB2 GLU 124 HB2 GLU 124 3.411 -3.018 10.687 930 HB3 GLU 124 HB3 GLU 124 2.959 -4.530 11.480 931 HG2 GLU 124 HG2 GLU 124 0.861 -2.693 10.294 932 HG3 GLU 124 HG3 GLU 124 1.726 -3.876 9.321 933 H GLU 125 H GLU 125 1.905 -3.170 14.984 934 HA GLU 125 HA GLU 125 4.408 -2.600 16.103 935 HB2 GLU 125 HB2 GLU 125 3.597 -3.621 18.136 936 HB3 GLU 125 HB3 GLU 125 2.334 -2.653 17.378 937 HG2 GLU 125 HG2 GLU 125 1.311 -4.750 16.456 938 HG3 GLU 125 HG3 GLU 125 2.555 -5.697 17.273 939 H GLU 126 H GLU 126 3.327 -5.562 14.572 940 HA GLU 126 HA GLU 126 5.339 -7.308 15.566 941 HB2 GLU 126 HB2 GLU 126 3.922 -7.354 12.859 942 HB3 GLU 126 HB3 GLU 126 4.849 -8.683 13.575 943 HG2 GLU 126 HG2 GLU 126 3.263 -8.632 15.536 944 HG3 GLU 126 HG3 GLU 126 2.293 -7.446 14.647 945 H ILE 127 H ILE 127 5.206 -5.077 12.798 946 HA ILE 127 HA ILE 127 7.872 -5.717 11.844 947 HB ILE 127 HB ILE 127 5.877 -3.584 11.190 948 HG12 ILE 127 HG12 ILE 127 5.869 -4.557 8.999 949 HG13 ILE 127 HG13 ILE 127 7.260 -5.581 9.363 950 HG21 ILE 127 HG21 ILE 127 7.902 -2.365 11.022 951 HG22 ILE 127 HG22 ILE 127 8.778 -3.767 10.362 952 HG23 ILE 127 HG23 ILE 127 7.576 -2.913 9.378 953 HD11 ILE 127 HD13 ILE 127 5.124 -6.816 9.181 954 HD12 ILE 127 HD11 ILE 127 5.908 -7.033 10.750 955 HD13 ILE 127 HD12 ILE 127 4.507 -5.940 10.593 956 H LEU 128 H LEU 128 6.385 -3.125 13.889 957 HA LEU 128 HA LEU 128 8.632 -1.564 14.164 958 HB2 LEU 128 HB2 LEU 128 6.605 -2.145 16.350 959 HB3 LEU 128 HB3 LEU 128 7.798 -0.861 16.399 960 HG LEU 128 HG LEU 128 5.480 -1.065 14.444 961 HD11 LEU 128 HD11 LEU 128 6.123 0.894 16.676 962 HD12 LEU 128 HD12 LEU 128 4.736 0.989 15.567 963 HD13 LEU 128 HD13 LEU 128 4.869 -0.356 16.706 964 HD21 LEU 128 HD23 LEU 128 6.273 1.255 13.753 965 HD22 LEU 128 HD21 LEU 128 7.836 0.848 14.491 966 HD23 LEU 128 HD22 LEU 128 7.200 -0.108 13.134 967 H GLU 129 H GLU 129 8.022 -4.538 16.044 968 HA GLU 129 HA GLU 129 10.323 -4.068 17.669 969 HB2 GLU 129 HB2 GLU 129 9.863 -5.946 18.820 970 HB3 GLU 129 HB3 GLU 129 8.266 -5.559 18.196 971 HG2 GLU 129 HG2 GLU 129 8.669 -7.261 16.362 972 HG3 GLU 129 HG3 GLU 129 10.209 -7.663 17.138 973 H GLN 130 H GLN 130 9.819 -5.608 14.507 974 HA GLN 130 HA GLN 130 12.337 -7.023 14.516 975 HB2 GLN 130 HB2 GLN 130 10.261 -6.413 12.382 976 HB3 GLN 130 HB3 GLN 130 11.739 -7.357 12.086 977 HG2 GLN 130 HG2 GLN 130 11.126 -9.015 13.709 978 HG3 GLN 130 HG3 GLN 130 9.702 -8.099 14.203 979 HE21 GLN 130 HE22 GLN 130 7.807 -8.293 13.033 980 HE22 GLN 130 HE21 GLN 130 7.617 -9.369 11.655 981 H LEU 131 H LEU 131 11.102 -3.863 13.425 982 HA LEU 131 HA LEU 131 13.565 -2.954 12.190 983 HB2 LEU 131 HB2 LEU 131 11.454 -1.372 13.706 984 HB3 LEU 131 HB3 LEU 131 12.731 -0.690 12.715 985 HG LEU 131 HG LEU 131 10.471 -2.419 11.607 986 HD11 LEU 131 HD11 LEU 131 9.725 -0.355 12.787 987 HD12 LEU 131 HD12 LEU 131 10.724 0.607 11.692 988 HD13 LEU 131 HD13 LEU 131 9.365 -0.341 11.043 989 HD21 LEU 131 HD23 LEU 131 12.467 -0.549 10.283 990 HD22 LEU 131 HD21 LEU 131 12.438 -2.313 10.135 991 HD23 LEU 131 HD22 LEU 131 11.114 -1.342 9.461 992 H LEU 132 H LEU 132 12.082 -2.452 15.437 993 HA LEU 132 HA LEU 132 14.179 -1.025 16.574 994 HB2 LEU 132 HB2 LEU 132 12.150 -2.879 17.821 995 HB3 LEU 132 HB3 LEU 132 13.359 -2.108 18.824 996 HG LEU 132 HG LEU 132 11.501 -0.503 17.036 997 HD11 LEU 132 HD11 LEU 132 11.194 -1.183 19.989 998 HD12 LEU 132 HD12 LEU 132 10.190 -0.038 19.070 999 HD13 LEU 132 HD13 LEU 132 10.160 -1.757 18.660 1000 HD21 LEU 132 HD23 LEU 132 12.128 1.361 18.543 1001 HD22 LEU 132 HD21 LEU 132 13.232 0.286 19.425 1002 HD23 LEU 132 HD22 LEU 132 13.553 0.708 17.730 1003 H THR 133 H THR 133 14.071 -4.519 16.145 1004 HA THR 133 HA THR 133 16.452 -4.912 17.817 1005 HB THR 133 HB THR 133 16.002 -7.337 17.252 1006 HG1 THR 133 HG1 THR 133 13.515 -6.383 16.335 1007 HG21 THR 133 HG23 THR 133 13.744 -5.719 18.530 1008 HG22 THR 133 HG21 THR 133 13.921 -7.480 18.638 1009 HG23 THR 133 HG22 THR 133 15.159 -6.419 19.344 1010 H ALA 134 H ALA 134 16.145 -3.744 14.737 1011 HA ALA 134 HA ALA 134 17.957 -5.330 13.240 1012 HB1 ALA 134 HB3 ALA 134 17.311 -2.373 12.948 1013 HB2 ALA 134 HB1 ALA 134 18.088 -3.415 11.748 1014 HB3 ALA 134 HB2 ALA 134 16.394 -3.712 12.216 1015 H SER 135 H SER 135 19.913 -5.808 14.186 1016 HA SER 135 HA SER 135 21.535 -3.955 15.601 1017 HB2 SER 135 HB2 SER 135 22.435 -6.422 14.057 1018 HB3 SER 135 HB3 SER 135 23.239 -5.670 15.446 1019 HG SER 135 HG SER 135 22.013 -7.514 16.039 1020 H SER 136 H SER 136 21.070 -4.506 12.160 1021 HA SER 136 HA SER 136 23.105 -2.503 11.427 1022 HB2 SER 136 HB2 SER 136 22.990 -5.311 10.234 1023 HB3 SER 136 HB3 SER 136 24.119 -4.019 9.800 1024 HG SER 136 HG SER 136 25.051 -5.564 11.211 1025 H GLU 137 H GLU 137 22.808 -1.779 9.249 1026 HA GLU 137 HA GLU 137 20.229 -1.106 8.549 1027 HB2 GLU 137 HB2 GLU 137 22.580 -1.392 6.618 1028 HB3 GLU 137 HB3 GLU 137 21.135 -0.407 6.408 1029 HG2 GLU 137 HG2 GLU 137 22.533 1.189 6.978 1030 HG3 GLU 137 HG3 GLU 137 21.877 0.802 8.554 1031 H LYS 138 H LYS 138 21.988 -4.005 7.566 1032 HA LYS 138 HA LYS 138 20.452 -4.749 5.348 1033 HB2 LYS 138 HB2 LYS 138 21.766 -6.565 7.418 1034 HB3 LYS 138 HB3 LYS 138 21.202 -7.086 5.835 1035 HG2 LYS 138 HG2 LYS 138 23.453 -5.099 6.356 1036 HG3 LYS 138 HG3 LYS 138 23.621 -6.785 5.862 1037 HD2 LYS 138 HD2 LYS 138 22.324 -6.237 3.761 1038 HD3 LYS 138 HD3 LYS 138 22.406 -4.529 4.200 1039 HE2 LYS 138 HE2 LYS 138 24.806 -6.366 3.765 1040 HE3 LYS 138 HE3 LYS 138 24.146 -5.265 2.556 1041 HZ1 LYS 138 HZ3 LYS 138 24.695 -3.412 4.025 1042 HZ2 LYS 138 HZ1 LYS 138 25.346 -4.431 5.133 1043 HZ3 LYS 138 HZ2 LYS 138 26.022 -4.278 3.662 1044 H GLN 139 H GLN 139 19.522 -5.162 8.823 1045 HA GLN 139 HA GLN 139 17.360 -6.886 8.099 1046 HB2 GLN 139 HB2 GLN 139 18.625 -7.194 10.120 1047 HB3 GLN 139 HB3 GLN 139 18.419 -5.504 10.585 1048 HG2 GLN 139 HG2 GLN 139 17.030 -6.861 11.909 1049 HG3 GLN 139 HG3 GLN 139 16.064 -5.824 10.860 1050 HE21 GLN 139 HE22 GLN 139 14.859 -6.863 9.077 1051 HE22 GLN 139 HE21 GLN 139 14.628 -8.586 8.966 1052 H LEU 140 H LEU 140 17.903 -3.364 8.340 1053 HA LEU 140 HA LEU 140 15.063 -2.722 8.643 1054 HB2 LEU 140 HB2 LEU 140 17.533 -1.127 7.903 1055 HB3 LEU 140 HB3 LEU 140 15.931 -0.427 7.907 1056 HG LEU 140 HG LEU 140 17.225 -1.727 10.314 1057 HD11 LEU 140 HD11 LEU 140 18.437 0.317 9.582 1058 HD12 LEU 140 HD12 LEU 140 16.930 1.242 9.687 1059 HD13 LEU 140 HD13 LEU 140 17.640 0.528 11.144 1060 HD21 LEU 140 HD23 LEU 140 15.541 -0.606 11.672 1061 HD22 LEU 140 HD21 LEU 140 14.745 -0.004 10.204 1062 HD23 LEU 140 HD22 LEU 140 14.812 -1.752 10.556 1063 H ALA 141 H ALA 141 17.522 -2.657 6.030 1064 HA ALA 141 HA ALA 141 15.880 -2.355 3.800 1065 HB1 ALA 141 HB3 ALA 141 17.698 -3.386 2.543 1066 HB2 ALA 141 HB1 ALA 141 18.390 -2.347 3.807 1067 HB3 ALA 141 HB2 ALA 141 18.365 -4.109 4.019 1068 H ASP 142 H ASP 142 16.611 -5.447 5.533 1069 HA ASP 142 HA ASP 142 15.239 -7.160 3.789 1070 HB2 ASP 142 HB2 ASP 142 16.528 -8.126 5.546 1071 HB3 ASP 142 HB3 ASP 142 15.629 -7.251 6.781 1072 H ILE 143 H ILE 143 13.914 -5.276 6.590 1073 HA ILE 143 HA ILE 143 11.267 -6.254 6.294 1074 HB ILE 143 HB ILE 143 12.614 -3.941 7.712 1075 HG12 ILE 143 HG12 ILE 143 11.195 -6.433 8.790 1076 HG13 ILE 143 HG13 ILE 143 12.912 -6.390 8.421 1077 HG21 ILE 143 HG21 ILE 143 9.668 -4.660 7.820 1078 HG22 ILE 143 HG22 ILE 143 10.508 -3.562 8.944 1079 HG23 ILE 143 HG23 ILE 143 10.393 -3.137 7.238 1080 HD11 ILE 143 HD13 ILE 143 11.490 -4.847 10.605 1081 HD12 ILE 143 HD11 ILE 143 12.775 -6.059 10.727 1082 HD13 ILE 143 HD12 ILE 143 13.157 -4.476 10.063 1083 H ILE 144 H ILE 144 12.957 -3.418 4.932 1084 HA ILE 144 HA ILE 144 10.700 -2.331 3.535 1085 HB ILE 144 HB ILE 144 13.668 -2.345 2.834 1086 HG12 ILE 144 HG12 ILE 144 13.321 -1.012 4.775 1087 HG13 ILE 144 HG13 ILE 144 13.540 0.081 3.420 1088 HG21 ILE 144 HG21 ILE 144 11.476 -0.827 1.380 1089 HG22 ILE 144 HG22 ILE 144 13.219 -0.548 1.207 1090 HG23 ILE 144 HG23 ILE 144 12.529 -2.088 0.719 1091 HD11 ILE 144 HD13 ILE 144 10.964 0.197 3.300 1092 HD12 ILE 144 HD11 ILE 144 11.002 -0.579 4.899 1093 HD13 ILE 144 HD12 ILE 144 11.773 0.997 4.665 1094 H SER 145 H SER 145 13.107 -4.754 2.501 1095 HA SER 145 HA SER 145 12.020 -4.983 -0.058 1096 HB2 SER 145 HB2 SER 145 13.446 -6.917 -0.351 1097 HB3 SER 145 HB3 SER 145 14.295 -5.681 0.589 1098 HG SER 145 HG SER 145 13.422 -7.022 2.477 1099 H ARG 146 H ARG 146 11.139 -6.669 2.896 1100 HA ARG 146 HA ARG 146 9.576 -8.751 2.006 1101 HB2 ARG 146 HB2 ARG 146 10.359 -7.637 4.405 1102 HB3 ARG 146 HB3 ARG 146 8.667 -7.138 4.382 1103 HG2 ARG 146 HG2 ARG 146 8.048 -9.533 3.967 1104 HG3 ARG 146 HG3 ARG 146 9.777 -9.952 4.073 1105 HD2 ARG 146 HD2 ARG 146 8.242 -8.507 6.272 1106 HD3 ARG 146 HD3 ARG 146 8.389 -10.278 6.199 1107 HE ARG 146 HE ARG 146 10.994 -9.116 6.053 1108 HH11 ARG 146 HH11 ARG 146 8.360 -9.701 8.371 1109 HH12 ARG 146 HH12 ARG 146 9.428 -9.753 9.747 1110 HH21 ARG 146 HH21 ARG 146 12.377 -9.186 7.901 1111 HH22 ARG 146 HH22 ARG 146 11.689 -9.464 9.483 1112 H GLY 147 H GLY 147 8.855 -5.322 1.857 1113 HA2 GLY 147 HA2 GLY 147 5.932 -5.686 1.720 1114 HA3 GLY 147 HA3 GLY 147 6.851 -4.174 1.651 Start of MODEL 6 1 H MET 1 H1 MET 1 1.926 -1.258 -0.958 2 HA MET 1 HA MET 1 2.634 -1.836 -3.760 3 HB2 MET 1 HB2 MET 1 2.170 0.678 -3.212 4 HB3 MET 1 HB3 MET 1 3.595 0.567 -2.149 5 HG2 MET 1 HG2 MET 1 3.983 1.526 -4.450 6 HG3 MET 1 HG3 MET 1 5.066 0.245 -3.943 7 HE1 MET 1 HE3 MET 1 5.026 -0.301 -7.770 8 HE2 MET 1 HE1 MET 1 5.028 1.233 -6.874 9 HE3 MET 1 HE2 MET 1 6.019 -0.131 -6.306 10 H ARG 2 H ARG 2 4.875 -2.165 -4.155 11 HA ARG 2 HA ARG 2 6.168 -3.501 -1.948 12 HB2 ARG 2 HB2 ARG 2 7.192 -2.718 -4.702 13 HB3 ARG 2 HB3 ARG 2 8.163 -3.579 -3.494 14 HG2 ARG 2 HG2 ARG 2 5.573 -4.535 -4.743 15 HG3 ARG 2 HG3 ARG 2 7.206 -5.169 -5.046 16 HD2 ARG 2 HD2 ARG 2 7.228 -5.751 -2.528 17 HD3 ARG 2 HD3 ARG 2 5.479 -5.409 -2.566 18 HE ARG 2 HE ARG 2 6.112 -7.205 -4.668 19 HH11 ARG 2 HH11 ARG 2 5.850 -7.190 -1.099 20 HH12 ARG 2 HH12 ARG 2 5.580 -8.896 -1.004 21 HH21 ARG 2 HH21 ARG 2 5.718 -9.458 -4.503 22 HH22 ARG 2 HH22 ARG 2 5.479 -10.200 -2.969 23 H LEU 3 H LEU 3 7.033 -2.577 -0.385 24 HA LEU 3 HA LEU 3 7.270 0.230 0.030 25 HB2 LEU 3 HB2 LEU 3 8.341 -2.248 1.389 26 HB3 LEU 3 HB3 LEU 3 8.990 -0.695 1.867 27 HG LEU 3 HG LEU 3 7.139 -1.584 3.282 28 HD11 LEU 3 HD11 LEU 3 7.827 0.776 3.306 29 HD12 LEU 3 HD12 LEU 3 6.675 1.150 2.003 30 HD13 LEU 3 HD13 LEU 3 6.101 0.586 3.582 31 HD21 LEU 3 HD23 LEU 3 5.270 -0.759 1.031 32 HD22 LEU 3 HD21 LEU 3 5.629 -2.430 1.476 33 HD23 LEU 3 HD22 LEU 3 4.831 -1.360 2.636 34 H SER 4 H SER 4 9.670 -2.208 -1.010 35 HA SER 4 HA SER 4 11.965 -0.743 -0.925 36 HB2 SER 4 HB2 SER 4 11.496 -2.579 -3.256 37 HB3 SER 4 HB3 SER 4 12.857 -2.520 -2.118 38 HG SER 4 HG SER 4 11.473 -4.364 -1.899 39 H ASP 5 H ASP 5 9.283 -0.154 -3.150 40 HA ASP 5 HA ASP 5 10.823 1.144 -5.196 41 HB2 ASP 5 HB2 ASP 5 8.533 0.285 -5.562 42 HB3 ASP 5 HB3 ASP 5 7.905 1.472 -4.411 43 H TYR 6 H TYR 6 9.529 2.178 -2.067 44 HA TYR 6 HA TYR 6 9.683 5.017 -2.786 45 HB2 TYR 6 HB2 TYR 6 8.729 3.552 -0.302 46 HB3 TYR 6 HB3 TYR 6 8.892 5.299 -0.379 47 HD1 TYR 6 HD2 TYR 6 7.543 6.708 -1.817 48 HD2 TYR 6 HD1 TYR 6 6.811 2.449 -1.518 49 HE1 TYR 6 HE2 TYR 6 5.391 6.985 -3.020 50 HE2 TYR 6 HE1 TYR 6 4.629 2.757 -2.608 51 HH TYR 6 HH TYR 6 3.160 4.247 -3.651 52 H PHE 7 H PHE 7 11.773 2.745 -1.080 53 HA PHE 7 HA PHE 7 13.376 4.986 0.065 54 HB2 PHE 7 HB2 PHE 7 13.719 1.971 0.388 55 HB3 PHE 7 HB3 PHE 7 14.674 3.220 1.178 56 HD1 PHE 7 HD1 PHE 7 11.144 1.993 0.819 57 HD2 PHE 7 HD2 PHE 7 14.004 3.830 3.472 58 HE1 PHE 7 HE1 PHE 7 9.383 2.276 2.508 59 HE2 PHE 7 HE2 PHE 7 12.193 4.182 5.126 60 HZ PHE 7 HZ PHE 7 9.894 3.412 4.662 61 HA PRO 8 HA PRO 8 14.834 4.537 -4.165 62 HB2 PRO 8 HB2 PRO 8 16.609 6.635 -4.378 63 HB3 PRO 8 HB3 PRO 8 14.830 6.756 -4.453 64 HG2 PRO 8 HG2 PRO 8 16.619 7.297 -2.083 65 HG3 PRO 8 HG3 PRO 8 15.228 8.258 -2.672 66 HD2 PRO 8 HD2 PRO 8 15.034 6.448 -0.602 67 HD3 PRO 8 HD3 PRO 8 13.692 6.750 -1.742 68 H GLU 9 H GLU 9 17.688 5.557 -2.290 69 HA GLU 9 HA GLU 9 18.860 2.946 -2.155 70 HB2 GLU 9 HB2 GLU 9 19.423 3.950 -4.566 71 HB3 GLU 9 HB3 GLU 9 20.471 5.038 -3.631 72 HG2 GLU 9 HG2 GLU 9 21.704 3.107 -2.714 73 HG3 GLU 9 HG3 GLU 9 20.607 1.994 -3.528 74 H SER 10 H SER 10 20.875 3.162 -0.840 75 HA SER 10 HA SER 10 21.999 3.929 0.873 76 HB2 SER 10 HB2 SER 10 21.963 6.481 -0.777 77 HB3 SER 10 HB3 SER 10 23.125 6.132 0.520 78 HG SER 10 HG SER 10 22.750 4.681 -1.898 79 H SER 11 H SER 11 19.059 4.254 1.093 80 HA SER 11 HA SER 11 18.760 6.601 2.899 81 HB2 SER 11 HB2 SER 11 16.730 5.188 1.127 82 HB3 SER 11 HB3 SER 11 16.416 6.587 2.161 83 HG SER 11 HG SER 11 18.246 6.492 -0.025 84 H ILE 12 H ILE 12 19.723 3.796 3.634 85 HA ILE 12 HA ILE 12 17.750 3.306 5.761 86 HB ILE 12 HB ILE 12 19.186 1.277 4.013 87 HG12 ILE 12 HG12 ILE 12 16.314 2.284 4.217 88 HG13 ILE 12 HG13 ILE 12 17.332 2.144 2.786 89 HG21 ILE 12 HG21 ILE 12 19.144 0.673 6.390 90 HG22 ILE 12 HG22 ILE 12 17.397 0.973 6.446 91 HG23 ILE 12 HG23 ILE 12 18.078 -0.369 5.477 92 HD11 ILE 12 HD13 ILE 12 15.634 0.486 2.701 93 HD12 ILE 12 HD11 ILE 12 17.185 -0.329 2.990 94 HD13 ILE 12 HD12 ILE 12 16.029 -0.075 4.340 95 H SER 13 H SER 13 18.875 3.508 7.710 96 HA SER 13 HA SER 13 21.823 3.136 7.792 97 HB2 SER 13 HB2 SER 13 20.337 5.662 8.678 98 HB3 SER 13 HB3 SER 13 22.075 5.365 8.823 99 HG SER 13 HG SER 13 21.552 6.681 7.024 100 H VAL 14 H VAL 14 22.644 2.770 9.808 101 HA VAL 14 HA VAL 14 20.807 2.730 12.148 102 HB VAL 14 HB VAL 14 23.028 0.778 11.469 103 HG11 VAL 14 HG11 VAL 14 23.032 1.163 13.898 104 HG12 VAL 14 HG12 VAL 14 21.269 0.938 13.969 105 HG13 VAL 14 HG13 VAL 14 22.341 -0.423 13.571 106 HG21 VAL 14 HG23 VAL 14 20.026 0.338 11.804 107 HG22 VAL 14 HG21 VAL 14 20.933 0.245 10.278 108 HG23 VAL 14 HG22 VAL 14 21.217 -0.944 11.557 109 H ILE 15 H ILE 15 21.694 3.648 13.941 110 HA ILE 15 HA ILE 15 24.359 4.946 13.833 111 HB ILE 15 HB ILE 15 21.546 6.096 13.913 112 HG12 ILE 15 HG12 ILE 15 24.053 6.561 12.290 113 HG13 ILE 15 HG13 ILE 15 22.444 6.076 11.754 114 HG21 ILE 15 HG21 ILE 15 23.949 7.563 15.012 115 HG22 ILE 15 HG22 ILE 15 22.328 8.251 14.720 116 HG23 ILE 15 HG23 ILE 15 22.493 6.989 15.893 117 HD11 ILE 15 HD13 ILE 15 23.300 8.832 12.758 118 HD12 ILE 15 HD11 ILE 15 22.849 8.376 11.102 119 HD13 ILE 15 HD12 ILE 15 21.616 8.387 12.386 120 H HIS 16 H HIS 16 25.189 5.318 16.002 121 HA HIS 16 HA HIS 16 23.975 3.654 18.059 122 HB2 HIS 16 HB2 HIS 16 26.447 4.059 17.844 123 HB3 HIS 16 HB3 HIS 16 26.184 5.724 18.378 124 HD1 HIS 16 HD1 HIS 16 25.361 2.144 19.701 125 HD2 HIS 16 HD2 HIS 16 26.331 6.047 20.986 126 HE1 HIS 16 HE1 HIS 16 25.591 2.037 22.246 127 H SER 17 H SER 17 24.248 7.189 17.408 128 HA SER 17 HA SER 17 21.764 7.782 18.690 129 HB2 SER 17 HB2 SER 17 22.933 9.499 20.251 130 HB3 SER 17 HB3 SER 17 22.805 7.821 20.786 131 HG SER 17 HG SER 17 24.894 8.710 21.136 132 H ALA 18 H ALA 18 21.132 9.902 18.005 133 HA ALA 18 HA ALA 18 22.756 11.069 15.832 134 HB1 ALA 18 HB3 ALA 18 20.896 12.738 15.733 135 HB2 ALA 18 HB1 ALA 18 20.335 11.076 15.511 136 HB3 ALA 18 HB2 ALA 18 20.101 11.900 17.079 137 H LYS 19 H LYS 19 23.467 13.312 16.021 138 HA LYS 19 HA LYS 19 24.920 13.886 18.356 139 HB2 LYS 19 HB2 LYS 19 25.211 14.698 15.989 140 HB3 LYS 19 HB3 LYS 19 24.016 15.944 16.357 141 HG2 LYS 19 HG2 LYS 19 25.387 16.876 18.148 142 HG3 LYS 19 HG3 LYS 19 26.449 15.456 18.139 143 HD2 LYS 19 HD2 LYS 19 27.677 17.098 17.015 144 HD3 LYS 19 HD3 LYS 19 27.060 15.983 15.789 145 HE2 LYS 19 HE2 LYS 19 25.040 17.791 15.734 146 HE3 LYS 19 HE3 LYS 19 26.291 18.856 16.384 147 HZ1 LYS 19 HZ3 LYS 19 26.280 19.002 14.013 148 HZ2 LYS 19 HZ1 LYS 19 27.641 18.180 14.393 149 HZ3 LYS 19 HZ2 LYS 19 26.307 17.376 13.827 150 H ASP 20 H ASP 20 21.744 15.048 17.270 151 HA ASP 20 HA ASP 20 20.613 15.229 19.849 152 HB2 ASP 20 HB2 ASP 20 20.154 17.485 20.081 153 HB3 ASP 20 HB3 ASP 20 21.884 17.505 19.714 154 H TRP 21 H TRP 21 18.281 16.492 19.356 155 HA TRP 21 HA TRP 21 17.079 14.936 17.376 156 HB2 TRP 21 HB2 TRP 21 15.046 16.166 17.851 157 HB3 TRP 21 HB3 TRP 21 15.880 15.689 19.323 158 HD1 TRP 21 HD1 TRP 21 16.730 17.625 20.916 159 HE1 TRP 21 HE1 TRP 21 16.478 20.161 20.960 160 HE3 TRP 21 HE3 TRP 21 14.637 18.288 16.291 161 HZ2 TRP 21 HZ2 TRP 21 15.608 22.261 19.138 162 HZ3 TRP 21 HZ3 TRP 21 14.142 20.570 15.459 163 HH2 TRP 21 HH2 TRP 21 14.691 22.552 16.841 164 H GLN 22 H GLN 22 18.384 18.288 17.073 165 HA GLN 22 HA GLN 22 17.164 18.955 14.526 166 HB2 GLN 22 HB2 GLN 22 19.840 19.757 15.698 167 HB3 GLN 22 HB3 GLN 22 19.103 20.440 14.260 168 HG2 GLN 22 HG2 GLN 22 17.275 21.383 15.482 169 HG3 GLN 22 HG3 GLN 22 17.657 20.455 16.933 170 HE21 GLN 22 HE22 GLN 22 19.781 20.836 17.962 171 HE22 GLN 22 HE21 GLN 22 20.391 22.496 18.014 172 H GLU 23 H GLU 23 20.321 17.365 15.457 173 HA GLU 23 HA GLU 23 21.055 16.672 12.809 174 HB2 GLU 23 HB2 GLU 23 22.427 16.604 15.012 175 HB3 GLU 23 HB3 GLU 23 21.672 15.018 15.268 176 HG2 GLU 23 HG2 GLU 23 23.666 14.428 14.239 177 HG3 GLU 23 HG3 GLU 23 22.587 14.459 12.871 178 H ALA 24 H ALA 24 18.960 15.008 15.147 179 HA ALA 24 HA ALA 24 18.824 12.542 13.734 180 HB1 ALA 24 HB3 ALA 24 17.039 12.001 15.246 181 HB2 ALA 24 HB1 ALA 24 18.251 12.967 16.124 182 HB3 ALA 24 HB2 ALA 24 16.737 13.717 15.592 183 H ILE 25 H ILE 25 16.952 15.583 13.370 184 HA ILE 25 HA ILE 25 15.078 14.471 11.460 185 HB ILE 25 HB ILE 25 16.058 17.334 11.611 186 HG12 ILE 25 HG12 ILE 25 14.615 15.966 13.657 187 HG13 ILE 25 HG13 ILE 25 15.102 17.644 13.562 188 HG21 ILE 25 HG21 ILE 25 14.876 16.696 9.530 189 HG22 ILE 25 HG22 ILE 25 13.484 16.170 10.471 190 HG23 ILE 25 HG23 ILE 25 13.979 17.884 10.445 191 HD11 ILE 25 HD13 ILE 25 12.493 16.446 12.597 192 HD12 ILE 25 HD11 ILE 25 12.737 17.454 14.033 193 HD13 ILE 25 HD12 ILE 25 12.930 18.170 12.424 194 H ASP 26 H ASP 26 18.265 16.177 11.192 195 HA ASP 26 HA ASP 26 18.438 16.047 8.367 196 HB2 ASP 26 HB2 ASP 26 19.995 17.386 9.661 197 HB3 ASP 26 HB3 ASP 26 20.680 15.945 10.411 198 H PHE 27 H PHE 27 19.498 13.632 10.832 199 HA PHE 27 HA PHE 27 20.195 11.670 8.879 200 HB2 PHE 27 HB2 PHE 27 19.703 11.590 11.868 201 HB3 PHE 27 HB3 PHE 27 19.980 10.120 10.955 202 HD1 PHE 27 HD1 PHE 27 22.031 10.467 9.111 203 HD2 PHE 27 HD2 PHE 27 21.770 12.258 13.061 204 HE1 PHE 27 HE1 PHE 27 24.491 10.628 9.219 205 HE2 PHE 27 HE2 PHE 27 24.220 12.338 13.154 206 HZ PHE 27 HZ PHE 27 25.596 11.553 11.247 207 H SER 28 H SER 28 17.009 12.709 9.846 208 HA SER 28 HA SER 28 15.749 10.195 8.957 209 HB2 SER 28 HB2 SER 28 14.485 12.945 9.474 210 HB3 SER 28 HB3 SER 28 13.631 11.444 9.221 211 HG SER 28 HG SER 28 15.510 11.942 11.319 212 H MET 29 H MET 29 17.007 13.144 7.502 213 HA MET 29 HA MET 29 15.420 12.585 5.019 214 HB2 MET 29 HB2 MET 29 16.527 15.222 5.951 215 HB3 MET 29 HB3 MET 29 15.254 14.912 4.763 216 HG2 MET 29 HG2 MET 29 14.637 14.175 7.596 217 HG3 MET 29 HG3 MET 29 14.813 15.867 7.203 218 HE1 MET 29 HE3 MET 29 11.471 13.081 5.860 219 HE2 MET 29 HE1 MET 29 13.184 12.679 5.511 220 HE3 MET 29 HE2 MET 29 12.612 12.829 7.203 221 H VAL 30 H VAL 30 18.747 13.035 6.115 222 HA VAL 30 HA VAL 30 19.786 14.464 4.046 223 HB VAL 30 HB VAL 30 20.985 13.966 6.083 224 HG11 VAL 30 HG11 VAL 30 22.139 11.859 6.511 225 HG12 VAL 30 HG12 VAL 30 20.402 11.558 6.382 226 HG13 VAL 30 HG13 VAL 30 21.478 11.145 5.027 227 HG21 VAL 30 HG23 VAL 30 22.599 13.008 3.690 228 HG22 VAL 30 HG21 VAL 30 22.256 14.701 4.095 229 HG23 VAL 30 HG22 VAL 30 23.225 13.708 5.198 230 H SER 31 H SER 31 19.228 10.896 3.923 231 HA SER 31 HA SER 31 20.679 10.567 1.523 232 HB2 SER 31 HB2 SER 31 18.306 8.958 2.556 233 HB3 SER 31 HB3 SER 31 19.552 8.415 1.415 234 HG SER 31 HG SER 31 20.611 7.833 3.079 235 H LEU 32 H LEU 32 17.397 11.745 2.097 236 HA LEU 32 HA LEU 32 16.597 11.609 -0.725 237 HB2 LEU 32 HB2 LEU 32 15.415 12.922 1.769 238 HB3 LEU 32 HB3 LEU 32 14.687 13.095 0.194 239 HG LEU 32 HG LEU 32 15.208 10.383 1.456 240 HD11 LEU 32 HD11 LEU 32 13.739 11.639 2.950 241 HD12 LEU 32 HD12 LEU 32 12.681 12.072 1.589 242 HD13 LEU 32 HD13 LEU 32 12.817 10.383 2.113 243 HD21 LEU 32 HD23 LEU 32 14.825 10.408 -1.027 244 HD22 LEU 32 HD21 LEU 32 13.621 9.518 -0.118 245 HD23 LEU 32 HD22 LEU 32 13.233 11.141 -0.724 246 H LEU 33 H LEU 33 17.847 14.008 1.645 247 HA LEU 33 HA LEU 33 17.709 16.274 0.029 248 HB2 LEU 33 HB2 LEU 33 18.258 16.249 2.442 249 HB3 LEU 33 HB3 LEU 33 19.828 15.544 2.077 250 HG LEU 33 HG LEU 33 20.483 17.574 0.818 251 HD11 LEU 33 HD11 LEU 33 17.789 18.664 1.730 252 HD12 LEU 33 HD12 LEU 33 19.103 19.610 0.995 253 HD13 LEU 33 HD13 LEU 33 18.300 18.373 0.054 254 HD21 LEU 33 HD23 LEU 33 20.792 18.983 2.779 255 HD22 LEU 33 HD21 LEU 33 19.536 18.079 3.657 256 HD23 LEU 33 HD22 LEU 33 21.044 17.285 3.178 257 H ASP 34 H ASP 34 20.354 13.885 0.385 258 HA ASP 34 HA ASP 34 22.256 15.055 -1.298 259 HB2 ASP 34 HB2 ASP 34 22.623 13.071 0.252 260 HB3 ASP 34 HB3 ASP 34 21.675 12.067 -0.862 261 H LYS 35 H LYS 35 19.547 13.020 -2.069 262 HA LYS 35 HA LYS 35 20.306 12.845 -4.943 263 HB2 LYS 35 HB2 LYS 35 18.387 11.329 -3.195 264 HB3 LYS 35 HB3 LYS 35 18.466 11.201 -4.985 265 HG2 LYS 35 HG2 LYS 35 20.949 10.844 -4.780 266 HG3 LYS 35 HG3 LYS 35 20.771 10.760 -3.023 267 HD2 LYS 35 HD2 LYS 35 19.231 9.070 -4.969 268 HD3 LYS 35 HD3 LYS 35 20.855 8.617 -4.411 269 HE2 LYS 35 HE2 LYS 35 18.344 8.874 -2.694 270 HE3 LYS 35 HE3 LYS 35 19.214 7.377 -3.112 271 HZ1 LYS 35 HZ3 LYS 35 19.899 7.841 -1.036 272 HZ2 LYS 35 HZ1 LYS 35 21.143 8.469 -1.901 273 HZ3 LYS 35 HZ2 LYS 35 19.997 9.477 -1.247 274 H ASN 36 H ASN 36 19.195 15.269 -3.338 275 HA ASN 36 HA ASN 36 17.643 16.831 -3.450 276 HB2 ASN 36 HB2 ASN 36 17.278 17.918 -5.666 277 HB3 ASN 36 HB3 ASN 36 18.918 17.743 -5.092 278 HD21 ASN 36 HD22 ASN 36 20.271 16.127 -6.006 279 HD22 ASN 36 HD21 ASN 36 20.027 15.580 -7.655 280 H TYR 37 H TYR 37 16.366 14.412 -2.973 281 HA TYR 37 HA TYR 37 13.801 14.428 -4.423 282 HB2 TYR 37 HB2 TYR 37 14.896 13.020 -1.971 283 HB3 TYR 37 HB3 TYR 37 13.176 13.066 -2.263 284 HD1 TYR 37 HD1 TYR 37 16.417 11.914 -3.852 285 HD2 TYR 37 HD2 TYR 37 12.150 11.367 -3.493 286 HE1 TYR 37 HE1 TYR 37 16.533 10.030 -5.436 287 HE2 TYR 37 HE2 TYR 37 12.282 9.463 -5.076 288 HH TYR 37 HH TYR 37 13.625 8.223 -6.506 289 H ILE 38 H ILE 38 15.361 16.273 -1.976 290 HA ILE 38 HA ILE 38 12.963 17.901 -1.485 291 HB ILE 38 HB ILE 38 13.478 17.928 0.946 292 HG12 ILE 38 HG12 ILE 38 15.364 15.606 0.347 293 HG13 ILE 38 HG13 ILE 38 15.857 17.243 0.801 294 HG21 ILE 38 HG21 ILE 38 12.879 15.090 0.020 295 HG22 ILE 38 HG22 ILE 38 12.401 15.843 1.547 296 HG23 ILE 38 HG23 ILE 38 11.705 16.425 0.044 297 HD11 ILE 38 HD13 ILE 38 14.366 15.287 2.563 298 HD12 ILE 38 HD11 ILE 38 16.062 15.785 2.656 299 HD13 ILE 38 HD12 ILE 38 14.779 16.974 2.993 300 H SER 39 H SER 39 13.673 19.963 -0.376 301 HA SER 39 HA SER 39 16.400 20.837 -1.193 302 HB2 SER 39 HB2 SER 39 15.471 23.109 -0.637 303 HB3 SER 39 HB3 SER 39 14.642 22.294 -1.970 304 HG SER 39 HG SER 39 12.944 21.845 -0.682 305 H GLU 40 H GLU 40 17.588 22.182 0.502 306 HA GLU 40 HA GLU 40 17.836 20.833 3.001 307 HB2 GLU 40 HB2 GLU 40 18.640 23.664 2.198 308 HB3 GLU 40 HB3 GLU 40 19.171 22.832 3.665 309 HG2 GLU 40 HG2 GLU 40 20.272 21.085 2.291 310 HG3 GLU 40 HG3 GLU 40 19.758 21.902 0.819 311 H ASN 41 H ASN 41 15.845 23.654 2.071 312 HA ASN 41 HA ASN 41 15.155 24.316 4.761 313 HB2 ASN 41 HB2 ASN 41 14.132 26.046 3.894 314 HB3 ASN 41 HB3 ASN 41 14.714 25.544 2.310 315 HD21 ASN 41 HD21 ASN 41 13.073 23.859 1.123 316 HD22 ASN 41 HD22 ASN 41 11.382 24.207 1.441 317 H TYR 42 H TYR 42 14.027 21.669 2.763 318 HA TYR 42 HA TYR 42 11.463 21.271 3.987 319 HB2 TYR 42 HB2 TYR 42 12.309 20.194 1.882 320 HB3 TYR 42 HB3 TYR 42 13.429 19.249 2.855 321 HD1 TYR 42 HD2 TYR 42 9.856 19.741 1.993 322 HD2 TYR 42 HD1 TYR 42 12.718 17.309 4.120 323 HE1 TYR 42 HE2 TYR 42 8.189 17.916 2.155 324 HE2 TYR 42 HE1 TYR 42 11.059 15.477 4.252 325 HH TYR 42 HH TYR 42 8.959 14.714 3.615 326 H ILE 43 H ILE 43 14.790 20.165 4.803 327 HA ILE 43 HA ILE 43 14.111 18.628 7.102 328 HB ILE 43 HB ILE 43 16.656 20.149 6.332 329 HG12 ILE 43 HG12 ILE 43 17.268 17.485 6.191 330 HG13 ILE 43 HG13 ILE 43 15.559 17.425 5.752 331 HG21 ILE 43 HG21 ILE 43 16.317 18.082 8.538 332 HG22 ILE 43 HG22 ILE 43 17.845 18.802 7.989 333 HG23 ILE 43 HG23 ILE 43 16.631 19.823 8.762 334 HD11 ILE 43 HD13 ILE 43 17.661 19.170 4.424 335 HD12 ILE 43 HD11 ILE 43 17.089 17.605 3.820 336 HD13 ILE 43 HD12 ILE 43 15.971 18.977 3.897 337 H GLN 44 H GLN 44 15.016 22.137 6.796 338 HA GLN 44 HA GLN 44 14.684 22.486 9.609 339 HB2 GLN 44 HB2 GLN 44 16.063 23.916 7.878 340 HB3 GLN 44 HB3 GLN 44 14.566 24.830 7.727 341 HG2 GLN 44 HG2 GLN 44 15.989 25.891 9.400 342 HG3 GLN 44 HG3 GLN 44 14.592 25.209 10.218 343 HE21 GLN 44 HE22 GLN 44 15.318 24.494 12.273 344 HE22 GLN 44 HE21 GLN 44 16.696 23.447 12.502 345 H ALA 45 H ALA 45 12.337 22.635 6.980 346 HA ALA 45 HA ALA 45 10.285 24.026 8.302 347 HB1 ALA 45 HB3 ALA 45 8.727 22.826 6.845 348 HB2 ALA 45 HB1 ALA 45 10.166 23.295 5.915 349 HB3 ALA 45 HB2 ALA 45 9.938 21.611 6.457 350 H ILE 46 H ILE 46 11.273 20.558 8.517 351 HA ILE 46 HA ILE 46 9.118 19.795 10.257 352 HB ILE 46 HB ILE 46 11.839 18.513 9.838 353 HG12 ILE 46 HG12 ILE 46 9.164 17.858 8.526 354 HG13 ILE 46 HG13 ILE 46 10.472 18.719 7.731 355 HG21 ILE 46 HG21 ILE 46 10.921 16.532 10.826 356 HG22 ILE 46 HG22 ILE 46 10.537 17.822 11.947 357 HG23 ILE 46 HG23 ILE 46 9.279 17.208 10.858 358 HD11 ILE 46 HD13 ILE 46 10.615 15.836 8.678 359 HD12 ILE 46 HD11 ILE 46 10.536 16.420 7.016 360 HD13 ILE 46 HD12 ILE 46 11.965 16.772 8.016 361 H LYS 47 H LYS 47 12.545 20.785 10.773 362 HA LYS 47 HA LYS 47 12.524 20.453 13.573 363 HB2 LYS 47 HB2 LYS 47 14.076 22.363 11.797 364 HB3 LYS 47 HB3 LYS 47 14.433 22.137 13.509 365 HG2 LYS 47 HG2 LYS 47 15.081 19.848 13.189 366 HG3 LYS 47 HG3 LYS 47 14.492 19.832 11.512 367 HD2 LYS 47 HD2 LYS 47 16.143 21.488 10.867 368 HD3 LYS 47 HD3 LYS 47 16.741 21.585 12.552 369 HE2 LYS 47 HE2 LYS 47 17.439 19.258 12.412 370 HE3 LYS 47 HE3 LYS 47 16.886 19.147 10.746 371 HZ1 LYS 47 HZ3 LYS 47 18.534 20.886 10.175 372 HZ2 LYS 47 HZ1 LYS 47 19.052 20.953 11.714 373 HZ3 LYS 47 HZ2 LYS 47 19.270 19.592 10.851 374 H ASP 48 H ASP 48 11.527 23.310 11.603 375 HA ASP 48 HA ASP 48 11.216 25.125 13.727 376 HB2 ASP 48 HB2 ASP 48 11.148 25.818 11.399 377 HB3 ASP 48 HB3 ASP 48 9.673 24.887 11.121 378 H SER 49 H SER 49 8.719 22.852 12.355 379 HA SER 49 HA SER 49 6.775 23.549 14.346 380 HB2 SER 49 HB2 SER 49 7.046 21.021 12.708 381 HB3 SER 49 HB3 SER 49 5.602 21.541 13.599 382 HG SER 49 HG SER 49 5.458 22.183 11.421 383 H THR 50 H THR 50 9.495 21.258 14.316 384 HA THR 50 HA THR 50 8.723 19.803 16.633 385 HB THR 50 HB THR 50 11.518 20.306 15.574 386 HG1 THR 50 HG1 THR 50 10.136 19.376 14.013 387 HG21 THR 50 HG23 THR 50 10.412 18.058 17.296 388 HG22 THR 50 HG21 THR 50 12.053 18.163 16.618 389 HG23 THR 50 HG22 THR 50 11.534 19.331 17.836 390 H ILE 51 H ILE 51 10.579 22.882 16.239 391 HA ILE 51 HA ILE 51 11.000 23.289 19.057 392 HB ILE 51 HB ILE 51 10.841 25.252 16.724 393 HG12 ILE 51 HG12 ILE 51 13.300 24.202 18.193 394 HG13 ILE 51 HG13 ILE 51 12.677 23.481 16.717 395 HG21 ILE 51 HG21 ILE 51 10.423 26.474 18.832 396 HG22 ILE 51 HG22 ILE 51 11.875 25.748 19.554 397 HG23 ILE 51 HG23 ILE 51 12.001 26.882 18.194 398 HD11 ILE 51 HD13 ILE 51 14.480 24.929 16.109 399 HD12 ILE 51 HD11 ILE 51 12.971 25.654 15.522 400 HD13 ILE 51 HD12 ILE 51 13.776 26.299 16.975 401 H ASN 52 H ASN 52 8.439 24.387 16.775 402 HA ASN 52 HA ASN 52 7.145 26.092 18.648 403 HB2 ASN 52 HB2 ASN 52 6.330 24.853 16.000 404 HB3 ASN 52 HB3 ASN 52 5.134 25.675 16.961 405 HD21 ASN 52 HD22 ASN 52 8.269 26.219 15.299 406 HD22 ASN 52 HD21 ASN 52 8.079 27.950 15.190 407 H ASN 53 H ASN 53 6.638 22.661 17.935 408 HA ASN 53 HA ASN 53 4.538 22.482 20.046 409 HB2 ASN 53 HB2 ASN 53 3.070 22.785 18.318 410 HB3 ASN 53 HB3 ASN 53 4.222 22.315 17.081 411 HD21 ASN 53 HD22 ASN 53 4.257 20.245 16.294 412 HD22 ASN 53 HD21 ASN 53 3.147 18.996 16.803 413 H GLY 54 H GLY 54 6.537 20.646 17.633 414 HA2 GLY 54 HA2 GLY 54 7.968 18.955 19.028 415 HA3 GLY 54 HA3 GLY 54 6.384 18.246 19.368 416 HA PRO 55 HA PRO 55 8.485 16.289 15.533 417 HB2 PRO 55 HB2 PRO 55 6.929 14.195 17.122 418 HB3 PRO 55 HB3 PRO 55 8.309 13.917 16.005 419 HG2 PRO 55 HG2 PRO 55 8.755 14.133 18.644 420 HG3 PRO 55 HG3 PRO 55 9.783 15.030 17.486 421 HD2 PRO 55 HD2 PRO 55 7.569 16.092 19.229 422 HD3 PRO 55 HD3 PRO 55 9.106 16.856 18.715 423 H TYR 56 H TYR 56 7.513 16.555 13.664 424 HA TYR 56 HA TYR 56 4.877 17.031 13.087 425 HB2 TYR 56 HB2 TYR 56 7.287 16.247 11.608 426 HB3 TYR 56 HB3 TYR 56 5.869 15.579 10.878 427 HD1 TYR 56 HD1 TYR 56 7.552 18.697 11.761 428 HD2 TYR 56 HD2 TYR 56 4.141 16.921 9.827 429 HE1 TYR 56 HE1 TYR 56 7.185 20.803 10.431 430 HE2 TYR 56 HE2 TYR 56 3.723 19.009 8.570 431 HH TYR 56 HH TYR 56 4.463 21.186 8.137 432 H TYR 57 H TYR 57 6.338 13.718 13.408 433 HA TYR 57 HA TYR 57 3.633 12.629 13.389 434 HB2 TYR 57 HB2 TYR 57 5.745 11.565 11.544 435 HB3 TYR 57 HB3 TYR 57 4.196 10.808 11.854 436 HD1 TYR 57 HD2 TYR 57 2.064 11.825 10.992 437 HD2 TYR 57 HD1 TYR 57 5.928 13.495 10.074 438 HE1 TYR 57 HE2 TYR 57 1.040 13.213 9.212 439 HE2 TYR 57 HE1 TYR 57 4.915 14.954 8.377 440 HH TYR 57 HH TYR 57 1.412 14.871 7.592 441 H ILE 58 H ILE 58 3.432 10.959 14.806 442 HA ILE 58 HA ILE 58 5.741 9.456 15.835 443 HB ILE 58 HB ILE 58 3.738 11.013 17.518 444 HG12 ILE 58 HG12 ILE 58 5.649 12.380 16.841 445 HG13 ILE 58 HG13 ILE 58 5.559 12.137 18.572 446 HG21 ILE 58 HG21 ILE 58 5.692 8.838 18.395 447 HG22 ILE 58 HG22 ILE 58 4.906 9.973 19.514 448 HG23 ILE 58 HG23 ILE 58 3.929 8.847 18.570 449 HD11 ILE 58 HD13 ILE 58 7.479 10.687 16.706 450 HD12 ILE 58 HD11 ILE 58 7.887 12.011 17.806 451 HD13 ILE 58 HD12 ILE 58 7.376 10.459 18.467 452 H LEU 59 H LEU 59 5.079 7.334 16.168 453 HA LEU 59 HA LEU 59 2.250 6.707 15.381 454 HB2 LEU 59 HB2 LEU 59 4.787 5.138 14.748 455 HB3 LEU 59 HB3 LEU 59 3.158 4.714 14.282 456 HG LEU 59 HG LEU 59 4.222 5.515 12.370 457 HD11 LEU 59 HD11 LEU 59 1.881 6.248 12.652 458 HD12 LEU 59 HD12 LEU 59 2.438 7.787 13.337 459 HD13 LEU 59 HD13 LEU 59 2.804 7.383 11.662 460 HD21 LEU 59 HD23 LEU 59 5.505 7.424 12.097 461 HD22 LEU 59 HD21 LEU 59 4.895 8.229 13.527 462 HD23 LEU 59 HD22 LEU 59 6.017 6.849 13.666 463 H ALA 60 H ALA 60 4.938 5.939 17.501 464 HA ALA 60 HA ALA 60 3.377 4.352 19.329 465 HB1 ALA 60 HB3 ALA 60 4.876 2.323 19.054 466 HB2 ALA 60 HB1 ALA 60 3.879 2.610 17.619 467 HB3 ALA 60 HB2 ALA 60 5.584 3.068 17.613 468 HA PRO 61 HA PRO 61 6.493 6.300 21.784 469 HB2 PRO 61 HB2 PRO 61 7.251 4.428 23.701 470 HB3 PRO 61 HB3 PRO 61 5.759 5.414 23.745 471 HG2 PRO 61 HG2 PRO 61 6.093 2.573 22.756 472 HG3 PRO 61 HG3 PRO 61 4.798 3.243 23.797 473 HD2 PRO 61 HD2 PRO 61 4.426 2.871 21.141 474 HD3 PRO 61 HD3 PRO 61 3.754 4.312 21.956 475 H GLY 62 H GLY 62 8.395 6.789 20.883 476 HA2 GLY 62 HA2 GLY 62 10.658 6.496 20.540 477 HA3 GLY 62 HA3 GLY 62 10.510 4.739 20.604 478 H VAL 63 H VAL 63 8.086 6.085 18.536 479 HA VAL 63 HA VAL 63 9.782 5.531 16.143 480 HB VAL 63 HB VAL 63 6.929 4.612 16.640 481 HG11 VAL 63 HG11 VAL 63 7.494 5.008 14.254 482 HG12 VAL 63 HG12 VAL 63 8.879 3.914 14.408 483 HG13 VAL 63 HG13 VAL 63 7.219 3.301 14.593 484 HG21 VAL 63 HG23 VAL 63 7.884 2.306 16.728 485 HG22 VAL 63 HG21 VAL 63 9.521 2.999 16.730 486 HG23 VAL 63 HG22 VAL 63 8.408 3.289 18.086 487 H ALA 64 H ALA 64 9.761 7.133 14.739 488 HA ALA 64 HA ALA 64 7.506 9.076 14.657 489 HB1 ALA 64 HB3 ALA 64 9.126 10.861 14.296 490 HB2 ALA 64 HB1 ALA 64 9.558 10.022 15.793 491 HB3 ALA 64 HB2 ALA 64 10.466 9.703 14.293 492 H MET 65 H MET 65 7.525 10.280 12.538 493 HA MET 65 HA MET 65 8.828 8.834 10.341 494 HB2 MET 65 HB2 MET 65 6.798 7.667 10.471 495 HB3 MET 65 HB3 MET 65 5.860 9.174 10.598 496 HG2 MET 65 HG2 MET 65 6.913 9.507 8.115 497 HG3 MET 65 HG3 MET 65 6.975 7.754 8.218 498 HE1 MET 65 HE3 MET 65 5.031 6.315 8.911 499 HE2 MET 65 HE1 MET 65 4.399 7.296 10.245 500 HE3 MET 65 HE2 MET 65 3.300 6.776 8.958 501 HA PRO 66 HA PRO 66 8.584 13.443 10.458 502 HB2 PRO 66 HB2 PRO 66 11.454 13.248 9.434 503 HB3 PRO 66 HB3 PRO 66 10.775 14.367 10.656 504 HG2 PRO 66 HG2 PRO 66 12.236 12.244 11.457 505 HG3 PRO 66 HG3 PRO 66 10.729 12.669 12.322 506 HD2 PRO 66 HD2 PRO 66 11.105 10.567 10.164 507 HD3 PRO 66 HD3 PRO 66 10.307 10.416 11.755 508 H HIS 67 H HIS 67 8.476 14.932 8.735 509 HA HIS 67 HA HIS 67 8.754 14.604 5.961 510 HB2 HIS 67 HB2 HIS 67 7.286 12.750 5.864 511 HB3 HIS 67 HB3 HIS 67 6.305 13.316 7.192 512 HD1 HIS 67 HD1 HIS 67 4.174 14.797 6.609 513 HD2 HIS 67 HD2 HIS 67 6.620 13.791 3.321 514 HE1 HIS 67 HE1 HIS 67 2.896 15.429 4.535 515 H ALA 68 H ALA 68 7.582 16.402 4.912 516 HA ALA 68 HA ALA 68 6.047 18.240 6.615 517 HB1 ALA 68 HB3 ALA 68 8.307 19.223 6.673 518 HB2 ALA 68 HB1 ALA 68 8.409 19.129 4.901 519 HB3 ALA 68 HB2 ALA 68 7.220 20.196 5.675 520 H ARG 69 H ARG 69 4.588 19.508 5.226 521 HA ARG 69 HA ARG 69 3.455 17.889 3.221 522 HB2 ARG 69 HB2 ARG 69 3.191 20.853 3.862 523 HB3 ARG 69 HB3 ARG 69 2.250 20.128 2.557 524 HG2 ARG 69 HG2 ARG 69 2.191 19.118 5.437 525 HG3 ARG 69 HG3 ARG 69 1.064 20.322 4.804 526 HD2 ARG 69 HD2 ARG 69 0.083 18.783 3.265 527 HD3 ARG 69 HD3 ARG 69 1.397 17.619 3.473 528 HE ARG 69 HE ARG 69 -0.170 18.248 5.879 529 HH11 ARG 69 HH11 ARG 69 0.190 16.046 3.124 530 HH12 ARG 69 HH12 ARG 69 -0.347 14.641 3.976 531 HH21 ARG 69 HH21 ARG 69 -1.083 16.419 6.968 532 HH22 ARG 69 HH22 ARG 69 -1.243 14.910 6.153 533 HA PRO 70 HA PRO 70 5.945 18.050 -0.315 534 HB2 PRO 70 HB2 PRO 70 3.421 19.020 -1.751 535 HB3 PRO 70 HB3 PRO 70 4.632 17.862 -2.345 536 HG2 PRO 70 HG2 PRO 70 2.350 16.967 -1.205 537 HG3 PRO 70 HG3 PRO 70 3.902 16.204 -0.735 538 HD2 PRO 70 HD2 PRO 70 2.262 18.221 0.776 539 HD3 PRO 70 HD3 PRO 70 3.233 16.843 1.381 540 H GLU 71 H GLU 71 3.678 20.826 -0.182 541 HA GLU 71 HA GLU 71 5.036 22.620 -1.833 542 HB2 GLU 71 HB2 GLU 71 3.227 23.289 0.528 543 HB3 GLU 71 HB3 GLU 71 3.545 24.296 -0.890 544 HG2 GLU 71 HG2 GLU 71 2.499 22.466 -2.312 545 HG3 GLU 71 HG3 GLU 71 2.031 21.652 -0.811 546 H CYS 72 H CYS 72 6.055 21.600 1.295 547 HA CYS 72 HA CYS 72 7.156 24.154 2.199 548 HB2 CYS 72 HB2 CYS 72 7.731 21.308 3.153 549 HB3 CYS 72 HB3 CYS 72 8.202 22.814 3.962 550 HG CYS 72 HG CYS 72 5.255 21.517 3.348 551 H GLY 73 H GLY 73 8.177 21.548 0.071 552 HA2 GLY 73 HA2 GLY 73 10.253 22.650 -1.173 553 HA3 GLY 73 HA3 GLY 73 11.035 22.269 0.370 554 H ALA 74 H ALA 74 8.564 20.000 -0.745 555 HA ALA 74 HA ALA 74 10.594 17.915 -1.148 556 HB1 ALA 74 HB3 ALA 74 7.640 17.924 -1.793 557 HB2 ALA 74 HB1 ALA 74 8.716 16.515 -1.737 558 HB3 ALA 74 HB2 ALA 74 8.335 17.385 -0.237 559 H LEU 75 H LEU 75 11.029 16.942 -3.154 560 HA LEU 75 HA LEU 75 10.410 18.565 -5.588 561 HB2 LEU 75 HB2 LEU 75 13.063 17.322 -4.795 562 HB3 LEU 75 HB3 LEU 75 12.745 18.155 -6.306 563 HG LEU 75 HG LEU 75 12.664 19.462 -3.546 564 HD11 LEU 75 HD11 LEU 75 14.802 19.597 -5.711 565 HD12 LEU 75 HD12 LEU 75 14.797 20.495 -4.174 566 HD13 LEU 75 HD13 LEU 75 14.934 18.732 -4.169 567 HD21 LEU 75 HD23 LEU 75 12.583 20.702 -6.340 568 HD22 LEU 75 HD21 LEU 75 11.237 20.658 -5.183 569 HD23 LEU 75 HD22 LEU 75 12.683 21.596 -4.805 570 H LYS 76 H LYS 76 11.100 15.371 -4.162 571 HA LYS 76 HA LYS 76 9.816 14.079 -6.457 572 HB2 LYS 76 HB2 LYS 76 12.399 13.110 -5.247 573 HB3 LYS 76 HB3 LYS 76 11.568 12.391 -6.621 574 HG2 LYS 76 HG2 LYS 76 12.203 14.355 -8.004 575 HG3 LYS 76 HG3 LYS 76 12.944 15.120 -6.583 576 HD2 LYS 76 HD2 LYS 76 14.476 13.122 -6.373 577 HD3 LYS 76 HD3 LYS 76 13.878 12.569 -7.954 578 HE2 LYS 76 HE2 LYS 76 14.658 14.646 -9.007 579 HE3 LYS 76 HE3 LYS 76 15.047 15.339 -7.428 580 HZ1 LYS 76 HZ3 LYS 76 16.462 13.083 -8.708 581 HZ2 LYS 76 HZ1 LYS 76 17.022 14.605 -8.394 582 HZ3 LYS 76 HZ2 LYS 76 16.734 13.596 -7.158 583 H THR 77 H THR 77 9.019 11.876 -5.816 584 HA THR 77 HA THR 77 8.408 11.800 -3.013 585 HB THR 77 HB THR 77 7.465 10.261 -5.448 586 HG1 THR 77 HG1 THR 77 6.139 11.807 -5.727 587 HG21 THR 77 HG23 THR 77 7.079 9.022 -3.329 588 HG22 THR 77 HG21 THR 77 6.229 10.442 -2.675 589 HG23 THR 77 HG22 THR 77 5.577 9.553 -4.082 590 H GLY 78 H GLY 78 9.419 10.518 -1.533 591 HA2 GLY 78 HA2 GLY 78 10.492 7.932 -2.135 592 HA3 GLY 78 HA3 GLY 78 11.778 9.142 -2.010 593 H MET 79 H MET 79 12.141 7.425 -0.122 594 HA MET 79 HA MET 79 11.136 8.592 2.403 595 HB2 MET 79 HB2 MET 79 10.974 5.670 1.538 596 HB3 MET 79 HB3 MET 79 10.864 6.179 3.217 597 HG2 MET 79 HG2 MET 79 8.860 7.518 2.734 598 HG3 MET 79 HG3 MET 79 8.923 7.004 1.047 599 HE1 MET 79 HE3 MET 79 6.097 4.599 1.753 600 HE2 MET 79 HE1 MET 79 6.142 6.282 2.325 601 HE3 MET 79 HE2 MET 79 6.803 5.861 0.728 602 H SER 80 H SER 80 12.335 7.469 4.289 603 HA SER 80 HA SER 80 14.871 6.232 3.666 604 HB2 SER 80 HB2 SER 80 14.791 8.878 5.184 605 HB3 SER 80 HB3 SER 80 16.203 7.811 5.079 606 HG SER 80 HG SER 80 15.146 8.337 2.634 607 H LEU 81 H LEU 81 15.796 5.274 5.631 608 HA LEU 81 HA LEU 81 13.878 4.891 7.857 609 HB2 LEU 81 HB2 LEU 81 13.795 3.106 6.111 610 HB3 LEU 81 HB3 LEU 81 15.530 2.877 6.226 611 HG LEU 81 HG LEU 81 15.377 1.925 8.407 612 HD11 LEU 81 HD11 LEU 81 13.224 1.568 9.545 613 HD12 LEU 81 HD12 LEU 81 13.534 3.291 9.387 614 HD13 LEU 81 HD13 LEU 81 12.408 2.476 8.270 615 HD21 LEU 81 HD23 LEU 81 14.864 0.569 6.349 616 HD22 LEU 81 HD21 LEU 81 14.000 -0.063 7.779 617 HD23 LEU 81 HD22 LEU 81 13.159 0.929 6.575 618 H THR 82 H THR 82 14.902 5.382 9.777 619 HA THR 82 HA THR 82 17.854 4.998 9.973 620 HB THR 82 HB THR 82 16.145 7.396 10.786 621 HG1 THR 82 HG1 THR 82 17.605 8.382 9.152 622 HG21 THR 82 HG23 THR 82 17.955 7.067 12.365 623 HG22 THR 82 HG21 THR 82 19.150 6.925 11.052 624 HG23 THR 82 HG22 THR 82 18.301 8.469 11.351 625 H LEU 83 H LEU 83 18.471 3.969 11.844 626 HA LEU 83 HA LEU 83 16.533 3.870 14.114 627 HB2 LEU 83 HB2 LEU 83 16.753 1.672 12.889 628 HB3 LEU 83 HB3 LEU 83 18.484 1.725 13.242 629 HG LEU 83 HG LEU 83 17.778 1.863 15.747 630 HD11 LEU 83 HD11 LEU 83 15.642 0.853 16.343 631 HD12 LEU 83 HD12 LEU 83 15.367 2.319 15.417 632 HD13 LEU 83 HD13 LEU 83 15.162 0.733 14.631 633 HD21 LEU 83 HD23 LEU 83 17.580 -0.589 15.895 634 HD22 LEU 83 HD21 LEU 83 17.243 -0.657 14.155 635 HD23 LEU 83 HD22 LEU 83 18.830 -0.110 14.735 636 H LEU 84 H LEU 84 17.432 4.330 16.086 637 HA LEU 84 HA LEU 84 20.335 5.012 16.287 638 HB2 LEU 84 HB2 LEU 84 17.831 6.289 17.395 639 HB3 LEU 84 HB3 LEU 84 19.391 6.470 18.203 640 HG LEU 84 HG LEU 84 20.337 7.699 16.418 641 HD11 LEU 84 HD11 LEU 84 17.770 7.204 14.870 642 HD12 LEU 84 HD12 LEU 84 18.995 8.421 14.432 643 HD13 LEU 84 HD13 LEU 84 19.420 6.714 14.419 644 HD21 LEU 84 HD23 LEU 84 18.804 9.670 16.465 645 HD22 LEU 84 HD21 LEU 84 17.513 8.637 17.090 646 HD23 LEU 84 HD22 LEU 84 18.982 8.908 18.052 647 H GLU 85 H GLU 85 21.295 3.469 17.605 648 HA GLU 85 HA GLU 85 19.897 1.524 19.074 649 HB2 GLU 85 HB2 GLU 85 22.740 2.524 19.496 650 HB3 GLU 85 HB3 GLU 85 22.072 1.049 20.187 651 HG2 GLU 85 HG2 GLU 85 21.637 0.178 17.887 652 HG3 GLU 85 HG3 GLU 85 22.466 1.585 17.219 653 H GLN 86 H GLN 86 20.853 4.741 20.117 654 HA GLN 86 HA GLN 86 19.854 4.169 22.878 655 HB2 GLN 86 HB2 GLN 86 21.589 6.424 21.843 656 HB3 GLN 86 HB3 GLN 86 21.126 6.188 23.517 657 HG2 GLN 86 HG2 GLN 86 22.726 4.147 21.910 658 HG3 GLN 86 HG3 GLN 86 23.437 5.370 22.956 659 HE21 GLN 86 HE22 GLN 86 21.276 2.448 22.974 660 HE22 GLN 86 HE21 GLN 86 21.631 2.039 24.634 661 H GLY 87 H GLY 87 18.849 5.573 19.976 662 HA2 GLY 87 HA2 GLY 87 17.309 7.126 19.360 663 HA3 GLY 87 HA3 GLY 87 16.607 7.017 20.979 664 H VAL 88 H VAL 88 16.367 9.455 20.102 665 HA VAL 88 HA VAL 88 18.073 10.850 21.966 666 HB VAL 88 HB VAL 88 18.945 10.929 19.361 667 HG11 VAL 88 HG11 VAL 88 16.926 11.989 18.548 668 HG12 VAL 88 HG12 VAL 88 17.237 13.410 19.587 669 HG13 VAL 88 HG13 VAL 88 18.387 12.986 18.312 670 HG21 VAL 88 HG23 VAL 88 19.228 13.138 21.396 671 HG22 VAL 88 HG21 VAL 88 20.173 11.625 21.297 672 HG23 VAL 88 HG22 VAL 88 20.283 12.819 19.996 673 H TYR 89 H TYR 89 17.017 13.112 22.351 674 HA TYR 89 HA TYR 89 14.129 12.475 22.380 675 HB2 TYR 89 HB2 TYR 89 15.341 12.462 24.549 676 HB3 TYR 89 HB3 TYR 89 15.607 14.188 24.363 677 HD1 TYR 89 HD2 TYR 89 12.281 13.104 23.091 678 HD2 TYR 89 HD1 TYR 89 14.508 14.217 26.649 679 HE1 TYR 89 HE2 TYR 89 10.215 13.517 24.247 680 HE2 TYR 89 HE1 TYR 89 12.371 14.671 27.814 681 HH TYR 89 HH TYR 89 9.200 14.351 26.130 682 H PHE 90 H PHE 90 13.033 13.497 20.918 683 HA PHE 90 HA PHE 90 13.590 16.187 19.946 684 HB2 PHE 90 HB2 PHE 90 11.372 14.137 19.665 685 HB3 PHE 90 HB3 PHE 90 11.304 15.750 18.953 686 HD1 PHE 90 HD2 PHE 90 13.842 12.872 18.989 687 HD2 PHE 90 HD1 PHE 90 11.727 15.851 16.675 688 HE1 PHE 90 HE2 PHE 90 14.916 12.053 16.938 689 HE2 PHE 90 HE1 PHE 90 12.765 14.969 14.624 690 HZ PHE 90 HZ PHE 90 14.386 13.096 14.739 691 HA PRO 91 HA PRO 91 11.284 17.941 23.427 692 HB2 PRO 91 HB2 PRO 91 10.782 20.468 22.478 693 HB3 PRO 91 HB3 PRO 91 12.400 19.934 23.033 694 HG2 PRO 91 HG2 PRO 91 11.336 20.007 20.195 695 HG3 PRO 91 HG3 PRO 91 12.896 20.656 20.803 696 HD2 PRO 91 HD2 PRO 91 12.735 18.217 19.617 697 HD3 PRO 91 HD3 PRO 91 13.799 18.477 21.034 698 H GLY 92 H GLY 92 9.044 18.545 23.914 699 HA2 GLY 92 HA2 GLY 92 6.791 18.706 23.575 700 HA3 GLY 92 HA3 GLY 92 7.120 19.015 21.865 701 H ASN 93 H ASN 93 8.256 15.988 23.332 702 HA ASN 93 HA ASN 93 5.848 14.496 22.540 703 HB2 ASN 93 HB2 ASN 93 7.368 14.317 20.608 704 HB3 ASN 93 HB3 ASN 93 8.696 13.837 21.672 705 HD21 ASN 93 HD22 ASN 93 9.069 11.667 21.451 706 HD22 ASN 93 HD21 ASN 93 7.852 10.435 21.237 707 H ASP 94 H ASP 94 5.997 12.247 23.634 708 HA ASP 94 HA ASP 94 6.655 12.824 26.395 709 HB2 ASP 94 HB2 ASP 94 4.586 11.679 25.747 710 HB3 ASP 94 HB3 ASP 94 5.515 10.328 25.100 711 H GLU 95 H GLU 95 8.237 10.942 23.864 712 HA GLU 95 HA GLU 95 10.321 10.093 25.785 713 HB2 GLU 95 HB2 GLU 95 9.914 7.846 25.460 714 HB3 GLU 95 HB3 GLU 95 8.300 8.493 25.461 715 HG2 GLU 95 HG2 GLU 95 9.905 7.713 23.004 716 HG3 GLU 95 HG3 GLU 95 8.640 6.763 23.754 717 HA PRO 96 HA PRO 96 13.088 10.732 22.388 718 HB2 PRO 96 HB2 PRO 96 15.109 8.930 22.740 719 HB3 PRO 96 HB3 PRO 96 14.812 10.262 23.897 720 HG2 PRO 96 HG2 PRO 96 13.942 7.373 24.113 721 HG3 PRO 96 HG3 PRO 96 14.680 8.409 25.373 722 HD2 PRO 96 HD2 PRO 96 11.974 7.958 25.125 723 HD3 PRO 96 HD3 PRO 96 12.641 9.473 25.815 724 H ILE 97 H ILE 97 13.586 10.056 20.282 725 HA ILE 97 HA ILE 97 11.927 7.789 19.308 726 HB ILE 97 HB ILE 97 13.518 9.825 17.704 727 HG12 ILE 97 HG12 ILE 97 11.989 11.167 18.938 728 HG13 ILE 97 HG13 ILE 97 11.350 11.001 17.317 729 HG21 ILE 97 HG21 ILE 97 11.247 7.918 16.960 730 HG22 ILE 97 HG22 ILE 97 11.949 9.150 15.904 731 HG23 ILE 97 HG23 ILE 97 12.940 7.798 16.437 732 HD11 ILE 97 HD13 ILE 97 9.700 9.319 18.145 733 HD12 ILE 97 HD11 ILE 97 10.368 9.482 19.788 734 HD13 ILE 97 HD12 ILE 97 9.602 10.865 19.021 735 H LYS 98 H LYS 98 12.797 5.916 18.692 736 HA LYS 98 HA LYS 98 15.762 5.726 18.382 737 HB2 LYS 98 HB2 LYS 98 13.747 3.487 18.848 738 HB3 LYS 98 HB3 LYS 98 15.495 3.326 18.654 739 HG2 LYS 98 HG2 LYS 98 15.665 4.928 20.719 740 HG3 LYS 98 HG3 LYS 98 13.949 4.587 20.950 741 HD2 LYS 98 HD2 LYS 98 15.140 3.098 22.364 742 HD3 LYS 98 HD3 LYS 98 14.557 2.105 21.015 743 HE2 LYS 98 HE2 LYS 98 16.789 2.218 19.942 744 HE3 LYS 98 HE3 LYS 98 17.341 3.357 21.169 745 HZ1 LYS 98 HZ3 LYS 98 18.163 1.255 21.751 746 HZ2 LYS 98 HZ1 LYS 98 16.985 1.558 22.831 747 HZ3 LYS 98 HZ2 LYS 98 16.706 0.503 21.609 748 H LEU 99 H LEU 99 12.639 5.469 16.672 749 HA LEU 99 HA LEU 99 14.208 4.660 14.264 750 HB2 LEU 99 HB2 LEU 99 13.016 2.737 15.361 751 HB3 LEU 99 HB3 LEU 99 11.496 3.552 15.059 752 HG LEU 99 HG LEU 99 12.168 1.693 13.572 753 HD11 LEU 99 HD11 LEU 99 10.363 3.107 12.856 754 HD12 LEU 99 HD12 LEU 99 11.481 4.261 12.111 755 HD13 LEU 99 HD13 LEU 99 11.336 2.641 11.452 756 HD21 LEU 99 HD23 LEU 99 13.853 3.433 11.843 757 HD22 LEU 99 HD21 LEU 99 14.598 2.574 13.201 758 HD23 LEU 99 HD22 LEU 99 13.770 1.672 11.942 759 H LEU 100 H LEU 100 13.820 5.762 12.496 760 HA LEU 100 HA LEU 100 11.511 7.659 12.454 761 HB2 LEU 100 HB2 LEU 100 14.291 8.382 11.463 762 HB3 LEU 100 HB3 LEU 100 12.902 9.418 11.661 763 HG LEU 100 HG LEU 100 13.256 8.413 14.221 764 HD11 LEU 100 HD11 LEU 100 15.592 8.623 14.853 765 HD12 LEU 100 HD12 LEU 100 15.395 7.350 13.646 766 HD13 LEU 100 HD13 LEU 100 16.042 8.933 13.159 767 HD21 LEU 100 HD23 LEU 100 13.939 10.527 14.958 768 HD22 LEU 100 HD21 LEU 100 14.593 10.967 13.377 769 HD23 LEU 100 HD22 LEU 100 12.834 10.798 13.600 770 H ILE 101 H ILE 101 10.320 7.383 10.608 771 HA ILE 101 HA ILE 101 11.743 6.403 8.185 772 HB ILE 101 HB ILE 101 8.832 5.925 8.950 773 HG12 ILE 101 HG12 ILE 101 11.395 4.380 8.728 774 HG13 ILE 101 HG13 ILE 101 10.106 4.262 9.901 775 HG21 ILE 101 HG21 ILE 101 10.134 5.496 6.239 776 HG22 ILE 101 HG22 ILE 101 8.493 4.992 6.742 777 HG23 ILE 101 HG23 ILE 101 8.875 6.689 6.622 778 HD11 ILE 101 HD13 ILE 101 8.726 3.106 8.066 779 HD12 ILE 101 HD11 ILE 101 10.242 3.108 7.099 780 HD13 ILE 101 HD12 ILE 101 10.159 2.232 8.635 781 H GLY 102 H GLY 102 12.396 8.032 7.074 782 HA2 GLY 102 HA2 GLY 102 11.062 10.634 7.014 783 HA3 GLY 102 HA3 GLY 102 12.418 10.109 6.011 784 H LEU 103 H LEU 103 9.713 11.362 5.286 785 HA LEU 103 HA LEU 103 9.360 9.701 2.887 786 HB2 LEU 103 HB2 LEU 103 7.470 9.095 4.577 787 HB3 LEU 103 HB3 LEU 103 6.959 10.759 4.433 788 HG LEU 103 HG LEU 103 6.775 8.489 2.393 789 HD11 LEU 103 HD11 LEU 103 4.797 10.547 3.527 790 HD12 LEU 103 HD12 LEU 103 4.406 9.163 2.497 791 HD13 LEU 103 HD13 LEU 103 4.998 8.897 4.124 792 HD21 LEU 103 HD23 LEU 103 7.431 10.155 0.942 793 HD22 LEU 103 HD21 LEU 103 5.692 10.237 0.865 794 HD23 LEU 103 HD22 LEU 103 6.525 11.459 1.806 795 H SER 104 H SER 104 9.241 11.102 1.112 796 HA SER 104 HA SER 104 8.524 13.927 1.499 797 HB2 SER 104 HB2 SER 104 10.240 14.650 -0.053 798 HB3 SER 104 HB3 SER 104 10.997 13.866 1.343 799 HG SER 104 HG SER 104 10.820 13.039 -1.331 800 H ALA 105 H ALA 105 7.347 14.735 -0.384 801 HA ALA 105 HA ALA 105 6.804 12.779 -2.513 802 HB1 ALA 105 HB3 ALA 105 5.152 12.186 -0.813 803 HB2 ALA 105 HB1 ALA 105 4.683 13.899 -0.649 804 HB3 ALA 105 HB2 ALA 105 4.364 13.032 -2.164 805 H ALA 106 H ALA 106 6.426 13.791 -4.427 806 HA ALA 106 HA ALA 106 6.874 16.642 -4.504 807 HB1 ALA 106 HB3 ALA 106 6.138 14.672 -6.724 808 HB2 ALA 106 HB1 ALA 106 6.733 16.330 -6.959 809 HB3 ALA 106 HB2 ALA 106 7.789 15.113 -6.226 810 H ASP 107 H ASP 107 4.026 14.609 -4.393 811 HA ASP 107 HA ASP 107 2.279 16.995 -4.656 812 HB2 ASP 107 HB2 ASP 107 2.364 15.996 -6.917 813 HB3 ASP 107 HB3 ASP 107 1.922 14.424 -6.252 814 H ALA 108 H ALA 108 0.148 16.632 -3.683 815 HA ALA 108 HA ALA 108 0.320 15.280 -1.227 816 HB1 ALA 108 HB3 ALA 108 -1.137 17.229 -1.623 817 HB2 ALA 108 HB1 ALA 108 -2.152 16.257 -2.719 818 HB3 ALA 108 HB2 ALA 108 -2.067 15.856 -0.992 819 H ASP 109 H ASP 109 -1.017 14.124 -4.347 820 HA ASP 109 HA ASP 109 -2.242 11.769 -3.083 821 HB2 ASP 109 HB2 ASP 109 -3.180 12.600 -5.122 822 HB3 ASP 109 HB3 ASP 109 -1.621 12.430 -5.965 823 H SER 110 H SER 110 0.887 12.586 -4.545 824 HA SER 110 HA SER 110 1.961 9.920 -4.464 825 HB2 SER 110 HB2 SER 110 3.521 12.524 -4.223 826 HB3 SER 110 HB3 SER 110 4.088 10.948 -4.775 827 HG SER 110 HG SER 110 3.632 12.270 -6.545 828 H HIS 111 H HIS 111 1.782 12.599 -2.060 829 HA HIS 111 HA HIS 111 3.163 11.282 0.061 830 HB2 HIS 111 HB2 HIS 111 2.729 13.564 0.421 831 HB3 HIS 111 HB3 HIS 111 1.060 13.440 -0.065 832 HD1 HIS 111 HD1 HIS 111 3.208 13.096 3.039 833 HD2 HIS 111 HD2 HIS 111 -0.768 12.667 1.727 834 HE1 HIS 111 HE1 HIS 111 1.783 12.854 5.133 835 H ILE 112 H ILE 112 -0.349 11.268 -0.791 836 HA ILE 112 HA ILE 112 -1.181 9.485 1.233 837 HB ILE 112 HB ILE 112 -2.193 9.978 -1.596 838 HG12 ILE 112 HG12 ILE 112 -2.343 11.880 0.057 839 HG13 ILE 112 HG13 ILE 112 -3.843 11.388 -0.705 840 HG21 ILE 112 HG21 ILE 112 -3.006 7.799 -1.102 841 HG22 ILE 112 HG22 ILE 112 -3.510 8.280 0.533 842 HG23 ILE 112 HG23 ILE 112 -4.339 8.937 -0.906 843 HD11 ILE 112 HD13 ILE 112 -4.078 11.945 1.675 844 HD12 ILE 112 HD11 ILE 112 -4.553 10.271 1.346 845 HD13 ILE 112 HD12 ILE 112 -2.976 10.618 2.109 846 H GLY 113 H GLY 113 -0.097 8.650 -2.149 847 HA2 GLY 113 HA2 GLY 113 -0.375 5.871 -1.851 848 HA3 GLY 113 HA3 GLY 113 0.745 6.681 -2.966 849 H ALA 114 H ALA 114 2.399 7.971 -1.029 850 HA ALA 114 HA ALA 114 4.257 5.867 -0.380 851 HB1 ALA 114 HB3 ALA 114 5.510 7.790 0.610 852 HB2 ALA 114 HB1 ALA 114 4.957 8.136 -1.030 853 HB3 ALA 114 HB2 ALA 114 4.088 8.823 0.339 854 H ILE 115 H ILE 115 2.245 8.025 1.731 855 HA ILE 115 HA ILE 115 2.819 6.967 4.180 856 HB ILE 115 HB ILE 115 0.501 8.234 2.906 857 HG12 ILE 115 HG12 ILE 115 2.394 9.712 3.492 858 HG13 ILE 115 HG13 ILE 115 0.905 10.131 4.302 859 HG21 ILE 115 HG21 ILE 115 -0.606 8.483 5.137 860 HG22 ILE 115 HG22 ILE 115 -0.693 6.918 4.330 861 HG23 ILE 115 HG23 ILE 115 0.461 7.133 5.672 862 HD11 ILE 115 HD13 ILE 115 2.821 10.350 5.805 863 HD12 ILE 115 HD11 ILE 115 1.702 9.114 6.405 864 HD13 ILE 115 HD12 ILE 115 3.211 8.638 5.595 865 H GLN 116 H GLN 116 0.309 5.968 1.742 866 HA GLN 116 HA GLN 116 -0.778 3.848 3.321 867 HB2 GLN 116 HB2 GLN 116 -0.893 4.520 0.355 868 HB3 GLN 116 HB3 GLN 116 -1.765 3.152 1.037 869 HG2 GLN 116 HG2 GLN 116 -2.076 6.003 2.039 870 HG3 GLN 116 HG3 GLN 116 -3.107 5.289 0.804 871 HE21 GLN 116 HE22 GLN 116 -3.216 6.101 3.963 872 HE22 GLN 116 HE21 GLN 116 -4.206 4.814 4.598 873 H ALA 117 H ALA 117 2.262 3.962 1.814 874 HA ALA 117 HA ALA 117 2.397 1.046 1.584 875 HB1 ALA 117 HB3 ALA 117 3.386 2.325 -0.309 876 HB2 ALA 117 HB1 ALA 117 4.474 3.149 0.818 877 HB3 ALA 117 HB2 ALA 117 4.615 1.403 0.573 878 H LEU 118 H LEU 118 3.839 3.864 3.281 879 HA LEU 118 HA LEU 118 5.496 2.106 4.843 880 HB2 LEU 118 HB2 LEU 118 6.180 4.020 6.042 881 HB3 LEU 118 HB3 LEU 118 6.202 4.259 4.276 882 HG LEU 118 HG LEU 118 4.342 5.670 4.330 883 HD11 LEU 118 HD11 LEU 118 3.635 6.655 6.628 884 HD12 LEU 118 HD12 LEU 118 2.924 5.164 6.195 885 HD13 LEU 118 HD13 LEU 118 4.278 5.129 7.318 886 HD21 LEU 118 HD23 LEU 118 5.489 7.550 5.643 887 HD22 LEU 118 HD21 LEU 118 6.520 6.340 6.375 888 HD23 LEU 118 HD22 LEU 118 6.606 6.622 4.625 889 H SER 119 H SER 119 2.341 3.355 5.324 890 HA SER 119 HA SER 119 1.972 2.669 8.039 891 HB2 SER 119 HB2 SER 119 -0.085 2.405 5.801 892 HB3 SER 119 HB3 SER 119 -0.426 2.525 7.537 893 HG SER 119 HG SER 119 0.704 4.479 5.813 894 H GLU 120 H GLU 120 2.373 0.522 5.277 895 HA GLU 120 HA GLU 120 1.142 -1.801 6.446 896 HB2 GLU 120 HB2 GLU 120 3.317 -1.633 4.338 897 HB3 GLU 120 HB3 GLU 120 2.396 -3.068 4.740 898 HG2 GLU 120 HG2 GLU 120 1.079 -0.518 3.751 899 HG3 GLU 120 HG3 GLU 120 1.651 -1.774 2.657 900 H LEU 121 H LEU 121 4.090 -0.042 6.814 901 HA LEU 121 HA LEU 121 5.456 -2.233 8.274 902 HB2 LEU 121 HB2 LEU 121 6.486 0.518 7.456 903 HB3 LEU 121 HB3 LEU 121 7.405 -0.712 8.287 904 HG LEU 121 HG LEU 121 6.336 -0.753 5.454 905 HD11 LEU 121 HD11 LEU 121 8.744 -1.029 4.916 906 HD12 LEU 121 HD12 LEU 121 8.450 0.440 5.863 907 HD13 LEU 121 HD13 LEU 121 9.136 -1.002 6.645 908 HD21 LEU 121 HD23 LEU 121 7.608 -3.090 6.981 909 HD22 LEU 121 HD21 LEU 121 5.983 -3.055 6.263 910 HD23 LEU 121 HD22 LEU 121 7.406 -3.038 5.223 911 H LEU 122 H LEU 122 5.092 1.332 8.925 912 HA LEU 122 HA LEU 122 5.695 0.747 11.667 913 HB2 LEU 122 HB2 LEU 122 4.501 3.293 10.479 914 HB3 LEU 122 HB3 LEU 122 5.118 3.121 12.120 915 HG LEU 122 HG LEU 122 6.707 3.059 9.538 916 HD11 LEU 122 HD11 LEU 122 6.787 4.781 12.058 917 HD12 LEU 122 HD12 LEU 122 7.912 4.925 10.709 918 HD13 LEU 122 HD13 LEU 122 6.191 5.263 10.462 919 HD21 LEU 122 HD23 LEU 122 8.741 2.685 10.935 920 HD22 LEU 122 HD21 LEU 122 7.705 2.335 12.330 921 HD23 LEU 122 HD22 LEU 122 7.689 1.279 10.895 922 H CYS 123 H CYS 123 2.560 0.509 10.144 923 HA CYS 123 HA CYS 123 1.274 0.745 12.806 924 HB2 CYS 123 HB2 CYS 123 -0.109 0.426 10.123 925 HB3 CYS 123 HB3 CYS 123 -0.838 0.842 11.670 926 HG CYS 123 HG CYS 123 0.443 3.094 12.027 927 H GLU 124 H GLU 124 3.077 -1.429 12.100 928 HA GLU 124 HA GLU 124 1.323 -3.652 12.880 929 HB2 GLU 124 HB2 GLU 124 3.542 -3.780 10.801 930 HB3 GLU 124 HB3 GLU 124 2.856 -5.194 11.595 931 HG2 GLU 124 HG2 GLU 124 1.331 -3.188 9.906 932 HG3 GLU 124 HG3 GLU 124 1.930 -4.750 9.341 933 H GLU 125 H GLU 125 1.874 -4.053 14.828 934 HA GLU 125 HA GLU 125 4.260 -3.039 16.071 935 HB2 GLU 125 HB2 GLU 125 3.595 -4.363 18.031 936 HB3 GLU 125 HB3 GLU 125 2.325 -3.310 17.440 937 HG2 GLU 125 HG2 GLU 125 2.351 -6.230 16.601 938 HG3 GLU 125 HG3 GLU 125 1.825 -5.781 18.213 939 H GLU 126 H GLU 126 3.542 -6.023 14.389 940 HA GLU 126 HA GLU 126 5.720 -7.578 15.350 941 HB2 GLU 126 HB2 GLU 126 4.393 -7.662 12.602 942 HB3 GLU 126 HB3 GLU 126 5.420 -8.917 13.311 943 HG2 GLU 126 HG2 GLU 126 3.744 -9.073 15.217 944 HG3 GLU 126 HG3 GLU 126 2.693 -7.998 14.286 945 H ILE 127 H ILE 127 5.390 -5.255 12.673 946 HA ILE 127 HA ILE 127 8.107 -5.497 11.728 947 HB ILE 127 HB ILE 127 5.801 -3.695 11.246 948 HG12 ILE 127 HG12 ILE 127 6.151 -4.327 8.921 949 HG13 ILE 127 HG13 ILE 127 7.606 -5.231 9.358 950 HG21 ILE 127 HG21 ILE 127 7.355 -1.950 11.252 951 HG22 ILE 127 HG22 ILE 127 8.670 -3.002 10.617 952 HG23 ILE 127 HG23 ILE 127 7.359 -2.469 9.568 953 HD11 ILE 127 HD13 ILE 127 4.783 -5.918 10.267 954 HD12 ILE 127 HD11 ILE 127 5.620 -6.650 8.886 955 HD13 ILE 127 HD12 ILE 127 6.249 -6.899 10.518 956 H LEU 128 H LEU 128 6.368 -3.261 13.973 957 HA LEU 128 HA LEU 128 8.508 -1.508 14.365 958 HB2 LEU 128 HB2 LEU 128 6.435 -2.360 16.418 959 HB3 LEU 128 HB3 LEU 128 7.571 -1.039 16.636 960 HG LEU 128 HG LEU 128 5.356 -1.158 14.555 961 HD11 LEU 128 HD11 LEU 128 4.466 0.751 15.812 962 HD12 LEU 128 HD12 LEU 128 4.633 -0.667 16.857 963 HD13 LEU 128 HD13 LEU 128 5.825 0.647 16.957 964 HD21 LEU 128 HD23 LEU 128 7.145 -0.015 13.456 965 HD22 LEU 128 HD21 LEU 128 6.063 1.231 14.077 966 HD23 LEU 128 HD22 LEU 128 7.583 0.878 14.929 967 H GLU 129 H GLU 129 7.995 -4.610 16.007 968 HA GLU 129 HA GLU 129 10.255 -4.266 17.724 969 HB2 GLU 129 HB2 GLU 129 8.398 -6.536 17.046 970 HB3 GLU 129 HB3 GLU 129 9.981 -6.940 17.730 971 HG2 GLU 129 HG2 GLU 129 9.623 -5.456 19.630 972 HG3 GLU 129 HG3 GLU 129 8.040 -4.974 19.000 973 H GLN 130 H GLN 130 9.864 -5.538 14.370 974 HA GLN 130 HA GLN 130 12.401 -6.901 14.367 975 HB2 GLN 130 HB2 GLN 130 10.475 -5.927 12.231 976 HB3 GLN 130 HB3 GLN 130 12.020 -6.694 11.833 977 HG2 GLN 130 HG2 GLN 130 11.417 -8.759 12.812 978 HG3 GLN 130 HG3 GLN 130 10.004 -8.073 13.607 979 HE21 GLN 130 HE22 GLN 130 8.078 -8.057 12.525 980 HE22 GLN 130 HE21 GLN 130 7.855 -8.575 10.855 981 H LEU 131 H LEU 131 11.198 -3.626 13.524 982 HA LEU 131 HA LEU 131 13.711 -2.613 12.528 983 HB2 LEU 131 HB2 LEU 131 11.444 -1.131 13.918 984 HB3 LEU 131 HB3 LEU 131 12.753 -0.395 13.010 985 HG LEU 131 HG LEU 131 10.798 -2.358 11.701 986 HD11 LEU 131 HD11 LEU 131 9.433 -0.456 11.060 987 HD12 LEU 131 HD12 LEU 131 9.560 -0.575 12.832 988 HD13 LEU 131 HD13 LEU 131 10.499 0.641 11.968 989 HD21 LEU 131 HD23 LEU 131 12.573 -0.155 10.636 990 HD22 LEU 131 HD21 LEU 131 12.801 -1.897 10.406 991 HD23 LEU 131 HD22 LEU 131 11.416 -1.084 9.657 992 H LEU 132 H LEU 132 12.003 -2.250 15.673 993 HA LEU 132 HA LEU 132 14.117 -0.902 16.969 994 HB2 LEU 132 HB2 LEU 132 11.849 -2.580 18.072 995 HB3 LEU 132 HB3 LEU 132 12.913 -1.638 19.105 996 HG LEU 132 HG LEU 132 11.361 -0.337 16.830 997 HD11 LEU 132 HD11 LEU 132 9.675 0.304 18.482 998 HD12 LEU 132 HD12 LEU 132 9.797 -1.461 18.363 999 HD13 LEU 132 HD13 LEU 132 10.530 -0.616 19.747 1000 HD21 LEU 132 HD23 LEU 132 12.662 0.812 19.327 1001 HD22 LEU 132 HD21 LEU 132 13.234 0.995 17.653 1002 HD23 LEU 132 HD22 LEU 132 11.699 1.719 18.139 1003 H THR 133 H THR 133 14.187 -4.211 16.079 1004 HA THR 133 HA THR 133 16.442 -4.651 17.950 1005 HB THR 133 HB THR 133 15.882 -7.029 17.950 1006 HG1 THR 133 HG1 THR 133 13.462 -6.295 16.686 1007 HG21 THR 133 HG23 THR 133 14.936 -5.581 19.745 1008 HG22 THR 133 HG21 THR 133 13.439 -5.398 18.804 1009 HG23 THR 133 HG22 THR 133 13.929 -6.994 19.390 1010 H ALA 134 H ALA 134 16.014 -3.689 14.923 1011 HA ALA 134 HA ALA 134 17.321 -5.578 13.278 1012 HB1 ALA 134 HB3 ALA 134 17.095 -2.565 13.078 1013 HB2 ALA 134 HB1 ALA 134 17.755 -3.599 11.813 1014 HB3 ALA 134 HB2 ALA 134 16.057 -3.785 12.304 1015 H SER 135 H SER 135 19.296 -6.410 13.645 1016 HA SER 135 HA SER 135 21.298 -5.078 15.203 1017 HB2 SER 135 HB2 SER 135 21.491 -7.526 13.394 1018 HB3 SER 135 HB3 SER 135 22.627 -7.075 14.678 1019 HG SER 135 HG SER 135 21.108 -8.656 15.359 1020 H SER 136 H SER 136 20.463 -4.808 11.817 1021 HA SER 136 HA SER 136 22.960 -3.348 11.292 1022 HB2 SER 136 HB2 SER 136 23.479 -4.747 9.322 1023 HB3 SER 136 HB3 SER 136 23.531 -5.693 10.813 1024 HG SER 136 HG SER 136 22.388 -6.871 9.347 1025 H GLU 137 H GLU 137 22.953 -2.264 9.255 1026 HA GLU 137 HA GLU 137 20.571 -0.964 8.392 1027 HB2 GLU 137 HB2 GLU 137 23.018 -0.289 8.160 1028 HB3 GLU 137 HB3 GLU 137 23.167 -1.504 6.877 1029 HG2 GLU 137 HG2 GLU 137 21.312 -0.238 5.664 1030 HG3 GLU 137 HG3 GLU 137 21.444 0.977 6.955 1031 H LYS 138 H LYS 138 22.242 -3.948 7.314 1032 HA LYS 138 HA LYS 138 20.610 -4.454 5.050 1033 HB2 LYS 138 HB2 LYS 138 22.019 -6.463 6.862 1034 HB3 LYS 138 HB3 LYS 138 21.395 -6.799 5.258 1035 HG2 LYS 138 HG2 LYS 138 23.702 -4.938 5.970 1036 HG3 LYS 138 HG3 LYS 138 23.815 -6.512 5.197 1037 HD2 LYS 138 HD2 LYS 138 22.589 -4.000 3.975 1038 HD3 LYS 138 HD3 LYS 138 24.157 -4.710 3.590 1039 HE2 LYS 138 HE2 LYS 138 23.023 -6.792 2.806 1040 HE3 LYS 138 HE3 LYS 138 21.451 -6.049 3.131 1041 HZ1 LYS 138 HZ3 LYS 138 21.993 -4.349 1.476 1042 HZ2 LYS 138 HZ1 LYS 138 23.442 -5.048 1.176 1043 HZ3 LYS 138 HZ2 LYS 138 22.065 -5.834 0.811 1044 H GLN 139 H GLN 139 20.173 -5.464 8.497 1045 HA GLN 139 HA GLN 139 17.801 -6.840 7.997 1046 HB2 GLN 139 HB2 GLN 139 19.417 -6.493 10.159 1047 HB3 GLN 139 HB3 GLN 139 18.110 -5.382 10.602 1048 HG2 GLN 139 HG2 GLN 139 16.488 -7.228 10.113 1049 HG3 GLN 139 HG3 GLN 139 17.881 -8.281 9.770 1050 HE21 GLN 139 HE22 GLN 139 15.630 -8.212 11.991 1051 HE22 GLN 139 HE21 GLN 139 16.543 -8.407 13.465 1052 H LEU 140 H LEU 140 18.309 -3.285 8.474 1053 HA LEU 140 HA LEU 140 15.488 -2.728 8.775 1054 HB2 LEU 140 HB2 LEU 140 17.906 -1.087 8.010 1055 HB3 LEU 140 HB3 LEU 140 16.293 -0.414 7.931 1056 HG LEU 140 HG LEU 140 17.531 -1.547 10.448 1057 HD11 LEU 140 HD11 LEU 140 17.102 1.364 9.659 1058 HD12 LEU 140 HD12 LEU 140 17.863 0.750 11.129 1059 HD13 LEU 140 HD13 LEU 140 18.650 0.514 9.570 1060 HD21 LEU 140 HD23 LEU 140 15.150 -1.707 10.661 1061 HD22 LEU 140 HD21 LEU 140 15.725 -0.370 11.648 1062 HD23 LEU 140 HD22 LEU 140 14.942 -0.029 10.090 1063 H ALA 141 H ALA 141 17.758 -2.621 5.991 1064 HA ALA 141 HA ALA 141 15.889 -2.250 3.937 1065 HB1 ALA 141 HB3 ALA 141 17.574 -3.156 2.450 1066 HB2 ALA 141 HB1 ALA 141 18.393 -2.193 3.699 1067 HB3 ALA 141 HB2 ALA 141 18.402 -3.966 3.792 1068 H ASP 142 H ASP 142 16.670 -5.333 5.606 1069 HA ASP 142 HA ASP 142 15.207 -6.974 3.804 1070 HB2 ASP 142 HB2 ASP 142 16.789 -7.913 5.411 1071 HB3 ASP 142 HB3 ASP 142 15.776 -7.389 6.758 1072 H ILE 143 H ILE 143 14.180 -5.174 6.780 1073 HA ILE 143 HA ILE 143 11.517 -6.150 6.765 1074 HB ILE 143 HB ILE 143 12.852 -3.688 7.951 1075 HG12 ILE 143 HG12 ILE 143 11.948 -6.226 9.387 1076 HG13 ILE 143 HG13 ILE 143 13.554 -6.097 8.704 1077 HG21 ILE 143 HG21 ILE 143 10.484 -3.239 7.791 1078 HG22 ILE 143 HG22 ILE 143 10.092 -4.838 8.473 1079 HG23 ILE 143 HG23 ILE 143 10.872 -3.595 9.475 1080 HD11 ILE 143 HD13 ILE 143 12.403 -4.385 10.911 1081 HD12 ILE 143 HD11 ILE 143 13.776 -5.505 10.976 1082 HD13 ILE 143 HD12 ILE 143 13.930 -3.999 10.067 1083 H ILE 144 H ILE 144 13.119 -3.375 5.176 1084 HA ILE 144 HA ILE 144 10.747 -2.311 3.948 1085 HB ILE 144 HB ILE 144 13.667 -2.303 3.053 1086 HG12 ILE 144 HG12 ILE 144 13.431 -0.937 4.968 1087 HG13 ILE 144 HG13 ILE 144 13.496 0.151 3.588 1088 HG21 ILE 144 HG21 ILE 144 12.416 -2.111 1.007 1089 HG22 ILE 144 HG22 ILE 144 11.356 -0.871 1.701 1090 HG23 ILE 144 HG23 ILE 144 13.076 -0.533 1.422 1091 HD11 ILE 144 HD13 ILE 144 11.137 -0.588 5.304 1092 HD12 ILE 144 HD11 ILE 144 11.760 1.019 4.907 1093 HD13 ILE 144 HD12 ILE 144 10.888 0.084 3.673 1094 H SER 145 H SER 145 13.077 -4.761 2.814 1095 HA SER 145 HA SER 145 11.777 -5.145 0.370 1096 HB2 SER 145 HB2 SER 145 13.484 -7.156 1.916 1097 HB3 SER 145 HB3 SER 145 13.151 -7.186 0.177 1098 HG SER 145 HG SER 145 14.601 -5.220 1.650 1099 H ARG 146 H ARG 146 11.105 -6.612 3.554 1100 HA ARG 146 HA ARG 146 9.414 -8.678 2.827 1101 HB2 ARG 146 HB2 ARG 146 10.387 -7.596 5.174 1102 HB3 ARG 146 HB3 ARG 146 8.709 -7.042 5.257 1103 HG2 ARG 146 HG2 ARG 146 7.991 -9.401 4.837 1104 HG3 ARG 146 HG3 ARG 146 9.711 -9.860 4.800 1105 HD2 ARG 146 HD2 ARG 146 9.968 -9.199 7.151 1106 HD3 ARG 146 HD3 ARG 146 8.280 -8.647 7.211 1107 HE ARG 146 HE ARG 146 7.871 -11.145 6.427 1108 HH11 ARG 146 HH11 ARG 146 9.947 -10.040 9.136 1109 HH12 ARG 146 HH12 ARG 146 10.022 -11.609 9.839 1110 HH21 ARG 146 HH21 ARG 146 7.914 -13.164 7.464 1111 HH22 ARG 146 HH22 ARG 146 8.783 -13.383 8.933 1112 H GLY 147 H GLY 147 8.806 -5.233 2.612 1113 HA2 GLY 147 HA2 GLY 147 5.868 -5.515 2.652 1114 HA3 GLY 147 HA3 GLY 147 6.821 -4.029 2.491 Start of MODEL 7 1 H MET 1 H1 MET 1 1.831 -1.284 -0.810 2 HA MET 1 HA MET 1 2.490 -1.137 -3.681 3 HB2 MET 1 HB2 MET 1 2.133 1.077 -1.838 4 HB3 MET 1 HB3 MET 1 3.863 0.883 -2.117 5 HG2 MET 1 HG2 MET 1 3.080 2.390 -3.766 6 HG3 MET 1 HG3 MET 1 3.420 0.878 -4.588 7 HE1 MET 1 HE3 MET 1 -0.700 2.881 -3.926 8 HE2 MET 1 HE1 MET 1 0.305 2.410 -2.540 9 HE3 MET 1 HE2 MET 1 0.896 3.626 -3.695 10 H ARG 2 H ARG 2 4.684 -1.339 -4.234 11 HA ARG 2 HA ARG 2 6.190 -3.055 -2.441 12 HB2 ARG 2 HB2 ARG 2 7.052 -1.544 -4.929 13 HB3 ARG 2 HB3 ARG 2 8.082 -2.638 -3.977 14 HG2 ARG 2 HG2 ARG 2 5.598 -3.363 -5.467 15 HG3 ARG 2 HG3 ARG 2 7.273 -3.813 -5.878 16 HD2 ARG 2 HD2 ARG 2 5.516 -4.698 -3.626 17 HD3 ARG 2 HD3 ARG 2 6.223 -5.731 -4.886 18 HE ARG 2 HE ARG 2 7.307 -4.908 -2.326 19 HH11 ARG 2 HH21 ARG 2 8.354 -6.146 -5.504 20 HH12 ARG 2 HH22 ARG 2 9.902 -6.629 -4.916 21 HH21 ARG 2 HH12 ARG 2 9.249 -5.336 -1.637 22 HH22 ARG 2 HH11 ARG 2 10.408 -6.269 -2.547 23 H LEU 3 H LEU 3 7.129 -2.376 -0.726 24 HA LEU 3 HA LEU 3 7.341 0.411 0.056 25 HB2 LEU 3 HB2 LEU 3 8.453 -2.184 1.141 26 HB3 LEU 3 HB3 LEU 3 9.145 -0.673 1.694 27 HG LEU 3 HG LEU 3 7.380 -1.628 3.173 28 HD11 LEU 3 HD11 LEU 3 8.063 0.751 3.249 29 HD12 LEU 3 HD12 LEU 3 6.780 1.162 2.086 30 HD13 LEU 3 HD13 LEU 3 6.372 0.507 3.683 31 HD21 LEU 3 HD23 LEU 3 5.765 -2.377 1.394 32 HD22 LEU 3 HD21 LEU 3 5.037 -1.391 2.664 33 HD23 LEU 3 HD22 LEU 3 5.380 -0.682 1.081 34 H SER 4 H SER 4 9.655 -1.984 -1.279 35 HA SER 4 HA SER 4 11.956 -0.419 -1.187 36 HB2 SER 4 HB2 SER 4 12.622 -1.995 -3.131 37 HB3 SER 4 HB3 SER 4 12.177 -2.718 -1.576 38 HG SER 4 HG SER 4 11.168 -3.725 -3.402 39 H ASP 5 H ASP 5 9.162 0.053 -3.324 40 HA ASP 5 HA ASP 5 10.556 1.352 -5.449 41 HB2 ASP 5 HB2 ASP 5 8.198 0.589 -5.587 42 HB3 ASP 5 HB3 ASP 5 7.739 1.850 -4.433 43 H TYR 6 H TYR 6 9.725 2.391 -2.192 44 HA TYR 6 HA TYR 6 10.058 5.240 -2.878 45 HB2 TYR 6 HB2 TYR 6 9.107 3.867 -0.335 46 HB3 TYR 6 HB3 TYR 6 9.238 5.603 -0.548 47 HD1 TYR 6 HD2 TYR 6 7.735 6.885 -1.919 48 HD2 TYR 6 HD1 TYR 6 7.239 2.599 -1.506 49 HE1 TYR 6 HE2 TYR 6 5.528 7.025 -3.032 50 HE2 TYR 6 HE1 TYR 6 5.032 2.763 -2.556 51 HH TYR 6 HH TYR 6 3.654 5.858 -3.762 52 H PHE 7 H PHE 7 12.011 2.706 -1.405 53 HA PHE 7 HA PHE 7 13.686 4.737 -0.003 54 HB2 PHE 7 HB2 PHE 7 13.590 1.723 0.294 55 HB3 PHE 7 HB3 PHE 7 14.703 2.782 1.137 56 HD1 PHE 7 HD1 PHE 7 11.062 2.197 0.611 57 HD2 PHE 7 HD2 PHE 7 14.074 3.495 3.408 58 HE1 PHE 7 HE1 PHE 7 9.312 2.596 2.291 59 HE2 PHE 7 HE2 PHE 7 12.283 4.028 5.030 60 HZ PHE 7 HZ PHE 7 9.917 3.571 4.499 61 HA PRO 8 HA PRO 8 15.769 4.210 -3.977 62 HB2 PRO 8 HB2 PRO 8 17.733 6.172 -3.738 63 HB3 PRO 8 HB3 PRO 8 16.043 6.424 -4.252 64 HG2 PRO 8 HG2 PRO 8 17.208 6.753 -1.473 65 HG3 PRO 8 HG3 PRO 8 16.120 7.872 -2.359 66 HD2 PRO 8 HD2 PRO 8 15.107 6.183 -0.543 67 HD3 PRO 8 HD3 PRO 8 14.268 6.416 -2.100 68 H GLU 9 H GLU 9 18.167 4.795 -1.375 69 HA GLU 9 HA GLU 9 19.552 2.307 -1.870 70 HB2 GLU 9 HB2 GLU 9 20.225 3.677 -3.885 71 HB3 GLU 9 HB3 GLU 9 20.842 4.903 -2.792 72 HG2 GLU 9 HG2 GLU 9 22.726 3.635 -3.499 73 HG3 GLU 9 HG3 GLU 9 22.411 3.124 -1.844 74 H SER 10 H SER 10 20.987 5.406 -0.910 75 HA SER 10 HA SER 10 22.031 4.385 1.506 76 HB2 SER 10 HB2 SER 10 21.500 7.323 1.034 77 HB3 SER 10 HB3 SER 10 22.908 6.560 1.782 78 HG SER 10 HG SER 10 23.551 5.866 -0.279 79 H SER 11 H SER 11 18.948 4.345 1.057 80 HA SER 11 HA SER 11 17.816 6.319 2.870 81 HB2 SER 11 HB2 SER 11 15.698 4.981 1.982 82 HB3 SER 11 HB3 SER 11 16.600 6.105 0.964 83 HG SER 11 HG SER 11 16.824 3.266 0.983 84 H ILE 12 H ILE 12 19.464 3.682 3.791 85 HA ILE 12 HA ILE 12 17.690 3.271 6.096 86 HB ILE 12 HB ILE 12 19.046 1.190 4.348 87 HG12 ILE 12 HG12 ILE 12 16.509 0.235 5.202 88 HG13 ILE 12 HG13 ILE 12 16.224 1.928 4.832 89 HG21 ILE 12 HG21 ILE 12 18.069 0.902 7.196 90 HG22 ILE 12 HG22 ILE 12 18.467 -0.452 6.094 91 HG23 ILE 12 HG23 ILE 12 19.722 0.692 6.562 92 HD11 ILE 12 HD13 ILE 12 17.519 -0.077 3.018 93 HD12 ILE 12 HD11 ILE 12 15.847 0.575 2.893 94 HD13 ILE 12 HD12 ILE 12 17.256 1.644 2.639 95 H SER 13 H SER 13 18.894 3.787 7.905 96 HA SER 13 HA SER 13 21.785 3.233 7.848 97 HB2 SER 13 HB2 SER 13 20.574 5.897 8.745 98 HB3 SER 13 HB3 SER 13 22.286 5.456 8.812 99 HG SER 13 HG SER 13 21.772 6.757 6.993 100 H VAL 14 H VAL 14 22.720 3.002 9.922 101 HA VAL 14 HA VAL 14 20.895 2.973 12.286 102 HB VAL 14 HB VAL 14 23.140 1.052 11.550 103 HG11 VAL 14 HG11 VAL 14 21.586 1.251 14.174 104 HG12 VAL 14 HG12 VAL 14 22.637 -0.105 13.712 105 HG13 VAL 14 HG13 VAL 14 23.334 1.495 13.954 106 HG21 VAL 14 HG23 VAL 14 20.861 0.543 10.570 107 HG22 VAL 14 HG21 VAL 14 21.422 -0.688 11.707 108 HG23 VAL 14 HG22 VAL 14 20.220 0.511 12.220 109 H ILE 15 H ILE 15 21.769 3.966 14.077 110 HA ILE 15 HA ILE 15 24.402 5.336 13.842 111 HB ILE 15 HB ILE 15 21.593 6.464 14.186 112 HG12 ILE 15 HG12 ILE 15 23.804 6.883 12.151 113 HG13 ILE 15 HG13 ILE 15 22.151 6.311 11.888 114 HG21 ILE 15 HG21 ILE 15 24.173 7.966 14.731 115 HG22 ILE 15 HG22 ILE 15 22.523 8.653 14.722 116 HG23 ILE 15 HG23 ILE 15 22.917 7.466 15.902 117 HD11 ILE 15 HD13 ILE 15 21.337 8.607 12.601 118 HD12 ILE 15 HD11 ILE 15 23.035 9.131 12.612 119 HD13 ILE 15 HD12 ILE 15 22.291 8.575 11.094 120 H HIS 16 H HIS 16 25.361 5.729 15.839 121 HA HIS 16 HA HIS 16 24.579 4.111 18.068 122 HB2 HIS 16 HB2 HIS 16 26.443 6.517 17.949 123 HB3 HIS 16 HB3 HIS 16 26.354 5.342 19.262 124 HD1 HIS 16 HD1 HIS 16 26.501 2.611 17.658 125 HD2 HIS 16 HD2 HIS 16 28.759 6.088 16.850 126 HE1 HIS 16 HE1 HIS 16 28.574 1.851 16.389 127 H SER 17 H SER 17 24.252 7.660 17.389 128 HA SER 17 HA SER 17 21.946 7.945 19.069 129 HB2 SER 17 HB2 SER 17 24.217 9.743 19.911 130 HB3 SER 17 HB3 SER 17 22.753 9.295 20.783 131 HG SER 17 HG SER 17 25.162 7.843 20.417 132 H ALA 18 H ALA 18 21.019 10.162 18.503 133 HA ALA 18 HA ALA 18 22.235 11.210 16.005 134 HB1 ALA 18 HB3 ALA 18 19.793 12.346 17.417 135 HB2 ALA 18 HB1 ALA 18 20.363 12.651 15.784 136 HB3 ALA 18 HB2 ALA 18 19.713 11.058 16.193 137 H LYS 19 H LYS 19 23.132 13.315 15.943 138 HA LYS 19 HA LYS 19 24.663 14.147 18.160 139 HB2 LYS 19 HB2 LYS 19 24.838 14.607 15.609 140 HB3 LYS 19 HB3 LYS 19 23.741 15.940 15.886 141 HG2 LYS 19 HG2 LYS 19 26.431 15.602 17.267 142 HG3 LYS 19 HG3 LYS 19 26.201 16.458 15.748 143 HD2 LYS 19 HD2 LYS 19 25.125 17.303 18.447 144 HD3 LYS 19 HD3 LYS 19 26.436 18.037 17.552 145 HE2 LYS 19 HE2 LYS 19 23.522 17.953 16.674 146 HE3 LYS 19 HE3 LYS 19 24.356 19.340 17.387 147 HZ1 LYS 19 HZ3 LYS 19 24.349 19.671 15.080 148 HZ2 LYS 19 HZ1 LYS 19 25.877 19.202 15.393 149 HZ3 LYS 19 HZ2 LYS 19 24.790 18.150 14.712 150 H ASP 20 H ASP 20 21.446 15.102 17.054 151 HA ASP 20 HA ASP 20 20.582 16.119 19.611 152 HB2 ASP 20 HB2 ASP 20 21.860 18.117 18.442 153 HB3 ASP 20 HB3 ASP 20 20.591 17.950 17.205 154 H TRP 21 H TRP 21 18.302 17.134 19.133 155 HA TRP 21 HA TRP 21 16.802 15.130 17.679 156 HB2 TRP 21 HB2 TRP 21 14.931 16.873 18.369 157 HB3 TRP 21 HB3 TRP 21 15.617 15.739 19.515 158 HD1 TRP 21 HD1 TRP 21 16.160 19.382 18.431 159 HE1 TRP 21 HE1 TRP 21 16.739 20.826 20.446 160 HE3 TRP 21 HE3 TRP 21 16.675 15.681 21.890 161 HZ2 TRP 21 HZ2 TRP 21 17.344 20.419 23.260 162 HZ3 TRP 21 HZ3 TRP 21 17.353 16.217 24.211 163 HH2 TRP 21 HH2 TRP 21 17.674 18.582 24.914 164 H GLN 22 H GLN 22 17.873 18.521 17.030 165 HA GLN 22 HA GLN 22 16.390 18.783 14.546 166 HB2 GLN 22 HB2 GLN 22 17.733 20.584 14.049 167 HB3 GLN 22 HB3 GLN 22 17.506 20.601 15.789 168 HG2 GLN 22 HG2 GLN 22 19.866 19.444 15.850 169 HG3 GLN 22 HG3 GLN 22 20.015 20.031 14.199 170 HE21 GLN 22 HE22 GLN 22 19.467 20.968 17.597 171 HE22 GLN 22 HE21 GLN 22 20.023 22.636 17.439 172 H GLU 23 H GLU 23 19.540 17.286 15.411 173 HA GLU 23 HA GLU 23 20.285 16.617 12.736 174 HB2 GLU 23 HB2 GLU 23 21.668 16.627 15.020 175 HB3 GLU 23 HB3 GLU 23 21.096 14.953 15.114 176 HG2 GLU 23 HG2 GLU 23 23.148 14.728 13.991 177 HG3 GLU 23 HG3 GLU 23 22.010 14.716 12.673 178 H ALA 24 H ALA 24 18.370 14.948 15.210 179 HA ALA 24 HA ALA 24 18.306 12.401 13.974 180 HB1 ALA 24 HB3 ALA 24 17.702 13.020 16.338 181 HB2 ALA 24 HB1 ALA 24 16.177 13.694 15.733 182 HB3 ALA 24 HB2 ALA 24 16.509 11.959 15.539 183 H ILE 25 H ILE 25 16.344 15.335 13.424 184 HA ILE 25 HA ILE 25 14.591 14.132 11.443 185 HB ILE 25 HB ILE 25 15.496 17.023 11.617 186 HG12 ILE 25 HG12 ILE 25 14.058 15.678 13.660 187 HG13 ILE 25 HG13 ILE 25 14.476 17.379 13.519 188 HG21 ILE 25 HG21 ILE 25 12.957 15.831 10.436 189 HG22 ILE 25 HG22 ILE 25 13.487 17.537 10.402 190 HG23 ILE 25 HG23 ILE 25 14.374 16.331 9.514 191 HD11 ILE 25 HD13 ILE 25 12.122 17.096 13.955 192 HD12 ILE 25 HD11 ILE 25 12.330 17.766 12.331 193 HD13 ILE 25 HD12 ILE 25 11.937 16.036 12.546 194 H ASP 26 H ASP 26 17.672 15.984 11.384 195 HA ASP 26 HA ASP 26 17.977 16.199 8.615 196 HB2 ASP 26 HB2 ASP 26 19.371 17.175 10.608 197 HB3 ASP 26 HB3 ASP 26 20.365 15.733 10.419 198 H PHE 27 H PHE 27 19.163 13.556 10.758 199 HA PHE 27 HA PHE 27 20.100 11.917 8.622 200 HB2 PHE 27 HB2 PHE 27 19.417 11.418 11.532 201 HB3 PHE 27 HB3 PHE 27 19.855 10.099 10.459 202 HD1 PHE 27 HD2 PHE 27 22.002 10.610 8.899 203 HD2 PHE 27 HD1 PHE 27 21.298 12.298 12.825 204 HE1 PHE 27 HE2 PHE 27 24.435 10.960 9.196 205 HE2 PHE 27 HE1 PHE 27 23.729 12.590 13.114 206 HZ PHE 27 HZ PHE 27 25.305 11.943 11.310 207 H SER 28 H SER 28 16.805 12.312 10.000 208 HA SER 28 HA SER 28 15.709 9.964 8.755 209 HB2 SER 28 HB2 SER 28 14.261 12.584 9.431 210 HB3 SER 28 HB3 SER 28 13.515 11.053 9.045 211 HG SER 28 HG SER 28 15.255 11.561 11.256 212 H MET 29 H MET 29 16.720 13.083 7.457 213 HA MET 29 HA MET 29 15.248 12.506 4.924 214 HB2 MET 29 HB2 MET 29 16.315 15.110 5.976 215 HB3 MET 29 HB3 MET 29 15.142 14.845 4.670 216 HG2 MET 29 HG2 MET 29 14.335 14.129 7.464 217 HG3 MET 29 HG3 MET 29 14.445 15.810 6.984 218 HE1 MET 29 HE3 MET 29 13.140 12.456 5.486 219 HE2 MET 29 HE1 MET 29 12.437 12.745 7.105 220 HE3 MET 29 HE2 MET 29 11.381 12.766 5.668 221 H VAL 30 H VAL 30 18.553 12.993 6.128 222 HA VAL 30 HA VAL 30 19.618 14.377 4.045 223 HB VAL 30 HB VAL 30 20.770 13.881 6.147 224 HG11 VAL 30 HG11 VAL 30 21.435 11.130 5.010 225 HG12 VAL 30 HG12 VAL 30 21.988 11.819 6.549 226 HG13 VAL 30 HG13 VAL 30 20.276 11.430 6.320 227 HG21 VAL 30 HG23 VAL 30 22.456 13.076 3.744 228 HG22 VAL 30 HG21 VAL 30 22.046 14.739 4.212 229 HG23 VAL 30 HG22 VAL 30 23.037 13.739 5.288 230 H SER 31 H SER 31 19.107 10.797 3.983 231 HA SER 31 HA SER 31 20.576 10.414 1.611 232 HB2 SER 31 HB2 SER 31 18.168 8.830 2.579 233 HB3 SER 31 HB3 SER 31 19.495 8.251 1.556 234 HG SER 31 HG SER 31 20.102 7.635 3.547 235 H LEU 32 H LEU 32 17.284 11.603 2.141 236 HA LEU 32 HA LEU 32 16.482 11.436 -0.669 237 HB2 LEU 32 HB2 LEU 32 15.318 12.825 1.795 238 HB3 LEU 32 HB3 LEU 32 14.583 12.942 0.224 239 HG LEU 32 HG LEU 32 15.097 10.287 1.614 240 HD11 LEU 32 HD11 LEU 32 12.708 10.304 2.228 241 HD12 LEU 32 HD12 LEU 32 13.598 11.623 3.001 242 HD13 LEU 32 HD13 LEU 32 12.559 11.957 1.600 243 HD21 LEU 32 HD23 LEU 32 14.783 10.156 -0.869 244 HD22 LEU 32 HD21 LEU 32 13.511 9.370 0.033 245 HD23 LEU 32 HD22 LEU 32 13.210 10.969 -0.678 246 H LEU 33 H LEU 33 17.788 13.875 1.626 247 HA LEU 33 HA LEU 33 17.676 16.095 -0.069 248 HB2 LEU 33 HB2 LEU 33 18.189 16.147 2.345 249 HB3 LEU 33 HB3 LEU 33 19.749 15.399 2.031 250 HG LEU 33 HG LEU 33 20.487 17.379 0.754 251 HD11 LEU 33 HD11 LEU 33 17.809 18.589 1.548 252 HD12 LEU 33 HD12 LEU 33 19.176 19.446 0.798 253 HD13 LEU 33 HD13 LEU 33 18.339 18.197 -0.101 254 HD21 LEU 33 HD23 LEU 33 19.444 18.068 3.515 255 HD22 LEU 33 HD21 LEU 33 20.888 17.094 3.183 256 HD23 LEU 33 HD22 LEU 33 20.843 18.773 2.664 257 H ASP 34 H ASP 34 20.267 13.649 0.350 258 HA ASP 34 HA ASP 34 22.182 14.786 -1.361 259 HB2 ASP 34 HB2 ASP 34 22.595 12.963 0.298 260 HB3 ASP 34 HB3 ASP 34 21.666 11.848 -0.721 261 H LYS 35 H LYS 35 19.636 12.383 -2.074 262 HA LYS 35 HA LYS 35 20.254 12.290 -4.935 263 HB2 LYS 35 HB2 LYS 35 18.456 10.918 -2.942 264 HB3 LYS 35 HB3 LYS 35 17.925 10.973 -4.625 265 HG2 LYS 35 HG2 LYS 35 19.078 8.942 -4.062 266 HG3 LYS 35 HG3 LYS 35 19.753 9.846 -5.426 267 HD2 LYS 35 HD2 LYS 35 21.645 9.099 -4.428 268 HD3 LYS 35 HD3 LYS 35 21.512 10.699 -3.698 269 HE2 LYS 35 HE2 LYS 35 20.551 9.716 -1.658 270 HE3 LYS 35 HE3 LYS 35 20.515 8.116 -2.419 271 HZ1 LYS 35 HZ3 LYS 35 22.491 8.286 -1.054 272 HZ2 LYS 35 HZ1 LYS 35 22.943 8.227 -2.601 273 HZ3 LYS 35 HZ2 LYS 35 22.976 9.673 -1.838 274 H ASN 36 H ASN 36 19.201 14.791 -3.323 275 HA ASN 36 HA ASN 36 17.771 16.376 -3.461 276 HB2 ASN 36 HB2 ASN 36 17.499 17.559 -5.614 277 HB3 ASN 36 HB3 ASN 36 19.139 17.175 -5.140 278 HD21 ASN 36 HD22 ASN 36 20.233 15.472 -6.163 279 HD22 ASN 36 HD21 ASN 36 19.836 14.965 -7.799 280 H TYR 37 H TYR 37 16.300 14.072 -3.012 281 HA TYR 37 HA TYR 37 13.773 14.229 -4.515 282 HB2 TYR 37 HB2 TYR 37 14.662 12.927 -1.920 283 HB3 TYR 37 HB3 TYR 37 12.972 13.017 -2.352 284 HD1 TYR 37 HD2 TYR 37 16.221 11.404 -3.195 285 HD2 TYR 37 HD1 TYR 37 11.978 11.558 -3.955 286 HE1 TYR 37 HE2 TYR 37 16.382 9.327 -4.534 287 HE2 TYR 37 HE1 TYR 37 12.162 9.528 -5.368 288 HH TYR 37 HH TYR 37 15.261 7.826 -5.924 289 H ILE 38 H ILE 38 15.392 16.075 -2.087 290 HA ILE 38 HA ILE 38 13.067 17.824 -1.678 291 HB ILE 38 HB ILE 38 13.527 17.852 0.764 292 HG12 ILE 38 HG12 ILE 38 15.355 15.472 0.215 293 HG13 ILE 38 HG13 ILE 38 15.872 17.092 0.711 294 HG21 ILE 38 HG21 ILE 38 11.718 16.405 -0.146 295 HG22 ILE 38 HG22 ILE 38 12.845 15.032 -0.154 296 HG23 ILE 38 HG23 ILE 38 12.374 15.803 1.364 297 HD11 ILE 38 HD13 ILE 38 14.306 15.111 2.380 298 HD12 ILE 38 HD11 ILE 38 15.986 15.633 2.561 299 HD13 ILE 38 HD12 ILE 38 14.667 16.795 2.854 300 H SER 39 H SER 39 13.825 19.867 -0.610 301 HA SER 39 HA SER 39 16.675 20.578 -1.162 302 HB2 SER 39 HB2 SER 39 14.236 22.347 -0.678 303 HB3 SER 39 HB3 SER 39 15.864 22.894 -1.118 304 HG SER 39 HG SER 39 14.485 22.805 -2.927 305 H GLU 40 H GLU 40 17.680 22.001 0.582 306 HA GLU 40 HA GLU 40 17.625 20.693 3.063 307 HB2 GLU 40 HB2 GLU 40 18.616 23.492 2.394 308 HB3 GLU 40 HB3 GLU 40 19.002 22.592 3.867 309 HG2 GLU 40 HG2 GLU 40 20.050 20.797 2.476 310 HG3 GLU 40 HG3 GLU 40 19.732 21.739 1.027 311 H ASN 41 H ASN 41 15.881 23.627 2.089 312 HA ASN 41 HA ASN 41 14.854 24.343 4.634 313 HB2 ASN 41 HB2 ASN 41 13.028 25.480 3.289 314 HB3 ASN 41 HB3 ASN 41 14.680 25.952 2.933 315 HD21 ASN 41 HD22 ASN 41 11.806 24.243 1.581 316 HD22 ASN 41 HD21 ASN 41 12.448 24.263 -0.041 317 H TYR 42 H TYR 42 13.927 21.627 2.574 318 HA TYR 42 HA TYR 42 11.274 21.259 3.635 319 HB2 TYR 42 HB2 TYR 42 12.225 20.157 1.572 320 HB3 TYR 42 HB3 TYR 42 13.257 19.188 2.618 321 HD1 TYR 42 HD1 TYR 42 9.701 19.942 1.811 322 HD2 TYR 42 HD2 TYR 42 12.444 17.196 3.685 323 HE1 TYR 42 HE1 TYR 42 7.892 18.277 1.983 324 HE2 TYR 42 HE2 TYR 42 10.638 15.504 3.842 325 HH TYR 42 HH TYR 42 7.287 16.236 2.839 326 H ILE 43 H ILE 43 14.538 20.030 4.555 327 HA ILE 43 HA ILE 43 13.660 18.441 6.749 328 HB ILE 43 HB ILE 43 16.353 19.836 6.316 329 HG12 ILE 43 HG12 ILE 43 16.859 17.214 5.844 330 HG13 ILE 43 HG13 ILE 43 15.189 17.279 5.251 331 HG21 ILE 43 HG21 ILE 43 15.712 17.401 8.040 332 HG22 ILE 43 HG22 ILE 43 17.263 18.253 7.889 333 HG23 ILE 43 HG23 ILE 43 15.888 19.039 8.681 334 HD11 ILE 43 HD13 ILE 43 15.870 19.061 3.682 335 HD12 ILE 43 HD11 ILE 43 17.510 19.034 4.398 336 HD13 ILE 43 HD12 ILE 43 16.906 17.627 3.515 337 H GLN 44 H GLN 44 14.791 21.885 6.561 338 HA GLN 44 HA GLN 44 14.537 22.204 9.363 339 HB2 GLN 44 HB2 GLN 44 15.886 23.641 7.650 340 HB3 GLN 44 HB3 GLN 44 14.392 24.567 7.495 341 HG2 GLN 44 HG2 GLN 44 15.846 25.616 9.159 342 HG3 GLN 44 HG3 GLN 44 14.422 24.982 9.969 343 HE21 GLN 44 HE22 GLN 44 15.009 24.102 11.985 344 HE22 GLN 44 HE21 GLN 44 16.407 23.096 12.256 345 H ALA 45 H ALA 45 12.087 22.527 6.829 346 HA ALA 45 HA ALA 45 10.121 23.858 8.354 347 HB1 ALA 45 HB3 ALA 45 8.493 22.826 6.853 348 HB2 ALA 45 HB1 ALA 45 9.916 23.345 5.922 349 HB3 ALA 45 HB2 ALA 45 9.671 21.623 6.323 350 H ILE 46 H ILE 46 11.186 20.421 8.460 351 HA ILE 46 HA ILE 46 8.997 19.658 10.236 352 HB ILE 46 HB ILE 46 11.598 18.196 9.767 353 HG12 ILE 46 HG12 ILE 46 9.050 17.722 8.215 354 HG13 ILE 46 HG13 ILE 46 10.423 18.610 7.570 355 HG21 ILE 46 HG21 ILE 46 10.349 16.255 10.586 356 HG22 ILE 46 HG22 ILE 46 10.122 17.561 11.736 357 HG23 ILE 46 HG23 ILE 46 8.831 17.179 10.585 358 HD11 ILE 46 HD13 ILE 46 11.886 16.664 7.815 359 HD12 ILE 46 HD11 ILE 46 10.536 15.692 8.417 360 HD13 ILE 46 HD12 ILE 46 10.490 16.323 6.771 361 H LYS 47 H LYS 47 12.543 20.315 10.505 362 HA LYS 47 HA LYS 47 12.761 19.760 13.241 363 HB2 LYS 47 HB2 LYS 47 14.212 21.773 11.496 364 HB3 LYS 47 HB3 LYS 47 14.732 21.420 13.142 365 HG2 LYS 47 HG2 LYS 47 15.456 19.218 12.558 366 HG3 LYS 47 HG3 LYS 47 14.683 19.307 10.960 367 HD2 LYS 47 HD2 LYS 47 16.149 21.039 10.237 368 HD3 LYS 47 HD3 LYS 47 16.874 21.221 11.846 369 HE2 LYS 47 HE2 LYS 47 18.072 19.177 11.658 370 HE3 LYS 47 HE3 LYS 47 17.161 18.669 10.243 371 HZ1 LYS 47 HZ3 LYS 47 18.194 20.672 9.105 372 HZ2 LYS 47 HZ1 LYS 47 19.166 20.851 10.398 373 HZ3 LYS 47 HZ2 LYS 47 19.249 19.488 9.480 374 H ASP 48 H ASP 48 11.956 22.889 11.642 375 HA ASP 48 HA ASP 48 12.179 24.499 13.932 376 HB2 ASP 48 HB2 ASP 48 12.112 25.389 11.656 377 HB3 ASP 48 HB3 ASP 48 10.439 24.853 11.460 378 H SER 49 H SER 49 9.152 23.052 12.522 379 HA SER 49 HA SER 49 7.491 23.966 14.642 380 HB2 SER 49 HB2 SER 49 7.126 21.561 12.819 381 HB3 SER 49 HB3 SER 49 5.852 22.398 13.725 382 HG SER 49 HG SER 49 5.989 23.084 11.527 383 H THR 50 H THR 50 9.320 20.884 14.190 384 HA THR 50 HA THR 50 8.433 19.566 16.480 385 HB THR 50 HB THR 50 11.157 19.482 15.149 386 HG1 THR 50 HG1 THR 50 9.665 18.914 13.704 387 HG21 THR 50 HG23 THR 50 11.427 18.397 17.260 388 HG22 THR 50 HG21 THR 50 9.834 17.628 17.162 389 HG23 THR 50 HG22 THR 50 11.140 17.110 16.078 390 H ILE 51 H ILE 51 11.137 21.943 16.197 391 HA ILE 51 HA ILE 51 11.825 21.763 18.978 392 HB ILE 51 HB ILE 51 12.451 23.739 16.757 393 HG12 ILE 51 HG12 ILE 51 14.286 21.747 18.178 394 HG13 ILE 51 HG13 ILE 51 13.359 21.303 16.757 395 HG21 ILE 51 HG21 ILE 51 14.239 24.681 18.212 396 HG22 ILE 51 HG22 ILE 51 12.642 25.004 18.859 397 HG23 ILE 51 HG23 ILE 51 13.634 23.713 19.573 398 HD11 ILE 51 HD13 ILE 51 14.464 23.155 15.471 399 HD12 ILE 51 HD11 ILE 51 15.534 23.420 16.870 400 HD13 ILE 51 HD12 ILE 51 15.550 21.868 16.020 401 H ASN 52 H ASN 52 9.685 23.986 17.117 402 HA ASN 52 HA ASN 52 9.429 25.820 19.336 403 HB2 ASN 52 HB2 ASN 52 8.103 25.551 16.621 404 HB3 ASN 52 HB3 ASN 52 7.444 26.652 17.816 405 HD21 ASN 52 HD22 ASN 52 10.363 25.978 15.903 406 HD22 ASN 52 HD21 ASN 52 11.034 27.588 16.044 407 H ASN 53 H ASN 53 7.435 23.119 18.171 408 HA ASN 53 HA ASN 53 5.494 23.671 20.385 409 HB2 ASN 53 HB2 ASN 53 3.846 24.044 18.961 410 HB3 ASN 53 HB3 ASN 53 5.049 24.181 17.687 411 HD21 ASN 53 HD22 ASN 53 5.654 22.009 16.575 412 HD22 ASN 53 HD21 ASN 53 4.370 20.858 16.362 413 H GLY 54 H GLY 54 7.206 21.237 18.542 414 HA2 GLY 54 HA2 GLY 54 7.674 19.224 19.958 415 HA3 GLY 54 HA3 GLY 54 5.922 19.047 20.134 416 HA PRO 55 HA PRO 55 7.654 17.146 16.086 417 HB2 PRO 55 HB2 PRO 55 7.450 14.463 16.645 418 HB3 PRO 55 HB3 PRO 55 8.912 15.423 17.005 419 HG2 PRO 55 HG2 PRO 55 6.648 14.704 18.883 420 HG3 PRO 55 HG3 PRO 55 8.410 14.564 19.158 421 HD2 PRO 55 HD2 PRO 55 6.954 16.688 20.084 422 HD3 PRO 55 HD3 PRO 55 8.617 16.928 19.476 423 H TYR 56 H TYR 56 6.290 16.203 14.483 424 HA TYR 56 HA TYR 56 3.431 15.937 15.299 425 HB2 TYR 56 HB2 TYR 56 2.721 17.434 13.611 426 HB3 TYR 56 HB3 TYR 56 3.869 18.227 14.653 427 HD1 TYR 56 HD2 TYR 56 6.257 18.663 13.809 428 HD2 TYR 56 HD1 TYR 56 3.038 17.350 11.247 429 HE1 TYR 56 HE2 TYR 56 7.434 19.602 11.854 430 HE2 TYR 56 HE1 TYR 56 4.187 18.342 9.292 431 HH TYR 56 HH TYR 56 7.225 20.207 9.573 432 H TYR 57 H TYR 57 5.667 14.054 14.273 433 HA TYR 57 HA TYR 57 3.757 12.416 12.763 434 HB2 TYR 57 HB2 TYR 57 6.505 13.114 11.734 435 HB3 TYR 57 HB3 TYR 57 5.727 11.568 11.401 436 HD1 TYR 57 HD1 TYR 57 3.528 11.420 10.257 437 HD2 TYR 57 HD2 TYR 57 5.788 15.091 10.464 438 HE1 TYR 57 HE1 TYR 57 2.099 12.386 8.481 439 HE2 TYR 57 HE2 TYR 57 4.397 16.048 8.658 440 HH TYR 57 HH TYR 57 1.605 14.308 7.232 441 H ILE 58 H ILE 58 3.497 11.484 14.851 442 HA ILE 58 HA ILE 58 5.715 9.704 15.730 443 HB ILE 58 HB ILE 58 3.760 11.207 17.514 444 HG12 ILE 58 HG12 ILE 58 5.524 12.734 16.787 445 HG13 ILE 58 HG13 ILE 58 5.645 12.361 18.490 446 HG21 ILE 58 HG21 ILE 58 4.138 9.030 18.471 447 HG22 ILE 58 HG22 ILE 58 5.883 9.126 18.199 448 HG23 ILE 58 HG23 ILE 58 5.098 10.186 19.393 449 HD11 ILE 58 HD13 ILE 58 7.414 11.262 16.276 450 HD12 ILE 58 HD11 ILE 58 7.878 12.390 17.555 451 HD13 ILE 58 HD12 ILE 58 7.497 10.722 17.962 452 H LEU 59 H LEU 59 5.022 7.609 16.012 453 HA LEU 59 HA LEU 59 2.170 7.061 15.266 454 HB2 LEU 59 HB2 LEU 59 4.755 5.689 14.408 455 HB3 LEU 59 HB3 LEU 59 3.171 4.978 14.200 456 HG LEU 59 HG LEU 59 3.801 5.861 12.136 457 HD11 LEU 59 HD11 LEU 59 1.424 6.157 12.754 458 HD12 LEU 59 HD12 LEU 59 1.779 7.842 13.210 459 HD13 LEU 59 HD13 LEU 59 1.996 7.302 11.535 460 HD21 LEU 59 HD23 LEU 59 5.510 7.492 12.800 461 HD22 LEU 59 HD21 LEU 59 4.351 8.101 11.612 462 HD23 LEU 59 HD22 LEU 59 4.219 8.634 13.270 463 H ALA 60 H ALA 60 4.876 6.180 17.360 464 HA ALA 60 HA ALA 60 3.126 4.785 19.178 465 HB1 ALA 60 HB3 ALA 60 5.347 3.249 17.715 466 HB2 ALA 60 HB1 ALA 60 4.451 2.643 19.110 467 HB3 ALA 60 HB2 ALA 60 3.607 2.923 17.582 468 HA PRO 61 HA PRO 61 6.470 6.321 21.810 469 HB2 PRO 61 HB2 PRO 61 6.806 4.243 23.639 470 HB3 PRO 61 HB3 PRO 61 5.555 5.521 23.736 471 HG2 PRO 61 HG2 PRO 61 5.301 2.712 22.644 472 HG3 PRO 61 HG3 PRO 61 4.163 3.603 23.705 473 HD2 PRO 61 HD2 PRO 61 3.742 3.402 21.043 474 HD3 PRO 61 HD3 PRO 61 3.382 4.924 21.902 475 H GLY 62 H GLY 62 8.393 6.429 20.808 476 HA2 GLY 62 HA2 GLY 62 10.605 5.574 20.541 477 HA3 GLY 62 HA3 GLY 62 9.970 3.951 20.331 478 H VAL 63 H VAL 63 7.864 5.688 18.426 479 HA VAL 63 HA VAL 63 9.585 5.326 16.018 480 HB VAL 63 HB VAL 63 6.684 4.480 16.306 481 HG11 VAL 63 HG11 VAL 63 8.704 3.762 14.137 482 HG12 VAL 63 HG12 VAL 63 6.974 3.336 14.155 483 HG13 VAL 63 HG13 VAL 63 7.471 5.016 13.985 484 HG21 VAL 63 HG23 VAL 63 7.660 2.122 16.236 485 HG22 VAL 63 HG21 VAL 63 9.234 2.849 16.610 486 HG23 VAL 63 HG22 VAL 63 7.885 2.991 17.750 487 H ALA 64 H ALA 64 9.620 7.021 14.708 488 HA ALA 64 HA ALA 64 7.348 8.942 14.632 489 HB1 ALA 64 HB3 ALA 64 9.316 9.934 15.816 490 HB2 ALA 64 HB1 ALA 64 10.309 9.618 14.372 491 HB3 ALA 64 HB2 ALA 64 8.959 10.768 14.300 492 H MET 65 H MET 65 7.389 10.197 12.511 493 HA MET 65 HA MET 65 8.625 8.680 10.322 494 HB2 MET 65 HB2 MET 65 6.446 7.665 10.659 495 HB3 MET 65 HB3 MET 65 5.693 9.254 10.385 496 HG2 MET 65 HG2 MET 65 7.382 8.751 8.153 497 HG3 MET 65 HG3 MET 65 6.586 7.228 8.493 498 HE1 MET 65 HE3 MET 65 4.027 7.110 8.964 499 HE2 MET 65 HE1 MET 65 3.502 8.684 9.623 500 HE3 MET 65 HE2 MET 65 2.830 8.092 8.083 501 HA PRO 66 HA PRO 66 8.701 13.387 10.255 502 HB2 PRO 66 HB2 PRO 66 11.462 12.745 9.144 503 HB3 PRO 66 HB3 PRO 66 10.971 14.136 10.158 504 HG2 PRO 66 HG2 PRO 66 12.169 12.047 11.333 505 HG3 PRO 66 HG3 PRO 66 10.694 12.724 12.083 506 HD2 PRO 66 HD2 PRO 66 10.926 10.295 10.279 507 HD3 PRO 66 HD3 PRO 66 10.076 10.464 11.841 508 H HIS 67 H HIS 67 8.423 14.767 8.611 509 HA HIS 67 HA HIS 67 8.602 14.518 5.812 510 HB2 HIS 67 HB2 HIS 67 7.093 12.648 5.825 511 HB3 HIS 67 HB3 HIS 67 6.111 13.342 7.102 512 HD1 HIS 67 HD1 HIS 67 4.093 14.865 6.403 513 HD2 HIS 67 HD2 HIS 67 6.613 13.746 3.207 514 HE1 HIS 67 HE1 HIS 67 2.919 15.540 4.265 515 H ALA 68 H ALA 68 7.499 16.350 4.862 516 HA ALA 68 HA ALA 68 5.942 18.160 6.573 517 HB1 ALA 68 HB3 ALA 68 8.360 19.046 4.929 518 HB2 ALA 68 HB1 ALA 68 7.153 20.130 5.649 519 HB3 ALA 68 HB2 ALA 68 8.184 19.159 6.695 520 H ARG 69 H ARG 69 4.635 19.620 5.189 521 HA ARG 69 HA ARG 69 3.333 18.253 3.107 522 HB2 ARG 69 HB2 ARG 69 3.572 21.203 3.787 523 HB3 ARG 69 HB3 ARG 69 2.599 20.643 2.418 524 HG2 ARG 69 HG2 ARG 69 1.215 19.262 3.928 525 HG3 ARG 69 HG3 ARG 69 2.203 19.756 5.310 526 HD2 ARG 69 HD2 ARG 69 0.144 21.039 5.272 527 HD3 ARG 69 HD3 ARG 69 1.514 22.105 4.999 528 HE ARG 69 HE ARG 69 -0.491 21.166 2.993 529 HH11 ARG 69 HH11 ARG 69 2.077 23.491 3.802 530 HH12 ARG 69 HH12 ARG 69 1.781 24.500 2.437 531 HH21 ARG 69 HH21 ARG 69 -0.873 22.506 1.180 532 HH22 ARG 69 HH22 ARG 69 0.063 23.926 0.918 533 HA PRO 70 HA PRO 70 6.097 18.159 -0.326 534 HB2 PRO 70 HB2 PRO 70 3.694 19.295 -1.845 535 HB3 PRO 70 HB3 PRO 70 4.838 18.049 -2.392 536 HG2 PRO 70 HG2 PRO 70 2.449 17.330 -1.346 537 HG3 PRO 70 HG3 PRO 70 3.917 16.453 -0.811 538 HD2 PRO 70 HD2 PRO 70 2.386 18.605 0.632 539 HD3 PRO 70 HD3 PRO 70 3.207 17.150 1.276 540 H GLU 71 H GLU 71 4.011 21.087 -0.180 541 HA GLU 71 HA GLU 71 5.509 22.837 -1.761 542 HB2 GLU 71 HB2 GLU 71 3.717 23.436 0.635 543 HB3 GLU 71 HB3 GLU 71 4.191 24.607 -0.592 544 HG2 GLU 71 HG2 GLU 71 2.481 22.125 -1.055 545 HG3 GLU 71 HG3 GLU 71 1.905 23.778 -0.937 546 H CYS 72 H CYS 72 6.459 21.615 1.316 547 HA CYS 72 HA CYS 72 7.813 24.034 2.254 548 HB2 CYS 72 HB2 CYS 72 8.006 21.147 3.230 549 HB3 CYS 72 HB3 CYS 72 8.638 22.588 4.045 550 HG CYS 72 HG CYS 72 5.576 21.663 3.342 551 H GLY 73 H GLY 73 8.528 21.726 -0.151 552 HA2 GLY 73 HA2 GLY 73 10.676 22.508 -1.287 553 HA3 GLY 73 HA3 GLY 73 11.483 22.035 0.214 554 H ALA 74 H ALA 74 8.792 19.979 -0.867 555 HA ALA 74 HA ALA 74 10.664 17.774 -1.407 556 HB1 ALA 74 HB3 ALA 74 7.690 17.958 -1.907 557 HB2 ALA 74 HB1 ALA 74 8.697 16.498 -1.939 558 HB3 ALA 74 HB2 ALA 74 8.433 17.338 -0.402 559 H LEU 75 H LEU 75 11.054 16.877 -3.383 560 HA LEU 75 HA LEU 75 10.431 18.517 -5.804 561 HB2 LEU 75 HB2 LEU 75 13.037 17.114 -5.101 562 HB3 LEU 75 HB3 LEU 75 12.713 17.987 -6.587 563 HG LEU 75 HG LEU 75 12.804 19.256 -3.808 564 HD11 LEU 75 HD11 LEU 75 14.970 20.200 -4.583 565 HD12 LEU 75 HD12 LEU 75 15.004 18.441 -4.465 566 HD13 LEU 75 HD13 LEU 75 14.863 19.214 -6.057 567 HD21 LEU 75 HD23 LEU 75 12.679 20.532 -6.585 568 HD22 LEU 75 HD21 LEU 75 11.385 20.551 -5.370 569 HD23 LEU 75 HD22 LEU 75 12.897 21.401 -5.050 570 H LYS 76 H LYS 76 11.111 15.304 -4.404 571 HA LYS 76 HA LYS 76 9.628 14.035 -6.590 572 HB2 LYS 76 HB2 LYS 76 12.368 13.175 -5.619 573 HB3 LYS 76 HB3 LYS 76 11.359 12.246 -6.731 574 HG2 LYS 76 HG2 LYS 76 11.542 14.081 -8.399 575 HG3 LYS 76 HG3 LYS 76 12.580 14.993 -7.291 576 HD2 LYS 76 HD2 LYS 76 13.264 12.244 -8.416 577 HD3 LYS 76 HD3 LYS 76 13.832 13.792 -9.067 578 HE2 LYS 76 HE2 LYS 76 14.847 14.318 -6.824 579 HE3 LYS 76 HE3 LYS 76 14.411 12.691 -6.277 580 HZ1 LYS 76 HZ3 LYS 76 16.243 13.314 -8.518 581 HZ2 LYS 76 HZ1 LYS 76 16.685 12.812 -7.027 582 HZ3 LYS 76 HZ2 LYS 76 15.850 11.801 -8.016 583 H THR 77 H THR 77 8.824 11.853 -5.891 584 HA THR 77 HA THR 77 8.354 11.824 -3.066 585 HB THR 77 HB THR 77 7.303 10.224 -5.419 586 HG1 THR 77 HG1 THR 77 5.926 11.755 -5.658 587 HG21 THR 77 HG23 THR 77 6.191 10.499 -2.599 588 HG22 THR 77 HG21 THR 77 5.459 9.591 -3.951 589 HG23 THR 77 HG22 THR 77 6.988 9.051 -3.258 590 H GLY 78 H GLY 78 9.323 10.464 -1.591 591 HA2 GLY 78 HA2 GLY 78 10.403 7.878 -2.222 592 HA3 GLY 78 HA3 GLY 78 11.682 9.096 -2.101 593 H MET 79 H MET 79 12.020 7.319 -0.230 594 HA MET 79 HA MET 79 11.098 8.510 2.306 595 HB2 MET 79 HB2 MET 79 10.799 5.600 1.451 596 HB3 MET 79 HB3 MET 79 10.760 6.108 3.136 597 HG2 MET 79 HG2 MET 79 8.793 7.487 2.756 598 HG3 MET 79 HG3 MET 79 8.789 7.047 1.044 599 HE1 MET 79 HE3 MET 79 6.845 5.836 0.513 600 HE2 MET 79 HE1 MET 79 6.043 4.570 1.466 601 HE3 MET 79 HE2 MET 79 6.020 6.261 2.020 602 H SER 80 H SER 80 12.288 7.389 4.162 603 HA SER 80 HA SER 80 14.694 5.945 3.585 604 HB2 SER 80 HB2 SER 80 14.896 8.791 4.646 605 HB3 SER 80 HB3 SER 80 16.183 7.586 4.857 606 HG SER 80 HG SER 80 15.117 7.906 2.294 607 H LEU 81 H LEU 81 15.782 5.399 5.738 608 HA LEU 81 HA LEU 81 13.870 5.103 7.986 609 HB2 LEU 81 HB2 LEU 81 13.746 3.239 6.381 610 HB3 LEU 81 HB3 LEU 81 15.484 3.063 6.389 611 HG LEU 81 HG LEU 81 15.569 2.043 8.448 612 HD11 LEU 81 HD11 LEU 81 12.633 2.680 8.913 613 HD12 LEU 81 HD12 LEU 81 13.666 1.724 9.964 614 HD13 LEU 81 HD13 LEU 81 13.974 3.444 9.783 615 HD21 LEU 81 HD23 LEU 81 14.080 0.109 8.010 616 HD22 LEU 81 HD21 LEU 81 12.993 1.139 7.075 617 HD23 LEU 81 HD22 LEU 81 14.606 0.806 6.453 618 H THR 82 H THR 82 14.879 5.469 9.917 619 HA THR 82 HA THR 82 17.849 5.288 10.120 620 HB THR 82 HB THR 82 15.995 7.429 11.273 621 HG1 THR 82 HG1 THR 82 16.447 7.607 9.016 622 HG21 THR 82 HG23 THR 82 19.019 7.083 11.446 623 HG22 THR 82 HG21 THR 82 18.139 8.566 11.901 624 HG23 THR 82 HG22 THR 82 17.845 7.066 12.790 625 H LEU 83 H LEU 83 18.544 4.385 12.077 626 HA LEU 83 HA LEU 83 16.520 3.960 14.170 627 HB2 LEU 83 HB2 LEU 83 16.875 1.793 12.803 628 HB3 LEU 83 HB3 LEU 83 18.554 1.842 13.336 629 HG LEU 83 HG LEU 83 17.583 1.901 15.763 630 HD11 LEU 83 HD11 LEU 83 15.216 2.391 14.919 631 HD12 LEU 83 HD12 LEU 83 15.128 0.697 14.408 632 HD13 LEU 83 HD13 LEU 83 15.390 1.130 16.129 633 HD21 LEU 83 HD23 LEU 83 17.229 -0.560 14.056 634 HD22 LEU 83 HD21 LEU 83 18.733 -0.046 14.847 635 HD23 LEU 83 HD22 LEU 83 17.338 -0.541 15.826 636 H LEU 84 H LEU 84 17.389 4.146 16.223 637 HA LEU 84 HA LEU 84 20.246 5.027 16.442 638 HB2 LEU 84 HB2 LEU 84 17.871 5.665 18.254 639 HB3 LEU 84 HB3 LEU 84 19.545 6.065 18.545 640 HG LEU 84 HG LEU 84 18.574 8.029 18.008 641 HD11 LEU 84 HD11 LEU 84 20.746 7.569 16.841 642 HD12 LEU 84 HD12 LEU 84 19.830 7.123 15.383 643 HD13 LEU 84 HD13 LEU 84 19.756 8.777 16.001 644 HD21 LEU 84 HD23 LEU 84 17.332 6.838 15.491 645 HD22 LEU 84 HD21 LEU 84 16.478 7.292 16.982 646 HD23 LEU 84 HD22 LEU 84 17.259 8.536 16.000 647 H GLU 85 H GLU 85 21.508 3.796 17.827 648 HA GLU 85 HA GLU 85 20.387 1.578 19.286 649 HB2 GLU 85 HB2 GLU 85 23.089 2.959 19.551 650 HB3 GLU 85 HB3 GLU 85 22.615 1.482 20.394 651 HG2 GLU 85 HG2 GLU 85 22.208 0.382 18.174 652 HG3 GLU 85 HG3 GLU 85 22.829 1.825 17.371 653 H GLN 86 H GLN 86 21.382 4.883 20.030 654 HA GLN 86 HA GLN 86 19.871 4.873 22.599 655 HB2 GLN 86 HB2 GLN 86 22.174 6.699 21.843 656 HB3 GLN 86 HB3 GLN 86 21.365 6.555 23.404 657 HG2 GLN 86 HG2 GLN 86 22.206 4.136 23.471 658 HG3 GLN 86 HG3 GLN 86 23.191 4.534 22.051 659 HE21 GLN 86 HE22 GLN 86 24.339 6.934 22.476 660 HE22 GLN 86 HE21 GLN 86 25.248 6.949 23.973 661 H GLY 87 H GLY 87 17.912 5.479 21.831 662 HA2 GLY 87 HA2 GLY 87 17.179 7.274 19.864 663 HA3 GLY 87 HA3 GLY 87 16.233 6.928 21.323 664 H VAL 88 H VAL 88 16.280 9.398 19.978 665 HA VAL 88 HA VAL 88 17.482 11.166 22.050 666 HB VAL 88 HB VAL 88 17.321 11.691 19.049 667 HG11 VAL 88 HG11 VAL 88 18.347 13.511 21.262 668 HG12 VAL 88 HG12 VAL 88 18.513 13.763 19.509 669 HG13 VAL 88 HG13 VAL 88 16.910 13.786 20.233 670 HG21 VAL 88 HG23 VAL 88 19.160 10.234 19.520 671 HG22 VAL 88 HG21 VAL 88 19.877 11.860 19.483 672 HG23 VAL 88 HG22 VAL 88 19.564 11.085 21.027 673 H TYR 89 H TYR 89 16.210 13.056 22.498 674 HA TYR 89 HA TYR 89 13.335 12.294 22.443 675 HB2 TYR 89 HB2 TYR 89 14.734 11.979 24.520 676 HB3 TYR 89 HB3 TYR 89 14.877 13.717 24.626 677 HD1 TYR 89 HD2 TYR 89 11.532 13.378 23.507 678 HD2 TYR 89 HD1 TYR 89 14.060 12.502 26.917 679 HE1 TYR 89 HE2 TYR 89 9.579 13.420 24.995 680 HE2 TYR 89 HE1 TYR 89 12.087 12.539 28.397 681 HH TYR 89 HH TYR 89 9.791 12.873 28.539 682 H PHE 90 H PHE 90 12.698 13.480 20.723 683 HA PHE 90 HA PHE 90 13.052 16.168 20.122 684 HB2 PHE 90 HB2 PHE 90 10.576 14.410 20.115 685 HB3 PHE 90 HB3 PHE 90 10.635 15.998 19.335 686 HD1 PHE 90 HD2 PHE 90 12.974 16.206 17.817 687 HD2 PHE 90 HD1 PHE 90 10.567 12.695 18.485 688 HE1 PHE 90 HE2 PHE 90 13.865 15.207 15.750 689 HE2 PHE 90 HE1 PHE 90 11.414 11.727 16.354 690 HZ PHE 90 HZ PHE 90 13.072 12.982 14.986 691 HA PRO 91 HA PRO 91 11.691 18.120 23.836 692 HB2 PRO 91 HB2 PRO 91 10.971 20.646 22.954 693 HB3 PRO 91 HB3 PRO 91 12.655 20.083 23.177 694 HG2 PRO 91 HG2 PRO 91 11.029 20.142 20.628 695 HG3 PRO 91 HG3 PRO 91 12.721 20.696 20.879 696 HD2 PRO 91 HD2 PRO 91 12.160 18.273 19.802 697 HD3 PRO 91 HD3 PRO 91 13.524 18.467 20.943 698 H GLY 92 H GLY 92 9.838 18.013 24.977 699 HA2 GLY 92 HA2 GLY 92 7.640 18.052 25.544 700 HA3 GLY 92 HA3 GLY 92 7.295 18.902 24.032 701 H ASN 93 H ASN 93 8.852 15.855 23.362 702 HA ASN 93 HA ASN 93 6.372 14.700 22.384 703 HB2 ASN 93 HB2 ASN 93 8.723 14.459 21.397 704 HB3 ASN 93 HB3 ASN 93 9.061 13.339 22.715 705 HD21 ASN 93 HD22 ASN 93 9.197 11.430 21.479 706 HD22 ASN 93 HD21 ASN 93 7.890 10.848 20.463 707 H ASP 94 H ASP 94 5.922 12.302 22.990 708 HA ASP 94 HA ASP 94 5.354 12.112 25.795 709 HB2 ASP 94 HB2 ASP 94 4.016 10.961 24.083 710 HB3 ASP 94 HB3 ASP 94 5.405 9.955 23.657 711 H GLU 95 H GLU 95 7.813 10.542 23.750 712 HA GLU 95 HA GLU 95 9.716 10.344 25.931 713 HB2 GLU 95 HB2 GLU 95 9.660 8.063 26.210 714 HB3 GLU 95 HB3 GLU 95 7.962 8.477 25.983 715 HG2 GLU 95 HG2 GLU 95 7.871 7.550 23.804 716 HG3 GLU 95 HG3 GLU 95 9.622 7.375 23.737 717 HA PRO 96 HA PRO 96 12.821 10.357 22.736 718 HB2 PRO 96 HB2 PRO 96 13.873 7.659 23.521 719 HB3 PRO 96 HB3 PRO 96 14.760 9.201 23.327 720 HG2 PRO 96 HG2 PRO 96 14.164 8.195 25.781 721 HG3 PRO 96 HG3 PRO 96 14.073 9.954 25.459 722 HD2 PRO 96 HD2 PRO 96 11.823 7.946 25.567 723 HD3 PRO 96 HD3 PRO 96 11.879 9.612 26.224 724 H ILE 97 H ILE 97 13.404 9.516 20.651 725 HA ILE 97 HA ILE 97 11.690 7.272 19.662 726 HB ILE 97 HB ILE 97 12.778 9.704 18.204 727 HG12 ILE 97 HG12 ILE 97 10.923 10.405 19.547 728 HG13 ILE 97 HG13 ILE 97 10.376 10.298 17.888 729 HG21 ILE 97 HG21 ILE 97 12.767 7.735 16.694 730 HG22 ILE 97 HG22 ILE 97 11.073 7.424 17.104 731 HG23 ILE 97 HG23 ILE 97 11.529 8.901 16.252 732 HD11 ILE 97 HD13 ILE 97 9.248 8.131 18.398 733 HD12 ILE 97 HD11 ILE 97 9.756 8.295 20.104 734 HD13 ILE 97 HD12 ILE 97 8.659 9.460 19.397 735 H LYS 98 H LYS 98 12.689 5.572 18.854 736 HA LYS 98 HA LYS 98 15.659 5.660 18.522 737 HB2 LYS 98 HB2 LYS 98 13.746 3.453 19.342 738 HB3 LYS 98 HB3 LYS 98 15.284 3.063 18.564 739 HG2 LYS 98 HG2 LYS 98 16.546 4.219 20.293 740 HG3 LYS 98 HG3 LYS 98 15.060 4.801 21.052 741 HD2 LYS 98 HD2 LYS 98 16.009 2.919 22.305 742 HD3 LYS 98 HD3 LYS 98 14.406 2.561 21.683 743 HE2 LYS 98 HE2 LYS 98 15.813 0.611 21.478 744 HE3 LYS 98 HE3 LYS 98 15.364 1.183 19.874 745 HZ1 LYS 98 HZ3 LYS 98 17.713 0.553 20.084 746 HZ2 LYS 98 HZ1 LYS 98 17.576 2.112 19.621 747 HZ3 LYS 98 HZ2 LYS 98 17.990 1.746 21.167 748 H LEU 99 H LEU 99 12.632 5.462 16.788 749 HA LEU 99 HA LEU 99 14.096 4.495 14.388 750 HB2 LEU 99 HB2 LEU 99 12.931 2.595 15.445 751 HB3 LEU 99 HB3 LEU 99 11.484 3.578 15.661 752 HG LEU 99 HG LEU 99 11.094 3.601 13.224 753 HD11 LEU 99 HD11 LEU 99 13.370 3.277 12.339 754 HD12 LEU 99 HD12 LEU 99 13.478 1.679 13.095 755 HD13 LEU 99 HD13 LEU 99 12.318 1.976 11.792 756 HD21 LEU 99 HD23 LEU 99 10.280 1.337 13.127 757 HD22 LEU 99 HD21 LEU 99 11.462 0.803 14.353 758 HD23 LEU 99 HD22 LEU 99 10.131 1.882 14.786 759 H LEU 100 H LEU 100 13.670 5.599 12.575 760 HA LEU 100 HA LEU 100 11.279 7.372 12.516 761 HB2 LEU 100 HB2 LEU 100 14.022 8.325 11.628 762 HB3 LEU 100 HB3 LEU 100 12.540 9.233 11.712 763 HG LEU 100 HG LEU 100 12.753 8.452 14.319 764 HD11 LEU 100 HD11 LEU 100 14.968 7.333 13.953 765 HD12 LEU 100 HD12 LEU 100 15.632 8.901 13.449 766 HD13 LEU 100 HD13 LEU 100 15.040 8.671 15.108 767 HD21 LEU 100 HD23 LEU 100 13.507 10.619 14.927 768 HD22 LEU 100 HD21 LEU 100 14.164 10.919 13.310 769 HD23 LEU 100 HD22 LEU 100 12.407 10.768 13.546 770 H ILE 101 H ILE 101 10.305 7.408 10.505 771 HA ILE 101 HA ILE 101 11.928 6.477 8.208 772 HB ILE 101 HB ILE 101 9.112 5.687 8.964 773 HG12 ILE 101 HG12 ILE 101 11.560 4.474 7.584 774 HG13 ILE 101 HG13 ILE 101 11.046 4.225 9.255 775 HG21 ILE 101 HG21 ILE 101 8.487 5.180 6.662 776 HG22 ILE 101 HG22 ILE 101 8.686 6.905 6.870 777 HG23 ILE 101 HG23 ILE 101 9.965 5.970 6.055 778 HD11 ILE 101 HD13 ILE 101 9.129 2.929 8.474 779 HD12 ILE 101 HD11 ILE 101 9.601 3.228 6.774 780 HD13 ILE 101 HD12 ILE 101 10.650 2.287 7.825 781 H GLY 102 H GLY 102 12.333 7.949 6.784 782 HA2 GLY 102 HA2 GLY 102 11.035 10.589 6.925 783 HA3 GLY 102 HA3 GLY 102 12.392 10.122 5.893 784 H LEU 103 H LEU 103 9.667 11.312 5.210 785 HA LEU 103 HA LEU 103 9.335 9.678 2.783 786 HB2 LEU 103 HB2 LEU 103 7.460 9.059 4.477 787 HB3 LEU 103 HB3 LEU 103 6.954 10.727 4.364 788 HG LEU 103 HG LEU 103 6.707 8.472 2.324 789 HD11 LEU 103 HD11 LEU 103 4.375 9.102 2.497 790 HD12 LEU 103 HD12 LEU 103 4.967 9.208 4.153 791 HD13 LEU 103 HD13 LEU 103 4.757 10.674 3.221 792 HD21 LEU 103 HD23 LEU 103 5.690 10.182 0.745 793 HD22 LEU 103 HD21 LEU 103 6.507 11.435 1.665 794 HD23 LEU 103 HD22 LEU 103 7.430 10.124 0.843 795 H SER 104 H SER 104 9.248 11.119 1.040 796 HA SER 104 HA SER 104 8.508 13.941 1.488 797 HB2 SER 104 HB2 SER 104 10.213 14.656 -0.102 798 HB3 SER 104 HB3 SER 104 10.953 13.920 1.330 799 HG SER 104 HG SER 104 10.795 12.964 -1.313 800 H ALA 105 H ALA 105 7.294 14.757 -0.382 801 HA ALA 105 HA ALA 105 6.714 12.791 -2.504 802 HB1 ALA 105 HB3 ALA 105 4.628 13.960 -0.627 803 HB2 ALA 105 HB1 ALA 105 4.285 13.042 -2.108 804 HB3 ALA 105 HB2 ALA 105 5.093 12.241 -0.742 805 H ALA 106 H ALA 106 6.288 13.786 -4.418 806 HA ALA 106 HA ALA 106 6.705 16.641 -4.541 807 HB1 ALA 106 HB3 ALA 106 7.602 15.102 -6.260 808 HB2 ALA 106 HB1 ALA 106 5.947 14.625 -6.711 809 HB3 ALA 106 HB2 ALA 106 6.507 16.289 -6.988 810 H ASP 107 H ASP 107 3.875 14.560 -4.375 811 HA ASP 107 HA ASP 107 2.099 16.927 -4.602 812 HB2 ASP 107 HB2 ASP 107 2.182 15.976 -6.876 813 HB3 ASP 107 HB3 ASP 107 1.786 14.380 -6.242 814 H ALA 108 H ALA 108 -0.022 16.532 -3.639 815 HA ALA 108 HA ALA 108 0.156 15.177 -1.190 816 HB1 ALA 108 HB3 ALA 108 -2.235 15.730 -0.959 817 HB2 ALA 108 HB1 ALA 108 -1.318 17.111 -1.590 818 HB3 ALA 108 HB2 ALA 108 -2.322 16.128 -2.687 819 H ASP 109 H ASP 109 -1.158 13.998 -4.312 820 HA ASP 109 HA ASP 109 -2.376 11.647 -3.033 821 HB2 ASP 109 HB2 ASP 109 -3.345 12.462 -5.054 822 HB3 ASP 109 HB3 ASP 109 -1.798 12.313 -5.921 823 H SER 110 H SER 110 0.730 12.464 -4.543 824 HA SER 110 HA SER 110 1.828 9.807 -4.472 825 HB2 SER 110 HB2 SER 110 3.377 12.409 -4.174 826 HB3 SER 110 HB3 SER 110 3.937 10.863 -4.810 827 HG SER 110 HG SER 110 2.546 11.129 -6.581 828 H HIS 111 H HIS 111 1.699 12.506 -2.086 829 HA HIS 111 HA HIS 111 3.075 11.215 0.040 830 HB2 HIS 111 HB2 HIS 111 2.637 13.516 0.325 831 HB3 HIS 111 HB3 HIS 111 0.955 13.357 -0.103 832 HD1 HIS 111 HD1 HIS 111 3.210 13.086 2.940 833 HD2 HIS 111 HD2 HIS 111 -0.809 12.686 1.765 834 HE1 HIS 111 HE1 HIS 111 1.853 12.908 5.079 835 H ILE 112 H ILE 112 -0.448 11.171 -0.777 836 HA ILE 112 HA ILE 112 -1.257 9.449 1.310 837 HB ILE 112 HB ILE 112 -2.294 9.913 -1.510 838 HG12 ILE 112 HG12 ILE 112 -2.430 11.781 0.210 839 HG13 ILE 112 HG13 ILE 112 -3.913 11.332 -0.613 840 HG21 ILE 112 HG21 ILE 112 -3.093 7.723 -1.045 841 HG22 ILE 112 HG22 ILE 112 -3.591 8.175 0.600 842 HG23 ILE 112 HG23 ILE 112 -4.433 8.848 -0.822 843 HD11 ILE 112 HD13 ILE 112 -3.146 10.434 2.191 844 HD12 ILE 112 HD11 ILE 112 -4.200 11.810 1.787 845 HD13 ILE 112 HD12 ILE 112 -4.708 10.168 1.368 846 H GLY 113 H GLY 113 -0.251 8.512 -2.065 847 HA2 GLY 113 HA2 GLY 113 -0.539 5.738 -1.658 848 HA3 GLY 113 HA3 GLY 113 0.532 6.502 -2.853 849 H ALA 114 H ALA 114 2.249 7.874 -1.022 850 HA ALA 114 HA ALA 114 4.154 5.823 -0.372 851 HB1 ALA 114 HB3 ALA 114 4.769 8.101 -1.092 852 HB2 ALA 114 HB1 ALA 114 3.970 8.788 0.323 853 HB3 ALA 114 HB2 ALA 114 5.417 7.778 0.516 854 H ILE 115 H ILE 115 2.135 7.989 1.738 855 HA ILE 115 HA ILE 115 2.840 7.010 4.196 856 HB ILE 115 HB ILE 115 0.476 8.248 2.985 857 HG12 ILE 115 HG12 ILE 115 2.403 9.688 3.591 858 HG13 ILE 115 HG13 ILE 115 0.898 10.145 4.370 859 HG21 ILE 115 HG21 ILE 115 0.431 7.146 5.752 860 HG22 ILE 115 HG22 ILE 115 -0.633 8.494 5.212 861 HG23 ILE 115 HG23 ILE 115 -0.720 6.929 4.406 862 HD11 ILE 115 HD13 ILE 115 1.604 9.201 6.481 863 HD12 ILE 115 HD11 ILE 115 3.092 8.580 5.726 864 HD13 ILE 115 HD12 ILE 115 2.830 10.326 5.872 865 H GLN 116 H GLN 116 0.261 5.892 1.902 866 HA GLN 116 HA GLN 116 -0.748 3.845 3.621 867 HB2 GLN 116 HB2 GLN 116 -0.950 4.362 0.627 868 HB3 GLN 116 HB3 GLN 116 -1.774 3.010 1.401 869 HG2 GLN 116 HG2 GLN 116 -2.142 5.925 2.194 870 HG3 GLN 116 HG3 GLN 116 -3.203 5.053 1.097 871 HE21 GLN 116 HE22 GLN 116 -3.332 6.230 4.075 872 HE22 GLN 116 HE21 GLN 116 -4.174 4.962 4.923 873 H ALA 117 H ALA 117 2.195 3.921 1.828 874 HA ALA 117 HA ALA 117 2.378 1.004 1.716 875 HB1 ALA 117 HB3 ALA 117 4.470 1.372 0.483 876 HB2 ALA 117 HB1 ALA 117 3.226 2.414 -0.241 877 HB3 ALA 117 HB2 ALA 117 4.431 3.100 0.848 878 H LEU 118 H LEU 118 3.803 3.861 3.360 879 HA LEU 118 HA LEU 118 5.583 2.120 4.817 880 HB2 LEU 118 HB2 LEU 118 6.298 4.054 5.965 881 HB3 LEU 118 HB3 LEU 118 6.144 4.334 4.217 882 HG LEU 118 HG LEU 118 4.025 5.440 4.577 883 HD11 LEU 118 HD11 LEU 118 3.486 6.484 6.685 884 HD12 LEU 118 HD12 LEU 118 3.510 4.789 7.021 885 HD13 LEU 118 HD13 LEU 118 4.910 5.753 7.479 886 HD21 LEU 118 HD23 LEU 118 6.059 6.697 4.130 887 HD22 LEU 118 HD21 LEU 118 5.162 7.555 5.385 888 HD23 LEU 118 HD22 LEU 118 6.563 6.585 5.822 889 H SER 119 H SER 119 2.389 3.344 5.296 890 HA SER 119 HA SER 119 1.987 2.623 7.976 891 HB2 SER 119 HB2 SER 119 -0.003 2.351 5.686 892 HB3 SER 119 HB3 SER 119 -0.409 2.325 7.413 893 HG SER 119 HG SER 119 0.750 4.453 5.925 894 H GLU 120 H GLU 120 2.532 0.402 5.286 895 HA GLU 120 HA GLU 120 1.430 -1.935 6.527 896 HB2 GLU 120 HB2 GLU 120 3.702 -1.659 4.534 897 HB3 GLU 120 HB3 GLU 120 2.921 -3.170 4.964 898 HG2 GLU 120 HG2 GLU 120 1.398 -0.822 3.776 899 HG3 GLU 120 HG3 GLU 120 2.141 -2.072 2.788 900 H LEU 121 H LEU 121 4.198 0.029 7.036 901 HA LEU 121 HA LEU 121 5.595 -1.996 8.720 902 HB2 LEU 121 HB2 LEU 121 6.614 0.655 7.617 903 HB3 LEU 121 HB3 LEU 121 7.558 -0.539 8.487 904 HG LEU 121 HG LEU 121 6.384 -0.691 5.691 905 HD11 LEU 121 HD11 LEU 121 8.505 0.512 5.944 906 HD12 LEU 121 HD12 LEU 121 9.237 -0.891 6.755 907 HD13 LEU 121 HD13 LEU 121 8.759 -0.997 5.051 908 HD21 LEU 121 HD23 LEU 121 7.306 -2.951 5.405 909 HD22 LEU 121 HD21 LEU 121 7.855 -2.997 7.079 910 HD23 LEU 121 HD22 LEU 121 6.118 -2.985 6.706 911 H LEU 122 H LEU 122 5.026 1.584 8.836 912 HA LEU 122 HA LEU 122 5.550 1.920 11.575 913 HB2 LEU 122 HB2 LEU 122 3.800 3.430 9.571 914 HB3 LEU 122 HB3 LEU 122 3.883 3.933 11.232 915 HG LEU 122 HG LEU 122 5.307 5.294 9.857 916 HD11 LEU 122 HD11 LEU 122 5.974 4.856 12.214 917 HD12 LEU 122 HD12 LEU 122 7.066 3.572 11.645 918 HD13 LEU 122 HD13 LEU 122 7.339 5.254 11.159 919 HD21 LEU 122 HD23 LEU 122 7.278 4.498 8.737 920 HD22 LEU 122 HD21 LEU 122 6.996 2.832 9.286 921 HD23 LEU 122 HD22 LEU 122 5.889 3.613 8.137 922 H CYS 123 H CYS 123 2.514 0.766 10.145 923 HA CYS 123 HA CYS 123 1.207 1.142 12.794 924 HB2 CYS 123 HB2 CYS 123 -0.066 0.511 10.101 925 HB3 CYS 123 HB3 CYS 123 -0.912 0.879 11.601 926 HG CYS 123 HG CYS 123 1.240 2.838 10.015 927 H GLU 124 H GLU 124 3.185 -0.936 12.205 928 HA GLU 124 HA GLU 124 1.525 -3.312 12.749 929 HB2 GLU 124 HB2 GLU 124 2.052 -3.008 10.254 930 HB3 GLU 124 HB3 GLU 124 3.739 -3.307 10.666 931 HG2 GLU 124 HG2 GLU 124 2.751 -5.333 9.892 932 HG3 GLU 124 HG3 GLU 124 3.079 -5.510 11.623 933 H GLU 125 H GLU 125 2.100 -3.394 14.845 934 HA GLU 125 HA GLU 125 4.565 -2.744 15.916 935 HB2 GLU 125 HB2 GLU 125 3.835 -3.847 17.940 936 HB3 GLU 125 HB3 GLU 125 2.513 -2.943 17.206 937 HG2 GLU 125 HG2 GLU 125 1.619 -5.089 16.245 938 HG3 GLU 125 HG3 GLU 125 2.911 -5.967 17.066 939 H GLU 126 H GLU 126 3.683 -5.734 14.320 940 HA GLU 126 HA GLU 126 5.780 -7.375 15.323 941 HB2 GLU 126 HB2 GLU 126 4.461 -7.477 12.573 942 HB3 GLU 126 HB3 GLU 126 5.410 -8.761 13.335 943 HG2 GLU 126 HG2 GLU 126 3.710 -8.765 15.221 944 HG3 GLU 126 HG3 GLU 126 2.730 -7.658 14.248 945 H ILE 127 H ILE 127 5.542 -5.158 12.556 946 HA ILE 127 HA ILE 127 8.251 -5.546 11.613 947 HB ILE 127 HB ILE 127 6.040 -3.620 11.027 948 HG12 ILE 127 HG12 ILE 127 6.201 -4.455 8.786 949 HG13 ILE 127 HG13 ILE 127 7.684 -5.350 9.148 950 HG21 ILE 127 HG21 ILE 127 8.933 -3.294 10.292 951 HG22 ILE 127 HG22 ILE 127 7.646 -2.649 9.272 952 HG23 ILE 127 HG23 ILE 127 7.787 -2.094 10.938 953 HD11 ILE 127 HD13 ILE 127 4.965 -5.990 10.329 954 HD12 ILE 127 HD11 ILE 127 5.642 -6.765 8.884 955 HD13 ILE 127 HD12 ILE 127 6.444 -6.978 10.447 956 H LEU 128 H LEU 128 6.548 -3.111 13.665 957 HA LEU 128 HA LEU 128 8.694 -1.379 13.972 958 HB2 LEU 128 HB2 LEU 128 6.647 -2.080 16.119 959 HB3 LEU 128 HB3 LEU 128 7.726 -0.700 16.163 960 HG LEU 128 HG LEU 128 5.492 -1.127 14.146 961 HD11 LEU 128 HD11 LEU 128 4.495 0.836 15.239 962 HD12 LEU 128 HD12 LEU 128 4.713 -0.493 16.380 963 HD13 LEU 128 HD13 LEU 128 5.828 0.878 16.410 964 HD21 LEU 128 HD23 LEU 128 6.099 1.278 13.522 965 HD22 LEU 128 HD21 LEU 128 7.670 0.975 14.289 966 HD23 LEU 128 HD22 LEU 128 7.147 -0.003 12.903 967 H GLU 129 H GLU 129 8.109 -4.324 15.888 968 HA GLU 129 HA GLU 129 10.314 -3.858 17.641 969 HB2 GLU 129 HB2 GLU 129 8.526 -6.201 17.014 970 HB3 GLU 129 HB3 GLU 129 10.073 -6.518 17.816 971 HG2 GLU 129 HG2 GLU 129 9.567 -4.902 19.579 972 HG3 GLU 129 HG3 GLU 129 8.004 -4.534 18.831 973 H GLN 130 H GLN 130 10.016 -5.498 14.443 974 HA GLN 130 HA GLN 130 12.589 -6.761 14.670 975 HB2 GLN 130 HB2 GLN 130 10.592 -6.300 12.430 976 HB3 GLN 130 HB3 GLN 130 12.152 -7.115 12.164 977 HG2 GLN 130 HG2 GLN 130 11.641 -8.849 13.735 978 HG3 GLN 130 HG3 GLN 130 10.144 -8.054 14.230 979 HE21 GLN 130 HE22 GLN 130 8.316 -8.158 12.884 980 HE22 GLN 130 HE21 GLN 130 8.203 -9.271 11.525 981 H LEU 131 H LEU 131 11.369 -3.661 13.375 982 HA LEU 131 HA LEU 131 13.927 -2.791 12.281 983 HB2 LEU 131 HB2 LEU 131 11.573 -1.218 13.373 984 HB3 LEU 131 HB3 LEU 131 12.925 -0.517 12.490 985 HG LEU 131 HG LEU 131 11.109 -2.658 11.267 986 HD11 LEU 131 HD11 LEU 131 9.737 -0.857 10.344 987 HD12 LEU 131 HD12 LEU 131 9.750 -0.814 12.130 988 HD13 LEU 131 HD13 LEU 131 10.718 0.350 11.190 989 HD21 LEU 131 HD23 LEU 131 11.801 -1.761 9.141 990 HD22 LEU 131 HD21 LEU 131 12.640 -0.419 9.918 991 HD23 LEU 131 HD22 LEU 131 13.264 -2.082 10.091 992 H LEU 132 H LEU 132 12.095 -2.066 15.285 993 HA LEU 132 HA LEU 132 14.048 -0.499 16.526 994 HB2 LEU 132 HB2 LEU 132 11.860 -2.218 17.700 995 HB3 LEU 132 HB3 LEU 132 12.931 -1.322 18.749 996 HG LEU 132 HG LEU 132 11.355 0.069 16.558 997 HD11 LEU 132 HD11 LEU 132 10.603 -0.297 19.490 998 HD12 LEU 132 HD12 LEU 132 9.745 0.715 18.305 999 HD13 LEU 132 HD13 LEU 132 9.783 -1.042 18.101 1000 HD21 LEU 132 HD23 LEU 132 11.768 2.079 17.922 1001 HD22 LEU 132 HD21 LEU 132 12.679 1.112 19.101 1002 HD23 LEU 132 HD22 LEU 132 13.299 1.335 17.453 1003 H THR 133 H THR 133 14.201 -3.969 16.209 1004 HA THR 133 HA THR 133 16.428 -4.060 18.166 1005 HB THR 133 HB THR 133 15.908 -6.451 18.377 1006 HG1 THR 133 HG1 THR 133 13.558 -5.877 16.907 1007 HG21 THR 133 HG23 THR 133 13.863 -6.270 19.684 1008 HG22 THR 133 HG21 THR 133 14.864 -4.835 19.954 1009 HG23 THR 133 HG22 THR 133 13.430 -4.738 18.911 1010 H ALA 134 H ALA 134 16.171 -3.512 15.007 1011 HA ALA 134 HA ALA 134 17.630 -5.518 13.688 1012 HB1 ALA 134 HB3 ALA 134 18.185 -3.635 12.090 1013 HB2 ALA 134 HB1 ALA 134 16.450 -3.859 12.433 1014 HB3 ALA 134 HB2 ALA 134 17.370 -2.535 13.193 1015 H SER 135 H SER 135 19.651 -6.152 13.812 1016 HA SER 135 HA SER 135 21.610 -4.711 15.470 1017 HB2 SER 135 HB2 SER 135 21.757 -7.353 13.953 1018 HB3 SER 135 HB3 SER 135 22.967 -6.742 15.095 1019 HG SER 135 HG SER 135 20.233 -7.274 15.710 1020 H SER 136 H SER 136 20.695 -4.651 12.135 1021 HA SER 136 HA SER 136 23.176 -3.257 11.408 1022 HB2 SER 136 HB2 SER 136 23.527 -4.776 9.461 1023 HB3 SER 136 HB3 SER 136 23.733 -5.610 11.005 1024 HG SER 136 HG SER 136 22.474 -6.899 9.725 1025 H GLU 137 H GLU 137 22.985 -2.149 9.368 1026 HA GLU 137 HA GLU 137 20.422 -1.094 8.652 1027 HB2 GLU 137 HB2 GLU 137 23.124 -1.227 7.246 1028 HB3 GLU 137 HB3 GLU 137 21.716 -0.395 6.531 1029 HG2 GLU 137 HG2 GLU 137 21.520 1.126 8.207 1030 HG3 GLU 137 HG3 GLU 137 22.666 0.286 9.279 1031 H LYS 138 H LYS 138 22.248 -3.969 7.572 1032 HA LYS 138 HA LYS 138 20.651 -4.601 5.330 1033 HB2 LYS 138 HB2 LYS 138 22.012 -6.533 7.258 1034 HB3 LYS 138 HB3 LYS 138 21.442 -6.928 5.647 1035 HG2 LYS 138 HG2 LYS 138 23.721 -5.037 6.371 1036 HG3 LYS 138 HG3 LYS 138 23.862 -6.634 5.655 1037 HD2 LYS 138 HD2 LYS 138 22.669 -4.168 4.311 1038 HD3 LYS 138 HD3 LYS 138 24.253 -4.882 4.003 1039 HE2 LYS 138 HE2 LYS 138 23.157 -6.993 3.247 1040 HE3 LYS 138 HE3 LYS 138 21.571 -6.251 3.497 1041 HZ1 LYS 138 HZ3 LYS 138 22.156 -4.600 1.807 1042 HZ2 LYS 138 HZ1 LYS 138 23.618 -5.296 1.578 1043 HZ3 LYS 138 HZ2 LYS 138 22.260 -6.105 1.192 1044 H GLN 139 H GLN 139 20.091 -5.348 8.802 1045 HA GLN 139 HA GLN 139 17.781 -6.891 8.325 1046 HB2 GLN 139 HB2 GLN 139 19.333 -6.147 10.537 1047 HB3 GLN 139 HB3 GLN 139 17.787 -5.340 10.837 1048 HG2 GLN 139 HG2 GLN 139 16.597 -7.435 10.514 1049 HG3 GLN 139 HG3 GLN 139 18.133 -8.263 10.158 1050 HE21 GLN 139 HE22 GLN 139 15.962 -8.431 12.461 1051 HE22 GLN 139 HE21 GLN 139 16.949 -8.439 13.900 1052 H LEU 140 H LEU 140 18.136 -3.325 8.905 1053 HA LEU 140 HA LEU 140 15.313 -2.789 8.928 1054 HB2 LEU 140 HB2 LEU 140 17.805 -1.151 8.390 1055 HB3 LEU 140 HB3 LEU 140 16.221 -0.426 8.272 1056 HG LEU 140 HG LEU 140 16.534 -1.941 10.782 1057 HD11 LEU 140 HD11 LEU 140 18.374 0.440 10.321 1058 HD12 LEU 140 HD12 LEU 140 18.096 -0.398 11.866 1059 HD13 LEU 140 HD13 LEU 140 18.884 -1.253 10.541 1060 HD21 LEU 140 HD23 LEU 140 16.005 1.025 10.471 1061 HD22 LEU 140 HD21 LEU 140 14.763 -0.240 10.350 1062 HD23 LEU 140 HD22 LEU 140 15.646 -0.021 11.857 1063 H ALA 141 H ALA 141 17.756 -2.475 6.303 1064 HA ALA 141 HA ALA 141 16.053 -2.045 4.150 1065 HB1 ALA 141 HB3 ALA 141 17.881 -2.880 2.767 1066 HB2 ALA 141 HB1 ALA 141 18.538 -1.903 4.096 1067 HB3 ALA 141 HB2 ALA 141 18.625 -3.677 4.170 1068 H ASP 142 H ASP 142 16.787 -5.243 5.697 1069 HA ASP 142 HA ASP 142 15.539 -6.783 3.660 1070 HB2 ASP 142 HB2 ASP 142 16.954 -7.871 5.293 1071 HB3 ASP 142 HB3 ASP 142 15.901 -7.370 6.619 1072 H ILE 143 H ILE 143 14.227 -5.278 6.679 1073 HA ILE 143 HA ILE 143 11.596 -6.279 6.364 1074 HB ILE 143 HB ILE 143 12.813 -3.927 7.859 1075 HG12 ILE 143 HG12 ILE 143 11.811 -6.599 8.952 1076 HG13 ILE 143 HG13 ILE 143 13.485 -6.344 8.486 1077 HG21 ILE 143 HG21 ILE 143 10.729 -3.937 9.200 1078 HG22 ILE 143 HG22 ILE 143 10.473 -3.446 7.524 1079 HG23 ILE 143 HG23 ILE 143 10.016 -5.089 8.045 1080 HD11 ILE 143 HD13 ILE 143 13.451 -6.010 10.798 1081 HD12 ILE 143 HD11 ILE 143 13.566 -4.391 10.113 1082 HD13 ILE 143 HD12 ILE 143 12.005 -4.985 10.753 1083 H ILE 144 H ILE 144 13.247 -3.358 5.145 1084 HA ILE 144 HA ILE 144 10.989 -2.182 3.824 1085 HB ILE 144 HB ILE 144 13.969 -2.170 3.200 1086 HG12 ILE 144 HG12 ILE 144 13.370 -1.000 5.253 1087 HG13 ILE 144 HG13 ILE 144 13.963 0.099 4.018 1088 HG21 ILE 144 HG21 ILE 144 13.533 -0.228 1.680 1089 HG22 ILE 144 HG22 ILE 144 13.048 -1.801 1.053 1090 HG23 ILE 144 HG23 ILE 144 11.814 -0.691 1.674 1091 HD11 ILE 144 HD13 ILE 144 11.092 -0.301 4.896 1092 HD12 ILE 144 HD11 ILE 144 12.108 1.146 5.041 1093 HD13 ILE 144 HD12 ILE 144 11.560 0.612 3.445 1094 H SER 145 H SER 145 13.391 -4.555 2.704 1095 HA SER 145 HA SER 145 12.324 -4.672 0.084 1096 HB2 SER 145 HB2 SER 145 14.027 -6.751 1.543 1097 HB3 SER 145 HB3 SER 145 13.810 -6.624 -0.212 1098 HG SER 145 HG SER 145 15.059 -4.771 1.552 1099 H ARG 146 H ARG 146 11.488 -6.463 3.019 1100 HA ARG 146 HA ARG 146 9.939 -8.525 2.032 1101 HB2 ARG 146 HB2 ARG 146 10.652 -7.438 4.481 1102 HB3 ARG 146 HB3 ARG 146 8.947 -7.001 4.428 1103 HG2 ARG 146 HG2 ARG 146 8.368 -9.367 4.048 1104 HG3 ARG 146 HG3 ARG 146 10.103 -9.781 4.011 1105 HD2 ARG 146 HD2 ARG 146 8.756 -8.431 6.389 1106 HD3 ARG 146 HD3 ARG 146 8.881 -10.198 6.227 1107 HE ARG 146 HE ARG 146 11.476 -9.108 5.873 1108 HH11 ARG 146 HH11 ARG 146 9.085 -9.549 8.461 1109 HH12 ARG 146 HH12 ARG 146 10.277 -9.649 9.722 1110 HH21 ARG 146 HH21 ARG 146 13.030 -9.268 7.505 1111 HH22 ARG 146 HH22 ARG 146 12.557 -9.493 9.170 1112 H GLY 147 H GLY 147 9.226 -5.083 2.015 1113 HA2 GLY 147 HA2 GLY 147 6.311 -5.457 1.823 1114 HA3 GLY 147 HA3 GLY 147 7.217 -3.937 1.883 Start of MODEL 8 1 H MET 1 H1 MET 1 1.462 -0.859 -0.314 2 HA MET 1 HA MET 1 1.809 -1.157 -3.215 3 HB2 MET 1 HB2 MET 1 1.661 1.295 -1.952 4 HB3 MET 1 HB3 MET 1 3.389 0.937 -1.776 5 HG2 MET 1 HG2 MET 1 2.894 2.221 -3.812 6 HG3 MET 1 HG3 MET 1 3.606 0.659 -4.197 7 HE1 MET 1 HE3 MET 1 2.920 1.082 -6.733 8 HE2 MET 1 HE1 MET 1 1.267 1.470 -7.258 9 HE3 MET 1 HE2 MET 1 2.183 2.635 -6.276 10 H ARG 2 H ARG 2 4.078 -1.552 -3.863 11 HA ARG 2 HA ARG 2 5.547 -3.244 -1.998 12 HB2 ARG 2 HB2 ARG 2 6.184 -2.034 -4.733 13 HB3 ARG 2 HB3 ARG 2 7.397 -2.870 -3.768 14 HG2 ARG 2 HG2 ARG 2 6.606 -4.448 -5.310 15 HG3 ARG 2 HG3 ARG 2 5.950 -4.913 -3.736 16 HD2 ARG 2 HD2 ARG 2 3.756 -3.992 -4.359 17 HD3 ARG 2 HD3 ARG 2 4.430 -3.394 -5.894 18 HE ARG 2 HE ARG 2 4.866 -6.215 -5.605 19 HH11 ARG 2 HH11 ARG 2 2.284 -3.901 -6.386 20 HH12 ARG 2 HH12 ARG 2 1.365 -5.025 -7.314 21 HH21 ARG 2 HH21 ARG 2 3.644 -7.709 -6.847 22 HH22 ARG 2 HH22 ARG 2 2.159 -7.237 -7.581 23 H LEU 3 H LEU 3 6.310 -2.248 -0.194 24 HA LEU 3 HA LEU 3 6.893 0.453 0.184 25 HB2 LEU 3 HB2 LEU 3 7.944 -2.084 1.468 26 HB3 LEU 3 HB3 LEU 3 8.705 -0.555 1.864 27 HG LEU 3 HG LEU 3 7.002 -1.265 3.514 28 HD11 LEU 3 HD11 LEU 3 7.683 1.040 3.326 29 HD12 LEU 3 HD12 LEU 3 6.424 1.371 2.120 30 HD13 LEU 3 HD13 LEU 3 5.990 0.915 3.784 31 HD21 LEU 3 HD23 LEU 3 4.934 -0.691 1.361 32 HD22 LEU 3 HD21 LEU 3 5.354 -2.297 1.994 33 HD23 LEU 3 HD22 LEU 3 4.636 -1.087 3.059 34 H SER 4 H SER 4 9.093 -2.118 -0.994 35 HA SER 4 HA SER 4 11.453 -0.783 -1.099 36 HB2 SER 4 HB2 SER 4 10.687 -2.633 -3.346 37 HB3 SER 4 HB3 SER 4 12.158 -2.615 -2.357 38 HG SER 4 HG SER 4 10.702 -4.380 -1.945 39 H ASP 5 H ASP 5 8.688 -0.080 -3.195 40 HA ASP 5 HA ASP 5 10.162 0.975 -5.408 41 HB2 ASP 5 HB2 ASP 5 7.776 0.326 -5.519 42 HB3 ASP 5 HB3 ASP 5 7.371 1.638 -4.405 43 H TYR 6 H TYR 6 9.369 2.226 -2.216 44 HA TYR 6 HA TYR 6 9.731 5.025 -3.065 45 HB2 TYR 6 HB2 TYR 6 8.821 3.761 -0.462 46 HB3 TYR 6 HB3 TYR 6 8.989 5.493 -0.719 47 HD1 TYR 6 HD1 TYR 6 6.883 2.521 -1.533 48 HD2 TYR 6 HD2 TYR 6 7.435 6.797 -1.949 49 HE1 TYR 6 HE1 TYR 6 4.627 2.735 -2.464 50 HE2 TYR 6 HE2 TYR 6 5.184 6.986 -2.967 51 HH TYR 6 HH TYR 6 3.258 5.850 -3.619 52 H PHE 7 H PHE 7 11.761 2.582 -1.561 53 HA PHE 7 HA PHE 7 13.315 4.643 -0.080 54 HB2 PHE 7 HB2 PHE 7 13.311 1.621 0.023 55 HB3 PHE 7 HB3 PHE 7 14.509 2.609 0.827 56 HD1 PHE 7 HD2 PHE 7 10.813 2.094 0.611 57 HD2 PHE 7 HD1 PHE 7 14.098 3.348 3.122 58 HE1 PHE 7 HE2 PHE 7 9.257 2.430 2.484 59 HE2 PHE 7 HE1 PHE 7 12.499 3.769 4.953 60 HZ PHE 7 HZ PHE 7 10.097 3.286 4.668 61 HA PRO 8 HA PRO 8 16.044 4.638 -3.770 62 HB2 PRO 8 HB2 PRO 8 17.592 6.518 -1.995 63 HB3 PRO 8 HB3 PRO 8 17.148 6.697 -3.720 64 HG2 PRO 8 HG2 PRO 8 15.819 8.049 -1.795 65 HG3 PRO 8 HG3 PRO 8 14.914 7.290 -3.153 66 HD2 PRO 8 HD2 PRO 8 15.321 6.237 -0.368 67 HD3 PRO 8 HD3 PRO 8 13.834 6.335 -1.333 68 H GLU 9 H GLU 9 18.728 4.948 -3.675 69 HA GLU 9 HA GLU 9 19.726 2.449 -2.495 70 HB2 GLU 9 HB2 GLU 9 20.498 3.150 -4.748 71 HB3 GLU 9 HB3 GLU 9 21.151 4.652 -4.044 72 HG2 GLU 9 HG2 GLU 9 22.747 3.411 -2.704 73 HG3 GLU 9 HG3 GLU 9 22.012 1.876 -3.130 74 H SER 10 H SER 10 21.249 2.433 -0.866 75 HA SER 10 HA SER 10 21.971 2.906 1.136 76 HB2 SER 10 HB2 SER 10 22.862 5.472 -0.217 77 HB3 SER 10 HB3 SER 10 23.515 4.841 1.307 78 HG SER 10 HG SER 10 24.788 4.223 -0.485 79 H SER 11 H SER 11 19.120 3.790 0.627 80 HA SER 11 HA SER 11 18.728 6.312 1.830 81 HB2 SER 11 HB2 SER 11 16.318 5.675 1.723 82 HB3 SER 11 HB3 SER 11 17.232 5.572 0.209 83 HG SER 11 HG SER 11 16.985 3.492 0.150 84 H ILE 12 H ILE 12 19.498 3.353 3.278 85 HA ILE 12 HA ILE 12 17.939 3.751 5.731 86 HB ILE 12 HB ILE 12 19.051 1.340 4.263 87 HG12 ILE 12 HG12 ILE 12 16.267 1.053 4.942 88 HG13 ILE 12 HG13 ILE 12 16.443 2.679 4.287 89 HG21 ILE 12 HG21 ILE 12 18.097 -0.054 5.998 90 HG22 ILE 12 HG22 ILE 12 19.409 0.960 6.608 91 HG23 ILE 12 HG23 ILE 12 17.726 1.396 6.982 92 HD11 ILE 12 HD13 ILE 12 15.939 1.187 2.495 93 HD12 ILE 12 HD11 ILE 12 17.642 1.691 2.327 94 HD13 ILE 12 HD12 ILE 12 17.244 0.077 2.968 95 H SER 13 H SER 13 19.120 3.975 7.633 96 HA SER 13 HA SER 13 22.034 3.441 7.661 97 HB2 SER 13 HB2 SER 13 20.691 6.052 8.514 98 HB3 SER 13 HB3 SER 13 22.415 5.670 8.653 99 HG SER 13 HG SER 13 21.948 6.947 6.811 100 H VAL 14 H VAL 14 22.901 3.310 9.819 101 HA VAL 14 HA VAL 14 20.970 3.092 12.057 102 HB VAL 14 HB VAL 14 23.257 1.200 11.402 103 HG11 VAL 14 HG11 VAL 14 23.095 1.465 13.837 104 HG12 VAL 14 HG12 VAL 14 21.337 1.205 13.780 105 HG13 VAL 14 HG13 VAL 14 22.461 -0.113 13.387 106 HG21 VAL 14 HG23 VAL 14 20.256 0.686 11.507 107 HG22 VAL 14 HG21 VAL 14 21.260 0.649 10.041 108 HG23 VAL 14 HG22 VAL 14 21.492 -0.561 11.302 109 H ILE 15 H ILE 15 21.815 3.883 13.966 110 HA ILE 15 HA ILE 15 24.460 5.220 14.004 111 HB ILE 15 HB ILE 15 21.645 6.366 14.051 112 HG12 ILE 15 HG12 ILE 15 24.230 6.984 12.597 113 HG13 ILE 15 HG13 ILE 15 22.668 6.496 11.936 114 HG21 ILE 15 HG21 ILE 15 22.386 8.461 15.037 115 HG22 ILE 15 HG22 ILE 15 22.517 7.124 16.129 116 HG23 ILE 15 HG23 ILE 15 23.999 7.760 15.339 117 HD11 ILE 15 HD13 ILE 15 23.029 8.832 11.457 118 HD12 ILE 15 HD11 ILE 15 21.739 8.736 12.678 119 HD13 ILE 15 HD12 ILE 15 23.391 9.200 13.153 120 H HIS 16 H HIS 16 25.208 5.516 16.215 121 HA HIS 16 HA HIS 16 23.940 3.759 18.175 122 HB2 HIS 16 HB2 HIS 16 26.421 4.154 18.046 123 HB3 HIS 16 HB3 HIS 16 26.152 5.803 18.627 124 HD1 HIS 16 HD1 HIS 16 25.311 2.177 19.801 125 HD2 HIS 16 HD2 HIS 16 26.156 6.048 21.256 126 HE1 HIS 16 HE1 HIS 16 25.454 1.981 22.342 127 H SER 17 H SER 17 24.287 7.332 17.700 128 HA SER 17 HA SER 17 21.758 7.852 18.958 129 HB2 SER 17 HB2 SER 17 22.887 9.527 20.578 130 HB3 SER 17 HB3 SER 17 22.838 7.827 21.050 131 HG SER 17 HG SER 17 24.890 8.789 21.404 132 H ALA 18 H ALA 18 21.105 10.000 18.321 133 HA ALA 18 HA ALA 18 22.791 11.280 16.240 134 HB1 ALA 18 HB3 ALA 18 20.002 11.957 17.263 135 HB2 ALA 18 HB1 ALA 18 20.857 12.817 15.968 136 HB3 ALA 18 HB2 ALA 18 20.399 11.128 15.728 137 H LYS 19 H LYS 19 23.216 13.606 16.497 138 HA LYS 19 HA LYS 19 24.469 14.246 18.940 139 HB2 LYS 19 HB2 LYS 19 24.782 15.181 16.521 140 HB3 LYS 19 HB3 LYS 19 23.442 16.231 16.894 141 HG2 LYS 19 HG2 LYS 19 25.400 17.508 17.312 142 HG3 LYS 19 HG3 LYS 19 24.687 17.136 18.878 143 HD2 LYS 19 HD2 LYS 19 27.114 16.939 18.957 144 HD3 LYS 19 HD3 LYS 19 26.381 15.356 19.240 145 HE2 LYS 19 HE2 LYS 19 26.804 14.728 16.875 146 HE3 LYS 19 HE3 LYS 19 27.467 16.334 16.556 147 HZ1 LYS 19 HZ3 LYS 19 29.250 15.839 18.130 148 HZ2 LYS 19 HZ1 LYS 19 28.636 14.353 18.430 149 HZ3 LYS 19 HZ2 LYS 19 29.214 14.717 16.951 150 H ASP 20 H ASP 20 21.291 15.182 17.655 151 HA ASP 20 HA ASP 20 20.005 15.235 20.177 152 HB2 ASP 20 HB2 ASP 20 19.387 17.439 20.424 153 HB3 ASP 20 HB3 ASP 20 21.125 17.593 20.127 154 H TRP 21 H TRP 21 17.618 16.342 19.576 155 HA TRP 21 HA TRP 21 16.671 14.722 17.493 156 HB2 TRP 21 HB2 TRP 21 14.497 15.756 17.868 157 HB3 TRP 21 HB3 TRP 21 15.265 15.223 19.353 158 HD1 TRP 21 HD1 TRP 21 15.722 17.032 21.191 159 HE1 TRP 21 HE1 TRP 21 15.239 19.521 21.444 160 HE3 TRP 21 HE3 TRP 21 14.110 18.009 16.426 161 HZ2 TRP 21 HZ2 TRP 21 14.398 21.723 19.738 162 HZ3 TRP 21 HZ3 TRP 21 13.508 20.324 15.762 163 HH2 TRP 21 HH2 TRP 21 13.709 22.179 17.394 164 H GLN 22 H GLN 22 17.681 18.176 17.352 165 HA GLN 22 HA GLN 22 16.563 18.820 14.749 166 HB2 GLN 22 HB2 GLN 22 19.094 19.788 16.088 167 HB3 GLN 22 HB3 GLN 22 18.378 20.448 14.629 168 HG2 GLN 22 HG2 GLN 22 16.422 21.217 15.772 169 HG3 GLN 22 HG3 GLN 22 16.796 20.281 17.222 170 HE21 GLN 22 HE22 GLN 22 18.837 20.789 18.366 171 HE22 GLN 22 HE21 GLN 22 19.311 22.489 18.492 172 H GLU 23 H GLU 23 19.808 17.498 15.791 173 HA GLU 23 HA GLU 23 20.727 16.958 13.176 174 HB2 GLU 23 HB2 GLU 23 22.010 16.933 15.413 175 HB3 GLU 23 HB3 GLU 23 21.353 15.299 15.640 176 HG2 GLU 23 HG2 GLU 23 23.401 14.819 14.699 177 HG3 GLU 23 HG3 GLU 23 22.407 14.827 13.270 178 H ALA 24 H ALA 24 18.739 14.988 15.367 179 HA ALA 24 HA ALA 24 18.854 12.590 13.853 180 HB1 ALA 24 HB3 ALA 24 16.614 13.544 15.669 181 HB2 ALA 24 HB1 ALA 24 17.008 11.866 15.240 182 HB3 ALA 24 HB2 ALA 24 18.138 12.834 16.215 183 H ILE 25 H ILE 25 16.842 15.523 13.432 184 HA ILE 25 HA ILE 25 15.114 14.326 11.432 185 HB ILE 25 HB ILE 25 15.899 17.248 11.681 186 HG12 ILE 25 HG12 ILE 25 14.417 15.710 13.609 187 HG13 ILE 25 HG13 ILE 25 14.874 17.406 13.619 188 HG21 ILE 25 HG21 ILE 25 14.841 16.556 9.537 189 HG22 ILE 25 HG22 ILE 25 13.441 15.967 10.426 190 HG23 ILE 25 HG23 ILE 25 13.891 17.698 10.434 191 HD11 ILE 25 HD13 ILE 25 12.510 17.201 13.953 192 HD12 ILE 25 HD11 ILE 25 12.758 17.904 12.348 193 HD13 ILE 25 HD12 ILE 25 12.345 16.174 12.515 194 H ASP 26 H ASP 26 18.169 16.269 11.330 195 HA ASP 26 HA ASP 26 18.457 16.302 8.518 196 HB2 ASP 26 HB2 ASP 26 19.866 17.668 9.967 197 HB3 ASP 26 HB3 ASP 26 20.620 16.230 10.654 198 H PHE 27 H PHE 27 19.686 13.901 10.907 199 HA PHE 27 HA PHE 27 20.676 12.089 8.971 200 HB2 PHE 27 HB2 PHE 27 19.829 11.817 11.869 201 HB3 PHE 27 HB3 PHE 27 20.282 10.408 10.930 202 HD1 PHE 27 HD1 PHE 27 22.515 10.889 9.380 203 HD2 PHE 27 HD2 PHE 27 21.709 12.581 13.300 204 HE1 PHE 27 HE1 PHE 27 24.936 11.154 9.782 205 HE2 PHE 27 HE2 PHE 27 24.124 12.768 13.683 206 HZ PHE 27 HZ PHE 27 25.751 12.084 11.941 207 H SER 28 H SER 28 17.298 12.554 10.149 208 HA SER 28 HA SER 28 16.290 10.120 9.015 209 HB2 SER 28 HB2 SER 28 14.832 12.762 9.553 210 HB3 SER 28 HB3 SER 28 14.077 11.242 9.148 211 HG SER 28 HG SER 28 15.757 11.759 11.399 212 H MET 29 H MET 29 17.057 13.291 7.607 213 HA MET 29 HA MET 29 15.639 12.462 5.119 214 HB2 MET 29 HB2 MET 29 16.491 15.221 5.929 215 HB3 MET 29 HB3 MET 29 15.340 14.754 4.680 216 HG2 MET 29 HG2 MET 29 14.971 15.308 7.516 217 HG3 MET 29 HG3 MET 29 13.899 15.561 6.171 218 HE1 MET 29 HE3 MET 29 11.934 12.088 6.162 219 HE2 MET 29 HE1 MET 29 12.244 13.568 5.222 220 HE3 MET 29 HE2 MET 29 13.452 12.248 5.262 221 H VAL 30 H VAL 30 18.907 13.062 6.240 222 HA VAL 30 HA VAL 30 19.943 14.413 4.100 223 HB VAL 30 HB VAL 30 21.141 14.026 6.187 224 HG11 VAL 30 HG11 VAL 30 20.630 11.605 6.529 225 HG12 VAL 30 HG12 VAL 30 21.731 11.201 5.195 226 HG13 VAL 30 HG13 VAL 30 22.355 11.965 6.672 227 HG21 VAL 30 HG23 VAL 30 22.792 13.053 3.829 228 HG22 VAL 30 HG21 VAL 30 22.392 14.746 4.180 229 HG23 VAL 30 HG22 VAL 30 23.387 13.819 5.317 230 H SER 31 H SER 31 19.261 10.871 4.122 231 HA SER 31 HA SER 31 20.842 10.333 1.813 232 HB2 SER 31 HB2 SER 31 19.160 8.337 1.713 233 HB3 SER 31 HB3 SER 31 20.301 8.461 3.062 234 HG SER 31 HG SER 31 18.276 8.031 3.895 235 H LEU 32 H LEU 32 17.514 11.513 2.294 236 HA LEU 32 HA LEU 32 16.785 11.341 -0.527 237 HB2 LEU 32 HB2 LEU 32 15.549 12.671 1.928 238 HB3 LEU 32 HB3 LEU 32 14.846 12.832 0.337 239 HG LEU 32 HG LEU 32 15.348 10.134 1.670 240 HD11 LEU 32 HD11 LEU 32 12.749 11.707 1.523 241 HD12 LEU 32 HD12 LEU 32 12.973 10.093 2.226 242 HD13 LEU 32 HD13 LEU 32 13.740 11.492 2.981 243 HD21 LEU 32 HD23 LEU 32 15.099 10.082 -0.839 244 HD22 LEU 32 HD21 LEU 32 13.813 9.244 0.009 245 HD23 LEU 32 HD22 LEU 32 13.512 10.857 -0.661 246 H LEU 33 H LEU 33 18.087 13.811 1.733 247 HA LEU 33 HA LEU 33 17.966 15.999 -0.017 248 HB2 LEU 33 HB2 LEU 33 18.494 16.087 2.404 249 HB3 LEU 33 HB3 LEU 33 20.062 15.358 2.074 250 HG LEU 33 HG LEU 33 20.716 17.344 0.730 251 HD11 LEU 33 HD11 LEU 33 18.514 18.126 -0.023 252 HD12 LEU 33 HD12 LEU 33 18.054 18.502 1.653 253 HD13 LEU 33 HD13 LEU 33 19.365 19.391 0.843 254 HD21 LEU 33 HD23 LEU 33 21.230 17.081 3.144 255 HD22 LEU 33 HD21 LEU 33 21.123 18.756 2.623 256 HD23 LEU 33 HD22 LEU 33 19.780 18.024 3.534 257 H ASP 34 H ASP 34 20.520 13.529 0.456 258 HA ASP 34 HA ASP 34 22.460 14.553 -1.295 259 HB2 ASP 34 HB2 ASP 34 22.838 12.775 0.413 260 HB3 ASP 34 HB3 ASP 34 21.834 11.664 -0.540 261 H LYS 35 H LYS 35 19.881 12.138 -1.922 262 HA LYS 35 HA LYS 35 20.516 11.959 -4.772 263 HB2 LYS 35 HB2 LYS 35 18.640 10.676 -2.783 264 HB3 LYS 35 HB3 LYS 35 18.184 10.689 -4.488 265 HG2 LYS 35 HG2 LYS 35 19.231 8.655 -3.899 266 HG3 LYS 35 HG3 LYS 35 20.058 9.548 -5.186 267 HD2 LYS 35 HD2 LYS 35 21.821 8.675 -4.028 268 HD3 LYS 35 HD3 LYS 35 21.703 10.292 -3.334 269 HE2 LYS 35 HE2 LYS 35 20.386 9.311 -1.431 270 HE3 LYS 35 HE3 LYS 35 20.602 7.697 -2.138 271 HZ1 LYS 35 HZ3 LYS 35 22.892 9.431 -1.403 272 HZ2 LYS 35 HZ1 LYS 35 22.266 8.281 -0.395 273 HZ3 LYS 35 HZ2 LYS 35 22.936 7.855 -1.824 274 H ASN 36 H ASN 36 19.467 14.517 -3.234 275 HA ASN 36 HA ASN 36 18.036 16.099 -3.401 276 HB2 ASN 36 HB2 ASN 36 17.842 17.297 -5.549 277 HB3 ASN 36 HB3 ASN 36 19.462 16.915 -5.010 278 HD21 ASN 36 HD22 ASN 36 20.568 15.130 -5.990 279 HD22 ASN 36 HD21 ASN 36 20.247 14.699 -7.663 280 H TYR 37 H TYR 37 16.535 13.959 -2.881 281 HA TYR 37 HA TYR 37 14.028 14.081 -4.452 282 HB2 TYR 37 HB2 TYR 37 14.902 12.767 -1.853 283 HB3 TYR 37 HB3 TYR 37 13.208 12.901 -2.262 284 HD1 TYR 37 HD1 TYR 37 16.441 11.336 -3.338 285 HD2 TYR 37 HD2 TYR 37 12.141 11.355 -3.694 286 HE1 TYR 37 HE1 TYR 37 16.536 9.281 -4.736 287 HE2 TYR 37 HE2 TYR 37 12.257 9.341 -5.133 288 HH TYR 37 HH TYR 37 13.622 7.765 -6.153 289 H ILE 38 H ILE 38 15.676 15.949 -2.052 290 HA ILE 38 HA ILE 38 13.360 17.712 -1.673 291 HB ILE 38 HB ILE 38 13.810 17.810 0.764 292 HG12 ILE 38 HG12 ILE 38 15.629 15.396 0.315 293 HG13 ILE 38 HG13 ILE 38 16.178 17.039 0.682 294 HG21 ILE 38 HG21 ILE 38 12.032 16.285 -0.147 295 HG22 ILE 38 HG22 ILE 38 13.177 14.936 -0.015 296 HG23 ILE 38 HG23 ILE 38 12.653 15.823 1.423 297 HD11 ILE 38 HD13 ILE 38 16.294 15.701 2.621 298 HD12 ILE 38 HD11 ILE 38 15.027 16.931 2.861 299 HD13 ILE 38 HD12 ILE 38 14.590 15.233 2.511 300 H SER 39 H SER 39 14.173 19.735 -0.488 301 HA SER 39 HA SER 39 17.020 20.422 -1.084 302 HB2 SER 39 HB2 SER 39 14.589 22.247 -0.805 303 HB3 SER 39 HB3 SER 39 16.243 22.750 -1.197 304 HG SER 39 HG SER 39 14.944 22.575 -3.058 305 H GLU 40 H GLU 40 17.958 21.982 0.571 306 HA GLU 40 HA GLU 40 17.912 20.722 3.072 307 HB2 GLU 40 HB2 GLU 40 18.946 23.489 2.345 308 HB3 GLU 40 HB3 GLU 40 19.348 22.590 3.817 309 HG2 GLU 40 HG2 GLU 40 20.332 20.770 2.426 310 HG3 GLU 40 HG3 GLU 40 19.998 21.699 0.971 311 H ASN 41 H ASN 41 16.067 23.600 2.074 312 HA ASN 41 HA ASN 41 15.210 24.466 4.647 313 HB2 ASN 41 HB2 ASN 41 14.798 25.739 2.553 314 HB3 ASN 41 HB3 ASN 41 13.689 24.483 1.990 315 HD21 ASN 41 HD22 ASN 41 11.517 24.408 2.870 316 HD22 ASN 41 HD21 ASN 41 10.946 25.659 3.950 317 H TYR 42 H TYR 42 14.187 21.673 2.717 318 HA TYR 42 HA TYR 42 11.647 21.225 3.884 319 HB2 TYR 42 HB2 TYR 42 12.634 20.160 1.814 320 HB3 TYR 42 HB3 TYR 42 13.662 19.183 2.860 321 HD1 TYR 42 HD2 TYR 42 10.148 19.936 1.954 322 HD2 TYR 42 HD1 TYR 42 12.822 17.216 3.963 323 HE1 TYR 42 HE2 TYR 42 8.343 18.243 2.041 324 HE2 TYR 42 HE1 TYR 42 11.018 15.522 4.077 325 HH TYR 42 HH TYR 42 7.721 16.198 2.872 326 H ILE 43 H ILE 43 14.919 20.041 4.782 327 HA ILE 43 HA ILE 43 14.170 18.480 7.031 328 HB ILE 43 HB ILE 43 16.737 20.027 6.394 329 HG12 ILE 43 HG12 ILE 43 17.334 17.355 6.143 330 HG13 ILE 43 HG13 ILE 43 15.652 17.357 5.605 331 HG21 ILE 43 HG21 ILE 43 16.347 17.812 8.450 332 HG22 ILE 43 HG22 ILE 43 17.873 18.620 8.026 333 HG23 ILE 43 HG23 ILE 43 16.592 19.533 8.824 334 HD11 ILE 43 HD13 ILE 43 17.272 17.611 3.762 335 HD12 ILE 43 HD11 ILE 43 16.225 19.040 3.876 336 HD13 ILE 43 HD12 ILE 43 17.894 19.090 4.507 337 H GLN 44 H GLN 44 15.043 21.987 6.776 338 HA GLN 44 HA GLN 44 14.742 22.313 9.591 339 HB2 GLN 44 HB2 GLN 44 16.123 23.750 7.919 340 HB3 GLN 44 HB3 GLN 44 14.624 24.626 7.645 341 HG2 GLN 44 HG2 GLN 44 15.980 25.746 9.377 342 HG3 GLN 44 HG3 GLN 44 14.503 25.134 10.104 343 HE21 GLN 44 HE22 GLN 44 14.930 24.280 12.177 344 HE22 GLN 44 HE21 GLN 44 16.302 23.274 12.570 345 H ALA 45 H ALA 45 12.359 22.482 6.988 346 HA ALA 45 HA ALA 45 10.318 23.774 8.484 347 HB1 ALA 45 HB3 ALA 45 10.202 23.364 6.034 348 HB2 ALA 45 HB1 ALA 45 9.999 21.620 6.347 349 HB3 ALA 45 HB2 ALA 45 8.766 22.762 6.890 350 H ILE 46 H ILE 46 11.357 20.319 8.380 351 HA ILE 46 HA ILE 46 9.171 19.365 10.006 352 HB ILE 46 HB ILE 46 11.965 18.211 9.708 353 HG12 ILE 46 HG12 ILE 46 9.542 17.519 8.041 354 HG13 ILE 46 HG13 ILE 46 10.861 18.515 7.479 355 HG21 ILE 46 HG21 ILE 46 9.346 16.793 10.385 356 HG22 ILE 46 HG22 ILE 46 10.981 16.102 10.430 357 HG23 ILE 46 HG23 ILE 46 10.517 17.334 11.603 358 HD11 ILE 46 HD13 ILE 46 12.448 16.638 7.798 359 HD12 ILE 46 HD11 ILE 46 11.076 15.585 8.215 360 HD13 ILE 46 HD12 ILE 46 11.174 16.308 6.605 361 H LYS 47 H LYS 47 12.562 20.429 10.667 362 HA LYS 47 HA LYS 47 12.439 19.964 13.457 363 HB2 LYS 47 HB2 LYS 47 13.991 22.010 11.826 364 HB3 LYS 47 HB3 LYS 47 14.296 21.731 13.540 365 HG2 LYS 47 HG2 LYS 47 15.161 19.536 13.144 366 HG3 LYS 47 HG3 LYS 47 14.609 19.532 11.453 367 HD2 LYS 47 HD2 LYS 47 16.091 21.351 10.906 368 HD3 LYS 47 HD3 LYS 47 16.632 21.483 12.601 369 HE2 LYS 47 HE2 LYS 47 17.787 19.400 12.441 370 HE3 LYS 47 HE3 LYS 47 17.157 19.084 10.821 371 HZ1 LYS 47 HZ3 LYS 47 18.398 21.105 10.093 372 HZ2 LYS 47 HZ1 LYS 47 18.990 21.306 11.592 373 HZ3 LYS 47 HZ2 LYS 47 19.411 19.992 10.734 374 H ASP 48 H ASP 48 11.621 22.917 11.540 375 HA ASP 48 HA ASP 48 10.994 24.598 13.721 376 HB2 ASP 48 HB2 ASP 48 11.364 25.450 11.477 377 HB3 ASP 48 HB3 ASP 48 9.970 24.556 10.862 378 H SER 49 H SER 49 8.938 22.284 11.894 379 HA SER 49 HA SER 49 6.501 22.881 13.276 380 HB2 SER 49 HB2 SER 49 7.438 20.254 12.055 381 HB3 SER 49 HB3 SER 49 5.766 20.706 12.435 382 HG SER 49 HG SER 49 7.520 21.846 10.501 383 H THR 50 H THR 50 9.194 20.614 13.962 384 HA THR 50 HA THR 50 8.135 19.517 16.330 385 HB THR 50 HB THR 50 11.056 19.867 15.584 386 HG1 THR 50 HG1 THR 50 9.947 18.822 13.932 387 HG21 THR 50 HG23 THR 50 9.668 17.837 17.376 388 HG22 THR 50 HG21 THR 50 11.378 17.807 16.883 389 HG23 THR 50 HG22 THR 50 10.781 19.124 17.899 390 H ILE 51 H ILE 51 10.056 22.552 15.861 391 HA ILE 51 HA ILE 51 10.192 23.205 18.649 392 HB ILE 51 HB ILE 51 10.207 24.963 16.154 393 HG12 ILE 51 HG12 ILE 51 12.473 24.101 18.000 394 HG13 ILE 51 HG13 ILE 51 12.088 23.334 16.462 395 HG21 ILE 51 HG21 ILE 51 10.858 25.791 19.015 396 HG22 ILE 51 HG22 ILE 51 11.102 26.788 17.564 397 HG23 ILE 51 HG23 ILE 51 9.477 26.360 18.047 398 HD11 ILE 51 HD13 ILE 51 13.121 26.158 16.837 399 HD12 ILE 51 HD11 ILE 51 13.928 24.784 16.073 400 HD13 ILE 51 HD12 ILE 51 12.513 25.513 15.292 401 H ASN 52 H ASN 52 7.749 23.906 16.125 402 HA ASN 52 HA ASN 52 6.275 25.811 17.594 403 HB2 ASN 52 HB2 ASN 52 5.765 24.099 15.162 404 HB3 ASN 52 HB3 ASN 52 4.374 24.818 15.927 405 HD21 ASN 52 HD22 ASN 52 7.543 25.672 14.470 406 HD22 ASN 52 HD21 ASN 52 7.089 27.309 14.066 407 H ASN 53 H ASN 53 5.846 22.285 17.402 408 HA ASN 53 HA ASN 53 3.692 22.445 19.489 409 HB2 ASN 53 HB2 ASN 53 2.328 22.324 17.678 410 HB3 ASN 53 HB3 ASN 53 3.586 21.748 16.602 411 HD21 ASN 53 HD22 ASN 53 4.193 19.431 16.665 412 HD22 ASN 53 HD21 ASN 53 2.920 18.286 17.013 413 H GLY 54 H GLY 54 6.577 20.876 18.510 414 HA2 GLY 54 HA2 GLY 54 7.606 19.120 19.766 415 HA3 GLY 54 HA3 GLY 54 6.010 18.484 20.204 416 HA PRO 55 HA PRO 55 7.694 16.503 16.222 417 HB2 PRO 55 HB2 PRO 55 7.426 13.870 16.947 418 HB3 PRO 55 HB3 PRO 55 8.888 14.838 17.271 419 HG2 PRO 55 HG2 PRO 55 6.584 14.272 19.166 420 HG3 PRO 55 HG3 PRO 55 8.336 14.132 19.497 421 HD2 PRO 55 HD2 PRO 55 6.916 16.334 20.214 422 HD3 PRO 55 HD3 PRO 55 8.589 16.499 19.596 423 H TYR 56 H TYR 56 6.279 15.936 14.607 424 HA TYR 56 HA TYR 56 3.421 15.614 15.387 425 HB2 TYR 56 HB2 TYR 56 2.750 17.291 14.006 426 HB3 TYR 56 HB3 TYR 56 4.180 17.946 14.763 427 HD1 TYR 56 HD2 TYR 56 6.486 17.288 13.210 428 HD2 TYR 56 HD1 TYR 56 2.449 18.009 11.843 429 HE1 TYR 56 HE2 TYR 56 7.351 17.914 10.995 430 HE2 TYR 56 HE1 TYR 56 3.323 18.714 9.641 431 HH TYR 56 HH TYR 56 6.809 18.582 8.838 432 H TYR 57 H TYR 57 5.681 13.791 14.174 433 HA TYR 57 HA TYR 57 3.745 12.244 12.579 434 HB2 TYR 57 HB2 TYR 57 6.564 12.912 11.694 435 HB3 TYR 57 HB3 TYR 57 5.726 11.429 11.237 436 HD1 TYR 57 HD1 TYR 57 3.560 11.481 10.011 437 HD2 TYR 57 HD2 TYR 57 6.045 14.974 10.489 438 HE1 TYR 57 HE1 TYR 57 2.241 12.647 8.262 439 HE2 TYR 57 HE2 TYR 57 4.779 16.122 8.700 440 HH TYR 57 HH TYR 57 1.898 14.678 7.134 441 H ILE 58 H ILE 58 3.370 11.021 14.382 442 HA ILE 58 HA ILE 58 5.559 9.408 15.545 443 HB ILE 58 HB ILE 58 3.575 11.153 17.076 444 HG12 ILE 58 HG12 ILE 58 5.591 12.377 16.576 445 HG13 ILE 58 HG13 ILE 58 5.525 12.007 18.289 446 HG21 ILE 58 HG21 ILE 58 3.465 9.016 18.155 447 HG22 ILE 58 HG22 ILE 58 5.222 8.814 18.120 448 HG23 ILE 58 HG23 ILE 58 4.454 10.058 19.156 449 HD11 ILE 58 HD13 ILE 58 7.322 10.750 16.191 450 HD12 ILE 58 HD11 ILE 58 7.796 11.674 17.616 451 HD13 ILE 58 HD12 ILE 58 7.138 10.041 17.797 452 H LEU 59 H LEU 59 4.883 7.349 15.708 453 HA LEU 59 HA LEU 59 1.998 6.786 15.140 454 HB2 LEU 59 HB2 LEU 59 4.469 5.373 14.068 455 HB3 LEU 59 HB3 LEU 59 2.823 4.817 13.879 456 HG LEU 59 HG LEU 59 3.396 5.780 11.826 457 HD11 LEU 59 HD11 LEU 59 1.797 7.493 11.432 458 HD12 LEU 59 HD12 LEU 59 1.132 6.346 12.604 459 HD13 LEU 59 HD13 LEU 59 1.734 7.928 13.146 460 HD21 LEU 59 HD23 LEU 59 4.274 7.941 11.399 461 HD22 LEU 59 HD21 LEU 59 4.261 8.402 13.076 462 HD23 LEU 59 HD22 LEU 59 5.372 7.132 12.522 463 H ALA 60 H ALA 60 4.829 6.020 17.083 464 HA ALA 60 HA ALA 60 3.113 4.742 18.981 465 HB1 ALA 60 HB3 ALA 60 4.369 2.616 19.155 466 HB2 ALA 60 HB1 ALA 60 3.699 2.765 17.529 467 HB3 ALA 60 HB2 ALA 60 5.420 3.099 17.822 468 HA PRO 61 HA PRO 61 6.303 6.471 21.703 469 HB2 PRO 61 HB2 PRO 61 6.520 3.683 22.868 470 HB3 PRO 61 HB3 PRO 61 6.494 5.256 23.724 471 HG2 PRO 61 HG2 PRO 61 4.245 3.765 23.597 472 HG3 PRO 61 HG3 PRO 61 4.145 5.527 23.271 473 HD2 PRO 61 HD2 PRO 61 4.249 3.248 21.286 474 HD3 PRO 61 HD3 PRO 61 3.199 4.698 21.278 475 H GLY 62 H GLY 62 8.408 6.847 21.131 476 HA2 GLY 62 HA2 GLY 62 10.549 6.477 20.491 477 HA3 GLY 62 HA3 GLY 62 10.293 4.738 20.601 478 H VAL 63 H VAL 63 7.951 5.927 18.392 479 HA VAL 63 HA VAL 63 9.751 5.382 16.072 480 HB VAL 63 HB VAL 63 7.060 4.137 16.730 481 HG11 VAL 63 HG11 VAL 63 7.048 4.648 14.351 482 HG12 VAL 63 HG12 VAL 63 8.647 3.903 14.137 483 HG13 VAL 63 HG13 VAL 63 7.225 2.913 14.548 484 HG21 VAL 63 HG23 VAL 63 9.848 2.965 16.313 485 HG22 VAL 63 HG21 VAL 63 8.920 2.996 17.828 486 HG23 VAL 63 HG22 VAL 63 8.371 2.004 16.479 487 H ALA 64 H ALA 64 9.751 7.003 14.738 488 HA ALA 64 HA ALA 64 7.422 8.851 14.561 489 HB1 ALA 64 HB3 ALA 64 9.449 9.807 15.710 490 HB2 ALA 64 HB1 ALA 64 10.396 9.468 14.244 491 HB3 ALA 64 HB2 ALA 64 9.060 10.638 14.195 492 H MET 65 H MET 65 7.324 9.994 12.445 493 HA MET 65 HA MET 65 8.575 8.494 10.262 494 HB2 MET 65 HB2 MET 65 6.364 7.549 10.529 495 HB3 MET 65 HB3 MET 65 5.669 9.142 10.131 496 HG2 MET 65 HG2 MET 65 7.470 8.690 8.058 497 HG3 MET 65 HG3 MET 65 6.929 7.060 8.425 498 HE1 MET 65 HE3 MET 65 3.727 7.853 9.320 499 HE2 MET 65 HE1 MET 65 3.041 7.391 7.750 500 HE3 MET 65 HE2 MET 65 4.337 6.401 8.469 501 HA PRO 66 HA PRO 66 8.717 13.192 10.235 502 HB2 PRO 66 HB2 PRO 66 11.385 13.518 9.411 503 HB3 PRO 66 HB3 PRO 66 10.785 13.493 11.097 504 HG2 PRO 66 HG2 PRO 66 11.904 11.200 9.470 505 HG3 PRO 66 HG3 PRO 66 12.288 11.672 11.163 506 HD2 PRO 66 HD2 PRO 66 10.567 9.656 10.641 507 HD3 PRO 66 HD3 PRO 66 10.194 10.831 11.937 508 H HIS 67 H HIS 67 8.826 14.660 8.620 509 HA HIS 67 HA HIS 67 8.974 14.435 5.838 510 HB2 HIS 67 HB2 HIS 67 7.377 12.625 5.818 511 HB3 HIS 67 HB3 HIS 67 6.421 13.349 7.095 512 HD1 HIS 67 HD1 HIS 67 4.485 14.993 6.405 513 HD2 HIS 67 HD2 HIS 67 6.924 13.703 3.217 514 HE1 HIS 67 HE1 HIS 67 3.322 15.681 4.266 515 H ALA 68 H ALA 68 7.854 16.290 4.887 516 HA ALA 68 HA ALA 68 6.320 18.103 6.584 517 HB1 ALA 68 HB3 ALA 68 7.581 20.088 5.685 518 HB2 ALA 68 HB1 ALA 68 8.533 19.128 6.813 519 HB3 ALA 68 HB2 ALA 68 8.823 18.984 5.064 520 H ARG 69 H ARG 69 5.113 19.636 5.240 521 HA ARG 69 HA ARG 69 3.740 18.317 3.181 522 HB2 ARG 69 HB2 ARG 69 4.078 21.275 3.805 523 HB3 ARG 69 HB3 ARG 69 2.964 20.675 2.562 524 HG2 ARG 69 HG2 ARG 69 1.756 19.343 4.271 525 HG3 ARG 69 HG3 ARG 69 2.846 19.967 5.528 526 HD2 ARG 69 HD2 ARG 69 2.113 22.278 5.018 527 HD3 ARG 69 HD3 ARG 69 1.018 21.654 3.765 528 HE ARG 69 HE ARG 69 0.456 20.337 6.219 529 HH11 ARG 69 HH11 ARG 69 0.105 23.554 4.757 530 HH12 ARG 69 HH12 ARG 69 -1.264 23.995 5.707 531 HH21 ARG 69 HH21 ARG 69 -1.373 20.922 7.487 532 HH22 ARG 69 HH22 ARG 69 -2.120 22.460 7.293 533 HA PRO 70 HA PRO 70 6.435 18.171 -0.256 534 HB2 PRO 70 HB2 PRO 70 4.076 19.341 -1.820 535 HB3 PRO 70 HB3 PRO 70 5.179 18.039 -2.322 536 HG2 PRO 70 HG2 PRO 70 2.753 17.440 -1.277 537 HG3 PRO 70 HG3 PRO 70 4.185 16.517 -0.720 538 HD2 PRO 70 HD2 PRO 70 2.738 18.756 0.677 539 HD3 PRO 70 HD3 PRO 70 3.493 17.278 1.349 540 H GLU 71 H GLU 71 4.422 21.165 -0.154 541 HA GLU 71 HA GLU 71 6.027 22.821 -1.743 542 HB2 GLU 71 HB2 GLU 71 4.697 24.643 -0.830 543 HB3 GLU 71 HB3 GLU 71 3.682 23.249 -1.188 544 HG2 GLU 71 HG2 GLU 71 3.683 22.632 1.233 545 HG3 GLU 71 HG3 GLU 71 4.688 24.036 1.589 546 H CYS 72 H CYS 72 6.867 21.641 1.374 547 HA CYS 72 HA CYS 72 8.345 24.008 2.255 548 HB2 CYS 72 HB2 CYS 72 8.309 21.126 3.266 549 HB3 CYS 72 HB3 CYS 72 9.146 22.480 4.039 550 HG CYS 72 HG CYS 72 7.029 23.987 4.378 551 H GLY 73 H GLY 73 8.910 21.707 -0.164 552 HA2 GLY 73 HA2 GLY 73 11.017 22.388 -1.359 553 HA3 GLY 73 HA3 GLY 73 11.886 21.977 0.121 554 H ALA 74 H ALA 74 9.143 19.897 -0.808 555 HA ALA 74 HA ALA 74 10.989 17.675 -1.318 556 HB1 ALA 74 HB3 ALA 74 8.009 17.832 -1.774 557 HB2 ALA 74 HB1 ALA 74 9.013 16.374 -1.806 558 HB3 ALA 74 HB2 ALA 74 8.785 17.226 -0.275 559 H LEU 75 H LEU 75 11.364 16.738 -3.311 560 HA LEU 75 HA LEU 75 10.751 18.386 -5.733 561 HB2 LEU 75 HB2 LEU 75 13.319 16.888 -5.083 562 HB3 LEU 75 HB3 LEU 75 12.999 17.811 -6.540 563 HG LEU 75 HG LEU 75 13.207 18.994 -3.734 564 HD11 LEU 75 HD11 LEU 75 15.181 18.978 -6.062 565 HD12 LEU 75 HD12 LEU 75 15.382 19.871 -4.539 566 HD13 LEU 75 HD13 LEU 75 15.349 18.107 -4.523 567 HD21 LEU 75 HD23 LEU 75 11.777 20.383 -5.196 568 HD22 LEU 75 HD21 LEU 75 13.329 21.172 -4.915 569 HD23 LEU 75 HD22 LEU 75 13.020 20.358 -6.466 570 H LYS 76 H LYS 76 11.339 15.155 -4.347 571 HA LYS 76 HA LYS 76 9.913 13.910 -6.598 572 HB2 LYS 76 HB2 LYS 76 12.514 12.940 -5.384 573 HB3 LYS 76 HB3 LYS 76 11.601 12.091 -6.632 574 HG2 LYS 76 HG2 LYS 76 12.174 13.860 -8.254 575 HG3 LYS 76 HG3 LYS 76 12.960 14.805 -6.968 576 HD2 LYS 76 HD2 LYS 76 14.579 12.943 -6.587 577 HD3 LYS 76 HD3 LYS 76 13.838 12.048 -7.912 578 HE2 LYS 76 HE2 LYS 76 15.918 13.140 -8.596 579 HE3 LYS 76 HE3 LYS 76 14.548 13.744 -9.531 580 HZ1 LYS 76 HZ3 LYS 76 16.239 15.406 -8.582 581 HZ2 LYS 76 HZ1 LYS 76 14.651 15.783 -8.410 582 HZ3 LYS 76 HZ2 LYS 76 15.532 15.200 -7.147 583 H THR 77 H THR 77 8.987 11.748 -5.879 584 HA THR 77 HA THR 77 8.447 11.744 -3.043 585 HB THR 77 HB THR 77 7.392 10.238 -5.454 586 HG1 THR 77 HG1 THR 77 6.000 11.768 -5.582 587 HG21 THR 77 HG23 THR 77 7.085 8.920 -3.391 588 HG22 THR 77 HG21 THR 77 6.322 10.328 -2.605 589 HG23 THR 77 HG22 THR 77 5.548 9.528 -4.004 590 H GLY 78 H GLY 78 9.451 10.416 -1.585 591 HA2 GLY 78 HA2 GLY 78 10.421 7.804 -2.195 592 HA3 GLY 78 HA3 GLY 78 11.760 8.964 -2.160 593 H MET 79 H MET 79 12.057 7.189 -0.288 594 HA MET 79 HA MET 79 11.181 8.365 2.295 595 HB2 MET 79 HB2 MET 79 10.937 5.484 1.327 596 HB3 MET 79 HB3 MET 79 10.821 5.939 3.026 597 HG2 MET 79 HG2 MET 79 8.851 7.263 2.648 598 HG3 MET 79 HG3 MET 79 8.979 7.062 0.898 599 HE1 MET 79 HE3 MET 79 6.771 6.250 0.427 600 HE2 MET 79 HE1 MET 79 5.966 4.815 1.094 601 HE3 MET 79 HE2 MET 79 6.133 6.283 2.084 602 H SER 80 H SER 80 12.408 7.307 4.122 603 HA SER 80 HA SER 80 15.044 6.200 3.468 604 HB2 SER 80 HB2 SER 80 16.053 8.017 5.025 605 HB3 SER 80 HB3 SER 80 15.708 8.447 3.345 606 HG SER 80 HG SER 80 14.919 9.763 5.384 607 H LEU 81 H LEU 81 16.154 5.574 5.592 608 HA LEU 81 HA LEU 81 14.213 5.122 7.776 609 HB2 LEU 81 HB2 LEU 81 14.318 3.229 6.032 610 HB3 LEU 81 HB3 LEU 81 15.972 2.953 6.534 611 HG LEU 81 HG LEU 81 15.351 2.070 8.613 612 HD11 LEU 81 HD11 LEU 81 12.900 2.185 9.382 613 HD12 LEU 81 HD12 LEU 81 13.887 3.646 9.570 614 HD13 LEU 81 HD13 LEU 81 12.771 3.508 8.200 615 HD21 LEU 81 HD23 LEU 81 13.017 1.359 6.801 616 HD22 LEU 81 HD21 LEU 81 14.646 0.747 6.507 617 HD23 LEU 81 HD22 LEU 81 13.790 0.304 8.004 618 H THR 82 H THR 82 15.123 5.673 9.690 619 HA THR 82 HA THR 82 18.074 5.371 9.989 620 HB THR 82 HB THR 82 16.269 7.642 10.960 621 HG1 THR 82 HG1 THR 82 16.698 7.670 8.710 622 HG21 THR 82 HG23 THR 82 18.129 7.269 12.476 623 HG22 THR 82 HG21 THR 82 19.293 7.283 11.129 624 HG23 THR 82 HG22 THR 82 18.391 8.760 11.562 625 H LEU 83 H LEU 83 18.632 4.316 11.847 626 HA LEU 83 HA LEU 83 16.629 4.075 14.029 627 HB2 LEU 83 HB2 LEU 83 16.862 1.901 12.749 628 HB3 LEU 83 HB3 LEU 83 18.593 1.948 13.108 629 HG LEU 83 HG LEU 83 17.862 2.029 15.617 630 HD11 LEU 83 HD11 LEU 83 15.751 1.069 16.201 631 HD12 LEU 83 HD12 LEU 83 15.420 2.437 15.144 632 HD13 LEU 83 HD13 LEU 83 15.312 0.773 14.505 633 HD21 LEU 83 HD23 LEU 83 18.973 0.104 14.602 634 HD22 LEU 83 HD21 LEU 83 17.693 -0.436 15.702 635 HD23 LEU 83 HD22 LEU 83 17.422 -0.460 13.949 636 H LEU 84 H LEU 84 17.487 4.439 16.008 637 HA LEU 84 HA LEU 84 20.382 5.126 16.313 638 HB2 LEU 84 HB2 LEU 84 17.842 6.357 17.404 639 HB3 LEU 84 HB3 LEU 84 19.373 6.483 18.276 640 HG LEU 84 HG LEU 84 20.383 7.803 16.582 641 HD11 LEU 84 HD11 LEU 84 17.829 7.452 14.969 642 HD12 LEU 84 HD12 LEU 84 19.093 8.659 14.621 643 HD13 LEU 84 HD13 LEU 84 19.474 6.944 14.514 644 HD21 LEU 84 HD23 LEU 84 19.030 8.902 18.271 645 HD22 LEU 84 HD21 LEU 84 18.855 9.777 16.739 646 HD23 LEU 84 HD22 LEU 84 17.559 8.709 17.288 647 H GLU 85 H GLU 85 21.291 3.572 17.688 648 HA GLU 85 HA GLU 85 19.780 1.570 18.969 649 HB2 GLU 85 HB2 GLU 85 22.577 2.575 19.638 650 HB3 GLU 85 HB3 GLU 85 21.857 1.091 20.267 651 HG2 GLU 85 HG2 GLU 85 21.584 0.260 17.915 652 HG3 GLU 85 HG3 GLU 85 22.473 1.673 17.343 653 H GLN 86 H GLN 86 21.018 4.623 20.255 654 HA GLN 86 HA GLN 86 19.926 4.138 22.952 655 HB2 GLN 86 HB2 GLN 86 21.281 6.540 21.677 656 HB3 GLN 86 HB3 GLN 86 20.882 6.436 23.375 657 HG2 GLN 86 HG2 GLN 86 22.729 4.431 22.007 658 HG3 GLN 86 HG3 GLN 86 23.297 5.926 22.740 659 HE21 GLN 86 HE22 GLN 86 24.582 4.057 23.825 660 HE22 GLN 86 HE21 GLN 86 23.938 3.498 25.362 661 H GLY 87 H GLY 87 18.819 5.490 19.976 662 HA2 GLY 87 HA2 GLY 87 17.123 6.880 19.363 663 HA3 GLY 87 HA3 GLY 87 16.416 6.701 20.976 664 H VAL 88 H VAL 88 16.096 9.174 20.037 665 HA VAL 88 HA VAL 88 17.729 10.630 21.941 666 HB VAL 88 HB VAL 88 18.674 10.853 19.435 667 HG11 VAL 88 HG11 VAL 88 16.601 13.063 19.501 668 HG12 VAL 88 HG12 VAL 88 17.914 12.856 18.340 669 HG13 VAL 88 HG13 VAL 88 16.613 11.642 18.424 670 HG21 VAL 88 HG23 VAL 88 19.711 12.907 20.062 671 HG22 VAL 88 HG21 VAL 88 18.512 13.178 21.352 672 HG23 VAL 88 HG22 VAL 88 19.646 11.800 21.436 673 H TYR 89 H TYR 89 16.531 12.777 22.445 674 HA TYR 89 HA TYR 89 13.714 11.867 22.473 675 HB2 TYR 89 HB2 TYR 89 15.029 11.886 24.611 676 HB3 TYR 89 HB3 TYR 89 14.890 13.637 24.583 677 HD1 TYR 89 HD1 TYR 89 11.814 12.371 23.132 678 HD2 TYR 89 HD2 TYR 89 13.913 12.738 26.914 679 HE1 TYR 89 HE1 TYR 89 9.731 12.141 24.304 680 HE2 TYR 89 HE2 TYR 89 11.754 12.507 28.105 681 HH TYR 89 HH TYR 89 8.642 12.088 26.320 682 H PHE 90 H PHE 90 12.737 12.771 20.875 683 HA PHE 90 HA PHE 90 12.836 15.550 20.107 684 HB2 PHE 90 HB2 PHE 90 10.963 13.201 19.650 685 HB3 PHE 90 HB3 PHE 90 10.577 14.818 19.074 686 HD1 PHE 90 HD2 PHE 90 13.524 12.402 18.890 687 HD2 PHE 90 HD1 PHE 90 11.108 15.381 16.893 688 HE1 PHE 90 HE2 PHE 90 14.841 12.102 16.830 689 HE2 PHE 90 HE1 PHE 90 12.406 15.028 14.827 690 HZ PHE 90 HZ PHE 90 14.296 13.421 14.788 691 HA PRO 91 HA PRO 91 10.566 16.946 23.582 692 HB2 PRO 91 HB2 PRO 91 9.804 19.467 22.860 693 HB3 PRO 91 HB3 PRO 91 11.507 18.968 23.019 694 HG2 PRO 91 HG2 PRO 91 9.855 19.054 20.469 695 HG3 PRO 91 HG3 PRO 91 11.462 19.797 20.769 696 HD2 PRO 91 HD2 PRO 91 11.228 17.358 19.586 697 HD3 PRO 91 HD3 PRO 91 12.538 17.702 20.753 698 H GLY 92 H GLY 92 8.933 15.088 23.080 699 HA2 GLY 92 HA2 GLY 92 6.526 15.897 24.029 700 HA3 GLY 92 HA3 GLY 92 6.241 15.992 22.293 701 H ASN 93 H ASN 93 8.280 13.400 22.356 702 HA ASN 93 HA ASN 93 6.071 11.509 22.181 703 HB2 ASN 93 HB2 ASN 93 8.279 11.428 20.869 704 HB3 ASN 93 HB3 ASN 93 9.022 10.811 22.340 705 HD21 ASN 93 HD22 ASN 93 6.616 10.143 19.792 706 HD22 ASN 93 HD21 ASN 93 6.487 8.430 20.102 707 H ASP 94 H ASP 94 6.265 9.337 23.485 708 HA ASP 94 HA ASP 94 6.256 9.905 26.334 709 HB2 ASP 94 HB2 ASP 94 4.742 8.234 25.342 710 HB3 ASP 94 HB3 ASP 94 6.130 7.296 24.786 711 H GLU 95 H GLU 95 8.540 8.518 23.989 712 HA GLU 95 HA GLU 95 10.680 8.597 25.992 713 HB2 GLU 95 HB2 GLU 95 11.103 6.305 25.915 714 HB3 GLU 95 HB3 GLU 95 9.343 6.383 25.890 715 HG2 GLU 95 HG2 GLU 95 9.329 6.025 23.453 716 HG3 GLU 95 HG3 GLU 95 11.096 5.941 23.456 717 HA PRO 96 HA PRO 96 13.462 9.755 22.766 718 HB2 PRO 96 HB2 PRO 96 15.027 7.201 23.170 719 HB3 PRO 96 HB3 PRO 96 15.630 8.881 23.049 720 HG2 PRO 96 HG2 PRO 96 15.409 7.694 25.469 721 HG3 PRO 96 HG3 PRO 96 14.874 9.393 25.257 722 HD2 PRO 96 HD2 PRO 96 13.185 6.881 25.278 723 HD3 PRO 96 HD3 PRO 96 12.897 8.440 26.115 724 H ILE 97 H ILE 97 13.356 9.629 20.562 725 HA ILE 97 HA ILE 97 11.895 7.460 19.286 726 HB ILE 97 HB ILE 97 13.388 9.800 18.045 727 HG12 ILE 97 HG12 ILE 97 11.688 10.777 19.396 728 HG13 ILE 97 HG13 ILE 97 11.104 10.793 17.742 729 HG21 ILE 97 HG21 ILE 97 11.969 9.308 16.075 730 HG22 ILE 97 HG22 ILE 97 13.032 7.949 16.451 731 HG23 ILE 97 HG23 ILE 97 11.320 7.871 16.885 732 HD11 ILE 97 HD13 ILE 97 9.284 10.210 19.170 733 HD12 ILE 97 HD11 ILE 97 9.709 8.726 18.310 734 HD13 ILE 97 HD12 ILE 97 10.208 8.958 20.010 735 H LYS 98 H LYS 98 12.862 5.561 18.993 736 HA LYS 98 HA LYS 98 15.786 5.411 18.480 737 HB2 LYS 98 HB2 LYS 98 13.625 3.324 18.885 738 HB3 LYS 98 HB3 LYS 98 15.223 2.949 18.210 739 HG2 LYS 98 HG2 LYS 98 16.311 3.862 20.247 740 HG3 LYS 98 HG3 LYS 98 14.723 4.195 20.944 741 HD2 LYS 98 HD2 LYS 98 15.716 2.120 21.833 742 HD3 LYS 98 HD3 LYS 98 14.190 1.812 20.993 743 HE2 LYS 98 HE2 LYS 98 15.427 1.038 18.994 744 HE3 LYS 98 HE3 LYS 98 16.967 1.405 19.776 745 HZ1 LYS 98 HZ3 LYS 98 15.041 -0.550 20.891 746 HZ2 LYS 98 HZ1 LYS 98 16.197 -0.977 19.829 747 HZ3 LYS 98 HZ2 LYS 98 16.614 -0.360 21.297 748 H LEU 99 H LEU 99 12.662 5.354 16.673 749 HA LEU 99 HA LEU 99 14.342 4.898 14.249 750 HB2 LEU 99 HB2 LEU 99 12.972 2.838 15.015 751 HB3 LEU 99 HB3 LEU 99 11.546 3.834 14.708 752 HG LEU 99 HG LEU 99 12.544 4.097 12.260 753 HD11 LEU 99 HD11 LEU 99 13.894 2.222 11.507 754 HD12 LEU 99 HD12 LEU 99 14.737 3.028 12.828 755 HD13 LEU 99 HD13 LEU 99 13.876 1.517 13.121 756 HD21 LEU 99 HD23 LEU 99 11.333 1.540 13.286 757 HD22 LEU 99 HD21 LEU 99 10.467 2.999 12.754 758 HD23 LEU 99 HD22 LEU 99 11.403 2.076 11.575 759 H LEU 100 H LEU 100 13.921 5.944 12.486 760 HA LEU 100 HA LEU 100 11.607 7.814 12.390 761 HB2 LEU 100 HB2 LEU 100 14.414 8.593 11.543 762 HB3 LEU 100 HB3 LEU 100 12.989 9.588 11.645 763 HG LEU 100 HG LEU 100 13.229 8.648 14.242 764 HD11 LEU 100 HD11 LEU 100 16.065 9.175 13.309 765 HD12 LEU 100 HD12 LEU 100 15.538 8.852 14.977 766 HD13 LEU 100 HD13 LEU 100 15.419 7.581 13.751 767 HD21 LEU 100 HD23 LEU 100 12.796 10.993 13.582 768 HD22 LEU 100 HD21 LEU 100 13.862 10.765 14.975 769 HD23 LEU 100 HD22 LEU 100 14.555 11.210 13.410 770 H ILE 101 H ILE 101 10.477 6.848 10.749 771 HA ILE 101 HA ILE 101 11.926 5.947 8.301 772 HB ILE 101 HB ILE 101 8.990 5.762 9.145 773 HG12 ILE 101 HG12 ILE 101 11.162 4.041 9.542 774 HG13 ILE 101 HG13 ILE 101 9.475 3.755 9.819 775 HG21 ILE 101 HG21 ILE 101 10.123 5.281 6.383 776 HG22 ILE 101 HG22 ILE 101 8.475 4.910 6.971 777 HG23 ILE 101 HG23 ILE 101 8.997 6.561 6.863 778 HD11 ILE 101 HD13 ILE 101 10.480 2.007 8.412 779 HD12 ILE 101 HD11 ILE 101 9.153 2.865 7.600 780 HD13 ILE 101 HD12 ILE 101 10.847 3.223 7.164 781 H GLY 102 H GLY 102 12.402 7.531 6.812 782 HA2 GLY 102 HA2 GLY 102 11.093 10.173 7.080 783 HA3 GLY 102 HA3 GLY 102 12.467 9.791 6.057 784 H LEU 103 H LEU 103 9.840 11.036 5.370 785 HA LEU 103 HA LEU 103 9.436 9.517 2.878 786 HB2 LEU 103 HB2 LEU 103 7.537 8.990 4.614 787 HB3 LEU 103 HB3 LEU 103 7.095 10.668 4.429 788 HG LEU 103 HG LEU 103 6.797 8.368 2.431 789 HD11 LEU 103 HD11 LEU 103 4.909 10.567 3.467 790 HD12 LEU 103 HD12 LEU 103 4.463 9.082 2.619 791 HD13 LEU 103 HD13 LEU 103 5.088 9.012 4.268 792 HD21 LEU 103 HD23 LEU 103 7.529 10.061 0.939 793 HD22 LEU 103 HD21 LEU 103 5.784 10.131 0.876 794 HD23 LEU 103 HD22 LEU 103 6.622 11.353 1.808 795 H SER 104 H SER 104 9.246 11.028 1.181 796 HA SER 104 HA SER 104 8.548 13.834 1.690 797 HB2 SER 104 HB2 SER 104 11.052 13.075 0.139 798 HB3 SER 104 HB3 SER 104 10.418 14.705 0.479 799 HG SER 104 HG SER 104 10.570 13.577 2.793 800 H ALA 105 H ALA 105 7.443 14.670 -0.175 801 HA ALA 105 HA ALA 105 6.904 12.717 -2.344 802 HB1 ALA 105 HB3 ALA 105 4.483 13.015 -1.937 803 HB2 ALA 105 HB1 ALA 105 5.289 12.192 -0.585 804 HB3 ALA 105 HB2 ALA 105 4.855 13.917 -0.453 805 H ALA 106 H ALA 106 6.373 13.699 -4.259 806 HA ALA 106 HA ALA 106 6.982 16.522 -4.416 807 HB1 ALA 106 HB3 ALA 106 7.801 14.906 -6.101 808 HB2 ALA 106 HB1 ALA 106 6.126 14.526 -6.565 809 HB3 ALA 106 HB2 ALA 106 6.788 16.149 -6.857 810 H ASP 107 H ASP 107 4.045 14.597 -4.273 811 HA ASP 107 HA ASP 107 2.382 17.042 -4.530 812 HB2 ASP 107 HB2 ASP 107 2.437 16.082 -6.796 813 HB3 ASP 107 HB3 ASP 107 1.988 14.500 -6.162 814 H ALA 108 H ALA 108 0.223 16.729 -3.597 815 HA ALA 108 HA ALA 108 0.317 15.406 -1.130 816 HB1 ALA 108 HB3 ALA 108 -1.094 17.374 -1.587 817 HB2 ALA 108 HB1 ALA 108 -2.107 16.401 -2.685 818 HB3 ALA 108 HB2 ALA 108 -2.061 16.030 -0.950 819 H ASP 109 H ASP 109 -0.975 14.210 -4.254 820 HA ASP 109 HA ASP 109 -2.273 11.913 -2.953 821 HB2 ASP 109 HB2 ASP 109 -3.209 12.718 -4.985 822 HB3 ASP 109 HB3 ASP 109 -1.660 12.529 -5.843 823 H SER 110 H SER 110 0.865 12.618 -4.458 824 HA SER 110 HA SER 110 1.897 9.941 -4.345 825 HB2 SER 110 HB2 SER 110 3.523 12.498 -4.024 826 HB3 SER 110 HB3 SER 110 4.036 10.936 -4.653 827 HG SER 110 HG SER 110 2.680 11.251 -6.444 828 H HIS 111 H HIS 111 1.828 12.668 -1.998 829 HA HIS 111 HA HIS 111 3.136 11.380 0.161 830 HB2 HIS 111 HB2 HIS 111 2.767 13.712 0.350 831 HB3 HIS 111 HB3 HIS 111 1.075 13.576 -0.041 832 HD1 HIS 111 HD1 HIS 111 3.393 13.258 2.970 833 HD2 HIS 111 HD2 HIS 111 -0.670 13.093 1.879 834 HE1 HIS 111 HE1 HIS 111 2.067 13.226 5.138 835 H ILE 112 H ILE 112 -0.387 11.432 -0.665 836 HA ILE 112 HA ILE 112 -1.251 9.786 1.461 837 HB ILE 112 HB ILE 112 -2.259 10.233 -1.374 838 HG12 ILE 112 HG12 ILE 112 -2.338 12.115 0.349 839 HG13 ILE 112 HG13 ILE 112 -3.817 11.732 -0.516 840 HG21 ILE 112 HG21 ILE 112 -4.439 9.246 -0.698 841 HG22 ILE 112 HG22 ILE 112 -3.138 8.076 -0.896 842 HG23 ILE 112 HG23 ILE 112 -3.634 8.560 0.740 843 HD11 ILE 112 HD13 ILE 112 -4.141 12.222 1.881 844 HD12 ILE 112 HD11 ILE 112 -4.721 10.609 1.436 845 HD13 ILE 112 HD12 ILE 112 -3.170 10.788 2.303 846 H GLY 113 H GLY 113 -0.305 8.723 -1.895 847 HA2 GLY 113 HA2 GLY 113 -0.699 5.975 -1.416 848 HA3 GLY 113 HA3 GLY 113 0.393 6.664 -2.633 849 H ALA 114 H ALA 114 2.159 8.018 -0.836 850 HA ALA 114 HA ALA 114 3.996 5.907 -0.159 851 HB1 ALA 114 HB3 ALA 114 5.318 7.879 0.665 852 HB2 ALA 114 HB1 ALA 114 4.706 8.118 -0.973 853 HB3 ALA 114 HB2 ALA 114 3.910 8.911 0.392 854 H ILE 115 H ILE 115 2.021 8.198 1.879 855 HA ILE 115 HA ILE 115 2.811 7.286 4.385 856 HB ILE 115 HB ILE 115 0.450 8.537 3.166 857 HG12 ILE 115 HG12 ILE 115 2.463 9.934 3.631 858 HG13 ILE 115 HG13 ILE 115 0.982 10.512 4.376 859 HG21 ILE 115 HG21 ILE 115 -0.746 7.343 4.691 860 HG22 ILE 115 HG22 ILE 115 0.421 7.648 6.007 861 HG23 ILE 115 HG23 ILE 115 -0.614 8.968 5.357 862 HD11 ILE 115 HD13 ILE 115 1.681 9.691 6.564 863 HD12 ILE 115 HD11 ILE 115 3.107 8.923 5.828 864 HD13 ILE 115 HD12 ILE 115 2.966 10.691 5.859 865 H GLN 116 H GLN 116 0.224 6.154 2.142 866 HA GLN 116 HA GLN 116 -0.820 4.162 3.919 867 HB2 GLN 116 HB2 GLN 116 -1.069 4.662 0.926 868 HB3 GLN 116 HB3 GLN 116 -1.930 3.354 1.739 869 HG2 GLN 116 HG2 GLN 116 -2.126 6.279 2.534 870 HG3 GLN 116 HG3 GLN 116 -3.254 5.484 1.442 871 HE21 GLN 116 HE22 GLN 116 -3.265 6.632 4.441 872 HE22 GLN 116 HE21 GLN 116 -4.167 5.406 5.289 873 H ALA 117 H ALA 117 2.172 4.146 2.187 874 HA ALA 117 HA ALA 117 2.217 1.226 2.058 875 HB1 ALA 117 HB3 ALA 117 4.395 1.514 0.992 876 HB2 ALA 117 HB1 ALA 117 3.254 2.599 0.184 877 HB3 ALA 117 HB2 ALA 117 4.401 3.246 1.365 878 H LEU 118 H LEU 118 3.554 4.064 3.741 879 HA LEU 118 HA LEU 118 5.191 2.483 5.473 880 HB2 LEU 118 HB2 LEU 118 4.137 5.354 5.688 881 HB3 LEU 118 HB3 LEU 118 5.366 4.659 6.763 882 HG LEU 118 HG LEU 118 5.548 4.879 3.742 883 HD11 LEU 118 HD11 LEU 118 5.653 7.039 4.837 884 HD12 LEU 118 HD12 LEU 118 6.873 6.475 5.983 885 HD13 LEU 118 HD13 LEU 118 7.279 6.624 4.263 886 HD21 LEU 118 HD23 LEU 118 7.248 3.498 5.819 887 HD22 LEU 118 HD21 LEU 118 7.029 3.156 4.096 888 HD23 LEU 118 HD22 LEU 118 8.124 4.439 4.604 889 H SER 119 H SER 119 1.837 3.578 5.711 890 HA SER 119 HA SER 119 1.376 2.851 8.385 891 HB2 SER 119 HB2 SER 119 -0.475 2.469 5.990 892 HB3 SER 119 HB3 SER 119 -0.970 2.559 7.689 893 HG SER 119 HG SER 119 0.331 4.632 6.200 894 H GLU 120 H GLU 120 2.191 0.670 5.721 895 HA GLU 120 HA GLU 120 1.104 -1.689 6.976 896 HB2 GLU 120 HB2 GLU 120 3.252 -1.453 4.853 897 HB3 GLU 120 HB3 GLU 120 2.439 -2.930 5.325 898 HG2 GLU 120 HG2 GLU 120 0.964 -0.517 4.217 899 HG3 GLU 120 HG3 GLU 120 1.565 -1.829 3.212 900 H LEU 121 H LEU 121 3.959 0.263 7.322 901 HA LEU 121 HA LEU 121 5.444 -1.896 8.754 902 HB2 LEU 121 HB2 LEU 121 6.391 0.826 7.758 903 HB3 LEU 121 HB3 LEU 121 7.381 -0.356 8.610 904 HG LEU 121 HG LEU 121 6.184 -0.586 5.822 905 HD11 LEU 121 HD11 LEU 121 9.059 -0.537 6.857 906 HD12 LEU 121 HD12 LEU 121 8.585 -0.715 5.160 907 HD13 LEU 121 HD13 LEU 121 8.218 0.787 6.022 908 HD21 LEU 121 HD23 LEU 121 7.736 -2.737 7.324 909 HD22 LEU 121 HD21 LEU 121 6.038 -2.829 6.779 910 HD23 LEU 121 HD22 LEU 121 7.348 -2.758 5.601 911 H LEU 122 H LEU 122 4.911 1.646 9.181 912 HA LEU 122 HA LEU 122 5.698 1.708 11.900 913 HB2 LEU 122 HB2 LEU 122 3.889 3.521 10.209 914 HB3 LEU 122 HB3 LEU 122 4.422 3.922 11.821 915 HG LEU 122 HG LEU 122 5.569 5.095 9.959 916 HD11 LEU 122 HD11 LEU 122 6.459 5.037 12.241 917 HD12 LEU 122 HD12 LEU 122 7.358 3.544 11.870 918 HD13 LEU 122 HD13 LEU 122 7.762 5.074 11.061 919 HD21 LEU 122 HD23 LEU 122 7.194 2.561 9.574 920 HD22 LEU 122 HD21 LEU 122 5.968 3.166 8.434 921 HD23 LEU 122 HD22 LEU 122 7.375 4.134 8.773 922 H CYS 123 H CYS 123 2.687 0.523 10.673 923 HA CYS 123 HA CYS 123 1.529 0.802 13.402 924 HB2 CYS 123 HB2 CYS 123 -0.038 0.602 10.802 925 HB3 CYS 123 HB3 CYS 123 -0.682 0.869 12.421 926 HG CYS 123 HG CYS 123 -0.868 3.082 11.043 927 H GLU 124 H GLU 124 3.371 -1.232 12.460 928 HA GLU 124 HA GLU 124 1.674 -3.552 13.145 929 HB2 GLU 124 HB2 GLU 124 3.674 -3.441 10.874 930 HB3 GLU 124 HB3 GLU 124 3.217 -4.955 11.655 931 HG2 GLU 124 HG2 GLU 124 1.315 -3.024 10.291 932 HG3 GLU 124 HG3 GLU 124 1.928 -4.532 9.603 933 H GLU 125 H GLU 125 2.200 -3.977 15.056 934 HA GLU 125 HA GLU 125 4.496 -3.194 16.445 935 HB2 GLU 125 HB2 GLU 125 2.964 -5.717 17.153 936 HB3 GLU 125 HB3 GLU 125 3.761 -4.565 18.230 937 HG2 GLU 125 HG2 GLU 125 2.030 -2.849 17.478 938 HG3 GLU 125 HG3 GLU 125 1.230 -4.168 16.604 939 H GLU 126 H GLU 126 3.811 -6.079 14.605 940 HA GLU 126 HA GLU 126 6.022 -7.691 15.370 941 HB2 GLU 126 HB2 GLU 126 4.604 -7.640 12.667 942 HB3 GLU 126 HB3 GLU 126 5.640 -8.937 13.285 943 HG2 GLU 126 HG2 GLU 126 4.030 -9.161 15.235 944 HG3 GLU 126 HG3 GLU 126 2.964 -8.025 14.395 945 H ILE 127 H ILE 127 5.631 -5.299 12.776 946 HA ILE 127 HA ILE 127 8.296 -5.573 11.702 947 HB ILE 127 HB ILE 127 5.965 -3.771 11.291 948 HG12 ILE 127 HG12 ILE 127 6.154 -4.467 8.985 949 HG13 ILE 127 HG13 ILE 127 7.668 -5.321 9.315 950 HG21 ILE 127 HG21 ILE 127 7.627 -2.120 11.226 951 HG22 ILE 127 HG22 ILE 127 8.787 -3.194 10.395 952 HG23 ILE 127 HG23 ILE 127 7.372 -2.555 9.544 953 HD11 ILE 127 HD13 ILE 127 6.479 -7.017 10.586 954 HD12 ILE 127 HD11 ILE 127 4.955 -6.099 10.441 955 HD13 ILE 127 HD12 ILE 127 5.717 -6.813 9.005 956 H LEU 128 H LEU 128 6.682 -3.194 13.948 957 HA LEU 128 HA LEU 128 8.799 -1.523 14.375 958 HB2 LEU 128 HB2 LEU 128 6.521 -2.440 16.123 959 HB3 LEU 128 HB3 LEU 128 7.849 -1.565 16.870 960 HG LEU 128 HG LEU 128 7.615 0.195 15.109 961 HD11 LEU 128 HD11 LEU 128 5.551 0.528 13.958 962 HD12 LEU 128 HD12 LEU 128 6.245 -1.006 13.445 963 HD13 LEU 128 HD13 LEU 128 4.882 -0.985 14.591 964 HD21 LEU 128 HD23 LEU 128 5.727 1.313 16.266 965 HD22 LEU 128 HD21 LEU 128 5.220 -0.245 16.958 966 HD23 LEU 128 HD22 LEU 128 6.769 0.480 17.434 967 H GLU 129 H GLU 129 8.393 -4.691 15.969 968 HA GLU 129 HA GLU 129 10.684 -4.273 17.626 969 HB2 GLU 129 HB2 GLU 129 8.940 -6.647 16.977 970 HB3 GLU 129 HB3 GLU 129 10.534 -6.931 17.700 971 HG2 GLU 129 HG2 GLU 129 10.044 -5.415 19.547 972 HG3 GLU 129 HG3 GLU 129 8.439 -5.071 18.883 973 H GLN 130 H GLN 130 10.250 -5.601 14.316 974 HA GLN 130 HA GLN 130 12.834 -6.856 14.213 975 HB2 GLN 130 HB2 GLN 130 10.846 -5.901 12.123 976 HB3 GLN 130 HB3 GLN 130 12.364 -6.724 11.718 977 HG2 GLN 130 HG2 GLN 130 11.690 -8.755 12.719 978 HG3 GLN 130 HG3 GLN 130 10.324 -8.006 13.537 979 HE21 GLN 130 HE22 GLN 130 8.375 -8.224 12.558 980 HE22 GLN 130 HE21 GLN 130 8.119 -8.654 10.869 981 H LEU 131 H LEU 131 11.483 -3.626 13.415 982 HA LEU 131 HA LEU 131 13.930 -2.552 12.307 983 HB2 LEU 131 HB2 LEU 131 11.566 -1.163 13.639 984 HB3 LEU 131 HB3 LEU 131 12.863 -0.350 12.785 985 HG LEU 131 HG LEU 131 11.286 -2.497 11.323 986 HD11 LEU 131 HD11 LEU 131 9.575 -1.292 12.434 987 HD12 LEU 131 HD12 LEU 131 10.186 0.256 11.877 988 HD13 LEU 131 HD13 LEU 131 9.557 -0.889 10.696 989 HD21 LEU 131 HD23 LEU 131 12.493 0.154 10.465 990 HD22 LEU 131 HD21 LEU 131 13.134 -1.470 10.135 991 HD23 LEU 131 HD22 LEU 131 11.613 -0.966 9.398 992 H LEU 132 H LEU 132 12.270 -2.174 15.442 993 HA LEU 132 HA LEU 132 14.230 -0.581 16.681 994 HB2 LEU 132 HB2 LEU 132 12.155 -2.445 17.861 995 HB3 LEU 132 HB3 LEU 132 13.145 -1.406 18.866 996 HG LEU 132 HG LEU 132 11.426 -0.265 16.629 997 HD11 LEU 132 HD11 LEU 132 10.013 -1.510 18.255 998 HD12 LEU 132 HD12 LEU 132 10.721 -0.567 19.583 999 HD13 LEU 132 HD13 LEU 132 9.740 0.241 18.336 1000 HD21 LEU 132 HD23 LEU 132 12.677 1.008 19.089 1001 HD22 LEU 132 HD21 LEU 132 13.190 1.241 17.397 1002 HD23 LEU 132 HD22 LEU 132 11.609 1.820 17.930 1003 H THR 133 H THR 133 14.591 -3.929 15.978 1004 HA THR 133 HA THR 133 16.853 -4.095 17.886 1005 HB THR 133 HB THR 133 16.445 -6.493 18.021 1006 HG1 THR 133 HG1 THR 133 14.019 -6.041 16.637 1007 HG21 THR 133 HG23 THR 133 14.435 -6.519 19.379 1008 HG22 THR 133 HG21 THR 133 15.315 -5.012 19.682 1009 HG23 THR 133 HG22 THR 133 13.851 -5.006 18.674 1010 H ALA 134 H ALA 134 16.343 -3.440 14.741 1011 HA ALA 134 HA ALA 134 17.820 -5.338 13.263 1012 HB1 ALA 134 HB3 ALA 134 18.066 -3.446 11.638 1013 HB2 ALA 134 HB1 ALA 134 16.394 -3.725 12.173 1014 HB3 ALA 134 HB2 ALA 134 17.341 -2.373 12.832 1015 H SER 135 H SER 135 19.877 -5.922 13.463 1016 HA SER 135 HA SER 135 21.826 -4.374 14.912 1017 HB2 SER 135 HB2 SER 135 22.142 -6.842 13.150 1018 HB3 SER 135 HB3 SER 135 23.302 -6.251 14.353 1019 HG SER 135 HG SER 135 21.979 -7.945 15.162 1020 H SER 136 H SER 136 20.790 -4.280 11.567 1021 HA SER 136 HA SER 136 23.144 -2.659 10.840 1022 HB2 SER 136 HB2 SER 136 23.646 -4.112 8.903 1023 HB3 SER 136 HB3 SER 136 23.868 -4.967 10.434 1024 HG SER 136 HG SER 136 22.731 -6.324 9.144 1025 H GLU 137 H GLU 137 22.949 -1.676 8.721 1026 HA GLU 137 HA GLU 137 20.385 -0.664 8.023 1027 HB2 GLU 137 HB2 GLU 137 22.876 -0.917 6.258 1028 HB3 GLU 137 HB3 GLU 137 21.487 0.132 5.995 1029 HG2 GLU 137 HG2 GLU 137 23.065 1.564 6.745 1030 HG3 GLU 137 HG3 GLU 137 22.005 1.298 8.119 1031 H LYS 138 H LYS 138 22.246 -3.527 6.976 1032 HA LYS 138 HA LYS 138 20.586 -4.317 4.818 1033 HB2 LYS 138 HB2 LYS 138 22.233 -6.058 6.675 1034 HB3 LYS 138 HB3 LYS 138 21.457 -6.563 5.167 1035 HG2 LYS 138 HG2 LYS 138 22.761 -4.501 4.122 1036 HG3 LYS 138 HG3 LYS 138 23.794 -4.664 5.548 1037 HD2 LYS 138 HD2 LYS 138 23.132 -6.828 3.517 1038 HD3 LYS 138 HD3 LYS 138 24.631 -5.882 3.551 1039 HE2 LYS 138 HE2 LYS 138 25.159 -6.797 5.812 1040 HE3 LYS 138 HE3 LYS 138 23.688 -7.776 5.757 1041 HZ1 LYS 138 HZ3 LYS 138 24.611 -8.936 3.835 1042 HZ2 LYS 138 HZ1 LYS 138 25.974 -8.034 3.890 1043 HZ3 LYS 138 HZ2 LYS 138 25.621 -9.056 5.106 1044 H GLN 139 H GLN 139 20.390 -5.250 8.314 1045 HA GLN 139 HA GLN 139 18.051 -6.732 7.990 1046 HB2 GLN 139 HB2 GLN 139 19.830 -6.332 10.012 1047 HB3 GLN 139 HB3 GLN 139 18.511 -5.304 10.591 1048 HG2 GLN 139 HG2 GLN 139 16.957 -7.243 10.199 1049 HG3 GLN 139 HG3 GLN 139 18.381 -8.199 9.731 1050 HE21 GLN 139 HE22 GLN 139 16.553 -8.886 11.910 1051 HE22 GLN 139 HE21 GLN 139 17.472 -8.812 13.391 1052 H LEU 140 H LEU 140 18.430 -3.174 8.460 1053 HA LEU 140 HA LEU 140 15.611 -2.717 8.922 1054 HB2 LEU 140 HB2 LEU 140 17.911 -1.026 7.974 1055 HB3 LEU 140 HB3 LEU 140 16.267 -0.385 7.977 1056 HG LEU 140 HG LEU 140 17.715 -1.446 10.420 1057 HD11 LEU 140 HD11 LEU 140 17.254 1.444 9.553 1058 HD12 LEU 140 HD12 LEU 140 18.045 0.897 11.034 1059 HD13 LEU 140 HD13 LEU 140 18.797 0.580 9.472 1060 HD21 LEU 140 HD23 LEU 140 15.330 -1.571 10.767 1061 HD22 LEU 140 HD21 LEU 140 15.979 -0.241 11.713 1062 HD23 LEU 140 HD22 LEU 140 15.114 0.109 10.204 1063 H ALA 141 H ALA 141 17.702 -2.650 5.974 1064 HA ALA 141 HA ALA 141 15.643 -2.120 4.123 1065 HB1 ALA 141 HB3 ALA 141 18.063 -1.912 3.689 1066 HB2 ALA 141 HB1 ALA 141 18.183 -3.688 3.624 1067 HB3 ALA 141 HB2 ALA 141 17.177 -2.810 2.442 1068 H ASP 142 H ASP 142 16.700 -5.274 5.513 1069 HA ASP 142 HA ASP 142 15.261 -6.975 3.799 1070 HB2 ASP 142 HB2 ASP 142 16.820 -7.835 5.446 1071 HB3 ASP 142 HB3 ASP 142 15.832 -7.219 6.771 1072 H ILE 143 H ILE 143 14.070 -5.016 6.568 1073 HA ILE 143 HA ILE 143 11.452 -6.157 6.585 1074 HB ILE 143 HB ILE 143 12.674 -3.623 7.723 1075 HG12 ILE 143 HG12 ILE 143 11.897 -6.169 9.215 1076 HG13 ILE 143 HG13 ILE 143 13.502 -5.976 8.522 1077 HG21 ILE 143 HG21 ILE 143 10.731 -3.539 9.223 1078 HG22 ILE 143 HG22 ILE 143 10.306 -3.287 7.528 1079 HG23 ILE 143 HG23 ILE 143 9.977 -4.863 8.296 1080 HD11 ILE 143 HD13 ILE 143 13.797 -5.295 10.714 1081 HD12 ILE 143 HD11 ILE 143 13.680 -3.771 9.833 1082 HD13 ILE 143 HD12 ILE 143 12.274 -4.387 10.752 1083 H ILE 144 H ILE 144 12.987 -3.386 4.938 1084 HA ILE 144 HA ILE 144 10.669 -2.202 3.784 1085 HB ILE 144 HB ILE 144 13.409 -2.553 2.467 1086 HG12 ILE 144 HG12 ILE 144 13.708 -1.361 4.556 1087 HG13 ILE 144 HG13 ILE 144 13.906 -0.271 3.183 1088 HG21 ILE 144 HG21 ILE 144 11.114 -0.753 1.689 1089 HG22 ILE 144 HG22 ILE 144 12.787 -0.568 1.118 1090 HG23 ILE 144 HG23 ILE 144 11.886 -2.039 0.751 1091 HD11 ILE 144 HD13 ILE 144 11.586 -0.507 5.108 1092 HD12 ILE 144 HD11 ILE 144 12.631 0.895 4.740 1093 HD13 ILE 144 HD12 ILE 144 11.432 0.339 3.554 1094 H SER 145 H SER 145 12.776 -4.813 2.584 1095 HA SER 145 HA SER 145 11.268 -5.140 0.261 1096 HB2 SER 145 HB2 SER 145 13.101 -7.174 1.622 1097 HB3 SER 145 HB3 SER 145 12.611 -7.201 -0.083 1098 HG SER 145 HG SER 145 14.665 -6.219 0.229 1099 H ARG 146 H ARG 146 10.816 -6.579 3.504 1100 HA ARG 146 HA ARG 146 9.089 -8.692 2.741 1101 HB2 ARG 146 HB2 ARG 146 10.256 -9.016 4.670 1102 HB3 ARG 146 HB3 ARG 146 10.190 -7.333 5.182 1103 HG2 ARG 146 HG2 ARG 146 7.957 -7.471 5.849 1104 HG3 ARG 146 HG3 ARG 146 7.806 -9.160 5.294 1105 HD2 ARG 146 HD2 ARG 146 9.417 -8.061 7.634 1106 HD3 ARG 146 HD3 ARG 146 8.081 -9.207 7.706 1107 HE ARG 146 HE ARG 146 9.505 -10.879 6.602 1108 HH11 ARG 146 HH11 ARG 146 11.248 -8.487 8.562 1109 HH12 ARG 146 HH12 ARG 146 12.795 -8.834 7.776 1110 HH21 ARG 146 HH21 ARG 146 11.681 -11.516 5.907 1111 HH22 ARG 146 HH22 ARG 146 13.029 -10.548 6.469 1112 H GLY 147 H GLY 147 8.679 -5.305 3.705 1113 HA2 GLY 147 HA2 GLY 147 6.881 -3.888 3.678 1114 HA3 GLY 147 HA3 GLY 147 6.367 -4.795 2.250 Start of MODEL 9 1 H MET 1 H1 MET 1 1.858 -1.302 -0.671 2 HA MET 1 HA MET 1 2.705 -1.249 -3.492 3 HB2 MET 1 HB2 MET 1 2.753 0.914 -1.413 4 HB3 MET 1 HB3 MET 1 4.279 0.634 -2.237 5 HG2 MET 1 HG2 MET 1 3.141 2.296 -3.475 6 HG3 MET 1 HG3 MET 1 3.172 0.828 -4.431 7 HE1 MET 1 HE3 MET 1 -0.527 2.909 -2.580 8 HE2 MET 1 HE1 MET 1 0.807 2.346 -1.551 9 HE3 MET 1 HE2 MET 1 1.098 3.601 -2.776 10 H ARG 2 H ARG 2 4.822 -1.886 -3.916 11 HA ARG 2 HA ARG 2 6.167 -3.524 -1.880 12 HB2 ARG 2 HB2 ARG 2 7.025 -2.508 -4.644 13 HB3 ARG 2 HB3 ARG 2 8.084 -3.379 -3.548 14 HG2 ARG 2 HG2 ARG 2 7.312 -4.978 -5.071 15 HG3 ARG 2 HG3 ARG 2 6.484 -5.311 -3.549 16 HD2 ARG 2 HD2 ARG 2 4.432 -4.284 -4.395 17 HD3 ARG 2 HD3 ARG 2 5.250 -3.758 -5.870 18 HE ARG 2 HE ARG 2 4.292 -6.441 -5.155 19 HH11 ARG 2 HH11 ARG 2 6.291 -4.589 -7.439 20 HH12 ARG 2 HH12 ARG 2 6.260 -5.802 -8.664 21 HH21 ARG 2 HH21 ARG 2 4.254 -8.051 -6.786 22 HH22 ARG 2 HH22 ARG 2 5.075 -7.812 -8.281 23 H LEU 3 H LEU 3 7.030 -2.471 -0.184 24 HA LEU 3 HA LEU 3 7.243 0.322 0.073 25 HB2 LEU 3 HB2 LEU 3 8.469 -2.034 1.513 26 HB3 LEU 3 HB3 LEU 3 9.118 -0.445 1.851 27 HG LEU 3 HG LEU 3 7.367 -1.269 3.451 28 HD11 LEU 3 HD11 LEU 3 6.852 1.386 2.068 29 HD12 LEU 3 HD12 LEU 3 6.333 0.912 3.705 30 HD13 LEU 3 HD13 LEU 3 8.048 1.048 3.337 31 HD21 LEU 3 HD23 LEU 3 5.374 -0.623 1.248 32 HD22 LEU 3 HD21 LEU 3 5.772 -2.246 1.811 33 HD23 LEU 3 HD22 LEU 3 5.023 -1.096 2.921 34 H SER 4 H SER 4 9.679 -1.986 -1.111 35 HA SER 4 HA SER 4 11.947 -0.391 -1.148 36 HB2 SER 4 HB2 SER 4 12.441 -2.029 -3.179 37 HB3 SER 4 HB3 SER 4 12.340 -2.617 -1.517 38 HG SER 4 HG SER 4 11.117 -3.889 -2.992 39 H ASP 5 H ASP 5 9.091 0.024 -3.209 40 HA ASP 5 HA ASP 5 10.371 1.195 -5.452 41 HB2 ASP 5 HB2 ASP 5 8.002 0.487 -5.375 42 HB3 ASP 5 HB3 ASP 5 7.651 1.789 -4.234 43 H TYR 6 H TYR 6 9.897 2.425 -2.197 44 HA TYR 6 HA TYR 6 10.204 5.235 -3.085 45 HB2 TYR 6 HB2 TYR 6 9.343 3.984 -0.465 46 HB3 TYR 6 HB3 TYR 6 9.451 5.716 -0.750 47 HD1 TYR 6 HD2 TYR 6 7.462 2.654 -1.507 48 HD2 TYR 6 HD1 TYR 6 7.823 6.940 -1.978 49 HE1 TYR 6 HE2 TYR 6 5.168 2.759 -2.393 50 HE2 TYR 6 HE1 TYR 6 5.549 7.022 -2.959 51 HH TYR 6 HH TYR 6 3.657 5.806 -3.550 52 H PHE 7 H PHE 7 12.297 2.790 -1.743 53 HA PHE 7 HA PHE 7 13.869 4.835 -0.246 54 HB2 PHE 7 HB2 PHE 7 14.028 1.811 -0.142 55 HB3 PHE 7 HB3 PHE 7 15.017 2.936 0.780 56 HD1 PHE 7 HD1 PHE 7 11.543 1.735 0.257 57 HD2 PHE 7 HD2 PHE 7 14.204 3.886 2.869 58 HE1 PHE 7 HE1 PHE 7 9.729 1.936 1.924 59 HE2 PHE 7 HE2 PHE 7 12.394 4.012 4.567 60 HZ PHE 7 HZ PHE 7 10.165 3.060 4.101 61 HA PRO 8 HA PRO 8 16.128 4.716 -4.149 62 HB2 PRO 8 HB2 PRO 8 18.092 6.608 -3.596 63 HB3 PRO 8 HB3 PRO 8 16.430 6.943 -4.148 64 HG2 PRO 8 HG2 PRO 8 17.474 6.946 -1.306 65 HG3 PRO 8 HG3 PRO 8 16.431 8.161 -2.110 66 HD2 PRO 8 HD2 PRO 8 15.355 6.278 -0.520 67 HD3 PRO 8 HD3 PRO 8 14.547 6.713 -2.049 68 H GLU 9 H GLU 9 18.492 5.132 -1.494 69 HA GLU 9 HA GLU 9 19.709 2.562 -1.867 70 HB2 GLU 9 HB2 GLU 9 20.493 3.588 -3.967 71 HB3 GLU 9 HB3 GLU 9 21.016 5.028 -3.099 72 HG2 GLU 9 HG2 GLU 9 22.829 3.810 -2.040 73 HG3 GLU 9 HG3 GLU 9 22.202 2.262 -2.620 74 H SER 10 H SER 10 21.195 5.707 -1.128 75 HA SER 10 HA SER 10 22.353 4.796 1.283 76 HB2 SER 10 HB2 SER 10 21.754 7.705 0.663 77 HB3 SER 10 HB3 SER 10 23.189 7.024 1.440 78 HG SER 10 HG SER 10 23.812 6.193 -0.580 79 H SER 11 H SER 11 19.209 4.846 0.899 80 HA SER 11 HA SER 11 18.201 6.823 2.736 81 HB2 SER 11 HB2 SER 11 16.098 5.197 2.208 82 HB3 SER 11 HB3 SER 11 16.689 6.470 1.138 83 HG SER 11 HG SER 11 17.139 3.675 0.931 84 H ILE 12 H ILE 12 19.745 3.861 3.466 85 HA ILE 12 HA ILE 12 17.982 3.362 5.793 86 HB ILE 12 HB ILE 12 19.551 1.515 3.982 87 HG12 ILE 12 HG12 ILE 12 16.612 2.279 4.203 88 HG13 ILE 12 HG13 ILE 12 17.652 2.310 2.789 89 HG21 ILE 12 HG21 ILE 12 19.593 0.782 6.295 90 HG22 ILE 12 HG22 ILE 12 17.856 1.025 6.467 91 HG23 ILE 12 HG23 ILE 12 18.500 -0.265 5.408 92 HD11 ILE 12 HD13 ILE 12 16.063 0.536 2.624 93 HD12 ILE 12 HD11 ILE 12 17.714 -0.124 2.762 94 HD13 ILE 12 HD12 ILE 12 16.600 -0.142 4.167 95 H SER 13 H SER 13 19.037 3.563 7.778 96 HA SER 13 HA SER 13 21.940 3.157 7.936 97 HB2 SER 13 HB2 SER 13 22.197 5.468 8.997 98 HB3 SER 13 HB3 SER 13 21.993 5.417 7.242 99 HG SER 13 HG SER 13 20.681 7.016 8.147 100 H VAL 14 H VAL 14 22.743 2.907 10.016 101 HA VAL 14 HA VAL 14 20.809 2.933 12.265 102 HB VAL 14 HB VAL 14 23.121 1.019 11.786 103 HG11 VAL 14 HG11 VAL 14 22.844 1.491 14.191 104 HG12 VAL 14 HG12 VAL 14 21.099 1.172 14.076 105 HG13 VAL 14 HG13 VAL 14 22.273 -0.139 13.836 106 HG21 VAL 14 HG23 VAL 14 21.370 -0.757 11.728 107 HG22 VAL 14 HG21 VAL 14 20.118 0.494 11.776 108 HG23 VAL 14 HG22 VAL 14 21.208 0.363 10.379 109 H ILE 15 H ILE 15 21.602 4.014 14.056 110 HA ILE 15 HA ILE 15 24.223 5.422 13.846 111 HB ILE 15 HB ILE 15 21.367 6.413 14.098 112 HG12 ILE 15 HG12 ILE 15 23.699 7.027 12.252 113 HG13 ILE 15 HG13 ILE 15 22.135 6.309 11.848 114 HG21 ILE 15 HG21 ILE 15 22.118 8.647 14.715 115 HG22 ILE 15 HG22 ILE 15 22.451 7.464 15.927 116 HG23 ILE 15 HG23 ILE 15 23.789 8.047 14.882 117 HD11 ILE 15 HD13 ILE 15 21.055 8.516 12.484 118 HD12 ILE 15 HD11 ILE 15 22.695 9.195 12.627 119 HD13 ILE 15 HD12 ILE 15 22.126 8.569 11.064 120 H HIS 16 H HIS 16 25.200 5.897 15.844 121 HA HIS 16 HA HIS 16 24.412 4.248 18.086 122 HB2 HIS 16 HB2 HIS 16 26.294 5.465 19.238 123 HB3 HIS 16 HB3 HIS 16 26.719 4.602 17.767 124 HD1 HIS 16 HD1 HIS 16 25.963 8.329 18.730 125 HD2 HIS 16 HD2 HIS 16 28.111 5.909 16.020 126 HE1 HIS 16 HE1 HIS 16 27.354 9.906 17.304 127 H SER 17 H SER 17 24.020 7.704 17.270 128 HA SER 17 HA SER 17 21.800 8.143 18.966 129 HB2 SER 17 HB2 SER 17 23.088 9.988 20.318 130 HB3 SER 17 HB3 SER 17 23.097 8.327 20.900 131 HG SER 17 HG SER 17 25.176 9.410 20.879 132 H ALA 18 H ALA 18 21.010 10.394 18.392 133 HA ALA 18 HA ALA 18 22.307 11.440 15.944 134 HB1 ALA 18 HB3 ALA 18 19.869 11.413 15.955 135 HB2 ALA 18 HB1 ALA 18 19.836 12.360 17.471 136 HB3 ALA 18 HB2 ALA 18 20.463 13.074 15.972 137 H LYS 19 H LYS 19 23.277 13.501 15.939 138 HA LYS 19 HA LYS 19 24.758 14.275 18.210 139 HB2 LYS 19 HB2 LYS 19 25.068 14.742 15.684 140 HB3 LYS 19 HB3 LYS 19 23.996 16.103 15.895 141 HG2 LYS 19 HG2 LYS 19 26.567 15.690 17.491 142 HG3 LYS 19 HG3 LYS 19 26.518 16.535 15.953 143 HD2 LYS 19 HD2 LYS 19 25.099 17.445 18.487 144 HD3 LYS 19 HD3 LYS 19 26.607 18.080 17.845 145 HE2 LYS 19 HE2 LYS 19 25.484 18.861 15.808 146 HE3 LYS 19 HE3 LYS 19 23.948 18.171 16.352 147 HZ1 LYS 19 HZ3 LYS 19 25.397 20.322 17.776 148 HZ2 LYS 19 HZ1 LYS 19 24.102 20.545 16.811 149 HZ3 LYS 19 HZ2 LYS 19 23.934 19.689 18.198 150 H ASP 20 H ASP 20 21.623 15.386 16.977 151 HA ASP 20 HA ASP 20 20.622 16.059 19.580 152 HB2 ASP 20 HB2 ASP 20 21.202 18.264 17.542 153 HB3 ASP 20 HB3 ASP 20 19.816 18.387 18.611 154 H TRP 21 H TRP 21 18.280 16.630 19.297 155 HA TRP 21 HA TRP 21 16.837 15.032 17.504 156 HB2 TRP 21 HB2 TRP 21 15.065 16.932 18.165 157 HB3 TRP 21 HB3 TRP 21 15.567 15.654 19.263 158 HD1 TRP 21 HD1 TRP 21 16.154 19.354 18.580 159 HE1 TRP 21 HE1 TRP 21 17.006 20.538 20.680 160 HE3 TRP 21 HE3 TRP 21 16.969 15.251 21.472 161 HZ2 TRP 21 HZ2 TRP 21 17.985 19.765 23.308 162 HZ3 TRP 21 HZ3 TRP 21 17.945 15.478 23.745 163 HH2 TRP 21 HH2 TRP 21 18.440 17.730 24.676 164 H GLN 22 H GLN 22 18.039 18.400 17.008 165 HA GLN 22 HA GLN 22 16.698 18.841 14.477 166 HB2 GLN 22 HB2 GLN 22 19.319 19.921 15.571 167 HB3 GLN 22 HB3 GLN 22 18.620 20.344 14.005 168 HG2 GLN 22 HG2 GLN 22 16.435 20.855 15.404 169 HG3 GLN 22 HG3 GLN 22 17.553 20.975 16.762 170 HE21 GLN 22 HE22 GLN 22 18.918 22.873 16.871 171 HE22 GLN 22 HE21 GLN 22 18.804 24.167 15.705 172 H GLU 23 H GLU 23 19.878 17.330 15.344 173 HA GLU 23 HA GLU 23 20.642 16.768 12.654 174 HB2 GLU 23 HB2 GLU 23 22.038 16.730 14.895 175 HB3 GLU 23 HB3 GLU 23 21.405 15.082 15.044 176 HG2 GLU 23 HG2 GLU 23 23.418 14.694 13.975 177 HG3 GLU 23 HG3 GLU 23 22.332 14.739 12.612 178 H ALA 24 H ALA 24 18.693 15.020 15.035 179 HA ALA 24 HA ALA 24 18.628 12.509 13.725 180 HB1 ALA 24 HB3 ALA 24 16.398 13.733 15.398 181 HB2 ALA 24 HB1 ALA 24 16.838 12.017 15.234 182 HB3 ALA 24 HB2 ALA 24 17.931 13.152 16.071 183 H ILE 25 H ILE 25 16.696 15.487 13.235 184 HA ILE 25 HA ILE 25 14.959 14.322 11.226 185 HB ILE 25 HB ILE 25 15.755 17.235 11.509 186 HG12 ILE 25 HG12 ILE 25 14.369 15.717 13.495 187 HG13 ILE 25 HG13 ILE 25 14.730 17.433 13.447 188 HG21 ILE 25 HG21 ILE 25 13.286 15.951 10.274 189 HG22 ILE 25 HG22 ILE 25 13.683 17.691 10.324 190 HG23 ILE 25 HG23 ILE 25 14.670 16.600 9.390 191 HD11 ILE 25 HD13 ILE 25 12.568 17.825 12.291 192 HD12 ILE 25 HD11 ILE 25 12.237 16.070 12.387 193 HD13 ILE 25 HD12 ILE 25 12.381 17.036 13.866 194 H ASP 26 H ASP 26 18.033 16.239 11.152 195 HA ASP 26 HA ASP 26 18.324 16.344 8.352 196 HB2 ASP 26 HB2 ASP 26 19.782 17.590 9.874 197 HB3 ASP 26 HB3 ASP 26 20.521 16.088 10.435 198 H PHE 27 H PHE 27 19.452 13.754 10.598 199 HA PHE 27 HA PHE 27 20.395 12.040 8.529 200 HB2 PHE 27 HB2 PHE 27 19.654 11.660 11.440 201 HB3 PHE 27 HB3 PHE 27 20.005 10.274 10.423 202 HD1 PHE 27 HD2 PHE 27 22.177 10.571 8.854 203 HD2 PHE 27 HD1 PHE 27 21.611 12.463 12.717 204 HE1 PHE 27 HE2 PHE 27 24.628 10.742 9.147 205 HE2 PHE 27 HE1 PHE 27 24.050 12.581 12.992 206 HZ PHE 27 HZ PHE 27 25.572 11.741 11.221 207 H SER 28 H SER 28 17.090 12.534 9.831 208 HA SER 28 HA SER 28 15.947 10.215 8.561 209 HB2 SER 28 HB2 SER 28 14.546 12.852 9.253 210 HB3 SER 28 HB3 SER 28 13.784 11.318 8.913 211 HG SER 28 HG SER 28 15.582 11.834 11.077 212 H MET 29 H MET 29 17.039 13.319 7.280 213 HA MET 29 HA MET 29 15.470 12.812 4.787 214 HB2 MET 29 HB2 MET 29 16.550 15.403 5.851 215 HB3 MET 29 HB3 MET 29 15.315 15.147 4.602 216 HG2 MET 29 HG2 MET 29 14.656 14.307 7.403 217 HG3 MET 29 HG3 MET 29 14.744 16.013 7.014 218 HE1 MET 29 HE3 MET 29 13.347 12.745 5.285 219 HE2 MET 29 HE1 MET 29 12.740 12.855 6.969 220 HE3 MET 29 HE2 MET 29 11.607 13.037 5.606 221 H VAL 30 H VAL 30 18.818 13.346 5.903 222 HA VAL 30 HA VAL 30 19.734 14.728 3.710 223 HB VAL 30 HB VAL 30 21.014 14.450 5.754 224 HG11 VAL 30 HG11 VAL 30 22.335 12.468 6.256 225 HG12 VAL 30 HG12 VAL 30 20.629 12.008 6.168 226 HG13 VAL 30 HG13 VAL 30 21.720 11.631 4.817 227 HG21 VAL 30 HG23 VAL 30 23.234 14.314 4.752 228 HG22 VAL 30 HG21 VAL 30 22.578 13.491 3.318 229 HG23 VAL 30 HG22 VAL 30 22.128 15.168 3.658 230 H SER 31 H SER 31 19.404 11.143 3.937 231 HA SER 31 HA SER 31 20.732 10.595 1.531 232 HB2 SER 31 HB2 SER 31 18.369 9.086 2.724 233 HB3 SER 31 HB3 SER 31 19.665 8.436 1.698 234 HG SER 31 HG SER 31 20.471 7.978 3.601 235 H LEU 32 H LEU 32 17.636 12.090 2.011 236 HA LEU 32 HA LEU 32 16.759 11.593 -0.777 237 HB2 LEU 32 HB2 LEU 32 15.447 12.927 1.639 238 HB3 LEU 32 HB3 LEU 32 14.722 12.927 0.060 239 HG LEU 32 HG LEU 32 15.400 10.428 1.659 240 HD11 LEU 32 HD11 LEU 32 13.546 11.796 2.615 241 HD12 LEU 32 HD12 LEU 32 12.687 11.681 1.065 242 HD13 LEU 32 HD13 LEU 32 13.005 10.222 2.028 243 HD21 LEU 32 HD23 LEU 32 13.851 10.704 -0.958 244 HD22 LEU 32 HD21 LEU 32 15.447 9.943 -0.765 245 HD23 LEU 32 HD22 LEU 32 14.052 9.216 -0.007 246 H LEU 33 H LEU 33 17.813 14.207 1.462 247 HA LEU 33 HA LEU 33 17.647 16.377 -0.266 248 HB2 LEU 33 HB2 LEU 33 18.235 16.436 2.161 249 HB3 LEU 33 HB3 LEU 33 19.816 15.776 1.766 250 HG LEU 33 HG LEU 33 20.362 17.814 0.458 251 HD11 LEU 33 HD11 LEU 33 17.680 18.869 1.438 252 HD12 LEU 33 HD12 LEU 33 18.948 19.807 0.618 253 HD13 LEU 33 HD13 LEU 33 18.123 18.526 -0.249 254 HD21 LEU 33 HD23 LEU 33 19.455 18.400 3.290 255 HD22 LEU 33 HD21 LEU 33 20.936 17.533 2.850 256 HD23 LEU 33 HD22 LEU 33 20.744 19.211 2.368 257 H ASP 34 H ASP 34 20.241 13.972 0.136 258 HA ASP 34 HA ASP 34 22.172 15.133 -1.527 259 HB2 ASP 34 HB2 ASP 34 22.648 13.447 0.192 260 HB3 ASP 34 HB3 ASP 34 21.697 12.241 -0.675 261 H LYS 35 H LYS 35 19.440 13.079 -2.433 262 HA LYS 35 HA LYS 35 20.488 13.021 -5.239 263 HB2 LYS 35 HB2 LYS 35 17.938 11.687 -4.572 264 HB3 LYS 35 HB3 LYS 35 19.146 11.245 -5.752 265 HG2 LYS 35 HG2 LYS 35 19.204 10.771 -2.763 266 HG3 LYS 35 HG3 LYS 35 18.908 9.562 -4.003 267 HD2 LYS 35 HD2 LYS 35 21.202 9.704 -4.807 268 HD3 LYS 35 HD3 LYS 35 21.542 11.052 -3.699 269 HE2 LYS 35 HE2 LYS 35 20.790 9.546 -1.796 270 HE3 LYS 35 HE3 LYS 35 20.780 8.196 -2.938 271 HZ1 LYS 35 HZ3 LYS 35 23.151 8.611 -3.338 272 HZ2 LYS 35 HZ1 LYS 35 23.147 9.866 -2.277 273 HZ3 LYS 35 HZ2 LYS 35 22.892 8.317 -1.752 274 H ASN 36 H ASN 36 19.264 15.361 -3.636 275 HA ASN 36 HA ASN 36 17.729 16.905 -3.732 276 HB2 ASN 36 HB2 ASN 36 17.244 18.052 -5.835 277 HB3 ASN 36 HB3 ASN 36 18.932 17.815 -5.453 278 HD21 ASN 36 HD22 ASN 36 20.129 16.275 -6.574 279 HD22 ASN 36 HD21 ASN 36 19.698 15.747 -8.194 280 H TYR 37 H TYR 37 16.465 14.439 -3.200 281 HA TYR 37 HA TYR 37 13.875 14.409 -4.600 282 HB2 TYR 37 HB2 TYR 37 14.913 13.262 -1.997 283 HB3 TYR 37 HB3 TYR 37 13.205 13.243 -2.356 284 HD1 TYR 37 HD1 TYR 37 12.264 11.837 -4.096 285 HD2 TYR 37 HD2 TYR 37 16.437 11.611 -3.027 286 HE1 TYR 37 HE1 TYR 37 12.503 9.795 -5.483 287 HE2 TYR 37 HE2 TYR 37 16.655 9.535 -4.356 288 HH TYR 37 HH TYR 37 15.612 8.055 -5.841 289 H ILE 38 H ILE 38 15.424 16.364 -2.196 290 HA ILE 38 HA ILE 38 12.996 17.966 -1.759 291 HB ILE 38 HB ILE 38 13.452 18.020 0.683 292 HG12 ILE 38 HG12 ILE 38 15.427 15.772 0.111 293 HG13 ILE 38 HG13 ILE 38 15.855 17.421 0.587 294 HG21 ILE 38 HG21 ILE 38 11.776 16.410 -0.293 295 HG22 ILE 38 HG22 ILE 38 13.007 15.137 -0.172 296 HG23 ILE 38 HG23 ILE 38 12.417 15.966 1.276 297 HD11 ILE 38 HD13 ILE 38 14.744 17.079 2.763 298 HD12 ILE 38 HD11 ILE 38 14.404 15.385 2.303 299 HD13 ILE 38 HD12 ILE 38 16.075 15.943 2.436 300 H SER 39 H SER 39 13.727 19.921 -0.366 301 HA SER 39 HA SER 39 16.378 20.977 -1.236 302 HB2 SER 39 HB2 SER 39 13.914 22.600 -0.509 303 HB3 SER 39 HB3 SER 39 15.344 23.119 -1.415 304 HG SER 39 HG SER 39 13.304 21.303 -2.233 305 H GLU 40 H GLU 40 17.408 22.409 0.451 306 HA GLU 40 HA GLU 40 17.493 21.099 2.929 307 HB2 GLU 40 HB2 GLU 40 18.429 23.902 2.207 308 HB3 GLU 40 HB3 GLU 40 18.894 23.012 3.663 309 HG2 GLU 40 HG2 GLU 40 19.874 21.209 2.232 310 HG3 GLU 40 HG3 GLU 40 19.478 22.138 0.795 311 H ASN 41 H ASN 41 15.508 23.912 2.051 312 HA ASN 41 HA ASN 41 14.670 24.686 4.660 313 HB2 ASN 41 HB2 ASN 41 14.135 25.991 2.627 314 HB3 ASN 41 HB3 ASN 41 13.116 24.679 2.023 315 HD21 ASN 41 HD22 ASN 41 10.972 24.382 2.936 316 HD22 ASN 41 HD21 ASN 41 10.307 25.557 4.048 317 H TYR 42 H TYR 42 13.693 21.899 2.670 318 HA TYR 42 HA TYR 42 11.203 21.352 3.918 319 HB2 TYR 42 HB2 TYR 42 12.031 20.411 1.759 320 HB3 TYR 42 HB3 TYR 42 13.225 19.467 2.648 321 HD1 TYR 42 HD1 TYR 42 9.614 19.858 1.967 322 HD2 TYR 42 HD2 TYR 42 12.675 17.468 3.843 323 HE1 TYR 42 HE1 TYR 42 8.011 17.961 2.179 324 HE2 TYR 42 HE2 TYR 42 11.093 15.588 4.049 325 HH TYR 42 HH TYR 42 9.004 14.791 3.609 326 H ILE 43 H ILE 43 14.538 20.220 4.640 327 HA ILE 43 HA ILE 43 13.895 18.567 6.859 328 HB ILE 43 HB ILE 43 16.419 20.192 6.241 329 HG12 ILE 43 HG12 ILE 43 17.079 17.569 5.819 330 HG13 ILE 43 HG13 ILE 43 15.383 17.541 5.316 331 HG21 ILE 43 HG21 ILE 43 16.094 17.825 8.140 332 HG22 ILE 43 HG22 ILE 43 17.593 18.705 7.778 333 HG23 ILE 43 HG23 ILE 43 16.283 19.515 8.644 334 HD11 ILE 43 HD13 ILE 43 15.867 19.321 3.674 335 HD12 ILE 43 HD11 ILE 43 17.547 19.400 4.281 336 HD13 ILE 43 HD12 ILE 43 16.963 17.938 3.473 337 H GLN 44 H GLN 44 14.769 22.086 6.708 338 HA GLN 44 HA GLN 44 14.556 22.316 9.539 339 HB2 GLN 44 HB2 GLN 44 15.901 23.792 7.883 340 HB3 GLN 44 HB3 GLN 44 14.402 24.685 7.669 341 HG2 GLN 44 HG2 GLN 44 15.768 25.774 9.385 342 HG3 GLN 44 HG3 GLN 44 14.348 25.099 10.164 343 HE21 GLN 44 HE22 GLN 44 14.925 24.242 12.206 344 HE22 GLN 44 HE21 GLN 44 16.382 23.336 12.542 345 H ALA 45 H ALA 45 12.098 22.606 7.027 346 HA ALA 45 HA ALA 45 10.101 23.908 8.527 347 HB1 ALA 45 HB3 ALA 45 9.702 21.608 6.551 348 HB2 ALA 45 HB1 ALA 45 8.495 22.788 7.056 349 HB3 ALA 45 HB2 ALA 45 9.897 23.325 6.106 350 H ILE 46 H ILE 46 11.087 20.433 8.491 351 HA ILE 46 HA ILE 46 8.994 19.624 10.293 352 HB ILE 46 HB ILE 46 11.655 18.255 9.798 353 HG12 ILE 46 HG12 ILE 46 9.069 17.670 8.331 354 HG13 ILE 46 HG13 ILE 46 10.346 18.665 7.650 355 HG21 ILE 46 HG21 ILE 46 10.293 17.504 11.793 356 HG22 ILE 46 HG22 ILE 46 8.958 17.124 10.692 357 HG23 ILE 46 HG23 ILE 46 10.496 16.240 10.588 358 HD11 ILE 46 HD13 ILE 46 10.694 15.739 8.398 359 HD12 ILE 46 HD11 ILE 46 10.545 16.415 6.774 360 HD13 ILE 46 HD12 ILE 46 11.947 16.826 7.783 361 H LYS 47 H LYS 47 12.496 20.422 10.671 362 HA LYS 47 HA LYS 47 12.650 19.888 13.423 363 HB2 LYS 47 HB2 LYS 47 14.064 21.966 11.714 364 HB3 LYS 47 HB3 LYS 47 14.543 21.626 13.373 365 HG2 LYS 47 HG2 LYS 47 15.343 19.448 12.817 366 HG3 LYS 47 HG3 LYS 47 14.616 19.502 11.195 367 HD2 LYS 47 HD2 LYS 47 16.073 21.270 10.510 368 HD3 LYS 47 HD3 LYS 47 16.709 21.470 12.153 369 HE2 LYS 47 HE2 LYS 47 17.908 19.418 12.029 370 HE3 LYS 47 HE3 LYS 47 17.211 19.013 10.460 371 HZ1 LYS 47 HZ3 LYS 47 18.963 21.360 11.024 372 HZ2 LYS 47 HZ1 LYS 47 19.446 20.003 10.265 373 HZ3 LYS 47 HZ2 LYS 47 18.359 20.999 9.560 374 H ASP 48 H ASP 48 11.687 22.927 11.750 375 HA ASP 48 HA ASP 48 11.672 24.608 13.990 376 HB2 ASP 48 HB2 ASP 48 11.589 25.420 11.689 377 HB3 ASP 48 HB3 ASP 48 9.982 24.723 11.462 378 H SER 49 H SER 49 8.824 22.853 12.546 379 HA SER 49 HA SER 49 7.013 23.592 14.637 380 HB2 SER 49 HB2 SER 49 7.018 21.165 12.806 381 HB3 SER 49 HB3 SER 49 5.626 21.787 13.717 382 HG SER 49 HG SER 49 5.660 22.512 11.528 383 H THR 50 H THR 50 9.198 20.737 14.230 384 HA THR 50 HA THR 50 8.392 19.326 16.488 385 HB THR 50 HB THR 50 11.152 19.508 15.253 386 HG1 THR 50 HG1 THR 50 9.737 18.838 13.751 387 HG21 THR 50 HG23 THR 50 11.383 18.406 17.387 388 HG22 THR 50 HG21 THR 50 9.909 17.452 17.119 389 HG23 THR 50 HG22 THR 50 11.353 17.164 16.123 390 H ILE 51 H ILE 51 10.736 22.062 16.326 391 HA ILE 51 HA ILE 51 11.321 21.935 19.163 392 HB ILE 51 HB ILE 51 11.826 23.996 16.984 393 HG12 ILE 51 HG12 ILE 51 13.828 22.219 18.458 394 HG13 ILE 51 HG13 ILE 51 13.032 21.695 16.984 395 HG21 ILE 51 HG21 ILE 51 12.858 24.039 19.860 396 HG22 ILE 51 HG22 ILE 51 13.406 25.113 18.556 397 HG23 ILE 51 HG23 ILE 51 11.753 25.220 19.124 398 HD11 ILE 51 HD13 ILE 51 13.942 23.684 15.775 399 HD12 ILE 51 HD11 ILE 51 14.881 24.097 17.233 400 HD13 ILE 51 HD12 ILE 51 15.174 22.572 16.394 401 H ASN 52 H ASN 52 9.234 24.047 17.114 402 HA ASN 52 HA ASN 52 8.569 25.812 19.276 403 HB2 ASN 52 HB2 ASN 52 7.467 25.372 16.480 404 HB3 ASN 52 HB3 ASN 52 6.654 26.453 17.593 405 HD21 ASN 52 HD22 ASN 52 9.704 25.968 15.844 406 HD22 ASN 52 HD21 ASN 52 10.253 27.623 15.993 407 H ASN 53 H ASN 53 6.978 22.916 18.024 408 HA ASN 53 HA ASN 53 4.651 23.371 19.868 409 HB2 ASN 53 HB2 ASN 53 4.293 23.749 17.386 410 HB3 ASN 53 HB3 ASN 53 4.675 22.055 17.112 411 HD21 ASN 53 HD22 ASN 53 2.189 24.237 17.709 412 HD22 ASN 53 HD21 ASN 53 0.944 23.112 18.200 413 H GLY 54 H GLY 54 6.543 20.924 18.073 414 HA2 GLY 54 HA2 GLY 54 7.385 19.084 19.753 415 HA3 GLY 54 HA3 GLY 54 5.647 18.740 19.857 416 HA PRO 55 HA PRO 55 7.576 16.933 15.864 417 HB2 PRO 55 HB2 PRO 55 7.518 14.257 16.452 418 HB3 PRO 55 HB3 PRO 55 8.931 15.296 16.796 419 HG2 PRO 55 HG2 PRO 55 6.712 14.480 18.686 420 HG3 PRO 55 HG3 PRO 55 8.479 14.436 18.964 421 HD2 PRO 55 HD2 PRO 55 6.910 16.489 19.869 422 HD3 PRO 55 HD3 PRO 55 8.561 16.809 19.260 423 H TYR 56 H TYR 56 6.195 16.048 14.291 424 HA TYR 56 HA TYR 56 3.361 15.653 15.154 425 HB2 TYR 56 HB2 TYR 56 2.629 17.197 13.477 426 HB3 TYR 56 HB3 TYR 56 3.739 17.971 14.581 427 HD1 TYR 56 HD1 TYR 56 6.222 18.295 13.817 428 HD2 TYR 56 HD2 TYR 56 2.960 17.372 11.140 429 HE1 TYR 56 HE1 TYR 56 7.545 19.141 11.917 430 HE2 TYR 56 HE2 TYR 56 4.246 18.316 9.249 431 HH TYR 56 HH TYR 56 6.213 19.340 8.582 432 H TYR 57 H TYR 57 5.686 13.921 13.909 433 HA TYR 57 HA TYR 57 3.785 12.283 12.370 434 HB2 TYR 57 HB2 TYR 57 6.473 13.159 11.351 435 HB3 TYR 57 HB3 TYR 57 5.831 11.552 11.012 436 HD1 TYR 57 HD1 TYR 57 3.937 11.154 9.580 437 HD2 TYR 57 HD2 TYR 57 5.244 15.179 10.425 438 HE1 TYR 57 HE1 TYR 57 2.377 12.015 7.861 439 HE2 TYR 57 HE2 TYR 57 3.684 16.046 8.716 440 HH TYR 57 HH TYR 57 1.966 15.526 7.213 441 H ILE 58 H ILE 58 3.465 11.076 14.183 442 HA ILE 58 HA ILE 58 5.680 9.501 15.331 443 HB ILE 58 HB ILE 58 3.651 11.110 16.943 444 HG12 ILE 58 HG12 ILE 58 5.536 12.540 16.269 445 HG13 ILE 58 HG13 ILE 58 5.465 12.275 17.999 446 HG21 ILE 58 HG21 ILE 58 3.884 8.977 18.022 447 HG22 ILE 58 HG22 ILE 58 5.644 8.983 17.842 448 HG23 ILE 58 HG23 ILE 58 4.845 10.126 18.949 449 HD11 ILE 58 HD13 ILE 58 7.788 12.178 17.272 450 HD12 ILE 58 HD11 ILE 58 7.295 10.582 17.812 451 HD13 ILE 58 HD12 ILE 58 7.395 10.930 16.076 452 H LEU 59 H LEU 59 4.961 7.419 15.650 453 HA LEU 59 HA LEU 59 2.112 6.867 14.896 454 HB2 LEU 59 HB2 LEU 59 4.641 5.325 14.173 455 HB3 LEU 59 HB3 LEU 59 3.006 4.793 13.865 456 HG LEU 59 HG LEU 59 3.795 5.563 11.825 457 HD11 LEU 59 HD11 LEU 59 2.283 7.297 11.160 458 HD12 LEU 59 HD12 LEU 59 1.484 6.282 12.367 459 HD13 LEU 59 HD13 LEU 59 2.114 7.882 12.823 460 HD21 LEU 59 HD23 LEU 59 5.746 6.871 12.449 461 HD22 LEU 59 HD21 LEU 59 4.685 7.798 11.379 462 HD23 LEU 59 HD22 LEU 59 4.726 8.183 13.067 463 H ALA 60 H ALA 60 4.822 6.056 17.004 464 HA ALA 60 HA ALA 60 3.049 4.931 18.954 465 HB1 ALA 60 HB3 ALA 60 3.457 2.875 17.578 466 HB2 ALA 60 HB1 ALA 60 5.211 3.146 17.708 467 HB3 ALA 60 HB2 ALA 60 4.261 2.753 19.152 468 HA PRO 61 HA PRO 61 6.459 6.652 21.395 469 HB2 PRO 61 HB2 PRO 61 6.294 4.144 23.064 470 HB3 PRO 61 HB3 PRO 61 6.335 5.858 23.589 471 HG2 PRO 61 HG2 PRO 61 4.006 4.466 23.600 472 HG3 PRO 61 HG3 PRO 61 4.049 6.170 23.040 473 HD2 PRO 61 HD2 PRO 61 4.026 3.649 21.371 474 HD3 PRO 61 HD3 PRO 61 3.100 5.168 21.150 475 H GLY 62 H GLY 62 8.511 6.593 20.579 476 HA2 GLY 62 HA2 GLY 62 10.639 5.557 20.325 477 HA3 GLY 62 HA3 GLY 62 9.872 3.992 20.116 478 H VAL 63 H VAL 63 7.882 5.643 18.147 479 HA VAL 63 HA VAL 63 9.665 5.323 15.771 480 HB VAL 63 HB VAL 63 6.849 4.256 16.238 481 HG11 VAL 63 HG11 VAL 63 8.563 4.153 13.721 482 HG12 VAL 63 HG12 VAL 63 7.065 3.215 13.971 483 HG13 VAL 63 HG13 VAL 63 7.011 4.978 13.908 484 HG21 VAL 63 HG23 VAL 63 8.523 2.831 17.302 485 HG22 VAL 63 HG21 VAL 63 7.940 2.039 15.840 486 HG23 VAL 63 HG22 VAL 63 9.521 2.839 15.831 487 H ALA 64 H ALA 64 9.765 7.078 14.607 488 HA ALA 64 HA ALA 64 7.449 8.935 14.404 489 HB1 ALA 64 HB3 ALA 64 9.068 10.743 14.053 490 HB2 ALA 64 HB1 ALA 64 9.425 9.937 15.585 491 HB3 ALA 64 HB2 ALA 64 10.419 9.592 14.149 492 H MET 65 H MET 65 7.476 10.102 12.272 493 HA MET 65 HA MET 65 8.790 8.577 10.137 494 HB2 MET 65 HB2 MET 65 6.578 7.641 10.350 495 HB3 MET 65 HB3 MET 65 5.860 9.230 10.011 496 HG2 MET 65 HG2 MET 65 7.477 8.935 7.836 497 HG3 MET 65 HG3 MET 65 7.211 7.244 8.224 498 HE1 MET 65 HE3 MET 65 3.204 7.083 7.893 499 HE2 MET 65 HE1 MET 65 4.646 6.184 8.406 500 HE3 MET 65 HE2 MET 65 4.024 7.539 9.393 501 HA PRO 66 HA PRO 66 8.898 13.302 10.216 502 HB2 PRO 66 HB2 PRO 66 11.710 12.745 9.188 503 HB3 PRO 66 HB3 PRO 66 11.159 14.081 10.245 504 HG2 PRO 66 HG2 PRO 66 12.339 11.948 11.360 505 HG3 PRO 66 HG3 PRO 66 10.833 12.580 12.092 506 HD2 PRO 66 HD2 PRO 66 11.149 10.230 10.201 507 HD3 PRO 66 HD3 PRO 66 10.236 10.328 11.730 508 H HIS 67 H HIS 67 8.518 14.676 8.641 509 HA HIS 67 HA HIS 67 8.808 14.524 5.830 510 HB2 HIS 67 HB2 HIS 67 7.410 12.584 5.774 511 HB3 HIS 67 HB3 HIS 67 6.408 13.158 7.092 512 HD1 HIS 67 HD1 HIS 67 4.318 14.571 6.530 513 HD2 HIS 67 HD2 HIS 67 6.782 13.753 3.215 514 HE1 HIS 67 HE1 HIS 67 3.010 15.252 4.465 515 H ALA 68 H ALA 68 7.593 16.320 4.884 516 HA ALA 68 HA ALA 68 5.995 18.082 6.617 517 HB1 ALA 68 HB3 ALA 68 8.403 19.021 4.991 518 HB2 ALA 68 HB1 ALA 68 7.169 20.073 5.709 519 HB3 ALA 68 HB2 ALA 68 8.215 19.122 6.756 520 H ARG 69 H ARG 69 4.722 19.561 5.229 521 HA ARG 69 HA ARG 69 3.410 18.145 3.168 522 HB2 ARG 69 HB2 ARG 69 3.619 21.128 3.715 523 HB3 ARG 69 HB3 ARG 69 2.480 20.409 2.554 524 HG2 ARG 69 HG2 ARG 69 1.532 19.047 4.491 525 HG3 ARG 69 HG3 ARG 69 2.519 20.036 5.576 526 HD2 ARG 69 HD2 ARG 69 0.286 20.962 3.726 527 HD3 ARG 69 HD3 ARG 69 0.252 20.942 5.487 528 HE ARG 69 HE ARG 69 1.457 22.938 3.714 529 HH11 ARG 69 HH11 ARG 69 1.489 21.765 7.082 530 HH12 ARG 69 HH12 ARG 69 2.182 23.222 7.691 531 HH21 ARG 69 HH21 ARG 69 2.312 24.723 4.442 532 HH22 ARG 69 HH22 ARG 69 2.675 25.014 6.135 533 HA PRO 70 HA PRO 70 6.189 18.160 -0.257 534 HB2 PRO 70 HB2 PRO 70 3.788 19.215 -1.826 535 HB3 PRO 70 HB3 PRO 70 4.967 17.977 -2.323 536 HG2 PRO 70 HG2 PRO 70 2.563 17.240 -1.316 537 HG3 PRO 70 HG3 PRO 70 4.035 16.390 -0.749 538 HD2 PRO 70 HD2 PRO 70 2.452 18.534 0.649 539 HD3 PRO 70 HD3 PRO 70 3.277 17.092 1.318 540 H GLU 71 H GLU 71 4.031 21.040 -0.126 541 HA GLU 71 HA GLU 71 5.511 22.840 -1.653 542 HB2 GLU 71 HB2 GLU 71 4.170 24.568 -0.531 543 HB3 GLU 71 HB3 GLU 71 3.193 23.178 -1.017 544 HG2 GLU 71 HG2 GLU 71 3.177 22.331 1.293 545 HG3 GLU 71 HG3 GLU 71 4.260 23.622 1.810 546 H CYS 72 H CYS 72 6.502 21.571 1.388 547 HA CYS 72 HA CYS 72 7.929 23.963 2.293 548 HB2 CYS 72 HB2 CYS 72 8.075 21.076 3.275 549 HB3 CYS 72 HB3 CYS 72 8.765 22.502 4.070 550 HG CYS 72 HG CYS 72 5.652 21.696 3.414 551 H GLY 73 H GLY 73 8.478 21.769 -0.207 552 HA2 GLY 73 HA2 GLY 73 10.467 22.580 -1.474 553 HA3 GLY 73 HA3 GLY 73 11.445 22.196 -0.054 554 H ALA 74 H ALA 74 8.835 19.932 -0.782 555 HA ALA 74 HA ALA 74 10.742 17.823 -1.480 556 HB1 ALA 74 HB3 ALA 74 8.817 16.436 -1.811 557 HB2 ALA 74 HB1 ALA 74 8.632 17.300 -0.278 558 HB3 ALA 74 HB2 ALA 74 7.743 17.845 -1.736 559 H LEU 75 H LEU 75 11.100 16.983 -3.478 560 HA LEU 75 HA LEU 75 10.234 18.593 -5.846 561 HB2 LEU 75 HB2 LEU 75 12.960 17.367 -5.285 562 HB3 LEU 75 HB3 LEU 75 12.509 18.252 -6.732 563 HG LEU 75 HG LEU 75 12.682 19.433 -3.924 564 HD11 LEU 75 HD11 LEU 75 14.879 18.832 -4.786 565 HD12 LEU 75 HD12 LEU 75 14.557 19.689 -6.309 566 HD13 LEU 75 HD13 LEU 75 14.691 20.587 -4.779 567 HD21 LEU 75 HD23 LEU 75 12.227 20.802 -6.619 568 HD22 LEU 75 HD21 LEU 75 11.043 20.668 -5.303 569 HD23 LEU 75 HD22 LEU 75 12.503 21.628 -5.068 570 H LYS 76 H LYS 76 11.177 15.422 -4.525 571 HA LYS 76 HA LYS 76 9.699 14.072 -6.667 572 HB2 LYS 76 HB2 LYS 76 12.515 13.373 -5.784 573 HB3 LYS 76 HB3 LYS 76 11.517 12.366 -6.838 574 HG2 LYS 76 HG2 LYS 76 11.507 14.166 -8.538 575 HG3 LYS 76 HG3 LYS 76 12.511 15.180 -7.492 576 HD2 LYS 76 HD2 LYS 76 13.377 12.471 -8.584 577 HD3 LYS 76 HD3 LYS 76 13.777 14.042 -9.301 578 HE2 LYS 76 HE2 LYS 76 14.831 14.721 -7.111 579 HE3 LYS 76 HE3 LYS 76 14.577 13.071 -6.519 580 HZ1 LYS 76 HZ3 LYS 76 16.014 12.290 -8.317 581 HZ2 LYS 76 HZ1 LYS 76 16.242 13.826 -8.848 582 HZ3 LYS 76 HZ2 LYS 76 16.794 13.384 -7.376 583 H THR 77 H THR 77 9.142 11.765 -5.902 584 HA THR 77 HA THR 77 8.665 11.842 -3.058 585 HB THR 77 HB THR 77 7.594 10.207 -5.380 586 HG1 THR 77 HG1 THR 77 6.280 11.742 -5.645 587 HG21 THR 77 HG23 THR 77 6.605 10.405 -2.514 588 HG22 THR 77 HG21 THR 77 5.775 9.570 -3.858 589 HG23 THR 77 HG22 THR 77 7.337 8.977 -3.287 590 H GLY 78 H GLY 78 9.586 10.453 -1.548 591 HA2 GLY 78 HA2 GLY 78 10.752 7.924 -2.159 592 HA3 GLY 78 HA3 GLY 78 12.011 9.165 -2.066 593 H MET 79 H MET 79 12.363 7.373 -0.185 594 HA MET 79 HA MET 79 11.317 8.476 2.363 595 HB2 MET 79 HB2 MET 79 11.190 5.605 1.356 596 HB3 MET 79 HB3 MET 79 11.016 6.022 3.060 597 HG2 MET 79 HG2 MET 79 9.021 7.286 2.671 598 HG3 MET 79 HG3 MET 79 9.187 7.133 0.921 599 HE1 MET 79 HE3 MET 79 7.013 6.250 0.406 600 HE2 MET 79 HE1 MET 79 6.247 4.782 1.039 601 HE3 MET 79 HE2 MET 79 6.365 6.237 2.055 602 H SER 80 H SER 80 12.392 7.427 4.245 603 HA SER 80 HA SER 80 15.142 6.457 3.807 604 HB2 SER 80 HB2 SER 80 14.609 8.503 5.958 605 HB3 SER 80 HB3 SER 80 16.151 8.026 5.252 606 HG SER 80 HG SER 80 15.094 10.141 4.749 607 H LEU 81 H LEU 81 15.957 5.462 5.870 608 HA LEU 81 HA LEU 81 13.887 4.537 7.775 609 HB2 LEU 81 HB2 LEU 81 14.130 3.105 5.711 610 HB3 LEU 81 HB3 LEU 81 15.836 2.924 6.069 611 HG LEU 81 HG LEU 81 15.300 1.676 8.132 612 HD11 LEU 81 HD11 LEU 81 13.125 2.556 8.702 613 HD12 LEU 81 HD12 LEU 81 12.425 1.972 7.166 614 HD13 LEU 81 HD13 LEU 81 12.977 0.824 8.406 615 HD21 LEU 81 HD23 LEU 81 14.224 -0.269 6.729 616 HD22 LEU 81 HD21 LEU 81 14.307 0.899 5.382 617 HD23 LEU 81 HD22 LEU 81 15.768 0.409 6.183 618 H THR 82 H THR 82 14.981 5.868 9.394 619 HA THR 82 HA THR 82 17.871 5.345 9.856 620 HB THR 82 HB THR 82 16.033 7.474 11.040 621 HG1 THR 82 HG1 THR 82 15.993 7.784 8.864 622 HG21 THR 82 HG23 THR 82 18.136 8.712 11.384 623 HG22 THR 82 HG21 THR 82 18.117 7.160 12.236 624 HG23 THR 82 HG22 THR 82 19.056 7.327 10.734 625 H LEU 83 H LEU 83 18.480 4.291 11.781 626 HA LEU 83 HA LEU 83 16.466 4.027 13.963 627 HB2 LEU 83 HB2 LEU 83 16.694 1.876 12.658 628 HB3 LEU 83 HB3 LEU 83 18.420 1.903 13.049 629 HG LEU 83 HG LEU 83 17.642 1.954 15.543 630 HD11 LEU 83 HD11 LEU 83 15.101 0.751 14.348 631 HD12 LEU 83 HD12 LEU 83 15.505 0.979 16.060 632 HD13 LEU 83 HD13 LEU 83 15.222 2.388 15.041 633 HD21 LEU 83 HD23 LEU 83 17.210 -0.497 13.824 634 HD22 LEU 83 HD21 LEU 83 18.756 0.038 14.512 635 HD23 LEU 83 HD22 LEU 83 17.453 -0.510 15.580 636 H LEU 84 H LEU 84 17.364 4.278 16.001 637 HA LEU 84 HA LEU 84 20.235 5.094 16.182 638 HB2 LEU 84 HB2 LEU 84 17.718 6.259 17.389 639 HB3 LEU 84 HB3 LEU 84 19.288 6.451 18.168 640 HG LEU 84 HG LEU 84 20.169 7.766 16.391 641 HD11 LEU 84 HD11 LEU 84 17.550 7.262 14.932 642 HD12 LEU 84 HD12 LEU 84 18.704 8.553 14.503 643 HD13 LEU 84 HD13 LEU 84 19.197 6.868 14.388 644 HD21 LEU 84 HD23 LEU 84 17.370 8.620 17.246 645 HD22 LEU 84 HD21 LEU 84 18.896 8.884 18.128 646 HD23 LEU 84 HD22 LEU 84 18.605 9.699 16.587 647 H GLU 85 H GLU 85 21.344 3.902 17.708 648 HA GLU 85 HA GLU 85 20.124 1.760 19.106 649 HB2 GLU 85 HB2 GLU 85 22.823 3.112 19.468 650 HB3 GLU 85 HB3 GLU 85 22.323 1.653 20.330 651 HG2 GLU 85 HG2 GLU 85 21.950 0.506 18.138 652 HG3 GLU 85 HG3 GLU 85 22.568 1.928 17.303 653 H GLN 86 H GLN 86 21.263 4.922 20.241 654 HA GLN 86 HA GLN 86 20.124 4.491 22.926 655 HB2 GLN 86 HB2 GLN 86 21.594 6.856 21.671 656 HB3 GLN 86 HB3 GLN 86 21.119 6.761 23.362 657 HG2 GLN 86 HG2 GLN 86 22.477 4.723 23.695 658 HG3 GLN 86 HG3 GLN 86 22.942 4.725 21.995 659 HE21 GLN 86 HE22 GLN 86 24.388 6.307 21.203 660 HE22 GLN 86 HE21 GLN 86 25.454 7.193 22.278 661 H GLY 87 H GLY 87 18.957 5.760 19.967 662 HA2 GLY 87 HA2 GLY 87 17.135 7.049 19.395 663 HA3 GLY 87 HA3 GLY 87 16.532 6.880 21.050 664 H VAL 88 H VAL 88 15.993 9.264 20.211 665 HA VAL 88 HA VAL 88 17.658 10.856 21.945 666 HB VAL 88 HB VAL 88 18.423 11.025 19.342 667 HG11 VAL 88 HG11 VAL 88 16.380 13.246 19.516 668 HG12 VAL 88 HG12 VAL 88 17.539 12.915 18.223 669 HG13 VAL 88 HG13 VAL 88 16.232 11.753 18.549 670 HG21 VAL 88 HG23 VAL 88 19.587 11.960 21.191 671 HG22 VAL 88 HG21 VAL 88 19.449 13.145 19.881 672 HG23 VAL 88 HG22 VAL 88 18.416 13.297 21.322 673 H TYR 89 H TYR 89 16.377 13.096 22.220 674 HA TYR 89 HA TYR 89 13.528 12.241 22.422 675 HB2 TYR 89 HB2 TYR 89 15.063 12.147 24.488 676 HB3 TYR 89 HB3 TYR 89 14.923 13.887 24.524 677 HD1 TYR 89 HD1 TYR 89 11.700 13.193 23.378 678 HD2 TYR 89 HD2 TYR 89 14.222 12.419 26.821 679 HE1 TYR 89 HE1 TYR 89 9.716 12.838 24.771 680 HE2 TYR 89 HE2 TYR 89 12.213 12.087 28.214 681 HH TYR 89 HH TYR 89 9.887 12.035 28.268 682 H PHE 90 H PHE 90 12.685 13.350 20.737 683 HA PHE 90 HA PHE 90 13.048 16.067 20.085 684 HB2 PHE 90 HB2 PHE 90 10.627 14.227 20.024 685 HB3 PHE 90 HB3 PHE 90 10.608 15.850 19.327 686 HD1 PHE 90 HD1 PHE 90 13.015 16.207 17.859 687 HD2 PHE 90 HD2 PHE 90 10.596 12.664 18.241 688 HE1 PHE 90 HE1 PHE 90 13.887 15.388 15.700 689 HE2 PHE 90 HE2 PHE 90 11.446 11.859 16.046 690 HZ PHE 90 HZ PHE 90 13.092 13.231 14.772 691 HA PRO 91 HA PRO 91 11.744 17.945 23.812 692 HB2 PRO 91 HB2 PRO 91 10.924 20.465 22.992 693 HB3 PRO 91 HB3 PRO 91 12.628 19.935 23.139 694 HG2 PRO 91 HG2 PRO 91 10.895 19.990 20.662 695 HG3 PRO 91 HG3 PRO 91 12.583 20.573 20.844 696 HD2 PRO 91 HD2 PRO 91 12.027 18.146 19.769 697 HD3 PRO 91 HD3 PRO 91 13.430 18.356 20.862 698 H GLY 92 H GLY 92 9.985 17.657 25.018 699 HA2 GLY 92 HA2 GLY 92 7.842 17.630 25.748 700 HA3 GLY 92 HA3 GLY 92 7.391 18.620 24.355 701 H ASN 93 H ASN 93 8.861 15.596 23.352 702 HA ASN 93 HA ASN 93 6.293 14.625 22.397 703 HB2 ASN 93 HB2 ASN 93 8.551 14.369 21.235 704 HB3 ASN 93 HB3 ASN 93 8.963 13.172 22.461 705 HD21 ASN 93 HD22 ASN 93 8.857 11.220 21.341 706 HD22 ASN 93 HD21 ASN 93 7.510 10.748 20.319 707 H ASP 94 H ASP 94 5.678 12.246 22.874 708 HA ASP 94 HA ASP 94 5.189 11.961 25.660 709 HB2 ASP 94 HB2 ASP 94 3.719 11.036 23.916 710 HB3 ASP 94 HB3 ASP 94 4.986 9.899 23.439 711 H GLU 95 H GLU 95 7.630 10.465 23.559 712 HA GLU 95 HA GLU 95 9.365 9.877 25.787 713 HB2 GLU 95 HB2 GLU 95 8.778 7.792 26.159 714 HB3 GLU 95 HB3 GLU 95 7.479 7.910 24.979 715 HG2 GLU 95 HG2 GLU 95 8.884 7.037 23.218 716 HG3 GLU 95 HG3 GLU 95 10.281 6.971 24.304 717 HA PRO 96 HA PRO 96 12.384 10.467 22.579 718 HB2 PRO 96 HB2 PRO 96 14.321 8.518 23.017 719 HB3 PRO 96 HB3 PRO 96 14.154 10.024 23.965 720 HG2 PRO 96 HG2 PRO 96 13.071 7.276 24.628 721 HG3 PRO 96 HG3 PRO 96 13.961 8.408 25.699 722 HD2 PRO 96 HD2 PRO 96 11.272 8.262 25.805 723 HD3 PRO 96 HD3 PRO 96 12.078 9.848 25.881 724 H ILE 97 H ILE 97 13.304 9.555 20.614 725 HA ILE 97 HA ILE 97 11.646 7.318 19.513 726 HB ILE 97 HB ILE 97 12.775 9.803 18.175 727 HG12 ILE 97 HG12 ILE 97 10.840 10.435 19.434 728 HG13 ILE 97 HG13 ILE 97 10.379 10.360 17.744 729 HG21 ILE 97 HG21 ILE 97 11.177 7.532 16.914 730 HG22 ILE 97 HG22 ILE 97 11.630 9.052 16.136 731 HG23 ILE 97 HG23 ILE 97 12.878 7.908 16.590 732 HD11 ILE 97 HD13 ILE 97 8.614 9.448 19.162 733 HD12 ILE 97 HD11 ILE 97 9.269 8.164 18.143 734 HD13 ILE 97 HD12 ILE 97 9.703 8.279 19.873 735 H LYS 98 H LYS 98 12.651 5.682 18.602 736 HA LYS 98 HA LYS 98 15.631 5.765 18.368 737 HB2 LYS 98 HB2 LYS 98 13.699 3.500 19.003 738 HB3 LYS 98 HB3 LYS 98 15.326 3.211 18.370 739 HG2 LYS 98 HG2 LYS 98 16.356 4.335 20.259 740 HG3 LYS 98 HG3 LYS 98 14.783 4.818 20.899 741 HD2 LYS 98 HD2 LYS 98 15.782 2.875 22.097 742 HD3 LYS 98 HD3 LYS 98 14.187 2.563 21.429 743 HE2 LYS 98 HE2 LYS 98 15.650 0.630 21.143 744 HE3 LYS 98 HE3 LYS 98 15.124 1.265 19.587 745 HZ1 LYS 98 HZ3 LYS 98 17.781 1.806 20.810 746 HZ2 LYS 98 HZ1 LYS 98 17.487 0.702 19.637 747 HZ3 LYS 98 HZ2 LYS 98 17.311 2.304 19.327 748 H LEU 99 H LEU 99 12.640 5.641 16.542 749 HA LEU 99 HA LEU 99 14.290 4.922 14.185 750 HB2 LEU 99 HB2 LEU 99 12.989 2.902 15.072 751 HB3 LEU 99 HB3 LEU 99 11.527 3.866 14.891 752 HG LEU 99 HG LEU 99 12.152 4.053 12.381 753 HD11 LEU 99 HD11 LEU 99 14.513 3.018 12.752 754 HD12 LEU 99 HD12 LEU 99 13.684 1.474 12.852 755 HD13 LEU 99 HD13 LEU 99 13.565 2.441 11.381 756 HD21 LEU 99 HD23 LEU 99 10.269 2.797 13.172 757 HD22 LEU 99 HD21 LEU 99 11.122 1.853 11.952 758 HD23 LEU 99 HD22 LEU 99 11.307 1.453 13.682 759 H LEU 100 H LEU 100 13.870 5.977 12.367 760 HA LEU 100 HA LEU 100 11.620 7.917 12.296 761 HB2 LEU 100 HB2 LEU 100 14.458 8.771 11.617 762 HB3 LEU 100 HB3 LEU 100 13.008 9.723 11.717 763 HG LEU 100 HG LEU 100 13.063 8.835 14.253 764 HD11 LEU 100 HD11 LEU 100 15.171 7.491 13.932 765 HD12 LEU 100 HD12 LEU 100 16.021 8.990 13.536 766 HD13 LEU 100 HD13 LEU 100 15.338 8.749 15.161 767 HD21 LEU 100 HD23 LEU 100 14.768 11.152 13.308 768 HD22 LEU 100 HD21 LEU 100 13.016 11.188 13.599 769 HD23 LEU 100 HD22 LEU 100 14.130 10.909 14.948 770 H ILE 101 H ILE 101 10.594 6.784 10.634 771 HA ILE 101 HA ILE 101 12.099 6.155 8.200 772 HB ILE 101 HB ILE 101 9.217 5.798 9.090 773 HG12 ILE 101 HG12 ILE 101 9.647 3.540 8.208 774 HG13 ILE 101 HG13 ILE 101 11.278 4.021 7.739 775 HG21 ILE 101 HG21 ILE 101 8.555 5.157 6.891 776 HG22 ILE 101 HG22 ILE 101 9.053 6.837 6.814 777 HG23 ILE 101 HG23 ILE 101 10.141 5.579 6.193 778 HD11 ILE 101 HD13 ILE 101 11.069 2.695 9.877 779 HD12 ILE 101 HD11 ILE 101 11.979 4.207 10.020 780 HD13 ILE 101 HD12 ILE 101 10.302 4.118 10.617 781 H GLY 102 H GLY 102 12.589 7.685 6.740 782 HA2 GLY 102 HA2 GLY 102 11.386 10.394 6.937 783 HA3 GLY 102 HA3 GLY 102 12.677 9.899 5.840 784 H LEU 103 H LEU 103 10.004 11.215 5.268 785 HA LEU 103 HA LEU 103 9.529 9.638 2.843 786 HB2 LEU 103 HB2 LEU 103 7.689 9.015 4.596 787 HB3 LEU 103 HB3 LEU 103 7.159 10.672 4.426 788 HG LEU 103 HG LEU 103 6.971 8.373 2.416 789 HD11 LEU 103 HD11 LEU 103 4.971 10.486 3.422 790 HD12 LEU 103 HD12 LEU 103 4.610 8.949 2.627 791 HD13 LEU 103 HD13 LEU 103 5.239 8.976 4.278 792 HD21 LEU 103 HD23 LEU 103 6.673 11.344 1.793 793 HD22 LEU 103 HD21 LEU 103 7.619 10.078 0.923 794 HD23 LEU 103 HD22 LEU 103 5.874 10.095 0.871 795 H SER 104 H SER 104 9.318 11.107 1.149 796 HA SER 104 HA SER 104 8.448 13.864 1.627 797 HB2 SER 104 HB2 SER 104 10.958 13.356 0.007 798 HB3 SER 104 HB3 SER 104 10.276 14.895 0.586 799 HG SER 104 HG SER 104 10.666 13.487 2.729 800 H ALA 105 H ALA 105 7.369 14.665 -0.260 801 HA ALA 105 HA ALA 105 7.001 12.727 -2.455 802 HB1 ALA 105 HB3 ALA 105 4.554 12.802 -2.104 803 HB2 ALA 105 HB1 ALA 105 5.389 12.026 -0.742 804 HB3 ALA 105 HB2 ALA 105 4.806 13.704 -0.595 805 H ALA 106 H ALA 106 6.413 13.707 -4.354 806 HA ALA 106 HA ALA 106 6.861 16.560 -4.432 807 HB1 ALA 106 HB3 ALA 106 7.765 15.028 -6.154 808 HB2 ALA 106 HB1 ALA 106 6.114 14.592 -6.649 809 HB3 ALA 106 HB2 ALA 106 6.712 16.249 -6.883 810 H ASP 107 H ASP 107 4.036 14.487 -4.367 811 HA ASP 107 HA ASP 107 2.242 16.841 -4.703 812 HB2 ASP 107 HB2 ASP 107 2.429 15.813 -6.937 813 HB3 ASP 107 HB3 ASP 107 2.024 14.234 -6.264 814 H ALA 108 H ALA 108 0.101 16.463 -3.798 815 HA ALA 108 HA ALA 108 0.185 15.192 -1.307 816 HB1 ALA 108 HB3 ALA 108 -2.240 16.038 -2.947 817 HB2 ALA 108 HB1 ALA 108 -2.225 15.704 -1.203 818 HB3 ALA 108 HB2 ALA 108 -1.306 17.079 -1.843 819 H ASP 109 H ASP 109 -0.978 13.883 -4.438 820 HA ASP 109 HA ASP 109 -2.191 11.548 -3.120 821 HB2 ASP 109 HB2 ASP 109 -3.139 12.287 -5.173 822 HB3 ASP 109 HB3 ASP 109 -1.574 12.149 -6.012 823 H SER 110 H SER 110 0.931 12.366 -4.605 824 HA SER 110 HA SER 110 2.073 9.739 -4.435 825 HB2 SER 110 HB2 SER 110 3.559 12.394 -4.185 826 HB3 SER 110 HB3 SER 110 4.192 10.828 -4.689 827 HG SER 110 HG SER 110 3.750 12.103 -6.499 828 H HIS 111 H HIS 111 1.852 12.487 -2.124 829 HA HIS 111 HA HIS 111 3.177 11.283 0.076 830 HB2 HIS 111 HB2 HIS 111 2.725 13.575 0.293 831 HB3 HIS 111 HB3 HIS 111 1.075 13.411 -0.245 832 HD1 HIS 111 HD1 HIS 111 3.119 13.119 2.965 833 HD2 HIS 111 HD2 HIS 111 -0.825 12.918 1.511 834 HE1 HIS 111 HE1 HIS 111 1.596 13.088 5.008 835 H ILE 112 H ILE 112 -0.333 11.190 -0.805 836 HA ILE 112 HA ILE 112 -1.158 9.539 1.326 837 HB ILE 112 HB ILE 112 -2.155 9.902 -1.526 838 HG12 ILE 112 HG12 ILE 112 -2.340 11.814 0.144 839 HG13 ILE 112 HG13 ILE 112 -3.799 11.337 -0.705 840 HG21 ILE 112 HG21 ILE 112 -3.479 8.215 0.608 841 HG22 ILE 112 HG22 ILE 112 -4.301 8.844 -0.845 842 HG23 ILE 112 HG23 ILE 112 -2.952 7.723 -1.017 843 HD11 ILE 112 HD13 ILE 112 -4.640 10.222 1.285 844 HD12 ILE 112 HD11 ILE 112 -3.099 10.513 2.139 845 HD13 ILE 112 HD12 ILE 112 -4.146 11.876 1.675 846 H GLY 113 H GLY 113 -0.126 8.467 -2.004 847 HA2 GLY 113 HA2 GLY 113 -0.424 5.713 -1.485 848 HA3 GLY 113 HA3 GLY 113 0.659 6.424 -2.700 849 H ALA 114 H ALA 114 2.358 7.873 -0.915 850 HA ALA 114 HA ALA 114 4.258 5.840 -0.202 851 HB1 ALA 114 HB3 ALA 114 4.063 8.831 0.371 852 HB2 ALA 114 HB1 ALA 114 5.505 7.839 0.629 853 HB3 ALA 114 HB2 ALA 114 4.884 8.082 -1.005 854 H ILE 115 H ILE 115 2.187 8.066 1.806 855 HA ILE 115 HA ILE 115 2.961 7.189 4.324 856 HB ILE 115 HB ILE 115 0.569 8.335 3.051 857 HG12 ILE 115 HG12 ILE 115 2.510 9.814 3.509 858 HG13 ILE 115 HG13 ILE 115 1.004 10.350 4.234 859 HG21 ILE 115 HG21 ILE 115 0.526 7.510 5.912 860 HG22 ILE 115 HG22 ILE 115 -0.549 8.768 5.210 861 HG23 ILE 115 HG23 ILE 115 -0.604 7.122 4.586 862 HD11 ILE 115 HD13 ILE 115 2.988 10.608 5.729 863 HD12 ILE 115 HD11 ILE 115 1.712 9.599 6.440 864 HD13 ILE 115 HD12 ILE 115 3.156 8.841 5.743 865 H GLN 116 H GLN 116 0.434 5.966 2.054 866 HA GLN 116 HA GLN 116 -0.552 3.941 3.831 867 HB2 GLN 116 HB2 GLN 116 -0.812 4.421 0.834 868 HB3 GLN 116 HB3 GLN 116 -1.637 3.099 1.657 869 HG2 GLN 116 HG2 GLN 116 -1.918 6.025 2.416 870 HG3 GLN 116 HG3 GLN 116 -3.027 5.179 1.344 871 HE21 GLN 116 HE22 GLN 116 -3.320 6.465 4.154 872 HE22 GLN 116 HE21 GLN 116 -4.079 5.215 5.104 873 H ALA 117 H ALA 117 2.443 4.027 2.112 874 HA ALA 117 HA ALA 117 2.581 1.116 1.934 875 HB1 ALA 117 HB3 ALA 117 4.739 3.198 1.376 876 HB2 ALA 117 HB1 ALA 117 4.757 1.493 0.917 877 HB3 ALA 117 HB2 ALA 117 3.622 2.606 0.136 878 H LEU 118 H LEU 118 3.857 3.952 3.669 879 HA LEU 118 HA LEU 118 5.490 2.401 5.416 880 HB2 LEU 118 HB2 LEU 118 4.363 5.230 5.681 881 HB3 LEU 118 HB3 LEU 118 5.628 4.542 6.724 882 HG LEU 118 HG LEU 118 5.784 4.784 3.695 883 HD11 LEU 118 HD11 LEU 118 6.936 6.520 5.914 884 HD12 LEU 118 HD12 LEU 118 7.419 6.629 4.211 885 HD13 LEU 118 HD13 LEU 118 5.743 6.953 4.688 886 HD21 LEU 118 HD23 LEU 118 7.356 3.155 4.073 887 HD22 LEU 118 HD21 LEU 118 8.376 4.498 4.578 888 HD23 LEU 118 HD22 LEU 118 7.545 3.520 5.793 889 H SER 119 H SER 119 2.125 3.452 5.627 890 HA SER 119 HA SER 119 1.646 2.681 8.294 891 HB2 SER 119 HB2 SER 119 -0.224 2.455 5.894 892 HB3 SER 119 HB3 SER 119 -0.707 2.504 7.598 893 HG SER 119 HG SER 119 0.632 4.569 6.141 894 H GLU 120 H GLU 120 2.424 0.577 5.565 895 HA GLU 120 HA GLU 120 1.199 -1.783 6.682 896 HB2 GLU 120 HB2 GLU 120 3.475 -1.552 4.688 897 HB3 GLU 120 HB3 GLU 120 2.613 -3.025 5.083 898 HG2 GLU 120 HG2 GLU 120 1.226 -0.571 3.962 899 HG3 GLU 120 HG3 GLU 120 1.892 -1.840 2.942 900 H LEU 121 H LEU 121 4.058 0.082 7.245 901 HA LEU 121 HA LEU 121 5.390 -2.118 8.760 902 HB2 LEU 121 HB2 LEU 121 6.502 0.565 7.825 903 HB3 LEU 121 HB3 LEU 121 7.391 -0.675 8.693 904 HG LEU 121 HG LEU 121 6.305 -0.800 5.851 905 HD11 LEU 121 HD11 LEU 121 8.394 0.446 6.159 906 HD12 LEU 121 HD12 LEU 121 9.122 -0.927 7.020 907 HD13 LEU 121 HD13 LEU 121 8.720 -1.068 5.301 908 HD21 LEU 121 HD23 LEU 121 5.997 -3.062 6.820 909 HD22 LEU 121 HD21 LEU 121 7.275 -3.032 5.605 910 HD23 LEU 121 HD22 LEU 121 7.706 -3.076 7.319 911 H LEU 122 H LEU 122 5.040 1.463 9.171 912 HA LEU 122 HA LEU 122 5.596 1.288 11.948 913 HB2 LEU 122 HB2 LEU 122 4.279 3.598 10.514 914 HB3 LEU 122 HB3 LEU 122 5.272 3.643 11.979 915 HG LEU 122 HG LEU 122 6.170 3.081 9.136 916 HD11 LEU 122 HD11 LEU 122 7.268 5.197 10.988 917 HD12 LEU 122 HD12 LEU 122 7.211 5.119 9.203 918 HD13 LEU 122 HD13 LEU 122 5.745 5.450 10.118 919 HD21 LEU 122 HD23 LEU 122 7.458 1.552 10.628 920 HD22 LEU 122 HD21 LEU 122 8.452 2.821 9.958 921 HD23 LEU 122 HD22 LEU 122 7.908 2.935 11.642 922 H CYS 123 H CYS 123 2.700 0.290 10.651 923 HA CYS 123 HA CYS 123 1.298 0.916 13.202 924 HB2 CYS 123 HB2 CYS 123 -0.012 0.532 10.483 925 HB3 CYS 123 HB3 CYS 123 -0.829 0.920 11.992 926 HG CYS 123 HG CYS 123 1.486 2.738 10.476 927 H GLU 124 H GLU 124 3.084 -1.290 12.494 928 HA GLU 124 HA GLU 124 1.250 -3.569 12.841 929 HB2 GLU 124 HB2 GLU 124 1.857 -3.131 10.391 930 HB3 GLU 124 HB3 GLU 124 3.526 -3.504 10.820 931 HG2 GLU 124 HG2 GLU 124 2.512 -5.430 9.870 932 HG3 GLU 124 HG3 GLU 124 2.794 -5.751 11.589 933 H GLU 125 H GLU 125 1.747 -3.900 14.915 934 HA GLU 125 HA GLU 125 4.143 -3.311 16.151 935 HB2 GLU 125 HB2 GLU 125 3.334 -4.576 18.044 936 HB3 GLU 125 HB3 GLU 125 2.032 -3.639 17.313 937 HG2 GLU 125 HG2 GLU 125 1.224 -5.718 16.156 938 HG3 GLU 125 HG3 GLU 125 2.496 -6.638 16.960 939 H GLU 126 H GLU 126 3.411 -6.142 14.254 940 HA GLU 126 HA GLU 126 5.458 -7.870 15.240 941 HB2 GLU 126 HB2 GLU 126 4.281 -7.721 12.428 942 HB3 GLU 126 HB3 GLU 126 5.221 -9.062 13.102 943 HG2 GLU 126 HG2 GLU 126 3.444 -9.285 14.892 944 HG3 GLU 126 HG3 GLU 126 2.488 -8.088 14.005 945 H ILE 127 H ILE 127 5.341 -5.394 12.706 946 HA ILE 127 HA ILE 127 8.074 -5.737 11.820 947 HB ILE 127 HB ILE 127 5.806 -3.909 11.216 948 HG12 ILE 127 HG12 ILE 127 6.146 -4.651 8.929 949 HG13 ILE 127 HG13 ILE 127 7.580 -5.578 9.402 950 HG21 ILE 127 HG21 ILE 127 7.385 -2.804 9.512 951 HG22 ILE 127 HG22 ILE 127 7.472 -2.289 11.190 952 HG23 ILE 127 HG23 ILE 127 8.697 -3.410 10.532 953 HD11 ILE 127 HD13 ILE 127 5.542 -6.944 8.968 954 HD12 ILE 127 HD11 ILE 127 6.195 -7.174 10.595 955 HD13 ILE 127 HD12 ILE 127 4.756 -6.150 10.347 956 H LEU 128 H LEU 128 6.311 -3.378 13.961 957 HA LEU 128 HA LEU 128 8.394 -1.630 14.400 958 HB2 LEU 128 HB2 LEU 128 6.191 -2.553 16.258 959 HB3 LEU 128 HB3 LEU 128 7.485 -1.530 16.853 960 HG LEU 128 HG LEU 128 7.025 0.049 14.917 961 HD11 LEU 128 HD11 LEU 128 4.374 -1.414 14.831 962 HD12 LEU 128 HD12 LEU 128 4.743 0.131 14.054 963 HD13 LEU 128 HD13 LEU 128 5.581 -1.325 13.521 964 HD21 LEU 128 HD23 LEU 128 5.218 1.193 16.165 965 HD22 LEU 128 HD21 LEU 128 4.889 -0.300 17.072 966 HD23 LEU 128 HD22 LEU 128 6.437 0.547 17.273 967 H GLU 129 H GLU 129 8.053 -4.780 16.014 968 HA GLU 129 HA GLU 129 10.316 -4.312 17.703 969 HB2 GLU 129 HB2 GLU 129 8.553 -6.675 17.080 970 HB3 GLU 129 HB3 GLU 129 10.156 -6.993 17.762 971 HG2 GLU 129 HG2 GLU 129 9.730 -5.470 19.632 972 HG3 GLU 129 HG3 GLU 129 8.114 -5.113 19.005 973 H GLN 130 H GLN 130 9.900 -5.660 14.399 974 HA GLN 130 HA GLN 130 12.485 -6.916 14.306 975 HB2 GLN 130 HB2 GLN 130 10.529 -5.954 12.183 976 HB3 GLN 130 HB3 GLN 130 12.048 -6.779 11.808 977 HG2 GLN 130 HG2 GLN 130 11.352 -8.807 12.822 978 HG3 GLN 130 HG3 GLN 130 9.969 -8.048 13.596 979 HE21 GLN 130 HE22 GLN 130 8.047 -8.372 12.595 980 HE22 GLN 130 HE21 GLN 130 7.833 -8.798 10.900 981 H LEU 131 H LEU 131 11.137 -3.686 13.482 982 HA LEU 131 HA LEU 131 13.583 -2.594 12.405 983 HB2 LEU 131 HB2 LEU 131 11.221 -1.243 13.778 984 HB3 LEU 131 HB3 LEU 131 12.520 -0.401 12.951 985 HG LEU 131 HG LEU 131 10.946 -2.488 11.407 986 HD11 LEU 131 HD11 LEU 131 9.204 -1.423 12.495 987 HD12 LEU 131 HD12 LEU 131 9.827 0.183 12.234 988 HD13 LEU 131 HD13 LEU 131 9.244 -0.756 10.844 989 HD21 LEU 131 HD23 LEU 131 12.138 0.204 10.654 990 HD22 LEU 131 HD21 LEU 131 12.836 -1.394 10.317 991 HD23 LEU 131 HD22 LEU 131 11.316 -0.920 9.546 992 H LEU 132 H LEU 132 11.934 -2.272 15.561 993 HA LEU 132 HA LEU 132 13.959 -0.743 16.794 994 HB2 LEU 132 HB2 LEU 132 11.830 -2.553 17.964 995 HB3 LEU 132 HB3 LEU 132 12.874 -1.576 18.982 996 HG LEU 132 HG LEU 132 11.179 -0.331 16.781 997 HD11 LEU 132 HD11 LEU 132 9.538 0.220 18.515 998 HD12 LEU 132 HD12 LEU 132 9.740 -1.538 18.398 999 HD13 LEU 132 HD13 LEU 132 10.499 -0.649 19.737 1000 HD21 LEU 132 HD23 LEU 132 11.473 1.734 18.092 1001 HD22 LEU 132 HD21 LEU 132 12.519 0.870 19.238 1002 HD23 LEU 132 HD22 LEU 132 13.022 1.096 17.546 1003 H THR 133 H THR 133 14.140 -4.144 16.112 1004 HA THR 133 HA THR 133 16.469 -4.365 17.938 1005 HB THR 133 HB THR 133 16.053 -6.770 17.971 1006 HG1 THR 133 HG1 THR 133 13.601 -6.200 16.678 1007 HG21 THR 133 HG23 THR 133 14.087 -6.807 19.401 1008 HG22 THR 133 HG21 THR 133 15.027 -5.345 19.735 1009 HG23 THR 133 HG22 THR 133 13.529 -5.243 18.784 1010 H ALA 134 H ALA 134 15.932 -3.612 14.815 1011 HA ALA 134 HA ALA 134 17.501 -5.419 13.312 1012 HB1 ALA 134 HB3 ALA 134 17.727 -3.488 11.737 1013 HB2 ALA 134 HB1 ALA 134 16.050 -3.818 12.226 1014 HB3 ALA 134 HB2 ALA 134 16.945 -2.461 12.937 1015 H SER 135 H SER 135 19.550 -5.951 13.624 1016 HA SER 135 HA SER 135 21.340 -4.249 15.211 1017 HB2 SER 135 HB2 SER 135 21.659 -7.032 14.010 1018 HB3 SER 135 HB3 SER 135 22.784 -6.259 15.144 1019 HG SER 135 HG SER 135 20.022 -6.679 15.700 1020 H SER 136 H SER 136 20.591 -4.389 11.890 1021 HA SER 136 HA SER 136 23.047 -2.945 11.235 1022 HB2 SER 136 HB2 SER 136 23.573 -4.407 9.315 1023 HB3 SER 136 HB3 SER 136 23.713 -5.280 10.846 1024 HG SER 136 HG SER 136 22.592 -6.578 9.468 1025 H GLU 137 H GLU 137 22.895 -1.905 9.129 1026 HA GLU 137 HA GLU 137 20.371 -0.869 8.366 1027 HB2 GLU 137 HB2 GLU 137 22.963 -1.200 6.768 1028 HB3 GLU 137 HB3 GLU 137 21.573 -0.223 6.294 1029 HG2 GLU 137 HG2 GLU 137 22.979 1.333 7.086 1030 HG3 GLU 137 HG3 GLU 137 21.827 1.073 8.389 1031 H LYS 138 H LYS 138 22.188 -3.760 7.276 1032 HA LYS 138 HA LYS 138 20.476 -4.454 5.143 1033 HB2 LYS 138 HB2 LYS 138 22.678 -5.502 5.487 1034 HB3 LYS 138 HB3 LYS 138 22.117 -6.243 6.984 1035 HG2 LYS 138 HG2 LYS 138 22.184 -7.871 5.188 1036 HG3 LYS 138 HG3 LYS 138 20.526 -7.649 5.742 1037 HD2 LYS 138 HD2 LYS 138 20.046 -6.203 3.786 1038 HD3 LYS 138 HD3 LYS 138 21.716 -6.364 3.231 1039 HE2 LYS 138 HE2 LYS 138 19.734 -8.666 3.582 1040 HE3 LYS 138 HE3 LYS 138 20.038 -7.832 2.057 1041 HZ1 LYS 138 HZ3 LYS 138 21.319 -9.851 2.192 1042 HZ2 LYS 138 HZ1 LYS 138 22.341 -8.586 2.162 1043 HZ3 LYS 138 HZ2 LYS 138 22.061 -9.386 3.564 1044 H GLN 139 H GLN 139 20.275 -5.412 8.628 1045 HA GLN 139 HA GLN 139 17.895 -6.820 8.299 1046 HB2 GLN 139 HB2 GLN 139 19.675 -6.488 10.324 1047 HB3 GLN 139 HB3 GLN 139 18.390 -5.423 10.908 1048 HG2 GLN 139 HG2 GLN 139 16.773 -7.312 10.512 1049 HG3 GLN 139 HG3 GLN 139 18.161 -8.301 10.006 1050 HE21 GLN 139 HE22 GLN 139 16.440 -9.135 12.122 1051 HE22 GLN 139 HE21 GLN 139 17.333 -9.065 13.620 1052 H LEU 140 H LEU 140 18.335 -3.260 8.466 1053 HA LEU 140 HA LEU 140 15.505 -2.802 9.021 1054 HB2 LEU 140 HB2 LEU 140 17.760 -1.057 7.994 1055 HB3 LEU 140 HB3 LEU 140 16.099 -0.515 8.102 1056 HG LEU 140 HG LEU 140 17.581 -1.484 10.515 1057 HD11 LEU 140 HD11 LEU 140 18.683 0.505 9.481 1058 HD12 LEU 140 HD12 LEU 140 17.139 1.377 9.548 1059 HD13 LEU 140 HD13 LEU 140 17.949 0.871 11.037 1060 HD21 LEU 140 HD23 LEU 140 15.169 -1.575 10.816 1061 HD22 LEU 140 HD21 LEU 140 15.834 -0.239 11.749 1062 HD23 LEU 140 HD22 LEU 140 14.999 0.097 10.219 1063 H ALA 141 H ALA 141 17.625 -2.730 6.075 1064 HA ALA 141 HA ALA 141 15.536 -2.342 4.223 1065 HB1 ALA 141 HB3 ALA 141 18.076 -3.892 3.680 1066 HB2 ALA 141 HB1 ALA 141 17.074 -2.936 2.547 1067 HB3 ALA 141 HB2 ALA 141 18.008 -2.120 3.818 1068 H ASP 142 H ASP 142 16.618 -5.380 5.733 1069 HA ASP 142 HA ASP 142 15.221 -7.206 4.109 1070 HB2 ASP 142 HB2 ASP 142 16.680 -8.081 5.750 1071 HB3 ASP 142 HB3 ASP 142 15.953 -7.120 7.034 1072 H ILE 143 H ILE 143 13.988 -5.068 6.739 1073 HA ILE 143 HA ILE 143 11.352 -6.185 6.705 1074 HB ILE 143 HB ILE 143 12.572 -3.654 7.859 1075 HG12 ILE 143 HG12 ILE 143 11.749 -6.192 9.338 1076 HG13 ILE 143 HG13 ILE 143 13.371 -6.000 8.691 1077 HG21 ILE 143 HG21 ILE 143 9.858 -4.870 8.397 1078 HG22 ILE 143 HG22 ILE 143 10.605 -3.519 9.292 1079 HG23 ILE 143 HG23 ILE 143 10.205 -3.319 7.588 1080 HD11 ILE 143 HD13 ILE 143 12.084 -4.380 10.864 1081 HD12 ILE 143 HD11 ILE 143 13.589 -5.328 10.895 1082 HD13 ILE 143 HD12 ILE 143 13.538 -3.807 9.998 1083 H ILE 144 H ILE 144 12.986 -3.442 5.095 1084 HA ILE 144 HA ILE 144 10.704 -2.357 3.747 1085 HB ILE 144 HB ILE 144 13.568 -2.635 2.704 1086 HG12 ILE 144 HG12 ILE 144 13.640 -1.327 4.681 1087 HG13 ILE 144 HG13 ILE 144 13.794 -0.242 3.299 1088 HG21 ILE 144 HG21 ILE 144 13.051 -0.787 1.162 1089 HG22 ILE 144 HG22 ILE 144 12.164 -2.265 0.801 1090 HG23 ILE 144 HG23 ILE 144 11.337 -0.918 1.595 1091 HD11 ILE 144 HD13 ILE 144 11.459 -0.645 5.162 1092 HD12 ILE 144 HD11 ILE 144 12.295 0.868 4.727 1093 HD13 ILE 144 HD12 ILE 144 11.218 0.073 3.557 1094 H SER 145 H SER 145 12.913 -5.010 2.893 1095 HA SER 145 HA SER 145 11.704 -5.438 0.408 1096 HB2 SER 145 HB2 SER 145 13.314 -7.431 2.085 1097 HB3 SER 145 HB3 SER 145 13.073 -7.498 0.332 1098 HG SER 145 HG SER 145 14.478 -5.516 1.834 1099 H ARG 146 H ARG 146 10.782 -6.653 3.631 1100 HA ARG 146 HA ARG 146 9.055 -8.727 2.748 1101 HB2 ARG 146 HB2 ARG 146 10.276 -8.961 4.714 1102 HB3 ARG 146 HB3 ARG 146 9.990 -7.312 5.265 1103 HG2 ARG 146 HG2 ARG 146 7.771 -7.711 5.792 1104 HG3 ARG 146 HG3 ARG 146 7.816 -9.373 5.140 1105 HD2 ARG 146 HD2 ARG 146 9.191 -8.284 7.633 1106 HD3 ARG 146 HD3 ARG 146 7.937 -9.522 7.570 1107 HE ARG 146 HE ARG 146 9.533 -11.018 6.442 1108 HH11 ARG 146 HH11 ARG 146 10.963 -8.658 8.658 1109 HH12 ARG 146 HH12 ARG 146 12.589 -8.873 8.027 1110 HH21 ARG 146 HH21 ARG 146 11.740 -11.429 5.795 1111 HH22 ARG 146 HH22 ARG 146 13.018 -10.429 6.414 1112 H GLY 147 H GLY 147 8.811 -5.252 2.888 1113 HA2 GLY 147 HA2 GLY 147 5.913 -5.144 3.338 1114 HA3 GLY 147 HA3 GLY 147 7.014 -3.817 2.926 Start of MODEL 10 1 H MET 1 H1 MET 1 1.704 0.018 0.138 2 HA MET 1 HA MET 1 1.944 -0.765 -2.695 3 HB2 MET 1 HB2 MET 1 1.593 1.840 -1.656 4 HB3 MET 1 HB3 MET 1 3.348 1.671 -1.832 5 HG2 MET 1 HG2 MET 1 2.332 2.641 -3.825 6 HG3 MET 1 HG3 MET 1 3.120 1.109 -4.183 7 HE1 MET 1 HE3 MET 1 1.925 1.081 -6.544 8 HE2 MET 1 HE1 MET 1 0.172 1.266 -6.770 9 HE3 MET 1 HE2 MET 1 1.136 2.626 -6.155 10 H ARG 2 H ARG 2 4.055 -0.858 -3.596 11 HA ARG 2 HA ARG 2 5.766 -2.409 -1.928 12 HB2 ARG 2 HB2 ARG 2 6.240 -1.157 -4.656 13 HB3 ARG 2 HB3 ARG 2 7.367 -2.261 -3.860 14 HG2 ARG 2 HG2 ARG 2 4.508 -2.905 -4.616 15 HG3 ARG 2 HG3 ARG 2 5.965 -3.407 -5.504 16 HD2 ARG 2 HD2 ARG 2 6.648 -4.632 -3.349 17 HD3 ARG 2 HD3 ARG 2 4.996 -4.291 -2.774 18 HE ARG 2 HE ARG 2 4.949 -5.496 -5.375 19 HH11 ARG 2 HH11 ARG 2 5.385 -6.310 -1.932 20 HH12 ARG 2 HH12 ARG 2 4.941 -7.975 -2.145 21 HH21 ARG 2 HH21 ARG 2 4.327 -7.691 -5.631 22 HH22 ARG 2 HH22 ARG 2 4.308 -8.762 -4.284 23 H LEU 3 H LEU 3 7.024 -1.712 -0.448 24 HA LEU 3 HA LEU 3 7.765 1.036 0.078 25 HB2 LEU 3 HB2 LEU 3 8.949 -1.633 0.955 26 HB3 LEU 3 HB3 LEU 3 9.728 -0.117 1.367 27 HG LEU 3 HG LEU 3 8.284 -1.078 3.166 28 HD11 LEU 3 HD11 LEU 3 7.273 1.067 3.793 29 HD12 LEU 3 HD12 LEU 3 8.881 1.319 3.097 30 HD13 LEU 3 HD13 LEU 3 7.434 1.675 2.130 31 HD21 LEU 3 HD23 LEU 3 5.870 -0.144 1.601 32 HD22 LEU 3 HD21 LEU 3 6.430 -1.801 1.565 33 HD23 LEU 3 HD22 LEU 3 5.953 -1.081 3.109 34 H SER 4 H SER 4 9.313 -1.614 -1.679 35 HA SER 4 HA SER 4 11.841 -0.497 -2.004 36 HB2 SER 4 HB2 SER 4 11.896 -2.223 -3.916 37 HB3 SER 4 HB3 SER 4 11.561 -2.805 -2.267 38 HG SER 4 HG SER 4 10.127 -3.676 -3.835 39 H ASP 5 H ASP 5 8.844 0.526 -3.455 40 HA ASP 5 HA ASP 5 10.112 1.743 -5.757 41 HB2 ASP 5 HB2 ASP 5 7.760 0.840 -5.822 42 HB3 ASP 5 HB3 ASP 5 7.280 2.070 -4.652 43 H TYR 6 H TYR 6 9.346 2.685 -2.474 44 HA TYR 6 HA TYR 6 9.513 5.566 -3.166 45 HB2 TYR 6 HB2 TYR 6 8.733 4.112 -0.606 46 HB3 TYR 6 HB3 TYR 6 8.853 5.865 -0.773 47 HD1 TYR 6 HD2 TYR 6 7.317 7.150 -2.172 48 HD2 TYR 6 HD1 TYR 6 6.841 2.901 -1.601 49 HE1 TYR 6 HE2 TYR 6 5.164 7.235 -3.413 50 HE2 TYR 6 HE1 TYR 6 4.726 2.972 -2.891 51 HH TYR 6 HH TYR 6 3.409 5.995 -4.314 52 H PHE 7 H PHE 7 11.287 3.043 -1.412 53 HA PHE 7 HA PHE 7 13.009 5.173 -0.265 54 HB2 PHE 7 HB2 PHE 7 13.494 3.914 1.464 55 HB3 PHE 7 HB3 PHE 7 11.983 3.133 1.066 56 HD1 PHE 7 HD2 PHE 7 12.457 1.180 -0.896 57 HD2 PHE 7 HD1 PHE 7 14.952 2.313 2.416 58 HE1 PHE 7 HE2 PHE 7 13.972 -0.745 -1.415 59 HE2 PHE 7 HE1 PHE 7 16.570 0.470 1.755 60 HZ PHE 7 HZ PHE 7 16.065 -1.036 -0.114 61 HA PRO 8 HA PRO 8 15.443 4.617 -3.876 62 HB2 PRO 8 HB2 PRO 8 17.707 6.106 -3.311 63 HB3 PRO 8 HB3 PRO 8 16.121 6.751 -3.791 64 HG2 PRO 8 HG2 PRO 8 17.246 6.491 -0.995 65 HG3 PRO 8 HG3 PRO 8 16.358 7.874 -1.716 66 HD2 PRO 8 HD2 PRO 8 15.139 6.044 -0.124 67 HD3 PRO 8 HD3 PRO 8 14.289 6.764 -1.516 68 H GLU 9 H GLU 9 17.977 4.578 -1.368 69 HA GLU 9 HA GLU 9 18.635 1.814 -1.584 70 HB2 GLU 9 HB2 GLU 9 19.450 2.423 -3.817 71 HB3 GLU 9 HB3 GLU 9 20.259 3.849 -3.169 72 HG2 GLU 9 HG2 GLU 9 21.912 2.472 -2.039 73 HG3 GLU 9 HG3 GLU 9 21.012 0.995 -2.407 74 H SER 10 H SER 10 20.501 4.836 -1.295 75 HA SER 10 HA SER 10 21.817 4.144 1.111 76 HB2 SER 10 HB2 SER 10 21.316 7.000 0.243 77 HB3 SER 10 HB3 SER 10 22.797 6.292 0.900 78 HG SER 10 HG SER 10 23.129 5.273 -1.097 79 H SER 11 H SER 11 18.721 4.155 1.091 80 HA SER 11 HA SER 11 17.750 6.429 2.539 81 HB2 SER 11 HB2 SER 11 16.066 4.092 2.646 82 HB3 SER 11 HB3 SER 11 15.826 5.591 1.760 83 HG SER 11 HG SER 11 16.044 3.431 0.572 84 H ILE 12 H ILE 12 19.235 3.390 3.447 85 HA ILE 12 HA ILE 12 17.865 3.257 6.011 86 HB ILE 12 HB ILE 12 19.901 1.440 4.668 87 HG12 ILE 12 HG12 ILE 12 17.976 1.632 3.126 88 HG13 ILE 12 HG13 ILE 12 18.264 0.045 3.752 89 HG21 ILE 12 HG21 ILE 12 17.836 1.064 6.890 90 HG22 ILE 12 HG22 ILE 12 18.789 -0.267 6.174 91 HG23 ILE 12 HG23 ILE 12 19.569 1.038 7.077 92 HD11 ILE 12 HD13 ILE 12 15.909 0.332 3.771 93 HD12 ILE 12 HD11 ILE 12 16.379 0.419 5.436 94 HD13 ILE 12 HD12 ILE 12 16.038 1.927 4.525 95 H SER 13 H SER 13 19.021 3.700 7.959 96 HA SER 13 HA SER 13 21.907 3.307 8.036 97 HB2 SER 13 HB2 SER 13 20.686 6.086 8.494 98 HB3 SER 13 HB3 SER 13 22.310 5.623 9.025 99 HG SER 13 HG SER 13 21.732 5.075 6.384 100 H VAL 14 H VAL 14 22.381 2.423 9.913 101 HA VAL 14 HA VAL 14 20.594 2.826 12.236 102 HB VAL 14 HB VAL 14 20.985 0.536 11.511 103 HG11 VAL 14 HG11 VAL 14 23.933 0.990 12.075 104 HG12 VAL 14 HG12 VAL 14 23.161 -0.581 11.825 105 HG13 VAL 14 HG13 VAL 14 23.170 0.598 10.514 106 HG21 VAL 14 HG23 VAL 14 20.608 1.081 13.920 107 HG22 VAL 14 HG21 VAL 14 21.538 -0.407 13.684 108 HG23 VAL 14 HG22 VAL 14 22.365 1.088 14.174 109 H ILE 15 H ILE 15 21.473 3.782 14.064 110 HA ILE 15 HA ILE 15 24.119 5.134 13.860 111 HB ILE 15 HB ILE 15 21.384 6.340 14.507 112 HG12 ILE 15 HG12 ILE 15 23.068 6.642 11.994 113 HG13 ILE 15 HG13 ILE 15 21.418 6.012 12.130 114 HG21 ILE 15 HG21 ILE 15 22.472 8.449 14.746 115 HG22 ILE 15 HG22 ILE 15 23.378 7.322 15.694 116 HG23 ILE 15 HG23 ILE 15 24.023 7.806 14.124 117 HD11 ILE 15 HD13 ILE 15 20.723 8.297 13.010 118 HD12 ILE 15 HD11 ILE 15 22.326 8.882 12.541 119 HD13 ILE 15 HD12 ILE 15 21.229 8.241 11.299 120 H HIS 16 H HIS 16 25.062 5.497 15.950 121 HA HIS 16 HA HIS 16 24.142 3.895 18.162 122 HB2 HIS 16 HB2 HIS 16 26.027 6.283 18.065 123 HB3 HIS 16 HB3 HIS 16 25.847 5.179 19.431 124 HD1 HIS 16 HD1 HIS 16 26.037 2.375 17.860 125 HD2 HIS 16 HD2 HIS 16 28.457 5.787 17.265 126 HE1 HIS 16 HE1 HIS 16 28.202 1.553 16.809 127 H SER 17 H SER 17 23.895 7.408 17.362 128 HA SER 17 HA SER 17 21.436 7.828 18.693 129 HB2 SER 17 HB2 SER 17 22.896 9.709 20.142 130 HB3 SER 17 HB3 SER 17 22.122 8.278 20.785 131 HG SER 17 HG SER 17 24.835 8.529 19.974 132 H ALA 18 H ALA 18 20.769 10.062 18.083 133 HA ALA 18 HA ALA 18 22.281 11.157 15.812 134 HB1 ALA 18 HB3 ALA 18 19.839 11.274 15.739 135 HB2 ALA 18 HB1 ALA 18 19.811 12.172 17.286 136 HB3 ALA 18 HB2 ALA 18 20.517 12.898 15.831 137 H LYS 19 H LYS 19 23.276 13.224 15.869 138 HA LYS 19 HA LYS 19 24.768 13.978 18.145 139 HB2 LYS 19 HB2 LYS 19 25.303 14.530 15.825 140 HB3 LYS 19 HB3 LYS 19 23.903 15.562 15.705 141 HG2 LYS 19 HG2 LYS 19 25.961 16.125 17.855 142 HG3 LYS 19 HG3 LYS 19 26.346 16.539 16.189 143 HD2 LYS 19 HD2 LYS 19 23.833 17.535 17.584 144 HD3 LYS 19 HD3 LYS 19 25.362 18.415 17.581 145 HE2 LYS 19 HE2 LYS 19 25.344 18.681 15.196 146 HE3 LYS 19 HE3 LYS 19 24.023 17.528 14.998 147 HZ1 LYS 19 HZ3 LYS 19 23.267 19.820 14.828 148 HZ2 LYS 19 HZ1 LYS 19 22.530 19.045 16.070 149 HZ3 LYS 19 HZ2 LYS 19 23.735 20.136 16.360 150 H ASP 20 H ASP 20 21.619 15.148 16.980 151 HA ASP 20 HA ASP 20 20.573 15.514 19.596 152 HB2 ASP 20 HB2 ASP 20 20.141 17.745 19.726 153 HB3 ASP 20 HB3 ASP 20 21.849 17.754 19.270 154 H TRP 21 H TRP 21 18.345 16.548 19.280 155 HA TRP 21 HA TRP 21 16.798 15.062 17.554 156 HB2 TRP 21 HB2 TRP 21 15.191 17.160 18.222 157 HB3 TRP 21 HB3 TRP 21 15.536 15.776 19.250 158 HD1 TRP 21 HD1 TRP 21 16.544 19.403 18.757 159 HE1 TRP 21 HE1 TRP 21 17.602 20.364 20.873 160 HE3 TRP 21 HE3 TRP 21 17.047 15.073 21.349 161 HZ2 TRP 21 HZ2 TRP 21 18.666 19.323 23.373 162 HZ3 TRP 21 HZ3 TRP 21 18.220 15.042 23.543 163 HH2 TRP 21 HH2 TRP 21 19.014 17.161 24.567 164 H GLN 22 H GLN 22 18.217 18.338 16.906 165 HA GLN 22 HA GLN 22 16.742 18.781 14.444 166 HB2 GLN 22 HB2 GLN 22 19.488 19.739 15.302 167 HB3 GLN 22 HB3 GLN 22 18.635 20.268 13.863 168 HG2 GLN 22 HG2 GLN 22 16.912 21.333 15.088 169 HG3 GLN 22 HG3 GLN 22 17.347 20.538 16.602 170 HE21 GLN 22 HE22 GLN 22 19.585 20.968 17.444 171 HE22 GLN 22 HE21 GLN 22 20.177 22.632 17.337 172 H GLU 23 H GLU 23 19.984 17.321 15.211 173 HA GLU 23 HA GLU 23 20.574 16.514 12.573 174 HB2 GLU 23 HB2 GLU 23 22.039 16.507 14.762 175 HB3 GLU 23 HB3 GLU 23 21.345 14.895 15.001 176 HG2 GLU 23 HG2 GLU 23 23.298 14.378 13.863 177 HG3 GLU 23 HG3 GLU 23 22.169 14.438 12.539 178 H ALA 24 H ALA 24 18.580 14.954 15.049 179 HA ALA 24 HA ALA 24 18.453 12.389 13.837 180 HB1 ALA 24 HB3 ALA 24 17.867 13.076 16.181 181 HB2 ALA 24 HB1 ALA 24 16.328 13.715 15.572 182 HB3 ALA 24 HB2 ALA 24 16.687 11.979 15.416 183 H ILE 25 H ILE 25 16.519 15.354 13.325 184 HA ILE 25 HA ILE 25 14.727 14.183 11.362 185 HB ILE 25 HB ILE 25 15.674 17.056 11.578 186 HG12 ILE 25 HG12 ILE 25 14.199 15.684 13.581 187 HG13 ILE 25 HG13 ILE 25 14.618 17.386 13.473 188 HG21 ILE 25 HG21 ILE 25 13.630 17.612 10.364 189 HG22 ILE 25 HG22 ILE 25 14.608 16.506 9.447 190 HG23 ILE 25 HG23 ILE 25 13.181 15.890 10.288 191 HD11 ILE 25 HD13 ILE 25 12.251 17.070 13.871 192 HD12 ILE 25 HD11 ILE 25 12.497 17.819 12.285 193 HD13 ILE 25 HD12 ILE 25 12.098 16.079 12.407 194 H ASP 26 H ASP 26 17.862 15.938 11.298 195 HA ASP 26 HA ASP 26 18.125 16.169 8.518 196 HB2 ASP 26 HB2 ASP 26 19.559 17.129 10.495 197 HB3 ASP 26 HB3 ASP 26 20.539 15.681 10.279 198 H PHE 27 H PHE 27 19.293 13.529 10.655 199 HA PHE 27 HA PHE 27 20.209 11.807 8.592 200 HB2 PHE 27 HB2 PHE 27 19.439 11.470 11.500 201 HB3 PHE 27 HB3 PHE 27 19.701 10.058 10.498 202 HD1 PHE 27 HD1 PHE 27 21.874 10.112 8.971 203 HD2 PHE 27 HD2 PHE 27 21.452 12.249 12.724 204 HE1 PHE 27 HE1 PHE 27 24.331 10.123 9.259 205 HE2 PHE 27 HE2 PHE 27 23.895 12.214 12.992 206 HZ PHE 27 HZ PHE 27 25.348 11.170 11.274 207 H SER 28 H SER 28 16.903 12.272 9.983 208 HA SER 28 HA SER 28 15.746 9.997 8.676 209 HB2 SER 28 HB2 SER 28 14.364 12.620 9.464 210 HB3 SER 28 HB3 SER 28 13.579 11.115 9.056 211 HG SER 28 HG SER 28 15.372 11.555 11.237 212 H MET 29 H MET 29 16.810 13.094 7.422 213 HA MET 29 HA MET 29 15.202 12.652 4.938 214 HB2 MET 29 HB2 MET 29 16.310 15.210 6.078 215 HB3 MET 29 HB3 MET 29 15.180 15.009 4.721 216 HG2 MET 29 HG2 MET 29 14.278 14.201 7.459 217 HG3 MET 29 HG3 MET 29 14.402 15.896 7.032 218 HE1 MET 29 HE3 MET 29 12.332 12.916 7.081 219 HE2 MET 29 HE1 MET 29 11.380 12.905 5.572 220 HE3 MET 29 HE2 MET 29 13.146 12.590 5.522 221 H VAL 30 H VAL 30 18.577 13.045 6.021 222 HA VAL 30 HA VAL 30 19.544 14.356 3.794 223 HB VAL 30 HB VAL 30 20.821 14.001 5.847 224 HG11 VAL 30 HG11 VAL 30 20.320 11.577 6.237 225 HG12 VAL 30 HG12 VAL 30 21.377 11.163 4.871 226 HG13 VAL 30 HG13 VAL 30 22.047 11.952 6.313 227 HG21 VAL 30 HG23 VAL 30 22.312 12.996 3.386 228 HG22 VAL 30 HG21 VAL 30 21.951 14.691 3.754 229 HG23 VAL 30 HG22 VAL 30 23.019 13.766 4.826 230 H SER 31 H SER 31 18.973 10.796 4.047 231 HA SER 31 HA SER 31 20.249 10.187 1.614 232 HB2 SER 31 HB2 SER 31 17.893 8.793 2.935 233 HB3 SER 31 HB3 SER 31 19.035 8.083 1.772 234 HG SER 31 HG SER 31 20.133 7.592 3.465 235 H LEU 32 H LEU 32 17.197 11.759 2.202 236 HA LEU 32 HA LEU 32 16.192 11.343 -0.541 237 HB2 LEU 32 HB2 LEU 32 15.155 12.898 1.876 238 HB3 LEU 32 HB3 LEU 32 14.370 12.946 0.328 239 HG LEU 32 HG LEU 32 14.837 10.393 1.917 240 HD11 LEU 32 HD11 LEU 32 13.302 11.917 3.096 241 HD12 LEU 32 HD12 LEU 32 12.295 12.028 1.637 242 HD13 LEU 32 HD13 LEU 32 12.462 10.480 2.488 243 HD21 LEU 32 HD23 LEU 32 13.125 10.938 -0.551 244 HD22 LEU 32 HD21 LEU 32 14.586 9.913 -0.484 245 HD23 LEU 32 HD22 LEU 32 13.139 9.435 0.380 246 H LEU 33 H LEU 33 17.591 13.886 1.579 247 HA LEU 33 HA LEU 33 17.529 16.018 -0.190 248 HB2 LEU 33 HB2 LEU 33 18.156 16.041 2.244 249 HB3 LEU 33 HB3 LEU 33 19.719 15.363 1.808 250 HG LEU 33 HG LEU 33 20.207 17.407 0.451 251 HD11 LEU 33 HD11 LEU 33 18.843 19.391 0.663 252 HD12 LEU 33 HD12 LEU 33 17.875 18.118 -0.022 253 HD13 LEU 33 HD13 LEU 33 17.672 18.532 1.697 254 HD21 LEU 33 HD23 LEU 33 20.765 18.788 2.322 255 HD22 LEU 33 HD21 LEU 33 19.569 17.968 3.350 256 HD23 LEU 33 HD22 LEU 33 20.998 17.100 2.760 257 H ASP 34 H ASP 34 20.004 13.510 0.235 258 HA ASP 34 HA ASP 34 22.020 14.435 -1.438 259 HB2 ASP 34 HB2 ASP 34 22.281 12.544 0.166 260 HB3 ASP 34 HB3 ASP 34 21.070 11.608 -0.725 261 H LYS 35 H LYS 35 19.098 12.816 -2.309 262 HA LYS 35 HA LYS 35 20.067 12.506 -5.132 263 HB2 LYS 35 HB2 LYS 35 17.758 11.078 -3.896 264 HB3 LYS 35 HB3 LYS 35 18.568 10.785 -5.446 265 HG2 LYS 35 HG2 LYS 35 20.737 10.534 -3.981 266 HG3 LYS 35 HG3 LYS 35 19.605 10.366 -2.618 267 HD2 LYS 35 HD2 LYS 35 18.483 8.571 -4.119 268 HD3 LYS 35 HD3 LYS 35 20.011 8.642 -5.034 269 HE2 LYS 35 HE2 LYS 35 19.695 8.194 -2.027 270 HE3 LYS 35 HE3 LYS 35 19.940 6.863 -3.180 271 HZ1 LYS 35 HZ3 LYS 35 22.099 7.864 -3.754 272 HZ2 LYS 35 HZ1 LYS 35 21.922 9.022 -2.603 273 HZ3 LYS 35 HZ2 LYS 35 22.035 7.432 -2.186 274 H ASN 36 H ASN 36 19.021 14.928 -3.613 275 HA ASN 36 HA ASN 36 17.485 16.468 -3.566 276 HB2 ASN 36 HB2 ASN 36 17.501 17.936 -5.219 277 HB3 ASN 36 HB3 ASN 36 18.923 16.974 -5.589 278 HD21 ASN 36 HD22 ASN 36 17.421 14.757 -6.866 279 HD22 ASN 36 HD21 ASN 36 16.970 15.401 -8.436 280 H TYR 37 H TYR 37 16.135 14.118 -3.078 281 HA TYR 37 HA TYR 37 13.531 14.203 -4.394 282 HB2 TYR 37 HB2 TYR 37 14.554 13.098 -1.764 283 HB3 TYR 37 HB3 TYR 37 12.854 13.119 -2.123 284 HD1 TYR 37 HD1 TYR 37 11.832 11.637 -3.743 285 HD2 TYR 37 HD2 TYR 37 16.030 11.325 -2.731 286 HE1 TYR 37 HE1 TYR 37 11.987 9.488 -4.967 287 HE2 TYR 37 HE2 TYR 37 16.149 9.174 -3.901 288 HH TYR 37 HH TYR 37 13.337 7.713 -5.594 289 H ILE 38 H ILE 38 15.183 16.205 -2.097 290 HA ILE 38 HA ILE 38 12.833 17.889 -1.579 291 HB ILE 38 HB ILE 38 13.386 17.877 0.858 292 HG12 ILE 38 HG12 ILE 38 15.204 15.517 0.183 293 HG13 ILE 38 HG13 ILE 38 15.747 17.136 0.642 294 HG21 ILE 38 HG21 ILE 38 12.727 15.053 -0.051 295 HG22 ILE 38 HG22 ILE 38 12.347 15.803 1.501 296 HG23 ILE 38 HG23 ILE 38 11.559 16.397 0.043 297 HD11 ILE 38 HD13 ILE 38 14.653 16.870 2.835 298 HD12 ILE 38 HD11 ILE 38 14.278 15.175 2.409 299 HD13 ILE 38 HD12 ILE 38 15.959 15.704 2.481 300 H SER 39 H SER 39 13.705 19.890 -0.274 301 HA SER 39 HA SER 39 16.541 20.533 -0.928 302 HB2 SER 39 HB2 SER 39 15.803 22.882 -0.819 303 HB3 SER 39 HB3 SER 39 14.926 21.984 -2.070 304 HG SER 39 HG SER 39 13.517 23.256 -0.830 305 H GLU 40 H GLU 40 17.571 21.944 0.807 306 HA GLU 40 HA GLU 40 17.366 20.707 3.335 307 HB2 GLU 40 HB2 GLU 40 18.547 23.457 2.764 308 HB3 GLU 40 HB3 GLU 40 18.898 22.394 4.121 309 HG2 GLU 40 HG2 GLU 40 20.709 21.870 2.881 310 HG3 GLU 40 HG3 GLU 40 19.632 20.688 2.170 311 H ASN 41 H ASN 41 15.609 23.489 2.038 312 HA ASN 41 HA ASN 41 14.684 24.607 4.504 313 HB2 ASN 41 HB2 ASN 41 14.434 25.731 2.292 314 HB3 ASN 41 HB3 ASN 41 13.266 24.498 1.796 315 HD21 ASN 41 HD22 ASN 41 11.068 24.584 2.692 316 HD22 ASN 41 HD21 ASN 41 10.567 25.949 3.656 317 H TYR 42 H TYR 42 13.515 21.878 2.525 318 HA TYR 42 HA TYR 42 11.007 21.444 3.765 319 HB2 TYR 42 HB2 TYR 42 11.928 20.387 1.658 320 HB3 TYR 42 HB3 TYR 42 12.980 19.402 2.657 321 HD1 TYR 42 HD2 TYR 42 9.412 20.160 1.964 322 HD2 TYR 42 HD1 TYR 42 12.235 17.354 3.618 323 HE1 TYR 42 HE2 TYR 42 7.655 18.412 1.986 324 HE2 TYR 42 HE1 TYR 42 10.477 15.606 3.672 325 HH TYR 42 HH TYR 42 7.103 16.297 2.714 326 H ILE 43 H ILE 43 14.246 20.129 4.467 327 HA ILE 43 HA ILE 43 13.667 18.518 6.684 328 HB ILE 43 HB ILE 43 16.220 20.024 6.094 329 HG12 ILE 43 HG12 ILE 43 15.047 17.390 5.105 330 HG13 ILE 43 HG13 ILE 43 15.463 18.797 4.122 331 HG21 ILE 43 HG21 ILE 43 15.827 17.407 7.600 332 HG22 ILE 43 HG22 ILE 43 17.315 18.357 7.426 333 HG23 ILE 43 HG23 ILE 43 15.975 18.974 8.400 334 HD11 ILE 43 HD13 ILE 43 17.817 18.516 4.666 335 HD12 ILE 43 HD11 ILE 43 17.416 17.016 5.545 336 HD13 ILE 43 HD12 ILE 43 17.082 17.133 3.805 337 H GLN 44 H GLN 44 14.749 21.981 6.529 338 HA GLN 44 HA GLN 44 14.727 22.235 9.351 339 HB2 GLN 44 HB2 GLN 44 16.016 23.634 7.579 340 HB3 GLN 44 HB3 GLN 44 14.553 24.611 7.485 341 HG2 GLN 44 HG2 GLN 44 16.145 25.608 9.067 342 HG3 GLN 44 HG3 GLN 44 14.725 25.062 9.945 343 HE21 GLN 44 HE22 GLN 44 15.292 24.085 11.917 344 HE22 GLN 44 HE21 GLN 44 16.680 23.057 12.156 345 H ALA 45 H ALA 45 12.109 22.703 7.017 346 HA ALA 45 HA ALA 45 10.305 24.087 8.690 347 HB1 ALA 45 HB3 ALA 45 9.892 23.541 6.271 348 HB2 ALA 45 HB1 ALA 45 9.600 21.843 6.734 349 HB3 ALA 45 HB2 ALA 45 8.532 23.111 7.331 350 H ILE 46 H ILE 46 11.113 20.574 8.533 351 HA ILE 46 HA ILE 46 9.111 19.809 10.447 352 HB ILE 46 HB ILE 46 11.693 18.330 9.878 353 HG12 ILE 46 HG12 ILE 46 9.154 17.936 8.299 354 HG13 ILE 46 HG13 ILE 46 10.516 18.854 7.701 355 HG21 ILE 46 HG21 ILE 46 8.909 17.345 10.666 356 HG22 ILE 46 HG22 ILE 46 10.392 16.374 10.594 357 HG23 ILE 46 HG23 ILE 46 10.236 17.631 11.812 358 HD11 ILE 46 HD13 ILE 46 10.572 16.588 6.793 359 HD12 ILE 46 HD11 ILE 46 11.996 16.927 7.793 360 HD13 ILE 46 HD12 ILE 46 10.700 15.902 8.412 361 H LYS 47 H LYS 47 12.669 20.456 10.611 362 HA LYS 47 HA LYS 47 12.942 19.791 13.328 363 HB2 LYS 47 HB2 LYS 47 14.403 21.817 11.591 364 HB3 LYS 47 HB3 LYS 47 14.961 21.411 13.214 365 HG2 LYS 47 HG2 LYS 47 15.588 19.198 12.554 366 HG3 LYS 47 HG3 LYS 47 14.763 19.355 10.987 367 HD2 LYS 47 HD2 LYS 47 16.278 21.065 10.272 368 HD3 LYS 47 HD3 LYS 47 17.100 21.099 11.846 369 HE2 LYS 47 HE2 LYS 47 18.087 18.945 11.458 370 HE3 LYS 47 HE3 LYS 47 17.089 18.658 10.038 371 HZ1 LYS 47 HZ3 LYS 47 19.268 20.656 10.303 372 HZ2 LYS 47 HZ1 LYS 47 19.253 19.355 9.304 373 HZ3 LYS 47 HZ2 LYS 47 18.266 20.623 9.021 374 H ASP 48 H ASP 48 12.262 22.996 11.818 375 HA ASP 48 HA ASP 48 12.356 24.513 14.203 376 HB2 ASP 48 HB2 ASP 48 12.504 25.502 11.971 377 HB3 ASP 48 HB3 ASP 48 10.856 24.986 11.598 378 H SER 49 H SER 49 9.576 22.965 12.516 379 HA SER 49 HA SER 49 7.556 23.812 14.373 380 HB2 SER 49 HB2 SER 49 7.689 21.308 12.652 381 HB3 SER 49 HB3 SER 49 6.230 22.046 13.347 382 HG SER 49 HG SER 49 7.887 22.883 11.229 383 H THR 50 H THR 50 9.589 20.808 14.233 384 HA THR 50 HA THR 50 8.573 19.594 16.525 385 HB THR 50 HB THR 50 11.358 19.487 15.318 386 HG1 THR 50 HG1 THR 50 9.909 18.855 13.853 387 HG21 THR 50 HG23 THR 50 11.556 18.482 17.483 388 HG22 THR 50 HG21 THR 50 10.000 17.649 17.322 389 HG23 THR 50 HG22 THR 50 11.378 17.168 16.307 390 H ILE 51 H ILE 51 11.180 22.097 16.318 391 HA ILE 51 HA ILE 51 11.741 22.032 19.138 392 HB ILE 51 HB ILE 51 12.224 24.080 16.944 393 HG12 ILE 51 HG12 ILE 51 14.222 22.350 18.476 394 HG13 ILE 51 HG13 ILE 51 13.450 21.796 17.000 395 HG21 ILE 51 HG21 ILE 51 13.230 24.204 19.825 396 HG22 ILE 51 HG22 ILE 51 13.773 25.255 18.501 397 HG23 ILE 51 HG23 ILE 51 12.114 25.351 19.052 398 HD11 ILE 51 HD13 ILE 51 15.612 22.682 16.449 399 HD12 ILE 51 HD11 ILE 51 14.376 23.749 15.761 400 HD13 ILE 51 HD12 ILE 51 15.268 24.226 17.228 401 H ASN 52 H ASN 52 9.578 24.102 17.137 402 HA ASN 52 HA ASN 52 8.899 25.811 19.368 403 HB2 ASN 52 HB2 ASN 52 7.901 25.495 16.517 404 HB3 ASN 52 HB3 ASN 52 7.068 26.552 17.643 405 HD21 ASN 52 HD22 ASN 52 10.140 26.088 15.933 406 HD22 ASN 52 HD21 ASN 52 10.727 27.715 16.184 407 H ASN 53 H ASN 53 7.329 22.998 17.910 408 HA ASN 53 HA ASN 53 4.892 23.412 19.592 409 HB2 ASN 53 HB2 ASN 53 4.926 23.607 16.978 410 HB3 ASN 53 HB3 ASN 53 5.117 21.858 16.989 411 HD21 ASN 53 HD22 ASN 53 3.007 24.561 17.850 412 HD22 ASN 53 HD21 ASN 53 1.530 23.637 17.978 413 H GLY 54 H GLY 54 7.591 21.367 19.162 414 HA2 GLY 54 HA2 GLY 54 8.081 19.351 20.284 415 HA3 GLY 54 HA3 GLY 54 6.360 19.079 20.620 416 HA PRO 55 HA PRO 55 7.850 17.082 16.528 417 HB2 PRO 55 HB2 PRO 55 7.626 14.413 17.130 418 HB3 PRO 55 HB3 PRO 55 9.119 15.357 17.417 419 HG2 PRO 55 HG2 PRO 55 6.921 14.693 19.386 420 HG3 PRO 55 HG3 PRO 55 8.691 14.536 19.587 421 HD2 PRO 55 HD2 PRO 55 7.282 16.696 20.548 422 HD3 PRO 55 HD3 PRO 55 8.931 16.900 19.890 423 H TYR 56 H TYR 56 6.414 16.281 15.007 424 HA TYR 56 HA TYR 56 3.579 16.000 15.872 425 HB2 TYR 56 HB2 TYR 56 2.855 17.660 14.369 426 HB3 TYR 56 HB3 TYR 56 4.078 18.349 15.404 427 HD1 TYR 56 HD1 TYR 56 6.653 18.138 14.237 428 HD2 TYR 56 HD2 TYR 56 2.843 18.518 12.230 429 HE1 TYR 56 HE1 TYR 56 7.789 19.027 12.252 430 HE2 TYR 56 HE2 TYR 56 3.972 19.538 10.288 431 HH TYR 56 HH TYR 56 6.006 20.163 9.341 432 H TYR 57 H TYR 57 5.742 14.187 14.789 433 HA TYR 57 HA TYR 57 4.044 12.706 12.896 434 HB2 TYR 57 HB2 TYR 57 6.896 13.515 12.341 435 HB3 TYR 57 HB3 TYR 57 6.115 12.084 11.670 436 HD1 TYR 57 HD1 TYR 57 4.188 12.224 10.141 437 HD2 TYR 57 HD2 TYR 57 6.266 15.756 11.503 438 HE1 TYR 57 HE1 TYR 57 3.042 13.561 8.401 439 HE2 TYR 57 HE2 TYR 57 5.161 17.080 9.737 440 HH TYR 57 HH TYR 57 3.560 17.102 8.048 441 H ILE 58 H ILE 58 3.608 11.559 14.910 442 HA ILE 58 HA ILE 58 5.764 9.751 15.847 443 HB ILE 58 HB ILE 58 3.787 11.225 17.634 444 HG12 ILE 58 HG12 ILE 58 5.613 12.742 17.089 445 HG13 ILE 58 HG13 ILE 58 5.665 12.250 18.769 446 HG21 ILE 58 HG21 ILE 58 5.016 10.067 19.513 447 HG22 ILE 58 HG22 ILE 58 4.057 8.993 18.500 448 HG23 ILE 58 HG23 ILE 58 5.811 9.041 18.297 449 HD11 ILE 58 HD13 ILE 58 7.925 12.270 17.971 450 HD12 ILE 58 HD11 ILE 58 7.479 10.575 18.152 451 HD13 ILE 58 HD12 ILE 58 7.504 11.312 16.543 452 H LEU 59 H LEU 59 4.934 7.662 16.223 453 HA LEU 59 HA LEU 59 2.106 7.236 15.307 454 HB2 LEU 59 HB2 LEU 59 4.627 5.861 14.361 455 HB3 LEU 59 HB3 LEU 59 2.991 5.271 14.089 456 HG LEU 59 HG LEU 59 2.707 7.931 13.343 457 HD11 LEU 59 HD11 LEU 59 5.430 7.083 12.292 458 HD12 LEU 59 HD12 LEU 59 4.560 8.623 12.024 459 HD13 LEU 59 HD13 LEU 59 5.194 8.233 13.608 460 HD21 LEU 59 HD23 LEU 59 1.817 5.980 12.252 461 HD22 LEU 59 HD21 LEU 59 2.526 7.112 11.105 462 HD23 LEU 59 HD22 LEU 59 3.406 5.617 11.535 463 H ALA 60 H ALA 60 4.754 6.112 17.388 464 HA ALA 60 HA ALA 60 3.017 4.461 18.979 465 HB1 ALA 60 HB3 ALA 60 3.371 2.889 17.075 466 HB2 ALA 60 HB1 ALA 60 5.125 3.122 17.196 467 HB3 ALA 60 HB2 ALA 60 4.243 2.317 18.500 468 HA PRO 61 HA PRO 61 6.289 5.296 21.931 469 HB2 PRO 61 HB2 PRO 61 6.414 2.284 22.331 470 HB3 PRO 61 HB3 PRO 61 6.453 3.576 23.566 471 HG2 PRO 61 HG2 PRO 61 4.149 2.263 23.079 472 HG3 PRO 61 HG3 PRO 61 4.123 4.051 23.237 473 HD2 PRO 61 HD2 PRO 61 4.105 2.382 20.721 474 HD3 PRO 61 HD3 PRO 61 3.138 3.835 21.118 475 H GLY 62 H GLY 62 8.143 5.997 21.030 476 HA2 GLY 62 HA2 GLY 62 10.387 5.795 20.535 477 HA3 GLY 62 HA3 GLY 62 10.209 4.063 20.282 478 H VAL 63 H VAL 63 7.809 5.694 18.417 479 HA VAL 63 HA VAL 63 9.519 5.410 15.990 480 HB VAL 63 HB VAL 63 6.583 4.684 16.274 481 HG11 VAL 63 HG11 VAL 63 7.250 5.223 13.958 482 HG12 VAL 63 HG12 VAL 63 8.588 4.068 14.059 483 HG13 VAL 63 HG13 VAL 63 6.903 3.504 14.106 484 HG21 VAL 63 HG23 VAL 63 9.038 2.892 16.442 485 HG22 VAL 63 HG21 VAL 63 7.772 3.114 17.661 486 HG23 VAL 63 HG22 VAL 63 7.383 2.307 16.156 487 H ALA 64 H ALA 64 9.586 7.112 14.696 488 HA ALA 64 HA ALA 64 7.416 9.135 14.707 489 HB1 ALA 64 HB3 ALA 64 9.401 9.985 15.966 490 HB2 ALA 64 HB1 ALA 64 10.407 9.692 14.523 491 HB3 ALA 64 HB2 ALA 64 9.115 10.905 14.486 492 H MET 65 H MET 65 7.630 10.539 12.664 493 HA MET 65 HA MET 65 8.783 9.071 10.393 494 HB2 MET 65 HB2 MET 65 6.559 8.144 10.659 495 HB3 MET 65 HB3 MET 65 5.865 9.771 10.555 496 HG2 MET 65 HG2 MET 65 7.313 9.664 8.212 497 HG3 MET 65 HG3 MET 65 6.947 7.969 8.445 498 HE1 MET 65 HE3 MET 65 4.580 7.058 8.730 499 HE2 MET 65 HE1 MET 65 4.078 8.199 9.990 500 HE3 MET 65 HE2 MET 65 3.048 7.956 8.562 501 HA PRO 66 HA PRO 66 9.013 13.751 10.312 502 HB2 PRO 66 HB2 PRO 66 11.756 12.971 9.214 503 HB3 PRO 66 HB3 PRO 66 11.328 14.412 10.181 504 HG2 PRO 66 HG2 PRO 66 12.453 12.321 11.424 505 HG3 PRO 66 HG3 PRO 66 11.005 13.072 12.156 506 HD2 PRO 66 HD2 PRO 66 11.131 10.586 10.412 507 HD3 PRO 66 HD3 PRO 66 10.304 10.820 11.983 508 H HIS 67 H HIS 67 8.597 14.975 8.615 509 HA HIS 67 HA HIS 67 8.725 14.597 5.810 510 HB2 HIS 67 HB2 HIS 67 7.236 12.731 5.951 511 HB3 HIS 67 HB3 HIS 67 6.336 13.434 7.282 512 HD1 HIS 67 HD1 HIS 67 4.262 14.946 6.713 513 HD2 HIS 67 HD2 HIS 67 6.532 13.791 3.355 514 HE1 HIS 67 HE1 HIS 67 2.867 15.468 4.668 515 H ALA 68 H ALA 68 7.456 16.386 4.831 516 HA ALA 68 HA ALA 68 6.085 18.244 6.649 517 HB1 ALA 68 HB3 ALA 68 8.388 19.111 4.851 518 HB2 ALA 68 HB1 ALA 68 7.226 20.212 5.613 519 HB3 ALA 68 HB2 ALA 68 8.304 19.240 6.616 520 H ARG 69 H ARG 69 4.761 19.814 5.300 521 HA ARG 69 HA ARG 69 3.288 18.489 3.299 522 HB2 ARG 69 HB2 ARG 69 3.602 21.351 4.191 523 HB3 ARG 69 HB3 ARG 69 2.864 21.084 2.636 524 HG2 ARG 69 HG2 ARG 69 1.869 19.847 5.228 525 HG3 ARG 69 HG3 ARG 69 1.226 21.314 4.493 526 HD2 ARG 69 HD2 ARG 69 1.113 18.514 3.292 527 HD3 ARG 69 HD3 ARG 69 -0.215 19.429 4.007 528 HE ARG 69 HE ARG 69 1.175 20.684 1.705 529 HH11 ARG 69 HH11 ARG 69 -1.552 18.595 2.628 530 HH12 ARG 69 HH12 ARG 69 -2.479 18.985 1.228 531 HH21 ARG 69 HH21 ARG 69 -0.069 21.327 0.003 532 HH22 ARG 69 HH22 ARG 69 -1.590 20.550 -0.354 533 HA PRO 70 HA PRO 70 5.923 18.199 -0.198 534 HB2 PRO 70 HB2 PRO 70 3.473 19.350 -1.646 535 HB3 PRO 70 HB3 PRO 70 4.571 18.078 -2.224 536 HG2 PRO 70 HG2 PRO 70 2.238 17.402 -1.047 537 HG3 PRO 70 HG3 PRO 70 3.726 16.537 -0.542 538 HD2 PRO 70 HD2 PRO 70 2.285 18.781 0.870 539 HD3 PRO 70 HD3 PRO 70 3.084 17.329 1.548 540 H GLU 71 H GLU 71 3.888 21.214 -0.230 541 HA GLU 71 HA GLU 71 5.688 22.668 -1.901 542 HB2 GLU 71 HB2 GLU 71 4.273 24.624 -1.336 543 HB3 GLU 71 HB3 GLU 71 3.395 23.246 -1.963 544 HG2 GLU 71 HG2 GLU 71 3.574 23.566 1.038 545 HG3 GLU 71 HG3 GLU 71 2.540 24.663 0.128 546 H CYS 72 H CYS 72 6.284 21.789 1.281 547 HA CYS 72 HA CYS 72 7.675 24.259 2.069 548 HB2 CYS 72 HB2 CYS 72 7.653 21.469 3.308 549 HB3 CYS 72 HB3 CYS 72 8.451 22.897 3.985 550 HG CYS 72 HG CYS 72 6.275 22.483 5.334 551 H GLY 73 H GLY 73 8.342 21.830 -0.206 552 HA2 GLY 73 HA2 GLY 73 10.513 22.564 -1.312 553 HA3 GLY 73 HA3 GLY 73 11.301 22.122 0.201 554 H ALA 74 H ALA 74 8.641 20.013 -0.756 555 HA ALA 74 HA ALA 74 10.490 17.806 -1.313 556 HB1 ALA 74 HB3 ALA 74 8.254 17.407 -0.301 557 HB2 ALA 74 HB1 ALA 74 7.518 18.015 -1.811 558 HB3 ALA 74 HB2 ALA 74 8.513 16.546 -1.830 559 H LEU 75 H LEU 75 10.894 16.932 -3.302 560 HA LEU 75 HA LEU 75 10.214 18.552 -5.721 561 HB2 LEU 75 HB2 LEU 75 12.870 17.286 -4.981 562 HB3 LEU 75 HB3 LEU 75 12.533 18.122 -6.489 563 HG LEU 75 HG LEU 75 12.519 19.419 -3.727 564 HD11 LEU 75 HD11 LEU 75 14.769 18.688 -4.386 565 HD12 LEU 75 HD12 LEU 75 14.615 19.541 -5.933 566 HD13 LEU 75 HD13 LEU 75 14.643 20.452 -4.404 567 HD21 LEU 75 HD23 LEU 75 11.063 20.634 -5.319 568 HD22 LEU 75 HD21 LEU 75 12.523 21.561 -4.977 569 HD23 LEU 75 HD22 LEU 75 12.379 20.673 -6.511 570 H LYS 76 H LYS 76 10.926 15.369 -4.286 571 HA LYS 76 HA LYS 76 9.471 14.103 -6.479 572 HB2 LYS 76 HB2 LYS 76 12.162 13.106 -5.482 573 HB3 LYS 76 HB3 LYS 76 11.132 12.292 -6.656 574 HG2 LYS 76 HG2 LYS 76 11.482 14.201 -8.229 575 HG3 LYS 76 HG3 LYS 76 12.565 14.960 -7.037 576 HD2 LYS 76 HD2 LYS 76 14.048 12.982 -7.101 577 HD3 LYS 76 HD3 LYS 76 13.020 12.228 -8.325 578 HE2 LYS 76 HE2 LYS 76 14.456 14.908 -8.636 579 HE3 LYS 76 HE3 LYS 76 15.082 13.362 -9.221 580 HZ1 LYS 76 HZ3 LYS 76 12.577 14.638 -10.160 581 HZ2 LYS 76 HZ1 LYS 76 13.978 14.554 -10.985 582 HZ3 LYS 76 HZ2 LYS 76 13.147 13.192 -10.675 583 H THR 77 H THR 77 8.524 12.042 -5.772 584 HA THR 77 HA THR 77 8.109 11.939 -2.938 585 HB THR 77 HB THR 77 7.055 10.326 -5.298 586 HG1 THR 77 HG1 THR 77 5.911 11.985 -5.716 587 HG21 THR 77 HG23 THR 77 5.219 9.694 -3.887 588 HG22 THR 77 HG21 THR 77 6.704 9.298 -3.029 589 HG23 THR 77 HG22 THR 77 5.790 10.749 -2.569 590 H GLY 78 H GLY 78 9.011 10.506 -1.510 591 HA2 GLY 78 HA2 GLY 78 10.067 7.966 -2.295 592 HA3 GLY 78 HA3 GLY 78 11.366 9.148 -2.053 593 H MET 79 H MET 79 11.740 7.331 -0.339 594 HA MET 79 HA MET 79 10.760 8.310 2.258 595 HB2 MET 79 HB2 MET 79 10.462 5.477 1.179 596 HB3 MET 79 HB3 MET 79 10.604 5.794 2.904 597 HG2 MET 79 HG2 MET 79 8.596 7.137 2.928 598 HG3 MET 79 HG3 MET 79 8.432 7.012 1.178 599 HE1 MET 79 HE3 MET 79 8.926 4.875 4.384 600 HE2 MET 79 HE1 MET 79 8.098 3.357 4.020 601 HE3 MET 79 HE2 MET 79 9.630 3.736 3.212 602 H SER 80 H SER 80 12.052 7.178 4.072 603 HA SER 80 HA SER 80 14.466 5.737 3.438 604 HB2 SER 80 HB2 SER 80 14.605 8.645 4.422 605 HB3 SER 80 HB3 SER 80 15.936 7.506 4.671 606 HG SER 80 HG SER 80 14.833 7.775 2.098 607 H LEU 81 H LEU 81 15.690 5.386 5.674 608 HA LEU 81 HA LEU 81 13.724 5.018 7.872 609 HB2 LEU 81 HB2 LEU 81 13.490 3.254 6.211 610 HB3 LEU 81 HB3 LEU 81 15.235 2.998 6.179 611 HG LEU 81 HG LEU 81 15.285 1.855 8.197 612 HD11 LEU 81 HD11 LEU 81 13.739 3.222 9.585 613 HD12 LEU 81 HD12 LEU 81 12.364 2.576 8.660 614 HD13 LEU 81 HD13 LEU 81 13.349 1.504 9.657 615 HD21 LEU 81 HD23 LEU 81 13.911 -0.029 7.509 616 HD22 LEU 81 HD21 LEU 81 12.691 1.042 6.798 617 HD23 LEU 81 HD22 LEU 81 14.249 0.885 6.003 618 H THR 82 H THR 82 14.761 5.679 9.698 619 HA THR 82 HA THR 82 17.709 5.298 9.961 620 HB THR 82 HB THR 82 15.902 7.483 11.088 621 HG1 THR 82 HG1 THR 82 16.396 7.593 8.822 622 HG21 THR 82 HG23 THR 82 18.917 7.058 11.330 623 HG22 THR 82 HG21 THR 82 18.067 8.573 11.737 624 HG23 THR 82 HG22 THR 82 17.711 7.093 12.629 625 H LEU 83 H LEU 83 18.423 4.447 11.939 626 HA LEU 83 HA LEU 83 16.421 4.066 14.071 627 HB2 LEU 83 HB2 LEU 83 16.704 1.900 12.767 628 HB3 LEU 83 HB3 LEU 83 18.404 1.919 13.231 629 HG LEU 83 HG LEU 83 17.505 2.047 15.701 630 HD11 LEU 83 HD11 LEU 83 15.322 1.262 16.126 631 HD12 LEU 83 HD12 LEU 83 15.118 2.525 14.920 632 HD13 LEU 83 HD13 LEU 83 15.025 0.825 14.416 633 HD21 LEU 83 HD23 LEU 83 17.217 -0.409 15.787 634 HD22 LEU 83 HD21 LEU 83 17.137 -0.416 14.015 635 HD23 LEU 83 HD22 LEU 83 18.630 0.081 14.836 636 H LEU 84 H LEU 84 17.322 4.306 16.105 637 HA LEU 84 HA LEU 84 20.213 5.086 16.324 638 HB2 LEU 84 HB2 LEU 84 17.698 6.246 17.528 639 HB3 LEU 84 HB3 LEU 84 19.259 6.378 18.341 640 HG LEU 84 HG LEU 84 20.208 7.689 16.579 641 HD11 LEU 84 HD11 LEU 84 18.770 8.606 14.738 642 HD12 LEU 84 HD12 LEU 84 19.177 6.905 14.561 643 HD13 LEU 84 HD13 LEU 84 17.552 7.368 15.134 644 HD21 LEU 84 HD23 LEU 84 18.706 9.683 16.860 645 HD22 LEU 84 HD21 LEU 84 17.443 8.622 17.486 646 HD23 LEU 84 HD22 LEU 84 18.977 8.800 18.372 647 H GLU 85 H GLU 85 21.264 3.765 17.843 648 HA GLU 85 HA GLU 85 19.910 1.653 19.165 649 HB2 GLU 85 HB2 GLU 85 22.687 2.799 19.599 650 HB3 GLU 85 HB3 GLU 85 22.069 1.361 20.412 651 HG2 GLU 85 HG2 GLU 85 21.659 0.282 18.207 652 HG3 GLU 85 HG3 GLU 85 22.359 1.681 17.395 653 H GLN 86 H GLN 86 21.180 4.729 20.409 654 HA GLN 86 HA GLN 86 20.001 4.238 23.076 655 HB2 GLN 86 HB2 GLN 86 21.406 6.729 22.007 656 HB3 GLN 86 HB3 GLN 86 21.002 6.390 23.678 657 HG2 GLN 86 HG2 GLN 86 22.466 4.266 23.460 658 HG3 GLN 86 HG3 GLN 86 23.085 4.980 21.969 659 HE21 GLN 86 HE22 GLN 86 24.110 7.248 22.179 660 HE22 GLN 86 HE21 GLN 86 24.905 7.613 23.692 661 H GLY 87 H GLY 87 18.966 5.665 20.122 662 HA2 GLY 87 HA2 GLY 87 17.139 6.960 19.549 663 HA3 GLY 87 HA3 GLY 87 16.524 6.797 21.197 664 H VAL 88 H VAL 88 16.073 9.213 20.324 665 HA VAL 88 HA VAL 88 17.789 10.749 22.077 666 HB VAL 88 HB VAL 88 18.500 10.925 19.453 667 HG11 VAL 88 HG11 VAL 88 16.530 13.203 19.704 668 HG12 VAL 88 HG12 VAL 88 17.660 12.869 18.386 669 HG13 VAL 88 HG13 VAL 88 16.327 11.735 18.712 670 HG21 VAL 88 HG23 VAL 88 19.733 11.789 21.296 671 HG22 VAL 88 HG21 VAL 88 19.618 12.986 19.996 672 HG23 VAL 88 HG22 VAL 88 18.618 13.169 21.458 673 H TYR 89 H TYR 89 16.589 13.005 22.397 674 HA TYR 89 HA TYR 89 13.714 12.266 22.634 675 HB2 TYR 89 HB2 TYR 89 15.069 11.943 24.700 676 HB3 TYR 89 HB3 TYR 89 15.394 13.661 24.720 677 HD1 TYR 89 HD2 TYR 89 11.949 13.058 23.582 678 HD2 TYR 89 HD1 TYR 89 14.494 13.238 27.092 679 HE1 TYR 89 HE2 TYR 89 10.001 13.357 24.997 680 HE2 TYR 89 HE1 TYR 89 12.493 13.595 28.508 681 HH TYR 89 HH TYR 89 9.190 13.843 27.078 682 H PHE 90 H PHE 90 12.996 13.443 20.932 683 HA PHE 90 HA PHE 90 13.400 16.125 20.287 684 HB2 PHE 90 HB2 PHE 90 10.902 14.391 20.335 685 HB3 PHE 90 HB3 PHE 90 10.949 15.987 19.576 686 HD1 PHE 90 HD2 PHE 90 13.139 16.289 17.945 687 HD2 PHE 90 HD1 PHE 90 10.986 12.646 18.739 688 HE1 PHE 90 HE2 PHE 90 13.948 15.351 15.808 689 HE2 PHE 90 HE1 PHE 90 11.781 11.713 16.574 690 HZ PHE 90 HZ PHE 90 13.268 13.068 15.107 691 HA PRO 91 HA PRO 91 12.246 18.201 23.944 692 HB2 PRO 91 HB2 PRO 91 11.439 20.693 23.037 693 HB3 PRO 91 HB3 PRO 91 13.138 20.137 23.131 694 HG2 PRO 91 HG2 PRO 91 11.297 20.115 20.729 695 HG3 PRO 91 HG3 PRO 91 13.005 20.661 20.817 696 HD2 PRO 91 HD2 PRO 91 12.345 18.199 19.887 697 HD3 PRO 91 HD3 PRO 91 13.802 18.432 20.905 698 H GLY 92 H GLY 92 10.523 18.128 25.255 699 HA2 GLY 92 HA2 GLY 92 8.415 18.269 26.060 700 HA3 GLY 92 HA3 GLY 92 7.955 19.133 24.589 701 H ASN 93 H ASN 93 9.199 16.001 23.728 702 HA ASN 93 HA ASN 93 6.513 15.041 23.139 703 HB2 ASN 93 HB2 ASN 93 8.645 14.636 21.762 704 HB3 ASN 93 HB3 ASN 93 9.138 13.504 22.999 705 HD21 ASN 93 HD21 ASN 93 8.897 11.518 21.992 706 HD22 ASN 93 HD22 ASN 93 7.427 10.994 21.185 707 H ASP 94 H ASP 94 5.912 12.720 23.910 708 HA ASP 94 HA ASP 94 5.975 12.646 26.775 709 HB2 ASP 94 HB2 ASP 94 4.139 11.689 25.418 710 HB3 ASP 94 HB3 ASP 94 5.239 10.442 24.819 711 H GLU 95 H GLU 95 7.857 10.941 24.290 712 HA GLU 95 HA GLU 95 9.835 10.045 26.266 713 HB2 GLU 95 HB2 GLU 95 9.318 7.788 26.053 714 HB3 GLU 95 HB3 GLU 95 7.738 8.535 26.003 715 HG2 GLU 95 HG2 GLU 95 7.750 8.390 23.508 716 HG3 GLU 95 HG3 GLU 95 9.290 7.526 23.613 717 HA PRO 96 HA PRO 96 12.609 10.440 22.830 718 HB2 PRO 96 HB2 PRO 96 14.498 8.490 23.130 719 HB3 PRO 96 HB3 PRO 96 14.316 9.833 24.296 720 HG2 PRO 96 HG2 PRO 96 13.214 7.023 24.511 721 HG3 PRO 96 HG3 PRO 96 14.092 7.967 25.756 722 HD2 PRO 96 HD2 PRO 96 11.365 7.780 25.645 723 HD3 PRO 96 HD3 PRO 96 12.185 9.256 26.246 724 H ILE 97 H ILE 97 13.408 9.503 20.813 725 HA ILE 97 HA ILE 97 11.684 7.285 19.758 726 HB ILE 97 HB ILE 97 12.780 9.743 18.356 727 HG12 ILE 97 HG12 ILE 97 10.984 10.473 19.729 728 HG13 ILE 97 HG13 ILE 97 10.379 10.390 18.089 729 HG21 ILE 97 HG21 ILE 97 11.568 9.038 16.387 730 HG22 ILE 97 HG22 ILE 97 12.683 7.762 16.814 731 HG23 ILE 97 HG23 ILE 97 10.961 7.588 17.193 732 HD11 ILE 97 HD13 ILE 97 8.726 9.616 19.739 733 HD12 ILE 97 HD11 ILE 97 9.156 8.304 18.623 734 HD13 ILE 97 HD12 ILE 97 9.794 8.349 20.288 735 H LYS 98 H LYS 98 12.646 5.684 18.743 736 HA LYS 98 HA LYS 98 15.622 5.755 18.424 737 HB2 LYS 98 HB2 LYS 98 13.697 3.511 19.131 738 HB3 LYS 98 HB3 LYS 98 15.299 3.201 18.445 739 HG2 LYS 98 HG2 LYS 98 16.403 4.261 20.312 740 HG3 LYS 98 HG3 LYS 98 14.868 4.808 20.992 741 HD2 LYS 98 HD2 LYS 98 15.834 2.808 22.148 742 HD3 LYS 98 HD3 LYS 98 14.194 2.593 21.554 743 HE2 LYS 98 HE2 LYS 98 15.525 0.579 21.189 744 HE3 LYS 98 HE3 LYS 98 14.968 1.256 19.662 745 HZ1 LYS 98 HZ3 LYS 98 17.696 1.619 20.777 746 HZ2 LYS 98 HZ1 LYS 98 17.287 0.563 19.586 747 HZ3 LYS 98 HZ2 LYS 98 17.199 2.185 19.327 748 H LEU 99 H LEU 99 12.524 5.472 16.774 749 HA LEU 99 HA LEU 99 13.985 4.570 14.333 750 HB2 LEU 99 HB2 LEU 99 12.759 2.677 15.369 751 HB3 LEU 99 HB3 LEU 99 11.322 3.691 15.516 752 HG LEU 99 HG LEU 99 11.112 3.744 13.031 753 HD11 LEU 99 HD11 LEU 99 13.358 1.660 13.093 754 HD12 LEU 99 HD12 LEU 99 12.331 2.031 11.702 755 HD13 LEU 99 HD13 LEU 99 13.426 3.254 12.330 756 HD21 LEU 99 HD23 LEU 99 9.915 2.118 14.511 757 HD22 LEU 99 HD21 LEU 99 10.168 1.540 12.875 758 HD23 LEU 99 HD22 LEU 99 11.197 0.939 14.205 759 H LEU 100 H LEU 100 13.573 5.689 12.528 760 HA LEU 100 HA LEU 100 11.256 7.549 12.507 761 HB2 LEU 100 HB2 LEU 100 14.030 8.413 11.633 762 HB3 LEU 100 HB3 LEU 100 12.588 9.376 11.748 763 HG LEU 100 HG LEU 100 12.822 8.525 14.346 764 HD11 LEU 100 HD11 LEU 100 15.687 8.931 13.424 765 HD12 LEU 100 HD12 LEU 100 15.134 8.672 15.095 766 HD13 LEU 100 HD13 LEU 100 14.990 7.372 13.906 767 HD21 LEU 100 HD23 LEU 100 13.656 10.680 14.962 768 HD22 LEU 100 HD21 LEU 100 14.229 10.989 13.314 769 HD23 LEU 100 HD22 LEU 100 12.487 10.855 13.641 770 H ILE 101 H ILE 101 10.253 7.520 10.499 771 HA ILE 101 HA ILE 101 11.888 6.550 8.207 772 HB ILE 101 HB ILE 101 9.027 5.971 8.946 773 HG12 ILE 101 HG12 ILE 101 11.441 4.548 7.755 774 HG13 ILE 101 HG13 ILE 101 10.666 4.274 9.313 775 HG21 ILE 101 HG21 ILE 101 8.374 5.485 6.661 776 HG22 ILE 101 HG22 ILE 101 8.698 7.189 6.846 777 HG23 ILE 101 HG23 ILE 101 9.910 6.151 6.050 778 HD11 ILE 101 HD13 ILE 101 8.656 3.411 7.959 779 HD12 ILE 101 HD11 ILE 101 9.737 3.493 6.537 780 HD13 ILE 101 HD12 ILE 101 10.146 2.438 7.894 781 H GLY 102 H GLY 102 12.240 7.864 6.631 782 HA2 GLY 102 HA2 GLY 102 11.189 10.628 6.750 783 HA3 GLY 102 HA3 GLY 102 12.457 10.020 5.670 784 H LEU 103 H LEU 103 9.748 11.352 5.143 785 HA LEU 103 HA LEU 103 9.133 9.689 2.784 786 HB2 LEU 103 HB2 LEU 103 7.490 9.023 4.545 787 HB3 LEU 103 HB3 LEU 103 6.947 10.695 4.630 788 HG LEU 103 HG LEU 103 6.860 8.992 2.065 789 HD11 LEU 103 HD11 LEU 103 5.544 7.823 3.546 790 HD12 LEU 103 HD12 LEU 103 4.914 9.300 4.348 791 HD13 LEU 103 HD13 LEU 103 4.404 8.874 2.712 792 HD21 LEU 103 HD23 LEU 103 5.400 11.547 2.972 793 HD22 LEU 103 HD21 LEU 103 6.601 11.431 1.676 794 HD23 LEU 103 HD22 LEU 103 5.052 10.667 1.473 795 H SER 104 H SER 104 9.104 11.037 1.057 796 HA SER 104 HA SER 104 8.511 13.911 1.457 797 HB2 SER 104 HB2 SER 104 10.100 14.491 -0.298 798 HB3 SER 104 HB3 SER 104 10.923 13.741 1.078 799 HG SER 104 HG SER 104 10.634 12.887 -1.536 800 H ALA 105 H ALA 105 7.323 14.800 -0.427 801 HA ALA 105 HA ALA 105 6.478 12.890 -2.469 802 HB1 ALA 105 HB3 ALA 105 4.538 14.122 -0.475 803 HB2 ALA 105 HB1 ALA 105 4.082 13.256 -1.958 804 HB3 ALA 105 HB2 ALA 105 4.914 12.387 -0.647 805 H ALA 106 H ALA 106 6.115 13.933 -4.353 806 HA ALA 106 HA ALA 106 6.493 16.795 -4.447 807 HB1 ALA 106 HB3 ALA 106 6.262 16.473 -6.891 808 HB2 ALA 106 HB1 ALA 106 7.387 15.294 -6.196 809 HB3 ALA 106 HB2 ALA 106 5.733 14.799 -6.630 810 H ASP 107 H ASP 107 3.694 14.682 -4.224 811 HA ASP 107 HA ASP 107 1.871 17.004 -4.353 812 HB2 ASP 107 HB2 ASP 107 1.915 16.187 -6.677 813 HB3 ASP 107 HB3 ASP 107 1.597 14.543 -6.129 814 H ALA 108 H ALA 108 -0.235 16.484 -3.374 815 HA ALA 108 HA ALA 108 0.038 15.008 -1.011 816 HB1 ALA 108 HB3 ALA 108 -1.526 16.889 -1.276 817 HB2 ALA 108 HB1 ALA 108 -2.508 15.925 -2.411 818 HB3 ALA 108 HB2 ALA 108 -2.370 15.435 -0.709 819 H ASP 109 H ASP 109 -1.267 13.913 -4.167 820 HA ASP 109 HA ASP 109 -2.368 11.453 -2.988 821 HB2 ASP 109 HB2 ASP 109 -3.366 12.317 -4.984 822 HB3 ASP 109 HB3 ASP 109 -1.809 12.259 -5.846 823 H SER 110 H SER 110 0.700 12.480 -4.441 824 HA SER 110 HA SER 110 1.889 9.858 -4.486 825 HB2 SER 110 HB2 SER 110 3.395 12.474 -4.179 826 HB3 SER 110 HB3 SER 110 3.892 10.964 -4.961 827 HG SER 110 HG SER 110 3.306 12.473 -6.518 828 H HIS 111 H HIS 111 1.650 12.463 -2.024 829 HA HIS 111 HA HIS 111 3.142 11.194 0.049 830 HB2 HIS 111 HB2 HIS 111 2.563 13.461 0.413 831 HB3 HIS 111 HB3 HIS 111 0.893 13.203 -0.002 832 HD1 HIS 111 HD1 HIS 111 3.163 13.118 3.024 833 HD2 HIS 111 HD2 HIS 111 -0.795 12.303 1.845 834 HE1 HIS 111 HE1 HIS 111 1.823 12.836 5.160 835 H ILE 112 H ILE 112 -0.375 10.986 -0.756 836 HA ILE 112 HA ILE 112 -1.067 9.088 1.203 837 HB ILE 112 HB ILE 112 -2.130 9.603 -1.592 838 HG12 ILE 112 HG12 ILE 112 -2.416 11.390 0.174 839 HG13 ILE 112 HG13 ILE 112 -3.871 10.832 -0.631 840 HG21 ILE 112 HG21 ILE 112 -3.276 7.685 0.443 841 HG22 ILE 112 HG22 ILE 112 -4.169 8.343 -0.955 842 HG23 ILE 112 HG23 ILE 112 -2.742 7.339 -1.216 843 HD11 ILE 112 HD13 ILE 112 -4.505 9.541 1.337 844 HD12 ILE 112 HD11 ILE 112 -2.960 9.947 2.134 845 HD13 ILE 112 HD12 ILE 112 -4.151 11.221 1.780 846 H GLY 113 H GLY 113 0.163 8.452 -2.163 847 HA2 GLY 113 HA2 GLY 113 0.129 5.655 -2.001 848 HA3 GLY 113 HA3 GLY 113 1.234 6.612 -3.002 849 H ALA 114 H ALA 114 2.730 7.922 -0.984 850 HA ALA 114 HA ALA 114 4.633 5.841 -0.349 851 HB1 ALA 114 HB3 ALA 114 5.935 7.682 0.551 852 HB2 ALA 114 HB1 ALA 114 5.245 8.160 -1.009 853 HB3 ALA 114 HB2 ALA 114 4.510 8.762 0.471 854 H ILE 115 H ILE 115 2.344 7.807 1.638 855 HA ILE 115 HA ILE 115 2.961 6.861 4.139 856 HB ILE 115 HB ILE 115 0.589 7.930 2.811 857 HG12 ILE 115 HG12 ILE 115 2.436 9.516 3.498 858 HG13 ILE 115 HG13 ILE 115 0.861 9.875 4.161 859 HG21 ILE 115 HG21 ILE 115 -0.579 8.070 5.026 860 HG22 ILE 115 HG22 ILE 115 -0.511 6.496 4.225 861 HG23 ILE 115 HG23 ILE 115 0.593 6.828 5.584 862 HD11 ILE 115 HD13 ILE 115 3.059 8.457 5.698 863 HD12 ILE 115 HD11 ILE 115 2.676 10.181 5.799 864 HD13 ILE 115 HD12 ILE 115 1.492 8.985 6.347 865 H GLN 116 H GLN 116 0.677 5.652 1.608 866 HA GLN 116 HA GLN 116 -0.171 3.316 3.000 867 HB2 GLN 116 HB2 GLN 116 -0.303 4.187 0.095 868 HB3 GLN 116 HB3 GLN 116 -1.030 2.684 0.666 869 HG2 GLN 116 HG2 GLN 116 -1.681 5.377 1.909 870 HG3 GLN 116 HG3 GLN 116 -2.560 4.724 0.529 871 HE21 GLN 116 HE22 GLN 116 -3.807 2.692 0.838 872 HE22 GLN 116 HE21 GLN 116 -4.324 2.236 2.440 873 H ALA 117 H ALA 117 2.873 3.906 1.999 874 HA ALA 117 HA ALA 117 3.460 1.072 1.539 875 HB1 ALA 117 HB3 ALA 117 4.340 2.860 -0.164 876 HB2 ALA 117 HB1 ALA 117 5.430 3.355 1.138 877 HB3 ALA 117 HB2 ALA 117 5.515 1.713 0.491 878 H LEU 118 H LEU 118 4.548 3.985 3.373 879 HA LEU 118 HA LEU 118 6.060 2.335 5.117 880 HB2 LEU 118 HB2 LEU 118 6.312 4.231 6.480 881 HB3 LEU 118 HB3 LEU 118 6.411 4.650 4.741 882 HG LEU 118 HG LEU 118 4.389 5.697 4.727 883 HD11 LEU 118 HD11 LEU 118 4.158 5.134 7.721 884 HD12 LEU 118 HD12 LEU 118 3.305 6.479 6.903 885 HD13 LEU 118 HD13 LEU 118 2.924 4.865 6.479 886 HD21 LEU 118 HD23 LEU 118 5.183 7.662 5.959 887 HD22 LEU 118 HD21 LEU 118 6.178 6.620 7.000 888 HD23 LEU 118 HD22 LEU 118 6.564 6.806 5.285 889 H SER 119 H SER 119 2.683 3.094 5.161 890 HA SER 119 HA SER 119 2.037 2.372 7.776 891 HB2 SER 119 HB2 SER 119 -0.188 1.694 6.866 892 HB3 SER 119 HB3 SER 119 0.370 3.273 6.287 893 HG SER 119 HG SER 119 -0.517 1.758 4.682 894 H GLU 120 H GLU 120 3.070 0.200 5.187 895 HA GLU 120 HA GLU 120 2.180 -2.223 6.498 896 HB2 GLU 120 HB2 GLU 120 4.082 -1.616 4.205 897 HB3 GLU 120 HB3 GLU 120 3.904 -3.241 4.807 898 HG2 GLU 120 HG2 GLU 120 1.640 -1.521 3.733 899 HG3 GLU 120 HG3 GLU 120 2.479 -2.785 2.832 900 H LEU 121 H LEU 121 4.636 0.016 7.045 901 HA LEU 121 HA LEU 121 6.214 -1.946 8.651 902 HB2 LEU 121 HB2 LEU 121 7.029 0.830 7.737 903 HB3 LEU 121 HB3 LEU 121 8.043 -0.358 8.563 904 HG LEU 121 HG LEU 121 6.966 -0.427 5.715 905 HD11 LEU 121 HD11 LEU 121 9.786 -0.294 6.875 906 HD12 LEU 121 HD12 LEU 121 9.381 -0.414 5.154 907 HD13 LEU 121 HD13 LEU 121 8.895 1.020 6.068 908 HD21 LEU 121 HD23 LEU 121 8.645 -2.592 7.073 909 HD22 LEU 121 HD21 LEU 121 6.950 -2.771 6.570 910 HD23 LEU 121 HD22 LEU 121 8.201 -2.530 5.357 911 H LEU 122 H LEU 122 5.312 1.557 8.868 912 HA LEU 122 HA LEU 122 5.788 1.632 11.677 913 HB2 LEU 122 HB2 LEU 122 4.219 3.611 10.034 914 HB3 LEU 122 HB3 LEU 122 4.927 3.845 11.636 915 HG LEU 122 HG LEU 122 6.354 3.588 8.981 916 HD11 LEU 122 HD11 LEU 122 6.880 5.673 11.093 917 HD12 LEU 122 HD12 LEU 122 6.934 5.792 9.318 918 HD13 LEU 122 HD13 LEU 122 5.385 5.766 10.153 919 HD21 LEU 122 HD23 LEU 122 7.746 2.217 10.418 920 HD22 LEU 122 HD21 LEU 122 8.512 3.806 10.325 921 HD23 LEU 122 HD22 LEU 122 7.589 3.363 11.764 922 H CYS 123 H CYS 123 2.939 0.561 9.984 923 HA CYS 123 HA CYS 123 1.386 0.812 12.510 924 HB2 CYS 123 HB2 CYS 123 0.253 0.502 9.703 925 HB3 CYS 123 HB3 CYS 123 -0.633 0.822 11.191 926 HG CYS 123 HG CYS 123 -0.644 2.986 9.750 927 H GLU 124 H GLU 124 3.391 -1.192 11.870 928 HA GLU 124 HA GLU 124 1.730 -3.593 12.285 929 HB2 GLU 124 HB2 GLU 124 4.013 -3.304 10.306 930 HB3 GLU 124 HB3 GLU 124 3.534 -4.867 10.970 931 HG2 GLU 124 HG2 GLU 124 1.723 -2.962 9.461 932 HG3 GLU 124 HG3 GLU 124 2.516 -4.380 8.763 933 H GLU 125 H GLU 125 2.009 -3.649 14.350 934 HA GLU 125 HA GLU 125 4.279 -2.803 15.768 935 HB2 GLU 125 HB2 GLU 125 3.322 -3.869 17.716 936 HB3 GLU 125 HB3 GLU 125 2.076 -3.048 16.779 937 HG2 GLU 125 HG2 GLU 125 1.392 -5.254 15.799 938 HG3 GLU 125 HG3 GLU 125 2.607 -6.055 16.797 939 H GLU 126 H GLU 126 3.701 -5.897 14.222 940 HA GLU 126 HA GLU 126 5.767 -7.362 15.543 941 HB2 GLU 126 HB2 GLU 126 4.739 -7.779 12.701 942 HB3 GLU 126 HB3 GLU 126 5.587 -8.954 13.717 943 HG2 GLU 126 HG2 GLU 126 3.655 -8.754 15.359 944 HG3 GLU 126 HG3 GLU 126 2.823 -7.779 14.135 945 H ILE 127 H ILE 127 5.615 -5.340 12.650 946 HA ILE 127 HA ILE 127 8.359 -5.758 11.817 947 HB ILE 127 HB ILE 127 6.160 -3.903 11.023 948 HG12 ILE 127 HG12 ILE 127 6.313 -4.938 8.891 949 HG13 ILE 127 HG13 ILE 127 7.863 -5.700 9.271 950 HG21 ILE 127 HG21 ILE 127 7.848 -2.351 10.818 951 HG22 ILE 127 HG22 ILE 127 9.069 -3.568 10.414 952 HG23 ILE 127 HG23 ILE 127 7.866 -3.105 9.212 953 HD11 ILE 127 HD13 ILE 127 6.799 -7.299 10.740 954 HD12 ILE 127 HD11 ILE 127 5.219 -6.474 10.554 955 HD13 ILE 127 HD12 ILE 127 5.972 -7.308 9.190 956 H LEU 128 H LEU 128 6.589 -3.264 13.702 957 HA LEU 128 HA LEU 128 8.669 -1.450 13.970 958 HB2 LEU 128 HB2 LEU 128 6.527 -2.196 16.015 959 HB3 LEU 128 HB3 LEU 128 7.633 -0.851 16.224 960 HG LEU 128 HG LEU 128 5.552 -1.088 14.016 961 HD11 LEU 128 HD11 LEU 128 5.773 0.724 16.453 962 HD12 LEU 128 HD12 LEU 128 4.529 0.832 15.187 963 HD13 LEU 128 HD13 LEU 128 4.615 -0.592 16.227 964 HD21 LEU 128 HD23 LEU 128 6.279 1.376 13.694 965 HD22 LEU 128 HD21 LEU 128 7.793 0.894 14.480 966 HD23 LEU 128 HD22 LEU 128 7.281 0.104 12.976 967 H GLU 129 H GLU 129 8.132 -4.325 16.012 968 HA GLU 129 HA GLU 129 10.294 -3.611 17.723 969 HB2 GLU 129 HB2 GLU 129 9.809 -5.379 19.000 970 HB3 GLU 129 HB3 GLU 129 8.269 -5.226 18.167 971 HG2 GLU 129 HG2 GLU 129 9.047 -7.047 16.582 972 HG3 GLU 129 HG3 GLU 129 10.514 -7.203 17.563 973 H GLN 130 H GLN 130 10.099 -5.428 14.650 974 HA GLN 130 HA GLN 130 12.674 -6.684 14.984 975 HB2 GLN 130 HB2 GLN 130 10.717 -6.369 12.685 976 HB3 GLN 130 HB3 GLN 130 12.285 -7.181 12.505 977 HG2 GLN 130 HG2 GLN 130 11.731 -8.838 14.167 978 HG3 GLN 130 HG3 GLN 130 10.220 -8.024 14.565 979 HE21 GLN 130 HE22 GLN 130 8.429 -8.205 13.164 980 HE22 GLN 130 HE21 GLN 130 8.373 -9.373 11.846 981 H LEU 131 H LEU 131 11.402 -3.694 13.468 982 HA LEU 131 HA LEU 131 13.949 -2.822 12.369 983 HB2 LEU 131 HB2 LEU 131 11.597 -1.206 13.416 984 HB3 LEU 131 HB3 LEU 131 12.934 -0.554 12.480 985 HG LEU 131 HG LEU 131 11.077 -2.731 11.405 986 HD11 LEU 131 HD11 LEU 131 9.741 -0.967 10.391 987 HD12 LEU 131 HD12 LEU 131 9.794 -0.790 12.166 988 HD13 LEU 131 HD13 LEU 131 10.778 0.270 11.126 989 HD21 LEU 131 HD23 LEU 131 12.723 -0.668 9.917 990 HD22 LEU 131 HD21 LEU 131 13.224 -2.358 10.183 991 HD23 LEU 131 HD22 LEU 131 11.784 -1.981 9.216 992 H LEU 132 H LEU 132 12.111 -2.049 15.352 993 HA LEU 132 HA LEU 132 14.044 -0.402 16.526 994 HB2 LEU 132 HB2 LEU 132 11.908 -2.130 17.775 995 HB3 LEU 132 HB3 LEU 132 12.959 -1.153 18.777 996 HG LEU 132 HG LEU 132 11.350 0.094 16.516 997 HD11 LEU 132 HD11 LEU 132 9.695 0.762 18.219 998 HD12 LEU 132 HD12 LEU 132 9.777 -0.999 18.074 999 HD13 LEU 132 HD13 LEU 132 10.558 -0.190 19.450 1000 HD21 LEU 132 HD23 LEU 132 13.239 1.448 17.401 1001 HD22 LEU 132 HD21 LEU 132 11.674 2.163 17.801 1002 HD23 LEU 132 HD22 LEU 132 12.579 1.275 19.043 1003 H THR 133 H THR 133 14.141 -3.909 16.418 1004 HA THR 133 HA THR 133 16.439 -3.939 18.278 1005 HB THR 133 HB THR 133 16.035 -6.392 18.307 1006 HG1 THR 133 HG1 THR 133 13.617 -5.803 16.980 1007 HG21 THR 133 HG23 THR 133 13.904 -6.349 19.575 1008 HG22 THR 133 HG21 THR 133 15.002 -5.039 20.057 1009 HG23 THR 133 HG22 THR 133 13.599 -4.694 19.025 1010 H ALA 134 H ALA 134 16.190 -3.375 15.052 1011 HA ALA 134 HA ALA 134 17.818 -5.284 13.776 1012 HB1 ALA 134 HB3 ALA 134 16.614 -3.723 12.459 1013 HB2 ALA 134 HB1 ALA 134 17.449 -2.344 13.225 1014 HB3 ALA 134 HB2 ALA 134 18.352 -3.437 12.197 1015 H SER 135 H SER 135 19.756 -5.930 14.276 1016 HA SER 135 HA SER 135 21.592 -4.575 15.955 1017 HB2 SER 135 HB2 SER 135 22.293 -6.775 13.986 1018 HB3 SER 135 HB3 SER 135 22.913 -6.533 15.623 1019 HG SER 135 HG SER 135 20.964 -7.274 16.439 1020 H SER 136 H SER 136 21.070 -4.655 12.473 1021 HA SER 136 HA SER 136 23.380 -2.867 11.946 1022 HB2 SER 136 HB2 SER 136 22.779 -5.501 10.521 1023 HB3 SER 136 HB3 SER 136 24.092 -4.377 10.135 1024 HG SER 136 HG SER 136 24.796 -6.143 11.412 1025 H GLU 137 H GLU 137 23.286 -2.022 9.719 1026 HA GLU 137 HA GLU 137 20.873 -0.812 9.019 1027 HB2 GLU 137 HB2 GLU 137 23.195 -0.109 8.399 1028 HB3 GLU 137 HB3 GLU 137 23.336 -1.514 7.337 1029 HG2 GLU 137 HG2 GLU 137 21.369 -0.458 6.025 1030 HG3 GLU 137 HG3 GLU 137 21.681 0.986 7.017 1031 H LYS 138 H LYS 138 22.311 -3.874 7.850 1032 HA LYS 138 HA LYS 138 20.669 -4.358 5.662 1033 HB2 LYS 138 HB2 LYS 138 22.746 -5.562 6.269 1034 HB3 LYS 138 HB3 LYS 138 21.896 -6.427 7.545 1035 HG2 LYS 138 HG2 LYS 138 20.884 -6.559 4.683 1036 HG3 LYS 138 HG3 LYS 138 22.321 -7.468 5.146 1037 HD2 LYS 138 HD2 LYS 138 21.067 -8.688 6.882 1038 HD3 LYS 138 HD3 LYS 138 19.614 -7.765 6.512 1039 HE2 LYS 138 HE2 LYS 138 19.385 -9.872 5.436 1040 HE3 LYS 138 HE3 LYS 138 19.626 -8.651 4.186 1041 HZ1 LYS 138 HZ3 LYS 138 20.940 -10.643 3.787 1042 HZ2 LYS 138 HZ1 LYS 138 21.942 -9.383 4.023 1043 HZ3 LYS 138 HZ2 LYS 138 21.719 -10.493 5.206 1044 H GLN 139 H GLN 139 19.907 -5.055 9.081 1045 HA GLN 139 HA GLN 139 17.602 -6.662 8.556 1046 HB2 GLN 139 HB2 GLN 139 18.667 -5.067 10.859 1047 HB3 GLN 139 HB3 GLN 139 16.977 -5.551 10.932 1048 HG2 GLN 139 HG2 GLN 139 17.415 -7.670 11.365 1049 HG3 GLN 139 HG3 GLN 139 18.741 -7.796 10.198 1050 HE21 GLN 139 HE22 GLN 139 18.263 -8.327 13.380 1051 HE22 GLN 139 HE21 GLN 139 19.822 -7.827 14.005 1052 H LEU 140 H LEU 140 18.021 -3.105 8.903 1053 HA LEU 140 HA LEU 140 15.199 -2.508 8.939 1054 HB2 LEU 140 HB2 LEU 140 17.700 -0.906 8.291 1055 HB3 LEU 140 HB3 LEU 140 16.108 -0.189 8.296 1056 HG LEU 140 HG LEU 140 16.701 -1.711 10.760 1057 HD11 LEU 140 HD11 LEU 140 18.240 -0.141 11.764 1058 HD12 LEU 140 HD12 LEU 140 18.962 -0.942 10.374 1059 HD13 LEU 140 HD13 LEU 140 18.387 0.742 10.220 1060 HD21 LEU 140 HD23 LEU 140 15.715 0.088 11.910 1061 HD22 LEU 140 HD21 LEU 140 15.885 1.188 10.518 1062 HD23 LEU 140 HD22 LEU 140 14.762 -0.186 10.463 1063 H ALA 141 H ALA 141 17.685 -2.361 6.370 1064 HA ALA 141 HA ALA 141 16.023 -1.960 4.172 1065 HB1 ALA 141 HB3 ALA 141 18.620 -1.957 4.358 1066 HB2 ALA 141 HB1 ALA 141 18.517 -3.701 4.105 1067 HB3 ALA 141 HB2 ALA 141 17.902 -2.592 2.857 1068 H ASP 142 H ASP 142 16.603 -5.049 5.850 1069 HA ASP 142 HA ASP 142 15.505 -6.638 3.705 1070 HB2 ASP 142 HB2 ASP 142 17.143 -7.596 5.228 1071 HB3 ASP 142 HB3 ASP 142 16.095 -7.286 6.615 1072 H ILE 143 H ILE 143 14.268 -5.266 6.785 1073 HA ILE 143 HA ILE 143 11.747 -6.610 6.723 1074 HB ILE 143 HB ILE 143 12.914 -4.191 8.138 1075 HG12 ILE 143 HG12 ILE 143 12.021 -6.872 9.315 1076 HG13 ILE 143 HG13 ILE 143 13.644 -6.646 8.673 1077 HG21 ILE 143 HG21 ILE 143 10.547 -3.762 8.025 1078 HG22 ILE 143 HG22 ILE 143 10.168 -5.432 8.518 1079 HG23 ILE 143 HG23 ILE 143 10.944 -4.309 9.656 1080 HD11 ILE 143 HD13 ILE 143 13.953 -4.707 10.282 1081 HD12 ILE 143 HD11 ILE 143 12.425 -5.205 11.053 1082 HD13 ILE 143 HD12 ILE 143 13.815 -6.309 11.011 1083 H ILE 144 H ILE 144 12.978 -3.582 5.367 1084 HA ILE 144 HA ILE 144 10.681 -2.392 4.308 1085 HB ILE 144 HB ILE 144 13.545 -2.662 3.545 1086 HG12 ILE 144 HG12 ILE 144 12.510 -1.012 5.238 1087 HG13 ILE 144 HG13 ILE 144 13.813 -0.527 4.164 1088 HG21 ILE 144 HG21 ILE 144 13.337 -1.148 1.619 1089 HG22 ILE 144 HG22 ILE 144 12.758 -2.777 1.319 1090 HG23 ILE 144 HG23 ILE 144 11.588 -1.466 1.589 1091 HD11 ILE 144 HD13 ILE 144 12.309 0.677 2.711 1092 HD12 ILE 144 HD11 ILE 144 10.896 0.070 3.592 1093 HD13 ILE 144 HD12 ILE 144 12.031 1.190 4.384 1094 H SER 145 H SER 145 12.499 -5.170 2.946 1095 HA SER 145 HA SER 145 11.148 -5.177 0.475 1096 HB2 SER 145 HB2 SER 145 12.543 -7.507 1.862 1097 HB3 SER 145 HB3 SER 145 12.257 -7.316 0.124 1098 HG SER 145 HG SER 145 14.370 -6.681 0.713 1099 H ARG 146 H ARG 146 10.050 -6.481 3.607 1100 HA ARG 146 HA ARG 146 8.303 -8.446 2.868 1101 HB2 ARG 146 HB2 ARG 146 9.056 -7.323 5.161 1102 HB3 ARG 146 HB3 ARG 146 7.680 -6.241 4.875 1103 HG2 ARG 146 HG2 ARG 146 6.403 -8.521 4.472 1104 HG3 ARG 146 HG3 ARG 146 7.849 -9.205 5.230 1105 HD2 ARG 146 HD2 ARG 146 6.022 -8.885 6.901 1106 HD3 ARG 146 HD3 ARG 146 7.423 -7.877 7.267 1107 HE ARG 146 HE ARG 146 6.164 -6.003 6.998 1108 HH11 ARG 146 HH11 ARG 146 4.366 -8.607 5.370 1109 HH12 ARG 146 HH12 ARG 146 2.968 -7.631 5.091 1110 HH21 ARG 146 HH21 ARG 146 4.256 -4.753 6.708 1111 HH22 ARG 146 HH22 ARG 146 2.964 -5.364 5.729 1112 H GLY 147 H GLY 147 8.011 -4.950 2.435 1113 HA2 GLY 147 HA2 GLY 147 5.105 -5.137 1.835 1114 HA3 GLY 147 HA3 GLY 147 6.040 -3.682 2.185 Start of MODEL 11 1 H MET 1 H1 MET 1 1.706 -1.924 -0.472 2 HA MET 1 HA MET 1 2.456 -2.880 -3.148 3 HB2 MET 1 HB2 MET 1 3.010 -0.588 -3.739 4 HB3 MET 1 HB3 MET 1 1.286 -0.687 -3.365 5 HG2 MET 1 HG2 MET 1 3.458 0.327 -1.481 6 HG3 MET 1 HG3 MET 1 2.489 1.354 -2.517 7 HE1 MET 1 HE3 MET 1 0.365 2.504 -1.823 8 HE2 MET 1 HE1 MET 1 -0.397 0.987 -2.360 9 HE3 MET 1 HE2 MET 1 -0.880 1.732 -0.820 10 H ARG 2 H ARG 2 4.614 -2.419 -3.818 11 HA ARG 2 HA ARG 2 6.285 -3.423 -1.756 12 HB2 ARG 2 HB2 ARG 2 6.862 -2.508 -4.607 13 HB3 ARG 2 HB3 ARG 2 8.133 -3.125 -3.555 14 HG2 ARG 2 HG2 ARG 2 5.588 -4.646 -4.247 15 HG3 ARG 2 HG3 ARG 2 7.130 -4.871 -5.072 16 HD2 ARG 2 HD2 ARG 2 6.751 -5.298 -2.077 17 HD3 ARG 2 HD3 ARG 2 6.521 -6.553 -3.272 18 HE ARG 2 HE ARG 2 8.793 -6.570 -3.823 19 HH11 ARG 2 HH11 ARG 2 8.298 -4.548 -0.882 20 HH12 ARG 2 HH12 ARG 2 9.980 -4.169 -0.766 21 HH21 ARG 2 HH21 ARG 2 11.010 -6.109 -3.509 22 HH22 ARG 2 HH22 ARG 2 11.485 -4.980 -2.276 23 H LEU 3 H LEU 3 7.095 -2.401 -0.172 24 HA LEU 3 HA LEU 3 7.339 0.449 -0.013 25 HB2 LEU 3 HB2 LEU 3 8.680 -1.780 1.531 26 HB3 LEU 3 HB3 LEU 3 9.075 -0.076 1.762 27 HG LEU 3 HG LEU 3 7.447 -1.219 3.385 28 HD11 LEU 3 HD11 LEU 3 6.325 0.884 3.761 29 HD12 LEU 3 HD12 LEU 3 8.009 1.174 3.365 30 HD13 LEU 3 HD13 LEU 3 6.752 1.473 2.138 31 HD21 LEU 3 HD23 LEU 3 5.083 -1.079 2.897 32 HD22 LEU 3 HD21 LEU 3 5.406 -0.542 1.239 33 HD23 LEU 3 HD22 LEU 3 5.857 -2.168 1.746 34 H SER 4 H SER 4 9.656 -2.094 -1.093 35 HA SER 4 HA SER 4 11.944 -0.567 -1.258 36 HB2 SER 4 HB2 SER 4 10.982 -2.742 -3.159 37 HB3 SER 4 HB3 SER 4 12.669 -2.227 -2.953 38 HG SER 4 HG SER 4 12.730 -3.136 -1.023 39 H ASP 5 H ASP 5 9.050 -0.008 -3.155 40 HA ASP 5 HA ASP 5 10.273 1.250 -5.398 41 HB2 ASP 5 HB2 ASP 5 7.874 0.562 -5.267 42 HB3 ASP 5 HB3 ASP 5 7.593 1.830 -4.074 43 H TYR 6 H TYR 6 9.960 2.334 -2.070 44 HA TYR 6 HA TYR 6 10.289 5.169 -2.883 45 HB2 TYR 6 HB2 TYR 6 9.612 4.024 -0.161 46 HB3 TYR 6 HB3 TYR 6 9.545 5.710 -0.633 47 HD1 TYR 6 HD1 TYR 6 7.734 6.630 -1.932 48 HD2 TYR 6 HD2 TYR 6 7.788 2.467 -0.768 49 HE1 TYR 6 HE1 TYR 6 5.411 6.366 -2.763 50 HE2 TYR 6 HE2 TYR 6 5.473 2.201 -1.594 51 HH TYR 6 HH TYR 6 3.637 3.258 -2.603 52 H PHE 7 H PHE 7 12.325 2.637 -1.554 53 HA PHE 7 HA PHE 7 13.933 4.673 -0.058 54 HB2 PHE 7 HB2 PHE 7 13.919 1.674 0.284 55 HB3 PHE 7 HB3 PHE 7 14.902 2.815 1.183 56 HD1 PHE 7 HD2 PHE 7 11.366 2.054 0.371 57 HD2 PHE 7 HD1 PHE 7 14.045 3.487 3.402 58 HE1 PHE 7 HE2 PHE 7 9.438 2.413 1.869 59 HE2 PHE 7 HE1 PHE 7 12.096 3.924 4.871 60 HZ PHE 7 HZ PHE 7 9.804 3.406 4.125 61 HA PRO 8 HA PRO 8 16.155 4.175 -3.957 62 HB2 PRO 8 HB2 PRO 8 18.108 6.139 -3.594 63 HB3 PRO 8 HB3 PRO 8 16.452 6.384 -4.210 64 HG2 PRO 8 HG2 PRO 8 17.439 6.717 -1.363 65 HG3 PRO 8 HG3 PRO 8 16.402 7.833 -2.310 66 HD2 PRO 8 HD2 PRO 8 15.283 6.145 -0.570 67 HD3 PRO 8 HD3 PRO 8 14.549 6.351 -2.181 68 H GLU 9 H GLU 9 18.469 4.842 -1.311 69 HA GLU 9 HA GLU 9 19.755 2.280 -1.515 70 HB2 GLU 9 HB2 GLU 9 20.579 3.230 -3.634 71 HB3 GLU 9 HB3 GLU 9 21.050 4.716 -2.817 72 HG2 GLU 9 HG2 GLU 9 22.850 3.577 -1.648 73 HG3 GLU 9 HG3 GLU 9 22.265 1.995 -2.178 74 H SER 10 H SER 10 21.174 5.478 -0.881 75 HA SER 10 HA SER 10 22.227 4.735 1.632 76 HB2 SER 10 HB2 SER 10 21.564 7.576 0.789 77 HB3 SER 10 HB3 SER 10 22.946 7.013 1.740 78 HG SER 10 HG SER 10 23.762 6.038 -0.155 79 H SER 11 H SER 11 19.072 4.741 1.050 80 HA SER 11 HA SER 11 17.949 6.752 2.783 81 HB2 SER 11 HB2 SER 11 15.902 5.074 2.257 82 HB3 SER 11 HB3 SER 11 16.521 6.283 1.128 83 HG SER 11 HG SER 11 17.051 3.490 1.131 84 H ILE 12 H ILE 12 19.380 3.673 3.498 85 HA ILE 12 HA ILE 12 17.662 3.299 5.873 86 HB ILE 12 HB ILE 12 19.162 1.354 4.102 87 HG12 ILE 12 HG12 ILE 12 16.266 2.276 4.296 88 HG13 ILE 12 HG13 ILE 12 17.299 2.150 2.872 89 HG21 ILE 12 HG21 ILE 12 19.079 0.722 6.520 90 HG22 ILE 12 HG22 ILE 12 17.316 0.914 6.489 91 HG23 ILE 12 HG23 ILE 12 18.122 -0.360 5.529 92 HD11 ILE 12 HD13 ILE 12 16.006 -0.081 4.410 93 HD12 ILE 12 HD11 ILE 12 15.673 0.444 2.744 94 HD13 ILE 12 HD12 ILE 12 17.225 -0.334 3.117 95 H SER 13 H SER 13 18.818 3.494 7.836 96 HA SER 13 HA SER 13 21.726 3.041 7.898 97 HB2 SER 13 HB2 SER 13 20.477 5.783 8.394 98 HB3 SER 13 HB3 SER 13 22.133 5.339 8.838 99 HG SER 13 HG SER 13 21.526 4.716 6.252 100 H VAL 14 H VAL 14 22.539 2.769 9.905 101 HA VAL 14 HA VAL 14 20.720 2.994 12.245 102 HB VAL 14 HB VAL 14 22.895 0.936 11.739 103 HG11 VAL 14 HG11 VAL 14 22.862 1.548 14.131 104 HG12 VAL 14 HG12 VAL 14 21.097 1.343 14.183 105 HG13 VAL 14 HG13 VAL 14 22.161 -0.056 13.917 106 HG21 VAL 14 HG23 VAL 14 20.816 0.382 10.545 107 HG22 VAL 14 HG21 VAL 14 21.019 -0.709 11.920 108 HG23 VAL 14 HG22 VAL 14 19.871 0.639 12.024 109 H ILE 15 H ILE 15 21.633 4.092 13.966 110 HA ILE 15 HA ILE 15 24.265 5.438 13.573 111 HB ILE 15 HB ILE 15 21.451 6.501 13.929 112 HG12 ILE 15 HG12 ILE 15 23.724 7.051 11.989 113 HG13 ILE 15 HG13 ILE 15 22.150 6.324 11.652 114 HG21 ILE 15 HG21 ILE 15 23.933 8.088 14.615 115 HG22 ILE 15 HG22 ILE 15 22.282 8.742 14.457 116 HG23 ILE 15 HG23 ILE 15 22.587 7.574 15.688 117 HD11 ILE 15 HD13 ILE 15 21.090 8.551 12.274 118 HD12 ILE 15 HD11 ILE 15 22.733 9.232 12.339 119 HD13 ILE 15 HD12 ILE 15 22.110 8.570 10.815 120 H HIS 16 H HIS 16 25.360 5.904 15.507 121 HA HIS 16 HA HIS 16 24.683 4.314 17.806 122 HB2 HIS 16 HB2 HIS 16 26.593 5.570 18.859 123 HB3 HIS 16 HB3 HIS 16 26.969 4.715 17.369 124 HD1 HIS 16 HD1 HIS 16 26.155 8.424 18.361 125 HD2 HIS 16 HD2 HIS 16 28.261 6.058 15.572 126 HE1 HIS 16 HE1 HIS 16 27.441 10.035 16.878 127 H SER 17 H SER 17 24.133 7.724 16.951 128 HA SER 17 HA SER 17 22.014 8.180 18.736 129 HB2 SER 17 HB2 SER 17 23.315 9.978 20.106 130 HB3 SER 17 HB3 SER 17 23.383 8.303 20.636 131 HG SER 17 HG SER 17 25.436 9.425 20.583 132 H ALA 18 H ALA 18 21.175 10.347 18.208 133 HA ALA 18 HA ALA 18 22.410 11.582 15.820 134 HB1 ALA 18 HB3 ALA 18 19.950 12.328 17.465 135 HB2 ALA 18 HB1 ALA 18 20.541 13.210 16.043 136 HB3 ALA 18 HB2 ALA 18 19.989 11.550 15.854 137 H LYS 19 H LYS 19 23.231 13.732 15.905 138 HA LYS 19 HA LYS 19 24.832 14.461 18.118 139 HB2 LYS 19 HB2 LYS 19 24.711 15.206 15.548 140 HB3 LYS 19 HB3 LYS 19 23.706 16.487 16.180 141 HG2 LYS 19 HG2 LYS 19 25.827 17.429 16.064 142 HG3 LYS 19 HG3 LYS 19 25.595 17.089 17.778 143 HD2 LYS 19 HD2 LYS 19 27.876 16.545 17.019 144 HD3 LYS 19 HD3 LYS 19 27.039 15.106 17.592 145 HE2 LYS 19 HE2 LYS 19 28.318 14.637 15.555 146 HE3 LYS 19 HE3 LYS 19 26.583 14.388 15.307 147 HZ1 LYS 19 HZ3 LYS 19 27.770 15.569 13.488 148 HZ2 LYS 19 HZ1 LYS 19 26.440 16.337 14.019 149 HZ3 LYS 19 HZ2 LYS 19 27.950 16.865 14.459 150 H ASP 20 H ASP 20 21.603 15.495 17.099 151 HA ASP 20 HA ASP 20 20.532 15.810 19.711 152 HB2 ASP 20 HB2 ASP 20 20.028 18.033 19.820 153 HB3 ASP 20 HB3 ASP 20 21.741 18.092 19.384 154 H TRP 21 H TRP 21 18.266 16.786 19.343 155 HA TRP 21 HA TRP 21 16.790 15.263 17.595 156 HB2 TRP 21 HB2 TRP 21 15.133 17.344 18.206 157 HB3 TRP 21 HB3 TRP 21 15.467 15.960 19.241 158 HD1 TRP 21 HD1 TRP 21 16.443 19.605 18.790 159 HE1 TRP 21 HE1 TRP 21 17.437 20.565 20.936 160 HE3 TRP 21 HE3 TRP 21 16.934 15.264 21.370 161 HZ2 TRP 21 HZ2 TRP 21 18.450 19.522 23.457 162 HZ3 TRP 21 HZ3 TRP 21 18.055 15.235 23.589 163 HH2 TRP 21 HH2 TRP 21 18.800 17.357 24.644 164 H GLN 22 H GLN 22 18.133 18.575 16.953 165 HA GLN 22 HA GLN 22 16.683 18.972 14.470 166 HB2 GLN 22 HB2 GLN 22 19.385 20.020 15.361 167 HB3 GLN 22 HB3 GLN 22 18.521 20.525 13.919 168 HG2 GLN 22 HG2 GLN 22 16.751 21.516 15.142 169 HG3 GLN 22 HG3 GLN 22 17.211 20.735 16.655 170 HE21 GLN 22 HE22 GLN 22 19.428 21.246 17.509 171 HE22 GLN 22 HE21 GLN 22 19.963 22.929 17.403 172 H GLU 23 H GLU 23 19.974 17.623 15.265 173 HA GLU 23 HA GLU 23 20.612 16.805 12.645 174 HB2 GLU 23 HB2 GLU 23 22.055 16.863 14.820 175 HB3 GLU 23 HB3 GLU 23 21.391 15.245 15.111 176 HG2 GLU 23 HG2 GLU 23 23.280 14.637 13.982 177 HG3 GLU 23 HG3 GLU 23 22.240 14.819 12.600 178 H ALA 24 H ALA 24 18.620 15.217 15.109 179 HA ALA 24 HA ALA 24 18.569 12.645 13.892 180 HB1 ALA 24 HB3 ALA 24 17.977 13.287 16.239 181 HB2 ALA 24 HB1 ALA 24 16.420 13.899 15.646 182 HB3 ALA 24 HB2 ALA 24 16.817 12.175 15.466 183 H ILE 25 H ILE 25 16.511 15.553 13.420 184 HA ILE 25 HA ILE 25 14.785 14.317 11.438 185 HB ILE 25 HB ILE 25 15.606 17.235 11.618 186 HG12 ILE 25 HG12 ILE 25 14.148 15.803 13.614 187 HG13 ILE 25 HG13 ILE 25 14.570 17.508 13.530 188 HG21 ILE 25 HG21 ILE 25 13.180 15.910 10.343 189 HG22 ILE 25 HG22 ILE 25 13.528 17.655 10.381 190 HG23 ILE 25 HG23 ILE 25 14.576 16.591 9.494 191 HD11 ILE 25 HD13 ILE 25 12.057 16.206 12.447 192 HD12 ILE 25 HD11 ILE 25 12.198 17.200 13.904 193 HD13 ILE 25 HD12 ILE 25 12.445 17.942 12.313 194 H ASP 26 H ASP 26 17.845 16.193 11.385 195 HA ASP 26 HA ASP 26 18.123 16.410 8.613 196 HB2 ASP 26 HB2 ASP 26 19.526 17.392 10.622 197 HB3 ASP 26 HB3 ASP 26 20.566 15.994 10.344 198 H PHE 27 H PHE 27 19.306 13.780 10.758 199 HA PHE 27 HA PHE 27 20.268 12.129 8.632 200 HB2 PHE 27 HB2 PHE 27 19.657 11.712 11.568 201 HB3 PHE 27 HB3 PHE 27 20.007 10.342 10.533 202 HD1 PHE 27 HD1 PHE 27 22.109 10.753 8.859 203 HD2 PHE 27 HD2 PHE 27 21.626 12.504 12.795 204 HE1 PHE 27 HE1 PHE 27 24.563 10.980 9.071 205 HE2 PHE 27 HE2 PHE 27 24.078 12.665 12.998 206 HZ PHE 27 HZ PHE 27 25.556 11.928 11.147 207 H SER 28 H SER 28 16.983 12.566 9.982 208 HA SER 28 HA SER 28 15.880 10.176 8.774 209 HB2 SER 28 HB2 SER 28 14.424 12.806 9.397 210 HB3 SER 28 HB3 SER 28 13.698 11.245 9.105 211 HG SER 28 HG SER 28 15.492 11.856 11.250 212 H MET 29 H MET 29 16.949 13.267 7.514 213 HA MET 29 HA MET 29 15.436 12.784 4.980 214 HB2 MET 29 HB2 MET 29 16.525 15.343 6.138 215 HB3 MET 29 HB3 MET 29 15.411 15.141 4.767 216 HG2 MET 29 HG2 MET 29 14.492 14.315 7.498 217 HG3 MET 29 HG3 MET 29 14.593 16.010 7.070 218 HE1 MET 29 HE3 MET 29 11.617 12.981 5.602 219 HE2 MET 29 HE1 MET 29 13.378 12.689 5.409 220 HE3 MET 29 HE2 MET 29 12.677 12.937 7.038 221 H VAL 30 H VAL 30 18.776 13.300 6.141 222 HA VAL 30 HA VAL 30 19.764 14.598 3.941 223 HB VAL 30 HB VAL 30 20.988 14.279 6.034 224 HG11 VAL 30 HG11 VAL 30 21.698 11.479 5.051 225 HG12 VAL 30 HG12 VAL 30 22.269 12.278 6.529 226 HG13 VAL 30 HG13 VAL 30 20.564 11.824 6.371 227 HG21 VAL 30 HG23 VAL 30 23.223 14.140 5.071 228 HG22 VAL 30 HG21 VAL 30 22.586 13.358 3.607 229 HG23 VAL 30 HG22 VAL 30 22.147 15.032 3.977 230 H SER 31 H SER 31 19.287 11.024 4.163 231 HA SER 31 HA SER 31 20.694 10.418 1.814 232 HB2 SER 31 HB2 SER 31 18.178 9.041 2.849 233 HB3 SER 31 HB3 SER 31 19.510 8.324 1.919 234 HG SER 31 HG SER 31 20.207 7.841 3.844 235 H LEU 32 H LEU 32 17.466 11.780 2.256 236 HA LEU 32 HA LEU 32 16.691 11.457 -0.562 237 HB2 LEU 32 HB2 LEU 32 15.461 12.914 1.827 238 HB3 LEU 32 HB3 LEU 32 14.757 12.972 0.238 239 HG LEU 32 HG LEU 32 15.242 10.393 1.780 240 HD11 LEU 32 HD11 LEU 32 13.605 11.820 2.938 241 HD12 LEU 32 HD12 LEU 32 12.664 11.979 1.440 242 HD13 LEU 32 HD13 LEU 32 12.827 10.398 2.234 243 HD21 LEU 32 HD23 LEU 32 13.755 9.349 0.174 244 HD22 LEU 32 HD21 LEU 32 13.526 10.884 -0.692 245 HD23 LEU 32 HD22 LEU 32 15.102 10.053 -0.690 246 H LEU 33 H LEU 33 17.882 14.014 1.673 247 HA LEU 33 HA LEU 33 17.814 16.171 -0.074 248 HB2 LEU 33 HB2 LEU 33 18.384 16.158 2.398 249 HB3 LEU 33 HB3 LEU 33 19.987 15.584 1.960 250 HG LEU 33 HG LEU 33 20.341 17.676 0.621 251 HD11 LEU 33 HD11 LEU 33 17.733 18.575 1.911 252 HD12 LEU 33 HD12 LEU 33 18.869 19.596 1.001 253 HD13 LEU 33 HD13 LEU 33 18.014 18.319 0.173 254 HD21 LEU 33 HD23 LEU 33 21.203 17.368 2.898 255 HD22 LEU 33 HD21 LEU 33 20.831 19.049 2.536 256 HD23 LEU 33 HD22 LEU 33 19.727 18.096 3.555 257 H ASP 34 H ASP 34 20.326 13.693 0.371 258 HA ASP 34 HA ASP 34 22.342 14.868 -1.173 259 HB2 ASP 34 HB2 ASP 34 22.722 13.140 0.528 260 HB3 ASP 34 HB3 ASP 34 21.820 11.958 -0.416 261 H LYS 35 H LYS 35 19.656 12.824 -2.230 262 HA LYS 35 HA LYS 35 20.776 12.898 -5.009 263 HB2 LYS 35 HB2 LYS 35 18.230 11.509 -4.474 264 HB3 LYS 35 HB3 LYS 35 19.486 11.122 -5.624 265 HG2 LYS 35 HG2 LYS 35 19.419 10.519 -2.655 266 HG3 LYS 35 HG3 LYS 35 19.221 9.367 -3.965 267 HD2 LYS 35 HD2 LYS 35 21.543 9.562 -4.625 268 HD3 LYS 35 HD3 LYS 35 21.808 10.879 -3.459 269 HE2 LYS 35 HE2 LYS 35 20.991 9.318 -1.639 270 HE3 LYS 35 HE3 LYS 35 21.022 7.999 -2.815 271 HZ1 LYS 35 HZ3 LYS 35 23.363 9.640 -2.015 272 HZ2 LYS 35 HZ1 LYS 35 23.069 8.088 -1.525 273 HZ3 LYS 35 HZ2 LYS 35 23.408 8.399 -3.095 274 H ASN 36 H ASN 36 19.455 15.116 -3.295 275 HA ASN 36 HA ASN 36 17.863 16.603 -3.307 276 HB2 ASN 36 HB2 ASN 36 17.482 17.951 -5.330 277 HB3 ASN 36 HB3 ASN 36 19.130 17.761 -4.784 278 HD21 ASN 36 HD22 ASN 36 20.519 16.280 -5.910 279 HD22 ASN 36 HD21 ASN 36 20.290 15.991 -7.627 280 H TYR 37 H TYR 37 16.610 14.274 -2.932 281 HA TYR 37 HA TYR 37 14.115 14.189 -4.496 282 HB2 TYR 37 HB2 TYR 37 15.053 12.992 -1.864 283 HB3 TYR 37 HB3 TYR 37 13.372 12.940 -2.318 284 HD1 TYR 37 HD2 TYR 37 12.538 11.479 -4.022 285 HD2 TYR 37 HD1 TYR 37 16.700 11.428 -2.910 286 HE1 TYR 37 HE2 TYR 37 12.874 9.462 -5.419 287 HE2 TYR 37 HE1 TYR 37 17.019 9.378 -4.260 288 HH TYR 37 HH TYR 37 16.070 7.891 -5.791 289 H ILE 38 H ILE 38 15.497 16.137 -2.018 290 HA ILE 38 HA ILE 38 13.020 17.694 -1.633 291 HB ILE 38 HB ILE 38 13.569 17.834 0.816 292 HG12 ILE 38 HG12 ILE 38 15.450 15.502 0.244 293 HG13 ILE 38 HG13 ILE 38 15.944 17.157 0.631 294 HG21 ILE 38 HG21 ILE 38 12.582 15.741 1.527 295 HG22 ILE 38 HG22 ILE 38 11.766 16.320 0.086 296 HG23 ILE 38 HG23 ILE 38 12.950 14.988 -0.030 297 HD11 ILE 38 HD13 ILE 38 14.526 15.225 2.475 298 HD12 ILE 38 HD11 ILE 38 16.185 15.819 2.539 299 HD13 ILE 38 HD12 ILE 38 14.833 16.950 2.830 300 H SER 39 H SER 39 13.646 19.735 -0.422 301 HA SER 39 HA SER 39 16.335 20.787 -1.178 302 HB2 SER 39 HB2 SER 39 13.870 22.368 -0.376 303 HB3 SER 39 HB3 SER 39 15.299 22.940 -1.251 304 HG SER 39 HG SER 39 13.261 21.166 -2.163 305 H GLU 40 H GLU 40 17.364 22.163 0.577 306 HA GLU 40 HA GLU 40 17.308 20.889 3.097 307 HB2 GLU 40 HB2 GLU 40 18.308 23.663 2.327 308 HB3 GLU 40 HB3 GLU 40 18.639 22.863 3.870 309 HG2 GLU 40 HG2 GLU 40 19.751 20.991 2.658 310 HG3 GLU 40 HG3 GLU 40 19.475 21.811 1.128 311 H ASN 41 H ASN 41 15.490 23.737 1.971 312 HA ASN 41 HA ASN 41 14.432 24.509 4.497 313 HB2 ASN 41 HB2 ASN 41 12.580 25.565 3.124 314 HB3 ASN 41 HB3 ASN 41 14.222 26.078 2.777 315 HD21 ASN 41 HD22 ASN 41 11.495 24.040 1.463 316 HD22 ASN 41 HD21 ASN 41 12.107 24.147 -0.166 317 H TYR 42 H TYR 42 13.553 21.739 2.483 318 HA TYR 42 HA TYR 42 10.919 21.299 3.594 319 HB2 TYR 42 HB2 TYR 42 11.807 20.222 1.519 320 HB3 TYR 42 HB3 TYR 42 12.986 19.358 2.492 321 HD1 TYR 42 HD1 TYR 42 9.392 19.590 1.661 322 HD2 TYR 42 HD2 TYR 42 12.456 17.399 3.765 323 HE1 TYR 42 HE1 TYR 42 7.862 17.641 1.871 324 HE2 TYR 42 HE2 TYR 42 10.939 15.452 3.947 325 HH TYR 42 HH TYR 42 8.915 14.531 3.297 326 H ILE 43 H ILE 43 14.217 20.206 4.409 327 HA ILE 43 HA ILE 43 13.640 18.558 6.610 328 HB ILE 43 HB ILE 43 16.130 20.193 6.094 329 HG12 ILE 43 HG12 ILE 43 15.122 17.492 5.113 330 HG13 ILE 43 HG13 ILE 43 15.521 18.900 4.121 331 HG21 ILE 43 HG21 ILE 43 15.817 17.611 7.669 332 HG22 ILE 43 HG22 ILE 43 17.267 18.617 7.492 333 HG23 ILE 43 HG23 ILE 43 15.878 19.215 8.405 334 HD11 ILE 43 HD13 ILE 43 17.859 18.715 4.725 335 HD12 ILE 43 HD11 ILE 43 17.494 17.245 5.668 336 HD13 ILE 43 HD12 ILE 43 17.206 17.259 3.918 337 H GLN 44 H GLN 44 14.568 22.063 6.472 338 HA GLN 44 HA GLN 44 14.373 22.325 9.290 339 HB2 GLN 44 HB2 GLN 44 15.677 23.788 7.542 340 HB3 GLN 44 HB3 GLN 44 14.184 24.722 7.471 341 HG2 GLN 44 HG2 GLN 44 15.703 25.733 9.092 342 HG3 GLN 44 HG3 GLN 44 14.321 25.075 9.954 343 HE21 GLN 44 HE22 GLN 44 15.074 24.274 11.952 344 HE22 GLN 44 HE21 GLN 44 16.457 23.228 12.133 345 H ALA 45 H ALA 45 11.855 22.588 6.825 346 HA ALA 45 HA ALA 45 9.910 23.947 8.347 347 HB1 ALA 45 HB3 ALA 45 9.627 23.246 5.947 348 HB2 ALA 45 HB1 ALA 45 9.393 21.564 6.502 349 HB3 ALA 45 HB2 ALA 45 8.248 22.812 6.979 350 H ILE 46 H ILE 46 10.939 20.491 8.446 351 HA ILE 46 HA ILE 46 8.861 19.695 10.286 352 HB ILE 46 HB ILE 46 11.563 18.369 9.868 353 HG12 ILE 46 HG12 ILE 46 9.132 17.642 8.239 354 HG13 ILE 46 HG13 ILE 46 10.342 18.751 7.632 355 HG21 ILE 46 HG21 ILE 46 10.155 17.603 11.775 356 HG22 ILE 46 HG22 ILE 46 8.821 17.269 10.651 357 HG23 ILE 46 HG23 ILE 46 10.327 16.341 10.553 358 HD11 ILE 46 HD13 ILE 46 12.105 17.100 7.787 359 HD12 ILE 46 HD11 ILE 46 10.998 15.893 8.449 360 HD13 ILE 46 HD12 ILE 46 10.759 16.495 6.805 361 H LYS 47 H LYS 47 12.366 20.529 10.547 362 HA LYS 47 HA LYS 47 12.581 20.022 13.305 363 HB2 LYS 47 HB2 LYS 47 14.036 22.013 11.523 364 HB3 LYS 47 HB3 LYS 47 14.544 21.678 13.177 365 HG2 LYS 47 HG2 LYS 47 15.232 19.449 12.638 366 HG3 LYS 47 HG3 LYS 47 14.453 19.517 11.040 367 HD2 LYS 47 HD2 LYS 47 15.955 21.234 10.304 368 HD3 LYS 47 HD3 LYS 47 16.738 21.324 11.899 369 HE2 LYS 47 HE2 LYS 47 17.762 19.176 11.589 370 HE3 LYS 47 HE3 LYS 47 16.832 18.860 10.128 371 HZ1 LYS 47 HZ3 LYS 47 18.999 19.600 9.459 372 HZ2 LYS 47 HZ1 LYS 47 18.013 20.869 9.171 373 HZ3 LYS 47 HZ2 LYS 47 18.976 20.882 10.482 374 H ASP 48 H ASP 48 11.661 23.059 11.586 375 HA ASP 48 HA ASP 48 11.655 24.776 13.805 376 HB2 ASP 48 HB2 ASP 48 11.542 25.585 11.519 377 HB3 ASP 48 HB3 ASP 48 9.973 24.809 11.274 378 H SER 49 H SER 49 8.856 22.877 12.457 379 HA SER 49 HA SER 49 6.998 23.664 14.462 380 HB2 SER 49 HB2 SER 49 7.149 21.060 12.887 381 HB3 SER 49 HB3 SER 49 5.715 21.744 13.679 382 HG SER 49 HG SER 49 5.807 22.212 11.425 383 H THR 50 H THR 50 9.274 20.889 14.289 384 HA THR 50 HA THR 50 8.537 19.642 16.677 385 HB THR 50 HB THR 50 11.261 19.716 15.335 386 HG1 THR 50 HG1 THR 50 9.782 19.043 13.864 387 HG21 THR 50 HG23 THR 50 11.441 18.667 17.524 388 HG22 THR 50 HG21 THR 50 9.976 17.709 17.226 389 HG23 THR 50 HG22 THR 50 11.443 17.412 16.271 390 H ILE 51 H ILE 51 10.920 22.301 16.164 391 HA ILE 51 HA ILE 51 11.742 22.468 18.915 392 HB ILE 51 HB ILE 51 11.879 24.340 16.520 393 HG12 ILE 51 HG12 ILE 51 14.159 22.922 17.974 394 HG13 ILE 51 HG13 ILE 51 13.277 22.149 16.668 395 HG21 ILE 51 HG21 ILE 51 13.492 25.746 17.800 396 HG22 ILE 51 HG22 ILE 51 11.881 25.805 18.484 397 HG23 ILE 51 HG23 ILE 51 13.130 24.806 19.264 398 HD11 ILE 51 HD13 ILE 51 13.874 24.049 15.144 399 HD12 ILE 51 HD11 ILE 51 14.910 24.706 16.434 400 HD13 ILE 51 HD12 ILE 51 15.259 23.122 15.739 401 H ASN 52 H ASN 52 9.183 24.078 16.987 402 HA ASN 52 HA ASN 52 8.627 26.187 18.757 403 HB2 ASN 52 HB2 ASN 52 7.212 24.860 16.471 404 HB3 ASN 52 HB3 ASN 52 6.160 25.688 17.581 405 HD21 ASN 52 HD22 ASN 52 9.039 26.166 15.520 406 HD22 ASN 52 HD21 ASN 52 8.841 27.893 15.333 407 H ASN 53 H ASN 53 7.423 22.880 18.778 408 HA ASN 53 HA ASN 53 5.880 23.364 21.290 409 HB2 ASN 53 HB2 ASN 53 4.243 23.899 19.682 410 HB3 ASN 53 HB3 ASN 53 4.871 22.750 18.511 411 HD21 ASN 53 HD22 ASN 53 3.103 21.620 18.057 412 HD22 ASN 53 HD21 ASN 53 2.217 20.631 19.209 413 H GLY 54 H GLY 54 6.555 20.909 18.703 414 HA2 GLY 54 HA2 GLY 54 8.139 19.164 20.049 415 HA3 GLY 54 HA3 GLY 54 6.501 18.680 20.544 416 HA PRO 55 HA PRO 55 7.711 16.855 16.276 417 HB2 PRO 55 HB2 PRO 55 6.698 14.485 17.863 418 HB3 PRO 55 HB3 PRO 55 7.909 14.504 16.537 419 HG2 PRO 55 HG2 PRO 55 8.722 14.374 19.103 420 HG3 PRO 55 HG3 PRO 55 9.536 15.493 17.964 421 HD2 PRO 55 HD2 PRO 55 7.432 16.146 20.049 422 HD3 PRO 55 HD3 PRO 55 8.928 17.039 19.632 423 H TYR 56 H TYR 56 6.236 16.263 14.709 424 HA TYR 56 HA TYR 56 3.317 16.271 15.420 425 HB2 TYR 56 HB2 TYR 56 4.811 17.456 13.058 426 HB3 TYR 56 HB3 TYR 56 3.094 17.123 12.991 427 HD1 TYR 56 HD2 TYR 56 5.630 19.011 15.000 428 HD2 TYR 56 HD1 TYR 56 1.504 18.666 13.796 429 HE1 TYR 56 HE2 TYR 56 5.114 21.145 16.153 430 HE2 TYR 56 HE1 TYR 56 0.991 20.823 14.894 431 HH TYR 56 HH TYR 56 1.849 22.628 16.117 432 H TYR 57 H TYR 57 5.660 14.131 14.707 433 HA TYR 57 HA TYR 57 3.991 12.421 12.944 434 HB2 TYR 57 HB2 TYR 57 6.867 13.221 12.455 435 HB3 TYR 57 HB3 TYR 57 6.006 11.906 11.659 436 HD1 TYR 57 HD2 TYR 57 4.172 12.307 10.084 437 HD2 TYR 57 HD1 TYR 57 6.354 15.574 11.868 438 HE1 TYR 57 HE2 TYR 57 3.116 13.878 8.481 439 HE2 TYR 57 HE1 TYR 57 5.326 17.148 10.255 440 HH TYR 57 HH TYR 57 2.956 16.090 7.765 441 H ILE 58 H ILE 58 3.667 11.554 15.270 442 HA ILE 58 HA ILE 58 5.831 9.605 15.934 443 HB ILE 58 HB ILE 58 3.911 10.901 17.899 444 HG12 ILE 58 HG12 ILE 58 5.536 12.575 17.340 445 HG13 ILE 58 HG13 ILE 58 5.842 11.960 18.951 446 HG21 ILE 58 HG21 ILE 58 6.149 8.867 18.315 447 HG22 ILE 58 HG22 ILE 58 5.317 9.737 19.622 448 HG23 ILE 58 HG23 ILE 58 4.418 8.632 18.586 449 HD11 ILE 58 HD13 ILE 58 7.475 11.518 16.445 450 HD12 ILE 58 HD11 ILE 58 7.985 12.201 17.993 451 HD13 ILE 58 HD12 ILE 58 7.671 10.468 17.857 452 H LEU 59 H LEU 59 5.095 7.501 16.101 453 HA LEU 59 HA LEU 59 2.236 7.065 15.315 454 HB2 LEU 59 HB2 LEU 59 4.752 5.605 14.389 455 HB3 LEU 59 HB3 LEU 59 3.112 5.111 14.037 456 HG LEU 59 HG LEU 59 3.856 6.103 12.099 457 HD11 LEU 59 HD11 LEU 59 2.253 8.335 13.379 458 HD12 LEU 59 HD12 LEU 59 2.363 7.919 11.662 459 HD13 LEU 59 HD13 LEU 59 1.573 6.803 12.781 460 HD21 LEU 59 HD23 LEU 59 5.850 7.286 12.852 461 HD22 LEU 59 HD21 LEU 59 4.812 8.347 11.892 462 HD23 LEU 59 HD22 LEU 59 4.864 8.548 13.613 463 H ALA 60 H ALA 60 4.951 5.903 17.290 464 HA ALA 60 HA ALA 60 3.208 4.275 18.919 465 HB1 ALA 60 HB3 ALA 60 3.601 2.714 17.000 466 HB2 ALA 60 HB1 ALA 60 5.353 2.925 17.187 467 HB3 ALA 60 HB2 ALA 60 4.412 2.133 18.457 468 HA PRO 61 HA PRO 61 6.422 5.154 21.920 469 HB2 PRO 61 HB2 PRO 61 6.646 2.145 22.272 470 HB3 PRO 61 HB3 PRO 61 6.641 3.419 23.527 471 HG2 PRO 61 HG2 PRO 61 4.377 2.051 23.011 472 HG3 PRO 61 HG3 PRO 61 4.299 3.836 23.187 473 HD2 PRO 61 HD2 PRO 61 4.343 2.191 20.656 474 HD3 PRO 61 HD3 PRO 61 3.335 3.615 21.058 475 H GLY 62 H GLY 62 8.264 5.943 21.067 476 HA2 GLY 62 HA2 GLY 62 10.505 5.865 20.578 477 HA3 GLY 62 HA3 GLY 62 10.428 4.121 20.360 478 H VAL 63 H VAL 63 7.984 5.603 18.420 479 HA VAL 63 HA VAL 63 9.757 5.375 16.024 480 HB VAL 63 HB VAL 63 6.918 4.369 16.437 481 HG11 VAL 63 HG11 VAL 63 8.744 4.058 14.019 482 HG12 VAL 63 HG12 VAL 63 7.150 3.291 14.219 483 HG13 VAL 63 HG13 VAL 63 7.274 5.047 14.091 484 HG21 VAL 63 HG23 VAL 63 9.518 2.799 16.119 485 HG22 VAL 63 HG21 VAL 63 8.557 2.927 17.607 486 HG23 VAL 63 HG22 VAL 63 7.880 2.111 16.213 487 H ALA 64 H ALA 64 9.787 7.128 14.815 488 HA ALA 64 HA ALA 64 7.468 8.971 14.747 489 HB1 ALA 64 HB3 ALA 64 10.411 9.766 14.627 490 HB2 ALA 64 HB1 ALA 64 9.020 10.869 14.603 491 HB3 ALA 64 HB2 ALA 64 9.374 9.942 16.065 492 H MET 65 H MET 65 7.641 10.399 12.743 493 HA MET 65 HA MET 65 8.863 9.010 10.453 494 HB2 MET 65 HB2 MET 65 6.617 8.154 10.722 495 HB3 MET 65 HB3 MET 65 5.970 9.799 10.567 496 HG2 MET 65 HG2 MET 65 7.447 9.572 8.260 497 HG3 MET 65 HG3 MET 65 7.017 7.889 8.538 498 HE1 MET 65 HE3 MET 65 3.831 8.751 10.040 499 HE2 MET 65 HE1 MET 65 3.086 8.041 8.592 500 HE3 MET 65 HE2 MET 65 4.505 7.269 9.316 501 HA PRO 66 HA PRO 66 9.027 13.736 10.715 502 HB2 PRO 66 HB2 PRO 66 11.933 13.330 9.956 503 HB3 PRO 66 HB3 PRO 66 11.240 14.450 11.162 504 HG2 PRO 66 HG2 PRO 66 12.492 12.210 11.962 505 HG3 PRO 66 HG3 PRO 66 10.974 12.724 12.762 506 HD2 PRO 66 HD2 PRO 66 11.302 10.688 10.529 507 HD3 PRO 66 HD3 PRO 66 10.441 10.507 12.087 508 H HIS 67 H HIS 67 8.519 14.852 8.933 509 HA HIS 67 HA HIS 67 9.360 14.680 6.256 510 HB2 HIS 67 HB2 HIS 67 8.437 12.765 5.566 511 HB3 HIS 67 HB3 HIS 67 7.693 12.463 7.090 512 HD1 HIS 67 HD1 HIS 67 5.179 12.997 7.427 513 HD2 HIS 67 HD2 HIS 67 6.719 13.685 3.538 514 HE1 HIS 67 HE1 HIS 67 3.174 13.094 5.852 515 H ALA 68 H ALA 68 7.650 15.966 4.871 516 HA ALA 68 HA ALA 68 6.009 17.819 6.521 517 HB1 ALA 68 HB3 ALA 68 8.206 18.709 4.621 518 HB2 ALA 68 HB1 ALA 68 7.054 19.745 5.482 519 HB3 ALA 68 HB2 ALA 68 8.256 18.830 6.389 520 H ARG 69 H ARG 69 4.813 19.324 4.928 521 HA ARG 69 HA ARG 69 3.366 17.800 2.962 522 HB2 ARG 69 HB2 ARG 69 3.664 20.757 3.619 523 HB3 ARG 69 HB3 ARG 69 2.752 20.247 2.199 524 HG2 ARG 69 HG2 ARG 69 1.321 18.799 3.713 525 HG3 ARG 69 HG3 ARG 69 2.176 19.498 5.095 526 HD2 ARG 69 HD2 ARG 69 0.118 20.725 4.824 527 HD3 ARG 69 HD3 ARG 69 1.440 21.784 4.341 528 HE ARG 69 HE ARG 69 0.673 21.795 2.146 529 HH11 ARG 69 HH11 ARG 69 -1.171 19.308 3.921 530 HH12 ARG 69 HH12 ARG 69 -2.308 19.084 2.643 531 HH21 ARG 69 HH21 ARG 69 -0.727 21.521 0.560 532 HH22 ARG 69 HH22 ARG 69 -2.071 20.394 0.631 533 HA PRO 70 HA PRO 70 6.073 17.761 -0.518 534 HB2 PRO 70 HB2 PRO 70 4.429 18.627 -2.633 535 HB3 PRO 70 HB3 PRO 70 4.489 16.980 -1.979 536 HG2 PRO 70 HG2 PRO 70 2.492 19.131 -1.385 537 HG3 PRO 70 HG3 PRO 70 2.228 17.375 -1.596 538 HD2 PRO 70 HD2 PRO 70 2.310 18.541 0.856 539 HD3 PRO 70 HD3 PRO 70 2.962 16.908 0.599 540 H GLU 71 H GLU 71 3.889 20.580 -0.281 541 HA GLU 71 HA GLU 71 5.210 22.529 -1.756 542 HB2 GLU 71 HB2 GLU 71 3.479 22.776 0.743 543 HB3 GLU 71 HB3 GLU 71 3.838 24.103 -0.366 544 HG2 GLU 71 HG2 GLU 71 2.658 22.980 -2.188 545 HG3 GLU 71 HG3 GLU 71 2.370 21.559 -1.181 546 H CYS 72 H CYS 72 6.320 21.168 1.252 547 HA CYS 72 HA CYS 72 7.554 23.646 2.241 548 HB2 CYS 72 HB2 CYS 72 7.775 20.746 3.156 549 HB3 CYS 72 HB3 CYS 72 8.551 22.130 3.947 550 HG CYS 72 HG CYS 72 5.337 21.785 3.266 551 H GLY 73 H GLY 73 8.319 21.431 -0.236 552 HA2 GLY 73 HA2 GLY 73 10.312 22.405 -1.457 553 HA3 GLY 73 HA3 GLY 73 11.247 22.015 -0.007 554 H ALA 74 H ALA 74 8.735 19.707 -0.963 555 HA ALA 74 HA ALA 74 10.748 17.646 -1.465 556 HB1 ALA 74 HB3 ALA 74 8.846 16.256 -2.046 557 HB2 ALA 74 HB1 ALA 74 8.494 17.111 -0.531 558 HB3 ALA 74 HB2 ALA 74 7.771 17.665 -2.066 559 H LEU 75 H LEU 75 11.258 16.740 -3.434 560 HA LEU 75 HA LEU 75 10.629 18.343 -5.879 561 HB2 LEU 75 HB2 LEU 75 13.290 17.115 -5.070 562 HB3 LEU 75 HB3 LEU 75 12.968 17.964 -6.573 563 HG LEU 75 HG LEU 75 12.885 19.227 -3.797 564 HD11 LEU 75 HD11 LEU 75 15.153 18.547 -4.459 565 HD12 LEU 75 HD12 LEU 75 14.987 19.414 -6.000 566 HD13 LEU 75 HD13 LEU 75 14.996 20.306 -4.460 567 HD21 LEU 75 HD23 LEU 75 12.723 20.505 -6.571 568 HD22 LEU 75 HD21 LEU 75 11.413 20.435 -5.374 569 HD23 LEU 75 HD22 LEU 75 12.860 21.383 -5.032 570 H LYS 76 H LYS 76 11.397 15.159 -4.458 571 HA LYS 76 HA LYS 76 10.164 13.840 -6.766 572 HB2 LYS 76 HB2 LYS 76 12.835 13.021 -5.603 573 HB3 LYS 76 HB3 LYS 76 12.007 12.226 -6.936 574 HG2 LYS 76 HG2 LYS 76 12.462 14.176 -8.378 575 HG3 LYS 76 HG3 LYS 76 13.168 15.044 -6.993 576 HD2 LYS 76 HD2 LYS 76 14.915 13.296 -6.765 577 HD3 LYS 76 HD3 LYS 76 14.257 12.459 -8.172 578 HE2 LYS 76 HE2 LYS 76 16.262 13.800 -8.694 579 HE3 LYS 76 HE3 LYS 76 14.859 14.302 -9.642 580 HZ1 LYS 76 HZ3 LYS 76 14.696 16.268 -8.416 581 HZ2 LYS 76 HZ1 LYS 76 15.580 15.711 -7.143 582 HZ3 LYS 76 HZ2 LYS 76 16.323 16.083 -8.525 583 H THR 77 H THR 77 9.466 11.619 -6.164 584 HA THR 77 HA THR 77 8.835 11.459 -3.387 585 HB THR 77 HB THR 77 7.977 9.981 -5.889 586 HG1 THR 77 HG1 THR 77 6.421 11.367 -6.017 587 HG21 THR 77 HG23 THR 77 6.822 9.911 -3.083 588 HG22 THR 77 HG21 THR 77 6.023 9.259 -4.544 589 HG23 THR 77 HG22 THR 77 7.546 8.556 -3.982 590 H GLY 78 H GLY 78 9.679 10.226 -1.837 591 HA2 GLY 78 HA2 GLY 78 10.846 7.656 -2.269 592 HA3 GLY 78 HA3 GLY 78 12.103 8.892 -2.107 593 H MET 79 H MET 79 12.330 7.206 -0.155 594 HA MET 79 HA MET 79 11.262 8.473 2.275 595 HB2 MET 79 HB2 MET 79 10.842 5.559 1.456 596 HB3 MET 79 HB3 MET 79 10.826 6.081 3.137 597 HG2 MET 79 HG2 MET 79 9.109 7.830 2.440 598 HG3 MET 79 HG3 MET 79 8.838 6.872 1.002 599 HE1 MET 79 HE3 MET 79 6.818 5.402 1.024 600 HE2 MET 79 HE1 MET 79 7.996 4.105 1.352 601 HE3 MET 79 HE2 MET 79 6.490 4.183 2.270 602 H SER 80 H SER 80 12.223 7.422 4.233 603 HA SER 80 HA SER 80 14.962 6.372 3.890 604 HB2 SER 80 HB2 SER 80 14.378 8.453 5.998 605 HB3 SER 80 HB3 SER 80 15.939 7.929 5.375 606 HG SER 80 HG SER 80 15.041 10.056 4.788 607 H LEU 81 H LEU 81 15.656 5.261 5.889 608 HA LEU 81 HA LEU 81 13.632 4.722 7.961 609 HB2 LEU 81 HB2 LEU 81 13.538 2.984 6.172 610 HB3 LEU 81 HB3 LEU 81 15.266 2.704 6.319 611 HG LEU 81 HG LEU 81 15.007 1.699 8.495 612 HD11 LEU 81 HD11 LEU 81 13.131 3.035 9.432 613 HD12 LEU 81 HD12 LEU 81 12.044 2.327 8.216 614 HD13 LEU 81 HD13 LEU 81 12.746 1.301 9.468 615 HD21 LEU 81 HD23 LEU 81 12.854 0.760 6.547 616 HD22 LEU 81 HD21 LEU 81 14.571 0.425 6.350 617 HD23 LEU 81 HD22 LEU 81 13.678 -0.257 7.739 618 H THR 82 H THR 82 14.729 5.594 9.736 619 HA THR 82 HA THR 82 17.677 5.189 9.942 620 HB THR 82 HB THR 82 15.944 7.422 11.080 621 HG1 THR 82 HG1 THR 82 15.756 7.563 8.896 622 HG21 THR 82 HG23 THR 82 18.075 8.659 11.171 623 HG22 THR 82 HG21 THR 82 18.122 7.183 12.146 624 HG23 THR 82 HG22 THR 82 18.941 7.222 10.566 625 H LEU 83 H LEU 83 18.430 4.281 11.919 626 HA LEU 83 HA LEU 83 16.499 4.192 14.167 627 HB2 LEU 83 HB2 LEU 83 16.748 1.980 12.788 628 HB3 LEU 83 HB3 LEU 83 18.290 1.807 13.598 629 HG LEU 83 HG LEU 83 15.648 2.238 15.084 630 HD11 LEU 83 HD11 LEU 83 16.967 -0.396 14.379 631 HD12 LEU 83 HD12 LEU 83 15.552 -0.168 15.433 632 HD13 LEU 83 HD13 LEU 83 15.432 0.229 13.726 633 HD21 LEU 83 HD23 LEU 83 17.378 2.582 16.655 634 HD22 LEU 83 HD21 LEU 83 16.916 0.920 16.905 635 HD23 LEU 83 HD22 LEU 83 18.394 1.277 15.985 636 H LEU 84 H LEU 84 17.447 4.627 16.134 637 HA LEU 84 HA LEU 84 20.360 5.312 16.168 638 HB2 LEU 84 HB2 LEU 84 17.915 6.523 17.465 639 HB3 LEU 84 HB3 LEU 84 19.525 6.741 18.160 640 HG LEU 84 HG LEU 84 20.315 8.005 16.333 641 HD11 LEU 84 HD11 LEU 84 17.695 7.408 14.910 642 HD12 LEU 84 HD12 LEU 84 18.863 8.655 14.403 643 HD13 LEU 84 HD13 LEU 84 19.333 6.957 14.389 644 HD21 LEU 84 HD23 LEU 84 18.684 9.905 16.454 645 HD22 LEU 84 HD21 LEU 84 17.492 8.817 17.167 646 HD23 LEU 84 HD22 LEU 84 19.007 9.164 18.032 647 H GLU 85 H GLU 85 21.517 4.010 17.550 648 HA GLU 85 HA GLU 85 20.344 1.916 19.018 649 HB2 GLU 85 HB2 GLU 85 23.095 3.194 19.224 650 HB3 GLU 85 HB3 GLU 85 22.620 1.731 20.095 651 HG2 GLU 85 HG2 GLU 85 22.069 0.629 17.920 652 HG3 GLU 85 HG3 GLU 85 22.653 2.051 17.062 653 H GLN 86 H GLN 86 21.423 5.113 20.083 654 HA GLN 86 HA GLN 86 20.473 4.605 22.849 655 HB2 GLN 86 HB2 GLN 86 21.894 6.983 21.567 656 HB3 GLN 86 HB3 GLN 86 21.497 6.860 23.275 657 HG2 GLN 86 HG2 GLN 86 22.864 4.810 23.509 658 HG3 GLN 86 HG3 GLN 86 23.254 4.843 21.791 659 HE21 GLN 86 HE22 GLN 86 24.731 6.369 20.981 660 HE22 GLN 86 HE21 GLN 86 25.824 7.251 22.034 661 H GLY 87 H GLY 87 19.115 5.799 19.962 662 HA2 GLY 87 HA2 GLY 87 17.313 7.140 19.458 663 HA3 GLY 87 HA3 GLY 87 16.780 6.955 21.131 664 H VAL 88 H VAL 88 16.162 9.327 20.402 665 HA VAL 88 HA VAL 88 17.884 10.918 22.071 666 HB VAL 88 HB VAL 88 18.510 11.156 19.425 667 HG11 VAL 88 HG11 VAL 88 16.449 13.339 19.755 668 HG12 VAL 88 HG12 VAL 88 17.539 13.047 18.395 669 HG13 VAL 88 HG13 VAL 88 16.270 11.858 18.776 670 HG21 VAL 88 HG23 VAL 88 18.587 13.379 21.456 671 HG22 VAL 88 HG21 VAL 88 19.759 12.053 21.236 672 HG23 VAL 88 HG22 VAL 88 19.545 13.262 19.958 673 H TYR 89 H TYR 89 16.578 13.129 22.441 674 HA TYR 89 HA TYR 89 13.723 12.310 22.630 675 HB2 TYR 89 HB2 TYR 89 14.962 11.846 24.721 676 HB3 TYR 89 HB3 TYR 89 15.360 13.545 24.846 677 HD1 TYR 89 HD2 TYR 89 11.931 13.001 23.548 678 HD2 TYR 89 HD1 TYR 89 14.344 13.222 27.149 679 HE1 TYR 89 HE2 TYR 89 9.941 13.390 24.863 680 HE2 TYR 89 HE1 TYR 89 12.296 13.658 28.472 681 HH TYR 89 HH TYR 89 9.064 13.965 26.901 682 H PHE 90 H PHE 90 13.047 13.574 20.999 683 HA PHE 90 HA PHE 90 13.471 16.272 20.474 684 HB2 PHE 90 HB2 PHE 90 10.967 14.556 20.383 685 HB3 PHE 90 HB3 PHE 90 11.081 16.170 19.671 686 HD1 PHE 90 HD1 PHE 90 12.987 16.604 17.964 687 HD2 PHE 90 HD2 PHE 90 11.544 12.683 18.998 688 HE1 PHE 90 HE1 PHE 90 13.925 15.708 15.860 689 HE2 PHE 90 HE2 PHE 90 12.485 11.783 16.879 690 HZ PHE 90 HZ PHE 90 13.682 13.300 15.307 691 HA PRO 91 HA PRO 91 11.925 18.295 24.110 692 HB2 PRO 91 HB2 PRO 91 11.199 20.765 23.117 693 HB3 PRO 91 HB3 PRO 91 12.891 20.251 23.395 694 HG2 PRO 91 HG2 PRO 91 11.325 20.191 20.805 695 HG3 PRO 91 HG3 PRO 91 12.990 20.798 21.080 696 HD2 PRO 91 HD2 PRO 91 12.515 18.315 20.083 697 HD3 PRO 91 HD3 PRO 91 13.857 18.598 21.236 698 H GLY 92 H GLY 92 9.973 18.423 25.150 699 HA2 GLY 92 HA2 GLY 92 7.749 18.628 25.539 700 HA3 GLY 92 HA3 GLY 92 7.544 19.194 23.878 701 H ASN 93 H ASN 93 8.942 16.151 23.438 702 HA ASN 93 HA ASN 93 6.338 14.954 22.897 703 HB2 ASN 93 HB2 ASN 93 8.428 14.648 21.461 704 HB3 ASN 93 HB3 ASN 93 9.092 13.659 22.756 705 HD21 ASN 93 HD22 ASN 93 8.894 11.516 22.115 706 HD22 ASN 93 HD21 ASN 93 7.455 10.837 21.375 707 H ASP 94 H ASP 94 5.880 12.671 23.785 708 HA ASP 94 HA ASP 94 5.997 12.758 26.652 709 HB2 ASP 94 HB2 ASP 94 4.130 11.745 25.386 710 HB3 ASP 94 HB3 ASP 94 5.214 10.473 24.810 711 H GLU 95 H GLU 95 7.871 10.976 24.220 712 HA GLU 95 HA GLU 95 9.796 10.065 26.253 713 HB2 GLU 95 HB2 GLU 95 9.256 7.815 26.020 714 HB3 GLU 95 HB3 GLU 95 7.692 8.587 25.943 715 HG2 GLU 95 HG2 GLU 95 7.734 8.436 23.449 716 HG3 GLU 95 HG3 GLU 95 9.265 7.557 23.572 717 HA PRO 96 HA PRO 96 12.703 10.425 22.934 718 HB2 PRO 96 HB2 PRO 96 14.513 8.403 23.230 719 HB3 PRO 96 HB3 PRO 96 14.350 9.721 24.425 720 HG2 PRO 96 HG2 PRO 96 13.144 6.951 24.543 721 HG3 PRO 96 HG3 PRO 96 14.019 7.836 25.832 722 HD2 PRO 96 HD2 PRO 96 11.296 7.747 25.652 723 HD3 PRO 96 HD3 PRO 96 12.146 9.184 26.301 724 H ILE 97 H ILE 97 13.507 9.521 20.910 725 HA ILE 97 HA ILE 97 11.768 7.359 19.757 726 HB ILE 97 HB ILE 97 12.943 9.833 18.453 727 HG12 ILE 97 HG12 ILE 97 11.106 10.550 19.792 728 HG13 ILE 97 HG13 ILE 97 10.563 10.525 18.127 729 HG21 ILE 97 HG21 ILE 97 12.880 7.921 16.855 730 HG22 ILE 97 HG22 ILE 97 11.159 7.690 17.216 731 HG23 ILE 97 HG23 ILE 97 11.728 9.175 16.440 732 HD11 ILE 97 HD13 ILE 97 8.830 9.724 19.662 733 HD12 ILE 97 HD11 ILE 97 9.316 8.407 18.574 734 HD13 ILE 97 HD12 ILE 97 9.867 8.456 20.270 735 H LYS 98 H LYS 98 12.734 5.754 18.768 736 HA LYS 98 HA LYS 98 15.708 5.796 18.513 737 HB2 LYS 98 HB2 LYS 98 13.805 3.560 19.308 738 HB3 LYS 98 HB3 LYS 98 15.402 3.245 18.612 739 HG2 LYS 98 HG2 LYS 98 16.498 4.517 20.399 740 HG3 LYS 98 HG3 LYS 98 14.937 4.930 21.110 741 HD2 LYS 98 HD2 LYS 98 16.100 3.086 22.307 742 HD3 LYS 98 HD3 LYS 98 14.504 2.644 21.714 743 HE2 LYS 98 HE2 LYS 98 16.089 0.812 21.397 744 HE3 LYS 98 HE3 LYS 98 15.455 1.384 19.857 745 HZ1 LYS 98 HZ3 LYS 98 17.830 1.005 19.758 746 HZ2 LYS 98 HZ1 LYS 98 17.564 2.609 19.534 747 HZ3 LYS 98 HZ2 LYS 98 18.134 2.059 20.966 748 H LEU 99 H LEU 99 12.643 5.538 16.755 749 HA LEU 99 HA LEU 99 14.370 5.136 14.398 750 HB2 LEU 99 HB2 LEU 99 13.343 2.931 14.967 751 HB3 LEU 99 HB3 LEU 99 11.752 3.676 14.886 752 HG LEU 99 HG LEU 99 13.100 4.223 12.371 753 HD11 LEU 99 HD11 LEU 99 13.351 1.332 13.115 754 HD12 LEU 99 HD12 LEU 99 13.550 2.039 11.503 755 HD13 LEU 99 HD13 LEU 99 14.616 2.531 12.809 756 HD21 LEU 99 HD23 LEU 99 10.704 2.568 13.073 757 HD22 LEU 99 HD21 LEU 99 10.784 4.264 12.559 758 HD23 LEU 99 HD22 LEU 99 11.229 2.980 11.420 759 H LEU 100 H LEU 100 13.744 6.009 12.535 760 HA LEU 100 HA LEU 100 11.509 7.961 12.574 761 HB2 LEU 100 HB2 LEU 100 14.295 8.790 11.704 762 HB3 LEU 100 HB3 LEU 100 12.884 9.771 11.940 763 HG LEU 100 HG LEU 100 13.205 8.772 14.476 764 HD11 LEU 100 HD11 LEU 100 15.314 7.583 13.821 765 HD12 LEU 100 HD12 LEU 100 16.030 9.150 13.409 766 HD13 LEU 100 HD13 LEU 100 15.566 8.795 15.088 767 HD21 LEU 100 HD23 LEU 100 14.586 11.252 13.442 768 HD22 LEU 100 HD21 LEU 100 12.905 11.123 14.017 769 HD23 LEU 100 HD22 LEU 100 14.247 10.864 15.139 770 H ILE 101 H ILE 101 10.362 7.272 10.760 771 HA ILE 101 HA ILE 101 11.929 6.443 8.367 772 HB ILE 101 HB ILE 101 9.089 5.968 9.190 773 HG12 ILE 101 HG12 ILE 101 11.318 4.548 7.708 774 HG13 ILE 101 HG13 ILE 101 10.590 4.153 9.257 775 HG21 ILE 101 HG21 ILE 101 8.189 5.793 6.982 776 HG22 ILE 101 HG22 ILE 101 8.734 7.435 7.196 777 HG23 ILE 101 HG23 ILE 101 9.730 6.308 6.246 778 HD11 ILE 101 HD13 ILE 101 8.475 3.542 7.921 779 HD12 ILE 101 HD11 ILE 101 9.478 3.765 6.458 780 HD13 ILE 101 HD12 ILE 101 9.901 2.524 7.632 781 H GLY 102 H GLY 102 12.154 7.714 6.635 782 HA2 GLY 102 HA2 GLY 102 11.211 10.552 6.851 783 HA3 GLY 102 HA3 GLY 102 12.581 10.012 5.879 784 H LEU 103 H LEU 103 10.169 11.444 4.936 785 HA LEU 103 HA LEU 103 9.655 9.747 2.623 786 HB2 LEU 103 HB2 LEU 103 7.787 9.221 4.359 787 HB3 LEU 103 HB3 LEU 103 7.319 10.896 4.201 788 HG LEU 103 HG LEU 103 6.990 8.582 2.249 789 HD11 LEU 103 HD11 LEU 103 5.042 10.747 3.221 790 HD12 LEU 103 HD12 LEU 103 4.672 9.121 2.618 791 HD13 LEU 103 HD13 LEU 103 5.396 9.349 4.210 792 HD21 LEU 103 HD23 LEU 103 5.786 10.306 0.752 793 HD22 LEU 103 HD21 LEU 103 6.726 11.536 1.562 794 HD23 LEU 103 HD22 LEU 103 7.522 10.187 0.656 795 H SER 104 H SER 104 9.333 11.034 0.801 796 HA SER 104 HA SER 104 8.537 13.830 1.077 797 HB2 SER 104 HB2 SER 104 10.273 14.608 -0.458 798 HB3 SER 104 HB3 SER 104 10.988 13.959 1.029 799 HG SER 104 HG SER 104 11.020 12.927 -1.589 800 H ALA 105 H ALA 105 7.195 14.393 -0.796 801 HA ALA 105 HA ALA 105 7.413 12.624 -3.074 802 HB1 ALA 105 HB3 ALA 105 5.325 11.776 -3.176 803 HB2 ALA 105 HB1 ALA 105 5.520 11.764 -1.423 804 HB3 ALA 105 HB2 ALA 105 4.606 13.068 -2.232 805 H ALA 106 H ALA 106 6.760 13.550 -5.019 806 HA ALA 106 HA ALA 106 7.022 16.426 -4.819 807 HB1 ALA 106 HB3 ALA 106 7.120 16.344 -7.308 808 HB2 ALA 106 HB1 ALA 106 8.174 15.103 -6.608 809 HB3 ALA 106 HB2 ALA 106 6.594 14.647 -7.286 810 H ASP 107 H ASP 107 4.348 14.262 -4.882 811 HA ASP 107 HA ASP 107 2.502 16.583 -5.234 812 HB2 ASP 107 HB2 ASP 107 2.545 15.323 -7.374 813 HB3 ASP 107 HB3 ASP 107 2.099 13.851 -6.507 814 H ALA 108 H ALA 108 0.510 16.371 -4.059 815 HA ALA 108 HA ALA 108 0.858 15.209 -1.510 816 HB1 ALA 108 HB3 ALA 108 -1.468 15.922 -1.112 817 HB2 ALA 108 HB1 ALA 108 -0.542 17.198 -1.926 818 HB3 ALA 108 HB2 ALA 108 -1.694 16.201 -2.851 819 H ASP 109 H ASP 109 -0.789 13.906 -4.412 820 HA ASP 109 HA ASP 109 -2.034 11.715 -2.906 821 HB2 ASP 109 HB2 ASP 109 -3.040 12.461 -4.968 822 HB3 ASP 109 HB3 ASP 109 -1.545 12.111 -5.865 823 H SER 110 H SER 110 1.038 12.280 -4.582 824 HA SER 110 HA SER 110 1.972 9.557 -4.353 825 HB2 SER 110 HB2 SER 110 3.592 12.128 -4.552 826 HB3 SER 110 HB3 SER 110 4.160 10.479 -4.841 827 HG SER 110 HG SER 110 3.613 11.513 -6.792 828 H HIS 111 H HIS 111 2.053 12.434 -2.151 829 HA HIS 111 HA HIS 111 3.511 11.120 -0.056 830 HB2 HIS 111 HB2 HIS 111 1.554 13.431 -0.053 831 HB3 HIS 111 HB3 HIS 111 2.035 12.676 1.449 832 HD1 HIS 111 HD1 HIS 111 4.438 13.237 2.392 833 HD2 HIS 111 HD2 HIS 111 3.435 14.945 -1.309 834 HE1 HIS 111 HE1 HIS 111 6.233 14.943 1.880 835 H ILE 112 H ILE 112 -0.038 11.257 -0.749 836 HA ILE 112 HA ILE 112 -0.864 9.656 1.422 837 HB ILE 112 HB ILE 112 -1.999 9.973 -1.379 838 HG12 ILE 112 HG12 ILE 112 -2.014 11.995 0.101 839 HG13 ILE 112 HG13 ILE 112 -3.583 11.474 -0.480 840 HG21 ILE 112 HG21 ILE 112 -4.140 9.047 -0.510 841 HG22 ILE 112 HG22 ILE 112 -2.855 7.856 -0.696 842 HG23 ILE 112 HG23 ILE 112 -3.259 8.460 0.923 843 HD11 ILE 112 HD13 ILE 112 -4.116 10.520 1.712 844 HD12 ILE 112 HD11 ILE 112 -2.482 10.919 2.306 845 HD13 ILE 112 HD12 ILE 112 -3.617 12.214 1.862 846 H GLY 113 H GLY 113 0.078 8.550 -1.912 847 HA2 GLY 113 HA2 GLY 113 -0.267 5.806 -1.431 848 HA3 GLY 113 HA3 GLY 113 0.864 6.510 -2.607 849 H ALA 114 H ALA 114 2.605 7.871 -0.820 850 HA ALA 114 HA ALA 114 4.360 5.720 -0.070 851 HB1 ALA 114 HB3 ALA 114 5.160 7.894 -0.913 852 HB2 ALA 114 HB1 ALA 114 4.412 8.709 0.464 853 HB3 ALA 114 HB2 ALA 114 5.780 7.592 0.717 854 H ILE 115 H ILE 115 2.336 8.029 1.855 855 HA ILE 115 HA ILE 115 3.073 7.200 4.392 856 HB ILE 115 HB ILE 115 0.744 8.450 3.108 857 HG12 ILE 115 HG12 ILE 115 2.758 9.804 3.702 858 HG13 ILE 115 HG13 ILE 115 1.239 10.429 4.306 859 HG21 ILE 115 HG21 ILE 115 -0.515 7.237 4.595 860 HG22 ILE 115 HG22 ILE 115 0.627 7.507 5.937 861 HG23 ILE 115 HG23 ILE 115 -0.387 8.845 5.306 862 HD11 ILE 115 HD13 ILE 115 1.710 9.719 6.554 863 HD12 ILE 115 HD11 ILE 115 3.100 8.757 6.022 864 HD13 ILE 115 HD12 ILE 115 3.160 10.529 5.938 865 H GLN 116 H GLN 116 0.468 6.082 2.127 866 HA GLN 116 HA GLN 116 -0.610 4.090 3.869 867 HB2 GLN 116 HB2 GLN 116 -0.781 4.579 0.868 868 HB3 GLN 116 HB3 GLN 116 -1.662 3.275 1.662 869 HG2 GLN 116 HG2 GLN 116 -1.935 6.196 2.475 870 HG3 GLN 116 HG3 GLN 116 -2.961 5.414 1.277 871 HE21 GLN 116 HE22 GLN 116 -4.367 3.593 2.007 872 HE22 GLN 116 HE21 GLN 116 -4.835 3.496 3.684 873 H ALA 117 H ALA 117 2.368 4.110 2.208 874 HA ALA 117 HA ALA 117 2.506 1.197 2.079 875 HB1 ALA 117 HB3 ALA 117 4.618 1.521 0.883 876 HB2 ALA 117 HB1 ALA 117 3.381 2.526 0.114 877 HB3 ALA 117 HB2 ALA 117 4.576 3.260 1.194 878 H LEU 118 H LEU 118 4.070 4.051 3.650 879 HA LEU 118 HA LEU 118 5.797 2.337 5.155 880 HB2 LEU 118 HB2 LEU 118 6.536 4.285 6.240 881 HB3 LEU 118 HB3 LEU 118 6.298 4.568 4.505 882 HG LEU 118 HG LEU 118 4.025 5.504 5.133 883 HD11 LEU 118 HD11 LEU 118 4.270 4.883 7.680 884 HD12 LEU 118 HD12 LEU 118 5.446 6.183 7.718 885 HD13 LEU 118 HD13 LEU 118 3.740 6.485 7.235 886 HD21 LEU 118 HD23 LEU 118 6.636 6.958 5.658 887 HD22 LEU 118 HD21 LEU 118 5.680 6.903 4.162 888 HD23 LEU 118 HD22 LEU 118 5.061 7.756 5.585 889 H SER 119 H SER 119 2.600 3.650 5.705 890 HA SER 119 HA SER 119 2.361 2.919 8.423 891 HB2 SER 119 HB2 SER 119 0.176 2.828 6.298 892 HB3 SER 119 HB3 SER 119 -0.071 2.875 8.053 893 HG SER 119 HG SER 119 1.041 4.853 6.356 894 H GLU 120 H GLU 120 2.601 0.747 5.653 895 HA GLU 120 HA GLU 120 1.415 -1.539 6.927 896 HB2 GLU 120 HB2 GLU 120 3.550 -1.432 4.771 897 HB3 GLU 120 HB3 GLU 120 2.653 -2.859 5.248 898 HG2 GLU 120 HG2 GLU 120 1.301 -0.361 4.184 899 HG3 GLU 120 HG3 GLU 120 1.826 -1.685 3.147 900 H LEU 121 H LEU 121 4.264 0.282 7.359 901 HA LEU 121 HA LEU 121 5.668 -1.860 8.876 902 HB2 LEU 121 HB2 LEU 121 6.749 0.809 7.895 903 HB3 LEU 121 HB3 LEU 121 7.662 -0.481 8.642 904 HG LEU 121 HG LEU 121 6.373 -0.435 5.882 905 HD11 LEU 121 HD11 LEU 121 8.751 -0.739 5.159 906 HD12 LEU 121 HD12 LEU 121 8.488 0.759 6.066 907 HD13 LEU 121 HD13 LEU 121 9.258 -0.635 6.850 908 HD21 LEU 121 HD23 LEU 121 7.829 -2.811 7.114 909 HD22 LEU 121 HD21 LEU 121 6.097 -2.742 6.727 910 HD23 LEU 121 HD22 LEU 121 7.295 -2.662 5.437 911 H LEU 122 H LEU 122 5.153 1.734 9.159 912 HA LEU 122 HA LEU 122 5.776 1.751 11.917 913 HB2 LEU 122 HB2 LEU 122 4.202 3.836 10.415 914 HB3 LEU 122 HB3 LEU 122 5.040 4.009 11.958 915 HG LEU 122 HG LEU 122 6.232 3.746 9.194 916 HD11 LEU 122 HD11 LEU 122 7.038 5.876 9.610 917 HD12 LEU 122 HD12 LEU 122 5.516 5.921 10.478 918 HD13 LEU 122 HD13 LEU 122 7.018 5.685 11.381 919 HD21 LEU 122 HD23 LEU 122 7.651 2.220 10.436 920 HD22 LEU 122 HD21 LEU 122 8.507 3.759 10.335 921 HD23 LEU 122 HD22 LEU 122 7.697 3.308 11.837 922 H CYS 123 H CYS 123 2.719 0.866 10.504 923 HA CYS 123 HA CYS 123 1.438 1.242 13.169 924 HB2 CYS 123 HB2 CYS 123 0.081 0.960 10.460 925 HB3 CYS 123 HB3 CYS 123 -0.689 1.346 11.996 926 HG CYS 123 HG CYS 123 -0.663 3.500 10.512 927 H GLU 124 H GLU 124 3.207 -0.946 12.354 928 HA GLU 124 HA GLU 124 1.328 -3.203 12.657 929 HB2 GLU 124 HB2 GLU 124 1.902 -2.712 10.222 930 HB3 GLU 124 HB3 GLU 124 3.572 -3.135 10.610 931 HG2 GLU 124 HG2 GLU 124 2.463 -5.021 9.628 932 HG3 GLU 124 HG3 GLU 124 2.804 -5.388 11.326 933 H GLU 125 H GLU 125 1.828 -3.668 14.689 934 HA GLU 125 HA GLU 125 4.272 -3.312 15.931 935 HB2 GLU 125 HB2 GLU 125 3.402 -4.649 17.744 936 HB3 GLU 125 HB3 GLU 125 2.158 -3.579 17.101 937 HG2 GLU 125 HG2 GLU 125 1.198 -5.512 15.815 938 HG3 GLU 125 HG3 GLU 125 2.414 -6.569 16.534 939 H GLU 126 H GLU 126 3.333 -5.976 13.859 940 HA GLU 126 HA GLU 126 5.293 -7.864 14.710 941 HB2 GLU 126 HB2 GLU 126 4.124 -7.479 11.916 942 HB3 GLU 126 HB3 GLU 126 4.992 -8.906 12.503 943 HG2 GLU 126 HG2 GLU 126 3.208 -9.150 14.281 944 HG3 GLU 126 HG3 GLU 126 2.318 -7.847 13.479 945 H ILE 127 H ILE 127 5.300 -5.251 12.310 946 HA ILE 127 HA ILE 127 8.054 -5.669 11.471 947 HB ILE 127 HB ILE 127 5.999 -3.572 10.947 948 HG12 ILE 127 HG12 ILE 127 6.166 -4.241 8.652 949 HG13 ILE 127 HG13 ILE 127 7.539 -5.305 8.980 950 HG21 ILE 127 HG21 ILE 127 7.981 -2.260 11.032 951 HG22 ILE 127 HG22 ILE 127 8.952 -3.541 10.270 952 HG23 ILE 127 HG23 ILE 127 7.770 -2.626 9.323 953 HD11 ILE 127 HD13 ILE 127 4.719 -5.773 9.994 954 HD12 ILE 127 HD11 ILE 127 5.394 -6.480 8.516 955 HD13 ILE 127 HD12 ILE 127 6.091 -6.906 10.084 956 H LEU 128 H LEU 128 6.294 -3.476 13.754 957 HA LEU 128 HA LEU 128 8.543 -1.973 14.433 958 HB2 LEU 128 HB2 LEU 128 6.367 -2.797 16.395 959 HB3 LEU 128 HB3 LEU 128 7.509 -1.483 16.606 960 HG LEU 128 HG LEU 128 5.234 -1.592 14.597 961 HD11 LEU 128 HD11 LEU 128 5.831 0.289 16.909 962 HD12 LEU 128 HD12 LEU 128 4.418 0.351 15.831 963 HD13 LEU 128 HD13 LEU 128 4.636 -1.025 16.924 964 HD21 LEU 128 HD23 LEU 128 7.004 -0.513 13.398 965 HD22 LEU 128 HD21 LEU 128 5.933 0.752 14.002 966 HD23 LEU 128 HD22 LEU 128 7.472 0.437 14.828 967 H GLU 129 H GLU 129 7.725 -5.233 15.625 968 HA GLU 129 HA GLU 129 9.877 -5.282 17.517 969 HB2 GLU 129 HB2 GLU 129 8.029 -7.320 16.329 970 HB3 GLU 129 HB3 GLU 129 9.604 -7.913 16.882 971 HG2 GLU 129 HG2 GLU 129 9.286 -6.905 19.083 972 HG3 GLU 129 HG3 GLU 129 7.710 -6.263 18.594 973 H GLN 130 H GLN 130 9.624 -6.111 14.014 974 HA GLN 130 HA GLN 130 12.205 -7.338 13.877 975 HB2 GLN 130 HB2 GLN 130 10.280 -6.185 11.832 976 HB3 GLN 130 HB3 GLN 130 11.831 -6.899 11.367 977 HG2 GLN 130 HG2 GLN 130 11.250 -9.045 12.168 978 HG3 GLN 130 HG3 GLN 130 9.863 -8.441 13.073 979 HE21 GLN 130 HE21 GLN 130 7.897 -8.134 12.065 980 HE22 GLN 130 HE22 GLN 130 7.583 -8.625 10.404 981 H LEU 131 H LEU 131 11.044 -3.975 13.556 982 HA LEU 131 HA LEU 131 13.682 -3.024 12.790 983 HB2 LEU 131 HB2 LEU 131 12.839 -0.884 12.685 984 HB3 LEU 131 HB3 LEU 131 11.562 -1.967 12.101 985 HG LEU 131 HG LEU 131 10.554 -1.724 14.400 986 HD11 LEU 131 HD11 LEU 131 11.754 1.032 14.466 987 HD12 LEU 131 HD12 LEU 131 10.822 0.201 15.687 988 HD13 LEU 131 HD13 LEU 131 12.504 -0.270 15.387 989 HD21 LEU 131 HD23 LEU 131 10.569 0.417 12.263 990 HD22 LEU 131 HD21 LEU 131 9.462 -0.952 12.429 991 HD23 LEU 131 HD22 LEU 131 9.380 0.392 13.580 992 H LEU 132 H LEU 132 11.761 -2.984 15.911 993 HA LEU 132 HA LEU 132 13.815 -1.647 17.322 994 HB2 LEU 132 HB2 LEU 132 11.702 -3.629 18.235 995 HB3 LEU 132 HB3 LEU 132 12.769 -2.817 19.372 996 HG LEU 132 HG LEU 132 11.038 -1.251 17.427 997 HD11 LEU 132 HD11 LEU 132 10.379 -2.075 20.276 998 HD12 LEU 132 HD12 LEU 132 9.418 -0.988 19.237 999 HD13 LEU 132 HD13 LEU 132 9.618 -2.691 18.788 1000 HD21 LEU 132 HD23 LEU 132 11.343 0.581 19.038 1001 HD22 LEU 132 HD21 LEU 132 12.430 -0.445 20.002 1002 HD23 LEU 132 HD22 LEU 132 12.874 0.043 18.349 1003 H THR 133 H THR 133 13.715 -5.003 16.303 1004 HA THR 133 HA THR 133 15.990 -5.691 18.050 1005 HB THR 133 HB THR 133 15.625 -7.976 17.125 1006 HG1 THR 133 HG1 THR 133 13.224 -6.925 16.068 1007 HG21 THR 133 HG23 THR 133 14.537 -7.308 19.242 1008 HG22 THR 133 HG21 THR 133 13.113 -6.730 18.354 1009 HG23 THR 133 HG22 THR 133 13.540 -8.447 18.325 1010 H ALA 134 H ALA 134 15.765 -4.018 15.185 1011 HA ALA 134 HA ALA 134 17.536 -5.469 13.515 1012 HB1 ALA 134 HB3 ALA 134 15.928 -3.770 12.670 1013 HB2 ALA 134 HB1 ALA 134 16.899 -2.490 13.432 1014 HB3 ALA 134 HB2 ALA 134 17.597 -3.473 12.132 1015 H SER 135 H SER 135 19.519 -5.998 14.126 1016 HA SER 135 HA SER 135 21.222 -4.324 15.729 1017 HB2 SER 135 HB2 SER 135 22.844 -6.234 15.039 1018 HB3 SER 135 HB3 SER 135 21.425 -6.633 16.025 1019 HG SER 135 HG SER 135 21.710 -8.088 14.278 1020 H SER 136 H SER 136 20.626 -4.661 12.272 1021 HA SER 136 HA SER 136 22.913 -2.886 11.630 1022 HB2 SER 136 HB2 SER 136 22.362 -5.588 10.320 1023 HB3 SER 136 HB3 SER 136 23.648 -4.453 9.884 1024 HG SER 136 HG SER 136 24.391 -6.154 11.227 1025 H GLU 137 H GLU 137 22.818 -1.976 9.571 1026 HA GLU 137 HA GLU 137 20.487 -0.831 8.608 1027 HB2 GLU 137 HB2 GLU 137 22.964 -0.313 8.238 1028 HB3 GLU 137 HB3 GLU 137 22.982 -1.610 7.045 1029 HG2 GLU 137 HG2 GLU 137 21.132 -0.310 5.824 1030 HG3 GLU 137 HG3 GLU 137 21.461 1.003 6.977 1031 H LYS 138 H LYS 138 22.023 -3.903 7.499 1032 HA LYS 138 HA LYS 138 20.263 -4.129 5.271 1033 HB2 LYS 138 HB2 LYS 138 22.301 -5.943 6.560 1034 HB3 LYS 138 HB3 LYS 138 21.168 -6.623 5.399 1035 HG2 LYS 138 HG2 LYS 138 23.233 -5.983 4.287 1036 HG3 LYS 138 HG3 LYS 138 21.849 -5.087 3.662 1037 HD2 LYS 138 HD2 LYS 138 22.538 -3.084 4.944 1038 HD3 LYS 138 HD3 LYS 138 23.912 -3.991 5.625 1039 HE2 LYS 138 HE2 LYS 138 24.789 -4.319 3.311 1040 HE3 LYS 138 HE3 LYS 138 23.409 -3.422 2.667 1041 HZ1 LYS 138 HZ3 LYS 138 25.309 -1.989 2.855 1042 HZ2 LYS 138 HZ1 LYS 138 24.188 -1.469 3.930 1043 HZ3 LYS 138 HZ2 LYS 138 25.504 -2.312 4.438 1044 H GLN 139 H GLN 139 19.652 -4.996 8.657 1045 HA GLN 139 HA GLN 139 17.544 -6.839 7.956 1046 HB2 GLN 139 HB2 GLN 139 18.632 -7.278 9.983 1047 HB3 GLN 139 HB3 GLN 139 18.744 -5.574 10.412 1048 HG2 GLN 139 HG2 GLN 139 17.238 -6.668 11.852 1049 HG3 GLN 139 HG3 GLN 139 16.453 -5.411 10.892 1050 HE21 GLN 139 HE22 GLN 139 14.489 -6.659 11.825 1051 HE22 GLN 139 HE21 GLN 139 13.919 -8.029 10.886 1052 H LEU 140 H LEU 140 17.996 -3.305 8.473 1053 HA LEU 140 HA LEU 140 15.140 -2.769 8.639 1054 HB2 LEU 140 HB2 LEU 140 17.593 -1.063 8.103 1055 HB3 LEU 140 HB3 LEU 140 15.977 -0.407 8.057 1056 HG LEU 140 HG LEU 140 17.155 -1.824 10.455 1057 HD11 LEU 140 HD11 LEU 140 16.816 1.174 10.035 1058 HD12 LEU 140 HD12 LEU 140 17.519 0.343 11.441 1059 HD13 LEU 140 HD13 LEU 140 18.350 0.295 9.886 1060 HD21 LEU 140 HD23 LEU 140 15.326 -0.780 11.734 1061 HD22 LEU 140 HD21 LEU 140 14.625 -0.148 10.231 1062 HD23 LEU 140 HD22 LEU 140 14.711 -1.900 10.533 1063 H ALA 141 H ALA 141 17.648 -2.662 6.063 1064 HA ALA 141 HA ALA 141 15.929 -2.240 3.878 1065 HB1 ALA 141 HB3 ALA 141 18.440 -2.295 3.779 1066 HB2 ALA 141 HB1 ALA 141 18.360 -4.071 3.888 1067 HB3 ALA 141 HB2 ALA 141 17.642 -3.235 2.501 1068 H ASP 142 H ASP 142 16.602 -5.381 5.541 1069 HA ASP 142 HA ASP 142 15.152 -6.962 3.719 1070 HB2 ASP 142 HB2 ASP 142 16.593 -7.927 5.450 1071 HB3 ASP 142 HB3 ASP 142 15.474 -7.392 6.708 1072 H ILE 143 H ILE 143 13.929 -5.060 6.557 1073 HA ILE 143 HA ILE 143 11.255 -5.976 6.396 1074 HB ILE 143 HB ILE 143 12.603 -3.478 7.479 1075 HG12 ILE 143 HG12 ILE 143 11.380 -5.891 8.899 1076 HG13 ILE 143 HG13 ILE 143 13.097 -5.680 8.582 1077 HG21 ILE 143 HG21 ILE 143 10.548 -2.925 8.646 1078 HG22 ILE 143 HG22 ILE 143 10.323 -2.876 6.907 1079 HG23 ILE 143 HG23 ILE 143 9.708 -4.276 7.827 1080 HD11 ILE 143 HD13 ILE 143 12.879 -3.432 9.883 1081 HD12 ILE 143 HD11 ILE 143 11.371 -4.155 10.525 1082 HD13 ILE 143 HD12 ILE 143 12.927 -4.966 10.754 1083 H ILE 144 H ILE 144 12.986 -3.285 4.787 1084 HA ILE 144 HA ILE 144 10.711 -2.251 3.398 1085 HB ILE 144 HB ILE 144 13.693 -2.193 2.711 1086 HG12 ILE 144 HG12 ILE 144 13.373 -0.946 4.696 1087 HG13 ILE 144 HG13 ILE 144 13.481 0.232 3.396 1088 HG21 ILE 144 HG21 ILE 144 12.573 -1.860 0.642 1089 HG22 ILE 144 HG22 ILE 144 11.457 -0.673 1.341 1090 HG23 ILE 144 HG23 ILE 144 13.192 -0.313 1.188 1091 HD11 ILE 144 HD13 ILE 144 10.890 0.151 3.354 1092 HD12 ILE 144 HD11 ILE 144 11.054 -0.669 4.925 1093 HD13 ILE 144 HD12 ILE 144 11.684 0.976 4.719 1094 H SER 145 H SER 145 13.040 -4.801 2.483 1095 HA SER 145 HA SER 145 11.772 -5.164 -0.035 1096 HB2 SER 145 HB2 SER 145 13.573 -7.047 1.555 1097 HB3 SER 145 HB3 SER 145 13.145 -7.250 -0.157 1098 HG SER 145 HG SER 145 15.156 -6.171 0.139 1099 H ARG 146 H ARG 146 11.014 -6.498 3.202 1100 HA ARG 146 HA ARG 146 9.331 -8.601 2.281 1101 HB2 ARG 146 HB2 ARG 146 10.019 -9.010 4.412 1102 HB3 ARG 146 HB3 ARG 146 10.164 -7.305 4.837 1103 HG2 ARG 146 HG2 ARG 146 7.846 -7.053 5.170 1104 HG3 ARG 146 HG3 ARG 146 7.516 -8.707 4.574 1105 HD2 ARG 146 HD2 ARG 146 8.925 -9.554 6.513 1106 HD3 ARG 146 HD3 ARG 146 8.901 -7.901 7.166 1107 HE ARG 146 HE ARG 146 6.259 -8.394 6.697 1108 HH11 ARG 146 HH11 ARG 146 8.688 -10.081 8.661 1109 HH12 ARG 146 HH12 ARG 146 7.549 -11.161 9.389 1110 HH21 ARG 146 HH21 ARG 146 4.722 -9.670 7.836 1111 HH22 ARG 146 HH22 ARG 146 5.234 -10.800 9.026 1112 H GLY 147 H GLY 147 8.900 -5.185 3.094 1113 HA2 GLY 147 HA2 GLY 147 6.099 -5.083 3.292 1114 HA3 GLY 147 HA3 GLY 147 7.161 -3.729 2.873 Start of MODEL 12 1 H MET 1 H1 MET 1 1.978 -1.267 -0.648 2 HA MET 1 HA MET 1 2.343 -1.723 -3.532 3 HB2 MET 1 HB2 MET 1 1.994 0.766 -2.770 4 HB3 MET 1 HB3 MET 1 3.580 0.579 -1.981 5 HG2 MET 1 HG2 MET 1 3.590 1.647 -4.260 6 HG3 MET 1 HG3 MET 1 4.703 0.313 -4.025 7 HE1 MET 1 HE3 MET 1 3.929 0.035 -7.814 8 HE2 MET 1 HE1 MET 1 4.116 1.512 -6.843 9 HE3 MET 1 HE2 MET 1 5.185 0.118 -6.560 10 H ARG 2 H ARG 2 4.613 -2.093 -4.166 11 HA ARG 2 HA ARG 2 6.151 -3.478 -2.186 12 HB2 ARG 2 HB2 ARG 2 6.610 -2.492 -5.010 13 HB3 ARG 2 HB3 ARG 2 8.024 -2.839 -4.023 14 HG2 ARG 2 HG2 ARG 2 7.264 -4.739 -5.443 15 HG3 ARG 2 HG3 ARG 2 7.453 -5.109 -3.720 16 HD2 ARG 2 HD2 ARG 2 5.033 -5.029 -3.391 17 HD3 ARG 2 HD3 ARG 2 4.805 -4.497 -5.061 18 HE ARG 2 HE ARG 2 5.154 -6.629 -5.842 19 HH11 ARG 2 HH11 ARG 2 5.830 -6.653 -2.292 20 HH12 ARG 2 HH12 ARG 2 5.953 -8.370 -2.252 21 HH21 ARG 2 HH21 ARG 2 5.301 -8.893 -5.688 22 HH22 ARG 2 HH22 ARG 2 5.629 -9.660 -4.183 23 H LEU 3 H LEU 3 7.009 -2.591 -0.528 24 HA LEU 3 HA LEU 3 7.188 0.193 0.035 25 HB2 LEU 3 HB2 LEU 3 8.428 -2.314 1.185 26 HB3 LEU 3 HB3 LEU 3 9.088 -0.763 1.665 27 HG LEU 3 HG LEU 3 7.417 -1.743 3.230 28 HD11 LEU 3 HD11 LEU 3 6.719 1.009 2.114 29 HD12 LEU 3 HD12 LEU 3 6.352 0.374 3.731 30 HD13 LEU 3 HD13 LEU 3 8.027 0.639 3.263 31 HD21 LEU 3 HD23 LEU 3 5.044 -1.567 2.801 32 HD22 LEU 3 HD21 LEU 3 5.320 -0.911 1.183 33 HD23 LEU 3 HD22 LEU 3 5.764 -2.582 1.544 34 H SER 4 H SER 4 9.569 -2.125 -1.319 35 HA SER 4 HA SER 4 11.834 -0.514 -1.323 36 HB2 SER 4 HB2 SER 4 12.432 -2.077 -3.314 37 HB3 SER 4 HB3 SER 4 12.132 -2.780 -1.718 38 HG SER 4 HG SER 4 11.036 -3.897 -3.398 39 H ASP 5 H ASP 5 8.978 -0.136 -3.412 40 HA ASP 5 HA ASP 5 10.273 1.256 -5.530 41 HB2 ASP 5 HB2 ASP 5 7.934 0.419 -5.610 42 HB3 ASP 5 HB3 ASP 5 7.471 1.640 -4.418 43 H TYR 6 H TYR 6 9.521 2.230 -2.236 44 HA TYR 6 HA TYR 6 9.690 5.094 -2.903 45 HB2 TYR 6 HB2 TYR 6 8.848 3.615 -0.382 46 HB3 TYR 6 HB3 TYR 6 8.951 5.359 -0.523 47 HD1 TYR 6 HD1 TYR 6 7.473 6.682 -1.894 48 HD2 TYR 6 HD2 TYR 6 6.911 2.406 -1.478 49 HE1 TYR 6 HE1 TYR 6 5.291 6.850 -3.057 50 HE2 TYR 6 HE2 TYR 6 4.692 2.610 -2.510 51 HH TYR 6 HH TYR 6 3.418 5.696 -3.830 52 H PHE 7 H PHE 7 11.858 2.685 -1.544 53 HA PHE 7 HA PHE 7 13.435 4.816 -0.156 54 HB2 PHE 7 HB2 PHE 7 13.639 1.806 0.183 55 HB3 PHE 7 HB3 PHE 7 14.549 3.027 1.057 56 HD1 PHE 7 HD1 PHE 7 11.067 1.951 0.345 57 HD2 PHE 7 HD2 PHE 7 13.710 3.568 3.327 58 HE1 PHE 7 HE1 PHE 7 9.164 2.138 1.897 59 HE2 PHE 7 HE2 PHE 7 11.786 3.800 4.863 60 HZ PHE 7 HZ PHE 7 9.528 3.050 4.179 61 HA PRO 8 HA PRO 8 15.350 4.234 -4.215 62 HB2 PRO 8 HB2 PRO 8 16.975 6.439 -4.340 63 HB3 PRO 8 HB3 PRO 8 15.201 6.465 -4.533 64 HG2 PRO 8 HG2 PRO 8 16.784 7.083 -2.019 65 HG3 PRO 8 HG3 PRO 8 15.455 8.031 -2.747 66 HD2 PRO 8 HD2 PRO 8 15.021 6.267 -0.715 67 HD3 PRO 8 HD3 PRO 8 13.837 6.490 -2.035 68 H GLU 9 H GLU 9 17.948 5.651 -2.251 69 HA GLU 9 HA GLU 9 19.352 3.213 -1.759 70 HB2 GLU 9 HB2 GLU 9 19.984 3.964 -4.227 71 HB3 GLU 9 HB3 GLU 9 20.786 5.315 -3.408 72 HG2 GLU 9 HG2 GLU 9 22.417 3.601 -3.895 73 HG3 GLU 9 HG3 GLU 9 22.211 3.720 -2.153 74 H SER 10 H SER 10 21.234 3.788 -0.408 75 HA SER 10 HA SER 10 22.125 4.722 1.334 76 HB2 SER 10 HB2 SER 10 21.463 7.497 0.327 77 HB3 SER 10 HB3 SER 10 22.879 6.977 1.243 78 HG SER 10 HG SER 10 23.576 5.842 -0.622 79 H SER 11 H SER 11 18.921 4.816 0.913 80 HA SER 11 HA SER 11 17.929 6.789 2.687 81 HB2 SER 11 HB2 SER 11 15.813 5.242 2.150 82 HB3 SER 11 HB3 SER 11 16.523 6.348 0.972 83 HG SER 11 HG SER 11 16.811 3.530 1.096 84 H ILE 12 H ILE 12 19.430 3.829 3.491 85 HA ILE 12 HA ILE 12 17.627 3.389 5.798 86 HB ILE 12 HB ILE 12 19.207 1.505 4.035 87 HG12 ILE 12 HG12 ILE 12 16.269 2.261 4.315 88 HG13 ILE 12 HG13 ILE 12 17.270 2.216 2.865 89 HG21 ILE 12 HG21 ILE 12 17.500 1.010 6.505 90 HG22 ILE 12 HG22 ILE 12 18.252 -0.258 5.492 91 HG23 ILE 12 HG23 ILE 12 19.266 0.844 6.402 92 HD11 ILE 12 HD13 ILE 12 16.184 -0.116 4.421 93 HD12 ILE 12 HD11 ILE 12 15.756 0.396 2.771 94 HD13 ILE 12 HD12 ILE 12 17.377 -0.266 3.090 95 H SER 13 H SER 13 18.648 3.683 7.781 96 HA SER 13 HA SER 13 21.573 3.410 7.888 97 HB2 SER 13 HB2 SER 13 21.624 5.688 9.084 98 HB3 SER 13 HB3 SER 13 21.421 5.690 7.329 99 HG SER 13 HG SER 13 19.982 7.121 8.255 100 H VAL 14 H VAL 14 22.451 3.019 9.872 101 HA VAL 14 HA VAL 14 20.654 2.891 12.229 102 HB VAL 14 HB VAL 14 22.760 0.856 11.424 103 HG11 VAL 14 HG11 VAL 14 22.841 1.193 13.863 104 HG12 VAL 14 HG12 VAL 14 21.074 1.027 13.971 105 HG13 VAL 14 HG13 VAL 14 22.085 -0.359 13.507 106 HG21 VAL 14 HG23 VAL 14 19.746 0.575 11.829 107 HG22 VAL 14 HG21 VAL 14 20.601 0.482 10.277 108 HG23 VAL 14 HG22 VAL 14 20.856 -0.764 11.505 109 H ILE 15 H ILE 15 21.533 3.869 13.943 110 HA ILE 15 HA ILE 15 24.267 5.023 13.827 111 HB ILE 15 HB ILE 15 21.505 6.273 13.837 112 HG12 ILE 15 HG12 ILE 15 24.105 6.736 12.351 113 HG13 ILE 15 HG13 ILE 15 22.548 6.193 11.718 114 HG21 ILE 15 HG21 ILE 15 22.422 7.143 15.865 115 HG22 ILE 15 HG22 ILE 15 23.893 7.704 14.998 116 HG23 ILE 15 HG23 ILE 15 22.279 8.394 14.672 117 HD11 ILE 15 HD13 ILE 15 22.909 8.487 11.054 118 HD12 ILE 15 HD11 ILE 15 21.609 8.481 12.268 119 HD13 ILE 15 HD12 ILE 15 23.257 8.986 12.720 120 H HIS 16 H HIS 16 25.116 5.483 15.955 121 HA HIS 16 HA HIS 16 23.904 3.911 18.095 122 HB2 HIS 16 HB2 HIS 16 26.392 4.219 17.784 123 HB3 HIS 16 HB3 HIS 16 26.203 5.891 18.316 124 HD1 HIS 16 HD1 HIS 16 25.694 2.284 19.665 125 HD2 HIS 16 HD2 HIS 16 26.084 6.273 20.959 126 HE1 HIS 16 HE1 HIS 16 25.855 2.200 22.201 127 H SER 17 H SER 17 24.284 7.449 17.340 128 HA SER 17 HA SER 17 21.865 8.081 18.764 129 HB2 SER 17 HB2 SER 17 23.042 9.810 20.225 130 HB3 SER 17 HB3 SER 17 23.198 8.128 20.747 131 HG SER 17 HG SER 17 25.263 8.105 19.678 132 H ALA 18 H ALA 18 21.249 10.351 18.201 133 HA ALA 18 HA ALA 18 22.656 11.286 15.768 134 HB1 ALA 18 HB3 ALA 18 20.808 12.961 15.703 135 HB2 ALA 18 HB1 ALA 18 20.238 11.302 15.603 136 HB3 ALA 18 HB2 ALA 18 20.093 12.206 17.143 137 H LYS 19 H LYS 19 23.492 13.452 15.754 138 HA LYS 19 HA LYS 19 24.955 14.233 18.040 139 HB2 LYS 19 HB2 LYS 19 25.385 14.760 15.626 140 HB3 LYS 19 HB3 LYS 19 24.157 16.020 15.729 141 HG2 LYS 19 HG2 LYS 19 25.409 17.312 17.297 142 HG3 LYS 19 HG3 LYS 19 26.368 15.919 17.812 143 HD2 LYS 19 HD2 LYS 19 27.797 17.324 16.555 144 HD3 LYS 19 HD3 LYS 19 27.486 15.842 15.636 145 HE2 LYS 19 HE2 LYS 19 25.780 17.075 14.279 146 HE3 LYS 19 HE3 LYS 19 26.109 18.545 15.206 147 HZ1 LYS 19 HZ3 LYS 19 28.063 17.137 13.477 148 HZ2 LYS 19 HZ1 LYS 19 27.300 18.525 13.109 149 HZ3 LYS 19 HZ2 LYS 19 28.377 18.497 14.332 150 H ASP 20 H ASP 20 21.672 15.009 17.014 151 HA ASP 20 HA ASP 20 20.816 16.020 19.550 152 HB2 ASP 20 HB2 ASP 20 21.982 18.088 18.354 153 HB3 ASP 20 HB3 ASP 20 20.658 17.895 17.180 154 H TRP 21 H TRP 21 18.497 16.783 19.210 155 HA TRP 21 HA TRP 21 17.013 14.944 17.569 156 HB2 TRP 21 HB2 TRP 21 15.132 16.569 18.303 157 HB3 TRP 21 HB3 TRP 21 15.873 15.492 19.471 158 HD1 TRP 21 HD1 TRP 21 16.238 19.145 18.340 159 HE1 TRP 21 HE1 TRP 21 16.677 20.649 20.349 160 HE3 TRP 21 HE3 TRP 21 16.839 15.527 21.870 161 HZ2 TRP 21 HZ2 TRP 21 17.233 20.313 23.181 162 HZ3 TRP 21 HZ3 TRP 21 17.419 16.130 24.201 163 HH2 TRP 21 HH2 TRP 21 17.604 18.519 24.873 164 H GLN 22 H GLN 22 18.140 18.332 17.117 165 HA GLN 22 HA GLN 22 16.789 18.859 14.600 166 HB2 GLN 22 HB2 GLN 22 19.479 19.713 15.734 167 HB3 GLN 22 HB3 GLN 22 18.828 20.295 14.200 168 HG2 GLN 22 HG2 GLN 22 16.969 21.365 15.233 169 HG3 GLN 22 HG3 GLN 22 17.229 20.550 16.774 170 HE21 GLN 22 HE22 GLN 22 19.258 21.015 17.962 171 HE22 GLN 22 HE21 GLN 22 19.913 22.653 17.880 172 H GLU 23 H GLU 23 19.949 17.280 15.417 173 HA GLU 23 HA GLU 23 20.625 16.677 12.726 174 HB2 GLU 23 HB2 GLU 23 22.103 16.671 14.895 175 HB3 GLU 23 HB3 GLU 23 21.453 15.042 15.123 176 HG2 GLU 23 HG2 GLU 23 23.439 14.605 14.002 177 HG3 GLU 23 HG3 GLU 23 22.290 14.572 12.696 178 H ALA 24 H ALA 24 18.694 14.934 15.135 179 HA ALA 24 HA ALA 24 18.657 12.432 13.785 180 HB1 ALA 24 HB3 ALA 24 16.876 11.891 15.325 181 HB2 ALA 24 HB1 ALA 24 18.082 12.913 16.153 182 HB3 ALA 24 HB2 ALA 24 16.537 13.612 15.626 183 H ILE 25 H ILE 25 16.605 15.360 13.459 184 HA ILE 25 HA ILE 25 14.856 14.242 11.440 185 HB ILE 25 HB ILE 25 15.747 17.127 11.720 186 HG12 ILE 25 HG12 ILE 25 14.336 15.701 13.730 187 HG13 ILE 25 HG13 ILE 25 14.720 17.413 13.631 188 HG21 ILE 25 HG21 ILE 25 14.661 16.601 9.599 189 HG22 ILE 25 HG22 ILE 25 13.266 15.912 10.447 190 HG23 ILE 25 HG23 ILE 25 13.652 17.647 10.555 191 HD11 ILE 25 HD13 ILE 25 12.203 16.074 12.599 192 HD12 ILE 25 HD11 ILE 25 12.364 17.052 14.071 193 HD13 ILE 25 HD12 ILE 25 12.569 17.820 12.489 194 H ASP 26 H ASP 26 17.950 16.075 11.420 195 HA ASP 26 HA ASP 26 18.228 16.352 8.651 196 HB2 ASP 26 HB2 ASP 26 19.644 17.292 10.646 197 HB3 ASP 26 HB3 ASP 26 20.644 15.860 10.407 198 H PHE 27 H PHE 27 19.395 13.666 10.732 199 HA PHE 27 HA PHE 27 20.335 12.041 8.589 200 HB2 PHE 27 HB2 PHE 27 19.701 11.593 11.515 201 HB3 PHE 27 HB3 PHE 27 20.005 10.222 10.465 202 HD1 PHE 27 HD2 PHE 27 22.106 10.525 8.815 203 HD2 PHE 27 HD1 PHE 27 21.727 12.384 12.721 204 HE1 PHE 27 HE2 PHE 27 24.566 10.703 8.989 205 HE2 PHE 27 HE1 PHE 27 24.172 12.512 12.871 206 HZ PHE 27 HZ PHE 27 25.607 11.691 11.021 207 H SER 28 H SER 28 17.048 12.448 9.971 208 HA SER 28 HA SER 28 15.912 10.131 8.682 209 HB2 SER 28 HB2 SER 28 14.486 12.758 9.380 210 HB3 SER 28 HB3 SER 28 13.743 11.214 9.055 211 HG SER 28 HG SER 28 15.546 11.759 11.211 212 H MET 29 H MET 29 16.950 13.268 7.475 213 HA MET 29 HA MET 29 15.383 12.816 4.965 214 HB2 MET 29 HB2 MET 29 16.409 15.400 6.101 215 HB3 MET 29 HB3 MET 29 15.228 15.153 4.795 216 HG2 MET 29 HG2 MET 29 14.473 14.260 7.554 217 HG3 MET 29 HG3 MET 29 14.554 15.973 7.194 218 HE1 MET 29 HE3 MET 29 12.518 12.909 7.140 219 HE2 MET 29 HE1 MET 29 11.496 13.014 5.684 220 HE3 MET 29 HE2 MET 29 13.260 12.714 5.519 221 H VAL 30 H VAL 30 18.737 13.356 6.081 222 HA VAL 30 HA VAL 30 19.664 14.682 3.836 223 HB VAL 30 HB VAL 30 20.937 14.414 5.911 224 HG11 VAL 30 HG11 VAL 30 20.547 11.962 6.300 225 HG12 VAL 30 HG12 VAL 30 21.650 11.603 4.956 226 HG13 VAL 30 HG13 VAL 30 22.252 12.430 6.407 227 HG21 VAL 30 HG23 VAL 30 22.037 15.141 3.811 228 HG22 VAL 30 HG21 VAL 30 23.150 14.282 4.895 229 HG23 VAL 30 HG22 VAL 30 22.486 13.466 3.461 230 H SER 31 H SER 31 19.190 11.121 4.160 231 HA SER 31 HA SER 31 20.531 10.416 1.809 232 HB2 SER 31 HB2 SER 31 17.991 9.155 2.925 233 HB3 SER 31 HB3 SER 31 19.239 8.383 1.926 234 HG SER 31 HG SER 31 20.158 7.909 3.722 235 H LEU 32 H LEU 32 17.430 12.019 2.222 236 HA LEU 32 HA LEU 32 16.629 11.609 -0.592 237 HB2 LEU 32 HB2 LEU 32 15.379 13.054 1.796 238 HB3 LEU 32 HB3 LEU 32 14.677 13.120 0.207 239 HG LEU 32 HG LEU 32 15.219 10.509 1.682 240 HD11 LEU 32 HD11 LEU 32 12.822 10.461 2.206 241 HD12 LEU 32 HD12 LEU 32 13.608 11.860 2.949 242 HD13 LEU 32 HD13 LEU 32 12.617 12.074 1.490 243 HD21 LEU 32 HD23 LEU 32 14.994 10.354 -0.844 244 HD22 LEU 32 HD21 LEU 32 13.807 9.471 0.072 245 HD23 LEU 32 HD22 LEU 32 13.358 11.026 -0.673 246 H LEU 33 H LEU 33 17.849 14.155 1.617 247 HA LEU 33 HA LEU 33 17.809 16.312 -0.134 248 HB2 LEU 33 HB2 LEU 33 18.411 16.273 2.326 249 HB3 LEU 33 HB3 LEU 33 19.997 15.667 1.865 250 HG LEU 33 HG LEU 33 20.367 17.765 0.532 251 HD11 LEU 33 HD11 LEU 33 18.034 18.449 0.145 252 HD12 LEU 33 HD12 LEU 33 17.810 18.709 1.892 253 HD13 LEU 33 HD13 LEU 33 18.942 19.707 0.949 254 HD21 LEU 33 HD23 LEU 33 20.927 19.110 2.441 255 HD22 LEU 33 HD21 LEU 33 19.813 18.190 3.477 256 HD23 LEU 33 HD22 LEU 33 21.259 17.421 2.799 257 H ASP 34 H ASP 34 20.240 13.759 0.283 258 HA ASP 34 HA ASP 34 22.290 14.824 -1.284 259 HB2 ASP 34 HB2 ASP 34 22.697 13.116 0.382 260 HB3 ASP 34 HB3 ASP 34 21.563 12.007 -0.379 261 H LYS 35 H LYS 35 19.492 13.053 -2.358 262 HA LYS 35 HA LYS 35 20.615 13.179 -5.141 263 HB2 LYS 35 HB2 LYS 35 18.314 11.404 -4.392 264 HB3 LYS 35 HB3 LYS 35 19.191 11.477 -5.899 265 HG2 LYS 35 HG2 LYS 35 19.970 9.526 -4.973 266 HG3 LYS 35 HG3 LYS 35 21.259 10.668 -4.550 267 HD2 LYS 35 HD2 LYS 35 20.439 10.814 -2.265 268 HD3 LYS 35 HD3 LYS 35 18.926 10.020 -2.701 269 HE2 LYS 35 HE2 LYS 35 20.266 8.538 -1.433 270 HE3 LYS 35 HE3 LYS 35 20.094 7.909 -3.068 271 HZ1 LYS 35 HZ3 LYS 35 22.338 8.516 -3.533 272 HZ2 LYS 35 HZ1 LYS 35 22.478 9.463 -2.206 273 HZ3 LYS 35 HZ2 LYS 35 22.391 7.822 -2.045 274 H ASN 36 H ASN 36 19.348 15.270 -3.417 275 HA ASN 36 HA ASN 36 17.756 16.788 -3.404 276 HB2 ASN 36 HB2 ASN 36 17.327 18.034 -5.517 277 HB3 ASN 36 HB3 ASN 36 18.977 17.870 -4.969 278 HD21 ASN 36 HD22 ASN 36 20.384 16.421 -6.030 279 HD22 ASN 36 HD21 ASN 36 20.143 15.987 -7.713 280 H TYR 37 H TYR 37 16.479 14.406 -2.986 281 HA TYR 37 HA TYR 37 13.937 14.392 -4.472 282 HB2 TYR 37 HB2 TYR 37 14.921 13.127 -1.896 283 HB3 TYR 37 HB3 TYR 37 13.223 13.122 -2.301 284 HD1 TYR 37 HD2 TYR 37 16.538 11.675 -3.151 285 HD2 TYR 37 HD1 TYR 37 12.290 11.602 -3.890 286 HE1 TYR 37 HE2 TYR 37 16.830 9.726 -4.661 287 HE2 TYR 37 HE1 TYR 37 12.595 9.691 -5.441 288 HH TYR 37 HH TYR 37 14.105 8.278 -6.489 289 H ILE 38 H ILE 38 15.431 16.326 -2.057 290 HA ILE 38 HA ILE 38 13.010 17.937 -1.612 291 HB ILE 38 HB ILE 38 13.563 18.028 0.830 292 HG12 ILE 38 HG12 ILE 38 15.447 15.708 0.216 293 HG13 ILE 38 HG13 ILE 38 15.939 17.351 0.641 294 HG21 ILE 38 HG21 ILE 38 12.590 15.926 1.533 295 HG22 ILE 38 HG22 ILE 38 11.764 16.496 0.090 296 HG23 ILE 38 HG23 ILE 38 12.955 15.173 -0.024 297 HD11 ILE 38 HD13 ILE 38 16.201 15.956 2.503 298 HD12 ILE 38 HD11 ILE 38 14.867 17.096 2.844 299 HD13 ILE 38 HD12 ILE 38 14.535 15.382 2.451 300 H SER 39 H SER 39 13.687 20.007 -0.513 301 HA SER 39 HA SER 39 16.477 20.889 -1.102 302 HB2 SER 39 HB2 SER 39 13.943 22.506 -0.555 303 HB3 SER 39 HB3 SER 39 15.532 23.156 -0.996 304 HG SER 39 HG SER 39 14.127 23.024 -2.788 305 H GLU 40 H GLU 40 17.444 22.294 0.664 306 HA GLU 40 HA GLU 40 17.375 20.940 3.128 307 HB2 GLU 40 HB2 GLU 40 18.404 23.728 2.462 308 HB3 GLU 40 HB3 GLU 40 18.742 22.859 3.966 309 HG2 GLU 40 HG2 GLU 40 19.813 21.024 2.664 310 HG3 GLU 40 HG3 GLU 40 19.535 21.912 1.174 311 H ASN 41 H ASN 41 15.495 23.783 2.117 312 HA ASN 41 HA ASN 41 14.563 24.665 4.636 313 HB2 ASN 41 HB2 ASN 41 14.119 25.873 2.521 314 HB3 ASN 41 HB3 ASN 41 13.068 24.563 1.969 315 HD21 ASN 41 HD22 ASN 41 10.898 24.348 2.916 316 HD22 ASN 41 HD21 ASN 41 10.266 25.618 3.933 317 H TYR 42 H TYR 42 13.525 21.880 2.680 318 HA TYR 42 HA TYR 42 11.035 21.334 3.923 319 HB2 TYR 42 HB2 TYR 42 11.936 20.370 1.790 320 HB3 TYR 42 HB3 TYR 42 13.113 19.456 2.724 321 HD1 TYR 42 HD2 TYR 42 9.519 19.821 1.971 322 HD2 TYR 42 HD1 TYR 42 12.564 17.426 3.866 323 HE1 TYR 42 HE2 TYR 42 7.953 17.885 2.058 324 HE2 TYR 42 HE1 TYR 42 11.008 15.504 3.970 325 HH TYR 42 HH TYR 42 8.926 14.676 3.392 326 H ILE 43 H ILE 43 14.353 20.252 4.636 327 HA ILE 43 HA ILE 43 13.824 18.528 6.811 328 HB ILE 43 HB ILE 43 16.318 20.150 6.263 329 HG12 ILE 43 HG12 ILE 43 15.228 17.527 5.163 330 HG13 ILE 43 HG13 ILE 43 15.653 18.975 4.242 331 HG21 ILE 43 HG21 ILE 43 16.090 19.026 8.536 332 HG22 ILE 43 HG22 ILE 43 16.007 17.476 7.695 333 HG23 ILE 43 HG23 ILE 43 17.461 18.484 7.561 334 HD11 ILE 43 HD13 ILE 43 17.995 18.683 4.788 335 HD12 ILE 43 HD11 ILE 43 17.598 17.172 5.652 336 HD13 ILE 43 HD12 ILE 43 17.276 17.300 3.912 337 H GLN 44 H GLN 44 14.762 22.025 6.661 338 HA GLN 44 HA GLN 44 14.717 22.281 9.487 339 HB2 GLN 44 HB2 GLN 44 15.981 23.716 7.720 340 HB3 GLN 44 HB3 GLN 44 14.492 24.652 7.620 341 HG2 GLN 44 HG2 GLN 44 16.050 25.684 9.220 342 HG3 GLN 44 HG3 GLN 44 14.639 25.097 10.086 343 HE21 GLN 44 HE22 GLN 44 15.227 24.139 12.062 344 HE22 GLN 44 HE21 GLN 44 16.631 23.134 12.303 345 H ALA 45 H ALA 45 12.116 22.645 7.124 346 HA ALA 45 HA ALA 45 10.243 23.989 8.740 347 HB1 ALA 45 HB3 ALA 45 9.658 21.675 6.823 348 HB2 ALA 45 HB1 ALA 45 8.524 22.901 7.382 349 HB3 ALA 45 HB2 ALA 45 9.876 23.376 6.333 350 H ILE 46 H ILE 46 11.138 20.485 8.670 351 HA ILE 46 HA ILE 46 9.111 19.741 10.584 352 HB ILE 46 HB ILE 46 11.697 18.286 9.939 353 HG12 ILE 46 HG12 ILE 46 9.060 17.814 8.531 354 HG13 ILE 46 HG13 ILE 46 10.348 18.778 7.838 355 HG21 ILE 46 HG21 ILE 46 10.350 17.575 11.968 356 HG22 ILE 46 HG22 ILE 46 8.989 17.229 10.890 357 HG23 ILE 46 HG23 ILE 46 10.504 16.309 10.756 358 HD11 ILE 46 HD13 ILE 46 10.662 15.835 8.547 359 HD12 ILE 46 HD11 ILE 46 10.457 16.519 6.932 360 HD13 ILE 46 HD12 ILE 46 11.905 16.900 7.884 361 H LYS 47 H LYS 47 12.679 20.410 10.744 362 HA LYS 47 HA LYS 47 12.956 19.824 13.480 363 HB2 LYS 47 HB2 LYS 47 14.368 21.855 11.711 364 HB3 LYS 47 HB3 LYS 47 14.927 21.488 13.343 365 HG2 LYS 47 HG2 LYS 47 15.612 19.278 12.717 366 HG3 LYS 47 HG3 LYS 47 14.800 19.400 11.139 367 HD2 LYS 47 HD2 LYS 47 16.272 21.148 10.429 368 HD3 LYS 47 HD3 LYS 47 17.083 21.207 12.011 369 HE2 LYS 47 HE2 LYS 47 18.137 19.088 11.630 370 HE3 LYS 47 HE3 LYS 47 17.154 18.766 10.206 371 HZ1 LYS 47 HZ3 LYS 47 18.276 20.774 9.198 372 HZ2 LYS 47 HZ1 LYS 47 19.276 20.821 10.481 373 HZ3 LYS 47 HZ2 LYS 47 19.292 19.526 9.473 374 H ASP 48 H ASP 48 12.205 22.976 11.893 375 HA ASP 48 HA ASP 48 12.198 24.543 14.247 376 HB2 ASP 48 HB2 ASP 48 12.378 25.508 12.015 377 HB3 ASP 48 HB3 ASP 48 10.772 24.908 11.585 378 H SER 49 H SER 49 9.505 22.866 12.528 379 HA SER 49 HA SER 49 7.422 23.727 14.279 380 HB2 SER 49 HB2 SER 49 7.637 21.111 12.723 381 HB3 SER 49 HB3 SER 49 6.161 21.880 13.332 382 HG SER 49 HG SER 49 7.875 22.695 11.242 383 H THR 50 H THR 50 9.588 20.864 14.365 384 HA THR 50 HA THR 50 8.502 19.656 16.655 385 HB THR 50 HB THR 50 11.309 19.541 15.495 386 HG1 THR 50 HG1 THR 50 9.877 18.891 14.003 387 HG21 THR 50 HG23 THR 50 11.320 17.246 16.505 388 HG22 THR 50 HG21 THR 50 11.435 18.565 17.684 389 HG23 THR 50 HG22 THR 50 9.898 17.703 17.464 390 H ILE 51 H ILE 51 11.136 22.116 16.394 391 HA ILE 51 HA ILE 51 11.654 22.220 19.212 392 HB ILE 51 HB ILE 51 12.108 24.154 16.911 393 HG12 ILE 51 HG12 ILE 51 14.134 22.553 18.542 394 HG13 ILE 51 HG13 ILE 51 13.378 21.900 17.099 395 HG21 ILE 51 HG21 ILE 51 13.626 25.445 18.403 396 HG22 ILE 51 HG22 ILE 51 11.962 25.536 18.944 397 HG23 ILE 51 HG23 ILE 51 13.100 24.458 19.783 398 HD11 ILE 51 HD13 ILE 51 15.158 24.365 17.196 399 HD12 ILE 51 HD11 ILE 51 15.520 22.787 16.492 400 HD13 ILE 51 HD12 ILE 51 14.270 23.805 15.756 401 H ASN 52 H ASN 52 9.363 23.989 17.095 402 HA ASN 52 HA ASN 52 8.616 25.935 19.036 403 HB2 ASN 52 HB2 ASN 52 7.503 24.980 16.391 404 HB3 ASN 52 HB3 ASN 52 6.416 25.866 17.419 405 HD21 ASN 52 HD22 ASN 52 9.570 26.097 15.770 406 HD22 ASN 52 HD21 ASN 52 9.636 27.844 15.752 407 H ASN 53 H ASN 53 7.125 22.793 18.193 408 HA ASN 53 HA ASN 53 5.191 23.148 20.464 409 HB2 ASN 53 HB2 ASN 53 4.445 24.028 18.202 410 HB3 ASN 53 HB3 ASN 53 4.649 22.396 17.577 411 HD21 ASN 53 HD21 ASN 53 2.522 22.565 16.896 412 HD22 ASN 53 HD22 ASN 53 1.156 22.323 17.982 413 H GLY 54 H GLY 54 7.577 21.182 19.516 414 HA2 GLY 54 HA2 GLY 54 8.045 18.998 20.166 415 HA3 GLY 54 HA3 GLY 54 6.345 18.705 20.557 416 HA PRO 55 HA PRO 55 7.793 17.187 16.277 417 HB2 PRO 55 HB2 PRO 55 7.513 14.447 16.603 418 HB3 PRO 55 HB3 PRO 55 8.999 15.365 16.977 419 HG2 PRO 55 HG2 PRO 55 6.806 14.506 18.870 420 HG3 PRO 55 HG3 PRO 55 8.582 14.371 19.069 421 HD2 PRO 55 HD2 PRO 55 7.135 16.391 20.209 422 HD3 PRO 55 HD3 PRO 55 8.771 16.707 19.557 423 H TYR 56 H TYR 56 6.573 16.235 14.563 424 HA TYR 56 HA TYR 56 3.633 16.538 15.013 425 HB2 TYR 56 HB2 TYR 56 5.531 17.331 12.795 426 HB3 TYR 56 HB3 TYR 56 3.843 17.049 12.432 427 HD1 TYR 56 HD2 TYR 56 5.908 18.946 14.955 428 HD2 TYR 56 HD1 TYR 56 2.371 18.834 12.494 429 HE1 TYR 56 HE2 TYR 56 5.267 21.182 15.784 430 HE2 TYR 56 HE1 TYR 56 1.750 21.104 13.266 431 HH TYR 56 HH TYR 56 2.359 22.928 14.579 432 H TYR 57 H TYR 57 5.922 14.136 14.234 433 HA TYR 57 HA TYR 57 3.918 12.478 12.793 434 HB2 TYR 57 HB2 TYR 57 6.720 13.146 11.904 435 HB3 TYR 57 HB3 TYR 57 5.812 11.733 11.369 436 HD1 TYR 57 HD2 TYR 57 3.852 11.881 9.948 437 HD2 TYR 57 HD1 TYR 57 5.980 15.439 11.160 438 HE1 TYR 57 HE2 TYR 57 2.591 13.192 8.278 439 HE2 TYR 57 HE1 TYR 57 4.745 16.752 9.466 440 HH TYR 57 HH TYR 57 2.170 15.324 7.408 441 H ILE 58 H ILE 58 3.626 11.503 14.897 442 HA ILE 58 HA ILE 58 5.794 9.641 15.720 443 HB ILE 58 HB ILE 58 3.878 11.125 17.561 444 HG12 ILE 58 HG12 ILE 58 5.603 12.689 16.849 445 HG13 ILE 58 HG13 ILE 58 5.785 12.257 18.531 446 HG21 ILE 58 HG21 ILE 58 6.037 9.054 18.165 447 HG22 ILE 58 HG22 ILE 58 5.242 10.068 19.393 448 HG23 ILE 58 HG23 ILE 58 4.298 8.917 18.448 449 HD11 ILE 58 HD13 ILE 58 7.985 12.343 17.543 450 HD12 ILE 58 HD11 ILE 58 7.632 10.649 17.864 451 HD13 ILE 58 HD12 ILE 58 7.495 11.286 16.218 452 H LEU 59 H LEU 59 4.995 7.557 16.102 453 HA LEU 59 HA LEU 59 2.130 7.121 15.315 454 HB2 LEU 59 HB2 LEU 59 4.605 5.741 14.276 455 HB3 LEU 59 HB3 LEU 59 2.959 5.157 14.074 456 HG LEU 59 HG LEU 59 2.636 7.807 13.325 457 HD11 LEU 59 HD11 LEU 59 5.366 6.970 12.268 458 HD12 LEU 59 HD12 LEU 59 4.443 8.442 11.856 459 HD13 LEU 59 HD13 LEU 59 5.074 8.228 13.475 460 HD21 LEU 59 HD23 LEU 59 2.411 6.996 11.088 461 HD22 LEU 59 HD21 LEU 59 3.310 5.508 11.490 462 HD23 LEU 59 HD22 LEU 59 1.737 5.854 12.250 463 H ALA 60 H ALA 60 4.838 6.078 17.333 464 HA ALA 60 HA ALA 60 3.115 4.546 19.049 465 HB1 ALA 60 HB3 ALA 60 3.551 2.814 17.299 466 HB2 ALA 60 HB1 ALA 60 5.297 3.099 17.446 467 HB3 ALA 60 HB2 ALA 60 4.401 2.398 18.792 468 HA PRO 61 HA PRO 61 6.454 5.893 21.753 469 HB2 PRO 61 HB2 PRO 61 6.882 3.685 23.403 470 HB3 PRO 61 HB3 PRO 61 5.583 4.904 23.606 471 HG2 PRO 61 HG2 PRO 61 5.418 2.193 22.275 472 HG3 PRO 61 HG3 PRO 61 4.269 2.940 23.432 473 HD2 PRO 61 HD2 PRO 61 3.791 2.981 20.781 474 HD3 PRO 61 HD3 PRO 61 3.431 4.418 21.775 475 H GLY 62 H GLY 62 8.377 6.157 20.785 476 HA2 GLY 62 HA2 GLY 62 10.602 5.460 20.434 477 HA3 GLY 62 HA3 GLY 62 10.077 3.806 20.181 478 H VAL 63 H VAL 63 7.886 5.573 18.337 479 HA VAL 63 HA VAL 63 9.573 5.249 15.891 480 HB VAL 63 HB VAL 63 6.674 4.440 16.313 481 HG11 VAL 63 HG11 VAL 63 8.526 3.828 13.980 482 HG12 VAL 63 HG12 VAL 63 6.847 3.281 14.146 483 HG13 VAL 63 HG13 VAL 63 7.192 4.997 13.946 484 HG21 VAL 63 HG23 VAL 63 9.156 2.666 16.183 485 HG22 VAL 63 HG21 VAL 63 8.112 2.910 17.604 486 HG23 VAL 63 HG22 VAL 63 7.472 2.099 16.193 487 H ALA 64 H ALA 64 9.566 6.920 14.547 488 HA ALA 64 HA ALA 64 7.348 8.880 14.522 489 HB1 ALA 64 HB3 ALA 64 8.996 10.702 14.335 490 HB2 ALA 64 HB1 ALA 64 9.300 9.786 15.815 491 HB3 ALA 64 HB2 ALA 64 10.325 9.533 14.377 492 H MET 65 H MET 65 7.470 10.223 12.502 493 HA MET 65 HA MET 65 8.630 8.779 10.207 494 HB2 MET 65 HB2 MET 65 6.368 7.955 10.574 495 HB3 MET 65 HB3 MET 65 5.743 9.595 10.345 496 HG2 MET 65 HG2 MET 65 7.241 9.235 8.059 497 HG3 MET 65 HG3 MET 65 6.763 7.582 8.410 498 HE1 MET 65 HE3 MET 65 3.617 8.496 9.808 499 HE2 MET 65 HE1 MET 65 2.845 7.823 8.350 500 HE3 MET 65 HE2 MET 65 4.232 6.999 9.072 501 HA PRO 66 HA PRO 66 8.904 13.555 10.306 502 HB2 PRO 66 HB2 PRO 66 11.683 12.752 9.325 503 HB3 PRO 66 HB3 PRO 66 11.223 14.222 10.237 504 HG2 PRO 66 HG2 PRO 66 12.278 12.134 11.561 505 HG3 PRO 66 HG3 PRO 66 10.827 12.945 12.231 506 HD2 PRO 66 HD2 PRO 66 10.979 10.374 10.654 507 HD3 PRO 66 HD3 PRO 66 10.030 10.757 12.114 508 H HIS 67 H HIS 67 8.610 14.842 8.617 509 HA HIS 67 HA HIS 67 8.893 14.560 5.837 510 HB2 HIS 67 HB2 HIS 67 7.495 12.655 5.729 511 HB3 HIS 67 HB3 HIS 67 6.518 13.166 7.090 512 HD1 HIS 67 HD1 HIS 67 4.451 14.735 6.638 513 HD2 HIS 67 HD2 HIS 67 6.680 13.710 3.204 514 HE1 HIS 67 HE1 HIS 67 2.991 15.259 4.630 515 H ALA 68 H ALA 68 7.631 16.325 4.818 516 HA ALA 68 HA ALA 68 6.066 18.104 6.556 517 HB1 ALA 68 HB3 ALA 68 8.308 19.138 6.601 518 HB2 ALA 68 HB1 ALA 68 8.380 19.079 4.828 519 HB3 ALA 68 HB2 ALA 68 7.177 20.099 5.643 520 H ARG 69 H ARG 69 4.713 19.537 5.091 521 HA ARG 69 HA ARG 69 3.523 17.908 3.087 522 HB2 ARG 69 HB2 ARG 69 3.354 20.861 3.778 523 HB3 ARG 69 HB3 ARG 69 2.452 20.224 2.398 524 HG2 ARG 69 HG2 ARG 69 2.200 19.117 5.229 525 HG3 ARG 69 HG3 ARG 69 1.150 20.380 4.580 526 HD2 ARG 69 HD2 ARG 69 0.200 18.928 2.939 527 HD3 ARG 69 HD3 ARG 69 1.457 17.710 3.175 528 HE ARG 69 HE ARG 69 -0.272 18.351 5.480 529 HH11 ARG 69 HH21 ARG 69 0.383 16.092 2.820 530 HH12 ARG 69 HH22 ARG 69 -0.252 14.708 3.639 531 HH21 ARG 69 HH11 ARG 69 -1.255 16.535 6.515 532 HH22 ARG 69 HH12 ARG 69 -1.315 15.006 5.724 533 HA PRO 70 HA PRO 70 6.074 18.068 -0.408 534 HB2 PRO 70 HB2 PRO 70 3.635 19.153 -1.901 535 HB3 PRO 70 HB3 PRO 70 4.810 17.938 -2.462 536 HG2 PRO 70 HG2 PRO 70 2.448 17.145 -1.411 537 HG3 PRO 70 HG3 PRO 70 3.946 16.309 -0.892 538 HD2 PRO 70 HD2 PRO 70 2.370 18.419 0.572 539 HD3 PRO 70 HD3 PRO 70 3.209 16.968 1.203 540 H GLU 71 H GLU 71 3.908 20.927 -0.141 541 HA GLU 71 HA GLU 71 5.331 22.765 -1.707 542 HB2 GLU 71 HB2 GLU 71 3.538 23.254 0.713 543 HB3 GLU 71 HB3 GLU 71 3.959 24.459 -0.501 544 HG2 GLU 71 HG2 GLU 71 2.330 21.926 -0.982 545 HG3 GLU 71 HG3 GLU 71 1.700 23.557 -0.839 546 H CYS 72 H CYS 72 6.307 21.510 1.364 547 HA CYS 72 HA CYS 72 7.665 23.942 2.284 548 HB2 CYS 72 HB2 CYS 72 7.743 21.067 3.305 549 HB3 CYS 72 HB3 CYS 72 8.461 22.472 4.107 550 HG CYS 72 HG CYS 72 6.242 23.839 4.366 551 H GLY 73 H GLY 73 8.342 21.778 -0.187 552 HA2 GLY 73 HA2 GLY 73 10.412 22.537 -1.334 553 HA3 GLY 73 HA3 GLY 73 11.302 22.182 0.149 554 H ALA 74 H ALA 74 8.688 19.965 -0.861 555 HA ALA 74 HA ALA 74 10.660 17.832 -1.321 556 HB1 ALA 74 HB3 ALA 74 7.693 17.889 -1.942 557 HB2 ALA 74 HB1 ALA 74 8.750 16.467 -1.902 558 HB3 ALA 74 HB2 ALA 74 8.390 17.332 -0.392 559 H LEU 75 H LEU 75 11.141 16.945 -3.323 560 HA LEU 75 HA LEU 75 10.494 18.590 -5.738 561 HB2 LEU 75 HB2 LEU 75 13.140 17.301 -4.990 562 HB3 LEU 75 HB3 LEU 75 12.812 18.171 -6.479 563 HG LEU 75 HG LEU 75 12.808 19.404 -3.686 564 HD11 LEU 75 HD11 LEU 75 14.864 19.523 -5.940 565 HD12 LEU 75 HD12 LEU 75 14.934 20.455 -4.429 566 HD13 LEU 75 HD13 LEU 75 15.047 18.696 -4.380 567 HD21 LEU 75 HD23 LEU 75 12.624 20.717 -6.444 568 HD22 LEU 75 HD21 LEU 75 11.331 20.660 -5.226 569 HD23 LEU 75 HD22 LEU 75 12.802 21.574 -4.896 570 H LYS 76 H LYS 76 11.243 15.387 -4.360 571 HA LYS 76 HA LYS 76 9.955 14.100 -6.657 572 HB2 LYS 76 HB2 LYS 76 12.578 13.180 -5.483 573 HB3 LYS 76 HB3 LYS 76 11.748 12.456 -6.856 574 HG2 LYS 76 HG2 LYS 76 12.337 14.444 -8.222 575 HG3 LYS 76 HG3 LYS 76 13.042 15.225 -6.790 576 HD2 LYS 76 HD2 LYS 76 14.643 13.275 -6.587 577 HD3 LYS 76 HD3 LYS 76 14.092 12.746 -8.195 578 HE2 LYS 76 HE2 LYS 76 14.787 14.903 -9.164 579 HE3 LYS 76 HE3 LYS 76 15.146 15.539 -7.554 580 HZ1 LYS 76 HZ3 LYS 76 17.150 14.926 -8.537 581 HZ2 LYS 76 HZ1 LYS 76 16.896 13.847 -7.357 582 HZ3 LYS 76 HZ2 LYS 76 16.650 13.403 -8.931 583 H THR 77 H THR 77 9.078 11.963 -6.006 584 HA THR 77 HA THR 77 8.557 11.815 -3.200 585 HB THR 77 HB THR 77 7.702 10.229 -5.638 586 HG1 THR 77 HG1 THR 77 6.194 11.651 -5.847 587 HG21 THR 77 HG23 THR 77 5.878 9.368 -4.287 588 HG22 THR 77 HG21 THR 77 7.404 8.951 -3.514 589 HG23 THR 77 HG22 THR 77 6.439 10.305 -2.871 590 H GLY 78 H GLY 78 9.577 10.515 -1.716 591 HA2 GLY 78 HA2 GLY 78 10.859 8.034 -2.369 592 HA3 GLY 78 HA3 GLY 78 12.042 9.339 -2.175 593 H MET 79 H MET 79 12.371 7.477 -0.327 594 HA MET 79 HA MET 79 11.232 8.548 2.185 595 HB2 MET 79 HB2 MET 79 10.997 5.717 1.073 596 HB3 MET 79 HB3 MET 79 10.953 6.046 2.780 597 HG2 MET 79 HG2 MET 79 9.088 7.725 2.327 598 HG3 MET 79 HG3 MET 79 9.020 7.108 0.688 599 HE1 MET 79 HE3 MET 79 9.634 5.549 4.207 600 HE2 MET 79 HE1 MET 79 8.311 6.706 4.388 601 HE3 MET 79 HE2 MET 79 8.060 4.959 4.634 602 H SER 80 H SER 80 12.181 7.465 4.097 603 HA SER 80 HA SER 80 14.923 6.440 3.798 604 HB2 SER 80 HB2 SER 80 14.312 8.475 5.941 605 HB3 SER 80 HB3 SER 80 15.882 7.940 5.350 606 HG SER 80 HG SER 80 15.027 10.092 4.782 607 H LEU 81 H LEU 81 15.598 5.341 5.816 608 HA LEU 81 HA LEU 81 13.583 4.770 7.875 609 HB2 LEU 81 HB2 LEU 81 13.446 3.048 6.070 610 HB3 LEU 81 HB3 LEU 81 15.174 2.742 6.207 611 HG LEU 81 HG LEU 81 14.927 1.787 8.392 612 HD11 LEU 81 HD11 LEU 81 12.727 1.475 9.454 613 HD12 LEU 81 HD12 LEU 81 13.073 3.191 9.310 614 HD13 LEU 81 HD13 LEU 81 11.962 2.394 8.165 615 HD21 LEU 81 HD23 LEU 81 12.714 0.794 6.561 616 HD22 LEU 81 HD21 LEU 81 14.423 0.492 6.260 617 HD23 LEU 81 HD22 LEU 81 13.635 -0.187 7.713 618 H THR 82 H THR 82 14.769 5.791 9.541 619 HA THR 82 HA THR 82 17.668 5.153 9.830 620 HB THR 82 HB THR 82 15.950 7.510 10.745 621 HG1 THR 82 HG1 THR 82 17.873 7.192 8.673 622 HG21 THR 82 HG23 THR 82 18.947 7.049 11.006 623 HG22 THR 82 HG21 THR 82 18.122 8.614 11.253 624 HG23 THR 82 HG22 THR 82 17.745 7.242 12.302 625 H LEU 83 H LEU 83 18.356 4.201 11.755 626 HA LEU 83 HA LEU 83 16.436 4.142 14.030 627 HB2 LEU 83 HB2 LEU 83 16.671 1.893 12.881 628 HB3 LEU 83 HB3 LEU 83 18.390 1.953 13.285 629 HG LEU 83 HG LEU 83 17.588 2.238 15.764 630 HD11 LEU 83 HD11 LEU 83 15.410 1.308 16.305 631 HD12 LEU 83 HD12 LEU 83 15.204 2.705 15.252 632 HD13 LEU 83 HD13 LEU 83 15.016 1.058 14.588 633 HD21 LEU 83 HD23 LEU 83 17.357 -0.190 16.054 634 HD22 LEU 83 HD21 LEU 83 17.135 -0.362 14.303 635 HD23 LEU 83 HD22 LEU 83 18.678 0.223 14.950 636 H LEU 84 H LEU 84 17.319 4.691 15.966 637 HA LEU 84 HA LEU 84 20.252 5.259 16.211 638 HB2 LEU 84 HB2 LEU 84 17.773 6.600 17.322 639 HB3 LEU 84 HB3 LEU 84 19.324 6.707 18.157 640 HG LEU 84 HG LEU 84 20.332 7.975 16.440 641 HD11 LEU 84 HD11 LEU 84 19.435 7.054 14.394 642 HD12 LEU 84 HD12 LEU 84 17.791 7.584 14.819 643 HD13 LEU 84 HD13 LEU 84 19.061 8.776 14.441 644 HD21 LEU 84 HD23 LEU 84 18.997 9.133 18.096 645 HD22 LEU 84 HD21 LEU 84 18.794 9.960 16.542 646 HD23 LEU 84 HD22 LEU 84 17.513 8.906 17.140 647 H GLU 85 H GLU 85 21.163 3.795 17.709 648 HA GLU 85 HA GLU 85 19.446 2.005 19.116 649 HB2 GLU 85 HB2 GLU 85 22.423 2.469 19.056 650 HB3 GLU 85 HB3 GLU 85 21.741 1.382 20.265 651 HG2 GLU 85 HG2 GLU 85 21.111 1.068 17.301 652 HG3 GLU 85 HG3 GLU 85 22.524 0.341 18.057 653 H GLN 86 H GLN 86 21.131 4.931 20.141 654 HA GLN 86 HA GLN 86 20.255 4.684 22.939 655 HB2 GLN 86 HB2 GLN 86 21.403 7.002 21.329 656 HB3 GLN 86 HB3 GLN 86 21.057 7.098 23.035 657 HG2 GLN 86 HG2 GLN 86 22.971 5.046 21.835 658 HG3 GLN 86 HG3 GLN 86 23.479 6.604 22.475 659 HE21 GLN 86 HE22 GLN 86 24.700 4.474 23.534 660 HE22 GLN 86 HE21 GLN 86 24.113 4.129 25.153 661 H GLY 87 H GLY 87 18.927 5.773 19.921 662 HA2 GLY 87 HA2 GLY 87 17.053 6.974 19.345 663 HA3 GLY 87 HA3 GLY 87 16.470 6.815 21.012 664 H VAL 88 H VAL 88 15.862 9.163 20.238 665 HA VAL 88 HA VAL 88 17.584 10.802 21.872 666 HB VAL 88 HB VAL 88 18.298 11.121 19.321 667 HG11 VAL 88 HG11 VAL 88 17.164 12.855 18.162 668 HG12 VAL 88 HG12 VAL 88 16.034 11.525 18.447 669 HG13 VAL 88 HG13 VAL 88 15.933 13.013 19.420 670 HG21 VAL 88 HG23 VAL 88 17.912 13.446 21.189 671 HG22 VAL 88 HG21 VAL 88 19.248 12.262 21.183 672 HG23 VAL 88 HG22 VAL 88 19.015 13.340 19.799 673 H TYR 89 H TYR 89 16.267 12.942 22.313 674 HA TYR 89 HA TYR 89 13.411 12.107 22.538 675 HB2 TYR 89 HB2 TYR 89 14.853 11.598 24.553 676 HB3 TYR 89 HB3 TYR 89 15.032 13.320 24.784 677 HD1 TYR 89 HD2 TYR 89 11.676 13.124 23.636 678 HD2 TYR 89 HD1 TYR 89 14.161 11.981 27.001 679 HE1 TYR 89 HE2 TYR 89 9.710 13.074 25.080 680 HE2 TYR 89 HE1 TYR 89 12.163 11.952 28.455 681 HH TYR 89 HH TYR 89 8.875 12.719 27.229 682 H PHE 90 H PHE 90 12.712 13.437 20.986 683 HA PHE 90 HA PHE 90 13.289 16.073 20.439 684 HB2 PHE 90 HB2 PHE 90 10.683 14.533 20.419 685 HB3 PHE 90 HB3 PHE 90 10.849 16.135 19.692 686 HD1 PHE 90 HD2 PHE 90 13.022 16.354 18.091 687 HD2 PHE 90 HD1 PHE 90 10.809 12.734 18.857 688 HE1 PHE 90 HE2 PHE 90 13.869 15.393 15.975 689 HE2 PHE 90 HE1 PHE 90 11.636 11.789 16.712 690 HZ PHE 90 HZ PHE 90 13.166 13.120 15.270 691 HA PRO 91 HA PRO 91 12.506 18.389 23.927 692 HB2 PRO 91 HB2 PRO 91 11.690 20.874 22.980 693 HB3 PRO 91 HB3 PRO 91 13.339 20.202 22.819 694 HG2 PRO 91 HG2 PRO 91 11.066 20.040 20.802 695 HG3 PRO 91 HG3 PRO 91 12.752 20.614 20.527 696 HD2 PRO 91 HD2 PRO 91 12.065 18.102 19.921 697 HD3 PRO 91 HD3 PRO 91 13.614 18.405 20.765 698 H GLY 92 H GLY 92 9.611 17.473 22.364 699 HA2 GLY 92 HA2 GLY 92 8.114 18.168 24.804 700 HA3 GLY 92 HA3 GLY 92 7.530 18.897 23.299 701 H ASN 93 H ASN 93 8.992 15.617 23.294 702 HA ASN 93 HA ASN 93 6.410 14.599 22.305 703 HB2 ASN 93 HB2 ASN 93 8.726 14.155 21.274 704 HB3 ASN 93 HB3 ASN 93 9.013 13.075 22.638 705 HD21 ASN 93 HD22 ASN 93 9.077 11.220 21.296 706 HD22 ASN 93 HD21 ASN 93 7.698 10.663 20.361 707 H ASP 94 H ASP 94 5.819 12.313 23.063 708 HA ASP 94 HA ASP 94 5.433 12.253 25.907 709 HB2 ASP 94 HB2 ASP 94 3.856 11.225 24.324 710 HB3 ASP 94 HB3 ASP 94 5.097 10.071 23.822 711 H GLU 95 H GLU 95 7.648 10.486 23.738 712 HA GLU 95 HA GLU 95 9.543 10.032 25.897 713 HB2 GLU 95 HB2 GLU 95 9.153 7.865 26.274 714 HB3 GLU 95 HB3 GLU 95 7.553 8.255 25.686 715 HG2 GLU 95 HG2 GLU 95 7.963 7.243 23.543 716 HG3 GLU 95 HG3 GLU 95 9.678 7.045 23.908 717 HA PRO 96 HA PRO 96 12.543 10.168 22.691 718 HB2 PRO 96 HB2 PRO 96 14.229 7.959 22.999 719 HB3 PRO 96 HB3 PRO 96 14.290 9.447 23.990 720 HG2 PRO 96 HG2 PRO 96 12.915 6.831 24.604 721 HG3 PRO 96 HG3 PRO 96 13.920 7.841 25.693 722 HD2 PRO 96 HD2 PRO 96 11.228 7.909 25.790 723 HD3 PRO 96 HD3 PRO 96 12.168 9.415 25.988 724 H ILE 97 H ILE 97 13.295 9.303 20.679 725 HA ILE 97 HA ILE 97 11.614 7.105 19.523 726 HB ILE 97 HB ILE 97 12.662 9.654 18.242 727 HG12 ILE 97 HG12 ILE 97 10.778 10.245 19.592 728 HG13 ILE 97 HG13 ILE 97 10.263 10.236 17.921 729 HG21 ILE 97 HG21 ILE 97 11.523 8.950 16.212 730 HG22 ILE 97 HG22 ILE 97 12.713 7.743 16.633 731 HG23 ILE 97 HG23 ILE 97 11.006 7.431 16.964 732 HD11 ILE 97 HD13 ILE 97 9.156 8.028 18.276 733 HD12 ILE 97 HD11 ILE 97 9.646 8.077 19.992 734 HD13 ILE 97 HD12 ILE 97 8.535 9.267 19.365 735 H LYS 98 H LYS 98 12.679 5.497 18.655 736 HA LYS 98 HA LYS 98 15.644 5.727 18.296 737 HB2 LYS 98 HB2 LYS 98 13.807 3.314 18.462 738 HB3 LYS 98 HB3 LYS 98 15.496 3.259 17.958 739 HG2 LYS 98 HG2 LYS 98 16.125 4.237 20.218 740 HG3 LYS 98 HG3 LYS 98 14.429 4.075 20.690 741 HD2 LYS 98 HD2 LYS 98 15.620 2.169 21.536 742 HD3 LYS 98 HD3 LYS 98 14.578 1.604 20.218 743 HE2 LYS 98 HE2 LYS 98 16.610 1.772 18.669 744 HE3 LYS 98 HE3 LYS 98 17.569 2.190 20.078 745 HZ1 LYS 98 HZ3 LYS 98 16.214 -0.404 19.577 746 HZ2 LYS 98 HZ1 LYS 98 17.822 -0.104 19.588 747 HZ3 LYS 98 HZ2 LYS 98 16.976 -0.021 20.992 748 H LEU 99 H LEU 99 12.491 5.149 16.638 749 HA LEU 99 HA LEU 99 14.043 4.709 14.121 750 HB2 LEU 99 HB2 LEU 99 12.741 2.799 15.075 751 HB3 LEU 99 HB3 LEU 99 11.274 3.722 14.821 752 HG LEU 99 HG LEU 99 11.756 1.978 13.224 753 HD11 LEU 99 HD11 LEU 99 11.636 4.583 11.695 754 HD12 LEU 99 HD12 LEU 99 11.016 3.013 11.211 755 HD13 LEU 99 HD13 LEU 99 10.271 3.866 12.569 756 HD21 LEU 99 HD23 LEU 99 13.431 1.768 11.703 757 HD22 LEU 99 HD21 LEU 99 13.754 3.497 11.640 758 HD23 LEU 99 HD22 LEU 99 14.316 2.535 13.014 759 H LEU 100 H LEU 100 13.769 6.002 12.469 760 HA LEU 100 HA LEU 100 11.499 7.933 12.456 761 HB2 LEU 100 HB2 LEU 100 14.298 8.738 11.612 762 HB3 LEU 100 HB3 LEU 100 12.884 9.727 11.827 763 HG LEU 100 HG LEU 100 13.261 8.621 14.362 764 HD11 LEU 100 HD11 LEU 100 15.432 7.673 13.697 765 HD12 LEU 100 HD12 LEU 100 16.002 9.300 13.258 766 HD13 LEU 100 HD13 LEU 100 15.609 8.913 14.948 767 HD21 LEU 100 HD23 LEU 100 14.006 10.812 15.083 768 HD22 LEU 100 HD21 LEU 100 14.363 11.275 13.405 769 HD23 LEU 100 HD22 LEU 100 12.686 10.962 13.908 770 H ILE 101 H ILE 101 10.358 7.154 10.708 771 HA ILE 101 HA ILE 101 11.899 6.363 8.294 772 HB ILE 101 HB ILE 101 9.070 5.950 9.189 773 HG12 ILE 101 HG12 ILE 101 11.236 4.535 7.611 774 HG13 ILE 101 HG13 ILE 101 10.488 4.082 9.136 775 HG21 ILE 101 HG21 ILE 101 9.670 6.440 6.277 776 HG22 ILE 101 HG22 ILE 101 8.121 5.851 6.963 777 HG23 ILE 101 HG23 ILE 101 8.662 7.484 7.286 778 HD11 ILE 101 HD13 ILE 101 9.824 2.548 7.411 779 HD12 ILE 101 HD11 ILE 101 8.390 3.543 7.768 780 HD13 ILE 101 HD12 ILE 101 9.393 3.860 6.321 781 H GLY 102 H GLY 102 12.043 7.638 6.506 782 HA2 GLY 102 HA2 GLY 102 11.203 10.492 6.805 783 HA3 GLY 102 HA3 GLY 102 12.514 9.930 5.769 784 H LEU 103 H LEU 103 9.895 11.340 5.088 785 HA LEU 103 HA LEU 103 9.450 9.722 2.683 786 HB2 LEU 103 HB2 LEU 103 7.580 9.144 4.436 787 HB3 LEU 103 HB3 LEU 103 7.088 10.811 4.262 788 HG LEU 103 HG LEU 103 6.810 8.467 2.349 789 HD11 LEU 103 HD11 LEU 103 5.146 9.322 4.201 790 HD12 LEU 103 HD12 LEU 103 4.864 10.698 3.148 791 HD13 LEU 103 HD13 LEU 103 4.501 9.057 2.581 792 HD21 LEU 103 HD23 LEU 103 5.806 10.127 0.691 793 HD22 LEU 103 HD21 LEU 103 6.625 11.409 1.562 794 HD23 LEU 103 HD22 LEU 103 7.549 10.073 0.784 795 H SER 104 H SER 104 9.340 11.102 0.930 796 HA SER 104 HA SER 104 8.602 13.921 1.289 797 HB2 SER 104 HB2 SER 104 10.319 14.653 -0.265 798 HB3 SER 104 HB3 SER 104 11.075 13.901 1.147 799 HG SER 104 HG SER 104 10.950 13.047 -1.518 800 H ALA 105 H ALA 105 7.414 14.685 -0.584 801 HA ALA 105 HA ALA 105 6.899 12.716 -2.704 802 HB1 ALA 105 HB3 ALA 105 4.459 12.893 -2.345 803 HB2 ALA 105 HB1 ALA 105 5.261 12.107 -0.969 804 HB3 ALA 105 HB2 ALA 105 4.744 13.812 -0.855 805 H ALA 106 H ALA 106 6.565 13.746 -4.612 806 HA ALA 106 HA ALA 106 6.834 16.626 -4.630 807 HB1 ALA 106 HB3 ALA 106 7.915 15.194 -6.343 808 HB2 ALA 106 HB1 ALA 106 6.318 14.646 -6.906 809 HB3 ALA 106 HB2 ALA 106 6.800 16.345 -7.096 810 H ASP 107 H ASP 107 4.128 14.427 -4.543 811 HA ASP 107 HA ASP 107 2.243 16.688 -4.925 812 HB2 ASP 107 HB2 ASP 107 2.436 15.597 -7.138 813 HB3 ASP 107 HB3 ASP 107 2.062 14.035 -6.409 814 H ALA 108 H ALA 108 0.166 16.294 -3.930 815 HA ALA 108 HA ALA 108 0.367 15.029 -1.434 816 HB1 ALA 108 HB3 ALA 108 -2.034 15.551 -1.220 817 HB2 ALA 108 HB1 ALA 108 -1.140 16.925 -1.899 818 HB3 ALA 108 HB2 ALA 108 -2.127 15.888 -2.960 819 H ASP 109 H ASP 109 -0.921 13.720 -4.514 820 HA ASP 109 HA ASP 109 -2.125 11.407 -3.156 821 HB2 ASP 109 HB2 ASP 109 -3.071 12.142 -5.225 822 HB3 ASP 109 HB3 ASP 109 -1.511 11.956 -6.062 823 H SER 110 H SER 110 0.993 12.199 -4.648 824 HA SER 110 HA SER 110 2.107 9.554 -4.474 825 HB2 SER 110 HB2 SER 110 3.590 12.212 -4.332 826 HB3 SER 110 HB3 SER 110 4.225 10.632 -4.795 827 HG SER 110 HG SER 110 3.732 11.874 -6.629 828 H HIS 111 H HIS 111 1.914 12.322 -2.175 829 HA HIS 111 HA HIS 111 3.284 11.101 0.007 830 HB2 HIS 111 HB2 HIS 111 2.843 13.380 0.290 831 HB3 HIS 111 HB3 HIS 111 1.194 13.247 -0.261 832 HD1 HIS 111 HD1 HIS 111 3.208 12.992 2.951 833 HD2 HIS 111 HD2 HIS 111 -0.717 12.630 1.476 834 HE1 HIS 111 HE1 HIS 111 1.686 12.873 4.984 835 H ILE 112 H ILE 112 -0.225 11.032 -0.862 836 HA ILE 112 HA ILE 112 -1.060 9.351 1.235 837 HB ILE 112 HB ILE 112 -2.072 9.711 -1.608 838 HG12 ILE 112 HG12 ILE 112 -2.247 11.664 -0.018 839 HG13 ILE 112 HG13 ILE 112 -3.740 11.129 -0.762 840 HG21 ILE 112 HG21 ILE 112 -4.209 8.669 -0.871 841 HG22 ILE 112 HG22 ILE 112 -2.863 7.542 -1.043 842 HG23 ILE 112 HG23 ILE 112 -3.363 8.069 0.579 843 HD11 ILE 112 HD13 ILE 112 -3.982 11.757 1.602 844 HD12 ILE 112 HD11 ILE 112 -4.437 10.070 1.324 845 HD13 ILE 112 HD12 ILE 112 -2.864 10.458 2.075 846 H GLY 113 H GLY 113 0.052 8.344 -2.085 847 HA2 GLY 113 HA2 GLY 113 -0.247 5.583 -1.631 848 HA3 GLY 113 HA3 GLY 113 0.873 6.321 -2.796 849 H ALA 114 H ALA 114 2.556 7.718 -0.952 850 HA ALA 114 HA ALA 114 4.383 5.623 -0.215 851 HB1 ALA 114 HB3 ALA 114 5.100 7.884 -0.932 852 HB2 ALA 114 HB1 ALA 114 4.289 8.585 0.465 853 HB3 ALA 114 HB2 ALA 114 5.694 7.503 0.691 854 H ILE 115 H ILE 115 2.249 7.818 1.724 855 HA ILE 115 HA ILE 115 2.930 6.942 4.248 856 HB ILE 115 HB ILE 115 0.584 8.117 2.926 857 HG12 ILE 115 HG12 ILE 115 2.522 9.581 3.515 858 HG13 ILE 115 HG13 ILE 115 0.971 10.108 4.126 859 HG21 ILE 115 HG21 ILE 115 0.479 7.193 5.757 860 HG22 ILE 115 HG22 ILE 115 -0.580 8.490 5.103 861 HG23 ILE 115 HG23 ILE 115 -0.639 6.872 4.406 862 HD11 ILE 115 HD13 ILE 115 2.873 10.340 5.751 863 HD12 ILE 115 HD11 ILE 115 1.493 9.418 6.372 864 HD13 ILE 115 HD12 ILE 115 2.947 8.565 5.822 865 H GLN 116 H GLN 116 0.409 5.785 1.901 866 HA GLN 116 HA GLN 116 -0.690 3.795 3.636 867 HB2 GLN 116 HB2 GLN 116 -0.807 4.259 0.628 868 HB3 GLN 116 HB3 GLN 116 -1.675 2.939 1.405 869 HG2 GLN 116 HG2 GLN 116 -2.018 5.873 2.133 870 HG3 GLN 116 HG3 GLN 116 -3.058 4.997 1.019 871 HE21 GLN 116 HE22 GLN 116 -3.244 6.230 3.977 872 HE22 GLN 116 HE21 GLN 116 -4.134 4.993 4.823 873 H ALA 117 H ALA 117 2.297 3.808 1.940 874 HA ALA 117 HA ALA 117 2.447 0.890 1.882 875 HB1 ALA 117 HB3 ALA 117 4.473 2.977 0.945 876 HB2 ALA 117 HB1 ALA 117 4.576 1.229 0.690 877 HB3 ALA 117 HB2 ALA 117 3.303 2.166 -0.113 878 H LEU 118 H LEU 118 3.961 3.768 3.439 879 HA LEU 118 HA LEU 118 5.708 2.066 4.935 880 HB2 LEU 118 HB2 LEU 118 6.417 4.040 6.018 881 HB3 LEU 118 HB3 LEU 118 6.166 4.297 4.260 882 HG LEU 118 HG LEU 118 3.922 5.231 4.849 883 HD11 LEU 118 HD11 LEU 118 5.236 5.895 7.498 884 HD12 LEU 118 HD12 LEU 118 3.573 6.267 6.938 885 HD13 LEU 118 HD13 LEU 118 4.014 4.643 7.396 886 HD21 LEU 118 HD23 LEU 118 4.848 7.485 5.234 887 HD22 LEU 118 HD21 LEU 118 6.420 6.787 5.596 888 HD23 LEU 118 HD22 LEU 118 5.718 6.609 3.964 889 H SER 119 H SER 119 2.491 3.329 5.480 890 HA SER 119 HA SER 119 2.228 2.612 8.194 891 HB2 SER 119 HB2 SER 119 0.093 2.408 6.030 892 HB3 SER 119 HB3 SER 119 -0.191 2.450 7.782 893 HG SER 119 HG SER 119 0.890 4.476 6.112 894 H GLU 120 H GLU 120 2.612 0.412 5.465 895 HA GLU 120 HA GLU 120 1.467 -1.899 6.729 896 HB2 GLU 120 HB2 GLU 120 3.640 -1.730 4.621 897 HB3 GLU 120 HB3 GLU 120 2.772 -3.183 5.072 898 HG2 GLU 120 HG2 GLU 120 1.370 -0.717 3.993 899 HG3 GLU 120 HG3 GLU 120 1.973 -2.000 2.950 900 H LEU 121 H LEU 121 4.270 -0.008 7.175 901 HA LEU 121 HA LEU 121 5.685 -2.094 8.780 902 HB2 LEU 121 HB2 LEU 121 6.713 0.603 7.795 903 HB3 LEU 121 HB3 LEU 121 7.643 -0.656 8.600 904 HG LEU 121 HG LEU 121 6.418 -0.713 5.812 905 HD11 LEU 121 HD11 LEU 121 8.472 0.599 6.036 906 HD12 LEU 121 HD12 LEU 121 9.303 -0.780 6.789 907 HD13 LEU 121 HD13 LEU 121 8.771 -0.873 5.098 908 HD21 LEU 121 HD23 LEU 121 7.492 -2.917 5.477 909 HD22 LEU 121 HD21 LEU 121 7.978 -2.960 7.178 910 HD23 LEU 121 HD22 LEU 121 6.257 -3.014 6.731 911 H LEU 122 H LEU 122 5.113 1.478 8.963 912 HA LEU 122 HA LEU 122 5.621 1.596 11.730 913 HB2 LEU 122 HB2 LEU 122 4.124 3.617 10.089 914 HB3 LEU 122 HB3 LEU 122 4.909 3.849 11.658 915 HG LEU 122 HG LEU 122 6.211 3.404 8.967 916 HD11 LEU 122 HD11 LEU 122 7.001 5.541 9.234 917 HD12 LEU 122 HD12 LEU 122 5.453 5.676 10.053 918 HD13 LEU 122 HD13 LEU 122 6.928 5.505 11.015 919 HD21 LEU 122 HD23 LEU 122 7.555 1.973 10.404 920 HD22 LEU 122 HD21 LEU 122 8.432 3.488 10.197 921 HD23 LEU 122 HD22 LEU 122 7.553 3.186 11.702 922 H CYS 123 H CYS 123 2.679 0.511 10.289 923 HA CYS 123 HA CYS 123 1.343 0.866 12.923 924 HB2 CYS 123 HB2 CYS 123 -0.046 0.685 10.220 925 HB3 CYS 123 HB3 CYS 123 -0.792 0.987 11.788 926 HG CYS 123 HG CYS 123 0.476 3.239 12.278 927 H GLU 124 H GLU 124 3.187 -1.217 12.095 928 HA GLU 124 HA GLU 124 1.420 -3.503 12.684 929 HB2 GLU 124 HB2 GLU 124 3.561 -3.434 10.539 930 HB3 GLU 124 HB3 GLU 124 3.018 -4.937 11.287 931 HG2 GLU 124 HG2 GLU 124 1.233 -2.952 9.845 932 HG3 GLU 124 HG3 GLU 124 1.858 -4.455 9.154 933 H GLU 125 H GLU 125 1.840 -3.628 14.697 934 HA GLU 125 HA GLU 125 4.219 -2.921 15.994 935 HB2 GLU 125 HB2 GLU 125 3.313 -3.969 17.972 936 HB3 GLU 125 HB3 GLU 125 2.061 -3.077 17.110 937 HG2 GLU 125 HG2 GLU 125 1.234 -5.239 16.132 938 HG3 GLU 125 HG3 GLU 125 2.452 -6.105 17.069 939 H GLU 126 H GLU 126 3.459 -5.922 14.363 940 HA GLU 126 HA GLU 126 5.469 -7.578 15.509 941 HB2 GLU 126 HB2 GLU 126 4.274 -7.546 12.707 942 HB3 GLU 126 HB3 GLU 126 5.330 -8.822 13.315 943 HG2 GLU 126 HG2 GLU 126 2.667 -8.033 14.529 944 HG3 GLU 126 HG3 GLU 126 2.908 -9.358 13.389 945 H ILE 127 H ILE 127 5.419 -5.403 12.699 946 HA ILE 127 HA ILE 127 8.178 -5.805 11.947 947 HB ILE 127 HB ILE 127 6.028 -3.886 11.162 948 HG12 ILE 127 HG12 ILE 127 6.352 -4.815 8.937 949 HG13 ILE 127 HG13 ILE 127 7.732 -5.769 9.485 950 HG21 ILE 127 HG21 ILE 127 7.907 -2.427 11.127 951 HG22 ILE 127 HG22 ILE 127 8.965 -3.694 10.468 952 HG23 ILE 127 HG23 ILE 127 7.698 -2.962 9.461 953 HD11 ILE 127 HD13 ILE 127 5.652 -7.086 9.115 954 HD12 ILE 127 HD11 ILE 127 6.278 -7.237 10.761 955 HD13 ILE 127 HD12 ILE 127 4.870 -6.188 10.431 956 H LEU 128 H LEU 128 6.387 -3.387 13.910 957 HA LEU 128 HA LEU 128 8.398 -1.523 14.140 958 HB2 LEU 128 HB2 LEU 128 6.411 -2.316 16.305 959 HB3 LEU 128 HB3 LEU 128 7.469 -0.920 16.404 960 HG LEU 128 HG LEU 128 5.225 -1.316 14.399 961 HD11 LEU 128 HD11 LEU 128 5.652 0.705 16.628 962 HD12 LEU 128 HD12 LEU 128 4.269 0.647 15.511 963 HD13 LEU 128 HD13 LEU 128 4.531 -0.667 16.665 964 HD21 LEU 128 HD23 LEU 128 5.849 1.119 13.804 965 HD22 LEU 128 HD21 LEU 128 7.451 0.734 14.462 966 HD23 LEU 128 HD22 LEU 128 6.806 -0.191 13.093 967 H GLU 129 H GLU 129 8.131 -4.458 16.150 968 HA GLU 129 HA GLU 129 10.287 -3.619 17.819 969 HB2 GLU 129 HB2 GLU 129 9.961 -5.435 19.083 970 HB3 GLU 129 HB3 GLU 129 8.387 -5.373 18.304 971 HG2 GLU 129 HG2 GLU 129 9.222 -7.112 16.663 972 HG3 GLU 129 HG3 GLU 129 10.739 -7.179 17.581 973 H GLN 130 H GLN 130 10.098 -5.288 14.707 974 HA GLN 130 HA GLN 130 12.729 -6.467 14.864 975 HB2 GLN 130 HB2 GLN 130 10.752 -6.052 12.585 976 HB3 GLN 130 HB3 GLN 130 12.291 -6.925 12.438 977 HG2 GLN 130 HG2 GLN 130 11.607 -8.591 14.025 978 HG3 GLN 130 HG3 GLN 130 10.128 -7.712 14.411 979 HE21 GLN 130 HE22 GLN 130 8.300 -8.188 13.273 980 HE22 GLN 130 HE21 GLN 130 8.242 -9.224 11.858 981 H LEU 131 H LEU 131 11.227 -3.483 13.554 982 HA LEU 131 HA LEU 131 13.628 -2.316 12.476 983 HB2 LEU 131 HB2 LEU 131 11.386 -0.849 13.935 984 HB3 LEU 131 HB3 LEU 131 12.597 -0.145 12.898 985 HG LEU 131 HG LEU 131 10.450 -2.132 11.959 986 HD11 LEU 131 HD11 LEU 131 9.151 -0.268 11.231 987 HD12 LEU 131 HD12 LEU 131 9.558 -0.021 12.946 988 HD13 LEU 131 HD13 LEU 131 10.427 0.877 11.686 989 HD21 LEU 131 HD23 LEU 131 12.386 -0.333 10.488 990 HD22 LEU 131 HD21 LEU 131 12.328 -2.093 10.443 991 HD23 LEU 131 HD22 LEU 131 11.014 -1.150 9.708 992 H LEU 132 H LEU 132 11.978 -1.908 15.635 993 HA LEU 132 HA LEU 132 13.934 -0.281 16.783 994 HB2 LEU 132 HB2 LEU 132 11.885 -2.105 18.061 995 HB3 LEU 132 HB3 LEU 132 12.842 -0.970 18.996 996 HG LEU 132 HG LEU 132 11.129 -0.037 16.657 997 HD11 LEU 132 HD11 LEU 132 10.362 -0.187 19.602 998 HD12 LEU 132 HD12 LEU 132 9.414 0.583 18.306 999 HD13 LEU 132 HD13 LEU 132 9.677 -1.165 18.284 1000 HD21 LEU 132 HD23 LEU 132 12.301 1.441 19.032 1001 HD22 LEU 132 HD21 LEU 132 12.848 1.534 17.336 1002 HD23 LEU 132 HD22 LEU 132 11.250 2.134 17.777 1003 H THR 133 H THR 133 14.404 -3.595 16.169 1004 HA THR 133 HA THR 133 16.607 -3.723 18.148 1005 HB THR 133 HB THR 133 16.230 -6.186 18.130 1006 HG1 THR 133 HG1 THR 133 13.745 -5.602 16.927 1007 HG21 THR 133 HG23 THR 133 13.782 -4.585 19.005 1008 HG22 THR 133 HG21 THR 133 14.171 -6.240 19.492 1009 HG23 THR 133 HG22 THR 133 15.241 -4.903 19.965 1010 H ALA 134 H ALA 134 16.150 -3.095 14.958 1011 HA ALA 134 HA ALA 134 17.697 -5.004 13.579 1012 HB1 ALA 134 HB3 ALA 134 17.106 -2.095 12.999 1013 HB2 ALA 134 HB1 ALA 134 17.968 -3.163 11.894 1014 HB3 ALA 134 HB2 ALA 134 16.286 -3.535 12.353 1015 H SER 135 H SER 135 19.741 -5.571 14.018 1016 HA SER 135 HA SER 135 21.582 -3.853 15.411 1017 HB2 SER 135 HB2 SER 135 22.081 -6.458 13.905 1018 HB3 SER 135 HB3 SER 135 23.112 -5.742 15.157 1019 HG SER 135 HG SER 135 21.763 -7.403 15.979 1020 H SER 136 H SER 136 20.814 -4.316 12.024 1021 HA SER 136 HA SER 136 23.182 -2.752 11.165 1022 HB2 SER 136 HB2 SER 136 22.395 -5.460 9.995 1023 HB3 SER 136 HB3 SER 136 23.755 -4.443 9.493 1024 HG SER 136 HG SER 136 24.402 -6.154 10.871 1025 H GLU 137 H GLU 137 22.936 -1.866 9.043 1026 HA GLU 137 HA GLU 137 20.326 -0.942 8.409 1027 HB2 GLU 137 HB2 GLU 137 22.915 -0.974 6.796 1028 HB3 GLU 137 HB3 GLU 137 21.463 -0.045 6.336 1029 HG2 GLU 137 HG2 GLU 137 21.500 1.261 8.237 1030 HG3 GLU 137 HG3 GLU 137 22.771 0.326 9.030 1031 H LYS 138 H LYS 138 22.180 -3.734 7.204 1032 HA LYS 138 HA LYS 138 20.491 -4.443 5.073 1033 HB2 LYS 138 HB2 LYS 138 22.694 -5.479 5.522 1034 HB3 LYS 138 HB3 LYS 138 22.058 -6.233 6.983 1035 HG2 LYS 138 HG2 LYS 138 22.231 -7.844 5.172 1036 HG3 LYS 138 HG3 LYS 138 20.546 -7.640 5.645 1037 HD2 LYS 138 HD2 LYS 138 20.141 -6.204 3.666 1038 HD3 LYS 138 HD3 LYS 138 21.862 -6.317 3.227 1039 HE2 LYS 138 HE2 LYS 138 21.624 -8.787 3.010 1040 HE3 LYS 138 HE3 LYS 138 19.913 -8.659 3.438 1041 HZ1 LYS 138 HZ3 LYS 138 20.227 -8.786 1.050 1042 HZ2 LYS 138 HZ1 LYS 138 19.576 -7.341 1.425 1043 HZ3 LYS 138 HZ2 LYS 138 21.161 -7.454 1.034 1044 H GLN 139 H GLN 139 20.036 -5.016 8.582 1045 HA GLN 139 HA GLN 139 17.806 -6.726 8.290 1046 HB2 GLN 139 HB2 GLN 139 19.473 -5.880 10.344 1047 HB3 GLN 139 HB3 GLN 139 17.985 -5.000 10.715 1048 HG2 GLN 139 HG2 GLN 139 16.730 -7.122 10.572 1049 HG3 GLN 139 HG3 GLN 139 18.256 -7.967 10.210 1050 HE21 GLN 139 HE22 GLN 139 16.248 -8.137 12.587 1051 HE22 GLN 139 HE21 GLN 139 17.267 -7.962 13.992 1052 H LEU 140 H LEU 140 18.131 -3.141 8.448 1053 HA LEU 140 HA LEU 140 15.272 -2.681 8.676 1054 HB2 LEU 140 HB2 LEU 140 17.646 -0.972 7.909 1055 HB3 LEU 140 HB3 LEU 140 16.008 -0.357 7.819 1056 HG LEU 140 HG LEU 140 17.295 -1.438 10.339 1057 HD11 LEU 140 HD11 LEU 140 18.367 0.648 9.485 1058 HD12 LEU 140 HD12 LEU 140 16.801 1.464 9.549 1059 HD13 LEU 140 HD13 LEU 140 17.553 0.877 11.035 1060 HD21 LEU 140 HD23 LEU 140 15.477 -0.337 11.568 1061 HD22 LEU 140 HD21 LEU 140 14.682 0.058 10.031 1062 HD23 LEU 140 HD22 LEU 140 14.891 -1.638 10.536 1063 H ALA 141 H ALA 141 17.656 -2.600 5.983 1064 HA ALA 141 HA ALA 141 15.892 -2.312 3.835 1065 HB1 ALA 141 HB3 ALA 141 17.659 -3.251 2.468 1066 HB2 ALA 141 HB1 ALA 141 18.404 -2.242 3.726 1067 HB3 ALA 141 HB2 ALA 141 18.420 -4.011 3.877 1068 H ASP 142 H ASP 142 16.696 -5.371 5.583 1069 HA ASP 142 HA ASP 142 15.320 -7.091 3.814 1070 HB2 ASP 142 HB2 ASP 142 16.753 -8.019 5.515 1071 HB3 ASP 142 HB3 ASP 142 15.788 -7.302 6.806 1072 H ILE 143 H ILE 143 14.109 -5.250 6.689 1073 HA ILE 143 HA ILE 143 11.460 -6.220 6.559 1074 HB ILE 143 HB ILE 143 12.813 -3.796 7.776 1075 HG12 ILE 143 HG12 ILE 143 11.598 -6.284 9.076 1076 HG13 ILE 143 HG13 ILE 143 13.298 -6.148 8.648 1077 HG21 ILE 143 HG21 ILE 143 10.757 -3.443 9.097 1078 HG22 ILE 143 HG22 ILE 143 10.534 -3.127 7.380 1079 HG23 ILE 143 HG23 ILE 143 9.920 -4.646 8.086 1080 HD11 ILE 143 HD13 ILE 143 11.826 -4.591 10.801 1081 HD12 ILE 143 HD11 ILE 143 13.221 -5.668 10.934 1082 HD13 ILE 143 HD12 ILE 143 13.428 -4.100 10.163 1083 H ILE 144 H ILE 144 13.075 -3.458 4.967 1084 HA ILE 144 HA ILE 144 10.740 -2.474 3.605 1085 HB ILE 144 HB ILE 144 13.687 -2.433 2.803 1086 HG12 ILE 144 HG12 ILE 144 13.387 -1.086 4.739 1087 HG13 ILE 144 HG13 ILE 144 13.551 -0.011 3.362 1088 HG21 ILE 144 HG21 ILE 144 13.115 -0.631 1.187 1089 HG22 ILE 144 HG22 ILE 144 12.508 -2.216 0.728 1090 HG23 ILE 144 HG23 ILE 144 11.398 -1.014 1.406 1091 HD11 ILE 144 HD13 ILE 144 11.077 -0.673 4.946 1092 HD12 ILE 144 HD11 ILE 144 11.806 0.909 4.619 1093 HD13 ILE 144 HD12 ILE 144 10.954 0.046 3.325 1094 H SER 145 H SER 145 13.112 -4.970 2.704 1095 HA SER 145 HA SER 145 12.148 -5.199 0.078 1096 HB2 SER 145 HB2 SER 145 13.750 -7.216 1.719 1097 HB3 SER 145 HB3 SER 145 13.583 -7.222 -0.046 1098 HG SER 145 HG SER 145 14.794 -5.229 1.590 1099 H ARG 146 H ARG 146 10.944 -6.789 3.001 1100 HA ARG 146 HA ARG 146 9.639 -8.970 1.732 1101 HB2 ARG 146 HB2 ARG 146 8.329 -7.622 4.086 1102 HB3 ARG 146 HB3 ARG 146 8.528 -9.345 3.738 1103 HG2 ARG 146 HG2 ARG 146 11.027 -8.952 4.229 1104 HG3 ARG 146 HG3 ARG 146 10.494 -7.334 4.787 1105 HD2 ARG 146 HD2 ARG 146 9.094 -8.316 6.494 1106 HD3 ARG 146 HD3 ARG 146 9.485 -9.958 5.932 1107 HE ARG 146 HE ARG 146 11.967 -8.918 6.448 1108 HH11 ARG 146 HH21 ARG 146 9.031 -9.209 8.472 1109 HH12 ARG 146 HH22 ARG 146 9.973 -9.298 9.942 1110 HH21 ARG 146 HH11 ARG 146 13.076 -9.088 8.298 1111 HH22 ARG 146 HH12 ARG 146 12.282 -9.237 9.872 1112 H GLY 147 H GLY 147 8.856 -5.567 2.021 1113 HA2 GLY 147 HA2 GLY 147 5.997 -5.906 1.714 1114 HA3 GLY 147 HA3 GLY 147 6.930 -4.407 1.897 Start of MODEL 13 1 H MET 1 H1 MET 1 1.884 -0.734 -0.713 2 HA MET 1 HA MET 1 2.325 -1.522 -3.516 3 HB2 MET 1 HB2 MET 1 2.029 1.118 -2.821 4 HB3 MET 1 HB3 MET 1 3.743 0.894 -2.411 5 HG2 MET 1 HG2 MET 1 4.162 0.036 -4.699 6 HG3 MET 1 HG3 MET 1 2.455 0.214 -5.098 7 HE1 MET 1 HE3 MET 1 1.993 4.067 -5.417 8 HE2 MET 1 HE1 MET 1 1.239 2.465 -5.562 9 HE3 MET 1 HE2 MET 1 1.649 3.122 -3.957 10 H ARG 2 H ARG 2 4.571 -1.841 -4.075 11 HA ARG 2 HA ARG 2 5.992 -3.231 -1.995 12 HB2 ARG 2 HB2 ARG 2 6.849 -2.302 -4.752 13 HB3 ARG 2 HB3 ARG 2 7.889 -3.221 -3.648 14 HG2 ARG 2 HG2 ARG 2 5.234 -4.115 -4.801 15 HG3 ARG 2 HG3 ARG 2 6.846 -4.728 -5.228 16 HD2 ARG 2 HD2 ARG 2 7.007 -5.467 -2.761 17 HD3 ARG 2 HD3 ARG 2 5.264 -5.104 -2.668 18 HE ARG 2 HE ARG 2 5.748 -6.787 -4.904 19 HH11 ARG 2 HH11 ARG 2 5.685 -6.937 -1.334 20 HH12 ARG 2 HH12 ARG 2 5.371 -8.641 -1.297 21 HH21 ARG 2 HH21 ARG 2 5.300 -9.039 -4.823 22 HH22 ARG 2 HH22 ARG 2 5.129 -9.849 -3.313 23 H LEU 3 H LEU 3 6.918 -2.357 -0.429 24 HA LEU 3 HA LEU 3 7.182 0.428 0.103 25 HB2 LEU 3 HB2 LEU 3 8.317 -2.108 1.296 26 HB3 LEU 3 HB3 LEU 3 9.017 -0.583 1.791 27 HG LEU 3 HG LEU 3 7.248 -1.496 3.296 28 HD11 LEU 3 HD11 LEU 3 6.696 1.278 2.147 29 HD12 LEU 3 HD12 LEU 3 6.261 0.658 3.752 30 HD13 LEU 3 HD13 LEU 3 7.957 0.866 3.335 31 HD21 LEU 3 HD23 LEU 3 5.631 -2.262 1.527 32 HD22 LEU 3 HD21 LEU 3 4.910 -1.243 2.777 33 HD23 LEU 3 HD22 LEU 3 5.262 -0.566 1.185 34 H SER 4 H SER 4 9.583 -1.981 -1.028 35 HA SER 4 HA SER 4 11.837 -0.468 -1.023 36 HB2 SER 4 HB2 SER 4 11.283 -2.379 -3.295 37 HB3 SER 4 HB3 SER 4 12.747 -2.210 -2.309 38 HG SER 4 HG SER 4 11.447 -4.100 -1.891 39 H ASP 5 H ASP 5 9.091 0.118 -3.160 40 HA ASP 5 HA ASP 5 10.583 1.237 -5.351 41 HB2 ASP 5 HB2 ASP 5 8.234 0.482 -5.565 42 HB3 ASP 5 HB3 ASP 5 7.727 1.753 -4.443 43 H TYR 6 H TYR 6 9.496 2.412 -2.209 44 HA TYR 6 HA TYR 6 9.846 5.223 -2.961 45 HB2 TYR 6 HB2 TYR 6 8.942 3.862 -0.394 46 HB3 TYR 6 HB3 TYR 6 9.133 5.597 -0.573 47 HD1 TYR 6 HD2 TYR 6 7.720 6.962 -1.958 48 HD2 TYR 6 HD1 TYR 6 6.932 2.728 -1.462 49 HE1 TYR 6 HE2 TYR 6 5.481 7.252 -2.969 50 HE2 TYR 6 HE1 TYR 6 4.667 3.058 -2.373 51 HH TYR 6 HH TYR 6 3.478 6.245 -3.536 52 H PHE 7 H PHE 7 11.761 2.772 -1.255 53 HA PHE 7 HA PHE 7 13.488 4.866 -0.048 54 HB2 PHE 7 HB2 PHE 7 13.581 1.843 0.243 55 HB3 PHE 7 HB3 PHE 7 14.649 2.981 1.047 56 HD1 PHE 7 HD2 PHE 7 11.022 2.161 0.648 57 HD2 PHE 7 HD1 PHE 7 14.050 3.649 3.328 58 HE1 PHE 7 HE2 PHE 7 9.311 2.490 2.382 59 HE2 PHE 7 HE1 PHE 7 12.299 4.047 5.034 60 HZ PHE 7 HZ PHE 7 9.939 3.483 4.577 61 HA PRO 8 HA PRO 8 15.502 4.319 -4.051 62 HB2 PRO 8 HB2 PRO 8 17.190 6.459 -4.108 63 HB3 PRO 8 HB3 PRO 8 15.417 6.581 -4.252 64 HG2 PRO 8 HG2 PRO 8 17.082 7.001 -1.747 65 HG3 PRO 8 HG3 PRO 8 15.785 8.041 -2.410 66 HD2 PRO 8 HD2 PRO 8 15.311 6.203 -0.449 67 HD3 PRO 8 HD3 PRO 8 14.115 6.582 -1.711 68 H GLU 9 H GLU 9 18.220 5.635 -2.195 69 HA GLU 9 HA GLU 9 19.470 3.128 -1.597 70 HB2 GLU 9 HB2 GLU 9 20.086 3.744 -4.099 71 HB3 GLU 9 HB3 GLU 9 21.038 5.042 -3.349 72 HG2 GLU 9 HG2 GLU 9 22.359 3.386 -2.089 73 HG3 GLU 9 HG3 GLU 9 21.340 2.081 -2.692 74 H SER 10 H SER 10 21.502 3.689 -0.361 75 HA SER 10 HA SER 10 22.432 4.612 1.373 76 HB2 SER 10 HB2 SER 10 21.835 7.403 0.373 77 HB3 SER 10 HB3 SER 10 23.278 6.827 1.209 78 HG SER 10 HG SER 10 23.837 5.697 -0.705 79 H SER 11 H SER 11 19.275 4.693 1.053 80 HA SER 11 HA SER 11 18.303 6.756 2.756 81 HB2 SER 11 HB2 SER 11 16.163 5.357 2.118 82 HB3 SER 11 HB3 SER 11 17.040 6.278 0.891 83 HG SER 11 HG SER 11 16.563 4.115 0.213 84 H ILE 12 H ILE 12 19.832 3.917 3.725 85 HA ILE 12 HA ILE 12 17.951 3.508 5.984 86 HB ILE 12 HB ILE 12 19.382 1.496 4.226 87 HG12 ILE 12 HG12 ILE 12 16.497 2.436 4.530 88 HG13 ILE 12 HG13 ILE 12 17.468 2.314 3.064 89 HG21 ILE 12 HG21 ILE 12 17.710 1.175 6.742 90 HG22 ILE 12 HG22 ILE 12 18.332 -0.164 5.732 91 HG23 ILE 12 HG23 ILE 12 19.456 0.879 6.578 92 HD11 ILE 12 HD13 ILE 12 16.300 0.059 4.681 93 HD12 ILE 12 HD11 ILE 12 15.828 0.589 3.051 94 HD13 ILE 12 HD12 ILE 12 17.425 -0.154 3.304 95 H SER 13 H SER 13 18.997 3.949 7.876 96 HA SER 13 HA SER 13 21.904 3.405 8.036 97 HB2 SER 13 HB2 SER 13 20.557 5.995 8.928 98 HB3 SER 13 HB3 SER 13 22.282 5.615 9.041 99 HG SER 13 HG SER 13 22.349 5.570 6.751 100 H VAL 14 H VAL 14 22.702 2.943 10.043 101 HA VAL 14 HA VAL 14 20.826 2.887 12.358 102 HB VAL 14 HB VAL 14 23.047 0.948 11.648 103 HG11 VAL 14 HG11 VAL 14 23.092 1.310 14.077 104 HG12 VAL 14 HG12 VAL 14 21.331 1.084 14.176 105 HG13 VAL 14 HG13 VAL 14 22.394 -0.273 13.741 106 HG21 VAL 14 HG23 VAL 14 21.265 -0.774 11.692 107 HG22 VAL 14 HG21 VAL 14 20.055 0.464 12.066 108 HG23 VAL 14 HG22 VAL 14 20.875 0.464 10.497 109 H ILE 15 H ILE 15 21.666 3.826 14.172 110 HA ILE 15 HA ILE 15 24.309 5.187 14.071 111 HB ILE 15 HB ILE 15 21.467 6.262 14.181 112 HG12 ILE 15 HG12 ILE 15 23.921 6.762 12.483 113 HG13 ILE 15 HG13 ILE 15 22.301 6.265 11.993 114 HG21 ILE 15 HG21 ILE 15 23.873 7.791 15.178 115 HG22 ILE 15 HG22 ILE 15 22.222 8.433 14.950 116 HG23 ILE 15 HG23 ILE 15 22.471 7.186 16.122 117 HD11 ILE 15 HD13 ILE 15 23.166 9.030 12.975 118 HD12 ILE 15 HD11 ILE 15 22.678 8.578 11.330 119 HD13 ILE 15 HD12 ILE 15 21.478 8.576 12.645 120 H HIS 16 H HIS 16 25.176 5.585 16.142 121 HA HIS 16 HA HIS 16 24.197 3.958 18.328 122 HB2 HIS 16 HB2 HIS 16 26.214 6.242 18.284 123 HB3 HIS 16 HB3 HIS 16 25.966 5.115 19.619 124 HD1 HIS 16 HD1 HIS 16 26.019 2.337 18.044 125 HD2 HIS 16 HD2 HIS 16 28.585 5.631 17.406 126 HE1 HIS 16 HE1 HIS 16 28.125 1.415 16.954 127 H SER 17 H SER 17 24.223 7.515 17.649 128 HA SER 17 HA SER 17 21.619 7.833 18.645 129 HB2 SER 17 HB2 SER 17 23.112 7.908 20.841 130 HB3 SER 17 HB3 SER 17 23.544 9.527 20.219 131 HG SER 17 HG SER 17 21.675 9.530 21.580 132 H ALA 18 H ALA 18 21.159 10.264 18.507 133 HA ALA 18 HA ALA 18 22.554 11.387 16.116 134 HB1 ALA 18 HB3 ALA 18 19.943 12.196 17.470 135 HB2 ALA 18 HB1 ALA 18 20.670 13.004 16.067 136 HB3 ALA 18 HB2 ALA 18 20.119 11.333 15.914 137 H LYS 19 H LYS 19 23.243 13.614 16.234 138 HA LYS 19 HA LYS 19 24.662 14.385 18.559 139 HB2 LYS 19 HB2 LYS 19 24.984 15.069 16.160 140 HB3 LYS 19 HB3 LYS 19 23.703 16.259 16.406 141 HG2 LYS 19 HG2 LYS 19 24.954 17.362 18.205 142 HG3 LYS 19 HG3 LYS 19 26.112 16.020 18.274 143 HD2 LYS 19 HD2 LYS 19 27.253 17.678 17.101 144 HD3 LYS 19 HD3 LYS 19 26.714 16.497 15.902 145 HE2 LYS 19 HE2 LYS 19 24.598 18.176 15.766 146 HE3 LYS 19 HE3 LYS 19 25.760 19.333 16.424 147 HZ1 LYS 19 HZ3 LYS 19 25.801 19.445 14.055 148 HZ2 LYS 19 HZ1 LYS 19 27.199 18.710 14.475 149 HZ3 LYS 19 HZ2 LYS 19 25.925 17.821 13.892 150 H ASP 20 H ASP 20 21.483 15.340 17.300 151 HA ASP 20 HA ASP 20 20.224 15.676 19.834 152 HB2 ASP 20 HB2 ASP 20 19.687 17.873 19.890 153 HB3 ASP 20 HB3 ASP 20 21.417 17.970 19.533 154 H TRP 21 H TRP 21 17.975 16.592 19.313 155 HA TRP 21 HA TRP 21 16.659 14.988 17.497 156 HB2 TRP 21 HB2 TRP 21 14.895 17.019 17.984 157 HB3 TRP 21 HB3 TRP 21 15.197 15.648 19.046 158 HD1 TRP 21 HD1 TRP 21 16.063 19.318 18.642 159 HE1 TRP 21 HE1 TRP 21 16.866 20.327 20.848 160 HE3 TRP 21 HE3 TRP 21 16.549 15.013 21.274 161 HZ2 TRP 21 HZ2 TRP 21 17.753 19.331 23.435 162 HZ3 TRP 21 HZ3 TRP 21 17.514 15.032 23.568 163 HH2 TRP 21 HH2 TRP 21 18.100 17.186 24.659 164 H GLN 22 H GLN 22 17.911 18.340 16.919 165 HA GLN 22 HA GLN 22 16.594 18.680 14.356 166 HB2 GLN 22 HB2 GLN 22 19.185 19.846 15.404 167 HB3 GLN 22 HB3 GLN 22 18.375 20.327 13.923 168 HG2 GLN 22 HG2 GLN 22 16.497 21.232 15.071 169 HG3 GLN 22 HG3 GLN 22 16.922 20.450 16.593 170 HE21 GLN 22 HE22 GLN 22 19.062 21.045 17.561 171 HE22 GLN 22 HE21 GLN 22 19.530 22.750 17.498 172 H GLU 23 H GLU 23 19.884 17.473 15.348 173 HA GLU 23 HA GLU 23 20.725 16.725 12.767 174 HB2 GLU 23 HB2 GLU 23 22.046 16.839 15.005 175 HB3 GLU 23 HB3 GLU 23 21.406 15.210 15.298 176 HG2 GLU 23 HG2 GLU 23 23.471 14.745 14.353 177 HG3 GLU 23 HG3 GLU 23 22.431 14.630 12.960 178 H ALA 24 H ALA 24 18.708 14.970 15.100 179 HA ALA 24 HA ALA 24 18.829 12.430 13.833 180 HB1 ALA 24 HB3 ALA 24 18.056 13.005 16.154 181 HB2 ALA 24 HB1 ALA 24 16.527 13.578 15.472 182 HB3 ALA 24 HB2 ALA 24 16.987 11.871 15.291 183 H ILE 25 H ILE 25 16.704 15.252 13.268 184 HA ILE 25 HA ILE 25 15.098 14.002 11.211 185 HB ILE 25 HB ILE 25 15.874 16.931 11.432 186 HG12 ILE 25 HG12 ILE 25 14.389 15.480 13.386 187 HG13 ILE 25 HG13 ILE 25 14.752 17.198 13.301 188 HG21 ILE 25 HG21 ILE 25 14.931 16.297 9.277 189 HG22 ILE 25 HG22 ILE 25 13.509 15.599 10.064 190 HG23 ILE 25 HG23 ILE 25 13.842 17.349 10.135 191 HD11 ILE 25 HD13 ILE 25 12.349 15.800 12.108 192 HD12 ILE 25 HD11 ILE 25 12.376 16.778 13.589 193 HD13 ILE 25 HD12 ILE 25 12.673 17.561 12.025 194 H ASP 26 H ASP 26 18.114 15.944 11.276 195 HA ASP 26 HA ASP 26 18.449 16.212 8.507 196 HB2 ASP 26 HB2 ASP 26 19.696 17.305 10.536 197 HB3 ASP 26 HB3 ASP 26 20.815 15.954 10.389 198 H PHE 27 H PHE 27 19.840 13.724 10.698 199 HA PHE 27 HA PHE 27 21.044 12.119 8.691 200 HB2 PHE 27 HB2 PHE 27 20.133 11.675 11.549 201 HB3 PHE 27 HB3 PHE 27 20.593 10.302 10.569 202 HD1 PHE 27 HD1 PHE 27 22.866 10.733 9.116 203 HD2 PHE 27 HD2 PHE 27 21.962 12.425 13.006 204 HE1 PHE 27 HE1 PHE 27 25.282 10.953 9.599 205 HE2 PHE 27 HE2 PHE 27 24.370 12.600 13.468 206 HZ PHE 27 HZ PHE 27 26.043 11.883 11.778 207 H SER 28 H SER 28 17.608 12.344 9.771 208 HA SER 28 HA SER 28 16.985 9.867 8.331 209 HB2 SER 28 HB2 SER 28 15.165 11.894 9.686 210 HB3 SER 28 HB3 SER 28 14.700 10.288 9.079 211 HG SER 28 HG SER 28 16.389 10.982 11.232 212 H MET 29 H MET 29 17.433 13.096 7.334 213 HA MET 29 HA MET 29 15.694 12.611 4.937 214 HB2 MET 29 HB2 MET 29 16.638 15.223 6.115 215 HB3 MET 29 HB3 MET 29 15.529 14.969 4.743 216 HG2 MET 29 HG2 MET 29 14.669 14.053 7.446 217 HG3 MET 29 HG3 MET 29 14.666 15.763 7.034 218 HE1 MET 29 HE3 MET 29 13.673 12.378 5.773 219 HE2 MET 29 HE1 MET 29 12.624 12.793 7.175 220 HE3 MET 29 HE2 MET 29 11.901 12.564 5.552 221 H VAL 30 H VAL 30 19.046 13.296 5.942 222 HA VAL 30 HA VAL 30 19.910 14.650 3.705 223 HB VAL 30 HB VAL 30 21.221 14.342 5.741 224 HG11 VAL 30 HG11 VAL 30 22.553 12.340 6.169 225 HG12 VAL 30 HG12 VAL 30 20.839 11.912 6.146 226 HG13 VAL 30 HG13 VAL 30 21.865 11.528 4.748 227 HG21 VAL 30 HG23 VAL 30 23.421 14.211 4.719 228 HG22 VAL 30 HG21 VAL 30 22.752 13.412 3.280 229 HG23 VAL 30 HG22 VAL 30 22.313 15.090 3.650 230 H SER 31 H SER 31 19.447 11.072 3.916 231 HA SER 31 HA SER 31 20.770 10.472 1.527 232 HB2 SER 31 HB2 SER 31 18.299 9.084 2.624 233 HB3 SER 31 HB3 SER 31 19.612 8.373 1.666 234 HG SER 31 HG SER 31 20.457 7.942 3.527 235 H LEU 32 H LEU 32 17.577 11.862 2.064 236 HA LEU 32 HA LEU 32 16.676 11.504 -0.718 237 HB2 LEU 32 HB2 LEU 32 15.553 12.941 1.734 238 HB3 LEU 32 HB3 LEU 32 14.773 13.021 0.182 239 HG LEU 32 HG LEU 32 15.348 10.416 1.640 240 HD11 LEU 32 HD11 LEU 32 13.791 11.815 2.942 241 HD12 LEU 32 HD12 LEU 32 12.742 11.970 1.518 242 HD13 LEU 32 HD13 LEU 32 12.987 10.386 2.276 243 HD21 LEU 32 HD23 LEU 32 13.708 9.434 0.101 244 HD22 LEU 32 HD21 LEU 32 13.496 10.992 -0.713 245 HD23 LEU 32 HD22 LEU 32 15.042 10.118 -0.808 246 H LEU 33 H LEU 33 17.946 14.056 1.463 247 HA LEU 33 HA LEU 33 17.780 16.232 -0.260 248 HB2 LEU 33 HB2 LEU 33 18.427 16.202 2.176 249 HB3 LEU 33 HB3 LEU 33 20.018 15.634 1.698 250 HG LEU 33 HG LEU 33 20.328 17.745 0.361 251 HD11 LEU 33 HD11 LEU 33 18.871 19.661 0.840 252 HD12 LEU 33 HD12 LEU 33 17.977 18.392 0.030 253 HD13 LEU 33 HD13 LEU 33 17.779 18.624 1.784 254 HD21 LEU 33 HD23 LEU 33 19.837 18.117 3.326 255 HD22 LEU 33 HD21 LEU 33 21.283 17.400 2.595 256 HD23 LEU 33 HD22 LEU 33 20.897 19.087 2.277 257 H ASP 34 H ASP 34 20.373 13.840 0.146 258 HA ASP 34 HA ASP 34 22.331 14.866 -1.547 259 HB2 ASP 34 HB2 ASP 34 22.727 13.026 0.086 260 HB3 ASP 34 HB3 ASP 34 21.539 12.013 -0.748 261 H LYS 35 H LYS 35 19.494 13.113 -2.361 262 HA LYS 35 HA LYS 35 20.433 12.776 -5.190 263 HB2 LYS 35 HB2 LYS 35 18.364 11.216 -3.716 264 HB3 LYS 35 HB3 LYS 35 18.950 10.976 -5.384 265 HG2 LYS 35 HG2 LYS 35 21.318 10.847 -4.290 266 HG3 LYS 35 HG3 LYS 35 20.449 10.737 -2.741 267 HD2 LYS 35 HD2 LYS 35 19.116 8.877 -4.154 268 HD3 LYS 35 HD3 LYS 35 20.693 8.818 -4.973 269 HE2 LYS 35 HE2 LYS 35 20.165 8.660 -1.964 270 HE3 LYS 35 HE3 LYS 35 20.424 7.232 -2.971 271 HZ1 LYS 35 HZ3 LYS 35 22.478 7.794 -1.896 272 HZ2 LYS 35 HZ1 LYS 35 22.665 8.102 -3.482 273 HZ3 LYS 35 HZ2 LYS 35 22.453 9.355 -2.444 274 H ASN 36 H ASN 36 19.261 15.171 -3.673 275 HA ASN 36 HA ASN 36 17.679 16.751 -3.826 276 HB2 ASN 36 HB2 ASN 36 17.470 17.831 -5.885 277 HB3 ASN 36 HB3 ASN 36 19.099 17.203 -5.727 278 HD21 ASN 36 HD22 ASN 36 15.932 16.410 -7.113 279 HD22 ASN 36 HD21 ASN 36 16.536 15.766 -8.650 280 H TYR 37 H TYR 37 16.425 14.253 -3.189 281 HA TYR 37 HA TYR 37 13.808 14.268 -4.493 282 HB2 TYR 37 HB2 TYR 37 14.926 13.102 -1.933 283 HB3 TYR 37 HB3 TYR 37 13.208 13.102 -2.235 284 HD1 TYR 37 HD2 TYR 37 16.437 11.582 -3.186 285 HD2 TYR 37 HD1 TYR 37 12.170 11.610 -3.797 286 HE1 TYR 37 HE2 TYR 37 16.652 9.625 -4.691 287 HE2 TYR 37 HE1 TYR 37 12.385 9.652 -5.324 288 HH TYR 37 HH TYR 37 15.541 8.179 -6.156 289 H ILE 38 H ILE 38 15.388 16.261 -2.148 290 HA ILE 38 HA ILE 38 12.944 17.815 -1.614 291 HB ILE 38 HB ILE 38 13.535 17.835 0.817 292 HG12 ILE 38 HG12 ILE 38 15.442 15.561 0.099 293 HG13 ILE 38 HG13 ILE 38 15.915 17.198 0.573 294 HG21 ILE 38 HG21 ILE 38 11.742 16.309 0.027 295 HG22 ILE 38 HG22 ILE 38 12.955 15.007 -0.122 296 HG23 ILE 38 HG23 ILE 38 12.574 15.707 1.454 297 HD11 ILE 38 HD13 ILE 38 16.209 15.739 2.391 298 HD12 ILE 38 HD11 ILE 38 14.856 16.845 2.775 299 HD13 ILE 38 HD12 ILE 38 14.550 15.143 2.328 300 H SER 39 H SER 39 13.642 19.819 -0.362 301 HA SER 39 HA SER 39 16.309 20.840 -1.230 302 HB2 SER 39 HB2 SER 39 13.881 22.446 -0.347 303 HB3 SER 39 HB3 SER 39 15.306 23.014 -1.232 304 HG SER 39 HG SER 39 13.239 21.275 -2.138 305 H GLU 40 H GLU 40 17.404 22.251 0.469 306 HA GLU 40 HA GLU 40 17.473 20.965 2.990 307 HB2 GLU 40 HB2 GLU 40 18.440 23.736 2.167 308 HB3 GLU 40 HB3 GLU 40 18.836 22.943 3.698 309 HG2 GLU 40 HG2 GLU 40 19.884 21.058 2.449 310 HG3 GLU 40 HG3 GLU 40 19.550 21.873 0.929 311 H ASN 41 H ASN 41 15.571 23.780 1.920 312 HA ASN 41 HA ASN 41 14.618 24.658 4.443 313 HB2 ASN 41 HB2 ASN 41 14.223 25.893 2.328 314 HB3 ASN 41 HB3 ASN 41 13.167 24.600 1.747 315 HD21 ASN 41 HD22 ASN 41 10.979 24.402 2.662 316 HD22 ASN 41 HD21 ASN 41 10.346 25.674 3.677 317 H TYR 42 H TYR 42 13.602 21.889 2.446 318 HA TYR 42 HA TYR 42 11.083 21.380 3.675 319 HB2 TYR 42 HB2 TYR 42 11.929 20.394 1.530 320 HB3 TYR 42 HB3 TYR 42 13.096 19.454 2.448 321 HD1 TYR 42 HD2 TYR 42 9.502 19.898 1.774 322 HD2 TYR 42 HD1 TYR 42 12.533 17.426 3.582 323 HE1 TYR 42 HE2 TYR 42 7.879 18.019 1.917 324 HE2 TYR 42 HE1 TYR 42 10.931 15.539 3.716 325 HH TYR 42 HH TYR 42 7.517 15.902 2.761 326 H ILE 43 H ILE 43 14.374 20.143 4.322 327 HA ILE 43 HA ILE 43 13.822 18.476 6.516 328 HB ILE 43 HB ILE 43 16.331 20.063 5.941 329 HG12 ILE 43 HG12 ILE 43 15.251 17.363 5.023 330 HG13 ILE 43 HG13 ILE 43 15.615 18.762 4.000 331 HG21 ILE 43 HG21 ILE 43 17.471 18.434 7.313 332 HG22 ILE 43 HG22 ILE 43 16.130 19.068 8.269 333 HG23 ILE 43 HG23 ILE 43 15.990 17.473 7.517 334 HD11 ILE 43 HD13 ILE 43 17.979 18.572 4.543 335 HD12 ILE 43 HD11 ILE 43 17.630 17.086 5.472 336 HD13 ILE 43 HD12 ILE 43 17.288 17.136 3.735 337 H GLN 44 H GLN 44 14.774 21.976 6.409 338 HA GLN 44 HA GLN 44 14.685 22.180 9.239 339 HB2 GLN 44 HB2 GLN 44 15.963 23.662 7.523 340 HB3 GLN 44 HB3 GLN 44 14.467 24.587 7.422 341 HG2 GLN 44 HG2 GLN 44 15.996 25.593 9.070 342 HG3 GLN 44 HG3 GLN 44 14.570 24.982 9.894 343 HE21 GLN 44 HE22 GLN 44 15.127 23.997 11.865 344 HE22 GLN 44 HE21 GLN 44 16.528 22.990 12.114 345 H ALA 45 H ALA 45 12.104 22.563 6.847 346 HA ALA 45 HA ALA 45 10.216 23.839 8.523 347 HB1 ALA 45 HB3 ALA 45 8.512 22.879 7.077 348 HB2 ALA 45 HB1 ALA 45 9.888 23.376 6.068 349 HB3 ALA 45 HB2 ALA 45 9.621 21.656 6.466 350 H ILE 46 H ILE 46 11.228 20.385 8.318 351 HA ILE 46 HA ILE 46 9.162 19.420 10.081 352 HB ILE 46 HB ILE 46 11.908 18.205 9.582 353 HG12 ILE 46 HG12 ILE 46 9.423 17.654 7.959 354 HG13 ILE 46 HG13 ILE 46 10.734 18.660 7.405 355 HG21 ILE 46 HG21 ILE 46 10.876 16.134 10.236 356 HG22 ILE 46 HG22 ILE 46 10.445 17.318 11.470 357 HG23 ILE 46 HG23 ILE 46 9.250 16.864 10.242 358 HD11 ILE 46 HD13 ILE 46 10.986 16.491 6.424 359 HD12 ILE 46 HD11 ILE 46 12.319 16.790 7.556 360 HD13 ILE 46 HD12 ILE 46 10.996 15.696 8.007 361 H LYS 47 H LYS 47 12.662 20.248 10.454 362 HA LYS 47 HA LYS 47 12.818 19.649 13.200 363 HB2 LYS 47 HB2 LYS 47 14.273 21.718 11.513 364 HB3 LYS 47 HB3 LYS 47 14.782 21.306 13.150 365 HG2 LYS 47 HG2 LYS 47 15.494 19.109 12.475 366 HG3 LYS 47 HG3 LYS 47 14.723 19.263 10.885 367 HD2 LYS 47 HD2 LYS 47 16.219 21.047 10.263 368 HD3 LYS 47 HD3 LYS 47 16.978 21.058 11.867 369 HE2 LYS 47 HE2 LYS 47 18.030 18.932 11.452 370 HE3 LYS 47 HE3 LYS 47 17.108 18.685 9.974 371 HZ1 LYS 47 HZ3 LYS 47 19.286 19.471 9.374 372 HZ2 LYS 47 HZ1 LYS 47 18.278 20.728 9.104 373 HZ3 LYS 47 HZ2 LYS 47 19.220 20.721 10.432 374 H ASP 48 H ASP 48 11.997 22.751 11.566 375 HA ASP 48 HA ASP 48 11.744 24.353 13.879 376 HB2 ASP 48 HB2 ASP 48 11.955 25.277 11.633 377 HB3 ASP 48 HB3 ASP 48 10.422 24.544 11.146 378 H SER 49 H SER 49 9.241 22.463 12.059 379 HA SER 49 HA SER 49 7.054 23.214 13.734 380 HB2 SER 49 HB2 SER 49 7.463 20.634 12.159 381 HB3 SER 49 HB3 SER 49 5.920 21.286 12.742 382 HG SER 49 HG SER 49 7.661 22.300 10.745 383 H THR 50 H THR 50 9.449 20.593 13.935 384 HA THR 50 HA THR 50 8.339 19.177 16.104 385 HB THR 50 HB THR 50 11.224 19.436 15.205 386 HG1 THR 50 HG1 THR 50 9.956 18.673 13.572 387 HG21 THR 50 HG23 THR 50 11.116 18.417 17.438 388 HG22 THR 50 HG21 THR 50 9.886 17.268 16.860 389 HG23 THR 50 HG22 THR 50 11.530 17.231 16.187 390 H ILE 51 H ILE 51 10.773 21.851 16.059 391 HA ILE 51 HA ILE 51 10.990 22.042 18.903 392 HB ILE 51 HB ILE 51 11.584 23.940 16.606 393 HG12 ILE 51 HG12 ILE 51 13.484 22.426 18.460 394 HG13 ILE 51 HG13 ILE 51 12.912 21.750 16.945 395 HG21 ILE 51 HG21 ILE 51 11.193 25.357 18.582 396 HG22 ILE 51 HG22 ILE 51 12.294 24.347 19.547 397 HG23 ILE 51 HG23 ILE 51 12.902 25.325 18.195 398 HD11 ILE 51 HD13 ILE 51 13.894 23.678 15.703 399 HD12 ILE 51 HD11 ILE 51 14.608 24.256 17.231 400 HD13 ILE 51 HD12 ILE 51 15.081 22.686 16.572 401 H ASN 52 H ASN 52 8.809 23.665 16.553 402 HA ASN 52 HA ASN 52 7.840 25.615 18.399 403 HB2 ASN 52 HB2 ASN 52 6.964 24.598 15.683 404 HB3 ASN 52 HB3 ASN 52 5.811 25.515 16.618 405 HD21 ASN 52 HD22 ASN 52 9.119 25.713 15.286 406 HD22 ASN 52 HD21 ASN 52 9.165 27.457 15.194 407 H ASN 53 H ASN 53 6.644 22.374 17.562 408 HA ASN 53 HA ASN 53 4.498 22.615 19.633 409 HB2 ASN 53 HB2 ASN 53 3.183 23.240 17.869 410 HB3 ASN 53 HB3 ASN 53 4.239 22.535 16.659 411 HD21 ASN 53 HD22 ASN 53 3.751 20.589 15.778 412 HD22 ASN 53 HD21 ASN 53 2.426 19.571 16.290 413 H GLY 54 H GLY 54 6.123 20.413 17.240 414 HA2 GLY 54 HA2 GLY 54 7.106 18.547 18.880 415 HA3 GLY 54 HA3 GLY 54 5.400 18.064 18.855 416 HA PRO 55 HA PRO 55 7.971 16.559 15.106 417 HB2 PRO 55 HB2 PRO 55 7.769 13.810 15.619 418 HB3 PRO 55 HB3 PRO 55 9.140 14.860 16.078 419 HG2 PRO 55 HG2 PRO 55 6.774 14.028 17.763 420 HG3 PRO 55 HG3 PRO 55 8.508 14.059 18.213 421 HD2 PRO 55 HD2 PRO 55 6.821 16.035 18.953 422 HD3 PRO 55 HD3 PRO 55 8.480 16.434 18.418 423 H TYR 56 H TYR 56 7.040 15.925 13.222 424 HA TYR 56 HA TYR 56 4.426 16.517 12.800 425 HB2 TYR 56 HB2 TYR 56 6.632 15.419 11.241 426 HB3 TYR 56 HB3 TYR 56 5.125 14.709 10.726 427 HD1 TYR 56 HD2 TYR 56 6.769 18.021 11.350 428 HD2 TYR 56 HD1 TYR 56 3.736 15.826 9.205 429 HE1 TYR 56 HE2 TYR 56 6.466 19.948 9.811 430 HE2 TYR 56 HE1 TYR 56 3.431 17.739 7.663 431 HH TYR 56 HH TYR 56 5.343 20.761 7.924 432 H TYR 57 H TYR 57 5.632 13.158 13.386 433 HA TYR 57 HA TYR 57 2.940 12.292 13.993 434 HB2 TYR 57 HB2 TYR 57 4.543 10.912 11.802 435 HB3 TYR 57 HB3 TYR 57 3.150 10.232 12.591 436 HD1 TYR 57 HD2 TYR 57 0.866 11.152 12.233 437 HD2 TYR 57 HD1 TYR 57 4.282 12.496 9.969 438 HE1 TYR 57 HE2 TYR 57 -0.653 12.065 10.508 439 HE2 TYR 57 HE1 TYR 57 2.766 13.456 8.253 440 HH TYR 57 HH TYR 57 -0.811 13.111 8.448 441 H ILE 58 H ILE 58 3.025 10.671 15.409 442 HA ILE 58 HA ILE 58 5.489 9.209 16.078 443 HB ILE 58 HB ILE 58 3.654 10.674 18.015 444 HG12 ILE 58 HG12 ILE 58 5.349 12.178 17.255 445 HG13 ILE 58 HG13 ILE 58 5.662 11.730 18.921 446 HG21 ILE 58 HG21 ILE 58 5.772 8.541 18.595 447 HG22 ILE 58 HG22 ILE 58 5.061 9.602 19.834 448 HG23 ILE 58 HG23 ILE 58 4.043 8.462 18.950 449 HD11 ILE 58 HD13 ILE 58 7.162 10.824 16.448 450 HD12 ILE 58 HD11 ILE 58 7.782 11.748 17.816 451 HD13 ILE 58 HD12 ILE 58 7.379 10.041 18.018 452 H LEU 59 H LEU 59 4.896 7.060 16.273 453 HA LEU 59 HA LEU 59 2.014 6.511 15.663 454 HB2 LEU 59 HB2 LEU 59 4.447 4.904 14.817 455 HB3 LEU 59 HB3 LEU 59 2.783 4.649 14.345 456 HG LEU 59 HG LEU 59 3.876 5.574 12.514 457 HD11 LEU 59 HD11 LEU 59 2.301 7.883 13.672 458 HD12 LEU 59 HD12 LEU 59 2.680 7.586 11.964 459 HD13 LEU 59 HD13 LEU 59 1.630 6.463 12.840 460 HD21 LEU 59 HD23 LEU 59 5.783 6.634 13.898 461 HD22 LEU 59 HD21 LEU 59 5.332 7.306 12.347 462 HD23 LEU 59 HD22 LEU 59 4.794 8.114 13.818 463 H ALA 60 H ALA 60 4.737 5.623 17.712 464 HA ALA 60 HA ALA 60 3.125 4.044 19.484 465 HB1 ALA 60 HB3 ALA 60 3.530 2.345 17.659 466 HB2 ALA 60 HB1 ALA 60 5.277 2.648 17.808 467 HB3 ALA 60 HB2 ALA 60 4.383 1.910 19.143 468 HA PRO 61 HA PRO 61 6.547 5.180 22.211 469 HB2 PRO 61 HB2 PRO 61 6.710 2.198 22.793 470 HB3 PRO 61 HB3 PRO 61 6.823 3.562 23.942 471 HG2 PRO 61 HG2 PRO 61 4.499 2.222 23.691 472 HG3 PRO 61 HG3 PRO 61 4.471 4.017 23.733 473 HD2 PRO 61 HD2 PRO 61 4.301 2.185 21.340 474 HD3 PRO 61 HD3 PRO 61 3.358 3.664 21.697 475 H GLY 62 H GLY 62 8.419 5.775 21.259 476 HA2 GLY 62 HA2 GLY 62 10.609 5.471 20.666 477 HA3 GLY 62 HA3 GLY 62 10.356 3.744 20.461 478 H VAL 63 H VAL 63 7.922 5.294 18.617 479 HA VAL 63 HA VAL 63 9.594 5.068 16.150 480 HB VAL 63 HB VAL 63 6.778 4.030 16.654 481 HG11 VAL 63 HG11 VAL 63 8.492 3.684 14.159 482 HG12 VAL 63 HG12 VAL 63 6.829 3.100 14.379 483 HG13 VAL 63 HG13 VAL 63 7.153 4.819 14.299 484 HG21 VAL 63 HG23 VAL 63 8.396 2.577 17.744 485 HG22 VAL 63 HG21 VAL 63 7.856 1.784 16.272 486 HG23 VAL 63 HG22 VAL 63 9.437 2.574 16.304 487 H ALA 64 H ALA 64 9.513 6.766 14.844 488 HA ALA 64 HA ALA 64 7.192 8.638 14.900 489 HB1 ALA 64 HB3 ALA 64 10.129 9.392 14.575 490 HB2 ALA 64 HB1 ALA 64 8.745 10.497 14.614 491 HB3 ALA 64 HB2 ALA 64 9.194 9.605 16.078 492 H MET 65 H MET 65 7.047 9.902 12.868 493 HA MET 65 HA MET 65 8.616 8.946 10.620 494 HB2 MET 65 HB2 MET 65 6.861 7.316 10.613 495 HB3 MET 65 HB3 MET 65 5.637 8.586 10.653 496 HG2 MET 65 HG2 MET 65 7.529 8.755 8.370 497 HG3 MET 65 HG3 MET 65 6.593 7.270 8.427 498 HE1 MET 65 HE3 MET 65 3.606 8.786 9.768 499 HE2 MET 65 HE1 MET 65 2.948 8.336 8.171 500 HE3 MET 65 HE2 MET 65 4.097 7.252 9.008 501 HA PRO 66 HA PRO 66 7.618 13.367 11.251 502 HB2 PRO 66 HB2 PRO 66 10.391 13.749 10.074 503 HB3 PRO 66 HB3 PRO 66 9.589 14.581 11.452 504 HG2 PRO 66 HG2 PRO 66 11.393 12.624 11.883 505 HG3 PRO 66 HG3 PRO 66 9.878 12.672 12.847 506 HD2 PRO 66 HD2 PRO 66 10.478 11.009 10.380 507 HD3 PRO 66 HD3 PRO 66 9.789 10.490 11.942 508 H HIS 67 H HIS 67 9.709 13.583 8.426 509 HA HIS 67 HA HIS 67 9.526 14.627 6.508 510 HB2 HIS 67 HB2 HIS 67 8.512 13.592 4.929 511 HB3 HIS 67 HB3 HIS 67 8.151 12.374 6.146 512 HD1 HIS 67 HD1 HIS 67 5.519 13.410 7.354 513 HD2 HIS 67 HD2 HIS 67 6.599 13.854 3.298 514 HE1 HIS 67 HE1 HIS 67 3.325 13.699 6.032 515 H ALA 68 H ALA 68 7.875 15.987 4.954 516 HA ALA 68 HA ALA 68 6.287 17.892 6.578 517 HB1 ALA 68 HB3 ALA 68 7.369 19.776 5.341 518 HB2 ALA 68 HB1 ALA 68 8.392 19.029 6.556 519 HB3 ALA 68 HB2 ALA 68 8.656 18.663 4.839 520 H ARG 69 H ARG 69 4.903 19.199 5.196 521 HA ARG 69 HA ARG 69 3.656 17.565 3.190 522 HB2 ARG 69 HB2 ARG 69 3.381 20.542 3.770 523 HB3 ARG 69 HB3 ARG 69 2.249 19.591 2.794 524 HG2 ARG 69 HG2 ARG 69 2.777 19.396 5.782 525 HG3 ARG 69 HG3 ARG 69 1.306 19.943 4.988 526 HD2 ARG 69 HD2 ARG 69 0.835 17.665 4.191 527 HD3 ARG 69 HD3 ARG 69 2.380 17.091 4.859 528 HE ARG 69 HE ARG 69 0.702 18.389 6.829 529 HH11 ARG 69 HH11 ARG 69 1.132 15.228 5.191 530 HH12 ARG 69 HH12 ARG 69 0.668 14.335 6.596 531 HH21 ARG 69 HH21 ARG 69 0.097 17.115 8.657 532 HH22 ARG 69 HH22 ARG 69 0.094 15.385 8.530 533 HA PRO 70 HA PRO 70 6.051 17.989 -0.423 534 HB2 PRO 70 HB2 PRO 70 3.520 19.098 -1.712 535 HB3 PRO 70 HB3 PRO 70 4.693 17.950 -2.404 536 HG2 PRO 70 HG2 PRO 70 2.409 17.049 -1.279 537 HG3 PRO 70 HG3 PRO 70 3.946 16.209 -0.904 538 HD2 PRO 70 HD2 PRO 70 2.396 18.152 0.787 539 HD3 PRO 70 HD3 PRO 70 3.340 16.710 1.270 540 H GLU 71 H GLU 71 3.865 20.811 -0.006 541 HA GLU 71 HA GLU 71 5.244 22.654 -1.587 542 HB2 GLU 71 HB2 GLU 71 3.844 24.326 -0.493 543 HB3 GLU 71 HB3 GLU 71 2.917 22.879 -0.879 544 HG2 GLU 71 HG2 GLU 71 3.090 22.129 1.494 545 HG3 GLU 71 HG3 GLU 71 4.026 23.572 1.883 546 H CYS 72 H CYS 72 6.393 21.378 1.368 547 HA CYS 72 HA CYS 72 7.721 23.827 2.292 548 HB2 CYS 72 HB2 CYS 72 8.044 20.938 3.216 549 HB3 CYS 72 HB3 CYS 72 8.660 22.389 4.025 550 HG CYS 72 HG CYS 72 5.590 21.392 3.411 551 H GLY 73 H GLY 73 8.313 21.730 -0.283 552 HA2 GLY 73 HA2 GLY 73 10.249 22.568 -1.587 553 HA3 GLY 73 HA3 GLY 73 11.264 22.291 -0.172 554 H ALA 74 H ALA 74 8.730 19.913 -0.925 555 HA ALA 74 HA ALA 74 10.705 17.810 -1.470 556 HB1 ALA 74 HB3 ALA 74 8.765 16.458 -1.988 557 HB2 ALA 74 HB1 ALA 74 8.494 17.310 -0.454 558 HB3 ALA 74 HB2 ALA 74 7.719 17.890 -1.955 559 H LEU 75 H LEU 75 11.121 16.889 -3.450 560 HA LEU 75 HA LEU 75 10.426 18.482 -5.885 561 HB2 LEU 75 HB2 LEU 75 13.089 17.265 -5.102 562 HB3 LEU 75 HB3 LEU 75 12.760 18.067 -6.630 563 HG LEU 75 HG LEU 75 12.721 19.408 -3.890 564 HD11 LEU 75 HD11 LEU 75 14.819 20.473 -4.615 565 HD12 LEU 75 HD12 LEU 75 14.978 18.715 -4.550 566 HD13 LEU 75 HD13 LEU 75 14.793 19.523 -6.120 567 HD21 LEU 75 HD23 LEU 75 12.526 20.620 -6.689 568 HD22 LEU 75 HD21 LEU 75 11.227 20.577 -5.478 569 HD23 LEU 75 HD22 LEU 75 12.678 21.531 -5.170 570 H LYS 76 H LYS 76 11.149 15.303 -4.445 571 HA LYS 76 HA LYS 76 9.810 14.014 -6.703 572 HB2 LYS 76 HB2 LYS 76 12.513 13.158 -5.632 573 HB3 LYS 76 HB3 LYS 76 11.555 12.253 -6.804 574 HG2 LYS 76 HG2 LYS 76 11.794 14.184 -8.400 575 HG3 LYS 76 HG3 LYS 76 12.878 14.970 -7.235 576 HD2 LYS 76 HD2 LYS 76 13.355 12.236 -8.512 577 HD3 LYS 76 HD3 LYS 76 14.083 13.760 -9.046 578 HE2 LYS 76 HE2 LYS 76 15.143 14.041 -6.810 579 HE3 LYS 76 HE3 LYS 76 14.458 12.500 -6.283 580 HZ1 LYS 76 HZ3 LYS 76 16.775 12.406 -7.040 581 HZ2 LYS 76 HZ1 LYS 76 15.808 11.364 -7.875 582 HZ3 LYS 76 HZ2 LYS 76 16.324 12.758 -8.567 583 H THR 77 H THR 77 8.988 11.854 -6.071 584 HA THR 77 HA THR 77 8.440 11.764 -3.277 585 HB THR 77 HB THR 77 7.445 10.242 -5.698 586 HG1 THR 77 HG1 THR 77 5.992 11.741 -5.855 587 HG21 THR 77 HG23 THR 77 6.255 10.427 -2.907 588 HG22 THR 77 HG21 THR 77 5.567 9.564 -4.314 589 HG23 THR 77 HG22 THR 77 7.074 8.999 -3.587 590 H GLY 78 H GLY 78 9.384 10.400 -1.790 591 HA2 GLY 78 HA2 GLY 78 10.584 7.860 -2.430 592 HA3 GLY 78 HA3 GLY 78 11.793 9.133 -2.197 593 H MET 79 H MET 79 12.197 7.394 -0.327 594 HA MET 79 HA MET 79 11.145 8.496 2.190 595 HB2 MET 79 HB2 MET 79 10.828 5.605 1.281 596 HB3 MET 79 HB3 MET 79 10.833 6.054 2.979 597 HG2 MET 79 HG2 MET 79 8.856 7.453 2.703 598 HG3 MET 79 HG3 MET 79 8.801 7.072 0.982 599 HE1 MET 79 HE3 MET 79 5.977 4.673 1.547 600 HE2 MET 79 HE1 MET 79 6.081 6.349 2.136 601 HE3 MET 79 HE2 MET 79 6.744 5.924 0.550 602 H SER 80 H SER 80 12.283 7.367 4.082 603 HA SER 80 HA SER 80 14.762 6.004 3.576 604 HB2 SER 80 HB2 SER 80 14.814 8.870 4.594 605 HB3 SER 80 HB3 SER 80 16.135 7.723 4.899 606 HG SER 80 HG SER 80 15.171 7.960 2.281 607 H LEU 81 H LEU 81 15.842 5.516 5.739 608 HA LEU 81 HA LEU 81 13.891 5.086 7.920 609 HB2 LEU 81 HB2 LEU 81 14.032 3.259 6.129 610 HB3 LEU 81 HB3 LEU 81 15.726 3.056 6.519 611 HG LEU 81 HG LEU 81 15.234 2.156 8.685 612 HD11 LEU 81 HD11 LEU 81 12.840 1.810 9.398 613 HD12 LEU 81 HD12 LEU 81 13.348 3.502 9.423 614 HD13 LEU 81 HD13 LEU 81 12.375 2.883 8.066 615 HD21 LEU 81 HD23 LEU 81 13.994 0.150 7.920 616 HD22 LEU 81 HD21 LEU 81 13.248 1.100 6.625 617 HD23 LEU 81 HD22 LEU 81 14.967 0.764 6.553 618 H THR 82 H THR 82 14.865 5.455 9.911 619 HA THR 82 HA THR 82 17.841 5.305 10.136 620 HB THR 82 HB THR 82 15.957 7.390 11.316 621 HG1 THR 82 HG1 THR 82 16.662 8.770 9.902 622 HG21 THR 82 HG23 THR 82 18.062 8.601 11.885 623 HG22 THR 82 HG21 THR 82 17.868 7.064 12.733 624 HG23 THR 82 HG22 THR 82 18.994 7.175 11.357 625 H LEU 83 H LEU 83 18.490 4.179 11.960 626 HA LEU 83 HA LEU 83 16.529 3.940 14.187 627 HB2 LEU 83 HB2 LEU 83 16.818 1.767 12.918 628 HB3 LEU 83 HB3 LEU 83 18.540 1.840 13.330 629 HG LEU 83 HG LEU 83 17.762 1.948 15.805 630 HD11 LEU 83 HD11 LEU 83 15.371 2.473 15.355 631 HD12 LEU 83 HD12 LEU 83 15.158 0.869 14.597 632 HD13 LEU 83 HD13 LEU 83 15.585 1.021 16.323 633 HD21 LEU 83 HD23 LEU 83 18.807 -0.037 14.835 634 HD22 LEU 83 HD21 LEU 83 17.487 -0.511 15.920 635 HD23 LEU 83 HD22 LEU 83 17.244 -0.543 14.162 636 H LEU 84 H LEU 84 17.353 4.540 16.108 637 HA LEU 84 HA LEU 84 20.271 5.121 16.406 638 HB2 LEU 84 HB2 LEU 84 17.775 6.345 17.617 639 HB3 LEU 84 HB3 LEU 84 19.332 6.417 18.442 640 HG LEU 84 HG LEU 84 20.330 7.744 16.741 641 HD11 LEU 84 HD11 LEU 84 19.027 8.676 14.836 642 HD12 LEU 84 HD12 LEU 84 19.333 6.947 14.693 643 HD13 LEU 84 HD13 LEU 84 17.722 7.518 15.199 644 HD21 LEU 84 HD23 LEU 84 17.565 8.740 17.550 645 HD22 LEU 84 HD21 LEU 84 19.063 8.852 18.507 646 HD23 LEU 84 HD22 LEU 84 18.897 9.763 17.001 647 H GLU 85 H GLU 85 21.268 3.771 17.926 648 HA GLU 85 HA GLU 85 19.807 1.696 19.218 649 HB2 GLU 85 HB2 GLU 85 22.605 2.786 19.719 650 HB3 GLU 85 HB3 GLU 85 21.948 1.342 20.496 651 HG2 GLU 85 HG2 GLU 85 21.589 0.299 18.269 652 HG3 GLU 85 HG3 GLU 85 22.317 1.703 17.491 653 H GLN 86 H GLN 86 21.078 4.790 20.387 654 HA GLN 86 HA GLN 86 20.085 4.381 23.113 655 HB2 GLN 86 HB2 GLN 86 21.303 6.771 21.679 656 HB3 GLN 86 HB3 GLN 86 20.881 6.784 23.380 657 HG2 GLN 86 HG2 GLN 86 22.846 4.818 22.123 658 HG3 GLN 86 HG3 GLN 86 23.307 6.297 22.958 659 HE21 GLN 86 HE22 GLN 86 22.943 2.981 23.398 660 HE22 GLN 86 HE21 GLN 86 22.748 2.956 25.131 661 H GLY 87 H GLY 87 18.861 5.834 20.178 662 HA2 GLY 87 HA2 GLY 87 16.941 6.970 19.677 663 HA3 GLY 87 HA3 GLY 87 16.343 6.735 21.331 664 H VAL 88 H VAL 88 15.954 9.196 20.056 665 HA VAL 88 HA VAL 88 17.401 10.856 21.985 666 HB VAL 88 HB VAL 88 18.297 10.978 19.415 667 HG11 VAL 88 HG11 VAL 88 17.487 12.908 18.275 668 HG12 VAL 88 HG12 VAL 88 16.174 11.729 18.480 669 HG13 VAL 88 HG13 VAL 88 16.238 13.196 19.493 670 HG21 VAL 88 HG23 VAL 88 18.199 13.270 21.371 671 HG22 VAL 88 HG21 VAL 88 19.377 11.937 21.308 672 HG23 VAL 88 HG22 VAL 88 19.295 13.102 19.979 673 H TYR 89 H TYR 89 16.097 12.997 22.249 674 HA TYR 89 HA TYR 89 13.233 12.146 22.277 675 HB2 TYR 89 HB2 TYR 89 14.340 11.762 24.394 676 HB3 TYR 89 HB3 TYR 89 14.864 13.437 24.458 677 HD1 TYR 89 HD2 TYR 89 11.377 13.021 23.234 678 HD2 TYR 89 HD1 TYR 89 13.902 13.330 26.748 679 HE1 TYR 89 HE2 TYR 89 9.448 13.664 24.583 680 HE2 TYR 89 HE1 TYR 89 11.939 13.972 28.100 681 HH TYR 89 HH TYR 89 9.655 14.434 28.091 682 H PHE 90 H PHE 90 12.601 13.281 20.558 683 HA PHE 90 HA PHE 90 12.888 15.965 19.915 684 HB2 PHE 90 HB2 PHE 90 10.502 14.086 19.829 685 HB3 PHE 90 HB3 PHE 90 10.491 15.676 19.069 686 HD1 PHE 90 HD1 PHE 90 12.914 16.046 17.681 687 HD2 PHE 90 HD2 PHE 90 10.623 12.424 18.118 688 HE1 PHE 90 HE1 PHE 90 13.848 15.208 15.559 689 HE2 PHE 90 HE2 PHE 90 11.541 11.594 15.966 690 HZ PHE 90 HZ PHE 90 13.144 13.004 14.672 691 HA PRO 91 HA PRO 91 10.634 18.089 23.250 692 HB2 PRO 91 HB2 PRO 91 10.146 20.483 21.997 693 HB3 PRO 91 HB3 PRO 91 11.755 20.031 22.642 694 HG2 PRO 91 HG2 PRO 91 10.740 19.729 19.800 695 HG3 PRO 91 HG3 PRO 91 12.280 20.485 20.342 696 HD2 PRO 91 HD2 PRO 91 12.164 17.932 19.461 697 HD3 PRO 91 HD3 PRO 91 13.211 18.360 20.850 698 H GLY 92 H GLY 92 8.378 18.795 23.563 699 HA2 GLY 92 HA2 GLY 92 6.128 18.953 23.121 700 HA3 GLY 92 HA3 GLY 92 6.453 18.683 21.404 701 H ASN 93 H ASN 93 7.847 16.165 21.722 702 HA ASN 93 HA ASN 93 5.712 14.225 22.026 703 HB2 ASN 93 HB2 ASN 93 7.766 14.124 20.493 704 HB3 ASN 93 HB3 ASN 93 8.718 13.769 21.934 705 HD21 ASN 93 HD22 ASN 93 9.189 11.827 20.482 706 HD22 ASN 93 HD21 ASN 93 8.139 10.452 20.695 707 H ASP 94 H ASP 94 6.347 12.214 23.520 708 HA ASP 94 HA ASP 94 6.753 13.289 26.275 709 HB2 ASP 94 HB2 ASP 94 4.490 12.505 25.714 710 HB3 ASP 94 HB3 ASP 94 5.141 10.924 25.274 711 H GLU 95 H GLU 95 8.038 10.900 24.012 712 HA GLU 95 HA GLU 95 10.040 10.202 26.017 713 HB2 GLU 95 HB2 GLU 95 9.521 7.979 26.180 714 HB3 GLU 95 HB3 GLU 95 7.921 8.699 26.005 715 HG2 GLU 95 HG2 GLU 95 7.977 8.114 23.555 716 HG3 GLU 95 HG3 GLU 95 9.490 7.244 23.855 717 HA PRO 96 HA PRO 96 12.947 10.089 22.754 718 HB2 PRO 96 HB2 PRO 96 13.838 7.328 23.532 719 HB3 PRO 96 HB3 PRO 96 14.815 8.814 23.332 720 HG2 PRO 96 HG2 PRO 96 14.179 7.848 25.794 721 HG3 PRO 96 HG3 PRO 96 14.187 9.610 25.468 722 HD2 PRO 96 HD2 PRO 96 11.813 7.732 25.570 723 HD3 PRO 96 HD3 PRO 96 11.991 9.376 26.257 724 H ILE 97 H ILE 97 13.383 9.260 20.679 725 HA ILE 97 HA ILE 97 11.689 7.007 19.676 726 HB ILE 97 HB ILE 97 12.647 9.529 18.272 727 HG12 ILE 97 HG12 ILE 97 10.818 10.129 19.686 728 HG13 ILE 97 HG13 ILE 97 10.224 10.058 18.043 729 HG21 ILE 97 HG21 ILE 97 10.975 7.245 17.137 730 HG22 ILE 97 HG22 ILE 97 11.438 8.741 16.314 731 HG23 ILE 97 HG23 ILE 97 12.665 7.564 16.729 732 HD11 ILE 97 HD13 ILE 97 9.170 7.843 18.524 733 HD12 ILE 97 HD11 ILE 97 9.749 7.950 20.209 734 HD13 ILE 97 HD12 ILE 97 8.588 9.100 19.613 735 H LYS 98 H LYS 98 12.771 5.359 18.939 736 HA LYS 98 HA LYS 98 15.713 5.598 18.473 737 HB2 LYS 98 HB2 LYS 98 13.865 3.225 18.866 738 HB3 LYS 98 HB3 LYS 98 15.514 3.093 18.234 739 HG2 LYS 98 HG2 LYS 98 16.440 4.004 20.304 740 HG3 LYS 98 HG3 LYS 98 14.821 4.277 20.952 741 HD2 LYS 98 HD2 LYS 98 15.917 2.234 21.866 742 HD3 LYS 98 HD3 LYS 98 14.368 1.913 21.072 743 HE2 LYS 98 HE2 LYS 98 15.559 1.144 19.035 744 HE3 LYS 98 HE3 LYS 98 17.116 1.479 19.799 745 HZ1 LYS 98 HZ3 LYS 98 15.159 -0.430 20.945 746 HZ2 LYS 98 HZ1 LYS 98 16.266 -0.890 19.851 747 HZ3 LYS 98 HZ2 LYS 98 16.749 -0.295 21.310 748 H LEU 99 H LEU 99 12.538 4.980 16.859 749 HA LEU 99 HA LEU 99 14.087 4.497 14.344 750 HB2 LEU 99 HB2 LEU 99 12.918 2.531 15.322 751 HB3 LEU 99 HB3 LEU 99 11.391 3.370 15.134 752 HG LEU 99 HG LEU 99 12.009 1.610 13.500 753 HD11 LEU 99 HD11 LEU 99 11.149 4.289 12.378 754 HD12 LEU 99 HD12 LEU 99 11.146 2.803 11.445 755 HD13 LEU 99 HD13 LEU 99 10.156 2.920 12.904 756 HD21 LEU 99 HD23 LEU 99 13.501 1.753 11.757 757 HD22 LEU 99 HD21 LEU 99 13.630 3.506 11.872 758 HD23 LEU 99 HD22 LEU 99 14.417 2.460 13.075 759 H LEU 100 H LEU 100 13.729 5.714 12.661 760 HA LEU 100 HA LEU 100 11.332 7.490 12.632 761 HB2 LEU 100 HB2 LEU 100 14.056 8.366 11.612 762 HB3 LEU 100 HB3 LEU 100 12.594 9.297 11.763 763 HG LEU 100 HG LEU 100 12.897 8.712 14.375 764 HD11 LEU 100 HD11 LEU 100 14.988 7.323 14.046 765 HD12 LEU 100 HD12 LEU 100 15.782 8.759 13.376 766 HD13 LEU 100 HD13 LEU 100 15.250 8.739 15.067 767 HD21 LEU 100 HD23 LEU 100 12.783 10.963 13.438 768 HD22 LEU 100 HD21 LEU 100 14.083 10.852 14.643 769 HD23 LEU 100 HD22 LEU 100 14.479 10.860 12.912 770 H ILE 101 H ILE 101 10.270 7.428 10.703 771 HA ILE 101 HA ILE 101 11.728 6.388 8.319 772 HB ILE 101 HB ILE 101 8.773 6.108 9.050 773 HG12 ILE 101 HG12 ILE 101 11.139 4.408 9.141 774 HG13 ILE 101 HG13 ILE 101 9.565 4.225 9.878 775 HG21 ILE 101 HG21 ILE 101 8.869 6.966 6.773 776 HG22 ILE 101 HG22 ILE 101 10.042 5.711 6.321 777 HG23 ILE 101 HG23 ILE 101 8.373 5.295 6.796 778 HD11 ILE 101 HD13 ILE 101 8.704 3.288 7.725 779 HD12 ILE 101 HD11 ILE 101 10.353 3.429 7.056 780 HD13 ILE 101 HD12 ILE 101 10.032 2.347 8.429 781 H GLY 102 H GLY 102 11.940 7.738 6.682 782 HA2 GLY 102 HA2 GLY 102 10.784 10.488 6.877 783 HA3 GLY 102 HA3 GLY 102 12.298 10.065 6.048 784 H LEU 103 H LEU 103 10.084 11.349 4.798 785 HA LEU 103 HA LEU 103 9.466 9.555 2.583 786 HB2 LEU 103 HB2 LEU 103 7.593 9.378 4.394 787 HB3 LEU 103 HB3 LEU 103 7.271 11.061 4.055 788 HG LEU 103 HG LEU 103 6.801 8.607 2.287 789 HD11 LEU 103 HD11 LEU 103 4.952 10.888 3.187 790 HD12 LEU 103 HD12 LEU 103 4.504 9.277 2.591 791 HD13 LEU 103 HD13 LEU 103 5.220 9.477 4.190 792 HD21 LEU 103 HD23 LEU 103 5.670 10.336 0.724 793 HD22 LEU 103 HD21 LEU 103 6.708 11.528 1.472 794 HD23 LEU 103 HD22 LEU 103 7.393 10.080 0.629 795 H SER 104 H SER 104 9.067 10.968 0.698 796 HA SER 104 HA SER 104 8.935 13.863 1.061 797 HB2 SER 104 HB2 SER 104 10.592 14.316 -0.651 798 HB3 SER 104 HB3 SER 104 11.332 13.496 0.731 799 HG SER 104 HG SER 104 10.910 12.649 -1.889 800 H ALA 105 H ALA 105 7.607 14.724 -0.741 801 HA ALA 105 HA ALA 105 6.791 12.785 -2.785 802 HB1 ALA 105 HB3 ALA 105 5.248 12.242 -0.965 803 HB2 ALA 105 HB1 ALA 105 4.842 13.967 -0.773 804 HB3 ALA 105 HB2 ALA 105 4.392 13.105 -2.259 805 H ALA 106 H ALA 106 6.501 13.838 -4.670 806 HA ALA 106 HA ALA 106 6.867 16.702 -4.689 807 HB1 ALA 106 HB3 ALA 106 7.827 15.231 -6.443 808 HB2 ALA 106 HB1 ALA 106 6.188 14.760 -6.954 809 HB3 ALA 106 HB2 ALA 106 6.740 16.436 -7.154 810 H ASP 107 H ASP 107 4.071 14.621 -4.536 811 HA ASP 107 HA ASP 107 2.293 16.990 -4.830 812 HB2 ASP 107 HB2 ASP 107 2.299 15.880 -7.031 813 HB3 ASP 107 HB3 ASP 107 1.898 14.340 -6.270 814 H ALA 108 H ALA 108 0.273 16.760 -3.708 815 HA ALA 108 HA ALA 108 0.557 15.539 -1.199 816 HB1 ALA 108 HB3 ALA 108 -1.779 16.228 -0.826 817 HB2 ALA 108 HB1 ALA 108 -0.842 17.524 -1.595 818 HB3 ALA 108 HB2 ALA 108 -1.974 16.544 -2.562 819 H ASP 109 H ASP 109 -1.002 14.247 -4.146 820 HA ASP 109 HA ASP 109 -2.268 12.052 -2.645 821 HB2 ASP 109 HB2 ASP 109 -3.361 12.865 -4.618 822 HB3 ASP 109 HB3 ASP 109 -1.914 12.549 -5.604 823 H SER 110 H SER 110 0.735 12.611 -4.456 824 HA SER 110 HA SER 110 1.667 9.891 -4.378 825 HB2 SER 110 HB2 SER 110 3.344 12.439 -4.326 826 HB3 SER 110 HB3 SER 110 3.850 10.821 -4.814 827 HG SER 110 HG SER 110 3.329 12.078 -6.629 828 H HIS 111 H HIS 111 1.850 12.644 -2.085 829 HA HIS 111 HA HIS 111 3.274 11.371 0.016 830 HB2 HIS 111 HB2 HIS 111 3.033 13.555 0.556 831 HB3 HIS 111 HB3 HIS 111 1.545 13.714 -0.360 832 HD1 HIS 111 HD1 HIS 111 -0.671 13.777 0.924 833 HD2 HIS 111 HD2 HIS 111 2.668 12.635 3.206 834 HE1 HIS 111 HE1 HIS 111 -1.420 13.831 3.376 835 H ILE 112 H ILE 112 -0.278 11.466 -0.624 836 HA ILE 112 HA ILE 112 -1.018 9.868 1.589 837 HB ILE 112 HB ILE 112 -2.256 10.324 -1.156 838 HG12 ILE 112 HG12 ILE 112 -2.176 12.275 0.417 839 HG13 ILE 112 HG13 ILE 112 -3.775 11.815 -0.125 840 HG21 ILE 112 HG21 ILE 112 -3.422 8.753 1.134 841 HG22 ILE 112 HG22 ILE 112 -4.373 9.427 -0.222 842 HG23 ILE 112 HG23 ILE 112 -3.122 8.221 -0.539 843 HD11 ILE 112 HD13 ILE 112 -4.237 10.783 2.046 844 HD12 ILE 112 HD11 ILE 112 -2.570 11.117 2.582 845 HD13 ILE 112 HD12 ILE 112 -3.686 12.459 2.240 846 H GLY 113 H GLY 113 -0.292 8.796 -1.814 847 HA2 GLY 113 HA2 GLY 113 -0.680 6.046 -1.323 848 HA3 GLY 113 HA3 GLY 113 0.356 6.735 -2.590 849 H ALA 114 H ALA 114 2.219 8.080 -0.882 850 HA ALA 114 HA ALA 114 4.082 5.986 -0.280 851 HB1 ALA 114 HB3 ALA 114 4.016 8.944 0.419 852 HB2 ALA 114 HB1 ALA 114 5.438 7.885 0.546 853 HB3 ALA 114 HB2 ALA 114 4.731 8.243 -1.031 854 H ILE 115 H ILE 115 2.251 8.250 1.898 855 HA ILE 115 HA ILE 115 3.002 7.296 4.335 856 HB ILE 115 HB ILE 115 0.612 8.548 3.185 857 HG12 ILE 115 HG12 ILE 115 2.576 9.961 3.660 858 HG13 ILE 115 HG13 ILE 115 1.116 10.476 4.491 859 HG21 ILE 115 HG21 ILE 115 0.678 7.515 5.977 860 HG22 ILE 115 HG22 ILE 115 -0.390 8.867 5.453 861 HG23 ILE 115 HG23 ILE 115 -0.537 7.284 4.692 862 HD11 ILE 115 HD13 ILE 115 1.914 9.584 6.598 863 HD12 ILE 115 HD11 ILE 115 3.366 8.938 5.790 864 HD13 ILE 115 HD12 ILE 115 3.110 10.687 5.896 865 H GLN 116 H GLN 116 0.309 6.223 2.164 866 HA GLN 116 HA GLN 116 -0.683 4.208 3.930 867 HB2 GLN 116 HB2 GLN 116 -1.045 4.781 0.963 868 HB3 GLN 116 HB3 GLN 116 -1.877 3.450 1.765 869 HG2 GLN 116 HG2 GLN 116 -2.062 6.365 2.612 870 HG3 GLN 116 HG3 GLN 116 -3.231 5.554 1.578 871 HE21 GLN 116 HE22 GLN 116 -3.248 6.752 4.497 872 HE22 GLN 116 HE21 GLN 116 -4.039 5.503 5.420 873 H ALA 117 H ALA 117 2.153 4.172 1.963 874 HA ALA 117 HA ALA 117 2.221 1.248 1.906 875 HB1 ALA 117 HB3 ALA 117 4.335 1.511 0.622 876 HB2 ALA 117 HB1 ALA 117 3.023 2.409 -0.161 877 HB3 ALA 117 HB2 ALA 117 4.237 3.266 0.803 878 H LEU 118 H LEU 118 3.805 4.082 3.442 879 HA LEU 118 HA LEU 118 5.612 2.325 4.844 880 HB2 LEU 118 HB2 LEU 118 6.327 4.240 6.053 881 HB3 LEU 118 HB3 LEU 118 6.255 4.493 4.297 882 HG LEU 118 HG LEU 118 4.199 5.709 4.540 883 HD11 LEU 118 HD11 LEU 118 3.642 6.820 6.649 884 HD12 LEU 118 HD12 LEU 118 3.435 5.125 6.883 885 HD13 LEU 118 HD13 LEU 118 4.900 5.891 7.505 886 HD21 LEU 118 HD23 LEU 118 6.338 6.866 4.238 887 HD22 LEU 118 HD21 LEU 118 5.369 7.782 5.402 888 HD23 LEU 118 HD22 LEU 118 6.678 6.760 5.971 889 H SER 119 H SER 119 2.456 3.573 5.469 890 HA SER 119 HA SER 119 2.153 2.780 8.144 891 HB2 SER 119 HB2 SER 119 0.055 2.633 5.938 892 HB3 SER 119 HB3 SER 119 -0.269 2.610 7.682 893 HG SER 119 HG SER 119 0.899 4.712 6.153 894 H GLU 120 H GLU 120 2.564 0.627 5.388 895 HA GLU 120 HA GLU 120 1.392 -1.700 6.602 896 HB2 GLU 120 HB2 GLU 120 3.584 -1.467 4.526 897 HB3 GLU 120 HB3 GLU 120 2.746 -2.951 4.939 898 HG2 GLU 120 HG2 GLU 120 1.294 -0.498 3.888 899 HG3 GLU 120 HG3 GLU 120 1.946 -1.741 2.830 900 H LEU 121 H LEU 121 4.205 0.174 7.112 901 HA LEU 121 HA LEU 121 5.574 -1.941 8.715 902 HB2 LEU 121 HB2 LEU 121 6.645 0.747 7.761 903 HB3 LEU 121 HB3 LEU 121 7.555 -0.518 8.570 904 HG LEU 121 HG LEU 121 6.396 -0.512 5.758 905 HD11 LEU 121 HD11 LEU 121 8.492 0.713 6.068 906 HD12 LEU 121 HD12 LEU 121 9.247 -0.713 6.815 907 HD13 LEU 121 HD13 LEU 121 8.768 -0.748 5.106 908 HD21 LEU 121 HD23 LEU 121 6.149 -2.844 6.650 909 HD22 LEU 121 HD21 LEU 121 7.393 -2.758 5.404 910 HD23 LEU 121 HD22 LEU 121 7.868 -2.848 7.103 911 H LEU 122 H LEU 122 4.973 1.638 8.893 912 HA LEU 122 HA LEU 122 5.424 1.911 11.628 913 HB2 LEU 122 HB2 LEU 122 3.743 3.451 9.601 914 HB3 LEU 122 HB3 LEU 122 3.716 3.906 11.271 915 HG LEU 122 HG LEU 122 5.224 5.340 10.161 916 HD11 LEU 122 HD11 LEU 122 7.041 3.387 11.634 917 HD12 LEU 122 HD12 LEU 122 7.242 5.133 11.445 918 HD13 LEU 122 HD13 LEU 122 5.917 4.497 12.437 919 HD21 LEU 122 HD23 LEU 122 7.144 4.665 8.911 920 HD22 LEU 122 HD21 LEU 122 6.862 2.946 9.251 921 HD23 LEU 122 HD22 LEU 122 5.736 3.875 8.237 922 H CYS 123 H CYS 123 2.444 0.679 10.174 923 HA CYS 123 HA CYS 123 1.164 0.912 12.849 924 HB2 CYS 123 HB2 CYS 123 -0.187 0.518 10.150 925 HB3 CYS 123 HB3 CYS 123 -0.970 0.837 11.699 926 HG CYS 123 HG CYS 123 0.111 3.180 12.119 927 H GLU 124 H GLU 124 3.122 -1.108 12.078 928 HA GLU 124 HA GLU 124 1.500 -3.490 12.744 929 HB2 GLU 124 HB2 GLU 124 3.539 -3.258 10.520 930 HB3 GLU 124 HB3 GLU 124 3.236 -4.799 11.326 931 HG2 GLU 124 HG2 GLU 124 0.976 -3.186 10.112 932 HG3 GLU 124 HG3 GLU 124 1.945 -4.311 9.166 933 H GLU 125 H GLU 125 1.994 -3.484 14.814 934 HA GLU 125 HA GLU 125 4.399 -2.692 15.982 935 HB2 GLU 125 HB2 GLU 125 3.630 -3.768 18.006 936 HB3 GLU 125 HB3 GLU 125 2.306 -2.929 17.198 937 HG2 GLU 125 HG2 GLU 125 1.525 -5.131 16.263 938 HG3 GLU 125 HG3 GLU 125 2.812 -5.940 17.156 939 H GLU 126 H GLU 126 3.663 -5.765 14.463 940 HA GLU 126 HA GLU 126 5.812 -7.274 15.566 941 HB2 GLU 126 HB2 GLU 126 4.497 -7.574 12.829 942 HB3 GLU 126 HB3 GLU 126 5.491 -8.781 13.661 943 HG2 GLU 126 HG2 GLU 126 3.789 -8.733 15.551 944 HG3 GLU 126 HG3 GLU 126 2.779 -7.709 14.520 945 H ILE 127 H ILE 127 5.502 -5.201 12.695 946 HA ILE 127 HA ILE 127 8.214 -5.540 11.756 947 HB ILE 127 HB ILE 127 5.985 -3.640 11.137 948 HG12 ILE 127 HG12 ILE 127 6.149 -4.533 8.913 949 HG13 ILE 127 HG13 ILE 127 7.643 -5.396 9.293 950 HG21 ILE 127 HG21 ILE 127 8.879 -3.336 10.369 951 HG22 ILE 127 HG22 ILE 127 7.575 -2.688 9.365 952 HG23 ILE 127 HG23 ILE 127 7.760 -2.120 11.024 953 HD11 ILE 127 HD13 ILE 127 5.664 -6.869 9.051 954 HD12 ILE 127 HD11 ILE 127 6.432 -7.016 10.636 955 HD13 ILE 127 HD12 ILE 127 4.921 -6.087 10.456 956 H LEU 128 H LEU 128 6.488 -3.103 13.782 957 HA LEU 128 HA LEU 128 8.590 -1.349 14.099 958 HB2 LEU 128 HB2 LEU 128 6.581 -2.082 16.261 959 HB3 LEU 128 HB3 LEU 128 7.629 -0.675 16.271 960 HG LEU 128 HG LEU 128 5.353 -1.215 14.333 961 HD11 LEU 128 HD11 LEU 128 4.378 0.786 15.313 962 HD12 LEU 128 HD12 LEU 128 4.705 -0.419 16.567 963 HD13 LEU 128 HD13 LEU 128 5.784 0.972 16.380 964 HD21 LEU 128 HD23 LEU 128 5.921 1.134 13.513 965 HD22 LEU 128 HD21 LEU 128 7.534 0.880 14.210 966 HD23 LEU 128 HD22 LEU 128 6.932 -0.190 12.929 967 H GLU 129 H GLU 129 8.083 -4.275 16.075 968 HA GLU 129 HA GLU 129 10.315 -3.739 17.766 969 HB2 GLU 129 HB2 GLU 129 8.538 -6.104 17.273 970 HB3 GLU 129 HB3 GLU 129 10.140 -6.419 17.967 971 HG2 GLU 129 HG2 GLU 129 9.768 -4.805 19.752 972 HG3 GLU 129 HG3 GLU 129 8.161 -4.418 19.114 973 H GLN 130 H GLN 130 10.004 -5.380 14.590 974 HA GLN 130 HA GLN 130 12.607 -6.595 14.782 975 HB2 GLN 130 HB2 GLN 130 10.544 -6.228 12.589 976 HB3 GLN 130 HB3 GLN 130 12.124 -6.994 12.289 977 HG2 GLN 130 HG2 GLN 130 11.736 -8.700 13.917 978 HG3 GLN 130 HG3 GLN 130 10.228 -7.949 14.453 979 HE21 GLN 130 HE22 GLN 130 8.367 -8.069 13.126 980 HE22 GLN 130 HE21 GLN 130 8.219 -9.275 11.855 981 H LEU 131 H LEU 131 11.302 -3.514 13.540 982 HA LEU 131 HA LEU 131 13.818 -2.582 12.411 983 HB2 LEU 131 HB2 LEU 131 11.553 -0.985 13.666 984 HB3 LEU 131 HB3 LEU 131 12.882 -0.330 12.731 985 HG LEU 131 HG LEU 131 10.908 -2.350 11.538 986 HD11 LEU 131 HD11 LEU 131 9.713 -0.433 12.545 987 HD12 LEU 131 HD12 LEU 131 10.656 0.661 11.524 988 HD13 LEU 131 HD13 LEU 131 9.550 -0.504 10.772 989 HD21 LEU 131 HD23 LEU 131 11.553 -1.217 9.411 990 HD22 LEU 131 HD21 LEU 131 12.715 -0.235 10.319 991 HD23 LEU 131 HD22 LEU 131 12.927 -1.992 10.214 992 H LEU 132 H LEU 132 12.077 -1.971 15.502 993 HA LEU 132 HA LEU 132 14.076 -0.461 16.739 994 HB2 LEU 132 HB2 LEU 132 11.931 -2.245 17.907 995 HB3 LEU 132 HB3 LEU 132 12.937 -1.232 18.921 996 HG LEU 132 HG LEU 132 11.304 -0.042 16.642 997 HD11 LEU 132 HD11 LEU 132 10.513 -0.389 19.566 998 HD12 LEU 132 HD12 LEU 132 9.615 0.539 18.343 999 HD13 LEU 132 HD13 LEU 132 9.783 -1.214 18.168 1000 HD21 LEU 132 HD23 LEU 132 13.123 1.367 17.481 1001 HD22 LEU 132 HD21 LEU 132 11.546 2.029 17.917 1002 HD23 LEU 132 HD22 LEU 132 12.513 1.184 19.145 1003 H THR 133 H THR 133 14.318 -3.822 16.114 1004 HA THR 133 HA THR 133 16.592 -4.047 17.998 1005 HB THR 133 HB THR 133 16.027 -6.437 18.196 1006 HG1 THR 133 HG1 THR 133 13.591 -5.781 16.915 1007 HG21 THR 133 HG23 THR 133 14.090 -6.275 19.645 1008 HG22 THR 133 HG21 THR 133 15.092 -4.831 19.874 1009 HG23 THR 133 HG22 THR 133 13.587 -4.740 18.929 1010 H ALA 134 H ALA 134 16.139 -3.357 14.909 1011 HA ALA 134 HA ALA 134 17.299 -5.377 13.342 1012 HB1 ALA 134 HB3 ALA 134 17.764 -3.615 11.730 1013 HB2 ALA 134 HB1 ALA 134 16.133 -3.429 12.417 1014 HB3 ALA 134 HB2 ALA 134 17.463 -2.378 12.957 1015 H SER 135 H SER 135 19.227 -6.303 13.464 1016 HA SER 135 HA SER 135 21.354 -5.284 15.056 1017 HB2 SER 135 HB2 SER 135 22.486 -7.344 13.864 1018 HB3 SER 135 HB3 SER 135 21.158 -7.597 15.007 1019 HG SER 135 HG SER 135 20.882 -8.789 13.070 1020 H SER 136 H SER 136 20.443 -4.630 11.759 1021 HA SER 136 HA SER 136 22.969 -3.225 11.251 1022 HB2 SER 136 HB2 SER 136 23.409 -4.579 9.197 1023 HB3 SER 136 HB3 SER 136 23.533 -5.543 10.673 1024 HG SER 136 HG SER 136 22.317 -6.714 9.270 1025 H GLU 137 H GLU 137 22.916 -2.077 9.168 1026 HA GLU 137 HA GLU 137 20.390 -0.901 8.461 1027 HB2 GLU 137 HB2 GLU 137 23.075 -1.037 7.015 1028 HB3 GLU 137 HB3 GLU 137 21.705 -0.022 6.487 1029 HG2 GLU 137 HG2 GLU 137 21.691 1.236 8.429 1030 HG3 GLU 137 HG3 GLU 137 22.873 0.213 9.258 1031 H LYS 138 H LYS 138 22.225 -3.739 7.295 1032 HA LYS 138 HA LYS 138 20.593 -4.283 5.058 1033 HB2 LYS 138 HB2 LYS 138 22.793 -5.346 5.434 1034 HB3 LYS 138 HB3 LYS 138 22.158 -6.192 6.843 1035 HG2 LYS 138 HG2 LYS 138 22.327 -7.687 4.947 1036 HG3 LYS 138 HG3 LYS 138 20.641 -7.507 5.423 1037 HD2 LYS 138 HD2 LYS 138 20.268 -5.920 3.548 1038 HD3 LYS 138 HD3 LYS 138 21.965 -6.056 3.075 1039 HE2 LYS 138 HE2 LYS 138 19.956 -8.359 3.162 1040 HE3 LYS 138 HE3 LYS 138 20.349 -7.430 1.715 1041 HZ1 LYS 138 HZ3 LYS 138 22.637 -8.212 1.897 1042 HZ2 LYS 138 HZ1 LYS 138 22.275 -9.099 3.224 1043 HZ3 LYS 138 HZ2 LYS 138 21.608 -9.466 1.786 1044 H GLN 139 H GLN 139 20.055 -5.136 8.562 1045 HA GLN 139 HA GLN 139 17.799 -6.716 7.921 1046 HB2 GLN 139 HB2 GLN 139 19.258 -7.141 9.789 1047 HB3 GLN 139 HB3 GLN 139 19.048 -5.500 10.407 1048 HG2 GLN 139 HG2 GLN 139 17.824 -7.015 11.710 1049 HG3 GLN 139 HG3 GLN 139 16.749 -5.903 10.852 1050 HE21 GLN 139 HE22 GLN 139 15.383 -6.782 9.117 1051 HE22 GLN 139 HE21 GLN 139 15.153 -8.486 8.852 1052 H LEU 140 H LEU 140 18.321 -3.188 8.520 1053 HA LEU 140 HA LEU 140 15.497 -2.610 8.882 1054 HB2 LEU 140 HB2 LEU 140 17.917 -1.007 8.053 1055 HB3 LEU 140 HB3 LEU 140 16.313 -0.321 7.957 1056 HG LEU 140 HG LEU 140 17.552 -1.369 10.505 1057 HD11 LEU 140 HD11 LEU 140 17.191 1.512 9.576 1058 HD12 LEU 140 HD12 LEU 140 17.930 0.966 11.087 1059 HD13 LEU 140 HD13 LEU 140 18.721 0.625 9.550 1060 HD21 LEU 140 HD23 LEU 140 15.801 -0.150 11.694 1061 HD22 LEU 140 HD21 LEU 140 15.011 0.221 10.149 1062 HD23 LEU 140 HD22 LEU 140 15.165 -1.465 10.719 1063 H ALA 141 H ALA 141 17.752 -2.515 6.075 1064 HA ALA 141 HA ALA 141 15.911 -2.123 4.023 1065 HB1 ALA 141 HB3 ALA 141 18.404 -3.866 3.855 1066 HB2 ALA 141 HB1 ALA 141 17.618 -2.972 2.544 1067 HB3 ALA 141 HB2 ALA 141 18.442 -2.094 3.851 1068 H ASP 142 H ASP 142 16.743 -5.253 5.588 1069 HA ASP 142 HA ASP 142 15.304 -6.910 3.816 1070 HB2 ASP 142 HB2 ASP 142 16.751 -7.937 5.407 1071 HB3 ASP 142 HB3 ASP 142 15.964 -7.123 6.754 1072 H ILE 143 H ILE 143 14.164 -5.060 6.709 1073 HA ILE 143 HA ILE 143 11.506 -6.095 6.595 1074 HB ILE 143 HB ILE 143 12.866 -3.745 7.951 1075 HG12 ILE 143 HG12 ILE 143 11.735 -6.357 9.083 1076 HG13 ILE 143 HG13 ILE 143 13.419 -6.150 8.626 1077 HG21 ILE 143 HG21 ILE 143 10.841 -3.539 9.346 1078 HG22 ILE 143 HG22 ILE 143 10.552 -3.111 7.661 1079 HG23 ILE 143 HG23 ILE 143 10.001 -4.691 8.279 1080 HD11 ILE 143 HD13 ILE 143 13.381 -5.849 10.942 1081 HD12 ILE 143 HD11 ILE 143 13.553 -4.222 10.283 1082 HD13 ILE 143 HD12 ILE 143 11.968 -4.782 10.903 1083 H ILE 144 H ILE 144 13.134 -3.253 5.166 1084 HA ILE 144 HA ILE 144 10.805 -2.159 3.887 1085 HB ILE 144 HB ILE 144 13.739 -2.162 3.031 1086 HG12 ILE 144 HG12 ILE 144 13.480 -0.860 5.010 1087 HG13 ILE 144 HG13 ILE 144 13.638 0.252 3.656 1088 HG21 ILE 144 HG21 ILE 144 12.530 -1.892 0.979 1089 HG22 ILE 144 HG22 ILE 144 11.448 -0.687 1.694 1090 HG23 ILE 144 HG23 ILE 144 13.170 -0.323 1.457 1091 HD11 ILE 144 HD13 ILE 144 11.896 1.148 4.953 1092 HD12 ILE 144 HD11 ILE 144 11.048 0.320 3.631 1093 HD13 ILE 144 HD12 ILE 144 11.167 -0.438 5.239 1094 H SER 145 H SER 145 13.155 -4.582 2.765 1095 HA SER 145 HA SER 145 11.989 -4.861 0.243 1096 HB2 SER 145 HB2 SER 145 13.638 -6.921 1.780 1097 HB3 SER 145 HB3 SER 145 13.386 -6.887 0.026 1098 HG SER 145 HG SER 145 14.744 -4.975 1.645 1099 H ARG 146 H ARG 146 11.187 -6.458 3.300 1100 HA ARG 146 HA ARG 146 9.573 -8.538 2.452 1101 HB2 ARG 146 HB2 ARG 146 10.431 -7.401 4.831 1102 HB3 ARG 146 HB3 ARG 146 8.732 -6.936 4.854 1103 HG2 ARG 146 HG2 ARG 146 8.116 -9.318 4.510 1104 HG3 ARG 146 HG3 ARG 146 9.847 -9.740 4.471 1105 HD2 ARG 146 HD2 ARG 146 8.520 -8.311 6.812 1106 HD3 ARG 146 HD3 ARG 146 8.633 -10.082 6.699 1107 HE ARG 146 HE ARG 146 11.228 -8.920 6.332 1108 HH11 ARG 146 HH11 ARG 146 8.833 -9.648 8.851 1109 HH12 ARG 146 HH12 ARG 146 10.020 -9.745 10.123 1110 HH21 ARG 146 HH21 ARG 146 12.792 -9.089 8.037 1111 HH22 ARG 146 HH22 ARG 146 12.254 -9.428 9.658 1112 H GLY 147 H GLY 147 8.893 -5.092 2.358 1113 HA2 GLY 147 HA2 GLY 147 5.971 -5.405 2.420 1114 HA3 GLY 147 HA3 GLY 147 6.909 -3.907 2.278 Start of MODEL 14 1 H MET 1 H1 MET 1 1.998 -0.880 -0.593 2 HA MET 1 HA MET 1 2.364 -1.249 -3.494 3 HB2 MET 1 HB2 MET 1 2.233 1.228 -2.679 4 HB3 MET 1 HB3 MET 1 3.763 0.877 -1.833 5 HG2 MET 1 HG2 MET 1 3.899 2.000 -4.117 6 HG3 MET 1 HG3 MET 1 4.961 0.641 -3.804 7 HE1 MET 1 HE3 MET 1 4.610 1.813 -6.660 8 HE2 MET 1 HE1 MET 1 5.609 0.389 -6.290 9 HE3 MET 1 HE2 MET 1 4.440 0.332 -7.628 10 H ARG 2 H ARG 2 4.628 -1.666 -4.087 11 HA ARG 2 HA ARG 2 5.988 -3.381 -2.167 12 HB2 ARG 2 HB2 ARG 2 6.799 -2.187 -4.870 13 HB3 ARG 2 HB3 ARG 2 7.919 -3.088 -3.853 14 HG2 ARG 2 HG2 ARG 2 7.170 -4.632 -5.436 15 HG3 ARG 2 HG3 ARG 2 6.338 -5.060 -3.935 16 HD2 ARG 2 HD2 ARG 2 4.280 -3.988 -4.751 17 HD3 ARG 2 HD3 ARG 2 5.140 -3.409 -6.199 18 HE ARG 2 HE ARG 2 5.356 -6.257 -5.952 19 HH11 ARG 2 HH11 ARG 2 3.002 -3.761 -6.879 20 HH12 ARG 2 HH12 ARG 2 2.095 -4.802 -7.910 21 HH21 ARG 2 HH21 ARG 2 4.150 -7.640 -7.332 22 HH22 ARG 2 HH22 ARG 2 2.766 -7.055 -8.170 23 H LEU 3 H LEU 3 6.837 -2.485 -0.408 24 HA LEU 3 HA LEU 3 7.095 0.277 0.095 25 HB2 LEU 3 HB2 LEU 3 8.254 -2.227 1.320 26 HB3 LEU 3 HB3 LEU 3 8.983 -0.700 1.770 27 HG LEU 3 HG LEU 3 7.220 -1.571 3.319 28 HD11 LEU 3 HD11 LEU 3 6.746 1.216 2.172 29 HD12 LEU 3 HD12 LEU 3 6.337 0.624 3.796 30 HD13 LEU 3 HD13 LEU 3 8.024 0.765 3.326 31 HD21 LEU 3 HD23 LEU 3 5.543 -2.287 1.589 32 HD22 LEU 3 HD21 LEU 3 4.879 -1.242 2.846 33 HD23 LEU 3 HD22 LEU 3 5.223 -0.592 1.238 34 H SER 4 H SER 4 9.588 -2.063 -0.930 35 HA SER 4 HA SER 4 11.811 -0.522 -0.887 36 HB2 SER 4 HB2 SER 4 11.398 -2.491 -3.128 37 HB3 SER 4 HB3 SER 4 12.780 -2.308 -2.030 38 HG SER 4 HG SER 4 11.448 -4.184 -1.682 39 H ASP 5 H ASP 5 9.147 -0.059 -3.170 40 HA ASP 5 HA ASP 5 10.635 1.089 -5.318 41 HB2 ASP 5 HB2 ASP 5 8.280 0.367 -5.513 42 HB3 ASP 5 HB3 ASP 5 7.797 1.632 -4.375 43 H TYR 6 H TYR 6 9.570 2.328 -2.180 44 HA TYR 6 HA TYR 6 10.010 5.121 -2.966 45 HB2 TYR 6 HB2 TYR 6 9.117 3.845 -0.365 46 HB3 TYR 6 HB3 TYR 6 9.289 5.578 -0.594 47 HD1 TYR 6 HD2 TYR 6 7.820 6.901 -1.950 48 HD2 TYR 6 HD1 TYR 6 7.111 2.666 -1.368 49 HE1 TYR 6 HE2 TYR 6 5.570 7.140 -2.944 50 HE2 TYR 6 HE1 TYR 6 4.833 2.946 -2.247 51 HH TYR 6 HH TYR 6 3.597 6.055 -3.541 52 H PHE 7 H PHE 7 11.997 2.630 -1.464 53 HA PHE 7 HA PHE 7 13.667 4.687 -0.100 54 HB2 PHE 7 HB2 PHE 7 13.725 1.662 0.187 55 HB3 PHE 7 HB3 PHE 7 14.716 2.811 1.071 56 HD1 PHE 7 HD1 PHE 7 11.167 1.864 0.423 57 HD2 PHE 7 HD2 PHE 7 13.923 3.468 3.320 58 HE1 PHE 7 HE1 PHE 7 9.297 2.227 1.982 59 HE2 PHE 7 HE2 PHE 7 12.023 3.904 4.843 60 HZ PHE 7 HZ PHE 7 9.713 3.309 4.186 61 HA PRO 8 HA PRO 8 15.652 4.123 -4.151 62 HB2 PRO 8 HB2 PRO 8 17.304 6.312 -4.208 63 HB3 PRO 8 HB3 PRO 8 15.535 6.377 -4.429 64 HG2 PRO 8 HG2 PRO 8 17.077 6.883 -1.855 65 HG3 PRO 8 HG3 PRO 8 15.799 7.894 -2.594 66 HD2 PRO 8 HD2 PRO 8 15.203 6.133 -0.643 67 HD3 PRO 8 HD3 PRO 8 14.125 6.383 -2.042 68 H GLU 9 H GLU 9 18.253 5.531 -2.197 69 HA GLU 9 HA GLU 9 19.601 3.088 -1.610 70 HB2 GLU 9 HB2 GLU 9 20.316 3.791 -4.079 71 HB3 GLU 9 HB3 GLU 9 21.137 5.121 -3.241 72 HG2 GLU 9 HG2 GLU 9 22.725 3.353 -3.664 73 HG3 GLU 9 HG3 GLU 9 22.469 3.498 -1.931 74 H SER 10 H SER 10 21.485 3.696 -0.247 75 HA SER 10 HA SER 10 22.303 4.639 1.516 76 HB2 SER 10 HB2 SER 10 21.628 7.408 0.504 77 HB3 SER 10 HB3 SER 10 23.008 6.915 1.486 78 HG SER 10 HG SER 10 23.812 5.798 -0.353 79 H SER 11 H SER 11 19.109 4.729 0.956 80 HA SER 11 HA SER 11 18.046 6.678 2.742 81 HB2 SER 11 HB2 SER 11 15.922 5.354 1.908 82 HB3 SER 11 HB3 SER 11 16.866 6.350 0.801 83 HG SER 11 HG SER 11 16.912 3.516 1.032 84 H ILE 12 H ILE 12 19.581 3.898 3.654 85 HA ILE 12 HA ILE 12 17.679 3.336 5.844 86 HB ILE 12 HB ILE 12 19.172 1.407 4.036 87 HG12 ILE 12 HG12 ILE 12 16.270 2.300 4.314 88 HG13 ILE 12 HG13 ILE 12 17.262 2.205 2.860 89 HG21 ILE 12 HG21 ILE 12 18.152 -0.314 5.479 90 HG22 ILE 12 HG22 ILE 12 19.171 0.761 6.414 91 HG23 ILE 12 HG23 ILE 12 17.411 0.975 6.474 92 HD11 ILE 12 HD13 ILE 12 17.175 -0.267 3.019 93 HD12 ILE 12 HD11 ILE 12 16.054 -0.070 4.409 94 HD13 ILE 12 HD12 ILE 12 15.594 0.512 2.797 95 H SER 13 H SER 13 18.825 3.504 7.822 96 HA SER 13 HA SER 13 21.735 3.040 7.902 97 HB2 SER 13 HB2 SER 13 20.455 5.745 8.508 98 HB3 SER 13 HB3 SER 13 22.115 5.295 8.937 99 HG SER 13 HG SER 13 21.528 4.780 6.325 100 H VAL 14 H VAL 14 22.504 2.632 9.912 101 HA VAL 14 HA VAL 14 20.636 2.733 12.233 102 HB VAL 14 HB VAL 14 22.877 0.766 11.653 103 HG11 VAL 14 HG11 VAL 14 21.051 0.993 14.098 104 HG12 VAL 14 HG12 VAL 14 22.132 -0.379 13.767 105 HG13 VAL 14 HG13 VAL 14 22.814 1.216 14.068 106 HG21 VAL 14 HG23 VAL 14 21.082 -0.967 11.733 107 HG22 VAL 14 HG21 VAL 14 19.870 0.311 11.904 108 HG23 VAL 14 HG22 VAL 14 20.834 0.180 10.413 109 H ILE 15 H ILE 15 21.516 3.705 14.025 110 HA ILE 15 HA ILE 15 24.199 4.968 13.887 111 HB ILE 15 HB ILE 15 21.408 6.155 14.045 112 HG12 ILE 15 HG12 ILE 15 23.907 6.644 12.408 113 HG13 ILE 15 HG13 ILE 15 22.299 6.156 11.871 114 HG21 ILE 15 HG21 ILE 15 22.411 6.994 16.028 115 HG22 ILE 15 HG22 ILE 15 23.858 7.562 15.128 116 HG23 ILE 15 HG23 ILE 15 22.243 8.282 14.883 117 HD11 ILE 15 HD13 ILE 15 22.676 8.467 11.254 118 HD12 ILE 15 HD11 ILE 15 21.461 8.455 12.553 119 HD13 ILE 15 HD12 ILE 15 23.146 8.905 12.908 120 H HIS 16 H HIS 16 25.113 5.267 16.012 121 HA HIS 16 HA HIS 16 23.944 3.616 18.103 122 HB2 HIS 16 HB2 HIS 16 26.413 3.989 17.822 123 HB3 HIS 16 HB3 HIS 16 26.187 5.660 18.354 124 HD1 HIS 16 HD1 HIS 16 25.373 2.095 19.714 125 HD2 HIS 16 HD2 HIS 16 26.357 6.004 20.967 126 HE1 HIS 16 HE1 HIS 16 25.667 1.992 22.249 127 H SER 17 H SER 17 24.243 7.162 17.473 128 HA SER 17 HA SER 17 21.822 7.736 18.908 129 HB2 SER 17 HB2 SER 17 23.110 9.470 20.367 130 HB3 SER 17 HB3 SER 17 23.010 7.799 20.923 131 HG SER 17 HG SER 17 25.242 8.994 19.642 132 H ALA 18 H ALA 18 21.109 9.809 18.219 133 HA ALA 18 HA ALA 18 22.623 11.029 15.985 134 HB1 ALA 18 HB3 ALA 18 20.709 12.612 15.881 135 HB2 ALA 18 HB1 ALA 18 20.199 10.933 15.703 136 HB3 ALA 18 HB2 ALA 18 19.959 11.786 17.258 137 H LYS 19 H LYS 19 23.340 13.213 16.143 138 HA LYS 19 HA LYS 19 24.717 13.936 18.483 139 HB2 LYS 19 HB2 LYS 19 25.063 14.601 16.059 140 HB3 LYS 19 HB3 LYS 19 23.753 15.729 16.229 141 HG2 LYS 19 HG2 LYS 19 26.329 15.812 17.856 142 HG3 LYS 19 HG3 LYS 19 26.058 16.691 16.357 143 HD2 LYS 19 HD2 LYS 19 24.684 17.185 19.003 144 HD3 LYS 19 HD3 LYS 19 25.838 18.215 18.186 145 HE2 LYS 19 HE2 LYS 19 23.055 17.520 17.166 146 HE3 LYS 19 HE3 LYS 19 23.505 19.022 17.975 147 HZ1 LYS 19 HZ3 LYS 19 24.417 18.104 15.302 148 HZ2 LYS 19 HZ1 LYS 19 23.471 19.381 15.654 149 HZ3 LYS 19 HZ2 LYS 19 25.046 19.423 16.082 150 H ASP 20 H ASP 20 21.542 15.013 17.265 151 HA ASP 20 HA ASP 20 20.407 15.168 19.853 152 HB2 ASP 20 HB2 ASP 20 19.840 17.384 20.082 153 HB3 ASP 20 HB3 ASP 20 21.561 17.494 19.680 154 H TRP 21 H TRP 21 18.023 16.325 19.374 155 HA TRP 21 HA TRP 21 16.844 14.703 17.412 156 HB2 TRP 21 HB2 TRP 21 14.770 15.969 17.927 157 HB3 TRP 21 HB3 TRP 21 15.592 15.295 19.327 158 HD1 TRP 21 HD1 TRP 21 16.519 16.956 21.138 159 HE1 TRP 21 HE1 TRP 21 16.357 19.465 21.533 160 HE3 TRP 21 HE3 TRP 21 14.379 18.322 16.684 161 HZ2 TRP 21 HZ2 TRP 21 15.520 21.817 20.051 162 HZ3 TRP 21 HZ3 TRP 21 13.912 20.716 16.208 163 HH2 TRP 21 HH2 TRP 21 14.537 22.458 17.866 164 H GLN 22 H GLN 22 17.999 18.114 17.116 165 HA GLN 22 HA GLN 22 16.743 18.730 14.568 166 HB2 GLN 22 HB2 GLN 22 19.404 19.620 15.697 167 HB3 GLN 22 HB3 GLN 22 18.617 20.265 14.269 168 HG2 GLN 22 HG2 GLN 22 16.782 21.160 15.525 169 HG3 GLN 22 HG3 GLN 22 17.234 20.263 16.976 170 HE21 GLN 22 HE22 GLN 22 19.345 20.725 17.960 171 HE22 GLN 22 HE21 GLN 22 19.914 22.402 17.976 172 H GLU 23 H GLU 23 19.944 17.246 15.489 173 HA GLU 23 HA GLU 23 20.716 16.565 12.865 174 HB2 GLU 23 HB2 GLU 23 21.971 16.458 15.195 175 HB3 GLU 23 HB3 GLU 23 21.365 14.797 15.226 176 HG2 GLU 23 HG2 GLU 23 23.473 14.554 14.218 177 HG3 GLU 23 HG3 GLU 23 22.405 14.586 12.837 178 H ALA 24 H ALA 24 18.668 14.803 15.175 179 HA ALA 24 HA ALA 24 18.602 12.351 13.726 180 HB1 ALA 24 HB3 ALA 24 16.798 11.757 15.220 181 HB2 ALA 24 HB1 ALA 24 18.014 12.701 16.113 182 HB3 ALA 24 HB2 ALA 24 16.493 13.463 15.614 183 H ILE 25 H ILE 25 16.684 15.359 13.389 184 HA ILE 25 HA ILE 25 14.869 14.261 11.409 185 HB ILE 25 HB ILE 25 15.802 17.142 11.621 186 HG12 ILE 25 HG12 ILE 25 14.334 15.728 13.638 187 HG13 ILE 25 HG13 ILE 25 14.821 17.414 13.567 188 HG21 ILE 25 HG21 ILE 25 13.263 15.952 10.436 189 HG22 ILE 25 HG22 ILE 25 13.751 17.667 10.424 190 HG23 ILE 25 HG23 ILE 25 14.667 16.491 9.521 191 HD11 ILE 25 HD13 ILE 25 12.451 17.209 13.984 192 HD12 ILE 25 HD11 ILE 25 12.692 17.944 12.391 193 HD13 ILE 25 HD12 ILE 25 12.243 16.217 12.526 194 H ASP 26 H ASP 26 18.013 16.065 11.272 195 HA ASP 26 HA ASP 26 18.236 16.112 8.459 196 HB2 ASP 26 HB2 ASP 26 19.735 17.388 9.916 197 HB3 ASP 26 HB3 ASP 26 20.481 15.901 10.498 198 H PHE 27 H PHE 27 19.391 13.585 10.755 199 HA PHE 27 HA PHE 27 20.274 11.802 8.729 200 HB2 PHE 27 HB2 PHE 27 19.557 11.496 11.658 201 HB3 PHE 27 HB3 PHE 27 19.922 10.092 10.672 202 HD1 PHE 27 HD2 PHE 27 22.083 10.455 9.054 203 HD2 PHE 27 HD1 PHE 27 21.524 12.278 12.956 204 HE1 PHE 27 HE2 PHE 27 24.531 10.661 9.328 205 HE2 PHE 27 HE1 PHE 27 23.960 12.415 13.213 206 HZ PHE 27 HZ PHE 27 25.478 11.632 11.414 207 H SER 28 H SER 28 16.952 12.420 9.940 208 HA SER 28 HA SER 28 15.852 10.016 8.737 209 HB2 SER 28 HB2 SER 28 14.435 12.646 9.447 210 HB3 SER 28 HB3 SER 28 13.666 11.126 9.055 211 HG SER 28 HG SER 28 15.435 11.601 11.245 212 H MET 29 H MET 29 16.918 13.124 7.450 213 HA MET 29 HA MET 29 15.334 12.644 4.962 214 HB2 MET 29 HB2 MET 29 16.512 15.203 6.023 215 HB3 MET 29 HB3 MET 29 15.278 14.995 4.770 216 HG2 MET 29 HG2 MET 29 14.563 14.194 7.565 217 HG3 MET 29 HG3 MET 29 14.728 15.896 7.168 218 HE1 MET 29 HE3 MET 29 12.565 12.877 7.194 219 HE2 MET 29 HE1 MET 29 11.511 13.031 5.764 220 HE3 MET 29 HE2 MET 29 13.250 12.663 5.552 221 H VAL 30 H VAL 30 18.683 13.055 6.061 222 HA VAL 30 HA VAL 30 19.681 14.469 3.966 223 HB VAL 30 HB VAL 30 20.927 13.995 5.986 224 HG11 VAL 30 HG11 VAL 30 20.369 11.580 6.298 225 HG12 VAL 30 HG12 VAL 30 21.433 11.176 4.933 226 HG13 VAL 30 HG13 VAL 30 22.104 11.902 6.405 227 HG21 VAL 30 HG23 VAL 30 22.144 14.732 3.961 228 HG22 VAL 30 HG21 VAL 30 23.151 13.750 5.042 229 HG23 VAL 30 HG22 VAL 30 22.488 13.041 3.553 230 H SER 31 H SER 31 19.181 10.892 3.914 231 HA SER 31 HA SER 31 20.534 10.484 1.495 232 HB2 SER 31 HB2 SER 31 18.120 8.923 2.464 233 HB3 SER 31 HB3 SER 31 19.518 8.327 1.548 234 HG SER 31 HG SER 31 20.172 7.817 3.506 235 H LEU 32 H LEU 32 17.327 11.782 2.123 236 HA LEU 32 HA LEU 32 16.407 11.547 -0.657 237 HB2 LEU 32 HB2 LEU 32 15.297 12.978 1.803 238 HB3 LEU 32 HB3 LEU 32 14.523 13.035 0.245 239 HG LEU 32 HG LEU 32 15.072 10.463 1.773 240 HD11 LEU 32 HD11 LEU 32 12.675 10.453 2.309 241 HD12 LEU 32 HD12 LEU 32 13.479 11.876 2.990 242 HD13 LEU 32 HD13 LEU 32 12.482 12.037 1.530 243 HD21 LEU 32 HD23 LEU 32 13.492 9.433 0.210 244 HD22 LEU 32 HD21 LEU 32 13.308 10.965 -0.664 245 HD23 LEU 32 HD22 LEU 32 14.855 10.081 -0.673 246 H LEU 33 H LEU 33 17.690 14.047 1.586 247 HA LEU 33 HA LEU 33 17.540 16.255 -0.095 248 HB2 LEU 33 HB2 LEU 33 18.116 16.214 2.323 249 HB3 LEU 33 HB3 LEU 33 19.704 15.599 1.948 250 HG LEU 33 HG LEU 33 19.582 17.986 2.516 251 HD11 LEU 33 HD11 LEU 33 21.481 17.042 1.183 252 HD12 LEU 33 HD12 LEU 33 20.706 17.690 -0.281 253 HD13 LEU 33 HD13 LEU 33 21.215 18.783 1.007 254 HD21 LEU 33 HD23 LEU 33 18.277 18.387 -0.209 255 HD22 LEU 33 HD21 LEU 33 17.478 18.585 1.370 256 HD23 LEU 33 HD22 LEU 33 18.812 19.651 0.906 257 H ASP 34 H ASP 34 20.230 14.003 0.392 258 HA ASP 34 HA ASP 34 22.116 15.005 -1.363 259 HB2 ASP 34 HB2 ASP 34 22.559 13.211 0.327 260 HB3 ASP 34 HB3 ASP 34 21.435 12.134 -0.518 261 H LYS 35 H LYS 35 19.339 13.130 -2.165 262 HA LYS 35 HA LYS 35 20.344 12.828 -4.976 263 HB2 LYS 35 HB2 LYS 35 18.380 11.105 -3.511 264 HB3 LYS 35 HB3 LYS 35 19.004 10.894 -5.172 265 HG2 LYS 35 HG2 LYS 35 21.361 10.944 -4.049 266 HG3 LYS 35 HG3 LYS 35 20.479 10.768 -2.512 267 HD2 LYS 35 HD2 LYS 35 19.289 8.840 -3.985 268 HD3 LYS 35 HD3 LYS 35 20.895 8.883 -4.746 269 HE2 LYS 35 HE2 LYS 35 20.265 8.673 -1.762 270 HE3 LYS 35 HE3 LYS 35 20.635 7.266 -2.764 271 HZ1 LYS 35 HZ3 LYS 35 22.842 8.252 -3.197 272 HZ2 LYS 35 HZ1 LYS 35 22.534 9.488 -2.162 273 HZ3 LYS 35 HZ2 LYS 35 22.618 7.923 -1.620 274 H ASN 36 H ASN 36 19.029 15.121 -3.581 275 HA ASN 36 HA ASN 36 17.649 16.776 -4.211 276 HB2 ASN 36 HB2 ASN 36 18.947 16.215 -6.384 277 HB3 ASN 36 HB3 ASN 36 17.465 15.449 -6.958 278 HD21 ASN 36 HD22 ASN 36 18.540 18.409 -5.345 279 HD22 ASN 36 HD21 ASN 36 17.553 19.533 -6.271 280 H TYR 37 H TYR 37 16.307 14.208 -3.179 281 HA TYR 37 HA TYR 37 13.678 14.257 -4.443 282 HB2 TYR 37 HB2 TYR 37 14.727 13.012 -1.892 283 HB3 TYR 37 HB3 TYR 37 13.050 12.918 -2.380 284 HD1 TYR 37 HD1 TYR 37 12.357 11.652 -4.358 285 HD2 TYR 37 HD2 TYR 37 16.411 11.455 -2.888 286 HE1 TYR 37 HE1 TYR 37 12.799 9.751 -5.866 287 HE2 TYR 37 HE2 TYR 37 16.845 9.543 -4.383 288 HH TYR 37 HH TYR 37 14.386 8.228 -6.638 289 H ILE 38 H ILE 38 15.318 16.152 -2.038 290 HA ILE 38 HA ILE 38 12.932 17.815 -1.601 291 HB ILE 38 HB ILE 38 13.399 17.874 0.849 292 HG12 ILE 38 HG12 ILE 38 15.234 15.513 0.288 293 HG13 ILE 38 HG13 ILE 38 15.752 17.144 0.729 294 HG21 ILE 38 HG21 ILE 38 12.288 15.791 1.461 295 HG22 ILE 38 HG22 ILE 38 11.579 16.432 -0.001 296 HG23 ILE 38 HG23 ILE 38 12.719 15.067 -0.090 297 HD11 ILE 38 HD13 ILE 38 15.940 15.710 2.600 298 HD12 ILE 38 HD11 ILE 38 14.664 16.905 2.923 299 HD13 ILE 38 HD12 ILE 38 14.243 15.217 2.511 300 H SER 39 H SER 39 13.715 19.762 -0.219 301 HA SER 39 HA SER 39 16.382 20.752 -1.131 302 HB2 SER 39 HB2 SER 39 13.980 22.413 -0.291 303 HB3 SER 39 HB3 SER 39 15.391 22.924 -1.232 304 HG SER 39 HG SER 39 13.288 21.169 -2.026 305 H GLU 40 H GLU 40 17.450 22.224 0.563 306 HA GLU 40 HA GLU 40 17.598 20.928 3.057 307 HB2 GLU 40 HB2 GLU 40 18.408 23.761 2.284 308 HB3 GLU 40 HB3 GLU 40 18.863 22.961 3.797 309 HG2 GLU 40 HG2 GLU 40 20.004 21.167 2.512 310 HG3 GLU 40 HG3 GLU 40 19.596 21.989 1.003 311 H ASN 41 H ASN 41 15.678 23.771 2.141 312 HA ASN 41 HA ASN 41 14.698 24.428 4.719 313 HB2 ASN 41 HB2 ASN 41 12.780 25.490 3.423 314 HB3 ASN 41 HB3 ASN 41 14.404 26.052 3.069 315 HD21 ASN 41 HD22 ASN 41 11.659 24.118 1.718 316 HD22 ASN 41 HD21 ASN 41 12.260 24.251 0.083 317 H TYR 42 H TYR 42 13.849 21.658 2.714 318 HA TYR 42 HA TYR 42 11.236 21.191 3.862 319 HB2 TYR 42 HB2 TYR 42 12.130 20.148 1.752 320 HB3 TYR 42 HB3 TYR 42 13.256 19.221 2.734 321 HD1 TYR 42 HD2 TYR 42 9.683 19.656 1.853 322 HD2 TYR 42 HD1 TYR 42 12.573 17.274 3.994 323 HE1 TYR 42 HE2 TYR 42 8.044 17.802 2.003 324 HE2 TYR 42 HE1 TYR 42 10.954 15.407 4.106 325 HH TYR 42 HH TYR 42 8.892 14.593 3.372 326 H ILE 43 H ILE 43 14.600 20.113 4.661 327 HA ILE 43 HA ILE 43 13.885 18.521 6.911 328 HB ILE 43 HB ILE 43 16.474 20.036 6.298 329 HG12 ILE 43 HG12 ILE 43 17.049 17.379 5.950 330 HG13 ILE 43 HG13 ILE 43 15.366 17.399 5.411 331 HG21 ILE 43 HG21 ILE 43 17.558 18.540 7.881 332 HG22 ILE 43 HG22 ILE 43 16.274 19.439 8.696 333 HG23 ILE 43 HG23 ILE 43 16.011 17.742 8.240 334 HD11 ILE 43 HD13 ILE 43 17.638 19.121 4.354 335 HD12 ILE 43 HD11 ILE 43 16.966 17.683 3.578 336 HD13 ILE 43 HD12 ILE 43 15.957 19.132 3.748 337 H GLN 44 H GLN 44 14.895 22.001 6.648 338 HA GLN 44 HA GLN 44 14.661 22.304 9.463 339 HB2 GLN 44 HB2 GLN 44 16.035 23.721 7.743 340 HB3 GLN 44 HB3 GLN 44 14.567 24.689 7.627 341 HG2 GLN 44 HG2 GLN 44 16.073 25.674 9.281 342 HG3 GLN 44 HG3 GLN 44 14.650 25.063 10.108 343 HE21 GLN 44 HE22 GLN 44 15.322 24.262 12.138 344 HE22 GLN 44 HE21 GLN 44 16.652 23.156 12.363 345 H ALA 45 H ALA 45 12.166 22.580 6.971 346 HA ALA 45 HA ALA 45 10.233 23.986 8.475 347 HB1 ALA 45 HB3 ALA 45 9.931 23.330 6.088 348 HB2 ALA 45 HB1 ALA 45 9.763 21.625 6.584 349 HB3 ALA 45 HB2 ALA 45 8.564 22.812 7.097 350 H ILE 46 H ILE 46 11.171 20.506 8.567 351 HA ILE 46 HA ILE 46 9.056 19.782 10.396 352 HB ILE 46 HB ILE 46 11.703 18.360 9.918 353 HG12 ILE 46 HG12 ILE 46 9.120 17.747 8.462 354 HG13 ILE 46 HG13 ILE 46 10.344 18.783 7.762 355 HG21 ILE 46 HG21 ILE 46 10.361 17.664 11.922 356 HG22 ILE 46 HG22 ILE 46 8.973 17.346 10.865 357 HG23 ILE 46 HG23 ILE 46 10.452 16.380 10.720 358 HD11 ILE 46 HD13 ILE 46 12.014 17.040 7.803 359 HD12 ILE 46 HD11 ILE 46 10.890 15.897 8.546 360 HD13 ILE 46 HD12 ILE 46 10.575 16.504 6.914 361 H LYS 47 H LYS 47 12.575 20.571 10.714 362 HA LYS 47 HA LYS 47 12.668 20.145 13.511 363 HB2 LYS 47 HB2 LYS 47 14.217 22.043 11.714 364 HB3 LYS 47 HB3 LYS 47 14.653 21.759 13.401 365 HG2 LYS 47 HG2 LYS 47 15.304 19.493 12.967 366 HG3 LYS 47 HG3 LYS 47 14.614 19.523 11.328 367 HD2 LYS 47 HD2 LYS 47 16.179 21.205 10.624 368 HD3 LYS 47 HD3 LYS 47 16.847 21.348 12.273 369 HE2 LYS 47 HE2 LYS 47 17.853 19.192 12.122 370 HE3 LYS 47 HE3 LYS 47 17.112 18.869 10.553 371 HZ1 LYS 47 HZ3 LYS 47 19.407 19.640 10.305 372 HZ2 LYS 47 HZ1 LYS 47 18.421 20.789 9.686 373 HZ3 LYS 47 HZ2 LYS 47 19.111 21.002 11.141 374 H ASP 48 H ASP 48 11.853 23.123 11.626 375 HA ASP 48 HA ASP 48 11.539 24.868 13.835 376 HB2 ASP 48 HB2 ASP 48 11.761 25.675 11.552 377 HB3 ASP 48 HB3 ASP 48 10.262 24.870 11.080 378 H SER 49 H SER 49 9.201 22.659 12.220 379 HA SER 49 HA SER 49 6.939 23.388 13.824 380 HB2 SER 49 HB2 SER 49 7.603 20.677 12.595 381 HB3 SER 49 HB3 SER 49 6.011 21.264 13.097 382 HG SER 49 HG SER 49 7.651 22.252 10.983 383 H THR 50 H THR 50 9.592 21.024 14.278 384 HA THR 50 HA THR 50 8.656 19.967 16.726 385 HB THR 50 HB THR 50 11.522 20.100 15.730 386 HG1 THR 50 HG1 THR 50 10.172 19.210 14.142 387 HG21 THR 50 HG23 THR 50 10.085 18.094 17.516 388 HG22 THR 50 HG21 THR 50 11.765 17.980 16.933 389 HG23 THR 50 HG22 THR 50 11.310 19.282 18.037 390 H ILE 51 H ILE 51 10.686 22.865 16.056 391 HA ILE 51 HA ILE 51 11.162 23.548 18.802 392 HB ILE 51 HB ILE 51 11.087 25.174 16.227 393 HG12 ILE 51 HG12 ILE 51 13.418 24.400 18.021 394 HG13 ILE 51 HG13 ILE 51 12.907 23.444 16.631 395 HG21 ILE 51 HG21 ILE 51 11.920 26.176 18.982 396 HG22 ILE 51 HG22 ILE 51 12.163 27.042 17.449 397 HG23 ILE 51 HG23 ILE 51 10.535 26.754 18.025 398 HD11 ILE 51 HD13 ILE 51 14.045 26.258 16.545 399 HD12 ILE 51 HD11 ILE 51 14.776 24.761 15.955 400 HD13 ILE 51 HD12 ILE 51 13.342 25.415 15.143 401 H ASN 52 H ASN 52 8.465 24.272 16.547 402 HA ASN 52 HA ASN 52 7.297 26.356 18.053 403 HB2 ASN 52 HB2 ASN 52 6.383 24.533 15.834 404 HB3 ASN 52 HB3 ASN 52 5.130 25.308 16.756 405 HD21 ASN 52 HD22 ASN 52 8.097 26.054 14.859 406 HD22 ASN 52 HD21 ASN 52 7.583 27.662 14.407 407 H ASN 53 H ASN 53 6.869 22.866 18.297 408 HA ASN 53 HA ASN 53 5.056 23.186 20.651 409 HB2 ASN 53 HB2 ASN 53 3.365 23.107 19.093 410 HB3 ASN 53 HB3 ASN 53 4.352 22.324 17.877 411 HD21 ASN 53 HD22 ASN 53 4.182 20.132 17.555 412 HD22 ASN 53 HD21 ASN 53 3.207 19.076 18.550 413 H GLY 54 H GLY 54 6.712 20.872 18.437 414 HA2 GLY 54 HA2 GLY 54 8.209 19.266 19.948 415 HA3 GLY 54 HA3 GLY 54 6.581 18.745 20.435 416 HA PRO 55 HA PRO 55 7.911 16.799 16.333 417 HB2 PRO 55 HB2 PRO 55 7.408 14.149 17.003 418 HB3 PRO 55 HB3 PRO 55 8.980 14.964 17.210 419 HG2 PRO 55 HG2 PRO 55 6.823 14.516 19.270 420 HG3 PRO 55 HG3 PRO 55 8.595 14.291 19.423 421 HD2 PRO 55 HD2 PRO 55 7.313 16.525 20.348 422 HD3 PRO 55 HD3 PRO 55 8.950 16.630 19.636 423 H TYR 56 H TYR 56 6.445 16.536 14.764 424 HA TYR 56 HA TYR 56 3.542 16.475 15.484 425 HB2 TYR 56 HB2 TYR 56 5.135 17.530 13.140 426 HB3 TYR 56 HB3 TYR 56 3.455 17.106 12.912 427 HD1 TYR 56 HD1 TYR 56 5.710 19.271 14.915 428 HD2 TYR 56 HD2 TYR 56 1.671 18.485 13.641 429 HE1 TYR 56 HE1 TYR 56 4.986 21.498 15.790 430 HE2 TYR 56 HE2 TYR 56 0.939 20.677 14.530 431 HH TYR 56 HH TYR 56 1.599 22.647 15.602 432 H TYR 57 H TYR 57 5.911 14.301 14.511 433 HA TYR 57 HA TYR 57 4.026 12.635 12.912 434 HB2 TYR 57 HB2 TYR 57 6.927 13.249 12.358 435 HB3 TYR 57 HB3 TYR 57 5.950 11.994 11.589 436 HD1 TYR 57 HD2 TYR 57 4.095 12.527 10.096 437 HD2 TYR 57 HD1 TYR 57 6.494 15.656 11.848 438 HE1 TYR 57 HE2 TYR 57 2.968 14.196 8.645 439 HE2 TYR 57 HE1 TYR 57 5.442 17.316 10.341 440 HH TYR 57 HH TYR 57 2.833 16.446 8.026 441 H ILE 58 H ILE 58 3.543 11.622 15.001 442 HA ILE 58 HA ILE 58 5.644 9.715 15.908 443 HB ILE 58 HB ILE 58 3.609 11.216 17.609 444 HG12 ILE 58 HG12 ILE 58 5.544 12.632 17.102 445 HG13 ILE 58 HG13 ILE 58 5.461 12.205 18.797 446 HG21 ILE 58 HG21 ILE 58 3.742 8.993 18.500 447 HG22 ILE 58 HG22 ILE 58 5.508 8.955 18.368 448 HG23 ILE 58 HG23 ILE 58 4.713 10.025 19.548 449 HD11 ILE 58 HD13 ILE 58 7.776 12.093 18.051 450 HD12 ILE 58 HD11 ILE 58 7.228 10.462 18.438 451 HD13 ILE 58 HD12 ILE 58 7.350 10.980 16.744 452 H LEU 59 H LEU 59 4.929 7.648 15.987 453 HA LEU 59 HA LEU 59 2.088 7.139 15.179 454 HB2 LEU 59 HB2 LEU 59 4.649 5.708 14.345 455 HB3 LEU 59 HB3 LEU 59 3.033 5.123 14.024 456 HG LEU 59 HG LEU 59 3.787 6.059 12.032 457 HD11 LEU 59 HD11 LEU 59 2.160 7.727 11.474 458 HD12 LEU 59 HD12 LEU 59 1.432 6.585 12.613 459 HD13 LEU 59 HD13 LEU 59 1.956 8.192 13.171 460 HD21 LEU 59 HD23 LEU 59 4.452 8.713 13.363 461 HD22 LEU 59 HD21 LEU 59 5.639 7.488 12.857 462 HD23 LEU 59 HD22 LEU 59 4.594 8.292 11.682 463 H ALA 60 H ALA 60 4.799 6.167 17.220 464 HA ALA 60 HA ALA 60 3.025 4.903 19.085 465 HB1 ALA 60 HB3 ALA 60 5.207 3.231 17.721 466 HB2 ALA 60 HB1 ALA 60 4.267 2.731 19.136 467 HB3 ALA 60 HB2 ALA 60 3.457 2.954 17.578 468 HA PRO 61 HA PRO 61 6.349 6.489 21.725 469 HB2 PRO 61 HB2 PRO 61 6.328 3.769 23.046 470 HB3 PRO 61 HB3 PRO 61 6.345 5.395 23.801 471 HG2 PRO 61 HG2 PRO 61 4.043 3.975 23.672 472 HG3 PRO 61 HG3 PRO 61 4.037 5.732 23.303 473 HD2 PRO 61 HD2 PRO 61 4.056 3.407 21.369 474 HD3 PRO 61 HD3 PRO 61 3.090 4.914 21.318 475 H GLY 62 H GLY 62 8.375 6.698 20.902 476 HA2 GLY 62 HA2 GLY 62 10.563 6.000 20.483 477 HA3 GLY 62 HA3 GLY 62 10.041 4.327 20.358 478 H VAL 63 H VAL 63 7.839 5.911 18.402 479 HA VAL 63 HA VAL 63 9.529 5.462 15.986 480 HB VAL 63 HB VAL 63 6.617 4.690 16.422 481 HG11 VAL 63 HG11 VAL 63 8.492 4.127 14.081 482 HG12 VAL 63 HG12 VAL 63 6.839 3.492 14.246 483 HG13 VAL 63 HG13 VAL 63 7.105 5.223 14.063 484 HG21 VAL 63 HG23 VAL 63 7.435 2.347 16.318 485 HG22 VAL 63 HG21 VAL 63 9.111 2.939 16.368 486 HG23 VAL 63 HG22 VAL 63 8.018 3.195 17.744 487 H ALA 64 H ALA 64 9.717 7.255 14.822 488 HA ALA 64 HA ALA 64 7.459 9.182 14.738 489 HB1 ALA 64 HB3 ALA 64 10.415 9.886 14.510 490 HB2 ALA 64 HB1 ALA 64 9.056 11.027 14.511 491 HB3 ALA 64 HB2 ALA 64 9.431 10.120 15.976 492 H MET 65 H MET 65 7.554 10.536 12.685 493 HA MET 65 HA MET 65 8.755 9.087 10.419 494 HB2 MET 65 HB2 MET 65 6.521 8.196 10.706 495 HB3 MET 65 HB3 MET 65 5.845 9.819 10.477 496 HG2 MET 65 HG2 MET 65 7.430 9.513 8.225 497 HG3 MET 65 HG3 MET 65 6.945 7.852 8.531 498 HE1 MET 65 HE3 MET 65 3.663 8.810 9.803 499 HE2 MET 65 HE1 MET 65 3.056 8.049 8.317 500 HE3 MET 65 HE2 MET 65 4.412 7.315 9.197 501 HA PRO 66 HA PRO 66 9.041 13.773 10.467 502 HB2 PRO 66 HB2 PRO 66 11.836 13.045 9.476 503 HB3 PRO 66 HB3 PRO 66 11.363 14.407 10.530 504 HG2 PRO 66 HG2 PRO 66 12.458 12.223 11.632 505 HG3 PRO 66 HG3 PRO 66 11.009 12.944 12.394 506 HD2 PRO 66 HD2 PRO 66 11.134 10.578 10.492 507 HD3 PRO 66 HD3 PRO 66 10.291 10.719 12.063 508 H HIS 67 H HIS 67 8.666 14.994 8.709 509 HA HIS 67 HA HIS 67 9.113 14.694 5.975 510 HB2 HIS 67 HB2 HIS 67 7.891 12.855 5.454 511 HB3 HIS 67 HB3 HIS 67 7.150 12.772 7.022 512 HD1 HIS 67 HD1 HIS 67 4.821 13.805 7.396 513 HD2 HIS 67 HD2 HIS 67 6.327 14.111 3.445 514 HE1 HIS 67 HE1 HIS 67 2.836 14.402 5.919 515 H ALA 68 H ALA 68 7.627 16.252 4.793 516 HA ALA 68 HA ALA 68 6.065 18.092 6.501 517 HB1 ALA 68 HB3 ALA 68 8.357 19.005 4.721 518 HB2 ALA 68 HB1 ALA 68 7.206 20.038 5.593 519 HB3 ALA 68 HB2 ALA 68 8.346 19.040 6.495 520 H ARG 69 H ARG 69 4.801 19.574 5.040 521 HA ARG 69 HA ARG 69 3.523 18.088 2.933 522 HB2 ARG 69 HB2 ARG 69 3.504 21.017 3.780 523 HB3 ARG 69 HB3 ARG 69 2.486 20.448 2.473 524 HG2 ARG 69 HG2 ARG 69 2.353 19.443 5.362 525 HG3 ARG 69 HG3 ARG 69 1.316 20.665 4.648 526 HD2 ARG 69 HD2 ARG 69 0.047 18.678 4.664 527 HD3 ARG 69 HD3 ARG 69 0.506 18.971 2.980 528 HE ARG 69 HE ARG 69 2.312 17.196 4.451 529 HH11 ARG 69 HH11 ARG 69 -0.756 17.231 2.688 530 HH12 ARG 69 HH12 ARG 69 -0.605 15.627 2.082 531 HH21 ARG 69 HH21 ARG 69 2.624 15.087 3.505 532 HH22 ARG 69 HH22 ARG 69 1.328 14.374 2.622 533 HA PRO 70 HA PRO 70 6.059 18.298 -0.435 534 HB2 PRO 70 HB2 PRO 70 4.463 19.240 -2.575 535 HB3 PRO 70 HB3 PRO 70 4.519 17.573 -1.970 536 HG2 PRO 70 HG2 PRO 70 2.511 19.709 -1.343 537 HG3 PRO 70 HG3 PRO 70 2.244 17.958 -1.603 538 HD2 PRO 70 HD2 PRO 70 2.290 19.053 0.873 539 HD3 PRO 70 HD3 PRO 70 2.971 17.437 0.588 540 H GLU 71 H GLU 71 4.006 21.225 -0.182 541 HA GLU 71 HA GLU 71 5.537 23.066 -1.628 542 HB2 GLU 71 HB2 GLU 71 3.766 23.557 0.807 543 HB3 GLU 71 HB3 GLU 71 4.212 24.756 -0.405 544 HG2 GLU 71 HG2 GLU 71 2.468 22.295 -0.849 545 HG3 GLU 71 HG3 GLU 71 1.920 23.956 -0.723 546 H CYS 72 H CYS 72 6.417 21.602 1.378 547 HA CYS 72 HA CYS 72 7.828 23.940 2.462 548 HB2 CYS 72 HB2 CYS 72 7.834 21.015 3.326 549 HB3 CYS 72 HB3 CYS 72 8.570 22.367 4.201 550 HG CYS 72 HG CYS 72 5.409 21.926 3.352 551 H GLY 73 H GLY 73 8.469 21.698 -0.027 552 HA2 GLY 73 HA2 GLY 73 10.602 22.546 -1.120 553 HA3 GLY 73 HA3 GLY 73 11.428 21.960 0.330 554 H ALA 74 H ALA 74 8.749 19.950 -0.783 555 HA ALA 74 HA ALA 74 10.615 17.781 -1.440 556 HB1 ALA 74 HB3 ALA 74 8.347 17.354 -0.441 557 HB2 ALA 74 HB1 ALA 74 7.634 17.962 -1.966 558 HB3 ALA 74 HB2 ALA 74 8.646 16.510 -1.972 559 H LEU 75 H LEU 75 11.038 16.962 -3.420 560 HA LEU 75 HA LEU 75 10.392 18.658 -5.799 561 HB2 LEU 75 HB2 LEU 75 13.016 17.328 -5.054 562 HB3 LEU 75 HB3 LEU 75 12.714 18.198 -6.552 563 HG LEU 75 HG LEU 75 12.729 19.426 -3.758 564 HD11 LEU 75 HD11 LEU 75 14.861 20.445 -4.464 565 HD12 LEU 75 HD12 LEU 75 14.956 18.681 -4.489 566 HD13 LEU 75 HD13 LEU 75 14.776 19.573 -6.012 567 HD21 LEU 75 HD23 LEU 75 12.546 20.757 -6.507 568 HD22 LEU 75 HD21 LEU 75 11.262 20.710 -5.281 569 HD23 LEU 75 HD22 LEU 75 12.747 21.604 -4.956 570 H LYS 76 H LYS 76 11.118 15.423 -4.476 571 HA LYS 76 HA LYS 76 9.768 14.174 -6.737 572 HB2 LYS 76 HB2 LYS 76 12.560 13.344 -5.879 573 HB3 LYS 76 HB3 LYS 76 11.578 12.552 -7.100 574 HG2 LYS 76 HG2 LYS 76 11.729 14.593 -8.514 575 HG3 LYS 76 HG3 LYS 76 12.770 15.360 -7.299 576 HD2 LYS 76 HD2 LYS 76 13.454 12.731 -8.670 577 HD3 LYS 76 HD3 LYS 76 13.967 14.310 -9.281 578 HE2 LYS 76 HE2 LYS 76 15.274 14.785 -7.307 579 HE3 LYS 76 HE3 LYS 76 14.604 13.394 -6.448 580 HZ1 LYS 76 HZ3 LYS 76 16.405 13.239 -8.788 581 HZ2 LYS 76 HZ1 LYS 76 16.766 12.871 -7.225 582 HZ3 LYS 76 HZ2 LYS 76 15.715 11.944 -8.060 583 H THR 77 H THR 77 9.112 11.940 -6.162 584 HA THR 77 HA THR 77 8.650 11.751 -3.359 585 HB THR 77 HB THR 77 7.667 10.257 -5.814 586 HG1 THR 77 HG1 THR 77 6.122 11.655 -5.902 587 HG21 THR 77 HG23 THR 77 6.620 10.230 -2.966 588 HG22 THR 77 HG21 THR 77 5.764 9.565 -4.386 589 HG23 THR 77 HG22 THR 77 7.303 8.860 -3.871 590 H GLY 78 H GLY 78 9.376 10.325 -1.858 591 HA2 GLY 78 HA2 GLY 78 10.591 7.815 -2.419 592 HA3 GLY 78 HA3 GLY 78 11.838 9.053 -2.207 593 H MET 79 H MET 79 12.065 7.265 -0.361 594 HA MET 79 HA MET 79 11.105 8.463 2.139 595 HB2 MET 79 HB2 MET 79 10.606 5.561 1.300 596 HB3 MET 79 HB3 MET 79 10.656 6.075 2.983 597 HG2 MET 79 HG2 MET 79 8.972 7.866 2.367 598 HG3 MET 79 HG3 MET 79 8.628 6.951 0.915 599 HE1 MET 79 HE3 MET 79 7.972 4.040 1.406 600 HE2 MET 79 HE1 MET 79 6.409 4.123 2.223 601 HE3 MET 79 HE2 MET 79 6.762 5.254 0.904 602 H SER 80 H SER 80 12.182 7.326 4.023 603 HA SER 80 HA SER 80 14.617 5.884 3.516 604 HB2 SER 80 HB2 SER 80 14.729 8.705 4.670 605 HB3 SER 80 HB3 SER 80 16.041 7.523 4.847 606 HG SER 80 HG SER 80 15.035 7.879 2.278 607 H LEU 81 H LEU 81 15.645 5.355 5.697 608 HA LEU 81 HA LEU 81 13.695 4.946 7.883 609 HB2 LEU 81 HB2 LEU 81 13.598 3.116 6.193 610 HB3 LEU 81 HB3 LEU 81 15.345 2.918 6.274 611 HG LEU 81 HG LEU 81 15.258 2.016 8.471 612 HD11 LEU 81 HD11 LEU 81 12.257 2.491 8.415 613 HD12 LEU 81 HD12 LEU 81 13.119 1.566 9.643 614 HD13 LEU 81 HD13 LEU 81 13.403 3.304 9.508 615 HD21 LEU 81 HD23 LEU 81 14.022 -0.040 7.879 616 HD22 LEU 81 HD21 LEU 81 13.021 0.886 6.753 617 HD23 LEU 81 HD22 LEU 81 14.728 0.657 6.392 618 H THR 82 H THR 82 14.724 5.234 9.847 619 HA THR 82 HA THR 82 17.686 5.037 10.021 620 HB THR 82 HB THR 82 15.871 7.246 11.080 621 HG1 THR 82 HG1 THR 82 17.553 7.179 8.802 622 HG21 THR 82 HG23 THR 82 17.821 6.988 12.468 623 HG22 THR 82 HG21 THR 82 18.903 7.001 11.056 624 HG23 THR 82 HG22 THR 82 17.987 8.464 11.507 625 H LEU 83 H LEU 83 18.359 4.091 11.947 626 HA LEU 83 HA LEU 83 16.392 3.852 14.169 627 HB2 LEU 83 HB2 LEU 83 16.661 1.652 12.950 628 HB3 LEU 83 HB3 LEU 83 18.394 1.740 13.303 629 HG LEU 83 HG LEU 83 17.645 1.906 15.817 630 HD11 LEU 83 HD11 LEU 83 15.198 2.245 15.237 631 HD12 LEU 83 HD12 LEU 83 15.146 0.541 14.727 632 HD13 LEU 83 HD13 LEU 83 15.543 0.993 16.418 633 HD21 LEU 83 HD23 LEU 83 18.817 -0.023 14.914 634 HD22 LEU 83 HD21 LEU 83 17.520 -0.548 16.004 635 HD23 LEU 83 HD22 LEU 83 17.297 -0.647 14.246 636 H LEU 84 H LEU 84 17.302 4.226 16.163 637 HA LEU 84 HA LEU 84 20.193 4.960 16.363 638 HB2 LEU 84 HB2 LEU 84 17.697 6.201 17.544 639 HB3 LEU 84 HB3 LEU 84 19.255 6.313 18.361 640 HG LEU 84 HG LEU 84 20.240 7.594 16.621 641 HD11 LEU 84 HD11 LEU 84 19.256 6.763 14.585 642 HD12 LEU 84 HD12 LEU 84 17.629 7.289 15.091 643 HD13 LEU 84 HD13 LEU 84 18.897 8.480 14.706 644 HD21 LEU 84 HD23 LEU 84 18.756 9.603 16.830 645 HD22 LEU 84 HD21 LEU 84 17.470 8.562 17.448 646 HD23 LEU 84 HD22 LEU 84 18.992 8.731 18.355 647 H GLU 85 H GLU 85 21.205 3.522 17.781 648 HA GLU 85 HA GLU 85 19.772 1.518 19.178 649 HB2 GLU 85 HB2 GLU 85 22.603 2.540 19.644 650 HB3 GLU 85 HB3 GLU 85 21.921 1.078 20.359 651 HG2 GLU 85 HG2 GLU 85 21.508 0.185 18.046 652 HG3 GLU 85 HG3 GLU 85 22.377 1.573 17.389 653 H GLN 86 H GLN 86 21.168 4.565 20.323 654 HA GLN 86 HA GLN 86 20.252 4.175 23.085 655 HB2 GLN 86 HB2 GLN 86 21.453 6.557 21.623 656 HB3 GLN 86 HB3 GLN 86 21.157 6.536 23.343 657 HG2 GLN 86 HG2 GLN 86 22.969 4.501 21.970 658 HG3 GLN 86 HG3 GLN 86 23.544 6.036 22.607 659 HE21 GLN 86 HE22 GLN 86 24.899 4.162 23.674 660 HE22 GLN 86 HE21 GLN 86 24.352 3.692 25.277 661 H GLY 87 H GLY 87 19.065 5.665 20.167 662 HA2 GLY 87 HA2 GLY 87 17.140 6.837 19.684 663 HA3 GLY 87 HA3 GLY 87 16.618 6.725 21.376 664 H VAL 88 H VAL 88 16.188 9.145 20.313 665 HA VAL 88 HA VAL 88 17.935 10.706 22.019 666 HB VAL 88 HB VAL 88 18.749 10.775 19.463 667 HG11 VAL 88 HG11 VAL 88 17.922 12.686 18.260 668 HG12 VAL 88 HG12 VAL 88 16.627 11.487 18.507 669 HG13 VAL 88 HG13 VAL 88 16.676 12.987 19.471 670 HG21 VAL 88 HG23 VAL 88 18.672 13.224 21.224 671 HG22 VAL 88 HG21 VAL 88 19.816 11.856 21.335 672 HG23 VAL 88 HG22 VAL 88 19.800 12.872 19.890 673 H TYR 89 H TYR 89 16.827 12.930 22.385 674 HA TYR 89 HA TYR 89 13.958 12.201 22.630 675 HB2 TYR 89 HB2 TYR 89 15.487 12.198 24.684 676 HB3 TYR 89 HB3 TYR 89 15.375 13.946 24.617 677 HD1 TYR 89 HD2 TYR 89 12.160 13.075 23.463 678 HD2 TYR 89 HD1 TYR 89 14.603 12.763 27.031 679 HE1 TYR 89 HE2 TYR 89 10.163 12.911 24.822 680 HE2 TYR 89 HE1 TYR 89 12.548 12.605 28.404 681 HH TYR 89 HH TYR 89 9.262 12.810 26.919 682 H PHE 90 H PHE 90 12.943 13.194 21.091 683 HA PHE 90 HA PHE 90 13.353 15.886 20.174 684 HB2 PHE 90 HB2 PHE 90 11.134 13.819 20.020 685 HB3 PHE 90 HB3 PHE 90 10.923 15.442 19.384 686 HD1 PHE 90 HD2 PHE 90 13.606 12.721 19.110 687 HD2 PHE 90 HD1 PHE 90 11.194 15.692 17.099 688 HE1 PHE 90 HE2 PHE 90 14.632 12.108 16.961 689 HE2 PHE 90 HE1 PHE 90 12.213 15.041 14.949 690 HZ PHE 90 HZ PHE 90 13.949 13.266 14.866 691 HA PRO 91 HA PRO 91 11.960 17.962 23.688 692 HB2 PRO 91 HB2 PRO 91 10.746 20.267 22.711 693 HB3 PRO 91 HB3 PRO 91 12.508 19.969 22.777 694 HG2 PRO 91 HG2 PRO 91 10.629 19.549 20.440 695 HG3 PRO 91 HG3 PRO 91 12.234 20.353 20.442 696 HD2 PRO 91 HD2 PRO 91 11.982 17.776 19.652 697 HD3 PRO 91 HD3 PRO 91 13.362 18.272 20.674 698 H GLY 92 H GLY 92 10.400 17.604 25.096 699 HA2 GLY 92 HA2 GLY 92 8.384 17.452 26.100 700 HA3 GLY 92 HA3 GLY 92 7.697 18.334 24.732 701 H ASN 93 H ASN 93 9.198 15.347 23.705 702 HA ASN 93 HA ASN 93 6.588 14.293 23.024 703 HB2 ASN 93 HB2 ASN 93 8.726 14.135 21.640 704 HB3 ASN 93 HB3 ASN 93 9.294 12.925 22.780 705 HD21 ASN 93 HD22 ASN 93 9.079 10.952 21.755 706 HD22 ASN 93 HD21 ASN 93 7.659 10.472 20.837 707 H ASP 94 H ASP 94 6.071 11.914 23.499 708 HA ASP 94 HA ASP 94 5.845 11.503 26.288 709 HB2 ASP 94 HB2 ASP 94 4.309 10.513 24.647 710 HB3 ASP 94 HB3 ASP 94 5.613 9.500 24.014 711 H GLU 95 H GLU 95 8.161 10.146 23.949 712 HA GLU 95 HA GLU 95 10.129 9.746 26.026 713 HB2 GLU 95 HB2 GLU 95 9.869 7.579 26.396 714 HB3 GLU 95 HB3 GLU 95 8.340 7.669 25.530 715 HG2 GLU 95 HG2 GLU 95 9.432 6.961 23.448 716 HG3 GLU 95 HG3 GLU 95 10.982 6.835 24.301 717 HA PRO 96 HA PRO 96 13.121 10.323 22.766 718 HB2 PRO 96 HB2 PRO 96 14.245 7.618 23.524 719 HB3 PRO 96 HB3 PRO 96 15.130 9.135 23.189 720 HG2 PRO 96 HG2 PRO 96 14.700 8.335 25.733 721 HG3 PRO 96 HG3 PRO 96 14.498 10.059 25.290 722 HD2 PRO 96 HD2 PRO 96 12.373 7.963 25.717 723 HD3 PRO 96 HD3 PRO 96 12.371 9.691 26.179 724 H ILE 97 H ILE 97 13.432 9.788 20.600 725 HA ILE 97 HA ILE 97 11.714 7.631 19.478 726 HB ILE 97 HB ILE 97 13.419 9.703 18.034 727 HG12 ILE 97 HG12 ILE 97 11.832 11.009 19.230 728 HG13 ILE 97 HG13 ILE 97 11.265 10.899 17.578 729 HG21 ILE 97 HG21 ILE 97 11.898 9.142 16.135 730 HG22 ILE 97 HG22 ILE 97 12.904 7.775 16.614 731 HG23 ILE 97 HG23 ILE 97 11.194 7.834 17.086 732 HD11 ILE 97 HD13 ILE 97 10.166 9.372 19.993 733 HD12 ILE 97 HD11 ILE 97 9.426 10.707 19.118 734 HD13 ILE 97 HD12 ILE 97 9.610 9.136 18.312 735 H LYS 98 H LYS 98 12.612 5.781 18.708 736 HA LYS 98 HA LYS 98 15.602 5.624 18.552 737 HB2 LYS 98 HB2 LYS 98 13.624 3.363 19.030 738 HB3 LYS 98 HB3 LYS 98 15.360 3.192 18.825 739 HG2 LYS 98 HG2 LYS 98 14.900 5.131 20.940 740 HG3 LYS 98 HG3 LYS 98 13.833 3.770 21.231 741 HD2 LYS 98 HD2 LYS 98 16.855 3.635 20.876 742 HD3 LYS 98 HD3 LYS 98 15.979 3.580 22.411 743 HE2 LYS 98 HE2 LYS 98 14.801 1.488 21.575 744 HE3 LYS 98 HE3 LYS 98 15.879 1.517 20.170 745 HZ1 LYS 98 HZ3 LYS 98 17.759 1.411 21.770 746 HZ2 LYS 98 HZ1 LYS 98 16.697 1.209 22.998 747 HZ3 LYS 98 HZ2 LYS 98 16.797 0.080 21.828 748 H LEU 99 H LEU 99 12.574 5.499 16.772 749 HA LEU 99 HA LEU 99 14.115 4.599 14.403 750 HB2 LEU 99 HB2 LEU 99 12.861 2.665 15.470 751 HB3 LEU 99 HB3 LEU 99 11.405 3.650 15.404 752 HG LEU 99 HG LEU 99 11.708 3.651 12.824 753 HD11 LEU 99 HD11 LEU 99 13.480 1.254 13.504 754 HD12 LEU 99 HD12 LEU 99 12.935 1.707 11.891 755 HD13 LEU 99 HD13 LEU 99 14.059 2.737 12.765 756 HD21 LEU 99 HD23 LEU 99 10.383 1.718 12.655 757 HD22 LEU 99 HD21 LEU 99 11.098 0.976 14.120 758 HD23 LEU 99 HD22 LEU 99 10.019 2.376 14.227 759 H LEU 100 H LEU 100 13.634 5.628 12.554 760 HA LEU 100 HA LEU 100 11.319 7.492 12.524 761 HB2 LEU 100 HB2 LEU 100 14.080 8.348 11.588 762 HB3 LEU 100 HB3 LEU 100 12.641 9.311 11.747 763 HG LEU 100 HG LEU 100 12.916 8.469 14.313 764 HD11 LEU 100 HD11 LEU 100 15.233 8.546 15.054 765 HD12 LEU 100 HD12 LEU 100 15.065 7.270 13.843 766 HD13 LEU 100 HD13 LEU 100 15.785 8.823 13.385 767 HD21 LEU 100 HD23 LEU 100 14.377 10.907 13.313 768 HD22 LEU 100 HD21 LEU 100 12.628 10.806 13.631 769 HD23 LEU 100 HD22 LEU 100 13.785 10.592 14.953 770 H ILE 101 H ILE 101 10.319 7.549 10.504 771 HA ILE 101 HA ILE 101 11.903 6.540 8.198 772 HB ILE 101 HB ILE 101 9.061 5.931 8.960 773 HG12 ILE 101 HG12 ILE 101 11.388 4.569 7.563 774 HG13 ILE 101 HG13 ILE 101 10.743 4.261 9.178 775 HG21 ILE 101 HG21 ILE 101 8.669 7.288 6.938 776 HG22 ILE 101 HG22 ILE 101 9.812 6.257 6.039 777 HG23 ILE 101 HG23 ILE 101 8.296 5.601 6.699 778 HD11 ILE 101 HD13 ILE 101 9.528 3.588 6.491 779 HD12 ILE 101 HD11 ILE 101 10.076 2.474 7.744 780 HD13 ILE 101 HD12 ILE 101 8.618 3.461 8.026 781 H GLY 102 H GLY 102 12.227 7.865 6.608 782 HA2 GLY 102 HA2 GLY 102 11.206 10.645 6.772 783 HA3 GLY 102 HA3 GLY 102 12.557 10.083 5.783 784 H LEU 103 H LEU 103 10.009 11.470 4.955 785 HA LEU 103 HA LEU 103 9.536 9.785 2.616 786 HB2 LEU 103 HB2 LEU 103 7.704 9.202 4.368 787 HB3 LEU 103 HB3 LEU 103 7.213 10.878 4.259 788 HG LEU 103 HG LEU 103 6.889 8.615 2.257 789 HD11 LEU 103 HD11 LEU 103 4.918 10.688 3.381 790 HD12 LEU 103 HD12 LEU 103 4.566 9.077 2.724 791 HD13 LEU 103 HD13 LEU 103 5.344 9.255 4.291 792 HD21 LEU 103 HD23 LEU 103 7.317 10.269 0.688 793 HD22 LEU 103 HD21 LEU 103 5.588 10.414 0.877 794 HD23 LEU 103 HD22 LEU 103 6.600 11.587 1.687 795 H SER 104 H SER 104 9.162 11.097 0.825 796 HA SER 104 HA SER 104 8.377 13.885 1.181 797 HB2 SER 104 HB2 SER 104 10.093 14.676 -0.389 798 HB3 SER 104 HB3 SER 104 10.813 14.033 1.099 799 HG SER 104 HG SER 104 10.858 13.006 -1.515 800 H ALA 105 H ALA 105 7.036 14.503 -0.613 801 HA ALA 105 HA ALA 105 7.154 12.826 -2.978 802 HB1 ALA 105 HB3 ALA 105 4.409 13.293 -1.912 803 HB2 ALA 105 HB1 ALA 105 4.996 12.098 -3.061 804 HB3 ALA 105 HB2 ALA 105 5.344 11.882 -1.345 805 H ALA 106 H ALA 106 6.481 13.833 -4.851 806 HA ALA 106 HA ALA 106 6.727 16.704 -4.654 807 HB1 ALA 106 HB3 ALA 106 7.753 15.407 -6.517 808 HB2 ALA 106 HB1 ALA 106 6.134 14.917 -7.073 809 HB3 ALA 106 HB2 ALA 106 6.623 16.624 -7.138 810 H ASP 107 H ASP 107 4.045 14.500 -4.619 811 HA ASP 107 HA ASP 107 2.159 16.810 -4.852 812 HB2 ASP 107 HB2 ASP 107 2.211 15.605 -7.025 813 HB3 ASP 107 HB3 ASP 107 1.783 14.110 -6.194 814 H ALA 108 H ALA 108 0.096 16.459 -3.761 815 HA ALA 108 HA ALA 108 0.416 15.275 -1.206 816 HB1 ALA 108 HB3 ALA 108 -1.062 17.202 -1.636 817 HB2 ALA 108 HB1 ALA 108 -2.116 16.177 -2.642 818 HB3 ALA 108 HB2 ALA 108 -1.961 15.860 -0.902 819 H ASP 109 H ASP 109 -1.132 14.008 -4.188 820 HA ASP 109 HA ASP 109 -2.287 11.712 -2.767 821 HB2 ASP 109 HB2 ASP 109 -3.340 12.512 -4.788 822 HB3 ASP 109 HB3 ASP 109 -1.849 12.252 -5.716 823 H SER 110 H SER 110 0.736 12.438 -4.476 824 HA SER 110 HA SER 110 1.786 9.760 -4.383 825 HB2 SER 110 HB2 SER 110 3.261 12.423 -4.388 826 HB3 SER 110 HB3 SER 110 3.941 10.839 -4.784 827 HG SER 110 HG SER 110 2.535 10.739 -6.564 828 H HIS 111 H HIS 111 1.801 12.511 -2.013 829 HA HIS 111 HA HIS 111 3.281 11.101 -0.009 830 HB2 HIS 111 HB2 HIS 111 1.230 13.334 0.193 831 HB3 HIS 111 HB3 HIS 111 1.896 12.545 1.608 832 HD1 HIS 111 HD1 HIS 111 2.819 15.204 -0.884 833 HD2 HIS 111 HD2 HIS 111 4.614 12.699 1.970 834 HE1 HIS 111 HE1 HIS 111 5.050 16.280 -0.255 835 H ILE 112 H ILE 112 -0.276 11.199 -0.679 836 HA ILE 112 HA ILE 112 -1.048 9.523 1.463 837 HB ILE 112 HB ILE 112 -2.221 9.885 -1.318 838 HG12 ILE 112 HG12 ILE 112 -2.281 11.877 0.183 839 HG13 ILE 112 HG13 ILE 112 -3.850 11.309 -0.351 840 HG21 ILE 112 HG21 ILE 112 -3.421 8.295 0.965 841 HG22 ILE 112 HG22 ILE 112 -4.327 8.888 -0.451 842 HG23 ILE 112 HG23 ILE 112 -3.015 7.732 -0.669 843 HD11 ILE 112 HD13 ILE 112 -2.632 10.786 2.394 844 HD12 ILE 112 HD11 ILE 112 -3.842 12.021 1.996 845 HD13 ILE 112 HD12 ILE 112 -4.264 10.308 1.857 846 H GLY 113 H GLY 113 -0.088 8.536 -1.907 847 HA2 GLY 113 HA2 GLY 113 -0.333 5.768 -1.465 848 HA3 GLY 113 HA3 GLY 113 0.756 6.530 -2.645 849 H ALA 114 H ALA 114 2.453 7.934 -0.818 850 HA ALA 114 HA ALA 114 4.313 5.852 -0.149 851 HB1 ALA 114 HB3 ALA 114 5.644 7.753 0.704 852 HB2 ALA 114 HB1 ALA 114 4.961 8.153 -0.875 853 HB3 ALA 114 HB2 ALA 114 4.222 8.816 0.581 854 H ILE 115 H ILE 115 2.235 8.006 1.875 855 HA ILE 115 HA ILE 115 2.987 7.103 4.373 856 HB ILE 115 HB ILE 115 0.617 8.327 3.124 857 HG12 ILE 115 HG12 ILE 115 2.611 9.720 3.724 858 HG13 ILE 115 HG13 ILE 115 1.069 10.303 4.319 859 HG21 ILE 115 HG21 ILE 115 0.564 7.340 5.941 860 HG22 ILE 115 HG22 ILE 115 -0.502 8.654 5.337 861 HG23 ILE 115 HG23 ILE 115 -0.583 7.050 4.610 862 HD11 ILE 115 HD13 ILE 115 2.965 10.473 5.957 863 HD12 ILE 115 HD11 ILE 115 1.546 9.602 6.567 864 HD13 ILE 115 HD12 ILE 115 2.974 8.696 6.036 865 H GLN 116 H GLN 116 0.406 5.992 2.064 866 HA GLN 116 HA GLN 116 -0.627 3.931 3.766 867 HB2 GLN 116 HB2 GLN 116 -0.836 4.502 0.781 868 HB3 GLN 116 HB3 GLN 116 -1.680 3.156 1.540 869 HG2 GLN 116 HG2 GLN 116 -1.989 6.054 2.406 870 HG3 GLN 116 HG3 GLN 116 -3.054 5.254 1.258 871 HE21 GLN 116 HE22 GLN 116 -3.166 6.309 4.300 872 HE22 GLN 116 HE21 GLN 116 -4.070 5.039 5.078 873 H ALA 117 H ALA 117 2.354 4.056 2.159 874 HA ALA 117 HA ALA 117 2.535 1.144 1.943 875 HB1 ALA 117 HB3 ALA 117 4.526 3.282 1.046 876 HB2 ALA 117 HB1 ALA 117 4.677 1.545 0.770 877 HB3 ALA 117 HB2 ALA 117 3.380 2.459 -0.021 878 H LEU 118 H LEU 118 4.058 3.994 3.550 879 HA LEU 118 HA LEU 118 5.767 2.255 5.050 880 HB2 LEU 118 HB2 LEU 118 6.478 4.173 6.203 881 HB3 LEU 118 HB3 LEU 118 6.227 4.547 4.482 882 HG LEU 118 HG LEU 118 3.924 5.374 5.190 883 HD11 LEU 118 HD11 LEU 118 4.325 4.646 7.719 884 HD12 LEU 118 HD12 LEU 118 5.376 6.044 7.767 885 HD13 LEU 118 HD13 LEU 118 3.629 6.202 7.358 886 HD21 LEU 118 HD23 LEU 118 6.486 6.905 5.730 887 HD22 LEU 118 HD21 LEU 118 5.540 6.830 4.227 888 HD23 LEU 118 HD22 LEU 118 4.874 7.634 5.651 889 H SER 119 H SER 119 2.544 3.524 5.595 890 HA SER 119 HA SER 119 2.310 2.796 8.312 891 HB2 SER 119 HB2 SER 119 0.121 2.706 6.193 892 HB3 SER 119 HB3 SER 119 -0.124 2.744 7.948 893 HG SER 119 HG SER 119 0.987 4.731 6.263 894 H GLU 120 H GLU 120 2.563 0.631 5.549 895 HA GLU 120 HA GLU 120 1.383 -1.675 6.778 896 HB2 GLU 120 HB2 GLU 120 3.615 -1.508 4.733 897 HB3 GLU 120 HB3 GLU 120 2.718 -2.958 5.139 898 HG2 GLU 120 HG2 GLU 120 1.370 -0.462 4.056 899 HG3 GLU 120 HG3 GLU 120 2.002 -1.722 3.005 900 H LEU 121 H LEU 121 4.225 0.163 7.257 901 HA LEU 121 HA LEU 121 5.601 -1.934 8.864 902 HB2 LEU 121 HB2 LEU 121 6.698 0.699 7.793 903 HB3 LEU 121 HB3 LEU 121 7.603 -0.569 8.581 904 HG LEU 121 HG LEU 121 6.312 -0.593 5.828 905 HD11 LEU 121 HD11 LEU 121 8.663 -0.908 5.096 906 HD12 LEU 121 HD12 LEU 121 8.444 0.586 6.024 907 HD13 LEU 121 HD13 LEU 121 9.190 -0.835 6.789 908 HD21 LEU 121 HD23 LEU 121 6.056 -2.905 6.776 909 HD22 LEU 121 HD21 LEU 121 7.180 -2.843 5.423 910 HD23 LEU 121 HD22 LEU 121 7.812 -2.959 7.064 911 H LEU 122 H LEU 122 5.121 1.673 9.029 912 HA LEU 122 HA LEU 122 5.752 1.826 11.788 913 HB2 LEU 122 HB2 LEU 122 4.191 3.789 10.127 914 HB3 LEU 122 HB3 LEU 122 4.822 4.034 11.750 915 HG LEU 122 HG LEU 122 6.324 3.911 9.152 916 HD11 LEU 122 HD11 LEU 122 5.530 6.004 10.336 917 HD12 LEU 122 HD12 LEU 122 6.646 5.623 11.658 918 HD13 LEU 122 HD13 LEU 122 7.266 5.962 10.039 919 HD21 LEU 122 HD23 LEU 122 8.494 3.825 10.432 920 HD22 LEU 122 HD21 LEU 122 7.595 3.297 11.861 921 HD23 LEU 122 HD22 LEU 122 7.637 2.283 10.403 922 H CYS 123 H CYS 123 2.716 0.790 10.420 923 HA CYS 123 HA CYS 123 1.455 1.191 13.089 924 HB2 CYS 123 HB2 CYS 123 0.079 0.721 10.418 925 HB3 CYS 123 HB3 CYS 123 -0.690 1.139 11.946 926 HG CYS 123 HG CYS 123 0.451 3.480 12.246 927 H GLU 124 H GLU 124 3.319 -0.947 12.323 928 HA GLU 124 HA GLU 124 1.553 -3.251 12.831 929 HB2 GLU 124 HB2 GLU 124 2.001 -2.917 10.343 930 HB3 GLU 124 HB3 GLU 124 3.702 -3.250 10.680 931 HG2 GLU 124 HG2 GLU 124 2.619 -5.235 9.883 932 HG3 GLU 124 HG3 GLU 124 3.074 -5.469 11.577 933 H GLU 125 H GLU 125 2.159 -3.588 14.862 934 HA GLU 125 HA GLU 125 4.657 -3.076 15.949 935 HB2 GLU 125 HB2 GLU 125 3.936 -4.332 17.881 936 HB3 GLU 125 HB3 GLU 125 2.623 -3.336 17.256 937 HG2 GLU 125 HG2 GLU 125 1.650 -5.364 16.140 938 HG3 GLU 125 HG3 GLU 125 2.941 -6.345 16.837 939 H GLU 126 H GLU 126 3.654 -5.890 14.119 940 HA GLU 126 HA GLU 126 5.697 -7.692 14.936 941 HB2 GLU 126 HB2 GLU 126 4.317 -7.458 12.222 942 HB3 GLU 126 HB3 GLU 126 5.308 -8.821 12.760 943 HG2 GLU 126 HG2 GLU 126 3.736 -9.127 14.689 944 HG3 GLU 126 HG3 GLU 126 2.699 -7.875 13.985 945 H ILE 127 H ILE 127 5.543 -5.219 12.391 946 HA ILE 127 HA ILE 127 8.247 -5.651 11.428 947 HB ILE 127 HB ILE 127 6.095 -3.637 10.954 948 HG12 ILE 127 HG12 ILE 127 6.240 -4.321 8.670 949 HG13 ILE 127 HG13 ILE 127 7.685 -5.300 8.974 950 HG21 ILE 127 HG21 ILE 127 9.008 -3.362 10.230 951 HG22 ILE 127 HG22 ILE 127 7.745 -2.620 9.254 952 HG23 ILE 127 HG23 ILE 127 7.908 -2.161 10.950 953 HD11 ILE 127 HD13 ILE 127 5.599 -6.602 8.611 954 HD12 ILE 127 HD11 ILE 127 6.362 -6.940 10.173 955 HD13 ILE 127 HD12 ILE 127 4.925 -5.879 10.087 956 H LEU 128 H LEU 128 6.593 -3.303 13.618 957 HA LEU 128 HA LEU 128 8.764 -1.600 13.944 958 HB2 LEU 128 HB2 LEU 128 6.665 -2.334 16.020 959 HB3 LEU 128 HB3 LEU 128 7.818 -1.028 16.211 960 HG LEU 128 HG LEU 128 5.690 -1.147 14.037 961 HD11 LEU 128 HD11 LEU 128 4.766 -0.732 16.270 962 HD12 LEU 128 HD12 LEU 128 5.942 0.567 16.543 963 HD13 LEU 128 HD13 LEU 128 4.695 0.734 15.287 964 HD21 LEU 128 HD23 LEU 128 6.417 1.286 13.742 965 HD22 LEU 128 HD21 LEU 128 7.900 0.856 14.614 966 HD23 LEU 128 HD22 LEU 128 7.495 0.057 13.079 967 H GLU 129 H GLU 129 8.171 -4.621 15.742 968 HA GLU 129 HA GLU 129 10.365 -4.118 17.495 969 HB2 GLU 129 HB2 GLU 129 9.852 -5.978 18.619 970 HB3 GLU 129 HB3 GLU 129 8.298 -5.707 17.840 971 HG2 GLU 129 HG2 GLU 129 9.015 -7.394 16.068 972 HG3 GLU 129 HG3 GLU 129 10.478 -7.684 17.031 973 H GLN 130 H GLN 130 10.084 -5.623 14.265 974 HA GLN 130 HA GLN 130 12.599 -7.019 14.391 975 HB2 GLN 130 HB2 GLN 130 10.796 -6.100 12.120 976 HB3 GLN 130 HB3 GLN 130 12.310 -6.980 11.866 977 HG2 GLN 130 HG2 GLN 130 11.509 -8.934 12.959 978 HG3 GLN 130 HG3 GLN 130 10.070 -8.111 13.549 979 HE21 GLN 130 HE22 GLN 130 8.245 -8.313 12.311 980 HE22 GLN 130 HE21 GLN 130 8.203 -8.871 10.642 981 H LEU 131 H LEU 131 11.451 -3.787 13.301 982 HA LEU 131 HA LEU 131 14.033 -2.915 12.316 983 HB2 LEU 131 HB2 LEU 131 11.780 -1.227 13.451 984 HB3 LEU 131 HB3 LEU 131 13.124 -0.658 12.482 985 HG LEU 131 HG LEU 131 11.100 -2.686 11.409 986 HD11 LEU 131 HD11 LEU 131 9.812 -0.859 10.508 987 HD12 LEU 131 HD12 LEU 131 9.980 -0.669 12.276 988 HD13 LEU 131 HD13 LEU 131 10.965 0.316 11.152 989 HD21 LEU 131 HD23 LEU 131 12.881 -0.686 9.984 990 HD22 LEU 131 HD21 LEU 131 13.169 -2.434 10.084 991 HD23 LEU 131 HD22 LEU 131 11.758 -1.812 9.212 992 H LEU 132 H LEU 132 12.194 -2.348 15.328 993 HA LEU 132 HA LEU 132 14.260 -0.953 16.696 994 HB2 LEU 132 HB2 LEU 132 11.922 -2.560 17.745 995 HB3 LEU 132 HB3 LEU 132 12.987 -1.665 18.810 996 HG LEU 132 HG LEU 132 11.531 -0.299 16.515 997 HD11 LEU 132 HD11 LEU 132 9.868 0.445 18.171 998 HD12 LEU 132 HD12 LEU 132 9.870 -1.318 18.042 999 HD13 LEU 132 HD13 LEU 132 10.656 -0.537 19.429 1000 HD21 LEU 132 HD23 LEU 132 12.822 0.790 19.050 1001 HD22 LEU 132 HD21 LEU 132 13.436 0.973 17.393 1002 HD23 LEU 132 HD22 LEU 132 11.916 1.740 17.852 1003 H THR 133 H THR 133 14.433 -4.225 15.786 1004 HA THR 133 HA THR 133 16.595 -4.673 17.757 1005 HB THR 133 HB THR 133 16.094 -7.097 17.564 1006 HG1 THR 133 HG1 THR 133 13.644 -6.295 16.430 1007 HG21 THR 133 HG23 THR 133 15.177 -5.925 19.502 1008 HG22 THR 133 HG21 THR 133 13.732 -5.450 18.584 1009 HG23 THR 133 HG22 THR 133 14.030 -7.157 18.930 1010 H ALA 134 H ALA 134 16.287 -3.580 14.772 1011 HA ALA 134 HA ALA 134 17.657 -5.397 13.103 1012 HB1 ALA 134 HB3 ALA 134 18.084 -3.377 11.694 1013 HB2 ALA 134 HB1 ALA 134 16.379 -3.638 12.129 1014 HB3 ALA 134 HB2 ALA 134 17.354 -2.394 12.953 1015 H SER 135 H SER 135 19.645 -6.211 13.602 1016 HA SER 135 HA SER 135 21.601 -4.779 15.129 1017 HB2 SER 135 HB2 SER 135 21.875 -7.273 13.397 1018 HB3 SER 135 HB3 SER 135 22.990 -6.750 14.672 1019 HG SER 135 HG SER 135 21.511 -8.351 15.394 1020 H SER 136 H SER 136 20.787 -4.612 11.736 1021 HA SER 136 HA SER 136 23.252 -3.115 11.171 1022 HB2 SER 136 HB2 SER 136 23.734 -4.534 9.201 1023 HB3 SER 136 HB3 SER 136 23.833 -5.463 10.702 1024 HG SER 136 HG SER 136 22.661 -6.663 9.269 1025 H GLU 137 H GLU 137 23.167 -2.056 9.100 1026 HA GLU 137 HA GLU 137 20.753 -0.793 8.326 1027 HB2 GLU 137 HB2 GLU 137 23.219 -0.181 7.908 1028 HB3 GLU 137 HB3 GLU 137 23.210 -1.382 6.611 1029 HG2 GLU 137 HG2 GLU 137 21.311 -0.098 5.551 1030 HG3 GLU 137 HG3 GLU 137 21.490 1.100 6.846 1031 H LYS 138 H LYS 138 22.390 -3.765 7.194 1032 HA LYS 138 HA LYS 138 20.688 -4.322 5.003 1033 HB2 LYS 138 HB2 LYS 138 22.182 -6.297 6.783 1034 HB3 LYS 138 HB3 LYS 138 21.522 -6.643 5.191 1035 HG2 LYS 138 HG2 LYS 138 23.804 -4.714 5.806 1036 HG3 LYS 138 HG3 LYS 138 23.940 -6.325 5.102 1037 HD2 LYS 138 HD2 LYS 138 22.598 -5.554 3.129 1038 HD3 LYS 138 HD3 LYS 138 22.588 -3.911 3.814 1039 HE2 LYS 138 HE2 LYS 138 25.068 -3.880 3.789 1040 HE3 LYS 138 HE3 LYS 138 25.087 -5.514 3.113 1041 HZ1 LYS 138 HZ3 LYS 138 23.943 -3.132 1.771 1042 HZ2 LYS 138 HZ1 LYS 138 25.357 -3.848 1.396 1043 HZ3 LYS 138 HZ2 LYS 138 23.960 -4.644 1.148 1044 H GLN 139 H GLN 139 20.366 -5.266 8.476 1045 HA GLN 139 HA GLN 139 18.044 -6.744 8.057 1046 HB2 GLN 139 HB2 GLN 139 19.691 -6.282 10.175 1047 HB3 GLN 139 HB3 GLN 139 18.331 -5.246 10.629 1048 HG2 GLN 139 HG2 GLN 139 16.807 -7.181 10.206 1049 HG3 GLN 139 HG3 GLN 139 18.244 -8.161 9.834 1050 HE21 GLN 139 HE22 GLN 139 16.025 -7.967 12.187 1051 HE22 GLN 139 HE21 GLN 139 17.013 -8.153 13.612 1052 H LEU 140 H LEU 140 18.402 -3.160 8.540 1053 HA LEU 140 HA LEU 140 15.576 -2.700 8.882 1054 HB2 LEU 140 HB2 LEU 140 17.918 -1.004 8.028 1055 HB3 LEU 140 HB3 LEU 140 16.285 -0.382 7.930 1056 HG LEU 140 HG LEU 140 17.549 -1.350 10.509 1057 HD11 LEU 140 HD11 LEU 140 17.831 1.026 11.033 1058 HD12 LEU 140 HD12 LEU 140 18.687 0.643 9.538 1059 HD13 LEU 140 HD13 LEU 140 17.138 1.491 9.478 1060 HD21 LEU 140 HD23 LEU 140 15.790 -0.189 11.673 1061 HD22 LEU 140 HD21 LEU 140 14.989 0.171 10.132 1062 HD23 LEU 140 HD22 LEU 140 15.185 -1.517 10.700 1063 H ALA 141 H ALA 141 17.752 -2.523 6.029 1064 HA ALA 141 HA ALA 141 15.842 -2.228 4.010 1065 HB1 ALA 141 HB3 ALA 141 17.544 -3.058 2.499 1066 HB2 ALA 141 HB1 ALA 141 18.351 -2.093 3.754 1067 HB3 ALA 141 HB2 ALA 141 18.407 -3.864 3.822 1068 H ASP 142 H ASP 142 16.867 -5.302 5.549 1069 HA ASP 142 HA ASP 142 15.485 -7.038 3.797 1070 HB2 ASP 142 HB2 ASP 142 17.101 -7.973 5.255 1071 HB3 ASP 142 HB3 ASP 142 16.378 -7.232 6.675 1072 H ILE 143 H ILE 143 14.365 -5.287 6.748 1073 HA ILE 143 HA ILE 143 11.760 -6.439 6.709 1074 HB ILE 143 HB ILE 143 12.970 -3.997 8.040 1075 HG12 ILE 143 HG12 ILE 143 12.227 -6.620 9.392 1076 HG13 ILE 143 HG13 ILE 143 13.787 -6.481 8.599 1077 HG21 ILE 143 HG21 ILE 143 10.299 -5.381 8.464 1078 HG22 ILE 143 HG22 ILE 143 11.009 -4.227 9.609 1079 HG23 ILE 143 HG23 ILE 143 10.590 -3.695 7.971 1080 HD11 ILE 143 HD13 ILE 143 12.797 -4.749 10.866 1081 HD12 ILE 143 HD11 ILE 143 14.104 -5.952 10.905 1082 HD13 ILE 143 HD12 ILE 143 14.312 -4.462 9.980 1083 H ILE 144 H ILE 144 13.188 -3.483 5.279 1084 HA ILE 144 HA ILE 144 10.766 -2.432 4.167 1085 HB ILE 144 HB ILE 144 13.652 -2.338 3.187 1086 HG12 ILE 144 HG12 ILE 144 13.358 -1.014 5.142 1087 HG13 ILE 144 HG13 ILE 144 13.502 0.068 3.763 1088 HG21 ILE 144 HG21 ILE 144 13.003 -0.546 1.592 1089 HG22 ILE 144 HG22 ILE 144 12.429 -2.147 1.143 1090 HG23 ILE 144 HG23 ILE 144 11.301 -0.979 1.846 1091 HD11 ILE 144 HD13 ILE 144 11.745 0.990 5.012 1092 HD12 ILE 144 HD11 ILE 144 10.887 0.080 3.760 1093 HD13 ILE 144 HD12 ILE 144 11.074 -0.600 5.398 1094 H SER 145 H SER 145 12.991 -4.929 2.976 1095 HA SER 145 HA SER 145 11.866 -5.061 0.421 1096 HB2 SER 145 HB2 SER 145 13.417 -7.210 1.938 1097 HB3 SER 145 HB3 SER 145 13.167 -7.154 0.187 1098 HG SER 145 HG SER 145 14.565 -5.248 1.792 1099 H ARG 146 H ARG 146 10.667 -6.547 3.391 1100 HA ARG 146 HA ARG 146 9.153 -8.639 2.160 1101 HB2 ARG 146 HB2 ARG 146 8.110 -7.227 4.627 1102 HB3 ARG 146 HB3 ARG 146 8.027 -8.933 4.185 1103 HG2 ARG 146 HG2 ARG 146 10.573 -8.918 4.520 1104 HG3 ARG 146 HG3 ARG 146 10.314 -7.321 5.267 1105 HD2 ARG 146 HD2 ARG 146 8.629 -8.387 6.810 1106 HD3 ARG 146 HD3 ARG 146 9.106 -9.974 6.193 1107 HE ARG 146 HE ARG 146 10.227 -8.741 8.357 1108 HH11 ARG 146 HH11 ARG 146 11.712 -9.974 5.343 1109 HH12 ARG 146 HH12 ARG 146 13.310 -9.965 6.018 1110 HH21 ARG 146 HH21 ARG 146 12.223 -9.014 9.246 1111 HH22 ARG 146 HH22 ARG 146 13.614 -9.385 8.210 1112 H GLY 147 H GLY 147 8.640 -5.213 2.674 1113 HA2 GLY 147 HA2 GLY 147 5.847 -5.181 2.811 1114 HA3 GLY 147 HA3 GLY 147 6.922 -3.816 2.472 Start of MODEL 15 1 H MET 1 H1 MET 1 1.782 -0.747 -0.693 2 HA MET 1 HA MET 1 2.431 -1.370 -3.502 3 HB2 MET 1 HB2 MET 1 2.095 1.203 -2.878 4 HB3 MET 1 HB3 MET 1 3.603 0.987 -1.951 5 HG2 MET 1 HG2 MET 1 3.855 1.952 -4.253 6 HG3 MET 1 HG3 MET 1 4.874 0.574 -3.883 7 HE1 MET 1 HE3 MET 1 4.592 1.674 -6.778 8 HE2 MET 1 HE1 MET 1 5.547 0.234 -6.358 9 HE3 MET 1 HE2 MET 1 4.392 0.173 -7.709 10 H ARG 2 H ARG 2 4.617 -1.746 -3.940 11 HA ARG 2 HA ARG 2 5.918 -3.189 -1.820 12 HB2 ARG 2 HB2 ARG 2 6.974 -2.245 -4.524 13 HB3 ARG 2 HB3 ARG 2 7.860 -3.319 -3.424 14 HG2 ARG 2 HG2 ARG 2 5.120 -3.898 -4.592 15 HG3 ARG 2 HG3 ARG 2 6.623 -4.517 -5.274 16 HD2 ARG 2 HD2 ARG 2 5.887 -5.065 -2.382 17 HD3 ARG 2 HD3 ARG 2 5.113 -5.950 -3.672 18 HE ARG 2 HE ARG 2 7.231 -6.810 -4.410 19 HH11 ARG 2 HH21 ARG 2 7.445 -5.313 -1.112 20 HH12 ARG 2 HH22 ARG 2 8.816 -6.281 -0.710 21 HH21 ARG 2 HH11 ARG 2 9.075 -7.985 -3.759 22 HH22 ARG 2 HH12 ARG 2 9.746 -7.756 -2.185 23 H LEU 3 H LEU 3 6.823 -2.330 -0.218 24 HA LEU 3 HA LEU 3 7.143 0.463 0.233 25 HB2 LEU 3 HB2 LEU 3 8.286 -2.030 1.504 26 HB3 LEU 3 HB3 LEU 3 8.962 -0.470 1.942 27 HG LEU 3 HG LEU 3 7.194 -1.377 3.486 28 HD11 LEU 3 HD11 LEU 3 7.915 0.966 3.466 29 HD12 LEU 3 HD12 LEU 3 6.677 1.361 2.252 30 HD13 LEU 3 HD13 LEU 3 6.210 0.808 3.881 31 HD21 LEU 3 HD23 LEU 3 5.583 -2.204 1.758 32 HD22 LEU 3 HD21 LEU 3 4.857 -1.144 2.970 33 HD23 LEU 3 HD22 LEU 3 5.208 -0.534 1.345 34 H SER 4 H SER 4 9.507 -2.016 -0.794 35 HA SER 4 HA SER 4 11.806 -0.622 -0.951 36 HB2 SER 4 HB2 SER 4 11.105 -2.504 -3.189 37 HB3 SER 4 HB3 SER 4 12.561 -2.447 -2.181 38 HG SER 4 HG SER 4 11.147 -4.243 -1.784 39 H ASP 5 H ASP 5 9.034 -0.160 -3.155 40 HA ASP 5 HA ASP 5 10.461 0.916 -5.368 41 HB2 ASP 5 HB2 ASP 5 8.086 0.225 -5.441 42 HB3 ASP 5 HB3 ASP 5 7.665 1.572 -4.375 43 H TYR 6 H TYR 6 9.617 2.304 -2.243 44 HA TYR 6 HA TYR 6 10.002 5.066 -3.172 45 HB2 TYR 6 HB2 TYR 6 9.159 3.852 -0.522 46 HB3 TYR 6 HB3 TYR 6 9.309 5.581 -0.809 47 HD1 TYR 6 HD1 TYR 6 7.767 6.848 -2.091 48 HD2 TYR 6 HD2 TYR 6 7.119 2.611 -1.417 49 HE1 TYR 6 HE1 TYR 6 5.501 7.033 -3.071 50 HE2 TYR 6 HE2 TYR 6 4.844 2.842 -2.285 51 HH TYR 6 HH TYR 6 3.532 5.906 -3.611 52 H PHE 7 H PHE 7 12.124 2.645 -1.829 53 HA PHE 7 HA PHE 7 13.722 4.705 -0.381 54 HB2 PHE 7 HB2 PHE 7 13.816 1.682 -0.234 55 HB3 PHE 7 HB3 PHE 7 14.903 2.775 0.608 56 HD1 PHE 7 HD2 PHE 7 11.363 1.721 0.305 57 HD2 PHE 7 HD1 PHE 7 14.245 3.800 2.727 58 HE1 PHE 7 HE2 PHE 7 9.641 2.041 2.054 59 HE2 PHE 7 HE1 PHE 7 12.525 4.069 4.500 60 HZ PHE 7 HZ PHE 7 10.235 3.210 4.171 61 HA PRO 8 HA PRO 8 16.129 4.518 -4.217 62 HB2 PRO 8 HB2 PRO 8 18.141 6.318 -3.550 63 HB3 PRO 8 HB3 PRO 8 16.530 6.724 -4.188 64 HG2 PRO 8 HG2 PRO 8 17.424 6.687 -1.299 65 HG3 PRO 8 HG3 PRO 8 16.455 7.936 -2.137 66 HD2 PRO 8 HD2 PRO 8 15.264 6.073 -0.606 67 HD3 PRO 8 HD3 PRO 8 14.524 6.556 -2.153 68 H GLU 9 H GLU 9 18.527 4.897 -1.596 69 HA GLU 9 HA GLU 9 19.468 2.187 -1.705 70 HB2 GLU 9 HB2 GLU 9 20.352 3.077 -3.910 71 HB3 GLU 9 HB3 GLU 9 21.161 4.349 -3.015 72 HG2 GLU 9 HG2 GLU 9 22.817 2.693 -3.460 73 HG3 GLU 9 HG3 GLU 9 22.422 2.511 -1.754 74 H SER 10 H SER 10 21.179 5.274 -1.271 75 HA SER 10 HA SER 10 22.316 4.578 1.204 76 HB2 SER 10 HB2 SER 10 21.768 7.438 0.381 77 HB3 SER 10 HB3 SER 10 23.205 6.773 1.169 78 HG SER 10 HG SER 10 23.770 5.800 -0.798 79 H SER 11 H SER 11 19.141 4.733 0.821 80 HA SER 11 HA SER 11 18.208 6.837 2.542 81 HB2 SER 11 HB2 SER 11 16.077 5.189 2.137 82 HB3 SER 11 HB3 SER 11 16.646 6.414 1.006 83 HG SER 11 HG SER 11 17.030 3.610 0.905 84 H ILE 12 H ILE 12 19.635 3.823 3.363 85 HA ILE 12 HA ILE 12 17.931 3.505 5.757 86 HB ILE 12 HB ILE 12 19.411 1.522 4.015 87 HG12 ILE 12 HG12 ILE 12 16.488 2.355 4.267 88 HG13 ILE 12 HG13 ILE 12 17.499 2.329 2.830 89 HG21 ILE 12 HG21 ILE 12 18.333 -0.147 5.560 90 HG22 ILE 12 HG22 ILE 12 19.501 0.891 6.343 91 HG23 ILE 12 HG23 ILE 12 17.784 1.221 6.572 92 HD11 ILE 12 HD13 ILE 12 15.922 0.537 2.758 93 HD12 ILE 12 HD11 ILE 12 17.581 -0.104 2.918 94 HD13 ILE 12 HD12 ILE 12 16.482 -0.062 4.330 95 H SER 13 H SER 13 18.984 3.890 7.649 96 HA SER 13 HA SER 13 21.901 3.477 7.793 97 HB2 SER 13 HB2 SER 13 20.478 6.047 8.639 98 HB3 SER 13 HB3 SER 13 22.208 5.707 8.807 99 HG SER 13 HG SER 13 21.738 6.998 6.972 100 H VAL 14 H VAL 14 22.708 3.136 9.852 101 HA VAL 14 HA VAL 14 20.819 3.130 12.154 102 HB VAL 14 HB VAL 14 22.961 1.077 11.475 103 HG11 VAL 14 HG11 VAL 14 23.014 1.489 13.897 104 HG12 VAL 14 HG12 VAL 14 21.247 1.326 13.996 105 HG13 VAL 14 HG13 VAL 14 22.263 -0.074 13.587 106 HG21 VAL 14 HG23 VAL 14 20.759 0.677 10.331 107 HG22 VAL 14 HG21 VAL 14 21.139 -0.577 11.516 108 HG23 VAL 14 HG22 VAL 14 19.966 0.689 11.916 109 H ILE 15 H ILE 15 21.687 4.142 13.916 110 HA ILE 15 HA ILE 15 24.482 5.128 13.863 111 HB ILE 15 HB ILE 15 21.869 6.652 13.655 112 HG12 ILE 15 HG12 ILE 15 24.671 6.925 12.519 113 HG13 ILE 15 HG13 ILE 15 23.173 6.522 11.678 114 HG21 ILE 15 HG21 ILE 15 24.259 7.855 15.093 115 HG22 ILE 15 HG22 ILE 15 22.724 8.663 14.673 116 HG23 ILE 15 HG23 ILE 15 22.701 7.372 15.830 117 HD11 ILE 15 HD13 ILE 15 23.782 8.802 11.148 118 HD12 ILE 15 HD11 ILE 15 22.346 8.868 12.198 119 HD13 ILE 15 HD12 ILE 15 23.958 9.227 12.860 120 H HIS 16 H HIS 16 25.261 5.554 16.026 121 HA HIS 16 HA HIS 16 24.019 3.898 18.025 122 HB2 HIS 16 HB2 HIS 16 26.496 4.396 17.793 123 HB3 HIS 16 HB3 HIS 16 26.176 5.996 18.470 124 HD1 HIS 16 HD1 HIS 16 25.464 2.292 19.478 125 HD2 HIS 16 HD2 HIS 16 26.451 6.070 21.082 126 HE1 HIS 16 HE1 HIS 16 25.813 1.949 21.990 127 H SER 17 H SER 17 24.255 7.456 17.514 128 HA SER 17 HA SER 17 21.760 7.976 18.819 129 HB2 SER 17 HB2 SER 17 22.952 9.661 20.423 130 HB3 SER 17 HB3 SER 17 22.763 7.973 20.907 131 HG SER 17 HG SER 17 24.875 8.778 21.310 132 H ALA 18 H ALA 18 21.164 10.239 18.213 133 HA ALA 18 HA ALA 18 22.819 11.338 16.034 134 HB1 ALA 18 HB3 ALA 18 21.068 12.911 15.652 135 HB2 ALA 18 HB1 ALA 18 20.251 11.370 15.953 136 HB3 ALA 18 HB2 ALA 18 20.333 12.618 17.228 137 H LYS 19 H LYS 19 23.539 13.588 16.166 138 HA LYS 19 HA LYS 19 24.914 14.312 18.538 139 HB2 LYS 19 HB2 LYS 19 25.485 15.000 16.252 140 HB3 LYS 19 HB3 LYS 19 24.037 15.970 16.150 141 HG2 LYS 19 HG2 LYS 19 25.986 16.507 18.405 142 HG3 LYS 19 HG3 LYS 19 26.435 17.012 16.781 143 HD2 LYS 19 HD2 LYS 19 23.810 17.835 18.073 144 HD3 LYS 19 HD3 LYS 19 25.297 18.775 18.217 145 HE2 LYS 19 HE2 LYS 19 25.423 19.161 15.849 146 HE3 LYS 19 HE3 LYS 19 24.157 17.977 15.511 147 HZ1 LYS 19 HZ3 LYS 19 23.329 20.247 15.408 148 HZ2 LYS 19 HZ1 LYS 19 22.553 19.389 16.568 149 HZ3 LYS 19 HZ2 LYS 19 23.699 20.503 16.977 150 H ASP 20 H ASP 20 21.726 15.307 17.300 151 HA ASP 20 HA ASP 20 20.505 15.602 19.849 152 HB2 ASP 20 HB2 ASP 20 20.149 17.830 20.085 153 HB3 ASP 20 HB3 ASP 20 21.857 17.866 19.640 154 H TRP 21 H TRP 21 18.366 16.808 19.441 155 HA TRP 21 HA TRP 21 16.937 15.210 17.655 156 HB2 TRP 21 HB2 TRP 21 15.172 17.125 18.400 157 HB3 TRP 21 HB3 TRP 21 15.642 15.758 19.400 158 HD1 TRP 21 HD1 TRP 21 16.357 19.452 18.963 159 HE1 TRP 21 HE1 TRP 21 17.229 20.497 21.121 160 HE3 TRP 21 HE3 TRP 21 17.165 15.171 21.570 161 HZ2 TRP 21 HZ2 TRP 21 18.330 19.543 23.635 162 HZ3 TRP 21 HZ3 TRP 21 18.270 15.239 23.787 163 HH2 TRP 21 HH2 TRP 21 18.841 17.420 24.837 164 H GLN 22 H GLN 22 18.246 18.551 17.173 165 HA GLN 22 HA GLN 22 16.845 19.065 14.651 166 HB2 GLN 22 HB2 GLN 22 19.545 20.029 15.661 167 HB3 GLN 22 HB3 GLN 22 18.723 20.600 14.225 168 HG2 GLN 22 HG2 GLN 22 17.571 20.844 17.042 169 HG3 GLN 22 HG3 GLN 22 18.495 22.094 16.223 170 HE21 GLN 22 HE22 GLN 22 15.338 20.620 16.516 171 HE22 GLN 22 HE21 GLN 22 14.538 21.657 15.367 172 H GLU 23 H GLU 23 20.100 17.649 15.530 173 HA GLU 23 HA GLU 23 20.828 16.987 12.892 174 HB2 GLU 23 HB2 GLU 23 22.211 16.921 15.115 175 HB3 GLU 23 HB3 GLU 23 21.541 15.293 15.299 176 HG2 GLU 23 HG2 GLU 23 23.541 14.828 14.234 177 HG3 GLU 23 HG3 GLU 23 22.467 14.895 12.864 178 H ALA 24 H ALA 24 18.894 15.166 15.238 179 HA ALA 24 HA ALA 24 18.839 12.691 13.885 180 HB1 ALA 24 HB3 ALA 24 16.985 12.180 15.353 181 HB2 ALA 24 HB1 ALA 24 18.173 13.171 16.242 182 HB3 ALA 24 HB2 ALA 24 16.671 13.906 15.641 183 H ILE 25 H ILE 25 16.952 15.670 13.338 184 HA ILE 25 HA ILE 25 15.121 14.442 11.437 185 HB ILE 25 HB ILE 25 15.939 17.354 11.685 186 HG12 ILE 25 HG12 ILE 25 14.558 15.864 13.665 187 HG13 ILE 25 HG13 ILE 25 14.852 17.591 13.578 188 HG21 ILE 25 HG21 ILE 25 13.836 17.803 10.495 189 HG22 ILE 25 HG22 ILE 25 14.873 16.779 9.544 190 HG23 ILE 25 HG23 ILE 25 13.503 16.055 10.390 191 HD11 ILE 25 HD13 ILE 25 12.517 17.116 13.991 192 HD12 ILE 25 HD11 ILE 25 12.688 17.883 12.403 193 HD13 ILE 25 HD12 ILE 25 12.417 16.123 12.527 194 H ASP 26 H ASP 26 18.209 16.333 11.223 195 HA ASP 26 HA ASP 26 18.396 16.323 8.402 196 HB2 ASP 26 HB2 ASP 26 19.849 17.718 9.762 197 HB3 ASP 26 HB3 ASP 26 20.624 16.297 10.466 198 H PHE 27 H PHE 27 19.643 13.911 10.781 199 HA PHE 27 HA PHE 27 20.594 12.113 8.791 200 HB2 PHE 27 HB2 PHE 27 19.884 11.843 11.725 201 HB3 PHE 27 HB3 PHE 27 20.272 10.424 10.769 202 HD1 PHE 27 HD2 PHE 27 22.431 10.871 9.105 203 HD2 PHE 27 HD1 PHE 27 21.829 12.596 13.041 204 HE1 PHE 27 HE2 PHE 27 24.871 11.160 9.368 205 HE2 PHE 27 HE1 PHE 27 24.265 12.799 13.296 206 HZ PHE 27 HZ PHE 27 25.797 12.115 11.470 207 H SER 28 H SER 28 17.292 12.633 10.051 208 HA SER 28 HA SER 28 16.215 10.220 8.895 209 HB2 SER 28 HB2 SER 28 14.803 12.826 9.660 210 HB3 SER 28 HB3 SER 28 14.001 11.348 9.189 211 HG SER 28 HG SER 28 15.752 11.757 11.406 212 H MET 29 H MET 29 17.035 13.425 7.520 213 HA MET 29 HA MET 29 15.537 12.649 5.063 214 HB2 MET 29 HB2 MET 29 16.427 15.400 5.828 215 HB3 MET 29 HB3 MET 29 15.192 14.916 4.671 216 HG2 MET 29 HG2 MET 29 15.015 15.613 7.474 217 HG3 MET 29 HG3 MET 29 13.850 15.776 6.196 218 HE1 MET 29 HE3 MET 29 12.110 13.640 5.530 219 HE2 MET 29 HE1 MET 29 13.421 12.428 5.534 220 HE3 MET 29 HE2 MET 29 12.008 12.203 6.580 221 H VAL 30 H VAL 30 18.848 13.222 6.096 222 HA VAL 30 HA VAL 30 19.778 14.653 3.965 223 HB VAL 30 HB VAL 30 21.089 14.261 5.949 224 HG11 VAL 30 HG11 VAL 30 21.636 11.427 4.959 225 HG12 VAL 30 HG12 VAL 30 22.325 12.210 6.394 226 HG13 VAL 30 HG13 VAL 30 20.596 11.842 6.340 227 HG21 VAL 30 HG23 VAL 30 22.601 13.274 3.498 228 HG22 VAL 30 HG21 VAL 30 22.223 14.965 3.862 229 HG23 VAL 30 HG22 VAL 30 23.289 14.047 4.943 230 H SER 31 H SER 31 19.423 11.048 3.960 231 HA SER 31 HA SER 31 20.729 10.689 1.502 232 HB2 SER 31 HB2 SER 31 18.405 9.051 2.574 233 HB3 SER 31 HB3 SER 31 19.730 8.505 1.524 234 HG SER 31 HG SER 31 20.487 7.922 3.421 235 H LEU 32 H LEU 32 17.583 12.026 2.162 236 HA LEU 32 HA LEU 32 16.567 11.645 -0.579 237 HB2 LEU 32 HB2 LEU 32 15.464 13.084 1.881 238 HB3 LEU 32 HB3 LEU 32 14.638 13.034 0.353 239 HG LEU 32 HG LEU 32 15.405 10.537 1.929 240 HD11 LEU 32 HD11 LEU 32 12.772 12.050 1.839 241 HD12 LEU 32 HD12 LEU 32 13.005 10.432 2.542 242 HD13 LEU 32 HD13 LEU 32 13.839 11.827 3.233 243 HD21 LEU 32 HD23 LEU 32 15.110 10.070 -0.470 244 HD22 LEU 32 HD21 LEU 32 13.781 9.419 0.460 245 HD23 LEU 32 HD22 LEU 32 13.545 10.918 -0.458 246 H LEU 33 H LEU 33 17.837 14.219 1.583 247 HA LEU 33 HA LEU 33 17.640 16.403 -0.150 248 HB2 LEU 33 HB2 LEU 33 18.247 16.420 2.248 249 HB3 LEU 33 HB3 LEU 33 19.819 15.764 1.879 250 HG LEU 33 HG LEU 33 19.778 18.150 2.398 251 HD11 LEU 33 HD11 LEU 33 21.611 17.143 1.016 252 HD12 LEU 33 HD12 LEU 33 20.808 17.804 -0.429 253 HD13 LEU 33 HD13 LEU 33 21.386 18.890 0.835 254 HD21 LEU 33 HD23 LEU 33 17.651 18.780 1.304 255 HD22 LEU 33 HD21 LEU 33 18.995 19.826 0.821 256 HD23 LEU 33 HD22 LEU 33 18.411 18.571 -0.290 257 H ASP 34 H ASP 34 20.315 14.123 0.332 258 HA ASP 34 HA ASP 34 22.162 15.055 -1.498 259 HB2 ASP 34 HB2 ASP 34 22.612 13.265 0.200 260 HB3 ASP 34 HB3 ASP 34 21.460 12.198 -0.620 261 H LYS 35 H LYS 35 19.354 13.167 -2.197 262 HA LYS 35 HA LYS 35 20.284 12.833 -5.031 263 HB2 LYS 35 HB2 LYS 35 18.279 11.181 -3.541 264 HB3 LYS 35 HB3 LYS 35 18.891 10.939 -5.199 265 HG2 LYS 35 HG2 LYS 35 21.254 10.940 -4.106 266 HG3 LYS 35 HG3 LYS 35 20.391 10.807 -2.553 267 HD2 LYS 35 HD2 LYS 35 19.124 8.879 -3.897 268 HD3 LYS 35 HD3 LYS 35 20.656 8.898 -4.807 269 HE2 LYS 35 HE2 LYS 35 20.294 8.732 -1.781 270 HE3 LYS 35 HE3 LYS 35 20.599 7.308 -2.799 271 HZ1 LYS 35 HZ3 LYS 35 22.676 8.004 -1.857 272 HZ2 LYS 35 HZ1 LYS 35 22.739 8.351 -3.442 273 HZ3 LYS 35 HZ2 LYS 35 22.506 9.568 -2.364 274 H ASN 36 H ASN 36 19.015 15.169 -3.625 275 HA ASN 36 HA ASN 36 17.569 16.806 -4.170 276 HB2 ASN 36 HB2 ASN 36 18.911 16.294 -6.366 277 HB3 ASN 36 HB3 ASN 36 17.393 15.638 -6.974 278 HD21 ASN 36 HD22 ASN 36 18.725 18.466 -5.276 279 HD22 ASN 36 HD21 ASN 36 17.770 19.680 -6.107 280 H TYR 37 H TYR 37 16.299 14.251 -3.172 281 HA TYR 37 HA TYR 37 13.633 14.219 -4.377 282 HB2 TYR 37 HB2 TYR 37 14.775 13.159 -1.775 283 HB3 TYR 37 HB3 TYR 37 13.071 13.087 -2.143 284 HD1 TYR 37 HD2 TYR 37 12.168 11.627 -3.855 285 HD2 TYR 37 HD1 TYR 37 16.358 11.488 -2.783 286 HE1 TYR 37 HE2 TYR 37 12.451 9.559 -5.191 287 HE2 TYR 37 HE1 TYR 37 16.618 9.421 -4.092 288 HH TYR 37 HH TYR 37 13.913 7.913 -5.911 289 H ILE 38 H ILE 38 15.365 16.205 -2.079 290 HA ILE 38 HA ILE 38 12.995 17.890 -1.627 291 HB ILE 38 HB ILE 38 13.454 17.959 0.801 292 HG12 ILE 38 HG12 ILE 38 15.411 15.697 0.253 293 HG13 ILE 38 HG13 ILE 38 15.849 17.350 0.706 294 HG21 ILE 38 HG21 ILE 38 12.974 15.076 -0.042 295 HG22 ILE 38 HG22 ILE 38 12.428 15.879 1.439 296 HG23 ILE 38 HG23 ILE 38 11.751 16.362 -0.107 297 HD11 ILE 38 HD13 ILE 38 14.793 17.049 2.898 298 HD12 ILE 38 HD11 ILE 38 14.398 15.358 2.471 299 HD13 ILE 38 HD12 ILE 38 16.085 15.876 2.569 300 H SER 39 H SER 39 13.794 19.849 -0.282 301 HA SER 39 HA SER 39 16.455 20.827 -1.216 302 HB2 SER 39 HB2 SER 39 14.056 22.524 -0.445 303 HB3 SER 39 HB3 SER 39 15.469 22.989 -1.406 304 HG SER 39 HG SER 39 13.351 21.223 -2.126 305 H GLU 40 H GLU 40 17.563 22.269 0.455 306 HA GLU 40 HA GLU 40 17.664 21.057 2.919 307 HB2 GLU 40 HB2 GLU 40 19.205 22.800 1.562 308 HB3 GLU 40 HB3 GLU 40 18.463 23.953 2.682 309 HG2 GLU 40 HG2 GLU 40 19.168 22.421 4.570 310 HG3 GLU 40 HG3 GLU 40 19.932 21.381 3.357 311 H ASN 41 H ASN 41 15.646 23.837 2.026 312 HA ASN 41 HA ASN 41 14.794 24.652 4.608 313 HB2 ASN 41 HB2 ASN 41 14.238 25.881 2.523 314 HB3 ASN 41 HB3 ASN 41 13.212 24.545 1.987 315 HD21 ASN 41 HD22 ASN 41 11.088 24.251 2.995 316 HD22 ASN 41 HD21 ASN 41 10.443 25.486 4.049 317 H TYR 42 H TYR 42 13.870 21.779 2.714 318 HA TYR 42 HA TYR 42 11.410 21.195 4.016 319 HB2 TYR 42 HB2 TYR 42 12.312 20.201 1.882 320 HB3 TYR 42 HB3 TYR 42 13.479 19.296 2.842 321 HD1 TYR 42 HD1 TYR 42 9.920 19.680 2.000 322 HD2 TYR 42 HD2 TYR 42 12.842 17.347 4.145 323 HE1 TYR 42 HE1 TYR 42 8.322 17.771 2.117 324 HE2 TYR 42 HE2 TYR 42 11.255 15.455 4.293 325 HH TYR 42 HH TYR 42 9.178 14.605 3.595 326 H ILE 43 H ILE 43 14.810 20.212 4.718 327 HA ILE 43 HA ILE 43 14.211 18.582 6.974 328 HB ILE 43 HB ILE 43 16.730 20.177 6.264 329 HG12 ILE 43 HG12 ILE 43 17.335 17.526 5.855 330 HG13 ILE 43 HG13 ILE 43 15.631 17.531 5.395 331 HG21 ILE 43 HG21 ILE 43 16.397 17.845 8.202 332 HG22 ILE 43 HG22 ILE 43 17.913 18.682 7.791 333 HG23 ILE 43 HG23 ILE 43 16.644 19.539 8.671 334 HD11 ILE 43 HD13 ILE 43 17.832 19.295 4.259 335 HD12 ILE 43 HD11 ILE 43 17.107 17.879 3.485 336 HD13 ILE 43 HD12 ILE 43 16.121 19.327 3.743 337 H GLN 44 H GLN 44 15.041 22.109 6.700 338 HA GLN 44 HA GLN 44 14.799 22.411 9.525 339 HB2 GLN 44 HB2 GLN 44 16.157 23.871 7.902 340 HB3 GLN 44 HB3 GLN 44 14.653 24.733 7.603 341 HG2 GLN 44 HG2 GLN 44 15.968 25.866 9.357 342 HG3 GLN 44 HG3 GLN 44 14.491 25.240 10.063 343 HE21 GLN 44 HE22 GLN 44 14.908 24.419 12.151 344 HE22 GLN 44 HE21 GLN 44 16.292 23.454 12.603 345 H ALA 45 H ALA 45 12.341 22.527 7.000 346 HA ALA 45 HA ALA 45 10.331 23.847 8.491 347 HB1 ALA 45 HB3 ALA 45 10.139 23.313 6.061 348 HB2 ALA 45 HB1 ALA 45 9.972 21.584 6.464 349 HB3 ALA 45 HB2 ALA 45 8.741 22.731 6.991 350 H ILE 46 H ILE 46 11.317 20.358 8.410 351 HA ILE 46 HA ILE 46 9.209 19.528 10.201 352 HB ILE 46 HB ILE 46 11.906 18.225 9.682 353 HG12 ILE 46 HG12 ILE 46 9.307 17.606 8.262 354 HG13 ILE 46 HG13 ILE 46 10.588 18.571 7.558 355 HG21 ILE 46 HG21 ILE 46 9.276 16.969 10.607 356 HG22 ILE 46 HG22 ILE 46 10.875 16.191 10.542 357 HG23 ILE 46 HG23 ILE 46 10.560 17.463 11.717 358 HD11 ILE 46 HD13 ILE 46 10.861 15.654 8.344 359 HD12 ILE 46 HD11 ILE 46 10.763 16.326 6.710 360 HD13 ILE 46 HD12 ILE 46 12.169 16.690 7.730 361 H LYS 47 H LYS 47 12.709 20.417 10.580 362 HA LYS 47 HA LYS 47 12.847 19.957 13.345 363 HB2 LYS 47 HB2 LYS 47 14.201 21.975 11.520 364 HB3 LYS 47 HB3 LYS 47 14.636 21.835 13.205 365 HG2 LYS 47 HG2 LYS 47 15.555 19.641 12.910 366 HG3 LYS 47 HG3 LYS 47 14.893 19.518 11.266 367 HD2 LYS 47 HD2 LYS 47 16.296 21.279 10.464 368 HD3 LYS 47 HD3 LYS 47 16.879 21.644 12.098 369 HE2 LYS 47 HE2 LYS 47 18.091 19.567 12.196 370 HE3 LYS 47 HE3 LYS 47 17.491 19.075 10.610 371 HZ1 LYS 47 HZ3 LYS 47 19.183 21.472 11.146 372 HZ2 LYS 47 HZ1 LYS 47 19.730 20.078 10.509 373 HZ3 LYS 47 HZ2 LYS 47 18.681 21.008 9.671 374 H ASP 48 H ASP 48 11.881 22.964 11.600 375 HA ASP 48 HA ASP 48 11.556 24.588 13.903 376 HB2 ASP 48 HB2 ASP 48 11.828 25.522 11.674 377 HB3 ASP 48 HB3 ASP 48 10.343 24.740 11.120 378 H SER 49 H SER 49 9.246 22.518 12.082 379 HA SER 49 HA SER 49 6.926 23.172 13.620 380 HB2 SER 49 HB2 SER 49 7.639 20.559 12.212 381 HB3 SER 49 HB3 SER 49 6.024 21.109 12.677 382 HG SER 49 HG SER 49 7.761 22.183 10.718 383 H THR 50 H THR 50 9.503 20.734 14.040 384 HA THR 50 HA THR 50 8.438 19.498 16.349 385 HB THR 50 HB THR 50 11.323 19.685 15.400 386 HG1 THR 50 HG1 THR 50 10.046 18.866 13.782 387 HG21 THR 50 HG23 THR 50 11.161 18.727 17.675 388 HG22 THR 50 HG21 THR 50 9.925 17.584 17.092 389 HG23 THR 50 HG22 THR 50 11.582 17.499 16.468 390 H ILE 51 H ILE 51 10.591 22.370 15.996 391 HA ILE 51 HA ILE 51 10.923 22.781 18.832 392 HB ILE 51 HB ILE 51 11.184 24.568 16.385 393 HG12 ILE 51 HG12 ILE 51 13.324 23.560 18.313 394 HG13 ILE 51 HG13 ILE 51 12.851 22.660 16.882 395 HG21 ILE 51 HG21 ILE 51 10.579 26.070 18.235 396 HG22 ILE 51 HG22 ILE 51 11.827 25.334 19.267 397 HG23 ILE 51 HG23 ILE 51 12.268 26.278 17.829 398 HD11 ILE 51 HD13 ILE 51 14.062 25.456 16.864 399 HD12 ILE 51 HD11 ILE 51 14.851 23.950 16.411 400 HD13 ILE 51 HD12 ILE 51 13.505 24.560 15.429 401 H ASN 52 H ASN 52 8.482 23.882 16.441 402 HA ASN 52 HA ASN 52 7.294 25.895 18.014 403 HB2 ASN 52 HB2 ASN 52 6.508 24.304 15.579 404 HB3 ASN 52 HB3 ASN 52 5.190 25.017 16.457 405 HD21 ASN 52 HD22 ASN 52 8.317 25.859 14.916 406 HD22 ASN 52 HD21 ASN 52 7.893 27.521 14.578 407 H ASN 53 H ASN 53 6.609 22.445 17.840 408 HA ASN 53 HA ASN 53 4.602 22.642 20.050 409 HB2 ASN 53 HB2 ASN 53 3.112 22.795 18.289 410 HB3 ASN 53 HB3 ASN 53 4.184 22.007 17.147 411 HD21 ASN 53 HD22 ASN 53 3.942 19.854 16.702 412 HD22 ASN 53 HD21 ASN 53 2.795 18.814 17.510 413 H GLY 54 H GLY 54 6.368 20.456 17.776 414 HA2 GLY 54 HA2 GLY 54 7.799 18.821 19.300 415 HA3 GLY 54 HA3 GLY 54 6.164 18.241 19.684 416 HA PRO 55 HA PRO 55 7.838 16.156 15.707 417 HB2 PRO 55 HB2 PRO 55 6.826 13.960 17.563 418 HB3 PRO 55 HB3 PRO 55 8.038 13.832 16.239 419 HG2 PRO 55 HG2 PRO 55 8.890 14.106 18.754 420 HG3 PRO 55 HG3 PRO 55 9.592 15.169 17.486 421 HD2 PRO 55 HD2 PRO 55 7.413 15.844 19.486 422 HD3 PRO 55 HD3 PRO 55 8.848 16.808 19.025 423 H TYR 56 H TYR 56 6.429 16.148 14.084 424 HA TYR 56 HA TYR 56 3.521 16.244 14.635 425 HB2 TYR 56 HB2 TYR 56 5.308 17.016 12.343 426 HB3 TYR 56 HB3 TYR 56 3.660 16.557 11.970 427 HD1 TYR 56 HD2 TYR 56 5.607 18.841 14.208 428 HD2 TYR 56 HD1 TYR 56 1.886 18.057 12.192 429 HE1 TYR 56 HE2 TYR 56 4.770 21.083 14.895 430 HE2 TYR 56 HE1 TYR 56 1.032 20.289 12.870 431 HH TYR 56 HH TYR 56 2.995 22.606 14.795 432 H TYR 57 H TYR 57 5.787 13.820 13.895 433 HA TYR 57 HA TYR 57 3.740 12.065 12.641 434 HB2 TYR 57 HB2 TYR 57 6.557 12.597 11.697 435 HB3 TYR 57 HB3 TYR 57 5.553 11.225 11.218 436 HD1 TYR 57 HD1 TYR 57 5.934 14.923 10.938 437 HD2 TYR 57 HD2 TYR 57 3.614 11.465 9.785 438 HE1 TYR 57 HE1 TYR 57 4.742 16.285 9.256 439 HE2 TYR 57 HE2 TYR 57 2.381 12.835 8.135 440 HH TYR 57 HH TYR 57 2.037 14.991 7.283 441 H ILE 58 H ILE 58 3.390 10.731 14.341 442 HA ILE 58 HA ILE 58 5.581 9.209 15.567 443 HB ILE 58 HB ILE 58 3.527 10.844 17.115 444 HG12 ILE 58 HG12 ILE 58 5.579 12.130 16.507 445 HG13 ILE 58 HG13 ILE 58 5.288 11.971 18.226 446 HG21 ILE 58 HG21 ILE 58 3.584 8.702 18.191 447 HG22 ILE 58 HG22 ILE 58 5.349 8.607 18.099 448 HG23 ILE 58 HG23 ILE 58 4.563 9.789 19.173 449 HD11 ILE 58 HD13 ILE 58 7.327 10.335 16.665 450 HD12 ILE 58 HD11 ILE 58 7.692 11.706 17.735 451 HD13 ILE 58 HD12 ILE 58 7.010 10.232 18.409 452 H LEU 59 H LEU 59 4.825 7.117 15.921 453 HA LEU 59 HA LEU 59 1.985 6.567 15.105 454 HB2 LEU 59 HB2 LEU 59 4.510 5.263 14.088 455 HB3 LEU 59 HB3 LEU 59 2.886 4.616 13.894 456 HG LEU 59 HG LEU 59 2.493 7.260 13.108 457 HD11 LEU 59 HD11 LEU 59 4.255 7.935 11.639 458 HD12 LEU 59 HD12 LEU 59 4.975 7.645 13.218 459 HD13 LEU 59 HD13 LEU 59 5.172 6.437 11.945 460 HD21 LEU 59 HD23 LEU 59 1.582 5.304 12.086 461 HD22 LEU 59 HD21 LEU 59 2.275 6.391 10.873 462 HD23 LEU 59 HD22 LEU 59 3.148 4.904 11.342 463 H ALA 60 H ALA 60 4.687 5.725 17.186 464 HA ALA 60 HA ALA 60 3.014 4.182 18.913 465 HB1 ALA 60 HB3 ALA 60 4.409 2.102 18.832 466 HB2 ALA 60 HB1 ALA 60 3.588 2.379 17.289 467 HB3 ALA 60 HB2 ALA 60 5.313 2.766 17.462 468 HA PRO 61 HA PRO 61 6.102 5.816 21.725 469 HB2 PRO 61 HB2 PRO 61 6.417 3.011 22.816 470 HB3 PRO 61 HB3 PRO 61 6.257 4.556 23.706 471 HG2 PRO 61 HG2 PRO 61 4.116 2.918 23.421 472 HG3 PRO 61 HG3 PRO 61 3.924 4.687 23.200 473 HD2 PRO 61 HD2 PRO 61 4.199 2.547 21.082 474 HD3 PRO 61 HD3 PRO 61 3.084 3.946 21.138 475 H GLY 62 H GLY 62 8.033 6.401 20.852 476 HA2 GLY 62 HA2 GLY 62 10.292 6.117 20.506 477 HA3 GLY 62 HA3 GLY 62 10.129 4.366 20.467 478 H VAL 63 H VAL 63 7.802 5.769 18.364 479 HA VAL 63 HA VAL 63 9.564 5.267 16.003 480 HB VAL 63 HB VAL 63 6.691 4.381 16.497 481 HG11 VAL 63 HG11 VAL 63 6.907 3.107 14.390 482 HG12 VAL 63 HG12 VAL 63 7.081 4.837 14.131 483 HG13 VAL 63 HG13 VAL 63 8.525 3.809 14.135 484 HG21 VAL 63 HG23 VAL 63 7.630 2.068 16.465 485 HG22 VAL 63 HG21 VAL 63 9.269 2.759 16.486 486 HG23 VAL 63 HG22 VAL 63 8.165 3.002 17.851 487 H ALA 64 H ALA 64 9.618 6.929 14.633 488 HA ALA 64 HA ALA 64 7.335 8.836 14.490 489 HB1 ALA 64 HB3 ALA 64 10.306 9.447 14.176 490 HB2 ALA 64 HB1 ALA 64 8.983 10.626 14.048 491 HB3 ALA 64 HB2 ALA 64 9.327 9.858 15.601 492 H MET 65 H MET 65 7.288 9.997 12.348 493 HA MET 65 HA MET 65 8.536 8.464 10.179 494 HB2 MET 65 HB2 MET 65 6.306 7.533 10.419 495 HB3 MET 65 HB3 MET 65 5.604 9.118 10.051 496 HG2 MET 65 HG2 MET 65 7.126 8.907 7.878 497 HG3 MET 65 HG3 MET 65 7.152 7.202 8.296 498 HE1 MET 65 HE3 MET 65 4.785 5.864 8.728 499 HE2 MET 65 HE1 MET 65 3.966 7.222 9.555 500 HE3 MET 65 HE2 MET 65 3.210 6.459 8.140 501 HA PRO 66 HA PRO 66 8.755 13.139 10.212 502 HB2 PRO 66 HB2 PRO 66 11.494 12.502 9.049 503 HB3 PRO 66 HB3 PRO 66 11.047 13.840 10.156 504 HG2 PRO 66 HG2 PRO 66 12.238 11.636 11.131 505 HG3 PRO 66 HG3 PRO 66 10.818 12.313 11.993 506 HD2 PRO 66 HD2 PRO 66 10.893 9.979 10.055 507 HD3 PRO 66 HD3 PRO 66 10.085 10.102 11.643 508 H HIS 67 H HIS 67 8.750 14.652 8.570 509 HA HIS 67 HA HIS 67 8.806 14.433 5.794 510 HB2 HIS 67 HB2 HIS 67 7.249 12.610 5.750 511 HB3 HIS 67 HB3 HIS 67 6.304 13.265 7.070 512 HD1 HIS 67 HD1 HIS 67 4.360 14.961 6.467 513 HD2 HIS 67 HD2 HIS 67 6.729 13.736 3.201 514 HE1 HIS 67 HE1 HIS 67 3.123 15.653 4.367 515 H ALA 68 H ALA 68 7.685 16.295 4.837 516 HA ALA 68 HA ALA 68 6.185 18.112 6.584 517 HB1 ALA 68 HB3 ALA 68 8.430 19.093 6.707 518 HB2 ALA 68 HB1 ALA 68 8.605 18.990 4.940 519 HB3 ALA 68 HB2 ALA 68 7.402 20.074 5.668 520 H ARG 69 H ARG 69 4.746 19.409 5.284 521 HA ARG 69 HA ARG 69 3.544 17.963 3.194 522 HB2 ARG 69 HB2 ARG 69 3.409 20.919 3.910 523 HB3 ARG 69 HB3 ARG 69 2.341 20.141 2.726 524 HG2 ARG 69 HG2 ARG 69 1.490 18.602 4.465 525 HG3 ARG 69 HG3 ARG 69 2.528 19.390 5.673 526 HD2 ARG 69 HD2 ARG 69 1.377 21.546 5.255 527 HD3 ARG 69 HD3 ARG 69 0.323 20.747 4.066 528 HE ARG 69 HE ARG 69 0.140 19.303 6.483 529 HH11 ARG 69 HH11 ARG 69 -0.747 22.519 5.268 530 HH12 ARG 69 HH12 ARG 69 -2.071 22.722 6.351 531 HH21 ARG 69 HH21 ARG 69 -1.626 19.571 7.931 532 HH22 ARG 69 HH22 ARG 69 -2.580 21.004 7.899 533 HA PRO 70 HA PRO 70 6.142 18.145 -0.260 534 HB2 PRO 70 HB2 PRO 70 3.747 19.256 -1.785 535 HB3 PRO 70 HB3 PRO 70 4.930 18.034 -2.325 536 HG2 PRO 70 HG2 PRO 70 2.537 17.262 -1.309 537 HG3 PRO 70 HG3 PRO 70 4.021 16.402 -0.796 538 HD2 PRO 70 HD2 PRO 70 2.431 18.453 0.710 539 HD3 PRO 70 HD3 PRO 70 3.331 17.028 1.308 540 H GLU 71 H GLU 71 4.075 21.134 -0.156 541 HA GLU 71 HA GLU 71 5.792 22.759 -1.710 542 HB2 GLU 71 HB2 GLU 71 4.452 24.631 -0.829 543 HB3 GLU 71 HB3 GLU 71 3.476 23.325 -1.465 544 HG2 GLU 71 HG2 GLU 71 4.023 23.300 1.506 545 HG3 GLU 71 HG3 GLU 71 2.986 24.572 0.878 546 H CYS 72 H CYS 72 6.482 21.586 1.398 547 HA CYS 72 HA CYS 72 7.945 23.927 2.377 548 HB2 CYS 72 HB2 CYS 72 8.001 21.025 3.316 549 HB3 CYS 72 HB3 CYS 72 8.690 22.422 4.156 550 HG CYS 72 HG CYS 72 5.588 21.667 3.415 551 H GLY 73 H GLY 73 8.531 21.815 -0.162 552 HA2 GLY 73 HA2 GLY 73 10.589 22.581 -1.324 553 HA3 GLY 73 HA3 GLY 73 11.501 22.151 0.126 554 H ALA 74 H ALA 74 8.873 19.962 -0.711 555 HA ALA 74 HA ALA 74 10.729 17.814 -1.355 556 HB1 ALA 74 HB3 ALA 74 8.779 16.501 -1.791 557 HB2 ALA 74 HB1 ALA 74 8.528 17.389 -0.277 558 HB3 ALA 74 HB2 ALA 74 7.747 17.943 -1.788 559 H LEU 75 H LEU 75 11.063 16.937 -3.396 560 HA LEU 75 HA LEU 75 10.330 18.604 -5.771 561 HB2 LEU 75 HB2 LEU 75 12.997 17.325 -5.094 562 HB3 LEU 75 HB3 LEU 75 12.639 18.187 -6.582 563 HG LEU 75 HG LEU 75 12.722 19.420 -3.793 564 HD11 LEU 75 HD11 LEU 75 14.695 19.596 -6.108 565 HD12 LEU 75 HD12 LEU 75 14.819 20.459 -4.559 566 HD13 LEU 75 HD13 LEU 75 14.933 18.697 -4.596 567 HD21 LEU 75 HD23 LEU 75 11.191 20.680 -5.277 568 HD22 LEU 75 HD21 LEU 75 12.671 21.594 -4.991 569 HD23 LEU 75 HD22 LEU 75 12.442 20.745 -6.536 570 H LYS 76 H LYS 76 11.045 15.403 -4.412 571 HA LYS 76 HA LYS 76 9.760 14.109 -6.693 572 HB2 LYS 76 HB2 LYS 76 12.370 13.074 -5.561 573 HB3 LYS 76 HB3 LYS 76 11.497 12.444 -6.944 574 HG2 LYS 76 HG2 LYS 76 12.113 14.441 -8.255 575 HG3 LYS 76 HG3 LYS 76 12.895 15.160 -6.832 576 HD2 LYS 76 HD2 LYS 76 14.449 13.199 -6.726 577 HD3 LYS 76 HD3 LYS 76 13.804 12.641 -8.272 578 HE2 LYS 76 HE2 LYS 76 15.097 15.371 -7.759 579 HE3 LYS 76 HE3 LYS 76 15.951 13.968 -8.405 580 HZ1 LYS 76 HZ3 LYS 76 15.249 15.429 -10.175 581 HZ2 LYS 76 HZ1 LYS 76 14.462 14.012 -10.325 582 HZ3 LYS 76 HZ2 LYS 76 13.683 15.330 -9.744 583 H THR 77 H THR 77 9.160 11.761 -5.956 584 HA THR 77 HA THR 77 8.546 11.807 -3.118 585 HB THR 77 HB THR 77 7.500 10.268 -5.514 586 HG1 THR 77 HG1 THR 77 6.166 11.802 -5.729 587 HG21 THR 77 HG23 THR 77 5.661 9.577 -4.060 588 HG22 THR 77 HG21 THR 77 7.205 8.982 -3.448 589 HG23 THR 77 HG22 THR 77 6.437 10.389 -2.670 590 H GLY 78 H GLY 78 9.573 10.469 -1.657 591 HA2 GLY 78 HA2 GLY 78 10.583 7.869 -2.257 592 HA3 GLY 78 HA3 GLY 78 11.906 9.045 -2.267 593 H MET 79 H MET 79 12.188 7.208 -0.355 594 HA MET 79 HA MET 79 11.289 8.428 2.213 595 HB2 MET 79 HB2 MET 79 11.076 5.543 1.261 596 HB3 MET 79 HB3 MET 79 10.910 6.011 2.953 597 HG2 MET 79 HG2 MET 79 8.954 7.310 2.531 598 HG3 MET 79 HG3 MET 79 9.126 7.126 0.781 599 HE1 MET 79 HE3 MET 79 6.913 6.318 0.310 600 HE2 MET 79 HE1 MET 79 6.128 4.847 0.918 601 HE3 MET 79 HE2 MET 79 6.258 6.283 1.957 602 H SER 80 H SER 80 12.372 7.426 4.091 603 HA SER 80 HA SER 80 15.019 6.255 3.664 604 HB2 SER 80 HB2 SER 80 15.856 8.038 5.414 605 HB3 SER 80 HB3 SER 80 15.822 8.419 3.686 606 HG SER 80 HG SER 80 14.800 9.896 5.426 607 H LEU 81 H LEU 81 15.935 5.540 5.798 608 HA LEU 81 HA LEU 81 13.894 4.718 7.791 609 HB2 LEU 81 HB2 LEU 81 14.180 3.215 5.740 610 HB3 LEU 81 HB3 LEU 81 15.859 3.017 6.190 611 HG LEU 81 HG LEU 81 15.196 1.835 8.254 612 HD11 LEU 81 HD11 LEU 81 12.833 1.053 8.425 613 HD12 LEU 81 HD12 LEU 81 13.016 2.790 8.670 614 HD13 LEU 81 HD13 LEU 81 12.391 2.167 7.117 615 HD21 LEU 81 HD23 LEU 81 14.302 1.023 5.470 616 HD22 LEU 81 HD21 LEU 81 15.715 0.503 6.356 617 HD23 LEU 81 HD22 LEU 81 14.124 -0.111 6.835 618 H THR 82 H THR 82 14.848 5.494 9.699 619 HA THR 82 HA THR 82 17.809 5.271 9.977 620 HB THR 82 HB THR 82 15.897 7.407 11.043 621 HG1 THR 82 HG1 THR 82 16.092 7.542 8.806 622 HG21 THR 82 HG23 THR 82 17.994 8.686 11.462 623 HG22 THR 82 HG21 THR 82 17.866 7.211 12.427 624 HG23 THR 82 HG22 THR 82 18.946 7.243 11.018 625 H LEU 83 H LEU 83 18.525 4.441 11.985 626 HA LEU 83 HA LEU 83 16.516 4.112 14.121 627 HB2 LEU 83 HB2 LEU 83 16.763 1.931 12.825 628 HB3 LEU 83 HB3 LEU 83 18.477 1.946 13.264 629 HG LEU 83 HG LEU 83 17.573 2.046 15.743 630 HD11 LEU 83 HD11 LEU 83 15.151 0.691 14.471 631 HD12 LEU 83 HD12 LEU 83 15.429 1.188 16.172 632 HD13 LEU 83 HD13 LEU 83 15.187 2.409 14.925 633 HD21 LEU 83 HD23 LEU 83 17.300 -0.463 14.076 634 HD22 LEU 83 HD21 LEU 83 18.790 0.134 14.837 635 HD23 LEU 83 HD22 LEU 83 17.434 -0.402 15.845 636 H LEU 84 H LEU 84 17.400 4.219 16.167 637 HA LEU 84 HA LEU 84 20.196 5.256 16.404 638 HB2 LEU 84 HB2 LEU 84 17.659 6.217 17.785 639 HB3 LEU 84 HB3 LEU 84 19.286 6.676 18.244 640 HG LEU 84 HG LEU 84 18.296 8.471 17.093 641 HD11 LEU 84 HD11 LEU 84 19.884 8.908 15.315 642 HD12 LEU 84 HD12 LEU 84 20.687 8.047 16.639 643 HD13 LEU 84 HD13 LEU 84 20.234 7.176 15.155 644 HD21 LEU 84 HD23 LEU 84 17.844 6.787 14.629 645 HD22 LEU 84 HD21 LEU 84 16.591 7.218 15.810 646 HD23 LEU 84 HD22 LEU 84 17.442 8.484 14.891 647 H GLU 85 H GLU 85 21.279 3.688 17.548 648 HA GLU 85 HA GLU 85 20.014 1.606 18.951 649 HB2 GLU 85 HB2 GLU 85 22.839 2.655 19.358 650 HB3 GLU 85 HB3 GLU 85 22.230 1.103 19.918 651 HG2 GLU 85 HG2 GLU 85 21.748 0.458 17.544 652 HG3 GLU 85 HG3 GLU 85 22.545 1.939 17.011 653 H GLN 86 H GLN 86 20.894 4.798 20.139 654 HA GLN 86 HA GLN 86 20.108 3.990 22.905 655 HB2 GLN 86 HB2 GLN 86 21.767 6.326 21.960 656 HB3 GLN 86 HB3 GLN 86 21.430 5.916 23.642 657 HG2 GLN 86 HG2 GLN 86 22.894 4.079 21.707 658 HG3 GLN 86 HG3 GLN 86 23.683 5.216 22.787 659 HE21 GLN 86 HE22 GLN 86 21.533 2.278 22.766 660 HE22 GLN 86 HE21 GLN 86 22.058 1.727 24.337 661 H GLY 87 H GLY 87 18.782 5.501 20.240 662 HA2 GLY 87 HA2 GLY 87 17.011 6.856 19.889 663 HA3 GLY 87 HA3 GLY 87 16.610 6.779 21.605 664 H VAL 88 H VAL 88 16.131 9.072 20.264 665 HA VAL 88 HA VAL 88 17.883 10.985 21.663 666 HB VAL 88 HB VAL 88 16.952 11.481 18.786 667 HG11 VAL 88 HG11 VAL 88 17.248 13.531 19.997 668 HG12 VAL 88 HG12 VAL 88 18.850 13.009 20.588 669 HG13 VAL 88 HG13 VAL 88 18.576 13.325 18.861 670 HG21 VAL 88 HG23 VAL 88 18.721 9.654 18.892 671 HG22 VAL 88 HG21 VAL 88 19.079 11.069 17.966 672 HG23 VAL 88 HG22 VAL 88 19.803 10.875 19.598 673 H TYR 89 H TYR 89 16.583 12.872 22.328 674 HA TYR 89 HA TYR 89 13.709 12.110 22.479 675 HB2 TYR 89 HB2 TYR 89 15.296 11.875 24.482 676 HB3 TYR 89 HB3 TYR 89 15.247 13.617 24.594 677 HD1 TYR 89 HD2 TYR 89 11.940 13.114 23.558 678 HD2 TYR 89 HD1 TYR 89 14.578 12.114 26.860 679 HE1 TYR 89 HE2 TYR 89 10.017 12.857 25.042 680 HE2 TYR 89 HE1 TYR 89 12.624 11.888 28.349 681 HH TYR 89 HH TYR 89 10.310 12.039 28.530 682 H PHE 90 H PHE 90 12.703 13.361 20.977 683 HA PHE 90 HA PHE 90 13.296 16.070 20.386 684 HB2 PHE 90 HB2 PHE 90 10.799 14.362 20.268 685 HB3 PHE 90 HB3 PHE 90 10.883 15.991 19.582 686 HD1 PHE 90 HD1 PHE 90 13.052 16.423 18.024 687 HD2 PHE 90 HD2 PHE 90 11.141 12.624 18.681 688 HE1 PHE 90 HE1 PHE 90 14.015 15.577 15.907 689 HE2 PHE 90 HE2 PHE 90 12.096 11.780 16.547 690 HZ PHE 90 HZ PHE 90 13.543 13.256 15.160 691 HA PRO 91 HA PRO 91 11.862 18.137 23.927 692 HB2 PRO 91 HB2 PRO 91 11.306 20.673 23.020 693 HB3 PRO 91 HB3 PRO 91 12.946 19.963 22.999 694 HG2 PRO 91 HG2 PRO 91 10.921 20.007 20.727 695 HG3 PRO 91 HG3 PRO 91 12.637 20.557 20.693 696 HD2 PRO 91 HD2 PRO 91 11.941 18.085 19.851 697 HD3 PRO 91 HD3 PRO 91 13.437 18.337 20.799 698 H GLY 92 H GLY 92 9.457 17.176 21.767 699 HA2 GLY 92 HA2 GLY 92 7.284 18.168 23.528 700 HA3 GLY 92 HA3 GLY 92 7.276 18.642 21.827 701 H ASN 93 H ASN 93 8.296 15.461 23.183 702 HA ASN 93 HA ASN 93 5.754 14.232 22.301 703 HB2 ASN 93 HB2 ASN 93 7.295 13.818 20.443 704 HB3 ASN 93 HB3 ASN 93 8.530 13.216 21.560 705 HD21 ASN 93 HD22 ASN 93 8.612 10.999 21.643 706 HD22 ASN 93 HD21 ASN 93 7.290 9.920 21.297 707 H ASP 94 H ASP 94 5.478 12.081 23.408 708 HA ASP 94 HA ASP 94 5.971 12.541 26.189 709 HB2 ASP 94 HB2 ASP 94 3.886 11.588 25.295 710 HB3 ASP 94 HB3 ASP 94 4.755 10.147 24.772 711 H GLU 95 H GLU 95 7.690 10.564 23.833 712 HA GLU 95 HA GLU 95 9.579 9.724 25.923 713 HB2 GLU 95 HB2 GLU 95 9.205 7.467 25.627 714 HB3 GLU 95 HB3 GLU 95 7.594 8.121 25.512 715 HG2 GLU 95 HG2 GLU 95 9.313 7.312 23.146 716 HG3 GLU 95 HG3 GLU 95 8.081 6.315 23.887 717 HA PRO 96 HA PRO 96 12.559 10.366 22.705 718 HB2 PRO 96 HB2 PRO 96 14.543 8.540 23.131 719 HB3 PRO 96 HB3 PRO 96 14.194 9.856 24.291 720 HG2 PRO 96 HG2 PRO 96 13.281 6.977 24.424 721 HG3 PRO 96 HG3 PRO 96 13.979 7.985 25.731 722 HD2 PRO 96 HD2 PRO 96 11.282 7.583 25.372 723 HD3 PRO 96 HD3 PRO 96 11.940 9.093 26.083 724 H ILE 97 H ILE 97 13.298 9.618 20.638 725 HA ILE 97 HA ILE 97 11.707 7.327 19.575 726 HB ILE 97 HB ILE 97 12.956 9.714 18.169 727 HG12 ILE 97 HG12 ILE 97 11.096 10.492 19.460 728 HG13 ILE 97 HG13 ILE 97 10.585 10.416 17.781 729 HG21 ILE 97 HG21 ILE 97 12.893 7.798 16.623 730 HG22 ILE 97 HG22 ILE 97 11.191 7.497 17.027 731 HG23 ILE 97 HG23 ILE 97 11.660 8.977 16.191 732 HD11 ILE 97 HD13 ILE 97 9.311 8.350 18.241 733 HD12 ILE 97 HD11 ILE 97 9.861 8.384 19.943 734 HD13 ILE 97 HD12 ILE 97 8.850 9.666 19.335 735 H LYS 98 H LYS 98 12.656 5.636 18.697 736 HA LYS 98 HA LYS 98 15.638 5.657 18.481 737 HB2 LYS 98 HB2 LYS 98 13.781 3.284 18.891 738 HB3 LYS 98 HB3 LYS 98 15.527 3.215 18.644 739 HG2 LYS 98 HG2 LYS 98 15.689 4.756 20.744 740 HG3 LYS 98 HG3 LYS 98 13.996 4.343 21.018 741 HD2 LYS 98 HD2 LYS 98 15.305 2.870 22.353 742 HD3 LYS 98 HD3 LYS 98 14.689 1.889 21.011 743 HE2 LYS 98 HE2 LYS 98 16.860 2.065 19.844 744 HE3 LYS 98 HE3 LYS 98 17.438 3.222 21.040 745 HZ1 LYS 98 HZ3 LYS 98 18.359 1.153 21.589 746 HZ2 LYS 98 HZ1 LYS 98 17.217 1.408 22.718 747 HZ3 LYS 98 HZ2 LYS 98 16.924 0.348 21.504 748 H LEU 99 H LEU 99 12.672 5.591 16.643 749 HA LEU 99 HA LEU 99 14.194 4.652 14.271 750 HB2 LEU 99 HB2 LEU 99 13.003 2.722 15.353 751 HB3 LEU 99 HB3 LEU 99 11.540 3.690 15.407 752 HG LEU 99 HG LEU 99 11.453 3.656 12.905 753 HD11 LEU 99 HD11 LEU 99 12.701 1.864 11.690 754 HD12 LEU 99 HD12 LEU 99 13.809 3.067 12.334 755 HD13 LEU 99 HD13 LEU 99 13.637 1.510 13.134 756 HD21 LEU 99 HD23 LEU 99 10.443 1.491 12.876 757 HD22 LEU 99 HD21 LEU 99 11.442 0.929 14.247 758 HD23 LEU 99 HD22 LEU 99 10.183 2.155 14.467 759 H LEU 100 H LEU 100 13.748 5.764 12.453 760 HA LEU 100 HA LEU 100 11.341 7.515 12.369 761 HB2 LEU 100 HB2 LEU 100 14.104 8.512 11.580 762 HB3 LEU 100 HB3 LEU 100 12.610 9.393 11.607 763 HG LEU 100 HG LEU 100 12.753 8.534 14.214 764 HD11 LEU 100 HD11 LEU 100 15.606 9.140 13.388 765 HD12 LEU 100 HD12 LEU 100 15.016 8.850 15.041 766 HD13 LEU 100 HD13 LEU 100 15.004 7.534 13.849 767 HD21 LEU 100 HD23 LEU 100 12.260 10.837 13.586 768 HD22 LEU 100 HD21 LEU 100 13.459 10.746 14.886 769 HD23 LEU 100 HD22 LEU 100 13.979 11.118 13.237 770 H ILE 101 H ILE 101 10.283 6.902 10.561 771 HA ILE 101 HA ILE 101 11.848 6.048 8.180 772 HB ILE 101 HB ILE 101 8.939 5.714 9.030 773 HG12 ILE 101 HG12 ILE 101 9.351 3.385 8.710 774 HG13 ILE 101 HG13 ILE 101 10.916 3.687 7.954 775 HG21 ILE 101 HG21 ILE 101 8.960 6.429 6.656 776 HG22 ILE 101 HG22 ILE 101 10.043 5.078 6.281 777 HG23 ILE 101 HG23 ILE 101 8.405 4.787 6.944 778 HD11 ILE 101 HD13 ILE 101 10.376 4.231 10.888 779 HD12 ILE 101 HD11 ILE 101 11.026 2.709 10.242 780 HD13 ILE 101 HD12 ILE 101 11.947 4.201 10.048 781 H GLY 102 H GLY 102 12.401 7.708 6.851 782 HA2 GLY 102 HA2 GLY 102 10.976 10.277 7.041 783 HA3 GLY 102 HA3 GLY 102 12.405 9.950 6.075 784 H LEU 103 H LEU 103 9.800 11.150 5.263 785 HA LEU 103 HA LEU 103 9.488 9.586 2.781 786 HB2 LEU 103 HB2 LEU 103 7.588 9.053 4.506 787 HB3 LEU 103 HB3 LEU 103 7.101 10.714 4.280 788 HG LEU 103 HG LEU 103 6.899 8.366 2.310 789 HD11 LEU 103 HD11 LEU 103 4.534 8.978 2.516 790 HD12 LEU 103 HD12 LEU 103 5.166 8.981 4.164 791 HD13 LEU 103 HD13 LEU 103 4.916 10.503 3.320 792 HD21 LEU 103 HD23 LEU 103 6.657 11.340 1.689 793 HD22 LEU 103 HD21 LEU 103 7.558 10.039 0.821 794 HD23 LEU 103 HD22 LEU 103 5.811 10.117 0.769 795 H SER 104 H SER 104 9.255 11.002 1.057 796 HA SER 104 HA SER 104 8.699 13.861 1.436 797 HB2 SER 104 HB2 SER 104 10.478 14.372 -0.267 798 HB3 SER 104 HB3 SER 104 11.113 13.838 1.302 799 HG SER 104 HG SER 104 11.086 11.650 0.238 800 H ALA 105 H ALA 105 7.463 14.647 -0.381 801 HA ALA 105 HA ALA 105 6.854 12.713 -2.517 802 HB1 ALA 105 HB3 ALA 105 4.424 12.973 -2.078 803 HB2 ALA 105 HB1 ALA 105 5.255 12.112 -0.764 804 HB3 ALA 105 HB2 ALA 105 4.803 13.827 -0.568 805 H ALA 106 H ALA 106 6.384 13.743 -4.401 806 HA ALA 106 HA ALA 106 6.885 16.585 -4.452 807 HB1 ALA 106 HB3 ALA 106 6.103 14.655 -6.689 808 HB2 ALA 106 HB1 ALA 106 6.723 16.305 -6.910 809 HB3 ALA 106 HB2 ALA 106 7.763 15.062 -6.195 810 H ASP 107 H ASP 107 4.019 14.577 -4.369 811 HA ASP 107 HA ASP 107 2.272 16.968 -4.662 812 HB2 ASP 107 HB2 ASP 107 2.395 15.957 -6.907 813 HB3 ASP 107 HB3 ASP 107 1.971 14.382 -6.242 814 H ALA 108 H ALA 108 0.130 16.623 -3.727 815 HA ALA 108 HA ALA 108 0.245 15.324 -1.246 816 HB1 ALA 108 HB3 ALA 108 -2.144 15.908 -1.074 817 HB2 ALA 108 HB1 ALA 108 -1.200 17.264 -1.719 818 HB3 ALA 108 HB2 ALA 108 -2.194 16.266 -2.811 819 H ASP 109 H ASP 109 -1.026 14.085 -4.362 820 HA ASP 109 HA ASP 109 -2.277 11.769 -3.045 821 HB2 ASP 109 HB2 ASP 109 -3.240 12.551 -5.077 822 HB3 ASP 109 HB3 ASP 109 -1.693 12.384 -5.943 823 H SER 110 H SER 110 0.839 12.533 -4.572 824 HA SER 110 HA SER 110 1.922 9.878 -4.444 825 HB2 SER 110 HB2 SER 110 3.473 12.495 -4.193 826 HB3 SER 110 HB3 SER 110 4.064 10.919 -4.712 827 HG SER 110 HG SER 110 3.630 12.213 -6.510 828 H HIS 111 H HIS 111 1.788 12.605 -2.097 829 HA HIS 111 HA HIS 111 3.126 11.342 0.063 830 HB2 HIS 111 HB2 HIS 111 2.718 13.652 0.291 831 HB3 HIS 111 HB3 HIS 111 1.042 13.507 -0.157 832 HD1 HIS 111 HD1 HIS 111 3.245 13.273 2.931 833 HD2 HIS 111 HD2 HIS 111 -0.762 12.917 1.696 834 HE1 HIS 111 HE1 HIS 111 1.843 13.195 5.051 835 H ILE 112 H ILE 112 -0.400 11.327 -0.758 836 HA ILE 112 HA ILE 112 -1.220 9.649 1.360 837 HB ILE 112 HB ILE 112 -2.245 10.079 -1.475 838 HG12 ILE 112 HG12 ILE 112 -2.365 11.977 0.213 839 HG13 ILE 112 HG13 ILE 112 -3.849 11.538 -0.613 840 HG21 ILE 112 HG21 ILE 112 -3.585 8.396 0.651 841 HG22 ILE 112 HG22 ILE 112 -4.405 9.062 -0.786 842 HG23 ILE 112 HG23 ILE 112 -3.084 7.913 -0.984 843 HD11 ILE 112 HD13 ILE 112 -4.141 12.058 1.779 844 HD12 ILE 112 HD11 ILE 112 -4.676 10.418 1.378 845 HD13 ILE 112 HD12 ILE 112 -3.114 10.667 2.208 846 H GLY 113 H GLY 113 -0.255 8.631 -2.005 847 HA2 GLY 113 HA2 GLY 113 -0.586 5.870 -1.558 848 HA3 GLY 113 HA3 GLY 113 0.498 6.600 -2.759 849 H ALA 114 H ALA 114 2.222 7.974 -0.944 850 HA ALA 114 HA ALA 114 4.104 5.896 -0.292 851 HB1 ALA 114 HB3 ALA 114 3.970 8.889 0.276 852 HB2 ALA 114 HB1 ALA 114 5.396 7.876 0.524 853 HB3 ALA 114 HB2 ALA 114 4.762 8.117 -1.104 854 H ILE 115 H ILE 115 2.081 8.126 1.763 855 HA ILE 115 HA ILE 115 2.903 7.221 4.266 856 HB ILE 115 HB ILE 115 0.503 8.419 3.058 857 HG12 ILE 115 HG12 ILE 115 2.449 9.883 3.475 858 HG13 ILE 115 HG13 ILE 115 0.979 10.402 4.279 859 HG21 ILE 115 HG21 ILE 115 0.533 7.512 5.894 860 HG22 ILE 115 HG22 ILE 115 -0.541 8.817 5.271 861 HG23 ILE 115 HG23 ILE 115 -0.646 7.196 4.592 862 HD11 ILE 115 HD13 ILE 115 2.969 10.671 5.710 863 HD12 ILE 115 HD11 ILE 115 1.802 9.550 6.436 864 HD13 ILE 115 HD12 ILE 115 3.258 8.925 5.630 865 H GLN 116 H GLN 116 0.330 6.067 2.024 866 HA GLN 116 HA GLN 116 -0.659 4.020 3.762 867 HB2 GLN 116 HB2 GLN 116 -0.930 4.559 0.777 868 HB3 GLN 116 HB3 GLN 116 -1.779 3.240 1.587 869 HG2 GLN 116 HG2 GLN 116 -2.008 6.134 2.483 870 HG3 GLN 116 HG3 GLN 116 -3.073 5.412 1.279 871 HE21 GLN 116 HE22 GLN 116 -4.459 3.549 1.974 872 HE22 GLN 116 HE21 GLN 116 -4.905 3.408 3.656 873 H ALA 117 H ALA 117 2.334 4.102 2.061 874 HA ALA 117 HA ALA 117 2.445 1.192 1.847 875 HB1 ALA 117 HB3 ALA 117 4.654 1.557 0.855 876 HB2 ALA 117 HB1 ALA 117 3.499 2.620 0.040 877 HB3 ALA 117 HB2 ALA 117 4.602 3.271 1.265 878 H LEU 118 H LEU 118 3.726 4.011 3.617 879 HA LEU 118 HA LEU 118 5.426 2.425 5.272 880 HB2 LEU 118 HB2 LEU 118 4.346 5.266 5.598 881 HB3 LEU 118 HB3 LEU 118 5.625 4.555 6.609 882 HG LEU 118 HG LEU 118 5.705 4.819 3.587 883 HD11 LEU 118 HD11 LEU 118 5.734 6.978 4.604 884 HD12 LEU 118 HD12 LEU 118 6.930 6.506 5.809 885 HD13 LEU 118 HD13 LEU 118 7.398 6.634 4.102 886 HD21 LEU 118 HD23 LEU 118 7.305 3.230 3.805 887 HD22 LEU 118 HD21 LEU 118 8.325 4.493 4.483 888 HD23 LEU 118 HD22 LEU 118 7.444 3.398 5.558 889 H SER 119 H SER 119 2.103 3.542 5.647 890 HA SER 119 HA SER 119 1.745 2.773 8.334 891 HB2 SER 119 HB2 SER 119 -0.271 2.633 6.048 892 HB3 SER 119 HB3 SER 119 -0.644 2.714 7.780 893 HG SER 119 HG SER 119 0.642 4.699 6.180 894 H GLU 120 H GLU 120 2.271 0.684 5.530 895 HA GLU 120 HA GLU 120 1.004 -1.648 6.632 896 HB2 GLU 120 HB2 GLU 120 3.285 -1.480 4.641 897 HB3 GLU 120 HB3 GLU 120 2.346 -2.914 5.000 898 HG2 GLU 120 HG2 GLU 120 1.081 -0.370 3.943 899 HG3 GLU 120 HG3 GLU 120 1.702 -1.626 2.880 900 H LEU 121 H LEU 121 4.043 0.028 7.063 901 HA LEU 121 HA LEU 121 5.252 -2.224 8.579 902 HB2 LEU 121 HB2 LEU 121 6.420 0.420 7.604 903 HB3 LEU 121 HB3 LEU 121 7.295 -0.751 8.568 904 HG LEU 121 HG LEU 121 6.260 -1.091 5.729 905 HD11 LEU 121 HD11 LEU 121 9.060 -1.125 6.955 906 HD12 LEU 121 HD12 LEU 121 8.691 -1.385 5.243 907 HD13 LEU 121 HD13 LEU 121 8.348 0.185 5.990 908 HD21 LEU 121 HD23 LEU 121 7.296 -3.331 5.682 909 HD22 LEU 121 HD21 LEU 121 7.626 -3.236 7.418 910 HD23 LEU 121 HD22 LEU 121 5.950 -3.286 6.819 911 H LEU 122 H LEU 122 4.968 1.364 9.107 912 HA LEU 122 HA LEU 122 5.634 0.955 11.855 913 HB2 LEU 122 HB2 LEU 122 4.581 3.402 10.410 914 HB3 LEU 122 HB3 LEU 122 5.167 3.382 12.076 915 HG LEU 122 HG LEU 122 6.745 2.956 9.526 916 HD11 LEU 122 HD11 LEU 122 6.548 5.235 10.183 917 HD12 LEU 122 HD12 LEU 122 6.864 4.867 11.893 918 HD13 LEU 122 HD13 LEU 122 8.159 4.733 10.732 919 HD21 LEU 122 HD23 LEU 122 7.693 2.269 12.342 920 HD22 LEU 122 HD21 LEU 122 7.598 1.173 10.943 921 HD23 LEU 122 HD22 LEU 122 8.754 2.482 10.947 922 H CYS 123 H CYS 123 2.636 0.239 10.582 923 HA CYS 123 HA CYS 123 1.337 0.789 13.211 924 HB2 CYS 123 HB2 CYS 123 -0.024 0.238 10.551 925 HB3 CYS 123 HB3 CYS 123 -0.806 0.685 12.063 926 HG CYS 123 HG CYS 123 -0.925 2.725 10.439 927 H GLU 124 H GLU 124 3.168 -1.394 12.569 928 HA GLU 124 HA GLU 124 1.443 -3.710 13.097 929 HB2 GLU 124 HB2 GLU 124 1.893 -3.399 10.599 930 HB3 GLU 124 HB3 GLU 124 3.602 -3.655 10.943 931 HG2 GLU 124 HG2 GLU 124 2.635 -5.668 10.147 932 HG3 GLU 124 HG3 GLU 124 3.081 -5.888 11.848 933 H GLU 125 H GLU 125 2.068 -3.961 15.147 934 HA GLU 125 HA GLU 125 4.530 -3.229 16.200 935 HB2 GLU 125 HB2 GLU 125 3.875 -4.421 18.202 936 HB3 GLU 125 HB3 GLU 125 2.510 -3.540 17.520 937 HG2 GLU 125 HG2 GLU 125 1.672 -5.684 16.507 938 HG3 GLU 125 HG3 GLU 125 3.009 -6.542 17.273 939 H GLU 126 H GLU 126 3.721 -6.172 14.504 940 HA GLU 126 HA GLU 126 5.871 -7.799 15.432 941 HB2 GLU 126 HB2 GLU 126 4.469 -7.827 12.721 942 HB3 GLU 126 HB3 GLU 126 5.527 -9.097 13.355 943 HG2 GLU 126 HG2 GLU 126 3.950 -9.336 15.309 944 HG3 GLU 126 HG3 GLU 126 2.856 -8.206 14.498 945 H ILE 127 H ILE 127 5.522 -5.525 12.728 946 HA ILE 127 HA ILE 127 8.207 -5.793 11.709 947 HB ILE 127 HB ILE 127 5.847 -4.044 11.264 948 HG12 ILE 127 HG12 ILE 127 6.126 -4.680 8.951 949 HG13 ILE 127 HG13 ILE 127 7.634 -5.532 9.326 950 HG21 ILE 127 HG21 ILE 127 8.644 -3.279 10.442 951 HG22 ILE 127 HG22 ILE 127 7.199 -2.713 9.595 952 HG23 ILE 127 HG23 ILE 127 7.417 -2.287 11.282 953 HD11 ILE 127 HD13 ILE 127 6.409 -7.236 10.555 954 HD12 ILE 127 HD11 ILE 127 4.907 -6.283 10.431 955 HD13 ILE 127 HD12 ILE 127 5.628 -7.004 8.982 956 H LEU 128 H LEU 128 6.516 -3.532 13.937 957 HA LEU 128 HA LEU 128 8.582 -1.674 14.145 958 HB2 LEU 128 HB2 LEU 128 6.619 -2.523 16.320 959 HB3 LEU 128 HB3 LEU 128 7.692 -1.143 16.448 960 HG LEU 128 HG LEU 128 5.440 -1.437 14.426 961 HD11 LEU 128 HD11 LEU 128 4.466 0.451 15.661 962 HD12 LEU 128 HD12 LEU 128 4.710 -0.938 16.727 963 HD13 LEU 128 HD13 LEU 128 5.835 0.430 16.795 964 HD21 LEU 128 HD23 LEU 128 7.620 0.653 14.714 965 HD22 LEU 128 HD21 LEU 128 7.098 -0.221 13.262 966 HD23 LEU 128 HD22 LEU 128 6.047 1.013 13.976 967 H GLU 129 H GLU 129 8.213 -4.646 16.070 968 HA GLU 129 HA GLU 129 10.462 -4.061 17.729 969 HB2 GLU 129 HB2 GLU 129 8.730 -6.470 17.245 970 HB3 GLU 129 HB3 GLU 129 10.336 -6.738 17.941 971 HG2 GLU 129 HG2 GLU 129 9.910 -5.119 19.720 972 HG3 GLU 129 HG3 GLU 129 8.292 -4.796 19.077 973 H GLN 130 H GLN 130 10.101 -5.695 14.548 974 HA GLN 130 HA GLN 130 12.719 -6.873 14.645 975 HB2 GLN 130 HB2 GLN 130 10.664 -6.386 12.462 976 HB3 GLN 130 HB3 GLN 130 12.233 -7.164 12.152 977 HG2 GLN 130 HG2 GLN 130 11.762 -8.962 13.667 978 HG3 GLN 130 HG3 GLN 130 10.253 -8.214 14.190 979 HE21 GLN 130 HE22 GLN 130 8.416 -8.323 12.850 980 HE22 GLN 130 HE21 GLN 130 8.338 -9.349 11.421 981 H LEU 131 H LEU 131 11.348 -3.770 13.469 982 HA LEU 131 HA LEU 131 13.842 -2.818 12.315 983 HB2 LEU 131 HB2 LEU 131 11.494 -1.290 13.495 984 HB3 LEU 131 HB3 LEU 131 12.822 -0.558 12.612 985 HG LEU 131 HG LEU 131 11.022 -2.708 11.369 986 HD11 LEU 131 HD11 LEU 131 10.547 0.263 11.164 987 HD12 LEU 131 HD12 LEU 131 9.537 -1.044 10.547 988 HD13 LEU 131 HD13 LEU 131 9.693 -0.815 12.310 989 HD21 LEU 131 HD23 LEU 131 11.662 -1.613 9.242 990 HD22 LEU 131 HD21 LEU 131 12.657 -0.453 10.147 991 HD23 LEU 131 HD22 LEU 131 13.090 -2.171 10.125 992 H LEU 132 H LEU 132 12.097 -2.197 15.363 993 HA LEU 132 HA LEU 132 14.064 -0.582 16.564 994 HB2 LEU 132 HB2 LEU 132 11.920 -2.333 17.790 995 HB3 LEU 132 HB3 LEU 132 12.941 -1.312 18.780 996 HG LEU 132 HG LEU 132 11.288 -0.160 16.501 997 HD11 LEU 132 HD11 LEU 132 9.637 0.499 18.200 998 HD12 LEU 132 HD12 LEU 132 9.793 -1.264 18.139 999 HD13 LEU 132 HD13 LEU 132 10.560 -0.356 19.458 1000 HD21 LEU 132 HD23 LEU 132 13.148 1.272 17.280 1001 HD22 LEU 132 HD21 LEU 132 11.581 1.956 17.725 1002 HD23 LEU 132 HD22 LEU 132 12.565 1.126 18.950 1003 H THR 133 H THR 133 14.397 -3.960 16.031 1004 HA THR 133 HA THR 133 16.640 -4.056 17.968 1005 HB THR 133 HB THR 133 16.235 -6.477 18.123 1006 HG1 THR 133 HG1 THR 133 13.782 -5.961 16.812 1007 HG21 THR 133 HG23 THR 133 13.716 -4.898 18.850 1008 HG22 THR 133 HG21 THR 133 14.257 -6.435 19.541 1009 HG23 THR 133 HG22 THR 133 15.209 -4.967 19.812 1010 H ALA 134 H ALA 134 16.199 -3.437 14.838 1011 HA ALA 134 HA ALA 134 17.753 -5.316 13.406 1012 HB1 ALA 134 HB3 ALA 134 16.327 -3.735 12.273 1013 HB2 ALA 134 HB1 ALA 134 17.230 -2.365 12.958 1014 HB3 ALA 134 HB2 ALA 134 18.015 -3.423 11.792 1015 H SER 135 H SER 135 19.828 -5.859 13.849 1016 HA SER 135 HA SER 135 21.620 -4.156 15.347 1017 HB2 SER 135 HB2 SER 135 22.183 -6.691 13.751 1018 HB3 SER 135 HB3 SER 135 23.180 -6.014 15.049 1019 HG SER 135 HG SER 135 21.474 -6.434 16.501 1020 H SER 136 H SER 136 20.845 -4.448 11.949 1021 HA SER 136 HA SER 136 23.202 -2.840 11.159 1022 HB2 SER 136 HB2 SER 136 22.420 -5.482 9.846 1023 HB3 SER 136 HB3 SER 136 23.785 -4.446 9.407 1024 HG SER 136 HG SER 136 24.725 -4.927 11.425 1025 H GLU 137 H GLU 137 22.965 -1.912 9.051 1026 HA GLU 137 HA GLU 137 20.405 -0.846 8.490 1027 HB2 GLU 137 HB2 GLU 137 22.982 -1.011 6.865 1028 HB3 GLU 137 HB3 GLU 137 21.584 -0.016 6.382 1029 HG2 GLU 137 HG2 GLU 137 21.668 1.314 8.259 1030 HG3 GLU 137 HG3 GLU 137 22.851 0.304 9.099 1031 H LYS 138 H LYS 138 22.151 -3.605 7.007 1032 HA LYS 138 HA LYS 138 20.263 -4.144 4.969 1033 HB2 LYS 138 HB2 LYS 138 21.988 -6.114 6.539 1034 HB3 LYS 138 HB3 LYS 138 21.152 -6.477 5.034 1035 HG2 LYS 138 HG2 LYS 138 23.418 -4.469 5.376 1036 HG3 LYS 138 HG3 LYS 138 23.525 -6.075 4.651 1037 HD2 LYS 138 HD2 LYS 138 21.851 -5.332 2.906 1038 HD3 LYS 138 HD3 LYS 138 21.977 -3.687 3.538 1039 HE2 LYS 138 HE2 LYS 138 24.292 -5.351 2.442 1040 HE3 LYS 138 HE3 LYS 138 23.401 -4.133 1.530 1041 HZ1 LYS 138 HZ3 LYS 138 25.037 -3.587 3.938 1042 HZ2 LYS 138 HZ1 LYS 138 25.431 -3.219 2.404 1043 HZ3 LYS 138 HZ2 LYS 138 24.177 -2.461 3.111 1044 H GLN 139 H GLN 139 20.189 -5.071 8.429 1045 HA GLN 139 HA GLN 139 17.937 -6.736 8.176 1046 HB2 GLN 139 HB2 GLN 139 19.806 -6.219 10.114 1047 HB3 GLN 139 HB3 GLN 139 18.445 -5.284 10.750 1048 HG2 GLN 139 HG2 GLN 139 17.008 -7.307 10.467 1049 HG3 GLN 139 HG3 GLN 139 18.448 -8.177 9.886 1050 HE21 GLN 139 HE22 GLN 139 16.988 -9.187 12.086 1051 HE22 GLN 139 HE21 GLN 139 17.939 -8.994 13.537 1052 H LEU 140 H LEU 140 18.222 -3.147 8.564 1053 HA LEU 140 HA LEU 140 15.386 -2.814 9.144 1054 HB2 LEU 140 HB2 LEU 140 17.493 -0.926 8.055 1055 HB3 LEU 140 HB3 LEU 140 15.807 -0.498 8.294 1056 HG LEU 140 HG LEU 140 17.456 -1.388 10.607 1057 HD11 LEU 140 HD11 LEU 140 17.846 0.961 11.101 1058 HD12 LEU 140 HD12 LEU 140 18.479 0.617 9.494 1059 HD13 LEU 140 HD13 LEU 140 16.934 1.467 9.675 1060 HD21 LEU 140 HD23 LEU 140 14.879 0.174 10.478 1061 HD22 LEU 140 HD21 LEU 140 15.098 -1.518 11.017 1062 HD23 LEU 140 HD22 LEU 140 15.810 -0.206 11.943 1063 H ALA 141 H ALA 141 17.493 -2.674 6.209 1064 HA ALA 141 HA ALA 141 15.444 -2.235 4.335 1065 HB1 ALA 141 HB3 ALA 141 17.958 -2.029 4.026 1066 HB2 ALA 141 HB1 ALA 141 17.977 -3.786 3.766 1067 HB3 ALA 141 HB2 ALA 141 17.028 -2.731 2.684 1068 H ASP 142 H ASP 142 16.497 -5.363 5.736 1069 HA ASP 142 HA ASP 142 15.163 -7.051 3.911 1070 HB2 ASP 142 HB2 ASP 142 16.649 -7.910 5.656 1071 HB3 ASP 142 HB3 ASP 142 15.532 -7.370 6.913 1072 H ILE 143 H ILE 143 13.911 -5.204 6.717 1073 HA ILE 143 HA ILE 143 11.277 -6.288 6.596 1074 HB ILE 143 HB ILE 143 12.532 -3.886 7.968 1075 HG12 ILE 143 HG12 ILE 143 11.714 -6.583 9.161 1076 HG13 ILE 143 HG13 ILE 143 13.340 -6.283 8.569 1077 HG21 ILE 143 HG21 ILE 143 10.546 -3.941 9.440 1078 HG22 ILE 143 HG22 ILE 143 10.177 -3.489 7.771 1079 HG23 ILE 143 HG23 ILE 143 9.802 -5.134 8.349 1080 HD11 ILE 143 HD13 ILE 143 13.472 -5.935 10.861 1081 HD12 ILE 143 HD11 ILE 143 13.526 -4.334 10.144 1082 HD13 ILE 143 HD12 ILE 143 12.013 -4.919 10.905 1083 H ILE 144 H ILE 144 12.900 -3.435 5.194 1084 HA ILE 144 HA ILE 144 10.617 -2.270 3.911 1085 HB ILE 144 HB ILE 144 13.486 -2.482 2.866 1086 HG12 ILE 144 HG12 ILE 144 13.498 -1.245 4.895 1087 HG13 ILE 144 HG13 ILE 144 13.710 -0.137 3.540 1088 HG21 ILE 144 HG21 ILE 144 12.950 -0.574 1.389 1089 HG22 ILE 144 HG22 ILE 144 12.141 -2.075 0.950 1090 HG23 ILE 144 HG23 ILE 144 11.231 -0.797 1.769 1091 HD11 ILE 144 HD13 ILE 144 11.148 0.235 3.714 1092 HD12 ILE 144 HD11 ILE 144 11.297 -0.537 5.307 1093 HD13 ILE 144 HD12 ILE 144 12.193 0.963 4.954 1094 H SER 145 H SER 145 12.875 -4.802 2.830 1095 HA SER 145 HA SER 145 11.676 -5.083 0.335 1096 HB2 SER 145 HB2 SER 145 13.291 -7.183 1.864 1097 HB3 SER 145 HB3 SER 145 13.054 -7.118 0.111 1098 HG SER 145 HG SER 145 14.449 -5.253 1.765 1099 H ARG 146 H ARG 146 10.873 -6.613 3.421 1100 HA ARG 146 HA ARG 146 9.067 -8.625 2.584 1101 HB2 ARG 146 HB2 ARG 146 9.673 -8.966 4.700 1102 HB3 ARG 146 HB3 ARG 146 9.999 -7.272 5.027 1103 HG2 ARG 146 HG2 ARG 146 7.647 -6.797 5.292 1104 HG3 ARG 146 HG3 ARG 146 7.262 -8.512 4.972 1105 HD2 ARG 146 HD2 ARG 146 8.937 -7.418 7.290 1106 HD3 ARG 146 HD3 ARG 146 7.252 -7.900 7.424 1107 HE ARG 146 HE ARG 146 9.613 -9.615 7.292 1108 HH11 ARG 146 HH11 ARG 146 6.072 -9.560 6.968 1109 HH12 ARG 146 HH12 ARG 146 5.882 -11.248 7.261 1110 HH21 ARG 146 HH21 ARG 146 9.355 -11.862 7.669 1111 HH22 ARG 146 HH22 ARG 146 7.791 -12.580 7.668 1112 H GLY 147 H GLY 147 8.699 -5.120 2.732 1113 HA2 GLY 147 HA2 GLY 147 5.834 -5.132 3.104 1114 HA3 GLY 147 HA3 GLY 147 6.877 -3.759 2.711 Start of MODEL 16 1 H MET 1 H1 MET 1 2.391 -1.167 -0.614 2 HA MET 1 HA MET 1 2.784 -2.044 -3.388 3 HB2 MET 1 HB2 MET 1 1.981 0.471 -2.839 4 HB3 MET 1 HB3 MET 1 3.705 0.656 -2.426 5 HG2 MET 1 HG2 MET 1 4.364 -0.006 -4.662 6 HG3 MET 1 HG3 MET 1 2.706 -0.468 -5.073 7 HE1 MET 1 HE3 MET 1 3.029 0.877 -7.347 8 HE2 MET 1 HE1 MET 1 3.492 2.590 -7.417 9 HE3 MET 1 HE2 MET 1 4.660 1.379 -6.842 10 H ARG 2 H ARG 2 5.064 -2.089 -4.078 11 HA ARG 2 HA ARG 2 6.858 -2.962 -2.145 12 HB2 ARG 2 HB2 ARG 2 6.895 -2.260 -5.030 13 HB3 ARG 2 HB3 ARG 2 8.431 -1.956 -4.234 14 HG2 ARG 2 HG2 ARG 2 8.271 -4.206 -5.211 15 HG3 ARG 2 HG3 ARG 2 8.630 -4.192 -3.477 16 HD2 ARG 2 HD2 ARG 2 6.277 -4.811 -2.983 17 HD3 ARG 2 HD3 ARG 2 5.933 -4.821 -4.716 18 HE ARG 2 HE ARG 2 6.932 -6.867 -4.907 19 HH11 ARG 2 HH21 ARG 2 7.802 -5.583 -1.664 20 HH12 ARG 2 HH22 ARG 2 8.807 -6.933 -1.278 21 HH21 ARG 2 HH11 ARG 2 8.140 -8.716 -4.272 22 HH22 ARG 2 HH12 ARG 2 8.904 -8.780 -2.730 23 H LEU 3 H LEU 3 7.552 -1.973 -0.477 24 HA LEU 3 HA LEU 3 7.971 0.822 -0.110 25 HB2 LEU 3 HB2 LEU 3 9.270 -1.645 1.096 26 HB3 LEU 3 HB3 LEU 3 9.843 -0.045 1.498 27 HG LEU 3 HG LEU 3 8.220 -1.078 3.152 28 HD11 LEU 3 HD11 LEU 3 7.328 1.572 1.949 29 HD12 LEU 3 HD12 LEU 3 7.028 0.974 3.594 30 HD13 LEU 3 HD13 LEU 3 8.681 1.332 3.079 31 HD21 LEU 3 HD23 LEU 3 6.041 -0.445 1.148 32 HD22 LEU 3 HD21 LEU 3 6.642 -2.071 1.487 33 HD23 LEU 3 HD22 LEU 3 5.872 -1.129 2.774 34 H SER 4 H SER 4 9.989 -1.686 -1.643 35 HA SER 4 HA SER 4 12.395 -0.243 -1.875 36 HB2 SER 4 HB2 SER 4 12.687 -1.968 -3.788 37 HB3 SER 4 HB3 SER 4 12.496 -2.548 -2.121 38 HG SER 4 HG SER 4 11.179 -3.671 -3.630 39 H ASP 5 H ASP 5 9.352 0.419 -3.470 40 HA ASP 5 HA ASP 5 10.694 1.823 -5.643 41 HB2 ASP 5 HB2 ASP 5 8.529 0.680 -6.050 42 HB3 ASP 5 HB3 ASP 5 7.759 1.746 -4.868 43 H TYR 6 H TYR 6 9.324 2.572 -2.483 44 HA TYR 6 HA TYR 6 9.430 5.483 -3.009 45 HB2 TYR 6 HB2 TYR 6 8.581 3.872 -0.566 46 HB3 TYR 6 HB3 TYR 6 8.662 5.632 -0.609 47 HD1 TYR 6 HD1 TYR 6 7.127 6.990 -1.872 48 HD2 TYR 6 HD2 TYR 6 6.750 2.682 -1.823 49 HE1 TYR 6 HE1 TYR 6 4.939 7.162 -3.041 50 HE2 TYR 6 HE2 TYR 6 4.538 2.864 -2.890 51 HH TYR 6 HH TYR 6 2.945 4.290 -3.828 52 H PHE 7 H PHE 7 11.162 2.978 -1.172 53 HA PHE 7 HA PHE 7 12.967 5.031 -0.022 54 HB2 PHE 7 HB2 PHE 7 12.798 3.730 1.754 55 HB3 PHE 7 HB3 PHE 7 12.004 2.451 0.869 56 HD1 PHE 7 HD2 PHE 7 13.235 0.664 -0.177 57 HD2 PHE 7 HD1 PHE 7 15.113 3.507 2.430 58 HE1 PHE 7 HE2 PHE 7 15.379 -0.648 -0.298 59 HE2 PHE 7 HE1 PHE 7 17.226 2.181 2.365 60 HZ PHE 7 HZ PHE 7 17.372 0.137 0.963 61 HA PRO 8 HA PRO 8 15.218 4.178 -3.792 62 HB2 PRO 8 HB2 PRO 8 16.987 6.232 -3.811 63 HB3 PRO 8 HB3 PRO 8 15.223 6.466 -3.917 64 HG2 PRO 8 HG2 PRO 8 16.940 6.698 -1.422 65 HG3 PRO 8 HG3 PRO 8 15.731 7.858 -2.047 66 HD2 PRO 8 HD2 PRO 8 15.141 5.969 -0.152 67 HD3 PRO 8 HD3 PRO 8 13.949 6.543 -1.348 68 H GLU 9 H GLU 9 18.073 5.414 -2.159 69 HA GLU 9 HA GLU 9 19.124 2.899 -1.294 70 HB2 GLU 9 HB2 GLU 9 19.672 3.133 -3.870 71 HB3 GLU 9 HB3 GLU 9 20.747 4.450 -3.338 72 HG2 GLU 9 HG2 GLU 9 22.066 2.936 -2.001 73 HG3 GLU 9 HG3 GLU 9 20.919 1.619 -2.254 74 H SER 10 H SER 10 21.260 3.387 -0.260 75 HA SER 10 HA SER 10 22.278 4.324 1.390 76 HB2 SER 10 HB2 SER 10 21.869 7.108 0.272 77 HB3 SER 10 HB3 SER 10 23.258 6.485 1.165 78 HG SER 10 HG SER 10 23.768 5.211 -0.675 79 H SER 11 H SER 11 19.216 4.367 1.192 80 HA SER 11 HA SER 11 18.394 6.428 3.074 81 HB2 SER 11 HB2 SER 11 16.130 5.541 2.071 82 HB3 SER 11 HB3 SER 11 17.219 6.537 1.114 83 HG SER 11 HG SER 11 16.675 3.800 0.850 84 H ILE 12 H ILE 12 19.807 3.824 3.893 85 HA ILE 12 HA ILE 12 18.009 3.364 6.170 86 HB ILE 12 HB ILE 12 19.032 1.289 4.301 87 HG12 ILE 12 HG12 ILE 12 16.790 1.194 6.371 88 HG13 ILE 12 HG13 ILE 12 16.594 2.078 4.835 89 HG21 ILE 12 HG21 ILE 12 20.376 0.794 6.275 90 HG22 ILE 12 HG22 ILE 12 18.933 0.833 7.322 91 HG23 ILE 12 HG23 ILE 12 19.123 -0.430 6.095 92 HD11 ILE 12 HD13 ILE 12 17.150 0.080 3.551 93 HD12 ILE 12 HD11 ILE 12 17.244 -0.838 5.053 94 HD13 ILE 12 HD12 ILE 12 15.694 -0.116 4.556 95 H SER 13 H SER 13 19.265 3.501 8.069 96 HA SER 13 HA SER 13 22.062 2.830 7.977 97 HB2 SER 13 HB2 SER 13 21.196 5.692 8.684 98 HB3 SER 13 HB3 SER 13 22.796 5.019 9.032 99 HG SER 13 HG SER 13 22.010 4.688 6.431 100 H VAL 14 H VAL 14 22.866 2.417 10.020 101 HA VAL 14 HA VAL 14 20.980 2.629 12.323 102 HB VAL 14 HB VAL 14 23.106 0.525 11.728 103 HG11 VAL 14 HG11 VAL 14 21.363 0.883 14.217 104 HG12 VAL 14 HG12 VAL 14 22.387 -0.529 13.879 105 HG13 VAL 14 HG13 VAL 14 23.130 1.050 14.137 106 HG21 VAL 14 HG23 VAL 14 20.094 0.214 12.126 107 HG22 VAL 14 HG21 VAL 14 20.926 0.112 10.567 108 HG23 VAL 14 HG22 VAL 14 21.250 -1.096 11.808 109 H ILE 15 H ILE 15 21.799 3.825 13.942 110 HA ILE 15 HA ILE 15 24.532 4.998 13.669 111 HB ILE 15 HB ILE 15 21.752 6.207 13.965 112 HG12 ILE 15 HG12 ILE 15 23.968 6.505 11.914 113 HG13 ILE 15 HG13 ILE 15 22.323 5.894 11.683 114 HG21 ILE 15 HG21 ILE 15 23.142 7.278 15.626 115 HG22 ILE 15 HG22 ILE 15 24.335 7.738 14.380 116 HG23 ILE 15 HG23 ILE 15 22.666 8.385 14.399 117 HD11 ILE 15 HD13 ILE 15 21.473 8.212 12.285 118 HD12 ILE 15 HD11 ILE 15 23.159 8.763 12.268 119 HD13 ILE 15 HD12 ILE 15 22.424 8.130 10.776 120 H HIS 16 H HIS 16 25.512 5.513 15.710 121 HA HIS 16 HA HIS 16 24.613 3.889 17.899 122 HB2 HIS 16 HB2 HIS 16 26.995 4.556 17.474 123 HB3 HIS 16 HB3 HIS 16 26.593 6.201 17.985 124 HD1 HIS 16 HD1 HIS 16 26.112 2.634 19.515 125 HD2 HIS 16 HD2 HIS 16 27.117 6.607 20.523 126 HE1 HIS 16 HE1 HIS 16 26.635 2.640 22.017 127 H SER 17 H SER 17 24.251 7.424 17.153 128 HA SER 17 HA SER 17 22.020 7.727 18.918 129 HB2 SER 17 HB2 SER 17 24.506 9.273 19.773 130 HB3 SER 17 HB3 SER 17 22.943 9.151 20.600 131 HG SER 17 HG SER 17 23.793 6.714 20.411 132 H ALA 18 H ALA 18 21.087 9.919 18.495 133 HA ALA 18 HA ALA 18 22.203 11.140 16.036 134 HB1 ALA 18 HB3 ALA 18 19.717 10.927 16.261 135 HB2 ALA 18 HB1 ALA 18 19.777 12.048 17.638 136 HB3 ALA 18 HB2 ALA 18 20.285 12.588 16.040 137 H LYS 19 H LYS 19 23.071 13.243 16.046 138 HA LYS 19 HA LYS 19 24.674 13.956 18.262 139 HB2 LYS 19 HB2 LYS 19 24.635 14.582 15.641 140 HB3 LYS 19 HB3 LYS 19 23.809 16.005 16.231 141 HG2 LYS 19 HG2 LYS 19 26.022 16.671 16.097 142 HG3 LYS 19 HG3 LYS 19 25.783 16.376 17.818 143 HD2 LYS 19 HD2 LYS 19 27.960 15.541 17.020 144 HD3 LYS 19 HD3 LYS 19 26.958 14.223 17.620 145 HE2 LYS 19 HE2 LYS 19 28.135 13.596 15.557 146 HE3 LYS 19 HE3 LYS 19 26.377 13.543 15.360 147 HZ1 LYS 19 HZ3 LYS 19 27.989 15.840 14.442 148 HZ2 LYS 19 HZ1 LYS 19 27.630 14.567 13.493 149 HZ3 LYS 19 HZ2 LYS 19 26.415 15.488 14.056 150 H ASP 20 H ASP 20 21.461 15.018 17.256 151 HA ASP 20 HA ASP 20 20.657 15.838 19.849 152 HB2 ASP 20 HB2 ASP 20 21.892 17.969 18.939 153 HB3 ASP 20 HB3 ASP 20 20.639 17.960 17.672 154 H TRP 21 H TRP 21 18.282 16.954 19.356 155 HA TRP 21 HA TRP 21 16.860 15.065 17.765 156 HB2 TRP 21 HB2 TRP 21 14.933 16.229 18.462 157 HB3 TRP 21 HB3 TRP 21 16.043 16.199 19.817 158 HD1 TRP 21 HD1 TRP 21 16.882 18.467 20.759 159 HE1 TRP 21 HE1 TRP 21 16.403 20.933 20.283 160 HE3 TRP 21 HE3 TRP 21 14.225 17.900 16.446 161 HZ2 TRP 21 HZ2 TRP 21 15.238 22.488 18.101 162 HZ3 TRP 21 HZ3 TRP 21 13.576 19.864 15.121 163 HH2 TRP 21 HH2 TRP 21 14.124 22.153 15.888 164 H GLN 22 H GLN 22 18.021 18.371 17.183 165 HA GLN 22 HA GLN 22 16.929 18.972 14.611 166 HB2 GLN 22 HB2 GLN 22 19.697 19.503 15.782 167 HB3 GLN 22 HB3 GLN 22 19.030 20.256 14.326 168 HG2 GLN 22 HG2 GLN 22 17.240 21.304 15.627 169 HG3 GLN 22 HG3 GLN 22 17.761 20.470 17.093 170 HE21 GLN 22 HE21 GLN 22 19.683 21.126 18.196 171 HE22 GLN 22 HE22 GLN 22 20.444 22.672 17.844 172 H GLU 23 H GLU 23 19.916 17.118 15.547 173 HA GLU 23 HA GLU 23 20.575 16.387 12.875 174 HB2 GLU 23 HB2 GLU 23 22.004 16.343 15.078 175 HB3 GLU 23 HB3 GLU 23 21.274 14.744 15.306 176 HG2 GLU 23 HG2 GLU 23 23.142 14.102 14.148 177 HG3 GLU 23 HG3 GLU 23 22.107 14.376 12.778 178 H ALA 24 H ALA 24 18.522 14.888 15.350 179 HA ALA 24 HA ALA 24 18.315 12.343 14.100 180 HB1 ALA 24 HB3 ALA 24 17.772 12.983 16.483 181 HB2 ALA 24 HB1 ALA 24 16.254 13.689 15.894 182 HB3 ALA 24 HB2 ALA 24 16.555 11.951 15.687 183 H ILE 25 H ILE 25 16.436 15.382 13.665 184 HA ILE 25 HA ILE 25 14.666 14.295 11.640 185 HB ILE 25 HB ILE 25 15.669 17.155 11.881 186 HG12 ILE 25 HG12 ILE 25 14.141 15.824 13.860 187 HG13 ILE 25 HG13 ILE 25 14.572 17.520 13.738 188 HG21 ILE 25 HG21 ILE 25 13.600 17.709 10.626 189 HG22 ILE 25 HG22 ILE 25 14.646 16.653 9.723 190 HG23 ILE 25 HG23 ILE 25 13.214 15.978 10.515 191 HD11 ILE 25 HD13 ILE 25 12.074 16.215 12.626 192 HD12 ILE 25 HD11 ILE 25 12.185 17.215 14.088 193 HD13 ILE 25 HD12 ILE 25 12.463 17.957 12.499 194 H ASP 26 H ASP 26 17.839 15.973 11.624 195 HA ASP 26 HA ASP 26 18.106 16.270 8.862 196 HB2 ASP 26 HB2 ASP 26 19.557 17.125 10.891 197 HB3 ASP 26 HB3 ASP 26 20.532 15.690 10.574 198 H PHE 27 H PHE 27 19.206 13.536 10.914 199 HA PHE 27 HA PHE 27 20.114 11.918 8.746 200 HB2 PHE 27 HB2 PHE 27 19.409 11.394 11.647 201 HB3 PHE 27 HB3 PHE 27 19.752 10.069 10.550 202 HD1 PHE 27 HD2 PHE 27 21.918 10.534 8.955 203 HD2 PHE 27 HD1 PHE 27 21.364 12.023 12.989 204 HE1 PHE 27 HE2 PHE 27 24.369 10.680 9.250 205 HE2 PHE 27 HE1 PHE 27 23.813 12.083 13.275 206 HZ PHE 27 HZ PHE 27 25.323 11.446 11.415 207 H SER 28 H SER 28 16.824 12.409 10.145 208 HA SER 28 HA SER 28 15.656 10.113 8.867 209 HB2 SER 28 HB2 SER 28 14.292 12.777 9.547 210 HB3 SER 28 HB3 SER 28 13.500 11.269 9.170 211 HG SER 28 HG SER 28 15.264 11.730 11.375 212 H MET 29 H MET 29 16.733 13.238 7.644 213 HA MET 29 HA MET 29 15.256 12.740 5.095 214 HB2 MET 29 HB2 MET 29 16.295 15.333 6.211 215 HB3 MET 29 HB3 MET 29 15.185 15.078 4.846 216 HG2 MET 29 HG2 MET 29 14.295 14.356 7.619 217 HG3 MET 29 HG3 MET 29 14.338 16.024 7.081 218 HE1 MET 29 HE3 MET 29 13.229 12.578 5.631 219 HE2 MET 29 HE1 MET 29 12.472 12.869 7.224 220 HE3 MET 29 HE2 MET 29 11.457 12.806 5.757 221 H VAL 30 H VAL 30 18.608 13.202 6.259 222 HA VAL 30 HA VAL 30 19.584 14.475 4.008 223 HB VAL 30 HB VAL 30 20.838 14.180 6.096 224 HG11 VAL 30 HG11 VAL 30 20.397 11.733 6.474 225 HG12 VAL 30 HG12 VAL 30 21.500 11.360 5.134 226 HG13 VAL 30 HG13 VAL 30 22.110 12.169 6.592 227 HG21 VAL 30 HG23 VAL 30 22.376 13.204 3.648 228 HG22 VAL 30 HG21 VAL 30 21.960 14.886 3.997 229 HG23 VAL 30 HG22 VAL 30 23.052 14.006 5.084 230 H SER 31 H SER 31 19.023 10.917 4.305 231 HA SER 31 HA SER 31 20.402 10.246 1.943 232 HB2 SER 31 HB2 SER 31 17.923 8.976 3.147 233 HB3 SER 31 HB3 SER 31 19.067 8.202 2.029 234 HG SER 31 HG SER 31 20.297 7.798 3.656 235 H LEU 32 H LEU 32 17.218 11.698 2.426 236 HA LEU 32 HA LEU 32 16.347 11.379 -0.356 237 HB2 LEU 32 HB2 LEU 32 15.304 13.033 1.998 238 HB3 LEU 32 HB3 LEU 32 14.537 13.015 0.442 239 HG LEU 32 HG LEU 32 14.971 10.511 2.117 240 HD11 LEU 32 HD11 LEU 32 13.512 12.069 3.314 241 HD12 LEU 32 HD12 LEU 32 12.474 12.217 1.883 242 HD13 LEU 32 HD13 LEU 32 12.606 10.663 2.730 243 HD21 LEU 32 HD23 LEU 32 13.170 11.027 -0.292 244 HD22 LEU 32 HD21 LEU 32 14.658 10.048 -0.301 245 HD23 LEU 32 HD22 LEU 32 13.279 9.529 0.645 246 H LEU 33 H LEU 33 17.763 13.911 1.768 247 HA LEU 33 HA LEU 33 17.794 16.014 -0.043 248 HB2 LEU 33 HB2 LEU 33 18.401 16.036 2.420 249 HB3 LEU 33 HB3 LEU 33 19.967 15.375 1.974 250 HG LEU 33 HG LEU 33 20.404 17.403 0.583 251 HD11 LEU 33 HD11 LEU 33 19.025 19.407 0.914 252 HD12 LEU 33 HD12 LEU 33 18.103 18.148 0.129 253 HD13 LEU 33 HD13 LEU 33 17.851 18.467 1.863 254 HD21 LEU 33 HD23 LEU 33 20.992 18.800 2.436 255 HD22 LEU 33 HD21 LEU 33 19.819 17.983 3.495 256 HD23 LEU 33 HD22 LEU 33 21.243 17.119 2.886 257 H ASP 34 H ASP 34 20.148 13.384 0.415 258 HA ASP 34 HA ASP 34 22.206 14.360 -1.210 259 HB2 ASP 34 HB2 ASP 34 22.504 12.615 0.489 260 HB3 ASP 34 HB3 ASP 34 21.447 11.519 -0.405 261 H LYS 35 H LYS 35 19.354 12.497 -2.159 262 HA LYS 35 HA LYS 35 20.391 12.472 -4.979 263 HB2 LYS 35 HB2 LYS 35 17.751 11.311 -4.350 264 HB3 LYS 35 HB3 LYS 35 18.919 10.819 -5.547 265 HG2 LYS 35 HG2 LYS 35 18.960 10.217 -2.569 266 HG3 LYS 35 HG3 LYS 35 18.568 9.091 -3.862 267 HD2 LYS 35 HD2 LYS 35 20.855 9.139 -4.709 268 HD3 LYS 35 HD3 LYS 35 21.298 10.373 -3.506 269 HE2 LYS 35 HE2 LYS 35 20.455 8.774 -1.715 270 HE3 LYS 35 HE3 LYS 35 20.348 7.522 -2.953 271 HZ1 LYS 35 HZ3 LYS 35 22.812 8.984 -2.167 272 HZ2 LYS 35 HZ1 LYS 35 22.486 7.395 -1.826 273 HZ3 LYS 35 HZ2 LYS 35 22.748 7.863 -3.369 274 H ASN 36 H ASN 36 19.263 14.786 -3.245 275 HA ASN 36 HA ASN 36 17.735 16.295 -3.143 276 HB2 ASN 36 HB2 ASN 36 17.836 17.966 -4.552 277 HB3 ASN 36 HB3 ASN 36 19.294 17.075 -4.954 278 HD21 ASN 36 HD22 ASN 36 18.113 15.087 -6.648 279 HD22 ASN 36 HD21 ASN 36 17.670 15.923 -8.139 280 H TYR 37 H TYR 37 16.383 14.060 -2.840 281 HA TYR 37 HA TYR 37 13.837 14.135 -4.287 282 HB2 TYR 37 HB2 TYR 37 14.801 12.944 -1.664 283 HB3 TYR 37 HB3 TYR 37 13.097 13.015 -2.019 284 HD1 TYR 37 HD2 TYR 37 16.277 11.267 -2.821 285 HD2 TYR 37 HD1 TYR 37 12.032 11.539 -3.566 286 HE1 TYR 37 HE2 TYR 37 16.389 9.263 -4.269 287 HE2 TYR 37 HE1 TYR 37 12.172 9.553 -5.051 288 HH TYR 37 HH TYR 37 15.250 7.892 -5.783 289 H ILE 38 H ILE 38 15.390 16.111 -1.930 290 HA ILE 38 HA ILE 38 13.000 17.775 -1.504 291 HB ILE 38 HB ILE 38 13.624 17.916 0.923 292 HG12 ILE 38 HG12 ILE 38 15.393 15.495 0.350 293 HG13 ILE 38 HG13 ILE 38 15.975 17.134 0.668 294 HG21 ILE 38 HG21 ILE 38 12.590 15.864 1.682 295 HG22 ILE 38 HG22 ILE 38 11.758 16.448 0.244 296 HG23 ILE 38 HG23 ILE 38 12.895 15.077 0.129 297 HD11 ILE 38 HD13 ILE 38 14.933 17.057 2.904 298 HD12 ILE 38 HD11 ILE 38 14.519 15.341 2.616 299 HD13 ILE 38 HD12 ILE 38 16.210 15.842 2.612 300 H SER 39 H SER 39 13.718 19.807 -0.408 301 HA SER 39 HA SER 39 16.435 20.739 -1.201 302 HB2 SER 39 HB2 SER 39 14.058 22.404 -0.283 303 HB3 SER 39 HB3 SER 39 15.491 22.942 -1.174 304 HG SER 39 HG SER 39 13.373 21.270 -2.090 305 H GLU 40 H GLU 40 17.580 22.023 0.541 306 HA GLU 40 HA GLU 40 17.553 20.738 3.058 307 HB2 GLU 40 HB2 GLU 40 18.618 23.484 2.270 308 HB3 GLU 40 HB3 GLU 40 18.965 22.667 3.800 309 HG2 GLU 40 HG2 GLU 40 19.983 20.767 2.548 310 HG3 GLU 40 HG3 GLU 40 19.698 21.609 1.031 311 H ASN 41 H ASN 41 15.762 23.617 1.974 312 HA ASN 41 HA ASN 41 14.853 24.574 4.467 313 HB2 ASN 41 HB2 ASN 41 14.480 25.747 2.312 314 HB3 ASN 41 HB3 ASN 41 13.340 24.490 1.813 315 HD21 ASN 41 HD22 ASN 41 11.172 24.492 2.736 316 HD22 ASN 41 HD21 ASN 41 10.641 25.810 3.754 317 H TYR 42 H TYR 42 13.734 21.763 2.590 318 HA TYR 42 HA TYR 42 11.206 21.376 3.832 319 HB2 TYR 42 HB2 TYR 42 12.105 20.312 1.717 320 HB3 TYR 42 HB3 TYR 42 13.158 19.318 2.721 321 HD1 TYR 42 HD2 TYR 42 9.631 20.055 1.884 322 HD2 TYR 42 HD1 TYR 42 12.354 17.336 3.821 323 HE1 TYR 42 HE2 TYR 42 7.828 18.354 2.013 324 HE2 TYR 42 HE1 TYR 42 10.571 15.616 3.928 325 HH TYR 42 HH TYR 42 7.233 16.289 2.854 326 H ILE 43 H ILE 43 14.495 20.262 4.641 327 HA ILE 43 HA ILE 43 13.851 18.544 6.790 328 HB ILE 43 HB ILE 43 16.409 20.091 6.318 329 HG12 ILE 43 HG12 ILE 43 15.256 17.512 5.175 330 HG13 ILE 43 HG13 ILE 43 15.769 18.944 4.274 331 HG21 ILE 43 HG21 ILE 43 16.075 18.958 8.571 332 HG22 ILE 43 HG22 ILE 43 15.944 17.417 7.719 333 HG23 ILE 43 HG23 ILE 43 17.450 18.358 7.635 334 HD11 ILE 43 HD13 ILE 43 18.082 18.543 4.907 335 HD12 ILE 43 HD11 ILE 43 17.581 17.036 5.723 336 HD13 ILE 43 HD12 ILE 43 17.333 17.213 3.976 337 H GLN 44 H GLN 44 14.837 22.035 6.696 338 HA GLN 44 HA GLN 44 14.537 22.372 9.525 339 HB2 GLN 44 HB2 GLN 44 15.314 24.049 7.263 340 HB3 GLN 44 HB3 GLN 44 14.221 24.933 8.326 341 HG2 GLN 44 HG2 GLN 44 16.645 23.379 9.261 342 HG3 GLN 44 HG3 GLN 44 16.657 25.111 8.924 343 HE21 GLN 44 HE22 GLN 44 16.663 23.097 11.611 344 HE22 GLN 44 HE21 GLN 44 15.620 23.995 12.658 345 H ALA 45 H ALA 45 12.240 22.670 6.899 346 HA ALA 45 HA ALA 45 10.151 23.930 8.292 347 HB1 ALA 45 HB3 ALA 45 9.708 21.581 6.399 348 HB2 ALA 45 HB1 ALA 45 8.581 22.866 6.802 349 HB3 ALA 45 HB2 ALA 45 10.045 23.254 5.871 350 H ILE 46 H ILE 46 11.140 20.440 8.464 351 HA ILE 46 HA ILE 46 8.971 19.743 10.251 352 HB ILE 46 HB ILE 46 11.647 18.353 9.841 353 HG12 ILE 46 HG12 ILE 46 9.050 17.773 8.375 354 HG13 ILE 46 HG13 ILE 46 10.419 18.618 7.662 355 HG21 ILE 46 HG21 ILE 46 8.982 17.139 10.690 356 HG22 ILE 46 HG22 ILE 46 10.592 16.404 10.776 357 HG23 ILE 46 HG23 ILE 46 10.179 17.717 11.866 358 HD11 ILE 46 HD13 ILE 46 11.861 16.643 8.001 359 HD12 ILE 46 HD11 ILE 46 10.471 15.732 8.613 360 HD13 ILE 46 HD12 ILE 46 10.466 16.317 6.950 361 H LYS 47 H LYS 47 12.481 20.614 10.625 362 HA LYS 47 HA LYS 47 12.518 20.160 13.393 363 HB2 LYS 47 HB2 LYS 47 14.120 22.092 11.687 364 HB3 LYS 47 HB3 LYS 47 14.544 21.739 13.359 365 HG2 LYS 47 HG2 LYS 47 15.177 19.484 12.839 366 HG3 LYS 47 HG3 LYS 47 14.476 19.588 11.212 367 HD2 LYS 47 HD2 LYS 47 16.098 21.262 10.554 368 HD3 LYS 47 HD3 LYS 47 16.822 21.255 12.184 369 HE2 LYS 47 HE2 LYS 47 17.673 19.043 11.876 370 HE3 LYS 47 HE3 LYS 47 16.758 18.799 10.397 371 HZ1 LYS 47 HZ3 LYS 47 19.031 19.315 9.813 372 HZ2 LYS 47 HZ1 LYS 47 18.164 20.622 9.409 373 HZ3 LYS 47 HZ2 LYS 47 19.067 20.635 10.773 374 H ASP 48 H ASP 48 11.835 23.219 11.625 375 HA ASP 48 HA ASP 48 11.566 24.882 13.911 376 HB2 ASP 48 HB2 ASP 48 11.922 25.783 11.674 377 HB3 ASP 48 HB3 ASP 48 10.403 25.079 11.108 378 H SER 49 H SER 49 9.164 22.945 12.038 379 HA SER 49 HA SER 49 6.904 23.772 13.588 380 HB2 SER 49 HB2 SER 49 7.313 21.149 12.104 381 HB3 SER 49 HB3 SER 49 5.777 21.906 12.584 382 HG SER 49 HG SER 49 7.610 22.697 10.607 383 H THR 50 H THR 50 9.390 21.256 14.052 384 HA THR 50 HA THR 50 8.173 20.007 16.296 385 HB THR 50 HB THR 50 11.062 20.094 15.376 386 HG1 THR 50 HG1 THR 50 9.732 19.188 13.877 387 HG21 THR 50 HG23 THR 50 11.227 17.912 16.616 388 HG22 THR 50 HG21 THR 50 11.177 19.366 17.625 389 HG23 THR 50 HG22 THR 50 9.727 18.355 17.467 390 H ILE 51 H ILE 51 10.463 22.804 16.085 391 HA ILE 51 HA ILE 51 10.576 23.239 18.918 392 HB ILE 51 HB ILE 51 10.871 25.118 16.538 393 HG12 ILE 51 HG12 ILE 51 12.969 23.970 18.432 394 HG13 ILE 51 HG13 ILE 51 12.526 23.243 16.895 395 HG21 ILE 51 HG21 ILE 51 11.904 26.764 18.082 396 HG22 ILE 51 HG22 ILE 51 10.214 26.505 18.459 397 HG23 ILE 51 HG23 ILE 51 11.466 25.736 19.464 398 HD11 ILE 51 HD13 ILE 51 14.536 24.515 16.563 399 HD12 ILE 51 HD11 ILE 51 13.215 25.328 15.704 400 HD13 ILE 51 HD12 ILE 51 13.815 25.972 17.253 401 H ASN 52 H ASN 52 8.281 24.346 16.402 402 HA ASN 52 HA ASN 52 6.965 26.295 17.983 403 HB2 ASN 52 HB2 ASN 52 6.329 24.815 15.428 404 HB3 ASN 52 HB3 ASN 52 5.001 25.599 16.220 405 HD21 ASN 52 HD22 ASN 52 8.276 26.255 14.886 406 HD22 ASN 52 HD21 ASN 52 7.981 27.949 14.581 407 H ASN 53 H ASN 53 6.348 22.829 17.664 408 HA ASN 53 HA ASN 53 4.051 23.032 19.587 409 HB2 ASN 53 HB2 ASN 53 3.100 23.287 17.412 410 HB3 ASN 53 HB3 ASN 53 4.163 22.078 16.713 411 HD21 ASN 53 HD22 ASN 53 2.364 21.148 15.751 412 HD22 ASN 53 HD21 ASN 53 1.291 20.090 16.652 413 H GLY 54 H GLY 54 5.945 20.666 17.581 414 HA2 GLY 54 HA2 GLY 54 7.194 19.184 19.484 415 HA3 GLY 54 HA3 GLY 54 5.538 18.527 19.511 416 HA PRO 55 HA PRO 55 8.442 16.982 16.050 417 HB2 PRO 55 HB2 PRO 55 8.228 14.246 16.483 418 HB3 PRO 55 HB3 PRO 55 9.513 15.322 17.106 419 HG2 PRO 55 HG2 PRO 55 6.984 14.423 18.506 420 HG3 PRO 55 HG3 PRO 55 8.655 14.491 19.141 421 HD2 PRO 55 HD2 PRO 55 6.842 16.428 19.707 422 HD3 PRO 55 HD3 PRO 55 8.539 16.881 19.347 423 H TYR 56 H TYR 56 7.884 16.603 14.104 424 HA TYR 56 HA TYR 56 5.018 16.311 13.562 425 HB2 TYR 56 HB2 TYR 56 7.287 17.593 12.115 426 HB3 TYR 56 HB3 TYR 56 5.991 16.871 11.148 427 HD1 TYR 56 HD1 TYR 56 6.507 19.060 14.145 428 HD2 TYR 56 HD2 TYR 56 3.946 18.035 10.837 429 HE1 TYR 56 HE1 TYR 56 4.856 20.727 14.923 430 HE2 TYR 56 HE2 TYR 56 2.326 19.779 11.544 431 HH TYR 56 HH TYR 56 1.805 21.404 13.156 432 H TYR 57 H TYR 57 5.033 14.362 14.252 433 HA TYR 57 HA TYR 57 3.879 12.538 13.274 434 HB2 TYR 57 HB2 TYR 57 6.232 12.121 11.475 435 HB3 TYR 57 HB3 TYR 57 4.912 10.993 11.686 436 HD1 TYR 57 HD1 TYR 57 2.509 11.721 11.161 437 HD2 TYR 57 HD2 TYR 57 5.985 13.889 9.822 438 HE1 TYR 57 HE1 TYR 57 1.142 12.851 9.430 439 HE2 TYR 57 HE2 TYR 57 4.616 15.123 8.206 440 HH TYR 57 HH TYR 57 1.139 14.424 7.677 441 H ILE 58 H ILE 58 3.753 11.369 15.030 442 HA ILE 58 HA ILE 58 6.004 9.651 15.880 443 HB ILE 58 HB ILE 58 4.103 11.136 17.739 444 HG12 ILE 58 HG12 ILE 58 5.887 12.647 17.059 445 HG13 ILE 58 HG13 ILE 58 6.032 12.195 18.748 446 HG21 ILE 58 HG21 ILE 58 6.186 8.991 18.344 447 HG22 ILE 58 HG22 ILE 58 5.434 10.029 19.575 448 HG23 ILE 58 HG23 ILE 58 4.440 8.922 18.629 449 HD11 ILE 58 HD13 ILE 58 8.247 12.226 17.794 450 HD12 ILE 58 HD11 ILE 58 7.835 10.541 18.099 451 HD13 ILE 58 HD12 ILE 58 7.748 11.188 16.451 452 H LEU 59 H LEU 59 5.264 7.549 16.143 453 HA LEU 59 HA LEU 59 2.391 7.084 15.418 454 HB2 LEU 59 HB2 LEU 59 4.938 5.684 14.503 455 HB3 LEU 59 HB3 LEU 59 3.350 4.970 14.338 456 HG LEU 59 HG LEU 59 3.928 5.858 12.255 457 HD11 LEU 59 HD11 LEU 59 2.090 7.275 11.704 458 HD12 LEU 59 HD12 LEU 59 1.562 6.129 12.942 459 HD13 LEU 59 HD13 LEU 59 1.913 7.820 13.382 460 HD21 LEU 59 HD23 LEU 59 5.633 7.506 12.861 461 HD22 LEU 59 HD21 LEU 59 4.417 8.129 11.738 462 HD23 LEU 59 HD22 LEU 59 4.353 8.623 13.413 463 H ALA 60 H ALA 60 5.100 6.085 17.454 464 HA ALA 60 HA ALA 60 3.323 4.784 19.307 465 HB1 ALA 60 HB3 ALA 60 5.462 3.132 17.852 466 HB2 ALA 60 HB1 ALA 60 4.527 2.591 19.255 467 HB3 ALA 60 HB2 ALA 60 3.709 2.888 17.713 468 HA PRO 61 HA PRO 61 6.716 6.192 21.948 469 HB2 PRO 61 HB2 PRO 61 6.619 3.450 23.223 470 HB3 PRO 61 HB3 PRO 61 6.685 5.058 24.005 471 HG2 PRO 61 HG2 PRO 61 4.342 3.702 23.852 472 HG3 PRO 61 HG3 PRO 61 4.384 5.466 23.529 473 HD2 PRO 61 HD2 PRO 61 4.331 3.193 21.533 474 HD3 PRO 61 HD3 PRO 61 3.402 4.724 21.530 475 H GLY 62 H GLY 62 8.636 6.366 20.894 476 HA2 GLY 62 HA2 GLY 62 10.838 5.565 20.551 477 HA3 GLY 62 HA3 GLY 62 10.242 3.926 20.355 478 H VAL 63 H VAL 63 8.095 5.686 18.472 479 HA VAL 63 HA VAL 63 9.767 5.305 16.034 480 HB VAL 63 HB VAL 63 6.875 4.457 16.432 481 HG11 VAL 63 HG11 VAL 63 7.491 5.044 14.084 482 HG12 VAL 63 HG12 VAL 63 8.780 3.841 14.127 483 HG13 VAL 63 HG13 VAL 63 7.073 3.342 14.237 484 HG21 VAL 63 HG23 VAL 63 7.868 2.113 16.257 485 HG22 VAL 63 HG21 VAL 63 9.454 2.847 16.547 486 HG23 VAL 63 HG22 VAL 63 8.173 2.955 17.770 487 H ALA 64 H ALA 64 9.748 6.970 14.667 488 HA ALA 64 HA ALA 64 7.531 8.957 14.680 489 HB1 ALA 64 HB3 ALA 64 10.512 9.506 14.312 490 HB2 ALA 64 HB1 ALA 64 9.221 10.715 14.250 491 HB3 ALA 64 HB2 ALA 64 9.574 9.895 15.775 492 H MET 65 H MET 65 7.484 10.196 12.560 493 HA MET 65 HA MET 65 8.636 8.683 10.323 494 HB2 MET 65 HB2 MET 65 6.461 7.672 10.689 495 HB3 MET 65 HB3 MET 65 5.711 9.267 10.459 496 HG2 MET 65 HG2 MET 65 7.300 8.859 8.171 497 HG3 MET 65 HG3 MET 65 6.601 7.289 8.505 498 HE1 MET 65 HE3 MET 65 4.033 7.077 9.078 499 HE2 MET 65 HE1 MET 65 3.472 8.635 9.753 500 HE3 MET 65 HE2 MET 65 2.791 8.025 8.218 501 HA PRO 66 HA PRO 66 8.642 13.361 10.333 502 HB2 PRO 66 HB2 PRO 66 11.457 12.905 9.278 503 HB3 PRO 66 HB3 PRO 66 10.866 14.202 10.365 504 HG2 PRO 66 HG2 PRO 66 12.144 12.105 11.444 505 HG3 PRO 66 HG3 PRO 66 10.619 12.664 12.191 506 HD2 PRO 66 HD2 PRO 66 10.999 10.376 10.226 507 HD3 PRO 66 HD3 PRO 66 10.148 10.382 11.795 508 H HIS 67 H HIS 67 8.325 14.763 8.708 509 HA HIS 67 HA HIS 67 8.556 14.519 5.898 510 HB2 HIS 67 HB2 HIS 67 7.120 12.621 5.896 511 HB3 HIS 67 HB3 HIS 67 6.123 13.242 7.185 512 HD1 HIS 67 HD1 HIS 67 3.889 14.383 6.486 513 HD2 HIS 67 HD2 HIS 67 6.598 13.810 3.297 514 HE1 HIS 67 HE1 HIS 67 2.651 14.949 4.360 515 H ALA 68 H ALA 68 7.415 16.313 4.924 516 HA ALA 68 HA ALA 68 5.896 18.206 6.611 517 HB1 ALA 68 HB3 ALA 68 7.167 20.104 5.665 518 HB2 ALA 68 HB1 ALA 68 8.178 19.108 6.709 519 HB3 ALA 68 HB2 ALA 68 8.333 18.977 4.946 520 H ARG 69 H ARG 69 4.660 19.686 5.203 521 HA ARG 69 HA ARG 69 3.329 18.259 3.150 522 HB2 ARG 69 HB2 ARG 69 3.566 21.249 3.640 523 HB3 ARG 69 HB3 ARG 69 2.427 20.507 2.496 524 HG2 ARG 69 HG2 ARG 69 1.559 19.169 4.571 525 HG3 ARG 69 HG3 ARG 69 2.454 20.351 5.531 526 HD2 ARG 69 HD2 ARG 69 0.062 20.782 3.725 527 HD3 ARG 69 HD3 ARG 69 0.216 21.137 5.436 528 HE ARG 69 HE ARG 69 1.548 23.058 4.960 529 HH11 ARG 69 HH21 ARG 69 0.093 21.627 2.004 530 HH12 ARG 69 HH22 ARG 69 0.498 23.040 1.044 531 HH21 ARG 69 HH11 ARG 69 1.976 24.899 3.536 532 HH22 ARG 69 HH12 ARG 69 1.486 24.767 1.858 533 HA PRO 70 HA PRO 70 6.096 18.208 -0.274 534 HB2 PRO 70 HB2 PRO 70 3.712 19.379 -1.803 535 HB3 PRO 70 HB3 PRO 70 4.848 18.129 -2.355 536 HG2 PRO 70 HG2 PRO 70 2.446 17.427 -1.330 537 HG3 PRO 70 HG3 PRO 70 3.901 16.523 -0.805 538 HD2 PRO 70 HD2 PRO 70 2.380 18.661 0.664 539 HD3 PRO 70 HD3 PRO 70 3.196 17.196 1.291 540 H GLU 71 H GLU 71 4.036 21.162 -0.099 541 HA GLU 71 HA GLU 71 5.544 22.882 -1.705 542 HB2 GLU 71 HB2 GLU 71 3.804 23.601 0.694 543 HB3 GLU 71 HB3 GLU 71 4.281 24.683 -0.621 544 HG2 GLU 71 HG2 GLU 71 3.089 23.088 -2.220 545 HG3 GLU 71 HG3 GLU 71 2.431 22.278 -0.787 546 H CYS 72 H CYS 72 6.505 21.654 1.357 547 HA CYS 72 HA CYS 72 7.935 24.036 2.271 548 HB2 CYS 72 HB2 CYS 72 8.083 21.140 3.224 549 HB3 CYS 72 HB3 CYS 72 8.771 22.559 4.031 550 HG CYS 72 HG CYS 72 5.670 21.707 3.395 551 H GLY 73 H GLY 73 8.506 21.889 -0.256 552 HA2 GLY 73 HA2 GLY 73 10.508 22.614 -1.523 553 HA3 GLY 73 HA3 GLY 73 11.473 22.312 -0.076 554 H ALA 74 H ALA 74 8.851 20.027 -0.820 555 HA ALA 74 HA ALA 74 10.760 17.865 -1.289 556 HB1 ALA 74 HB3 ALA 74 8.557 17.413 -0.277 557 HB2 ALA 74 HB1 ALA 74 7.783 17.991 -1.780 558 HB3 ALA 74 HB2 ALA 74 8.799 16.533 -1.795 559 H LEU 75 H LEU 75 11.210 16.900 -3.268 560 HA LEU 75 HA LEU 75 10.587 18.489 -5.728 561 HB2 LEU 75 HB2 LEU 75 13.217 17.218 -4.907 562 HB3 LEU 75 HB3 LEU 75 12.917 18.031 -6.437 563 HG LEU 75 HG LEU 75 12.886 19.358 -3.691 564 HD11 LEU 75 HD11 LEU 75 15.000 20.396 -4.407 565 HD12 LEU 75 HD12 LEU 75 15.134 18.635 -4.377 566 HD13 LEU 75 HD13 LEU 75 14.953 19.476 -5.928 567 HD21 LEU 75 HD23 LEU 75 12.875 21.493 -4.964 568 HD22 LEU 75 HD21 LEU 75 12.694 20.588 -6.484 569 HD23 LEU 75 HD22 LEU 75 11.407 20.565 -5.260 570 H LYS 76 H LYS 76 11.196 15.307 -4.263 571 HA LYS 76 HA LYS 76 9.881 14.034 -6.554 572 HB2 LYS 76 HB2 LYS 76 12.367 13.002 -5.198 573 HB3 LYS 76 HB3 LYS 76 11.519 12.195 -6.512 574 HG2 LYS 76 HG2 LYS 76 12.329 13.944 -8.070 575 HG3 LYS 76 HG3 LYS 76 13.088 14.815 -6.713 576 HD2 LYS 76 HD2 LYS 76 14.487 12.814 -6.208 577 HD3 LYS 76 HD3 LYS 76 13.788 11.985 -7.611 578 HE2 LYS 76 HE2 LYS 76 14.716 13.696 -9.113 579 HE3 LYS 76 HE3 LYS 76 15.325 14.620 -7.729 580 HZ1 LYS 76 HZ3 LYS 76 16.206 11.863 -8.383 581 HZ2 LYS 76 HZ1 LYS 76 17.023 13.201 -8.808 582 HZ3 LYS 76 HZ2 LYS 76 16.843 12.843 -7.222 583 H THR 77 H THR 77 8.864 11.931 -5.817 584 HA THR 77 HA THR 77 8.326 11.929 -2.987 585 HB THR 77 HB THR 77 7.302 10.323 -5.350 586 HG1 THR 77 HG1 THR 77 6.033 11.931 -5.656 587 HG21 THR 77 HG23 THR 77 5.452 9.681 -3.891 588 HG22 THR 77 HG21 THR 77 6.980 9.160 -3.187 589 HG23 THR 77 HG22 THR 77 6.166 10.607 -2.540 590 H GLY 78 H GLY 78 9.324 10.593 -1.519 591 HA2 GLY 78 HA2 GLY 78 10.279 7.996 -2.209 592 HA3 GLY 78 HA3 GLY 78 11.631 9.130 -2.049 593 H MET 79 H MET 79 11.918 7.310 -0.255 594 HA MET 79 HA MET 79 10.981 8.399 2.341 595 HB2 MET 79 HB2 MET 79 10.631 5.567 1.272 596 HB3 MET 79 HB3 MET 79 10.731 5.902 2.996 597 HG2 MET 79 HG2 MET 79 8.755 7.262 2.969 598 HG3 MET 79 HG3 MET 79 8.642 7.192 1.212 599 HE1 MET 79 HE3 MET 79 8.173 3.399 3.879 600 HE2 MET 79 HE1 MET 79 9.739 3.881 3.218 601 HE3 MET 79 HE2 MET 79 8.914 4.918 4.412 602 H SER 80 H SER 80 12.214 7.287 4.192 603 HA SER 80 HA SER 80 14.581 5.761 3.550 604 HB2 SER 80 HB2 SER 80 14.863 8.573 4.711 605 HB3 SER 80 HB3 SER 80 16.146 7.349 4.741 606 HG SER 80 HG SER 80 14.962 7.782 2.271 607 H LEU 81 H LEU 81 15.615 4.999 5.581 608 HA LEU 81 HA LEU 81 13.831 4.918 7.961 609 HB2 LEU 81 HB2 LEU 81 15.153 2.827 6.243 610 HB3 LEU 81 HB3 LEU 81 15.297 2.566 7.968 611 HG LEU 81 HG LEU 81 12.874 2.596 8.209 612 HD11 LEU 81 HD11 LEU 81 12.120 4.016 6.376 613 HD12 LEU 81 HD12 LEU 81 12.897 2.974 5.168 614 HD13 LEU 81 HD13 LEU 81 11.467 2.415 6.058 615 HD21 LEU 81 HD23 LEU 81 12.383 0.469 6.967 616 HD22 LEU 81 HD21 LEU 81 13.936 0.662 6.121 617 HD23 LEU 81 HD22 LEU 81 13.877 0.455 7.886 618 H THR 82 H THR 82 14.894 5.369 9.888 619 HA THR 82 HA THR 82 17.871 5.291 9.968 620 HB THR 82 HB THR 82 16.021 7.429 11.144 621 HG1 THR 82 HG1 THR 82 16.393 7.577 8.869 622 HG21 THR 82 HG23 THR 82 18.167 8.586 11.710 623 HG22 THR 82 HG21 THR 82 17.924 7.080 12.601 624 HG23 THR 82 HG22 THR 82 19.055 7.112 11.231 625 H LEU 83 H LEU 83 18.575 4.194 11.745 626 HA LEU 83 HA LEU 83 16.677 3.950 14.029 627 HB2 LEU 83 HB2 LEU 83 16.954 1.802 12.648 628 HB3 LEU 83 HB3 LEU 83 18.652 1.820 13.119 629 HG LEU 83 HG LEU 83 17.768 1.849 15.578 630 HD11 LEU 83 HD11 LEU 83 15.244 0.765 14.247 631 HD12 LEU 83 HD12 LEU 83 15.568 1.045 15.981 632 HD13 LEU 83 HD13 LEU 83 15.382 2.411 14.887 633 HD21 LEU 83 HD23 LEU 83 18.847 -0.098 14.591 634 HD22 LEU 83 HD21 LEU 83 17.455 -0.606 15.565 635 HD23 LEU 83 HD22 LEU 83 17.324 -0.543 13.796 636 H LEU 84 H LEU 84 17.578 4.132 16.060 637 HA LEU 84 HA LEU 84 20.461 4.875 16.259 638 HB2 LEU 84 HB2 LEU 84 18.136 5.582 18.096 639 HB3 LEU 84 HB3 LEU 84 19.825 5.939 18.369 640 HG LEU 84 HG LEU 84 18.918 7.929 17.831 641 HD11 LEU 84 HD11 LEU 84 21.038 7.368 16.595 642 HD12 LEU 84 HD12 LEU 84 20.053 6.989 15.165 643 HD13 LEU 84 HD13 LEU 84 20.077 8.636 15.806 644 HD21 LEU 84 HD23 LEU 84 17.578 6.787 15.344 645 HD22 LEU 84 HD21 LEU 84 16.774 7.241 16.860 646 HD23 LEU 84 HD22 LEU 84 17.566 8.480 15.877 647 H GLU 85 H GLU 85 21.695 3.702 17.752 648 HA GLU 85 HA GLU 85 20.538 1.477 19.186 649 HB2 GLU 85 HB2 GLU 85 23.258 2.815 19.500 650 HB3 GLU 85 HB3 GLU 85 22.757 1.313 20.275 651 HG2 GLU 85 HG2 GLU 85 22.372 0.320 17.990 652 HG3 GLU 85 HG3 GLU 85 23.089 1.771 17.282 653 H GLN 86 H GLN 86 21.397 4.822 19.884 654 HA GLN 86 HA GLN 86 19.859 4.735 22.435 655 HB2 GLN 86 HB2 GLN 86 22.136 6.654 21.902 656 HB3 GLN 86 HB3 GLN 86 21.258 6.379 23.397 657 HG2 GLN 86 HG2 GLN 86 22.224 4.021 23.416 658 HG3 GLN 86 HG3 GLN 86 23.256 4.508 22.061 659 HE21 GLN 86 HE22 GLN 86 24.386 6.857 22.572 660 HE22 GLN 86 HE21 GLN 86 25.146 6.913 24.146 661 H GLY 87 H GLY 87 17.956 5.312 21.526 662 HA2 GLY 87 HA2 GLY 87 17.436 7.255 19.563 663 HA3 GLY 87 HA3 GLY 87 16.306 6.700 20.804 664 H VAL 88 H VAL 88 16.286 9.287 19.857 665 HA VAL 88 HA VAL 88 17.284 10.935 22.133 666 HB VAL 88 HB VAL 88 17.453 11.489 19.132 667 HG11 VAL 88 HG11 VAL 88 16.920 13.595 20.256 668 HG12 VAL 88 HG12 VAL 88 18.251 13.334 21.417 669 HG13 VAL 88 HG13 VAL 88 18.582 13.576 19.682 670 HG21 VAL 88 HG23 VAL 88 19.236 10.036 19.798 671 HG22 VAL 88 HG21 VAL 88 19.951 11.660 19.765 672 HG23 VAL 88 HG22 VAL 88 19.514 10.932 21.308 673 H TYR 89 H TYR 89 15.924 12.749 22.601 674 HA TYR 89 HA TYR 89 13.092 12.250 21.810 675 HB2 TYR 89 HB2 TYR 89 12.361 12.583 23.887 676 HB3 TYR 89 HB3 TYR 89 13.881 11.811 24.257 677 HD1 TYR 89 HD2 TYR 89 11.986 14.950 24.217 678 HD2 TYR 89 HD1 TYR 89 15.703 13.101 25.352 679 HE1 TYR 89 HE2 TYR 89 12.516 16.921 25.645 680 HE2 TYR 89 HE1 TYR 89 16.263 15.058 26.770 681 HH TYR 89 HH TYR 89 15.574 17.149 27.538 682 H PHE 90 H PHE 90 11.765 14.299 22.252 683 HA PHE 90 HA PHE 90 13.034 16.473 20.624 684 HB2 PHE 90 HB2 PHE 90 10.426 15.007 20.638 685 HB3 PHE 90 HB3 PHE 90 10.610 16.533 19.757 686 HD1 PHE 90 HD2 PHE 90 12.731 16.708 18.146 687 HD2 PHE 90 HD1 PHE 90 10.890 12.992 19.347 688 HE1 PHE 90 HE2 PHE 90 13.640 15.601 16.130 689 HE2 PHE 90 HE1 PHE 90 11.831 11.898 17.322 690 HZ PHE 90 HZ PHE 90 13.191 13.196 15.712 691 HA PRO 91 HA PRO 91 11.658 19.430 23.530 692 HB2 PRO 91 HB2 PRO 91 10.854 21.596 21.981 693 HB3 PRO 91 HB3 PRO 91 12.548 21.098 22.267 694 HG2 PRO 91 HG2 PRO 91 10.762 20.369 19.926 695 HG3 PRO 91 HG3 PRO 91 12.437 21.019 19.875 696 HD2 PRO 91 HD2 PRO 91 11.990 18.384 19.632 697 HD3 PRO 91 HD3 PRO 91 13.334 18.954 20.664 698 H GLY 92 H GLY 92 9.264 17.929 21.629 699 HA2 GLY 92 HA2 GLY 92 7.174 18.883 23.516 700 HA3 GLY 92 HA3 GLY 92 6.834 18.837 21.785 701 H ASN 93 H ASN 93 8.944 16.278 23.014 702 HA ASN 93 HA ASN 93 6.815 14.494 23.832 703 HB2 ASN 93 HB2 ASN 93 6.495 13.959 21.521 704 HB3 ASN 93 HB3 ASN 93 8.236 14.074 21.208 705 HD21 ASN 93 HD22 ASN 93 8.993 12.089 20.714 706 HD22 ASN 93 HD21 ASN 93 8.907 10.754 21.814 707 H ASP 94 H ASP 94 7.786 13.882 25.648 708 HA ASP 94 HA ASP 94 10.603 14.062 26.057 709 HB2 ASP 94 HB2 ASP 94 8.922 14.578 27.772 710 HB3 ASP 94 HB3 ASP 94 8.365 12.903 27.757 711 H GLU 95 H GLU 95 8.663 11.319 24.915 712 HA GLU 95 HA GLU 95 10.385 9.291 26.011 713 HB2 GLU 95 HB2 GLU 95 7.993 8.928 25.707 714 HB3 GLU 95 HB3 GLU 95 8.084 9.487 24.039 715 HG2 GLU 95 HG2 GLU 95 7.912 7.237 23.867 716 HG3 GLU 95 HG3 GLU 95 9.594 7.624 23.516 717 HA PRO 96 HA PRO 96 13.165 10.187 22.580 718 HB2 PRO 96 HB2 PRO 96 15.026 8.231 22.898 719 HB3 PRO 96 HB3 PRO 96 14.865 9.615 24.028 720 HG2 PRO 96 HG2 PRO 96 13.771 6.795 24.334 721 HG3 PRO 96 HG3 PRO 96 14.634 7.783 25.554 722 HD2 PRO 96 HD2 PRO 96 11.860 7.585 25.383 723 HD3 PRO 96 HD3 PRO 96 12.703 9.032 26.030 724 H ILE 97 H ILE 97 13.572 9.447 20.497 725 HA ILE 97 HA ILE 97 11.934 7.130 19.605 726 HB ILE 97 HB ILE 97 12.953 9.589 18.136 727 HG12 ILE 97 HG12 ILE 97 11.181 10.281 19.589 728 HG13 ILE 97 HG13 ILE 97 10.540 10.207 17.961 729 HG21 ILE 97 HG21 ILE 97 11.640 8.827 16.235 730 HG22 ILE 97 HG22 ILE 97 12.845 7.611 16.623 731 HG23 ILE 97 HG23 ILE 97 11.156 7.361 17.090 732 HD11 ILE 97 HD13 ILE 97 9.351 8.128 18.460 733 HD12 ILE 97 HD11 ILE 97 10.047 8.094 20.103 734 HD13 ILE 97 HD12 ILE 97 8.942 9.375 19.645 735 H LYS 98 H LYS 98 12.986 5.385 18.991 736 HA LYS 98 HA LYS 98 15.912 5.523 18.435 737 HB2 LYS 98 HB2 LYS 98 13.976 3.311 19.145 738 HB3 LYS 98 HB3 LYS 98 15.416 2.943 18.188 739 HG2 LYS 98 HG2 LYS 98 16.869 3.875 19.940 740 HG3 LYS 98 HG3 LYS 98 15.452 4.289 20.916 741 HD2 LYS 98 HD2 LYS 98 16.542 2.206 21.687 742 HD3 LYS 98 HD3 LYS 98 14.871 1.935 21.170 743 HE2 LYS 98 HE2 LYS 98 15.682 1.074 18.983 744 HE3 LYS 98 HE3 LYS 98 17.354 1.358 19.472 745 HZ1 LYS 98 HZ3 LYS 98 15.528 -0.462 20.934 746 HZ2 LYS 98 HZ1 LYS 98 16.470 -0.956 19.703 747 HZ3 LYS 98 HZ2 LYS 98 17.157 -0.367 21.082 748 H LEU 99 H LEU 99 12.766 5.266 16.806 749 HA LEU 99 HA LEU 99 14.209 4.550 14.307 750 HB2 LEU 99 HB2 LEU 99 13.049 2.584 15.216 751 HB3 LEU 99 HB3 LEU 99 11.615 3.557 15.537 752 HG LEU 99 HG LEU 99 11.195 3.781 13.103 753 HD11 LEU 99 HD11 LEU 99 13.442 3.472 12.159 754 HD12 LEU 99 HD12 LEU 99 13.536 1.827 12.813 755 HD13 LEU 99 HD13 LEU 99 12.369 2.224 11.536 756 HD21 LEU 99 HD23 LEU 99 11.487 0.911 14.057 757 HD22 LEU 99 HD21 LEU 99 10.195 2.003 14.557 758 HD23 LEU 99 HD22 LEU 99 10.317 1.554 12.868 759 H LEU 100 H LEU 100 13.851 5.782 12.607 760 HA LEU 100 HA LEU 100 11.456 7.559 12.611 761 HB2 LEU 100 HB2 LEU 100 14.178 8.515 11.662 762 HB3 LEU 100 HB3 LEU 100 12.703 9.426 11.855 763 HG LEU 100 HG LEU 100 13.023 8.532 14.408 764 HD11 LEU 100 HD11 LEU 100 15.340 8.668 15.110 765 HD12 LEU 100 HD12 LEU 100 15.196 7.386 13.901 766 HD13 LEU 100 HD13 LEU 100 15.871 8.960 13.440 767 HD21 LEU 100 HD23 LEU 100 13.821 10.668 15.086 768 HD22 LEU 100 HD21 LEU 100 14.441 11.022 13.466 769 HD23 LEU 100 HD22 LEU 100 12.690 10.893 13.741 770 H ILE 101 H ILE 101 10.458 7.626 10.634 771 HA ILE 101 HA ILE 101 11.916 6.465 8.319 772 HB ILE 101 HB ILE 101 9.070 5.855 9.235 773 HG12 ILE 101 HG12 ILE 101 11.688 4.400 8.735 774 HG13 ILE 101 HG13 ILE 101 10.744 4.461 10.209 775 HG21 ILE 101 HG21 ILE 101 8.745 4.715 7.062 776 HG22 ILE 101 HG22 ILE 101 8.865 6.454 6.896 777 HG23 ILE 101 HG23 ILE 101 10.261 5.438 6.465 778 HD11 ILE 101 HD13 ILE 101 9.982 2.921 7.703 779 HD12 ILE 101 HD11 ILE 101 10.761 2.261 9.140 780 HD13 ILE 101 HD12 ILE 101 9.124 2.909 9.272 781 H GLY 102 H GLY 102 12.409 7.989 6.997 782 HA2 GLY 102 HA2 GLY 102 11.059 10.578 6.978 783 HA3 GLY 102 HA3 GLY 102 12.409 10.067 5.958 784 H LEU 103 H LEU 103 9.723 11.306 5.289 785 HA LEU 103 HA LEU 103 9.321 9.694 2.859 786 HB2 LEU 103 HB2 LEU 103 7.464 9.085 4.562 787 HB3 LEU 103 HB3 LEU 103 7.007 10.768 4.524 788 HG LEU 103 HG LEU 103 6.619 8.584 2.466 789 HD11 LEU 103 HD11 LEU 103 4.952 9.379 4.312 790 HD12 LEU 103 HD12 LEU 103 4.817 10.883 3.420 791 HD13 LEU 103 HD13 LEU 103 4.326 9.356 2.663 792 HD21 LEU 103 HD23 LEU 103 6.550 11.546 1.789 793 HD22 LEU 103 HD21 LEU 103 7.418 10.192 0.970 794 HD23 LEU 103 HD22 LEU 103 5.681 10.325 0.879 795 H SER 104 H SER 104 9.280 11.167 1.130 796 HA SER 104 HA SER 104 8.550 13.987 1.608 797 HB2 SER 104 HB2 SER 104 10.250 14.718 0.016 798 HB3 SER 104 HB3 SER 104 10.986 13.983 1.450 799 HG SER 104 HG SER 104 10.843 13.041 -1.196 800 H ALA 105 H ALA 105 7.365 14.851 -0.262 801 HA ALA 105 HA ALA 105 6.746 12.901 -2.396 802 HB1 ALA 105 HB3 ALA 105 4.659 14.164 -0.594 803 HB2 ALA 105 HB1 ALA 105 4.358 13.181 -2.042 804 HB3 ALA 105 HB2 ALA 105 5.118 12.440 -0.618 805 H ALA 106 H ALA 106 6.494 13.901 -4.319 806 HA ALA 106 HA ALA 106 6.897 16.751 -4.472 807 HB1 ALA 106 HB3 ALA 106 7.811 15.197 -6.163 808 HB2 ALA 106 HB1 ALA 106 6.160 14.713 -6.625 809 HB3 ALA 106 HB2 ALA 106 6.719 16.374 -6.915 810 H ASP 107 H ASP 107 4.063 14.716 -4.203 811 HA ASP 107 HA ASP 107 2.305 17.073 -4.432 812 HB2 ASP 107 HB2 ASP 107 2.295 16.127 -6.714 813 HB3 ASP 107 HB3 ASP 107 1.919 14.530 -6.068 814 H ALA 108 H ALA 108 0.273 16.723 -3.327 815 HA ALA 108 HA ALA 108 0.590 15.328 -0.922 816 HB1 ALA 108 HB3 ALA 108 -0.865 17.298 -1.176 817 HB2 ALA 108 HB1 ALA 108 -1.973 16.356 -2.207 818 HB3 ALA 108 HB2 ALA 108 -1.764 15.926 -0.499 819 H ASP 109 H ASP 109 -0.920 14.197 -3.957 820 HA ASP 109 HA ASP 109 -2.155 11.881 -2.627 821 HB2 ASP 109 HB2 ASP 109 -3.209 12.807 -4.584 822 HB3 ASP 109 HB3 ASP 109 -1.734 12.560 -5.544 823 H SER 110 H SER 110 0.879 12.609 -4.319 824 HA SER 110 HA SER 110 1.849 9.898 -4.399 825 HB2 SER 110 HB2 SER 110 3.509 12.438 -4.179 826 HB3 SER 110 HB3 SER 110 3.972 10.873 -4.862 827 HG SER 110 HG SER 110 3.423 12.327 -6.506 828 H HIS 111 H HIS 111 1.918 12.513 -1.954 829 HA HIS 111 HA HIS 111 3.360 11.146 0.092 830 HB2 HIS 111 HB2 HIS 111 3.052 13.271 0.801 831 HB3 HIS 111 HB3 HIS 111 1.595 13.477 -0.160 832 HD1 HIS 111 HD1 HIS 111 -0.679 13.339 1.033 833 HD2 HIS 111 HD2 HIS 111 2.637 12.241 3.375 834 HE1 HIS 111 HE1 HIS 111 -1.513 13.216 3.455 835 H ILE 112 H ILE 112 -0.171 11.196 -0.656 836 HA ILE 112 HA ILE 112 -0.925 9.452 1.428 837 HB ILE 112 HB ILE 112 -2.120 10.021 -1.307 838 HG12 ILE 112 HG12 ILE 112 -2.161 11.879 0.364 839 HG13 ILE 112 HG13 ILE 112 -3.734 11.366 -0.205 840 HG21 ILE 112 HG21 ILE 112 -3.247 8.265 0.863 841 HG22 ILE 112 HG22 ILE 112 -4.208 8.975 -0.467 842 HG23 ILE 112 HG23 ILE 112 -2.896 7.848 -0.832 843 HD11 ILE 112 HD13 ILE 112 -3.693 11.881 2.190 844 HD12 ILE 112 HD11 ILE 112 -4.135 10.186 1.911 845 HD13 ILE 112 HD12 ILE 112 -2.494 10.600 2.471 846 H GLY 113 H GLY 113 0.019 8.625 -1.981 847 HA2 GLY 113 HA2 GLY 113 -0.234 5.841 -1.755 848 HA3 GLY 113 HA3 GLY 113 0.907 6.685 -2.821 849 H ALA 114 H ALA 114 2.549 7.929 -0.872 850 HA ALA 114 HA ALA 114 4.343 5.772 -0.241 851 HB1 ALA 114 HB3 ALA 114 4.314 8.684 0.613 852 HB2 ALA 114 HB1 ALA 114 5.709 7.569 0.712 853 HB3 ALA 114 HB2 ALA 114 5.063 8.082 -0.857 854 H ILE 115 H ILE 115 2.241 7.903 1.810 855 HA ILE 115 HA ILE 115 2.899 6.920 4.297 856 HB ILE 115 HB ILE 115 0.568 8.170 3.038 857 HG12 ILE 115 HG12 ILE 115 2.448 9.620 3.790 858 HG13 ILE 115 HG13 ILE 115 0.907 10.022 4.521 859 HG21 ILE 115 HG21 ILE 115 -0.663 6.773 4.383 860 HG22 ILE 115 HG22 ILE 115 0.443 6.962 5.767 861 HG23 ILE 115 HG23 ILE 115 -0.624 8.309 5.250 862 HD11 ILE 115 HD13 ILE 115 1.528 9.017 6.611 863 HD12 ILE 115 HD11 ILE 115 3.048 8.425 5.895 864 HD13 ILE 115 HD12 ILE 115 2.774 10.166 6.088 865 H GLN 116 H GLN 116 0.446 5.841 1.865 866 HA GLN 116 HA GLN 116 -0.629 3.699 3.404 867 HB2 GLN 116 HB2 GLN 116 -0.710 4.422 0.459 868 HB3 GLN 116 HB3 GLN 116 -1.573 3.027 1.108 869 HG2 GLN 116 HG2 GLN 116 -1.946 5.853 2.170 870 HG3 GLN 116 HG3 GLN 116 -2.922 5.160 0.878 871 HE21 GLN 116 HE22 GLN 116 -4.194 3.128 1.423 872 HE22 GLN 116 HE21 GLN 116 -4.751 2.928 3.063 873 H ALA 117 H ALA 117 2.421 3.882 1.928 874 HA ALA 117 HA ALA 117 2.666 0.966 1.748 875 HB1 ALA 117 HB3 ALA 117 4.793 1.381 0.599 876 HB2 ALA 117 HB1 ALA 117 3.505 2.277 -0.225 877 HB3 ALA 117 HB2 ALA 117 4.629 3.124 0.858 878 H LEU 118 H LEU 118 3.940 3.844 3.461 879 HA LEU 118 HA LEU 118 5.766 2.137 4.898 880 HB2 LEU 118 HB2 LEU 118 6.459 4.092 6.034 881 HB3 LEU 118 HB3 LEU 118 6.242 4.378 4.292 882 HG LEU 118 HG LEU 118 4.039 5.355 4.780 883 HD11 LEU 118 HD11 LEU 118 3.584 6.397 6.847 884 HD12 LEU 118 HD12 LEU 118 3.878 4.743 7.289 885 HD13 LEU 118 HD13 LEU 118 5.162 5.917 7.534 886 HD21 LEU 118 HD23 LEU 118 5.130 7.565 5.354 887 HD22 LEU 118 HD21 LEU 118 6.637 6.690 5.635 888 HD23 LEU 118 HD22 LEU 118 5.893 6.687 4.019 889 H SER 119 H SER 119 2.546 3.360 5.459 890 HA SER 119 HA SER 119 2.297 2.614 8.164 891 HB2 SER 119 HB2 SER 119 -0.180 2.229 7.599 892 HB3 SER 119 HB3 SER 119 0.509 3.836 7.328 893 HG SER 119 HG SER 119 0.594 3.500 5.195 894 H GLU 120 H GLU 120 2.710 0.448 5.434 895 HA GLU 120 HA GLU 120 1.631 -1.900 6.678 896 HB2 GLU 120 HB2 GLU 120 3.812 -1.633 4.581 897 HB3 GLU 120 HB3 GLU 120 3.014 -3.132 5.031 898 HG2 GLU 120 HG2 GLU 120 1.517 -0.721 3.941 899 HG3 GLU 120 HG3 GLU 120 2.152 -2.008 2.922 900 H LEU 121 H LEU 121 4.451 0.031 7.066 901 HA LEU 121 HA LEU 121 5.815 -1.981 8.777 902 HB2 LEU 121 HB2 LEU 121 6.823 0.714 7.772 903 HB3 LEU 121 HB3 LEU 121 7.754 -0.506 8.636 904 HG LEU 121 HG LEU 121 6.695 -0.552 5.789 905 HD11 LEU 121 HD11 LEU 121 9.487 -0.794 6.994 906 HD12 LEU 121 HD12 LEU 121 9.105 -0.871 5.266 907 HD13 LEU 121 HD13 LEU 121 8.801 0.623 6.170 908 HD21 LEU 121 HD23 LEU 121 6.337 -2.866 6.678 909 HD22 LEU 121 HD21 LEU 121 7.605 -2.804 5.456 910 HD23 LEU 121 HD22 LEU 121 8.042 -2.927 7.162 911 H LEU 122 H LEU 122 5.164 1.583 8.941 912 HA LEU 122 HA LEU 122 5.615 1.883 11.686 913 HB2 LEU 122 HB2 LEU 122 3.833 3.396 9.710 914 HB3 LEU 122 HB3 LEU 122 3.927 3.869 11.381 915 HG LEU 122 HG LEU 122 5.305 5.291 10.040 916 HD11 LEU 122 HD11 LEU 122 7.359 5.238 11.295 917 HD12 LEU 122 HD12 LEU 122 6.032 4.747 12.359 918 HD13 LEU 122 HD13 LEU 122 7.144 3.526 11.699 919 HD21 LEU 122 HD23 LEU 122 7.298 4.542 8.884 920 HD22 LEU 122 HD21 LEU 122 6.956 2.849 9.304 921 HD23 LEU 122 HD22 LEU 122 5.880 3.748 8.226 922 H CYS 123 H CYS 123 2.623 0.677 10.206 923 HA CYS 123 HA CYS 123 1.313 0.954 12.865 924 HB2 CYS 123 HB2 CYS 123 0.002 0.560 10.146 925 HB3 CYS 123 HB3 CYS 123 -0.816 0.829 11.685 926 HG CYS 123 HG CYS 123 1.398 2.837 10.261 927 H GLU 124 H GLU 124 3.272 -1.078 12.143 928 HA GLU 124 HA GLU 124 1.641 -3.447 12.833 929 HB2 GLU 124 HB2 GLU 124 3.713 -3.259 10.633 930 HB3 GLU 124 HB3 GLU 124 3.388 -4.784 11.461 931 HG2 GLU 124 HG2 GLU 124 1.164 -3.179 10.177 932 HG3 GLU 124 HG3 GLU 124 2.144 -4.327 9.269 933 H GLU 125 H GLU 125 2.123 -3.399 14.908 934 HA GLU 125 HA GLU 125 4.531 -2.578 16.063 935 HB2 GLU 125 HB2 GLU 125 3.756 -3.607 18.113 936 HB3 GLU 125 HB3 GLU 125 2.438 -2.779 17.288 937 HG2 GLU 125 HG2 GLU 125 1.647 -4.997 16.398 938 HG3 GLU 125 HG3 GLU 125 2.926 -5.793 17.316 939 H GLU 126 H GLU 126 3.767 -5.687 14.632 940 HA GLU 126 HA GLU 126 5.927 -7.166 15.752 941 HB2 GLU 126 HB2 GLU 126 4.566 -7.551 13.049 942 HB3 GLU 126 HB3 GLU 126 5.568 -8.735 13.903 943 HG2 GLU 126 HG2 GLU 126 3.899 -8.624 15.817 944 HG3 GLU 126 HG3 GLU 126 2.875 -7.626 14.777 945 H ILE 127 H ILE 127 5.593 -5.165 12.831 946 HA ILE 127 HA ILE 127 8.289 -5.583 11.865 947 HB ILE 127 HB ILE 127 6.076 -3.684 11.194 948 HG12 ILE 127 HG12 ILE 127 6.170 -4.693 9.019 949 HG13 ILE 127 HG13 ILE 127 7.674 -5.540 9.395 950 HG21 ILE 127 HG21 ILE 127 8.964 -3.473 10.382 951 HG22 ILE 127 HG22 ILE 127 7.673 -2.865 9.343 952 HG23 ILE 127 HG23 ILE 127 7.863 -2.201 10.964 953 HD11 ILE 127 HD13 ILE 127 4.986 -6.185 10.654 954 HD12 ILE 127 HD11 ILE 127 5.699 -7.025 9.267 955 HD13 ILE 127 HD12 ILE 127 6.505 -7.100 10.839 956 H LEU 128 H LEU 128 6.618 -3.092 13.862 957 HA LEU 128 HA LEU 128 8.763 -1.322 14.067 958 HB2 LEU 128 HB2 LEU 128 6.751 -1.993 16.264 959 HB3 LEU 128 HB3 LEU 128 7.839 -0.619 16.275 960 HG LEU 128 HG LEU 128 5.548 -1.060 14.329 961 HD11 LEU 128 HD11 LEU 128 4.858 -0.362 16.573 962 HD12 LEU 128 HD12 LEU 128 5.983 1.000 16.523 963 HD13 LEU 128 HD13 LEU 128 4.609 0.936 15.403 964 HD21 LEU 128 HD23 LEU 128 7.150 0.005 12.990 965 HD22 LEU 128 HD21 LEU 128 6.169 1.327 13.635 966 HD23 LEU 128 HD22 LEU 128 7.770 0.995 14.324 967 H GLU 129 H GLU 129 8.196 -4.217 16.073 968 HA GLU 129 HA GLU 129 10.468 -3.763 17.736 969 HB2 GLU 129 HB2 GLU 129 8.649 -6.104 17.188 970 HB3 GLU 129 HB3 GLU 129 10.210 -6.408 17.965 971 HG2 GLU 129 HG2 GLU 129 9.736 -4.753 19.705 972 HG3 GLU 129 HG3 GLU 129 8.160 -4.404 18.979 973 H GLN 130 H GLN 130 10.046 -5.441 14.581 974 HA GLN 130 HA GLN 130 12.612 -6.727 14.732 975 HB2 GLN 130 HB2 GLN 130 10.516 -6.309 12.580 976 HB3 GLN 130 HB3 GLN 130 12.054 -7.136 12.246 977 HG2 GLN 130 HG2 GLN 130 11.639 -8.833 13.866 978 HG3 GLN 130 HG3 GLN 130 10.186 -8.020 14.456 979 HE21 GLN 130 HE22 GLN 130 8.273 -8.127 13.254 980 HE22 GLN 130 HE21 GLN 130 8.041 -9.275 11.940 981 H LEU 131 H LEU 131 11.436 -3.613 13.520 982 HA LEU 131 HA LEU 131 13.984 -2.800 12.324 983 HB2 LEU 131 HB2 LEU 131 11.580 -1.269 13.394 984 HB3 LEU 131 HB3 LEU 131 12.952 -0.496 12.602 985 HG LEU 131 HG LEU 131 11.304 -2.652 11.220 986 HD11 LEU 131 HD11 LEU 131 9.892 -0.938 10.282 987 HD12 LEU 131 HD12 LEU 131 9.848 -0.842 12.065 988 HD13 LEU 131 HD13 LEU 131 10.802 0.332 11.122 989 HD21 LEU 131 HD23 LEU 131 13.526 -1.985 10.234 990 HD22 LEU 131 HD21 LEU 131 12.164 -1.567 9.174 991 HD23 LEU 131 HD22 LEU 131 12.944 -0.311 10.154 992 H LEU 132 H LEU 132 12.184 -2.006 15.315 993 HA LEU 132 HA LEU 132 14.143 -0.415 16.517 994 HB2 LEU 132 HB2 LEU 132 11.969 -2.113 17.746 995 HB3 LEU 132 HB3 LEU 132 13.029 -1.155 18.753 996 HG LEU 132 HG LEU 132 11.423 0.120 16.504 997 HD11 LEU 132 HD11 LEU 132 9.872 -0.949 18.109 998 HD12 LEU 132 HD12 LEU 132 10.694 -0.138 19.458 999 HD13 LEU 132 HD13 LEU 132 9.814 0.814 18.241 1000 HD21 LEU 132 HD23 LEU 132 11.809 2.184 17.792 1001 HD22 LEU 132 HD21 LEU 132 12.750 1.273 18.992 1002 HD23 LEU 132 HD22 LEU 132 13.345 1.447 17.326 1003 H THR 133 H THR 133 14.238 -3.890 16.293 1004 HA THR 133 HA THR 133 16.568 -3.942 18.126 1005 HB THR 133 HB THR 133 16.061 -6.322 18.414 1006 HG1 THR 133 HG1 THR 133 13.670 -5.799 16.983 1007 HG21 THR 133 HG23 THR 133 15.041 -4.665 19.974 1008 HG22 THR 133 HG21 THR 133 13.570 -4.636 18.975 1009 HG23 THR 133 HG22 THR 133 14.067 -6.132 19.784 1010 H ALA 134 H ALA 134 16.239 -3.375 14.994 1011 HA ALA 134 HA ALA 134 17.560 -5.466 13.642 1012 HB1 ALA 134 HB3 ALA 134 17.521 -2.506 12.967 1013 HB2 ALA 134 HB1 ALA 134 17.960 -3.816 11.873 1014 HB3 ALA 134 HB2 ALA 134 16.294 -3.694 12.484 1015 H SER 135 H SER 135 19.493 -6.261 14.252 1016 HA SER 135 HA SER 135 21.517 -4.720 15.535 1017 HB2 SER 135 HB2 SER 135 21.788 -7.416 14.142 1018 HB3 SER 135 HB3 SER 135 22.787 -6.779 15.459 1019 HG SER 135 HG SER 135 21.214 -8.264 16.206 1020 H SER 136 H SER 136 20.650 -4.742 12.191 1021 HA SER 136 HA SER 136 23.190 -3.618 11.373 1022 HB2 SER 136 HB2 SER 136 23.405 -5.436 9.532 1023 HB3 SER 136 HB3 SER 136 23.987 -5.810 11.154 1024 HG SER 136 HG SER 136 21.993 -6.884 11.547 1025 H GLU 137 H GLU 137 23.031 -2.672 9.307 1026 HA GLU 137 HA GLU 137 20.556 -1.461 8.724 1027 HB2 GLU 137 HB2 GLU 137 23.149 -1.763 7.154 1028 HB3 GLU 137 HB3 GLU 137 21.845 -0.668 6.668 1029 HG2 GLU 137 HG2 GLU 137 21.977 0.571 8.689 1030 HG3 GLU 137 HG3 GLU 137 23.181 -0.520 9.388 1031 H LYS 138 H LYS 138 22.063 -4.346 7.334 1032 HA LYS 138 HA LYS 138 20.389 -4.832 5.151 1033 HB2 LYS 138 HB2 LYS 138 21.177 -7.045 5.215 1034 HB3 LYS 138 HB3 LYS 138 22.480 -5.978 5.721 1035 HG2 LYS 138 HG2 LYS 138 22.765 -7.525 7.354 1036 HG3 LYS 138 HG3 LYS 138 21.500 -6.596 8.166 1037 HD2 LYS 138 HD2 LYS 138 19.842 -8.182 6.924 1038 HD3 LYS 138 HD3 LYS 138 21.246 -9.182 6.590 1039 HE2 LYS 138 HE2 LYS 138 20.064 -8.467 9.307 1040 HE3 LYS 138 HE3 LYS 138 20.146 -10.061 8.554 1041 HZ1 LYS 138 HZ3 LYS 138 22.377 -8.475 9.666 1042 HZ2 LYS 138 HZ1 LYS 138 21.829 -9.912 10.196 1043 HZ3 LYS 138 HZ2 LYS 138 22.623 -9.848 8.773 1044 H GLN 139 H GLN 139 19.578 -5.383 8.580 1045 HA GLN 139 HA GLN 139 17.330 -7.041 7.965 1046 HB2 GLN 139 HB2 GLN 139 18.375 -7.442 10.007 1047 HB3 GLN 139 HB3 GLN 139 18.618 -5.741 10.344 1048 HG2 GLN 139 HG2 GLN 139 17.128 -6.456 11.871 1049 HG3 GLN 139 HG3 GLN 139 16.225 -5.451 10.751 1050 HE21 GLN 139 HE22 GLN 139 14.699 -6.894 12.383 1051 HE22 GLN 139 HE21 GLN 139 14.114 -8.397 11.679 1052 H LEU 140 H LEU 140 17.804 -3.449 8.446 1053 HA LEU 140 HA LEU 140 14.991 -2.862 8.462 1054 HB2 LEU 140 HB2 LEU 140 17.391 -1.212 7.537 1055 HB3 LEU 140 HB3 LEU 140 15.759 -0.616 7.697 1056 HG LEU 140 HG LEU 140 16.253 -1.819 10.190 1057 HD11 LEU 140 HD11 LEU 140 18.308 -0.921 11.031 1058 HD12 LEU 140 HD12 LEU 140 18.618 -2.027 9.695 1059 HD13 LEU 140 HD13 LEU 140 18.724 -0.264 9.433 1060 HD21 LEU 140 HD23 LEU 140 16.233 0.417 11.112 1061 HD22 LEU 140 HD21 LEU 140 16.665 1.135 9.543 1062 HD23 LEU 140 HD22 LEU 140 15.081 0.373 9.791 1063 H ALA 141 H ALA 141 17.435 -2.994 5.841 1064 HA ALA 141 HA ALA 141 15.691 -2.631 3.689 1065 HB1 ALA 141 HB3 ALA 141 18.153 -2.553 3.512 1066 HB2 ALA 141 HB1 ALA 141 18.220 -4.321 3.724 1067 HB3 ALA 141 HB2 ALA 141 17.430 -3.623 2.296 1068 H ASP 142 H ASP 142 16.312 -5.673 5.480 1069 HA ASP 142 HA ASP 142 14.912 -7.339 3.637 1070 HB2 ASP 142 HB2 ASP 142 16.364 -8.312 5.338 1071 HB3 ASP 142 HB3 ASP 142 15.340 -7.675 6.628 1072 H ILE 143 H ILE 143 13.832 -5.539 6.576 1073 HA ILE 143 HA ILE 143 11.129 -6.372 6.498 1074 HB ILE 143 HB ILE 143 12.678 -4.053 7.695 1075 HG12 ILE 143 HG12 ILE 143 11.302 -6.467 8.971 1076 HG13 ILE 143 HG13 ILE 143 13.014 -6.390 8.570 1077 HG21 ILE 143 HG21 ILE 143 10.455 -3.185 7.316 1078 HG22 ILE 143 HG22 ILE 143 9.729 -4.621 8.089 1079 HG23 ILE 143 HG23 ILE 143 10.717 -3.468 9.026 1080 HD11 ILE 143 HD13 ILE 143 13.110 -4.282 10.075 1081 HD12 ILE 143 HD11 ILE 143 11.550 -4.871 10.729 1082 HD13 ILE 143 HD12 ILE 143 13.003 -5.868 10.816 1083 H ILE 144 H ILE 144 12.848 -3.665 4.942 1084 HA ILE 144 HA ILE 144 10.643 -2.459 3.606 1085 HB ILE 144 HB ILE 144 13.578 -2.792 3.000 1086 HG12 ILE 144 HG12 ILE 144 12.950 -1.219 4.778 1087 HG13 ILE 144 HG13 ILE 144 13.845 -0.504 3.439 1088 HG21 ILE 144 HG21 ILE 144 13.510 -1.322 1.129 1089 HG22 ILE 144 HG22 ILE 144 12.632 -2.770 0.764 1090 HG23 ILE 144 HG23 ILE 144 11.735 -1.286 1.136 1091 HD11 ILE 144 HD13 ILE 144 11.853 0.539 2.562 1092 HD12 ILE 144 HD11 ILE 144 10.840 -0.271 3.789 1093 HD13 ILE 144 HD12 ILE 144 12.043 0.936 4.271 1094 H SER 145 H SER 145 12.835 -5.062 2.503 1095 HA SER 145 HA SER 145 11.594 -5.336 -0.007 1096 HB2 SER 145 HB2 SER 145 13.215 -7.411 1.544 1097 HB3 SER 145 HB3 SER 145 12.909 -7.415 -0.201 1098 HG SER 145 HG SER 145 14.413 -5.545 1.332 1099 H ARG 146 H ARG 146 10.791 -6.825 3.106 1100 HA ARG 146 HA ARG 146 9.040 -8.836 2.342 1101 HB2 ARG 146 HB2 ARG 146 10.005 -7.669 4.673 1102 HB3 ARG 146 HB3 ARG 146 8.330 -7.128 4.709 1103 HG2 ARG 146 HG2 ARG 146 7.587 -9.471 4.486 1104 HG3 ARG 146 HG3 ARG 146 9.288 -9.995 4.376 1105 HD2 ARG 146 HD2 ARG 146 8.153 -8.448 6.744 1106 HD3 ARG 146 HD3 ARG 146 8.190 -10.224 6.672 1107 HE ARG 146 HE ARG 146 10.807 -9.249 6.127 1108 HH11 ARG 146 HH21 ARG 146 8.540 -9.550 8.848 1109 HH12 ARG 146 HH22 ARG 146 9.803 -9.657 10.042 1110 HH21 ARG 146 HH11 ARG 146 12.441 -9.412 7.695 1111 HH22 ARG 146 HH12 ARG 146 12.036 -9.566 9.385 1112 H GLY 147 H GLY 147 8.573 -5.357 2.134 1113 HA2 GLY 147 HA2 GLY 147 5.621 -5.569 2.127 1114 HA3 GLY 147 HA3 GLY 147 6.600 -4.099 2.198 Start of MODEL 17 1 H MET 1 H1 MET 1 1.950 -1.031 -0.726 2 HA MET 1 HA MET 1 2.459 -1.434 -3.607 3 HB2 MET 1 HB2 MET 1 2.107 1.073 -2.778 4 HB3 MET 1 HB3 MET 1 3.685 0.828 -1.989 5 HG2 MET 1 HG2 MET 1 3.802 1.926 -4.226 6 HG3 MET 1 HG3 MET 1 4.794 0.498 -4.047 7 HE1 MET 1 HE3 MET 1 1.814 2.213 -5.853 8 HE2 MET 1 HE1 MET 1 1.018 0.878 -6.712 9 HE3 MET 1 HE2 MET 1 0.898 0.986 -4.945 10 H ARG 2 H ARG 2 4.624 -1.896 -4.149 11 HA ARG 2 HA ARG 2 6.093 -3.292 -2.165 12 HB2 ARG 2 HB2 ARG 2 7.958 -3.400 -3.663 13 HB3 ARG 2 HB3 ARG 2 6.415 -3.953 -4.366 14 HG2 ARG 2 HG2 ARG 2 6.439 -1.273 -4.951 15 HG3 ARG 2 HG3 ARG 2 8.161 -1.660 -5.049 16 HD2 ARG 2 HD2 ARG 2 5.913 -3.185 -6.395 17 HD3 ARG 2 HD3 ARG 2 6.791 -1.887 -7.219 18 HE ARG 2 HE ARG 2 7.690 -4.626 -6.691 19 HH11 ARG 2 HH11 ARG 2 8.776 -1.361 -7.583 20 HH12 ARG 2 HH12 ARG 2 10.279 -1.888 -8.240 21 HH21 ARG 2 HH21 ARG 2 9.690 -5.325 -7.569 22 HH22 ARG 2 HH22 ARG 2 10.802 -4.195 -8.239 23 H LEU 3 H LEU 3 7.019 -2.525 -0.547 24 HA LEU 3 HA LEU 3 7.187 0.258 0.095 25 HB2 LEU 3 HB2 LEU 3 8.320 -2.266 1.281 26 HB3 LEU 3 HB3 LEU 3 9.051 -0.750 1.775 27 HG LEU 3 HG LEU 3 7.280 -1.618 3.293 28 HD11 LEU 3 HD11 LEU 3 6.321 0.557 3.738 29 HD12 LEU 3 HD12 LEU 3 8.016 0.742 3.295 30 HD13 LEU 3 HD13 LEU 3 6.743 1.149 2.121 31 HD21 LEU 3 HD23 LEU 3 4.940 -1.354 2.788 32 HD22 LEU 3 HD21 LEU 3 5.290 -0.713 1.177 33 HD23 LEU 3 HD22 LEU 3 5.651 -2.399 1.552 34 H SER 4 H SER 4 9.680 -2.040 -1.065 35 HA SER 4 HA SER 4 11.905 -0.517 -0.937 36 HB2 SER 4 HB2 SER 4 11.412 -2.235 -3.370 37 HB3 SER 4 HB3 SER 4 12.850 -2.141 -2.336 38 HG SER 4 HG SER 4 11.574 -4.071 -2.092 39 H ASP 5 H ASP 5 9.236 0.009 -3.240 40 HA ASP 5 HA ASP 5 10.700 1.372 -5.270 41 HB2 ASP 5 HB2 ASP 5 8.377 0.605 -5.556 42 HB3 ASP 5 HB3 ASP 5 7.833 1.769 -4.341 43 H TYR 6 H TYR 6 9.644 2.348 -2.059 44 HA TYR 6 HA TYR 6 10.039 5.202 -2.620 45 HB2 TYR 6 HB2 TYR 6 9.057 3.723 -0.149 46 HB3 TYR 6 HB3 TYR 6 9.199 5.468 -0.287 47 HD1 TYR 6 HD2 TYR 6 7.804 6.800 -1.763 48 HD2 TYR 6 HD1 TYR 6 7.096 2.552 -1.250 49 HE1 TYR 6 HE2 TYR 6 5.601 7.019 -2.877 50 HE2 TYR 6 HE1 TYR 6 4.888 2.807 -2.267 51 HH TYR 6 HH TYR 6 3.351 4.257 -3.279 52 H PHE 7 H PHE 7 12.163 2.656 -1.581 53 HA PHE 7 HA PHE 7 13.781 4.601 0.038 54 HB2 PHE 7 HB2 PHE 7 13.638 1.591 0.291 55 HB3 PHE 7 HB3 PHE 7 14.748 2.635 1.163 56 HD1 PHE 7 HD2 PHE 7 11.144 1.953 0.607 57 HD2 PHE 7 HD1 PHE 7 14.064 3.519 3.363 58 HE1 PHE 7 HE2 PHE 7 9.344 2.429 2.227 59 HE2 PHE 7 HE1 PHE 7 12.235 4.084 4.934 60 HZ PHE 7 HZ PHE 7 9.888 3.535 4.387 61 HA PRO 8 HA PRO 8 15.658 3.912 -4.047 62 HB2 PRO 8 HB2 PRO 8 17.354 6.149 -4.086 63 HB3 PRO 8 HB3 PRO 8 15.664 6.065 -4.664 64 HG2 PRO 8 HG2 PRO 8 16.686 7.002 -1.978 65 HG3 PRO 8 HG3 PRO 8 15.424 7.746 -2.995 66 HD2 PRO 8 HD2 PRO 8 14.722 6.213 -0.918 67 HD3 PRO 8 HD3 PRO 8 13.852 6.057 -2.470 68 H GLU 9 H GLU 9 17.898 4.881 -1.402 69 HA GLU 9 HA GLU 9 19.666 2.667 -2.038 70 HB2 GLU 9 HB2 GLU 9 20.110 4.252 -3.959 71 HB3 GLU 9 HB3 GLU 9 20.453 5.527 -2.806 72 HG2 GLU 9 HG2 GLU 9 22.471 4.204 -2.035 73 HG3 GLU 9 HG3 GLU 9 22.083 2.989 -3.252 74 H SER 10 H SER 10 20.949 5.744 -0.892 75 HA SER 10 HA SER 10 21.979 4.626 1.489 76 HB2 SER 10 HB2 SER 10 21.428 7.569 0.988 77 HB3 SER 10 HB3 SER 10 22.776 6.848 1.880 78 HG SER 10 HG SER 10 23.627 6.123 -0.070 79 H SER 11 H SER 11 18.988 4.446 1.053 80 HA SER 11 HA SER 11 17.610 6.364 2.731 81 HB2 SER 11 HB2 SER 11 16.664 3.849 1.311 82 HB3 SER 11 HB3 SER 11 15.665 5.235 1.796 83 HG SER 11 HG SER 11 16.764 6.500 0.301 84 H ILE 12 H ILE 12 19.521 3.944 3.797 85 HA ILE 12 HA ILE 12 17.738 3.066 5.951 86 HB ILE 12 HB ILE 12 19.826 1.427 4.441 87 HG12 ILE 12 HG12 ILE 12 18.225 1.900 2.675 88 HG13 ILE 12 HG13 ILE 12 18.362 0.222 3.096 89 HG21 ILE 12 HG21 ILE 12 17.473 0.678 6.204 90 HG22 ILE 12 HG22 ILE 12 18.669 -0.459 5.524 91 HG23 ILE 12 HG23 ILE 12 19.173 0.743 6.710 92 HD11 ILE 12 HD13 ILE 12 16.041 1.979 3.969 93 HD12 ILE 12 HD11 ILE 12 16.068 0.897 2.567 94 HD13 ILE 12 HD12 ILE 12 16.201 0.227 4.206 95 H SER 13 H SER 13 18.901 3.560 7.906 96 HA SER 13 HA SER 13 21.789 3.036 7.951 97 HB2 SER 13 HB2 SER 13 20.619 5.805 8.521 98 HB3 SER 13 HB3 SER 13 22.251 5.298 8.986 99 HG SER 13 HG SER 13 21.631 4.812 6.358 100 H VAL 14 H VAL 14 22.373 2.230 9.880 101 HA VAL 14 HA VAL 14 20.641 2.657 12.237 102 HB VAL 14 HB VAL 14 20.869 0.383 11.497 103 HG11 VAL 14 HG11 VAL 14 22.937 0.256 10.343 104 HG12 VAL 14 HG12 VAL 14 23.867 0.634 11.820 105 HG13 VAL 14 HG13 VAL 14 22.982 -0.893 11.679 106 HG21 VAL 14 HG23 VAL 14 22.458 0.796 14.069 107 HG22 VAL 14 HG21 VAL 14 20.691 0.911 13.938 108 HG23 VAL 14 HG22 VAL 14 21.498 -0.633 13.625 109 H ILE 15 H ILE 15 21.592 3.677 13.990 110 HA ILE 15 HA ILE 15 24.324 4.833 13.613 111 HB ILE 15 HB ILE 15 21.617 6.113 14.176 112 HG12 ILE 15 HG12 ILE 15 23.574 6.415 11.877 113 HG13 ILE 15 HG13 ILE 15 21.907 5.815 11.833 114 HG21 ILE 15 HG21 ILE 15 24.333 7.456 14.376 115 HG22 ILE 15 HG22 ILE 15 22.748 8.276 14.478 116 HG23 ILE 15 HG23 ILE 15 23.147 7.112 15.673 117 HD11 ILE 15 HD13 ILE 15 21.859 8.042 10.971 118 HD12 ILE 15 HD11 ILE 15 21.162 8.124 12.611 119 HD13 ILE 15 HD12 ILE 15 22.827 8.669 12.325 120 H HIS 16 H HIS 16 25.477 5.152 15.519 121 HA HIS 16 HA HIS 16 24.742 3.620 17.819 122 HB2 HIS 16 HB2 HIS 16 26.848 5.793 17.493 123 HB3 HIS 16 HB3 HIS 16 26.754 4.639 18.826 124 HD1 HIS 16 HD1 HIS 16 28.592 5.012 15.704 125 HD2 HIS 16 HD2 HIS 16 26.703 1.865 17.774 126 HE1 HIS 16 HE1 HIS 16 29.588 2.857 14.793 127 H SER 17 H SER 17 24.375 7.094 17.020 128 HA SER 17 HA SER 17 22.282 7.513 18.846 129 HB2 SER 17 HB2 SER 17 23.533 9.340 20.184 130 HB3 SER 17 HB3 SER 17 23.702 7.664 20.707 131 HG SER 17 HG SER 17 25.706 8.780 20.666 132 H ALA 18 H ALA 18 21.369 9.669 18.257 133 HA ALA 18 HA ALA 18 22.678 10.923 15.891 134 HB1 ALA 18 HB3 ALA 18 19.952 11.428 17.150 135 HB2 ALA 18 HB1 ALA 18 20.686 12.464 15.921 136 HB3 ALA 18 HB2 ALA 18 20.326 10.776 15.544 137 H LYS 19 H LYS 19 23.401 13.074 16.006 138 HA LYS 19 HA LYS 19 24.815 13.756 18.346 139 HB2 LYS 19 HB2 LYS 19 25.436 14.351 16.071 140 HB3 LYS 19 HB3 LYS 19 24.055 15.398 15.917 141 HG2 LYS 19 HG2 LYS 19 26.038 15.908 18.149 142 HG3 LYS 19 HG3 LYS 19 26.483 16.345 16.504 143 HD2 LYS 19 HD2 LYS 19 23.931 17.334 17.828 144 HD3 LYS 19 HD3 LYS 19 25.463 18.207 17.889 145 HE2 LYS 19 HE2 LYS 19 25.522 18.507 15.507 146 HE3 LYS 19 HE3 LYS 19 24.197 17.368 15.251 147 HZ1 LYS 19 HZ3 LYS 19 23.454 19.659 15.093 148 HZ2 LYS 19 HZ1 LYS 19 22.692 18.886 16.321 149 HZ3 LYS 19 HZ2 LYS 19 23.901 19.965 16.635 150 H ASP 20 H ASP 20 21.648 14.908 17.205 151 HA ASP 20 HA ASP 20 20.666 15.307 19.806 152 HB2 ASP 20 HB2 ASP 20 20.318 17.584 19.987 153 HB3 ASP 20 HB3 ASP 20 22.011 17.536 19.482 154 H TRP 21 H TRP 21 18.341 16.764 19.319 155 HA TRP 21 HA TRP 21 17.083 14.941 17.577 156 HB2 TRP 21 HB2 TRP 21 15.052 15.944 18.143 157 HB3 TRP 21 HB3 TRP 21 16.017 15.805 19.589 158 HD1 TRP 21 HD1 TRP 21 16.415 17.941 20.935 159 HE1 TRP 21 HE1 TRP 21 15.879 20.438 20.688 160 HE3 TRP 21 HE3 TRP 21 14.510 17.848 16.203 161 HZ2 TRP 21 HZ2 TRP 21 14.925 22.212 18.568 162 HZ3 TRP 21 HZ3 TRP 21 13.855 19.932 15.076 163 HH2 TRP 21 HH2 TRP 21 14.108 22.120 16.206 164 H GLN 22 H GLN 22 18.304 18.248 17.024 165 HA GLN 22 HA GLN 22 17.011 18.798 14.471 166 HB2 GLN 22 HB2 GLN 22 19.701 19.647 15.570 167 HB3 GLN 22 HB3 GLN 22 18.930 20.278 14.127 168 HG2 GLN 22 HG2 GLN 22 17.120 21.256 15.353 169 HG3 GLN 22 HG3 GLN 22 17.532 20.385 16.829 170 HE21 GLN 22 HE22 GLN 22 19.715 20.796 17.770 171 HE22 GLN 22 HE21 GLN 22 20.299 22.465 17.763 172 H GLU 23 H GLU 23 20.163 17.186 15.447 173 HA GLU 23 HA GLU 23 20.849 16.391 12.821 174 HB2 GLU 23 HB2 GLU 23 22.215 16.287 15.061 175 HB3 GLU 23 HB3 GLU 23 21.441 14.705 15.256 176 HG2 GLU 23 HG2 GLU 23 23.383 14.082 14.166 177 HG3 GLU 23 HG3 GLU 23 22.322 14.262 12.796 178 H ALA 24 H ALA 24 18.767 14.812 15.231 179 HA ALA 24 HA ALA 24 18.528 12.321 13.891 180 HB1 ALA 24 HB3 ALA 24 16.468 13.641 15.695 181 HB2 ALA 24 HB1 ALA 24 16.706 11.908 15.401 182 HB3 ALA 24 HB2 ALA 24 17.954 12.844 16.266 183 H ILE 25 H ILE 25 16.763 15.410 13.412 184 HA ILE 25 HA ILE 25 14.932 14.307 11.440 185 HB ILE 25 HB ILE 25 15.903 17.168 11.691 186 HG12 ILE 25 HG12 ILE 25 14.395 15.757 13.631 187 HG13 ILE 25 HG13 ILE 25 14.804 17.461 13.572 188 HG21 ILE 25 HG21 ILE 25 13.410 16.035 10.358 189 HG22 ILE 25 HG22 ILE 25 13.869 17.755 10.450 190 HG23 ILE 25 HG23 ILE 25 14.843 16.637 9.530 191 HD11 ILE 25 HD13 ILE 25 12.679 17.910 12.366 192 HD12 ILE 25 HD11 ILE 25 12.315 16.158 12.427 193 HD13 ILE 25 HD12 ILE 25 12.420 17.103 13.924 194 H ASP 26 H ASP 26 18.126 16.010 11.302 195 HA ASP 26 HA ASP 26 18.332 16.102 8.487 196 HB2 ASP 26 HB2 ASP 26 19.879 17.316 9.933 197 HB3 ASP 26 HB3 ASP 26 20.553 15.802 10.540 198 H PHE 27 H PHE 27 19.433 13.529 10.751 199 HA PHE 27 HA PHE 27 20.256 11.725 8.718 200 HB2 PHE 27 HB2 PHE 27 19.537 11.444 11.646 201 HB3 PHE 27 HB3 PHE 27 19.788 10.020 10.656 202 HD1 PHE 27 HD1 PHE 27 21.945 10.207 9.018 203 HD2 PHE 27 HD2 PHE 27 21.576 12.091 12.915 204 HE1 PHE 27 HE1 PHE 27 24.404 10.227 9.260 205 HE2 PHE 27 HE2 PHE 27 24.020 12.042 13.139 206 HZ PHE 27 HZ PHE 27 25.449 11.136 11.326 207 H SER 28 H SER 28 16.972 12.367 10.082 208 HA SER 28 HA SER 28 15.755 10.075 8.852 209 HB2 SER 28 HB2 SER 28 14.456 12.763 9.558 210 HB3 SER 28 HB3 SER 28 13.615 11.284 9.163 211 HG SER 28 HG SER 28 15.408 11.676 11.351 212 H MET 29 H MET 29 16.898 13.130 7.482 213 HA MET 29 HA MET 29 15.276 12.587 5.026 214 HB2 MET 29 HB2 MET 29 16.449 15.188 5.988 215 HB3 MET 29 HB3 MET 29 15.224 14.921 4.733 216 HG2 MET 29 HG2 MET 29 14.508 14.227 7.560 217 HG3 MET 29 HG3 MET 29 14.619 15.907 7.075 218 HE1 MET 29 HE3 MET 29 12.606 12.791 7.184 219 HE2 MET 29 HE1 MET 29 11.466 12.892 5.819 220 HE3 MET 29 HE2 MET 29 13.200 12.562 5.512 221 H VAL 30 H VAL 30 18.638 12.946 6.078 222 HA VAL 30 HA VAL 30 19.648 14.257 3.904 223 HB VAL 30 HB VAL 30 20.920 13.820 5.928 224 HG11 VAL 30 HG11 VAL 30 21.347 10.971 4.918 225 HG12 VAL 30 HG12 VAL 30 22.069 11.712 6.359 226 HG13 VAL 30 HG13 VAL 30 20.326 11.420 6.300 227 HG21 VAL 30 HG23 VAL 30 23.110 13.521 4.909 228 HG22 VAL 30 HG21 VAL 30 22.386 12.778 3.465 229 HG23 VAL 30 HG22 VAL 30 22.078 14.482 3.832 230 H SER 31 H SER 31 18.950 10.709 3.992 231 HA SER 31 HA SER 31 20.291 10.050 1.636 232 HB2 SER 31 HB2 SER 31 17.569 8.916 2.366 233 HB3 SER 31 HB3 SER 31 18.972 8.070 1.705 234 HG SER 31 HG SER 31 19.584 7.701 3.677 235 H LEU 32 H LEU 32 17.164 11.642 2.120 236 HA LEU 32 HA LEU 32 16.386 11.472 -0.703 237 HB2 LEU 32 HB2 LEU 32 15.198 12.822 1.771 238 HB3 LEU 32 HB3 LEU 32 14.467 12.946 0.194 239 HG LEU 32 HG LEU 32 14.952 10.329 1.688 240 HD11 LEU 32 HD11 LEU 32 12.566 10.297 2.087 241 HD12 LEU 32 HD12 LEU 32 13.225 11.805 2.716 242 HD13 LEU 32 HD13 LEU 32 12.343 11.802 1.175 243 HD21 LEU 32 HD23 LEU 32 13.395 10.835 -0.891 244 HD22 LEU 32 HD21 LEU 32 14.943 9.965 -0.773 245 HD23 LEU 32 HD22 LEU 32 13.526 9.296 -0.018 246 H LEU 33 H LEU 33 17.694 13.881 1.620 247 HA LEU 33 HA LEU 33 17.688 16.095 -0.077 248 HB2 LEU 33 HB2 LEU 33 18.259 16.075 2.349 249 HB3 LEU 33 HB3 LEU 33 19.797 15.310 1.956 250 HG LEU 33 HG LEU 33 20.484 17.314 0.663 251 HD11 LEU 33 HD11 LEU 33 17.858 18.511 1.629 252 HD12 LEU 33 HD12 LEU 33 19.187 19.397 0.850 253 HD13 LEU 33 HD13 LEU 33 18.313 18.181 -0.056 254 HD21 LEU 33 HD23 LEU 33 20.921 18.698 2.590 255 HD22 LEU 33 HD21 LEU 33 19.610 17.915 3.505 256 HD23 LEU 33 HD22 LEU 33 21.055 17.003 3.039 257 H ASP 34 H ASP 34 20.042 13.434 0.268 258 HA ASP 34 HA ASP 34 22.073 14.504 -1.338 259 HB2 ASP 34 HB2 ASP 34 22.428 12.740 0.341 260 HB3 ASP 34 HB3 ASP 34 21.436 11.612 -0.578 261 H LYS 35 H LYS 35 19.298 12.515 -2.327 262 HA LYS 35 HA LYS 35 20.348 12.632 -5.127 263 HB2 LYS 35 HB2 LYS 35 17.740 11.378 -4.614 264 HB3 LYS 35 HB3 LYS 35 18.985 10.931 -5.754 265 HG2 LYS 35 HG2 LYS 35 18.847 10.314 -2.796 266 HG3 LYS 35 HG3 LYS 35 18.583 9.179 -4.105 267 HD2 LYS 35 HD2 LYS 35 20.884 9.116 -4.711 268 HD3 LYS 35 HD3 LYS 35 21.270 10.539 -3.719 269 HE2 LYS 35 HE2 LYS 35 20.514 9.318 -1.691 270 HE3 LYS 35 HE3 LYS 35 20.243 7.867 -2.668 271 HZ1 LYS 35 HZ3 LYS 35 22.589 7.757 -3.143 272 HZ2 LYS 35 HZ1 LYS 35 22.860 9.239 -2.397 273 HZ3 LYS 35 HZ2 LYS 35 22.443 7.910 -1.532 274 H ASN 36 H ASN 36 19.209 14.915 -3.404 275 HA ASN 36 HA ASN 36 17.703 16.442 -3.310 276 HB2 ASN 36 HB2 ASN 36 17.811 18.091 -4.767 277 HB3 ASN 36 HB3 ASN 36 19.268 17.181 -5.134 278 HD21 ASN 36 HD22 ASN 36 18.110 15.152 -6.774 279 HD22 ASN 36 HD21 ASN 36 17.639 15.923 -8.283 280 H TYR 37 H TYR 37 16.311 14.184 -3.053 281 HA TYR 37 HA TYR 37 13.755 14.360 -4.491 282 HB2 TYR 37 HB2 TYR 37 14.691 13.061 -1.911 283 HB3 TYR 37 HB3 TYR 37 12.994 13.134 -2.309 284 HD1 TYR 37 HD1 TYR 37 16.218 11.448 -3.078 285 HD2 TYR 37 HD2 TYR 37 12.004 11.724 -3.961 286 HE1 TYR 37 HE1 TYR 37 16.369 9.437 -4.515 287 HE2 TYR 37 HE2 TYR 37 12.172 9.729 -5.420 288 HH TYR 37 HH TYR 37 13.571 8.089 -6.294 289 H ILE 38 H ILE 38 15.377 16.167 -2.022 290 HA ILE 38 HA ILE 38 13.059 17.917 -1.628 291 HB ILE 38 HB ILE 38 13.557 17.995 0.814 292 HG12 ILE 38 HG12 ILE 38 15.321 15.562 0.286 293 HG13 ILE 38 HG13 ILE 38 15.898 17.180 0.706 294 HG21 ILE 38 HG21 ILE 38 12.810 15.169 -0.033 295 HG22 ILE 38 HG22 ILE 38 12.385 15.996 1.473 296 HG23 ILE 38 HG23 ILE 38 11.710 16.563 -0.035 297 HD11 ILE 38 HD13 ILE 38 14.790 17.004 2.903 298 HD12 ILE 38 HD11 ILE 38 14.320 15.326 2.501 299 HD13 ILE 38 HD12 ILE 38 16.032 15.765 2.588 300 H SER 39 H SER 39 13.864 19.995 -0.556 301 HA SER 39 HA SER 39 16.691 20.633 -1.235 302 HB2 SER 39 HB2 SER 39 15.913 22.981 -0.998 303 HB3 SER 39 HB3 SER 39 15.032 22.094 -2.251 304 HG SER 39 HG SER 39 13.634 23.303 -0.924 305 H GLU 40 H GLU 40 17.799 22.058 0.460 306 HA GLU 40 HA GLU 40 17.858 20.752 2.975 307 HB2 GLU 40 HB2 GLU 40 18.886 23.503 2.166 308 HB3 GLU 40 HB3 GLU 40 19.303 22.660 3.663 309 HG2 GLU 40 HG2 GLU 40 20.281 20.789 2.334 310 HG3 GLU 40 HG3 GLU 40 19.916 21.652 0.846 311 H ASN 41 H ASN 41 15.940 23.540 1.915 312 HA ASN 41 HA ASN 41 15.176 24.535 4.474 313 HB2 ASN 41 HB2 ASN 41 14.696 25.704 2.324 314 HB3 ASN 41 HB3 ASN 41 13.548 24.432 1.884 315 HD21 ASN 41 HD22 ASN 41 11.397 24.489 2.823 316 HD22 ASN 41 HD21 ASN 41 10.922 25.776 3.903 317 H TYR 42 H TYR 42 14.036 21.715 2.629 318 HA TYR 42 HA TYR 42 11.556 21.327 3.921 319 HB2 TYR 42 HB2 TYR 42 12.442 20.241 1.814 320 HB3 TYR 42 HB3 TYR 42 13.470 19.232 2.827 321 HD1 TYR 42 HD1 TYR 42 9.965 20.052 1.960 322 HD2 TYR 42 HD2 TYR 42 12.577 17.319 4.026 323 HE1 TYR 42 HE1 TYR 42 8.118 18.407 2.091 324 HE2 TYR 42 HE2 TYR 42 10.736 15.678 4.186 325 HH TYR 42 HH TYR 42 7.457 16.381 2.966 326 H ILE 43 H ILE 43 14.848 20.166 4.756 327 HA ILE 43 HA ILE 43 14.123 18.580 7.004 328 HB ILE 43 HB ILE 43 16.688 20.087 6.285 329 HG12 ILE 43 HG12 ILE 43 17.233 17.386 6.105 330 HG13 ILE 43 HG13 ILE 43 15.542 17.413 5.602 331 HG21 ILE 43 HG21 ILE 43 17.850 18.670 7.915 332 HG22 ILE 43 HG22 ILE 43 16.655 19.703 8.699 333 HG23 ILE 43 HG23 ILE 43 16.301 17.974 8.442 334 HD11 ILE 43 HD13 ILE 43 16.100 19.023 3.822 335 HD12 ILE 43 HD11 ILE 43 17.784 19.076 4.406 336 HD13 ILE 43 HD12 ILE 43 17.125 17.578 3.727 337 H GLN 44 H GLN 44 15.032 22.086 6.785 338 HA GLN 44 HA GLN 44 14.678 22.446 9.608 339 HB2 GLN 44 HB2 GLN 44 15.459 24.122 7.336 340 HB3 GLN 44 HB3 GLN 44 14.354 24.992 8.399 341 HG2 GLN 44 HG2 GLN 44 16.786 23.457 9.353 342 HG3 GLN 44 HG3 GLN 44 16.788 25.189 9.017 343 HE21 GLN 44 HE21 GLN 44 16.726 23.133 11.702 344 HE22 GLN 44 HE22 GLN 44 15.684 24.047 12.735 345 H ALA 45 H ALA 45 12.432 22.683 6.935 346 HA ALA 45 HA ALA 45 10.295 23.945 8.259 347 HB1 ALA 45 HB3 ALA 45 10.255 23.256 5.849 348 HB2 ALA 45 HB1 ALA 45 9.977 21.571 6.366 349 HB3 ALA 45 HB2 ALA 45 8.782 22.809 6.739 350 H ILE 46 H ILE 46 11.280 20.464 8.459 351 HA ILE 46 HA ILE 46 9.084 19.769 10.207 352 HB ILE 46 HB ILE 46 11.767 18.363 9.889 353 HG12 ILE 46 HG12 ILE 46 9.205 17.814 8.354 354 HG13 ILE 46 HG13 ILE 46 10.581 18.661 7.674 355 HG21 ILE 46 HG21 ILE 46 10.561 16.401 10.744 356 HG22 ILE 46 HG22 ILE 46 10.337 17.722 11.877 357 HG23 ILE 46 HG23 ILE 46 9.029 17.301 10.756 358 HD11 ILE 46 HD13 ILE 46 12.017 16.693 7.990 359 HD12 ILE 46 HD11 ILE 46 10.635 15.767 8.593 360 HD13 ILE 46 HD12 ILE 46 10.622 16.366 6.936 361 H LYS 47 H LYS 47 12.556 20.704 10.693 362 HA LYS 47 HA LYS 47 12.501 20.268 13.480 363 HB2 LYS 47 HB2 LYS 47 14.112 22.213 11.786 364 HB3 LYS 47 HB3 LYS 47 14.478 21.902 13.484 365 HG2 LYS 47 HG2 LYS 47 15.099 19.625 13.042 366 HG3 LYS 47 HG3 LYS 47 14.492 19.698 11.379 367 HD2 LYS 47 HD2 LYS 47 16.183 21.339 10.772 368 HD3 LYS 47 HD3 LYS 47 16.768 21.394 12.464 369 HE2 LYS 47 HE2 LYS 47 17.384 19.048 12.318 370 HE3 LYS 47 HE3 LYS 47 16.861 18.956 10.645 371 HZ1 LYS 47 HZ3 LYS 47 19.080 20.693 11.641 372 HZ2 LYS 47 HZ1 LYS 47 19.274 19.290 10.848 373 HZ3 LYS 47 HZ2 LYS 47 18.623 20.569 10.079 374 H ASP 48 H ASP 48 11.753 23.247 11.610 375 HA ASP 48 HA ASP 48 11.274 24.966 13.812 376 HB2 ASP 48 HB2 ASP 48 11.589 25.801 11.547 377 HB3 ASP 48 HB3 ASP 48 10.157 24.932 10.984 378 H SER 49 H SER 49 9.118 22.715 12.019 379 HA SER 49 HA SER 49 6.738 23.324 13.482 380 HB2 SER 49 HB2 SER 49 7.560 20.699 12.169 381 HB3 SER 49 HB3 SER 49 5.926 21.219 12.589 382 HG SER 49 HG SER 49 7.657 22.292 10.617 383 H THR 50 H THR 50 9.497 21.149 14.132 384 HA THR 50 HA THR 50 8.338 19.902 16.428 385 HB THR 50 HB THR 50 11.279 20.171 15.718 386 HG1 THR 50 HG1 THR 50 10.044 19.281 13.994 387 HG21 THR 50 HG23 THR 50 10.883 19.267 17.985 388 HG22 THR 50 HG21 THR 50 9.771 18.050 17.307 389 HG23 THR 50 HG22 THR 50 11.498 18.023 16.886 390 H ILE 51 H ILE 51 10.432 22.818 16.041 391 HA ILE 51 HA ILE 51 10.549 23.457 18.826 392 HB ILE 51 HB ILE 51 10.736 25.121 16.287 393 HG12 ILE 51 HG12 ILE 51 12.880 24.341 18.315 394 HG13 ILE 51 HG13 ILE 51 12.495 23.380 16.897 395 HG21 ILE 51 HG21 ILE 51 11.657 26.980 17.651 396 HG22 ILE 51 HG22 ILE 51 9.974 26.670 18.032 397 HG23 ILE 51 HG23 ILE 51 11.245 26.089 19.133 398 HD11 ILE 51 HD13 ILE 51 13.603 26.208 16.859 399 HD12 ILE 51 HD11 ILE 51 14.428 24.713 16.398 400 HD13 ILE 51 HD12 ILE 51 13.072 25.303 15.419 401 H ASN 52 H ASN 52 8.106 24.194 16.304 402 HA ASN 52 HA ASN 52 6.687 26.154 17.770 403 HB2 ASN 52 HB2 ASN 52 6.133 24.437 15.358 404 HB3 ASN 52 HB3 ASN 52 4.736 25.094 16.159 405 HD21 ASN 52 HD22 ASN 52 7.851 26.074 14.668 406 HD22 ASN 52 HD21 ASN 52 7.331 27.695 14.268 407 H ASN 53 H ASN 53 6.358 22.628 17.745 408 HA ASN 53 HA ASN 53 4.270 22.760 19.876 409 HB2 ASN 53 HB2 ASN 53 2.801 22.783 18.096 410 HB3 ASN 53 HB3 ASN 53 3.934 22.033 16.989 411 HD21 ASN 53 HD22 ASN 53 3.628 19.937 16.456 412 HD22 ASN 53 HD21 ASN 53 2.602 18.820 17.327 413 H GLY 54 H GLY 54 6.127 20.537 17.685 414 HA2 GLY 54 HA2 GLY 54 7.543 18.988 19.382 415 HA3 GLY 54 HA3 GLY 54 5.894 18.367 19.613 416 HA PRO 55 HA PRO 55 7.911 16.529 15.747 417 HB2 PRO 55 HB2 PRO 55 7.583 13.864 16.363 418 HB3 PRO 55 HB3 PRO 55 9.009 14.834 16.839 419 HG2 PRO 55 HG2 PRO 55 6.569 14.161 18.496 420 HG3 PRO 55 HG3 PRO 55 8.285 14.074 18.982 421 HD2 PRO 55 HD2 PRO 55 6.663 16.193 19.596 422 HD3 PRO 55 HD3 PRO 55 8.403 16.430 19.263 423 H TYR 56 H TYR 56 6.531 16.523 14.087 424 HA TYR 56 HA TYR 56 3.666 16.557 14.636 425 HB2 TYR 56 HB2 TYR 56 5.451 17.322 12.369 426 HB3 TYR 56 HB3 TYR 56 3.860 16.761 11.910 427 HD1 TYR 56 HD2 TYR 56 5.511 19.157 14.268 428 HD2 TYR 56 HD1 TYR 56 2.011 18.187 11.955 429 HE1 TYR 56 HE2 TYR 56 4.530 21.375 14.830 430 HE2 TYR 56 HE1 TYR 56 1.006 20.383 12.528 431 HH TYR 56 HH TYR 56 2.700 22.809 14.573 432 H TYR 57 H TYR 57 5.840 14.063 13.830 433 HA TYR 57 HA TYR 57 3.690 12.360 12.681 434 HB2 TYR 57 HB2 TYR 57 6.477 12.836 11.640 435 HB3 TYR 57 HB3 TYR 57 5.487 11.425 11.255 436 HD1 TYR 57 HD1 TYR 57 5.770 15.104 10.790 437 HD2 TYR 57 HD2 TYR 57 3.562 11.523 9.836 438 HE1 TYR 57 HE1 TYR 57 4.468 16.364 9.105 439 HE2 TYR 57 HE2 TYR 57 2.218 12.784 8.176 440 HH TYR 57 HH TYR 57 1.764 14.896 7.257 441 H ILE 58 H ILE 58 3.340 11.118 14.442 442 HA ILE 58 HA ILE 58 5.534 9.412 15.465 443 HB ILE 58 HB ILE 58 3.406 10.900 17.064 444 HG12 ILE 58 HG12 ILE 58 5.347 12.310 16.719 445 HG13 ILE 58 HG13 ILE 58 5.216 11.829 18.397 446 HG21 ILE 58 HG21 ILE 58 3.469 8.645 17.937 447 HG22 ILE 58 HG22 ILE 58 5.239 8.675 18.044 448 HG23 ILE 58 HG23 ILE 58 4.230 9.730 19.076 449 HD11 ILE 58 HD13 ILE 58 7.195 10.776 16.348 450 HD12 ILE 58 HD11 ILE 58 7.543 11.750 17.775 451 HD13 ILE 58 HD12 ILE 58 7.021 10.069 17.959 452 H LEU 59 H LEU 59 4.832 7.279 15.598 453 HA LEU 59 HA LEU 59 1.953 6.747 14.931 454 HB2 LEU 59 HB2 LEU 59 4.368 4.983 14.338 455 HB3 LEU 59 HB3 LEU 59 2.691 4.558 14.094 456 HG LEU 59 HG LEU 59 3.396 5.040 11.993 457 HD11 LEU 59 HD11 LEU 59 1.285 6.217 12.532 458 HD12 LEU 59 HD12 LEU 59 2.215 7.719 12.745 459 HD13 LEU 59 HD13 LEU 59 2.178 6.903 11.173 460 HD21 LEU 59 HD23 LEU 59 4.753 7.644 12.816 461 HD22 LEU 59 HD21 LEU 59 5.591 6.092 12.608 462 HD23 LEU 59 HD22 LEU 59 4.768 6.831 11.249 463 H ALA 60 H ALA 60 4.682 6.025 17.060 464 HA ALA 60 HA ALA 60 2.932 4.865 19.063 465 HB1 ALA 60 HB3 ALA 60 5.190 3.242 17.756 466 HB2 ALA 60 HB1 ALA 60 4.299 2.766 19.214 467 HB3 ALA 60 HB2 ALA 60 3.460 2.867 17.656 468 HA PRO 61 HA PRO 61 6.130 6.773 21.643 469 HB2 PRO 61 HB2 PRO 61 6.180 4.088 23.051 470 HB3 PRO 61 HB3 PRO 61 6.204 5.730 23.764 471 HG2 PRO 61 HG2 PRO 61 3.896 4.318 23.696 472 HG3 PRO 61 HG3 PRO 61 3.880 6.052 23.234 473 HD2 PRO 61 HD2 PRO 61 3.923 3.623 21.426 474 HD3 PRO 61 HD3 PRO 61 2.948 5.119 21.288 475 H GLY 62 H GLY 62 8.219 7.015 20.984 476 HA2 GLY 62 HA2 GLY 62 10.391 6.411 20.555 477 HA3 GLY 62 HA3 GLY 62 9.976 4.709 20.640 478 H VAL 63 H VAL 63 7.781 6.037 18.409 479 HA VAL 63 HA VAL 63 9.570 5.465 16.091 480 HB VAL 63 HB VAL 63 6.667 4.608 16.422 481 HG11 VAL 63 HG11 VAL 63 8.662 3.959 14.201 482 HG12 VAL 63 HG12 VAL 63 6.987 3.367 14.295 483 HG13 VAL 63 HG13 VAL 63 7.302 5.078 14.060 484 HG21 VAL 63 HG23 VAL 63 9.224 2.963 16.589 485 HG22 VAL 63 HG21 VAL 63 8.024 3.215 17.872 486 HG23 VAL 63 HG22 VAL 63 7.586 2.285 16.443 487 H ALA 64 H ALA 64 9.798 7.305 14.989 488 HA ALA 64 HA ALA 64 7.482 9.166 14.744 489 HB1 ALA 64 HB3 ALA 64 10.424 9.863 14.416 490 HB2 ALA 64 HB1 ALA 64 9.043 10.987 14.361 491 HB3 ALA 64 HB2 ALA 64 9.463 10.188 15.879 492 H MET 65 H MET 65 7.486 10.352 12.610 493 HA MET 65 HA MET 65 8.674 8.775 10.435 494 HB2 MET 65 HB2 MET 65 6.616 7.749 10.756 495 HB3 MET 65 HB3 MET 65 5.734 9.275 10.622 496 HG2 MET 65 HG2 MET 65 7.308 9.049 8.256 497 HG3 MET 65 HG3 MET 65 6.711 7.438 8.551 498 HE1 MET 65 HE3 MET 65 3.650 8.290 9.939 499 HE2 MET 65 HE1 MET 65 2.853 7.909 8.389 500 HE3 MET 65 HE2 MET 65 4.215 6.913 8.968 501 HA PRO 66 HA PRO 66 8.750 13.455 10.371 502 HB2 PRO 66 HB2 PRO 66 11.534 12.923 9.252 503 HB3 PRO 66 HB3 PRO 66 11.010 14.244 10.339 504 HG2 PRO 66 HG2 PRO 66 12.264 12.124 11.394 505 HG3 PRO 66 HG3 PRO 66 10.786 12.739 12.190 506 HD2 PRO 66 HD2 PRO 66 11.035 10.406 10.263 507 HD3 PRO 66 HD3 PRO 66 10.214 10.476 11.846 508 H HIS 67 H HIS 67 8.511 14.879 8.738 509 HA HIS 67 HA HIS 67 8.652 14.610 5.933 510 HB2 HIS 67 HB2 HIS 67 7.091 12.768 6.011 511 HB3 HIS 67 HB3 HIS 67 6.134 13.536 7.265 512 HD1 HIS 67 HD1 HIS 67 4.193 15.148 6.511 513 HD2 HIS 67 HD2 HIS 67 6.650 13.800 3.359 514 HE1 HIS 67 HE1 HIS 67 3.041 15.789 4.350 515 H ALA 68 H ALA 68 7.555 16.424 4.979 516 HA ALA 68 HA ALA 68 6.036 18.286 6.658 517 HB1 ALA 68 HB3 ALA 68 8.486 19.139 5.043 518 HB2 ALA 68 HB1 ALA 68 7.285 20.238 5.749 519 HB3 ALA 68 HB2 ALA 68 8.295 19.253 6.807 520 H ARG 69 H ARG 69 4.665 19.637 5.335 521 HA ARG 69 HA ARG 69 3.435 18.186 3.266 522 HB2 ARG 69 HB2 ARG 69 3.380 21.159 3.885 523 HB3 ARG 69 HB3 ARG 69 2.300 20.361 2.720 524 HG2 ARG 69 HG2 ARG 69 1.590 18.809 4.647 525 HG3 ARG 69 HG3 ARG 69 2.436 19.919 5.732 526 HD2 ARG 69 HD2 ARG 69 0.064 20.525 3.932 527 HD3 ARG 69 HD3 ARG 69 0.063 20.438 5.689 528 HE ARG 69 HE ARG 69 1.290 22.470 5.843 529 HH11 ARG 69 HH11 ARG 69 0.111 21.816 2.556 530 HH12 ARG 69 HH12 ARG 69 0.611 23.346 1.910 531 HH21 ARG 69 HH21 ARG 69 1.852 24.548 5.017 532 HH22 ARG 69 HH22 ARG 69 1.648 24.913 3.335 533 HA PRO 70 HA PRO 70 6.052 18.221 -0.164 534 HB2 PRO 70 HB2 PRO 70 3.686 19.385 -1.717 535 HB3 PRO 70 HB3 PRO 70 4.826 18.127 -2.248 536 HG2 PRO 70 HG2 PRO 70 2.418 17.437 -1.220 537 HG3 PRO 70 HG3 PRO 70 3.872 16.540 -0.684 538 HD2 PRO 70 HD2 PRO 70 2.343 18.674 0.770 539 HD3 PRO 70 HD3 PRO 70 3.191 17.229 1.403 540 H GLU 71 H GLU 71 4.052 21.240 -0.120 541 HA GLU 71 HA GLU 71 5.687 22.840 -1.733 542 HB2 GLU 71 HB2 GLU 71 4.379 24.703 -0.878 543 HB3 GLU 71 HB3 GLU 71 3.341 23.306 -1.164 544 HG2 GLU 71 HG2 GLU 71 3.415 22.781 1.291 545 HG3 GLU 71 HG3 GLU 71 4.419 24.207 1.551 546 H CYS 72 H CYS 72 6.498 21.717 1.402 547 HA CYS 72 HA CYS 72 7.943 24.087 2.305 548 HB2 CYS 72 HB2 CYS 72 8.037 21.204 3.305 549 HB3 CYS 72 HB3 CYS 72 8.705 22.629 4.116 550 HG CYS 72 HG CYS 72 5.618 21.790 3.400 551 H GLY 73 H GLY 73 8.590 21.792 -0.107 552 HA2 GLY 73 HA2 GLY 73 10.760 22.511 -1.228 553 HA3 GLY 73 HA3 GLY 73 11.552 22.014 0.271 554 H ALA 74 H ALA 74 8.820 19.994 -0.715 555 HA ALA 74 HA ALA 74 10.642 17.778 -1.339 556 HB1 ALA 74 HB3 ALA 74 8.663 16.502 -1.754 557 HB2 ALA 74 HB1 ALA 74 8.484 17.345 -0.209 558 HB3 ALA 74 HB2 ALA 74 7.657 17.963 -1.671 559 H LEU 75 H LEU 75 11.044 16.957 -3.328 560 HA LEU 75 HA LEU 75 10.304 18.608 -5.711 561 HB2 LEU 75 HB2 LEU 75 12.984 17.335 -5.039 562 HB3 LEU 75 HB3 LEU 75 12.614 18.211 -6.514 563 HG LEU 75 HG LEU 75 12.620 19.441 -3.723 564 HD11 LEU 75 HD11 LEU 75 14.703 19.613 -5.932 565 HD12 LEU 75 HD12 LEU 75 14.725 20.517 -4.398 566 HD13 LEU 75 HD13 LEU 75 14.870 18.756 -4.388 567 HD21 LEU 75 HD23 LEU 75 12.438 20.753 -6.475 568 HD22 LEU 75 HD21 LEU 75 11.138 20.676 -5.267 569 HD23 LEU 75 HD22 LEU 75 12.594 21.608 -4.923 570 H LYS 76 H LYS 76 11.064 15.402 -4.375 571 HA LYS 76 HA LYS 76 9.593 14.135 -6.567 572 HB2 LYS 76 HB2 LYS 76 12.334 13.300 -5.582 573 HB3 LYS 76 HB3 LYS 76 11.323 12.319 -6.650 574 HG2 LYS 76 HG2 LYS 76 11.484 14.097 -8.382 575 HG3 LYS 76 HG3 LYS 76 12.544 15.037 -7.318 576 HD2 LYS 76 HD2 LYS 76 13.172 12.234 -8.341 577 HD3 LYS 76 HD3 LYS 76 13.765 13.737 -9.062 578 HE2 LYS 76 HE2 LYS 76 14.878 14.335 -6.915 579 HE3 LYS 76 HE3 LYS 76 14.334 12.806 -6.206 580 HZ1 LYS 76 HZ3 LYS 76 15.682 11.623 -7.795 581 HZ2 LYS 76 HZ1 LYS 76 16.116 13.001 -8.563 582 HZ3 LYS 76 HZ2 LYS 76 16.620 12.736 -7.032 583 H THR 77 H THR 77 8.901 11.843 -5.806 584 HA THR 77 HA THR 77 8.415 11.916 -2.960 585 HB THR 77 HB THR 77 7.290 10.316 -5.278 586 HG1 THR 77 HG1 THR 77 6.043 11.921 -5.540 587 HG21 THR 77 HG23 THR 77 7.025 9.117 -3.152 588 HG22 THR 77 HG21 THR 77 6.308 10.571 -2.413 589 HG23 THR 77 HG22 THR 77 5.476 9.718 -3.743 590 H GLY 78 H GLY 78 9.301 10.519 -1.474 591 HA2 GLY 78 HA2 GLY 78 10.316 7.916 -2.049 592 HA3 GLY 78 HA3 GLY 78 11.643 9.087 -1.999 593 H MET 79 H MET 79 11.939 7.350 -0.099 594 HA MET 79 HA MET 79 11.095 8.587 2.441 595 HB2 MET 79 HB2 MET 79 10.820 5.666 1.606 596 HB3 MET 79 HB3 MET 79 10.766 6.192 3.279 597 HG2 MET 79 HG2 MET 79 8.771 7.524 2.887 598 HG3 MET 79 HG3 MET 79 8.786 7.087 1.174 599 HE1 MET 79 HE3 MET 79 6.748 5.872 0.765 600 HE2 MET 79 HE1 MET 79 6.031 4.600 1.771 601 HE3 MET 79 HE2 MET 79 6.054 6.284 2.352 602 H SER 80 H SER 80 12.292 7.494 4.253 603 HA SER 80 HA SER 80 14.882 6.281 3.671 604 HB2 SER 80 HB2 SER 80 15.704 8.176 5.468 605 HB3 SER 80 HB3 SER 80 15.926 8.287 3.723 606 HG SER 80 HG SER 80 14.630 9.968 5.268 607 H LEU 81 H LEU 81 15.788 5.379 5.700 608 HA LEU 81 HA LEU 81 13.863 4.973 7.915 609 HB2 LEU 81 HB2 LEU 81 13.682 3.181 6.269 610 HB3 LEU 81 HB3 LEU 81 15.426 2.982 6.187 611 HG LEU 81 HG LEU 81 15.549 1.981 8.329 612 HD11 LEU 81 HD11 LEU 81 13.840 3.335 9.587 613 HD12 LEU 81 HD12 LEU 81 12.568 2.487 8.680 614 HD13 LEU 81 HD13 LEU 81 13.615 1.603 9.783 615 HD21 LEU 81 HD23 LEU 81 14.113 0.004 7.858 616 HD22 LEU 81 HD21 LEU 81 13.099 0.997 6.806 617 HD23 LEU 81 HD22 LEU 81 14.770 0.677 6.340 618 H THR 82 H THR 82 14.865 5.539 9.765 619 HA THR 82 HA THR 82 17.816 5.235 9.982 620 HB THR 82 HB THR 82 15.998 7.385 11.173 621 HG1 THR 82 HG1 THR 82 16.396 7.582 8.916 622 HG21 THR 82 HG23 THR 82 17.865 6.987 12.658 623 HG22 THR 82 HG21 THR 82 19.020 7.001 11.301 624 HG23 THR 82 HG22 THR 82 18.164 8.493 11.780 625 H LEU 83 H LEU 83 18.500 4.280 11.911 626 HA LEU 83 HA LEU 83 16.497 3.911 14.050 627 HB2 LEU 83 HB2 LEU 83 16.824 1.758 12.665 628 HB3 LEU 83 HB3 LEU 83 18.505 1.780 13.194 629 HG LEU 83 HG LEU 83 17.518 1.834 15.629 630 HD11 LEU 83 HD11 LEU 83 15.083 0.613 14.279 631 HD12 LEU 83 HD12 LEU 83 15.325 1.136 15.979 632 HD13 LEU 83 HD13 LEU 83 15.159 2.327 14.698 633 HD21 LEU 83 HD23 LEU 83 17.235 -0.610 15.671 634 HD22 LEU 83 HD21 LEU 83 17.231 -0.613 13.896 635 HD23 LEU 83 HD22 LEU 83 18.678 -0.099 14.781 636 H LEU 84 H LEU 84 17.401 3.992 16.104 637 HA LEU 84 HA LEU 84 20.280 4.812 16.294 638 HB2 LEU 84 HB2 LEU 84 17.939 5.486 18.133 639 HB3 LEU 84 HB3 LEU 84 19.626 5.835 18.422 640 HG LEU 84 HG LEU 84 18.726 7.835 17.916 641 HD11 LEU 84 HD11 LEU 84 19.864 6.948 15.233 642 HD12 LEU 84 HD12 LEU 84 19.878 8.581 15.908 643 HD13 LEU 84 HD13 LEU 84 20.854 7.307 16.668 644 HD21 LEU 84 HD23 LEU 84 16.580 7.156 16.931 645 HD22 LEU 84 HD21 LEU 84 17.367 8.412 15.968 646 HD23 LEU 84 HD22 LEU 84 17.389 6.729 15.408 647 H GLU 85 H GLU 85 21.497 3.457 17.542 648 HA GLU 85 HA GLU 85 20.418 1.245 19.015 649 HB2 GLU 85 HB2 GLU 85 23.086 2.708 19.116 650 HB3 GLU 85 HB3 GLU 85 22.753 1.276 20.083 651 HG2 GLU 85 HG2 GLU 85 22.523 1.276 17.041 652 HG3 GLU 85 HG3 GLU 85 24.025 0.948 17.890 653 H GLN 86 H GLN 86 21.411 4.544 19.758 654 HA GLN 86 HA GLN 86 20.080 4.485 22.427 655 HB2 GLN 86 HB2 GLN 86 22.424 6.214 21.584 656 HB3 GLN 86 HB3 GLN 86 21.727 6.074 23.194 657 HG2 GLN 86 HG2 GLN 86 22.544 3.752 23.356 658 HG3 GLN 86 HG3 GLN 86 23.147 3.834 21.691 659 HE21 GLN 86 HE22 GLN 86 24.787 5.455 21.157 660 HE22 GLN 86 HE21 GLN 86 25.992 5.875 22.371 661 H GLY 87 H GLY 87 18.117 5.195 21.683 662 HA2 GLY 87 HA2 GLY 87 17.491 7.034 19.716 663 HA3 GLY 87 HA3 GLY 87 16.484 6.664 21.113 664 H VAL 88 H VAL 88 16.488 9.127 19.891 665 HA VAL 88 HA VAL 88 17.684 10.920 21.942 666 HB VAL 88 HB VAL 88 17.529 11.377 18.930 667 HG11 VAL 88 HG11 VAL 88 17.126 13.505 20.093 668 HG12 VAL 88 HG12 VAL 88 18.545 13.226 21.141 669 HG13 VAL 88 HG13 VAL 88 18.743 13.475 19.394 670 HG21 VAL 88 HG23 VAL 88 20.075 11.564 19.301 671 HG22 VAL 88 HG21 VAL 88 19.809 10.863 20.894 672 HG23 VAL 88 HG22 VAL 88 19.381 9.934 19.440 673 H TYR 89 H TYR 89 16.332 12.778 22.401 674 HA TYR 89 HA TYR 89 13.495 11.921 22.153 675 HB2 TYR 89 HB2 TYR 89 14.815 11.680 24.313 676 HB3 TYR 89 HB3 TYR 89 14.789 13.424 24.436 677 HD1 TYR 89 HD1 TYR 89 11.589 12.626 23.058 678 HD2 TYR 89 HD2 TYR 89 13.911 12.252 26.697 679 HE1 TYR 89 HE1 TYR 89 9.550 12.501 24.352 680 HE2 TYR 89 HE2 TYR 89 11.816 12.097 28.006 681 HH TYR 89 HH TYR 89 8.579 12.290 26.431 682 H PHE 90 H PHE 90 12.467 13.137 20.723 683 HA PHE 90 HA PHE 90 12.886 15.937 20.235 684 HB2 PHE 90 HB2 PHE 90 10.492 14.083 19.897 685 HB3 PHE 90 HB3 PHE 90 10.500 15.754 19.340 686 HD1 PHE 90 HD2 PHE 90 12.924 16.252 17.957 687 HD2 PHE 90 HD1 PHE 90 10.525 12.677 18.014 688 HE1 PHE 90 HE2 PHE 90 13.873 15.579 15.777 689 HE2 PHE 90 HE1 PHE 90 11.457 12.020 15.804 690 HZ PHE 90 HZ PHE 90 13.145 13.465 14.686 691 HA PRO 91 HA PRO 91 10.661 17.440 23.833 692 HB2 PRO 91 HB2 PRO 91 10.033 20.003 23.110 693 HB3 PRO 91 HB3 PRO 91 11.710 19.445 23.327 694 HG2 PRO 91 HG2 PRO 91 10.157 19.603 20.720 695 HG3 PRO 91 HG3 PRO 91 11.767 20.309 21.087 696 HD2 PRO 91 HD2 PRO 91 11.514 17.889 19.867 697 HD3 PRO 91 HD3 PRO 91 12.808 18.185 21.063 698 H GLY 92 H GLY 92 9.066 15.575 22.573 699 HA2 GLY 92 HA2 GLY 92 6.507 16.238 23.434 700 HA3 GLY 92 HA3 GLY 92 6.499 16.621 21.715 701 H ASN 93 H ASN 93 7.865 13.890 23.709 702 HA ASN 93 HA ASN 93 5.964 12.079 22.429 703 HB2 ASN 93 HB2 ASN 93 8.227 11.989 21.116 704 HB3 ASN 93 HB3 ASN 93 8.875 11.196 22.555 705 HD21 ASN 93 HD22 ASN 93 6.171 11.099 20.241 706 HD22 ASN 93 HD21 ASN 93 5.945 9.357 20.276 707 H ASP 94 H ASP 94 6.181 9.812 23.597 708 HA ASP 94 HA ASP 94 6.123 10.305 26.469 709 HB2 ASP 94 HB2 ASP 94 4.533 8.754 25.404 710 HB3 ASP 94 HB3 ASP 94 5.875 7.752 24.846 711 H GLU 95 H GLU 95 8.366 8.867 24.113 712 HA GLU 95 HA GLU 95 10.480 8.832 26.139 713 HB2 GLU 95 HB2 GLU 95 10.812 6.535 26.073 714 HB3 GLU 95 HB3 GLU 95 9.055 6.673 26.006 715 HG2 GLU 95 HG2 GLU 95 9.094 6.310 23.564 716 HG3 GLU 95 HG3 GLU 95 10.856 6.151 23.628 717 HA PRO 96 HA PRO 96 13.275 9.898 22.867 718 HB2 PRO 96 HB2 PRO 96 14.898 7.416 23.382 719 HB3 PRO 96 HB3 PRO 96 15.439 9.118 23.283 720 HG2 PRO 96 HG2 PRO 96 15.179 7.875 25.688 721 HG3 PRO 96 HG3 PRO 96 14.660 9.578 25.483 722 HD2 PRO 96 HD2 PRO 96 12.951 7.079 25.455 723 HD3 PRO 96 HD3 PRO 96 12.661 8.643 26.284 724 H ILE 97 H ILE 97 13.325 9.595 20.646 725 HA ILE 97 HA ILE 97 11.863 7.324 19.526 726 HB ILE 97 HB ILE 97 13.312 9.606 18.138 727 HG12 ILE 97 HG12 ILE 97 11.604 10.659 19.404 728 HG13 ILE 97 HG13 ILE 97 11.004 10.511 17.763 729 HG21 ILE 97 HG21 ILE 97 12.982 7.695 16.620 730 HG22 ILE 97 HG22 ILE 97 11.276 7.584 17.090 731 HG23 ILE 97 HG23 ILE 97 11.862 8.997 16.215 732 HD11 ILE 97 HD13 ILE 97 9.598 8.556 18.467 733 HD12 ILE 97 HD11 ILE 97 10.143 8.823 20.148 734 HD13 ILE 97 HD12 ILE 97 9.214 10.065 19.308 735 H LYS 98 H LYS 98 12.770 5.502 18.847 736 HA LYS 98 HA LYS 98 15.737 5.429 18.459 737 HB2 LYS 98 HB2 LYS 98 13.751 3.326 19.344 738 HB3 LYS 98 HB3 LYS 98 15.239 2.856 18.506 739 HG2 LYS 98 HG2 LYS 98 16.615 3.986 20.181 740 HG3 LYS 98 HG3 LYS 98 15.175 4.589 21.008 741 HD2 LYS 98 HD2 LYS 98 16.132 2.668 22.196 742 HD3 LYS 98 HD3 LYS 98 14.500 2.348 21.631 743 HE2 LYS 98 HE2 LYS 98 15.858 0.374 21.338 744 HE3 LYS 98 HE3 LYS 98 15.367 0.985 19.761 745 HZ1 LYS 98 HZ3 LYS 98 17.589 1.889 19.461 746 HZ2 LYS 98 HZ1 LYS 98 18.047 1.452 20.976 747 HZ3 LYS 98 HZ2 LYS 98 17.699 0.310 19.856 748 H LEU 99 H LEU 99 12.696 5.416 16.745 749 HA LEU 99 HA LEU 99 14.112 4.456 14.318 750 HB2 LEU 99 HB2 LEU 99 12.886 2.548 15.326 751 HB3 LEU 99 HB3 LEU 99 11.466 3.567 15.542 752 HG LEU 99 HG LEU 99 11.160 3.669 13.074 753 HD11 LEU 99 HD11 LEU 99 13.427 1.601 12.999 754 HD12 LEU 99 HD12 LEU 99 12.327 1.974 11.666 755 HD13 LEU 99 HD13 LEU 99 13.438 3.205 12.255 756 HD21 LEU 99 HD23 LEU 99 10.204 1.468 12.931 757 HD22 LEU 99 HD21 LEU 99 11.303 0.846 14.192 758 HD23 LEU 99 HD22 LEU 99 10.036 2.014 14.590 759 H LEU 100 H LEU 100 13.687 5.613 12.542 760 HA LEU 100 HA LEU 100 11.349 7.441 12.536 761 HB2 LEU 100 HB2 LEU 100 14.101 8.359 11.624 762 HB3 LEU 100 HB3 LEU 100 12.634 9.288 11.735 763 HG LEU 100 HG LEU 100 12.871 8.466 14.318 764 HD11 LEU 100 HD11 LEU 100 15.065 7.338 13.913 765 HD12 LEU 100 HD12 LEU 100 15.741 8.905 13.423 766 HD13 LEU 100 HD13 LEU 100 15.170 8.659 15.087 767 HD21 LEU 100 HD23 LEU 100 14.310 10.943 13.382 768 HD22 LEU 100 HD21 LEU 100 12.545 10.810 13.551 769 HD23 LEU 100 HD22 LEU 100 13.598 10.626 14.966 770 H ILE 101 H ILE 101 10.298 7.317 10.576 771 HA ILE 101 HA ILE 101 11.933 6.450 8.246 772 HB ILE 101 HB ILE 101 9.100 5.735 8.974 773 HG12 ILE 101 HG12 ILE 101 11.592 4.400 7.847 774 HG13 ILE 101 HG13 ILE 101 10.812 4.121 9.403 775 HG21 ILE 101 HG21 ILE 101 8.771 6.898 6.847 776 HG22 ILE 101 HG22 ILE 101 10.065 5.931 6.094 777 HG23 ILE 101 HG23 ILE 101 8.551 5.177 6.648 778 HD11 ILE 101 HD13 ILE 101 8.846 3.162 8.016 779 HD12 ILE 101 HD11 ILE 101 9.980 3.220 6.639 780 HD13 ILE 101 HD12 ILE 101 10.360 2.227 8.047 781 H GLY 102 H GLY 102 12.379 7.990 6.903 782 HA2 GLY 102 HA2 GLY 102 11.040 10.605 7.092 783 HA3 GLY 102 HA3 GLY 102 12.398 10.178 6.045 784 H LEU 103 H LEU 103 9.648 11.332 5.411 785 HA LEU 103 HA LEU 103 9.315 9.746 2.957 786 HB2 LEU 103 HB2 LEU 103 7.419 9.086 4.632 787 HB3 LEU 103 HB3 LEU 103 6.909 10.759 4.510 788 HG LEU 103 HG LEU 103 6.767 8.532 2.410 789 HD11 LEU 103 HD11 LEU 103 4.358 9.318 2.478 790 HD12 LEU 103 HD12 LEU 103 4.931 8.778 4.034 791 HD13 LEU 103 HD13 LEU 103 4.794 10.510 3.698 792 HD21 LEU 103 HD23 LEU 103 7.428 10.278 0.998 793 HD22 LEU 103 HD21 LEU 103 5.694 10.266 0.886 794 HD23 LEU 103 HD22 LEU 103 6.443 11.512 1.874 795 H SER 104 H SER 104 9.164 11.231 1.267 796 HA SER 104 HA SER 104 8.287 13.988 1.777 797 HB2 SER 104 HB2 SER 104 10.825 13.466 0.204 798 HB3 SER 104 HB3 SER 104 10.129 15.015 0.740 799 HG SER 104 HG SER 104 10.381 13.844 2.927 800 H ALA 105 H ALA 105 7.213 14.818 -0.111 801 HA ALA 105 HA ALA 105 6.824 12.881 -2.321 802 HB1 ALA 105 HB3 ALA 105 4.649 13.957 -0.505 803 HB2 ALA 105 HB1 ALA 105 4.397 13.011 -1.985 804 HB3 ALA 105 HB2 ALA 105 5.198 12.261 -0.589 805 H ALA 106 H ALA 106 6.370 13.870 -4.236 806 HA ALA 106 HA ALA 106 6.773 16.717 -4.365 807 HB1 ALA 106 HB3 ALA 106 6.539 16.373 -6.808 808 HB2 ALA 106 HB1 ALA 106 7.634 15.177 -6.095 809 HB3 ALA 106 HB2 ALA 106 5.971 14.714 -6.528 810 H ASP 107 H ASP 107 3.929 14.678 -4.135 811 HA ASP 107 HA ASP 107 2.171 17.053 -4.354 812 HB2 ASP 107 HB2 ASP 107 2.218 16.090 -6.633 813 HB3 ASP 107 HB3 ASP 107 1.792 14.506 -5.983 814 H ALA 108 H ALA 108 0.066 16.670 -3.342 815 HA ALA 108 HA ALA 108 0.293 15.273 -0.917 816 HB1 ALA 108 HB3 ALA 108 -2.211 16.284 -2.330 817 HB2 ALA 108 HB1 ALA 108 -2.085 15.851 -0.614 818 HB3 ALA 108 HB2 ALA 108 -1.166 17.233 -1.241 819 H ASP 109 H ASP 109 -1.102 14.170 -4.031 820 HA ASP 109 HA ASP 109 -2.321 11.806 -2.780 821 HB2 ASP 109 HB2 ASP 109 -3.301 12.668 -4.781 822 HB3 ASP 109 HB3 ASP 109 -1.763 12.512 -5.663 823 H SER 110 H SER 110 0.779 12.622 -4.305 824 HA SER 110 HA SER 110 1.842 9.951 -4.281 825 HB2 SER 110 HB2 SER 110 3.418 12.544 -4.029 826 HB3 SER 110 HB3 SER 110 3.965 10.978 -4.630 827 HG SER 110 HG SER 110 3.472 12.347 -6.357 828 H HIS 111 H HIS 111 1.755 12.611 -1.849 829 HA HIS 111 HA HIS 111 3.159 11.268 0.231 830 HB2 HIS 111 HB2 HIS 111 2.734 13.572 0.560 831 HB3 HIS 111 HB3 HIS 111 1.038 13.419 0.188 832 HD1 HIS 111 HD1 HIS 111 3.385 13.170 3.142 833 HD2 HIS 111 HD2 HIS 111 -0.656 12.650 2.100 834 HE1 HIS 111 HE1 HIS 111 2.109 12.941 5.324 835 H ILE 112 H ILE 112 -0.372 11.272 -0.547 836 HA ILE 112 HA ILE 112 -1.174 9.496 1.495 837 HB ILE 112 HB ILE 112 -2.239 10.029 -1.302 838 HG12 ILE 112 HG12 ILE 112 -2.337 11.873 0.443 839 HG13 ILE 112 HG13 ILE 112 -3.837 11.445 -0.360 840 HG21 ILE 112 HG21 ILE 112 -3.051 7.837 -0.859 841 HG22 ILE 112 HG22 ILE 112 -3.525 8.271 0.797 842 HG23 ILE 112 HG23 ILE 112 -4.377 8.970 -0.605 843 HD11 ILE 112 HD13 ILE 112 -4.082 11.895 2.048 844 HD12 ILE 112 HD11 ILE 112 -4.604 10.258 1.621 845 HD13 ILE 112 HD12 ILE 112 -3.028 10.511 2.420 846 H GLY 113 H GLY 113 -0.185 8.658 -1.910 847 HA2 GLY 113 HA2 GLY 113 -0.467 5.878 -1.629 848 HA3 GLY 113 HA3 GLY 113 0.636 6.692 -2.756 849 H ALA 114 H ALA 114 2.314 7.969 -0.843 850 HA ALA 114 HA ALA 114 4.182 5.862 -0.240 851 HB1 ALA 114 HB3 ALA 114 4.888 8.093 -0.932 852 HB2 ALA 114 HB1 ALA 114 4.035 8.832 0.413 853 HB3 ALA 114 HB2 ALA 114 5.456 7.807 0.713 854 H ILE 115 H ILE 115 2.242 8.036 1.941 855 HA ILE 115 HA ILE 115 2.847 6.962 4.375 856 HB ILE 115 HB ILE 115 0.521 8.247 3.141 857 HG12 ILE 115 HG12 ILE 115 2.404 9.728 3.739 858 HG13 ILE 115 HG13 ILE 115 0.936 10.113 4.618 859 HG21 ILE 115 HG21 ILE 115 -0.676 6.914 4.557 860 HG22 ILE 115 HG22 ILE 115 0.474 7.131 5.904 861 HG23 ILE 115 HG23 ILE 115 -0.588 8.477 5.365 862 HD11 ILE 115 HD13 ILE 115 3.312 8.645 5.737 863 HD12 ILE 115 HD11 ILE 115 2.848 10.320 6.057 864 HD13 ILE 115 HD12 ILE 115 1.809 9.003 6.630 865 H GLN 116 H GLN 116 0.321 5.947 1.982 866 HA GLN 116 HA GLN 116 -0.724 3.836 3.597 867 HB2 GLN 116 HB2 GLN 116 -0.892 4.470 0.626 868 HB3 GLN 116 HB3 GLN 116 -1.757 3.114 1.349 869 HG2 GLN 116 HG2 GLN 116 -2.059 5.967 2.359 870 HG3 GLN 116 HG3 GLN 116 -3.064 5.285 1.082 871 HE21 GLN 116 HE22 GLN 116 -4.478 3.409 1.637 872 HE22 GLN 116 HE21 GLN 116 -4.975 3.177 3.293 873 H ALA 117 H ALA 117 2.282 3.941 2.007 874 HA ALA 117 HA ALA 117 2.443 1.021 1.844 875 HB1 ALA 117 HB3 ALA 117 3.322 2.290 -0.136 876 HB2 ALA 117 HB1 ALA 117 4.454 3.137 0.923 877 HB3 ALA 117 HB2 ALA 117 4.607 1.392 0.688 878 H LEU 118 H LEU 118 3.919 3.879 3.446 879 HA LEU 118 HA LEU 118 5.615 2.134 4.977 880 HB2 LEU 118 HB2 LEU 118 6.251 4.062 6.209 881 HB3 LEU 118 HB3 LEU 118 6.295 4.297 4.438 882 HG LEU 118 HG LEU 118 4.364 5.643 4.477 883 HD11 LEU 118 HD11 LEU 118 3.065 5.112 6.466 884 HD12 LEU 118 HD12 LEU 118 4.475 5.318 7.508 885 HD13 LEU 118 HD13 LEU 118 3.674 6.691 6.691 886 HD21 LEU 118 HD23 LEU 118 5.504 7.595 5.651 887 HD22 LEU 118 HD21 LEU 118 6.574 6.450 6.424 888 HD23 LEU 118 HD22 LEU 118 6.624 6.645 4.661 889 H SER 119 H SER 119 2.432 3.347 5.485 890 HA SER 119 HA SER 119 2.112 2.642 8.197 891 HB2 SER 119 HB2 SER 119 0.025 2.387 5.990 892 HB3 SER 119 HB3 SER 119 -0.294 2.461 7.733 893 HG SER 119 HG SER 119 0.796 4.466 6.045 894 H GLU 120 H GLU 120 2.529 0.479 5.444 895 HA GLU 120 HA GLU 120 1.386 -1.847 6.671 896 HB2 GLU 120 HB2 GLU 120 3.564 -1.645 4.569 897 HB3 GLU 120 HB3 GLU 120 2.681 -3.104 4.978 898 HG2 GLU 120 HG2 GLU 120 1.305 -0.596 3.956 899 HG3 GLU 120 HG3 GLU 120 1.909 -1.847 2.877 900 H LEU 121 H LEU 121 4.208 0.025 7.149 901 HA LEU 121 HA LEU 121 5.604 -2.125 8.687 902 HB2 LEU 121 HB2 LEU 121 6.666 0.553 7.685 903 HB3 LEU 121 HB3 LEU 121 7.593 -0.703 8.494 904 HG LEU 121 HG LEU 121 6.370 -0.732 5.710 905 HD11 LEU 121 HD11 LEU 121 8.744 -1.013 5.037 906 HD12 LEU 121 HD12 LEU 121 8.487 0.470 5.971 907 HD13 LEU 121 HD13 LEU 121 9.232 -0.950 6.740 908 HD21 LEU 121 HD23 LEU 121 7.329 -2.991 5.360 909 HD22 LEU 121 HD21 LEU 121 7.856 -3.071 7.042 910 HD23 LEU 121 HD22 LEU 121 6.124 -3.057 6.641 911 H LEU 122 H LEU 122 5.145 1.450 8.947 912 HA LEU 122 HA LEU 122 5.766 1.577 11.729 913 HB2 LEU 122 HB2 LEU 122 4.322 3.577 10.022 914 HB3 LEU 122 HB3 LEU 122 5.161 3.847 11.565 915 HG LEU 122 HG LEU 122 6.492 3.001 8.969 916 HD11 LEU 122 HD11 LEU 122 5.577 5.436 9.497 917 HD12 LEU 122 HD12 LEU 122 7.094 5.552 10.405 918 HD13 LEU 122 HD13 LEU 122 7.084 5.150 8.658 919 HD21 LEU 122 HD23 LEU 122 7.776 2.012 10.781 920 HD22 LEU 122 HD21 LEU 122 8.626 3.478 10.293 921 HD23 LEU 122 HD22 LEU 122 7.641 3.493 11.757 922 H CYS 123 H CYS 123 2.826 0.466 10.364 923 HA CYS 123 HA CYS 123 1.519 0.911 12.995 924 HB2 CYS 123 HB2 CYS 123 0.089 0.689 10.313 925 HB3 CYS 123 HB3 CYS 123 -0.635 1.031 11.884 926 HG CYS 123 HG CYS 123 0.655 3.280 12.313 927 H GLU 124 H GLU 124 3.320 -1.210 12.136 928 HA GLU 124 HA GLU 124 1.568 -3.498 12.789 929 HB2 GLU 124 HB2 GLU 124 3.576 -3.328 10.533 930 HB3 GLU 124 HB3 GLU 124 3.292 -4.862 11.356 931 HG2 GLU 124 HG2 GLU 124 1.037 -3.224 10.147 932 HG3 GLU 124 HG3 GLU 124 1.935 -4.443 9.246 933 H GLU 125 H GLU 125 2.074 -3.648 14.838 934 HA GLU 125 HA GLU 125 4.490 -2.904 16.023 935 HB2 GLU 125 HB2 GLU 125 3.713 -4.036 18.014 936 HB3 GLU 125 HB3 GLU 125 2.403 -3.148 17.240 937 HG2 GLU 125 HG2 GLU 125 1.588 -5.308 16.230 938 HG3 GLU 125 HG3 GLU 125 2.853 -6.164 17.111 939 H GLU 126 H GLU 126 3.699 -5.906 14.405 940 HA GLU 126 HA GLU 126 5.793 -7.537 15.422 941 HB2 GLU 126 HB2 GLU 126 4.405 -7.529 12.710 942 HB3 GLU 126 HB3 GLU 126 5.495 -8.805 13.256 943 HG2 GLU 126 HG2 GLU 126 2.940 -7.990 14.685 944 HG3 GLU 126 HG3 GLU 126 3.050 -9.296 13.509 945 H ILE 127 H ILE 127 5.554 -5.391 12.600 946 HA ILE 127 HA ILE 127 8.272 -5.731 11.701 947 HB ILE 127 HB ILE 127 6.003 -3.908 11.051 948 HG12 ILE 127 HG12 ILE 127 6.269 -4.778 8.813 949 HG13 ILE 127 HG13 ILE 127 7.760 -5.617 9.255 950 HG21 ILE 127 HG21 ILE 127 7.714 -2.297 10.948 951 HG22 ILE 127 HG22 ILE 127 8.891 -3.463 10.296 952 HG23 ILE 127 HG23 ILE 127 7.566 -2.877 9.288 953 HD11 ILE 127 HD13 ILE 127 6.518 -7.223 10.592 954 HD12 ILE 127 HD11 ILE 127 5.004 -6.306 10.344 955 HD13 ILE 127 HD12 ILE 127 5.801 -7.114 8.980 956 H LEU 128 H LEU 128 6.549 -3.314 13.740 957 HA LEU 128 HA LEU 128 8.652 -1.501 13.965 958 HB2 LEU 128 HB2 LEU 128 6.566 -2.235 16.063 959 HB3 LEU 128 HB3 LEU 128 7.688 -0.903 16.241 960 HG LEU 128 HG LEU 128 5.560 -1.102 14.075 961 HD11 LEU 128 HD11 LEU 128 5.816 0.716 16.507 962 HD12 LEU 128 HD12 LEU 128 4.540 0.786 15.272 963 HD13 LEU 128 HD13 LEU 128 4.669 -0.624 16.328 964 HD21 LEU 128 HD23 LEU 128 7.329 0.099 13.064 965 HD22 LEU 128 HD21 LEU 128 6.261 1.337 13.739 966 HD23 LEU 128 HD22 LEU 128 7.764 0.921 14.580 967 H GLU 129 H GLU 129 8.157 -4.421 15.950 968 HA GLU 129 HA GLU 129 10.379 -3.856 17.653 969 HB2 GLU 129 HB2 GLU 129 8.623 -6.245 17.140 970 HB3 GLU 129 HB3 GLU 129 10.203 -6.523 17.890 971 HG2 GLU 129 HG2 GLU 129 9.737 -4.870 19.635 972 HG3 GLU 129 HG3 GLU 129 8.144 -4.545 18.936 973 H GLN 130 H GLN 130 10.081 -5.514 14.473 974 HA GLN 130 HA GLN 130 12.676 -6.748 14.706 975 HB2 GLN 130 HB2 GLN 130 10.634 -6.388 12.488 976 HB3 GLN 130 HB3 GLN 130 12.207 -7.173 12.213 977 HG2 GLN 130 HG2 GLN 130 11.770 -8.865 13.858 978 HG3 GLN 130 HG3 GLN 130 10.270 -8.083 14.367 979 HE21 GLN 130 HE22 GLN 130 8.411 -8.223 13.046 980 HE22 GLN 130 HE21 GLN 130 8.276 -9.412 11.756 981 H LEU 131 H LEU 131 11.358 -3.721 13.338 982 HA LEU 131 HA LEU 131 13.873 -2.783 12.218 983 HB2 LEU 131 HB2 LEU 131 11.483 -1.279 13.341 984 HB3 LEU 131 HB3 LEU 131 12.811 -0.537 12.457 985 HG LEU 131 HG LEU 131 11.033 -2.700 11.238 986 HD11 LEU 131 HD11 LEU 131 10.649 0.302 11.093 987 HD12 LEU 131 HD12 LEU 131 9.651 -0.935 10.309 988 HD13 LEU 131 HD13 LEU 131 9.690 -0.821 12.089 989 HD21 LEU 131 HD23 LEU 131 13.182 -2.200 10.067 990 HD22 LEU 131 HD21 LEU 131 11.761 -1.748 9.105 991 HD23 LEU 131 HD22 LEU 131 12.675 -0.496 9.948 992 H LEU 132 H LEU 132 12.071 -2.072 15.238 993 HA LEU 132 HA LEU 132 13.984 -0.434 16.420 994 HB2 LEU 132 HB2 LEU 132 11.878 -2.201 17.661 995 HB3 LEU 132 HB3 LEU 132 12.940 -1.256 18.678 996 HG LEU 132 HG LEU 132 11.308 0.061 16.478 997 HD11 LEU 132 HD11 LEU 132 9.762 -1.071 18.038 998 HD12 LEU 132 HD12 LEU 132 10.567 -0.293 19.416 999 HD13 LEU 132 HD13 LEU 132 9.684 0.686 18.221 1000 HD21 LEU 132 HD23 LEU 132 11.672 2.094 17.819 1001 HD22 LEU 132 HD21 LEU 132 12.596 1.161 19.015 1002 HD23 LEU 132 HD22 LEU 132 13.224 1.378 17.369 1003 H THR 133 H THR 133 14.184 -3.927 16.243 1004 HA THR 133 HA THR 133 16.496 -3.894 18.097 1005 HB THR 133 HB THR 133 16.102 -6.319 18.278 1006 HG1 THR 133 HG1 THR 133 13.687 -5.838 16.881 1007 HG21 THR 133 HG23 THR 133 13.567 -4.717 18.890 1008 HG22 THR 133 HG21 THR 133 14.075 -6.244 19.630 1009 HG23 THR 133 HG22 THR 133 15.026 -4.775 19.903 1010 H ALA 134 H ALA 134 16.142 -3.424 14.885 1011 HA ALA 134 HA ALA 134 17.784 -5.387 13.677 1012 HB1 ALA 134 HB3 ALA 134 17.158 -2.537 12.864 1013 HB2 ALA 134 HB1 ALA 134 18.038 -3.690 11.866 1014 HB3 ALA 134 HB2 ALA 134 16.352 -4.027 12.314 1015 H SER 135 H SER 135 19.735 -5.853 14.454 1016 HA SER 135 HA SER 135 21.554 -3.926 15.538 1017 HB2 SER 135 HB2 SER 135 23.039 -6.056 15.488 1018 HB3 SER 135 HB3 SER 135 21.581 -6.037 16.492 1019 HG SER 135 HG SER 135 21.773 -7.963 15.298 1020 H SER 136 H SER 136 20.744 -4.383 12.293 1021 HA SER 136 HA SER 136 23.303 -3.261 11.394 1022 HB2 SER 136 HB2 SER 136 23.388 -4.987 9.550 1023 HB3 SER 136 HB3 SER 136 23.768 -5.587 11.168 1024 HG SER 136 HG SER 136 22.390 -6.998 10.111 1025 H GLU 137 H GLU 137 23.162 -2.268 9.331 1026 HA GLU 137 HA GLU 137 20.752 -0.930 8.624 1027 HB2 GLU 137 HB2 GLU 137 23.154 -0.295 8.118 1028 HB3 GLU 137 HB3 GLU 137 23.201 -1.582 6.912 1029 HG2 GLU 137 HG2 GLU 137 21.303 -0.420 5.717 1030 HG3 GLU 137 HG3 GLU 137 21.424 0.884 6.910 1031 H LYS 138 H LYS 138 22.270 -3.971 7.427 1032 HA LYS 138 HA LYS 138 20.509 -4.369 5.264 1033 HB2 LYS 138 HB2 LYS 138 21.495 -6.391 4.930 1034 HB3 LYS 138 HB3 LYS 138 22.738 -5.465 5.747 1035 HG2 LYS 138 HG2 LYS 138 22.974 -7.442 6.835 1036 HG3 LYS 138 HG3 LYS 138 21.810 -6.675 7.914 1037 HD2 LYS 138 HD2 LYS 138 19.965 -7.879 6.668 1038 HD3 LYS 138 HD3 LYS 138 21.179 -8.668 5.677 1039 HE2 LYS 138 HE2 LYS 138 20.981 -8.903 8.721 1040 HE3 LYS 138 HE3 LYS 138 20.284 -10.056 7.582 1041 HZ1 LYS 138 HZ3 LYS 138 22.416 -10.820 8.365 1042 HZ2 LYS 138 HZ1 LYS 138 22.517 -10.530 6.769 1043 HZ3 LYS 138 HZ2 LYS 138 23.181 -9.484 7.839 1044 H GLN 139 H GLN 139 20.060 -5.193 8.668 1045 HA GLN 139 HA GLN 139 17.685 -6.749 8.287 1046 HB2 GLN 139 HB2 GLN 139 19.055 -5.416 10.562 1047 HB3 GLN 139 HB3 GLN 139 17.296 -5.505 10.720 1048 HG2 GLN 139 HG2 GLN 139 17.201 -7.789 10.646 1049 HG3 GLN 139 HG3 GLN 139 18.856 -7.969 9.999 1050 HE21 GLN 139 HE22 GLN 139 20.628 -6.883 11.552 1051 HE22 GLN 139 HE21 GLN 139 20.469 -7.355 13.228 1052 H LEU 140 H LEU 140 18.195 -3.199 8.674 1053 HA LEU 140 HA LEU 140 15.381 -2.573 8.807 1054 HB2 LEU 140 HB2 LEU 140 17.914 -1.002 8.222 1055 HB3 LEU 140 HB3 LEU 140 16.351 -0.239 8.143 1056 HG LEU 140 HG LEU 140 16.739 -1.800 10.621 1057 HD11 LEU 140 HD11 LEU 140 18.256 -0.277 11.730 1058 HD12 LEU 140 HD12 LEU 140 19.049 -1.007 10.342 1059 HD13 LEU 140 HD13 LEU 140 18.458 0.671 10.233 1060 HD21 LEU 140 HD23 LEU 140 14.853 -0.270 10.234 1061 HD22 LEU 140 HD21 LEU 140 15.722 -0.040 11.747 1062 HD23 LEU 140 HD22 LEU 140 15.987 1.096 10.405 1063 H ALA 141 H ALA 141 17.777 -2.447 6.121 1064 HA ALA 141 HA ALA 141 15.997 -2.018 4.002 1065 HB1 ALA 141 HB3 ALA 141 17.745 -2.967 2.574 1066 HB2 ALA 141 HB1 ALA 141 18.482 -1.946 3.819 1067 HB3 ALA 141 HB2 ALA 141 18.531 -3.714 3.978 1068 H ASP 142 H ASP 142 16.760 -5.184 5.573 1069 HA ASP 142 HA ASP 142 15.450 -6.770 3.617 1070 HB2 ASP 142 HB2 ASP 142 16.931 -7.815 5.219 1071 HB3 ASP 142 HB3 ASP 142 15.936 -7.274 6.574 1072 H ILE 143 H ILE 143 14.253 -5.227 6.653 1073 HA ILE 143 HA ILE 143 11.629 -6.284 6.452 1074 HB ILE 143 HB ILE 143 12.894 -3.959 7.935 1075 HG12 ILE 143 HG12 ILE 143 11.920 -6.661 9.005 1076 HG13 ILE 143 HG13 ILE 143 13.565 -6.438 8.439 1077 HG21 ILE 143 HG21 ILE 143 10.109 -5.152 8.209 1078 HG22 ILE 143 HG22 ILE 143 10.860 -4.061 9.392 1079 HG23 ILE 143 HG23 ILE 143 10.531 -3.484 7.752 1080 HD11 ILE 143 HD13 ILE 143 12.278 -5.121 10.839 1081 HD12 ILE 143 HD11 ILE 143 13.686 -6.207 10.765 1082 HD13 ILE 143 HD12 ILE 143 13.824 -4.563 10.136 1083 H ILE 144 H ILE 144 13.178 -3.332 5.165 1084 HA ILE 144 HA ILE 144 10.819 -2.234 3.941 1085 HB ILE 144 HB ILE 144 13.757 -2.129 3.118 1086 HG12 ILE 144 HG12 ILE 144 13.414 -0.856 5.085 1087 HG13 ILE 144 HG13 ILE 144 13.574 0.274 3.749 1088 HG21 ILE 144 HG21 ILE 144 13.192 -0.312 1.545 1089 HG22 ILE 144 HG22 ILE 144 12.584 -1.879 1.035 1090 HG23 ILE 144 HG23 ILE 144 11.468 -0.695 1.738 1091 HD11 ILE 144 HD13 ILE 144 11.774 1.103 5.034 1092 HD12 ILE 144 HD11 ILE 144 10.967 0.258 3.692 1093 HD13 ILE 144 HD12 ILE 144 11.108 -0.512 5.292 1094 H SER 145 H SER 145 13.231 -4.543 2.703 1095 HA SER 145 HA SER 145 12.050 -4.773 0.178 1096 HB2 SER 145 HB2 SER 145 13.758 -6.841 1.634 1097 HB3 SER 145 HB3 SER 145 13.492 -6.749 -0.114 1098 HG SER 145 HG SER 145 14.820 -4.860 1.560 1099 H ARG 146 H ARG 146 11.332 -6.502 3.181 1100 HA ARG 146 HA ARG 146 9.725 -8.571 2.295 1101 HB2 ARG 146 HB2 ARG 146 10.635 -7.515 4.687 1102 HB3 ARG 146 HB3 ARG 146 8.936 -7.064 4.777 1103 HG2 ARG 146 HG2 ARG 146 8.326 -9.441 4.385 1104 HG3 ARG 146 HG3 ARG 146 10.059 -9.842 4.271 1105 HD2 ARG 146 HD2 ARG 146 8.812 -8.487 6.701 1106 HD3 ARG 146 HD3 ARG 146 8.926 -10.254 6.539 1107 HE ARG 146 HE ARG 146 11.504 -9.122 6.079 1108 HH11 ARG 146 HH11 ARG 146 9.226 -9.735 8.724 1109 HH12 ARG 146 HH12 ARG 146 10.452 -9.843 9.946 1110 HH21 ARG 146 HH21 ARG 146 13.125 -9.298 7.646 1111 HH22 ARG 146 HH22 ARG 146 12.724 -9.607 9.316 1112 H GLY 147 H GLY 147 8.991 -5.135 2.360 1113 HA2 GLY 147 HA2 GLY 147 6.105 -5.433 2.617 1114 HA3 GLY 147 HA3 GLY 147 7.026 -3.952 2.322 Start of MODEL 18 1 H MET 1 H1 MET 1 1.639 -1.778 -0.393 2 HA MET 1 HA MET 1 2.226 -2.301 -3.226 3 HB2 MET 1 HB2 MET 1 3.215 -0.070 -3.338 4 HB3 MET 1 HB3 MET 1 1.471 -0.009 -3.103 5 HG2 MET 1 HG2 MET 1 3.507 0.319 -0.865 6 HG3 MET 1 HG3 MET 1 2.889 1.660 -1.810 7 HE1 MET 1 HE3 MET 1 0.762 2.905 -1.458 8 HE2 MET 1 HE1 MET 1 -0.143 1.534 -2.137 9 HE3 MET 1 HE2 MET 1 -0.672 2.282 -0.614 10 H ARG 2 H ARG 2 4.498 -2.136 -3.822 11 HA ARG 2 HA ARG 2 6.204 -3.465 -1.899 12 HB2 ARG 2 HB2 ARG 2 6.715 -2.239 -4.647 13 HB3 ARG 2 HB3 ARG 2 8.015 -2.827 -3.619 14 HG2 ARG 2 HG2 ARG 2 7.582 -4.574 -5.103 15 HG3 ARG 2 HG3 ARG 2 6.913 -5.086 -3.548 16 HD2 ARG 2 HD2 ARG 2 4.643 -4.539 -4.333 17 HD3 ARG 2 HD3 ARG 2 5.315 -3.899 -5.853 18 HE ARG 2 HE ARG 2 6.156 -6.607 -5.410 19 HH11 ARG 2 HH11 ARG 2 3.306 -4.753 -6.443 20 HH12 ARG 2 HH12 ARG 2 2.626 -6.043 -7.363 21 HH21 ARG 2 HH21 ARG 2 5.252 -8.322 -6.642 22 HH22 ARG 2 HH22 ARG 2 3.762 -8.114 -7.478 23 H LEU 3 H LEU 3 6.864 -2.389 -0.136 24 HA LEU 3 HA LEU 3 7.198 0.466 0.059 25 HB2 LEU 3 HB2 LEU 3 8.357 -1.858 1.608 26 HB3 LEU 3 HB3 LEU 3 8.920 -0.202 1.846 27 HG LEU 3 HG LEU 3 7.197 -1.103 3.483 28 HD11 LEU 3 HD11 LEU 3 6.714 1.554 2.082 29 HD12 LEU 3 HD12 LEU 3 6.235 1.114 3.741 30 HD13 LEU 3 HD13 LEU 3 7.936 1.214 3.319 31 HD21 LEU 3 HD23 LEU 3 4.843 -0.865 2.945 32 HD22 LEU 3 HD21 LEU 3 5.220 -0.469 1.260 33 HD23 LEU 3 HD22 LEU 3 5.578 -2.075 1.889 34 H SER 4 H SER 4 9.347 -2.194 -1.024 35 HA SER 4 HA SER 4 11.752 -0.901 -1.006 36 HB2 SER 4 HB2 SER 4 11.040 -2.711 -3.312 37 HB3 SER 4 HB3 SER 4 12.486 -2.717 -2.282 38 HG SER 4 HG SER 4 11.026 -4.479 -1.922 39 H ASP 5 H ASP 5 9.039 -0.036 -3.054 40 HA ASP 5 HA ASP 5 10.504 1.023 -5.272 41 HB2 ASP 5 HB2 ASP 5 8.094 0.458 -5.320 42 HB3 ASP 5 HB3 ASP 5 7.772 1.750 -4.159 43 H TYR 6 H TYR 6 9.977 2.189 -1.999 44 HA TYR 6 HA TYR 6 10.386 4.998 -2.816 45 HB2 TYR 6 HB2 TYR 6 9.583 3.866 -0.132 46 HB3 TYR 6 HB3 TYR 6 9.552 5.560 -0.600 47 HD1 TYR 6 HD1 TYR 6 7.782 6.519 -1.911 48 HD2 TYR 6 HD2 TYR 6 7.765 2.359 -0.776 49 HE1 TYR 6 HE1 TYR 6 5.450 6.317 -2.719 50 HE2 TYR 6 HE2 TYR 6 5.432 2.144 -1.575 51 HH TYR 6 HH TYR 6 3.629 4.891 -3.034 52 H PHE 7 H PHE 7 12.585 2.572 -1.765 53 HA PHE 7 HA PHE 7 14.097 4.563 -0.098 54 HB2 PHE 7 HB2 PHE 7 14.037 1.551 0.157 55 HB3 PHE 7 HB3 PHE 7 15.111 2.631 1.034 56 HD1 PHE 7 HD1 PHE 7 11.497 1.921 0.424 57 HD2 PHE 7 HD2 PHE 7 14.396 3.445 3.238 58 HE1 PHE 7 HE1 PHE 7 9.689 2.373 2.039 59 HE2 PHE 7 HE2 PHE 7 12.549 4.031 4.771 60 HZ PHE 7 HZ PHE 7 10.229 3.435 4.227 61 HA PRO 8 HA PRO 8 16.287 4.403 -4.113 62 HB2 PRO 8 HB2 PRO 8 17.903 6.439 -2.564 63 HB3 PRO 8 HB3 PRO 8 17.480 6.415 -4.300 64 HG2 PRO 8 HG2 PRO 8 16.042 7.866 -2.476 65 HG3 PRO 8 HG3 PRO 8 15.244 7.017 -3.839 66 HD2 PRO 8 HD2 PRO 8 15.232 6.296 -0.963 67 HD3 PRO 8 HD3 PRO 8 14.079 5.938 -2.280 68 H GLU 9 H GLU 9 18.624 4.884 -1.454 69 HA GLU 9 HA GLU 9 19.938 2.338 -1.850 70 HB2 GLU 9 HB2 GLU 9 20.621 3.448 -3.949 71 HB3 GLU 9 HB3 GLU 9 21.156 4.864 -3.052 72 HG2 GLU 9 HG2 GLU 9 22.993 3.604 -2.056 73 HG3 GLU 9 HG3 GLU 9 22.359 2.084 -2.698 74 H SER 10 H SER 10 21.430 5.477 -1.130 75 HA SER 10 HA SER 10 22.521 4.672 1.349 76 HB2 SER 10 HB2 SER 10 21.908 7.553 0.666 77 HB3 SER 10 HB3 SER 10 23.372 6.879 1.390 78 HG SER 10 HG SER 10 23.953 6.088 -0.645 79 H SER 11 H SER 11 19.415 4.699 0.830 80 HA SER 11 HA SER 11 18.255 6.703 2.517 81 HB2 SER 11 HB2 SER 11 16.996 4.241 1.275 82 HB3 SER 11 HB3 SER 11 16.222 5.796 1.635 83 HG SER 11 HG SER 11 17.443 6.746 0.018 84 H ILE 12 H ILE 12 19.843 3.878 3.528 85 HA ILE 12 HA ILE 12 17.959 3.438 5.773 86 HB ILE 12 HB ILE 12 19.372 1.445 3.983 87 HG12 ILE 12 HG12 ILE 12 16.479 2.372 4.322 88 HG13 ILE 12 HG13 ILE 12 17.456 2.385 2.853 89 HG21 ILE 12 HG21 ILE 12 19.353 0.798 6.373 90 HG22 ILE 12 HG22 ILE 12 17.599 1.068 6.433 91 HG23 ILE 12 HG23 ILE 12 18.299 -0.238 5.435 92 HD11 ILE 12 HD13 ILE 12 16.336 -0.021 4.241 93 HD12 ILE 12 HD11 ILE 12 15.825 0.685 2.691 94 HD13 ILE 12 HD12 ILE 12 17.432 -0.051 2.812 95 H SER 13 H SER 13 19.089 3.499 7.760 96 HA SER 13 HA SER 13 21.979 2.935 7.866 97 HB2 SER 13 HB2 SER 13 20.785 5.668 8.530 98 HB3 SER 13 HB3 SER 13 22.422 5.148 8.967 99 HG SER 13 HG SER 13 21.849 4.729 6.333 100 H VAL 14 H VAL 14 22.727 2.557 9.920 101 HA VAL 14 HA VAL 14 20.795 2.630 12.190 102 HB VAL 14 HB VAL 14 22.987 0.590 11.607 103 HG11 VAL 14 HG11 VAL 14 22.214 -0.542 13.697 104 HG12 VAL 14 HG12 VAL 14 22.919 1.037 14.033 105 HG13 VAL 14 HG13 VAL 14 21.152 0.841 14.044 106 HG21 VAL 14 HG23 VAL 14 19.972 0.250 11.859 107 HG22 VAL 14 HG21 VAL 14 20.907 0.141 10.351 108 HG23 VAL 14 HG22 VAL 14 21.141 -1.058 11.627 109 H ILE 15 H ILE 15 21.630 3.578 14.036 110 HA ILE 15 HA ILE 15 24.300 4.870 13.940 111 HB ILE 15 HB ILE 15 21.634 6.191 14.601 112 HG12 ILE 15 HG12 ILE 15 23.245 6.428 12.032 113 HG13 ILE 15 HG13 ILE 15 21.570 5.886 12.216 114 HG21 ILE 15 HG21 ILE 15 22.814 8.235 14.826 115 HG22 ILE 15 HG22 ILE 15 23.748 7.071 15.710 116 HG23 ILE 15 HG23 ILE 15 24.305 7.554 14.109 117 HD11 ILE 15 HD13 ILE 15 21.024 8.209 13.115 118 HD12 ILE 15 HD11 ILE 15 22.640 8.710 12.602 119 HD13 ILE 15 HD12 ILE 15 21.478 8.131 11.393 120 H HIS 16 H HIS 16 25.149 5.151 16.111 121 HA HIS 16 HA HIS 16 23.964 3.593 18.244 122 HB2 HIS 16 HB2 HIS 16 26.399 4.040 17.998 123 HB3 HIS 16 HB3 HIS 16 26.117 5.752 18.311 124 HD1 HIS 16 HD1 HIS 16 25.465 6.390 20.891 125 HD2 HIS 16 HD2 HIS 16 26.429 2.371 20.078 126 HE1 HIS 16 HE1 HIS 16 25.980 5.297 23.145 127 H SER 17 H SER 17 24.062 7.115 17.430 128 HA SER 17 HA SER 17 21.602 7.744 18.689 129 HB2 SER 17 HB2 SER 17 22.943 9.447 20.282 130 HB3 SER 17 HB3 SER 17 22.389 7.866 20.808 131 HG SER 17 HG SER 17 25.012 8.586 20.029 132 H ALA 18 H ALA 18 21.085 9.984 18.080 133 HA ALA 18 HA ALA 18 22.770 10.965 15.855 134 HB1 ALA 18 HB3 ALA 18 20.348 10.967 15.492 135 HB2 ALA 18 HB1 ALA 18 20.112 11.952 16.970 136 HB3 ALA 18 HB2 ALA 18 20.951 12.621 15.559 137 H LYS 19 H LYS 19 23.493 13.184 15.895 138 HA LYS 19 HA LYS 19 24.908 13.928 18.198 139 HB2 LYS 19 HB2 LYS 19 25.199 14.520 15.734 140 HB3 LYS 19 HB3 LYS 19 24.105 15.864 16.043 141 HG2 LYS 19 HG2 LYS 19 25.580 16.816 17.738 142 HG3 LYS 19 HG3 LYS 19 26.536 15.326 17.812 143 HD2 LYS 19 HD2 LYS 19 27.856 16.787 16.558 144 HD3 LYS 19 HD3 LYS 19 27.134 15.644 15.420 145 HE2 LYS 19 HE2 LYS 19 25.255 17.618 15.306 146 HE3 LYS 19 HE3 LYS 19 26.631 18.604 15.811 147 HZ1 LYS 19 HZ3 LYS 19 27.809 17.646 13.827 148 HZ2 LYS 19 HZ1 LYS 19 26.378 16.934 13.385 149 HZ3 LYS 19 HZ2 LYS 19 26.512 18.564 13.440 150 H ASP 20 H ASP 20 21.672 14.845 17.099 151 HA ASP 20 HA ASP 20 20.712 15.443 19.690 152 HB2 ASP 20 HB2 ASP 20 21.813 17.717 19.000 153 HB3 ASP 20 HB3 ASP 20 20.621 17.715 17.677 154 H TRP 21 H TRP 21 18.277 16.370 19.182 155 HA TRP 21 HA TRP 21 17.066 14.611 17.264 156 HB2 TRP 21 HB2 TRP 21 15.002 15.587 17.861 157 HB3 TRP 21 HB3 TRP 21 15.952 15.428 19.329 158 HD1 TRP 21 HD1 TRP 21 16.687 17.733 20.513 159 HE1 TRP 21 HE1 TRP 21 16.049 20.186 20.181 160 HE3 TRP 21 HE3 TRP 21 14.229 17.268 16.082 161 HZ2 TRP 21 HZ2 TRP 21 14.718 21.792 18.117 162 HZ3 TRP 21 HZ3 TRP 21 13.378 19.244 14.905 163 HH2 TRP 21 HH2 TRP 21 13.630 21.520 15.884 164 H GLN 22 H GLN 22 18.068 18.030 17.117 165 HA GLN 22 HA GLN 22 17.123 18.828 14.530 166 HB2 GLN 22 HB2 GLN 22 19.739 19.404 15.983 167 HB3 GLN 22 HB3 GLN 22 19.146 20.256 14.553 168 HG2 GLN 22 HG2 GLN 22 17.161 21.030 15.777 169 HG3 GLN 22 HG3 GLN 22 17.638 20.110 17.204 170 HE21 GLN 22 HE22 GLN 22 19.443 20.794 18.490 171 HE22 GLN 22 HE21 GLN 22 20.079 22.429 18.346 172 H GLU 23 H GLU 23 20.059 16.901 15.519 173 HA GLU 23 HA GLU 23 20.908 16.508 12.787 174 HB2 GLU 23 HB2 GLU 23 22.302 16.367 14.968 175 HB3 GLU 23 HB3 GLU 23 21.571 14.768 15.169 176 HG2 GLU 23 HG2 GLU 23 23.533 14.199 14.099 177 HG3 GLU 23 HG3 GLU 23 22.466 14.318 12.728 178 H ALA 24 H ALA 24 18.860 14.722 15.079 179 HA ALA 24 HA ALA 24 18.755 12.298 13.607 180 HB1 ALA 24 HB3 ALA 24 16.983 11.702 15.107 181 HB2 ALA 24 HB1 ALA 24 18.148 12.700 16.008 182 HB3 ALA 24 HB2 ALA 24 16.618 13.405 15.459 183 H ILE 25 H ILE 25 16.766 15.292 13.372 184 HA ILE 25 HA ILE 25 15.016 14.256 11.322 185 HB ILE 25 HB ILE 25 15.939 17.115 11.677 186 HG12 ILE 25 HG12 ILE 25 14.427 15.643 13.577 187 HG13 ILE 25 HG13 ILE 25 14.867 17.340 13.564 188 HG21 ILE 25 HG21 ILE 25 14.881 16.624 9.496 189 HG22 ILE 25 HG22 ILE 25 13.460 15.974 10.310 190 HG23 ILE 25 HG23 ILE 25 13.879 17.700 10.434 191 HD11 ILE 25 HD13 ILE 25 12.357 16.122 12.384 192 HD12 ILE 25 HD11 ILE 25 12.473 17.042 13.895 193 HD13 ILE 25 HD12 ILE 25 12.749 17.865 12.351 194 H ASP 26 H ASP 26 18.186 16.041 11.236 195 HA ASP 26 HA ASP 26 18.376 16.148 8.412 196 HB2 ASP 26 HB2 ASP 26 19.873 17.432 9.834 197 HB3 ASP 26 HB3 ASP 26 20.610 15.958 10.461 198 H PHE 27 H PHE 27 19.444 13.565 10.681 199 HA PHE 27 HA PHE 27 20.367 11.788 8.660 200 HB2 PHE 27 HB2 PHE 27 19.580 11.523 11.566 201 HB3 PHE 27 HB3 PHE 27 19.775 10.080 10.595 202 HD1 PHE 27 HD1 PHE 27 21.933 10.017 9.052 203 HD2 PHE 27 HD2 PHE 27 21.655 12.220 12.787 204 HE1 PHE 27 HE1 PHE 27 24.390 9.916 9.317 205 HE2 PHE 27 HE2 PHE 27 24.088 12.076 13.023 206 HZ PHE 27 HZ PHE 27 25.474 10.942 11.307 207 H SER 28 H SER 28 17.038 12.426 9.892 208 HA SER 28 HA SER 28 15.860 10.151 8.560 209 HB2 SER 28 HB2 SER 28 14.506 12.797 9.335 210 HB3 SER 28 HB3 SER 28 13.708 11.287 8.962 211 HG SER 28 HG SER 28 15.544 11.707 11.109 212 H MET 29 H MET 29 17.098 13.227 7.370 213 HA MET 29 HA MET 29 15.506 12.907 4.864 214 HB2 MET 29 HB2 MET 29 16.753 15.356 6.116 215 HB3 MET 29 HB3 MET 29 15.621 15.293 4.756 216 HG2 MET 29 HG2 MET 29 14.654 14.317 7.425 217 HG3 MET 29 HG3 MET 29 14.881 16.034 7.155 218 HE1 MET 29 HE3 MET 29 13.428 13.004 4.996 219 HE2 MET 29 HE1 MET 29 12.817 13.000 6.674 220 HE3 MET 29 HE2 MET 29 11.704 13.353 5.330 221 H VAL 30 H VAL 30 18.899 13.289 5.958 222 HA VAL 30 HA VAL 30 19.814 14.648 3.739 223 HB VAL 30 HB VAL 30 21.103 14.355 5.780 224 HG11 VAL 30 HG11 VAL 30 20.680 11.930 6.223 225 HG12 VAL 30 HG12 VAL 30 21.736 11.515 4.855 226 HG13 VAL 30 HG13 VAL 30 22.396 12.349 6.274 227 HG21 VAL 30 HG23 VAL 30 22.629 13.354 3.336 228 HG22 VAL 30 HG21 VAL 30 22.216 15.042 3.674 229 HG23 VAL 30 HG22 VAL 30 23.312 14.169 4.761 230 H SER 31 H SER 31 19.392 11.077 4.008 231 HA SER 31 HA SER 31 20.681 10.515 1.573 232 HB2 SER 31 HB2 SER 31 18.412 8.989 2.893 233 HB3 SER 31 HB3 SER 31 19.622 8.351 1.759 234 HG SER 31 HG SER 31 20.572 7.888 3.587 235 H LEU 32 H LEU 32 17.566 11.984 2.128 236 HA LEU 32 HA LEU 32 16.661 11.515 -0.656 237 HB2 LEU 32 HB2 LEU 32 15.471 12.995 1.740 238 HB3 LEU 32 HB3 LEU 32 14.753 13.066 0.155 239 HG LEU 32 HG LEU 32 15.241 10.471 1.657 240 HD11 LEU 32 HD11 LEU 32 12.827 10.489 2.164 241 HD12 LEU 32 HD12 LEU 32 13.662 11.864 2.902 242 HD13 LEU 32 HD13 LEU 32 12.683 12.103 1.439 243 HD21 LEU 32 HD23 LEU 32 13.734 9.461 0.062 244 HD22 LEU 32 HD21 LEU 32 13.423 11.017 -0.729 245 HD23 LEU 32 HD22 LEU 32 15.014 10.223 -0.842 246 H LEU 33 H LEU 33 17.866 14.108 1.522 247 HA LEU 33 HA LEU 33 17.673 16.245 -0.216 248 HB2 LEU 33 HB2 LEU 33 18.288 16.311 2.216 249 HB3 LEU 33 HB3 LEU 33 19.892 15.723 1.792 250 HG LEU 33 HG LEU 33 20.323 17.783 0.485 251 HD11 LEU 33 HD11 LEU 33 18.802 19.688 0.600 252 HD12 LEU 33 HD12 LEU 33 18.029 18.354 -0.212 253 HD13 LEU 33 HD13 LEU 33 17.600 18.715 1.478 254 HD21 LEU 33 HD23 LEU 33 20.558 19.265 2.400 255 HD22 LEU 33 HD21 LEU 33 19.411 18.281 3.333 256 HD23 LEU 33 HD22 LEU 33 20.971 17.608 2.835 257 H ASP 34 H ASP 34 20.293 13.891 0.189 258 HA ASP 34 HA ASP 34 22.221 15.108 -1.432 259 HB2 ASP 34 HB2 ASP 34 22.809 13.508 0.295 260 HB3 ASP 34 HB3 ASP 34 21.776 12.270 -0.415 261 H LYS 35 H LYS 35 19.569 13.083 -2.436 262 HA LYS 35 HA LYS 35 20.664 13.319 -5.205 263 HB2 LYS 35 HB2 LYS 35 18.612 11.247 -4.477 264 HB3 LYS 35 HB3 LYS 35 19.532 11.395 -5.957 265 HG2 LYS 35 HG2 LYS 35 20.481 9.553 -4.949 266 HG3 LYS 35 HG3 LYS 35 21.624 10.838 -4.513 267 HD2 LYS 35 HD2 LYS 35 20.721 10.955 -2.271 268 HD3 LYS 35 HD3 LYS 35 19.290 10.038 -2.736 269 HE2 LYS 35 HE2 LYS 35 20.684 8.701 -1.368 270 HE3 LYS 35 HE3 LYS 35 20.610 8.006 -2.988 271 HZ1 LYS 35 HZ3 LYS 35 22.816 8.753 -3.413 272 HZ2 LYS 35 HZ1 LYS 35 22.881 8.114 -1.905 273 HZ3 LYS 35 HZ2 LYS 35 22.858 9.753 -2.120 274 H ASN 36 H ASN 36 19.205 15.222 -3.545 275 HA ASN 36 HA ASN 36 17.702 16.840 -3.931 276 HB2 ASN 36 HB2 ASN 36 19.120 16.753 -6.075 277 HB3 ASN 36 HB3 ASN 36 17.753 15.953 -6.851 278 HD21 ASN 36 HD21 ASN 36 18.415 18.730 -4.741 279 HD22 ASN 36 HD22 ASN 36 17.379 19.874 -5.582 280 H TYR 37 H TYR 37 16.510 14.172 -3.234 281 HA TYR 37 HA TYR 37 13.887 14.125 -4.517 282 HB2 TYR 37 HB2 TYR 37 15.009 12.918 -1.973 283 HB3 TYR 37 HB3 TYR 37 13.317 12.802 -2.391 284 HD1 TYR 37 HD1 TYR 37 16.741 11.522 -3.212 285 HD2 TYR 37 HD2 TYR 37 12.510 11.314 -4.073 286 HE1 TYR 37 HE1 TYR 37 17.127 9.598 -4.707 287 HE2 TYR 37 HE2 TYR 37 12.912 9.406 -5.594 288 HH TYR 37 HH TYR 37 16.201 8.125 -6.257 289 H ILE 38 H ILE 38 15.438 16.081 -2.117 290 HA ILE 38 HA ILE 38 13.010 17.684 -1.716 291 HB ILE 38 HB ILE 38 13.482 17.842 0.724 292 HG12 ILE 38 HG12 ILE 38 15.416 15.539 0.248 293 HG13 ILE 38 HG13 ILE 38 15.878 17.208 0.594 294 HG21 ILE 38 HG21 ILE 38 12.498 15.714 1.422 295 HG22 ILE 38 HG22 ILE 38 11.739 16.281 -0.049 296 HG23 ILE 38 HG23 ILE 38 12.937 14.968 -0.116 297 HD11 ILE 38 HD13 ILE 38 14.470 15.326 2.499 298 HD12 ILE 38 HD11 ILE 38 16.145 15.892 2.523 299 HD13 ILE 38 HD12 ILE 38 14.825 17.052 2.813 300 H SER 39 H SER 39 13.853 19.695 -0.340 301 HA SER 39 HA SER 39 16.615 20.483 -1.112 302 HB2 SER 39 HB2 SER 39 15.646 22.843 -1.231 303 HB3 SER 39 HB3 SER 39 15.267 21.754 -2.568 304 HG SER 39 HG SER 39 13.239 21.341 -1.574 305 H GLU 40 H GLU 40 17.502 22.116 0.429 306 HA GLU 40 HA GLU 40 17.529 21.004 2.952 307 HB2 GLU 40 HB2 GLU 40 18.342 23.862 2.306 308 HB3 GLU 40 HB3 GLU 40 18.883 22.868 3.655 309 HG2 GLU 40 HG2 GLU 40 20.680 22.591 2.314 310 HG3 GLU 40 HG3 GLU 40 19.748 21.226 1.741 311 H ASN 41 H ASN 41 15.411 23.657 1.905 312 HA ASN 41 HA ASN 41 14.588 24.556 4.486 313 HB2 ASN 41 HB2 ASN 41 14.036 25.746 2.374 314 HB3 ASN 41 HB3 ASN 41 12.987 24.410 1.882 315 HD21 ASN 41 HD22 ASN 41 10.867 24.207 2.868 316 HD22 ASN 41 HD21 ASN 41 10.252 25.453 3.932 317 H TYR 42 H TYR 42 13.639 21.689 2.608 318 HA TYR 42 HA TYR 42 11.172 21.130 3.884 319 HB2 TYR 42 HB2 TYR 42 12.075 20.146 1.756 320 HB3 TYR 42 HB3 TYR 42 13.229 19.222 2.710 321 HD1 TYR 42 HD2 TYR 42 9.614 19.677 1.977 322 HD2 TYR 42 HD1 TYR 42 12.622 17.189 3.797 323 HE1 TYR 42 HE2 TYR 42 7.990 17.787 2.088 324 HE2 TYR 42 HE1 TYR 42 11.020 15.304 3.897 325 HH TYR 42 HH TYR 42 8.936 14.533 3.272 326 H ILE 43 H ILE 43 14.535 20.189 4.697 327 HA ILE 43 HA ILE 43 13.943 18.564 6.953 328 HB ILE 43 HB ILE 43 16.380 20.277 6.247 329 HG12 ILE 43 HG12 ILE 43 17.101 17.607 6.030 330 HG13 ILE 43 HG13 ILE 43 15.423 17.565 5.480 331 HG21 ILE 43 HG21 ILE 43 16.396 19.857 8.651 332 HG22 ILE 43 HG22 ILE 43 16.154 18.110 8.370 333 HG23 ILE 43 HG23 ILE 43 17.651 18.914 7.845 334 HD11 ILE 43 HD13 ILE 43 17.036 17.851 3.655 335 HD12 ILE 43 HD11 ILE 43 15.947 19.249 3.763 336 HD13 ILE 43 HD12 ILE 43 17.614 19.355 4.393 337 H GLN 44 H GLN 44 14.657 22.122 6.755 338 HA GLN 44 HA GLN 44 14.312 22.404 9.588 339 HB2 GLN 44 HB2 GLN 44 15.020 24.161 7.338 340 HB3 GLN 44 HB3 GLN 44 13.960 24.979 8.486 341 HG2 GLN 44 HG2 GLN 44 16.411 23.391 9.290 342 HG3 GLN 44 HG3 GLN 44 16.437 25.132 9.002 343 HE21 GLN 44 HE22 GLN 44 16.533 23.085 11.651 344 HE22 GLN 44 HE21 GLN 44 15.493 23.941 12.736 345 H ALA 45 H ALA 45 12.026 22.607 6.957 346 HA ALA 45 HA ALA 45 9.867 23.819 8.301 347 HB1 ALA 45 HB3 ALA 45 8.374 22.564 6.831 348 HB2 ALA 45 HB1 ALA 45 9.798 23.098 5.911 349 HB3 ALA 45 HB2 ALA 45 9.643 21.402 6.445 350 H ILE 46 H ILE 46 11.037 20.430 8.551 351 HA ILE 46 HA ILE 46 8.890 19.566 10.265 352 HB ILE 46 HB ILE 46 11.679 18.390 9.903 353 HG12 ILE 46 HG12 ILE 46 9.197 17.487 8.406 354 HG13 ILE 46 HG13 ILE 46 10.293 18.664 7.719 355 HG21 ILE 46 HG21 ILE 46 10.667 16.299 10.660 356 HG22 ILE 46 HG22 ILE 46 10.356 17.547 11.869 357 HG23 ILE 46 HG23 ILE 46 9.066 17.053 10.753 358 HD11 ILE 46 HD13 ILE 46 10.829 16.482 6.851 359 HD12 ILE 46 HD11 ILE 46 12.170 17.113 7.826 360 HD13 ILE 46 HD12 ILE 46 11.119 15.843 8.478 361 H LYS 47 H LYS 47 12.282 20.694 10.743 362 HA LYS 47 HA LYS 47 12.245 20.259 13.535 363 HB2 LYS 47 HB2 LYS 47 13.846 22.193 11.821 364 HB3 LYS 47 HB3 LYS 47 14.236 21.853 13.511 365 HG2 LYS 47 HG2 LYS 47 14.778 19.552 13.012 366 HG3 LYS 47 HG3 LYS 47 14.196 19.706 11.344 367 HD2 LYS 47 HD2 LYS 47 15.933 21.308 10.813 368 HD3 LYS 47 HD3 LYS 47 16.495 21.302 12.518 369 HE2 LYS 47 HE2 LYS 47 16.965 18.883 12.286 370 HE3 LYS 47 HE3 LYS 47 16.575 18.958 10.576 371 HZ1 LYS 47 HZ3 LYS 47 18.761 20.536 11.853 372 HZ2 LYS 47 HZ1 LYS 47 18.980 19.129 11.079 373 HZ3 LYS 47 HZ2 LYS 47 18.467 20.445 10.248 374 H ASP 48 H ASP 48 11.446 23.184 11.629 375 HA ASP 48 HA ASP 48 11.110 24.985 13.776 376 HB2 ASP 48 HB2 ASP 48 11.261 25.699 11.447 377 HB3 ASP 48 HB3 ASP 48 9.770 24.839 11.047 378 H SER 49 H SER 49 8.806 22.721 12.209 379 HA SER 49 HA SER 49 6.538 23.363 13.856 380 HB2 SER 49 HB2 SER 49 7.286 20.782 12.441 381 HB3 SER 49 HB3 SER 49 5.664 21.250 12.986 382 HG SER 49 HG SER 49 7.242 22.255 10.863 383 H THR 50 H THR 50 9.194 20.923 14.190 384 HA THR 50 HA THR 50 8.292 19.805 16.598 385 HB THR 50 HB THR 50 11.160 20.112 15.676 386 HG1 THR 50 HG1 THR 50 9.889 19.133 14.073 387 HG21 THR 50 HG23 THR 50 9.823 18.063 17.495 388 HG22 THR 50 HG21 THR 50 11.489 17.969 16.888 389 HG23 THR 50 HG22 THR 50 11.026 19.279 17.982 390 H ILE 51 H ILE 51 10.347 22.747 16.108 391 HA ILE 51 HA ILE 51 10.662 23.263 18.912 392 HB ILE 51 HB ILE 51 10.859 24.988 16.416 393 HG12 ILE 51 HG12 ILE 51 13.067 24.051 18.301 394 HG13 ILE 51 HG13 ILE 51 12.514 23.067 16.962 395 HG21 ILE 51 HG21 ILE 51 10.327 26.538 18.248 396 HG22 ILE 51 HG22 ILE 51 11.585 25.802 19.267 397 HG23 ILE 51 HG23 ILE 51 12.016 26.708 17.801 398 HD11 ILE 51 HD13 ILE 51 13.094 24.874 15.357 399 HD12 ILE 51 HD11 ILE 51 13.771 25.821 16.705 400 HD13 ILE 51 HD12 ILE 51 14.484 24.260 16.271 401 H ASN 52 H ASN 52 8.264 24.466 16.504 402 HA ASN 52 HA ASN 52 7.067 26.321 18.344 403 HB2 ASN 52 HB2 ASN 52 6.335 25.248 15.601 404 HB3 ASN 52 HB3 ASN 52 5.161 26.181 16.503 405 HD21 ASN 52 HD22 ASN 52 8.397 26.366 15.044 406 HD22 ASN 52 HD21 ASN 52 8.466 28.111 14.987 407 H ASN 53 H ASN 53 6.278 22.981 17.481 408 HA ASN 53 HA ASN 53 3.819 23.101 19.201 409 HB2 ASN 53 HB2 ASN 53 3.497 23.176 16.695 410 HB3 ASN 53 HB3 ASN 53 4.227 21.582 16.580 411 HD21 ASN 53 HD22 ASN 53 1.376 22.904 16.291 412 HD22 ASN 53 HD21 ASN 53 0.336 21.730 17.062 413 H GLY 54 H GLY 54 6.142 20.854 17.609 414 HA2 GLY 54 HA2 GLY 54 7.390 19.518 19.510 415 HA3 GLY 54 HA3 GLY 54 5.768 18.865 19.776 416 HA PRO 55 HA PRO 55 7.876 16.378 16.306 417 HB2 PRO 55 HB2 PRO 55 7.502 13.936 17.631 418 HB3 PRO 55 HB3 PRO 55 9.021 14.865 17.592 419 HG2 PRO 55 HG2 PRO 55 6.884 14.819 19.716 420 HG3 PRO 55 HG3 PRO 55 8.669 14.817 19.924 421 HD2 PRO 55 HD2 PRO 55 7.190 17.053 20.251 422 HD3 PRO 55 HD3 PRO 55 8.810 17.116 19.488 423 H TYR 56 H TYR 56 6.355 16.139 14.799 424 HA TYR 56 HA TYR 56 3.542 15.622 15.651 425 HB2 TYR 56 HB2 TYR 56 2.803 17.225 14.099 426 HB3 TYR 56 HB3 TYR 56 4.056 17.958 15.073 427 HD1 TYR 56 HD1 TYR 56 6.525 17.944 14.007 428 HD2 TYR 56 HD2 TYR 56 2.844 17.538 11.780 429 HE1 TYR 56 HE1 TYR 56 7.700 18.597 11.947 430 HE2 TYR 56 HE2 TYR 56 3.989 18.330 9.741 431 HH TYR 56 HH TYR 56 5.997 19.028 8.806 432 H TYR 57 H TYR 57 5.848 13.899 14.320 433 HA TYR 57 HA TYR 57 3.912 12.307 12.771 434 HB2 TYR 57 HB2 TYR 57 6.631 13.139 11.789 435 HB3 TYR 57 HB3 TYR 57 5.937 11.566 11.396 436 HD1 TYR 57 HD2 TYR 57 3.750 11.351 10.226 437 HD2 TYR 57 HD1 TYR 57 5.792 15.132 10.616 438 HE1 TYR 57 HE2 TYR 57 2.231 12.334 8.537 439 HE2 TYR 57 HE1 TYR 57 4.326 16.101 8.878 440 HH TYR 57 HH TYR 57 1.608 14.283 7.392 441 H ILE 58 H ILE 58 3.577 10.967 14.466 442 HA ILE 58 HA ILE 58 5.789 9.408 15.619 443 HB ILE 58 HB ILE 58 3.766 11.030 17.226 444 HG12 ILE 58 HG12 ILE 58 5.838 12.273 16.636 445 HG13 ILE 58 HG13 ILE 58 5.612 12.051 18.361 446 HG21 ILE 58 HG21 ILE 58 5.546 8.734 18.156 447 HG22 ILE 58 HG22 ILE 58 4.781 9.906 19.255 448 HG23 ILE 58 HG23 ILE 58 3.781 8.856 18.252 449 HD11 ILE 58 HD13 ILE 58 7.480 10.346 16.663 450 HD12 ILE 58 HD11 ILE 58 7.980 11.722 17.653 451 HD13 ILE 58 HD12 ILE 58 7.305 10.285 18.428 452 H LEU 59 H LEU 59 5.140 7.333 15.807 453 HA LEU 59 HA LEU 59 2.328 6.715 14.980 454 HB2 LEU 59 HB2 LEU 59 4.929 5.341 14.185 455 HB3 LEU 59 HB3 LEU 59 3.320 4.776 13.801 456 HG LEU 59 HG LEU 59 4.115 5.724 11.842 457 HD11 LEU 59 HD11 LEU 59 2.343 7.909 12.975 458 HD12 LEU 59 HD12 LEU 59 2.557 7.452 11.278 459 HD13 LEU 59 HD13 LEU 59 1.774 6.328 12.397 460 HD21 LEU 59 HD23 LEU 59 4.943 8.009 11.558 461 HD22 LEU 59 HD21 LEU 59 4.926 8.286 13.271 462 HD23 LEU 59 HD22 LEU 59 6.010 7.056 12.598 463 H ALA 60 H ALA 60 5.010 5.915 17.122 464 HA ALA 60 HA ALA 60 3.274 4.498 18.900 465 HB1 ALA 60 HB3 ALA 60 5.562 2.958 17.558 466 HB2 ALA 60 HB1 ALA 60 4.607 2.380 18.930 467 HB3 ALA 60 HB2 ALA 60 3.831 2.613 17.359 468 HA PRO 61 HA PRO 61 6.424 6.112 21.719 469 HB2 PRO 61 HB2 PRO 61 6.616 3.307 22.844 470 HB3 PRO 61 HB3 PRO 61 6.518 4.868 23.716 471 HG2 PRO 61 HG2 PRO 61 4.315 3.319 23.459 472 HG3 PRO 61 HG3 PRO 61 4.194 5.091 23.205 473 HD2 PRO 61 HD2 PRO 61 4.387 2.902 21.128 474 HD3 PRO 61 HD3 PRO 61 3.322 4.341 21.156 475 H GLY 62 H GLY 62 8.392 6.579 20.881 476 HA2 GLY 62 HA2 GLY 62 10.652 6.190 20.499 477 HA3 GLY 62 HA3 GLY 62 10.373 4.447 20.417 478 H VAL 63 H VAL 63 8.046 5.879 18.382 479 HA VAL 63 HA VAL 63 9.796 5.420 16.007 480 HB VAL 63 HB VAL 63 6.933 4.497 16.474 481 HG11 VAL 63 HG11 VAL 63 7.219 3.215 14.377 482 HG12 VAL 63 HG12 VAL 63 7.412 4.944 14.106 483 HG13 VAL 63 HG13 VAL 63 8.850 3.904 14.181 484 HG21 VAL 63 HG23 VAL 63 8.456 3.142 17.860 485 HG22 VAL 63 HG21 VAL 63 7.838 2.204 16.515 486 HG23 VAL 63 HG22 VAL 63 9.495 2.842 16.450 487 H ALA 64 H ALA 64 9.882 7.146 14.750 488 HA ALA 64 HA ALA 64 7.587 9.032 14.598 489 HB1 ALA 64 HB3 ALA 64 9.212 10.845 14.337 490 HB2 ALA 64 HB1 ALA 64 9.595 9.965 15.821 491 HB3 ALA 64 HB2 ALA 64 10.557 9.686 14.353 492 H MET 65 H MET 65 7.628 10.295 12.527 493 HA MET 65 HA MET 65 8.999 8.915 10.320 494 HB2 MET 65 HB2 MET 65 6.764 7.974 10.398 495 HB3 MET 65 HB3 MET 65 6.069 9.586 10.140 496 HG2 MET 65 HG2 MET 65 7.610 9.558 7.992 497 HG3 MET 65 HG3 MET 65 7.676 7.824 8.281 498 HE1 MET 65 HE3 MET 65 4.370 7.730 9.504 499 HE2 MET 65 HE1 MET 65 3.727 7.006 8.021 500 HE3 MET 65 HE2 MET 65 5.276 6.429 8.676 501 HA PRO 66 HA PRO 66 9.051 13.574 10.769 502 HB2 PRO 66 HB2 PRO 66 11.993 13.405 10.150 503 HB3 PRO 66 HB3 PRO 66 11.166 14.279 11.473 504 HG2 PRO 66 HG2 PRO 66 12.556 11.999 11.937 505 HG3 PRO 66 HG3 PRO 66 11.035 12.360 12.813 506 HD2 PRO 66 HD2 PRO 66 11.418 10.600 10.371 507 HD3 PRO 66 HD3 PRO 66 10.535 10.243 11.882 508 H HIS 67 H HIS 67 8.440 14.664 9.046 509 HA HIS 67 HA HIS 67 9.465 14.724 6.398 510 HB2 HIS 67 HB2 HIS 67 8.598 12.883 5.522 511 HB3 HIS 67 HB3 HIS 67 7.933 12.385 7.024 512 HD1 HIS 67 HD1 HIS 67 5.356 12.894 7.505 513 HD2 HIS 67 HD2 HIS 67 6.779 13.717 3.598 514 HE1 HIS 67 HE1 HIS 67 3.319 12.989 5.979 515 H ALA 68 H ALA 68 7.785 16.003 4.992 516 HA ALA 68 HA ALA 68 6.053 17.763 6.652 517 HB1 ALA 68 HB3 ALA 68 8.300 18.722 4.844 518 HB2 ALA 68 HB1 ALA 68 7.089 19.739 5.648 519 HB3 ALA 68 HB2 ALA 68 8.251 18.837 6.614 520 H ARG 69 H ARG 69 4.908 19.328 5.090 521 HA ARG 69 HA ARG 69 3.411 17.851 3.131 522 HB2 ARG 69 HB2 ARG 69 3.762 20.802 3.806 523 HB3 ARG 69 HB3 ARG 69 2.724 20.293 2.471 524 HG2 ARG 69 HG2 ARG 69 1.376 18.910 4.037 525 HG3 ARG 69 HG3 ARG 69 2.403 19.435 5.385 526 HD2 ARG 69 HD2 ARG 69 1.744 21.811 4.925 527 HD3 ARG 69 HD3 ARG 69 0.705 21.249 3.616 528 HE ARG 69 HE ARG 69 -0.845 20.433 5.110 529 HH11 ARG 69 HH11 ARG 69 1.998 21.546 6.931 530 HH12 ARG 69 HH12 ARG 69 1.214 21.480 8.466 531 HH21 ARG 69 HH21 ARG 69 -1.885 20.348 7.151 532 HH22 ARG 69 HH22 ARG 69 -1.044 20.786 8.588 533 HA PRO 70 HA PRO 70 6.034 17.818 -0.391 534 HB2 PRO 70 HB2 PRO 70 4.374 18.750 -2.471 535 HB3 PRO 70 HB3 PRO 70 4.427 17.092 -1.842 536 HG2 PRO 70 HG2 PRO 70 2.465 19.259 -1.188 537 HG3 PRO 70 HG3 PRO 70 2.174 17.508 -1.411 538 HD2 PRO 70 HD2 PRO 70 2.313 18.646 1.051 539 HD3 PRO 70 HD3 PRO 70 2.951 17.011 0.765 540 H GLU 71 H GLU 71 3.957 20.740 -0.100 541 HA GLU 71 HA GLU 71 5.442 22.535 -1.663 542 HB2 GLU 71 HB2 GLU 71 3.621 23.126 0.712 543 HB3 GLU 71 HB3 GLU 71 4.085 24.262 -0.561 544 HG2 GLU 71 HG2 GLU 71 2.977 22.730 -2.241 545 HG3 GLU 71 HG3 GLU 71 2.387 21.754 -0.888 546 H CYS 72 H CYS 72 6.403 21.224 1.366 547 HA CYS 72 HA CYS 72 7.759 23.637 2.355 548 HB2 CYS 72 HB2 CYS 72 7.831 20.724 3.262 549 HB3 CYS 72 HB3 CYS 72 8.671 22.062 4.059 550 HG CYS 72 HG CYS 72 5.443 21.876 3.377 551 H GLY 73 H GLY 73 8.398 21.491 -0.179 552 HA2 GLY 73 HA2 GLY 73 10.431 22.319 -1.382 553 HA3 GLY 73 HA3 GLY 73 11.356 21.940 0.073 554 H ALA 74 H ALA 74 8.748 19.711 -0.861 555 HA ALA 74 HA ALA 74 10.686 17.589 -1.411 556 HB1 ALA 74 HB3 ALA 74 8.742 16.239 -1.929 557 HB2 ALA 74 HB1 ALA 74 8.432 17.107 -0.408 558 HB3 ALA 74 HB2 ALA 74 7.697 17.664 -1.941 559 H LEU 75 H LEU 75 11.159 16.743 -3.417 560 HA LEU 75 HA LEU 75 10.397 18.368 -5.811 561 HB2 LEU 75 HB2 LEU 75 13.132 17.314 -5.029 562 HB3 LEU 75 HB3 LEU 75 12.761 18.119 -6.548 563 HG LEU 75 HG LEU 75 12.611 19.396 -3.782 564 HD11 LEU 75 HD11 LEU 75 14.632 20.613 -4.467 565 HD12 LEU 75 HD12 LEU 75 14.913 18.864 -4.501 566 HD13 LEU 75 HD13 LEU 75 14.650 19.745 -6.017 567 HD21 LEU 75 HD23 LEU 75 12.340 20.658 -6.556 568 HD22 LEU 75 HD21 LEU 75 11.043 20.500 -5.356 569 HD23 LEU 75 HD22 LEU 75 12.421 21.544 -5.017 570 H LYS 76 H LYS 76 11.252 15.195 -4.449 571 HA LYS 76 HA LYS 76 10.052 13.919 -6.778 572 HB2 LYS 76 HB2 LYS 76 12.656 12.884 -5.670 573 HB3 LYS 76 HB3 LYS 76 11.852 12.373 -7.138 574 HG2 LYS 76 HG2 LYS 76 12.571 14.453 -8.256 575 HG3 LYS 76 HG3 LYS 76 13.231 15.076 -6.730 576 HD2 LYS 76 HD2 LYS 76 14.793 13.123 -6.626 577 HD3 LYS 76 HD3 LYS 76 14.227 12.635 -8.236 578 HE2 LYS 76 HE2 LYS 76 14.992 14.823 -9.149 579 HE3 LYS 76 HE3 LYS 76 15.538 15.319 -7.540 580 HZ1 LYS 76 HZ3 LYS 76 17.342 14.420 -8.917 581 HZ2 LYS 76 HZ1 LYS 76 17.138 13.521 -7.560 582 HZ3 LYS 76 HZ2 LYS 76 16.603 12.974 -9.016 583 H THR 77 H THR 77 9.296 11.714 -6.187 584 HA THR 77 HA THR 77 8.721 11.552 -3.394 585 HB THR 77 HB THR 77 7.819 10.091 -5.892 586 HG1 THR 77 HG1 THR 77 6.245 11.431 -5.965 587 HG21 THR 77 HG23 THR 77 7.452 8.606 -4.016 588 HG22 THR 77 HG21 THR 77 6.749 9.928 -3.055 589 HG23 THR 77 HG22 THR 77 5.903 9.313 -4.505 590 H GLY 78 H GLY 78 9.558 10.246 -1.868 591 HA2 GLY 78 HA2 GLY 78 10.816 7.728 -2.325 592 HA3 GLY 78 HA3 GLY 78 12.035 9.008 -2.216 593 H MET 79 H MET 79 12.339 7.318 -0.261 594 HA MET 79 HA MET 79 11.353 8.564 2.213 595 HB2 MET 79 HB2 MET 79 11.115 5.625 1.422 596 HB3 MET 79 HB3 MET 79 10.974 6.180 3.083 597 HG2 MET 79 HG2 MET 79 9.001 7.429 2.639 598 HG3 MET 79 HG3 MET 79 9.145 7.188 0.897 599 HE1 MET 79 HE3 MET 79 6.966 6.409 0.462 600 HE2 MET 79 HE1 MET 79 6.168 4.950 1.080 601 HE3 MET 79 HE2 MET 79 6.306 6.395 2.108 602 H SER 80 H SER 80 12.518 7.417 4.105 603 HA SER 80 HA SER 80 14.958 6.019 3.532 604 HB2 SER 80 HB2 SER 80 15.085 8.830 4.716 605 HB3 SER 80 HB3 SER 80 16.406 7.651 4.847 606 HG SER 80 HG SER 80 15.353 8.005 2.306 607 H LEU 81 H LEU 81 16.005 5.400 5.711 608 HA LEU 81 HA LEU 81 14.040 5.110 7.912 609 HB2 LEU 81 HB2 LEU 81 13.696 3.285 6.361 610 HB3 LEU 81 HB3 LEU 81 15.424 2.981 6.207 611 HG LEU 81 HG LEU 81 15.573 1.963 8.298 612 HD11 LEU 81 HD11 LEU 81 13.794 1.716 9.923 613 HD12 LEU 81 HD12 LEU 81 13.980 3.441 9.640 614 HD13 LEU 81 HD13 LEU 81 12.648 2.557 8.881 615 HD21 LEU 81 HD23 LEU 81 14.053 0.065 7.849 616 HD22 LEU 81 HD21 LEU 81 12.962 1.134 6.961 617 HD23 LEU 81 HD22 LEU 81 14.560 0.795 6.294 618 H THR 82 H THR 82 15.056 5.418 9.829 619 HA THR 82 HA THR 82 17.989 4.992 10.056 620 HB THR 82 HB THR 82 16.334 7.348 11.081 621 HG1 THR 82 HG1 THR 82 16.738 7.461 8.848 622 HG21 THR 82 HG23 THR 82 19.322 6.781 11.262 623 HG22 THR 82 HG21 THR 82 18.539 8.329 11.681 624 HG23 THR 82 HG22 THR 82 18.152 6.873 12.599 625 H LEU 83 H LEU 83 18.621 4.239 12.145 626 HA LEU 83 HA LEU 83 16.550 3.974 14.232 627 HB2 LEU 83 HB2 LEU 83 16.732 1.853 12.887 628 HB3 LEU 83 HB3 LEU 83 18.401 1.695 13.437 629 HG LEU 83 HG LEU 83 15.934 1.776 15.235 630 HD11 LEU 83 HD11 LEU 83 15.825 -0.219 13.898 631 HD12 LEU 83 HD12 LEU 83 17.555 -0.565 14.194 632 HD13 LEU 83 HD13 LEU 83 16.364 -0.664 15.505 633 HD21 LEU 83 HD23 LEU 83 17.587 2.348 16.707 634 HD22 LEU 83 HD21 LEU 83 17.595 0.614 16.874 635 HD23 LEU 83 HD22 LEU 83 18.855 1.387 15.885 636 H LEU 84 H LEU 84 17.418 4.521 16.193 637 HA LEU 84 HA LEU 84 20.345 5.157 16.454 638 HB2 LEU 84 HB2 LEU 84 17.814 6.445 17.491 639 HB3 LEU 84 HB3 LEU 84 19.338 6.597 18.369 640 HG LEU 84 HG LEU 84 20.380 7.813 16.601 641 HD11 LEU 84 HD11 LEU 84 19.486 6.849 14.593 642 HD12 LEU 84 HD12 LEU 84 17.837 7.340 15.022 643 HD13 LEU 84 HD13 LEU 84 19.060 8.564 14.599 644 HD21 LEU 84 HD23 LEU 84 19.007 9.002 18.245 645 HD22 LEU 84 HD21 LEU 84 18.841 9.807 16.672 646 HD23 LEU 84 HD22 LEU 84 17.549 8.763 17.260 647 H GLU 85 H GLU 85 21.236 3.614 17.895 648 HA GLU 85 HA GLU 85 19.670 1.724 19.260 649 HB2 GLU 85 HB2 GLU 85 22.546 2.582 19.762 650 HB3 GLU 85 HB3 GLU 85 21.777 1.186 20.516 651 HG2 GLU 85 HG2 GLU 85 21.323 0.217 18.267 652 HG3 GLU 85 HG3 GLU 85 22.177 1.563 17.520 653 H GLN 86 H GLN 86 20.951 4.796 20.463 654 HA GLN 86 HA GLN 86 19.759 4.322 23.151 655 HB2 GLN 86 HB2 GLN 86 21.118 6.841 22.101 656 HB3 GLN 86 HB3 GLN 86 20.730 6.454 23.763 657 HG2 GLN 86 HG2 GLN 86 22.295 4.408 23.514 658 HG3 GLN 86 HG3 GLN 86 22.882 5.180 22.039 659 HE21 GLN 86 HE22 GLN 86 23.907 7.422 22.275 660 HE22 GLN 86 HE21 GLN 86 24.566 7.863 23.831 661 H GLY 87 H GLY 87 18.782 5.626 20.136 662 HA2 GLY 87 HA2 GLY 87 17.094 6.981 19.452 663 HA3 GLY 87 HA3 GLY 87 16.352 6.859 21.053 664 H VAL 88 H VAL 88 15.996 9.316 20.201 665 HA VAL 88 HA VAL 88 17.699 10.778 22.012 666 HB VAL 88 HB VAL 88 18.781 10.851 19.616 667 HG11 VAL 88 HG11 VAL 88 16.710 13.029 19.241 668 HG12 VAL 88 HG12 VAL 88 18.114 12.684 18.220 669 HG13 VAL 88 HG13 VAL 88 16.805 11.491 18.346 670 HG21 VAL 88 HG23 VAL 88 18.471 13.391 21.215 671 HG22 VAL 88 HG21 VAL 88 19.593 12.040 21.550 672 HG23 VAL 88 HG22 VAL 88 19.758 12.976 20.061 673 H TYR 89 H TYR 89 16.746 13.130 22.221 674 HA TYR 89 HA TYR 89 13.838 12.596 22.558 675 HB2 TYR 89 HB2 TYR 89 14.952 12.805 24.649 676 HB3 TYR 89 HB3 TYR 89 15.784 14.271 24.138 677 HD1 TYR 89 HD1 TYR 89 12.108 13.856 23.380 678 HD2 TYR 89 HD2 TYR 89 15.075 15.511 26.082 679 HE1 TYR 89 HE1 TYR 89 10.409 15.268 24.410 680 HE2 TYR 89 HE2 TYR 89 13.344 16.968 27.078 681 HH TYR 89 HH TYR 89 11.081 17.619 27.019 682 H PHE 90 H PHE 90 12.674 13.492 21.092 683 HA PHE 90 HA PHE 90 13.223 16.057 19.775 684 HB2 PHE 90 HB2 PHE 90 11.134 13.874 19.713 685 HB3 PHE 90 HB3 PHE 90 10.846 15.430 18.936 686 HD1 PHE 90 HD1 PHE 90 13.745 12.927 18.953 687 HD2 PHE 90 HD2 PHE 90 11.131 15.485 16.642 688 HE1 PHE 90 HE1 PHE 90 14.864 12.214 16.883 689 HE2 PHE 90 HE2 PHE 90 12.253 14.736 14.575 690 HZ PHE 90 HZ PHE 90 14.146 13.136 14.684 691 HA PRO 91 HA PRO 91 11.409 17.811 23.476 692 HB2 PRO 91 HB2 PRO 91 11.050 20.447 22.700 693 HB3 PRO 91 HB3 PRO 91 12.609 19.716 23.183 694 HG2 PRO 91 HG2 PRO 91 11.526 20.115 20.383 695 HG3 PRO 91 HG3 PRO 91 13.170 20.478 21.001 696 HD2 PRO 91 HD2 PRO 91 12.654 18.196 19.639 697 HD3 PRO 91 HD3 PRO 91 13.747 18.174 21.059 698 H GLY 92 H GLY 92 9.419 17.192 24.034 699 HA2 GLY 92 HA2 GLY 92 7.069 18.028 24.073 700 HA3 GLY 92 HA3 GLY 92 7.072 17.897 22.314 701 H ASN 93 H ASN 93 8.820 15.277 22.746 702 HA ASN 93 HA ASN 93 6.706 13.473 23.846 703 HB2 ASN 93 HB2 ASN 93 6.477 13.343 21.425 704 HB3 ASN 93 HB3 ASN 93 8.223 13.082 21.242 705 HD21 ASN 93 HD22 ASN 93 9.105 11.021 21.669 706 HD22 ASN 93 HD21 ASN 93 8.088 9.630 21.930 707 H ASP 94 H ASP 94 7.758 13.099 25.715 708 HA ASP 94 HA ASP 94 10.495 13.270 26.151 709 HB2 ASP 94 HB2 ASP 94 8.785 13.532 27.873 710 HB3 ASP 94 HB3 ASP 94 8.352 11.826 27.737 711 H GLU 95 H GLU 95 8.780 10.406 24.966 712 HA GLU 95 HA GLU 95 10.663 8.462 25.855 713 HB2 GLU 95 HB2 GLU 95 8.317 7.973 25.436 714 HB3 GLU 95 HB3 GLU 95 8.403 8.706 23.840 715 HG2 GLU 95 HG2 GLU 95 8.364 6.502 23.418 716 HG3 GLU 95 HG3 GLU 95 10.048 6.971 23.185 717 HA PRO 96 HA PRO 96 13.580 9.889 22.768 718 HB2 PRO 96 HB2 PRO 96 15.467 7.904 22.851 719 HB3 PRO 96 HB3 PRO 96 15.247 9.098 24.162 720 HG2 PRO 96 HG2 PRO 96 14.175 6.266 24.014 721 HG3 PRO 96 HG3 PRO 96 14.972 7.082 25.395 722 HD2 PRO 96 HD2 PRO 96 12.230 6.879 25.124 723 HD3 PRO 96 HD3 PRO 96 13.015 8.270 25.938 724 H ILE 97 H ILE 97 13.478 9.747 20.571 725 HA ILE 97 HA ILE 97 11.947 7.613 19.318 726 HB ILE 97 HB ILE 97 13.567 9.851 18.032 727 HG12 ILE 97 HG12 ILE 97 11.963 10.954 19.405 728 HG13 ILE 97 HG13 ILE 97 11.387 11.023 17.751 729 HG21 ILE 97 HG21 ILE 97 11.349 8.064 16.929 730 HG22 ILE 97 HG22 ILE 97 12.128 9.414 16.083 731 HG23 ILE 97 HG23 ILE 97 13.060 7.970 16.493 732 HD11 ILE 97 HD13 ILE 97 10.342 9.157 19.935 733 HD12 ILE 97 HD11 ILE 97 9.552 10.598 19.293 734 HD13 ILE 97 HD12 ILE 97 9.766 9.179 18.249 735 H LYS 98 H LYS 98 12.884 5.644 19.159 736 HA LYS 98 HA LYS 98 15.781 5.416 18.557 737 HB2 LYS 98 HB2 LYS 98 13.645 3.330 19.170 738 HB3 LYS 98 HB3 LYS 98 15.281 2.956 18.605 739 HG2 LYS 98 HG2 LYS 98 16.185 4.327 20.547 740 HG3 LYS 98 HG3 LYS 98 14.538 4.438 21.169 741 HD2 LYS 98 HD2 LYS 98 15.850 2.717 22.298 742 HD3 LYS 98 HD3 LYS 98 14.469 1.991 21.459 743 HE2 LYS 98 HE2 LYS 98 15.810 1.015 19.792 744 HE3 LYS 98 HE3 LYS 98 17.133 2.167 20.035 745 HZ1 LYS 98 HZ3 LYS 98 17.796 1.087 21.970 746 HZ2 LYS 98 HZ1 LYS 98 16.442 0.142 22.076 747 HZ3 LYS 98 HZ2 LYS 98 17.548 -0.119 20.903 748 H LEU 99 H LEU 99 12.711 5.528 16.815 749 HA LEU 99 HA LEU 99 14.220 4.717 14.387 750 HB2 LEU 99 HB2 LEU 99 11.575 3.699 15.496 751 HB3 LEU 99 HB3 LEU 99 11.793 3.748 13.754 752 HG LEU 99 HG LEU 99 13.859 2.367 15.468 753 HD11 LEU 99 HD11 LEU 99 11.301 1.090 14.454 754 HD12 LEU 99 HD12 LEU 99 12.670 0.273 15.265 755 HD13 LEU 99 HD13 LEU 99 11.693 1.447 16.146 756 HD21 LEU 99 HD23 LEU 99 14.338 2.815 13.053 757 HD22 LEU 99 HD21 LEU 99 14.217 1.087 13.348 758 HD23 LEU 99 HD22 LEU 99 12.869 1.949 12.593 759 H LEU 100 H LEU 100 13.810 5.693 12.563 760 HA LEU 100 HA LEU 100 11.672 7.760 12.497 761 HB2 LEU 100 HB2 LEU 100 14.490 8.392 11.571 762 HB3 LEU 100 HB3 LEU 100 13.127 9.461 11.796 763 HG LEU 100 HG LEU 100 13.392 8.634 14.325 764 HD11 LEU 100 HD11 LEU 100 15.705 8.409 15.025 765 HD12 LEU 100 HD12 LEU 100 15.379 7.157 13.823 766 HD13 LEU 100 HD13 LEU 100 16.270 8.614 13.353 767 HD21 LEU 100 HD23 LEU 100 13.422 10.965 13.709 768 HD22 LEU 100 HD21 LEU 100 14.662 10.600 14.908 769 HD23 LEU 100 HD22 LEU 100 15.127 10.829 13.210 770 H ILE 101 H ILE 101 10.680 7.743 10.495 771 HA ILE 101 HA ILE 101 12.274 6.706 8.210 772 HB ILE 101 HB ILE 101 9.342 6.176 8.836 773 HG12 ILE 101 HG12 ILE 101 11.838 4.572 8.186 774 HG13 ILE 101 HG13 ILE 101 10.843 4.501 9.641 775 HG21 ILE 101 HG21 ILE 101 8.949 5.456 6.642 776 HG22 ILE 101 HG22 ILE 101 9.429 7.126 6.542 777 HG23 ILE 101 HG23 ILE 101 10.590 5.854 6.093 778 HD11 ILE 101 HD13 ILE 101 8.996 3.541 8.143 779 HD12 ILE 101 HD11 ILE 101 10.257 3.406 6.877 780 HD13 ILE 101 HD12 ILE 101 10.424 2.516 8.394 781 H GLY 102 H GLY 102 12.588 8.074 6.636 782 HA2 GLY 102 HA2 GLY 102 11.327 10.767 6.715 783 HA3 GLY 102 HA3 GLY 102 12.711 10.282 5.722 784 H LEU 103 H LEU 103 10.190 11.500 4.832 785 HA LEU 103 HA LEU 103 9.662 9.699 2.589 786 HB2 LEU 103 HB2 LEU 103 7.897 9.217 4.436 787 HB3 LEU 103 HB3 LEU 103 7.371 10.865 4.210 788 HG LEU 103 HG LEU 103 7.042 8.462 2.342 789 HD11 LEU 103 HD11 LEU 103 5.108 10.597 3.427 790 HD12 LEU 103 HD12 LEU 103 4.707 9.022 2.730 791 HD13 LEU 103 HD13 LEU 103 5.467 9.135 4.324 792 HD21 LEU 103 HD23 LEU 103 7.490 10.101 0.719 793 HD22 LEU 103 HD21 LEU 103 5.753 10.220 0.887 794 HD23 LEU 103 HD22 LEU 103 6.719 11.429 1.671 795 H SER 104 H SER 104 9.295 11.030 0.747 796 HA SER 104 HA SER 104 8.454 13.805 1.096 797 HB2 SER 104 HB2 SER 104 10.151 14.641 -0.459 798 HB3 SER 104 HB3 SER 104 10.889 13.993 1.016 799 HG SER 104 HG SER 104 10.950 13.009 -1.621 800 H ALA 105 H ALA 105 7.108 14.406 -0.749 801 HA ALA 105 HA ALA 105 7.219 12.621 -3.022 802 HB1 ALA 105 HB3 ALA 105 4.440 13.116 -2.176 803 HB2 ALA 105 HB1 ALA 105 5.170 11.726 -2.977 804 HB3 ALA 105 HB2 ALA 105 5.335 11.894 -1.230 805 H ALA 106 H ALA 106 6.414 13.565 -4.942 806 HA ALA 106 HA ALA 106 6.844 16.441 -4.707 807 HB1 ALA 106 HB3 ALA 106 7.989 15.123 -6.492 808 HB2 ALA 106 HB1 ALA 106 6.411 14.697 -7.196 809 HB3 ALA 106 HB2 ALA 106 6.964 16.385 -7.198 810 H ASP 107 H ASP 107 4.126 14.353 -4.818 811 HA ASP 107 HA ASP 107 2.340 16.731 -5.107 812 HB2 ASP 107 HB2 ASP 107 2.290 15.490 -7.255 813 HB3 ASP 107 HB3 ASP 107 1.831 14.021 -6.390 814 H ALA 108 H ALA 108 0.340 16.546 -3.897 815 HA ALA 108 HA ALA 108 0.718 15.375 -1.358 816 HB1 ALA 108 HB3 ALA 108 -1.849 16.382 -2.659 817 HB2 ALA 108 HB1 ALA 108 -1.601 16.093 -0.924 818 HB3 ALA 108 HB2 ALA 108 -0.679 17.370 -1.744 819 H ASP 109 H ASP 109 -0.982 14.092 -4.237 820 HA ASP 109 HA ASP 109 -2.198 11.886 -2.729 821 HB2 ASP 109 HB2 ASP 109 -3.236 12.632 -4.770 822 HB3 ASP 109 HB3 ASP 109 -1.752 12.304 -5.692 823 H SER 110 H SER 110 0.849 12.469 -4.455 824 HA SER 110 HA SER 110 1.805 9.760 -4.254 825 HB2 SER 110 HB2 SER 110 3.476 12.316 -4.382 826 HB3 SER 110 HB3 SER 110 3.991 10.666 -4.727 827 HG SER 110 HG SER 110 3.470 11.752 -6.644 828 H HIS 111 H HIS 111 1.895 12.609 -2.013 829 HA HIS 111 HA HIS 111 3.339 11.266 0.065 830 HB2 HIS 111 HB2 HIS 111 1.444 13.621 0.072 831 HB3 HIS 111 HB3 HIS 111 1.901 12.858 1.579 832 HD1 HIS 111 HD1 HIS 111 4.343 13.328 2.510 833 HD2 HIS 111 HD2 HIS 111 3.383 15.048 -1.203 834 HE1 HIS 111 HE1 HIS 111 6.191 14.970 1.980 835 H ILE 112 H ILE 112 -0.211 11.389 -0.624 836 HA ILE 112 HA ILE 112 -1.016 9.842 1.615 837 HB ILE 112 HB ILE 112 -2.173 10.147 -1.186 838 HG12 ILE 112 HG12 ILE 112 -2.168 12.170 0.290 839 HG13 ILE 112 HG13 ILE 112 -3.745 11.658 -0.279 840 HG21 ILE 112 HG21 ILE 112 -3.046 8.039 -0.504 841 HG22 ILE 112 HG22 ILE 112 -3.438 8.642 1.119 842 HG23 ILE 112 HG23 ILE 112 -4.319 9.241 -0.310 843 HD11 ILE 112 HD13 ILE 112 -4.267 10.705 1.914 844 HD12 ILE 112 HD11 ILE 112 -2.626 11.084 2.495 845 HD13 ILE 112 HD12 ILE 112 -3.751 12.393 2.067 846 H GLY 113 H GLY 113 -0.246 8.656 -1.737 847 HA2 GLY 113 HA2 GLY 113 -0.587 5.925 -1.149 848 HA3 GLY 113 HA3 GLY 113 0.459 6.581 -2.425 849 H ALA 114 H ALA 114 2.280 8.012 -0.766 850 HA ALA 114 HA ALA 114 4.151 5.956 -0.083 851 HB1 ALA 114 HB3 ALA 114 4.822 8.129 -0.968 852 HB2 ALA 114 HB1 ALA 114 4.037 8.962 0.393 853 HB3 ALA 114 HB2 ALA 114 5.465 7.965 0.668 854 H ILE 115 H ILE 115 2.227 8.267 1.983 855 HA ILE 115 HA ILE 115 3.134 7.420 4.470 856 HB ILE 115 HB ILE 115 0.734 8.653 3.322 857 HG12 ILE 115 HG12 ILE 115 2.784 9.990 3.854 858 HG13 ILE 115 HG13 ILE 115 1.295 10.623 4.534 859 HG21 ILE 115 HG21 ILE 115 -0.345 9.034 5.522 860 HG22 ILE 115 HG22 ILE 115 -0.480 7.429 4.813 861 HG23 ILE 115 HG23 ILE 115 0.678 7.693 6.142 862 HD11 ILE 115 HD13 ILE 115 1.847 9.856 6.748 863 HD12 ILE 115 HD11 ILE 115 3.179 8.860 6.134 864 HD13 ILE 115 HD12 ILE 115 3.304 10.626 6.099 865 H GLN 116 H GLN 116 0.492 6.222 2.350 866 HA GLN 116 HA GLN 116 -0.465 4.230 4.179 867 HB2 GLN 116 HB2 GLN 116 -0.857 4.740 1.203 868 HB3 GLN 116 HB3 GLN 116 -1.669 3.422 2.050 869 HG2 GLN 116 HG2 GLN 116 -1.843 6.351 2.834 870 HG3 GLN 116 HG3 GLN 116 -3.029 5.530 1.825 871 HE21 GLN 116 HE22 GLN 116 -3.265 6.845 4.570 872 HE22 GLN 116 HE21 GLN 116 -3.954 5.611 5.592 873 H ALA 117 H ALA 117 2.458 4.260 2.342 874 HA ALA 117 HA ALA 117 2.539 1.350 2.176 875 HB1 ALA 117 HB3 ALA 117 4.776 3.324 1.566 876 HB2 ALA 117 HB1 ALA 117 4.649 1.646 1.040 877 HB3 ALA 117 HB2 ALA 117 3.572 2.858 0.350 878 H LEU 118 H LEU 118 3.886 4.186 3.859 879 HA LEU 118 HA LEU 118 5.587 2.598 5.518 880 HB2 LEU 118 HB2 LEU 118 4.579 5.461 5.860 881 HB3 LEU 118 HB3 LEU 118 5.870 4.678 6.828 882 HG LEU 118 HG LEU 118 5.880 4.965 3.804 883 HD11 LEU 118 HD11 LEU 118 7.559 6.801 4.275 884 HD12 LEU 118 HD12 LEU 118 5.906 7.135 4.821 885 HD13 LEU 118 HD13 LEU 118 7.140 6.678 5.996 886 HD21 LEU 118 HD23 LEU 118 7.715 3.725 5.880 887 HD22 LEU 118 HD21 LEU 118 7.427 3.277 4.191 888 HD23 LEU 118 HD22 LEU 118 8.484 4.634 4.579 889 H SER 119 H SER 119 2.255 3.713 5.911 890 HA SER 119 HA SER 119 1.994 2.960 8.618 891 HB2 SER 119 HB2 SER 119 -0.073 2.678 6.383 892 HB3 SER 119 HB3 SER 119 -0.413 2.773 8.119 893 HG SER 119 HG SER 119 0.796 4.807 6.505 894 H GLU 120 H GLU 120 2.481 0.863 5.804 895 HA GLU 120 HA GLU 120 1.423 -1.503 7.063 896 HB2 GLU 120 HB2 GLU 120 3.453 -1.308 4.807 897 HB3 GLU 120 HB3 GLU 120 2.598 -2.754 5.290 898 HG2 GLU 120 HG2 GLU 120 1.156 -0.267 4.342 899 HG3 GLU 120 HG3 GLU 120 1.681 -1.538 3.239 900 H LEU 121 H LEU 121 4.241 0.410 7.407 901 HA LEU 121 HA LEU 121 5.782 -1.784 8.708 902 HB2 LEU 121 HB2 LEU 121 6.706 0.978 7.764 903 HB3 LEU 121 HB3 LEU 121 7.707 -0.244 8.557 904 HG LEU 121 HG LEU 121 6.423 -0.379 5.799 905 HD11 LEU 121 HD11 LEU 121 8.801 -0.541 5.071 906 HD12 LEU 121 HD12 LEU 121 8.495 0.939 5.993 907 HD13 LEU 121 HD13 LEU 121 9.323 -0.435 6.760 908 HD21 LEU 121 HD23 LEU 121 6.243 -2.653 6.678 909 HD22 LEU 121 HD21 LEU 121 7.520 -2.580 5.471 910 HD23 LEU 121 HD22 LEU 121 7.953 -2.629 7.184 911 H LEU 122 H LEU 122 5.320 1.768 9.250 912 HA LEU 122 HA LEU 122 6.010 1.413 12.023 913 HB2 LEU 122 HB2 LEU 122 4.887 3.835 10.582 914 HB3 LEU 122 HB3 LEU 122 5.621 3.808 12.192 915 HG LEU 122 HG LEU 122 6.967 3.419 9.508 916 HD11 LEU 122 HD11 LEU 122 8.460 5.199 10.490 917 HD12 LEU 122 HD12 LEU 122 6.770 5.694 10.273 918 HD13 LEU 122 HD13 LEU 122 7.401 5.280 11.881 919 HD21 LEU 122 HD23 LEU 122 8.163 2.689 12.216 920 HD22 LEU 122 HD21 LEU 122 7.968 1.635 10.804 921 HD23 LEU 122 HD22 LEU 122 9.114 2.967 10.748 922 H CYS 123 H CYS 123 3.001 0.830 10.564 923 HA CYS 123 HA CYS 123 1.714 1.128 13.225 924 HB2 CYS 123 HB2 CYS 123 0.249 1.316 10.564 925 HB3 CYS 123 HB3 CYS 123 -0.409 1.569 12.175 926 HG CYS 123 HG CYS 123 -0.252 3.865 10.938 927 H GLU 124 H GLU 124 3.322 -1.054 12.204 928 HA GLU 124 HA GLU 124 1.353 -3.185 12.678 929 HB2 GLU 124 HB2 GLU 124 3.508 -3.222 10.537 930 HB3 GLU 124 HB3 GLU 124 2.783 -4.688 11.192 931 HG2 GLU 124 HG2 GLU 124 1.282 -2.437 9.821 932 HG3 GLU 124 HG3 GLU 124 1.731 -3.978 9.079 933 H GLU 125 H GLU 125 1.793 -3.728 14.604 934 HA GLU 125 HA GLU 125 4.192 -3.201 15.984 935 HB2 GLU 125 HB2 GLU 125 3.305 -4.562 17.780 936 HB3 GLU 125 HB3 GLU 125 2.049 -3.533 17.094 937 HG2 GLU 125 HG2 GLU 125 1.195 -5.504 15.786 938 HG3 GLU 125 HG3 GLU 125 2.415 -6.518 16.558 939 H GLU 126 H GLU 126 3.336 -5.914 13.942 940 HA GLU 126 HA GLU 126 5.333 -7.749 14.801 941 HB2 GLU 126 HB2 GLU 126 4.131 -7.423 12.013 942 HB3 GLU 126 HB3 GLU 126 5.014 -8.833 12.619 943 HG2 GLU 126 HG2 GLU 126 3.248 -9.042 14.427 944 HG3 GLU 126 HG3 GLU 126 2.340 -7.772 13.591 945 H ILE 127 H ILE 127 5.297 -5.180 12.338 946 HA ILE 127 HA ILE 127 8.046 -5.567 11.508 947 HB ILE 127 HB ILE 127 5.960 -3.496 11.017 948 HG12 ILE 127 HG12 ILE 127 6.248 -4.086 8.691 949 HG13 ILE 127 HG13 ILE 127 7.605 -5.154 9.075 950 HG21 ILE 127 HG21 ILE 127 7.735 -2.423 9.456 951 HG22 ILE 127 HG22 ILE 127 7.872 -2.097 11.182 952 HG23 ILE 127 HG23 ILE 127 8.919 -3.312 10.419 953 HD11 ILE 127 HD13 ILE 127 6.108 -6.752 10.108 954 HD12 ILE 127 HD11 ILE 127 4.732 -5.619 9.942 955 HD13 ILE 127 HD12 ILE 127 5.498 -6.326 8.504 956 H LEU 128 H LEU 128 6.319 -3.384 13.815 957 HA LEU 128 HA LEU 128 8.503 -1.740 14.362 958 HB2 LEU 128 HB2 LEU 128 6.337 -2.617 16.311 959 HB3 LEU 128 HB3 LEU 128 7.517 -1.359 16.635 960 HG LEU 128 HG LEU 128 5.344 -1.265 14.513 961 HD11 LEU 128 HD11 LEU 128 5.870 0.427 16.985 962 HD12 LEU 128 HD12 LEU 128 4.527 0.621 15.834 963 HD13 LEU 128 HD13 LEU 128 4.628 -0.834 16.835 964 HD21 LEU 128 HD23 LEU 128 7.147 -0.162 13.452 965 HD22 LEU 128 HD21 LEU 128 6.202 1.126 14.211 966 HD23 LEU 128 HD22 LEU 128 7.712 0.576 14.967 967 H GLU 129 H GLU 129 7.854 -4.926 15.793 968 HA GLU 129 HA GLU 129 10.073 -4.753 17.597 969 HB2 GLU 129 HB2 GLU 129 8.144 -6.889 16.758 970 HB3 GLU 129 HB3 GLU 129 9.722 -7.432 17.348 971 HG2 GLU 129 HG2 GLU 129 9.491 -6.119 19.391 972 HG3 GLU 129 HG3 GLU 129 7.910 -5.518 18.862 973 H GLN 130 H GLN 130 9.715 -5.805 14.171 974 HA GLN 130 HA GLN 130 12.222 -7.221 14.114 975 HB2 GLN 130 HB2 GLN 130 10.376 -6.069 11.993 976 HB3 GLN 130 HB3 GLN 130 11.892 -6.899 11.604 977 HG2 GLN 130 HG2 GLN 130 11.147 -8.967 12.514 978 HG3 GLN 130 HG3 GLN 130 9.742 -8.228 13.272 979 HE21 GLN 130 HE22 GLN 130 7.851 -8.167 12.129 980 HE22 GLN 130 HE21 GLN 130 7.684 -8.600 10.431 981 H LEU 131 H LEU 131 11.103 -3.878 13.395 982 HA LEU 131 HA LEU 131 13.686 -2.897 12.551 983 HB2 LEU 131 HB2 LEU 131 11.480 -1.369 13.958 984 HB3 LEU 131 HB3 LEU 131 12.861 -0.688 13.090 985 HG LEU 131 HG LEU 131 10.719 -2.359 11.695 986 HD11 LEU 131 HD11 LEU 131 10.745 0.646 12.137 987 HD12 LEU 131 HD12 LEU 131 9.544 -0.288 11.213 988 HD13 LEU 131 HD13 LEU 131 9.698 -0.518 12.971 989 HD21 LEU 131 HD23 LEU 131 11.445 -1.109 9.710 990 HD22 LEU 131 HD21 LEU 131 12.622 -0.212 10.689 991 HD23 LEU 131 HD22 LEU 131 12.816 -1.963 10.439 992 H LEU 132 H LEU 132 11.881 -2.671 15.676 993 HA LEU 132 HA LEU 132 13.970 -1.431 17.099 994 HB2 LEU 132 HB2 LEU 132 11.715 -3.210 18.052 995 HB3 LEU 132 HB3 LEU 132 12.835 -2.478 19.183 996 HG LEU 132 HG LEU 132 11.236 -0.802 17.212 997 HD11 LEU 132 HD11 LEU 132 9.704 -2.073 18.670 998 HD12 LEU 132 HD12 LEU 132 10.567 -1.483 20.106 999 HD13 LEU 132 HD13 LEU 132 9.686 -0.344 19.062 1000 HD21 LEU 132 HD23 LEU 132 13.196 0.368 18.136 1001 HD22 LEU 132 HD21 LEU 132 11.710 1.032 18.822 1002 HD23 LEU 132 HD22 LEU 132 12.708 -0.076 19.785 1003 H THR 133 H THR 133 13.915 -4.781 16.119 1004 HA THR 133 HA THR 133 16.202 -5.348 17.914 1005 HB THR 133 HB THR 133 15.711 -7.720 17.437 1006 HG1 THR 133 HG1 THR 133 13.293 -6.778 16.317 1007 HG21 THR 133 HG23 THR 133 13.696 -7.910 18.815 1008 HG22 THR 133 HG21 THR 133 14.750 -6.637 19.452 1009 HG23 THR 133 HG22 THR 133 13.286 -6.209 18.542 1010 H ALA 134 H ALA 134 15.828 -4.087 14.896 1011 HA ALA 134 HA ALA 134 17.758 -5.531 13.357 1012 HB1 ALA 134 HB3 ALA 134 16.910 -2.624 13.199 1013 HB2 ALA 134 HB1 ALA 134 17.854 -3.503 11.999 1014 HB3 ALA 134 HB2 ALA 134 16.170 -3.980 12.311 1015 H SER 135 H SER 135 19.911 -5.375 13.373 1016 HA SER 135 HA SER 135 21.283 -3.306 15.034 1017 HB2 SER 135 HB2 SER 135 22.035 -6.242 14.722 1018 HB3 SER 135 HB3 SER 135 22.870 -5.036 15.716 1019 HG SER 135 HG SER 135 21.442 -6.351 16.937 1020 H SER 136 H SER 136 20.745 -4.243 11.901 1021 HA SER 136 HA SER 136 23.352 -3.193 10.990 1022 HB2 SER 136 HB2 SER 136 22.136 -5.781 9.926 1023 HB3 SER 136 HB3 SER 136 23.644 -5.025 9.401 1024 HG SER 136 HG SER 136 24.491 -5.432 11.491 1025 H GLU 137 H GLU 137 23.248 -2.260 8.940 1026 HA GLU 137 HA GLU 137 20.894 -0.886 8.236 1027 HB2 GLU 137 HB2 GLU 137 23.373 -0.396 7.795 1028 HB3 GLU 137 HB3 GLU 137 23.276 -1.533 6.444 1029 HG2 GLU 137 HG2 GLU 137 21.429 -0.087 5.490 1030 HG3 GLU 137 HG3 GLU 137 21.705 1.030 6.841 1031 H LYS 138 H LYS 138 22.360 -3.838 6.791 1032 HA LYS 138 HA LYS 138 20.465 -4.192 4.747 1033 HB2 LYS 138 HB2 LYS 138 22.668 -5.376 4.938 1034 HB3 LYS 138 HB3 LYS 138 22.043 -6.299 6.299 1035 HG2 LYS 138 HG2 LYS 138 22.030 -7.635 4.257 1036 HG3 LYS 138 HG3 LYS 138 20.400 -7.411 4.869 1037 HD2 LYS 138 HD2 LYS 138 20.414 -7.236 2.454 1038 HD3 LYS 138 HD3 LYS 138 19.978 -5.671 3.146 1039 HE2 LYS 138 HE2 LYS 138 22.303 -4.859 2.796 1040 HE3 LYS 138 HE3 LYS 138 22.771 -6.447 2.176 1041 HZ1 LYS 138 HZ3 LYS 138 22.320 -4.900 0.387 1042 HZ2 LYS 138 HZ1 LYS 138 21.235 -6.111 0.331 1043 HZ3 LYS 138 HZ2 LYS 138 20.796 -4.642 0.899 1044 H GLN 139 H GLN 139 20.287 -5.103 8.185 1045 HA GLN 139 HA GLN 139 18.011 -6.757 7.993 1046 HB2 GLN 139 HB2 GLN 139 19.823 -5.943 9.959 1047 HB3 GLN 139 HB3 GLN 139 18.329 -5.161 10.480 1048 HG2 GLN 139 HG2 GLN 139 17.176 -7.358 10.349 1049 HG3 GLN 139 HG3 GLN 139 18.702 -8.100 9.817 1050 HE21 GLN 139 HE22 GLN 139 17.179 -8.852 12.231 1051 HE22 GLN 139 HE21 GLN 139 18.199 -8.493 13.602 1052 H LEU 140 H LEU 140 18.368 -3.177 8.388 1053 HA LEU 140 HA LEU 140 15.546 -2.737 8.816 1054 HB2 LEU 140 HB2 LEU 140 17.892 -1.001 8.015 1055 HB3 LEU 140 HB3 LEU 140 16.261 -0.369 7.972 1056 HG LEU 140 HG LEU 140 17.582 -1.536 10.449 1057 HD11 LEU 140 HD11 LEU 140 17.829 0.709 11.234 1058 HD12 LEU 140 HD12 LEU 140 18.565 0.633 9.633 1059 HD13 LEU 140 HD13 LEU 140 16.972 1.382 9.848 1060 HD21 LEU 140 HD23 LEU 140 15.688 -0.393 11.653 1061 HD22 LEU 140 HD21 LEU 140 14.878 -0.266 10.082 1062 HD23 LEU 140 HD22 LEU 140 15.275 -1.858 10.775 1063 H ALA 141 H ALA 141 17.661 -2.520 5.904 1064 HA ALA 141 HA ALA 141 15.575 -2.154 4.050 1065 HB1 ALA 141 HB3 ALA 141 18.080 -3.734 3.465 1066 HB2 ALA 141 HB1 ALA 141 17.105 -2.701 2.377 1067 HB3 ALA 141 HB2 ALA 141 18.077 -1.966 3.671 1068 H ASP 142 H ASP 142 16.635 -5.258 5.512 1069 HA ASP 142 HA ASP 142 15.180 -6.912 3.727 1070 HB2 ASP 142 HB2 ASP 142 16.801 -7.834 5.307 1071 HB3 ASP 142 HB3 ASP 142 15.794 -7.344 6.672 1072 H ILE 143 H ILE 143 14.154 -5.115 6.671 1073 HA ILE 143 HA ILE 143 11.482 -6.112 6.678 1074 HB ILE 143 HB ILE 143 12.874 -3.717 7.919 1075 HG12 ILE 143 HG12 ILE 143 11.896 -6.260 9.287 1076 HG13 ILE 143 HG13 ILE 143 13.504 -6.181 8.581 1077 HG21 ILE 143 HG21 ILE 143 10.524 -3.193 7.781 1078 HG22 ILE 143 HG22 ILE 143 10.089 -4.789 8.449 1079 HG23 ILE 143 HG23 ILE 143 10.940 -3.587 9.449 1080 HD11 ILE 143 HD13 ILE 143 12.470 -4.466 10.835 1081 HD12 ILE 143 HD11 ILE 143 13.774 -5.674 10.865 1082 HD13 ILE 143 HD12 ILE 143 14.008 -4.159 9.985 1083 H ILE 144 H ILE 144 13.110 -3.329 5.128 1084 HA ILE 144 HA ILE 144 10.773 -2.172 3.939 1085 HB ILE 144 HB ILE 144 13.611 -2.377 2.815 1086 HG12 ILE 144 HG12 ILE 144 13.665 -1.039 4.795 1087 HG13 ILE 144 HG13 ILE 144 13.765 0.029 3.398 1088 HG21 ILE 144 HG21 ILE 144 12.992 -0.525 1.285 1089 HG22 ILE 144 HG22 ILE 144 12.232 -2.070 0.915 1090 HG23 ILE 144 HG23 ILE 144 11.287 -0.797 1.703 1091 HD11 ILE 144 HD13 ILE 144 12.253 1.059 4.851 1092 HD12 ILE 144 HD11 ILE 144 11.221 0.292 3.618 1093 HD13 ILE 144 HD12 ILE 144 11.417 -0.464 5.218 1094 H SER 145 H SER 145 12.925 -4.769 2.808 1095 HA SER 145 HA SER 145 11.538 -5.142 0.409 1096 HB2 SER 145 HB2 SER 145 13.214 -7.202 1.929 1097 HB3 SER 145 HB3 SER 145 12.845 -7.220 0.198 1098 HG SER 145 HG SER 145 14.393 -5.291 1.632 1099 H ARG 146 H ARG 146 10.987 -6.604 3.649 1100 HA ARG 146 HA ARG 146 9.086 -8.507 3.017 1101 HB2 ARG 146 HB2 ARG 146 10.304 -7.572 5.295 1102 HB3 ARG 146 HB3 ARG 146 8.711 -6.821 5.491 1103 HG2 ARG 146 HG2 ARG 146 7.731 -9.124 5.026 1104 HG3 ARG 146 HG3 ARG 146 9.404 -9.726 5.056 1105 HD2 ARG 146 HD2 ARG 146 9.639 -9.026 7.395 1106 HD3 ARG 146 HD3 ARG 146 8.032 -8.281 7.373 1107 HE ARG 146 HE ARG 146 7.136 -10.583 6.856 1108 HH11 ARG 146 HH11 ARG 146 9.938 -10.183 9.003 1109 HH12 ARG 146 HH12 ARG 146 9.993 -11.853 9.453 1110 HH21 ARG 146 HH22 ARG 146 7.103 -12.740 7.601 1111 HH22 ARG 146 HH21 ARG 146 8.264 -13.292 8.744 1112 H GLY 147 H GLY 147 8.751 -5.012 2.942 1113 HA2 GLY 147 HA2 GLY 147 5.847 -4.955 3.254 1114 HA3 GLY 147 HA3 GLY 147 6.932 -3.618 2.827 Start of MODEL 19 1 H MET 1 H1 MET 1 1.856 -2.343 -0.408 2 HA MET 1 HA MET 1 2.512 -2.676 -3.249 3 HB2 MET 1 HB2 MET 1 3.202 -0.338 -3.254 4 HB3 MET 1 HB3 MET 1 1.467 -0.503 -2.986 5 HG2 MET 1 HG2 MET 1 3.502 -0.040 -0.770 6 HG3 MET 1 HG3 MET 1 2.694 1.259 -1.627 7 HE1 MET 1 HE3 MET 1 -0.781 1.523 -0.193 8 HE2 MET 1 HE1 MET 1 0.634 2.400 -0.813 9 HE3 MET 1 HE2 MET 1 -0.164 1.171 -1.823 10 H ARG 2 H ARG 2 4.791 -2.272 -3.813 11 HA ARG 2 HA ARG 2 6.631 -3.316 -1.848 12 HB2 ARG 2 HB2 ARG 2 6.906 -2.155 -4.642 13 HB3 ARG 2 HB3 ARG 2 8.322 -2.357 -3.622 14 HG2 ARG 2 HG2 ARG 2 8.085 -4.212 -5.118 15 HG3 ARG 2 HG3 ARG 2 7.995 -4.742 -3.438 16 HD2 ARG 2 HD2 ARG 2 5.496 -4.205 -5.042 17 HD3 ARG 2 HD3 ARG 2 6.388 -5.726 -5.247 18 HE ARG 2 HE ARG 2 6.024 -5.396 -2.473 19 HH11 ARG 2 HH21 ARG 2 4.072 -6.125 -5.363 20 HH12 ARG 2 HH22 ARG 2 2.838 -6.947 -4.486 21 HH21 ARG 2 HH12 ARG 2 4.353 -6.367 -1.302 22 HH22 ARG 2 HH11 ARG 2 3.027 -7.141 -2.121 23 H LEU 3 H LEU 3 6.996 -2.124 -0.073 24 HA LEU 3 HA LEU 3 7.164 0.726 0.038 25 HB2 LEU 3 HB2 LEU 3 8.496 -1.470 1.657 26 HB3 LEU 3 HB3 LEU 3 8.883 0.234 1.875 27 HG LEU 3 HG LEU 3 7.224 -0.802 3.496 28 HD11 LEU 3 HD11 LEU 3 6.021 1.304 3.683 29 HD12 LEU 3 HD12 LEU 3 7.719 1.557 3.331 30 HD13 LEU 3 HD13 LEU 3 6.524 1.770 2.037 31 HD21 LEU 3 HD23 LEU 3 5.725 -1.979 1.977 32 HD22 LEU 3 HD21 LEU 3 4.858 -0.762 2.908 33 HD23 LEU 3 HD22 LEU 3 5.251 -0.454 1.210 34 H SER 4 H SER 4 9.476 -1.808 -0.990 35 HA SER 4 HA SER 4 11.812 -0.446 -1.195 36 HB2 SER 4 HB2 SER 4 11.010 -2.270 -3.438 37 HB3 SER 4 HB3 SER 4 12.479 -2.278 -2.443 38 HG SER 4 HG SER 4 11.052 -4.049 -2.046 39 H ASP 5 H ASP 5 8.930 0.267 -3.140 40 HA ASP 5 HA ASP 5 10.289 1.474 -5.335 41 HB2 ASP 5 HB2 ASP 5 7.890 0.848 -5.328 42 HB3 ASP 5 HB3 ASP 5 7.572 2.104 -4.125 43 H TYR 6 H TYR 6 9.783 2.604 -2.040 44 HA TYR 6 HA TYR 6 10.149 5.425 -2.842 45 HB2 TYR 6 HB2 TYR 6 9.463 4.229 -0.146 46 HB3 TYR 6 HB3 TYR 6 9.400 5.932 -0.573 47 HD1 TYR 6 HD1 TYR 6 7.609 6.875 -1.903 48 HD2 TYR 6 HD2 TYR 6 7.626 2.727 -0.722 49 HE1 TYR 6 HE1 TYR 6 5.278 6.635 -2.728 50 HE2 TYR 6 HE2 TYR 6 5.301 2.477 -1.532 51 HH TYR 6 HH TYR 6 3.470 3.545 -2.540 52 H PHE 7 H PHE 7 12.142 2.895 -1.431 53 HA PHE 7 HA PHE 7 13.798 4.931 -0.004 54 HB2 PHE 7 HB2 PHE 7 13.757 1.927 0.359 55 HB3 PHE 7 HB3 PHE 7 14.788 3.061 1.210 56 HD1 PHE 7 HD1 PHE 7 11.190 2.398 0.536 57 HD2 PHE 7 HD2 PHE 7 14.060 3.677 3.477 58 HE1 PHE 7 HE1 PHE 7 9.373 2.666 2.175 59 HE2 PHE 7 HE2 PHE 7 12.210 4.054 5.072 60 HZ PHE 7 HZ PHE 7 9.885 3.515 4.463 61 HA PRO 8 HA PRO 8 16.010 4.368 -3.911 62 HB2 PRO 8 HB2 PRO 8 18.085 6.190 -3.502 63 HB3 PRO 8 HB3 PRO 8 16.450 6.573 -4.100 64 HG2 PRO 8 HG2 PRO 8 17.464 6.717 -1.242 65 HG3 PRO 8 HG3 PRO 8 16.528 7.948 -2.139 66 HD2 PRO 8 HD2 PRO 8 15.261 6.307 -0.469 67 HD3 PRO 8 HD3 PRO 8 14.551 6.611 -2.076 68 H GLU 9 H GLU 9 18.352 4.852 -1.255 69 HA GLU 9 HA GLU 9 19.545 2.245 -1.496 70 HB2 GLU 9 HB2 GLU 9 20.331 3.332 -3.647 71 HB3 GLU 9 HB3 GLU 9 21.005 4.637 -2.691 72 HG2 GLU 9 HG2 GLU 9 22.822 3.218 -3.219 73 HG3 GLU 9 HG3 GLU 9 22.461 2.885 -1.529 74 H SER 10 H SER 10 21.114 5.365 -0.890 75 HA SER 10 HA SER 10 22.163 4.598 1.611 76 HB2 SER 10 HB2 SER 10 21.630 7.477 0.842 77 HB3 SER 10 HB3 SER 10 23.062 6.795 1.619 78 HG SER 10 HG SER 10 23.654 5.911 -0.381 79 H SER 11 H SER 11 19.009 4.745 1.085 80 HA SER 11 HA SER 11 18.012 6.849 2.763 81 HB2 SER 11 HB2 SER 11 15.905 5.135 2.364 82 HB3 SER 11 HB3 SER 11 16.440 6.409 1.267 83 HG SER 11 HG SER 11 16.951 3.624 1.100 84 H ILE 12 H ILE 12 19.331 3.759 3.634 85 HA ILE 12 HA ILE 12 17.670 3.666 6.083 86 HB ILE 12 HB ILE 12 18.920 1.538 4.320 87 HG12 ILE 12 HG12 ILE 12 16.153 1.013 4.924 88 HG13 ILE 12 HG13 ILE 12 16.235 2.721 4.496 89 HG21 ILE 12 HG21 ILE 12 17.563 1.272 7.014 90 HG22 ILE 12 HG22 ILE 12 17.969 -0.088 5.916 91 HG23 ILE 12 HG23 ILE 12 19.250 0.884 6.625 92 HD11 ILE 12 HD13 ILE 12 17.246 0.391 2.860 93 HD12 ILE 12 HD11 ILE 12 15.818 1.402 2.543 94 HD13 ILE 12 HD12 ILE 12 17.451 2.114 2.433 95 H SER 13 H SER 13 18.869 3.699 8.041 96 HA SER 13 HA SER 13 21.714 2.992 8.032 97 HB2 SER 13 HB2 SER 13 20.775 5.831 8.654 98 HB3 SER 13 HB3 SER 13 22.380 5.192 9.045 99 HG SER 13 HG SER 13 21.660 4.753 6.448 100 H VAL 14 H VAL 14 22.390 2.319 9.974 101 HA VAL 14 HA VAL 14 20.614 2.626 12.351 102 HB VAL 14 HB VAL 14 22.727 0.519 11.691 103 HG11 VAL 14 HG11 VAL 14 21.048 0.884 14.222 104 HG12 VAL 14 HG12 VAL 14 22.034 -0.547 13.852 105 HG13 VAL 14 HG13 VAL 14 22.816 1.014 14.100 106 HG21 VAL 14 HG23 VAL 14 20.850 -1.087 11.853 107 HG22 VAL 14 HG21 VAL 14 19.723 0.250 12.113 108 HG23 VAL 14 HG22 VAL 14 20.582 0.089 10.560 109 H ILE 15 H ILE 15 21.519 3.749 14.018 110 HA ILE 15 HA ILE 15 24.354 4.641 13.912 111 HB ILE 15 HB ILE 15 21.805 6.285 14.187 112 HG12 ILE 15 HG12 ILE 15 23.933 6.391 12.030 113 HG13 ILE 15 HG13 ILE 15 22.228 5.948 11.853 114 HG21 ILE 15 HG21 ILE 15 23.532 7.033 15.757 115 HG22 ILE 15 HG22 ILE 15 24.666 7.301 14.415 116 HG23 ILE 15 HG23 ILE 15 23.163 8.253 14.611 117 HD11 ILE 15 HD13 ILE 15 23.351 8.711 12.486 118 HD12 ILE 15 HD11 ILE 15 22.415 8.204 11.065 119 HD13 ILE 15 HD12 ILE 15 21.642 8.305 12.669 120 H HIS 16 H HIS 16 25.176 4.964 16.049 121 HA HIS 16 HA HIS 16 23.905 3.505 18.175 122 HB2 HIS 16 HB2 HIS 16 26.159 5.553 18.201 123 HB3 HIS 16 HB3 HIS 16 25.706 4.525 19.565 124 HD1 HIS 16 HD1 HIS 16 28.164 4.531 16.864 125 HD2 HIS 16 HD2 HIS 16 25.714 1.681 18.768 126 HE1 HIS 16 HE1 HIS 16 29.191 2.258 16.366 127 H SER 17 H SER 17 24.130 7.051 17.407 128 HA SER 17 HA SER 17 21.736 7.664 18.869 129 HB2 SER 17 HB2 SER 17 22.987 9.307 20.393 130 HB3 SER 17 HB3 SER 17 23.030 7.603 20.859 131 HG SER 17 HG SER 17 25.080 8.583 21.029 132 H ALA 18 H ALA 18 21.057 9.790 18.277 133 HA ALA 18 HA ALA 18 22.585 11.053 16.069 134 HB1 ALA 18 HB3 ALA 18 20.704 12.628 15.946 135 HB2 ALA 18 HB1 ALA 18 20.109 10.971 15.834 136 HB3 ALA 18 HB2 ALA 18 19.943 11.870 17.360 137 H LYS 19 H LYS 19 23.296 13.282 16.346 138 HA LYS 19 HA LYS 19 24.593 13.846 18.795 139 HB2 LYS 19 HB2 LYS 19 25.060 14.671 16.454 140 HB3 LYS 19 HB3 LYS 19 23.836 15.909 16.741 141 HG2 LYS 19 HG2 LYS 19 25.063 16.853 18.613 142 HG3 LYS 19 HG3 LYS 19 26.115 15.428 18.712 143 HD2 LYS 19 HD2 LYS 19 27.438 17.069 17.682 144 HD3 LYS 19 HD3 LYS 19 26.946 15.920 16.431 145 HE2 LYS 19 HE2 LYS 19 24.926 17.728 16.168 146 HE3 LYS 19 HE3 LYS 19 26.139 18.807 16.865 147 HZ1 LYS 19 HZ3 LYS 19 26.327 17.229 14.374 148 HZ2 LYS 19 HZ1 LYS 19 26.295 18.861 14.494 149 HZ3 LYS 19 HZ2 LYS 19 27.620 18.052 15.004 150 H ASP 20 H ASP 20 21.489 14.938 17.467 151 HA ASP 20 HA ASP 20 20.161 15.094 19.954 152 HB2 ASP 20 HB2 ASP 20 19.610 17.325 20.141 153 HB3 ASP 20 HB3 ASP 20 21.364 17.397 19.919 154 H TRP 21 H TRP 21 17.836 16.267 19.277 155 HA TRP 21 HA TRP 21 16.821 14.712 17.194 156 HB2 TRP 21 HB2 TRP 21 14.735 15.954 17.506 157 HB3 TRP 21 HB3 TRP 21 15.433 15.399 19.019 158 HD1 TRP 21 HD1 TRP 21 16.174 17.235 20.771 159 HE1 TRP 21 HE1 TRP 21 15.878 19.759 20.952 160 HE3 TRP 21 HE3 TRP 21 14.400 18.164 16.055 161 HZ2 TRP 21 HZ2 TRP 21 15.067 21.953 19.224 162 HZ3 TRP 21 HZ3 TRP 21 13.874 20.485 15.354 163 HH2 TRP 21 HH2 TRP 21 14.263 22.381 16.907 164 H GLN 22 H GLN 22 18.069 18.096 17.015 165 HA GLN 22 HA GLN 22 17.063 18.740 14.374 166 HB2 GLN 22 HB2 GLN 22 19.589 19.629 15.780 167 HB3 GLN 22 HB3 GLN 22 18.948 20.296 14.290 168 HG2 GLN 22 HG2 GLN 22 16.982 21.149 15.358 169 HG3 GLN 22 HG3 GLN 22 17.279 20.224 16.830 170 HE21 GLN 22 HE22 GLN 22 19.297 20.679 18.032 171 HE22 GLN 22 HE21 GLN 22 19.827 22.363 18.151 172 H GLU 23 H GLU 23 20.171 17.207 15.567 173 HA GLU 23 HA GLU 23 21.161 16.580 12.981 174 HB2 GLU 23 HB2 GLU 23 22.362 16.501 15.259 175 HB3 GLU 23 HB3 GLU 23 21.581 14.922 15.484 176 HG2 GLU 23 HG2 GLU 23 23.629 14.276 14.618 177 HG3 GLU 23 HG3 GLU 23 22.678 14.322 13.164 178 H ALA 24 H ALA 24 18.953 14.803 15.125 179 HA ALA 24 HA ALA 24 19.003 12.345 13.719 180 HB1 ALA 24 HB3 ALA 24 17.066 11.782 15.034 181 HB2 ALA 24 HB1 ALA 24 18.131 12.805 16.026 182 HB3 ALA 24 HB2 ALA 24 16.670 13.493 15.301 183 H ILE 25 H ILE 25 17.027 15.299 13.201 184 HA ILE 25 HA ILE 25 15.453 14.207 11.052 185 HB ILE 25 HB ILE 25 16.345 17.078 11.441 186 HG12 ILE 25 HG12 ILE 25 14.778 15.640 13.286 187 HG13 ILE 25 HG13 ILE 25 15.053 17.367 13.199 188 HG21 ILE 25 HG21 ILE 25 15.463 16.601 9.200 189 HG22 ILE 25 HG22 ILE 25 13.984 15.938 9.890 190 HG23 ILE 25 HG23 ILE 25 14.383 17.666 10.067 191 HD11 ILE 25 HD13 ILE 25 12.788 15.821 11.928 192 HD12 ILE 25 HD11 ILE 25 12.693 16.844 13.383 193 HD13 ILE 25 HD12 ILE 25 13.005 17.602 11.823 194 H ASP 26 H ASP 26 18.603 16.010 11.166 195 HA ASP 26 HA ASP 26 18.981 16.170 8.366 196 HB2 ASP 26 HB2 ASP 26 20.332 17.443 9.969 197 HB3 ASP 26 HB3 ASP 26 21.065 15.958 10.576 198 H PHE 27 H PHE 27 20.139 13.682 10.688 199 HA PHE 27 HA PHE 27 21.277 11.931 8.780 200 HB2 PHE 27 HB2 PHE 27 20.233 11.632 11.610 201 HB3 PHE 27 HB3 PHE 27 20.617 10.199 10.686 202 HD1 PHE 27 HD1 PHE 27 22.979 10.509 9.267 203 HD2 PHE 27 HD2 PHE 27 22.061 12.170 13.169 204 HE1 PHE 27 HE1 PHE 27 25.384 10.544 9.834 205 HE2 PHE 27 HE2 PHE 27 24.456 12.150 13.715 206 HZ PHE 27 HZ PHE 27 26.130 11.359 12.064 207 H SER 28 H SER 28 17.835 12.458 9.659 208 HA SER 28 HA SER 28 17.064 10.011 8.232 209 HB2 SER 28 HB2 SER 28 15.360 12.209 9.473 210 HB3 SER 28 HB3 SER 28 14.794 10.636 8.877 211 HG SER 28 HG SER 28 16.470 11.224 11.085 212 H MET 29 H MET 29 17.796 13.225 7.225 213 HA MET 29 HA MET 29 16.045 12.820 4.828 214 HB2 MET 29 HB2 MET 29 17.062 15.363 6.080 215 HB3 MET 29 HB3 MET 29 15.929 15.190 4.716 216 HG2 MET 29 HG2 MET 29 15.069 14.098 7.361 217 HG3 MET 29 HG3 MET 29 15.134 15.839 7.118 218 HE1 MET 29 HE3 MET 29 13.054 12.773 6.771 219 HE2 MET 29 HE1 MET 29 12.226 12.923 5.197 220 HE3 MET 29 HE2 MET 29 13.993 12.641 5.246 221 H VAL 30 H VAL 30 19.421 13.415 5.836 222 HA VAL 30 HA VAL 30 20.260 14.713 3.547 223 HB VAL 30 HB VAL 30 21.649 14.447 5.522 224 HG11 VAL 30 HG11 VAL 30 22.172 11.570 4.638 225 HG12 VAL 30 HG12 VAL 30 22.933 12.427 5.992 226 HG13 VAL 30 HG13 VAL 30 21.208 12.045 6.055 227 HG21 VAL 30 HG23 VAL 30 22.652 15.054 3.333 228 HG22 VAL 30 HG21 VAL 30 23.796 14.183 4.374 229 HG23 VAL 30 HG22 VAL 30 23.005 13.352 3.014 230 H SER 31 H SER 31 19.796 11.157 3.942 231 HA SER 31 HA SER 31 20.938 10.425 1.501 232 HB2 SER 31 HB2 SER 31 18.554 9.128 2.891 233 HB3 SER 31 HB3 SER 31 19.741 8.349 1.828 234 HG SER 31 HG SER 31 20.545 7.916 3.753 235 H LEU 32 H LEU 32 17.843 11.980 2.102 236 HA LEU 32 HA LEU 32 16.817 11.378 -0.611 237 HB2 LEU 32 HB2 LEU 32 15.702 12.836 1.832 238 HB3 LEU 32 HB3 LEU 32 14.875 12.833 0.297 239 HG LEU 32 HG LEU 32 15.575 10.323 1.877 240 HD11 LEU 32 HD11 LEU 32 13.204 10.210 2.436 241 HD12 LEU 32 HD12 LEU 32 13.875 11.746 2.995 242 HD13 LEU 32 HD13 LEU 32 12.883 11.701 1.523 243 HD21 LEU 32 HD23 LEU 32 13.830 10.684 -0.608 244 HD22 LEU 32 HD21 LEU 32 15.378 9.809 -0.532 245 HD23 LEU 32 HD22 LEU 32 13.985 9.192 0.334 246 H LEU 33 H LEU 33 18.047 14.069 1.412 247 HA LEU 33 HA LEU 33 17.792 16.173 -0.387 248 HB2 LEU 33 HB2 LEU 33 18.496 16.304 2.001 249 HB3 LEU 33 HB3 LEU 33 20.051 15.610 1.554 250 HG LEU 33 HG LEU 33 20.521 17.625 0.125 251 HD11 LEU 33 HD11 LEU 33 18.236 18.353 -0.361 252 HD12 LEU 33 HD12 LEU 33 17.953 18.694 1.361 253 HD13 LEU 33 HD13 LEU 33 19.145 19.631 0.428 254 HD21 LEU 33 HD23 LEU 33 21.315 17.345 2.464 255 HD22 LEU 33 HD21 LEU 33 21.111 19.021 1.976 256 HD23 LEU 33 HD22 LEU 33 19.896 18.251 3.026 257 H ASP 34 H ASP 34 20.376 13.745 -0.027 258 HA ASP 34 HA ASP 34 22.248 14.799 -1.818 259 HB2 ASP 34 HB2 ASP 34 22.783 13.150 -0.095 260 HB3 ASP 34 HB3 ASP 34 21.736 11.951 -0.857 261 H LYS 35 H LYS 35 19.480 12.661 -2.493 262 HA LYS 35 HA LYS 35 20.325 12.566 -5.360 263 HB2 LYS 35 HB2 LYS 35 17.777 11.329 -4.542 264 HB3 LYS 35 HB3 LYS 35 18.927 10.814 -5.749 265 HG2 LYS 35 HG2 LYS 35 19.049 10.416 -2.754 266 HG3 LYS 35 HG3 LYS 35 18.717 9.183 -3.960 267 HD2 LYS 35 HD2 LYS 35 20.995 9.228 -4.783 268 HD3 LYS 35 HD3 LYS 35 21.387 10.623 -3.754 269 HE2 LYS 35 HE2 LYS 35 20.651 9.247 -1.757 270 HE3 LYS 35 HE3 LYS 35 20.564 7.836 -2.822 271 HZ1 LYS 35 HZ3 LYS 35 22.712 7.963 -1.682 272 HZ2 LYS 35 HZ1 LYS 35 22.934 8.129 -3.293 273 HZ3 LYS 35 HZ2 LYS 35 23.006 9.458 -2.332 274 H ASN 36 H ASN 36 19.208 14.952 -3.698 275 HA ASN 36 HA ASN 36 17.703 16.524 -3.741 276 HB2 ASN 36 HB2 ASN 36 17.199 17.668 -5.889 277 HB3 ASN 36 HB3 ASN 36 18.867 17.496 -5.406 278 HD21 ASN 36 HD22 ASN 36 20.198 15.951 -6.451 279 HD22 ASN 36 HD21 ASN 36 19.877 15.459 -8.103 280 H TYR 37 H TYR 37 16.400 14.199 -3.119 281 HA TYR 37 HA TYR 37 13.778 14.142 -4.458 282 HB2 TYR 37 HB2 TYR 37 14.857 13.133 -1.804 283 HB3 TYR 37 HB3 TYR 37 13.146 13.127 -2.128 284 HD1 TYR 37 HD1 TYR 37 12.102 11.562 -3.615 285 HD2 TYR 37 HD2 TYR 37 16.362 11.452 -2.905 286 HE1 TYR 37 HE1 TYR 37 12.251 9.401 -4.818 287 HE2 TYR 37 HE2 TYR 37 16.483 9.274 -4.076 288 HH TYR 37 HH TYR 37 13.622 7.682 -5.533 289 H ILE 38 H ILE 38 15.433 16.198 -2.212 290 HA ILE 38 HA ILE 38 13.073 17.866 -1.717 291 HB ILE 38 HB ILE 38 13.688 17.950 0.708 292 HG12 ILE 38 HG12 ILE 38 15.452 15.535 0.091 293 HG13 ILE 38 HG13 ILE 38 16.026 17.162 0.472 294 HG21 ILE 38 HG21 ILE 38 11.802 16.533 -0.026 295 HG22 ILE 38 HG22 ILE 38 12.897 15.138 -0.152 296 HG23 ILE 38 HG23 ILE 38 12.581 15.905 1.405 297 HD11 ILE 38 HD13 ILE 38 15.044 16.981 2.727 298 HD12 ILE 38 HD11 ILE 38 14.593 15.289 2.365 299 HD13 ILE 38 HD12 ILE 38 16.296 15.775 2.349 300 H SER 39 H SER 39 13.878 19.965 -0.641 301 HA SER 39 HA SER 39 16.681 20.647 -1.390 302 HB2 SER 39 HB2 SER 39 15.874 22.984 -1.272 303 HB3 SER 39 HB3 SER 39 14.994 22.028 -2.474 304 HG SER 39 HG SER 39 13.598 23.292 -1.193 305 H GLU 40 H GLU 40 17.695 22.253 0.243 306 HA GLU 40 HA GLU 40 17.902 20.914 2.733 307 HB2 GLU 40 HB2 GLU 40 18.808 23.707 1.922 308 HB3 GLU 40 HB3 GLU 40 19.319 22.848 3.383 309 HG2 GLU 40 HG2 GLU 40 20.268 21.026 1.964 310 HG3 GLU 40 HG3 GLU 40 19.827 21.918 0.518 311 H ASN 41 H ASN 41 15.848 23.647 1.784 312 HA ASN 41 HA ASN 41 15.103 24.537 4.414 313 HB2 ASN 41 HB2 ASN 41 14.545 25.785 2.326 314 HB3 ASN 41 HB3 ASN 41 13.481 24.471 1.811 315 HD21 ASN 41 HD22 ASN 41 11.345 24.274 2.805 316 HD22 ASN 41 HD21 ASN 41 10.765 25.508 3.896 317 H TYR 42 H TYR 42 14.060 21.710 2.492 318 HA TYR 42 HA TYR 42 11.622 21.221 3.850 319 HB2 TYR 42 HB2 TYR 42 12.396 20.185 1.705 320 HB3 TYR 42 HB3 TYR 42 13.565 19.237 2.622 321 HD1 TYR 42 HD1 TYR 42 9.950 19.763 1.979 322 HD2 TYR 42 HD2 TYR 42 12.920 17.291 3.892 323 HE1 TYR 42 HE1 TYR 42 8.266 17.951 2.264 324 HE2 TYR 42 HE2 TYR 42 11.257 15.492 4.175 325 HH TYR 42 HH TYR 42 9.105 14.763 3.742 326 H ILE 43 H ILE 43 14.981 20.133 4.553 327 HA ILE 43 HA ILE 43 14.423 18.538 6.834 328 HB ILE 43 HB ILE 43 16.846 20.224 6.034 329 HG12 ILE 43 HG12 ILE 43 17.590 17.560 5.974 330 HG13 ILE 43 HG13 ILE 43 15.897 17.458 5.486 331 HG21 ILE 43 HG21 ILE 43 16.942 19.975 8.455 332 HG22 ILE 43 HG22 ILE 43 16.712 18.212 8.302 333 HG23 ILE 43 HG23 ILE 43 18.177 18.994 7.670 334 HD11 ILE 43 HD13 ILE 43 16.349 19.019 3.629 335 HD12 ILE 43 HD11 ILE 43 18.038 19.173 4.188 336 HD13 ILE 43 HD12 ILE 43 17.439 17.614 3.592 337 H GLN 44 H GLN 44 15.096 22.085 6.577 338 HA GLN 44 HA GLN 44 14.819 22.363 9.410 339 HB2 GLN 44 HB2 GLN 44 16.160 23.838 7.712 340 HB3 GLN 44 HB3 GLN 44 14.649 24.700 7.492 341 HG2 GLN 44 HG2 GLN 44 16.032 25.791 9.236 342 HG3 GLN 44 HG3 GLN 44 14.583 25.135 9.983 343 HE21 GLN 44 HE22 GLN 44 15.085 24.219 12.023 344 HE22 GLN 44 HE21 GLN 44 16.491 23.235 12.342 345 H ALA 45 H ALA 45 12.456 22.484 6.799 346 HA ALA 45 HA ALA 45 10.361 23.749 8.221 347 HB1 ALA 45 HB3 ALA 45 8.860 22.641 6.649 348 HB2 ALA 45 HB1 ALA 45 10.298 23.224 5.780 349 HB3 ALA 45 HB2 ALA 45 10.113 21.494 6.176 350 H ILE 46 H ILE 46 11.397 20.272 8.126 351 HA ILE 46 HA ILE 46 9.266 19.351 9.815 352 HB ILE 46 HB ILE 46 12.071 18.202 9.480 353 HG12 ILE 46 HG12 ILE 46 9.521 17.620 7.938 354 HG13 ILE 46 HG13 ILE 46 10.951 18.390 7.289 355 HG21 ILE 46 HG21 ILE 46 9.495 16.778 10.285 356 HG22 ILE 46 HG22 ILE 46 11.168 16.155 10.295 357 HG23 ILE 46 HG23 ILE 46 10.680 17.369 11.465 358 HD11 ILE 46 HD13 ILE 46 10.964 16.138 6.536 359 HD12 ILE 46 HD11 ILE 46 12.240 16.296 7.770 360 HD13 ILE 46 HD12 ILE 46 10.701 15.497 8.158 361 H LYS 47 H LYS 47 12.635 20.480 10.468 362 HA LYS 47 HA LYS 47 12.503 20.044 13.265 363 HB2 LYS 47 HB2 LYS 47 14.050 22.056 11.600 364 HB3 LYS 47 HB3 LYS 47 14.342 21.819 13.326 365 HG2 LYS 47 HG2 LYS 47 15.124 19.577 12.999 366 HG3 LYS 47 HG3 LYS 47 14.589 19.548 11.305 367 HD2 LYS 47 HD2 LYS 47 16.178 21.328 10.747 368 HD3 LYS 47 HD3 LYS 47 16.734 21.376 12.446 369 HE2 LYS 47 HE2 LYS 47 17.481 19.038 12.197 370 HE3 LYS 47 HE3 LYS 47 17.012 19.054 10.501 371 HZ1 LYS 47 HZ3 LYS 47 19.087 20.812 11.724 372 HZ2 LYS 47 HZ1 LYS 47 19.377 19.538 10.759 373 HZ3 LYS 47 HZ2 LYS 47 18.643 20.870 10.160 374 H ASP 48 H ASP 48 11.494 22.903 11.291 375 HA ASP 48 HA ASP 48 10.826 24.576 13.474 376 HB2 ASP 48 HB2 ASP 48 11.062 25.449 11.229 377 HB3 ASP 48 HB3 ASP 48 9.718 24.463 10.650 378 H SER 49 H SER 49 8.750 22.203 11.648 379 HA SER 49 HA SER 49 6.422 22.553 13.238 380 HB2 SER 49 HB2 SER 49 7.487 20.030 11.897 381 HB3 SER 49 HB3 SER 49 5.834 20.283 12.482 382 HG SER 49 HG SER 49 6.044 20.717 10.238 383 H THR 50 H THR 50 9.364 20.582 13.766 384 HA THR 50 HA THR 50 8.440 19.271 16.096 385 HB THR 50 HB THR 50 11.305 19.872 15.285 386 HG1 THR 50 HG1 THR 50 10.169 18.798 13.637 387 HG21 THR 50 HG23 THR 50 11.782 17.763 16.494 388 HG22 THR 50 HG21 THR 50 11.195 19.049 17.554 389 HG23 THR 50 HG22 THR 50 10.092 17.735 17.074 390 H ILE 51 H ILE 51 10.206 22.413 15.734 391 HA ILE 51 HA ILE 51 10.346 22.958 18.540 392 HB ILE 51 HB ILE 51 10.227 24.784 16.102 393 HG12 ILE 51 HG12 ILE 51 12.586 24.064 17.901 394 HG13 ILE 51 HG13 ILE 51 12.205 23.198 16.422 395 HG21 ILE 51 HG21 ILE 51 10.888 25.561 18.979 396 HG22 ILE 51 HG22 ILE 51 11.067 26.612 17.557 397 HG23 ILE 51 HG23 ILE 51 9.469 26.095 18.051 398 HD11 ILE 51 HD13 ILE 51 13.026 26.115 16.601 399 HD12 ILE 51 HD11 ILE 51 13.937 24.763 15.918 400 HD13 ILE 51 HD12 ILE 51 12.456 25.315 15.115 401 H ASN 52 H ASN 52 7.823 23.602 16.082 402 HA ASN 52 HA ASN 52 6.215 25.256 17.771 403 HB2 ASN 52 HB2 ASN 52 5.814 23.834 15.124 404 HB3 ASN 52 HB3 ASN 52 4.411 24.466 15.943 405 HD21 ASN 52 HD22 ASN 52 7.552 25.447 14.534 406 HD22 ASN 52 HD21 ASN 52 7.129 27.132 14.351 407 H ASN 53 H ASN 53 6.046 21.751 17.057 408 HA ASN 53 HA ASN 53 3.768 21.513 18.992 409 HB2 ASN 53 HB2 ASN 53 3.298 21.757 16.441 410 HB3 ASN 53 HB3 ASN 53 4.003 20.151 16.287 411 HD21 ASN 53 HD22 ASN 53 1.710 20.147 15.296 412 HD22 ASN 53 HD21 ASN 53 0.421 19.580 16.335 413 H GLY 54 H GLY 54 6.871 20.519 18.607 414 HA2 GLY 54 HA2 GLY 54 8.042 18.681 19.418 415 HA3 GLY 54 HA3 GLY 54 6.530 17.969 19.995 416 HA PRO 55 HA PRO 55 7.878 15.771 16.057 417 HB2 PRO 55 HB2 PRO 55 7.587 13.194 16.936 418 HB3 PRO 55 HB3 PRO 55 9.084 14.135 17.153 419 HG2 PRO 55 HG2 PRO 55 6.883 13.658 19.156 420 HG3 PRO 55 HG3 PRO 55 8.654 13.606 19.398 421 HD2 PRO 55 HD2 PRO 55 7.064 15.779 20.046 422 HD3 PRO 55 HD3 PRO 55 8.765 15.970 19.550 423 H TYR 56 H TYR 56 6.147 16.218 14.838 424 HA TYR 56 HA TYR 56 3.469 15.815 15.903 425 HB2 TYR 56 HB2 TYR 56 2.719 17.361 14.417 426 HB3 TYR 56 HB3 TYR 56 4.323 17.936 14.803 427 HD1 TYR 56 HD1 TYR 56 6.241 16.926 13.035 428 HD2 TYR 56 HD2 TYR 56 2.044 17.564 12.223 429 HE1 TYR 56 HE1 TYR 56 6.714 16.943 10.619 430 HE2 TYR 56 HE2 TYR 56 2.526 17.649 9.800 431 HH TYR 56 HH TYR 56 5.823 17.010 8.528 432 H TYR 57 H TYR 57 5.412 13.713 14.332 433 HA TYR 57 HA TYR 57 3.098 12.103 13.442 434 HB2 TYR 57 HB2 TYR 57 5.588 12.700 11.871 435 HB3 TYR 57 HB3 TYR 57 4.943 11.068 11.857 436 HD1 TYR 57 HD2 TYR 57 4.121 14.590 10.968 437 HD2 TYR 57 HD1 TYR 57 3.016 10.437 10.613 438 HE1 TYR 57 HE2 TYR 57 2.533 15.171 9.159 439 HE2 TYR 57 HE1 TYR 57 1.429 11.005 8.803 440 HH TYR 57 HH TYR 57 0.945 14.378 7.651 441 H ILE 58 H ILE 58 3.022 10.590 14.942 442 HA ILE 58 HA ILE 58 5.360 9.134 15.926 443 HB ILE 58 HB ILE 58 3.422 10.679 17.704 444 HG12 ILE 58 HG12 ILE 58 5.522 11.870 17.047 445 HG13 ILE 58 HG13 ILE 58 5.298 11.658 18.773 446 HG21 ILE 58 HG21 ILE 58 5.186 8.313 18.474 447 HG22 ILE 58 HG22 ILE 58 4.494 9.462 19.646 448 HG23 ILE 58 HG23 ILE 58 3.430 8.473 18.649 449 HD11 ILE 58 HD13 ILE 58 7.652 11.285 18.082 450 HD12 ILE 58 HD11 ILE 58 6.959 9.852 18.830 451 HD13 ILE 58 HD12 ILE 58 7.136 9.930 17.064 452 H LEU 59 H LEU 59 4.734 7.019 16.063 453 HA LEU 59 HA LEU 59 1.852 6.424 15.444 454 HB2 LEU 59 HB2 LEU 59 4.322 5.319 14.124 455 HB3 LEU 59 HB3 LEU 59 2.675 4.727 13.913 456 HG LEU 59 HG LEU 59 2.336 7.482 13.544 457 HD11 LEU 59 HD11 LEU 59 4.921 6.754 12.127 458 HD12 LEU 59 HD12 LEU 59 4.017 8.283 12.023 459 HD13 LEU 59 HD13 LEU 59 4.809 7.818 13.522 460 HD21 LEU 59 HD23 LEU 59 2.755 5.450 11.364 461 HD22 LEU 59 HD21 LEU 59 1.277 5.721 12.324 462 HD23 LEU 59 HD22 LEU 59 1.889 7.002 11.266 463 H ALA 60 H ALA 60 4.710 5.584 17.271 464 HA ALA 60 HA ALA 60 3.195 3.823 18.930 465 HB1 ALA 60 HB3 ALA 60 5.545 2.704 17.317 466 HB2 ALA 60 HB1 ALA 60 4.833 1.894 18.715 467 HB3 ALA 60 HB2 ALA 60 3.863 2.147 17.258 468 HA PRO 61 HA PRO 61 6.181 5.691 21.710 469 HB2 PRO 61 HB2 PRO 61 6.920 3.616 23.423 470 HB3 PRO 61 HB3 PRO 61 5.428 4.597 23.557 471 HG2 PRO 61 HG2 PRO 61 5.776 1.877 22.282 472 HG3 PRO 61 HG3 PRO 61 4.468 2.437 23.374 473 HD2 PRO 61 HD2 PRO 61 4.106 2.346 20.703 474 HD3 PRO 61 HD3 PRO 61 3.459 3.716 21.648 475 H GLY 62 H GLY 62 8.182 6.255 21.062 476 HA2 GLY 62 HA2 GLY 62 10.446 5.980 20.631 477 HA3 GLY 62 HA3 GLY 62 10.244 4.236 20.500 478 H VAL 63 H VAL 63 7.858 5.692 18.493 479 HA VAL 63 HA VAL 63 9.663 5.405 16.130 480 HB VAL 63 HB VAL 63 6.862 4.262 16.334 481 HG11 VAL 63 HG11 VAL 63 7.390 3.051 14.339 482 HG12 VAL 63 HG12 VAL 63 7.995 4.699 14.075 483 HG13 VAL 63 HG13 VAL 63 9.126 3.413 14.497 484 HG21 VAL 63 HG23 VAL 63 9.478 2.780 16.873 485 HG22 VAL 63 HG21 VAL 63 8.131 3.014 18.012 486 HG23 VAL 63 HG22 VAL 63 7.901 2.007 16.596 487 H ALA 64 H ALA 64 9.601 7.158 14.909 488 HA ALA 64 HA ALA 64 7.162 8.871 14.824 489 HB1 ALA 64 HB3 ALA 64 10.084 9.674 14.453 490 HB2 ALA 64 HB1 ALA 64 8.679 10.763 14.451 491 HB3 ALA 64 HB2 ALA 64 9.151 9.934 15.940 492 H MET 65 H MET 65 6.928 10.041 12.749 493 HA MET 65 HA MET 65 8.331 8.830 10.488 494 HB2 MET 65 HB2 MET 65 6.266 7.564 10.673 495 HB3 MET 65 HB3 MET 65 5.348 9.071 10.449 496 HG2 MET 65 HG2 MET 65 7.011 9.083 8.253 497 HG3 MET 65 HG3 MET 65 6.806 7.355 8.515 498 HE1 MET 65 HE3 MET 65 2.788 7.151 8.341 499 HE2 MET 65 HE1 MET 65 4.270 6.248 8.733 500 HE3 MET 65 HE2 MET 65 3.693 7.552 9.813 501 HA PRO 66 HA PRO 66 8.102 13.466 11.385 502 HB2 PRO 66 HB2 PRO 66 10.573 13.350 9.627 503 HB3 PRO 66 HB3 PRO 66 10.194 14.406 11.039 504 HG2 PRO 66 HG2 PRO 66 11.690 12.197 11.372 505 HG3 PRO 66 HG3 PRO 66 10.427 12.636 12.568 506 HD2 PRO 66 HD2 PRO 66 10.314 10.571 10.380 507 HD3 PRO 66 HD3 PRO 66 9.689 10.495 12.046 508 H HIS 67 H HIS 67 9.390 13.411 8.085 509 HA HIS 67 HA HIS 67 8.770 14.423 6.173 510 HB2 HIS 67 HB2 HIS 67 7.361 12.672 5.778 511 HB3 HIS 67 HB3 HIS 67 6.277 13.057 7.085 512 HD1 HIS 67 HD1 HIS 67 4.329 14.782 6.663 513 HD2 HIS 67 HD2 HIS 67 6.709 13.835 3.301 514 HE1 HIS 67 HE1 HIS 67 3.013 15.497 4.606 515 H ALA 68 H ALA 68 7.501 16.172 5.041 516 HA ALA 68 HA ALA 68 6.155 18.184 6.680 517 HB1 ALA 68 HB3 ALA 68 8.376 19.122 6.824 518 HB2 ALA 68 HB1 ALA 68 8.687 18.800 5.101 519 HB3 ALA 68 HB2 ALA 68 7.491 20.012 5.594 520 H ARG 69 H ARG 69 4.875 19.570 5.271 521 HA ARG 69 HA ARG 69 3.537 18.180 3.241 522 HB2 ARG 69 HB2 ARG 69 3.931 21.163 3.669 523 HB3 ARG 69 HB3 ARG 69 2.857 20.495 2.431 524 HG2 ARG 69 HG2 ARG 69 1.503 19.398 4.228 525 HG3 ARG 69 HG3 ARG 69 2.524 20.221 5.444 526 HD2 ARG 69 HD2 ARG 69 1.990 22.412 4.369 527 HD3 ARG 69 HD3 ARG 69 0.967 21.567 3.190 528 HE ARG 69 HE ARG 69 0.069 20.979 5.830 529 HH11 ARG 69 HH11 ARG 69 0.183 23.609 3.419 530 HH12 ARG 69 HH12 ARG 69 -1.243 24.396 4.017 531 HH21 ARG 69 HH21 ARG 69 -1.839 22.038 6.611 532 HH22 ARG 69 HH22 ARG 69 -2.415 23.479 5.864 533 HA PRO 70 HA PRO 70 6.160 18.124 -0.345 534 HB2 PRO 70 HB2 PRO 70 3.694 19.263 -1.742 535 HB3 PRO 70 HB3 PRO 70 4.811 18.011 -2.337 536 HG2 PRO 70 HG2 PRO 70 2.457 17.304 -1.201 537 HG3 PRO 70 HG3 PRO 70 3.941 16.408 -0.749 538 HD2 PRO 70 HD2 PRO 70 2.507 18.562 0.793 539 HD3 PRO 70 HD3 PRO 70 3.317 17.079 1.382 540 H GLU 71 H GLU 71 4.053 21.037 0.001 541 HA GLU 71 HA GLU 71 5.512 22.820 -1.576 542 HB2 GLU 71 HB2 GLU 71 4.184 24.547 -0.581 543 HB3 GLU 71 HB3 GLU 71 3.174 23.120 -0.795 544 HG2 GLU 71 HG2 GLU 71 3.464 22.571 1.621 545 HG3 GLU 71 HG3 GLU 71 4.434 24.024 1.840 546 H CYS 72 H CYS 72 6.577 21.512 1.409 547 HA CYS 72 HA CYS 72 8.019 23.896 2.333 548 HB2 CYS 72 HB2 CYS 72 8.087 20.992 3.275 549 HB3 CYS 72 HB3 CYS 72 8.884 22.363 4.060 550 HG CYS 72 HG CYS 72 5.683 21.901 3.436 551 H GLY 73 H GLY 73 8.557 21.753 -0.200 552 HA2 GLY 73 HA2 GLY 73 10.620 22.459 -1.418 553 HA3 GLY 73 HA3 GLY 73 11.533 22.059 0.041 554 H ALA 74 H ALA 74 8.825 19.931 -0.866 555 HA ALA 74 HA ALA 74 10.704 17.743 -1.385 556 HB1 ALA 74 HB3 ALA 74 8.743 16.423 -1.836 557 HB2 ALA 74 HB1 ALA 74 8.480 17.334 -0.335 558 HB3 ALA 74 HB2 ALA 74 7.725 17.874 -1.866 559 H LEU 75 H LEU 75 11.076 16.812 -3.383 560 HA LEU 75 HA LEU 75 10.371 18.402 -5.816 561 HB2 LEU 75 HB2 LEU 75 13.043 17.138 -5.109 562 HB3 LEU 75 HB3 LEU 75 12.678 17.980 -6.604 563 HG LEU 75 HG LEU 75 12.714 19.276 -3.842 564 HD11 LEU 75 HD11 LEU 75 14.950 18.526 -4.543 565 HD12 LEU 75 HD12 LEU 75 14.772 19.387 -6.083 566 HD13 LEU 75 HD13 LEU 75 14.835 20.290 -4.550 567 HD21 LEU 75 HD23 LEU 75 12.538 20.528 -6.624 568 HD22 LEU 75 HD21 LEU 75 11.238 20.491 -5.417 569 HD23 LEU 75 HD22 LEU 75 12.705 21.415 -5.091 570 H LYS 76 H LYS 76 11.112 15.232 -4.373 571 HA LYS 76 HA LYS 76 9.761 13.899 -6.606 572 HB2 LYS 76 HB2 LYS 76 12.363 12.895 -5.427 573 HB3 LYS 76 HB3 LYS 76 11.482 12.187 -6.776 574 HG2 LYS 76 HG2 LYS 76 12.111 14.117 -8.192 575 HG3 LYS 76 HG3 LYS 76 12.883 14.904 -6.801 576 HD2 LYS 76 HD2 LYS 76 14.436 12.936 -6.594 577 HD3 LYS 76 HD3 LYS 76 13.796 12.336 -8.144 578 HE2 LYS 76 HE2 LYS 76 14.483 14.431 -9.255 579 HE3 LYS 76 HE3 LYS 76 14.963 15.124 -7.700 580 HZ1 LYS 76 HZ3 LYS 76 16.875 14.395 -8.798 581 HZ2 LYS 76 HZ1 LYS 76 16.674 13.398 -7.538 582 HZ3 LYS 76 HZ2 LYS 76 16.304 12.869 -9.061 583 H THR 77 H THR 77 9.044 11.627 -5.846 584 HA THR 77 HA THR 77 8.410 11.740 -3.028 585 HB THR 77 HB THR 77 7.378 10.184 -5.410 586 HG1 THR 77 HG1 THR 77 5.995 11.705 -5.582 587 HG21 THR 77 HG23 THR 77 7.040 8.896 -3.348 588 HG22 THR 77 HG21 THR 77 6.305 10.321 -2.568 589 HG23 THR 77 HG22 THR 77 5.511 9.527 -3.960 590 H GLY 78 H GLY 78 9.437 10.487 -1.513 591 HA2 GLY 78 HA2 GLY 78 10.498 7.868 -2.023 592 HA3 GLY 78 HA3 GLY 78 11.783 9.083 -1.970 593 H MET 79 H MET 79 12.134 7.384 -0.027 594 HA MET 79 HA MET 79 11.116 8.552 2.500 595 HB2 MET 79 HB2 MET 79 10.826 5.675 1.550 596 HB3 MET 79 HB3 MET 79 10.668 6.142 3.241 597 HG2 MET 79 HG2 MET 79 8.720 7.439 2.843 598 HG3 MET 79 HG3 MET 79 8.889 7.296 1.089 599 HE1 MET 79 HE3 MET 79 6.025 6.467 2.176 600 HE2 MET 79 HE1 MET 79 6.709 6.486 0.539 601 HE3 MET 79 HE2 MET 79 5.892 5.029 1.138 602 H SER 80 H SER 80 12.177 7.467 4.390 603 HA SER 80 HA SER 80 14.796 6.248 3.929 604 HB2 SER 80 HB2 SER 80 15.762 8.058 5.538 605 HB3 SER 80 HB3 SER 80 15.563 8.453 3.825 606 HG SER 80 HG SER 80 14.770 9.995 5.488 607 H LEU 81 H LEU 81 15.779 5.625 6.068 608 HA LEU 81 HA LEU 81 13.792 4.973 8.148 609 HB2 LEU 81 HB2 LEU 81 13.802 3.258 6.277 610 HB3 LEU 81 HB3 LEU 81 15.500 2.968 6.569 611 HG LEU 81 HG LEU 81 15.059 1.993 8.725 612 HD11 LEU 81 HD11 LEU 81 12.705 1.673 9.521 613 HD12 LEU 81 HD12 LEU 81 13.231 3.369 9.563 614 HD13 LEU 81 HD13 LEU 81 12.204 2.790 8.234 615 HD21 LEU 81 HD23 LEU 81 14.628 0.704 6.521 616 HD22 LEU 81 HD21 LEU 81 13.800 0.042 7.954 617 HD23 LEU 81 HD22 LEU 81 12.919 1.032 6.782 618 H THR 82 H THR 82 14.993 6.277 9.643 619 HA THR 82 HA THR 82 17.841 5.562 10.130 620 HB THR 82 HB THR 82 16.138 7.706 11.466 621 HG1 THR 82 HG1 THR 82 16.667 9.050 9.966 622 HG21 THR 82 HG23 THR 82 18.368 8.796 11.840 623 HG22 THR 82 HG21 THR 82 18.220 7.249 12.677 624 HG23 THR 82 HG22 THR 82 19.163 7.347 11.176 625 H LEU 83 H LEU 83 18.480 4.637 12.105 626 HA LEU 83 HA LEU 83 16.434 4.342 14.216 627 HB2 LEU 83 HB2 LEU 83 16.683 2.117 12.987 628 HB3 LEU 83 HB3 LEU 83 18.402 2.170 13.364 629 HG LEU 83 HG LEU 83 17.661 2.312 15.860 630 HD11 LEU 83 HD11 LEU 83 15.500 1.304 16.400 631 HD12 LEU 83 HD12 LEU 83 15.258 2.765 15.435 632 HD13 LEU 83 HD13 LEU 83 15.091 1.150 14.682 633 HD21 LEU 83 HD23 LEU 83 17.105 -0.195 14.249 634 HD22 LEU 83 HD21 LEU 83 18.708 0.318 14.831 635 HD23 LEU 83 HD22 LEU 83 17.450 -0.146 15.991 636 H LEU 84 H LEU 84 17.296 4.816 16.177 637 HA LEU 84 HA LEU 84 20.230 5.350 16.471 638 HB2 LEU 84 HB2 LEU 84 17.858 6.686 17.858 639 HB3 LEU 84 HB3 LEU 84 19.538 6.872 18.318 640 HG LEU 84 HG LEU 84 19.166 8.819 17.231 641 HD11 LEU 84 HD11 LEU 84 20.347 8.836 15.129 642 HD12 LEU 84 HD12 LEU 84 21.061 7.558 16.137 643 HD13 LEU 84 HD13 LEU 84 19.929 7.150 14.822 644 HD21 LEU 84 HD23 LEU 84 16.884 8.365 16.507 645 HD22 LEU 84 HD21 LEU 84 17.815 9.155 15.222 646 HD23 LEU 84 HD22 LEU 84 17.477 7.413 15.132 647 H GLU 85 H GLU 85 21.003 3.636 17.705 648 HA GLU 85 HA GLU 85 19.215 1.867 18.991 649 HB2 GLU 85 HB2 GLU 85 22.209 2.196 18.956 650 HB3 GLU 85 HB3 GLU 85 21.502 1.074 20.116 651 HG2 GLU 85 HG2 GLU 85 20.800 0.942 17.158 652 HG3 GLU 85 HG3 GLU 85 22.213 0.138 17.835 653 H GLN 86 H GLN 86 20.984 4.625 20.269 654 HA GLN 86 HA GLN 86 20.084 4.144 23.038 655 HB2 GLN 86 HB2 GLN 86 21.435 6.507 21.681 656 HB3 GLN 86 HB3 GLN 86 21.111 6.426 23.399 657 HG2 GLN 86 HG2 GLN 86 22.835 4.389 21.926 658 HG3 GLN 86 HG3 GLN 86 23.469 5.789 22.786 659 HE21 GLN 86 HE22 GLN 86 22.620 2.489 23.112 660 HE22 GLN 86 HE21 GLN 86 22.620 2.406 24.855 661 H GLY 87 H GLY 87 18.695 5.445 20.176 662 HA2 GLY 87 HA2 GLY 87 16.907 6.787 19.741 663 HA3 GLY 87 HA3 GLY 87 16.465 6.750 21.451 664 H VAL 88 H VAL 88 16.055 9.135 20.310 665 HA VAL 88 HA VAL 88 17.876 10.729 21.906 666 HB VAL 88 HB VAL 88 18.509 10.682 19.251 667 HG11 VAL 88 HG11 VAL 88 17.691 12.610 18.105 668 HG12 VAL 88 HG12 VAL 88 16.343 11.525 18.518 669 HG13 VAL 88 HG13 VAL 88 16.611 13.037 19.431 670 HG21 VAL 88 HG23 VAL 88 18.733 13.086 21.066 671 HG22 VAL 88 HG21 VAL 88 19.812 11.664 21.018 672 HG23 VAL 88 HG22 VAL 88 19.709 12.738 19.618 673 H TYR 89 H TYR 89 16.725 12.997 22.198 674 HA TYR 89 HA TYR 89 13.879 12.195 22.561 675 HB2 TYR 89 HB2 TYR 89 15.336 12.298 24.594 676 HB3 TYR 89 HB3 TYR 89 15.378 14.042 24.393 677 HD1 TYR 89 HD1 TYR 89 12.059 13.002 23.351 678 HD2 TYR 89 HD2 TYR 89 14.557 13.493 26.867 679 HE1 TYR 89 HE1 TYR 89 10.083 13.137 24.745 680 HE2 TYR 89 HE2 TYR 89 12.524 13.648 28.268 681 HH TYR 89 HH TYR 89 9.217 13.513 26.835 682 H PHE 90 H PHE 90 12.760 13.078 21.001 683 HA PHE 90 HA PHE 90 13.166 15.725 19.933 684 HB2 PHE 90 HB2 PHE 90 11.091 13.530 19.808 685 HB3 PHE 90 HB3 PHE 90 10.710 15.139 19.199 686 HD1 PHE 90 HD2 PHE 90 13.610 12.680 18.857 687 HD2 PHE 90 HD1 PHE 90 10.996 15.543 16.953 688 HE1 PHE 90 HE2 PHE 90 14.830 12.396 16.732 689 HE2 PHE 90 HE1 PHE 90 12.205 15.225 14.828 690 HZ PHE 90 HZ PHE 90 14.162 13.702 14.717 691 HA PRO 91 HA PRO 91 11.639 17.924 23.313 692 HB2 PRO 91 HB2 PRO 91 10.497 20.195 22.210 693 HB3 PRO 91 HB3 PRO 91 12.255 19.875 22.301 694 HG2 PRO 91 HG2 PRO 91 10.387 19.371 19.973 695 HG3 PRO 91 HG3 PRO 91 11.994 20.169 19.950 696 HD2 PRO 91 HD2 PRO 91 11.722 17.555 19.279 697 HD3 PRO 91 HD3 PRO 91 13.115 18.100 20.258 698 H GLY 92 H GLY 92 9.951 17.894 24.675 699 HA2 GLY 92 HA2 GLY 92 7.856 17.954 25.520 700 HA3 GLY 92 HA3 GLY 92 7.284 18.506 23.942 701 H ASN 93 H ASN 93 8.774 15.481 23.394 702 HA ASN 93 HA ASN 93 6.175 14.221 23.085 703 HB2 ASN 93 HB2 ASN 93 8.227 13.968 21.571 704 HB3 ASN 93 HB3 ASN 93 8.925 12.950 22.820 705 HD21 ASN 93 HD22 ASN 93 8.743 10.855 22.097 706 HD22 ASN 93 HD21 ASN 93 7.296 10.175 21.364 707 H ASP 94 H ASP 94 5.801 11.950 23.998 708 HA ASP 94 HA ASP 94 5.998 12.015 26.832 709 HB2 ASP 94 HB2 ASP 94 4.222 10.816 25.604 710 HB3 ASP 94 HB3 ASP 94 5.416 9.655 25.012 711 H GLU 95 H GLU 95 7.932 10.278 24.401 712 HA GLU 95 HA GLU 95 10.115 9.974 26.320 713 HB2 GLU 95 HB2 GLU 95 10.076 7.660 26.380 714 HB3 GLU 95 HB3 GLU 95 8.363 8.075 26.362 715 HG2 GLU 95 HG2 GLU 95 8.239 7.547 23.950 716 HG3 GLU 95 HG3 GLU 95 9.955 7.110 23.985 717 HA PRO 96 HA PRO 96 12.904 10.387 22.900 718 HB2 PRO 96 HB2 PRO 96 14.076 7.679 23.534 719 HB3 PRO 96 HB3 PRO 96 14.925 9.231 23.267 720 HG2 PRO 96 HG2 PRO 96 14.578 8.291 25.776 721 HG3 PRO 96 HG3 PRO 96 14.298 10.031 25.430 722 HD2 PRO 96 HD2 PRO 96 12.249 7.809 25.659 723 HD3 PRO 96 HD3 PRO 96 12.225 9.449 26.385 724 H ILE 97 H ILE 97 13.552 9.579 20.788 725 HA ILE 97 HA ILE 97 11.661 7.592 19.588 726 HB ILE 97 HB ILE 97 13.219 9.869 18.289 727 HG12 ILE 97 HG12 ILE 97 11.621 10.979 19.629 728 HG13 ILE 97 HG13 ILE 97 10.999 10.985 17.991 729 HG21 ILE 97 HG21 ILE 97 12.779 8.061 16.711 730 HG22 ILE 97 HG22 ILE 97 11.069 8.011 17.185 731 HG23 ILE 97 HG23 ILE 97 11.731 9.428 16.349 732 HD11 ILE 97 HD13 ILE 97 10.051 9.199 20.287 733 HD12 ILE 97 HD11 ILE 97 9.218 10.564 19.563 734 HD13 ILE 97 HD12 ILE 97 9.460 9.081 18.610 735 H LYS 98 H LYS 98 12.579 5.723 18.989 736 HA LYS 98 HA LYS 98 15.540 5.601 18.650 737 HB2 LYS 98 HB2 LYS 98 13.433 3.417 18.914 738 HB3 LYS 98 HB3 LYS 98 15.057 3.146 18.269 739 HG2 LYS 98 HG2 LYS 98 15.957 4.257 20.417 740 HG3 LYS 98 HG3 LYS 98 14.323 4.106 21.060 741 HD2 LYS 98 HD2 LYS 98 15.788 2.302 21.820 742 HD3 LYS 98 HD3 LYS 98 14.465 1.640 20.846 743 HE2 LYS 98 HE2 LYS 98 15.889 1.194 18.992 744 HE3 LYS 98 HE3 LYS 98 17.115 2.333 19.553 745 HZ1 LYS 98 HZ3 LYS 98 17.786 0.025 19.856 746 HZ2 LYS 98 HZ1 LYS 98 17.747 0.851 21.263 747 HZ3 LYS 98 HZ2 LYS 98 16.546 -0.232 20.911 748 H LEU 99 H LEU 99 12.446 5.505 16.790 749 HA LEU 99 HA LEU 99 14.199 5.228 14.384 750 HB2 LEU 99 HB2 LEU 99 12.942 3.101 15.005 751 HB3 LEU 99 HB3 LEU 99 11.455 3.995 14.743 752 HG LEU 99 HG LEU 99 12.856 4.438 12.330 753 HD11 LEU 99 HD11 LEU 99 13.419 1.587 13.074 754 HD12 LEU 99 HD12 LEU 99 13.770 2.414 11.552 755 HD13 LEU 99 HD13 LEU 99 14.583 2.922 13.019 756 HD21 LEU 99 HD23 LEU 99 11.280 2.814 11.358 757 HD22 LEU 99 HD21 LEU 99 10.724 2.453 13.011 758 HD23 LEU 99 HD22 LEU 99 10.565 4.089 12.359 759 H LEU 100 H LEU 100 13.677 6.177 12.571 760 HA LEU 100 HA LEU 100 11.402 8.104 12.547 761 HB2 LEU 100 HB2 LEU 100 14.185 8.849 11.564 762 HB3 LEU 100 HB3 LEU 100 12.750 9.845 11.633 763 HG LEU 100 HG LEU 100 12.938 9.302 14.263 764 HD11 LEU 100 HD11 LEU 100 15.856 9.225 13.371 765 HD12 LEU 100 HD12 LEU 100 15.238 9.235 15.037 766 HD13 LEU 100 HD13 LEU 100 14.994 7.818 14.014 767 HD21 LEU 100 HD23 LEU 100 14.265 11.375 14.522 768 HD22 LEU 100 HD21 LEU 100 14.613 11.362 12.782 769 HD23 LEU 100 HD22 LEU 100 12.940 11.547 13.363 770 H ILE 101 H ILE 101 10.191 7.268 10.909 771 HA ILE 101 HA ILE 101 11.593 6.339 8.445 772 HB ILE 101 HB ILE 101 8.686 6.067 9.339 773 HG12 ILE 101 HG12 ILE 101 11.032 4.375 9.313 774 HG13 ILE 101 HG13 ILE 101 9.453 4.135 10.027 775 HG21 ILE 101 HG21 ILE 101 8.693 6.974 7.036 776 HG22 ILE 101 HG22 ILE 101 9.738 5.638 6.529 777 HG23 ILE 101 HG23 ILE 101 8.090 5.356 7.177 778 HD11 ILE 101 HD13 ILE 101 8.606 3.289 7.842 779 HD12 ILE 101 HD11 ILE 101 10.255 3.461 7.177 780 HD13 ILE 101 HD12 ILE 101 9.932 2.327 8.505 781 H GLY 102 H GLY 102 12.130 7.893 7.037 782 HA2 GLY 102 HA2 GLY 102 10.774 10.544 7.163 783 HA3 GLY 102 HA3 GLY 102 12.202 10.148 6.213 784 H LEU 103 H LEU 103 9.732 11.360 5.276 785 HA LEU 103 HA LEU 103 9.304 9.694 2.928 786 HB2 LEU 103 HB2 LEU 103 7.366 9.248 4.646 787 HB3 LEU 103 HB3 LEU 103 6.927 10.912 4.379 788 HG LEU 103 HG LEU 103 6.697 8.545 2.445 789 HD11 LEU 103 HD11 LEU 103 4.344 9.197 2.609 790 HD12 LEU 103 HD12 LEU 103 4.954 9.248 4.265 791 HD13 LEU 103 HD13 LEU 103 4.743 10.742 3.369 792 HD21 LEU 103 HD23 LEU 103 6.491 11.511 1.757 793 HD22 LEU 103 HD21 LEU 103 7.400 10.199 0.918 794 HD23 LEU 103 HD22 LEU 103 5.656 10.266 0.853 795 H SER 104 H SER 104 9.109 11.140 1.178 796 HA SER 104 HA SER 104 8.465 13.966 1.604 797 HB2 SER 104 HB2 SER 104 10.891 13.099 -0.029 798 HB3 SER 104 HB3 SER 104 10.354 14.752 0.347 799 HG SER 104 HG SER 104 10.632 13.494 2.642 800 H ALA 105 H ALA 105 7.318 14.736 -0.281 801 HA ALA 105 HA ALA 105 6.793 12.728 -2.397 802 HB1 ALA 105 HB3 ALA 105 4.730 13.895 -0.493 803 HB2 ALA 105 HB1 ALA 105 4.361 12.987 -1.972 804 HB3 ALA 105 HB2 ALA 105 5.198 12.180 -0.630 805 H ALA 106 H ALA 106 6.301 13.675 -4.324 806 HA ALA 106 HA ALA 106 6.842 16.500 -4.509 807 HB1 ALA 106 HB3 ALA 106 6.647 16.104 -6.948 808 HB2 ALA 106 HB1 ALA 106 7.669 14.873 -6.186 809 HB3 ALA 106 HB2 ALA 106 5.994 14.481 -6.643 810 H ASP 107 H ASP 107 3.922 14.539 -4.392 811 HA ASP 107 HA ASP 107 2.249 16.988 -4.649 812 HB2 ASP 107 HB2 ASP 107 2.305 15.986 -6.899 813 HB3 ASP 107 HB3 ASP 107 1.839 14.422 -6.235 814 H ALA 108 H ALA 108 0.080 16.684 -3.719 815 HA ALA 108 HA ALA 108 0.160 15.402 -1.228 816 HB1 ALA 108 HB3 ALA 108 -2.255 16.345 -2.826 817 HB2 ALA 108 HB1 ALA 108 -2.227 15.997 -1.085 818 HB3 ALA 108 HB2 ALA 108 -1.269 17.345 -1.728 819 H ASP 109 H ASP 109 -1.095 14.155 -4.348 820 HA ASP 109 HA ASP 109 -2.364 11.851 -3.034 821 HB2 ASP 109 HB2 ASP 109 -3.293 12.622 -5.082 822 HB3 ASP 109 HB3 ASP 109 -1.734 12.447 -5.924 823 H SER 110 H SER 110 0.780 12.586 -4.515 824 HA SER 110 HA SER 110 1.847 9.923 -4.362 825 HB2 SER 110 HB2 SER 110 3.434 12.505 -4.042 826 HB3 SER 110 HB3 SER 110 3.985 10.943 -4.635 827 HG SER 110 HG SER 110 2.662 11.211 -6.460 828 H HIS 111 H HIS 111 1.713 12.672 -2.042 829 HA HIS 111 HA HIS 111 3.004 11.423 0.150 830 HB2 HIS 111 HB2 HIS 111 2.622 13.733 0.353 831 HB3 HIS 111 HB3 HIS 111 0.955 13.607 -0.140 832 HD1 HIS 111 HD1 HIS 111 3.065 13.331 3.023 833 HD2 HIS 111 HD2 HIS 111 -0.911 13.104 1.657 834 HE1 HIS 111 HE1 HIS 111 1.588 13.302 5.097 835 H ILE 112 H ILE 112 -0.508 11.414 -0.728 836 HA ILE 112 HA ILE 112 -1.371 9.783 1.412 837 HB ILE 112 HB ILE 112 -2.352 10.183 -1.444 838 HG12 ILE 112 HG12 ILE 112 -2.493 12.090 0.229 839 HG13 ILE 112 HG13 ILE 112 -3.967 11.648 -0.613 840 HG21 ILE 112 HG21 ILE 112 -3.722 8.512 0.671 841 HG22 ILE 112 HG22 ILE 112 -4.525 9.175 -0.778 842 HG23 ILE 112 HG23 ILE 112 -3.203 8.022 -0.956 843 HD11 ILE 112 HD13 ILE 112 -4.821 10.539 1.370 844 HD12 ILE 112 HD11 ILE 112 -3.270 10.780 2.218 845 HD13 ILE 112 HD12 ILE 112 -4.284 12.177 1.777 846 H GLY 113 H GLY 113 -0.385 8.692 -1.923 847 HA2 GLY 113 HA2 GLY 113 -0.732 5.940 -1.419 848 HA3 GLY 113 HA3 GLY 113 0.363 6.640 -2.628 849 H ALA 114 H ALA 114 2.073 8.050 -0.839 850 HA ALA 114 HA ALA 114 3.951 5.997 -0.125 851 HB1 ALA 114 HB3 ALA 114 5.211 8.023 0.694 852 HB2 ALA 114 HB1 ALA 114 4.634 8.189 -0.964 853 HB3 ALA 114 HB2 ALA 114 3.791 9.008 0.362 854 H ILE 115 H ILE 115 1.917 8.256 1.885 855 HA ILE 115 HA ILE 115 2.715 7.381 4.406 856 HB ILE 115 HB ILE 115 0.336 8.568 3.159 857 HG12 ILE 115 HG12 ILE 115 2.288 10.035 3.592 858 HG13 ILE 115 HG13 ILE 115 0.810 10.567 4.371 859 HG21 ILE 115 HG21 ILE 115 0.307 7.717 6.009 860 HG22 ILE 115 HG22 ILE 115 -0.750 9.008 5.332 861 HG23 ILE 115 HG23 ILE 115 -0.842 7.373 4.688 862 HD11 ILE 115 HD13 ILE 115 1.596 9.722 6.543 863 HD12 ILE 115 HD11 ILE 115 3.060 9.082 5.762 864 HD13 ILE 115 HD12 ILE 115 2.781 10.831 5.828 865 H GLN 116 H GLN 116 0.176 6.178 2.148 866 HA GLN 116 HA GLN 116 -0.847 4.171 3.919 867 HB2 GLN 116 HB2 GLN 116 -1.056 4.661 0.922 868 HB3 GLN 116 HB3 GLN 116 -1.881 3.316 1.714 869 HG2 GLN 116 HG2 GLN 116 -2.200 6.229 2.515 870 HG3 GLN 116 HG3 GLN 116 -3.280 5.396 1.401 871 HE21 GLN 116 HE22 GLN 116 -3.330 6.508 4.437 872 HE22 GLN 116 HE21 GLN 116 -4.220 5.250 5.250 873 H ALA 117 H ALA 117 2.165 4.228 2.205 874 HA ALA 117 HA ALA 117 2.299 1.313 2.121 875 HB1 ALA 117 HB3 ALA 117 3.299 2.725 0.233 876 HB2 ALA 117 HB1 ALA 117 4.463 3.345 1.413 877 HB3 ALA 117 HB2 ALA 117 4.434 1.622 1.008 878 H LEU 118 H LEU 118 3.516 4.202 3.799 879 HA LEU 118 HA LEU 118 5.213 2.716 5.553 880 HB2 LEU 118 HB2 LEU 118 3.977 5.505 5.787 881 HB3 LEU 118 HB3 LEU 118 5.249 4.871 6.853 882 HG LEU 118 HG LEU 118 5.430 5.113 3.835 883 HD11 LEU 118 HD11 LEU 118 5.343 7.273 4.914 884 HD12 LEU 118 HD12 LEU 118 6.603 6.831 6.066 885 HD13 LEU 118 HD13 LEU 118 7.000 6.982 4.342 886 HD21 LEU 118 HD23 LEU 118 8.024 4.877 4.764 887 HD22 LEU 118 HD21 LEU 118 7.179 3.834 5.920 888 HD23 LEU 118 HD22 LEU 118 7.041 3.531 4.188 889 H SER 119 H SER 119 1.808 3.640 5.754 890 HA SER 119 HA SER 119 1.336 2.831 8.396 891 HB2 SER 119 HB2 SER 119 -0.446 2.385 5.958 892 HB3 SER 119 HB3 SER 119 -0.978 2.424 7.647 893 HG SER 119 HG SER 119 0.239 4.589 6.216 894 H GLU 120 H GLU 120 2.309 0.745 5.706 895 HA GLU 120 HA GLU 120 1.331 -1.694 6.909 896 HB2 GLU 120 HB2 GLU 120 3.408 -1.321 4.733 897 HB3 GLU 120 HB3 GLU 120 2.668 -2.838 5.194 898 HG2 GLU 120 HG2 GLU 120 1.062 -0.471 4.179 899 HG3 GLU 120 HG3 GLU 120 1.693 -1.737 3.131 900 H LEU 121 H LEU 121 4.049 0.393 7.369 901 HA LEU 121 HA LEU 121 5.707 -1.759 8.621 902 HB2 LEU 121 HB2 LEU 121 6.456 1.089 7.808 903 HB3 LEU 121 HB3 LEU 121 7.530 -0.091 8.554 904 HG LEU 121 HG LEU 121 6.297 -0.180 5.773 905 HD11 LEU 121 HD11 LEU 121 9.174 -0.054 6.805 906 HD12 LEU 121 HD12 LEU 121 8.714 -0.157 5.100 907 HD13 LEU 121 HD13 LEU 121 8.262 1.267 6.045 908 HD21 LEU 121 HD23 LEU 121 6.250 -2.491 6.532 909 HD22 LEU 121 HD21 LEU 121 7.580 -2.293 5.396 910 HD23 LEU 121 HD22 LEU 121 7.919 -2.371 7.135 911 H LEU 122 H LEU 122 4.925 1.715 9.270 912 HA LEU 122 HA LEU 122 5.705 1.639 11.976 913 HB2 LEU 122 HB2 LEU 122 3.674 3.351 10.437 914 HB3 LEU 122 HB3 LEU 122 4.116 3.691 12.091 915 HG LEU 122 HG LEU 122 5.154 5.158 10.435 916 HD11 LEU 122 HD11 LEU 122 6.150 4.775 12.692 917 HD12 LEU 122 HD12 LEU 122 7.208 3.533 11.981 918 HD13 LEU 122 HD13 LEU 122 7.353 5.230 11.477 919 HD21 LEU 122 HD23 LEU 122 6.985 2.872 9.652 920 HD22 LEU 122 HD21 LEU 122 5.684 3.541 8.639 921 HD23 LEU 122 HD22 LEU 122 7.021 4.560 9.105 922 H CYS 123 H CYS 123 2.625 0.614 10.602 923 HA CYS 123 HA CYS 123 1.509 0.471 13.351 924 HB2 CYS 123 HB2 CYS 123 -0.018 0.367 10.725 925 HB3 CYS 123 HB3 CYS 123 -0.685 0.513 12.348 926 HG CYS 123 HG CYS 123 -0.937 2.798 11.101 927 H GLU 124 H GLU 124 3.453 -1.409 12.297 928 HA GLU 124 HA GLU 124 1.856 -3.846 12.778 929 HB2 GLU 124 HB2 GLU 124 3.902 -3.498 10.569 930 HB3 GLU 124 HB3 GLU 124 3.498 -5.077 11.240 931 HG2 GLU 124 HG2 GLU 124 1.524 -3.145 9.981 932 HG3 GLU 124 HG3 GLU 124 2.216 -4.568 9.194 933 H GLU 125 H GLU 125 2.350 -4.279 14.712 934 HA GLU 125 HA GLU 125 4.692 -3.512 16.062 935 HB2 GLU 125 HB2 GLU 125 3.938 -4.918 17.883 936 HB3 GLU 125 HB3 GLU 125 2.591 -4.023 17.185 937 HG2 GLU 125 HG2 GLU 125 1.917 -6.081 15.913 938 HG3 GLU 125 HG3 GLU 125 3.233 -6.966 16.687 939 H GLU 126 H GLU 126 4.139 -6.316 14.031 940 HA GLU 126 HA GLU 126 6.331 -7.893 14.952 941 HB2 GLU 126 HB2 GLU 126 5.122 -7.797 12.151 942 HB3 GLU 126 HB3 GLU 126 6.146 -9.077 12.819 943 HG2 GLU 126 HG2 GLU 126 4.372 -9.416 14.613 944 HG3 GLU 126 HG3 GLU 126 3.348 -8.294 13.707 945 H ILE 127 H ILE 127 5.958 -5.474 12.382 946 HA ILE 127 HA ILE 127 8.690 -5.471 11.493 947 HB ILE 127 HB ILE 127 6.313 -3.729 11.099 948 HG12 ILE 127 HG12 ILE 127 6.691 -4.206 8.737 949 HG13 ILE 127 HG13 ILE 127 8.176 -5.089 9.121 950 HG21 ILE 127 HG21 ILE 127 9.158 -2.969 10.442 951 HG22 ILE 127 HG22 ILE 127 7.773 -2.301 9.551 952 HG23 ILE 127 HG23 ILE 127 7.921 -2.010 11.281 953 HD11 ILE 127 HD13 ILE 127 6.898 -6.877 10.158 954 HD12 ILE 127 HD11 ILE 127 5.388 -5.939 9.994 955 HD13 ILE 127 HD12 ILE 127 6.234 -6.538 8.556 956 H LEU 128 H LEU 128 6.833 -3.466 13.858 957 HA LEU 128 HA LEU 128 8.996 -1.839 14.548 958 HB2 LEU 128 HB2 LEU 128 6.830 -2.792 16.468 959 HB3 LEU 128 HB3 LEU 128 7.901 -1.427 16.716 960 HG LEU 128 HG LEU 128 5.663 -1.630 14.674 961 HD11 LEU 128 HD11 LEU 128 5.003 -1.144 16.989 962 HD12 LEU 128 HD12 LEU 128 6.134 0.224 17.029 963 HD13 LEU 128 HD13 LEU 128 4.737 0.246 15.926 964 HD21 LEU 128 HD23 LEU 128 7.367 -0.450 13.496 965 HD22 LEU 128 HD21 LEU 128 6.254 0.763 14.125 966 HD23 LEU 128 HD22 LEU 128 7.809 0.497 14.939 967 H GLU 129 H GLU 129 8.325 -5.140 15.722 968 HA GLU 129 HA GLU 129 10.451 -5.059 17.648 969 HB2 GLU 129 HB2 GLU 129 8.714 -7.215 16.487 970 HB3 GLU 129 HB3 GLU 129 10.297 -7.699 17.117 971 HG2 GLU 129 HG2 GLU 129 9.844 -6.620 19.261 972 HG3 GLU 129 HG3 GLU 129 8.253 -6.092 18.693 973 H GLN 130 H GLN 130 10.216 -5.983 14.161 974 HA GLN 130 HA GLN 130 12.821 -7.121 14.023 975 HB2 GLN 130 HB2 GLN 130 10.967 -5.899 11.954 976 HB3 GLN 130 HB3 GLN 130 12.481 -6.708 11.534 977 HG2 GLN 130 HG2 GLN 130 11.713 -8.826 12.177 978 HG3 GLN 130 HG3 GLN 130 10.431 -8.184 13.188 979 HE21 GLN 130 HE22 GLN 130 8.800 -9.455 12.131 980 HE22 GLN 130 HE21 GLN 130 8.268 -9.095 10.507 981 H LEU 131 H LEU 131 11.606 -3.780 13.726 982 HA LEU 131 HA LEU 131 14.217 -2.755 12.956 983 HB2 LEU 131 HB2 LEU 131 13.267 -0.612 12.892 984 HB3 LEU 131 HB3 LEU 131 12.110 -1.781 12.182 985 HG LEU 131 HG LEU 131 10.988 -1.703 14.424 986 HD11 LEU 131 HD11 LEU 131 12.679 -0.052 15.524 987 HD12 LEU 131 HD12 LEU 131 11.896 1.164 14.522 988 HD13 LEU 131 HD13 LEU 131 10.946 0.273 15.694 989 HD21 LEU 131 HD23 LEU 131 9.877 -1.084 12.434 990 HD22 LEU 131 HD21 LEU 131 9.637 0.303 13.509 991 HD23 LEU 131 HD22 LEU 131 10.864 0.364 12.226 992 H LEU 132 H LEU 132 12.279 -2.755 16.051 993 HA LEU 132 HA LEU 132 14.287 -1.347 17.496 994 HB2 LEU 132 HB2 LEU 132 12.196 -3.369 18.365 995 HB3 LEU 132 HB3 LEU 132 13.233 -2.541 19.519 996 HG LEU 132 HG LEU 132 11.494 -1.001 17.556 997 HD11 LEU 132 HD11 LEU 132 9.850 -0.774 19.349 998 HD12 LEU 132 HD12 LEU 132 10.089 -2.472 18.897 999 HD13 LEU 132 HD13 LEU 132 10.818 -1.845 20.396 1000 HD21 LEU 132 HD23 LEU 132 11.739 0.833 19.185 1001 HD22 LEU 132 HD21 LEU 132 12.833 -0.179 20.154 1002 HD23 LEU 132 HD22 LEU 132 13.290 0.330 18.509 1003 H THR 133 H THR 133 14.259 -4.658 16.377 1004 HA THR 133 HA THR 133 16.668 -5.262 17.987 1005 HB THR 133 HB THR 133 16.173 -7.602 17.482 1006 HG1 THR 133 HG1 THR 133 13.757 -6.684 16.334 1007 HG21 THR 133 HG23 THR 133 14.178 -7.908 18.835 1008 HG22 THR 133 HG21 THR 133 15.151 -6.589 19.511 1009 HG23 THR 133 HG22 THR 133 13.673 -6.230 18.588 1010 H ALA 134 H ALA 134 16.403 -3.609 15.298 1011 HA ALA 134 HA ALA 134 17.635 -5.180 13.293 1012 HB1 ALA 134 HB3 ALA 134 16.423 -3.215 12.675 1013 HB2 ALA 134 HB1 ALA 134 17.567 -2.189 13.588 1014 HB3 ALA 134 HB2 ALA 134 18.112 -3.073 12.157 1015 H SER 135 H SER 135 19.477 -6.279 13.811 1016 HA SER 135 HA SER 135 21.667 -5.122 15.237 1017 HB2 SER 135 HB2 SER 135 21.593 -7.503 13.333 1018 HB3 SER 135 HB3 SER 135 22.837 -7.168 14.550 1019 HG SER 135 HG SER 135 21.275 -8.681 15.283 1020 H SER 136 H SER 136 20.648 -4.726 11.905 1021 HA SER 136 HA SER 136 23.186 -3.405 11.211 1022 HB2 SER 136 HB2 SER 136 23.394 -4.852 9.191 1023 HB3 SER 136 HB3 SER 136 23.563 -5.772 10.692 1024 HG SER 136 HG SER 136 22.187 -6.909 9.404 1025 H GLU 137 H GLU 137 23.067 -2.286 9.185 1026 HA GLU 137 HA GLU 137 20.685 -0.879 8.518 1027 HB2 GLU 137 HB2 GLU 137 23.131 -0.316 8.057 1028 HB3 GLU 137 HB3 GLU 137 23.104 -1.529 6.773 1029 HG2 GLU 137 HG2 GLU 137 21.231 -0.213 5.692 1030 HG3 GLU 137 HG3 GLU 137 21.441 1.000 6.966 1031 H LYS 138 H LYS 138 22.122 -3.931 7.328 1032 HA LYS 138 HA LYS 138 20.372 -4.369 5.172 1033 HB2 LYS 138 HB2 LYS 138 22.462 -5.638 5.513 1034 HB3 LYS 138 HB3 LYS 138 21.792 -6.383 6.963 1035 HG2 LYS 138 HG2 LYS 138 21.742 -7.932 5.095 1036 HG3 LYS 138 HG3 LYS 138 20.102 -7.567 5.626 1037 HD2 LYS 138 HD2 LYS 138 19.799 -6.024 3.712 1038 HD3 LYS 138 HD3 LYS 138 21.486 -6.299 3.217 1039 HE2 LYS 138 HE2 LYS 138 20.981 -8.721 2.920 1040 HE3 LYS 138 HE3 LYS 138 19.305 -8.431 3.402 1041 HZ1 LYS 138 HZ3 LYS 138 20.616 -7.273 1.007 1042 HZ2 LYS 138 HZ1 LYS 138 19.543 -8.497 1.003 1043 HZ3 LYS 138 HZ2 LYS 138 19.062 -7.006 1.448 1044 H GLN 139 H GLN 139 19.978 -5.381 8.635 1045 HA GLN 139 HA GLN 139 17.568 -6.656 8.278 1046 HB2 GLN 139 HB2 GLN 139 19.235 -6.295 10.347 1047 HB3 GLN 139 HB3 GLN 139 18.080 -5.019 10.776 1048 HG2 GLN 139 HG2 GLN 139 16.252 -6.664 10.638 1049 HG3 GLN 139 HG3 GLN 139 17.430 -7.894 10.110 1050 HE21 GLN 139 HE22 GLN 139 15.645 -7.019 12.809 1051 HE22 GLN 139 HE21 GLN 139 16.765 -7.506 14.054 1052 H LEU 140 H LEU 140 18.155 -3.116 8.606 1053 HA LEU 140 HA LEU 140 15.332 -2.500 8.877 1054 HB2 LEU 140 HB2 LEU 140 17.792 -0.891 8.213 1055 HB3 LEU 140 HB3 LEU 140 16.182 -0.185 8.115 1056 HG LEU 140 HG LEU 140 17.399 -1.405 10.594 1057 HD11 LEU 140 HD11 LEU 140 16.915 1.534 9.894 1058 HD12 LEU 140 HD12 LEU 140 17.676 0.898 11.357 1059 HD13 LEU 140 HD13 LEU 140 18.481 0.721 9.795 1060 HD21 LEU 140 HD23 LEU 140 14.979 -1.564 10.784 1061 HD22 LEU 140 HD21 LEU 140 15.560 -0.270 11.827 1062 HD23 LEU 140 HD22 LEU 140 14.789 0.130 10.280 1063 H ALA 141 H ALA 141 17.663 -2.485 6.095 1064 HA ALA 141 HA ALA 141 15.688 -1.810 4.152 1065 HB1 ALA 141 HB3 ALA 141 18.089 -1.636 3.780 1066 HB2 ALA 141 HB1 ALA 141 18.204 -3.425 3.754 1067 HB3 ALA 141 HB2 ALA 141 17.248 -2.552 2.516 1068 H ASP 142 H ASP 142 16.510 -4.973 5.600 1069 HA ASP 142 HA ASP 142 15.034 -6.569 3.781 1070 HB2 ASP 142 HB2 ASP 142 16.608 -7.513 5.395 1071 HB3 ASP 142 HB3 ASP 142 15.567 -7.017 6.733 1072 H ILE 143 H ILE 143 13.950 -4.667 6.649 1073 HA ILE 143 HA ILE 143 11.250 -5.576 6.625 1074 HB ILE 143 HB ILE 143 12.701 -3.129 7.671 1075 HG12 ILE 143 HG12 ILE 143 11.401 -5.448 9.141 1076 HG13 ILE 143 HG13 ILE 143 13.113 -5.367 8.738 1077 HG21 ILE 143 HG21 ILE 143 10.478 -2.369 7.170 1078 HG22 ILE 143 HG22 ILE 143 9.785 -3.740 8.075 1079 HG23 ILE 143 HG23 ILE 143 10.735 -2.467 8.900 1080 HD11 ILE 143 HD13 ILE 143 11.591 -3.748 10.764 1081 HD12 ILE 143 HD11 ILE 143 13.130 -4.610 10.904 1082 HD13 ILE 143 HD12 ILE 143 13.081 -3.080 10.029 1083 H ILE 144 H ILE 144 12.985 -2.980 4.877 1084 HA ILE 144 HA ILE 144 10.701 -1.888 3.531 1085 HB ILE 144 HB ILE 144 13.541 -2.180 2.413 1086 HG12 ILE 144 HG12 ILE 144 13.761 -0.951 4.455 1087 HG13 ILE 144 HG13 ILE 144 13.869 0.177 3.106 1088 HG21 ILE 144 HG21 ILE 144 12.967 -0.256 0.994 1089 HG22 ILE 144 HG22 ILE 144 12.063 -1.723 0.627 1090 HG23 ILE 144 HG23 ILE 144 11.271 -0.405 1.508 1091 HD11 ILE 144 HD13 ILE 144 11.349 0.563 3.474 1092 HD12 ILE 144 HD11 ILE 144 11.575 -0.301 5.012 1093 HD13 ILE 144 HD12 ILE 144 12.490 1.192 4.688 1094 H SER 145 H SER 145 12.956 -4.476 2.661 1095 HA SER 145 HA SER 145 11.845 -4.892 0.150 1096 HB2 SER 145 HB2 SER 145 13.430 -6.876 1.862 1097 HB3 SER 145 HB3 SER 145 13.251 -6.934 0.100 1098 HG SER 145 HG SER 145 14.561 -4.926 1.658 1099 H ARG 146 H ARG 146 10.840 -6.220 3.311 1100 HA ARG 146 HA ARG 146 9.250 -8.332 2.527 1101 HB2 ARG 146 HB2 ARG 146 10.009 -7.057 4.846 1102 HB3 ARG 146 HB3 ARG 146 8.347 -6.475 4.732 1103 HG2 ARG 146 HG2 ARG 146 7.571 -8.806 4.507 1104 HG3 ARG 146 HG3 ARG 146 9.240 -9.373 4.563 1105 HD2 ARG 146 HD2 ARG 146 7.678 -7.948 6.734 1106 HD3 ARG 146 HD3 ARG 146 8.129 -9.660 6.750 1107 HE ARG 146 HE ARG 146 9.471 -7.777 8.081 1108 HH11 ARG 146 HH11 ARG 146 10.742 -9.802 5.373 1109 HH12 ARG 146 HH12 ARG 146 12.382 -9.537 5.938 1110 HH21 ARG 146 HH22 ARG 146 11.561 -7.719 8.752 1111 HH22 ARG 146 HH21 ARG 146 12.840 -8.402 7.728 1112 H GLY 147 H GLY 147 8.690 -4.913 2.014 1113 HA2 GLY 147 HA2 GLY 147 5.916 -4.725 2.255 1114 HA3 GLY 147 HA3 GLY 147 6.933 -3.714 1.212 Start of MODEL 20 1 H MET 1 H1 MET 1 2.282 -2.757 -0.421 2 HA MET 1 HA MET 1 2.618 -2.321 -2.758 3 HB2 MET 1 HB2 MET 1 1.912 0.219 -2.330 4 HB3 MET 1 HB3 MET 1 3.644 0.406 -1.970 5 HG2 MET 1 HG2 MET 1 3.029 0.970 -4.301 6 HG3 MET 1 HG3 MET 1 4.248 -0.290 -4.183 7 HE1 MET 1 HE3 MET 1 2.365 -1.195 -7.494 8 HE2 MET 1 HE1 MET 1 2.710 0.429 -6.860 9 HE3 MET 1 HE2 MET 1 3.938 -0.852 -6.739 10 H ARG 2 H ARG 2 4.895 -2.192 -3.685 11 HA ARG 2 HA ARG 2 6.867 -3.147 -1.879 12 HB2 ARG 2 HB2 ARG 2 6.866 -2.095 -4.720 13 HB3 ARG 2 HB3 ARG 2 8.393 -2.210 -3.869 14 HG2 ARG 2 HG2 ARG 2 8.107 -4.178 -5.154 15 HG3 ARG 2 HG3 ARG 2 8.051 -4.613 -3.447 16 HD2 ARG 2 HD2 ARG 2 5.538 -4.145 -5.069 17 HD3 ARG 2 HD3 ARG 2 6.391 -5.700 -5.114 18 HE ARG 2 HE ARG 2 6.042 -5.154 -2.396 19 HH11 ARG 2 HH21 ARG 2 3.984 -5.875 -5.213 20 HH12 ARG 2 HH22 ARG 2 2.691 -6.514 -4.273 21 HH21 ARG 2 HH11 ARG 2 4.308 -5.895 -1.148 22 HH22 ARG 2 HH12 ARG 2 2.896 -6.577 -1.905 23 H LEU 3 H LEU 3 7.553 -2.035 -0.205 24 HA LEU 3 HA LEU 3 7.860 0.804 -0.044 25 HB2 LEU 3 HB2 LEU 3 9.197 -1.552 1.361 26 HB3 LEU 3 HB3 LEU 3 9.774 0.077 1.626 27 HG LEU 3 HG LEU 3 8.117 -0.796 3.358 28 HD11 LEU 3 HD11 LEU 3 8.569 1.609 3.046 29 HD12 LEU 3 HD12 LEU 3 7.236 1.718 1.875 30 HD13 LEU 3 HD13 LEU 3 6.905 1.293 3.569 31 HD21 LEU 3 HD23 LEU 3 5.757 -0.809 2.957 32 HD22 LEU 3 HD21 LEU 3 5.977 -0.376 1.253 33 HD23 LEU 3 HD22 LEU 3 6.519 -1.951 1.855 34 H SER 4 H SER 4 9.924 -1.763 -1.386 35 HA SER 4 HA SER 4 12.234 -0.253 -1.962 36 HB2 SER 4 HB2 SER 4 12.387 -2.193 -3.728 37 HB3 SER 4 HB3 SER 4 12.452 -2.563 -1.996 38 HG SER 4 HG SER 4 11.014 -3.931 -3.139 39 H ASP 5 H ASP 5 9.063 0.263 -3.239 40 HA ASP 5 HA ASP 5 10.220 1.588 -5.578 41 HB2 ASP 5 HB2 ASP 5 8.469 -0.197 -5.956 42 HB3 ASP 5 HB3 ASP 5 7.317 0.820 -5.090 43 H TYR 6 H TYR 6 9.814 2.467 -2.608 44 HA TYR 6 HA TYR 6 9.220 5.286 -3.412 45 HB2 TYR 6 HB2 TYR 6 8.381 3.908 -0.836 46 HB3 TYR 6 HB3 TYR 6 8.408 5.656 -1.087 47 HD1 TYR 6 HD1 TYR 6 6.681 2.493 -2.002 48 HD2 TYR 6 HD2 TYR 6 6.609 6.814 -2.069 49 HE1 TYR 6 HE1 TYR 6 4.362 2.447 -2.879 50 HE2 TYR 6 HE2 TYR 6 4.308 6.768 -3.002 51 HH TYR 6 HH TYR 6 2.537 5.426 -3.713 52 H PHE 7 H PHE 7 10.760 3.025 -1.151 53 HA PHE 7 HA PHE 7 12.748 5.033 -0.272 54 HB2 PHE 7 HB2 PHE 7 12.454 3.730 1.548 55 HB3 PHE 7 HB3 PHE 7 11.863 2.360 0.638 56 HD1 PHE 7 HD1 PHE 7 14.945 4.073 1.830 57 HD2 PHE 7 HD2 PHE 7 13.212 0.609 -0.031 58 HE1 PHE 7 HE1 PHE 7 17.160 2.925 1.919 59 HE2 PHE 7 HE2 PHE 7 15.468 -0.520 -0.022 60 HZ PHE 7 HZ PHE 7 17.427 0.655 0.950 61 HA PRO 8 HA PRO 8 14.438 3.959 -4.238 62 HB2 PRO 8 HB2 PRO 8 16.456 5.773 -4.461 63 HB3 PRO 8 HB3 PRO 8 14.729 6.216 -4.471 64 HG2 PRO 8 HG2 PRO 8 16.669 6.415 -2.160 65 HG3 PRO 8 HG3 PRO 8 15.430 7.589 -2.671 66 HD2 PRO 8 HD2 PRO 8 15.080 5.726 -0.653 67 HD3 PRO 8 HD3 PRO 8 13.746 6.442 -1.609 68 H GLU 9 H GLU 9 17.364 4.801 -2.412 69 HA GLU 9 HA GLU 9 18.372 2.186 -1.922 70 HB2 GLU 9 HB2 GLU 9 18.719 2.608 -4.504 71 HB3 GLU 9 HB3 GLU 9 19.844 3.873 -3.982 72 HG2 GLU 9 HG2 GLU 9 21.264 2.233 -2.878 73 HG3 GLU 9 HG3 GLU 9 20.069 0.961 -3.130 74 H SER 10 H SER 10 20.622 2.593 -0.964 75 HA SER 10 HA SER 10 21.981 3.616 0.425 76 HB2 SER 10 HB2 SER 10 21.746 6.195 -1.110 77 HB3 SER 10 HB3 SER 10 23.202 5.386 -0.533 78 HG SER 10 HG SER 10 22.979 3.896 -2.221 79 H SER 11 H SER 11 19.017 4.133 0.900 80 HA SER 11 HA SER 11 19.171 6.576 2.559 81 HB2 SER 11 HB2 SER 11 16.816 5.393 1.057 82 HB3 SER 11 HB3 SER 11 16.795 6.868 2.040 83 HG SER 11 HG SER 11 18.341 6.380 -0.305 84 H ILE 12 H ILE 12 19.981 3.912 3.420 85 HA ILE 12 HA ILE 12 18.182 3.733 5.758 86 HB ILE 12 HB ILE 12 19.018 1.555 3.947 87 HG12 ILE 12 HG12 ILE 12 16.925 1.733 6.154 88 HG13 ILE 12 HG13 ILE 12 16.695 2.496 4.555 89 HG21 ILE 12 HG21 ILE 12 19.155 -0.154 5.711 90 HG22 ILE 12 HG22 ILE 12 20.449 1.033 5.893 91 HG23 ILE 12 HG23 ILE 12 19.026 1.095 6.963 92 HD11 ILE 12 HD13 ILE 12 15.571 0.407 4.533 93 HD12 ILE 12 HD11 ILE 12 17.002 0.281 3.483 94 HD13 ILE 12 HD12 ILE 12 17.016 -0.446 5.106 95 H SER 13 H SER 13 19.282 3.705 7.730 96 HA SER 13 HA SER 13 22.094 3.050 7.831 97 HB2 SER 13 HB2 SER 13 21.137 5.890 8.489 98 HB3 SER 13 HB3 SER 13 22.702 5.235 8.998 99 HG SER 13 HG SER 13 22.136 4.931 6.319 100 H VAL 14 H VAL 14 22.825 2.858 10.016 101 HA VAL 14 HA VAL 14 20.770 2.892 12.146 102 HB VAL 14 HB VAL 14 22.927 0.813 11.654 103 HG11 VAL 14 HG11 VAL 14 20.964 1.042 13.985 104 HG12 VAL 14 HG12 VAL 14 22.051 -0.329 13.680 105 HG13 VAL 14 HG13 VAL 14 22.729 1.249 14.073 106 HG21 VAL 14 HG23 VAL 14 20.909 0.419 10.263 107 HG22 VAL 14 HG21 VAL 14 21.027 -0.803 11.534 108 HG23 VAL 14 HG22 VAL 14 19.879 0.542 11.701 109 H ILE 15 H ILE 15 21.567 3.868 13.980 110 HA ILE 15 HA ILE 15 24.260 5.144 13.880 111 HB ILE 15 HB ILE 15 21.439 6.232 13.986 112 HG12 ILE 15 HG12 ILE 15 23.908 6.785 12.326 113 HG13 ILE 15 HG13 ILE 15 22.347 6.140 11.811 114 HG21 ILE 15 HG21 ILE 15 23.807 7.785 15.008 115 HG22 ILE 15 HG22 ILE 15 22.161 8.414 14.715 116 HG23 ILE 15 HG23 ILE 15 22.375 7.194 15.923 117 HD11 ILE 15 HD13 ILE 15 21.318 8.389 12.388 118 HD12 ILE 15 HD11 ILE 15 22.961 8.999 12.690 119 HD13 ILE 15 HD12 ILE 15 22.511 8.429 11.070 120 H HIS 16 H HIS 16 25.215 5.436 15.901 121 HA HIS 16 HA HIS 16 24.235 3.813 18.066 122 HB2 HIS 16 HB2 HIS 16 26.368 5.982 18.040 123 HB3 HIS 16 HB3 HIS 16 26.136 4.777 19.309 124 HD1 HIS 16 HD1 HIS 16 25.856 2.182 17.314 125 HD2 HIS 16 HD2 HIS 16 28.764 5.247 17.233 126 HE1 HIS 16 HE1 HIS 16 27.893 1.216 16.140 127 H SER 17 H SER 17 24.021 7.297 17.294 128 HA SER 17 HA SER 17 21.798 7.810 18.952 129 HB2 SER 17 HB2 SER 17 23.106 9.543 20.410 130 HB3 SER 17 HB3 SER 17 23.054 7.859 20.923 131 HG SER 17 HG SER 17 25.167 8.841 21.017 132 H ALA 18 H ALA 18 21.081 10.033 18.420 133 HA ALA 18 HA ALA 18 22.574 11.250 16.147 134 HB1 ALA 18 HB3 ALA 18 20.592 12.763 16.021 135 HB2 ALA 18 HB1 ALA 18 20.205 11.064 15.741 136 HB3 ALA 18 HB2 ALA 18 19.827 11.822 17.315 137 H LYS 19 H LYS 19 23.123 13.497 16.330 138 HA LYS 19 HA LYS 19 24.389 14.172 18.765 139 HB2 LYS 19 HB2 LYS 19 24.755 14.933 16.249 140 HB3 LYS 19 HB3 LYS 19 23.595 16.173 16.637 141 HG2 LYS 19 HG2 LYS 19 25.754 17.137 16.924 142 HG3 LYS 19 HG3 LYS 19 25.019 16.983 18.514 143 HD2 LYS 19 HD2 LYS 19 27.403 16.408 18.551 144 HD3 LYS 19 HD3 LYS 19 26.424 15.011 19.006 145 HE2 LYS 19 HE2 LYS 19 26.640 14.096 16.709 146 HE3 LYS 19 HE3 LYS 19 27.554 15.524 16.214 147 HZ1 LYS 19 HZ3 LYS 19 29.017 13.675 16.733 148 HZ2 LYS 19 HZ1 LYS 19 29.288 14.883 17.790 149 HZ3 LYS 19 HZ2 LYS 19 28.444 13.562 18.254 150 H ASP 20 H ASP 20 21.220 15.048 17.457 151 HA ASP 20 HA ASP 20 20.081 15.490 20.013 152 HB2 ASP 20 HB2 ASP 20 21.178 17.824 19.468 153 HB3 ASP 20 HB3 ASP 20 20.014 17.864 18.121 154 H TRP 21 H TRP 21 17.661 16.410 19.408 155 HA TRP 21 HA TRP 21 16.568 14.700 17.384 156 HB2 TRP 21 HB2 TRP 21 14.462 15.868 17.747 157 HB3 TRP 21 HB3 TRP 21 15.211 15.372 19.254 158 HD1 TRP 21 HD1 TRP 21 16.005 17.271 20.912 159 HE1 TRP 21 HE1 TRP 21 15.651 19.786 21.062 160 HE3 TRP 21 HE3 TRP 21 14.084 18.066 16.236 161 HZ2 TRP 21 HZ2 TRP 21 14.844 21.937 19.283 162 HZ3 TRP 21 HZ3 TRP 21 13.648 20.377 15.455 163 HH2 TRP 21 HH2 TRP 21 14.083 22.309 16.943 164 H GLN 22 H GLN 22 17.579 18.118 17.318 165 HA GLN 22 HA GLN 22 16.803 18.945 14.704 166 HB2 GLN 22 HB2 GLN 22 19.392 19.419 16.244 167 HB3 GLN 22 HB3 GLN 22 18.861 20.311 14.814 168 HG2 GLN 22 HG2 GLN 22 16.901 21.160 16.000 169 HG3 GLN 22 HG3 GLN 22 17.262 20.167 17.412 170 HE21 GLN 22 HE22 GLN 22 18.919 20.784 18.884 171 HE22 GLN 22 HE21 GLN 22 19.692 22.360 18.778 172 H GLU 23 H GLU 23 19.792 17.142 15.744 173 HA GLU 23 HA GLU 23 20.702 16.710 13.071 174 HB2 GLU 23 HB2 GLU 23 22.013 16.620 15.293 175 HB3 GLU 23 HB3 GLU 23 21.317 15.002 15.501 176 HG2 GLU 23 HG2 GLU 23 23.328 14.466 14.522 177 HG3 GLU 23 HG3 GLU 23 22.324 14.545 13.103 178 H ALA 24 H ALA 24 18.638 14.831 15.270 179 HA ALA 24 HA ALA 24 18.664 12.422 13.748 180 HB1 ALA 24 HB3 ALA 24 16.514 13.477 15.609 181 HB2 ALA 24 HB1 ALA 24 16.801 11.780 15.160 182 HB3 ALA 24 HB2 ALA 24 17.997 12.677 16.127 183 H ILE 25 H ILE 25 16.704 15.417 13.455 184 HA ILE 25 HA ILE 25 14.950 14.370 11.411 185 HB ILE 25 HB ILE 25 15.891 17.243 11.734 186 HG12 ILE 25 HG12 ILE 25 14.412 15.796 13.672 187 HG13 ILE 25 HG13 ILE 25 14.795 17.508 13.612 188 HG21 ILE 25 HG21 ILE 25 14.820 16.697 9.567 189 HG22 ILE 25 HG22 ILE 25 13.403 16.075 10.411 190 HG23 ILE 25 HG23 ILE 25 13.845 17.798 10.500 191 HD11 ILE 25 HD13 ILE 25 12.319 16.160 12.511 192 HD12 ILE 25 HD11 ILE 25 12.436 17.137 13.988 193 HD13 ILE 25 HD12 ILE 25 12.662 17.911 12.413 194 H ASP 26 H ASP 26 18.101 16.164 11.359 195 HA ASP 26 HA ASP 26 18.369 16.227 8.543 196 HB2 ASP 26 HB2 ASP 26 19.827 17.536 9.981 197 HB3 ASP 26 HB3 ASP 26 20.546 16.075 10.657 198 H PHE 27 H PHE 27 19.487 13.715 10.874 199 HA PHE 27 HA PHE 27 20.418 11.935 8.873 200 HB2 PHE 27 HB2 PHE 27 19.662 11.642 11.790 201 HB3 PHE 27 HB3 PHE 27 20.022 10.228 10.822 202 HD1 PHE 27 HD2 PHE 27 22.203 10.606 9.201 203 HD2 PHE 27 HD1 PHE 27 21.634 12.358 13.138 204 HE1 PHE 27 HE2 PHE 27 24.649 10.775 9.499 205 HE2 PHE 27 HE1 PHE 27 24.067 12.454 13.414 206 HZ PHE 27 HZ PHE 27 25.589 11.690 11.613 207 H SER 28 H SER 28 17.078 12.514 10.037 208 HA SER 28 HA SER 28 15.976 10.125 8.845 209 HB2 SER 28 HB2 SER 28 14.576 12.809 9.366 210 HB3 SER 28 HB3 SER 28 13.795 11.290 9.018 211 HG SER 28 HG SER 28 15.500 11.807 11.254 212 H MET 29 H MET 29 17.063 13.223 7.523 213 HA MET 29 HA MET 29 15.615 12.618 4.977 214 HB2 MET 29 HB2 MET 29 16.624 15.245 6.028 215 HB3 MET 29 HB3 MET 29 15.450 14.952 4.731 216 HG2 MET 29 HG2 MET 29 14.679 14.187 7.525 217 HG3 MET 29 HG3 MET 29 14.749 15.877 7.072 218 HE1 MET 29 HE3 MET 29 12.815 12.696 7.070 219 HE2 MET 29 HE1 MET 29 11.741 12.778 5.651 220 HE3 MET 29 HE2 MET 29 13.501 12.517 5.426 221 H VAL 30 H VAL 30 18.893 13.172 6.186 222 HA VAL 30 HA VAL 30 19.968 14.582 4.106 223 HB VAL 30 HB VAL 30 21.095 14.131 6.225 224 HG11 VAL 30 HG11 VAL 30 20.578 11.697 6.479 225 HG12 VAL 30 HG12 VAL 30 21.728 11.335 5.173 226 HG13 VAL 30 HG13 VAL 30 22.295 12.058 6.692 227 HG21 VAL 30 HG23 VAL 30 23.374 13.943 5.432 228 HG22 VAL 30 HG21 VAL 30 22.831 13.231 3.897 229 HG23 VAL 30 HG22 VAL 30 22.423 14.914 4.295 230 H SER 31 H SER 31 19.428 11.012 4.082 231 HA SER 31 HA SER 31 20.922 10.562 1.736 232 HB2 SER 31 HB2 SER 31 18.372 9.083 2.468 233 HB3 SER 31 HB3 SER 31 19.818 8.458 1.659 234 HG SER 31 HG SER 31 20.932 8.644 3.622 235 H LEU 32 H LEU 32 17.499 11.544 2.238 236 HA LEU 32 HA LEU 32 16.767 11.459 -0.559 237 HB2 LEU 32 HB2 LEU 32 15.555 12.854 1.872 238 HB3 LEU 32 HB3 LEU 32 14.817 12.875 0.287 239 HG LEU 32 HG LEU 32 15.417 10.309 1.824 240 HD11 LEU 32 HD11 LEU 32 12.987 10.277 2.323 241 HD12 LEU 32 HD12 LEU 32 13.821 11.635 3.082 242 HD13 LEU 32 HD13 LEU 32 12.839 11.911 1.634 243 HD21 LEU 32 HD23 LEU 32 13.864 9.269 0.242 244 HD22 LEU 32 HD21 LEU 32 13.640 10.806 -0.606 245 HD23 LEU 32 HD22 LEU 32 15.210 9.964 -0.629 246 H LEU 33 H LEU 33 18.103 13.923 1.664 247 HA LEU 33 HA LEU 33 17.888 16.124 -0.064 248 HB2 LEU 33 HB2 LEU 33 18.445 16.224 2.341 249 HB3 LEU 33 HB3 LEU 33 20.021 15.518 2.005 250 HG LEU 33 HG LEU 33 20.649 17.500 0.661 251 HD11 LEU 33 HD11 LEU 33 19.263 19.525 0.742 252 HD12 LEU 33 HD12 LEU 33 18.440 18.240 -0.118 253 HD13 LEU 33 HD13 LEU 33 17.961 18.621 1.550 254 HD21 LEU 33 HD23 LEU 33 19.701 18.169 3.460 255 HD22 LEU 33 HD21 LEU 33 21.177 17.275 3.059 256 HD23 LEU 33 HD22 LEU 33 21.013 18.947 2.542 257 H ASP 34 H ASP 34 20.585 13.770 0.395 258 HA ASP 34 HA ASP 34 22.329 14.853 -1.554 259 HB2 ASP 34 HB2 ASP 34 23.036 13.284 0.230 260 HB3 ASP 34 HB3 ASP 34 22.073 11.996 -0.504 261 H LYS 35 H LYS 35 19.776 12.425 -1.797 262 HA LYS 35 HA LYS 35 20.270 11.751 -4.598 263 HB2 LYS 35 HB2 LYS 35 17.976 11.344 -2.665 264 HB3 LYS 35 HB3 LYS 35 17.987 10.657 -4.299 265 HG2 LYS 35 HG2 LYS 35 20.044 9.963 -2.176 266 HG3 LYS 35 HG3 LYS 35 18.520 9.106 -2.417 267 HD2 LYS 35 HD2 LYS 35 19.295 8.653 -4.816 268 HD3 LYS 35 HD3 LYS 35 20.882 9.318 -4.319 269 HE2 LYS 35 HE2 LYS 35 20.783 7.743 -2.327 270 HE3 LYS 35 HE3 LYS 35 19.331 7.028 -3.027 271 HZ1 LYS 35 HZ3 LYS 35 21.995 7.065 -4.358 272 HZ2 LYS 35 HZ1 LYS 35 21.422 5.791 -3.524 273 HZ3 LYS 35 HZ2 LYS 35 20.667 6.281 -4.905 274 H ASN 36 H ASN 36 19.258 14.606 -3.293 275 HA ASN 36 HA ASN 36 17.868 16.167 -3.606 276 HB2 ASN 36 HB2 ASN 36 18.142 17.448 -5.364 277 HB3 ASN 36 HB3 ASN 36 19.440 16.303 -5.656 278 HD21 ASN 36 HD22 ASN 36 17.863 14.163 -6.759 279 HD22 ASN 36 HD21 ASN 36 17.298 14.699 -8.334 280 H TYR 37 H TYR 37 16.447 13.830 -3.054 281 HA TYR 37 HA TYR 37 13.867 13.972 -4.455 282 HB2 TYR 37 HB2 TYR 37 14.928 12.634 -1.950 283 HB3 TYR 37 HB3 TYR 37 13.202 12.859 -2.134 284 HD1 TYR 37 HD1 TYR 37 11.930 11.753 -3.898 285 HD2 TYR 37 HD2 TYR 37 16.048 10.764 -3.154 286 HE1 TYR 37 HE1 TYR 37 11.782 9.863 -5.512 287 HE2 TYR 37 HE2 TYR 37 15.909 8.891 -4.739 288 HH TYR 37 HH TYR 37 12.898 8.104 -6.536 289 H ILE 38 H ILE 38 15.545 15.825 -2.015 290 HA ILE 38 HA ILE 38 13.206 17.599 -1.672 291 HB ILE 38 HB ILE 38 13.640 17.705 0.760 292 HG12 ILE 38 HG12 ILE 38 15.552 15.377 0.308 293 HG13 ILE 38 HG13 ILE 38 16.044 17.039 0.655 294 HG21 ILE 38 HG21 ILE 38 12.595 15.624 1.416 295 HG22 ILE 38 HG22 ILE 38 11.911 16.148 -0.117 296 HG23 ILE 38 HG23 ILE 38 13.107 14.830 -0.080 297 HD11 ILE 38 HD13 ILE 38 16.247 15.721 2.599 298 HD12 ILE 38 HD11 ILE 38 14.953 16.916 2.852 299 HD13 ILE 38 HD12 ILE 38 14.555 15.200 2.535 300 H SER 39 H SER 39 14.043 19.541 -0.281 301 HA SER 39 HA SER 39 16.740 20.460 -1.160 302 HB2 SER 39 HB2 SER 39 14.341 22.231 -0.578 303 HB3 SER 39 HB3 SER 39 15.819 22.636 -1.464 304 HG SER 39 HG SER 39 13.695 20.913 -2.254 305 H GLU 40 H GLU 40 17.711 22.031 0.464 306 HA GLU 40 HA GLU 40 17.808 20.816 2.989 307 HB2 GLU 40 HB2 GLU 40 18.680 23.615 2.170 308 HB3 GLU 40 HB3 GLU 40 19.159 22.788 3.659 309 HG2 GLU 40 HG2 GLU 40 20.199 20.966 2.297 310 HG3 GLU 40 HG3 GLU 40 19.787 21.836 0.828 311 H ASN 41 H ASN 41 15.800 23.586 2.002 312 HA ASN 41 HA ASN 41 14.976 24.419 4.597 313 HB2 ASN 41 HB2 ASN 41 14.489 25.693 2.525 314 HB3 ASN 41 HB3 ASN 41 13.393 24.416 1.982 315 HD21 ASN 41 HD22 ASN 41 11.284 24.249 2.951 316 HD22 ASN 41 HD21 ASN 41 10.684 25.478 4.050 317 H TYR 42 H TYR 42 13.995 21.586 2.690 318 HA TYR 42 HA TYR 42 11.492 21.092 3.938 319 HB2 TYR 42 HB2 TYR 42 12.382 20.087 1.810 320 HB3 TYR 42 HB3 TYR 42 13.494 19.120 2.775 321 HD1 TYR 42 HD1 TYR 42 9.902 19.740 2.048 322 HD2 TYR 42 HD2 TYR 42 12.799 17.104 3.854 323 HE1 TYR 42 HE1 TYR 42 8.191 17.934 2.175 324 HE2 TYR 42 HE2 TYR 42 11.107 15.307 3.978 325 HH TYR 42 HH TYR 42 8.975 14.647 3.451 326 H ILE 43 H ILE 43 14.829 20.046 4.740 327 HA ILE 43 HA ILE 43 14.174 18.434 7.002 328 HB ILE 43 HB ILE 43 16.696 20.046 6.329 329 HG12 ILE 43 HG12 ILE 43 17.353 17.403 6.006 330 HG13 ILE 43 HG13 ILE 43 15.657 17.366 5.506 331 HG21 ILE 43 HG21 ILE 43 16.372 17.768 8.333 332 HG22 ILE 43 HG22 ILE 43 17.876 18.619 7.922 333 HG23 ILE 43 HG23 ILE 43 16.582 19.481 8.758 334 HD11 ILE 43 HD13 ILE 43 17.223 17.691 3.638 335 HD12 ILE 43 HD11 ILE 43 16.141 19.086 3.800 336 HD13 ILE 43 HD12 ILE 43 17.822 19.177 4.392 337 H GLN 44 H GLN 44 15.021 21.951 6.724 338 HA GLN 44 HA GLN 44 14.760 22.290 9.539 339 HB2 GLN 44 HB2 GLN 44 16.098 23.728 7.835 340 HB3 GLN 44 HB3 GLN 44 14.585 24.590 7.581 341 HG2 GLN 44 HG2 GLN 44 15.957 25.743 9.269 342 HG3 GLN 44 HG3 GLN 44 14.506 25.118 10.037 343 HE21 GLN 44 HE22 GLN 44 15.007 24.323 12.115 344 HE22 GLN 44 HE21 GLN 44 16.399 23.337 12.488 345 H ALA 45 H ALA 45 12.336 22.434 6.980 346 HA ALA 45 HA ALA 45 10.306 23.759 8.429 347 HB1 ALA 45 HB3 ALA 45 8.736 22.601 6.939 348 HB2 ALA 45 HB1 ALA 45 10.135 23.197 6.019 349 HB3 ALA 45 HB2 ALA 45 9.989 21.468 6.431 350 H ILE 46 H ILE 46 11.262 20.261 8.427 351 HA ILE 46 HA ILE 46 9.123 19.501 10.210 352 HB ILE 46 HB ILE 46 11.803 18.127 9.805 353 HG12 ILE 46 HG12 ILE 46 9.206 17.593 8.324 354 HG13 ILE 46 HG13 ILE 46 10.586 18.431 7.632 355 HG21 ILE 46 HG21 ILE 46 9.113 16.987 10.713 356 HG22 ILE 46 HG22 ILE 46 10.678 16.141 10.682 357 HG23 ILE 46 HG23 ILE 46 10.410 17.449 11.824 358 HD11 ILE 46 HD13 ILE 46 12.001 16.418 7.973 359 HD12 ILE 46 HD11 ILE 46 10.570 15.522 8.507 360 HD13 ILE 46 HD12 ILE 46 10.639 16.153 6.863 361 H LYS 47 H LYS 47 12.594 20.464 10.688 362 HA LYS 47 HA LYS 47 12.571 20.022 13.477 363 HB2 LYS 47 HB2 LYS 47 14.078 22.041 11.771 364 HB3 LYS 47 HB3 LYS 47 14.427 21.816 13.483 365 HG2 LYS 47 HG2 LYS 47 15.279 19.607 13.135 366 HG3 LYS 47 HG3 LYS 47 14.682 19.557 11.461 367 HD2 LYS 47 HD2 LYS 47 16.157 21.344 10.813 368 HD3 LYS 47 HD3 LYS 47 16.740 21.535 12.489 369 HE2 LYS 47 HE2 LYS 47 17.862 19.430 12.392 370 HE3 LYS 47 HE3 LYS 47 17.207 19.065 10.791 371 HZ1 LYS 47 HZ3 LYS 47 18.463 21.032 9.970 372 HZ2 LYS 47 HZ1 LYS 47 19.071 21.292 11.456 373 HZ3 LYS 47 HZ2 LYS 47 19.470 19.938 10.650 374 H ASP 48 H ASP 48 11.746 22.999 11.605 375 HA ASP 48 HA ASP 48 11.149 24.665 13.813 376 HB2 ASP 48 HB2 ASP 48 11.516 25.530 11.570 377 HB3 ASP 48 HB3 ASP 48 10.109 24.654 10.959 378 H SER 49 H SER 49 9.093 22.353 11.994 379 HA SER 49 HA SER 49 6.652 22.950 13.367 380 HB2 SER 49 HB2 SER 49 7.577 20.319 12.133 381 HB3 SER 49 HB3 SER 49 5.916 20.800 12.498 382 HG SER 49 HG SER 49 7.677 21.950 10.594 383 H THR 50 H THR 50 9.404 20.795 14.125 384 HA THR 50 HA THR 50 8.223 19.629 16.446 385 HB THR 50 HB THR 50 11.179 19.897 15.809 386 HG1 THR 50 HG1 THR 50 10.057 18.979 14.048 387 HG21 THR 50 HG23 THR 50 10.678 19.005 18.077 388 HG22 THR 50 HG21 THR 50 9.622 17.771 17.345 389 HG23 THR 50 HG22 THR 50 11.369 17.768 17.018 390 H ILE 51 H ILE 51 10.175 22.614 15.973 391 HA ILE 51 HA ILE 51 10.298 23.310 18.759 392 HB ILE 51 HB ILE 51 10.358 25.011 16.228 393 HG12 ILE 51 HG12 ILE 51 12.585 24.128 18.116 394 HG13 ILE 51 HG13 ILE 51 12.211 23.381 16.568 395 HG21 ILE 51 HG21 ILE 51 10.963 25.900 19.078 396 HG22 ILE 51 HG22 ILE 51 11.237 26.862 17.607 397 HG23 ILE 51 HG23 ILE 51 9.602 26.449 18.070 398 HD11 ILE 51 HD13 ILE 51 12.692 25.560 15.419 399 HD12 ILE 51 HD11 ILE 51 13.281 26.188 16.980 400 HD13 ILE 51 HD12 ILE 51 14.083 24.808 16.221 401 H ASN 52 H ASN 52 7.871 23.940 16.192 402 HA ASN 52 HA ASN 52 6.379 25.881 17.601 403 HB2 ASN 52 HB2 ASN 52 5.909 24.107 15.210 404 HB3 ASN 52 HB3 ASN 52 4.489 24.781 15.961 405 HD21 ASN 52 HD22 ASN 52 7.640 25.734 14.523 406 HD22 ASN 52 HD21 ASN 52 7.124 27.339 14.069 407 H ASN 53 H ASN 53 6.130 22.357 17.630 408 HA ASN 53 HA ASN 53 3.995 22.460 19.714 409 HB2 ASN 53 HB2 ASN 53 2.552 22.404 17.916 410 HB3 ASN 53 HB3 ASN 53 3.733 21.696 16.833 411 HD21 ASN 53 HD22 ASN 53 3.540 19.571 16.322 412 HD22 ASN 53 HD21 ASN 53 2.536 18.426 17.179 413 H GLY 54 H GLY 54 5.969 20.290 17.585 414 HA2 GLY 54 HA2 GLY 54 7.460 18.825 19.252 415 HA3 GLY 54 HA3 GLY 54 5.848 18.151 19.579 416 HA PRO 55 HA PRO 55 7.805 16.260 15.712 417 HB2 PRO 55 HB2 PRO 55 7.435 13.609 16.376 418 HB3 PRO 55 HB3 PRO 55 8.887 14.554 16.782 419 HG2 PRO 55 HG2 PRO 55 6.498 13.991 18.559 420 HG3 PRO 55 HG3 PRO 55 8.234 13.865 18.972 421 HD2 PRO 55 HD2 PRO 55 6.753 16.039 19.636 422 HD3 PRO 55 HD3 PRO 55 8.451 16.227 19.101 423 H TYR 56 H TYR 56 6.433 16.291 14.052 424 HA TYR 56 HA TYR 56 3.565 16.283 14.551 425 HB2 TYR 56 HB2 TYR 56 5.391 17.077 12.327 426 HB3 TYR 56 HB3 TYR 56 3.819 16.501 11.825 427 HD1 TYR 56 HD1 TYR 56 5.403 18.921 14.201 428 HD2 TYR 56 HD2 TYR 56 1.938 17.894 11.859 429 HE1 TYR 56 HE1 TYR 56 4.406 21.143 14.709 430 HE2 TYR 56 HE2 TYR 56 0.910 20.088 12.394 431 HH TYR 56 HH TYR 56 2.566 22.559 14.413 432 H TYR 57 H TYR 57 5.788 13.831 13.598 433 HA TYR 57 HA TYR 57 3.607 12.138 12.476 434 HB2 TYR 57 HB2 TYR 57 6.395 12.609 11.423 435 HB3 TYR 57 HB3 TYR 57 5.420 11.189 11.045 436 HD1 TYR 57 HD1 TYR 57 5.653 14.877 10.585 437 HD2 TYR 57 HD2 TYR 57 3.475 11.273 9.632 438 HE1 TYR 57 HE1 TYR 57 4.361 16.114 8.876 439 HE2 TYR 57 HE2 TYR 57 2.152 12.509 7.944 440 HH TYR 57 HH TYR 57 1.714 14.592 6.979 441 H ILE 58 H ILE 58 3.251 10.908 14.257 442 HA ILE 58 HA ILE 58 5.456 9.357 15.469 443 HB ILE 58 HB ILE 58 3.402 11.103 16.896 444 HG12 ILE 58 HG12 ILE 58 5.431 12.309 16.459 445 HG13 ILE 58 HG13 ILE 58 5.321 11.956 18.173 446 HG21 ILE 58 HG21 ILE 58 4.997 8.810 18.103 447 HG22 ILE 58 HG22 ILE 58 4.185 10.091 19.049 448 HG23 ILE 58 HG23 ILE 58 3.238 9.009 18.049 449 HD11 ILE 58 HD13 ILE 58 7.177 10.715 16.124 450 HD12 ILE 58 HD11 ILE 58 7.602 11.590 17.595 451 HD13 ILE 58 HD12 ILE 58 6.930 9.957 17.698 452 H LEU 59 H LEU 59 4.789 7.315 15.993 453 HA LEU 59 HA LEU 59 1.992 6.550 15.224 454 HB2 LEU 59 HB2 LEU 59 4.580 5.260 14.347 455 HB3 LEU 59 HB3 LEU 59 2.973 4.560 14.180 456 HG LEU 59 HG LEU 59 2.551 7.131 13.176 457 HD11 LEU 59 HD11 LEU 59 5.058 7.520 13.275 458 HD12 LEU 59 HD12 LEU 59 5.223 6.275 12.031 459 HD13 LEU 59 HD13 LEU 59 4.297 7.760 11.712 460 HD21 LEU 59 HD23 LEU 59 3.203 4.614 11.658 461 HD22 LEU 59 HD21 LEU 59 1.641 5.138 12.317 462 HD23 LEU 59 HD22 LEU 59 2.388 6.065 11.009 463 H ALA 60 H ALA 60 4.815 5.963 17.285 464 HA ALA 60 HA ALA 60 3.153 4.698 19.253 465 HB1 ALA 60 HB3 ALA 60 5.482 3.121 18.029 466 HB2 ALA 60 HB1 ALA 60 4.549 2.637 19.450 467 HB3 ALA 60 HB2 ALA 60 3.764 2.702 17.868 468 HA PRO 61 HA PRO 61 6.324 6.643 21.848 469 HB2 PRO 61 HB2 PRO 61 6.637 3.915 23.131 470 HB3 PRO 61 HB3 PRO 61 6.563 5.522 23.917 471 HG2 PRO 61 HG2 PRO 61 4.370 3.943 23.875 472 HG3 PRO 61 HG3 PRO 61 4.201 5.687 23.481 473 HD2 PRO 61 HD2 PRO 61 4.373 3.334 21.584 474 HD3 PRO 61 HD3 PRO 61 3.267 4.742 21.535 475 H GLY 62 H GLY 62 8.368 7.063 21.110 476 HA2 GLY 62 HA2 GLY 62 10.516 6.689 20.482 477 HA3 GLY 62 HA3 GLY 62 10.294 4.949 20.624 478 H VAL 63 H VAL 63 7.877 6.144 18.476 479 HA VAL 63 HA VAL 63 9.586 5.474 16.113 480 HB VAL 63 HB VAL 63 6.738 4.574 16.710 481 HG11 VAL 63 HG11 VAL 63 6.951 3.186 14.652 482 HG12 VAL 63 HG12 VAL 63 7.069 4.904 14.306 483 HG13 VAL 63 HG13 VAL 63 8.543 3.919 14.341 484 HG21 VAL 63 HG23 VAL 63 7.718 2.276 16.767 485 HG22 VAL 63 HG21 VAL 63 9.345 2.994 16.700 486 HG23 VAL 63 HG22 VAL 63 8.283 3.290 18.090 487 H ALA 64 H ALA 64 9.592 7.028 14.624 488 HA ALA 64 HA ALA 64 7.302 8.910 14.431 489 HB1 ALA 64 HB3 ALA 64 9.302 9.965 15.557 490 HB2 ALA 64 HB1 ALA 64 10.256 9.608 14.100 491 HB3 ALA 64 HB2 ALA 64 8.887 10.736 14.022 492 H MET 65 H MET 65 7.196 9.976 12.285 493 HA MET 65 HA MET 65 8.462 8.410 10.129 494 HB2 MET 65 HB2 MET 65 6.215 7.547 10.476 495 HB3 MET 65 HB3 MET 65 5.546 9.117 10.010 496 HG2 MET 65 HG2 MET 65 7.068 8.741 7.860 497 HG3 MET 65 HG3 MET 65 7.073 7.067 8.393 498 HE1 MET 65 HE3 MET 65 4.665 5.837 8.993 499 HE2 MET 65 HE1 MET 65 3.799 7.276 9.609 500 HE3 MET 65 HE2 MET 65 3.122 6.345 8.258 501 HA PRO 66 HA PRO 66 8.658 13.122 10.140 502 HB2 PRO 66 HB2 PRO 66 11.436 12.540 9.038 503 HB3 PRO 66 HB3 PRO 66 10.927 13.868 10.129 504 HG2 PRO 66 HG2 PRO 66 12.128 11.702 11.171 505 HG3 PRO 66 HG3 PRO 66 10.667 12.360 11.970 506 HD2 PRO 66 HD2 PRO 66 10.868 10.014 10.066 507 HD3 PRO 66 HD3 PRO 66 10.011 10.131 11.625 508 H HIS 67 H HIS 67 8.515 14.605 8.532 509 HA HIS 67 HA HIS 67 8.632 14.376 5.732 510 HB2 HIS 67 HB2 HIS 67 7.053 12.544 5.805 511 HB3 HIS 67 HB3 HIS 67 6.091 13.313 7.043 512 HD1 HIS 67 HD1 HIS 67 4.061 14.740 6.246 513 HD2 HIS 67 HD2 HIS 67 6.758 13.751 3.159 514 HE1 HIS 67 HE1 HIS 67 2.938 15.361 4.065 515 H ALA 68 H ALA 68 7.522 16.266 4.787 516 HA ALA 68 HA ALA 68 6.064 18.095 6.552 517 HB1 ALA 68 HB3 ALA 68 7.354 20.051 5.683 518 HB2 ALA 68 HB1 ALA 68 8.333 19.018 6.728 519 HB3 ALA 68 HB2 ALA 68 8.534 18.941 4.964 520 H ARG 69 H ARG 69 4.879 19.667 5.201 521 HA ARG 69 HA ARG 69 3.542 18.502 3.047 522 HB2 ARG 69 HB2 ARG 69 2.750 20.821 2.528 523 HB3 ARG 69 HB3 ARG 69 2.564 20.304 4.213 524 HG2 ARG 69 HG2 ARG 69 4.605 21.596 4.816 525 HG3 ARG 69 HG3 ARG 69 4.701 22.200 3.155 526 HD2 ARG 69 HD2 ARG 69 2.713 23.492 3.413 527 HD3 ARG 69 HD3 ARG 69 2.200 22.573 4.827 528 HE ARG 69 HE ARG 69 3.893 23.565 6.159 529 HH11 ARG 69 HH11 ARG 69 3.336 25.380 3.096 530 HH12 ARG 69 HH12 ARG 69 4.265 26.726 3.639 531 HH21 ARG 69 HH21 ARG 69 5.040 25.397 6.818 532 HH22 ARG 69 HH22 ARG 69 5.187 26.767 5.788 533 HA PRO 70 HA PRO 70 6.382 18.239 -0.284 534 HB2 PRO 70 HB2 PRO 70 4.121 19.522 -1.900 535 HB3 PRO 70 HB3 PRO 70 5.188 18.187 -2.385 536 HG2 PRO 70 HG2 PRO 70 2.711 17.677 -1.421 537 HG3 PRO 70 HG3 PRO 70 4.084 16.686 -0.833 538 HD2 PRO 70 HD2 PRO 70 2.676 18.961 0.545 539 HD3 PRO 70 HD3 PRO 70 3.364 17.453 1.223 540 H GLU 71 H GLU 71 4.477 21.291 -0.273 541 HA GLU 71 HA GLU 71 6.216 22.888 -1.781 542 HB2 GLU 71 HB2 GLU 71 4.863 24.759 -0.859 543 HB3 GLU 71 HB3 GLU 71 3.916 23.416 -1.505 544 HG2 GLU 71 HG2 GLU 71 3.517 22.585 0.817 545 HG3 GLU 71 HG3 GLU 71 4.471 23.929 1.445 546 H CYS 72 H CYS 72 6.890 21.710 1.337 547 HA CYS 72 HA CYS 72 8.505 24.016 2.202 548 HB2 CYS 72 HB2 CYS 72 8.165 21.183 3.273 549 HB3 CYS 72 HB3 CYS 72 9.362 22.320 3.908 550 HG CYS 72 HG CYS 72 7.727 24.258 4.467 551 H GLY 73 H GLY 73 8.914 21.726 -0.255 552 HA2 GLY 73 HA2 GLY 73 10.978 22.445 -1.484 553 HA3 GLY 73 HA3 GLY 73 11.901 21.991 -0.050 554 H ALA 74 H ALA 74 9.191 19.885 -0.794 555 HA ALA 74 HA ALA 74 10.949 17.662 -1.476 556 HB1 ALA 74 HB3 ALA 74 8.917 16.458 -1.932 557 HB2 ALA 74 HB1 ALA 74 8.728 17.336 -0.399 558 HB3 ALA 74 HB2 ALA 74 7.971 17.955 -1.894 559 H LEU 75 H LEU 75 11.337 16.816 -3.482 560 HA LEU 75 HA LEU 75 10.676 18.519 -5.856 561 HB2 LEU 75 HB2 LEU 75 13.251 17.030 -5.230 562 HB3 LEU 75 HB3 LEU 75 12.929 17.950 -6.694 563 HG LEU 75 HG LEU 75 13.131 19.108 -3.877 564 HD11 LEU 75 HD11 LEU 75 15.069 19.211 -6.230 565 HD12 LEU 75 HD12 LEU 75 15.250 20.099 -4.700 566 HD13 LEU 75 HD13 LEU 75 15.294 18.335 -4.702 567 HD21 LEU 75 HD23 LEU 75 11.637 20.494 -5.272 568 HD22 LEU 75 HD21 LEU 75 13.176 21.317 -5.036 569 HD23 LEU 75 HD22 LEU 75 12.837 20.509 -6.583 570 H LYS 76 H LYS 76 11.254 15.263 -4.549 571 HA LYS 76 HA LYS 76 9.707 14.095 -6.759 572 HB2 LYS 76 HB2 LYS 76 12.379 13.160 -5.666 573 HB3 LYS 76 HB3 LYS 76 11.346 12.159 -6.697 574 HG2 LYS 76 HG2 LYS 76 11.690 13.674 -8.573 575 HG3 LYS 76 HG3 LYS 76 12.537 14.835 -7.541 576 HD2 LYS 76 HD2 LYS 76 14.139 13.604 -8.876 577 HD3 LYS 76 HD3 LYS 76 14.368 13.281 -7.152 578 HE2 LYS 76 HE2 LYS 76 13.155 11.119 -7.399 579 HE3 LYS 76 HE3 LYS 76 12.915 11.450 -9.120 580 HZ1 LYS 76 HZ3 LYS 76 15.321 11.384 -9.401 581 HZ2 LYS 76 HZ1 LYS 76 15.552 11.102 -7.803 582 HZ3 LYS 76 HZ2 LYS 76 14.803 9.993 -8.735 583 H THR 77 H THR 77 8.918 11.790 -5.985 584 HA THR 77 HA THR 77 8.335 11.914 -3.140 585 HB THR 77 HB THR 77 7.193 10.363 -5.486 586 HG1 THR 77 HG1 THR 77 5.818 11.896 -5.629 587 HG21 THR 77 HG23 THR 77 6.223 10.520 -2.609 588 HG22 THR 77 HG21 THR 77 5.384 9.716 -3.969 589 HG23 THR 77 HG22 THR 77 6.934 9.094 -3.406 590 H GLY 78 H GLY 78 9.549 10.667 -1.722 591 HA2 GLY 78 HA2 GLY 78 10.324 8.004 -2.376 592 HA3 GLY 78 HA3 GLY 78 11.730 9.080 -2.425 593 H MET 79 H MET 79 12.086 7.251 -0.549 594 HA MET 79 HA MET 79 11.291 8.458 2.068 595 HB2 MET 79 HB2 MET 79 11.002 5.565 1.189 596 HB3 MET 79 HB3 MET 79 10.812 6.102 2.849 597 HG2 MET 79 HG2 MET 79 8.844 7.362 2.319 598 HG3 MET 79 HG3 MET 79 9.074 7.110 0.580 599 HE1 MET 79 HE3 MET 79 6.747 6.267 0.270 600 HE2 MET 79 HE1 MET 79 6.034 4.827 1.019 601 HE3 MET 79 HE2 MET 79 6.274 6.307 1.974 602 H SER 80 H SER 80 12.427 7.460 3.917 603 HA SER 80 HA SER 80 15.007 6.143 3.403 604 HB2 SER 80 HB2 SER 80 15.944 7.917 5.113 605 HB3 SER 80 HB3 SER 80 15.830 8.341 3.399 606 HG SER 80 HG SER 80 14.853 9.767 5.261 607 H LEU 81 H LEU 81 15.880 5.242 5.480 608 HA LEU 81 HA LEU 81 13.862 4.927 7.665 609 HB2 LEU 81 HB2 LEU 81 14.942 2.857 5.827 610 HB3 LEU 81 HB3 LEU 81 15.215 2.488 7.521 611 HG LEU 81 HG LEU 81 12.757 2.765 7.921 612 HD11 LEU 81 HD11 LEU 81 11.316 2.480 5.795 613 HD12 LEU 81 HD12 LEU 81 12.012 4.074 6.027 614 HD13 LEU 81 HD13 LEU 81 12.754 2.971 4.863 615 HD21 LEU 81 HD23 LEU 81 13.703 0.549 7.722 616 HD22 LEU 81 HD21 LEU 81 12.165 0.567 6.868 617 HD23 LEU 81 HD22 LEU 81 13.689 0.640 5.953 618 H THR 82 H THR 82 14.817 5.240 9.644 619 HA THR 82 HA THR 82 17.788 5.067 9.852 620 HB THR 82 HB THR 82 15.925 7.220 10.944 621 HG1 THR 82 HG1 THR 82 16.021 7.457 8.749 622 HG21 THR 82 HG23 THR 82 18.958 7.052 10.825 623 HG22 THR 82 HG21 THR 82 18.013 8.467 11.366 624 HG23 THR 82 HG22 THR 82 17.920 6.947 12.268 625 H LEU 83 H LEU 83 18.453 4.048 11.712 626 HA LEU 83 HA LEU 83 16.509 3.940 13.963 627 HB2 LEU 83 HB2 LEU 83 16.925 1.615 12.855 628 HB3 LEU 83 HB3 LEU 83 18.566 1.761 13.498 629 HG LEU 83 HG LEU 83 17.338 2.271 15.793 630 HD11 LEU 83 HD11 LEU 83 15.078 0.769 14.394 631 HD12 LEU 83 HD12 LEU 83 15.153 1.418 16.067 632 HD13 LEU 83 HD13 LEU 83 15.108 2.510 14.697 633 HD21 LEU 83 HD23 LEU 83 17.138 -0.559 14.843 634 HD22 LEU 83 HD21 LEU 83 18.654 0.216 15.357 635 HD23 LEU 83 HD22 LEU 83 17.304 0.043 16.493 636 H LEU 84 H LEU 84 17.347 4.345 15.949 637 HA LEU 84 HA LEU 84 20.197 5.230 16.207 638 HB2 LEU 84 HB2 LEU 84 17.614 6.445 17.212 639 HB3 LEU 84 HB3 LEU 84 19.129 6.670 18.088 640 HG LEU 84 HG LEU 84 20.115 7.959 16.387 641 HD11 LEU 84 HD11 LEU 84 18.899 8.599 14.299 642 HD12 LEU 84 HD12 LEU 84 19.400 6.913 14.336 643 HD13 LEU 84 HD13 LEU 84 17.701 7.327 14.657 644 HD21 LEU 84 HD23 LEU 84 17.199 8.719 16.886 645 HD22 LEU 84 HD21 LEU 84 18.605 9.109 17.901 646 HD23 LEU 84 HD22 LEU 84 18.432 9.834 16.294 647 H GLU 85 H GLU 85 21.125 3.687 17.521 648 HA GLU 85 HA GLU 85 19.677 1.698 18.877 649 HB2 GLU 85 HB2 GLU 85 22.558 2.636 19.180 650 HB3 GLU 85 HB3 GLU 85 21.913 1.171 19.930 651 HG2 GLU 85 HG2 GLU 85 21.317 0.263 17.708 652 HG3 GLU 85 HG3 GLU 85 21.975 1.697 16.925 653 H GLN 86 H GLN 86 20.703 4.850 20.034 654 HA GLN 86 HA GLN 86 19.699 4.224 22.784 655 HB2 GLN 86 HB2 GLN 86 21.428 6.507 21.724 656 HB3 GLN 86 HB3 GLN 86 20.910 6.332 23.394 657 HG2 GLN 86 HG2 GLN 86 22.076 4.158 23.591 658 HG3 GLN 86 HG3 GLN 86 22.582 4.250 21.906 659 HE21 GLN 86 HE22 GLN 86 24.165 5.786 21.266 660 HE22 GLN 86 HE21 GLN 86 25.273 6.492 22.435 661 H GLY 87 H GLY 87 18.619 5.562 19.889 662 HA2 GLY 87 HA2 GLY 87 17.082 7.105 19.262 663 HA3 GLY 87 HA3 GLY 87 16.355 6.952 20.867 664 H VAL 88 H VAL 88 16.039 9.376 20.016 665 HA VAL 88 HA VAL 88 17.635 10.818 21.939 666 HB VAL 88 HB VAL 88 18.626 10.933 19.398 667 HG11 VAL 88 HG11 VAL 88 18.014 12.952 18.296 668 HG12 VAL 88 HG12 VAL 88 16.599 11.884 18.461 669 HG13 VAL 88 HG13 VAL 88 16.778 13.322 19.508 670 HG21 VAL 88 HG23 VAL 88 18.687 13.175 21.418 671 HG22 VAL 88 HG21 VAL 88 19.725 11.720 21.368 672 HG23 VAL 88 HG22 VAL 88 19.820 12.918 20.068 673 H TYR 89 H TYR 89 16.448 13.021 22.346 674 HA TYR 89 HA TYR 89 13.609 12.172 22.306 675 HB2 TYR 89 HB2 TYR 89 14.531 12.324 24.506 676 HB3 TYR 89 HB3 TYR 89 15.006 14.000 24.232 677 HD1 TYR 89 HD1 TYR 89 11.654 12.652 23.029 678 HD2 TYR 89 HD2 TYR 89 13.774 14.903 26.084 679 HE1 TYR 89 HE1 TYR 89 9.544 13.446 23.927 680 HE2 TYR 89 HE2 TYR 89 11.616 15.752 26.933 681 HH TYR 89 HH TYR 89 9.283 15.761 26.650 682 H PHE 90 H PHE 90 12.465 12.974 20.826 683 HA PHE 90 HA PHE 90 12.630 15.714 19.777 684 HB2 PHE 90 HB2 PHE 90 10.913 13.242 19.387 685 HB3 PHE 90 HB3 PHE 90 10.464 14.798 18.692 686 HD1 PHE 90 HD1 PHE 90 13.524 12.530 18.758 687 HD2 PHE 90 HD2 PHE 90 11.043 15.251 16.492 688 HE1 PHE 90 HE1 PHE 90 14.857 12.079 16.743 689 HE2 PHE 90 HE2 PHE 90 12.362 14.748 14.471 690 HZ PHE 90 HZ PHE 90 14.295 13.200 14.586 691 HA PRO 91 HA PRO 91 10.345 16.557 23.560 692 HB2 PRO 91 HB2 PRO 91 9.654 19.214 23.176 693 HB3 PRO 91 HB3 PRO 91 11.259 18.626 23.699 694 HG2 PRO 91 HG2 PRO 91 10.364 19.353 20.899 695 HG3 PRO 91 HG3 PRO 91 11.882 19.816 21.736 696 HD2 PRO 91 HD2 PRO 91 11.808 17.758 19.976 697 HD3 PRO 91 HD3 PRO 91 12.791 17.642 21.468 698 H GLY 92 H GLY 92 8.473 15.434 23.682 699 HA2 GLY 92 HA2 GLY 92 6.009 16.182 23.651 700 HA3 GLY 92 HA3 GLY 92 6.190 16.115 21.895 701 H ASN 93 H ASN 93 8.020 13.682 22.027 702 HA ASN 93 HA ASN 93 5.900 11.676 22.051 703 HB2 ASN 93 HB2 ASN 93 7.984 11.631 20.573 704 HB3 ASN 93 HB3 ASN 93 8.890 11.133 22.000 705 HD21 ASN 93 HD22 ASN 93 6.364 10.168 19.674 706 HD22 ASN 93 HD21 ASN 93 6.357 8.476 20.099 707 H ASP 94 H ASP 94 6.059 9.646 23.431 708 HA ASP 94 HA ASP 94 6.231 10.297 26.223 709 HB2 ASP 94 HB2 ASP 94 4.698 8.584 25.349 710 HB3 ASP 94 HB3 ASP 94 6.073 7.621 24.800 711 H GLU 95 H GLU 95 8.477 8.815 23.904 712 HA GLU 95 HA GLU 95 10.638 8.962 25.885 713 HB2 GLU 95 HB2 GLU 95 11.087 6.673 25.842 714 HB3 GLU 95 HB3 GLU 95 9.328 6.747 25.861 715 HG2 GLU 95 HG2 GLU 95 9.220 6.290 23.468 716 HG3 GLU 95 HG3 GLU 95 10.986 6.282 23.366 717 HA PRO 96 HA PRO 96 13.399 10.072 22.626 718 HB2 PRO 96 HB2 PRO 96 14.967 7.520 23.030 719 HB3 PRO 96 HB3 PRO 96 15.569 9.200 22.918 720 HG2 PRO 96 HG2 PRO 96 15.364 8.003 25.328 721 HG3 PRO 96 HG3 PRO 96 14.826 9.703 25.127 722 HD2 PRO 96 HD2 PRO 96 13.141 7.187 25.131 723 HD3 PRO 96 HD3 PRO 96 12.857 8.733 25.995 724 H ILE 97 H ILE 97 13.252 9.907 20.393 725 HA ILE 97 HA ILE 97 11.802 7.656 19.228 726 HB ILE 97 HB ILE 97 13.219 9.936 17.813 727 HG12 ILE 97 HG12 ILE 97 11.541 10.964 19.159 728 HG13 ILE 97 HG13 ILE 97 10.918 10.886 17.519 729 HG21 ILE 97 HG21 ILE 97 12.841 7.958 16.364 730 HG22 ILE 97 HG22 ILE 97 11.142 7.906 16.841 731 HG23 ILE 97 HG23 ILE 97 11.761 9.285 15.920 732 HD11 ILE 97 HD13 ILE 97 9.145 10.363 19.038 733 HD12 ILE 97 HD11 ILE 97 9.552 8.850 18.222 734 HD13 ILE 97 HD12 ILE 97 10.101 9.151 19.897 735 H LYS 98 H LYS 98 12.737 5.811 18.762 736 HA LYS 98 HA LYS 98 15.692 5.692 18.378 737 HB2 LYS 98 HB2 LYS 98 13.687 3.440 18.744 738 HB3 LYS 98 HB3 LYS 98 15.443 3.299 18.648 739 HG2 LYS 98 HG2 LYS 98 15.446 4.889 20.746 740 HG3 LYS 98 HG3 LYS 98 13.732 4.483 20.863 741 HD2 LYS 98 HD2 LYS 98 14.880 3.001 22.319 742 HD3 LYS 98 HD3 LYS 98 14.425 2.022 20.909 743 HE2 LYS 98 HE2 LYS 98 16.722 2.301 19.978 744 HE3 LYS 98 HE3 LYS 98 17.139 3.368 21.316 745 HZ1 LYS 98 HZ3 LYS 98 16.566 0.475 21.525 746 HZ2 LYS 98 HZ1 LYS 98 17.998 1.249 21.768 747 HZ3 LYS 98 HZ2 LYS 98 16.771 1.456 22.823 748 H LEU 99 H LEU 99 12.673 5.678 16.585 749 HA LEU 99 HA LEU 99 14.120 4.647 14.205 750 HB2 LEU 99 HB2 LEU 99 12.922 2.796 15.356 751 HB3 LEU 99 HB3 LEU 99 11.480 3.792 15.466 752 HG LEU 99 HG LEU 99 11.168 3.664 13.027 753 HD11 LEU 99 HD11 LEU 99 12.435 1.908 11.727 754 HD12 LEU 99 HD12 LEU 99 13.451 3.270 12.179 755 HD13 LEU 99 HD13 LEU 99 13.564 1.742 13.057 756 HD21 LEU 99 HD23 LEU 99 11.494 0.955 14.375 757 HD22 LEU 99 HD21 LEU 99 10.163 2.081 14.694 758 HD23 LEU 99 HD22 LEU 99 10.339 1.403 13.095 759 H LEU 100 H LEU 100 13.773 5.766 12.420 760 HA LEU 100 HA LEU 100 11.506 7.695 12.317 761 HB2 LEU 100 HB2 LEU 100 14.321 8.521 11.514 762 HB3 LEU 100 HB3 LEU 100 12.883 9.487 11.686 763 HG LEU 100 HG LEU 100 13.050 8.556 14.202 764 HD11 LEU 100 HD11 LEU 100 15.360 8.495 15.013 765 HD12 LEU 100 HD12 LEU 100 15.162 7.259 13.762 766 HD13 LEU 100 HD13 LEU 100 15.968 8.783 13.368 767 HD21 LEU 100 HD23 LEU 100 12.952 10.939 13.562 768 HD22 LEU 100 HD21 LEU 100 14.017 10.599 14.936 769 HD23 LEU 100 HD22 LEU 100 14.717 10.917 13.339 770 H ILE 101 H ILE 101 10.409 7.097 10.545 771 HA ILE 101 HA ILE 101 11.871 6.171 8.121 772 HB ILE 101 HB ILE 101 9.015 5.955 9.146 773 HG12 ILE 101 HG12 ILE 101 9.253 3.633 8.884 774 HG13 ILE 101 HG13 ILE 101 10.694 3.778 7.904 775 HG21 ILE 101 HG21 ILE 101 8.880 6.665 6.778 776 HG22 ILE 101 HG22 ILE 101 9.865 5.268 6.326 777 HG23 ILE 101 HG23 ILE 101 8.270 5.054 7.117 778 HD11 ILE 101 HD13 ILE 101 12.073 4.262 9.808 779 HD12 ILE 101 HD11 ILE 101 10.645 4.376 10.869 780 HD13 ILE 101 HD12 ILE 101 11.100 2.825 10.129 781 H GLY 102 H GLY 102 12.420 7.812 6.758 782 HA2 GLY 102 HA2 GLY 102 11.069 10.422 6.910 783 HA3 GLY 102 HA3 GLY 102 12.462 10.012 5.920 784 H LEU 103 H LEU 103 9.771 11.220 5.213 785 HA LEU 103 HA LEU 103 9.411 9.642 2.734 786 HB2 LEU 103 HB2 LEU 103 7.529 9.205 4.501 787 HB3 LEU 103 HB3 LEU 103 7.098 10.876 4.251 788 HG LEU 103 HG LEU 103 6.746 8.515 2.321 789 HD11 LEU 103 HD11 LEU 103 5.077 9.171 4.167 790 HD12 LEU 103 HD12 LEU 103 4.895 10.735 3.370 791 HD13 LEU 103 HD13 LEU 103 4.419 9.254 2.530 792 HD21 LEU 103 HD23 LEU 103 7.490 10.103 0.813 793 HD22 LEU 103 HD21 LEU 103 5.745 10.218 0.742 794 HD23 LEU 103 HD22 LEU 103 6.619 11.462 1.622 795 H SER 104 H SER 104 9.230 11.021 1.006 796 HA SER 104 HA SER 104 8.890 13.930 1.326 797 HB2 SER 104 HB2 SER 104 10.614 14.218 -0.464 798 HB3 SER 104 HB3 SER 104 11.262 13.660 1.093 799 HG SER 104 HG SER 104 11.018 11.465 0.097 800 H ALA 105 H ALA 105 7.571 14.755 -0.406 801 HA ALA 105 HA ALA 105 6.664 12.815 -2.442 802 HB1 ALA 105 HB3 ALA 105 5.173 12.435 -0.528 803 HB2 ALA 105 HB1 ALA 105 4.851 14.187 -0.422 804 HB3 ALA 105 HB2 ALA 105 4.319 13.269 -1.844 805 H ALA 106 H ALA 106 6.253 13.846 -4.338 806 HA ALA 106 HA ALA 106 6.840 16.669 -4.495 807 HB1 ALA 106 HB3 ALA 106 6.490 16.328 -6.929 808 HB2 ALA 106 HB1 ALA 106 7.554 15.080 -6.256 809 HB3 ALA 106 HB2 ALA 106 5.851 14.700 -6.616 810 H ASP 107 H ASP 107 3.919 14.744 -4.171 811 HA ASP 107 HA ASP 107 2.282 17.213 -4.185 812 HB2 ASP 107 HB2 ASP 107 2.092 16.334 -6.484 813 HB3 ASP 107 HB3 ASP 107 1.648 14.747 -5.857 814 H ALA 108 H ALA 108 0.259 16.927 -3.004 815 HA ALA 108 HA ALA 108 0.599 15.471 -0.637 816 HB1 ALA 108 HB3 ALA 108 -0.813 17.476 -0.785 817 HB2 ALA 108 HB1 ALA 108 -1.969 16.599 -1.822 818 HB3 ALA 108 HB2 ALA 108 -1.732 16.100 -0.135 819 H ASP 109 H ASP 109 -1.003 14.455 -3.665 820 HA ASP 109 HA ASP 109 -2.292 12.169 -2.366 821 HB2 ASP 109 HB2 ASP 109 -3.363 13.107 -4.253 822 HB3 ASP 109 HB3 ASP 109 -1.911 12.896 -5.263 823 H SER 110 H SER 110 0.731 12.789 -4.122 824 HA SER 110 HA SER 110 1.641 10.071 -4.256 825 HB2 SER 110 HB2 SER 110 3.412 12.525 -3.896 826 HB3 SER 110 HB3 SER 110 3.787 11.002 -4.699 827 HG SER 110 HG SER 110 2.300 11.534 -6.324 828 H HIS 111 H HIS 111 1.904 12.655 -1.789 829 HA HIS 111 HA HIS 111 3.256 11.214 0.243 830 HB2 HIS 111 HB2 HIS 111 3.103 13.383 0.869 831 HB3 HIS 111 HB3 HIS 111 1.608 13.634 -0.012 832 HD1 HIS 111 HD1 HIS 111 -0.598 13.648 1.312 833 HD2 HIS 111 HD2 HIS 111 2.793 12.462 3.497 834 HE1 HIS 111 HE1 HIS 111 -1.285 13.677 3.781 835 H ILE 112 H ILE 112 -0.287 11.480 -0.392 836 HA ILE 112 HA ILE 112 -1.102 9.905 1.786 837 HB ILE 112 HB ILE 112 -2.235 10.628 -0.922 838 HG12 ILE 112 HG12 ILE 112 -2.162 12.269 1.000 839 HG13 ILE 112 HG13 ILE 112 -3.723 12.037 0.233 840 HG21 ILE 112 HG21 ILE 112 -4.438 9.698 -0.315 841 HG22 ILE 112 HG22 ILE 112 -3.210 8.510 -0.746 842 HG23 ILE 112 HG23 ILE 112 -3.635 8.761 0.972 843 HD11 ILE 112 HD13 ILE 112 -4.505 10.692 2.079 844 HD12 ILE 112 HD11 ILE 112 -2.886 10.649 2.812 845 HD13 ILE 112 HD12 ILE 112 -3.789 12.188 2.716 846 H GLY 113 H GLY 113 -0.256 8.738 -1.563 847 HA2 GLY 113 HA2 GLY 113 -0.871 6.011 -0.790 848 HA3 GLY 113 HA3 GLY 113 0.022 6.528 -2.249 849 H ALA 114 H ALA 114 2.076 7.992 -0.745 850 HA ALA 114 HA ALA 114 3.965 5.904 -0.170 851 HB1 ALA 114 HB3 ALA 114 3.899 8.905 0.356 852 HB2 ALA 114 HB1 ALA 114 5.321 7.890 0.596 853 HB3 ALA 114 HB2 ALA 114 4.641 8.090 -1.022 854 H ILE 115 H ILE 115 2.071 8.119 1.988 855 HA ILE 115 HA ILE 115 2.976 7.230 4.466 856 HB ILE 115 HB ILE 115 0.521 8.372 3.315 857 HG12 ILE 115 HG12 ILE 115 2.412 9.908 3.698 858 HG13 ILE 115 HG13 ILE 115 0.953 10.359 4.561 859 HG21 ILE 115 HG21 ILE 115 -0.559 7.104 4.877 860 HG22 ILE 115 HG22 ILE 115 0.632 7.470 6.153 861 HG23 ILE 115 HG23 ILE 115 -0.498 8.733 5.539 862 HD11 ILE 115 HD13 ILE 115 1.911 9.458 6.670 863 HD12 ILE 115 HD11 ILE 115 3.371 8.995 5.766 864 HD13 ILE 115 HD12 ILE 115 2.944 10.702 5.938 865 H GLN 116 H GLN 116 0.348 6.026 2.312 866 HA GLN 116 HA GLN 116 -0.508 3.944 4.066 867 HB2 GLN 116 HB2 GLN 116 -0.941 4.567 1.124 868 HB3 GLN 116 HB3 GLN 116 -1.652 3.133 1.892 869 HG2 GLN 116 HG2 GLN 116 -2.776 4.566 3.545 870 HG3 GLN 116 HG3 GLN 116 -2.028 5.991 2.809 871 HE21 GLN 116 HE22 GLN 116 -2.615 6.605 0.668 872 HE22 GLN 116 HE21 GLN 116 -4.146 6.107 -0.052 873 H ALA 117 H ALA 117 2.438 4.065 2.285 874 HA ALA 117 HA ALA 117 2.579 1.147 2.130 875 HB1 ALA 117 HB3 ALA 117 4.742 1.546 0.998 876 HB2 ALA 117 HB1 ALA 117 3.425 2.389 0.159 877 HB3 ALA 117 HB2 ALA 117 4.532 3.292 1.204 878 H LEU 118 H LEU 118 3.835 4.023 3.797 879 HA LEU 118 HA LEU 118 5.726 2.538 5.362 880 HB2 LEU 118 HB2 LEU 118 4.449 5.282 5.773 881 HB3 LEU 118 HB3 LEU 118 5.829 4.669 6.701 882 HG LEU 118 HG LEU 118 5.756 4.943 3.674 883 HD11 LEU 118 HD11 LEU 118 6.952 6.792 5.758 884 HD12 LEU 118 HD12 LEU 118 7.294 6.878 4.021 885 HD13 LEU 118 HD13 LEU 118 5.640 7.120 4.621 886 HD21 LEU 118 HD23 LEU 118 7.481 3.526 3.815 887 HD22 LEU 118 HD21 LEU 118 8.432 4.864 4.443 888 HD23 LEU 118 HD22 LEU 118 7.691 3.689 5.550 889 H SER 119 H SER 119 2.365 3.526 5.822 890 HA SER 119 HA SER 119 2.053 2.714 8.494 891 HB2 SER 119 HB2 SER 119 0.023 2.543 6.223 892 HB3 SER 119 HB3 SER 119 -0.340 2.588 7.957 893 HG SER 119 HG SER 119 0.874 4.635 6.379 894 H GLU 120 H GLU 120 2.613 0.657 5.671 895 HA GLU 120 HA GLU 120 1.389 -1.705 6.750 896 HB2 GLU 120 HB2 GLU 120 3.684 -1.461 4.776 897 HB3 GLU 120 HB3 GLU 120 2.810 -2.937 5.141 898 HG2 GLU 120 HG2 GLU 120 1.472 -0.445 4.052 899 HG3 GLU 120 HG3 GLU 120 2.090 -1.741 3.029 900 H LEU 121 H LEU 121 4.336 0.052 7.308 901 HA LEU 121 HA LEU 121 5.552 -2.187 8.842 902 HB2 LEU 121 HB2 LEU 121 6.741 0.435 7.850 903 HB3 LEU 121 HB3 LEU 121 7.606 -0.797 8.755 904 HG LEU 121 HG LEU 121 6.510 -0.978 5.921 905 HD11 LEU 121 HD11 LEU 121 8.639 0.175 6.142 906 HD12 LEU 121 HD12 LEU 121 9.311 -1.145 7.120 907 HD13 LEU 121 HD13 LEU 121 8.928 -1.414 5.411 908 HD21 LEU 121 HD23 LEU 121 7.403 -3.265 5.764 909 HD22 LEU 121 HD21 LEU 121 7.777 -3.264 7.492 910 HD23 LEU 121 HD22 LEU 121 6.091 -3.193 6.937 911 H LEU 122 H LEU 122 5.226 1.408 9.269 912 HA LEU 122 HA LEU 122 5.814 1.139 12.077 913 HB2 LEU 122 HB2 LEU 122 4.814 3.500 10.478 914 HB3 LEU 122 HB3 LEU 122 5.333 3.542 12.168 915 HG LEU 122 HG LEU 122 7.012 3.045 9.702 916 HD11 LEU 122 HD11 LEU 122 6.772 5.341 10.324 917 HD12 LEU 122 HD12 LEU 122 7.095 4.995 12.042 918 HD13 LEU 122 HD13 LEU 122 8.384 4.852 10.878 919 HD21 LEU 122 HD23 LEU 122 7.823 1.304 11.174 920 HD22 LEU 122 HD21 LEU 122 8.969 2.629 11.236 921 HD23 LEU 122 HD22 LEU 122 7.828 2.407 12.568 922 H CYS 123 H CYS 123 2.882 0.322 10.672 923 HA CYS 123 HA CYS 123 1.507 0.867 13.260 924 HB2 CYS 123 HB2 CYS 123 0.169 0.332 10.585 925 HB3 CYS 123 HB3 CYS 123 -0.613 0.802 12.088 926 HG CYS 123 HG CYS 123 -0.720 2.821 10.450 927 H GLU 124 H GLU 124 3.334 -1.335 12.590 928 HA GLU 124 HA GLU 124 1.544 -3.612 13.087 929 HB2 GLU 124 HB2 GLU 124 2.097 -3.314 10.606 930 HB3 GLU 124 HB3 GLU 124 3.781 -3.636 11.015 931 HG2 GLU 124 HG2 GLU 124 2.749 -5.614 10.189 932 HG3 GLU 124 HG3 GLU 124 3.141 -5.838 11.902 933 H GLU 125 H GLU 125 2.088 -3.832 15.168 934 HA GLU 125 HA GLU 125 4.550 -3.165 16.275 935 HB2 GLU 125 HB2 GLU 125 3.781 -4.246 18.296 936 HB3 GLU 125 HB3 GLU 125 2.477 -3.334 17.540 937 HG2 GLU 125 HG2 GLU 125 1.569 -5.472 16.586 938 HG3 GLU 125 HG3 GLU 125 2.848 -6.362 17.412 939 H GLU 126 H GLU 126 3.693 -6.099 14.608 940 HA GLU 126 HA GLU 126 5.738 -7.811 15.614 941 HB2 GLU 126 HB2 GLU 126 4.404 -7.696 12.878 942 HB3 GLU 126 HB3 GLU 126 5.471 -8.999 13.403 943 HG2 GLU 126 HG2 GLU 126 2.893 -8.209 14.803 944 HG3 GLU 126 HG3 GLU 126 3.021 -9.479 13.588 945 H ILE 127 H ILE 127 5.564 -5.575 12.863 946 HA ILE 127 HA ILE 127 8.278 -5.916 11.959 947 HB ILE 127 HB ILE 127 6.001 -4.096 11.372 948 HG12 ILE 127 HG12 ILE 127 6.302 -4.852 9.088 949 HG13 ILE 127 HG13 ILE 127 7.762 -5.750 9.534 950 HG21 ILE 127 HG21 ILE 127 8.854 -3.556 10.550 951 HG22 ILE 127 HG22 ILE 127 7.458 -2.918 9.670 952 HG23 ILE 127 HG23 ILE 127 7.696 -2.451 11.343 953 HD11 ILE 127 HD13 ILE 127 6.430 -7.344 10.812 954 HD12 ILE 127 HD11 ILE 127 4.972 -6.340 10.579 955 HD13 ILE 127 HD12 ILE 127 5.724 -7.162 9.198 956 H LEU 128 H LEU 128 6.576 -3.581 14.092 957 HA LEU 128 HA LEU 128 8.589 -1.691 14.241 958 HB2 LEU 128 HB2 LEU 128 6.674 -2.550 16.450 959 HB3 LEU 128 HB3 LEU 128 7.771 -1.193 16.612 960 HG LEU 128 HG LEU 128 5.519 -1.379 14.577 961 HD11 LEU 128 HD11 LEU 128 4.804 -0.950 16.920 962 HD12 LEU 128 HD12 LEU 128 5.921 0.426 17.002 963 HD13 LEU 128 HD13 LEU 128 4.544 0.455 15.880 964 HD21 LEU 128 HD23 LEU 128 7.686 0.714 15.004 965 HD22 LEU 128 HD21 LEU 128 7.233 -0.117 13.499 966 HD23 LEU 128 HD22 LEU 128 6.137 1.070 14.216 967 H GLU 129 H GLU 129 8.431 -4.658 16.207 968 HA GLU 129 HA GLU 129 10.721 -3.955 17.768 969 HB2 GLU 129 HB2 GLU 129 9.049 -6.413 17.387 970 HB3 GLU 129 HB3 GLU 129 10.708 -6.655 17.956 971 HG2 GLU 129 HG2 GLU 129 10.385 -5.063 19.783 972 HG3 GLU 129 HG3 GLU 129 8.721 -4.760 19.262 973 H GLN 130 H GLN 130 10.281 -5.591 14.627 974 HA GLN 130 HA GLN 130 12.932 -6.708 14.595 975 HB2 GLN 130 HB2 GLN 130 10.768 -6.342 12.488 976 HB3 GLN 130 HB3 GLN 130 12.304 -7.198 12.201 977 HG2 GLN 130 HG2 GLN 130 11.812 -8.843 13.873 978 HG3 GLN 130 HG3 GLN 130 10.349 -7.995 14.376 979 HE21 GLN 130 HE22 GLN 130 8.442 -8.441 13.342 980 HE22 GLN 130 HE21 GLN 130 8.284 -9.546 11.988 981 H LEU 131 H LEU 131 11.411 -3.680 13.484 982 HA LEU 131 HA LEU 131 13.817 -2.627 12.189 983 HB2 LEU 131 HB2 LEU 131 11.441 -1.219 13.460 984 HB3 LEU 131 HB3 LEU 131 12.712 -0.418 12.554 985 HG LEU 131 HG LEU 131 10.946 -2.604 11.323 986 HD11 LEU 131 HD11 LEU 131 10.392 0.363 11.229 987 HD12 LEU 131 HD12 LEU 131 9.407 -0.942 10.562 988 HD13 LEU 131 HD13 LEU 131 9.582 -0.790 12.331 989 HD21 LEU 131 HD23 LEU 131 12.480 -0.278 10.085 990 HD22 LEU 131 HD21 LEU 131 12.945 -1.991 10.011 991 HD23 LEU 131 HD22 LEU 131 11.477 -1.438 9.196 992 H LEU 132 H LEU 132 12.132 -2.059 15.302 993 HA LEU 132 HA LEU 132 14.014 -0.333 16.432 994 HB2 LEU 132 HB2 LEU 132 12.040 -2.207 17.733 995 HB3 LEU 132 HB3 LEU 132 13.056 -1.172 18.703 996 HG LEU 132 HG LEU 132 11.251 -0.023 16.545 997 HD11 LEU 132 HD11 LEU 132 9.871 -1.229 18.210 998 HD12 LEU 132 HD12 LEU 132 10.677 -0.348 19.524 999 HD13 LEU 132 HD13 LEU 132 9.666 0.523 18.348 1000 HD21 LEU 132 HD23 LEU 132 13.088 1.458 17.302 1001 HD22 LEU 132 HD21 LEU 132 11.514 2.063 17.833 1002 HD23 LEU 132 HD22 LEU 132 12.577 1.232 18.986 1003 H THR 133 H THR 133 14.616 -3.647 15.880 1004 HA THR 133 HA THR 133 16.871 -3.622 17.809 1005 HB THR 133 HB THR 133 16.686 -6.103 17.727 1006 HG1 THR 133 HG1 THR 133 14.145 -5.677 16.572 1007 HG21 THR 133 HG23 THR 133 14.120 -4.737 18.677 1008 HG22 THR 133 HG21 THR 133 14.720 -6.329 19.168 1009 HG23 THR 133 HG22 THR 133 15.636 -4.872 19.588 1010 H ALA 134 H ALA 134 16.515 -2.672 14.826 1011 HA ALA 134 HA ALA 134 18.004 -4.326 13.153 1012 HB1 ALA 134 HB3 ALA 134 18.352 -2.427 11.722 1013 HB2 ALA 134 HB1 ALA 134 16.666 -2.562 12.264 1014 HB3 ALA 134 HB2 ALA 134 17.757 -1.332 12.964 1015 H SER 135 H SER 135 19.782 -5.233 13.988 1016 HA SER 135 HA SER 135 21.787 -3.665 15.400 1017 HB2 SER 135 HB2 SER 135 21.725 -6.569 14.479 1018 HB3 SER 135 HB3 SER 135 22.894 -5.868 15.615 1019 HG SER 135 HG SER 135 20.072 -5.763 16.028 1020 H SER 136 H SER 136 21.151 -4.350 12.093 1021 HA SER 136 HA SER 136 23.644 -3.080 11.253 1022 HB2 SER 136 HB2 SER 136 22.688 -5.737 10.077 1023 HB3 SER 136 HB3 SER 136 24.073 -4.779 9.530 1024 HG SER 136 HG SER 136 24.691 -6.539 10.860 1025 H GLU 137 H GLU 137 23.311 -2.089 9.196 1026 HA GLU 137 HA GLU 137 20.795 -1.033 8.598 1027 HB2 GLU 137 HB2 GLU 137 23.160 -1.497 6.714 1028 HB3 GLU 137 HB3 GLU 137 21.842 -0.374 6.473 1029 HG2 GLU 137 HG2 GLU 137 23.291 1.115 7.245 1030 HG3 GLU 137 HG3 GLU 137 22.648 0.626 8.800 1031 H LYS 138 H LYS 138 22.237 -4.031 7.353 1032 HA LYS 138 HA LYS 138 20.421 -4.624 5.318 1033 HB2 LYS 138 HB2 LYS 138 22.470 -5.854 5.792 1034 HB3 LYS 138 HB3 LYS 138 21.720 -6.598 7.216 1035 HG2 LYS 138 HG2 LYS 138 20.200 -7.862 5.908 1036 HG3 LYS 138 HG3 LYS 138 20.356 -6.787 4.503 1037 HD2 LYS 138 HD2 LYS 138 22.622 -7.508 4.110 1038 HD3 LYS 138 HD3 LYS 138 22.583 -8.572 5.539 1039 HE2 LYS 138 HE2 LYS 138 20.717 -9.865 4.511 1040 HE3 LYS 138 HE3 LYS 138 20.766 -8.810 3.091 1041 HZ1 LYS 138 HZ3 LYS 138 23.017 -9.609 2.658 1042 HZ2 LYS 138 HZ1 LYS 138 22.972 -10.584 3.971 1043 HZ3 LYS 138 HZ2 LYS 138 21.976 -10.860 2.713 1044 H GLN 139 H GLN 139 19.924 -5.002 8.860 1045 HA GLN 139 HA GLN 139 17.586 -6.512 8.685 1046 HB2 GLN 139 HB2 GLN 139 19.298 -5.787 10.645 1047 HB3 GLN 139 HB3 GLN 139 18.062 -4.550 10.923 1048 HG2 GLN 139 HG2 GLN 139 16.361 -6.335 11.052 1049 HG3 GLN 139 HG3 GLN 139 17.644 -7.527 10.710 1050 HE21 GLN 139 HE22 GLN 139 15.801 -6.282 13.261 1051 HE22 GLN 139 HE21 GLN 139 16.938 -6.565 14.554 1052 H LEU 140 H LEU 140 18.064 -2.929 8.412 1053 HA LEU 140 HA LEU 140 15.213 -2.366 8.721 1054 HB2 LEU 140 HB2 LEU 140 17.552 -0.776 7.632 1055 HB3 LEU 140 HB3 LEU 140 15.904 -0.180 7.549 1056 HG LEU 140 HG LEU 140 17.245 -0.932 10.159 1057 HD11 LEU 140 HD11 LEU 140 18.517 0.885 9.178 1058 HD12 LEU 140 HD12 LEU 140 17.029 1.814 8.877 1059 HD13 LEU 140 HD13 LEU 140 17.576 1.493 10.533 1060 HD21 LEU 140 HD23 LEU 140 14.753 0.708 9.710 1061 HD22 LEU 140 HD21 LEU 140 14.873 -0.933 10.416 1062 HD23 LEU 140 HD22 LEU 140 15.566 0.438 11.259 1063 H ALA 141 H ALA 141 17.522 -2.898 6.003 1064 HA ALA 141 HA ALA 141 15.512 -2.473 3.990 1065 HB1 ALA 141 HB3 ALA 141 17.187 -3.208 2.421 1066 HB2 ALA 141 HB1 ALA 141 17.913 -2.110 3.605 1067 HB3 ALA 141 HB2 ALA 141 18.182 -3.877 3.749 1068 H ASP 142 H ASP 142 16.562 -5.423 5.680 1069 HA ASP 142 HA ASP 142 15.314 -7.317 3.999 1070 HB2 ASP 142 HB2 ASP 142 16.671 -8.028 5.887 1071 HB3 ASP 142 HB3 ASP 142 15.560 -7.269 7.032 1072 H ILE 143 H ILE 143 13.927 -5.299 6.637 1073 HA ILE 143 HA ILE 143 11.303 -6.350 6.450 1074 HB ILE 143 HB ILE 143 12.570 -3.888 7.684 1075 HG12 ILE 143 HG12 ILE 143 11.503 -6.474 8.937 1076 HG13 ILE 143 HG13 ILE 143 13.194 -6.222 8.529 1077 HG21 ILE 143 HG21 ILE 143 9.734 -4.912 8.047 1078 HG22 ILE 143 HG22 ILE 143 10.516 -3.630 9.008 1079 HG23 ILE 143 HG23 ILE 143 10.231 -3.376 7.289 1080 HD11 ILE 143 HD13 ILE 143 13.172 -4.197 10.069 1081 HD12 ILE 143 HD11 ILE 143 11.614 -4.829 10.690 1082 HD13 ILE 143 HD12 ILE 143 13.096 -5.794 10.793 1083 H ILE 144 H ILE 144 12.947 -3.602 4.887 1084 HA ILE 144 HA ILE 144 10.745 -2.521 3.438 1085 HB ILE 144 HB ILE 144 13.669 -2.875 2.716 1086 HG12 ILE 144 HG12 ILE 144 13.184 -1.298 4.556 1087 HG13 ILE 144 HG13 ILE 144 14.044 -0.629 3.172 1088 HG21 ILE 144 HG21 ILE 144 13.483 -1.381 0.863 1089 HG22 ILE 144 HG22 ILE 144 12.590 -2.832 0.567 1090 HG23 ILE 144 HG23 ILE 144 11.705 -1.361 1.004 1091 HD11 ILE 144 HD13 ILE 144 11.075 -0.282 3.699 1092 HD12 ILE 144 HD11 ILE 144 12.359 0.906 4.015 1093 HD13 ILE 144 HD12 ILE 144 12.015 0.434 2.355 1094 H SER 145 H SER 145 12.923 -5.231 2.649 1095 HA SER 145 HA SER 145 11.976 -5.533 0.029 1096 HB2 SER 145 HB2 SER 145 13.374 -7.589 1.805 1097 HB3 SER 145 HB3 SER 145 13.259 -7.649 0.039 1098 HG SER 145 HG SER 145 14.599 -5.700 1.639 1099 H ARG 146 H ARG 146 10.676 -6.909 3.028 1100 HA ARG 146 HA ARG 146 9.060 -8.922 1.800 1101 HB2 ARG 146 HB2 ARG 146 8.096 -7.557 4.294 1102 HB3 ARG 146 HB3 ARG 146 8.129 -9.275 3.886 1103 HG2 ARG 146 HG2 ARG 146 10.672 -9.135 4.228 1104 HG3 ARG 146 HG3 ARG 146 10.355 -7.473 4.809 1105 HD2 ARG 146 HD2 ARG 146 8.898 -8.340 6.577 1106 HD3 ARG 146 HD3 ARG 146 9.186 -10.003 6.023 1107 HE ARG 146 HE ARG 146 11.733 -8.999 6.496 1108 HH11 ARG 146 HH11 ARG 146 8.802 -9.442 8.510 1109 HH12 ARG 146 HH12 ARG 146 9.756 -9.608 9.968 1110 HH21 ARG 146 HH21 ARG 146 12.851 -9.261 8.369 1111 HH22 ARG 146 HH22 ARG 146 12.027 -9.508 9.920 1112 H GLY 147 H GLY 147 8.826 -5.482 2.065 1113 HA2 GLY 147 HA2 GLY 147 6.195 -4.955 2.513 1114 HA3 GLY 147 HA3 GLY 147 7.321 -3.922 1.619 Start of MODEL 21 1 H MET 1 H1 MET 1 2.007 -1.000 -0.749 2 HA MET 1 HA MET 1 2.360 -1.129 -3.670 3 HB2 MET 1 HB2 MET 1 2.129 1.261 -2.494 4 HB3 MET 1 HB3 MET 1 3.782 0.906 -1.938 5 HG2 MET 1 HG2 MET 1 3.632 2.268 -4.025 6 HG3 MET 1 HG3 MET 1 4.611 0.820 -4.170 7 HE1 MET 1 HE3 MET 1 4.656 1.116 -6.782 8 HE2 MET 1 HE1 MET 1 3.203 1.325 -7.783 9 HE3 MET 1 HE2 MET 1 3.668 2.586 -6.621 10 H ARG 2 H ARG 2 4.668 -1.336 -4.309 11 HA ARG 2 HA ARG 2 6.140 -3.169 -2.590 12 HB2 ARG 2 HB2 ARG 2 6.820 -1.635 -5.149 13 HB3 ARG 2 HB3 ARG 2 8.034 -2.531 -4.238 14 HG2 ARG 2 HG2 ARG 2 7.364 -3.955 -5.978 15 HG3 ARG 2 HG3 ARG 2 6.663 -4.617 -4.496 16 HD2 ARG 2 HD2 ARG 2 4.464 -3.704 -5.104 17 HD3 ARG 2 HD3 ARG 2 5.175 -2.903 -6.527 18 HE ARG 2 HE ARG 2 5.712 -5.714 -6.574 19 HH11 ARG 2 HH11 ARG 2 3.044 -3.433 -7.127 20 HH12 ARG 2 HH12 ARG 2 2.197 -4.469 -8.211 21 HH21 ARG 2 HH21 ARG 2 4.584 -7.092 -8.025 22 HH22 ARG 2 HH22 ARG 2 3.095 -6.594 -8.732 23 H LEU 3 H LEU 3 6.908 -2.408 -0.715 24 HA LEU 3 HA LEU 3 7.166 0.332 0.013 25 HB2 LEU 3 HB2 LEU 3 8.230 -2.281 1.091 26 HB3 LEU 3 HB3 LEU 3 8.971 -0.805 1.665 27 HG LEU 3 HG LEU 3 7.188 -1.703 3.137 28 HD11 LEU 3 HD11 LEU 3 6.662 1.105 2.077 29 HD12 LEU 3 HD12 LEU 3 6.235 0.444 3.669 30 HD13 LEU 3 HD13 LEU 3 7.927 0.637 3.240 31 HD21 LEU 3 HD23 LEU 3 4.843 -1.391 2.610 32 HD22 LEU 3 HD21 LEU 3 5.230 -0.747 1.010 33 HD23 LEU 3 HD22 LEU 3 5.572 -2.439 1.386 34 H SER 4 H SER 4 9.602 -2.009 -1.175 35 HA SER 4 HA SER 4 11.865 -0.520 -1.066 36 HB2 SER 4 HB2 SER 4 11.311 -2.313 -3.429 37 HB3 SER 4 HB3 SER 4 12.773 -2.196 -2.432 38 HG SER 4 HG SER 4 11.465 -4.096 -2.095 39 H ASP 5 H ASP 5 9.175 0.212 -3.241 40 HA ASP 5 HA ASP 5 10.745 1.440 -5.305 41 HB2 ASP 5 HB2 ASP 5 8.395 0.727 -5.634 42 HB3 ASP 5 HB3 ASP 5 7.868 1.931 -4.450 43 H TYR 6 H TYR 6 9.591 2.474 -2.135 44 HA TYR 6 HA TYR 6 9.992 5.308 -2.747 45 HB2 TYR 6 HB2 TYR 6 9.127 3.876 -0.206 46 HB3 TYR 6 HB3 TYR 6 9.253 5.619 -0.384 47 HD1 TYR 6 HD2 TYR 6 7.748 6.926 -1.752 48 HD2 TYR 6 HD1 TYR 6 7.174 2.656 -1.265 49 HE1 TYR 6 HE2 TYR 6 5.518 7.097 -2.810 50 HE2 TYR 6 HE1 TYR 6 4.934 2.862 -2.228 51 HH TYR 6 HH TYR 6 3.610 5.949 -3.497 52 H PHE 7 H PHE 7 11.821 2.765 -1.084 53 HA PHE 7 HA PHE 7 13.577 4.752 0.254 54 HB2 PHE 7 HB2 PHE 7 13.530 1.718 0.403 55 HB3 PHE 7 HB3 PHE 7 14.574 2.762 1.341 56 HD1 PHE 7 HD2 PHE 7 11.012 1.976 0.677 57 HD2 PHE 7 HD1 PHE 7 13.809 3.514 3.562 58 HE1 PHE 7 HE2 PHE 7 9.167 2.283 2.279 59 HE2 PHE 7 HE1 PHE 7 11.932 3.873 5.143 60 HZ PHE 7 HZ PHE 7 9.627 3.253 4.527 61 HA PRO 8 HA PRO 8 15.551 4.454 -3.775 62 HB2 PRO 8 HB2 PRO 8 17.640 6.299 -2.641 63 HB3 PRO 8 HB3 PRO 8 16.733 6.407 -4.176 64 HG2 PRO 8 HG2 PRO 8 16.031 7.952 -2.061 65 HG3 PRO 8 HG3 PRO 8 14.754 7.140 -3.030 66 HD2 PRO 8 HD2 PRO 8 16.002 6.204 -0.451 67 HD3 PRO 8 HD3 PRO 8 14.275 6.385 -0.841 68 H GLU 9 H GLU 9 18.104 4.675 -1.294 69 HA GLU 9 HA GLU 9 18.997 1.984 -1.504 70 HB2 GLU 9 HB2 GLU 9 19.870 2.719 -3.696 71 HB3 GLU 9 HB3 GLU 9 20.566 4.158 -2.956 72 HG2 GLU 9 HG2 GLU 9 22.219 2.799 -1.768 73 HG3 GLU 9 HG3 GLU 9 21.413 1.307 -2.266 74 H SER 10 H SER 10 20.660 5.107 -1.107 75 HA SER 10 HA SER 10 21.876 4.440 1.354 76 HB2 SER 10 HB2 SER 10 21.267 7.279 0.473 77 HB3 SER 10 HB3 SER 10 22.730 6.663 1.255 78 HG SER 10 HG SER 10 23.272 5.644 -0.704 79 H SER 11 H SER 11 18.731 4.452 1.087 80 HA SER 11 HA SER 11 17.675 6.558 2.745 81 HB2 SER 11 HB2 SER 11 15.836 4.476 2.703 82 HB3 SER 11 HB3 SER 11 15.961 5.796 1.553 83 HG SER 11 HG SER 11 16.773 3.121 1.260 84 H ILE 12 H ILE 12 19.076 3.401 3.301 85 HA ILE 12 HA ILE 12 17.770 2.995 5.863 86 HB ILE 12 HB ILE 12 19.896 1.396 4.364 87 HG12 ILE 12 HG12 ILE 12 18.181 1.707 2.675 88 HG13 ILE 12 HG13 ILE 12 18.297 0.061 3.199 89 HG21 ILE 12 HG21 ILE 12 19.389 0.719 6.678 90 HG22 ILE 12 HG22 ILE 12 17.666 0.616 6.287 91 HG23 ILE 12 HG23 ILE 12 18.822 -0.515 5.539 92 HD11 ILE 12 HD13 ILE 12 16.235 0.250 4.504 93 HD12 ILE 12 HD11 ILE 12 16.128 1.993 4.101 94 HD13 ILE 12 HD12 ILE 12 15.974 0.761 2.833 95 H SER 13 H SER 13 18.893 3.410 7.848 96 HA SER 13 HA SER 13 21.795 3.158 7.892 97 HB2 SER 13 HB2 SER 13 20.428 5.829 8.512 98 HB3 SER 13 HB3 SER 13 22.086 5.436 8.996 99 HG SER 13 HG SER 13 21.518 4.971 6.344 100 H VAL 14 H VAL 14 22.635 2.865 9.963 101 HA VAL 14 HA VAL 14 20.748 2.931 12.260 102 HB VAL 14 HB VAL 14 23.010 0.986 11.704 103 HG11 VAL 14 HG11 VAL 14 22.870 1.435 14.119 104 HG12 VAL 14 HG12 VAL 14 21.112 1.165 14.096 105 HG13 VAL 14 HG13 VAL 14 22.238 -0.176 13.790 106 HG21 VAL 14 HG23 VAL 14 21.006 0.359 10.405 107 HG22 VAL 14 HG21 VAL 14 21.228 -0.772 11.738 108 HG23 VAL 14 HG22 VAL 14 20.002 0.500 11.864 109 H ILE 15 H ILE 15 21.636 3.899 14.062 110 HA ILE 15 HA ILE 15 24.281 5.245 13.883 111 HB ILE 15 HB ILE 15 21.457 6.357 14.091 112 HG12 ILE 15 HG12 ILE 15 23.832 6.806 12.271 113 HG13 ILE 15 HG13 ILE 15 22.196 6.281 11.866 114 HG21 ILE 15 HG21 ILE 15 22.315 8.552 14.764 115 HG22 ILE 15 HG22 ILE 15 22.530 7.325 15.958 116 HG23 ILE 15 HG23 ILE 15 23.940 7.846 14.975 117 HD11 ILE 15 HD13 ILE 15 23.081 9.077 12.721 118 HD12 ILE 15 HD11 ILE 15 22.492 8.564 11.127 119 HD13 ILE 15 HD12 ILE 15 21.381 8.598 12.516 120 H HIS 16 H HIS 16 25.174 5.633 16.013 121 HA HIS 16 HA HIS 16 24.000 4.018 18.137 122 HB2 HIS 16 HB2 HIS 16 26.477 4.417 17.852 123 HB3 HIS 16 HB3 HIS 16 26.220 6.082 18.391 124 HD1 HIS 16 HD1 HIS 16 25.393 2.504 19.718 125 HD2 HIS 16 HD2 HIS 16 26.397 6.396 21.006 126 HE1 HIS 16 HE1 HIS 16 25.660 2.382 22.255 127 H SER 17 H SER 17 24.248 7.554 17.393 128 HA SER 17 HA SER 17 21.870 8.166 18.883 129 HB2 SER 17 HB2 SER 17 23.189 9.872 20.331 130 HB3 SER 17 HB3 SER 17 23.142 8.190 20.863 131 HG SER 17 HG SER 17 25.244 9.123 20.979 132 H ALA 18 H ALA 18 21.189 10.322 18.290 133 HA ALA 18 HA ALA 18 22.611 11.475 15.967 134 HB1 ALA 18 HB3 ALA 18 20.197 11.474 15.795 135 HB2 ALA 18 HB1 ALA 18 20.031 12.270 17.389 136 HB3 ALA 18 HB2 ALA 18 20.737 13.135 16.012 137 H LYS 19 H LYS 19 23.289 13.698 16.050 138 HA LYS 19 HA LYS 19 24.837 14.467 18.286 139 HB2 LYS 19 HB2 LYS 19 24.712 15.205 15.707 140 HB3 LYS 19 HB3 LYS 19 23.671 16.459 16.334 141 HG2 LYS 19 HG2 LYS 19 25.785 17.439 16.214 142 HG3 LYS 19 HG3 LYS 19 25.525 17.131 17.929 143 HD2 LYS 19 HD2 LYS 19 27.832 16.617 17.225 144 HD3 LYS 19 HD3 LYS 19 27.013 15.178 17.819 145 HE2 LYS 19 HE2 LYS 19 28.331 14.669 15.827 146 HE3 LYS 19 HE3 LYS 19 26.605 14.401 15.540 147 HZ1 LYS 19 HZ3 LYS 19 26.482 16.317 14.202 148 HZ2 LYS 19 HZ1 LYS 19 27.975 16.869 14.670 149 HZ3 LYS 19 HZ2 LYS 19 27.832 15.549 13.725 150 H ASP 20 H ASP 20 21.593 15.421 17.223 151 HA ASP 20 HA ASP 20 20.457 15.770 19.807 152 HB2 ASP 20 HB2 ASP 20 19.996 17.987 19.912 153 HB3 ASP 20 HB3 ASP 20 21.711 18.034 19.490 154 H TRP 21 H TRP 21 18.231 16.792 19.390 155 HA TRP 21 HA TRP 21 16.795 15.223 17.618 156 HB2 TRP 21 HB2 TRP 21 15.069 17.222 18.247 157 HB3 TRP 21 HB3 TRP 21 15.475 15.879 19.307 158 HD1 TRP 21 HD1 TRP 21 16.330 19.538 18.749 159 HE1 TRP 21 HE1 TRP 21 17.237 20.609 20.882 160 HE3 TRP 21 HE3 TRP 21 16.872 15.317 21.504 161 HZ2 TRP 21 HZ2 TRP 21 18.230 19.687 23.459 162 HZ3 TRP 21 HZ3 TRP 21 17.934 15.399 23.750 163 HH2 TRP 21 HH2 TRP 21 18.600 17.580 24.740 164 H GLN 22 H GLN 22 18.128 18.541 17.030 165 HA GLN 22 HA GLN 22 16.717 18.994 14.525 166 HB2 GLN 22 HB2 GLN 22 19.402 20.004 15.486 167 HB3 GLN 22 HB3 GLN 22 18.569 20.537 14.040 168 HG2 GLN 22 HG2 GLN 22 16.769 21.513 15.254 169 HG3 GLN 22 HG3 GLN 22 17.218 20.712 16.759 170 HE21 GLN 22 HE22 GLN 22 19.431 21.213 17.632 171 HE22 GLN 22 HE21 GLN 22 19.963 22.898 17.552 172 H GLU 23 H GLU 23 19.999 17.619 15.351 173 HA GLU 23 HA GLU 23 20.681 16.864 12.725 174 HB2 GLU 23 HB2 GLU 23 22.107 16.889 14.890 175 HB3 GLU 23 HB3 GLU 23 21.418 15.285 15.203 176 HG2 GLU 23 HG2 GLU 23 23.308 14.629 14.113 177 HG3 GLU 23 HG3 GLU 23 22.296 14.800 12.711 178 H ALA 24 H ALA 24 18.736 15.147 15.153 179 HA ALA 24 HA ALA 24 18.661 12.639 13.827 180 HB1 ALA 24 HB3 ALA 24 16.855 12.133 15.348 181 HB2 ALA 24 HB1 ALA 24 18.069 13.138 16.181 182 HB3 ALA 24 HB2 ALA 24 16.542 13.860 15.637 183 H ILE 25 H ILE 25 16.744 15.612 13.326 184 HA ILE 25 HA ILE 25 14.889 14.401 11.450 185 HB ILE 25 HB ILE 25 15.781 17.297 11.590 186 HG12 ILE 25 HG12 ILE 25 14.382 15.887 13.641 187 HG13 ILE 25 HG13 ILE 25 14.805 17.585 13.538 188 HG21 ILE 25 HG21 ILE 25 14.618 16.598 9.513 189 HG22 ILE 25 HG22 ILE 25 13.230 16.075 10.467 190 HG23 ILE 25 HG23 ILE 25 13.734 17.790 10.425 191 HD11 ILE 25 HD13 ILE 25 12.623 18.000 12.383 192 HD12 ILE 25 HD11 ILE 25 12.229 16.278 12.627 193 HD13 ILE 25 HD12 ILE 25 12.467 17.342 14.021 194 H ASP 26 H ASP 26 18.022 16.201 11.183 195 HA ASP 26 HA ASP 26 18.214 16.074 8.359 196 HB2 ASP 26 HB2 ASP 26 19.718 17.466 9.666 197 HB3 ASP 26 HB3 ASP 26 20.459 16.046 10.402 198 H PHE 27 H PHE 27 19.285 13.673 10.829 199 HA PHE 27 HA PHE 27 20.106 11.759 8.861 200 HB2 PHE 27 HB2 PHE 27 19.566 11.631 11.841 201 HB3 PHE 27 HB3 PHE 27 19.928 10.187 10.912 202 HD1 PHE 27 HD1 PHE 27 21.990 10.602 9.126 203 HD2 PHE 27 HD2 PHE 27 21.562 12.446 13.031 204 HE1 PHE 27 HE1 PHE 27 24.440 10.876 9.279 205 HE2 PHE 27 HE2 PHE 27 24.012 12.635 13.178 206 HZ PHE 27 HZ PHE 27 25.460 11.882 11.313 207 H SER 28 H SER 28 16.897 12.653 9.878 208 HA SER 28 HA SER 28 15.679 10.149 8.923 209 HB2 SER 28 HB2 SER 28 14.329 12.860 9.442 210 HB3 SER 28 HB3 SER 28 13.536 11.324 9.223 211 HG SER 28 HG SER 28 15.407 11.916 11.307 212 H MET 29 H MET 29 16.901 13.152 7.518 213 HA MET 29 HA MET 29 15.352 12.627 5.016 214 HB2 MET 29 HB2 MET 29 16.523 15.187 6.091 215 HB3 MET 29 HB3 MET 29 15.380 14.983 4.752 216 HG2 MET 29 HG2 MET 29 14.469 14.256 7.510 217 HG3 MET 29 HG3 MET 29 14.628 15.939 7.048 218 HE1 MET 29 HE3 MET 29 12.667 12.882 7.054 219 HE2 MET 29 HE1 MET 29 11.544 12.954 5.671 220 HE3 MET 29 HE2 MET 29 13.283 12.609 5.397 221 H VAL 30 H VAL 30 18.710 13.007 6.126 222 HA VAL 30 HA VAL 30 19.681 14.366 3.954 223 HB VAL 30 HB VAL 30 20.953 13.985 5.991 224 HG11 VAL 30 HG11 VAL 30 22.176 11.920 6.445 225 HG12 VAL 30 HG12 VAL 30 20.443 11.575 6.390 226 HG13 VAL 30 HG13 VAL 30 21.479 11.141 5.011 227 HG21 VAL 30 HG23 VAL 30 22.480 12.977 3.553 228 HG22 VAL 30 HG21 VAL 30 22.112 14.672 3.907 229 HG23 VAL 30 HG22 VAL 30 23.164 13.752 5.000 230 H SER 31 H SER 31 19.144 10.803 4.088 231 HA SER 31 HA SER 31 20.465 10.161 1.724 232 HB2 SER 31 HB2 SER 31 17.857 8.945 2.733 233 HB3 SER 31 HB3 SER 31 19.145 8.143 1.815 234 HG SER 31 HG SER 31 19.965 7.672 3.667 235 H LEU 32 H LEU 32 17.423 11.813 2.191 236 HA LEU 32 HA LEU 32 16.518 11.479 -0.598 237 HB2 LEU 32 HB2 LEU 32 15.366 12.887 1.863 238 HB3 LEU 32 HB3 LEU 32 14.583 12.914 0.314 239 HG LEU 32 HG LEU 32 15.240 10.346 1.819 240 HD11 LEU 32 HD11 LEU 32 13.677 11.641 3.128 241 HD12 LEU 32 HD12 LEU 32 12.657 11.943 1.719 242 HD13 LEU 32 HD13 LEU 32 12.819 10.296 2.372 243 HD21 LEU 32 HD23 LEU 32 13.461 10.837 -0.604 244 HD22 LEU 32 HD21 LEU 32 15.011 9.973 -0.598 245 HD23 LEU 32 HD22 LEU 32 13.653 9.304 0.272 246 H LEU 33 H LEU 33 17.727 13.996 1.673 247 HA LEU 33 HA LEU 33 17.678 16.187 -0.035 248 HB2 LEU 33 HB2 LEU 33 18.221 16.201 2.394 249 HB3 LEU 33 HB3 LEU 33 19.780 15.467 2.034 250 HG LEU 33 HG LEU 33 20.459 17.479 0.749 251 HD11 LEU 33 HD11 LEU 33 18.291 18.284 -0.043 252 HD12 LEU 33 HD12 LEU 33 17.783 18.633 1.622 253 HD13 LEU 33 HD13 LEU 33 19.118 19.530 0.866 254 HD21 LEU 33 HD23 LEU 33 19.505 18.086 3.560 255 HD22 LEU 33 HD21 LEU 33 20.979 17.201 3.134 256 HD23 LEU 33 HD22 LEU 33 20.818 18.890 2.666 257 H ASP 34 H ASP 34 20.150 13.668 0.385 258 HA ASP 34 HA ASP 34 22.214 14.686 -1.157 259 HB2 ASP 34 HB2 ASP 34 22.447 12.754 0.403 260 HB3 ASP 34 HB3 ASP 34 21.310 11.813 -0.574 261 H LYS 35 H LYS 35 19.393 13.033 -2.231 262 HA LYS 35 HA LYS 35 20.498 12.913 -5.025 263 HB2 LYS 35 HB2 LYS 35 18.241 11.283 -4.001 264 HB3 LYS 35 HB3 LYS 35 19.163 11.126 -5.505 265 HG2 LYS 35 HG2 LYS 35 21.242 10.895 -3.916 266 HG3 LYS 35 HG3 LYS 35 20.038 10.620 -2.634 267 HD2 LYS 35 HD2 LYS 35 19.093 8.873 -4.347 268 HD3 LYS 35 HD3 LYS 35 20.722 9.013 -5.053 269 HE2 LYS 35 HE2 LYS 35 20.042 8.433 -2.125 270 HE3 LYS 35 HE3 LYS 35 20.431 7.152 -3.289 271 HZ1 LYS 35 HZ3 LYS 35 22.641 8.131 -3.541 272 HZ2 LYS 35 HZ1 LYS 35 22.317 9.304 -2.436 273 HZ3 LYS 35 HZ2 LYS 35 22.365 7.719 -1.986 274 H ASN 36 H ASN 36 19.245 15.160 -3.387 275 HA ASN 36 HA ASN 36 17.646 16.706 -3.409 276 HB2 ASN 36 HB2 ASN 36 17.493 18.048 -5.294 277 HB3 ASN 36 HB3 ASN 36 19.124 17.425 -5.159 278 HD21 ASN 36 HD22 ASN 36 16.034 16.810 -6.776 279 HD22 ASN 36 HD21 ASN 36 16.718 16.451 -8.373 280 H TYR 37 H TYR 37 16.404 14.218 -3.027 281 HA TYR 37 HA TYR 37 13.824 14.237 -4.400 282 HB2 TYR 37 HB2 TYR 37 14.830 13.121 -1.762 283 HB3 TYR 37 HB3 TYR 37 13.138 13.063 -2.173 284 HD1 TYR 37 HD1 TYR 37 16.487 11.614 -2.940 285 HD2 TYR 37 HD2 TYR 37 12.233 11.429 -3.612 286 HE1 TYR 37 HE1 TYR 37 16.785 9.555 -4.289 287 HE2 TYR 37 HE2 TYR 37 12.543 9.391 -5.003 288 HH TYR 37 HH TYR 37 14.063 7.895 -5.925 289 H ILE 38 H ILE 38 15.347 16.197 -1.993 290 HA ILE 38 HA ILE 38 12.956 17.830 -1.580 291 HB ILE 38 HB ILE 38 13.414 17.863 0.868 292 HG12 ILE 38 HG12 ILE 38 15.316 15.550 0.284 293 HG13 ILE 38 HG13 ILE 38 15.790 17.177 0.782 294 HG21 ILE 38 HG21 ILE 38 12.803 15.035 -0.079 295 HG22 ILE 38 HG22 ILE 38 12.335 15.751 1.466 296 HG23 ILE 38 HG23 ILE 38 11.631 16.369 -0.011 297 HD11 ILE 38 HD13 ILE 38 15.998 15.690 2.598 298 HD12 ILE 38 HD11 ILE 38 14.684 16.837 2.954 299 HD13 ILE 38 HD12 ILE 38 14.314 15.154 2.480 300 H SER 39 H SER 39 13.685 19.960 -0.565 301 HA SER 39 HA SER 39 16.512 20.646 -1.203 302 HB2 SER 39 HB2 SER 39 15.702 22.977 -0.983 303 HB3 SER 39 HB3 SER 39 14.823 22.074 -2.226 304 HG SER 39 HG SER 39 13.420 23.273 -0.901 305 H GLU 40 H GLU 40 17.570 22.119 0.504 306 HA GLU 40 HA GLU 40 17.651 20.821 3.021 307 HB2 GLU 40 HB2 GLU 40 18.578 23.609 2.224 308 HB3 GLU 40 HB3 GLU 40 19.002 22.786 3.731 309 HG2 GLU 40 HG2 GLU 40 20.068 20.947 2.415 310 HG3 GLU 40 HG3 GLU 40 19.705 21.806 0.926 311 H ASN 41 H ASN 41 15.666 23.543 1.925 312 HA ASN 41 HA ASN 41 14.792 24.500 4.460 313 HB2 ASN 41 HB2 ASN 41 14.361 25.658 2.290 314 HB3 ASN 41 HB3 ASN 41 13.245 24.366 1.826 315 HD21 ASN 41 HD22 ASN 41 11.099 24.322 2.797 316 HD22 ASN 41 HD21 ASN 41 10.556 25.633 3.817 317 H TYR 42 H TYR 42 13.808 21.638 2.576 318 HA TYR 42 HA TYR 42 11.322 21.144 3.838 319 HB2 TYR 42 HB2 TYR 42 12.296 20.070 1.752 320 HB3 TYR 42 HB3 TYR 42 13.329 19.109 2.803 321 HD1 TYR 42 HD2 TYR 42 9.805 19.838 1.899 322 HD2 TYR 42 HD1 TYR 42 12.484 17.130 3.908 323 HE1 TYR 42 HE2 TYR 42 8.010 18.130 1.979 324 HE2 TYR 42 HE1 TYR 42 10.690 15.415 3.998 325 HH TYR 42 HH TYR 42 7.380 16.089 2.831 326 H ILE 43 H ILE 43 14.658 20.063 4.665 327 HA ILE 43 HA ILE 43 13.943 18.542 6.968 328 HB ILE 43 HB ILE 43 16.543 20.024 6.314 329 HG12 ILE 43 HG12 ILE 43 17.105 17.370 5.983 330 HG13 ILE 43 HG13 ILE 43 15.409 17.376 5.480 331 HG21 ILE 43 HG21 ILE 43 16.089 17.725 8.267 332 HG22 ILE 43 HG22 ILE 43 17.622 18.551 7.921 333 HG23 ILE 43 HG23 ILE 43 16.317 19.420 8.737 334 HD11 ILE 43 HD13 ILE 43 15.938 19.052 3.766 335 HD12 ILE 43 HD11 ILE 43 17.617 19.128 4.362 336 HD13 ILE 43 HD12 ILE 43 16.999 17.639 3.625 337 H GLN 44 H GLN 44 14.931 22.016 6.603 338 HA GLN 44 HA GLN 44 14.774 22.396 9.413 339 HB2 GLN 44 HB2 GLN 44 16.103 23.769 7.661 340 HB3 GLN 44 HB3 GLN 44 14.616 24.685 7.442 341 HG2 GLN 44 HG2 GLN 44 16.080 25.800 9.078 342 HG3 GLN 44 HG3 GLN 44 14.628 25.241 9.892 343 HE21 GLN 44 HE22 GLN 44 15.110 24.360 11.938 344 HE22 GLN 44 HE21 GLN 44 16.504 23.372 12.292 345 H ALA 45 H ALA 45 12.257 22.653 6.947 346 HA ALA 45 HA ALA 45 10.310 24.019 8.470 347 HB1 ALA 45 HB3 ALA 45 9.853 21.678 6.549 348 HB2 ALA 45 HB1 ALA 45 8.657 22.867 7.065 349 HB3 ALA 45 HB2 ALA 45 10.032 23.385 6.065 350 H ILE 46 H ILE 46 11.249 20.533 8.463 351 HA ILE 46 HA ILE 46 9.151 19.738 10.271 352 HB ILE 46 HB ILE 46 11.822 18.399 9.737 353 HG12 ILE 46 HG12 ILE 46 9.282 17.694 8.271 354 HG13 ILE 46 HG13 ILE 46 10.422 18.841 7.616 355 HG21 ILE 46 HG21 ILE 46 10.692 16.352 10.448 356 HG22 ILE 46 HG22 ILE 46 10.484 17.576 11.709 357 HG23 ILE 46 HG23 ILE 46 9.145 17.211 10.610 358 HD11 ILE 46 HD13 ILE 46 12.240 17.154 7.703 359 HD12 ILE 46 HD11 ILE 46 11.067 15.924 8.200 360 HD13 ILE 46 HD12 ILE 46 10.905 16.726 6.628 361 H LYS 47 H LYS 47 12.674 20.544 10.614 362 HA LYS 47 HA LYS 47 12.823 20.001 13.376 363 HB2 LYS 47 HB2 LYS 47 14.260 22.045 11.639 364 HB3 LYS 47 HB3 LYS 47 14.728 21.741 13.311 365 HG2 LYS 47 HG2 LYS 47 15.507 19.537 12.800 366 HG3 LYS 47 HG3 LYS 47 14.811 19.586 11.165 367 HD2 LYS 47 HD2 LYS 47 16.285 21.332 10.493 368 HD3 LYS 47 HD3 LYS 47 16.916 21.540 12.143 369 HE2 LYS 47 HE2 LYS 47 18.090 19.461 12.037 370 HE3 LYS 47 HE3 LYS 47 17.369 19.038 10.488 371 HZ1 LYS 47 HZ3 LYS 47 19.196 21.343 10.979 372 HZ2 LYS 47 HZ1 LYS 47 19.614 19.961 10.229 373 HZ3 LYS 47 HZ2 LYS 47 18.548 20.982 9.532 374 H ASP 48 H ASP 48 12.057 23.098 11.683 375 HA ASP 48 HA ASP 48 11.839 24.709 13.989 376 HB2 ASP 48 HB2 ASP 48 12.061 25.632 11.745 377 HB3 ASP 48 HB3 ASP 48 10.513 24.929 11.260 378 H SER 49 H SER 49 9.329 22.855 12.200 379 HA SER 49 HA SER 49 7.095 23.570 13.828 380 HB2 SER 49 HB2 SER 49 7.635 20.963 12.335 381 HB3 SER 49 HB3 SER 49 6.063 21.596 12.845 382 HG SER 49 HG SER 49 7.813 22.564 10.852 383 H THR 50 H THR 50 9.374 20.779 14.064 384 HA THR 50 HA THR 50 8.300 19.623 16.362 385 HB THR 50 HB THR 50 11.173 19.635 15.368 386 HG1 THR 50 HG1 THR 50 9.876 18.894 13.784 387 HG21 THR 50 HG23 THR 50 9.714 17.678 17.191 388 HG22 THR 50 HG21 THR 50 11.296 17.396 16.435 389 HG23 THR 50 HG22 THR 50 11.102 18.700 17.617 390 H ILE 51 H ILE 51 10.824 22.206 16.142 391 HA ILE 51 HA ILE 51 11.230 22.381 18.973 392 HB ILE 51 HB ILE 51 11.721 24.271 16.642 393 HG12 ILE 51 HG12 ILE 51 13.716 22.760 18.398 394 HG13 ILE 51 HG13 ILE 51 13.037 22.057 16.942 395 HG21 ILE 51 HG21 ILE 51 13.147 25.641 18.152 396 HG22 ILE 51 HG22 ILE 51 11.461 25.703 18.628 397 HG23 ILE 51 HG23 ILE 51 12.594 24.680 19.539 398 HD11 ILE 51 HD13 ILE 51 13.949 23.946 15.590 399 HD12 ILE 51 HD11 ILE 51 14.763 24.557 17.052 400 HD13 ILE 51 HD12 ILE 51 15.185 22.968 16.403 401 H ASN 52 H ASN 52 8.935 24.016 16.748 402 HA ASN 52 HA ASN 52 8.061 25.966 18.654 403 HB2 ASN 52 HB2 ASN 52 7.099 24.983 15.960 404 HB3 ASN 52 HB3 ASN 52 5.952 25.852 16.939 405 HD21 ASN 52 HD22 ASN 52 9.153 26.141 15.408 406 HD22 ASN 52 HD21 ASN 52 9.191 27.890 15.394 407 H ASN 53 H ASN 53 6.731 22.767 17.753 408 HA ASN 53 HA ASN 53 4.644 23.097 19.890 409 HB2 ASN 53 HB2 ASN 53 4.073 23.752 17.447 410 HB3 ASN 53 HB3 ASN 53 4.237 22.035 17.084 411 HD21 ASN 53 HD22 ASN 53 2.053 22.609 16.290 412 HD22 ASN 53 HD21 ASN 53 0.689 22.431 17.386 413 H GLY 54 H GLY 54 7.196 21.231 19.167 414 HA2 GLY 54 HA2 GLY 54 7.764 19.099 19.866 415 HA3 GLY 54 HA3 GLY 54 6.077 18.727 20.252 416 HA PRO 55 HA PRO 55 7.578 17.059 16.044 417 HB2 PRO 55 HB2 PRO 55 7.295 14.337 16.534 418 HB3 PRO 55 HB3 PRO 55 8.788 15.272 16.845 419 HG2 PRO 55 HG2 PRO 55 6.601 14.533 18.791 420 HG3 PRO 55 HG3 PRO 55 8.376 14.396 18.998 421 HD2 PRO 55 HD2 PRO 55 6.954 16.488 20.025 422 HD3 PRO 55 HD3 PRO 55 8.587 16.752 19.347 423 H TYR 56 H TYR 56 6.271 16.178 14.389 424 HA TYR 56 HA TYR 56 3.337 16.330 14.989 425 HB2 TYR 56 HB2 TYR 56 5.030 17.106 12.598 426 HB3 TYR 56 HB3 TYR 56 3.318 16.803 12.422 427 HD1 TYR 56 HD2 TYR 56 5.711 18.898 14.422 428 HD2 TYR 56 HD1 TYR 56 1.735 18.484 12.801 429 HE1 TYR 56 HE2 TYR 56 5.200 21.219 15.081 430 HE2 TYR 56 HE1 TYR 56 1.236 20.836 13.411 431 HH TYR 56 HH TYR 56 3.726 23.017 14.811 432 H TYR 57 H TYR 57 5.709 14.038 14.233 433 HA TYR 57 HA TYR 57 3.783 12.236 12.860 434 HB2 TYR 57 HB2 TYR 57 6.576 12.987 11.979 435 HB3 TYR 57 HB3 TYR 57 5.716 11.543 11.451 436 HD1 TYR 57 HD2 TYR 57 3.755 11.622 10.032 437 HD2 TYR 57 HD1 TYR 57 5.836 15.230 11.160 438 HE1 TYR 57 HE2 TYR 57 2.437 12.899 8.362 439 HE2 TYR 57 HE1 TYR 57 4.585 16.498 9.447 440 HH TYR 57 HH TYR 57 2.929 16.416 7.805 441 H ILE 58 H ILE 58 3.554 11.356 15.018 442 HA ILE 58 HA ILE 58 5.760 9.510 15.769 443 HB ILE 58 HB ILE 58 3.831 10.855 17.698 444 HG12 ILE 58 HG12 ILE 58 5.435 12.543 17.110 445 HG13 ILE 58 HG13 ILE 58 5.762 11.950 18.725 446 HG21 ILE 58 HG21 ILE 58 6.094 8.861 18.175 447 HG22 ILE 58 HG22 ILE 58 5.232 9.748 19.453 448 HG23 ILE 58 HG23 ILE 58 4.366 8.604 18.431 449 HD11 ILE 58 HD13 ILE 58 7.894 12.169 17.787 450 HD12 ILE 58 HD11 ILE 58 7.576 10.441 17.576 451 HD13 ILE 58 HD12 ILE 58 7.386 11.553 16.215 452 H LEU 59 H LEU 59 5.020 7.409 15.875 453 HA LEU 59 HA LEU 59 2.149 7.008 15.112 454 HB2 LEU 59 HB2 LEU 59 4.616 5.443 14.242 455 HB3 LEU 59 HB3 LEU 59 2.959 5.060 13.836 456 HG LEU 59 HG LEU 59 3.831 6.012 11.933 457 HD11 LEU 59 HD11 LEU 59 1.586 6.873 12.514 458 HD12 LEU 59 HD12 LEU 59 2.341 8.337 13.182 459 HD13 LEU 59 HD13 LEU 59 2.507 7.955 11.462 460 HD21 LEU 59 HD23 LEU 59 5.872 7.059 12.864 461 HD22 LEU 59 HD21 LEU 59 5.013 8.088 11.719 462 HD23 LEU 59 HD22 LEU 59 4.901 8.441 13.424 463 H ALA 60 H ALA 60 4.815 5.885 17.144 464 HA ALA 60 HA ALA 60 3.064 4.325 18.819 465 HB1 ALA 60 HB3 ALA 60 5.201 2.918 17.130 466 HB2 ALA 60 HB1 ALA 60 4.286 2.164 18.442 467 HB3 ALA 60 HB2 ALA 60 3.448 2.679 16.974 468 HA PRO 61 HA PRO 61 6.326 5.293 21.758 469 HB2 PRO 61 HB2 PRO 61 6.482 2.286 22.211 470 HB3 PRO 61 HB3 PRO 61 6.532 3.594 23.427 471 HG2 PRO 61 HG2 PRO 61 4.227 2.271 22.993 472 HG3 PRO 61 HG3 PRO 61 4.193 4.063 23.110 473 HD2 PRO 61 HD2 PRO 61 4.154 2.334 20.636 474 HD3 PRO 61 HD3 PRO 61 3.192 3.798 21.004 475 H GLY 62 H GLY 62 8.215 5.977 20.924 476 HA2 GLY 62 HA2 GLY 62 10.446 5.790 20.424 477 HA3 GLY 62 HA3 GLY 62 10.283 4.052 20.208 478 H VAL 63 H VAL 63 7.875 5.503 18.263 479 HA VAL 63 HA VAL 63 9.647 5.273 15.867 480 HB VAL 63 HB VAL 63 6.800 4.281 16.269 481 HG11 VAL 63 HG11 VAL 63 7.150 4.990 13.928 482 HG12 VAL 63 HG12 VAL 63 8.609 3.995 13.828 483 HG13 VAL 63 HG13 VAL 63 7.006 3.242 14.015 484 HG21 VAL 63 HG23 VAL 63 8.374 2.831 17.445 485 HG22 VAL 63 HG21 VAL 63 7.820 2.020 15.993 486 HG23 VAL 63 HG22 VAL 63 9.434 2.759 16.023 487 H ALA 64 H ALA 64 9.702 7.025 14.675 488 HA ALA 64 HA ALA 64 7.384 8.878 14.591 489 HB1 ALA 64 HB3 ALA 64 9.278 9.849 15.908 490 HB2 ALA 64 HB1 ALA 64 10.330 9.649 14.482 491 HB3 ALA 64 HB2 ALA 64 8.952 10.763 14.430 492 H MET 65 H MET 65 7.525 10.258 12.588 493 HA MET 65 HA MET 65 8.925 8.982 10.354 494 HB2 MET 65 HB2 MET 65 6.730 7.973 10.381 495 HB3 MET 65 HB3 MET 65 5.989 9.583 10.354 496 HG2 MET 65 HG2 MET 65 7.549 9.636 8.074 497 HG3 MET 65 HG3 MET 65 7.120 7.931 8.173 498 HE1 MET 65 HE3 MET 65 4.083 8.581 9.779 499 HE2 MET 65 HE1 MET 65 3.182 8.170 8.305 500 HE3 MET 65 HE2 MET 65 4.632 7.242 8.751 501 HA PRO 66 HA PRO 66 8.842 13.653 10.832 502 HB2 PRO 66 HB2 PRO 66 11.794 13.484 10.236 503 HB3 PRO 66 HB3 PRO 66 10.950 14.426 11.502 504 HG2 PRO 66 HG2 PRO 66 12.335 12.193 12.133 505 HG3 PRO 66 HG3 PRO 66 10.777 12.571 12.930 506 HD2 PRO 66 HD2 PRO 66 11.266 10.698 10.592 507 HD3 PRO 66 HD3 PRO 66 10.343 10.409 12.091 508 H HIS 67 H HIS 67 8.253 14.709 9.090 509 HA HIS 67 HA HIS 67 9.566 15.003 6.661 510 HB2 HIS 67 HB2 HIS 67 8.565 13.861 5.107 511 HB3 HIS 67 HB3 HIS 67 8.453 12.624 6.354 512 HD1 HIS 67 HD1 HIS 67 5.766 12.854 7.602 513 HD2 HIS 67 HD2 HIS 67 6.568 13.875 3.572 514 HE1 HIS 67 HE1 HIS 67 3.561 12.658 6.341 515 H ALA 68 H ALA 68 7.880 16.275 5.070 516 HA ALA 68 HA ALA 68 6.203 18.093 6.742 517 HB1 ALA 68 HB3 ALA 68 7.245 20.015 5.606 518 HB2 ALA 68 HB1 ALA 68 8.385 19.139 6.617 519 HB3 ALA 68 HB2 ALA 68 8.432 18.931 4.854 520 H ARG 69 H ARG 69 5.001 19.649 5.189 521 HA ARG 69 HA ARG 69 3.434 18.185 3.270 522 HB2 ARG 69 HB2 ARG 69 3.749 21.085 4.100 523 HB3 ARG 69 HB3 ARG 69 3.011 20.776 2.545 524 HG2 ARG 69 HG2 ARG 69 1.269 20.999 4.175 525 HG3 ARG 69 HG3 ARG 69 1.299 19.325 3.598 526 HD2 ARG 69 HD2 ARG 69 2.525 18.646 5.638 527 HD3 ARG 69 HD3 ARG 69 2.531 20.336 6.192 528 HE ARG 69 HE ARG 69 -0.135 19.377 5.624 529 HH11 ARG 69 HH11 ARG 69 2.388 19.321 8.124 530 HH12 ARG 69 HH12 ARG 69 1.301 18.966 9.413 531 HH21 ARG 69 HH21 ARG 69 -1.586 18.926 7.347 532 HH22 ARG 69 HH22 ARG 69 -1.010 18.748 8.958 533 HA PRO 70 HA PRO 70 5.981 18.081 -0.247 534 HB2 PRO 70 HB2 PRO 70 4.361 18.872 -2.378 535 HB3 PRO 70 HB3 PRO 70 4.303 17.277 -1.603 536 HG2 PRO 70 HG2 PRO 70 2.478 19.615 -1.156 537 HG3 PRO 70 HG3 PRO 70 2.073 17.875 -1.247 538 HD2 PRO 70 HD2 PRO 70 2.304 19.236 1.116 539 HD3 PRO 70 HD3 PRO 70 2.723 17.517 0.984 540 H GLU 71 H GLU 71 3.986 21.027 0.149 541 HA GLU 71 HA GLU 71 5.425 22.765 -1.579 542 HB2 GLU 71 HB2 GLU 71 3.648 23.399 0.821 543 HB3 GLU 71 HB3 GLU 71 4.136 24.540 -0.438 544 HG2 GLU 71 HG2 GLU 71 2.993 23.073 -2.140 545 HG3 GLU 71 HG3 GLU 71 2.392 22.071 -0.814 546 H CYS 72 H CYS 72 6.415 21.484 1.459 547 HA CYS 72 HA CYS 72 7.847 23.887 2.355 548 HB2 CYS 72 HB2 CYS 72 7.848 21.015 3.385 549 HB3 CYS 72 HB3 CYS 72 8.690 22.383 4.133 550 HG CYS 72 HG CYS 72 6.602 22.020 5.568 551 H GLY 73 H GLY 73 8.397 21.683 -0.123 552 HA2 GLY 73 HA2 GLY 73 10.481 22.391 -1.319 553 HA3 GLY 73 HA3 GLY 73 11.367 21.967 0.149 554 H ALA 74 H ALA 74 8.653 19.870 -0.844 555 HA ALA 74 HA ALA 74 10.529 17.665 -1.334 556 HB1 ALA 74 HB3 ALA 74 7.558 17.839 -1.888 557 HB2 ALA 74 HB1 ALA 74 8.571 16.381 -1.890 558 HB3 ALA 74 HB2 ALA 74 8.282 17.245 -0.367 559 H LEU 75 H LEU 75 11.025 16.811 -3.338 560 HA LEU 75 HA LEU 75 10.383 18.438 -5.767 561 HB2 LEU 75 HB2 LEU 75 13.063 17.301 -4.912 562 HB3 LEU 75 HB3 LEU 75 12.758 18.130 -6.430 563 HG LEU 75 HG LEU 75 12.548 19.406 -3.667 564 HD11 LEU 75 HD11 LEU 75 14.655 20.537 -4.238 565 HD12 LEU 75 HD12 LEU 75 14.861 18.782 -4.218 566 HD13 LEU 75 HD13 LEU 75 14.741 19.635 -5.769 567 HD21 LEU 75 HD23 LEU 75 11.117 20.559 -5.329 568 HD22 LEU 75 HD21 LEU 75 12.512 21.553 -4.907 569 HD23 LEU 75 HD22 LEU 75 12.490 20.670 -6.449 570 H LYS 76 H LYS 76 11.128 15.276 -4.345 571 HA LYS 76 HA LYS 76 9.925 13.965 -6.673 572 HB2 LYS 76 HB2 LYS 76 12.398 12.979 -5.240 573 HB3 LYS 76 HB3 LYS 76 11.605 12.160 -6.575 574 HG2 LYS 76 HG2 LYS 76 12.362 13.907 -8.126 575 HG3 LYS 76 HG3 LYS 76 13.081 14.823 -6.780 576 HD2 LYS 76 HD2 LYS 76 14.579 12.924 -6.255 577 HD3 LYS 76 HD3 LYS 76 13.898 12.001 -7.608 578 HE2 LYS 76 HE2 LYS 76 14.719 13.638 -9.213 579 HE3 LYS 76 HE3 LYS 76 15.225 14.723 -7.911 580 HZ1 LYS 76 HZ3 LYS 76 17.075 13.435 -8.850 581 HZ2 LYS 76 HZ1 LYS 76 16.898 13.143 -7.253 582 HZ3 LYS 76 HZ2 LYS 76 16.391 12.038 -8.364 583 H THR 77 H THR 77 9.302 11.619 -5.916 584 HA THR 77 HA THR 77 8.542 11.632 -3.116 585 HB THR 77 HB THR 77 7.589 10.159 -5.593 586 HG1 THR 77 HG1 THR 77 6.109 11.583 -5.722 587 HG21 THR 77 HG23 THR 77 6.487 10.089 -2.770 588 HG22 THR 77 HG21 THR 77 5.710 9.387 -4.222 589 HG23 THR 77 HG22 THR 77 7.255 8.746 -3.653 590 H GLY 78 H GLY 78 9.469 10.291 -1.624 591 HA2 GLY 78 HA2 GLY 78 10.563 7.713 -2.175 592 HA3 GLY 78 HA3 GLY 78 11.857 8.915 -2.052 593 H MET 79 H MET 79 12.210 7.232 -0.092 594 HA MET 79 HA MET 79 11.172 8.468 2.390 595 HB2 MET 79 HB2 MET 79 10.890 5.555 1.552 596 HB3 MET 79 HB3 MET 79 10.863 6.035 3.241 597 HG2 MET 79 HG2 MET 79 8.890 7.416 2.916 598 HG3 MET 79 HG3 MET 79 8.885 7.064 1.191 599 HE1 MET 79 HE3 MET 79 6.816 5.991 0.729 600 HE2 MET 79 HE1 MET 79 6.046 4.666 1.621 601 HE3 MET 79 HE2 MET 79 6.103 6.300 2.325 602 H SER 80 H SER 80 12.265 7.387 4.334 603 HA SER 80 HA SER 80 15.022 6.415 3.860 604 HB2 SER 80 HB2 SER 80 14.462 8.417 6.048 605 HB3 SER 80 HB3 SER 80 16.017 7.926 5.380 606 HG SER 80 HG SER 80 15.019 10.065 4.881 607 H LEU 81 H LEU 81 15.822 5.289 5.893 608 HA LEU 81 HA LEU 81 13.775 4.662 7.915 609 HB2 LEU 81 HB2 LEU 81 13.602 2.927 6.171 610 HB3 LEU 81 HB3 LEU 81 15.343 2.668 6.203 611 HG LEU 81 HG LEU 81 15.241 1.714 8.407 612 HD11 LEU 81 HD11 LEU 81 13.116 1.335 9.598 613 HD12 LEU 81 HD12 LEU 81 13.456 3.050 9.445 614 HD13 LEU 81 HD13 LEU 81 12.263 2.261 8.365 615 HD21 LEU 81 HD23 LEU 81 13.956 -0.299 7.834 616 HD22 LEU 81 HD21 LEU 81 12.948 0.639 6.731 617 HD23 LEU 81 HD22 LEU 81 14.649 0.371 6.333 618 H THR 82 H THR 82 14.876 5.623 9.602 619 HA THR 82 HA THR 82 17.781 5.053 9.914 620 HB THR 82 HB THR 82 16.087 7.465 10.720 621 HG1 THR 82 HG1 THR 82 17.526 8.416 9.032 622 HG21 THR 82 HG23 THR 82 18.255 8.550 11.201 623 HG22 THR 82 HG21 THR 82 17.950 7.173 12.257 624 HG23 THR 82 HG22 THR 82 19.099 7.005 10.907 625 H LEU 83 H LEU 83 18.468 4.279 11.939 626 HA LEU 83 HA LEU 83 16.485 4.166 14.154 627 HB2 LEU 83 HB2 LEU 83 16.696 2.022 12.756 628 HB3 LEU 83 HB3 LEU 83 18.314 1.855 13.417 629 HG LEU 83 HG LEU 83 15.747 2.044 15.086 630 HD11 LEU 83 HD11 LEU 83 15.559 0.075 13.775 631 HD12 LEU 83 HD12 LEU 83 17.284 -0.331 14.003 632 HD13 LEU 83 HD13 LEU 83 16.149 -0.451 15.347 633 HD21 LEU 83 HD23 LEU 83 18.624 1.411 15.843 634 HD22 LEU 83 HD21 LEU 83 17.463 2.539 16.603 635 HD23 LEU 83 HD22 LEU 83 17.251 0.825 16.808 636 H LEU 84 H LEU 84 17.369 4.680 16.110 637 HA LEU 84 HA LEU 84 20.291 5.304 16.293 638 HB2 LEU 84 HB2 LEU 84 17.820 6.611 17.453 639 HB3 LEU 84 HB3 LEU 84 19.396 6.766 18.230 640 HG LEU 84 HG LEU 84 20.324 8.002 16.437 641 HD11 LEU 84 HD11 LEU 84 19.346 7.016 14.453 642 HD12 LEU 84 HD12 LEU 84 17.719 7.531 14.940 643 HD13 LEU 84 HD13 LEU 84 18.949 8.734 14.474 644 HD21 LEU 84 HD23 LEU 84 18.784 9.974 16.559 645 HD22 LEU 84 HD21 LEU 84 17.517 8.928 17.203 646 HD23 LEU 84 HD22 LEU 84 19.016 9.177 18.127 647 H GLU 85 H GLU 85 21.261 3.819 17.705 648 HA GLU 85 HA GLU 85 19.805 1.902 19.165 649 HB2 GLU 85 HB2 GLU 85 22.645 2.904 19.617 650 HB3 GLU 85 HB3 GLU 85 21.954 1.462 20.360 651 HG2 GLU 85 HG2 GLU 85 21.552 0.502 18.086 652 HG3 GLU 85 HG3 GLU 85 22.390 1.883 17.376 653 H GLN 86 H GLN 86 21.146 4.998 20.229 654 HA GLN 86 HA GLN 86 20.232 4.646 23.006 655 HB2 GLN 86 HB2 GLN 86 21.464 6.997 21.518 656 HB3 GLN 86 HB3 GLN 86 21.140 7.001 23.235 657 HG2 GLN 86 HG2 GLN 86 22.961 4.938 21.915 658 HG3 GLN 86 HG3 GLN 86 23.537 6.474 22.547 659 HE21 GLN 86 HE22 GLN 86 24.853 4.579 23.648 660 HE22 GLN 86 HE21 GLN 86 24.276 4.135 25.247 661 H GLY 87 H GLY 87 18.997 5.941 20.029 662 HA2 GLY 87 HA2 GLY 87 17.144 7.186 19.482 663 HA3 GLY 87 HA3 GLY 87 16.558 7.009 21.143 664 H VAL 88 H VAL 88 15.994 9.385 20.289 665 HA VAL 88 HA VAL 88 17.629 10.998 22.034 666 HB VAL 88 HB VAL 88 18.430 11.182 19.451 667 HG11 VAL 88 HG11 VAL 88 17.517 13.049 18.301 668 HG12 VAL 88 HG12 VAL 88 16.239 11.845 18.596 669 HG13 VAL 88 HG13 VAL 88 16.313 13.344 19.561 670 HG21 VAL 88 HG23 VAL 88 19.374 13.344 19.965 671 HG22 VAL 88 HG21 VAL 88 18.314 13.489 21.389 672 HG23 VAL 88 HG22 VAL 88 19.531 12.194 21.302 673 H TYR 89 H TYR 89 16.340 13.207 22.323 674 HA TYR 89 HA TYR 89 13.483 12.380 22.451 675 HB2 TYR 89 HB2 TYR 89 14.774 12.179 24.579 676 HB3 TYR 89 HB3 TYR 89 15.030 13.909 24.549 677 HD1 TYR 89 HD1 TYR 89 11.657 13.139 23.303 678 HD2 TYR 89 HD2 TYR 89 14.053 13.523 26.901 679 HE1 TYR 89 HE1 TYR 89 9.645 13.410 24.627 680 HE2 TYR 89 HE2 TYR 89 11.986 13.856 28.224 681 HH TYR 89 HH TYR 89 8.738 13.955 26.657 682 H PHE 90 H PHE 90 12.708 13.498 20.733 683 HA PHE 90 HA PHE 90 13.133 16.166 20.016 684 HB2 PHE 90 HB2 PHE 90 10.630 14.437 20.037 685 HB3 PHE 90 HB3 PHE 90 10.691 16.024 19.264 686 HD1 PHE 90 HD1 PHE 90 13.157 16.161 17.798 687 HD2 PHE 90 HD2 PHE 90 10.471 12.826 18.298 688 HE1 PHE 90 HE1 PHE 90 13.987 15.185 15.694 689 HE2 PHE 90 HE2 PHE 90 11.264 11.883 16.138 690 HZ PHE 90 HZ PHE 90 13.024 13.065 14.834 691 HA PRO 91 HA PRO 91 11.920 18.387 23.577 692 HB2 PRO 91 HB2 PRO 91 11.045 20.803 22.513 693 HB3 PRO 91 HB3 PRO 91 12.758 20.314 22.685 694 HG2 PRO 91 HG2 PRO 91 10.983 20.056 20.240 695 HG3 PRO 91 HG3 PRO 91 12.658 20.707 20.334 696 HD2 PRO 91 HD2 PRO 91 12.200 18.174 19.543 697 HD3 PRO 91 HD3 PRO 91 13.562 18.526 20.650 698 H GLY 92 H GLY 92 10.184 18.220 24.852 699 HA2 GLY 92 HA2 GLY 92 8.061 18.254 25.629 700 HA3 GLY 92 HA3 GLY 92 7.611 19.188 24.196 701 H ASN 93 H ASN 93 8.924 16.063 23.294 702 HA ASN 93 HA ASN 93 6.267 15.103 22.572 703 HB2 ASN 93 HB2 ASN 93 8.422 14.675 21.269 704 HB3 ASN 93 HB3 ASN 93 8.911 13.588 22.555 705 HD21 ASN 93 HD22 ASN 93 8.742 11.579 21.542 706 HD22 ASN 93 HD21 ASN 93 7.298 11.015 20.719 707 H ASP 94 H ASP 94 5.633 12.784 23.328 708 HA ASP 94 HA ASP 94 5.510 12.748 26.186 709 HB2 ASP 94 HB2 ASP 94 3.788 11.738 24.723 710 HB3 ASP 94 HB3 ASP 94 4.946 10.498 24.227 711 H GLU 95 H GLU 95 7.561 10.991 23.872 712 HA GLU 95 HA GLU 95 9.473 10.272 25.974 713 HB2 GLU 95 HB2 GLU 95 9.045 7.996 25.894 714 HB3 GLU 95 HB3 GLU 95 7.442 8.668 25.707 715 HG2 GLU 95 HG2 GLU 95 7.568 8.331 23.247 716 HG3 GLU 95 HG3 GLU 95 9.152 7.575 23.462 717 HA PRO 96 HA PRO 96 12.381 10.598 22.657 718 HB2 PRO 96 HB2 PRO 96 14.291 8.681 23.080 719 HB3 PRO 96 HB3 PRO 96 14.059 10.072 24.177 720 HG2 PRO 96 HG2 PRO 96 12.982 7.262 24.490 721 HG3 PRO 96 HG3 PRO 96 13.815 8.272 25.714 722 HD2 PRO 96 HD2 PRO 96 11.105 8.054 25.566 723 HD3 PRO 96 HD3 PRO 96 11.889 9.582 26.073 724 H ILE 97 H ILE 97 13.289 9.629 20.707 725 HA ILE 97 HA ILE 97 11.624 7.382 19.625 726 HB ILE 97 HB ILE 97 12.778 9.824 18.234 727 HG12 ILE 97 HG12 ILE 97 10.907 10.564 19.495 728 HG13 ILE 97 HG13 ILE 97 10.384 10.433 17.833 729 HG21 ILE 97 HG21 ILE 97 11.654 9.069 16.217 730 HG22 ILE 97 HG22 ILE 97 12.794 7.842 16.710 731 HG23 ILE 97 HG23 ILE 97 11.064 7.609 17.023 732 HD11 ILE 97 HD13 ILE 97 8.650 9.660 19.384 733 HD12 ILE 97 HD11 ILE 97 9.190 8.309 18.367 734 HD13 ILE 97 HD12 ILE 97 9.714 8.455 20.066 735 H LYS 98 H LYS 98 12.655 5.761 18.654 736 HA LYS 98 HA LYS 98 15.636 5.892 18.459 737 HB2 LYS 98 HB2 LYS 98 13.946 3.428 19.027 738 HB3 LYS 98 HB3 LYS 98 15.698 3.514 18.900 739 HG2 LYS 98 HG2 LYS 98 15.039 5.421 20.896 740 HG3 LYS 98 HG3 LYS 98 13.938 4.085 21.190 741 HD2 LYS 98 HD2 LYS 98 16.976 3.940 21.024 742 HD3 LYS 98 HD3 LYS 98 16.009 3.914 22.503 743 HE2 LYS 98 HE2 LYS 98 14.933 1.778 21.708 744 HE3 LYS 98 HE3 LYS 98 16.011 1.800 20.303 745 HZ1 LYS 98 HZ3 LYS 98 17.895 1.760 21.889 746 HZ2 LYS 98 HZ1 LYS 98 16.847 1.578 23.133 747 HZ3 LYS 98 HZ2 LYS 98 16.954 0.416 21.995 748 H LEU 99 H LEU 99 12.700 5.716 16.662 749 HA LEU 99 HA LEU 99 14.272 4.838 14.334 750 HB2 LEU 99 HB2 LEU 99 13.074 2.851 15.387 751 HB3 LEU 99 HB3 LEU 99 11.566 3.749 15.218 752 HG LEU 99 HG LEU 99 12.031 3.727 12.669 753 HD11 LEU 99 HD11 LEU 99 13.862 1.429 13.507 754 HD12 LEU 99 HD12 LEU 99 13.435 1.863 11.850 755 HD13 LEU 99 HD13 LEU 99 14.421 2.959 12.815 756 HD21 LEU 99 HD23 LEU 99 11.008 1.548 12.459 757 HD22 LEU 99 HD21 LEU 99 11.489 1.096 14.110 758 HD23 LEU 99 HD22 LEU 99 10.298 2.383 13.825 759 H LEU 100 H LEU 100 13.785 5.845 12.472 760 HA LEU 100 HA LEU 100 11.521 7.785 12.463 761 HB2 LEU 100 HB2 LEU 100 14.314 8.571 11.585 762 HB3 LEU 100 HB3 LEU 100 12.920 9.579 11.799 763 HG LEU 100 HG LEU 100 13.383 8.409 14.343 764 HD11 LEU 100 HD11 LEU 100 16.011 9.361 13.182 765 HD12 LEU 100 HD12 LEU 100 15.701 8.879 14.867 766 HD13 LEU 100 HD13 LEU 100 15.593 7.674 13.571 767 HD21 LEU 100 HD23 LEU 100 13.935 10.602 15.138 768 HD22 LEU 100 HD21 LEU 100 14.211 11.174 13.481 769 HD23 LEU 100 HD22 LEU 100 12.581 10.681 14.002 770 H ILE 101 H ILE 101 10.362 7.074 10.678 771 HA ILE 101 HA ILE 101 11.872 6.278 8.271 772 HB ILE 101 HB ILE 101 8.970 5.915 9.119 773 HG12 ILE 101 HG12 ILE 101 9.582 3.598 8.401 774 HG13 ILE 101 HG13 ILE 101 11.208 4.159 8.026 775 HG21 ILE 101 HG21 ILE 101 8.478 5.043 6.884 776 HG22 ILE 101 HG22 ILE 101 8.804 6.773 6.826 777 HG23 ILE 101 HG23 ILE 101 10.048 5.627 6.284 778 HD11 ILE 101 HD13 ILE 101 10.817 2.917 10.259 779 HD12 ILE 101 HD11 ILE 101 11.795 4.387 10.287 780 HD13 ILE 101 HD12 ILE 101 10.107 4.435 10.841 781 H GLY 102 H GLY 102 12.450 7.755 6.869 782 HA2 GLY 102 HA2 GLY 102 11.280 10.477 6.904 783 HA3 GLY 102 HA3 GLY 102 12.581 9.896 5.852 784 H LEU 103 H LEU 103 10.138 11.282 5.030 785 HA LEU 103 HA LEU 103 9.439 9.513 2.830 786 HB2 LEU 103 HB2 LEU 103 7.572 9.251 4.639 787 HB3 LEU 103 HB3 LEU 103 7.218 10.940 4.345 788 HG LEU 103 HG LEU 103 6.833 8.528 2.511 789 HD11 LEU 103 HD11 LEU 103 4.855 10.705 3.355 790 HD12 LEU 103 HD12 LEU 103 4.529 9.036 2.847 791 HD13 LEU 103 HD13 LEU 103 5.213 9.380 4.439 792 HD21 LEU 103 HD23 LEU 103 5.661 10.277 0.982 793 HD22 LEU 103 HD21 LEU 103 6.689 11.457 1.753 794 HD23 LEU 103 HD22 LEU 103 7.389 10.031 0.881 795 H SER 104 H SER 104 9.034 10.883 0.991 796 HA SER 104 HA SER 104 8.828 13.776 1.267 797 HB2 SER 104 HB2 SER 104 10.547 14.131 -0.512 798 HB3 SER 104 HB3 SER 104 11.206 13.611 1.052 799 HG SER 104 HG SER 104 11.094 11.416 0.127 800 H ALA 105 H ALA 105 7.459 14.495 -0.531 801 HA ALA 105 HA ALA 105 6.907 12.579 -2.655 802 HB1 ALA 105 HB3 ALA 105 5.312 11.588 -1.352 803 HB2 ALA 105 HB1 ALA 105 5.003 13.049 -0.423 804 HB3 ALA 105 HB2 ALA 105 4.366 12.909 -2.075 805 H ALA 106 H ALA 106 6.466 13.607 -4.489 806 HA ALA 106 HA ALA 106 6.838 16.443 -4.418 807 HB1 ALA 106 HB3 ALA 106 6.182 14.588 -6.762 808 HB2 ALA 106 HB1 ALA 106 6.763 16.260 -6.899 809 HB3 ALA 106 HB2 ALA 106 7.813 15.021 -6.194 810 H ASP 107 H ASP 107 4.010 14.417 -4.424 811 HA ASP 107 HA ASP 107 2.254 16.812 -4.732 812 HB2 ASP 107 HB2 ASP 107 2.330 15.696 -6.937 813 HB3 ASP 107 HB3 ASP 107 1.874 14.165 -6.188 814 H ALA 108 H ALA 108 0.142 16.538 -3.707 815 HA ALA 108 HA ALA 108 0.298 15.297 -1.191 816 HB1 ALA 108 HB3 ALA 108 -2.166 16.210 -2.734 817 HB2 ALA 108 HB1 ALA 108 -2.083 15.894 -0.989 818 HB3 ALA 108 HB2 ALA 108 -1.148 17.231 -1.684 819 H ASP 109 H ASP 109 -1.100 14.013 -4.237 820 HA ASP 109 HA ASP 109 -2.306 11.705 -2.874 821 HB2 ASP 109 HB2 ASP 109 -3.222 12.466 -4.973 822 HB3 ASP 109 HB3 ASP 109 -1.655 12.234 -5.783 823 H SER 110 H SER 110 0.832 12.493 -4.325 824 HA SER 110 HA SER 110 1.897 9.819 -4.128 825 HB2 SER 110 HB2 SER 110 3.442 12.438 -4.070 826 HB3 SER 110 HB3 SER 110 4.054 10.827 -4.430 827 HG SER 110 HG SER 110 3.623 11.964 -6.348 828 H HIS 111 H HIS 111 1.660 12.600 -1.805 829 HA HIS 111 HA HIS 111 3.070 11.293 0.321 830 HB2 HIS 111 HB2 HIS 111 0.858 13.381 0.390 831 HB3 HIS 111 HB3 HIS 111 1.452 12.612 1.841 832 HD1 HIS 111 HD1 HIS 111 3.823 13.393 2.781 833 HD2 HIS 111 HD2 HIS 111 2.601 15.102 -0.878 834 HE1 HIS 111 HE1 HIS 111 5.452 15.245 2.260 835 H ILE 112 H ILE 112 -0.435 11.239 -0.559 836 HA ILE 112 HA ILE 112 -1.260 9.481 1.486 837 HB ILE 112 HB ILE 112 -2.263 9.853 -1.374 838 HG12 ILE 112 HG12 ILE 112 -2.440 11.853 0.105 839 HG13 ILE 112 HG13 ILE 112 -3.961 11.269 -0.538 840 HG21 ILE 112 HG21 ILE 112 -3.083 7.698 -0.773 841 HG22 ILE 112 HG22 ILE 112 -3.611 8.265 0.826 842 HG23 ILE 112 HG23 ILE 112 -4.413 8.848 -0.657 843 HD11 ILE 112 HD13 ILE 112 -4.115 11.996 1.798 844 HD12 ILE 112 HD11 ILE 112 -4.531 10.281 1.631 845 HD13 ILE 112 HD12 ILE 112 -2.940 10.753 2.283 846 H GLY 113 H GLY 113 -0.201 8.564 -1.880 847 HA2 GLY 113 HA2 GLY 113 -0.454 5.790 -1.457 848 HA3 GLY 113 HA3 GLY 113 0.611 6.560 -2.654 849 H ALA 114 H ALA 114 2.315 7.966 -0.812 850 HA ALA 114 HA ALA 114 4.235 5.929 -0.175 851 HB1 ALA 114 HB3 ALA 114 4.839 8.239 -0.829 852 HB2 ALA 114 HB1 ALA 114 4.016 8.872 0.603 853 HB3 ALA 114 HB2 ALA 114 5.467 7.870 0.776 854 H ILE 115 H ILE 115 2.247 8.075 1.960 855 HA ILE 115 HA ILE 115 2.931 7.103 4.402 856 HB ILE 115 HB ILE 115 0.537 8.275 3.159 857 HG12 ILE 115 HG12 ILE 115 2.472 9.753 3.664 858 HG13 ILE 115 HG13 ILE 115 0.968 10.269 4.403 859 HG21 ILE 115 HG21 ILE 115 -0.556 8.634 5.360 860 HG22 ILE 115 HG22 ILE 115 -0.626 7.020 4.659 861 HG23 ILE 115 HG23 ILE 115 0.525 7.339 5.984 862 HD11 ILE 115 HD13 ILE 115 1.683 9.401 6.584 863 HD12 ILE 115 HD11 ILE 115 3.168 8.756 5.847 864 HD13 ILE 115 HD12 ILE 115 2.899 10.504 5.918 865 H GLN 116 H GLN 116 0.340 6.001 2.107 866 HA GLN 116 HA GLN 116 -0.701 3.954 3.808 867 HB2 GLN 116 HB2 GLN 116 -0.896 4.514 0.823 868 HB3 GLN 116 HB3 GLN 116 -1.726 3.151 1.568 869 HG2 GLN 116 HG2 GLN 116 -2.087 6.043 2.439 870 HG3 GLN 116 HG3 GLN 116 -3.131 5.220 1.290 871 HE21 GLN 116 HE22 GLN 116 -3.192 6.236 4.378 872 HE22 GLN 116 HE21 GLN 116 -4.104 4.957 5.133 873 H ALA 117 H ALA 117 2.227 3.994 1.953 874 HA ALA 117 HA ALA 117 2.368 1.079 1.849 875 HB1 ALA 117 HB3 ALA 117 4.501 1.444 0.644 876 HB2 ALA 117 HB1 ALA 117 3.211 2.389 -0.125 877 HB3 ALA 117 HB2 ALA 117 4.388 3.186 0.925 878 H LEU 118 H LEU 118 3.930 3.898 3.439 879 HA LEU 118 HA LEU 118 5.642 2.156 4.933 880 HB2 LEU 118 HB2 LEU 118 6.264 4.091 6.191 881 HB3 LEU 118 HB3 LEU 118 6.267 4.355 4.429 882 HG LEU 118 HG LEU 118 4.199 5.555 4.578 883 HD11 LEU 118 HD11 LEU 118 4.641 5.433 7.596 884 HD12 LEU 118 HD12 LEU 118 3.606 6.643 6.770 885 HD13 LEU 118 HD13 LEU 118 3.162 4.993 6.744 886 HD21 LEU 118 HD23 LEU 118 6.522 6.595 6.265 887 HD22 LEU 118 HD21 LEU 118 6.395 6.693 4.501 888 HD23 LEU 118 HD22 LEU 118 5.281 7.603 5.529 889 H SER 119 H SER 119 2.438 3.344 5.442 890 HA SER 119 HA SER 119 2.075 2.601 8.130 891 HB2 SER 119 HB2 SER 119 0.044 2.398 5.867 892 HB3 SER 119 HB3 SER 119 -0.330 2.368 7.599 893 HG SER 119 HG SER 119 0.833 4.489 6.102 894 H GLU 120 H GLU 120 2.552 0.443 5.384 895 HA GLU 120 HA GLU 120 1.393 -1.899 6.577 896 HB2 GLU 120 HB2 GLU 120 3.607 -1.643 4.518 897 HB3 GLU 120 HB3 GLU 120 2.776 -3.133 4.925 898 HG2 GLU 120 HG2 GLU 120 1.314 -0.692 3.863 899 HG3 GLU 120 HG3 GLU 120 1.984 -1.931 2.810 900 H LEU 121 H LEU 121 4.174 0.012 7.126 901 HA LEU 121 HA LEU 121 5.536 -2.109 8.725 902 HB2 LEU 121 HB2 LEU 121 6.652 0.542 7.745 903 HB3 LEU 121 HB3 LEU 121 7.544 -0.754 8.531 904 HG LEU 121 HG LEU 121 6.329 -0.703 5.739 905 HD11 LEU 121 HD11 LEU 121 8.686 -0.975 5.035 906 HD12 LEU 121 HD12 LEU 121 8.449 0.489 6.002 907 HD13 LEU 121 HD13 LEU 121 9.201 -0.946 6.733 908 HD21 LEU 121 HD23 LEU 121 7.827 -3.064 7.006 909 HD22 LEU 121 HD21 LEU 121 6.087 -3.042 6.654 910 HD23 LEU 121 HD22 LEU 121 7.258 -2.953 5.339 911 H LEU 122 H LEU 122 5.074 1.488 8.909 912 HA LEU 122 HA LEU 122 5.553 1.691 11.641 913 HB2 LEU 122 HB2 LEU 122 3.847 3.542 9.988 914 HB3 LEU 122 HB3 LEU 122 4.592 3.863 11.555 915 HG LEU 122 HG LEU 122 5.925 3.583 8.861 916 HD11 LEU 122 HD11 LEU 122 5.087 5.748 10.021 917 HD12 LEU 122 HD12 LEU 122 6.497 5.579 11.069 918 HD13 LEU 122 HD13 LEU 122 6.712 5.743 9.307 919 HD21 LEU 122 HD23 LEU 122 8.121 3.728 10.059 920 HD22 LEU 122 HD21 LEU 122 7.316 3.297 11.567 921 HD23 LEU 122 HD22 LEU 122 7.366 2.149 10.205 922 H CYS 123 H CYS 123 2.548 0.571 10.221 923 HA CYS 123 HA CYS 123 1.251 0.911 12.877 924 HB2 CYS 123 HB2 CYS 123 -0.116 0.550 10.180 925 HB3 CYS 123 HB3 CYS 123 -0.884 0.909 11.727 926 HG CYS 123 HG CYS 123 0.288 3.218 12.119 927 H GLU 124 H GLU 124 3.141 -1.173 12.083 928 HA GLU 124 HA GLU 124 1.464 -3.505 12.773 929 HB2 GLU 124 HB2 GLU 124 3.480 -3.324 10.522 930 HB3 GLU 124 HB3 GLU 124 3.153 -4.858 11.329 931 HG2 GLU 124 HG2 GLU 124 0.917 -3.184 10.148 932 HG3 GLU 124 HG3 GLU 124 1.844 -4.332 9.187 933 H GLU 125 H GLU 125 1.989 -3.492 14.839 934 HA GLU 125 HA GLU 125 4.443 -2.754 15.950 935 HB2 GLU 125 HB2 GLU 125 3.679 -3.776 18.007 936 HB3 GLU 125 HB3 GLU 125 2.368 -2.905 17.214 937 HG2 GLU 125 HG2 GLU 125 1.496 -5.092 16.326 938 HG3 GLU 125 HG3 GLU 125 2.774 -5.932 17.205 939 H GLU 126 H GLU 126 3.571 -5.824 14.500 940 HA GLU 126 HA GLU 126 5.693 -7.386 15.578 941 HB2 GLU 126 HB2 GLU 126 4.308 -7.685 12.875 942 HB3 GLU 126 HB3 GLU 126 5.276 -8.912 13.708 943 HG2 GLU 126 HG2 GLU 126 3.619 -8.771 15.631 944 HG3 GLU 126 HG3 GLU 126 2.623 -7.731 14.603 945 H ILE 127 H ILE 127 5.390 -5.347 12.680 946 HA ILE 127 HA ILE 127 8.068 -5.803 11.696 947 HB ILE 127 HB ILE 127 5.882 -3.862 11.073 948 HG12 ILE 127 HG12 ILE 127 5.959 -4.813 8.878 949 HG13 ILE 127 HG13 ILE 127 7.461 -5.678 9.222 950 HG21 ILE 127 HG21 ILE 127 7.462 -2.999 9.241 951 HG22 ILE 127 HG22 ILE 127 7.690 -2.391 10.883 952 HG23 ILE 127 HG23 ILE 127 8.765 -3.653 10.239 953 HD11 ILE 127 HD13 ILE 127 4.776 -6.329 10.486 954 HD12 ILE 127 HD11 ILE 127 5.475 -7.146 9.076 955 HD13 ILE 127 HD12 ILE 127 6.292 -7.262 10.639 956 H LEU 128 H LEU 128 6.474 -3.311 13.752 957 HA LEU 128 HA LEU 128 8.629 -1.559 13.887 958 HB2 LEU 128 HB2 LEU 128 6.659 -2.204 16.126 959 HB3 LEU 128 HB3 LEU 128 7.773 -0.850 16.132 960 HG LEU 128 HG LEU 128 5.454 -1.233 14.206 961 HD11 LEU 128 HD11 LEU 128 5.977 0.780 16.419 962 HD12 LEU 128 HD12 LEU 128 4.583 0.783 15.313 963 HD13 LEU 128 HD13 LEU 128 4.803 -0.541 16.461 964 HD21 LEU 128 HD23 LEU 128 7.028 -0.169 12.846 965 HD22 LEU 128 HD21 LEU 128 6.127 1.173 13.568 966 HD23 LEU 128 HD22 LEU 128 7.736 0.754 14.184 967 H GLU 129 H GLU 129 8.115 -4.426 15.937 968 HA GLU 129 HA GLU 129 10.411 -3.926 17.557 969 HB2 GLU 129 HB2 GLU 129 8.505 -6.208 17.167 970 HB3 GLU 129 HB3 GLU 129 10.111 -6.612 17.792 971 HG2 GLU 129 HG2 GLU 129 9.905 -4.957 19.579 972 HG3 GLU 129 HG3 GLU 129 8.295 -4.496 19.004 973 H GLN 130 H GLN 130 9.930 -5.634 14.428 974 HA GLN 130 HA GLN 130 12.488 -6.951 14.564 975 HB2 GLN 130 HB2 GLN 130 10.385 -6.534 12.416 976 HB3 GLN 130 HB3 GLN 130 11.917 -7.382 12.102 977 HG2 GLN 130 HG2 GLN 130 11.473 -9.042 13.769 978 HG3 GLN 130 HG3 GLN 130 10.012 -8.210 14.309 979 HE21 GLN 130 HE22 GLN 130 8.121 -8.309 13.039 980 HE22 GLN 130 HE21 GLN 130 7.920 -9.486 11.746 981 H LEU 131 H LEU 131 11.243 -3.856 13.281 982 HA LEU 131 HA LEU 131 13.761 -3.057 12.057 983 HB2 LEU 131 HB2 LEU 131 11.553 -1.353 13.276 984 HB3 LEU 131 HB3 LEU 131 12.913 -0.743 12.340 985 HG LEU 131 HG LEU 131 10.897 -2.769 11.210 986 HD11 LEU 131 HD11 LEU 131 10.713 0.219 10.843 987 HD12 LEU 131 HD12 LEU 131 9.555 -1.021 10.358 988 HD13 LEU 131 HD13 LEU 131 9.803 -0.685 12.091 989 HD21 LEU 131 HD23 LEU 131 12.782 -0.788 9.896 990 HD22 LEU 131 HD21 LEU 131 12.961 -2.545 9.908 991 HD23 LEU 131 HD22 LEU 131 11.617 -1.791 9.028 992 H LEU 132 H LEU 132 12.113 -2.239 15.131 993 HA LEU 132 HA LEU 132 14.186 -0.751 16.254 994 HB2 LEU 132 HB2 LEU 132 11.963 -2.333 17.543 995 HB3 LEU 132 HB3 LEU 132 13.085 -1.419 18.523 996 HG LEU 132 HG LEU 132 11.510 -0.096 16.284 997 HD11 LEU 132 HD11 LEU 132 10.807 -0.276 19.248 998 HD12 LEU 132 HD12 LEU 132 9.952 0.687 18.023 999 HD13 LEU 132 HD13 LEU 132 9.940 -1.079 17.922 1000 HD21 LEU 132 HD23 LEU 132 12.008 1.969 17.545 1001 HD22 LEU 132 HD21 LEU 132 12.936 1.032 18.735 1002 HD23 LEU 132 HD22 LEU 132 13.503 1.161 17.059 1003 H THR 133 H THR 133 14.380 -4.150 15.810 1004 HA THR 133 HA THR 133 16.564 -4.340 17.809 1005 HB THR 133 HB THR 133 16.088 -6.787 17.768 1006 HG1 THR 133 HG1 THR 133 13.651 -6.054 16.541 1007 HG21 THR 133 HG23 THR 133 13.694 -5.074 18.611 1008 HG22 THR 133 HG21 THR 133 14.077 -6.711 19.170 1009 HG23 THR 133 HG22 THR 133 15.159 -5.366 19.569 1010 H ALA 134 H ALA 134 16.274 -3.609 14.679 1011 HA ALA 134 HA ALA 134 17.925 -5.379 13.240 1012 HB1 ALA 134 HB3 ALA 134 16.528 -3.670 12.181 1013 HB2 ALA 134 HB1 ALA 134 17.514 -2.382 12.913 1014 HB3 ALA 134 HB2 ALA 134 18.236 -3.475 11.718 1015 H SER 135 H SER 135 19.924 -6.000 13.975 1016 HA SER 135 HA SER 135 21.664 -4.370 15.499 1017 HB2 SER 135 HB2 SER 135 22.422 -6.703 13.697 1018 HB3 SER 135 HB3 SER 135 23.257 -6.164 15.164 1019 HG SER 135 HG SER 135 21.438 -6.821 16.366 1020 H SER 136 H SER 136 21.131 -4.592 12.028 1021 HA SER 136 HA SER 136 23.239 -2.617 11.435 1022 HB2 SER 136 HB2 SER 136 23.039 -5.330 10.044 1023 HB3 SER 136 HB3 SER 136 24.209 -4.046 9.703 1024 HG SER 136 HG SER 136 25.093 -5.714 10.997 1025 H GLU 137 H GLU 137 22.985 -1.769 9.251 1026 HA GLU 137 HA GLU 137 20.393 -1.036 8.544 1027 HB2 GLU 137 HB2 GLU 137 22.910 -1.194 6.803 1028 HB3 GLU 137 HB3 GLU 137 21.422 -0.342 6.390 1029 HG2 GLU 137 HG2 GLU 137 22.749 1.320 7.054 1030 HG3 GLU 137 HG3 GLU 137 21.666 1.032 8.411 1031 H LYS 138 H LYS 138 22.276 -3.820 7.419 1032 HA LYS 138 HA LYS 138 20.742 -4.574 5.244 1033 HB2 LYS 138 HB2 LYS 138 22.888 -5.628 5.914 1034 HB3 LYS 138 HB3 LYS 138 22.087 -6.404 7.279 1035 HG2 LYS 138 HG2 LYS 138 22.446 -7.979 5.460 1036 HG3 LYS 138 HG3 LYS 138 20.721 -7.762 5.750 1037 HD2 LYS 138 HD2 LYS 138 20.555 -6.283 3.758 1038 HD3 LYS 138 HD3 LYS 138 22.307 -6.362 3.549 1039 HE2 LYS 138 HE2 LYS 138 21.315 -7.845 1.955 1040 HE3 LYS 138 HE3 LYS 138 22.144 -8.821 3.168 1041 HZ1 LYS 138 HZ3 LYS 138 19.219 -8.329 3.083 1042 HZ2 LYS 138 HZ1 LYS 138 19.960 -9.701 2.615 1043 HZ3 LYS 138 HZ2 LYS 138 19.985 -9.272 4.184 1044 H GLN 139 H GLN 139 19.856 -5.156 8.713 1045 HA GLN 139 HA GLN 139 17.695 -6.861 7.959 1046 HB2 GLN 139 HB2 GLN 139 19.039 -7.247 9.925 1047 HB3 GLN 139 HB3 GLN 139 18.794 -5.591 10.491 1048 HG2 GLN 139 HG2 GLN 139 17.488 -7.075 11.763 1049 HG3 GLN 139 HG3 GLN 139 16.467 -5.991 10.814 1050 HE21 GLN 139 HE22 GLN 139 15.237 -6.932 8.993 1051 HE22 GLN 139 HE21 GLN 139 15.043 -8.646 8.760 1052 H LEU 140 H LEU 140 18.203 -3.361 8.471 1053 HA LEU 140 HA LEU 140 15.383 -2.718 8.804 1054 HB2 LEU 140 HB2 LEU 140 17.848 -1.144 8.014 1055 HB3 LEU 140 HB3 LEU 140 16.258 -0.435 7.927 1056 HG LEU 140 HG LEU 140 17.493 -1.568 10.445 1057 HD11 LEU 140 HD11 LEU 140 17.816 0.755 11.127 1058 HD12 LEU 140 HD12 LEU 140 18.658 0.465 9.602 1059 HD13 LEU 140 HD13 LEU 140 17.120 1.341 9.611 1060 HD21 LEU 140 HD23 LEU 140 14.938 -0.003 10.126 1061 HD22 LEU 140 HD21 LEU 140 15.121 -1.695 10.680 1062 HD23 LEU 140 HD22 LEU 140 15.739 -0.381 11.656 1063 H ALA 141 H ALA 141 17.717 -2.677 6.070 1064 HA ALA 141 HA ALA 141 15.884 -2.185 3.994 1065 HB1 ALA 141 HB3 ALA 141 17.633 -3.019 2.518 1066 HB2 ALA 141 HB1 ALA 141 18.363 -2.053 3.814 1067 HB3 ALA 141 HB2 ALA 141 18.451 -3.825 3.877 1068 H ASP 142 H ASP 142 16.789 -5.344 5.488 1069 HA ASP 142 HA ASP 142 15.433 -7.023 3.680 1070 HB2 ASP 142 HB2 ASP 142 16.821 -8.016 5.353 1071 HB3 ASP 142 HB3 ASP 142 15.939 -7.222 6.653 1072 H ILE 143 H ILE 143 14.119 -5.220 6.540 1073 HA ILE 143 HA ILE 143 11.509 -6.351 6.273 1074 HB ILE 143 HB ILE 143 12.738 -4.038 7.787 1075 HG12 ILE 143 HG12 ILE 143 11.558 -6.693 8.764 1076 HG13 ILE 143 HG13 ILE 143 13.255 -6.511 8.342 1077 HG21 ILE 143 HG21 ILE 143 9.871 -5.049 7.907 1078 HG22 ILE 143 HG22 ILE 143 10.625 -3.971 9.103 1079 HG23 ILE 143 HG23 ILE 143 10.429 -3.422 7.438 1080 HD11 ILE 143 HD13 ILE 143 13.146 -6.337 10.675 1081 HD12 ILE 143 HD11 ILE 143 13.456 -4.709 10.087 1082 HD13 ILE 143 HD12 ILE 143 11.815 -5.167 10.643 1083 H ILE 144 H ILE 144 13.083 -3.409 5.010 1084 HA ILE 144 HA ILE 144 10.763 -2.323 3.705 1085 HB ILE 144 HB ILE 144 13.703 -2.286 2.865 1086 HG12 ILE 144 HG12 ILE 144 13.452 -1.055 4.874 1087 HG13 ILE 144 HG13 ILE 144 13.598 0.109 3.564 1088 HG21 ILE 144 HG21 ILE 144 11.411 -0.757 1.591 1089 HG22 ILE 144 HG22 ILE 144 13.138 -0.416 1.347 1090 HG23 ILE 144 HG23 ILE 144 12.469 -1.958 0.830 1091 HD11 ILE 144 HD13 ILE 144 11.856 0.955 4.900 1092 HD12 ILE 144 HD11 ILE 144 10.986 0.146 3.580 1093 HD13 ILE 144 HD12 ILE 144 11.148 -0.649 5.160 1094 H SER 145 H SER 145 13.178 -4.682 2.595 1095 HA SER 145 HA SER 145 12.065 -4.929 0.039 1096 HB2 SER 145 HB2 SER 145 13.754 -6.980 1.551 1097 HB3 SER 145 HB3 SER 145 13.543 -6.892 -0.205 1098 HG SER 145 HG SER 145 14.808 -5.006 1.516 1099 H ARG 146 H ARG 146 11.278 -6.615 3.056 1100 HA ARG 146 HA ARG 146 9.730 -8.725 2.182 1101 HB2 ARG 146 HB2 ARG 146 10.559 -7.616 4.564 1102 HB3 ARG 146 HB3 ARG 146 8.865 -7.128 4.587 1103 HG2 ARG 146 HG2 ARG 146 8.235 -9.509 4.216 1104 HG3 ARG 146 HG3 ARG 146 9.967 -9.932 4.214 1105 HD2 ARG 146 HD2 ARG 146 8.596 -8.498 6.530 1106 HD3 ARG 146 HD3 ARG 146 8.684 -10.270 6.417 1107 HE ARG 146 HE ARG 146 11.306 -9.155 6.113 1108 HH11 ARG 146 HH21 ARG 146 8.843 -9.831 8.578 1109 HH12 ARG 146 HH22 ARG 146 9.988 -9.968 9.878 1110 HH21 ARG 146 HH11 ARG 146 12.823 -9.349 7.832 1111 HH22 ARG 146 HH12 ARG 146 12.268 -9.724 9.440 1112 H GLY 147 H GLY 147 8.976 -5.306 2.013 1113 HA2 GLY 147 HA2 GLY 147 6.052 -5.690 1.998 1114 HA3 GLY 147 HA3 GLY 147 6.955 -4.172 1.870
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