NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
601558 | 2rva | 11592 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H ASN 1 H ASN 1 -5.542 -9.851 -20.028 2 HA ASN 1 HA ASN 1 -4.202 -9.941 -18.028 3 HB2 ASN 1 1HB ASN 1 -2.907 -7.772 -19.668 4 HB3 ASN 1 2HB ASN 1 -2.138 -9.088 -18.786 5 HD21 ASN 1 1HD2 ASN 1 -2.930 -8.008 -21.769 6 HD22 ASN 1 2HD2 ASN 1 -2.944 -9.506 -22.632 7 H LEU 2 H LEU 2 -6.056 -8.719 -16.793 8 HA LEU 2 HA LEU 2 -4.795 -6.357 -15.591 9 HB2 LEU 2 1HB LEU 2 -7.621 -6.619 -16.561 10 HB3 LEU 2 2HB LEU 2 -7.186 -5.474 -15.294 11 HG LEU 2 HG LEU 2 -5.477 -4.573 -17.009 12 HD11 LEU 2 1HD1 LEU 2 -6.730 -4.904 -19.349 13 HD12 LEU 2 2HD1 LEU 2 -7.058 -6.478 -18.623 14 HD13 LEU 2 3HD1 LEU 2 -5.394 -5.927 -18.818 15 HD21 LEU 2 3HD2 LEU 2 -7.258 -3.188 -16.360 16 HD22 LEU 2 1HD2 LEU 2 -8.455 -4.207 -17.159 17 HD23 LEU 2 2HD2 LEU 2 -7.340 -3.238 -18.121 18 H ALA 3 H ALA 3 -4.155 -8.118 -14.090 19 HA ALA 3 HA ALA 3 -5.717 -8.051 -11.751 20 HB1 ALA 3 1HB ALA 3 -7.205 -9.654 -12.225 21 HB2 ALA 3 2HB ALA 3 -6.263 -10.258 -13.587 22 HB3 ALA 3 3HB ALA 3 -5.870 -10.773 -11.947 23 H LEU 4 H LEU 4 -4.269 -8.135 -10.172 24 HA LEU 4 HA LEU 4 -1.582 -8.789 -10.535 25 HB2 LEU 4 1HB LEU 4 -2.989 -7.553 -8.599 26 HB3 LEU 4 2HB LEU 4 -2.680 -9.100 -7.813 27 HG LEU 4 HG LEU 4 -0.192 -8.518 -8.632 28 HD11 LEU 4 1HD1 LEU 4 0.241 -6.363 -9.016 29 HD12 LEU 4 2HD1 LEU 4 -0.820 -5.823 -7.715 30 HD13 LEU 4 3HD1 LEU 4 -1.492 -6.200 -9.301 31 HD21 LEU 4 3HD2 LEU 4 -0.751 -9.103 -6.377 32 HD22 LEU 4 1HD2 LEU 4 -1.580 -7.566 -6.133 33 HD23 LEU 4 2HD2 LEU 4 0.170 -7.597 -6.347 34 H ASN 5 H ASN 5 -0.551 -10.426 -8.807 35 HA ASN 5 HA ASN 5 -1.024 -12.997 -9.810 36 HB2 ASN 5 1HB ASN 5 0.299 -13.641 -7.620 37 HB3 ASN 5 2HB ASN 5 1.101 -12.784 -8.934 38 HD21 ASN 5 1HD2 ASN 5 -0.787 -12.119 -6.007 39 HD22 ASN 5 2HD2 ASN 5 0.159 -10.766 -5.498 40 H LYS 6 H LYS 6 -2.303 -11.325 -7.011 41 HA LYS 6 HA LYS 6 -4.060 -13.635 -6.509 42 HB2 LYS 6 1HB LYS 6 -2.140 -12.718 -4.760 43 HB3 LYS 6 2HB LYS 6 -3.590 -11.898 -4.197 44 HG2 LYS 6 1HG LYS 6 -3.204 -14.866 -4.515 45 HG3 LYS 6 2HG LYS 6 -3.322 -13.963 -3.003 46 HD2 LYS 6 1HD LYS 6 -5.622 -13.201 -4.140 47 HD3 LYS 6 2HD LYS 6 -5.441 -14.783 -4.902 48 HE2 LYS 6 1HE LYS 6 -5.249 -15.833 -2.718 49 HE3 LYS 6 2HE LYS 6 -5.353 -14.258 -1.932 50 HZ1 LYS 6 3HZ LYS 6 -7.580 -14.021 -2.560 51 HZ2 LYS 6 1HZ LYS 6 -7.459 -15.625 -2.037 52 HZ3 LYS 6 2HZ LYS 6 -7.502 -15.277 -3.692 53 H ALA 7 H ALA 7 -3.865 -10.298 -5.282 54 HA ALA 7 HA ALA 7 -5.961 -9.210 -6.741 55 HB1 ALA 7 1HB ALA 7 -7.354 -9.452 -4.278 56 HB2 ALA 7 2HB ALA 7 -7.833 -10.025 -5.877 57 HB3 ALA 7 3HB ALA 7 -6.891 -11.068 -4.812 58 H THR 8 H THR 8 -6.490 -7.087 -6.094 59 HA THR 8 HA THR 8 -5.072 -6.059 -3.738 60 HB THR 8 HB THR 8 -3.863 -4.484 -4.851 61 HG1 THR 8 1HG THR 8 -4.579 -3.468 -6.745 62 HG21 THR 8 3HG2 THR 8 -4.206 -6.142 -7.316 63 HG22 THR 8 1HG2 THR 8 -3.486 -6.858 -5.875 64 HG23 THR 8 2HG2 THR 8 -2.738 -5.449 -6.629 65 H ALA 9 H ALA 9 -5.890 -4.057 -2.918 66 HA ALA 9 HA ALA 9 -8.415 -3.099 -4.021 67 HB1 ALA 9 1HB ALA 9 -8.628 -3.390 -1.141 68 HB2 ALA 9 2HB ALA 9 -9.755 -3.863 -2.412 69 HB3 ALA 9 3HB ALA 9 -8.433 -4.940 -1.961 70 H THR 10 H THR 10 -8.838 -0.968 -3.584 71 HA THR 10 HA THR 10 -6.921 0.445 -1.850 72 HB THR 10 HB THR 10 -6.452 2.068 -3.402 73 HG1 THR 10 1HG THR 10 -8.816 1.379 -4.843 74 HG21 THR 10 3HG2 THR 10 -7.115 0.154 -5.562 75 HG22 THR 10 1HG2 THR 10 -6.076 -0.443 -4.269 76 HG23 THR 10 2HG2 THR 10 -5.597 0.975 -5.202 77 H SER 11 H SER 11 -7.723 2.758 -1.415 78 HA SER 11 HA SER 11 -10.446 2.534 -0.430 79 HB2 SER 11 1HB SER 11 -9.908 4.183 1.090 80 HB3 SER 11 2HB SER 11 -8.304 3.515 0.789 81 HG SER 11 HG SER 11 -9.251 5.995 0.279 82 H SER 12 H SER 12 -8.562 4.633 -2.573 83 HA SER 12 HA SER 12 -11.100 5.706 -3.617 84 HB2 SER 12 1HB SER 12 -8.832 7.092 -2.582 85 HB3 SER 12 2HB SER 12 -8.931 7.424 -4.312 86 HG SER 12 HG SER 12 -11.017 7.756 -2.413 87 H ILE 13 H ILE 13 -11.087 6.296 -5.899 88 HA ILE 13 HA ILE 13 -9.027 5.509 -7.663 89 HB ILE 13 HB ILE 13 -9.828 3.250 -6.912 90 HG12 ILE 13 1HG1 ILE 13 -10.213 3.936 -9.835 91 HG13 ILE 13 2HG1 ILE 13 -8.678 3.569 -9.055 92 HG21 ILE 13 1HG2 ILE 13 -11.982 2.697 -6.928 93 HG22 ILE 13 2HG2 ILE 13 -12.342 4.378 -7.319 94 HG23 ILE 13 3HG2 ILE 13 -12.157 3.193 -8.611 95 HD11 ILE 13 3HD1 ILE 13 -8.977 1.428 -9.494 96 HD12 ILE 13 1HD1 ILE 13 -10.450 1.429 -8.522 97 HD13 ILE 13 2HD1 ILE 13 -10.530 1.794 -10.247 98 H GLU 14 H GLU 14 -9.481 6.026 -9.821 99 HA GLU 14 HA GLU 14 -11.451 8.029 -10.194 100 HB2 GLU 14 1HB GLU 14 -9.620 6.576 -12.097 101 HB3 GLU 14 2HB GLU 14 -10.751 7.807 -12.640 102 HG2 GLU 14 1HG GLU 14 -9.413 8.982 -10.511 103 HG3 GLU 14 2HG GLU 14 -8.168 8.096 -11.390 104 H THR 15 H THR 15 -11.083 4.935 -11.933 105 HA THR 15 HA THR 15 -13.746 4.991 -12.932 106 HB THR 15 HB THR 15 -11.807 3.777 -14.002 107 HG1 THR 15 1HG THR 15 -13.456 2.934 -15.012 108 HG21 THR 15 3HG2 THR 15 -11.327 1.509 -13.243 109 HG22 THR 15 1HG2 THR 15 -12.441 1.710 -11.892 110 HG23 THR 15 2HG2 THR 15 -10.966 2.674 -11.971 111 H ALA 16 H ALA 16 -14.770 2.495 -12.602 112 HA ALA 16 HA ALA 16 -15.650 2.592 -9.822 113 HB1 ALA 16 1HB ALA 16 -17.436 1.069 -10.563 114 HB2 ALA 16 2HB ALA 16 -17.378 2.552 -11.517 115 HB3 ALA 16 3HB ALA 16 -16.729 1.052 -12.179 116 H GLY 17 H GLY 17 -13.088 1.698 -9.937 117 HA2 GLY 17 2HA GLY 17 -11.916 0.001 -8.860 118 HA3 GLY 17 3HA GLY 17 -13.375 -0.978 -8.873 119 H HIS 18 H HIS 18 -10.366 -0.386 -10.344 120 HA HIS 18 HA HIS 18 -10.319 -2.764 -11.780 121 HB2 HIS 18 1HB HIS 18 -11.771 -0.711 -13.133 122 HB3 HIS 18 2HB HIS 18 -10.275 -1.001 -14.015 123 HD1 HIS 18 1HD HIS 18 -13.574 -1.998 -14.210 124 HD2 HIS 18 2HD HIS 18 -10.011 -4.135 -14.103 125 HE1 HIS 18 1HE HIS 18 -14.106 -4.243 -15.212 126 H GLU 19 H GLU 19 -9.190 0.518 -11.422 127 HA GLU 19 HA GLU 19 -6.741 0.248 -12.807 128 HB2 GLU 19 1HB GLU 19 -8.007 2.211 -11.052 129 HB3 GLU 19 2HB GLU 19 -6.264 2.129 -10.837 130 HG2 GLU 19 1HG GLU 19 -6.638 3.785 -12.456 131 HG3 GLU 19 2HG GLU 19 -6.065 2.370 -13.339 132 H GLY 20 H GLY 20 -7.799 -0.779 -9.682 133 HA2 GLY 20 2HA GLY 20 -5.374 -0.915 -8.299 134 HA3 GLY 20 3HA GLY 20 -6.755 -1.966 -8.019 135 H ASP 21 H ASP 21 -6.732 -3.065 -10.717 136 HA ASP 21 HA ASP 21 -4.819 -5.156 -10.264 137 HB2 ASP 21 1HB ASP 21 -6.729 -4.651 -12.554 138 HB3 ASP 21 2HB ASP 21 -5.744 -6.100 -12.383 139 H LYS 22 H LYS 22 -4.534 -2.144 -11.575 140 HA LYS 22 HA LYS 22 -2.833 -2.746 -13.810 141 HB2 LYS 22 1HB LYS 22 -4.275 -0.573 -13.160 142 HB3 LYS 22 2HB LYS 22 -2.712 -0.073 -12.527 143 HG2 LYS 22 1HG LYS 22 -1.757 -0.641 -14.798 144 HG3 LYS 22 2HG LYS 22 -3.426 -0.775 -15.358 145 HD2 LYS 22 1HD LYS 22 -3.228 1.647 -13.920 146 HD3 LYS 22 2HD LYS 22 -1.829 1.570 -14.993 147 HE2 LYS 22 1HE LYS 22 -3.810 0.734 -16.649 148 HE3 LYS 22 2HE LYS 22 -4.687 1.862 -15.618 149 HZ1 LYS 22 3HZ LYS 22 -3.915 3.308 -17.158 150 HZ2 LYS 22 1HZ LYS 22 -2.555 2.375 -17.542 151 HZ3 LYS 22 2HZ LYS 22 -2.563 3.322 -16.141 152 H ALA 23 H ALA 23 -2.385 -2.985 -10.549 153 HA ALA 23 HA ALA 23 0.361 -2.048 -10.476 154 HB1 ALA 23 1HB ALA 23 0.330 -2.636 -8.147 155 HB2 ALA 23 2HB ALA 23 -1.158 -1.771 -8.535 156 HB3 ALA 23 3HB ALA 23 -1.180 -3.524 -8.348 157 H VAL 24 H VAL 24 -0.945 -4.604 -11.885 158 HA VAL 24 HA VAL 24 0.189 -6.917 -10.938 159 HB VAL 24 HB VAL 24 -0.234 -6.026 -13.786 160 HG11 VAL 24 1HG1 VAL 24 1.460 -7.645 -13.994 161 HG12 VAL 24 2HG1 VAL 24 0.760 -8.659 -12.730 162 HG13 VAL 24 3HG1 VAL 24 -0.047 -8.511 -14.292 163 HG21 VAL 24 3HG2 VAL 24 -1.814 -8.248 -12.862 164 HG22 VAL 24 1HG2 VAL 24 -1.979 -6.871 -11.772 165 HG23 VAL 24 2HG2 VAL 24 -2.337 -6.685 -13.489 166 H ASP 25 H ASP 25 1.744 -4.271 -12.606 167 HA ASP 25 HA ASP 25 4.224 -5.731 -12.958 168 HB2 ASP 25 1HB ASP 25 3.047 -3.514 -14.204 169 HB3 ASP 25 2HB ASP 25 4.448 -2.872 -13.352 170 H GLY 26 H GLY 26 2.876 -3.274 -10.837 171 HA2 GLY 26 2HA GLY 26 3.600 -2.466 -8.814 172 HA3 GLY 26 3HA GLY 26 4.671 -3.858 -8.740 173 H ASN 27 H ASN 27 5.090 -1.953 -11.521 174 HA ASN 27 HA ASN 27 7.336 -0.517 -10.270 175 HB2 ASN 27 1HB ASN 27 7.542 -2.591 -12.140 176 HB3 ASN 27 2HB ASN 27 7.816 -1.117 -13.063 177 HD21 ASN 27 1HD2 ASN 27 9.473 -3.442 -11.819 178 HD22 ASN 27 2HD2 ASN 27 10.843 -2.614 -11.166 179 H ALA 28 H ALA 28 8.205 0.916 -12.437 180 HA ALA 28 HA ALA 28 6.444 3.088 -12.499 181 HB1 ALA 28 1HB ALA 28 9.023 2.432 -13.597 182 HB2 ALA 28 2HB ALA 28 8.053 3.327 -14.768 183 HB3 ALA 28 3HB ALA 28 8.353 4.006 -13.168 184 H ALA 29 H ALA 29 6.455 0.192 -14.318 185 HA ALA 29 HA ALA 29 5.199 1.110 -16.685 186 HB1 ALA 29 1HB ALA 29 5.173 -1.064 -17.335 187 HB2 ALA 29 2HB ALA 29 6.351 -1.199 -16.028 188 HB3 ALA 29 3HB ALA 29 4.669 -1.649 -15.750 189 H THR 30 H THR 30 4.065 0.755 -13.513 190 HA THR 30 HA THR 30 1.274 0.476 -14.365 191 HB THR 30 HB THR 30 0.710 -0.025 -12.113 192 HG1 THR 30 1HG THR 30 3.372 0.627 -11.340 193 HG21 THR 30 3HG2 THR 30 1.667 -2.066 -12.006 194 HG22 THR 30 1HG2 THR 30 3.304 -1.413 -12.035 195 HG23 THR 30 2HG2 THR 30 2.402 -1.598 -13.538 196 H ARG 31 H ARG 31 -0.331 1.954 -13.666 197 HA ARG 31 HA ARG 31 0.646 4.537 -12.672 198 HB2 ARG 31 1HB ARG 31 0.391 4.527 -15.194 199 HB3 ARG 31 2HB ARG 31 -1.334 4.307 -14.935 200 HG2 ARG 31 1HG ARG 31 -1.276 6.421 -13.562 201 HG3 ARG 31 2HG ARG 31 0.364 6.663 -14.170 202 HD2 ARG 31 1HD ARG 31 -0.383 7.399 -16.137 203 HD3 ARG 31 2HD ARG 31 -1.491 6.036 -16.302 204 HE ARG 31 HE ARG 31 -2.142 8.682 -15.465 205 HH11 ARG 31 1HH1 ARG 31 -2.991 5.330 -15.063 206 HH12 ARG 31 2HH1 ARG 31 -4.632 5.664 -14.618 207 HH21 ARG 31 1HH2 ARG 31 -4.300 9.134 -14.881 208 HH22 ARG 31 2HH2 ARG 31 -5.376 7.827 -14.517 209 H TRP 32 H TRP 32 -0.272 4.008 -10.660 210 HA TRP 32 HA TRP 32 -3.123 3.475 -10.516 211 HB2 TRP 32 1HB TRP 32 -1.839 2.239 -8.950 212 HB3 TRP 32 2HB TRP 32 -0.937 3.667 -8.448 213 HD1 TRP 32 HD TRP 32 -1.642 4.458 -6.131 214 HE1 TRP 32 1HE TRP 32 -3.818 4.471 -4.757 215 HE3 TRP 32 3HE TRP 32 -4.762 2.254 -9.530 216 HZ2 TRP 32 2HZ TRP 32 -6.502 3.655 -5.072 217 HZ3 TRP 32 3HZ TRP 32 -7.119 1.907 -8.915 218 HH2 TRP 32 HH TRP 32 -7.969 2.593 -6.731 219 H ALA 33 H ALA 33 -4.672 4.904 -9.963 220 HA ALA 33 HA ALA 33 -3.887 7.537 -8.946 221 HB1 ALA 33 1HB ALA 33 -4.911 8.761 -10.613 222 HB2 ALA 33 2HB ALA 33 -4.192 7.433 -11.527 223 HB3 ALA 33 3HB ALA 33 -5.912 7.408 -11.138 224 H SER 34 H SER 34 -4.979 7.805 -7.122 225 HA SER 34 HA SER 34 -7.544 6.474 -6.744 226 HB2 SER 34 1HB SER 34 -5.402 7.435 -5.010 227 HB3 SER 34 2HB SER 34 -7.001 7.893 -4.423 228 HG SER 34 HG SER 34 -6.791 5.913 -3.616 229 H ALA 35 H ALA 35 -9.469 7.512 -6.357 230 HA ALA 35 HA ALA 35 -9.899 9.996 -7.595 231 HB1 ALA 35 1HB ALA 35 -11.550 8.187 -5.898 232 HB2 ALA 35 2HB ALA 35 -12.137 9.814 -6.243 233 HB3 ALA 35 3HB ALA 35 -11.793 8.702 -7.568 234 H TYR 36 H TYR 36 -9.710 12.023 -6.892 235 HA TYR 36 HA TYR 36 -8.468 12.717 -4.513 236 HB2 TYR 36 1HB TYR 36 -9.551 15.032 -4.998 237 HB3 TYR 36 2HB TYR 36 -8.399 14.369 -6.153 238 HD1 TYR 36 1HD TYR 36 -12.033 14.750 -5.481 239 HD2 TYR 36 2HD TYR 36 -9.016 14.022 -8.392 240 HE1 TYR 36 1HE TYR 36 -13.712 14.964 -7.266 241 HE2 TYR 36 2HE TYR 36 -10.686 14.235 -10.184 242 HH TYR 36 HH TYR 36 -13.517 15.647 -9.904 243 H GLY 37 H GLY 37 -9.116 13.050 -2.473 244 HA2 GLY 37 2HA GLY 37 -10.664 13.737 -0.805 245 HA3 GLY 37 3HA GLY 37 -11.978 13.387 -1.918 246 H ALA 38 H ALA 38 -12.619 12.414 0.310 247 HA ALA 38 HA ALA 38 -13.236 10.518 1.413 248 HB1 ALA 38 1HB ALA 38 -13.292 9.708 -1.068 249 HB2 ALA 38 2HB ALA 38 -11.862 8.789 -0.593 250 HB3 ALA 38 3HB ALA 38 -13.391 8.539 0.250 251 H SER 39 H SER 39 -11.334 11.584 2.709 252 HA SER 39 HA SER 39 -9.119 9.675 2.981 253 HB2 SER 39 1HB SER 39 -8.957 12.109 4.598 254 HB3 SER 39 2HB SER 39 -7.781 11.421 3.479 255 HG SER 39 HG SER 39 -9.290 12.275 1.798 256 HA PRO 40 HA PRO 40 -7.415 9.938 4.775 257 HB2 PRO 40 1HB PRO 40 -6.514 7.699 6.018 258 HB3 PRO 40 2HB PRO 40 -6.717 9.245 6.851 259 HG2 PRO 40 1HG PRO 40 -8.529 6.863 6.810 260 HG3 PRO 40 2HG PRO 40 -8.061 7.890 8.179 261 HD2 PRO 40 1HD PRO 40 -10.433 8.158 6.900 262 HD3 PRO 40 2HD PRO 40 -9.578 9.535 7.626 263 H GLN 41 H GLN 41 -5.977 8.484 3.545 264 HA GLN 41 HA GLN 41 -7.556 6.681 1.848 265 HB2 GLN 41 1HB GLN 41 -5.112 8.348 1.377 266 HB3 GLN 41 2HB GLN 41 -5.417 6.944 0.362 267 HG2 GLN 41 1HG GLN 41 -6.415 8.577 -0.872 268 HG3 GLN 41 2HG GLN 41 -7.782 8.029 0.097 269 HE21 GLN 41 1HE2 GLN 41 -5.044 10.223 0.644 270 HE22 GLN 41 2HE2 GLN 41 -6.000 11.554 1.190 271 H TRP 42 H TRP 42 -6.754 4.638 1.260 272 HA TRP 42 HA TRP 42 -4.342 3.633 2.499 273 HB2 TRP 42 1HB TRP 42 -5.246 2.211 4.047 274 HB3 TRP 42 2HB TRP 42 -6.474 3.472 4.096 275 HD1 TRP 42 HD TRP 42 -5.881 -0.059 2.686 276 HE1 TRP 42 1HE TRP 42 -8.169 -1.136 2.210 277 HE3 TRP 42 3HE TRP 42 -8.884 3.968 3.631 278 HZ2 TRP 42 2HZ TRP 42 -10.889 -0.378 2.232 279 HZ3 TRP 42 3HZ TRP 42 -11.318 3.709 3.381 280 HH2 TRP 42 HH TRP 42 -12.298 1.580 2.694 281 H ILE 43 H ILE 43 -3.992 1.293 1.920 282 HA ILE 43 HA ILE 43 -5.492 0.091 -0.161 283 HB ILE 43 HB ILE 43 -4.415 1.962 -1.430 284 HG12 ILE 43 1HG1 ILE 43 -3.645 -0.869 -2.166 285 HG13 ILE 43 2HG1 ILE 43 -5.137 -0.041 -2.595 286 HG21 ILE 43 1HG2 ILE 43 -2.308 2.009 -0.168 287 HG22 ILE 43 2HG2 ILE 43 -1.873 0.447 -0.859 288 HG23 ILE 43 3HG2 ILE 43 -2.038 1.858 -1.905 289 HD11 ILE 43 3HD1 ILE 43 -3.641 1.634 -3.808 290 HD12 ILE 43 1HD1 ILE 43 -2.372 0.421 -3.639 291 HD13 ILE 43 2HD1 ILE 43 -3.847 0.037 -4.527 292 H TYR 44 H TYR 44 -4.979 -2.026 -0.350 293 HA TYR 44 HA TYR 44 -2.424 -2.935 0.789 294 HB2 TYR 44 1HB TYR 44 -3.507 -4.741 1.950 295 HB3 TYR 44 2HB TYR 44 -4.303 -3.241 2.415 296 HD1 TYR 44 2HD TYR 44 -4.632 -6.283 0.340 297 HD2 TYR 44 1HD TYR 44 -6.611 -2.892 1.977 298 HE1 TYR 44 2HE TYR 44 -6.800 -7.241 -0.313 299 HE2 TYR 44 1HE TYR 44 -8.785 -3.841 1.330 300 HH TYR 44 HH TYR 44 -9.799 -5.904 0.765 301 H ILE 45 H ILE 45 -1.606 -4.889 -0.056 302 HA ILE 45 HA ILE 45 -2.898 -5.797 -2.544 303 HB ILE 45 HB ILE 45 0.087 -5.691 -2.142 304 HG12 ILE 45 1HG1 ILE 45 -1.755 -3.671 -3.429 305 HG13 ILE 45 2HG1 ILE 45 -0.650 -3.407 -2.085 306 HG21 ILE 45 1HG2 ILE 45 0.193 -6.049 -4.521 307 HG22 ILE 45 2HG2 ILE 45 -0.819 -7.296 -3.794 308 HG23 ILE 45 3HG2 ILE 45 -1.563 -5.947 -4.652 309 HD11 ILE 45 3HD1 ILE 45 0.257 -2.436 -4.081 310 HD12 ILE 45 1HD1 ILE 45 1.243 -3.820 -3.609 311 HD13 ILE 45 2HD1 ILE 45 0.098 -3.967 -4.942 312 H ASN 46 H ASN 46 -3.179 -7.932 -2.750 313 HA ASN 46 HA ASN 46 -2.180 -9.653 -0.608 314 HB2 ASN 46 1HB ASN 46 -4.055 -10.593 -2.749 315 HB3 ASN 46 2HB ASN 46 -3.944 -11.096 -1.066 316 HD21 ASN 46 1HD2 ASN 46 -6.203 -10.128 -2.734 317 HD22 ASN 46 2HD2 ASN 46 -6.888 -8.817 -1.841 318 H LEU 47 H LEU 47 -0.368 -10.746 -0.927 319 HA LEU 47 HA LEU 47 0.778 -11.076 -3.529 320 HB2 LEU 47 1HB LEU 47 2.071 -10.725 -1.417 321 HB3 LEU 47 2HB LEU 47 1.630 -12.364 -0.942 322 HG LEU 47 HG LEU 47 2.812 -13.171 -3.010 323 HD11 LEU 47 1HD1 LEU 47 4.286 -10.599 -3.100 324 HD12 LEU 47 2HD1 LEU 47 2.722 -10.682 -3.908 325 HD13 LEU 47 3HD1 LEU 47 4.011 -11.795 -4.367 326 HD21 LEU 47 3HD2 LEU 47 3.816 -13.274 -0.774 327 HD22 LEU 47 1HD2 LEU 47 4.477 -11.655 -1.002 328 HD23 LEU 47 2HD2 LEU 47 5.026 -12.983 -2.024 329 H GLY 48 H GLY 48 -0.168 -13.465 -1.043 330 HA2 GLY 48 2HA GLY 48 -1.725 -15.097 -2.635 331 HA3 GLY 48 3HA GLY 48 -0.073 -15.648 -2.876 332 H SER 49 H SER 49 1.099 -15.589 -0.510 333 HA SER 49 HA SER 49 -0.633 -16.746 1.514 334 HB2 SER 49 1HB SER 49 0.705 -18.815 1.700 335 HB3 SER 49 2HB SER 49 -0.089 -18.691 0.130 336 HG SER 49 HG SER 49 2.310 -19.250 0.327 337 H THR 50 H THR 50 0.897 -17.558 3.403 338 HA THR 50 HA THR 50 2.143 -15.319 4.476 339 HB THR 50 HB THR 50 3.396 -17.415 5.770 340 HG1 THR 50 1HG THR 50 2.357 -19.151 5.151 341 HG21 THR 50 3HG2 THR 50 2.400 -16.131 7.313 342 HG22 THR 50 1HG2 THR 50 0.992 -17.167 7.090 343 HG23 THR 50 2HG2 THR 50 1.117 -15.648 6.205 344 H GLN 51 H GLN 51 4.042 -14.380 4.128 345 HA GLN 51 HA GLN 51 6.305 -15.990 3.207 346 HB2 GLN 51 1HB GLN 51 5.036 -13.718 1.746 347 HB3 GLN 51 2HB GLN 51 6.784 -13.889 1.671 348 HG2 GLN 51 1HG GLN 51 4.748 -15.943 0.841 349 HG3 GLN 51 2HG GLN 51 5.753 -14.963 -0.226 350 HE21 GLN 51 1HE2 GLN 51 5.483 -17.859 1.451 351 HE22 GLN 51 2HE2 GLN 51 7.101 -18.426 1.245 352 H SER 52 H SER 52 8.333 -15.167 3.751 353 HA SER 52 HA SER 52 8.336 -13.428 6.044 354 HB2 SER 52 1HB SER 52 9.864 -15.524 5.449 355 HB3 SER 52 2HB SER 52 10.880 -14.274 4.732 356 HG SER 52 HG SER 52 10.175 -14.682 7.412 357 H ILE 53 H ILE 53 8.868 -11.330 6.140 358 HA ILE 53 HA ILE 53 9.899 -10.059 3.687 359 HB ILE 53 HB ILE 53 8.685 -7.979 4.555 360 HG12 ILE 53 1HG1 ILE 53 6.914 -9.978 5.942 361 HG13 ILE 53 2HG1 ILE 53 8.230 -9.182 6.799 362 HG21 ILE 53 1HG2 ILE 53 6.419 -9.461 3.818 363 HG22 ILE 53 2HG2 ILE 53 7.462 -8.492 2.776 364 HG23 ILE 53 3HG2 ILE 53 7.787 -10.211 2.996 365 HD11 ILE 53 3HD1 ILE 53 7.073 -7.300 7.024 366 HD12 ILE 53 1HD1 ILE 53 6.550 -7.318 5.340 367 HD13 ILE 53 2HD1 ILE 53 5.665 -8.250 6.548 368 H SER 54 H SER 54 11.340 -8.324 3.933 369 HA SER 54 HA SER 54 12.528 -8.083 6.620 370 HB2 SER 54 1HB SER 54 14.706 -7.687 5.456 371 HB3 SER 54 2HB SER 54 14.053 -9.305 5.194 372 HG SER 54 HG SER 54 14.688 -8.536 3.219 373 H ARG 55 H ARG 55 12.365 -6.414 3.471 374 HA ARG 55 HA ARG 55 11.656 -3.941 4.812 375 HB2 ARG 55 1HB ARG 55 13.468 -2.676 3.634 376 HB3 ARG 55 2HB ARG 55 14.042 -3.753 4.900 377 HG2 ARG 55 1HG ARG 55 14.007 -5.176 2.432 378 HG3 ARG 55 2HG ARG 55 14.845 -3.640 2.203 379 HD2 ARG 55 1HD ARG 55 16.396 -4.124 3.925 380 HD3 ARG 55 2HD ARG 55 15.440 -5.491 4.497 381 HE ARG 55 HE ARG 55 16.190 -5.958 1.834 382 HH11 ARG 55 1HH1 ARG 55 17.600 -5.736 5.009 383 HH12 ARG 55 2HH1 ARG 55 18.900 -6.824 4.651 384 HH21 ARG 55 1HH2 ARG 55 17.897 -7.390 1.350 385 HH22 ARG 55 2HH2 ARG 55 19.069 -7.762 2.568 386 H VAL 56 H VAL 56 10.241 -2.813 3.630 387 HA VAL 56 HA VAL 56 10.043 -3.421 0.752 388 HB VAL 56 HB VAL 56 7.635 -3.139 0.873 389 HG11 VAL 56 1HG1 VAL 56 8.451 -5.379 1.182 390 HG12 VAL 56 2HG1 VAL 56 8.716 -5.089 2.902 391 HG13 VAL 56 3HG1 VAL 56 7.075 -5.123 2.255 392 HG21 VAL 56 3HG2 VAL 56 6.718 -3.156 3.346 393 HG22 VAL 56 1HG2 VAL 56 8.247 -2.341 3.672 394 HG23 VAL 56 2HG2 VAL 56 7.104 -1.644 2.524 395 H LYS 57 H LYS 57 9.978 -1.734 -0.615 396 HA LYS 57 HA LYS 57 9.807 0.963 0.561 397 HB2 LYS 57 1HB LYS 57 11.324 1.746 -1.147 398 HB3 LYS 57 2HB LYS 57 12.051 0.371 -0.326 399 HG2 LYS 57 1HG LYS 57 10.978 -0.982 -2.295 400 HG3 LYS 57 2HG LYS 57 11.007 0.587 -3.104 401 HD2 LYS 57 1HD LYS 57 13.369 0.756 -2.868 402 HD3 LYS 57 2HD LYS 57 13.423 -0.630 -1.776 403 HE2 LYS 57 1HE LYS 57 14.191 -1.291 -3.970 404 HE3 LYS 57 2HE LYS 57 12.651 -2.074 -3.620 405 HZ1 LYS 57 3HZ LYS 57 13.176 0.193 -5.445 406 HZ2 LYS 57 1HZ LYS 57 11.617 -0.162 -4.891 407 HZ3 LYS 57 2HZ LYS 57 12.471 -1.302 -5.803 408 H LEU 58 H LEU 58 8.394 2.389 -0.292 409 HA LEU 58 HA LEU 58 7.073 1.725 -2.824 410 HB2 LEU 58 1HB LEU 58 4.919 1.928 -1.981 411 HB3 LEU 58 2HB LEU 58 5.762 0.977 -0.760 412 HG LEU 58 HG LEU 58 5.611 3.921 -0.371 413 HD11 LEU 58 1HD1 LEU 58 3.378 3.120 0.923 414 HD12 LEU 58 2HD1 LEU 58 3.284 2.133 -0.535 415 HD13 LEU 58 3HD1 LEU 58 3.384 3.890 -0.664 416 HD21 LEU 58 3HD2 LEU 58 6.450 3.288 1.581 417 HD22 LEU 58 1HD2 LEU 58 6.297 1.589 1.131 418 HD23 LEU 58 2HD2 LEU 58 4.954 2.417 1.920 419 H ASN 59 H ASN 59 5.929 3.551 -3.789 420 HA ASN 59 HA ASN 59 7.208 6.099 -3.061 421 HB2 ASN 59 1HB ASN 59 7.858 5.752 -5.247 422 HB3 ASN 59 2HB ASN 59 6.380 4.888 -5.663 423 HD21 ASN 59 1HD2 ASN 59 4.502 6.075 -6.130 424 HD22 ASN 59 2HD2 ASN 59 4.583 7.735 -6.600 425 H TRP 60 H TRP 60 5.980 8.027 -3.098 426 HA TRP 60 HA TRP 60 3.107 7.578 -2.647 427 HB2 TRP 60 1HB TRP 60 4.538 10.065 -1.778 428 HB3 TRP 60 2HB TRP 60 3.103 9.309 -1.091 429 HD1 TRP 60 HD TRP 60 6.808 9.504 -0.673 430 HE1 TRP 60 1HE TRP 60 7.565 7.917 1.206 431 HE3 TRP 60 3HE TRP 60 2.477 6.861 -0.048 432 HZ2 TRP 60 2HZ TRP 60 6.472 5.822 2.749 433 HZ3 TRP 60 3HZ TRP 60 2.416 5.082 1.651 434 HH2 TRP 60 HH TRP 60 4.373 4.575 3.019 435 H GLU 61 H GLU 61 5.364 9.039 -4.731 436 HA GLU 61 HA GLU 61 5.136 10.275 -6.627 437 HB2 GLU 61 1HB GLU 61 2.835 8.769 -6.508 438 HB3 GLU 61 2HB GLU 61 2.209 10.405 -6.653 439 HG2 GLU 61 1HG GLU 61 2.499 9.249 -8.817 440 HG3 GLU 61 2HG GLU 61 3.403 10.757 -8.690 441 H ASP 62 H ASP 62 3.243 12.169 -7.391 442 HA ASP 62 HA ASP 62 4.076 14.464 -6.146 443 HB2 ASP 62 1HB ASP 62 2.053 13.756 -8.059 444 HB3 ASP 62 2HB ASP 62 1.411 14.963 -6.948 445 H ALA 63 H ALA 63 1.457 12.327 -5.214 446 HA ALA 63 HA ALA 63 0.157 13.977 -3.365 447 HB1 ALA 63 1HB ALA 63 -0.130 11.467 -2.305 448 HB2 ALA 63 2HB ALA 63 -1.145 12.170 -3.566 449 HB3 ALA 63 3HB ALA 63 0.211 11.129 -4.003 450 H TYR 64 H TYR 64 1.545 15.120 -2.057 451 HA TYR 64 HA TYR 64 3.564 13.739 -0.504 452 HB2 TYR 64 1HB TYR 64 4.060 15.960 -1.401 453 HB3 TYR 64 2HB TYR 64 2.708 16.641 -0.503 454 HD1 TYR 64 2HD TYR 64 2.802 16.653 2.012 455 HD2 TYR 64 1HD TYR 64 6.174 15.670 -0.388 456 HE1 TYR 64 2HE TYR 64 4.282 17.072 3.931 457 HE2 TYR 64 1HE TYR 64 7.664 16.085 1.524 458 HH TYR 64 HH TYR 64 7.719 17.214 3.604 459 H ALA 65 H ALA 65 3.088 12.738 1.325 460 HA ALA 65 HA ALA 65 0.776 13.663 2.893 461 HB1 ALA 65 1HB ALA 65 0.877 11.394 3.940 462 HB2 ALA 65 2HB ALA 65 0.512 11.391 2.214 463 HB3 ALA 65 3HB ALA 65 2.132 10.976 2.774 464 H THR 66 H THR 66 0.943 13.885 5.147 465 HA THR 66 HA THR 66 3.500 14.833 6.047 466 HB THR 66 HB THR 66 1.170 15.762 6.676 467 HG1 THR 66 1HG THR 66 3.382 15.379 8.384 468 HG21 THR 66 3HG2 THR 66 0.684 13.285 7.599 469 HG22 THR 66 1HG2 THR 66 -0.104 14.725 8.243 470 HG23 THR 66 2HG2 THR 66 1.290 14.035 9.075 471 H ALA 67 H ALA 67 1.826 11.853 6.168 472 HA ALA 67 HA ALA 67 3.984 10.483 7.351 473 HB1 ALA 67 1HB ALA 67 3.301 11.489 9.421 474 HB2 ALA 67 2HB ALA 67 1.630 10.986 9.166 475 HB3 ALA 67 3HB ALA 67 2.879 9.776 9.462 476 H TYR 68 H TYR 68 3.692 8.218 7.363 477 HA TYR 68 HA TYR 68 1.133 7.225 6.333 478 HB2 TYR 68 1HB TYR 68 2.624 5.688 4.832 479 HB3 TYR 68 2HB TYR 68 2.248 7.324 4.302 480 HD1 TYR 68 1HD TYR 68 4.867 5.257 5.924 481 HD2 TYR 68 2HD TYR 68 3.964 8.880 3.885 482 HE1 TYR 68 1HE TYR 68 7.271 5.736 5.723 483 HE2 TYR 68 2HE TYR 68 6.366 9.369 3.678 484 HH TYR 68 HH TYR 68 8.430 8.782 4.365 485 H SER 69 H SER 69 1.170 4.743 6.293 486 HA SER 69 HA SER 69 2.825 3.616 8.425 487 HB2 SER 69 1HB SER 69 -0.167 3.833 8.449 488 HB3 SER 69 2HB SER 69 0.618 2.464 9.235 489 HG SER 69 HG SER 69 0.191 4.586 10.435 490 H ILE 70 H ILE 70 3.335 1.497 8.144 491 HA ILE 70 HA ILE 70 2.088 0.114 5.859 492 HB ILE 70 HB ILE 70 4.499 0.940 5.538 493 HG12 ILE 70 1HG1 ILE 70 3.164 -0.983 4.336 494 HG13 ILE 70 2HG1 ILE 70 4.889 -0.779 4.042 495 HG21 ILE 70 1HG2 ILE 70 6.253 -0.446 6.463 496 HG22 ILE 70 2HG2 ILE 70 5.291 0.249 7.766 497 HG23 ILE 70 3HG2 ILE 70 5.062 -1.438 7.304 498 HD11 ILE 70 3HD1 ILE 70 3.792 -2.679 6.091 499 HD12 ILE 70 1HD1 ILE 70 4.104 -3.132 4.416 500 HD13 ILE 70 2HD1 ILE 70 5.432 -2.598 5.446 501 H GLN 71 H GLN 71 1.245 -1.820 6.289 502 HA GLN 71 HA GLN 71 2.323 -3.471 8.421 503 HB2 GLN 71 1HB GLN 71 -0.290 -3.747 9.051 504 HB3 GLN 71 2HB GLN 71 0.805 -2.653 9.886 505 HG2 GLN 71 1HG GLN 71 0.035 -0.793 8.598 506 HG3 GLN 71 2HG GLN 71 -0.922 -1.849 7.560 507 HE21 GLN 71 1HE2 GLN 71 -2.428 -0.028 8.405 508 HE22 GLN 71 2HE2 GLN 71 -3.375 -0.451 9.786 509 H VAL 72 H VAL 72 0.489 -5.428 8.587 510 HA VAL 72 HA VAL 72 -0.080 -6.265 5.827 511 HB VAL 72 HB VAL 72 0.786 -8.473 6.200 512 HG11 VAL 72 1HG1 VAL 72 2.355 -6.196 6.022 513 HG12 VAL 72 2HG1 VAL 72 3.139 -7.165 7.270 514 HG13 VAL 72 3HG1 VAL 72 2.857 -7.848 5.668 515 HG21 VAL 72 3HG2 VAL 72 2.056 -7.908 8.789 516 HG22 VAL 72 1HG2 VAL 72 0.299 -8.061 8.833 517 HG23 VAL 72 2HG2 VAL 72 1.285 -9.379 8.199 518 H SER 73 H SER 73 -0.986 -8.839 6.471 519 HA SER 73 HA SER 73 -3.256 -8.315 8.271 520 HB2 SER 73 1HB SER 73 -3.580 -9.937 5.757 521 HB3 SER 73 2HB SER 73 -4.822 -9.165 6.742 522 HG SER 73 HG SER 73 -3.756 -8.196 4.595 523 H ASN 74 H ASN 74 -3.565 -9.834 9.763 524 HA ASN 74 HA ASN 74 -3.371 -12.584 9.417 525 HB2 ASN 74 1HB ASN 74 -0.807 -11.279 9.862 526 HB3 ASN 74 2HB ASN 74 -1.161 -12.475 11.105 527 HD21 ASN 74 1HD2 ASN 74 -2.493 -14.396 9.773 528 HD22 ASN 74 2HD2 ASN 74 -1.490 -15.095 8.552 529 H ASP 75 H ASP 75 -3.585 -13.784 11.434 530 HA ASP 75 HA ASP 75 -3.708 -12.582 13.964 531 HB2 ASP 75 1HB ASP 75 -5.735 -11.573 12.570 532 HB3 ASP 75 2HB ASP 75 -6.502 -13.083 13.050 533 H SER 76 H SER 76 -5.263 -14.990 11.874 534 HA SER 76 HA SER 76 -5.057 -16.935 14.075 535 HB2 SER 76 1HB SER 76 -7.350 -16.617 13.312 536 HB3 SER 76 2HB SER 76 -6.867 -16.944 11.648 537 HG SER 76 HG SER 76 -7.809 -18.755 12.837 538 H GLY 77 H GLY 77 -3.413 -15.976 11.440 539 HA2 GLY 77 2HA GLY 77 -1.503 -17.081 10.607 540 HA3 GLY 77 3HA GLY 77 -2.193 -18.613 11.124 541 H SER 78 H SER 78 -4.725 -18.381 9.919 542 HA SER 78 HA SER 78 -3.986 -18.459 7.066 543 HB2 SER 78 1HB SER 78 -5.027 -20.516 8.685 544 HB3 SER 78 2HB SER 78 -6.354 -20.000 7.645 545 HG SER 78 HG SER 78 -3.998 -21.285 7.005 546 H THR 79 H THR 79 -6.137 -17.229 9.452 547 HA THR 79 HA THR 79 -7.833 -16.046 7.353 548 HB THR 79 HB THR 79 -8.626 -16.204 10.250 549 HG1 THR 79 1HG THR 79 -9.368 -18.134 8.305 550 HG21 THR 79 3HG2 THR 79 -10.377 -15.076 9.451 551 HG22 THR 79 1HG2 THR 79 -10.814 -16.520 8.539 552 HG23 THR 79 2HG2 THR 79 -9.817 -15.272 7.790 553 HA PRO 80 HA PRO 80 -5.351 -12.585 9.198 554 HB2 PRO 80 1HB PRO 80 -4.829 -11.384 6.818 555 HB3 PRO 80 2HB PRO 80 -3.824 -12.678 7.483 556 HG2 PRO 80 1HG PRO 80 -5.971 -12.827 5.402 557 HG3 PRO 80 2HG PRO 80 -4.381 -13.614 5.429 558 HD2 PRO 80 1HD PRO 80 -6.662 -14.915 6.091 559 HD3 PRO 80 2HD PRO 80 -5.095 -15.293 6.836 560 H THR 81 H THR 81 -6.080 -10.534 9.606 561 HA THR 81 HA THR 81 -8.220 -9.386 8.016 562 HB THR 81 HB THR 81 -9.700 -9.026 9.966 563 HG1 THR 81 1HG THR 81 -9.210 -10.563 11.780 564 HG21 THR 81 3HG2 THR 81 -10.006 -10.952 8.397 565 HG22 THR 81 1HG2 THR 81 -10.662 -11.224 10.011 566 HG23 THR 81 2HG2 THR 81 -9.127 -11.959 9.548 567 H ASN 82 H ASN 82 -6.687 -9.013 11.220 568 HA ASN 82 HA ASN 82 -6.187 -6.191 10.536 569 HB2 ASN 82 1HB ASN 82 -7.035 -7.515 13.071 570 HB3 ASN 82 2HB ASN 82 -5.995 -6.098 13.187 571 HD21 ASN 82 1HD2 ASN 82 -9.140 -7.218 12.830 572 HD22 ASN 82 2HD2 ASN 82 -9.904 -5.715 12.452 573 H TRP 83 H TRP 83 -4.351 -5.344 12.140 574 HA TRP 83 HA TRP 83 -2.266 -7.070 12.877 575 HB2 TRP 83 1HB TRP 83 -2.256 -7.236 10.297 576 HB3 TRP 83 2HB TRP 83 -1.582 -5.609 10.338 577 HD1 TRP 83 HD TRP 83 0.971 -5.511 10.407 578 HE1 TRP 83 1HE TRP 83 2.864 -7.132 11.050 579 HE3 TRP 83 3HE TRP 83 -1.850 -9.422 12.103 580 HZ2 TRP 83 2HZ TRP 83 3.127 -9.726 12.132 581 HZ3 TRP 83 3HZ TRP 83 -0.701 -11.437 12.924 582 HH2 TRP 83 HH TRP 83 1.736 -11.583 12.937 583 H THR 84 H THR 84 -0.165 -5.820 13.217 584 HA THR 84 HA THR 84 -0.870 -3.144 14.193 585 HB THR 84 HB THR 84 1.742 -3.994 15.044 586 HG1 THR 84 1HG THR 84 -0.395 -5.823 15.516 587 HG21 THR 84 3HG2 THR 84 -0.831 -3.125 16.230 588 HG22 THR 84 1HG2 THR 84 0.802 -2.519 16.502 589 HG23 THR 84 2HG2 THR 84 0.273 -4.009 17.284 590 H THR 85 H THR 85 0.109 -1.341 13.465 591 HA THR 85 HA THR 85 1.333 -1.204 11.005 592 HB THR 85 HB THR 85 2.198 1.046 11.726 593 HG1 THR 85 1HG THR 85 0.863 0.434 14.167 594 HG21 THR 85 3HG2 THR 85 -0.670 0.683 12.553 595 HG22 THR 85 1HG2 THR 85 -0.161 0.532 10.873 596 HG23 THR 85 2HG2 THR 85 0.074 2.054 11.731 597 H VAL 86 H VAL 86 3.532 -0.607 10.408 598 HA VAL 86 HA VAL 86 5.531 -1.876 12.166 599 HB VAL 86 HB VAL 86 5.740 -1.636 9.166 600 HG11 VAL 86 1HG1 VAL 86 7.878 -2.031 9.851 601 HG12 VAL 86 2HG1 VAL 86 7.372 -2.857 11.327 602 HG13 VAL 86 3HG1 VAL 86 7.294 -3.694 9.775 603 HG21 VAL 86 3HG2 VAL 86 4.228 -3.258 8.980 604 HG22 VAL 86 1HG2 VAL 86 5.342 -4.318 9.845 605 HG23 VAL 86 2HG2 VAL 86 4.110 -3.421 10.733 606 H TYR 87 H TYR 87 4.564 0.992 10.634 607 HA TYR 87 HA TYR 87 6.856 2.401 11.656 608 HB2 TYR 87 1HB TYR 87 7.579 1.541 9.388 609 HB3 TYR 87 2HB TYR 87 6.337 2.572 8.685 610 HD1 TYR 87 1HD TYR 87 8.653 3.277 11.517 611 HD2 TYR 87 2HD TYR 87 7.521 4.210 7.523 612 HE1 TYR 87 1HE TYR 87 10.228 5.165 11.518 613 HE2 TYR 87 2HE TYR 87 9.094 6.101 7.512 614 HH TYR 87 HH TYR 87 10.921 6.981 8.613 615 H SER 88 H SER 88 6.541 4.650 11.772 616 HA SER 88 HA SER 88 4.457 6.084 10.590 617 HB2 SER 88 1HB SER 88 2.987 6.328 12.656 618 HB3 SER 88 2HB SER 88 2.862 4.794 11.794 619 HG SER 88 HG SER 88 3.360 5.094 14.316 620 H THR 89 H THR 89 5.080 8.130 10.713 621 HA THR 89 HA THR 89 5.760 9.497 13.059 622 HB THR 89 HB THR 89 7.816 7.978 12.747 623 HG1 THR 89 1HG THR 89 9.112 9.635 13.559 624 HG21 THR 89 3HG2 THR 89 8.993 10.005 10.977 625 HG22 THR 89 1HG2 THR 89 7.798 8.964 10.204 626 HG23 THR 89 2HG2 THR 89 9.206 8.254 10.995 627 H THR 90 H THR 90 7.477 11.440 12.164 628 HA THR 90 HA THR 90 5.814 12.769 10.174 629 HB THR 90 HB THR 90 7.105 14.799 10.748 630 HG1 THR 90 1HG THR 90 9.066 14.195 11.432 631 HG21 THR 90 3HG2 THR 90 5.175 13.568 12.240 632 HG22 THR 90 1HG2 THR 90 5.784 15.198 12.526 633 HG23 THR 90 2HG2 THR 90 6.440 13.838 13.439 634 H THR 91 H THR 91 7.291 10.690 9.092 635 HA THR 91 HA THR 91 9.502 12.017 7.679 636 HB THR 91 HB THR 91 10.122 9.916 8.756 637 HG1 THR 91 1HG THR 91 11.042 8.971 6.917 638 HG21 THR 91 3HG2 THR 91 7.590 9.067 8.055 639 HG22 THR 91 1HG2 THR 91 8.873 8.057 8.720 640 HG23 THR 91 2HG2 THR 91 8.640 8.151 6.974 641 H GLY 92 H GLY 92 7.400 13.071 6.665 642 HA2 GLY 92 2HA GLY 92 5.841 11.679 4.813 643 HA3 GLY 92 3HA GLY 92 6.202 13.397 4.735 644 H ASP 93 H ASP 93 7.488 14.125 3.149 645 HA ASP 93 HA ASP 93 8.832 14.152 1.313 646 HB2 ASP 93 1HB ASP 93 10.234 12.695 3.044 647 HB3 ASP 93 2HB ASP 93 9.913 11.429 1.863 648 H GLY 94 H GLY 94 7.205 14.039 -0.211 649 HA2 GLY 94 2HA GLY 94 5.679 11.878 -0.964 650 HA3 GLY 94 3HA GLY 94 6.167 13.158 -2.064 651 H ALA 95 H ALA 95 9.046 12.418 -1.599 652 HA ALA 95 HA ALA 95 9.407 10.791 -3.843 653 HB1 ALA 95 1HB ALA 95 11.114 12.323 -2.949 654 HB2 ALA 95 2HB ALA 95 11.354 11.234 -1.583 655 HB3 ALA 95 3HB ALA 95 11.742 10.697 -3.217 656 H ILE 96 H ILE 96 10.526 8.666 -3.883 657 HA ILE 96 HA ILE 96 9.024 6.685 -2.635 658 HB ILE 96 HB ILE 96 11.851 6.316 -3.617 659 HG12 ILE 96 1HG1 ILE 96 10.179 5.558 -5.675 660 HG13 ILE 96 2HG1 ILE 96 9.401 7.014 -5.063 661 HG21 ILE 96 1HG2 ILE 96 9.528 4.498 -3.121 662 HG22 ILE 96 2HG2 ILE 96 10.771 4.067 -4.295 663 HG23 ILE 96 3HG2 ILE 96 11.207 4.331 -2.607 664 HD11 ILE 96 3HD1 ILE 96 10.836 8.225 -6.220 665 HD12 ILE 96 1HD1 ILE 96 12.152 7.576 -5.240 666 HD13 ILE 96 2HD1 ILE 96 11.686 6.769 -6.738 667 H ASP 97 H ASP 97 9.067 5.781 -0.683 668 HA ASP 97 HA ASP 97 11.412 6.281 1.031 669 HB2 ASP 97 1HB ASP 97 8.475 6.311 1.629 670 HB3 ASP 97 2HB ASP 97 9.620 5.904 2.905 671 H ASP 98 H ASP 98 12.489 4.549 1.694 672 HA ASP 98 HA ASP 98 11.292 1.909 1.283 673 HB2 ASP 98 1HB ASP 98 13.390 2.009 0.231 674 HB3 ASP 98 2HB ASP 98 14.123 2.880 1.575 675 H ILE 99 H ILE 99 10.361 0.967 2.964 676 HA ILE 99 HA ILE 99 11.242 1.676 5.671 677 HB ILE 99 HB ILE 99 8.736 0.220 4.820 678 HG12 ILE 99 1HG1 ILE 99 9.145 3.096 5.666 679 HG13 ILE 99 2HG1 ILE 99 8.743 2.545 4.044 680 HG21 ILE 99 1HG2 ILE 99 8.638 1.477 7.401 681 HG22 ILE 99 2HG2 ILE 99 8.360 -0.208 6.966 682 HG23 ILE 99 3HG2 ILE 99 9.995 0.355 7.314 683 HD11 ILE 99 3HD1 ILE 99 6.648 1.545 5.086 684 HD12 ILE 99 1HD1 ILE 99 7.031 2.527 6.500 685 HD13 ILE 99 2HD1 ILE 99 6.730 3.301 4.944 686 H THR 100 H THR 100 12.574 0.331 6.667 687 HA THR 100 HA THR 100 12.545 -2.515 5.911 688 HB THR 100 HB THR 100 14.833 -2.682 6.532 689 HG1 THR 100 1HG THR 100 15.314 -1.504 8.238 690 HG21 THR 100 3HG2 THR 100 13.973 -0.923 4.538 691 HG22 THR 100 1HG2 THR 100 15.552 -1.697 4.663 692 HG23 THR 100 2HG2 THR 100 15.301 -0.091 5.347 693 H PHE 101 H PHE 101 12.284 -4.068 7.438 694 HA PHE 101 HA PHE 101 12.273 -3.310 10.259 695 HB2 PHE 101 1HB PHE 101 10.072 -4.909 10.206 696 HB3 PHE 101 2HB PHE 101 10.017 -3.149 10.194 697 HD1 PHE 101 1HD PHE 101 9.779 -6.174 8.117 698 HD2 PHE 101 2HD PHE 101 9.312 -1.946 8.267 699 HE1 PHE 101 1HE PHE 101 8.595 -6.232 5.961 700 HE2 PHE 101 2HE PHE 101 8.127 -1.997 6.111 701 HZ PHE 101 HZ PHE 101 7.766 -4.142 4.956 702 H ALA 102 H ALA 102 11.494 -5.532 11.474 703 HA ALA 102 HA ALA 102 13.643 -7.353 10.955 704 HB1 ALA 102 1HB ALA 102 12.978 -8.476 12.935 705 HB2 ALA 102 2HB ALA 102 12.764 -6.750 13.233 706 HB3 ALA 102 3HB ALA 102 11.365 -7.764 12.876 707 H ALA 103 H ALA 103 13.386 -9.659 10.630 708 HA ALA 103 HA ALA 103 11.761 -10.288 8.435 709 HB1 ALA 103 1HB ALA 103 13.608 -11.736 10.197 710 HB2 ALA 103 2HB ALA 103 12.366 -12.734 9.441 711 HB3 ALA 103 3HB ALA 103 13.450 -11.768 8.440 712 H THR 104 H THR 104 9.625 -10.475 8.414 713 HA THR 104 HA THR 104 8.317 -11.983 10.564 714 HB THR 104 HB THR 104 7.932 -9.661 11.140 715 HG1 THR 104 1HG THR 104 5.496 -10.383 9.936 716 HG21 THR 104 3HG2 THR 104 6.634 -9.296 8.444 717 HG22 THR 104 1HG2 THR 104 8.290 -8.805 8.792 718 HG23 THR 104 2HG2 THR 104 6.949 -8.067 9.669 719 H ASN 105 H ASN 105 6.537 -13.181 9.945 720 HA ASN 105 HA ASN 105 6.317 -13.677 7.097 721 HB2 ASN 105 1HB ASN 105 4.649 -15.467 7.974 722 HB3 ASN 105 2HB ASN 105 6.368 -15.682 8.292 723 HD21 ASN 105 1HD2 ASN 105 7.160 -15.319 10.381 724 HD22 ASN 105 2HD2 ASN 105 6.115 -15.321 11.756 725 H ALA 106 H ALA 106 4.674 -13.083 5.813 726 HA ALA 106 HA ALA 106 2.091 -12.365 6.877 727 HB1 ALA 106 1HB ALA 106 2.884 -10.245 7.274 728 HB2 ALA 106 2HB ALA 106 4.016 -10.296 5.921 729 HB3 ALA 106 3HB ALA 106 2.291 -10.080 5.621 730 H LYS 107 H LYS 107 0.478 -12.214 5.285 731 HA LYS 107 HA LYS 107 1.225 -13.464 2.750 732 HB2 LYS 107 1HB LYS 107 -1.445 -13.406 2.615 733 HB3 LYS 107 2HB LYS 107 -0.569 -14.666 3.476 734 HG2 LYS 107 1HG LYS 107 -1.334 -12.215 4.971 735 HG3 LYS 107 2HG LYS 107 -2.592 -13.387 4.572 736 HD2 LYS 107 1HD LYS 107 -0.020 -14.021 6.019 737 HD3 LYS 107 2HD LYS 107 -1.590 -13.787 6.791 738 HE2 LYS 107 1HE LYS 107 -0.733 -15.981 4.924 739 HE3 LYS 107 2HE LYS 107 -1.311 -16.121 6.584 740 HZ1 LYS 107 3HZ LYS 107 -3.049 -16.772 5.103 741 HZ2 LYS 107 1HZ LYS 107 -2.907 -15.346 4.204 742 HZ3 LYS 107 2HZ LYS 107 -3.485 -15.290 5.792 743 H PHE 108 H PHE 108 -0.967 -10.850 3.805 744 HA PHE 108 HA PHE 108 -0.384 -9.480 1.261 745 HB2 PHE 108 1HB PHE 108 -2.880 -8.989 2.859 746 HB3 PHE 108 2HB PHE 108 -2.585 -8.688 1.149 747 HD1 PHE 108 1HD PHE 108 -1.337 -11.407 0.548 748 HD2 PHE 108 2HD PHE 108 -4.866 -10.256 2.633 749 HE1 PHE 108 1HE PHE 108 -2.370 -13.569 -0.011 750 HE2 PHE 108 2HE PHE 108 -5.903 -12.416 2.078 751 HZ PHE 108 HZ PHE 108 -4.655 -14.077 0.755 752 H VAL 109 H VAL 109 -0.127 -7.224 1.293 753 HA VAL 109 HA VAL 109 0.546 -6.138 3.946 754 HB VAL 109 HB VAL 109 1.599 -5.273 1.249 755 HG11 VAL 109 1HG1 VAL 109 2.487 -4.444 4.008 756 HG12 VAL 109 2HG1 VAL 109 3.109 -3.850 2.467 757 HG13 VAL 109 3HG1 VAL 109 1.455 -3.476 2.955 758 HG21 VAL 109 3HG2 VAL 109 3.770 -6.188 2.276 759 HG22 VAL 109 1HG2 VAL 109 2.712 -7.056 3.387 760 HG23 VAL 109 2HG2 VAL 109 2.596 -7.346 1.651 761 H ARG 110 H ARG 110 -0.271 -4.198 4.598 762 HA ARG 110 HA ARG 110 -2.049 -2.776 2.736 763 HB2 ARG 110 1HB ARG 110 -3.760 -2.568 4.354 764 HB3 ARG 110 2HB ARG 110 -3.279 -4.259 4.393 765 HG2 ARG 110 1HG ARG 110 -1.773 -3.624 6.340 766 HG3 ARG 110 2HG ARG 110 -2.661 -2.100 6.381 767 HD2 ARG 110 1HD ARG 110 -4.529 -4.246 6.220 768 HD3 ARG 110 2HD ARG 110 -3.384 -4.592 7.515 769 HE ARG 110 HE ARG 110 -4.116 -1.979 7.891 770 HH11 ARG 110 1HH1 ARG 110 -5.781 -5.030 7.688 771 HH12 ARG 110 2HH1 ARG 110 -7.065 -4.548 8.747 772 HH21 ARG 110 1HH2 ARG 110 -5.801 -1.333 9.287 773 HH22 ARG 110 2HH2 ARG 110 -7.076 -2.445 9.655 774 H VAL 111 H VAL 111 -1.868 -0.606 2.740 775 HA VAL 111 HA VAL 111 -0.173 0.612 4.824 776 HB VAL 111 HB VAL 111 0.435 2.311 3.045 777 HG11 VAL 111 1HG1 VAL 111 2.332 1.162 3.080 778 HG12 VAL 111 2HG1 VAL 111 1.462 -0.294 3.566 779 HG13 VAL 111 3HG1 VAL 111 1.687 0.071 1.855 780 HG21 VAL 111 3HG2 VAL 111 -0.043 1.979 0.821 781 HG22 VAL 111 1HG2 VAL 111 -0.269 0.241 1.018 782 HG23 VAL 111 2HG2 VAL 111 -1.517 1.361 1.567 783 H TYR 112 H TYR 112 -0.908 2.411 5.814 784 HA TYR 112 HA TYR 112 -3.333 3.689 4.747 785 HB2 TYR 112 1HB TYR 112 -2.821 2.743 7.562 786 HB3 TYR 112 2HB TYR 112 -4.030 3.968 7.194 787 HD1 TYR 112 2HD TYR 112 -3.021 0.574 5.984 788 HD2 TYR 112 1HD TYR 112 -6.198 3.242 6.929 789 HE1 TYR 112 2HE TYR 112 -4.652 -1.196 5.475 790 HE2 TYR 112 1HE TYR 112 -7.837 1.479 6.422 791 HH TYR 112 HH TYR 112 -7.673 -1.247 6.449 792 H ALA 113 H ALA 113 -3.562 5.893 5.168 793 HA ALA 113 HA ALA 113 -1.214 7.218 6.358 794 HB1 ALA 113 1HB ALA 113 -2.594 8.687 4.218 795 HB2 ALA 113 2HB ALA 113 -0.871 8.528 4.563 796 HB3 ALA 113 3HB ALA 113 -1.720 7.246 3.700 797 H THR 114 H THR 114 -2.121 7.766 8.291 798 HA THR 114 HA THR 114 -4.676 8.499 8.902 799 HB THR 114 HB THR 114 -3.166 8.259 10.705 800 HG1 THR 114 1HG THR 114 -4.187 9.794 11.728 801 HG21 THR 114 3HG2 THR 114 -1.569 10.474 9.423 802 HG22 THR 114 1HG2 THR 114 -1.080 8.796 9.654 803 HG23 THR 114 2HG2 THR 114 -1.269 9.859 11.048 804 H THR 115 H THR 115 -2.186 10.489 7.423 805 HA THR 115 HA THR 115 -4.114 12.708 7.236 806 HB THR 115 HB THR 115 -1.135 12.935 6.813 807 HG1 THR 115 1HG THR 115 -1.253 12.387 8.927 808 HG21 THR 115 3HG2 THR 115 -2.174 15.312 7.801 809 HG22 THR 115 1HG2 THR 115 -3.404 14.743 6.672 810 HG23 THR 115 2HG2 THR 115 -1.744 14.974 6.125 811 H ARG 116 H ARG 116 -4.557 13.642 5.267 812 HA ARG 116 HA ARG 116 -4.430 12.029 2.981 813 HB2 ARG 116 1HB ARG 116 -4.779 15.025 2.954 814 HB3 ARG 116 2HB ARG 116 -5.405 13.856 1.799 815 HG2 ARG 116 1HG ARG 116 -7.309 14.025 2.941 816 HG3 ARG 116 2HG ARG 116 -6.519 12.995 4.139 817 HD2 ARG 116 1HD ARG 116 -5.595 15.476 4.816 818 HD3 ARG 116 2HD ARG 116 -7.231 15.832 4.263 819 HE ARG 116 HE ARG 116 -7.246 13.627 6.034 820 HH11 ARG 116 1HH1 ARG 116 -6.893 17.090 5.974 821 HH12 ARG 116 2HH1 ARG 116 -7.489 17.309 7.586 822 HH21 ARG 116 1HH2 ARG 116 -8.032 13.903 8.158 823 HH22 ARG 116 2HH2 ARG 116 -8.136 15.495 8.827 824 H ALA 117 H ALA 117 -3.660 13.554 0.861 825 HA ALA 117 HA ALA 117 -0.772 13.952 1.306 826 HB1 ALA 117 1HB ALA 117 -2.087 12.107 -0.423 827 HB2 ALA 117 2HB ALA 117 -1.203 13.278 -1.402 828 HB3 ALA 117 3HB ALA 117 -0.359 12.346 -0.165 829 H THR 118 H THR 118 -2.974 14.516 -1.433 830 HA THR 118 HA THR 118 -2.770 17.377 -1.176 831 HB THR 118 HB THR 118 -1.846 16.619 -3.850 832 HG1 THR 118 1HG THR 118 -0.001 16.346 -1.702 833 HG21 THR 118 3HG2 THR 118 -0.239 18.404 -2.156 834 HG22 THR 118 1HG2 THR 118 -1.923 18.890 -2.352 835 HG23 THR 118 2HG2 THR 118 -0.900 18.664 -3.770 836 H ALA 119 H ALA 119 -3.385 18.043 -3.830 837 HA ALA 119 HA ALA 119 -6.102 17.910 -3.943 838 HB1 ALA 119 1HB ALA 119 -4.719 19.332 -5.393 839 HB2 ALA 119 2HB ALA 119 -4.277 17.913 -6.344 840 HB3 ALA 119 3HB ALA 119 -5.954 18.459 -6.300 841 H TYR 120 H TYR 120 -3.824 15.457 -4.948 842 HA TYR 120 HA TYR 120 -5.927 13.830 -6.141 843 HB2 TYR 120 1HB TYR 120 -3.219 14.114 -6.667 844 HB3 TYR 120 2HB TYR 120 -3.317 12.558 -5.849 845 HD1 TYR 120 2HD TYR 120 -5.446 11.105 -6.735 846 HD2 TYR 120 1HD TYR 120 -3.319 14.040 -8.962 847 HE1 TYR 120 2HE TYR 120 -6.189 10.048 -8.827 848 HE2 TYR 120 1HE TYR 120 -4.058 12.992 -11.061 849 HH TYR 120 HH TYR 120 -5.339 11.425 -11.985 850 H GLY 121 H GLY 121 -6.793 12.030 -5.246 851 HA2 GLY 121 2HA GLY 121 -6.917 11.684 -2.513 852 HA3 GLY 121 3HA GLY 121 -7.278 10.420 -3.679 853 H TYR 122 H TYR 122 -5.257 9.343 -4.622 854 HA TYR 122 HA TYR 122 -2.997 9.249 -2.803 855 HB2 TYR 122 1HB TYR 122 -4.792 7.649 -1.941 856 HB3 TYR 122 2HB TYR 122 -4.486 6.691 -3.385 857 HD1 TYR 122 1HD TYR 122 -3.080 7.857 -0.195 858 HD2 TYR 122 2HD TYR 122 -2.468 5.394 -3.611 859 HE1 TYR 122 1HE TYR 122 -1.212 6.740 0.952 860 HE2 TYR 122 2HE TYR 122 -0.600 4.270 -2.473 861 HH TYR 122 HH TYR 122 0.108 3.862 -0.058 862 H SER 123 H SER 123 -1.210 7.988 -3.644 863 HA SER 123 HA SER 123 -1.399 7.272 -6.476 864 HB2 SER 123 1HB SER 123 1.024 8.794 -5.656 865 HB3 SER 123 2HB SER 123 0.203 8.737 -7.216 866 HG SER 123 HG SER 123 -1.494 9.988 -6.186 867 H LEU 124 H LEU 124 0.156 5.777 -7.182 868 HA LEU 124 HA LEU 124 2.266 4.839 -5.522 869 HB2 LEU 124 1HB LEU 124 0.394 3.879 -4.287 870 HB3 LEU 124 2HB LEU 124 -0.187 3.101 -5.758 871 HG LEU 124 HG LEU 124 2.566 2.409 -4.973 872 HD11 LEU 124 1HD1 LEU 124 0.785 0.763 -3.451 873 HD12 LEU 124 2HD1 LEU 124 0.606 2.448 -2.965 874 HD13 LEU 124 3HD1 LEU 124 2.193 1.680 -2.915 875 HD21 LEU 124 3HD2 LEU 124 1.378 0.098 -5.375 876 HD22 LEU 124 1HD2 LEU 124 1.825 1.138 -6.726 877 HD23 LEU 124 2HD2 LEU 124 0.159 1.110 -6.150 878 H TRP 125 H TRP 125 3.472 5.055 -7.397 879 HA TRP 125 HA TRP 125 2.769 3.270 -9.626 880 HB2 TRP 125 1HB TRP 125 4.687 5.612 -9.581 881 HB3 TRP 125 2HB TRP 125 4.281 4.640 -10.993 882 HD1 TRP 125 HD TRP 125 1.075 4.865 -9.528 883 HE1 TRP 125 1HE TRP 125 -0.281 6.884 -10.370 884 HE3 TRP 125 3HE TRP 125 4.882 7.611 -11.553 885 HZ2 TRP 125 2HZ TRP 125 0.201 9.318 -11.715 886 HZ3 TRP 125 3HZ TRP 125 4.350 9.774 -12.598 887 HH2 TRP 125 HH TRP 125 2.056 10.608 -12.676 888 H GLU 126 H GLU 126 5.077 3.857 -7.132 889 HA GLU 126 HA GLU 126 6.683 1.598 -8.125 890 HB2 GLU 126 1HB GLU 126 7.710 4.009 -8.231 891 HB3 GLU 126 2HB GLU 126 7.942 3.779 -6.504 892 HG2 GLU 126 1HG GLU 126 9.567 2.234 -6.783 893 HG3 GLU 126 2HG GLU 126 8.862 1.597 -8.267 894 H PHE 127 H PHE 127 5.238 0.353 -6.740 895 HA PHE 127 HA PHE 127 6.071 0.483 -3.918 896 HB2 PHE 127 1HB PHE 127 3.781 1.194 -3.988 897 HB3 PHE 127 2HB PHE 127 3.340 -0.142 -5.048 898 HD1 PHE 127 2HD PHE 127 5.540 -0.479 -2.118 899 HD2 PHE 127 1HD PHE 127 1.621 -1.045 -3.681 900 HE1 PHE 127 2HE PHE 127 4.957 -1.839 -0.154 901 HE2 PHE 127 1HE PHE 127 1.032 -2.406 -1.718 902 HZ PHE 127 HZ PHE 127 2.701 -2.806 0.048 903 H GLU 128 H GLU 128 7.263 -1.221 -3.410 904 HA GLU 128 HA GLU 128 6.879 -3.725 -4.891 905 HB2 GLU 128 1HB GLU 128 9.184 -2.310 -4.003 906 HB3 GLU 128 2HB GLU 128 9.137 -3.848 -3.153 907 HG2 GLU 128 1HG GLU 128 8.715 -4.849 -5.503 908 HG3 GLU 128 2HG GLU 128 9.357 -3.313 -6.082 909 H VAL 129 H VAL 129 5.865 -5.363 -3.957 910 HA VAL 129 HA VAL 129 6.041 -5.719 -1.058 911 HB VAL 129 HB VAL 129 3.992 -4.548 -1.172 912 HG11 VAL 129 1HG1 VAL 129 3.720 -5.932 -3.739 913 HG12 VAL 129 2HG1 VAL 129 2.221 -5.804 -2.817 914 HG13 VAL 129 3HG1 VAL 129 3.129 -4.350 -3.233 915 HG21 VAL 129 3HG2 VAL 129 4.011 -6.719 0.105 916 HG22 VAL 129 1HG2 VAL 129 2.415 -6.129 -0.361 917 HG23 VAL 129 2HG2 VAL 129 3.168 -7.444 -1.265 918 H TYR 130 H TYR 130 6.848 -7.693 -0.824 919 HA TYR 130 HA TYR 130 5.529 -10.024 -1.577 920 HB2 TYR 130 1HB TYR 130 6.021 -9.875 -3.825 921 HB3 TYR 130 2HB TYR 130 7.538 -9.027 -3.548 922 HD1 TYR 130 2HD TYR 130 9.565 -10.282 -2.925 923 HD2 TYR 130 1HD TYR 130 5.927 -12.274 -3.878 924 HE1 TYR 130 2HE TYR 130 10.801 -12.389 -3.212 925 HE2 TYR 130 1HE TYR 130 7.153 -14.386 -4.166 926 HH TYR 130 HH TYR 130 9.117 -15.410 -4.020 927 H GLY 131 H GLY 131 6.513 -11.882 -0.750 928 HA2 GLY 131 2HA GLY 131 9.108 -11.465 0.593 929 HA3 GLY 131 3HA GLY 131 7.744 -12.150 1.465 Start of MODEL 2 1 H ASN 1 H ASN 1 -10.594 -12.890 -16.707 2 HA ASN 1 HA ASN 1 -8.366 -13.227 -17.120 3 HB2 ASN 1 1HB ASN 1 -7.566 -12.942 -19.548 4 HB3 ASN 1 2HB ASN 1 -8.685 -14.259 -19.211 5 HD21 ASN 1 1HD2 ASN 1 -8.132 -11.383 -20.948 6 HD22 ASN 1 2HD2 ASN 1 -9.650 -11.314 -21.771 7 H LEU 2 H LEU 2 -9.243 -10.871 -16.056 8 HA LEU 2 HA LEU 2 -7.322 -8.953 -17.184 9 HB2 LEU 2 1HB LEU 2 -10.121 -8.388 -16.229 10 HB3 LEU 2 2HB LEU 2 -8.907 -7.135 -16.483 11 HG LEU 2 HG LEU 2 -9.713 -8.984 -18.704 12 HD11 LEU 2 1HD1 LEU 2 -11.808 -8.143 -18.191 13 HD12 LEU 2 2HD1 LEU 2 -11.204 -6.979 -19.368 14 HD13 LEU 2 3HD1 LEU 2 -11.167 -6.593 -17.647 15 HD21 LEU 2 3HD2 LEU 2 -7.686 -7.293 -18.621 16 HD22 LEU 2 1HD2 LEU 2 -8.949 -6.129 -19.022 17 HD23 LEU 2 2HD2 LEU 2 -8.650 -7.507 -20.083 18 H ALA 3 H ALA 3 -6.789 -10.737 -15.104 19 HA ALA 3 HA ALA 3 -6.041 -8.884 -13.034 20 HB1 ALA 3 1HB ALA 3 -8.452 -9.797 -12.572 21 HB2 ALA 3 2HB ALA 3 -7.579 -11.226 -12.018 22 HB3 ALA 3 3HB ALA 3 -7.278 -9.660 -11.263 23 H LEU 4 H LEU 4 -4.341 -9.625 -11.769 24 HA LEU 4 HA LEU 4 -3.193 -12.199 -12.623 25 HB2 LEU 4 1HB LEU 4 -2.077 -9.752 -12.883 26 HB3 LEU 4 2HB LEU 4 -1.453 -10.219 -11.303 27 HG LEU 4 HG LEU 4 -0.787 -12.420 -12.611 28 HD11 LEU 4 1HD1 LEU 4 0.020 -10.934 -14.877 29 HD12 LEU 4 2HD1 LEU 4 -1.721 -10.720 -14.691 30 HD13 LEU 4 3HD1 LEU 4 -1.039 -12.342 -14.809 31 HD21 LEU 4 3HD2 LEU 4 0.542 -10.260 -11.613 32 HD22 LEU 4 1HD2 LEU 4 1.048 -10.245 -13.303 33 HD23 LEU 4 2HD2 LEU 4 1.310 -11.685 -12.316 34 H ASN 5 H ASN 5 -1.265 -12.543 -10.727 35 HA ASN 5 HA ASN 5 -2.801 -13.498 -8.510 36 HB2 ASN 5 1HB ASN 5 0.193 -13.405 -8.473 37 HB3 ASN 5 2HB ASN 5 -0.892 -14.652 -7.865 38 HD21 ASN 5 1HD2 ASN 5 -2.465 -15.199 -9.983 39 HD22 ASN 5 2HD2 ASN 5 -1.524 -15.828 -11.288 40 H LYS 6 H LYS 6 -1.240 -10.573 -9.225 41 HA LYS 6 HA LYS 6 -0.307 -9.722 -6.741 42 HB2 LYS 6 1HB LYS 6 -0.778 -8.568 -9.297 43 HB3 LYS 6 2HB LYS 6 -1.505 -7.510 -8.095 44 HG2 LYS 6 1HG LYS 6 0.622 -6.663 -8.230 45 HG3 LYS 6 2HG LYS 6 0.779 -7.782 -6.874 46 HD2 LYS 6 1HD LYS 6 1.363 -9.434 -8.921 47 HD3 LYS 6 2HD LYS 6 1.938 -7.905 -9.587 48 HE2 LYS 6 1HE LYS 6 3.671 -7.802 -8.163 49 HE3 LYS 6 2HE LYS 6 2.708 -8.372 -6.800 50 HZ1 LYS 6 3HZ LYS 6 4.633 -9.807 -7.927 51 HZ2 LYS 6 1HZ LYS 6 3.316 -10.344 -8.845 52 HZ3 LYS 6 2HZ LYS 6 3.294 -10.501 -7.161 53 H ALA 7 H ALA 7 -3.379 -8.655 -8.204 54 HA ALA 7 HA ALA 7 -5.415 -8.186 -7.300 55 HB1 ALA 7 1HB ALA 7 -6.033 -10.078 -6.303 56 HB2 ALA 7 2HB ALA 7 -4.401 -10.385 -5.706 57 HB3 ALA 7 3HB ALA 7 -5.493 -9.345 -4.791 58 H THR 8 H THR 8 -5.859 -6.200 -6.636 59 HA THR 8 HA THR 8 -4.761 -5.256 -4.090 60 HB THR 8 HB THR 8 -3.724 -3.399 -4.892 61 HG1 THR 8 1HG THR 8 -5.283 -2.264 -5.877 62 HG21 THR 8 3HG2 THR 8 -3.660 -4.851 -7.522 63 HG22 THR 8 1HG2 THR 8 -2.827 -5.477 -6.101 64 HG23 THR 8 2HG2 THR 8 -2.388 -3.900 -6.757 65 H ALA 9 H ALA 9 -5.950 -3.519 -3.134 66 HA ALA 9 HA ALA 9 -8.497 -2.809 -4.366 67 HB1 ALA 9 1HB ALA 9 -8.198 -4.566 -2.012 68 HB2 ALA 9 2HB ALA 9 -9.429 -3.307 -1.900 69 HB3 ALA 9 3HB ALA 9 -9.487 -4.482 -3.213 70 H THR 10 H THR 10 -9.267 -0.831 -3.752 71 HA THR 10 HA THR 10 -7.859 0.580 -1.593 72 HB THR 10 HB THR 10 -7.252 2.389 -2.857 73 HG1 THR 10 1HG THR 10 -9.021 1.782 -4.979 74 HG21 THR 10 3HG2 THR 10 -6.018 1.625 -4.634 75 HG22 THR 10 1HG2 THR 10 -7.323 0.610 -5.247 76 HG23 THR 10 2HG2 THR 10 -6.390 0.094 -3.842 77 H SER 11 H SER 11 -9.001 2.802 -1.235 78 HA SER 11 HA SER 11 -11.844 2.202 -0.918 79 HB2 SER 11 1HB SER 11 -11.401 3.045 1.119 80 HB3 SER 11 2HB SER 11 -9.860 3.717 0.585 81 HG SER 11 HG SER 11 -11.918 5.092 1.217 82 H SER 12 H SER 12 -9.704 4.672 -2.266 83 HA SER 12 HA SER 12 -12.027 5.806 -3.682 84 HB2 SER 12 1HB SER 12 -10.249 7.115 -1.978 85 HB3 SER 12 2HB SER 12 -9.707 7.558 -3.597 86 HG SER 12 HG SER 12 -11.489 8.662 -3.903 87 H ILE 13 H ILE 13 -11.479 6.819 -5.796 88 HA ILE 13 HA ILE 13 -9.110 6.240 -7.188 89 HB ILE 13 HB ILE 13 -9.863 3.907 -6.999 90 HG12 ILE 13 1HG1 ILE 13 -10.070 5.021 -9.806 91 HG13 ILE 13 2HG1 ILE 13 -8.573 4.626 -8.968 92 HG21 ILE 13 1HG2 ILE 13 -12.016 3.396 -7.139 93 HG22 ILE 13 2HG2 ILE 13 -12.396 5.052 -7.607 94 HG23 ILE 13 3HG2 ILE 13 -12.006 3.856 -8.842 95 HD11 ILE 13 3HD1 ILE 13 -8.705 2.520 -9.622 96 HD12 ILE 13 1HD1 ILE 13 -10.334 2.364 -8.964 97 HD13 ILE 13 2HD1 ILE 13 -10.098 2.965 -10.606 98 H GLU 14 H GLU 14 -9.096 7.120 -9.256 99 HA GLU 14 HA GLU 14 -10.968 9.156 -9.771 100 HB2 GLU 14 1HB GLU 14 -8.803 7.900 -11.445 101 HB3 GLU 14 2HB GLU 14 -9.819 9.194 -12.063 102 HG2 GLU 14 1HG GLU 14 -9.090 10.496 -9.980 103 HG3 GLU 14 2HG GLU 14 -7.822 9.279 -9.836 104 H THR 15 H THR 15 -10.425 6.049 -11.422 105 HA THR 15 HA THR 15 -12.815 6.375 -13.017 106 HB THR 15 HB THR 15 -12.237 4.332 -14.091 107 HG1 THR 15 1HG THR 15 -10.672 2.927 -13.228 108 HG21 THR 15 3HG2 THR 15 -9.901 4.700 -14.749 109 HG22 THR 15 1HG2 THR 15 -9.687 5.788 -13.379 110 HG23 THR 15 2HG2 THR 15 -10.797 6.216 -14.681 111 H ALA 16 H ALA 16 -13.922 3.910 -13.146 112 HA ALA 16 HA ALA 16 -15.252 3.719 -10.555 113 HB1 ALA 16 1HB ALA 16 -15.961 2.540 -13.237 114 HB2 ALA 16 2HB ALA 16 -16.920 2.360 -11.768 115 HB3 ALA 16 3HB ALA 16 -16.688 3.958 -12.480 116 H GLY 17 H GLY 17 -12.691 2.724 -10.451 117 HA2 GLY 17 2HA GLY 17 -11.743 0.867 -9.417 118 HA3 GLY 17 3HA GLY 17 -13.221 -0.030 -9.732 119 H HIS 18 H HIS 18 -10.022 0.580 -10.726 120 HA HIS 18 HA HIS 18 -9.861 -1.637 -12.400 121 HB2 HIS 18 1HB HIS 18 -11.097 0.556 -13.692 122 HB3 HIS 18 2HB HIS 18 -9.475 0.423 -14.364 123 HD1 HIS 18 1HD HIS 18 -11.871 -2.354 -13.359 124 HD2 HIS 18 2HD HIS 18 -9.880 -0.891 -16.700 125 HE1 HIS 18 1HE HIS 18 -12.360 -3.991 -15.204 126 H GLU 19 H GLU 19 -8.679 1.519 -11.507 127 HA GLU 19 HA GLU 19 -6.081 1.305 -12.592 128 HB2 GLU 19 1HB GLU 19 -7.500 3.259 -11.277 129 HB3 GLU 19 2HB GLU 19 -6.280 2.819 -10.090 130 HG2 GLU 19 1HG GLU 19 -4.656 3.830 -11.223 131 HG3 GLU 19 2HG GLU 19 -5.185 3.150 -12.761 132 H GLY 20 H GLY 20 -7.566 -0.050 -9.777 133 HA2 GLY 20 2HA GLY 20 -5.217 -0.532 -8.257 134 HA3 GLY 20 3HA GLY 20 -6.758 -1.356 -8.067 135 H ASP 21 H ASP 21 -6.889 -2.380 -10.747 136 HA ASP 21 HA ASP 21 -5.274 -4.726 -10.377 137 HB2 ASP 21 1HB ASP 21 -6.799 -4.187 -12.897 138 HB3 ASP 21 2HB ASP 21 -6.557 -5.708 -12.043 139 H LYS 22 H LYS 22 -4.593 -1.755 -11.619 140 HA LYS 22 HA LYS 22 -3.113 -2.451 -13.954 141 HB2 LYS 22 1HB LYS 22 -4.030 -0.108 -12.911 142 HB3 LYS 22 2HB LYS 22 -2.322 -0.008 -12.504 143 HG2 LYS 22 1HG LYS 22 -2.040 0.821 -14.546 144 HG3 LYS 22 2HG LYS 22 -2.284 -0.828 -15.128 145 HD2 LYS 22 1HD LYS 22 -4.738 0.714 -14.592 146 HD3 LYS 22 2HD LYS 22 -3.751 1.294 -15.935 147 HE2 LYS 22 1HE LYS 22 -3.840 -0.861 -16.998 148 HE3 LYS 22 2HE LYS 22 -4.661 -1.561 -15.603 149 HZ1 LYS 22 3HZ LYS 22 -6.508 -1.112 -16.752 150 HZ2 LYS 22 1HZ LYS 22 -5.736 -0.016 -17.785 151 HZ3 LYS 22 2HZ LYS 22 -6.277 0.492 -16.265 152 H ALA 23 H ALA 23 -2.549 -3.055 -10.741 153 HA ALA 23 HA ALA 23 0.320 -2.690 -10.770 154 HB1 ALA 23 1HB ALA 23 0.300 -3.430 -8.521 155 HB2 ALA 23 2HB ALA 23 -1.129 -2.414 -8.724 156 HB3 ALA 23 3HB ALA 23 -1.291 -4.170 -8.705 157 H VAL 24 H VAL 24 -1.545 -4.803 -12.316 158 HA VAL 24 HA VAL 24 -0.781 -7.367 -11.703 159 HB VAL 24 HB VAL 24 -1.298 -6.089 -14.378 160 HG11 VAL 24 1HG1 VAL 24 -1.610 -8.724 -14.881 161 HG12 VAL 24 2HG1 VAL 24 -0.145 -7.815 -15.257 162 HG13 VAL 24 3HG1 VAL 24 -0.238 -8.769 -13.775 163 HG21 VAL 24 3HG2 VAL 24 -3.096 -8.180 -13.586 164 HG22 VAL 24 1HG2 VAL 24 -2.946 -6.991 -12.294 165 HG23 VAL 24 2HG2 VAL 24 -3.435 -6.481 -13.909 166 H ASP 25 H ASP 25 0.932 -5.098 -13.843 167 HA ASP 25 HA ASP 25 3.036 -6.696 -14.628 168 HB2 ASP 25 1HB ASP 25 2.390 -3.987 -14.818 169 HB3 ASP 25 2HB ASP 25 3.956 -4.012 -14.011 170 H GLY 26 H GLY 26 2.789 -4.714 -11.687 171 HA2 GLY 26 2HA GLY 26 3.739 -5.142 -9.609 172 HA3 GLY 26 3HA GLY 26 4.572 -6.525 -10.304 173 H ASN 27 H ASN 27 5.236 -4.161 -12.405 174 HA ASN 27 HA ASN 27 7.685 -3.381 -10.965 175 HB2 ASN 27 1HB ASN 27 7.530 -4.765 -13.312 176 HB3 ASN 27 2HB ASN 27 7.670 -3.111 -13.900 177 HD21 ASN 27 1HD2 ASN 27 9.547 -5.359 -14.034 178 HD22 ASN 27 2HD2 ASN 27 11.006 -4.795 -13.300 179 H ALA 28 H ALA 28 8.573 -1.405 -12.678 180 HA ALA 28 HA ALA 28 7.108 0.839 -11.775 181 HB1 ALA 28 1HB ALA 28 9.242 1.493 -12.097 182 HB2 ALA 28 2HB ALA 28 9.497 0.379 -13.440 183 HB3 ALA 28 3HB ALA 28 8.649 1.902 -13.707 184 H ALA 29 H ALA 29 6.565 -1.258 -14.352 185 HA ALA 29 HA ALA 29 5.533 0.520 -16.296 186 HB1 ALA 29 1HB ALA 29 5.805 -1.437 -17.351 187 HB2 ALA 29 2HB ALA 29 5.603 -2.375 -15.870 188 HB3 ALA 29 3HB ALA 29 4.187 -1.806 -16.753 189 H THR 30 H THR 30 4.367 -0.393 -13.265 190 HA THR 30 HA THR 30 1.571 0.110 -13.984 191 HB THR 30 HB THR 30 0.937 -0.811 -11.893 192 HG1 THR 30 1HG THR 30 2.538 -1.307 -10.290 193 HG21 THR 30 3HG2 THR 30 1.891 -3.019 -11.939 194 HG22 THR 30 1HG2 THR 30 3.324 -2.433 -12.784 195 HG23 THR 30 2HG2 THR 30 1.759 -2.438 -13.599 196 H ARG 31 H ARG 31 0.527 1.931 -13.432 197 HA ARG 31 HA ARG 31 1.768 3.741 -11.483 198 HB2 ARG 31 1HB ARG 31 1.014 4.350 -14.320 199 HB3 ARG 31 2HB ARG 31 0.941 5.615 -13.101 200 HG2 ARG 31 1HG ARG 31 3.058 5.961 -13.807 201 HG3 ARG 31 2HG ARG 31 3.398 4.715 -12.605 202 HD2 ARG 31 1HD ARG 31 4.329 3.500 -14.214 203 HD3 ARG 31 2HD ARG 31 2.737 3.343 -14.953 204 HE ARG 31 HE ARG 31 3.391 4.813 -16.579 205 HH11 ARG 31 1HH1 ARG 31 5.591 5.042 -13.891 206 HH12 ARG 31 2HH1 ARG 31 6.698 6.087 -14.719 207 HH21 ARG 31 1HH2 ARG 31 4.840 6.188 -17.678 208 HH22 ARG 31 2HH2 ARG 31 6.270 6.740 -16.872 209 H TRP 32 H TRP 32 0.348 4.134 -9.932 210 HA TRP 32 HA TRP 32 -2.506 3.850 -10.481 211 HB2 TRP 32 1HB TRP 32 -1.929 2.651 -8.552 212 HB3 TRP 32 2HB TRP 32 -0.856 3.921 -7.971 213 HD1 TRP 32 HD TRP 32 -2.006 6.038 -6.757 214 HE1 TRP 32 1HE TRP 32 -4.285 6.290 -5.587 215 HE3 TRP 32 3HE TRP 32 -4.341 1.892 -8.627 216 HZ2 TRP 32 2HZ TRP 32 -6.746 4.912 -5.472 217 HZ3 TRP 32 3HZ TRP 32 -6.657 1.430 -7.936 218 HH2 TRP 32 HH TRP 32 -7.833 2.910 -6.391 219 H ALA 33 H ALA 33 -4.019 5.460 -10.060 220 HA ALA 33 HA ALA 33 -2.950 8.145 -9.507 221 HB1 ALA 33 1HB ALA 33 -5.196 7.867 -11.437 222 HB2 ALA 33 2HB ALA 33 -3.949 9.108 -11.325 223 HB3 ALA 33 3HB ALA 33 -3.558 7.524 -11.993 224 H SER 34 H SER 34 -4.055 9.274 -8.028 225 HA SER 34 HA SER 34 -6.459 8.062 -6.901 226 HB2 SER 34 1HB SER 34 -4.238 9.319 -5.765 227 HB3 SER 34 2HB SER 34 -5.555 10.475 -5.563 228 HG SER 34 HG SER 34 -5.496 7.767 -4.720 229 H ALA 35 H ALA 35 -8.205 9.576 -6.161 230 HA ALA 35 HA ALA 35 -8.755 11.529 -8.293 231 HB1 ALA 35 1HB ALA 35 -10.262 9.460 -7.845 232 HB2 ALA 35 2HB ALA 35 -10.879 10.426 -6.503 233 HB3 ALA 35 3HB ALA 35 -11.005 11.029 -8.156 234 H TYR 36 H TYR 36 -7.347 12.983 -6.948 235 HA TYR 36 HA TYR 36 -7.014 14.608 -5.366 236 HB2 TYR 36 1HB TYR 36 -9.265 15.994 -5.104 237 HB3 TYR 36 2HB TYR 36 -8.328 16.030 -6.594 238 HD1 TYR 36 2HD TYR 36 -9.063 14.639 -8.538 239 HD2 TYR 36 1HD TYR 36 -11.466 15.111 -5.059 240 HE1 TYR 36 2HE TYR 36 -11.028 13.867 -9.799 241 HE2 TYR 36 1HE TYR 36 -13.438 14.338 -6.309 242 HH TYR 36 HH TYR 36 -13.657 14.253 -9.527 243 H GLY 37 H GLY 37 -8.558 15.784 -3.450 244 HA2 GLY 37 2HA GLY 37 -8.311 14.150 -1.252 245 HA3 GLY 37 3HA GLY 37 -9.403 15.524 -1.329 246 H ALA 38 H ALA 38 -9.618 12.805 -0.073 247 HA ALA 38 HA ALA 38 -12.338 12.396 -0.350 248 HB1 ALA 38 1HB ALA 38 -12.674 11.195 -2.184 249 HB2 ALA 38 2HB ALA 38 -10.977 11.424 -2.611 250 HB3 ALA 38 3HB ALA 38 -11.468 10.012 -1.675 251 H SER 39 H SER 39 -10.238 12.338 1.612 252 HA SER 39 HA SER 39 -9.431 9.865 2.503 253 HB2 SER 39 1HB SER 39 -9.970 11.123 4.866 254 HB3 SER 39 2HB SER 39 -8.524 11.405 3.897 255 HG SER 39 HG SER 39 -10.527 13.099 4.479 256 HA PRO 40 HA PRO 40 -9.219 9.069 4.809 257 HB2 PRO 40 1HB PRO 40 -9.319 6.395 5.263 258 HB3 PRO 40 2HB PRO 40 -9.971 7.586 6.395 259 HG2 PRO 40 1HG PRO 40 -11.405 5.930 4.356 260 HG3 PRO 40 2HG PRO 40 -11.871 6.297 6.027 261 HD2 PRO 40 1HD PRO 40 -12.933 7.593 3.900 262 HD3 PRO 40 2HD PRO 40 -12.691 8.378 5.473 263 H GLN 41 H GLN 41 -7.320 8.062 3.999 264 HA GLN 41 HA GLN 41 -7.635 6.899 1.309 265 HB2 GLN 41 1HB GLN 41 -5.524 8.768 2.381 266 HB3 GLN 41 2HB GLN 41 -5.328 7.871 0.881 267 HG2 GLN 41 1HG GLN 41 -7.252 8.975 -0.073 268 HG3 GLN 41 2HG GLN 41 -7.557 9.812 1.448 269 HE21 GLN 41 1HE2 GLN 41 -7.453 11.691 -0.018 270 HE22 GLN 41 2HE2 GLN 41 -5.908 12.402 -0.322 271 H TRP 42 H TRP 42 -6.641 5.013 0.880 272 HA TRP 42 HA TRP 42 -4.331 4.042 2.141 273 HB2 TRP 42 1HB TRP 42 -5.278 2.259 3.540 274 HB3 TRP 42 2HB TRP 42 -5.768 3.849 4.117 275 HD1 TRP 42 HD TRP 42 -8.315 4.548 2.706 276 HE1 TRP 42 1HE TRP 42 -10.439 3.096 2.808 277 HE3 TRP 42 3HE TRP 42 -6.184 0.084 3.997 278 HZ2 TRP 42 2HZ TRP 42 -11.120 0.414 3.363 279 HZ3 TRP 42 3HZ TRP 42 -7.642 -1.876 4.295 280 HH2 TRP 42 HH TRP 42 -10.058 -1.712 3.984 281 H ILE 43 H ILE 43 -4.032 1.631 1.697 282 HA ILE 43 HA ILE 43 -5.677 0.447 -0.330 283 HB ILE 43 HB ILE 43 -4.436 2.048 -1.712 284 HG12 ILE 43 1HG1 ILE 43 -3.345 -0.719 -2.220 285 HG13 ILE 43 2HG1 ILE 43 -5.037 -0.308 -2.485 286 HG21 ILE 43 1HG2 ILE 43 -2.418 1.949 -0.093 287 HG22 ILE 43 2HG2 ILE 43 -1.893 0.599 -1.099 288 HG23 ILE 43 3HG2 ILE 43 -2.126 2.193 -1.816 289 HD11 ILE 43 3HD1 ILE 43 -4.029 1.614 -3.938 290 HD12 ILE 43 1HD1 ILE 43 -2.616 0.558 -3.980 291 HD13 ILE 43 2HD1 ILE 43 -4.170 -0.023 -4.580 292 H TYR 44 H TYR 44 -5.507 -1.704 -0.216 293 HA TYR 44 HA TYR 44 -3.114 -2.836 1.082 294 HB2 TYR 44 1HB TYR 44 -4.667 -4.649 1.911 295 HB3 TYR 44 2HB TYR 44 -4.912 -3.062 2.632 296 HD1 TYR 44 2HD TYR 44 -6.817 -1.629 1.760 297 HD2 TYR 44 1HD TYR 44 -6.422 -5.755 0.803 298 HE1 TYR 44 2HE TYR 44 -9.190 -1.702 1.123 299 HE2 TYR 44 1HE TYR 44 -8.794 -5.840 0.161 300 HH TYR 44 HH TYR 44 -10.728 -2.966 -0.105 301 H ILE 45 H ILE 45 -2.406 -4.880 0.365 302 HA ILE 45 HA ILE 45 -3.483 -5.700 -2.254 303 HB ILE 45 HB ILE 45 -0.592 -5.944 -1.433 304 HG12 ILE 45 1HG1 ILE 45 -1.929 -3.822 -3.125 305 HG13 ILE 45 2HG1 ILE 45 -1.152 -3.578 -1.565 306 HG21 ILE 45 1HG2 ILE 45 -1.528 -7.500 -3.167 307 HG22 ILE 45 2HG2 ILE 45 -1.827 -6.085 -4.174 308 HG23 ILE 45 3HG2 ILE 45 -0.179 -6.502 -3.708 309 HD11 ILE 45 3HD1 ILE 45 0.998 -4.168 -2.534 310 HD12 ILE 45 1HD1 ILE 45 0.226 -4.446 -4.095 311 HD13 ILE 45 2HD1 ILE 45 0.253 -2.824 -3.400 312 H ASN 46 H ASN 46 -4.105 -7.756 -2.415 313 HA ASN 46 HA ASN 46 -3.241 -9.632 -0.314 314 HB2 ASN 46 1HB ASN 46 -5.741 -10.076 -1.899 315 HB3 ASN 46 2HB ASN 46 -5.354 -10.582 -0.257 316 HD21 ASN 46 1HD2 ASN 46 -6.800 -8.215 -2.220 317 HD22 ASN 46 2HD2 ASN 46 -7.261 -7.119 -0.966 318 H LEU 47 H LEU 47 -1.930 -11.179 -0.997 319 HA LEU 47 HA LEU 47 -1.670 -11.744 -3.827 320 HB2 LEU 47 1HB LEU 47 0.261 -11.511 -2.213 321 HB3 LEU 47 2HB LEU 47 -0.219 -13.072 -1.550 322 HG LEU 47 HG LEU 47 1.694 -13.124 -3.176 323 HD11 LEU 47 1HD1 LEU 47 -0.602 -14.715 -4.247 324 HD12 LEU 47 2HD1 LEU 47 0.023 -15.016 -2.625 325 HD13 LEU 47 3HD1 LEU 47 1.083 -15.190 -4.025 326 HD21 LEU 47 3HD2 LEU 47 0.102 -11.491 -4.696 327 HD22 LEU 47 1HD2 LEU 47 -0.083 -13.055 -5.490 328 HD23 LEU 47 2HD2 LEU 47 1.524 -12.362 -5.270 329 H GLY 48 H GLY 48 -2.170 -13.736 -0.901 330 HA2 GLY 48 2HA GLY 48 -4.173 -15.225 -0.997 331 HA3 GLY 48 3HA GLY 48 -3.632 -15.653 -2.613 332 H SER 49 H SER 49 -1.066 -15.197 -0.459 333 HA SER 49 HA SER 49 -1.025 -17.866 0.620 334 HB2 SER 49 1HB SER 49 1.107 -18.495 -0.535 335 HB3 SER 49 2HB SER 49 -0.285 -18.408 -1.614 336 HG SER 49 HG SER 49 1.279 -17.292 -2.647 337 H THR 50 H THR 50 0.552 -18.153 2.208 338 HA THR 50 HA THR 50 1.437 -15.760 3.479 339 HB THR 50 HB THR 50 2.828 -17.898 4.647 340 HG1 THR 50 1HG THR 50 0.158 -18.737 4.297 341 HG21 THR 50 3HG2 THR 50 1.948 -16.649 6.288 342 HG22 THR 50 1HG2 THR 50 0.507 -17.649 6.108 343 HG23 THR 50 2HG2 THR 50 0.616 -16.100 5.270 344 H GLN 51 H GLN 51 3.227 -14.647 3.087 345 HA GLN 51 HA GLN 51 5.600 -16.069 2.098 346 HB2 GLN 51 1HB GLN 51 4.865 -13.336 1.083 347 HB3 GLN 51 2HB GLN 51 6.030 -14.474 0.420 348 HG2 GLN 51 1HG GLN 51 3.691 -15.883 0.281 349 HG3 GLN 51 2HG GLN 51 3.166 -14.233 -0.048 350 HE21 GLN 51 1HE2 GLN 51 2.996 -16.224 -1.945 351 HE22 GLN 51 2HE2 GLN 51 4.107 -15.890 -3.226 352 H SER 52 H SER 52 7.569 -15.291 2.804 353 HA SER 52 HA SER 52 7.478 -13.713 5.215 354 HB2 SER 52 1HB SER 52 9.963 -14.146 5.234 355 HB3 SER 52 2HB SER 52 8.964 -15.598 5.215 356 HG SER 52 HG SER 52 10.811 -15.478 3.690 357 H ILE 53 H ILE 53 8.008 -11.628 5.460 358 HA ILE 53 HA ILE 53 9.182 -10.221 3.149 359 HB ILE 53 HB ILE 53 7.475 -8.658 4.991 360 HG12 ILE 53 1HG1 ILE 53 6.335 -10.644 3.014 361 HG13 ILE 53 2HG1 ILE 53 6.102 -10.649 4.759 362 HG21 ILE 53 1HG2 ILE 53 8.739 -7.967 2.815 363 HG22 ILE 53 2HG2 ILE 53 7.329 -8.654 2.010 364 HG23 ILE 53 3HG2 ILE 53 7.134 -7.320 3.148 365 HD11 ILE 53 3HD1 ILE 53 4.625 -9.276 2.722 366 HD12 ILE 53 1HD1 ILE 53 4.255 -9.480 4.433 367 HD13 ILE 53 2HD1 ILE 53 5.260 -8.131 3.903 368 H SER 54 H SER 54 10.550 -8.452 3.603 369 HA SER 54 HA SER 54 11.528 -8.337 6.382 370 HB2 SER 54 1HB SER 54 13.764 -7.691 5.096 371 HB3 SER 54 2HB SER 54 13.333 -9.374 5.400 372 HG SER 54 HG SER 54 13.959 -8.766 3.172 373 H ARG 55 H ARG 55 12.181 -6.530 3.382 374 HA ARG 55 HA ARG 55 11.421 -4.068 4.814 375 HB2 ARG 55 1HB ARG 55 13.113 -2.954 3.242 376 HB3 ARG 55 2HB ARG 55 13.748 -3.898 4.581 377 HG2 ARG 55 1HG ARG 55 14.627 -5.487 3.230 378 HG3 ARG 55 2HG ARG 55 13.355 -5.318 2.019 379 HD2 ARG 55 1HD ARG 55 14.657 -3.999 0.795 380 HD3 ARG 55 2HD ARG 55 14.840 -2.886 2.150 381 HE ARG 55 HE ARG 55 16.924 -3.749 2.528 382 HH11 ARG 55 1HH1 ARG 55 15.149 -5.923 0.469 383 HH12 ARG 55 2HH1 ARG 55 16.514 -6.943 0.150 384 HH21 ARG 55 1HH2 ARG 55 18.728 -5.084 2.116 385 HH22 ARG 55 2HH2 ARG 55 18.548 -6.465 1.088 386 H VAL 56 H VAL 56 10.197 -2.572 3.732 387 HA VAL 56 HA VAL 56 9.485 -3.134 0.940 388 HB VAL 56 HB VAL 56 7.088 -2.529 1.541 389 HG11 VAL 56 1HG1 VAL 56 6.612 -4.718 1.464 390 HG12 VAL 56 2HG1 VAL 56 8.360 -4.936 1.355 391 HG13 VAL 56 3HG1 VAL 56 7.550 -5.071 2.916 392 HG21 VAL 56 3HG2 VAL 56 7.436 -1.618 3.741 393 HG22 VAL 56 1HG2 VAL 56 6.424 -3.056 3.873 394 HG23 VAL 56 2HG2 VAL 56 8.132 -3.137 4.305 395 H LYS 57 H LYS 57 9.804 -1.374 -0.232 396 HA LYS 57 HA LYS 57 9.600 1.255 1.078 397 HB2 LYS 57 1HB LYS 57 11.156 2.096 -0.557 398 HB3 LYS 57 2HB LYS 57 11.833 0.639 0.161 399 HG2 LYS 57 1HG LYS 57 10.712 -0.520 -1.908 400 HG3 LYS 57 2HG LYS 57 10.813 1.102 -2.596 401 HD2 LYS 57 1HD LYS 57 13.231 -0.011 -1.268 402 HD3 LYS 57 2HD LYS 57 12.784 -0.651 -2.851 403 HE2 LYS 57 1HE LYS 57 12.731 2.282 -2.605 404 HE3 LYS 57 2HE LYS 57 14.324 1.540 -2.472 405 HZ1 LYS 57 3HZ LYS 57 14.287 1.617 -4.691 406 HZ2 LYS 57 1HZ LYS 57 12.609 1.814 -4.773 407 HZ3 LYS 57 2HZ LYS 57 13.271 0.268 -4.597 408 H LEU 58 H LEU 58 8.234 2.770 0.301 409 HA LEU 58 HA LEU 58 6.888 2.263 -2.257 410 HB2 LEU 58 1HB LEU 58 4.737 2.710 -1.352 411 HB3 LEU 58 2HB LEU 58 5.489 1.465 -0.357 412 HG LEU 58 HG LEU 58 5.969 4.106 0.723 413 HD11 LEU 58 1HD1 LEU 58 3.998 5.045 0.226 414 HD12 LEU 58 2HD1 LEU 58 3.350 3.957 1.455 415 HD13 LEU 58 3HD1 LEU 58 3.273 3.510 -0.249 416 HD21 LEU 58 3HD2 LEU 58 4.536 2.792 2.575 417 HD22 LEU 58 1HD2 LEU 58 6.257 2.518 2.304 418 HD23 LEU 58 2HD2 LEU 58 5.068 1.430 1.587 419 H ASN 59 H ASN 59 5.945 4.145 -3.236 420 HA ASN 59 HA ASN 59 7.056 6.676 -2.213 421 HB2 ASN 59 1HB ASN 59 8.251 5.850 -4.231 422 HB3 ASN 59 2HB ASN 59 6.732 5.899 -5.119 423 HD21 ASN 59 1HD2 ASN 59 8.160 7.308 -6.471 424 HD22 ASN 59 2HD2 ASN 59 8.170 8.996 -6.109 425 H TRP 60 H TRP 60 5.782 8.499 -2.351 426 HA TRP 60 HA TRP 60 2.943 7.986 -2.852 427 HB2 TRP 60 1HB TRP 60 4.171 9.215 -0.748 428 HB3 TRP 60 2HB TRP 60 3.724 10.599 -1.742 429 HD1 TRP 60 HD TRP 60 1.371 11.503 -1.316 430 HE1 TRP 60 1HE TRP 60 -0.796 10.591 -0.269 431 HE3 TRP 60 3HE TRP 60 2.853 6.688 -0.449 432 HZ2 TRP 60 2HZ TRP 60 -1.750 8.152 0.787 433 HZ3 TRP 60 3HZ TRP 60 1.254 5.129 0.583 434 HH2 TRP 60 HH TRP 60 -1.000 5.848 1.188 435 H GLU 61 H GLU 61 5.482 9.034 -4.583 436 HA GLU 61 HA GLU 61 5.741 10.245 -6.491 437 HB2 GLU 61 1HB GLU 61 3.263 9.060 -6.677 438 HB3 GLU 61 2HB GLU 61 2.898 10.754 -6.977 439 HG2 GLU 61 1HG GLU 61 3.343 9.459 -9.029 440 HG3 GLU 61 2HG GLU 61 4.433 10.827 -8.810 441 H ASP 62 H ASP 62 4.224 12.320 -7.599 442 HA ASP 62 HA ASP 62 5.181 14.557 -6.340 443 HB2 ASP 62 1HB ASP 62 3.948 14.221 -8.649 444 HB3 ASP 62 2HB ASP 62 2.542 14.752 -7.731 445 H ALA 63 H ALA 63 1.978 13.085 -5.933 446 HA ALA 63 HA ALA 63 0.744 14.891 -4.295 447 HB1 ALA 63 1HB ALA 63 -0.390 12.913 -5.068 448 HB2 ALA 63 2HB ALA 63 0.664 11.884 -4.098 449 HB3 ALA 63 3HB ALA 63 -0.473 12.976 -3.306 450 H TYR 64 H TYR 64 1.229 15.791 -2.411 451 HA TYR 64 HA TYR 64 3.430 14.813 -0.836 452 HB2 TYR 64 1HB TYR 64 1.608 17.195 -0.671 453 HB3 TYR 64 2HB TYR 64 2.666 16.787 0.675 454 HD1 TYR 64 2HD TYR 64 2.794 17.342 -3.016 455 HD2 TYR 64 1HD TYR 64 4.802 17.678 0.720 456 HE1 TYR 64 2HE TYR 64 4.647 18.520 -4.125 457 HE2 TYR 64 1HE TYR 64 6.660 18.856 -0.378 458 HH TYR 64 HH TYR 64 7.520 19.547 -2.309 459 H ALA 65 H ALA 65 3.373 13.959 1.216 460 HA ALA 65 HA ALA 65 0.812 13.546 2.531 461 HB1 ALA 65 1HB ALA 65 2.404 11.375 1.272 462 HB2 ALA 65 2HB ALA 65 1.609 11.045 2.812 463 HB3 ALA 65 3HB ALA 65 0.656 11.557 1.421 464 H THR 66 H THR 66 0.976 13.142 4.738 465 HA THR 66 HA THR 66 3.386 14.064 5.972 466 HB THR 66 HB THR 66 1.213 14.622 6.941 467 HG1 THR 66 1HG THR 66 3.017 14.471 8.356 468 HG21 THR 66 3HG2 THR 66 0.461 12.088 6.368 469 HG22 THR 66 1HG2 THR 66 -0.381 13.125 7.520 470 HG23 THR 66 2HG2 THR 66 0.793 11.939 8.093 471 H ALA 67 H ALA 67 1.822 10.942 5.555 472 HA ALA 67 HA ALA 67 4.030 9.363 5.593 473 HB1 ALA 67 1HB ALA 67 3.220 10.119 8.353 474 HB2 ALA 67 2HB ALA 67 3.779 8.471 8.060 475 HB3 ALA 67 3HB ALA 67 4.827 9.838 7.682 476 H TYR 68 H TYR 68 3.555 7.031 6.239 477 HA TYR 68 HA TYR 68 0.687 6.429 6.181 478 HB2 TYR 68 1HB TYR 68 1.646 4.500 4.515 479 HB3 TYR 68 2HB TYR 68 0.882 5.991 3.973 480 HD1 TYR 68 2HD TYR 68 2.270 7.877 3.181 481 HD2 TYR 68 1HD TYR 68 3.986 4.117 4.191 482 HE1 TYR 68 2HE TYR 68 4.320 8.494 1.971 483 HE2 TYR 68 1HE TYR 68 6.042 4.724 2.985 484 HH TYR 68 HH TYR 68 6.222 7.408 0.897 485 H SER 69 H SER 69 0.361 3.977 6.426 486 HA SER 69 HA SER 69 2.402 2.851 8.221 487 HB2 SER 69 1HB SER 69 -0.468 3.386 8.761 488 HB3 SER 69 2HB SER 69 0.169 1.848 9.344 489 HG SER 69 HG SER 69 0.420 4.191 10.480 490 H ILE 70 H ILE 70 2.865 0.746 7.917 491 HA ILE 70 HA ILE 70 1.328 -0.673 5.850 492 HB ILE 70 HB ILE 70 4.195 -0.602 6.557 493 HG12 ILE 70 1HG1 ILE 70 2.889 -1.379 3.955 494 HG13 ILE 70 2HG1 ILE 70 3.030 0.302 4.455 495 HG21 ILE 70 1HG2 ILE 70 3.919 -2.850 7.159 496 HG22 ILE 70 2HG2 ILE 70 2.764 -3.147 5.862 497 HG23 ILE 70 3HG2 ILE 70 4.469 -2.901 5.485 498 HD11 ILE 70 3HD1 ILE 70 5.561 -1.028 4.697 499 HD12 ILE 70 1HD1 ILE 70 4.905 -1.225 3.073 500 HD13 ILE 70 2HD1 ILE 70 5.122 0.390 3.747 501 H GLN 71 H GLN 71 -0.008 -2.194 6.544 502 HA GLN 71 HA GLN 71 0.654 -3.623 9.035 503 HB2 GLN 71 1HB GLN 71 -2.134 -3.484 7.954 504 HB3 GLN 71 2HB GLN 71 -1.595 -3.717 9.611 505 HG2 GLN 71 1HG GLN 71 -0.643 -1.245 9.154 506 HG3 GLN 71 2HG GLN 71 -2.054 -1.238 8.097 507 HE21 GLN 71 1HE2 GLN 71 -3.138 0.264 9.351 508 HE22 GLN 71 2HE2 GLN 71 -3.809 -0.128 10.894 509 H VAL 72 H VAL 72 -0.015 -5.865 9.162 510 HA VAL 72 HA VAL 72 -0.464 -7.191 6.589 511 HB VAL 72 HB VAL 72 1.256 -8.900 7.130 512 HG11 VAL 72 1HG1 VAL 72 1.573 -6.440 5.942 513 HG12 VAL 72 2HG1 VAL 72 2.928 -6.517 7.071 514 HG13 VAL 72 3HG1 VAL 72 2.713 -7.782 5.859 515 HG21 VAL 72 3HG2 VAL 72 1.226 -7.922 9.635 516 HG22 VAL 72 1HG2 VAL 72 2.575 -8.841 8.965 517 HG23 VAL 72 2HG2 VAL 72 2.639 -7.079 8.998 518 H SER 73 H SER 73 -1.003 -9.523 6.873 519 HA SER 73 HA SER 73 -2.735 -9.823 9.210 520 HB2 SER 73 1HB SER 73 -4.014 -11.328 7.959 521 HB3 SER 73 2HB SER 73 -3.474 -10.174 6.738 522 HG SER 73 HG SER 73 -2.010 -11.627 6.000 523 H ASN 74 H ASN 74 -2.098 -10.994 10.882 524 HA ASN 74 HA ASN 74 -1.012 -13.564 10.731 525 HB2 ASN 74 1HB ASN 74 0.930 -11.597 10.248 526 HB3 ASN 74 2HB ASN 74 1.196 -12.115 11.910 527 HD21 ASN 74 1HD2 ASN 74 0.221 -13.745 8.910 528 HD22 ASN 74 2HD2 ASN 74 1.423 -14.983 8.995 529 H ASP 75 H ASP 75 -0.388 -14.419 12.860 530 HA ASP 75 HA ASP 75 -0.597 -12.944 15.239 531 HB2 ASP 75 1HB ASP 75 -3.043 -13.025 14.202 532 HB3 ASP 75 2HB ASP 75 -3.053 -14.612 14.966 533 H SER 76 H SER 76 -1.344 -16.076 13.751 534 HA SER 76 HA SER 76 -0.034 -17.396 16.034 535 HB2 SER 76 1HB SER 76 -2.030 -18.491 16.036 536 HB3 SER 76 2HB SER 76 -2.359 -18.106 14.347 537 HG SER 76 HG SER 76 -1.288 -19.859 13.715 538 H GLY 77 H GLY 77 0.084 -16.832 12.635 539 HA2 GLY 77 2HA GLY 77 2.404 -17.134 11.737 540 HA3 GLY 77 3HA GLY 77 2.313 -18.759 12.403 541 H SER 78 H SER 78 -0.068 -19.701 11.652 542 HA SER 78 HA SER 78 0.117 -19.666 8.718 543 HB2 SER 78 1HB SER 78 0.500 -21.846 9.890 544 HB3 SER 78 2HB SER 78 -1.161 -21.772 10.476 545 HG SER 78 HG SER 78 -1.271 -22.942 8.634 546 H THR 79 H THR 79 -1.974 -19.051 11.402 547 HA THR 79 HA THR 79 -4.225 -18.582 9.561 548 HB THR 79 HB THR 79 -4.340 -19.040 12.548 549 HG1 THR 79 1HG THR 79 -4.827 -20.737 10.321 550 HG21 THR 79 3HG2 THR 79 -6.336 -18.041 12.342 551 HG22 THR 79 1HG2 THR 79 -6.839 -19.501 11.493 552 HG23 THR 79 2HG2 THR 79 -6.281 -18.100 10.580 553 HA PRO 80 HA PRO 80 -2.807 -14.397 10.930 554 HB2 PRO 80 1HB PRO 80 -3.181 -13.234 8.507 555 HB3 PRO 80 2HB PRO 80 -1.692 -14.078 8.948 556 HG2 PRO 80 1HG PRO 80 -4.015 -15.054 7.332 557 HG3 PRO 80 2HG PRO 80 -2.279 -15.265 7.036 558 HD2 PRO 80 1HD PRO 80 -3.818 -17.209 8.126 559 HD3 PRO 80 2HD PRO 80 -2.105 -17.000 8.543 560 H THR 81 H THR 81 -4.149 -12.861 11.690 561 HA THR 81 HA THR 81 -6.714 -12.348 10.458 562 HB THR 81 HB THR 81 -7.935 -12.676 12.657 563 HG1 THR 81 1HG THR 81 -6.684 -13.229 14.268 564 HG21 THR 81 3HG2 THR 81 -6.943 -15.329 11.718 565 HG22 THR 81 1HG2 THR 81 -7.787 -14.284 10.577 566 HG23 THR 81 2HG2 THR 81 -8.590 -14.799 12.060 567 H ASN 82 H ASN 82 -4.439 -11.741 13.072 568 HA ASN 82 HA ASN 82 -5.617 -9.264 13.877 569 HB2 ASN 82 1HB ASN 82 -3.566 -10.973 14.823 570 HB3 ASN 82 2HB ASN 82 -2.831 -9.395 14.555 571 HD21 ASN 82 1HD2 ASN 82 -2.718 -8.369 16.411 572 HD22 ASN 82 2HD2 ASN 82 -3.973 -8.263 17.594 573 H TRP 83 H TRP 83 -5.052 -7.189 13.350 574 HA TRP 83 HA TRP 83 -3.092 -6.866 11.173 575 HB2 TRP 83 1HB TRP 83 -5.917 -6.111 11.286 576 HB3 TRP 83 2HB TRP 83 -4.863 -4.773 10.841 577 HD1 TRP 83 HD TRP 83 -3.773 -8.213 9.708 578 HE1 TRP 83 1HE TRP 83 -4.087 -8.406 7.161 579 HE3 TRP 83 3HE TRP 83 -6.412 -3.911 8.886 580 HZ2 TRP 83 2HZ TRP 83 -5.293 -6.929 5.079 581 HZ3 TRP 83 3HZ TRP 83 -7.106 -3.374 6.588 582 HH2 TRP 83 HH TRP 83 -6.558 -4.853 4.724 583 H THR 84 H THR 84 -1.452 -5.612 11.736 584 HA THR 84 HA THR 84 -1.935 -3.287 13.446 585 HB THR 84 HB THR 84 0.583 -4.644 14.091 586 HG1 THR 84 1HG THR 84 -1.912 -5.845 14.778 587 HG21 THR 84 3HG2 THR 84 -0.676 -2.637 15.202 588 HG22 THR 84 1HG2 THR 84 0.193 -3.797 16.205 589 HG23 THR 84 2HG2 THR 84 -1.560 -3.911 16.042 590 H THR 85 H THR 85 -0.506 -1.582 13.138 591 HA THR 85 HA THR 85 0.729 -1.455 10.572 592 HB THR 85 HB THR 85 1.412 0.807 11.195 593 HG1 THR 85 1HG THR 85 1.314 1.515 13.254 594 HG21 THR 85 3HG2 THR 85 -1.389 0.101 12.072 595 HG22 THR 85 1HG2 THR 85 -0.870 0.538 10.444 596 HG23 THR 85 2HG2 THR 85 -0.825 1.737 11.736 597 H VAL 86 H VAL 86 2.965 -0.954 10.142 598 HA VAL 86 HA VAL 86 4.808 -2.045 12.168 599 HB VAL 86 HB VAL 86 5.213 -2.284 9.190 600 HG11 VAL 86 1HG1 VAL 86 7.201 -3.135 9.703 601 HG12 VAL 86 2HG1 VAL 86 6.917 -2.659 11.378 602 HG13 VAL 86 3HG1 VAL 86 6.476 -4.278 10.833 603 HG21 VAL 86 3HG2 VAL 86 4.680 -4.820 10.226 604 HG22 VAL 86 1HG2 VAL 86 3.432 -3.772 10.902 605 HG23 VAL 86 2HG2 VAL 86 3.651 -3.870 9.154 606 H TYR 87 H TYR 87 4.013 0.552 10.130 607 HA TYR 87 HA TYR 87 6.488 1.920 10.888 608 HB2 TYR 87 1HB TYR 87 6.719 1.023 8.550 609 HB3 TYR 87 2HB TYR 87 5.371 2.053 8.083 610 HD1 TYR 87 1HD TYR 87 8.828 2.103 9.422 611 HD2 TYR 87 2HD TYR 87 5.705 4.335 7.586 612 HE1 TYR 87 1HE TYR 87 10.391 3.962 9.038 613 HE2 TYR 87 2HE TYR 87 7.260 6.200 7.196 614 HH TYR 87 HH TYR 87 9.651 6.914 8.543 615 H SER 88 H SER 88 6.285 4.124 11.197 616 HA SER 88 HA SER 88 4.283 5.813 10.363 617 HB2 SER 88 1HB SER 88 2.953 5.883 12.610 618 HB3 SER 88 2HB SER 88 2.537 4.668 11.401 619 HG SER 88 HG SER 88 4.346 4.195 13.532 620 H THR 89 H THR 89 4.370 7.879 11.348 621 HA THR 89 HA THR 89 5.781 8.476 13.703 622 HB THR 89 HB THR 89 7.740 7.707 12.411 623 HG1 THR 89 1HG THR 89 8.287 9.244 13.869 624 HG21 THR 89 3HG2 THR 89 8.519 8.939 10.480 625 HG22 THR 89 1HG2 THR 89 7.150 10.045 10.591 626 HG23 THR 89 2HG2 THR 89 6.885 8.352 10.173 627 H THR 90 H THR 90 4.747 9.494 10.511 628 HA THR 90 HA THR 90 3.647 11.360 9.800 629 HB THR 90 HB THR 90 3.482 12.585 12.504 630 HG1 THR 90 1HG THR 90 2.802 10.761 13.337 631 HG21 THR 90 3HG2 THR 90 1.658 12.189 10.148 632 HG22 THR 90 1HG2 THR 90 2.252 13.698 10.840 633 HG23 THR 90 2HG2 THR 90 1.050 12.742 11.708 634 H THR 91 H THR 91 6.313 11.430 9.512 635 HA THR 91 HA THR 91 6.955 14.245 10.071 636 HB THR 91 HB THR 91 9.158 13.799 10.721 637 HG1 THR 91 1HG THR 91 10.167 11.811 10.377 638 HG21 THR 91 3HG2 THR 91 7.567 13.194 12.479 639 HG22 THR 91 1HG2 THR 91 9.008 12.181 12.555 640 HG23 THR 91 2HG2 THR 91 7.515 11.539 11.871 641 H GLY 92 H GLY 92 6.249 12.134 7.754 642 HA2 GLY 92 2HA GLY 92 8.342 12.392 5.870 643 HA3 GLY 92 3HA GLY 92 6.677 11.966 5.503 644 H ASP 93 H ASP 93 7.385 13.293 3.552 645 HA ASP 93 HA ASP 93 6.172 15.885 3.784 646 HB2 ASP 93 1HB ASP 93 8.689 16.100 4.442 647 HB3 ASP 93 2HB ASP 93 8.973 15.932 2.711 648 H GLY 94 H GLY 94 5.949 13.302 2.308 649 HA2 GLY 94 2HA GLY 94 4.910 12.968 0.222 650 HA3 GLY 94 3HA GLY 94 5.585 14.492 -0.334 651 H ALA 95 H ALA 95 7.927 12.674 1.229 652 HA ALA 95 HA ALA 95 9.125 11.956 -1.339 653 HB1 ALA 95 1HB ALA 95 10.307 12.051 1.434 654 HB2 ALA 95 2HB ALA 95 11.192 11.634 -0.033 655 HB3 ALA 95 3HB ALA 95 10.513 13.250 0.157 656 H ILE 96 H ILE 96 10.351 9.874 -1.431 657 HA ILE 96 HA ILE 96 8.611 7.704 -0.893 658 HB ILE 96 HB ILE 96 11.534 7.440 -1.568 659 HG12 ILE 96 1HG1 ILE 96 10.049 7.290 -3.938 660 HG13 ILE 96 2HG1 ILE 96 9.424 8.705 -3.100 661 HG21 ILE 96 1HG2 ILE 96 10.881 5.378 -2.604 662 HG22 ILE 96 2HG2 ILE 96 10.235 5.409 -0.964 663 HG23 ILE 96 3HG2 ILE 96 9.174 5.731 -2.335 664 HD11 ILE 96 3HD1 ILE 96 11.210 9.890 -3.643 665 HD12 ILE 96 1HD1 ILE 96 12.299 8.654 -3.014 666 HD13 ILE 96 2HD1 ILE 96 11.707 8.547 -4.673 667 H ASP 97 H ASP 97 8.597 6.200 0.694 668 HA ASP 97 HA ASP 97 10.596 6.498 2.838 669 HB2 ASP 97 1HB ASP 97 8.119 7.145 3.279 670 HB3 ASP 97 2HB ASP 97 7.837 5.405 3.304 671 H ASP 98 H ASP 98 11.846 4.792 3.183 672 HA ASP 98 HA ASP 98 11.015 2.199 2.078 673 HB2 ASP 98 1HB ASP 98 13.081 2.783 1.125 674 HB3 ASP 98 2HB ASP 98 13.705 3.415 2.645 675 H ILE 99 H ILE 99 10.367 0.673 3.434 676 HA ILE 99 HA ILE 99 11.025 0.942 6.282 677 HB ILE 99 HB ILE 99 8.844 -0.599 4.881 678 HG12 ILE 99 1HG1 ILE 99 8.089 1.202 7.033 679 HG13 ILE 99 2HG1 ILE 99 8.990 2.041 5.775 680 HG21 ILE 99 1HG2 ILE 99 9.280 -2.050 6.603 681 HG22 ILE 99 2HG2 ILE 99 9.875 -0.777 7.669 682 HG23 ILE 99 3HG2 ILE 99 8.143 -0.952 7.385 683 HD11 ILE 99 3HD1 ILE 99 7.242 0.583 4.300 684 HD12 ILE 99 1HD1 ILE 99 6.286 0.934 5.739 685 HD13 ILE 99 2HD1 ILE 99 6.992 2.253 4.805 686 H THR 100 H THR 100 11.924 -0.727 7.455 687 HA THR 100 HA THR 100 12.623 -3.204 6.078 688 HB THR 100 HB THR 100 14.950 -3.086 6.498 689 HG1 THR 100 1HG THR 100 15.792 -1.826 7.998 690 HG21 THR 100 3HG2 THR 100 15.646 -1.337 5.095 691 HG22 THR 100 1HG2 THR 100 14.345 -0.273 5.629 692 HG23 THR 100 2HG2 THR 100 13.984 -1.657 4.598 693 H PHE 101 H PHE 101 12.228 -4.865 7.376 694 HA PHE 101 HA PHE 101 12.712 -4.613 10.246 695 HB2 PHE 101 1HB PHE 101 10.069 -5.282 8.975 696 HB3 PHE 101 2HB PHE 101 10.473 -5.856 10.590 697 HD1 PHE 101 2HD PHE 101 9.723 -2.920 8.540 698 HD2 PHE 101 1HD PHE 101 10.605 -4.340 12.454 699 HE1 PHE 101 2HE PHE 101 8.988 -0.769 9.482 700 HE2 PHE 101 1HE PHE 101 9.870 -2.192 13.402 701 HZ PHE 101 HZ PHE 101 9.061 -0.403 11.915 702 H ALA 102 H ALA 102 11.902 -6.969 11.182 703 HA ALA 102 HA ALA 102 13.794 -8.798 10.053 704 HB1 ALA 102 1HB ALA 102 13.790 -9.489 12.160 705 HB2 ALA 102 2HB ALA 102 12.355 -8.527 12.514 706 HB3 ALA 102 3HB ALA 102 12.184 -10.171 11.900 707 H ALA 103 H ALA 103 13.292 -10.992 9.388 708 HA ALA 103 HA ALA 103 11.335 -11.102 7.377 709 HB1 ALA 103 1HB ALA 103 13.282 -12.480 7.214 710 HB2 ALA 103 2HB ALA 103 12.891 -13.302 8.726 711 HB3 ALA 103 3HB ALA 103 11.872 -13.537 7.304 712 H THR 104 H THR 104 9.213 -11.323 7.546 713 HA THR 104 HA THR 104 8.113 -13.027 9.666 714 HB THR 104 HB THR 104 6.198 -11.276 9.798 715 HG1 THR 104 1HG THR 104 8.301 -9.838 8.576 716 HG21 THR 104 3HG2 THR 104 8.425 -11.788 11.348 717 HG22 THR 104 1HG2 THR 104 7.037 -10.811 11.823 718 HG23 THR 104 2HG2 THR 104 8.467 -10.038 11.140 719 H ASN 105 H ASN 105 6.363 -14.222 9.079 720 HA ASN 105 HA ASN 105 5.717 -14.285 6.258 721 HB2 ASN 105 1HB ASN 105 4.216 -16.235 7.069 722 HB3 ASN 105 2HB ASN 105 5.964 -16.438 7.139 723 HD21 ASN 105 1HD2 ASN 105 3.050 -16.010 8.960 724 HD22 ASN 105 2HD2 ASN 105 3.720 -16.375 10.510 725 H ALA 106 H ALA 106 3.859 -13.634 5.321 726 HA ALA 106 HA ALA 106 1.495 -13.073 6.886 727 HB1 ALA 106 1HB ALA 106 1.796 -10.690 5.451 728 HB2 ALA 106 2HB ALA 106 1.869 -10.908 7.200 729 HB3 ALA 106 3HB ALA 106 3.347 -10.973 6.240 730 H LYS 107 H LYS 107 -0.350 -12.466 5.530 731 HA LYS 107 HA LYS 107 -0.161 -13.763 2.920 732 HB2 LYS 107 1HB LYS 107 -2.523 -12.941 4.614 733 HB3 LYS 107 2HB LYS 107 -2.677 -13.629 3.002 734 HG2 LYS 107 1HG LYS 107 -1.174 -15.057 5.163 735 HG3 LYS 107 2HG LYS 107 -2.929 -15.185 5.018 736 HD2 LYS 107 1HD LYS 107 -1.425 -15.590 2.520 737 HD3 LYS 107 2HD LYS 107 -1.170 -16.818 3.762 738 HE2 LYS 107 1HE LYS 107 -3.890 -15.911 2.836 739 HE3 LYS 107 2HE LYS 107 -3.037 -17.293 2.150 740 HZ1 LYS 107 3HZ LYS 107 -3.263 -17.279 5.040 741 HZ2 LYS 107 1HZ LYS 107 -3.464 -18.552 3.943 742 HZ3 LYS 107 2HZ LYS 107 -4.725 -17.457 4.208 743 H PHE 108 H PHE 108 -2.046 -10.983 4.115 744 HA PHE 108 HA PHE 108 -1.361 -9.579 1.617 745 HB2 PHE 108 1HB PHE 108 -3.801 -8.933 3.243 746 HB3 PHE 108 2HB PHE 108 -3.498 -8.636 1.534 747 HD1 PHE 108 1HD PHE 108 -2.467 -11.440 0.898 748 HD2 PHE 108 2HD PHE 108 -5.884 -10.037 3.014 749 HE1 PHE 108 1HE PHE 108 -3.668 -13.510 0.325 750 HE2 PHE 108 2HE PHE 108 -7.089 -12.104 2.445 751 HZ PHE 108 HZ PHE 108 -5.982 -13.845 1.100 752 H VAL 109 H VAL 109 -1.582 -7.133 1.852 753 HA VAL 109 HA VAL 109 -0.658 -6.230 4.493 754 HB VAL 109 HB VAL 109 0.946 -4.692 3.333 755 HG11 VAL 109 1HG1 VAL 109 2.555 -6.174 3.776 756 HG12 VAL 109 2HG1 VAL 109 1.255 -7.317 4.121 757 HG13 VAL 109 3HG1 VAL 109 1.996 -7.278 2.521 758 HG21 VAL 109 3HG2 VAL 109 1.387 -6.197 0.977 759 HG22 VAL 109 1HG2 VAL 109 -0.325 -5.775 1.026 760 HG23 VAL 109 2HG2 VAL 109 0.899 -4.509 1.120 761 H ARG 110 H ARG 110 -1.020 -4.001 4.943 762 HA ARG 110 HA ARG 110 -2.924 -2.673 3.134 763 HB2 ARG 110 1HB ARG 110 -4.202 -3.621 4.966 764 HB3 ARG 110 2HB ARG 110 -3.115 -2.895 6.143 765 HG2 ARG 110 1HG ARG 110 -3.825 -0.653 5.119 766 HG3 ARG 110 2HG ARG 110 -5.151 -1.565 4.397 767 HD2 ARG 110 1HD ARG 110 -6.276 -1.491 6.309 768 HD3 ARG 110 2HD ARG 110 -4.938 -2.272 7.151 769 HE ARG 110 HE ARG 110 -4.215 0.369 6.903 770 HH11 ARG 110 1HH1 ARG 110 -6.850 -1.399 8.338 771 HH12 ARG 110 2HH1 ARG 110 -7.124 -0.231 9.588 772 HH21 ARG 110 1HH2 ARG 110 -4.566 1.913 8.546 773 HH22 ARG 110 2HH2 ARG 110 -5.825 1.652 9.705 774 H VAL 111 H VAL 111 -2.717 -0.479 2.921 775 HA VAL 111 HA VAL 111 -0.575 0.816 4.475 776 HB VAL 111 HB VAL 111 -1.128 1.460 1.586 777 HG11 VAL 111 1HG1 VAL 111 0.830 2.299 3.642 778 HG12 VAL 111 2HG1 VAL 111 1.429 2.114 1.992 779 HG13 VAL 111 3HG1 VAL 111 0.097 3.221 2.330 780 HG21 VAL 111 3HG2 VAL 111 1.233 0.146 1.497 781 HG22 VAL 111 1HG2 VAL 111 0.393 -0.779 2.741 782 HG23 VAL 111 2HG2 VAL 111 -0.325 -0.600 1.141 783 H TYR 112 H TYR 112 -1.423 2.374 5.675 784 HA TYR 112 HA TYR 112 -3.796 3.801 4.692 785 HB2 TYR 112 1HB TYR 112 -3.515 2.573 7.060 786 HB3 TYR 112 2HB TYR 112 -2.871 4.152 7.494 787 HD1 TYR 112 1HD TYR 112 -5.858 2.365 6.273 788 HD2 TYR 112 2HD TYR 112 -4.304 6.049 7.728 789 HE1 TYR 112 1HE TYR 112 -8.150 3.213 6.556 790 HE2 TYR 112 2HE TYR 112 -6.590 6.907 8.017 791 HH TYR 112 HH TYR 112 -9.046 5.512 8.385 792 H ALA 113 H ALA 113 -3.920 6.084 4.891 793 HA ALA 113 HA ALA 113 -1.499 7.556 5.528 794 HB1 ALA 113 1HB ALA 113 -1.520 6.791 3.037 795 HB2 ALA 113 2HB ALA 113 -2.681 8.105 2.842 796 HB3 ALA 113 3HB ALA 113 -1.061 8.444 3.448 797 H THR 114 H THR 114 -4.658 7.943 3.912 798 HA THR 114 HA THR 114 -6.197 9.643 4.043 799 HB THR 114 HB THR 114 -6.766 8.242 5.988 800 HG1 THR 114 1HG THR 114 -7.046 11.010 6.604 801 HG21 THR 114 3HG2 THR 114 -4.865 10.091 7.414 802 HG22 THR 114 1HG2 THR 114 -4.814 8.330 7.332 803 HG23 THR 114 2HG2 THR 114 -6.082 9.133 8.258 804 H THR 115 H THR 115 -3.604 10.663 3.626 805 HA THR 115 HA THR 115 -3.634 13.119 5.254 806 HB THR 115 HB THR 115 -1.537 12.096 5.603 807 HG1 THR 115 1HG THR 115 -1.113 14.210 5.192 808 HG21 THR 115 3HG2 THR 115 -0.106 11.253 3.824 809 HG22 THR 115 1HG2 THR 115 -1.292 11.739 2.613 810 HG23 THR 115 2HG2 THR 115 -1.680 10.460 3.763 811 H ARG 116 H ARG 116 -3.209 15.125 4.195 812 HA ARG 116 HA ARG 116 -4.388 15.251 1.557 813 HB2 ARG 116 1HB ARG 116 -4.411 17.642 1.869 814 HB3 ARG 116 2HB ARG 116 -4.979 16.873 3.345 815 HG2 ARG 116 1HG ARG 116 -2.230 17.146 3.691 816 HG3 ARG 116 2HG ARG 116 -2.755 18.654 2.941 817 HD2 ARG 116 1HD ARG 116 -4.684 18.460 4.736 818 HD3 ARG 116 2HD ARG 116 -3.482 17.480 5.576 819 HE ARG 116 HE ARG 116 -2.416 19.972 4.675 820 HH11 ARG 116 1HH1 ARG 116 -4.290 18.453 7.186 821 HH12 ARG 116 2HH1 ARG 116 -3.892 19.642 8.382 822 HH21 ARG 116 1HH2 ARG 116 -1.886 21.544 6.241 823 HH22 ARG 116 2HH2 ARG 116 -2.525 21.400 7.844 824 H ALA 117 H ALA 117 -3.400 16.544 -0.174 825 HA ALA 117 HA ALA 117 -0.458 16.420 -0.141 826 HB1 ALA 117 1HB ALA 117 -1.003 14.592 -1.481 827 HB2 ALA 117 2HB ALA 117 -2.353 15.434 -2.243 828 HB3 ALA 117 3HB ALA 117 -0.696 15.884 -2.642 829 H THR 118 H THR 118 -2.729 17.463 -2.651 830 HA THR 118 HA THR 118 -2.486 20.237 -2.165 831 HB THR 118 HB THR 118 -1.164 20.082 -4.679 832 HG1 THR 118 1HG THR 118 -0.138 18.216 -4.233 833 HG21 THR 118 3HG2 THR 118 -0.361 21.078 -1.949 834 HG22 THR 118 1HG2 THR 118 -1.008 22.015 -3.294 835 HG23 THR 118 2HG2 THR 118 0.613 21.331 -3.397 836 H ALA 119 H ALA 119 -2.828 17.786 -4.710 837 HA ALA 119 HA ALA 119 -5.340 19.057 -5.512 838 HB1 ALA 119 1HB ALA 119 -4.195 18.198 -7.914 839 HB2 ALA 119 2HB ALA 119 -4.477 19.861 -7.393 840 HB3 ALA 119 3HB ALA 119 -2.925 19.087 -7.071 841 H TYR 120 H TYR 120 -3.163 16.282 -5.862 842 HA TYR 120 HA TYR 120 -5.450 14.575 -6.523 843 HB2 TYR 120 1HB TYR 120 -2.468 14.114 -6.666 844 HB3 TYR 120 2HB TYR 120 -3.655 12.849 -6.961 845 HD1 TYR 120 1HD TYR 120 -2.966 16.355 -8.075 846 HD2 TYR 120 2HD TYR 120 -4.199 12.429 -9.157 847 HE1 TYR 120 1HE TYR 120 -3.124 17.060 -10.425 848 HE2 TYR 120 2HE TYR 120 -4.358 13.123 -11.512 849 HH TYR 120 HH TYR 120 -3.230 15.006 -12.957 850 H GLY 121 H GLY 121 -5.574 12.433 -5.469 851 HA2 GLY 121 2HA GLY 121 -5.469 12.743 -2.615 852 HA3 GLY 121 3HA GLY 121 -6.041 11.331 -3.492 853 H TYR 122 H TYR 122 -4.876 9.554 -3.246 854 HA TYR 122 HA TYR 122 -2.094 9.828 -2.333 855 HB2 TYR 122 1HB TYR 122 -2.343 7.523 -1.475 856 HB3 TYR 122 2HB TYR 122 -3.529 8.622 -0.779 857 HD1 TYR 122 1HD TYR 122 -5.896 8.527 -1.548 858 HD2 TYR 122 2HD TYR 122 -3.013 5.648 -2.777 859 HE1 TYR 122 1HE TYR 122 -7.708 7.017 -2.244 860 HE2 TYR 122 2HE TYR 122 -4.818 4.131 -3.477 861 HH TYR 122 HH TYR 122 -7.815 4.273 -2.516 862 H SER 123 H SER 123 -0.558 9.429 -3.764 863 HA SER 123 HA SER 123 -1.203 7.911 -6.179 864 HB2 SER 123 1HB SER 123 1.469 9.175 -5.823 865 HB3 SER 123 2HB SER 123 0.446 9.088 -7.256 866 HG SER 123 HG SER 123 -0.910 10.663 -6.256 867 H LEU 124 H LEU 124 0.087 6.185 -6.914 868 HA LEU 124 HA LEU 124 2.083 5.081 -5.108 869 HB2 LEU 124 1HB LEU 124 -0.134 4.185 -4.391 870 HB3 LEU 124 2HB LEU 124 -0.296 3.453 -5.986 871 HG LEU 124 HG LEU 124 2.179 2.594 -4.910 872 HD11 LEU 124 1HD1 LEU 124 0.190 1.583 -3.023 873 HD12 LEU 124 2HD1 LEU 124 0.595 3.284 -2.797 874 HD13 LEU 124 3HD1 LEU 124 1.867 2.063 -2.761 875 HD21 LEU 124 3HD2 LEU 124 1.370 0.498 -5.427 876 HD22 LEU 124 1HD2 LEU 124 0.391 1.525 -6.476 877 HD23 LEU 124 2HD2 LEU 124 -0.284 0.905 -4.969 878 H TRP 125 H TRP 125 3.508 5.556 -6.833 879 HA TRP 125 HA TRP 125 3.148 3.922 -9.251 880 HB2 TRP 125 1HB TRP 125 4.642 6.470 -8.706 881 HB3 TRP 125 2HB TRP 125 5.087 5.452 -10.073 882 HD1 TRP 125 HD TRP 125 1.401 5.620 -9.258 883 HE1 TRP 125 1HE TRP 125 0.191 6.996 -11.066 884 HE3 TRP 125 3HE TRP 125 5.475 7.485 -11.719 885 HZ2 TRP 125 2HZ TRP 125 0.874 8.653 -13.247 886 HZ3 TRP 125 3HZ TRP 125 5.111 8.957 -13.656 887 HH2 TRP 125 HH TRP 125 2.857 9.527 -14.403 888 H GLU 126 H GLU 126 5.340 4.639 -6.605 889 HA GLU 126 HA GLU 126 7.040 2.396 -7.479 890 HB2 GLU 126 1HB GLU 126 7.846 4.980 -7.108 891 HB3 GLU 126 2HB GLU 126 8.184 4.281 -5.531 892 HG2 GLU 126 1HG GLU 126 10.122 3.646 -6.410 893 HG3 GLU 126 2HG GLU 126 9.194 2.395 -7.234 894 H PHE 127 H PHE 127 5.259 1.197 -6.301 895 HA PHE 127 HA PHE 127 5.876 1.084 -3.421 896 HB2 PHE 127 1HB PHE 127 3.599 1.831 -3.729 897 HB3 PHE 127 2HB PHE 127 3.270 0.508 -4.842 898 HD1 PHE 127 2HD PHE 127 5.198 0.101 -1.743 899 HD2 PHE 127 1HD PHE 127 1.414 -0.378 -3.633 900 HE1 PHE 127 2HE PHE 127 4.437 -1.289 0.139 901 HE2 PHE 127 1HE PHE 127 0.646 -1.766 -1.753 902 HZ PHE 127 HZ PHE 127 2.159 -2.225 0.136 903 H GLU 128 H GLU 128 7.254 -0.566 -3.179 904 HA GLU 128 HA GLU 128 6.625 -3.106 -4.533 905 HB2 GLU 128 1HB GLU 128 8.881 -1.819 -4.916 906 HB3 GLU 128 2HB GLU 128 9.320 -2.525 -3.368 907 HG2 GLU 128 1HG GLU 128 9.082 -4.731 -4.209 908 HG3 GLU 128 2HG GLU 128 8.341 -4.148 -5.698 909 H VAL 129 H VAL 129 5.987 -4.740 -3.299 910 HA VAL 129 HA VAL 129 6.895 -4.899 -0.520 911 HB VAL 129 HB VAL 129 4.792 -3.840 -0.225 912 HG11 VAL 129 1HG1 VAL 129 3.333 -3.906 -1.907 913 HG12 VAL 129 2HG1 VAL 129 4.062 -5.370 -2.571 914 HG13 VAL 129 3HG1 VAL 129 2.838 -5.488 -1.307 915 HG21 VAL 129 3HG2 VAL 129 3.742 -6.541 0.201 916 HG22 VAL 129 1HG2 VAL 129 5.360 -6.278 0.852 917 HG23 VAL 129 2HG2 VAL 129 4.027 -5.239 1.355 918 H TYR 130 H TYR 130 7.892 -6.798 -0.416 919 HA TYR 130 HA TYR 130 6.623 -9.249 -0.638 920 HB2 TYR 130 1HB TYR 130 7.141 -8.229 -3.184 921 HB3 TYR 130 2HB TYR 130 8.425 -9.402 -2.910 922 HD1 TYR 130 2HD TYR 130 4.858 -9.430 -1.819 923 HD2 TYR 130 1HD TYR 130 7.882 -11.268 -4.181 924 HE1 TYR 130 2HE TYR 130 3.304 -11.254 -2.379 925 HE2 TYR 130 1HE TYR 130 6.337 -13.096 -4.748 926 HH TYR 130 HH TYR 130 4.141 -13.722 -4.732 927 H GLY 131 H GLY 131 8.129 -11.095 -0.485 928 HA2 GLY 131 2HA GLY 131 10.931 -10.535 -0.076 929 HA3 GLY 131 3HA GLY 131 10.049 -10.845 1.412 Start of MODEL 3 1 H ASN 1 H ASN 1 -10.297 -12.950 -15.378 2 HA ASN 1 HA ASN 1 -10.952 -11.098 -16.527 3 HB2 ASN 1 1HB ASN 1 -12.152 -10.241 -13.884 4 HB3 ASN 1 2HB ASN 1 -12.492 -9.510 -15.449 5 HD21 ASN 1 1HD2 ASN 1 -14.492 -10.510 -13.851 6 HD22 ASN 1 2HD2 ASN 1 -15.179 -11.907 -14.599 7 H LEU 2 H LEU 2 -8.653 -10.640 -16.651 8 HA LEU 2 HA LEU 2 -6.841 -9.271 -16.527 9 HB2 LEU 2 1HB LEU 2 -8.978 -7.330 -15.667 10 HB3 LEU 2 2HB LEU 2 -7.315 -6.868 -16.025 11 HG LEU 2 HG LEU 2 -7.957 -8.117 -18.324 12 HD11 LEU 2 1HD1 LEU 2 -10.398 -8.025 -17.052 13 HD12 LEU 2 2HD1 LEU 2 -10.134 -8.229 -18.783 14 HD13 LEU 2 3HD1 LEU 2 -10.440 -6.623 -18.122 15 HD21 LEU 2 3HD2 LEU 2 -6.993 -5.868 -18.042 16 HD22 LEU 2 1HD2 LEU 2 -8.602 -5.243 -17.680 17 HD23 LEU 2 2HD2 LEU 2 -8.255 -5.912 -19.274 18 H ALA 3 H ALA 3 -6.139 -10.672 -14.735 19 HA ALA 3 HA ALA 3 -5.454 -9.066 -12.437 20 HB1 ALA 3 1HB ALA 3 -7.750 -10.538 -12.204 21 HB2 ALA 3 2HB ALA 3 -6.535 -11.617 -11.517 22 HB3 ALA 3 3HB ALA 3 -6.743 -9.993 -10.862 23 H LEU 4 H LEU 4 -3.723 -9.929 -11.221 24 HA LEU 4 HA LEU 4 -2.490 -12.374 -12.274 25 HB2 LEU 4 1HB LEU 4 -1.540 -9.700 -12.648 26 HB3 LEU 4 2HB LEU 4 -0.398 -10.593 -11.646 27 HG LEU 4 HG LEU 4 -1.338 -11.376 -14.405 28 HD11 LEU 4 1HD1 LEU 4 1.037 -10.961 -14.996 29 HD12 LEU 4 2HD1 LEU 4 1.276 -10.274 -13.389 30 HD13 LEU 4 3HD1 LEU 4 0.159 -9.507 -14.519 31 HD21 LEU 4 3HD2 LEU 4 0.642 -12.690 -12.547 32 HD22 LEU 4 1HD2 LEU 4 0.370 -13.137 -14.231 33 HD23 LEU 4 2HD2 LEU 4 -0.920 -13.339 -13.046 34 H ASN 5 H ASN 5 -0.241 -12.518 -10.817 35 HA ASN 5 HA ASN 5 -1.127 -13.359 -8.295 36 HB2 ASN 5 1HB ASN 5 1.367 -13.296 -9.756 37 HB3 ASN 5 2HB ASN 5 1.632 -12.892 -8.063 38 HD21 ASN 5 1HD2 ASN 5 -0.636 -15.093 -9.669 39 HD22 ASN 5 2HD2 ASN 5 -0.144 -16.505 -8.802 40 H LYS 6 H LYS 6 -0.280 -10.257 -9.439 41 HA LYS 6 HA LYS 6 0.692 -9.039 -7.109 42 HB2 LYS 6 1HB LYS 6 -0.174 -8.215 -9.717 43 HB3 LYS 6 2HB LYS 6 -0.868 -7.138 -8.512 44 HG2 LYS 6 1HG LYS 6 1.099 -6.067 -8.901 45 HG3 LYS 6 2HG LYS 6 1.602 -7.138 -7.590 46 HD2 LYS 6 1HD LYS 6 1.812 -8.257 -10.310 47 HD3 LYS 6 2HD LYS 6 2.905 -6.919 -9.946 48 HE2 LYS 6 1HE LYS 6 4.103 -8.133 -8.461 49 HE3 LYS 6 2HE LYS 6 2.690 -9.007 -7.875 50 HZ1 LYS 6 3HZ LYS 6 4.628 -9.848 -9.734 51 HZ2 LYS 6 1HZ LYS 6 3.121 -9.802 -10.505 52 HZ3 LYS 6 2HZ LYS 6 3.325 -10.720 -9.099 53 H ALA 7 H ALA 7 -2.557 -8.450 -8.439 54 HA ALA 7 HA ALA 7 -4.585 -8.171 -7.445 55 HB1 ALA 7 1HB ALA 7 -4.168 -9.307 -4.863 56 HB2 ALA 7 2HB ALA 7 -5.091 -9.950 -6.221 57 HB3 ALA 7 3HB ALA 7 -3.373 -10.318 -6.069 58 H THR 8 H THR 8 -5.211 -6.230 -6.796 59 HA THR 8 HA THR 8 -4.131 -5.119 -4.315 60 HB THR 8 HB THR 8 -3.290 -3.192 -5.182 61 HG1 THR 8 1HG THR 8 -4.911 -2.194 -6.181 62 HG21 THR 8 3HG2 THR 8 -2.203 -5.185 -6.345 63 HG22 THR 8 1HG2 THR 8 -1.966 -3.605 -7.088 64 HG23 THR 8 2HG2 THR 8 -3.144 -4.730 -7.764 65 H ALA 9 H ALA 9 -5.455 -3.482 -3.365 66 HA ALA 9 HA ALA 9 -8.032 -2.904 -4.557 67 HB1 ALA 9 1HB ALA 9 -9.051 -3.696 -2.237 68 HB2 ALA 9 2HB ALA 9 -8.891 -4.788 -3.613 69 HB3 ALA 9 3HB ALA 9 -7.695 -4.821 -2.318 70 H THR 10 H THR 10 -8.961 -1.059 -3.758 71 HA THR 10 HA THR 10 -7.763 0.197 -1.397 72 HB THR 10 HB THR 10 -6.982 2.047 -2.429 73 HG1 THR 10 1HG THR 10 -9.039 1.772 -4.387 74 HG21 THR 10 3HG2 THR 10 -6.137 -0.020 -3.729 75 HG22 THR 10 1HG2 THR 10 -5.874 1.578 -4.427 76 HG23 THR 10 2HG2 THR 10 -7.183 0.559 -5.025 77 H SER 11 H SER 11 -9.012 2.322 -0.913 78 HA SER 11 HA SER 11 -11.839 1.615 -0.893 79 HB2 SER 11 1HB SER 11 -11.160 2.217 1.258 80 HB3 SER 11 2HB SER 11 -10.135 3.528 0.675 81 HG SER 11 HG SER 11 -11.784 4.744 1.120 82 H SER 12 H SER 12 -9.717 4.238 -1.944 83 HA SER 12 HA SER 12 -11.982 5.371 -3.452 84 HB2 SER 12 1HB SER 12 -10.356 6.638 -1.569 85 HB3 SER 12 2HB SER 12 -9.742 7.193 -3.127 86 HG SER 12 HG SER 12 -11.540 8.257 -3.465 87 H ILE 13 H ILE 13 -11.667 5.961 -5.587 88 HA ILE 13 HA ILE 13 -9.070 5.659 -6.822 89 HB ILE 13 HB ILE 13 -9.881 3.343 -6.805 90 HG12 ILE 13 1HG1 ILE 13 -10.005 4.532 -9.583 91 HG13 ILE 13 2HG1 ILE 13 -8.513 4.238 -8.697 92 HG21 ILE 13 1HG2 ILE 13 -12.200 3.449 -6.758 93 HG22 ILE 13 2HG2 ILE 13 -12.274 4.580 -8.108 94 HG23 ILE 13 3HG2 ILE 13 -11.863 2.890 -8.397 95 HD11 ILE 13 3HD1 ILE 13 -9.299 1.808 -8.564 96 HD12 ILE 13 1HD1 ILE 13 -10.446 2.256 -9.828 97 HD13 ILE 13 2HD1 ILE 13 -8.712 2.410 -10.114 98 H GLU 14 H GLU 14 -8.934 6.604 -8.870 99 HA GLU 14 HA GLU 14 -10.713 8.735 -9.362 100 HB2 GLU 14 1HB GLU 14 -8.496 7.496 -10.977 101 HB3 GLU 14 2HB GLU 14 -9.449 8.835 -11.598 102 HG2 GLU 14 1HG GLU 14 -8.690 9.661 -9.066 103 HG3 GLU 14 2HG GLU 14 -7.269 8.838 -9.705 104 H THR 15 H THR 15 -10.178 5.695 -11.137 105 HA THR 15 HA THR 15 -12.485 6.174 -12.817 106 HB THR 15 HB THR 15 -10.368 5.026 -13.613 107 HG1 THR 15 1HG THR 15 -11.578 4.070 -15.103 108 HG21 THR 15 3HG2 THR 15 -9.683 3.079 -12.749 109 HG22 THR 15 1HG2 THR 15 -11.308 2.398 -12.793 110 HG23 THR 15 2HG2 THR 15 -10.806 3.391 -11.425 111 H ALA 16 H ALA 16 -13.607 3.717 -13.135 112 HA ALA 16 HA ALA 16 -15.122 3.452 -10.666 113 HB1 ALA 16 1HB ALA 16 -15.974 3.534 -13.186 114 HB2 ALA 16 2HB ALA 16 -15.771 1.789 -13.031 115 HB3 ALA 16 3HB ALA 16 -16.837 2.655 -11.924 116 H GLY 17 H GLY 17 -12.594 2.521 -10.268 117 HA2 GLY 17 2HA GLY 17 -11.569 0.701 -9.295 118 HA3 GLY 17 3HA GLY 17 -13.086 -0.171 -9.460 119 H HIS 18 H HIS 18 -9.953 0.378 -10.760 120 HA HIS 18 HA HIS 18 -9.849 -2.009 -12.178 121 HB2 HIS 18 1HB HIS 18 -11.324 -0.062 -13.584 122 HB3 HIS 18 2HB HIS 18 -9.759 -0.157 -14.385 123 HD1 HIS 18 1HD HIS 18 -12.978 -1.834 -14.155 124 HD2 HIS 18 2HD HIS 18 -9.110 -2.878 -15.255 125 HE1 HIS 18 1HE HIS 18 -13.203 -3.978 -15.449 126 H GLU 19 H GLU 19 -8.732 1.262 -11.753 127 HA GLU 19 HA GLU 19 -6.247 1.028 -13.073 128 HB2 GLU 19 1HB GLU 19 -7.622 3.049 -11.792 129 HB3 GLU 19 2HB GLU 19 -6.242 2.786 -10.735 130 HG2 GLU 19 1HG GLU 19 -5.605 4.465 -12.254 131 HG3 GLU 19 2HG GLU 19 -4.780 2.995 -12.770 132 H GLY 20 H GLY 20 -7.381 -0.079 -9.997 133 HA2 GLY 20 2HA GLY 20 -4.861 -0.326 -8.703 134 HA3 GLY 20 3HA GLY 20 -6.343 -1.154 -8.250 135 H ASP 21 H ASP 21 -6.715 -2.452 -10.804 136 HA ASP 21 HA ASP 21 -5.092 -4.755 -10.342 137 HB2 ASP 21 1HB ASP 21 -6.690 -4.370 -12.849 138 HB3 ASP 21 2HB ASP 21 -6.424 -5.839 -11.912 139 H LYS 22 H LYS 22 -4.497 -1.897 -11.941 140 HA LYS 22 HA LYS 22 -3.108 -2.737 -14.240 141 HB2 LYS 22 1HB LYS 22 -2.701 -0.261 -12.552 142 HB3 LYS 22 2HB LYS 22 -2.051 -0.502 -14.168 143 HG2 LYS 22 1HG LYS 22 -4.984 -0.771 -13.769 144 HG3 LYS 22 2HG LYS 22 -4.271 0.844 -13.768 145 HD2 LYS 22 1HD LYS 22 -3.780 -1.168 -15.953 146 HD3 LYS 22 2HD LYS 22 -5.098 0.003 -16.003 147 HE2 LYS 22 1HE LYS 22 -3.408 1.814 -15.741 148 HE3 LYS 22 2HE LYS 22 -2.144 0.592 -15.876 149 HZ1 LYS 22 3HZ LYS 22 -2.997 1.919 -17.958 150 HZ2 LYS 22 1HZ LYS 22 -4.171 0.701 -17.982 151 HZ3 LYS 22 2HZ LYS 22 -2.533 0.297 -18.082 152 H ALA 23 H ALA 23 -2.332 -2.995 -10.941 153 HA ALA 23 HA ALA 23 0.504 -2.874 -11.119 154 HB1 ALA 23 1HB ALA 23 0.515 -3.328 -8.893 155 HB2 ALA 23 2HB ALA 23 -1.167 -2.822 -9.051 156 HB3 ALA 23 3HB ALA 23 -0.762 -4.538 -9.018 157 H VAL 24 H VAL 24 -1.717 -5.124 -12.250 158 HA VAL 24 HA VAL 24 -0.719 -7.617 -11.805 159 HB VAL 24 HB VAL 24 -1.368 -8.146 -14.213 160 HG11 VAL 24 1HG1 VAL 24 -3.809 -6.982 -13.412 161 HG12 VAL 24 2HG1 VAL 24 -3.270 -8.647 -13.183 162 HG13 VAL 24 3HG1 VAL 24 -2.949 -7.436 -11.940 163 HG21 VAL 24 3HG2 VAL 24 -0.997 -6.063 -15.291 164 HG22 VAL 24 1HG2 VAL 24 -2.740 -6.326 -15.288 165 HG23 VAL 24 2HG2 VAL 24 -2.016 -5.206 -14.135 166 H ASP 25 H ASP 25 0.465 -5.319 -14.246 167 HA ASP 25 HA ASP 25 2.402 -6.857 -15.456 168 HB2 ASP 25 1HB ASP 25 1.700 -4.131 -15.410 169 HB3 ASP 25 2HB ASP 25 3.421 -4.192 -15.039 170 H GLY 26 H GLY 26 2.697 -4.930 -12.486 171 HA2 GLY 26 2HA GLY 26 4.078 -5.290 -10.663 172 HA3 GLY 26 3HA GLY 26 4.714 -6.715 -11.471 173 H ASN 27 H ASN 27 4.762 -3.860 -13.340 174 HA ASN 27 HA ASN 27 7.539 -3.289 -12.575 175 HB2 ASN 27 1HB ASN 27 6.927 -4.724 -14.835 176 HB3 ASN 27 2HB ASN 27 7.022 -3.079 -15.458 177 HD21 ASN 27 1HD2 ASN 27 8.936 -2.622 -16.237 178 HD22 ASN 27 2HD2 ASN 27 10.452 -3.181 -15.627 179 H ALA 28 H ALA 28 8.101 -1.357 -14.448 180 HA ALA 28 HA ALA 28 6.827 0.910 -13.365 181 HB1 ALA 28 1HB ALA 28 8.127 1.221 -15.991 182 HB2 ALA 28 2HB ALA 28 8.376 2.105 -14.486 183 HB3 ALA 28 3HB ALA 28 9.124 0.524 -14.713 184 H ALA 29 H ALA 29 5.828 -1.247 -15.770 185 HA ALA 29 HA ALA 29 4.357 0.538 -17.430 186 HB1 ALA 29 1HB ALA 29 3.530 -2.304 -17.154 187 HB2 ALA 29 2HB ALA 29 3.705 -1.310 -18.601 188 HB3 ALA 29 3HB ALA 29 5.135 -1.957 -17.799 189 H THR 30 H THR 30 3.897 -0.417 -14.271 190 HA THR 30 HA THR 30 0.975 -0.257 -14.403 191 HB THR 30 HB THR 30 0.887 -1.166 -12.229 192 HG1 THR 30 1HG THR 30 2.697 -1.256 -10.871 193 HG21 THR 30 3HG2 THR 30 1.575 -3.226 -12.775 194 HG22 THR 30 1HG2 THR 30 3.264 -2.728 -12.854 195 HG23 THR 30 2HG2 THR 30 2.211 -2.500 -14.251 196 H ARG 31 H ARG 31 -0.134 1.476 -13.730 197 HA ARG 31 HA ARG 31 1.227 3.491 -12.090 198 HB2 ARG 31 1HB ARG 31 0.126 5.261 -13.531 199 HB3 ARG 31 2HB ARG 31 1.474 4.400 -14.264 200 HG2 ARG 31 1HG ARG 31 -1.109 3.159 -14.792 201 HG3 ARG 31 2HG ARG 31 -0.977 4.808 -15.407 202 HD2 ARG 31 1HD ARG 31 1.427 3.307 -15.943 203 HD3 ARG 31 2HD ARG 31 0.010 2.475 -16.583 204 HE ARG 31 HE ARG 31 -0.286 5.077 -17.375 205 HH11 ARG 31 1HH1 ARG 31 2.156 2.626 -17.761 206 HH12 ARG 31 2HH1 ARG 31 2.696 3.222 -19.295 207 HH21 ARG 31 1HH2 ARG 31 0.416 5.871 -19.395 208 HH22 ARG 31 2HH2 ARG 31 1.706 5.068 -20.224 209 H TRP 32 H TRP 32 0.059 3.461 -10.277 210 HA TRP 32 HA TRP 32 -2.811 3.029 -10.363 211 HB2 TRP 32 1HB TRP 32 -1.770 1.867 -8.596 212 HB3 TRP 32 2HB TRP 32 -0.793 3.260 -8.141 213 HD1 TRP 32 HD TRP 32 -1.591 4.325 -5.968 214 HE1 TRP 32 1HE TRP 32 -3.844 4.601 -4.754 215 HE3 TRP 32 3HE TRP 32 -4.631 2.006 -9.362 216 HZ2 TRP 32 2HZ TRP 32 -6.551 3.925 -5.180 217 HZ3 TRP 32 3HZ TRP 32 -7.040 1.862 -8.882 218 HH2 TRP 32 HH TRP 32 -7.978 2.802 -6.834 219 H ALA 33 H ALA 33 -4.370 4.500 -9.757 220 HA ALA 33 HA ALA 33 -3.516 7.219 -9.078 221 HB1 ALA 33 1HB ALA 33 -3.760 7.213 -11.500 222 HB2 ALA 33 2HB ALA 33 -5.397 6.577 -11.347 223 HB3 ALA 33 3HB ALA 33 -5.019 8.192 -10.748 224 H SER 34 H SER 34 -4.691 8.036 -7.472 225 HA SER 34 HA SER 34 -7.357 6.885 -6.963 226 HB2 SER 34 1HB SER 34 -5.334 6.398 -5.329 227 HB3 SER 34 2HB SER 34 -5.728 8.004 -4.719 228 HG SER 34 HG SER 34 -7.473 5.773 -4.898 229 H ALA 35 H ALA 35 -9.004 8.275 -6.698 230 HA ALA 35 HA ALA 35 -8.736 10.976 -7.429 231 HB1 ALA 35 1HB ALA 35 -11.023 11.117 -7.253 232 HB2 ALA 35 2HB ALA 35 -10.807 9.378 -7.452 233 HB3 ALA 35 3HB ALA 35 -11.090 10.053 -5.848 234 H TYR 36 H TYR 36 -9.025 12.885 -6.207 235 HA TYR 36 HA TYR 36 -7.699 12.856 -3.683 236 HB2 TYR 36 1HB TYR 36 -8.240 15.314 -3.688 237 HB3 TYR 36 2HB TYR 36 -7.362 14.752 -5.106 238 HD1 TYR 36 1HD TYR 36 -10.697 15.768 -3.867 239 HD2 TYR 36 2HD TYR 36 -8.287 14.958 -7.279 240 HE1 TYR 36 1HE TYR 36 -12.436 16.730 -5.316 241 HE2 TYR 36 2HE TYR 36 -10.019 15.920 -8.738 242 HH TYR 36 HH TYR 36 -13.097 16.383 -7.876 243 H GLY 37 H GLY 37 -8.869 14.549 -2.011 244 HA2 GLY 37 2HA GLY 37 -10.500 14.777 -0.411 245 HA3 GLY 37 3HA GLY 37 -11.652 14.254 -1.631 246 H ALA 38 H ALA 38 -12.482 13.364 0.560 247 HA ALA 38 HA ALA 38 -12.910 11.584 1.920 248 HB1 ALA 38 1HB ALA 38 -13.511 10.683 -0.320 249 HB2 ALA 38 2HB ALA 38 -11.904 9.962 -0.411 250 HB3 ALA 38 3HB ALA 38 -13.031 9.448 0.845 251 H SER 39 H SER 39 -10.271 12.768 2.139 252 HA SER 39 HA SER 39 -8.488 10.525 2.646 253 HB2 SER 39 1HB SER 39 -8.195 13.463 2.404 254 HB3 SER 39 2HB SER 39 -7.092 12.665 3.526 255 HG SER 39 HG SER 39 -7.497 11.864 0.833 256 HA PRO 40 HA PRO 40 -6.377 10.863 3.961 257 HB2 PRO 40 1HB PRO 40 -5.534 8.833 5.554 258 HB3 PRO 40 2HB PRO 40 -5.327 10.536 5.978 259 HG2 PRO 40 1HG PRO 40 -7.412 8.595 6.899 260 HG3 PRO 40 2HG PRO 40 -6.508 9.796 7.840 261 HD2 PRO 40 1HD PRO 40 -9.047 10.215 7.002 262 HD3 PRO 40 2HD PRO 40 -7.868 11.531 7.171 263 H GLN 41 H GLN 41 -5.548 9.039 2.766 264 HA GLN 41 HA GLN 41 -7.661 7.118 2.077 265 HB2 GLN 41 1HB GLN 41 -6.358 8.793 0.416 266 HB3 GLN 41 2HB GLN 41 -5.289 7.400 0.326 267 HG2 GLN 41 1HG GLN 41 -6.643 6.548 -1.196 268 HG3 GLN 41 2HG GLN 41 -7.857 6.355 0.068 269 HE21 GLN 41 1HE2 GLN 41 -6.920 8.065 -2.742 270 HE22 GLN 41 2HE2 GLN 41 -8.304 9.093 -2.855 271 H TRP 42 H TRP 42 -6.478 5.082 0.949 272 HA TRP 42 HA TRP 42 -4.085 4.150 2.119 273 HB2 TRP 42 1HB TRP 42 -4.920 2.525 3.699 274 HB3 TRP 42 2HB TRP 42 -5.540 4.114 4.144 275 HD1 TRP 42 HD TRP 42 -8.122 4.458 2.618 276 HE1 TRP 42 1HE TRP 42 -10.125 2.864 2.882 277 HE3 TRP 42 3HE TRP 42 -5.665 0.366 4.449 278 HZ2 TRP 42 2HZ TRP 42 -10.600 0.221 3.754 279 HZ3 TRP 42 3HZ TRP 42 -6.967 -1.654 4.974 280 HH2 TRP 42 HH TRP 42 -9.384 -1.724 4.633 281 H ILE 43 H ILE 43 -3.615 1.915 1.550 282 HA ILE 43 HA ILE 43 -5.445 0.599 -0.281 283 HB ILE 43 HB ILE 43 -4.269 2.083 -1.795 284 HG12 ILE 43 1HG1 ILE 43 -3.043 -0.652 -2.130 285 HG13 ILE 43 2HG1 ILE 43 -4.758 -0.356 -2.388 286 HG21 ILE 43 1HG2 ILE 43 -2.226 2.134 -0.165 287 HG22 ILE 43 2HG2 ILE 43 -1.648 0.806 -1.170 288 HG23 ILE 43 3HG2 ILE 43 -1.990 2.376 -1.896 289 HD11 ILE 43 3HD1 ILE 43 -4.118 -0.026 -4.507 290 HD12 ILE 43 1HD1 ILE 43 -3.683 1.582 -3.926 291 HD13 ILE 43 2HD1 ILE 43 -2.450 0.328 -4.059 292 H TYR 44 H TYR 44 -5.048 -1.590 -0.530 293 HA TYR 44 HA TYR 44 -2.779 -2.686 0.992 294 HB2 TYR 44 1HB TYR 44 -4.540 -4.636 1.394 295 HB3 TYR 44 2HB TYR 44 -4.439 -3.247 2.470 296 HD1 TYR 44 2HD TYR 44 -6.105 -1.400 2.251 297 HD2 TYR 44 1HD TYR 44 -6.486 -5.048 0.095 298 HE1 TYR 44 2HE TYR 44 -8.475 -0.896 1.829 299 HE2 TYR 44 1HE TYR 44 -8.857 -4.554 -0.335 300 HH TYR 44 HH TYR 44 -10.339 -1.534 0.807 301 H ILE 45 H ILE 45 -1.957 -4.686 0.268 302 HA ILE 45 HA ILE 45 -2.885 -5.547 -2.389 303 HB ILE 45 HB ILE 45 0.022 -5.394 -1.595 304 HG12 ILE 45 1HG1 ILE 45 -1.682 -3.487 -3.200 305 HG13 ILE 45 2HG1 ILE 45 -0.726 -3.132 -1.766 306 HG21 ILE 45 1HG2 ILE 45 -1.107 -5.684 -4.359 307 HG22 ILE 45 2HG2 ILE 45 0.524 -6.031 -3.788 308 HG23 ILE 45 3HG2 ILE 45 -0.815 -7.083 -3.326 309 HD11 ILE 45 3HD1 ILE 45 0.433 -2.240 -3.619 310 HD12 ILE 45 1HD1 ILE 45 1.313 -3.683 -3.117 311 HD13 ILE 45 2HD1 ILE 45 0.264 -3.737 -4.534 312 H ASN 46 H ASN 46 -3.179 -7.675 -2.599 313 HA ASN 46 HA ASN 46 -2.072 -9.432 -0.507 314 HB2 ASN 46 1HB ASN 46 -4.090 -10.916 -1.140 315 HB3 ASN 46 2HB ASN 46 -4.390 -9.483 -0.162 316 HD21 ASN 46 1HD2 ASN 46 -5.219 -7.595 -1.223 317 HD22 ASN 46 2HD2 ASN 46 -6.182 -7.763 -2.647 318 H LEU 47 H LEU 47 -0.716 -10.959 -1.172 319 HA LEU 47 HA LEU 47 -0.192 -11.316 -3.978 320 HB2 LEU 47 1HB LEU 47 1.359 -11.453 -1.779 321 HB3 LEU 47 2HB LEU 47 1.018 -13.165 -2.022 322 HG LEU 47 HG LEU 47 1.790 -12.546 -4.501 323 HD11 LEU 47 1HD1 LEU 47 3.301 -10.836 -4.686 324 HD12 LEU 47 2HD1 LEU 47 3.679 -10.833 -2.964 325 HD13 LEU 47 3HD1 LEU 47 2.162 -10.138 -3.535 326 HD21 LEU 47 3HD2 LEU 47 3.080 -13.615 -2.119 327 HD22 LEU 47 1HD2 LEU 47 4.223 -12.953 -3.289 328 HD23 LEU 47 2HD2 LEU 47 3.089 -14.212 -3.780 329 H GLY 48 H GLY 48 -1.260 -13.457 -1.333 330 HA2 GLY 48 2HA GLY 48 -3.303 -14.799 -2.208 331 HA3 GLY 48 3HA GLY 48 -2.118 -15.418 -3.347 332 H SER 49 H SER 49 -0.186 -15.043 -0.896 333 HA SER 49 HA SER 49 -1.027 -17.227 0.807 334 HB2 SER 49 1HB SER 49 1.347 -18.300 0.277 335 HB3 SER 49 2HB SER 49 -0.079 -18.711 -0.676 336 HG SER 49 HG SER 49 2.196 -17.535 -1.471 337 H THR 50 H THR 50 0.696 -17.700 2.483 338 HA THR 50 HA THR 50 1.500 -15.240 3.675 339 HB THR 50 HB THR 50 2.854 -17.283 5.022 340 HG1 THR 50 1HG THR 50 0.236 -18.179 4.358 341 HG21 THR 50 3HG2 THR 50 0.437 -17.034 6.324 342 HG22 THR 50 1HG2 THR 50 0.562 -15.524 5.423 343 HG23 THR 50 2HG2 THR 50 1.839 -15.989 6.547 344 H GLN 51 H GLN 51 3.395 -14.203 3.603 345 HA GLN 51 HA GLN 51 5.776 -15.623 2.657 346 HB2 GLN 51 1HB GLN 51 4.479 -13.259 1.377 347 HB3 GLN 51 2HB GLN 51 6.233 -13.359 1.371 348 HG2 GLN 51 1HG GLN 51 4.797 -15.786 0.520 349 HG3 GLN 51 2HG GLN 51 4.671 -14.390 -0.548 350 HE21 GLN 51 1HE2 GLN 51 7.100 -16.207 1.290 351 HE22 GLN 51 2HE2 GLN 51 8.330 -16.120 0.080 352 H SER 52 H SER 52 7.703 -14.883 3.487 353 HA SER 52 HA SER 52 7.478 -13.212 5.841 354 HB2 SER 52 1HB SER 52 8.873 -15.383 5.603 355 HB3 SER 52 2HB SER 52 10.053 -14.359 4.786 356 HG SER 52 HG SER 52 9.950 -14.703 7.299 357 H ILE 53 H ILE 53 8.156 -11.161 6.050 358 HA ILE 53 HA ILE 53 9.563 -9.947 3.762 359 HB ILE 53 HB ILE 53 8.426 -7.784 4.594 360 HG12 ILE 53 1HG1 ILE 53 6.544 -9.851 5.754 361 HG13 ILE 53 2HG1 ILE 53 7.556 -8.756 6.691 362 HG21 ILE 53 1HG2 ILE 53 7.608 -9.846 2.784 363 HG22 ILE 53 2HG2 ILE 53 6.188 -9.049 3.459 364 HG23 ILE 53 3HG2 ILE 53 7.426 -8.098 2.638 365 HD11 ILE 53 3HD1 ILE 53 4.948 -8.328 5.830 366 HD12 ILE 53 1HD1 ILE 53 6.038 -7.153 6.566 367 HD13 ILE 53 2HD1 ILE 53 5.948 -7.294 4.810 368 H SER 54 H SER 54 11.107 -8.347 4.202 369 HA SER 54 HA SER 54 11.927 -8.109 7.020 370 HB2 SER 54 1HB SER 54 14.324 -8.058 6.070 371 HB3 SER 54 2HB SER 54 13.516 -9.623 6.165 372 HG SER 54 HG SER 54 14.275 -9.581 4.139 373 H ARG 55 H ARG 55 12.159 -6.744 3.757 374 HA ARG 55 HA ARG 55 11.952 -4.072 4.866 375 HB2 ARG 55 1HB ARG 55 14.282 -4.104 4.917 376 HB3 ARG 55 2HB ARG 55 14.398 -5.097 3.470 377 HG2 ARG 55 1HG ARG 55 13.179 -2.450 3.084 378 HG3 ARG 55 2HG ARG 55 14.885 -2.448 3.538 379 HD2 ARG 55 1HD ARG 55 15.459 -2.999 1.467 380 HD3 ARG 55 2HD ARG 55 14.470 -4.454 1.559 381 HE ARG 55 HE ARG 55 12.849 -2.200 1.035 382 HH11 ARG 55 1HH1 ARG 55 15.167 -4.311 -0.477 383 HH12 ARG 55 2HH1 ARG 55 14.530 -4.083 -2.072 384 HH21 ARG 55 1HH2 ARG 55 12.001 -1.891 -1.060 385 HH22 ARG 55 2HH2 ARG 55 12.729 -2.705 -2.402 386 H VAL 56 H VAL 56 10.774 -2.784 3.583 387 HA VAL 56 HA VAL 56 10.527 -3.449 0.735 388 HB VAL 56 HB VAL 56 8.071 -2.995 0.867 389 HG11 VAL 56 1HG1 VAL 56 9.475 -5.332 1.363 390 HG12 VAL 56 2HG1 VAL 56 8.232 -5.299 2.615 391 HG13 VAL 56 3HG1 VAL 56 7.774 -5.202 0.914 392 HG21 VAL 56 3HG2 VAL 56 8.665 -3.052 3.813 393 HG22 VAL 56 1HG2 VAL 56 7.828 -1.805 2.887 394 HG23 VAL 56 2HG2 VAL 56 7.056 -3.366 3.165 395 H LYS 57 H LYS 57 10.165 -1.717 -0.619 396 HA LYS 57 HA LYS 57 10.156 0.941 0.653 397 HB2 LYS 57 1HB LYS 57 11.656 1.768 -0.980 398 HB3 LYS 57 2HB LYS 57 12.335 0.235 -0.445 399 HG2 LYS 57 1HG LYS 57 11.156 -0.790 -2.464 400 HG3 LYS 57 2HG LYS 57 10.953 0.870 -3.030 401 HD2 LYS 57 1HD LYS 57 13.275 1.211 -3.189 402 HD3 LYS 57 2HD LYS 57 13.635 -0.217 -2.216 403 HE2 LYS 57 1HE LYS 57 14.063 -1.073 -4.282 404 HE3 LYS 57 2HE LYS 57 12.338 -1.422 -4.191 405 HZ1 LYS 57 3HZ LYS 57 13.287 1.118 -5.347 406 HZ2 LYS 57 1HZ LYS 57 11.827 0.306 -5.615 407 HZ3 LYS 57 2HZ LYS 57 13.262 -0.290 -6.284 408 H LEU 58 H LEU 58 8.710 2.403 -0.075 409 HA LEU 58 HA LEU 58 7.241 1.820 -2.546 410 HB2 LEU 58 1HB LEU 58 5.137 2.079 -1.567 411 HB3 LEU 58 2HB LEU 58 6.023 1.030 -0.462 412 HG LEU 58 HG LEU 58 6.274 3.814 0.291 413 HD11 LEU 58 1HD1 LEU 58 4.207 4.510 -0.188 414 HD12 LEU 58 2HD1 LEU 58 3.688 3.457 1.127 415 HD13 LEU 58 3HD1 LEU 58 3.639 2.877 -0.538 416 HD21 LEU 58 3HD2 LEU 58 5.658 1.187 1.492 417 HD22 LEU 58 1HD2 LEU 58 5.038 2.605 2.339 418 HD23 LEU 58 2HD2 LEU 58 6.767 2.452 2.026 419 H ASN 59 H ASN 59 6.088 3.681 -3.415 420 HA ASN 59 HA ASN 59 7.381 6.212 -2.637 421 HB2 ASN 59 1HB ASN 59 7.931 5.339 -4.919 422 HB3 ASN 59 2HB ASN 59 6.228 5.497 -5.341 423 HD21 ASN 59 1HD2 ASN 59 6.888 6.931 -7.008 424 HD22 ASN 59 2HD2 ASN 59 7.264 8.579 -6.651 425 H TRP 60 H TRP 60 6.123 8.158 -2.812 426 HA TRP 60 HA TRP 60 3.246 7.671 -2.411 427 HB2 TRP 60 1HB TRP 60 4.617 10.158 -1.455 428 HB3 TRP 60 2HB TRP 60 3.177 9.365 -0.822 429 HD1 TRP 60 HD TRP 60 6.926 9.481 -0.434 430 HE1 TRP 60 1HE TRP 60 7.635 7.928 1.493 431 HE3 TRP 60 3HE TRP 60 2.481 7.081 0.351 432 HZ2 TRP 60 2HZ TRP 60 6.464 5.947 3.129 433 HZ3 TRP 60 3HZ TRP 60 2.359 5.370 2.115 434 HH2 TRP 60 HH TRP 60 4.311 4.816 3.473 435 H GLU 61 H GLU 61 5.139 8.501 -4.806 436 HA GLU 61 HA GLU 61 5.037 9.859 -6.639 437 HB2 GLU 61 1HB GLU 61 2.989 9.837 -7.724 438 HB3 GLU 61 2HB GLU 61 2.817 8.498 -6.598 439 HG2 GLU 61 1HG GLU 61 1.045 9.439 -5.675 440 HG3 GLU 61 2HG GLU 61 1.949 10.915 -5.342 441 H ASP 62 H ASP 62 3.463 11.935 -7.427 442 HA ASP 62 HA ASP 62 4.565 14.144 -6.220 443 HB2 ASP 62 1HB ASP 62 2.439 13.642 -8.135 444 HB3 ASP 62 2HB ASP 62 2.093 15.052 -7.137 445 H ALA 63 H ALA 63 1.413 12.663 -5.540 446 HA ALA 63 HA ALA 63 0.283 14.397 -3.792 447 HB1 ALA 63 1HB ALA 63 0.030 11.629 -4.351 448 HB2 ALA 63 2HB ALA 63 0.016 11.833 -2.599 449 HB3 ALA 63 3HB ALA 63 -1.142 12.711 -3.598 450 H TYR 64 H TYR 64 1.313 15.551 -2.282 451 HA TYR 64 HA TYR 64 3.413 14.357 -0.672 452 HB2 TYR 64 1HB TYR 64 2.618 17.040 -1.430 453 HB3 TYR 64 2HB TYR 64 2.900 16.925 0.303 454 HD1 TYR 64 2HD TYR 64 4.618 15.117 -2.460 455 HD2 TYR 64 1HD TYR 64 4.929 18.039 0.617 456 HE1 TYR 64 2HE TYR 64 7.042 15.262 -2.851 457 HE2 TYR 64 1HE TYR 64 7.353 18.194 0.234 458 HH TYR 64 HH TYR 64 9.096 15.952 -1.446 459 H ALA 65 H ALA 65 3.010 13.354 1.172 460 HA ALA 65 HA ALA 65 0.533 13.999 2.625 461 HB1 ALA 65 1HB ALA 65 0.493 11.798 3.462 462 HB2 ALA 65 2HB ALA 65 0.899 11.648 1.752 463 HB3 ALA 65 3HB ALA 65 2.161 11.497 2.973 464 H THR 66 H THR 66 0.661 13.746 5.019 465 HA THR 66 HA THR 66 3.087 15.060 5.991 466 HB THR 66 HB THR 66 0.758 15.979 6.470 467 HG1 THR 66 1HG THR 66 2.192 16.888 7.780 468 HG21 THR 66 3HG2 THR 66 -0.273 13.802 7.038 469 HG22 THR 66 1HG2 THR 66 -0.471 14.999 8.316 470 HG23 THR 66 2HG2 THR 66 0.737 13.726 8.482 471 H ALA 67 H ALA 67 1.749 11.989 5.853 472 HA ALA 67 HA ALA 67 3.799 10.759 7.292 473 HB1 ALA 67 1HB ALA 67 1.545 11.645 8.922 474 HB2 ALA 67 2HB ALA 67 1.914 9.929 9.096 475 HB3 ALA 67 3HB ALA 67 3.163 11.135 9.402 476 H TYR 68 H TYR 68 3.284 8.396 7.752 477 HA TYR 68 HA TYR 68 1.060 7.305 6.246 478 HB2 TYR 68 1HB TYR 68 2.953 5.758 5.128 479 HB3 TYR 68 2HB TYR 68 2.338 7.219 4.364 480 HD1 TYR 68 1HD TYR 68 5.164 5.736 6.181 481 HD2 TYR 68 2HD TYR 68 3.706 9.198 4.184 482 HE1 TYR 68 1HE TYR 68 7.443 6.660 6.132 483 HE2 TYR 68 2HE TYR 68 5.981 10.131 4.128 484 HH TYR 68 HH TYR 68 8.328 9.363 5.950 485 H SER 69 H SER 69 0.983 4.903 6.417 486 HA SER 69 HA SER 69 2.478 3.816 8.683 487 HB2 SER 69 1HB SER 69 -0.486 4.209 8.559 488 HB3 SER 69 2HB SER 69 0.154 2.796 9.397 489 HG SER 69 HG SER 69 0.042 4.379 10.912 490 H ILE 70 H ILE 70 2.965 1.696 8.480 491 HA ILE 70 HA ILE 70 1.715 0.226 6.252 492 HB ILE 70 HB ILE 70 4.224 1.021 6.071 493 HG12 ILE 70 1HG1 ILE 70 3.162 -1.711 5.344 494 HG13 ILE 70 2HG1 ILE 70 3.167 -0.261 4.345 495 HG21 ILE 70 1HG2 ILE 70 5.824 -0.544 6.912 496 HG22 ILE 70 2HG2 ILE 70 4.811 -0.026 8.259 497 HG23 ILE 70 3HG2 ILE 70 4.550 -1.603 7.514 498 HD11 ILE 70 3HD1 ILE 70 5.630 -0.351 4.298 499 HD12 ILE 70 1HD1 ILE 70 5.563 -1.863 5.203 500 HD13 ILE 70 2HD1 ILE 70 4.867 -1.772 3.584 501 H GLN 71 H GLN 71 0.761 -1.611 6.819 502 HA GLN 71 HA GLN 71 1.827 -3.239 8.970 503 HB2 GLN 71 1HB GLN 71 -0.060 -3.221 10.359 504 HB3 GLN 71 2HB GLN 71 0.177 -1.530 9.944 505 HG2 GLN 71 1HG GLN 71 -1.537 -1.832 8.141 506 HG3 GLN 71 2HG GLN 71 -1.863 -3.426 8.818 507 HE21 GLN 71 1HE2 GLN 71 -4.033 -2.322 8.929 508 HE22 GLN 71 2HE2 GLN 71 -4.403 -1.483 10.393 509 H VAL 72 H VAL 72 1.286 -5.392 8.805 510 HA VAL 72 HA VAL 72 -0.169 -6.129 6.357 511 HB VAL 72 HB VAL 72 1.024 -8.219 6.377 512 HG11 VAL 72 1HG1 VAL 72 3.312 -6.490 7.014 513 HG12 VAL 72 2HG1 VAL 72 2.928 -7.369 5.533 514 HG13 VAL 72 3HG1 VAL 72 2.164 -5.813 5.860 515 HG21 VAL 72 3HG2 VAL 72 2.653 -8.792 8.094 516 HG22 VAL 72 1HG2 VAL 72 2.277 -7.304 8.965 517 HG23 VAL 72 2HG2 VAL 72 1.055 -8.566 8.806 518 H SER 73 H SER 73 -0.724 -8.754 6.860 519 HA SER 73 HA SER 73 -2.447 -8.713 9.244 520 HB2 SER 73 1HB SER 73 -3.195 -9.452 6.420 521 HB3 SER 73 2HB SER 73 -4.118 -10.030 7.806 522 HG SER 73 HG SER 73 -3.551 -7.288 7.429 523 H ASN 74 H ASN 74 -2.411 -10.516 10.451 524 HA ASN 74 HA ASN 74 -2.027 -13.127 9.571 525 HB2 ASN 74 1HB ASN 74 0.370 -11.714 9.440 526 HB3 ASN 74 2HB ASN 74 0.488 -12.622 10.946 527 HD21 ASN 74 1HD2 ASN 74 -0.719 -13.176 7.650 528 HD22 ASN 74 2HD2 ASN 74 0.049 -14.710 7.447 529 H ASP 75 H ASP 75 -1.597 -14.652 11.376 530 HA ASP 75 HA ASP 75 -1.485 -13.827 14.062 531 HB2 ASP 75 1HB ASP 75 -3.847 -13.065 13.252 532 HB3 ASP 75 2HB ASP 75 -4.250 -14.775 13.386 533 H SER 76 H SER 76 -2.853 -16.246 11.860 534 HA SER 76 HA SER 76 -1.889 -18.352 13.677 535 HB2 SER 76 1HB SER 76 -3.509 -19.619 11.838 536 HB3 SER 76 2HB SER 76 -4.001 -19.105 13.452 537 HG SER 76 HG SER 76 -5.446 -18.127 12.182 538 H GLY 77 H GLY 77 -0.935 -16.726 11.031 539 HA2 GLY 77 2HA GLY 77 0.840 -17.165 9.607 540 HA3 GLY 77 3HA GLY 77 0.904 -18.801 10.247 541 H SER 78 H SER 78 -2.229 -18.294 9.420 542 HA SER 78 HA SER 78 -1.897 -18.966 6.594 543 HB2 SER 78 1HB SER 78 -1.994 -21.086 8.016 544 HB3 SER 78 2HB SER 78 -3.665 -20.648 8.371 545 HG SER 78 HG SER 78 -4.081 -20.713 6.129 546 H THR 79 H THR 79 -4.081 -18.214 9.264 547 HA THR 79 HA THR 79 -5.973 -17.056 7.325 548 HB THR 79 HB THR 79 -6.589 -17.803 10.186 549 HG1 THR 79 1HG THR 79 -6.041 -19.662 8.910 550 HG21 THR 79 3HG2 THR 79 -8.273 -16.368 9.574 551 HG22 THR 79 1HG2 THR 79 -8.939 -17.892 8.990 552 HG23 THR 79 2HG2 THR 79 -8.155 -16.783 7.864 553 HA PRO 80 HA PRO 80 -4.047 -13.457 9.504 554 HB2 PRO 80 1HB PRO 80 -3.921 -11.899 7.285 555 HB3 PRO 80 2HB PRO 80 -2.660 -13.060 7.716 556 HG2 PRO 80 1HG PRO 80 -4.900 -13.338 5.750 557 HG3 PRO 80 2HG PRO 80 -3.203 -13.821 5.585 558 HD2 PRO 80 1HD PRO 80 -5.168 -15.585 6.185 559 HD3 PRO 80 2HD PRO 80 -3.508 -15.763 6.790 560 H THR 81 H THR 81 -5.182 -11.811 10.369 561 HA THR 81 HA THR 81 -7.510 -10.731 9.009 562 HB THR 81 HB THR 81 -9.047 -11.104 10.854 563 HG1 THR 81 1HG THR 81 -8.385 -12.478 12.592 564 HG21 THR 81 3HG2 THR 81 -7.797 -13.760 10.180 565 HG22 THR 81 1HG2 THR 81 -8.750 -12.832 9.024 566 HG23 THR 81 2HG2 THR 81 -9.492 -13.409 10.516 567 H ASN 82 H ASN 82 -5.763 -10.792 12.115 568 HA ASN 82 HA ASN 82 -5.989 -7.855 12.192 569 HB2 ASN 82 1HB ASN 82 -6.784 -9.709 14.112 570 HB3 ASN 82 2HB ASN 82 -5.252 -9.089 14.721 571 HD21 ASN 82 1HD2 ASN 82 -5.194 -7.132 15.634 572 HD22 ASN 82 2HD2 ASN 82 -6.531 -6.041 15.713 573 H TRP 83 H TRP 83 -4.164 -6.807 13.447 574 HA TRP 83 HA TRP 83 -1.675 -8.030 13.796 575 HB2 TRP 83 1HB TRP 83 -2.053 -8.063 11.194 576 HB3 TRP 83 2HB TRP 83 -1.579 -6.371 11.305 577 HD1 TRP 83 HD TRP 83 0.870 -6.171 10.617 578 HE1 TRP 83 1HE TRP 83 3.033 -7.491 11.070 579 HE3 TRP 83 3HE TRP 83 -1.079 -10.000 13.387 580 HZ2 TRP 83 2HZ TRP 83 3.810 -9.844 12.422 581 HZ3 TRP 83 3HZ TRP 83 0.441 -11.745 14.222 582 HH2 TRP 83 HH TRP 83 2.834 -11.667 13.748 583 H THR 84 H THR 84 0.146 -6.304 13.809 584 HA THR 84 HA THR 84 -0.999 -3.810 14.885 585 HB THR 84 HB THR 84 1.720 -4.273 15.745 586 HG1 THR 84 1HG THR 84 1.418 -6.430 15.783 587 HG21 THR 84 3HG2 THR 84 0.146 -2.741 16.823 588 HG22 THR 84 1HG2 THR 84 0.716 -3.962 17.961 589 HG23 THR 84 2HG2 THR 84 -0.894 -4.101 17.252 590 H THR 85 H THR 85 -0.122 -1.861 14.291 591 HA THR 85 HA THR 85 0.937 -1.534 11.769 592 HB THR 85 HB THR 85 1.746 0.738 12.629 593 HG1 THR 85 1HG THR 85 1.740 0.998 14.722 594 HG21 THR 85 3HG2 THR 85 -0.367 0.587 11.531 595 HG22 THR 85 1HG2 THR 85 -0.615 1.534 12.997 596 HG23 THR 85 2HG2 THR 85 -1.117 -0.156 12.944 597 H VAL 86 H VAL 86 3.034 -0.838 11.036 598 HA VAL 86 HA VAL 86 5.222 -2.005 12.628 599 HB VAL 86 HB VAL 86 5.308 -1.556 9.652 600 HG11 VAL 86 1HG1 VAL 86 7.051 -2.766 11.686 601 HG12 VAL 86 2HG1 VAL 86 6.867 -3.704 10.202 602 HG13 VAL 86 3HG1 VAL 86 7.453 -2.041 10.129 603 HG21 VAL 86 3HG2 VAL 86 3.742 -3.135 9.432 604 HG22 VAL 86 1HG2 VAL 86 4.966 -4.266 10.010 605 HG23 VAL 86 2HG2 VAL 86 3.812 -3.560 11.142 606 H TYR 87 H TYR 87 3.977 0.866 11.303 607 HA TYR 87 HA TYR 87 6.109 2.426 12.376 608 HB2 TYR 87 1HB TYR 87 7.146 1.698 10.246 609 HB3 TYR 87 2HB TYR 87 5.806 2.422 9.366 610 HD1 TYR 87 1HD TYR 87 8.257 3.428 12.011 611 HD2 TYR 87 2HD TYR 87 6.201 4.492 8.441 612 HE1 TYR 87 1HE TYR 87 9.455 5.576 11.968 613 HE2 TYR 87 2HE TYR 87 7.394 6.641 8.388 614 HH TYR 87 HH TYR 87 9.988 7.360 10.635 615 H SER 88 H SER 88 5.676 4.703 12.300 616 HA SER 88 HA SER 88 3.522 5.914 11.020 617 HB2 SER 88 1HB SER 88 1.999 6.144 13.073 618 HB3 SER 88 2HB SER 88 1.965 4.601 12.220 619 HG SER 88 HG SER 88 3.585 5.108 14.492 620 H THR 89 H THR 89 3.842 8.041 11.140 621 HA THR 89 HA THR 89 4.902 9.246 13.569 622 HB THR 89 HB THR 89 6.768 10.329 12.521 623 HG1 THR 89 1HG THR 89 6.001 8.999 10.117 624 HG21 THR 89 3HG2 THR 89 6.784 7.413 11.737 625 HG22 THR 89 1HG2 THR 89 7.151 8.038 13.344 626 HG23 THR 89 2HG2 THR 89 8.199 8.435 11.983 627 H THR 90 H THR 90 5.474 11.749 12.668 628 HA THR 90 HA THR 90 3.072 12.640 11.227 629 HB THR 90 HB THR 90 3.136 14.658 12.873 630 HG1 THR 90 1HG THR 90 5.042 13.964 13.974 631 HG21 THR 90 3HG2 THR 90 2.093 12.436 14.430 632 HG22 THR 90 1HG2 THR 90 1.630 12.337 12.732 633 HG23 THR 90 2HG2 THR 90 1.239 13.778 13.671 634 H THR 91 H THR 91 5.213 12.485 9.769 635 HA THR 91 HA THR 91 6.055 15.261 9.433 636 HB THR 91 HB THR 91 8.046 14.780 10.389 637 HG1 THR 91 1HG THR 91 8.797 15.011 8.333 638 HG21 THR 91 3HG2 THR 91 7.691 12.739 11.405 639 HG22 THR 91 1HG2 THR 91 8.973 12.334 10.265 640 HG23 THR 91 2HG2 THR 91 7.296 11.931 9.888 641 H GLY 92 H GLY 92 6.948 12.096 8.041 642 HA2 GLY 92 2HA GLY 92 7.016 11.392 5.854 643 HA3 GLY 92 3HA GLY 92 5.456 12.190 5.727 644 H ASP 93 H ASP 93 6.156 12.549 3.489 645 HA ASP 93 HA ASP 93 7.039 15.199 3.105 646 HB2 ASP 93 1HB ASP 93 9.105 13.127 3.098 647 HB3 ASP 93 2HB ASP 93 9.070 14.071 1.611 648 H GLY 94 H GLY 94 7.753 12.331 1.125 649 HA2 GLY 94 2HA GLY 94 5.564 12.060 -0.428 650 HA3 GLY 94 3HA GLY 94 6.315 13.501 -1.099 651 H ALA 95 H ALA 95 9.004 12.310 -0.317 652 HA ALA 95 HA ALA 95 9.491 11.028 -2.836 653 HB1 ALA 95 1HB ALA 95 11.704 11.366 -2.427 654 HB2 ALA 95 2HB ALA 95 11.033 12.570 -1.327 655 HB3 ALA 95 3HB ALA 95 11.557 11.005 -0.707 656 H ILE 96 H ILE 96 10.519 8.935 -3.077 657 HA ILE 96 HA ILE 96 9.129 6.826 -2.025 658 HB ILE 96 HB ILE 96 12.037 6.668 -2.815 659 HG12 ILE 96 1HG1 ILE 96 10.549 5.913 -5.010 660 HG13 ILE 96 2HG1 ILE 96 9.639 7.281 -4.380 661 HG21 ILE 96 1HG2 ILE 96 11.399 4.610 -1.893 662 HG22 ILE 96 2HG2 ILE 96 9.806 4.669 -2.643 663 HG23 ILE 96 3HG2 ILE 96 11.236 4.388 -3.634 664 HD11 ILE 96 3HD1 ILE 96 12.061 7.255 -5.893 665 HD12 ILE 96 1HD1 ILE 96 11.052 8.621 -5.420 666 HD13 ILE 96 2HD1 ILE 96 12.330 8.054 -4.344 667 H ASP 97 H ASP 97 9.010 5.877 -0.106 668 HA ASP 97 HA ASP 97 11.180 6.355 1.829 669 HB2 ASP 97 1HB ASP 97 9.265 7.343 2.749 670 HB3 ASP 97 2HB ASP 97 8.209 6.057 2.169 671 H ASP 98 H ASP 98 12.347 4.663 2.432 672 HA ASP 98 HA ASP 98 11.378 1.977 1.771 673 HB2 ASP 98 1HB ASP 98 13.548 2.524 0.842 674 HB3 ASP 98 2HB ASP 98 14.150 2.988 2.431 675 H ILE 99 H ILE 99 10.399 0.918 3.356 676 HA ILE 99 HA ILE 99 11.185 1.453 6.133 677 HB ILE 99 HB ILE 99 8.792 1.714 5.579 678 HG12 ILE 99 1HG1 ILE 99 8.920 -0.699 7.333 679 HG13 ILE 99 2HG1 ILE 99 9.818 0.735 7.818 680 HG21 ILE 99 1HG2 ILE 99 7.445 -0.306 5.127 681 HG22 ILE 99 2HG2 ILE 99 8.586 0.060 3.833 682 HG23 ILE 99 3HG2 ILE 99 8.936 -1.235 4.976 683 HD11 ILE 99 3HD1 ILE 99 7.337 0.310 8.591 684 HD12 ILE 99 1HD1 ILE 99 7.938 1.932 8.251 685 HD13 ILE 99 2HD1 ILE 99 6.978 1.076 7.044 686 H THR 100 H THR 100 11.950 -0.117 7.462 687 HA THR 100 HA THR 100 12.173 -2.844 6.378 688 HB THR 100 HB THR 100 14.433 -3.069 7.026 689 HG1 THR 100 1HG THR 100 15.065 -2.038 8.754 690 HG21 THR 100 3HG2 THR 100 14.823 -0.313 6.112 691 HG22 THR 100 1HG2 THR 100 13.697 -1.242 5.122 692 HG23 THR 100 2HG2 THR 100 15.338 -1.833 5.381 693 H PHE 101 H PHE 101 11.769 -4.460 7.789 694 HA PHE 101 HA PHE 101 11.706 -3.880 10.654 695 HB2 PHE 101 1HB PHE 101 9.451 -5.393 10.429 696 HB3 PHE 101 2HB PHE 101 9.461 -3.636 10.541 697 HD1 PHE 101 1HD PHE 101 9.128 -6.501 8.272 698 HD2 PHE 101 2HD PHE 101 8.908 -2.268 8.662 699 HE1 PHE 101 1HE PHE 101 8.010 -6.361 6.085 700 HE2 PHE 101 2HE PHE 101 7.789 -2.121 6.475 701 HZ PHE 101 HZ PHE 101 7.338 -4.171 5.184 702 H ALA 102 H ALA 102 10.883 -6.112 11.748 703 HA ALA 102 HA ALA 102 12.962 -7.977 11.180 704 HB1 ALA 102 1HB ALA 102 11.968 -9.311 12.986 705 HB2 ALA 102 2HB ALA 102 12.189 -7.624 13.453 706 HB3 ALA 102 3HB ALA 102 10.586 -8.217 13.021 707 H ALA 103 H ALA 103 12.660 -10.247 10.686 708 HA ALA 103 HA ALA 103 11.121 -10.680 8.382 709 HB1 ALA 103 1HB ALA 103 13.141 -11.953 8.883 710 HB2 ALA 103 2HB ALA 103 12.326 -12.725 10.244 711 HB3 ALA 103 3HB ALA 103 11.770 -13.025 8.597 712 H THR 104 H THR 104 8.963 -10.584 8.391 713 HA THR 104 HA THR 104 7.525 -12.271 10.328 714 HB THR 104 HB THR 104 7.267 -9.903 10.973 715 HG1 THR 104 1HG THR 104 4.828 -10.851 9.864 716 HG21 THR 104 3HG2 THR 104 7.512 -8.878 8.770 717 HG22 THR 104 1HG2 THR 104 5.997 -8.381 9.522 718 HG23 THR 104 2HG2 THR 104 5.991 -9.603 8.251 719 H ASN 105 H ASN 105 5.857 -13.468 9.531 720 HA ASN 105 HA ASN 105 5.640 -13.616 6.639 721 HB2 ASN 105 1HB ASN 105 4.069 -15.587 7.304 722 HB3 ASN 105 2HB ASN 105 5.806 -15.757 7.539 723 HD21 ASN 105 1HD2 ASN 105 2.818 -16.046 8.961 724 HD22 ASN 105 2HD2 ASN 105 3.312 -16.125 10.615 725 H ALA 106 H ALA 106 3.918 -13.011 5.454 726 HA ALA 106 HA ALA 106 1.350 -12.495 6.686 727 HB1 ALA 106 1HB ALA 106 1.723 -10.133 5.275 728 HB2 ALA 106 2HB ALA 106 1.681 -10.323 7.028 729 HB3 ALA 106 3HB ALA 106 3.224 -10.354 6.174 730 H LYS 107 H LYS 107 -0.344 -12.175 5.151 731 HA LYS 107 HA LYS 107 0.266 -13.384 2.565 732 HB2 LYS 107 1HB LYS 107 -2.323 -12.855 4.024 733 HB3 LYS 107 2HB LYS 107 -2.263 -13.464 2.375 734 HG2 LYS 107 1HG LYS 107 -0.764 -15.321 3.366 735 HG3 LYS 107 2HG LYS 107 -1.441 -14.807 4.913 736 HD2 LYS 107 1HD LYS 107 -3.369 -15.848 4.501 737 HD3 LYS 107 2HD LYS 107 -3.501 -15.102 2.905 738 HE2 LYS 107 1HE LYS 107 -2.724 -16.930 1.863 739 HE3 LYS 107 2HE LYS 107 -1.467 -17.198 3.070 740 HZ1 LYS 107 3HZ LYS 107 -4.069 -18.393 2.843 741 HZ2 LYS 107 1HZ LYS 107 -3.743 -17.815 4.400 742 HZ3 LYS 107 2HZ LYS 107 -2.700 -18.934 3.677 743 H PHE 108 H PHE 108 -1.294 -10.492 3.897 744 HA PHE 108 HA PHE 108 -0.700 -9.092 1.401 745 HB2 PHE 108 1HB PHE 108 -2.928 -8.117 1.276 746 HB3 PHE 108 2HB PHE 108 -3.039 -9.873 1.222 747 HD1 PHE 108 2HD PHE 108 -3.544 -6.903 3.342 748 HD2 PHE 108 1HD PHE 108 -4.185 -11.087 2.902 749 HE1 PHE 108 2HE PHE 108 -5.123 -6.856 5.227 750 HE2 PHE 108 1HE PHE 108 -5.766 -11.047 4.785 751 HZ PHE 108 HZ PHE 108 -6.237 -8.929 5.952 752 H VAL 109 H VAL 109 -0.378 -6.877 1.620 753 HA VAL 109 HA VAL 109 -0.109 -5.953 4.402 754 HB VAL 109 HB VAL 109 1.280 -4.805 1.982 755 HG11 VAL 109 1HG1 VAL 109 1.521 -3.161 3.524 756 HG12 VAL 109 2HG1 VAL 109 1.297 -4.256 4.889 757 HG13 VAL 109 3HG1 VAL 109 2.850 -4.190 4.055 758 HG21 VAL 109 3HG2 VAL 109 3.289 -6.022 3.127 759 HG22 VAL 109 1HG2 VAL 109 2.028 -7.068 3.779 760 HG23 VAL 109 2HG2 VAL 109 2.225 -6.907 2.034 761 H ARG 110 H ARG 110 -0.655 -3.776 4.912 762 HA ARG 110 HA ARG 110 -2.391 -2.418 2.971 763 HB2 ARG 110 1HB ARG 110 -3.143 -2.535 5.877 764 HB3 ARG 110 2HB ARG 110 -4.148 -2.129 4.492 765 HG2 ARG 110 1HG ARG 110 -3.605 -4.630 3.824 766 HG3 ARG 110 2HG ARG 110 -3.376 -4.780 5.567 767 HD2 ARG 110 1HD ARG 110 -5.572 -4.790 5.908 768 HD3 ARG 110 2HD ARG 110 -5.759 -3.281 5.016 769 HE ARG 110 HE ARG 110 -5.455 -5.321 3.149 770 HH11 ARG 110 1HH1 ARG 110 -7.716 -4.357 5.615 771 HH12 ARG 110 2HH1 ARG 110 -9.086 -5.052 4.814 772 HH21 ARG 110 1HH2 ARG 110 -7.250 -6.241 2.085 773 HH22 ARG 110 2HH2 ARG 110 -8.819 -6.124 2.806 774 H VAL 111 H VAL 111 -1.943 -0.321 2.772 775 HA VAL 111 HA VAL 111 -0.413 0.988 4.927 776 HB VAL 111 HB VAL 111 0.801 2.268 3.325 777 HG11 VAL 111 1HG1 VAL 111 1.251 -0.310 3.684 778 HG12 VAL 111 2HG1 VAL 111 0.872 -0.372 1.960 779 HG13 VAL 111 3HG1 VAL 111 2.197 0.641 2.538 780 HG21 VAL 111 3HG2 VAL 111 -0.441 2.902 1.551 781 HG22 VAL 111 1HG2 VAL 111 0.275 1.476 0.800 782 HG23 VAL 111 2HG2 VAL 111 -1.340 1.385 1.504 783 H TYR 112 H TYR 112 -1.120 2.919 5.653 784 HA TYR 112 HA TYR 112 -3.177 4.349 4.139 785 HB2 TYR 112 1HB TYR 112 -4.563 4.617 6.158 786 HB3 TYR 112 2HB TYR 112 -4.410 2.927 5.693 787 HD1 TYR 112 1HD TYR 112 -3.056 1.384 7.039 788 HD2 TYR 112 2HD TYR 112 -3.630 5.429 8.223 789 HE1 TYR 112 1HE TYR 112 -2.270 0.826 9.302 790 HE2 TYR 112 2HE TYR 112 -2.845 4.885 10.490 791 HH TYR 112 HH TYR 112 -2.677 1.888 11.704 792 H ALA 113 H ALA 113 -3.492 6.560 4.857 793 HA ALA 113 HA ALA 113 -1.064 7.646 6.122 794 HB1 ALA 113 1HB ALA 113 -2.008 8.210 3.649 795 HB2 ALA 113 2HB ALA 113 -2.769 9.489 4.596 796 HB3 ALA 113 3HB ALA 113 -1.015 9.309 4.609 797 H THR 114 H THR 114 -1.417 9.777 7.247 798 HA THR 114 HA THR 114 -3.749 9.522 8.997 799 HB THR 114 HB THR 114 -1.468 9.662 10.008 800 HG1 THR 114 1HG THR 114 -3.119 10.282 11.343 801 HG21 THR 114 3HG2 THR 114 -0.281 11.759 10.035 802 HG22 THR 114 1HG2 THR 114 -1.552 12.539 9.095 803 HG23 THR 114 2HG2 THR 114 -0.552 11.287 8.358 804 H THR 115 H THR 115 -2.404 11.562 6.554 805 HA THR 115 HA THR 115 -4.739 13.314 6.764 806 HB THR 115 HB THR 115 -1.992 14.472 6.304 807 HG1 THR 115 1HG THR 115 -2.512 15.285 8.584 808 HG21 THR 115 3HG2 THR 115 -4.721 15.622 6.851 809 HG22 THR 115 1HG2 THR 115 -3.678 15.902 5.458 810 HG23 THR 115 2HG2 THR 115 -3.240 16.562 7.033 811 H ARG 116 H ARG 116 -5.173 14.525 4.800 812 HA ARG 116 HA ARG 116 -5.035 12.983 2.489 813 HB2 ARG 116 1HB ARG 116 -5.995 14.827 1.340 814 HB3 ARG 116 2HB ARG 116 -6.633 14.878 2.978 815 HG2 ARG 116 1HG ARG 116 -4.448 16.462 3.224 816 HG3 ARG 116 2HG ARG 116 -4.924 16.786 1.556 817 HD2 ARG 116 1HD ARG 116 -7.321 16.842 2.887 818 HD3 ARG 116 2HD ARG 116 -6.214 17.550 4.062 819 HE ARG 116 HE ARG 116 -5.722 18.763 1.606 820 HH11 ARG 116 1HH1 ARG 116 -8.293 18.532 3.940 821 HH12 ARG 116 2HH1 ARG 116 -8.951 20.089 3.564 822 HH21 ARG 116 1HH2 ARG 116 -6.576 20.817 1.102 823 HH22 ARG 116 2HH2 ARG 116 -7.975 21.388 1.950 824 H ALA 117 H ALA 117 -4.008 13.573 0.411 825 HA ALA 117 HA ALA 117 -1.195 14.235 0.860 826 HB1 ALA 117 1HB ALA 117 -1.663 13.494 -1.836 827 HB2 ALA 117 2HB ALA 117 -0.824 12.587 -0.577 828 HB3 ALA 117 3HB ALA 117 -2.560 12.381 -0.802 829 H THR 118 H THR 118 -3.312 14.801 -1.942 830 HA THR 118 HA THR 118 -3.081 17.651 -1.765 831 HB THR 118 HB THR 118 -1.921 16.836 -4.329 832 HG1 THR 118 1HG THR 118 -0.295 16.603 -2.005 833 HG21 THR 118 3HG2 THR 118 -2.079 19.118 -2.756 834 HG22 THR 118 1HG2 THR 118 -1.135 18.926 -4.233 835 HG23 THR 118 2HG2 THR 118 -0.383 18.645 -2.663 836 H ALA 119 H ALA 119 -3.572 18.402 -4.335 837 HA ALA 119 HA ALA 119 -6.297 17.822 -4.658 838 HB1 ALA 119 1HB ALA 119 -4.507 19.651 -5.715 839 HB2 ALA 119 2HB ALA 119 -5.044 18.717 -7.112 840 HB3 ALA 119 3HB ALA 119 -6.227 19.528 -6.085 841 H TYR 120 H TYR 120 -3.531 16.074 -5.609 842 HA TYR 120 HA TYR 120 -4.726 14.736 -7.859 843 HB2 TYR 120 1HB TYR 120 -2.176 15.136 -7.224 844 HB3 TYR 120 2HB TYR 120 -2.378 13.582 -6.424 845 HD1 TYR 120 2HD TYR 120 -4.276 12.289 -8.350 846 HD2 TYR 120 1HD TYR 120 -0.756 14.587 -9.011 847 HE1 TYR 120 2HE TYR 120 -3.935 11.138 -10.496 848 HE2 TYR 120 1HE TYR 120 -0.406 13.443 -11.161 849 HH TYR 120 HH TYR 120 -2.290 12.129 -12.873 850 H GLY 121 H GLY 121 -3.565 13.510 -4.709 851 HA2 GLY 121 2HA GLY 121 -5.468 12.334 -3.450 852 HA3 GLY 121 3HA GLY 121 -5.580 11.370 -4.916 853 H TYR 122 H TYR 122 -4.541 9.500 -4.880 854 HA TYR 122 HA TYR 122 -2.029 9.279 -3.393 855 HB2 TYR 122 1HB TYR 122 -4.522 7.685 -2.904 856 HB3 TYR 122 2HB TYR 122 -2.945 6.951 -2.632 857 HD1 TYR 122 2HD TYR 122 -4.912 9.993 -1.734 858 HD2 TYR 122 1HD TYR 122 -1.926 7.197 -0.565 859 HE1 TYR 122 2HE TYR 122 -4.818 11.033 0.492 860 HE2 TYR 122 1HE TYR 122 -1.824 8.229 1.666 861 HH TYR 122 HH TYR 122 -3.971 10.914 2.546 862 H SER 123 H SER 123 -0.526 8.271 -4.549 863 HA SER 123 HA SER 123 -1.320 6.255 -6.517 864 HB2 SER 123 1HB SER 123 0.771 8.204 -7.366 865 HB3 SER 123 2HB SER 123 -0.386 7.299 -8.341 866 HG SER 123 HG SER 123 -1.205 9.291 -8.387 867 H LEU 124 H LEU 124 0.141 4.624 -6.802 868 HA LEU 124 HA LEU 124 2.694 4.836 -5.354 869 HB2 LEU 124 1HB LEU 124 2.382 2.374 -4.831 870 HB3 LEU 124 2HB LEU 124 1.397 3.520 -3.923 871 HG LEU 124 HG LEU 124 -0.180 2.798 -6.105 872 HD11 LEU 124 1HD1 LEU 124 0.357 0.180 -4.984 873 HD12 LEU 124 2HD1 LEU 124 1.737 0.822 -5.874 874 HD13 LEU 124 3HD1 LEU 124 0.169 0.675 -6.667 875 HD21 LEU 124 3HD2 LEU 124 -0.512 1.341 -3.551 876 HD22 LEU 124 1HD2 LEU 124 -1.681 2.269 -4.492 877 HD23 LEU 124 2HD2 LEU 124 -0.506 3.104 -3.473 878 H TRP 125 H TRP 125 3.301 5.403 -7.645 879 HA TRP 125 HA TRP 125 3.277 3.361 -9.634 880 HB2 TRP 125 1HB TRP 125 5.091 5.776 -9.520 881 HB3 TRP 125 2HB TRP 125 4.628 4.854 -10.947 882 HD1 TRP 125 HD TRP 125 1.435 4.813 -10.002 883 HE1 TRP 125 1HE TRP 125 0.069 6.944 -10.467 884 HE3 TRP 125 3HE TRP 125 5.280 8.142 -10.524 885 HZ2 TRP 125 2HZ TRP 125 0.557 9.675 -10.987 886 HZ3 TRP 125 3HZ TRP 125 4.744 10.495 -11.005 887 HH2 TRP 125 HH TRP 125 2.432 11.244 -11.232 888 H GLU 126 H GLU 126 5.097 3.784 -6.847 889 HA GLU 126 HA GLU 126 7.020 1.776 -7.758 890 HB2 GLU 126 1HB GLU 126 7.654 4.520 -6.819 891 HB3 GLU 126 2HB GLU 126 8.674 3.219 -6.217 892 HG2 GLU 126 1HG GLU 126 9.792 3.140 -8.120 893 HG3 GLU 126 2HG GLU 126 8.304 2.931 -9.041 894 H PHE 127 H PHE 127 5.302 0.635 -6.429 895 HA PHE 127 HA PHE 127 6.084 0.690 -3.589 896 HB2 PHE 127 1HB PHE 127 3.825 1.522 -3.765 897 HB3 PHE 127 2HB PHE 127 3.358 0.165 -4.784 898 HD1 PHE 127 1HD PHE 127 5.522 -0.293 -1.874 899 HD2 PHE 127 2HD PHE 127 1.530 -0.469 -3.343 900 HE1 PHE 127 1HE PHE 127 4.845 -1.555 0.127 901 HE2 PHE 127 2HE PHE 127 0.847 -1.731 -1.345 902 HZ PHE 127 HZ PHE 127 2.504 -2.275 0.394 903 H GLU 128 H GLU 128 7.390 -1.011 -3.328 904 HA GLU 128 HA GLU 128 6.705 -3.543 -4.645 905 HB2 GLU 128 1HB GLU 128 9.234 -2.308 -3.698 906 HB3 GLU 128 2HB GLU 128 9.109 -4.058 -3.578 907 HG2 GLU 128 1HG GLU 128 9.796 -4.129 -5.683 908 HG3 GLU 128 2HG GLU 128 8.202 -3.521 -6.126 909 H VAL 129 H VAL 129 5.772 -5.099 -3.506 910 HA VAL 129 HA VAL 129 6.389 -5.391 -0.664 911 HB VAL 129 HB VAL 129 4.413 -4.084 -0.513 912 HG11 VAL 129 1HG1 VAL 129 3.687 -5.499 -2.939 913 HG12 VAL 129 2HG1 VAL 129 2.359 -5.440 -1.779 914 HG13 VAL 129 3HG1 VAL 129 3.122 -3.946 -2.327 915 HG21 VAL 129 3HG2 VAL 129 3.567 -6.968 -0.251 916 HG22 VAL 129 1HG2 VAL 129 4.520 -6.082 0.939 917 HG23 VAL 129 2HG2 VAL 129 2.867 -5.582 0.584 918 H TYR 130 H TYR 130 7.092 -7.409 -0.481 919 HA TYR 130 HA TYR 130 5.529 -9.663 -0.977 920 HB2 TYR 130 1HB TYR 130 6.947 -10.642 -2.867 921 HB3 TYR 130 2HB TYR 130 5.775 -9.405 -3.310 922 HD1 TYR 130 2HD TYR 130 9.368 -9.741 -2.343 923 HD2 TYR 130 1HD TYR 130 6.469 -7.654 -4.655 924 HE1 TYR 130 2HE TYR 130 11.161 -8.431 -3.399 925 HE2 TYR 130 1HE TYR 130 8.254 -6.339 -5.718 926 HH TYR 130 HH TYR 130 11.552 -6.482 -4.605 927 H GLY 131 H GLY 131 6.712 -11.699 -0.622 928 HA2 GLY 131 2HA GLY 131 9.207 -11.219 0.889 929 HA3 GLY 131 3HA GLY 131 7.982 -12.374 1.393 Start of MODEL 4 1 H ASN 1 H ASN 1 -9.548 -14.344 -17.103 2 HA ASN 1 HA ASN 1 -7.701 -14.066 -18.399 3 HB2 ASN 1 1HB ASN 1 -9.848 -12.682 -19.922 4 HB3 ASN 1 2HB ASN 1 -8.188 -12.383 -20.424 5 HD21 ASN 1 1HD2 ASN 1 -9.286 -13.453 -22.359 6 HD22 ASN 1 2HD2 ASN 1 -9.102 -15.167 -22.475 7 H LEU 2 H LEU 2 -5.932 -12.652 -18.809 8 HA LEU 2 HA LEU 2 -4.499 -10.992 -18.201 9 HB2 LEU 2 1HB LEU 2 -6.967 -9.686 -19.095 10 HB3 LEU 2 2HB LEU 2 -5.933 -8.675 -18.088 11 HG LEU 2 HG LEU 2 -5.534 -8.331 -20.484 12 HD11 LEU 2 1HD1 LEU 2 -3.729 -8.212 -18.655 13 HD12 LEU 2 2HD1 LEU 2 -3.216 -8.241 -20.341 14 HD13 LEU 2 3HD1 LEU 2 -3.120 -9.707 -19.365 15 HD21 LEU 2 3HD2 LEU 2 -4.880 -9.982 -21.949 16 HD22 LEU 2 1HD2 LEU 2 -6.030 -10.853 -20.936 17 HD23 LEU 2 2HD2 LEU 2 -4.297 -11.043 -20.665 18 H ALA 3 H ALA 3 -4.169 -11.787 -16.085 19 HA ALA 3 HA ALA 3 -4.878 -9.907 -14.033 20 HB1 ALA 3 1HB ALA 3 -5.631 -12.529 -13.046 21 HB2 ALA 3 2HB ALA 3 -6.490 -10.992 -12.943 22 HB3 ALA 3 3HB ALA 3 -6.652 -11.997 -14.382 23 H LEU 4 H LEU 4 -3.743 -10.304 -12.022 24 HA LEU 4 HA LEU 4 -1.481 -12.168 -12.315 25 HB2 LEU 4 1HB LEU 4 -1.381 -9.372 -12.233 26 HB3 LEU 4 2HB LEU 4 -0.852 -9.911 -10.642 27 HG LEU 4 HG LEU 4 1.002 -9.526 -12.243 28 HD11 LEU 4 1HD1 LEU 4 0.799 -11.401 -10.351 29 HD12 LEU 4 2HD1 LEU 4 2.245 -11.183 -11.337 30 HD13 LEU 4 3HD1 LEU 4 1.077 -12.439 -11.749 31 HD21 LEU 4 3HD2 LEU 4 1.107 -10.465 -14.270 32 HD22 LEU 4 1HD2 LEU 4 -0.618 -10.770 -14.063 33 HD23 LEU 4 2HD2 LEU 4 0.552 -12.032 -13.677 34 H ASN 5 H ASN 5 -0.565 -12.957 -10.330 35 HA ASN 5 HA ASN 5 -2.528 -13.678 -8.419 36 HB2 ASN 5 1HB ASN 5 0.161 -14.426 -9.057 37 HB3 ASN 5 2HB ASN 5 0.055 -14.118 -7.326 38 HD21 ASN 5 1HD2 ASN 5 -2.328 -15.419 -9.594 39 HD22 ASN 5 2HD2 ASN 5 -2.542 -16.925 -8.774 40 H LYS 6 H LYS 6 -0.656 -10.900 -8.767 41 HA LYS 6 HA LYS 6 -0.004 -10.164 -6.173 42 HB2 LYS 6 1HB LYS 6 0.382 -8.987 -8.503 43 HB3 LYS 6 2HB LYS 6 -1.074 -8.106 -8.059 44 HG2 LYS 6 1HG LYS 6 0.047 -6.800 -6.662 45 HG3 LYS 6 2HG LYS 6 0.807 -8.183 -5.872 46 HD2 LYS 6 1HD LYS 6 2.420 -8.281 -7.782 47 HD3 LYS 6 2HD LYS 6 1.724 -6.770 -8.374 48 HE2 LYS 6 1HE LYS 6 2.640 -5.531 -6.688 49 HE3 LYS 6 2HE LYS 6 2.619 -6.873 -5.544 50 HZ1 LYS 6 3HZ LYS 6 4.537 -6.446 -7.768 51 HZ2 LYS 6 1HZ LYS 6 4.453 -7.873 -6.862 52 HZ3 LYS 6 2HZ LYS 6 4.868 -6.416 -6.109 53 H ALA 7 H ALA 7 -2.890 -9.035 -7.946 54 HA ALA 7 HA ALA 7 -4.998 -8.525 -7.252 55 HB1 ALA 7 1HB ALA 7 -4.460 -10.040 -4.716 56 HB2 ALA 7 2HB ALA 7 -5.995 -9.800 -5.553 57 HB3 ALA 7 3HB ALA 7 -4.765 -10.855 -6.251 58 H THR 8 H THR 8 -5.474 -6.516 -6.687 59 HA THR 8 HA THR 8 -4.586 -5.512 -4.080 60 HB THR 8 HB THR 8 -3.504 -3.668 -4.852 61 HG1 THR 8 1HG THR 8 -4.052 -2.815 -7.048 62 HG21 THR 8 3HG2 THR 8 -3.230 -5.150 -7.446 63 HG22 THR 8 1HG2 THR 8 -2.539 -5.792 -5.957 64 HG23 THR 8 2HG2 THR 8 -2.017 -4.221 -6.567 65 H ALA 9 H ALA 9 -5.853 -3.770 -3.249 66 HA ALA 9 HA ALA 9 -8.239 -2.967 -4.677 67 HB1 ALA 9 1HB ALA 9 -9.556 -4.541 -3.818 68 HB2 ALA 9 2HB ALA 9 -8.298 -5.093 -2.713 69 HB3 ALA 9 3HB ALA 9 -9.343 -3.747 -2.258 70 H THR 10 H THR 10 -9.097 -1.059 -3.934 71 HA THR 10 HA THR 10 -7.980 0.082 -1.471 72 HB THR 10 HB THR 10 -7.038 1.893 -2.434 73 HG1 THR 10 1HG THR 10 -9.006 1.773 -4.496 74 HG21 THR 10 3HG2 THR 10 -7.204 0.447 -5.058 75 HG22 THR 10 1HG2 THR 10 -6.248 -0.198 -3.725 76 HG23 THR 10 2HG2 THR 10 -5.871 1.390 -4.393 77 H SER 11 H SER 11 -9.128 2.272 -1.022 78 HA SER 11 HA SER 11 -11.990 1.733 -1.168 79 HB2 SER 11 1HB SER 11 -11.385 2.248 1.032 80 HB3 SER 11 2HB SER 11 -10.270 3.520 0.531 81 HG SER 11 HG SER 11 -12.807 3.763 1.246 82 H SER 12 H SER 12 -9.658 4.238 -2.045 83 HA SER 12 HA SER 12 -11.765 5.540 -3.642 84 HB2 SER 12 1HB SER 12 -9.823 6.630 -1.777 85 HB3 SER 12 2HB SER 12 -9.685 7.383 -3.365 86 HG SER 12 HG SER 12 -11.668 8.187 -3.180 87 H ILE 13 H ILE 13 -11.353 6.036 -5.760 88 HA ILE 13 HA ILE 13 -8.735 5.825 -6.907 89 HB ILE 13 HB ILE 13 -9.233 3.449 -6.760 90 HG12 ILE 13 1HG1 ILE 13 -9.476 4.544 -9.571 91 HG13 ILE 13 2HG1 ILE 13 -7.980 4.212 -8.705 92 HG21 ILE 13 1HG2 ILE 13 -11.278 2.625 -7.017 93 HG22 ILE 13 2HG2 ILE 13 -11.862 4.264 -7.297 94 HG23 ILE 13 3HG2 ILE 13 -11.372 3.258 -8.661 95 HD11 ILE 13 3HD1 ILE 13 -8.061 2.309 -9.892 96 HD12 ILE 13 1HD1 ILE 13 -9.124 1.791 -8.584 97 HD13 ILE 13 2HD1 ILE 13 -9.811 2.382 -10.097 98 H GLU 14 H GLU 14 -8.606 6.872 -8.838 99 HA GLU 14 HA GLU 14 -10.528 8.701 -9.588 100 HB2 GLU 14 1HB GLU 14 -8.180 7.494 -10.990 101 HB3 GLU 14 2HB GLU 14 -9.284 8.510 -11.907 102 HG2 GLU 14 1HG GLU 14 -7.948 9.384 -9.360 103 HG3 GLU 14 2HG GLU 14 -7.287 9.678 -10.968 104 H THR 15 H THR 15 -9.828 5.584 -11.170 105 HA THR 15 HA THR 15 -12.158 5.783 -12.849 106 HB THR 15 HB THR 15 -11.511 3.695 -13.792 107 HG1 THR 15 1HG THR 15 -10.736 2.213 -12.510 108 HG21 THR 15 3HG2 THR 15 -8.836 4.847 -13.097 109 HG22 THR 15 1HG2 THR 15 -9.978 5.782 -14.061 110 HG23 THR 15 2HG2 THR 15 -9.414 4.215 -14.639 111 H ALA 16 H ALA 16 -13.240 3.306 -12.913 112 HA ALA 16 HA ALA 16 -14.696 3.227 -10.386 113 HB1 ALA 16 1HB ALA 16 -16.119 3.328 -12.269 114 HB2 ALA 16 2HB ALA 16 -15.240 2.042 -13.096 115 HB3 ALA 16 3HB ALA 16 -16.214 1.670 -11.673 116 H GLY 17 H GLY 17 -12.108 2.264 -10.157 117 HA2 GLY 17 2HA GLY 17 -11.070 0.486 -9.115 118 HA3 GLY 17 3HA GLY 17 -12.609 -0.361 -9.132 119 H HIS 18 H HIS 18 -9.551 0.019 -10.639 120 HA HIS 18 HA HIS 18 -9.603 -2.441 -11.930 121 HB2 HIS 18 1HB HIS 18 -11.085 -0.509 -13.358 122 HB3 HIS 18 2HB HIS 18 -9.574 -0.720 -14.238 123 HD1 HIS 18 1HD HIS 18 -12.606 -1.744 -14.944 124 HD2 HIS 18 2HD HIS 18 -9.326 -4.004 -13.764 125 HE1 HIS 18 1HE HIS 18 -13.055 -4.070 -15.787 126 H GLU 19 H GLU 19 -8.361 0.807 -11.744 127 HA GLU 19 HA GLU 19 -5.980 0.471 -13.195 128 HB2 GLU 19 1HB GLU 19 -7.184 2.508 -11.675 129 HB3 GLU 19 2HB GLU 19 -5.610 2.234 -10.942 130 HG2 GLU 19 1HG GLU 19 -4.562 2.524 -13.153 131 HG3 GLU 19 2HG GLU 19 -6.148 2.886 -13.829 132 H GLY 20 H GLY 20 -6.930 -0.614 -10.055 133 HA2 GLY 20 2HA GLY 20 -4.345 -0.936 -8.925 134 HA3 GLY 20 3HA GLY 20 -5.813 -1.741 -8.393 135 H ASP 21 H ASP 21 -6.348 -2.980 -10.961 136 HA ASP 21 HA ASP 21 -4.707 -5.309 -10.626 137 HB2 ASP 21 1HB ASP 21 -7.077 -5.532 -11.182 138 HB3 ASP 21 2HB ASP 21 -6.820 -4.666 -12.693 139 H LYS 22 H LYS 22 -4.201 -2.453 -12.197 140 HA LYS 22 HA LYS 22 -3.063 -3.303 -14.648 141 HB2 LYS 22 1HB LYS 22 -2.569 -0.800 -13.027 142 HB3 LYS 22 2HB LYS 22 -2.013 -1.051 -14.676 143 HG2 LYS 22 1HG LYS 22 -4.915 -1.216 -13.937 144 HG3 LYS 22 2HG LYS 22 -4.132 0.311 -14.350 145 HD2 LYS 22 1HD LYS 22 -3.438 -0.682 -16.511 146 HD3 LYS 22 2HD LYS 22 -4.336 -2.144 -16.095 147 HE2 LYS 22 1HE LYS 22 -6.151 -0.085 -15.694 148 HE3 LYS 22 2HE LYS 22 -5.285 0.383 -17.155 149 HZ1 LYS 22 3HZ LYS 22 -6.503 -2.291 -16.755 150 HZ2 LYS 22 1HZ LYS 22 -5.863 -1.660 -18.188 151 HZ3 LYS 22 2HZ LYS 22 -7.285 -1.014 -17.542 152 H ALA 23 H ALA 23 -2.022 -3.655 -11.469 153 HA ALA 23 HA ALA 23 0.749 -3.334 -11.653 154 HB1 ALA 23 1HB ALA 23 -1.101 -4.774 -9.858 155 HB2 ALA 23 2HB ALA 23 0.576 -5.319 -9.854 156 HB3 ALA 23 3HB ALA 23 0.196 -3.638 -9.483 157 H VAL 24 H VAL 24 -1.297 -5.668 -13.076 158 HA VAL 24 HA VAL 24 0.162 -7.976 -13.214 159 HB VAL 24 HB VAL 24 -1.364 -6.699 -15.488 160 HG11 VAL 24 1HG1 VAL 24 0.224 -9.060 -15.413 161 HG12 VAL 24 2HG1 VAL 24 -1.471 -9.527 -15.563 162 HG13 VAL 24 3HG1 VAL 24 -0.750 -8.427 -16.739 163 HG21 VAL 24 3HG2 VAL 24 -2.343 -7.437 -13.054 164 HG22 VAL 24 1HG2 VAL 24 -3.279 -7.402 -14.550 165 HG23 VAL 24 2HG2 VAL 24 -2.566 -8.915 -13.990 166 H ASP 25 H ASP 25 0.715 -4.981 -14.967 167 HA ASP 25 HA ASP 25 2.540 -5.850 -16.873 168 HB2 ASP 25 1HB ASP 25 1.685 -3.332 -15.775 169 HB3 ASP 25 2HB ASP 25 3.432 -3.321 -15.994 170 H GLY 26 H GLY 26 3.100 -4.845 -13.517 171 HA2 GLY 26 2HA GLY 26 4.814 -5.398 -12.080 172 HA3 GLY 26 3HA GLY 26 5.387 -6.539 -13.287 173 H ASN 27 H ASN 27 4.932 -3.181 -14.078 174 HA ASN 27 HA ASN 27 7.736 -2.547 -13.669 175 HB2 ASN 27 1HB ASN 27 7.077 -3.639 -16.077 176 HB3 ASN 27 2HB ASN 27 6.844 -1.926 -16.412 177 HD21 ASN 27 1HD2 ASN 27 8.569 -1.641 -17.729 178 HD22 ASN 27 2HD2 ASN 27 10.211 -1.786 -17.210 179 H ALA 28 H ALA 28 7.876 -0.265 -15.229 180 HA ALA 28 HA ALA 28 6.373 1.573 -13.634 181 HB1 ALA 28 1HB ALA 28 7.550 2.882 -15.870 182 HB2 ALA 28 2HB ALA 28 8.050 2.915 -14.179 183 HB3 ALA 28 3HB ALA 28 8.683 1.675 -15.262 184 H ALA 29 H ALA 29 5.504 -0.234 -16.248 185 HA ALA 29 HA ALA 29 4.090 1.624 -17.849 186 HB1 ALA 29 1HB ALA 29 3.290 -1.250 -17.585 187 HB2 ALA 29 2HB ALA 29 3.250 -0.209 -19.007 188 HB3 ALA 29 3HB ALA 29 4.793 -0.797 -18.387 189 H THR 30 H THR 30 3.514 0.493 -14.734 190 HA THR 30 HA THR 30 0.615 0.872 -14.919 191 HB THR 30 HB THR 30 0.382 -0.247 -12.882 192 HG1 THR 30 1HG THR 30 3.128 -0.237 -12.273 193 HG21 THR 30 3HG2 THR 30 2.837 -1.486 -14.133 194 HG22 THR 30 1HG2 THR 30 1.180 -1.745 -14.672 195 HG23 THR 30 2HG2 THR 30 1.684 -2.296 -13.074 196 H ARG 31 H ARG 31 -0.387 2.624 -14.137 197 HA ARG 31 HA ARG 31 1.065 4.397 -12.306 198 HB2 ARG 31 1HB ARG 31 -0.174 5.144 -14.943 199 HB3 ARG 31 2HB ARG 31 0.030 6.330 -13.662 200 HG2 ARG 31 1HG ARG 31 1.964 6.683 -14.785 201 HG3 ARG 31 2HG ARG 31 2.510 5.398 -13.706 202 HD2 ARG 31 1HD ARG 31 3.243 4.508 -15.658 203 HD3 ARG 31 2HD ARG 31 1.590 3.896 -15.710 204 HE ARG 31 HE ARG 31 1.518 6.355 -16.944 205 HH11 ARG 31 1HH1 ARG 31 3.175 3.332 -17.422 206 HH12 ARG 31 2HH1 ARG 31 3.288 3.514 -19.141 207 HH21 ARG 31 1HH2 ARG 31 1.660 6.608 -19.207 208 HH22 ARG 31 2HH2 ARG 31 2.426 5.379 -20.156 209 H TRP 32 H TRP 32 -0.162 4.261 -10.531 210 HA TRP 32 HA TRP 32 -3.069 4.185 -10.771 211 HB2 TRP 32 1HB TRP 32 -2.223 2.576 -9.241 212 HB3 TRP 32 2HB TRP 32 -1.177 3.760 -8.461 213 HD1 TRP 32 HD TRP 32 -2.384 5.556 -6.815 214 HE1 TRP 32 1HE TRP 32 -4.567 5.381 -5.460 215 HE3 TRP 32 3HE TRP 32 -4.536 1.608 -9.249 216 HZ2 TRP 32 2HZ TRP 32 -6.892 3.780 -5.429 217 HZ3 TRP 32 3HZ TRP 32 -6.740 0.817 -8.494 218 HH2 TRP 32 HH TRP 32 -7.892 1.881 -6.623 219 H ALA 33 H ALA 33 -4.396 5.825 -10.229 220 HA ALA 33 HA ALA 33 -3.297 8.142 -8.813 221 HB1 ALA 33 1HB ALA 33 -5.056 8.965 -10.969 222 HB2 ALA 33 2HB ALA 33 -3.461 9.568 -10.518 223 HB3 ALA 33 3HB ALA 33 -3.606 8.151 -11.559 224 H SER 34 H SER 34 -4.574 8.555 -7.146 225 HA SER 34 HA SER 34 -7.358 7.669 -7.207 226 HB2 SER 34 1HB SER 34 -6.552 6.955 -5.186 227 HB3 SER 34 2HB SER 34 -5.374 8.264 -5.072 228 HG SER 34 HG SER 34 -8.035 8.183 -4.270 229 H ALA 35 H ALA 35 -9.086 9.015 -7.078 230 HA ALA 35 HA ALA 35 -9.015 11.560 -8.093 231 HB1 ALA 35 1HB ALA 35 -11.162 10.896 -8.084 232 HB2 ALA 35 2HB ALA 35 -10.979 9.975 -6.592 233 HB3 ALA 35 3HB ALA 35 -11.220 11.721 -6.526 234 H TYR 36 H TYR 36 -8.209 13.415 -7.386 235 HA TYR 36 HA TYR 36 -6.893 13.870 -5.048 236 HB2 TYR 36 1HB TYR 36 -7.596 16.354 -5.445 237 HB3 TYR 36 2HB TYR 36 -6.592 15.535 -6.635 238 HD1 TYR 36 1HD TYR 36 -10.033 16.662 -5.892 239 HD2 TYR 36 2HD TYR 36 -7.366 15.169 -8.852 240 HE1 TYR 36 1HE TYR 36 -11.686 17.184 -7.635 241 HE2 TYR 36 2HE TYR 36 -9.012 15.689 -10.604 242 HH TYR 36 HH TYR 36 -11.348 16.076 -10.878 243 H GLY 37 H GLY 37 -7.474 13.855 -2.986 244 HA2 GLY 37 2HA GLY 37 -8.762 14.861 -1.205 245 HA3 GLY 37 3HA GLY 37 -10.157 14.848 -2.275 246 H ALA 38 H ALA 38 -11.010 13.871 -0.177 247 HA ALA 38 HA ALA 38 -11.967 12.062 0.824 248 HB1 ALA 38 1HB ALA 38 -12.296 10.082 -0.400 249 HB2 ALA 38 2HB ALA 38 -12.245 11.369 -1.606 250 HB3 ALA 38 3HB ALA 38 -10.837 10.336 -1.360 251 H SER 39 H SER 39 -8.904 12.747 0.873 252 HA SER 39 HA SER 39 -7.722 10.278 1.763 253 HB2 SER 39 1HB SER 39 -6.804 12.926 1.075 254 HB3 SER 39 2HB SER 39 -6.119 12.429 2.623 255 HG SER 39 HG SER 39 -5.788 11.311 0.081 256 HA PRO 40 HA PRO 40 -5.564 10.501 3.189 257 HB2 PRO 40 1HB PRO 40 -5.046 8.533 4.986 258 HB3 PRO 40 2HB PRO 40 -4.662 10.233 5.285 259 HG2 PRO 40 1HG PRO 40 -7.004 8.625 6.230 260 HG3 PRO 40 2HG PRO 40 -6.014 9.793 7.125 261 HD2 PRO 40 1HD PRO 40 -8.442 10.422 6.105 262 HD3 PRO 40 2HD PRO 40 -7.127 11.606 6.240 263 H GLN 41 H GLN 41 -5.028 8.694 1.953 264 HA GLN 41 HA GLN 41 -7.266 6.887 1.410 265 HB2 GLN 41 1HB GLN 41 -5.468 8.272 -0.248 266 HB3 GLN 41 2HB GLN 41 -5.029 6.574 -0.386 267 HG2 GLN 41 1HG GLN 41 -6.580 6.913 -2.086 268 HG3 GLN 41 2HG GLN 41 -7.506 6.143 -0.799 269 HE21 GLN 41 1HE2 GLN 41 -8.887 7.461 0.492 270 HE22 GLN 41 2HE2 GLN 41 -9.530 8.935 -0.139 271 H TRP 42 H TRP 42 -6.519 4.629 0.642 272 HA TRP 42 HA TRP 42 -4.173 3.564 1.913 273 HB2 TRP 42 1HB TRP 42 -5.277 2.094 3.482 274 HB3 TRP 42 2HB TRP 42 -5.770 3.751 3.818 275 HD1 TRP 42 HD TRP 42 -8.294 4.439 2.870 276 HE1 TRP 42 1HE TRP 42 -10.414 2.986 2.730 277 HE3 TRP 42 3HE TRP 42 -6.132 -0.186 3.158 278 HZ2 TRP 42 2HZ TRP 42 -11.082 0.244 2.742 279 HZ3 TRP 42 3HZ TRP 42 -7.583 -2.172 3.088 280 HH2 TRP 42 HH TRP 42 -10.006 -1.960 2.885 281 H ILE 43 H ILE 43 -3.797 1.339 1.383 282 HA ILE 43 HA ILE 43 -5.633 0.052 -0.463 283 HB ILE 43 HB ILE 43 -4.326 1.434 -1.975 284 HG12 ILE 43 1HG1 ILE 43 -3.249 -1.368 -2.226 285 HG13 ILE 43 2HG1 ILE 43 -4.949 -1.002 -2.500 286 HG21 ILE 43 1HG2 ILE 43 -1.977 1.424 -2.102 287 HG22 ILE 43 2HG2 ILE 43 -2.348 1.554 -0.384 288 HG23 ILE 43 3HG2 ILE 43 -1.845 0.006 -1.063 289 HD11 ILE 43 3HD1 ILE 43 -4.124 -0.898 -4.626 290 HD12 ILE 43 1HD1 ILE 43 -3.983 0.791 -4.138 291 HD13 ILE 43 2HD1 ILE 43 -2.564 -0.257 -4.109 292 H TYR 44 H TYR 44 -5.524 -2.126 -0.365 293 HA TYR 44 HA TYR 44 -3.294 -3.295 1.168 294 HB2 TYR 44 1HB TYR 44 -4.775 -4.807 2.221 295 HB3 TYR 44 2HB TYR 44 -5.583 -3.244 2.297 296 HD1 TYR 44 1HD TYR 44 -5.591 -6.559 0.710 297 HD2 TYR 44 2HD TYR 44 -7.619 -2.837 1.074 298 HE1 TYR 44 1HE TYR 44 -7.568 -7.538 -0.376 299 HE2 TYR 44 2HE TYR 44 -9.603 -3.805 -0.010 300 HH TYR 44 HH TYR 44 -10.601 -6.023 -0.380 301 H ILE 45 H ILE 45 -2.591 -5.384 0.571 302 HA ILE 45 HA ILE 45 -3.530 -6.343 -2.046 303 HB ILE 45 HB ILE 45 -0.633 -6.122 -1.222 304 HG12 ILE 45 1HG1 ILE 45 -2.246 -4.614 -3.289 305 HG13 ILE 45 2HG1 ILE 45 -1.542 -3.949 -1.820 306 HG21 ILE 45 1HG2 ILE 45 -1.112 -6.683 -4.006 307 HG22 ILE 45 2HG2 ILE 45 -0.129 -7.562 -2.836 308 HG23 ILE 45 3HG2 ILE 45 -1.851 -7.913 -2.981 309 HD11 ILE 45 3HD1 ILE 45 -0.286 -4.599 -4.405 310 HD12 ILE 45 1HD1 ILE 45 0.056 -3.296 -3.265 311 HD13 ILE 45 2HD1 ILE 45 0.669 -4.922 -2.958 312 H ASN 46 H ASN 46 -3.967 -8.452 -2.088 313 HA ASN 46 HA ASN 46 -2.966 -10.114 0.127 314 HB2 ASN 46 1HB ASN 46 -4.987 -11.595 -0.627 315 HB3 ASN 46 2HB ASN 46 -5.276 -10.166 0.361 316 HD21 ASN 46 1HD2 ASN 46 -6.076 -11.786 -2.452 317 HD22 ASN 46 2HD2 ASN 46 -6.954 -10.524 -3.240 318 H LEU 47 H LEU 47 -1.668 -11.769 -0.333 319 HA LEU 47 HA LEU 47 -1.055 -12.340 -3.114 320 HB2 LEU 47 1HB LEU 47 0.586 -12.066 -1.089 321 HB3 LEU 47 2HB LEU 47 0.211 -13.767 -0.820 322 HG LEU 47 HG LEU 47 1.480 -12.572 -3.282 323 HD11 LEU 47 1HD1 LEU 47 2.748 -14.658 -1.592 324 HD12 LEU 47 2HD1 LEU 47 2.738 -12.998 -0.998 325 HD13 LEU 47 3HD1 LEU 47 3.483 -13.374 -2.551 326 HD21 LEU 47 3HD2 LEU 47 0.402 -15.297 -2.688 327 HD22 LEU 47 1HD2 LEU 47 1.787 -15.104 -3.761 328 HD23 LEU 47 2HD2 LEU 47 0.253 -14.327 -4.153 329 H GLY 48 H GLY 48 -1.866 -14.271 -0.219 330 HA2 GLY 48 2HA GLY 48 -3.893 -15.781 -0.842 331 HA3 GLY 48 3HA GLY 48 -2.740 -16.443 -1.991 332 H SER 49 H SER 49 -0.694 -15.749 0.284 333 HA SER 49 HA SER 49 -1.313 -17.762 2.259 334 HB2 SER 49 1HB SER 49 0.893 -18.984 1.722 335 HB3 SER 49 2HB SER 49 -0.492 -19.307 0.680 336 HG SER 49 HG SER 49 0.383 -17.750 -0.783 337 H THR 50 H THR 50 0.642 -18.060 3.763 338 HA THR 50 HA THR 50 1.539 -15.420 4.513 339 HB THR 50 HB THR 50 2.766 -17.466 6.104 340 HG1 THR 50 1HG THR 50 1.263 -18.948 6.023 341 HG21 THR 50 3HG2 THR 50 1.537 -15.011 6.444 342 HG22 THR 50 1HG2 THR 50 2.152 -16.051 7.727 343 HG23 THR 50 2HG2 THR 50 0.453 -16.136 7.262 344 H GLN 51 H GLN 51 3.402 -14.534 3.930 345 HA GLN 51 HA GLN 51 5.673 -16.289 3.296 346 HB2 GLN 51 1HB GLN 51 4.280 -14.469 1.519 347 HB3 GLN 51 2HB GLN 51 5.980 -14.043 1.666 348 HG2 GLN 51 1HG GLN 51 4.886 -16.732 0.871 349 HG3 GLN 51 2HG GLN 51 5.611 -15.539 -0.205 350 HE21 GLN 51 1HE2 GLN 51 7.865 -14.864 0.441 351 HE22 GLN 51 2HE2 GLN 51 8.932 -16.121 0.957 352 H SER 52 H SER 52 7.729 -15.443 3.729 353 HA SER 52 HA SER 52 7.775 -13.513 5.866 354 HB2 SER 52 1HB SER 52 9.238 -15.656 5.578 355 HB3 SER 52 2HB SER 52 10.246 -14.621 4.567 356 HG SER 52 HG SER 52 9.477 -13.981 7.220 357 H ILE 53 H ILE 53 8.400 -11.432 5.790 358 HA ILE 53 HA ILE 53 9.350 -10.393 3.201 359 HB ILE 53 HB ILE 53 8.302 -8.186 4.103 360 HG12 ILE 53 1HG1 ILE 53 6.468 -10.141 5.477 361 HG13 ILE 53 2HG1 ILE 53 7.790 -9.356 6.334 362 HG21 ILE 53 1HG2 ILE 53 5.994 -9.662 3.352 363 HG22 ILE 53 2HG2 ILE 53 6.972 -8.572 2.372 364 HG23 ILE 53 3HG2 ILE 53 7.373 -10.287 2.448 365 HD11 ILE 53 3HD1 ILE 53 6.683 -7.430 6.503 366 HD12 ILE 53 1HD1 ILE 53 6.096 -7.510 4.842 367 HD13 ILE 53 2HD1 ILE 53 5.256 -8.392 6.117 368 H SER 54 H SER 54 10.888 -8.729 3.224 369 HA SER 54 HA SER 54 12.384 -8.523 5.751 370 HB2 SER 54 1HB SER 54 14.294 -7.828 4.200 371 HB3 SER 54 2HB SER 54 13.783 -9.512 4.110 372 HG SER 54 HG SER 54 13.394 -9.174 2.085 373 H ARG 55 H ARG 55 11.968 -6.560 2.799 374 HA ARG 55 HA ARG 55 11.327 -4.249 4.474 375 HB2 ARG 55 1HB ARG 55 12.870 -2.877 2.947 376 HB3 ARG 55 2HB ARG 55 13.621 -3.854 4.203 377 HG2 ARG 55 1HG ARG 55 13.336 -5.335 1.737 378 HG3 ARG 55 2HG ARG 55 14.246 -3.841 1.505 379 HD2 ARG 55 1HD ARG 55 15.371 -4.727 3.783 380 HD3 ARG 55 2HD ARG 55 14.927 -6.265 3.045 381 HE ARG 55 HE ARG 55 16.244 -4.588 1.175 382 HH11 ARG 55 1HH1 ARG 55 16.820 -6.634 3.932 383 HH12 ARG 55 2HH1 ARG 55 18.447 -7.014 3.473 384 HH21 ARG 55 1HH2 ARG 55 18.384 -5.081 0.560 385 HH22 ARG 55 2HH2 ARG 55 19.336 -6.130 1.556 386 H VAL 56 H VAL 56 9.810 -2.938 3.616 387 HA VAL 56 HA VAL 56 8.983 -3.470 0.836 388 HB VAL 56 HB VAL 56 7.222 -4.286 2.161 389 HG11 VAL 56 1HG1 VAL 56 7.792 -1.923 3.894 390 HG12 VAL 56 2HG1 VAL 56 6.192 -2.664 3.927 391 HG13 VAL 56 3HG1 VAL 56 7.616 -3.621 4.333 392 HG21 VAL 56 3HG2 VAL 56 6.429 -1.444 1.544 393 HG22 VAL 56 1HG2 VAL 56 6.551 -2.727 0.340 394 HG23 VAL 56 2HG2 VAL 56 5.369 -2.849 1.644 395 H LYS 57 H LYS 57 8.907 -1.787 -0.516 396 HA LYS 57 HA LYS 57 9.062 0.923 0.633 397 HB2 LYS 57 1HB LYS 57 11.198 0.342 -0.353 398 HB3 LYS 57 2HB LYS 57 10.413 -0.160 -1.845 399 HG2 LYS 57 1HG LYS 57 9.690 2.544 -1.218 400 HG3 LYS 57 2HG LYS 57 11.445 2.363 -1.216 401 HD2 LYS 57 1HD LYS 57 10.070 1.032 -3.444 402 HD3 LYS 57 2HD LYS 57 9.933 2.791 -3.437 403 HE2 LYS 57 1HE LYS 57 12.291 3.057 -3.468 404 HE3 LYS 57 2HE LYS 57 12.556 1.347 -3.134 405 HZ1 LYS 57 3HZ LYS 57 11.102 1.284 -5.403 406 HZ2 LYS 57 1HZ LYS 57 12.789 1.182 -5.333 407 HZ3 LYS 57 2HZ LYS 57 12.044 2.669 -5.640 408 H LEU 58 H LEU 58 7.668 2.420 -0.124 409 HA LEU 58 HA LEU 58 6.134 1.826 -2.550 410 HB2 LEU 58 1HB LEU 58 4.052 2.191 -1.547 411 HB3 LEU 58 2HB LEU 58 4.911 1.118 -0.445 412 HG LEU 58 HG LEU 58 3.748 2.698 0.884 413 HD11 LEU 58 1HD1 LEU 58 6.473 3.913 0.854 414 HD12 LEU 58 2HD1 LEU 58 6.276 2.215 1.287 415 HD13 LEU 58 3HD1 LEU 58 5.455 3.463 2.223 416 HD21 LEU 58 3HD2 LEU 58 5.029 5.134 -0.079 417 HD22 LEU 58 1HD2 LEU 58 3.339 4.819 0.316 418 HD23 LEU 58 2HD2 LEU 58 3.968 4.381 -1.272 419 H ASN 59 H ASN 59 5.208 3.664 -3.570 420 HA ASN 59 HA ASN 59 6.569 6.166 -2.852 421 HB2 ASN 59 1HB ASN 59 7.157 5.726 -5.051 422 HB3 ASN 59 2HB ASN 59 5.594 5.010 -5.435 423 HD21 ASN 59 1HD2 ASN 59 3.836 6.367 -5.875 424 HD22 ASN 59 2HD2 ASN 59 4.062 8.017 -6.333 425 H TRP 60 H TRP 60 5.430 8.148 -2.872 426 HA TRP 60 HA TRP 60 2.514 7.855 -2.556 427 HB2 TRP 60 1HB TRP 60 3.571 8.337 -0.414 428 HB3 TRP 60 2HB TRP 60 4.395 9.732 -1.108 429 HD1 TRP 60 HD TRP 60 3.069 11.984 -1.232 430 HE1 TRP 60 1HE TRP 60 0.754 12.736 -0.399 431 HE3 TRP 60 3HE TRP 60 1.105 7.412 -0.062 432 HZ2 TRP 60 2HZ TRP 60 -1.596 11.549 0.621 433 HZ3 TRP 60 3HZ TRP 60 -1.183 7.307 0.838 434 HH2 TRP 60 HH TRP 60 -2.503 9.334 1.172 435 H GLU 61 H GLU 61 4.922 9.170 -4.432 436 HA GLU 61 HA GLU 61 4.821 10.546 -6.256 437 HB2 GLU 61 1HB GLU 61 2.145 9.885 -5.832 438 HB3 GLU 61 2HB GLU 61 2.155 11.640 -5.925 439 HG2 GLU 61 1HG GLU 61 3.725 11.020 -8.033 440 HG3 GLU 61 2HG GLU 61 2.638 9.632 -8.009 441 H ASP 62 H ASP 62 3.694 13.012 -6.640 442 HA ASP 62 HA ASP 62 5.256 14.635 -4.899 443 HB2 ASP 62 1HB ASP 62 4.347 14.953 -7.425 444 HB3 ASP 62 2HB ASP 62 3.173 15.935 -6.552 445 H ALA 63 H ALA 63 2.076 13.425 -4.746 446 HA ALA 63 HA ALA 63 0.551 15.315 -3.526 447 HB1 ALA 63 1HB ALA 63 -0.320 13.125 -3.990 448 HB2 ALA 63 2HB ALA 63 0.763 12.396 -2.802 449 HB3 ALA 63 3HB ALA 63 -0.534 13.468 -2.273 450 H TYR 64 H TYR 64 0.350 16.241 -1.535 451 HA TYR 64 HA TYR 64 2.684 16.276 0.128 452 HB2 TYR 64 1HB TYR 64 1.409 18.320 -0.230 453 HB3 TYR 64 2HB TYR 64 -0.023 17.580 0.478 454 HD1 TYR 64 1HD TYR 64 3.458 18.621 1.269 455 HD2 TYR 64 2HD TYR 64 -0.416 17.722 2.782 456 HE1 TYR 64 1HE TYR 64 4.141 19.438 3.486 457 HE2 TYR 64 2HE TYR 64 0.256 18.538 5.003 458 HH TYR 64 HH TYR 64 1.905 19.346 6.247 459 H ALA 65 H ALA 65 3.117 14.899 1.705 460 HA ALA 65 HA ALA 65 0.973 13.915 3.416 461 HB1 ALA 65 1HB ALA 65 0.883 12.061 2.096 462 HB2 ALA 65 2HB ALA 65 2.560 12.216 1.570 463 HB3 ALA 65 3HB ALA 65 2.193 11.579 3.173 464 H THR 66 H THR 66 1.598 13.640 5.495 465 HA THR 66 HA THR 66 4.211 14.570 6.246 466 HB THR 66 HB THR 66 3.152 13.675 8.583 467 HG1 THR 66 1HG THR 66 0.861 14.284 8.381 468 HG21 THR 66 3HG2 THR 66 3.418 16.170 7.198 469 HG22 THR 66 1HG2 THR 66 3.454 15.855 8.931 470 HG23 THR 66 2HG2 THR 66 1.917 16.167 8.124 471 H ALA 67 H ALA 67 2.536 11.482 6.149 472 HA ALA 67 HA ALA 67 4.896 9.973 6.014 473 HB1 ALA 67 1HB ALA 67 4.785 8.840 8.225 474 HB2 ALA 67 2HB ALA 67 5.265 10.535 8.314 475 HB3 ALA 67 3HB ALA 67 3.621 10.060 8.742 476 H TYR 68 H TYR 68 4.424 7.569 6.390 477 HA TYR 68 HA TYR 68 1.611 6.981 5.748 478 HB2 TYR 68 1HB TYR 68 3.776 5.310 4.552 479 HB3 TYR 68 2HB TYR 68 2.163 5.662 3.940 480 HD1 TYR 68 1HD TYR 68 1.774 8.198 3.284 481 HD2 TYR 68 2HD TYR 68 5.581 6.315 3.522 482 HE1 TYR 68 1HE TYR 68 2.710 9.916 1.793 483 HE2 TYR 68 2HE TYR 68 6.528 8.029 2.034 484 HH TYR 68 HH TYR 68 6.117 9.818 0.789 485 H SER 69 H SER 69 1.203 4.532 5.937 486 HA SER 69 HA SER 69 2.714 3.390 8.182 487 HB2 SER 69 1HB SER 69 -0.222 3.954 8.041 488 HB3 SER 69 2HB SER 69 0.334 2.537 8.932 489 HG SER 69 HG SER 69 0.629 3.928 10.482 490 H ILE 70 H ILE 70 3.105 1.251 8.032 491 HA ILE 70 HA ILE 70 1.747 -0.232 5.876 492 HB ILE 70 HB ILE 70 4.575 0.234 6.284 493 HG12 ILE 70 1HG1 ILE 70 3.294 -1.366 4.081 494 HG13 ILE 70 2HG1 ILE 70 3.077 0.378 4.182 495 HG21 ILE 70 1HG2 ILE 70 5.289 -2.109 5.828 496 HG22 ILE 70 2HG2 ILE 70 4.626 -1.857 7.442 497 HG23 ILE 70 3HG2 ILE 70 3.645 -2.629 6.197 498 HD11 ILE 70 3HD1 ILE 70 5.248 0.817 3.638 499 HD12 ILE 70 1HD1 ILE 70 5.836 -0.719 4.275 500 HD13 ILE 70 2HD1 ILE 70 4.983 -0.673 2.731 501 H GLN 71 H GLN 71 0.805 -2.085 6.451 502 HA GLN 71 HA GLN 71 1.755 -3.571 8.764 503 HB2 GLN 71 1HB GLN 71 -0.678 -3.735 9.573 504 HB3 GLN 71 2HB GLN 71 0.205 -2.256 9.926 505 HG2 GLN 71 1HG GLN 71 -1.077 -1.937 7.417 506 HG3 GLN 71 2HG GLN 71 -2.257 -2.571 8.564 507 HE21 GLN 71 1HE2 GLN 71 0.499 -0.422 9.091 508 HE22 GLN 71 2HE2 GLN 71 -0.425 0.904 9.700 509 H VAL 72 H VAL 72 -0.044 -5.486 9.050 510 HA VAL 72 HA VAL 72 -0.853 -6.490 6.437 511 HB VAL 72 HB VAL 72 0.282 -8.616 6.682 512 HG11 VAL 72 1HG1 VAL 72 2.187 -6.299 7.006 513 HG12 VAL 72 2HG1 VAL 72 2.597 -7.887 6.351 514 HG13 VAL 72 3HG1 VAL 72 1.460 -6.845 5.495 515 HG21 VAL 72 3HG2 VAL 72 0.278 -8.407 9.254 516 HG22 VAL 72 1HG2 VAL 72 1.631 -9.228 8.476 517 HG23 VAL 72 2HG2 VAL 72 1.812 -7.565 9.035 518 H SER 73 H SER 73 -1.425 -9.093 7.147 519 HA SER 73 HA SER 73 -3.264 -8.836 9.428 520 HB2 SER 73 1HB SER 73 -5.087 -9.180 8.162 521 HB3 SER 73 2HB SER 73 -4.062 -8.902 6.754 522 HG SER 73 HG SER 73 -5.278 -10.948 6.830 523 H ASN 74 H ASN 74 -2.773 -10.317 10.892 524 HA ASN 74 HA ASN 74 -2.746 -13.058 10.464 525 HB2 ASN 74 1HB ASN 74 -0.119 -13.200 11.042 526 HB3 ASN 74 2HB ASN 74 -0.745 -13.257 9.396 527 HD21 ASN 74 1HD2 ASN 74 -0.127 -10.682 11.763 528 HD22 ASN 74 2HD2 ASN 74 0.808 -9.696 10.696 529 H ASP 75 H ASP 75 -2.073 -14.286 12.378 530 HA ASP 75 HA ASP 75 -1.328 -12.905 14.770 531 HB2 ASP 75 1HB ASP 75 -3.865 -12.447 14.354 532 HB3 ASP 75 2HB ASP 75 -4.072 -14.110 14.897 533 H SER 76 H SER 76 -2.832 -15.791 13.377 534 HA SER 76 HA SER 76 -1.395 -17.429 15.356 535 HB2 SER 76 1HB SER 76 -3.307 -18.917 13.780 536 HB3 SER 76 2HB SER 76 -3.242 -18.689 15.528 537 HG SER 76 HG SER 76 -4.456 -16.995 13.606 538 H GLY 77 H GLY 77 -1.674 -16.655 12.011 539 HA2 GLY 77 2HA GLY 77 0.340 -17.187 10.684 540 HA3 GLY 77 3HA GLY 77 0.266 -18.796 11.386 541 H SER 78 H SER 78 -2.231 -19.625 11.095 542 HA SER 78 HA SER 78 -2.556 -19.692 8.184 543 HB2 SER 78 1HB SER 78 -2.437 -21.746 9.945 544 HB3 SER 78 2HB SER 78 -4.181 -21.497 9.878 545 HG SER 78 HG SER 78 -2.642 -21.665 7.522 546 H THR 79 H THR 79 -4.160 -18.726 11.110 547 HA THR 79 HA THR 79 -6.531 -17.944 9.541 548 HB THR 79 HB THR 79 -6.515 -18.212 12.539 549 HG1 THR 79 1HG THR 79 -5.909 -20.223 11.344 550 HG21 THR 79 3HG2 THR 79 -8.585 -17.428 12.263 551 HG22 THR 79 1HG2 THR 79 -8.980 -18.929 11.426 552 HG23 THR 79 2HG2 THR 79 -8.445 -17.521 10.507 553 HA PRO 80 HA PRO 80 -4.374 -14.035 10.806 554 HB2 PRO 80 1HB PRO 80 -4.720 -12.799 8.414 555 HB3 PRO 80 2HB PRO 80 -3.349 -13.861 8.757 556 HG2 PRO 80 1HG PRO 80 -5.888 -14.460 7.289 557 HG3 PRO 80 2HG PRO 80 -4.226 -14.924 6.884 558 HD2 PRO 80 1HD PRO 80 -5.966 -16.630 8.063 559 HD3 PRO 80 2HD PRO 80 -4.219 -16.684 8.372 560 H THR 81 H THR 81 -5.278 -11.928 11.077 561 HA THR 81 HA THR 81 -8.041 -11.479 10.331 562 HB THR 81 HB THR 81 -8.681 -10.940 12.720 563 HG1 THR 81 1HG THR 81 -7.271 -11.321 14.255 564 HG21 THR 81 3HG2 THR 81 -9.449 -13.110 13.147 565 HG22 THR 81 1HG2 THR 81 -8.036 -13.857 12.401 566 HG23 THR 81 2HG2 THR 81 -9.252 -13.070 11.396 567 H ASN 82 H ASN 82 -6.108 -10.137 12.987 568 HA ASN 82 HA ASN 82 -6.095 -7.560 11.555 569 HB2 ASN 82 1HB ASN 82 -7.153 -8.188 14.096 570 HB3 ASN 82 2HB ASN 82 -5.695 -7.244 14.388 571 HD21 ASN 82 1HD2 ASN 82 -6.433 -5.298 14.908 572 HD22 ASN 82 2HD2 ASN 82 -7.512 -4.348 13.949 573 H TRP 83 H TRP 83 -4.370 -6.137 13.097 574 HA TRP 83 HA TRP 83 -1.993 -7.414 13.847 575 HB2 TRP 83 1HB TRP 83 -2.083 -7.830 11.290 576 HB3 TRP 83 2HB TRP 83 -1.670 -6.124 11.150 577 HD1 TRP 83 HD TRP 83 0.814 -6.006 10.556 578 HE1 TRP 83 1HE TRP 83 2.973 -7.111 11.421 579 HE3 TRP 83 3HE TRP 83 -1.230 -9.235 13.952 580 HZ2 TRP 83 2HZ TRP 83 3.711 -9.088 13.295 581 HZ3 TRP 83 3HZ TRP 83 0.272 -10.698 15.239 582 HH2 TRP 83 HH TRP 83 2.690 -10.626 14.915 583 H THR 84 H THR 84 -0.101 -5.794 13.872 584 HA THR 84 HA THR 84 -1.202 -3.150 14.555 585 HB THR 84 HB THR 84 -0.184 -4.403 16.442 586 HG1 THR 84 1HG THR 84 0.019 -1.947 15.954 587 HG21 THR 84 3HG2 THR 84 1.543 -5.589 15.135 588 HG22 THR 84 1HG2 THR 84 2.220 -4.739 16.523 589 HG23 THR 84 2HG2 THR 84 2.393 -4.062 14.904 590 H THR 85 H THR 85 -0.185 -1.287 13.857 591 HA THR 85 HA THR 85 0.929 -1.223 11.341 592 HB THR 85 HB THR 85 1.654 1.064 11.814 593 HG1 THR 85 1HG THR 85 1.356 0.186 14.473 594 HG21 THR 85 3HG2 THR 85 -0.943 0.093 11.978 595 HG22 THR 85 1HG2 THR 85 -0.464 1.769 11.711 596 HG23 THR 85 2HG2 THR 85 -0.804 1.198 13.345 597 H VAL 86 H VAL 86 3.082 -0.670 10.609 598 HA VAL 86 HA VAL 86 5.185 -1.775 12.357 599 HB VAL 86 HB VAL 86 5.245 -1.813 9.343 600 HG11 VAL 86 1HG1 VAL 86 6.723 -3.879 10.686 601 HG12 VAL 86 2HG1 VAL 86 7.296 -2.635 9.573 602 HG13 VAL 86 3HG1 VAL 86 7.190 -2.294 11.301 603 HG21 VAL 86 3HG2 VAL 86 3.684 -3.405 9.403 604 HG22 VAL 86 1HG2 VAL 86 4.879 -4.420 10.211 605 HG23 VAL 86 2HG2 VAL 86 3.730 -3.482 11.165 606 H TYR 87 H TYR 87 4.099 0.926 10.615 607 HA TYR 87 HA TYR 87 6.478 2.409 11.328 608 HB2 TYR 87 1HB TYR 87 6.431 1.324 8.806 609 HB3 TYR 87 2HB TYR 87 5.760 2.927 8.530 610 HD1 TYR 87 1HD TYR 87 8.601 1.348 10.384 611 HD2 TYR 87 2HD TYR 87 7.245 4.612 8.016 612 HE1 TYR 87 1HE TYR 87 10.871 2.294 10.398 613 HE2 TYR 87 2HE TYR 87 9.512 5.566 8.021 614 HH TYR 87 HH TYR 87 11.546 5.470 9.328 615 H SER 88 H SER 88 6.093 4.568 11.618 616 HA SER 88 HA SER 88 4.100 6.128 10.520 617 HB2 SER 88 1HB SER 88 2.546 6.173 12.614 618 HB3 SER 88 2HB SER 88 2.331 4.898 11.414 619 HG SER 88 HG SER 88 2.644 3.572 13.002 620 H THR 89 H THR 89 3.906 8.209 11.517 621 HA THR 89 HA THR 89 5.068 8.934 13.959 622 HB THR 89 HB THR 89 7.216 8.367 13.071 623 HG1 THR 89 1HG THR 89 7.730 10.180 14.048 624 HG21 THR 89 3HG2 THR 89 8.078 9.161 10.982 625 HG22 THR 89 1HG2 THR 89 6.666 10.186 10.727 626 HG23 THR 89 2HG2 THR 89 6.503 8.430 10.669 627 H THR 90 H THR 90 4.591 9.976 10.604 628 HA THR 90 HA THR 90 3.550 11.795 9.712 629 HB THR 90 HB THR 90 2.490 12.612 12.393 630 HG1 THR 90 1HG THR 90 1.775 10.307 10.894 631 HG21 THR 90 3HG2 THR 90 0.433 12.957 10.941 632 HG22 THR 90 1HG2 THR 90 1.478 12.646 9.556 633 HG23 THR 90 2HG2 THR 90 1.803 14.016 10.617 634 H THR 91 H THR 91 5.793 12.587 9.531 635 HA THR 91 HA THR 91 6.202 14.995 11.183 636 HB THR 91 HB THR 91 8.579 14.725 11.045 637 HG1 THR 91 1HG THR 91 8.032 12.466 9.390 638 HG21 THR 91 3HG2 THR 91 7.041 13.151 12.559 639 HG22 THR 91 1HG2 THR 91 8.800 13.050 12.572 640 HG23 THR 91 2HG2 THR 91 7.859 11.906 11.616 641 H GLY 92 H GLY 92 6.945 13.510 8.030 642 HA2 GLY 92 2HA GLY 92 5.981 15.477 6.398 643 HA3 GLY 92 3HA GLY 92 7.592 16.035 6.823 644 H ASP 93 H ASP 93 7.940 15.869 4.480 645 HA ASP 93 HA ASP 93 8.988 14.870 2.723 646 HB2 ASP 93 1HB ASP 93 10.224 13.762 4.773 647 HB3 ASP 93 2HB ASP 93 9.357 12.323 4.246 648 H GLY 94 H GLY 94 7.092 14.792 1.494 649 HA2 GLY 94 2HA GLY 94 5.338 12.494 1.694 650 HA3 GLY 94 3HA GLY 94 5.176 13.839 0.575 651 H ALA 95 H ALA 95 8.310 12.654 0.533 652 HA ALA 95 HA ALA 95 7.965 11.572 -2.106 653 HB1 ALA 95 1HB ALA 95 10.542 11.166 -0.735 654 HB2 ALA 95 2HB ALA 95 10.193 11.825 -2.334 655 HB3 ALA 95 3HB ALA 95 10.012 12.841 -0.903 656 H ILE 96 H ILE 96 9.047 9.447 -2.668 657 HA ILE 96 HA ILE 96 7.702 7.306 -1.665 658 HB ILE 96 HB ILE 96 10.555 7.139 -2.636 659 HG12 ILE 96 1HG1 ILE 96 8.930 6.552 -4.781 660 HG13 ILE 96 2HG1 ILE 96 8.073 7.883 -4.010 661 HG21 ILE 96 1HG2 ILE 96 8.336 5.130 -2.937 662 HG22 ILE 96 2HG2 ILE 96 10.054 4.907 -3.261 663 HG23 ILE 96 3HG2 ILE 96 9.488 5.105 -1.603 664 HD11 ILE 96 3HD1 ILE 96 9.456 9.310 -4.963 665 HD12 ILE 96 1HD1 ILE 96 10.813 8.572 -4.111 666 HD13 ILE 96 2HD1 ILE 96 10.340 7.974 -5.702 667 H ASP 97 H ASP 97 7.833 5.947 0.035 668 HA ASP 97 HA ASP 97 9.992 6.433 1.980 669 HB2 ASP 97 1HB ASP 97 7.996 7.112 3.028 670 HB3 ASP 97 2HB ASP 97 7.084 5.761 2.363 671 H ASP 98 H ASP 98 11.339 4.807 2.344 672 HA ASP 98 HA ASP 98 10.550 2.112 1.469 673 HB2 ASP 98 1HB ASP 98 12.545 3.069 0.369 674 HB3 ASP 98 2HB ASP 98 13.322 3.230 1.943 675 H ILE 99 H ILE 99 9.937 0.791 3.038 676 HA ILE 99 HA ILE 99 10.988 1.202 5.747 677 HB ILE 99 HB ILE 99 8.570 -0.310 4.763 678 HG12 ILE 99 1HG1 ILE 99 8.639 1.956 6.741 679 HG13 ILE 99 2HG1 ILE 99 8.616 2.266 5.008 680 HG21 ILE 99 1HG2 ILE 99 9.937 -0.315 7.415 681 HG22 ILE 99 2HG2 ILE 99 8.182 -0.455 7.343 682 HG23 ILE 99 3HG2 ILE 99 9.195 -1.647 6.529 683 HD11 ILE 99 3HD1 ILE 99 6.577 0.373 5.835 684 HD12 ILE 99 1HD1 ILE 99 6.427 1.941 6.627 685 HD13 ILE 99 2HD1 ILE 99 6.441 1.840 4.867 686 H THR 100 H THR 100 12.004 -0.408 6.885 687 HA THR 100 HA THR 100 12.407 -2.999 5.580 688 HB THR 100 HB THR 100 14.760 -2.973 5.742 689 HG1 THR 100 1HG THR 100 14.318 -0.785 7.454 690 HG21 THR 100 3HG2 THR 100 14.463 -0.135 4.922 691 HG22 THR 100 1HG2 THR 100 13.530 -1.338 4.034 692 HG23 THR 100 2HG2 THR 100 15.287 -1.466 4.111 693 H PHE 101 H PHE 101 12.237 -4.637 6.972 694 HA PHE 101 HA PHE 101 12.883 -4.221 9.791 695 HB2 PHE 101 1HB PHE 101 10.194 -4.987 8.703 696 HB3 PHE 101 2HB PHE 101 10.706 -5.575 10.282 697 HD1 PHE 101 2HD PHE 101 9.817 -2.610 8.320 698 HD2 PHE 101 1HD PHE 101 10.874 -4.102 12.164 699 HE1 PHE 101 2HE PHE 101 9.096 -0.488 9.337 700 HE2 PHE 101 1HE PHE 101 10.152 -1.984 13.188 701 HZ PHE 101 HZ PHE 101 9.263 -0.173 11.775 702 H ALA 102 H ALA 102 12.228 -6.554 10.890 703 HA ALA 102 HA ALA 102 14.122 -8.366 9.734 704 HB1 ALA 102 1HB ALA 102 12.429 -9.461 11.841 705 HB2 ALA 102 2HB ALA 102 14.183 -9.284 11.771 706 HB3 ALA 102 3HB ALA 102 13.179 -7.923 12.271 707 H ALA 103 H ALA 103 13.643 -10.645 9.288 708 HA ALA 103 HA ALA 103 11.660 -10.958 7.344 709 HB1 ALA 103 1HB ALA 103 13.281 -12.511 7.040 710 HB2 ALA 103 2HB ALA 103 13.520 -12.766 8.768 711 HB3 ALA 103 3HB ALA 103 12.146 -13.509 7.949 712 H THR 104 H THR 104 9.559 -10.685 7.815 713 HA THR 104 HA THR 104 8.441 -12.274 10.033 714 HB THR 104 HB THR 104 6.567 -10.473 9.956 715 HG1 THR 104 1HG THR 104 7.030 -8.648 8.940 716 HG21 THR 104 3HG2 THR 104 9.238 -10.377 11.234 717 HG22 THR 104 1HG2 THR 104 7.636 -10.442 11.965 718 HG23 THR 104 2HG2 THR 104 8.255 -8.916 11.332 719 H ASN 105 H ASN 105 6.739 -13.567 9.592 720 HA ASN 105 HA ASN 105 6.006 -13.918 6.817 721 HB2 ASN 105 1HB ASN 105 4.551 -15.785 7.855 722 HB3 ASN 105 2HB ASN 105 6.303 -15.962 7.925 723 HD21 ASN 105 1HD2 ASN 105 7.154 -16.430 9.818 724 HD22 ASN 105 2HD2 ASN 105 6.393 -16.213 11.354 725 H ALA 106 H ALA 106 4.128 -13.357 5.869 726 HA ALA 106 HA ALA 106 1.791 -12.672 7.423 727 HB1 ALA 106 1HB ALA 106 2.839 -10.567 7.623 728 HB2 ALA 106 2HB ALA 106 3.342 -10.571 5.933 729 HB3 ALA 106 3HB ALA 106 1.637 -10.387 6.345 730 H LYS 107 H LYS 107 -0.095 -12.295 6.095 731 HA LYS 107 HA LYS 107 0.073 -13.758 3.578 732 HB2 LYS 107 1HB LYS 107 -2.393 -12.776 5.021 733 HB3 LYS 107 2HB LYS 107 -2.330 -13.951 3.714 734 HG2 LYS 107 1HG LYS 107 -0.662 -14.765 5.922 735 HG3 LYS 107 2HG LYS 107 -2.324 -14.473 6.441 736 HD2 LYS 107 1HD LYS 107 -1.525 -16.216 4.111 737 HD3 LYS 107 2HD LYS 107 -1.925 -16.810 5.725 738 HE2 LYS 107 1HE LYS 107 -4.091 -16.767 5.239 739 HE3 LYS 107 2HE LYS 107 -3.994 -15.057 4.826 740 HZ1 LYS 107 3HZ LYS 107 -3.306 -15.678 2.590 741 HZ2 LYS 107 1HZ LYS 107 -4.808 -16.358 2.969 742 HZ3 LYS 107 2HZ LYS 107 -3.416 -17.318 2.990 743 H PHE 108 H PHE 108 -1.865 -10.947 4.604 744 HA PHE 108 HA PHE 108 -1.278 -9.720 1.989 745 HB2 PHE 108 1HB PHE 108 -3.698 -9.013 3.619 746 HB3 PHE 108 2HB PHE 108 -3.444 -8.853 1.884 747 HD1 PHE 108 1HD PHE 108 -2.347 -11.674 1.464 748 HD2 PHE 108 2HD PHE 108 -5.755 -10.184 3.534 749 HE1 PHE 108 1HE PHE 108 -3.501 -13.817 1.099 750 HE2 PHE 108 2HE PHE 108 -6.914 -12.324 3.173 751 HZ PHE 108 HZ PHE 108 -5.787 -14.144 1.955 752 H VAL 109 H VAL 109 -0.855 -7.507 1.902 753 HA VAL 109 HA VAL 109 -0.171 -6.284 4.495 754 HB VAL 109 HB VAL 109 1.078 -5.627 1.827 755 HG11 VAL 109 1HG1 VAL 109 2.676 -4.382 3.060 756 HG12 VAL 109 2HG1 VAL 109 1.091 -3.905 3.672 757 HG13 VAL 109 3HG1 VAL 109 2.093 -5.023 4.596 758 HG21 VAL 109 3HG2 VAL 109 1.636 -7.789 3.733 759 HG22 VAL 109 1HG2 VAL 109 2.060 -7.638 2.027 760 HG23 VAL 109 2HG2 VAL 109 3.045 -6.841 3.255 761 H ARG 110 H ARG 110 -0.838 -4.233 4.941 762 HA ARG 110 HA ARG 110 -2.456 -2.874 2.888 763 HB2 ARG 110 1HB ARG 110 -3.834 -2.027 4.873 764 HB3 ARG 110 2HB ARG 110 -4.068 -3.700 4.382 765 HG2 ARG 110 1HG ARG 110 -1.989 -3.510 6.359 766 HG3 ARG 110 2HG ARG 110 -3.473 -2.748 6.931 767 HD2 ARG 110 1HD ARG 110 -4.484 -4.995 5.848 768 HD3 ARG 110 2HD ARG 110 -2.896 -5.580 6.337 769 HE ARG 110 HE ARG 110 -3.755 -4.327 8.554 770 HH11 ARG 110 1HH1 ARG 110 -5.239 -6.682 6.464 771 HH12 ARG 110 2HH1 ARG 110 -6.191 -7.394 7.725 772 HH21 ARG 110 1HH2 ARG 110 -5.002 -5.256 10.223 773 HH22 ARG 110 2HH2 ARG 110 -6.056 -6.582 9.863 774 H VAL 111 H VAL 111 -2.066 -0.754 2.591 775 HA VAL 111 HA VAL 111 -0.329 0.616 4.537 776 HB VAL 111 HB VAL 111 0.882 1.706 2.774 777 HG11 VAL 111 1HG1 VAL 111 1.322 -0.785 3.471 778 HG12 VAL 111 2HG1 VAL 111 0.862 -1.110 1.799 779 HG13 VAL 111 3HG1 VAL 111 2.225 -0.048 2.149 780 HG21 VAL 111 3HG2 VAL 111 0.479 1.167 0.399 781 HG22 VAL 111 1HG2 VAL 111 -0.938 0.231 0.874 782 HG23 VAL 111 2HG2 VAL 111 -0.897 1.972 1.154 783 H TYR 112 H TYR 112 -0.879 2.668 5.065 784 HA TYR 112 HA TYR 112 -2.799 4.135 3.447 785 HB2 TYR 112 1HB TYR 112 -4.453 4.375 5.105 786 HB3 TYR 112 2HB TYR 112 -4.048 2.662 5.135 787 HD1 TYR 112 2HD TYR 112 -2.431 1.849 6.929 788 HD2 TYR 112 1HD TYR 112 -4.278 5.680 7.046 789 HE1 TYR 112 2HE TYR 112 -1.954 1.999 9.336 790 HE2 TYR 112 1HE TYR 112 -3.804 5.842 9.454 791 HH TYR 112 HH TYR 112 -2.607 3.139 11.275 792 H ALA 113 H ALA 113 -2.958 6.374 4.020 793 HA ALA 113 HA ALA 113 -0.548 7.334 5.397 794 HB1 ALA 113 1HB ALA 113 -1.959 9.423 4.046 795 HB2 ALA 113 2HB ALA 113 -0.346 8.782 3.729 796 HB3 ALA 113 3HB ALA 113 -1.753 8.051 2.958 797 H THR 114 H THR 114 -1.044 9.762 6.205 798 HA THR 114 HA THR 114 -3.412 9.572 7.953 799 HB THR 114 HB THR 114 -1.259 9.263 9.176 800 HG1 THR 114 1HG THR 114 -1.769 11.119 10.679 801 HG21 THR 114 3HG2 THR 114 -0.545 12.077 9.167 802 HG22 THR 114 1HG2 THR 114 -0.376 11.348 7.571 803 HG23 THR 114 2HG2 THR 114 0.476 10.656 8.951 804 H THR 115 H THR 115 -1.564 11.473 5.760 805 HA THR 115 HA THR 115 -2.661 14.018 6.471 806 HB THR 115 HB THR 115 -1.483 13.325 3.786 807 HG1 THR 115 1HG THR 115 -0.266 12.892 6.020 808 HG21 THR 115 3HG2 THR 115 -2.185 15.773 5.241 809 HG22 THR 115 1HG2 THR 115 -1.987 15.502 3.510 810 HG23 THR 115 2HG2 THR 115 -0.574 15.792 4.524 811 H ARG 116 H ARG 116 -4.062 15.305 5.100 812 HA ARG 116 HA ARG 116 -6.281 13.727 4.101 813 HB2 ARG 116 1HB ARG 116 -5.935 16.348 5.228 814 HB3 ARG 116 2HB ARG 116 -6.774 16.475 3.689 815 HG2 ARG 116 1HG ARG 116 -8.558 15.153 4.419 816 HG3 ARG 116 2HG ARG 116 -7.644 14.526 5.792 817 HD2 ARG 116 1HD ARG 116 -7.868 17.425 5.821 818 HD3 ARG 116 2HD ARG 116 -9.439 16.624 5.839 819 HE ARG 116 HE ARG 116 -7.762 15.391 7.721 820 HH11 ARG 116 1HH1 ARG 116 -9.440 18.392 7.186 821 HH12 ARG 116 2HH1 ARG 116 -9.632 18.737 8.874 822 HH21 ARG 116 1HH2 ARG 116 -8.006 15.832 9.945 823 HH22 ARG 116 2HH2 ARG 116 -8.814 17.281 10.442 824 H ALA 117 H ALA 117 -3.494 14.553 2.755 825 HA ALA 117 HA ALA 117 -2.728 15.033 0.654 826 HB1 ALA 117 1HB ALA 117 -3.485 13.569 -0.951 827 HB2 ALA 117 2HB ALA 117 -4.048 12.785 0.526 828 HB3 ALA 117 3HB ALA 117 -5.170 13.727 -0.455 829 H THR 118 H THR 118 -3.037 17.314 0.815 830 HA THR 118 HA THR 118 -5.414 18.646 0.115 831 HB THR 118 HB THR 118 -3.786 20.591 -0.410 832 HG1 THR 118 1HG THR 118 -1.916 19.098 1.060 833 HG21 THR 118 3HG2 THR 118 -3.640 19.395 2.354 834 HG22 THR 118 1HG2 THR 118 -5.068 20.212 1.722 835 HG23 THR 118 2HG2 THR 118 -3.555 21.099 1.911 836 H ALA 119 H ALA 119 -2.437 18.851 -1.812 837 HA ALA 119 HA ALA 119 -3.551 19.643 -4.181 838 HB1 ALA 119 1HB ALA 119 -1.565 18.562 -5.284 839 HB2 ALA 119 2HB ALA 119 -1.189 19.657 -3.952 840 HB3 ALA 119 3HB ALA 119 -1.137 17.912 -3.701 841 H TYR 120 H TYR 120 -2.257 16.364 -4.135 842 HA TYR 120 HA TYR 120 -4.582 15.493 -5.691 843 HB2 TYR 120 1HB TYR 120 -1.760 14.925 -5.790 844 HB3 TYR 120 2HB TYR 120 -2.665 13.428 -5.593 845 HD1 TYR 120 2HD TYR 120 -4.840 13.321 -7.181 846 HD2 TYR 120 1HD TYR 120 -1.331 15.600 -7.948 847 HE1 TYR 120 2HE TYR 120 -5.372 13.321 -9.584 848 HE2 TYR 120 1HE TYR 120 -1.853 15.608 -10.351 849 HH TYR 120 HH TYR 120 -4.851 14.197 -11.584 850 H GLY 121 H GLY 121 -4.656 12.836 -5.317 851 HA2 GLY 121 2HA GLY 121 -5.521 12.637 -2.516 852 HA3 GLY 121 3HA GLY 121 -6.079 11.621 -3.837 853 H TYR 122 H TYR 122 -4.637 9.992 -4.664 854 HA TYR 122 HA TYR 122 -2.324 9.345 -3.008 855 HB2 TYR 122 1HB TYR 122 -4.218 8.209 -1.920 856 HB3 TYR 122 2HB TYR 122 -4.611 7.410 -3.439 857 HD1 TYR 122 2HD TYR 122 -1.164 7.930 -2.239 858 HD2 TYR 122 1HD TYR 122 -4.377 5.168 -2.638 859 HE1 TYR 122 2HE TYR 122 0.356 6.086 -1.658 860 HE2 TYR 122 1HE TYR 122 -2.865 3.317 -2.056 861 HH TYR 122 HH TYR 122 0.476 3.609 -2.039 862 H SER 123 H SER 123 -0.708 8.427 -4.137 863 HA SER 123 HA SER 123 -1.289 7.207 -6.735 864 HB2 SER 123 1HB SER 123 0.205 9.716 -6.274 865 HB3 SER 123 2HB SER 123 0.981 8.562 -7.359 866 HG SER 123 HG SER 123 -1.243 10.108 -7.745 867 H LEU 124 H LEU 124 -0.485 5.225 -6.575 868 HA LEU 124 HA LEU 124 2.068 4.846 -5.158 869 HB2 LEU 124 1HB LEU 124 1.347 2.460 -4.969 870 HB3 LEU 124 2HB LEU 124 0.362 3.614 -4.071 871 HG LEU 124 HG LEU 124 -0.910 3.325 -6.545 872 HD11 LEU 124 1HD1 LEU 124 -1.268 0.708 -6.181 873 HD12 LEU 124 2HD1 LEU 124 0.416 0.829 -5.673 874 HD13 LEU 124 3HD1 LEU 124 -0.059 1.362 -7.286 875 HD21 LEU 124 3HD2 LEU 124 -2.307 3.620 -4.764 876 HD22 LEU 124 1HD2 LEU 124 -1.400 2.521 -3.726 877 HD23 LEU 124 2HD2 LEU 124 -2.464 1.877 -4.976 878 H TRP 125 H TRP 125 2.711 5.719 -7.455 879 HA TRP 125 HA TRP 125 2.645 3.874 -9.621 880 HB2 TRP 125 1HB TRP 125 4.220 6.382 -9.073 881 HB3 TRP 125 2HB TRP 125 4.505 5.412 -10.516 882 HD1 TRP 125 HD TRP 125 0.917 5.701 -9.342 883 HE1 TRP 125 1HE TRP 125 -0.394 7.185 -10.986 884 HE3 TRP 125 3HE TRP 125 4.819 7.458 -12.138 885 HZ2 TRP 125 2HZ TRP 125 0.154 8.876 -13.179 886 HZ3 TRP 125 3HZ TRP 125 4.340 9.006 -13.991 887 HH2 TRP 125 HH TRP 125 2.055 9.698 -14.499 888 H GLU 126 H GLU 126 4.407 3.928 -6.766 889 HA GLU 126 HA GLU 126 6.208 1.874 -7.795 890 HB2 GLU 126 1HB GLU 126 7.217 4.337 -7.634 891 HB3 GLU 126 2HB GLU 126 7.419 3.873 -5.951 892 HG2 GLU 126 1HG GLU 126 8.853 2.094 -6.502 893 HG3 GLU 126 2HG GLU 126 8.418 2.169 -8.208 894 H PHE 127 H PHE 127 4.396 0.800 -6.525 895 HA PHE 127 HA PHE 127 5.149 0.669 -3.678 896 HB2 PHE 127 1HB PHE 127 2.918 1.595 -3.893 897 HB3 PHE 127 2HB PHE 127 2.431 0.266 -4.940 898 HD1 PHE 127 1HD PHE 127 4.507 -0.198 -1.949 899 HD2 PHE 127 2HD PHE 127 0.589 -0.439 -3.595 900 HE1 PHE 127 1HE PHE 127 3.761 -1.472 0.020 901 HE2 PHE 127 2HE PHE 127 -0.163 -1.712 -1.629 902 HZ PHE 127 HZ PHE 127 1.424 -2.230 0.182 903 H GLU 128 H GLU 128 6.366 -1.096 -3.436 904 HA GLU 128 HA GLU 128 5.360 -3.621 -4.570 905 HB2 GLU 128 1HB GLU 128 8.077 -2.425 -4.711 906 HB3 GLU 128 2HB GLU 128 7.980 -4.161 -4.455 907 HG2 GLU 128 1HG GLU 128 7.953 -4.236 -6.691 908 HG3 GLU 128 2HG GLU 128 6.238 -3.880 -6.490 909 H VAL 129 H VAL 129 4.959 -5.118 -3.089 910 HA VAL 129 HA VAL 129 6.548 -5.191 -0.631 911 HB VAL 129 HB VAL 129 4.655 -3.926 0.081 912 HG11 VAL 129 1HG1 VAL 129 3.261 -5.534 -1.847 913 HG12 VAL 129 2HG1 VAL 129 2.425 -5.582 -0.294 914 HG13 VAL 129 3HG1 VAL 129 2.759 -4.034 -1.070 915 HG21 VAL 129 3HG2 VAL 129 3.713 -6.569 1.008 916 HG22 VAL 129 1HG2 VAL 129 5.416 -6.201 1.281 917 HG23 VAL 129 2HG2 VAL 129 4.168 -5.138 1.932 918 H TYR 130 H TYR 130 7.420 -7.156 -0.689 919 HA TYR 130 HA TYR 130 5.822 -9.493 -0.536 920 HB2 TYR 130 1HB TYR 130 6.967 -8.747 -3.178 921 HB3 TYR 130 2HB TYR 130 7.087 -10.437 -2.699 922 HD1 TYR 130 2HD TYR 130 4.480 -10.585 -1.146 923 HD2 TYR 130 1HD TYR 130 5.423 -8.953 -4.961 924 HE1 TYR 130 2HE TYR 130 2.160 -10.958 -1.873 925 HE2 TYR 130 1HE TYR 130 3.106 -9.321 -5.697 926 HH TYR 130 HH TYR 130 0.593 -9.976 -3.602 927 H GLY 131 H GLY 131 7.147 -11.473 -0.366 928 HA2 GLY 131 2HA GLY 131 9.394 -11.052 1.287 929 HA3 GLY 131 3HA GLY 131 8.890 -12.597 0.618 Start of MODEL 5 1 H ASN 1 H ASN 1 -10.558 -11.382 -14.560 2 HA ASN 1 HA ASN 1 -8.210 -11.753 -13.618 3 HB2 ASN 1 1HB ASN 1 -8.567 -8.832 -12.934 4 HB3 ASN 1 2HB ASN 1 -7.149 -9.837 -12.646 5 HD21 ASN 1 1HD2 ASN 1 -8.598 -7.642 -14.702 6 HD22 ASN 1 2HD2 ASN 1 -7.556 -7.831 -16.066 7 H LEU 2 H LEU 2 -7.890 -11.799 -11.248 8 HA LEU 2 HA LEU 2 -10.188 -11.142 -9.608 9 HB2 LEU 2 1HB LEU 2 -9.761 -13.784 -10.659 10 HB3 LEU 2 2HB LEU 2 -9.632 -13.799 -8.902 11 HG LEU 2 HG LEU 2 -11.967 -12.332 -9.811 12 HD11 LEU 2 1HD1 LEU 2 -13.162 -13.952 -10.918 13 HD12 LEU 2 2HD1 LEU 2 -12.147 -15.265 -10.324 14 HD13 LEU 2 3HD1 LEU 2 -11.552 -14.194 -11.593 15 HD21 LEU 2 3HD2 LEU 2 -12.997 -14.147 -8.280 16 HD22 LEU 2 1HD2 LEU 2 -11.940 -12.925 -7.572 17 HD23 LEU 2 2HD2 LEU 2 -11.320 -14.543 -7.901 18 H ALA 3 H ALA 3 -7.293 -13.229 -9.518 19 HA ALA 3 HA ALA 3 -6.333 -11.659 -7.225 20 HB1 ALA 3 1HB ALA 3 -6.961 -14.528 -7.312 21 HB2 ALA 3 2HB ALA 3 -5.406 -14.119 -6.586 22 HB3 ALA 3 3HB ALA 3 -6.892 -13.418 -5.943 23 H LEU 4 H LEU 4 -4.057 -11.634 -6.942 24 HA LEU 4 HA LEU 4 -2.271 -12.999 -8.672 25 HB2 LEU 4 1HB LEU 4 -3.331 -11.292 -10.203 26 HB3 LEU 4 2HB LEU 4 -2.548 -10.053 -9.225 27 HG LEU 4 HG LEU 4 -0.466 -11.731 -9.911 28 HD11 LEU 4 1HD1 LEU 4 -2.569 -11.805 -11.989 29 HD12 LEU 4 2HD1 LEU 4 -1.315 -12.981 -11.597 30 HD13 LEU 4 3HD1 LEU 4 -0.913 -11.543 -12.534 31 HD21 LEU 4 3HD2 LEU 4 -1.054 -9.458 -11.709 32 HD22 LEU 4 1HD2 LEU 4 0.409 -9.842 -10.802 33 HD23 LEU 4 2HD2 LEU 4 -0.968 -9.106 -9.982 34 H ASN 5 H ASN 5 -0.068 -12.562 -8.198 35 HA ASN 5 HA ASN 5 0.402 -11.796 -5.509 36 HB2 ASN 5 1HB ASN 5 2.589 -11.986 -7.560 37 HB3 ASN 5 2HB ASN 5 2.623 -12.444 -5.860 38 HD21 ASN 5 1HD2 ASN 5 1.710 -13.379 -9.067 39 HD22 ASN 5 2HD2 ASN 5 1.373 -15.036 -8.710 40 H LYS 6 H LYS 6 0.040 -9.981 -8.318 41 HA LYS 6 HA LYS 6 1.536 -7.719 -7.166 42 HB2 LYS 6 1HB LYS 6 1.840 -8.768 -9.652 43 HB3 LYS 6 2HB LYS 6 0.626 -7.537 -9.970 44 HG2 LYS 6 1HG LYS 6 2.808 -6.623 -10.364 45 HG3 LYS 6 2HG LYS 6 2.109 -5.856 -8.936 46 HD2 LYS 6 1HD LYS 6 3.496 -8.112 -8.007 47 HD3 LYS 6 2HD LYS 6 4.554 -7.347 -9.194 48 HE2 LYS 6 1HE LYS 6 3.913 -5.157 -7.932 49 HE3 LYS 6 2HE LYS 6 3.474 -6.258 -6.627 50 HZ1 LYS 6 3HZ LYS 6 6.112 -6.461 -7.928 51 HZ2 LYS 6 1HZ LYS 6 5.646 -6.968 -6.383 52 HZ3 LYS 6 2HZ LYS 6 5.847 -5.320 -6.708 53 H ALA 7 H ALA 7 -1.549 -8.936 -7.851 54 HA ALA 7 HA ALA 7 -3.123 -6.828 -8.553 55 HB1 ALA 7 1HB ALA 7 -3.520 -9.234 -6.908 56 HB2 ALA 7 2HB ALA 7 -4.702 -7.947 -6.668 57 HB3 ALA 7 3HB ALA 7 -4.451 -8.625 -8.277 58 H THR 8 H THR 8 -4.358 -5.266 -7.382 59 HA THR 8 HA THR 8 -3.446 -4.606 -4.687 60 HB THR 8 HB THR 8 -2.523 -2.589 -5.139 61 HG1 THR 8 1HG THR 8 -4.381 -2.419 -7.286 62 HG21 THR 8 3HG2 THR 8 -2.314 -3.660 -7.950 63 HG22 THR 8 1HG2 THR 8 -1.358 -4.273 -6.603 64 HG23 THR 8 2HG2 THR 8 -1.184 -2.594 -7.115 65 H ALA 9 H ALA 9 -4.829 -3.085 -3.587 66 HA ALA 9 HA ALA 9 -7.370 -2.436 -4.848 67 HB1 ALA 9 1HB ALA 9 -7.144 -4.255 -2.460 68 HB2 ALA 9 2HB ALA 9 -8.633 -3.426 -2.915 69 HB3 ALA 9 3HB ALA 9 -7.904 -4.596 -4.015 70 H THR 10 H THR 10 -8.337 -0.644 -3.998 71 HA THR 10 HA THR 10 -7.366 0.446 -1.470 72 HB THR 10 HB THR 10 -6.373 2.308 -2.267 73 HG1 THR 10 1HG THR 10 -8.251 2.265 -4.412 74 HG21 THR 10 3HG2 THR 10 -5.349 0.391 -3.540 75 HG22 THR 10 1HG2 THR 10 -5.139 1.977 -4.280 76 HG23 THR 10 2HG2 THR 10 -6.352 0.863 -4.913 77 H SER 11 H SER 11 -8.582 2.635 -1.070 78 HA SER 11 HA SER 11 -11.399 2.012 -1.285 79 HB2 SER 11 1HB SER 11 -10.945 2.810 0.840 80 HB3 SER 11 2HB SER 11 -9.764 3.984 0.260 81 HG SER 11 HG SER 11 -12.408 4.298 0.704 82 H SER 12 H SER 12 -9.178 4.519 -2.409 83 HA SER 12 HA SER 12 -11.326 5.837 -3.878 84 HB2 SER 12 1HB SER 12 -8.733 6.628 -2.828 85 HB3 SER 12 2HB SER 12 -8.929 7.116 -4.512 86 HG SER 12 HG SER 12 -10.083 8.682 -3.737 87 H ILE 13 H ILE 13 -11.047 6.367 -6.157 88 HA ILE 13 HA ILE 13 -9.124 5.209 -7.824 89 HB ILE 13 HB ILE 13 -10.580 3.181 -6.896 90 HG12 ILE 13 1HG1 ILE 13 -8.690 2.919 -8.385 91 HG13 ILE 13 2HG1 ILE 13 -10.036 1.968 -9.004 92 HG21 ILE 13 1HG2 ILE 13 -12.686 4.220 -7.730 93 HG22 ILE 13 2HG2 ILE 13 -12.095 3.982 -9.373 94 HG23 ILE 13 3HG2 ILE 13 -12.399 2.590 -8.335 95 HD11 ILE 13 3HD1 ILE 13 -8.755 4.398 -10.114 96 HD12 ILE 13 1HD1 ILE 13 -9.323 2.940 -10.927 97 HD13 ILE 13 2HD1 ILE 13 -10.480 4.161 -10.398 98 H GLU 14 H GLU 14 -9.216 6.236 -9.721 99 HA GLU 14 HA GLU 14 -11.301 8.101 -10.249 100 HB2 GLU 14 1HB GLU 14 -8.813 7.237 -11.664 101 HB3 GLU 14 2HB GLU 14 -10.010 8.175 -12.546 102 HG2 GLU 14 1HG GLU 14 -9.825 9.694 -10.365 103 HG3 GLU 14 2HG GLU 14 -8.216 8.977 -10.341 104 H THR 15 H THR 15 -10.197 5.233 -12.063 105 HA THR 15 HA THR 15 -12.324 5.220 -13.898 106 HB THR 15 HB THR 15 -11.641 2.990 -14.500 107 HG1 THR 15 1HG THR 15 -11.139 1.746 -12.860 108 HG21 THR 15 3HG2 THR 15 -9.608 3.558 -15.326 109 HG22 THR 15 1HG2 THR 15 -8.986 4.052 -13.753 110 HG23 THR 15 2HG2 THR 15 -10.028 5.139 -14.670 111 H ALA 16 H ALA 16 -13.408 2.704 -13.894 112 HA ALA 16 HA ALA 16 -15.368 2.948 -11.771 113 HB1 ALA 16 1HB ALA 16 -15.782 2.429 -14.294 114 HB2 ALA 16 2HB ALA 16 -15.433 0.768 -13.809 115 HB3 ALA 16 3HB ALA 16 -16.765 1.645 -13.056 116 H GLY 17 H GLY 17 -13.013 2.297 -10.613 117 HA2 GLY 17 2HA GLY 17 -12.045 0.795 -9.172 118 HA3 GLY 17 3HA GLY 17 -13.614 0.002 -9.134 119 H HIS 18 H HIS 18 -10.455 0.060 -10.614 120 HA HIS 18 HA HIS 18 -10.258 -2.671 -10.977 121 HB2 HIS 18 1HB HIS 18 -11.962 -1.517 -12.930 122 HB3 HIS 18 2HB HIS 18 -10.462 -1.957 -13.743 123 HD1 HIS 18 1HD HIS 18 -13.597 -3.352 -12.565 124 HD2 HIS 18 2HD HIS 18 -9.778 -4.789 -13.346 125 HE1 HIS 18 1HE HIS 18 -13.843 -5.848 -12.755 126 H GLU 19 H GLU 19 -9.380 0.538 -11.948 127 HA GLU 19 HA GLU 19 -7.073 0.054 -13.427 128 HB2 GLU 19 1HB GLU 19 -8.370 2.288 -12.552 129 HB3 GLU 19 2HB GLU 19 -6.917 2.329 -11.564 130 HG2 GLU 19 1HG GLU 19 -5.862 1.811 -14.001 131 HG3 GLU 19 2HG GLU 19 -7.262 2.788 -14.439 132 H GLY 20 H GLY 20 -7.674 -0.314 -10.044 133 HA2 GLY 20 2HA GLY 20 -5.052 -0.104 -9.046 134 HA3 GLY 20 3HA GLY 20 -6.353 -1.024 -8.306 135 H ASP 21 H ASP 21 -6.697 -2.717 -10.688 136 HA ASP 21 HA ASP 21 -4.742 -4.703 -10.002 137 HB2 ASP 21 1HB ASP 21 -6.551 -4.998 -12.366 138 HB3 ASP 21 2HB ASP 21 -6.051 -6.202 -11.181 139 H LYS 22 H LYS 22 -4.608 -2.075 -11.978 140 HA LYS 22 HA LYS 22 -3.382 -3.064 -14.314 141 HB2 LYS 22 1HB LYS 22 -2.890 -0.839 -14.838 142 HB3 LYS 22 2HB LYS 22 -4.331 -0.716 -13.836 143 HG2 LYS 22 1HG LYS 22 -2.781 -0.302 -11.884 144 HG3 LYS 22 2HG LYS 22 -1.487 -0.128 -13.071 145 HD2 LYS 22 1HD LYS 22 -4.018 1.511 -12.949 146 HD3 LYS 22 2HD LYS 22 -2.409 2.047 -12.458 147 HE2 LYS 22 1HE LYS 22 -2.434 2.901 -14.565 148 HE3 LYS 22 2HE LYS 22 -1.826 1.288 -14.937 149 HZ1 LYS 22 3HZ LYS 22 -3.514 1.256 -16.384 150 HZ2 LYS 22 1HZ LYS 22 -4.357 2.504 -15.612 151 HZ3 LYS 22 2HZ LYS 22 -4.482 0.919 -15.037 152 H ALA 23 H ALA 23 -2.277 -2.941 -11.127 153 HA ALA 23 HA ALA 23 0.504 -2.541 -11.613 154 HB1 ALA 23 1HB ALA 23 0.812 -2.865 -9.356 155 HB2 ALA 23 2HB ALA 23 -0.871 -2.336 -9.402 156 HB3 ALA 23 3HB ALA 23 -0.490 -4.050 -9.238 157 H VAL 24 H VAL 24 -1.531 -5.059 -12.383 158 HA VAL 24 HA VAL 24 -0.218 -7.395 -11.770 159 HB VAL 24 HB VAL 24 -1.744 -6.628 -14.250 160 HG11 VAL 24 1HG1 VAL 24 -0.338 -9.183 -13.596 161 HG12 VAL 24 2HG1 VAL 24 -1.842 -9.215 -14.518 162 HG13 VAL 24 3HG1 VAL 24 -0.448 -8.325 -15.132 163 HG21 VAL 24 3HG2 VAL 24 -2.529 -7.274 -11.660 164 HG22 VAL 24 1HG2 VAL 24 -3.554 -7.216 -13.094 165 HG23 VAL 24 2HG2 VAL 24 -2.821 -8.740 -12.596 166 H ASP 25 H ASP 25 0.507 -5.099 -14.350 167 HA ASP 25 HA ASP 25 2.345 -6.522 -15.829 168 HB2 ASP 25 1HB ASP 25 1.484 -3.893 -15.742 169 HB3 ASP 25 2HB ASP 25 3.201 -3.766 -15.371 170 H GLY 26 H GLY 26 2.715 -5.093 -12.665 171 HA2 GLY 26 2HA GLY 26 4.387 -5.279 -11.103 172 HA3 GLY 26 3HA GLY 26 4.970 -6.656 -12.027 173 H ASN 27 H ASN 27 4.695 -3.577 -13.585 174 HA ASN 27 HA ASN 27 7.535 -3.008 -13.179 175 HB2 ASN 27 1HB ASN 27 6.698 -4.342 -15.440 176 HB3 ASN 27 2HB ASN 27 6.712 -2.662 -15.971 177 HD21 ASN 27 1HD2 ASN 27 8.409 -4.502 -17.068 178 HD22 ASN 27 2HD2 ASN 27 10.033 -4.152 -16.592 179 H ALA 28 H ALA 28 7.852 -0.956 -14.953 180 HA ALA 28 HA ALA 28 6.474 1.167 -13.646 181 HB1 ALA 28 1HB ALA 28 7.646 2.279 -15.884 182 HB2 ALA 28 2HB ALA 28 8.385 2.118 -14.291 183 HB3 ALA 28 3HB ALA 28 8.671 0.891 -15.524 184 H ALA 29 H ALA 29 5.566 -0.875 -16.127 185 HA ALA 29 HA ALA 29 4.180 0.900 -17.846 186 HB1 ALA 29 1HB ALA 29 3.314 -1.931 -17.439 187 HB2 ALA 29 2HB ALA 29 3.373 -0.979 -18.923 188 HB3 ALA 29 3HB ALA 29 4.866 -1.578 -18.201 189 H THR 30 H THR 30 3.569 -0.072 -14.677 190 HA THR 30 HA THR 30 0.685 0.442 -14.920 191 HB THR 30 HB THR 30 0.299 -0.881 -13.111 192 HG1 THR 30 1HG THR 30 1.320 0.164 -11.489 193 HG21 THR 30 3HG2 THR 30 1.495 -2.853 -13.292 194 HG22 THR 30 1HG2 THR 30 3.035 -2.021 -13.508 195 HG23 THR 30 2HG2 THR 30 1.868 -2.071 -14.829 196 H ARG 31 H ARG 31 -0.218 2.221 -14.070 197 HA ARG 31 HA ARG 31 1.334 3.837 -12.177 198 HB2 ARG 31 1HB ARG 31 0.215 4.705 -14.820 199 HB3 ARG 31 2HB ARG 31 0.347 5.861 -13.499 200 HG2 ARG 31 1HG ARG 31 2.370 6.239 -14.398 201 HG3 ARG 31 2HG ARG 31 2.825 4.818 -13.455 202 HD2 ARG 31 1HD ARG 31 3.333 3.705 -15.307 203 HD3 ARG 31 2HD ARG 31 1.715 3.980 -15.952 204 HE ARG 31 HE ARG 31 3.406 6.264 -16.243 205 HH11 ARG 31 1HH1 ARG 31 2.590 3.170 -17.615 206 HH12 ARG 31 2HH1 ARG 31 3.102 3.598 -19.214 207 HH21 ARG 31 1HH2 ARG 31 4.084 6.839 -18.344 208 HH22 ARG 31 2HH2 ARG 31 3.953 5.685 -19.627 209 H TRP 32 H TRP 32 0.104 3.765 -10.406 210 HA TRP 32 HA TRP 32 -2.791 3.729 -10.601 211 HB2 TRP 32 1HB TRP 32 -1.980 2.268 -8.943 212 HB3 TRP 32 2HB TRP 32 -0.838 3.458 -8.328 213 HD1 TRP 32 HD TRP 32 -1.702 5.168 -6.520 214 HE1 TRP 32 1HE TRP 32 -3.873 5.331 -5.148 215 HE3 TRP 32 3HE TRP 32 -4.558 1.812 -9.113 216 HZ2 TRP 32 2HZ TRP 32 -6.454 4.188 -5.161 217 HZ3 TRP 32 3HZ TRP 32 -6.867 1.405 -8.368 218 HH2 TRP 32 HH TRP 32 -7.794 2.568 -6.432 219 H ALA 33 H ALA 33 -4.110 5.415 -10.277 220 HA ALA 33 HA ALA 33 -3.067 7.831 -8.992 221 HB1 ALA 33 1HB ALA 33 -3.183 9.145 -10.791 222 HB2 ALA 33 2HB ALA 33 -3.231 7.653 -11.733 223 HB3 ALA 33 3HB ALA 33 -4.732 8.466 -11.291 224 H SER 34 H SER 34 -4.378 7.796 -7.247 225 HA SER 34 HA SER 34 -7.097 6.985 -7.306 226 HB2 SER 34 1HB SER 34 -5.274 8.214 -5.297 227 HB3 SER 34 2HB SER 34 -7.009 8.361 -5.016 228 HG SER 34 HG SER 34 -6.372 6.467 -4.074 229 H ALA 35 H ALA 35 -8.962 8.315 -6.851 230 HA ALA 35 HA ALA 35 -9.244 10.483 -8.587 231 HB1 ALA 35 1HB ALA 35 -11.060 9.008 -7.598 232 HB2 ALA 35 2HB ALA 35 -10.984 10.050 -6.176 233 HB3 ALA 35 3HB ALA 35 -11.426 10.727 -7.743 234 H TYR 36 H TYR 36 -10.452 12.556 -7.392 235 HA TYR 36 HA TYR 36 -8.335 14.146 -6.493 236 HB2 TYR 36 1HB TYR 36 -11.071 14.511 -7.144 237 HB3 TYR 36 2HB TYR 36 -10.820 15.218 -5.552 238 HD1 TYR 36 2HD TYR 36 -8.049 16.217 -5.798 239 HD2 TYR 36 1HD TYR 36 -11.277 16.347 -8.567 240 HE1 TYR 36 2HE TYR 36 -7.068 18.219 -6.838 241 HE2 TYR 36 1HE TYR 36 -10.305 18.348 -9.616 242 HH TYR 36 HH TYR 36 -8.544 20.306 -8.564 243 H GLY 37 H GLY 37 -9.143 15.574 -4.317 244 HA2 GLY 37 2HA GLY 37 -8.115 14.229 -2.159 245 HA3 GLY 37 3HA GLY 37 -9.229 15.582 -2.018 246 H ALA 38 H ALA 38 -8.906 13.092 -0.414 247 HA ALA 38 HA ALA 38 -11.563 12.624 0.232 248 HB1 ALA 38 1HB ALA 38 -12.051 11.519 -1.744 249 HB2 ALA 38 2HB ALA 38 -10.468 10.746 -1.822 250 HB3 ALA 38 3HB ALA 38 -11.662 10.194 -0.648 251 H SER 39 H SER 39 -8.973 12.941 1.445 252 HA SER 39 HA SER 39 -8.038 10.484 2.509 253 HB2 SER 39 1HB SER 39 -6.363 11.874 3.043 254 HB3 SER 39 2HB SER 39 -7.376 13.285 2.739 255 HG SER 39 HG SER 39 -8.121 13.164 4.853 256 HA PRO 40 HA PRO 40 -6.858 10.369 4.727 257 HB2 PRO 40 1HB PRO 40 -7.005 8.045 6.122 258 HB3 PRO 40 2HB PRO 40 -6.975 9.631 6.901 259 HG2 PRO 40 1HG PRO 40 -9.311 7.854 6.310 260 HG3 PRO 40 2HG PRO 40 -8.957 8.787 7.776 261 HD2 PRO 40 1HD PRO 40 -10.716 9.634 5.899 262 HD3 PRO 40 2HD PRO 40 -9.733 10.756 6.861 263 H GLN 41 H GLN 41 -5.655 8.954 3.485 264 HA GLN 41 HA GLN 41 -7.218 7.163 1.756 265 HB2 GLN 41 1HB GLN 41 -4.845 8.885 1.326 266 HB3 GLN 41 2HB GLN 41 -4.856 7.346 0.476 267 HG2 GLN 41 1HG GLN 41 -6.274 8.116 -1.035 268 HG3 GLN 41 2HG GLN 41 -7.402 8.644 0.214 269 HE21 GLN 41 1HE2 GLN 41 -7.962 10.642 -0.300 270 HE22 GLN 41 2HE2 GLN 41 -6.873 11.932 -0.671 271 H TRP 42 H TRP 42 -5.992 5.224 0.944 272 HA TRP 42 HA TRP 42 -3.803 4.156 2.348 273 HB2 TRP 42 1HB TRP 42 -4.890 2.470 3.728 274 HB3 TRP 42 2HB TRP 42 -5.423 4.078 4.214 275 HD1 TRP 42 HD TRP 42 -7.812 4.704 2.455 276 HE1 TRP 42 1HE TRP 42 -9.950 3.271 2.460 277 HE3 TRP 42 3HE TRP 42 -5.874 0.358 4.324 278 HZ2 TRP 42 2HZ TRP 42 -10.714 0.646 3.162 279 HZ3 TRP 42 3HZ TRP 42 -7.375 -1.567 4.633 280 HH2 TRP 42 HH TRP 42 -9.745 -1.423 4.063 281 H ILE 43 H ILE 43 -3.266 2.003 1.673 282 HA ILE 43 HA ILE 43 -4.939 0.817 -0.403 283 HB ILE 43 HB ILE 43 -3.500 2.287 -1.679 284 HG12 ILE 43 1HG1 ILE 43 -2.226 -0.399 -2.046 285 HG13 ILE 43 2HG1 ILE 43 -3.957 -0.224 -2.307 286 HG21 ILE 43 1HG2 ILE 43 -0.975 0.962 -1.039 287 HG22 ILE 43 2HG2 ILE 43 -1.337 2.674 -1.250 288 HG23 ILE 43 3HG2 ILE 43 -1.656 1.891 0.297 289 HD11 ILE 43 3HD1 ILE 43 -2.879 1.879 -3.722 290 HD12 ILE 43 1HD1 ILE 43 -1.733 0.565 -3.984 291 HD13 ILE 43 2HD1 ILE 43 -3.436 0.343 -4.387 292 H TYR 44 H TYR 44 -4.718 -1.375 -0.595 293 HA TYR 44 HA TYR 44 -2.735 -2.653 1.173 294 HB2 TYR 44 1HB TYR 44 -4.706 -4.521 1.001 295 HB3 TYR 44 2HB TYR 44 -4.566 -3.347 2.306 296 HD1 TYR 44 2HD TYR 44 -5.873 -1.166 2.091 297 HD2 TYR 44 1HD TYR 44 -6.599 -4.553 -0.381 298 HE1 TYR 44 2HE TYR 44 -8.096 -0.275 1.530 299 HE2 TYR 44 1HE TYR 44 -8.823 -3.670 -0.948 300 HH TYR 44 HH TYR 44 -10.440 -2.150 -0.225 301 H ILE 45 H ILE 45 -1.848 -4.632 0.489 302 HA ILE 45 HA ILE 45 -2.327 -5.341 -2.325 303 HB ILE 45 HB ILE 45 0.327 -4.892 -0.981 304 HG12 ILE 45 1HG1 ILE 45 -1.043 -3.109 -2.320 305 HG13 ILE 45 2HG1 ILE 45 0.688 -3.265 -2.595 306 HG21 ILE 45 1HG2 ILE 45 0.619 -6.999 -2.005 307 HG22 ILE 45 2HG2 ILE 45 -0.290 -6.515 -3.435 308 HG23 ILE 45 3HG2 ILE 45 1.302 -5.822 -3.127 309 HD11 ILE 45 3HD1 ILE 45 0.318 -4.499 -4.608 310 HD12 ILE 45 1HD1 ILE 45 -1.418 -4.574 -4.296 311 HD13 ILE 45 2HD1 ILE 45 -0.652 -3.027 -4.662 312 H ASN 46 H ASN 46 -2.610 -7.452 -2.684 313 HA ASN 46 HA ASN 46 -2.174 -9.291 -0.443 314 HB2 ASN 46 1HB ASN 46 -3.626 -10.172 -2.886 315 HB3 ASN 46 2HB ASN 46 -3.953 -10.529 -1.192 316 HD21 ASN 46 1HD2 ASN 46 -4.617 -8.526 0.097 317 HD22 ASN 46 2HD2 ASN 46 -5.789 -7.505 -0.657 318 H LEU 47 H LEU 47 -0.378 -10.456 -0.476 319 HA LEU 47 HA LEU 47 1.157 -10.797 -2.885 320 HB2 LEU 47 1HB LEU 47 1.986 -10.497 -0.450 321 HB3 LEU 47 2HB LEU 47 1.695 -12.230 -0.312 322 HG LEU 47 HG LEU 47 4.053 -11.682 -0.769 323 HD11 LEU 47 1HD1 LEU 47 4.402 -13.373 -2.368 324 HD12 LEU 47 2HD1 LEU 47 2.854 -13.065 -3.153 325 HD13 LEU 47 3HD1 LEU 47 2.900 -13.801 -1.551 326 HD21 LEU 47 3HD2 LEU 47 4.739 -10.767 -2.875 327 HD22 LEU 47 1HD2 LEU 47 3.579 -9.659 -2.140 328 HD23 LEU 47 2HD2 LEU 47 3.073 -10.722 -3.454 329 H GLY 48 H GLY 48 0.007 -13.204 -0.509 330 HA2 GLY 48 2HA GLY 48 -1.568 -14.856 -1.828 331 HA3 GLY 48 3HA GLY 48 -0.051 -15.204 -2.643 332 H SER 49 H SER 49 -1.807 -15.416 0.377 333 HA SER 49 HA SER 49 -1.615 -16.828 2.151 334 HB2 SER 49 1HB SER 49 0.406 -18.378 0.526 335 HB3 SER 49 2HB SER 49 -0.610 -18.975 1.838 336 HG SER 49 HG SER 49 -2.425 -18.413 0.419 337 H THR 50 H THR 50 0.446 -18.133 3.339 338 HA THR 50 HA THR 50 1.861 -16.086 4.613 339 HB THR 50 HB THR 50 3.429 -18.206 5.179 340 HG1 THR 50 1HG THR 50 2.583 -19.879 4.177 341 HG21 THR 50 3HG2 THR 50 0.942 -17.097 6.275 342 HG22 THR 50 1HG2 THR 50 2.473 -17.453 7.075 343 HG23 THR 50 2HG2 THR 50 1.301 -18.742 6.799 344 H GLN 51 H GLN 51 3.563 -14.933 4.000 345 HA GLN 51 HA GLN 51 5.597 -16.149 2.290 346 HB2 GLN 51 1HB GLN 51 3.677 -14.305 1.328 347 HB3 GLN 51 2HB GLN 51 5.204 -13.441 1.436 348 HG2 GLN 51 1HG GLN 51 4.568 -15.902 -0.156 349 HG3 GLN 51 2HG GLN 51 5.107 -14.327 -0.736 350 HE21 GLN 51 1HE2 GLN 51 6.051 -17.418 -0.091 351 HE22 GLN 51 2HE2 GLN 51 7.756 -17.174 0.039 352 H SER 52 H SER 52 7.654 -15.336 2.572 353 HA SER 52 HA SER 52 8.092 -13.913 5.038 354 HB2 SER 52 1HB SER 52 9.496 -15.857 3.922 355 HB3 SER 52 2HB SER 52 10.316 -14.511 3.128 356 HG SER 52 HG SER 52 10.001 -14.874 5.928 357 H ILE 53 H ILE 53 8.558 -11.819 5.300 358 HA ILE 53 HA ILE 53 9.269 -10.227 2.930 359 HB ILE 53 HB ILE 53 7.597 -8.907 4.989 360 HG12 ILE 53 1HG1 ILE 53 6.487 -10.879 2.982 361 HG13 ILE 53 2HG1 ILE 53 6.382 -10.992 4.735 362 HG21 ILE 53 1HG2 ILE 53 7.152 -8.725 2.056 363 HG22 ILE 53 2HG2 ILE 53 7.062 -7.473 3.294 364 HG23 ILE 53 3HG2 ILE 53 8.632 -8.036 2.723 365 HD11 ILE 53 3HD1 ILE 53 5.261 -8.531 4.141 366 HD12 ILE 53 1HD1 ILE 53 4.679 -9.604 2.868 367 HD13 ILE 53 2HD1 ILE 53 4.404 -10.014 4.561 368 H SER 54 H SER 54 10.520 -8.363 3.328 369 HA SER 54 HA SER 54 11.686 -8.191 6.026 370 HB2 SER 54 1HB SER 54 13.866 -7.601 4.839 371 HB3 SER 54 2HB SER 54 13.361 -9.288 4.744 372 HG SER 54 HG SER 54 13.612 -8.970 2.676 373 H ARG 55 H ARG 55 12.202 -6.392 3.004 374 HA ARG 55 HA ARG 55 11.274 -3.964 4.391 375 HB2 ARG 55 1HB ARG 55 13.417 -3.954 2.277 376 HB3 ARG 55 2HB ARG 55 13.007 -2.685 3.425 377 HG2 ARG 55 1HG ARG 55 14.855 -3.462 4.457 378 HG3 ARG 55 2HG ARG 55 13.697 -4.599 5.150 379 HD2 ARG 55 1HD ARG 55 14.246 -6.199 3.349 380 HD3 ARG 55 2HD ARG 55 15.459 -5.069 2.748 381 HE ARG 55 HE ARG 55 15.720 -6.846 4.965 382 HH11 ARG 55 1HH1 ARG 55 16.726 -3.761 3.705 383 HH12 ARG 55 2HH1 ARG 55 18.212 -3.735 4.594 384 HH21 ARG 55 1HH2 ARG 55 17.674 -6.824 6.142 385 HH22 ARG 55 2HH2 ARG 55 18.751 -5.479 5.980 386 H VAL 56 H VAL 56 10.201 -2.404 3.139 387 HA VAL 56 HA VAL 56 9.484 -3.179 0.401 388 HB VAL 56 HB VAL 56 7.397 -2.165 2.317 389 HG11 VAL 56 1HG1 VAL 56 7.185 -2.039 -0.238 390 HG12 VAL 56 2HG1 VAL 56 6.987 -3.792 -0.170 391 HG13 VAL 56 3HG1 VAL 56 5.845 -2.740 0.670 392 HG21 VAL 56 3HG2 VAL 56 8.232 -4.999 1.767 393 HG22 VAL 56 1HG2 VAL 56 8.009 -4.197 3.323 394 HG23 VAL 56 2HG2 VAL 56 6.610 -4.590 2.324 395 H LYS 57 H LYS 57 9.490 -1.528 -0.997 396 HA LYS 57 HA LYS 57 9.677 1.198 0.106 397 HB2 LYS 57 1HB LYS 57 10.723 0.303 -2.577 398 HB3 LYS 57 2HB LYS 57 11.075 1.802 -1.729 399 HG2 LYS 57 1HG LYS 57 11.989 0.091 0.092 400 HG3 LYS 57 2HG LYS 57 12.204 -0.904 -1.350 401 HD2 LYS 57 1HD LYS 57 13.442 0.983 -2.394 402 HD3 LYS 57 2HD LYS 57 13.323 1.855 -0.864 403 HE2 LYS 57 1HE LYS 57 14.385 -0.318 0.121 404 HE3 LYS 57 2HE LYS 57 14.901 -0.590 -1.542 405 HZ1 LYS 57 3HZ LYS 57 15.960 1.606 -1.502 406 HZ2 LYS 57 1HZ LYS 57 16.606 0.570 -0.330 407 HZ3 LYS 57 2HZ LYS 57 15.523 1.789 0.122 408 H LEU 58 H LEU 58 8.055 2.527 -0.339 409 HA LEU 58 HA LEU 58 6.546 2.160 -2.828 410 HB2 LEU 58 1HB LEU 58 4.455 2.668 -1.558 411 HB3 LEU 58 2HB LEU 58 5.174 1.097 -1.217 412 HG LEU 58 HG LEU 58 6.176 2.957 0.687 413 HD11 LEU 58 1HD1 LEU 58 3.185 2.873 0.785 414 HD12 LEU 58 2HD1 LEU 58 4.029 4.168 -0.061 415 HD13 LEU 58 3HD1 LEU 58 4.302 3.918 1.663 416 HD21 LEU 58 3HD2 LEU 58 4.669 0.425 0.595 417 HD22 LEU 58 1HD2 LEU 58 4.496 1.373 2.073 418 HD23 LEU 58 2HD2 LEU 58 6.097 0.867 1.531 419 H ASN 59 H ASN 59 6.263 3.996 -3.918 420 HA ASN 59 HA ASN 59 7.133 6.488 -2.706 421 HB2 ASN 59 1HB ASN 59 7.916 5.862 -4.968 422 HB3 ASN 59 2HB ASN 59 6.252 5.919 -5.544 423 HD21 ASN 59 1HD2 ASN 59 6.924 7.499 -7.060 424 HD22 ASN 59 2HD2 ASN 59 7.143 9.144 -6.581 425 H TRP 60 H TRP 60 5.882 8.357 -2.557 426 HA TRP 60 HA TRP 60 2.996 7.855 -2.451 427 HB2 TRP 60 1HB TRP 60 4.638 8.981 -0.595 428 HB3 TRP 60 2HB TRP 60 4.037 10.417 -1.422 429 HD1 TRP 60 HD TRP 60 1.470 11.030 -1.118 430 HE1 TRP 60 1HE TRP 60 -0.323 10.229 0.547 431 HE3 TRP 60 3HE TRP 60 3.854 6.897 0.719 432 HZ2 TRP 60 2HZ TRP 60 -0.679 8.125 2.393 433 HZ3 TRP 60 3HZ TRP 60 2.719 5.545 2.433 434 HH2 TRP 60 HH TRP 60 0.500 6.147 3.252 435 H GLU 61 H GLU 61 5.205 9.109 -4.551 436 HA GLU 61 HA GLU 61 5.020 10.336 -6.459 437 HB2 GLU 61 1HB GLU 61 2.539 9.209 -6.154 438 HB3 GLU 61 2HB GLU 61 2.151 10.921 -6.240 439 HG2 GLU 61 1HG GLU 61 2.026 10.194 -8.443 440 HG3 GLU 61 2HG GLU 61 3.606 10.968 -8.334 441 H ASP 62 H ASP 62 3.516 12.518 -7.161 442 HA ASP 62 HA ASP 62 4.767 14.629 -5.916 443 HB2 ASP 62 1HB ASP 62 2.811 14.307 -7.931 444 HB3 ASP 62 2HB ASP 62 2.171 15.491 -6.795 445 H ALA 63 H ALA 63 1.489 13.404 -5.275 446 HA ALA 63 HA ALA 63 0.673 15.186 -3.347 447 HB1 ALA 63 1HB ALA 63 -1.007 13.721 -2.867 448 HB2 ALA 63 2HB ALA 63 -0.465 13.048 -4.405 449 HB3 ALA 63 3HB ALA 63 0.058 12.316 -2.888 450 H TYR 64 H TYR 64 1.268 15.668 -1.332 451 HA TYR 64 HA TYR 64 3.388 14.082 -0.096 452 HB2 TYR 64 1HB TYR 64 3.510 16.054 1.489 453 HB3 TYR 64 2HB TYR 64 3.906 16.402 -0.191 454 HD1 TYR 64 2HD TYR 64 0.918 16.392 2.060 455 HD2 TYR 64 1HD TYR 64 3.000 18.308 -1.117 456 HE1 TYR 64 2HE TYR 64 -0.771 18.180 2.041 457 HE2 TYR 64 1HE TYR 64 1.318 20.103 -1.145 458 HH TYR 64 HH TYR 64 -0.392 21.052 0.806 459 H ALA 65 H ALA 65 3.297 13.826 2.310 460 HA ALA 65 HA ALA 65 0.612 13.642 3.427 461 HB1 ALA 65 1HB ALA 65 0.914 11.489 2.327 462 HB2 ALA 65 2HB ALA 65 2.419 11.238 3.213 463 HB3 ALA 65 3HB ALA 65 0.886 11.302 4.082 464 H THR 66 H THR 66 0.568 13.474 5.705 465 HA THR 66 HA THR 66 2.819 14.705 6.992 466 HB THR 66 HB THR 66 0.387 15.150 7.564 467 HG1 THR 66 1HG THR 66 1.676 15.981 9.071 468 HG21 THR 66 3HG2 THR 66 -0.879 13.652 8.763 469 HG22 THR 66 1HG2 THR 66 0.529 12.806 9.403 470 HG23 THR 66 2HG2 THR 66 0.027 12.543 7.733 471 H ALA 67 H ALA 67 1.696 11.482 6.548 472 HA ALA 67 HA ALA 67 4.011 10.275 7.506 473 HB1 ALA 67 1HB ALA 67 3.743 10.473 9.720 474 HB2 ALA 67 2HB ALA 67 2.026 10.855 9.577 475 HB3 ALA 67 3HB ALA 67 2.562 9.176 9.534 476 H TYR 68 H TYR 68 3.711 7.856 7.825 477 HA TYR 68 HA TYR 68 1.326 6.807 6.500 478 HB2 TYR 68 1HB TYR 68 3.116 5.291 5.224 479 HB3 TYR 68 2HB TYR 68 2.537 6.815 4.563 480 HD1 TYR 68 1HD TYR 68 5.305 5.323 6.548 481 HD2 TYR 68 2HD TYR 68 4.039 8.543 4.071 482 HE1 TYR 68 1HE TYR 68 7.617 6.155 6.458 483 HE2 TYR 68 2HE TYR 68 6.349 9.383 3.974 484 HH TYR 68 HH TYR 68 8.900 7.975 5.925 485 H SER 69 H SER 69 1.029 4.523 6.785 486 HA SER 69 HA SER 69 2.708 3.297 8.859 487 HB2 SER 69 1HB SER 69 -0.245 3.786 8.947 488 HB3 SER 69 2HB SER 69 0.408 2.339 9.717 489 HG SER 69 HG SER 69 0.952 5.048 10.302 490 H ILE 70 H ILE 70 3.140 1.185 8.552 491 HA ILE 70 HA ILE 70 1.733 -0.171 6.344 492 HB ILE 70 HB ILE 70 4.608 0.048 6.979 493 HG12 ILE 70 1HG1 ILE 70 3.375 -0.775 4.368 494 HG13 ILE 70 2HG1 ILE 70 3.237 0.890 4.925 495 HG21 ILE 70 1HG2 ILE 70 4.454 -2.240 7.519 496 HG22 ILE 70 2HG2 ILE 70 3.326 -2.556 6.202 497 HG23 ILE 70 3HG2 ILE 70 5.014 -2.189 5.848 498 HD11 ILE 70 3HD1 ILE 70 5.467 -0.475 3.708 499 HD12 ILE 70 1HD1 ILE 70 5.190 1.249 3.944 500 HD13 ILE 70 2HD1 ILE 70 5.922 0.290 5.230 501 H GLN 71 H GLN 71 0.565 -1.861 6.946 502 HA GLN 71 HA GLN 71 1.451 -3.443 9.263 503 HB2 GLN 71 1HB GLN 71 -1.466 -3.083 8.686 504 HB3 GLN 71 2HB GLN 71 -0.677 -3.520 10.196 505 HG2 GLN 71 1HG GLN 71 -1.332 -1.372 10.635 506 HG3 GLN 71 2HG GLN 71 0.313 -1.117 10.054 507 HE21 GLN 71 1HE2 GLN 71 -2.787 -1.686 8.425 508 HE22 GLN 71 2HE2 GLN 71 -2.713 -0.280 7.423 509 H VAL 72 H VAL 72 0.035 -5.566 9.315 510 HA VAL 72 HA VAL 72 -0.349 -6.597 6.598 511 HB VAL 72 HB VAL 72 0.804 -8.738 7.343 512 HG11 VAL 72 1HG1 VAL 72 2.265 -6.172 6.815 513 HG12 VAL 72 2HG1 VAL 72 3.120 -7.710 6.953 514 HG13 VAL 72 3HG1 VAL 72 1.899 -7.487 5.699 515 HG21 VAL 72 3HG2 VAL 72 2.503 -8.515 9.093 516 HG22 VAL 72 1HG2 VAL 72 1.936 -6.879 9.432 517 HG23 VAL 72 2HG2 VAL 72 0.879 -8.258 9.733 518 H SER 73 H SER 73 -1.070 -9.080 6.927 519 HA SER 73 HA SER 73 -3.090 -9.127 9.067 520 HB2 SER 73 1HB SER 73 -3.644 -10.269 6.338 521 HB3 SER 73 2HB SER 73 -4.790 -9.833 7.605 522 HG SER 73 HG SER 73 -4.460 -7.691 7.159 523 H ASN 74 H ASN 74 -2.857 -10.839 10.330 524 HA ASN 74 HA ASN 74 -2.654 -13.480 9.466 525 HB2 ASN 74 1HB ASN 74 -0.208 -13.752 10.469 526 HB3 ASN 74 2HB ASN 74 -0.470 -13.383 8.768 527 HD21 ASN 74 1HD2 ASN 74 -0.510 -11.457 11.749 528 HD22 ASN 74 2HD2 ASN 74 0.618 -10.270 11.196 529 H ASP 75 H ASP 75 -2.809 -14.942 11.162 530 HA ASP 75 HA ASP 75 -2.332 -14.132 13.881 531 HB2 ASP 75 1HB ASP 75 -4.655 -13.209 13.111 532 HB3 ASP 75 2HB ASP 75 -5.175 -14.881 13.293 533 H SER 76 H SER 76 -3.919 -16.460 11.732 534 HA SER 76 HA SER 76 -3.084 -18.618 13.553 535 HB2 SER 76 1HB SER 76 -5.503 -18.534 13.176 536 HB3 SER 76 2HB SER 76 -5.248 -18.621 11.434 537 HG SER 76 HG SER 76 -4.945 -20.699 11.589 538 H GLY 77 H GLY 77 -2.051 -17.087 10.879 539 HA2 GLY 77 2HA GLY 77 -0.105 -17.856 9.717 540 HA3 GLY 77 3HA GLY 77 -0.683 -19.504 9.913 541 H SER 78 H SER 78 -3.240 -19.375 8.988 542 HA SER 78 HA SER 78 -2.886 -18.510 6.192 543 HB2 SER 78 1HB SER 78 -3.013 -21.076 6.880 544 HB3 SER 78 2HB SER 78 -4.746 -20.749 6.859 545 HG SER 78 HG SER 78 -3.025 -20.074 4.712 546 H THR 79 H THR 79 -4.667 -18.132 9.009 547 HA THR 79 HA THR 79 -6.947 -17.006 7.517 548 HB THR 79 HB THR 79 -7.116 -17.800 10.410 549 HG1 THR 79 1HG THR 79 -7.594 -19.462 8.141 550 HG21 THR 79 3HG2 THR 79 -9.258 -17.793 8.296 551 HG22 THR 79 1HG2 THR 79 -8.856 -16.359 9.238 552 HG23 THR 79 2HG2 THR 79 -9.451 -17.808 10.048 553 HA PRO 80 HA PRO 80 -4.755 -13.472 9.542 554 HB2 PRO 80 1HB PRO 80 -5.076 -11.782 7.443 555 HB3 PRO 80 2HB PRO 80 -3.728 -12.919 7.563 556 HG2 PRO 80 1HG PRO 80 -6.282 -13.164 6.019 557 HG3 PRO 80 2HG PRO 80 -4.629 -13.572 5.522 558 HD2 PRO 80 1HD PRO 80 -6.405 -15.441 6.350 559 HD3 PRO 80 2HD PRO 80 -4.658 -15.591 6.632 560 H THR 81 H THR 81 -5.768 -11.950 10.722 561 HA THR 81 HA THR 81 -8.270 -10.783 9.867 562 HB THR 81 HB THR 81 -9.366 -11.398 12.103 563 HG1 THR 81 1HG THR 81 -8.597 -13.457 12.911 564 HG21 THR 81 3HG2 THR 81 -9.100 -13.875 10.494 565 HG22 THR 81 1HG2 THR 81 -9.663 -12.428 9.656 566 HG23 THR 81 2HG2 THR 81 -10.549 -13.039 11.055 567 H ASN 82 H ASN 82 -5.801 -11.149 12.351 568 HA ASN 82 HA ASN 82 -6.483 -8.755 13.753 569 HB2 ASN 82 1HB ASN 82 -5.065 -10.876 14.486 570 HB3 ASN 82 2HB ASN 82 -3.727 -9.897 13.888 571 HD21 ASN 82 1HD2 ASN 82 -2.947 -9.882 16.054 572 HD22 ASN 82 2HD2 ASN 82 -3.613 -8.787 17.213 573 H TRP 83 H TRP 83 -4.825 -6.978 14.031 574 HA TRP 83 HA TRP 83 -3.413 -6.385 11.526 575 HB2 TRP 83 1HB TRP 83 -5.781 -5.079 12.460 576 HB3 TRP 83 2HB TRP 83 -4.442 -3.938 12.539 577 HD1 TRP 83 HD TRP 83 -4.792 -6.613 9.792 578 HE1 TRP 83 1HE TRP 83 -5.042 -5.415 7.526 579 HE3 TRP 83 3HE TRP 83 -5.103 -1.788 11.454 580 HZ2 TRP 83 2HZ TRP 83 -5.333 -2.775 6.572 581 HZ3 TRP 83 3HZ TRP 83 -5.366 0.014 9.800 582 HH2 TRP 83 HH TRP 83 -5.478 -0.471 7.410 583 H THR 84 H THR 84 -1.401 -5.689 11.841 584 HA THR 84 HA THR 84 -0.711 -4.319 14.332 585 HB THR 84 HB THR 84 -0.228 -6.748 14.656 586 HG1 THR 84 1HG THR 84 1.387 -6.083 15.849 587 HG21 THR 84 3HG2 THR 84 1.919 -6.340 12.579 588 HG22 THR 84 1HG2 THR 84 0.391 -7.156 12.252 589 HG23 THR 84 2HG2 THR 84 1.515 -7.829 13.432 590 H THR 85 H THR 85 0.670 -2.677 14.034 591 HA THR 85 HA THR 85 1.504 -2.014 11.372 592 HB THR 85 HB THR 85 2.644 -0.061 12.552 593 HG1 THR 85 1HG THR 85 2.867 -0.632 14.631 594 HG21 THR 85 3HG2 THR 85 0.536 0.318 11.525 595 HG22 THR 85 1HG2 THR 85 0.425 1.000 13.148 596 HG23 THR 85 2HG2 THR 85 -0.317 -0.560 12.794 597 H VAL 86 H VAL 86 3.715 -1.493 10.771 598 HA VAL 86 HA VAL 86 5.693 -3.163 12.183 599 HB VAL 86 HB VAL 86 5.806 -2.592 9.232 600 HG11 VAL 86 1HG1 VAL 86 7.185 -4.461 11.121 601 HG12 VAL 86 2HG1 VAL 86 7.097 -4.824 9.397 602 HG13 VAL 86 3HG1 VAL 86 7.883 -3.344 9.948 603 HG21 VAL 86 3HG2 VAL 86 4.136 -4.551 10.689 604 HG22 VAL 86 1HG2 VAL 86 3.882 -3.785 9.120 605 HG23 VAL 86 2HG2 VAL 86 4.996 -5.144 9.268 606 H TYR 87 H TYR 87 4.876 -0.077 11.024 607 HA TYR 87 HA TYR 87 7.230 1.097 12.111 608 HB2 TYR 87 1HB TYR 87 7.933 0.212 9.791 609 HB3 TYR 87 2HB TYR 87 6.942 1.514 9.144 610 HD1 TYR 87 1HD TYR 87 9.810 0.847 11.416 611 HD2 TYR 87 2HD TYR 87 7.817 3.673 8.936 612 HE1 TYR 87 1HE TYR 87 11.695 2.405 11.686 613 HE2 TYR 87 2HE TYR 87 9.697 5.237 9.199 614 HH TYR 87 HH TYR 87 12.657 4.400 10.235 615 H SER 88 H SER 88 7.256 3.512 11.701 616 HA SER 88 HA SER 88 5.064 4.899 10.668 617 HB2 SER 88 1HB SER 88 4.133 5.605 13.004 618 HB3 SER 88 2HB SER 88 3.587 4.092 12.281 619 HG SER 88 HG SER 88 4.187 3.387 14.200 620 H THR 89 H THR 89 5.617 6.983 10.476 621 HA THR 89 HA THR 89 7.970 7.905 11.965 622 HB THR 89 HB THR 89 7.604 9.843 10.119 623 HG1 THR 89 1HG THR 89 6.495 9.149 8.445 624 HG21 THR 89 3HG2 THR 89 9.486 9.005 9.090 625 HG22 THR 89 1HG2 THR 89 8.932 7.333 9.195 626 HG23 THR 89 2HG2 THR 89 9.548 8.151 10.632 627 H THR 90 H THR 90 4.847 9.173 10.800 628 HA THR 90 HA THR 90 3.382 10.665 11.706 629 HB THR 90 HB THR 90 4.664 10.846 14.353 630 HG1 THR 90 1HG THR 90 3.837 8.365 13.236 631 HG21 THR 90 3HG2 THR 90 2.334 11.602 13.693 632 HG22 THR 90 1HG2 THR 90 2.441 10.595 15.136 633 HG23 THR 90 2HG2 THR 90 1.905 9.894 13.610 634 H THR 91 H THR 91 5.675 11.619 10.359 635 HA THR 91 HA THR 91 6.180 14.141 11.803 636 HB THR 91 HB THR 91 8.263 14.311 10.383 637 HG1 THR 91 1HG THR 91 9.006 12.316 9.496 638 HG21 THR 91 3HG2 THR 91 7.815 12.991 12.792 639 HG22 THR 91 1HG2 THR 91 9.368 13.545 12.167 640 HG23 THR 91 2HG2 THR 91 8.836 11.890 11.866 641 H GLY 92 H GLY 92 6.702 13.136 8.431 642 HA2 GLY 92 2HA GLY 92 4.919 13.908 6.813 643 HA3 GLY 92 3HA GLY 92 5.085 15.466 7.609 644 H ASP 93 H ASP 93 5.606 14.395 4.794 645 HA ASP 93 HA ASP 93 7.681 16.129 4.111 646 HB2 ASP 93 1HB ASP 93 8.645 13.700 5.195 647 HB3 ASP 93 2HB ASP 93 8.936 13.630 3.459 648 H GLY 94 H GLY 94 5.907 13.194 3.360 649 HA2 GLY 94 2HA GLY 94 4.686 12.711 1.450 650 HA3 GLY 94 3HA GLY 94 5.249 14.221 0.748 651 H ALA 95 H ALA 95 7.895 12.581 1.880 652 HA ALA 95 HA ALA 95 8.752 11.914 -0.784 653 HB1 ALA 95 1HB ALA 95 10.446 10.959 1.388 654 HB2 ALA 95 2HB ALA 95 10.818 12.052 0.054 655 HB3 ALA 95 3HB ALA 95 10.048 12.672 1.513 656 H ILE 96 H ILE 96 9.808 9.771 -1.213 657 HA ILE 96 HA ILE 96 7.998 7.704 -1.164 658 HB ILE 96 HB ILE 96 11.002 7.391 -1.197 659 HG12 ILE 96 1HG1 ILE 96 9.833 7.176 -3.783 660 HG13 ILE 96 2HG1 ILE 96 9.234 8.660 -3.050 661 HG21 ILE 96 1HG2 ILE 96 10.086 5.257 -0.873 662 HG22 ILE 96 2HG2 ILE 96 8.738 5.576 -1.963 663 HG23 ILE 96 3HG2 ILE 96 10.364 5.366 -2.612 664 HD11 ILE 96 3HD1 ILE 96 12.078 7.873 -3.584 665 HD12 ILE 96 1HD1 ILE 96 11.177 9.239 -4.240 666 HD13 ILE 96 2HD1 ILE 96 11.638 9.222 -2.537 667 H ASP 97 H ASP 97 7.386 6.173 0.243 668 HA ASP 97 HA ASP 97 8.513 6.266 2.930 669 HB2 ASP 97 1HB ASP 97 6.175 6.330 3.017 670 HB3 ASP 97 2HB ASP 97 6.000 5.123 1.746 671 H ASP 98 H ASP 98 10.255 5.033 3.230 672 HA ASP 98 HA ASP 98 10.295 2.344 2.031 673 HB2 ASP 98 1HB ASP 98 12.183 3.525 1.242 674 HB3 ASP 98 2HB ASP 98 12.509 4.227 2.824 675 H ILE 99 H ILE 99 9.767 0.784 3.400 676 HA ILE 99 HA ILE 99 10.448 1.111 6.248 677 HB ILE 99 HB ILE 99 8.016 0.895 5.695 678 HG12 ILE 99 1HG1 ILE 99 9.246 -1.319 7.352 679 HG13 ILE 99 2HG1 ILE 99 8.860 0.304 7.911 680 HG21 ILE 99 1HG2 ILE 99 7.159 -1.308 5.057 681 HG22 ILE 99 2HG2 ILE 99 8.213 -0.637 3.814 682 HG23 ILE 99 3HG2 ILE 99 8.811 -1.901 4.889 683 HD11 ILE 99 3HD1 ILE 99 6.492 -0.130 7.548 684 HD12 ILE 99 1HD1 ILE 99 6.876 -1.753 6.973 685 HD13 ILE 99 2HD1 ILE 99 7.203 -1.310 8.649 686 H THR 100 H THR 100 11.601 -0.436 7.295 687 HA THR 100 HA THR 100 12.278 -2.901 5.857 688 HB THR 100 HB THR 100 14.623 -2.698 6.273 689 HG1 THR 100 1HG THR 100 15.469 -1.229 7.615 690 HG21 THR 100 3HG2 THR 100 13.273 -1.060 4.527 691 HG22 THR 100 1HG2 THR 100 15.015 -1.326 4.541 692 HG23 THR 100 2HG2 THR 100 14.329 0.066 5.377 693 H PHE 101 H PHE 101 12.142 -4.642 7.117 694 HA PHE 101 HA PHE 101 12.616 -4.404 9.988 695 HB2 PHE 101 1HB PHE 101 10.482 -5.952 10.200 696 HB3 PHE 101 2HB PHE 101 10.334 -4.198 10.188 697 HD1 PHE 101 2HD PHE 101 9.569 -3.036 8.150 698 HD2 PHE 101 1HD PHE 101 9.601 -7.283 8.445 699 HE1 PHE 101 2HE PHE 101 8.047 -3.178 6.222 700 HE2 PHE 101 1HE PHE 101 8.080 -7.431 6.516 701 HZ PHE 101 HZ PHE 101 7.301 -5.377 5.403 702 H ALA 102 H ALA 102 12.112 -6.817 10.910 703 HA ALA 102 HA ALA 102 14.107 -8.451 9.652 704 HB1 ALA 102 1HB ALA 102 14.006 -9.805 11.536 705 HB2 ALA 102 2HB ALA 102 13.589 -8.211 12.168 706 HB3 ALA 102 3HB ALA 102 12.320 -9.396 11.861 707 H ALA 103 H ALA 103 13.771 -10.692 9.027 708 HA ALA 103 HA ALA 103 11.719 -11.004 7.143 709 HB1 ALA 103 1HB ALA 103 13.651 -12.927 8.395 710 HB2 ALA 103 2HB ALA 103 12.443 -13.460 7.225 711 HB3 ALA 103 3HB ALA 103 13.650 -12.261 6.762 712 H THR 104 H THR 104 9.626 -11.275 7.514 713 HA THR 104 HA THR 104 8.786 -13.120 9.636 714 HB THR 104 HB THR 104 6.800 -11.469 9.981 715 HG1 THR 104 1HG THR 104 7.221 -9.904 8.490 716 HG21 THR 104 3HG2 THR 104 7.894 -10.508 11.852 717 HG22 THR 104 1HG2 THR 104 9.475 -10.624 11.080 718 HG23 THR 104 2HG2 THR 104 8.643 -12.085 11.611 719 H ASN 105 H ASN 105 6.931 -14.281 9.209 720 HA ASN 105 HA ASN 105 6.133 -14.361 6.425 721 HB2 ASN 105 1HB ASN 105 4.691 -16.314 7.319 722 HB3 ASN 105 2HB ASN 105 6.441 -16.511 7.301 723 HD21 ASN 105 1HD2 ASN 105 7.295 -17.286 9.079 724 HD22 ASN 105 2HD2 ASN 105 6.621 -17.181 10.666 725 H ALA 106 H ALA 106 4.227 -13.707 5.598 726 HA ALA 106 HA ALA 106 1.949 -13.161 7.290 727 HB1 ALA 106 1HB ALA 106 2.809 -11.069 7.690 728 HB2 ALA 106 2HB ALA 106 3.601 -10.974 6.117 729 HB3 ALA 106 3HB ALA 106 1.854 -10.769 6.237 730 H LYS 107 H LYS 107 0.099 -12.261 5.939 731 HA LYS 107 HA LYS 107 0.028 -13.755 3.434 732 HB2 LYS 107 1HB LYS 107 -2.050 -12.592 5.256 733 HB3 LYS 107 2HB LYS 107 -2.467 -12.976 3.591 734 HG2 LYS 107 1HG LYS 107 -1.085 -15.196 4.725 735 HG3 LYS 107 2HG LYS 107 -2.382 -14.703 5.817 736 HD2 LYS 107 1HD LYS 107 -3.995 -14.848 4.010 737 HD3 LYS 107 2HD LYS 107 -2.711 -15.242 2.865 738 HE2 LYS 107 1HE LYS 107 -2.228 -17.285 4.168 739 HE3 LYS 107 2HE LYS 107 -3.582 -16.900 5.230 740 HZ1 LYS 107 3HZ LYS 107 -4.384 -16.859 2.506 741 HZ2 LYS 107 1HZ LYS 107 -4.993 -17.782 3.786 742 HZ3 LYS 107 2HZ LYS 107 -3.675 -18.346 2.891 743 H PHE 108 H PHE 108 -1.699 -10.767 4.214 744 HA PHE 108 HA PHE 108 -0.557 -9.568 1.775 745 HB2 PHE 108 1HB PHE 108 -3.261 -8.882 2.920 746 HB3 PHE 108 2HB PHE 108 -2.630 -8.505 1.320 747 HD1 PHE 108 1HD PHE 108 -1.457 -11.293 0.809 748 HD2 PHE 108 2HD PHE 108 -5.251 -9.959 2.200 749 HE1 PHE 108 1HE PHE 108 -2.497 -13.336 -0.083 750 HE2 PHE 108 2HE PHE 108 -6.299 -12.001 1.312 751 HZ PHE 108 HZ PHE 108 -4.922 -13.693 0.169 752 H VAL 109 H VAL 109 -0.456 -7.197 1.774 753 HA VAL 109 HA VAL 109 0.152 -6.174 4.469 754 HB VAL 109 HB VAL 109 1.220 -5.086 1.865 755 HG11 VAL 109 1HG1 VAL 109 2.917 -4.068 3.347 756 HG12 VAL 109 2HG1 VAL 109 1.280 -3.503 3.686 757 HG13 VAL 109 3HG1 VAL 109 2.039 -4.697 4.741 758 HG21 VAL 109 3HG2 VAL 109 2.057 -7.302 1.979 759 HG22 VAL 109 1HG2 VAL 109 3.349 -6.252 2.558 760 HG23 VAL 109 2HG2 VAL 109 2.376 -7.168 3.708 761 H ARG 110 H ARG 110 -0.467 -4.066 5.030 762 HA ARG 110 HA ARG 110 -2.330 -2.710 3.216 763 HB2 ARG 110 1HB ARG 110 -2.912 -3.168 6.145 764 HB3 ARG 110 2HB ARG 110 -3.958 -2.382 4.970 765 HG2 ARG 110 1HG ARG 110 -3.404 -4.914 3.915 766 HG3 ARG 110 2HG ARG 110 -3.726 -5.162 5.633 767 HD2 ARG 110 1HD ARG 110 -5.885 -4.403 5.477 768 HD3 ARG 110 2HD ARG 110 -5.537 -3.378 4.086 769 HE ARG 110 HE ARG 110 -5.947 -5.164 2.690 770 HH11 ARG 110 1HH1 ARG 110 -5.795 -6.247 5.995 771 HH12 ARG 110 2HH1 ARG 110 -6.407 -7.828 5.641 772 HH21 ARG 110 1HH2 ARG 110 -6.754 -7.243 2.213 773 HH22 ARG 110 2HH2 ARG 110 -6.952 -8.394 3.490 774 H VAL 111 H VAL 111 -1.884 -0.615 3.041 775 HA VAL 111 HA VAL 111 -0.372 0.681 5.217 776 HB VAL 111 HB VAL 111 -0.174 1.370 2.284 777 HG11 VAL 111 1HG1 VAL 111 1.044 3.128 2.900 778 HG12 VAL 111 2HG1 VAL 111 0.497 2.830 4.551 779 HG13 VAL 111 3HG1 VAL 111 2.026 2.149 3.990 780 HG21 VAL 111 3HG2 VAL 111 1.317 -0.578 3.954 781 HG22 VAL 111 1HG2 VAL 111 0.921 -0.626 2.235 782 HG23 VAL 111 2HG2 VAL 111 2.242 0.392 2.809 783 H TYR 112 H TYR 112 -1.117 2.581 5.976 784 HA TYR 112 HA TYR 112 -3.224 3.974 4.485 785 HB2 TYR 112 1HB TYR 112 -4.701 4.075 6.313 786 HB3 TYR 112 2HB TYR 112 -4.143 2.406 6.299 787 HD1 TYR 112 1HD TYR 112 -3.984 5.617 8.064 788 HD2 TYR 112 2HD TYR 112 -2.719 1.555 8.062 789 HE1 TYR 112 1HE TYR 112 -3.265 5.847 10.404 790 HE2 TYR 112 2HE TYR 112 -1.997 1.773 10.404 791 HH TYR 112 HH TYR 112 -1.358 4.439 11.889 792 H ALA 113 H ALA 113 -3.596 6.185 5.254 793 HA ALA 113 HA ALA 113 -1.331 7.327 6.736 794 HB1 ALA 113 1HB ALA 113 -1.010 9.073 5.139 795 HB2 ALA 113 2HB ALA 113 -0.954 7.536 4.274 796 HB3 ALA 113 3HB ALA 113 -2.401 8.541 4.194 797 H THR 114 H THR 114 -2.023 9.990 6.528 798 HA THR 114 HA THR 114 -4.801 10.271 7.334 799 HB THR 114 HB THR 114 -3.700 9.670 9.440 800 HG1 THR 114 1HG THR 114 -4.220 12.459 9.509 801 HG21 THR 114 3HG2 THR 114 -1.624 10.338 9.881 802 HG22 THR 114 1HG2 THR 114 -2.185 12.007 9.968 803 HG23 THR 114 2HG2 THR 114 -1.625 11.344 8.433 804 H THR 115 H THR 115 -3.389 11.259 5.099 805 HA THR 115 HA THR 115 -3.704 14.131 5.567 806 HB THR 115 HB THR 115 -1.271 12.865 4.306 807 HG1 THR 115 1HG THR 115 -1.687 14.612 6.517 808 HG21 THR 115 3HG2 THR 115 -0.659 15.409 4.083 809 HG22 THR 115 1HG2 THR 115 -2.410 15.612 4.029 810 HG23 THR 115 2HG2 THR 115 -1.600 14.603 2.829 811 H ARG 116 H ARG 116 -4.482 15.276 3.825 812 HA ARG 116 HA ARG 116 -5.709 13.702 1.740 813 HB2 ARG 116 1HB ARG 116 -5.733 16.706 1.899 814 HB3 ARG 116 2HB ARG 116 -6.936 15.637 1.191 815 HG2 ARG 116 1HG ARG 116 -8.079 15.874 3.076 816 HG3 ARG 116 2HG ARG 116 -6.851 14.865 3.842 817 HD2 ARG 116 1HD ARG 116 -5.666 17.334 3.834 818 HD3 ARG 116 2HD ARG 116 -7.363 17.731 4.102 819 HE ARG 116 HE ARG 116 -5.580 16.431 5.936 820 HH11 ARG 116 1HH1 ARG 116 -8.908 16.846 5.005 821 HH12 ARG 116 2HH1 ARG 116 -9.532 16.452 6.573 822 HH21 ARG 116 1HH2 ARG 116 -6.388 15.910 8.004 823 HH22 ARG 116 2HH2 ARG 116 -8.097 15.920 8.278 824 H ALA 117 H ALA 117 -5.702 15.388 -0.425 825 HA ALA 117 HA ALA 117 -2.908 15.862 -1.134 826 HB1 ALA 117 1HB ALA 117 -3.682 14.657 -3.410 827 HB2 ALA 117 2HB ALA 117 -2.847 13.823 -2.099 828 HB3 ALA 117 3HB ALA 117 -4.602 13.715 -2.237 829 H THR 118 H THR 118 -3.792 18.062 -0.948 830 HA THR 118 HA THR 118 -5.842 19.174 -2.384 831 HB THR 118 HB THR 118 -3.321 20.745 -2.352 832 HG1 THR 118 1HG THR 118 -3.733 21.027 0.002 833 HG21 THR 118 3HG2 THR 118 -5.245 22.108 -0.962 834 HG22 THR 118 1HG2 THR 118 -6.209 21.162 -2.094 835 HG23 THR 118 2HG2 THR 118 -4.957 22.248 -2.696 836 H ALA 119 H ALA 119 -2.677 18.207 -3.541 837 HA ALA 119 HA ALA 119 -2.758 19.511 -6.042 838 HB1 ALA 119 1HB ALA 119 -0.639 18.818 -5.587 839 HB2 ALA 119 2HB ALA 119 -1.171 17.305 -4.852 840 HB3 ALA 119 3HB ALA 119 -1.158 17.476 -6.608 841 H TYR 120 H TYR 120 -2.647 15.998 -5.934 842 HA TYR 120 HA TYR 120 -4.924 15.937 -7.805 843 HB2 TYR 120 1HB TYR 120 -2.619 15.291 -8.688 844 HB3 TYR 120 2HB TYR 120 -2.735 13.867 -7.661 845 HD1 TYR 120 2HD TYR 120 -4.864 12.396 -7.990 846 HD2 TYR 120 1HD TYR 120 -3.451 15.209 -10.853 847 HE1 TYR 120 2HE TYR 120 -6.115 11.221 -9.753 848 HE2 TYR 120 1HE TYR 120 -4.699 14.043 -12.624 849 HH TYR 120 HH TYR 120 -5.582 11.662 -12.991 850 H GLY 121 H GLY 121 -3.204 13.472 -5.891 851 HA2 GLY 121 2HA GLY 121 -5.234 13.033 -4.005 852 HA3 GLY 121 3HA GLY 121 -5.507 11.950 -5.362 853 H TYR 122 H TYR 122 -4.724 9.991 -5.026 854 HA TYR 122 HA TYR 122 -2.226 9.726 -3.485 855 HB2 TYR 122 1HB TYR 122 -4.249 8.883 -2.289 856 HB3 TYR 122 2HB TYR 122 -4.494 7.727 -3.593 857 HD1 TYR 122 1HD TYR 122 -1.254 8.720 -2.080 858 HD2 TYR 122 2HD TYR 122 -4.212 5.685 -2.459 859 HE1 TYR 122 1HE TYR 122 0.240 7.132 -0.945 860 HE2 TYR 122 2HE TYR 122 -2.726 4.088 -1.323 861 HH TYR 122 HH TYR 122 -0.185 4.899 0.478 862 H SER 123 H SER 123 -0.592 9.006 -4.660 863 HA SER 123 HA SER 123 -1.111 7.025 -6.766 864 HB2 SER 123 1HB SER 123 -0.881 8.988 -8.056 865 HB3 SER 123 2HB SER 123 0.413 9.611 -7.033 866 HG SER 123 HG SER 123 0.833 8.468 -9.221 867 H LEU 124 H LEU 124 0.451 5.473 -7.022 868 HA LEU 124 HA LEU 124 2.963 5.712 -5.568 869 HB2 LEU 124 1HB LEU 124 2.412 3.237 -4.791 870 HB3 LEU 124 2HB LEU 124 1.993 4.648 -3.824 871 HG LEU 124 HG LEU 124 -0.308 4.537 -4.747 872 HD11 LEU 124 1HD1 LEU 124 0.485 1.846 -5.832 873 HD12 LEU 124 2HD1 LEU 124 0.397 3.299 -6.826 874 HD13 LEU 124 3HD1 LEU 124 -1.052 2.691 -6.025 875 HD21 LEU 124 3HD2 LEU 124 -1.016 2.986 -3.205 876 HD22 LEU 124 1HD2 LEU 124 0.619 3.312 -2.629 877 HD23 LEU 124 2HD2 LEU 124 0.291 1.859 -3.575 878 H TRP 125 H TRP 125 3.382 5.851 -7.985 879 HA TRP 125 HA TRP 125 3.164 3.488 -9.560 880 HB2 TRP 125 1HB TRP 125 4.917 5.923 -9.946 881 HB3 TRP 125 2HB TRP 125 4.616 4.679 -11.157 882 HD1 TRP 125 HD TRP 125 1.388 5.002 -9.672 883 HE1 TRP 125 1HE TRP 125 -0.108 6.683 -10.922 884 HE3 TRP 125 3HE TRP 125 4.978 7.411 -12.400 885 HZ2 TRP 125 2HZ TRP 125 0.194 8.755 -12.814 886 HZ3 TRP 125 3HZ TRP 125 4.291 9.231 -13.907 887 HH2 TRP 125 HH TRP 125 1.948 9.887 -14.109 888 H GLU 126 H GLU 126 5.182 4.306 -7.020 889 HA GLU 126 HA GLU 126 7.213 2.363 -7.907 890 HB2 GLU 126 1HB GLU 126 7.600 5.021 -7.143 891 HB3 GLU 126 2HB GLU 126 8.088 4.083 -5.740 892 HG2 GLU 126 1HG GLU 126 9.950 3.362 -6.727 893 HG3 GLU 126 2HG GLU 126 9.123 3.020 -8.245 894 H PHE 127 H PHE 127 5.036 1.283 -6.814 895 HA PHE 127 HA PHE 127 5.690 0.811 -3.986 896 HB2 PHE 127 1HB PHE 127 3.346 1.617 -4.739 897 HB3 PHE 127 2HB PHE 127 3.123 -0.036 -5.302 898 HD1 PHE 127 2HD PHE 127 4.024 -1.805 -3.403 899 HD2 PHE 127 1HD PHE 127 2.387 2.063 -2.718 900 HE1 PHE 127 2HE PHE 127 3.369 -2.489 -1.133 901 HE2 PHE 127 1HE PHE 127 1.729 1.386 -0.445 902 HZ PHE 127 HZ PHE 127 2.218 -0.894 0.350 903 H GLU 128 H GLU 128 7.088 -0.847 -3.897 904 HA GLU 128 HA GLU 128 6.405 -3.290 -5.399 905 HB2 GLU 128 1HB GLU 128 8.825 -1.810 -5.337 906 HB3 GLU 128 2HB GLU 128 9.123 -3.329 -4.503 907 HG2 GLU 128 1HG GLU 128 8.355 -4.575 -6.429 908 HG3 GLU 128 2HG GLU 128 7.956 -3.076 -7.266 909 H VAL 129 H VAL 129 5.739 -4.919 -4.182 910 HA VAL 129 HA VAL 129 6.937 -5.353 -1.552 911 HB VAL 129 HB VAL 129 5.004 -4.117 -0.924 912 HG11 VAL 129 1HG1 VAL 129 3.836 -4.345 -3.106 913 HG12 VAL 129 2HG1 VAL 129 3.329 -5.964 -2.618 914 HG13 VAL 129 3HG1 VAL 129 2.780 -4.554 -1.711 915 HG21 VAL 129 3HG2 VAL 129 5.491 -6.594 0.005 916 HG22 VAL 129 1HG2 VAL 129 4.221 -5.549 0.640 917 HG23 VAL 129 2HG2 VAL 129 3.827 -6.797 -0.542 918 H TYR 130 H TYR 130 7.677 -7.362 -1.601 919 HA TYR 130 HA TYR 130 6.083 -9.624 -1.944 920 HB2 TYR 130 1HB TYR 130 5.877 -9.420 -4.233 921 HB3 TYR 130 2HB TYR 130 7.443 -8.635 -4.411 922 HD1 TYR 130 2HD TYR 130 9.506 -9.980 -4.464 923 HD2 TYR 130 1HD TYR 130 5.669 -11.811 -4.297 924 HE1 TYR 130 2HE TYR 130 10.503 -12.120 -5.154 925 HE2 TYR 130 1HE TYR 130 6.656 -13.956 -4.985 926 HH TYR 130 HH TYR 130 9.375 -14.899 -4.718 927 H GLY 131 H GLY 131 7.189 -11.539 -1.484 928 HA2 GLY 131 2HA GLY 131 9.871 -11.111 -0.393 929 HA3 GLY 131 3HA GLY 131 8.811 -12.466 -0.036 Start of MODEL 6 1 H ASN 1 H ASN 1 -10.335 -16.636 -12.837 2 HA ASN 1 HA ASN 1 -8.097 -15.997 -12.283 3 HB2 ASN 1 1HB ASN 1 -7.281 -14.985 -14.519 4 HB3 ASN 1 2HB ASN 1 -8.031 -16.578 -14.551 5 HD21 ASN 1 1HD2 ASN 1 -8.301 -13.267 -15.468 6 HD22 ASN 1 2HD2 ASN 1 -9.706 -13.434 -16.459 7 H LEU 2 H LEU 2 -9.374 -14.231 -10.757 8 HA LEU 2 HA LEU 2 -8.313 -11.595 -11.533 9 HB2 LEU 2 1HB LEU 2 -10.437 -12.187 -9.481 10 HB3 LEU 2 2HB LEU 2 -9.943 -10.602 -10.072 11 HG LEU 2 HG LEU 2 -11.225 -12.683 -11.830 12 HD11 LEU 2 1HD1 LEU 2 -12.577 -11.809 -9.777 13 HD12 LEU 2 2HD1 LEU 2 -13.324 -11.869 -11.373 14 HD13 LEU 2 3HD1 LEU 2 -12.713 -10.340 -10.743 15 HD21 LEU 2 3HD2 LEU 2 -11.831 -10.398 -12.984 16 HD22 LEU 2 1HD2 LEU 2 -10.271 -11.174 -13.263 17 HD23 LEU 2 2HD2 LEU 2 -10.399 -9.838 -12.120 18 H ALA 3 H ALA 3 -6.447 -13.284 -10.586 19 HA ALA 3 HA ALA 3 -5.845 -12.129 -7.960 20 HB1 ALA 3 1HB ALA 3 -5.206 -15.009 -8.461 21 HB2 ALA 3 2HB ALA 3 -5.342 -14.143 -6.930 22 HB3 ALA 3 3HB ALA 3 -6.793 -14.534 -7.853 23 H LEU 4 H LEU 4 -3.729 -11.603 -7.653 24 HA LEU 4 HA LEU 4 -1.598 -12.690 -9.204 25 HB2 LEU 4 1HB LEU 4 -3.029 -10.609 -10.402 26 HB3 LEU 4 2HB LEU 4 -1.560 -9.864 -9.777 27 HG LEU 4 HG LEU 4 -1.753 -12.127 -11.759 28 HD11 LEU 4 1HD1 LEU 4 -0.196 -10.144 -12.818 29 HD12 LEU 4 2HD1 LEU 4 -1.426 -9.234 -11.943 30 HD13 LEU 4 3HD1 LEU 4 -1.904 -10.405 -13.171 31 HD21 LEU 4 3HD2 LEU 4 0.735 -11.923 -11.841 32 HD22 LEU 4 1HD2 LEU 4 0.109 -12.604 -10.339 33 HD23 LEU 4 2HD2 LEU 4 0.646 -10.926 -10.389 34 H ASN 5 H ASN 5 0.440 -12.058 -8.452 35 HA ASN 5 HA ASN 5 0.516 -11.194 -5.750 36 HB2 ASN 5 1HB ASN 5 2.940 -11.230 -7.523 37 HB3 ASN 5 2HB ASN 5 2.809 -11.647 -5.817 38 HD21 ASN 5 1HD2 ASN 5 2.272 -12.719 -9.082 39 HD22 ASN 5 2HD2 ASN 5 2.083 -14.396 -8.712 40 H LYS 6 H LYS 6 0.334 -9.492 -8.646 41 HA LYS 6 HA LYS 6 1.602 -7.102 -7.501 42 HB2 LYS 6 1HB LYS 6 1.745 -8.195 -10.047 43 HB3 LYS 6 2HB LYS 6 0.619 -6.857 -10.237 44 HG2 LYS 6 1HG LYS 6 2.279 -5.395 -10.224 45 HG3 LYS 6 2HG LYS 6 2.867 -6.011 -8.677 46 HD2 LYS 6 1HD LYS 6 3.491 -7.217 -11.372 47 HD3 LYS 6 2HD LYS 6 4.562 -6.138 -10.474 48 HE2 LYS 6 1HE LYS 6 4.172 -7.919 -8.564 49 HE3 LYS 6 2HE LYS 6 3.814 -8.969 -9.934 50 HZ1 LYS 6 3HZ LYS 6 6.246 -7.353 -10.064 51 HZ2 LYS 6 1HZ LYS 6 5.948 -8.909 -10.660 52 HZ3 LYS 6 2HZ LYS 6 6.246 -8.677 -9.011 53 H ALA 7 H ALA 7 -1.434 -8.491 -8.313 54 HA ALA 7 HA ALA 7 -3.090 -6.386 -8.847 55 HB1 ALA 7 1HB ALA 7 -4.284 -8.124 -6.856 56 HB2 ALA 7 2HB ALA 7 -4.707 -7.888 -8.552 57 HB3 ALA 7 3HB ALA 7 -3.435 -9.028 -8.110 58 H THR 8 H THR 8 -4.211 -4.845 -7.679 59 HA THR 8 HA THR 8 -3.607 -4.563 -4.828 60 HB THR 8 HB THR 8 -2.617 -2.519 -4.935 61 HG1 THR 8 1HG THR 8 -4.039 -1.199 -5.873 62 HG21 THR 8 3HG2 THR 8 -1.056 -2.358 -6.792 63 HG22 THR 8 1HG2 THR 8 -2.032 -3.480 -7.738 64 HG23 THR 8 2HG2 THR 8 -1.213 -4.039 -6.281 65 H ALA 9 H ALA 9 -4.959 -2.826 -3.812 66 HA ALA 9 HA ALA 9 -7.365 -2.059 -5.222 67 HB1 ALA 9 1HB ALA 9 -8.722 -3.110 -3.239 68 HB2 ALA 9 2HB ALA 9 -8.291 -4.077 -4.650 69 HB3 ALA 9 3HB ALA 9 -7.349 -4.214 -3.166 70 H THR 10 H THR 10 -8.394 -0.322 -4.298 71 HA THR 10 HA THR 10 -7.419 0.618 -1.693 72 HB THR 10 HB THR 10 -6.837 2.731 -2.415 73 HG1 THR 10 1HG THR 10 -8.139 2.368 -4.914 74 HG21 THR 10 3HG2 THR 10 -6.209 1.510 -5.049 75 HG22 THR 10 1HG2 THR 10 -5.564 0.721 -3.611 76 HG23 THR 10 2HG2 THR 10 -5.170 2.408 -3.943 77 H SER 11 H SER 11 -8.765 2.623 -1.013 78 HA SER 11 HA SER 11 -11.543 1.819 -1.150 79 HB2 SER 11 1HB SER 11 -11.131 2.431 1.019 80 HB3 SER 11 2HB SER 11 -9.917 3.627 0.563 81 HG SER 11 HG SER 11 -11.412 5.091 0.626 82 H SER 12 H SER 12 -9.563 4.595 -2.083 83 HA SER 12 HA SER 12 -11.857 5.621 -3.624 84 HB2 SER 12 1HB SER 12 -10.383 6.940 -1.659 85 HB3 SER 12 2HB SER 12 -9.744 7.571 -3.177 86 HG SER 12 HG SER 12 -12.463 7.525 -2.359 87 H ILE 13 H ILE 13 -11.532 6.259 -5.737 88 HA ILE 13 HA ILE 13 -8.912 6.278 -6.921 89 HB ILE 13 HB ILE 13 -9.311 3.869 -6.877 90 HG12 ILE 13 1HG1 ILE 13 -9.577 5.088 -9.634 91 HG13 ILE 13 2HG1 ILE 13 -8.074 4.795 -8.766 92 HG21 ILE 13 1HG2 ILE 13 -11.413 3.673 -8.811 93 HG22 ILE 13 2HG2 ILE 13 -11.319 2.981 -7.193 94 HG23 ILE 13 3HG2 ILE 13 -11.968 4.605 -7.419 95 HD11 ILE 13 3HD1 ILE 13 -8.154 3.020 -10.218 96 HD12 ILE 13 1HD1 ILE 13 -8.869 2.325 -8.764 97 HD13 ILE 13 2HD1 ILE 13 -9.905 2.854 -10.090 98 H GLU 14 H GLU 14 -8.869 7.304 -8.899 99 HA GLU 14 HA GLU 14 -10.933 9.086 -9.502 100 HB2 GLU 14 1HB GLU 14 -8.553 8.126 -11.073 101 HB3 GLU 14 2HB GLU 14 -9.684 9.291 -11.744 102 HG2 GLU 14 1HG GLU 14 -8.203 9.677 -9.155 103 HG3 GLU 14 2HG GLU 14 -7.657 10.292 -10.714 104 H THR 15 H THR 15 -9.961 6.123 -11.225 105 HA THR 15 HA THR 15 -12.221 6.227 -12.990 106 HB THR 15 HB THR 15 -11.434 4.184 -13.925 107 HG1 THR 15 1HG THR 15 -11.017 2.906 -12.170 108 HG21 THR 15 3HG2 THR 15 -8.866 5.468 -13.059 109 HG22 THR 15 1HG2 THR 15 -9.990 6.326 -14.112 110 HG23 THR 15 2HG2 THR 15 -9.296 4.789 -14.628 111 H ALA 16 H ALA 16 -13.162 3.682 -13.139 112 HA ALA 16 HA ALA 16 -14.780 3.519 -10.718 113 HB1 ALA 16 1HB ALA 16 -15.902 3.553 -12.901 114 HB2 ALA 16 2HB ALA 16 -15.082 2.054 -13.338 115 HB3 ALA 16 3HB ALA 16 -16.241 2.069 -12.009 116 H GLY 17 H GLY 17 -12.145 2.711 -10.326 117 HA2 GLY 17 2HA GLY 17 -11.036 1.007 -9.246 118 HA3 GLY 17 3HA GLY 17 -12.546 0.109 -9.239 119 H HIS 18 H HIS 18 -9.488 0.527 -10.735 120 HA HIS 18 HA HIS 18 -9.449 -1.985 -11.923 121 HB2 HIS 18 1HB HIS 18 -10.988 -0.183 -13.437 122 HB3 HIS 18 2HB HIS 18 -9.456 -0.336 -14.291 123 HD1 HIS 18 1HD HIS 18 -9.043 -2.475 -15.562 124 HD2 HIS 18 2HD HIS 18 -12.429 -2.652 -13.160 125 HE1 HIS 18 1HE HIS 18 -10.211 -4.608 -16.202 126 H GLU 19 H GLU 19 -8.310 1.306 -11.862 127 HA GLU 19 HA GLU 19 -5.883 0.930 -13.254 128 HB2 GLU 19 1HB GLU 19 -7.204 3.058 -11.973 129 HB3 GLU 19 2HB GLU 19 -5.642 2.917 -11.178 130 HG2 GLU 19 1HG GLU 19 -4.615 2.926 -13.487 131 HG3 GLU 19 2HG GLU 19 -6.204 3.401 -14.086 132 H GLY 20 H GLY 20 -6.892 0.134 -10.044 133 HA2 GLY 20 2HA GLY 20 -4.335 0.017 -8.816 134 HA3 GLY 20 3HA GLY 20 -5.791 -0.788 -8.249 135 H ASP 21 H ASP 21 -6.273 -2.369 -10.557 136 HA ASP 21 HA ASP 21 -4.449 -4.520 -10.015 137 HB2 ASP 21 1HB ASP 21 -5.845 -5.827 -11.522 138 HB3 ASP 21 2HB ASP 21 -6.858 -4.910 -10.411 139 H LYS 22 H LYS 22 -4.224 -1.871 -11.957 140 HA LYS 22 HA LYS 22 -3.281 -2.800 -14.404 141 HB2 LYS 22 1HB LYS 22 -3.744 -0.379 -13.561 142 HB3 LYS 22 2HB LYS 22 -2.056 -0.408 -13.068 143 HG2 LYS 22 1HG LYS 22 -1.297 -0.611 -15.273 144 HG3 LYS 22 2HG LYS 22 -2.891 -1.081 -15.868 145 HD2 LYS 22 1HD LYS 22 -3.679 1.222 -15.160 146 HD3 LYS 22 2HD LYS 22 -1.977 1.633 -14.941 147 HE2 LYS 22 1HE LYS 22 -2.332 0.371 -17.483 148 HE3 LYS 22 2HE LYS 22 -3.495 1.686 -17.320 149 HZ1 LYS 22 3HZ LYS 22 -1.182 2.208 -18.251 150 HZ2 LYS 22 1HZ LYS 22 -0.654 2.100 -16.647 151 HZ3 LYS 22 2HZ LYS 22 -1.820 3.246 -17.076 152 H ALA 23 H ALA 23 -1.851 -2.970 -11.293 153 HA ALA 23 HA ALA 23 0.873 -3.003 -11.897 154 HB1 ALA 23 1HB ALA 23 -0.713 -3.473 -9.642 155 HB2 ALA 23 2HB ALA 23 0.260 -4.929 -9.852 156 HB3 ALA 23 3HB ALA 23 1.045 -3.356 -9.713 157 H VAL 24 H VAL 24 -1.579 -5.237 -12.714 158 HA VAL 24 HA VAL 24 -0.436 -7.702 -12.758 159 HB VAL 24 HB VAL 24 -1.651 -8.073 -14.964 160 HG11 VAL 24 1HG1 VAL 24 -3.875 -7.146 -13.560 161 HG12 VAL 24 2HG1 VAL 24 -3.159 -8.758 -13.479 162 HG13 VAL 24 3HG1 VAL 24 -2.673 -7.516 -12.324 163 HG21 VAL 24 3HG2 VAL 24 -2.356 -5.184 -14.477 164 HG22 VAL 24 1HG2 VAL 24 -1.594 -5.886 -15.905 165 HG23 VAL 24 2HG2 VAL 24 -3.280 -6.249 -15.537 166 H ASP 25 H ASP 25 0.069 -5.145 -15.171 167 HA ASP 25 HA ASP 25 1.620 -6.425 -17.016 168 HB2 ASP 25 1HB ASP 25 0.961 -3.812 -16.531 169 HB3 ASP 25 2HB ASP 25 2.700 -3.796 -16.259 170 H GLY 26 H GLY 26 2.716 -5.041 -13.933 171 HA2 GLY 26 2HA GLY 26 4.483 -5.721 -12.600 172 HA3 GLY 26 3HA GLY 26 4.855 -6.963 -13.785 173 H ASN 27 H ASN 27 4.560 -3.582 -14.626 174 HA ASN 27 HA ASN 27 7.416 -3.137 -14.551 175 HB2 ASN 27 1HB ASN 27 6.403 -4.284 -16.844 176 HB3 ASN 27 2HB ASN 27 6.400 -2.567 -17.239 177 HD21 ASN 27 1HD2 ASN 27 8.141 -5.238 -17.579 178 HD22 ASN 27 2HD2 ASN 27 9.741 -4.585 -17.589 179 H ALA 28 H ALA 28 7.609 -0.955 -16.192 180 HA ALA 28 HA ALA 28 6.465 1.088 -14.613 181 HB1 ALA 28 1HB ALA 28 7.223 2.238 -17.050 182 HB2 ALA 28 2HB ALA 28 8.163 2.156 -15.561 183 HB3 ALA 28 3HB ALA 28 8.337 0.897 -16.783 184 H ALA 29 H ALA 29 5.160 -0.773 -17.106 185 HA ALA 29 HA ALA 29 3.462 1.118 -18.354 186 HB1 ALA 29 1HB ALA 29 2.603 -0.638 -19.533 187 HB2 ALA 29 2HB ALA 29 4.127 -1.353 -19.002 188 HB3 ALA 29 3HB ALA 29 2.631 -1.728 -18.147 189 H THR 30 H THR 30 3.428 -0.204 -15.253 190 HA THR 30 HA THR 30 0.535 0.138 -14.936 191 HB THR 30 HB THR 30 0.614 -1.188 -13.052 192 HG1 THR 30 1HG THR 30 2.575 -1.452 -11.820 193 HG21 THR 30 3HG2 THR 30 1.764 -2.224 -15.230 194 HG22 THR 30 1HG2 THR 30 1.579 -3.137 -13.733 195 HG23 THR 30 2HG2 THR 30 3.121 -2.369 -14.113 196 H ARG 31 H ARG 31 -0.328 1.830 -13.900 197 HA ARG 31 HA ARG 31 1.386 3.484 -12.190 198 HB2 ARG 31 1HB ARG 31 0.130 5.491 -13.265 199 HB3 ARG 31 2HB ARG 31 1.506 4.788 -14.105 200 HG2 ARG 31 1HG ARG 31 0.159 3.745 -15.694 201 HG3 ARG 31 2HG ARG 31 -1.291 3.898 -14.698 202 HD2 ARG 31 1HD ARG 31 -0.700 6.485 -14.968 203 HD3 ARG 31 2HD ARG 31 0.036 5.883 -16.453 204 HE ARG 31 HE ARG 31 -2.584 4.861 -16.170 205 HH11 ARG 31 1HH1 ARG 31 -0.854 7.781 -16.945 206 HH12 ARG 31 2HH1 ARG 31 -2.120 8.422 -17.939 207 HH21 ARG 31 1HH2 ARG 31 -4.258 5.694 -17.476 208 HH22 ARG 31 2HH2 ARG 31 -4.057 7.235 -18.239 209 H TRP 32 H TRP 32 0.068 5.090 -10.924 210 HA TRP 32 HA TRP 32 -2.678 4.188 -10.443 211 HB2 TRP 32 1HB TRP 32 -1.279 2.999 -8.818 212 HB3 TRP 32 2HB TRP 32 -0.587 4.528 -8.282 213 HD1 TRP 32 HD TRP 32 -1.584 5.233 -6.046 214 HE1 TRP 32 1HE TRP 32 -3.888 5.076 -4.909 215 HE3 TRP 32 3HE TRP 32 -4.142 2.779 -9.730 216 HZ2 TRP 32 2HZ TRP 32 -6.449 4.046 -5.495 217 HZ3 TRP 32 3HZ TRP 32 -6.516 2.245 -9.362 218 HH2 TRP 32 HH TRP 32 -7.644 2.866 -7.288 219 H ALA 33 H ALA 33 -4.080 5.804 -10.043 220 HA ALA 33 HA ALA 33 -3.042 8.429 -9.256 221 HB1 ALA 33 1HB ALA 33 -3.134 8.691 -11.594 222 HB2 ALA 33 2HB ALA 33 -4.686 7.860 -11.706 223 HB3 ALA 33 3HB ALA 33 -4.596 9.461 -10.975 224 H SER 34 H SER 34 -4.081 7.336 -7.283 225 HA SER 34 HA SER 34 -6.823 6.953 -7.030 226 HB2 SER 34 1HB SER 34 -4.605 6.927 -5.316 227 HB3 SER 34 2HB SER 34 -5.710 8.112 -4.619 228 HG SER 34 HG SER 34 -7.346 6.346 -5.026 229 H ALA 35 H ALA 35 -8.542 8.257 -6.824 230 HA ALA 35 HA ALA 35 -8.505 10.910 -7.607 231 HB1 ALA 35 1HB ALA 35 -10.633 10.213 -7.750 232 HB2 ALA 35 2HB ALA 35 -10.469 9.105 -6.387 233 HB3 ALA 35 3HB ALA 35 -10.762 10.821 -6.099 234 H TYR 36 H TYR 36 -9.164 12.829 -6.326 235 HA TYR 36 HA TYR 36 -7.553 12.968 -3.896 236 HB2 TYR 36 1HB TYR 36 -7.933 15.445 -4.134 237 HB3 TYR 36 2HB TYR 36 -7.081 14.697 -5.481 238 HD1 TYR 36 1HD TYR 36 -10.543 15.631 -4.432 239 HD2 TYR 36 2HD TYR 36 -7.784 15.164 -7.636 240 HE1 TYR 36 1HE TYR 36 -12.203 16.563 -5.988 241 HE2 TYR 36 2HE TYR 36 -9.436 16.095 -9.203 242 HH TYR 36 HH TYR 36 -12.504 17.406 -8.073 243 H GLY 37 H GLY 37 -8.451 14.485 -2.152 244 HA2 GLY 37 2HA GLY 37 -10.085 15.028 -0.617 245 HA3 GLY 37 3HA GLY 37 -11.289 14.641 -1.838 246 H ALA 38 H ALA 38 -12.038 13.943 0.554 247 HA ALA 38 HA ALA 38 -12.808 12.202 1.804 248 HB1 ALA 38 1HB ALA 38 -12.839 11.270 -0.746 249 HB2 ALA 38 2HB ALA 38 -11.823 10.067 0.050 250 HB3 ALA 38 3HB ALA 38 -13.449 10.385 0.653 251 H SER 39 H SER 39 -9.834 13.061 1.668 252 HA SER 39 HA SER 39 -8.347 10.775 2.504 253 HB2 SER 39 1HB SER 39 -6.576 12.151 2.314 254 HB3 SER 39 2HB SER 39 -7.714 13.348 1.696 255 HG SER 39 HG SER 39 -7.832 14.273 3.683 256 HA PRO 40 HA PRO 40 -6.283 10.992 3.915 257 HB2 PRO 40 1HB PRO 40 -5.648 8.929 5.561 258 HB3 PRO 40 2HB PRO 40 -5.351 10.620 5.982 259 HG2 PRO 40 1HG PRO 40 -7.598 8.828 6.818 260 HG3 PRO 40 2HG PRO 40 -6.663 9.977 7.791 261 HD2 PRO 40 1HD PRO 40 -9.129 10.550 6.831 262 HD3 PRO 40 2HD PRO 40 -7.877 11.790 7.045 263 H GLN 41 H GLN 41 -5.458 8.986 2.919 264 HA GLN 41 HA GLN 41 -7.660 7.177 2.172 265 HB2 GLN 41 1HB GLN 41 -6.269 8.840 0.498 266 HB3 GLN 41 2HB GLN 41 -5.379 7.333 0.328 267 HG2 GLN 41 1HG GLN 41 -6.920 6.567 -1.052 268 HG3 GLN 41 2HG GLN 41 -8.143 6.727 0.208 269 HE21 GLN 41 1HE2 GLN 41 -9.172 8.839 0.424 270 HE22 GLN 41 2HE2 GLN 41 -9.418 9.795 -0.994 271 H TRP 42 H TRP 42 -6.279 5.238 0.849 272 HA TRP 42 HA TRP 42 -3.974 4.291 2.175 273 HB2 TRP 42 1HB TRP 42 -5.063 2.352 3.356 274 HB3 TRP 42 2HB TRP 42 -5.366 3.926 4.089 275 HD1 TRP 42 HD TRP 42 -7.857 5.051 3.299 276 HE1 TRP 42 1HE TRP 42 -10.118 3.837 3.110 277 HE3 TRP 42 3HE TRP 42 -6.168 0.239 2.933 278 HZ2 TRP 42 2HZ TRP 42 -11.062 1.190 2.842 279 HZ3 TRP 42 3HZ TRP 42 -7.815 -1.576 2.713 280 HH2 TRP 42 HH TRP 42 -10.211 -1.108 2.670 281 H ILE 43 H ILE 43 -3.346 2.140 1.465 282 HA ILE 43 HA ILE 43 -4.918 0.993 -0.709 283 HB ILE 43 HB ILE 43 -3.449 2.605 -1.826 284 HG12 ILE 43 1HG1 ILE 43 -2.218 -0.048 -2.441 285 HG13 ILE 43 2HG1 ILE 43 -3.955 0.142 -2.646 286 HG21 ILE 43 1HG2 ILE 43 -1.151 2.679 -1.601 287 HG22 ILE 43 2HG2 ILE 43 -1.672 2.329 0.045 288 HG23 ILE 43 3HG2 ILE 43 -1.054 1.034 -0.978 289 HD11 ILE 43 3HD1 ILE 43 -2.841 2.367 -3.884 290 HD12 ILE 43 1HD1 ILE 43 -1.798 1.018 -4.332 291 HD13 ILE 43 2HD1 ILE 43 -3.530 0.943 -4.663 292 H TYR 44 H TYR 44 -4.730 -1.177 -0.859 293 HA TYR 44 HA TYR 44 -2.611 -2.478 0.719 294 HB2 TYR 44 1HB TYR 44 -4.279 -4.250 1.292 295 HB3 TYR 44 2HB TYR 44 -4.645 -2.677 1.993 296 HD1 TYR 44 1HD TYR 44 -6.385 -1.226 0.818 297 HD2 TYR 44 2HD TYR 44 -5.857 -5.359 -0.040 298 HE1 TYR 44 1HE TYR 44 -8.633 -1.300 -0.177 299 HE2 TYR 44 2HE TYR 44 -8.103 -5.445 -1.039 300 HH TYR 44 HH TYR 44 -10.009 -4.337 -1.383 301 H ILE 45 H ILE 45 -1.918 -4.531 -0.021 302 HA ILE 45 HA ILE 45 -2.673 -5.136 -2.806 303 HB ILE 45 HB ILE 45 0.051 -5.091 -1.539 304 HG12 ILE 45 1HG1 ILE 45 -1.080 -3.970 -4.113 305 HG13 ILE 45 2HG1 ILE 45 -0.699 -3.054 -2.658 306 HG21 ILE 45 1HG2 ILE 45 -0.076 -7.255 -2.554 307 HG22 ILE 45 2HG2 ILE 45 -0.792 -6.582 -4.017 308 HG23 ILE 45 3HG2 ILE 45 0.882 -6.213 -3.605 309 HD11 ILE 45 3HD1 ILE 45 1.249 -4.474 -4.457 310 HD12 ILE 45 1HD1 ILE 45 1.029 -2.732 -4.288 311 HD13 ILE 45 2HD1 ILE 45 1.674 -3.675 -2.944 312 H ASN 46 H ASN 46 -3.041 -7.237 -3.328 313 HA ASN 46 HA ASN 46 -2.809 -9.196 -1.141 314 HB2 ASN 46 1HB ASN 46 -5.133 -8.756 -1.694 315 HB3 ASN 46 2HB ASN 46 -4.817 -9.061 -3.399 316 HD21 ASN 46 1HD2 ASN 46 -6.184 -10.751 -3.659 317 HD22 ASN 46 2HD2 ASN 46 -5.988 -12.278 -2.876 318 H LEU 47 H LEU 47 -2.008 -11.236 -1.578 319 HA LEU 47 HA LEU 47 -0.663 -11.519 -4.182 320 HB2 LEU 47 1HB LEU 47 0.426 -11.564 -1.665 321 HB3 LEU 47 2HB LEU 47 0.225 -13.278 -2.024 322 HG LEU 47 HG LEU 47 1.411 -12.249 -4.310 323 HD11 LEU 47 1HD1 LEU 47 1.862 -10.155 -3.102 324 HD12 LEU 47 2HD1 LEU 47 3.342 -11.009 -3.540 325 HD13 LEU 47 3HD1 LEU 47 2.749 -11.068 -1.881 326 HD21 LEU 47 3HD2 LEU 47 1.845 -14.406 -3.196 327 HD22 LEU 47 1HD2 LEU 47 2.752 -13.554 -1.945 328 HD23 LEU 47 2HD2 LEU 47 3.328 -13.545 -3.612 329 H GLY 48 H GLY 48 -2.189 -13.446 -1.598 330 HA2 GLY 48 2HA GLY 48 -4.083 -14.861 -2.549 331 HA3 GLY 48 3HA GLY 48 -2.846 -15.477 -3.634 332 H SER 49 H SER 49 -1.008 -15.110 -1.127 333 HA SER 49 HA SER 49 -1.917 -17.255 0.581 334 HB2 SER 49 1HB SER 49 0.354 -18.473 0.130 335 HB3 SER 49 2HB SER 49 -1.005 -18.739 -0.962 336 HG SER 49 HG SER 49 1.111 -18.229 -1.941 337 H THR 50 H THR 50 -0.132 -17.793 2.229 338 HA THR 50 HA THR 50 0.727 -15.309 3.384 339 HB THR 50 HB THR 50 1.920 -17.440 4.800 340 HG1 THR 50 1HG THR 50 -0.035 -18.729 5.123 341 HG21 THR 50 3HG2 THR 50 1.096 -16.018 6.317 342 HG22 THR 50 1HG2 THR 50 -0.452 -16.832 6.100 343 HG23 THR 50 2HG2 THR 50 -0.086 -15.374 5.178 344 H GLN 51 H GLN 51 2.606 -14.327 3.057 345 HA GLN 51 HA GLN 51 4.951 -15.943 2.334 346 HB2 GLN 51 1HB GLN 51 3.798 -13.599 0.883 347 HB3 GLN 51 2HB GLN 51 5.544 -13.811 0.898 348 HG2 GLN 51 1HG GLN 51 3.839 -16.129 0.155 349 HG3 GLN 51 2HG GLN 51 4.052 -14.823 -1.010 350 HE21 GLN 51 1HE2 GLN 51 4.950 -17.575 -1.167 351 HE22 GLN 51 2HE2 GLN 51 6.667 -17.520 -1.342 352 H SER 52 H SER 52 6.905 -15.236 3.134 353 HA SER 52 HA SER 52 6.745 -13.447 5.395 354 HB2 SER 52 1HB SER 52 9.220 -14.048 5.601 355 HB3 SER 52 2HB SER 52 8.075 -15.380 5.756 356 HG SER 52 HG SER 52 9.891 -15.805 4.348 357 H ILE 53 H ILE 53 7.478 -11.405 5.527 358 HA ILE 53 HA ILE 53 8.898 -10.306 3.191 359 HB ILE 53 HB ILE 53 7.732 -8.094 4.023 360 HG12 ILE 53 1HG1 ILE 53 5.526 -10.025 4.657 361 HG13 ILE 53 2HG1 ILE 53 6.662 -9.551 5.915 362 HG21 ILE 53 1HG2 ILE 53 5.649 -9.283 2.587 363 HG22 ILE 53 2HG2 ILE 53 6.993 -8.341 1.944 364 HG23 ILE 53 3HG2 ILE 53 7.120 -10.097 2.054 365 HD11 ILE 53 3HD1 ILE 53 6.073 -7.151 5.297 366 HD12 ILE 53 1HD1 ILE 53 4.712 -7.845 4.417 367 HD13 ILE 53 2HD1 ILE 53 4.858 -8.097 6.157 368 H SER 54 H SER 54 10.450 -8.707 3.577 369 HA SER 54 HA SER 54 11.181 -8.264 6.391 370 HB2 SER 54 1HB SER 54 13.520 -8.631 5.907 371 HB3 SER 54 2HB SER 54 12.614 -10.044 5.366 372 HG SER 54 HG SER 54 13.755 -7.976 3.820 373 H ARG 55 H ARG 55 11.454 -7.207 3.037 374 HA ARG 55 HA ARG 55 11.766 -4.450 4.011 375 HB2 ARG 55 1HB ARG 55 13.273 -3.987 2.098 376 HB3 ARG 55 2HB ARG 55 13.949 -5.146 3.236 377 HG2 ARG 55 1HG ARG 55 12.980 -6.928 1.637 378 HG3 ARG 55 2HG ARG 55 12.908 -5.603 0.473 379 HD2 ARG 55 1HD ARG 55 15.402 -5.248 1.322 380 HD3 ARG 55 2HD ARG 55 15.257 -6.971 1.666 381 HE ARG 55 HE ARG 55 14.342 -6.589 -0.922 382 HH11 ARG 55 1HH1 ARG 55 17.310 -6.181 0.852 383 HH12 ARG 55 2HH1 ARG 55 18.325 -6.468 -0.523 384 HH21 ARG 55 1HH2 ARG 55 15.668 -6.967 -2.740 385 HH22 ARG 55 2HH2 ARG 55 17.389 -6.913 -2.566 386 H VAL 56 H VAL 56 10.352 -3.055 3.168 387 HA VAL 56 HA VAL 56 9.079 -3.678 0.600 388 HB VAL 56 HB VAL 56 6.895 -2.819 1.625 389 HG11 VAL 56 1HG1 VAL 56 7.954 -5.359 1.329 390 HG12 VAL 56 2HG1 VAL 56 7.285 -5.363 2.962 391 HG13 VAL 56 3HG1 VAL 56 6.257 -4.954 1.587 392 HG21 VAL 56 3HG2 VAL 56 8.398 -3.515 4.145 393 HG22 VAL 56 1HG2 VAL 56 7.757 -1.934 3.693 394 HG23 VAL 56 2HG2 VAL 56 6.655 -3.263 4.052 395 H LYS 57 H LYS 57 9.292 -2.001 -0.711 396 HA LYS 57 HA LYS 57 9.394 0.701 0.461 397 HB2 LYS 57 1HB LYS 57 10.679 -0.122 -2.141 398 HB3 LYS 57 2HB LYS 57 10.922 1.372 -1.246 399 HG2 LYS 57 1HG LYS 57 12.709 0.432 -0.338 400 HG3 LYS 57 2HG LYS 57 11.619 -0.644 0.539 401 HD2 LYS 57 1HD LYS 57 11.687 -1.961 -1.767 402 HD3 LYS 57 2HD LYS 57 13.250 -1.149 -1.892 403 HE2 LYS 57 1HE LYS 57 13.722 -2.025 0.444 404 HE3 LYS 57 2HE LYS 57 12.299 -3.046 0.241 405 HZ1 LYS 57 3HZ LYS 57 14.648 -3.929 -0.387 406 HZ2 LYS 57 1HZ LYS 57 14.386 -3.077 -1.825 407 HZ3 LYS 57 2HZ LYS 57 13.317 -4.303 -1.362 408 H LEU 58 H LEU 58 8.026 2.209 -0.309 409 HA LEU 58 HA LEU 58 6.548 1.642 -2.781 410 HB2 LEU 58 1HB LEU 58 4.452 2.121 -1.814 411 HB3 LEU 58 2HB LEU 58 5.241 0.960 -0.746 412 HG LEU 58 HG LEU 58 5.664 3.755 0.020 413 HD11 LEU 58 1HD1 LEU 58 3.206 3.513 1.074 414 HD12 LEU 58 2HD1 LEU 58 2.946 2.730 -0.485 415 HD13 LEU 58 3HD1 LEU 58 3.545 4.387 -0.420 416 HD21 LEU 58 3HD2 LEU 58 5.696 1.202 1.180 417 HD22 LEU 58 1HD2 LEU 58 4.372 2.075 1.953 418 HD23 LEU 58 2HD2 LEU 58 6.000 2.751 1.970 419 H ASN 59 H ASN 59 5.866 3.449 -3.933 420 HA ASN 59 HA ASN 59 7.243 5.923 -3.210 421 HB2 ASN 59 1HB ASN 59 6.353 4.663 -5.727 422 HB3 ASN 59 2HB ASN 59 6.171 6.414 -5.664 423 HD21 ASN 59 1HD2 ASN 59 7.849 7.540 -6.308 424 HD22 ASN 59 2HD2 ASN 59 9.491 7.007 -6.324 425 H TRP 60 H TRP 60 6.165 7.979 -3.390 426 HA TRP 60 HA TRP 60 3.250 7.821 -2.999 427 HB2 TRP 60 1HB TRP 60 5.288 9.397 -1.431 428 HB3 TRP 60 2HB TRP 60 3.575 9.807 -1.421 429 HD1 TRP 60 HD TRP 60 6.042 7.698 0.337 430 HE1 TRP 60 1HE TRP 60 4.859 6.047 1.918 431 HE3 TRP 60 3HE TRP 60 1.255 8.220 -1.380 432 HZ2 TRP 60 2HZ TRP 60 2.243 5.092 2.376 433 HZ3 TRP 60 3HZ TRP 60 -0.530 6.901 -0.316 434 HH2 TRP 60 HH TRP 60 -0.043 5.370 1.523 435 H GLU 61 H GLU 61 5.638 8.921 -4.945 436 HA GLU 61 HA GLU 61 5.862 10.591 -6.485 437 HB2 GLU 61 1HB GLU 61 3.462 9.350 -6.858 438 HB3 GLU 61 2HB GLU 61 2.960 11.029 -6.721 439 HG2 GLU 61 1HG GLU 61 3.401 11.179 -8.891 440 HG3 GLU 61 2HG GLU 61 5.101 11.182 -8.425 441 H ASP 62 H ASP 62 4.298 12.794 -7.124 442 HA ASP 62 HA ASP 62 5.212 14.756 -5.434 443 HB2 ASP 62 1HB ASP 62 4.390 15.336 -7.613 444 HB3 ASP 62 2HB ASP 62 2.775 14.753 -7.220 445 H ALA 63 H ALA 63 2.111 13.060 -5.312 446 HA ALA 63 HA ALA 63 0.776 14.502 -3.393 447 HB1 ALA 63 1HB ALA 63 0.806 11.605 -4.103 448 HB2 ALA 63 2HB ALA 63 -0.103 12.141 -2.688 449 HB3 ALA 63 3HB ALA 63 -0.483 12.797 -4.280 450 H TYR 64 H TYR 64 1.803 15.316 -1.651 451 HA TYR 64 HA TYR 64 3.370 13.482 0.028 452 HB2 TYR 64 1HB TYR 64 4.500 15.376 0.911 453 HB3 TYR 64 2HB TYR 64 4.415 15.630 -0.827 454 HD1 TYR 64 1HD TYR 64 3.126 16.718 2.438 455 HD2 TYR 64 2HD TYR 64 3.098 17.421 -1.758 456 HE1 TYR 64 1HE TYR 64 2.071 18.906 2.818 457 HE2 TYR 64 2HE TYR 64 2.043 19.611 -1.390 458 HH TYR 64 HH TYR 64 2.046 21.223 1.318 459 H ALA 65 H ALA 65 2.737 12.979 2.044 460 HA ALA 65 HA ALA 65 0.333 14.325 3.091 461 HB1 ALA 65 1HB ALA 65 -0.382 12.269 4.060 462 HB2 ALA 65 2HB ALA 65 0.017 11.948 2.372 463 HB3 ALA 65 3HB ALA 65 1.139 11.478 3.648 464 H THR 66 H THR 66 0.133 13.931 5.554 465 HA THR 66 HA THR 66 2.422 15.123 6.778 466 HB THR 66 HB THR 66 0.959 14.542 8.921 467 HG1 THR 66 1HG THR 66 -1.215 14.334 8.388 468 HG21 THR 66 3HG2 THR 66 0.537 16.736 8.861 469 HG22 THR 66 1HG2 THR 66 -0.468 16.575 7.421 470 HG23 THR 66 2HG2 THR 66 1.280 16.747 7.263 471 H ALA 67 H ALA 67 1.461 11.913 6.207 472 HA ALA 67 HA ALA 67 3.758 10.708 7.095 473 HB1 ALA 67 1HB ALA 67 3.581 11.030 9.328 474 HB2 ALA 67 2HB ALA 67 1.823 11.173 9.281 475 HB3 ALA 67 3HB ALA 67 2.580 9.581 9.215 476 H TYR 68 H TYR 68 3.477 8.283 7.457 477 HA TYR 68 HA TYR 68 1.033 7.241 6.228 478 HB2 TYR 68 1HB TYR 68 3.827 6.641 5.235 479 HB3 TYR 68 2HB TYR 68 2.370 5.808 4.705 480 HD1 TYR 68 1HD TYR 68 0.430 7.627 4.010 481 HD2 TYR 68 2HD TYR 68 4.639 8.192 3.746 482 HE1 TYR 68 1HE TYR 68 0.086 9.329 2.268 483 HE2 TYR 68 2HE TYR 68 4.307 9.896 2.004 484 HH TYR 68 HH TYR 68 2.833 10.893 0.660 485 H SER 69 H SER 69 0.960 4.819 6.345 486 HA SER 69 HA SER 69 2.558 3.692 8.519 487 HB2 SER 69 1HB SER 69 -0.407 4.103 8.549 488 HB3 SER 69 2HB SER 69 0.264 2.672 9.332 489 HG SER 69 HG SER 69 1.462 5.125 9.892 490 H ILE 70 H ILE 70 2.913 1.518 8.357 491 HA ILE 70 HA ILE 70 1.697 0.167 6.034 492 HB ILE 70 HB ILE 70 4.322 0.734 6.234 493 HG12 ILE 70 1HG1 ILE 70 3.080 -1.747 5.029 494 HG13 ILE 70 2HG1 ILE 70 3.240 -0.173 4.258 495 HG21 ILE 70 1HG2 ILE 70 5.583 -1.146 7.000 496 HG22 ILE 70 2HG2 ILE 70 4.488 -0.663 8.295 497 HG23 ILE 70 3HG2 ILE 70 4.113 -2.074 7.304 498 HD11 ILE 70 3HD1 ILE 70 5.509 -1.976 5.066 499 HD12 ILE 70 1HD1 ILE 70 4.894 -1.746 3.429 500 HD13 ILE 70 2HD1 ILE 70 5.664 -0.405 4.279 501 H GLN 71 H GLN 71 0.798 -1.796 6.332 502 HA GLN 71 HA GLN 71 1.336 -3.285 8.780 503 HB2 GLN 71 1HB GLN 71 -1.536 -2.966 8.069 504 HB3 GLN 71 2HB GLN 71 -0.793 -3.249 9.637 505 HG2 GLN 71 1HG GLN 71 -1.555 -1.097 9.855 506 HG3 GLN 71 2HG GLN 71 0.116 -0.838 9.357 507 HE21 GLN 71 1HE2 GLN 71 -3.109 -1.272 7.946 508 HE22 GLN 71 2HE2 GLN 71 -2.913 -0.087 6.704 509 H VAL 72 H VAL 72 -0.166 -5.366 8.702 510 HA VAL 72 HA VAL 72 -0.562 -6.347 5.996 511 HB VAL 72 HB VAL 72 0.848 -8.309 6.266 512 HG11 VAL 72 1HG1 VAL 72 1.821 -6.342 5.207 513 HG12 VAL 72 2HG1 VAL 72 2.362 -5.751 6.779 514 HG13 VAL 72 3HG1 VAL 72 3.043 -7.235 6.112 515 HG21 VAL 72 3HG2 VAL 72 0.646 -8.185 8.838 516 HG22 VAL 72 1HG2 VAL 72 2.149 -8.780 8.133 517 HG23 VAL 72 2HG2 VAL 72 2.054 -7.127 8.740 518 H SER 73 H SER 73 -0.745 -9.061 6.597 519 HA SER 73 HA SER 73 -2.836 -9.163 8.666 520 HB2 SER 73 1HB SER 73 -4.403 -9.700 7.159 521 HB3 SER 73 2HB SER 73 -3.227 -9.424 5.874 522 HG SER 73 HG SER 73 -3.835 -11.499 5.611 523 H ASN 74 H ASN 74 -2.201 -10.514 10.201 524 HA ASN 74 HA ASN 74 -1.643 -13.216 9.785 525 HB2 ASN 74 1HB ASN 74 0.701 -13.417 10.077 526 HB3 ASN 74 2HB ASN 74 0.487 -12.175 8.847 527 HD21 ASN 74 1HD2 ASN 74 1.434 -10.276 9.143 528 HD22 ASN 74 2HD2 ASN 74 2.160 -9.737 10.614 529 H ASP 75 H ASP 75 -0.865 -14.306 11.799 530 HA ASP 75 HA ASP 75 -0.680 -12.939 14.255 531 HB2 ASP 75 1HB ASP 75 -3.180 -12.681 13.539 532 HB3 ASP 75 2HB ASP 75 -3.312 -14.362 14.047 533 H SER 76 H SER 76 -1.796 -15.912 12.685 534 HA SER 76 HA SER 76 -0.441 -17.462 14.789 535 HB2 SER 76 1HB SER 76 -2.693 -18.155 14.743 536 HB3 SER 76 2HB SER 76 -2.763 -18.108 12.982 537 HG SER 76 HG SER 76 -1.478 -19.999 14.645 538 H GLY 77 H GLY 77 -0.001 -16.342 11.714 539 HA2 GLY 77 2HA GLY 77 1.854 -16.783 10.356 540 HA3 GLY 77 3HA GLY 77 2.108 -18.287 11.229 541 H SER 78 H SER 78 -0.322 -19.530 10.954 542 HA SER 78 HA SER 78 -0.328 -20.093 8.076 543 HB2 SER 78 1HB SER 78 -0.756 -21.710 10.514 544 HB3 SER 78 2HB SER 78 -1.805 -22.102 9.151 545 HG SER 78 HG SER 78 0.960 -22.358 9.409 546 H THR 79 H THR 79 -2.291 -18.890 10.650 547 HA THR 79 HA THR 79 -4.575 -18.700 8.796 548 HB THR 79 HB THR 79 -4.837 -18.838 11.799 549 HG1 THR 79 1HG THR 79 -4.193 -20.860 11.372 550 HG21 THR 79 3HG2 THR 79 -6.919 -18.195 11.301 551 HG22 THR 79 1HG2 THR 79 -7.137 -19.785 10.571 552 HG23 THR 79 2HG2 THR 79 -6.651 -18.415 9.572 553 HA PRO 80 HA PRO 80 -3.182 -14.434 10.000 554 HB2 PRO 80 1HB PRO 80 -3.335 -13.422 7.486 555 HB3 PRO 80 2HB PRO 80 -1.896 -14.239 8.107 556 HG2 PRO 80 1HG PRO 80 -4.075 -15.310 6.357 557 HG3 PRO 80 2HG PRO 80 -2.322 -15.541 6.227 558 HD2 PRO 80 1HD PRO 80 -3.962 -17.412 7.295 559 HD3 PRO 80 2HD PRO 80 -2.292 -17.181 7.848 560 H THR 81 H THR 81 -4.455 -12.584 10.179 561 HA THR 81 HA THR 81 -7.050 -12.478 8.893 562 HB THR 81 HB THR 81 -8.240 -12.154 11.085 563 HG1 THR 81 1HG THR 81 -7.217 -12.657 12.947 564 HG21 THR 81 3HG2 THR 81 -8.086 -14.333 9.681 565 HG22 THR 81 1HG2 THR 81 -8.734 -14.413 11.318 566 HG23 THR 81 2HG2 THR 81 -7.073 -14.912 11.003 567 H ASN 82 H ASN 82 -5.719 -11.016 11.855 568 HA ASN 82 HA ASN 82 -5.948 -8.388 10.541 569 HB2 ASN 82 1HB ASN 82 -6.174 -9.008 13.495 570 HB3 ASN 82 2HB ASN 82 -6.369 -7.425 12.747 571 HD21 ASN 82 1HD2 ASN 82 -8.241 -8.914 14.371 572 HD22 ASN 82 2HD2 ASN 82 -9.655 -9.144 13.404 573 H TRP 83 H TRP 83 -4.592 -6.810 12.266 574 HA TRP 83 HA TRP 83 -2.135 -7.752 13.213 575 HB2 TRP 83 1HB TRP 83 -1.918 -8.112 10.659 576 HB3 TRP 83 2HB TRP 83 -1.756 -6.360 10.574 577 HD1 TRP 83 HD TRP 83 0.728 -5.869 10.211 578 HE1 TRP 83 1HE TRP 83 2.937 -6.655 11.271 579 HE3 TRP 83 3HE TRP 83 -1.116 -9.421 13.392 580 HZ2 TRP 83 2HZ TRP 83 3.786 -8.533 13.201 581 HZ3 TRP 83 3HZ TRP 83 0.461 -10.668 14.810 582 HH2 TRP 83 HH TRP 83 2.862 -10.231 14.714 583 H THR 84 H THR 84 -0.519 -5.894 13.479 584 HA THR 84 HA THR 84 -2.024 -3.404 13.956 585 HB THR 84 HB THR 84 -1.323 -4.536 16.039 586 HG1 THR 84 1HG THR 84 -1.221 -2.529 16.684 587 HG21 THR 84 3HG2 THR 84 0.721 -5.598 15.146 588 HG22 THR 84 1HG2 THR 84 1.027 -4.694 16.628 589 HG23 THR 84 2HG2 THR 84 1.489 -4.014 15.069 590 H THR 85 H THR 85 -1.016 -1.430 13.539 591 HA THR 85 HA THR 85 0.452 -1.119 11.277 592 HB THR 85 HB THR 85 1.272 1.079 12.272 593 HG1 THR 85 1HG THR 85 1.266 0.601 14.453 594 HG21 THR 85 3HG2 THR 85 -1.692 0.556 12.504 595 HG22 THR 85 1HG2 THR 85 -0.844 0.795 10.977 596 HG23 THR 85 2HG2 THR 85 -0.905 2.096 12.165 597 H VAL 86 H VAL 86 2.644 -0.698 10.779 598 HA VAL 86 HA VAL 86 4.554 -1.828 12.722 599 HB VAL 86 HB VAL 86 5.040 -1.865 9.762 600 HG11 VAL 86 1HG1 VAL 86 6.792 -2.344 11.591 601 HG12 VAL 86 2HG1 VAL 86 5.938 -3.873 11.796 602 HG13 VAL 86 3HG1 VAL 86 6.659 -3.466 10.238 603 HG21 VAL 86 3HG2 VAL 86 3.123 -3.499 11.283 604 HG22 VAL 86 1HG2 VAL 86 3.200 -3.149 9.556 605 HG23 VAL 86 2HG2 VAL 86 4.231 -4.401 10.249 606 H TYR 87 H TYR 87 3.691 0.865 10.836 607 HA TYR 87 HA TYR 87 6.104 2.261 11.689 608 HB2 TYR 87 1HB TYR 87 6.110 1.291 9.179 609 HB3 TYR 87 2HB TYR 87 5.282 2.817 8.892 610 HD1 TYR 87 2HD TYR 87 8.271 1.578 10.775 611 HD2 TYR 87 1HD TYR 87 6.603 4.602 8.289 612 HE1 TYR 87 2HE TYR 87 10.438 2.743 10.746 613 HE2 TYR 87 1HE TYR 87 8.765 5.773 8.252 614 HH TYR 87 HH TYR 87 11.503 4.598 8.799 615 H SER 88 H SER 88 5.784 4.396 12.134 616 HA SER 88 HA SER 88 3.827 6.079 11.137 617 HB2 SER 88 1HB SER 88 2.290 6.085 13.214 618 HB3 SER 88 2HB SER 88 2.062 4.802 12.025 619 HG SER 88 HG SER 88 3.609 4.567 14.394 620 H THR 89 H THR 89 4.472 8.064 11.644 621 HA THR 89 HA THR 89 5.736 8.538 14.252 622 HB THR 89 HB THR 89 7.516 8.247 12.540 623 HG1 THR 89 1HG THR 89 8.042 9.584 14.235 624 HG21 THR 89 3HG2 THR 89 6.129 9.213 10.664 625 HG22 THR 89 1HG2 THR 89 7.794 9.784 10.747 626 HG23 THR 89 2HG2 THR 89 6.481 10.807 11.331 627 H THR 90 H THR 90 4.001 9.767 11.478 628 HA THR 90 HA THR 90 2.515 11.489 11.284 629 HB THR 90 HB THR 90 2.884 12.470 14.063 630 HG1 THR 90 1HG THR 90 1.398 10.099 13.621 631 HG21 THR 90 3HG2 THR 90 0.861 12.450 11.991 632 HG22 THR 90 1HG2 THR 90 0.995 13.474 13.419 633 HG23 THR 90 2HG2 THR 90 0.212 11.897 13.535 634 H THR 91 H THR 91 5.103 11.895 10.489 635 HA THR 91 HA THR 91 5.723 14.630 11.387 636 HB THR 91 HB THR 91 7.972 14.258 10.378 637 HG1 THR 91 1HG THR 91 8.525 12.207 9.690 638 HG21 THR 91 3HG2 THR 91 7.808 11.994 12.229 639 HG22 THR 91 1HG2 THR 91 7.035 13.463 12.823 640 HG23 THR 91 2HG2 THR 91 8.734 13.490 12.349 641 H GLY 92 H GLY 92 6.292 12.763 8.398 642 HA2 GLY 92 2HA GLY 92 4.614 13.904 6.628 643 HA3 GLY 92 3HA GLY 92 5.846 15.145 6.810 644 H ASP 93 H ASP 93 7.117 15.108 5.083 645 HA ASP 93 HA ASP 93 8.606 14.375 3.524 646 HB2 ASP 93 1HB ASP 93 9.424 13.046 5.593 647 HB3 ASP 93 2HB ASP 93 8.641 11.666 4.827 648 H GLY 94 H GLY 94 6.998 14.494 1.907 649 HA2 GLY 94 2HA GLY 94 5.248 12.317 1.331 650 HA3 GLY 94 3HA GLY 94 5.574 13.692 0.286 651 H ALA 95 H ALA 95 8.544 12.652 0.875 652 HA ALA 95 HA ALA 95 8.933 11.517 -1.668 653 HB1 ALA 95 1HB ALA 95 10.581 12.591 0.158 654 HB2 ALA 95 2HB ALA 95 10.917 10.880 0.423 655 HB3 ALA 95 3HB ALA 95 11.138 11.584 -1.178 656 H ILE 96 H ILE 96 9.961 9.339 -2.023 657 HA ILE 96 HA ILE 96 8.234 7.280 -1.549 658 HB ILE 96 HB ILE 96 11.225 6.931 -1.772 659 HG12 ILE 96 1HG1 ILE 96 10.166 6.534 -4.282 660 HG13 ILE 96 2HG1 ILE 96 9.219 7.892 -3.684 661 HG21 ILE 96 1HG2 ILE 96 9.036 5.096 -2.718 662 HG22 ILE 96 2HG2 ILE 96 10.765 4.764 -2.617 663 HG23 ILE 96 3HG2 ILE 96 9.814 4.943 -1.143 664 HD11 ILE 96 3HD1 ILE 96 11.868 8.480 -3.029 665 HD12 ILE 96 1HD1 ILE 96 11.909 7.833 -4.670 666 HD13 ILE 96 2HD1 ILE 96 10.881 9.216 -4.292 667 H ASP 97 H ASP 97 7.828 5.837 0.034 668 HA ASP 97 HA ASP 97 9.300 6.179 2.554 669 HB2 ASP 97 1HB ASP 97 6.782 6.553 2.458 670 HB3 ASP 97 2HB ASP 97 6.630 4.815 2.213 671 H ASP 98 H ASP 98 10.698 4.658 3.108 672 HA ASP 98 HA ASP 98 10.357 1.955 1.987 673 HB2 ASP 98 1HB ASP 98 12.403 2.798 1.171 674 HB3 ASP 98 2HB ASP 98 12.819 3.525 2.720 675 H ILE 99 H ILE 99 9.588 0.550 3.408 676 HA ILE 99 HA ILE 99 10.402 0.815 6.229 677 HB ILE 99 HB ILE 99 7.794 -0.075 5.032 678 HG12 ILE 99 1HG1 ILE 99 7.866 1.578 7.460 679 HG13 ILE 99 2HG1 ILE 99 8.636 2.325 6.064 680 HG21 ILE 99 1HG2 ILE 99 7.368 -0.518 7.639 681 HG22 ILE 99 2HG2 ILE 99 7.876 -1.778 6.517 682 HG23 ILE 99 3HG2 ILE 99 9.068 -0.976 7.540 683 HD11 ILE 99 3HD1 ILE 99 6.615 2.996 5.460 684 HD12 ILE 99 1HD1 ILE 99 6.263 1.313 5.067 685 HD13 ILE 99 2HD1 ILE 99 5.836 1.956 6.653 686 H THR 100 H THR 100 11.391 -0.868 7.162 687 HA THR 100 HA THR 100 11.196 -3.519 5.929 688 HB THR 100 HB THR 100 13.553 -3.889 5.905 689 HG1 THR 100 1HG THR 100 14.930 -1.991 6.512 690 HG21 THR 100 3HG2 THR 100 13.497 -1.124 4.798 691 HG22 THR 100 1HG2 THR 100 12.389 -2.319 4.125 692 HG23 THR 100 2HG2 THR 100 14.127 -2.610 4.088 693 H PHE 101 H PHE 101 11.016 -5.116 7.380 694 HA PHE 101 HA PHE 101 11.972 -4.702 10.111 695 HB2 PHE 101 1HB PHE 101 9.126 -5.287 9.321 696 HB3 PHE 101 2HB PHE 101 9.751 -5.729 10.907 697 HD1 PHE 101 2HD PHE 101 8.896 -2.943 8.681 698 HD2 PHE 101 1HD PHE 101 10.196 -4.071 12.574 699 HE1 PHE 101 2HE PHE 101 8.432 -0.667 9.491 700 HE2 PHE 101 1HE PHE 101 9.732 -1.797 13.391 701 HZ PHE 101 HZ PHE 101 8.851 -0.091 11.849 702 H ALA 102 H ALA 102 11.187 -6.916 11.352 703 HA ALA 102 HA ALA 102 12.858 -8.921 10.337 704 HB1 ALA 102 1HB ALA 102 11.758 -8.476 12.733 705 HB2 ALA 102 2HB ALA 102 10.681 -9.748 12.159 706 HB3 ALA 102 3HB ALA 102 12.418 -10.040 12.255 707 H ALA 103 H ALA 103 12.274 -11.102 9.672 708 HA ALA 103 HA ALA 103 10.525 -11.136 7.480 709 HB1 ALA 103 1HB ALA 103 11.335 -13.206 7.074 710 HB2 ALA 103 2HB ALA 103 12.527 -12.731 8.285 711 HB3 ALA 103 3HB ALA 103 11.148 -13.728 8.748 712 H THR 104 H THR 104 8.395 -10.837 7.685 713 HA THR 104 HA THR 104 6.958 -12.466 9.679 714 HB THR 104 HB THR 104 5.175 -10.596 9.480 715 HG1 THR 104 1HG THR 104 5.756 -8.862 8.422 716 HG21 THR 104 3HG2 THR 104 7.380 -11.001 11.202 717 HG22 THR 104 1HG2 THR 104 5.862 -10.177 11.557 718 HG23 THR 104 2HG2 THR 104 7.239 -9.263 10.942 719 H ASN 105 H ASN 105 5.349 -13.726 8.951 720 HA ASN 105 HA ASN 105 4.905 -13.873 6.099 721 HB2 ASN 105 1HB ASN 105 3.346 -15.793 6.842 722 HB3 ASN 105 2HB ASN 105 5.079 -15.992 7.089 723 HD21 ASN 105 1HD2 ASN 105 4.695 -17.512 8.715 724 HD22 ASN 105 2HD2 ASN 105 4.167 -17.040 10.291 725 H ALA 106 H ALA 106 3.143 -13.219 5.003 726 HA ALA 106 HA ALA 106 0.656 -12.627 6.345 727 HB1 ALA 106 1HB ALA 106 1.089 -10.477 6.726 728 HB2 ALA 106 2HB ALA 106 2.568 -10.526 5.763 729 HB3 ALA 106 3HB ALA 106 1.013 -10.249 4.978 730 H LYS 107 H LYS 107 -1.067 -12.079 4.842 731 HA LYS 107 HA LYS 107 -0.635 -13.359 2.253 732 HB2 LYS 107 1HB LYS 107 -3.221 -12.475 3.545 733 HB3 LYS 107 2HB LYS 107 -3.062 -13.471 2.104 734 HG2 LYS 107 1HG LYS 107 -1.731 -14.456 4.552 735 HG3 LYS 107 2HG LYS 107 -3.496 -14.478 4.533 736 HD2 LYS 107 1HD LYS 107 -2.354 -15.468 2.052 737 HD3 LYS 107 2HD LYS 107 -1.814 -16.395 3.454 738 HE2 LYS 107 1HE LYS 107 -4.665 -15.784 3.501 739 HE3 LYS 107 2HE LYS 107 -4.184 -16.743 2.103 740 HZ1 LYS 107 3HZ LYS 107 -4.181 -17.448 4.929 741 HZ2 LYS 107 1HZ LYS 107 -2.896 -18.043 4.004 742 HZ3 LYS 107 2HZ LYS 107 -4.490 -18.411 3.573 743 H PHE 108 H PHE 108 -1.785 -10.312 3.627 744 HA PHE 108 HA PHE 108 -1.205 -9.006 1.079 745 HB2 PHE 108 1HB PHE 108 -3.456 -7.651 1.794 746 HB3 PHE 108 2HB PHE 108 -3.417 -8.956 0.613 747 HD1 PHE 108 1HD PHE 108 -4.299 -8.032 4.046 748 HD2 PHE 108 2HD PHE 108 -4.337 -11.115 1.111 749 HE1 PHE 108 1HE PHE 108 -5.881 -9.319 5.423 750 HE2 PHE 108 2HE PHE 108 -5.919 -12.406 2.483 751 HZ PHE 108 HZ PHE 108 -6.694 -11.509 4.642 752 H VAL 109 H VAL 109 -0.924 -6.700 1.257 753 HA VAL 109 HA VAL 109 -0.142 -5.889 3.978 754 HB VAL 109 HB VAL 109 1.672 -5.997 2.251 755 HG11 VAL 109 1HG1 VAL 109 1.737 -4.610 0.405 756 HG12 VAL 109 2HG1 VAL 109 0.030 -5.053 0.467 757 HG13 VAL 109 3HG1 VAL 109 0.558 -3.484 1.078 758 HG21 VAL 109 3HG2 VAL 109 2.023 -4.648 4.189 759 HG22 VAL 109 1HG2 VAL 109 2.584 -3.728 2.793 760 HG23 VAL 109 2HG2 VAL 109 1.030 -3.346 3.533 761 H ARG 110 H ARG 110 -0.700 -3.858 4.756 762 HA ARG 110 HA ARG 110 -2.701 -2.385 3.171 763 HB2 ARG 110 1HB ARG 110 -3.658 -3.721 5.088 764 HB3 ARG 110 2HB ARG 110 -2.746 -2.681 6.176 765 HG2 ARG 110 1HG ARG 110 -3.956 -0.729 5.161 766 HG3 ARG 110 2HG ARG 110 -4.983 -1.897 4.327 767 HD2 ARG 110 1HD ARG 110 -4.738 -2.485 7.155 768 HD3 ARG 110 2HD ARG 110 -5.369 -0.863 6.871 769 HE ARG 110 HE ARG 110 -6.649 -2.913 5.306 770 HH11 ARG 110 1HH1 ARG 110 -6.633 -1.196 8.335 771 HH12 ARG 110 2HH1 ARG 110 -8.304 -1.508 8.670 772 HH21 ARG 110 1HH2 ARG 110 -8.850 -3.332 5.736 773 HH22 ARG 110 2HH2 ARG 110 -9.564 -2.724 7.192 774 H VAL 111 H VAL 111 -2.386 -0.252 2.969 775 HA VAL 111 HA VAL 111 -0.379 1.024 4.710 776 HB VAL 111 HB VAL 111 -0.771 1.847 1.848 777 HG11 VAL 111 1HG1 VAL 111 0.386 3.360 3.433 778 HG12 VAL 111 2HG1 VAL 111 1.596 2.103 3.700 779 HG13 VAL 111 3HG1 VAL 111 1.412 2.829 2.101 780 HG21 VAL 111 3HG2 VAL 111 -0.066 -0.245 1.322 781 HG22 VAL 111 1HG2 VAL 111 1.509 0.464 1.679 782 HG23 VAL 111 2HG2 VAL 111 0.684 -0.508 2.897 783 H TYR 112 H TYR 112 -1.339 2.502 5.928 784 HA TYR 112 HA TYR 112 -3.514 4.103 4.745 785 HB2 TYR 112 1HB TYR 112 -4.494 2.764 6.450 786 HB3 TYR 112 2HB TYR 112 -3.167 3.082 7.562 787 HD1 TYR 112 1HD TYR 112 -5.518 5.183 5.542 788 HD2 TYR 112 2HD TYR 112 -3.773 4.402 9.343 789 HE1 TYR 112 1HE TYR 112 -6.782 7.062 6.501 790 HE2 TYR 112 2HE TYR 112 -5.033 6.279 10.313 791 HH TYR 112 HH TYR 112 -6.567 7.846 9.957 792 H ALA 113 H ALA 113 -3.443 6.291 4.965 793 HA ALA 113 HA ALA 113 -0.939 7.400 6.009 794 HB1 ALA 113 1HB ALA 113 -2.207 7.843 3.642 795 HB2 ALA 113 2HB ALA 113 -2.761 9.215 4.603 796 HB3 ALA 113 3HB ALA 113 -1.034 8.937 4.378 797 H THR 114 H THR 114 -1.700 10.015 6.438 798 HA THR 114 HA THR 114 -3.546 9.770 8.725 799 HB THR 114 HB THR 114 -1.514 10.198 9.760 800 HG1 THR 114 1HG THR 114 -2.978 11.799 10.413 801 HG21 THR 114 3HG2 THR 114 -0.893 11.747 7.291 802 HG22 THR 114 1HG2 THR 114 0.072 10.535 8.133 803 HG23 THR 114 2HG2 THR 114 -0.056 12.170 8.784 804 H THR 115 H THR 115 -2.453 11.765 6.048 805 HA THR 115 HA THR 115 -4.994 13.213 6.152 806 HB THR 115 HB THR 115 -3.008 14.511 7.251 807 HG1 THR 115 1HG THR 115 -4.289 16.172 6.917 808 HG21 THR 115 3HG2 THR 115 -1.430 15.472 5.916 809 HG22 THR 115 1HG2 THR 115 -2.492 15.524 4.510 810 HG23 THR 115 2HG2 THR 115 -1.714 14.010 4.972 811 H ARG 116 H ARG 116 -4.906 14.837 4.106 812 HA ARG 116 HA ARG 116 -4.914 13.133 1.839 813 HB2 ARG 116 1HB ARG 116 -5.674 15.015 0.608 814 HB3 ARG 116 2HB ARG 116 -6.386 15.155 2.210 815 HG2 ARG 116 1HG ARG 116 -4.295 16.640 2.693 816 HG3 ARG 116 2HG ARG 116 -4.249 16.791 0.935 817 HD2 ARG 116 1HD ARG 116 -5.678 18.491 1.248 818 HD3 ARG 116 2HD ARG 116 -6.887 17.224 1.456 819 HE ARG 116 HE ARG 116 -6.984 17.723 3.694 820 HH11 ARG 116 1HH1 ARG 116 -4.190 19.249 2.287 821 HH12 ARG 116 2HH1 ARG 116 -3.834 20.192 3.696 822 HH21 ARG 116 1HH2 ARG 116 -6.526 18.958 5.555 823 HH22 ARG 116 2HH2 ARG 116 -5.163 20.025 5.554 824 H ALA 117 H ALA 117 -3.894 14.579 -0.240 825 HA ALA 117 HA ALA 117 -1.003 14.413 0.277 826 HB1 ALA 117 1HB ALA 117 -2.669 13.912 -2.159 827 HB2 ALA 117 2HB ALA 117 -0.950 14.278 -2.306 828 HB3 ALA 117 3HB ALA 117 -1.475 12.867 -1.386 829 H THR 118 H THR 118 -2.759 16.041 -2.331 830 HA THR 118 HA THR 118 -2.174 18.674 -1.372 831 HB THR 118 HB THR 118 -0.797 18.191 -3.958 832 HG1 THR 118 1HG THR 118 0.953 17.258 -3.044 833 HG21 THR 118 3HG2 THR 118 0.772 19.856 -2.951 834 HG22 THR 118 1HG2 THR 118 -0.274 19.910 -1.533 835 HG23 THR 118 2HG2 THR 118 -0.887 20.433 -3.103 836 H ALA 119 H ALA 119 -3.054 16.599 -4.082 837 HA ALA 119 HA ALA 119 -5.480 17.858 -4.600 838 HB1 ALA 119 1HB ALA 119 -3.370 19.428 -5.514 839 HB2 ALA 119 2HB ALA 119 -4.009 18.637 -6.955 840 HB3 ALA 119 3HB ALA 119 -5.077 19.593 -5.928 841 H TYR 120 H TYR 120 -2.779 15.989 -5.755 842 HA TYR 120 HA TYR 120 -4.413 14.667 -7.780 843 HB2 TYR 120 1HB TYR 120 -1.854 15.380 -7.920 844 HB3 TYR 120 2HB TYR 120 -1.622 13.796 -7.185 845 HD1 TYR 120 2HD TYR 120 -4.064 12.517 -8.600 846 HD2 TYR 120 1HD TYR 120 -0.788 14.842 -10.001 847 HE1 TYR 120 2HE TYR 120 -4.266 11.458 -10.811 848 HE2 TYR 120 1HE TYR 120 -0.982 13.791 -12.216 849 HH TYR 120 HH TYR 120 -3.664 11.733 -13.044 850 H GLY 121 H GLY 121 -5.189 14.300 -5.070 851 HA2 GLY 121 2HA GLY 121 -5.618 12.662 -3.503 852 HA3 GLY 121 3HA GLY 121 -5.786 11.646 -4.927 853 H TYR 122 H TYR 122 -4.782 9.792 -4.502 854 HA TYR 122 HA TYR 122 -2.127 9.904 -3.232 855 HB2 TYR 122 1HB TYR 122 -4.337 7.886 -3.134 856 HB3 TYR 122 2HB TYR 122 -2.677 7.361 -2.882 857 HD1 TYR 122 2HD TYR 122 -4.415 10.476 -1.789 858 HD2 TYR 122 1HD TYR 122 -2.488 6.866 -0.621 859 HE1 TYR 122 2HE TYR 122 -4.559 11.167 0.567 860 HE2 TYR 122 1HE TYR 122 -2.628 7.547 1.737 861 HH TYR 122 HH TYR 122 -2.919 10.320 2.837 862 H SER 123 H SER 123 -0.394 8.981 -4.209 863 HA SER 123 HA SER 123 -0.843 7.861 -6.897 864 HB2 SER 123 1HB SER 123 1.721 9.134 -5.940 865 HB3 SER 123 2HB SER 123 1.234 8.785 -7.598 866 HG SER 123 HG SER 123 -0.391 10.477 -6.083 867 H LEU 124 H LEU 124 0.424 6.092 -7.572 868 HA LEU 124 HA LEU 124 2.236 4.798 -5.754 869 HB2 LEU 124 1HB LEU 124 -0.036 4.166 -4.914 870 HB3 LEU 124 2HB LEU 124 -0.319 3.368 -6.460 871 HG LEU 124 HG LEU 124 2.121 2.393 -5.319 872 HD11 LEU 124 1HD1 LEU 124 0.511 3.200 -3.291 873 HD12 LEU 124 2HD1 LEU 124 1.655 1.861 -3.192 874 HD13 LEU 124 3HD1 LEU 124 -0.046 1.544 -3.535 875 HD21 LEU 124 3HD2 LEU 124 0.876 0.245 -5.460 876 HD22 LEU 124 1HD2 LEU 124 0.854 1.180 -6.955 877 HD23 LEU 124 2HD2 LEU 124 -0.565 1.158 -5.908 878 H TRP 125 H TRP 125 3.601 5.085 -7.577 879 HA TRP 125 HA TRP 125 2.975 3.378 -9.888 880 HB2 TRP 125 1HB TRP 125 4.876 5.707 -9.587 881 HB3 TRP 125 2HB TRP 125 4.826 4.674 -11.013 882 HD1 TRP 125 HD TRP 125 1.873 6.260 -9.050 883 HE1 TRP 125 1HE TRP 125 0.451 7.607 -10.720 884 HE3 TRP 125 3HE TRP 125 4.714 5.602 -13.251 885 HZ2 TRP 125 2HZ TRP 125 0.524 8.299 -13.457 886 HZ3 TRP 125 3HZ TRP 125 3.967 6.639 -15.354 887 HH2 TRP 125 HH TRP 125 1.915 7.959 -15.453 888 H GLU 126 H GLU 126 4.951 3.628 -7.132 889 HA GLU 126 HA GLU 126 6.517 1.322 -8.043 890 HB2 GLU 126 1HB GLU 126 7.544 3.960 -7.191 891 HB3 GLU 126 2HB GLU 126 8.359 2.564 -6.502 892 HG2 GLU 126 1HG GLU 126 9.504 2.272 -8.366 893 HG3 GLU 126 2HG GLU 126 8.013 2.133 -9.294 894 H PHE 127 H PHE 127 4.807 0.305 -6.713 895 HA PHE 127 HA PHE 127 5.524 0.386 -3.855 896 HB2 PHE 127 1HB PHE 127 3.300 1.324 -4.164 897 HB3 PHE 127 2HB PHE 127 2.803 -0.090 -5.087 898 HD1 PHE 127 2HD PHE 127 4.921 -0.502 -2.157 899 HD2 PHE 127 1HD PHE 127 0.915 -0.452 -3.591 900 HE1 PHE 127 2HE PHE 127 4.169 -1.587 -0.081 901 HE2 PHE 127 1HE PHE 127 0.155 -1.537 -1.517 902 HZ PHE 127 HZ PHE 127 1.782 -2.106 0.241 903 H GLU 128 H GLU 128 6.827 -1.349 -3.655 904 HA GLU 128 HA GLU 128 5.812 -3.930 -4.651 905 HB2 GLU 128 1HB GLU 128 8.052 -2.931 -5.538 906 HB3 GLU 128 2HB GLU 128 8.698 -3.458 -3.990 907 HG2 GLU 128 1HG GLU 128 8.109 -5.738 -4.461 908 HG3 GLU 128 2HG GLU 128 7.292 -5.259 -5.947 909 H VAL 129 H VAL 129 5.339 -5.437 -3.189 910 HA VAL 129 HA VAL 129 6.444 -5.150 -0.471 911 HB VAL 129 HB VAL 129 4.160 -4.497 -0.297 912 HG11 VAL 129 1HG1 VAL 129 2.624 -6.693 -1.078 913 HG12 VAL 129 2HG1 VAL 129 2.731 -5.125 -1.882 914 HG13 VAL 129 3HG1 VAL 129 3.783 -6.449 -2.385 915 HG21 VAL 129 3HG2 VAL 129 5.215 -6.603 1.103 916 HG22 VAL 129 1HG2 VAL 129 3.724 -5.751 1.505 917 HG23 VAL 129 2HG2 VAL 129 3.662 -7.244 0.567 918 H TYR 130 H TYR 130 7.776 -6.790 -0.101 919 HA TYR 130 HA TYR 130 7.001 -9.459 -0.033 920 HB2 TYR 130 1HB TYR 130 7.453 -8.668 -2.665 921 HB3 TYR 130 2HB TYR 130 8.934 -9.499 -2.206 922 HD1 TYR 130 2HD TYR 130 5.394 -10.159 -1.232 923 HD2 TYR 130 1HD TYR 130 8.864 -11.573 -3.247 924 HE1 TYR 130 2HE TYR 130 4.288 -12.325 -1.604 925 HE2 TYR 130 1HE TYR 130 7.767 -13.741 -3.626 926 HH TYR 130 HH TYR 130 5.646 -14.747 -3.681 927 H GLY 131 H GLY 131 8.815 -10.939 0.414 928 HA2 GLY 131 2HA GLY 131 10.995 -9.460 1.716 929 HA3 GLY 131 3HA GLY 131 10.485 -11.095 2.112 Start of MODEL 7 1 H ASN 1 H ASN 1 -9.623 -13.926 -17.955 2 HA ASN 1 HA ASN 1 -7.570 -13.421 -17.114 3 HB2 ASN 1 1HB ASN 1 -6.914 -13.357 -20.066 4 HB3 ASN 1 2HB ASN 1 -5.706 -13.332 -18.785 5 HD21 ASN 1 1HD2 ASN 1 -6.446 -15.285 -20.961 6 HD22 ASN 1 2HD2 ASN 1 -6.589 -16.799 -20.140 7 H LEU 2 H LEU 2 -8.038 -11.459 -16.141 8 HA LEU 2 HA LEU 2 -6.810 -9.149 -17.409 9 HB2 LEU 2 1HB LEU 2 -8.771 -7.716 -16.814 10 HB3 LEU 2 2HB LEU 2 -9.039 -8.838 -18.147 11 HG LEU 2 HG LEU 2 -9.868 -9.777 -15.472 12 HD11 LEU 2 1HD1 LEU 2 -11.655 -7.842 -16.888 13 HD12 LEU 2 2HD1 LEU 2 -10.483 -7.278 -15.697 14 HD13 LEU 2 3HD1 LEU 2 -11.733 -8.428 -15.226 15 HD21 LEU 2 3HD2 LEU 2 -11.678 -9.786 -17.793 16 HD22 LEU 2 1HD2 LEU 2 -11.268 -11.077 -16.664 17 HD23 LEU 2 2HD2 LEU 2 -10.175 -10.687 -17.993 18 H ALA 3 H ALA 3 -6.240 -10.904 -15.130 19 HA ALA 3 HA ALA 3 -5.421 -8.953 -13.274 20 HB1 ALA 3 1HB ALA 3 -7.373 -8.664 -12.194 21 HB2 ALA 3 2HB ALA 3 -8.051 -10.177 -12.798 22 HB3 ALA 3 3HB ALA 3 -6.954 -10.192 -11.417 23 H LEU 4 H LEU 4 -3.617 -9.751 -12.434 24 HA LEU 4 HA LEU 4 -3.029 -12.563 -12.624 25 HB2 LEU 4 1HB LEU 4 -1.564 -10.118 -12.324 26 HB3 LEU 4 2HB LEU 4 -1.052 -11.271 -11.092 27 HG LEU 4 HG LEU 4 -1.007 -11.709 -14.078 28 HD11 LEU 4 1HD1 LEU 4 0.758 -10.290 -12.526 29 HD12 LEU 4 2HD1 LEU 4 1.122 -11.045 -14.077 30 HD13 LEU 4 3HD1 LEU 4 1.480 -11.898 -12.576 31 HD21 LEU 4 3HD2 LEU 4 0.181 -13.798 -13.503 32 HD22 LEU 4 1HD2 LEU 4 -1.492 -13.784 -12.946 33 HD23 LEU 4 2HD2 LEU 4 -0.180 -13.506 -11.801 34 H ASN 5 H ASN 5 -1.640 -13.327 -10.528 35 HA ASN 5 HA ASN 5 -3.605 -13.811 -8.533 36 HB2 ASN 5 1HB ASN 5 -0.982 -14.796 -9.209 37 HB3 ASN 5 2HB ASN 5 -1.077 -14.485 -7.479 38 HD21 ASN 5 1HD2 ASN 5 -3.464 -15.627 -9.837 39 HD22 ASN 5 2HD2 ASN 5 -3.841 -17.091 -9.000 40 H LYS 6 H LYS 6 -1.522 -11.226 -9.055 41 HA LYS 6 HA LYS 6 -0.677 -10.462 -6.529 42 HB2 LYS 6 1HB LYS 6 -0.800 -9.297 -9.098 43 HB3 LYS 6 2HB LYS 6 -1.549 -8.148 -7.998 44 HG2 LYS 6 1HG LYS 6 0.505 -7.445 -7.538 45 HG3 LYS 6 2HG LYS 6 0.722 -8.954 -6.648 46 HD2 LYS 6 1HD LYS 6 1.382 -9.948 -8.935 47 HD3 LYS 6 2HD LYS 6 1.578 -8.267 -9.440 48 HE2 LYS 6 1HE LYS 6 2.924 -9.454 -7.021 49 HE3 LYS 6 2HE LYS 6 3.668 -9.395 -8.618 50 HZ1 LYS 6 3HZ LYS 6 4.155 -7.249 -8.378 51 HZ2 LYS 6 1HZ LYS 6 3.823 -7.453 -6.731 52 HZ3 LYS 6 2HZ LYS 6 2.624 -6.862 -7.768 53 H ALA 7 H ALA 7 -3.594 -9.235 -8.186 54 HA ALA 7 HA ALA 7 -5.616 -8.550 -7.395 55 HB1 ALA 7 1HB ALA 7 -6.610 -9.794 -5.762 56 HB2 ALA 7 2HB ALA 7 -5.248 -10.848 -6.144 57 HB3 ALA 7 3HB ALA 7 -5.178 -9.794 -4.733 58 H THR 8 H THR 8 -5.958 -6.494 -6.906 59 HA THR 8 HA THR 8 -4.746 -5.386 -4.468 60 HB THR 8 HB THR 8 -3.819 -3.561 -5.485 61 HG1 THR 8 1HG THR 8 -5.536 -3.894 -7.736 62 HG21 THR 8 3HG2 THR 8 -3.744 -5.152 -8.007 63 HG22 THR 8 1HG2 THR 8 -3.028 -5.837 -6.549 64 HG23 THR 8 2HG2 THR 8 -2.445 -4.296 -7.178 65 H ALA 9 H ALA 9 -5.865 -3.581 -3.563 66 HA ALA 9 HA ALA 9 -8.476 -2.914 -4.666 67 HB1 ALA 9 1HB ALA 9 -9.736 -3.541 -2.761 68 HB2 ALA 9 2HB ALA 9 -8.757 -4.942 -3.199 69 HB3 ALA 9 3HB ALA 9 -8.283 -3.924 -1.839 70 H THR 10 H THR 10 -9.206 -0.909 -4.071 71 HA THR 10 HA THR 10 -7.732 0.558 -2.008 72 HB THR 10 HB THR 10 -7.248 2.425 -3.370 73 HG1 THR 10 1HG THR 10 -8.836 2.809 -4.752 74 HG21 THR 10 3HG2 THR 10 -5.586 1.567 -4.666 75 HG22 THR 10 1HG2 THR 10 -6.643 0.380 -5.429 76 HG23 THR 10 2HG2 THR 10 -6.019 0.090 -3.805 77 H SER 11 H SER 11 -8.785 2.825 -1.748 78 HA SER 11 HA SER 11 -11.704 2.434 -1.758 79 HB2 SER 11 1HB SER 11 -11.010 2.578 0.497 80 HB3 SER 11 2HB SER 11 -9.879 3.887 0.152 81 HG SER 11 HG SER 11 -12.310 4.144 1.018 82 H SER 12 H SER 12 -9.120 4.778 -2.302 83 HA SER 12 HA SER 12 -11.069 6.556 -3.607 84 HB2 SER 12 1HB SER 12 -9.407 8.353 -3.282 85 HB3 SER 12 2HB SER 12 -9.868 7.609 -1.750 86 HG SER 12 HG SER 12 -7.464 7.377 -3.191 87 H ILE 13 H ILE 13 -10.784 7.188 -5.699 88 HA ILE 13 HA ILE 13 -8.418 6.989 -7.183 89 HB ILE 13 HB ILE 13 -9.169 4.490 -6.769 90 HG12 ILE 13 1HG1 ILE 13 -7.229 5.152 -8.088 91 HG13 ILE 13 2HG1 ILE 13 -8.118 3.884 -8.927 92 HG21 ILE 13 1HG2 ILE 13 -10.633 3.596 -8.411 93 HG22 ILE 13 2HG2 ILE 13 -11.458 4.973 -7.684 94 HG23 ILE 13 3HG2 ILE 13 -10.709 5.133 -9.273 95 HD11 ILE 13 3HD1 ILE 13 -7.682 6.705 -9.662 96 HD12 ILE 13 1HD1 ILE 13 -7.791 5.266 -10.674 97 HD13 ILE 13 2HD1 ILE 13 -9.260 6.017 -10.049 98 H GLU 14 H GLU 14 -8.638 8.252 -8.920 99 HA GLU 14 HA GLU 14 -10.918 9.701 -9.480 100 HB2 GLU 14 1HB GLU 14 -8.433 9.090 -11.019 101 HB3 GLU 14 2HB GLU 14 -9.758 9.895 -11.849 102 HG2 GLU 14 1HG GLU 14 -9.571 11.805 -10.593 103 HG3 GLU 14 2HG GLU 14 -8.816 10.969 -9.238 104 H THR 15 H THR 15 -9.625 7.244 -11.713 105 HA THR 15 HA THR 15 -11.988 6.981 -13.197 106 HB THR 15 HB THR 15 -9.673 6.221 -13.892 107 HG1 THR 15 1HG THR 15 -11.218 5.577 -15.276 108 HG21 THR 15 3HG2 THR 15 -10.134 3.510 -12.916 109 HG22 THR 15 1HG2 THR 15 -9.815 4.667 -11.624 110 HG23 THR 15 2HG2 THR 15 -8.653 4.467 -12.935 111 H ALA 16 H ALA 16 -12.515 4.274 -13.381 112 HA ALA 16 HA ALA 16 -14.084 3.874 -10.958 113 HB1 ALA 16 1HB ALA 16 -15.133 2.025 -12.303 114 HB2 ALA 16 2HB ALA 16 -15.329 3.647 -12.967 115 HB3 ALA 16 3HB ALA 16 -14.136 2.549 -13.660 116 H GLY 17 H GLY 17 -11.405 3.519 -10.460 117 HA2 GLY 17 2HA GLY 17 -9.872 2.024 -9.625 118 HA3 GLY 17 3HA GLY 17 -11.285 1.085 -9.164 119 H HIS 18 H HIS 18 -9.311 1.804 -12.042 120 HA HIS 18 HA HIS 18 -9.591 -1.030 -12.804 121 HB2 HIS 18 1HB HIS 18 -10.423 1.161 -14.267 122 HB3 HIS 18 2HB HIS 18 -8.854 0.789 -14.973 123 HD1 HIS 18 1HD HIS 18 -9.143 -0.633 -16.960 124 HD2 HIS 18 2HD HIS 18 -11.901 -1.565 -13.996 125 HE1 HIS 18 1HE HIS 18 -10.503 -2.538 -17.881 126 H GLU 19 H GLU 19 -7.468 1.640 -12.242 127 HA GLU 19 HA GLU 19 -5.161 0.649 -13.539 128 HB2 GLU 19 1HB GLU 19 -5.807 2.796 -11.650 129 HB3 GLU 19 2HB GLU 19 -4.190 2.139 -11.442 130 HG2 GLU 19 1HG GLU 19 -3.716 3.736 -12.967 131 HG3 GLU 19 2HG GLU 19 -4.141 2.433 -14.075 132 H GLY 20 H GLY 20 -6.722 -0.190 -10.585 133 HA2 GLY 20 2HA GLY 20 -4.597 -1.185 -9.074 134 HA3 GLY 20 3HA GLY 20 -6.250 -1.774 -8.992 135 H ASP 21 H ASP 21 -6.485 -2.752 -11.625 136 HA ASP 21 HA ASP 21 -5.149 -5.274 -11.306 137 HB2 ASP 21 1HB ASP 21 -6.666 -6.087 -12.800 138 HB3 ASP 21 2HB ASP 21 -7.523 -4.608 -12.376 139 H LYS 22 H LYS 22 -4.164 -2.381 -12.548 140 HA LYS 22 HA LYS 22 -2.760 -3.287 -14.877 141 HB2 LYS 22 1HB LYS 22 -3.519 -0.836 -13.958 142 HB3 LYS 22 2HB LYS 22 -1.807 -0.832 -13.551 143 HG2 LYS 22 1HG LYS 22 -1.256 -0.414 -15.652 144 HG3 LYS 22 2HG LYS 22 -2.169 -1.816 -16.218 145 HD2 LYS 22 1HD LYS 22 -3.946 -0.569 -16.831 146 HD3 LYS 22 2HD LYS 22 -3.796 0.509 -15.442 147 HE2 LYS 22 1HE LYS 22 -2.792 2.042 -16.696 148 HE3 LYS 22 2HE LYS 22 -1.555 0.883 -17.178 149 HZ1 LYS 22 3HZ LYS 22 -3.755 1.895 -18.675 150 HZ2 LYS 22 1HZ LYS 22 -3.774 0.203 -18.637 151 HZ3 LYS 22 2HZ LYS 22 -2.407 1.019 -19.207 152 H ALA 23 H ALA 23 -2.257 -3.789 -11.644 153 HA ALA 23 HA ALA 23 0.581 -3.502 -11.503 154 HB1 ALA 23 1HB ALA 23 -0.634 -3.395 -9.464 155 HB2 ALA 23 2HB ALA 23 -1.397 -4.957 -9.762 156 HB3 ALA 23 3HB ALA 23 0.330 -4.872 -9.414 157 H VAL 24 H VAL 24 -1.358 -5.673 -13.121 158 HA VAL 24 HA VAL 24 -0.289 -8.174 -12.753 159 HB VAL 24 HB VAL 24 -1.111 -6.897 -15.364 160 HG11 VAL 24 1HG1 VAL 24 -0.655 -9.800 -14.681 161 HG12 VAL 24 2HG1 VAL 24 -1.405 -9.215 -16.167 162 HG13 VAL 24 3HG1 VAL 24 0.278 -8.823 -15.815 163 HG21 VAL 24 3HG2 VAL 24 -2.669 -7.353 -13.206 164 HG22 VAL 24 1HG2 VAL 24 -3.250 -7.411 -14.870 165 HG23 VAL 24 2HG2 VAL 24 -2.813 -8.903 -14.037 166 H ASP 25 H ASP 25 1.125 -5.434 -14.405 167 HA ASP 25 HA ASP 25 3.210 -6.834 -15.718 168 HB2 ASP 25 1HB ASP 25 2.290 -4.204 -15.650 169 HB3 ASP 25 2HB ASP 25 3.914 -4.113 -14.973 170 H GLY 26 H GLY 26 2.998 -5.197 -12.582 171 HA2 GLY 26 2HA GLY 26 4.250 -5.490 -10.672 172 HA3 GLY 26 3HA GLY 26 4.978 -6.895 -11.436 173 H ASN 27 H ASN 27 5.097 -3.790 -12.990 174 HA ASN 27 HA ASN 27 7.792 -3.269 -12.009 175 HB2 ASN 27 1HB ASN 27 7.474 -4.678 -14.354 176 HB3 ASN 27 2HB ASN 27 7.635 -3.019 -14.926 177 HD21 ASN 27 1HD2 ASN 27 9.126 -5.272 -12.630 178 HD22 ASN 27 2HD2 ASN 27 10.751 -4.775 -12.935 179 H ALA 28 H ALA 28 8.539 -1.292 -13.748 180 HA ALA 28 HA ALA 28 7.113 0.934 -12.802 181 HB1 ALA 28 1HB ALA 28 8.411 2.107 -14.728 182 HB2 ALA 28 2HB ALA 28 9.298 1.417 -13.368 183 HB3 ALA 28 3HB ALA 28 9.208 0.542 -14.896 184 H ALA 29 H ALA 29 6.449 -1.191 -15.376 185 HA ALA 29 HA ALA 29 5.095 0.567 -17.135 186 HB1 ALA 29 1HB ALA 29 5.766 -2.148 -17.100 187 HB2 ALA 29 2HB ALA 29 4.007 -2.092 -17.219 188 HB3 ALA 29 3HB ALA 29 4.999 -1.249 -18.409 189 H THR 30 H THR 30 4.315 -0.530 -14.050 190 HA THR 30 HA THR 30 1.427 -0.271 -14.477 191 HB THR 30 HB THR 30 1.082 -1.322 -12.397 192 HG1 THR 30 1HG THR 30 2.395 -0.964 -10.784 193 HG21 THR 30 3HG2 THR 30 2.260 -3.398 -12.571 194 HG22 THR 30 1HG2 THR 30 3.588 -2.635 -13.445 195 HG23 THR 30 2HG2 THR 30 2.005 -2.794 -14.208 196 H ARG 31 H ARG 31 0.247 1.385 -13.683 197 HA ARG 31 HA ARG 31 1.557 3.302 -11.887 198 HB2 ARG 31 1HB ARG 31 0.376 5.122 -13.257 199 HB3 ARG 31 2HB ARG 31 1.825 4.400 -13.942 200 HG2 ARG 31 1HG ARG 31 0.461 2.976 -15.368 201 HG3 ARG 31 2HG ARG 31 -1.004 3.662 -14.661 202 HD2 ARG 31 1HD ARG 31 -0.532 5.809 -15.576 203 HD3 ARG 31 2HD ARG 31 1.088 5.312 -16.061 204 HE ARG 31 HE ARG 31 -0.667 3.623 -17.365 205 HH11 ARG 31 1HH1 ARG 31 -0.012 7.040 -17.257 206 HH12 ARG 31 2HH1 ARG 31 -0.518 7.321 -18.890 207 HH21 ARG 31 1HH2 ARG 31 -1.335 3.980 -19.517 208 HH22 ARG 31 2HH2 ARG 31 -1.271 5.579 -20.174 209 H TRP 32 H TRP 32 0.101 4.618 -10.658 210 HA TRP 32 HA TRP 32 -2.698 3.747 -10.649 211 HB2 TRP 32 1HB TRP 32 -1.720 2.380 -8.944 212 HB3 TRP 32 2HB TRP 32 -0.837 3.748 -8.271 213 HD1 TRP 32 HD TRP 32 -2.040 5.175 -6.459 214 HE1 TRP 32 1HE TRP 32 -4.349 5.066 -5.326 215 HE3 TRP 32 3HE TRP 32 -4.271 1.720 -9.495 216 HZ2 TRP 32 2HZ TRP 32 -6.792 3.695 -5.672 217 HZ3 TRP 32 3HZ TRP 32 -6.595 1.063 -9.025 218 HH2 TRP 32 HH TRP 32 -7.828 2.031 -7.153 219 H ALA 33 H ALA 33 -4.133 5.348 -10.279 220 HA ALA 33 HA ALA 33 -3.030 8.015 -9.708 221 HB1 ALA 33 1HB ALA 33 -5.768 7.641 -10.822 222 HB2 ALA 33 2HB ALA 33 -4.613 8.951 -11.077 223 HB3 ALA 33 3HB ALA 33 -4.374 7.397 -11.877 224 H SER 34 H SER 34 -5.290 9.370 -9.006 225 HA SER 34 HA SER 34 -6.774 8.042 -6.954 226 HB2 SER 34 1HB SER 34 -5.701 9.923 -5.297 227 HB3 SER 34 2HB SER 34 -5.176 8.241 -5.356 228 HG SER 34 HG SER 34 -3.651 10.246 -5.714 229 H ALA 35 H ALA 35 -8.359 9.416 -5.967 230 HA ALA 35 HA ALA 35 -8.805 11.919 -7.461 231 HB1 ALA 35 1HB ALA 35 -10.778 11.122 -8.082 232 HB2 ALA 35 2HB ALA 35 -10.470 9.628 -7.197 233 HB3 ALA 35 3HB ALA 35 -11.254 10.986 -6.389 234 H TYR 36 H TYR 36 -9.029 13.738 -6.319 235 HA TYR 36 HA TYR 36 -8.332 14.043 -3.705 236 HB2 TYR 36 1HB TYR 36 -9.927 16.142 -3.850 237 HB3 TYR 36 2HB TYR 36 -8.453 16.058 -4.809 238 HD1 TYR 36 1HD TYR 36 -12.123 15.537 -4.950 239 HD2 TYR 36 2HD TYR 36 -8.538 16.138 -7.161 240 HE1 TYR 36 1HE TYR 36 -13.447 15.855 -6.999 241 HE2 TYR 36 2HE TYR 36 -9.852 16.460 -9.216 242 HH TYR 36 HH TYR 36 -11.909 16.199 -10.145 243 H GLY 37 H GLY 37 -9.448 14.359 -1.736 244 HA2 GLY 37 2HA GLY 37 -11.212 14.157 -0.234 245 HA3 GLY 37 3HA GLY 37 -12.272 13.756 -1.575 246 H ALA 38 H ALA 38 -12.799 12.306 0.493 247 HA ALA 38 HA ALA 38 -13.035 10.167 1.239 248 HB1 ALA 38 1HB ALA 38 -11.401 9.116 -1.027 249 HB2 ALA 38 2HB ALA 38 -12.845 8.439 -0.271 250 HB3 ALA 38 3HB ALA 38 -12.982 9.832 -1.345 251 H SER 39 H SER 39 -11.039 11.613 2.414 252 HA SER 39 HA SER 39 -8.738 9.798 2.592 253 HB2 SER 39 1HB SER 39 -9.111 12.697 2.933 254 HB3 SER 39 2HB SER 39 -8.085 11.948 4.156 255 HG SER 39 HG SER 39 -7.461 12.580 1.658 256 HA PRO 40 HA PRO 40 -6.938 10.238 4.285 257 HB2 PRO 40 1HB PRO 40 -5.821 8.101 5.534 258 HB3 PRO 40 2HB PRO 40 -6.079 9.654 6.336 259 HG2 PRO 40 1HG PRO 40 -7.729 7.159 6.462 260 HG3 PRO 40 2HG PRO 40 -7.255 8.255 7.774 261 HD2 PRO 40 1HD PRO 40 -9.707 8.329 6.627 262 HD3 PRO 40 2HD PRO 40 -8.908 9.780 7.265 263 H GLN 41 H GLN 41 -5.489 8.866 2.992 264 HA GLN 41 HA GLN 41 -7.040 7.007 1.358 265 HB2 GLN 41 1HB GLN 41 -4.248 7.861 0.700 266 HB3 GLN 41 2HB GLN 41 -5.567 7.439 -0.385 267 HG2 GLN 41 1HG GLN 41 -5.516 9.689 -0.687 268 HG3 GLN 41 2HG GLN 41 -6.664 9.593 0.647 269 HE21 GLN 41 1HE2 GLN 41 -3.405 10.396 -0.283 270 HE22 GLN 41 2HE2 GLN 41 -3.007 11.292 1.139 271 H TRP 42 H TRP 42 -6.060 4.999 0.625 272 HA TRP 42 HA TRP 42 -3.753 3.885 1.783 273 HB2 TRP 42 1HB TRP 42 -4.714 2.325 3.383 274 HB3 TRP 42 2HB TRP 42 -5.121 3.976 3.845 275 HD1 TRP 42 HD TRP 42 -7.708 4.696 2.620 276 HE1 TRP 42 1HE TRP 42 -9.873 3.328 2.880 277 HE3 TRP 42 3HE TRP 42 -5.668 0.179 3.874 278 HZ2 TRP 42 2HZ TRP 42 -10.617 0.685 3.531 279 HZ3 TRP 42 3HZ TRP 42 -7.177 -1.718 4.300 280 HH2 TRP 42 HH TRP 42 -9.599 -1.469 4.132 281 H ILE 43 H ILE 43 -3.436 1.650 1.193 282 HA ILE 43 HA ILE 43 -5.350 0.656 -0.811 283 HB ILE 43 HB ILE 43 -3.459 1.680 -1.989 284 HG12 ILE 43 1HG1 ILE 43 -2.909 -1.209 -2.374 285 HG13 ILE 43 2HG1 ILE 43 -4.590 -0.709 -2.518 286 HG21 ILE 43 1HG2 ILE 43 -1.227 0.428 -1.784 287 HG22 ILE 43 2HG2 ILE 43 -1.657 1.574 -0.516 288 HG23 ILE 43 3HG2 ILE 43 -1.857 -0.157 -0.245 289 HD11 ILE 43 3HD1 ILE 43 -2.289 -0.160 -4.271 290 HD12 ILE 43 1HD1 ILE 43 -3.989 -0.413 -4.666 291 HD13 ILE 43 2HD1 ILE 43 -3.447 1.152 -4.058 292 H TYR 44 H TYR 44 -5.485 -1.589 -1.032 293 HA TYR 44 HA TYR 44 -4.152 -3.129 1.099 294 HB2 TYR 44 1HB TYR 44 -6.456 -3.006 1.682 295 HB3 TYR 44 2HB TYR 44 -6.966 -3.339 0.031 296 HD1 TYR 44 2HD TYR 44 -4.866 -4.955 2.676 297 HD2 TYR 44 1HD TYR 44 -7.789 -5.448 -0.378 298 HE1 TYR 44 2HE TYR 44 -5.010 -7.351 3.209 299 HE2 TYR 44 1HE TYR 44 -7.941 -7.846 0.149 300 HH TYR 44 HH TYR 44 -7.438 -9.412 1.767 301 H ILE 45 H ILE 45 -3.539 -5.267 0.627 302 HA ILE 45 HA ILE 45 -3.695 -6.095 -2.181 303 HB ILE 45 HB ILE 45 -1.128 -6.127 -0.591 304 HG12 ILE 45 1HG1 ILE 45 -2.155 -4.291 -2.745 305 HG13 ILE 45 2HG1 ILE 45 -1.464 -3.868 -1.182 306 HG21 ILE 45 1HG2 ILE 45 -1.482 -7.984 -2.228 307 HG22 ILE 45 2HG2 ILE 45 -1.565 -6.766 -3.500 308 HG23 ILE 45 3HG2 ILE 45 -0.083 -6.965 -2.565 309 HD11 ILE 45 3HD1 ILE 45 0.097 -3.336 -2.918 310 HD12 ILE 45 1HD1 ILE 45 0.724 -4.689 -1.977 311 HD13 ILE 45 2HD1 ILE 45 0.003 -4.976 -3.561 312 H ASN 46 H ASN 46 -4.131 -8.199 -2.431 313 HA ASN 46 HA ASN 46 -3.748 -9.981 -0.117 314 HB2 ASN 46 1HB ASN 46 -5.848 -11.164 -1.252 315 HB3 ASN 46 2HB ASN 46 -6.038 -9.872 -0.071 316 HD21 ASN 46 1HD2 ASN 46 -6.850 -10.942 -3.117 317 HD22 ASN 46 2HD2 ASN 46 -7.476 -9.467 -3.761 318 H LEU 47 H LEU 47 -2.321 -11.507 -0.581 319 HA LEU 47 HA LEU 47 -1.845 -12.257 -3.360 320 HB2 LEU 47 1HB LEU 47 -0.168 -11.841 -1.229 321 HB3 LEU 47 2HB LEU 47 -0.264 -13.599 -1.302 322 HG LEU 47 HG LEU 47 0.193 -12.743 -3.936 323 HD11 LEU 47 1HD1 LEU 47 0.888 -10.578 -3.191 324 HD12 LEU 47 2HD1 LEU 47 2.324 -11.493 -3.646 325 HD13 LEU 47 3HD1 LEU 47 1.917 -11.282 -1.943 326 HD21 LEU 47 3HD2 LEU 47 1.115 -14.763 -3.326 327 HD22 LEU 47 1HD2 LEU 47 1.740 -14.140 -1.799 328 HD23 LEU 47 2HD2 LEU 47 2.537 -13.718 -3.315 329 H GLY 48 H GLY 48 -2.812 -13.707 -0.282 330 HA2 GLY 48 2HA GLY 48 -4.414 -15.464 -0.165 331 HA3 GLY 48 3HA GLY 48 -3.960 -15.947 -1.792 332 H SER 49 H SER 49 -1.313 -15.235 0.214 333 HA SER 49 HA SER 49 -1.045 -17.881 1.332 334 HB2 SER 49 1HB SER 49 0.834 -16.962 -0.857 335 HB3 SER 49 2HB SER 49 1.063 -18.398 0.141 336 HG SER 49 HG SER 49 -0.603 -19.372 -0.846 337 H THR 50 H THR 50 0.997 -18.108 2.571 338 HA THR 50 HA THR 50 1.563 -15.624 3.950 339 HB THR 50 HB THR 50 3.196 -17.599 5.053 340 HG1 THR 50 1HG THR 50 2.258 -19.442 4.638 341 HG21 THR 50 3HG2 THR 50 2.213 -16.536 6.755 342 HG22 THR 50 1HG2 THR 50 0.851 -17.636 6.537 343 HG23 THR 50 2HG2 THR 50 0.843 -16.054 5.756 344 H GLN 51 H GLN 51 3.229 -14.353 3.495 345 HA GLN 51 HA GLN 51 5.635 -15.549 2.297 346 HB2 GLN 51 1HB GLN 51 3.868 -13.637 1.120 347 HB3 GLN 51 2HB GLN 51 5.413 -12.854 1.425 348 HG2 GLN 51 1HG GLN 51 5.575 -13.709 -0.743 349 HG3 GLN 51 2HG GLN 51 6.483 -14.834 0.264 350 HE21 GLN 51 1HE2 GLN 51 5.845 -16.919 0.401 351 HE22 GLN 51 2HE2 GLN 51 4.504 -17.581 -0.461 352 H SER 52 H SER 52 7.599 -14.711 2.942 353 HA SER 52 HA SER 52 7.527 -13.194 5.425 354 HB2 SER 52 1HB SER 52 8.970 -15.332 4.854 355 HB3 SER 52 2HB SER 52 10.080 -14.137 4.182 356 HG SER 52 HG SER 52 10.213 -13.166 6.190 357 H ILE 53 H ILE 53 8.178 -11.138 5.660 358 HA ILE 53 HA ILE 53 9.627 -9.843 3.464 359 HB ILE 53 HB ILE 53 8.017 -7.805 4.211 360 HG12 ILE 53 1HG1 ILE 53 6.136 -10.153 4.092 361 HG13 ILE 53 2HG1 ILE 53 6.743 -9.540 5.626 362 HG21 ILE 53 1HG2 ILE 53 8.235 -9.622 1.974 363 HG22 ILE 53 2HG2 ILE 53 6.591 -9.011 2.155 364 HG23 ILE 53 3HG2 ILE 53 7.936 -7.883 1.989 365 HD11 ILE 53 3HD1 ILE 53 5.333 -7.823 5.608 366 HD12 ILE 53 1HD1 ILE 53 5.673 -7.448 3.919 367 HD13 ILE 53 2HD1 ILE 53 4.489 -8.690 4.325 368 H SER 54 H SER 54 10.868 -8.038 4.063 369 HA SER 54 HA SER 54 11.107 -7.555 6.956 370 HB2 SER 54 1HB SER 54 13.663 -7.222 6.254 371 HB3 SER 54 2HB SER 54 13.024 -8.796 6.731 372 HG SER 54 HG SER 54 12.751 -9.277 4.520 373 H ARG 55 H ARG 55 12.158 -6.371 3.762 374 HA ARG 55 HA ARG 55 11.758 -3.626 4.761 375 HB2 ARG 55 1HB ARG 55 13.584 -4.289 2.471 376 HB3 ARG 55 2HB ARG 55 13.578 -2.863 3.502 377 HG2 ARG 55 1HG ARG 55 14.359 -4.263 5.381 378 HG3 ARG 55 2HG ARG 55 14.453 -5.637 4.278 379 HD2 ARG 55 1HD ARG 55 15.822 -3.457 3.083 380 HD3 ARG 55 2HD ARG 55 16.377 -3.598 4.751 381 HE ARG 55 HE ARG 55 16.368 -6.153 3.629 382 HH11 ARG 55 1HH1 ARG 55 18.024 -3.115 3.244 383 HH12 ARG 55 2HH1 ARG 55 19.491 -3.838 2.672 384 HH21 ARG 55 1HH2 ARG 55 18.293 -7.117 2.877 385 HH22 ARG 55 2HH2 ARG 55 19.643 -6.115 2.463 386 H VAL 56 H VAL 56 10.448 -2.302 3.631 387 HA VAL 56 HA VAL 56 9.574 -3.128 0.953 388 HB VAL 56 HB VAL 56 7.777 -3.932 2.237 389 HG11 VAL 56 1HG1 VAL 56 8.356 -2.957 4.373 390 HG12 VAL 56 2HG1 VAL 56 7.894 -1.353 3.800 391 HG13 VAL 56 3HG1 VAL 56 6.669 -2.607 4.000 392 HG21 VAL 56 3HG2 VAL 56 7.186 -2.413 0.322 393 HG22 VAL 56 1HG2 VAL 56 5.927 -2.607 1.543 394 HG23 VAL 56 2HG2 VAL 56 6.906 -1.140 1.512 395 H LYS 57 H LYS 57 9.385 -1.495 -0.470 396 HA LYS 57 HA LYS 57 9.539 1.256 0.577 397 HB2 LYS 57 1HB LYS 57 10.932 1.874 -1.289 398 HB3 LYS 57 2HB LYS 57 11.655 0.487 -0.485 399 HG2 LYS 57 1HG LYS 57 10.660 -0.976 -2.218 400 HG3 LYS 57 2HG LYS 57 10.077 0.468 -3.050 401 HD2 LYS 57 1HD LYS 57 12.030 0.423 -4.143 402 HD3 LYS 57 2HD LYS 57 12.736 1.030 -2.644 403 HE2 LYS 57 1HE LYS 57 12.560 -1.702 -2.241 404 HE3 LYS 57 2HE LYS 57 13.035 -1.556 -3.931 405 HZ1 LYS 57 3HZ LYS 57 14.857 -1.626 -2.157 406 HZ2 LYS 57 1HZ LYS 57 14.431 -0.021 -1.834 407 HZ3 LYS 57 2HZ LYS 57 14.980 -0.457 -3.373 408 H LEU 58 H LEU 58 8.023 2.638 -0.106 409 HA LEU 58 HA LEU 58 6.499 1.995 -2.530 410 HB2 LEU 58 1HB LEU 58 4.414 2.374 -1.487 411 HB3 LEU 58 2HB LEU 58 5.294 1.236 -0.470 412 HG LEU 58 HG LEU 58 5.303 4.161 0.170 413 HD11 LEU 58 1HD1 LEU 58 3.042 2.283 0.372 414 HD12 LEU 58 2HD1 LEU 58 3.056 4.044 0.292 415 HD13 LEU 58 3HD1 LEU 58 3.395 3.230 1.818 416 HD21 LEU 58 3HD2 LEU 58 5.147 2.386 2.394 417 HD22 LEU 58 1HD2 LEU 58 6.460 3.469 1.930 418 HD23 LEU 58 2HD2 LEU 58 6.412 1.822 1.302 419 H ASN 59 H ASN 59 5.493 3.797 -3.545 420 HA ASN 59 HA ASN 59 6.715 6.367 -2.793 421 HB2 ASN 59 1HB ASN 59 7.499 6.045 -4.927 422 HB3 ASN 59 2HB ASN 59 6.102 5.089 -5.413 423 HD21 ASN 59 1HD2 ASN 59 7.574 8.129 -5.456 424 HD22 ASN 59 2HD2 ASN 59 6.283 9.016 -6.186 425 H TRP 60 H TRP 60 5.460 8.289 -3.010 426 HA TRP 60 HA TRP 60 2.560 7.806 -2.788 427 HB2 TRP 60 1HB TRP 60 4.123 8.817 -0.835 428 HB3 TRP 60 2HB TRP 60 3.699 10.307 -1.675 429 HD1 TRP 60 HD TRP 60 1.534 11.400 -0.870 430 HE1 TRP 60 1HE TRP 60 -0.564 10.627 0.406 431 HE3 TRP 60 3HE TRP 60 2.591 6.411 -0.522 432 HZ2 TRP 60 2HZ TRP 60 -1.629 8.219 1.424 433 HZ3 TRP 60 3HZ TRP 60 0.980 4.941 0.619 434 HH2 TRP 60 HH TRP 60 -1.085 5.828 1.572 435 H GLU 61 H GLU 61 5.068 9.582 -4.369 436 HA GLU 61 HA GLU 61 5.024 10.852 -6.266 437 HB2 GLU 61 1HB GLU 61 2.760 9.344 -6.527 438 HB3 GLU 61 2HB GLU 61 2.098 10.971 -6.554 439 HG2 GLU 61 1HG GLU 61 2.696 11.203 -8.664 440 HG3 GLU 61 2HG GLU 61 4.382 10.913 -8.239 441 H ASP 62 H ASP 62 3.169 12.792 -7.085 442 HA ASP 62 HA ASP 62 3.886 15.007 -5.633 443 HB2 ASP 62 1HB ASP 62 1.804 14.392 -7.620 444 HB3 ASP 62 2HB ASP 62 1.440 15.773 -6.588 445 H ALA 63 H ALA 63 1.319 12.742 -4.984 446 HA ALA 63 HA ALA 63 -0.406 14.055 -3.356 447 HB1 ALA 63 1HB ALA 63 0.770 11.315 -2.917 448 HB2 ALA 63 2HB ALA 63 -0.654 11.939 -2.084 449 HB3 ALA 63 3HB ALA 63 -0.682 11.716 -3.832 450 H TYR 64 H TYR 64 -0.310 15.169 -1.516 451 HA TYR 64 HA TYR 64 2.204 15.503 -0.167 452 HB2 TYR 64 1HB TYR 64 -0.552 16.628 0.348 453 HB3 TYR 64 2HB TYR 64 0.858 17.039 1.318 454 HD1 TYR 64 2HD TYR 64 -0.228 16.966 -2.258 455 HD2 TYR 64 1HD TYR 64 2.072 18.918 0.743 456 HE1 TYR 64 2HE TYR 64 0.353 18.736 -3.863 457 HE2 TYR 64 1HE TYR 64 2.659 20.694 -0.854 458 HH TYR 64 HH TYR 64 2.375 21.496 -2.904 459 H ALA 65 H ALA 65 2.935 14.178 1.343 460 HA ALA 65 HA ALA 65 1.163 13.233 3.440 461 HB1 ALA 65 1HB ALA 65 2.099 10.870 3.135 462 HB2 ALA 65 2HB ALA 65 0.840 11.404 2.021 463 HB3 ALA 65 3HB ALA 65 2.527 11.389 1.505 464 H THR 66 H THR 66 2.184 13.004 5.364 465 HA THR 66 HA THR 66 4.956 13.842 5.494 466 HB THR 66 HB THR 66 4.637 13.936 7.912 467 HG1 THR 66 1HG THR 66 2.387 13.479 8.636 468 HG21 THR 66 3HG2 THR 66 3.322 15.507 6.020 469 HG22 THR 66 1HG2 THR 66 3.651 15.928 7.700 470 HG23 THR 66 2HG2 THR 66 2.112 15.187 7.262 471 H ALA 67 H ALA 67 3.104 10.929 5.785 472 HA ALA 67 HA ALA 67 5.332 9.243 5.626 473 HB1 ALA 67 1HB ALA 67 6.060 9.023 7.707 474 HB2 ALA 67 2HB ALA 67 4.879 10.215 8.249 475 HB3 ALA 67 3HB ALA 67 4.457 8.503 8.224 476 H TYR 68 H TYR 68 4.750 6.933 5.936 477 HA TYR 68 HA TYR 68 1.850 6.494 5.666 478 HB2 TYR 68 1HB TYR 68 3.641 4.638 4.222 479 HB3 TYR 68 2HB TYR 68 2.085 5.306 3.743 480 HD1 TYR 68 2HD TYR 68 2.318 8.068 3.514 481 HD2 TYR 68 1HD TYR 68 5.344 5.169 2.775 482 HE1 TYR 68 2HE TYR 68 3.455 9.647 2.010 483 HE2 TYR 68 1HE TYR 68 6.491 6.742 1.270 484 HH TYR 68 HH TYR 68 6.525 9.423 1.090 485 H SER 69 H SER 69 1.093 4.390 6.287 486 HA SER 69 HA SER 69 2.867 3.077 8.240 487 HB2 SER 69 1HB SER 69 -0.074 3.671 8.296 488 HB3 SER 69 2HB SER 69 0.565 2.309 9.217 489 HG SER 69 HG SER 69 0.585 4.879 9.867 490 H ILE 70 H ILE 70 3.212 0.937 8.075 491 HA ILE 70 HA ILE 70 1.735 -0.510 5.974 492 HB ILE 70 HB ILE 70 4.605 -0.411 6.648 493 HG12 ILE 70 1HG1 ILE 70 3.526 -1.458 4.080 494 HG13 ILE 70 2HG1 ILE 70 3.177 0.222 4.473 495 HG21 ILE 70 1HG2 ILE 70 3.194 -2.998 6.055 496 HG22 ILE 70 2HG2 ILE 70 4.911 -2.752 5.737 497 HG23 ILE 70 3HG2 ILE 70 4.293 -2.632 7.384 498 HD11 ILE 70 3HD1 ILE 70 5.979 -0.726 4.719 499 HD12 ILE 70 1HD1 ILE 70 5.314 -0.463 3.107 500 HD13 ILE 70 2HD1 ILE 70 5.352 0.861 4.272 501 H GLN 71 H GLN 71 0.492 -2.121 6.644 502 HA GLN 71 HA GLN 71 1.276 -3.665 9.003 503 HB2 GLN 71 1HB GLN 71 -1.185 -3.631 9.699 504 HB3 GLN 71 2HB GLN 71 -0.241 -2.181 10.013 505 HG2 GLN 71 1HG GLN 71 -1.475 -2.060 7.414 506 HG3 GLN 71 2HG GLN 71 -2.672 -2.359 8.674 507 HE21 GLN 71 1HE2 GLN 71 -0.275 -0.153 7.456 508 HE22 GLN 71 2HE2 GLN 71 -0.770 1.216 8.386 509 H VAL 72 H VAL 72 0.925 -5.802 8.803 510 HA VAL 72 HA VAL 72 -0.517 -6.706 6.400 511 HB VAL 72 HB VAL 72 0.803 -8.848 6.741 512 HG11 VAL 72 1HG1 VAL 72 2.169 -8.087 5.151 513 HG12 VAL 72 2HG1 VAL 72 1.407 -6.513 5.393 514 HG13 VAL 72 3HG1 VAL 72 2.904 -6.909 6.238 515 HG21 VAL 72 3HG2 VAL 72 2.874 -8.673 8.036 516 HG22 VAL 72 1HG2 VAL 72 2.399 -7.062 8.575 517 HG23 VAL 72 2HG2 VAL 72 1.454 -8.470 9.062 518 H SER 73 H SER 73 -1.560 -8.867 6.595 519 HA SER 73 HA SER 73 -3.089 -8.966 9.077 520 HB2 SER 73 1HB SER 73 -3.560 -10.634 6.606 521 HB3 SER 73 2HB SER 73 -4.707 -10.238 7.885 522 HG SER 73 HG SER 73 -5.241 -8.760 6.451 523 H ASN 74 H ASN 74 -2.375 -10.228 10.652 524 HA ASN 74 HA ASN 74 -1.984 -12.988 10.374 525 HB2 ASN 74 1HB ASN 74 0.308 -13.316 10.354 526 HB3 ASN 74 2HB ASN 74 0.159 -11.911 9.303 527 HD21 ASN 74 1HD2 ASN 74 0.060 -9.792 10.732 528 HD22 ASN 74 2HD2 ASN 74 1.367 -9.653 11.854 529 H ASP 75 H ASP 75 -1.471 -14.033 12.381 530 HA ASP 75 HA ASP 75 -0.840 -12.667 14.755 531 HB2 ASP 75 1HB ASP 75 -3.249 -11.850 14.160 532 HB3 ASP 75 2HB ASP 75 -3.740 -13.437 14.748 533 H SER 76 H SER 76 -2.739 -15.340 13.406 534 HA SER 76 HA SER 76 -1.616 -17.099 15.485 535 HB2 SER 76 1HB SER 76 -4.064 -17.010 15.503 536 HB3 SER 76 2HB SER 76 -4.106 -17.466 13.800 537 HG SER 76 HG SER 76 -3.686 -19.019 16.040 538 H GLY 77 H GLY 77 -1.038 -16.193 12.421 539 HA2 GLY 77 2HA GLY 77 0.304 -17.108 10.788 540 HA3 GLY 77 3HA GLY 77 0.564 -18.482 11.852 541 H SER 78 H SER 78 -0.657 -17.576 8.934 542 HA SER 78 HA SER 78 -1.732 -18.783 7.317 543 HB2 SER 78 1HB SER 78 -0.765 -20.773 8.717 544 HB3 SER 78 2HB SER 78 -2.431 -20.955 9.267 545 HG SER 78 HG SER 78 -1.336 -21.335 6.724 546 H THR 79 H THR 79 -3.024 -17.585 10.095 547 HA THR 79 HA THR 79 -5.700 -17.551 8.941 548 HB THR 79 HB THR 79 -5.376 -18.277 11.848 549 HG1 THR 79 1HG THR 79 -4.571 -20.041 10.762 550 HG21 THR 79 3HG2 THR 79 -7.575 -17.570 10.156 551 HG22 THR 79 1HG2 THR 79 -7.576 -17.927 11.882 552 HG23 THR 79 2HG2 THR 79 -7.776 -19.230 10.712 553 HA PRO 80 HA PRO 80 -4.329 -13.491 10.707 554 HB2 PRO 80 1HB PRO 80 -5.141 -12.030 8.567 555 HB3 PRO 80 2HB PRO 80 -3.553 -12.798 8.658 556 HG2 PRO 80 1HG PRO 80 -6.029 -13.729 7.257 557 HG3 PRO 80 2HG PRO 80 -4.348 -13.747 6.690 558 HD2 PRO 80 1HD PRO 80 -5.577 -15.950 7.674 559 HD3 PRO 80 2HD PRO 80 -3.837 -15.658 7.872 560 H THR 81 H THR 81 -5.627 -11.734 11.411 561 HA THR 81 HA THR 81 -8.475 -11.775 10.876 562 HB THR 81 HB THR 81 -9.019 -11.800 13.346 563 HG1 THR 81 1HG THR 81 -7.252 -11.714 14.532 564 HG21 THR 81 3HG2 THR 81 -9.409 -14.062 13.317 565 HG22 THR 81 1HG2 THR 81 -7.819 -14.440 12.654 566 HG23 THR 81 2HG2 THR 81 -9.079 -13.787 11.606 567 H ASN 82 H ASN 82 -5.786 -10.397 12.707 568 HA ASN 82 HA ASN 82 -7.152 -7.789 12.639 569 HB2 ASN 82 1HB ASN 82 -6.253 -9.044 14.852 570 HB3 ASN 82 2HB ASN 82 -4.801 -8.151 14.409 571 HD21 ASN 82 1HD2 ASN 82 -4.636 -6.272 15.366 572 HD22 ASN 82 2HD2 ASN 82 -5.943 -5.241 15.834 573 H TRP 83 H TRP 83 -5.068 -6.104 13.093 574 HA TRP 83 HA TRP 83 -3.102 -6.636 10.983 575 HB2 TRP 83 1HB TRP 83 -5.230 -4.641 10.909 576 HB3 TRP 83 2HB TRP 83 -3.632 -3.929 10.697 577 HD1 TRP 83 HD TRP 83 -2.095 -5.355 8.719 578 HE1 TRP 83 1HE TRP 83 -2.916 -6.073 6.387 579 HE3 TRP 83 3HE TRP 83 -7.136 -5.233 9.560 580 HZ2 TRP 83 2HZ TRP 83 -5.375 -6.527 5.078 581 HZ3 TRP 83 3HZ TRP 83 -8.654 -5.823 7.716 582 HH2 TRP 83 HH TRP 83 -7.790 -6.456 5.522 583 H THR 84 H THR 84 -1.092 -5.829 11.367 584 HA THR 84 HA THR 84 -0.747 -4.125 13.744 585 HB THR 84 HB THR 84 1.502 -5.920 13.261 586 HG1 THR 84 1HG THR 84 0.406 -7.787 14.031 587 HG21 THR 84 3HG2 THR 84 0.819 -6.385 15.778 588 HG22 THR 84 1HG2 THR 84 -0.123 -4.914 15.543 589 HG23 THR 84 2HG2 THR 84 1.624 -4.890 15.303 590 H THR 85 H THR 85 0.369 -2.334 13.351 591 HA THR 85 HA THR 85 1.529 -1.853 10.779 592 HB THR 85 HB THR 85 2.268 0.335 11.867 593 HG1 THR 85 1HG THR 85 1.951 0.544 13.946 594 HG21 THR 85 3HG2 THR 85 -0.486 -0.618 11.379 595 HG22 THR 85 1HG2 THR 85 0.389 0.734 10.662 596 HG23 THR 85 2HG2 THR 85 -0.337 0.902 12.261 597 H VAL 86 H VAL 86 3.723 -1.222 10.372 598 HA VAL 86 HA VAL 86 5.645 -2.454 12.241 599 HB VAL 86 HB VAL 86 6.141 -2.171 9.289 600 HG11 VAL 86 1HG1 VAL 86 7.526 -4.304 9.976 601 HG12 VAL 86 2HG1 VAL 86 8.153 -2.679 10.258 602 HG13 VAL 86 3HG1 VAL 86 7.413 -3.582 11.581 603 HG21 VAL 86 3HG2 VAL 86 4.579 -4.272 10.731 604 HG22 VAL 86 1HG2 VAL 86 4.256 -3.503 9.178 605 HG23 VAL 86 2HG2 VAL 86 5.540 -4.704 9.316 606 H TYR 87 H TYR 87 4.668 0.389 10.693 607 HA TYR 87 HA TYR 87 6.759 1.911 11.896 608 HB2 TYR 87 1HB TYR 87 7.782 0.945 9.737 609 HB3 TYR 87 2HB TYR 87 6.715 2.058 8.888 610 HD1 TYR 87 2HD TYR 87 9.483 1.885 11.349 611 HD2 TYR 87 1HD TYR 87 7.275 4.338 8.664 612 HE1 TYR 87 2HE TYR 87 11.137 3.681 11.639 613 HE2 TYR 87 1HE TYR 87 8.923 6.140 8.945 614 HH TYR 87 HH TYR 87 11.714 5.968 9.772 615 H SER 88 H SER 88 6.544 4.267 11.356 616 HA SER 88 HA SER 88 4.389 5.359 9.977 617 HB2 SER 88 1HB SER 88 2.977 5.996 12.031 618 HB3 SER 88 2HB SER 88 2.825 4.347 11.426 619 HG SER 88 HG SER 88 3.552 5.151 13.852 620 H THR 89 H THR 89 4.376 7.597 10.066 621 HA THR 89 HA THR 89 5.930 8.974 12.093 622 HB THR 89 HB THR 89 6.826 9.978 9.550 623 HG1 THR 89 1HG THR 89 6.459 7.620 9.102 624 HG21 THR 89 3HG2 THR 89 8.693 10.315 10.743 625 HG22 THR 89 1HG2 THR 89 8.790 8.622 11.226 626 HG23 THR 89 2HG2 THR 89 7.767 9.740 12.129 627 H THR 90 H THR 90 5.993 11.416 11.518 628 HA THR 90 HA THR 90 3.909 12.426 9.844 629 HB THR 90 HB THR 90 2.888 13.566 12.062 630 HG1 THR 90 1HG THR 90 2.676 11.898 13.640 631 HG21 THR 90 3HG2 THR 90 1.518 11.089 11.774 632 HG22 THR 90 1HG2 THR 90 2.095 11.587 10.184 633 HG23 THR 90 2HG2 THR 90 1.075 12.670 11.131 634 H THR 91 H THR 91 5.986 13.447 9.236 635 HA THR 91 HA THR 91 6.400 15.898 10.806 636 HB THR 91 HB THR 91 8.771 15.825 10.523 637 HG1 THR 91 1HG THR 91 9.481 14.833 8.799 638 HG21 THR 91 3HG2 THR 91 9.366 13.975 11.884 639 HG22 THR 91 1HG2 THR 91 8.009 13.014 11.299 640 HG23 THR 91 2HG2 THR 91 7.720 14.408 12.341 641 H GLY 92 H GLY 92 6.770 14.265 7.685 642 HA2 GLY 92 2HA GLY 92 5.666 15.670 5.865 643 HA3 GLY 92 3HA GLY 92 6.803 16.909 6.378 644 H ASP 93 H ASP 93 6.373 15.287 3.827 645 HA ASP 93 HA ASP 93 9.034 15.220 2.977 646 HB2 ASP 93 1HB ASP 93 8.126 12.799 4.323 647 HB3 ASP 93 2HB ASP 93 8.675 12.485 2.680 648 H GLY 94 H GLY 94 6.464 12.833 2.365 649 HA2 GLY 94 2HA GLY 94 4.981 12.710 0.572 650 HA3 GLY 94 3HA GLY 94 5.685 14.183 -0.078 651 H ALA 95 H ALA 95 8.269 12.343 0.598 652 HA ALA 95 HA ALA 95 8.459 11.416 -2.167 653 HB1 ALA 95 1HB ALA 95 10.399 12.534 -1.793 654 HB2 ALA 95 2HB ALA 95 10.410 12.165 -0.068 655 HB3 ALA 95 3HB ALA 95 10.906 10.940 -1.235 656 H ILE 96 H ILE 96 9.609 9.311 -2.531 657 HA ILE 96 HA ILE 96 8.180 7.172 -1.566 658 HB ILE 96 HB ILE 96 11.070 7.024 -2.429 659 HG12 ILE 96 1HG1 ILE 96 9.523 6.361 -4.612 660 HG13 ILE 96 2HG1 ILE 96 8.632 7.705 -3.905 661 HG21 ILE 96 1HG2 ILE 96 9.974 5.000 -1.382 662 HG22 ILE 96 2HG2 ILE 96 8.902 4.970 -2.783 663 HG23 ILE 96 3HG2 ILE 96 10.641 4.771 -2.998 664 HD11 ILE 96 3HD1 ILE 96 10.839 7.834 -5.594 665 HD12 ILE 96 1HD1 ILE 96 10.082 9.163 -4.717 666 HD13 ILE 96 2HD1 ILE 96 11.441 8.296 -4.002 667 H ASP 97 H ASP 97 8.175 5.970 0.228 668 HA ASP 97 HA ASP 97 10.353 6.386 2.171 669 HB2 ASP 97 1HB ASP 97 8.067 7.294 2.793 670 HB3 ASP 97 2HB ASP 97 7.514 5.623 2.858 671 H ASP 98 H ASP 98 11.508 4.653 2.690 672 HA ASP 98 HA ASP 98 10.373 1.995 2.115 673 HB2 ASP 98 1HB ASP 98 12.162 2.260 0.610 674 HB3 ASP 98 2HB ASP 98 13.173 3.055 1.814 675 H ILE 99 H ILE 99 9.914 0.885 3.886 676 HA ILE 99 HA ILE 99 11.369 1.479 6.364 677 HB ILE 99 HB ILE 99 8.825 -0.115 6.043 678 HG12 ILE 99 1HG1 ILE 99 8.329 2.330 7.359 679 HG13 ILE 99 2HG1 ILE 99 9.279 2.728 5.932 680 HG21 ILE 99 1HG2 ILE 99 9.522 1.202 8.587 681 HG22 ILE 99 2HG2 ILE 99 8.781 -0.369 8.286 682 HG23 ILE 99 3HG2 ILE 99 10.525 -0.172 8.125 683 HD11 ILE 99 3HD1 ILE 99 7.083 2.870 5.204 684 HD12 ILE 99 1HD1 ILE 99 7.598 1.274 4.657 685 HD13 ILE 99 2HD1 ILE 99 6.592 1.431 6.097 686 H THR 100 H THR 100 12.948 0.157 6.939 687 HA THR 100 HA THR 100 12.903 -2.620 5.965 688 HB THR 100 HB THR 100 15.282 -2.679 6.156 689 HG1 THR 100 1HG THR 100 16.445 -0.953 7.071 690 HG21 THR 100 3HG2 THR 100 13.949 -0.861 4.486 691 HG22 THR 100 1HG2 THR 100 15.543 -1.572 4.238 692 HG23 THR 100 2HG2 THR 100 15.388 -0.019 5.062 693 H PHE 101 H PHE 101 12.511 -4.173 7.389 694 HA PHE 101 HA PHE 101 13.395 -3.862 10.156 695 HB2 PHE 101 1HB PHE 101 11.086 -4.872 10.817 696 HB3 PHE 101 2HB PHE 101 11.211 -3.143 10.509 697 HD1 PHE 101 2HD PHE 101 10.303 -2.179 8.453 698 HD2 PHE 101 1HD PHE 101 9.834 -6.308 9.376 699 HE1 PHE 101 2HE PHE 101 8.526 -2.352 6.760 700 HE2 PHE 101 1HE PHE 101 8.057 -6.488 7.684 701 HZ PHE 101 HZ PHE 101 7.400 -4.508 6.374 702 H ALA 102 H ALA 102 12.499 -6.074 11.317 703 HA ALA 102 HA ALA 102 14.087 -8.124 10.206 704 HB1 ALA 102 1HB ALA 102 12.574 -9.482 11.963 705 HB2 ALA 102 2HB ALA 102 13.945 -8.475 12.432 706 HB3 ALA 102 3HB ALA 102 12.304 -7.836 12.539 707 H ALA 103 H ALA 103 13.386 -10.257 9.529 708 HA ALA 103 HA ALA 103 11.326 -10.120 7.556 709 HB1 ALA 103 1HB ALA 103 13.415 -12.012 8.340 710 HB2 ALA 103 2HB ALA 103 11.948 -12.771 7.720 711 HB3 ALA 103 3HB ALA 103 12.810 -11.586 6.739 712 H THR 104 H THR 104 9.240 -10.597 7.747 713 HA THR 104 HA THR 104 8.364 -12.397 9.892 714 HB THR 104 HB THR 104 6.366 -10.835 10.225 715 HG1 THR 104 1HG THR 104 6.710 -9.430 8.488 716 HG21 THR 104 3HG2 THR 104 7.963 -9.192 11.587 717 HG22 THR 104 1HG2 THR 104 9.143 -10.444 11.200 718 HG23 THR 104 2HG2 THR 104 7.679 -10.858 12.092 719 H ASN 105 H ASN 105 6.549 -13.610 9.432 720 HA ASN 105 HA ASN 105 5.862 -13.798 6.627 721 HB2 ASN 105 1HB ASN 105 4.411 -15.733 7.515 722 HB3 ASN 105 2HB ASN 105 6.161 -15.904 7.625 723 HD21 ASN 105 1HD2 ASN 105 3.230 -15.876 9.310 724 HD22 ASN 105 2HD2 ASN 105 3.868 -15.989 10.910 725 H ALA 106 H ALA 106 3.897 -13.375 5.710 726 HA ALA 106 HA ALA 106 1.621 -12.638 7.335 727 HB1 ALA 106 1HB ALA 106 3.325 -10.624 6.028 728 HB2 ALA 106 2HB ALA 106 1.589 -10.437 5.777 729 HB3 ALA 106 3HB ALA 106 2.244 -10.475 7.414 730 H LYS 107 H LYS 107 -0.327 -12.367 6.091 731 HA LYS 107 HA LYS 107 -0.236 -13.898 3.603 732 HB2 LYS 107 1HB LYS 107 -2.553 -13.072 5.362 733 HB3 LYS 107 2HB LYS 107 -2.714 -14.007 3.880 734 HG2 LYS 107 1HG LYS 107 -0.978 -15.579 5.093 735 HG3 LYS 107 2HG LYS 107 -1.654 -14.816 6.533 736 HD2 LYS 107 1HD LYS 107 -3.008 -16.684 6.244 737 HD3 LYS 107 2HD LYS 107 -3.943 -15.394 5.484 738 HE2 LYS 107 1HE LYS 107 -2.576 -16.184 3.351 739 HE3 LYS 107 2HE LYS 107 -2.517 -17.694 4.259 740 HZ1 LYS 107 3HZ LYS 107 -4.427 -17.674 2.818 741 HZ2 LYS 107 1HZ LYS 107 -4.968 -16.211 3.474 742 HZ3 LYS 107 2HZ LYS 107 -4.948 -17.609 4.426 743 H PHE 108 H PHE 108 -1.848 -10.957 4.824 744 HA PHE 108 HA PHE 108 -1.782 -9.906 2.072 745 HB2 PHE 108 1HB PHE 108 -3.746 -8.903 4.097 746 HB3 PHE 108 2HB PHE 108 -3.872 -8.933 2.341 747 HD1 PHE 108 2HD PHE 108 -3.414 -11.663 1.613 748 HD2 PHE 108 1HD PHE 108 -5.484 -10.105 4.990 749 HE1 PHE 108 2HE PHE 108 -4.745 -13.727 1.744 750 HE2 PHE 108 1HE PHE 108 -6.818 -12.167 5.127 751 HZ PHE 108 HZ PHE 108 -6.451 -13.981 3.503 752 H VAL 109 H VAL 109 -1.650 -7.540 1.906 753 HA VAL 109 HA VAL 109 -0.321 -6.277 4.204 754 HB VAL 109 HB VAL 109 0.646 -5.990 1.358 755 HG11 VAL 109 1HG1 VAL 109 2.372 -4.666 2.191 756 HG12 VAL 109 2HG1 VAL 109 0.962 -4.124 3.106 757 HG13 VAL 109 3HG1 VAL 109 2.128 -5.221 3.848 758 HG21 VAL 109 3HG2 VAL 109 2.653 -7.195 2.839 759 HG22 VAL 109 1HG2 VAL 109 1.187 -8.039 3.336 760 HG23 VAL 109 2HG2 VAL 109 1.631 -7.973 1.631 761 H ARG 110 H ARG 110 -0.991 -4.262 4.631 762 HA ARG 110 HA ARG 110 -2.380 -2.749 2.537 763 HB2 ARG 110 1HB ARG 110 -4.260 -2.286 3.862 764 HB3 ARG 110 2HB ARG 110 -3.979 -4.005 4.099 765 HG2 ARG 110 1HG ARG 110 -4.277 -3.422 6.260 766 HG3 ARG 110 2HG ARG 110 -2.550 -3.076 6.146 767 HD2 ARG 110 1HD ARG 110 -2.858 -0.822 6.199 768 HD3 ARG 110 2HD ARG 110 -4.420 -0.908 5.385 769 HE ARG 110 HE ARG 110 -3.975 -0.824 8.179 770 HH11 ARG 110 1HH1 ARG 110 -6.022 -2.274 5.766 771 HH12 ARG 110 2HH1 ARG 110 -7.372 -2.459 6.835 772 HH21 ARG 110 1HH2 ARG 110 -5.746 -1.062 9.597 773 HH22 ARG 110 2HH2 ARG 110 -7.215 -1.769 9.013 774 H VAL 111 H VAL 111 -1.963 -0.604 2.535 775 HA VAL 111 HA VAL 111 -0.442 0.490 4.812 776 HB VAL 111 HB VAL 111 0.964 1.745 3.342 777 HG11 VAL 111 1HG1 VAL 111 2.317 0.052 2.590 778 HG12 VAL 111 2HG1 VAL 111 1.267 -0.840 3.694 779 HG13 VAL 111 3HG1 VAL 111 0.968 -0.891 1.955 780 HG21 VAL 111 3HG2 VAL 111 -1.101 1.089 1.372 781 HG22 VAL 111 1HG2 VAL 111 -0.016 2.477 1.463 782 HG23 VAL 111 2HG2 VAL 111 0.548 0.962 0.760 783 H TYR 112 H TYR 112 -1.037 2.462 5.541 784 HA TYR 112 HA TYR 112 -2.973 4.010 3.966 785 HB2 TYR 112 1HB TYR 112 -4.498 4.219 5.714 786 HB3 TYR 112 2HB TYR 112 -3.992 2.539 5.852 787 HD1 TYR 112 2HD TYR 112 -3.786 5.876 7.359 788 HD2 TYR 112 1HD TYR 112 -2.659 1.790 7.727 789 HE1 TYR 112 2HE TYR 112 -3.134 6.273 9.697 790 HE2 TYR 112 1HE TYR 112 -2.005 2.175 10.067 791 HH TYR 112 HH TYR 112 -2.490 3.746 11.879 792 H ALA 113 H ALA 113 -3.105 6.261 4.556 793 HA ALA 113 HA ALA 113 -0.701 7.232 5.960 794 HB1 ALA 113 1HB ALA 113 -0.664 9.136 4.409 795 HB2 ALA 113 2HB ALA 113 -0.466 7.596 3.572 796 HB3 ALA 113 3HB ALA 113 -2.019 8.432 3.527 797 H THR 114 H THR 114 -1.084 8.495 7.654 798 HA THR 114 HA THR 114 -3.779 9.289 8.290 799 HB THR 114 HB THR 114 -2.189 8.465 10.024 800 HG1 THR 114 1HG THR 114 -3.839 9.597 10.894 801 HG21 THR 114 3HG2 THR 114 -0.526 10.489 8.915 802 HG22 THR 114 1HG2 THR 114 -0.147 9.338 10.195 803 HG23 THR 114 2HG2 THR 114 -0.849 10.905 10.598 804 H THR 115 H THR 115 -1.208 10.674 6.599 805 HA THR 115 HA THR 115 -1.637 13.413 7.292 806 HB THR 115 HB THR 115 -0.360 12.399 4.752 807 HG1 THR 115 1HG THR 115 0.423 11.666 7.046 808 HG21 THR 115 3HG2 THR 115 -0.371 14.650 4.451 809 HG22 THR 115 1HG2 THR 115 1.054 14.562 5.486 810 HG23 THR 115 2HG2 THR 115 -0.512 14.989 6.176 811 H ARG 116 H ARG 116 -2.415 15.063 5.797 812 HA ARG 116 HA ARG 116 -4.985 14.505 4.824 813 HB2 ARG 116 1HB ARG 116 -3.278 16.834 3.951 814 HB3 ARG 116 2HB ARG 116 -5.033 16.758 4.045 815 HG2 ARG 116 1HG ARG 116 -4.146 16.194 6.625 816 HG3 ARG 116 2HG ARG 116 -3.116 17.509 6.055 817 HD2 ARG 116 1HD ARG 116 -5.097 18.385 7.160 818 HD3 ARG 116 2HD ARG 116 -5.106 18.797 5.446 819 HE ARG 116 HE ARG 116 -6.553 16.392 6.093 820 HH11 ARG 116 1HH1 ARG 116 -6.713 19.854 5.765 821 HH12 ARG 116 2HH1 ARG 116 -8.427 19.881 5.505 822 HH21 ARG 116 1HH2 ARG 116 -8.808 16.414 5.752 823 HH22 ARG 116 2HH2 ARG 116 -9.617 17.923 5.498 824 H ALA 117 H ALA 117 -5.150 15.787 2.358 825 HA ALA 117 HA ALA 117 -3.376 14.640 0.441 826 HB1 ALA 117 1HB ALA 117 -6.061 13.511 0.010 827 HB2 ALA 117 2HB ALA 117 -4.470 12.807 -0.280 828 HB3 ALA 117 3HB ALA 117 -5.145 12.816 1.348 829 H THR 118 H THR 118 -3.268 16.602 -0.548 830 HA THR 118 HA THR 118 -5.369 18.370 -1.021 831 HB THR 118 HB THR 118 -3.346 18.368 -3.141 832 HG1 THR 118 1HG THR 118 -2.472 18.730 -0.455 833 HG21 THR 118 3HG2 THR 118 -4.219 20.442 -2.996 834 HG22 THR 118 1HG2 THR 118 -3.029 20.658 -1.713 835 HG23 THR 118 2HG2 THR 118 -4.694 20.235 -1.311 836 H ALA 119 H ALA 119 -5.166 18.885 -3.815 837 HA ALA 119 HA ALA 119 -7.335 17.637 -4.866 838 HB1 ALA 119 1HB ALA 119 -5.456 19.405 -5.820 839 HB2 ALA 119 2HB ALA 119 -5.307 18.032 -6.915 840 HB3 ALA 119 3HB ALA 119 -6.869 18.822 -6.699 841 H TYR 120 H TYR 120 -4.092 16.362 -4.654 842 HA TYR 120 HA TYR 120 -4.933 13.951 -6.114 843 HB2 TYR 120 1HB TYR 120 -2.656 15.459 -6.411 844 HB3 TYR 120 2HB TYR 120 -2.102 14.155 -5.365 845 HD1 TYR 120 2HD TYR 120 -4.087 12.077 -6.549 846 HD2 TYR 120 1HD TYR 120 -1.326 14.798 -8.303 847 HE1 TYR 120 2HE TYR 120 -3.878 10.597 -8.502 848 HE2 TYR 120 1HE TYR 120 -1.111 13.326 -10.262 849 HH TYR 120 HH TYR 120 -3.210 10.633 -10.776 850 H GLY 121 H GLY 121 -5.889 12.640 -4.654 851 HA2 GLY 121 2HA GLY 121 -5.464 12.409 -1.957 852 HA3 GLY 121 3HA GLY 121 -5.980 11.070 -2.972 853 H TYR 122 H TYR 122 -4.478 9.544 -3.659 854 HA TYR 122 HA TYR 122 -1.721 9.830 -2.738 855 HB2 TYR 122 1HB TYR 122 -1.695 7.944 -1.386 856 HB3 TYR 122 2HB TYR 122 -3.274 8.627 -1.017 857 HD1 TYR 122 2HD TYR 122 -5.177 7.750 -2.743 858 HD2 TYR 122 1HD TYR 122 -1.623 5.665 -1.682 859 HE1 TYR 122 2HE TYR 122 -6.246 5.623 -3.365 860 HE2 TYR 122 1HE TYR 122 -2.682 3.533 -2.302 861 HH TYR 122 HH TYR 122 -5.282 2.738 -2.429 862 H SER 123 H SER 123 -0.298 9.040 -4.158 863 HA SER 123 HA SER 123 -1.346 7.433 -6.387 864 HB2 SER 123 1HB SER 123 0.571 9.649 -6.210 865 HB3 SER 123 2HB SER 123 1.133 8.302 -7.201 866 HG SER 123 HG SER 123 -0.034 9.635 -8.525 867 H LEU 124 H LEU 124 -0.263 5.595 -7.082 868 HA LEU 124 HA LEU 124 1.962 4.652 -5.413 869 HB2 LEU 124 1HB LEU 124 -0.242 3.693 -4.681 870 HB3 LEU 124 2HB LEU 124 -0.346 2.913 -6.259 871 HG LEU 124 HG LEU 124 2.161 2.255 -5.041 872 HD11 LEU 124 1HD1 LEU 124 0.121 1.016 -3.364 873 HD12 LEU 124 2HD1 LEU 124 0.318 2.744 -3.076 874 HD13 LEU 124 3HD1 LEU 124 1.704 1.664 -2.937 875 HD21 LEU 124 3HD2 LEU 124 0.029 1.052 -6.497 876 HD22 LEU 124 1HD2 LEU 124 0.383 0.056 -5.085 877 HD23 LEU 124 2HD2 LEU 124 1.666 0.450 -6.230 878 H TRP 125 H TRP 125 3.271 5.259 -7.229 879 HA TRP 125 HA TRP 125 2.933 3.605 -9.628 880 HB2 TRP 125 1HB TRP 125 4.464 6.139 -9.079 881 HB3 TRP 125 2HB TRP 125 4.783 5.164 -10.511 882 HD1 TRP 125 HD TRP 125 1.424 6.316 -8.919 883 HE1 TRP 125 1HE TRP 125 0.014 7.412 -10.772 884 HE3 TRP 125 3HE TRP 125 4.739 5.938 -12.792 885 HZ2 TRP 125 2HZ TRP 125 0.273 8.034 -13.514 886 HZ3 TRP 125 3HZ TRP 125 4.081 6.808 -14.997 887 HH2 TRP 125 HH TRP 125 1.894 7.833 -15.348 888 H GLU 126 H GLU 126 4.797 3.880 -6.791 889 HA GLU 126 HA GLU 126 6.575 1.762 -7.753 890 HB2 GLU 126 1HB GLU 126 7.651 4.040 -6.106 891 HB3 GLU 126 2HB GLU 126 8.550 2.798 -6.966 892 HG2 GLU 126 1HG GLU 126 7.380 3.863 -9.063 893 HG3 GLU 126 2HG GLU 126 7.254 5.264 -8.001 894 H PHE 127 H PHE 127 5.046 0.506 -6.469 895 HA PHE 127 HA PHE 127 5.738 0.588 -3.608 896 HB2 PHE 127 1HB PHE 127 3.468 1.394 -3.815 897 HB3 PHE 127 2HB PHE 127 3.032 0.028 -4.838 898 HD1 PHE 127 2HD PHE 127 5.123 -0.243 -1.822 899 HD2 PHE 127 1HD PHE 127 1.247 -0.781 -3.496 900 HE1 PHE 127 2HE PHE 127 4.442 -1.513 0.171 901 HE2 PHE 127 1HE PHE 127 0.560 -2.052 -1.503 902 HZ PHE 127 HZ PHE 127 2.158 -2.419 0.333 903 H GLU 128 H GLU 128 7.138 -1.074 -3.470 904 HA GLU 128 HA GLU 128 6.235 -3.690 -4.485 905 HB2 GLU 128 1HB GLU 128 9.049 -2.617 -4.247 906 HB3 GLU 128 2HB GLU 128 8.659 -4.287 -4.630 907 HG2 GLU 128 1HG GLU 128 8.161 -3.816 -6.759 908 HG3 GLU 128 2HG GLU 128 7.335 -2.315 -6.340 909 H VAL 129 H VAL 129 5.862 -5.173 -2.982 910 HA VAL 129 HA VAL 129 7.387 -5.120 -0.483 911 HB VAL 129 HB VAL 129 5.408 -3.934 0.142 912 HG11 VAL 129 1HG1 VAL 129 3.186 -4.642 -0.305 913 HG12 VAL 129 2HG1 VAL 129 4.067 -4.740 -1.832 914 HG13 VAL 129 3HG1 VAL 129 3.735 -6.206 -0.909 915 HG21 VAL 129 3HG2 VAL 129 4.538 -6.552 1.155 916 HG22 VAL 129 1HG2 VAL 129 6.250 -6.193 1.386 917 HG23 VAL 129 2HG2 VAL 129 5.023 -5.100 2.029 918 H TYR 130 H TYR 130 8.325 -7.048 -0.390 919 HA TYR 130 HA TYR 130 6.953 -9.449 -0.127 920 HB2 TYR 130 1HB TYR 130 7.738 -10.524 -2.323 921 HB3 TYR 130 2HB TYR 130 6.329 -9.472 -2.394 922 HD1 TYR 130 2HD TYR 130 10.032 -9.381 -2.844 923 HD2 TYR 130 1HD TYR 130 6.256 -7.787 -3.984 924 HE1 TYR 130 2HE TYR 130 11.133 -8.035 -4.583 925 HE2 TYR 130 1HE TYR 130 7.346 -6.437 -5.728 926 HH TYR 130 HH TYR 130 10.706 -5.988 -5.873 927 H GLY 131 H GLY 131 8.402 -11.341 -0.062 928 HA2 GLY 131 2HA GLY 131 10.902 -10.637 1.134 929 HA3 GLY 131 3HA GLY 131 10.302 -12.266 0.857 Start of MODEL 8 1 H ASN 1 H ASN 1 -6.793 -16.940 -17.598 2 HA ASN 1 HA ASN 1 -5.444 -16.463 -15.828 3 HB2 ASN 1 1HB ASN 1 -4.254 -14.219 -17.434 4 HB3 ASN 1 2HB ASN 1 -3.456 -15.320 -16.314 5 HD21 ASN 1 1HD2 ASN 1 -4.117 -14.641 -19.522 6 HD22 ASN 1 2HD2 ASN 1 -3.600 -16.138 -20.215 7 H LEU 2 H LEU 2 -6.885 -15.705 -14.321 8 HA LEU 2 HA LEU 2 -7.038 -12.776 -14.069 9 HB2 LEU 2 1HB LEU 2 -9.188 -14.835 -13.795 10 HB3 LEU 2 2HB LEU 2 -9.284 -13.333 -12.878 11 HG LEU 2 HG LEU 2 -10.619 -13.179 -14.891 12 HD11 LEU 2 1HD1 LEU 2 -10.070 -11.035 -14.901 13 HD12 LEU 2 2HD1 LEU 2 -8.696 -11.398 -15.945 14 HD13 LEU 2 3HD1 LEU 2 -8.500 -11.411 -14.193 15 HD21 LEU 2 3HD2 LEU 2 -8.220 -13.330 -16.643 16 HD22 LEU 2 1HD2 LEU 2 -9.910 -13.679 -17.004 17 HD23 LEU 2 2HD2 LEU 2 -8.950 -14.836 -16.086 18 H ALA 3 H ALA 3 -5.232 -14.815 -12.881 19 HA ALA 3 HA ALA 3 -5.795 -14.214 -10.052 20 HB1 ALA 3 1HB ALA 3 -5.943 -16.714 -11.037 21 HB2 ALA 3 2HB ALA 3 -4.232 -16.650 -10.611 22 HB3 ALA 3 3HB ALA 3 -5.458 -16.341 -9.382 23 H LEU 4 H LEU 4 -4.229 -13.132 -9.050 24 HA LEU 4 HA LEU 4 -1.468 -13.580 -9.426 25 HB2 LEU 4 1HB LEU 4 -2.156 -12.336 -11.548 26 HB3 LEU 4 2HB LEU 4 -2.376 -10.930 -10.509 27 HG LEU 4 HG LEU 4 0.073 -11.314 -9.820 28 HD11 LEU 4 1HD1 LEU 4 0.921 -13.220 -10.634 29 HD12 LEU 4 2HD1 LEU 4 1.129 -12.298 -12.122 30 HD13 LEU 4 3HD1 LEU 4 -0.286 -13.329 -11.915 31 HD21 LEU 4 3HD2 LEU 4 -0.977 -9.559 -11.416 32 HD22 LEU 4 1HD2 LEU 4 -0.220 -10.519 -12.688 33 HD23 LEU 4 2HD2 LEU 4 0.771 -9.795 -11.420 34 H ASN 5 H ASN 5 -0.287 -12.680 -7.795 35 HA ASN 5 HA ASN 5 -1.681 -11.640 -5.561 36 HB2 ASN 5 1HB ASN 5 1.293 -11.380 -5.889 37 HB3 ASN 5 2HB ASN 5 0.365 -11.707 -4.429 38 HD21 ASN 5 1HD2 ASN 5 -1.246 -13.762 -5.283 39 HD22 ASN 5 2HD2 ASN 5 -0.272 -15.147 -5.631 40 H LYS 6 H LYS 6 -0.542 -10.166 -8.368 41 HA LYS 6 HA LYS 6 0.247 -7.638 -7.372 42 HB2 LYS 6 1HB LYS 6 0.605 -8.664 -9.718 43 HB3 LYS 6 2HB LYS 6 -1.007 -8.055 -10.073 44 HG2 LYS 6 1HG LYS 6 0.662 -6.492 -10.840 45 HG3 LYS 6 2HG LYS 6 -0.260 -5.786 -9.511 46 HD2 LYS 6 1HD LYS 6 1.651 -5.392 -8.446 47 HD3 LYS 6 2HD LYS 6 1.925 -7.132 -8.350 48 HE2 LYS 6 1HE LYS 6 2.741 -6.747 -10.848 49 HE3 LYS 6 2HE LYS 6 3.046 -5.125 -10.229 50 HZ1 LYS 6 3HZ LYS 6 3.999 -7.423 -8.675 51 HZ2 LYS 6 1HZ LYS 6 4.652 -5.867 -8.809 52 HZ3 LYS 6 2HZ LYS 6 4.855 -6.981 -10.066 53 H ALA 7 H ALA 7 -2.773 -9.139 -7.531 54 HA ALA 7 HA ALA 7 -4.514 -7.026 -8.084 55 HB1 ALA 7 1HB ALA 7 -4.719 -9.634 -6.719 56 HB2 ALA 7 2HB ALA 7 -5.970 -8.451 -6.334 57 HB3 ALA 7 3HB ALA 7 -5.707 -8.941 -8.007 58 H THR 8 H THR 8 -5.241 -5.322 -6.950 59 HA THR 8 HA THR 8 -4.729 -5.171 -4.075 60 HB THR 8 HB THR 8 -3.409 -3.318 -4.092 61 HG1 THR 8 1HG THR 8 -3.488 -1.890 -6.097 62 HG21 THR 8 3HG2 THR 8 -1.706 -3.459 -5.752 63 HG22 THR 8 1HG2 THR 8 -2.811 -4.191 -6.916 64 HG23 THR 8 2HG2 THR 8 -2.300 -5.099 -5.493 65 H ALA 9 H ALA 9 -5.734 -3.068 -3.185 66 HA ALA 9 HA ALA 9 -7.989 -2.054 -4.684 67 HB1 ALA 9 1HB ALA 9 -9.525 -3.441 -3.887 68 HB2 ALA 9 2HB ALA 9 -8.323 -4.256 -2.885 69 HB3 ALA 9 3HB ALA 9 -9.181 -2.845 -2.264 70 H THR 10 H THR 10 -8.973 -0.222 -3.710 71 HA THR 10 HA THR 10 -7.753 0.810 -1.265 72 HB THR 10 HB THR 10 -7.113 2.910 -2.195 73 HG1 THR 10 1HG THR 10 -8.642 2.033 -4.361 74 HG21 THR 10 3HG2 THR 10 -5.260 2.293 -3.456 75 HG22 THR 10 1HG2 THR 10 -6.132 1.011 -4.294 76 HG23 THR 10 2HG2 THR 10 -5.661 0.800 -2.608 77 H SER 11 H SER 11 -8.802 3.043 -0.753 78 HA SER 11 HA SER 11 -11.664 2.610 -0.796 79 HB2 SER 11 1HB SER 11 -10.738 3.285 1.311 80 HB3 SER 11 2HB SER 11 -9.924 4.666 0.577 81 HG SER 11 HG SER 11 -11.799 5.374 1.579 82 H SER 12 H SER 12 -9.348 4.981 -2.013 83 HA SER 12 HA SER 12 -11.521 6.192 -3.594 84 HB2 SER 12 1HB SER 12 -9.582 7.404 -1.878 85 HB3 SER 12 2HB SER 12 -9.267 7.925 -3.533 86 HG SER 12 HG SER 12 -11.583 8.412 -3.612 87 H ILE 13 H ILE 13 -10.960 6.946 -5.732 88 HA ILE 13 HA ILE 13 -8.502 6.347 -6.983 89 HB ILE 13 HB ILE 13 -9.256 4.023 -6.697 90 HG12 ILE 13 1HG1 ILE 13 -9.547 4.609 -9.620 91 HG13 ILE 13 2HG1 ILE 13 -8.038 5.006 -8.805 92 HG21 ILE 13 1HG2 ILE 13 -11.504 4.593 -8.598 93 HG22 ILE 13 2HG2 ILE 13 -11.243 3.175 -7.584 94 HG23 ILE 13 3HG2 ILE 13 -11.722 4.706 -6.852 95 HD11 ILE 13 3HD1 ILE 13 -9.002 2.472 -9.744 96 HD12 ILE 13 1HD1 ILE 13 -7.399 2.921 -9.164 97 HD13 ILE 13 2HD1 ILE 13 -8.636 2.400 -8.020 98 H GLU 14 H GLU 14 -8.528 6.786 -9.286 99 HA GLU 14 HA GLU 14 -10.581 8.738 -9.952 100 HB2 GLU 14 1HB GLU 14 -7.851 8.096 -10.979 101 HB3 GLU 14 2HB GLU 14 -8.974 8.934 -12.041 102 HG2 GLU 14 1HG GLU 14 -9.174 10.334 -9.680 103 HG3 GLU 14 2HG GLU 14 -7.463 9.923 -9.771 104 H THR 15 H THR 15 -9.263 5.700 -11.179 105 HA THR 15 HA THR 15 -11.168 5.645 -13.372 106 HB THR 15 HB THR 15 -8.810 4.816 -13.636 107 HG1 THR 15 1HG THR 15 -10.939 2.984 -14.129 108 HG21 THR 15 3HG2 THR 15 -8.185 2.676 -12.759 109 HG22 THR 15 1HG2 THR 15 -9.791 2.426 -12.078 110 HG23 THR 15 2HG2 THR 15 -8.732 3.669 -11.409 111 H ALA 16 H ALA 16 -12.073 5.533 -10.551 112 HA ALA 16 HA ALA 16 -13.456 4.333 -9.174 113 HB1 ALA 16 1HB ALA 16 -14.607 3.293 -11.751 114 HB2 ALA 16 2HB ALA 16 -15.441 3.587 -10.224 115 HB3 ALA 16 3HB ALA 16 -14.855 4.945 -11.184 116 H GLY 17 H GLY 17 -10.969 2.996 -9.793 117 HA2 GLY 17 2HA GLY 17 -10.192 0.942 -8.939 118 HA3 GLY 17 3HA GLY 17 -11.809 0.280 -9.123 119 H HIS 18 H HIS 18 -8.706 0.556 -10.483 120 HA HIS 18 HA HIS 18 -9.040 -1.472 -12.339 121 HB2 HIS 18 1HB HIS 18 -10.242 0.884 -13.265 122 HB3 HIS 18 2HB HIS 18 -8.718 0.769 -14.140 123 HD1 HIS 18 1HD HIS 18 -10.993 -2.099 -13.151 124 HD2 HIS 18 2HD HIS 18 -9.578 -0.170 -16.549 125 HE1 HIS 18 1HE HIS 18 -11.805 -3.474 -15.094 126 H GLU 19 H GLU 19 -7.394 1.475 -11.441 127 HA GLU 19 HA GLU 19 -5.004 1.011 -12.896 128 HB2 GLU 19 1HB GLU 19 -5.784 2.778 -10.612 129 HB3 GLU 19 2HB GLU 19 -4.080 2.584 -10.999 130 HG2 GLU 19 1HG GLU 19 -6.246 3.644 -12.796 131 HG3 GLU 19 2HG GLU 19 -4.900 4.540 -12.095 132 H GLY 20 H GLY 20 -6.100 0.117 -9.668 133 HA2 GLY 20 2HA GLY 20 -3.677 -0.771 -8.598 134 HA3 GLY 20 3HA GLY 20 -5.263 -1.373 -8.138 135 H ASP 21 H ASP 21 -6.124 -2.607 -10.411 136 HA ASP 21 HA ASP 21 -4.514 -4.995 -10.388 137 HB2 ASP 21 1HB ASP 21 -6.948 -5.173 -10.358 138 HB3 ASP 21 2HB ASP 21 -7.049 -4.326 -11.899 139 H LYS 22 H LYS 22 -4.328 -2.177 -12.089 140 HA LYS 22 HA LYS 22 -3.658 -3.281 -14.673 141 HB2 LYS 22 1HB LYS 22 -4.289 -0.701 -13.621 142 HB3 LYS 22 2HB LYS 22 -2.729 -0.604 -14.426 143 HG2 LYS 22 1HG LYS 22 -4.812 -2.044 -15.914 144 HG3 LYS 22 2HG LYS 22 -5.109 -0.322 -15.667 145 HD2 LYS 22 1HD LYS 22 -2.703 0.012 -16.489 146 HD3 LYS 22 2HD LYS 22 -2.806 -1.653 -17.066 147 HE2 LYS 22 1HE LYS 22 -3.377 -0.175 -18.870 148 HE3 LYS 22 2HE LYS 22 -4.833 -1.024 -18.353 149 HZ1 LYS 22 3HZ LYS 22 -4.333 1.760 -18.430 150 HZ2 LYS 22 1HZ LYS 22 -4.715 1.291 -16.850 151 HZ3 LYS 22 2HZ LYS 22 -5.782 0.947 -18.116 152 H ALA 23 H ALA 23 -2.086 -3.141 -11.774 153 HA ALA 23 HA ALA 23 0.559 -2.526 -12.770 154 HB1 ALA 23 1HB ALA 23 -0.680 -2.626 -10.229 155 HB2 ALA 23 2HB ALA 23 0.660 -3.774 -10.215 156 HB3 ALA 23 3HB ALA 23 0.949 -2.085 -10.633 157 H VAL 24 H VAL 24 -1.364 -5.097 -13.204 158 HA VAL 24 HA VAL 24 -0.040 -7.385 -12.479 159 HB VAL 24 HB VAL 24 -1.488 -6.817 -15.066 160 HG11 VAL 24 1HG1 VAL 24 -0.580 -8.734 -15.784 161 HG12 VAL 24 2HG1 VAL 24 -0.023 -9.184 -14.171 162 HG13 VAL 24 3HG1 VAL 24 -1.688 -9.512 -14.655 163 HG21 VAL 24 3HG2 VAL 24 -2.718 -8.598 -13.115 164 HG22 VAL 24 1HG2 VAL 24 -2.448 -6.970 -12.493 165 HG23 VAL 24 2HG2 VAL 24 -3.394 -7.206 -13.963 166 H ASP 25 H ASP 25 0.807 -5.108 -14.993 167 HA ASP 25 HA ASP 25 2.586 -6.612 -16.500 168 HB2 ASP 25 1HB ASP 25 2.935 -3.697 -15.782 169 HB3 ASP 25 2HB ASP 25 3.560 -4.522 -17.207 170 H GLY 26 H GLY 26 3.072 -4.960 -13.423 171 HA2 GLY 26 2HA GLY 26 4.656 -5.404 -11.791 172 HA3 GLY 26 3HA GLY 26 5.342 -6.635 -12.840 173 H ASN 27 H ASN 27 4.848 -3.302 -13.813 174 HA ASN 27 HA ASN 27 7.644 -2.642 -13.386 175 HB2 ASN 27 1HB ASN 27 7.016 -3.783 -15.776 176 HB3 ASN 27 2HB ASN 27 6.769 -2.079 -16.148 177 HD21 ASN 27 1HD2 ASN 27 8.806 -3.977 -17.076 178 HD22 ASN 27 2HD2 ASN 27 10.327 -3.256 -16.688 179 H ALA 28 H ALA 28 7.820 -0.381 -14.931 180 HA ALA 28 HA ALA 28 6.190 1.448 -13.428 181 HB1 ALA 28 1HB ALA 28 8.445 2.092 -13.812 182 HB2 ALA 28 2HB ALA 28 8.281 1.863 -15.553 183 HB3 ALA 28 3HB ALA 28 7.429 3.183 -14.754 184 H ALA 29 H ALA 29 5.537 -0.351 -16.085 185 HA ALA 29 HA ALA 29 4.337 1.495 -17.857 186 HB1 ALA 29 1HB ALA 29 3.466 -0.361 -18.995 187 HB2 ALA 29 2HB ALA 29 4.986 -0.931 -18.304 188 HB3 ALA 29 3HB ALA 29 3.455 -1.357 -17.539 189 H THR 30 H THR 30 3.426 0.474 -14.775 190 HA THR 30 HA THR 30 0.596 1.112 -15.252 191 HB THR 30 HB THR 30 0.693 -0.975 -14.177 192 HG1 THR 30 1HG THR 30 0.470 0.660 -11.890 193 HG21 THR 30 3HG2 THR 30 2.750 -1.444 -13.356 194 HG22 THR 30 1HG2 THR 30 2.031 -0.909 -11.838 195 HG23 THR 30 2HG2 THR 30 3.016 0.203 -12.787 196 H ARG 31 H ARG 31 -0.387 2.795 -14.241 197 HA ARG 31 HA ARG 31 1.144 4.321 -12.259 198 HB2 ARG 31 1HB ARG 31 -0.289 5.609 -14.585 199 HB3 ARG 31 2HB ARG 31 0.672 6.417 -13.354 200 HG2 ARG 31 1HG ARG 31 2.328 6.318 -14.841 201 HG3 ARG 31 2HG ARG 31 2.452 4.618 -14.387 202 HD2 ARG 31 1HD ARG 31 2.348 4.715 -16.764 203 HD3 ARG 31 2HD ARG 31 0.796 4.106 -16.192 204 HE ARG 31 HE ARG 31 0.465 6.819 -16.428 205 HH11 ARG 31 1HH1 ARG 31 1.378 4.215 -18.550 206 HH12 ARG 31 2HH1 ARG 31 0.721 4.966 -19.967 207 HH21 ARG 31 1HH2 ARG 31 -0.403 7.819 -18.286 208 HH22 ARG 31 2HH2 ARG 31 -0.290 7.016 -19.816 209 H TRP 32 H TRP 32 -0.063 4.455 -10.496 210 HA TRP 32 HA TRP 32 -2.947 4.184 -10.656 211 HB2 TRP 32 1HB TRP 32 -1.891 2.936 -8.907 212 HB3 TRP 32 2HB TRP 32 -1.027 4.360 -8.332 213 HD1 TRP 32 HD TRP 32 -2.528 6.244 -7.039 214 HE1 TRP 32 1HE TRP 32 -4.681 5.985 -5.653 215 HE3 TRP 32 3HE TRP 32 -4.008 1.639 -8.694 216 HZ2 TRP 32 2HZ TRP 32 -6.735 4.080 -5.308 217 HZ3 TRP 32 3HZ TRP 32 -6.079 0.670 -7.785 218 HH2 TRP 32 HH TRP 32 -7.412 1.866 -6.126 219 H ALA 33 H ALA 33 -4.439 5.735 -10.155 220 HA ALA 33 HA ALA 33 -3.476 8.384 -9.349 221 HB1 ALA 33 1HB ALA 33 -5.454 8.078 -11.590 222 HB2 ALA 33 2HB ALA 33 -4.582 9.527 -11.083 223 HB3 ALA 33 3HB ALA 33 -3.716 8.206 -11.869 224 H SER 34 H SER 34 -4.598 9.058 -7.654 225 HA SER 34 HA SER 34 -7.184 7.841 -7.067 226 HB2 SER 34 1HB SER 34 -5.176 9.390 -5.463 227 HB3 SER 34 2HB SER 34 -6.839 9.248 -4.890 228 HG SER 34 HG SER 34 -6.410 6.868 -5.362 229 H ALA 35 H ALA 35 -9.043 9.072 -6.561 230 HA ALA 35 HA ALA 35 -9.179 11.586 -8.043 231 HB1 ALA 35 1HB ALA 35 -11.710 11.225 -7.472 232 HB2 ALA 35 2HB ALA 35 -10.933 10.282 -8.745 233 HB3 ALA 35 3HB ALA 35 -11.184 9.571 -7.150 234 H TYR 36 H TYR 36 -7.890 11.432 -5.414 235 HA TYR 36 HA TYR 36 -7.899 12.426 -3.351 236 HB2 TYR 36 1HB TYR 36 -8.508 14.812 -3.417 237 HB3 TYR 36 2HB TYR 36 -7.541 14.348 -4.813 238 HD1 TYR 36 1HD TYR 36 -10.950 15.204 -3.680 239 HD2 TYR 36 2HD TYR 36 -8.410 14.517 -7.025 240 HE1 TYR 36 1HE TYR 36 -12.676 16.122 -5.172 241 HE2 TYR 36 2HE TYR 36 -10.130 15.434 -8.525 242 HH TYR 36 HH TYR 36 -13.303 16.414 -7.303 243 H GLY 37 H GLY 37 -9.577 14.124 -2.031 244 HA2 GLY 37 2HA GLY 37 -11.475 14.179 -0.741 245 HA3 GLY 37 3HA GLY 37 -12.312 13.460 -2.110 246 H ALA 38 H ALA 38 -12.887 12.875 0.587 247 HA ALA 38 HA ALA 38 -13.358 11.084 1.912 248 HB1 ALA 38 1HB ALA 38 -13.560 8.957 0.937 249 HB2 ALA 38 2HB ALA 38 -13.883 10.094 -0.373 250 HB3 ALA 38 3HB ALA 38 -12.314 9.296 -0.265 251 H SER 39 H SER 39 -10.990 12.336 2.435 252 HA SER 39 HA SER 39 -8.960 10.259 2.759 253 HB2 SER 39 1HB SER 39 -7.448 11.927 2.692 254 HB3 SER 39 2HB SER 39 -8.783 12.960 2.180 255 HG SER 39 HG SER 39 -7.641 12.658 4.735 256 HA PRO 40 HA PRO 40 -6.937 10.675 4.170 257 HB2 PRO 40 1HB PRO 40 -5.946 8.602 5.615 258 HB3 PRO 40 2HB PRO 40 -5.915 10.274 6.188 259 HG2 PRO 40 1HG PRO 40 -7.828 8.074 6.868 260 HG3 PRO 40 2HG PRO 40 -7.070 9.267 7.938 261 HD2 PRO 40 1HD PRO 40 -9.614 9.517 7.049 262 HD3 PRO 40 2HD PRO 40 -8.573 10.919 7.369 263 H GLN 41 H GLN 41 -5.817 8.920 2.996 264 HA GLN 41 HA GLN 41 -7.745 6.921 2.022 265 HB2 GLN 41 1HB GLN 41 -5.866 8.708 0.668 266 HB3 GLN 41 2HB GLN 41 -5.746 7.038 0.128 267 HG2 GLN 41 1HG GLN 41 -8.195 7.057 -0.279 268 HG3 GLN 41 2HG GLN 41 -8.200 8.775 0.112 269 HE21 GLN 41 1HE2 GLN 41 -6.929 6.365 -2.105 270 HE22 GLN 41 2HE2 GLN 41 -6.676 7.446 -3.428 271 H TRP 42 H TRP 42 -6.506 5.004 0.932 272 HA TRP 42 HA TRP 42 -4.009 4.223 2.027 273 HB2 TRP 42 1HB TRP 42 -4.809 2.383 3.472 274 HB3 TRP 42 2HB TRP 42 -5.292 3.964 4.082 275 HD1 TRP 42 HD TRP 42 -7.946 4.668 3.428 276 HE1 TRP 42 1HE TRP 42 -10.025 3.152 3.449 277 HE3 TRP 42 3HE TRP 42 -5.635 0.114 3.187 278 HZ2 TRP 42 2HZ TRP 42 -10.610 0.392 3.373 279 HZ3 TRP 42 3HZ TRP 42 -7.027 -1.916 3.166 280 HH2 TRP 42 HH TRP 42 -9.463 -1.777 3.257 281 H ILE 43 H ILE 43 -3.317 2.145 1.281 282 HA ILE 43 HA ILE 43 -5.077 0.844 -0.671 283 HB ILE 43 HB ILE 43 -3.745 2.318 -2.025 284 HG12 ILE 43 1HG1 ILE 43 -2.288 -0.272 -2.363 285 HG13 ILE 43 2HG1 ILE 43 -4.038 -0.255 -2.549 286 HG21 ILE 43 1HG2 ILE 43 -1.373 2.445 -1.962 287 HG22 ILE 43 2HG2 ILE 43 -1.941 2.602 -0.300 288 HG23 ILE 43 3HG2 ILE 43 -1.265 1.073 -0.861 289 HD11 ILE 43 3HD1 ILE 43 -3.613 0.242 -4.675 290 HD12 ILE 43 1HD1 ILE 43 -3.275 1.868 -4.084 291 HD13 ILE 43 2HD1 ILE 43 -1.953 0.727 -4.327 292 H TYR 44 H TYR 44 -5.045 -1.305 -0.515 293 HA TYR 44 HA TYR 44 -2.794 -2.559 0.916 294 HB2 TYR 44 1HB TYR 44 -4.265 -4.048 1.994 295 HB3 TYR 44 2HB TYR 44 -5.073 -2.487 2.092 296 HD1 TYR 44 2HD TYR 44 -5.102 -5.792 0.487 297 HD2 TYR 44 1HD TYR 44 -7.131 -2.078 0.910 298 HE1 TYR 44 2HE TYR 44 -7.096 -6.768 -0.572 299 HE2 TYR 44 1HE TYR 44 -9.132 -3.043 -0.147 300 HH TYR 44 HH TYR 44 -10.140 -5.121 -0.625 301 H ILE 45 H ILE 45 -2.139 -4.635 0.237 302 HA ILE 45 HA ILE 45 -3.059 -5.376 -2.465 303 HB ILE 45 HB ILE 45 -0.265 -5.588 -1.337 304 HG12 ILE 45 1HG1 ILE 45 -1.455 -3.894 -3.541 305 HG13 ILE 45 2HG1 ILE 45 -0.791 -3.325 -2.013 306 HG21 ILE 45 1HG2 ILE 45 -0.810 -7.517 -2.728 307 HG22 ILE 45 2HG2 ILE 45 -1.323 -6.442 -4.028 308 HG23 ILE 45 3HG2 ILE 45 0.368 -6.473 -3.524 309 HD11 ILE 45 3HD1 ILE 45 0.928 -2.879 -3.452 310 HD12 ILE 45 1HD1 ILE 45 1.385 -4.480 -2.870 311 HD13 ILE 45 2HD1 ILE 45 0.612 -4.302 -4.446 312 H ASN 46 H ASN 46 -3.711 -7.418 -2.760 313 HA ASN 46 HA ASN 46 -3.555 -9.242 -0.481 314 HB2 ASN 46 1HB ASN 46 -5.210 -10.587 -1.890 315 HB3 ASN 46 2HB ASN 46 -5.773 -9.035 -1.276 316 HD21 ASN 46 1HD2 ASN 46 -6.385 -7.487 -2.673 317 HD22 ASN 46 2HD2 ASN 46 -6.351 -7.654 -4.392 318 H LEU 47 H LEU 47 -2.572 -11.214 -0.546 319 HA LEU 47 HA LEU 47 -0.946 -11.771 -2.935 320 HB2 LEU 47 1HB LEU 47 0.068 -11.308 -0.577 321 HB3 LEU 47 2HB LEU 47 -0.405 -12.974 -0.254 322 HG LEU 47 HG LEU 47 1.195 -12.504 -2.699 323 HD11 LEU 47 1HD1 LEU 47 2.507 -11.097 -1.405 324 HD12 LEU 47 2HD1 LEU 47 3.269 -12.670 -1.171 325 HD13 LEU 47 3HD1 LEU 47 2.208 -12.012 0.073 326 HD21 LEU 47 3HD2 LEU 47 2.337 -14.563 -1.579 327 HD22 LEU 47 1HD2 LEU 47 0.758 -14.738 -2.346 328 HD23 LEU 47 2HD2 LEU 47 0.875 -14.597 -0.592 329 H GLY 48 H GLY 48 -2.596 -13.477 -0.267 330 HA2 GLY 48 2HA GLY 48 -4.347 -15.094 -1.027 331 HA3 GLY 48 3HA GLY 48 -3.147 -15.666 -2.176 332 H SER 49 H SER 49 -1.045 -15.265 -0.022 333 HA SER 49 HA SER 49 -1.729 -17.250 1.965 334 HB2 SER 49 1HB SER 49 0.244 -18.705 1.316 335 HB3 SER 49 2HB SER 49 -1.134 -18.771 0.218 336 HG SER 49 HG SER 49 0.171 -18.146 -1.289 337 H THR 50 H THR 50 0.206 -17.701 3.404 338 HA THR 50 HA THR 50 1.307 -15.210 4.240 339 HB THR 50 HB THR 50 2.746 -17.230 5.541 340 HG1 THR 50 1HG THR 50 1.510 -18.920 5.053 341 HG21 THR 50 3HG2 THR 50 0.201 -16.380 6.763 342 HG22 THR 50 1HG2 THR 50 1.263 -15.077 6.233 343 HG23 THR 50 2HG2 THR 50 1.847 -16.277 7.385 344 H GLN 51 H GLN 51 3.093 -14.248 3.543 345 HA GLN 51 HA GLN 51 5.238 -15.909 2.398 346 HB2 GLN 51 1HB GLN 51 3.686 -13.873 1.107 347 HB3 GLN 51 2HB GLN 51 5.359 -13.343 1.212 348 HG2 GLN 51 1HG GLN 51 5.526 -15.985 0.388 349 HG3 GLN 51 2HG GLN 51 4.152 -15.329 -0.500 350 HE21 GLN 51 1HE2 GLN 51 6.674 -16.162 -1.569 351 HE22 GLN 51 2HE2 GLN 51 7.392 -14.778 -2.314 352 H SER 52 H SER 52 7.338 -15.290 2.834 353 HA SER 52 HA SER 52 7.681 -13.673 5.194 354 HB2 SER 52 1HB SER 52 10.080 -14.326 4.973 355 HB3 SER 52 2HB SER 52 8.984 -15.707 4.993 356 HG SER 52 HG SER 52 9.566 -16.186 3.030 357 H ILE 53 H ILE 53 8.419 -11.638 5.326 358 HA ILE 53 HA ILE 53 9.576 -10.395 2.930 359 HB ILE 53 HB ILE 53 7.788 -8.690 4.567 360 HG12 ILE 53 1HG1 ILE 53 6.755 -10.761 2.619 361 HG13 ILE 53 2HG1 ILE 53 6.399 -10.671 4.340 362 HG21 ILE 53 1HG2 ILE 53 7.661 -7.418 2.674 363 HG22 ILE 53 2HG2 ILE 53 9.223 -8.191 2.410 364 HG23 ILE 53 3HG2 ILE 53 7.784 -8.809 1.597 365 HD11 ILE 53 3HD1 ILE 53 5.454 -8.329 3.755 366 HD12 ILE 53 1HD1 ILE 53 5.402 -8.964 2.110 367 HD13 ILE 53 2HD1 ILE 53 4.507 -9.774 3.397 368 H SER 54 H SER 54 10.935 -8.597 3.331 369 HA SER 54 HA SER 54 11.870 -8.418 6.121 370 HB2 SER 54 1HB SER 54 14.072 -7.679 4.986 371 HB3 SER 54 2HB SER 54 13.649 -9.390 4.930 372 HG SER 54 HG SER 54 14.338 -8.362 2.892 373 H ARG 55 H ARG 55 12.110 -6.513 3.111 374 HA ARG 55 HA ARG 55 11.189 -4.163 4.610 375 HB2 ARG 55 1HB ARG 55 12.891 -2.788 3.404 376 HB3 ARG 55 2HB ARG 55 13.579 -3.928 4.553 377 HG2 ARG 55 1HG ARG 55 13.461 -5.280 2.100 378 HG3 ARG 55 2HG ARG 55 14.067 -3.661 1.746 379 HD2 ARG 55 1HD ARG 55 15.977 -3.963 2.950 380 HD3 ARG 55 2HD ARG 55 15.206 -5.058 4.098 381 HE ARG 55 HE ARG 55 15.455 -6.190 1.481 382 HH11 ARG 55 1HH1 ARG 55 17.123 -5.589 4.476 383 HH12 ARG 55 2HH1 ARG 55 18.232 -6.905 4.274 384 HH21 ARG 55 1HH2 ARG 55 16.908 -7.925 1.203 385 HH22 ARG 55 2HH2 ARG 55 18.109 -8.232 2.410 386 H VAL 56 H VAL 56 9.921 -2.746 3.477 387 HA VAL 56 HA VAL 56 9.410 -3.386 0.646 388 HB VAL 56 HB VAL 56 7.535 -4.259 1.845 389 HG11 VAL 56 1HG1 VAL 56 7.149 -1.566 3.137 390 HG12 VAL 56 2HG1 VAL 56 6.266 -3.058 3.466 391 HG13 VAL 56 3HG1 VAL 56 7.965 -2.919 3.921 392 HG21 VAL 56 3HG2 VAL 56 6.171 -1.797 1.109 393 HG22 VAL 56 1HG2 VAL 56 7.326 -2.331 -0.112 394 HG23 VAL 56 2HG2 VAL 56 6.038 -3.413 0.417 395 H LYS 57 H LYS 57 9.313 -1.695 -0.723 396 HA LYS 57 HA LYS 57 9.292 1.013 0.434 397 HB2 LYS 57 1HB LYS 57 11.546 0.606 -0.243 398 HB3 LYS 57 2HB LYS 57 11.029 -0.083 -1.775 399 HG2 LYS 57 1HG LYS 57 10.195 2.697 -1.269 400 HG3 LYS 57 2HG LYS 57 11.925 2.429 -1.493 401 HD2 LYS 57 1HD LYS 57 10.249 1.014 -3.429 402 HD3 LYS 57 2HD LYS 57 10.096 2.771 -3.504 403 HE2 LYS 57 1HE LYS 57 12.530 2.968 -3.699 404 HE3 LYS 57 2HE LYS 57 12.677 1.213 -3.632 405 HZ1 LYS 57 3HZ LYS 57 12.128 1.021 -5.769 406 HZ2 LYS 57 1HZ LYS 57 12.434 2.681 -5.891 407 HZ3 LYS 57 2HZ LYS 57 10.854 2.128 -5.655 408 H LEU 58 H LEU 58 7.889 2.413 -0.445 409 HA LEU 58 HA LEU 58 6.727 1.794 -3.068 410 HB2 LEU 58 1HB LEU 58 4.498 2.366 -2.240 411 HB3 LEU 58 2HB LEU 58 5.167 0.956 -1.423 412 HG LEU 58 HG LEU 58 5.817 3.216 0.149 413 HD11 LEU 58 1HD1 LEU 58 3.145 3.353 -1.113 414 HD12 LEU 58 2HD1 LEU 58 4.186 4.643 -0.510 415 HD13 LEU 58 3HD1 LEU 58 3.237 3.675 0.619 416 HD21 LEU 58 3HD2 LEU 58 5.518 1.385 1.426 417 HD22 LEU 58 1HD2 LEU 58 4.290 0.708 0.357 418 HD23 LEU 58 2HD2 LEU 58 3.854 1.965 1.515 419 H ASN 59 H ASN 59 5.645 3.642 -4.073 420 HA ASN 59 HA ASN 59 6.946 6.159 -3.293 421 HB2 ASN 59 1HB ASN 59 7.605 5.906 -5.468 422 HB3 ASN 59 2HB ASN 59 6.191 4.948 -5.897 423 HD21 ASN 59 1HD2 ASN 59 7.628 8.022 -5.908 424 HD22 ASN 59 2HD2 ASN 59 6.305 8.900 -6.589 425 H TRP 60 H TRP 60 5.747 8.140 -3.460 426 HA TRP 60 HA TRP 60 2.853 7.752 -3.062 427 HB2 TRP 60 1HB TRP 60 4.683 8.813 -1.276 428 HB3 TRP 60 2HB TRP 60 3.948 10.242 -1.999 429 HD1 TRP 60 HD TRP 60 1.354 10.670 -1.515 430 HE1 TRP 60 1HE TRP 60 -0.234 9.755 0.292 431 HE3 TRP 60 3HE TRP 60 4.166 6.724 0.112 432 HZ2 TRP 60 2HZ TRP 60 -0.287 7.640 2.160 433 HZ3 TRP 60 3HZ TRP 60 3.275 5.304 1.912 434 HH2 TRP 60 HH TRP 60 1.095 5.755 2.914 435 H GLU 61 H GLU 61 5.222 9.156 -5.011 436 HA GLU 61 HA GLU 61 5.131 10.512 -6.836 437 HB2 GLU 61 1HB GLU 61 2.614 9.246 -6.721 438 HB3 GLU 61 2HB GLU 61 2.294 10.941 -7.066 439 HG2 GLU 61 1HG GLU 61 3.898 8.979 -8.662 440 HG3 GLU 61 2HG GLU 61 2.491 9.918 -9.157 441 H ASP 62 H ASP 62 3.339 12.554 -7.528 442 HA ASP 62 HA ASP 62 4.301 14.742 -6.207 443 HB2 ASP 62 1HB ASP 62 1.887 14.220 -7.851 444 HB3 ASP 62 2HB ASP 62 1.883 15.703 -6.899 445 H ALA 63 H ALA 63 1.502 12.784 -5.343 446 HA ALA 63 HA ALA 63 0.318 14.352 -3.410 447 HB1 ALA 63 1HB ALA 63 0.597 11.384 -3.694 448 HB2 ALA 63 2HB ALA 63 -0.239 12.087 -2.310 449 HB3 ALA 63 3HB ALA 63 -0.823 12.400 -3.943 450 H TYR 64 H TYR 64 1.389 15.435 -1.877 451 HA TYR 64 HA TYR 64 3.634 14.187 -0.499 452 HB2 TYR 64 1HB TYR 64 2.663 16.951 -0.897 453 HB3 TYR 64 2HB TYR 64 3.418 16.624 0.659 454 HD1 TYR 64 2HD TYR 64 4.403 14.910 -2.445 455 HD2 TYR 64 1HD TYR 64 5.331 18.029 0.296 456 HE1 TYR 64 2HE TYR 64 6.623 15.148 -3.477 457 HE2 TYR 64 1HE TYR 64 7.553 18.276 -0.730 458 HH TYR 64 HH TYR 64 8.670 17.796 -2.840 459 H ALA 65 H ALA 65 3.432 13.213 1.399 460 HA ALA 65 HA ALA 65 1.069 13.832 3.050 461 HB1 ALA 65 1HB ALA 65 0.771 11.633 2.254 462 HB2 ALA 65 2HB ALA 65 2.454 11.208 2.570 463 HB3 ALA 65 3HB ALA 65 1.342 11.468 3.914 464 H THR 66 H THR 66 1.342 14.111 5.235 465 HA THR 66 HA THR 66 3.958 14.887 6.106 466 HB THR 66 HB THR 66 2.944 15.612 8.128 467 HG1 THR 66 1HG THR 66 1.352 14.525 8.993 468 HG21 THR 66 3HG2 THR 66 2.303 16.785 5.947 469 HG22 THR 66 1HG2 THR 66 1.298 17.109 7.359 470 HG23 THR 66 2HG2 THR 66 0.738 15.989 6.118 471 H ALA 67 H ALA 67 2.402 11.936 5.944 472 HA ALA 67 HA ALA 67 4.440 10.487 7.158 473 HB1 ALA 67 1HB ALA 67 2.593 9.773 9.092 474 HB2 ALA 67 2HB ALA 67 4.043 10.746 9.334 475 HB3 ALA 67 3HB ALA 67 2.494 11.533 9.035 476 H TYR 68 H TYR 68 3.743 8.156 7.615 477 HA TYR 68 HA TYR 68 1.329 7.341 6.214 478 HB2 TYR 68 1HB TYR 68 2.969 5.601 5.011 479 HB3 TYR 68 2HB TYR 68 2.545 7.151 4.292 480 HD1 TYR 68 1HD TYR 68 5.121 5.567 6.477 481 HD2 TYR 68 2HD TYR 68 4.230 8.609 3.637 482 HE1 TYR 68 1HE TYR 68 7.503 6.170 6.385 483 HE2 TYR 68 2HE TYR 68 6.611 9.219 3.536 484 HH TYR 68 HH TYR 68 8.841 8.298 5.781 485 H SER 69 H SER 69 1.065 4.914 6.317 486 HA SER 69 HA SER 69 2.440 3.705 8.600 487 HB2 SER 69 1HB SER 69 -0.509 4.228 8.381 488 HB3 SER 69 2HB SER 69 0.075 2.834 9.289 489 HG SER 69 HG SER 69 1.174 5.376 9.765 490 H ILE 70 H ILE 70 2.811 1.566 8.377 491 HA ILE 70 HA ILE 70 1.517 0.190 6.115 492 HB ILE 70 HB ILE 70 4.208 0.813 6.279 493 HG12 ILE 70 1HG1 ILE 70 2.855 -1.413 4.738 494 HG13 ILE 70 2HG1 ILE 70 2.954 0.273 4.245 495 HG21 ILE 70 1HG2 ILE 70 5.384 -1.282 6.594 496 HG22 ILE 70 2HG2 ILE 70 4.477 -0.875 8.048 497 HG23 ILE 70 3HG2 ILE 70 3.867 -2.108 6.946 498 HD11 ILE 70 3HD1 ILE 70 5.377 0.082 4.076 499 HD12 ILE 70 1HD1 ILE 70 5.279 -1.606 4.577 500 HD13 ILE 70 2HD1 ILE 70 4.560 -1.097 3.049 501 H GLN 71 H GLN 71 0.722 -1.807 6.487 502 HA GLN 71 HA GLN 71 1.527 -3.295 8.850 503 HB2 GLN 71 1HB GLN 71 -1.077 -3.614 9.243 504 HB3 GLN 71 2HB GLN 71 -0.185 -2.296 9.990 505 HG2 GLN 71 1HG GLN 71 -1.487 -1.899 7.334 506 HG3 GLN 71 2HG GLN 71 -2.445 -1.829 8.813 507 HE21 GLN 71 1HE2 GLN 71 -1.195 0.104 6.668 508 HE22 GLN 71 2HE2 GLN 71 -0.672 1.431 7.643 509 H VAL 72 H VAL 72 0.116 -5.405 8.934 510 HA VAL 72 HA VAL 72 -0.572 -6.349 6.257 511 HB VAL 72 HB VAL 72 0.777 -8.405 6.542 512 HG11 VAL 72 1HG1 VAL 72 2.775 -6.227 6.749 513 HG12 VAL 72 2HG1 VAL 72 2.601 -7.496 5.536 514 HG13 VAL 72 3HG1 VAL 72 1.549 -6.080 5.490 515 HG21 VAL 72 3HG2 VAL 72 0.920 -8.140 9.061 516 HG22 VAL 72 1HG2 VAL 72 2.398 -8.643 8.241 517 HG23 VAL 72 2HG2 VAL 72 2.208 -6.971 8.767 518 H SER 73 H SER 73 -1.171 -8.854 6.548 519 HA SER 73 HA SER 73 -3.075 -8.926 8.790 520 HB2 SER 73 1HB SER 73 -4.590 -10.038 7.446 521 HB3 SER 73 2HB SER 73 -3.763 -9.052 6.239 522 HG SER 73 HG SER 73 -4.052 -11.510 5.980 523 H ASN 74 H ASN 74 -2.917 -10.467 10.294 524 HA ASN 74 HA ASN 74 -2.050 -13.084 9.932 525 HB2 ASN 74 1HB ASN 74 0.174 -12.686 11.338 526 HB3 ASN 74 2HB ASN 74 0.169 -12.624 9.578 527 HD21 ASN 74 1HD2 ASN 74 -0.842 -10.329 12.086 528 HD22 ASN 74 2HD2 ASN 74 0.148 -9.026 11.533 529 H ASP 75 H ASP 75 -2.250 -14.308 11.799 530 HA ASP 75 HA ASP 75 -2.288 -13.231 14.414 531 HB2 ASP 75 1HB ASP 75 -4.485 -12.386 13.263 532 HB3 ASP 75 2HB ASP 75 -5.044 -14.032 13.549 533 H SER 76 H SER 76 -3.658 -15.740 12.312 534 HA SER 76 HA SER 76 -3.036 -17.726 14.396 535 HB2 SER 76 1HB SER 76 -5.415 -17.642 13.792 536 HB3 SER 76 2HB SER 76 -5.003 -17.921 12.100 537 HG SER 76 HG SER 76 -5.373 -19.716 14.039 538 H GLY 77 H GLY 77 -1.745 -16.459 11.700 539 HA2 GLY 77 2HA GLY 77 0.210 -17.269 10.664 540 HA3 GLY 77 3HA GLY 77 -0.226 -18.897 11.164 541 H SER 78 H SER 78 -2.667 -19.314 10.164 542 HA SER 78 HA SER 78 -2.238 -19.053 7.265 543 HB2 SER 78 1HB SER 78 -2.455 -21.354 8.574 544 HB3 SER 78 2HB SER 78 -4.178 -21.026 8.391 545 HG SER 78 HG SER 78 -2.681 -22.135 6.626 546 H THR 79 H THR 79 -4.369 -18.299 9.864 547 HA THR 79 HA THR 79 -6.345 -17.252 7.941 548 HB THR 79 HB THR 79 -7.048 -17.869 10.794 549 HG1 THR 79 1HG THR 79 -7.866 -19.922 9.804 550 HG21 THR 79 3HG2 THR 79 -9.166 -18.456 9.111 551 HG22 THR 79 1HG2 THR 79 -8.426 -17.036 8.373 552 HG23 THR 79 2HG2 THR 79 -8.962 -16.978 10.052 553 HA PRO 80 HA PRO 80 -4.494 -13.615 10.096 554 HB2 PRO 80 1HB PRO 80 -4.535 -12.022 7.898 555 HB3 PRO 80 2HB PRO 80 -3.214 -13.142 8.249 556 HG2 PRO 80 1HG PRO 80 -5.536 -13.475 6.390 557 HG3 PRO 80 2HG PRO 80 -3.832 -13.892 6.136 558 HD2 PRO 80 1HD PRO 80 -5.700 -15.736 6.802 559 HD3 PRO 80 2HD PRO 80 -4.006 -15.860 7.323 560 H THR 81 H THR 81 -5.647 -12.026 11.042 561 HA THR 81 HA THR 81 -8.026 -10.938 9.813 562 HB THR 81 HB THR 81 -9.388 -11.436 11.931 563 HG1 THR 81 1HG THR 81 -8.669 -12.984 13.252 564 HG21 THR 81 3HG2 THR 81 -10.411 -13.200 10.875 565 HG22 THR 81 1HG2 THR 81 -8.884 -13.967 10.441 566 HG23 THR 81 2HG2 THR 81 -9.450 -12.560 9.542 567 H ASN 82 H ASN 82 -5.741 -11.070 12.451 568 HA ASN 82 HA ASN 82 -6.645 -8.699 13.760 569 HB2 ASN 82 1HB ASN 82 -4.329 -10.542 14.008 570 HB3 ASN 82 2HB ASN 82 -4.112 -8.909 14.631 571 HD21 ASN 82 1HD2 ASN 82 -4.022 -9.531 16.756 572 HD22 ASN 82 2HD2 ASN 82 -5.394 -10.125 17.621 573 H TRP 83 H TRP 83 -4.887 -6.904 14.122 574 HA TRP 83 HA TRP 83 -3.678 -6.191 11.538 575 HB2 TRP 83 1HB TRP 83 -5.820 -4.813 12.962 576 HB3 TRP 83 2HB TRP 83 -4.446 -3.761 12.632 577 HD1 TRP 83 HD TRP 83 -3.609 -3.955 9.879 578 HE1 TRP 83 1HE TRP 83 -5.145 -3.856 7.816 579 HE3 TRP 83 3HE TRP 83 -8.038 -5.201 12.106 580 HZ2 TRP 83 2HZ TRP 83 -7.874 -4.252 7.213 581 HZ3 TRP 83 3HZ TRP 83 -10.065 -5.319 10.716 582 HH2 TRP 83 HH TRP 83 -9.982 -4.853 8.320 583 H THR 84 H THR 84 -1.643 -5.478 11.672 584 HA THR 84 HA THR 84 -0.660 -4.394 14.211 585 HB THR 84 HB THR 84 -0.121 -6.828 14.169 586 HG1 THR 84 1HG THR 84 2.216 -5.226 13.895 587 HG21 THR 84 3HG2 THR 84 1.820 -6.210 11.961 588 HG22 THR 84 1HG2 THR 84 0.196 -6.803 11.616 589 HG23 THR 84 2HG2 THR 84 1.307 -7.781 12.574 590 H THR 85 H THR 85 0.596 -2.661 13.939 591 HA THR 85 HA THR 85 1.303 -1.874 11.224 592 HB THR 85 HB THR 85 1.845 0.315 12.188 593 HG1 THR 85 1HG THR 85 1.629 -1.136 14.556 594 HG21 THR 85 3HG2 THR 85 -0.315 0.797 11.949 595 HG22 THR 85 1HG2 THR 85 -0.652 0.143 13.552 596 HG23 THR 85 2HG2 THR 85 -0.713 -0.911 12.141 597 H VAL 86 H VAL 86 3.430 -1.027 10.727 598 HA VAL 86 HA VAL 86 5.555 -2.302 12.326 599 HB VAL 86 HB VAL 86 5.920 -1.727 9.413 600 HG11 VAL 86 1HG1 VAL 86 7.166 -4.058 9.916 601 HG12 VAL 86 2HG1 VAL 86 7.920 -2.479 10.148 602 HG13 VAL 86 3HG1 VAL 86 7.216 -3.332 11.523 603 HG21 VAL 86 3HG2 VAL 86 4.209 -3.845 10.602 604 HG22 VAL 86 1HG2 VAL 86 4.050 -2.986 9.069 605 HG23 VAL 86 2HG2 VAL 86 5.236 -4.281 9.236 606 H TYR 87 H TYR 87 4.301 0.595 11.126 607 HA TYR 87 HA TYR 87 6.410 2.131 12.281 608 HB2 TYR 87 1HB TYR 87 7.451 1.540 10.112 609 HB3 TYR 87 2HB TYR 87 6.093 2.285 9.276 610 HD1 TYR 87 2HD TYR 87 8.855 3.034 11.653 611 HD2 TYR 87 1HD TYR 87 6.128 4.567 8.769 612 HE1 TYR 87 2HE TYR 87 10.013 5.203 11.721 613 HE2 TYR 87 1HE TYR 87 7.278 6.740 8.828 614 HH TYR 87 HH TYR 87 10.277 7.199 10.051 615 H SER 88 H SER 88 5.914 4.372 12.405 616 HA SER 88 HA SER 88 3.786 5.667 11.177 617 HB2 SER 88 1HB SER 88 2.209 5.674 13.230 618 HB3 SER 88 2HB SER 88 2.179 4.269 12.164 619 HG SER 88 HG SER 88 3.722 4.440 14.539 620 H THR 89 H THR 89 3.932 7.793 11.592 621 HA THR 89 HA THR 89 4.625 8.906 14.101 622 HB THR 89 HB THR 89 6.861 7.975 13.352 623 HG1 THR 89 1HG THR 89 6.744 9.677 14.865 624 HG21 THR 89 3HG2 THR 89 6.466 8.656 10.933 625 HG22 THR 89 1HG2 THR 89 8.060 9.011 11.599 626 HG23 THR 89 2HG2 THR 89 6.864 10.298 11.437 627 H THR 90 H THR 90 5.709 11.304 13.415 628 HA THR 90 HA THR 90 3.904 12.381 11.352 629 HB THR 90 HB THR 90 3.886 14.486 12.904 630 HG1 THR 90 1HG THR 90 5.216 13.835 14.545 631 HG21 THR 90 3HG2 THR 90 2.188 12.425 14.132 632 HG22 THR 90 1HG2 THR 90 2.084 12.518 12.375 633 HG23 THR 90 2HG2 THR 90 1.744 13.945 13.354 634 H THR 91 H THR 91 6.277 11.859 10.451 635 HA THR 91 HA THR 91 7.507 14.469 10.122 636 HB THR 91 HB THR 91 8.878 13.766 11.910 637 HG1 THR 91 1HG THR 91 10.661 14.123 10.828 638 HG21 THR 91 3HG2 THR 91 8.299 11.481 12.167 639 HG22 THR 91 1HG2 THR 91 10.030 11.509 11.837 640 HG23 THR 91 2HG2 THR 91 8.895 11.074 10.558 641 H GLY 92 H GLY 92 6.421 13.983 8.040 642 HA2 GLY 92 2HA GLY 92 8.257 12.464 6.304 643 HA3 GLY 92 3HA GLY 92 6.519 12.229 6.176 644 H ASP 93 H ASP 93 7.307 12.858 3.888 645 HA ASP 93 HA ASP 93 6.740 15.714 3.571 646 HB2 ASP 93 1HB ASP 93 8.474 15.505 1.575 647 HB3 ASP 93 2HB ASP 93 8.998 15.921 3.205 648 H GLY 94 H GLY 94 7.556 12.950 1.463 649 HA2 GLY 94 2HA GLY 94 5.067 12.311 0.515 650 HA3 GLY 94 3HA GLY 94 5.555 13.697 -0.450 651 H ALA 95 H ALA 95 8.420 12.838 -0.222 652 HA ALA 95 HA ALA 95 8.653 11.497 -2.650 653 HB1 ALA 95 1HB ALA 95 10.396 12.648 -0.822 654 HB2 ALA 95 2HB ALA 95 10.902 10.961 -0.911 655 HB3 ALA 95 3HB ALA 95 10.818 11.934 -2.379 656 H ILE 96 H ILE 96 9.746 9.349 -2.966 657 HA ILE 96 HA ILE 96 8.171 7.253 -2.197 658 HB ILE 96 HB ILE 96 11.138 7.026 -2.711 659 HG12 ILE 96 1HG1 ILE 96 9.840 6.398 -5.059 660 HG13 ILE 96 2HG1 ILE 96 8.896 7.755 -4.454 661 HG21 ILE 96 1HG2 ILE 96 8.955 5.028 -3.263 662 HG22 ILE 96 2HG2 ILE 96 10.696 4.783 -3.384 663 HG23 ILE 96 3HG2 ILE 96 9.947 5.017 -1.804 664 HD11 ILE 96 3HD1 ILE 96 10.411 9.043 -5.436 665 HD12 ILE 96 1HD1 ILE 96 11.488 8.596 -4.115 666 HD13 ILE 96 2HD1 ILE 96 11.542 7.704 -5.636 667 H ASP 97 H ASP 97 7.869 6.081 -0.415 668 HA ASP 97 HA ASP 97 9.690 6.519 1.849 669 HB2 ASP 97 1HB ASP 97 7.850 5.830 3.285 670 HB3 ASP 97 2HB ASP 97 7.314 7.113 2.203 671 H ASP 98 H ASP 98 11.018 4.944 2.431 672 HA ASP 98 HA ASP 98 10.372 2.189 1.607 673 HB2 ASP 98 1HB ASP 98 12.320 3.011 0.412 674 HB3 ASP 98 2HB ASP 98 13.078 3.502 1.924 675 H ILE 99 H ILE 99 9.759 0.996 3.278 676 HA ILE 99 HA ILE 99 10.959 1.533 5.914 677 HB ILE 99 HB ILE 99 8.555 1.832 5.928 678 HG12 ILE 99 1HG1 ILE 99 9.400 -0.742 7.277 679 HG13 ILE 99 2HG1 ILE 99 9.572 0.881 7.935 680 HG21 ILE 99 1HG2 ILE 99 7.026 -0.008 5.411 681 HG22 ILE 99 2HG2 ILE 99 7.996 0.441 4.009 682 HG23 ILE 99 3HG2 ILE 99 8.396 -1.009 4.929 683 HD11 ILE 99 3HD1 ILE 99 7.705 -0.085 8.993 684 HD12 ILE 99 1HD1 ILE 99 7.064 1.062 7.817 685 HD13 ILE 99 2HD1 ILE 99 7.045 -0.667 7.465 686 H THR 100 H THR 100 12.113 -0.007 6.906 687 HA THR 100 HA THR 100 12.091 -2.717 5.742 688 HB THR 100 HB THR 100 14.435 -2.937 6.059 689 HG1 THR 100 1HG THR 100 15.201 -1.931 7.759 690 HG21 THR 100 3HG2 THR 100 13.360 -1.001 4.366 691 HG22 THR 100 1HG2 THR 100 14.948 -1.755 4.237 692 HG23 THR 100 2HG2 THR 100 14.764 -0.229 5.101 693 H PHE 101 H PHE 101 11.908 -4.395 7.121 694 HA PHE 101 HA PHE 101 12.293 -3.945 9.985 695 HB2 PHE 101 1HB PHE 101 10.058 -5.481 10.066 696 HB3 PHE 101 2HB PHE 101 10.048 -3.726 10.205 697 HD1 PHE 101 1HD PHE 101 9.363 -6.575 8.016 698 HD2 PHE 101 2HD PHE 101 9.254 -2.339 8.407 699 HE1 PHE 101 1HE PHE 101 7.919 -6.432 6.028 700 HE2 PHE 101 2HE PHE 101 7.809 -2.188 6.421 701 HZ PHE 101 HZ PHE 101 7.139 -4.237 5.229 702 H ALA 102 H ALA 102 11.765 -6.205 11.122 703 HA ALA 102 HA ALA 102 13.734 -8.005 10.159 704 HB1 ALA 102 1HB ALA 102 11.873 -9.152 12.079 705 HB2 ALA 102 2HB ALA 102 13.610 -8.881 12.207 706 HB3 ALA 102 3HB ALA 102 12.486 -7.574 12.573 707 H ALA 103 H ALA 103 13.407 -10.261 9.609 708 HA ALA 103 HA ALA 103 11.561 -10.630 7.528 709 HB1 ALA 103 1HB ALA 103 13.280 -12.063 7.227 710 HB2 ALA 103 2HB ALA 103 13.516 -12.319 8.956 711 HB3 ALA 103 3HB ALA 103 12.222 -13.165 8.108 712 H THR 104 H THR 104 9.428 -10.730 7.759 713 HA THR 104 HA THR 104 8.322 -12.530 9.795 714 HB THR 104 HB THR 104 6.401 -10.788 9.988 715 HG1 THR 104 1HG THR 104 6.794 -9.020 8.903 716 HG21 THR 104 3HG2 THR 104 8.065 -9.450 11.631 717 HG22 THR 104 1HG2 THR 104 9.030 -10.896 11.333 718 HG23 THR 104 2HG2 THR 104 7.406 -11.042 12.003 719 H ASN 105 H ASN 105 6.451 -13.596 9.211 720 HA ASN 105 HA ASN 105 5.897 -13.663 6.372 721 HB2 ASN 105 1HB ASN 105 4.271 -15.510 7.123 722 HB3 ASN 105 2HB ASN 105 5.994 -15.808 7.336 723 HD21 ASN 105 1HD2 ASN 105 6.628 -16.483 9.253 724 HD22 ASN 105 2HD2 ASN 105 5.736 -16.338 10.725 725 H ALA 106 H ALA 106 4.066 -12.997 5.363 726 HA ALA 106 HA ALA 106 1.759 -12.140 6.901 727 HB1 ALA 106 1HB ALA 106 2.449 -10.027 5.052 728 HB2 ALA 106 2HB ALA 106 2.038 -9.937 6.765 729 HB3 ALA 106 3HB ALA 106 3.701 -10.260 6.272 730 H LYS 107 H LYS 107 -0.130 -11.930 5.664 731 HA LYS 107 HA LYS 107 0.007 -13.288 3.081 732 HB2 LYS 107 1HB LYS 107 -2.308 -12.630 4.908 733 HB3 LYS 107 2HB LYS 107 -2.497 -13.391 3.332 734 HG2 LYS 107 1HG LYS 107 -0.546 -14.824 4.856 735 HG3 LYS 107 2HG LYS 107 -2.022 -14.629 5.805 736 HD2 LYS 107 1HD LYS 107 -2.302 -15.441 2.962 737 HD3 LYS 107 2HD LYS 107 -1.689 -16.641 4.101 738 HE2 LYS 107 1HE LYS 107 -3.644 -16.475 5.449 739 HE3 LYS 107 2HE LYS 107 -4.209 -15.060 4.561 740 HZ1 LYS 107 3HZ LYS 107 -4.136 -17.875 3.671 741 HZ2 LYS 107 1HZ LYS 107 -4.244 -16.606 2.558 742 HZ3 LYS 107 2HZ LYS 107 -5.455 -16.816 3.720 743 H PHE 108 H PHE 108 -1.700 -10.473 4.460 744 HA PHE 108 HA PHE 108 -1.569 -9.222 1.795 745 HB2 PHE 108 1HB PHE 108 -3.639 -8.354 3.753 746 HB3 PHE 108 2HB PHE 108 -3.712 -8.418 1.994 747 HD1 PHE 108 2HD PHE 108 -3.133 -11.138 1.325 748 HD2 PHE 108 1HD PHE 108 -5.353 -9.608 4.619 749 HE1 PHE 108 2HE PHE 108 -4.389 -13.250 1.455 750 HE2 PHE 108 1HE PHE 108 -6.612 -11.718 4.755 751 HZ PHE 108 HZ PHE 108 -6.132 -13.542 3.171 752 H VAL 109 H VAL 109 -1.067 -7.034 1.668 753 HA VAL 109 HA VAL 109 0.009 -5.855 4.147 754 HB VAL 109 HB VAL 109 1.508 -4.533 2.549 755 HG11 VAL 109 1HG1 VAL 109 2.836 -6.888 2.168 756 HG12 VAL 109 2HG1 VAL 109 2.854 -5.941 3.657 757 HG13 VAL 109 3HG1 VAL 109 1.736 -7.296 3.485 758 HG21 VAL 109 3HG2 VAL 109 -0.010 -5.784 0.621 759 HG22 VAL 109 1HG2 VAL 109 1.526 -4.959 0.356 760 HG23 VAL 109 2HG2 VAL 109 1.495 -6.704 0.608 761 H ARG 110 H ARG 110 -1.142 -4.184 4.831 762 HA ARG 110 HA ARG 110 -2.555 -2.534 2.841 763 HB2 ARG 110 1HB ARG 110 -3.924 -1.835 4.916 764 HB3 ARG 110 2HB ARG 110 -4.211 -3.426 4.223 765 HG2 ARG 110 1HG ARG 110 -2.152 -3.398 6.294 766 HG3 ARG 110 2HG ARG 110 -3.749 -2.906 6.858 767 HD2 ARG 110 1HD ARG 110 -3.073 -5.455 5.395 768 HD3 ARG 110 2HD ARG 110 -3.456 -5.306 7.109 769 HE ARG 110 HE ARG 110 -5.511 -4.330 5.336 770 HH11 ARG 110 1HH1 ARG 110 -4.244 -7.078 7.059 771 HH12 ARG 110 2HH1 ARG 110 -5.755 -7.926 7.080 772 HH21 ARG 110 1HH2 ARG 110 -7.505 -5.436 5.358 773 HH22 ARG 110 2HH2 ARG 110 -7.610 -6.991 6.111 774 H VAL 111 H VAL 111 -2.195 -0.381 2.758 775 HA VAL 111 HA VAL 111 -0.448 0.802 4.812 776 HB VAL 111 HB VAL 111 -0.267 1.617 1.927 777 HG11 VAL 111 1HG1 VAL 111 1.914 2.449 2.596 778 HG12 VAL 111 2HG1 VAL 111 0.661 3.106 3.651 779 HG13 VAL 111 3HG1 VAL 111 1.691 1.790 4.216 780 HG21 VAL 111 3HG2 VAL 111 1.892 0.138 2.048 781 HG22 VAL 111 1HG2 VAL 111 0.972 -0.744 3.266 782 HG23 VAL 111 2HG2 VAL 111 0.339 -0.583 1.627 783 H TYR 112 H TYR 112 -1.316 2.526 5.743 784 HA TYR 112 HA TYR 112 -3.225 4.156 4.205 785 HB2 TYR 112 1HB TYR 112 -4.715 4.310 6.023 786 HB3 TYR 112 2HB TYR 112 -4.270 2.608 5.960 787 HD1 TYR 112 2HD TYR 112 -3.736 5.777 7.776 788 HD2 TYR 112 1HD TYR 112 -3.113 1.568 7.765 789 HE1 TYR 112 2HE TYR 112 -3.031 5.881 10.130 790 HE2 TYR 112 1HE TYR 112 -2.407 1.660 10.119 791 HH TYR 112 HH TYR 112 -1.538 4.432 11.670 792 H ALA 113 H ALA 113 -3.368 6.375 4.834 793 HA ALA 113 HA ALA 113 -1.087 7.340 6.427 794 HB1 ALA 113 1HB ALA 113 -1.625 7.794 3.633 795 HB2 ALA 113 2HB ALA 113 -1.596 9.316 4.526 796 HB3 ALA 113 3HB ALA 113 -0.208 8.229 4.591 797 H THR 114 H THR 114 -2.145 7.970 8.235 798 HA THR 114 HA THR 114 -4.699 8.979 8.479 799 HB THR 114 HB THR 114 -3.476 8.343 10.448 800 HG1 THR 114 1HG THR 114 -4.281 9.917 11.683 801 HG21 THR 114 3HG2 THR 114 -1.388 9.862 9.286 802 HG22 THR 114 1HG2 THR 114 -1.335 8.880 10.749 803 HG23 THR 114 2HG2 THR 114 -1.759 10.589 10.849 804 H THR 115 H THR 115 -1.852 10.556 7.311 805 HA THR 115 HA THR 115 -2.967 13.221 7.581 806 HB THR 115 HB THR 115 -0.576 13.001 7.885 807 HG1 THR 115 1HG THR 115 -0.989 14.951 6.992 808 HG21 THR 115 3HG2 THR 115 0.319 12.514 5.226 809 HG22 THR 115 1HG2 THR 115 -0.772 11.210 5.691 810 HG23 THR 115 2HG2 THR 115 0.640 11.574 6.683 811 H ARG 116 H ARG 116 -3.054 14.662 5.663 812 HA ARG 116 HA ARG 116 -4.370 13.263 3.460 813 HB2 ARG 116 1HB ARG 116 -4.240 16.249 3.758 814 HB3 ARG 116 2HB ARG 116 -5.468 15.271 2.966 815 HG2 ARG 116 1HG ARG 116 -6.210 14.447 5.152 816 HG3 ARG 116 2HG ARG 116 -4.997 15.463 5.933 817 HD2 ARG 116 1HD ARG 116 -6.618 17.003 6.035 818 HD3 ARG 116 2HD ARG 116 -6.296 17.248 4.318 819 HE ARG 116 HE ARG 116 -8.175 15.149 4.770 820 HH11 ARG 116 1HH1 ARG 116 -7.820 18.609 4.605 821 HH12 ARG 116 2HH1 ARG 116 -9.473 18.888 4.164 822 HH21 ARG 116 1HH2 ARG 116 -10.352 15.503 4.192 823 HH22 ARG 116 2HH2 ARG 116 -10.913 17.121 3.931 824 H ALA 117 H ALA 117 -3.508 13.077 1.491 825 HA ALA 117 HA ALA 117 -0.813 13.807 1.005 826 HB1 ALA 117 1HB ALA 117 -2.969 12.470 -0.513 827 HB2 ALA 117 2HB ALA 117 -1.663 13.193 -1.455 828 HB3 ALA 117 3HB ALA 117 -1.299 11.974 -0.233 829 H THR 118 H THR 118 -3.398 14.623 -1.260 830 HA THR 118 HA THR 118 -3.234 17.426 -0.985 831 HB THR 118 HB THR 118 -2.123 17.135 -3.596 832 HG1 THR 118 1HG THR 118 -1.207 15.192 -2.470 833 HG21 THR 118 3HG2 THR 118 -2.082 18.983 -1.656 834 HG22 THR 118 1HG2 THR 118 -0.899 18.943 -2.963 835 HG23 THR 118 2HG2 THR 118 -0.498 18.256 -1.389 836 H ALA 119 H ALA 119 -3.813 18.342 -3.465 837 HA ALA 119 HA ALA 119 -6.487 17.625 -3.831 838 HB1 ALA 119 1HB ALA 119 -4.929 19.661 -4.698 839 HB2 ALA 119 2HB ALA 119 -5.138 18.743 -6.190 840 HB3 ALA 119 3HB ALA 119 -6.549 19.321 -5.305 841 H TYR 120 H TYR 120 -3.622 16.122 -4.950 842 HA TYR 120 HA TYR 120 -5.007 14.693 -7.089 843 HB2 TYR 120 1HB TYR 120 -2.491 15.653 -7.006 844 HB3 TYR 120 2HB TYR 120 -2.198 14.022 -6.411 845 HD1 TYR 120 2HD TYR 120 -4.491 12.761 -8.083 846 HD2 TYR 120 1HD TYR 120 -1.273 15.369 -9.058 847 HE1 TYR 120 2HE TYR 120 -4.512 11.914 -10.391 848 HE2 TYR 120 1HE TYR 120 -1.286 14.529 -11.370 849 HH TYR 120 HH TYR 120 -2.017 12.712 -12.665 850 H GLY 121 H GLY 121 -5.486 14.319 -4.132 851 HA2 GLY 121 2HA GLY 121 -5.794 12.600 -2.634 852 HA3 GLY 121 3HA GLY 121 -6.093 11.639 -4.076 853 H TYR 122 H TYR 122 -5.103 9.763 -3.554 854 HA TYR 122 HA TYR 122 -2.316 9.872 -2.637 855 HB2 TYR 122 1HB TYR 122 -4.480 7.804 -2.436 856 HB3 TYR 122 2HB TYR 122 -2.791 7.325 -2.304 857 HD1 TYR 122 1HD TYR 122 -3.976 10.574 -1.078 858 HD2 TYR 122 2HD TYR 122 -3.011 6.569 -0.018 859 HE1 TYR 122 1HE TYR 122 -3.986 11.207 1.299 860 HE2 TYR 122 2HE TYR 122 -3.020 7.190 2.362 861 HH TYR 122 HH TYR 122 -4.128 10.308 3.443 862 H SER 123 H SER 123 -0.713 9.388 -3.979 863 HA SER 123 HA SER 123 -1.363 7.958 -6.473 864 HB2 SER 123 1HB SER 123 0.636 10.170 -5.971 865 HB3 SER 123 2HB SER 123 0.615 9.201 -7.444 866 HG SER 123 HG SER 123 -1.575 10.723 -6.474 867 H LEU 124 H LEU 124 0.167 6.479 -7.284 868 HA LEU 124 HA LEU 124 2.588 5.880 -5.898 869 HB2 LEU 124 1HB LEU 124 1.256 4.857 -4.259 870 HB3 LEU 124 2HB LEU 124 0.163 4.170 -5.458 871 HG LEU 124 HG LEU 124 1.880 2.662 -4.179 872 HD11 LEU 124 1HD1 LEU 124 1.943 2.085 -7.070 873 HD12 LEU 124 2HD1 LEU 124 0.348 2.334 -6.362 874 HD13 LEU 124 3HD1 LEU 124 1.411 1.083 -5.718 875 HD21 LEU 124 3HD2 LEU 124 3.687 4.339 -5.282 876 HD22 LEU 124 1HD2 LEU 124 3.641 3.066 -6.502 877 HD23 LEU 124 2HD2 LEU 124 4.036 2.671 -4.828 878 H TRP 125 H TRP 125 3.817 5.531 -7.626 879 HA TRP 125 HA TRP 125 2.758 3.831 -9.785 880 HB2 TRP 125 1HB TRP 125 5.005 5.853 -9.919 881 HB3 TRP 125 2HB TRP 125 4.360 4.925 -11.269 882 HD1 TRP 125 HD TRP 125 1.289 5.626 -9.787 883 HE1 TRP 125 1HE TRP 125 0.239 7.846 -10.557 884 HE3 TRP 125 3HE TRP 125 5.452 7.853 -11.748 885 HZ2 TRP 125 2HZ TRP 125 1.068 10.227 -11.829 886 HZ3 TRP 125 3HZ TRP 125 5.237 10.102 -12.723 887 HH2 TRP 125 HH TRP 125 3.090 11.262 -12.762 888 H GLU 126 H GLU 126 5.233 4.188 -7.406 889 HA GLU 126 HA GLU 126 6.553 1.761 -8.434 890 HB2 GLU 126 1HB GLU 126 7.660 4.273 -7.296 891 HB3 GLU 126 2HB GLU 126 8.466 2.773 -6.859 892 HG2 GLU 126 1HG GLU 126 9.380 2.533 -8.879 893 HG3 GLU 126 2HG GLU 126 7.903 3.014 -9.712 894 H PHE 127 H PHE 127 5.299 0.320 -7.263 895 HA PHE 127 HA PHE 127 5.683 0.423 -4.344 896 HB2 PHE 127 1HB PHE 127 3.311 0.853 -5.149 897 HB3 PHE 127 2HB PHE 127 3.294 -0.816 -5.709 898 HD1 PHE 127 2HD PHE 127 3.760 -2.643 -3.982 899 HD2 PHE 127 1HD PHE 127 2.764 1.366 -2.953 900 HE1 PHE 127 2HE PHE 127 3.083 -3.390 -1.737 901 HE2 PHE 127 1HE PHE 127 2.086 0.624 -0.707 902 HZ PHE 127 HZ PHE 127 2.245 -1.756 -0.097 903 H GLU 128 H GLU 128 7.244 -1.029 -3.963 904 HA GLU 128 HA GLU 128 7.145 -3.612 -5.354 905 HB2 GLU 128 1HB GLU 128 9.409 -2.584 -3.650 906 HB3 GLU 128 2HB GLU 128 9.448 -3.885 -4.832 907 HG2 GLU 128 1HG GLU 128 9.092 -0.955 -5.424 908 HG3 GLU 128 2HG GLU 128 10.552 -1.908 -5.687 909 H VAL 129 H VAL 129 6.333 -5.298 -4.317 910 HA VAL 129 HA VAL 129 6.765 -5.585 -1.442 911 HB VAL 129 HB VAL 129 4.629 -4.548 -1.410 912 HG11 VAL 129 1HG1 VAL 129 2.856 -6.098 -2.846 913 HG12 VAL 129 2HG1 VAL 129 3.481 -4.518 -3.324 914 HG13 VAL 129 3HG1 VAL 129 4.261 -5.989 -3.907 915 HG21 VAL 129 3HG2 VAL 129 3.587 -6.046 -0.085 916 HG22 VAL 129 1HG2 VAL 129 3.619 -7.313 -1.312 917 HG23 VAL 129 2HG2 VAL 129 5.056 -6.987 -0.341 918 H TYR 130 H TYR 130 7.725 -7.495 -1.265 919 HA TYR 130 HA TYR 130 6.514 -9.920 -1.883 920 HB2 TYR 130 1HB TYR 130 8.074 -10.669 -3.739 921 HB3 TYR 130 2HB TYR 130 6.824 -9.522 -4.206 922 HD1 TYR 130 2HD TYR 130 10.410 -9.721 -3.229 923 HD2 TYR 130 1HD TYR 130 7.399 -7.538 -5.296 924 HE1 TYR 130 2HE TYR 130 12.134 -8.230 -4.151 925 HE2 TYR 130 1HE TYR 130 9.116 -6.041 -6.225 926 HH TYR 130 HH TYR 130 11.272 -5.529 -6.295 927 H GLY 131 H GLY 131 7.948 -11.787 -1.519 928 HA2 GLY 131 2HA GLY 131 9.912 -11.128 0.517 929 HA3 GLY 131 3HA GLY 131 9.310 -12.732 0.127 Start of MODEL 9 1 H ASN 1 H ASN 1 -4.354 -12.179 -17.430 2 HA ASN 1 HA ASN 1 -5.496 -10.882 -19.536 3 HB2 ASN 1 1HB ASN 1 -7.393 -12.551 -19.083 4 HB3 ASN 1 2HB ASN 1 -7.733 -11.591 -17.645 5 HD21 ASN 1 1HD2 ASN 1 -9.704 -10.859 -18.302 6 HD22 ASN 1 2HD2 ASN 1 -9.923 -9.765 -19.620 7 H LEU 2 H LEU 2 -3.801 -9.699 -18.251 8 HA LEU 2 HA LEU 2 -3.155 -7.998 -16.883 9 HB2 LEU 2 1HB LEU 2 -6.025 -7.142 -16.780 10 HB3 LEU 2 2HB LEU 2 -4.572 -6.144 -16.788 11 HG LEU 2 HG LEU 2 -5.621 -7.706 -19.147 12 HD11 LEU 2 1HD1 LEU 2 -6.234 -5.050 -18.101 13 HD12 LEU 2 2HD1 LEU 2 -7.099 -6.036 -19.279 14 HD13 LEU 2 3HD1 LEU 2 -5.728 -5.052 -19.791 15 HD21 LEU 2 3HD2 LEU 2 -3.351 -7.526 -19.536 16 HD22 LEU 2 1HD2 LEU 2 -3.223 -5.980 -18.695 17 HD23 LEU 2 2HD2 LEU 2 -3.970 -6.056 -20.291 18 H ALA 3 H ALA 3 -2.895 -9.786 -15.256 19 HA ALA 3 HA ALA 3 -3.814 -8.921 -12.737 20 HB1 ALA 3 1HB ALA 3 -5.830 -9.883 -12.697 21 HB2 ALA 3 2HB ALA 3 -5.477 -10.895 -14.098 22 HB3 ALA 3 3HB ALA 3 -4.955 -11.400 -12.492 23 H LEU 4 H LEU 4 -2.919 -10.148 -10.985 24 HA LEU 4 HA LEU 4 -1.202 -12.395 -11.593 25 HB2 LEU 4 1HB LEU 4 -0.076 -9.955 -11.885 26 HB3 LEU 4 2HB LEU 4 0.232 -10.247 -10.174 27 HG LEU 4 HG LEU 4 1.024 -12.597 -11.425 28 HD11 LEU 4 1HD1 LEU 4 1.518 -10.225 -13.156 29 HD12 LEU 4 2HD1 LEU 4 1.150 -11.892 -13.602 30 HD13 LEU 4 3HD1 LEU 4 2.762 -11.468 -13.028 31 HD21 LEU 4 3HD2 LEU 4 2.109 -11.541 -9.524 32 HD22 LEU 4 1HD2 LEU 4 2.661 -10.219 -10.552 33 HD23 LEU 4 2HD2 LEU 4 3.277 -11.851 -10.808 34 H ASN 5 H ASN 5 0.314 -12.506 -9.338 35 HA ASN 5 HA ASN 5 -1.613 -13.276 -7.373 36 HB2 ASN 5 1HB ASN 5 1.208 -13.688 -7.858 37 HB3 ASN 5 2HB ASN 5 0.920 -13.289 -6.167 38 HD21 ASN 5 1HD2 ASN 5 -1.001 -15.094 -8.531 39 HD22 ASN 5 2HD2 ASN 5 -1.088 -16.551 -7.605 40 H LYS 6 H LYS 6 -0.100 -10.360 -8.103 41 HA LYS 6 HA LYS 6 0.303 -9.247 -5.551 42 HB2 LYS 6 1HB LYS 6 0.377 -8.360 -8.281 43 HB3 LYS 6 2HB LYS 6 -0.493 -7.179 -7.310 44 HG2 LYS 6 1HG LYS 6 1.461 -6.355 -6.678 45 HG3 LYS 6 2HG LYS 6 1.761 -7.861 -5.806 46 HD2 LYS 6 1HD LYS 6 2.460 -8.663 -8.251 47 HD3 LYS 6 2HD LYS 6 2.790 -6.939 -8.433 48 HE2 LYS 6 1HE LYS 6 4.549 -6.994 -7.020 49 HE3 LYS 6 2HE LYS 6 3.786 -8.168 -5.949 50 HZ1 LYS 6 3HZ LYS 6 5.195 -9.630 -6.821 51 HZ2 LYS 6 1HZ LYS 6 5.641 -8.595 -8.084 52 HZ3 LYS 6 2HZ LYS 6 4.267 -9.570 -8.235 53 H ALA 7 H ALA 7 -2.263 -8.196 -7.776 54 HA ALA 7 HA ALA 7 -4.430 -7.589 -7.432 55 HB1 ALA 7 1HB ALA 7 -4.288 -9.368 -5.002 56 HB2 ALA 7 2HB ALA 7 -5.743 -8.837 -5.846 57 HB3 ALA 7 3HB ALA 7 -4.610 -9.930 -6.642 58 H THR 8 H THR 8 -4.896 -5.581 -6.854 59 HA THR 8 HA THR 8 -4.408 -4.749 -4.078 60 HB THR 8 HB THR 8 -3.206 -2.897 -4.599 61 HG1 THR 8 1HG THR 8 -3.527 -1.715 -6.549 62 HG21 THR 8 3HG2 THR 8 -2.191 -4.993 -5.773 63 HG22 THR 8 1HG2 THR 8 -1.518 -3.397 -6.104 64 HG23 THR 8 2HG2 THR 8 -2.625 -4.145 -7.257 65 H ALA 9 H ALA 9 -5.765 -3.042 -3.325 66 HA ALA 9 HA ALA 9 -7.936 -2.130 -5.010 67 HB1 ALA 9 1HB ALA 9 -8.274 -4.409 -3.325 68 HB2 ALA 9 2HB ALA 9 -9.262 -3.083 -2.711 69 HB3 ALA 9 3HB ALA 9 -9.450 -3.622 -4.379 70 H THR 10 H THR 10 -8.836 -0.237 -4.303 71 HA THR 10 HA THR 10 -7.908 0.791 -1.703 72 HB THR 10 HB THR 10 -7.459 2.929 -2.586 73 HG1 THR 10 1HG THR 10 -8.936 3.490 -4.028 74 HG21 THR 10 3HG2 THR 10 -6.129 0.691 -3.575 75 HG22 THR 10 1HG2 THR 10 -5.540 2.352 -3.572 76 HG23 THR 10 2HG2 THR 10 -6.383 1.718 -4.985 77 H SER 11 H SER 11 -9.215 2.854 -1.124 78 HA SER 11 HA SER 11 -12.002 2.081 -1.146 79 HB2 SER 11 1HB SER 11 -11.701 2.909 0.935 80 HB3 SER 11 2HB SER 11 -10.286 3.846 0.454 81 HG SER 11 HG SER 11 -12.975 4.570 0.505 82 H SER 12 H SER 12 -10.013 4.730 -2.369 83 HA SER 12 HA SER 12 -12.342 5.679 -3.906 84 HB2 SER 12 1HB SER 12 -11.773 7.849 -3.508 85 HB3 SER 12 2HB SER 12 -10.981 7.156 -2.094 86 HG SER 12 HG SER 12 -9.890 8.266 -4.366 87 H ILE 13 H ILE 13 -12.051 6.231 -6.072 88 HA ILE 13 HA ILE 13 -9.447 5.698 -7.285 89 HB ILE 13 HB ILE 13 -10.690 3.557 -7.358 90 HG12 ILE 13 1HG1 ILE 13 -10.620 4.559 -10.176 91 HG13 ILE 13 2HG1 ILE 13 -9.131 4.559 -9.235 92 HG21 ILE 13 1HG2 ILE 13 -12.953 4.332 -7.429 93 HG22 ILE 13 2HG2 ILE 13 -12.671 5.171 -8.953 94 HG23 ILE 13 3HG2 ILE 13 -12.645 3.409 -8.899 95 HD11 ILE 13 3HD1 ILE 13 -10.839 2.214 -10.000 96 HD12 ILE 13 1HD1 ILE 13 -9.166 2.544 -10.450 97 HD13 ILE 13 2HD1 ILE 13 -9.564 2.120 -8.785 98 H GLU 14 H GLU 14 -9.295 6.452 -9.509 99 HA GLU 14 HA GLU 14 -10.873 8.866 -9.890 100 HB2 GLU 14 1HB GLU 14 -8.307 7.810 -10.995 101 HB3 GLU 14 2HB GLU 14 -9.192 9.011 -11.925 102 HG2 GLU 14 1HG GLU 14 -8.492 9.436 -9.041 103 HG3 GLU 14 2HG GLU 14 -7.383 9.845 -10.349 104 H THR 15 H THR 15 -10.182 5.825 -11.547 105 HA THR 15 HA THR 15 -11.917 6.480 -13.767 106 HB THR 15 HB THR 15 -9.840 5.074 -14.010 107 HG1 THR 15 1HG THR 15 -10.949 3.563 -15.433 108 HG21 THR 15 3HG2 THR 15 -10.074 3.687 -12.029 109 HG22 THR 15 1HG2 THR 15 -10.052 2.674 -13.471 110 HG23 THR 15 2HG2 THR 15 -11.577 3.010 -12.652 111 H ALA 16 H ALA 16 -12.750 5.980 -10.792 112 HA ALA 16 HA ALA 16 -14.438 4.939 -9.640 113 HB1 ALA 16 1HB ALA 16 -15.439 6.512 -11.601 114 HB2 ALA 16 2HB ALA 16 -16.225 4.977 -11.973 115 HB3 ALA 16 3HB ALA 16 -16.420 5.703 -10.379 116 H GLY 17 H GLY 17 -12.659 3.071 -10.816 117 HA2 GLY 17 2HA GLY 17 -14.520 0.820 -11.173 118 HA3 GLY 17 3HA GLY 17 -13.193 1.033 -12.306 119 H HIS 18 H HIS 18 -11.430 -0.108 -11.896 120 HA HIS 18 HA HIS 18 -10.550 -0.530 -9.159 121 HB2 HIS 18 1HB HIS 18 -10.232 -3.042 -9.773 122 HB3 HIS 18 2HB HIS 18 -11.812 -2.483 -9.235 123 HD1 HIS 18 1HD HIS 18 -13.672 -3.283 -10.637 124 HD2 HIS 18 2HD HIS 18 -10.134 -2.997 -12.796 125 HE1 HIS 18 1HE HIS 18 -14.223 -4.119 -12.945 126 H GLU 19 H GLU 19 -9.712 0.710 -11.823 127 HA GLU 19 HA GLU 19 -7.619 -0.579 -13.033 128 HB2 GLU 19 1HB GLU 19 -8.339 2.247 -12.574 129 HB3 GLU 19 2HB GLU 19 -6.649 1.957 -12.964 130 HG2 GLU 19 1HG GLU 19 -7.483 0.626 -14.951 131 HG3 GLU 19 2HG GLU 19 -9.073 1.308 -14.611 132 H GLY 20 H GLY 20 -7.759 0.695 -9.821 133 HA2 GLY 20 2HA GLY 20 -5.076 1.115 -9.233 134 HA3 GLY 20 3HA GLY 20 -6.279 0.579 -8.071 135 H ASP 21 H ASP 21 -6.817 -1.889 -9.603 136 HA ASP 21 HA ASP 21 -4.913 -3.557 -8.321 137 HB2 ASP 21 1HB ASP 21 -7.338 -4.117 -8.895 138 HB3 ASP 21 2HB ASP 21 -6.771 -4.417 -10.536 139 H LYS 22 H LYS 22 -4.692 -1.771 -11.114 140 HA LYS 22 HA LYS 22 -3.390 -3.455 -12.921 141 HB2 LYS 22 1HB LYS 22 -3.307 -0.494 -12.438 142 HB3 LYS 22 2HB LYS 22 -2.259 -1.228 -13.644 143 HG2 LYS 22 1HG LYS 22 -5.178 -1.818 -13.706 144 HG3 LYS 22 2HG LYS 22 -4.592 -0.267 -14.309 145 HD2 LYS 22 1HD LYS 22 -3.737 -1.191 -16.162 146 HD3 LYS 22 2HD LYS 22 -3.035 -2.541 -15.268 147 HE2 LYS 22 1HE LYS 22 -4.663 -3.398 -16.811 148 HE3 LYS 22 2HE LYS 22 -5.286 -3.578 -15.173 149 HZ1 LYS 22 3HZ LYS 22 -6.170 -1.768 -17.306 150 HZ2 LYS 22 1HZ LYS 22 -6.371 -1.287 -15.696 151 HZ3 LYS 22 2HZ LYS 22 -7.092 -2.713 -16.248 152 H ALA 23 H ALA 23 -2.353 -2.259 -9.903 153 HA ALA 23 HA ALA 23 0.391 -2.006 -10.195 154 HB1 ALA 23 1HB ALA 23 0.382 -1.774 -7.975 155 HB2 ALA 23 2HB ALA 23 -1.369 -1.952 -8.089 156 HB3 ALA 23 3HB ALA 23 -0.363 -3.354 -7.725 157 H VAL 24 H VAL 24 -1.563 -4.821 -10.408 158 HA VAL 24 HA VAL 24 -0.014 -6.904 -9.596 159 HB VAL 24 HB VAL 24 -0.904 -8.156 -11.643 160 HG11 VAL 24 1HG1 VAL 24 -2.141 -8.548 -9.754 161 HG12 VAL 24 2HG1 VAL 24 -2.521 -6.840 -9.516 162 HG13 VAL 24 3HG1 VAL 24 -3.352 -7.764 -10.769 163 HG21 VAL 24 3HG2 VAL 24 -2.744 -6.998 -12.835 164 HG22 VAL 24 1HG2 VAL 24 -2.265 -5.496 -12.044 165 HG23 VAL 24 2HG2 VAL 24 -1.157 -6.298 -13.157 166 H ASP 25 H ASP 25 0.309 -5.134 -12.654 167 HA ASP 25 HA ASP 25 2.222 -6.590 -13.947 168 HB2 ASP 25 1HB ASP 25 1.130 -4.065 -14.250 169 HB3 ASP 25 2HB ASP 25 2.846 -3.737 -14.024 170 H GLY 26 H GLY 26 2.738 -4.257 -11.330 171 HA2 GLY 26 2HA GLY 26 4.470 -4.101 -9.817 172 HA3 GLY 26 3HA GLY 26 5.100 -5.609 -10.463 173 H ASN 27 H ASN 27 4.495 -2.950 -12.603 174 HA ASN 27 HA ASN 27 7.301 -2.135 -12.549 175 HB2 ASN 27 1HB ASN 27 6.390 -3.970 -14.425 176 HB3 ASN 27 2HB ASN 27 6.346 -2.435 -15.287 177 HD21 ASN 27 1HD2 ASN 27 8.069 -2.461 -16.555 178 HD22 ASN 27 2HD2 ASN 27 9.691 -2.766 -16.040 179 H ALA 28 H ALA 28 7.346 -0.519 -14.756 180 HA ALA 28 HA ALA 28 6.002 1.788 -13.842 181 HB1 ALA 28 1HB ALA 28 6.718 2.667 -16.172 182 HB2 ALA 28 2HB ALA 28 7.959 2.245 -14.991 183 HB3 ALA 28 3HB ALA 28 7.573 1.130 -16.300 184 H ALA 29 H ALA 29 4.916 -0.825 -15.689 185 HA ALA 29 HA ALA 29 3.078 0.474 -17.409 186 HB1 ALA 29 1HB ALA 29 3.977 -1.987 -17.386 187 HB2 ALA 29 2HB ALA 29 2.553 -2.276 -16.385 188 HB3 ALA 29 3HB ALA 29 2.369 -1.624 -18.014 189 H THR 30 H THR 30 3.089 -0.004 -14.053 190 HA THR 30 HA THR 30 0.173 0.212 -13.846 191 HB THR 30 HB THR 30 0.304 -0.555 -11.661 192 HG1 THR 30 1HG THR 30 3.055 0.204 -11.648 193 HG21 THR 30 3HG2 THR 30 1.310 -2.593 -11.852 194 HG22 THR 30 1HG2 THR 30 2.814 -1.916 -12.473 195 HG23 THR 30 2HG2 THR 30 1.418 -2.087 -13.537 196 H ARG 31 H ARG 31 -0.807 2.055 -13.290 197 HA ARG 31 HA ARG 31 0.746 4.172 -11.990 198 HB2 ARG 31 1HB ARG 31 -0.398 5.828 -13.545 199 HB3 ARG 31 2HB ARG 31 0.889 4.856 -14.248 200 HG2 ARG 31 1HG ARG 31 -0.481 3.993 -15.764 201 HG3 ARG 31 2HG ARG 31 -1.679 3.569 -14.539 202 HD2 ARG 31 1HD ARG 31 -2.382 5.988 -14.555 203 HD3 ARG 31 2HD ARG 31 -1.349 6.197 -15.968 204 HE ARG 31 HE ARG 31 -3.024 4.065 -16.521 205 HH11 ARG 31 1HH1 ARG 31 -3.328 7.463 -15.828 206 HH12 ARG 31 2HH1 ARG 31 -4.777 7.656 -16.760 207 HH21 ARG 31 1HH2 ARG 31 -4.930 4.306 -17.750 208 HH22 ARG 31 2HH2 ARG 31 -5.687 5.860 -17.852 209 H TRP 32 H TRP 32 -0.362 3.935 -10.079 210 HA TRP 32 HA TRP 32 -3.265 3.971 -10.072 211 HB2 TRP 32 1HB TRP 32 -2.191 2.494 -8.492 212 HB3 TRP 32 2HB TRP 32 -1.235 3.821 -7.837 213 HD1 TRP 32 HD TRP 32 -2.107 4.211 -5.461 214 HE1 TRP 32 1HE TRP 32 -4.421 4.522 -4.377 215 HE3 TRP 32 3HE TRP 32 -5.045 3.319 -9.549 216 HZ2 TRP 32 2HZ TRP 32 -7.133 4.404 -5.153 217 HZ3 TRP 32 3HZ TRP 32 -7.489 3.438 -9.294 218 HH2 TRP 32 HH TRP 32 -8.509 3.969 -7.140 219 H ALA 33 H ALA 33 -4.518 5.690 -9.645 220 HA ALA 33 HA ALA 33 -3.307 8.097 -8.496 221 HB1 ALA 33 1HB ALA 33 -4.805 7.995 -11.106 222 HB2 ALA 33 2HB ALA 33 -4.495 9.483 -10.212 223 HB3 ALA 33 3HB ALA 33 -3.147 8.531 -10.832 224 H SER 34 H SER 34 -4.460 7.898 -6.611 225 HA SER 34 HA SER 34 -7.219 7.270 -6.483 226 HB2 SER 34 1HB SER 34 -5.113 7.706 -4.640 227 HB3 SER 34 2HB SER 34 -6.408 8.821 -4.207 228 HG SER 34 HG SER 34 -6.283 6.289 -3.629 229 H ALA 35 H ALA 35 -8.990 8.511 -6.614 230 HA ALA 35 HA ALA 35 -8.926 11.048 -7.771 231 HB1 ALA 35 1HB ALA 35 -11.159 9.823 -6.155 232 HB2 ALA 35 2HB ALA 35 -11.308 11.160 -7.296 233 HB3 ALA 35 3HB ALA 35 -10.867 9.553 -7.873 234 H TYR 36 H TYR 36 -8.790 13.069 -6.995 235 HA TYR 36 HA TYR 36 -7.759 13.651 -4.505 236 HB2 TYR 36 1HB TYR 36 -8.675 16.010 -4.963 237 HB3 TYR 36 2HB TYR 36 -7.551 15.330 -6.135 238 HD1 TYR 36 1HD TYR 36 -11.211 15.666 -5.485 239 HD2 TYR 36 2HD TYR 36 -8.115 15.340 -8.386 240 HE1 TYR 36 1HE TYR 36 -12.854 16.053 -7.273 241 HE2 TYR 36 2HE TYR 36 -9.750 15.726 -10.182 242 HH TYR 36 HH TYR 36 -12.358 15.354 -10.407 243 H GLY 37 H GLY 37 -8.587 14.349 -2.552 244 HA2 GLY 37 2HA GLY 37 -10.218 14.858 -0.964 245 HA3 GLY 37 3HA GLY 37 -11.452 14.612 -2.191 246 H ALA 38 H ALA 38 -12.387 13.573 -0.146 247 HA ALA 38 HA ALA 38 -13.131 11.688 0.889 248 HB1 ALA 38 1HB ALA 38 -12.062 9.598 -0.685 249 HB2 ALA 38 2HB ALA 38 -13.706 10.239 -0.688 250 HB3 ALA 38 3HB ALA 38 -12.493 10.915 -1.776 251 H SER 39 H SER 39 -10.310 12.758 1.271 252 HA SER 39 HA SER 39 -8.759 10.453 2.024 253 HB2 SER 39 1HB SER 39 -7.679 12.774 3.232 254 HB3 SER 39 2HB SER 39 -7.109 11.949 1.781 255 HG SER 39 HG SER 39 -9.018 14.043 1.929 256 HA PRO 40 HA PRO 40 -6.833 10.694 3.634 257 HB2 PRO 40 1HB PRO 40 -6.241 8.576 5.226 258 HB3 PRO 40 2HB PRO 40 -6.073 10.253 5.758 259 HG2 PRO 40 1HG PRO 40 -8.289 8.311 6.288 260 HG3 PRO 40 2HG PRO 40 -7.508 9.449 7.401 261 HD2 PRO 40 1HD PRO 40 -9.904 9.954 6.245 262 HD3 PRO 40 2HD PRO 40 -8.743 11.239 6.639 263 H GLN 41 H GLN 41 -5.830 8.829 2.572 264 HA GLN 41 HA GLN 41 -7.862 6.998 1.486 265 HB2 GLN 41 1HB GLN 41 -6.191 8.731 0.139 266 HB3 GLN 41 2HB GLN 41 -5.350 7.193 0.001 267 HG2 GLN 41 1HG GLN 41 -6.662 7.136 -1.865 268 HG3 GLN 41 2HG GLN 41 -7.701 6.306 -0.708 269 HE21 GLN 41 1HE2 GLN 41 -9.415 7.514 0.276 270 HE22 GLN 41 2HE2 GLN 41 -10.120 8.852 -0.559 271 H TRP 42 H TRP 42 -6.592 4.987 0.454 272 HA TRP 42 HA TRP 42 -4.345 3.981 1.819 273 HB2 TRP 42 1HB TRP 42 -5.341 2.352 3.297 274 HB3 TRP 42 2HB TRP 42 -5.972 3.944 3.710 275 HD1 TRP 42 HD TRP 42 -8.532 4.472 2.731 276 HE1 TRP 42 1HE TRP 42 -10.525 2.860 2.502 277 HE3 TRP 42 3HE TRP 42 -6.006 0.029 2.893 278 HZ2 TRP 42 2HZ TRP 42 -10.968 0.074 2.403 279 HZ3 TRP 42 3HZ TRP 42 -7.289 -2.063 2.724 280 HH2 TRP 42 HH TRP 42 -9.719 -2.039 2.485 281 H ILE 43 H ILE 43 -4.181 1.513 1.498 282 HA ILE 43 HA ILE 43 -5.774 0.346 -0.571 283 HB ILE 43 HB ILE 43 -4.455 1.791 -1.998 284 HG12 ILE 43 1HG1 ILE 43 -3.293 -0.986 -2.215 285 HG13 ILE 43 2HG1 ILE 43 -4.958 -0.616 -2.647 286 HG21 ILE 43 1HG2 ILE 43 -2.101 1.879 -2.017 287 HG22 ILE 43 2HG2 ILE 43 -2.561 1.972 -0.318 288 HG23 ILE 43 3HG2 ILE 43 -1.961 0.455 -0.987 289 HD11 ILE 43 3HD1 ILE 43 -2.501 -0.155 -4.119 290 HD12 ILE 43 1HD1 ILE 43 -4.169 -0.230 -4.686 291 HD13 ILE 43 2HD1 ILE 43 -3.527 1.276 -4.028 292 H TYR 44 H TYR 44 -5.544 -1.842 -0.641 293 HA TYR 44 HA TYR 44 -3.410 -3.000 1.030 294 HB2 TYR 44 1HB TYR 44 -4.909 -4.645 1.842 295 HB3 TYR 44 2HB TYR 44 -5.783 -3.121 1.949 296 HD1 TYR 44 2HD TYR 44 -5.478 -6.280 0.070 297 HD2 TYR 44 1HD TYR 44 -7.763 -2.740 0.666 298 HE1 TYR 44 2HE TYR 44 -7.313 -7.249 -1.249 299 HE2 TYR 44 1HE TYR 44 -9.604 -3.700 -0.652 300 HH TYR 44 HH TYR 44 -10.209 -6.525 -1.181 301 H ILE 45 H ILE 45 -2.564 -5.029 0.395 302 HA ILE 45 HA ILE 45 -3.246 -5.927 -2.314 303 HB ILE 45 HB ILE 45 -0.388 -5.615 -1.407 304 HG12 ILE 45 1HG1 ILE 45 -2.110 -3.777 -3.073 305 HG13 ILE 45 2HG1 ILE 45 -1.250 -3.389 -1.588 306 HG21 ILE 45 1HG2 ILE 45 0.223 -6.216 -3.581 307 HG22 ILE 45 2HG2 ILE 45 -1.089 -7.323 -3.181 308 HG23 ILE 45 3HG2 ILE 45 -1.398 -5.927 -4.213 309 HD11 ILE 45 3HD1 ILE 45 0.882 -3.802 -2.818 310 HD12 ILE 45 1HD1 ILE 45 -0.070 -3.940 -4.295 311 HD13 ILE 45 2HD1 ILE 45 -0.055 -2.424 -3.393 312 H ASN 46 H ASN 46 -3.199 -8.096 -2.600 313 HA ASN 46 HA ASN 46 -2.686 -9.721 -0.233 314 HB2 ASN 46 1HB ASN 46 -3.670 -10.954 -2.754 315 HB3 ASN 46 2HB ASN 46 -4.159 -11.253 -1.088 316 HD21 ASN 46 1HD2 ASN 46 -5.982 -10.371 -0.384 317 HD22 ASN 46 2HD2 ASN 46 -6.902 -9.172 -1.220 318 H LEU 47 H LEU 47 -0.748 -10.593 0.034 319 HA LEU 47 HA LEU 47 1.163 -10.777 -2.080 320 HB2 LEU 47 1HB LEU 47 1.470 -10.478 0.507 321 HB3 LEU 47 2HB LEU 47 1.478 -12.239 0.501 322 HG LEU 47 HG LEU 47 3.394 -10.481 -1.029 323 HD11 LEU 47 1HD1 LEU 47 4.809 -11.967 0.812 324 HD12 LEU 47 2HD1 LEU 47 3.379 -11.453 1.707 325 HD13 LEU 47 3HD1 LEU 47 4.415 -10.252 0.936 326 HD21 LEU 47 3HD2 LEU 47 4.557 -12.887 -0.957 327 HD22 LEU 47 1HD2 LEU 47 3.494 -12.375 -2.267 328 HD23 LEU 47 2HD2 LEU 47 2.867 -13.391 -0.969 329 H GLY 48 H GLY 48 -0.523 -13.228 -0.110 330 HA2 GLY 48 2HA GLY 48 -1.528 -15.114 -1.337 331 HA3 GLY 48 3HA GLY 48 -0.074 -15.134 -2.323 332 H SER 49 H SER 49 -1.551 -16.167 0.605 333 HA SER 49 HA SER 49 -0.956 -17.736 2.145 334 HB2 SER 49 1HB SER 49 1.460 -18.344 0.438 335 HB3 SER 49 2HB SER 49 0.625 -19.419 1.560 336 HG SER 49 HG SER 49 -0.886 -19.791 0.106 337 H THR 50 H THR 50 0.934 -18.382 3.635 338 HA THR 50 HA THR 50 1.975 -16.001 4.778 339 HB THR 50 HB THR 50 3.411 -17.966 6.008 340 HG1 THR 50 1HG THR 50 2.511 -19.655 4.843 341 HG21 THR 50 3HG2 THR 50 1.007 -18.075 7.341 342 HG22 THR 50 1HG2 THR 50 0.909 -16.538 6.484 343 HG23 THR 50 2HG2 THR 50 2.257 -16.852 7.576 344 H GLN 51 H GLN 51 3.751 -14.927 4.241 345 HA GLN 51 HA GLN 51 6.063 -16.396 3.209 346 HB2 GLN 51 1HB GLN 51 5.124 -13.836 1.925 347 HB3 GLN 51 2HB GLN 51 6.389 -14.921 1.366 348 HG2 GLN 51 1HG GLN 51 3.492 -15.701 1.537 349 HG3 GLN 51 2HG GLN 51 4.240 -15.023 0.091 350 HE21 GLN 51 1HE2 GLN 51 6.617 -16.240 -0.048 351 HE22 GLN 51 2HE2 GLN 51 6.430 -17.950 -0.217 352 H SER 52 H SER 52 8.041 -15.525 3.738 353 HA SER 52 HA SER 52 8.038 -13.669 5.940 354 HB2 SER 52 1HB SER 52 10.419 -14.137 6.091 355 HB3 SER 52 2HB SER 52 9.542 -15.651 5.870 356 HG SER 52 HG SER 52 11.192 -15.737 4.438 357 H ILE 53 H ILE 53 8.587 -11.566 5.928 358 HA ILE 53 HA ILE 53 9.572 -10.420 3.398 359 HB ILE 53 HB ILE 53 8.309 -8.301 4.406 360 HG12 ILE 53 1HG1 ILE 53 6.610 -10.634 5.314 361 HG13 ILE 53 2HG1 ILE 53 7.521 -9.579 6.389 362 HG21 ILE 53 1HG2 ILE 53 7.786 -10.257 2.398 363 HG22 ILE 53 2HG2 ILE 53 6.258 -9.740 3.107 364 HG23 ILE 53 3HG2 ILE 53 7.358 -8.547 2.416 365 HD11 ILE 53 3HD1 ILE 53 5.498 -8.582 6.535 366 HD12 ILE 53 1HD1 ILE 53 6.117 -7.721 5.126 367 HD13 ILE 53 2HD1 ILE 53 5.010 -9.078 4.914 368 H SER 54 H SER 54 10.995 -8.665 3.542 369 HA SER 54 HA SER 54 12.268 -8.364 6.180 370 HB2 SER 54 1HB SER 54 14.268 -7.587 4.766 371 HB3 SER 54 2HB SER 54 13.869 -9.304 4.719 372 HG SER 54 HG SER 54 14.035 -8.814 2.627 373 H ARG 55 H ARG 55 12.165 -6.458 3.168 374 HA ARG 55 HA ARG 55 11.177 -4.163 4.695 375 HB2 ARG 55 1HB ARG 55 12.842 -2.687 3.587 376 HB3 ARG 55 2HB ARG 55 13.568 -3.848 4.690 377 HG2 ARG 55 1HG ARG 55 14.959 -4.361 3.040 378 HG3 ARG 55 2HG ARG 55 13.590 -5.154 2.256 379 HD2 ARG 55 1HD ARG 55 13.137 -2.617 1.505 380 HD3 ARG 55 2HD ARG 55 14.893 -2.570 1.660 381 HE ARG 55 HE ARG 55 14.326 -4.830 0.192 382 HH11 ARG 55 1HH1 ARG 55 13.787 -1.405 -0.118 383 HH12 ARG 55 2HH1 ARG 55 13.828 -1.423 -1.850 384 HH21 ARG 55 1HH2 ARG 55 14.382 -4.868 -2.088 385 HH22 ARG 55 2HH2 ARG 55 14.164 -3.394 -2.969 386 H VAL 56 H VAL 56 9.859 -2.800 3.562 387 HA VAL 56 HA VAL 56 9.329 -3.539 0.757 388 HB VAL 56 HB VAL 56 7.331 -2.282 2.632 389 HG11 VAL 56 1HG1 VAL 56 7.100 -2.127 0.095 390 HG12 VAL 56 2HG1 VAL 56 6.796 -3.865 0.137 391 HG13 VAL 56 3HG1 VAL 56 5.721 -2.760 0.995 392 HG21 VAL 56 3HG2 VAL 56 6.345 -4.508 2.893 393 HG22 VAL 56 1HG2 VAL 56 7.674 -5.205 1.967 394 HG23 VAL 56 2HG2 VAL 56 7.988 -4.455 3.532 395 H LYS 57 H LYS 57 9.190 -1.954 -0.763 396 HA LYS 57 HA LYS 57 9.670 0.807 0.153 397 HB2 LYS 57 1HB LYS 57 11.596 -0.405 -1.026 398 HB3 LYS 57 2HB LYS 57 10.619 -0.295 -2.485 399 HG2 LYS 57 1HG LYS 57 10.566 2.170 -2.195 400 HG3 LYS 57 2HG LYS 57 11.680 1.990 -0.838 401 HD2 LYS 57 1HD LYS 57 13.115 0.663 -2.576 402 HD3 LYS 57 2HD LYS 57 12.150 1.554 -3.756 403 HE2 LYS 57 1HE LYS 57 13.154 3.518 -3.285 404 HE3 LYS 57 2HE LYS 57 13.256 3.169 -1.560 405 HZ1 LYS 57 3HZ LYS 57 14.987 1.402 -2.726 406 HZ2 LYS 57 1HZ LYS 57 15.408 2.822 -1.910 407 HZ3 LYS 57 2HZ LYS 57 15.231 2.834 -3.591 408 H LEU 58 H LEU 58 8.193 2.252 -0.434 409 HA LEU 58 HA LEU 58 6.597 1.768 -2.848 410 HB2 LEU 58 1HB LEU 58 4.552 2.194 -1.779 411 HB3 LEU 58 2HB LEU 58 5.396 1.039 -0.751 412 HG LEU 58 HG LEU 58 5.913 3.762 0.080 413 HD11 LEU 58 1HD1 LEU 58 3.337 3.592 1.008 414 HD12 LEU 58 2HD1 LEU 58 3.180 3.097 -0.677 415 HD13 LEU 58 3HD1 LEU 58 3.902 4.656 -0.280 416 HD21 LEU 58 3HD2 LEU 58 5.948 2.766 2.079 417 HD22 LEU 58 1HD2 LEU 58 5.806 1.250 1.188 418 HD23 LEU 58 2HD2 LEU 58 4.363 2.030 1.837 419 H ASN 59 H ASN 59 5.712 3.651 -3.814 420 HA ASN 59 HA ASN 59 7.001 6.147 -2.924 421 HB2 ASN 59 1HB ASN 59 7.839 5.248 -5.095 422 HB3 ASN 59 2HB ASN 59 6.211 5.402 -5.748 423 HD21 ASN 59 1HD2 ASN 59 7.165 6.787 -7.337 424 HD22 ASN 59 2HD2 ASN 59 7.472 8.446 -6.964 425 H TRP 60 H TRP 60 5.823 8.078 -3.055 426 HA TRP 60 HA TRP 60 2.906 7.698 -3.249 427 HB2 TRP 60 1HB TRP 60 4.390 8.650 -1.109 428 HB3 TRP 60 2HB TRP 60 3.776 10.117 -1.867 429 HD1 TRP 60 HD TRP 60 1.075 10.394 -1.974 430 HE1 TRP 60 1HE TRP 60 -0.771 9.417 -0.469 431 HE3 TRP 60 3HE TRP 60 3.743 6.645 0.256 432 HZ2 TRP 60 2HZ TRP 60 -1.059 7.334 1.413 433 HZ3 TRP 60 3HZ TRP 60 2.608 5.207 1.898 434 HH2 TRP 60 HH TRP 60 0.257 5.545 2.463 435 H GLU 61 H GLU 61 5.293 8.713 -5.098 436 HA GLU 61 HA GLU 61 5.591 10.266 -6.744 437 HB2 GLU 61 1HB GLU 61 3.139 9.056 -7.063 438 HB3 GLU 61 2HB GLU 61 2.734 10.765 -7.151 439 HG2 GLU 61 1HG GLU 61 3.157 9.876 -9.357 440 HG3 GLU 61 2HG GLU 61 4.382 11.068 -8.927 441 H ASP 62 H ASP 62 3.985 12.420 -7.573 442 HA ASP 62 HA ASP 62 4.915 14.522 -6.095 443 HB2 ASP 62 1HB ASP 62 2.423 14.300 -7.781 444 HB3 ASP 62 2HB ASP 62 2.950 15.824 -7.074 445 H ALA 63 H ALA 63 1.924 12.720 -5.610 446 HA ALA 63 HA ALA 63 0.703 14.353 -3.713 447 HB1 ALA 63 1HB ALA 63 -0.469 12.299 -2.973 448 HB2 ALA 63 2HB ALA 63 -0.487 12.523 -4.722 449 HB3 ALA 63 3HB ALA 63 0.614 11.354 -3.994 450 H TYR 64 H TYR 64 1.593 15.094 -1.903 451 HA TYR 64 HA TYR 64 3.383 13.330 -0.375 452 HB2 TYR 64 1HB TYR 64 4.351 15.301 0.591 453 HB3 TYR 64 2HB TYR 64 4.270 15.548 -1.150 454 HD1 TYR 64 1HD TYR 64 2.712 17.165 -2.107 455 HD2 TYR 64 2HD TYR 64 2.990 16.612 2.103 456 HE1 TYR 64 1HE TYR 64 1.493 19.272 -1.755 457 HE2 TYR 64 2HE TYR 64 1.770 18.716 2.466 458 HH TYR 64 HH TYR 64 0.716 20.421 1.516 459 H ALA 65 H ALA 65 2.819 12.629 1.588 460 HA ALA 65 HA ALA 65 0.354 13.720 2.779 461 HB1 ALA 65 1HB ALA 65 -0.225 11.620 3.540 462 HB2 ALA 65 2HB ALA 65 0.535 11.247 1.993 463 HB3 ALA 65 3HB ALA 65 1.435 11.028 3.493 464 H THR 66 H THR 66 0.238 13.676 5.148 465 HA THR 66 HA THR 66 2.612 14.805 6.297 466 HB THR 66 HB THR 66 0.236 15.531 6.825 467 HG1 THR 66 1HG THR 66 2.303 15.815 8.163 468 HG21 THR 66 3HG2 THR 66 -0.902 14.312 8.629 469 HG22 THR 66 1HG2 THR 66 0.335 13.058 8.557 470 HG23 THR 66 2HG2 THR 66 -0.737 13.321 7.180 471 H ALA 67 H ALA 67 1.245 11.669 6.125 472 HA ALA 67 HA ALA 67 3.440 10.392 7.277 473 HB1 ALA 67 1HB ALA 67 2.196 9.507 9.353 474 HB2 ALA 67 2HB ALA 67 2.910 11.118 9.421 475 HB3 ALA 67 3HB ALA 67 1.176 10.933 9.162 476 H TYR 68 H TYR 68 3.260 8.108 7.252 477 HA TYR 68 HA TYR 68 0.783 7.085 6.027 478 HB2 TYR 68 1HB TYR 68 3.320 5.737 5.317 479 HB3 TYR 68 2HB TYR 68 1.901 6.062 4.329 480 HD1 TYR 68 1HD TYR 68 5.111 7.371 5.509 481 HD2 TYR 68 2HD TYR 68 1.687 8.150 3.106 482 HE1 TYR 68 1HE TYR 68 6.299 9.236 4.430 483 HE2 TYR 68 2HE TYR 68 2.866 10.015 2.019 484 HH TYR 68 HH TYR 68 4.692 11.302 2.043 485 H SER 69 H SER 69 0.610 4.668 6.204 486 HA SER 69 HA SER 69 1.955 3.558 8.551 487 HB2 SER 69 1HB SER 69 -0.998 4.018 8.277 488 HB3 SER 69 2HB SER 69 -0.404 2.656 9.226 489 HG SER 69 HG SER 69 -0.724 4.996 10.142 490 H ILE 70 H ILE 70 2.283 1.385 8.457 491 HA ILE 70 HA ILE 70 1.154 -0.029 6.129 492 HB ILE 70 HB ILE 70 3.881 0.452 6.729 493 HG12 ILE 70 1HG1 ILE 70 2.717 -1.476 4.712 494 HG13 ILE 70 2HG1 ILE 70 2.717 0.273 4.502 495 HG21 ILE 70 1HG2 ILE 70 3.142 -2.465 6.935 496 HG22 ILE 70 2HG2 ILE 70 4.779 -1.822 6.813 497 HG23 ILE 70 3HG2 ILE 70 3.795 -1.465 8.232 498 HD11 ILE 70 3HD1 ILE 70 5.072 0.345 4.370 499 HD12 ILE 70 1HD1 ILE 70 5.226 -1.321 4.927 500 HD13 ILE 70 2HD1 ILE 70 4.550 -0.982 3.334 501 H GLN 71 H GLN 71 0.393 -2.079 6.430 502 HA GLN 71 HA GLN 71 0.794 -3.388 9.005 503 HB2 GLN 71 1HB GLN 71 -2.001 -3.110 7.936 504 HB3 GLN 71 2HB GLN 71 -1.484 -3.593 9.546 505 HG2 GLN 71 1HG GLN 71 -0.572 -1.233 9.787 506 HG3 GLN 71 2HG GLN 71 -1.500 -0.849 8.337 507 HE21 GLN 71 1HE2 GLN 71 -2.107 -2.767 11.263 508 HE22 GLN 71 2HE2 GLN 71 -3.602 -1.999 11.662 509 H VAL 72 H VAL 72 -0.371 -5.598 8.970 510 HA VAL 72 HA VAL 72 -0.661 -6.770 6.337 511 HB VAL 72 HB VAL 72 1.000 -8.612 6.936 512 HG11 VAL 72 1HG1 VAL 72 2.192 -5.894 6.415 513 HG12 VAL 72 2HG1 VAL 72 2.822 -7.461 5.904 514 HG13 VAL 72 3HG1 VAL 72 1.327 -6.840 5.203 515 HG21 VAL 72 3HG2 VAL 72 2.270 -8.480 8.764 516 HG22 VAL 72 1HG2 VAL 72 2.670 -6.790 8.456 517 HG23 VAL 72 2HG2 VAL 72 1.183 -7.202 9.309 518 H SER 73 H SER 73 -1.198 -9.140 6.509 519 HA SER 73 HA SER 73 -3.080 -9.487 8.700 520 HB2 SER 73 1HB SER 73 -4.197 -10.997 7.353 521 HB3 SER 73 2HB SER 73 -3.437 -9.984 6.126 522 HG SER 73 HG SER 73 -1.643 -11.636 6.359 523 H ASN 74 H ASN 74 -2.663 -10.660 10.445 524 HA ASN 74 HA ASN 74 -1.372 -13.141 10.474 525 HB2 ASN 74 1HB ASN 74 0.719 -12.482 11.703 526 HB3 ASN 74 2HB ASN 74 0.689 -11.998 10.009 527 HD21 ASN 74 1HD2 ASN 74 0.388 -9.811 9.490 528 HD22 ASN 74 2HD2 ASN 74 0.697 -8.563 10.643 529 H ASP 75 H ASP 75 -1.551 -14.147 12.455 530 HA ASP 75 HA ASP 75 -1.887 -12.836 14.921 531 HB2 ASP 75 1HB ASP 75 -4.078 -12.312 13.592 532 HB3 ASP 75 2HB ASP 75 -4.502 -13.974 13.994 533 H SER 76 H SER 76 -2.845 -15.658 13.006 534 HA SER 76 HA SER 76 -2.242 -17.365 15.327 535 HB2 SER 76 1HB SER 76 -4.506 -17.697 14.580 536 HB3 SER 76 2HB SER 76 -3.983 -17.867 12.905 537 HG SER 76 HG SER 76 -4.145 -19.918 13.523 538 H GLY 77 H GLY 77 -0.796 -16.213 12.653 539 HA2 GLY 77 2HA GLY 77 1.330 -16.885 11.898 540 HA3 GLY 77 3HA GLY 77 1.026 -18.492 12.540 541 H SER 78 H SER 78 -1.282 -19.247 11.364 542 HA SER 78 HA SER 78 -0.621 -19.169 8.493 543 HB2 SER 78 1HB SER 78 -1.221 -21.394 10.314 544 HB3 SER 78 2HB SER 78 -2.131 -21.442 8.805 545 HG SER 78 HG SER 78 0.674 -21.061 8.905 546 H THR 79 H THR 79 -3.022 -18.656 10.889 547 HA THR 79 HA THR 79 -5.087 -18.335 8.813 548 HB THR 79 HB THR 79 -5.507 -18.671 11.788 549 HG1 THR 79 1HG THR 79 -6.439 -20.753 10.858 550 HG21 THR 79 3HG2 THR 79 -7.623 -18.085 11.419 551 HG22 THR 79 1HG2 THR 79 -7.772 -19.324 10.174 552 HG23 THR 79 2HG2 THR 79 -7.211 -17.708 9.746 553 HA PRO 80 HA PRO 80 -3.991 -14.045 10.139 554 HB2 PRO 80 1HB PRO 80 -4.216 -12.985 7.650 555 HB3 PRO 80 2HB PRO 80 -2.732 -13.742 8.240 556 HG2 PRO 80 1HG PRO 80 -4.870 -14.881 6.482 557 HG3 PRO 80 2HG PRO 80 -3.109 -15.020 6.334 558 HD2 PRO 80 1HD PRO 80 -4.644 -16.996 7.370 559 HD3 PRO 80 2HD PRO 80 -2.982 -16.692 7.915 560 H THR 81 H THR 81 -5.451 -12.532 10.712 561 HA THR 81 HA THR 81 -7.957 -12.251 9.276 562 HB THR 81 HB THR 81 -9.322 -12.482 11.354 563 HG1 THR 81 1HG THR 81 -8.403 -13.093 13.192 564 HG21 THR 81 3HG2 THR 81 -7.923 -15.087 10.891 565 HG22 THR 81 1HG2 THR 81 -8.840 -14.335 9.586 566 HG23 THR 81 2HG2 THR 81 -9.644 -14.763 11.096 567 H ASN 82 H ASN 82 -5.972 -11.303 12.046 568 HA ASN 82 HA ASN 82 -7.260 -8.709 12.208 569 HB2 ASN 82 1HB ASN 82 -5.978 -10.320 14.054 570 HB3 ASN 82 2HB ASN 82 -4.801 -9.045 13.753 571 HD21 ASN 82 1HD2 ASN 82 -4.939 -7.781 15.479 572 HD22 ASN 82 2HD2 ASN 82 -6.389 -7.057 16.077 573 H TRP 83 H TRP 83 -5.228 -7.005 12.807 574 HA TRP 83 HA TRP 83 -3.215 -7.100 10.730 575 HB2 TRP 83 1HB TRP 83 -5.664 -5.527 10.453 576 HB3 TRP 83 2HB TRP 83 -4.203 -4.554 10.302 577 HD1 TRP 83 HD TRP 83 -2.567 -5.110 8.235 578 HE1 TRP 83 1HE TRP 83 -3.010 -6.279 5.985 579 HE3 TRP 83 3HE TRP 83 -7.015 -7.367 9.355 580 HZ2 TRP 83 2HZ TRP 83 -4.984 -7.938 4.836 581 HZ3 TRP 83 3HZ TRP 83 -8.116 -8.728 7.625 582 HH2 TRP 83 HH TRP 83 -7.120 -9.005 5.413 583 H THR 84 H THR 84 -1.392 -6.183 11.432 584 HA THR 84 HA THR 84 -1.569 -4.299 13.693 585 HB THR 84 HB THR 84 -0.649 -6.508 14.360 586 HG1 THR 84 1HG THR 84 1.035 -5.596 15.507 587 HG21 THR 84 3HG2 THR 84 1.947 -6.082 13.102 588 HG22 THR 84 1HG2 THR 84 0.666 -6.416 11.938 589 HG23 THR 84 2HG2 THR 84 0.989 -7.556 13.244 590 H THR 85 H THR 85 -0.174 -2.548 13.715 591 HA THR 85 HA THR 85 0.819 -1.742 11.117 592 HB THR 85 HB THR 85 1.531 0.338 12.588 593 HG1 THR 85 1HG THR 85 0.994 -0.019 14.610 594 HG21 THR 85 3HG2 THR 85 -1.334 -0.337 11.913 595 HG22 THR 85 1HG2 THR 85 -0.155 0.407 10.836 596 HG23 THR 85 2HG2 THR 85 -0.724 1.281 12.259 597 H VAL 86 H VAL 86 2.879 -1.760 10.466 598 HA VAL 86 HA VAL 86 4.902 -2.775 12.309 599 HB VAL 86 HB VAL 86 5.415 -2.187 9.413 600 HG11 VAL 86 1HG1 VAL 86 6.740 -3.577 11.580 601 HG12 VAL 86 2HG1 VAL 86 6.553 -4.604 10.157 602 HG13 VAL 86 3HG1 VAL 86 7.376 -3.050 10.023 603 HG21 VAL 86 3HG2 VAL 86 4.735 -4.731 9.204 604 HG22 VAL 86 1HG2 VAL 86 3.676 -4.314 10.552 605 HG23 VAL 86 2HG2 VAL 86 3.543 -3.444 9.023 606 H TYR 87 H TYR 87 3.871 0.178 10.969 607 HA TYR 87 HA TYR 87 5.872 1.655 12.346 608 HB2 TYR 87 1HB TYR 87 6.763 0.778 9.922 609 HB3 TYR 87 2HB TYR 87 6.071 2.338 9.486 610 HD1 TYR 87 1HD TYR 87 8.060 1.072 12.397 611 HD2 TYR 87 2HD TYR 87 7.685 3.967 9.301 612 HE1 TYR 87 1HE TYR 87 10.095 2.192 13.205 613 HE2 TYR 87 2HE TYR 87 9.719 5.095 10.101 614 HH TYR 87 HH TYR 87 11.833 4.333 11.460 615 H SER 88 H SER 88 5.778 4.039 10.924 616 HA SER 88 HA SER 88 3.194 4.793 10.085 617 HB2 SER 88 1HB SER 88 2.311 5.924 11.975 618 HB3 SER 88 2HB SER 88 2.825 4.348 12.576 619 HG SER 88 HG SER 88 3.679 5.740 14.002 620 H THR 89 H THR 89 3.233 7.450 11.188 621 HA THR 89 HA THR 89 3.981 9.494 10.479 622 HB THR 89 HB THR 89 5.558 8.857 12.366 623 HG1 THR 89 1HG THR 89 6.483 10.777 12.097 624 HG21 THR 89 3HG2 THR 89 6.934 7.190 11.449 625 HG22 THR 89 1HG2 THR 89 7.971 8.613 11.531 626 HG23 THR 89 2HG2 THR 89 7.255 8.131 9.994 627 H THR 90 H THR 90 6.270 10.397 9.287 628 HA THR 90 HA THR 90 6.422 8.889 6.762 629 HB THR 90 HB THR 90 5.027 10.679 6.165 630 HG1 THR 90 1HG THR 90 6.533 12.106 4.967 631 HG21 THR 90 3HG2 THR 90 5.264 11.987 8.223 632 HG22 THR 90 1HG2 THR 90 5.430 13.010 6.797 633 HG23 THR 90 2HG2 THR 90 6.861 12.522 7.704 634 H THR 91 H THR 91 7.947 11.284 8.872 635 HA THR 91 HA THR 91 10.119 11.897 9.184 636 HB THR 91 HB THR 91 11.686 10.192 9.429 637 HG1 THR 91 1HG THR 91 11.865 8.487 8.074 638 HG21 THR 91 3HG2 THR 91 10.578 8.754 10.770 639 HG22 THR 91 1HG2 THR 91 9.455 8.271 9.498 640 HG23 THR 91 2HG2 THR 91 9.186 9.768 10.391 641 H GLY 92 H GLY 92 8.853 12.151 6.446 642 HA2 GLY 92 2HA GLY 92 11.347 12.812 5.056 643 HA3 GLY 92 3HA GLY 92 10.199 11.768 4.231 644 H ASP 93 H ASP 93 9.226 12.903 2.692 645 HA ASP 93 HA ASP 93 7.491 15.036 3.264 646 HB2 ASP 93 1HB ASP 93 9.905 16.072 3.374 647 HB3 ASP 93 2HB ASP 93 9.781 16.039 1.618 648 H GLY 94 H GLY 94 6.331 13.382 2.040 649 HA2 GLY 94 2HA GLY 94 5.286 12.674 0.123 650 HA3 GLY 94 3HA GLY 94 5.895 14.140 -0.630 651 H ALA 95 H ALA 95 8.307 12.138 0.698 652 HA ALA 95 HA ALA 95 9.151 11.374 -1.996 653 HB1 ALA 95 1HB ALA 95 10.587 12.492 -0.040 654 HB2 ALA 95 2HB ALA 95 10.880 10.792 0.332 655 HB3 ALA 95 3HB ALA 95 11.292 11.430 -1.260 656 H ILE 96 H ILE 96 10.206 9.198 -2.219 657 HA ILE 96 HA ILE 96 8.425 7.143 -1.854 658 HB ILE 96 HB ILE 96 11.423 6.795 -1.908 659 HG12 ILE 96 1HG1 ILE 96 10.499 6.379 -4.469 660 HG13 ILE 96 2HG1 ILE 96 9.530 7.747 -3.933 661 HG21 ILE 96 1HG2 ILE 96 10.068 4.795 -1.336 662 HG22 ILE 96 2HG2 ILE 96 9.244 4.960 -2.886 663 HG23 ILE 96 3HG2 ILE 96 10.975 4.629 -2.841 664 HD11 ILE 96 3HD1 ILE 96 12.354 8.018 -3.289 665 HD12 ILE 96 1HD1 ILE 96 12.033 7.883 -5.018 666 HD13 ILE 96 2HD1 ILE 96 11.250 9.149 -4.071 667 H ASP 97 H ASP 97 7.738 6.003 -0.171 668 HA ASP 97 HA ASP 97 9.075 6.308 2.397 669 HB2 ASP 97 1HB ASP 97 6.503 4.841 1.788 670 HB3 ASP 97 2HB ASP 97 7.080 5.365 3.368 671 H ASP 98 H ASP 98 10.660 4.945 2.868 672 HA ASP 98 HA ASP 98 10.458 2.161 1.931 673 HB2 ASP 98 1HB ASP 98 12.437 3.238 1.076 674 HB3 ASP 98 2HB ASP 98 12.870 3.819 2.682 675 H ILE 99 H ILE 99 9.770 0.800 3.435 676 HA ILE 99 HA ILE 99 10.540 1.289 6.237 677 HB ILE 99 HB ILE 99 8.148 1.437 5.995 678 HG12 ILE 99 1HG1 ILE 99 8.957 -1.218 7.203 679 HG13 ILE 99 2HG1 ILE 99 8.987 0.340 8.020 680 HG21 ILE 99 1HG2 ILE 99 8.533 -0.610 4.064 681 HG22 ILE 99 2HG2 ILE 99 7.403 -1.203 5.282 682 HG23 ILE 99 3HG2 ILE 99 7.068 0.302 4.426 683 HD11 ILE 99 3HD1 ILE 99 6.584 -1.205 7.094 684 HD12 ILE 99 1HD1 ILE 99 7.053 -0.813 8.748 685 HD13 ILE 99 2HD1 ILE 99 6.513 0.464 7.659 686 H THR 100 H THR 100 11.917 -0.110 7.089 687 HA THR 100 HA THR 100 12.073 -2.818 5.932 688 HB THR 100 HB THR 100 14.414 -2.883 6.294 689 HG1 THR 100 1HG THR 100 14.405 -0.301 7.457 690 HG21 THR 100 3HG2 THR 100 13.262 -1.006 4.606 691 HG22 THR 100 1HG2 THR 100 14.920 -1.602 4.532 692 HG23 THR 100 2HG2 THR 100 14.554 -0.120 5.417 693 H PHE 101 H PHE 101 11.962 -4.521 7.288 694 HA PHE 101 HA PHE 101 12.273 -4.099 10.161 695 HB2 PHE 101 1HB PHE 101 10.108 -5.679 10.262 696 HB3 PHE 101 2HB PHE 101 10.004 -3.922 10.296 697 HD1 PHE 101 1HD PHE 101 9.604 -6.915 8.201 698 HD2 PHE 101 2HD PHE 101 9.064 -2.702 8.479 699 HE1 PHE 101 1HE PHE 101 8.185 -6.968 6.192 700 HE2 PHE 101 2HE PHE 101 7.644 -2.748 6.470 701 HZ PHE 101 HZ PHE 101 7.203 -4.883 5.324 702 H ALA 102 H ALA 102 11.754 -6.422 11.230 703 HA ALA 102 HA ALA 102 13.798 -8.141 10.205 704 HB1 ALA 102 1HB ALA 102 11.900 -9.072 12.300 705 HB2 ALA 102 2HB ALA 102 13.648 -9.277 12.186 706 HB3 ALA 102 3HB ALA 102 12.973 -7.721 12.669 707 H ALA 103 H ALA 103 13.484 -10.438 9.740 708 HA ALA 103 HA ALA 103 11.628 -10.883 7.701 709 HB1 ALA 103 1HB ALA 103 13.054 -12.959 9.359 710 HB2 ALA 103 2HB ALA 103 12.334 -13.201 7.768 711 HB3 ALA 103 3HB ALA 103 13.728 -12.137 7.953 712 H THR 104 H THR 104 9.494 -10.741 8.060 713 HA THR 104 HA THR 104 8.357 -12.421 10.200 714 HB THR 104 HB THR 104 6.414 -10.712 10.125 715 HG1 THR 104 1HG THR 104 8.543 -9.105 9.112 716 HG21 THR 104 3HG2 THR 104 7.358 -9.484 11.912 717 HG22 THR 104 1HG2 THR 104 8.996 -9.698 11.297 718 HG23 THR 104 2HG2 THR 104 8.121 -11.073 11.973 719 H ASN 105 H ASN 105 6.537 -13.606 9.717 720 HA ASN 105 HA ASN 105 6.047 -14.050 6.899 721 HB2 ASN 105 1HB ASN 105 4.464 -15.843 7.850 722 HB3 ASN 105 2HB ASN 105 6.192 -16.055 8.122 723 HD21 ASN 105 1HD2 ASN 105 3.210 -14.907 9.597 724 HD22 ASN 105 2HD2 ASN 105 3.685 -15.214 11.229 725 H ALA 106 H ALA 106 4.216 -13.576 5.786 726 HA ALA 106 HA ALA 106 1.826 -12.675 7.138 727 HB1 ALA 106 1HB ALA 106 2.297 -10.504 7.092 728 HB2 ALA 106 2HB ALA 106 3.765 -10.779 6.153 729 HB3 ALA 106 3HB ALA 106 2.215 -10.592 5.333 730 H LYS 107 H LYS 107 0.060 -12.212 5.598 731 HA LYS 107 HA LYS 107 0.407 -13.765 3.117 732 HB2 LYS 107 1HB LYS 107 -2.008 -13.416 4.895 733 HB3 LYS 107 2HB LYS 107 -2.089 -14.130 3.290 734 HG2 LYS 107 1HG LYS 107 -0.099 -15.590 4.423 735 HG3 LYS 107 2HG LYS 107 -1.136 -15.265 5.814 736 HD2 LYS 107 1HD LYS 107 -3.052 -16.171 4.624 737 HD3 LYS 107 2HD LYS 107 -2.059 -16.435 3.188 738 HE2 LYS 107 1HE LYS 107 -0.950 -18.218 4.118 739 HE3 LYS 107 2HE LYS 107 -1.200 -17.651 5.769 740 HZ1 LYS 107 3HZ LYS 107 -3.229 -18.616 5.894 741 HZ2 LYS 107 1HZ LYS 107 -2.548 -19.665 4.756 742 HZ3 LYS 107 2HZ LYS 107 -3.570 -18.417 4.249 743 H PHE 108 H PHE 108 -1.318 -11.008 4.544 744 HA PHE 108 HA PHE 108 -1.400 -9.794 1.863 745 HB2 PHE 108 1HB PHE 108 -3.513 -9.064 3.825 746 HB3 PHE 108 2HB PHE 108 -3.597 -9.170 2.070 747 HD1 PHE 108 2HD PHE 108 -3.028 -11.765 1.291 748 HD2 PHE 108 1HD PHE 108 -4.919 -10.511 4.892 749 HE1 PHE 108 2HE PHE 108 -4.124 -13.960 1.476 750 HE2 PHE 108 1HE PHE 108 -6.017 -12.705 5.083 751 HZ PHE 108 HZ PHE 108 -5.621 -14.432 3.374 752 H VAL 109 H VAL 109 -1.647 -7.388 1.947 753 HA VAL 109 HA VAL 109 -0.405 -6.221 4.344 754 HB VAL 109 HB VAL 109 0.390 -5.471 1.531 755 HG11 VAL 109 1HG1 VAL 109 0.617 -3.687 3.186 756 HG12 VAL 109 2HG1 VAL 109 1.581 -4.755 4.208 757 HG13 VAL 109 3HG1 VAL 109 2.193 -4.251 2.634 758 HG21 VAL 109 3HG2 VAL 109 2.617 -6.561 2.661 759 HG22 VAL 109 1HG2 VAL 109 1.346 -7.607 3.294 760 HG23 VAL 109 2HG2 VAL 109 1.534 -7.403 1.552 761 H ARG 110 H ARG 110 -0.999 -4.119 4.829 762 HA ARG 110 HA ARG 110 -2.936 -2.814 3.057 763 HB2 ARG 110 1HB ARG 110 -4.234 -4.053 4.727 764 HB3 ARG 110 2HB ARG 110 -3.340 -3.263 6.019 765 HG2 ARG 110 1HG ARG 110 -4.234 -1.089 5.251 766 HG3 ARG 110 2HG ARG 110 -5.205 -1.950 4.056 767 HD2 ARG 110 1HD ARG 110 -6.663 -2.732 5.606 768 HD3 ARG 110 2HD ARG 110 -5.422 -2.885 6.849 769 HE ARG 110 HE ARG 110 -5.747 -0.189 6.503 770 HH11 ARG 110 1HH1 ARG 110 -7.823 -2.861 7.326 771 HH12 ARG 110 2HH1 ARG 110 -8.893 -1.900 8.293 772 HH21 ARG 110 1HH2 ARG 110 -7.149 1.085 7.772 773 HH22 ARG 110 2HH2 ARG 110 -8.509 0.344 8.545 774 H VAL 111 H VAL 111 -2.468 -0.738 2.757 775 HA VAL 111 HA VAL 111 -0.849 0.645 4.796 776 HB VAL 111 HB VAL 111 -0.663 1.287 1.864 777 HG11 VAL 111 1HG1 VAL 111 1.358 1.676 4.061 778 HG12 VAL 111 2HG1 VAL 111 1.345 2.402 2.452 779 HG13 VAL 111 3HG1 VAL 111 0.139 2.881 3.647 780 HG21 VAL 111 3HG2 VAL 111 0.152 -0.817 1.630 781 HG22 VAL 111 1HG2 VAL 111 1.614 -0.061 2.266 782 HG23 VAL 111 2HG2 VAL 111 0.551 -0.971 3.341 783 H TYR 112 H TYR 112 -1.559 2.590 5.453 784 HA TYR 112 HA TYR 112 -3.481 4.068 3.836 785 HB2 TYR 112 1HB TYR 112 -5.160 4.196 5.508 786 HB3 TYR 112 2HB TYR 112 -4.738 2.492 5.384 787 HD1 TYR 112 1HD TYR 112 -2.925 1.653 7.078 788 HD2 TYR 112 2HD TYR 112 -5.225 5.196 7.598 789 HE1 TYR 112 1HE TYR 112 -2.473 1.585 9.496 790 HE2 TYR 112 2HE TYR 112 -4.777 5.139 10.016 791 HH TYR 112 HH TYR 112 -3.965 3.898 11.709 792 H ALA 113 H ALA 113 -3.864 6.257 4.669 793 HA ALA 113 HA ALA 113 -1.511 7.249 6.139 794 HB1 ALA 113 1HB ALA 113 -2.040 9.436 4.994 795 HB2 ALA 113 2HB ALA 113 -1.474 8.135 3.946 796 HB3 ALA 113 3HB ALA 113 -3.190 8.539 4.002 797 H THR 114 H THR 114 -2.201 9.686 6.909 798 HA THR 114 HA THR 114 -4.556 9.268 8.631 799 HB THR 114 HB THR 114 -2.697 9.355 10.073 800 HG1 THR 114 1HG THR 114 -3.565 10.856 11.283 801 HG21 THR 114 3HG2 THR 114 -0.938 11.032 9.954 802 HG22 THR 114 1HG2 THR 114 -1.729 11.793 8.575 803 HG23 THR 114 2HG2 THR 114 -1.059 10.168 8.422 804 H THR 115 H THR 115 -2.685 11.712 6.867 805 HA THR 115 HA THR 115 -5.112 13.385 6.778 806 HB THR 115 HB THR 115 -2.280 14.409 6.552 807 HG1 THR 115 1HG THR 115 -3.972 14.614 8.829 808 HG21 THR 115 3HG2 THR 115 -3.587 16.541 7.278 809 HG22 THR 115 1HG2 THR 115 -4.996 15.663 6.685 810 HG23 THR 115 2HG2 THR 115 -3.654 16.016 5.596 811 H ARG 116 H ARG 116 -5.389 14.681 4.840 812 HA ARG 116 HA ARG 116 -5.289 13.257 2.490 813 HB2 ARG 116 1HB ARG 116 -5.128 16.266 2.573 814 HB3 ARG 116 2HB ARG 116 -5.901 15.257 1.359 815 HG2 ARG 116 1HG ARG 116 -7.813 15.545 2.434 816 HG3 ARG 116 2HG ARG 116 -7.149 14.603 3.770 817 HD2 ARG 116 1HD ARG 116 -7.729 16.543 4.853 818 HD3 ARG 116 2HD ARG 116 -6.051 16.884 4.433 819 HE ARG 116 HE ARG 116 -7.585 17.820 2.335 820 HH11 ARG 116 1HH1 ARG 116 -7.261 18.444 5.745 821 HH12 ARG 116 2HH1 ARG 116 -7.729 20.108 5.618 822 HH21 ARG 116 1HH2 ARG 116 -8.201 20.009 2.155 823 HH22 ARG 116 2HH2 ARG 116 -8.263 20.996 3.575 824 H ALA 117 H ALA 117 -4.108 13.915 0.450 825 HA ALA 117 HA ALA 117 -1.246 14.133 1.070 826 HB1 ALA 117 1HB ALA 117 -2.796 12.581 -0.839 827 HB2 ALA 117 2HB ALA 117 -1.430 13.412 -1.583 828 HB3 ALA 117 3HB ALA 117 -1.163 12.319 -0.225 829 H THR 118 H THR 118 -3.216 14.967 -1.780 830 HA THR 118 HA THR 118 -2.580 17.754 -1.610 831 HB THR 118 HB THR 118 -1.527 16.761 -4.161 832 HG1 THR 118 1HG THR 118 0.532 16.224 -3.042 833 HG21 THR 118 3HG2 THR 118 -1.040 18.967 -3.918 834 HG22 THR 118 1HG2 THR 118 0.395 18.320 -3.126 835 HG23 THR 118 2HG2 THR 118 -0.974 18.871 -2.158 836 H ALA 119 H ALA 119 -2.906 18.507 -4.234 837 HA ALA 119 HA ALA 119 -5.706 18.284 -4.563 838 HB1 ALA 119 1HB ALA 119 -4.209 19.123 -6.934 839 HB2 ALA 119 2HB ALA 119 -5.467 19.964 -6.026 840 HB3 ALA 119 3HB ALA 119 -3.795 20.007 -5.465 841 H TYR 120 H TYR 120 -3.200 16.197 -5.413 842 HA TYR 120 HA TYR 120 -4.792 14.955 -7.551 843 HB2 TYR 120 1HB TYR 120 -2.222 15.655 -7.717 844 HB3 TYR 120 2HB TYR 120 -2.007 14.063 -6.998 845 HD1 TYR 120 2HD TYR 120 -4.497 12.848 -8.396 846 HD2 TYR 120 1HD TYR 120 -1.178 15.105 -9.811 847 HE1 TYR 120 2HE TYR 120 -4.745 11.812 -10.613 848 HE2 TYR 120 1HE TYR 120 -1.418 14.075 -12.031 849 HH TYR 120 HH TYR 120 -3.550 11.404 -12.598 850 H GLY 121 H GLY 121 -5.468 14.654 -4.778 851 HA2 GLY 121 2HA GLY 121 -5.914 13.036 -3.202 852 HA3 GLY 121 3HA GLY 121 -6.075 11.986 -4.602 853 H TYR 122 H TYR 122 -5.003 10.165 -4.243 854 HA TYR 122 HA TYR 122 -2.355 10.334 -2.961 855 HB2 TYR 122 1HB TYR 122 -4.539 8.290 -2.772 856 HB3 TYR 122 2HB TYR 122 -2.867 7.807 -2.506 857 HD1 TYR 122 2HD TYR 122 -4.798 10.850 -1.510 858 HD2 TYR 122 1HD TYR 122 -2.528 7.480 -0.246 859 HE1 TYR 122 2HE TYR 122 -4.949 11.629 0.818 860 HE2 TYR 122 1HE TYR 122 -2.673 8.249 2.086 861 HH TYR 122 HH TYR 122 -3.058 10.786 3.166 862 H SER 123 H SER 123 -0.642 9.660 -4.082 863 HA SER 123 HA SER 123 -1.129 8.244 -6.619 864 HB2 SER 123 1HB SER 123 1.302 9.906 -5.942 865 HB3 SER 123 2HB SER 123 0.811 9.309 -7.528 866 HG SER 123 HG SER 123 -0.987 10.696 -7.422 867 H LEU 124 H LEU 124 0.319 6.591 -7.252 868 HA LEU 124 HA LEU 124 2.457 5.686 -5.633 869 HB2 LEU 124 1HB LEU 124 0.693 5.026 -4.120 870 HB3 LEU 124 2HB LEU 124 -0.147 4.185 -5.420 871 HG LEU 124 HG LEU 124 2.591 3.245 -4.900 872 HD11 LEU 124 1HD1 LEU 124 1.069 3.783 -2.660 873 HD12 LEU 124 2HD1 LEU 124 2.419 2.654 -2.761 874 HD13 LEU 124 3HD1 LEU 124 0.767 2.073 -2.973 875 HD21 LEU 124 3HD2 LEU 124 0.159 2.323 -6.053 876 HD22 LEU 124 1HD2 LEU 124 0.608 1.230 -4.743 877 HD23 LEU 124 2HD2 LEU 124 1.745 1.550 -6.052 878 H TRP 125 H TRP 125 3.531 5.535 -7.583 879 HA TRP 125 HA TRP 125 2.521 3.528 -9.484 880 HB2 TRP 125 1HB TRP 125 4.595 5.670 -9.993 881 HB3 TRP 125 2HB TRP 125 3.852 4.611 -11.189 882 HD1 TRP 125 HD TRP 125 0.902 5.251 -9.519 883 HE1 TRP 125 1HE TRP 125 -0.321 7.380 -10.294 884 HE3 TRP 125 3HE TRP 125 4.781 7.605 -11.874 885 HZ2 TRP 125 2HZ TRP 125 0.279 9.744 -11.715 886 HZ3 TRP 125 3HZ TRP 125 4.374 9.797 -12.916 887 HH2 TRP 125 HH TRP 125 2.168 10.842 -12.837 888 H GLU 126 H GLU 126 4.823 4.050 -7.098 889 HA GLU 126 HA GLU 126 6.436 1.803 -8.103 890 HB2 GLU 126 1HB GLU 126 7.294 4.470 -7.198 891 HB3 GLU 126 2HB GLU 126 8.192 3.132 -6.496 892 HG2 GLU 126 1HG GLU 126 8.849 2.346 -8.647 893 HG3 GLU 126 2HG GLU 126 7.772 3.486 -9.451 894 H PHE 127 H PHE 127 4.788 0.640 -6.784 895 HA PHE 127 HA PHE 127 5.645 0.545 -3.968 896 HB2 PHE 127 1HB PHE 127 3.431 1.549 -4.056 897 HB3 PHE 127 2HB PHE 127 2.836 0.220 -5.045 898 HD1 PHE 127 1HD PHE 127 5.127 -0.429 -2.287 899 HD2 PHE 127 2HD PHE 127 1.044 -0.240 -3.472 900 HE1 PHE 127 1HE PHE 127 4.482 -1.650 -0.250 901 HE2 PHE 127 2HE PHE 127 0.392 -1.459 -1.438 902 HZ PHE 127 HZ PHE 127 2.112 -2.166 0.178 903 H GLU 128 H GLU 128 6.748 -1.280 -3.713 904 HA GLU 128 HA GLU 128 5.677 -3.737 -4.940 905 HB2 GLU 128 1HB GLU 128 8.040 -4.558 -5.005 906 HB3 GLU 128 2HB GLU 128 7.715 -3.204 -6.079 907 HG2 GLU 128 1HG GLU 128 8.642 -1.706 -4.281 908 HG3 GLU 128 2HG GLU 128 9.178 -3.169 -3.457 909 H VAL 129 H VAL 129 5.070 -5.232 -3.531 910 HA VAL 129 HA VAL 129 6.482 -5.482 -0.981 911 HB VAL 129 HB VAL 129 4.623 -4.075 -0.392 912 HG11 VAL 129 1HG1 VAL 129 2.725 -4.117 -1.538 913 HG12 VAL 129 2HG1 VAL 129 3.264 -5.562 -2.399 914 HG13 VAL 129 3HG1 VAL 129 2.369 -5.717 -0.886 915 HG21 VAL 129 3HG2 VAL 129 5.239 -6.334 0.887 916 HG22 VAL 129 1HG2 VAL 129 3.967 -5.245 1.441 917 HG23 VAL 129 2HG2 VAL 129 3.552 -6.685 0.512 918 H TYR 130 H TYR 130 6.982 -7.536 -0.623 919 HA TYR 130 HA TYR 130 5.238 -9.707 -0.847 920 HB2 TYR 130 1HB TYR 130 6.429 -10.856 -2.804 921 HB3 TYR 130 2HB TYR 130 5.279 -9.583 -3.200 922 HD1 TYR 130 2HD TYR 130 8.892 -10.330 -2.852 923 HD2 TYR 130 1HD TYR 130 5.957 -7.661 -4.393 924 HE1 TYR 130 2HE TYR 130 10.635 -9.164 -4.137 925 HE2 TYR 130 1HE TYR 130 7.693 -6.489 -5.683 926 HH TYR 130 HH TYR 130 9.922 -6.234 -5.964 927 H GLY 131 H GLY 131 6.324 -11.796 -0.491 928 HA2 GLY 131 2HA GLY 131 8.904 -11.384 0.884 929 HA3 GLY 131 3HA GLY 131 7.701 -12.575 1.358 Start of MODEL 10 1 H ASN 1 H ASN 1 -9.980 -17.146 -18.382 2 HA ASN 1 HA ASN 1 -8.178 -16.238 -17.176 3 HB2 ASN 1 1HB ASN 1 -8.015 -14.955 -19.914 4 HB3 ASN 1 2HB ASN 1 -6.663 -15.226 -18.818 5 HD21 ASN 1 1HD2 ASN 1 -6.144 -17.448 -18.283 6 HD22 ASN 1 2HD2 ASN 1 -6.432 -18.685 -19.454 7 H LEU 2 H LEU 2 -9.041 -14.907 -15.566 8 HA LEU 2 HA LEU 2 -8.432 -12.119 -15.871 9 HB2 LEU 2 1HB LEU 2 -10.741 -12.336 -16.816 10 HB3 LEU 2 2HB LEU 2 -11.278 -12.863 -15.221 11 HG LEU 2 HG LEU 2 -10.052 -10.484 -14.654 12 HD11 LEU 2 1HD1 LEU 2 -10.196 -8.980 -16.310 13 HD12 LEU 2 2HD1 LEU 2 -11.715 -9.640 -16.916 14 HD13 LEU 2 3HD1 LEU 2 -10.185 -10.393 -17.363 15 HD21 LEU 2 3HD2 LEU 2 -12.148 -9.796 -14.016 16 HD22 LEU 2 1HD2 LEU 2 -12.387 -11.541 -14.118 17 HD23 LEU 2 2HD2 LEU 2 -12.930 -10.498 -15.433 18 H ALA 3 H ALA 3 -7.253 -13.916 -14.239 19 HA ALA 3 HA ALA 3 -8.031 -12.927 -11.601 20 HB1 ALA 3 1HB ALA 3 -8.102 -15.033 -10.565 21 HB2 ALA 3 2HB ALA 3 -9.057 -15.215 -12.037 22 HB3 ALA 3 3HB ALA 3 -7.411 -15.842 -11.972 23 H LEU 4 H LEU 4 -6.308 -12.144 -10.591 24 HA LEU 4 HA LEU 4 -3.744 -13.469 -10.745 25 HB2 LEU 4 1HB LEU 4 -3.869 -11.946 -12.742 26 HB3 LEU 4 2HB LEU 4 -3.952 -10.593 -11.615 27 HG LEU 4 HG LEU 4 -1.715 -11.431 -10.710 28 HD11 LEU 4 1HD1 LEU 4 -1.358 -13.542 -11.515 29 HD12 LEU 4 2HD1 LEU 4 -0.467 -12.596 -12.707 30 HD13 LEU 4 3HD1 LEU 4 -2.084 -13.189 -13.083 31 HD21 LEU 4 3HD2 LEU 4 -0.558 -10.054 -12.167 32 HD22 LEU 4 1HD2 LEU 4 -2.219 -9.486 -12.344 33 HD23 LEU 4 2HD2 LEU 4 -1.516 -10.550 -13.563 34 H ASN 5 H ASN 5 -2.237 -12.711 -9.170 35 HA ASN 5 HA ASN 5 -3.451 -11.904 -6.742 36 HB2 ASN 5 1HB ASN 5 -0.512 -12.004 -7.458 37 HB3 ASN 5 2HB ASN 5 -1.173 -11.914 -5.828 38 HD21 ASN 5 1HD2 ASN 5 -3.235 -13.693 -5.957 39 HD22 ASN 5 2HD2 ASN 5 -2.620 -15.285 -6.226 40 H LYS 6 H LYS 6 -2.408 -10.135 -9.406 41 HA LYS 6 HA LYS 6 -1.381 -7.806 -8.201 42 HB2 LYS 6 1HB LYS 6 -1.330 -8.490 -10.671 43 HB3 LYS 6 2HB LYS 6 -2.962 -7.842 -10.766 44 HG2 LYS 6 1HG LYS 6 -1.354 -6.204 -11.523 45 HG3 LYS 6 2HG LYS 6 -2.131 -5.657 -10.036 46 HD2 LYS 6 1HD LYS 6 0.239 -7.187 -9.445 47 HD3 LYS 6 2HD LYS 6 0.613 -5.858 -10.544 48 HE2 LYS 6 1HE LYS 6 -0.974 -4.580 -8.787 49 HE3 LYS 6 2HE LYS 6 -0.279 -5.807 -7.730 50 HZ1 LYS 6 3HZ LYS 6 0.938 -3.471 -8.843 51 HZ2 LYS 6 1HZ LYS 6 1.853 -4.862 -9.137 52 HZ3 LYS 6 2HZ LYS 6 1.446 -4.437 -7.552 53 H ALA 7 H ALA 7 -4.508 -9.103 -8.210 54 HA ALA 7 HA ALA 7 -6.199 -6.925 -8.296 55 HB1 ALA 7 1HB ALA 7 -7.800 -8.244 -7.244 56 HB2 ALA 7 2HB ALA 7 -6.731 -9.428 -7.999 57 HB3 ALA 7 3HB ALA 7 -6.601 -9.097 -6.272 58 H THR 8 H THR 8 -6.797 -5.321 -6.924 59 HA THR 8 HA THR 8 -5.705 -5.282 -4.210 60 HB THR 8 HB THR 8 -4.479 -3.375 -4.402 61 HG1 THR 8 1HG THR 8 -5.912 -1.870 -5.037 62 HG21 THR 8 3HG2 THR 8 -3.610 -5.036 -6.076 63 HG22 THR 8 1HG2 THR 8 -3.164 -3.360 -6.397 64 HG23 THR 8 2HG2 THR 8 -4.456 -4.122 -7.323 65 H ALA 9 H ALA 9 -6.556 -3.234 -3.041 66 HA ALA 9 HA ALA 9 -9.226 -2.475 -3.964 67 HB1 ALA 9 1HB ALA 9 -8.910 -4.487 -2.104 68 HB2 ALA 9 2HB ALA 9 -9.234 -3.061 -1.118 69 HB3 ALA 9 3HB ALA 9 -10.373 -3.540 -2.377 70 H THR 10 H THR 10 -9.833 -0.442 -3.385 71 HA THR 10 HA THR 10 -8.292 0.994 -1.362 72 HB THR 10 HB THR 10 -7.664 2.799 -2.741 73 HG1 THR 10 1HG THR 10 -9.527 1.692 -4.546 74 HG21 THR 10 3HG2 THR 10 -6.504 0.465 -3.084 75 HG22 THR 10 1HG2 THR 10 -6.079 1.837 -4.106 76 HG23 THR 10 2HG2 THR 10 -7.188 0.603 -4.703 77 H SER 11 H SER 11 -9.224 3.316 -1.160 78 HA SER 11 HA SER 11 -12.097 3.011 -0.847 79 HB2 SER 11 1HB SER 11 -10.978 3.911 1.063 80 HB3 SER 11 2HB SER 11 -10.136 5.113 0.084 81 HG SER 11 HG SER 11 -11.816 6.365 0.218 82 H SER 12 H SER 12 -9.814 5.129 -2.529 83 HA SER 12 HA SER 12 -12.066 6.149 -4.134 84 HB2 SER 12 1HB SER 12 -10.390 7.653 -2.558 85 HB3 SER 12 2HB SER 12 -9.624 7.781 -4.142 86 HG SER 12 HG SER 12 -11.207 9.003 -4.783 87 H ILE 13 H ILE 13 -11.279 6.997 -6.324 88 HA ILE 13 HA ILE 13 -8.941 5.991 -7.517 89 HB ILE 13 HB ILE 13 -10.135 3.821 -7.149 90 HG12 ILE 13 1HG1 ILE 13 -9.684 2.956 -9.385 91 HG13 ILE 13 2HG1 ILE 13 -9.753 4.583 -10.053 92 HG21 ILE 13 1HG2 ILE 13 -12.050 4.882 -9.223 93 HG22 ILE 13 2HG2 ILE 13 -12.066 3.276 -8.496 94 HG23 ILE 13 3HG2 ILE 13 -12.415 4.694 -7.508 95 HD11 ILE 13 3HD1 ILE 13 -7.829 4.405 -7.911 96 HD12 ILE 13 1HD1 ILE 13 -7.500 3.232 -9.186 97 HD13 ILE 13 2HD1 ILE 13 -7.622 4.948 -9.576 98 H GLU 14 H GLU 14 -8.794 6.485 -9.763 99 HA GLU 14 HA GLU 14 -10.646 8.593 -10.556 100 HB2 GLU 14 1HB GLU 14 -7.883 7.793 -11.355 101 HB3 GLU 14 2HB GLU 14 -8.857 8.705 -12.500 102 HG2 GLU 14 1HG GLU 14 -9.235 10.238 -10.370 103 HG3 GLU 14 2HG GLU 14 -7.683 9.539 -9.913 104 H THR 15 H THR 15 -9.406 5.498 -11.726 105 HA THR 15 HA THR 15 -11.171 5.584 -14.040 106 HB THR 15 HB THR 15 -10.133 3.211 -14.374 107 HG1 THR 15 1HG THR 15 -9.139 3.008 -12.358 108 HG21 THR 15 3HG2 THR 15 -9.594 4.988 -15.867 109 HG22 THR 15 1HG2 THR 15 -8.066 4.277 -15.352 110 HG23 THR 15 2HG2 THR 15 -8.611 5.800 -14.648 111 H ALA 16 H ALA 16 -12.224 5.396 -11.275 112 HA ALA 16 HA ALA 16 -13.706 4.186 -10.017 113 HB1 ALA 16 1HB ALA 16 -14.699 3.364 -12.743 114 HB2 ALA 16 2HB ALA 16 -15.628 3.410 -11.244 115 HB3 ALA 16 3HB ALA 16 -15.048 4.910 -11.967 116 H GLY 17 H GLY 17 -11.229 2.813 -10.503 117 HA2 GLY 17 2HA GLY 17 -10.560 0.711 -9.678 118 HA3 GLY 17 3HA GLY 17 -12.171 0.092 -10.012 119 H HIS 18 H HIS 18 -8.973 0.499 -11.191 120 HA HIS 18 HA HIS 18 -9.117 -1.513 -13.083 121 HB2 HIS 18 1HB HIS 18 -10.378 0.835 -14.028 122 HB3 HIS 18 2HB HIS 18 -8.845 0.706 -14.887 123 HD1 HIS 18 1HD HIS 18 -8.552 -2.145 -15.550 124 HD2 HIS 18 2HD HIS 18 -12.266 -0.284 -15.586 125 HE1 HIS 18 1HE HIS 18 -10.000 -3.561 -17.042 126 H GLU 19 H GLU 19 -7.678 1.475 -12.027 127 HA GLU 19 HA GLU 19 -5.235 1.280 -13.428 128 HB2 GLU 19 1HB GLU 19 -6.346 2.905 -11.273 129 HB3 GLU 19 2HB GLU 19 -4.629 2.588 -11.063 130 HG2 GLU 19 1HG GLU 19 -5.961 3.874 -13.432 131 HG3 GLU 19 2HG GLU 19 -4.901 4.642 -12.252 132 H GLY 20 H GLY 20 -6.392 -0.135 -10.443 133 HA2 GLY 20 2HA GLY 20 -3.865 -0.980 -9.454 134 HA3 GLY 20 3HA GLY 20 -5.430 -1.610 -8.964 135 H ASP 21 H ASP 21 -6.292 -2.530 -11.501 136 HA ASP 21 HA ASP 21 -4.866 -5.029 -11.581 137 HB2 ASP 21 1HB ASP 21 -7.304 -4.994 -11.782 138 HB3 ASP 21 2HB ASP 21 -7.182 -4.026 -13.248 139 H LYS 22 H LYS 22 -4.316 -2.090 -12.972 140 HA LYS 22 HA LYS 22 -3.528 -2.954 -15.599 141 HB2 LYS 22 1HB LYS 22 -3.875 -0.457 -14.222 142 HB3 LYS 22 2HB LYS 22 -2.290 -0.488 -14.986 143 HG2 LYS 22 1HG LYS 22 -4.561 -1.397 -16.639 144 HG3 LYS 22 2HG LYS 22 -4.510 0.321 -16.234 145 HD2 LYS 22 1HD LYS 22 -2.320 0.542 -17.193 146 HD3 LYS 22 2HD LYS 22 -2.199 -1.203 -17.431 147 HE2 LYS 22 1HE LYS 22 -3.164 -1.017 -19.422 148 HE3 LYS 22 2HE LYS 22 -4.582 -0.270 -18.686 149 HZ1 LYS 22 3HZ LYS 22 -3.020 1.818 -18.705 150 HZ2 LYS 22 1HZ LYS 22 -3.916 1.387 -20.074 151 HZ3 LYS 22 2HZ LYS 22 -2.275 0.989 -19.977 152 H ALA 23 H ALA 23 -2.201 -3.399 -12.612 153 HA ALA 23 HA ALA 23 0.578 -3.097 -13.426 154 HB1 ALA 23 1HB ALA 23 0.117 -2.393 -11.203 155 HB2 ALA 23 2HB ALA 23 -0.699 -3.910 -10.824 156 HB3 ALA 23 3HB ALA 23 1.044 -3.889 -11.092 157 H VAL 24 H VAL 24 -1.553 -5.237 -14.298 158 HA VAL 24 HA VAL 24 -0.877 -7.766 -13.513 159 HB VAL 24 HB VAL 24 -1.612 -6.770 -16.260 160 HG11 VAL 24 1HG1 VAL 24 -2.213 -9.260 -16.599 161 HG12 VAL 24 2HG1 VAL 24 -0.535 -8.754 -16.802 162 HG13 VAL 24 3HG1 VAL 24 -1.043 -9.552 -15.313 163 HG21 VAL 24 3HG2 VAL 24 -3.498 -8.510 -14.958 164 HG22 VAL 24 1HG2 VAL 24 -3.080 -7.153 -13.910 165 HG23 VAL 24 2HG2 VAL 24 -3.712 -6.855 -15.530 166 H ASP 25 H ASP 25 0.929 -5.619 -15.603 167 HA ASP 25 HA ASP 25 2.714 -7.461 -16.725 168 HB2 ASP 25 1HB ASP 25 2.832 -4.518 -16.168 169 HB3 ASP 25 2HB ASP 25 4.273 -5.355 -16.736 170 H GLY 26 H GLY 26 2.910 -5.600 -13.709 171 HA2 GLY 26 2HA GLY 26 3.944 -6.309 -11.729 172 HA3 GLY 26 3HA GLY 26 4.715 -7.609 -12.624 173 H ASN 27 H ASN 27 4.747 -4.139 -13.330 174 HA ASN 27 HA ASN 27 7.478 -3.872 -12.416 175 HB2 ASN 27 1HB ASN 27 7.095 -4.706 -15.029 176 HB3 ASN 27 2HB ASN 27 7.306 -2.964 -15.187 177 HD21 ASN 27 1HD2 ASN 27 8.810 -5.964 -14.567 178 HD22 ASN 27 2HD2 ASN 27 10.420 -5.372 -14.354 179 H ALA 28 H ALA 28 8.181 -1.554 -13.704 180 HA ALA 28 HA ALA 28 6.519 0.359 -12.356 181 HB1 ALA 28 1HB ALA 28 9.017 0.500 -12.526 182 HB2 ALA 28 2HB ALA 28 8.809 0.941 -14.222 183 HB3 ALA 28 3HB ALA 28 8.154 1.978 -12.954 184 H ALA 29 H ALA 29 6.155 -1.175 -15.231 185 HA ALA 29 HA ALA 29 5.476 0.906 -17.014 186 HB1 ALA 29 1HB ALA 29 5.935 -1.538 -17.556 187 HB2 ALA 29 2HB ALA 29 4.265 -1.842 -17.076 188 HB3 ALA 29 3HB ALA 29 4.613 -0.760 -18.425 189 H THR 30 H THR 30 3.936 -0.219 -14.226 190 HA THR 30 HA THR 30 1.331 0.836 -15.100 191 HB THR 30 HB THR 30 0.984 -1.353 -14.306 192 HG1 THR 30 1HG THR 30 -0.610 -0.524 -13.192 193 HG21 THR 30 3HG2 THR 30 1.871 -1.578 -11.712 194 HG22 THR 30 1HG2 THR 30 3.180 -0.697 -12.497 195 HG23 THR 30 2HG2 THR 30 2.665 -2.260 -13.130 196 H ARG 31 H ARG 31 0.325 2.462 -13.978 197 HA ARG 31 HA ARG 31 1.704 3.577 -11.642 198 HB2 ARG 31 1HB ARG 31 0.962 5.048 -14.163 199 HB3 ARG 31 2HB ARG 31 1.199 5.882 -12.633 200 HG2 ARG 31 1HG ARG 31 3.470 5.372 -12.567 201 HG3 ARG 31 2HG ARG 31 3.307 4.077 -13.754 202 HD2 ARG 31 1HD ARG 31 3.390 5.496 -15.512 203 HD3 ARG 31 2HD ARG 31 2.512 6.766 -14.662 204 HE ARG 31 HE ARG 31 4.513 7.668 -14.020 205 HH11 ARG 31 1HH1 ARG 31 5.036 4.405 -15.114 206 HH12 ARG 31 2HH1 ARG 31 6.764 4.522 -15.053 207 HH21 ARG 31 1HH2 ARG 31 6.787 7.834 -13.934 208 HH22 ARG 31 2HH2 ARG 31 7.758 6.473 -14.381 209 H TRP 32 H TRP 32 0.276 3.574 -10.044 210 HA TRP 32 HA TRP 32 -2.570 3.682 -10.604 211 HB2 TRP 32 1HB TRP 32 -1.946 2.068 -8.968 212 HB3 TRP 32 2HB TRP 32 -0.972 3.239 -8.082 213 HD1 TRP 32 HD TRP 32 -2.381 5.177 -6.720 214 HE1 TRP 32 1HE TRP 32 -4.693 5.035 -5.596 215 HE3 TRP 32 3HE TRP 32 -4.185 1.026 -9.098 216 HZ2 TRP 32 2HZ TRP 32 -6.978 3.381 -5.703 217 HZ3 TRP 32 3HZ TRP 32 -6.443 0.229 -8.529 218 HH2 TRP 32 HH TRP 32 -7.808 1.383 -6.866 219 H ALA 33 H ALA 33 -3.884 5.379 -10.256 220 HA ALA 33 HA ALA 33 -2.872 7.680 -8.748 221 HB1 ALA 33 1HB ALA 33 -2.488 8.799 -10.636 222 HB2 ALA 33 2HB ALA 33 -3.313 7.587 -11.617 223 HB3 ALA 33 3HB ALA 33 -4.240 8.865 -10.831 224 H SER 34 H SER 34 -4.327 7.206 -7.098 225 HA SER 34 HA SER 34 -7.098 6.749 -7.542 226 HB2 SER 34 1HB SER 34 -5.331 7.128 -5.200 227 HB3 SER 34 2HB SER 34 -7.021 7.569 -4.960 228 HG SER 34 HG SER 34 -7.612 5.529 -5.216 229 H ALA 35 H ALA 35 -8.805 8.123 -7.545 230 HA ALA 35 HA ALA 35 -8.568 10.725 -8.392 231 HB1 ALA 35 1HB ALA 35 -10.663 9.735 -8.669 232 HB2 ALA 35 2HB ALA 35 -10.790 9.305 -6.963 233 HB3 ALA 35 3HB ALA 35 -10.941 10.990 -7.461 234 H TYR 36 H TYR 36 -8.386 12.706 -7.467 235 HA TYR 36 HA TYR 36 -7.258 12.905 -4.882 236 HB2 TYR 36 1HB TYR 36 -7.012 15.185 -5.316 237 HB3 TYR 36 2HB TYR 36 -6.994 14.476 -6.927 238 HD1 TYR 36 1HD TYR 36 -9.738 14.078 -7.623 239 HD2 TYR 36 2HD TYR 36 -8.006 17.266 -5.399 240 HE1 TYR 36 1HE TYR 36 -11.593 15.546 -8.293 241 HE2 TYR 36 2HE TYR 36 -9.857 18.742 -6.064 242 HH TYR 36 HH TYR 36 -12.172 18.560 -6.832 243 H GLY 37 H GLY 37 -8.097 13.552 -2.945 244 HA2 GLY 37 2HA GLY 37 -10.663 14.703 -2.609 245 HA3 GLY 37 3HA GLY 37 -10.748 12.971 -2.330 246 H ALA 38 H ALA 38 -11.454 13.923 -0.178 247 HA ALA 38 HA ALA 38 -9.187 14.713 1.498 248 HB1 ALA 38 1HB ALA 38 -11.589 14.620 2.997 249 HB2 ALA 38 2HB ALA 38 -10.666 16.035 2.488 250 HB3 ALA 38 3HB ALA 38 -11.945 15.397 1.455 251 H SER 39 H SER 39 -8.762 13.655 3.499 252 HA SER 39 HA SER 39 -8.535 10.918 3.402 253 HB2 SER 39 1HB SER 39 -7.402 11.249 5.309 254 HB3 SER 39 2HB SER 39 -7.912 12.937 5.254 255 HG SER 39 HG SER 39 -9.317 12.565 6.786 256 HA PRO 40 HA PRO 40 -8.422 9.605 5.675 257 HB2 PRO 40 1HB PRO 40 -8.995 6.952 5.608 258 HB3 PRO 40 2HB PRO 40 -9.442 7.998 6.961 259 HG2 PRO 40 1HG PRO 40 -11.117 7.043 4.671 260 HG3 PRO 40 2HG PRO 40 -11.533 7.155 6.391 261 HD2 PRO 40 1HD PRO 40 -12.325 9.003 4.576 262 HD3 PRO 40 2HD PRO 40 -11.970 9.415 6.266 263 H GLN 41 H GLN 41 -6.820 8.100 4.713 264 HA GLN 41 HA GLN 41 -7.291 7.471 1.894 265 HB2 GLN 41 1HB GLN 41 -4.779 8.887 2.768 266 HB3 GLN 41 2HB GLN 41 -5.332 8.577 1.128 267 HG2 GLN 41 1HG GLN 41 -6.015 10.701 1.200 268 HG3 GLN 41 2HG GLN 41 -7.388 10.047 2.089 269 HE21 GLN 41 1HE2 GLN 41 -6.505 12.685 2.317 270 HE22 GLN 41 2HE2 GLN 41 -5.916 12.931 3.922 271 H TRP 42 H TRP 42 -6.675 5.462 1.483 272 HA TRP 42 HA TRP 42 -4.216 4.369 2.428 273 HB2 TRP 42 1HB TRP 42 -5.138 2.546 3.778 274 HB3 TRP 42 2HB TRP 42 -5.551 4.110 4.476 275 HD1 TRP 42 HD TRP 42 -8.151 4.941 4.083 276 HE1 TRP 42 1HE TRP 42 -10.305 3.546 3.897 277 HE3 TRP 42 3HE TRP 42 -6.080 0.392 3.011 278 HZ2 TRP 42 2HZ TRP 42 -11.031 0.870 3.368 279 HZ3 TRP 42 3HZ TRP 42 -7.574 -1.535 2.680 280 HH2 TRP 42 HH TRP 42 -9.998 -1.299 2.857 281 H ILE 43 H ILE 43 -3.976 2.048 1.744 282 HA ILE 43 HA ILE 43 -5.794 1.235 -0.388 283 HB ILE 43 HB ILE 43 -4.200 2.517 -1.631 284 HG12 ILE 43 1HG1 ILE 43 -3.082 -0.211 -2.065 285 HG13 ILE 43 2HG1 ILE 43 -4.822 -0.004 -2.237 286 HG21 ILE 43 1HG2 ILE 43 -1.821 2.223 -1.497 287 HG22 ILE 43 2HG2 ILE 43 -2.445 2.522 0.125 288 HG23 ILE 43 3HG2 ILE 43 -2.008 0.885 -0.364 289 HD11 ILE 43 3HD1 ILE 43 -2.622 0.929 -3.946 290 HD12 ILE 43 1HD1 ILE 43 -4.269 0.453 -4.363 291 HD13 ILE 43 2HD1 ILE 43 -3.952 2.063 -3.716 292 H TYR 44 H TYR 44 -5.752 -0.967 -0.853 293 HA TYR 44 HA TYR 44 -4.151 -2.597 1.008 294 HB2 TYR 44 1HB TYR 44 -6.390 -2.879 1.675 295 HB3 TYR 44 2HB TYR 44 -6.971 -2.929 0.015 296 HD1 TYR 44 1HD TYR 44 -6.738 -4.966 -1.325 297 HD2 TYR 44 2HD TYR 44 -5.492 -4.847 2.742 298 HE1 TYR 44 1HE TYR 44 -6.660 -7.424 -1.284 299 HE2 TYR 44 2HE TYR 44 -5.409 -7.305 2.794 300 HH TYR 44 HH TYR 44 -6.439 -9.208 1.567 301 H ILE 45 H ILE 45 -3.273 -4.541 0.256 302 HA ILE 45 HA ILE 45 -3.460 -5.071 -2.620 303 HB ILE 45 HB ILE 45 -0.938 -4.500 -1.098 304 HG12 ILE 45 1HG1 ILE 45 -2.297 -2.858 -2.632 305 HG13 ILE 45 2HG1 ILE 45 -0.540 -2.902 -2.726 306 HG21 ILE 45 1HG2 ILE 45 -0.452 -6.625 -2.008 307 HG22 ILE 45 2HG2 ILE 45 -1.249 -6.236 -3.532 308 HG23 ILE 45 3HG2 ILE 45 0.270 -5.449 -3.105 309 HD11 ILE 45 3HD1 ILE 45 -1.909 -2.883 -4.900 310 HD12 ILE 45 1HD1 ILE 45 -0.554 -4.002 -4.761 311 HD13 ILE 45 2HD1 ILE 45 -2.205 -4.585 -4.549 312 H ASN 46 H ASN 46 -3.561 -7.182 -3.105 313 HA ASN 46 HA ASN 46 -3.193 -9.093 -0.903 314 HB2 ASN 46 1HB ASN 46 -5.418 -9.181 -1.786 315 HB3 ASN 46 2HB ASN 46 -4.823 -9.238 -3.443 316 HD21 ASN 46 1HD2 ASN 46 -5.750 -11.025 -0.731 317 HD22 ASN 46 2HD2 ASN 46 -5.320 -12.595 -1.313 318 H LEU 47 H LEU 47 -2.032 -11.008 -1.207 319 HA LEU 47 HA LEU 47 -0.164 -10.943 -3.481 320 HB2 LEU 47 1HB LEU 47 0.619 -10.740 -1.014 321 HB3 LEU 47 2HB LEU 47 0.326 -12.477 -0.958 322 HG LEU 47 HG LEU 47 1.966 -12.810 -2.745 323 HD11 LEU 47 1HD1 LEU 47 2.309 -11.080 -4.112 324 HD12 LEU 47 2HD1 LEU 47 3.421 -10.490 -2.877 325 HD13 LEU 47 3HD1 LEU 47 1.757 -9.908 -2.916 326 HD21 LEU 47 3HD2 LEU 47 3.907 -12.470 -1.434 327 HD22 LEU 47 1HD2 LEU 47 2.586 -12.753 -0.300 328 HD23 LEU 47 2HD2 LEU 47 3.176 -11.114 -0.574 329 H GLY 48 H GLY 48 -2.172 -13.052 -1.475 330 HA2 GLY 48 2HA GLY 48 -3.473 -14.745 -2.708 331 HA3 GLY 48 3HA GLY 48 -2.009 -15.075 -3.622 332 H SER 49 H SER 49 -0.329 -14.869 -1.195 333 HA SER 49 HA SER 49 -1.226 -17.006 0.529 334 HB2 SER 49 1HB SER 49 1.403 -17.587 -0.733 335 HB3 SER 49 2HB SER 49 0.163 -18.697 -0.148 336 HG SER 49 HG SER 49 0.446 -18.569 -2.495 337 H THR 50 H THR 50 0.656 -17.611 2.081 338 HA THR 50 HA THR 50 1.563 -15.154 3.256 339 HB THR 50 HB THR 50 2.829 -17.252 4.605 340 HG1 THR 50 1HG THR 50 1.555 -18.752 3.450 341 HG21 THR 50 3HG2 THR 50 1.073 -15.176 5.146 342 HG22 THR 50 1HG2 THR 50 1.786 -16.277 6.326 343 HG23 THR 50 2HG2 THR 50 0.194 -16.620 5.650 344 H GLN 51 H GLN 51 3.420 -14.159 2.857 345 HA GLN 51 HA GLN 51 5.704 -15.754 1.908 346 HB2 GLN 51 1HB GLN 51 4.314 -13.677 0.517 347 HB3 GLN 51 2HB GLN 51 5.941 -13.119 0.885 348 HG2 GLN 51 1HG GLN 51 5.156 -15.580 -0.652 349 HG3 GLN 51 2HG GLN 51 5.966 -14.139 -1.264 350 HE21 GLN 51 1HE2 GLN 51 6.551 -17.187 -0.772 351 HE22 GLN 51 2HE2 GLN 51 8.185 -17.154 -0.212 352 H SER 52 H SER 52 7.720 -15.169 2.658 353 HA SER 52 HA SER 52 7.740 -13.664 5.114 354 HB2 SER 52 1HB SER 52 9.095 -15.816 4.498 355 HB3 SER 52 2HB SER 52 10.227 -14.676 3.772 356 HG SER 52 HG SER 52 10.930 -14.792 5.805 357 H ILE 53 H ILE 53 8.404 -11.630 5.425 358 HA ILE 53 HA ILE 53 9.762 -10.254 3.201 359 HB ILE 53 HB ILE 53 8.016 -8.634 4.961 360 HG12 ILE 53 1HG1 ILE 53 6.930 -10.494 2.838 361 HG13 ILE 53 2HG1 ILE 53 6.558 -10.535 4.558 362 HG21 ILE 53 1HG2 ILE 53 9.483 -7.938 2.927 363 HG22 ILE 53 2HG2 ILE 53 8.125 -8.543 1.978 364 HG23 ILE 53 3HG2 ILE 53 7.880 -7.232 3.133 365 HD11 ILE 53 3HD1 ILE 53 5.764 -8.449 2.551 366 HD12 ILE 53 1HD1 ILE 53 4.718 -9.535 3.463 367 HD13 ILE 53 2HD1 ILE 53 5.583 -8.240 4.292 368 H SER 54 H SER 54 11.180 -8.553 3.777 369 HA SER 54 HA SER 54 11.966 -8.510 6.616 370 HB2 SER 54 1HB SER 54 14.334 -8.029 5.472 371 HB3 SER 54 2HB SER 54 13.776 -9.667 5.814 372 HG SER 54 HG SER 54 13.759 -10.034 3.753 373 H ARG 55 H ARG 55 11.813 -6.794 3.548 374 HA ARG 55 HA ARG 55 11.620 -4.276 4.990 375 HB2 ARG 55 1HB ARG 55 13.282 -3.203 3.445 376 HB3 ARG 55 2HB ARG 55 13.976 -4.329 4.604 377 HG2 ARG 55 1HG ARG 55 14.227 -6.010 2.926 378 HG3 ARG 55 2HG ARG 55 13.328 -5.043 1.755 379 HD2 ARG 55 1HD ARG 55 15.223 -3.279 2.328 380 HD3 ARG 55 2HD ARG 55 16.115 -4.743 2.738 381 HE ARG 55 HE ARG 55 14.953 -5.131 0.236 382 HH11 ARG 55 1HH1 ARG 55 17.356 -3.100 1.725 383 HH12 ARG 55 2HH1 ARG 55 18.282 -2.908 0.272 384 HH21 ARG 55 1HH2 ARG 55 16.162 -4.884 -1.683 385 HH22 ARG 55 2HH2 ARG 55 17.601 -3.921 -1.666 386 H VAL 56 H VAL 56 10.600 -2.621 3.811 387 HA VAL 56 HA VAL 56 9.557 -3.350 1.165 388 HB VAL 56 HB VAL 56 7.815 -2.151 3.319 389 HG11 VAL 56 1HG1 VAL 56 7.014 -3.435 0.717 390 HG12 VAL 56 2HG1 VAL 56 6.012 -2.482 1.815 391 HG13 VAL 56 3HG1 VAL 56 7.299 -1.703 0.893 392 HG21 VAL 56 3HG2 VAL 56 8.319 -4.366 4.044 393 HG22 VAL 56 1HG2 VAL 56 6.705 -4.400 3.335 394 HG23 VAL 56 2HG2 VAL 56 8.082 -5.015 2.422 395 H LYS 57 H LYS 57 9.316 -1.674 -0.247 396 HA LYS 57 HA LYS 57 9.928 1.025 0.762 397 HB2 LYS 57 1HB LYS 57 11.071 1.404 -1.463 398 HB3 LYS 57 2HB LYS 57 11.903 0.323 -0.352 399 HG2 LYS 57 1HG LYS 57 10.056 -0.974 -2.240 400 HG3 LYS 57 2HG LYS 57 11.482 -0.216 -2.954 401 HD2 LYS 57 1HD LYS 57 12.831 -1.821 -2.182 402 HD3 LYS 57 2HD LYS 57 12.127 -1.737 -0.566 403 HE2 LYS 57 1HE LYS 57 10.521 -3.332 -1.040 404 HE3 LYS 57 2HE LYS 57 10.611 -3.053 -2.779 405 HZ1 LYS 57 3HZ LYS 57 13.088 -3.924 -2.230 406 HZ2 LYS 57 1HZ LYS 57 11.824 -4.916 -2.760 407 HZ3 LYS 57 2HZ LYS 57 12.182 -4.811 -1.111 408 H LEU 58 H LEU 58 8.389 2.458 0.339 409 HA LEU 58 HA LEU 58 6.782 2.162 -2.095 410 HB2 LEU 58 1HB LEU 58 4.731 2.555 -0.932 411 HB3 LEU 58 2HB LEU 58 5.547 1.181 -0.190 412 HG LEU 58 HG LEU 58 6.315 3.497 1.248 413 HD11 LEU 58 1HD1 LEU 58 3.765 3.813 2.034 414 HD12 LEU 58 2HD1 LEU 58 3.522 3.538 0.310 415 HD13 LEU 58 3HD1 LEU 58 4.560 4.855 0.855 416 HD21 LEU 58 3HD2 LEU 58 5.716 0.921 1.776 417 HD22 LEU 58 1HD2 LEU 58 4.259 1.714 2.374 418 HD23 LEU 58 2HD2 LEU 58 5.837 2.176 3.011 419 H ASN 59 H ASN 59 6.314 4.040 -3.113 420 HA ASN 59 HA ASN 59 7.371 6.492 -1.893 421 HB2 ASN 59 1HB ASN 59 8.313 5.834 -4.082 422 HB3 ASN 59 2HB ASN 59 6.703 5.922 -4.789 423 HD21 ASN 59 1HD2 ASN 59 7.609 7.460 -6.256 424 HD22 ASN 59 2HD2 ASN 59 7.794 9.110 -5.778 425 H TRP 60 H TRP 60 6.163 8.373 -1.786 426 HA TRP 60 HA TRP 60 3.300 7.979 -1.676 427 HB2 TRP 60 1HB TRP 60 4.876 9.370 -0.071 428 HB3 TRP 60 2HB TRP 60 4.566 10.651 -1.240 429 HD1 TRP 60 HD TRP 60 2.656 12.155 -0.478 430 HE1 TRP 60 1HE TRP 60 0.459 11.847 0.827 431 HE3 TRP 60 3HE TRP 60 2.951 7.132 0.434 432 HZ2 TRP 60 2HZ TRP 60 -0.961 9.753 2.078 433 HZ3 TRP 60 3HZ TRP 60 1.131 6.054 1.693 434 HH2 TRP 60 HH TRP 60 -0.783 7.339 2.498 435 H GLU 61 H GLU 61 5.564 9.143 -3.933 436 HA GLU 61 HA GLU 61 5.333 9.988 -6.035 437 HB2 GLU 61 1HB GLU 61 3.003 8.547 -5.626 438 HB3 GLU 61 2HB GLU 61 2.422 10.124 -6.141 439 HG2 GLU 61 1HG GLU 61 2.740 8.499 -7.987 440 HG3 GLU 61 2HG GLU 61 3.648 9.998 -8.177 441 H ASP 62 H ASP 62 3.381 11.696 -7.112 442 HA ASP 62 HA ASP 62 4.215 14.187 -6.368 443 HB2 ASP 62 1HB ASP 62 1.975 13.108 -7.889 444 HB3 ASP 62 2HB ASP 62 1.577 14.634 -7.106 445 H ALA 63 H ALA 63 1.497 12.367 -5.024 446 HA ALA 63 HA ALA 63 0.258 14.214 -3.450 447 HB1 ALA 63 1HB ALA 63 -0.458 11.883 -3.628 448 HB2 ALA 63 2HB ALA 63 0.917 11.384 -2.642 449 HB3 ALA 63 3HB ALA 63 -0.348 12.396 -1.944 450 H TYR 64 H TYR 64 0.438 14.793 -1.205 451 HA TYR 64 HA TYR 64 3.138 14.543 -0.075 452 HB2 TYR 64 1HB TYR 64 3.129 16.718 -1.087 453 HB3 TYR 64 2HB TYR 64 1.551 17.093 -0.404 454 HD1 TYR 64 2HD TYR 64 1.324 17.641 1.974 455 HD2 TYR 64 1HD TYR 64 5.136 16.904 0.234 456 HE1 TYR 64 2HE TYR 64 2.409 18.664 3.931 457 HE2 TYR 64 1HE TYR 64 6.231 17.923 2.186 458 HH TYR 64 HH TYR 64 5.108 19.868 4.119 459 H ALA 65 H ALA 65 2.997 13.650 1.863 460 HA ALA 65 HA ALA 65 0.821 14.456 3.655 461 HB1 ALA 65 1HB ALA 65 1.617 11.598 3.116 462 HB2 ALA 65 2HB ALA 65 0.491 12.126 4.367 463 HB3 ALA 65 3HB ALA 65 0.095 12.365 2.665 464 H THR 66 H THR 66 1.252 13.882 5.931 465 HA THR 66 HA THR 66 3.924 14.586 6.646 466 HB THR 66 HB THR 66 1.985 15.316 7.983 467 HG1 THR 66 1HG THR 66 4.229 14.806 8.870 468 HG21 THR 66 3HG2 THR 66 0.714 13.839 9.324 469 HG22 THR 66 1HG2 THR 66 1.805 12.490 9.009 470 HG23 THR 66 2HG2 THR 66 0.765 13.102 7.723 471 H ALA 67 H ALA 67 2.132 11.604 6.428 472 HA ALA 67 HA ALA 67 4.265 9.907 6.242 473 HB1 ALA 67 1HB ALA 67 5.174 10.289 8.318 474 HB2 ALA 67 2HB ALA 67 3.603 10.537 9.081 475 HB3 ALA 67 3HB ALA 67 4.129 8.909 8.657 476 H TYR 68 H TYR 68 3.688 7.576 6.831 477 HA TYR 68 HA TYR 68 0.785 7.150 6.842 478 HB2 TYR 68 1HB TYR 68 1.012 5.467 5.048 479 HB3 TYR 68 2HB TYR 68 1.461 7.078 4.502 480 HD1 TYR 68 1HD TYR 68 2.853 3.830 5.633 481 HD2 TYR 68 2HD TYR 68 3.598 7.495 3.605 482 HE1 TYR 68 1HE TYR 68 5.019 2.957 4.863 483 HE2 TYR 68 2HE TYR 68 5.767 6.632 2.829 484 HH TYR 68 HH TYR 68 7.209 3.870 4.110 485 H SER 69 H SER 69 0.339 4.690 7.016 486 HA SER 69 HA SER 69 2.288 3.489 8.871 487 HB2 SER 69 1HB SER 69 -0.648 3.920 9.185 488 HB3 SER 69 2HB SER 69 0.042 2.438 9.844 489 HG SER 69 HG SER 69 0.963 5.063 10.410 490 H ILE 70 H ILE 70 2.806 1.408 8.521 491 HA ILE 70 HA ILE 70 1.488 0.061 6.272 492 HB ILE 70 HB ILE 70 4.166 0.431 6.794 493 HG12 ILE 70 1HG1 ILE 70 2.951 -1.792 5.141 494 HG13 ILE 70 2HG1 ILE 70 3.041 -0.108 4.633 495 HG21 ILE 70 1HG2 ILE 70 3.988 -1.251 8.616 496 HG22 ILE 70 2HG2 ILE 70 3.535 -2.450 7.406 497 HG23 ILE 70 3HG2 ILE 70 5.129 -1.696 7.347 498 HD11 ILE 70 3HD1 ILE 70 5.478 -0.217 4.723 499 HD12 ILE 70 1HD1 ILE 70 5.381 -1.906 5.221 500 HD13 ILE 70 2HD1 ILE 70 4.808 -1.424 3.624 501 H GLN 71 H GLN 71 0.557 -1.922 6.464 502 HA GLN 71 HA GLN 71 0.710 -3.296 9.049 503 HB2 GLN 71 1HB GLN 71 -1.926 -2.935 7.641 504 HB3 GLN 71 2HB GLN 71 -1.633 -3.498 9.281 505 HG2 GLN 71 1HG GLN 71 -0.706 -1.181 9.746 506 HG3 GLN 71 2HG GLN 71 -1.419 -0.708 8.205 507 HE21 GLN 71 1HE2 GLN 71 -2.042 -1.720 11.467 508 HE22 GLN 71 2HE2 GLN 71 -3.720 -1.311 11.492 509 H VAL 72 H VAL 72 0.495 -5.514 8.959 510 HA VAL 72 HA VAL 72 0.163 -6.693 6.279 511 HB VAL 72 HB VAL 72 1.820 -8.474 7.109 512 HG11 VAL 72 1HG1 VAL 72 2.840 -5.700 6.502 513 HG12 VAL 72 2HG1 VAL 72 3.720 -7.212 6.268 514 HG13 VAL 72 3HG1 VAL 72 2.281 -6.871 5.307 515 HG21 VAL 72 3HG2 VAL 72 3.033 -6.324 8.764 516 HG22 VAL 72 1HG2 VAL 72 1.710 -7.260 9.460 517 HG23 VAL 72 2HG2 VAL 72 3.171 -8.077 8.907 518 H SER 73 H SER 73 -0.316 -9.068 6.381 519 HA SER 73 HA SER 73 -2.421 -9.502 8.327 520 HB2 SER 73 1HB SER 73 -3.185 -11.226 6.925 521 HB3 SER 73 2HB SER 73 -2.528 -10.040 5.797 522 HG SER 73 HG SER 73 -1.904 -12.498 5.810 523 H ASN 74 H ASN 74 -2.081 -10.485 10.194 524 HA ASN 74 HA ASN 74 -0.804 -12.946 10.511 525 HB2 ASN 74 1HB ASN 74 1.123 -11.868 12.005 526 HB3 ASN 74 2HB ASN 74 1.348 -12.194 10.289 527 HD21 ASN 74 1HD2 ASN 74 -0.340 -9.622 12.052 528 HD22 ASN 74 2HD2 ASN 74 0.515 -8.317 11.311 529 H ASP 75 H ASP 75 -1.076 -13.777 12.572 530 HA ASP 75 HA ASP 75 -1.748 -12.109 14.806 531 HB2 ASP 75 1HB ASP 75 -3.864 -12.348 13.275 532 HB3 ASP 75 2HB ASP 75 -3.962 -13.956 13.989 533 H SER 76 H SER 76 -1.916 -15.365 13.414 534 HA SER 76 HA SER 76 -1.155 -16.457 16.040 535 HB2 SER 76 1HB SER 76 -2.980 -17.740 15.628 536 HB3 SER 76 2HB SER 76 -2.942 -17.411 13.897 537 HG SER 76 HG SER 76 -2.403 -19.645 14.784 538 H GLY 77 H GLY 77 -0.195 -16.062 12.751 539 HA2 GLY 77 2HA GLY 77 2.302 -16.228 12.521 540 HA3 GLY 77 3HA GLY 77 2.126 -17.829 13.222 541 H SER 78 H SER 78 0.534 -19.274 11.990 542 HA SER 78 HA SER 78 1.355 -19.232 9.201 543 HB2 SER 78 1HB SER 78 1.335 -21.292 10.809 544 HB3 SER 78 2HB SER 78 -0.380 -21.365 10.408 545 HG SER 78 HG SER 78 0.116 -21.749 8.312 546 H THR 79 H THR 79 -1.456 -18.646 11.131 547 HA THR 79 HA THR 79 -3.085 -18.390 8.687 548 HB THR 79 HB THR 79 -4.119 -18.747 11.505 549 HG1 THR 79 1HG THR 79 -3.726 -20.639 9.410 550 HG21 THR 79 3HG2 THR 79 -5.932 -19.582 9.482 551 HG22 THR 79 1HG2 THR 79 -5.358 -17.968 9.065 552 HG23 THR 79 2HG2 THR 79 -6.109 -18.259 10.634 553 HA PRO 80 HA PRO 80 -2.418 -14.095 10.274 554 HB2 PRO 80 1HB PRO 80 -2.123 -12.994 7.810 555 HB3 PRO 80 2HB PRO 80 -0.782 -13.723 8.703 556 HG2 PRO 80 1HG PRO 80 -2.448 -14.886 6.504 557 HG3 PRO 80 2HG PRO 80 -0.693 -14.974 6.744 558 HD2 PRO 80 1HD PRO 80 -2.357 -17.010 7.393 559 HD3 PRO 80 2HD PRO 80 -0.866 -16.673 8.294 560 H THR 81 H THR 81 -4.021 -12.648 10.544 561 HA THR 81 HA THR 81 -6.132 -12.348 8.588 562 HB THR 81 HB THR 81 -7.927 -12.719 10.335 563 HG1 THR 81 1HG THR 81 -6.476 -12.768 12.150 564 HG21 THR 81 3HG2 THR 81 -6.507 -15.303 9.867 565 HG22 THR 81 1HG2 THR 81 -7.065 -14.368 8.480 566 HG23 THR 81 2HG2 THR 81 -8.219 -14.914 9.697 567 H ASN 82 H ASN 82 -4.821 -11.529 11.758 568 HA ASN 82 HA ASN 82 -6.317 -9.107 12.024 569 HB2 ASN 82 1HB ASN 82 -4.032 -10.369 13.495 570 HB3 ASN 82 2HB ASN 82 -4.421 -8.677 13.791 571 HD21 ASN 82 1HD2 ASN 82 -5.077 -9.019 15.886 572 HD22 ASN 82 2HD2 ASN 82 -6.537 -9.849 16.286 573 H TRP 83 H TRP 83 -4.792 -7.078 12.612 574 HA TRP 83 HA TRP 83 -2.700 -6.745 10.612 575 HB2 TRP 83 1HB TRP 83 -5.381 -5.611 10.374 576 HB3 TRP 83 2HB TRP 83 -4.119 -4.383 10.322 577 HD1 TRP 83 HD TRP 83 -1.963 -5.313 8.533 578 HE1 TRP 83 1HE TRP 83 -2.318 -6.073 6.100 579 HE3 TRP 83 3HE TRP 83 -6.940 -6.457 8.758 580 HZ2 TRP 83 2HZ TRP 83 -4.429 -7.031 4.489 581 HZ3 TRP 83 3HZ TRP 83 -8.052 -7.289 6.728 582 HH2 TRP 83 HH TRP 83 -6.820 -7.569 4.637 583 H THR 84 H THR 84 -1.070 -5.550 11.374 584 HA THR 84 HA THR 84 -1.588 -3.728 13.625 585 HB THR 84 HB THR 84 1.052 -4.974 13.729 586 HG1 THR 84 1HG THR 84 0.380 -6.963 13.492 587 HG21 THR 84 3HG2 THR 84 -0.015 -3.549 15.485 588 HG22 THR 84 1HG2 THR 84 0.562 -5.108 16.076 589 HG23 THR 84 2HG2 THR 84 -1.159 -4.859 15.780 590 H THR 85 H THR 85 -0.444 -1.839 13.631 591 HA THR 85 HA THR 85 0.733 -1.020 11.156 592 HB THR 85 HB THR 85 1.313 1.073 12.643 593 HG1 THR 85 1HG THR 85 -0.286 1.172 14.386 594 HG21 THR 85 3HG2 THR 85 -1.606 0.836 12.444 595 HG22 THR 85 1HG2 THR 85 -0.737 0.429 10.965 596 HG23 THR 85 2HG2 THR 85 -0.512 2.009 11.713 597 H VAL 86 H VAL 86 2.841 -0.701 10.638 598 HA VAL 86 HA VAL 86 4.850 -1.371 12.690 599 HB VAL 86 HB VAL 86 5.407 -1.922 9.810 600 HG11 VAL 86 1HG1 VAL 86 7.266 -2.726 10.718 601 HG12 VAL 86 2HG1 VAL 86 6.644 -2.405 12.338 602 HG13 VAL 86 3HG1 VAL 86 6.308 -3.949 11.552 603 HG21 VAL 86 3HG2 VAL 86 3.398 -3.082 9.875 604 HG22 VAL 86 1HG2 VAL 86 4.568 -4.312 10.354 605 HG23 VAL 86 2HG2 VAL 86 3.582 -3.508 11.576 606 H TYR 87 H TYR 87 3.696 0.939 10.572 607 HA TYR 87 HA TYR 87 6.245 2.404 10.695 608 HB2 TYR 87 1HB TYR 87 5.450 1.448 8.371 609 HB3 TYR 87 2HB TYR 87 4.377 2.844 8.400 610 HD1 TYR 87 1HD TYR 87 7.956 2.285 9.343 611 HD2 TYR 87 2HD TYR 87 5.163 4.543 7.062 612 HE1 TYR 87 1HE TYR 87 9.788 3.703 8.514 613 HE2 TYR 87 2HE TYR 87 6.987 5.966 6.227 614 HH TYR 87 HH TYR 87 10.360 5.374 7.171 615 H SER 88 H SER 88 6.121 4.579 11.135 616 HA SER 88 HA SER 88 4.015 6.304 10.955 617 HB2 SER 88 1HB SER 88 3.252 6.234 13.454 618 HB3 SER 88 2HB SER 88 2.538 5.107 12.302 619 HG SER 88 HG SER 88 3.388 4.271 14.413 620 H THR 89 H THR 89 4.741 8.284 11.438 621 HA THR 89 HA THR 89 6.573 8.744 13.623 622 HB THR 89 HB THR 89 7.946 10.019 11.563 623 HG1 THR 89 1HG THR 89 7.638 8.821 9.854 624 HG21 THR 89 3HG2 THR 89 8.700 8.749 13.691 625 HG22 THR 89 1HG2 THR 89 9.771 8.766 12.290 626 HG23 THR 89 2HG2 THR 89 8.784 7.344 12.628 627 H THR 90 H THR 90 5.029 10.041 10.713 628 HA THR 90 HA THR 90 3.881 11.976 10.348 629 HB THR 90 HB THR 90 4.086 12.897 13.169 630 HG1 THR 90 1HG THR 90 2.617 10.596 12.346 631 HG21 THR 90 3HG2 THR 90 1.670 13.341 12.777 632 HG22 THR 90 1HG2 THR 90 1.856 12.701 11.145 633 HG23 THR 90 2HG2 THR 90 2.728 14.157 11.626 634 H THR 91 H THR 91 6.463 12.085 9.695 635 HA THR 91 HA THR 91 7.170 14.850 10.333 636 HB THR 91 HB THR 91 9.472 14.376 10.776 637 HG1 THR 91 1HG THR 91 8.769 11.749 9.988 638 HG21 THR 91 3HG2 THR 91 7.619 13.906 12.569 639 HG22 THR 91 1HG2 THR 91 9.298 13.479 12.896 640 HG23 THR 91 2HG2 THR 91 8.153 12.235 12.391 641 H GLY 92 H GLY 92 7.662 11.995 8.317 642 HA2 GLY 92 2HA GLY 92 9.300 12.916 6.335 643 HA3 GLY 92 3HA GLY 92 7.945 11.838 6.036 644 H ASP 93 H ASP 93 8.861 13.717 4.170 645 HA ASP 93 HA ASP 93 6.802 15.813 4.228 646 HB2 ASP 93 1HB ASP 93 9.413 15.550 2.751 647 HB3 ASP 93 2HB ASP 93 8.190 16.716 2.254 648 H GLY 94 H GLY 94 8.416 14.162 1.523 649 HA2 GLY 94 2HA GLY 94 5.982 12.886 0.661 650 HA3 GLY 94 3HA GLY 94 6.413 14.280 -0.317 651 H ALA 95 H ALA 95 8.962 12.439 1.103 652 HA ALA 95 HA ALA 95 9.773 11.555 -1.562 653 HB1 ALA 95 1HB ALA 95 11.570 12.606 -0.570 654 HB2 ALA 95 2HB ALA 95 11.205 11.955 1.028 655 HB3 ALA 95 3HB ALA 95 11.900 10.911 -0.212 656 H ILE 96 H ILE 96 10.754 9.377 -1.769 657 HA ILE 96 HA ILE 96 8.955 7.362 -1.096 658 HB ILE 96 HB ILE 96 11.876 6.907 -1.688 659 HG12 ILE 96 1HG1 ILE 96 10.390 6.628 -4.049 660 HG13 ILE 96 2HG1 ILE 96 9.822 8.128 -3.323 661 HG21 ILE 96 1HG2 ILE 96 9.425 5.237 -1.689 662 HG22 ILE 96 2HG2 ILE 96 10.630 4.928 -2.938 663 HG23 ILE 96 3HG2 ILE 96 11.078 4.823 -1.235 664 HD11 ILE 96 3HD1 ILE 96 12.476 7.439 -4.436 665 HD12 ILE 96 1HD1 ILE 96 11.549 8.936 -4.545 666 HD13 ILE 96 2HD1 ILE 96 12.422 8.544 -3.063 667 H ASP 97 H ASP 97 8.647 6.141 0.652 668 HA ASP 97 HA ASP 97 10.697 6.213 2.770 669 HB2 ASP 97 1HB ASP 97 7.753 6.535 2.853 670 HB3 ASP 97 2HB ASP 97 8.464 5.563 4.140 671 H ASP 98 H ASP 98 11.587 4.332 3.285 672 HA ASP 98 HA ASP 98 10.157 1.860 2.554 673 HB2 ASP 98 1HB ASP 98 12.023 1.894 1.139 674 HB3 ASP 98 2HB ASP 98 13.069 2.580 2.381 675 H ILE 99 H ILE 99 9.579 0.629 4.208 676 HA ILE 99 HA ILE 99 10.879 1.050 6.806 677 HB ILE 99 HB ILE 99 8.485 1.357 6.864 678 HG12 ILE 99 1HG1 ILE 99 9.330 -1.260 8.125 679 HG13 ILE 99 2HG1 ILE 99 9.494 0.342 8.835 680 HG21 ILE 99 1HG2 ILE 99 6.928 -0.436 6.295 681 HG22 ILE 99 2HG2 ILE 99 7.904 0.028 4.902 682 HG23 ILE 99 3HG2 ILE 99 8.278 -1.452 5.786 683 HD11 ILE 99 3HD1 ILE 99 6.888 -1.010 8.174 684 HD12 ILE 99 1HD1 ILE 99 7.617 -0.908 9.776 685 HD13 ILE 99 2HD1 ILE 99 7.085 0.559 8.954 686 H THR 100 H THR 100 12.080 -0.484 7.733 687 HA THR 100 HA THR 100 12.052 -3.178 6.532 688 HB THR 100 HB THR 100 14.405 -3.402 6.980 689 HG1 THR 100 1HG THR 100 15.529 -1.957 8.162 690 HG21 THR 100 3HG2 THR 100 14.846 -0.824 5.855 691 HG22 THR 100 1HG2 THR 100 13.330 -1.455 5.214 692 HG23 THR 100 2HG2 THR 100 14.817 -2.387 5.041 693 H PHE 101 H PHE 101 11.738 -4.863 7.857 694 HA PHE 101 HA PHE 101 12.127 -4.517 10.738 695 HB2 PHE 101 1HB PHE 101 9.853 -5.982 10.770 696 HB3 PHE 101 2HB PHE 101 9.884 -4.230 10.928 697 HD1 PHE 101 1HD PHE 101 9.289 -7.020 8.605 698 HD2 PHE 101 2HD PHE 101 9.004 -2.821 9.234 699 HE1 PHE 101 1HE PHE 101 7.868 -6.820 6.606 700 HE2 PHE 101 2HE PHE 101 7.582 -2.614 7.236 701 HZ PHE 101 HZ PHE 101 7.012 -4.616 5.920 702 H ALA 102 H ALA 102 11.491 -6.807 11.787 703 HA ALA 102 HA ALA 102 13.454 -8.615 10.882 704 HB1 ALA 102 1HB ALA 102 11.232 -8.830 12.887 705 HB2 ALA 102 2HB ALA 102 12.283 -10.198 12.519 706 HB3 ALA 102 3HB ALA 102 12.969 -8.709 13.166 707 H ALA 103 H ALA 103 13.142 -10.821 10.158 708 HA ALA 103 HA ALA 103 11.503 -11.016 7.891 709 HB1 ALA 103 1HB ALA 103 12.549 -13.421 9.341 710 HB2 ALA 103 2HB ALA 103 12.357 -13.166 7.607 711 HB3 ALA 103 3HB ALA 103 13.633 -12.324 8.486 712 H THR 104 H THR 104 9.354 -11.060 7.916 713 HA THR 104 HA THR 104 8.016 -12.963 9.706 714 HB THR 104 HB THR 104 6.149 -11.268 9.979 715 HG1 THR 104 1HG THR 104 6.431 -9.526 8.808 716 HG21 THR 104 3HG2 THR 104 8.490 -10.043 11.290 717 HG22 THR 104 1HG2 THR 104 8.299 -11.778 11.536 718 HG23 THR 104 2HG2 THR 104 7.000 -10.674 11.989 719 H ASN 105 H ASN 105 6.191 -13.933 8.872 720 HA ASN 105 HA ASN 105 5.907 -13.783 5.996 721 HB2 ASN 105 1HB ASN 105 4.187 -15.640 6.451 722 HB3 ASN 105 2HB ASN 105 5.876 -15.993 6.804 723 HD21 ASN 105 1HD2 ASN 105 2.949 -14.729 8.346 724 HD22 ASN 105 2HD2 ASN 105 3.225 -15.478 9.878 725 H ALA 106 H ALA 106 4.099 -13.143 4.871 726 HA ALA 106 HA ALA 106 1.715 -12.283 6.264 727 HB1 ALA 106 1HB ALA 106 3.677 -10.349 5.128 728 HB2 ALA 106 2HB ALA 106 1.954 -9.985 5.029 729 HB3 ALA 106 3HB ALA 106 2.713 -10.243 6.601 730 H LYS 107 H LYS 107 -0.064 -11.960 4.890 731 HA LYS 107 HA LYS 107 0.312 -13.076 2.201 732 HB2 LYS 107 1HB LYS 107 -2.207 -12.795 3.851 733 HB3 LYS 107 2HB LYS 107 -2.104 -13.551 2.266 734 HG2 LYS 107 1HG LYS 107 -0.531 -15.216 3.232 735 HG3 LYS 107 2HG LYS 107 -0.829 -14.504 4.819 736 HD2 LYS 107 1HD LYS 107 -2.282 -16.353 4.680 737 HD3 LYS 107 2HD LYS 107 -3.296 -14.939 4.381 738 HE2 LYS 107 1HE LYS 107 -2.463 -15.579 1.863 739 HE3 LYS 107 2HE LYS 107 -2.590 -17.169 2.614 740 HZ1 LYS 107 3HZ LYS 107 -4.804 -17.052 2.639 741 HZ2 LYS 107 1HZ LYS 107 -4.642 -15.788 1.527 742 HZ3 LYS 107 2HZ LYS 107 -4.825 -15.448 3.173 743 H PHE 108 H PHE 108 -1.621 -10.572 3.850 744 HA PHE 108 HA PHE 108 -1.546 -9.017 1.348 745 HB2 PHE 108 1HB PHE 108 -3.704 -8.469 3.307 746 HB3 PHE 108 2HB PHE 108 -3.749 -8.452 1.547 747 HD1 PHE 108 2HD PHE 108 -3.102 -11.017 0.644 748 HD2 PHE 108 1HD PHE 108 -5.194 -9.956 4.195 749 HE1 PHE 108 2HE PHE 108 -4.201 -13.218 0.650 750 HE2 PHE 108 1HE PHE 108 -6.295 -12.156 4.208 751 HZ PHE 108 HZ PHE 108 -5.800 -13.790 2.433 752 H VAL 109 H VAL 109 -1.599 -6.677 1.612 753 HA VAL 109 HA VAL 109 -0.499 -5.775 4.192 754 HB VAL 109 HB VAL 109 1.311 -5.964 2.524 755 HG11 VAL 109 1HG1 VAL 109 0.781 -3.737 0.874 756 HG12 VAL 109 2HG1 VAL 109 0.938 -5.430 0.402 757 HG13 VAL 109 3HG1 VAL 109 -0.645 -4.774 0.819 758 HG21 VAL 109 3HG2 VAL 109 0.604 -3.125 3.261 759 HG22 VAL 109 1HG2 VAL 109 1.449 -4.284 4.286 760 HG23 VAL 109 2HG2 VAL 109 2.206 -3.703 2.803 761 H ARG 110 H ARG 110 -1.027 -3.684 4.839 762 HA ARG 110 HA ARG 110 -2.912 -2.197 3.155 763 HB2 ARG 110 1HB ARG 110 -4.044 -3.691 4.933 764 HB3 ARG 110 2HB ARG 110 -3.421 -2.531 6.098 765 HG2 ARG 110 1HG ARG 110 -4.681 -0.757 5.102 766 HG3 ARG 110 2HG ARG 110 -5.178 -1.800 3.768 767 HD2 ARG 110 1HD ARG 110 -6.731 -2.892 5.019 768 HD3 ARG 110 2HD ARG 110 -5.803 -2.727 6.510 769 HE ARG 110 HE ARG 110 -6.740 -0.200 5.686 770 HH11 ARG 110 1HH1 ARG 110 -7.871 -3.205 7.032 771 HH12 ARG 110 2HH1 ARG 110 -9.210 -2.480 7.858 772 HH21 ARG 110 1HH2 ARG 110 -8.500 0.765 6.769 773 HH22 ARG 110 2HH2 ARG 110 -9.568 -0.223 7.706 774 H VAL 111 H VAL 111 -2.386 -0.119 3.022 775 HA VAL 111 HA VAL 111 -0.746 1.054 5.175 776 HB VAL 111 HB VAL 111 0.705 0.828 3.307 777 HG11 VAL 111 1HG1 VAL 111 -0.258 2.241 1.176 778 HG12 VAL 111 2HG1 VAL 111 -0.303 0.484 1.335 779 HG13 VAL 111 3HG1 VAL 111 -1.712 1.448 1.780 780 HG21 VAL 111 3HG2 VAL 111 -0.323 3.661 3.223 781 HG22 VAL 111 1HG2 VAL 111 0.718 3.015 4.492 782 HG23 VAL 111 2HG2 VAL 111 1.304 3.104 2.831 783 H TYR 112 H TYR 112 -1.562 2.811 6.110 784 HA TYR 112 HA TYR 112 -3.545 4.409 4.641 785 HB2 TYR 112 1HB TYR 112 -4.963 4.565 6.565 786 HB3 TYR 112 2HB TYR 112 -4.629 2.857 6.298 787 HD1 TYR 112 1HD TYR 112 -3.907 5.758 8.448 788 HD2 TYR 112 2HD TYR 112 -3.403 1.569 7.905 789 HE1 TYR 112 1HE TYR 112 -3.116 5.559 10.769 790 HE2 TYR 112 2HE TYR 112 -2.613 1.357 10.224 791 HH TYR 112 HH TYR 112 -2.958 2.744 12.421 792 H ALA 113 H ALA 113 -3.602 6.611 5.132 793 HA ALA 113 HA ALA 113 -1.322 7.585 6.728 794 HB1 ALA 113 1HB ALA 113 -1.704 9.655 5.110 795 HB2 ALA 113 2HB ALA 113 -0.677 8.292 4.665 796 HB3 ALA 113 3HB ALA 113 -2.330 8.387 4.057 797 H THR 114 H THR 114 -4.701 7.949 5.926 798 HA THR 114 HA THR 114 -6.342 9.342 6.731 799 HB THR 114 HB THR 114 -6.102 7.670 8.527 800 HG1 THR 114 1HG THR 114 -7.010 9.074 10.204 801 HG21 THR 114 3HG2 THR 114 -4.904 8.460 10.626 802 HG22 THR 114 1HG2 THR 114 -4.126 9.669 9.607 803 HG23 THR 114 2HG2 THR 114 -3.877 7.954 9.284 804 H THR 115 H THR 115 -4.080 10.798 5.794 805 HA THR 115 HA THR 115 -4.399 13.218 7.413 806 HB THR 115 HB THR 115 -1.736 12.074 6.560 807 HG1 THR 115 1HG THR 115 -2.618 12.941 9.124 808 HG21 THR 115 3HG2 THR 115 -2.543 14.854 7.270 809 HG22 THR 115 1HG2 THR 115 -1.349 14.292 6.102 810 HG23 THR 115 2HG2 THR 115 -0.979 14.261 7.826 811 H ARG 116 H ARG 116 -4.306 15.133 6.261 812 HA ARG 116 HA ARG 116 -5.219 15.248 3.703 813 HB2 ARG 116 1HB ARG 116 -3.281 17.280 4.808 814 HB3 ARG 116 2HB ARG 116 -4.566 17.548 3.639 815 HG2 ARG 116 1HG ARG 116 -5.821 18.210 5.344 816 HG3 ARG 116 2HG ARG 116 -5.879 16.519 5.845 817 HD2 ARG 116 1HD ARG 116 -3.687 16.987 7.065 818 HD3 ARG 116 2HD ARG 116 -4.041 18.695 6.802 819 HE ARG 116 HE ARG 116 -6.271 17.419 7.967 820 HH11 ARG 116 1HH1 ARG 116 -3.055 18.507 8.733 821 HH12 ARG 116 2HH1 ARG 116 -3.400 18.764 10.411 822 HH21 ARG 116 1HH2 ARG 116 -6.739 17.754 10.174 823 HH22 ARG 116 2HH2 ARG 116 -5.497 18.334 11.230 824 H ALA 117 H ALA 117 -4.445 14.865 1.730 825 HA ALA 117 HA ALA 117 -1.567 14.352 1.447 826 HB1 ALA 117 1HB ALA 117 -2.637 12.435 0.746 827 HB2 ALA 117 2HB ALA 117 -3.985 13.320 0.030 828 HB3 ALA 117 3HB ALA 117 -2.417 13.298 -0.776 829 H THR 118 H THR 118 -3.846 15.119 -1.124 830 HA THR 118 HA THR 118 -3.011 17.812 -1.488 831 HB THR 118 HB THR 118 -2.097 16.382 -3.868 832 HG1 THR 118 1HG THR 118 -1.318 14.921 -2.284 833 HG21 THR 118 3HG2 THR 118 -0.211 18.089 -2.440 834 HG22 THR 118 1HG2 THR 118 -1.767 18.867 -2.726 835 HG23 THR 118 2HG2 THR 118 -0.839 18.226 -4.082 836 H ALA 119 H ALA 119 -3.368 18.094 -4.216 837 HA ALA 119 HA ALA 119 -6.225 17.572 -4.431 838 HB1 ALA 119 1HB ALA 119 -6.268 19.217 -6.140 839 HB2 ALA 119 2HB ALA 119 -5.221 19.837 -4.863 840 HB3 ALA 119 3HB ALA 119 -4.517 19.161 -6.332 841 H TYR 120 H TYR 120 -3.979 15.546 -4.883 842 HA TYR 120 HA TYR 120 -4.719 14.748 -7.620 843 HB2 TYR 120 1HB TYR 120 -2.238 15.160 -6.896 844 HB3 TYR 120 2HB TYR 120 -2.384 13.574 -6.148 845 HD1 TYR 120 2HD TYR 120 -3.816 11.938 -7.955 846 HD2 TYR 120 1HD TYR 120 -1.055 15.044 -8.867 847 HE1 TYR 120 2HE TYR 120 -3.338 10.869 -10.118 848 HE2 TYR 120 1HE TYR 120 -0.571 13.985 -11.033 849 HH TYR 120 HH TYR 120 -2.232 12.140 -12.591 850 H GLY 121 H GLY 121 -3.984 13.397 -4.404 851 HA2 GLY 121 2HA GLY 121 -5.816 11.947 -3.500 852 HA3 GLY 121 3HA GLY 121 -5.783 11.147 -5.065 853 H TYR 122 H TYR 122 -5.191 9.126 -4.446 854 HA TYR 122 HA TYR 122 -2.739 8.842 -2.855 855 HB2 TYR 122 1HB TYR 122 -4.362 6.453 -3.522 856 HB3 TYR 122 2HB TYR 122 -3.560 6.886 -2.017 857 HD1 TYR 122 1HD TYR 122 -4.737 9.484 -1.382 858 HD2 TYR 122 2HD TYR 122 -6.569 5.986 -2.969 859 HE1 TYR 122 1HE TYR 122 -6.894 10.190 -0.433 860 HE2 TYR 122 2HE TYR 122 -8.730 6.684 -2.024 861 HH TYR 122 HH TYR 122 -9.032 9.684 -0.144 862 H SER 123 H SER 123 -1.155 9.108 -4.391 863 HA SER 123 HA SER 123 -1.221 7.368 -6.750 864 HB2 SER 123 1HB SER 123 0.976 8.852 -7.168 865 HB3 SER 123 2HB SER 123 -0.640 9.412 -7.600 866 HG SER 123 HG SER 123 0.518 9.925 -5.070 867 H LEU 124 H LEU 124 -0.067 5.562 -6.802 868 HA LEU 124 HA LEU 124 2.344 5.359 -5.136 869 HB2 LEU 124 1HB LEU 124 1.660 2.930 -4.762 870 HB3 LEU 124 2HB LEU 124 0.827 4.172 -3.831 871 HG LEU 124 HG LEU 124 -0.771 3.830 -6.069 872 HD11 LEU 124 1HD1 LEU 124 -0.076 1.853 -6.918 873 HD12 LEU 124 2HD1 LEU 124 -1.096 1.212 -5.630 874 HD13 LEU 124 3HD1 LEU 124 0.649 1.327 -5.398 875 HD21 LEU 124 3HD2 LEU 124 -2.385 3.141 -4.537 876 HD22 LEU 124 1HD2 LEU 124 -1.274 4.105 -3.564 877 HD23 LEU 124 2HD2 LEU 124 -1.200 2.344 -3.500 878 H TRP 125 H TRP 125 3.526 5.719 -7.069 879 HA TRP 125 HA TRP 125 3.305 3.682 -9.154 880 HB2 TRP 125 1HB TRP 125 5.007 6.182 -9.058 881 HB3 TRP 125 2HB TRP 125 4.819 5.114 -10.446 882 HD1 TRP 125 HD TRP 125 1.482 5.040 -9.469 883 HE1 TRP 125 1HE TRP 125 0.054 6.929 -10.476 884 HE3 TRP 125 3HE TRP 125 5.226 8.224 -10.874 885 HZ2 TRP 125 2HZ TRP 125 0.461 9.438 -11.704 886 HZ3 TRP 125 3HZ TRP 125 4.622 10.348 -11.960 887 HH2 TRP 125 HH TRP 125 2.288 10.941 -12.365 888 H GLU 126 H GLU 126 5.032 4.252 -6.337 889 HA GLU 126 HA GLU 126 7.105 2.342 -7.176 890 HB2 GLU 126 1HB GLU 126 7.547 5.024 -6.477 891 HB3 GLU 126 2HB GLU 126 8.040 4.089 -5.073 892 HG2 GLU 126 1HG GLU 126 9.970 3.706 -6.075 893 HG3 GLU 126 2HG GLU 126 9.108 2.744 -7.276 894 H PHE 127 H PHE 127 4.699 1.647 -5.944 895 HA PHE 127 HA PHE 127 5.431 1.127 -3.150 896 HB2 PHE 127 1HB PHE 127 3.236 2.144 -3.476 897 HB3 PHE 127 2HB PHE 127 2.775 0.843 -4.568 898 HD1 PHE 127 1HD PHE 127 2.555 -1.484 -3.660 899 HD2 PHE 127 2HD PHE 127 2.992 1.928 -1.154 900 HE1 PHE 127 1HE PHE 127 1.684 -2.776 -1.755 901 HE2 PHE 127 2HE PHE 127 2.122 0.642 0.754 902 HZ PHE 127 HZ PHE 127 1.468 -1.714 0.456 903 H GLU 128 H GLU 128 6.594 -0.683 -2.966 904 HA GLU 128 HA GLU 128 5.568 -3.108 -4.279 905 HB2 GLU 128 1HB GLU 128 8.406 -2.132 -4.077 906 HB3 GLU 128 2HB GLU 128 8.042 -3.837 -4.298 907 HG2 GLU 128 1HG GLU 128 7.224 -3.532 -6.423 908 HG3 GLU 128 2HG GLU 128 6.835 -1.835 -6.144 909 H VAL 129 H VAL 129 4.994 -4.603 -2.859 910 HA VAL 129 HA VAL 129 6.568 -4.992 -0.432 911 HB VAL 129 HB VAL 129 4.844 -3.466 0.318 912 HG11 VAL 129 1HG1 VAL 129 3.263 -4.170 -1.582 913 HG12 VAL 129 2HG1 VAL 129 2.726 -5.436 -0.474 914 HG13 VAL 129 3HG1 VAL 129 2.554 -3.738 -0.026 915 HG21 VAL 129 3HG2 VAL 129 5.521 -5.674 1.585 916 HG22 VAL 129 1HG2 VAL 129 4.248 -4.622 2.204 917 HG23 VAL 129 2HG2 VAL 129 3.828 -6.084 1.311 918 H TYR 130 H TYR 130 7.110 -7.065 -0.519 919 HA TYR 130 HA TYR 130 5.294 -9.168 -0.347 920 HB2 TYR 130 1HB TYR 130 5.714 -10.220 -2.617 921 HB3 TYR 130 2HB TYR 130 4.639 -8.826 -2.606 922 HD1 TYR 130 2HD TYR 130 8.256 -9.646 -3.064 923 HD2 TYR 130 1HD TYR 130 4.983 -7.162 -4.172 924 HE1 TYR 130 2HE TYR 130 9.666 -8.553 -4.758 925 HE2 TYR 130 1HE TYR 130 6.384 -6.063 -5.870 926 HH TYR 130 HH TYR 130 8.336 -6.208 -7.021 927 H GLY 131 H GLY 131 6.342 -11.304 -0.469 928 HA2 GLY 131 2HA GLY 131 9.140 -11.069 0.353 929 HA3 GLY 131 3HA GLY 131 8.091 -12.452 0.627
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