NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
584895 | 2mwm | 25342 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H GLY 1 -11.633 -24.686 -0.887 2 HA2 GLY 1 1HA GLY 1 -9.915 -23.228 0.066 3 HA3 GLY 1 2HA GLY 1 -9.459 -24.930 0.226 4 H MET 2 H MET 2 -9.310 -22.407 -2.381 5 HA MET 2 HA MET 2 -6.487 -22.172 -2.258 6 HB3 MET 2 2HB MET 2 -7.733 -23.400 -4.771 7 HG3 MET 2 2HG MET 2 -4.986 -22.179 -4.282 8 HE1 MET 2 3HE MET 2 -3.480 -25.320 -5.958 9 HE2 MET 2 1HE MET 2 -3.315 -24.088 -4.688 10 HE3 MET 2 2HE MET 2 -4.654 -25.255 -4.629 11 H ALA 3 H ALA 3 -7.127 -20.061 -1.728 12 HA ALA 3 HA ALA 3 -7.890 -18.327 -3.900 13 HB1 ALA 3 1HB ALA 3 -9.801 -17.306 -2.688 14 HB2 ALA 3 2HB ALA 3 -10.162 -18.949 -3.225 15 HB3 ALA 3 3HB ALA 3 -9.775 -18.633 -1.514 16 H LYS 4 H LYS 4 -5.666 -17.722 -3.337 17 HA LYS 4 HA LYS 4 -5.607 -15.710 -1.315 18 HB3 LYS 4 2HB LYS 4 -5.089 -17.741 0.076 19 HG3 LYS 4 2HG LYS 4 -2.814 -18.539 0.170 20 HD3 LYS 4 2HD LYS 4 -4.555 -19.817 -1.367 21 HE3 LYS 4 2HE LYS 4 -4.003 -19.000 -3.600 22 HZ1 LYS 4 3HZ LYS 4 -1.942 -18.088 -3.552 23 HZ2 LYS 4 1HZ LYS 4 -1.622 -19.462 -4.367 24 HZ3 LYS 4 2HZ LYS 4 -1.215 -19.342 -2.760 25 H LYS 5 H LYS 5 -4.085 -14.099 -1.941 26 HA LYS 5 HA LYS 5 -1.902 -14.809 -3.701 27 HB3 LYS 5 2HB LYS 5 -2.332 -13.162 -5.451 28 HG3 LYS 5 2HG LYS 5 -4.812 -14.847 -5.160 29 HD3 LYS 5 2HD LYS 5 -3.380 -13.597 -7.533 30 HE3 LYS 5 2HE LYS 5 -5.417 -15.859 -7.546 31 HZ1 LYS 5 3HZ LYS 5 -5.349 -14.461 -9.555 32 HZ2 LYS 5 1HZ LYS 5 -4.890 -16.009 -9.818 33 HZ3 LYS 5 2HZ LYS 5 -3.751 -14.836 -9.766 34 H THR 6 H THR 6 -0.607 -12.852 -4.146 35 HA THR 6 HA THR 6 -0.778 -10.833 -1.963 36 HB THR 6 HB THR 6 1.669 -12.491 -2.645 37 HG1 THR 6 1HG THR 6 -0.028 -12.462 -0.362 38 HG21 THR 6 3HG2 THR 6 1.231 -10.371 -0.494 39 HG22 THR 6 1HG2 THR 6 2.215 -10.155 -1.939 40 HG23 THR 6 2HG2 THR 6 2.679 -11.358 -0.721 41 H LEU 7 H LEU 7 -0.859 -8.925 -2.901 42 HA LEU 7 HA LEU 7 0.779 -8.369 -5.350 43 HB3 LEU 7 2HB LEU 7 -1.670 -6.977 -4.195 44 HG LEU 7 HG LEU 7 -0.636 -5.456 -5.756 45 HD11 LEU 7 1HD1 LEU 7 0.817 -6.941 -7.091 46 HD12 LEU 7 2HD1 LEU 7 -0.293 -6.097 -8.164 47 HD13 LEU 7 3HD1 LEU 7 -0.612 -7.790 -7.735 48 HD21 LEU 7 3HD2 LEU 7 -3.056 -5.605 -5.822 49 HD22 LEU 7 1HD2 LEU 7 -3.001 -7.027 -6.881 50 HD23 LEU 7 2HD2 LEU 7 -2.503 -5.462 -7.507 51 H ILE 8 H ILE 8 1.929 -6.296 -5.448 52 HA ILE 8 HA ILE 8 2.128 -4.735 -2.927 53 HB ILE 8 HB ILE 8 4.305 -5.290 -4.978 54 HG13 ILE 8 2HG1 ILE 8 3.850 -7.091 -3.162 55 HG21 ILE 8 1HG2 ILE 8 5.762 -3.868 -3.547 56 HG22 ILE 8 2HG2 ILE 8 4.412 -2.947 -4.183 57 HG23 ILE 8 3HG2 ILE 8 4.377 -3.515 -2.493 58 HD11 ILE 8 3HD1 ILE 8 6.624 -5.867 -3.488 59 HD12 ILE 8 1HD1 ILE 8 6.295 -7.409 -2.709 60 HD13 ILE 8 2HD1 ILE 8 5.883 -7.191 -4.421 61 H LEU 9 H LEU 9 1.476 -2.636 -3.290 62 HA LEU 9 HA LEU 9 1.410 -1.537 -6.072 63 HB3 LEU 9 2HB LEU 9 -0.645 -0.367 -5.433 64 HG LEU 9 HG LEU 9 -1.034 -3.274 -4.581 65 HD11 LEU 9 1HD1 LEU 9 -2.819 -1.758 -3.853 66 HD12 LEU 9 2HD1 LEU 9 -3.393 -2.870 -5.094 67 HD13 LEU 9 3HD1 LEU 9 -3.038 -1.174 -5.510 68 HD21 LEU 9 3HD2 LEU 9 -2.015 -3.411 -6.977 69 HD22 LEU 9 1HD2 LEU 9 -0.262 -3.455 -6.792 70 HD23 LEU 9 2HD2 LEU 9 -1.055 -1.979 -7.319 71 H TYR 10 H TYR 10 3.267 -0.106 -5.921 72 HA TYR 10 HA TYR 10 3.294 1.604 -3.452 73 HB3 TYR 10 2HB TYR 10 5.047 -0.278 -3.598 74 HD1 TYR 10 1HD TYR 10 5.174 0.725 -6.736 75 HD2 TYR 10 2HD TYR 10 7.793 0.741 -3.295 76 HE1 TYR 10 1HE TYR 10 7.091 1.118 -8.232 77 HE2 TYR 10 2HE TYR 10 9.705 1.139 -4.832 78 HH TYR 10 HH TYR 10 9.414 1.370 -8.363 79 H TYR 11 H TYR 11 4.576 3.626 -3.581 80 HA TYR 11 HA TYR 11 4.467 4.806 -6.293 81 HB3 TYR 11 2HB TYR 11 3.862 6.220 -3.701 82 HD1 TYR 11 1HD TYR 11 4.114 6.520 -7.480 83 HD2 TYR 11 2HD TYR 11 3.932 8.621 -3.706 84 HE1 TYR 11 1HE TYR 11 4.677 8.608 -8.629 85 HE2 TYR 11 2HE TYR 11 4.457 10.742 -4.890 86 HH TYR 11 HH TYR 11 4.751 10.917 -8.453 87 H SER 12 H SER 12 6.571 4.946 -7.019 88 HA SER 12 HA SER 12 8.762 5.405 -5.163 89 HB3 SER 12 2HB SER 12 9.422 3.912 -6.714 90 HG SER 12 HG SER 12 9.065 4.314 -9.001 91 H TRP 13 H TRP 13 9.025 7.399 -4.416 92 HA TRP 13 HA TRP 13 8.203 9.880 -5.450 93 HB3 TRP 13 2HB TRP 13 10.475 9.282 -3.509 94 HD1 TRP 13 HD TRP 13 7.485 11.592 -3.104 95 HE1 TRP 13 1HE TRP 13 8.225 13.964 -2.632 96 HE3 TRP 13 3HE TRP 13 12.555 11.016 -3.756 97 HZ2 TRP 13 2HZ TRP 13 10.638 15.548 -3.006 98 HZ3 TRP 13 3HZ TRP 13 14.016 13.004 -3.800 99 HH2 TRP 13 HH TRP 13 13.069 15.281 -3.512 100 H SER 14 H SER 14 11.635 9.165 -4.930 101 HA SER 14 HA SER 14 12.462 9.312 -7.663 102 HB3 SER 14 2HB SER 14 13.281 11.744 -6.038 103 HG SER 14 HG SER 14 13.486 12.438 -8.332 104 H GLY 15 H GLY 15 12.945 7.303 -6.354 105 HA2 GLY 15 1HA GLY 15 14.869 6.035 -6.444 106 HA3 GLY 15 2HA GLY 15 15.855 7.413 -6.017 107 H GLU 16 H GLU 16 13.130 6.694 -3.917 108 HA GLU 16 HA GLU 16 14.963 5.482 -1.879 109 HB3 GLU 16 2HB GLU 16 13.337 6.401 -0.269 110 HG3 GLU 16 2HG GLU 16 14.016 8.715 -2.119 111 H THR 17 H THR 17 11.444 5.568 -2.624 112 HA THR 17 HA THR 17 10.767 3.266 -1.293 113 HB THR 17 HB THR 17 9.319 3.843 -3.815 114 HG1 THR 17 1HG THR 17 8.451 5.765 -2.545 115 HG21 THR 17 3HG2 THR 17 7.349 3.910 -2.322 116 HG22 THR 17 1HG2 THR 17 8.418 3.906 -0.904 117 HG23 THR 17 2HG2 THR 17 8.328 2.504 -1.980 118 H LYS 18 H LYS 18 12.222 3.645 -4.460 119 HA LYS 18 HA LYS 18 11.682 1.192 -5.688 120 HB3 LYS 18 2HB LYS 18 13.950 3.157 -6.010 121 HG3 LYS 18 2HG LYS 18 13.511 0.440 -7.335 122 HD3 LYS 18 2HD LYS 18 13.457 2.159 -9.101 123 HE3 LYS 18 2HE LYS 18 16.339 2.728 -8.292 124 HZ1 LYS 18 3HZ LYS 18 14.598 4.054 -10.297 125 HZ2 LYS 18 1HZ LYS 18 15.713 2.944 -10.686 126 HZ3 LYS 18 2HZ LYS 18 16.194 4.353 -10.021 127 H LYS 19 H LYS 19 14.764 1.850 -3.737 128 HA LYS 19 HA LYS 19 15.663 -0.836 -4.046 129 HB3 LYS 19 2HB LYS 19 16.785 -0.395 -1.722 130 HG3 LYS 19 2HG LYS 19 17.382 1.363 -4.138 131 HD3 LYS 19 2HD LYS 19 19.758 1.069 -3.152 132 HE3 LYS 19 2HE LYS 19 18.166 3.226 -3.196 133 HZ1 LYS 19 3HZ LYS 19 17.440 2.860 -0.835 134 HZ2 LYS 19 1HZ LYS 19 18.187 4.270 -1.077 135 HZ3 LYS 19 2HZ LYS 19 19.018 3.052 -0.369 136 H MET 20 H MET 20 13.471 0.570 -1.653 137 HA MET 20 HA MET 20 13.223 -1.668 -0.001 138 HB3 MET 20 2HB MET 20 11.021 0.360 -0.545 139 HG3 MET 20 2HG MET 20 10.560 -1.274 1.149 140 HE1 MET 20 3HE MET 20 13.123 1.182 2.762 141 HE2 MET 20 1HE MET 20 14.401 0.121 3.391 142 HE3 MET 20 2HE MET 20 14.227 0.355 1.634 143 H ALA 21 H ALA 21 11.717 -1.127 -3.172 144 HA ALA 21 HA ALA 21 9.361 -2.764 -2.679 145 HB1 ALA 21 1HB ALA 21 10.522 -1.274 -5.031 146 HB2 ALA 21 2HB ALA 21 9.432 -2.632 -5.336 147 HB3 ALA 21 3HB ALA 21 8.877 -1.303 -4.327 148 H GLU 22 H GLU 22 12.350 -2.888 -4.618 149 HA GLU 22 HA GLU 22 11.860 -5.507 -5.516 150 HB3 GLU 22 2HB GLU 22 13.158 -4.539 -7.084 151 HG3 GLU 22 2HG GLU 22 14.381 -2.907 -4.883 152 H LYS 23 H LYS 23 13.479 -4.298 -2.731 153 HA LYS 23 HA LYS 23 14.820 -6.659 -1.788 154 HB3 LYS 23 2HB LYS 23 13.547 -5.219 0.368 155 HG3 LYS 23 2HG LYS 23 16.314 -5.415 -0.803 156 HD3 LYS 23 2HD LYS 23 15.483 -3.634 1.535 157 HE3 LYS 23 2HE LYS 23 17.988 -3.099 1.454 158 HZ1 LYS 23 3HZ LYS 23 17.136 -5.813 2.275 159 HZ2 LYS 23 1HZ LYS 23 17.304 -4.486 3.226 160 HZ3 LYS 23 2HZ LYS 23 18.623 -5.189 2.582 161 H ILE 24 H ILE 24 11.706 -5.421 -0.666 162 HA ILE 24 HA ILE 24 10.926 -7.695 0.579 163 HB ILE 24 HB ILE 24 9.501 -5.262 -0.558 164 HG13 ILE 24 2HG1 ILE 24 11.210 -5.101 1.339 165 HG21 ILE 24 1HG2 ILE 24 7.555 -5.878 1.025 166 HG22 ILE 24 2HG2 ILE 24 7.685 -6.802 -0.485 167 HG23 ILE 24 3HG2 ILE 24 8.263 -7.497 1.027 168 HD11 ILE 24 3HD1 ILE 24 9.427 -3.376 0.956 169 HD12 ILE 24 1HD1 ILE 24 8.441 -4.209 2.166 170 HD13 ILE 24 2HD1 ILE 24 9.995 -3.509 2.620 171 H ASN 25 H ASN 25 10.179 -6.843 -2.846 172 HA ASN 25 HA ASN 25 8.286 -8.929 -3.147 173 HB3 ASN 25 2HB ASN 25 10.010 -7.639 -5.297 174 HD21 ASN 25 1HD2 ASN 25 6.923 -9.375 -4.510 175 HD22 ASN 25 2HD2 ASN 25 6.866 -10.254 -5.968 176 H SER 26 H SER 26 11.718 -9.177 -2.832 177 HA SER 26 HA SER 26 11.841 -11.900 -3.932 178 HB3 SER 26 2HB SER 26 14.343 -11.027 -3.005 179 HG SER 26 HG SER 26 14.770 -10.797 -5.216 180 H GLU 27 H GLU 27 11.083 -10.464 -0.869 181 HA GLU 27 HA GLU 27 12.244 -12.808 0.510 182 HB3 GLU 27 2HB GLU 27 13.226 -11.133 1.649 183 HG3 GLU 27 2HG GLU 27 10.953 -9.300 1.695 184 H ILE 28 H ILE 28 9.610 -12.014 -1.075 185 HA ILE 28 HA ILE 28 7.752 -13.358 0.806 186 HB ILE 28 HB ILE 28 7.176 -11.309 -1.398 187 HG13 ILE 28 2HG1 ILE 28 8.131 -10.468 0.829 188 HG21 ILE 28 1HG2 ILE 28 5.317 -12.822 -1.463 189 HG22 ILE 28 2HG2 ILE 28 5.225 -12.882 0.324 190 HG23 ILE 28 3HG2 ILE 28 4.815 -11.427 -0.588 191 HD11 ILE 28 3HD1 ILE 28 5.219 -9.686 0.586 192 HD12 ILE 28 1HD1 ILE 28 6.496 -8.852 1.448 193 HD13 ILE 28 2HD1 ILE 28 6.581 -8.967 -0.319 194 H LYS 29 H LYS 29 6.129 -14.670 -0.403 195 HA LYS 29 HA LYS 29 7.182 -16.562 -2.279 196 HB3 LYS 29 2HB LYS 29 4.256 -16.210 -2.339 197 HG3 LYS 29 2HG LYS 29 4.356 -18.391 -1.038 198 HD3 LYS 29 2HD LYS 29 5.273 -19.855 -2.764 199 HE3 LYS 29 2HE LYS 29 3.580 -17.740 -4.125 200 HZ1 LYS 29 3HZ LYS 29 3.934 -19.903 -5.251 201 HZ2 LYS 29 1HZ LYS 29 2.378 -19.714 -4.801 202 HZ3 LYS 29 2HZ LYS 29 3.338 -20.692 -3.913 203 H ASP 30 H ASP 30 5.934 -16.819 -4.307 204 HA ASP 30 HA ASP 30 6.265 -15.070 -6.388 205 HB3 ASP 30 2HB ASP 30 4.588 -17.553 -5.991 206 H SER 31 H SER 31 5.514 -13.494 -5.126 207 HA SER 31 HA SER 31 2.729 -12.482 -5.498 208 HB3 SER 31 2HB SER 31 3.728 -12.068 -3.335 209 HG SER 31 HG SER 31 5.941 -12.106 -3.952 210 H GLU 32 H GLU 32 2.869 -9.898 -6.219 211 HA GLU 32 HA GLU 32 4.507 -9.673 -8.675 212 HB3 GLU 32 2HB GLU 32 2.418 -8.523 -9.544 213 HG3 GLU 32 2HG GLU 32 3.056 -11.311 -9.538 214 H LEU 33 H LEU 33 4.501 -7.366 -9.398 215 HA LEU 33 HA LEU 33 4.895 -5.628 -7.030 216 HB3 LEU 33 2HB LEU 33 7.167 -5.672 -8.968 217 HG LEU 33 HG LEU 33 7.059 -6.051 -6.007 218 HD11 LEU 33 1HD1 LEU 33 9.425 -5.134 -6.062 219 HD12 LEU 33 2HD1 LEU 33 9.240 -4.744 -7.775 220 HD13 LEU 33 3HD1 LEU 33 9.290 -6.420 -7.258 221 HD21 LEU 33 3HD2 LEU 33 7.578 -3.827 -5.488 222 HD22 LEU 33 1HD2 LEU 33 5.962 -3.974 -6.155 223 HD23 LEU 33 2HD2 LEU 33 7.254 -3.323 -7.175 224 H LYS 34 H LYS 34 3.487 -4.125 -7.529 225 HA LYS 34 HA LYS 34 3.375 -3.052 -10.312 226 HB3 LYS 34 2HB LYS 34 1.094 -2.628 -8.451 227 HG3 LYS 34 2HG LYS 34 -0.038 -4.014 -10.364 228 HD3 LYS 34 2HD LYS 34 0.918 -1.231 -10.968 229 HE3 LYS 34 2HE LYS 34 -1.578 -1.603 -11.945 230 HZ1 LYS 34 3HZ LYS 34 0.759 -2.401 -13.572 231 HZ2 LYS 34 1HZ LYS 34 0.423 -0.845 -13.243 232 HZ3 LYS 34 2HZ LYS 34 -0.639 -1.749 -14.128 233 H GLU 35 H GLU 35 2.877 -0.726 -10.648 234 HA GLU 35 HA GLU 35 3.710 0.979 -8.375 235 HB3 GLU 35 2HB GLU 35 5.634 0.691 -9.861 236 HG3 GLU 35 2HG GLU 35 3.805 1.836 -11.986 237 H VAL 36 H VAL 36 2.770 2.881 -8.117 238 HA VAL 36 HA VAL 36 0.462 3.694 -9.828 239 HB VAL 36 HB VAL 36 1.242 4.722 -7.063 240 HG11 VAL 36 1HG1 VAL 36 -1.346 4.767 -8.686 241 HG12 VAL 36 2HG1 VAL 36 -1.252 5.236 -6.978 242 HG13 VAL 36 3HG1 VAL 36 -0.366 6.152 -8.181 243 HG21 VAL 36 3HG2 VAL 36 -0.623 2.389 -7.604 244 HG22 VAL 36 1HG2 VAL 36 0.890 2.340 -6.685 245 HG23 VAL 36 2HG2 VAL 36 -0.492 3.236 -6.067 246 H LYS 37 H LYS 37 0.478 6.104 -10.378 247 HA LYS 37 HA LYS 37 2.652 7.686 -9.382 248 HB3 LYS 37 2HB LYS 37 3.538 6.971 -11.492 249 HG3 LYS 37 2HG LYS 37 2.053 8.273 -13.489 250 HD3 LYS 37 2HD LYS 37 1.414 5.953 -14.271 251 HE3 LYS 37 2HE LYS 37 4.297 6.487 -13.522 252 HZ1 LYS 37 3HZ LYS 37 3.166 4.346 -15.200 253 HZ2 LYS 37 1HZ LYS 37 4.141 4.178 -13.863 254 HZ3 LYS 37 2HZ LYS 37 4.734 4.827 -15.267 255 H VAL 38 H VAL 38 2.050 10.148 -10.109 256 HA VAL 38 HA VAL 38 -0.863 10.400 -9.696 257 HB VAL 38 HB VAL 38 -0.449 12.321 -8.278 258 HG11 VAL 38 1HG1 VAL 38 1.179 10.048 -7.123 259 HG12 VAL 38 2HG1 VAL 38 0.027 11.154 -6.337 260 HG13 VAL 38 3HG1 VAL 38 -0.555 9.906 -7.448 261 HG21 VAL 38 3HG2 VAL 38 1.824 13.044 -9.047 262 HG22 VAL 38 1HG2 VAL 38 1.714 12.857 -7.309 263 HG23 VAL 38 2HG2 VAL 38 2.517 11.614 -8.290 264 H SER 39 H SER 39 -1.254 13.115 -10.090 265 HA SER 39 HA SER 39 -0.887 13.514 -12.815 266 HB3 SER 39 2HB SER 39 -2.720 14.651 -12.035 267 HG SER 39 HG SER 39 -1.602 15.310 -9.533 268 H GLU 40 H GLU 40 0.432 15.301 -13.746 269 HA GLU 40 HA GLU 40 3.007 15.491 -12.340 270 HB3 GLU 40 2HB GLU 40 2.999 14.795 -14.626 271 HG3 GLU 40 2HG GLU 40 2.257 17.654 -15.359 272 H GLY 41 H GLY 41 3.940 17.304 -11.535 273 HA2 GLY 41 1HA GLY 41 4.087 19.439 -10.755 274 HA3 GLY 41 2HA GLY 41 2.816 19.938 -11.859 275 H THR 42 H THR 42 2.145 17.261 -9.577 276 HA THR 42 HA THR 42 0.136 18.808 -8.217 277 HB THR 42 HB THR 42 1.331 16.029 -7.992 278 HG1 THR 42 1HG THR 42 -1.129 17.209 -8.699 279 HG21 THR 42 3HG2 THR 42 0.747 16.686 -5.657 280 HG22 THR 42 1HG2 THR 42 -0.248 15.379 -6.302 281 HG23 THR 42 2HG2 THR 42 -0.906 17.042 -6.196 282 H PHE 43 H PHE 43 3.577 17.921 -7.663 283 HA PHE 43 HA PHE 43 3.617 19.991 -5.612 284 HB3 PHE 43 2HB PHE 43 3.176 18.339 -4.191 285 HD1 PHE 43 2HD PHE 43 5.745 16.891 -6.440 286 HD2 PHE 43 1HD PHE 43 2.474 16.310 -3.781 287 HE1 PHE 43 2HE PHE 43 5.617 14.504 -7.220 288 HE2 PHE 43 1HE PHE 43 2.288 13.865 -4.568 289 HZ PHE 43 HZ PHE 43 3.867 13.012 -6.264 290 H ASP 44 H ASP 44 5.920 19.990 -4.683 291 HA ASP 44 HA ASP 44 7.950 19.956 -6.824 292 HB3 ASP 44 2HB ASP 44 8.702 22.080 -5.192 293 H ALA 45 H ALA 45 10.101 20.615 -4.891 294 HA ALA 45 HA ALA 45 9.998 18.092 -3.285 295 HB1 ALA 45 1HB ALA 45 12.388 17.883 -3.723 296 HB2 ALA 45 2HB ALA 45 11.487 17.935 -5.250 297 HB3 ALA 45 3HB ALA 45 12.365 19.373 -4.681 298 H ASP 46 H ASP 46 9.473 21.189 -2.761 299 HA ASP 46 HA ASP 46 11.655 22.048 -1.229 300 HB3 ASP 46 2HB ASP 46 8.955 23.293 -0.877 301 H MET 47 H MET 47 11.058 23.096 1.052 302 HA MET 47 HA MET 47 10.061 20.999 2.879 303 HB3 MET 47 2HB MET 47 11.617 23.604 3.251 304 HG3 MET 47 2HG MET 47 10.408 21.759 5.320 305 HE1 MET 47 3HE MET 47 13.726 24.826 6.431 306 HE2 MET 47 1HE MET 47 13.649 24.206 4.770 307 HE3 MET 47 2HE MET 47 12.320 25.176 5.408 308 H TYR 48 H TYR 48 9.592 24.521 2.260 309 HA TYR 48 HA TYR 48 7.124 24.507 3.832 310 HB3 TYR 48 2HB TYR 48 8.265 26.428 4.247 311 HD1 TYR 48 1HD TYR 48 10.641 26.075 3.819 312 HD2 TYR 48 2HD TYR 48 8.041 27.711 0.780 313 HE1 TYR 48 1HE TYR 48 12.617 26.740 2.506 314 HE2 TYR 48 2HE TYR 48 10.018 28.355 -0.558 315 HH TYR 48 HH TYR 48 12.339 28.019 -0.792 316 H LYS 49 H LYS 49 7.956 25.244 0.384 317 HA LYS 49 HA LYS 49 5.347 25.904 -0.378 318 HB3 LYS 49 2HB LYS 49 7.487 24.554 -2.097 319 HG3 LYS 49 2HG LYS 49 4.826 25.500 -2.758 320 HD3 LYS 49 2HD LYS 49 7.121 26.994 -4.074 321 HE3 LYS 49 2HE LYS 49 4.359 26.195 -5.037 322 HZ1 LYS 49 3HZ LYS 49 5.996 28.383 -6.120 323 HZ2 LYS 49 1HZ LYS 49 4.463 28.489 -5.458 324 HZ3 LYS 49 2HZ LYS 49 4.714 27.692 -6.865 325 H THR 50 H THR 50 6.841 22.594 -0.486 326 HA THR 50 HA THR 50 4.532 21.383 -1.586 327 HB THR 50 HB THR 50 5.696 19.325 -0.627 328 HG1 THR 50 1HG THR 50 8.019 20.173 0.004 329 HG21 THR 50 3HG2 THR 50 7.667 19.575 -2.117 330 HG22 THR 50 1HG2 THR 50 7.292 21.303 -2.323 331 HG23 THR 50 2HG2 THR 50 6.136 20.067 -2.868 332 H SER 51 H SER 51 5.264 22.216 1.871 333 HA SER 51 HA SER 51 3.454 20.184 2.812 334 HB3 SER 51 2HB SER 51 5.352 21.186 4.148 335 HG SER 51 HG SER 51 3.395 23.124 4.837 336 H ASP 52 H ASP 52 3.087 23.520 1.703 337 HA ASP 52 HA ASP 52 0.456 24.000 2.669 338 HB3 ASP 52 2HB ASP 52 1.555 24.856 -0.056 339 H ILE 53 H ILE 53 1.623 22.324 -0.220 340 HA ILE 53 HA ILE 53 -0.914 21.994 -1.503 341 HB ILE 53 HB ILE 53 1.485 20.105 -1.896 342 HG13 ILE 53 2HG1 ILE 53 2.263 22.516 -1.936 343 HG21 ILE 53 1HG2 ILE 53 -0.838 19.709 -2.945 344 HG22 ILE 53 2HG2 ILE 53 -0.479 21.116 -3.963 345 HG23 ILE 53 3HG2 ILE 53 0.578 19.686 -3.968 346 HD11 ILE 53 3HD1 ILE 53 3.257 20.716 -3.434 347 HD12 ILE 53 1HD1 ILE 53 2.342 21.522 -4.746 348 HD13 ILE 53 2HD1 ILE 53 3.566 22.416 -3.809 349 H ALA 54 H ALA 54 1.160 19.716 0.364 350 HA ALA 54 HA ALA 54 -0.766 17.633 0.353 351 HB1 ALA 54 1HB ALA 54 1.381 18.195 2.432 352 HB2 ALA 54 2HB ALA 54 0.610 16.622 2.065 353 HB3 ALA 54 3HB ALA 54 1.642 17.434 0.851 354 H LEU 55 H LEU 55 -0.622 20.536 2.322 355 HA LEU 55 HA LEU 55 -2.579 19.590 4.264 356 HB3 LEU 55 2HB LEU 55 -1.539 22.391 3.692 357 HG LEU 55 HG LEU 55 -3.515 22.292 5.212 358 HD11 LEU 55 1HD1 LEU 55 -3.168 21.357 7.521 359 HD12 LEU 55 2HD1 LEU 55 -1.664 20.599 6.950 360 HD13 LEU 55 3HD1 LEU 55 -3.239 20.102 6.283 361 HD21 LEU 55 3HD2 LEU 55 -2.506 23.644 6.995 362 HD22 LEU 55 1HD2 LEU 55 -1.789 24.049 5.427 363 HD23 LEU 55 2HD2 LEU 55 -0.897 23.028 6.580 364 H ASP 56 H ASP 56 -2.563 21.488 1.223 365 HA ASP 56 HA ASP 56 -5.238 22.312 1.254 366 HB3 ASP 56 2HB ASP 56 -3.366 23.111 -0.268 367 H GLN 57 H GLN 57 -3.863 19.246 0.688 368 HA GLN 57 HA GLN 57 -6.425 18.120 -0.197 369 HB3 GLN 57 2HB GLN 57 -5.144 16.070 -0.593 370 HG3 GLN 57 2HG GLN 57 -3.475 18.530 -1.262 371 HE21 GLN 57 1HE2 GLN 57 -3.026 17.623 -3.915 372 HE22 GLN 57 2HE2 GLN 57 -1.730 16.427 -3.792 373 H ILE 58 H ILE 58 -5.704 19.023 2.793 374 HA ILE 58 HA ILE 58 -6.716 16.546 4.126 375 HB ILE 58 HB ILE 58 -4.590 18.529 4.961 376 HG13 ILE 58 2HG1 ILE 58 -3.944 16.564 3.566 377 HG21 ILE 58 1HG2 ILE 58 -6.097 18.142 6.973 378 HG22 ILE 58 2HG2 ILE 58 -5.680 16.422 6.871 379 HG23 ILE 58 3HG2 ILE 58 -4.441 17.648 7.185 380 HD11 ILE 58 3HD1 ILE 58 -2.405 17.489 5.415 381 HD12 ILE 58 1HD1 ILE 58 -2.993 16.115 6.390 382 HD13 ILE 58 2HD1 ILE 58 -2.095 15.822 4.905 383 H GLN 59 H GLN 59 -6.442 20.078 4.591 384 HA GLN 59 HA GLN 59 -8.365 20.291 6.656 385 HB3 GLN 59 2HB GLN 59 -8.351 22.775 5.836 386 HG3 GLN 59 2HG GLN 59 -5.585 21.594 6.330 387 HE21 GLN 59 1HE2 GLN 59 -4.731 23.553 5.283 388 HE22 GLN 59 2HE2 GLN 59 -4.948 25.127 5.966 389 H GLY 60 H GLY 60 -8.779 19.971 3.231 390 HA2 GLY 60 1HA GLY 60 -10.862 19.311 2.227 391 HA3 GLY 60 2HA GLY 60 -11.727 20.255 3.445 392 H ASN 61 H ASN 61 -8.930 21.854 2.382 393 HA ASN 61 HA ASN 61 -10.314 24.009 1.116 394 HB3 ASN 61 2HB ASN 61 -8.124 24.888 0.598 395 HD21 ASN 61 1HD2 ASN 61 -5.994 24.906 2.168 396 HD22 ASN 61 2HD2 ASN 61 -6.388 25.155 3.849 397 H LYS 62 H LYS 62 -8.442 21.129 -0.231 398 HA LYS 62 HA LYS 62 -9.477 21.883 -2.891 399 HB3 LYS 62 2HB LYS 62 -6.920 20.452 -2.969 400 HG3 LYS 62 2HG LYS 62 -6.397 23.118 -3.559 401 HD3 LYS 62 2HD LYS 62 -7.544 21.101 -5.537 402 HE3 LYS 62 2HE LYS 62 -5.826 23.594 -5.717 403 HZ1 LYS 62 3HZ LYS 62 -5.865 21.371 -7.667 404 HZ2 LYS 62 1HZ LYS 62 -4.569 21.882 -6.778 405 HZ3 LYS 62 2HZ LYS 62 -5.217 22.835 -7.940 406 H ASP 63 H ASP 63 -9.265 20.010 -4.388 407 HA ASP 63 HA ASP 63 -10.345 17.516 -3.355 408 HB3 ASP 63 2HB ASP 63 -11.128 18.394 -5.478 409 H PHE 64 H PHE 64 -8.917 15.690 -4.972 410 HA PHE 64 HA PHE 64 -6.361 15.524 -3.456 411 HB3 PHE 64 2HB PHE 64 -7.765 14.078 -2.320 412 HD1 PHE 64 2HD PHE 64 -8.253 12.677 -5.771 413 HD2 PHE 64 1HD PHE 64 -10.081 13.919 -2.083 414 HE1 PHE 64 2HE PHE 64 -10.493 11.902 -6.606 415 HE2 PHE 64 1HE PHE 64 -12.310 13.105 -2.913 416 HZ PHE 64 HZ PHE 64 -12.488 12.109 -5.180 417 HA PRO 65 HA PRO 65 -4.442 14.910 -7.316 418 HB3 PRO 65 2HB PRO 65 -2.466 14.769 -6.135 419 HG3 PRO 65 2HG PRO 65 -2.274 13.409 -4.155 420 HD3 PRO 65 2HD PRO 65 -4.054 14.933 -3.808 421 H GLU 66 H GLU 66 -4.755 13.679 -9.233 422 HA GLU 66 HA GLU 66 -6.348 11.257 -9.047 423 HB3 GLU 66 2HB GLU 66 -6.885 12.739 -10.825 424 HG3 GLU 66 2HG GLU 66 -3.933 12.659 -11.434 425 H ILE 67 H ILE 67 -5.622 9.254 -10.341 426 HA ILE 67 HA ILE 67 -2.692 8.770 -10.062 427 HB ILE 67 HB ILE 67 -3.234 6.368 -9.735 428 HG13 ILE 67 2HG1 ILE 67 -5.587 6.379 -10.572 429 HG21 ILE 67 1HG2 ILE 67 -2.580 7.879 -7.914 430 HG22 ILE 67 2HG2 ILE 67 -4.292 8.157 -7.521 431 HG23 ILE 67 3HG2 ILE 67 -3.567 6.540 -7.337 432 HD11 ILE 67 3HD1 ILE 67 -5.478 5.365 -7.705 433 HD12 ILE 67 1HD1 ILE 67 -6.506 4.796 -9.019 434 HD13 ILE 67 2HD1 ILE 67 -4.772 4.517 -9.100 435 H GLN 68 H GLN 68 -1.733 7.523 -11.636 436 HA GLN 68 HA GLN 68 -3.256 7.236 -14.155 437 HB3 GLN 68 2HB GLN 68 -1.553 8.027 -15.358 438 HG3 GLN 68 2HG GLN 68 -0.211 9.822 -14.162 439 HE21 GLN 68 1HE2 GLN 68 -2.434 11.282 -12.363 440 HE22 GLN 68 2HE2 GLN 68 -3.663 11.647 -13.576 441 H LEU 69 H LEU 69 -3.828 5.471 -13.505 442 HA LEU 69 HA LEU 69 -2.070 3.050 -13.686 443 HB3 LEU 69 2HB LEU 69 -4.276 2.528 -11.900 444 HG LEU 69 HG LEU 69 -1.348 3.033 -11.236 445 HD11 LEU 69 1HD1 LEU 69 -3.689 1.849 -9.703 446 HD12 LEU 69 2HD1 LEU 69 -2.880 3.389 -9.395 447 HD13 LEU 69 3HD1 LEU 69 -2.006 1.855 -9.140 448 HD21 LEU 69 3HD2 LEU 69 -1.608 1.046 -12.733 449 HD22 LEU 69 1HD2 LEU 69 -2.833 0.393 -11.619 450 HD23 LEU 69 2HD2 LEU 69 -1.148 0.590 -11.089 451 H ASP 70 H ASP 70 -3.537 0.955 -13.927 452 HA ASP 70 HA ASP 70 -6.001 1.555 -15.496 453 HB3 ASP 70 2HB ASP 70 -5.531 -0.973 -16.219 454 H ASN 71 H ASN 71 -7.684 -0.127 -15.170 455 HA ASN 71 HA ASN 71 -8.117 -0.220 -12.292 456 HB3 ASN 71 2HB ASN 71 -9.945 -1.228 -14.510 457 HD21 ASN 71 1HD2 ASN 71 -11.264 -2.528 -13.044 458 HD22 ASN 71 2HD2 ASN 71 -12.063 -1.769 -11.679 459 H ILE 72 H ILE 72 -8.072 -2.015 -10.979 460 HA ILE 72 HA ILE 72 -7.541 -4.686 -12.185 461 HB ILE 72 HB ILE 72 -5.973 -3.179 -10.052 462 HG13 ILE 72 2HG1 ILE 72 -5.345 -2.922 -12.478 463 HG21 ILE 72 1HG2 ILE 72 -6.402 -5.447 -9.142 464 HG22 ILE 72 2HG2 ILE 72 -5.806 -6.176 -10.651 465 HG23 ILE 72 3HG2 ILE 72 -4.724 -5.275 -9.565 466 HD11 ILE 72 3HD1 ILE 72 -3.247 -4.470 -10.908 467 HD12 ILE 72 1HD1 ILE 72 -3.009 -3.495 -12.342 468 HD13 ILE 72 2HD1 ILE 72 -3.547 -2.709 -10.835 469 H ASP 73 H ASP 73 -8.538 -6.347 -11.142 470 HA ASP 73 HA ASP 73 -10.546 -5.809 -9.110 471 HB3 ASP 73 2HB ASP 73 -10.687 -8.365 -9.303 472 H TYR 74 H TYR 74 -9.411 -5.153 -7.240 473 HA TYR 74 HA TYR 74 -7.096 -6.633 -6.317 474 HB3 TYR 74 2HB TYR 74 -7.319 -5.298 -4.286 475 HD1 TYR 74 2HD TYR 74 -5.504 -4.995 -6.496 476 HD2 TYR 74 1HD TYR 74 -8.872 -2.533 -5.433 477 HE1 TYR 74 2HE TYR 74 -4.537 -3.116 -7.782 478 HE2 TYR 74 1HE TYR 74 -7.869 -0.604 -6.582 479 HH TYR 74 HH TYR 74 -6.286 -0.041 -8.237 480 H ASN 75 H ASN 75 -10.354 -7.541 -6.423 481 HA ASN 75 HA ASN 75 -10.836 -8.275 -3.730 482 HB3 ASN 75 2HB ASN 75 -12.264 -9.722 -5.956 483 HD21 ASN 75 1HD2 ASN 75 -12.157 -10.053 -2.922 484 HD22 ASN 75 2HD2 ASN 75 -13.771 -9.604 -2.412 485 H ASN 76 H ASN 76 -9.148 -9.905 -6.299 486 HA ASN 76 HA ASN 76 -9.227 -12.552 -5.051 487 HB3 ASN 76 2HB ASN 76 -9.664 -12.489 -7.384 488 HD21 ASN 76 1HD2 ASN 76 -9.758 -10.346 -8.362 489 HD22 ASN 76 2HD2 ASN 76 -8.302 -9.557 -8.932 490 H TYR 77 H TYR 77 -7.565 -9.976 -4.115 491 HA TYR 77 HA TYR 77 -5.018 -11.473 -3.740 492 HB3 TYR 77 2HB TYR 77 -3.997 -9.308 -3.300 493 HD1 TYR 77 1HD TYR 77 -2.613 -10.562 -4.958 494 HD2 TYR 77 2HD TYR 77 -6.200 -8.518 -6.149 495 HE1 TYR 77 1HE TYR 77 -1.915 -10.731 -7.341 496 HE2 TYR 77 2HE TYR 77 -5.527 -8.652 -8.513 497 HH TYR 77 HH TYR 77 -3.898 -9.395 -10.009 498 H ASP 78 H ASP 78 -4.764 -12.315 -1.863 499 HA ASP 78 HA ASP 78 -6.673 -11.570 0.323 500 HB3 ASP 78 2HB ASP 78 -4.783 -13.367 1.414 501 H LEU 79 H LEU 79 -3.381 -10.941 -0.676 502 HA LEU 79 HA LEU 79 -3.039 -9.225 1.708 503 HB3 LEU 79 2HB LEU 79 -0.836 -10.822 0.355 504 HG LEU 79 HG LEU 79 0.348 -10.633 2.454 505 HD11 LEU 79 1HD1 LEU 79 0.690 -8.736 0.743 506 HD12 LEU 79 2HD1 LEU 79 1.311 -8.630 2.394 507 HD13 LEU 79 3HD1 LEU 79 -0.159 -7.738 1.941 508 HD21 LEU 79 3HD2 LEU 79 -1.770 -8.711 3.402 509 HD22 LEU 79 1HD2 LEU 79 -0.335 -9.165 4.275 510 HD23 LEU 79 2HD2 LEU 79 -1.572 -10.395 3.946 511 H ILE 80 H ILE 80 -2.329 -7.233 1.215 512 HA ILE 80 HA ILE 80 -1.247 -6.634 -1.467 513 HB ILE 80 HB ILE 80 -3.542 -5.011 -0.316 514 HG13 ILE 80 2HG1 ILE 80 -4.438 -7.087 -1.197 515 HG21 ILE 80 1HG2 ILE 80 -3.339 -3.683 -2.361 516 HG22 ILE 80 2HG2 ILE 80 -1.764 -3.724 -1.586 517 HG23 ILE 80 3HG2 ILE 80 -2.071 -4.770 -2.984 518 HD11 ILE 80 3HD1 ILE 80 -5.633 -4.975 -1.916 519 HD12 ILE 80 1HD1 ILE 80 -4.773 -5.117 -3.478 520 HD13 ILE 80 2HD1 ILE 80 -5.869 -6.398 -2.944 521 H LEU 81 H LEU 81 0.696 -5.849 -0.964 522 HA LEU 81 HA LEU 81 1.005 -4.204 1.491 523 HB3 LEU 81 2HB LEU 81 3.463 -4.168 0.585 524 HG LEU 81 HG LEU 81 2.033 -6.698 1.412 525 HD11 LEU 81 1HD1 LEU 81 5.030 -6.407 1.088 526 HD12 LEU 81 2HD1 LEU 81 3.948 -7.361 0.032 527 HD13 LEU 81 3HD1 LEU 81 4.135 -7.809 1.725 528 HD21 LEU 81 3HD2 LEU 81 2.171 -4.990 3.143 529 HD22 LEU 81 1HD2 LEU 81 3.914 -4.823 2.886 530 HD23 LEU 81 2HD2 LEU 81 3.253 -6.333 3.544 531 H ILE 82 H ILE 82 1.592 -2.010 1.430 532 HA ILE 82 HA ILE 82 1.759 -0.716 -1.210 533 HB ILE 82 HB ILE 82 0.145 0.194 1.196 534 HG13 ILE 82 2HG1 ILE 82 -0.582 -0.987 -1.468 535 HG21 ILE 82 1HG2 ILE 82 0.652 1.702 -1.392 536 HG22 ILE 82 2HG2 ILE 82 -0.466 2.168 -0.086 537 HG23 ILE 82 3HG2 ILE 82 1.262 2.143 0.224 538 HD11 ILE 82 3HD1 ILE 82 -2.148 -0.753 1.137 539 HD12 ILE 82 1HD1 ILE 82 -2.574 -1.746 -0.272 540 HD13 ILE 82 2HD1 ILE 82 -1.150 -2.155 0.703 541 H GLY 83 H GLY 83 3.306 0.769 -1.414 542 HA2 GLY 83 1HA GLY 83 5.174 1.372 0.860 543 HA3 GLY 83 2HA GLY 83 5.684 1.064 -0.791 544 H SER 84 H SER 84 5.448 3.685 1.096 545 HA SER 84 HA SER 84 4.555 5.499 -1.080 546 HB3 SER 84 2HB SER 84 3.500 5.346 1.749 547 HG SER 84 HG SER 84 3.559 7.490 1.281 548 HA PRO 85 HA PRO 85 7.989 7.925 0.661 549 HB3 PRO 85 2HB PRO 85 8.262 9.136 -1.232 550 HG3 PRO 85 2HG PRO 85 6.597 9.027 -2.814 551 HD3 PRO 85 2HD PRO 85 5.636 7.090 -2.152 552 H VAL 86 H VAL 86 8.351 9.841 2.087 553 HA VAL 86 HA VAL 86 5.979 10.868 3.546 554 HB VAL 86 HB VAL 86 8.557 9.696 4.620 555 HG11 VAL 86 1HG1 VAL 86 7.663 10.518 6.919 556 HG12 VAL 86 2HG1 VAL 86 8.532 11.641 5.879 557 HG13 VAL 86 3HG1 VAL 86 6.786 11.750 5.954 558 HG21 VAL 86 3HG2 VAL 86 6.621 8.225 4.315 559 HG22 VAL 86 1HG2 VAL 86 6.992 8.420 6.030 560 HG23 VAL 86 2HG2 VAL 86 5.612 9.287 5.314 561 H TRP 87 H TRP 87 5.808 12.950 3.068 562 HA TRP 87 HA TRP 87 8.077 14.649 2.464 563 HB3 TRP 87 2HB TRP 87 5.643 16.115 2.982 564 HD1 TRP 87 HD TRP 87 6.976 17.868 1.312 565 HE1 TRP 87 1HE TRP 87 7.193 17.976 -1.270 566 HE3 TRP 87 3HE TRP 87 5.385 13.190 0.086 567 HZ2 TRP 87 2HZ TRP 87 6.918 16.290 -3.491 568 HZ3 TRP 87 3HZ TRP 87 5.269 12.489 -2.311 569 HH2 TRP 87 HH TRP 87 6.030 14.033 -4.098 570 H SER 88 H SER 88 7.669 16.973 3.864 571 HA SER 88 HA SER 88 8.745 16.292 6.432 572 HB3 SER 88 2HB SER 88 7.945 19.101 5.674 573 HG SER 88 HG SER 88 9.205 18.826 7.545 574 H GLY 89 H GLY 89 6.973 15.023 7.173 575 HA2 GLY 89 1HA GLY 89 5.744 15.298 9.315 576 HA3 GLY 89 2HA GLY 89 4.744 16.504 8.551 577 H TYR 90 H TYR 90 4.095 15.395 6.048 578 HA TYR 90 HA TYR 90 2.780 12.846 6.775 579 HB3 TYR 90 2HB TYR 90 0.956 13.972 7.265 580 HD1 TYR 90 2HD TYR 90 1.797 16.215 4.344 581 HD2 TYR 90 1HD TYR 90 0.900 15.858 8.535 582 HE1 TYR 90 2HE TYR 90 1.925 18.704 4.578 583 HE2 TYR 90 1HE TYR 90 1.031 18.347 8.784 584 HH TYR 90 HH TYR 90 2.601 20.169 7.138 585 HA PRO 91 HA PRO 91 3.646 11.916 2.511 586 HB3 PRO 91 2HB PRO 91 2.772 9.847 2.836 587 HG3 PRO 91 2HG PRO 91 0.828 9.487 4.184 588 HD3 PRO 91 2HD PRO 91 2.360 10.690 5.508 589 H ALA 92 H ALA 92 2.468 11.969 0.262 590 HA ALA 92 HA ALA 92 1.447 14.677 -0.080 591 HB1 ALA 92 1HB ALA 92 1.829 14.225 -2.453 592 HB2 ALA 92 2HB ALA 92 3.250 13.966 -1.459 593 HB3 ALA 92 3HB ALA 92 2.332 12.556 -2.059 594 H THR 93 H THR 93 -0.266 12.553 1.086 595 HA THR 93 HA THR 93 -2.061 11.186 0.867 596 HB THR 93 HB THR 93 -4.093 12.149 0.079 597 HG1 THR 93 1HG THR 93 -2.657 14.321 -1.079 598 HG21 THR 93 3HG2 THR 93 -3.131 13.076 2.197 599 HG22 THR 93 1HG2 THR 93 -4.254 14.155 1.355 600 HG23 THR 93 2HG2 THR 93 -2.514 14.461 1.240 601 HA PRO 94 HA PRO 94 -1.076 9.813 -3.518 602 HB3 PRO 94 2HB PRO 94 1.159 9.319 -3.298 603 HG3 PRO 94 2HG PRO 94 2.101 8.826 -1.196 604 HD3 PRO 94 2HD PRO 94 0.907 10.757 -0.739 605 H ILE 95 H ILE 95 -1.329 7.575 -0.698 606 HA ILE 95 HA ILE 95 -2.741 5.630 -2.217 607 HB ILE 95 HB ILE 95 -2.655 5.766 0.813 608 HG13 ILE 95 2HG1 ILE 95 -0.567 4.413 0.730 609 HG21 ILE 95 1HG2 ILE 95 -2.613 3.295 0.643 610 HG22 ILE 95 2HG2 ILE 95 -4.049 3.965 -0.119 611 HG23 ILE 95 3HG2 ILE 95 -2.701 3.411 -1.125 612 HD11 ILE 95 3HD1 ILE 95 -0.032 5.643 -1.998 613 HD12 ILE 95 1HD1 ILE 95 0.980 4.526 -1.098 614 HD13 ILE 95 2HD1 ILE 95 -0.531 3.953 -1.822 615 H LYS 96 H LYS 96 -3.889 8.554 -0.839 616 HA LYS 96 HA LYS 96 -6.425 8.082 0.163 617 HB3 LYS 96 2HB LYS 96 -5.299 10.384 -1.448 618 HG3 LYS 96 2HG LYS 96 -7.678 10.698 -1.429 619 HD3 LYS 96 2HD LYS 96 -7.452 10.128 1.541 620 HE3 LYS 96 2HE LYS 96 -8.400 12.406 1.284 621 HZ1 LYS 96 3HZ LYS 96 -10.846 11.250 0.179 622 HZ2 LYS 96 1HZ LYS 96 -9.681 11.702 -0.863 623 HZ3 LYS 96 2HZ LYS 96 -10.318 12.820 0.184 624 H THR 97 H THR 97 -5.688 9.043 -3.232 625 HA THR 97 HA THR 97 -8.291 8.781 -4.116 626 HB THR 97 HB THR 97 -5.834 8.471 -5.869 627 HG1 THR 97 1HG THR 97 -5.682 10.847 -5.569 628 HG21 THR 97 3HG2 THR 97 -6.951 9.837 -7.419 629 HG22 THR 97 1HG2 THR 97 -7.996 10.556 -6.169 630 HG23 THR 97 2HG2 THR 97 -8.306 8.928 -6.713 631 H LEU 98 H LEU 98 -5.656 6.380 -4.117 632 HA LEU 98 HA LEU 98 -6.962 4.391 -5.780 633 HB3 LEU 98 2HB LEU 98 -4.752 4.342 -3.657 634 HG LEU 98 HG LEU 98 -5.694 2.047 -3.827 635 HD11 LEU 98 1HD1 LEU 98 -5.404 0.781 -5.915 636 HD12 LEU 98 2HD1 LEU 98 -4.906 2.254 -6.774 637 HD13 LEU 98 3HD1 LEU 98 -6.560 2.089 -6.148 638 HD21 LEU 98 3HD2 LEU 98 -3.556 0.942 -4.311 639 HD22 LEU 98 1HD2 LEU 98 -3.306 2.414 -3.365 640 HD23 LEU 98 2HD2 LEU 98 -2.953 2.412 -5.105 641 H LEU 99 H LEU 99 -6.946 5.030 -2.167 642 HA LEU 99 HA LEU 99 -8.206 2.600 -1.558 643 HB3 LEU 99 2HB LEU 99 -6.931 4.356 -0.125 644 HG LEU 99 HG LEU 99 -9.154 5.928 -0.287 645 HD11 LEU 99 1HD1 LEU 99 -10.340 3.791 0.741 646 HD12 LEU 99 2HD1 LEU 99 -10.836 5.445 1.157 647 HD13 LEU 99 3HD1 LEU 99 -9.814 4.529 2.276 648 HD21 LEU 99 3HD2 LEU 99 -7.068 6.368 0.957 649 HD22 LEU 99 1HD2 LEU 99 -7.672 5.428 2.301 650 HD23 LEU 99 2HD2 LEU 99 -8.524 6.915 1.818 651 H ASP 100 H ASP 100 -9.499 5.733 -2.567 652 HA ASP 100 HA ASP 100 -12.206 5.263 -1.954 653 HB3 ASP 100 2HB ASP 100 -11.384 6.922 -4.350 654 H GLN 101 H GLN 101 -10.229 4.154 -4.661 655 HA GLN 101 HA GLN 101 -12.476 3.073 -6.191 656 HB3 GLN 101 2HB GLN 101 -10.634 1.930 -7.482 657 HG3 GLN 101 2HG GLN 101 -9.999 4.859 -7.216 658 HE21 GLN 101 1HE2 GLN 101 -8.704 5.425 -8.973 659 HE22 GLN 101 2HE2 GLN 101 -8.560 4.513 -10.466 660 H MET 102 H MET 102 -10.089 1.802 -3.822 661 HA MET 102 HA MET 102 -11.104 -0.921 -4.292 662 HB3 MET 102 2HB MET 102 -8.717 -0.545 -4.382 663 HG3 MET 102 2HG MET 102 -9.117 0.724 -1.791 664 HE1 MET 102 3HE MET 102 -5.561 -0.343 -3.110 665 HE2 MET 102 1HE MET 102 -5.212 -1.760 -2.094 666 HE3 MET 102 2HE MET 102 -6.489 -1.849 -3.327 667 H LYS 103 H LYS 103 -12.082 1.402 -2.175 668 HA LYS 103 HA LYS 103 -12.085 0.509 0.328 669 HB3 LYS 103 2HB LYS 103 -14.698 1.591 0.021 670 HG3 LYS 103 2HG LYS 103 -12.853 3.763 0.074 671 HD3 LYS 103 2HD LYS 103 -13.154 3.049 2.750 672 HE3 LYS 103 2HE LYS 103 -13.557 5.231 1.753 673 HZ1 LYS 103 3HZ LYS 103 -15.783 5.740 0.889 674 HZ2 LYS 103 1HZ LYS 103 -16.230 4.166 0.970 675 HZ3 LYS 103 2HZ LYS 103 -15.066 4.645 -0.072 676 H ASN 104 H ASN 104 -13.957 -1.261 -1.932 677 HA ASN 104 HA ASN 104 -15.652 -2.346 0.269 678 HB3 ASN 104 2HB ASN 104 -16.989 -3.326 -1.632 679 HD21 ASN 104 1HD2 ASN 104 -15.943 -0.059 -2.598 680 HD22 ASN 104 2HD2 ASN 104 -17.323 0.775 -1.897 681 H TYR 105 H TYR 105 -12.728 -3.224 -1.060 682 HA TYR 105 HA TYR 105 -13.338 -6.104 -1.221 683 HB3 TYR 105 2HB TYR 105 -10.993 -6.332 -1.853 684 HD1 TYR 105 1HD TYR 105 -13.358 -6.468 -3.375 685 HD2 TYR 105 2HD TYR 105 -10.458 -3.339 -3.323 686 HE1 TYR 105 1HE TYR 105 -14.043 -5.877 -5.666 687 HE2 TYR 105 2HE TYR 105 -11.131 -2.684 -5.694 688 HH TYR 105 HH TYR 105 -12.423 -3.314 -7.555 689 H ARG 106 H ARG 106 -11.639 -7.566 -0.143 690 HA ARG 106 HA ARG 106 -11.043 -6.736 2.634 691 HB3 ARG 106 2HB ARG 106 -11.761 -8.972 3.409 692 HG3 ARG 106 2HG ARG 106 -14.206 -9.022 2.642 693 HD3 ARG 106 2HD ARG 106 -13.111 -6.464 3.910 694 HE ARG 106 HE ARG 106 -15.242 -5.806 3.789 695 HH11 ARG 106 1HH1 ARG 106 -15.346 -9.325 4.511 696 HH12 ARG 106 2HH1 ARG 106 -17.071 -9.404 4.388 697 HH21 ARG 106 1HH2 ARG 106 -17.502 -5.983 3.587 698 HH22 ARG 106 2HH2 ARG 106 -18.294 -7.510 3.669 699 H GLY 107 H GLY 107 -9.455 -8.457 3.562 700 HA2 GLY 107 1HA GLY 107 -7.704 -10.137 2.649 701 HA3 GLY 107 2HA GLY 107 -7.276 -8.737 1.632 702 H GLU 108 H GLU 108 -5.282 -9.066 2.995 703 HA GLU 108 HA GLU 108 -5.333 -7.465 5.509 704 HB3 GLU 108 2HB GLU 108 -3.083 -8.616 5.774 705 HG3 GLU 108 2HG GLU 108 -5.447 -10.539 5.631 706 H VAL 109 H VAL 109 -4.411 -5.478 5.330 707 HA VAL 109 HA VAL 109 -2.948 -4.886 2.798 708 HB VAL 109 HB VAL 109 -5.193 -3.310 4.088 709 HG11 VAL 109 1HG1 VAL 109 -5.174 -2.097 1.912 710 HG12 VAL 109 2HG1 VAL 109 -3.543 -2.072 2.607 711 HG13 VAL 109 3HG1 VAL 109 -3.913 -3.196 1.303 712 HG21 VAL 109 3HG2 VAL 109 -6.261 -5.321 3.280 713 HG22 VAL 109 1HG2 VAL 109 -6.594 -4.038 2.117 714 HG23 VAL 109 2HG2 VAL 109 -5.354 -5.259 1.749 715 H ALA 110 H ALA 110 -0.921 -4.580 3.646 716 HA ALA 110 HA ALA 110 -0.667 -2.768 6.020 717 HB1 ALA 110 1HB ALA 110 1.022 -5.048 5.093 718 HB2 ALA 110 2HB ALA 110 1.811 -3.639 5.838 719 HB3 ALA 110 3HB ALA 110 0.553 -4.500 6.724 720 H SER 111 H SER 111 0.452 -0.896 5.872 721 HA SER 111 HA SER 111 1.115 0.071 3.146 722 HB3 SER 111 2HB SER 111 -0.110 2.145 3.769 723 HG SER 111 HG SER 111 -2.125 0.282 3.992 724 H PHE 112 H PHE 112 3.267 0.018 3.506 725 HA PHE 112 HA PHE 112 4.387 1.421 5.874 726 HB3 PHE 112 2HB PHE 112 5.077 -0.903 5.612 727 HD1 PHE 112 1HD PHE 112 4.319 -2.111 3.484 728 HD2 PHE 112 2HD PHE 112 7.758 0.520 3.583 729 HE1 PHE 112 1HE PHE 112 5.202 -3.162 1.430 730 HE2 PHE 112 2HE PHE 112 8.601 -0.535 1.515 731 HZ PHE 112 HZ PHE 112 7.326 -2.348 0.416 732 H PHE 113 H PHE 113 6.598 2.443 5.287 733 HA PHE 113 HA PHE 113 6.332 4.058 2.841 734 HB3 PHE 113 2HB PHE 113 6.585 6.110 4.251 735 HD1 PHE 113 2HD PHE 113 4.023 3.818 5.856 736 HD2 PHE 113 1HD PHE 113 4.739 7.269 3.381 737 HE1 PHE 113 2HE PHE 113 1.599 4.259 5.782 738 HE2 PHE 113 1HE PHE 113 2.288 7.704 3.319 739 HZ PHE 113 HZ PHE 113 0.725 6.209 4.512 740 H THR 114 H THR 114 8.266 5.371 2.446 741 HA THR 114 HA THR 114 10.685 4.546 3.985 742 HB THR 114 HB THR 114 11.915 5.476 1.962 743 HG1 THR 114 1HG THR 114 10.409 6.519 0.731 744 HG21 THR 114 3HG2 THR 114 10.155 3.047 1.411 745 HG22 THR 114 1HG2 THR 114 11.578 3.028 2.469 746 HG23 THR 114 2HG2 THR 114 11.773 3.394 0.750 747 H SER 115 H SER 115 12.019 6.260 4.854 748 HA SER 115 HA SER 115 11.177 9.015 4.506 749 HB3 SER 115 2HB SER 115 9.595 8.217 6.231 750 HG SER 115 HG SER 115 10.467 7.460 8.240 751 H ALA 116 H ALA 116 12.622 10.383 6.050 752 HA ALA 116 HA ALA 116 15.369 9.300 6.293 753 HB1 ALA 116 1HB ALA 116 15.931 11.680 6.774 754 HB2 ALA 116 2HB ALA 116 15.156 11.510 5.196 755 HB3 ALA 116 3HB ALA 116 14.225 12.129 6.568 756 H GLY 117 H GLY 117 13.604 7.957 7.845 757 HA2 GLY 117 1HA GLY 117 13.282 7.262 10.007 758 HA3 GLY 117 2HA GLY 117 14.551 8.411 10.444 759 H THR 118 H THR 118 12.029 10.131 9.014 760 HA THR 118 HA THR 118 11.576 11.306 11.649 761 HB THR 118 HB THR 118 10.958 13.227 9.760 762 HG1 THR 118 1HG THR 118 13.221 11.822 8.799 763 HG21 THR 118 3HG2 THR 118 12.409 13.504 11.704 764 HG22 THR 118 1HG2 THR 118 13.246 14.067 10.253 765 HG23 THR 118 2HG2 THR 118 13.651 12.476 10.958 766 H ASN 119 H ASN 119 9.669 12.492 12.085 767 HA ASN 119 HA ASN 119 7.475 12.602 12.519 768 HB3 ASN 119 2HB ASN 119 6.043 12.987 10.490 769 HD21 ASN 119 1HD2 ASN 119 8.828 14.310 9.025 770 HD22 ASN 119 2HD2 ASN 119 8.975 15.764 9.972 771 H HIS 120 H HIS 120 8.483 9.979 12.805 772 HA HIS 120 HA HIS 120 7.063 8.103 11.272 773 HB3 HIS 120 2HB HIS 120 9.279 7.818 12.554 774 HD1 HIS 120 1HD HIS 120 9.527 9.094 14.964 775 HD2 HIS 120 2HD HIS 120 6.978 5.744 14.838 776 HE1 HIS 120 1HE HIS 120 8.937 8.533 17.406 777 H LYS 121 H LYS 121 5.914 9.945 13.889 778 HA LYS 121 HA LYS 121 3.755 7.980 14.498 779 HB3 LYS 121 2HB LYS 121 3.643 10.269 16.213 780 HG3 LYS 121 2HG LYS 121 4.560 8.553 17.902 781 HD3 LYS 121 2HD LYS 121 2.125 7.772 16.233 782 HE3 LYS 121 2HE LYS 121 2.947 7.252 19.125 783 HZ1 LYS 121 3HZ LYS 121 0.660 7.885 19.085 784 HZ2 LYS 121 1HZ LYS 121 0.688 6.237 19.211 785 HZ3 LYS 121 2HZ LYS 121 0.346 6.927 17.787 786 H ALA 122 H ALA 122 4.393 11.267 13.298 787 HA ALA 122 HA ALA 122 1.676 12.106 13.076 788 HB1 ALA 122 1HB ALA 122 3.567 13.692 12.805 789 HB2 ALA 122 2HB ALA 122 4.034 12.883 11.288 790 HB3 ALA 122 3HB ALA 122 2.500 13.729 11.393 791 H TYR 123 H TYR 123 3.832 10.366 10.774 792 HA TYR 123 HA TYR 123 2.058 10.281 8.609 793 HB3 TYR 123 2HB TYR 123 4.571 9.453 8.991 794 HD1 TYR 123 1HD TYR 123 2.637 6.641 7.495 795 HD2 TYR 123 2HD TYR 123 5.278 7.961 10.547 796 HE1 TYR 123 1HE TYR 123 3.248 4.290 7.942 797 HE2 TYR 123 2HE TYR 123 6.023 5.588 10.992 798 HH TYR 123 HH TYR 123 4.838 2.922 8.972 799 H VAL 124 H VAL 124 2.232 8.149 11.449 800 HA VAL 124 HA VAL 124 0.457 6.162 10.456 801 HB VAL 124 HB VAL 124 1.085 6.791 13.370 802 HG11 VAL 124 1HG1 VAL 124 -0.791 5.191 13.070 803 HG12 VAL 124 2HG1 VAL 124 0.204 4.201 11.988 804 HG13 VAL 124 3HG1 VAL 124 0.640 4.375 13.698 805 HG21 VAL 124 3HG2 VAL 124 2.536 4.953 11.407 806 HG22 VAL 124 1HG2 VAL 124 3.172 6.467 12.068 807 HG23 VAL 124 2HG2 VAL 124 2.883 5.100 13.143 808 H SER 125 H SER 125 -0.101 9.012 12.684 809 HA SER 125 HA SER 125 -2.937 8.592 12.876 810 HB3 SER 125 2HB SER 125 -2.860 11.234 13.148 811 HG SER 125 HG SER 125 -3.092 9.641 14.792 812 H HIS 126 H HIS 126 -0.967 10.446 10.490 813 HA HIS 126 HA HIS 126 -3.221 11.453 9.068 814 HB3 HIS 126 2HB HIS 126 -1.298 11.580 7.241 815 HD1 HIS 126 1HD HIS 126 -2.070 14.015 6.968 816 HD2 HIS 126 2HD HIS 126 -0.743 13.027 10.835 817 HE1 HIS 126 1HE HIS 126 -2.221 16.188 8.394 818 H PHE 127 H PHE 127 -1.277 8.422 8.605 819 HA PHE 127 HA PHE 127 -2.758 7.651 6.288 820 HB3 PHE 127 2HB PHE 127 -1.390 5.861 8.322 821 HD1 PHE 127 1HD PHE 127 -1.698 6.102 4.549 822 HD2 PHE 127 2HD PHE 127 -2.559 3.773 8.097 823 HE1 PHE 127 1HE PHE 127 -2.567 4.265 3.145 824 HE2 PHE 127 2HE PHE 127 -3.448 1.959 6.665 825 HZ PHE 127 HZ PHE 127 -3.454 2.214 4.207 826 H ASN 128 H ASN 128 -3.319 6.979 9.774 827 HA ASN 128 HA ASN 128 -5.494 5.236 9.549 828 HB3 ASN 128 2HB ASN 128 -6.251 6.538 11.764 829 HD21 ASN 128 1HD2 ASN 128 -2.791 5.519 11.531 830 HD22 ASN 128 2HD2 ASN 128 -3.081 3.982 12.334 831 H GLU 129 H GLU 129 -5.722 8.803 9.918 832 HA GLU 129 HA GLU 129 -8.561 8.923 9.640 833 HB3 GLU 129 2HB GLU 129 -7.450 11.357 8.601 834 HG3 GLU 129 2HG GLU 129 -7.494 12.054 11.099 835 H TRP 130 H TRP 130 -5.988 8.931 7.212 836 HA TRP 130 HA TRP 130 -7.974 9.321 5.061 837 HB3 TRP 130 2HB TRP 130 -6.004 9.703 3.644 838 HD1 TRP 130 HD TRP 130 -4.075 11.629 5.998 839 HE1 TRP 130 1HE TRP 130 -4.974 13.932 6.416 840 HE3 TRP 130 3HE TRP 130 -8.744 11.044 3.955 841 HZ2 TRP 130 2HZ TRP 130 -7.342 15.424 5.841 842 HZ3 TRP 130 3HZ TRP 130 -10.255 13.006 3.787 843 HH2 TRP 130 HH TRP 130 -9.533 15.199 4.669 844 H ALA 131 H ALA 131 -7.593 6.733 6.727 845 HA ALA 131 HA ALA 131 -7.977 5.039 4.402 846 HB1 ALA 131 1HB ALA 131 -5.475 5.029 4.723 847 HB2 ALA 131 2HB ALA 131 -5.742 4.350 6.351 848 HB3 ALA 131 3HB ALA 131 -6.246 3.443 4.912 849 H ASP 132 H ASP 132 -9.417 5.956 7.060 850 HA ASP 132 HA ASP 132 -9.746 3.448 8.440 851 HB3 ASP 132 2HB ASP 132 -11.824 5.626 8.406 852 H GLY 133 H GLY 133 -10.436 1.713 7.316 853 HA2 GLY 133 1HA GLY 133 -12.867 1.459 5.846 854 HA3 GLY 133 2HA GLY 133 -11.599 1.910 4.716 855 H LEU 134 H LEU 134 -9.588 0.401 4.688 856 HA LEU 134 HA LEU 134 -10.610 -2.350 4.436 857 HB3 LEU 134 2HB LEU 134 -8.344 -2.757 3.424 858 HG LEU 134 HG LEU 134 -8.458 -1.596 1.346 859 HD11 LEU 134 1HD1 LEU 134 -9.903 -3.594 1.727 860 HD12 LEU 134 2HD1 LEU 134 -10.470 -2.528 0.442 861 HD13 LEU 134 3HD1 LEU 134 -11.267 -2.512 2.040 862 HD21 LEU 134 3HD2 LEU 134 -10.898 -0.041 2.258 863 HD22 LEU 134 1HD2 LEU 134 -10.012 0.062 0.717 864 HD23 LEU 134 2HD2 LEU 134 -9.250 0.625 2.204 865 H ASN 135 H ASN 135 -9.359 -4.131 5.324 866 HA ASN 135 HA ASN 135 -8.522 -3.784 8.048 867 HB3 ASN 135 2HB ASN 135 -8.565 -6.072 6.096 868 HD21 ASN 135 1HD2 ASN 135 -7.185 -7.694 6.385 869 HD22 ASN 135 2HD2 ASN 135 -6.452 -8.203 7.910 870 H VAL 136 H VAL 136 -6.619 -2.779 8.559 871 HA VAL 136 HA VAL 136 -4.220 -3.506 6.995 872 HB VAL 136 HB VAL 136 -4.414 -1.176 7.091 873 HG11 VAL 136 1HG1 VAL 136 -5.937 -0.847 8.943 874 HG12 VAL 136 2HG1 VAL 136 -4.678 -1.388 10.082 875 HG13 VAL 136 3HG1 VAL 136 -4.477 0.129 9.171 876 HG21 VAL 136 3HG2 VAL 136 -2.375 -0.479 7.974 877 HG22 VAL 136 1HG2 VAL 136 -2.383 -1.706 9.256 878 HG23 VAL 136 2HG2 VAL 136 -2.119 -2.172 7.558 879 H ILE 137 H ILE 137 -2.913 -4.938 7.675 880 HA ILE 137 HA ILE 137 -3.141 -6.044 10.384 881 HB ILE 137 HB ILE 137 -1.402 -7.661 9.589 882 HG13 ILE 137 2HG1 ILE 137 -0.483 -6.079 7.811 883 HG21 ILE 137 1HG2 ILE 137 -3.858 -8.062 9.563 884 HG22 ILE 137 2HG2 ILE 137 -3.925 -7.462 7.890 885 HG23 ILE 137 3HG2 ILE 137 -2.997 -8.930 8.298 886 HD11 ILE 137 3HD1 ILE 137 0.202 -8.403 7.837 887 HD12 ILE 137 1HD1 ILE 137 -1.191 -8.875 6.860 888 HD13 ILE 137 2HD1 ILE 137 0.038 -7.797 6.178 889 H GLY 138 H GLY 138 -1.252 -3.490 9.037 890 HA2 GLY 138 1HA GLY 138 -0.111 -2.824 11.469 891 HA3 GLY 138 2HA GLY 138 1.091 -3.806 10.627 892 H VAL 139 H VAL 139 1.441 -1.102 11.297 893 HA VAL 139 HA VAL 139 1.869 0.161 8.628 894 HB VAL 139 HB VAL 139 0.737 1.655 11.023 895 HG11 VAL 139 1HG1 VAL 139 0.639 3.564 9.467 896 HG12 VAL 139 2HG1 VAL 139 2.291 3.030 9.767 897 HG13 VAL 139 3HG1 VAL 139 1.482 2.605 8.240 898 HG21 VAL 139 3HG2 VAL 139 -1.213 2.070 9.545 899 HG22 VAL 139 1HG2 VAL 139 -0.511 0.994 8.318 900 HG23 VAL 139 2HG2 VAL 139 -1.035 0.358 9.898 901 H ALA 140 H ALA 140 4.080 -0.112 8.575 902 HA ALA 140 HA ALA 140 5.649 1.127 10.746 903 HB1 ALA 140 1HB ALA 140 5.604 -1.452 11.012 904 HB2 ALA 140 2HB ALA 140 6.710 -1.475 9.609 905 HB3 ALA 140 3HB ALA 140 7.155 -0.620 11.079 906 H ARG 141 H ARG 141 8.177 1.321 9.787 907 HA ARG 141 HA ARG 141 7.841 2.099 6.935 908 HB3 ARG 141 2HB ARG 141 8.281 3.845 8.699 909 HG3 ARG 141 2HG ARG 141 11.184 3.157 8.596 910 HD3 ARG 141 2HD ARG 141 9.670 3.864 11.110 911 HE ARG 141 HE ARG 141 12.218 4.904 9.922 912 HH11 ARG 141 1HH1 ARG 141 10.598 3.536 12.847 913 HH12 ARG 141 2HH1 ARG 141 12.133 3.006 13.484 914 HH21 ARG 141 1HH2 ARG 141 14.187 4.433 11.075 915 HH22 ARG 141 2HH2 ARG 141 14.048 3.588 12.599 916 H ASP 142 H ASP 142 9.603 1.810 5.570 917 HA ASP 142 HA ASP 142 11.108 0.562 4.452 918 HB3 ASP 142 2HB ASP 142 13.173 -0.204 5.629 919 H ASP 143 H ASP 143 12.494 -1.879 5.200 920 HA ASP 143 HA ASP 143 10.348 -3.847 4.848 921 HB3 ASP 143 2HB ASP 143 12.279 -3.894 3.380 922 H SER 144 H SER 144 11.658 -2.517 7.614 923 HA SER 144 HA SER 144 12.369 -4.910 8.954 924 HB3 SER 144 2HB SER 144 11.722 -2.684 10.753 925 HG SER 144 HG SER 144 14.152 -3.926 9.924 926 H GLU 145 H GLU 145 9.272 -4.501 8.080 927 HA GLU 145 HA GLU 145 8.638 -6.467 10.167 928 HB3 GLU 145 2HB GLU 145 6.328 -5.806 10.389 929 HG3 GLU 145 2HG GLU 145 8.022 -3.392 11.091 930 H VAL 146 H VAL 146 9.303 -6.234 6.966 931 HA VAL 146 HA VAL 146 7.054 -7.160 5.698 932 HB VAL 146 HB VAL 146 9.067 -6.434 4.537 933 HG11 VAL 146 1HG1 VAL 146 10.671 -7.710 6.160 934 HG12 VAL 146 2HG1 VAL 146 10.497 -9.039 5.031 935 HG13 VAL 146 3HG1 VAL 146 11.097 -7.454 4.466 936 HG21 VAL 146 3HG2 VAL 146 7.740 -7.800 3.107 937 HG22 VAL 146 1HG2 VAL 146 9.408 -8.282 2.844 938 HG23 VAL 146 2HG2 VAL 146 8.347 -9.319 3.795 939 H ASP 147 H ASP 147 9.204 -9.065 7.663 940 HA ASP 147 HA ASP 147 8.447 -11.560 6.548 941 HB3 ASP 147 2HB ASP 147 9.681 -10.951 9.255 942 H LYS 148 H LYS 148 6.719 -9.570 8.744 943 HA LYS 148 HA LYS 148 5.117 -11.960 9.674 944 HB3 LYS 148 2HB LYS 148 5.556 -10.453 11.555 945 HG3 LYS 148 2HG LYS 148 4.538 -8.245 9.742 946 HD3 LYS 148 2HD LYS 148 3.640 -8.195 12.206 947 HE3 LYS 148 2HE LYS 148 6.593 -7.443 12.422 948 HZ1 LYS 148 3HZ LYS 148 4.453 -6.760 14.336 949 HZ2 LYS 148 1HZ LYS 148 5.169 -5.696 13.296 950 HZ3 LYS 148 2HZ LYS 148 6.040 -6.405 14.499 951 H TRP 149 H TRP 149 5.078 -9.208 7.464 952 HA TRP 149 HA TRP 149 2.164 -9.292 7.478 953 HB3 TRP 149 2HB TRP 149 2.341 -7.563 5.684 954 HD1 TRP 149 HD TRP 149 2.031 -7.686 9.068 955 HE1 TRP 149 1HE TRP 149 2.705 -5.618 10.395 956 HE3 TRP 149 3HE TRP 149 4.722 -5.268 5.461 957 HZ2 TRP 149 2HZ TRP 149 3.984 -3.071 9.869 958 HZ3 TRP 149 3HZ TRP 149 5.688 -3.044 5.902 959 HH2 TRP 149 HH TRP 149 5.323 -1.922 8.058 960 H SER 150 H SER 150 4.571 -11.022 5.645 961 HA SER 150 HA SER 150 2.392 -11.928 3.805 962 HB3 SER 150 2HB SER 150 5.058 -12.079 2.624 963 HG SER 150 HG SER 150 3.130 -12.137 1.456 964 H LYS 151 H LYS 151 2.365 -13.251 5.956 965 HA LYS 151 HA LYS 151 3.910 -15.762 5.614 966 HB3 LYS 151 2HB LYS 151 3.276 -16.187 7.935 967 HG3 LYS 151 2HG LYS 151 4.328 -13.361 7.766 968 HD3 LYS 151 2HD LYS 151 5.622 -14.172 9.739 969 HE3 LYS 151 2HE LYS 151 2.589 -14.402 9.911 970 HZ1 LYS 151 3HZ LYS 151 3.366 -15.630 11.704 971 HZ2 LYS 151 1HZ LYS 151 3.068 -14.109 12.340 972 HZ3 LYS 151 2HZ LYS 151 4.609 -14.635 12.020 Start of MODEL 2 1 H1 GLY 1 H GLY 1 -10.246 -25.042 -1.018 2 HA2 GLY 1 1HA GLY 1 -8.625 -23.258 -1.218 3 HA3 GLY 1 2HA GLY 1 -7.840 -24.722 -0.606 4 H MET 2 H MET 2 -8.492 -22.792 -3.511 5 HA MET 2 HA MET 2 -5.731 -22.843 -4.120 6 HB3 MET 2 2HB MET 2 -5.919 -24.694 -5.500 7 HG3 MET 2 2HG MET 2 -8.539 -23.678 -6.641 8 HE1 MET 2 3HE MET 2 -10.025 -25.508 -7.972 9 HE2 MET 2 1HE MET 2 -9.344 -26.984 -8.702 10 HE3 MET 2 2HE MET 2 -9.512 -26.860 -6.939 11 H ALA 3 H ALA 3 -6.396 -20.830 -3.206 12 HA ALA 3 HA ALA 3 -6.679 -18.880 -5.286 13 HB1 ALA 3 1HB ALA 3 -8.559 -17.638 -4.221 14 HB2 ALA 3 2HB ALA 3 -9.079 -19.190 -4.915 15 HB3 ALA 3 3HB ALA 3 -8.862 -19.031 -3.163 16 H LYS 4 H LYS 4 -4.566 -18.458 -4.557 17 HA LYS 4 HA LYS 4 -4.507 -16.581 -2.333 18 HB3 LYS 4 2HB LYS 4 -3.575 -18.835 -1.444 19 HG3 LYS 4 2HG LYS 4 -1.125 -19.125 -1.788 20 HD3 LYS 4 2HD LYS 4 -3.041 -19.922 -3.862 21 HE3 LYS 4 2HE LYS 4 -0.088 -19.781 -4.619 22 HZ1 LYS 4 3HZ LYS 4 -1.319 -21.606 -5.671 23 HZ2 LYS 4 1HZ LYS 4 -1.011 -20.431 -6.772 24 HZ3 LYS 4 2HZ LYS 4 -2.503 -20.550 -6.149 25 H LYS 5 H LYS 5 -2.963 -14.938 -2.768 26 HA LYS 5 HA LYS 5 -0.845 -15.159 -4.603 27 HB3 LYS 5 2HB LYS 5 -1.285 -13.419 -6.182 28 HG3 LYS 5 2HG LYS 5 -3.924 -14.821 -6.130 29 HD3 LYS 5 2HD LYS 5 -2.371 -13.545 -8.420 30 HE3 LYS 5 2HE LYS 5 -4.953 -15.145 -8.236 31 HZ1 LYS 5 3HZ LYS 5 -5.349 -13.215 -9.566 32 HZ2 LYS 5 1HZ LYS 5 -5.283 -14.550 -10.543 33 HZ3 LYS 5 2HZ LYS 5 -4.044 -13.458 -10.495 34 H THR 6 H THR 6 0.218 -12.982 -4.683 35 HA THR 6 HA THR 6 -0.713 -11.073 -2.614 36 HB THR 6 HB THR 6 2.114 -11.999 -3.173 37 HG1 THR 6 1HG THR 6 0.886 -13.216 -1.641 38 HG21 THR 6 3HG2 THR 6 1.151 -9.635 -1.493 39 HG22 THR 6 1HG2 THR 6 2.186 -9.547 -2.929 40 HG23 THR 6 2HG2 THR 6 2.802 -10.283 -1.446 41 H LEU 7 H LEU 7 -0.807 -8.991 -3.385 42 HA LEU 7 HA LEU 7 0.705 -8.318 -5.905 43 HB3 LEU 7 2HB LEU 7 -1.939 -7.257 -4.871 44 HG LEU 7 HG LEU 7 -0.691 -5.395 -5.898 45 HD11 LEU 7 1HD1 LEU 7 -0.573 -7.138 -8.402 46 HD12 LEU 7 2HD1 LEU 7 0.835 -6.669 -7.438 47 HD13 LEU 7 3HD1 LEU 7 -0.076 -5.432 -8.280 48 HD21 LEU 7 3HD2 LEU 7 -2.888 -6.513 -7.670 49 HD22 LEU 7 1HD2 LEU 7 -2.440 -4.825 -7.558 50 HD23 LEU 7 2HD2 LEU 7 -3.148 -5.625 -6.151 51 H ILE 8 H ILE 8 2.029 -6.498 -5.813 52 HA ILE 8 HA ILE 8 2.024 -4.924 -3.265 53 HB ILE 8 HB ILE 8 4.407 -5.718 -4.972 54 HG13 ILE 8 2HG1 ILE 8 3.463 -7.684 -3.772 55 HG21 ILE 8 1HG2 ILE 8 5.803 -4.765 -3.344 56 HG22 ILE 8 2HG2 ILE 8 4.650 -3.541 -3.819 57 HG23 ILE 8 3HG2 ILE 8 4.453 -4.414 -2.256 58 HD11 ILE 8 3HD1 ILE 8 5.345 -8.447 -2.529 59 HD12 ILE 8 1HD1 ILE 8 5.903 -7.569 -3.967 60 HD13 ILE 8 2HD1 ILE 8 5.989 -6.808 -2.354 61 H LEU 9 H LEU 9 1.265 -2.919 -3.647 62 HA LEU 9 HA LEU 9 1.689 -1.593 -6.297 63 HB3 LEU 9 2HB LEU 9 -0.398 -0.368 -5.748 64 HG LEU 9 HG LEU 9 -0.918 -3.338 -5.407 65 HD11 LEU 9 1HD1 LEU 9 -2.682 -1.092 -6.414 66 HD12 LEU 9 2HD1 LEU 9 -2.789 -1.908 -4.832 67 HD13 LEU 9 3HD1 LEU 9 -3.109 -2.820 -6.324 68 HD21 LEU 9 3HD2 LEU 9 -0.335 -1.645 -7.859 69 HD22 LEU 9 1HD2 LEU 9 -1.332 -3.087 -7.996 70 HD23 LEU 9 2HD2 LEU 9 0.313 -3.243 -7.369 71 H TYR 10 H TYR 10 3.364 -0.036 -5.971 72 HA TYR 10 HA TYR 10 3.096 1.580 -3.467 73 HB3 TYR 10 2HB TYR 10 4.886 -0.212 -3.196 74 HD1 TYR 10 1HD TYR 10 5.179 -0.043 -6.368 75 HD2 TYR 10 2HD TYR 10 7.631 1.059 -2.980 76 HE1 TYR 10 1HE TYR 10 7.135 0.039 -7.850 77 HE2 TYR 10 2HE TYR 10 9.529 1.343 -4.534 78 HH TYR 10 HH TYR 10 9.268 1.182 -8.021 79 H TYR 11 H TYR 11 4.234 3.576 -3.425 80 HA TYR 11 HA TYR 11 4.759 4.729 -6.090 81 HB3 TYR 11 2HB TYR 11 3.889 6.166 -3.601 82 HD1 TYR 11 1HD TYR 11 5.213 6.496 -7.165 83 HD2 TYR 11 2HD TYR 11 3.583 8.532 -3.730 84 HE1 TYR 11 1HE TYR 11 5.842 8.618 -8.151 85 HE2 TYR 11 2HE TYR 11 4.136 10.725 -4.803 86 HH TYR 11 HH TYR 11 5.830 11.004 -7.918 87 H SER 12 H SER 12 6.922 4.578 -6.419 88 HA SER 12 HA SER 12 8.911 5.423 -4.387 89 HB3 SER 12 2HB SER 12 9.770 3.653 -5.621 90 HG SER 12 HG SER 12 8.672 4.882 -7.943 91 H TRP 13 H TRP 13 9.434 7.547 -4.226 92 HA TRP 13 HA TRP 13 8.268 9.557 -5.858 93 HB3 TRP 13 2HB TRP 13 10.768 9.976 -4.223 94 HD1 TRP 13 HD TRP 13 8.457 11.645 -2.353 95 HE1 TRP 13 1HE TRP 13 8.025 14.059 -2.973 96 HE3 TRP 13 3HE TRP 13 10.588 11.747 -7.062 97 HZ2 TRP 13 2HZ TRP 13 8.684 15.875 -5.110 98 HZ3 TRP 13 3HZ TRP 13 10.706 13.834 -8.309 99 HH2 TRP 13 HH TRP 13 9.748 15.937 -7.354 100 H SER 14 H SER 14 11.882 9.200 -5.634 101 HA SER 14 HA SER 14 11.926 8.754 -8.590 102 HB3 SER 14 2HB SER 14 14.097 10.117 -8.538 103 HG SER 14 HG SER 14 12.985 11.727 -9.278 104 H GLY 15 H GLY 15 13.389 8.052 -5.423 105 HA2 GLY 15 1HA GLY 15 14.326 5.583 -6.620 106 HA3 GLY 15 2HA GLY 15 15.643 6.666 -6.204 107 H GLU 16 H GLU 16 13.231 7.164 -3.922 108 HA GLU 16 HA GLU 16 14.636 5.668 -1.844 109 HB3 GLU 16 2HB GLU 16 13.745 7.570 -0.828 110 HG3 GLU 16 2HG GLU 16 11.403 8.494 -1.314 111 H THR 17 H THR 17 11.101 5.589 -2.259 112 HA THR 17 HA THR 17 10.852 3.356 -0.826 113 HB THR 17 HB THR 17 8.988 3.821 -3.106 114 HG1 THR 17 1HG THR 17 8.130 5.632 -2.116 115 HG21 THR 17 3HG2 THR 17 8.410 3.653 -0.117 116 HG22 THR 17 1HG2 THR 17 8.394 2.272 -1.230 117 HG23 THR 17 2HG2 THR 17 7.226 3.569 -1.451 118 H LYS 18 H LYS 18 12.089 3.467 -4.027 119 HA LYS 18 HA LYS 18 11.425 1.000 -5.184 120 HB3 LYS 18 2HB LYS 18 12.835 2.984 -6.129 121 HG3 LYS 18 2HG LYS 18 15.031 1.017 -5.355 122 HD3 LYS 18 2HD LYS 18 15.074 3.699 -6.745 123 HE3 LYS 18 2HE LYS 18 17.517 2.008 -6.254 124 HZ1 LYS 18 3HZ LYS 18 17.320 4.266 -7.516 125 HZ2 LYS 18 1HZ LYS 18 18.625 3.977 -6.565 126 HZ3 LYS 18 2HZ LYS 18 17.425 4.917 -5.990 127 H LYS 19 H LYS 19 14.051 1.707 -2.704 128 HA LYS 19 HA LYS 19 14.869 -1.078 -2.935 129 HB3 LYS 19 2HB LYS 19 15.411 0.770 -0.576 130 HG3 LYS 19 2HG LYS 19 16.587 -1.854 -1.566 131 HD3 LYS 19 2HD LYS 19 18.341 -1.607 0.148 132 HE3 LYS 19 2HE LYS 19 19.873 -0.161 -0.937 133 HZ1 LYS 19 3HZ LYS 19 18.032 -0.886 -3.127 134 HZ2 LYS 19 1HZ LYS 19 18.991 -2.001 -2.396 135 HZ3 LYS 19 2HZ LYS 19 19.636 -0.711 -3.217 136 H MET 20 H MET 20 12.553 0.586 -0.916 137 HA MET 20 HA MET 20 11.922 -1.639 0.779 138 HB3 MET 20 2HB MET 20 10.096 0.729 0.236 139 HG3 MET 20 2HG MET 20 9.421 -0.656 2.095 140 HE1 MET 20 3HE MET 20 13.627 -0.342 4.057 141 HE2 MET 20 1HE MET 20 13.374 0.043 2.341 142 HE3 MET 20 2HE MET 20 12.680 1.076 3.613 143 H ALA 21 H ALA 21 11.270 -1.190 -2.548 144 HA ALA 21 HA ALA 21 8.718 -2.650 -2.480 145 HB1 ALA 21 1HB ALA 21 10.167 -1.108 -4.524 146 HB2 ALA 21 2HB ALA 21 9.552 -2.651 -5.106 147 HB3 ALA 21 3HB ALA 21 8.448 -1.508 -4.350 148 H GLU 22 H GLU 22 11.911 -2.988 -4.047 149 HA GLU 22 HA GLU 22 11.546 -5.623 -4.746 150 HB3 GLU 22 2HB GLU 22 13.236 -4.662 -6.009 151 HG3 GLU 22 2HG GLU 22 14.193 -3.426 -3.420 152 H LYS 23 H LYS 23 13.276 -4.396 -1.798 153 HA LYS 23 HA LYS 23 14.295 -6.910 -0.941 154 HB3 LYS 23 2HB LYS 23 13.456 -4.522 0.729 155 HG3 LYS 23 2HG LYS 23 14.812 -7.170 1.379 156 HD3 LYS 23 2HD LYS 23 15.258 -5.971 3.633 157 HE3 LYS 23 2HE LYS 23 17.201 -5.573 1.321 158 HZ1 LYS 23 3HZ LYS 23 18.842 -5.872 3.014 159 HZ2 LYS 23 1HZ LYS 23 17.731 -6.108 4.184 160 HZ3 LYS 23 2HZ LYS 23 17.867 -4.618 3.472 161 H ILE 24 H ILE 24 11.026 -5.653 -0.800 162 HA ILE 24 HA ILE 24 10.167 -7.816 1.021 163 HB ILE 24 HB ILE 24 8.628 -5.623 -0.402 164 HG13 ILE 24 2HG1 ILE 24 10.224 -4.539 1.026 165 HG21 ILE 24 1HG2 ILE 24 7.808 -7.303 2.002 166 HG22 ILE 24 2HG2 ILE 24 6.844 -6.088 1.154 167 HG23 ILE 24 3HG2 ILE 24 7.248 -7.595 0.347 168 HD11 ILE 24 3HD1 ILE 24 7.860 -3.684 1.287 169 HD12 ILE 24 1HD1 ILE 24 7.739 -4.682 2.744 170 HD13 ILE 24 2HD1 ILE 24 8.949 -3.392 2.660 171 H ASN 25 H ASN 25 9.656 -6.738 -2.404 172 HA ASN 25 HA ASN 25 7.830 -8.804 -3.053 173 HB3 ASN 25 2HB ASN 25 9.741 -7.203 -4.771 174 HD21 ASN 25 1HD2 ASN 25 6.740 -9.415 -5.004 175 HD22 ASN 25 2HD2 ASN 25 7.114 -9.775 -6.644 176 H SER 26 H SER 26 11.438 -8.829 -3.291 177 HA SER 26 HA SER 26 11.585 -11.393 -4.577 178 HB3 SER 26 2HB SER 26 13.890 -11.382 -3.586 179 HG SER 26 HG SER 26 12.875 -9.151 -5.018 180 H GLU 27 H GLU 27 10.670 -10.501 -1.293 181 HA GLU 27 HA GLU 27 11.506 -13.095 -0.187 182 HB3 GLU 27 2HB GLU 27 10.927 -11.858 2.003 183 HG3 GLU 27 2HG GLU 27 12.831 -10.197 1.813 184 H ILE 28 H ILE 28 8.766 -12.124 -1.777 185 HA ILE 28 HA ILE 28 7.042 -13.766 0.031 186 HB ILE 28 HB ILE 28 6.135 -11.302 -1.513 187 HG13 ILE 28 2HG1 ILE 28 7.348 -10.544 0.416 188 HG21 ILE 28 1HG2 ILE 28 4.624 -13.280 0.265 189 HG22 ILE 28 2HG2 ILE 28 3.936 -11.784 -0.377 190 HG23 ILE 28 3HG2 ILE 28 4.405 -13.033 -1.479 191 HD11 ILE 28 3HD1 ILE 28 5.756 -9.622 1.950 192 HD12 ILE 28 1HD1 ILE 28 5.002 -9.616 0.333 193 HD13 ILE 28 2HD1 ILE 28 4.563 -10.860 1.533 194 H LYS 29 H LYS 29 6.074 -15.434 -0.921 195 HA LYS 29 HA LYS 29 6.680 -16.042 -3.679 196 HB3 LYS 29 2HB LYS 29 5.105 -17.419 -1.467 197 HG3 LYS 29 2HG LYS 29 4.604 -18.329 -3.753 198 HD3 LYS 29 2HD LYS 29 6.167 -20.148 -4.480 199 HE3 LYS 29 2HE LYS 29 7.475 -17.414 -4.666 200 HZ1 LYS 29 3HZ LYS 29 8.995 -19.128 -5.192 201 HZ2 LYS 29 1HZ LYS 29 8.525 -18.384 -6.592 202 HZ3 LYS 29 2HZ LYS 29 7.921 -19.871 -6.216 203 H ASP 30 H ASP 30 5.041 -16.553 -5.214 204 HA ASP 30 HA ASP 30 3.402 -15.905 -6.604 205 HB3 ASP 30 2HB ASP 30 1.310 -16.037 -4.474 206 H SER 31 H SER 31 4.802 -13.674 -5.262 207 HA SER 31 HA SER 31 2.709 -11.616 -5.135 208 HB3 SER 31 2HB SER 31 4.349 -11.729 -3.288 209 HG SER 31 HG SER 31 6.328 -12.165 -3.956 210 H GLU 32 H GLU 32 3.314 -9.489 -6.176 211 HA GLU 32 HA GLU 32 5.031 -9.591 -8.507 212 HB3 GLU 32 2HB GLU 32 2.112 -8.630 -8.678 213 HG3 GLU 32 2HG GLU 32 4.453 -8.822 -10.554 214 H LEU 33 H LEU 33 5.329 -7.330 -9.213 215 HA LEU 33 HA LEU 33 4.882 -5.284 -7.123 216 HB3 LEU 33 2HB LEU 33 7.079 -4.550 -8.733 217 HG LEU 33 HG LEU 33 7.051 -5.790 -6.009 218 HD11 LEU 33 1HD1 LEU 33 9.376 -4.914 -5.708 219 HD12 LEU 33 2HD1 LEU 33 9.319 -4.168 -7.310 220 HD13 LEU 33 3HD1 LEU 33 9.337 -5.930 -7.156 221 HD21 LEU 33 3HD2 LEU 33 7.376 -2.861 -6.686 222 HD22 LEU 33 1HD2 LEU 33 7.398 -3.619 -5.074 223 HD23 LEU 33 2HD2 LEU 33 5.900 -3.612 -6.034 224 H LYS 34 H LYS 34 3.845 -3.566 -7.856 225 HA LYS 34 HA LYS 34 4.001 -2.802 -10.706 226 HB3 LYS 34 2HB LYS 34 1.585 -2.074 -10.644 227 HG3 LYS 34 2HG LYS 34 1.887 -5.105 -10.404 228 HD3 LYS 34 2HD LYS 34 -0.267 -3.246 -11.486 229 HE3 LYS 34 2HE LYS 34 0.201 -4.988 -13.164 230 HZ1 LYS 34 3HZ LYS 34 -0.652 -7.218 -12.598 231 HZ2 LYS 34 1HZ LYS 34 -0.471 -6.927 -11.015 232 HZ3 LYS 34 2HZ LYS 34 0.828 -6.941 -12.044 233 H GLU 35 H GLU 35 3.384 -0.422 -10.874 234 HA GLU 35 HA GLU 35 3.972 1.031 -8.337 235 HB3 GLU 35 2HB GLU 35 5.985 0.867 -9.742 236 HG3 GLU 35 2HG GLU 35 4.503 2.611 -11.757 237 H VAL 36 H VAL 36 3.311 3.256 -8.264 238 HA VAL 36 HA VAL 36 0.975 3.903 -10.008 239 HB VAL 36 HB VAL 36 1.393 4.565 -7.061 240 HG11 VAL 36 1HG1 VAL 36 -1.037 4.799 -8.917 241 HG12 VAL 36 2HG1 VAL 36 -1.068 5.066 -7.159 242 HG13 VAL 36 3HG1 VAL 36 -0.138 6.146 -8.181 243 HG21 VAL 36 3HG2 VAL 36 -0.108 2.278 -8.417 244 HG22 VAL 36 1HG2 VAL 36 1.091 2.191 -7.103 245 HG23 VAL 36 2HG2 VAL 36 -0.514 2.837 -6.785 246 H LYS 37 H LYS 37 0.706 6.095 -10.632 247 HA LYS 37 HA LYS 37 2.692 8.074 -9.770 248 HB3 LYS 37 2HB LYS 37 3.541 7.374 -11.900 249 HG3 LYS 37 2HG LYS 37 1.884 8.219 -13.904 250 HD3 LYS 37 2HD LYS 37 1.221 5.716 -14.169 251 HE3 LYS 37 2HE LYS 37 3.521 4.942 -14.656 252 HZ1 LYS 37 3HZ LYS 37 3.976 6.441 -16.350 253 HZ2 LYS 37 1HZ LYS 37 3.326 7.731 -15.601 254 HZ3 LYS 37 2HZ LYS 37 2.327 6.560 -16.160 255 H VAL 38 H VAL 38 1.866 10.294 -10.354 256 HA VAL 38 HA VAL 38 -1.008 10.507 -9.693 257 HB VAL 38 HB VAL 38 -0.215 12.705 -8.636 258 HG11 VAL 38 1HG1 VAL 38 0.486 11.697 -6.554 259 HG12 VAL 38 2HG1 VAL 38 -0.839 10.783 -7.270 260 HG13 VAL 38 3HG1 VAL 38 0.821 10.151 -7.367 261 HG21 VAL 38 3HG2 VAL 38 2.036 13.120 -8.178 262 HG22 VAL 38 1HG2 VAL 38 2.554 11.460 -8.548 263 HG23 VAL 38 2HG2 VAL 38 2.090 12.575 -9.844 264 H SER 39 H SER 39 -1.270 13.254 -10.135 265 HA SER 39 HA SER 39 -1.093 13.596 -13.039 266 HB3 SER 39 2HB SER 39 -1.742 15.843 -11.295 267 HG SER 39 HG SER 39 -3.375 14.838 -13.321 268 H GLU 40 H GLU 40 -0.193 15.761 -13.607 269 HA GLU 40 HA GLU 40 2.516 16.110 -12.370 270 HB3 GLU 40 2HB GLU 40 2.772 17.580 -14.595 271 HG3 GLU 40 2HG GLU 40 3.000 14.560 -14.307 272 H GLY 41 H GLY 41 3.245 18.352 -12.189 273 HA2 GLY 41 1HA GLY 41 3.006 20.456 -11.417 274 HA3 GLY 41 2HA GLY 41 1.403 20.524 -12.176 275 H THR 42 H THR 42 1.695 17.874 -9.850 276 HA THR 42 HA THR 42 -0.230 19.208 -8.124 277 HB THR 42 HB THR 42 1.140 16.485 -7.936 278 HG1 THR 42 1HG THR 42 -0.351 17.259 -9.825 279 HG21 THR 42 3HG2 THR 42 -0.053 17.280 -5.854 280 HG22 THR 42 1HG2 THR 42 -0.704 15.794 -6.570 281 HG23 THR 42 2HG2 THR 42 -1.546 17.345 -6.803 282 H PHE 43 H PHE 43 3.213 17.997 -8.043 283 HA PHE 43 HA PHE 43 3.767 20.008 -6.018 284 HB3 PHE 43 2HB PHE 43 3.093 18.673 -4.501 285 HD1 PHE 43 2HD PHE 43 4.986 16.308 -6.635 286 HD2 PHE 43 1HD PHE 43 1.747 17.048 -3.994 287 HE1 PHE 43 2HE PHE 43 4.179 13.924 -6.998 288 HE2 PHE 43 1HE PHE 43 0.812 14.744 -4.428 289 HZ PHE 43 HZ PHE 43 2.105 13.169 -5.877 290 H ASP 44 H ASP 44 6.081 19.350 -5.079 291 HA ASP 44 HA ASP 44 8.072 19.437 -7.255 292 HB3 ASP 44 2HB ASP 44 7.887 21.306 -4.844 293 H ALA 45 H ALA 45 10.275 19.341 -5.871 294 HA ALA 45 HA ALA 45 10.058 17.290 -3.716 295 HB1 ALA 45 1HB ALA 45 12.449 16.991 -4.106 296 HB2 ALA 45 2HB ALA 45 11.543 16.785 -5.619 297 HB3 ALA 45 3HB ALA 45 12.439 18.299 -5.315 298 H ASP 46 H ASP 46 9.307 20.273 -3.444 299 HA ASP 46 HA ASP 46 11.503 21.567 -2.186 300 HB3 ASP 46 2HB ASP 46 8.602 22.372 -2.007 301 H MET 47 H MET 47 10.758 22.731 0.032 302 HA MET 47 HA MET 47 9.894 20.671 2.008 303 HB3 MET 47 2HB MET 47 12.356 20.820 1.884 304 HG3 MET 47 2HG MET 47 12.018 23.613 3.024 305 HE1 MET 47 3HE MET 47 14.726 22.765 0.461 306 HE2 MET 47 1HE MET 47 16.026 22.007 1.405 307 HE3 MET 47 2HE MET 47 14.502 21.143 1.153 308 H TYR 48 H TYR 48 9.705 24.004 0.887 309 HA TYR 48 HA TYR 48 7.964 24.660 3.191 310 HB3 TYR 48 2HB TYR 48 9.863 26.072 3.217 311 HD1 TYR 48 1HD TYR 48 11.796 25.569 1.784 312 HD2 TYR 48 2HD TYR 48 8.460 27.906 0.333 313 HE1 TYR 48 1HE TYR 48 13.100 26.177 -0.220 314 HE2 TYR 48 2HE TYR 48 9.772 28.560 -1.633 315 HH TYR 48 HH TYR 48 12.779 26.930 -2.493 316 H LYS 49 H LYS 49 8.331 24.562 -0.370 317 HA LYS 49 HA LYS 49 5.753 25.846 -0.782 318 HB3 LYS 49 2HB LYS 49 7.071 23.912 -2.730 319 HG3 LYS 49 2HG LYS 49 4.839 25.153 -3.212 320 HD3 LYS 49 2HD LYS 49 6.884 27.405 -3.616 321 HE3 LYS 49 2HE LYS 49 3.922 27.241 -4.308 322 HZ1 LYS 49 3HZ LYS 49 5.869 29.397 -4.845 323 HZ2 LYS 49 1HZ LYS 49 4.653 29.488 -3.749 324 HZ3 LYS 49 2HZ LYS 49 4.320 29.355 -5.363 325 H THR 50 H THR 50 6.813 22.413 -0.879 326 HA THR 50 HA THR 50 4.338 21.314 -1.577 327 HB THR 50 HB THR 50 5.485 19.185 -0.780 328 HG1 THR 50 1HG THR 50 7.872 19.776 -0.313 329 HG21 THR 50 3HG2 THR 50 7.405 19.472 -2.405 330 HG22 THR 50 1HG2 THR 50 6.799 21.106 -2.718 331 HG23 THR 50 2HG2 THR 50 5.747 19.703 -3.011 332 H SER 51 H SER 51 5.739 21.860 1.640 333 HA SER 51 HA SER 51 3.895 20.448 3.161 334 HB3 SER 51 2HB SER 51 4.992 23.124 4.056 335 HG SER 51 HG SER 51 5.494 21.621 5.904 336 H ASP 52 H ASP 52 3.474 23.573 1.497 337 HA ASP 52 HA ASP 52 0.921 24.211 2.760 338 HB3 ASP 52 2HB ASP 52 1.932 25.288 0.114 339 H ILE 53 H ILE 53 2.062 22.733 -0.276 340 HA ILE 53 HA ILE 53 -0.404 22.609 -1.675 341 HB ILE 53 HB ILE 53 1.890 20.611 -1.834 342 HG13 ILE 53 2HG1 ILE 53 2.736 22.900 -2.147 343 HG21 ILE 53 1HG2 ILE 53 -0.644 20.633 -3.200 344 HG22 ILE 53 2HG2 ILE 53 0.589 21.034 -4.365 345 HG23 ILE 53 3HG2 ILE 53 0.736 19.554 -3.439 346 HD11 ILE 53 3HD1 ILE 53 2.769 21.741 -4.916 347 HD12 ILE 53 1HD1 ILE 53 4.070 22.541 -4.012 348 HD13 ILE 53 2HD1 ILE 53 3.590 20.888 -3.594 349 H ALA 54 H ALA 54 1.203 20.256 0.516 350 HA ALA 54 HA ALA 54 -0.894 18.289 0.439 351 HB1 ALA 54 1HB ALA 54 1.218 18.907 2.526 352 HB2 ALA 54 2HB ALA 54 0.170 17.457 2.518 353 HB3 ALA 54 3HB ALA 54 1.330 17.734 1.209 354 H LEU 55 H LEU 55 -0.224 21.008 2.702 355 HA LEU 55 HA LEU 55 -2.338 20.545 4.449 356 HB3 LEU 55 2HB LEU 55 -1.162 23.222 3.648 357 HG LEU 55 HG LEU 55 -3.084 23.318 5.256 358 HD11 LEU 55 1HD1 LEU 55 -2.645 22.505 7.614 359 HD12 LEU 55 2HD1 LEU 55 -1.205 21.670 7.008 360 HD13 LEU 55 3HD1 LEU 55 -2.812 21.172 6.468 361 HD21 LEU 55 3HD2 LEU 55 -1.283 24.995 5.268 362 HD22 LEU 55 1HD2 LEU 55 -0.331 23.973 6.366 363 HD23 LEU 55 2HD2 LEU 55 -1.864 24.697 6.915 364 H ASP 56 H ASP 56 -2.401 22.358 1.375 365 HA ASP 56 HA ASP 56 -5.034 23.403 1.550 366 HB3 ASP 56 2HB ASP 56 -4.528 22.589 -1.169 367 H GLN 57 H GLN 57 -3.844 20.205 0.656 368 HA GLN 57 HA GLN 57 -6.520 19.226 -0.106 369 HB3 GLN 57 2HB GLN 57 -5.335 17.310 -1.039 370 HG3 GLN 57 2HG GLN 57 -4.272 20.084 -1.790 371 HE21 GLN 57 1HE2 GLN 57 -5.149 17.112 -3.574 372 HE22 GLN 57 2HE2 GLN 57 -3.768 17.238 -4.683 373 H ILE 58 H ILE 58 -5.383 19.818 2.728 374 HA ILE 58 HA ILE 58 -6.492 17.341 3.978 375 HB ILE 58 HB ILE 58 -4.341 19.268 4.933 376 HG13 ILE 58 2HG1 ILE 58 -3.812 17.219 3.365 377 HG21 ILE 58 1HG2 ILE 58 -5.764 18.807 6.874 378 HG22 ILE 58 2HG2 ILE 58 -5.677 17.062 6.564 379 HG23 ILE 58 3HG2 ILE 58 -4.235 17.971 7.051 380 HD11 ILE 58 3HD1 ILE 58 -1.710 16.761 4.494 381 HD12 ILE 58 1HD1 ILE 58 -2.060 18.488 4.589 382 HD13 ILE 58 2HD1 ILE 58 -2.328 17.465 6.000 383 H GLN 59 H GLN 59 -6.177 20.915 4.211 384 HA GLN 59 HA GLN 59 -7.988 21.057 6.423 385 HB3 GLN 59 2HB GLN 59 -7.596 23.566 6.069 386 HG3 GLN 59 2HG GLN 59 -5.059 21.906 6.184 387 HE21 GLN 59 1HE2 GLN 59 -5.226 24.604 5.196 388 HE22 GLN 59 2HE2 GLN 59 -4.651 25.723 6.401 389 H GLY 60 H GLY 60 -8.971 20.602 3.281 390 HA2 GLY 60 1HA GLY 60 -11.244 20.563 2.737 391 HA3 GLY 60 2HA GLY 60 -11.561 21.986 3.742 392 H ASN 61 H ASN 61 -8.807 22.868 2.231 393 HA ASN 61 HA ASN 61 -10.201 24.706 0.530 394 HB3 ASN 61 2HB ASN 61 -7.951 25.374 -0.252 395 HD21 ASN 61 1HD2 ASN 61 -5.887 25.447 1.956 396 HD22 ASN 61 2HD2 ASN 61 -6.696 26.574 3.017 397 H LYS 62 H LYS 62 -8.317 21.769 -0.148 398 HA LYS 62 HA LYS 62 -9.199 21.792 -2.993 399 HB3 LYS 62 2HB LYS 62 -6.745 20.790 -3.229 400 HG3 LYS 62 2HG LYS 62 -5.816 23.211 -3.290 401 HD3 LYS 62 2HD LYS 62 -8.144 22.312 -5.030 402 HE3 LYS 62 2HE LYS 62 -7.236 24.653 -5.498 403 HZ1 LYS 62 3HZ LYS 62 -5.090 24.397 -6.833 404 HZ2 LYS 62 1HZ LYS 62 -4.819 23.015 -5.953 405 HZ3 LYS 62 2HZ LYS 62 -4.950 24.465 -5.209 406 H ASP 63 H ASP 63 -8.506 19.669 -4.062 407 HA ASP 63 HA ASP 63 -10.023 17.578 -2.651 408 HB3 ASP 63 2HB ASP 63 -9.206 17.839 -5.584 409 H PHE 64 H PHE 64 -9.345 15.247 -3.424 410 HA PHE 64 HA PHE 64 -6.680 14.744 -2.552 411 HB3 PHE 64 2HB PHE 64 -8.365 13.064 -2.260 412 HD1 PHE 64 2HD PHE 64 -7.730 12.588 -5.976 413 HD2 PHE 64 1HD PHE 64 -10.617 12.794 -2.788 414 HE1 PHE 64 2HE PHE 64 -9.524 11.965 -7.553 415 HE2 PHE 64 1HE PHE 64 -12.411 12.156 -4.379 416 HZ PHE 64 HZ PHE 64 -11.871 11.750 -6.762 417 HA PRO 65 HA PRO 65 -4.576 15.054 -6.521 418 HB3 PRO 65 2HB PRO 65 -2.580 15.050 -5.312 419 HG3 PRO 65 2HG PRO 65 -2.276 13.648 -3.438 420 HD3 PRO 65 2HD PRO 65 -4.286 14.680 -2.855 421 H GLU 66 H GLU 66 -4.856 13.910 -8.411 422 HA GLU 66 HA GLU 66 -6.265 11.365 -8.297 423 HB3 GLU 66 2HB GLU 66 -6.103 11.533 -10.795 424 HG3 GLU 66 2HG GLU 66 -7.038 14.140 -9.555 425 H ILE 67 H ILE 67 -5.538 9.474 -9.509 426 HA ILE 67 HA ILE 67 -2.637 9.059 -9.598 427 HB ILE 67 HB ILE 67 -2.809 6.887 -8.541 428 HG13 ILE 67 2HG1 ILE 67 -5.142 6.334 -9.077 429 HG21 ILE 67 1HG2 ILE 67 -2.268 8.897 -7.171 430 HG22 ILE 67 2HG2 ILE 67 -3.965 8.994 -6.664 431 HG23 ILE 67 3HG2 ILE 67 -2.974 7.591 -6.221 432 HD11 ILE 67 3HD1 ILE 67 -4.769 6.181 -6.107 433 HD12 ILE 67 1HD1 ILE 67 -5.836 5.202 -7.138 434 HD13 ILE 67 2HD1 ILE 67 -4.073 5.063 -7.320 435 H GLN 68 H GLN 68 -2.045 7.741 -11.249 436 HA GLN 68 HA GLN 68 -4.172 7.348 -13.269 437 HB3 GLN 68 2HB GLN 68 -2.544 7.654 -14.924 438 HG3 GLN 68 2HG GLN 68 -1.074 9.528 -14.334 439 HE21 GLN 68 1HE2 GLN 68 -1.767 11.746 -13.476 440 HE22 GLN 68 2HE2 GLN 68 -3.492 12.128 -13.569 441 H LEU 69 H LEU 69 -3.774 5.467 -11.117 442 HA LEU 69 HA LEU 69 -2.503 3.081 -12.164 443 HB3 LEU 69 2HB LEU 69 -4.627 3.259 -9.981 444 HG LEU 69 HG LEU 69 -4.076 0.921 -10.362 445 HD11 LEU 69 1HD1 LEU 69 -1.672 0.130 -10.122 446 HD12 LEU 69 2HD1 LEU 69 -1.161 1.814 -10.348 447 HD13 LEU 69 3HD1 LEU 69 -2.028 0.954 -11.631 448 HD21 LEU 69 3HD2 LEU 69 -4.247 1.595 -8.064 449 HD22 LEU 69 1HD2 LEU 69 -2.562 2.153 -8.012 450 HD23 LEU 69 2HD2 LEU 69 -2.932 0.433 -8.167 451 H ASP 70 H ASP 70 -3.691 1.071 -12.702 452 HA ASP 70 HA ASP 70 -5.825 1.525 -14.657 453 HB3 ASP 70 2HB ASP 70 -5.614 -1.078 -14.748 454 H ASN 71 H ASN 71 -7.793 0.116 -14.565 455 HA ASN 71 HA ASN 71 -8.822 -0.517 -11.869 456 HB3 ASN 71 2HB ASN 71 -9.867 -1.260 -14.618 457 HD21 ASN 71 1HD2 ASN 71 -10.232 -3.486 -13.629 458 HD22 ASN 71 2HD2 ASN 71 -11.559 -3.686 -12.517 459 H ILE 72 H ILE 72 -8.313 -2.367 -10.989 460 HA ILE 72 HA ILE 72 -7.498 -4.732 -12.515 461 HB ILE 72 HB ILE 72 -5.954 -3.387 -10.268 462 HG13 ILE 72 2HG1 ILE 72 -5.561 -2.753 -12.730 463 HG21 ILE 72 1HG2 ILE 72 -6.178 -5.804 -9.739 464 HG22 ILE 72 2HG2 ILE 72 -5.551 -6.207 -11.353 465 HG23 ILE 72 3HG2 ILE 72 -4.516 -5.401 -10.164 466 HD11 ILE 72 3HD1 ILE 72 -3.230 -3.906 -11.208 467 HD12 ILE 72 1HD1 ILE 72 -3.112 -3.083 -12.765 468 HD13 ILE 72 2HD1 ILE 72 -3.779 -2.209 -11.395 469 H ASP 73 H ASP 73 -8.479 -6.486 -11.695 470 HA ASP 73 HA ASP 73 -10.485 -6.163 -9.621 471 HB3 ASP 73 2HB ASP 73 -10.178 -8.899 -9.864 472 H TYR 74 H TYR 74 -9.878 -5.885 -7.557 473 HA TYR 74 HA TYR 74 -7.414 -7.063 -6.597 474 HB3 TYR 74 2HB TYR 74 -7.954 -5.894 -4.489 475 HD1 TYR 74 2HD TYR 74 -5.948 -5.418 -6.345 476 HD2 TYR 74 1HD TYR 74 -9.678 -3.244 -6.022 477 HE1 TYR 74 2HE TYR 74 -5.032 -3.647 -7.755 478 HE2 TYR 74 1HE TYR 74 -8.725 -1.416 -7.367 479 HH TYR 74 HH TYR 74 -6.898 -0.709 -8.691 480 H ASN 75 H ASN 75 -10.642 -8.246 -6.696 481 HA ASN 75 HA ASN 75 -10.629 -9.593 -4.164 482 HB3 ASN 75 2HB ASN 75 -12.518 -10.375 -6.373 483 HD21 ASN 75 1HD2 ASN 75 -13.258 -8.499 -3.363 484 HD22 ASN 75 2HD2 ASN 75 -13.849 -9.877 -2.494 485 H ASN 76 H ASN 76 -8.545 -10.475 -6.597 486 HA ASN 76 HA ASN 76 -8.768 -13.303 -5.946 487 HB3 ASN 76 2HB ASN 76 -9.129 -12.823 -8.281 488 HD21 ASN 76 1HD2 ASN 76 -8.922 -10.837 -9.337 489 HD22 ASN 76 2HD2 ASN 76 -7.348 -10.088 -9.537 490 H TYR 77 H TYR 77 -7.032 -10.557 -4.964 491 HA TYR 77 HA TYR 77 -4.483 -12.060 -4.647 492 HB3 TYR 77 2HB TYR 77 -3.633 -10.030 -3.701 493 HD1 TYR 77 2HD TYR 77 -2.632 -10.959 -5.981 494 HD2 TYR 77 1HD TYR 77 -5.789 -8.064 -5.723 495 HE1 TYR 77 2HE TYR 77 -2.325 -10.453 -8.362 496 HE2 TYR 77 1HE TYR 77 -5.428 -7.464 -8.115 497 HH TYR 77 HH TYR 77 -2.707 -8.840 -9.988 498 H ASP 78 H ASP 78 -3.934 -12.965 -2.614 499 HA ASP 78 HA ASP 78 -6.101 -13.010 -0.568 500 HB3 ASP 78 2HB ASP 78 -3.476 -14.124 0.220 501 H LEU 79 H LEU 79 -3.102 -11.512 -1.292 502 HA LEU 79 HA LEU 79 -3.252 -9.717 1.105 503 HB3 LEU 79 2HB LEU 79 -0.932 -11.291 -0.059 504 HG LEU 79 HG LEU 79 -0.073 -9.031 0.535 505 HD11 LEU 79 1HD1 LEU 79 -1.550 -8.275 2.297 506 HD12 LEU 79 2HD1 LEU 79 0.044 -8.501 3.033 507 HD13 LEU 79 3HD1 LEU 79 -1.231 -9.728 3.253 508 HD21 LEU 79 3HD2 LEU 79 0.754 -11.289 2.398 509 HD22 LEU 79 1HD2 LEU 79 1.721 -9.869 1.952 510 HD23 LEU 79 2HD2 LEU 79 1.303 -11.053 0.738 511 H ILE 80 H ILE 80 -2.830 -7.547 0.675 512 HA ILE 80 HA ILE 80 -1.444 -6.877 -1.859 513 HB ILE 80 HB ILE 80 -3.871 -5.361 -0.847 514 HG13 ILE 80 2HG1 ILE 80 -4.576 -7.525 -1.761 515 HG21 ILE 80 1HG2 ILE 80 -2.130 -3.976 -2.012 516 HG22 ILE 80 2HG2 ILE 80 -2.202 -5.074 -3.404 517 HG23 ILE 80 3HG2 ILE 80 -3.606 -4.080 -2.953 518 HD11 ILE 80 3HD1 ILE 80 -5.998 -6.940 -3.564 519 HD12 ILE 80 1HD1 ILE 80 -5.943 -5.550 -2.467 520 HD13 ILE 80 2HD1 ILE 80 -5.021 -5.529 -3.997 521 H LEU 81 H LEU 81 0.453 -5.919 -1.291 522 HA LEU 81 HA LEU 81 0.626 -4.300 1.204 523 HB3 LEU 81 2HB LEU 81 3.050 -4.054 0.230 524 HG LEU 81 HG LEU 81 2.484 -5.293 2.259 525 HD11 LEU 81 1HD1 LEU 81 2.213 -7.705 0.427 526 HD12 LEU 81 2HD1 LEU 81 0.961 -6.993 1.477 527 HD13 LEU 81 3HD1 LEU 81 2.373 -7.762 2.200 528 HD21 LEU 81 3HD2 LEU 81 4.514 -6.697 2.262 529 HD22 LEU 81 1HD2 LEU 81 4.787 -5.125 1.492 530 HD23 LEU 81 2HD2 LEU 81 4.583 -6.589 0.490 531 H ILE 82 H ILE 82 0.910 -2.076 1.150 532 HA ILE 82 HA ILE 82 1.146 -0.809 -1.486 533 HB ILE 82 HB ILE 82 -0.545 0.109 0.848 534 HG13 ILE 82 2HG1 ILE 82 -1.142 -1.184 -1.820 535 HG21 ILE 82 1HG2 ILE 82 -1.208 1.980 -0.628 536 HG22 ILE 82 2HG2 ILE 82 0.491 2.067 -0.182 537 HG23 ILE 82 3HG2 ILE 82 0.037 1.487 -1.802 538 HD11 ILE 82 3HD1 ILE 82 -3.139 -2.003 -0.626 539 HD12 ILE 82 1HD1 ILE 82 -1.687 -2.398 0.308 540 HD13 ILE 82 2HD1 ILE 82 -2.705 -1.027 0.794 541 H GLY 83 H GLY 83 2.629 0.879 -1.667 542 HA2 GLY 83 1HA GLY 83 4.368 1.476 0.720 543 HA3 GLY 83 2HA GLY 83 4.982 1.135 -0.857 544 H SER 84 H SER 84 5.149 3.758 0.848 545 HA SER 84 HA SER 84 4.596 5.503 -1.463 546 HB3 SER 84 2HB SER 84 2.521 5.511 -0.195 547 HG SER 84 HG SER 84 2.469 5.511 1.889 548 HA PRO 85 HA PRO 85 8.095 7.925 0.302 549 HB3 PRO 85 2HB PRO 85 8.137 9.155 -1.649 550 HG3 PRO 85 2HG PRO 85 6.237 9.624 -2.871 551 HD3 PRO 85 2HD PRO 85 5.718 7.413 -2.504 552 H VAL 86 H VAL 86 8.477 9.588 1.874 553 HA VAL 86 HA VAL 86 6.170 10.596 3.444 554 HB VAL 86 HB VAL 86 9.116 10.186 4.063 555 HG11 VAL 86 1HG1 VAL 86 8.875 11.217 6.207 556 HG12 VAL 86 2HG1 VAL 86 8.303 12.437 5.078 557 HG13 VAL 86 3HG1 VAL 86 7.170 11.453 6.001 558 HG21 VAL 86 3HG2 VAL 86 8.108 8.823 5.894 559 HG22 VAL 86 1HG2 VAL 86 6.482 9.298 5.351 560 HG23 VAL 86 2HG2 VAL 86 7.512 8.288 4.316 561 H TRP 87 H TRP 87 5.936 12.872 3.405 562 HA TRP 87 HA TRP 87 7.886 14.556 1.910 563 HB3 TRP 87 2HB TRP 87 5.282 15.793 2.244 564 HD1 TRP 87 HD TRP 87 6.916 17.528 0.696 565 HE1 TRP 87 1HE TRP 87 7.188 17.640 -1.887 566 HE3 TRP 87 3HE TRP 87 5.037 12.965 -0.536 567 HZ2 TRP 87 2HZ TRP 87 6.553 16.037 -4.151 568 HZ3 TRP 87 3HZ TRP 87 4.711 12.374 -2.906 569 HH2 TRP 87 HH TRP 87 5.536 13.840 -4.725 570 H SER 88 H SER 88 7.058 16.968 2.797 571 HA SER 88 HA SER 88 8.149 17.592 5.258 572 HB3 SER 88 2HB SER 88 6.745 19.680 4.975 573 HG SER 88 HG SER 88 8.247 18.769 2.708 574 H GLY 89 H GLY 89 7.394 15.905 6.556 575 HA2 GLY 89 1HA GLY 89 6.412 15.397 8.601 576 HA3 GLY 89 2HA GLY 89 5.381 16.816 8.456 577 H TYR 90 H TYR 90 4.387 15.704 5.633 578 HA TYR 90 HA TYR 90 2.790 13.463 6.639 579 HB3 TYR 90 2HB TYR 90 0.708 14.650 5.974 580 HD1 TYR 90 1HD TYR 90 1.128 13.512 8.337 581 HD2 TYR 90 2HD TYR 90 1.773 17.670 7.539 582 HE1 TYR 90 1HE TYR 90 0.426 14.044 10.674 583 HE2 TYR 90 2HE TYR 90 1.293 18.203 9.898 584 HH TYR 90 HH TYR 90 0.276 17.421 11.807 585 HA PRO 91 HA PRO 91 3.517 12.254 2.576 586 HB3 PRO 91 2HB PRO 91 2.712 10.176 3.234 587 HG3 PRO 91 2HG PRO 91 0.726 9.979 4.571 588 HD3 PRO 91 2HD PRO 91 2.215 11.503 5.764 589 H ALA 92 H ALA 92 2.797 12.408 0.399 590 HA ALA 92 HA ALA 92 1.205 14.729 -0.270 591 HB1 ALA 92 1HB ALA 92 2.817 12.765 -1.783 592 HB2 ALA 92 2HB ALA 92 1.814 13.972 -2.596 593 HB3 ALA 92 3HB ALA 92 3.074 14.510 -1.508 594 H THR 93 H THR 93 -0.267 12.690 1.061 595 HA THR 93 HA THR 93 -1.820 10.998 1.032 596 HB THR 93 HB THR 93 -3.886 12.072 0.526 597 HG1 THR 93 1HG THR 93 -4.105 13.449 -0.912 598 HG21 THR 93 3HG2 THR 93 -1.959 14.259 1.449 599 HG22 THR 93 1HG2 THR 93 -2.655 12.983 2.498 600 HG23 THR 93 2HG2 THR 93 -3.697 14.188 1.712 601 HA PRO 94 HA PRO 94 -1.329 9.618 -3.440 602 HB3 PRO 94 2HB PRO 94 1.023 9.276 -3.293 603 HG3 PRO 94 2HG PRO 94 2.014 8.479 -1.222 604 HD3 PRO 94 2HD PRO 94 0.869 10.478 -0.850 605 H ILE 95 H ILE 95 -2.246 7.917 -0.601 606 HA ILE 95 HA ILE 95 -2.989 5.498 -2.181 607 HB ILE 95 HB ILE 95 -2.656 5.830 0.812 608 HG13 ILE 95 2HG1 ILE 95 -0.628 4.301 0.464 609 HG21 ILE 95 1HG2 ILE 95 -3.050 3.381 -0.920 610 HG22 ILE 95 2HG2 ILE 95 -2.654 3.337 0.816 611 HG23 ILE 95 3HG2 ILE 95 -4.178 4.034 0.286 612 HD11 ILE 95 3HD1 ILE 95 -0.843 3.932 -2.058 613 HD12 ILE 95 1HD1 ILE 95 -0.317 5.606 -2.281 614 HD13 ILE 95 2HD1 ILE 95 0.751 4.484 -1.499 615 H LYS 96 H LYS 96 -4.326 8.352 -0.758 616 HA LYS 96 HA LYS 96 -6.772 7.364 0.229 617 HB3 LYS 96 2HB LYS 96 -5.943 10.049 -0.996 618 HG3 LYS 96 2HG LYS 96 -8.319 10.160 -0.981 619 HD3 LYS 96 2HD LYS 96 -8.193 9.025 1.843 620 HE3 LYS 96 2HE LYS 96 -10.446 10.564 0.464 621 HZ1 LYS 96 3HZ LYS 96 -11.524 8.956 1.680 622 HZ2 LYS 96 1HZ LYS 96 -11.493 10.209 2.687 623 HZ3 LYS 96 2HZ LYS 96 -10.481 8.929 2.941 624 H THR 97 H THR 97 -5.924 8.537 -3.107 625 HA THR 97 HA THR 97 -8.673 8.152 -3.937 626 HB THR 97 HB THR 97 -6.195 8.428 -5.708 627 HG1 THR 97 1HG THR 97 -6.429 10.706 -5.410 628 HG21 THR 97 3HG2 THR 97 -9.074 9.388 -6.041 629 HG22 THR 97 1HG2 THR 97 -8.253 8.137 -6.992 630 HG23 THR 97 2HG2 THR 97 -7.741 9.818 -7.132 631 H LEU 98 H LEU 98 -6.181 5.924 -3.297 632 HA LEU 98 HA LEU 98 -7.163 3.952 -5.285 633 HB3 LEU 98 2HB LEU 98 -4.885 3.757 -3.260 634 HG LEU 98 HG LEU 98 -5.718 1.523 -3.756 635 HD11 LEU 98 1HD1 LEU 98 -7.019 1.724 -5.737 636 HD12 LEU 98 2HD1 LEU 98 -5.648 0.727 -6.202 637 HD13 LEU 98 3HD1 LEU 98 -5.685 2.459 -6.643 638 HD21 LEU 98 3HD2 LEU 98 -3.255 2.136 -5.436 639 HD22 LEU 98 1HD2 LEU 98 -3.713 0.567 -4.732 640 HD23 LEU 98 2HD2 LEU 98 -3.279 1.905 -3.670 641 H LEU 99 H LEU 99 -6.779 4.222 -1.506 642 HA LEU 99 HA LEU 99 -7.924 1.720 -1.186 643 HB3 LEU 99 2HB LEU 99 -6.400 3.443 0.112 644 HG LEU 99 HG LEU 99 -7.079 4.307 1.863 645 HD11 LEU 99 1HD1 LEU 99 -9.684 5.137 0.675 646 HD12 LEU 99 2HD1 LEU 99 -8.079 5.643 0.081 647 HD13 LEU 99 3HD1 LEU 99 -8.590 6.005 1.731 648 HD21 LEU 99 3HD2 LEU 99 -8.339 2.404 2.771 649 HD22 LEU 99 1HD2 LEU 99 -9.675 2.705 1.661 650 HD23 LEU 99 2HD2 LEU 99 -9.376 3.830 3.026 651 H ASP 100 H ASP 100 -9.417 4.828 -1.789 652 HA ASP 100 HA ASP 100 -11.989 4.042 -0.866 653 HB3 ASP 100 2HB ASP 100 -11.870 6.066 -3.059 654 H GLN 101 H GLN 101 -10.265 3.371 -3.812 655 HA GLN 101 HA GLN 101 -12.584 2.393 -5.316 656 HB3 GLN 101 2HB GLN 101 -10.887 1.468 -6.830 657 HG3 GLN 101 2HG GLN 101 -10.129 4.282 -5.980 658 HE21 GLN 101 1HE2 GLN 101 -8.582 5.289 -7.184 659 HE22 GLN 101 2HE2 GLN 101 -7.986 4.779 -8.756 660 H MET 102 H MET 102 -9.968 1.127 -3.234 661 HA MET 102 HA MET 102 -10.545 -1.615 -3.747 662 HB3 MET 102 2HB MET 102 -8.942 -2.125 -2.079 663 HG3 MET 102 2HG MET 102 -7.924 0.317 -3.477 664 HE1 MET 102 3HE MET 102 -6.139 -3.135 -3.063 665 HE2 MET 102 1HE MET 102 -5.235 -2.955 -1.551 666 HE3 MET 102 2HE MET 102 -7.000 -3.124 -1.508 667 H LYS 103 H LYS 103 -12.744 0.197 -2.076 668 HA LYS 103 HA LYS 103 -12.942 -1.034 0.475 669 HB3 LYS 103 2HB LYS 103 -15.187 -0.273 0.606 670 HG3 LYS 103 2HG LYS 103 -14.177 1.854 -1.181 671 HD3 LYS 103 2HD LYS 103 -14.826 1.917 1.771 672 HE3 LYS 103 2HE LYS 103 -13.646 3.783 0.224 673 HZ1 LYS 103 3HZ LYS 103 -15.852 3.841 -1.109 674 HZ2 LYS 103 1HZ LYS 103 -15.060 5.227 -0.739 675 HZ3 LYS 103 2HZ LYS 103 -16.353 4.823 0.160 676 H ASN 104 H ASN 104 -13.825 -2.255 -2.596 677 HA ASN 104 HA ASN 104 -15.693 -4.305 -1.700 678 HB3 ASN 104 2HB ASN 104 -15.964 -4.784 -4.009 679 HD21 ASN 104 1HD2 ASN 104 -14.300 -1.903 -5.006 680 HD22 ASN 104 2HD2 ASN 104 -15.582 -0.777 -4.695 681 H TYR 105 H TYR 105 -12.439 -4.135 -1.266 682 HA TYR 105 HA TYR 105 -11.899 -6.985 -1.893 683 HB3 TYR 105 2HB TYR 105 -10.070 -4.687 -1.163 684 HD1 TYR 105 2HD TYR 105 -10.104 -8.121 -2.670 685 HD2 TYR 105 1HD TYR 105 -8.073 -5.339 -0.064 686 HE1 TYR 105 2HE TYR 105 -8.464 -9.851 -2.121 687 HE2 TYR 105 1HE TYR 105 -6.371 -7.088 0.446 688 HH TYR 105 HH TYR 105 -6.577 -10.351 -0.970 689 H ARG 106 H ARG 106 -11.793 -8.408 -0.209 690 HA ARG 106 HA ARG 106 -11.373 -7.362 2.540 691 HB3 ARG 106 2HB ARG 106 -12.685 -9.406 3.242 692 HG3 ARG 106 2HG ARG 106 -14.951 -8.620 2.333 693 HD3 ARG 106 2HD ARG 106 -13.489 -6.253 3.529 694 HE ARG 106 HE ARG 106 -16.144 -6.785 3.266 695 HH11 ARG 106 1HH1 ARG 106 -14.148 -6.444 6.290 696 HH12 ARG 106 2HH1 ARG 106 -15.551 -6.612 7.262 697 HH21 ARG 106 1HH2 ARG 106 -17.951 -6.845 4.757 698 HH22 ARG 106 2HH2 ARG 106 -17.581 -6.809 6.451 699 H GLY 107 H GLY 107 -9.518 -8.251 3.475 700 HA2 GLY 107 1HA GLY 107 -8.307 -10.616 3.193 701 HA3 GLY 107 2HA GLY 107 -7.747 -9.739 1.751 702 H GLU 108 H GLU 108 -5.627 -9.987 2.895 703 HA GLU 108 HA GLU 108 -5.211 -8.194 5.203 704 HB3 GLU 108 2HB GLU 108 -2.843 -8.939 4.876 705 HG3 GLU 108 2HG GLU 108 -4.647 -11.348 5.213 706 H VAL 109 H VAL 109 -4.265 -6.191 5.089 707 HA VAL 109 HA VAL 109 -3.240 -5.278 2.490 708 HB VAL 109 HB VAL 109 -5.132 -3.569 4.136 709 HG11 VAL 109 1HG1 VAL 109 -5.196 -2.213 2.070 710 HG12 VAL 109 2HG1 VAL 109 -3.534 -2.402 2.640 711 HG13 VAL 109 3HG1 VAL 109 -4.116 -3.372 1.270 712 HG21 VAL 109 3HG2 VAL 109 -6.530 -5.406 3.276 713 HG22 VAL 109 1HG2 VAL 109 -6.848 -3.931 2.366 714 HG23 VAL 109 2HG2 VAL 109 -5.828 -5.194 1.652 715 H ALA 110 H ALA 110 -1.285 -4.125 2.830 716 HA ALA 110 HA ALA 110 -0.719 -3.205 5.616 717 HB1 ALA 110 1HB ALA 110 1.442 -4.180 5.626 718 HB2 ALA 110 2HB ALA 110 0.349 -5.479 5.088 719 HB3 ALA 110 3HB ALA 110 1.327 -4.614 3.911 720 H SER 111 H SER 111 1.124 -1.621 5.675 721 HA SER 111 HA SER 111 1.084 0.060 3.224 722 HB3 SER 111 2HB SER 111 -0.277 1.594 4.018 723 HG SER 111 HG SER 111 -0.776 -0.177 6.176 724 H PHE 112 H PHE 112 3.375 -0.449 3.068 725 HA PHE 112 HA PHE 112 5.081 0.547 5.250 726 HB3 PHE 112 2HB PHE 112 5.783 -1.514 4.160 727 HD1 PHE 112 1HD PHE 112 7.555 0.793 1.897 728 HD2 PHE 112 2HD PHE 112 4.634 -2.375 2.135 729 HE1 PHE 112 1HE PHE 112 7.821 0.337 -0.535 730 HE2 PHE 112 2HE PHE 112 4.891 -2.776 -0.278 731 HZ PHE 112 HZ PHE 112 6.446 -1.404 -1.631 732 H PHE 113 H PHE 113 6.989 1.955 4.540 733 HA PHE 113 HA PHE 113 6.805 3.738 2.356 734 HB3 PHE 113 2HB PHE 113 4.968 4.829 3.556 735 HD1 PHE 113 2HD PHE 113 5.158 3.016 6.001 736 HD2 PHE 113 1HD PHE 113 6.105 7.144 5.336 737 HE1 PHE 113 2HE PHE 113 5.028 3.423 8.405 738 HE2 PHE 113 1HE PHE 113 6.053 7.547 7.730 739 HZ PHE 113 HZ PHE 113 5.486 5.677 9.332 740 H THR 114 H THR 114 8.550 5.723 3.079 741 HA THR 114 HA THR 114 10.503 4.505 4.980 742 HB THR 114 HB THR 114 12.339 5.113 3.378 743 HG1 THR 114 1HG THR 114 10.722 6.560 2.175 744 HG21 THR 114 3HG2 THR 114 12.116 3.257 1.862 745 HG22 THR 114 1HG2 THR 114 10.349 3.271 1.973 746 HG23 THR 114 2HG2 THR 114 11.326 2.788 3.376 747 H SER 115 H SER 115 11.795 6.271 6.107 748 HA SER 115 HA SER 115 11.030 9.043 5.394 749 HB3 SER 115 2HB SER 115 9.863 9.430 7.236 750 HG SER 115 HG SER 115 8.996 7.337 6.807 751 H ALA 116 H ALA 116 12.213 10.544 7.203 752 HA ALA 116 HA ALA 116 15.088 9.883 7.006 753 HB1 ALA 116 1HB ALA 116 15.364 12.336 7.007 754 HB2 ALA 116 2HB ALA 116 14.303 11.775 5.715 755 HB3 ALA 116 3HB ALA 116 13.599 12.526 7.173 756 H GLY 117 H GLY 117 13.298 9.043 9.351 757 HA2 GLY 117 1HA GLY 117 13.993 8.583 11.481 758 HA3 GLY 117 2HA GLY 117 15.295 9.739 11.292 759 H THR 118 H THR 118 12.408 11.345 10.621 760 HA THR 118 HA THR 118 11.918 12.273 13.391 761 HB THR 118 HB THR 118 11.551 14.511 12.072 762 HG1 THR 118 1HG THR 118 12.105 14.514 10.088 763 HG21 THR 118 3HG2 THR 118 14.368 13.408 12.407 764 HG22 THR 118 1HG2 THR 118 13.403 14.184 13.674 765 HG23 THR 118 2HG2 THR 118 13.932 15.118 12.270 766 H ASN 119 H ASN 119 9.681 13.589 13.231 767 HA ASN 119 HA ASN 119 7.522 13.679 12.899 768 HB3 ASN 119 2HB ASN 119 6.761 13.852 10.479 769 HD21 ASN 119 1HD2 ASN 119 8.522 15.799 9.082 770 HD22 ASN 119 2HD2 ASN 119 8.273 17.195 10.082 771 H HIS 120 H HIS 120 8.684 10.815 13.057 772 HA HIS 120 HA HIS 120 7.263 9.122 11.553 773 HB3 HIS 120 2HB HIS 120 8.149 8.552 14.377 774 HD1 HIS 120 1HD HIS 120 8.213 5.879 14.929 775 HD2 HIS 120 2HD HIS 120 6.740 6.965 11.122 776 HE1 HIS 120 1HE HIS 120 7.219 3.783 13.866 777 H LYS 121 H LYS 121 6.159 10.373 14.680 778 HA LYS 121 HA LYS 121 3.804 8.736 14.817 779 HB3 LYS 121 2HB LYS 121 3.599 11.485 15.947 780 HG3 LYS 121 2HG LYS 121 3.769 8.874 17.419 781 HD3 LYS 121 2HD LYS 121 3.558 11.171 18.614 782 HE3 LYS 121 2HE LYS 121 0.732 10.873 17.468 783 HZ1 LYS 121 3HZ LYS 121 0.320 12.947 18.551 784 HZ2 LYS 121 1HZ LYS 121 1.841 13.023 19.154 785 HZ3 LYS 121 2HZ LYS 121 0.818 11.854 19.690 786 H ALA 122 H ALA 122 4.502 11.841 13.250 787 HA ALA 122 HA ALA 122 1.829 12.684 12.747 788 HB1 ALA 122 1HB ALA 122 2.834 14.316 11.311 789 HB2 ALA 122 2HB ALA 122 3.929 14.123 12.676 790 HB3 ALA 122 3HB ALA 122 4.299 13.378 11.099 791 H TYR 123 H TYR 123 4.271 10.992 10.684 792 HA TYR 123 HA TYR 123 2.724 10.600 8.407 793 HB3 TYR 123 2HB TYR 123 4.253 9.013 7.732 794 HD1 TYR 123 2HD TYR 123 4.861 11.919 8.101 795 HD2 TYR 123 1HD TYR 123 6.762 8.381 9.541 796 HE1 TYR 123 2HE TYR 123 7.056 13.067 7.989 797 HE2 TYR 123 1HE TYR 123 8.971 9.491 9.481 798 HH TYR 123 HH TYR 123 9.445 12.622 7.895 799 H VAL 124 H VAL 124 3.018 8.225 11.141 800 HA VAL 124 HA VAL 124 1.128 6.352 10.084 801 HB VAL 124 HB VAL 124 2.090 6.797 12.932 802 HG11 VAL 124 1HG1 VAL 124 0.124 5.212 12.751 803 HG12 VAL 124 2HG1 VAL 124 1.109 4.204 11.656 804 HG13 VAL 124 3HG1 VAL 124 1.618 4.460 13.330 805 HG21 VAL 124 3HG2 VAL 124 3.216 5.127 10.642 806 HG22 VAL 124 1HG2 VAL 124 4.022 6.475 11.467 807 HG23 VAL 124 2HG2 VAL 124 3.731 4.964 12.321 808 H SER 125 H SER 125 0.676 9.260 12.189 809 HA SER 125 HA SER 125 -2.089 8.717 12.821 810 HB3 SER 125 2HB SER 125 -0.509 11.334 12.695 811 HG SER 125 HG SER 125 -2.962 10.651 13.974 812 H HIS 126 H HIS 126 -0.435 10.506 10.193 813 HA HIS 126 HA HIS 126 -2.890 11.535 9.122 814 HB3 HIS 126 2HB HIS 126 -0.193 11.342 7.723 815 HD1 HIS 126 1HD HIS 126 -1.511 12.120 5.380 816 HD2 HIS 126 2HD HIS 126 -1.867 14.553 8.795 817 HE1 HIS 126 1HE HIS 126 -2.324 14.402 4.561 818 H PHE 127 H PHE 127 -0.869 8.674 8.397 819 HA PHE 127 HA PHE 127 -2.133 8.032 5.908 820 HB3 PHE 127 2HB PHE 127 -0.923 6.162 7.983 821 HD1 PHE 127 2HD PHE 127 -0.938 6.479 4.213 822 HD2 PHE 127 1HD PHE 127 -2.014 4.068 7.628 823 HE1 PHE 127 2HE PHE 127 -1.713 4.676 2.713 824 HE2 PHE 127 1HE PHE 127 -2.795 2.282 6.115 825 HZ PHE 127 HZ PHE 127 -2.662 2.593 3.642 826 H ASN 128 H ASN 128 -2.880 7.092 9.275 827 HA ASN 128 HA ASN 128 -5.052 5.448 8.945 828 HB3 ASN 128 2HB ASN 128 -5.901 6.811 11.121 829 HD21 ASN 128 1HD2 ASN 128 -2.488 5.811 11.436 830 HD22 ASN 128 2HD2 ASN 128 -2.899 4.284 12.159 831 H GLU 129 H GLU 129 -5.340 9.026 9.209 832 HA GLU 129 HA GLU 129 -8.098 9.313 8.983 833 HB3 GLU 129 2HB GLU 129 -7.268 11.503 7.606 834 HG3 GLU 129 2HG GLU 129 -6.019 12.177 9.929 835 H TRP 130 H TRP 130 -5.774 8.833 6.383 836 HA TRP 130 HA TRP 130 -7.929 9.040 4.364 837 HB3 TRP 130 2HB TRP 130 -6.161 9.492 2.815 838 HD1 TRP 130 HD TRP 130 -3.743 11.015 4.939 839 HE1 TRP 130 1HE TRP 130 -4.253 13.452 5.577 840 HE3 TRP 130 3HE TRP 130 -8.699 11.201 3.725 841 HZ2 TRP 130 2HZ TRP 130 -6.345 15.344 5.153 842 HZ3 TRP 130 3HZ TRP 130 -9.931 13.358 3.826 843 HH2 TRP 130 HH TRP 130 -8.771 15.430 4.511 844 H ALA 131 H ALA 131 -7.066 6.607 6.189 845 HA ALA 131 HA ALA 131 -7.323 4.569 4.118 846 HB1 ALA 131 1HB ALA 131 -4.865 4.996 4.217 847 HB2 ALA 131 2HB ALA 131 -4.894 4.608 5.952 848 HB3 ALA 131 3HB ALA 131 -5.308 3.366 4.753 849 H ASP 132 H ASP 132 -9.020 5.538 6.232 850 HA ASP 132 HA ASP 132 -9.007 3.312 8.124 851 HB3 ASP 132 2HB ASP 132 -11.026 5.443 8.466 852 H GLY 133 H GLY 133 -9.736 2.623 5.524 853 HA2 GLY 133 1HA GLY 133 -12.713 2.285 5.595 854 HA3 GLY 133 2HA GLY 133 -11.706 2.248 4.155 855 H LEU 134 H LEU 134 -9.772 0.398 5.866 856 HA LEU 134 HA LEU 134 -11.217 -2.185 5.465 857 HB3 LEU 134 2HB LEU 134 -8.951 -2.923 4.520 858 HG LEU 134 HG LEU 134 -8.996 -2.130 2.382 859 HD11 LEU 134 1HD1 LEU 134 -10.455 -3.979 2.883 860 HD12 LEU 134 2HD1 LEU 134 -11.196 -3.005 1.616 861 HD13 LEU 134 3HD1 LEU 134 -11.796 -2.875 3.280 862 HD21 LEU 134 3HD2 LEU 134 -9.740 0.246 2.724 863 HD22 LEU 134 1HD2 LEU 134 -11.414 -0.363 2.721 864 HD23 LEU 134 2HD2 LEU 134 -10.376 -0.596 1.304 865 H ASN 135 H ASN 135 -9.894 -3.985 6.358 866 HA ASN 135 HA ASN 135 -8.456 -3.745 8.837 867 HB3 ASN 135 2HB ASN 135 -8.633 -5.716 6.536 868 HD21 ASN 135 1HD2 ASN 135 -7.120 -7.285 6.182 869 HD22 ASN 135 2HD2 ASN 135 -5.954 -7.769 7.401 870 H VAL 136 H VAL 136 -6.225 -3.495 9.158 871 HA VAL 136 HA VAL 136 -4.422 -3.342 6.884 872 HB VAL 136 HB VAL 136 -4.540 -1.179 9.044 873 HG11 VAL 136 1HG1 VAL 136 -2.531 -1.626 6.787 874 HG12 VAL 136 2HG1 VAL 136 -2.632 -0.153 7.796 875 HG13 VAL 136 3HG1 VAL 136 -2.209 -1.693 8.537 876 HG21 VAL 136 3HG2 VAL 136 -4.820 0.385 7.103 877 HG22 VAL 136 1HG2 VAL 136 -4.988 -1.032 6.029 878 HG23 VAL 136 2HG2 VAL 136 -6.184 -0.707 7.299 879 H ILE 137 H ILE 137 -2.610 -4.637 7.400 880 HA ILE 137 HA ILE 137 -2.653 -5.836 10.072 881 HB ILE 137 HB ILE 137 -1.323 -7.567 9.088 882 HG13 ILE 137 2HG1 ILE 137 -0.086 -5.997 7.456 883 HG21 ILE 137 1HG2 ILE 137 -3.032 -8.458 7.580 884 HG22 ILE 137 2HG2 ILE 137 -3.811 -7.601 8.904 885 HG23 ILE 137 3HG2 ILE 137 -3.700 -6.843 7.298 886 HD11 ILE 137 3HD1 ILE 137 0.164 -8.466 7.395 887 HD12 ILE 137 1HD1 ILE 137 -1.192 -8.530 6.244 888 HD13 ILE 137 2HD1 ILE 137 0.302 -7.688 5.801 889 H GLY 138 H GLY 138 -0.873 -3.301 8.597 890 HA2 GLY 138 1HA GLY 138 0.679 -2.818 10.817 891 HA3 GLY 138 2HA GLY 138 1.727 -3.736 9.729 892 H VAL 139 H VAL 139 2.213 -1.048 10.496 893 HA VAL 139 HA VAL 139 2.376 0.215 7.874 894 HB VAL 139 HB VAL 139 1.360 1.804 10.294 895 HG11 VAL 139 1HG1 VAL 139 2.819 3.125 8.853 896 HG12 VAL 139 2HG1 VAL 139 1.842 2.676 7.431 897 HG13 VAL 139 3HG1 VAL 139 1.143 3.651 8.725 898 HG21 VAL 139 3HG2 VAL 139 -0.495 0.486 9.454 899 HG22 VAL 139 1HG2 VAL 139 -0.686 2.101 8.786 900 HG23 VAL 139 2HG2 VAL 139 -0.039 0.821 7.770 901 H ALA 140 H ALA 140 4.584 0.314 7.622 902 HA ALA 140 HA ALA 140 6.259 0.976 9.972 903 HB1 ALA 140 1HB ALA 140 6.871 -1.411 8.222 904 HB2 ALA 140 2HB ALA 140 7.597 -0.977 9.754 905 HB3 ALA 140 3HB ALA 140 5.929 -1.559 9.722 906 H ARG 141 H ARG 141 8.228 1.873 9.450 907 HA ARG 141 HA ARG 141 8.235 3.257 6.858 908 HB3 ARG 141 2HB ARG 141 8.092 4.558 8.876 909 HG3 ARG 141 2HG ARG 141 10.780 3.358 9.740 910 HD3 ARG 141 2HD ARG 141 9.559 4.597 11.874 911 HE ARG 141 HE ARG 141 11.553 5.808 10.005 912 HH11 ARG 141 1HH1 ARG 141 10.560 5.081 13.352 913 HH12 ARG 141 2HH1 ARG 141 12.049 5.641 14.042 914 HH21 ARG 141 1HH2 ARG 141 13.491 6.389 10.887 915 HH22 ARG 141 2HH2 ARG 141 13.860 6.227 12.589 916 H ASP 142 H ASP 142 9.382 0.561 7.073 917 HA ASP 142 HA ASP 142 11.734 0.462 5.751 918 HB3 ASP 142 2HB ASP 142 13.215 -0.443 7.835 919 H ASP 143 H ASP 143 12.935 -1.745 6.633 920 HA ASP 143 HA ASP 143 10.949 -3.578 5.532 921 HB3 ASP 143 2HB ASP 143 12.662 -3.440 4.061 922 H SER 144 H SER 144 11.744 -3.134 8.633 923 HA SER 144 HA SER 144 12.722 -5.652 9.479 924 HB3 SER 144 2HB SER 144 10.925 -3.897 11.168 925 HG SER 144 HG SER 144 12.053 -4.759 12.778 926 H GLU 145 H GLU 145 9.406 -4.828 8.525 927 HA GLU 145 HA GLU 145 8.341 -6.996 10.234 928 HB3 GLU 145 2HB GLU 145 6.164 -5.880 9.903 929 HG3 GLU 145 2HG GLU 145 8.445 -4.190 10.977 930 H VAL 146 H VAL 146 9.455 -7.250 7.177 931 HA VAL 146 HA VAL 146 7.185 -8.010 5.718 932 HB VAL 146 HB VAL 146 10.009 -9.140 5.433 933 HG11 VAL 146 1HG1 VAL 146 9.379 -9.288 2.985 934 HG12 VAL 146 2HG1 VAL 146 8.512 -10.406 4.037 935 HG13 VAL 146 3HG1 VAL 146 7.693 -8.947 3.474 936 HG21 VAL 146 3HG2 VAL 146 8.790 -6.631 4.218 937 HG22 VAL 146 1HG2 VAL 146 10.079 -6.680 5.428 938 HG23 VAL 146 2HG2 VAL 146 10.391 -7.315 3.822 939 H ASP 147 H ASP 147 8.924 -9.882 8.112 940 HA ASP 147 HA ASP 147 7.962 -12.460 7.488 941 HB3 ASP 147 2HB ASP 147 8.431 -11.307 10.267 942 H LYS 148 H LYS 148 6.259 -9.767 9.056 943 HA LYS 148 HA LYS 148 3.981 -11.587 9.802 944 HB3 LYS 148 2HB LYS 148 4.484 -9.964 11.478 945 HG3 LYS 148 2HG LYS 148 4.346 -7.938 9.276 946 HD3 LYS 148 2HD LYS 148 2.703 -7.062 10.858 947 HE3 LYS 148 2HE LYS 148 3.636 -6.069 12.980 948 HZ1 LYS 148 3HZ LYS 148 2.324 -8.205 12.950 949 HZ2 LYS 148 1HZ LYS 148 3.267 -8.009 14.290 950 HZ3 LYS 148 2HZ LYS 148 3.767 -9.014 13.136 951 H TRP 149 H TRP 149 5.054 -9.817 7.099 952 HA TRP 149 HA TRP 149 2.305 -9.391 6.127 953 HB3 TRP 149 2HB TRP 149 3.294 -8.112 4.378 954 HD1 TRP 149 HD TRP 149 2.283 -7.604 7.550 955 HE1 TRP 149 1HE TRP 149 2.840 -5.389 8.612 956 HE3 TRP 149 3HE TRP 149 5.949 -6.143 4.341 957 HZ2 TRP 149 2HZ TRP 149 4.666 -3.150 8.116 958 HZ3 TRP 149 3HZ TRP 149 7.091 -3.935 4.653 959 HH2 TRP 149 HH TRP 149 6.451 -2.450 6.466 960 H SER 150 H SER 150 4.151 -12.094 6.327 961 HA SER 150 HA SER 150 3.374 -13.090 3.657 962 HB3 SER 150 2HB SER 150 6.210 -13.388 4.697 963 HG SER 150 HG SER 150 4.999 -14.525 2.732 964 H LYS 151 H LYS 151 2.184 -13.764 6.123 965 HA LYS 151 HA LYS 151 3.510 -16.134 7.221 966 HB3 LYS 151 2HB LYS 151 2.388 -14.360 8.623 967 HG3 LYS 151 2HG LYS 151 0.096 -14.621 9.280 968 HD3 LYS 151 2HD LYS 151 -1.284 -14.026 7.334 969 HE3 LYS 151 2HE LYS 151 0.335 -12.305 6.265 970 HZ1 LYS 151 3HZ LYS 151 -1.133 -11.602 7.955 971 HZ2 LYS 151 1HZ LYS 151 0.337 -10.937 8.216 972 HZ3 LYS 151 2HZ LYS 151 -0.135 -12.159 9.171 Start of MODEL 3 1 H1 GLY 1 H GLY 1 -12.095 -23.309 -1.943 2 HA2 GLY 1 1HA GLY 1 -10.204 -24.167 -3.188 3 HA3 GLY 1 2HA GLY 1 -10.936 -22.823 -4.067 4 H MET 2 H MET 2 -9.047 -22.005 -5.083 5 HA MET 2 HA MET 2 -6.533 -21.775 -3.622 6 HB3 MET 2 2HB MET 2 -5.774 -20.715 -5.747 7 HG3 MET 2 2HG MET 2 -5.667 -23.210 -5.444 8 HE1 MET 2 3HE MET 2 -6.042 -25.635 -6.381 9 HE2 MET 2 1HE MET 2 -7.321 -26.080 -7.536 10 HE3 MET 2 2HE MET 2 -5.999 -25.004 -8.041 11 H ALA 3 H ALA 3 -6.639 -20.230 -1.981 12 HA ALA 3 HA ALA 3 -7.252 -17.435 -2.799 13 HB1 ALA 3 1HB ALA 3 -8.549 -17.123 -0.752 14 HB2 ALA 3 2HB ALA 3 -9.295 -18.359 -1.776 15 HB3 ALA 3 3HB ALA 3 -8.364 -18.834 -0.335 16 H LYS 4 H LYS 4 -4.919 -17.469 -2.930 17 HA LYS 4 HA LYS 4 -3.859 -16.143 -0.692 18 HB3 LYS 4 2HB LYS 4 -3.394 -18.315 0.227 19 HG3 LYS 4 2HG LYS 4 -1.585 -19.707 -0.446 20 HD3 LYS 4 2HD LYS 4 -3.965 -20.065 -1.448 21 HE3 LYS 4 2HE LYS 4 -3.487 -18.696 -3.564 22 HZ1 LYS 4 3HZ LYS 4 -2.352 -19.926 -5.261 23 HZ2 LYS 4 1HZ LYS 4 -1.830 -21.052 -4.167 24 HZ3 LYS 4 2HZ LYS 4 -1.307 -19.472 -4.097 25 H LYS 5 H LYS 5 -3.739 -14.501 -2.281 26 HA LYS 5 HA LYS 5 -1.421 -14.750 -4.136 27 HB3 LYS 5 2HB LYS 5 -2.910 -12.934 -5.389 28 HG3 LYS 5 2HG LYS 5 -4.312 -14.841 -6.322 29 HD3 LYS 5 2HD LYS 5 -1.326 -15.256 -6.672 30 HE3 LYS 5 2HE LYS 5 -3.670 -15.064 -8.594 31 HZ1 LYS 5 3HZ LYS 5 -1.333 -14.341 -9.350 32 HZ2 LYS 5 1HZ LYS 5 -2.195 -15.344 -10.306 33 HZ3 LYS 5 2HZ LYS 5 -0.982 -15.942 -9.372 34 H THR 6 H THR 6 -0.466 -12.624 -4.620 35 HA THR 6 HA THR 6 -0.816 -10.667 -2.415 36 HB THR 6 HB THR 6 1.860 -11.837 -3.128 37 HG1 THR 6 1HG THR 6 0.202 -12.584 -0.958 38 HG21 THR 6 3HG2 THR 6 2.217 -9.772 -2.140 39 HG22 THR 6 1HG2 THR 6 2.381 -10.889 -0.777 40 HG23 THR 6 2HG2 THR 6 0.888 -9.948 -0.963 41 H LEU 7 H LEU 7 -0.965 -8.703 -3.268 42 HA LEU 7 HA LEU 7 0.483 -8.049 -5.827 43 HB3 LEU 7 2HB LEU 7 -1.901 -6.765 -4.436 44 HG LEU 7 HG LEU 7 -0.591 -5.159 -5.893 45 HD11 LEU 7 1HD1 LEU 7 -0.744 -5.447 -8.348 46 HD12 LEU 7 2HD1 LEU 7 -1.470 -7.052 -8.121 47 HD13 LEU 7 3HD1 LEU 7 0.197 -6.721 -7.608 48 HD21 LEU 7 3HD2 LEU 7 -2.956 -4.794 -5.458 49 HD22 LEU 7 1HD2 LEU 7 -3.417 -5.974 -6.696 50 HD23 LEU 7 2HD2 LEU 7 -2.658 -4.458 -7.174 51 H ILE 8 H ILE 8 2.156 -6.596 -5.729 52 HA ILE 8 HA ILE 8 2.422 -4.858 -3.287 53 HB ILE 8 HB ILE 8 4.449 -5.488 -5.448 54 HG13 ILE 8 2HG1 ILE 8 3.936 -7.433 -3.845 55 HG21 ILE 8 1HG2 ILE 8 4.792 -3.995 -2.822 56 HG22 ILE 8 2HG2 ILE 8 6.081 -4.334 -3.994 57 HG23 ILE 8 3HG2 ILE 8 4.778 -3.250 -4.438 58 HD11 ILE 8 3HD1 ILE 8 6.066 -7.351 -5.086 59 HD12 ILE 8 1HD1 ILE 8 6.806 -6.446 -3.739 60 HD13 ILE 8 2HD1 ILE 8 6.207 -8.093 -3.487 61 H LEU 9 H LEU 9 1.499 -2.835 -3.603 62 HA LEU 9 HA LEU 9 1.731 -1.590 -6.331 63 HB3 LEU 9 2HB LEU 9 -0.241 -0.219 -5.755 64 HG LEU 9 HG LEU 9 -1.151 -3.079 -5.638 65 HD11 LEU 9 1HD1 LEU 9 -3.107 -2.208 -6.804 66 HD12 LEU 9 2HD1 LEU 9 -2.351 -0.610 -6.949 67 HD13 LEU 9 3HD1 LEU 9 -2.804 -1.254 -5.351 68 HD21 LEU 9 3HD2 LEU 9 -1.230 -2.942 -8.189 69 HD22 LEU 9 1HD2 LEU 9 0.370 -3.082 -7.479 70 HD23 LEU 9 2HD2 LEU 9 -0.205 -1.494 -8.070 71 H TYR 10 H TYR 10 3.631 -0.461 -5.934 72 HA TYR 10 HA TYR 10 3.599 1.431 -3.607 73 HB3 TYR 10 2HB TYR 10 6.060 1.469 -3.937 74 HD1 TYR 10 1HD TYR 10 3.635 -0.872 -2.584 75 HD2 TYR 10 2HD TYR 10 7.881 -0.157 -3.055 76 HE1 TYR 10 1HE TYR 10 4.088 -2.285 -0.666 77 HE2 TYR 10 2HE TYR 10 8.327 -1.661 -1.164 78 HH TYR 10 HH TYR 10 7.264 -3.417 0.224 79 H TYR 11 H TYR 11 3.931 3.575 -4.070 80 HA TYR 11 HA TYR 11 4.263 4.457 -6.863 81 HB3 TYR 11 2HB TYR 11 3.968 5.863 -4.192 82 HD1 TYR 11 1HD TYR 11 4.575 6.521 -7.883 83 HD2 TYR 11 2HD TYR 11 4.087 8.257 -3.976 84 HE1 TYR 11 1HE TYR 11 5.435 8.651 -8.741 85 HE2 TYR 11 2HE TYR 11 5.018 10.378 -4.812 86 HH TYR 11 HH TYR 11 5.947 11.494 -6.617 87 H SER 12 H SER 12 6.314 6.289 -6.893 88 HA SER 12 HA SER 12 8.588 5.443 -5.338 89 HB3 SER 12 2HB SER 12 8.847 3.904 -7.201 90 HG SER 12 HG SER 12 7.850 4.834 -8.969 91 H TRP 13 H TRP 13 9.117 7.448 -4.519 92 HA TRP 13 HA TRP 13 8.238 9.928 -5.682 93 HB3 TRP 13 2HB TRP 13 10.118 9.306 -3.436 94 HD1 TRP 13 HD TRP 13 7.601 12.145 -3.547 95 HE1 TRP 13 1HE TRP 13 8.812 14.343 -3.070 96 HE3 TRP 13 3HE TRP 13 12.418 10.429 -3.642 97 HZ2 TRP 13 2HZ TRP 13 11.573 15.266 -2.845 98 HZ3 TRP 13 3HZ TRP 13 14.290 11.992 -3.389 99 HH2 TRP 13 HH TRP 13 13.889 14.418 -2.970 100 H SER 14 H SER 14 11.546 8.662 -4.986 101 HA SER 14 HA SER 14 12.421 9.165 -7.734 102 HB3 SER 14 2HB SER 14 13.964 10.545 -5.510 103 HG SER 14 HG SER 14 14.510 11.742 -7.562 104 H GLY 15 H GLY 15 12.196 6.836 -7.341 105 HA2 GLY 15 1HA GLY 15 13.206 4.841 -7.458 106 HA3 GLY 15 2HA GLY 15 14.731 5.656 -7.169 107 H GLU 16 H GLU 16 13.321 6.519 -4.415 108 HA GLU 16 HA GLU 16 14.840 4.662 -2.923 109 HB3 GLU 16 2HB GLU 16 14.187 5.868 -1.014 110 HG3 GLU 16 2HG GLU 16 13.782 7.916 -3.236 111 H THR 17 H THR 17 11.316 5.116 -3.132 112 HA THR 17 HA THR 17 10.445 2.937 -1.585 113 HB THR 17 HB THR 17 9.052 3.927 -4.059 114 HG1 THR 17 1HG THR 17 8.865 5.320 -1.627 115 HG21 THR 17 3HG2 THR 17 7.994 3.216 -1.296 116 HG22 THR 17 1HG2 THR 17 7.923 2.178 -2.722 117 HG23 THR 17 2HG2 THR 17 7.010 3.699 -2.687 118 H LYS 18 H LYS 18 11.238 3.205 -5.034 119 HA LYS 18 HA LYS 18 10.382 0.650 -5.907 120 HB3 LYS 18 2HB LYS 18 12.533 2.508 -6.999 121 HG3 LYS 18 2HG LYS 18 12.802 0.310 -8.056 122 HD3 LYS 18 2HD LYS 18 10.550 0.145 -9.736 123 HE3 LYS 18 2HE LYS 18 11.239 -1.547 -7.296 124 HZ1 LYS 18 3HZ LYS 18 10.246 -3.290 -8.834 125 HZ2 LYS 18 1HZ LYS 18 9.565 -2.067 -9.684 126 HZ3 LYS 18 2HZ LYS 18 9.130 -2.239 -8.131 127 H LYS 19 H LYS 19 13.632 1.812 -4.927 128 HA LYS 19 HA LYS 19 15.012 -0.565 -5.214 129 HB3 LYS 19 2HB LYS 19 15.603 1.507 -3.044 130 HG3 LYS 19 2HG LYS 19 17.970 1.024 -4.165 131 HD3 LYS 19 2HD LYS 19 16.669 -0.606 -1.992 132 HE3 LYS 19 2HE LYS 19 19.473 -1.009 -3.133 133 HZ1 LYS 19 3HZ LYS 19 18.238 -1.764 -0.602 134 HZ2 LYS 19 1HZ LYS 19 19.811 -1.411 -0.909 135 HZ3 LYS 19 2HZ LYS 19 19.161 -2.881 -1.347 136 H MET 20 H MET 20 13.162 0.472 -2.319 137 HA MET 20 HA MET 20 13.776 -1.872 -0.720 138 HB3 MET 20 2HB MET 20 11.258 -0.155 -0.594 139 HG3 MET 20 2HG MET 20 11.390 -1.968 0.986 140 HE1 MET 20 3HE MET 20 15.438 -0.340 2.557 141 HE2 MET 20 1HE MET 20 14.787 0.033 0.938 142 HE3 MET 20 2HE MET 20 13.955 0.625 2.399 143 H ALA 21 H ALA 21 11.547 -1.439 -3.407 144 HA ALA 21 HA ALA 21 9.549 -3.302 -2.468 145 HB1 ALA 21 1HB ALA 21 9.205 -1.490 -4.265 146 HB2 ALA 21 2HB ALA 21 10.145 -2.517 -5.360 147 HB3 ALA 21 3HB ALA 21 8.623 -3.111 -4.672 148 H GLU 22 H GLU 22 12.508 -3.398 -4.464 149 HA GLU 22 HA GLU 22 12.009 -6.000 -5.332 150 HB3 GLU 22 2HB GLU 22 14.350 -6.041 -6.106 151 HG3 GLU 22 2HG GLU 22 13.392 -3.218 -6.618 152 H LYS 23 H LYS 23 13.599 -4.858 -2.395 153 HA LYS 23 HA LYS 23 14.746 -7.435 -1.715 154 HB3 LYS 23 2HB LYS 23 14.117 -5.029 0.090 155 HG3 LYS 23 2HG LYS 23 15.398 -7.718 0.554 156 HD3 LYS 23 2HD LYS 23 17.203 -5.691 0.835 157 HE3 LYS 23 2HE LYS 23 15.977 -6.157 3.593 158 HZ1 LYS 23 3HZ LYS 23 18.452 -5.811 3.473 159 HZ2 LYS 23 1HZ LYS 23 17.670 -4.705 4.365 160 HZ3 LYS 23 2HZ LYS 23 18.180 -4.306 2.868 161 H ILE 24 H ILE 24 11.799 -5.710 -0.727 162 HA ILE 24 HA ILE 24 10.707 -7.728 0.862 163 HB ILE 24 HB ILE 24 9.401 -5.540 -0.809 164 HG13 ILE 24 2HG1 ILE 24 11.208 -4.842 0.906 165 HG21 ILE 24 1HG2 ILE 24 7.706 -7.170 -0.116 166 HG22 ILE 24 2HG2 ILE 24 8.274 -7.088 1.564 167 HG23 ILE 24 3HG2 ILE 24 7.490 -5.693 0.796 168 HD11 ILE 24 3HD1 ILE 24 8.446 -3.900 1.639 169 HD12 ILE 24 1HD1 ILE 24 10.009 -3.142 1.938 170 HD13 ILE 24 2HD1 ILE 24 9.421 -3.289 0.261 171 H ASN 25 H ASN 25 10.473 -7.248 -2.688 172 HA ASN 25 HA ASN 25 8.519 -9.224 -3.147 173 HB3 ASN 25 2HB ASN 25 10.742 -8.289 -5.008 174 HD21 ASN 25 1HD2 ASN 25 7.431 -9.772 -4.730 175 HD22 ASN 25 2HD2 ASN 25 7.410 -10.369 -6.347 176 H SER 26 H SER 26 11.956 -9.701 -2.395 177 HA SER 26 HA SER 26 12.036 -12.444 -3.301 178 HB3 SER 26 2HB SER 26 14.163 -11.962 -1.737 179 HG SER 26 HG SER 26 13.950 -10.735 -4.305 180 H GLU 27 H GLU 27 11.348 -10.612 -0.271 181 HA GLU 27 HA GLU 27 11.678 -12.901 1.483 182 HB3 GLU 27 2HB GLU 27 10.352 -11.266 3.062 183 HG3 GLU 27 2HG GLU 27 12.284 -9.648 3.211 184 H ILE 28 H ILE 28 9.151 -11.928 -0.620 185 HA ILE 28 HA ILE 28 7.011 -13.113 1.050 186 HB ILE 28 HB ILE 28 7.081 -11.251 -1.339 187 HG13 ILE 28 2HG1 ILE 28 7.562 -10.380 0.974 188 HG21 ILE 28 1HG2 ILE 28 4.538 -12.331 -0.041 189 HG22 ILE 28 2HG2 ILE 28 4.651 -11.061 -1.289 190 HG23 ILE 28 3HG2 ILE 28 5.101 -12.688 -1.698 191 HD11 ILE 28 3HD1 ILE 28 4.814 -9.383 0.178 192 HD12 ILE 28 1HD1 ILE 28 6.107 -8.543 1.040 193 HD13 ILE 28 2HD1 ILE 28 6.303 -8.929 -0.690 194 H LYS 29 H LYS 29 5.414 -14.401 0.004 195 HA LYS 29 HA LYS 29 6.167 -16.734 -1.374 196 HB3 LYS 29 2HB LYS 29 3.390 -15.571 -1.616 197 HG3 LYS 29 2HG LYS 29 4.200 -18.167 -0.279 198 HD3 LYS 29 2HD LYS 29 1.752 -17.012 -0.856 199 HE3 LYS 29 2HE LYS 29 2.252 -17.398 -3.303 200 HZ1 LYS 29 3HZ LYS 29 1.594 -20.194 -2.681 201 HZ2 LYS 29 1HZ LYS 29 3.171 -19.732 -2.899 202 HZ3 LYS 29 2HZ LYS 29 2.097 -19.575 -4.116 203 H ASP 30 H ASP 30 4.291 -16.948 -3.403 204 HA ASP 30 HA ASP 30 5.667 -16.198 -5.741 205 HB3 ASP 30 2HB ASP 30 3.943 -17.450 -6.915 206 H SER 31 H SER 31 5.058 -13.814 -4.596 207 HA SER 31 HA SER 31 2.537 -12.683 -5.198 208 HB3 SER 31 2HB SER 31 3.998 -11.936 -3.392 209 HG SER 31 HG SER 31 6.033 -11.775 -4.595 210 H GLU 32 H GLU 32 2.524 -10.332 -6.226 211 HA GLU 32 HA GLU 32 3.729 -10.275 -8.900 212 HB3 GLU 32 2HB GLU 32 1.103 -8.934 -8.084 213 HG3 GLU 32 2HG GLU 32 0.790 -9.553 -10.668 214 H LEU 33 H LEU 33 4.239 -8.146 -9.453 215 HA LEU 33 HA LEU 33 4.876 -6.305 -7.223 216 HB3 LEU 33 2HB LEU 33 6.903 -7.488 -9.124 217 HG LEU 33 HG LEU 33 7.402 -5.076 -8.950 218 HD11 LEU 33 1HD1 LEU 33 6.285 -4.507 -6.813 219 HD12 LEU 33 2HD1 LEU 33 7.986 -4.055 -6.789 220 HD13 LEU 33 3HD1 LEU 33 7.464 -5.518 -5.933 221 HD21 LEU 33 3HD2 LEU 33 9.227 -6.784 -7.213 222 HD22 LEU 33 1HD2 LEU 33 9.677 -5.297 -8.055 223 HD23 LEU 33 2HD2 LEU 33 9.225 -6.740 -8.981 224 H LYS 34 H LYS 34 3.611 -4.571 -7.830 225 HA LYS 34 HA LYS 34 3.954 -3.646 -10.620 226 HB3 LYS 34 2HB LYS 34 1.677 -2.457 -9.318 227 HG3 LYS 34 2HG LYS 34 0.388 -3.881 -10.916 228 HD3 LYS 34 2HD LYS 34 2.715 -2.473 -12.277 229 HE3 LYS 34 2HE LYS 34 0.345 -1.953 -13.546 230 HZ1 LYS 34 3HZ LYS 34 0.981 -3.593 -15.194 231 HZ2 LYS 34 1HZ LYS 34 2.028 -4.299 -14.141 232 HZ3 LYS 34 2HZ LYS 34 2.316 -2.770 -14.704 233 H GLU 35 H GLU 35 3.141 -1.194 -10.536 234 HA GLU 35 HA GLU 35 4.129 0.253 -8.288 235 HB3 GLU 35 2HB GLU 35 6.225 0.061 -9.517 236 HG3 GLU 35 2HG GLU 35 4.634 1.173 -11.856 237 H VAL 36 H VAL 36 3.599 2.583 -8.536 238 HA VAL 36 HA VAL 36 1.324 3.185 -10.361 239 HB VAL 36 HB VAL 36 1.456 3.776 -7.364 240 HG11 VAL 36 1HG1 VAL 36 -0.065 5.312 -8.403 241 HG12 VAL 36 2HG1 VAL 36 -0.795 4.033 -9.394 242 HG13 VAL 36 3HG1 VAL 36 -1.056 4.078 -7.641 243 HG21 VAL 36 3HG2 VAL 36 0.037 1.447 -8.731 244 HG22 VAL 36 1HG2 VAL 36 1.278 1.377 -7.463 245 HG23 VAL 36 2HG2 VAL 36 -0.314 1.996 -7.080 246 H LYS 37 H LYS 37 0.982 5.670 -10.548 247 HA LYS 37 HA LYS 37 2.782 7.314 -8.975 248 HB3 LYS 37 2HB LYS 37 4.037 6.988 -11.028 249 HG3 LYS 37 2HG LYS 37 2.718 8.607 -12.941 250 HD3 LYS 37 2HD LYS 37 2.235 6.276 -14.059 251 HE3 LYS 37 2HE LYS 37 4.018 7.772 -14.789 252 HZ1 LYS 37 3HZ LYS 37 5.664 6.427 -12.738 253 HZ2 LYS 37 1HZ LYS 37 5.342 8.057 -12.852 254 HZ3 LYS 37 2HZ LYS 37 6.268 7.302 -13.975 255 H VAL 38 H VAL 38 2.205 9.691 -9.238 256 HA VAL 38 HA VAL 38 -0.699 10.127 -9.487 257 HB VAL 38 HB VAL 38 -0.208 12.327 -8.464 258 HG11 VAL 38 1HG1 VAL 38 0.731 10.025 -6.704 259 HG12 VAL 38 2HG1 VAL 38 -0.055 11.554 -6.202 260 HG13 VAL 38 3HG1 VAL 38 -0.956 10.350 -7.122 261 HG21 VAL 38 3HG2 VAL 38 2.557 11.265 -7.724 262 HG22 VAL 38 1HG2 VAL 38 2.274 12.411 -9.043 263 HG23 VAL 38 2HG2 VAL 38 1.854 12.880 -7.408 264 H SER 39 H SER 39 -0.982 12.608 -10.550 265 HA SER 39 HA SER 39 0.230 12.442 -13.188 266 HB3 SER 39 2HB SER 39 -1.202 14.796 -12.217 267 HG SER 39 HG SER 39 -2.052 14.426 -14.469 268 H GLU 40 H GLU 40 1.121 14.657 -13.875 269 HA GLU 40 HA GLU 40 3.475 15.119 -12.140 270 HB3 GLU 40 2HB GLU 40 3.945 14.754 -14.442 271 HG3 GLU 40 2HG GLU 40 2.351 17.268 -15.103 272 H GLY 41 H GLY 41 4.166 17.243 -11.598 273 HA2 GLY 41 1HA GLY 41 3.959 19.499 -11.172 274 HA3 GLY 41 2HA GLY 41 2.431 19.519 -12.054 275 H THR 42 H THR 42 2.206 17.023 -9.699 276 HA THR 42 HA THR 42 0.272 18.416 -8.254 277 HB THR 42 HB THR 42 1.758 15.956 -7.272 278 HG1 THR 42 1HG THR 42 1.281 15.349 -9.314 279 HG21 THR 42 3HG2 THR 42 -0.448 15.336 -6.433 280 HG22 THR 42 1HG2 THR 42 -1.181 16.775 -7.189 281 HG23 THR 42 2HG2 THR 42 -0.048 16.959 -5.842 282 H PHE 43 H PHE 43 3.721 17.665 -7.218 283 HA PHE 43 HA PHE 43 3.360 19.686 -5.058 284 HB3 PHE 43 2HB PHE 43 4.591 18.222 -3.552 285 HD1 PHE 43 1HD PHE 43 2.159 18.924 -2.873 286 HD2 PHE 43 2HD PHE 43 3.096 15.315 -5.039 287 HE1 PHE 43 1HE PHE 43 0.013 17.916 -2.131 288 HE2 PHE 43 2HE PHE 43 0.933 14.334 -4.320 289 HZ PHE 43 HZ PHE 43 -0.589 15.615 -2.833 290 H ASP 44 H ASP 44 5.724 19.919 -3.975 291 HA ASP 44 HA ASP 44 7.704 20.506 -6.102 292 HB3 ASP 44 2HB ASP 44 7.392 22.363 -3.773 293 H ALA 45 H ALA 45 9.720 21.324 -4.509 294 HA ALA 45 HA ALA 45 9.989 19.480 -2.201 295 HB1 ALA 45 1HB ALA 45 12.083 20.071 -4.345 296 HB2 ALA 45 2HB ALA 45 12.367 19.150 -2.848 297 HB3 ALA 45 3HB ALA 45 11.273 18.517 -4.097 298 H ASP 46 H ASP 46 9.038 21.940 -1.665 299 HA ASP 46 HA ASP 46 11.202 23.906 -1.267 300 HB3 ASP 46 2HB ASP 46 8.248 24.028 -0.617 301 H MET 47 H MET 47 10.207 24.921 1.192 302 HA MET 47 HA MET 47 10.562 22.688 3.089 303 HB3 MET 47 2HB MET 47 11.597 25.545 3.070 304 HG3 MET 47 2HG MET 47 11.213 23.723 5.437 305 HE1 MET 47 3HE MET 47 12.612 27.412 4.917 306 HE2 MET 47 1HE MET 47 14.313 27.193 5.380 307 HE3 MET 47 2HE MET 47 13.703 26.444 3.893 308 H TYR 48 H TYR 48 8.717 25.594 2.235 309 HA TYR 48 HA TYR 48 6.762 24.962 4.381 310 HB3 TYR 48 2HB TYR 48 8.012 26.752 5.135 311 HD1 TYR 48 1HD TYR 48 6.721 28.682 2.226 312 HD2 TYR 48 2HD TYR 48 10.198 27.214 4.307 313 HE1 TYR 48 1HE TYR 48 8.173 29.898 0.667 314 HE2 TYR 48 2HE TYR 48 11.676 28.408 2.703 315 HH TYR 48 HH TYR 48 10.483 29.764 -0.199 316 H LYS 49 H LYS 49 7.322 26.192 1.057 317 HA LYS 49 HA LYS 49 4.605 26.676 0.340 318 HB3 LYS 49 2HB LYS 49 6.672 25.350 -1.446 319 HG3 LYS 49 2HG LYS 49 4.160 26.139 -2.066 320 HD3 LYS 49 2HD LYS 49 6.092 28.363 -2.931 321 HE3 LYS 49 2HE LYS 49 3.158 27.964 -3.626 322 HZ1 LYS 49 3HZ LYS 49 3.718 29.406 -5.458 323 HZ2 LYS 49 1HZ LYS 49 5.225 29.670 -4.885 324 HZ3 LYS 49 2HZ LYS 49 3.931 30.196 -4.012 325 H THR 50 H THR 50 6.554 23.592 0.381 326 HA THR 50 HA THR 50 4.485 22.034 -0.724 327 HB THR 50 HB THR 50 5.957 20.206 0.344 328 HG1 THR 50 1HG THR 50 7.251 21.164 1.843 329 HG21 THR 50 3HG2 THR 50 6.119 20.900 -1.991 330 HG22 THR 50 1HG2 THR 50 7.733 20.573 -1.315 331 HG23 THR 50 2HG2 THR 50 7.158 22.253 -1.534 332 H SER 51 H SER 51 5.321 22.803 2.678 333 HA SER 51 HA SER 51 3.664 20.925 3.947 334 HB3 SER 51 2HB SER 51 3.946 22.340 5.876 335 HG SER 51 HG SER 51 6.195 22.740 5.757 336 H ASP 52 H ASP 52 3.083 24.186 2.645 337 HA ASP 52 HA ASP 52 0.431 24.538 3.610 338 HB3 ASP 52 2HB ASP 52 1.827 25.897 1.273 339 H ILE 53 H ILE 53 1.677 23.614 0.343 340 HA ILE 53 HA ILE 53 -0.727 23.377 -1.060 341 HB ILE 53 HB ILE 53 1.727 21.562 -1.209 342 HG13 ILE 53 2HG1 ILE 53 1.975 23.984 -1.931 343 HG21 ILE 53 1HG2 ILE 53 -0.130 20.243 -2.097 344 HG22 ILE 53 2HG2 ILE 53 -0.753 21.633 -2.987 345 HG23 ILE 53 3HG2 ILE 53 0.746 20.833 -3.478 346 HD11 ILE 53 3HD1 ILE 53 3.374 22.067 -2.836 347 HD12 ILE 53 1HD1 ILE 53 2.325 22.046 -4.272 348 HD13 ILE 53 2HD1 ILE 53 3.246 23.501 -3.884 349 H ALA 54 H ALA 54 0.859 20.713 0.731 350 HA ALA 54 HA ALA 54 -1.341 18.969 0.121 351 HB1 ALA 54 1HB ALA 54 -0.072 17.292 1.264 352 HB2 ALA 54 2HB ALA 54 1.080 18.316 0.410 353 HB3 ALA 54 3HB ALA 54 0.861 18.512 2.166 354 H LEU 55 H LEU 55 -0.831 21.247 2.666 355 HA LEU 55 HA LEU 55 -2.605 20.016 4.618 356 HB3 LEU 55 2HB LEU 55 -1.482 22.834 4.346 357 HG LEU 55 HG LEU 55 -3.402 22.717 5.894 358 HD11 LEU 55 1HD1 LEU 55 -3.372 20.421 6.658 359 HD12 LEU 55 2HD1 LEU 55 -3.147 21.467 8.046 360 HD13 LEU 55 3HD1 LEU 55 -1.751 20.611 7.340 361 HD21 LEU 55 3HD2 LEU 55 -1.584 24.288 6.291 362 HD22 LEU 55 1HD2 LEU 55 -0.687 23.064 7.210 363 HD23 LEU 55 2HD2 LEU 55 -2.248 23.711 7.826 364 H ASP 56 H ASP 56 -2.831 22.438 2.012 365 HA ASP 56 HA ASP 56 -5.373 23.476 2.520 366 HB3 ASP 56 2HB ASP 56 -4.764 22.827 -0.348 367 H GLN 57 H GLN 57 -4.454 20.480 0.957 368 HA GLN 57 HA GLN 57 -7.072 19.572 0.150 369 HB3 GLN 57 2HB GLN 57 -5.978 17.529 -0.404 370 HG3 GLN 57 2HG GLN 57 -3.757 19.540 -0.862 371 HE21 GLN 57 1HE2 GLN 57 -3.144 16.832 -0.534 372 HE22 GLN 57 2HE2 GLN 57 -2.933 16.093 -2.093 373 H ILE 58 H ILE 58 -5.500 19.568 3.240 374 HA ILE 58 HA ILE 58 -7.060 17.263 4.278 375 HB ILE 58 HB ILE 58 -5.056 19.159 5.570 376 HG13 ILE 58 2HG1 ILE 58 -4.236 17.289 4.022 377 HG21 ILE 58 1HG2 ILE 58 -5.281 17.853 7.646 378 HG22 ILE 58 2HG2 ILE 58 -6.798 18.614 7.240 379 HG23 ILE 58 3HG2 ILE 58 -6.575 16.883 6.915 380 HD11 ILE 58 3HD1 ILE 58 -2.516 16.434 5.518 381 HD12 ILE 58 1HD1 ILE 58 -2.695 18.184 5.708 382 HD13 ILE 58 2HD1 ILE 58 -3.358 17.078 6.923 383 H GLN 59 H GLN 59 -6.675 20.787 4.638 384 HA GLN 59 HA GLN 59 -8.607 21.017 6.669 385 HB3 GLN 59 2HB GLN 59 -8.200 23.488 6.351 386 HG3 GLN 59 2HG GLN 59 -5.747 21.664 6.476 387 HE21 GLN 59 1HE2 GLN 59 -5.386 24.256 5.288 388 HE22 GLN 59 2HE2 GLN 59 -4.517 25.206 6.432 389 H GLY 60 H GLY 60 -9.526 20.183 3.725 390 HA2 GLY 60 1HA GLY 60 -11.690 20.045 2.935 391 HA3 GLY 60 2HA GLY 60 -12.196 21.290 4.078 392 H ASN 61 H ASN 61 -9.604 22.682 2.677 393 HA ASN 61 HA ASN 61 -11.223 24.494 1.148 394 HB3 ASN 61 2HB ASN 61 -9.156 25.675 0.708 395 HD21 ASN 61 1HD2 ASN 61 -7.033 25.661 2.475 396 HD22 ASN 61 2HD2 ASN 61 -7.617 26.146 4.075 397 H LYS 62 H LYS 62 -8.995 21.828 0.365 398 HA LYS 62 HA LYS 62 -9.470 22.248 -2.539 399 HB3 LYS 62 2HB LYS 62 -6.950 21.002 -2.296 400 HG3 LYS 62 2HG LYS 62 -6.049 23.362 -2.655 401 HD3 LYS 62 2HD LYS 62 -8.179 22.151 -4.433 402 HE3 LYS 62 2HE LYS 62 -7.473 23.590 -6.254 403 HZ1 LYS 62 3HZ LYS 62 -8.554 25.622 -5.547 404 HZ2 LYS 62 1HZ LYS 62 -8.342 25.248 -3.975 405 HZ3 LYS 62 2HZ LYS 62 -9.345 24.319 -4.900 406 H ASP 63 H ASP 63 -9.135 20.438 -3.874 407 HA ASP 63 HA ASP 63 -10.353 17.942 -3.089 408 HB3 ASP 63 2HB ASP 63 -10.644 18.907 -5.340 409 H PHE 64 H PHE 64 -8.950 16.002 -4.220 410 HA PHE 64 HA PHE 64 -6.335 15.837 -2.836 411 HB3 PHE 64 2HB PHE 64 -7.775 14.336 -1.701 412 HD1 PHE 64 2HD PHE 64 -10.163 14.737 -2.030 413 HD2 PHE 64 1HD PHE 64 -7.974 12.147 -4.685 414 HE1 PHE 64 2HE PHE 64 -12.307 13.907 -2.971 415 HE2 PHE 64 1HE PHE 64 -10.125 11.272 -5.581 416 HZ PHE 64 HZ PHE 64 -12.285 12.167 -4.754 417 HA PRO 65 HA PRO 65 -4.922 15.033 -7.012 418 HB3 PRO 65 2HB PRO 65 -2.809 15.335 -6.094 419 HG3 PRO 65 2HG PRO 65 -2.158 14.214 -4.044 420 HD3 PRO 65 2HD PRO 65 -4.107 15.348 -3.414 421 H GLU 66 H GLU 66 -4.249 13.414 -8.494 422 HA GLU 66 HA GLU 66 -5.995 11.011 -8.336 423 HB3 GLU 66 2HB GLU 66 -5.543 11.210 -10.928 424 HG3 GLU 66 2HG GLU 66 -7.055 13.430 -10.876 425 H ILE 67 H ILE 67 -5.217 9.185 -9.846 426 HA ILE 67 HA ILE 67 -2.273 8.903 -9.861 427 HB ILE 67 HB ILE 67 -2.416 6.530 -9.505 428 HG13 ILE 67 2HG1 ILE 67 -4.652 6.122 -10.483 429 HG21 ILE 67 1HG2 ILE 67 -2.855 6.539 -7.124 430 HG22 ILE 67 2HG2 ILE 67 -2.135 8.082 -7.580 431 HG23 ILE 67 3HG2 ILE 67 -3.875 7.989 -7.261 432 HD11 ILE 67 3HD1 ILE 67 -3.608 4.441 -8.895 433 HD12 ILE 67 1HD1 ILE 67 -4.672 5.111 -7.639 434 HD13 ILE 67 2HD1 ILE 67 -5.371 4.368 -9.086 435 H GLN 68 H GLN 68 -1.556 7.392 -11.540 436 HA GLN 68 HA GLN 68 -3.123 7.772 -14.073 437 HB3 GLN 68 2HB GLN 68 -1.018 7.828 -15.207 438 HG3 GLN 68 2HG GLN 68 0.389 9.340 -13.351 439 HE21 GLN 68 1HE2 GLN 68 -2.278 11.268 -14.024 440 HE22 GLN 68 2HE2 GLN 68 -1.624 12.034 -15.442 441 H LEU 69 H LEU 69 -3.548 5.505 -12.265 442 HA LEU 69 HA LEU 69 -1.889 3.313 -13.260 443 HB3 LEU 69 2HB LEU 69 -4.168 3.174 -11.258 444 HG LEU 69 HG LEU 69 -3.163 0.930 -11.865 445 HD11 LEU 69 1HD1 LEU 69 -0.590 2.197 -10.808 446 HD12 LEU 69 2HD1 LEU 69 -0.854 1.651 -12.459 447 HD13 LEU 69 3HD1 LEU 69 -0.819 0.473 -11.152 448 HD21 LEU 69 3HD2 LEU 69 -4.047 1.294 -9.621 449 HD22 LEU 69 1HD2 LEU 69 -2.548 2.097 -9.102 450 HD23 LEU 69 2HD2 LEU 69 -2.543 0.370 -9.469 451 H ASP 70 H ASP 70 -2.537 1.602 -14.352 452 HA ASP 70 HA ASP 70 -4.874 1.914 -16.170 453 HB3 ASP 70 2HB ASP 70 -4.006 -0.466 -16.925 454 H ASN 71 H ASN 71 -6.221 -0.205 -16.424 455 HA ASN 71 HA ASN 71 -7.773 -0.394 -14.069 456 HB3 ASN 71 2HB ASN 71 -7.813 -2.320 -16.436 457 HD21 ASN 71 1HD2 ASN 71 -8.819 -3.760 -14.548 458 HD22 ASN 71 2HD2 ASN 71 -10.508 -3.435 -14.237 459 H ILE 72 H ILE 72 -7.851 -1.859 -12.408 460 HA ILE 72 HA ILE 72 -6.430 -4.430 -12.623 461 HB ILE 72 HB ILE 72 -6.013 -2.369 -10.419 462 HG13 ILE 72 2HG1 ILE 72 -4.692 -1.979 -12.512 463 HG21 ILE 72 1HG2 ILE 72 -4.382 -4.015 -9.423 464 HG22 ILE 72 2HG2 ILE 72 -6.010 -4.607 -9.381 465 HG23 ILE 72 3HG2 ILE 72 -4.880 -5.200 -10.635 466 HD11 ILE 72 3HD1 ILE 72 -3.831 -1.300 -10.287 467 HD12 ILE 72 1HD1 ILE 72 -2.794 -2.759 -10.312 468 HD13 ILE 72 2HD1 ILE 72 -2.619 -1.530 -11.575 469 H ASP 73 H ASP 73 -7.118 -5.811 -10.812 470 HA ASP 73 HA ASP 73 -9.950 -5.412 -9.933 471 HB3 ASP 73 2HB ASP 73 -8.313 -7.979 -10.264 472 H TYR 74 H TYR 74 -9.880 -4.739 -7.715 473 HA TYR 74 HA TYR 74 -7.755 -5.962 -6.054 474 HB3 TYR 74 2HB TYR 74 -7.784 -4.275 -4.697 475 HD1 TYR 74 1HD TYR 74 -5.954 -3.857 -6.613 476 HD2 TYR 74 2HD TYR 74 -9.756 -1.829 -6.352 477 HE1 TYR 74 1HE TYR 74 -5.137 -2.098 -8.168 478 HE2 TYR 74 2HE TYR 74 -8.982 -0.120 -7.926 479 HH TYR 74 HH TYR 74 -7.272 0.585 -9.292 480 H ASN 75 H ASN 75 -8.974 -7.799 -6.198 481 HA ASN 75 HA ASN 75 -10.597 -8.182 -3.748 482 HB3 ASN 75 2HB ASN 75 -11.540 -9.118 -6.496 483 HD21 ASN 75 1HD2 ASN 75 -13.071 -8.208 -3.282 484 HD22 ASN 75 2HD2 ASN 75 -13.760 -9.780 -3.074 485 H ASN 76 H ASN 76 -9.327 -9.781 -6.691 486 HA ASN 76 HA ASN 76 -9.287 -12.362 -5.535 487 HB3 ASN 76 2HB ASN 76 -9.498 -11.885 -7.956 488 HD21 ASN 76 1HD2 ASN 76 -8.609 -9.722 -8.534 489 HD22 ASN 76 2HD2 ASN 76 -6.957 -9.637 -9.051 490 H TYR 77 H TYR 77 -7.211 -10.040 -4.552 491 HA TYR 77 HA TYR 77 -4.794 -11.714 -4.161 492 HB3 TYR 77 2HB TYR 77 -3.824 -9.717 -3.217 493 HD1 TYR 77 2HD TYR 77 -2.763 -10.826 -5.345 494 HD2 TYR 77 1HD TYR 77 -5.714 -7.698 -5.516 495 HE1 TYR 77 2HE TYR 77 -2.318 -10.573 -7.763 496 HE2 TYR 77 1HE TYR 77 -5.182 -7.337 -7.887 497 HH TYR 77 HH TYR 77 -2.900 -9.417 -9.712 498 H ASP 78 H ASP 78 -4.140 -12.209 -1.972 499 HA ASP 78 HA ASP 78 -6.338 -12.179 0.050 500 HB3 ASP 78 2HB ASP 78 -3.725 -13.724 0.102 501 H LEU 79 H LEU 79 -3.044 -11.084 -0.693 502 HA LEU 79 HA LEU 79 -3.090 -9.296 1.691 503 HB3 LEU 79 2HB LEU 79 -0.858 -11.064 0.632 504 HG LEU 79 HG LEU 79 0.065 -8.896 1.357 505 HD11 LEU 79 1HD1 LEU 79 0.053 -8.273 3.764 506 HD12 LEU 79 2HD1 LEU 79 -1.077 -9.586 4.096 507 HD13 LEU 79 3HD1 LEU 79 -1.577 -8.205 3.091 508 HD21 LEU 79 3HD2 LEU 79 1.696 -9.844 2.987 509 HD22 LEU 79 1HD2 LEU 79 1.376 -10.952 1.641 510 HD23 LEU 79 2HD2 LEU 79 0.626 -11.224 3.227 511 H ILE 80 H ILE 80 -2.474 -7.180 1.193 512 HA ILE 80 HA ILE 80 -1.171 -6.682 -1.419 513 HB ILE 80 HB ILE 80 -3.555 -5.071 -0.443 514 HG13 ILE 80 2HG1 ILE 80 -4.382 -7.178 -1.278 515 HG21 ILE 80 1HG2 ILE 80 -3.303 -3.815 -2.538 516 HG22 ILE 80 2HG2 ILE 80 -1.785 -3.756 -1.664 517 HG23 ILE 80 3HG2 ILE 80 -1.948 -4.857 -3.035 518 HD11 ILE 80 3HD1 ILE 80 -4.635 -5.293 -3.661 519 HD12 ILE 80 1HD1 ILE 80 -5.712 -6.601 -3.183 520 HD13 ILE 80 2HD1 ILE 80 -5.590 -5.157 -2.162 521 H LEU 81 H LEU 81 0.586 -5.433 -1.139 522 HA LEU 81 HA LEU 81 0.879 -3.919 1.411 523 HB3 LEU 81 2HB LEU 81 3.328 -3.967 0.553 524 HG LEU 81 HG LEU 81 2.729 -5.352 2.402 525 HD11 LEU 81 1HD1 LEU 81 0.859 -6.592 1.919 526 HD12 LEU 81 2HD1 LEU 81 2.169 -7.687 2.321 527 HD13 LEU 81 3HD1 LEU 81 1.684 -7.496 0.635 528 HD21 LEU 81 3HD2 LEU 81 4.965 -5.591 1.303 529 HD22 LEU 81 1HD2 LEU 81 4.317 -6.927 0.343 530 HD23 LEU 81 2HD2 LEU 81 4.462 -7.087 2.110 531 H ILE 82 H ILE 82 1.237 -1.674 1.332 532 HA ILE 82 HA ILE 82 1.461 -0.447 -1.358 533 HB ILE 82 HB ILE 82 -0.303 0.410 0.973 534 HG13 ILE 82 2HG1 ILE 82 -0.809 -0.960 -1.685 535 HG21 ILE 82 1HG2 ILE 82 0.523 2.436 0.010 536 HG22 ILE 82 2HG2 ILE 82 0.405 1.808 -1.640 537 HG23 ILE 82 3HG2 ILE 82 -1.057 2.188 -0.705 538 HD11 ILE 82 3HD1 ILE 82 -2.769 -1.874 -0.438 539 HD12 ILE 82 1HD1 ILE 82 -1.256 -2.257 0.401 540 HD13 ILE 82 2HD1 ILE 82 -2.282 -0.939 0.984 541 H GLY 83 H GLY 83 2.999 1.028 -1.707 542 HA2 GLY 83 1HA GLY 83 4.530 2.044 0.635 543 HA3 GLY 83 2HA GLY 83 5.230 1.604 -0.912 544 H SER 84 H SER 84 4.948 4.351 0.668 545 HA SER 84 HA SER 84 4.595 6.015 -1.753 546 HB3 SER 84 2HB SER 84 2.384 5.940 -1.106 547 HG SER 84 HG SER 84 2.523 5.324 1.118 548 HA PRO 85 HA PRO 85 7.747 8.300 0.548 549 HB3 PRO 85 2HB PRO 85 8.098 9.587 -1.406 550 HG3 PRO 85 2HG PRO 85 6.275 10.325 -2.707 551 HD3 PRO 85 2HD PRO 85 6.024 7.978 -2.518 552 H VAL 86 H VAL 86 8.043 10.148 2.074 553 HA VAL 86 HA VAL 86 5.560 11.090 3.422 554 HB VAL 86 HB VAL 86 8.193 10.453 4.834 555 HG11 VAL 86 1HG1 VAL 86 6.152 10.568 6.738 556 HG12 VAL 86 2HG1 VAL 86 7.234 11.911 6.298 557 HG13 VAL 86 3HG1 VAL 86 5.631 11.795 5.585 558 HG21 VAL 86 3HG2 VAL 86 5.641 8.834 4.845 559 HG22 VAL 86 1HG2 VAL 86 7.213 8.387 4.118 560 HG23 VAL 86 2HG2 VAL 86 7.082 8.564 5.865 561 H TRP 87 H TRP 87 5.397 13.237 3.432 562 HA TRP 87 HA TRP 87 7.654 15.006 2.883 563 HB3 TRP 87 2HB TRP 87 5.272 16.485 3.446 564 HD1 TRP 87 HD TRP 87 6.264 18.385 1.928 565 HE1 TRP 87 1HE TRP 87 6.813 18.621 -0.607 566 HE3 TRP 87 3HE TRP 87 5.461 13.565 0.422 567 HZ2 TRP 87 2HZ TRP 87 6.954 16.969 -2.886 568 HZ3 TRP 87 3HZ TRP 87 5.655 12.967 -1.989 569 HH2 TRP 87 HH TRP 87 6.417 14.668 -3.645 570 H SER 88 H SER 88 7.190 17.127 4.418 571 HA SER 88 HA SER 88 8.357 16.627 6.845 572 HB3 SER 88 2HB SER 88 8.162 19.037 7.063 573 HG SER 88 HG SER 88 8.877 19.556 4.924 574 H GLY 89 H GLY 89 5.494 15.450 6.553 575 HA2 GLY 89 1HA GLY 89 5.048 15.282 9.314 576 HA3 GLY 89 2HA GLY 89 3.788 16.311 8.666 577 H TYR 90 H TYR 90 3.394 15.288 6.146 578 HA TYR 90 HA TYR 90 2.090 12.706 6.789 579 HB3 TYR 90 2HB TYR 90 0.330 14.059 6.817 580 HD1 TYR 90 1HD TYR 90 2.223 15.852 4.025 581 HD2 TYR 90 2HD TYR 90 -0.307 16.126 7.514 582 HE1 TYR 90 1HE TYR 90 2.484 18.316 4.030 583 HE2 TYR 90 2HE TYR 90 -0.075 18.559 7.519 584 HH TYR 90 HH TYR 90 1.334 20.461 5.049 585 HA PRO 91 HA PRO 91 3.297 11.404 2.596 586 HB3 PRO 91 2HB PRO 91 2.279 9.403 2.770 587 HG3 PRO 91 2HG PRO 91 0.475 9.063 4.267 588 HD3 PRO 91 2HD PRO 91 1.833 10.348 5.665 589 H ALA 92 H ALA 92 2.751 11.990 0.463 590 HA ALA 92 HA ALA 92 1.394 14.533 0.024 591 HB1 ALA 92 1HB ALA 92 2.282 13.609 -2.411 592 HB2 ALA 92 2HB ALA 92 3.249 14.492 -1.251 593 HB3 ALA 92 3HB ALA 92 3.341 12.734 -1.309 594 H THR 93 H THR 93 -0.352 12.580 0.938 595 HA THR 93 HA THR 93 -2.145 11.136 0.530 596 HB THR 93 HB THR 93 -3.945 12.573 -0.406 597 HG1 THR 93 1HG THR 93 -2.659 13.526 -1.995 598 HG21 THR 93 3HG2 THR 93 -3.230 12.879 1.961 599 HG22 THR 93 1HG2 THR 93 -3.798 14.383 1.222 600 HG23 THR 93 2HG2 THR 93 -2.062 14.121 1.446 601 HA PRO 94 HA PRO 94 -1.464 9.936 -3.961 602 HB3 PRO 94 2HB PRO 94 0.954 9.704 -3.699 603 HG3 PRO 94 2HG PRO 94 1.835 8.734 -1.765 604 HD3 PRO 94 2HD PRO 94 0.624 10.426 -0.847 605 H ILE 95 H ILE 95 -2.327 8.082 -1.190 606 HA ILE 95 HA ILE 95 -3.067 5.767 -2.899 607 HB ILE 95 HB ILE 95 -2.990 5.822 0.143 608 HG13 ILE 95 2HG1 ILE 95 -0.836 4.618 -0.013 609 HG21 ILE 95 1HG2 ILE 95 -2.864 3.414 -0.094 610 HG22 ILE 95 2HG2 ILE 95 -4.269 3.992 -0.961 611 HG23 ILE 95 3HG2 ILE 95 -2.839 3.526 -1.872 612 HD11 ILE 95 3HD1 ILE 95 -0.744 4.045 -2.461 613 HD12 ILE 95 1HD1 ILE 95 -0.480 5.758 -2.823 614 HD13 ILE 95 2HD1 ILE 95 0.700 4.868 -1.879 615 H LYS 96 H LYS 96 -4.436 8.636 -1.665 616 HA LYS 96 HA LYS 96 -6.940 7.760 -0.649 617 HB3 LYS 96 2HB LYS 96 -5.970 10.360 -1.879 618 HG3 LYS 96 2HG LYS 96 -8.402 10.438 -2.101 619 HD3 LYS 96 2HD LYS 96 -8.364 9.425 0.732 620 HE3 LYS 96 2HE LYS 96 -9.316 11.650 1.106 621 HZ1 LYS 96 3HZ LYS 96 -11.223 10.943 -1.023 622 HZ2 LYS 96 1HZ LYS 96 -10.190 12.213 -1.049 623 HZ3 LYS 96 2HZ LYS 96 -11.424 12.184 0.037 624 H THR 97 H THR 97 -6.028 8.665 -4.079 625 HA THR 97 HA THR 97 -8.632 8.355 -5.147 626 HB THR 97 HB THR 97 -6.018 7.500 -6.463 627 HG1 THR 97 1HG THR 97 -7.016 10.126 -6.566 628 HG21 THR 97 3HG2 THR 97 -7.077 8.510 -8.532 629 HG22 THR 97 1HG2 THR 97 -8.607 8.562 -7.640 630 HG23 THR 97 2HG2 THR 97 -7.820 7.009 -7.955 631 H LEU 98 H LEU 98 -6.201 5.946 -4.334 632 HA LEU 98 HA LEU 98 -7.444 3.793 -5.858 633 HB3 LEU 98 2HB LEU 98 -5.086 3.736 -3.921 634 HG LEU 98 HG LEU 98 -5.633 1.515 -4.709 635 HD11 LEU 98 1HD1 LEU 98 -5.380 1.133 -7.289 636 HD12 LEU 98 2HD1 LEU 98 -5.841 2.832 -7.441 637 HD13 LEU 98 3HD1 LEU 98 -6.937 1.673 -6.662 638 HD21 LEU 98 3HD2 LEU 98 -3.256 2.309 -4.643 639 HD22 LEU 98 1HD2 LEU 98 -3.345 2.669 -6.382 640 HD23 LEU 98 2HD2 LEU 98 -3.523 1.006 -5.805 641 H LEU 99 H LEU 99 -6.990 4.780 -2.478 642 HA LEU 99 HA LEU 99 -8.161 2.559 -1.176 643 HB3 LEU 99 2HB LEU 99 -8.819 4.622 0.471 644 HG LEU 99 HG LEU 99 -6.134 3.410 -0.157 645 HD11 LEU 99 1HD1 LEU 99 -5.676 5.697 0.658 646 HD12 LEU 99 2HD1 LEU 99 -5.175 4.458 1.824 647 HD13 LEU 99 3HD1 LEU 99 -6.673 5.381 2.084 648 HD21 LEU 99 3HD2 LEU 99 -7.843 2.007 0.906 649 HD22 LEU 99 1HD2 LEU 99 -8.012 3.186 2.224 650 HD23 LEU 99 2HD2 LEU 99 -6.484 2.297 2.000 651 H ASP 100 H ASP 100 -9.648 5.539 -2.641 652 HA ASP 100 HA ASP 100 -12.261 4.967 -1.740 653 HB3 ASP 100 2HB ASP 100 -11.852 6.246 -4.416 654 H GLN 101 H GLN 101 -10.453 3.582 -4.383 655 HA GLN 101 HA GLN 101 -12.823 2.187 -5.479 656 HB3 GLN 101 2HB GLN 101 -11.641 3.440 -7.120 657 HG3 GLN 101 2HG GLN 101 -9.271 1.740 -6.439 658 HE21 GLN 101 1HE2 GLN 101 -9.245 5.088 -7.486 659 HE22 GLN 101 2HE2 GLN 101 -8.629 4.851 -9.123 660 H MET 102 H MET 102 -10.818 1.580 -3.005 661 HA MET 102 HA MET 102 -10.185 -1.233 -3.671 662 HB3 MET 102 2HB MET 102 -9.179 -0.737 -1.141 663 HG3 MET 102 2HG MET 102 -7.333 0.466 -2.963 664 HE1 MET 102 3HE MET 102 -7.269 -3.884 -1.371 665 HE2 MET 102 1HE MET 102 -8.445 -2.686 -0.807 666 HE3 MET 102 2HE MET 102 -8.485 -3.237 -2.500 667 H LYS 103 H LYS 103 -12.890 0.226 -2.364 668 HA LYS 103 HA LYS 103 -13.171 -0.857 0.126 669 HB3 LYS 103 2HB LYS 103 -15.721 -0.646 -0.349 670 HG3 LYS 103 2HG LYS 103 -15.623 1.857 -0.872 671 HD3 LYS 103 2HD LYS 103 -14.095 0.650 1.456 672 HE3 LYS 103 2HE LYS 103 -14.951 3.550 1.035 673 HZ1 LYS 103 3HZ LYS 103 -14.257 2.005 3.416 674 HZ2 LYS 103 1HZ LYS 103 -15.286 3.266 3.265 675 HZ3 LYS 103 2HZ LYS 103 -13.656 3.533 3.297 676 H ASN 104 H ASN 104 -13.560 -2.633 -2.785 677 HA ASN 104 HA ASN 104 -15.237 -4.758 -1.631 678 HB3 ASN 104 2HB ASN 104 -14.973 -5.787 -3.940 679 HD21 ASN 104 1HD2 ASN 104 -15.239 -2.235 -3.960 680 HD22 ASN 104 2HD2 ASN 104 -16.982 -2.197 -3.791 681 H TYR 105 H TYR 105 -12.122 -4.157 -0.992 682 HA TYR 105 HA TYR 105 -10.758 -6.523 -1.682 683 HB3 TYR 105 2HB TYR 105 -9.958 -4.240 -0.600 684 HD1 TYR 105 1HD TYR 105 -12.100 -4.142 1.327 685 HD2 TYR 105 2HD TYR 105 -8.191 -5.948 1.770 686 HE1 TYR 105 1HE TYR 105 -12.333 -4.065 3.782 687 HE2 TYR 105 2HE TYR 105 -8.419 -5.810 4.222 688 HH TYR 105 HH TYR 105 -10.450 -5.862 5.841 689 H ARG 106 H ARG 106 -9.991 -8.200 -0.281 690 HA ARG 106 HA ARG 106 -11.528 -9.026 2.093 691 HB3 ARG 106 2HB ARG 106 -11.793 -11.251 1.256 692 HG3 ARG 106 2HG ARG 106 -13.058 -9.172 -0.590 693 HD3 ARG 106 2HD ARG 106 -14.239 -11.726 0.480 694 HE ARG 106 HE ARG 106 -15.549 -9.755 -0.636 695 HH11 ARG 106 1HH1 ARG 106 -14.296 -12.611 -2.345 696 HH12 ARG 106 2HH1 ARG 106 -15.676 -12.725 -3.401 697 HH21 ARG 106 1HH2 ARG 106 -17.332 -9.925 -2.025 698 HH22 ARG 106 2HH2 ARG 106 -17.430 -11.138 -3.223 699 H GLY 107 H GLY 107 -9.514 -8.872 3.452 700 HA2 GLY 107 1HA GLY 107 -7.564 -10.749 3.413 701 HA3 GLY 107 2HA GLY 107 -7.030 -9.654 2.150 702 H GLU 108 H GLU 108 -5.130 -9.519 3.547 703 HA GLU 108 HA GLU 108 -5.349 -7.553 5.793 704 HB3 GLU 108 2HB GLU 108 -2.945 -8.210 6.112 705 HG3 GLU 108 2HG GLU 108 -4.867 -9.341 7.401 706 H VAL 109 H VAL 109 -4.167 -5.450 5.597 707 HA VAL 109 HA VAL 109 -2.874 -5.077 2.949 708 HB VAL 109 HB VAL 109 -4.997 -3.280 4.136 709 HG11 VAL 109 1HG1 VAL 109 -4.925 -2.380 1.759 710 HG12 VAL 109 2HG1 VAL 109 -3.310 -2.341 2.500 711 HG13 VAL 109 3HG1 VAL 109 -3.705 -3.615 1.359 712 HG21 VAL 109 3HG2 VAL 109 -6.557 -4.037 2.387 713 HG22 VAL 109 1HG2 VAL 109 -5.443 -5.345 1.942 714 HG23 VAL 109 2HG2 VAL 109 -6.205 -5.310 3.550 715 H ALA 110 H ALA 110 -0.850 -4.890 3.907 716 HA ALA 110 HA ALA 110 -0.519 -3.071 6.235 717 HB1 ALA 110 1HB ALA 110 0.637 -5.173 6.354 718 HB2 ALA 110 2HB ALA 110 1.576 -4.775 4.882 719 HB3 ALA 110 3HB ALA 110 1.761 -3.811 6.374 720 H SER 111 H SER 111 1.026 -1.192 6.257 721 HA SER 111 HA SER 111 1.433 -0.130 3.481 722 HB3 SER 111 2HB SER 111 0.948 1.949 5.431 723 HG SER 111 HG SER 111 -0.971 0.997 3.625 724 H PHE 112 H PHE 112 3.211 1.228 3.118 725 HA PHE 112 HA PHE 112 5.491 0.904 5.051 726 HB3 PHE 112 2HB PHE 112 6.843 0.286 3.126 727 HD1 PHE 112 2HD PHE 112 3.433 -1.012 2.349 728 HD2 PHE 112 1HD PHE 112 7.322 -1.888 3.928 729 HE1 PHE 112 2HE PHE 112 2.691 -3.295 2.890 730 HE2 PHE 112 1HE PHE 112 6.677 -4.304 4.116 731 HZ PHE 112 HZ PHE 112 4.361 -4.974 3.740 732 H PHE 113 H PHE 113 7.063 2.527 4.868 733 HA PHE 113 HA PHE 113 6.749 4.587 2.800 734 HB3 PHE 113 2HB PHE 113 6.721 6.372 4.494 735 HD1 PHE 113 2HD PHE 113 4.405 3.677 5.776 736 HD2 PHE 113 1HD PHE 113 4.786 7.266 3.404 737 HE1 PHE 113 2HE PHE 113 1.952 3.853 5.653 738 HE2 PHE 113 1HE PHE 113 2.317 7.381 3.271 739 HZ PHE 113 HZ PHE 113 0.905 5.700 4.369 740 H THR 114 H THR 114 8.640 6.179 3.054 741 HA THR 114 HA THR 114 10.919 5.167 4.594 742 HB THR 114 HB THR 114 12.406 5.562 2.602 743 HG1 THR 114 1HG THR 114 11.324 6.639 1.174 744 HG21 THR 114 3HG2 THR 114 11.742 3.220 3.187 745 HG22 THR 114 1HG2 THR 114 11.958 3.445 1.438 746 HG23 THR 114 2HG2 THR 114 10.332 3.373 2.113 747 H SER 115 H SER 115 12.151 6.967 5.364 748 HA SER 115 HA SER 115 11.816 9.539 4.217 749 HB3 SER 115 2HB SER 115 11.025 9.540 7.128 750 HG SER 115 HG SER 115 10.221 11.048 4.825 751 H ALA 116 H ALA 116 12.794 11.068 6.192 752 HA ALA 116 HA ALA 116 15.607 10.153 6.305 753 HB1 ALA 116 1HB ALA 116 14.313 12.889 6.672 754 HB2 ALA 116 2HB ALA 116 16.058 12.541 6.585 755 HB3 ALA 116 3HB ALA 116 15.028 12.264 5.170 756 H GLY 117 H GLY 117 13.672 9.057 8.272 757 HA2 GLY 117 1HA GLY 117 13.622 8.689 10.559 758 HA3 GLY 117 2HA GLY 117 15.011 9.773 10.702 759 H THR 118 H THR 118 12.378 11.295 9.065 760 HA THR 118 HA THR 118 11.634 12.852 11.443 761 HB THR 118 HB THR 118 10.486 14.170 9.560 762 HG1 THR 118 1HG THR 118 11.279 13.723 7.467 763 HG21 THR 118 3HG2 THR 118 12.699 14.784 10.601 764 HG22 THR 118 1HG2 THR 118 12.560 15.269 8.899 765 HG23 THR 118 2HG2 THR 118 13.525 13.844 9.336 766 H ASN 119 H ASN 119 9.340 13.290 11.723 767 HA ASN 119 HA ASN 119 7.199 12.815 12.080 768 HB3 ASN 119 2HB ASN 119 5.944 12.767 9.920 769 HD21 ASN 119 1HD2 ASN 119 8.176 14.281 8.050 770 HD22 ASN 119 2HD2 ASN 119 8.391 15.741 9.017 771 H HIS 120 H HIS 120 8.763 10.348 12.615 772 HA HIS 120 HA HIS 120 7.494 8.181 11.309 773 HB3 HIS 120 2HB HIS 120 9.830 8.334 12.425 774 HD1 HIS 120 1HD HIS 120 9.175 9.727 15.030 775 HD2 HIS 120 2HD HIS 120 9.150 5.513 14.594 776 HE1 HIS 120 1HE HIS 120 9.553 8.717 17.353 777 H LYS 121 H LYS 121 6.210 10.032 13.725 778 HA LYS 121 HA LYS 121 4.325 7.914 14.726 779 HB3 LYS 121 2HB LYS 121 5.210 10.728 15.547 780 HG3 LYS 121 2HG LYS 121 2.682 9.345 16.451 781 HD3 LYS 121 2HD LYS 121 3.999 11.830 17.612 782 HE3 LYS 121 2HE LYS 121 2.328 11.219 19.483 783 HZ1 LYS 121 3HZ LYS 121 0.392 12.061 18.254 784 HZ2 LYS 121 1HZ LYS 121 1.212 12.036 16.865 785 HZ3 LYS 121 2HZ LYS 121 1.696 13.030 18.117 786 H ALA 122 H ALA 122 4.534 11.007 13.156 787 HA ALA 122 HA ALA 122 1.817 11.542 12.733 788 HB1 ALA 122 1HB ALA 122 3.540 13.271 12.646 789 HB2 ALA 122 2HB ALA 122 4.280 12.501 11.228 790 HB3 ALA 122 3HB ALA 122 2.699 13.237 11.079 791 H TYR 123 H TYR 123 4.182 10.039 10.474 792 HA TYR 123 HA TYR 123 2.555 9.790 8.230 793 HB3 TYR 123 2HB TYR 123 5.094 9.260 8.816 794 HD1 TYR 123 1HD TYR 123 5.554 7.881 10.745 795 HD2 TYR 123 2HD TYR 123 4.045 6.259 7.113 796 HE1 TYR 123 1HE TYR 123 6.485 5.625 11.388 797 HE2 TYR 123 2HE TYR 123 4.958 3.990 7.754 798 HH TYR 123 HH TYR 123 6.075 3.201 10.882 799 H VAL 124 H VAL 124 2.931 7.467 10.919 800 HA VAL 124 HA VAL 124 1.420 5.337 9.951 801 HB VAL 124 HB VAL 124 1.601 6.383 12.849 802 HG11 VAL 124 1HG1 VAL 124 0.054 4.432 12.483 803 HG12 VAL 124 2HG1 VAL 124 1.467 3.515 11.918 804 HG13 VAL 124 3HG1 VAL 124 1.411 4.110 13.568 805 HG21 VAL 124 3HG2 VAL 124 3.602 4.739 11.292 806 HG22 VAL 124 1HG2 VAL 124 3.856 6.330 12.064 807 HG23 VAL 124 2HG2 VAL 124 3.615 4.901 13.048 808 H SER 125 H SER 125 0.465 8.196 12.019 809 HA SER 125 HA SER 125 -2.316 7.414 12.183 810 HB3 SER 125 2HB SER 125 -0.536 9.522 13.188 811 HG SER 125 HG SER 125 -3.244 10.260 13.245 812 H HIS 126 H HIS 126 -0.518 9.748 10.111 813 HA HIS 126 HA HIS 126 -2.927 10.760 8.938 814 HB3 HIS 126 2HB HIS 126 -0.225 11.026 7.635 815 HD1 HIS 126 1HD HIS 126 -2.467 11.679 5.782 816 HD2 HIS 126 2HD HIS 126 -1.794 14.043 9.189 817 HE1 HIS 126 1HE HIS 126 -3.575 13.926 5.318 818 H PHE 127 H PHE 127 -1.069 7.871 8.245 819 HA PHE 127 HA PHE 127 -2.344 7.477 5.633 820 HB3 PHE 127 2HB PHE 127 -1.021 5.590 7.615 821 HD1 PHE 127 1HD PHE 127 -1.947 5.657 3.881 822 HD2 PHE 127 2HD PHE 127 -2.103 3.514 7.673 823 HE1 PHE 127 1HE PHE 127 -3.135 3.813 2.814 824 HE2 PHE 127 2HE PHE 127 -3.348 1.688 6.529 825 HZ PHE 127 HZ PHE 127 -3.887 1.875 4.143 826 H ASN 128 H ASN 128 -2.862 6.320 8.990 827 HA ASN 128 HA ASN 128 -5.170 4.846 8.539 828 HB3 ASN 128 2HB ASN 128 -5.726 5.475 11.017 829 HD21 ASN 128 1HD2 ASN 128 -2.217 4.802 10.767 830 HD22 ASN 128 2HD2 ASN 128 -2.393 3.105 11.130 831 H GLU 129 H GLU 129 -5.108 8.344 9.457 832 HA GLU 129 HA GLU 129 -7.828 8.869 9.590 833 HB3 GLU 129 2HB GLU 129 -7.061 11.132 8.402 834 HG3 GLU 129 2HG GLU 129 -5.851 10.255 11.022 835 H TRP 130 H TRP 130 -5.985 8.273 6.652 836 HA TRP 130 HA TRP 130 -8.238 9.183 4.926 837 HB3 TRP 130 2HB TRP 130 -6.464 9.336 3.196 838 HD1 TRP 130 HD TRP 130 -5.106 10.700 6.531 839 HE1 TRP 130 1HE TRP 130 -5.760 13.147 6.835 840 HE3 TRP 130 3HE TRP 130 -7.561 11.369 2.135 841 HZ2 TRP 130 2HZ TRP 130 -7.134 15.183 5.300 842 HZ3 TRP 130 3HZ TRP 130 -8.525 13.602 1.548 843 HH2 TRP 130 HH TRP 130 -8.310 15.499 3.128 844 H ALA 131 H ALA 131 -7.141 6.359 6.282 845 HA ALA 131 HA ALA 131 -8.109 4.686 4.024 846 HB1 ALA 131 1HB ALA 131 -5.592 4.716 4.218 847 HB2 ALA 131 2HB ALA 131 -5.759 4.079 5.867 848 HB3 ALA 131 3HB ALA 131 -6.314 3.116 4.479 849 H ASP 132 H ASP 132 -8.770 5.659 7.109 850 HA ASP 132 HA ASP 132 -9.287 3.326 8.530 851 HB3 ASP 132 2HB ASP 132 -10.825 5.942 8.586 852 H GLY 133 H GLY 133 -10.585 1.698 7.979 853 HA2 GLY 133 1HA GLY 133 -12.974 1.120 7.225 854 HA3 GLY 133 2HA GLY 133 -12.632 2.166 5.853 855 H LEU 134 H LEU 134 -9.676 0.696 6.480 856 HA LEU 134 HA LEU 134 -10.264 -1.838 5.037 857 HB3 LEU 134 2HB LEU 134 -8.034 -1.434 3.848 858 HG LEU 134 HG LEU 134 -8.722 -0.112 2.032 859 HD11 LEU 134 1HD1 LEU 134 -10.713 -1.230 1.308 860 HD12 LEU 134 2HD1 LEU 134 -11.182 -1.589 2.983 861 HD13 LEU 134 3HD1 LEU 134 -9.731 -2.327 2.281 862 HD21 LEU 134 3HD2 LEU 134 -9.975 1.592 3.796 863 HD22 LEU 134 1HD2 LEU 134 -11.333 0.856 2.907 864 HD23 LEU 134 2HD2 LEU 134 -9.992 1.691 2.059 865 H ASN 135 H ASN 135 -9.140 -3.551 5.923 866 HA ASN 135 HA ASN 135 -7.895 -3.246 8.459 867 HB3 ASN 135 2HB ASN 135 -8.005 -5.612 6.576 868 HD21 ASN 135 1HD2 ASN 135 -6.766 -7.296 7.181 869 HD22 ASN 135 2HD2 ASN 135 -6.124 -7.542 8.827 870 H VAL 136 H VAL 136 -5.999 -2.067 8.484 871 HA VAL 136 HA VAL 136 -3.702 -3.135 6.963 872 HB VAL 136 HB VAL 136 -3.913 -0.790 6.629 873 HG11 VAL 136 1HG1 VAL 136 -5.338 -0.280 8.525 874 HG12 VAL 136 2HG1 VAL 136 -3.962 -0.549 9.626 875 HG13 VAL 136 3HG1 VAL 136 -3.944 0.814 8.493 876 HG21 VAL 136 3HG2 VAL 136 -1.727 -1.193 8.716 877 HG22 VAL 136 1HG2 VAL 136 -1.579 -1.455 6.962 878 HG23 VAL 136 2HG2 VAL 136 -1.848 0.164 7.583 879 H ILE 137 H ILE 137 -2.880 -4.753 7.889 880 HA ILE 137 HA ILE 137 -3.025 -5.294 10.714 881 HB ILE 137 HB ILE 137 -1.526 -7.190 10.241 882 HG13 ILE 137 2HG1 ILE 137 -0.169 -6.063 8.427 883 HG21 ILE 137 1HG2 ILE 137 -3.758 -6.990 8.173 884 HG22 ILE 137 2HG2 ILE 137 -3.181 -8.428 9.056 885 HG23 ILE 137 3HG2 ILE 137 -4.049 -7.164 9.915 886 HD11 ILE 137 3HD1 ILE 137 0.002 -8.473 8.720 887 HD12 ILE 137 1HD1 ILE 137 -1.388 -8.729 7.645 888 HD13 ILE 137 2HD1 ILE 137 0.090 -8.012 6.999 889 H GLY 138 H GLY 138 -0.697 -3.444 8.823 890 HA2 GLY 138 1HA GLY 138 0.515 -2.459 11.192 891 HA3 GLY 138 2HA GLY 138 1.575 -3.643 10.413 892 H VAL 139 H VAL 139 2.157 -0.985 10.739 893 HA VAL 139 HA VAL 139 2.845 -0.324 8.066 894 HB VAL 139 HB VAL 139 1.056 1.161 8.103 895 HG11 VAL 139 1HG1 VAL 139 0.484 2.617 9.973 896 HG12 VAL 139 2HG1 VAL 139 0.193 0.887 10.109 897 HG13 VAL 139 3HG1 VAL 139 1.585 1.594 10.973 898 HG21 VAL 139 3HG2 VAL 139 3.227 2.906 9.227 899 HG22 VAL 139 1HG2 VAL 139 3.164 2.345 7.542 900 HG23 VAL 139 2HG2 VAL 139 1.888 3.389 8.176 901 H ALA 140 H ALA 140 4.879 0.192 7.794 902 HA ALA 140 HA ALA 140 6.578 0.996 10.003 903 HB1 ALA 140 1HB ALA 140 7.200 -1.585 8.512 904 HB2 ALA 140 2HB ALA 140 8.086 -0.909 9.872 905 HB3 ALA 140 3HB ALA 140 6.454 -1.565 10.133 906 H ARG 141 H ARG 141 8.979 0.816 9.073 907 HA ARG 141 HA ARG 141 8.947 1.661 6.239 908 HB3 ARG 141 2HB ARG 141 10.921 3.027 6.616 909 HG3 ARG 141 2HG ARG 141 8.341 3.780 7.354 910 HD3 ARG 141 2HD ARG 141 9.687 3.677 9.790 911 HE ARG 141 HE ARG 141 11.139 5.522 9.525 912 HH11 ARG 141 1HH1 ARG 141 7.742 6.436 8.879 913 HH12 ARG 141 2HH1 ARG 141 8.105 8.128 8.745 914 HH21 ARG 141 1HH2 ARG 141 11.530 7.764 9.414 915 HH22 ARG 141 2HH2 ARG 141 10.213 8.927 9.480 916 H ASP 142 H ASP 142 10.720 1.036 5.185 917 HA ASP 142 HA ASP 142 12.171 -0.512 4.364 918 HB3 ASP 142 2HB ASP 142 14.087 -1.173 5.849 919 H ASP 143 H ASP 143 13.319 -2.787 5.060 920 HA ASP 143 HA ASP 143 11.028 -4.614 5.080 921 HB3 ASP 143 2HB ASP 143 13.948 -5.132 4.520 922 H SER 144 H SER 144 10.906 -3.682 7.538 923 HA SER 144 HA SER 144 12.616 -5.065 9.374 924 HB3 SER 144 2HB SER 144 11.288 -3.251 10.685 925 HG SER 144 HG SER 144 12.560 -1.625 9.874 926 H GLU 145 H GLU 145 9.249 -5.322 8.291 927 HA GLU 145 HA GLU 145 8.689 -7.208 10.510 928 HB3 GLU 145 2HB GLU 145 6.437 -6.208 10.775 929 HG3 GLU 145 2HG GLU 145 8.352 -3.930 11.288 930 H VAL 146 H VAL 146 9.114 -7.211 7.291 931 HA VAL 146 HA VAL 146 6.580 -7.829 6.187 932 HB VAL 146 HB VAL 146 9.293 -8.922 5.295 933 HG11 VAL 146 1HG1 VAL 146 7.306 -9.879 4.122 934 HG12 VAL 146 2HG1 VAL 146 6.801 -8.244 3.664 935 HG13 VAL 146 3HG1 VAL 146 8.328 -8.926 3.053 936 HG21 VAL 146 3HG2 VAL 146 9.533 -6.482 5.541 937 HG22 VAL 146 1HG2 VAL 146 9.488 -6.937 3.846 938 HG23 VAL 146 2HG2 VAL 146 8.035 -6.235 4.599 939 H ASP 147 H ASP 147 8.934 -9.815 7.861 940 HA ASP 147 HA ASP 147 7.865 -12.375 7.243 941 HB3 ASP 147 2HB ASP 147 9.583 -11.423 9.543 942 H LYS 148 H LYS 148 6.487 -9.988 9.405 943 HA LYS 148 HA LYS 148 4.926 -12.176 10.676 944 HB3 LYS 148 2HB LYS 148 5.543 -10.842 12.375 945 HG3 LYS 148 2HG LYS 148 4.985 -8.334 10.799 946 HD3 LYS 148 2HD LYS 148 6.183 -7.426 12.932 947 HE3 LYS 148 2HE LYS 148 3.230 -8.184 13.130 948 HZ1 LYS 148 3HZ LYS 148 3.870 -6.944 14.988 949 HZ2 LYS 148 1HZ LYS 148 3.337 -5.772 13.920 950 HZ3 LYS 148 2HZ LYS 148 4.931 -5.979 14.106 951 H TRP 149 H TRP 149 4.826 -9.724 8.180 952 HA TRP 149 HA TRP 149 1.942 -9.473 8.344 953 HB3 TRP 149 2HB TRP 149 2.325 -7.941 6.381 954 HD1 TRP 149 HD TRP 149 2.317 -7.926 9.864 955 HE1 TRP 149 1HE TRP 149 2.971 -5.687 10.942 956 HE3 TRP 149 3HE TRP 149 4.646 -5.726 5.884 957 HZ2 TRP 149 2HZ TRP 149 4.212 -3.245 10.177 958 HZ3 TRP 149 3HZ TRP 149 5.382 -3.322 6.081 959 HH2 TRP 149 HH TRP 149 5.101 -2.119 8.140 960 H SER 150 H SER 150 3.879 -11.810 6.726 961 HA SER 150 HA SER 150 1.515 -12.485 5.024 962 HB3 SER 150 2HB SER 150 4.395 -13.051 4.284 963 HG SER 150 HG SER 150 3.376 -13.979 2.726 964 H LYS 151 H LYS 151 2.395 -13.411 7.852 965 HA LYS 151 HA LYS 151 3.128 -16.210 7.559 966 HB3 LYS 151 2HB LYS 151 2.563 -16.405 9.910 967 HG3 LYS 151 2HG LYS 151 4.086 -13.825 9.530 968 HD3 LYS 151 2HD LYS 151 3.892 -15.913 11.626 969 HE3 LYS 151 2HE LYS 151 6.251 -15.728 12.308 970 HZ1 LYS 151 3HZ LYS 151 7.119 -17.293 10.715 971 HZ2 LYS 151 1HZ LYS 151 6.000 -16.899 9.600 972 HZ3 LYS 151 2HZ LYS 151 5.541 -17.669 10.959 Start of MODEL 4 1 H1 GLY 1 H GLY 1 -0.403 -21.733 -3.140 2 HA2 GLY 1 1HA GLY 1 -1.583 -23.250 -1.619 3 HA3 GLY 1 2HA GLY 1 -2.067 -21.567 -1.346 4 H MET 2 H MET 2 -4.148 -22.375 -0.495 5 HA MET 2 HA MET 2 -5.911 -23.851 -2.226 6 HB3 MET 2 2HB MET 2 -6.641 -22.120 0.170 7 HG3 MET 2 2HG MET 2 -8.605 -22.901 -1.182 8 HE1 MET 2 3HE MET 2 -7.740 -24.338 -3.461 9 HE2 MET 2 1HE MET 2 -8.690 -25.832 -3.539 10 HE3 MET 2 2HE MET 2 -9.467 -24.316 -3.041 11 H ALA 3 H ALA 3 -6.546 -20.492 -1.048 12 HA ALA 3 HA ALA 3 -6.611 -19.459 -3.784 13 HB1 ALA 3 1HB ALA 3 -9.067 -19.373 -1.973 14 HB2 ALA 3 2HB ALA 3 -8.887 -18.531 -3.529 15 HB3 ALA 3 3HB ALA 3 -8.906 -20.303 -3.485 16 H LYS 4 H LYS 4 -4.636 -18.829 -2.209 17 HA LYS 4 HA LYS 4 -5.305 -16.135 -1.214 18 HB3 LYS 4 2HB LYS 4 -4.820 -17.012 0.843 19 HG3 LYS 4 2HG LYS 4 -3.932 -19.172 0.631 20 HD3 LYS 4 2HD LYS 4 -2.586 -19.217 -1.299 21 HE3 LYS 4 2HE LYS 4 -1.511 -16.896 -1.138 22 HZ1 LYS 4 3HZ LYS 4 0.411 -18.411 0.533 23 HZ2 LYS 4 1HZ LYS 4 -0.444 -17.082 1.005 24 HZ3 LYS 4 2HZ LYS 4 0.692 -16.953 -0.178 25 H LYS 5 H LYS 5 -3.801 -14.502 -1.632 26 HA LYS 5 HA LYS 5 -1.515 -15.088 -3.397 27 HB3 LYS 5 2HB LYS 5 -2.239 -13.466 -5.108 28 HG3 LYS 5 2HG LYS 5 -4.578 -15.263 -4.584 29 HD3 LYS 5 2HD LYS 5 -3.999 -13.550 -6.789 30 HE3 LYS 5 2HE LYS 5 -4.008 -15.323 -8.623 31 HZ1 LYS 5 3HZ LYS 5 -1.572 -15.015 -6.964 32 HZ2 LYS 5 1HZ LYS 5 -1.976 -14.206 -8.340 33 HZ3 LYS 5 2HZ LYS 5 -1.591 -15.806 -8.395 34 H THR 6 H THR 6 -0.447 -12.996 -3.896 35 HA THR 6 HA THR 6 -0.915 -10.816 -1.972 36 HB THR 6 HB THR 6 1.746 -12.161 -2.322 37 HG1 THR 6 1HG THR 6 0.231 -13.057 -0.743 38 HG21 THR 6 3HG2 THR 6 2.574 -10.472 -0.668 39 HG22 THR 6 1HG2 THR 6 1.034 -9.602 -0.849 40 HG23 THR 6 2HG2 THR 6 2.142 -9.754 -2.225 41 H LEU 7 H LEU 7 -1.389 -9.185 -3.281 42 HA LEU 7 HA LEU 7 0.391 -8.487 -5.622 43 HB3 LEU 7 2HB LEU 7 -2.104 -7.229 -4.433 44 HG LEU 7 HG LEU 7 -0.832 -5.448 -5.481 45 HD11 LEU 7 1HD1 LEU 7 0.636 -6.676 -7.058 46 HD12 LEU 7 2HD1 LEU 7 -0.303 -5.466 -7.912 47 HD13 LEU 7 3HD1 LEU 7 -0.785 -7.173 -8.002 48 HD21 LEU 7 3HD2 LEU 7 -3.105 -6.456 -7.250 49 HD22 LEU 7 1HD2 LEU 7 -2.536 -4.779 -7.142 50 HD23 LEU 7 2HD2 LEU 7 -3.298 -5.552 -5.737 51 H ILE 8 H ILE 8 1.737 -6.618 -5.503 52 HA ILE 8 HA ILE 8 1.991 -5.366 -2.856 53 HB ILE 8 HB ILE 8 4.338 -6.006 -4.662 54 HG13 ILE 8 2HG1 ILE 8 3.414 -8.192 -3.816 55 HG21 ILE 8 1HG2 ILE 8 5.001 -4.277 -3.278 56 HG22 ILE 8 2HG2 ILE 8 3.850 -4.637 -2.015 57 HG23 ILE 8 3HG2 ILE 8 5.316 -5.578 -2.103 58 HD11 ILE 8 3HD1 ILE 8 5.877 -7.747 -4.358 59 HD12 ILE 8 1HD1 ILE 8 6.135 -7.602 -2.617 60 HD13 ILE 8 2HD1 ILE 8 5.519 -9.116 -3.287 61 H LEU 9 H LEU 9 2.055 -3.180 -2.995 62 HA LEU 9 HA LEU 9 2.454 -1.884 -5.621 63 HB3 LEU 9 2HB LEU 9 0.436 -0.469 -5.037 64 HG LEU 9 HG LEU 9 0.136 -3.370 -5.622 65 HD11 LEU 9 1HD1 LEU 9 -2.094 -1.962 -4.131 66 HD12 LEU 9 2HD1 LEU 9 -1.101 -3.323 -3.553 67 HD13 LEU 9 3HD1 LEU 9 -2.185 -3.563 -4.921 68 HD21 LEU 9 3HD2 LEU 9 -1.782 -2.492 -7.014 69 HD22 LEU 9 1HD2 LEU 9 -0.187 -1.935 -7.456 70 HD23 LEU 9 2HD2 LEU 9 -1.267 -0.866 -6.529 71 H TYR 10 H TYR 10 3.133 0.312 -5.470 72 HA TYR 10 HA TYR 10 3.127 1.747 -3.064 73 HB3 TYR 10 2HB TYR 10 4.902 1.043 -2.015 74 HD1 TYR 10 1HD TYR 10 5.744 0.253 -5.623 75 HD2 TYR 10 2HD TYR 10 6.272 -0.718 -1.437 76 HE1 TYR 10 1HE TYR 10 6.534 -1.997 -6.219 77 HE2 TYR 10 2HE TYR 10 7.139 -2.930 -2.035 78 HH TYR 10 HH TYR 10 7.529 -4.428 -3.752 79 H TYR 11 H TYR 11 4.238 3.819 -3.161 80 HA TYR 11 HA TYR 11 4.670 4.803 -5.918 81 HB3 TYR 11 2HB TYR 11 3.730 6.383 -3.507 82 HD1 TYR 11 1HD TYR 11 4.907 6.540 -7.109 83 HD2 TYR 11 2HD TYR 11 3.465 8.790 -3.710 84 HE1 TYR 11 1HE TYR 11 5.601 8.585 -8.198 85 HE2 TYR 11 2HE TYR 11 4.152 10.887 -4.851 86 HH TYR 11 HH TYR 11 6.097 10.910 -7.793 87 H SER 12 H SER 12 6.679 5.781 -6.264 88 HA SER 12 HA SER 12 8.786 5.442 -4.264 89 HB3 SER 12 2HB SER 12 9.488 4.664 -6.269 90 HG SER 12 HG SER 12 9.294 6.113 -8.190 91 H TRP 13 H TRP 13 10.448 7.723 -4.997 92 HA TRP 13 HA TRP 13 8.858 10.026 -4.316 93 HB3 TRP 13 2HB TRP 13 11.137 9.492 -2.373 94 HD1 TRP 13 HD TRP 13 7.621 11.058 -2.261 95 HE1 TRP 13 1HE TRP 13 7.737 13.515 -1.674 96 HE3 TRP 13 3HE TRP 13 12.724 11.591 -2.067 97 HZ2 TRP 13 2HZ TRP 13 9.792 15.584 -1.566 98 HZ3 TRP 13 3HZ TRP 13 13.713 13.830 -1.832 99 HH2 TRP 13 HH TRP 13 12.258 15.841 -1.606 100 H SER 14 H SER 14 12.329 9.740 -3.716 101 HA SER 14 HA SER 14 12.914 10.203 -6.525 102 HB3 SER 14 2HB SER 14 14.421 11.940 -4.566 103 HG SER 14 HG SER 14 14.536 13.159 -6.558 104 H GLY 15 H GLY 15 12.947 7.841 -5.603 105 HA2 GLY 15 1HA GLY 15 14.500 6.140 -5.993 106 HA3 GLY 15 2HA GLY 15 15.821 7.202 -5.539 107 H GLU 16 H GLU 16 13.283 7.223 -3.218 108 HA GLU 16 HA GLU 16 14.933 5.703 -1.281 109 HB3 GLU 16 2HB GLU 16 13.389 6.611 0.360 110 HG3 GLU 16 2HG GLU 16 14.018 8.880 -1.568 111 H THR 17 H THR 17 11.382 5.882 -1.677 112 HA THR 17 HA THR 17 10.830 3.340 -0.780 113 HB THR 17 HB THR 17 8.795 4.183 -2.547 114 HG1 THR 17 1HG THR 17 8.514 6.330 -1.945 115 HG21 THR 17 3HG2 THR 17 8.611 3.362 -0.158 116 HG22 THR 17 1HG2 THR 17 7.516 4.666 -0.608 117 HG23 THR 17 2HG2 THR 17 8.965 5.017 0.356 118 H LYS 18 H LYS 18 11.712 4.416 -3.928 119 HA LYS 18 HA LYS 18 10.978 2.291 -5.642 120 HB3 LYS 18 2HB LYS 18 13.542 3.952 -5.690 121 HG3 LYS 18 2HG LYS 18 12.263 3.581 -8.250 122 HD3 LYS 18 2HD LYS 18 14.707 4.076 -7.832 123 HE3 LYS 18 2HE LYS 18 14.592 1.263 -6.810 124 HZ1 LYS 18 3HZ LYS 18 16.694 2.127 -8.683 125 HZ2 LYS 18 1HZ LYS 18 15.780 0.729 -8.643 126 HZ3 LYS 18 2HZ LYS 18 16.933 0.943 -7.547 127 H LYS 19 H LYS 19 13.844 2.611 -3.468 128 HA LYS 19 HA LYS 19 15.125 0.216 -4.527 129 HB3 LYS 19 2HB LYS 19 16.075 0.744 -1.876 130 HG3 LYS 19 2HG LYS 19 17.900 2.051 -3.063 131 HD3 LYS 19 2HD LYS 19 18.777 0.168 -4.427 132 HE3 LYS 19 2HE LYS 19 18.556 -1.702 -2.688 133 HZ1 LYS 19 3HZ LYS 19 19.556 -0.319 -0.872 134 HZ2 LYS 19 1HZ LYS 19 19.552 0.962 -1.902 135 HZ3 LYS 19 2HZ LYS 19 20.388 -0.413 -2.275 136 H MET 20 H MET 20 12.989 0.978 -1.791 137 HA MET 20 HA MET 20 13.199 -1.514 -0.486 138 HB3 MET 20 2HB MET 20 10.605 -0.012 -0.406 139 HG3 MET 20 2HG MET 20 11.108 -1.681 1.282 140 HE1 MET 20 3HE MET 20 13.241 1.391 2.786 141 HE2 MET 20 1HE MET 20 14.868 0.711 2.593 142 HE3 MET 20 2HE MET 20 13.913 1.107 1.139 143 H ALA 21 H ALA 21 11.549 -0.766 -3.502 144 HA ALA 21 HA ALA 21 9.327 -2.559 -3.181 145 HB1 ALA 21 1HB ALA 21 10.610 -1.092 -5.575 146 HB2 ALA 21 2HB ALA 21 9.153 -2.067 -5.679 147 HB3 ALA 21 3HB ALA 21 9.162 -0.606 -4.665 148 H GLU 22 H GLU 22 12.272 -2.385 -5.157 149 HA GLU 22 HA GLU 22 12.108 -4.890 -6.215 150 HB3 GLU 22 2HB GLU 22 14.506 -4.505 -6.906 151 HG3 GLU 22 2HG GLU 22 13.078 -1.818 -6.706 152 H LYS 23 H LYS 23 13.574 -3.863 -3.191 153 HA LYS 23 HA LYS 23 14.927 -6.297 -2.591 154 HB3 LYS 23 2HB LYS 23 14.051 -4.910 -0.174 155 HG3 LYS 23 2HG LYS 23 16.343 -6.119 -1.040 156 HD3 LYS 23 2HD LYS 23 17.132 -3.214 -0.769 157 HE3 LYS 23 2HE LYS 23 19.206 -3.934 -1.818 158 HZ1 LYS 23 3HZ LYS 23 18.559 -6.023 0.159 159 HZ2 LYS 23 1HZ LYS 23 19.014 -4.510 0.578 160 HZ3 LYS 23 2HZ LYS 23 20.050 -5.495 -0.270 161 H ILE 24 H ILE 24 11.871 -5.007 -1.208 162 HA ILE 24 HA ILE 24 11.221 -7.302 0.238 163 HB ILE 24 HB ILE 24 9.524 -5.068 -0.939 164 HG13 ILE 24 2HG1 ILE 24 11.254 -4.526 0.807 165 HG21 ILE 24 1HG2 ILE 24 8.046 -7.094 -0.470 166 HG22 ILE 24 2HG2 ILE 24 8.623 -7.054 1.188 167 HG23 ILE 24 3HG2 ILE 24 7.659 -5.718 0.539 168 HD11 ILE 24 3HD1 ILE 24 9.797 -3.151 2.213 169 HD12 ILE 24 1HD1 ILE 24 9.299 -3.047 0.509 170 HD13 ILE 24 2HD1 ILE 24 8.373 -4.021 1.660 171 H ASN 25 H ASN 25 10.377 -6.566 -3.226 172 HA ASN 25 HA ASN 25 8.477 -8.660 -3.428 173 HB3 ASN 25 2HB ASN 25 10.360 -7.800 -5.637 174 HD21 ASN 25 1HD2 ASN 25 7.109 -9.208 -4.803 175 HD22 ASN 25 2HD2 ASN 25 6.906 -9.983 -6.333 176 H SER 26 H SER 26 12.005 -8.777 -3.562 177 HA SER 26 HA SER 26 12.097 -11.457 -4.652 178 HB3 SER 26 2HB SER 26 14.351 -10.041 -3.200 179 HG SER 26 HG SER 26 14.245 -12.180 -4.668 180 H GLU 27 H GLU 27 11.759 -10.108 -1.413 181 HA GLU 27 HA GLU 27 12.636 -12.567 -0.036 182 HB3 GLU 27 2HB GLU 27 11.893 -11.115 1.995 183 HG3 GLU 27 2HG GLU 27 13.836 -9.636 1.956 184 H ILE 28 H ILE 28 10.103 -12.247 -1.874 185 HA ILE 28 HA ILE 28 8.107 -13.428 -0.042 186 HB ILE 28 HB ILE 28 7.763 -11.201 -2.088 187 HG13 ILE 28 2HG1 ILE 28 8.440 -10.556 0.238 188 HG21 ILE 28 1HG2 ILE 28 5.505 -12.709 -0.700 189 HG22 ILE 28 2HG2 ILE 28 5.327 -11.267 -1.717 190 HG23 ILE 28 3HG2 ILE 28 5.886 -12.733 -2.442 191 HD11 ILE 28 3HD1 ILE 28 6.813 -8.888 0.682 192 HD12 ILE 28 1HD1 ILE 28 6.900 -9.071 -1.074 193 HD13 ILE 28 2HD1 ILE 28 5.537 -9.762 -0.152 194 H LYS 29 H LYS 29 6.464 -14.634 -1.386 195 HA LYS 29 HA LYS 29 7.610 -16.513 -3.242 196 HB3 LYS 29 2HB LYS 29 4.645 -16.069 -3.287 197 HG3 LYS 29 2HG LYS 29 6.372 -18.448 -2.451 198 HD3 LYS 29 2HD LYS 29 4.077 -18.396 -1.457 199 HE3 LYS 29 2HE LYS 29 3.016 -17.334 -3.593 200 HZ1 LYS 29 3HZ LYS 29 2.014 -18.959 -5.023 201 HZ2 LYS 29 1HZ LYS 29 2.756 -20.224 -4.266 202 HZ3 LYS 29 2HZ LYS 29 3.607 -19.077 -5.121 203 H ASP 30 H ASP 30 5.956 -16.739 -5.353 204 HA ASP 30 HA ASP 30 6.732 -14.881 -7.290 205 HB3 ASP 30 2HB ASP 30 6.304 -17.229 -7.717 206 H SER 31 H SER 31 5.254 -13.484 -5.224 207 HA SER 31 HA SER 31 2.628 -12.623 -5.993 208 HB3 SER 31 2HB SER 31 3.159 -10.987 -4.167 209 HG SER 31 HG SER 31 3.474 -13.708 -4.136 210 H GLU 32 H GLU 32 2.093 -10.530 -6.754 211 HA GLU 32 HA GLU 32 3.707 -9.714 -9.049 212 HB3 GLU 32 2HB GLU 32 1.590 -7.931 -8.848 213 HG3 GLU 32 2HG GLU 32 2.308 -10.017 -10.597 214 H LEU 33 H LEU 33 3.911 -7.342 -9.513 215 HA LEU 33 HA LEU 33 4.964 -5.778 -7.253 216 HB3 LEU 33 2HB LEU 33 6.569 -6.985 -9.557 217 HG LEU 33 HG LEU 33 7.358 -4.656 -9.332 218 HD11 LEU 33 1HD1 LEU 33 7.483 -5.392 -6.403 219 HD12 LEU 33 2HD1 LEU 33 6.529 -4.094 -7.124 220 HD13 LEU 33 3HD1 LEU 33 8.303 -3.964 -7.068 221 HD21 LEU 33 3HD2 LEU 33 9.198 -6.602 -7.907 222 HD22 LEU 33 1HD2 LEU 33 9.670 -5.057 -8.623 223 HD23 LEU 33 2HD2 LEU 33 9.074 -6.368 -9.667 224 H LYS 34 H LYS 34 3.596 -3.988 -7.704 225 HA LYS 34 HA LYS 34 3.734 -2.904 -10.528 226 HB3 LYS 34 2HB LYS 34 1.489 -1.835 -9.921 227 HG3 LYS 34 2HG LYS 34 0.075 -3.826 -10.244 228 HD3 LYS 34 2HD LYS 34 2.399 -4.108 -12.171 229 HE3 LYS 34 2HE LYS 34 -0.646 -4.133 -12.510 230 HZ1 LYS 34 3HZ LYS 34 1.504 -4.666 -14.453 231 HZ2 LYS 34 1HZ LYS 34 0.363 -3.504 -14.544 232 HZ3 LYS 34 2HZ LYS 34 -0.081 -5.071 -14.687 233 H GLU 35 H GLU 35 3.500 -0.427 -10.543 234 HA GLU 35 HA GLU 35 4.056 0.796 -7.924 235 HB3 GLU 35 2HB GLU 35 6.177 1.012 -9.037 236 HG3 GLU 35 2HG GLU 35 4.564 2.063 -11.369 237 H VAL 36 H VAL 36 3.176 2.824 -7.650 238 HA VAL 36 HA VAL 36 0.871 3.618 -9.368 239 HB VAL 36 HB VAL 36 1.319 4.280 -6.448 240 HG11 VAL 36 1HG1 VAL 36 -0.398 5.613 -7.576 241 HG12 VAL 36 2HG1 VAL 36 -1.164 4.129 -8.235 242 HG13 VAL 36 3HG1 VAL 36 -1.224 4.487 -6.505 243 HG21 VAL 36 3HG2 VAL 36 -0.409 2.452 -5.934 244 HG22 VAL 36 1HG2 VAL 36 -0.061 1.804 -7.550 245 HG23 VAL 36 2HG2 VAL 36 1.217 1.920 -6.305 246 H LYS 37 H LYS 37 0.615 5.946 -9.512 247 HA LYS 37 HA LYS 37 3.020 7.655 -9.207 248 HB3 LYS 37 2HB LYS 37 2.398 8.485 -11.544 249 HG3 LYS 37 2HG LYS 37 4.321 6.883 -11.075 250 HD3 LYS 37 2HD LYS 37 2.311 4.843 -11.483 251 HE3 LYS 37 2HE LYS 37 2.647 5.013 -13.868 252 HZ1 LYS 37 3HZ LYS 37 4.887 5.891 -14.017 253 HZ2 LYS 37 1HZ LYS 37 4.788 4.469 -14.789 254 HZ3 LYS 37 2HZ LYS 37 5.514 4.503 -13.319 255 H VAL 38 H VAL 38 2.139 10.010 -10.075 256 HA VAL 38 HA VAL 38 -0.692 10.393 -9.563 257 HB VAL 38 HB VAL 38 -0.306 12.527 -8.326 258 HG11 VAL 38 1HG1 VAL 38 -0.145 11.508 -6.157 259 HG12 VAL 38 2HG1 VAL 38 -1.007 10.402 -7.243 260 HG13 VAL 38 3HG1 VAL 38 0.689 10.083 -6.816 261 HG21 VAL 38 3HG2 VAL 38 2.518 11.474 -7.824 262 HG22 VAL 38 1HG2 VAL 38 2.110 12.859 -8.860 263 HG23 VAL 38 2HG2 VAL 38 1.772 12.928 -7.129 264 H SER 39 H SER 39 -1.145 12.984 -10.344 265 HA SER 39 HA SER 39 -0.362 12.959 -13.079 266 HB3 SER 39 2HB SER 39 -1.509 15.388 -12.332 267 HG SER 39 HG SER 39 -3.298 14.581 -13.289 268 H GLU 40 H GLU 40 0.303 15.103 -13.918 269 HA GLU 40 HA GLU 40 3.004 15.650 -13.017 270 HB3 GLU 40 2HB GLU 40 2.841 17.514 -14.765 271 HG3 GLU 40 2HG GLU 40 2.138 14.699 -15.652 272 H GLY 41 H GLY 41 3.844 17.356 -11.895 273 HA2 GLY 41 1HA GLY 41 3.990 19.482 -11.075 274 HA3 GLY 41 2HA GLY 41 2.432 19.833 -11.809 275 H THR 42 H THR 42 2.300 17.063 -9.779 276 HA THR 42 HA THR 42 0.557 18.379 -7.919 277 HB THR 42 HB THR 42 1.830 15.643 -7.560 278 HG1 THR 42 1HG THR 42 0.923 15.528 -9.597 279 HG21 THR 42 3HG2 THR 42 -0.975 16.605 -6.877 280 HG22 THR 42 1HG2 THR 42 0.347 16.624 -5.720 281 HG23 THR 42 2HG2 THR 42 -0.201 15.077 -6.395 282 H PHE 43 H PHE 43 4.074 17.616 -7.796 283 HA PHE 43 HA PHE 43 4.298 19.280 -5.413 284 HB3 PHE 43 2HB PHE 43 5.464 17.709 -4.048 285 HD1 PHE 43 1HD PHE 43 3.157 18.177 -3.003 286 HD2 PHE 43 2HD PHE 43 3.932 14.854 -5.651 287 HE1 PHE 43 1HE PHE 43 1.043 17.119 -2.297 288 HE2 PHE 43 2HE PHE 43 1.810 13.785 -4.911 289 HZ PHE 43 HZ PHE 43 0.350 14.943 -3.273 290 H ASP 44 H ASP 44 6.771 19.576 -4.907 291 HA ASP 44 HA ASP 44 8.191 19.590 -7.580 292 HB3 ASP 44 2HB ASP 44 8.914 21.672 -5.605 293 H ALA 45 H ALA 45 8.323 17.740 -5.231 294 HA ALA 45 HA ALA 45 9.616 16.937 -3.512 295 HB1 ALA 45 1HB ALA 45 11.976 16.491 -4.027 296 HB2 ALA 45 2HB ALA 45 10.897 16.090 -5.382 297 HB3 ALA 45 3HB ALA 45 11.881 17.579 -5.428 298 H ASP 46 H ASP 46 9.668 20.204 -4.063 299 HA ASP 46 HA ASP 46 11.501 21.135 -2.200 300 HB3 ASP 46 2HB ASP 46 9.400 22.926 -1.971 301 H MET 47 H MET 47 10.970 22.128 -0.114 302 HA MET 47 HA MET 47 8.935 20.693 1.542 303 HB3 MET 47 2HB MET 47 10.832 20.540 2.788 304 HG3 MET 47 2HG MET 47 11.626 23.207 1.642 305 HE1 MET 47 3HE MET 47 13.464 24.717 2.287 306 HE2 MET 47 1HE MET 47 11.902 24.965 3.101 307 HE3 MET 47 2HE MET 47 13.423 25.153 4.015 308 H TYR 48 H TYR 48 10.092 24.078 0.886 309 HA TYR 48 HA TYR 48 7.895 25.215 2.298 310 HB3 TYR 48 2HB TYR 48 9.979 26.407 2.062 311 HD1 TYR 48 1HD TYR 48 11.689 25.275 0.617 312 HD2 TYR 48 2HD TYR 48 8.636 27.863 -1.058 313 HE1 TYR 48 1HE TYR 48 12.851 25.255 -1.539 314 HE2 TYR 48 2HE TYR 48 9.829 27.831 -3.230 315 HH TYR 48 HH TYR 48 12.025 25.455 -3.967 316 H LYS 49 H LYS 49 8.304 24.494 -1.202 317 HA LYS 49 HA LYS 49 5.844 25.884 -1.977 318 HB3 LYS 49 2HB LYS 49 6.982 23.598 -3.565 319 HG3 LYS 49 2HG LYS 49 5.011 25.242 -4.209 320 HD3 LYS 49 2HD LYS 49 7.519 26.895 -4.739 321 HE3 LYS 49 2HE LYS 49 4.696 27.542 -5.683 322 HZ1 LYS 49 3HZ LYS 49 6.110 29.423 -5.763 323 HZ2 LYS 49 1HZ LYS 49 6.150 28.814 -7.306 324 HZ3 LYS 49 2HZ LYS 49 7.402 28.542 -6.296 325 H THR 50 H THR 50 6.641 22.451 -1.223 326 HA THR 50 HA THR 50 4.022 21.507 -1.903 327 HB THR 50 HB THR 50 4.988 19.392 -0.941 328 HG1 THR 50 1HG THR 50 7.448 20.006 -0.420 329 HG21 THR 50 3HG2 THR 50 5.496 20.080 -3.280 330 HG22 THR 50 1HG2 THR 50 6.788 19.121 -2.538 331 HG23 THR 50 2HG2 THR 50 6.985 20.873 -2.721 332 H SER 51 H SER 51 5.520 22.809 1.029 333 HA SER 51 HA SER 51 3.668 22.313 2.980 334 HB3 SER 51 2HB SER 51 4.720 25.101 2.492 335 HG SER 51 HG SER 51 4.645 23.590 4.896 336 H ASP 52 H ASP 52 3.234 24.429 0.116 337 HA ASP 52 HA ASP 52 0.698 25.480 1.122 338 HB3 ASP 52 2HB ASP 52 1.918 25.741 -1.661 339 H ILE 53 H ILE 53 1.782 23.279 -1.470 340 HA ILE 53 HA ILE 53 -0.708 23.009 -2.709 341 HB ILE 53 HB ILE 53 1.596 21.020 -2.846 342 HG13 ILE 53 2HG1 ILE 53 2.231 23.452 -3.372 343 HG21 ILE 53 1HG2 ILE 53 -0.848 21.585 -4.598 344 HG22 ILE 53 2HG2 ILE 53 0.520 20.647 -5.175 345 HG23 ILE 53 3HG2 ILE 53 -0.419 20.057 -3.812 346 HD11 ILE 53 3HD1 ILE 53 3.494 21.560 -4.389 347 HD12 ILE 53 1HD1 ILE 53 2.408 21.637 -5.797 348 HD13 ILE 53 2HD1 ILE 53 3.426 23.021 -5.393 349 H ALA 54 H ALA 54 0.898 20.584 -0.513 350 HA ALA 54 HA ALA 54 -1.395 18.865 -0.623 351 HB1 ALA 54 1HB ALA 54 0.833 18.059 0.024 352 HB2 ALA 54 2HB ALA 54 0.772 19.010 1.515 353 HB3 ALA 54 3HB ALA 54 -0.354 17.680 1.268 354 H LEU 55 H LEU 55 -0.573 21.585 1.502 355 HA LEU 55 HA LEU 55 -2.397 21.267 3.583 356 HB3 LEU 55 2HB LEU 55 -1.495 23.835 2.239 357 HG LEU 55 HG LEU 55 -1.334 24.697 4.580 358 HD11 LEU 55 1HD1 LEU 55 -2.880 25.464 2.766 359 HD12 LEU 55 2HD1 LEU 55 -3.378 25.819 4.400 360 HD13 LEU 55 3HD1 LEU 55 -4.147 24.475 3.490 361 HD21 LEU 55 3HD2 LEU 55 -1.727 22.596 5.751 362 HD22 LEU 55 1HD2 LEU 55 -3.409 22.596 5.226 363 HD23 LEU 55 2HD2 LEU 55 -2.787 23.887 6.292 364 H ASP 56 H ASP 56 -2.928 22.675 0.391 365 HA ASP 56 HA ASP 56 -5.568 23.718 0.669 366 HB3 ASP 56 2HB ASP 56 -3.773 22.783 -1.617 367 H GLN 57 H GLN 57 -4.374 20.493 -0.355 368 HA GLN 57 HA GLN 57 -7.004 19.381 -0.804 369 HB3 GLN 57 2HB GLN 57 -5.805 17.267 -1.086 370 HG3 GLN 57 2HG GLN 57 -4.153 19.566 -2.254 371 HE21 GLN 57 1HE2 GLN 57 -5.299 17.295 -4.477 372 HE22 GLN 57 2HE2 GLN 57 -3.642 16.791 -4.848 373 H ILE 58 H ILE 58 -4.667 19.317 1.887 374 HA ILE 58 HA ILE 58 -5.951 17.408 3.520 375 HB ILE 58 HB ILE 58 -4.077 19.719 4.129 376 HG13 ILE 58 2HG1 ILE 58 -3.562 17.471 2.822 377 HG21 ILE 58 1HG2 ILE 58 -4.995 17.581 6.111 378 HG22 ILE 58 2HG2 ILE 58 -3.623 18.693 6.335 379 HG23 ILE 58 3HG2 ILE 58 -5.264 19.327 6.240 380 HD11 ILE 58 3HD1 ILE 58 -1.295 17.462 3.458 381 HD12 ILE 58 1HD1 ILE 58 -1.821 19.153 3.535 382 HD13 ILE 58 2HD1 ILE 58 -1.652 18.258 5.030 383 H GLN 59 H GLN 59 -6.286 20.986 3.595 384 HA GLN 59 HA GLN 59 -8.119 20.797 5.801 385 HB3 GLN 59 2HB GLN 59 -8.576 23.247 5.206 386 HG3 GLN 59 2HG GLN 59 -5.616 22.449 5.473 387 HE21 GLN 59 1HE2 GLN 59 -4.581 24.315 5.386 388 HE22 GLN 59 2HE2 GLN 59 -5.009 25.834 6.095 389 H GLY 60 H GLY 60 -8.572 20.124 2.471 390 HA2 GLY 60 1HA GLY 60 -10.441 19.165 1.529 391 HA3 GLY 60 2HA GLY 60 -11.445 19.707 2.891 392 H ASN 61 H ASN 61 -9.243 21.819 1.130 393 HA ASN 61 HA ASN 61 -11.471 23.561 0.221 394 HB3 ASN 61 2HB ASN 61 -9.575 24.955 -0.655 395 HD21 ASN 61 1HD2 ASN 61 -7.578 25.630 1.115 396 HD22 ASN 61 2HD2 ASN 61 -8.259 26.062 2.675 397 H LYS 62 H LYS 62 -8.565 21.952 -1.108 398 HA LYS 62 HA LYS 62 -10.099 21.191 -3.544 399 HB3 LYS 62 2HB LYS 62 -7.614 20.561 -4.338 400 HG3 LYS 62 2HG LYS 62 -7.052 22.912 -4.803 401 HD3 LYS 62 2HD LYS 62 -9.831 22.138 -5.406 402 HE3 LYS 62 2HE LYS 62 -9.107 25.037 -4.786 403 HZ1 LYS 62 3HZ LYS 62 -10.427 24.825 -6.850 404 HZ2 LYS 62 1HZ LYS 62 -11.245 25.575 -5.625 405 HZ3 LYS 62 2HZ LYS 62 -11.595 24.017 -5.976 406 H ASP 63 H ASP 63 -8.876 19.096 -4.261 407 HA ASP 63 HA ASP 63 -9.748 17.018 -2.295 408 HB3 ASP 63 2HB ASP 63 -10.530 15.931 -4.559 409 H PHE 64 H PHE 64 -9.012 14.799 -3.031 410 HA PHE 64 HA PHE 64 -6.223 14.817 -2.843 411 HB3 PHE 64 2HB PHE 64 -7.373 13.118 -1.772 412 HD1 PHE 64 1HD PHE 64 -7.992 12.062 -5.357 413 HD2 PHE 64 2HD PHE 64 -9.523 12.339 -1.335 414 HE1 PHE 64 1HE PHE 64 -10.177 11.069 -6.090 415 HE2 PHE 64 2HE PHE 64 -11.623 11.242 -2.052 416 HZ PHE 64 HZ PHE 64 -11.965 10.645 -4.443 417 HA PRO 65 HA PRO 65 -4.650 14.823 -6.873 418 HB3 PRO 65 2HB PRO 65 -2.551 14.805 -5.920 419 HG3 PRO 65 2HG PRO 65 -1.999 13.276 -4.141 420 HD3 PRO 65 2HD PRO 65 -3.876 14.584 -3.490 421 H GLU 66 H GLU 66 -4.375 13.736 -8.888 422 HA GLU 66 HA GLU 66 -6.178 11.482 -9.203 423 HB3 GLU 66 2HB GLU 66 -5.674 11.739 -11.604 424 HG3 GLU 66 2HG GLU 66 -6.022 14.560 -10.598 425 H ILE 67 H ILE 67 -5.677 9.452 -9.869 426 HA ILE 67 HA ILE 67 -2.820 8.607 -9.729 427 HB ILE 67 HB ILE 67 -3.598 6.294 -9.420 428 HG13 ILE 67 2HG1 ILE 67 -5.858 6.452 -10.410 429 HG21 ILE 67 1HG2 ILE 67 -4.621 8.212 -7.295 430 HG22 ILE 67 2HG2 ILE 67 -4.053 6.542 -7.041 431 HG23 ILE 67 3HG2 ILE 67 -2.927 7.788 -7.572 432 HD11 ILE 67 3HD1 ILE 67 -6.101 5.558 -7.515 433 HD12 ILE 67 1HD1 ILE 67 -6.956 4.938 -8.936 434 HD13 ILE 67 2HD1 ILE 67 -5.228 4.619 -8.749 435 H GLN 68 H GLN 68 -2.095 7.175 -11.303 436 HA GLN 68 HA GLN 68 -3.340 7.413 -13.992 437 HB3 GLN 68 2HB GLN 68 -1.238 7.982 -14.863 438 HG3 GLN 68 2HG GLN 68 -0.225 9.796 -13.543 439 HE21 GLN 68 1HE2 GLN 68 -2.486 10.986 -11.603 440 HE22 GLN 68 2HE2 GLN 68 -3.310 11.874 -12.836 441 H LEU 69 H LEU 69 -3.849 5.408 -12.179 442 HA LEU 69 HA LEU 69 -2.082 3.101 -12.786 443 HB3 LEU 69 2HB LEU 69 -4.040 3.439 -10.504 444 HG LEU 69 HG LEU 69 -2.651 1.908 -9.246 445 HD11 LEU 69 1HD1 LEU 69 -3.373 -0.178 -10.088 446 HD12 LEU 69 2HD1 LEU 69 -3.440 0.393 -11.753 447 HD13 LEU 69 3HD1 LEU 69 -4.608 1.001 -10.560 448 HD21 LEU 69 3HD2 LEU 69 -0.884 0.564 -10.215 449 HD22 LEU 69 1HD2 LEU 69 -0.524 2.274 -10.455 450 HD23 LEU 69 2HD2 LEU 69 -1.133 1.309 -11.810 451 H ASP 70 H ASP 70 -2.839 1.600 -13.779 452 HA ASP 70 HA ASP 70 -5.153 1.838 -15.438 453 HB3 ASP 70 2HB ASP 70 -4.410 -0.851 -15.737 454 H ASN 71 H ASN 71 -6.805 -0.018 -15.822 455 HA ASN 71 HA ASN 71 -8.193 -0.046 -13.245 456 HB3 ASN 71 2HB ASN 71 -9.408 -1.185 -15.739 457 HD21 ASN 71 1HD2 ASN 71 -10.050 1.541 -13.530 458 HD22 ASN 71 2HD2 ASN 71 -11.476 0.819 -12.811 459 H ILE 72 H ILE 72 -8.024 -1.652 -11.923 460 HA ILE 72 HA ILE 72 -7.404 -4.430 -12.865 461 HB ILE 72 HB ILE 72 -5.856 -2.806 -10.800 462 HG13 ILE 72 2HG1 ILE 72 -5.242 -2.378 -13.208 463 HG21 ILE 72 1HG2 ILE 72 -5.520 -5.741 -11.573 464 HG22 ILE 72 2HG2 ILE 72 -4.457 -4.837 -10.469 465 HG23 ILE 72 3HG2 ILE 72 -6.120 -5.133 -10.007 466 HD11 ILE 72 3HD1 ILE 72 -3.517 -2.241 -11.377 467 HD12 ILE 72 1HD1 ILE 72 -2.991 -3.876 -11.854 468 HD13 ILE 72 2HD1 ILE 72 -2.902 -2.544 -13.013 469 H ASP 73 H ASP 73 -8.460 -5.971 -11.798 470 HA ASP 73 HA ASP 73 -10.341 -5.376 -9.644 471 HB3 ASP 73 2HB ASP 73 -10.549 -7.925 -9.772 472 H TYR 74 H TYR 74 -9.607 -5.313 -7.533 473 HA TYR 74 HA TYR 74 -7.089 -6.708 -6.845 474 HB3 TYR 74 2HB TYR 74 -7.074 -5.377 -4.867 475 HD1 TYR 74 1HD TYR 74 -5.470 -4.888 -7.060 476 HD2 TYR 74 2HD TYR 74 -8.954 -2.638 -5.875 477 HE1 TYR 74 1HE TYR 74 -4.695 -2.952 -8.415 478 HE2 TYR 74 2HE TYR 74 -8.148 -0.691 -7.127 479 HH TYR 74 HH TYR 74 -6.668 0.001 -8.807 480 H ASN 75 H ASN 75 -10.451 -7.406 -6.815 481 HA ASN 75 HA ASN 75 -10.606 -8.375 -4.136 482 HB3 ASN 75 2HB ASN 75 -12.498 -9.627 -6.028 483 HD21 ASN 75 1HD2 ASN 75 -12.066 -10.226 -3.370 484 HD22 ASN 75 2HD2 ASN 75 -13.194 -9.419 -2.310 485 H ASN 76 H ASN 76 -9.168 -9.759 -6.858 486 HA ASN 76 HA ASN 76 -9.276 -12.542 -5.969 487 HB3 ASN 76 2HB ASN 76 -9.646 -12.191 -8.305 488 HD21 ASN 76 1HD2 ASN 76 -9.654 -9.874 -8.909 489 HD22 ASN 76 2HD2 ASN 76 -8.179 -9.050 -9.376 490 H TYR 77 H TYR 77 -8.029 -10.795 -4.128 491 HA TYR 77 HA TYR 77 -5.377 -12.026 -4.023 492 HB3 TYR 77 2HB TYR 77 -4.389 -9.973 -3.048 493 HD1 TYR 77 2HD TYR 77 -2.855 -11.035 -4.723 494 HD2 TYR 77 1HD TYR 77 -6.161 -8.573 -5.911 495 HE1 TYR 77 2HE TYR 77 -2.127 -11.210 -7.092 496 HE2 TYR 77 1HE TYR 77 -5.487 -8.742 -8.262 497 HH TYR 77 HH TYR 77 -3.998 -9.622 -9.708 498 H ASP 78 H ASP 78 -4.661 -12.290 -1.864 499 HA ASP 78 HA ASP 78 -6.853 -12.178 0.181 500 HB3 ASP 78 2HB ASP 78 -4.354 -13.877 -0.014 501 H LEU 79 H LEU 79 -3.452 -11.461 -0.459 502 HA LEU 79 HA LEU 79 -3.253 -9.563 1.800 503 HB3 LEU 79 2HB LEU 79 -0.699 -10.202 0.722 504 HG LEU 79 HG LEU 79 -1.917 -11.409 3.240 505 HD11 LEU 79 1HD1 LEU 79 0.486 -11.721 3.846 506 HD12 LEU 79 2HD1 LEU 79 0.950 -11.071 2.263 507 HD13 LEU 79 3HD1 LEU 79 0.080 -12.627 2.364 508 HD21 LEU 79 3HD2 LEU 79 -0.071 -9.023 2.866 509 HD22 LEU 79 1HD2 LEU 79 -0.585 -9.705 4.420 510 HD23 LEU 79 2HD2 LEU 79 -1.783 -8.952 3.365 511 H ILE 80 H ILE 80 -2.466 -7.562 1.242 512 HA ILE 80 HA ILE 80 -1.559 -6.939 -1.479 513 HB ILE 80 HB ILE 80 -3.967 -5.489 -0.311 514 HG13 ILE 80 2HG1 ILE 80 -4.674 -7.575 -1.344 515 HG21 ILE 80 1HG2 ILE 80 -2.262 -4.037 -1.531 516 HG22 ILE 80 2HG2 ILE 80 -2.550 -5.037 -2.967 517 HG23 ILE 80 3HG2 ILE 80 -3.853 -4.045 -2.258 518 HD11 ILE 80 3HD1 ILE 80 -6.039 -5.536 -1.953 519 HD12 ILE 80 1HD1 ILE 80 -5.131 -5.481 -3.500 520 HD13 ILE 80 2HD1 ILE 80 -6.125 -6.880 -3.110 521 H LEU 81 H LEU 81 0.442 -6.340 -0.753 522 HA LEU 81 HA LEU 81 0.874 -4.671 1.643 523 HB3 LEU 81 2HB LEU 81 3.193 -4.527 0.297 524 HG LEU 81 HG LEU 81 3.089 -5.774 2.369 525 HD11 LEU 81 1HD1 LEU 81 2.496 -8.133 2.469 526 HD12 LEU 81 2HD1 LEU 81 2.109 -8.182 0.760 527 HD13 LEU 81 3HD1 LEU 81 1.120 -7.240 1.887 528 HD21 LEU 81 3HD2 LEU 81 4.820 -7.462 1.791 529 HD22 LEU 81 1HD2 LEU 81 5.077 -5.946 0.889 530 HD23 LEU 81 2HD2 LEU 81 4.366 -7.369 0.064 531 H ILE 82 H ILE 82 0.831 -2.347 1.670 532 HA ILE 82 HA ILE 82 1.135 -1.035 -0.972 533 HB ILE 82 HB ILE 82 -0.974 -0.502 1.115 534 HG13 ILE 82 2HG1 ILE 82 -1.403 -2.190 -0.685 535 HG21 ILE 82 1HG2 ILE 82 -1.526 1.536 -0.316 536 HG22 ILE 82 2HG2 ILE 82 0.006 1.689 0.525 537 HG23 ILE 82 3HG2 ILE 82 -0.004 1.265 -1.194 538 HD11 ILE 82 3HD1 ILE 82 -3.062 0.269 -1.249 539 HD12 ILE 82 1HD1 ILE 82 -3.467 -1.428 -1.561 540 HD13 ILE 82 2HD1 ILE 82 -3.324 -0.851 0.119 541 H GLY 83 H GLY 83 2.864 0.120 -1.004 542 HA2 GLY 83 1HA GLY 83 3.820 1.430 1.514 543 HA3 GLY 83 2HA GLY 83 4.799 1.046 0.110 544 H SER 84 H SER 84 4.890 3.605 1.190 545 HA SER 84 HA SER 84 4.080 5.292 -1.027 546 HB3 SER 84 2HB SER 84 2.028 5.722 -0.185 547 HG SER 84 HG SER 84 2.919 4.972 2.405 548 HA PRO 85 HA PRO 85 7.466 7.539 0.956 549 HB3 PRO 85 2HB PRO 85 7.769 8.450 -1.153 550 HG3 PRO 85 2HG PRO 85 5.998 9.266 -2.489 551 HD3 PRO 85 2HD PRO 85 5.446 7.041 -2.040 552 H VAL 86 H VAL 86 7.871 9.754 2.116 553 HA VAL 86 HA VAL 86 5.463 10.877 3.419 554 HB VAL 86 HB VAL 86 8.028 9.856 4.675 555 HG11 VAL 86 1HG1 VAL 86 6.100 11.892 5.849 556 HG12 VAL 86 2HG1 VAL 86 7.245 10.907 6.824 557 HG13 VAL 86 3HG1 VAL 86 7.853 12.021 5.613 558 HG21 VAL 86 3HG2 VAL 86 6.197 8.289 4.587 559 HG22 VAL 86 1HG2 VAL 86 6.376 8.803 6.261 560 HG23 VAL 86 2HG2 VAL 86 5.049 9.457 5.274 561 H TRP 87 H TRP 87 5.526 13.127 3.577 562 HA TRP 87 HA TRP 87 7.799 14.543 2.336 563 HB3 TRP 87 2HB TRP 87 5.378 16.131 2.856 564 HD1 TRP 87 HD TRP 87 7.154 17.825 1.395 565 HE1 TRP 87 1HE TRP 87 7.720 17.968 -1.100 566 HE3 TRP 87 3HE TRP 87 5.109 13.398 -0.132 567 HZ2 TRP 87 2HZ TRP 87 7.366 16.307 -3.470 568 HZ3 TRP 87 3HZ TRP 87 5.108 12.772 -2.538 569 HH2 TRP 87 HH TRP 87 6.238 14.227 -4.207 570 H SER 88 H SER 88 7.404 17.007 3.451 571 HA SER 88 HA SER 88 8.461 17.204 5.977 572 HB3 SER 88 2HB SER 88 7.849 19.494 5.766 573 HG SER 88 HG SER 88 9.217 18.642 4.028 574 H GLY 89 H GLY 89 7.489 15.706 7.168 575 HA2 GLY 89 1HA GLY 89 6.385 15.318 9.187 576 HA3 GLY 89 2HA GLY 89 5.301 16.658 8.914 577 H TYR 90 H TYR 90 4.259 15.613 6.139 578 HA TYR 90 HA TYR 90 2.983 13.097 7.128 579 HB3 TYR 90 2HB TYR 90 0.875 14.093 6.134 580 HD1 TYR 90 1HD TYR 90 1.618 13.055 8.868 581 HD2 TYR 90 2HD TYR 90 0.498 17.003 7.520 582 HE1 TYR 90 1HE TYR 90 0.416 13.440 10.985 583 HE2 TYR 90 2HE TYR 90 -0.713 17.380 9.618 584 HH TYR 90 HH TYR 90 -1.637 16.349 11.454 585 HA PRO 91 HA PRO 91 3.596 11.849 2.904 586 HB3 PRO 91 2HB PRO 91 2.741 9.780 3.474 587 HG3 PRO 91 2HG PRO 91 0.804 9.557 4.854 588 HD3 PRO 91 2HD PRO 91 2.389 10.873 6.067 589 H ALA 92 H ALA 92 2.555 11.926 0.727 590 HA ALA 92 HA ALA 92 1.337 14.506 0.139 591 HB1 ALA 92 1HB ALA 92 2.939 14.058 -1.414 592 HB2 ALA 92 2HB ALA 92 2.794 12.287 -1.253 593 HB3 ALA 92 3HB ALA 92 1.650 13.173 -2.236 594 H THR 93 H THR 93 -0.292 12.306 1.543 595 HA THR 93 HA THR 93 -1.916 10.722 1.233 596 HB THR 93 HB THR 93 -3.162 12.443 1.933 597 HG1 THR 93 1HG THR 93 -4.232 11.410 -0.408 598 HG21 THR 93 3HG2 THR 93 -2.300 14.289 0.531 599 HG22 THR 93 1HG2 THR 93 -4.046 14.326 0.601 600 HG23 THR 93 2HG2 THR 93 -3.248 13.692 -0.858 601 HA PRO 94 HA PRO 94 -1.383 9.772 -3.280 602 HB3 PRO 94 2HB PRO 94 0.883 9.267 -3.209 603 HG3 PRO 94 2HG PRO 94 1.928 8.535 -1.153 604 HD3 PRO 94 2HD PRO 94 0.866 10.553 -0.747 605 H ILE 95 H ILE 95 -1.830 7.710 -0.345 606 HA ILE 95 HA ILE 95 -3.010 5.636 -2.022 607 HB ILE 95 HB ILE 95 -2.750 5.675 0.999 608 HG13 ILE 95 2HG1 ILE 95 -0.693 4.215 0.599 609 HG21 ILE 95 1HG2 ILE 95 -4.252 3.923 0.241 610 HG22 ILE 95 2HG2 ILE 95 -3.077 3.369 -0.964 611 HG23 ILE 95 3HG2 ILE 95 -2.752 3.206 0.777 612 HD11 ILE 95 3HD1 ILE 95 -0.506 5.638 -2.087 613 HD12 ILE 95 1HD1 ILE 95 0.669 4.541 -1.398 614 HD13 ILE 95 2HD1 ILE 95 -0.907 3.917 -1.917 615 H LYS 96 H LYS 96 -4.329 8.371 -0.250 616 HA LYS 96 HA LYS 96 -6.887 7.578 0.497 617 HB3 LYS 96 2HB LYS 96 -5.831 10.074 -0.778 618 HG3 LYS 96 2HG LYS 96 -8.377 9.935 -0.967 619 HD3 LYS 96 2HD LYS 96 -9.681 10.729 0.790 620 HE3 LYS 96 2HE LYS 96 -8.189 8.595 2.327 621 HZ1 LYS 96 3HZ LYS 96 -10.483 8.143 3.068 622 HZ2 LYS 96 1HZ LYS 96 -11.051 9.332 2.082 623 HZ3 LYS 96 2HZ LYS 96 -10.107 9.725 3.308 624 H THR 97 H THR 97 -5.986 8.809 -2.823 625 HA THR 97 HA THR 97 -8.498 8.511 -3.903 626 HB THR 97 HB THR 97 -5.895 8.015 -5.407 627 HG1 THR 97 1HG THR 97 -6.001 10.474 -5.503 628 HG21 THR 97 3HG2 THR 97 -7.090 9.407 -7.149 629 HG22 THR 97 1HG2 THR 97 -8.517 9.395 -6.098 630 HG23 THR 97 2HG2 THR 97 -7.913 7.901 -6.761 631 H LEU 98 H LEU 98 -5.808 6.124 -3.988 632 HA LEU 98 HA LEU 98 -7.207 4.200 -5.553 633 HB3 LEU 98 2HB LEU 98 -4.863 3.991 -3.587 634 HG LEU 98 HG LEU 98 -5.746 1.717 -4.081 635 HD11 LEU 98 1HD1 LEU 98 -6.747 2.176 -6.333 636 HD12 LEU 98 2HD1 LEU 98 -5.636 0.820 -6.346 637 HD13 LEU 98 3HD1 LEU 98 -5.107 2.386 -6.995 638 HD21 LEU 98 3HD2 LEU 98 -3.600 0.795 -4.821 639 HD22 LEU 98 1HD2 LEU 98 -3.341 2.124 -3.686 640 HD23 LEU 98 2HD2 LEU 98 -3.094 2.381 -5.433 641 H LEU 99 H LEU 99 -6.906 4.539 -1.936 642 HA LEU 99 HA LEU 99 -8.190 2.058 -1.390 643 HB3 LEU 99 2HB LEU 99 -6.710 3.703 0.055 644 HG LEU 99 HG LEU 99 -8.882 5.290 0.215 645 HD11 LEU 99 1HD1 LEU 99 -10.312 4.748 2.066 646 HD12 LEU 99 2HD1 LEU 99 -9.305 3.343 2.496 647 HD13 LEU 99 3HD1 LEU 99 -10.257 3.307 1.020 648 HD21 LEU 99 3HD2 LEU 99 -8.132 6.112 2.266 649 HD22 LEU 99 1HD2 LEU 99 -6.704 5.620 1.313 650 HD23 LEU 99 2HD2 LEU 99 -7.275 4.598 2.631 651 H ASP 100 H ASP 100 -9.394 5.395 -2.035 652 HA ASP 100 HA ASP 100 -11.995 4.967 -1.060 653 HB3 ASP 100 2HB ASP 100 -11.439 6.738 -3.460 654 H GLN 101 H GLN 101 -10.559 4.361 -4.215 655 HA GLN 101 HA GLN 101 -12.958 3.454 -5.522 656 HB3 GLN 101 2HB GLN 101 -11.323 2.522 -7.169 657 HG3 GLN 101 2HG GLN 101 -10.320 5.268 -6.374 658 HE21 GLN 101 1HE2 GLN 101 -9.109 5.925 -8.125 659 HE22 GLN 101 2HE2 GLN 101 -9.409 5.426 -9.784 660 H MET 102 H MET 102 -10.185 1.628 -4.118 661 HA MET 102 HA MET 102 -11.418 -0.887 -4.664 662 HB3 MET 102 2HB MET 102 -9.032 -0.464 -4.790 663 HG3 MET 102 2HG MET 102 -9.175 0.633 -2.310 664 HE1 MET 102 3HE MET 102 -6.826 -3.275 -1.416 665 HE2 MET 102 1HE MET 102 -7.792 -3.131 -2.893 666 HE3 MET 102 2HE MET 102 -6.380 -2.075 -2.650 667 H LYS 103 H LYS 103 -12.399 1.055 -2.173 668 HA LYS 103 HA LYS 103 -12.224 -0.132 0.222 669 HB3 LYS 103 2HB LYS 103 -14.639 0.580 0.676 670 HG3 LYS 103 2HG LYS 103 -13.305 2.901 -0.608 671 HD3 LYS 103 2HD LYS 103 -13.937 2.485 2.309 672 HE3 LYS 103 2HE LYS 103 -12.860 4.585 1.097 673 HZ1 LYS 103 3HZ LYS 103 -15.650 5.483 0.951 674 HZ2 LYS 103 1HZ LYS 103 -15.025 4.685 -0.326 675 HZ3 LYS 103 2HZ LYS 103 -14.321 6.064 0.183 676 H ASN 104 H ASN 104 -13.944 -1.720 -2.289 677 HA ASN 104 HA ASN 104 -15.661 -3.309 -0.482 678 HB3 ASN 104 2HB ASN 104 -16.168 -4.543 -2.723 679 HD21 ASN 104 1HD2 ASN 104 -16.258 -0.930 -2.626 680 HD22 ASN 104 2HD2 ASN 104 -17.931 -0.864 -2.100 681 H TYR 105 H TYR 105 -12.425 -3.500 -1.442 682 HA TYR 105 HA TYR 105 -12.061 -6.357 -1.521 683 HB3 TYR 105 2HB TYR 105 -10.242 -4.041 -0.659 684 HD1 TYR 105 1HD TYR 105 -9.760 -7.070 -2.732 685 HD2 TYR 105 2HD TYR 105 -8.676 -5.044 0.901 686 HE1 TYR 105 1HE TYR 105 -8.071 -8.809 -2.287 687 HE2 TYR 105 2HE TYR 105 -6.968 -6.784 1.364 688 HH TYR 105 HH TYR 105 -6.178 -8.981 0.708 689 H ARG 106 H ARG 106 -11.915 -7.866 0.102 690 HA ARG 106 HA ARG 106 -11.620 -6.855 2.897 691 HB3 ARG 106 2HB ARG 106 -12.566 -8.906 3.666 692 HG3 ARG 106 2HG ARG 106 -14.673 -8.732 1.643 693 HD3 ARG 106 2HD ARG 106 -14.533 -7.696 4.518 694 HE ARG 106 HE ARG 106 -16.767 -8.082 2.679 695 HH11 ARG 106 1HH1 ARG 106 -15.882 -7.740 6.074 696 HH12 ARG 106 2HH1 ARG 106 -17.503 -7.376 6.595 697 HH21 ARG 106 1HH2 ARG 106 -18.819 -7.590 3.336 698 HH22 ARG 106 2HH2 ARG 106 -19.262 -7.369 5.008 699 H GLY 107 H GLY 107 -9.803 -7.745 4.022 700 HA2 GLY 107 1HA GLY 107 -8.445 -9.952 3.870 701 HA3 GLY 107 2HA GLY 107 -7.891 -9.233 2.342 702 H GLU 108 H GLU 108 -5.777 -9.159 3.127 703 HA GLU 108 HA GLU 108 -5.239 -7.734 5.636 704 HB3 GLU 108 2HB GLU 108 -3.161 -9.130 5.451 705 HG3 GLU 108 2HG GLU 108 -5.740 -10.704 5.192 706 H VAL 109 H VAL 109 -4.594 -5.639 5.397 707 HA VAL 109 HA VAL 109 -2.904 -4.931 3.047 708 HB VAL 109 HB VAL 109 -5.074 -3.174 4.172 709 HG11 VAL 109 1HG1 VAL 109 -3.282 -2.104 2.799 710 HG12 VAL 109 2HG1 VAL 109 -3.587 -3.258 1.494 711 HG13 VAL 109 3HG1 VAL 109 -4.842 -2.083 1.938 712 HG21 VAL 109 3HG2 VAL 109 -6.460 -3.819 2.186 713 HG22 VAL 109 1HG2 VAL 109 -5.308 -5.131 1.848 714 HG23 VAL 109 2HG2 VAL 109 -6.272 -5.131 3.344 715 H ALA 110 H ALA 110 -0.950 -4.809 4.078 716 HA ALA 110 HA ALA 110 -0.603 -3.232 6.532 717 HB1 ALA 110 1HB ALA 110 1.356 -4.673 4.697 718 HB2 ALA 110 2HB ALA 110 1.748 -3.886 6.242 719 HB3 ALA 110 3HB ALA 110 0.676 -5.299 6.214 720 H SER 111 H SER 111 0.730 -1.379 6.686 721 HA SER 111 HA SER 111 1.066 0.163 4.184 722 HB3 SER 111 2HB SER 111 -0.850 0.941 5.149 723 HG SER 111 HG SER 111 -1.154 1.230 7.369 724 H PHE 112 H PHE 112 3.095 0.905 3.794 725 HA PHE 112 HA PHE 112 4.870 1.405 6.074 726 HB3 PHE 112 2HB PHE 112 5.344 -0.885 5.545 727 HD1 PHE 112 1HD PHE 112 3.739 -1.621 3.633 728 HD2 PHE 112 2HD PHE 112 7.731 -0.068 3.000 729 HE1 PHE 112 1HE PHE 112 3.807 -2.682 1.424 730 HE2 PHE 112 2HE PHE 112 7.776 -1.155 0.770 731 HZ PHE 112 HZ PHE 112 5.817 -2.495 -0.006 732 H PHE 113 H PHE 113 6.927 2.435 5.471 733 HA PHE 113 HA PHE 113 6.859 4.200 3.136 734 HB3 PHE 113 2HB PHE 113 6.861 6.197 4.589 735 HD1 PHE 113 2HD PHE 113 4.574 3.855 6.443 736 HD2 PHE 113 1HD PHE 113 4.855 7.016 3.521 737 HE1 PHE 113 2HE PHE 113 2.113 4.076 6.437 738 HE2 PHE 113 1HE PHE 113 2.406 7.297 3.599 739 HZ PHE 113 HZ PHE 113 1.033 5.813 5.045 740 H THR 114 H THR 114 8.982 5.648 3.244 741 HA THR 114 HA THR 114 11.123 4.335 4.851 742 HB THR 114 HB THR 114 12.537 4.202 2.901 743 HG1 THR 114 1HG THR 114 11.509 5.956 1.811 744 HG21 THR 114 3HG2 THR 114 10.982 2.286 3.373 745 HG22 THR 114 1HG2 THR 114 11.475 2.426 1.664 746 HG23 THR 114 2HG2 THR 114 9.856 2.943 2.159 747 H SER 115 H SER 115 10.566 6.379 6.094 748 HA SER 115 HA SER 115 11.142 8.924 4.800 749 HB3 SER 115 2HB SER 115 10.115 9.921 6.636 750 HG SER 115 HG SER 115 8.576 8.241 7.476 751 H ALA 116 H ALA 116 12.204 10.551 6.637 752 HA ALA 116 HA ALA 116 15.033 9.989 6.383 753 HB1 ALA 116 1HB ALA 116 13.869 12.081 5.559 754 HB2 ALA 116 2HB ALA 116 13.464 12.462 7.244 755 HB3 ALA 116 3HB ALA 116 15.162 12.409 6.718 756 H GLY 117 H GLY 117 13.173 8.833 8.693 757 HA2 GLY 117 1HA GLY 117 13.729 8.193 10.840 758 HA3 GLY 117 2HA GLY 117 15.215 9.125 10.630 759 H THR 118 H THR 118 12.599 11.177 10.058 760 HA THR 118 HA THR 118 12.183 11.926 12.879 761 HB THR 118 HB THR 118 12.077 14.326 11.954 762 HG1 THR 118 1HG THR 118 13.058 14.794 10.137 763 HG21 THR 118 3HG2 THR 118 14.790 12.920 11.973 764 HG22 THR 118 1HG2 THR 118 13.901 13.458 13.411 765 HG23 THR 118 2HG2 THR 118 14.495 14.651 12.242 766 H ASN 119 H ASN 119 10.099 13.186 13.082 767 HA ASN 119 HA ASN 119 7.870 13.304 12.928 768 HB3 ASN 119 2HB ASN 119 6.864 13.689 10.667 769 HD21 ASN 119 1HD2 ASN 119 9.709 15.381 9.728 770 HD22 ASN 119 2HD2 ASN 119 9.422 16.783 10.710 771 H HIS 120 H HIS 120 8.948 10.653 13.253 772 HA HIS 120 HA HIS 120 7.690 8.851 11.475 773 HB3 HIS 120 2HB HIS 120 9.663 8.202 12.701 774 HD1 HIS 120 1HD HIS 120 7.941 6.913 15.798 775 HD2 HIS 120 2HD HIS 120 10.443 10.093 14.569 776 HE1 HIS 120 1HE HIS 120 8.790 8.022 17.902 777 H LYS 121 H LYS 121 6.608 10.066 14.717 778 HA LYS 121 HA LYS 121 4.462 8.163 14.807 779 HB3 LYS 121 2HB LYS 121 4.108 10.688 16.358 780 HG3 LYS 121 2HG LYS 121 4.391 8.931 18.245 781 HD3 LYS 121 2HD LYS 121 2.118 8.425 16.284 782 HE3 LYS 121 2HE LYS 121 2.496 7.883 19.263 783 HZ1 LYS 121 3HZ LYS 121 0.253 8.558 18.784 784 HZ2 LYS 121 1HZ LYS 121 0.279 6.962 19.122 785 HZ3 LYS 121 2HZ LYS 121 0.111 7.440 17.569 786 H ALA 122 H ALA 122 4.729 11.404 13.438 787 HA ALA 122 HA ALA 122 2.040 11.972 12.921 788 HB1 ALA 122 1HB ALA 122 4.503 12.652 11.232 789 HB2 ALA 122 2HB ALA 122 2.928 13.431 11.107 790 HB3 ALA 122 3HB ALA 122 3.865 13.607 12.589 791 H TYR 123 H TYR 123 4.363 10.064 10.900 792 HA TYR 123 HA TYR 123 2.606 9.759 8.737 793 HB3 TYR 123 2HB TYR 123 5.162 9.189 9.099 794 HD1 TYR 123 1HD TYR 123 3.211 6.074 8.214 795 HD2 TYR 123 2HD TYR 123 6.560 7.857 10.196 796 HE1 TYR 123 1HE TYR 123 4.086 3.826 8.747 797 HE2 TYR 123 2HE TYR 123 7.415 5.611 10.853 798 HH TYR 123 HH TYR 123 6.059 2.735 9.431 799 H VAL 124 H VAL 124 3.098 7.658 11.560 800 HA VAL 124 HA VAL 124 1.386 5.583 10.735 801 HB VAL 124 HB VAL 124 2.082 6.397 13.588 802 HG11 VAL 124 1HG1 VAL 124 1.838 3.986 14.096 803 HG12 VAL 124 2HG1 VAL 124 0.304 4.667 13.505 804 HG13 VAL 124 3HG1 VAL 124 1.302 3.667 12.437 805 HG21 VAL 124 3HG2 VAL 124 3.978 4.835 13.410 806 HG22 VAL 124 1HG2 VAL 124 3.561 4.496 11.720 807 HG23 VAL 124 2HG2 VAL 124 4.144 6.100 12.192 808 H SER 125 H SER 125 0.679 8.614 12.563 809 HA SER 125 HA SER 125 -2.128 7.967 13.029 810 HB3 SER 125 2HB SER 125 -0.577 10.609 12.858 811 HG SER 125 HG SER 125 -2.322 11.606 13.147 812 H HIS 126 H HIS 126 -0.384 9.909 10.526 813 HA HIS 126 HA HIS 126 -2.695 10.982 9.442 814 HB3 HIS 126 2HB HIS 126 -0.107 10.429 7.936 815 HD1 HIS 126 1HD HIS 126 -2.145 10.529 5.811 816 HD2 HIS 126 2HD HIS 126 -1.454 13.936 8.151 817 HE1 HIS 126 1HE HIS 126 -3.021 12.489 4.479 818 H PHE 127 H PHE 127 -1.007 7.973 8.405 819 HA PHE 127 HA PHE 127 -2.679 7.499 6.161 820 HB3 PHE 127 2HB PHE 127 -1.386 5.417 7.922 821 HD1 PHE 127 2HD PHE 127 -3.325 3.847 7.393 822 HD2 PHE 127 1HD PHE 127 -0.960 5.638 4.272 823 HE1 PHE 127 2HE PHE 127 -3.910 1.983 5.887 824 HE2 PHE 127 1HE PHE 127 -1.556 3.776 2.767 825 HZ PHE 127 HZ PHE 127 -2.988 1.915 3.565 826 H ASN 128 H ASN 128 -3.031 6.153 9.483 827 HA ASN 128 HA ASN 128 -5.369 4.774 9.233 828 HB3 ASN 128 2HB ASN 128 -5.798 5.509 11.701 829 HD21 ASN 128 1HD2 ASN 128 -3.051 5.067 13.010 830 HD22 ASN 128 2HD2 ASN 128 -2.779 3.365 12.797 831 H GLU 129 H GLU 129 -5.336 8.279 10.148 832 HA GLU 129 HA GLU 129 -8.181 8.504 10.274 833 HB3 GLU 129 2HB GLU 129 -7.355 11.059 9.550 834 HG3 GLU 129 2HG GLU 129 -6.467 11.197 12.047 835 H TRP 130 H TRP 130 -5.997 8.705 7.547 836 HA TRP 130 HA TRP 130 -8.084 9.538 5.604 837 HB3 TRP 130 2HB TRP 130 -6.038 9.582 4.115 838 HD1 TRP 130 HD TRP 130 -5.598 11.276 7.603 839 HE1 TRP 130 1HE TRP 130 -5.543 13.799 7.257 840 HE3 TRP 130 3HE TRP 130 -6.200 11.379 2.539 841 HZ2 TRP 130 2HZ TRP 130 -5.485 15.634 4.989 842 HZ3 TRP 130 3HZ TRP 130 -6.202 13.519 1.313 843 HH2 TRP 130 HH TRP 130 -5.800 15.634 2.481 844 H ALA 131 H ALA 131 -7.630 6.699 7.070 845 HA ALA 131 HA ALA 131 -7.774 5.078 4.590 846 HB1 ALA 131 1HB ALA 131 -5.992 4.603 7.009 847 HB2 ALA 131 2HB ALA 131 -6.172 3.500 5.661 848 HB3 ALA 131 3HB ALA 131 -5.435 5.075 5.384 849 H ASP 132 H ASP 132 -9.120 5.739 7.674 850 HA ASP 132 HA ASP 132 -9.745 3.222 8.579 851 HB3 ASP 132 2HB ASP 132 -11.603 5.581 8.887 852 H GLY 133 H GLY 133 -10.664 1.666 7.395 853 HA2 GLY 133 1HA GLY 133 -13.180 1.729 6.015 854 HA3 GLY 133 2HA GLY 133 -11.898 2.207 4.901 855 H LEU 134 H LEU 134 -9.911 0.677 4.897 856 HA LEU 134 HA LEU 134 -10.844 -2.097 4.651 857 HB3 LEU 134 2HB LEU 134 -8.464 -2.526 3.938 858 HG LEU 134 HG LEU 134 -8.389 -1.549 1.832 859 HD11 LEU 134 1HD1 LEU 134 -10.090 -3.301 2.217 860 HD12 LEU 134 2HD1 LEU 134 -10.510 -2.213 0.875 861 HD13 LEU 134 3HD1 LEU 134 -11.323 -2.050 2.441 862 HD21 LEU 134 3HD2 LEU 134 -8.921 0.818 2.430 863 HD22 LEU 134 1HD2 LEU 134 -10.651 0.381 2.454 864 HD23 LEU 134 2HD2 LEU 134 -9.713 0.223 0.959 865 H ASN 135 H ASN 135 -8.960 -3.694 5.501 866 HA ASN 135 HA ASN 135 -8.682 -3.317 8.438 867 HB3 ASN 135 2HB ASN 135 -8.784 -5.705 6.574 868 HD21 ASN 135 1HD2 ASN 135 -7.269 -7.241 6.795 869 HD22 ASN 135 2HD2 ASN 135 -6.572 -7.757 8.319 870 H VAL 136 H VAL 136 -6.622 -3.254 9.300 871 HA VAL 136 HA VAL 136 -4.328 -3.272 7.420 872 HB VAL 136 HB VAL 136 -4.903 -1.511 9.827 873 HG11 VAL 136 1HG1 VAL 136 -2.361 -1.580 8.140 874 HG12 VAL 136 2HG1 VAL 136 -2.757 -0.414 9.417 875 HG13 VAL 136 3HG1 VAL 136 -2.505 -2.082 9.846 876 HG21 VAL 136 3HG2 VAL 136 -4.490 -0.823 6.895 877 HG22 VAL 136 1HG2 VAL 136 -6.044 -0.773 7.766 878 HG23 VAL 136 2HG2 VAL 136 -4.751 0.343 8.203 879 H ILE 137 H ILE 137 -2.999 -4.988 7.790 880 HA ILE 137 HA ILE 137 -3.106 -6.383 10.353 881 HB ILE 137 HB ILE 137 -1.546 -7.960 9.322 882 HG13 ILE 137 2HG1 ILE 137 -0.410 -6.224 7.870 883 HG21 ILE 137 1HG2 ILE 137 -3.147 -8.917 7.782 884 HG22 ILE 137 2HG2 ILE 137 -4.009 -8.193 9.124 885 HG23 ILE 137 3HG2 ILE 137 -3.962 -7.343 7.567 886 HD11 ILE 137 3HD1 ILE 137 -0.002 -8.628 7.503 887 HD12 ILE 137 1HD1 ILE 137 -1.349 -8.680 6.373 888 HD13 ILE 137 2HD1 ILE 137 0.058 -7.677 5.997 889 H GLY 138 H GLY 138 -1.194 -3.725 9.258 890 HA2 GLY 138 1HA GLY 138 0.114 -3.401 11.671 891 HA3 GLY 138 2HA GLY 138 1.218 -4.338 10.659 892 H VAL 139 H VAL 139 1.780 -1.725 11.536 893 HA VAL 139 HA VAL 139 1.961 -0.306 8.943 894 HB VAL 139 HB VAL 139 1.681 1.131 11.623 895 HG11 VAL 139 1HG1 VAL 139 1.476 2.049 8.729 896 HG12 VAL 139 2HG1 VAL 139 1.189 3.066 10.149 897 HG13 VAL 139 3HG1 VAL 139 2.800 2.386 9.868 898 HG21 VAL 139 3HG2 VAL 139 -0.442 -0.008 11.325 899 HG22 VAL 139 1HG2 VAL 139 -0.639 1.688 10.926 900 HG23 VAL 139 2HG2 VAL 139 -0.492 0.493 9.622 901 H ALA 140 H ALA 140 4.128 -0.017 8.487 902 HA ALA 140 HA ALA 140 6.090 0.055 10.718 903 HB1 ALA 140 1HB ALA 140 7.392 -1.759 10.079 904 HB2 ALA 140 2HB ALA 140 5.748 -2.385 9.875 905 HB3 ALA 140 3HB ALA 140 6.692 -1.864 8.459 906 H ARG 141 H ARG 141 8.464 0.002 9.355 907 HA ARG 141 HA ARG 141 8.168 1.809 7.059 908 HB3 ARG 141 2HB ARG 141 8.975 3.208 8.898 909 HG3 ARG 141 2HG ARG 141 11.657 2.143 9.193 910 HD3 ARG 141 2HD ARG 141 10.979 2.091 11.633 911 HE ARG 141 HE ARG 141 11.175 4.369 9.940 912 HH11 ARG 141 1HH1 ARG 141 10.049 3.646 13.236 913 HH12 ARG 141 2HH1 ARG 141 10.600 5.191 13.844 914 HH21 ARG 141 1HH2 ARG 141 11.630 6.422 10.714 915 HH22 ARG 141 2HH2 ARG 141 11.491 6.755 12.422 916 H ASP 142 H ASP 142 10.061 1.624 5.662 917 HA ASP 142 HA ASP 142 11.520 0.429 4.409 918 HB3 ASP 142 2HB ASP 142 13.427 -0.495 5.569 919 H ASP 143 H ASP 143 12.698 -2.201 5.088 920 HA ASP 143 HA ASP 143 10.466 -3.988 4.380 921 HB3 ASP 143 2HB ASP 143 12.185 -3.690 2.692 922 H SER 144 H SER 144 11.119 -3.111 7.215 923 HA SER 144 HA SER 144 12.368 -5.312 8.451 924 HB3 SER 144 2HB SER 144 12.012 -3.978 10.398 925 HG SER 144 HG SER 144 13.515 -3.175 9.030 926 H GLU 145 H GLU 145 8.999 -4.920 7.522 927 HA GLU 145 HA GLU 145 8.306 -7.053 9.506 928 HB3 GLU 145 2HB GLU 145 6.116 -6.135 9.843 929 HG3 GLU 145 2HG GLU 145 8.251 -4.081 10.471 930 H VAL 146 H VAL 146 9.086 -7.108 6.536 931 HA VAL 146 HA VAL 146 6.784 -7.986 5.102 932 HB VAL 146 HB VAL 146 9.527 -9.235 4.733 933 HG11 VAL 146 1HG1 VAL 146 7.377 -8.347 2.778 934 HG12 VAL 146 2HG1 VAL 146 8.921 -9.144 2.344 935 HG13 VAL 146 3HG1 VAL 146 7.713 -10.017 3.289 936 HG21 VAL 146 3HG2 VAL 146 8.864 -6.409 3.818 937 HG22 VAL 146 1HG2 VAL 146 10.122 -6.900 4.974 938 HG23 VAL 146 2HG2 VAL 146 10.256 -7.388 3.296 939 H ASP 147 H ASP 147 8.983 -9.616 7.296 940 HA ASP 147 HA ASP 147 8.236 -12.273 6.859 941 HB3 ASP 147 2HB ASP 147 8.817 -12.254 9.557 942 H LYS 148 H LYS 148 6.425 -9.782 8.534 943 HA LYS 148 HA LYS 148 4.635 -11.921 9.664 944 HB3 LYS 148 2HB LYS 148 5.144 -10.330 11.347 945 HG3 LYS 148 2HG LYS 148 4.452 -8.297 9.254 946 HD3 LYS 148 2HD LYS 148 2.938 -7.810 11.144 947 HE3 LYS 148 2HE LYS 148 5.619 -7.498 12.534 948 HZ1 LYS 148 3HZ LYS 148 4.413 -5.485 12.754 949 HZ2 LYS 148 1HZ LYS 148 4.535 -6.235 14.176 950 HZ3 LYS 148 2HZ LYS 148 3.067 -6.278 13.361 951 H TRP 149 H TRP 149 4.866 -9.438 7.108 952 HA TRP 149 HA TRP 149 1.984 -9.665 6.621 953 HB3 TRP 149 2HB TRP 149 2.267 -8.029 4.945 954 HD1 TRP 149 HD TRP 149 1.982 -8.079 8.267 955 HE1 TRP 149 1HE TRP 149 2.512 -5.985 9.554 956 HE3 TRP 149 3HE TRP 149 4.538 -5.511 4.657 957 HZ2 TRP 149 2HZ TRP 149 3.779 -3.437 9.122 958 HZ3 TRP 149 3HZ TRP 149 5.282 -3.199 5.090 959 HH2 TRP 149 HH TRP 149 4.846 -2.118 7.294 960 H SER 150 H SER 150 4.066 -11.974 6.193 961 HA SER 150 HA SER 150 2.975 -12.808 3.595 962 HB3 SER 150 2HB SER 150 5.968 -12.971 3.979 963 HG SER 150 HG SER 150 4.360 -12.246 1.764 964 H LYS 151 H LYS 151 2.819 -13.629 6.541 965 HA LYS 151 HA LYS 151 3.733 -16.445 6.349 966 HB3 LYS 151 2HB LYS 151 2.967 -16.354 8.852 967 HG3 LYS 151 2HG LYS 151 5.513 -15.104 7.754 968 HD3 LYS 151 2HD LYS 151 5.159 -16.367 10.504 969 HE3 LYS 151 2HE LYS 151 7.361 -14.539 9.447 970 HZ1 LYS 151 3HZ LYS 151 7.426 -16.650 11.526 971 HZ2 LYS 151 1HZ LYS 151 7.459 -15.014 11.831 972 HZ3 LYS 151 2HZ LYS 151 8.675 -15.754 11.048 Start of MODEL 5 1 H1 GLY 1 H GLY 1 -9.244 -23.582 -7.703 2 HA2 GLY 1 1HA GLY 1 -10.269 -23.610 -4.917 3 HA3 GLY 1 2HA GLY 1 -9.489 -24.988 -5.718 4 H MET 2 H MET 2 -8.663 -21.449 -5.509 5 HA MET 2 HA MET 2 -6.393 -21.920 -3.822 6 HB3 MET 2 2HB MET 2 -5.214 -22.439 -5.828 7 HG3 MET 2 2HG MET 2 -4.982 -20.771 -7.684 8 HE1 MET 2 3HE MET 2 -7.165 -21.884 -10.598 9 HE2 MET 2 1HE MET 2 -6.943 -20.304 -9.813 10 HE3 MET 2 2HE MET 2 -5.543 -21.368 -10.085 11 H ALA 3 H ALA 3 -6.389 -20.157 -2.481 12 HA ALA 3 HA ALA 3 -7.103 -17.504 -3.500 13 HB1 ALA 3 1HB ALA 3 -9.339 -18.436 -3.014 14 HB2 ALA 3 2HB ALA 3 -8.814 -18.860 -1.365 15 HB3 ALA 3 3HB ALA 3 -8.922 -17.160 -1.856 16 H LYS 4 H LYS 4 -4.720 -17.617 -2.870 17 HA LYS 4 HA LYS 4 -4.514 -16.598 -0.109 18 HB3 LYS 4 2HB LYS 4 -4.169 -18.972 0.184 19 HG3 LYS 4 2HG LYS 4 -1.977 -19.930 -0.057 20 HD3 LYS 4 2HD LYS 4 -3.784 -20.401 -1.828 21 HE3 LYS 4 2HE LYS 4 -3.042 -18.415 -3.340 22 HZ1 LYS 4 3HZ LYS 4 -1.464 -19.145 -5.013 23 HZ2 LYS 4 1HZ LYS 4 -0.949 -20.387 -4.074 24 HZ3 LYS 4 2HZ LYS 4 -0.761 -18.826 -3.579 25 H LYS 5 H LYS 5 -4.274 -15.423 -2.746 26 HA LYS 5 HA LYS 5 -1.482 -15.070 -3.438 27 HB3 LYS 5 2HB LYS 5 -2.685 -13.243 -4.994 28 HG3 LYS 5 2HG LYS 5 -3.746 -15.433 -6.153 29 HD3 LYS 5 2HD LYS 5 -1.248 -16.017 -6.808 30 HE3 LYS 5 2HE LYS 5 -2.764 -13.430 -7.371 31 HZ1 LYS 5 3HZ LYS 5 -0.684 -12.926 -8.242 32 HZ2 LYS 5 1HZ LYS 5 -1.409 -13.575 -9.502 33 HZ3 LYS 5 2HZ LYS 5 -0.302 -14.457 -8.634 34 H THR 6 H THR 6 -0.342 -13.118 -3.770 35 HA THR 6 HA THR 6 -0.939 -11.041 -1.736 36 HB THR 6 HB THR 6 1.808 -12.094 -2.403 37 HG1 THR 6 1HG THR 6 0.137 -12.906 -0.241 38 HG21 THR 6 3HG2 THR 6 0.696 -10.337 -0.172 39 HG22 THR 6 1HG2 THR 6 1.848 -9.858 -1.428 40 HG23 THR 6 2HG2 THR 6 2.335 -11.002 -0.163 41 H LEU 7 H LEU 7 -0.990 -9.024 -2.567 42 HA LEU 7 HA LEU 7 0.540 -8.390 -5.094 43 HB3 LEU 7 2HB LEU 7 -1.948 -7.127 -3.905 44 HG LEU 7 HG LEU 7 -0.709 -5.375 -5.101 45 HD11 LEU 7 1HD1 LEU 7 0.684 -6.673 -6.650 46 HD12 LEU 7 2HD1 LEU 7 -0.356 -5.586 -7.560 47 HD13 LEU 7 3HD1 LEU 7 -0.766 -7.314 -7.457 48 HD21 LEU 7 3HD2 LEU 7 -3.059 -6.486 -6.698 49 HD22 LEU 7 1HD2 LEU 7 -2.468 -4.810 -6.731 50 HD23 LEU 7 2HD2 LEU 7 -3.183 -5.471 -5.249 51 H ILE 8 H ILE 8 1.760 -6.436 -5.117 52 HA ILE 8 HA ILE 8 2.156 -5.068 -2.534 53 HB ILE 8 HB ILE 8 4.414 -5.721 -4.459 54 HG13 ILE 8 2HG1 ILE 8 3.556 -7.939 -3.559 55 HG21 ILE 8 1HG2 ILE 8 5.774 -5.070 -2.443 56 HG22 ILE 8 2HG2 ILE 8 4.559 -3.822 -2.761 57 HG23 ILE 8 3HG2 ILE 8 4.309 -5.015 -1.472 58 HD11 ILE 8 3HD1 ILE 8 5.733 -8.784 -2.899 59 HD12 ILE 8 1HD1 ILE 8 5.911 -7.649 -4.246 60 HD13 ILE 8 2HD1 ILE 8 6.332 -7.155 -2.600 61 H LEU 9 H LEU 9 1.894 -2.871 -2.858 62 HA LEU 9 HA LEU 9 2.587 -1.723 -5.501 63 HB3 LEU 9 2HB LEU 9 0.741 -0.204 -5.374 64 HG LEU 9 HG LEU 9 0.240 -2.883 -5.928 65 HD11 LEU 9 1HD1 LEU 9 -1.987 -3.351 -4.883 66 HD12 LEU 9 2HD1 LEU 9 -1.781 -1.934 -3.842 67 HD13 LEU 9 3HD1 LEU 9 -0.674 -3.310 -3.705 68 HD21 LEU 9 3HD2 LEU 9 -1.719 -0.559 -6.095 69 HD22 LEU 9 1HD2 LEU 9 -1.809 -2.099 -7.011 70 HD23 LEU 9 2HD2 LEU 9 -0.475 -0.982 -7.282 71 H TYR 10 H TYR 10 2.881 0.672 -5.245 72 HA TYR 10 HA TYR 10 3.216 2.031 -2.890 73 HB3 TYR 10 2HB TYR 10 5.062 1.254 -1.972 74 HD1 TYR 10 2HD TYR 10 5.413 0.198 -5.590 75 HD2 TYR 10 1HD TYR 10 6.728 -0.343 -1.493 76 HE1 TYR 10 2HE TYR 10 6.053 -2.069 -6.080 77 HE2 TYR 10 1HE TYR 10 7.284 -2.650 -1.961 78 HH TYR 10 HH TYR 10 7.333 -4.354 -3.576 79 H TYR 11 H TYR 11 4.053 4.163 -3.136 80 HA TYR 11 HA TYR 11 4.231 5.068 -5.975 81 HB3 TYR 11 2HB TYR 11 3.616 6.548 -3.415 82 HD1 TYR 11 1HD TYR 11 4.235 6.963 -7.145 83 HD2 TYR 11 2HD TYR 11 4.107 8.864 -3.294 84 HE1 TYR 11 1HE TYR 11 5.069 9.042 -8.157 85 HE2 TYR 11 2HE TYR 11 5.000 10.973 -4.308 86 HH TYR 11 HH TYR 11 6.310 11.681 -6.539 87 H SER 12 H SER 12 6.269 4.936 -6.651 88 HA SER 12 HA SER 12 8.583 5.236 -4.989 89 HB3 SER 12 2HB SER 12 9.164 3.939 -6.700 90 HG SER 12 HG SER 12 7.585 3.571 -7.939 91 H TRP 13 H TRP 13 9.091 7.069 -4.046 92 HA TRP 13 HA TRP 13 8.116 9.609 -4.876 93 HB3 TRP 13 2HB TRP 13 10.410 9.041 -2.965 94 HD1 TRP 13 HD TRP 13 7.296 11.364 -2.953 95 HE1 TRP 13 1HE TRP 13 7.970 13.705 -2.319 96 HE3 TRP 13 3HE TRP 13 12.399 10.744 -2.865 97 HZ2 TRP 13 2HZ TRP 13 10.415 15.271 -2.271 98 HZ3 TRP 13 3HZ TRP 13 13.861 12.732 -2.692 99 HH2 TRP 13 HH TRP 13 12.893 14.982 -2.400 100 H SER 14 H SER 14 11.617 9.201 -4.413 101 HA SER 14 HA SER 14 12.274 9.523 -7.237 102 HB3 SER 14 2HB SER 14 13.954 11.361 -6.556 103 HG SER 14 HG SER 14 11.447 12.487 -6.559 104 H GLY 15 H GLY 15 12.690 7.285 -6.500 105 HA2 GLY 15 1HA GLY 15 14.448 5.769 -6.569 106 HA3 GLY 15 2HA GLY 15 15.562 7.054 -6.150 107 H GLU 16 H GLU 16 12.948 6.793 -3.900 108 HA GLU 16 HA GLU 16 14.811 5.547 -1.910 109 HB3 GLU 16 2HB GLU 16 13.244 6.513 -0.228 110 HG3 GLU 16 2HG GLU 16 13.544 8.931 -0.604 111 H THR 17 H THR 17 11.298 5.478 -2.801 112 HA THR 17 HA THR 17 10.628 3.284 -1.206 113 HB THR 17 HB THR 17 9.194 3.922 -3.726 114 HG1 THR 17 1HG THR 17 9.177 5.675 -1.513 115 HG21 THR 17 3HG2 THR 17 7.202 3.860 -2.375 116 HG22 THR 17 1HG2 THR 17 8.146 3.777 -0.895 117 HG23 THR 17 2HG2 THR 17 8.173 2.408 -2.027 118 H LYS 18 H LYS 18 11.735 3.549 -4.562 119 HA LYS 18 HA LYS 18 11.247 1.018 -5.556 120 HB3 LYS 18 2HB LYS 18 13.628 2.887 -6.027 121 HG3 LYS 18 2HG LYS 18 13.538 1.698 -8.341 122 HD3 LYS 18 2HD LYS 18 14.891 -0.414 -7.156 123 HE3 LYS 18 2HE LYS 18 16.958 1.049 -7.237 124 HZ1 LYS 18 3HZ LYS 18 16.100 -0.233 -9.205 125 HZ2 LYS 18 1HZ LYS 18 17.010 1.100 -9.580 126 HZ3 LYS 18 2HZ LYS 18 15.402 1.158 -9.734 127 H LYS 19 H LYS 19 14.072 1.806 -3.352 128 HA LYS 19 HA LYS 19 15.332 -0.605 -3.849 129 HB3 LYS 19 2HB LYS 19 15.304 0.404 -0.980 130 HG3 LYS 19 2HG LYS 19 17.767 -0.004 -2.677 131 HD3 LYS 19 2HD LYS 19 18.815 -0.526 -0.592 132 HE3 LYS 19 2HE LYS 19 16.854 1.734 0.022 133 HZ1 LYS 19 3HZ LYS 19 19.491 1.134 1.228 134 HZ2 LYS 19 1HZ LYS 19 18.003 1.021 1.971 135 HZ3 LYS 19 2HZ LYS 19 18.582 2.478 1.478 136 H MET 20 H MET 20 12.867 -0.023 -1.196 137 HA MET 20 HA MET 20 12.964 -2.669 -0.192 138 HB3 MET 20 2HB MET 20 12.627 -0.555 1.027 139 HG3 MET 20 2HG MET 20 10.182 -0.480 -0.636 140 HE1 MET 20 3HE MET 20 10.010 -1.818 2.509 141 HE2 MET 20 1HE MET 20 9.579 -2.041 0.823 142 HE3 MET 20 2HE MET 20 8.273 -1.834 2.035 143 H ALA 21 H ALA 21 11.605 -1.423 -3.198 144 HA ALA 21 HA ALA 21 9.198 -2.969 -3.047 145 HB1 ALA 21 1HB ALA 21 9.187 -0.839 -4.272 146 HB2 ALA 21 2HB ALA 21 10.498 -1.387 -5.327 147 HB3 ALA 21 3HB ALA 21 8.940 -2.164 -5.416 148 H GLU 22 H GLU 22 12.085 -2.831 -5.132 149 HA GLU 22 HA GLU 22 11.881 -5.360 -6.213 150 HB3 GLU 22 2HB GLU 22 14.092 -5.082 -7.077 151 HG3 GLU 22 2HG GLU 22 13.419 -2.201 -6.495 152 H LYS 23 H LYS 23 13.126 -4.478 -3.028 153 HA LYS 23 HA LYS 23 14.417 -6.959 -2.391 154 HB3 LYS 23 2HB LYS 23 13.156 -5.811 -0.080 155 HG3 LYS 23 2HG LYS 23 15.571 -6.752 -0.371 156 HD3 LYS 23 2HD LYS 23 17.158 -4.714 -0.280 157 HE3 LYS 23 2HE LYS 23 17.349 -4.424 -2.771 158 HZ1 LYS 23 3HZ LYS 23 18.356 -6.295 -1.652 159 HZ2 LYS 23 1HZ LYS 23 17.871 -6.732 -3.170 160 HZ3 LYS 23 2HZ LYS 23 17.008 -7.217 -1.859 161 H ILE 24 H ILE 24 11.213 -5.746 -1.331 162 HA ILE 24 HA ILE 24 10.506 -8.161 -0.163 163 HB ILE 24 HB ILE 24 8.827 -5.807 -1.151 164 HG13 ILE 24 2HG1 ILE 24 10.677 -5.446 0.618 165 HG21 ILE 24 1HG2 ILE 24 7.992 -7.910 0.897 166 HG22 ILE 24 2HG2 ILE 24 7.027 -6.525 0.370 167 HG23 ILE 24 3HG2 ILE 24 7.377 -7.840 -0.748 168 HD11 ILE 24 3HD1 ILE 24 9.373 -4.079 2.075 169 HD12 ILE 24 1HD1 ILE 24 8.742 -3.882 0.418 170 HD13 ILE 24 2HD1 ILE 24 7.882 -4.873 1.604 171 H ASN 25 H ASN 25 9.845 -7.013 -3.503 172 HA ASN 25 HA ASN 25 8.010 -9.074 -4.149 173 HB3 ASN 25 2HB ASN 25 10.060 -7.814 -6.014 174 HD21 ASN 25 1HD2 ASN 25 6.785 -9.380 -5.678 175 HD22 ASN 25 2HD2 ASN 25 6.904 -10.186 -7.204 176 H SER 26 H SER 26 11.513 -9.176 -3.874 177 HA SER 26 HA SER 26 11.678 -11.913 -4.949 178 HB3 SER 26 2HB SER 26 14.169 -11.387 -4.587 179 HG SER 26 HG SER 26 13.707 -11.210 -6.579 180 H GLU 27 H GLU 27 10.812 -10.715 -1.915 181 HA GLU 27 HA GLU 27 12.129 -13.082 -0.636 182 HB3 GLU 27 2HB GLU 27 11.661 -11.884 1.506 183 HG3 GLU 27 2HG GLU 27 13.356 -10.103 1.352 184 H ILE 28 H ILE 28 9.048 -11.585 -1.523 185 HA ILE 28 HA ILE 28 7.527 -13.402 0.204 186 HB ILE 28 HB ILE 28 6.678 -11.316 -1.870 187 HG13 ILE 28 2HG1 ILE 28 7.618 -10.342 0.188 188 HG21 ILE 28 1HG2 ILE 28 4.356 -11.775 -0.848 189 HG22 ILE 28 2HG2 ILE 28 5.011 -13.029 -1.878 190 HG23 ILE 28 3HG2 ILE 28 5.054 -13.211 -0.111 191 HD11 ILE 28 3HD1 ILE 28 4.632 -10.253 0.729 192 HD12 ILE 28 1HD1 ILE 28 5.844 -9.026 1.054 193 HD13 ILE 28 2HD1 ILE 28 5.379 -9.362 -0.621 194 H LYS 29 H LYS 29 6.241 -15.041 -0.615 195 HA LYS 29 HA LYS 29 7.122 -16.353 -3.097 196 HB3 LYS 29 2HB LYS 29 5.456 -17.114 -0.701 197 HG3 LYS 29 2HG LYS 29 4.383 -18.228 -2.659 198 HD3 LYS 29 2HD LYS 29 6.454 -20.250 -2.914 199 HE3 LYS 29 2HE LYS 29 5.373 -18.422 -5.064 200 HZ1 LYS 29 3HZ LYS 29 6.010 -21.317 -5.099 201 HZ2 LYS 29 1HZ LYS 29 7.044 -20.148 -5.615 202 HZ3 LYS 29 2HZ LYS 29 5.625 -20.381 -6.410 203 H ASP 30 H ASP 30 5.893 -16.613 -4.751 204 HA ASP 30 HA ASP 30 4.502 -15.943 -6.440 205 HB3 ASP 30 2HB ASP 30 3.515 -17.978 -5.745 206 H SER 31 H SER 31 5.048 -13.650 -4.869 207 HA SER 31 HA SER 31 2.660 -12.054 -4.672 208 HB3 SER 31 2HB SER 31 4.913 -10.327 -4.944 209 HG SER 31 HG SER 31 3.856 -11.559 -2.624 210 H GLU 32 H GLU 32 2.740 -9.805 -5.777 211 HA GLU 32 HA GLU 32 3.621 -9.815 -8.587 212 HB3 GLU 32 2HB GLU 32 1.491 -7.982 -8.426 213 HG3 GLU 32 2HG GLU 32 2.219 -9.721 -10.286 214 H LEU 33 H LEU 33 3.561 -7.242 -9.208 215 HA LEU 33 HA LEU 33 4.630 -5.571 -7.054 216 HB3 LEU 33 2HB LEU 33 6.155 -6.634 -9.477 217 HG LEU 33 HG LEU 33 6.521 -4.165 -9.396 218 HD11 LEU 33 1HD1 LEU 33 7.802 -4.677 -6.681 219 HD12 LEU 33 2HD1 LEU 33 6.181 -4.023 -6.869 220 HD13 LEU 33 3HD1 LEU 33 7.552 -3.114 -7.506 221 HD21 LEU 33 3HD2 LEU 33 8.358 -5.791 -10.062 222 HD22 LEU 33 1HD2 LEU 33 9.016 -5.606 -8.411 223 HD23 LEU 33 2HD2 LEU 33 8.903 -4.211 -9.496 224 H LYS 34 H LYS 34 3.499 -3.603 -7.401 225 HA LYS 34 HA LYS 34 3.238 -2.629 -10.209 226 HB3 LYS 34 2HB LYS 34 0.997 -1.692 -9.564 227 HG3 LYS 34 2HG LYS 34 -0.382 -3.721 -9.414 228 HD3 LYS 34 2HD LYS 34 1.902 -4.149 -11.380 229 HE3 LYS 34 2HE LYS 34 -1.021 -4.690 -11.866 230 HZ1 LYS 34 3HZ LYS 34 -0.112 -6.325 -13.337 231 HZ2 LYS 34 1HZ LYS 34 1.397 -6.184 -12.683 232 HZ3 LYS 34 2HZ LYS 34 0.761 -4.954 -13.573 233 H GLU 35 H GLU 35 2.695 -0.133 -10.121 234 HA GLU 35 HA GLU 35 3.642 1.147 -7.661 235 HB3 GLU 35 2HB GLU 35 5.656 0.960 -9.059 236 HG3 GLU 35 2HG GLU 35 5.761 2.464 -11.097 237 H VAL 36 H VAL 36 3.004 3.418 -7.525 238 HA VAL 36 HA VAL 36 0.631 4.039 -9.232 239 HB VAL 36 HB VAL 36 0.750 4.342 -6.224 240 HG11 VAL 36 1HG1 VAL 36 -0.953 5.691 -7.454 241 HG12 VAL 36 2HG1 VAL 36 -1.513 4.245 -8.317 242 HG13 VAL 36 3HG1 VAL 36 -1.765 4.393 -6.575 243 HG21 VAL 36 3HG2 VAL 36 -0.168 1.953 -7.816 244 HG22 VAL 36 1HG2 VAL 36 0.956 1.999 -6.447 245 HG23 VAL 36 2HG2 VAL 36 -0.764 2.297 -6.180 246 H LYS 37 H LYS 37 1.574 5.744 -10.380 247 HA LYS 37 HA LYS 37 2.799 7.958 -8.801 248 HB3 LYS 37 2HB LYS 37 3.483 8.896 -10.897 249 HG3 LYS 37 2HG LYS 37 4.506 6.537 -9.883 250 HD3 LYS 37 2HD LYS 37 3.339 5.552 -12.173 251 HE3 LYS 37 2HE LYS 37 5.216 5.284 -13.806 252 HZ1 LYS 37 3HZ LYS 37 5.080 7.447 -14.805 253 HZ2 LYS 37 1HZ LYS 37 4.447 8.127 -13.459 254 HZ3 LYS 37 2HZ LYS 37 3.605 6.988 -14.303 255 H VAL 38 H VAL 38 2.231 10.227 -9.853 256 HA VAL 38 HA VAL 38 -0.704 10.565 -9.642 257 HB VAL 38 HB VAL 38 -0.243 12.666 -8.438 258 HG11 VAL 38 1HG1 VAL 38 -0.704 10.591 -7.201 259 HG12 VAL 38 2HG1 VAL 38 1.021 10.270 -7.039 260 HG13 VAL 38 3HG1 VAL 38 0.302 11.706 -6.268 261 HG21 VAL 38 3HG2 VAL 38 1.869 13.271 -7.542 262 HG22 VAL 38 1HG2 VAL 38 2.662 11.792 -8.139 263 HG23 VAL 38 2HG2 VAL 38 2.115 13.059 -9.255 264 H SER 39 H SER 39 -0.602 13.395 -10.254 265 HA SER 39 HA SER 39 -0.217 13.405 -13.140 266 HB3 SER 39 2HB SER 39 -0.593 15.804 -11.515 267 HG SER 39 HG SER 39 -2.146 16.021 -13.403 268 H GLU 40 H GLU 40 0.886 15.884 -13.500 269 HA GLU 40 HA GLU 40 3.603 15.743 -12.292 270 HB3 GLU 40 2HB GLU 40 3.586 15.210 -14.721 271 HG3 GLU 40 2HG GLU 40 2.897 18.155 -15.071 272 H GLY 41 H GLY 41 4.490 17.739 -11.665 273 HA2 GLY 41 1HA GLY 41 4.422 19.891 -10.831 274 HA3 GLY 41 2HA GLY 41 2.986 20.205 -11.788 275 H THR 42 H THR 42 3.008 17.455 -9.419 276 HA THR 42 HA THR 42 0.722 18.688 -8.096 277 HB THR 42 HB THR 42 2.199 16.108 -7.448 278 HG1 THR 42 1HG THR 42 -0.111 16.360 -9.080 279 HG21 THR 42 3HG2 THR 42 0.576 16.924 -5.719 280 HG22 THR 42 1HG2 THR 42 0.072 15.399 -6.464 281 HG23 THR 42 2HG2 THR 42 -0.698 16.939 -6.946 282 H PHE 43 H PHE 43 4.176 17.833 -7.435 283 HA PHE 43 HA PHE 43 4.258 19.798 -5.314 284 HB3 PHE 43 2HB PHE 43 3.480 18.327 -3.917 285 HD1 PHE 43 2HD PHE 43 5.785 16.236 -5.915 286 HD2 PHE 43 1HD PHE 43 2.168 16.585 -3.721 287 HE1 PHE 43 2HE PHE 43 5.228 13.876 -6.579 288 HE2 PHE 43 1HE PHE 43 1.538 14.195 -4.364 289 HZ PHE 43 HZ PHE 43 3.134 12.838 -5.715 290 H ASP 44 H ASP 44 6.372 19.874 -4.192 291 HA ASP 44 HA ASP 44 8.537 19.545 -6.200 292 HB3 ASP 44 2HB ASP 44 8.821 21.509 -3.968 293 H ALA 45 H ALA 45 10.649 20.020 -4.229 294 HA ALA 45 HA ALA 45 10.356 17.615 -2.473 295 HB1 ALA 45 1HB ALA 45 12.797 18.576 -3.978 296 HB2 ALA 45 2HB ALA 45 12.768 17.246 -2.810 297 HB3 ALA 45 3HB ALA 45 11.839 17.112 -4.315 298 H ASP 46 H ASP 46 9.853 20.603 -2.103 299 HA ASP 46 HA ASP 46 11.920 21.641 -0.496 300 HB3 ASP 46 2HB ASP 46 9.115 22.737 -0.433 301 H MET 47 H MET 47 10.529 22.842 1.643 302 HA MET 47 HA MET 47 9.393 20.623 3.255 303 HB3 MET 47 2HB MET 47 11.816 21.100 3.834 304 HG3 MET 47 2HG MET 47 10.715 23.681 4.993 305 HE1 MET 47 3HE MET 47 14.115 23.426 3.464 306 HE2 MET 47 1HE MET 47 15.222 22.926 4.754 307 HE3 MET 47 2HE MET 47 14.121 21.737 4.015 308 H TYR 48 H TYR 48 9.287 24.101 2.403 309 HA TYR 48 HA TYR 48 6.922 24.388 4.181 310 HB3 TYR 48 2HB TYR 48 8.383 26.165 4.565 311 HD1 TYR 48 2HD TYR 48 7.564 27.360 1.130 312 HD2 TYR 48 1HD TYR 48 10.688 26.070 3.824 313 HE1 TYR 48 2HE TYR 48 9.260 27.762 -0.628 314 HE2 TYR 48 1HE TYR 48 12.383 26.538 2.105 315 HH TYR 48 HH TYR 48 11.784 26.348 -0.831 316 H LYS 49 H LYS 49 7.940 24.737 0.707 317 HA LYS 49 HA LYS 49 5.455 25.632 -0.247 318 HB3 LYS 49 2HB LYS 49 7.389 23.763 -1.701 319 HG3 LYS 49 2HG LYS 49 5.066 24.598 -2.741 320 HD3 LYS 49 2HD LYS 49 6.950 26.777 -3.706 321 HE3 LYS 49 2HE LYS 49 3.960 26.183 -3.844 322 HZ1 LYS 49 3HZ LYS 49 3.609 28.184 -4.900 323 HZ2 LYS 49 1HZ LYS 49 5.196 28.607 -4.971 324 HZ3 LYS 49 2HZ LYS 49 4.355 28.590 -3.523 325 H THR 50 H THR 50 6.601 22.218 0.088 326 HA THR 50 HA THR 50 4.123 21.156 -0.886 327 HB THR 50 HB THR 50 5.265 19.014 -0.087 328 HG1 THR 50 1HG THR 50 6.772 19.968 1.416 329 HG21 THR 50 3HG2 THR 50 5.419 19.897 -2.414 330 HG22 THR 50 1HG2 THR 50 6.920 19.104 -1.905 331 HG23 THR 50 2HG2 THR 50 6.848 20.859 -1.946 332 H SER 51 H SER 51 5.039 22.370 2.253 333 HA SER 51 HA SER 51 2.921 20.915 3.649 334 HB3 SER 51 2HB SER 51 3.563 22.454 5.512 335 HG SER 51 HG SER 51 4.808 20.868 5.862 336 H ASP 52 H ASP 52 2.943 23.459 1.374 337 HA ASP 52 HA ASP 52 0.350 24.435 2.444 338 HB3 ASP 52 2HB ASP 52 1.639 25.121 -0.222 339 H ILE 53 H ILE 53 1.771 22.722 -0.373 340 HA ILE 53 HA ILE 53 -0.604 22.108 -1.677 341 HB ILE 53 HB ILE 53 1.946 20.393 -1.643 342 HG13 ILE 53 2HG1 ILE 53 1.986 23.013 -2.390 343 HG21 ILE 53 1HG2 ILE 53 -0.210 20.536 -3.782 344 HG22 ILE 53 2HG2 ILE 53 1.224 19.495 -3.733 345 HG23 ILE 53 3HG2 ILE 53 -0.072 19.242 -2.586 346 HD11 ILE 53 3HD1 ILE 53 3.413 22.276 -4.497 347 HD12 ILE 53 1HD1 ILE 53 4.036 22.081 -2.867 348 HD13 ILE 53 2HD1 ILE 53 3.322 20.690 -3.701 349 H ALA 54 H ALA 54 1.126 20.035 0.724 350 HA ALA 54 HA ALA 54 -0.936 18.030 0.672 351 HB1 ALA 54 1HB ALA 54 0.313 17.098 2.613 352 HB2 ALA 54 2HB ALA 54 1.404 17.537 1.286 353 HB3 ALA 54 3HB ALA 54 1.267 18.587 2.712 354 H LEU 55 H LEU 55 -0.855 21.133 2.237 355 HA LEU 55 HA LEU 55 -2.603 20.276 4.447 356 HB3 LEU 55 2HB LEU 55 -1.520 23.004 3.668 357 HG LEU 55 HG LEU 55 -3.399 23.272 5.192 358 HD11 LEU 55 1HD1 LEU 55 -3.688 21.101 6.205 359 HD12 LEU 55 2HD1 LEU 55 -3.273 22.183 7.519 360 HD13 LEU 55 3HD1 LEU 55 -2.039 21.084 6.822 361 HD21 LEU 55 3HD2 LEU 55 -0.707 23.479 6.598 362 HD22 LEU 55 1HD2 LEU 55 -2.199 24.268 7.162 363 HD23 LEU 55 2HD2 LEU 55 -1.489 24.712 5.603 364 H ASP 56 H ASP 56 -2.667 22.063 1.416 365 HA ASP 56 HA ASP 56 -5.142 23.335 1.433 366 HB3 ASP 56 2HB ASP 56 -4.850 22.206 -1.156 367 H GLN 57 H GLN 57 -4.266 20.083 0.451 368 HA GLN 57 HA GLN 57 -6.897 19.128 -0.182 369 HB3 GLN 57 2HB GLN 57 -5.676 17.013 -0.575 370 HG3 GLN 57 2HG GLN 57 -4.140 19.495 -1.527 371 HE21 GLN 57 1HE2 GLN 57 -3.740 18.485 -4.173 372 HE22 GLN 57 2HE2 GLN 57 -2.522 17.246 -4.044 373 H ILE 58 H ILE 58 -5.616 19.726 2.858 374 HA ILE 58 HA ILE 58 -7.209 17.559 4.161 375 HB ILE 58 HB ILE 58 -5.064 19.392 5.303 376 HG13 ILE 58 2HG1 ILE 58 -4.338 17.340 3.900 377 HG21 ILE 58 1HG2 ILE 58 -6.840 19.013 6.984 378 HG22 ILE 58 2HG2 ILE 58 -6.733 17.262 6.720 379 HG23 ILE 58 3HG2 ILE 58 -5.384 18.164 7.443 380 HD11 ILE 58 3HD1 ILE 58 -3.441 17.388 6.805 381 HD12 ILE 58 1HD1 ILE 58 -2.552 16.740 5.426 382 HD13 ILE 58 2HD1 ILE 58 -2.835 18.474 5.546 383 H GLN 59 H GLN 59 -6.481 21.125 4.344 384 HA GLN 59 HA GLN 59 -8.669 21.497 6.136 385 HB3 GLN 59 2HB GLN 59 -8.354 23.919 5.711 386 HG3 GLN 59 2HG GLN 59 -5.690 22.544 6.173 387 HE21 GLN 59 1HE2 GLN 59 -4.236 24.298 6.439 388 HE22 GLN 59 2HE2 GLN 59 -4.710 25.795 7.251 389 H GLY 60 H GLY 60 -8.664 21.256 2.682 390 HA2 GLY 60 1HA GLY 60 -10.800 20.502 1.789 391 HA3 GLY 60 2HA GLY 60 -11.624 21.745 2.744 392 H ASN 61 H ASN 61 -8.608 22.503 1.211 393 HA ASN 61 HA ASN 61 -9.827 24.704 -0.213 394 HB3 ASN 61 2HB ASN 61 -7.498 25.284 -0.754 395 HD21 ASN 61 1HD2 ASN 61 -5.668 25.880 0.815 396 HD22 ASN 61 2HD2 ASN 61 -6.101 26.129 2.488 397 H LYS 62 H LYS 62 -8.536 21.527 -1.013 398 HA LYS 62 HA LYS 62 -9.060 21.851 -3.895 399 HB3 LYS 62 2HB LYS 62 -6.676 20.528 -3.992 400 HG3 LYS 62 2HG LYS 62 -5.521 22.774 -4.254 401 HD3 LYS 62 2HD LYS 62 -8.011 22.077 -5.872 402 HE3 LYS 62 2HE LYS 62 -5.829 24.109 -6.491 403 HZ1 LYS 62 3HZ LYS 62 -8.093 23.080 -8.056 404 HZ2 LYS 62 1HZ LYS 62 -6.550 23.445 -8.539 405 HZ3 LYS 62 2HZ LYS 62 -7.624 24.644 -8.202 406 H ASP 63 H ASP 63 -8.782 19.755 -5.024 407 HA ASP 63 HA ASP 63 -9.802 17.447 -3.549 408 HB3 ASP 63 2HB ASP 63 -10.873 17.917 -5.650 409 H PHE 64 H PHE 64 -8.626 15.409 -3.892 410 HA PHE 64 HA PHE 64 -5.767 15.596 -3.443 411 HB3 PHE 64 2HB PHE 64 -6.802 13.827 -2.316 412 HD1 PHE 64 1HD PHE 64 -7.613 12.865 -5.902 413 HD2 PHE 64 2HD PHE 64 -8.945 13.088 -1.813 414 HE1 PHE 64 1HE PHE 64 -9.860 12.189 -6.601 415 HE2 PHE 64 2HE PHE 64 -11.181 12.263 -2.510 416 HZ PHE 64 HZ PHE 64 -11.678 11.885 -4.918 417 HA PRO 65 HA PRO 65 -4.510 15.173 -7.703 418 HB3 PRO 65 2HB PRO 65 -2.332 15.142 -7.134 419 HG3 PRO 65 2HG PRO 65 -1.612 14.112 -5.063 420 HD3 PRO 65 2HD PRO 65 -3.441 15.396 -4.340 421 H GLU 66 H GLU 66 -4.408 13.788 -9.448 422 HA GLU 66 HA GLU 66 -6.144 11.446 -9.480 423 HB3 GLU 66 2HB GLU 66 -6.185 13.003 -11.336 424 HG3 GLU 66 2HG GLU 66 -3.205 12.426 -11.560 425 H ILE 67 H ILE 67 -5.222 9.431 -10.789 426 HA ILE 67 HA ILE 67 -2.391 8.889 -10.069 427 HB ILE 67 HB ILE 67 -2.871 6.576 -9.603 428 HG13 ILE 67 2HG1 ILE 67 -4.906 6.299 -11.032 429 HG21 ILE 67 1HG2 ILE 67 -3.873 6.808 -7.407 430 HG22 ILE 67 2HG2 ILE 67 -2.834 8.183 -7.795 431 HG23 ILE 67 3HG2 ILE 67 -4.604 8.359 -7.872 432 HD11 ILE 67 3HD1 ILE 67 -4.239 4.695 -9.131 433 HD12 ILE 67 1HD1 ILE 67 -5.592 5.421 -8.225 434 HD13 ILE 67 2HD1 ILE 67 -5.883 4.596 -9.772 435 H GLN 68 H GLN 68 -1.379 7.201 -11.339 436 HA GLN 68 HA GLN 68 -2.393 6.957 -14.125 437 HB3 GLN 68 2HB GLN 68 -0.210 7.252 -14.900 438 HG3 GLN 68 2HG GLN 68 0.794 9.234 -13.855 439 HE21 GLN 68 1HE2 GLN 68 -0.542 11.386 -13.191 440 HE22 GLN 68 2HE2 GLN 68 -2.050 11.644 -14.104 441 H LEU 69 H LEU 69 -2.827 5.084 -11.905 442 HA LEU 69 HA LEU 69 -1.361 2.699 -12.892 443 HB3 LEU 69 2HB LEU 69 -3.024 3.049 -10.362 444 HG LEU 69 HG LEU 69 -3.139 0.751 -11.192 445 HD11 LEU 69 1HD1 LEU 69 -1.184 0.543 -12.596 446 HD12 LEU 69 2HD1 LEU 69 -0.937 -0.581 -11.257 447 HD13 LEU 69 3HD1 LEU 69 -0.114 0.998 -11.281 448 HD21 LEU 69 3HD2 LEU 69 -1.176 0.568 -8.972 449 HD22 LEU 69 1HD2 LEU 69 -2.629 -0.372 -9.301 450 HD23 LEU 69 2HD2 LEU 69 -2.799 1.289 -8.711 451 H ASP 70 H ASP 70 -2.710 0.860 -13.480 452 HA ASP 70 HA ASP 70 -5.165 1.633 -14.888 453 HB3 ASP 70 2HB ASP 70 -5.008 -0.745 -15.755 454 H ASN 71 H ASN 71 -6.974 -0.071 -14.862 455 HA ASN 71 HA ASN 71 -7.607 -0.741 -12.053 456 HB3 ASN 71 2HB ASN 71 -9.363 -0.792 -14.566 457 HD21 ASN 71 1HD2 ASN 71 -10.809 0.120 -11.612 458 HD22 ASN 71 2HD2 ASN 71 -11.686 -1.383 -11.363 459 H ILE 72 H ILE 72 -7.750 -2.588 -11.237 460 HA ILE 72 HA ILE 72 -7.649 -5.104 -12.747 461 HB ILE 72 HB ILE 72 -5.640 -4.138 -10.668 462 HG13 ILE 72 2HG1 ILE 72 -5.166 -3.584 -13.033 463 HG21 ILE 72 1HG2 ILE 72 -4.689 -6.461 -10.675 464 HG22 ILE 72 2HG2 ILE 72 -6.267 -6.344 -9.939 465 HG23 ILE 72 3HG2 ILE 72 -6.114 -7.002 -11.587 466 HD11 ILE 72 3HD1 ILE 72 -2.988 -4.195 -13.107 467 HD12 ILE 72 1HD1 ILE 72 -3.363 -4.300 -11.378 468 HD13 ILE 72 2HD1 ILE 72 -3.258 -5.789 -12.361 469 H ASP 73 H ASP 73 -8.627 -6.756 -11.572 470 HA ASP 73 HA ASP 73 -10.485 -6.068 -9.445 471 HB3 ASP 73 2HB ASP 73 -10.627 -8.705 -9.567 472 H TYR 74 H TYR 74 -9.804 -5.986 -7.366 473 HA TYR 74 HA TYR 74 -7.162 -7.158 -6.674 474 HB3 TYR 74 2HB TYR 74 -7.293 -5.753 -4.658 475 HD1 TYR 74 1HD TYR 74 -5.489 -5.655 -6.800 476 HD2 TYR 74 2HD TYR 74 -8.704 -2.891 -5.922 477 HE1 TYR 74 1HE TYR 74 -4.276 -3.838 -7.967 478 HE2 TYR 74 2HE TYR 74 -7.526 -1.134 -7.119 479 HH TYR 74 HH TYR 74 -5.554 -0.760 -8.724 480 H ASN 75 H ASN 75 -10.279 -8.312 -6.551 481 HA ASN 75 HA ASN 75 -10.240 -9.306 -3.800 482 HB3 ASN 75 2HB ASN 75 -12.118 -10.722 -5.442 483 HD21 ASN 75 1HD2 ASN 75 -11.522 -8.015 -3.051 484 HD22 ASN 75 2HD2 ASN 75 -13.117 -8.080 -2.416 485 H ASN 76 H ASN 76 -8.714 -10.384 -6.657 486 HA ASN 76 HA ASN 76 -8.465 -13.138 -5.713 487 HB3 ASN 76 2HB ASN 76 -8.924 -12.983 -8.001 488 HD21 ASN 76 1HD2 ASN 76 -9.433 -10.729 -8.632 489 HD22 ASN 76 2HD2 ASN 76 -8.164 -9.720 -9.317 490 H TYR 77 H TYR 77 -7.495 -11.312 -3.919 491 HA TYR 77 HA TYR 77 -4.691 -12.133 -3.627 492 HB3 TYR 77 2HB TYR 77 -4.154 -9.866 -2.790 493 HD1 TYR 77 2HD TYR 77 -2.520 -11.062 -4.306 494 HD2 TYR 77 1HD TYR 77 -5.737 -8.689 -5.827 495 HE1 TYR 77 2HE TYR 77 -1.348 -10.946 -6.483 496 HE2 TYR 77 1HE TYR 77 -4.622 -8.560 -8.044 497 HH TYR 77 HH TYR 77 -1.494 -10.284 -8.635 498 H ASP 78 H ASP 78 -4.418 -12.805 -1.542 499 HA ASP 78 HA ASP 78 -6.645 -12.692 0.397 500 HB3 ASP 78 2HB ASP 78 -3.873 -13.951 0.504 501 H LEU 79 H LEU 79 -3.321 -11.468 -0.045 502 HA LEU 79 HA LEU 79 -3.671 -9.421 2.104 503 HB3 LEU 79 2HB LEU 79 -1.407 -11.304 1.417 504 HG LEU 79 HG LEU 79 -0.359 -9.010 1.472 505 HD11 LEU 79 1HD1 LEU 79 -1.835 -7.952 3.219 506 HD12 LEU 79 2HD1 LEU 79 -0.108 -7.861 3.607 507 HD13 LEU 79 3HD1 LEU 79 -1.130 -9.065 4.411 508 HD21 LEU 79 3HD2 LEU 79 0.787 -11.175 2.110 509 HD22 LEU 79 1HD2 LEU 79 0.460 -10.759 3.802 510 HD23 LEU 79 2HD2 LEU 79 1.467 -9.706 2.803 511 H ILE 80 H ILE 80 -2.967 -7.329 1.510 512 HA ILE 80 HA ILE 80 -1.447 -7.089 -1.006 513 HB ILE 80 HB ILE 80 -3.892 -5.390 -0.398 514 HG13 ILE 80 2HG1 ILE 80 -4.581 -7.679 -1.071 515 HG21 ILE 80 1HG2 ILE 80 -2.330 -4.061 -1.545 516 HG22 ILE 80 2HG2 ILE 80 -1.734 -5.397 -2.542 517 HG23 ILE 80 3HG2 ILE 80 -3.309 -4.681 -2.866 518 HD11 ILE 80 3HD1 ILE 80 -5.995 -5.833 -1.834 519 HD12 ILE 80 1HD1 ILE 80 -5.087 -5.777 -3.375 520 HD13 ILE 80 2HD1 ILE 80 -6.008 -7.207 -2.919 521 H LEU 81 H LEU 81 0.252 -5.712 -0.787 522 HA LEU 81 HA LEU 81 0.331 -3.967 1.656 523 HB3 LEU 81 2HB LEU 81 2.767 -3.943 1.274 524 HG LEU 81 HG LEU 81 1.212 -6.073 2.378 525 HD11 LEU 81 1HD1 LEU 81 3.573 -7.155 0.769 526 HD12 LEU 81 2HD1 LEU 81 1.853 -7.547 0.523 527 HD13 LEU 81 3HD1 LEU 81 2.681 -8.042 2.010 528 HD21 LEU 81 3HD2 LEU 81 4.184 -5.661 2.708 529 HD22 LEU 81 1HD2 LEU 81 3.045 -6.365 3.860 530 HD23 LEU 81 2HD2 LEU 81 2.951 -4.633 3.468 531 H ILE 82 H ILE 82 1.148 -1.844 1.454 532 HA ILE 82 HA ILE 82 1.228 -0.635 -1.223 533 HB ILE 82 HB ILE 82 -0.616 -0.047 1.093 534 HG13 ILE 82 2HG1 ILE 82 -0.939 -1.053 -1.673 535 HG21 ILE 82 1HG2 ILE 82 -1.395 2.022 0.031 536 HG22 ILE 82 2HG2 ILE 82 0.230 2.135 0.680 537 HG23 ILE 82 3HG2 ILE 82 0.002 1.953 -1.077 538 HD11 ILE 82 3HD1 ILE 82 -2.899 -0.869 0.657 539 HD12 ILE 82 1HD1 ILE 82 -3.074 -1.850 -0.803 540 HD13 ILE 82 2HD1 ILE 82 -1.801 -2.236 0.371 541 H GLY 83 H GLY 83 2.330 1.529 -1.104 542 HA2 GLY 83 1HA GLY 83 3.672 2.189 1.442 543 HA3 GLY 83 2HA GLY 83 4.705 1.798 0.083 544 H SER 84 H SER 84 4.562 4.358 1.486 545 HA SER 84 HA SER 84 4.353 6.009 -0.870 546 HB3 SER 84 2HB SER 84 2.270 6.622 -0.656 547 HG SER 84 HG SER 84 1.032 6.364 1.330 548 HA PRO 85 HA PRO 85 7.573 8.192 1.240 549 HB3 PRO 85 2HB PRO 85 8.102 9.448 -0.604 550 HG3 PRO 85 2HG PRO 85 6.514 9.515 -2.279 551 HD3 PRO 85 2HD PRO 85 5.608 7.556 -1.687 552 H VAL 86 H VAL 86 7.951 9.300 3.134 553 HA VAL 86 HA VAL 86 5.640 10.466 4.522 554 HB VAL 86 HB VAL 86 8.481 10.160 5.445 555 HG11 VAL 86 1HG1 VAL 86 6.056 11.382 6.774 556 HG12 VAL 86 2HG1 VAL 86 7.330 10.594 7.721 557 HG13 VAL 86 3HG1 VAL 86 7.711 11.970 6.682 558 HG21 VAL 86 3HG2 VAL 86 7.677 8.402 6.876 559 HG22 VAL 86 1HG2 VAL 86 6.009 8.679 6.350 560 HG23 VAL 86 2HG2 VAL 86 7.221 8.028 5.207 561 H TRP 87 H TRP 87 5.210 12.584 3.514 562 HA TRP 87 HA TRP 87 7.411 14.501 3.159 563 HB3 TRP 87 2HB TRP 87 4.929 15.881 3.300 564 HD1 TRP 87 HD TRP 87 6.723 17.549 1.942 565 HE1 TRP 87 1HE TRP 87 7.143 17.777 -0.588 566 HE3 TRP 87 3HE TRP 87 4.763 13.119 0.379 567 HZ2 TRP 87 2HZ TRP 87 6.900 16.138 -2.940 568 HZ3 TRP 87 3HZ TRP 87 4.763 12.528 -1.995 569 HH2 TRP 87 HH TRP 87 5.862 13.969 -3.676 570 H SER 88 H SER 88 6.834 16.690 4.349 571 HA SER 88 HA SER 88 7.873 16.525 6.846 572 HB3 SER 88 2HB SER 88 7.748 18.909 6.763 573 HG SER 88 HG SER 88 8.925 18.086 5.041 574 H GLY 89 H GLY 89 5.776 14.887 7.459 575 HA2 GLY 89 1HA GLY 89 4.698 15.174 9.809 576 HA3 GLY 89 2HA GLY 89 3.801 16.465 9.012 577 H TYR 90 H TYR 90 3.404 15.362 6.413 578 HA TYR 90 HA TYR 90 1.643 13.096 6.967 579 HB3 TYR 90 2HB TYR 90 -0.048 14.531 7.297 580 HD1 TYR 90 1HD TYR 90 1.790 16.620 4.684 581 HD2 TYR 90 2HD TYR 90 -0.304 16.485 8.461 582 HE1 TYR 90 1HE TYR 90 2.187 19.050 5.002 583 HE2 TYR 90 2HE TYR 90 0.094 18.893 8.774 584 HH TYR 90 HH TYR 90 0.846 20.856 7.776 585 HA PRO 91 HA PRO 91 2.994 12.214 2.798 586 HB3 PRO 91 2HB PRO 91 2.110 10.125 2.816 587 HG3 PRO 91 2HG PRO 91 0.310 9.649 4.313 588 HD3 PRO 91 2HD PRO 91 1.470 11.034 5.797 589 H ALA 92 H ALA 92 2.441 12.581 0.600 590 HA ALA 92 HA ALA 92 1.008 15.041 0.082 591 HB1 ALA 92 1HB ALA 92 1.834 14.704 -2.173 592 HB2 ALA 92 2HB ALA 92 3.096 14.785 -0.950 593 HB3 ALA 92 3HB ALA 92 2.619 13.203 -1.644 594 H THR 93 H THR 93 -0.694 13.160 1.008 595 HA THR 93 HA THR 93 -2.504 11.761 0.767 596 HB THR 93 HB THR 93 -4.277 12.936 -0.506 597 HG1 THR 93 1HG THR 93 -3.127 15.105 -1.345 598 HG21 THR 93 3HG2 THR 93 -4.238 15.046 0.673 599 HG22 THR 93 1HG2 THR 93 -2.493 14.960 0.906 600 HG23 THR 93 2HG2 THR 93 -3.555 13.820 1.754 601 HA PRO 94 HA PRO 94 -1.415 10.027 -3.445 602 HB3 PRO 94 2HB PRO 94 0.840 9.752 -3.020 603 HG3 PRO 94 2HG PRO 94 1.647 8.960 -0.909 604 HD3 PRO 94 2HD PRO 94 0.457 10.893 -0.543 605 H ILE 95 H ILE 95 -2.134 8.042 -0.541 606 HA ILE 95 HA ILE 95 -3.186 5.918 -2.272 607 HB ILE 95 HB ILE 95 -3.315 5.927 0.714 608 HG13 ILE 95 2HG1 ILE 95 -1.150 4.674 0.719 609 HG21 ILE 95 1HG2 ILE 95 -2.971 3.663 -1.329 610 HG22 ILE 95 2HG2 ILE 95 -3.209 3.489 0.426 611 HG23 ILE 95 3HG2 ILE 95 -4.493 4.120 -0.589 612 HD11 ILE 95 3HD1 ILE 95 -0.519 5.907 -2.009 613 HD12 ILE 95 1HD1 ILE 95 0.530 4.949 -0.993 614 HD13 ILE 95 2HD1 ILE 95 -0.862 4.184 -1.762 615 H LYS 96 H LYS 96 -4.487 8.816 -0.916 616 HA LYS 96 HA LYS 96 -7.062 8.015 -0.151 617 HB3 LYS 96 2HB LYS 96 -6.718 10.642 -1.624 618 HG3 LYS 96 2HG LYS 96 -7.766 11.591 0.355 619 HD3 LYS 96 2HD LYS 96 -9.384 9.132 -0.410 620 HE3 LYS 96 2HE LYS 96 -10.114 11.819 0.809 621 HZ1 LYS 96 3HZ LYS 96 -11.823 11.359 -0.703 622 HZ2 LYS 96 1HZ LYS 96 -12.405 10.861 0.705 623 HZ3 LYS 96 2HZ LYS 96 -11.861 9.723 -0.328 624 H THR 97 H THR 97 -6.050 9.201 -3.429 625 HA THR 97 HA THR 97 -8.481 8.845 -4.689 626 HB THR 97 HB THR 97 -5.698 8.629 -5.917 627 HG1 THR 97 1HG THR 97 -5.998 11.018 -5.914 628 HG21 THR 97 3HG2 THR 97 -7.626 8.418 -7.497 629 HG22 THR 97 1HG2 THR 97 -6.664 9.876 -7.786 630 HG23 THR 97 2HG2 THR 97 -8.218 10.002 -6.945 631 H LEU 98 H LEU 98 -5.646 6.591 -4.588 632 HA LEU 98 HA LEU 98 -6.767 4.529 -6.163 633 HB3 LEU 98 2HB LEU 98 -4.839 4.279 -3.803 634 HG LEU 98 HG LEU 98 -5.724 2.130 -4.994 635 HD11 LEU 98 1HD1 LEU 98 -4.573 1.564 -7.102 636 HD12 LEU 98 2HD1 LEU 98 -3.766 3.141 -7.116 637 HD13 LEU 98 3HD1 LEU 98 -5.519 3.047 -7.332 638 HD21 LEU 98 3HD2 LEU 98 -3.529 1.070 -4.868 639 HD22 LEU 98 1HD2 LEU 98 -3.726 2.200 -3.522 640 HD23 LEU 98 2HD2 LEU 98 -2.728 2.654 -4.916 641 H LEU 99 H LEU 99 -6.832 5.004 -2.594 642 HA LEU 99 HA LEU 99 -8.187 2.717 -1.836 643 HB3 LEU 99 2HB LEU 99 -9.170 4.454 -0.022 644 HG LEU 99 HG LEU 99 -6.440 3.209 -0.396 645 HD11 LEU 99 1HD1 LEU 99 -5.967 5.286 0.820 646 HD12 LEU 99 2HD1 LEU 99 -5.870 3.906 1.929 647 HD13 LEU 99 3HD1 LEU 99 -7.304 4.967 1.917 648 HD21 LEU 99 3HD2 LEU 99 -8.631 2.808 1.680 649 HD22 LEU 99 1HD2 LEU 99 -7.162 1.827 1.463 650 HD23 LEU 99 2HD2 LEU 99 -8.425 1.830 0.212 651 H ASP 100 H ASP 100 -9.581 5.742 -3.127 652 HA ASP 100 HA ASP 100 -12.297 5.026 -2.527 653 HB3 ASP 100 2HB ASP 100 -11.671 6.756 -4.892 654 H GLN 101 H GLN 101 -10.134 4.127 -5.143 655 HA GLN 101 HA GLN 101 -12.262 3.082 -6.860 656 HB3 GLN 101 2HB GLN 101 -10.363 2.306 -8.254 657 HG3 GLN 101 2HG GLN 101 -9.789 5.189 -7.559 658 HE21 GLN 101 1HE2 GLN 101 -7.886 4.961 -8.999 659 HE22 GLN 101 2HE2 GLN 101 -8.124 4.709 -10.719 660 H MET 102 H MET 102 -10.502 1.909 -4.132 661 HA MET 102 HA MET 102 -10.973 -0.930 -4.940 662 HB3 MET 102 2HB MET 102 -8.667 -0.397 -5.199 663 HG3 MET 102 2HG MET 102 -9.020 1.311 -3.009 664 HE1 MET 102 3HE MET 102 -5.642 1.414 -2.444 665 HE2 MET 102 1HE MET 102 -5.048 -0.079 -1.687 666 HE3 MET 102 2HE MET 102 -5.617 -0.109 -3.372 667 H LYS 103 H LYS 103 -12.249 1.127 -2.762 668 HA LYS 103 HA LYS 103 -11.997 0.184 -0.254 669 HB3 LYS 103 2HB LYS 103 -14.327 0.793 0.188 670 HG3 LYS 103 2HG LYS 103 -13.370 2.888 -1.740 671 HD3 LYS 103 2HD LYS 103 -13.941 3.014 1.241 672 HE3 LYS 103 2HE LYS 103 -14.103 5.091 -1.000 673 HZ1 LYS 103 3HZ LYS 103 -15.601 5.428 0.903 674 HZ2 LYS 103 1HZ LYS 103 -14.558 6.640 0.700 675 HZ3 LYS 103 2HZ LYS 103 -14.295 5.554 1.917 676 H ASN 104 H ASN 104 -13.322 -1.852 -2.673 677 HA ASN 104 HA ASN 104 -14.729 -3.635 -0.756 678 HB3 ASN 104 2HB ASN 104 -14.983 -5.031 -2.983 679 HD21 ASN 104 1HD2 ASN 104 -15.892 -1.557 -2.579 680 HD22 ASN 104 2HD2 ASN 104 -17.611 -1.873 -2.448 681 H TYR 105 H TYR 105 -11.574 -3.105 -1.295 682 HA TYR 105 HA TYR 105 -10.190 -5.506 -1.399 683 HB3 TYR 105 2HB TYR 105 -9.236 -4.126 0.866 684 HD1 TYR 105 1HD TYR 105 -9.085 -3.576 -2.878 685 HD2 TYR 105 2HD TYR 105 -6.986 -3.906 0.868 686 HE1 TYR 105 1HE TYR 105 -6.947 -2.957 -4.000 687 HE2 TYR 105 2HE TYR 105 -4.865 -3.287 -0.252 688 HH TYR 105 HH TYR 105 -4.739 -2.272 -3.701 689 H ARG 106 H ARG 106 -9.877 -7.221 0.071 690 HA ARG 106 HA ARG 106 -11.214 -7.091 2.728 691 HB3 ARG 106 2HB ARG 106 -11.912 -9.357 2.613 692 HG3 ARG 106 2HG ARG 106 -13.060 -8.164 0.086 693 HD3 ARG 106 2HD ARG 106 -14.389 -9.178 2.605 694 HE ARG 106 HE ARG 106 -15.359 -8.552 -0.095 695 HH11 ARG 106 1HH1 ARG 106 -16.139 -10.127 3.021 696 HH12 ARG 106 2HH1 ARG 106 -17.807 -10.348 2.610 697 HH21 ARG 106 1HH2 ARG 106 -17.592 -8.699 -0.514 698 HH22 ARG 106 2HH2 ARG 106 -18.649 -9.441 0.652 699 H GLY 107 H GLY 107 -10.203 -9.003 4.126 700 HA2 GLY 107 1HA GLY 107 -8.435 -10.387 4.651 701 HA3 GLY 107 2HA GLY 107 -7.592 -9.903 3.188 702 H GLU 108 H GLU 108 -5.661 -9.418 3.920 703 HA GLU 108 HA GLU 108 -5.254 -7.717 6.339 704 HB3 GLU 108 2HB GLU 108 -2.875 -8.507 5.978 705 HG3 GLU 108 2HG GLU 108 -4.952 -10.705 6.277 706 H VAL 109 H VAL 109 -4.064 -5.656 6.074 707 HA VAL 109 HA VAL 109 -2.968 -5.164 3.409 708 HB VAL 109 HB VAL 109 -4.641 -3.181 4.998 709 HG11 VAL 109 1HG1 VAL 109 -3.566 -3.021 2.126 710 HG12 VAL 109 2HG1 VAL 109 -4.520 -1.767 2.965 711 HG13 VAL 109 3HG1 VAL 109 -2.889 -2.144 3.495 712 HG21 VAL 109 3HG2 VAL 109 -5.380 -4.661 2.447 713 HG22 VAL 109 1HG2 VAL 109 -6.185 -4.810 4.033 714 HG23 VAL 109 2HG2 VAL 109 -6.292 -3.296 3.138 715 H ALA 110 H ALA 110 -1.039 -3.777 3.500 716 HA ALA 110 HA ALA 110 -0.366 -2.623 6.141 717 HB1 ALA 110 1HB ALA 110 1.115 -4.799 4.805 718 HB2 ALA 110 2HB ALA 110 2.110 -3.455 5.398 719 HB3 ALA 110 3HB ALA 110 1.044 -4.320 6.503 720 H SER 111 H SER 111 1.667 -1.127 5.891 721 HA SER 111 HA SER 111 1.479 0.518 3.479 722 HB3 SER 111 2HB SER 111 0.627 1.504 6.220 723 HG SER 111 HG SER 111 1.577 3.159 4.980 724 H PHE 112 H PHE 112 3.820 0.054 3.251 725 HA PHE 112 HA PHE 112 5.483 0.686 5.587 726 HB3 PHE 112 2HB PHE 112 6.479 -1.102 4.816 727 HD1 PHE 112 1HD PHE 112 5.688 0.597 1.545 728 HD2 PHE 112 2HD PHE 112 6.164 -3.124 3.657 729 HE1 PHE 112 1HE PHE 112 4.840 -0.656 -0.435 730 HE2 PHE 112 2HE PHE 112 5.506 -4.349 1.620 731 HZ PHE 112 HZ PHE 112 4.794 -3.096 -0.415 732 H PHE 113 H PHE 113 6.901 2.348 5.780 733 HA PHE 113 HA PHE 113 6.723 4.685 3.927 734 HB3 PHE 113 2HB PHE 113 7.972 5.875 5.645 735 HD1 PHE 113 2HD PHE 113 5.464 6.651 5.533 736 HD2 PHE 113 1HD PHE 113 6.893 3.530 8.224 737 HE1 PHE 113 2HE PHE 113 3.544 6.818 6.950 738 HE2 PHE 113 1HE PHE 113 5.023 3.939 9.723 739 HZ PHE 113 HZ PHE 113 3.277 5.614 9.070 740 H THR 114 H THR 114 8.958 5.799 3.373 741 HA THR 114 HA THR 114 11.251 4.007 3.733 742 HB THR 114 HB THR 114 11.714 5.238 1.218 743 HG1 THR 114 1HG THR 114 9.159 3.995 1.195 744 HG21 THR 114 3HG2 THR 114 11.808 2.920 0.473 745 HG22 THR 114 1HG2 THR 114 10.911 2.417 1.928 746 HG23 THR 114 2HG2 THR 114 12.534 3.097 2.071 747 H SER 115 H SER 115 10.265 6.667 4.811 748 HA SER 115 HA SER 115 12.224 8.581 3.973 749 HB3 SER 115 2HB SER 115 11.269 9.438 6.511 750 HG SER 115 HG SER 115 10.250 10.917 5.117 751 H ALA 116 H ALA 116 13.424 9.792 5.943 752 HA ALA 116 HA ALA 116 15.483 7.950 6.953 753 HB1 ALA 116 1HB ALA 116 16.262 9.879 5.556 754 HB2 ALA 116 2HB ALA 116 15.411 11.002 6.622 755 HB3 ALA 116 3HB ALA 116 16.779 10.047 7.238 756 H GLY 117 H GLY 117 13.425 7.377 8.215 757 HA2 GLY 117 1HA GLY 117 12.671 7.075 10.303 758 HA3 GLY 117 2HA GLY 117 14.109 8.005 10.778 759 H THR 118 H THR 118 12.004 9.988 8.986 760 HA THR 118 HA THR 118 11.503 11.488 11.443 761 HB THR 118 HB THR 118 11.314 13.218 9.319 762 HG1 THR 118 1HG THR 118 13.419 11.495 8.591 763 HG21 THR 118 3HG2 THR 118 13.858 12.231 10.662 764 HG22 THR 118 1HG2 THR 118 12.761 13.506 11.250 765 HG23 THR 118 2HG2 THR 118 13.674 13.755 9.748 766 H ASN 119 H ASN 119 9.569 12.660 11.823 767 HA ASN 119 HA ASN 119 7.443 13.184 11.845 768 HB3 ASN 119 2HB ASN 119 6.306 13.788 9.915 769 HD21 ASN 119 1HD2 ASN 119 7.463 15.938 10.277 770 HD22 ASN 119 2HD2 ASN 119 8.936 16.183 9.349 771 H HIS 120 H HIS 120 8.269 10.231 12.079 772 HA HIS 120 HA HIS 120 6.519 8.662 10.513 773 HB3 HIS 120 2HB HIS 120 7.169 6.864 12.293 774 HD1 HIS 120 1HD HIS 120 8.765 8.877 9.513 775 HD2 HIS 120 2HD HIS 120 9.515 5.460 11.872 776 HE1 HIS 120 1HE HIS 120 10.348 7.401 8.184 777 H LYS 121 H LYS 121 6.217 9.672 13.962 778 HA LYS 121 HA LYS 121 3.905 8.004 14.415 779 HB3 LYS 121 2HB LYS 121 3.911 10.475 16.020 780 HG3 LYS 121 2HG LYS 121 4.671 7.724 16.975 781 HD3 LYS 121 2HD LYS 121 4.462 9.802 18.556 782 HE3 LYS 121 2HE LYS 121 1.551 9.069 17.969 783 HZ1 LYS 121 3HZ LYS 121 1.926 9.291 20.392 784 HZ2 LYS 121 1HZ LYS 121 0.932 10.428 19.767 785 HZ3 LYS 121 2HZ LYS 121 2.459 10.839 20.154 786 H ALA 122 H ALA 122 4.285 11.373 13.285 787 HA ALA 122 HA ALA 122 1.500 12.015 13.376 788 HB1 ALA 122 1HB ALA 122 3.686 13.174 11.577 789 HB2 ALA 122 2HB ALA 122 2.089 13.885 11.897 790 HB3 ALA 122 3HB ALA 122 3.265 13.752 13.209 791 H TYR 123 H TYR 123 3.497 10.616 10.731 792 HA TYR 123 HA TYR 123 1.416 10.659 8.772 793 HB3 TYR 123 2HB TYR 123 3.554 8.553 8.979 794 HD1 TYR 123 1HD TYR 123 1.069 7.680 7.556 795 HD2 TYR 123 2HD TYR 123 4.280 10.274 6.256 796 HE1 TYR 123 1HE TYR 123 0.818 6.822 5.321 797 HE2 TYR 123 2HE TYR 123 4.069 9.269 3.983 798 HH TYR 123 HH TYR 123 2.275 6.485 3.253 799 H VAL 124 H VAL 124 2.353 7.982 11.115 800 HA VAL 124 HA VAL 124 0.470 6.058 10.282 801 HB VAL 124 HB VAL 124 1.396 6.627 13.117 802 HG11 VAL 124 1HG1 VAL 124 1.025 4.170 13.436 803 HG12 VAL 124 2HG1 VAL 124 -0.488 5.040 13.127 804 HG13 VAL 124 3HG1 VAL 124 0.274 4.079 11.836 805 HG21 VAL 124 3HG2 VAL 124 3.161 4.982 12.710 806 HG22 VAL 124 1HG2 VAL 124 2.535 4.642 11.084 807 HG23 VAL 124 2HG2 VAL 124 3.284 6.196 11.439 808 H SER 125 H SER 125 0.056 8.667 12.787 809 HA SER 125 HA SER 125 -2.682 8.273 13.303 810 HB3 SER 125 2HB SER 125 -2.478 10.535 14.256 811 HG SER 125 HG SER 125 -1.231 8.726 15.206 812 H HIS 126 H HIS 126 -1.197 9.865 10.525 813 HA HIS 126 HA HIS 126 -3.659 11.329 9.832 814 HB3 HIS 126 2HB HIS 126 -1.107 11.163 8.187 815 HD1 HIS 126 1HD HIS 126 -2.292 12.446 5.998 816 HD2 HIS 126 2HD HIS 126 -2.815 14.180 9.836 817 HE1 HIS 126 1HE HIS 126 -3.297 14.699 5.636 818 H PHE 127 H PHE 127 -1.765 8.506 8.691 819 HA PHE 127 HA PHE 127 -3.224 8.093 6.238 820 HB3 PHE 127 2HB PHE 127 -1.871 6.059 8.033 821 HD1 PHE 127 1HD PHE 127 -2.385 7.006 4.333 822 HD2 PHE 127 2HD PHE 127 -2.163 3.847 7.304 823 HE1 PHE 127 1HE PHE 127 -2.623 5.333 2.598 824 HE2 PHE 127 2HE PHE 127 -2.375 2.189 5.471 825 HZ PHE 127 HZ PHE 127 -2.617 2.922 3.127 826 H ASN 128 H ASN 128 -3.746 7.067 9.577 827 HA ASN 128 HA ASN 128 -5.985 5.454 9.259 828 HB3 ASN 128 2HB ASN 128 -6.595 6.541 11.603 829 HD21 ASN 128 1HD2 ASN 128 -3.105 5.669 11.281 830 HD22 ASN 128 2HD2 ASN 128 -3.316 3.976 11.631 831 H GLU 129 H GLU 129 -6.054 9.105 9.280 832 HA GLU 129 HA GLU 129 -8.935 9.200 9.133 833 HB3 GLU 129 2HB GLU 129 -8.329 11.533 8.064 834 HG3 GLU 129 2HG GLU 129 -7.179 11.735 10.736 835 H TRP 130 H TRP 130 -6.522 8.554 6.689 836 HA TRP 130 HA TRP 130 -8.489 9.217 4.529 837 HB3 TRP 130 2HB TRP 130 -6.552 9.481 3.087 838 HD1 TRP 130 HD TRP 130 -4.710 11.207 5.768 839 HE1 TRP 130 1HE TRP 130 -5.373 13.640 6.037 840 HE3 TRP 130 3HE TRP 130 -8.980 11.215 2.964 841 HZ2 TRP 130 2HZ TRP 130 -7.184 15.482 4.792 842 HZ3 TRP 130 3HZ TRP 130 -10.176 13.367 2.530 843 HH2 TRP 130 HH TRP 130 -9.291 15.494 3.438 844 H ALA 131 H ALA 131 -7.326 6.551 6.174 845 HA ALA 131 HA ALA 131 -7.806 4.717 3.902 846 HB1 ALA 131 1HB ALA 131 -5.359 4.923 4.427 847 HB2 ALA 131 2HB ALA 131 -5.713 4.398 6.090 848 HB3 ALA 131 3HB ALA 131 -6.016 3.307 4.728 849 H ASP 132 H ASP 132 -9.346 5.908 6.339 850 HA ASP 132 HA ASP 132 -10.071 3.703 7.977 851 HB3 ASP 132 2HB ASP 132 -11.830 6.072 7.166 852 H GLY 133 H GLY 133 -11.032 1.897 7.269 853 HA2 GLY 133 1HA GLY 133 -13.267 1.304 6.056 854 HA3 GLY 133 2HA GLY 133 -12.356 1.754 4.612 855 H LEU 134 H LEU 134 -9.748 0.656 5.753 856 HA LEU 134 HA LEU 134 -10.364 -2.253 5.412 857 HB3 LEU 134 2HB LEU 134 -8.056 -2.407 4.439 858 HG LEU 134 HG LEU 134 -8.525 -1.996 2.268 859 HD11 LEU 134 1HD1 LEU 134 -11.323 -2.123 3.461 860 HD12 LEU 134 2HD1 LEU 134 -10.245 -3.507 3.156 861 HD13 LEU 134 3HD1 LEU 134 -10.896 -2.533 1.819 862 HD21 LEU 134 3HD2 LEU 134 -8.848 0.474 2.502 863 HD22 LEU 134 1HD2 LEU 134 -10.571 0.169 2.796 864 HD23 LEU 134 2HD2 LEU 134 -9.823 -0.321 1.252 865 H ASN 135 H ASN 135 -8.145 -3.534 6.134 866 HA ASN 135 HA ASN 135 -7.861 -2.906 9.043 867 HB3 ASN 135 2HB ASN 135 -8.491 -5.506 7.594 868 HD21 ASN 135 1HD2 ASN 135 -6.870 -6.864 8.152 869 HD22 ASN 135 2HD2 ASN 135 -6.478 -7.334 9.806 870 H VAL 136 H VAL 136 -5.769 -2.803 9.698 871 HA VAL 136 HA VAL 136 -3.787 -3.665 7.721 872 HB VAL 136 HB VAL 136 -3.924 -1.394 7.641 873 HG11 VAL 136 1HG1 VAL 136 -3.654 0.124 9.573 874 HG12 VAL 136 2HG1 VAL 136 -5.127 -0.847 9.643 875 HG13 VAL 136 3HG1 VAL 136 -3.708 -1.292 10.644 876 HG21 VAL 136 3HG2 VAL 136 -1.564 -2.307 7.821 877 HG22 VAL 136 1HG2 VAL 136 -1.750 -0.587 8.182 878 HG23 VAL 136 2HG2 VAL 136 -1.554 -1.753 9.506 879 H ILE 137 H ILE 137 -2.133 -4.907 8.205 880 HA ILE 137 HA ILE 137 -2.004 -6.079 10.879 881 HB ILE 137 HB ILE 137 -0.542 -7.752 9.821 882 HG13 ILE 137 2HG1 ILE 137 0.510 -6.250 8.102 883 HG21 ILE 137 1HG2 ILE 137 -2.315 -8.795 8.577 884 HG22 ILE 137 2HG2 ILE 137 -3.093 -7.812 9.829 885 HG23 ILE 137 3HG2 ILE 137 -3.051 -7.226 8.157 886 HD11 ILE 137 3HD1 ILE 137 0.653 -7.840 6.289 887 HD12 ILE 137 1HD1 ILE 137 0.703 -8.662 7.856 888 HD13 ILE 137 2HD1 ILE 137 -0.770 -8.725 6.875 889 H GLY 138 H GLY 138 -0.370 -3.466 9.445 890 HA2 GLY 138 1HA GLY 138 1.021 -2.784 11.707 891 HA3 GLY 138 2HA GLY 138 2.164 -3.784 10.782 892 H VAL 139 H VAL 139 2.613 -1.064 11.341 893 HA VAL 139 HA VAL 139 2.791 0.101 8.611 894 HB VAL 139 HB VAL 139 1.817 1.759 11.002 895 HG11 VAL 139 1HG1 VAL 139 1.361 3.450 9.405 896 HG12 VAL 139 2HG1 VAL 139 3.076 2.966 9.199 897 HG13 VAL 139 3HG1 VAL 139 1.850 2.414 8.048 898 HG21 VAL 139 3HG2 VAL 139 -0.360 1.845 9.762 899 HG22 VAL 139 1HG2 VAL 139 0.270 0.602 8.659 900 HG23 VAL 139 2HG2 VAL 139 -0.006 0.232 10.377 901 H ALA 140 H ALA 140 4.992 0.021 8.393 902 HA ALA 140 HA ALA 140 6.717 1.246 10.429 903 HB1 ALA 140 1HB ALA 140 8.151 -0.583 10.822 904 HB2 ALA 140 2HB ALA 140 6.538 -1.283 10.950 905 HB3 ALA 140 3HB ALA 140 7.517 -1.506 9.467 906 H ARG 141 H ARG 141 9.290 1.031 9.392 907 HA ARG 141 HA ARG 141 8.871 2.201 6.708 908 HB3 ARG 141 2HB ARG 141 10.565 2.827 9.116 909 HG3 ARG 141 2HG ARG 141 11.394 4.809 7.662 910 HD3 ARG 141 2HD ARG 141 12.618 2.054 7.333 911 HE ARG 141 HE ARG 141 13.766 3.648 6.068 912 HH11 ARG 141 1HH1 ARG 141 14.193 4.034 9.625 913 HH12 ARG 141 2HH1 ARG 141 15.738 4.804 9.447 914 HH21 ARG 141 1HH2 ARG 141 15.826 4.718 5.960 915 HH22 ARG 141 2HH2 ARG 141 16.637 5.235 7.437 916 H ASP 142 H ASP 142 10.181 1.642 5.048 917 HA ASP 142 HA ASP 142 11.135 0.300 3.644 918 HB3 ASP 142 2HB ASP 142 13.312 -0.509 4.008 919 H ASP 143 H ASP 143 12.401 -2.132 3.827 920 HA ASP 143 HA ASP 143 10.372 -4.074 4.461 921 HB3 ASP 143 2HB ASP 143 11.587 -4.238 2.423 922 H SER 144 H SER 144 11.063 -2.727 6.814 923 HA SER 144 HA SER 144 12.987 -4.311 8.347 924 HB3 SER 144 2HB SER 144 10.871 -2.314 9.254 925 HG SER 144 HG SER 144 12.548 -2.153 11.025 926 H GLU 145 H GLU 145 9.563 -4.606 7.542 927 HA GLU 145 HA GLU 145 9.305 -6.844 9.516 928 HB3 GLU 145 2HB GLU 145 7.031 -6.115 9.938 929 HG3 GLU 145 2HG GLU 145 8.436 -3.536 10.362 930 H VAL 146 H VAL 146 9.737 -6.749 6.404 931 HA VAL 146 HA VAL 146 7.388 -7.723 5.202 932 HB VAL 146 HB VAL 146 9.144 -6.997 3.791 933 HG11 VAL 146 1HG1 VAL 146 11.080 -7.163 5.227 934 HG12 VAL 146 2HG1 VAL 146 11.031 -8.924 5.182 935 HG13 VAL 146 3HG1 VAL 146 11.424 -7.990 3.717 936 HG21 VAL 146 3HG2 VAL 146 9.322 -10.035 3.548 937 HG22 VAL 146 1HG2 VAL 146 8.033 -9.049 2.864 938 HG23 VAL 146 2HG2 VAL 146 9.703 -8.847 2.294 939 H ASP 147 H ASP 147 9.709 -9.336 7.254 940 HA ASP 147 HA ASP 147 9.129 -11.980 6.434 941 HB3 ASP 147 2HB ASP 147 9.969 -11.480 9.282 942 H LYS 148 H LYS 148 7.368 -9.826 8.475 943 HA LYS 148 HA LYS 148 5.811 -12.052 9.705 944 HB3 LYS 148 2HB LYS 148 6.550 -10.785 11.451 945 HG3 LYS 148 2HG LYS 148 5.863 -8.173 10.094 946 HD3 LYS 148 2HD LYS 148 7.421 -7.325 11.926 947 HE3 LYS 148 2HE LYS 148 4.893 -8.433 13.176 948 HZ1 LYS 148 3HZ LYS 148 6.436 -6.873 14.412 949 HZ2 LYS 148 1HZ LYS 148 4.928 -6.301 14.255 950 HZ3 LYS 148 2HZ LYS 148 6.145 -5.739 13.290 951 H TRP 149 H TRP 149 5.602 -9.171 7.611 952 HA TRP 149 HA TRP 149 2.695 -9.333 7.521 953 HB3 TRP 149 2HB TRP 149 2.915 -7.587 5.800 954 HD1 TRP 149 HD TRP 149 2.820 -7.752 9.164 955 HE1 TRP 149 1HE TRP 149 3.462 -5.679 10.429 956 HE3 TRP 149 3HE TRP 149 5.245 -5.292 5.402 957 HZ2 TRP 149 2HZ TRP 149 4.798 -3.095 9.862 958 HZ3 TRP 149 3HZ TRP 149 6.268 -3.066 5.824 959 HH2 TRP 149 HH TRP 149 6.017 -1.957 7.986 960 H SER 150 H SER 150 3.878 -11.834 6.809 961 HA SER 150 HA SER 150 2.735 -12.316 4.169 962 HB3 SER 150 2HB SER 150 5.739 -12.795 4.484 963 HG SER 150 HG SER 150 3.885 -12.887 2.330 964 H LYS 151 H LYS 151 2.209 -13.352 6.875 965 HA LYS 151 HA LYS 151 2.934 -16.188 6.537 966 HB3 LYS 151 2HB LYS 151 3.356 -16.243 9.048 967 HG3 LYS 151 2HG LYS 151 5.626 -15.371 8.944 968 HD3 LYS 151 2HD LYS 151 4.833 -16.860 6.408 969 HE3 LYS 151 2HE LYS 151 7.043 -15.727 6.410 970 HZ1 LYS 151 3HZ LYS 151 7.691 -16.192 8.671 971 HZ2 LYS 151 1HZ LYS 151 8.775 -16.795 7.646 972 HZ3 LYS 151 2HZ LYS 151 7.714 -17.820 8.409 Start of MODEL 6 1 H1 GLY 1 H GLY 1 -4.979 -27.216 -4.856 2 HA2 GLY 1 1HA GLY 1 -6.526 -24.746 -5.397 3 HA3 GLY 1 2HA GLY 1 -6.708 -25.667 -3.900 4 H MET 2 H MET 2 -5.786 -24.452 -2.347 5 HA MET 2 HA MET 2 -4.272 -23.235 -1.144 6 HB3 MET 2 2HB MET 2 -2.572 -25.562 -2.128 7 HG3 MET 2 2HG MET 2 -2.525 -23.924 0.446 8 HE1 MET 2 3HE MET 2 0.543 -24.374 0.915 9 HE2 MET 2 1HE MET 2 -0.589 -24.380 2.285 10 HE3 MET 2 2HE MET 2 0.593 -25.698 2.101 11 H ALA 3 H ALA 3 -4.276 -21.322 -2.610 12 HA ALA 3 HA ALA 3 -1.530 -20.673 -3.407 13 HB1 ALA 3 1HB ALA 3 -3.850 -20.595 -5.389 14 HB2 ALA 3 2HB ALA 3 -2.204 -19.980 -5.660 15 HB3 ALA 3 3HB ALA 3 -2.462 -21.703 -5.432 16 H LYS 4 H LYS 4 -1.797 -19.312 -1.528 17 HA LYS 4 HA LYS 4 -3.499 -16.852 -1.644 18 HB3 LYS 4 2HB LYS 4 -1.888 -16.179 0.172 19 HG3 LYS 4 2HG LYS 4 -3.476 -16.901 1.540 20 HD3 LYS 4 2HD LYS 4 -4.650 -18.977 1.622 21 HE3 LYS 4 2HE LYS 4 -5.104 -18.289 -1.263 22 HZ1 LYS 4 3HZ LYS 4 -7.309 -17.833 -0.340 23 HZ2 LYS 4 1HZ LYS 4 -6.740 -18.038 1.189 24 HZ3 LYS 4 2HZ LYS 4 -6.840 -19.332 0.175 25 H LYS 5 H LYS 5 -2.265 -14.875 -1.610 26 HA LYS 5 HA LYS 5 -0.648 -14.814 -4.098 27 HB3 LYS 5 2HB LYS 5 -2.338 -13.183 -5.036 28 HG3 LYS 5 2HG LYS 5 -4.395 -14.832 -4.974 29 HD3 LYS 5 2HD LYS 5 -1.897 -15.399 -6.606 30 HE3 LYS 5 2HE LYS 5 -3.477 -16.372 -8.229 31 HZ1 LYS 5 3HZ LYS 5 -4.040 -18.370 -7.035 32 HZ2 LYS 5 1HZ LYS 5 -3.901 -17.634 -5.580 33 HZ3 LYS 5 2HZ LYS 5 -2.552 -17.851 -6.486 34 H THR 6 H THR 6 -0.122 -12.749 -4.566 35 HA THR 6 HA THR 6 -0.398 -10.663 -2.545 36 HB THR 6 HB THR 6 2.393 -11.665 -3.047 37 HG1 THR 6 1HG THR 6 0.558 -12.315 -1.158 38 HG21 THR 6 3HG2 THR 6 2.976 -10.047 -1.241 39 HG22 THR 6 1HG2 THR 6 1.318 -9.415 -1.317 40 HG23 THR 6 2HG2 THR 6 2.408 -9.272 -2.727 41 H LEU 7 H LEU 7 -0.874 -8.924 -3.597 42 HA LEU 7 HA LEU 7 0.549 -8.228 -6.140 43 HB3 LEU 7 2HB LEU 7 -1.770 -6.896 -4.718 44 HG LEU 7 HG LEU 7 -0.545 -5.333 -6.132 45 HD11 LEU 7 1HD1 LEU 7 -0.392 -5.629 -8.586 46 HD12 LEU 7 2HD1 LEU 7 -1.012 -7.297 -8.423 47 HD13 LEU 7 3HD1 LEU 7 0.566 -6.828 -7.758 48 HD21 LEU 7 3HD2 LEU 7 -3.120 -6.298 -7.434 49 HD22 LEU 7 1HD2 LEU 7 -2.478 -4.665 -7.521 50 HD23 LEU 7 2HD2 LEU 7 -3.040 -5.297 -5.976 51 H ILE 8 H ILE 8 1.956 -6.445 -6.093 52 HA ILE 8 HA ILE 8 2.518 -5.130 -3.459 53 HB ILE 8 HB ILE 8 4.310 -5.633 -5.865 54 HG13 ILE 8 2HG1 ILE 8 3.806 -7.730 -4.411 55 HG21 ILE 8 1HG2 ILE 8 4.862 -3.542 -4.661 56 HG22 ILE 8 2HG2 ILE 8 4.988 -4.467 -3.149 57 HG23 ILE 8 3HG2 ILE 8 6.136 -4.729 -4.464 58 HD11 ILE 8 3HD1 ILE 8 5.778 -7.777 -5.854 59 HD12 ILE 8 1HD1 ILE 8 6.716 -6.890 -4.656 60 HD13 ILE 8 2HD1 ILE 8 6.113 -8.505 -4.276 61 H LEU 9 H LEU 9 1.901 -2.921 -3.549 62 HA LEU 9 HA LEU 9 2.001 -1.561 -6.201 63 HB3 LEU 9 2HB LEU 9 -0.068 -0.330 -5.534 64 HG LEU 9 HG LEU 9 -0.474 -3.335 -5.453 65 HD11 LEU 9 1HD1 LEU 9 -2.810 -2.856 -6.014 66 HD12 LEU 9 2HD1 LEU 9 -2.486 -1.111 -5.894 67 HD13 LEU 9 3HD1 LEU 9 -2.335 -2.163 -4.464 68 HD21 LEU 9 3HD2 LEU 9 -0.958 -3.176 -7.833 69 HD22 LEU 9 1HD2 LEU 9 0.589 -2.453 -7.531 70 HD23 LEU 9 2HD2 LEU 9 -0.790 -1.383 -7.785 71 H TYR 10 H TYR 10 4.049 -0.597 -5.570 72 HA TYR 10 HA TYR 10 3.840 1.243 -3.210 73 HB3 TYR 10 2HB TYR 10 6.261 1.375 -3.318 74 HD1 TYR 10 1HD TYR 10 3.885 -1.284 -2.518 75 HD2 TYR 10 2HD TYR 10 8.093 -0.277 -2.700 76 HE1 TYR 10 1HE TYR 10 4.389 -3.148 -1.052 77 HE2 TYR 10 2HE TYR 10 8.572 -2.173 -1.170 78 HH TYR 10 HH TYR 10 6.190 -4.605 -0.322 79 H TYR 11 H TYR 11 4.682 3.415 -3.411 80 HA TYR 11 HA TYR 11 4.773 4.467 -6.181 81 HB3 TYR 11 2HB TYR 11 3.495 5.604 -3.717 82 HD1 TYR 11 1HD TYR 11 4.574 6.604 -7.239 83 HD2 TYR 11 2HD TYR 11 3.553 7.853 -3.257 84 HE1 TYR 11 1HE TYR 11 5.181 8.927 -7.821 85 HE2 TYR 11 2HE TYR 11 4.222 10.147 -3.822 86 HH TYR 11 HH TYR 11 5.544 11.134 -6.950 87 H SER 12 H SER 12 6.941 4.716 -6.524 88 HA SER 12 HA SER 12 8.735 5.610 -4.370 89 HB3 SER 12 2HB SER 12 9.713 3.986 -5.734 90 HG SER 12 HG SER 12 8.508 4.129 -7.643 91 H TRP 13 H TRP 13 9.473 7.560 -4.075 92 HA TRP 13 HA TRP 13 8.418 9.851 -5.482 93 HB3 TRP 13 2HB TRP 13 10.707 9.643 -3.467 94 HD1 TRP 13 HD TRP 13 7.450 11.560 -3.233 95 HE1 TRP 13 1HE TRP 13 7.887 13.960 -2.720 96 HE3 TRP 13 3HE TRP 13 12.541 11.576 -3.829 97 HZ2 TRP 13 2HZ TRP 13 10.150 15.789 -2.725 98 HZ3 TRP 13 3HZ TRP 13 13.811 13.695 -3.606 99 HH2 TRP 13 HH TRP 13 12.635 15.813 -3.044 100 H SER 14 H SER 14 11.898 9.382 -4.813 101 HA SER 14 HA SER 14 12.551 9.375 -7.693 102 HB3 SER 14 2HB SER 14 13.953 10.979 -5.518 103 HG SER 14 HG SER 14 14.629 12.099 -7.540 104 H GLY 15 H GLY 15 12.140 7.112 -6.565 105 HA2 GLY 15 1HA GLY 15 13.235 5.126 -6.931 106 HA3 GLY 15 2HA GLY 15 14.789 5.899 -6.658 107 H GLU 16 H GLU 16 13.489 6.860 -3.870 108 HA GLU 16 HA GLU 16 14.878 4.954 -2.347 109 HB3 GLU 16 2HB GLU 16 13.438 5.892 -0.409 110 HG3 GLU 16 2HG GLU 16 14.256 8.381 -1.033 111 H THR 17 H THR 17 11.262 5.266 -2.466 112 HA THR 17 HA THR 17 10.754 2.959 -1.036 113 HB THR 17 HB THR 17 8.917 4.003 -3.189 114 HG1 THR 17 1HG THR 17 9.308 5.398 -0.759 115 HG21 THR 17 3HG2 THR 17 7.192 3.845 -1.435 116 HG22 THR 17 1HG2 THR 17 8.403 3.248 -0.275 117 HG23 THR 17 2HG2 THR 17 7.983 2.296 -1.724 118 H LYS 18 H LYS 18 11.413 3.312 -4.476 119 HA LYS 18 HA LYS 18 10.381 0.848 -5.445 120 HB3 LYS 18 2HB LYS 18 12.636 2.665 -6.418 121 HG3 LYS 18 2HG LYS 18 11.520 1.265 -8.607 122 HD3 LYS 18 2HD LYS 18 13.845 2.193 -8.421 123 HE3 LYS 18 2HE LYS 18 14.412 -0.543 -7.171 124 HZ1 LYS 18 3HZ LYS 18 16.309 1.679 -7.587 125 HZ2 LYS 18 1HZ LYS 18 16.076 0.551 -8.734 126 HZ3 LYS 18 2HZ LYS 18 16.671 0.128 -7.257 127 H LYS 19 H LYS 19 13.526 1.749 -3.991 128 HA LYS 19 HA LYS 19 14.861 -0.708 -4.589 129 HB3 LYS 19 2HB LYS 19 15.361 1.229 -2.276 130 HG3 LYS 19 2HG LYS 19 17.763 0.826 -3.068 131 HD3 LYS 19 2HD LYS 19 16.716 -1.740 -1.865 132 HE3 LYS 19 2HE LYS 19 18.996 0.213 -1.325 133 HZ1 LYS 19 3HZ LYS 19 19.756 -1.379 0.229 134 HZ2 LYS 19 1HZ LYS 19 18.515 -2.418 -0.079 135 HZ3 LYS 19 2HZ LYS 19 18.222 -0.973 0.682 136 H MET 20 H MET 20 12.631 0.194 -1.913 137 HA MET 20 HA MET 20 13.095 -2.208 -0.419 138 HB3 MET 20 2HB MET 20 10.373 -0.962 -0.402 139 HG3 MET 20 2HG MET 20 11.233 -2.559 1.314 140 HE1 MET 20 3HE MET 20 13.510 0.714 1.088 141 HE2 MET 20 1HE MET 20 12.462 0.990 2.509 142 HE3 MET 20 2HE MET 20 14.198 0.710 2.723 143 H ALA 21 H ALA 21 11.349 -1.666 -3.472 144 HA ALA 21 HA ALA 21 9.197 -3.513 -2.867 145 HB1 ALA 21 1HB ALA 21 8.313 -2.858 -4.956 146 HB2 ALA 21 2HB ALA 21 9.070 -1.376 -4.356 147 HB3 ALA 21 3HB ALA 21 9.891 -2.335 -5.584 148 H GLU 22 H GLU 22 11.916 -3.281 -5.138 149 HA GLU 22 HA GLU 22 11.715 -5.895 -6.060 150 HB3 GLU 22 2HB GLU 22 12.798 -4.527 -7.515 151 HG3 GLU 22 2HG GLU 22 13.945 -3.215 -5.173 152 H LYS 23 H LYS 23 13.254 -4.721 -3.166 153 HA LYS 23 HA LYS 23 14.777 -7.157 -2.639 154 HB3 LYS 23 2HB LYS 23 13.754 -4.967 -0.767 155 HG3 LYS 23 2HG LYS 23 15.568 -7.363 -0.258 156 HD3 LYS 23 2HD LYS 23 15.059 -4.899 1.436 157 HE3 LYS 23 2HE LYS 23 16.783 -7.344 2.067 158 HZ1 LYS 23 3HZ LYS 23 17.405 -5.267 3.186 159 HZ2 LYS 23 1HZ LYS 23 16.746 -6.311 4.287 160 HZ3 LYS 23 2HZ LYS 23 15.869 -5.071 3.713 161 H ILE 24 H ILE 24 11.732 -5.850 -1.266 162 HA ILE 24 HA ILE 24 11.076 -8.158 0.175 163 HB ILE 24 HB ILE 24 9.471 -5.817 -0.869 164 HG13 ILE 24 2HG1 ILE 24 11.304 -5.395 0.799 165 HG21 ILE 24 1HG2 ILE 24 8.526 -7.994 1.024 166 HG22 ILE 24 2HG2 ILE 24 7.662 -6.464 0.762 167 HG23 ILE 24 3HG2 ILE 24 7.844 -7.604 -0.556 168 HD11 ILE 24 3HD1 ILE 24 8.507 -4.837 1.896 169 HD12 ILE 24 1HD1 ILE 24 10.000 -4.025 2.322 170 HD13 ILE 24 2HD1 ILE 24 9.368 -3.868 0.684 171 H ASN 25 H ASN 25 10.421 -7.394 -3.236 172 HA ASN 25 HA ASN 25 8.457 -9.335 -3.732 173 HB3 ASN 25 2HB ASN 25 10.684 -8.378 -5.580 174 HD21 ASN 25 1HD2 ASN 25 7.305 -9.728 -5.387 175 HD22 ASN 25 2HD2 ASN 25 7.370 -10.444 -6.966 176 H SER 26 H SER 26 11.997 -9.794 -3.423 177 HA SER 26 HA SER 26 11.951 -12.551 -4.291 178 HB3 SER 26 2HB SER 26 14.228 -12.562 -3.618 179 HG SER 26 HG SER 26 13.838 -11.151 -5.347 180 H GLU 27 H GLU 27 11.490 -10.916 -1.163 181 HA GLU 27 HA GLU 27 12.135 -13.203 0.488 182 HB3 GLU 27 2HB GLU 27 11.012 -11.782 2.268 183 HG3 GLU 27 2HG GLU 27 12.490 -9.731 2.026 184 H ILE 28 H ILE 28 9.289 -12.152 -1.202 185 HA ILE 28 HA ILE 28 7.378 -13.741 0.354 186 HB ILE 28 HB ILE 28 7.195 -11.694 -1.909 187 HG13 ILE 28 2HG1 ILE 28 7.773 -10.856 0.382 188 HG21 ILE 28 1HG2 ILE 28 4.833 -13.038 -0.509 189 HG22 ILE 28 2HG2 ILE 28 4.751 -11.698 -1.671 190 HG23 ILE 28 3HG2 ILE 28 5.300 -13.254 -2.216 191 HD11 ILE 28 3HD1 ILE 28 6.185 -9.147 0.669 192 HD12 ILE 28 1HD1 ILE 28 6.272 -9.442 -1.084 193 HD13 ILE 28 2HD1 ILE 28 4.904 -10.066 -0.120 194 H LYS 29 H LYS 29 5.886 -15.160 -0.978 195 HA LYS 29 HA LYS 29 7.234 -17.004 -2.626 196 HB3 LYS 29 2HB LYS 29 4.246 -16.456 -2.300 197 HG3 LYS 29 2HG LYS 29 4.487 -18.374 -3.826 198 HD3 LYS 29 2HD LYS 29 5.560 -20.482 -2.822 199 HE3 LYS 29 2HE LYS 29 7.159 -18.250 -4.040 200 HZ1 LYS 29 3HZ LYS 29 9.149 -19.617 -3.870 201 HZ2 LYS 29 1HZ LYS 29 8.386 -20.710 -2.932 202 HZ3 LYS 29 2HZ LYS 29 8.668 -19.223 -2.354 203 H ASP 30 H ASP 30 5.431 -17.344 -4.759 204 HA ASP 30 HA ASP 30 6.755 -15.958 -6.784 205 HB3 ASP 30 2HB ASP 30 5.120 -17.092 -8.305 206 H SER 31 H SER 31 5.326 -13.953 -5.152 207 HA SER 31 HA SER 31 2.954 -12.945 -6.170 208 HB3 SER 31 2HB SER 31 4.038 -12.476 -3.998 209 HG SER 31 HG SER 31 6.179 -11.849 -5.039 210 H GLU 32 H GLU 32 2.729 -10.626 -7.022 211 HA GLU 32 HA GLU 32 4.427 -10.232 -9.425 212 HB3 GLU 32 2HB GLU 32 2.484 -8.803 -10.155 213 HG3 GLU 32 2HG GLU 32 1.109 -10.485 -11.011 214 H LEU 33 H LEU 33 4.773 -8.178 -9.902 215 HA LEU 33 HA LEU 33 5.129 -6.343 -7.556 216 HB3 LEU 33 2HB LEU 33 7.175 -7.029 -9.668 217 HG LEU 33 HG LEU 33 7.437 -4.650 -9.209 218 HD11 LEU 33 1HD1 LEU 33 7.601 -5.389 -6.260 219 HD12 LEU 33 2HD1 LEU 33 6.288 -4.450 -7.023 220 HD13 LEU 33 3HD1 LEU 33 7.917 -3.792 -6.977 221 HD21 LEU 33 3HD2 LEU 33 9.460 -6.380 -7.709 222 HD22 LEU 33 1HD2 LEU 33 9.753 -4.714 -8.236 223 HD23 LEU 33 2HD2 LEU 33 9.469 -5.988 -9.437 224 H LYS 34 H LYS 34 3.672 -4.691 -7.903 225 HA LYS 34 HA LYS 34 3.820 -3.355 -10.532 226 HB3 LYS 34 2HB LYS 34 1.397 -2.584 -9.531 227 HG3 LYS 34 2HG LYS 34 0.320 -4.384 -10.906 228 HD3 LYS 34 2HD LYS 34 2.325 -3.293 -12.776 229 HE3 LYS 34 2HE LYS 34 -0.620 -2.647 -12.310 230 HZ1 LYS 34 3HZ LYS 34 0.633 -1.022 -13.679 231 HZ2 LYS 34 1HZ LYS 34 -0.542 -1.776 -14.510 232 HZ3 LYS 34 2HZ LYS 34 0.971 -2.235 -14.770 233 H GLU 35 H GLU 35 2.999 -1.030 -10.112 234 HA GLU 35 HA GLU 35 4.062 0.219 -7.714 235 HB3 GLU 35 2HB GLU 35 5.205 0.399 -10.499 236 HG3 GLU 35 2HG GLU 35 5.297 2.676 -9.410 237 H VAL 36 H VAL 36 3.564 2.547 -7.985 238 HA VAL 36 HA VAL 36 1.272 3.169 -9.807 239 HB VAL 36 HB VAL 36 1.460 3.874 -6.846 240 HG11 VAL 36 1HG1 VAL 36 -1.028 4.229 -7.147 241 HG12 VAL 36 2HG1 VAL 36 -0.022 5.385 -8.002 242 HG13 VAL 36 3HG1 VAL 36 -0.796 4.049 -8.898 243 HG21 VAL 36 3HG2 VAL 36 1.245 1.511 -6.790 244 HG22 VAL 36 1HG2 VAL 36 -0.397 2.103 -6.614 245 HG23 VAL 36 2HG2 VAL 36 0.143 1.486 -8.182 246 H LYS 37 H LYS 37 1.020 5.567 -10.076 247 HA LYS 37 HA LYS 37 3.163 7.276 -9.069 248 HB3 LYS 37 2HB LYS 37 3.126 8.535 -11.242 249 HG3 LYS 37 2HG LYS 37 4.914 6.740 -10.642 250 HD3 LYS 37 2HD LYS 37 3.515 5.522 -13.072 251 HE3 LYS 37 2HE LYS 37 6.302 4.946 -11.950 252 HZ1 LYS 37 3HZ LYS 37 6.491 3.773 -14.100 253 HZ2 LYS 37 1HZ LYS 37 4.883 3.937 -14.347 254 HZ3 LYS 37 2HZ LYS 37 5.431 3.021 -13.092 255 H VAL 38 H VAL 38 2.386 9.586 -9.284 256 HA VAL 38 HA VAL 38 -0.558 9.873 -9.429 257 HB VAL 38 HB VAL 38 -0.260 11.980 -8.116 258 HG11 VAL 38 1HG1 VAL 38 -0.262 10.928 -5.937 259 HG12 VAL 38 2HG1 VAL 38 -1.118 9.900 -7.072 260 HG13 VAL 38 3HG1 VAL 38 0.535 9.465 -6.571 261 HG21 VAL 38 3HG2 VAL 38 1.707 12.374 -6.776 262 HG22 VAL 38 1HG2 VAL 38 2.482 10.877 -7.336 263 HG23 VAL 38 2HG2 VAL 38 2.221 12.235 -8.454 264 H SER 39 H SER 39 -0.948 12.341 -10.249 265 HA SER 39 HA SER 39 0.163 12.603 -12.814 266 HB3 SER 39 2HB SER 39 -1.771 13.737 -12.688 267 HG SER 39 HG SER 39 -1.167 14.736 -10.066 268 H GLU 40 H GLU 40 1.241 14.406 -13.583 269 HA GLU 40 HA GLU 40 3.479 15.511 -12.172 270 HB3 GLU 40 2HB GLU 40 3.207 15.067 -14.593 271 HG3 GLU 40 2HG GLU 40 1.496 17.575 -14.588 272 H GLY 41 H GLY 41 3.696 17.767 -11.641 273 HA2 GLY 41 1HA GLY 41 3.053 19.860 -11.010 274 HA3 GLY 41 2HA GLY 41 1.507 19.609 -11.831 275 H THR 42 H THR 42 1.777 17.074 -9.624 276 HA THR 42 HA THR 42 -0.272 18.134 -7.994 277 HB THR 42 HB THR 42 1.398 15.677 -7.352 278 HG1 THR 42 1HG THR 42 0.939 15.092 -9.345 279 HG21 THR 42 3HG2 THR 42 -0.755 14.792 -6.643 280 HG22 THR 42 1HG2 THR 42 -1.598 16.252 -7.209 281 HG23 THR 42 2HG2 THR 42 -0.488 16.353 -5.828 282 H PHE 43 H PHE 43 3.211 17.391 -7.243 283 HA PHE 43 HA PHE 43 3.032 19.250 -4.920 284 HB3 PHE 43 2HB PHE 43 4.678 17.574 -3.795 285 HD1 PHE 43 1HD PHE 43 1.576 15.790 -4.771 286 HD2 PHE 43 2HD PHE 43 3.432 18.513 -1.987 287 HE1 PHE 43 1HE PHE 43 -0.395 15.606 -3.240 288 HE2 PHE 43 2HE PHE 43 1.484 18.321 -0.499 289 HZ PHE 43 HZ PHE 43 -0.413 16.824 -1.094 290 H ASP 44 H ASP 44 5.609 19.219 -4.034 291 HA ASP 44 HA ASP 44 7.292 19.908 -6.324 292 HB3 ASP 44 2HB ASP 44 7.123 21.799 -3.957 293 H ALA 45 H ALA 45 9.639 20.439 -5.184 294 HA ALA 45 HA ALA 45 10.228 18.114 -3.432 295 HB1 ALA 45 1HB ALA 45 11.434 18.487 -5.631 296 HB2 ALA 45 2HB ALA 45 12.070 19.991 -4.952 297 HB3 ALA 45 3HB ALA 45 12.506 18.434 -4.210 298 H ASP 46 H ASP 46 9.240 21.087 -2.941 299 HA ASP 46 HA ASP 46 11.371 22.475 -1.833 300 HB3 ASP 46 2HB ASP 46 8.463 23.081 -1.269 301 H MET 47 H MET 47 11.358 23.649 0.343 302 HA MET 47 HA MET 47 10.859 21.826 2.570 303 HB3 MET 47 2HB MET 47 12.270 24.498 2.175 304 HG3 MET 47 2HG MET 47 11.672 22.978 4.682 305 HE1 MET 47 3HE MET 47 15.535 25.529 4.227 306 HE2 MET 47 1HE MET 47 14.437 25.136 2.894 307 HE3 MET 47 2HE MET 47 13.894 26.222 4.190 308 H TYR 48 H TYR 48 9.386 24.786 1.281 309 HA TYR 48 HA TYR 48 7.453 24.808 3.560 310 HB3 TYR 48 2HB TYR 48 8.867 26.575 3.886 311 HD1 TYR 48 1HD TYR 48 11.049 26.368 2.814 312 HD2 TYR 48 2HD TYR 48 7.751 28.314 0.822 313 HE1 TYR 48 1HE TYR 48 12.590 27.146 1.050 314 HE2 TYR 48 2HE TYR 48 9.291 29.182 -0.889 315 HH TYR 48 HH TYR 48 12.707 28.080 -1.116 316 H LYS 49 H LYS 49 7.847 25.264 0.059 317 HA LYS 49 HA LYS 49 5.157 25.864 -0.633 318 HB3 LYS 49 2HB LYS 49 6.706 23.879 -2.294 319 HG3 LYS 49 2HG LYS 49 4.531 25.074 -3.018 320 HD3 LYS 49 2HD LYS 49 6.076 27.125 -4.394 321 HE3 LYS 49 2HE LYS 49 3.809 27.289 -2.368 322 HZ1 LYS 49 3HZ LYS 49 4.730 29.441 -4.167 323 HZ2 LYS 49 1HZ LYS 49 5.165 29.327 -2.576 324 HZ3 LYS 49 2HZ LYS 49 3.602 29.550 -2.972 325 H THR 50 H THR 50 6.700 22.679 0.099 326 HA THR 50 HA THR 50 4.495 21.179 -0.874 327 HB THR 50 HB THR 50 5.742 19.305 0.310 328 HG1 THR 50 1HG THR 50 8.071 20.451 0.688 329 HG21 THR 50 3HG2 THR 50 6.114 19.796 -1.976 330 HG22 THR 50 1HG2 THR 50 7.705 19.552 -1.231 331 HG23 THR 50 2HG2 THR 50 7.149 21.190 -1.636 332 H SER 51 H SER 51 5.306 22.298 2.402 333 HA SER 51 HA SER 51 3.213 21.102 3.860 334 HB3 SER 51 2HB SER 51 3.444 23.315 5.200 335 HG SER 51 HG SER 51 5.836 21.937 4.611 336 H ASP 52 H ASP 52 3.280 24.106 1.923 337 HA ASP 52 HA ASP 52 0.676 25.034 2.639 338 HB3 ASP 52 2HB ASP 52 2.315 25.582 0.124 339 H ILE 53 H ILE 53 1.846 23.167 -0.188 340 HA ILE 53 HA ILE 53 -0.666 22.846 -1.454 341 HB ILE 53 HB ILE 53 1.734 20.970 -1.460 342 HG13 ILE 53 2HG1 ILE 53 2.034 23.437 -2.285 343 HG21 ILE 53 1HG2 ILE 53 -0.350 19.838 -2.285 344 HG22 ILE 53 2HG2 ILE 53 -0.619 21.165 -3.418 345 HG23 ILE 53 3HG2 ILE 53 0.787 20.095 -3.596 346 HD11 ILE 53 3HD1 ILE 53 3.591 21.567 -2.916 347 HD12 ILE 53 1HD1 ILE 53 2.589 21.310 -4.366 348 HD13 ILE 53 2HD1 ILE 53 3.422 22.850 -4.130 349 H ALA 54 H ALA 54 0.983 20.543 0.831 350 HA ALA 54 HA ALA 54 -1.209 18.734 0.768 351 HB1 ALA 54 1HB ALA 54 -0.150 17.512 2.479 352 HB2 ALA 54 2HB ALA 54 1.203 18.288 1.614 353 HB3 ALA 54 3HB ALA 54 0.658 18.963 3.148 354 H LEU 55 H LEU 55 -0.496 21.478 2.928 355 HA LEU 55 HA LEU 55 -2.446 20.969 4.912 356 HB3 LEU 55 2HB LEU 55 -1.352 23.642 3.931 357 HG LEU 55 HG LEU 55 -1.475 24.219 6.377 358 HD11 LEU 55 1HD1 LEU 55 -3.422 25.408 6.083 359 HD12 LEU 55 2HD1 LEU 55 -4.187 24.146 5.064 360 HD13 LEU 55 3HD1 LEU 55 -2.860 25.129 4.458 361 HD21 LEU 55 3HD2 LEU 55 -3.624 22.114 6.563 362 HD22 LEU 55 1HD2 LEU 55 -2.996 23.186 7.846 363 HD23 LEU 55 2HD2 LEU 55 -1.978 21.921 7.172 364 H ASP 56 H ASP 56 -2.625 22.736 1.811 365 HA ASP 56 HA ASP 56 -5.288 23.663 2.098 366 HB3 ASP 56 2HB ASP 56 -4.712 22.990 -0.661 367 H GLN 57 H GLN 57 -3.982 20.615 0.759 368 HA GLN 57 HA GLN 57 -6.563 19.549 0.008 369 HB3 GLN 57 2HB GLN 57 -5.375 17.426 -0.295 370 HG3 GLN 57 2HG GLN 57 -3.624 19.704 -1.303 371 HE21 GLN 57 1HE2 GLN 57 -5.284 17.849 -3.604 372 HE22 GLN 57 2HE2 GLN 57 -3.885 16.911 -4.141 373 H ILE 58 H ILE 58 -4.875 19.726 3.050 374 HA ILE 58 HA ILE 58 -6.388 17.544 4.251 375 HB ILE 58 HB ILE 58 -4.361 19.557 5.268 376 HG13 ILE 58 2HG1 ILE 58 -3.806 17.400 3.850 377 HG21 ILE 58 1HG2 ILE 58 -4.364 18.364 7.462 378 HG22 ILE 58 2HG2 ILE 58 -5.873 19.220 7.167 379 HG23 ILE 58 3HG2 ILE 58 -5.804 17.463 6.941 380 HD11 ILE 58 3HD1 ILE 58 -1.743 17.020 5.006 381 HD12 ILE 58 1HD1 ILE 58 -2.104 18.752 5.118 382 HD13 ILE 58 2HD1 ILE 58 -2.388 17.695 6.514 383 H GLN 59 H GLN 59 -6.299 21.116 4.647 384 HA GLN 59 HA GLN 59 -8.607 20.991 6.416 385 HB3 GLN 59 2HB GLN 59 -8.325 23.542 6.330 386 HG3 GLN 59 2HG GLN 59 -5.807 21.988 7.060 387 HE21 GLN 59 1HE2 GLN 59 -4.778 24.005 6.764 388 HE22 GLN 59 2HE2 GLN 59 -4.939 25.331 7.864 389 H GLY 60 H GLY 60 -8.782 20.290 3.365 390 HA2 GLY 60 1HA GLY 60 -10.651 20.058 2.067 391 HA3 GLY 60 2HA GLY 60 -11.539 21.128 3.151 392 H ASN 61 H ASN 61 -8.890 22.890 2.420 393 HA ASN 61 HA ASN 61 -10.201 24.767 0.743 394 HB3 ASN 61 2HB ASN 61 -7.969 25.774 0.438 395 HD21 ASN 61 1HD2 ASN 61 -6.100 25.553 2.537 396 HD22 ASN 61 2HD2 ASN 61 -6.866 26.121 4.036 397 H LYS 62 H LYS 62 -8.252 21.904 0.026 398 HA LYS 62 HA LYS 62 -8.751 22.225 -2.890 399 HB3 LYS 62 2HB LYS 62 -6.498 20.691 -2.805 400 HG3 LYS 62 2HG LYS 62 -5.168 22.914 -2.962 401 HD3 LYS 62 2HD LYS 62 -7.335 22.047 -4.920 402 HE3 LYS 62 2HE LYS 62 -6.451 24.360 -5.366 403 HZ1 LYS 62 3HZ LYS 62 -4.121 24.056 -4.710 404 HZ2 LYS 62 1HZ LYS 62 -4.269 24.428 -6.326 405 HZ3 LYS 62 2HZ LYS 62 -3.904 22.908 -5.882 406 H ASP 63 H ASP 63 -8.982 20.311 -4.013 407 HA ASP 63 HA ASP 63 -10.213 18.031 -2.734 408 HB3 ASP 63 2HB ASP 63 -9.200 17.829 -5.540 409 H PHE 64 H PHE 64 -9.312 15.773 -3.559 410 HA PHE 64 HA PHE 64 -6.577 15.519 -2.474 411 HB3 PHE 64 2HB PHE 64 -7.969 13.913 -1.562 412 HD1 PHE 64 1HD PHE 64 -8.397 12.753 -5.130 413 HD2 PHE 64 2HD PHE 64 -10.321 13.976 -1.463 414 HE1 PHE 64 1HE PHE 64 -10.586 12.129 -6.066 415 HE2 PHE 64 2HE PHE 64 -12.516 13.306 -2.403 416 HZ PHE 64 HZ PHE 64 -12.645 12.385 -4.707 417 HA PRO 65 HA PRO 65 -4.701 14.940 -6.519 418 HB3 PRO 65 2HB PRO 65 -2.715 14.761 -5.419 419 HG3 PRO 65 2HG PRO 65 -2.462 13.368 -3.467 420 HD3 PRO 65 2HD PRO 65 -4.166 14.926 -2.970 421 H GLU 66 H GLU 66 -4.080 13.239 -8.120 422 HA GLU 66 HA GLU 66 -5.903 10.874 -8.044 423 HB3 GLU 66 2HB GLU 66 -5.809 11.031 -10.543 424 HG3 GLU 66 2HG GLU 66 -7.017 13.632 -9.713 425 H ILE 67 H ILE 67 -5.201 9.015 -9.283 426 HA ILE 67 HA ILE 67 -2.281 8.550 -9.057 427 HB ILE 67 HB ILE 67 -2.902 6.142 -8.980 428 HG13 ILE 67 2HG1 ILE 67 -5.087 6.285 -10.133 429 HG21 ILE 67 1HG2 ILE 67 -3.639 6.187 -6.616 430 HG22 ILE 67 2HG2 ILE 67 -2.402 7.402 -6.946 431 HG23 ILE 67 3HG2 ILE 67 -4.089 7.896 -6.781 432 HD11 ILE 67 3HD1 ILE 67 -4.665 4.328 -8.594 433 HD12 ILE 67 1HD1 ILE 67 -5.590 5.214 -7.351 434 HD13 ILE 67 2HD1 ILE 67 -6.376 4.738 -8.857 435 H GLN 68 H GLN 68 -1.440 7.051 -10.666 436 HA GLN 68 HA GLN 68 -2.631 7.257 -13.396 437 HB3 GLN 68 2HB GLN 68 -0.247 7.510 -14.138 438 HG3 GLN 68 2HG GLN 68 0.227 9.757 -13.045 439 HE21 GLN 68 1HE2 GLN 68 -2.819 10.938 -12.921 440 HE22 GLN 68 2HE2 GLN 68 -3.008 11.231 -14.629 441 H LEU 69 H LEU 69 -3.333 5.266 -11.914 442 HA LEU 69 HA LEU 69 -1.735 2.871 -12.715 443 HB3 LEU 69 2HB LEU 69 -4.021 2.334 -10.965 444 HG LEU 69 HG LEU 69 -1.049 2.149 -10.301 445 HD11 LEU 69 1HD1 LEU 69 -1.928 0.566 -8.571 446 HD12 LEU 69 2HD1 LEU 69 -3.579 0.905 -9.121 447 HD13 LEU 69 3HD1 LEU 69 -2.601 2.197 -8.395 448 HD21 LEU 69 3HD2 LEU 69 -1.450 0.720 -12.257 449 HD22 LEU 69 1HD2 LEU 69 -2.868 -0.012 -11.455 450 HD23 LEU 69 2HD2 LEU 69 -1.230 -0.257 -10.811 451 H ASP 70 H ASP 70 -3.232 1.025 -13.368 452 HA ASP 70 HA ASP 70 -5.452 1.842 -15.143 453 HB3 ASP 70 2HB ASP 70 -5.633 -0.827 -15.101 454 H ASN 71 H ASN 71 -7.580 0.897 -14.811 455 HA ASN 71 HA ASN 71 -8.351 0.407 -11.991 456 HB3 ASN 71 2HB ASN 71 -10.124 0.141 -14.431 457 HD21 ASN 71 1HD2 ASN 71 -10.726 1.767 -11.327 458 HD22 ASN 71 2HD2 ASN 71 -11.873 0.588 -10.740 459 H ILE 72 H ILE 72 -8.302 -1.539 -11.218 460 HA ILE 72 HA ILE 72 -8.010 -3.995 -12.872 461 HB ILE 72 HB ILE 72 -6.095 -2.785 -10.839 462 HG13 ILE 72 2HG1 ILE 72 -5.811 -2.255 -13.252 463 HG21 ILE 72 1HG2 ILE 72 -6.058 -5.693 -11.723 464 HG22 ILE 72 2HG2 ILE 72 -4.846 -4.875 -10.724 465 HG23 ILE 72 3HG2 ILE 72 -6.450 -5.107 -10.089 466 HD11 ILE 72 3HD1 ILE 72 -3.506 -2.826 -13.619 467 HD12 ILE 72 1HD1 ILE 72 -3.730 -2.371 -11.926 468 HD13 ILE 72 2HD1 ILE 72 -3.555 -4.083 -12.395 469 H ASP 73 H ASP 73 -8.622 -5.938 -11.634 470 HA ASP 73 HA ASP 73 -10.534 -5.422 -9.452 471 HB3 ASP 73 2HB ASP 73 -9.893 -8.212 -10.375 472 H TYR 74 H TYR 74 -9.807 -5.674 -7.366 473 HA TYR 74 HA TYR 74 -7.212 -7.055 -6.959 474 HB3 TYR 74 2HB TYR 74 -7.107 -5.799 -4.884 475 HD1 TYR 74 2HD TYR 74 -5.518 -5.541 -7.143 476 HD2 TYR 74 1HD TYR 74 -8.638 -2.882 -5.822 477 HE1 TYR 74 2HE TYR 74 -4.475 -3.729 -8.392 478 HE2 TYR 74 1HE TYR 74 -7.537 -0.995 -6.948 479 HH TYR 74 HH TYR 74 -4.477 -1.483 -8.881 480 H ASN 75 H ASN 75 -10.527 -7.763 -6.517 481 HA ASN 75 HA ASN 75 -10.247 -8.875 -3.860 482 HB3 ASN 75 2HB ASN 75 -12.540 -9.797 -5.528 483 HD21 ASN 75 1HD2 ASN 75 -11.924 -11.007 -3.249 484 HD22 ASN 75 2HD2 ASN 75 -12.912 -10.475 -1.901 485 H ASN 76 H ASN 76 -8.612 -9.953 -6.313 486 HA ASN 76 HA ASN 76 -8.994 -12.820 -5.886 487 HB3 ASN 76 2HB ASN 76 -9.277 -12.313 -8.173 488 HD21 ASN 76 1HD2 ASN 76 -9.411 -9.979 -8.760 489 HD22 ASN 76 2HD2 ASN 76 -7.936 -9.104 -9.088 490 H TYR 77 H TYR 77 -7.126 -10.316 -4.652 491 HA TYR 77 HA TYR 77 -4.678 -11.978 -4.386 492 HB3 TYR 77 2HB TYR 77 -3.655 -9.965 -3.475 493 HD1 TYR 77 2HD TYR 77 -2.801 -11.189 -5.711 494 HD2 TYR 77 1HD TYR 77 -5.569 -7.892 -5.647 495 HE1 TYR 77 2HE TYR 77 -2.472 -10.895 -8.123 496 HE2 TYR 77 1HE TYR 77 -5.254 -7.609 -8.118 497 HH TYR 77 HH TYR 77 -3.459 -9.947 -10.025 498 H ASP 78 H ASP 78 -3.813 -12.265 -2.205 499 HA ASP 78 HA ASP 78 -5.937 -12.735 -0.144 500 HB3 ASP 78 2HB ASP 78 -3.053 -13.730 -0.013 501 H LEU 79 H LEU 79 -2.668 -11.628 -0.707 502 HA LEU 79 HA LEU 79 -2.866 -9.580 1.481 503 HB3 LEU 79 2HB LEU 79 -0.513 -11.127 0.336 504 HG LEU 79 HG LEU 79 0.207 -8.906 1.224 505 HD11 LEU 79 1HD1 LEU 79 0.124 -8.570 3.709 506 HD12 LEU 79 2HD1 LEU 79 -0.902 -9.991 3.858 507 HD13 LEU 79 3HD1 LEU 79 -1.493 -8.552 2.996 508 HD21 LEU 79 3HD2 LEU 79 1.042 -11.341 2.843 509 HD22 LEU 79 1HD2 LEU 79 1.985 -9.862 2.648 510 HD23 LEU 79 2HD2 LEU 79 1.678 -10.894 1.245 511 H ILE 80 H ILE 80 -2.192 -7.412 1.029 512 HA ILE 80 HA ILE 80 -0.836 -6.833 -1.539 513 HB ILE 80 HB ILE 80 -3.288 -5.282 -0.638 514 HG13 ILE 80 2HG1 ILE 80 -4.022 -7.459 -1.461 515 HG21 ILE 80 1HG2 ILE 80 -1.623 -5.105 -3.197 516 HG22 ILE 80 2HG2 ILE 80 -3.012 -4.083 -2.771 517 HG23 ILE 80 3HG2 ILE 80 -1.525 -3.967 -1.847 518 HD11 ILE 80 3HD1 ILE 80 -5.516 -6.872 -3.177 519 HD12 ILE 80 1HD1 ILE 80 -5.302 -5.420 -2.183 520 HD13 ILE 80 2HD1 ILE 80 -4.480 -5.571 -3.763 521 H LEU 81 H LEU 81 1.091 -5.737 -0.813 522 HA LEU 81 HA LEU 81 0.842 -3.952 1.547 523 HB3 LEU 81 2HB LEU 81 3.369 -3.833 1.185 524 HG LEU 81 HG LEU 81 2.517 -5.101 3.020 525 HD11 LEU 81 1HD1 LEU 81 0.945 -6.658 2.135 526 HD12 LEU 81 2HD1 LEU 81 2.208 -7.549 2.971 527 HD13 LEU 81 3HD1 LEU 81 2.222 -7.482 1.195 528 HD21 LEU 81 3HD2 LEU 81 4.380 -6.737 3.260 529 HD22 LEU 81 1HD2 LEU 81 4.945 -5.208 2.550 530 HD23 LEU 81 2HD2 LEU 81 4.682 -6.632 1.532 531 H ILE 82 H ILE 82 1.417 -1.812 1.364 532 HA ILE 82 HA ILE 82 1.681 -0.680 -1.361 533 HB ILE 82 HB ILE 82 -0.215 0.204 0.853 534 HG13 ILE 82 2HG1 ILE 82 -0.592 -1.289 -1.732 535 HG21 ILE 82 1HG2 ILE 82 0.716 2.199 -0.199 536 HG22 ILE 82 2HG2 ILE 82 0.352 1.540 -1.810 537 HG23 ILE 82 3HG2 ILE 82 -0.956 1.967 -0.691 538 HD11 ILE 82 3HD1 ILE 82 -1.201 -2.330 0.458 539 HD12 ILE 82 1HD1 ILE 82 -2.312 -0.979 0.771 540 HD13 ILE 82 2HD1 ILE 82 -2.625 -2.092 -0.574 541 H GLY 83 H GLY 83 3.231 0.881 -1.542 542 HA2 GLY 83 1HA GLY 83 4.570 1.872 0.966 543 HA3 GLY 83 2HA GLY 83 5.334 1.717 -0.621 544 H SER 84 H SER 84 4.950 4.173 1.142 545 HA SER 84 HA SER 84 4.327 5.885 -1.109 546 HB3 SER 84 2HB SER 84 2.173 5.952 -0.300 547 HG SER 84 HG SER 84 2.405 4.854 1.698 548 HA PRO 85 HA PRO 85 7.801 8.032 0.724 549 HB3 PRO 85 2HB PRO 85 8.045 9.061 -1.325 550 HG3 PRO 85 2HG PRO 85 6.213 9.694 -2.618 551 HD3 PRO 85 2HD PRO 85 5.578 7.525 -2.059 552 H VAL 86 H VAL 86 8.373 9.358 2.402 553 HA VAL 86 HA VAL 86 6.381 10.962 3.842 554 HB VAL 86 HB VAL 86 9.334 10.449 4.233 555 HG11 VAL 86 1HG1 VAL 86 7.444 12.166 5.930 556 HG12 VAL 86 2HG1 VAL 86 9.069 11.617 6.420 557 HG13 VAL 86 3HG1 VAL 86 8.890 12.706 5.049 558 HG21 VAL 86 3HG2 VAL 86 8.468 9.286 6.231 559 HG22 VAL 86 1HG2 VAL 86 6.836 9.801 5.863 560 HG23 VAL 86 2HG2 VAL 86 7.660 8.637 4.807 561 H TRP 87 H TRP 87 6.039 13.073 3.490 562 HA TRP 87 HA TRP 87 8.006 14.736 2.056 563 HB3 TRP 87 2HB TRP 87 5.378 15.902 2.211 564 HD1 TRP 87 HD TRP 87 7.453 17.459 0.783 565 HE1 TRP 87 1HE TRP 87 7.724 17.617 -1.795 566 HE3 TRP 87 3HE TRP 87 5.159 13.125 -0.608 567 HZ2 TRP 87 2HZ TRP 87 6.969 16.180 -4.101 568 HZ3 TRP 87 3HZ TRP 87 4.774 12.638 -3.003 569 HH2 TRP 87 HH TRP 87 5.716 14.126 -4.778 570 H SER 88 H SER 88 6.772 17.191 3.079 571 HA SER 88 HA SER 88 8.055 17.333 5.669 572 HB3 SER 88 2HB SER 88 6.314 19.365 4.247 573 HG SER 88 HG SER 88 7.358 20.784 5.555 574 H GLY 89 H GLY 89 6.899 15.724 6.714 575 HA2 GLY 89 1HA GLY 89 5.593 15.659 8.774 576 HA3 GLY 89 2HA GLY 89 4.329 16.589 7.990 577 H TYR 90 H TYR 90 4.161 15.203 5.424 578 HA TYR 90 HA TYR 90 2.654 12.907 6.516 579 HB3 TYR 90 2HB TYR 90 0.686 13.968 5.596 580 HD1 TYR 90 1HD TYR 90 0.891 13.958 8.238 581 HD2 TYR 90 2HD TYR 90 1.968 17.282 5.704 582 HE1 TYR 90 1HE TYR 90 0.649 15.507 10.161 583 HE2 TYR 90 2HE TYR 90 1.836 18.804 7.614 584 HH TYR 90 HH TYR 90 0.883 18.998 9.779 585 HA PRO 91 HA PRO 91 3.250 11.227 2.313 586 HB3 PRO 91 2HB PRO 91 1.867 9.411 2.690 587 HG3 PRO 91 2HG PRO 91 0.106 9.528 4.250 588 HD3 PRO 91 2HD PRO 91 1.759 10.589 5.532 589 H ALA 92 H ALA 92 2.716 12.005 0.160 590 HA ALA 92 HA ALA 92 1.236 14.546 -0.066 591 HB1 ALA 92 1HB ALA 92 3.068 13.017 -1.780 592 HB2 ALA 92 2HB ALA 92 1.918 14.089 -2.540 593 HB3 ALA 92 3HB ALA 92 3.061 14.718 -1.343 594 H THR 93 H THR 93 -0.247 12.565 0.962 595 HA THR 93 HA THR 93 -1.923 10.990 0.813 596 HB THR 93 HB THR 93 -3.921 12.305 0.112 597 HG1 THR 93 1HG THR 93 -3.598 14.370 -0.643 598 HG21 THR 93 3HG2 THR 93 -3.624 14.121 1.709 599 HG22 THR 93 1HG2 THR 93 -1.871 14.057 1.607 600 HG23 THR 93 2HG2 THR 93 -2.782 12.708 2.346 601 HA PRO 94 HA PRO 94 -1.385 9.714 -3.668 602 HB3 PRO 94 2HB PRO 94 1.008 9.653 -3.371 603 HG3 PRO 94 2HG PRO 94 1.944 8.449 -1.460 604 HD3 PRO 94 2HD PRO 94 0.737 10.297 -0.660 605 H ILE 95 H ILE 95 -2.251 7.897 -0.900 606 HA ILE 95 HA ILE 95 -2.986 5.518 -2.533 607 HB ILE 95 HB ILE 95 -2.829 5.737 0.489 608 HG13 ILE 95 2HG1 ILE 95 -0.720 4.423 0.336 609 HG21 ILE 95 1HG2 ILE 95 -3.023 3.353 -1.386 610 HG22 ILE 95 2HG2 ILE 95 -2.697 3.247 0.362 611 HG23 ILE 95 3HG2 ILE 95 -4.225 3.910 -0.193 612 HD11 ILE 95 3HD1 ILE 95 -0.364 5.508 -2.502 613 HD12 ILE 95 1HD1 ILE 95 0.750 4.525 -1.572 614 HD13 ILE 95 2HD1 ILE 95 -0.773 3.830 -2.151 615 H LYS 96 H LYS 96 -4.284 8.417 -1.502 616 HA LYS 96 HA LYS 96 -6.786 7.777 -0.329 617 HB3 LYS 96 2HB LYS 96 -5.806 10.188 -1.913 618 HG3 LYS 96 2HG LYS 96 -8.230 10.317 -1.689 619 HD3 LYS 96 2HD LYS 96 -7.648 9.923 1.275 620 HE3 LYS 96 2HE LYS 96 -9.008 12.018 0.848 621 HZ1 LYS 96 3HZ LYS 96 -11.142 10.104 0.139 622 HZ2 LYS 96 1HZ LYS 96 -10.436 11.031 -0.991 623 HZ3 LYS 96 2HZ LYS 96 -11.296 11.703 0.264 624 H THR 97 H THR 97 -5.980 8.630 -3.764 625 HA THR 97 HA THR 97 -8.615 8.367 -4.701 626 HB THR 97 HB THR 97 -6.297 7.651 -6.460 627 HG1 THR 97 1HG THR 97 -6.526 10.379 -5.879 628 HG21 THR 97 3HG2 THR 97 -8.547 9.674 -6.831 629 HG22 THR 97 1HG2 THR 97 -8.529 8.016 -7.464 630 HG23 THR 97 2HG2 THR 97 -7.358 9.189 -8.059 631 H LEU 98 H LEU 98 -5.993 5.948 -4.422 632 HA LEU 98 HA LEU 98 -7.345 3.881 -5.917 633 HB3 LEU 98 2HB LEU 98 -5.069 3.759 -3.876 634 HG LEU 98 HG LEU 98 -6.086 1.499 -4.286 635 HD11 LEU 98 1HD1 LEU 98 -5.752 0.464 -6.512 636 HD12 LEU 98 2HD1 LEU 98 -5.339 2.048 -7.191 637 HD13 LEU 98 3HD1 LEU 98 -6.971 1.741 -6.543 638 HD21 LEU 98 3HD2 LEU 98 -3.352 1.854 -5.567 639 HD22 LEU 98 1HD2 LEU 98 -4.014 0.379 -4.808 640 HD23 LEU 98 2HD2 LEU 98 -3.683 1.796 -3.807 641 H LEU 99 H LEU 99 -7.013 4.598 -2.357 642 HA LEU 99 HA LEU 99 -8.276 2.234 -1.483 643 HB3 LEU 99 2HB LEU 99 -6.862 4.039 -0.260 644 HG LEU 99 HG LEU 99 -8.964 5.705 -0.275 645 HD11 LEU 99 1HD1 LEU 99 -10.469 5.332 1.598 646 HD12 LEU 99 2HD1 LEU 99 -9.579 3.858 2.078 647 HD13 LEU 99 3HD1 LEU 99 -10.495 3.876 0.577 648 HD21 LEU 99 3HD2 LEU 99 -7.388 4.979 2.214 649 HD22 LEU 99 1HD2 LEU 99 -8.253 6.514 1.922 650 HD23 LEU 99 2HD2 LEU 99 -6.854 6.061 0.931 651 H ASP 100 H ASP 100 -9.538 5.420 -2.448 652 HA ASP 100 HA ASP 100 -12.111 5.104 -1.553 653 HB3 ASP 100 2HB ASP 100 -11.877 6.488 -4.181 654 H GLN 101 H GLN 101 -10.683 4.009 -4.567 655 HA GLN 101 HA GLN 101 -13.051 2.889 -5.817 656 HB3 GLN 101 2HB GLN 101 -11.379 1.843 -7.303 657 HG3 GLN 101 2HG GLN 101 -10.714 4.758 -6.829 658 HE21 GLN 101 1HE2 GLN 101 -10.038 5.799 -8.969 659 HE22 GLN 101 2HE2 GLN 101 -8.886 4.904 -9.942 660 H MET 102 H MET 102 -10.083 1.401 -4.403 661 HA MET 102 HA MET 102 -10.942 -1.224 -4.871 662 HB3 MET 102 2HB MET 102 -8.607 -0.538 -4.751 663 HG3 MET 102 2HG MET 102 -9.203 0.747 -2.450 664 HE1 MET 102 3HE MET 102 -6.233 -2.200 -0.639 665 HE2 MET 102 1HE MET 102 -6.465 -1.974 -2.393 666 HE3 MET 102 2HE MET 102 -5.944 -0.617 -1.418 667 H LYS 103 H LYS 103 -11.852 0.739 -2.310 668 HA LYS 103 HA LYS 103 -11.953 -0.462 0.035 669 HB3 LYS 103 2HB LYS 103 -14.460 0.880 -0.205 670 HG3 LYS 103 2HG LYS 103 -12.797 2.938 0.206 671 HD3 LYS 103 2HD LYS 103 -12.661 1.158 2.564 672 HE3 LYS 103 2HE LYS 103 -12.438 3.679 2.557 673 HZ1 LYS 103 3HZ LYS 103 -15.342 3.522 1.941 674 HZ2 LYS 103 1HZ LYS 103 -14.216 4.319 1.077 675 HZ3 LYS 103 2HZ LYS 103 -14.601 4.849 2.587 676 H ASN 104 H ASN 104 -13.377 -2.248 -2.353 677 HA ASN 104 HA ASN 104 -15.462 -3.412 -0.585 678 HB3 ASN 104 2HB ASN 104 -16.337 -4.452 -2.578 679 HD21 ASN 104 1HD2 ASN 104 -15.159 -1.851 -4.491 680 HD22 ASN 104 2HD2 ASN 104 -16.314 -0.632 -4.019 681 H TYR 105 H TYR 105 -12.231 -3.794 -1.270 682 HA TYR 105 HA TYR 105 -11.807 -6.593 -1.782 683 HB3 TYR 105 2HB TYR 105 -10.159 -4.430 -0.372 684 HD1 TYR 105 1HD TYR 105 -9.340 -7.142 -2.805 685 HD2 TYR 105 2HD TYR 105 -8.590 -5.444 1.093 686 HE1 TYR 105 1HE TYR 105 -7.464 -8.753 -2.452 687 HE2 TYR 105 2HE TYR 105 -6.708 -7.019 1.418 688 HH TYR 105 HH TYR 105 -5.496 -8.831 0.517 689 H ARG 106 H ARG 106 -11.568 -8.372 -0.392 690 HA ARG 106 HA ARG 106 -11.402 -7.839 2.507 691 HB3 ARG 106 2HB ARG 106 -12.474 -9.892 2.864 692 HG3 ARG 106 2HG ARG 106 -14.092 -8.063 2.052 693 HD3 ARG 106 2HD ARG 106 -13.640 -9.516 -0.515 694 HE ARG 106 HE ARG 106 -16.078 -10.026 0.507 695 HH11 ARG 106 1HH1 ARG 106 -15.065 -7.871 -2.193 696 HH12 ARG 106 2HH1 ARG 106 -16.597 -8.083 -3.023 697 HH21 ARG 106 1HH2 ARG 106 -18.034 -10.264 -0.722 698 HH22 ARG 106 2HH2 ARG 106 -18.185 -9.438 -2.244 699 H GLY 107 H GLY 107 -9.390 -8.464 3.319 700 HA2 GLY 107 1HA GLY 107 -8.049 -10.796 2.933 701 HA3 GLY 107 2HA GLY 107 -7.411 -9.723 1.667 702 H GLU 108 H GLU 108 -5.382 -9.963 3.044 703 HA GLU 108 HA GLU 108 -5.369 -8.065 5.343 704 HB3 GLU 108 2HB GLU 108 -2.971 -8.794 5.490 705 HG3 GLU 108 2HG GLU 108 -5.044 -11.010 5.807 706 H VAL 109 H VAL 109 -4.095 -6.185 5.226 707 HA VAL 109 HA VAL 109 -2.843 -5.505 2.683 708 HB VAL 109 HB VAL 109 -4.737 -3.612 4.137 709 HG11 VAL 109 1HG1 VAL 109 -4.526 -2.193 2.162 710 HG12 VAL 109 2HG1 VAL 109 -2.935 -2.495 2.874 711 HG13 VAL 109 3HG1 VAL 109 -3.431 -3.381 1.412 712 HG21 VAL 109 3HG2 VAL 109 -5.269 -5.141 1.557 713 HG22 VAL 109 1HG2 VAL 109 -6.150 -5.321 3.099 714 HG23 VAL 109 2HG2 VAL 109 -6.278 -3.816 2.195 715 H ALA 110 H ALA 110 -0.880 -4.305 3.160 716 HA ALA 110 HA ALA 110 -0.666 -3.172 5.905 717 HB1 ALA 110 1HB ALA 110 1.274 -4.142 6.496 718 HB2 ALA 110 2HB ALA 110 0.788 -5.428 5.373 719 HB3 ALA 110 3HB ALA 110 1.911 -4.157 4.852 720 H SER 111 H SER 111 1.017 -1.351 5.962 721 HA SER 111 HA SER 111 1.437 -0.194 3.286 722 HB3 SER 111 2HB SER 111 0.203 1.871 3.841 723 HG SER 111 HG SER 111 -0.763 -0.543 3.249 724 H PHE 112 H PHE 112 3.640 -0.484 3.828 725 HA PHE 112 HA PHE 112 4.806 0.969 6.031 726 HB3 PHE 112 2HB PHE 112 5.690 -1.126 4.708 727 HD1 PHE 112 1HD PHE 112 4.991 -0.590 2.168 728 HD2 PHE 112 2HD PHE 112 8.581 0.784 4.120 729 HE1 PHE 112 1HE PHE 112 6.077 -0.301 -0.005 730 HE2 PHE 112 2HE PHE 112 9.673 1.051 1.915 731 HZ PHE 112 HZ PHE 112 8.421 0.520 -0.164 732 H PHE 113 H PHE 113 6.801 2.416 5.452 733 HA PHE 113 HA PHE 113 6.554 4.180 3.208 734 HB3 PHE 113 2HB PHE 113 4.941 5.262 4.752 735 HD1 PHE 113 2HD PHE 113 6.175 3.569 7.158 736 HD2 PHE 113 1HD PHE 113 6.125 7.759 6.115 737 HE1 PHE 113 2HE PHE 113 6.626 4.136 9.475 738 HE2 PHE 113 1HE PHE 113 6.573 8.329 8.487 739 HZ PHE 113 HZ PHE 113 6.823 6.515 10.180 740 H THR 114 H THR 114 8.441 5.898 3.482 741 HA THR 114 HA THR 114 10.633 4.859 5.165 742 HB THR 114 HB THR 114 12.238 4.967 3.356 743 HG1 THR 114 1HG THR 114 11.544 6.289 1.861 744 HG21 THR 114 3HG2 THR 114 9.903 3.225 2.490 745 HG22 THR 114 1HG2 THR 114 11.111 2.785 3.715 746 HG23 THR 114 2HG2 THR 114 11.588 3.010 2.021 747 H SER 115 H SER 115 12.039 6.613 5.860 748 HA SER 115 HA SER 115 10.939 9.337 5.318 749 HB3 SER 115 2HB SER 115 9.837 8.313 7.317 750 HG SER 115 HG SER 115 11.297 6.962 8.036 751 H ALA 116 H ALA 116 12.232 11.068 6.447 752 HA ALA 116 HA ALA 116 15.135 10.479 6.602 753 HB1 ALA 116 1HB ALA 116 13.729 13.176 6.655 754 HB2 ALA 116 2HB ALA 116 15.472 12.874 6.575 755 HB3 ALA 116 3HB ALA 116 14.448 12.425 5.202 756 H GLY 117 H GLY 117 13.142 9.440 8.569 757 HA2 GLY 117 1HA GLY 117 13.314 9.003 10.802 758 HA3 GLY 117 2HA GLY 117 14.841 9.883 10.737 759 H THR 118 H THR 118 11.736 11.495 10.061 760 HA THR 118 HA THR 118 11.565 12.641 12.772 761 HB THR 118 HB THR 118 11.168 14.875 11.280 762 HG1 THR 118 1HG THR 118 13.360 13.600 9.975 763 HG21 THR 118 3HG2 THR 118 12.660 14.687 13.236 764 HG22 THR 118 1HG2 THR 118 13.420 15.604 11.931 765 HG23 THR 118 2HG2 THR 118 13.898 13.928 12.216 766 H ASN 119 H ASN 119 9.401 13.846 12.954 767 HA ASN 119 HA ASN 119 7.196 14.084 12.713 768 HB3 ASN 119 2HB ASN 119 6.339 14.326 10.369 769 HD21 ASN 119 1HD2 ASN 119 8.043 15.838 8.687 770 HD22 ASN 119 2HD2 ASN 119 8.185 17.402 9.488 771 H HIS 120 H HIS 120 8.387 11.118 12.403 772 HA HIS 120 HA HIS 120 6.790 9.661 10.774 773 HB3 HIS 120 2HB HIS 120 8.898 8.887 11.812 774 HD1 HIS 120 1HD HIS 120 7.034 6.784 14.318 775 HD2 HIS 120 2HD HIS 120 9.386 10.306 14.216 776 HE1 HIS 120 1HE HIS 120 7.607 7.370 16.729 777 H LYS 121 H LYS 121 6.019 10.427 14.215 778 HA LYS 121 HA LYS 121 3.771 8.644 14.277 779 HB3 LYS 121 2HB LYS 121 3.307 10.890 16.003 780 HG3 LYS 121 2HG LYS 121 4.757 8.429 16.949 781 HD3 LYS 121 2HD LYS 121 2.164 9.726 17.919 782 HE3 LYS 121 2HE LYS 121 4.170 7.807 19.186 783 HZ1 LYS 121 3HZ LYS 121 3.170 9.158 20.870 784 HZ2 LYS 121 1HZ LYS 121 2.553 7.654 20.933 785 HZ3 LYS 121 2HZ LYS 121 1.629 8.840 20.311 786 H ALA 122 H ALA 122 4.220 11.974 13.133 787 HA ALA 122 HA ALA 122 1.427 12.653 12.988 788 HB1 ALA 122 1HB ALA 122 2.121 14.514 11.620 789 HB2 ALA 122 2HB ALA 122 3.327 14.337 12.905 790 HB3 ALA 122 3HB ALA 122 3.678 13.781 11.244 791 H TYR 123 H TYR 123 3.797 11.330 10.634 792 HA TYR 123 HA TYR 123 2.078 11.025 8.432 793 HB3 TYR 123 2HB TYR 123 4.357 9.167 9.178 794 HD1 TYR 123 1HD TYR 123 2.795 7.548 7.717 795 HD2 TYR 123 2HD TYR 123 4.689 11.111 6.205 796 HE1 TYR 123 1HE TYR 123 2.739 6.589 5.442 797 HE2 TYR 123 2HE TYR 123 4.564 10.147 3.904 798 HH TYR 123 HH TYR 123 3.338 6.929 3.116 799 H VAL 124 H VAL 124 2.818 8.503 10.977 800 HA VAL 124 HA VAL 124 1.123 6.474 9.958 801 HB VAL 124 HB VAL 124 1.883 7.091 12.831 802 HG11 VAL 124 1HG1 VAL 124 0.793 4.506 11.590 803 HG12 VAL 124 2HG1 VAL 124 1.439 4.667 13.224 804 HG13 VAL 124 3HG1 VAL 124 -0.034 5.524 12.787 805 HG21 VAL 124 3HG2 VAL 124 3.826 6.647 11.284 806 HG22 VAL 124 1HG2 VAL 124 3.597 5.360 12.472 807 HG23 VAL 124 2HG2 VAL 124 3.067 5.134 10.795 808 H SER 125 H SER 125 0.295 9.132 12.342 809 HA SER 125 HA SER 125 -2.451 8.392 12.557 810 HB3 SER 125 2HB SER 125 -2.643 10.843 13.314 811 HG SER 125 HG SER 125 -2.335 9.213 14.738 812 H HIS 126 H HIS 126 -0.754 10.484 10.212 813 HA HIS 126 HA HIS 126 -3.067 11.576 8.992 814 HB3 HIS 126 2HB HIS 126 -0.582 11.019 7.347 815 HD1 HIS 126 1HD HIS 126 -1.549 12.315 5.172 816 HD2 HIS 126 2HD HIS 126 -2.087 14.240 8.888 817 HE1 HIS 126 1HE HIS 126 -2.384 14.662 4.663 818 H PHE 127 H PHE 127 -1.032 8.735 8.141 819 HA PHE 127 HA PHE 127 -2.562 7.907 5.897 820 HB3 PHE 127 2HB PHE 127 -0.719 6.464 7.825 821 HD1 PHE 127 2HD PHE 127 -1.865 5.918 4.236 822 HD2 PHE 127 1HD PHE 127 -1.445 4.276 8.225 823 HE1 PHE 127 2HE PHE 127 -2.642 3.718 3.432 824 HE2 PHE 127 1HE PHE 127 -2.280 2.101 7.402 825 HZ PHE 127 HZ PHE 127 -2.873 1.815 5.026 826 H ASN 128 H ASN 128 -2.976 7.156 9.394 827 HA ASN 128 HA ASN 128 -5.146 5.323 8.972 828 HB3 ASN 128 2HB ASN 128 -5.786 5.986 11.374 829 HD21 ASN 128 1HD2 ASN 128 -2.216 5.708 11.148 830 HD22 ASN 128 2HD2 ASN 128 -2.187 4.013 11.595 831 H GLU 129 H GLU 129 -5.181 8.880 9.624 832 HA GLU 129 HA GLU 129 -7.962 9.340 9.605 833 HB3 GLU 129 2HB GLU 129 -6.940 11.520 8.220 834 HG3 GLU 129 2HG GLU 129 -6.296 12.465 10.506 835 H TRP 130 H TRP 130 -5.692 9.319 6.875 836 HA TRP 130 HA TRP 130 -7.846 9.418 4.883 837 HB3 TRP 130 2HB TRP 130 -5.999 9.690 3.304 838 HD1 TRP 130 HD TRP 130 -3.911 11.401 5.789 839 HE1 TRP 130 1HE TRP 130 -4.518 13.881 6.050 840 HE3 TRP 130 3HE TRP 130 -8.343 11.446 3.272 841 HZ2 TRP 130 2HZ TRP 130 -6.371 15.677 4.970 842 HZ3 TRP 130 3HZ TRP 130 -9.496 13.622 2.812 843 HH2 TRP 130 HH TRP 130 -8.521 15.747 3.638 844 H ALA 131 H ALA 131 -7.405 6.847 6.600 845 HA ALA 131 HA ALA 131 -7.860 5.141 4.275 846 HB1 ALA 131 1HB ALA 131 -5.371 4.926 4.685 847 HB2 ALA 131 2HB ALA 131 -5.744 4.311 6.314 848 HB3 ALA 131 3HB ALA 131 -6.266 3.411 4.871 849 H ASP 132 H ASP 132 -9.053 6.175 7.035 850 HA ASP 132 HA ASP 132 -9.327 4.029 8.755 851 HB3 ASP 132 2HB ASP 132 -11.273 6.329 8.458 852 H GLY 133 H GLY 133 -10.418 2.194 8.534 853 HA2 GLY 133 1HA GLY 133 -12.749 1.294 8.267 854 HA3 GLY 133 2HA GLY 133 -12.723 1.982 6.645 855 H LEU 134 H LEU 134 -10.164 1.363 5.751 856 HA LEU 134 HA LEU 134 -10.452 -1.363 4.982 857 HB3 LEU 134 2HB LEU 134 -7.961 -1.072 4.231 858 HG LEU 134 HG LEU 134 -9.967 0.956 3.156 859 HD11 LEU 134 1HD1 LEU 134 -7.498 -0.271 1.844 860 HD12 LEU 134 2HD1 LEU 134 -7.644 1.414 2.407 861 HD13 LEU 134 3HD1 LEU 134 -8.663 0.809 1.076 862 HD21 LEU 134 3HD2 LEU 134 -9.380 -1.941 2.395 863 HD22 LEU 134 1HD2 LEU 134 -10.263 -0.805 1.366 864 HD23 LEU 134 2HD2 LEU 134 -10.937 -1.245 2.927 865 H ASN 135 H ASN 135 -9.420 -3.272 5.525 866 HA ASN 135 HA ASN 135 -8.494 -3.550 8.268 867 HB3 ASN 135 2HB ASN 135 -8.584 -5.510 5.937 868 HD21 ASN 135 1HD2 ASN 135 -7.561 -7.541 6.338 869 HD22 ASN 135 2HD2 ASN 135 -6.896 -7.927 7.936 870 H VAL 136 H VAL 136 -6.439 -2.806 8.766 871 HA VAL 136 HA VAL 136 -4.236 -3.356 6.852 872 HB VAL 136 HB VAL 136 -4.476 -1.165 8.947 873 HG11 VAL 136 1HG1 VAL 136 -2.211 -1.780 6.994 874 HG12 VAL 136 2HG1 VAL 136 -2.365 -0.282 7.944 875 HG13 VAL 136 3HG1 VAL 136 -2.144 -1.809 8.782 876 HG21 VAL 136 3HG2 VAL 136 -4.413 0.363 6.972 877 HG22 VAL 136 1HG2 VAL 136 -4.460 -1.064 5.895 878 HG23 VAL 136 2HG2 VAL 136 -5.843 -0.673 6.954 879 H ILE 137 H ILE 137 -2.521 -4.558 7.603 880 HA ILE 137 HA ILE 137 -2.819 -5.752 10.288 881 HB ILE 137 HB ILE 137 -1.386 -7.500 9.488 882 HG13 ILE 137 2HG1 ILE 137 0.155 -6.129 8.084 883 HG21 ILE 137 1HG2 ILE 137 -2.900 -8.474 7.940 884 HG22 ILE 137 2HG2 ILE 137 -3.873 -7.408 8.954 885 HG23 ILE 137 3HG2 ILE 137 -3.429 -6.899 7.308 886 HD11 ILE 137 3HD1 ILE 137 -1.092 -8.332 6.427 887 HD12 ILE 137 1HD1 ILE 137 0.501 -7.621 6.233 888 HD13 ILE 137 2HD1 ILE 137 0.132 -8.558 7.693 889 H GLY 138 H GLY 138 -0.791 -3.366 8.715 890 HA2 GLY 138 1HA GLY 138 0.607 -2.903 11.148 891 HA3 GLY 138 2HA GLY 138 1.658 -3.722 9.986 892 H VAL 139 H VAL 139 1.715 -0.974 11.098 893 HA VAL 139 HA VAL 139 2.282 0.323 8.536 894 HB VAL 139 HB VAL 139 1.274 2.008 10.887 895 HG11 VAL 139 1HG1 VAL 139 1.194 3.729 9.227 896 HG12 VAL 139 2HG1 VAL 139 2.809 2.992 9.203 897 HG13 VAL 139 3HG1 VAL 139 1.626 2.583 7.949 898 HG21 VAL 139 3HG2 VAL 139 -0.662 0.645 10.135 899 HG22 VAL 139 1HG2 VAL 139 -0.816 2.306 9.572 900 HG23 VAL 139 2HG2 VAL 139 -0.280 1.039 8.444 901 H ALA 140 H ALA 140 4.432 0.274 8.532 902 HA ALA 140 HA ALA 140 6.040 0.845 10.908 903 HB1 ALA 140 1HB ALA 140 6.313 -1.741 9.293 904 HB2 ALA 140 2HB ALA 140 7.398 -1.203 10.578 905 HB3 ALA 140 3HB ALA 140 5.717 -1.620 10.965 906 H ARG 141 H ARG 141 8.477 1.005 10.100 907 HA ARG 141 HA ARG 141 8.342 2.292 7.433 908 HB3 ARG 141 2HB ARG 141 9.449 3.428 9.339 909 HG3 ARG 141 2HG ARG 141 11.989 2.024 8.962 910 HD3 ARG 141 2HD ARG 141 12.056 2.133 11.452 911 HE ARG 141 HE ARG 141 10.974 4.763 11.034 912 HH11 ARG 141 1HH1 ARG 141 13.840 2.819 9.932 913 HH12 ARG 141 2HH1 ARG 141 14.702 4.224 9.498 914 HH21 ARG 141 1HH2 ARG 141 12.081 6.492 10.246 915 HH22 ARG 141 2HH2 ARG 141 13.641 6.303 9.506 916 H ASP 142 H ASP 142 9.958 1.791 5.892 917 HA ASP 142 HA ASP 142 11.188 0.475 4.533 918 HB3 ASP 142 2HB ASP 142 13.189 -0.439 5.554 919 H ASP 143 H ASP 143 12.384 -2.139 5.271 920 HA ASP 143 HA ASP 143 10.219 -3.953 4.471 921 HB3 ASP 143 2HB ASP 143 12.179 -4.051 3.103 922 H SER 144 H SER 144 11.143 -2.824 7.351 923 HA SER 144 HA SER 144 12.257 -5.013 8.644 924 HB3 SER 144 2HB SER 144 10.776 -2.962 10.262 925 HG SER 144 HG SER 144 12.279 -4.435 11.179 926 H GLU 145 H GLU 145 8.852 -4.685 7.918 927 HA GLU 145 HA GLU 145 8.229 -6.751 9.990 928 HB3 GLU 145 2HB GLU 145 5.881 -5.833 9.828 929 HG3 GLU 145 2HG GLU 145 7.822 -3.830 10.995 930 H VAL 146 H VAL 146 8.727 -6.641 6.684 931 HA VAL 146 HA VAL 146 6.488 -8.012 5.652 932 HB VAL 146 HB VAL 146 9.447 -8.274 5.001 933 HG11 VAL 146 1HG1 VAL 146 8.792 -9.186 2.833 934 HG12 VAL 146 2HG1 VAL 146 8.210 -10.248 4.090 935 HG13 VAL 146 3HG1 VAL 146 7.069 -9.150 3.293 936 HG21 VAL 146 3HG2 VAL 146 7.164 -6.600 3.861 937 HG22 VAL 146 1HG2 VAL 146 8.612 -6.010 4.715 938 HG23 VAL 146 2HG2 VAL 146 8.762 -6.766 3.131 939 H ASP 147 H ASP 147 9.156 -9.232 7.630 940 HA ASP 147 HA ASP 147 8.566 -11.980 7.248 941 HB3 ASP 147 2HB ASP 147 9.849 -10.804 9.722 942 H LYS 148 H LYS 148 6.777 -9.643 9.142 943 HA LYS 148 HA LYS 148 5.263 -11.844 10.422 944 HB3 LYS 148 2HB LYS 148 5.606 -10.306 12.067 945 HG3 LYS 148 2HG LYS 148 4.861 -7.996 10.279 946 HD3 LYS 148 2HD LYS 148 5.840 -6.829 12.443 947 HE3 LYS 148 2HE LYS 148 3.613 -6.399 11.434 948 HZ1 LYS 148 3HZ LYS 148 1.764 -7.418 12.837 949 HZ2 LYS 148 1HZ LYS 148 2.831 -8.612 13.204 950 HZ3 LYS 148 2HZ LYS 148 2.368 -8.380 11.643 951 H TRP 149 H TRP 149 5.055 -9.344 7.935 952 HA TRP 149 HA TRP 149 2.222 -9.375 7.793 953 HB3 TRP 149 2HB TRP 149 2.661 -8.001 5.705 954 HD1 TRP 149 HD TRP 149 2.536 -7.673 9.162 955 HE1 TRP 149 1HE TRP 149 3.239 -5.387 10.095 956 HE3 TRP 149 3HE TRP 149 4.995 -5.756 5.126 957 HZ2 TRP 149 2HZ TRP 149 4.024 -2.843 9.023 958 HZ3 TRP 149 3HZ TRP 149 5.707 -3.391 5.087 959 HH2 TRP 149 HH TRP 149 5.166 -1.887 7.014 960 H SER 150 H SER 150 3.917 -12.058 6.907 961 HA SER 150 HA SER 150 1.784 -12.779 5.037 962 HB3 SER 150 2HB SER 150 4.692 -13.179 4.212 963 HG SER 150 HG SER 150 2.212 -13.385 2.774 964 H LYS 151 H LYS 151 2.083 -13.491 7.772 965 HA LYS 151 HA LYS 151 3.462 -15.945 8.172 966 HB3 LYS 151 2HB LYS 151 1.350 -14.306 9.619 967 HG3 LYS 151 2HG LYS 151 3.024 -16.650 10.599 968 HD3 LYS 151 2HD LYS 151 1.580 -14.455 11.989 969 HE3 LYS 151 2HE LYS 151 0.851 -17.350 12.367 970 HZ1 LYS 151 3HZ LYS 151 -0.078 -16.740 14.499 971 HZ2 LYS 151 1HZ LYS 151 0.544 -15.215 14.410 972 HZ3 LYS 151 2HZ LYS 151 1.541 -16.487 14.518 Start of MODEL 7 1 H1 GLY 1 H GLY 1 -2.705 -25.380 -4.425 2 HA2 GLY 1 1HA GLY 1 -4.060 -24.367 -2.504 3 HA3 GLY 1 2HA GLY 1 -2.859 -23.307 -3.285 4 H MET 2 H MET 2 -5.707 -22.724 -2.024 5 HA MET 2 HA MET 2 -7.321 -22.306 -4.404 6 HB3 MET 2 2HB MET 2 -7.798 -21.543 -1.499 7 HG3 MET 2 2HG MET 2 -9.387 -20.411 -3.125 8 HE1 MET 2 3HE MET 2 -12.498 -22.180 -4.966 9 HE2 MET 2 1HE MET 2 -12.317 -21.881 -3.223 10 HE3 MET 2 2HE MET 2 -11.855 -20.626 -4.395 11 H ALA 3 H ALA 3 -6.962 -19.622 -1.926 12 HA ALA 3 HA ALA 3 -6.175 -17.836 -4.147 13 HB1 ALA 3 1HB ALA 3 -7.859 -16.281 -3.497 14 HB2 ALA 3 2HB ALA 3 -8.654 -17.833 -3.819 15 HB3 ALA 3 3HB ALA 3 -8.365 -17.299 -2.145 16 H LYS 4 H LYS 4 -4.244 -18.118 -3.326 17 HA LYS 4 HA LYS 4 -3.541 -16.449 -0.963 18 HB3 LYS 4 2HB LYS 4 -3.148 -18.726 -0.312 19 HG3 LYS 4 2HG LYS 4 -1.303 -20.050 -1.006 20 HD3 LYS 4 2HD LYS 4 -3.550 -20.306 -2.413 21 HE3 LYS 4 2HE LYS 4 -1.389 -19.542 -4.447 22 HZ1 LYS 4 3HZ LYS 4 -3.153 -19.723 -6.038 23 HZ2 LYS 4 1HZ LYS 4 -4.196 -20.370 -5.002 24 HZ3 LYS 4 2HZ LYS 4 -2.827 -21.219 -5.415 25 H LYS 5 H LYS 5 -3.062 -14.528 -2.018 26 HA LYS 5 HA LYS 5 -0.799 -14.596 -3.861 27 HB3 LYS 5 2HB LYS 5 -2.174 -12.835 -5.285 28 HG3 LYS 5 2HG LYS 5 -3.016 -15.701 -5.622 29 HD3 LYS 5 2HD LYS 5 -2.237 -13.437 -7.497 30 HE3 LYS 5 2HE LYS 5 -2.786 -16.168 -8.604 31 HZ1 LYS 5 3HZ LYS 5 -2.140 -14.460 -10.140 32 HZ2 LYS 5 1HZ LYS 5 -0.884 -15.499 -9.996 33 HZ3 LYS 5 2HZ LYS 5 -0.810 -14.046 -9.232 34 H THR 6 H THR 6 0.325 -12.750 -4.038 35 HA THR 6 HA THR 6 -0.322 -10.604 -2.090 36 HB THR 6 HB THR 6 2.202 -12.117 -2.797 37 HG1 THR 6 1HG THR 6 0.903 -12.963 -1.109 38 HG21 THR 6 3HG2 THR 6 2.430 -9.444 -2.482 39 HG22 THR 6 1HG2 THR 6 3.607 -10.578 -1.849 40 HG23 THR 6 2HG2 THR 6 2.370 -9.930 -0.778 41 H LEU 7 H LEU 7 -1.069 -8.922 -3.299 42 HA LEU 7 HA LEU 7 0.374 -8.165 -5.812 43 HB3 LEU 7 2HB LEU 7 -2.258 -7.273 -4.611 44 HG LEU 7 HG LEU 7 -1.373 -5.375 -5.850 45 HD11 LEU 7 1HD1 LEU 7 -0.811 -7.388 -8.080 46 HD12 LEU 7 2HD1 LEU 7 0.343 -6.271 -7.299 47 HD13 LEU 7 3HD1 LEU 7 -0.926 -5.645 -8.347 48 HD21 LEU 7 3HD2 LEU 7 -3.760 -5.953 -6.087 49 HD22 LEU 7 1HD2 LEU 7 -3.381 -6.948 -7.512 50 HD23 LEU 7 2HD2 LEU 7 -3.144 -5.196 -7.566 51 H ILE 8 H ILE 8 2.223 -6.996 -5.325 52 HA ILE 8 HA ILE 8 2.214 -5.146 -3.045 53 HB ILE 8 HB ILE 8 4.455 -6.058 -4.886 54 HG13 ILE 8 2HG1 ILE 8 3.521 -7.974 -3.696 55 HG21 ILE 8 1HG2 ILE 8 6.012 -5.208 -3.274 56 HG22 ILE 8 2HG2 ILE 8 4.920 -3.915 -3.740 57 HG23 ILE 8 3HG2 ILE 8 4.676 -4.758 -2.189 58 HD11 ILE 8 3HD1 ILE 8 5.348 -8.825 -2.446 59 HD12 ILE 8 1HD1 ILE 8 5.994 -7.863 -3.793 60 HD13 ILE 8 2HD1 ILE 8 5.997 -7.211 -2.133 61 H LEU 9 H LEU 9 1.226 -3.194 -3.589 62 HA LEU 9 HA LEU 9 1.729 -1.982 -6.284 63 HB3 LEU 9 2HB LEU 9 -0.129 -0.509 -5.741 64 HG LEU 9 HG LEU 9 -0.972 -3.289 -4.801 65 HD11 LEU 9 1HD1 LEU 9 -2.512 -1.409 -4.254 66 HD12 LEU 9 2HD1 LEU 9 -3.210 -2.606 -5.352 67 HD13 LEU 9 3HD1 LEU 9 -2.643 -1.050 -5.996 68 HD21 LEU 9 3HD2 LEU 9 -0.794 -2.023 -7.564 69 HD22 LEU 9 1HD2 LEU 9 -1.798 -3.431 -7.222 70 HD23 LEU 9 2HD2 LEU 9 -0.055 -3.546 -6.978 71 H TYR 10 H TYR 10 3.296 -0.175 -6.344 72 HA TYR 10 HA TYR 10 3.230 1.463 -3.912 73 HB3 TYR 10 2HB TYR 10 5.060 -0.300 -3.515 74 HD1 TYR 10 1HD TYR 10 5.394 -0.137 -6.708 75 HD2 TYR 10 2HD TYR 10 7.801 0.925 -3.295 76 HE1 TYR 10 1HE TYR 10 7.345 0.013 -8.175 77 HE2 TYR 10 2HE TYR 10 9.714 1.281 -4.805 78 HH TYR 10 HH TYR 10 9.387 1.044 -8.358 79 H TYR 11 H TYR 11 4.427 3.461 -3.966 80 HA TYR 11 HA TYR 11 4.503 4.579 -6.686 81 HB3 TYR 11 2HB TYR 11 3.800 5.980 -4.122 82 HD1 TYR 11 1HD TYR 11 4.852 6.358 -7.758 83 HD2 TYR 11 2HD TYR 11 3.716 8.455 -4.131 84 HE1 TYR 11 1HE TYR 11 5.230 8.465 -8.869 85 HE2 TYR 11 2HE TYR 11 4.133 10.580 -5.275 86 HH TYR 11 HH TYR 11 5.083 10.850 -8.746 87 H SER 12 H SER 12 6.683 4.704 -7.223 88 HA SER 12 HA SER 12 8.644 5.248 -5.104 89 HB3 SER 12 2HB SER 12 9.420 3.499 -6.466 90 HG SER 12 HG SER 12 8.039 3.883 -8.292 91 H TRP 13 H TRP 13 8.870 7.245 -4.512 92 HA TRP 13 HA TRP 13 8.306 9.617 -5.650 93 HB3 TRP 13 2HB TRP 13 10.873 9.040 -4.103 94 HD1 TRP 13 HD TRP 13 8.039 11.387 -3.113 95 HE1 TRP 13 1HE TRP 13 8.914 13.724 -2.800 96 HE3 TRP 13 3HE TRP 13 12.714 10.747 -5.106 97 HZ2 TRP 13 2HZ TRP 13 11.385 15.167 -3.275 98 HZ3 TRP 13 3HZ TRP 13 14.222 12.700 -5.376 99 HH2 TRP 13 HH TRP 13 13.608 14.898 -4.371 100 H SER 14 H SER 14 11.681 8.419 -5.839 101 HA SER 14 HA SER 14 11.773 8.690 -8.715 102 HB3 SER 14 2HB SER 14 13.847 10.504 -7.633 103 HG SER 14 HG SER 14 13.612 11.023 -9.647 104 H GLY 15 H GLY 15 13.036 7.366 -5.791 105 HA2 GLY 15 1HA GLY 15 14.672 5.481 -6.843 106 HA3 GLY 15 2HA GLY 15 15.711 6.897 -6.837 107 H GLU 16 H GLU 16 13.247 6.200 -4.350 108 HA GLU 16 HA GLU 16 15.355 5.403 -2.412 109 HB3 GLU 16 2HB GLU 16 14.322 6.744 -0.715 110 HG3 GLU 16 2HG GLU 16 13.914 8.499 -3.189 111 H THR 17 H THR 17 11.769 5.592 -2.629 112 HA THR 17 HA THR 17 11.062 3.269 -1.426 113 HB THR 17 HB THR 17 9.668 3.901 -3.981 114 HG1 THR 17 1HG THR 17 9.708 5.845 -1.935 115 HG21 THR 17 3HG2 THR 17 8.098 4.269 -1.546 116 HG22 THR 17 1HG2 THR 17 8.860 2.676 -1.665 117 HG23 THR 17 2HG2 THR 17 7.807 3.259 -2.966 118 H LYS 18 H LYS 18 12.485 3.622 -4.650 119 HA LYS 18 HA LYS 18 11.531 1.232 -5.793 120 HB3 LYS 18 2HB LYS 18 14.009 2.804 -6.538 121 HG3 LYS 18 2HG LYS 18 13.116 1.954 -8.870 122 HD3 LYS 18 2HD LYS 18 14.387 -0.251 -8.735 123 HE3 LYS 18 2HE LYS 18 16.438 1.527 -7.752 124 HZ1 LYS 18 3HZ LYS 18 16.693 0.009 -9.637 125 HZ2 LYS 18 1HZ LYS 18 17.078 1.547 -10.067 126 HZ3 LYS 18 2HZ LYS 18 15.648 0.906 -10.536 127 H LYS 19 H LYS 19 14.544 1.639 -3.788 128 HA LYS 19 HA LYS 19 15.285 -1.147 -4.231 129 HB3 LYS 19 2HB LYS 19 16.389 -0.936 -1.967 130 HG3 LYS 19 2HG LYS 19 17.434 1.490 -3.276 131 HD3 LYS 19 2HD LYS 19 18.621 -1.304 -3.007 132 HE3 LYS 19 2HE LYS 19 19.910 1.459 -2.976 133 HZ1 LYS 19 3HZ LYS 19 21.397 -1.024 -3.321 134 HZ2 LYS 19 1HZ LYS 19 20.904 -0.632 -1.791 135 HZ3 LYS 19 2HZ LYS 19 21.879 0.378 -2.624 136 H MET 20 H MET 20 13.080 0.400 -1.906 137 HA MET 20 HA MET 20 12.832 -1.874 -0.213 138 HB3 MET 20 2HB MET 20 10.805 0.388 -0.494 139 HG3 MET 20 2HG MET 20 10.315 -1.189 1.276 140 HE1 MET 20 3HE MET 20 13.412 0.798 2.660 141 HE2 MET 20 1HE MET 20 14.564 -0.488 3.081 142 HE3 MET 20 2HE MET 20 14.211 -0.143 1.374 143 H ALA 21 H ALA 21 11.565 -1.470 -3.350 144 HA ALA 21 HA ALA 21 8.977 -2.772 -2.847 145 HB1 ALA 21 1HB ALA 21 10.261 -1.339 -5.101 146 HB2 ALA 21 2HB ALA 21 9.439 -2.819 -5.592 147 HB3 ALA 21 3HB ALA 21 8.540 -1.601 -4.704 148 H GLU 22 H GLU 22 11.848 -3.354 -4.905 149 HA GLU 22 HA GLU 22 11.334 -5.982 -5.410 150 HB3 GLU 22 2HB GLU 22 12.866 -4.976 -6.847 151 HG3 GLU 22 2HG GLU 22 14.445 -4.241 -4.373 152 H LYS 23 H LYS 23 13.238 -4.736 -2.631 153 HA LYS 23 HA LYS 23 14.215 -7.282 -1.857 154 HB3 LYS 23 2HB LYS 23 13.537 -5.040 0.107 155 HG3 LYS 23 2HG LYS 23 15.573 -7.310 -0.027 156 HD3 LYS 23 2HD LYS 23 15.361 -5.428 2.322 157 HE3 LYS 23 2HE LYS 23 17.684 -6.210 2.702 158 HZ1 LYS 23 3HZ LYS 23 15.907 -8.515 2.202 159 HZ2 LYS 23 1HZ LYS 23 15.925 -7.653 3.581 160 HZ3 LYS 23 2HZ LYS 23 17.247 -8.538 3.133 161 H ILE 24 H ILE 24 11.216 -5.598 -0.778 162 HA ILE 24 HA ILE 24 10.332 -7.803 0.817 163 HB ILE 24 HB ILE 24 9.038 -5.295 -0.309 164 HG13 ILE 24 2HG1 ILE 24 10.830 -5.081 1.421 165 HG21 ILE 24 1HG2 ILE 24 7.708 -7.630 0.962 166 HG22 ILE 24 2HG2 ILE 24 7.330 -6.093 1.698 167 HG23 ILE 24 3HG2 ILE 24 7.046 -6.335 -0.040 168 HD11 ILE 24 3HD1 ILE 24 9.821 -3.589 2.881 169 HD12 ILE 24 1HD1 ILE 24 8.808 -3.494 1.430 170 HD13 ILE 24 2HD1 ILE 24 8.271 -4.430 2.854 171 H ASN 25 H ASN 25 9.838 -6.905 -2.622 172 HA ASN 25 HA ASN 25 7.847 -8.890 -3.105 173 HB3 ASN 25 2HB ASN 25 9.839 -7.548 -4.967 174 HD21 ASN 25 1HD2 ASN 25 6.605 -9.304 -4.993 175 HD22 ASN 25 2HD2 ASN 25 6.958 -10.109 -6.474 176 H SER 26 H SER 26 11.395 -9.084 -3.339 177 HA SER 26 HA SER 26 11.604 -11.786 -4.194 178 HB3 SER 26 2HB SER 26 13.409 -10.095 -2.403 179 HG SER 26 HG SER 26 13.819 -12.506 -3.811 180 H GLU 27 H GLU 27 11.522 -10.321 -0.905 181 HA GLU 27 HA GLU 27 11.700 -12.785 0.473 182 HB3 GLU 27 2HB GLU 27 11.004 -11.242 2.447 183 HG3 GLU 27 2HG GLU 27 13.104 -9.847 2.258 184 H ILE 28 H ILE 28 8.940 -11.803 -1.226 185 HA ILE 28 HA ILE 28 7.221 -13.354 0.682 186 HB ILE 28 HB ILE 28 6.340 -11.078 -1.140 187 HG13 ILE 28 2HG1 ILE 28 7.454 -10.387 1.017 188 HG21 ILE 28 1HG2 ILE 28 4.589 -12.710 -1.183 189 HG22 ILE 28 2HG2 ILE 28 4.819 -13.138 0.532 190 HG23 ILE 28 3HG2 ILE 28 4.068 -11.625 0.079 191 HD11 ILE 28 3HD1 ILE 28 5.369 -9.148 0.213 192 HD12 ILE 28 1HD1 ILE 28 4.489 -10.075 1.462 193 HD13 ILE 28 2HD1 ILE 28 5.795 -8.989 1.935 194 H LYS 29 H LYS 29 6.213 -15.040 -0.068 195 HA LYS 29 HA LYS 29 6.862 -15.931 -2.789 196 HB3 LYS 29 2HB LYS 29 4.941 -17.610 -1.244 197 HG3 LYS 29 2HG LYS 29 7.355 -18.969 -1.543 198 HD3 LYS 29 2HD LYS 29 5.213 -20.012 -2.129 199 HE3 LYS 29 2HE LYS 29 5.422 -18.256 -4.603 200 HZ1 LYS 29 3HZ LYS 29 4.783 -20.400 -5.369 201 HZ2 LYS 29 1HZ LYS 29 3.489 -19.410 -5.380 202 HZ3 LYS 29 2HZ LYS 29 3.635 -20.562 -4.195 203 H ASP 30 H ASP 30 5.404 -16.352 -4.306 204 HA ASP 30 HA ASP 30 3.590 -16.116 -5.675 205 HB3 ASP 30 2HB ASP 30 1.335 -16.001 -3.834 206 H SER 31 H SER 31 5.026 -13.722 -4.716 207 HA SER 31 HA SER 31 3.049 -11.655 -4.596 208 HB3 SER 31 2HB SER 31 4.991 -11.583 -3.198 209 HG SER 31 HG SER 31 6.929 -12.083 -3.853 210 H GLU 32 H GLU 32 2.986 -9.915 -6.056 211 HA GLU 32 HA GLU 32 4.461 -10.084 -8.598 212 HB3 GLU 32 2HB GLU 32 1.866 -8.524 -8.332 213 HG3 GLU 32 2HG GLU 32 3.167 -10.027 -10.623 214 H LEU 33 H LEU 33 4.681 -7.659 -9.309 215 HA LEU 33 HA LEU 33 4.784 -5.729 -7.072 216 HB3 LEU 33 2HB LEU 33 6.883 -5.202 -9.011 217 HG LEU 33 HG LEU 33 7.038 -6.076 -6.114 218 HD11 LEU 33 1HD1 LEU 33 9.150 -4.693 -7.843 219 HD12 LEU 33 2HD1 LEU 33 9.185 -6.385 -7.327 220 HD13 LEU 33 3HD1 LEU 33 9.340 -5.099 -6.130 221 HD21 LEU 33 3HD2 LEU 33 7.379 -3.824 -5.447 222 HD22 LEU 33 1HD2 LEU 33 5.854 -3.885 -6.332 223 HD23 LEU 33 2HD2 LEU 33 7.315 -3.228 -7.123 224 H LYS 34 H LYS 34 4.072 -3.694 -7.665 225 HA LYS 34 HA LYS 34 3.323 -3.172 -10.487 226 HB3 LYS 34 2HB LYS 34 1.256 -2.435 -8.561 227 HG3 LYS 34 2HG LYS 34 0.145 -4.522 -9.822 228 HD3 LYS 34 2HD LYS 34 0.738 -1.800 -11.008 229 HE3 LYS 34 2HE LYS 34 -1.332 -2.383 -12.381 230 HZ1 LYS 34 3HZ LYS 34 0.957 -4.139 -12.998 231 HZ2 LYS 34 1HZ LYS 34 0.930 -2.505 -13.329 232 HZ3 LYS 34 2HZ LYS 34 -0.165 -3.534 -14.037 233 H GLU 35 H GLU 35 3.243 -0.984 -11.008 234 HA GLU 35 HA GLU 35 4.146 0.875 -8.865 235 HB3 GLU 35 2HB GLU 35 5.727 0.439 -10.779 236 HG3 GLU 35 2HG GLU 35 4.035 2.462 -12.307 237 H VAL 36 H VAL 36 3.252 2.976 -8.796 238 HA VAL 36 HA VAL 36 0.768 3.511 -10.317 239 HB VAL 36 HB VAL 36 1.185 4.002 -7.318 240 HG11 VAL 36 1HG1 VAL 36 -0.473 5.479 -8.393 241 HG12 VAL 36 2HG1 VAL 36 -1.312 4.074 -9.085 242 HG13 VAL 36 3HG1 VAL 36 -1.284 4.328 -7.330 243 HG21 VAL 36 3HG2 VAL 36 1.105 1.606 -7.460 244 HG22 VAL 36 1HG2 VAL 36 -0.516 2.117 -6.995 245 HG23 VAL 36 2HG2 VAL 36 -0.191 1.642 -8.673 246 H LYS 37 H LYS 37 0.818 5.696 -11.067 247 HA LYS 37 HA LYS 37 2.742 7.582 -9.752 248 HB3 LYS 37 2HB LYS 37 3.000 8.606 -12.019 249 HG3 LYS 37 2HG LYS 37 4.610 6.883 -10.921 250 HD3 LYS 37 2HD LYS 37 3.164 4.927 -12.297 251 HE3 LYS 37 2HE LYS 37 4.861 4.155 -14.022 252 HZ1 LYS 37 3HZ LYS 37 4.199 5.859 -15.729 253 HZ2 LYS 37 1HZ LYS 37 3.337 6.630 -14.615 254 HZ3 LYS 37 2HZ LYS 37 2.964 5.070 -14.996 255 H VAL 38 H VAL 38 2.121 9.976 -10.507 256 HA VAL 38 HA VAL 38 -0.782 10.404 -10.290 257 HB VAL 38 HB VAL 38 -0.454 12.140 -8.576 258 HG11 VAL 38 1HG1 VAL 38 -1.124 9.838 -7.911 259 HG12 VAL 38 2HG1 VAL 38 0.581 9.494 -7.550 260 HG13 VAL 38 3HG1 VAL 38 -0.279 10.745 -6.639 261 HG21 VAL 38 3HG2 VAL 38 1.966 12.638 -8.921 262 HG22 VAL 38 1HG2 VAL 38 1.579 12.293 -7.235 263 HG23 VAL 38 2HG2 VAL 38 2.360 11.052 -8.236 264 H SER 39 H SER 39 -1.145 12.877 -10.474 265 HA SER 39 HA SER 39 -0.186 13.814 -12.991 266 HB3 SER 39 2HB SER 39 -1.893 14.845 -10.718 267 HG SER 39 HG SER 39 -1.010 16.759 -11.603 268 H GLU 40 H GLU 40 0.754 15.817 -13.243 269 HA GLU 40 HA GLU 40 3.115 16.565 -11.686 270 HB3 GLU 40 2HB GLU 40 2.896 18.596 -13.242 271 HG3 GLU 40 2HG GLU 40 2.748 16.542 -15.227 272 H GLY 41 H GLY 41 3.213 18.858 -10.896 273 HA2 GLY 41 1HA GLY 41 2.328 20.782 -10.022 274 HA3 GLY 41 2HA GLY 41 0.775 20.206 -10.671 275 H THR 42 H THR 42 1.270 17.596 -8.964 276 HA THR 42 HA THR 42 -0.159 18.368 -6.658 277 HB THR 42 HB THR 42 1.394 15.778 -6.883 278 HG1 THR 42 1HG THR 42 0.559 15.657 -8.842 279 HG21 THR 42 3HG2 THR 42 -0.528 14.843 -5.802 280 HG22 THR 42 1HG2 THR 42 -1.493 16.325 -6.081 281 HG23 THR 42 2HG2 THR 42 -0.168 16.345 -4.934 282 H PHE 43 H PHE 43 3.370 17.401 -7.065 283 HA PHE 43 HA PHE 43 3.919 19.038 -4.660 284 HB3 PHE 43 2HB PHE 43 5.538 17.225 -3.853 285 HD1 PHE 43 2HD PHE 43 1.971 16.125 -4.424 286 HD2 PHE 43 1HD PHE 43 4.943 17.436 -1.631 287 HE1 PHE 43 2HE PHE 43 0.231 16.277 -2.658 288 HE2 PHE 43 1HE PHE 43 3.228 17.543 0.157 289 HZ PHE 43 HZ PHE 43 0.832 17.025 -0.410 290 H ASP 44 H ASP 44 6.368 19.198 -4.338 291 HA ASP 44 HA ASP 44 7.659 19.761 -6.979 292 HB3 ASP 44 2HB ASP 44 7.510 21.882 -4.822 293 H ALA 45 H ALA 45 8.146 17.975 -4.769 294 HA ALA 45 HA ALA 45 9.754 17.216 -3.205 295 HB1 ALA 45 1HB ALA 45 10.747 16.798 -5.409 296 HB2 ALA 45 2HB ALA 45 11.517 18.401 -5.387 297 HB3 ALA 45 3HB ALA 45 12.012 17.168 -4.216 298 H ASP 46 H ASP 46 8.878 20.048 -2.720 299 HA ASP 46 HA ASP 46 11.295 21.517 -1.989 300 HB3 ASP 46 2HB ASP 46 8.409 22.424 -1.810 301 H MET 47 H MET 47 11.527 22.661 0.031 302 HA MET 47 HA MET 47 10.752 21.123 2.368 303 HB3 MET 47 2HB MET 47 12.415 23.616 1.789 304 HG3 MET 47 2HG MET 47 11.832 22.317 4.432 305 HE1 MET 47 3HE MET 47 13.683 25.587 3.529 306 HE2 MET 47 1HE MET 47 15.403 25.202 3.766 307 HE3 MET 47 2HE MET 47 14.498 24.473 2.416 308 H TYR 48 H TYR 48 9.755 24.224 0.953 309 HA TYR 48 HA TYR 48 8.015 24.777 3.308 310 HB3 TYR 48 2HB TYR 48 9.895 26.185 3.295 311 HD1 TYR 48 2HD TYR 48 8.355 27.862 0.358 312 HD2 TYR 48 1HD TYR 48 11.814 25.795 1.888 313 HE1 TYR 48 2HE TYR 48 9.587 28.428 -1.695 314 HE2 TYR 48 1HE TYR 48 13.040 26.278 -0.201 315 HH TYR 48 HH TYR 48 12.605 26.821 -2.520 316 H LYS 49 H LYS 49 8.174 24.545 -0.156 317 HA LYS 49 HA LYS 49 5.438 25.581 -0.492 318 HB3 LYS 49 2HB LYS 49 6.744 23.717 -2.484 319 HG3 LYS 49 2HG LYS 49 4.398 24.798 -2.721 320 HD3 LYS 49 2HD LYS 49 6.064 27.136 -3.757 321 HE3 LYS 49 2HE LYS 49 3.095 26.762 -3.144 322 HZ1 LYS 49 3HZ LYS 49 2.773 28.709 -4.402 323 HZ2 LYS 49 1HZ LYS 49 4.382 28.918 -4.712 324 HZ3 LYS 49 2HZ LYS 49 3.789 29.102 -3.183 325 H THR 50 H THR 50 6.846 22.191 -0.416 326 HA THR 50 HA THR 50 4.266 21.094 -0.857 327 HB THR 50 HB THR 50 5.171 18.965 -0.205 328 HG1 THR 50 1HG THR 50 7.692 20.028 0.435 329 HG21 THR 50 3HG2 THR 50 7.023 18.802 -1.830 330 HG22 THR 50 1HG2 THR 50 7.160 20.573 -1.858 331 HG23 THR 50 2HG2 THR 50 5.687 19.795 -2.452 332 H SER 51 H SER 51 5.745 22.118 2.195 333 HA SER 51 HA SER 51 4.041 20.620 3.895 334 HB3 SER 51 2HB SER 51 6.166 21.577 4.598 335 HG SER 51 HG SER 51 4.969 24.094 4.725 336 H ASP 52 H ASP 52 3.485 23.476 1.935 337 HA ASP 52 HA ASP 52 1.022 24.237 3.346 338 HB3 ASP 52 2HB ASP 52 2.052 25.242 0.659 339 H ILE 53 H ILE 53 2.087 22.789 0.247 340 HA ILE 53 HA ILE 53 -0.439 22.505 -0.916 341 HB ILE 53 HB ILE 53 2.009 20.756 -1.349 342 HG13 ILE 53 2HG1 ILE 53 2.185 23.321 -1.791 343 HG21 ILE 53 1HG2 ILE 53 0.594 20.690 -3.707 344 HG22 ILE 53 2HG2 ILE 53 0.447 19.461 -2.448 345 HG23 ILE 53 3HG2 ILE 53 -0.734 20.776 -2.581 346 HD11 ILE 53 3HD1 ILE 53 3.259 23.064 -3.998 347 HD12 ILE 53 1HD1 ILE 53 3.805 21.839 -2.844 348 HD13 ILE 53 2HD1 ILE 53 2.647 21.408 -4.114 349 H ALA 54 H ALA 54 1.302 19.972 1.076 350 HA ALA 54 HA ALA 54 -0.939 18.185 0.805 351 HB1 ALA 54 1HB ALA 54 0.033 16.803 2.445 352 HB2 ALA 54 2HB ALA 54 1.438 17.559 1.659 353 HB3 ALA 54 3HB ALA 54 0.865 18.148 3.228 354 H LEU 55 H LEU 55 -0.490 21.021 2.822 355 HA LEU 55 HA LEU 55 -2.296 20.246 4.912 356 HB3 LEU 55 2HB LEU 55 -2.009 23.140 4.252 357 HG LEU 55 HG LEU 55 -0.845 21.827 6.708 358 HD11 LEU 55 1HD1 LEU 55 -1.572 23.950 7.751 359 HD12 LEU 55 2HD1 LEU 55 -2.383 24.420 6.250 360 HD13 LEU 55 3HD1 LEU 55 -0.604 24.268 6.292 361 HD21 LEU 55 3HD2 LEU 55 -3.037 22.130 7.927 362 HD22 LEU 55 1HD2 LEU 55 -3.016 20.778 6.798 363 HD23 LEU 55 2HD2 LEU 55 -3.780 22.306 6.324 364 H ASP 56 H ASP 56 -2.486 22.175 1.980 365 HA ASP 56 HA ASP 56 -5.234 22.922 1.945 366 HB3 ASP 56 2HB ASP 56 -3.105 22.464 -0.170 367 H GLN 57 H GLN 57 -3.576 20.016 0.678 368 HA GLN 57 HA GLN 57 -6.087 18.703 0.011 369 HB3 GLN 57 2HB GLN 57 -4.687 16.889 -0.794 370 HG3 GLN 57 2HG GLN 57 -3.420 19.537 -1.593 371 HE21 GLN 57 1HE2 GLN 57 -5.104 17.844 -3.996 372 HE22 GLN 57 2HE2 GLN 57 -3.644 17.232 -4.797 373 H ILE 58 H ILE 58 -5.068 19.290 2.998 374 HA ILE 58 HA ILE 58 -6.051 16.673 4.047 375 HB ILE 58 HB ILE 58 -4.260 18.784 5.252 376 HG13 ILE 58 2HG1 ILE 58 -3.450 16.644 3.991 377 HG21 ILE 58 1HG2 ILE 58 -4.433 17.598 7.478 378 HG22 ILE 58 2HG2 ILE 58 -5.858 18.528 7.028 379 HG23 ILE 58 3HG2 ILE 58 -5.866 16.769 6.868 380 HD11 ILE 58 3HD1 ILE 58 -2.371 16.930 6.817 381 HD12 ILE 58 1HD1 ILE 58 -1.511 16.458 5.344 382 HD13 ILE 58 2HD1 ILE 58 -2.031 18.136 5.559 383 H GLN 59 H GLN 59 -6.311 20.235 4.449 384 HA GLN 59 HA GLN 59 -8.224 19.947 6.479 385 HB3 GLN 59 2HB GLN 59 -8.541 22.487 6.086 386 HG3 GLN 59 2HG GLN 59 -5.719 21.448 6.431 387 HE21 GLN 59 1HE2 GLN 59 -5.307 23.610 5.116 388 HE22 GLN 59 2HE2 GLN 59 -5.291 25.074 6.091 389 H GLY 60 H GLY 60 -9.015 19.336 3.254 390 HA2 GLY 60 1HA GLY 60 -11.087 19.166 2.252 391 HA3 GLY 60 2HA GLY 60 -11.847 19.961 3.638 392 H ASN 61 H ASN 61 -9.047 21.499 2.310 393 HA ASN 61 HA ASN 61 -10.584 23.842 1.435 394 HB3 ASN 61 2HB ASN 61 -8.390 24.798 0.883 395 HD21 ASN 61 1HD2 ASN 61 -6.311 24.852 2.541 396 HD22 ASN 61 2HD2 ASN 61 -6.797 24.968 4.217 397 H LYS 62 H LYS 62 -8.706 21.173 -0.002 398 HA LYS 62 HA LYS 62 -9.732 21.822 -2.704 399 HB3 LYS 62 2HB LYS 62 -7.098 20.810 -3.068 400 HG3 LYS 62 2HG LYS 62 -6.315 22.910 -3.536 401 HD3 LYS 62 2HD LYS 62 -8.846 24.140 -4.102 402 HE3 LYS 62 2HE LYS 62 -6.484 24.068 -5.347 403 HZ1 LYS 62 3HZ LYS 62 -6.859 21.649 -5.974 404 HZ2 LYS 62 1HZ LYS 62 -6.530 22.649 -7.234 405 HZ3 LYS 62 2HZ LYS 62 -8.073 22.155 -6.949 406 H ASP 63 H ASP 63 -9.003 20.041 -4.180 407 HA ASP 63 HA ASP 63 -10.114 17.508 -3.151 408 HB3 ASP 63 2HB ASP 63 -9.375 17.899 -6.021 409 H PHE 64 H PHE 64 -9.091 15.547 -4.055 410 HA PHE 64 HA PHE 64 -6.229 15.555 -3.166 411 HB3 PHE 64 2HB PHE 64 -7.516 14.146 -1.828 412 HD1 PHE 64 1HD PHE 64 -9.895 14.527 -1.875 413 HD2 PHE 64 2HD PHE 64 -8.002 11.876 -4.718 414 HE1 PHE 64 1HE PHE 64 -12.110 13.768 -2.636 415 HE2 PHE 64 2HE PHE 64 -10.236 11.110 -5.467 416 HZ PHE 64 HZ PHE 64 -12.286 12.095 -4.477 417 HA PRO 65 HA PRO 65 -4.779 14.677 -7.166 418 HB3 PRO 65 2HB PRO 65 -2.651 14.394 -6.573 419 HG3 PRO 65 2HG PRO 65 -2.135 13.573 -4.383 420 HD3 PRO 65 2HD PRO 65 -3.908 14.999 -3.868 421 H GLU 66 H GLU 66 -4.828 13.395 -8.961 422 HA GLU 66 HA GLU 66 -6.439 10.934 -8.968 423 HB3 GLU 66 2HB GLU 66 -6.582 12.759 -10.702 424 HG3 GLU 66 2HG GLU 66 -4.227 11.403 -11.986 425 H ILE 67 H ILE 67 -5.575 8.926 -9.759 426 HA ILE 67 HA ILE 67 -2.622 8.624 -9.667 427 HB ILE 67 HB ILE 67 -3.007 6.196 -9.414 428 HG13 ILE 67 2HG1 ILE 67 -5.360 6.075 -10.232 429 HG21 ILE 67 1HG2 ILE 67 -3.316 6.277 -7.008 430 HG22 ILE 67 2HG2 ILE 67 -2.429 7.701 -7.546 431 HG23 ILE 67 3HG2 ILE 67 -4.145 7.849 -7.134 432 HD11 ILE 67 3HD1 ILE 67 -5.184 5.000 -7.398 433 HD12 ILE 67 1HD1 ILE 67 -6.176 4.399 -8.733 434 HD13 ILE 67 2HD1 ILE 67 -4.414 4.233 -8.807 435 H GLN 68 H GLN 68 -1.735 7.379 -11.330 436 HA GLN 68 HA GLN 68 -3.166 7.601 -13.929 437 HB3 GLN 68 2HB GLN 68 -0.869 7.772 -14.831 438 HG3 GLN 68 2HG GLN 68 -1.299 9.618 -12.438 439 HE21 GLN 68 1HE2 GLN 68 -0.724 11.652 -14.914 440 HE22 GLN 68 2HE2 GLN 68 1.055 11.663 -14.755 441 H LEU 69 H LEU 69 -3.465 5.392 -12.120 442 HA LEU 69 HA LEU 69 -1.929 3.127 -13.128 443 HB3 LEU 69 2HB LEU 69 -4.257 2.562 -11.370 444 HG LEU 69 HG LEU 69 -1.300 2.298 -10.713 445 HD11 LEU 69 1HD1 LEU 69 -3.031 1.957 -8.933 446 HD12 LEU 69 2HD1 LEU 69 -2.127 0.471 -9.283 447 HD13 LEU 69 3HD1 LEU 69 -3.764 0.685 -9.936 448 HD21 LEU 69 3HD2 LEU 69 -2.907 0.135 -12.125 449 HD22 LEU 69 1HD2 LEU 69 -1.230 0.045 -11.557 450 HD23 LEU 69 2HD2 LEU 69 -1.631 1.112 -12.895 451 H ASP 70 H ASP 70 -3.929 1.172 -13.075 452 HA ASP 70 HA ASP 70 -5.894 1.918 -15.161 453 HB3 ASP 70 2HB ASP 70 -5.077 -0.899 -15.303 454 H ASN 71 H ASN 71 -7.613 0.047 -15.258 455 HA ASN 71 HA ASN 71 -8.514 -0.175 -12.473 456 HB3 ASN 71 2HB ASN 71 -10.074 -1.353 -14.795 457 HD21 ASN 71 1HD2 ASN 71 -11.354 -2.687 -13.310 458 HD22 ASN 71 2HD2 ASN 71 -12.135 -2.008 -11.918 459 H ILE 72 H ILE 72 -8.240 -1.832 -11.197 460 HA ILE 72 HA ILE 72 -7.736 -4.520 -12.350 461 HB ILE 72 HB ILE 72 -6.260 -2.957 -10.233 462 HG13 ILE 72 2HG1 ILE 72 -5.583 -2.962 -12.718 463 HG21 ILE 72 1HG2 ILE 72 -5.110 -4.968 -9.459 464 HG22 ILE 72 2HG2 ILE 72 -6.824 -5.151 -9.185 465 HG23 ILE 72 3HG2 ILE 72 -6.061 -5.975 -10.566 466 HD11 ILE 72 3HD1 ILE 72 -3.233 -3.727 -12.408 467 HD12 ILE 72 1HD1 ILE 72 -3.804 -2.425 -11.337 468 HD13 ILE 72 2HD1 ILE 72 -3.596 -4.098 -10.728 469 H ASP 73 H ASP 73 -8.795 -6.152 -11.413 470 HA ASP 73 HA ASP 73 -10.974 -5.540 -9.527 471 HB3 ASP 73 2HB ASP 73 -11.438 -8.022 -10.017 472 H TYR 74 H TYR 74 -9.866 -5.154 -7.663 473 HA TYR 74 HA TYR 74 -7.607 -6.585 -6.772 474 HB3 TYR 74 2HB TYR 74 -8.064 -5.365 -4.632 475 HD1 TYR 74 1HD TYR 74 -5.916 -4.904 -5.940 476 HD2 TYR 74 2HD TYR 74 -9.602 -2.785 -6.695 477 HE1 TYR 74 1HE TYR 74 -4.661 -3.148 -7.126 478 HE2 TYR 74 2HE TYR 74 -8.346 -1.028 -7.897 479 HH TYR 74 HH TYR 74 -6.177 -0.325 -8.742 480 H ASN 75 H ASN 75 -10.799 -7.712 -6.831 481 HA ASN 75 HA ASN 75 -10.969 -8.831 -4.241 482 HB3 ASN 75 2HB ASN 75 -12.793 -10.025 -6.250 483 HD21 ASN 75 1HD2 ASN 75 -12.800 -10.789 -3.727 484 HD22 ASN 75 2HD2 ASN 75 -13.962 -9.911 -2.737 485 H ASN 76 H ASN 76 -8.650 -9.888 -6.003 486 HA ASN 76 HA ASN 76 -9.217 -12.813 -5.940 487 HB3 ASN 76 2HB ASN 76 -7.612 -12.886 -7.773 488 HD21 ASN 76 1HD2 ASN 76 -8.991 -9.793 -8.799 489 HD22 ASN 76 2HD2 ASN 76 -10.384 -10.513 -9.531 490 H TYR 77 H TYR 77 -7.222 -10.335 -4.574 491 HA TYR 77 HA TYR 77 -4.788 -12.025 -4.329 492 HB3 TYR 77 2HB TYR 77 -3.661 -10.011 -3.773 493 HD1 TYR 77 2HD TYR 77 -2.799 -10.849 -6.048 494 HD2 TYR 77 1HD TYR 77 -6.295 -8.382 -5.704 495 HE1 TYR 77 2HE TYR 77 -2.794 -10.520 -8.497 496 HE2 TYR 77 1HE TYR 77 -6.441 -8.205 -8.170 497 HH TYR 77 HH TYR 77 -3.953 -9.633 -10.335 498 H ASP 78 H ASP 78 -4.012 -12.583 -2.217 499 HA ASP 78 HA ASP 78 -6.163 -12.836 -0.183 500 HB3 ASP 78 2HB ASP 78 -3.286 -13.853 -0.210 501 H LEU 79 H LEU 79 -3.189 -11.123 -0.766 502 HA LEU 79 HA LEU 79 -3.464 -9.382 1.620 503 HB3 LEU 79 2HB LEU 79 -1.181 -11.157 0.687 504 HG LEU 79 HG LEU 79 -0.221 -8.923 1.206 505 HD11 LEU 79 1HD1 LEU 79 -1.180 -9.457 4.042 506 HD12 LEU 79 2HD1 LEU 79 -1.799 -8.165 2.983 507 HD13 LEU 79 3HD1 LEU 79 -0.113 -8.146 3.531 508 HD21 LEU 79 3HD2 LEU 79 0.435 -11.198 3.099 509 HD22 LEU 79 1HD2 LEU 79 1.506 -9.845 2.715 510 HD23 LEU 79 2HD2 LEU 79 1.056 -10.999 1.451 511 H ILE 80 H ILE 80 -2.781 -7.227 1.124 512 HA ILE 80 HA ILE 80 -1.459 -6.740 -1.510 513 HB ILE 80 HB ILE 80 -3.791 -5.088 -0.535 514 HG13 ILE 80 2HG1 ILE 80 -4.614 -7.310 -1.260 515 HG21 ILE 80 1HG2 ILE 80 -1.915 -4.058 -2.046 516 HG22 ILE 80 2HG2 ILE 80 -2.497 -5.144 -3.297 517 HG23 ILE 80 3HG2 ILE 80 -3.581 -3.922 -2.618 518 HD11 ILE 80 3HD1 ILE 80 -5.104 -5.363 -3.547 519 HD12 ILE 80 1HD1 ILE 80 -6.075 -6.759 -3.096 520 HD13 ILE 80 2HD1 ILE 80 -5.986 -5.365 -1.997 521 H LEU 81 H LEU 81 0.543 -6.151 -0.803 522 HA LEU 81 HA LEU 81 0.948 -4.349 1.505 523 HB3 LEU 81 2HB LEU 81 3.302 -4.272 0.467 524 HG LEU 81 HG LEU 81 4.178 -6.337 1.140 525 HD11 LEU 81 1HD1 LEU 81 3.380 -4.767 2.951 526 HD12 LEU 81 2HD1 LEU 81 3.504 -6.465 3.443 527 HD13 LEU 81 3HD1 LEU 81 1.914 -5.783 3.082 528 HD21 LEU 81 3HD2 LEU 81 2.651 -7.869 0.118 529 HD22 LEU 81 1HD2 LEU 81 1.396 -7.463 1.329 530 HD23 LEU 81 2HD2 LEU 81 2.901 -8.267 1.821 531 H ILE 82 H ILE 82 1.258 -2.073 1.330 532 HA ILE 82 HA ILE 82 1.433 -0.982 -1.405 533 HB ILE 82 HB ILE 82 -0.187 0.054 0.894 534 HG13 ILE 82 2HG1 ILE 82 -0.778 -0.812 -1.976 535 HG21 ILE 82 1HG2 ILE 82 0.553 1.530 -1.658 536 HG22 ILE 82 2HG2 ILE 82 -0.713 2.009 -0.511 537 HG23 ILE 82 3HG2 ILE 82 0.962 2.006 0.014 538 HD11 ILE 82 3HD1 ILE 82 -1.921 -1.611 0.719 539 HD12 ILE 82 1HD1 ILE 82 -2.779 -1.900 -0.808 540 HD13 ILE 82 2HD1 ILE 82 -1.225 -2.644 -0.529 541 H GLY 83 H GLY 83 2.855 0.740 -1.786 542 HA2 GLY 83 1HA GLY 83 4.631 1.636 0.429 543 HA3 GLY 83 2HA GLY 83 5.293 1.122 -1.103 544 H SER 84 H SER 84 5.269 3.918 0.255 545 HA SER 84 HA SER 84 4.871 5.432 -2.148 546 HB3 SER 84 2HB SER 84 2.579 5.387 -1.762 547 HG SER 84 HG SER 84 2.885 4.676 0.572 548 HA PRO 85 HA PRO 85 7.750 7.831 0.269 549 HB3 PRO 85 2HB PRO 85 8.083 9.107 -1.679 550 HG3 PRO 85 2HG PRO 85 6.323 9.852 -3.061 551 HD3 PRO 85 2HD PRO 85 6.150 7.507 -2.862 552 H VAL 86 H VAL 86 7.705 8.455 2.418 553 HA VAL 86 HA VAL 86 5.396 9.935 3.493 554 HB VAL 86 HB VAL 86 8.133 9.386 4.712 555 HG11 VAL 86 1HG1 VAL 86 5.599 10.248 6.086 556 HG12 VAL 86 2HG1 VAL 86 7.142 9.848 6.847 557 HG13 VAL 86 3HG1 VAL 86 7.069 11.264 5.810 558 HG21 VAL 86 3HG2 VAL 86 6.912 7.263 4.439 559 HG22 VAL 86 1HG2 VAL 86 6.839 7.715 6.152 560 HG23 VAL 86 2HG2 VAL 86 5.442 8.001 5.123 561 H TRP 87 H TRP 87 5.445 12.280 3.727 562 HA TRP 87 HA TRP 87 7.676 13.714 2.399 563 HB3 TRP 87 2HB TRP 87 5.353 15.377 2.672 564 HD1 TRP 87 HD TRP 87 7.530 16.678 1.313 565 HE1 TRP 87 1HE TRP 87 7.960 16.834 -1.195 566 HE3 TRP 87 3HE TRP 87 4.806 12.632 -0.227 567 HZ2 TRP 87 2HZ TRP 87 7.319 15.338 -3.565 568 HZ3 TRP 87 3HZ TRP 87 4.615 12.123 -2.636 569 HH2 TRP 87 HH TRP 87 5.932 13.438 -4.307 570 H SER 88 H SER 88 6.969 16.338 3.549 571 HA SER 88 HA SER 88 8.460 16.110 6.007 572 HB3 SER 88 2HB SER 88 7.084 18.607 5.008 573 HG SER 88 HG SER 88 8.782 19.552 5.992 574 H GLY 89 H GLY 89 6.921 14.628 6.965 575 HA2 GLY 89 1HA GLY 89 5.803 14.388 8.993 576 HA3 GLY 89 2HA GLY 89 5.307 16.069 8.948 577 H TYR 90 H TYR 90 4.199 15.320 5.971 578 HA TYR 90 HA TYR 90 1.953 13.666 6.854 579 HB3 TYR 90 2HB TYR 90 0.308 15.176 6.120 580 HD1 TYR 90 2HD TYR 90 3.144 17.634 6.373 581 HD2 TYR 90 1HD TYR 90 -0.366 16.011 8.288 582 HE1 TYR 90 2HE TYR 90 3.468 19.191 8.251 583 HE2 TYR 90 1HE TYR 90 -0.034 17.553 10.189 584 HH TYR 90 HH TYR 90 1.888 18.704 11.270 585 HA PRO 91 HA PRO 91 3.236 12.245 2.772 586 HB3 PRO 91 2HB PRO 91 2.568 10.142 3.251 587 HG3 PRO 91 2HG PRO 91 0.944 9.742 4.877 588 HD3 PRO 91 2HD PRO 91 1.992 11.479 6.013 589 H ALA 92 H ALA 92 2.432 12.202 0.521 590 HA ALA 92 HA ALA 92 1.129 14.662 -0.166 591 HB1 ALA 92 1HB ALA 92 3.024 14.102 -1.374 592 HB2 ALA 92 2HB ALA 92 2.459 12.433 -1.711 593 HB3 ALA 92 3HB ALA 92 1.705 13.839 -2.493 594 H THR 93 H THR 93 -0.547 12.552 1.091 595 HA THR 93 HA THR 93 -2.124 10.924 0.853 596 HB THR 93 HB THR 93 -4.226 12.000 0.172 597 HG1 THR 93 1HG THR 93 -4.228 14.041 -0.576 598 HG21 THR 93 3HG2 THR 93 -4.175 13.684 1.890 599 HG22 THR 93 1HG2 THR 93 -2.440 13.968 1.679 600 HG23 THR 93 2HG2 THR 93 -3.019 12.443 2.386 601 HA PRO 94 HA PRO 94 -1.232 9.701 -3.599 602 HB3 PRO 94 2HB PRO 94 1.031 9.232 -3.352 603 HG3 PRO 94 2HG PRO 94 1.908 8.710 -1.190 604 HD3 PRO 94 2HD PRO 94 0.721 10.673 -1.063 605 H ILE 95 H ILE 95 -1.522 7.471 -0.829 606 HA ILE 95 HA ILE 95 -3.023 5.543 -2.362 607 HB ILE 95 HB ILE 95 -2.575 5.537 0.640 608 HG13 ILE 95 2HG1 ILE 95 -0.521 4.190 0.232 609 HG21 ILE 95 1HG2 ILE 95 -4.062 3.759 -0.336 610 HG22 ILE 95 2HG2 ILE 95 -2.758 3.242 -1.381 611 HG23 ILE 95 3HG2 ILE 95 -2.601 3.104 0.384 612 HD11 ILE 95 3HD1 ILE 95 -0.198 5.484 -2.515 613 HD12 ILE 95 1HD1 ILE 95 0.779 4.244 -1.772 614 HD13 ILE 95 2HD1 ILE 95 -0.829 3.838 -2.346 615 H LYS 96 H LYS 96 -4.097 8.529 -1.429 616 HA LYS 96 HA LYS 96 -6.535 7.949 -0.017 617 HB3 LYS 96 2HB LYS 96 -5.611 10.301 -1.717 618 HG3 LYS 96 2HG LYS 96 -7.993 10.525 -1.669 619 HD3 LYS 96 2HD LYS 96 -7.753 9.677 1.194 620 HE3 LYS 96 2HE LYS 96 -8.447 11.983 1.543 621 HZ1 LYS 96 3HZ LYS 96 -9.522 12.555 -0.475 622 HZ2 LYS 96 1HZ LYS 96 -10.585 12.706 0.736 623 HZ3 LYS 96 2HZ LYS 96 -10.702 11.403 -0.285 624 H THR 97 H THR 97 -5.839 8.704 -3.516 625 HA THR 97 HA THR 97 -8.448 8.253 -4.412 626 HB THR 97 HB THR 97 -6.264 7.511 -6.269 627 HG1 THR 97 1HG THR 97 -5.940 10.149 -5.873 628 HG21 THR 97 3HG2 THR 97 -8.203 9.855 -6.315 629 HG22 THR 97 1HG2 THR 97 -8.555 8.235 -6.939 630 HG23 THR 97 2HG2 THR 97 -7.264 9.203 -7.682 631 H LEU 98 H LEU 98 -5.660 6.037 -4.155 632 HA LEU 98 HA LEU 98 -6.781 3.938 -5.646 633 HB3 LEU 98 2HB LEU 98 -4.686 3.875 -3.431 634 HG LEU 98 HG LEU 98 -5.293 1.580 -4.119 635 HD11 LEU 98 1HD1 LEU 98 -6.134 1.933 -6.405 636 HD12 LEU 98 2HD1 LEU 98 -4.803 0.786 -6.409 637 HD13 LEU 98 3HD1 LEU 98 -4.520 2.456 -6.935 638 HD21 LEU 98 3HD2 LEU 98 -2.996 0.900 -4.752 639 HD22 LEU 98 1HD2 LEU 98 -2.975 2.154 -3.508 640 HD23 LEU 98 2HD2 LEU 98 -2.619 2.574 -5.201 641 H LEU 99 H LEU 99 -7.068 4.586 -2.065 642 HA LEU 99 HA LEU 99 -8.128 2.052 -1.463 643 HB3 LEU 99 2HB LEU 99 -7.029 4.117 -0.131 644 HG LEU 99 HG LEU 99 -9.644 5.133 -0.190 645 HD11 LEU 99 1HD1 LEU 99 -10.271 3.034 1.006 646 HD12 LEU 99 2HD1 LEU 99 -10.626 4.518 1.952 647 HD13 LEU 99 3HD1 LEU 99 -9.194 3.517 2.349 648 HD21 LEU 99 3HD2 LEU 99 -8.986 6.558 1.577 649 HD22 LEU 99 1HD2 LEU 99 -7.551 6.227 0.580 650 HD23 LEU 99 2HD2 LEU 99 -7.754 5.398 2.112 651 H ASP 100 H ASP 100 -9.583 5.003 -2.713 652 HA ASP 100 HA ASP 100 -12.313 4.403 -2.063 653 HB3 ASP 100 2HB ASP 100 -11.156 6.052 -4.349 654 H GLN 101 H GLN 101 -10.113 3.502 -4.678 655 HA GLN 101 HA GLN 101 -12.153 2.162 -6.301 656 HB3 GLN 101 2HB GLN 101 -10.213 1.350 -7.580 657 HG3 GLN 101 2HG GLN 101 -10.045 4.333 -6.946 658 HE21 GLN 101 1HE2 GLN 101 -9.506 5.607 -8.981 659 HE22 GLN 101 2HE2 GLN 101 -8.345 4.888 -10.079 660 H MET 102 H MET 102 -9.457 1.154 -4.110 661 HA MET 102 HA MET 102 -9.997 -1.630 -4.309 662 HB3 MET 102 2HB MET 102 -8.600 -1.780 -2.219 663 HG3 MET 102 2HG MET 102 -6.964 0.080 -3.751 664 HE1 MET 102 3HE MET 102 -4.603 -0.477 -3.652 665 HE2 MET 102 1HE MET 102 -5.219 -0.628 -1.994 666 HE3 MET 102 2HE MET 102 -4.044 -1.800 -2.616 667 H LYS 103 H LYS 103 -12.061 0.620 -2.753 668 HA LYS 103 HA LYS 103 -12.653 -0.425 -0.371 669 HB3 LYS 103 2HB LYS 103 -14.878 0.556 -2.029 670 HG3 LYS 103 2HG LYS 103 -14.970 0.573 0.446 671 HD3 LYS 103 2HD LYS 103 -12.637 2.442 0.121 672 HE3 LYS 103 2HE LYS 103 -14.377 3.965 0.889 673 HZ1 LYS 103 3HZ LYS 103 -14.796 2.110 3.172 674 HZ2 LYS 103 1HZ LYS 103 -15.888 2.495 1.968 675 HZ3 LYS 103 2HZ LYS 103 -15.438 3.607 3.030 676 H ASN 104 H ASN 104 -13.460 -2.087 -3.276 677 HA ASN 104 HA ASN 104 -15.606 -3.687 -2.117 678 HB3 ASN 104 2HB ASN 104 -16.002 -4.071 -4.255 679 HD21 ASN 104 1HD2 ASN 104 -12.671 -4.558 -5.408 680 HD22 ASN 104 2HD2 ASN 104 -12.728 -3.194 -6.504 681 H TYR 105 H TYR 105 -12.117 -3.769 -1.884 682 HA TYR 105 HA TYR 105 -11.899 -6.688 -1.737 683 HB3 TYR 105 2HB TYR 105 -10.026 -4.312 -1.203 684 HD1 TYR 105 2HD TYR 105 -9.051 -5.017 0.926 685 HD2 TYR 105 1HD TYR 105 -8.920 -7.543 -2.557 686 HE1 TYR 105 2HE TYR 105 -7.256 -6.364 1.961 687 HE2 TYR 105 1HE TYR 105 -7.046 -8.820 -1.561 688 HH TYR 105 HH TYR 105 -5.450 -7.864 1.483 689 H ARG 106 H ARG 106 -11.194 -7.893 -0.093 690 HA ARG 106 HA ARG 106 -11.368 -7.015 2.680 691 HB3 ARG 106 2HB ARG 106 -12.664 -9.169 3.078 692 HG3 ARG 106 2HG ARG 106 -14.789 -8.407 1.631 693 HD3 ARG 106 2HD ARG 106 -13.639 -6.605 3.839 694 HE ARG 106 HE ARG 106 -16.149 -6.509 2.596 695 HH11 ARG 106 1HH1 ARG 106 -14.851 -6.498 5.943 696 HH12 ARG 106 2HH1 ARG 106 -16.372 -6.096 6.636 697 HH21 ARG 106 1HH2 ARG 106 -18.147 -5.936 3.591 698 HH22 ARG 106 2HH2 ARG 106 -18.193 -5.601 5.292 699 H GLY 107 H GLY 107 -9.787 -8.299 3.856 700 HA2 GLY 107 1HA GLY 107 -8.250 -10.345 3.635 701 HA3 GLY 107 2HA GLY 107 -7.767 -9.578 2.114 702 H GLU 108 H GLU 108 -5.622 -9.637 3.484 703 HA GLU 108 HA GLU 108 -5.461 -7.526 5.551 704 HB3 GLU 108 2HB GLU 108 -3.064 -8.323 5.668 705 HG3 GLU 108 2HG GLU 108 -5.161 -10.498 6.064 706 H VAL 109 H VAL 109 -4.254 -5.599 5.364 707 HA VAL 109 HA VAL 109 -3.000 -5.046 2.763 708 HB VAL 109 HB VAL 109 -4.925 -3.206 4.257 709 HG11 VAL 109 1HG1 VAL 109 -4.822 -1.832 2.236 710 HG12 VAL 109 2HG1 VAL 109 -3.165 -2.141 2.767 711 HG13 VAL 109 3HG1 VAL 109 -3.823 -3.056 1.406 712 HG21 VAL 109 3HG2 VAL 109 -6.326 -4.940 3.400 713 HG22 VAL 109 1HG2 VAL 109 -6.507 -3.538 2.347 714 HG23 VAL 109 2HG2 VAL 109 -5.501 -4.899 1.813 715 H ALA 110 H ALA 110 -1.035 -3.877 3.082 716 HA ALA 110 HA ALA 110 -0.649 -2.611 5.767 717 HB1 ALA 110 1HB ALA 110 1.496 -3.447 6.090 718 HB2 ALA 110 2HB ALA 110 0.575 -4.851 5.566 719 HB3 ALA 110 3HB ALA 110 1.641 -4.009 4.418 720 H SER 111 H SER 111 1.414 -1.171 5.661 721 HA SER 111 HA SER 111 1.711 0.154 3.057 722 HB3 SER 111 2HB SER 111 0.695 1.663 5.475 723 HG SER 111 HG SER 111 0.186 3.173 3.836 724 H PHE 112 H PHE 112 3.925 -0.225 2.982 725 HA PHE 112 HA PHE 112 5.599 0.611 5.312 726 HB3 PHE 112 2HB PHE 112 6.359 -1.470 4.780 727 HD1 PHE 112 1HD PHE 112 5.987 0.106 1.335 728 HD2 PHE 112 2HD PHE 112 6.053 -3.522 3.666 729 HE1 PHE 112 1HE PHE 112 5.576 -1.223 -0.698 730 HE2 PHE 112 2HE PHE 112 5.652 -4.810 1.641 731 HZ PHE 112 HZ PHE 112 5.495 -3.683 -0.565 732 H PHE 113 H PHE 113 7.695 1.815 4.570 733 HA PHE 113 HA PHE 113 7.868 3.250 2.194 734 HB3 PHE 113 2HB PHE 113 6.004 4.350 2.384 735 HD1 PHE 113 1HD PHE 113 6.573 3.678 5.937 736 HD2 PHE 113 2HD PHE 113 4.457 6.141 3.052 737 HE1 PHE 113 1HE PHE 113 4.865 4.115 7.546 738 HE2 PHE 113 2HE PHE 113 2.670 6.506 4.721 739 HZ PHE 113 HZ PHE 113 2.811 5.446 6.933 740 H THR 114 H THR 114 9.047 5.680 2.807 741 HA THR 114 HA THR 114 11.082 5.041 4.837 742 HB THR 114 HB THR 114 12.874 5.831 3.342 743 HG1 THR 114 1HG THR 114 11.948 7.092 1.848 744 HG21 THR 114 3HG2 THR 114 11.337 3.606 1.904 745 HG22 THR 114 1HG2 THR 114 12.293 3.362 3.389 746 HG23 THR 114 2HG2 THR 114 13.083 3.920 1.904 747 H SER 115 H SER 115 12.306 7.191 5.443 748 HA SER 115 HA SER 115 10.762 9.617 4.944 749 HB3 SER 115 2HB SER 115 9.811 9.932 7.037 750 HG SER 115 HG SER 115 9.024 7.901 6.036 751 H ALA 116 H ALA 116 11.580 11.319 6.811 752 HA ALA 116 HA ALA 116 14.422 11.692 6.332 753 HB1 ALA 116 1HB ALA 116 12.239 13.427 7.583 754 HB2 ALA 116 2HB ALA 116 13.866 13.967 7.093 755 HB3 ALA 116 3HB ALA 116 12.701 13.436 5.871 756 H GLY 117 H GLY 117 13.482 9.604 8.305 757 HA2 GLY 117 1HA GLY 117 14.171 8.881 10.409 758 HA3 GLY 117 2HA GLY 117 15.331 10.198 10.233 759 H THR 118 H THR 118 11.981 11.092 10.288 760 HA THR 118 HA THR 118 11.870 11.921 13.108 761 HB THR 118 HB THR 118 11.050 14.200 11.966 762 HG1 THR 118 1HG THR 118 13.076 13.387 10.139 763 HG21 THR 118 3HG2 THR 118 12.893 14.075 13.572 764 HG22 THR 118 1HG2 THR 118 13.251 15.205 12.256 765 HG23 THR 118 2HG2 THR 118 14.007 13.601 12.269 766 H ASN 119 H ASN 119 9.456 13.015 13.275 767 HA ASN 119 HA ASN 119 7.271 13.089 12.854 768 HB3 ASN 119 2HB ASN 119 6.532 13.013 10.468 769 HD21 ASN 119 1HD2 ASN 119 8.907 14.500 8.957 770 HD22 ASN 119 2HD2 ASN 119 8.722 16.085 9.632 771 H HIS 120 H HIS 120 8.374 10.501 13.695 772 HA HIS 120 HA HIS 120 7.156 8.378 12.336 773 HB3 HIS 120 2HB HIS 120 8.991 8.192 14.041 774 HD1 HIS 120 1HD HIS 120 6.649 6.945 16.593 775 HD2 HIS 120 2HD HIS 120 8.895 10.441 15.873 776 HE1 HIS 120 1HE HIS 120 6.563 8.327 18.756 777 H LYS 121 H LYS 121 5.912 10.114 15.238 778 HA LYS 121 HA LYS 121 3.524 8.563 15.363 779 HB3 LYS 121 2HB LYS 121 3.077 11.207 16.453 780 HG3 LYS 121 2HG LYS 121 3.526 10.087 18.638 781 HD3 LYS 121 2HD LYS 121 1.712 8.309 16.978 782 HE3 LYS 121 2HE LYS 121 0.266 8.587 19.022 783 HZ1 LYS 121 3HZ LYS 121 1.722 6.654 18.889 784 HZ2 LYS 121 1HZ LYS 121 1.511 7.157 20.451 785 HZ3 LYS 121 2HZ LYS 121 2.925 7.449 19.674 786 H ALA 122 H ALA 122 4.219 11.624 13.788 787 HA ALA 122 HA ALA 122 1.682 12.302 12.846 788 HB1 ALA 122 1HB ALA 122 4.375 12.875 11.536 789 HB2 ALA 122 2HB ALA 122 2.851 13.739 11.279 790 HB3 ALA 122 3HB ALA 122 3.638 13.820 12.856 791 H TYR 123 H TYR 123 4.289 10.467 10.970 792 HA TYR 123 HA TYR 123 2.813 10.119 8.644 793 HB3 TYR 123 2HB TYR 123 5.260 9.451 9.443 794 HD1 TYR 123 2HD TYR 123 3.074 6.426 8.780 795 HD2 TYR 123 1HD TYR 123 6.688 8.021 10.395 796 HE1 TYR 123 2HE TYR 123 3.590 4.219 9.745 797 HE2 TYR 123 1HE TYR 123 7.293 5.790 11.312 798 HH TYR 123 HH TYR 123 5.062 2.956 10.929 799 H VAL 124 H VAL 124 2.713 8.149 11.650 800 HA VAL 124 HA VAL 124 1.122 6.082 10.618 801 HB VAL 124 HB VAL 124 1.451 7.111 13.461 802 HG11 VAL 124 1HG1 VAL 124 -0.493 5.541 13.301 803 HG12 VAL 124 2HG1 VAL 124 0.589 4.307 12.608 804 HG13 VAL 124 3HG1 VAL 124 0.839 4.885 14.257 805 HG21 VAL 124 3HG2 VAL 124 3.213 5.531 13.732 806 HG22 VAL 124 1HG2 VAL 124 2.872 4.768 12.171 807 HG23 VAL 124 2HG2 VAL 124 3.574 6.388 12.228 808 H SER 125 H SER 125 0.057 9.018 12.537 809 HA SER 125 HA SER 125 -2.734 8.416 12.138 810 HB3 SER 125 2HB SER 125 -2.922 10.978 12.655 811 HG SER 125 HG SER 125 -3.398 9.829 14.308 812 H HIS 126 H HIS 126 -0.414 10.344 10.192 813 HA HIS 126 HA HIS 126 -2.545 11.365 8.495 814 HB3 HIS 126 2HB HIS 126 -0.794 12.499 7.341 815 HD1 HIS 126 1HD HIS 126 1.558 13.849 9.186 816 HD2 HIS 126 2HD HIS 126 -2.386 12.863 10.335 817 HE1 HIS 126 1HE HIS 126 0.976 15.325 11.147 818 H PHE 127 H PHE 127 -0.789 8.412 8.490 819 HA PHE 127 HA PHE 127 -1.637 7.797 5.733 820 HB3 PHE 127 2HB PHE 127 -0.561 6.033 7.941 821 HD1 PHE 127 1HD PHE 127 -0.955 5.974 4.134 822 HD2 PHE 127 2HD PHE 127 -1.734 4.001 7.907 823 HE1 PHE 127 1HE PHE 127 -1.949 4.065 2.944 824 HE2 PHE 127 2HE PHE 127 -2.670 2.057 6.674 825 HZ PHE 127 HZ PHE 127 -2.796 2.100 4.219 826 H ASN 128 H ASN 128 -2.570 6.910 9.085 827 HA ASN 128 HA ASN 128 -4.781 5.326 8.570 828 HB3 ASN 128 2HB ASN 128 -5.750 6.379 10.771 829 HD21 ASN 128 1HD2 ASN 128 -2.216 5.647 10.939 830 HD22 ASN 128 2HD2 ASN 128 -2.444 4.070 11.609 831 H GLU 129 H GLU 129 -4.901 8.889 9.028 832 HA GLU 129 HA GLU 129 -7.626 9.290 8.724 833 HB3 GLU 129 2HB GLU 129 -6.464 11.513 7.478 834 HG3 GLU 129 2HG GLU 129 -5.957 11.935 10.196 835 H TRP 130 H TRP 130 -5.407 8.451 6.164 836 HA TRP 130 HA TRP 130 -7.536 8.881 4.126 837 HB3 TRP 130 2HB TRP 130 -5.876 9.541 2.552 838 HD1 TRP 130 HD TRP 130 -3.379 11.130 4.505 839 HE1 TRP 130 1HE TRP 130 -3.953 13.447 5.312 840 HE3 TRP 130 3HE TRP 130 -8.447 10.995 3.754 841 HZ2 TRP 130 2HZ TRP 130 -6.335 15.089 5.597 842 HZ3 TRP 130 3HZ TRP 130 -9.825 12.999 4.235 843 HH2 TRP 130 HH TRP 130 -8.781 15.044 5.173 844 H ALA 131 H ALA 131 -6.922 6.549 5.872 845 HA ALA 131 HA ALA 131 -7.003 4.518 3.759 846 HB1 ALA 131 1HB ALA 131 -5.417 3.092 4.774 847 HB2 ALA 131 2HB ALA 131 -4.622 4.640 4.438 848 HB3 ALA 131 3HB ALA 131 -5.116 4.244 6.105 849 H ASP 132 H ASP 132 -8.728 5.911 5.992 850 HA ASP 132 HA ASP 132 -9.135 3.855 8.003 851 HB3 ASP 132 2HB ASP 132 -10.855 6.292 7.633 852 H GLY 133 H GLY 133 -9.600 2.500 6.023 853 HA2 GLY 133 1HA GLY 133 -12.478 1.972 5.776 854 HA3 GLY 133 2HA GLY 133 -11.774 2.665 4.325 855 H LEU 134 H LEU 134 -9.288 0.714 5.501 856 HA LEU 134 HA LEU 134 -10.396 -1.825 4.538 857 HB3 LEU 134 2HB LEU 134 -8.105 -2.210 3.401 858 HG LEU 134 HG LEU 134 -8.618 -1.600 1.258 859 HD11 LEU 134 1HD1 LEU 134 -10.162 -3.286 2.249 860 HD12 LEU 134 2HD1 LEU 134 -10.827 -2.426 0.853 861 HD13 LEU 134 3HD1 LEU 134 -11.361 -2.001 2.487 862 HD21 LEU 134 3HD2 LEU 134 -9.110 0.852 1.724 863 HD22 LEU 134 1HD2 LEU 134 -10.779 0.361 2.020 864 HD23 LEU 134 2HD2 LEU 134 -10.067 0.066 0.439 865 H ASN 135 H ASN 135 -9.022 -3.626 5.265 866 HA ASN 135 HA ASN 135 -8.291 -3.266 7.993 867 HB3 ASN 135 2HB ASN 135 -7.980 -5.611 6.131 868 HD21 ASN 135 1HD2 ASN 135 -6.959 -7.368 6.911 869 HD22 ASN 135 2HD2 ASN 135 -6.625 -7.668 8.619 870 H VAL 136 H VAL 136 -6.598 -1.774 8.026 871 HA VAL 136 HA VAL 136 -3.967 -2.298 7.013 872 HB VAL 136 HB VAL 136 -4.776 -0.725 9.486 873 HG11 VAL 136 1HG1 VAL 136 -2.680 0.522 9.097 874 HG12 VAL 136 2HG1 VAL 136 -2.364 -1.173 9.451 875 HG13 VAL 136 3HG1 VAL 136 -2.249 -0.586 7.774 876 HG21 VAL 136 3HG2 VAL 136 -4.417 0.121 6.590 877 HG22 VAL 136 1HG2 VAL 136 -5.942 0.170 7.502 878 HG23 VAL 136 2HG2 VAL 136 -4.621 1.258 7.926 879 H ILE 137 H ILE 137 -2.554 -3.890 7.650 880 HA ILE 137 HA ILE 137 -2.974 -5.185 10.264 881 HB ILE 137 HB ILE 137 -1.409 -6.850 9.515 882 HG13 ILE 137 2HG1 ILE 137 0.030 -5.404 8.060 883 HG21 ILE 137 1HG2 ILE 137 -2.880 -7.858 7.903 884 HG22 ILE 137 2HG2 ILE 137 -3.885 -6.931 8.997 885 HG23 ILE 137 3HG2 ILE 137 -3.532 -6.287 7.381 886 HD11 ILE 137 3HD1 ILE 137 0.103 -7.852 7.742 887 HD12 ILE 137 1HD1 ILE 137 -1.123 -7.707 6.461 888 HD13 ILE 137 2HD1 ILE 137 0.449 -6.947 6.264 889 H GLY 138 H GLY 138 -0.649 -2.989 8.672 890 HA2 GLY 138 1HA GLY 138 0.446 -2.072 11.102 891 HA3 GLY 138 2HA GLY 138 1.498 -3.335 10.442 892 H VAL 139 H VAL 139 2.075 -0.505 10.750 893 HA VAL 139 HA VAL 139 2.769 0.144 7.951 894 HB VAL 139 HB VAL 139 1.553 2.097 9.931 895 HG11 VAL 139 1HG1 VAL 139 1.825 2.676 6.976 896 HG12 VAL 139 2HG1 VAL 139 1.732 3.789 8.346 897 HG13 VAL 139 3HG1 VAL 139 3.217 2.866 8.007 898 HG21 VAL 139 3HG2 VAL 139 0.304 0.706 7.535 899 HG22 VAL 139 1HG2 VAL 139 -0.257 0.699 9.223 900 HG23 VAL 139 2HG2 VAL 139 -0.376 2.164 8.249 901 H ALA 140 H ALA 140 4.901 -0.276 8.213 902 HA ALA 140 HA ALA 140 6.409 1.282 10.245 903 HB1 ALA 140 1HB ALA 140 6.235 -1.116 10.955 904 HB2 ALA 140 2HB ALA 140 7.046 -1.582 9.446 905 HB3 ALA 140 3HB ALA 140 7.895 -0.594 10.629 906 H ARG 141 H ARG 141 8.392 2.124 9.476 907 HA ARG 141 HA ARG 141 8.635 2.283 6.574 908 HB3 ARG 141 2HB ARG 141 10.787 3.478 7.120 909 HG3 ARG 141 2HG ARG 141 8.094 4.351 7.896 910 HD3 ARG 141 2HD ARG 141 9.294 4.702 10.066 911 HE ARG 141 HE ARG 141 11.079 6.332 8.333 912 HH11 ARG 141 1HH1 ARG 141 10.321 5.287 11.691 913 HH12 ARG 141 2HH1 ARG 141 11.833 5.791 12.310 914 HH21 ARG 141 1HH2 ARG 141 13.088 6.869 9.189 915 HH22 ARG 141 2HH2 ARG 141 13.407 6.800 10.897 916 H ASP 142 H ASP 142 10.488 1.625 5.474 917 HA ASP 142 HA ASP 142 11.973 0.139 4.673 918 HB3 ASP 142 2HB ASP 142 13.675 -0.802 6.214 919 H ASP 143 H ASP 143 12.886 -2.385 5.511 920 HA ASP 143 HA ASP 143 10.490 -4.041 5.042 921 HB3 ASP 143 2HB ASP 143 12.496 -4.252 3.602 922 H SER 144 H SER 144 11.722 -2.885 7.915 923 HA SER 144 HA SER 144 12.575 -5.203 9.193 924 HB3 SER 144 2HB SER 144 11.573 -3.268 11.069 925 HG SER 144 HG SER 144 13.767 -3.096 11.471 926 H GLU 145 H GLU 145 9.227 -4.290 8.639 927 HA GLU 145 HA GLU 145 8.388 -6.443 10.528 928 HB3 GLU 145 2HB GLU 145 6.180 -5.359 10.585 929 HG3 GLU 145 2HG GLU 145 8.339 -3.423 11.504 930 H VAL 146 H VAL 146 9.077 -6.249 7.286 931 HA VAL 146 HA VAL 146 6.628 -7.236 6.216 932 HB VAL 146 HB VAL 146 8.563 -6.387 4.906 933 HG11 VAL 146 1HG1 VAL 146 10.369 -7.739 4.240 934 HG12 VAL 146 2HG1 VAL 146 10.333 -7.873 6.000 935 HG13 VAL 146 3HG1 VAL 146 9.692 -9.195 5.018 936 HG21 VAL 146 3HG2 VAL 146 7.287 -9.043 4.186 937 HG22 VAL 146 1HG2 VAL 146 6.700 -7.413 3.791 938 HG23 VAL 146 2HG2 VAL 146 8.197 -8.055 3.053 939 H ASP 147 H ASP 147 8.951 -8.753 8.272 940 HA ASP 147 HA ASP 147 8.377 -11.471 7.656 941 HB3 ASP 147 2HB ASP 147 9.276 -10.727 10.420 942 H LYS 148 H LYS 148 6.293 -9.305 9.127 943 HA LYS 148 HA LYS 148 4.791 -11.540 10.450 944 HB3 LYS 148 2HB LYS 148 5.282 -9.859 12.093 945 HG3 LYS 148 2HG LYS 148 4.301 -7.875 10.071 946 HD3 LYS 148 2HD LYS 148 3.245 -7.502 12.403 947 HE3 LYS 148 2HE LYS 148 6.214 -6.947 12.852 948 HZ1 LYS 148 3HZ LYS 148 5.664 -5.875 14.801 949 HZ2 LYS 148 1HZ LYS 148 4.021 -6.206 14.649 950 HZ3 LYS 148 2HZ LYS 148 4.821 -5.148 13.623 951 H TRP 149 H TRP 149 4.883 -9.279 7.822 952 HA TRP 149 HA TRP 149 1.988 -9.071 7.690 953 HB3 TRP 149 2HB TRP 149 2.547 -7.639 5.678 954 HD1 TRP 149 HD TRP 149 2.027 -7.313 9.005 955 HE1 TRP 149 1HE TRP 149 2.831 -5.174 10.142 956 HE3 TRP 149 3HE TRP 149 5.254 -5.620 5.424 957 HZ2 TRP 149 2HZ TRP 149 4.261 -2.777 9.390 958 HZ3 TRP 149 3HZ TRP 149 6.392 -3.437 5.714 959 HH2 TRP 149 HH TRP 149 5.815 -1.956 7.600 960 H SER 150 H SER 150 3.871 -11.670 6.624 961 HA SER 150 HA SER 150 1.732 -12.404 4.737 962 HB3 SER 150 2HB SER 150 4.690 -12.488 3.992 963 HG SER 150 HG SER 150 2.339 -13.423 2.860 964 H LYS 151 H LYS 151 1.809 -13.432 7.235 965 HA LYS 151 HA LYS 151 3.308 -16.025 7.032 966 HB3 LYS 151 2HB LYS 151 2.788 -15.934 9.607 967 HG3 LYS 151 2HG LYS 151 5.009 -14.454 8.134 968 HD3 LYS 151 2HD LYS 151 4.954 -13.688 10.434 969 HE3 LYS 151 2HE LYS 151 5.182 -16.620 11.218 970 HZ1 LYS 151 3HZ LYS 151 6.303 -15.096 12.768 971 HZ2 LYS 151 1HZ LYS 151 4.923 -15.735 13.418 972 HZ3 LYS 151 2HZ LYS 151 4.921 -14.199 12.888 Start of MODEL 8 1 H1 GLY 1 H GLY 1 -3.934 -23.700 -8.093 2 HA2 GLY 1 1HA GLY 1 -2.841 -22.646 -6.199 3 HA3 GLY 1 2HA GLY 1 -3.457 -21.087 -6.796 4 H MET 2 H MET 2 -4.721 -20.591 -5.001 5 HA MET 2 HA MET 2 -7.335 -21.464 -5.395 6 HB3 MET 2 2HB MET 2 -6.370 -22.048 -2.560 7 HG3 MET 2 2HG MET 2 -9.013 -22.477 -3.993 8 HE1 MET 2 3HE MET 2 -11.183 -24.161 -1.444 9 HE2 MET 2 1HE MET 2 -11.135 -22.614 -2.326 10 HE3 MET 2 2HE MET 2 -10.764 -24.130 -3.172 11 H ALA 3 H ALA 3 -6.117 -20.115 -2.278 12 HA ALA 3 HA ALA 3 -6.852 -17.388 -3.194 13 HB1 ALA 3 1HB ALA 3 -8.361 -17.185 -1.256 14 HB2 ALA 3 2HB ALA 3 -8.892 -18.481 -2.340 15 HB3 ALA 3 3HB ALA 3 -8.055 -18.881 -0.821 16 H LYS 4 H LYS 4 -4.314 -17.578 -3.023 17 HA LYS 4 HA LYS 4 -3.758 -16.036 -0.674 18 HB3 LYS 4 2HB LYS 4 -3.335 -18.179 0.329 19 HG3 LYS 4 2HG LYS 4 -1.377 -19.438 0.045 20 HD3 LYS 4 2HD LYS 4 -3.367 -20.116 -1.526 21 HE3 LYS 4 2HE LYS 4 -2.867 -18.748 -3.492 22 HZ1 LYS 4 3HZ LYS 4 -0.818 -19.027 -4.692 23 HZ2 LYS 4 1HZ LYS 4 -0.175 -19.967 -3.517 24 HZ3 LYS 4 2HZ LYS 4 -0.557 -18.376 -3.228 25 H LYS 5 H LYS 5 -3.511 -14.361 -2.195 26 HA LYS 5 HA LYS 5 -0.874 -14.458 -3.582 27 HB3 LYS 5 2HB LYS 5 -2.040 -12.941 -5.320 28 HG3 LYS 5 2HG LYS 5 -3.401 -14.885 -6.252 29 HD3 LYS 5 2HD LYS 5 -1.305 -16.309 -6.637 30 HE3 LYS 5 2HE LYS 5 -1.090 -13.352 -7.299 31 HZ1 LYS 5 3HZ LYS 5 0.895 -14.473 -7.888 32 HZ2 LYS 5 1HZ LYS 5 0.025 -14.326 -9.266 33 HZ3 LYS 5 2HZ LYS 5 0.076 -15.783 -8.512 34 H THR 6 H THR 6 0.057 -12.587 -3.914 35 HA THR 6 HA THR 6 -0.559 -10.498 -1.885 36 HB THR 6 HB THR 6 2.070 -11.982 -2.146 37 HG1 THR 6 1HG THR 6 1.283 -12.783 -0.063 38 HG21 THR 6 3HG2 THR 6 1.062 -9.721 -0.369 39 HG22 THR 6 1HG2 THR 6 2.603 -9.854 -1.252 40 HG23 THR 6 2HG2 THR 6 2.305 -10.826 0.198 41 H LEU 7 H LEU 7 -0.964 -8.743 -3.123 42 HA LEU 7 HA LEU 7 0.879 -8.112 -5.403 43 HB3 LEU 7 2HB LEU 7 -1.745 -6.878 -4.486 44 HG LEU 7 HG LEU 7 -0.605 -5.328 -5.911 45 HD11 LEU 7 1HD1 LEU 7 0.016 -5.895 -8.292 46 HD12 LEU 7 2HD1 LEU 7 -0.284 -7.609 -7.937 47 HD13 LEU 7 3HD1 LEU 7 1.041 -6.728 -7.136 48 HD21 LEU 7 3HD2 LEU 7 -2.950 -5.577 -6.234 49 HD22 LEU 7 1HD2 LEU 7 -2.751 -6.948 -7.350 50 HD23 LEU 7 2HD2 LEU 7 -2.237 -5.328 -7.845 51 H ILE 8 H ILE 8 2.174 -6.208 -5.464 52 HA ILE 8 HA ILE 8 2.314 -4.577 -2.977 53 HB ILE 8 HB ILE 8 4.492 -5.509 -4.890 54 HG13 ILE 8 2HG1 ILE 8 3.459 -7.340 -3.343 55 HG21 ILE 8 1HG2 ILE 8 4.681 -4.119 -2.196 56 HG22 ILE 8 2HG2 ILE 8 6.055 -4.600 -3.208 57 HG23 ILE 8 3HG2 ILE 8 4.978 -3.328 -3.759 58 HD11 ILE 8 3HD1 ILE 8 5.570 -8.335 -2.758 59 HD12 ILE 8 1HD1 ILE 8 5.637 -7.666 -4.402 60 HD13 ILE 8 2HD1 ILE 8 6.424 -6.814 -3.049 61 H LEU 9 H LEU 9 1.667 -2.476 -3.350 62 HA LEU 9 HA LEU 9 2.018 -1.276 -6.073 63 HB3 LEU 9 2HB LEU 9 -0.030 -0.094 -5.756 64 HG LEU 9 HG LEU 9 -1.776 -1.599 -5.767 65 HD11 LEU 9 1HD1 LEU 9 -0.096 -1.970 -7.573 66 HD12 LEU 9 2HD1 LEU 9 -1.195 -3.325 -7.261 67 HD13 LEU 9 3HD1 LEU 9 0.479 -3.386 -6.675 68 HD21 LEU 9 3HD2 LEU 9 -0.225 -3.757 -4.333 69 HD22 LEU 9 1HD2 LEU 9 -1.951 -3.697 -4.749 70 HD23 LEU 9 2HD2 LEU 9 -1.278 -2.591 -3.542 71 H TYR 10 H TYR 10 3.864 0.161 -5.735 72 HA TYR 10 HA TYR 10 3.701 1.898 -3.292 73 HB3 TYR 10 2HB TYR 10 6.139 1.840 -3.203 74 HD1 TYR 10 2HD TYR 10 3.589 -0.147 -2.135 75 HD2 TYR 10 1HD TYR 10 7.807 -0.439 -2.966 76 HE1 TYR 10 2HE TYR 10 3.778 -1.939 -0.493 77 HE2 TYR 10 1HE TYR 10 7.972 -2.271 -1.327 78 HH TYR 10 HH TYR 10 6.525 -3.938 -0.235 79 H TYR 11 H TYR 11 4.634 4.003 -3.515 80 HA TYR 11 HA TYR 11 4.783 5.048 -6.308 81 HB3 TYR 11 2HB TYR 11 4.238 6.436 -3.667 82 HD1 TYR 11 1HD TYR 11 4.536 7.168 -7.413 83 HD2 TYR 11 2HD TYR 11 5.051 8.620 -3.413 84 HE1 TYR 11 1HE TYR 11 5.560 9.241 -8.302 85 HE2 TYR 11 2HE TYR 11 6.128 10.670 -4.284 86 HH TYR 11 HH TYR 11 6.322 11.457 -7.730 87 H SER 12 H SER 12 6.860 5.085 -7.028 88 HA SER 12 HA SER 12 9.228 5.237 -5.390 89 HB3 SER 12 2HB SER 12 9.282 4.090 -7.496 90 HG SER 12 HG SER 12 8.220 6.531 -8.457 91 H TRP 13 H TRP 13 9.583 7.131 -4.193 92 HA TRP 13 HA TRP 13 8.439 9.635 -4.836 93 HB3 TRP 13 2HB TRP 13 10.972 9.111 -3.226 94 HD1 TRP 13 HD TRP 13 7.967 11.414 -2.477 95 HE1 TRP 13 1HE TRP 13 8.727 13.761 -2.090 96 HE3 TRP 13 3HE TRP 13 12.907 10.839 -3.740 97 HZ2 TRP 13 2HZ TRP 13 11.131 15.336 -2.537 98 HZ3 TRP 13 3HZ TRP 13 14.398 12.820 -3.755 99 HH2 TRP 13 HH TRP 13 13.511 15.069 -3.205 100 H SER 14 H SER 14 11.890 8.726 -5.251 101 HA SER 14 HA SER 14 11.833 9.692 -7.992 102 HB3 SER 14 2HB SER 14 13.843 10.936 -6.071 103 HG SER 14 HG SER 14 13.741 12.428 -8.028 104 H GLY 15 H GLY 15 11.859 7.324 -7.922 105 HA2 GLY 15 1HA GLY 15 12.911 5.409 -8.506 106 HA3 GLY 15 2HA GLY 15 14.450 6.247 -8.452 107 H GLU 16 H GLU 16 13.855 6.938 -5.555 108 HA GLU 16 HA GLU 16 15.442 5.048 -4.379 109 HB3 GLU 16 2HB GLU 16 14.774 6.150 -2.266 110 HG3 GLU 16 2HG GLU 16 14.702 8.517 -4.054 111 H THR 17 H THR 17 11.934 5.415 -3.680 112 HA THR 17 HA THR 17 11.648 3.228 -2.065 113 HB THR 17 HB THR 17 9.395 4.060 -3.840 114 HG1 THR 17 1HG THR 17 9.451 5.953 -2.140 115 HG21 THR 17 3HG2 THR 17 8.544 2.808 -2.098 116 HG22 THR 17 1HG2 THR 17 8.319 4.471 -1.475 117 HG23 THR 17 2HG2 THR 17 9.673 3.490 -0.905 118 H LYS 18 H LYS 18 12.379 2.956 -5.352 119 HA LYS 18 HA LYS 18 10.900 0.501 -5.983 120 HB3 LYS 18 2HB LYS 18 13.325 1.896 -7.202 121 HG3 LYS 18 2HG LYS 18 11.694 -0.408 -8.340 122 HD3 LYS 18 2HD LYS 18 12.485 1.329 -9.992 123 HE3 LYS 18 2HE LYS 18 15.244 0.255 -9.221 124 HZ1 LYS 18 3HZ LYS 18 15.987 1.923 -10.808 125 HZ2 LYS 18 1HZ LYS 18 14.455 2.427 -11.053 126 HZ3 LYS 18 2HZ LYS 18 14.942 0.906 -11.530 127 H LYS 19 H LYS 19 14.122 1.348 -4.573 128 HA LYS 19 HA LYS 19 15.095 -1.378 -4.742 129 HB3 LYS 19 2HB LYS 19 16.602 -0.428 -2.747 130 HG3 LYS 19 2HG LYS 19 17.967 0.938 -4.369 131 HD3 LYS 19 2HD LYS 19 17.949 -1.721 -4.061 132 HE3 LYS 19 2HE LYS 19 17.630 -1.453 -7.081 133 HZ1 LYS 19 3HZ LYS 19 17.562 -3.770 -5.246 134 HZ2 LYS 19 1HZ LYS 19 18.796 -3.395 -6.278 135 HZ3 LYS 19 2HZ LYS 19 17.322 -3.854 -6.862 136 H MET 20 H MET 20 13.488 0.467 -2.152 137 HA MET 20 HA MET 20 12.943 -2.040 -0.684 138 HB3 MET 20 2HB MET 20 11.610 0.600 -0.044 139 HG3 MET 20 2HG MET 20 11.227 -1.464 1.331 140 HE1 MET 20 3HE MET 20 14.355 -0.079 3.118 141 HE2 MET 20 1HE MET 20 15.631 -1.254 2.721 142 HE3 MET 20 2HE MET 20 14.958 -0.206 1.459 143 H ALA 21 H ALA 21 12.264 -2.643 -2.894 144 HA ALA 21 HA ALA 21 9.472 -3.230 -2.555 145 HB1 ALA 21 1HB ALA 21 9.529 -1.140 -4.152 146 HB2 ALA 21 2HB ALA 21 10.125 -2.263 -5.371 147 HB3 ALA 21 3HB ALA 21 8.545 -2.529 -4.615 148 H GLU 22 H GLU 22 11.982 -3.439 -5.114 149 HA GLU 22 HA GLU 22 11.286 -6.095 -5.864 150 HB3 GLU 22 2HB GLU 22 12.364 -4.931 -7.513 151 HG3 GLU 22 2HG GLU 22 14.439 -4.123 -5.479 152 H LYS 23 H LYS 23 13.481 -5.027 -3.325 153 HA LYS 23 HA LYS 23 14.711 -7.537 -2.724 154 HB3 LYS 23 2HB LYS 23 13.933 -5.119 -1.071 155 HG3 LYS 23 2HG LYS 23 13.680 -6.876 0.590 156 HD3 LYS 23 2HD LYS 23 16.516 -7.785 -0.027 157 HE3 LYS 23 2HE LYS 23 14.380 -8.833 1.903 158 HZ1 LYS 23 3HZ LYS 23 17.246 -9.529 1.604 159 HZ2 LYS 23 1HZ LYS 23 15.962 -10.525 1.321 160 HZ3 LYS 23 2HZ LYS 23 16.303 -10.021 2.853 161 H ILE 24 H ILE 24 11.782 -6.180 -1.121 162 HA ILE 24 HA ILE 24 11.216 -8.623 0.182 163 HB ILE 24 HB ILE 24 9.550 -6.163 -0.428 164 HG13 ILE 24 2HG1 ILE 24 11.509 -5.680 0.962 165 HG21 ILE 24 1HG2 ILE 24 8.908 -8.426 1.513 166 HG22 ILE 24 2HG2 ILE 24 7.997 -6.908 1.422 167 HG23 ILE 24 3HG2 ILE 24 7.995 -8.006 0.055 168 HD11 ILE 24 3HD1 ILE 24 10.445 -4.394 2.570 169 HD12 ILE 24 1HD1 ILE 24 9.048 -4.768 1.559 170 HD13 ILE 24 2HD1 ILE 24 9.323 -5.677 3.039 171 H ASN 25 H ASN 25 9.994 -7.405 -3.006 172 HA ASN 25 HA ASN 25 7.956 -9.348 -3.348 173 HB3 ASN 25 2HB ASN 25 9.733 -7.949 -5.356 174 HD21 ASN 25 1HD2 ASN 25 6.818 -10.241 -5.118 175 HD22 ASN 25 2HD2 ASN 25 6.998 -10.680 -6.771 176 H SER 26 H SER 26 11.504 -9.785 -3.670 177 HA SER 26 HA SER 26 11.454 -12.345 -4.932 178 HB3 SER 26 2HB SER 26 13.688 -12.561 -4.076 179 HG SER 26 HG SER 26 13.360 -9.740 -4.331 180 H GLU 27 H GLU 27 11.155 -11.252 -1.584 181 HA GLU 27 HA GLU 27 11.584 -13.881 -0.413 182 HB3 GLU 27 2HB GLU 27 11.751 -12.581 1.651 183 HG3 GLU 27 2HG GLU 27 13.321 -10.776 1.208 184 H ILE 28 H ILE 28 8.856 -12.649 -1.789 185 HA ILE 28 HA ILE 28 7.103 -13.852 0.289 186 HB ILE 28 HB ILE 28 6.511 -11.413 -1.408 187 HG13 ILE 28 2HG1 ILE 28 7.928 -10.904 0.548 188 HG21 ILE 28 1HG2 ILE 28 4.326 -11.411 -0.358 189 HG22 ILE 28 2HG2 ILE 28 4.510 -12.990 -1.088 190 HG23 ILE 28 3HG2 ILE 28 4.754 -12.808 0.651 191 HD11 ILE 28 3HD1 ILE 28 5.930 -9.394 0.031 192 HD12 ILE 28 1HD1 ILE 28 5.108 -10.197 1.399 193 HD13 ILE 28 2HD1 ILE 28 6.618 -9.312 1.662 194 H LYS 29 H LYS 29 5.688 -15.309 -0.366 195 HA LYS 29 HA LYS 29 6.117 -16.664 -2.824 196 HB3 LYS 29 2HB LYS 29 4.243 -16.901 -0.482 197 HG3 LYS 29 2HG LYS 29 3.147 -18.015 -2.519 198 HD3 LYS 29 2HD LYS 29 3.813 -20.431 -2.696 199 HE3 LYS 29 2HE LYS 29 6.060 -18.644 -3.675 200 HZ1 LYS 29 3HZ LYS 29 5.906 -20.130 -5.574 201 HZ2 LYS 29 1HZ LYS 29 4.776 -21.040 -4.852 202 HZ3 LYS 29 2HZ LYS 29 6.304 -21.008 -4.223 203 H ASP 30 H ASP 30 5.048 -16.807 -4.514 204 HA ASP 30 HA ASP 30 3.776 -16.307 -6.348 205 HB3 ASP 30 2HB ASP 30 1.280 -16.519 -5.985 206 H SER 31 H SER 31 4.725 -13.913 -4.754 207 HA SER 31 HA SER 31 2.539 -12.082 -4.794 208 HB3 SER 31 2HB SER 31 4.168 -12.031 -3.005 209 HG SER 31 HG SER 31 6.168 -12.459 -3.713 210 H GLU 32 H GLU 32 3.082 -9.717 -5.701 211 HA GLU 32 HA GLU 32 4.583 -9.758 -8.189 212 HB3 GLU 32 2HB GLU 32 1.878 -8.641 -8.703 213 HG3 GLU 32 2HG GLU 32 3.780 -10.590 -10.060 214 H LEU 33 H LEU 33 4.557 -7.632 -9.181 215 HA LEU 33 HA LEU 33 4.558 -5.511 -7.106 216 HB3 LEU 33 2HB LEU 33 6.706 -5.114 -8.926 217 HG LEU 33 HG LEU 33 6.804 -6.312 -6.155 218 HD11 LEU 33 1HD1 LEU 33 8.923 -6.636 -7.457 219 HD12 LEU 33 2HD1 LEU 33 9.143 -5.520 -6.085 220 HD13 LEU 33 3HD1 LEU 33 9.000 -4.899 -7.736 221 HD21 LEU 33 3HD2 LEU 33 5.772 -4.012 -6.166 222 HD22 LEU 33 1HD2 LEU 33 7.274 -3.410 -6.888 223 HD23 LEU 33 2HD2 LEU 33 7.284 -4.173 -5.275 224 H LYS 34 H LYS 34 3.891 -3.562 -7.715 225 HA LYS 34 HA LYS 34 3.770 -2.781 -10.557 226 HB3 LYS 34 2HB LYS 34 1.556 -1.641 -9.155 227 HG3 LYS 34 2HG LYS 34 0.235 -3.476 -10.388 228 HD3 LYS 34 2HD LYS 34 1.763 -1.702 -12.321 229 HE3 LYS 34 2HE LYS 34 -1.206 -2.327 -12.024 230 HZ1 LYS 34 3HZ LYS 34 -1.157 -2.067 -14.442 231 HZ2 LYS 34 1HZ LYS 34 0.368 -1.570 -14.427 232 HZ3 LYS 34 2HZ LYS 34 -0.842 -0.657 -13.739 233 H GLU 35 H GLU 35 2.951 -0.297 -10.299 234 HA GLU 35 HA GLU 35 4.311 1.155 -8.203 235 HB3 GLU 35 2HB GLU 35 6.187 0.884 -9.702 236 HG3 GLU 35 2HG GLU 35 4.297 1.661 -11.959 237 H VAL 36 H VAL 36 3.601 3.319 -8.204 238 HA VAL 36 HA VAL 36 1.229 4.011 -9.921 239 HB VAL 36 HB VAL 36 1.691 4.923 -7.072 240 HG11 VAL 36 1HG1 VAL 36 0.119 6.346 -8.339 241 HG12 VAL 36 2HG1 VAL 36 -0.727 4.919 -8.970 242 HG13 VAL 36 3HG1 VAL 36 -0.852 5.354 -7.266 243 HG21 VAL 36 3HG2 VAL 36 -0.189 2.677 -7.828 244 HG22 VAL 36 1HG2 VAL 36 1.335 2.469 -6.933 245 HG23 VAL 36 2HG2 VAL 36 0.021 3.399 -6.229 246 H LYS 37 H LYS 37 1.116 6.357 -10.426 247 HA LYS 37 HA LYS 37 3.097 8.081 -9.272 248 HB3 LYS 37 2HB LYS 37 4.194 7.346 -11.335 249 HG3 LYS 37 2HG LYS 37 3.459 8.489 -13.461 250 HD3 LYS 37 2HD LYS 37 1.324 6.445 -13.129 251 HE3 LYS 37 2HE LYS 37 2.553 5.308 -14.923 252 HZ1 LYS 37 3HZ LYS 37 2.401 8.206 -15.544 253 HZ2 LYS 37 1HZ LYS 37 1.257 7.044 -15.927 254 HZ3 LYS 37 2HZ LYS 37 2.733 7.039 -16.607 255 H VAL 38 H VAL 38 2.527 10.382 -9.748 256 HA VAL 38 HA VAL 38 -0.382 10.809 -9.865 257 HB VAL 38 HB VAL 38 0.287 13.114 -8.942 258 HG11 VAL 38 1HG1 VAL 38 -0.851 11.402 -7.630 259 HG12 VAL 38 2HG1 VAL 38 0.725 10.759 -7.114 260 HG13 VAL 38 3HG1 VAL 38 0.238 12.399 -6.653 261 HG21 VAL 38 3HG2 VAL 38 2.794 12.783 -9.428 262 HG22 VAL 38 1HG2 VAL 38 2.349 13.459 -7.872 263 HG23 VAL 38 2HG2 VAL 38 2.826 11.750 -7.986 264 H SER 39 H SER 39 -0.404 13.395 -10.707 265 HA SER 39 HA SER 39 0.462 13.435 -13.452 266 HB3 SER 39 2HB SER 39 -0.535 15.666 -11.839 267 HG SER 39 HG SER 39 -1.539 16.104 -13.937 268 H GLU 40 H GLU 40 1.338 16.012 -13.688 269 HA GLU 40 HA GLU 40 4.049 16.021 -12.429 270 HB3 GLU 40 2HB GLU 40 3.995 15.316 -14.728 271 HG3 GLU 40 2HG GLU 40 3.113 18.128 -15.487 272 H GLY 41 H GLY 41 1.812 17.162 -11.383 273 HA2 GLY 41 1HA GLY 41 2.607 19.981 -11.051 274 HA3 GLY 41 2HA GLY 41 1.031 19.716 -11.821 275 H THR 42 H THR 42 2.475 17.771 -9.166 276 HA THR 42 HA THR 42 0.014 18.488 -7.609 277 HB THR 42 HB THR 42 1.344 15.785 -7.896 278 HG1 THR 42 1HG THR 42 -1.014 16.830 -9.092 279 HG21 THR 42 3HG2 THR 42 -0.610 14.889 -6.898 280 HG22 THR 42 1HG2 THR 42 -1.448 16.472 -6.909 281 HG23 THR 42 2HG2 THR 42 -0.086 16.193 -5.821 282 H PHE 43 H PHE 43 3.515 17.487 -7.298 283 HA PHE 43 HA PHE 43 3.721 19.328 -5.148 284 HB3 PHE 43 2HB PHE 43 3.366 17.817 -3.667 285 HD1 PHE 43 1HD PHE 43 5.430 15.251 -5.440 286 HD2 PHE 43 2HD PHE 43 1.561 16.493 -4.023 287 HE1 PHE 43 1HE PHE 43 4.541 12.975 -5.913 288 HE2 PHE 43 2HE PHE 43 0.658 14.197 -4.494 289 HZ PHE 43 HZ PHE 43 2.156 12.450 -5.423 290 H ASP 44 H ASP 44 5.924 19.338 -4.329 291 HA ASP 44 HA ASP 44 7.898 19.338 -6.522 292 HB3 ASP 44 2HB ASP 44 7.732 21.387 -4.288 293 H ALA 45 H ALA 45 10.202 19.844 -5.049 294 HA ALA 45 HA ALA 45 10.270 17.561 -3.168 295 HB1 ALA 45 1HB ALA 45 12.662 17.946 -3.126 296 HB2 ALA 45 2HB ALA 45 12.092 17.863 -4.805 297 HB3 ALA 45 3HB ALA 45 12.465 19.433 -4.069 298 H ASP 46 H ASP 46 9.699 20.974 -3.061 299 HA ASP 46 HA ASP 46 11.366 21.460 -0.832 300 HB3 ASP 46 2HB ASP 46 9.213 23.469 -1.131 301 H MET 47 H MET 47 10.831 22.305 1.224 302 HA MET 47 HA MET 47 8.945 20.636 2.655 303 HB3 MET 47 2HB MET 47 11.038 21.050 3.633 304 HG3 MET 47 2HG MET 47 10.562 23.911 4.316 305 HE1 MET 47 3HE MET 47 12.920 21.266 2.710 306 HE2 MET 47 1HE MET 47 13.421 22.802 1.967 307 HE3 MET 47 2HE MET 47 14.529 21.923 3.063 308 H TYR 48 H TYR 48 9.195 24.256 2.635 309 HA TYR 48 HA TYR 48 6.621 24.623 3.770 310 HB3 TYR 48 2HB TYR 48 8.203 26.377 3.964 311 HD1 TYR 48 1HD TYR 48 7.171 27.594 0.642 312 HD2 TYR 48 2HD TYR 48 10.436 25.959 2.955 313 HE1 TYR 48 1HE TYR 48 8.708 27.964 -1.270 314 HE2 TYR 48 2HE TYR 48 11.952 26.251 1.036 315 HH TYR 48 HH TYR 48 11.573 26.255 -1.491 316 H LYS 49 H LYS 49 7.689 24.587 0.311 317 HA LYS 49 HA LYS 49 5.243 25.583 -0.700 318 HB3 LYS 49 2HB LYS 49 7.209 23.710 -2.094 319 HG3 LYS 49 2HG LYS 49 4.884 25.287 -3.012 320 HD3 LYS 49 2HD LYS 49 7.611 25.579 -4.332 321 HE3 LYS 49 2HE LYS 49 4.931 26.611 -5.346 322 HZ1 LYS 49 3HZ LYS 49 6.924 27.719 -6.200 323 HZ2 LYS 49 1HZ LYS 49 6.197 26.833 -7.368 324 HZ3 LYS 49 2HZ LYS 49 7.554 26.256 -6.662 325 H THR 50 H THR 50 6.323 22.127 -0.335 326 HA THR 50 HA THR 50 3.727 21.234 -1.273 327 HB THR 50 HB THR 50 4.494 19.013 -0.663 328 HG1 THR 50 1HG THR 50 6.955 20.143 0.206 329 HG21 THR 50 3HG2 THR 50 5.199 20.109 -2.800 330 HG22 THR 50 1HG2 THR 50 6.304 18.848 -2.209 331 HG23 THR 50 2HG2 THR 50 6.729 20.571 -2.039 332 H SER 51 H SER 51 4.988 22.137 1.930 333 HA SER 51 HA SER 51 3.022 20.775 3.477 334 HB3 SER 51 2HB SER 51 3.370 22.600 5.117 335 HG SER 51 HG SER 51 5.791 21.733 3.870 336 H ASP 52 H ASP 52 2.838 23.726 1.469 337 HA ASP 52 HA ASP 52 0.231 24.454 2.481 338 HB3 ASP 52 2HB ASP 52 1.432 25.229 -0.218 339 H ILE 53 H ILE 53 1.331 22.663 -0.418 340 HA ILE 53 HA ILE 53 -1.324 22.323 -1.519 341 HB ILE 53 HB ILE 53 0.918 20.249 -1.965 342 HG13 ILE 53 2HG1 ILE 53 1.913 22.615 -2.200 343 HG21 ILE 53 1HG2 ILE 53 -0.119 20.099 -4.169 344 HG22 ILE 53 2HG2 ILE 53 -1.347 19.909 -2.920 345 HG23 ILE 53 3HG2 ILE 53 -1.204 21.448 -3.774 346 HD11 ILE 53 3HD1 ILE 53 3.196 22.145 -4.088 347 HD12 ILE 53 1HD1 ILE 53 2.808 20.567 -3.394 348 HD13 ILE 53 2HD1 ILE 53 1.921 21.151 -4.827 349 H ALA 54 H ALA 54 0.801 20.235 0.508 350 HA ALA 54 HA ALA 54 -1.195 18.219 0.777 351 HB1 ALA 54 1HB ALA 54 1.249 18.678 2.527 352 HB2 ALA 54 2HB ALA 54 0.306 17.177 2.361 353 HB3 ALA 54 3HB ALA 54 1.253 17.773 0.988 354 H LEU 55 H LEU 55 -1.155 21.335 2.172 355 HA LEU 55 HA LEU 55 -2.943 20.424 4.333 356 HB3 LEU 55 2HB LEU 55 -1.991 23.221 3.572 357 HG LEU 55 HG LEU 55 -4.039 23.290 4.884 358 HD11 LEU 55 1HD1 LEU 55 -3.961 22.418 7.277 359 HD12 LEU 55 2HD1 LEU 55 -2.447 21.579 6.858 360 HD13 LEU 55 3HD1 LEU 55 -3.968 21.129 6.068 361 HD21 LEU 55 3HD2 LEU 55 -2.320 24.982 5.228 362 HD22 LEU 55 1HD2 LEU 55 -1.540 23.970 6.464 363 HD23 LEU 55 2HD2 LEU 55 -3.158 24.650 6.752 364 H ASP 56 H ASP 56 -2.889 22.183 1.197 365 HA ASP 56 HA ASP 56 -5.575 22.988 1.254 366 HB3 ASP 56 2HB ASP 56 -3.607 23.845 -0.184 367 H GLN 57 H GLN 57 -4.122 19.971 0.124 368 HA GLN 57 HA GLN 57 -6.686 18.842 -0.631 369 HB3 GLN 57 2HB GLN 57 -5.408 16.790 -1.034 370 HG3 GLN 57 2HG GLN 57 -3.918 19.257 -2.013 371 HE21 GLN 57 1HE2 GLN 57 -4.505 17.817 -4.755 372 HE22 GLN 57 2HE2 GLN 57 -3.149 16.714 -4.838 373 H ILE 58 H ILE 58 -5.577 19.469 2.485 374 HA ILE 58 HA ILE 58 -6.904 17.063 3.664 375 HB ILE 58 HB ILE 58 -5.268 19.275 4.974 376 HG13 ILE 58 2HG1 ILE 58 -4.047 17.520 3.722 377 HG21 ILE 58 1HG2 ILE 58 -6.677 16.903 6.280 378 HG22 ILE 58 2HG2 ILE 58 -5.537 17.990 7.093 379 HG23 ILE 58 3HG2 ILE 58 -7.057 18.627 6.538 380 HD11 ILE 58 3HD1 ILE 58 -3.517 17.166 6.702 381 HD12 ILE 58 1HD1 ILE 58 -2.379 16.975 5.368 382 HD13 ILE 58 2HD1 ILE 58 -2.997 18.581 5.770 383 H GLN 59 H GLN 59 -6.980 20.650 3.769 384 HA GLN 59 HA GLN 59 -8.817 20.594 5.896 385 HB3 GLN 59 2HB GLN 59 -8.929 23.119 5.474 386 HG3 GLN 59 2HG GLN 59 -6.061 22.220 5.540 387 HE21 GLN 59 1HE2 GLN 59 -5.447 24.511 5.474 388 HE22 GLN 59 2HE2 GLN 59 -5.889 25.560 6.797 389 H GLY 60 H GLY 60 -9.814 19.872 2.804 390 HA2 GLY 60 1HA GLY 60 -11.883 19.957 1.789 391 HA3 GLY 60 2HA GLY 60 -12.570 20.768 3.215 392 H ASN 61 H ASN 61 -9.624 21.712 1.523 393 HA ASN 61 HA ASN 61 -10.845 24.338 0.723 394 HB3 ASN 61 2HB ASN 61 -8.598 25.042 0.086 395 HD21 ASN 61 1HD2 ASN 61 -6.474 24.997 1.804 396 HD22 ASN 61 2HD2 ASN 61 -6.962 25.455 3.403 397 H LYS 62 H LYS 62 -8.725 21.690 -0.451 398 HA LYS 62 HA LYS 62 -9.744 22.082 -3.188 399 HB3 LYS 62 2HB LYS 62 -6.970 21.226 -3.129 400 HG3 LYS 62 2HG LYS 62 -6.589 23.582 -3.984 401 HD3 LYS 62 2HD LYS 62 -8.839 21.897 -5.153 402 HE3 LYS 62 2HE LYS 62 -7.400 24.185 -6.481 403 HZ1 LYS 62 3HZ LYS 62 -8.894 23.250 -8.333 404 HZ2 LYS 62 1HZ LYS 62 -8.812 21.814 -7.468 405 HZ3 LYS 62 2HZ LYS 62 -7.460 22.518 -8.029 406 H ASP 63 H ASP 63 -8.773 20.187 -4.620 407 HA ASP 63 HA ASP 63 -10.339 17.920 -3.855 408 HB3 ASP 63 2HB ASP 63 -10.614 18.916 -6.016 409 H PHE 64 H PHE 64 -8.630 16.060 -5.610 410 HA PHE 64 HA PHE 64 -6.561 15.373 -3.639 411 HB3 PHE 64 2HB PHE 64 -8.269 14.019 -2.800 412 HD1 PHE 64 2HD PHE 64 -8.180 12.332 -6.149 413 HD2 PHE 64 1HD PHE 64 -10.616 14.287 -3.172 414 HE1 PHE 64 2HE PHE 64 -10.220 11.457 -7.242 415 HE2 PHE 64 1HE PHE 64 -12.647 13.433 -4.295 416 HZ PHE 64 HZ PHE 64 -12.468 11.971 -6.296 417 HA PRO 65 HA PRO 65 -4.205 15.049 -7.063 418 HB3 PRO 65 2HB PRO 65 -2.478 14.756 -5.570 419 HG3 PRO 65 2HG PRO 65 -2.532 13.158 -3.829 420 HD3 PRO 65 2HD PRO 65 -4.390 14.603 -3.613 421 H GLU 66 H GLU 66 -4.193 14.293 -9.085 422 HA GLU 66 HA GLU 66 -5.741 12.009 -9.835 423 HB3 GLU 66 2HB GLU 66 -4.790 12.534 -12.127 424 HG3 GLU 66 2HG GLU 66 -5.902 15.002 -10.752 425 H ILE 67 H ILE 67 -5.145 9.957 -9.874 426 HA ILE 67 HA ILE 67 -2.287 9.134 -9.956 427 HB ILE 67 HB ILE 67 -3.160 6.810 -9.806 428 HG13 ILE 67 2HG1 ILE 67 -5.456 7.222 -10.756 429 HG21 ILE 67 1HG2 ILE 67 -4.013 8.678 -7.560 430 HG22 ILE 67 2HG2 ILE 67 -3.697 6.931 -7.410 431 HG23 ILE 67 3HG2 ILE 67 -2.390 8.012 -7.872 432 HD11 ILE 67 3HD1 ILE 67 -6.711 5.725 -9.398 433 HD12 ILE 67 1HD1 ILE 67 -5.031 5.172 -9.374 434 HD13 ILE 67 2HD1 ILE 67 -5.710 6.044 -7.977 435 H GLN 68 H GLN 68 -1.490 7.909 -11.660 436 HA GLN 68 HA GLN 68 -2.986 8.125 -14.228 437 HB3 GLN 68 2HB GLN 68 -0.938 8.496 -15.300 438 HG3 GLN 68 2HG GLN 68 0.188 10.327 -14.102 439 HE21 GLN 68 1HE2 GLN 68 -1.976 11.809 -12.284 440 HE22 GLN 68 2HE2 GLN 68 -2.930 12.480 -13.602 441 H LEU 69 H LEU 69 -3.527 6.104 -12.519 442 HA LEU 69 HA LEU 69 -2.026 3.682 -13.384 443 HB3 LEU 69 2HB LEU 69 -3.822 4.042 -10.960 444 HG LEU 69 HG LEU 69 -3.149 1.641 -11.536 445 HD11 LEU 69 1HD1 LEU 69 -0.886 2.076 -12.445 446 HD12 LEU 69 2HD1 LEU 69 -0.823 0.989 -11.063 447 HD13 LEU 69 3HD1 LEU 69 -0.373 2.700 -10.867 448 HD21 LEU 69 3HD2 LEU 69 -3.818 2.221 -9.347 449 HD22 LEU 69 1HD2 LEU 69 -2.236 2.938 -8.947 450 HD23 LEU 69 2HD2 LEU 69 -2.405 1.189 -9.191 451 H ASP 70 H ASP 70 -3.185 1.714 -13.653 452 HA ASP 70 HA ASP 70 -5.593 1.882 -15.241 453 HB3 ASP 70 2HB ASP 70 -5.077 -0.325 -15.797 454 H ASN 71 H ASN 71 -7.444 0.265 -14.853 455 HA ASN 71 HA ASN 71 -8.030 -0.096 -11.989 456 HB3 ASN 71 2HB ASN 71 -9.790 -1.027 -14.292 457 HD21 ASN 71 1HD2 ASN 71 -10.967 -2.627 -12.867 458 HD22 ASN 71 2HD2 ASN 71 -11.566 -2.170 -11.322 459 H ILE 72 H ILE 72 -8.079 -2.071 -10.908 460 HA ILE 72 HA ILE 72 -7.535 -4.575 -12.369 461 HB ILE 72 HB ILE 72 -5.803 -3.399 -10.159 462 HG13 ILE 72 2HG1 ILE 72 -5.262 -2.665 -12.488 463 HG21 ILE 72 1HG2 ILE 72 -6.203 -5.779 -9.649 464 HG22 ILE 72 2HG2 ILE 72 -5.734 -6.226 -11.309 465 HG23 ILE 72 3HG2 ILE 72 -4.551 -5.551 -10.169 466 HD11 ILE 72 3HD1 ILE 72 -2.987 -3.124 -12.591 467 HD12 ILE 72 1HD1 ILE 72 -3.431 -2.900 -10.886 468 HD13 ILE 72 2HD1 ILE 72 -3.104 -4.538 -11.531 469 H ASP 73 H ASP 73 -8.424 -6.353 -11.270 470 HA ASP 73 HA ASP 73 -10.321 -5.633 -9.156 471 HB3 ASP 73 2HB ASP 73 -10.922 -8.162 -9.587 472 H TYR 74 H TYR 74 -9.069 -5.252 -7.479 473 HA TYR 74 HA TYR 74 -6.857 -6.842 -6.627 474 HB3 TYR 74 2HB TYR 74 -7.068 -5.413 -4.586 475 HD1 TYR 74 2HD TYR 74 -5.049 -5.306 -6.256 476 HD2 TYR 74 1HD TYR 74 -8.455 -2.681 -6.397 477 HE1 TYR 74 2HE TYR 74 -3.708 -3.623 -7.532 478 HE2 TYR 74 1HE TYR 74 -7.161 -1.053 -7.670 479 HH TYR 74 HH TYR 74 -5.190 -0.688 -8.876 480 H ASN 75 H ASN 75 -10.251 -7.463 -6.324 481 HA ASN 75 HA ASN 75 -10.282 -8.374 -3.640 482 HB3 ASN 75 2HB ASN 75 -12.111 -9.474 -5.771 483 HD21 ASN 75 1HD2 ASN 75 -12.589 -7.712 -2.582 484 HD22 ASN 75 2HD2 ASN 75 -13.242 -9.121 -1.814 485 H ASN 76 H ASN 76 -8.883 -9.783 -6.398 486 HA ASN 76 HA ASN 76 -9.013 -12.558 -5.633 487 HB3 ASN 76 2HB ASN 76 -7.553 -12.930 -7.490 488 HD21 ASN 76 1HD2 ASN 76 -8.272 -9.965 -9.079 489 HD22 ASN 76 2HD2 ASN 76 -9.591 -10.640 -9.983 490 H TYR 77 H TYR 77 -7.396 -10.278 -3.877 491 HA TYR 77 HA TYR 77 -4.827 -11.804 -3.610 492 HB3 TYR 77 2HB TYR 77 -3.845 -9.601 -3.125 493 HD1 TYR 77 2HD TYR 77 -6.086 -8.993 -6.039 494 HD2 TYR 77 1HD TYR 77 -2.330 -10.613 -4.734 495 HE1 TYR 77 2HE TYR 77 -5.381 -9.156 -8.398 496 HE2 TYR 77 1HE TYR 77 -1.574 -10.766 -7.104 497 HH TYR 77 HH TYR 77 -3.483 -9.450 -9.796 498 H ASP 78 H ASP 78 -4.178 -12.259 -1.581 499 HA ASP 78 HA ASP 78 -6.174 -12.158 0.603 500 HB3 ASP 78 2HB ASP 78 -3.425 -13.463 0.401 501 H LEU 79 H LEU 79 -3.080 -10.764 -0.413 502 HA LEU 79 HA LEU 79 -2.973 -9.090 2.018 503 HB3 LEU 79 2HB LEU 79 -0.516 -10.420 0.896 504 HG LEU 79 HG LEU 79 -1.190 -10.191 3.824 505 HD11 LEU 79 1HD1 LEU 79 0.694 -11.575 2.970 506 HD12 LEU 79 2HD1 LEU 79 1.116 -10.340 4.157 507 HD13 LEU 79 3HD1 LEU 79 1.489 -10.073 2.436 508 HD21 LEU 79 3HD2 LEU 79 0.187 -8.085 3.957 509 HD22 LEU 79 1HD2 LEU 79 -1.408 -7.861 3.240 510 HD23 LEU 79 2HD2 LEU 79 0.025 -7.944 2.195 511 H ILE 80 H ILE 80 -2.382 -6.984 1.474 512 HA ILE 80 HA ILE 80 -1.142 -6.403 -1.198 513 HB ILE 80 HB ILE 80 -3.676 -5.113 -0.156 514 HG13 ILE 80 2HG1 ILE 80 -4.124 -7.285 -1.194 515 HG21 ILE 80 1HG2 ILE 80 -3.408 -3.776 -2.267 516 HG22 ILE 80 2HG2 ILE 80 -2.072 -3.498 -1.180 517 HG23 ILE 80 3HG2 ILE 80 -1.866 -4.612 -2.548 518 HD11 ILE 80 3HD1 ILE 80 -4.552 -5.259 -3.420 519 HD12 ILE 80 1HD1 ILE 80 -5.400 -6.774 -3.174 520 HD13 ILE 80 2HD1 ILE 80 -5.621 -5.486 -2.000 521 H LEU 81 H LEU 81 0.877 -5.720 -0.314 522 HA LEU 81 HA LEU 81 0.839 -3.726 1.873 523 HB3 LEU 81 2HB LEU 81 3.319 -3.623 1.329 524 HG LEU 81 HG LEU 81 1.922 -5.193 3.085 525 HD11 LEU 81 1HD1 LEU 81 2.823 -7.464 3.048 526 HD12 LEU 81 2HD1 LEU 81 3.679 -7.117 1.507 527 HD13 LEU 81 3HD1 LEU 81 1.922 -7.129 1.579 528 HD21 LEU 81 3HD2 LEU 81 3.965 -3.953 3.559 529 HD22 LEU 81 1HD2 LEU 81 4.930 -5.184 2.688 530 HD23 LEU 81 2HD2 LEU 81 4.046 -5.605 4.172 531 H ILE 82 H ILE 82 1.410 -1.598 1.625 532 HA ILE 82 HA ILE 82 1.561 -0.508 -1.124 533 HB ILE 82 HB ILE 82 -0.225 0.457 1.131 534 HG13 ILE 82 2HG1 ILE 82 -1.081 -1.671 0.145 535 HG21 ILE 82 1HG2 ILE 82 -1.156 2.044 -0.508 536 HG22 ILE 82 2HG2 ILE 82 0.584 2.298 -0.356 537 HG23 ILE 82 3HG2 ILE 82 -0.068 1.417 -1.752 538 HD11 ILE 82 3HD1 ILE 82 -3.285 -1.118 -0.296 539 HD12 ILE 82 1HD1 ILE 82 -2.712 -0.061 1.009 540 HD13 ILE 82 2HD1 ILE 82 -2.902 0.577 -0.648 541 H GLY 83 H GLY 83 2.860 1.509 -1.112 542 HA2 GLY 83 1HA GLY 83 4.122 2.215 1.499 543 HA3 GLY 83 2HA GLY 83 5.071 1.961 0.017 544 H SER 84 H SER 84 5.133 4.441 1.350 545 HA SER 84 HA SER 84 4.762 5.979 -0.963 546 HB3 SER 84 2HB SER 84 2.966 7.175 -0.642 547 HG SER 84 HG SER 84 2.200 5.099 0.119 548 HA PRO 85 HA PRO 85 7.893 8.332 1.304 549 HB3 PRO 85 2HB PRO 85 8.253 9.551 -0.665 550 HG3 PRO 85 2HG PRO 85 6.369 10.197 -2.043 551 HD3 PRO 85 2HD PRO 85 6.214 7.873 -1.771 552 H VAL 86 H VAL 86 7.970 9.431 3.184 553 HA VAL 86 HA VAL 86 5.591 10.552 4.440 554 HB VAL 86 HB VAL 86 8.523 10.609 5.246 555 HG11 VAL 86 1HG1 VAL 86 7.517 12.421 6.423 556 HG12 VAL 86 2HG1 VAL 86 6.053 11.496 6.805 557 HG13 VAL 86 3HG1 VAL 86 7.617 11.083 7.547 558 HG21 VAL 86 3HG2 VAL 86 7.573 8.325 5.266 559 HG22 VAL 86 1HG2 VAL 86 7.938 8.890 6.902 560 HG23 VAL 86 2HG2 VAL 86 6.262 8.872 6.326 561 H TRP 87 H TRP 87 5.703 13.113 4.855 562 HA TRP 87 HA TRP 87 7.688 14.613 3.324 563 HB3 TRP 87 2HB TRP 87 5.098 15.974 3.239 564 HD1 TRP 87 HD TRP 87 7.089 17.581 1.835 565 HE1 TRP 87 1HE TRP 87 7.396 17.706 -0.736 566 HE3 TRP 87 3HE TRP 87 5.139 13.065 0.495 567 HZ2 TRP 87 2HZ TRP 87 7.377 15.908 -2.919 568 HZ3 TRP 87 3HZ TRP 87 5.162 12.372 -1.855 569 HH2 TRP 87 HH TRP 87 6.362 13.715 -3.586 570 H SER 88 H SER 88 6.655 17.185 4.185 571 HA SER 88 HA SER 88 7.653 17.293 6.831 572 HB3 SER 88 2HB SER 88 7.554 19.561 6.620 573 HG SER 88 HG SER 88 6.949 19.226 3.922 574 H GLY 89 H GLY 89 6.371 15.757 7.822 575 HA2 GLY 89 1HA GLY 89 4.989 15.556 9.764 576 HA3 GLY 89 2HA GLY 89 3.901 16.769 9.116 577 H TYR 90 H TYR 90 3.552 15.712 6.379 578 HA TYR 90 HA TYR 90 1.987 13.283 7.074 579 HB3 TYR 90 2HB TYR 90 0.008 14.253 6.337 580 HD1 TYR 90 1HD TYR 90 0.710 14.613 9.082 581 HD2 TYR 90 2HD TYR 90 0.341 17.645 6.023 582 HE1 TYR 90 1HE TYR 90 0.328 16.321 10.820 583 HE2 TYR 90 2HE TYR 90 -0.067 19.346 7.764 584 HH TYR 90 HH TYR 90 0.098 18.669 11.265 585 HA PRO 91 HA PRO 91 3.397 12.228 2.877 586 HB3 PRO 91 2HB PRO 91 2.288 10.218 2.814 587 HG3 PRO 91 2HG PRO 91 0.264 9.935 4.076 588 HD3 PRO 91 2HD PRO 91 1.720 10.989 5.621 589 H ALA 92 H ALA 92 2.925 12.704 0.622 590 HA ALA 92 HA ALA 92 1.476 15.118 0.041 591 HB1 ALA 92 1HB ALA 92 2.191 14.603 -2.218 592 HB2 ALA 92 2HB ALA 92 3.491 14.709 -1.072 593 HB3 ALA 92 3HB ALA 92 2.924 13.090 -1.643 594 H THR 93 H THR 93 -0.163 12.958 1.130 595 HA THR 93 HA THR 93 -1.644 11.248 0.818 596 HB THR 93 HB THR 93 -3.766 12.248 0.168 597 HG1 THR 93 1HG THR 93 -2.284 14.590 -0.401 598 HG21 THR 93 3HG2 THR 93 -3.752 13.967 1.895 599 HG22 THR 93 1HG2 THR 93 -1.981 14.062 1.857 600 HG23 THR 93 2HG2 THR 93 -2.788 12.582 2.415 601 HA PRO 94 HA PRO 94 -0.873 10.147 -3.643 602 HB3 PRO 94 2HB PRO 94 1.428 9.779 -3.450 603 HG3 PRO 94 2HG PRO 94 2.393 9.139 -1.373 604 HD3 PRO 94 2HD PRO 94 1.179 11.039 -0.971 605 H ILE 95 H ILE 95 -1.841 8.348 -0.819 606 HA ILE 95 HA ILE 95 -2.896 6.172 -2.549 607 HB ILE 95 HB ILE 95 -2.758 6.153 0.453 608 HG13 ILE 95 2HG1 ILE 95 -0.646 4.867 0.347 609 HG21 ILE 95 1HG2 ILE 95 -4.140 4.419 -0.615 610 HG22 ILE 95 2HG2 ILE 95 -2.763 3.900 -1.603 611 HG23 ILE 95 3HG2 ILE 95 -2.731 3.713 0.165 612 HD11 ILE 95 3HD1 ILE 95 0.981 5.205 -1.498 613 HD12 ILE 95 1HD1 ILE 95 -0.391 4.230 -2.044 614 HD13 ILE 95 2HD1 ILE 95 -0.247 5.943 -2.486 615 H LYS 96 H LYS 96 -3.887 9.074 -0.901 616 HA LYS 96 HA LYS 96 -6.479 8.513 -0.053 617 HB3 LYS 96 2HB LYS 96 -5.128 10.970 -1.100 618 HG3 LYS 96 2HG LYS 96 -7.477 11.438 -1.645 619 HD3 LYS 96 2HD LYS 96 -7.902 10.393 1.159 620 HE3 LYS 96 2HE LYS 96 -8.597 12.706 1.388 621 HZ1 LYS 96 3HZ LYS 96 -10.211 12.183 -1.038 622 HZ2 LYS 96 1HZ LYS 96 -9.271 13.537 -0.695 623 HZ3 LYS 96 2HZ LYS 96 -10.683 13.277 0.047 624 H THR 97 H THR 97 -5.560 9.536 -3.433 625 HA THR 97 HA THR 97 -8.281 9.235 -4.347 626 HB THR 97 HB THR 97 -5.659 9.017 -5.905 627 HG1 THR 97 1HG THR 97 -5.758 11.258 -6.028 628 HG21 THR 97 3HG2 THR 97 -6.987 10.157 -7.701 629 HG22 THR 97 1HG2 THR 97 -8.443 9.951 -6.695 630 HG23 THR 97 2HG2 THR 97 -7.579 8.536 -7.308 631 H LEU 98 H LEU 98 -5.537 7.001 -4.227 632 HA LEU 98 HA LEU 98 -6.705 5.095 -6.025 633 HB3 LEU 98 2HB LEU 98 -4.500 4.890 -3.888 634 HG LEU 98 HG LEU 98 -5.076 2.713 -4.861 635 HD11 LEU 98 1HD1 LEU 98 -4.212 3.948 -7.510 636 HD12 LEU 98 2HD1 LEU 98 -5.861 3.403 -7.094 637 HD13 LEU 98 3HD1 LEU 98 -4.568 2.232 -7.218 638 HD21 LEU 98 3HD2 LEU 98 -2.733 2.152 -5.573 639 HD22 LEU 98 1HD2 LEU 98 -2.793 3.146 -4.114 640 HD23 LEU 98 2HD2 LEU 98 -2.386 3.886 -5.686 641 H LEU 99 H LEU 99 -6.636 5.348 -2.462 642 HA LEU 99 HA LEU 99 -7.799 2.849 -1.832 643 HB3 LEU 99 2HB LEU 99 -6.636 4.612 -0.434 644 HG LEU 99 HG LEU 99 -8.618 6.261 -0.808 645 HD11 LEU 99 1HD1 LEU 99 -9.935 5.389 1.646 646 HD12 LEU 99 2HD1 LEU 99 -10.028 4.144 0.384 647 HD13 LEU 99 3HD1 LEU 99 -10.630 5.791 0.064 648 HD21 LEU 99 3HD2 LEU 99 -8.166 7.313 1.264 649 HD22 LEU 99 1HD2 LEU 99 -6.668 6.530 0.716 650 HD23 LEU 99 2HD2 LEU 99 -7.624 5.770 1.996 651 H ASP 100 H ASP 100 -9.321 5.803 -2.932 652 HA ASP 100 HA ASP 100 -12.056 5.117 -2.324 653 HB3 ASP 100 2HB ASP 100 -10.943 6.787 -4.645 654 H GLN 101 H GLN 101 -9.872 4.233 -4.893 655 HA GLN 101 HA GLN 101 -11.884 2.691 -6.384 656 HB3 GLN 101 2HB GLN 101 -10.105 2.492 -8.032 657 HG3 GLN 101 2HG GLN 101 -9.970 5.367 -7.044 658 HE21 GLN 101 1HE2 GLN 101 -9.545 6.836 -8.696 659 HE22 GLN 101 2HE2 GLN 101 -9.224 6.365 -10.365 660 H MET 102 H MET 102 -10.538 2.017 -3.584 661 HA MET 102 HA MET 102 -10.012 -0.875 -4.165 662 HB3 MET 102 2HB MET 102 -8.279 -0.680 -2.321 663 HG3 MET 102 2HG MET 102 -7.850 1.028 -4.795 664 HE1 MET 102 3HE MET 102 -5.610 0.620 -6.006 665 HE2 MET 102 1HE MET 102 -4.046 0.361 -5.206 666 HE3 MET 102 2HE MET 102 -5.182 -0.981 -5.386 667 H LYS 103 H LYS 103 -12.470 0.674 -3.048 668 HA LYS 103 HA LYS 103 -12.653 0.176 -0.226 669 HB3 LYS 103 2HB LYS 103 -15.218 0.014 -1.634 670 HG3 LYS 103 2HG LYS 103 -14.245 1.391 0.630 671 HD3 LYS 103 2HD LYS 103 -15.266 3.341 -1.493 672 HE3 LYS 103 2HE LYS 103 -14.282 4.044 1.271 673 HZ1 LYS 103 3HZ LYS 103 -14.835 5.899 -0.037 674 HZ2 LYS 103 1HZ LYS 103 -16.045 5.738 1.038 675 HZ3 LYS 103 2HZ LYS 103 -16.284 5.277 -0.527 676 H ASN 104 H ASN 104 -13.151 -1.812 -2.988 677 HA ASN 104 HA ASN 104 -14.643 -3.961 -1.957 678 HB3 ASN 104 2HB ASN 104 -14.321 -3.239 -4.357 679 HD21 ASN 104 1HD2 ASN 104 -11.784 -5.785 -4.167 680 HD22 ASN 104 2HD2 ASN 104 -10.623 -4.810 -5.077 681 H TYR 105 H TYR 105 -11.576 -3.218 -0.808 682 HA TYR 105 HA TYR 105 -10.182 -5.676 -1.256 683 HB3 TYR 105 2HB TYR 105 -8.972 -4.745 0.937 684 HD1 TYR 105 2HD TYR 105 -9.637 -3.654 -2.581 685 HD2 TYR 105 1HD TYR 105 -6.918 -3.562 0.751 686 HE1 TYR 105 2HE TYR 105 -7.859 -2.911 -4.066 687 HE2 TYR 105 1HE TYR 105 -5.076 -2.849 -0.764 688 HH TYR 105 HH TYR 105 -5.637 -2.634 -4.325 689 H ARG 106 H ARG 106 -10.024 -7.479 -0.140 690 HA ARG 106 HA ARG 106 -11.275 -7.952 2.512 691 HB3 ARG 106 2HB ARG 106 -12.067 -10.103 1.773 692 HG3 ARG 106 2HG ARG 106 -13.210 -7.957 -0.062 693 HD3 ARG 106 2HD ARG 106 -14.927 -9.871 1.406 694 HE ARG 106 HE ARG 106 -15.215 -10.088 -1.399 695 HH11 ARG 106 1HH1 ARG 106 -15.907 -7.790 1.247 696 HH12 ARG 106 2HH1 ARG 106 -16.933 -6.818 0.275 697 HH21 ARG 106 1HH2 ARG 106 -16.543 -8.653 -2.709 698 HH22 ARG 106 2HH2 ARG 106 -17.477 -7.455 -1.872 699 H GLY 107 H GLY 107 -9.370 -8.438 3.667 700 HA2 GLY 107 1HA GLY 107 -7.618 -10.407 3.546 701 HA3 GLY 107 2HA GLY 107 -7.056 -9.481 2.158 702 H GLU 108 H GLU 108 -5.138 -9.549 3.588 703 HA GLU 108 HA GLU 108 -4.961 -7.683 5.851 704 HB3 GLU 108 2HB GLU 108 -2.536 -8.509 5.672 705 HG3 GLU 108 2HG GLU 108 -4.781 -10.537 6.068 706 H VAL 109 H VAL 109 -3.637 -5.813 5.765 707 HA VAL 109 HA VAL 109 -2.493 -4.919 3.241 708 HB VAL 109 HB VAL 109 -4.448 -3.187 4.809 709 HG11 VAL 109 1HG1 VAL 109 -3.455 -2.930 1.925 710 HG12 VAL 109 2HG1 VAL 109 -4.388 -1.734 2.835 711 HG13 VAL 109 3HG1 VAL 109 -2.711 -2.088 3.290 712 HG21 VAL 109 3HG2 VAL 109 -5.858 -4.950 3.871 713 HG22 VAL 109 1HG2 VAL 109 -6.129 -3.411 3.058 714 HG23 VAL 109 2HG2 VAL 109 -5.146 -4.656 2.256 715 H ALA 110 H ALA 110 -0.527 -3.785 3.784 716 HA ALA 110 HA ALA 110 -0.384 -2.563 6.486 717 HB1 ALA 110 1HB ALA 110 0.927 -4.675 6.556 718 HB2 ALA 110 2HB ALA 110 1.894 -4.113 5.180 719 HB3 ALA 110 3HB ALA 110 1.953 -3.247 6.728 720 H SER 111 H SER 111 1.363 -0.793 6.581 721 HA SER 111 HA SER 111 1.780 0.388 3.853 722 HB3 SER 111 2HB SER 111 1.516 1.833 6.487 723 HG SER 111 HG SER 111 1.091 2.819 3.869 724 H PHE 112 H PHE 112 3.926 1.535 3.612 725 HA PHE 112 HA PHE 112 5.674 1.364 5.929 726 HB3 PHE 112 2HB PHE 112 6.009 -0.762 4.422 727 HD1 PHE 112 2HD PHE 112 5.467 0.088 1.914 728 HD2 PHE 112 1HD PHE 112 9.216 0.595 3.965 729 HE1 PHE 112 2HE PHE 112 6.612 0.558 -0.241 730 HE2 PHE 112 1HE PHE 112 10.320 1.161 1.827 731 HZ PHE 112 HZ PHE 112 9.021 1.113 -0.296 732 H PHE 113 H PHE 113 7.673 2.605 5.650 733 HA PHE 113 HA PHE 113 7.418 4.919 3.773 734 HB3 PHE 113 2HB PHE 113 8.465 6.300 5.454 735 HD1 PHE 113 1HD PHE 113 5.784 6.642 4.979 736 HD2 PHE 113 2HD PHE 113 7.538 4.484 8.333 737 HE1 PHE 113 1HE PHE 113 3.636 6.371 6.022 738 HE2 PHE 113 2HE PHE 113 5.405 4.643 9.545 739 HZ PHE 113 HZ PHE 113 3.389 5.561 8.372 740 H THR 114 H THR 114 9.582 5.895 3.266 741 HA THR 114 HA THR 114 11.882 4.309 4.248 742 HB THR 114 HB THR 114 12.384 5.145 1.491 743 HG1 THR 114 1HG THR 114 10.365 3.246 1.982 744 HG21 THR 114 3HG2 THR 114 12.536 2.466 2.948 745 HG22 THR 114 1HG2 THR 114 13.854 3.635 2.725 746 HG23 THR 114 2HG2 THR 114 13.178 2.794 1.322 747 H SER 115 H SER 115 10.854 6.703 5.249 748 HA SER 115 HA SER 115 12.145 9.015 4.133 749 HB3 SER 115 2HB SER 115 11.192 8.892 6.998 750 HG SER 115 HG SER 115 10.561 10.976 6.507 751 H ALA 116 H ALA 116 13.225 10.479 5.820 752 HA ALA 116 HA ALA 116 15.826 9.490 6.693 753 HB1 ALA 116 1HB ALA 116 15.550 11.631 5.433 754 HB2 ALA 116 2HB ALA 116 14.488 12.228 6.727 755 HB3 ALA 116 3HB ALA 116 16.209 11.897 7.059 756 H GLY 117 H GLY 117 13.473 8.387 7.980 757 HA2 GLY 117 1HA GLY 117 13.125 7.643 10.093 758 HA3 GLY 117 2HA GLY 117 14.310 8.836 10.631 759 H THR 118 H THR 118 12.183 10.839 9.162 760 HA THR 118 HA THR 118 11.174 11.666 11.719 761 HB THR 118 HB THR 118 10.485 13.651 10.218 762 HG1 THR 118 1HG THR 118 11.396 13.707 8.230 763 HG21 THR 118 3HG2 THR 118 13.414 12.793 10.257 764 HG22 THR 118 1HG2 THR 118 12.537 13.590 11.583 765 HG23 THR 118 2HG2 THR 118 12.800 14.447 10.054 766 H ASN 119 H ASN 119 9.023 12.516 12.038 767 HA ASN 119 HA ASN 119 6.859 12.675 12.061 768 HB3 ASN 119 2HB ASN 119 5.715 13.145 9.974 769 HD21 ASN 119 1HD2 ASN 119 7.921 14.402 7.994 770 HD22 ASN 119 2HD2 ASN 119 8.446 15.762 8.968 771 H HIS 120 H HIS 120 7.924 9.972 12.390 772 HA HIS 120 HA HIS 120 6.549 8.141 10.772 773 HB3 HIS 120 2HB HIS 120 8.594 7.768 12.357 774 HD1 HIS 120 1HD HIS 120 5.838 5.643 14.005 775 HD2 HIS 120 2HD HIS 120 8.902 8.380 14.965 776 HE1 HIS 120 1HE HIS 120 6.038 5.627 16.532 777 H LYS 121 H LYS 121 5.727 9.361 14.032 778 HA LYS 121 HA LYS 121 3.449 7.622 14.184 779 HB3 LYS 121 2HB LYS 121 3.399 9.991 15.979 780 HG3 LYS 121 2HG LYS 121 3.417 8.245 17.716 781 HD3 LYS 121 2HD LYS 121 1.610 7.208 15.503 782 HE3 LYS 121 2HE LYS 121 -0.030 7.053 17.322 783 HZ1 LYS 121 3HZ LYS 121 0.720 5.126 18.151 784 HZ2 LYS 121 1HZ LYS 121 2.277 5.604 18.383 785 HZ3 LYS 121 2HZ LYS 121 1.720 5.231 16.886 786 H ALA 122 H ALA 122 3.868 11.044 13.383 787 HA ALA 122 HA ALA 122 1.166 11.785 13.113 788 HB1 ALA 122 1HB ALA 122 2.007 13.562 11.579 789 HB2 ALA 122 2HB ALA 122 3.037 13.420 13.012 790 HB3 ALA 122 3HB ALA 122 3.568 12.737 11.458 791 H TYR 123 H TYR 123 3.346 10.447 10.544 792 HA TYR 123 HA TYR 123 1.422 10.398 8.527 793 HB3 TYR 123 2HB TYR 123 3.555 8.268 8.908 794 HD1 TYR 123 1HD TYR 123 1.180 7.202 7.478 795 HD2 TYR 123 2HD TYR 123 4.283 9.876 6.072 796 HE1 TYR 123 1HE TYR 123 0.620 6.627 5.195 797 HE2 TYR 123 2HE TYR 123 3.848 9.066 3.771 798 HH TYR 123 HH TYR 123 2.142 6.585 2.858 799 H VAL 124 H VAL 124 2.256 7.654 10.712 800 HA VAL 124 HA VAL 124 0.469 5.639 9.896 801 HB VAL 124 HB VAL 124 1.430 6.461 12.677 802 HG11 VAL 124 1HG1 VAL 124 0.903 4.138 13.369 803 HG12 VAL 124 2HG1 VAL 124 -0.562 5.038 12.946 804 HG13 VAL 124 3HG1 VAL 124 0.076 3.870 11.823 805 HG21 VAL 124 3HG2 VAL 124 2.392 4.362 10.710 806 HG22 VAL 124 1HG2 VAL 124 3.188 5.873 11.015 807 HG23 VAL 124 2HG2 VAL 124 3.077 4.679 12.323 808 H SER 125 H SER 125 -0.118 8.315 12.388 809 HA SER 125 HA SER 125 -2.765 7.419 12.899 810 HB3 SER 125 2HB SER 125 -1.803 10.273 13.374 811 HG SER 125 HG SER 125 -2.950 8.524 15.255 812 H HIS 126 H HIS 126 -1.487 10.072 10.840 813 HA HIS 126 HA HIS 126 -4.043 11.178 10.129 814 HB3 HIS 126 2HB HIS 126 -2.599 11.908 8.035 815 HD1 HIS 126 1HD HIS 126 -3.083 14.363 8.306 816 HD2 HIS 126 2HD HIS 126 -1.334 12.587 11.712 817 HE1 HIS 126 1HE HIS 126 -2.702 16.245 9.998 818 H PHE 127 H PHE 127 -1.955 8.751 8.572 819 HA PHE 127 HA PHE 127 -3.552 8.305 6.249 820 HB3 PHE 127 2HB PHE 127 -1.577 6.532 7.734 821 HD1 PHE 127 2HD PHE 127 -2.733 4.386 7.322 822 HD2 PHE 127 1HD PHE 127 -1.757 7.068 4.070 823 HE1 PHE 127 2HE PHE 127 -2.974 2.527 5.708 824 HE2 PHE 127 1HE PHE 127 -2.040 5.200 2.469 825 HZ PHE 127 HZ PHE 127 -2.641 2.935 3.279 826 H ASN 128 H ASN 128 -3.634 6.859 9.546 827 HA ASN 128 HA ASN 128 -5.450 4.756 8.882 828 HB3 ASN 128 2HB ASN 128 -6.129 4.881 11.329 829 HD21 ASN 128 1HD2 ASN 128 -3.311 4.465 9.396 830 HD22 ASN 128 2HD2 ASN 128 -2.404 3.442 10.474 831 H GLU 129 H GLU 129 -6.019 8.101 10.002 832 HA GLU 129 HA GLU 129 -8.853 8.158 9.943 833 HB3 GLU 129 2HB GLU 129 -7.811 10.678 9.025 834 HG3 GLU 129 2HG GLU 129 -7.749 11.126 11.647 835 H TRP 130 H TRP 130 -6.518 9.187 7.445 836 HA TRP 130 HA TRP 130 -8.369 9.717 5.336 837 HB3 TRP 130 2HB TRP 130 -6.378 9.859 3.996 838 HD1 TRP 130 HD TRP 130 -8.167 11.693 6.182 839 HE1 TRP 130 1HE TRP 130 -7.234 13.970 6.674 840 HE3 TRP 130 3HE TRP 130 -3.285 10.870 4.846 841 HZ2 TRP 130 2HZ TRP 130 -4.635 15.207 6.874 842 HZ3 TRP 130 3HZ TRP 130 -1.611 12.675 5.131 843 HH2 TRP 130 HH TRP 130 -2.250 14.834 6.161 844 H ALA 131 H ALA 131 -7.684 6.604 6.542 845 HA ALA 131 HA ALA 131 -8.668 5.452 4.008 846 HB1 ALA 131 1HB ALA 131 -6.981 3.734 3.998 847 HB2 ALA 131 2HB ALA 131 -6.150 5.297 4.015 848 HB3 ALA 131 3HB ALA 131 -6.264 4.337 5.518 849 H ASP 132 H ASP 132 -9.623 5.955 6.946 850 HA ASP 132 HA ASP 132 -10.110 3.504 8.198 851 HB3 ASP 132 2HB ASP 132 -11.822 6.011 8.039 852 H GLY 133 H GLY 133 -11.209 1.826 7.532 853 HA2 GLY 133 1HA GLY 133 -13.610 1.260 6.744 854 HA3 GLY 133 2HA GLY 133 -13.094 1.957 5.213 855 H LEU 134 H LEU 134 -10.295 0.579 6.225 856 HA LEU 134 HA LEU 134 -10.962 -2.208 5.451 857 HB3 LEU 134 2HB LEU 134 -8.751 -2.199 4.167 858 HG LEU 134 HG LEU 134 -9.469 -1.457 2.066 859 HD11 LEU 134 1HD1 LEU 134 -11.841 -2.695 3.524 860 HD12 LEU 134 2HD1 LEU 134 -10.466 -3.537 2.775 861 HD13 LEU 134 3HD1 LEU 134 -11.618 -2.625 1.770 862 HD21 LEU 134 3HD2 LEU 134 -12.057 -0.240 2.981 863 HD22 LEU 134 1HD2 LEU 134 -11.162 -0.056 1.469 864 HD23 LEU 134 2HD2 LEU 134 -10.577 0.717 2.948 865 H ASN 135 H ASN 135 -9.854 -3.672 6.565 866 HA ASN 135 HA ASN 135 -8.623 -3.345 9.025 867 HB3 ASN 135 2HB ASN 135 -8.492 -5.431 6.810 868 HD21 ASN 135 1HD2 ASN 135 -7.228 -7.179 6.996 869 HD22 ASN 135 2HD2 ASN 135 -6.600 -7.745 8.517 870 H VAL 136 H VAL 136 -6.460 -3.222 9.732 871 HA VAL 136 HA VAL 136 -4.270 -3.029 7.708 872 HB VAL 136 HB VAL 136 -4.719 -1.062 9.970 873 HG11 VAL 136 1HG1 VAL 136 -2.449 -1.283 7.933 874 HG12 VAL 136 2HG1 VAL 136 -2.729 0.116 8.994 875 HG13 VAL 136 3HG1 VAL 136 -2.312 -1.436 9.703 876 HG21 VAL 136 3HG2 VAL 136 -4.860 0.629 8.169 877 HG22 VAL 136 1HG2 VAL 136 -4.732 -0.684 6.977 878 HG23 VAL 136 2HG2 VAL 136 -6.155 -0.562 8.044 879 H ILE 137 H ILE 137 -2.969 -4.733 8.190 880 HA ILE 137 HA ILE 137 -2.669 -5.706 10.907 881 HB ILE 137 HB ILE 137 -0.900 -7.166 9.904 882 HG13 ILE 137 2HG1 ILE 137 -0.492 -5.530 7.950 883 HG21 ILE 137 1HG2 ILE 137 -3.256 -7.866 10.223 884 HG22 ILE 137 2HG2 ILE 137 -3.640 -7.333 8.577 885 HG23 ILE 137 3HG2 ILE 137 -2.489 -8.660 8.850 886 HD11 ILE 137 3HD1 ILE 137 -0.858 -8.430 7.173 887 HD12 ILE 137 1HD1 ILE 137 0.212 -7.236 6.414 888 HD13 ILE 137 2HD1 ILE 137 0.529 -7.803 8.070 889 H GLY 138 H GLY 138 -0.942 -3.186 9.095 890 HA2 GLY 138 1HA GLY 138 0.386 -2.327 11.402 891 HA3 GLY 138 2HA GLY 138 1.488 -3.435 10.599 892 H VAL 139 H VAL 139 2.333 -0.967 10.977 893 HA VAL 139 HA VAL 139 3.066 -0.325 8.314 894 HB VAL 139 HB VAL 139 1.323 1.366 8.481 895 HG11 VAL 139 1HG1 VAL 139 0.943 2.791 10.207 896 HG12 VAL 139 2HG1 VAL 139 0.739 1.123 10.645 897 HG13 VAL 139 3HG1 VAL 139 2.191 1.990 11.245 898 HG21 VAL 139 3HG2 VAL 139 3.823 2.837 9.337 899 HG22 VAL 139 1HG2 VAL 139 3.524 2.282 7.678 900 HG23 VAL 139 2HG2 VAL 139 2.426 3.453 8.426 901 H ALA 140 H ALA 140 5.258 0.322 8.254 902 HA ALA 140 HA ALA 140 6.662 1.223 10.595 903 HB1 ALA 140 1HB ALA 140 7.372 -1.533 9.453 904 HB2 ALA 140 2HB ALA 140 8.348 -0.628 10.629 905 HB3 ALA 140 3HB ALA 140 6.746 -1.175 11.084 906 H ARG 141 H ARG 141 9.281 0.442 9.314 907 HA ARG 141 HA ARG 141 9.000 1.500 6.610 908 HB3 ARG 141 2HB ARG 141 9.838 3.420 8.064 909 HG3 ARG 141 2HG ARG 141 12.392 3.330 8.291 910 HD3 ARG 141 2HD ARG 141 11.121 1.605 10.414 911 HE ARG 141 HE ARG 141 13.091 3.848 10.524 912 HH11 ARG 141 1HH1 ARG 141 12.498 0.373 11.273 913 HH12 ARG 141 2HH1 ARG 141 13.807 0.344 12.411 914 HH21 ARG 141 1HH2 ARG 141 15.025 3.530 11.530 915 HH22 ARG 141 2HH2 ARG 141 15.449 2.016 12.261 916 H ASP 142 H ASP 142 10.854 0.908 5.334 917 HA ASP 142 HA ASP 142 12.308 -0.575 4.445 918 HB3 ASP 142 2HB ASP 142 14.103 -1.515 5.778 919 H ASP 143 H ASP 143 13.200 -3.115 5.623 920 HA ASP 143 HA ASP 143 10.884 -4.725 4.808 921 HB3 ASP 143 2HB ASP 143 12.660 -4.545 3.165 922 H SER 144 H SER 144 11.997 -4.012 7.678 923 HA SER 144 HA SER 144 12.888 -6.522 8.784 924 HB3 SER 144 2HB SER 144 11.919 -3.896 9.856 925 HG SER 144 HG SER 144 12.329 -6.221 11.474 926 H GLU 145 H GLU 145 9.554 -5.107 8.442 927 HA GLU 145 HA GLU 145 8.553 -7.131 10.249 928 HB3 GLU 145 2HB GLU 145 6.441 -5.970 10.045 929 HG3 GLU 145 2HG GLU 145 8.383 -3.688 10.191 930 H VAL 146 H VAL 146 9.412 -7.733 7.179 931 HA VAL 146 HA VAL 146 7.060 -8.546 5.906 932 HB VAL 146 HB VAL 146 9.907 -9.602 5.625 933 HG11 VAL 146 1HG1 VAL 146 7.550 -9.850 3.699 934 HG12 VAL 146 2HG1 VAL 146 9.241 -10.229 3.289 935 HG13 VAL 146 3HG1 VAL 146 8.392 -11.182 4.502 936 HG21 VAL 146 3HG2 VAL 146 9.666 -7.152 5.262 937 HG22 VAL 146 1HG2 VAL 146 10.037 -7.999 3.769 938 HG23 VAL 146 2HG2 VAL 146 8.370 -7.466 4.088 939 H ASP 147 H ASP 147 8.918 -10.222 8.273 940 HA ASP 147 HA ASP 147 7.879 -12.858 8.181 941 HB3 ASP 147 2HB ASP 147 8.516 -11.087 10.591 942 H LYS 148 H LYS 148 6.463 -9.885 9.513 943 HA LYS 148 HA LYS 148 4.138 -11.460 10.498 944 HB3 LYS 148 2HB LYS 148 4.839 -10.039 12.211 945 HG3 LYS 148 2HG LYS 148 4.796 -7.721 10.255 946 HD3 LYS 148 2HD LYS 148 6.023 -6.983 12.697 947 HE3 LYS 148 2HE LYS 148 3.243 -6.263 11.697 948 HZ1 LYS 148 3HZ LYS 148 3.832 -5.413 13.903 949 HZ2 LYS 148 1HZ LYS 148 3.781 -4.188 12.791 950 HZ3 LYS 148 2HZ LYS 148 5.229 -4.743 13.270 951 H TRP 149 H TRP 149 5.146 -9.421 7.888 952 HA TRP 149 HA TRP 149 2.375 -8.910 7.025 953 HB3 TRP 149 2HB TRP 149 3.439 -7.544 5.322 954 HD1 TRP 149 HD TRP 149 2.529 -7.231 8.615 955 HE1 TRP 149 1HE TRP 149 2.976 -4.993 9.617 956 HE3 TRP 149 3HE TRP 149 6.125 -5.653 5.361 957 HZ2 TRP 149 2HZ TRP 149 4.588 -2.602 8.976 958 HZ3 TRP 149 3HZ TRP 149 7.100 -3.353 5.561 959 HH2 TRP 149 HH TRP 149 6.286 -1.815 7.316 960 H SER 150 H SER 150 3.450 -11.728 7.044 961 HA SER 150 HA SER 150 2.475 -12.374 4.387 962 HB3 SER 150 2HB SER 150 5.211 -13.447 5.170 963 HG SER 150 HG SER 150 3.959 -14.565 3.630 964 H LYS 151 H LYS 151 1.855 -12.865 7.404 965 HA LYS 151 HA LYS 151 2.546 -15.624 7.943 966 HB3 LYS 151 2HB LYS 151 1.213 -15.361 9.973 967 HG3 LYS 151 2HG LYS 151 2.936 -12.913 9.459 968 HD3 LYS 151 2HD LYS 151 3.632 -13.397 11.869 969 HE3 LYS 151 2HE LYS 151 2.263 -11.409 11.342 970 HZ1 LYS 151 3HZ LYS 151 0.007 -13.191 11.984 971 HZ2 LYS 151 1HZ LYS 151 0.200 -12.322 10.588 972 HZ3 LYS 151 2HZ LYS 151 -0.100 -11.556 11.986 Start of MODEL 9 1 H1 GLY 1 H GLY 1 -9.873 -24.497 -2.478 2 HA2 GLY 1 1HA GLY 1 -8.743 -22.590 -1.445 3 HA3 GLY 1 2HA GLY 1 -7.959 -24.121 -1.004 4 H MET 2 H MET 2 -7.604 -21.114 -2.683 5 HA MET 2 HA MET 2 -4.870 -21.233 -2.379 6 HB3 MET 2 2HB MET 2 -4.473 -22.459 -4.334 7 HG3 MET 2 2HG MET 2 -6.256 -20.532 -5.862 8 HE1 MET 2 3HE MET 2 -6.966 -22.024 -8.234 9 HE2 MET 2 1HE MET 2 -6.300 -20.387 -8.448 10 HE3 MET 2 2HE MET 2 -5.699 -21.735 -9.440 11 H ALA 3 H ALA 3 -5.654 -19.555 -1.117 12 HA ALA 3 HA ALA 3 -5.796 -16.984 -2.576 13 HB1 ALA 3 1HB ALA 3 -8.085 -17.298 -1.953 14 HB2 ALA 3 2HB ALA 3 -7.649 -17.817 -0.320 15 HB3 ALA 3 3HB ALA 3 -7.363 -16.150 -0.805 16 H LYS 4 H LYS 4 -3.548 -17.144 -2.174 17 HA LYS 4 HA LYS 4 -2.910 -15.693 0.226 18 HB3 LYS 4 2HB LYS 4 -2.771 -17.915 1.176 19 HG3 LYS 4 2HG LYS 4 -0.944 -19.375 0.911 20 HD3 LYS 4 2HD LYS 4 -2.939 -19.635 -0.799 21 HE3 LYS 4 2HE LYS 4 -1.819 -18.196 -2.600 22 HZ1 LYS 4 3HZ LYS 4 0.090 -20.452 -2.612 23 HZ2 LYS 4 1HZ LYS 4 0.464 -18.866 -2.371 24 HZ3 LYS 4 2HZ LYS 4 -0.075 -19.378 -3.824 25 H LYS 5 H LYS 5 -3.003 -14.815 -2.259 26 HA LYS 5 HA LYS 5 -0.236 -14.662 -3.400 27 HB3 LYS 5 2HB LYS 5 -1.418 -12.886 -4.865 28 HG3 LYS 5 2HG LYS 5 -3.168 -14.731 -5.738 29 HD3 LYS 5 2HD LYS 5 -0.976 -16.110 -6.530 30 HE3 LYS 5 2HE LYS 5 -0.550 -14.200 -8.229 31 HZ1 LYS 5 3HZ LYS 5 -1.960 -15.936 -8.796 32 HZ2 LYS 5 1HZ LYS 5 -2.769 -14.587 -9.225 33 HZ3 LYS 5 2HZ LYS 5 -3.209 -15.407 -7.853 34 H THR 6 H THR 6 0.406 -12.287 -3.802 35 HA THR 6 HA THR 6 -0.278 -10.518 -1.534 36 HB THR 6 HB THR 6 2.579 -11.337 -2.008 37 HG1 THR 6 1HG THR 6 0.721 -12.230 -0.100 38 HG21 THR 6 3HG2 THR 6 2.389 -9.057 -1.102 39 HG22 THR 6 1HG2 THR 6 2.864 -10.132 0.234 40 HG23 THR 6 2HG2 THR 6 1.187 -9.586 0.094 41 H LEU 7 H LEU 7 -0.942 -8.796 -2.670 42 HA LEU 7 HA LEU 7 0.545 -7.943 -5.127 43 HB3 LEU 7 2HB LEU 7 -1.976 -6.900 -3.850 44 HG LEU 7 HG LEU 7 -0.938 -5.112 -5.185 45 HD11 LEU 7 1HD1 LEU 7 -0.587 -5.429 -7.652 46 HD12 LEU 7 2HD1 LEU 7 -0.811 -7.176 -7.433 47 HD13 LEU 7 3HD1 LEU 7 0.568 -6.332 -6.682 48 HD21 LEU 7 3HD2 LEU 7 -2.772 -4.821 -6.827 49 HD22 LEU 7 1HD2 LEU 7 -3.382 -5.422 -5.273 50 HD23 LEU 7 2HD2 LEU 7 -3.203 -6.536 -6.648 51 H ILE 8 H ILE 8 2.421 -6.879 -4.683 52 HA ILE 8 HA ILE 8 2.448 -4.822 -2.566 53 HB ILE 8 HB ILE 8 4.574 -5.530 -4.606 54 HG13 ILE 8 2HG1 ILE 8 4.010 -7.509 -3.071 55 HG21 ILE 8 1HG2 ILE 8 4.814 -3.290 -3.588 56 HG22 ILE 8 2HG2 ILE 8 4.703 -4.001 -1.969 57 HG23 ILE 8 3HG2 ILE 8 6.095 -4.346 -3.011 58 HD11 ILE 8 3HD1 ILE 8 6.832 -6.464 -2.709 59 HD12 ILE 8 1HD1 ILE 8 6.258 -8.140 -2.722 60 HD13 ILE 8 2HD1 ILE 8 6.221 -7.200 -4.211 61 H LEU 9 H LEU 9 2.024 -2.695 -3.097 62 HA LEU 9 HA LEU 9 2.203 -1.806 -5.933 63 HB3 LEU 9 2HB LEU 9 0.390 -0.129 -5.250 64 HG LEU 9 HG LEU 9 -0.043 -3.006 -5.817 65 HD11 LEU 9 1HD1 LEU 9 -2.260 -1.472 -4.402 66 HD12 LEU 9 2HD1 LEU 9 -1.406 -2.934 -3.830 67 HD13 LEU 9 3HD1 LEU 9 -2.445 -3.021 -5.254 68 HD21 LEU 9 3HD2 LEU 9 -1.495 -2.234 -7.480 69 HD22 LEU 9 1HD2 LEU 9 -0.141 -1.085 -7.459 70 HD23 LEU 9 2HD2 LEU 9 -1.692 -0.630 -6.728 71 H TYR 10 H TYR 10 3.437 0.245 -6.036 72 HA TYR 10 HA TYR 10 3.664 1.741 -3.584 73 HB3 TYR 10 2HB TYR 10 5.461 -0.089 -3.231 74 HD1 TYR 10 1HD TYR 10 5.581 -0.084 -6.490 75 HD2 TYR 10 2HD TYR 10 8.167 0.961 -3.224 76 HE1 TYR 10 1HE TYR 10 7.403 0.215 -8.102 77 HE2 TYR 10 2HE TYR 10 9.920 1.609 -4.880 78 HH TYR 10 HH TYR 10 9.408 1.486 -8.388 79 H TYR 11 H TYR 11 5.243 3.655 -3.858 80 HA TYR 11 HA TYR 11 5.071 4.660 -6.652 81 HB3 TYR 11 2HB TYR 11 4.510 6.064 -4.051 82 HD1 TYR 11 1HD TYR 11 5.244 6.605 -7.747 83 HD2 TYR 11 2HD TYR 11 4.463 8.445 -3.928 84 HE1 TYR 11 1HE TYR 11 5.951 8.764 -8.654 85 HE2 TYR 11 2HE TYR 11 5.202 10.617 -4.831 86 HH TYR 11 HH TYR 11 5.891 11.108 -8.251 87 H SER 12 H SER 12 7.204 4.725 -7.477 88 HA SER 12 HA SER 12 9.530 5.378 -5.810 89 HB3 SER 12 2HB SER 12 9.893 3.812 -7.533 90 HG SER 12 HG SER 12 9.010 3.919 -9.384 91 H TRP 13 H TRP 13 9.278 7.354 -4.940 92 HA TRP 13 HA TRP 13 8.196 9.640 -5.923 93 HB3 TRP 13 2HB TRP 13 10.648 9.430 -4.209 94 HD1 TRP 13 HD TRP 13 7.470 11.598 -4.689 95 HE1 TRP 13 1HE TRP 13 7.961 13.958 -4.045 96 HE3 TRP 13 3HE TRP 13 12.331 11.031 -3.148 97 HZ2 TRP 13 2HZ TRP 13 10.324 15.553 -3.318 98 HZ3 TRP 13 3HZ TRP 13 13.677 12.998 -2.497 99 HH2 TRP 13 HH TRP 13 12.688 15.266 -2.616 100 H SER 14 H SER 14 11.729 8.988 -6.046 101 HA SER 14 HA SER 14 11.842 10.035 -8.816 102 HB3 SER 14 2HB SER 14 13.807 10.801 -6.634 103 HG SER 14 HG SER 14 14.517 12.234 -8.290 104 H GLY 15 H GLY 15 13.382 8.109 -6.188 105 HA2 GLY 15 1HA GLY 15 13.530 5.806 -7.773 106 HA3 GLY 15 2HA GLY 15 15.082 6.618 -7.968 107 H GLU 16 H GLU 16 13.983 7.279 -4.784 108 HA GLU 16 HA GLU 16 15.970 5.428 -3.704 109 HB3 GLU 16 2HB GLU 16 15.090 6.226 -1.525 110 HG3 GLU 16 2HG GLU 16 15.564 8.574 -3.402 111 H THR 17 H THR 17 12.386 5.807 -3.367 112 HA THR 17 HA THR 17 11.780 3.757 -1.804 113 HB THR 17 HB THR 17 10.189 4.299 -4.268 114 HG1 THR 17 1HG THR 17 9.189 5.973 -3.038 115 HG21 THR 17 3HG2 THR 17 8.218 3.811 -2.862 116 HG22 THR 17 1HG2 THR 17 9.191 3.943 -1.383 117 HG23 THR 17 2HG2 THR 17 9.392 2.571 -2.475 118 H LYS 18 H LYS 18 12.564 3.445 -5.277 119 HA LYS 18 HA LYS 18 11.576 0.891 -5.870 120 HB3 LYS 18 2HB LYS 18 12.604 2.724 -7.402 121 HG3 LYS 18 2HG LYS 18 15.004 0.880 -7.276 122 HD3 LYS 18 2HD LYS 18 14.481 3.627 -8.485 123 HE3 LYS 18 2HE LYS 18 17.154 2.172 -8.347 124 HZ1 LYS 18 3HZ LYS 18 17.911 4.458 -8.944 125 HZ2 LYS 18 1HZ LYS 18 16.389 4.863 -9.341 126 HZ3 LYS 18 2HZ LYS 18 17.168 3.639 -10.144 127 H LYS 19 H LYS 19 14.498 1.688 -4.130 128 HA LYS 19 HA LYS 19 15.764 -0.840 -4.452 129 HB3 LYS 19 2HB LYS 19 16.127 0.999 -2.040 130 HG3 LYS 19 2HG LYS 19 17.958 -0.594 -3.893 131 HD3 LYS 19 2HD LYS 19 19.842 0.378 -2.524 132 HE3 LYS 19 2HE LYS 19 20.102 2.471 -3.726 133 HZ1 LYS 19 3HZ LYS 19 19.690 1.814 -5.958 134 HZ2 LYS 19 1HZ LYS 19 18.613 0.674 -5.560 135 HZ3 LYS 19 2HZ LYS 19 20.200 0.471 -5.170 136 H MET 20 H MET 20 13.927 0.520 -1.713 137 HA MET 20 HA MET 20 13.254 -2.045 -0.538 138 HB3 MET 20 2HB MET 20 12.058 0.694 0.067 139 HG3 MET 20 2HG MET 20 10.999 -1.192 1.146 140 HE1 MET 20 3HE MET 20 15.036 -2.233 3.221 141 HE2 MET 20 1HE MET 20 14.846 -0.960 2.014 142 HE3 MET 20 2HE MET 20 14.069 -0.791 3.588 143 H ALA 21 H ALA 21 12.539 -2.387 -2.953 144 HA ALA 21 HA ALA 21 9.607 -2.651 -2.833 145 HB1 ALA 21 1HB ALA 21 10.758 -1.752 -5.492 146 HB2 ALA 21 2HB ALA 21 9.085 -1.779 -4.892 147 HB3 ALA 21 3HB ALA 21 10.234 -0.611 -4.233 148 H GLU 22 H GLU 22 12.438 -3.037 -5.027 149 HA GLU 22 HA GLU 22 11.999 -5.640 -5.943 150 HB3 GLU 22 2HB GLU 22 14.410 -5.762 -6.381 151 HG3 GLU 22 2HG GLU 22 13.709 -2.830 -6.645 152 H LYS 23 H LYS 23 13.801 -4.567 -3.030 153 HA LYS 23 HA LYS 23 14.801 -7.027 -2.116 154 HB3 LYS 23 2HB LYS 23 13.891 -4.549 -0.594 155 HG3 LYS 23 2HG LYS 23 15.424 -7.007 0.343 156 HD3 LYS 23 2HD LYS 23 15.234 -4.272 1.673 157 HE3 LYS 23 2HE LYS 23 16.339 -6.961 2.551 158 HZ1 LYS 23 3HZ LYS 23 16.307 -4.456 4.098 159 HZ2 LYS 23 1HZ LYS 23 17.692 -5.095 3.373 160 HZ3 LYS 23 2HZ LYS 23 16.883 -5.868 4.589 161 H ILE 24 H ILE 24 11.747 -5.526 -1.061 162 HA ILE 24 HA ILE 24 10.900 -7.811 0.461 163 HB ILE 24 HB ILE 24 9.449 -5.399 -0.754 164 HG13 ILE 24 2HG1 ILE 24 11.409 -5.086 1.077 165 HG21 ILE 24 1HG2 ILE 24 8.519 -7.339 1.388 166 HG22 ILE 24 2HG2 ILE 24 7.741 -5.772 1.076 167 HG23 ILE 24 3HG2 ILE 24 7.775 -6.995 -0.197 168 HD11 ILE 24 3HD1 ILE 24 8.709 -3.714 1.117 169 HD12 ILE 24 1HD1 ILE 24 10.106 -3.186 2.070 170 HD13 ILE 24 2HD1 ILE 24 10.183 -3.196 0.297 171 H ASN 25 H ASN 25 10.335 -6.811 -2.967 172 HA ASN 25 HA ASN 25 8.546 -9.019 -3.478 173 HB3 ASN 25 2HB ASN 25 10.243 -7.437 -5.437 174 HD21 ASN 25 1HD2 ASN 25 7.206 -9.462 -4.922 175 HD22 ASN 25 2HD2 ASN 25 7.052 -9.809 -6.606 176 H SER 26 H SER 26 11.781 -9.055 -2.750 177 HA SER 26 HA SER 26 12.166 -11.692 -4.003 178 HB3 SER 26 2HB SER 26 14.365 -10.874 -2.313 179 HG SER 26 HG SER 26 13.972 -12.018 -4.642 180 H GLU 27 H GLU 27 12.059 -10.056 -0.749 181 HA GLU 27 HA GLU 27 12.307 -12.601 0.551 182 HB3 GLU 27 2HB GLU 27 13.402 -11.044 1.668 183 HG3 GLU 27 2HG GLU 27 11.123 -9.155 2.001 184 H ILE 28 H ILE 28 9.486 -11.085 -0.631 185 HA ILE 28 HA ILE 28 7.714 -12.692 1.107 186 HB ILE 28 HB ILE 28 7.153 -10.839 -1.261 187 HG13 ILE 28 2HG1 ILE 28 7.896 -9.741 0.862 188 HG21 ILE 28 1HG2 ILE 28 5.360 -12.643 -1.062 189 HG22 ILE 28 2HG2 ILE 28 5.101 -12.118 0.614 190 HG23 ILE 28 3HG2 ILE 28 4.791 -11.033 -0.752 191 HD11 ILE 28 3HD1 ILE 28 4.913 -9.281 0.611 192 HD12 ILE 28 1HD1 ILE 28 6.141 -8.177 1.188 193 HD13 ILE 28 2HD1 ILE 28 6.105 -8.620 -0.535 194 H LYS 29 H LYS 29 6.293 -14.229 -0.003 195 HA LYS 29 HA LYS 29 7.461 -16.253 -1.573 196 HB3 LYS 29 2HB LYS 29 4.518 -16.061 -1.880 197 HG3 LYS 29 2HG LYS 29 4.440 -18.033 -0.554 198 HD3 LYS 29 2HD LYS 29 5.149 -18.512 -2.885 199 HE3 LYS 29 2HE LYS 29 7.488 -17.671 -2.940 200 HZ1 LYS 29 3HZ LYS 29 9.209 -18.737 -1.792 201 HZ2 LYS 29 1HZ LYS 29 8.235 -19.890 -1.149 202 HZ3 LYS 29 2HZ LYS 29 8.154 -18.309 -0.647 203 H ASP 30 H ASP 30 5.485 -16.727 -3.505 204 HA ASP 30 HA ASP 30 6.507 -15.531 -5.873 205 HB3 ASP 30 2HB ASP 30 4.184 -17.432 -5.414 206 H SER 31 H SER 31 5.895 -13.521 -4.684 207 HA SER 31 HA SER 31 3.122 -12.614 -4.789 208 HB3 SER 31 2HB SER 31 4.695 -12.098 -2.930 209 HG SER 31 HG SER 31 6.601 -11.328 -3.698 210 H GLU 32 H GLU 32 3.012 -10.030 -5.481 211 HA GLU 32 HA GLU 32 4.005 -9.846 -8.238 212 HB3 GLU 32 2HB GLU 32 1.299 -8.857 -7.327 213 HG3 GLU 32 2HG GLU 32 2.354 -8.237 -9.637 214 H LEU 33 H LEU 33 4.105 -7.713 -8.875 215 HA LEU 33 HA LEU 33 4.471 -5.585 -6.806 216 HB3 LEU 33 2HB LEU 33 6.636 -6.547 -8.707 217 HG LEU 33 HG LEU 33 6.766 -4.038 -8.230 218 HD11 LEU 33 1HD1 LEU 33 7.270 -5.030 -5.383 219 HD12 LEU 33 2HD1 LEU 33 5.916 -3.992 -5.921 220 HD13 LEU 33 3HD1 LEU 33 7.589 -3.396 -5.953 221 HD21 LEU 33 3HD2 LEU 33 9.019 -5.677 -6.999 222 HD22 LEU 33 1HD2 LEU 33 9.127 -4.055 -7.722 223 HD23 LEU 33 2HD2 LEU 33 8.774 -5.466 -8.730 224 H LYS 34 H LYS 34 2.889 -4.317 -7.611 225 HA LYS 34 HA LYS 34 3.051 -3.347 -10.435 226 HB3 LYS 34 2HB LYS 34 1.133 -1.786 -9.143 227 HG3 LYS 34 2HG LYS 34 -0.584 -3.455 -10.079 228 HD3 LYS 34 2HD LYS 34 1.487 -2.204 -11.943 229 HE3 LYS 34 2HE LYS 34 -1.119 -3.671 -12.430 230 HZ1 LYS 34 3HZ LYS 34 -1.432 -1.560 -13.455 231 HZ2 LYS 34 1HZ LYS 34 -1.155 -2.682 -14.615 232 HZ3 LYS 34 2HZ LYS 34 0.047 -1.629 -14.223 233 H GLU 35 H GLU 35 3.117 -0.974 -10.656 234 HA GLU 35 HA GLU 35 4.251 0.446 -8.329 235 HB3 GLU 35 2HB GLU 35 5.827 -0.063 -10.439 236 HG3 GLU 35 2HG GLU 35 4.509 2.589 -11.187 237 H VAL 36 H VAL 36 3.707 2.773 -8.460 238 HA VAL 36 HA VAL 36 1.296 3.446 -10.051 239 HB VAL 36 HB VAL 36 1.731 4.212 -7.148 240 HG11 VAL 36 1HG1 VAL 36 -0.796 3.890 -8.798 241 HG12 VAL 36 2HG1 VAL 36 -0.718 4.515 -7.157 242 HG13 VAL 36 3HG1 VAL 36 -0.013 5.448 -8.482 243 HG21 VAL 36 3HG2 VAL 36 0.121 2.420 -6.448 244 HG22 VAL 36 1HG2 VAL 36 0.271 1.699 -8.058 245 HG23 VAL 36 2HG2 VAL 36 1.672 1.787 -6.969 246 H LYS 37 H LYS 37 1.162 5.943 -10.336 247 HA LYS 37 HA LYS 37 3.107 7.464 -8.963 248 HB3 LYS 37 2HB LYS 37 4.316 6.814 -11.082 249 HG3 LYS 37 2HG LYS 37 3.823 8.644 -12.898 250 HD3 LYS 37 2HD LYS 37 2.218 6.064 -13.075 251 HE3 LYS 37 2HE LYS 37 3.630 7.898 -15.094 252 HZ1 LYS 37 3HZ LYS 37 2.252 5.373 -15.430 253 HZ2 LYS 37 1HZ LYS 37 3.472 6.030 -16.317 254 HZ3 LYS 37 2HZ LYS 37 1.938 6.556 -16.535 255 H VAL 38 H VAL 38 2.690 9.841 -9.431 256 HA VAL 38 HA VAL 38 -0.165 10.445 -9.870 257 HB VAL 38 HB VAL 38 0.510 12.676 -8.817 258 HG11 VAL 38 1HG1 VAL 38 0.445 11.732 -6.419 259 HG12 VAL 38 2HG1 VAL 38 -0.906 11.386 -7.490 260 HG13 VAL 38 3HG1 VAL 38 0.303 10.139 -7.204 261 HG21 VAL 38 3HG2 VAL 38 2.899 11.143 -7.711 262 HG22 VAL 38 1HG2 VAL 38 2.980 12.406 -8.956 263 HG23 VAL 38 2HG2 VAL 38 2.410 12.805 -7.335 264 H SER 39 H SER 39 -0.328 12.641 -11.071 265 HA SER 39 HA SER 39 1.041 12.708 -13.472 266 HB3 SER 39 2HB SER 39 -0.092 15.206 -12.860 267 HG SER 39 HG SER 39 -2.049 14.195 -13.659 268 H GLU 40 H GLU 40 1.918 15.093 -14.045 269 HA GLU 40 HA GLU 40 4.269 15.721 -12.352 270 HB3 GLU 40 2HB GLU 40 4.435 17.556 -14.237 271 HG3 GLU 40 2HG GLU 40 4.884 14.583 -14.519 272 H GLY 41 H GLY 41 4.513 18.072 -11.776 273 HA2 GLY 41 1HA GLY 41 3.883 19.996 -10.844 274 HA3 GLY 41 2HA GLY 41 2.486 19.927 -11.932 275 H THR 42 H THR 42 2.399 17.232 -9.830 276 HA THR 42 HA THR 42 -0.050 18.336 -8.750 277 HB THR 42 HB THR 42 1.337 15.628 -8.641 278 HG1 THR 42 1HG THR 42 0.497 16.521 -10.659 279 HG21 THR 42 3HG2 THR 42 -0.179 15.734 -6.711 280 HG22 THR 42 1HG2 THR 42 -0.757 14.609 -7.947 281 HG23 THR 42 2HG2 THR 42 -1.515 16.204 -7.755 282 H PHE 43 H PHE 43 3.211 17.853 -7.527 283 HA PHE 43 HA PHE 43 2.405 19.368 -5.151 284 HB3 PHE 43 2HB PHE 43 3.689 17.964 -3.610 285 HD1 PHE 43 2HD PHE 43 1.209 18.500 -3.250 286 HD2 PHE 43 1HD PHE 43 2.600 14.932 -5.175 287 HE1 PHE 43 2HE PHE 43 -0.948 17.377 -2.665 288 HE2 PHE 43 1HE PHE 43 0.419 13.824 -4.659 289 HZ PHE 43 HZ PHE 43 -1.314 15.021 -3.365 290 H ASP 44 H ASP 44 4.897 19.448 -3.898 291 HA ASP 44 HA ASP 44 6.972 19.897 -5.812 292 HB3 ASP 44 2HB ASP 44 6.379 22.255 -3.983 293 H ALA 45 H ALA 45 8.719 21.090 -3.850 294 HA ALA 45 HA ALA 45 8.292 19.612 -1.318 295 HB1 ALA 45 1HB ALA 45 10.709 18.976 -1.332 296 HB2 ALA 45 2HB ALA 45 9.678 18.141 -2.509 297 HB3 ALA 45 3HB ALA 45 10.777 19.456 -3.041 298 H ASP 46 H ASP 46 8.631 22.529 -2.716 299 HA ASP 46 HA ASP 46 10.506 23.839 -1.023 300 HB3 ASP 46 2HB ASP 46 8.357 25.636 -1.688 301 H MET 47 H MET 47 9.908 25.469 0.736 302 HA MET 47 HA MET 47 8.582 24.051 2.845 303 HB3 MET 47 2HB MET 47 9.875 26.796 2.543 304 HG3 MET 47 2HG MET 47 9.190 25.485 5.168 305 HE1 MET 47 3HE MET 47 8.538 29.200 4.154 306 HE2 MET 47 1HE MET 47 10.069 30.015 4.531 307 HE3 MET 47 2HE MET 47 9.972 28.917 3.139 308 H TYR 48 H TYR 48 7.931 27.481 1.744 309 HA TYR 48 HA TYR 48 5.309 27.339 2.925 310 HB3 TYR 48 2HB TYR 48 6.494 29.434 2.727 311 HD1 TYR 48 1HD TYR 48 4.751 29.601 -0.566 312 HD2 TYR 48 2HD TYR 48 8.560 29.680 1.467 313 HE1 TYR 48 1HE TYR 48 5.866 30.305 -2.657 314 HE2 TYR 48 2HE TYR 48 9.667 30.364 -0.565 315 HH TYR 48 HH TYR 48 9.209 31.378 -2.733 316 H LYS 49 H LYS 49 6.504 26.489 -0.228 317 HA LYS 49 HA LYS 49 3.949 26.523 -1.535 318 HB3 LYS 49 2HB LYS 49 6.198 24.565 -2.228 319 HG3 LYS 49 2HG LYS 49 3.845 24.658 -3.399 320 HD3 LYS 49 2HD LYS 49 5.061 26.494 -5.362 321 HE3 LYS 49 2HE LYS 49 2.686 25.475 -5.345 322 HZ1 LYS 49 3HZ LYS 49 1.050 26.809 -4.176 323 HZ2 LYS 49 1HZ LYS 49 2.211 27.832 -3.642 324 HZ3 LYS 49 2HZ LYS 49 2.121 26.286 -3.061 325 H THR 50 H THR 50 5.734 23.485 -0.174 326 HA THR 50 HA THR 50 3.249 22.143 -0.417 327 HB THR 50 HB THR 50 4.446 20.293 0.355 328 HG1 THR 50 1HG THR 50 6.633 22.033 0.987 329 HG21 THR 50 3HG2 THR 50 4.827 21.040 -1.934 330 HG22 THR 50 1HG2 THR 50 6.232 20.217 -1.208 331 HG23 THR 50 2HG2 THR 50 6.262 21.965 -1.415 332 H SER 51 H SER 51 4.594 24.068 2.250 333 HA SER 51 HA SER 51 2.838 23.153 4.298 334 HB3 SER 51 2HB SER 51 3.119 25.460 5.180 335 HG SER 51 HG SER 51 4.836 23.814 5.388 336 H ASP 52 H ASP 52 2.125 24.842 1.299 337 HA ASP 52 HA ASP 52 -0.543 25.693 2.295 338 HB3 ASP 52 2HB ASP 52 0.715 26.099 -0.467 339 H ILE 53 H ILE 53 0.901 23.899 -0.464 340 HA ILE 53 HA ILE 53 -1.469 23.022 -1.555 341 HB ILE 53 HB ILE 53 1.226 21.595 -1.604 342 HG13 ILE 53 2HG1 ILE 53 1.028 23.967 -2.612 343 HG21 ILE 53 1HG2 ILE 53 -0.384 19.917 -2.206 344 HG22 ILE 53 2HG2 ILE 53 -1.349 21.068 -3.128 345 HG23 ILE 53 3HG2 ILE 53 0.195 20.517 -3.764 346 HD11 ILE 53 3HD1 ILE 53 2.837 22.395 -3.274 347 HD12 ILE 53 1HD1 ILE 53 1.789 21.746 -4.554 348 HD13 ILE 53 2HD1 ILE 53 2.295 23.429 -4.616 349 H ALA 54 H ALA 54 0.511 21.061 0.790 350 HA ALA 54 HA ALA 54 -1.419 18.939 0.648 351 HB1 ALA 54 1HB ALA 54 1.098 19.065 1.738 352 HB2 ALA 54 2HB ALA 54 0.107 19.191 3.194 353 HB3 ALA 54 3HB ALA 54 -0.121 17.802 2.134 354 H LEU 55 H LEU 55 -0.887 21.603 2.940 355 HA LEU 55 HA LEU 55 -2.573 20.938 4.977 356 HB3 LEU 55 2HB LEU 55 -2.236 23.736 3.822 357 HG LEU 55 HG LEU 55 -1.697 24.300 6.248 358 HD11 LEU 55 1HD1 LEU 55 -3.650 25.083 5.047 359 HD12 LEU 55 2HD1 LEU 55 -3.999 24.788 6.760 360 HD13 LEU 55 3HD1 LEU 55 -4.525 23.614 5.520 361 HD21 LEU 55 3HD2 LEU 55 -2.657 23.036 8.031 362 HD22 LEU 55 1HD2 LEU 55 -1.538 21.993 7.131 363 HD23 LEU 55 2HD2 LEU 55 -3.293 21.815 6.913 364 H ASP 56 H ASP 56 -3.365 22.686 2.031 365 HA ASP 56 HA ASP 56 -6.023 23.528 2.595 366 HB3 ASP 56 2HB ASP 56 -4.565 22.960 -0.072 367 H GLN 57 H GLN 57 -4.643 20.728 0.835 368 HA GLN 57 HA GLN 57 -7.161 19.452 0.152 369 HB3 GLN 57 2HB GLN 57 -5.730 17.678 -0.705 370 HG3 GLN 57 2HG GLN 57 -3.671 19.315 -1.586 371 HE21 GLN 57 1HE2 GLN 57 -4.182 17.538 -3.243 372 HE22 GLN 57 2HE2 GLN 57 -5.157 18.134 -4.580 373 H ILE 58 H ILE 58 -4.726 18.951 2.694 374 HA ILE 58 HA ILE 58 -5.708 16.624 3.933 375 HB ILE 58 HB ILE 58 -4.079 19.001 4.890 376 HG13 ILE 58 2HG1 ILE 58 -3.118 17.259 3.293 377 HG21 ILE 58 1HG2 ILE 58 -5.023 16.673 6.580 378 HG22 ILE 58 2HG2 ILE 58 -3.565 17.613 6.984 379 HG23 ILE 58 3HG2 ILE 58 -5.128 18.401 6.928 380 HD11 ILE 58 3HD1 ILE 58 -0.993 17.142 4.344 381 HD12 ILE 58 1HD1 ILE 58 -1.712 18.680 4.900 382 HD13 ILE 58 2HD1 ILE 58 -1.662 17.262 5.969 383 H GLN 59 H GLN 59 -6.345 20.071 4.755 384 HA GLN 59 HA GLN 59 -7.904 19.375 7.031 385 HB3 GLN 59 2HB GLN 59 -8.559 21.862 6.867 386 HG3 GLN 59 2HG GLN 59 -5.553 21.287 6.740 387 HE21 GLN 59 1HE2 GLN 59 -7.072 23.762 5.922 388 HE22 GLN 59 2HE2 GLN 59 -6.590 25.013 7.023 389 H GLY 60 H GLY 60 -8.841 18.862 3.845 390 HA2 GLY 60 1HA GLY 60 -10.904 18.492 2.882 391 HA3 GLY 60 2HA GLY 60 -11.672 18.736 4.461 392 H ASN 61 H ASN 61 -9.451 21.188 3.236 393 HA ASN 61 HA ASN 61 -11.658 23.105 2.794 394 HB3 ASN 61 2HB ASN 61 -9.883 24.706 2.259 395 HD21 ASN 61 1HD2 ASN 61 -8.097 25.543 3.786 396 HD22 ASN 61 2HD2 ASN 61 -8.301 25.365 5.506 397 H LYS 62 H LYS 62 -9.192 21.162 1.092 398 HA LYS 62 HA LYS 62 -10.474 21.831 -1.504 399 HB3 LYS 62 2HB LYS 62 -8.196 21.248 -2.525 400 HG3 LYS 62 2HG LYS 62 -7.018 23.199 -1.905 401 HD3 LYS 62 2HD LYS 62 -9.482 24.652 -2.078 402 HE3 LYS 62 2HE LYS 62 -7.096 24.090 -3.711 403 HZ1 LYS 62 3HZ LYS 62 -9.673 24.468 -5.091 404 HZ2 LYS 62 1HZ LYS 62 -8.661 23.172 -5.229 405 HZ3 LYS 62 2HZ LYS 62 -8.203 24.644 -5.812 406 H ASP 63 H ASP 63 -9.507 20.172 -3.051 407 HA ASP 63 HA ASP 63 -10.838 17.593 -2.530 408 HB3 ASP 63 2HB ASP 63 -9.667 18.532 -5.164 409 H PHE 64 H PHE 64 -9.082 16.206 -4.601 410 HA PHE 64 HA PHE 64 -6.702 15.716 -2.911 411 HB3 PHE 64 2HB PHE 64 -8.469 14.406 -2.040 412 HD1 PHE 64 2HD PHE 64 -8.369 13.440 -5.767 413 HD2 PHE 64 1HD PHE 64 -10.407 13.190 -1.945 414 HE1 PHE 64 2HE PHE 64 -10.226 12.303 -6.829 415 HE2 PHE 64 1HE PHE 64 -12.253 12.004 -3.052 416 HZ PHE 64 HZ PHE 64 -12.194 11.567 -5.484 417 HA PRO 65 HA PRO 65 -4.661 15.154 -6.736 418 HB3 PRO 65 2HB PRO 65 -2.725 14.850 -5.530 419 HG3 PRO 65 2HG PRO 65 -2.649 13.256 -3.704 420 HD3 PRO 65 2HD PRO 65 -4.367 14.825 -3.210 421 H GLU 66 H GLU 66 -3.873 13.622 -8.464 422 HA GLU 66 HA GLU 66 -5.848 11.475 -9.020 423 HB3 GLU 66 2HB GLU 66 -6.088 13.404 -10.521 424 HG3 GLU 66 2HG GLU 66 -3.091 13.114 -10.907 425 H ILE 67 H ILE 67 -5.038 9.566 -10.333 426 HA ILE 67 HA ILE 67 -2.100 9.148 -10.109 427 HB ILE 67 HB ILE 67 -2.388 6.916 -9.203 428 HG13 ILE 67 2HG1 ILE 67 -4.688 6.467 -10.024 429 HG21 ILE 67 1HG2 ILE 67 -1.800 8.696 -7.720 430 HG22 ILE 67 2HG2 ILE 67 -3.477 9.196 -7.519 431 HG23 ILE 67 3HG2 ILE 67 -2.956 7.667 -6.861 432 HD11 ILE 67 3HD1 ILE 67 -3.803 5.018 -8.248 433 HD12 ILE 67 1HD1 ILE 67 -4.520 6.088 -7.034 434 HD13 ILE 67 2HD1 ILE 67 -5.567 5.225 -8.177 435 H GLN 68 H GLN 68 -1.206 7.601 -11.342 436 HA GLN 68 HA GLN 68 -2.610 7.089 -13.907 437 HB3 GLN 68 2HB GLN 68 -0.309 6.922 -14.799 438 HG3 GLN 68 2HG GLN 68 0.582 9.219 -14.073 439 HE21 GLN 68 1HE2 GLN 68 -1.331 11.275 -13.985 440 HE22 GLN 68 2HE2 GLN 68 -2.149 11.352 -15.501 441 H LEU 69 H LEU 69 -3.647 5.478 -12.600 442 HA LEU 69 HA LEU 69 -2.202 2.861 -12.592 443 HB3 LEU 69 2HB LEU 69 -3.881 3.954 -10.304 444 HG LEU 69 HG LEU 69 -2.624 2.415 -8.861 445 HD11 LEU 69 1HD1 LEU 69 -4.006 0.574 -9.072 446 HD12 LEU 69 2HD1 LEU 69 -4.071 0.681 -10.828 447 HD13 LEU 69 3HD1 LEU 69 -4.934 1.871 -9.851 448 HD21 LEU 69 3HD2 LEU 69 -1.405 0.488 -9.721 449 HD22 LEU 69 1HD2 LEU 69 -0.677 1.984 -10.327 450 HD23 LEU 69 2HD2 LEU 69 -1.688 1.004 -11.392 451 H ASP 70 H ASP 70 -3.351 1.181 -13.031 452 HA ASP 70 HA ASP 70 -5.774 1.677 -14.639 453 HB3 ASP 70 2HB ASP 70 -4.569 -1.035 -14.543 454 H ASN 71 H ASN 71 -7.309 -0.273 -14.867 455 HA ASN 71 HA ASN 71 -8.488 -0.420 -12.166 456 HB3 ASN 71 2HB ASN 71 -10.215 -1.266 -14.450 457 HD21 ASN 71 1HD2 ASN 71 -11.506 -1.678 -12.321 458 HD22 ASN 71 2HD2 ASN 71 -12.335 -0.241 -11.730 459 H ILE 72 H ILE 72 -8.330 -2.194 -11.008 460 HA ILE 72 HA ILE 72 -8.320 -4.865 -12.314 461 HB ILE 72 HB ILE 72 -6.199 -3.717 -10.447 462 HG13 ILE 72 2HG1 ILE 72 -5.898 -2.886 -12.744 463 HG21 ILE 72 1HG2 ILE 72 -6.680 -6.103 -9.938 464 HG22 ILE 72 2HG2 ILE 72 -6.383 -6.520 -11.648 465 HG23 ILE 72 3HG2 ILE 72 -5.079 -5.902 -10.612 466 HD11 ILE 72 3HD1 ILE 72 -3.877 -3.642 -11.560 467 HD12 ILE 72 1HD1 ILE 72 -3.942 -5.153 -12.502 468 HD13 ILE 72 2HD1 ILE 72 -3.796 -3.579 -13.326 469 H ASP 73 H ASP 73 -9.293 -6.414 -11.146 470 HA ASP 73 HA ASP 73 -10.775 -5.701 -8.731 471 HB3 ASP 73 2HB ASP 73 -11.007 -8.402 -8.864 472 H TYR 74 H TYR 74 -9.725 -5.504 -6.885 473 HA TYR 74 HA TYR 74 -7.338 -7.079 -6.319 474 HB3 TYR 74 2HB TYR 74 -7.254 -5.716 -4.303 475 HD1 TYR 74 1HD TYR 74 -5.631 -5.597 -6.597 476 HD2 TYR 74 2HD TYR 74 -8.832 -2.932 -5.537 477 HE1 TYR 74 1HE TYR 74 -4.688 -3.892 -8.093 478 HE2 TYR 74 2HE TYR 74 -7.819 -1.138 -6.888 479 HH TYR 74 HH TYR 74 -4.905 -1.698 -8.951 480 H ASN 75 H ASN 75 -10.604 -7.862 -6.070 481 HA ASN 75 HA ASN 75 -10.605 -9.090 -3.461 482 HB3 ASN 75 2HB ASN 75 -12.502 -10.027 -5.585 483 HD21 ASN 75 1HD2 ASN 75 -13.185 -7.781 -2.949 484 HD22 ASN 75 2HD2 ASN 75 -13.993 -8.956 -1.927 485 H ASN 76 H ASN 76 -8.500 -9.993 -5.632 486 HA ASN 76 HA ASN 76 -8.863 -12.924 -5.493 487 HB3 ASN 76 2HB ASN 76 -7.457 -12.959 -7.456 488 HD21 ASN 76 1HD2 ASN 76 -8.779 -9.894 -8.514 489 HD22 ASN 76 2HD2 ASN 76 -10.260 -10.557 -9.147 490 H TYR 77 H TYR 77 -7.519 -10.614 -3.696 491 HA TYR 77 HA TYR 77 -4.778 -11.733 -3.584 492 HB3 TYR 77 2HB TYR 77 -4.139 -9.303 -3.252 493 HD1 TYR 77 2HD TYR 77 -2.600 -10.329 -4.920 494 HD2 TYR 77 1HD TYR 77 -6.545 -9.043 -6.028 495 HE1 TYR 77 2HE TYR 77 -1.869 -10.102 -7.277 496 HE2 TYR 77 1HE TYR 77 -5.879 -8.912 -8.403 497 HH TYR 77 HH TYR 77 -3.786 -9.649 -9.998 498 H ASP 78 H ASP 78 -4.494 -12.585 -1.667 499 HA ASP 78 HA ASP 78 -6.392 -12.440 0.511 500 HB3 ASP 78 2HB ASP 78 -3.532 -13.508 0.408 501 H LEU 79 H LEU 79 -3.335 -10.922 -0.200 502 HA LEU 79 HA LEU 79 -3.628 -9.053 2.055 503 HB3 LEU 79 2HB LEU 79 -0.827 -9.846 1.662 504 HG LEU 79 HG LEU 79 -2.742 -10.046 4.022 505 HD11 LEU 79 1HD1 LEU 79 -1.078 -11.690 4.350 506 HD12 LEU 79 2HD1 LEU 79 -0.518 -10.287 5.301 507 HD13 LEU 79 3HD1 LEU 79 0.185 -10.641 3.696 508 HD21 LEU 79 3HD2 LEU 79 -0.445 -8.075 3.610 509 HD22 LEU 79 1HD2 LEU 79 -1.666 -8.098 4.917 510 HD23 LEU 79 2HD2 LEU 79 -2.145 -7.684 3.297 511 H ILE 80 H ILE 80 -2.814 -7.019 1.609 512 HA ILE 80 HA ILE 80 -1.392 -6.611 -0.967 513 HB ILE 80 HB ILE 80 -3.827 -5.024 -0.063 514 HG13 ILE 80 2HG1 ILE 80 -4.536 -7.154 -0.927 515 HG21 ILE 80 1HG2 ILE 80 -2.221 -4.764 -2.636 516 HG22 ILE 80 2HG2 ILE 80 -3.563 -3.722 -2.100 517 HG23 ILE 80 3HG2 ILE 80 -2.024 -3.674 -1.255 518 HD11 ILE 80 3HD1 ILE 80 -4.857 -5.218 -3.242 519 HD12 ILE 80 1HD1 ILE 80 -5.857 -6.613 -2.818 520 HD13 ILE 80 2HD1 ILE 80 -5.839 -5.191 -1.755 521 H LEU 81 H LEU 81 0.258 -5.069 -0.834 522 HA LEU 81 HA LEU 81 0.495 -3.606 1.757 523 HB3 LEU 81 2HB LEU 81 2.987 -3.715 1.319 524 HG LEU 81 HG LEU 81 1.874 -5.324 2.957 525 HD11 LEU 81 1HD1 LEU 81 2.271 -7.249 0.628 526 HD12 LEU 81 2HD1 LEU 81 0.773 -6.948 1.545 527 HD13 LEU 81 3HD1 LEU 81 2.116 -7.767 2.316 528 HD21 LEU 81 3HD2 LEU 81 4.459 -6.150 1.540 529 HD22 LEU 81 1HD2 LEU 81 3.997 -6.603 3.185 530 HD23 LEU 81 2HD2 LEU 81 4.313 -4.900 2.800 531 H ILE 82 H ILE 82 1.153 -1.393 1.492 532 HA ILE 82 HA ILE 82 1.491 -0.531 -1.317 533 HB ILE 82 HB ILE 82 -0.329 0.794 0.689 534 HG13 ILE 82 2HG1 ILE 82 -0.841 -1.081 -1.662 535 HG21 ILE 82 1HG2 ILE 82 0.791 2.421 -0.792 536 HG22 ILE 82 2HG2 ILE 82 0.408 1.426 -2.218 537 HG23 ILE 82 3HG2 ILE 82 -0.883 2.219 -1.313 538 HD11 ILE 82 3HD1 ILE 82 -2.867 -1.667 -0.344 539 HD12 ILE 82 1HD1 ILE 82 -1.410 -1.914 0.632 540 HD13 ILE 82 2HD1 ILE 82 -2.422 -0.488 0.877 541 H GLY 83 H GLY 83 3.307 0.550 -1.624 542 HA2 GLY 83 1HA GLY 83 4.961 1.758 0.500 543 HA3 GLY 83 2HA GLY 83 5.372 1.398 -1.107 544 H SER 84 H SER 84 5.510 4.019 0.623 545 HA SER 84 HA SER 84 4.975 5.771 -1.669 546 HB3 SER 84 2HB SER 84 2.846 5.811 -0.628 547 HG SER 84 HG SER 84 2.973 5.104 1.367 548 HA PRO 85 HA PRO 85 8.420 8.133 0.347 549 HB3 PRO 85 2HB PRO 85 8.589 9.485 -1.662 550 HG3 PRO 85 2HG PRO 85 6.712 9.914 -2.927 551 HD3 PRO 85 2HD PRO 85 6.217 7.669 -2.629 552 H VAL 86 H VAL 86 8.502 9.622 2.379 553 HA VAL 86 HA VAL 86 5.888 10.225 3.494 554 HB VAL 86 HB VAL 86 6.866 10.380 5.410 555 HG11 VAL 86 1HG1 VAL 86 8.004 8.617 5.893 556 HG12 VAL 86 2HG1 VAL 86 6.977 8.325 4.468 557 HG13 VAL 86 3HG1 VAL 86 8.711 8.539 4.233 558 HG21 VAL 86 3HG2 VAL 86 9.281 10.842 5.950 559 HG22 VAL 86 1HG2 VAL 86 9.026 11.957 4.560 560 HG23 VAL 86 2HG2 VAL 86 7.942 11.983 5.977 561 H TRP 87 H TRP 87 6.206 12.884 4.417 562 HA TRP 87 HA TRP 87 7.654 14.507 2.445 563 HB3 TRP 87 2HB TRP 87 5.039 15.580 3.434 564 HD1 TRP 87 HD TRP 87 7.787 16.469 1.082 565 HE1 TRP 87 1HE TRP 87 6.837 18.063 -0.858 566 HE3 TRP 87 3HE TRP 87 2.735 16.021 1.828 567 HZ2 TRP 87 2HZ TRP 87 4.545 18.854 -1.833 568 HZ3 TRP 87 3HZ TRP 87 1.166 17.237 0.321 569 HH2 TRP 87 HH TRP 87 2.029 18.786 -1.385 570 H SER 88 H SER 88 7.067 16.992 3.874 571 HA SER 88 HA SER 88 8.942 16.888 5.941 572 HB3 SER 88 2HB SER 88 8.276 19.187 6.336 573 HG SER 88 HG SER 88 8.149 19.869 4.090 574 H GLY 89 H GLY 89 6.118 15.226 6.358 575 HA2 GLY 89 1HA GLY 89 6.465 14.770 8.976 576 HA3 GLY 89 2HA GLY 89 5.271 16.026 9.002 577 H TYR 90 H TYR 90 4.254 14.876 6.273 578 HA TYR 90 HA TYR 90 2.808 12.470 7.144 579 HB3 TYR 90 2HB TYR 90 1.312 14.015 7.986 580 HD1 TYR 90 2HD TYR 90 1.389 15.568 4.582 581 HD2 TYR 90 1HD TYR 90 1.816 16.140 8.833 582 HE1 TYR 90 2HE TYR 90 1.673 17.998 4.237 583 HE2 TYR 90 1HE TYR 90 2.055 18.579 8.498 584 HH TYR 90 HH TYR 90 2.213 20.334 6.891 585 HA PRO 91 HA PRO 91 3.384 11.760 2.838 586 HB3 PRO 91 2HB PRO 91 2.323 9.742 3.011 587 HG3 PRO 91 2HG PRO 91 0.311 9.494 4.283 588 HD3 PRO 91 2HD PRO 91 1.721 10.589 5.809 589 H ALA 92 H ALA 92 2.919 12.404 0.697 590 HA ALA 92 HA ALA 92 1.394 14.862 0.191 591 HB1 ALA 92 1HB ALA 92 3.083 13.021 -1.586 592 HB2 ALA 92 2HB ALA 92 2.464 14.631 -2.022 593 HB3 ALA 92 3HB ALA 92 3.683 14.479 -0.756 594 H THR 93 H THR 93 -0.200 12.902 1.077 595 HA THR 93 HA THR 93 -1.863 11.336 0.707 596 HB THR 93 HB THR 93 -3.723 12.649 -0.304 597 HG1 THR 93 1HG THR 93 -3.367 14.605 -1.134 598 HG21 THR 93 3HG2 THR 93 -1.941 14.406 1.465 599 HG22 THR 93 1HG2 THR 93 -2.952 13.064 2.059 600 HG23 THR 93 2HG2 THR 93 -3.699 14.473 1.292 601 HA PRO 94 HA PRO 94 -0.779 10.198 -3.705 602 HB3 PRO 94 2HB PRO 94 1.494 9.723 -3.348 603 HG3 PRO 94 2HG PRO 94 2.309 8.878 -1.345 604 HD3 PRO 94 2HD PRO 94 1.121 10.772 -0.801 605 H ILE 95 H ILE 95 -1.423 7.923 -1.057 606 HA ILE 95 HA ILE 95 -2.581 5.982 -2.880 607 HB ILE 95 HB ILE 95 -2.539 5.893 0.133 608 HG13 ILE 95 2HG1 ILE 95 -0.369 4.587 -0.066 609 HG21 ILE 95 1HG2 ILE 95 -3.901 4.165 -0.910 610 HG22 ILE 95 2HG2 ILE 95 -2.567 3.692 -1.970 611 HG23 ILE 95 3HG2 ILE 95 -2.471 3.448 -0.201 612 HD11 ILE 95 3HD1 ILE 95 1.240 5.148 -1.872 613 HD12 ILE 95 1HD1 ILE 95 -0.099 4.192 -2.485 614 HD13 ILE 95 2HD1 ILE 95 -0.045 5.940 -2.766 615 H LYS 96 H LYS 96 -3.782 8.895 -1.717 616 HA LYS 96 HA LYS 96 -6.291 8.252 -0.588 617 HB3 LYS 96 2HB LYS 96 -5.278 10.748 -1.981 618 HG3 LYS 96 2HG LYS 96 -7.728 10.830 -1.758 619 HD3 LYS 96 2HD LYS 96 -7.146 10.213 1.163 620 HE3 LYS 96 2HE LYS 96 -9.561 10.712 1.573 621 HZ1 LYS 96 3HZ LYS 96 -9.317 13.019 1.858 622 HZ2 LYS 96 1HZ LYS 96 -8.091 13.147 0.766 623 HZ3 LYS 96 2HZ LYS 96 -7.915 12.352 2.211 624 H THR 97 H THR 97 -5.304 8.868 -4.046 625 HA THR 97 HA THR 97 -7.993 8.637 -4.951 626 HB THR 97 HB THR 97 -5.666 7.879 -6.679 627 HG1 THR 97 1HG THR 97 -5.733 10.572 -6.325 628 HG21 THR 97 3HG2 THR 97 -7.841 9.985 -7.035 629 HG22 THR 97 1HG2 THR 97 -7.897 8.330 -7.674 630 HG23 THR 97 2HG2 THR 97 -6.672 9.469 -8.267 631 H LEU 98 H LEU 98 -5.352 6.176 -4.669 632 HA LEU 98 HA LEU 98 -6.752 4.245 -6.227 633 HB3 LEU 98 2HB LEU 98 -4.625 3.757 -4.094 634 HG LEU 98 HG LEU 98 -5.787 1.654 -4.722 635 HD11 LEU 98 1HD1 LEU 98 -6.706 2.170 -6.920 636 HD12 LEU 98 2HD1 LEU 98 -5.583 0.838 -7.109 637 HD13 LEU 98 3HD1 LEU 98 -5.086 2.482 -7.573 638 HD21 LEU 98 3HD2 LEU 98 -3.844 0.402 -5.529 639 HD22 LEU 98 1HD2 LEU 98 -3.384 1.573 -4.287 640 HD23 LEU 98 2HD2 LEU 98 -3.047 1.909 -6.019 641 H LEU 99 H LEU 99 -6.567 4.780 -2.714 642 HA LEU 99 HA LEU 99 -7.978 2.516 -1.811 643 HB3 LEU 99 2HB LEU 99 -6.677 4.375 -0.591 644 HG LEU 99 HG LEU 99 -8.552 6.147 -1.121 645 HD11 LEU 99 1HD1 LEU 99 -9.836 5.358 1.439 646 HD12 LEU 99 2HD1 LEU 99 -10.160 4.257 0.095 647 HD13 LEU 99 3HD1 LEU 99 -10.567 5.987 -0.059 648 HD21 LEU 99 3HD2 LEU 99 -7.410 5.624 1.621 649 HD22 LEU 99 1HD2 LEU 99 -8.048 7.209 1.105 650 HD23 LEU 99 2HD2 LEU 99 -6.604 6.484 0.351 651 H ASP 100 H ASP 100 -9.290 5.531 -3.165 652 HA ASP 100 HA ASP 100 -11.963 5.000 -2.386 653 HB3 ASP 100 2HB ASP 100 -11.316 6.525 -4.893 654 H GLN 101 H GLN 101 -10.081 3.909 -5.130 655 HA GLN 101 HA GLN 101 -12.252 2.640 -6.618 656 HB3 GLN 101 2HB GLN 101 -10.426 1.958 -8.115 657 HG3 GLN 101 2HG GLN 101 -10.036 4.853 -7.265 658 HE21 GLN 101 1HE2 GLN 101 -8.964 6.185 -8.806 659 HE22 GLN 101 2HE2 GLN 101 -7.893 5.482 -10.047 660 H MET 102 H MET 102 -10.644 1.706 -3.779 661 HA MET 102 HA MET 102 -11.124 -1.166 -4.365 662 HB3 MET 102 2HB MET 102 -8.760 -0.800 -4.811 663 HG3 MET 102 2HG MET 102 -8.714 0.410 -2.095 664 HE1 MET 102 3HE MET 102 -4.847 -1.657 -3.644 665 HE2 MET 102 1HE MET 102 -6.411 -2.322 -4.138 666 HE3 MET 102 2HE MET 102 -5.959 -0.672 -4.635 667 H LYS 103 H LYS 103 -12.367 1.072 -2.613 668 HA LYS 103 HA LYS 103 -11.785 0.463 0.064 669 HB3 LYS 103 2HB LYS 103 -14.152 1.749 -1.321 670 HG3 LYS 103 2HG LYS 103 -14.841 1.094 0.912 671 HD3 LYS 103 2HD LYS 103 -12.758 1.154 2.207 672 HE3 LYS 103 2HE LYS 103 -11.688 3.170 1.251 673 HZ1 LYS 103 3HZ LYS 103 -13.422 4.746 1.044 674 HZ2 LYS 103 1HZ LYS 103 -12.425 5.327 2.209 675 HZ3 LYS 103 2HZ LYS 103 -13.841 4.634 2.635 676 H ASN 104 H ASN 104 -13.944 -1.138 -2.102 677 HA ASN 104 HA ASN 104 -15.395 -2.667 -0.124 678 HB3 ASN 104 2HB ASN 104 -16.088 -3.814 -2.304 679 HD21 ASN 104 1HD2 ASN 104 -16.964 -1.722 -0.265 680 HD22 ASN 104 2HD2 ASN 104 -18.292 -1.058 -1.207 681 H TYR 105 H TYR 105 -12.325 -2.879 -0.515 682 HA TYR 105 HA TYR 105 -11.795 -5.624 -1.356 683 HB3 TYR 105 2HB TYR 105 -10.188 -3.557 0.209 684 HD1 TYR 105 1HD TYR 105 -9.305 -6.286 -2.206 685 HD2 TYR 105 2HD TYR 105 -8.831 -4.721 1.789 686 HE1 TYR 105 1HE TYR 105 -7.625 -8.025 -1.720 687 HE2 TYR 105 2HE TYR 105 -7.117 -6.466 2.253 688 HH TYR 105 HH TYR 105 -6.416 -9.063 -0.036 689 H ARG 106 H ARG 106 -11.486 -7.517 -0.056 690 HA ARG 106 HA ARG 106 -11.481 -7.259 2.871 691 HB3 ARG 106 2HB ARG 106 -12.781 -9.326 2.991 692 HG3 ARG 106 2HG ARG 106 -14.902 -8.780 1.786 693 HD3 ARG 106 2HD ARG 106 -15.362 -6.546 2.812 694 HE ARG 106 HE ARG 106 -14.391 -8.771 4.430 695 HH11 ARG 106 1HH1 ARG 106 -15.905 -5.539 4.572 696 HH12 ARG 106 2HH1 ARG 106 -16.684 -5.861 6.098 697 HH21 ARG 106 1HH2 ARG 106 -15.471 -9.185 6.322 698 HH22 ARG 106 2HH2 ARG 106 -16.694 -8.097 6.928 699 H GLY 107 H GLY 107 -10.200 -9.033 3.803 700 HA2 GLY 107 1HA GLY 107 -8.437 -10.827 3.257 701 HA3 GLY 107 2HA GLY 107 -7.874 -9.628 2.068 702 H GLU 108 H GLU 108 -5.912 -9.117 3.280 703 HA GLU 108 HA GLU 108 -6.361 -7.363 5.650 704 HB3 GLU 108 2HB GLU 108 -4.095 -8.298 6.446 705 HG3 GLU 108 2HG GLU 108 -6.632 -9.988 6.487 706 H VAL 109 H VAL 109 -4.665 -5.512 5.804 707 HA VAL 109 HA VAL 109 -3.057 -5.281 3.319 708 HB VAL 109 HB VAL 109 -4.545 -2.935 4.525 709 HG11 VAL 109 1HG1 VAL 109 -4.137 -1.937 2.346 710 HG12 VAL 109 2HG1 VAL 109 -2.624 -2.607 2.906 711 HG13 VAL 109 3HG1 VAL 109 -3.566 -3.472 1.681 712 HG21 VAL 109 3HG2 VAL 109 -6.394 -4.423 3.891 713 HG22 VAL 109 1HG2 VAL 109 -6.267 -3.070 2.772 714 HG23 VAL 109 2HG2 VAL 109 -5.653 -4.669 2.288 715 H ALA 110 H ALA 110 -1.090 -4.097 3.688 716 HA ALA 110 HA ALA 110 -0.880 -2.895 6.418 717 HB1 ALA 110 1HB ALA 110 1.481 -3.429 6.511 718 HB2 ALA 110 2HB ALA 110 0.490 -4.896 6.492 719 HB3 ALA 110 3HB ALA 110 1.364 -4.387 5.021 720 H SER 111 H SER 111 0.499 -0.966 6.508 721 HA SER 111 HA SER 111 0.877 0.230 3.789 722 HB3 SER 111 2HB SER 111 0.699 2.369 4.850 723 HG SER 111 HG SER 111 -1.424 2.176 5.745 724 H PHE 112 H PHE 112 2.878 0.924 3.218 725 HA PHE 112 HA PHE 112 5.120 0.564 5.113 726 HB3 PHE 112 2HB PHE 112 4.501 -0.697 2.424 727 HD1 PHE 112 1HD PHE 112 7.723 -0.210 4.413 728 HD2 PHE 112 2HD PHE 112 5.768 -0.417 0.564 729 HE1 PHE 112 1HE PHE 112 9.811 0.506 3.276 730 HE2 PHE 112 2HE PHE 112 7.855 0.336 -0.541 731 HZ PHE 112 HZ PHE 112 9.856 0.811 0.808 732 H PHE 113 H PHE 113 6.905 2.001 4.583 733 HA PHE 113 HA PHE 113 6.543 4.059 2.618 734 HB3 PHE 113 2HB PHE 113 4.943 4.840 4.322 735 HD1 PHE 113 2HD PHE 113 5.846 2.949 6.480 736 HD2 PHE 113 1HD PHE 113 6.386 7.164 5.941 737 HE1 PHE 113 2HE PHE 113 6.183 3.230 8.906 738 HE2 PHE 113 1HE PHE 113 6.973 7.405 8.307 739 HZ PHE 113 HZ PHE 113 6.836 5.423 9.836 740 H THR 114 H THR 114 8.330 5.769 2.986 741 HA THR 114 HA THR 114 10.730 4.502 4.218 742 HB THR 114 HB THR 114 11.997 5.177 2.132 743 HG1 THR 114 1HG THR 114 9.337 5.224 1.123 744 HG21 THR 114 3HG2 THR 114 11.514 3.091 0.947 745 HG22 THR 114 1HG2 THR 114 9.993 2.918 1.847 746 HG23 THR 114 2HG2 THR 114 11.548 2.825 2.700 747 H SER 115 H SER 115 9.972 6.109 5.781 748 HA SER 115 HA SER 115 10.275 8.889 5.584 749 HB3 SER 115 2HB SER 115 9.410 7.789 7.559 750 HG SER 115 HG SER 115 11.372 6.062 7.161 751 H ALA 116 H ALA 116 11.826 10.234 6.172 752 HA ALA 116 HA ALA 116 14.696 9.489 5.783 753 HB1 ALA 116 1HB ALA 116 15.159 11.820 6.483 754 HB2 ALA 116 2HB ALA 116 14.044 11.737 5.116 755 HB3 ALA 116 3HB ALA 116 13.431 12.094 6.749 756 H GLY 117 H GLY 117 13.099 8.019 7.707 757 HA2 GLY 117 1HA GLY 117 13.210 7.114 9.813 758 HA3 GLY 117 2HA GLY 117 14.511 8.293 10.176 759 H THR 118 H THR 118 12.790 10.613 9.341 760 HA THR 118 HA THR 118 11.846 11.158 12.021 761 HB THR 118 HB THR 118 11.459 13.437 10.849 762 HG1 THR 118 1HG THR 118 12.429 13.621 8.802 763 HG21 THR 118 3HG2 THR 118 14.246 12.175 10.697 764 HG22 THR 118 1HG2 THR 118 13.502 12.884 12.151 765 HG23 THR 118 2HG2 THR 118 13.886 13.898 10.753 766 H ASN 119 H ASN 119 9.703 12.101 12.432 767 HA ASN 119 HA ASN 119 7.486 12.290 12.309 768 HB3 ASN 119 2HB ASN 119 6.547 13.057 10.248 769 HD21 ASN 119 1HD2 ASN 119 9.150 13.799 8.427 770 HD22 ASN 119 2HD2 ASN 119 9.673 15.259 9.257 771 H HIS 120 H HIS 120 8.780 9.501 11.940 772 HA HIS 120 HA HIS 120 7.351 7.840 10.324 773 HB3 HIS 120 2HB HIS 120 9.351 7.112 11.375 774 HD1 HIS 120 1HD HIS 120 7.767 5.809 14.499 775 HD2 HIS 120 2HD HIS 120 10.190 9.046 13.283 776 HE1 HIS 120 1HE HIS 120 8.683 6.897 16.624 777 H LYS 121 H LYS 121 6.499 8.554 13.812 778 HA LYS 121 HA LYS 121 4.150 6.958 13.693 779 HB3 LYS 121 2HB LYS 121 3.841 8.613 15.769 780 HG3 LYS 121 2HG LYS 121 6.063 6.599 16.051 781 HD3 LYS 121 2HD LYS 121 3.568 7.266 17.646 782 HE3 LYS 121 2HE LYS 121 4.486 4.863 17.866 783 HZ1 LYS 121 3HZ LYS 121 6.868 5.318 18.042 784 HZ2 LYS 121 1HZ LYS 121 6.370 4.853 19.533 785 HZ3 LYS 121 2HZ LYS 121 6.604 6.423 19.211 786 H ALA 122 H ALA 122 4.805 10.353 12.870 787 HA ALA 122 HA ALA 122 2.059 11.209 12.920 788 HB1 ALA 122 1HB ALA 122 3.876 12.843 13.054 789 HB2 ALA 122 2HB ALA 122 4.487 12.359 11.452 790 HB3 ALA 122 3HB ALA 122 2.911 13.134 11.594 791 H TYR 123 H TYR 123 4.273 10.126 10.265 792 HA TYR 123 HA TYR 123 2.580 10.189 8.072 793 HB3 TYR 123 2HB TYR 123 4.808 8.339 8.796 794 HD1 TYR 123 2HD TYR 123 3.428 9.314 5.465 795 HD2 TYR 123 1HD TYR 123 3.973 6.118 8.318 796 HE1 TYR 123 2HE TYR 123 2.282 7.715 3.924 797 HE2 TYR 123 1HE TYR 123 3.041 4.515 6.701 798 HH TYR 123 HH TYR 123 1.551 5.480 3.620 799 H VAL 124 H VAL 124 2.889 7.423 10.341 800 HA VAL 124 HA VAL 124 0.930 5.624 9.461 801 HB VAL 124 HB VAL 124 1.925 6.372 12.237 802 HG11 VAL 124 1HG1 VAL 124 -0.068 4.281 11.426 803 HG12 VAL 124 2HG1 VAL 124 1.078 3.907 12.714 804 HG13 VAL 124 3HG1 VAL 124 -0.004 5.301 12.856 805 HG21 VAL 124 3HG2 VAL 124 2.635 4.116 10.367 806 HG22 VAL 124 1HG2 VAL 124 3.631 5.526 10.671 807 HG23 VAL 124 2HG2 VAL 124 3.331 4.382 11.975 808 H SER 125 H SER 125 0.416 8.258 11.989 809 HA SER 125 HA SER 125 -2.346 7.707 12.264 810 HB3 SER 125 2HB SER 125 -2.339 9.995 13.379 811 HG SER 125 HG SER 125 -1.751 8.318 14.634 812 H HIS 126 H HIS 126 -0.626 10.121 10.237 813 HA HIS 126 HA HIS 126 -3.043 11.498 9.436 814 HB3 HIS 126 2HB HIS 126 -1.450 12.388 7.628 815 HD1 HIS 126 1HD HIS 126 -1.118 14.861 8.362 816 HD2 HIS 126 2HD HIS 126 -0.457 12.056 11.430 817 HE1 HIS 126 1HE HIS 126 -0.381 16.182 10.420 818 H PHE 127 H PHE 127 -1.165 8.766 8.042 819 HA PHE 127 HA PHE 127 -2.780 8.446 5.692 820 HB3 PHE 127 2HB PHE 127 -1.073 6.581 7.357 821 HD1 PHE 127 2HD PHE 127 -2.037 6.260 3.760 822 HD2 PHE 127 1HD PHE 127 -2.490 4.628 7.733 823 HE1 PHE 127 2HE PHE 127 -3.080 4.194 2.817 824 HE2 PHE 127 1HE PHE 127 -3.581 2.628 6.779 825 HZ PHE 127 HZ PHE 127 -3.856 2.402 4.325 826 H ASN 128 H ASN 128 -3.109 7.014 9.006 827 HA ASN 128 HA ASN 128 -5.231 5.290 8.290 828 HB3 ASN 128 2HB ASN 128 -5.811 5.597 10.874 829 HD21 ASN 128 1HD2 ASN 128 -2.313 5.076 10.401 830 HD22 ASN 128 2HD2 ASN 128 -2.470 3.342 10.612 831 H GLU 129 H GLU 129 -5.365 8.702 8.950 832 HA GLU 129 HA GLU 129 -8.219 8.966 9.159 833 HB3 GLU 129 2HB GLU 129 -6.748 11.321 8.200 834 HG3 GLU 129 2HG GLU 129 -6.980 11.643 10.907 835 H TRP 130 H TRP 130 -5.927 9.947 6.563 836 HA TRP 130 HA TRP 130 -7.993 10.203 4.533 837 HB3 TRP 130 2HB TRP 130 -6.235 11.000 3.187 838 HD1 TRP 130 HD TRP 130 -7.595 12.448 5.839 839 HE1 TRP 130 1HE TRP 130 -6.366 14.274 7.096 840 HE3 TRP 130 3HE TRP 130 -2.916 11.667 3.958 841 HZ2 TRP 130 2HZ TRP 130 -3.609 15.157 7.417 842 HZ3 TRP 130 3HZ TRP 130 -1.037 13.182 4.583 843 HH2 TRP 130 HH TRP 130 -1.374 14.910 6.328 844 H ALA 131 H ALA 131 -7.449 7.488 5.757 845 HA ALA 131 HA ALA 131 -7.984 5.906 3.516 846 HB1 ALA 131 1HB ALA 131 -5.291 5.347 4.844 847 HB2 ALA 131 2HB ALA 131 -6.061 4.370 3.586 848 HB3 ALA 131 3HB ALA 131 -5.470 6.001 3.193 849 H ASP 132 H ASP 132 -9.348 6.551 5.798 850 HA ASP 132 HA ASP 132 -9.153 4.195 7.509 851 HB3 ASP 132 2HB ASP 132 -11.593 5.970 7.394 852 H GLY 133 H GLY 133 -10.718 2.656 7.515 853 HA2 GLY 133 1HA GLY 133 -12.903 1.893 6.822 854 HA3 GLY 133 2HA GLY 133 -12.575 2.410 5.176 855 H LEU 134 H LEU 134 -9.796 0.634 6.369 856 HA LEU 134 HA LEU 134 -11.086 -1.962 5.767 857 HB3 LEU 134 2HB LEU 134 -8.874 -2.649 4.698 858 HG LEU 134 HG LEU 134 -10.552 -0.509 3.284 859 HD11 LEU 134 1HD1 LEU 134 -9.453 -1.245 1.222 860 HD12 LEU 134 2HD1 LEU 134 -8.393 -2.319 2.167 861 HD13 LEU 134 3HD1 LEU 134 -8.305 -0.562 2.397 862 HD21 LEU 134 3HD2 LEU 134 -11.824 -2.551 3.746 863 HD22 LEU 134 1HD2 LEU 134 -10.513 -3.560 3.106 864 HD23 LEU 134 2HD2 LEU 134 -11.432 -2.479 2.036 865 H ASN 135 H ASN 135 -10.052 -3.693 6.607 866 HA ASN 135 HA ASN 135 -8.600 -3.630 9.082 867 HB3 ASN 135 2HB ASN 135 -9.715 -5.602 8.774 868 HD21 ASN 135 1HD2 ASN 135 -7.869 -5.363 5.736 869 HD22 ASN 135 2HD2 ASN 135 -8.800 -6.639 4.973 870 H VAL 136 H VAL 136 -6.764 -2.454 9.062 871 HA VAL 136 HA VAL 136 -4.666 -3.332 7.184 872 HB VAL 136 HB VAL 136 -5.151 -0.945 7.035 873 HG11 VAL 136 1HG1 VAL 136 -4.022 -0.760 9.839 874 HG12 VAL 136 2HG1 VAL 136 -4.583 0.579 8.809 875 HG13 VAL 136 3HG1 VAL 136 -5.742 -0.620 9.419 876 HG21 VAL 136 3HG2 VAL 136 -2.950 -1.657 6.372 877 HG22 VAL 136 1HG2 VAL 136 -2.848 -0.106 7.197 878 HG23 VAL 136 2HG2 VAL 136 -2.363 -1.583 8.052 879 H ILE 137 H ILE 137 -3.090 -4.558 8.025 880 HA ILE 137 HA ILE 137 -3.268 -5.333 10.830 881 HB ILE 137 HB ILE 137 -2.022 -7.320 10.037 882 HG13 ILE 137 2HG1 ILE 137 -1.021 -5.890 8.000 883 HG21 ILE 137 1HG2 ILE 137 -4.536 -7.118 10.063 884 HG22 ILE 137 2HG2 ILE 137 -4.518 -6.697 8.343 885 HG23 ILE 137 3HG2 ILE 137 -3.914 -8.269 8.884 886 HD11 ILE 137 3HD1 ILE 137 -1.776 -8.743 7.399 887 HD12 ILE 137 1HD1 ILE 137 -0.411 -7.784 6.767 888 HD13 ILE 137 2HD1 ILE 137 -0.422 -8.275 8.463 889 H GLY 138 H GLY 138 -1.471 -3.033 9.260 890 HA2 GLY 138 1HA GLY 138 0.023 -2.441 11.455 891 HA3 GLY 138 2HA GLY 138 1.093 -3.508 10.572 892 H VAL 139 H VAL 139 1.735 -0.818 11.041 893 HA VAL 139 HA VAL 139 2.433 -0.454 8.313 894 HB VAL 139 HB VAL 139 0.790 1.206 8.282 895 HG11 VAL 139 1HG1 VAL 139 1.533 2.191 10.947 896 HG12 VAL 139 2HG1 VAL 139 0.419 2.927 9.706 897 HG13 VAL 139 3HG1 VAL 139 0.052 1.343 10.389 898 HG21 VAL 139 3HG2 VAL 139 2.043 3.356 8.219 899 HG22 VAL 139 1HG2 VAL 139 3.422 2.576 8.968 900 HG23 VAL 139 2HG2 VAL 139 2.904 2.063 7.359 901 H ALA 140 H ALA 140 4.500 -0.150 8.005 902 HA ALA 140 HA ALA 140 6.163 0.957 10.062 903 HB1 ALA 140 1HB ALA 140 6.163 -1.427 10.739 904 HB2 ALA 140 2HB ALA 140 6.634 -1.910 9.093 905 HB3 ALA 140 3HB ALA 140 7.759 -0.987 10.086 906 H ARG 141 H ARG 141 8.367 1.332 9.355 907 HA ARG 141 HA ARG 141 8.354 1.978 6.484 908 HB3 ARG 141 2HB ARG 141 9.145 3.618 8.267 909 HG3 ARG 141 2HG ARG 141 11.635 1.904 8.307 910 HD3 ARG 141 2HD ARG 141 11.740 3.002 10.672 911 HE ARG 141 HE ARG 141 12.184 5.142 8.786 912 HH11 ARG 141 1HH1 ARG 141 13.438 1.919 9.675 913 HH12 ARG 141 2HH1 ARG 141 14.972 2.154 8.901 914 HH21 ARG 141 1HH2 ARG 141 14.161 5.342 7.623 915 HH22 ARG 141 2HH2 ARG 141 15.333 4.085 7.669 916 H ASP 142 H ASP 142 10.257 1.375 5.294 917 HA ASP 142 HA ASP 142 11.633 -0.165 4.333 918 HB3 ASP 142 2HB ASP 142 13.478 -0.912 5.867 919 H ASP 143 H ASP 143 12.766 -2.600 5.455 920 HA ASP 143 HA ASP 143 10.642 -4.429 4.723 921 HB3 ASP 143 2HB ASP 143 12.819 -4.815 3.837 922 H SER 144 H SER 144 10.938 -3.001 7.616 923 HA SER 144 HA SER 144 11.753 -5.065 9.322 924 HB3 SER 144 2HB SER 144 10.098 -2.663 10.158 925 HG SER 144 HG SER 144 10.815 -4.331 11.652 926 H GLU 145 H GLU 145 8.665 -5.078 7.913 927 HA GLU 145 HA GLU 145 7.630 -6.844 10.083 928 HB3 GLU 145 2HB GLU 145 5.361 -5.767 9.802 929 HG3 GLU 145 2HG GLU 145 7.467 -3.865 10.887 930 H VAL 146 H VAL 146 8.674 -7.021 7.106 931 HA VAL 146 HA VAL 146 6.495 -7.821 5.533 932 HB VAL 146 HB VAL 146 9.444 -8.636 5.521 933 HG11 VAL 146 1HG1 VAL 146 9.248 -9.267 3.191 934 HG12 VAL 146 2HG1 VAL 146 8.093 -10.229 4.112 935 HG13 VAL 146 3HG1 VAL 146 7.537 -8.831 3.168 936 HG21 VAL 146 3HG2 VAL 146 9.780 -6.924 3.880 937 HG22 VAL 146 1HG2 VAL 146 8.032 -6.583 3.762 938 HG23 VAL 146 2HG2 VAL 146 8.931 -6.159 5.223 939 H ASP 147 H ASP 147 8.407 -9.713 7.756 940 HA ASP 147 HA ASP 147 7.476 -12.308 7.457 941 HB3 ASP 147 2HB ASP 147 8.386 -10.603 9.748 942 H LYS 148 H LYS 148 5.721 -9.581 8.921 943 HA LYS 148 HA LYS 148 3.583 -11.503 9.814 944 HB3 LYS 148 2HB LYS 148 4.341 -10.207 11.653 945 HG3 LYS 148 2HG LYS 148 3.790 -7.715 9.996 946 HD3 LYS 148 2HD LYS 148 5.074 -6.963 12.352 947 HE3 LYS 148 2HE LYS 148 3.232 -5.795 11.095 948 HZ1 LYS 148 3HZ LYS 148 1.492 -7.578 11.363 949 HZ2 LYS 148 1HZ LYS 148 1.005 -6.109 11.916 950 HZ3 LYS 148 2HZ LYS 148 1.462 -7.263 12.954 951 H TRP 149 H TRP 149 4.354 -9.338 7.331 952 HA TRP 149 HA TRP 149 1.510 -8.956 6.614 953 HB3 TRP 149 2HB TRP 149 2.337 -7.400 4.986 954 HD1 TRP 149 HD TRP 149 1.614 -7.381 8.318 955 HE1 TRP 149 1HE TRP 149 2.115 -5.257 9.516 956 HE3 TRP 149 3HE TRP 149 4.896 -5.455 5.005 957 HZ2 TRP 149 2HZ TRP 149 3.600 -2.743 8.963 958 HZ3 TRP 149 3HZ TRP 149 5.838 -3.131 5.313 959 HH2 TRP 149 HH TRP 149 5.158 -1.791 7.216 960 H SER 150 H SER 150 3.329 -11.577 6.356 961 HA SER 150 HA SER 150 1.949 -12.364 3.935 962 HB3 SER 150 2HB SER 150 4.944 -12.870 4.025 963 HG SER 150 HG SER 150 4.575 -13.832 2.199 964 H LYS 151 H LYS 151 1.175 -12.927 6.360 965 HA LYS 151 HA LYS 151 2.349 -15.331 7.485 966 HB3 LYS 151 2HB LYS 151 0.425 -15.186 8.976 967 HG3 LYS 151 2HG LYS 151 0.831 -12.646 9.676 968 HD3 LYS 151 2HD LYS 151 3.269 -13.543 10.430 969 HE3 LYS 151 2HE LYS 151 1.180 -12.999 11.780 970 HZ1 LYS 151 3HZ LYS 151 -0.211 -14.919 11.097 971 HZ2 LYS 151 1HZ LYS 151 0.102 -14.999 12.719 972 HZ3 LYS 151 2HZ LYS 151 0.914 -15.949 11.709 Start of MODEL 10 1 H1 GLY 1 H GLY 1 -7.407 -25.106 0.359 2 HA2 GLY 1 1HA GLY 1 -7.097 -22.822 -0.415 3 HA3 GLY 1 2HA GLY 1 -5.535 -23.648 -0.262 4 H MET 2 H MET 2 -4.231 -23.566 -2.016 5 HA MET 2 HA MET 2 -3.426 -22.772 -3.936 6 HB3 MET 2 2HB MET 2 -3.899 -24.958 -4.728 7 HG3 MET 2 2HG MET 2 -6.678 -23.934 -5.372 8 HE1 MET 2 3HE MET 2 -7.682 -24.147 -7.540 9 HE2 MET 2 1HE MET 2 -6.028 -23.657 -7.944 10 HE3 MET 2 2HE MET 2 -6.844 -24.919 -8.901 11 H ALA 3 H ALA 3 -4.993 -20.930 -2.633 12 HA ALA 3 HA ALA 3 -5.897 -19.188 -4.814 13 HB1 ALA 3 1HB ALA 3 -8.056 -18.829 -3.564 14 HB2 ALA 3 2HB ALA 3 -7.904 -20.433 -4.319 15 HB3 ALA 3 3HB ALA 3 -7.657 -20.243 -2.578 16 H LYS 4 H LYS 4 -3.785 -18.235 -4.014 17 HA LYS 4 HA LYS 4 -4.324 -16.115 -2.142 18 HB3 LYS 4 2HB LYS 4 -3.724 -17.876 -0.503 19 HG3 LYS 4 2HG LYS 4 -1.364 -18.434 -0.186 20 HD3 LYS 4 2HD LYS 4 -3.019 -19.921 -1.720 21 HE3 LYS 4 2HE LYS 4 -1.949 -18.843 -3.842 22 HZ1 LYS 4 3HZ LYS 4 0.279 -20.609 -3.014 23 HZ2 LYS 4 1HZ LYS 4 0.357 -18.962 -3.062 24 HZ3 LYS 4 2HZ LYS 4 0.148 -19.823 -4.453 25 H LYS 5 H LYS 5 -2.677 -14.447 -2.251 26 HA LYS 5 HA LYS 5 -0.411 -14.670 -4.033 27 HB3 LYS 5 2HB LYS 5 -1.089 -13.092 -5.708 28 HG3 LYS 5 2HG LYS 5 -3.663 -14.617 -5.272 29 HD3 LYS 5 2HD LYS 5 -3.987 -12.930 -7.033 30 HE3 LYS 5 2HE LYS 5 -1.577 -14.260 -8.364 31 HZ1 LYS 5 3HZ LYS 5 -3.558 -12.395 -9.570 32 HZ2 LYS 5 1HZ LYS 5 -3.205 -13.936 -10.048 33 HZ3 LYS 5 2HZ LYS 5 -2.094 -12.770 -10.195 34 H THR 6 H THR 6 0.403 -12.366 -4.227 35 HA THR 6 HA THR 6 -0.378 -10.600 -2.012 36 HB THR 6 HB THR 6 2.475 -11.529 -2.372 37 HG1 THR 6 1HG THR 6 1.889 -12.126 -0.008 38 HG21 THR 6 3HG2 THR 6 1.154 -9.601 -0.395 39 HG22 THR 6 1HG2 THR 6 2.382 -9.183 -1.607 40 HG23 THR 6 2HG2 THR 6 2.811 -10.199 -0.215 41 H LEU 7 H LEU 7 -1.159 -9.066 -3.368 42 HA LEU 7 HA LEU 7 0.412 -8.200 -5.732 43 HB3 LEU 7 2HB LEU 7 -1.981 -6.972 -4.392 44 HG LEU 7 HG LEU 7 -0.950 -5.466 -6.069 45 HD11 LEU 7 1HD1 LEU 7 -1.614 -7.404 -8.320 46 HD12 LEU 7 2HD1 LEU 7 -0.010 -7.403 -7.610 47 HD13 LEU 7 3HD1 LEU 7 -0.598 -5.933 -8.352 48 HD21 LEU 7 3HD2 LEU 7 -3.553 -6.877 -6.868 49 HD22 LEU 7 1HD2 LEU 7 -3.043 -5.339 -7.557 50 HD23 LEU 7 2HD2 LEU 7 -3.386 -5.457 -5.814 51 H ILE 8 H ILE 8 1.655 -6.399 -5.739 52 HA ILE 8 HA ILE 8 2.152 -4.905 -3.200 53 HB ILE 8 HB ILE 8 4.245 -5.916 -5.168 54 HG13 ILE 8 2HG1 ILE 8 3.278 -7.801 -3.834 55 HG21 ILE 8 1HG2 ILE 8 5.880 -5.066 -3.578 56 HG22 ILE 8 2HG2 ILE 8 4.799 -3.765 -4.040 57 HG23 ILE 8 3HG2 ILE 8 4.593 -4.558 -2.463 58 HD11 ILE 8 3HD1 ILE 8 5.699 -7.812 -4.489 59 HD12 ILE 8 1HD1 ILE 8 6.073 -7.250 -2.838 60 HD13 ILE 8 2HD1 ILE 8 5.246 -8.806 -3.096 61 H LEU 9 H LEU 9 1.539 -2.849 -3.639 62 HA LEU 9 HA LEU 9 1.925 -1.669 -6.362 63 HB3 LEU 9 2HB LEU 9 -0.390 -0.525 -5.615 64 HG LEU 9 HG LEU 9 0.087 -3.166 -6.997 65 HD11 LEU 9 1HD1 LEU 9 -2.011 -3.471 -5.780 66 HD12 LEU 9 2HD1 LEU 9 -2.266 -3.314 -7.529 67 HD13 LEU 9 3HD1 LEU 9 -2.641 -1.946 -6.449 68 HD21 LEU 9 3HD2 LEU 9 -0.793 -1.914 -8.924 69 HD22 LEU 9 1HD2 LEU 9 0.522 -0.986 -8.172 70 HD23 LEU 9 2HD2 LEU 9 -1.173 -0.527 -7.894 71 H TYR 10 H TYR 10 3.461 -0.242 -5.910 72 HA TYR 10 HA TYR 10 3.108 1.579 -3.562 73 HB3 TYR 10 2HB TYR 10 4.895 -0.178 -3.184 74 HD1 TYR 10 1HD TYR 10 5.109 -0.087 -6.497 75 HD2 TYR 10 2HD TYR 10 7.677 0.835 -3.137 76 HE1 TYR 10 1HE TYR 10 7.012 -0.133 -7.994 77 HE2 TYR 10 2HE TYR 10 9.577 0.857 -4.699 78 HH TYR 10 HH TYR 10 9.231 0.738 -8.208 79 H TYR 11 H TYR 11 4.260 3.613 -3.683 80 HA TYR 11 HA TYR 11 4.732 4.602 -6.444 81 HB3 TYR 11 2HB TYR 11 3.958 6.122 -3.959 82 HD1 TYR 11 1HD TYR 11 5.061 6.378 -7.612 83 HD2 TYR 11 2HD TYR 11 4.153 8.519 -3.971 84 HE1 TYR 11 1HE TYR 11 6.009 8.396 -8.567 85 HE2 TYR 11 2HE TYR 11 5.163 10.565 -4.944 86 HH TYR 11 HH TYR 11 6.373 11.525 -6.873 87 H SER 12 H SER 12 6.876 4.403 -6.827 88 HA SER 12 HA SER 12 9.002 5.110 -4.881 89 HB3 SER 12 2HB SER 12 9.538 3.358 -6.440 90 HG SER 12 HG SER 12 8.462 5.123 -8.334 91 H TRP 13 H TRP 13 9.177 7.209 -4.374 92 HA TRP 13 HA TRP 13 8.355 9.456 -5.817 93 HB3 TRP 13 2HB TRP 13 10.768 9.278 -3.958 94 HD1 TRP 13 HD TRP 13 7.660 11.237 -3.156 95 HE1 TRP 13 1HE TRP 13 8.226 13.675 -2.804 96 HE3 TRP 13 3HE TRP 13 12.419 11.253 -5.046 97 HZ2 TRP 13 2HZ TRP 13 10.486 15.436 -3.214 98 HZ3 TRP 13 3HZ TRP 13 13.785 13.305 -4.958 99 HH2 TRP 13 HH TRP 13 12.839 15.403 -4.043 100 H SER 14 H SER 14 11.881 8.912 -5.456 101 HA SER 14 HA SER 14 12.183 8.698 -8.402 102 HB3 SER 14 2HB SER 14 13.844 10.494 -6.592 103 HG SER 14 HG SER 14 14.482 11.413 -8.507 104 H GLY 15 H GLY 15 13.031 7.577 -5.243 105 HA2 GLY 15 1HA GLY 15 14.458 5.294 -6.321 106 HA3 GLY 15 2HA GLY 15 15.514 6.437 -5.501 107 H GLU 16 H GLU 16 13.286 7.210 -3.553 108 HA GLU 16 HA GLU 16 14.312 5.750 -1.489 109 HB3 GLU 16 2HB GLU 16 12.210 6.639 -0.222 110 HG3 GLU 16 2HG GLU 16 12.864 9.054 -0.607 111 H THR 17 H THR 17 10.800 5.512 -2.222 112 HA THR 17 HA THR 17 10.413 3.086 -1.028 113 HB THR 17 HB THR 17 8.797 3.638 -3.429 114 HG1 THR 17 1HG THR 17 7.892 5.503 -2.704 115 HG21 THR 17 3HG2 THR 17 6.905 3.455 -1.937 116 HG22 THR 17 1HG2 THR 17 7.949 3.667 -0.504 117 HG23 THR 17 2HG2 THR 17 8.049 2.195 -1.488 118 H LYS 18 H LYS 18 11.804 3.771 -4.203 119 HA LYS 18 HA LYS 18 11.299 1.289 -5.563 120 HB3 LYS 18 2HB LYS 18 13.555 3.263 -5.971 121 HG3 LYS 18 2HG LYS 18 13.266 2.003 -8.321 122 HD3 LYS 18 2HD LYS 18 15.109 1.352 -6.012 123 HE3 LYS 18 2HE LYS 18 14.789 -0.826 -7.097 124 HZ1 LYS 18 3HZ LYS 18 15.700 -0.973 -9.382 125 HZ2 LYS 18 1HZ LYS 18 15.483 0.655 -9.547 126 HZ3 LYS 18 2HZ LYS 18 14.183 -0.327 -9.280 127 H LYS 19 H LYS 19 14.146 2.306 -3.581 128 HA LYS 19 HA LYS 19 15.350 -0.291 -3.836 129 HB3 LYS 19 2HB LYS 19 16.099 1.312 -1.438 130 HG3 LYS 19 2HG LYS 19 18.271 1.477 -2.713 131 HD3 LYS 19 2HD LYS 19 18.983 -0.825 -2.723 132 HE3 LYS 19 2HE LYS 19 17.077 -0.387 -0.388 133 HZ1 LYS 19 3HZ LYS 19 19.787 -1.515 -0.388 134 HZ2 LYS 19 1HZ LYS 19 18.466 -2.461 -0.586 135 HZ3 LYS 19 2HZ LYS 19 18.655 -1.609 0.806 136 H MET 20 H MET 20 12.641 0.651 -2.045 137 HA MET 20 HA MET 20 13.016 -1.398 0.019 138 HB3 MET 20 2HB MET 20 10.643 0.486 -0.342 139 HG3 MET 20 2HG MET 20 10.389 -1.077 1.416 140 HE1 MET 20 3HE MET 20 14.559 0.192 3.160 141 HE2 MET 20 1HE MET 20 14.021 0.654 1.530 142 HE3 MET 20 2HE MET 20 13.193 1.307 2.967 143 H ALA 21 H ALA 21 11.443 -1.033 -3.109 144 HA ALA 21 HA ALA 21 9.158 -2.685 -2.554 145 HB1 ALA 21 1HB ALA 21 10.375 -1.446 -4.974 146 HB2 ALA 21 2HB ALA 21 9.617 -3.016 -5.256 147 HB3 ALA 21 3HB ALA 21 8.658 -1.747 -4.533 148 H GLU 22 H GLU 22 12.275 -3.077 -4.141 149 HA GLU 22 HA GLU 22 11.791 -5.610 -5.006 150 HB3 GLU 22 2HB GLU 22 14.141 -5.723 -5.649 151 HG3 GLU 22 2HG GLU 22 13.400 -2.757 -5.616 152 H LYS 23 H LYS 23 13.433 -4.521 -2.085 153 HA LYS 23 HA LYS 23 14.506 -6.913 -1.057 154 HB3 LYS 23 2HB LYS 23 13.316 -4.972 0.840 155 HG3 LYS 23 2HG LYS 23 15.042 -6.835 1.343 156 HD3 LYS 23 2HD LYS 23 16.899 -4.619 0.350 157 HE3 LYS 23 2HE LYS 23 18.705 -6.172 0.741 158 HZ1 LYS 23 3HZ LYS 23 17.925 -4.978 2.768 159 HZ2 LYS 23 1HZ LYS 23 18.617 -6.412 3.084 160 HZ3 LYS 23 2HZ LYS 23 16.984 -6.295 3.135 161 H ILE 24 H ILE 24 11.400 -5.384 -0.370 162 HA ILE 24 HA ILE 24 10.325 -7.436 1.282 163 HB ILE 24 HB ILE 24 9.242 -5.088 -0.334 164 HG13 ILE 24 2HG1 ILE 24 10.784 -4.614 1.575 165 HG21 ILE 24 1HG2 ILE 24 7.090 -5.167 0.768 166 HG22 ILE 24 2HG2 ILE 24 7.361 -6.704 -0.035 167 HG23 ILE 24 3HG2 ILE 24 7.563 -6.562 1.721 168 HD11 ILE 24 3HD1 ILE 24 9.505 -2.959 2.722 169 HD12 ILE 24 1HD1 ILE 24 9.018 -2.952 1.011 170 HD13 ILE 24 2HD1 ILE 24 7.981 -3.706 2.226 171 H ASN 25 H ASN 25 9.989 -6.734 -2.235 172 HA ASN 25 HA ASN 25 8.214 -8.834 -2.871 173 HB3 ASN 25 2HB ASN 25 10.285 -7.310 -4.468 174 HD21 ASN 25 1HD2 ASN 25 7.383 -9.401 -5.113 175 HD22 ASN 25 2HD2 ASN 25 8.164 -10.234 -6.402 176 H SER 26 H SER 26 11.881 -8.984 -2.793 177 HA SER 26 HA SER 26 11.981 -11.707 -3.526 178 HB3 SER 26 2HB SER 26 14.250 -11.617 -2.456 179 HG SER 26 HG SER 26 13.959 -10.851 -4.534 180 H GLU 27 H GLU 27 11.116 -10.334 -0.391 181 HA GLU 27 HA GLU 27 11.793 -12.795 1.076 182 HB3 GLU 27 2HB GLU 27 10.588 -11.344 2.939 183 HG3 GLU 27 2HG GLU 27 12.548 -9.894 3.241 184 H ILE 28 H ILE 28 9.039 -11.467 -0.531 185 HA ILE 28 HA ILE 28 7.034 -13.092 0.810 186 HB ILE 28 HB ILE 28 7.030 -11.202 -1.578 187 HG13 ILE 28 2HG1 ILE 28 7.311 -10.351 0.896 188 HG21 ILE 28 1HG2 ILE 28 4.583 -12.485 -0.297 189 HG22 ILE 28 2HG2 ILE 28 4.595 -11.220 -1.546 190 HG23 ILE 28 3HG2 ILE 28 5.213 -12.801 -1.931 191 HD11 ILE 28 3HD1 ILE 28 6.586 -8.816 -0.897 192 HD12 ILE 28 1HD1 ILE 28 4.895 -9.256 -0.581 193 HD13 ILE 28 2HD1 ILE 28 5.842 -8.468 0.680 194 H LYS 29 H LYS 29 5.714 -14.557 -0.548 195 HA LYS 29 HA LYS 29 7.007 -16.645 -1.995 196 HB3 LYS 29 2HB LYS 29 4.262 -16.288 -2.928 197 HG3 LYS 29 2HG LYS 29 3.775 -18.106 -1.274 198 HD3 LYS 29 2HD LYS 29 5.408 -19.840 -2.106 199 HE3 LYS 29 2HE LYS 29 4.152 -18.096 -4.270 200 HZ1 LYS 29 3HZ LYS 29 4.287 -20.028 -5.618 201 HZ2 LYS 29 1HZ LYS 29 4.721 -21.006 -4.371 202 HZ3 LYS 29 2HZ LYS 29 5.756 -19.890 -4.944 203 H ASP 30 H ASP 30 6.080 -17.121 -4.337 204 HA ASP 30 HA ASP 30 7.095 -15.320 -6.276 205 HB3 ASP 30 2HB ASP 30 5.663 -17.962 -6.351 206 H SER 31 H SER 31 5.777 -13.798 -5.203 207 HA SER 31 HA SER 31 2.963 -13.446 -5.915 208 HB3 SER 31 2HB SER 31 4.089 -12.942 -3.680 209 HG SER 31 HG SER 31 5.768 -11.474 -4.356 210 H GLU 32 H GLU 32 3.277 -10.377 -6.158 211 HA GLU 32 HA GLU 32 4.484 -10.267 -8.832 212 HB3 GLU 32 2HB GLU 32 1.875 -8.817 -8.391 213 HG3 GLU 32 2HG GLU 32 3.594 -9.357 -10.601 214 H LEU 33 H LEU 33 4.757 -8.069 -9.483 215 HA LEU 33 HA LEU 33 4.904 -6.060 -7.287 216 HB3 LEU 33 2HB LEU 33 7.235 -5.920 -9.079 217 HG LEU 33 HG LEU 33 7.111 -6.368 -6.097 218 HD11 LEU 33 1HD1 LEU 33 9.296 -5.154 -7.878 219 HD12 LEU 33 2HD1 LEU 33 9.301 -6.820 -7.314 220 HD13 LEU 33 3HD1 LEU 33 9.438 -5.492 -6.142 221 HD21 LEU 33 3HD2 LEU 33 7.355 -3.674 -7.467 222 HD22 LEU 33 1HD2 LEU 33 7.560 -4.029 -5.727 223 HD23 LEU 33 2HD2 LEU 33 5.978 -4.240 -6.490 224 H LYS 34 H LYS 34 3.773 -4.300 -7.886 225 HA LYS 34 HA LYS 34 3.586 -3.510 -10.708 226 HB3 LYS 34 2HB LYS 34 1.284 -2.681 -9.525 227 HG3 LYS 34 2HG LYS 34 1.393 -3.696 -11.683 228 HD3 LYS 34 2HD LYS 34 1.383 -6.380 -10.237 229 HE3 LYS 34 2HE LYS 34 0.852 -5.575 -13.148 230 HZ1 LYS 34 3HZ LYS 34 0.787 -8.288 -11.926 231 HZ2 LYS 34 1HZ LYS 34 1.707 -7.794 -13.186 232 HZ3 LYS 34 2HZ LYS 34 0.093 -7.892 -13.332 233 H GLU 35 H GLU 35 2.932 -1.129 -10.813 234 HA GLU 35 HA GLU 35 3.804 0.408 -8.416 235 HB3 GLU 35 2HB GLU 35 5.631 0.162 -10.106 236 HG3 GLU 35 2HG GLU 35 3.974 2.142 -11.735 237 H VAL 36 H VAL 36 3.294 2.753 -8.547 238 HA VAL 36 HA VAL 36 0.816 3.488 -9.973 239 HB VAL 36 HB VAL 36 1.329 3.928 -6.985 240 HG11 VAL 36 1HG1 VAL 36 -0.220 5.498 -8.215 241 HG12 VAL 36 2HG1 VAL 36 -1.234 4.134 -8.659 242 HG13 VAL 36 3HG1 VAL 36 -1.038 4.587 -6.950 243 HG21 VAL 36 3HG2 VAL 36 0.980 1.526 -7.159 244 HG22 VAL 36 1HG2 VAL 36 -0.526 2.237 -6.593 245 HG23 VAL 36 2HG2 VAL 36 -0.375 1.747 -8.293 246 H LYS 37 H LYS 37 0.971 5.829 -10.440 247 HA LYS 37 HA LYS 37 2.814 7.376 -8.835 248 HB3 LYS 37 2HB LYS 37 4.167 6.784 -10.765 249 HG3 LYS 37 2HG LYS 37 3.866 8.331 -12.773 250 HD3 LYS 37 2HD LYS 37 2.013 5.925 -12.677 251 HE3 LYS 37 2HE LYS 37 1.751 7.412 -14.663 252 HZ1 LYS 37 3HZ LYS 37 4.123 8.127 -14.797 253 HZ2 LYS 37 1HZ LYS 37 3.485 7.633 -16.212 254 HZ3 LYS 37 2HZ LYS 37 4.508 6.650 -15.423 255 H VAL 38 H VAL 38 2.369 9.898 -10.055 256 HA VAL 38 HA VAL 38 -0.557 10.199 -10.178 257 HB VAL 38 HB VAL 38 -0.421 12.313 -8.886 258 HG11 VAL 38 1HG1 VAL 38 0.389 10.021 -7.112 259 HG12 VAL 38 2HG1 VAL 38 -0.676 11.394 -6.754 260 HG13 VAL 38 3HG1 VAL 38 -1.177 10.124 -7.872 261 HG21 VAL 38 3HG2 VAL 38 2.349 11.364 -8.023 262 HG22 VAL 38 1HG2 VAL 38 2.001 12.748 -9.059 263 HG23 VAL 38 2HG2 VAL 38 1.438 12.780 -7.398 264 H SER 39 H SER 39 -0.908 12.709 -10.827 265 HA SER 39 HA SER 39 0.369 13.109 -13.393 266 HB3 SER 39 2HB SER 39 -1.316 15.189 -12.696 267 HG SER 39 HG SER 39 -2.929 14.030 -13.764 268 H GLU 40 H GLU 40 0.748 15.643 -13.674 269 HA GLU 40 HA GLU 40 3.172 15.947 -11.998 270 HB3 GLU 40 2HB GLU 40 3.558 15.087 -14.162 271 HG3 GLU 40 2HG GLU 40 2.119 17.559 -15.166 272 H GLY 41 H GLY 41 0.746 17.216 -11.461 273 HA2 GLY 41 1HA GLY 41 1.744 20.005 -11.082 274 HA3 GLY 41 2HA GLY 41 0.105 19.727 -11.722 275 H THR 42 H THR 42 1.364 17.454 -9.289 276 HA THR 42 HA THR 42 -0.847 18.269 -7.582 277 HB THR 42 HB THR 42 1.099 16.038 -6.979 278 HG1 THR 42 1HG THR 42 0.662 15.466 -9.014 279 HG21 THR 42 3HG2 THR 42 -0.793 16.620 -5.431 280 HG22 THR 42 1HG2 THR 42 -0.929 14.978 -6.104 281 HG23 THR 42 2HG2 THR 42 -1.930 16.299 -6.758 282 H PHE 43 H PHE 43 2.745 17.834 -7.554 283 HA PHE 43 HA PHE 43 3.082 20.052 -5.730 284 HB3 PHE 43 2HB PHE 43 2.788 18.750 -4.046 285 HD1 PHE 43 2HD PHE 43 4.943 16.303 -5.839 286 HD2 PHE 43 1HD PHE 43 1.268 17.193 -3.842 287 HE1 PHE 43 2HE PHE 43 4.223 13.919 -6.168 288 HE2 PHE 43 1HE PHE 43 0.538 14.792 -4.075 289 HZ PHE 43 HZ PHE 43 2.019 13.193 -5.249 290 H ASP 44 H ASP 44 5.718 19.297 -4.957 291 HA ASP 44 HA ASP 44 7.389 19.536 -7.337 292 HB3 ASP 44 2HB ASP 44 7.279 21.546 -5.041 293 H ALA 45 H ALA 45 9.722 19.737 -6.217 294 HA ALA 45 HA ALA 45 9.965 17.813 -3.952 295 HB1 ALA 45 1HB ALA 45 11.191 17.331 -6.053 296 HB2 ALA 45 2HB ALA 45 12.027 18.894 -5.920 297 HB3 ALA 45 3HB ALA 45 12.292 17.627 -4.702 298 H ASP 46 H ASP 46 8.949 20.561 -3.432 299 HA ASP 46 HA ASP 46 11.161 22.240 -2.672 300 HB3 ASP 46 2HB ASP 46 8.199 22.686 -2.217 301 H MET 47 H MET 47 10.205 23.456 -0.388 302 HA MET 47 HA MET 47 9.832 21.397 1.720 303 HB3 MET 47 2HB MET 47 12.274 21.856 1.445 304 HG3 MET 47 2HG MET 47 11.683 24.572 2.658 305 HE1 MET 47 3HE MET 47 15.595 23.518 0.476 306 HE2 MET 47 1HE MET 47 14.284 22.335 0.553 307 HE3 MET 47 2HE MET 47 14.023 23.899 -0.249 308 H TYR 48 H TYR 48 9.211 24.643 0.471 309 HA TYR 48 HA TYR 48 7.586 25.207 2.890 310 HB3 TYR 48 2HB TYR 48 9.294 26.819 2.729 311 HD1 TYR 48 2HD TYR 48 7.493 28.152 -0.244 312 HD2 TYR 48 1HD TYR 48 11.234 26.594 1.281 313 HE1 TYR 48 2HE TYR 48 8.616 28.830 -2.310 314 HE2 TYR 48 1HE TYR 48 12.366 27.292 -0.811 315 HH TYR 48 HH TYR 48 10.572 28.207 -3.607 316 H LYS 49 H LYS 49 7.714 25.012 -0.699 317 HA LYS 49 HA LYS 49 4.993 25.986 -0.911 318 HB3 LYS 49 2HB LYS 49 6.159 24.144 -3.013 319 HG3 LYS 49 2HG LYS 49 3.953 25.417 -3.286 320 HD3 LYS 49 2HD LYS 49 5.901 27.791 -3.337 321 HE3 LYS 49 2HE LYS 49 3.720 29.068 -3.882 322 HZ1 LYS 49 3HZ LYS 49 4.983 29.218 -5.673 323 HZ2 LYS 49 1HZ LYS 49 3.991 28.073 -6.350 324 HZ3 LYS 49 2HZ LYS 49 5.443 27.656 -5.696 325 H THR 50 H THR 50 6.396 22.664 -1.037 326 HA THR 50 HA THR 50 3.963 21.362 -1.429 327 HB THR 50 HB THR 50 5.322 19.346 -0.684 328 HG1 THR 50 1HG THR 50 6.825 20.214 0.735 329 HG21 THR 50 3HG2 THR 50 6.474 21.310 -2.716 330 HG22 THR 50 1HG2 THR 50 5.342 19.978 -2.983 331 HG23 THR 50 2HG2 THR 50 7.023 19.649 -2.488 332 H SER 51 H SER 51 5.381 22.431 1.628 333 HA SER 51 HA SER 51 3.860 20.733 3.343 334 HB3 SER 51 2HB SER 51 4.807 23.578 3.899 335 HG SER 51 HG SER 51 5.217 22.395 5.965 336 H ASP 52 H ASP 52 3.199 23.831 1.717 337 HA ASP 52 HA ASP 52 0.658 24.359 2.975 338 HB3 ASP 52 2HB ASP 52 1.657 25.433 0.311 339 H ILE 53 H ILE 53 1.742 22.964 -0.134 340 HA ILE 53 HA ILE 53 -0.762 22.604 -1.379 341 HB ILE 53 HB ILE 53 1.721 20.828 -1.539 342 HG13 ILE 53 2HG1 ILE 53 2.098 23.231 -2.175 343 HG21 ILE 53 1HG2 ILE 53 -0.262 20.987 -3.779 344 HG22 ILE 53 2HG2 ILE 53 0.913 19.740 -3.387 345 HG23 ILE 53 3HG2 ILE 53 -0.570 19.856 -2.461 346 HD11 ILE 53 3HD1 ILE 53 2.067 21.701 -4.764 347 HD12 ILE 53 1HD1 ILE 53 3.207 22.950 -4.231 348 HD13 ILE 53 2HD1 ILE 53 3.267 21.338 -3.504 349 H ALA 54 H ALA 54 1.042 20.269 0.718 350 HA ALA 54 HA ALA 54 -1.096 18.388 0.775 351 HB1 ALA 54 1HB ALA 54 1.169 18.905 2.721 352 HB2 ALA 54 2HB ALA 54 0.127 17.453 2.737 353 HB3 ALA 54 3HB ALA 54 1.190 17.787 1.352 354 H LEU 55 H LEU 55 -0.310 21.107 3.023 355 HA LEU 55 HA LEU 55 -2.243 20.571 4.996 356 HB3 LEU 55 2HB LEU 55 -1.208 23.253 4.000 357 HG LEU 55 HG LEU 55 -1.161 23.773 6.498 358 HD11 LEU 55 1HD1 LEU 55 -3.297 24.890 6.398 359 HD12 LEU 55 2HD1 LEU 55 -3.796 23.864 5.029 360 HD13 LEU 55 3HD1 LEU 55 -2.457 25.003 4.844 361 HD21 LEU 55 3HD2 LEU 55 -3.434 21.766 6.606 362 HD22 LEU 55 1HD2 LEU 55 -2.953 22.887 7.890 363 HD23 LEU 55 2HD2 LEU 55 -1.855 21.591 7.380 364 H ASP 56 H ASP 56 -2.539 22.409 1.962 365 HA ASP 56 HA ASP 56 -5.268 23.215 2.205 366 HB3 ASP 56 2HB ASP 56 -3.278 22.881 -0.074 367 H GLN 57 H GLN 57 -3.751 20.342 0.667 368 HA GLN 57 HA GLN 57 -6.325 19.124 0.037 369 HB3 GLN 57 2HB GLN 57 -5.040 17.276 -0.832 370 HG3 GLN 57 2HG GLN 57 -3.699 19.881 -1.648 371 HE21 GLN 57 1HE2 GLN 57 -5.569 18.158 -3.892 372 HE22 GLN 57 2HE2 GLN 57 -4.206 17.566 -4.854 373 H ILE 58 H ILE 58 -5.194 19.601 2.978 374 HA ILE 58 HA ILE 58 -6.098 16.974 4.067 375 HB ILE 58 HB ILE 58 -4.190 19.082 5.072 376 HG13 ILE 58 2HG1 ILE 58 -3.514 17.000 3.673 377 HG21 ILE 58 1HG2 ILE 58 -4.062 18.031 7.290 378 HG22 ILE 58 2HG2 ILE 58 -5.642 18.728 7.013 379 HG23 ILE 58 3HG2 ILE 58 -5.430 16.979 6.888 380 HD11 ILE 58 3HD1 ILE 58 -2.185 17.263 6.387 381 HD12 ILE 58 1HD1 ILE 58 -1.453 16.737 4.855 382 HD13 ILE 58 2HD1 ILE 58 -1.936 18.423 5.074 383 H GLN 59 H GLN 59 -6.282 20.538 4.601 384 HA GLN 59 HA GLN 59 -8.036 20.217 6.755 385 HB3 GLN 59 2HB GLN 59 -8.472 22.779 6.271 386 HG3 GLN 59 2HG GLN 59 -5.643 21.841 6.796 387 HE21 GLN 59 1HE2 GLN 59 -5.893 24.177 5.410 388 HE22 GLN 59 2HE2 GLN 59 -5.645 25.538 6.482 389 H GLY 60 H GLY 60 -9.027 19.696 3.565 390 HA2 GLY 60 1HA GLY 60 -11.208 19.359 2.811 391 HA3 GLY 60 2HA GLY 60 -11.844 20.362 4.129 392 H ASN 61 H ASN 61 -9.225 22.005 2.983 393 HA ASN 61 HA ASN 61 -10.776 24.131 1.915 394 HB3 ASN 61 2HB ASN 61 -8.564 25.100 1.269 395 HD21 ASN 61 1HD2 ASN 61 -6.749 25.700 2.863 396 HD22 ASN 61 2HD2 ASN 61 -7.239 25.831 4.545 397 H LYS 62 H LYS 62 -8.695 21.686 0.360 398 HA LYS 62 HA LYS 62 -9.937 22.277 -2.280 399 HB3 LYS 62 2HB LYS 62 -7.362 21.472 -2.977 400 HG3 LYS 62 2HG LYS 62 -6.653 23.707 -3.156 401 HD3 LYS 62 2HD LYS 62 -9.417 24.578 -3.410 402 HE3 LYS 62 2HE LYS 62 -7.463 25.533 -4.641 403 HZ1 LYS 62 3HZ LYS 62 -7.482 22.968 -6.131 404 HZ2 LYS 62 1HZ LYS 62 -6.298 23.430 -5.115 405 HZ3 LYS 62 2HZ LYS 62 -6.552 24.298 -6.480 406 H ASP 63 H ASP 63 -9.050 20.564 -3.833 407 HA ASP 63 HA ASP 63 -10.544 18.190 -3.046 408 HB3 ASP 63 2HB ASP 63 -9.136 18.508 -5.679 409 H PHE 64 H PHE 64 -9.677 16.060 -3.612 410 HA PHE 64 HA PHE 64 -6.935 15.695 -2.508 411 HB3 PHE 64 2HB PHE 64 -8.396 14.236 -1.445 412 HD1 PHE 64 2HD PHE 64 -10.789 14.802 -1.740 413 HD2 PHE 64 1HD PHE 64 -8.736 12.084 -4.398 414 HE1 PHE 64 2HE PHE 64 -12.953 13.908 -2.494 415 HE2 PHE 64 1HE PHE 64 -10.922 11.174 -5.137 416 HZ PHE 64 HZ PHE 64 -13.036 12.079 -4.191 417 HA PRO 65 HA PRO 65 -5.249 14.980 -6.527 418 HB3 PRO 65 2HB PRO 65 -3.212 14.835 -5.505 419 HG3 PRO 65 2HG PRO 65 -2.873 13.590 -3.490 420 HD3 PRO 65 2HD PRO 65 -4.580 15.182 -3.080 421 H GLU 66 H GLU 66 -4.626 13.175 -8.077 422 HA GLU 66 HA GLU 66 -6.357 10.785 -7.842 423 HB3 GLU 66 2HB GLU 66 -7.268 12.460 -9.531 424 HG3 GLU 66 2HG GLU 66 -4.775 11.575 -11.091 425 H ILE 67 H ILE 67 -5.446 9.172 -9.711 426 HA ILE 67 HA ILE 67 -2.511 9.011 -9.321 427 HB ILE 67 HB ILE 67 -2.751 6.669 -8.720 428 HG13 ILE 67 2HG1 ILE 67 -4.697 6.008 -9.977 429 HG21 ILE 67 1HG2 ILE 67 -4.631 8.252 -6.926 430 HG22 ILE 67 2HG2 ILE 67 -3.533 6.930 -6.469 431 HG23 ILE 67 3HG2 ILE 67 -2.881 8.489 -6.952 432 HD11 ILE 67 3HD1 ILE 67 -5.600 5.763 -7.095 433 HD12 ILE 67 1HD1 ILE 67 -5.969 4.697 -8.460 434 HD13 ILE 67 2HD1 ILE 67 -4.306 4.774 -7.828 435 H GLN 68 H GLN 68 -1.437 7.562 -10.744 436 HA GLN 68 HA GLN 68 -2.822 6.875 -13.269 437 HB3 GLN 68 2HB GLN 68 -0.626 7.167 -14.354 438 HG3 GLN 68 2HG GLN 68 -1.613 9.615 -12.883 439 HE21 GLN 68 1HE2 GLN 68 -1.300 11.724 -14.363 440 HE22 GLN 68 2HE2 GLN 68 0.174 11.711 -15.299 441 H LEU 69 H LEU 69 -2.998 4.806 -13.291 442 HA LEU 69 HA LEU 69 -0.904 2.948 -12.808 443 HB3 LEU 69 2HB LEU 69 -1.440 2.791 -10.584 444 HG LEU 69 HG LEU 69 -3.252 4.329 -10.112 445 HD11 LEU 69 1HD1 LEU 69 -5.647 3.704 -10.624 446 HD12 LEU 69 2HD1 LEU 69 -5.046 2.424 -11.697 447 HD13 LEU 69 3HD1 LEU 69 -4.714 4.135 -12.065 448 HD21 LEU 69 3HD2 LEU 69 -2.839 2.416 -8.630 449 HD22 LEU 69 1HD2 LEU 69 -3.934 1.402 -9.591 450 HD23 LEU 69 2HD2 LEU 69 -4.595 2.747 -8.667 451 H ASP 70 H ASP 70 -1.877 0.731 -13.105 452 HA ASP 70 HA ASP 70 -3.630 0.581 -15.479 453 HB3 ASP 70 2HB ASP 70 -3.159 -1.930 -15.038 454 H ASN 71 H ASN 71 -5.482 -1.012 -15.338 455 HA ASN 71 HA ASN 71 -6.870 -0.844 -12.708 456 HB3 ASN 71 2HB ASN 71 -8.162 -2.201 -15.064 457 HD21 ASN 71 1HD2 ASN 71 -8.767 0.763 -13.230 458 HD22 ASN 71 2HD2 ASN 71 -10.129 0.152 -12.277 459 H ILE 72 H ILE 72 -7.308 -2.685 -11.555 460 HA ILE 72 HA ILE 72 -6.466 -5.307 -12.589 461 HB ILE 72 HB ILE 72 -5.234 -4.113 -10.097 462 HG13 ILE 72 2HG1 ILE 72 -4.170 -3.244 -12.155 463 HG21 ILE 72 1HG2 ILE 72 -5.621 -6.514 -9.733 464 HG22 ILE 72 2HG2 ILE 72 -4.876 -6.895 -11.295 465 HG23 ILE 72 3HG2 ILE 72 -3.912 -6.255 -9.951 466 HD11 ILE 72 3HD1 ILE 72 -1.925 -3.625 -11.711 467 HD12 ILE 72 1HD1 ILE 72 -2.755 -3.637 -10.145 468 HD13 ILE 72 2HD1 ILE 72 -2.229 -5.169 -10.896 469 H ASP 73 H ASP 73 -7.307 -7.055 -11.186 470 HA ASP 73 HA ASP 73 -9.880 -6.411 -10.009 471 HB3 ASP 73 2HB ASP 73 -9.759 -7.861 -11.935 472 H TYR 74 H TYR 74 -8.636 -5.489 -8.204 473 HA TYR 74 HA TYR 74 -6.957 -6.887 -6.455 474 HB3 TYR 74 2HB TYR 74 -7.621 -5.223 -4.746 475 HD1 TYR 74 2HD TYR 74 -5.680 -5.246 -7.404 476 HD2 TYR 74 1HD TYR 74 -8.291 -2.444 -5.433 477 HE1 TYR 74 2HE TYR 74 -4.364 -3.353 -8.296 478 HE2 TYR 74 1HE TYR 74 -7.055 -0.555 -6.400 479 HH TYR 74 HH TYR 74 -5.068 0.045 -7.615 480 H ASN 75 H ASN 75 -10.401 -7.494 -6.817 481 HA ASN 75 HA ASN 75 -11.077 -8.227 -4.154 482 HB3 ASN 75 2HB ASN 75 -11.969 -9.446 -6.794 483 HD21 ASN 75 1HD2 ASN 75 -13.339 -8.550 -3.551 484 HD22 ASN 75 2HD2 ASN 75 -14.166 -10.057 -3.362 485 H ASN 76 H ASN 76 -9.375 -9.955 -6.692 486 HA ASN 76 HA ASN 76 -9.687 -12.573 -5.530 487 HB3 ASN 76 2HB ASN 76 -8.334 -13.316 -7.403 488 HD21 ASN 76 1HD2 ASN 76 -9.242 -10.190 -8.742 489 HD22 ASN 76 2HD2 ASN 76 -10.575 -10.797 -9.651 490 H TYR 77 H TYR 77 -7.768 -10.219 -4.252 491 HA TYR 77 HA TYR 77 -5.191 -11.753 -4.251 492 HB3 TYR 77 2HB TYR 77 -4.354 -9.331 -3.834 493 HD1 TYR 77 2HD TYR 77 -6.757 -9.253 -6.657 494 HD2 TYR 77 1HD TYR 77 -2.797 -10.329 -5.404 495 HE1 TYR 77 2HE TYR 77 -6.080 -9.442 -9.029 496 HE2 TYR 77 1HE TYR 77 -2.046 -10.380 -7.745 497 HH TYR 77 HH TYR 77 -2.638 -10.131 -9.975 498 H ASP 78 H ASP 78 -4.883 -12.703 -2.469 499 HA ASP 78 HA ASP 78 -6.363 -12.670 -0.119 500 HB3 ASP 78 2HB ASP 78 -3.440 -13.449 -0.017 501 H LEU 79 H LEU 79 -3.456 -10.978 -0.886 502 HA LEU 79 HA LEU 79 -3.525 -9.241 1.546 503 HB3 LEU 79 2HB LEU 79 -0.842 -10.214 0.643 504 HG LEU 79 HG LEU 79 -1.928 -10.466 3.441 505 HD11 LEU 79 1HD1 LEU 79 0.333 -10.337 4.076 506 HD12 LEU 79 2HD1 LEU 79 0.864 -9.901 2.432 507 HD13 LEU 79 3HD1 LEU 79 0.189 -11.513 2.767 508 HD21 LEU 79 3HD2 LEU 79 -2.359 -8.133 3.130 509 HD22 LEU 79 1HD2 LEU 79 -0.806 -7.888 2.270 510 HD23 LEU 79 2HD2 LEU 79 -0.848 -8.261 4.004 511 H ILE 80 H ILE 80 -2.811 -7.045 0.956 512 HA ILE 80 HA ILE 80 -1.441 -6.737 -1.673 513 HB ILE 80 HB ILE 80 -3.772 -5.047 -0.736 514 HG13 ILE 80 2HG1 ILE 80 -4.568 -7.218 -1.493 515 HG21 ILE 80 1HG2 ILE 80 -1.966 -3.816 -2.016 516 HG22 ILE 80 2HG2 ILE 80 -2.192 -4.947 -3.353 517 HG23 ILE 80 3HG2 ILE 80 -3.506 -3.861 -2.852 518 HD11 ILE 80 3HD1 ILE 80 -6.082 -6.613 -3.202 519 HD12 ILE 80 1HD1 ILE 80 -5.834 -5.163 -2.212 520 HD13 ILE 80 2HD1 ILE 80 -5.042 -5.313 -3.801 521 H LEU 81 H LEU 81 0.537 -5.921 -1.232 522 HA LEU 81 HA LEU 81 0.935 -4.260 1.191 523 HB3 LEU 81 2HB LEU 81 3.360 -4.210 0.012 524 HG LEU 81 HG LEU 81 3.997 -6.460 0.873 525 HD11 LEU 81 1HD1 LEU 81 3.644 -5.877 3.257 526 HD12 LEU 81 2HD1 LEU 81 2.515 -4.595 2.760 527 HD13 LEU 81 3HD1 LEU 81 4.226 -4.513 2.292 528 HD21 LEU 81 3HD2 LEU 81 1.158 -6.632 1.952 529 HD22 LEU 81 1HD2 LEU 81 2.475 -7.794 2.178 530 HD23 LEU 81 2HD2 LEU 81 1.768 -7.572 0.572 531 H ILE 82 H ILE 82 1.416 -2.057 1.121 532 HA ILE 82 HA ILE 82 1.717 -0.769 -1.518 533 HB ILE 82 HB ILE 82 -0.151 0.032 0.742 534 HG13 ILE 82 2HG1 ILE 82 -0.471 -0.918 -2.083 535 HG21 ILE 82 1HG2 ILE 82 -0.594 2.145 -0.428 536 HG22 ILE 82 2HG2 ILE 82 1.051 2.079 0.202 537 HG23 ILE 82 3HG2 ILE 82 0.756 1.827 -1.536 538 HD11 ILE 82 3HD1 ILE 82 -1.441 -2.117 -0.097 539 HD12 ILE 82 1HD1 ILE 82 -2.472 -0.698 0.188 540 HD13 ILE 82 2HD1 ILE 82 -2.650 -1.631 -1.306 541 H GLY 83 H GLY 83 3.147 0.860 -1.617 542 HA2 GLY 83 1HA GLY 83 4.765 1.578 0.789 543 HA3 GLY 83 2HA GLY 83 5.477 1.297 -0.781 544 H SER 84 H SER 84 4.774 3.875 1.052 545 HA SER 84 HA SER 84 4.390 5.534 -1.392 546 HB3 SER 84 2HB SER 84 2.294 5.895 -0.734 547 HG SER 84 HG SER 84 3.079 5.258 1.905 548 HA PRO 85 HA PRO 85 7.807 7.797 0.394 549 HB3 PRO 85 2HB PRO 85 7.999 8.727 -1.691 550 HG3 PRO 85 2HG PRO 85 6.093 9.541 -2.895 551 HD3 PRO 85 2HD PRO 85 5.724 7.247 -2.469 552 H VAL 86 H VAL 86 8.269 9.721 1.700 553 HA VAL 86 HA VAL 86 5.946 10.921 3.133 554 HB VAL 86 HB VAL 86 8.744 10.209 4.099 555 HG11 VAL 86 1HG1 VAL 86 7.784 12.252 5.231 556 HG12 VAL 86 2HG1 VAL 86 6.416 11.240 5.769 557 HG13 VAL 86 3HG1 VAL 86 8.104 10.872 6.211 558 HG21 VAL 86 3HG2 VAL 86 7.375 8.207 3.920 559 HG22 VAL 86 1HG2 VAL 86 7.545 8.625 5.632 560 HG23 VAL 86 2HG2 VAL 86 6.027 8.987 4.790 561 H TRP 87 H TRP 87 6.069 13.158 3.528 562 HA TRP 87 HA TRP 87 8.137 14.756 2.157 563 HB3 TRP 87 2HB TRP 87 5.592 16.113 2.622 564 HD1 TRP 87 HD TRP 87 6.959 17.867 0.899 565 HE1 TRP 87 1HE TRP 87 7.090 17.894 -1.700 566 HE3 TRP 87 3HE TRP 87 5.570 13.067 -0.041 567 HZ2 TRP 87 2HZ TRP 87 6.691 16.054 -3.861 568 HZ3 TRP 87 3HZ TRP 87 5.335 12.248 -2.353 569 HH2 TRP 87 HH TRP 87 5.923 13.721 -4.288 570 H SER 88 H SER 88 7.405 17.191 3.262 571 HA SER 88 HA SER 88 8.330 17.666 5.788 572 HB3 SER 88 2HB SER 88 7.149 19.776 5.444 573 HG SER 88 HG SER 88 8.681 19.864 3.982 574 H GLY 89 H GLY 89 7.508 15.883 6.978 575 HA2 GLY 89 1HA GLY 89 6.335 15.463 9.010 576 HA3 GLY 89 2HA GLY 89 5.146 16.677 8.562 577 H TYR 90 H TYR 90 4.469 15.512 5.887 578 HA TYR 90 HA TYR 90 3.136 13.009 6.786 579 HB3 TYR 90 2HB TYR 90 1.322 14.228 7.099 580 HD1 TYR 90 1HD TYR 90 2.953 16.300 4.331 581 HD2 TYR 90 2HD TYR 90 0.286 16.169 7.726 582 HE1 TYR 90 1HE TYR 90 2.760 18.746 4.283 583 HE2 TYR 90 2HE TYR 90 0.008 18.593 7.619 584 HH TYR 90 HH TYR 90 1.439 20.621 5.047 585 HA PRO 91 HA PRO 91 3.858 11.738 2.507 586 HB3 PRO 91 2HB PRO 91 2.939 9.662 3.053 587 HG3 PRO 91 2HG PRO 91 0.944 9.484 4.400 588 HD3 PRO 91 2HD PRO 91 2.620 10.685 5.650 589 H ALA 92 H ALA 92 3.131 12.227 0.428 590 HA ALA 92 HA ALA 92 1.646 14.612 0.006 591 HB1 ALA 92 1HB ALA 92 3.220 12.663 -1.545 592 HB2 ALA 92 2HB ALA 92 2.173 13.735 -2.453 593 HB3 ALA 92 3HB ALA 92 3.379 14.433 -1.393 594 H THR 93 H THR 93 -0.013 12.491 1.131 595 HA THR 93 HA THR 93 -1.778 11.056 0.839 596 HB THR 93 HB THR 93 -3.758 12.334 0.198 597 HG1 THR 93 1HG THR 93 -3.686 14.298 -0.587 598 HG21 THR 93 3HG2 THR 93 -2.707 12.736 2.434 599 HG22 THR 93 1HG2 THR 93 -3.533 14.174 1.802 600 HG23 THR 93 2HG2 THR 93 -1.777 14.092 1.728 601 HA PRO 94 HA PRO 94 -1.318 9.765 -3.649 602 HB3 PRO 94 2HB PRO 94 1.043 9.479 -3.557 603 HG3 PRO 94 2HG PRO 94 2.127 8.658 -1.597 604 HD3 PRO 94 2HD PRO 94 1.021 10.625 -1.101 605 H ILE 95 H ILE 95 -2.026 8.033 -0.711 606 HA ILE 95 HA ILE 95 -3.195 5.843 -2.359 607 HB ILE 95 HB ILE 95 -2.607 5.704 0.603 608 HG13 ILE 95 2HG1 ILE 95 -0.559 4.459 0.083 609 HG21 ILE 95 1HG2 ILE 95 -4.131 3.995 -0.343 610 HG22 ILE 95 2HG2 ILE 95 -2.907 3.531 -1.527 611 HG23 ILE 95 3HG2 ILE 95 -2.625 3.291 0.213 612 HD11 ILE 95 3HD1 ILE 95 -0.761 3.904 -2.348 613 HD12 ILE 95 1HD1 ILE 95 -0.512 5.612 -2.740 614 HD13 ILE 95 2HD1 ILE 95 0.759 4.712 -1.934 615 H LYS 96 H LYS 96 -4.181 8.745 -1.425 616 HA LYS 96 HA LYS 96 -6.550 8.322 0.159 617 HB3 LYS 96 2HB LYS 96 -5.600 10.595 -1.631 618 HG3 LYS 96 2HG LYS 96 -7.999 10.894 -1.415 619 HD3 LYS 96 2HD LYS 96 -7.459 10.487 1.545 620 HE3 LYS 96 2HE LYS 96 -8.616 12.675 1.325 621 HZ1 LYS 96 3HZ LYS 96 -10.922 12.636 0.678 622 HZ2 LYS 96 1HZ LYS 96 -10.822 11.099 0.123 623 HZ3 LYS 96 2HZ LYS 96 -9.997 12.287 -0.639 624 H THR 97 H THR 97 -5.928 8.719 -3.394 625 HA THR 97 HA THR 97 -8.739 8.358 -3.998 626 HB THR 97 HB THR 97 -6.698 7.670 -6.065 627 HG1 THR 97 1HG THR 97 -6.847 10.417 -5.531 628 HG21 THR 97 3HG2 THR 97 -9.082 7.998 -6.625 629 HG22 THR 97 1HG2 THR 97 -8.034 9.140 -7.485 630 HG23 THR 97 2HG2 THR 97 -8.980 9.684 -6.077 631 H LEU 98 H LEU 98 -5.924 6.159 -3.855 632 HA LEU 98 HA LEU 98 -7.094 3.886 -5.086 633 HB3 LEU 98 2HB LEU 98 -5.473 2.711 -3.207 634 HG LEU 98 HG LEU 98 -4.544 4.329 -5.569 635 HD11 LEU 98 1HD1 LEU 98 -2.906 2.436 -3.845 636 HD12 LEU 98 2HD1 LEU 98 -2.669 4.197 -4.034 637 HD13 LEU 98 3HD1 LEU 98 -2.395 3.118 -5.405 638 HD21 LEU 98 3HD2 LEU 98 -4.192 1.992 -6.518 639 HD22 LEU 98 1HD2 LEU 98 -5.895 2.379 -6.197 640 HD23 LEU 98 2HD2 LEU 98 -4.977 1.342 -5.076 641 H LEU 99 H LEU 99 -6.970 4.751 -1.610 642 HA LEU 99 HA LEU 99 -8.155 2.435 -0.646 643 HB3 LEU 99 2HB LEU 99 -6.914 4.420 0.455 644 HG LEU 99 HG LEU 99 -9.290 5.823 0.162 645 HD11 LEU 99 1HD1 LEU 99 -9.275 4.455 2.884 646 HD12 LEU 99 2HD1 LEU 99 -10.322 3.982 1.527 647 HD13 LEU 99 3HD1 LEU 99 -10.493 5.620 2.263 648 HD21 LEU 99 3HD2 LEU 99 -7.865 6.257 2.715 649 HD22 LEU 99 1HD2 LEU 99 -8.499 7.411 1.555 650 HD23 LEU 99 2HD2 LEU 99 -6.992 6.534 1.197 651 H ASP 100 H ASP 100 -9.763 5.307 -1.933 652 HA ASP 100 HA ASP 100 -12.383 4.711 -1.005 653 HB3 ASP 100 2HB ASP 100 -11.733 6.204 -3.527 654 H GLN 101 H GLN 101 -10.622 3.956 -4.014 655 HA GLN 101 HA GLN 101 -12.713 2.427 -5.306 656 HB3 GLN 101 2HB GLN 101 -10.906 1.642 -6.752 657 HG3 GLN 101 2HG GLN 101 -10.462 4.573 -6.067 658 HE21 GLN 101 1HE2 GLN 101 -9.799 5.878 -7.913 659 HE22 GLN 101 2HE2 GLN 101 -8.817 5.158 -9.184 660 H MET 102 H MET 102 -10.073 1.696 -3.012 661 HA MET 102 HA MET 102 -10.305 -1.101 -3.264 662 HB3 MET 102 2HB MET 102 -8.931 -1.193 -1.162 663 HG3 MET 102 2HG MET 102 -8.051 0.493 -3.522 664 HE1 MET 102 3HE MET 102 -6.699 -1.793 -0.479 665 HE2 MET 102 1HE MET 102 -6.174 -2.514 -2.015 666 HE3 MET 102 2HE MET 102 -4.981 -1.782 -0.936 667 H LYS 103 H LYS 103 -12.441 1.068 -1.598 668 HA LYS 103 HA LYS 103 -13.267 -0.332 0.602 669 HB3 LYS 103 2HB LYS 103 -14.818 1.311 -1.460 670 HG3 LYS 103 2HG LYS 103 -16.305 0.314 0.195 671 HD3 LYS 103 2HD LYS 103 -14.912 0.296 2.253 672 HE3 LYS 103 2HE LYS 103 -15.047 3.305 1.854 673 HZ1 LYS 103 3HZ LYS 103 -14.490 1.904 4.403 674 HZ2 LYS 103 1HZ LYS 103 -15.601 3.083 4.109 675 HZ3 LYS 103 2HZ LYS 103 -14.010 3.441 4.036 676 H ASN 104 H ASN 104 -13.721 -1.235 -2.676 677 HA ASN 104 HA ASN 104 -16.133 -2.822 -2.417 678 HB3 ASN 104 2HB ASN 104 -15.467 -3.709 -4.653 679 HD21 ASN 104 1HD2 ASN 104 -13.908 -0.597 -5.122 680 HD22 ASN 104 2HD2 ASN 104 -15.371 0.254 -5.503 681 H TYR 105 H TYR 105 -12.790 -3.472 -1.518 682 HA TYR 105 HA TYR 105 -13.131 -6.349 -2.130 683 HB3 TYR 105 2HB TYR 105 -10.727 -6.370 -2.333 684 HD1 TYR 105 1HD TYR 105 -12.542 -6.292 -4.553 685 HD2 TYR 105 2HD TYR 105 -10.098 -3.114 -3.039 686 HE1 TYR 105 1HE TYR 105 -12.664 -5.192 -6.761 687 HE2 TYR 105 2HE TYR 105 -10.373 -1.878 -5.242 688 HH TYR 105 HH TYR 105 -10.984 -2.076 -7.476 689 H ARG 106 H ARG 106 -11.912 -7.890 -0.726 690 HA ARG 106 HA ARG 106 -12.156 -7.273 2.180 691 HB3 ARG 106 2HB ARG 106 -13.296 -9.503 2.321 692 HG3 ARG 106 2HG ARG 106 -15.424 -8.946 0.930 693 HD3 ARG 106 2HD ARG 106 -15.972 -6.903 2.416 694 HE ARG 106 HE ARG 106 -15.264 -9.594 3.360 695 HH11 ARG 106 1HH1 ARG 106 -16.881 -6.571 4.352 696 HH12 ARG 106 2HH1 ARG 106 -17.934 -7.377 5.457 697 HH21 ARG 106 1HH2 ARG 106 -16.534 -10.579 4.793 698 HH22 ARG 106 2HH2 ARG 106 -17.653 -9.741 5.825 699 H GLY 107 H GLY 107 -10.041 -7.585 2.930 700 HA2 GLY 107 1HA GLY 107 -8.669 -9.884 3.099 701 HA3 GLY 107 2HA GLY 107 -8.186 -9.288 1.497 702 H GLU 108 H GLU 108 -6.090 -9.318 3.044 703 HA GLU 108 HA GLU 108 -5.929 -7.018 4.834 704 HB3 GLU 108 2HB GLU 108 -4.919 -8.550 6.029 705 HG3 GLU 108 2HG GLU 108 -4.005 -10.126 3.637 706 H VAL 109 H VAL 109 -4.474 -5.440 4.773 707 HA VAL 109 HA VAL 109 -3.097 -4.962 2.209 708 HB VAL 109 HB VAL 109 -5.147 -3.099 3.477 709 HG11 VAL 109 1HG1 VAL 109 -4.930 -1.797 1.387 710 HG12 VAL 109 2HG1 VAL 109 -3.349 -1.953 2.140 711 HG13 VAL 109 3HG1 VAL 109 -3.757 -2.981 0.755 712 HG21 VAL 109 3HG2 VAL 109 -5.494 -4.861 1.020 713 HG22 VAL 109 1HG2 VAL 109 -6.448 -4.872 2.524 714 HG23 VAL 109 2HG2 VAL 109 -6.548 -3.498 1.439 715 H ALA 110 H ALA 110 -0.900 -4.525 3.042 716 HA ALA 110 HA ALA 110 -0.824 -2.915 5.583 717 HB1 ALA 110 1HB ALA 110 1.587 -4.406 4.755 718 HB2 ALA 110 2HB ALA 110 0.908 -4.047 6.357 719 HB3 ALA 110 3HB ALA 110 0.212 -5.338 5.350 720 H SER 111 H SER 111 0.768 -1.267 5.884 721 HA SER 111 HA SER 111 1.591 0.005 3.332 722 HB3 SER 111 2HB SER 111 -0.172 1.300 3.804 723 HG SER 111 HG SER 111 -0.915 1.768 5.907 724 H PHE 112 H PHE 112 3.706 0.110 3.183 725 HA PHE 112 HA PHE 112 5.266 0.913 5.598 726 HB3 PHE 112 2HB PHE 112 6.143 -1.139 4.623 727 HD1 PHE 112 1HD PHE 112 4.935 -1.995 2.570 728 HD2 PHE 112 2HD PHE 112 8.088 0.944 2.355 729 HE1 PHE 112 1HE PHE 112 5.226 -2.479 0.159 730 HE2 PHE 112 2HE PHE 112 8.383 0.430 -0.054 731 HZ PHE 112 HZ PHE 112 6.947 -1.271 -1.162 732 H PHE 113 H PHE 113 7.045 2.425 5.033 733 HA PHE 113 HA PHE 113 6.540 4.302 2.878 734 HB3 PHE 113 2HB PHE 113 6.768 6.234 4.439 735 HD1 PHE 113 1HD PHE 113 4.431 3.842 6.158 736 HD2 PHE 113 2HD PHE 113 4.843 7.173 3.423 737 HE1 PHE 113 1HE PHE 113 1.975 4.052 6.045 738 HE2 PHE 113 2HE PHE 113 2.379 7.378 3.338 739 HZ PHE 113 HZ PHE 113 0.941 5.785 4.598 740 H THR 114 H THR 114 8.465 5.972 3.022 741 HA THR 114 HA THR 114 10.894 4.842 4.264 742 HB THR 114 HB THR 114 12.069 5.586 2.080 743 HG1 THR 114 1HG THR 114 10.139 6.539 1.212 744 HG21 THR 114 3HG2 THR 114 11.798 3.418 1.026 745 HG22 THR 114 1HG2 THR 114 10.279 3.122 1.898 746 HG23 THR 114 2HG2 THR 114 11.817 3.203 2.785 747 H SER 115 H SER 115 11.810 6.466 5.469 748 HA SER 115 HA SER 115 11.539 9.239 4.529 749 HB3 SER 115 2HB SER 115 9.843 8.514 6.496 750 HG SER 115 HG SER 115 11.728 9.701 8.038 751 H ALA 116 H ALA 116 12.991 10.533 6.363 752 HA ALA 116 HA ALA 116 15.646 9.199 6.482 753 HB1 ALA 116 1HB ALA 116 16.501 11.553 6.297 754 HB2 ALA 116 2HB ALA 116 15.628 11.000 4.873 755 HB3 ALA 116 3HB ALA 116 14.823 12.083 6.021 756 H GLY 117 H GLY 117 13.879 8.595 8.519 757 HA2 GLY 117 1HA GLY 117 14.135 8.293 10.743 758 HA3 GLY 117 2HA GLY 117 15.597 9.266 10.625 759 H THR 118 H THR 118 12.294 10.607 10.004 760 HA THR 118 HA THR 118 12.232 11.742 12.744 761 HB THR 118 HB THR 118 11.418 13.915 11.741 762 HG1 THR 118 1HG THR 118 12.020 14.385 9.639 763 HG21 THR 118 3HG2 THR 118 13.717 13.626 12.676 764 HG22 THR 118 1HG2 THR 118 13.638 14.832 11.384 765 HG23 THR 118 2HG2 THR 118 14.296 13.224 11.038 766 H ASN 119 H ASN 119 9.862 12.770 13.068 767 HA ASN 119 HA ASN 119 7.684 12.849 12.924 768 HB3 ASN 119 2HB ASN 119 6.846 13.287 10.564 769 HD21 ASN 119 1HD2 ASN 119 8.868 14.892 9.098 770 HD22 ASN 119 2HD2 ASN 119 9.021 16.319 10.082 771 H HIS 120 H HIS 120 8.788 10.034 12.832 772 HA HIS 120 HA HIS 120 7.304 8.198 11.550 773 HB3 HIS 120 2HB HIS 120 9.187 7.624 12.930 774 HD1 HIS 120 1HD HIS 120 7.248 6.836 16.014 775 HD2 HIS 120 2HD HIS 120 9.906 9.771 14.588 776 HE1 HIS 120 1HE HIS 120 7.863 8.262 18.022 777 H LYS 121 H LYS 121 6.245 9.751 14.699 778 HA LYS 121 HA LYS 121 3.847 8.220 14.760 779 HB3 LYS 121 2HB LYS 121 4.034 10.986 16.018 780 HG3 LYS 121 2HG LYS 121 3.368 8.198 16.919 781 HD3 LYS 121 2HD LYS 121 2.898 10.845 18.371 782 HE3 LYS 121 2HE LYS 121 2.415 9.006 20.241 783 HZ1 LYS 121 3HZ LYS 121 0.816 10.665 19.482 784 HZ2 LYS 121 1HZ LYS 121 0.116 9.216 19.844 785 HZ3 LYS 121 2HZ LYS 121 0.305 9.682 18.281 786 H ALA 122 H ALA 122 4.704 11.356 13.277 787 HA ALA 122 HA ALA 122 2.041 12.173 12.780 788 HB1 ALA 122 1HB ALA 122 4.516 12.914 11.158 789 HB2 ALA 122 2HB ALA 122 2.963 13.751 11.163 790 HB3 ALA 122 3HB ALA 122 3.962 13.748 12.631 791 H TYR 123 H TYR 123 4.407 10.366 10.708 792 HA TYR 123 HA TYR 123 2.883 10.081 8.427 793 HB3 TYR 123 2HB TYR 123 4.255 8.218 7.860 794 HD1 TYR 123 2HD TYR 123 4.814 11.342 8.309 795 HD2 TYR 123 1HD TYR 123 6.887 7.650 9.150 796 HE1 TYR 123 2HE TYR 123 6.929 12.515 8.167 797 HE2 TYR 123 1HE TYR 123 9.048 8.833 8.977 798 HH TYR 123 HH TYR 123 9.163 12.286 8.004 799 H VAL 124 H VAL 124 2.939 7.796 11.202 800 HA VAL 124 HA VAL 124 1.047 6.019 10.035 801 HB VAL 124 HB VAL 124 1.968 6.416 12.903 802 HG11 VAL 124 1HG1 VAL 124 -0.086 5.104 12.944 803 HG12 VAL 124 2HG1 VAL 124 0.493 4.071 11.627 804 HG13 VAL 124 3HG1 VAL 124 1.289 4.025 13.211 805 HG21 VAL 124 3HG2 VAL 124 3.445 4.458 12.389 806 HG22 VAL 124 1HG2 VAL 124 2.920 4.525 10.702 807 HG23 VAL 124 2HG2 VAL 124 3.839 5.866 11.404 808 H SER 125 H SER 125 0.641 8.800 12.297 809 HA SER 125 HA SER 125 -2.181 8.491 12.668 810 HB3 SER 125 2HB SER 125 -1.833 11.118 12.997 811 HG SER 125 HG SER 125 -2.229 9.847 14.616 812 H HIS 126 H HIS 126 -0.239 10.267 10.193 813 HA HIS 126 HA HIS 126 -2.511 11.488 9.007 814 HB3 HIS 126 2HB HIS 126 0.005 10.885 7.422 815 HD1 HIS 126 1HD HIS 126 -0.760 12.210 5.174 816 HD2 HIS 126 2HD HIS 126 -1.825 14.005 8.845 817 HE1 HIS 126 1HE HIS 126 -1.879 14.411 4.602 818 H PHE 127 H PHE 127 -0.728 8.474 8.251 819 HA PHE 127 HA PHE 127 -2.291 7.723 5.980 820 HB3 PHE 127 2HB PHE 127 -0.789 6.070 8.041 821 HD1 PHE 127 2HD PHE 127 -1.499 5.603 4.318 822 HD2 PHE 127 1HD PHE 127 -2.119 4.110 8.346 823 HE1 PHE 127 2HE PHE 127 -2.510 3.536 3.433 824 HE2 PHE 127 1HE PHE 127 -3.140 2.072 7.418 825 HZ PHE 127 HZ PHE 127 -3.312 1.768 4.951 826 H ASN 128 H ASN 128 -2.772 7.099 9.516 827 HA ASN 128 HA ASN 128 -4.881 5.346 9.247 828 HB3 ASN 128 2HB ASN 128 -5.666 6.698 11.515 829 HD21 ASN 128 1HD2 ASN 128 -2.339 5.404 11.575 830 HD22 ASN 128 2HD2 ASN 128 -2.839 3.810 12.157 831 H GLU 129 H GLU 129 -5.189 8.890 9.218 832 HA GLU 129 HA GLU 129 -8.067 8.988 8.948 833 HB3 GLU 129 2HB GLU 129 -7.073 11.256 7.666 834 HG3 GLU 129 2HG GLU 129 -6.732 11.841 10.385 835 H TRP 130 H TRP 130 -5.409 9.328 6.557 836 HA TRP 130 HA TRP 130 -7.309 9.107 4.350 837 HB3 TRP 130 2HB TRP 130 -5.446 9.692 2.965 838 HD1 TRP 130 HD TRP 130 -3.303 11.302 5.289 839 HE1 TRP 130 1HE TRP 130 -3.969 13.680 5.934 840 HE3 TRP 130 3HE TRP 130 -8.207 11.176 3.856 841 HZ2 TRP 130 2HZ TRP 130 -6.258 15.376 5.677 842 HZ3 TRP 130 3HZ TRP 130 -9.631 13.190 4.145 843 HH2 TRP 130 HH TRP 130 -8.670 15.295 5.038 844 H ALA 131 H ALA 131 -7.115 6.793 6.072 845 HA ALA 131 HA ALA 131 -6.976 4.785 3.968 846 HB1 ALA 131 1HB ALA 131 -5.308 4.481 6.500 847 HB2 ALA 131 2HB ALA 131 -5.429 3.342 5.154 848 HB3 ALA 131 3HB ALA 131 -4.649 4.908 4.907 849 H ASP 132 H ASP 132 -8.982 6.087 5.990 850 HA ASP 132 HA ASP 132 -9.166 4.089 8.098 851 HB3 ASP 132 2HB ASP 132 -11.160 6.295 7.727 852 H GLY 133 H GLY 133 -9.880 2.205 7.376 853 HA2 GLY 133 1HA GLY 133 -12.274 1.319 7.403 854 HA3 GLY 133 2HA GLY 133 -12.411 2.037 5.804 855 H LEU 134 H LEU 134 -9.479 1.147 5.201 856 HA LEU 134 HA LEU 134 -10.307 -1.535 4.256 857 HB3 LEU 134 2HB LEU 134 -7.712 -1.335 3.447 858 HG LEU 134 HG LEU 134 -8.440 -0.395 1.322 859 HD11 LEU 134 1HD1 LEU 134 -10.378 -2.514 2.325 860 HD12 LEU 134 2HD1 LEU 134 -8.727 -2.813 1.758 861 HD13 LEU 134 3HD1 LEU 134 -9.951 -2.206 0.646 862 HD21 LEU 134 3HD2 LEU 134 -11.205 -0.074 2.556 863 HD22 LEU 134 1HD2 LEU 134 -10.737 0.254 0.882 864 HD23 LEU 134 2HD2 LEU 134 -10.080 1.253 2.179 865 H ASN 135 H ASN 135 -9.535 -3.385 4.982 866 HA ASN 135 HA ASN 135 -8.666 -3.682 7.671 867 HB3 ASN 135 2HB ASN 135 -8.936 -5.595 5.332 868 HD21 ASN 135 1HD2 ASN 135 -7.634 -7.305 5.589 869 HD22 ASN 135 2HD2 ASN 135 -7.253 -8.178 7.073 870 H VAL 136 H VAL 136 -6.745 -2.525 7.889 871 HA VAL 136 HA VAL 136 -4.413 -3.440 6.385 872 HB VAL 136 HB VAL 136 -4.668 -1.097 6.302 873 HG11 VAL 136 1HG1 VAL 136 -6.112 -0.756 8.281 874 HG12 VAL 136 2HG1 VAL 136 -4.706 -1.077 9.333 875 HG13 VAL 136 3HG1 VAL 136 -4.730 0.351 8.279 876 HG21 VAL 136 3HG2 VAL 136 -2.543 -1.386 8.463 877 HG22 VAL 136 1HG2 VAL 136 -2.269 -1.916 6.806 878 HG23 VAL 136 2HG2 VAL 136 -2.621 -0.222 7.131 879 H ILE 137 H ILE 137 -2.958 -4.764 7.109 880 HA ILE 137 HA ILE 137 -3.231 -5.725 9.862 881 HB ILE 137 HB ILE 137 -1.535 -7.419 9.175 882 HG13 ILE 137 2HG1 ILE 137 -0.600 -5.848 7.334 883 HG21 ILE 137 1HG2 ILE 137 -4.096 -7.093 7.546 884 HG22 ILE 137 2HG2 ILE 137 -3.152 -8.589 7.659 885 HG23 ILE 137 3HG2 ILE 137 -3.887 -7.911 9.113 886 HD11 ILE 137 3HD1 ILE 137 0.150 -8.172 7.672 887 HD12 ILE 137 1HD1 ILE 137 -1.122 -8.721 6.554 888 HD13 ILE 137 2HD1 ILE 137 0.173 -7.663 5.973 889 H GLY 138 H GLY 138 -1.204 -3.307 8.361 890 HA2 GLY 138 1HA GLY 138 -0.220 -2.632 10.875 891 HA3 GLY 138 2HA GLY 138 1.060 -3.530 10.044 892 H VAL 139 H VAL 139 1.311 -0.945 10.796 893 HA VAL 139 HA VAL 139 1.607 0.557 8.269 894 HB VAL 139 HB VAL 139 0.491 1.864 10.783 895 HG11 VAL 139 1HG1 VAL 139 0.658 2.797 7.875 896 HG12 VAL 139 2HG1 VAL 139 0.074 3.747 9.257 897 HG13 VAL 139 3HG1 VAL 139 1.783 3.290 9.153 898 HG21 VAL 139 3HG2 VAL 139 -1.671 2.048 9.576 899 HG22 VAL 139 1HG2 VAL 139 -1.025 0.968 8.315 900 HG23 VAL 139 2HG2 VAL 139 -1.273 0.382 9.968 901 H ALA 140 H ALA 140 3.744 0.605 8.210 902 HA ALA 140 HA ALA 140 5.354 1.254 10.627 903 HB1 ALA 140 1HB ALA 140 6.841 -0.630 10.288 904 HB2 ALA 140 2HB ALA 140 5.196 -1.253 10.415 905 HB3 ALA 140 3HB ALA 140 5.979 -1.127 8.822 906 H ARG 141 H ARG 141 7.885 0.756 9.200 907 HA ARG 141 HA ARG 141 7.632 2.146 6.699 908 HB3 ARG 141 2HB ARG 141 8.195 3.996 8.234 909 HG3 ARG 141 2HG ARG 141 10.800 3.936 8.779 910 HD3 ARG 141 2HD ARG 141 8.940 2.668 10.796 911 HE ARG 141 HE ARG 141 11.601 3.367 10.939 912 HH11 ARG 141 1HH1 ARG 141 8.689 4.683 12.624 913 HH12 ARG 141 2HH1 ARG 141 9.669 5.294 13.934 914 HH21 ARG 141 1HH2 ARG 141 12.741 4.139 12.816 915 HH22 ARG 141 2HH2 ARG 141 11.897 5.191 13.921 916 H ASP 142 H ASP 142 9.703 1.902 5.500 917 HA ASP 142 HA ASP 142 11.144 0.585 4.477 918 HB3 ASP 142 2HB ASP 142 13.091 -0.118 5.745 919 H ASP 143 H ASP 143 12.394 -1.886 5.221 920 HA ASP 143 HA ASP 143 10.281 -3.805 4.655 921 HB3 ASP 143 2HB ASP 143 12.359 -3.794 3.345 922 H SER 144 H SER 144 10.953 -2.418 7.504 923 HA SER 144 HA SER 144 11.937 -4.115 9.287 924 HB3 SER 144 2HB SER 144 10.783 -2.837 10.883 925 HG SER 144 HG SER 144 10.510 -0.924 8.882 926 H GLU 145 H GLU 145 8.649 -4.444 7.863 927 HA GLU 145 HA GLU 145 8.066 -6.638 9.789 928 HB3 GLU 145 2HB GLU 145 5.730 -5.891 9.755 929 HG3 GLU 145 2HG GLU 145 7.098 -3.342 10.445 930 H VAL 146 H VAL 146 8.838 -6.413 6.526 931 HA VAL 146 HA VAL 146 6.640 -7.750 5.356 932 HB VAL 146 HB VAL 146 8.337 -6.715 4.033 933 HG11 VAL 146 1HG1 VAL 146 10.545 -7.572 3.667 934 HG12 VAL 146 2HG1 VAL 146 10.351 -7.323 5.398 935 HG13 VAL 146 3HG1 VAL 146 10.249 -8.968 4.733 936 HG21 VAL 146 3HG2 VAL 146 8.300 -9.712 3.484 937 HG22 VAL 146 1HG2 VAL 146 7.002 -8.582 3.063 938 HG23 VAL 146 2HG2 VAL 146 8.604 -8.446 2.311 939 H ASP 147 H ASP 147 9.115 -8.980 7.457 940 HA ASP 147 HA ASP 147 8.945 -11.791 7.044 941 HB3 ASP 147 2HB ASP 147 9.582 -9.964 9.361 942 H LYS 148 H LYS 148 6.720 -9.545 8.663 943 HA LYS 148 HA LYS 148 5.087 -11.816 9.616 944 HB3 LYS 148 2HB LYS 148 5.536 -10.596 11.467 945 HG3 LYS 148 2HG LYS 148 4.991 -7.964 10.090 946 HD3 LYS 148 2HD LYS 148 6.362 -7.153 12.129 947 HE3 LYS 148 2HE LYS 148 3.545 -8.168 12.686 948 HZ1 LYS 148 3HZ LYS 148 5.003 -5.749 13.579 949 HZ2 LYS 148 1HZ LYS 148 4.726 -7.106 14.528 950 HZ3 LYS 148 2HZ LYS 148 3.474 -6.185 14.026 951 H TRP 149 H TRP 149 5.006 -8.898 7.530 952 HA TRP 149 HA TRP 149 2.184 -9.126 7.126 953 HB3 TRP 149 2HB TRP 149 2.478 -7.350 5.500 954 HD1 TRP 149 HD TRP 149 2.476 -7.719 8.947 955 HE1 TRP 149 1HE TRP 149 2.569 -5.518 10.171 956 HE3 TRP 149 3HE TRP 149 4.236 -4.828 5.172 957 HZ2 TRP 149 2HZ TRP 149 3.271 -2.738 9.572 958 HZ3 TRP 149 3HZ TRP 149 4.429 -2.369 5.428 959 HH2 TRP 149 HH TRP 149 3.940 -1.313 7.618 960 H SER 150 H SER 150 3.789 -11.612 6.212 961 HA SER 150 HA SER 150 1.872 -11.987 4.150 962 HB3 SER 150 2HB SER 150 4.649 -12.614 3.141 963 HG SER 150 HG SER 150 2.192 -13.049 2.194 964 H LYS 151 H LYS 151 2.825 -13.105 6.816 965 HA LYS 151 HA LYS 151 3.632 -15.837 6.252 966 HB3 LYS 151 2HB LYS 151 2.926 -16.053 8.786 967 HG3 LYS 151 2HG LYS 151 5.290 -14.586 7.552 968 HD3 LYS 151 2HD LYS 151 5.152 -13.889 9.922 969 HE3 LYS 151 2HE LYS 151 5.491 -16.852 10.474 970 HZ1 LYS 151 3HZ LYS 151 5.527 -14.603 12.392 971 HZ2 LYS 151 1HZ LYS 151 6.887 -15.408 11.882 972 HZ3 LYS 151 2HZ LYS 151 5.696 -16.171 12.722 Start of MODEL 11 1 H1 GLY 1 H GLY 1 -10.095 -22.556 -2.416 2 HA2 GLY 1 1HA GLY 1 -8.442 -23.990 -3.460 3 HA3 GLY 1 2HA GLY 1 -8.927 -22.708 -4.587 4 H MET 2 H MET 2 -7.526 -20.779 -4.741 5 HA MET 2 HA MET 2 -4.869 -20.918 -3.479 6 HB3 MET 2 2HB MET 2 -3.942 -19.980 -5.659 7 HG3 MET 2 2HG MET 2 -3.514 -22.365 -4.858 8 HE1 MET 2 3HE MET 2 -3.991 -25.519 -7.266 9 HE2 MET 2 1HE MET 2 -3.068 -24.087 -7.770 10 HE3 MET 2 2HE MET 2 -2.909 -24.707 -6.114 11 H ALA 3 H ALA 3 -5.921 -19.429 -2.035 12 HA ALA 3 HA ALA 3 -6.625 -16.751 -3.163 13 HB1 ALA 3 1HB ALA 3 -8.680 -17.893 -2.421 14 HB2 ALA 3 2HB ALA 3 -7.936 -18.250 -0.845 15 HB3 ALA 3 3HB ALA 3 -8.273 -16.576 -1.322 16 H LYS 4 H LYS 4 -4.272 -16.591 -2.871 17 HA LYS 4 HA LYS 4 -3.470 -15.534 -0.297 18 HB3 LYS 4 2HB LYS 4 -3.384 -17.916 0.186 19 HG3 LYS 4 2HG LYS 4 -1.548 -19.298 -0.418 20 HD3 LYS 4 2HD LYS 4 -3.546 -19.182 -2.104 21 HE3 LYS 4 2HE LYS 4 -2.656 -17.319 -3.553 22 HZ1 LYS 4 3HZ LYS 4 -0.797 -17.996 -5.040 23 HZ2 LYS 4 1HZ LYS 4 -0.488 -19.243 -4.019 24 HZ3 LYS 4 2HZ LYS 4 -0.316 -17.712 -3.517 25 H LYS 5 H LYS 5 -3.444 -14.576 -3.039 26 HA LYS 5 HA LYS 5 -0.622 -14.380 -3.970 27 HB3 LYS 5 2HB LYS 5 -1.746 -12.257 -5.129 28 HG3 LYS 5 2HG LYS 5 -3.065 -13.660 -6.754 29 HD3 LYS 5 2HD LYS 5 -0.318 -14.869 -6.469 30 HE3 LYS 5 2HE LYS 5 -1.729 -15.329 -8.507 31 HZ1 LYS 5 3HZ LYS 5 -1.927 -13.672 -10.156 32 HZ2 LYS 5 1HZ LYS 5 -1.179 -12.508 -9.292 33 HZ3 LYS 5 2HZ LYS 5 -2.657 -13.075 -8.820 34 H THR 6 H THR 6 0.198 -11.991 -4.167 35 HA THR 6 HA THR 6 -0.380 -10.377 -1.800 36 HB THR 6 HB THR 6 2.410 -11.385 -2.316 37 HG1 THR 6 1HG THR 6 0.593 -12.079 -0.282 38 HG21 THR 6 3HG2 THR 6 1.269 -9.448 -0.285 39 HG22 THR 6 1HG2 THR 6 2.584 -9.169 -1.434 40 HG23 THR 6 2HG2 THR 6 2.831 -10.253 -0.051 41 H LEU 7 H LEU 7 -1.123 -8.675 -3.012 42 HA LEU 7 HA LEU 7 0.231 -8.032 -5.550 43 HB3 LEU 7 2HB LEU 7 -2.062 -6.731 -4.104 44 HG LEU 7 HG LEU 7 -1.103 -5.181 -5.767 45 HD11 LEU 7 1HD1 LEU 7 -1.405 -7.476 -7.739 46 HD12 LEU 7 2HD1 LEU 7 0.085 -6.584 -7.317 47 HD13 LEU 7 3HD1 LEU 7 -1.201 -5.779 -8.207 48 HD21 LEU 7 3HD2 LEU 7 -3.131 -4.861 -7.138 49 HD22 LEU 7 1HD2 LEU 7 -3.553 -5.278 -5.472 50 HD23 LEU 7 2HD2 LEU 7 -3.663 -6.509 -6.750 51 H ILE 8 H ILE 8 2.021 -6.825 -5.492 52 HA ILE 8 HA ILE 8 2.418 -4.915 -3.230 53 HB ILE 8 HB ILE 8 4.202 -5.907 -5.464 54 HG13 ILE 8 2HG1 ILE 8 3.510 -7.310 -3.234 55 HG21 ILE 8 1HG2 ILE 8 4.916 -4.004 -3.188 56 HG22 ILE 8 2HG2 ILE 8 6.031 -4.660 -4.416 57 HG23 ILE 8 3HG2 ILE 8 4.767 -3.555 -4.901 58 HD11 ILE 8 3HD1 ILE 8 6.308 -7.199 -4.405 59 HD12 ILE 8 1HD1 ILE 8 5.705 -8.428 -3.264 60 HD13 ILE 8 2HD1 ILE 8 4.972 -8.282 -4.861 61 H LEU 9 H LEU 9 1.882 -2.841 -3.465 62 HA LEU 9 HA LEU 9 1.719 -1.555 -6.161 63 HB3 LEU 9 2HB LEU 9 -0.186 -0.257 -5.267 64 HG LEU 9 HG LEU 9 -0.692 -3.240 -5.030 65 HD11 LEU 9 1HD1 LEU 9 -2.696 -0.978 -5.326 66 HD12 LEU 9 2HD1 LEU 9 -2.406 -1.954 -3.863 67 HD13 LEU 9 3HD1 LEU 9 -3.065 -2.718 -5.310 68 HD21 LEU 9 3HD2 LEU 9 0.078 -2.639 -7.259 69 HD22 LEU 9 1HD2 LEU 9 -1.107 -1.310 -7.354 70 HD23 LEU 9 2HD2 LEU 9 -1.640 -3.021 -7.329 71 H TYR 10 H TYR 10 3.942 -0.796 -5.659 72 HA TYR 10 HA TYR 10 4.034 1.170 -3.373 73 HB3 TYR 10 2HB TYR 10 6.465 1.109 -3.784 74 HD1 TYR 10 2HD TYR 10 3.913 -1.176 -2.422 75 HD2 TYR 10 1HD TYR 10 8.147 -0.212 -2.373 76 HE1 TYR 10 2HE TYR 10 4.176 -2.297 -0.294 77 HE2 TYR 10 1HE TYR 10 8.377 -1.363 -0.262 78 HH TYR 10 HH TYR 10 7.265 -2.469 1.493 79 H TYR 11 H TYR 11 4.162 3.315 -3.750 80 HA TYR 11 HA TYR 11 4.546 4.317 -6.467 81 HB3 TYR 11 2HB TYR 11 4.045 5.719 -3.853 82 HD1 TYR 11 1HD TYR 11 5.044 6.269 -7.463 83 HD2 TYR 11 2HD TYR 11 3.731 8.129 -3.775 84 HE1 TYR 11 1HE TYR 11 5.557 8.458 -8.392 85 HE2 TYR 11 2HE TYR 11 4.268 10.342 -4.741 86 HH TYR 11 HH TYR 11 5.513 10.865 -8.034 87 H SER 12 H SER 12 6.716 4.154 -7.110 88 HA SER 12 HA SER 12 8.962 4.520 -5.249 89 HB3 SER 12 2HB SER 12 9.274 3.087 -7.162 90 HG SER 12 HG SER 12 7.851 4.321 -8.690 91 H TRP 13 H TRP 13 8.975 6.536 -4.248 92 HA TRP 13 HA TRP 13 8.189 8.895 -5.672 93 HB3 TRP 13 2HB TRP 13 9.585 8.506 -3.068 94 HD1 TRP 13 HD TRP 13 10.254 10.622 -1.731 95 HE1 TRP 13 1HE TRP 13 10.247 13.141 -2.155 96 HE3 TRP 13 3HE TRP 13 7.520 10.781 -6.106 97 HZ2 TRP 13 2HZ TRP 13 9.507 14.930 -4.283 98 HZ3 TRP 13 3HZ TRP 13 7.246 12.890 -7.293 99 HH2 TRP 13 HH TRP 13 8.267 14.980 -6.420 100 H SER 14 H SER 14 11.307 8.963 -4.040 101 HA SER 14 HA SER 14 12.702 9.713 -6.497 102 HB3 SER 14 2HB SER 14 14.290 10.666 -5.062 103 HG SER 14 HG SER 14 12.041 11.566 -4.934 104 H GLY 15 H GLY 15 12.037 6.998 -6.469 105 HA2 GLY 15 1HA GLY 15 13.035 4.983 -7.038 106 HA3 GLY 15 2HA GLY 15 14.611 5.693 -6.709 107 H GLU 16 H GLU 16 13.342 6.380 -3.870 108 HA GLU 16 HA GLU 16 14.848 4.291 -2.646 109 HB3 GLU 16 2HB GLU 16 14.441 5.424 -0.590 110 HG3 GLU 16 2HG GLU 16 14.276 7.575 -2.744 111 H THR 17 H THR 17 11.341 5.062 -2.471 112 HA THR 17 HA THR 17 10.579 2.482 -1.505 113 HB THR 17 HB THR 17 8.984 4.611 -2.978 114 HG1 THR 17 1HG THR 17 9.663 5.534 -1.192 115 HG21 THR 17 3HG2 THR 17 8.068 2.256 -1.280 116 HG22 THR 17 1HG2 THR 17 7.620 2.658 -2.951 117 HG23 THR 17 2HG2 THR 17 7.054 3.680 -1.628 118 H LYS 18 H LYS 18 11.867 3.219 -4.607 119 HA LYS 18 HA LYS 18 10.436 1.035 -6.017 120 HB3 LYS 18 2HB LYS 18 13.205 2.023 -6.796 121 HG3 LYS 18 2HG LYS 18 10.921 1.457 -8.653 122 HD3 LYS 18 2HD LYS 18 13.302 2.387 -9.277 123 HE3 LYS 18 2HE LYS 18 13.895 -0.603 -9.369 124 HZ1 LYS 18 3HZ LYS 18 15.861 1.564 -9.228 125 HZ2 LYS 18 1HZ LYS 18 15.157 1.199 -10.684 126 HZ3 LYS 18 2HZ LYS 18 16.041 0.081 -9.888 127 H LYS 19 H LYS 19 13.576 1.724 -4.501 128 HA LYS 19 HA LYS 19 14.820 -0.684 -4.920 129 HB3 LYS 19 2HB LYS 19 15.575 0.505 -2.317 130 HG3 LYS 19 2HG LYS 19 17.485 1.373 -3.995 131 HD3 LYS 19 2HD LYS 19 17.054 -1.454 -2.977 132 HE3 LYS 19 2HE LYS 19 19.565 -1.645 -3.349 133 HZ1 LYS 19 3HZ LYS 19 19.363 -2.588 -5.440 134 HZ2 LYS 19 1HZ LYS 19 18.100 -1.634 -5.909 135 HZ3 LYS 19 2HZ LYS 19 17.892 -2.797 -4.773 136 H MET 20 H MET 20 12.858 0.147 -1.950 137 HA MET 20 HA MET 20 13.319 -2.438 -0.890 138 HB3 MET 20 2HB MET 20 10.736 -1.080 -0.185 139 HG3 MET 20 2HG MET 20 11.691 -2.841 1.169 140 HE1 MET 20 3HE MET 20 14.203 0.198 0.778 141 HE2 MET 20 1HE MET 20 13.853 0.162 2.544 142 HE3 MET 20 2HE MET 20 15.478 -0.245 1.945 143 H ALA 21 H ALA 21 11.140 -1.666 -3.488 144 HA ALA 21 HA ALA 21 9.124 -3.663 -2.798 145 HB1 ALA 21 1HB ALA 21 8.211 -3.181 -4.996 146 HB2 ALA 21 2HB ALA 21 8.630 -1.640 -4.225 147 HB3 ALA 21 3HB ALA 21 9.686 -2.319 -5.491 148 H GLU 22 H GLU 22 12.021 -3.401 -4.813 149 HA GLU 22 HA GLU 22 11.625 -5.780 -6.230 150 HB3 GLU 22 2HB GLU 22 13.984 -5.590 -6.909 151 HG3 GLU 22 2HG GLU 22 12.635 -2.858 -6.624 152 H LYS 23 H LYS 23 13.243 -5.168 -3.120 153 HA LYS 23 HA LYS 23 14.322 -7.890 -2.846 154 HB3 LYS 23 2HB LYS 23 14.064 -5.625 -0.862 155 HG3 LYS 23 2HG LYS 23 15.077 -8.526 -0.675 156 HD3 LYS 23 2HD LYS 23 15.699 -7.767 1.718 157 HE3 LYS 23 2HE LYS 23 18.016 -7.024 1.005 158 HZ1 LYS 23 3HZ LYS 23 18.516 -9.123 0.705 159 HZ2 LYS 23 1HZ LYS 23 17.626 -9.327 -0.630 160 HZ3 LYS 23 2HZ LYS 23 16.934 -9.496 0.864 161 H ILE 24 H ILE 24 11.520 -6.081 -1.379 162 HA ILE 24 HA ILE 24 10.705 -8.316 0.109 163 HB ILE 24 HB ILE 24 9.113 -5.924 -0.876 164 HG13 ILE 24 2HG1 ILE 24 11.088 -5.458 0.573 165 HG21 ILE 24 1HG2 ILE 24 7.575 -6.590 1.130 166 HG22 ILE 24 2HG2 ILE 24 7.474 -7.586 -0.320 167 HG23 ILE 24 3HG2 ILE 24 8.404 -8.158 1.084 168 HD11 ILE 24 3HD1 ILE 24 8.514 -4.872 2.064 169 HD12 ILE 24 1HD1 ILE 24 10.055 -4.017 2.160 170 HD13 ILE 24 2HD1 ILE 24 9.106 -3.948 0.656 171 H ASN 25 H ASN 25 9.793 -7.431 -3.266 172 HA ASN 25 HA ASN 25 7.932 -9.460 -3.754 173 HB3 ASN 25 2HB ASN 25 10.138 -8.409 -5.575 174 HD21 ASN 25 1HD2 ASN 25 6.771 -9.928 -5.607 175 HD22 ASN 25 2HD2 ASN 25 6.923 -10.432 -7.255 176 H SER 26 H SER 26 11.474 -9.741 -3.710 177 HA SER 26 HA SER 26 11.709 -12.391 -4.666 178 HB3 SER 26 2HB SER 26 13.589 -11.084 -2.666 179 HG SER 26 HG SER 26 14.468 -12.909 -3.329 180 H GLU 27 H GLU 27 11.131 -11.124 -1.376 181 HA GLU 27 HA GLU 27 11.751 -13.630 -0.065 182 HB3 GLU 27 2HB GLU 27 10.484 -11.986 1.817 183 HG3 GLU 27 2HG GLU 27 12.810 -11.074 2.252 184 H ILE 28 H ILE 28 9.063 -12.769 -1.765 185 HA ILE 28 HA ILE 28 7.130 -14.206 -0.009 186 HB ILE 28 HB ILE 28 6.757 -12.174 -2.249 187 HG13 ILE 28 2HG1 ILE 28 7.569 -11.387 0.121 188 HG21 ILE 28 1HG2 ILE 28 4.356 -12.165 -1.635 189 HG22 ILE 28 2HG2 ILE 28 4.827 -13.738 -2.224 190 HG23 ILE 28 3HG2 ILE 28 4.629 -13.465 -0.476 191 HD11 ILE 28 3HD1 ILE 28 6.097 -9.469 0.221 192 HD12 ILE 28 1HD1 ILE 28 6.587 -9.791 -1.457 193 HD13 ILE 28 2HD1 ILE 28 4.960 -10.214 -0.904 194 H LYS 29 H LYS 29 5.557 -15.576 -1.298 195 HA LYS 29 HA LYS 29 6.844 -17.374 -3.193 196 HB3 LYS 29 2HB LYS 29 3.860 -17.222 -2.992 197 HG3 LYS 29 2HG LYS 29 5.503 -19.619 -2.247 198 HD3 LYS 29 2HD LYS 29 2.934 -19.642 -2.561 199 HE3 LYS 29 2HE LYS 29 3.956 -19.279 -5.394 200 HZ1 LYS 29 3HZ LYS 29 1.409 -20.540 -4.703 201 HZ2 LYS 29 1HZ LYS 29 2.689 -21.266 -5.452 202 HZ3 LYS 29 2HZ LYS 29 1.879 -20.062 -6.230 203 H ASP 30 H ASP 30 4.798 -17.620 -5.089 204 HA ASP 30 HA ASP 30 5.425 -15.746 -7.113 205 HB3 ASP 30 2HB ASP 30 3.598 -18.137 -6.982 206 H SER 31 H SER 31 4.881 -14.225 -5.729 207 HA SER 31 HA SER 31 2.128 -13.108 -5.911 208 HB3 SER 31 2HB SER 31 3.467 -13.062 -3.755 209 HG SER 31 HG SER 31 5.437 -12.019 -4.724 210 H GLU 32 H GLU 32 2.772 -10.295 -6.128 211 HA GLU 32 HA GLU 32 3.605 -10.185 -8.940 212 HB3 GLU 32 2HB GLU 32 0.864 -9.145 -8.116 213 HG3 GLU 32 2HG GLU 32 2.061 -10.314 -10.645 214 H LEU 33 H LEU 33 3.777 -8.183 -9.610 215 HA LEU 33 HA LEU 33 4.281 -6.072 -7.546 216 HB3 LEU 33 2HB LEU 33 6.179 -7.126 -9.674 217 HG LEU 33 HG LEU 33 6.625 -4.718 -9.329 218 HD11 LEU 33 1HD1 LEU 33 5.741 -4.396 -7.072 219 HD12 LEU 33 2HD1 LEU 33 7.452 -3.987 -7.076 220 HD13 LEU 33 3HD1 LEU 33 6.935 -5.548 -6.409 221 HD21 LEU 33 3HD2 LEU 33 9.022 -5.020 -8.688 222 HD22 LEU 33 1HD2 LEU 33 8.471 -6.305 -9.765 223 HD23 LEU 33 2HD2 LEU 33 8.640 -6.620 -8.029 224 H LYS 34 H LYS 34 2.987 -4.432 -8.087 225 HA LYS 34 HA LYS 34 3.220 -3.469 -10.871 226 HB3 LYS 34 2HB LYS 34 1.074 -2.574 -10.954 227 HG3 LYS 34 2HG LYS 34 -0.652 -4.169 -10.222 228 HD3 LYS 34 2HD LYS 34 1.317 -6.109 -11.341 229 HE3 LYS 34 2HE LYS 34 -1.272 -5.048 -12.564 230 HZ1 LYS 34 3HZ LYS 34 0.034 -6.845 -13.719 231 HZ2 LYS 34 1HZ LYS 34 -1.486 -7.300 -13.361 232 HZ3 LYS 34 2HZ LYS 34 -0.287 -7.887 -12.454 233 H GLU 35 H GLU 35 2.805 -0.923 -10.680 234 HA GLU 35 HA GLU 35 3.784 0.145 -8.101 235 HB3 GLU 35 2HB GLU 35 5.790 -0.139 -9.525 236 HG3 GLU 35 2HG GLU 35 6.091 1.343 -11.505 237 H VAL 36 H VAL 36 3.311 2.435 -7.905 238 HA VAL 36 HA VAL 36 0.980 3.236 -9.594 239 HB VAL 36 HB VAL 36 1.354 3.926 -6.678 240 HG11 VAL 36 1HG1 VAL 36 -0.248 5.385 -7.733 241 HG12 VAL 36 2HG1 VAL 36 -0.963 4.056 -8.658 242 HG13 VAL 36 3HG1 VAL 36 -1.229 4.156 -6.916 243 HG21 VAL 36 3HG2 VAL 36 1.209 1.546 -6.592 244 HG22 VAL 36 1HG2 VAL 36 -0.401 2.135 -6.218 245 HG23 VAL 36 2HG2 VAL 36 -0.048 1.496 -7.844 246 H LYS 37 H LYS 37 0.692 5.623 -9.760 247 HA LYS 37 HA LYS 37 3.002 7.316 -9.248 248 HB3 LYS 37 2HB LYS 37 3.549 6.255 -11.352 249 HG3 LYS 37 2HG LYS 37 1.166 7.588 -12.640 250 HD3 LYS 37 2HD LYS 37 3.211 5.509 -13.473 251 HE3 LYS 37 2HE LYS 37 2.234 6.044 -15.840 252 HZ1 LYS 37 3HZ LYS 37 0.729 4.083 -14.244 253 HZ2 LYS 37 1HZ LYS 37 2.299 3.849 -14.734 254 HZ3 LYS 37 2HZ LYS 37 1.115 4.032 -15.836 255 H VAL 38 H VAL 38 2.439 9.530 -9.655 256 HA VAL 38 HA VAL 38 -0.465 10.162 -9.816 257 HB VAL 38 HB VAL 38 -0.093 12.123 -8.405 258 HG11 VAL 38 1HG1 VAL 38 0.753 9.566 -6.967 259 HG12 VAL 38 2HG1 VAL 38 0.021 11.008 -6.233 260 HG13 VAL 38 3HG1 VAL 38 -0.916 10.039 -7.372 261 HG21 VAL 38 3HG2 VAL 38 2.649 11.007 -7.699 262 HG22 VAL 38 1HG2 VAL 38 2.395 12.399 -8.763 263 HG23 VAL 38 2HG2 VAL 38 1.900 12.501 -7.086 264 H SER 39 H SER 39 -0.542 12.734 -10.565 265 HA SER 39 HA SER 39 0.807 12.845 -13.088 266 HB3 SER 39 2HB SER 39 -0.451 15.244 -12.443 267 HG SER 39 HG SER 39 -2.123 14.377 -13.765 268 H GLU 40 H GLU 40 1.621 15.376 -13.410 269 HA GLU 40 HA GLU 40 4.084 15.105 -11.799 270 HB3 GLU 40 2HB GLU 40 4.301 14.301 -14.016 271 HG3 GLU 40 2HG GLU 40 3.992 17.125 -15.053 272 H GLY 41 H GLY 41 5.041 16.713 -10.906 273 HA2 GLY 41 1HA GLY 41 5.292 18.771 -9.882 274 HA3 GLY 41 2HA GLY 41 4.288 19.512 -11.146 275 H THR 42 H THR 42 3.015 16.735 -9.299 276 HA THR 42 HA THR 42 0.739 18.188 -8.419 277 HB THR 42 HB THR 42 1.953 15.561 -7.450 278 HG1 THR 42 1HG THR 42 1.419 15.149 -9.467 279 HG21 THR 42 3HG2 THR 42 -0.924 16.549 -7.204 280 HG22 THR 42 1HG2 THR 42 0.222 16.399 -5.864 281 HG23 THR 42 2HG2 THR 42 -0.290 14.953 -6.739 282 H PHE 43 H PHE 43 3.816 17.382 -6.799 283 HA PHE 43 HA PHE 43 3.211 19.467 -4.762 284 HB3 PHE 43 2HB PHE 43 4.838 18.045 -3.290 285 HD1 PHE 43 1HD PHE 43 2.039 15.893 -4.416 286 HD2 PHE 43 2HD PHE 43 3.251 19.093 -1.787 287 HE1 PHE 43 1HE PHE 43 -0.085 15.666 -3.150 288 HE2 PHE 43 2HE PHE 43 1.133 18.854 -0.533 289 HZ PHE 43 HZ PHE 43 -0.539 17.135 -1.207 290 H ASP 44 H ASP 44 5.974 19.414 -3.734 291 HA ASP 44 HA ASP 44 7.639 20.241 -5.902 292 HB3 ASP 44 2HB ASP 44 6.826 22.369 -3.870 293 H ALA 45 H ALA 45 9.727 21.313 -4.561 294 HA ALA 45 HA ALA 45 10.348 19.334 -2.424 295 HB1 ALA 45 1HB ALA 45 11.792 19.198 -4.398 296 HB2 ALA 45 2HB ALA 45 12.157 20.940 -4.272 297 HB3 ALA 45 3HB ALA 45 12.711 19.808 -3.027 298 H ASP 46 H ASP 46 8.973 22.177 -2.324 299 HA ASP 46 HA ASP 46 10.836 23.848 -0.960 300 HB3 ASP 46 2HB ASP 46 7.839 24.075 -1.020 301 H MET 47 H MET 47 9.457 24.963 1.124 302 HA MET 47 HA MET 47 9.036 22.860 3.184 303 HB3 MET 47 2HB MET 47 11.296 23.576 3.391 304 HG3 MET 47 2HG MET 47 10.235 26.349 3.022 305 HE1 MET 47 3HE MET 47 10.102 26.340 5.949 306 HE2 MET 47 1HE MET 47 11.169 27.664 6.466 307 HE3 MET 47 2HE MET 47 10.134 27.873 5.043 308 H TYR 48 H TYR 48 8.144 26.020 1.864 309 HA TYR 48 HA TYR 48 5.973 26.193 3.889 310 HB3 TYR 48 2HB TYR 48 7.130 28.196 3.979 311 HD1 TYR 48 2HD TYR 48 5.995 28.879 0.473 312 HD2 TYR 48 1HD TYR 48 9.340 28.461 3.162 313 HE1 TYR 48 2HE TYR 48 7.562 29.378 -1.383 314 HE2 TYR 48 1HE TYR 48 10.902 28.911 1.332 315 HH TYR 48 HH TYR 48 10.222 28.208 -1.471 316 H LYS 49 H LYS 49 6.720 26.248 0.335 317 HA LYS 49 HA LYS 49 4.004 26.583 -0.495 318 HB3 LYS 49 2HB LYS 49 6.260 25.136 -1.927 319 HG3 LYS 49 2HG LYS 49 4.043 24.787 -2.999 320 HD3 LYS 49 2HD LYS 49 4.182 27.818 -3.211 321 HE3 LYS 49 2HE LYS 49 2.641 25.865 -4.978 322 HZ1 LYS 49 3HZ LYS 49 2.626 28.817 -4.901 323 HZ2 LYS 49 1HZ LYS 49 1.375 27.844 -4.519 324 HZ3 LYS 49 2HZ LYS 49 1.900 27.916 -6.069 325 H THR 50 H THR 50 5.933 23.599 -0.060 326 HA THR 50 HA THR 50 3.934 21.740 -0.776 327 HB THR 50 HB THR 50 5.487 20.225 0.497 328 HG1 THR 50 1HG THR 50 7.561 21.449 1.055 329 HG21 THR 50 3HG2 THR 50 6.703 22.155 -1.530 330 HG22 THR 50 1HG2 THR 50 5.905 20.604 -1.831 331 HG23 THR 50 2HG2 THR 50 7.458 20.662 -0.965 332 H SER 51 H SER 51 4.706 23.297 2.298 333 HA SER 51 HA SER 51 3.175 21.600 3.998 334 HB3 SER 51 2HB SER 51 3.530 24.546 4.574 335 HG SER 51 HG SER 51 4.703 22.946 6.327 336 H ASP 52 H ASP 52 2.492 24.647 2.254 337 HA ASP 52 HA ASP 52 -0.200 24.902 3.108 338 HB3 ASP 52 2HB ASP 52 0.905 26.094 0.541 339 H ILE 53 H ILE 53 1.194 23.518 0.088 340 HA ILE 53 HA ILE 53 -1.318 22.916 -1.073 341 HB ILE 53 HB ILE 53 1.295 21.324 -1.361 342 HG13 ILE 53 2HG1 ILE 53 1.244 23.868 -2.118 343 HG21 ILE 53 1HG2 ILE 53 0.253 20.562 -3.574 344 HG22 ILE 53 2HG2 ILE 53 -0.661 20.016 -2.175 345 HG23 ILE 53 3HG2 ILE 53 -1.240 21.399 -3.095 346 HD11 ILE 53 3HD1 ILE 53 2.659 23.374 -4.070 347 HD12 ILE 53 1HD1 ILE 53 3.086 22.311 -2.712 348 HD13 ILE 53 2HD1 ILE 53 2.126 21.684 -4.070 349 H ALA 54 H ALA 54 0.719 20.860 1.124 350 HA ALA 54 HA ALA 54 -1.117 18.655 0.996 351 HB1 ALA 54 1HB ALA 54 1.230 18.492 1.839 352 HB2 ALA 54 2HB ALA 54 0.750 19.379 3.302 353 HB3 ALA 54 3HB ALA 54 0.032 17.789 2.941 354 H LEU 55 H LEU 55 -0.997 21.559 3.013 355 HA LEU 55 HA LEU 55 -3.069 20.856 4.845 356 HB3 LEU 55 2HB LEU 55 -2.092 23.584 3.882 357 HG LEU 55 HG LEU 55 -2.601 24.329 6.166 358 HD11 LEU 55 1HD1 LEU 55 -4.611 25.228 5.536 359 HD12 LEU 55 2HD1 LEU 55 -5.207 23.714 4.774 360 HD13 LEU 55 3HD1 LEU 55 -3.991 24.721 3.992 361 HD21 LEU 55 3HD2 LEU 55 -4.063 23.162 7.627 362 HD22 LEU 55 1HD2 LEU 55 -2.864 21.995 7.097 363 HD23 LEU 55 2HD2 LEU 55 -4.482 21.957 6.376 364 H ASP 56 H ASP 56 -3.096 22.545 1.663 365 HA ASP 56 HA ASP 56 -5.781 23.208 1.641 366 HB3 ASP 56 2HB ASP 56 -3.859 23.950 0.098 367 H GLN 57 H GLN 57 -4.244 20.163 0.740 368 HA GLN 57 HA GLN 57 -6.732 18.949 -0.182 369 HB3 GLN 57 2HB GLN 57 -5.399 16.935 -0.467 370 HG3 GLN 57 2HG GLN 57 -3.675 19.252 -1.380 371 HE21 GLN 57 1HE2 GLN 57 -4.907 18.045 -4.120 372 HE22 GLN 57 2HE2 GLN 57 -3.705 16.815 -4.413 373 H ILE 58 H ILE 58 -5.768 19.722 2.910 374 HA ILE 58 HA ILE 58 -7.045 17.320 4.149 375 HB ILE 58 HB ILE 58 -5.057 19.339 5.202 376 HG13 ILE 58 2HG1 ILE 58 -4.379 17.191 3.908 377 HG21 ILE 58 1HG2 ILE 58 -5.297 18.077 7.426 378 HG22 ILE 58 2HG2 ILE 58 -6.542 19.244 7.015 379 HG23 ILE 58 3HG2 ILE 58 -6.863 17.536 6.791 380 HD11 ILE 58 3HD1 ILE 58 -2.818 18.536 5.393 381 HD12 ILE 58 1HD1 ILE 58 -3.246 17.435 6.708 382 HD13 ILE 58 2HD1 ILE 58 -2.429 16.816 5.265 383 H GLN 59 H GLN 59 -6.914 20.927 4.556 384 HA GLN 59 HA GLN 59 -9.201 20.800 6.297 385 HB3 GLN 59 2HB GLN 59 -8.880 23.418 6.157 386 HG3 GLN 59 2HG GLN 59 -6.621 21.753 7.283 387 HE21 GLN 59 1HE2 GLN 59 -5.885 24.132 6.460 388 HE22 GLN 59 2HE2 GLN 59 -5.737 25.283 7.749 389 H GLY 60 H GLY 60 -9.643 20.123 3.345 390 HA2 GLY 60 1HA GLY 60 -11.644 19.986 2.252 391 HA3 GLY 60 2HA GLY 60 -12.326 21.213 3.316 392 H ASN 61 H ASN 61 -9.558 22.569 2.226 393 HA ASN 61 HA ASN 61 -10.735 24.588 0.726 394 HB3 ASN 61 2HB ASN 61 -8.608 25.443 0.376 395 HD21 ASN 61 1HD2 ASN 61 -7.386 26.380 2.063 396 HD22 ASN 61 2HD2 ASN 61 -6.952 25.495 3.506 397 H LYS 62 H LYS 62 -8.801 21.785 -0.404 398 HA LYS 62 HA LYS 62 -9.700 22.290 -3.181 399 HB3 LYS 62 2HB LYS 62 -6.977 21.397 -3.166 400 HG3 LYS 62 2HG LYS 62 -6.476 23.852 -3.665 401 HD3 LYS 62 2HD LYS 62 -7.865 23.991 -5.773 402 HE3 LYS 62 2HE LYS 62 -6.451 21.339 -5.272 403 HZ1 LYS 62 3HZ LYS 62 -6.961 22.794 -7.782 404 HZ2 LYS 62 1HZ LYS 62 -7.587 21.314 -7.331 405 HZ3 LYS 62 2HZ LYS 62 -5.968 21.507 -7.631 406 H ASP 63 H ASP 63 -9.325 20.566 -4.647 407 HA ASP 63 HA ASP 63 -10.260 18.008 -3.819 408 HB3 ASP 63 2HB ASP 63 -10.807 18.844 -5.995 409 H PHE 64 H PHE 64 -8.975 16.004 -4.807 410 HA PHE 64 HA PHE 64 -6.402 15.945 -3.325 411 HB3 PHE 64 2HB PHE 64 -8.084 14.602 -2.345 412 HD1 PHE 64 2HD PHE 64 -7.628 12.889 -5.723 413 HD2 PHE 64 1HD PHE 64 -10.249 13.825 -2.406 414 HE1 PHE 64 2HE PHE 64 -9.437 11.626 -6.797 415 HE2 PHE 64 1HE PHE 64 -12.023 12.488 -3.475 416 HZ PHE 64 HZ PHE 64 -11.643 11.432 -5.684 417 HA PRO 65 HA PRO 65 -4.516 14.884 -7.161 418 HB3 PRO 65 2HB PRO 65 -2.550 15.174 -5.929 419 HG3 PRO 65 2HG PRO 65 -2.177 14.038 -3.912 420 HD3 PRO 65 2HD PRO 65 -4.266 14.900 -3.302 421 H GLU 66 H GLU 66 -4.811 13.534 -8.733 422 HA GLU 66 HA GLU 66 -6.144 10.965 -8.364 423 HB3 GLU 66 2HB GLU 66 -5.973 11.069 -10.926 424 HG3 GLU 66 2HG GLU 66 -7.253 13.544 -10.728 425 H ILE 67 H ILE 67 -5.302 9.153 -9.752 426 HA ILE 67 HA ILE 67 -2.349 8.919 -9.735 427 HB ILE 67 HB ILE 67 -2.575 6.511 -9.371 428 HG13 ILE 67 2HG1 ILE 67 -4.814 6.109 -10.255 429 HG21 ILE 67 1HG2 ILE 67 -2.968 6.594 -6.972 430 HG22 ILE 67 2HG2 ILE 67 -2.182 8.086 -7.481 431 HG23 ILE 67 3HG2 ILE 67 -3.923 8.083 -7.131 432 HD11 ILE 67 3HD1 ILE 67 -3.871 4.575 -8.407 433 HD12 ILE 67 1HD1 ILE 67 -5.015 5.393 -7.318 434 HD13 ILE 67 2HD1 ILE 67 -5.612 4.505 -8.729 435 H GLN 68 H GLN 68 -1.687 7.274 -11.506 436 HA GLN 68 HA GLN 68 -3.529 7.345 -13.850 437 HB3 GLN 68 2HB GLN 68 -1.608 7.680 -15.240 438 HG3 GLN 68 2HG GLN 68 -1.423 9.694 -12.972 439 HE21 GLN 68 1HE2 GLN 68 -1.001 12.002 -14.434 440 HE22 GLN 68 2HE2 GLN 68 0.494 11.860 -15.328 441 H LEU 69 H LEU 69 -3.691 5.336 -12.095 442 HA LEU 69 HA LEU 69 -1.843 3.123 -12.814 443 HB3 LEU 69 2HB LEU 69 -4.203 2.509 -11.104 444 HG LEU 69 HG LEU 69 -1.221 2.406 -10.458 445 HD11 LEU 69 1HD1 LEU 69 -3.699 1.233 -9.119 446 HD12 LEU 69 2HD1 LEU 69 -2.667 2.517 -8.491 447 HD13 LEU 69 3HD1 LEU 69 -2.034 0.876 -8.637 448 HD21 LEU 69 3HD2 LEU 69 -1.387 -0.055 -10.763 449 HD22 LEU 69 1HD2 LEU 69 -1.573 0.823 -12.269 450 HD23 LEU 69 2HD2 LEU 69 -3.020 0.158 -11.457 451 H ASP 70 H ASP 70 -3.017 0.947 -13.317 452 HA ASP 70 HA ASP 70 -5.131 1.375 -15.312 453 HB3 ASP 70 2HB ASP 70 -4.548 -1.435 -14.846 454 H ASN 71 H ASN 71 -6.959 -0.274 -15.252 455 HA ASN 71 HA ASN 71 -8.120 -0.308 -12.498 456 HB3 ASN 71 2HB ASN 71 -9.456 -1.249 -15.038 457 HD21 ASN 71 1HD2 ASN 71 -10.806 0.703 -12.360 458 HD22 ASN 71 2HD2 ASN 71 -11.719 -0.613 -11.664 459 H ILE 72 H ILE 72 -7.912 -2.005 -11.334 460 HA ILE 72 HA ILE 72 -7.206 -4.675 -12.432 461 HB ILE 72 HB ILE 72 -5.653 -3.049 -10.393 462 HG13 ILE 72 2HG1 ILE 72 -5.160 -2.778 -12.872 463 HG21 ILE 72 1HG2 ILE 72 -4.317 -5.037 -9.895 464 HG22 ILE 72 2HG2 ILE 72 -5.995 -5.406 -9.554 465 HG23 ILE 72 3HG2 ILE 72 -5.254 -6.009 -11.042 466 HD11 ILE 72 3HD1 ILE 72 -2.765 -3.217 -12.899 467 HD12 ILE 72 1HD1 ILE 72 -3.284 -2.345 -11.453 468 HD13 ILE 72 2HD1 ILE 72 -2.896 -4.088 -11.357 469 H ASP 73 H ASP 73 -8.252 -6.243 -11.478 470 HA ASP 73 HA ASP 73 -10.305 -5.653 -9.495 471 HB3 ASP 73 2HB ASP 73 -10.448 -8.327 -9.661 472 H TYR 74 H TYR 74 -9.432 -5.185 -7.559 473 HA TYR 74 HA TYR 74 -7.162 -6.601 -6.475 474 HB3 TYR 74 2HB TYR 74 -7.523 -5.214 -4.552 475 HD1 TYR 74 1HD TYR 74 -5.753 -4.930 -6.778 476 HD2 TYR 74 2HD TYR 74 -9.100 -2.451 -5.692 477 HE1 TYR 74 1HE TYR 74 -4.714 -3.053 -7.918 478 HE2 TYR 74 2HE TYR 74 -8.028 -0.491 -6.773 479 HH TYR 74 HH TYR 74 -4.842 -0.814 -8.439 480 H ASN 75 H ASN 75 -10.535 -7.381 -6.566 481 HA ASN 75 HA ASN 75 -10.732 -8.485 -3.932 482 HB3 ASN 75 2HB ASN 75 -12.426 -9.731 -6.056 483 HD21 ASN 75 1HD2 ASN 75 -13.234 -7.116 -3.772 484 HD22 ASN 75 2HD2 ASN 75 -14.042 -8.115 -2.589 485 H ASN 76 H ASN 76 -8.910 -9.610 -6.537 486 HA ASN 76 HA ASN 76 -9.142 -12.482 -5.966 487 HB3 ASN 76 2HB ASN 76 -7.511 -12.692 -7.795 488 HD21 ASN 76 1HD2 ASN 76 -8.006 -10.701 -10.025 489 HD22 ASN 76 2HD2 ASN 76 -9.728 -10.761 -10.367 490 H TYR 77 H TYR 77 -7.672 -10.054 -4.232 491 HA TYR 77 HA TYR 77 -5.054 -11.417 -3.976 492 HB3 TYR 77 2HB TYR 77 -4.263 -9.015 -3.668 493 HD1 TYR 77 2HD TYR 77 -2.750 -10.312 -5.173 494 HD2 TYR 77 1HD TYR 77 -6.455 -8.667 -6.588 495 HE1 TYR 77 2HE TYR 77 -1.907 -10.469 -7.496 496 HE2 TYR 77 1HE TYR 77 -5.648 -8.845 -8.917 497 HH TYR 77 HH TYR 77 -2.362 -10.083 -9.785 498 H ASP 78 H ASP 78 -4.835 -12.291 -2.139 499 HA ASP 78 HA ASP 78 -6.485 -12.019 0.205 500 HB3 ASP 78 2HB ASP 78 -3.748 -13.314 -0.272 501 H LEU 79 H LEU 79 -3.418 -10.602 -0.723 502 HA LEU 79 HA LEU 79 -3.205 -9.076 1.815 503 HB3 LEU 79 2HB LEU 79 -1.120 -10.949 0.670 504 HG LEU 79 HG LEU 79 -0.073 -8.794 1.409 505 HD11 LEU 79 1HD1 LEU 79 -1.189 -9.544 4.145 506 HD12 LEU 79 2HD1 LEU 79 -1.634 -8.105 3.196 507 HD13 LEU 79 3HD1 LEU 79 -0.005 -8.272 3.837 508 HD21 LEU 79 3HD2 LEU 79 0.540 -11.097 3.258 509 HD22 LEU 79 1HD2 LEU 79 1.647 -9.836 2.691 510 HD23 LEU 79 2HD2 LEU 79 1.042 -11.058 1.568 511 H ILE 80 H ILE 80 -2.535 -6.958 1.367 512 HA ILE 80 HA ILE 80 -1.277 -6.457 -1.274 513 HB ILE 80 HB ILE 80 -3.764 -5.025 -0.289 514 HG13 ILE 80 2HG1 ILE 80 -4.346 -7.242 -1.088 515 HG21 ILE 80 1HG2 ILE 80 -2.176 -4.690 -2.878 516 HG22 ILE 80 2HG2 ILE 80 -3.638 -3.797 -2.416 517 HG23 ILE 80 3HG2 ILE 80 -2.151 -3.557 -1.515 518 HD11 ILE 80 3HD1 ILE 80 -5.969 -6.762 -2.660 519 HD12 ILE 80 1HD1 ILE 80 -5.726 -5.252 -1.763 520 HD13 ILE 80 2HD1 ILE 80 -5.018 -5.458 -3.390 521 H LEU 81 H LEU 81 0.573 -5.433 -0.915 522 HA LEU 81 HA LEU 81 0.914 -3.781 1.536 523 HB3 LEU 81 2HB LEU 81 3.375 -4.023 0.736 524 HG LEU 81 HG LEU 81 2.404 -5.028 2.775 525 HD11 LEU 81 1HD1 LEU 81 0.813 -6.630 1.944 526 HD12 LEU 81 2HD1 LEU 81 2.056 -7.493 2.837 527 HD13 LEU 81 3HD1 LEU 81 2.088 -7.510 1.058 528 HD21 LEU 81 3HD2 LEU 81 4.252 -6.631 3.130 529 HD22 LEU 81 1HD2 LEU 81 4.821 -5.188 2.282 530 HD23 LEU 81 2HD2 LEU 81 4.532 -6.713 1.386 531 H ILE 82 H ILE 82 1.264 -1.639 1.282 532 HA ILE 82 HA ILE 82 1.605 -0.637 -1.483 533 HB ILE 82 HB ILE 82 -0.049 0.602 0.743 534 HG13 ILE 82 2HG1 ILE 82 -0.781 -1.295 -1.469 535 HG21 ILE 82 1HG2 ILE 82 0.856 2.326 -0.725 536 HG22 ILE 82 2HG2 ILE 82 0.305 1.448 -2.160 537 HG23 ILE 82 3HG2 ILE 82 -0.873 2.129 -1.019 538 HD11 ILE 82 3HD1 ILE 82 -2.244 -0.437 1.076 539 HD12 ILE 82 1HD1 ILE 82 -2.642 -1.826 0.048 540 HD13 ILE 82 2HD1 ILE 82 -1.143 -1.827 0.978 541 H GLY 83 H GLY 83 2.827 1.315 -1.760 542 HA2 GLY 83 1HA GLY 83 4.467 2.168 0.582 543 HA3 GLY 83 2HA GLY 83 5.220 1.793 -0.962 544 H SER 84 H SER 84 5.004 4.440 0.611 545 HA SER 84 HA SER 84 4.666 6.100 -1.739 546 HB3 SER 84 2HB SER 84 2.433 6.164 -1.323 547 HG SER 84 HG SER 84 2.454 5.234 0.899 548 HA PRO 85 HA PRO 85 7.670 8.385 0.639 549 HB3 PRO 85 2HB PRO 85 7.995 9.412 -1.416 550 HG3 PRO 85 2HG PRO 85 6.264 10.380 -2.700 551 HD3 PRO 85 2HD PRO 85 5.845 8.073 -2.431 552 H VAL 86 H VAL 86 8.085 10.286 2.119 553 HA VAL 86 HA VAL 86 5.635 11.283 3.502 554 HB VAL 86 HB VAL 86 8.294 10.465 4.716 555 HG11 VAL 86 1HG1 VAL 86 7.553 12.350 5.986 556 HG12 VAL 86 2HG1 VAL 86 5.867 11.842 5.910 557 HG13 VAL 86 3HG1 VAL 86 7.038 10.937 6.919 558 HG21 VAL 86 3HG2 VAL 86 7.001 8.780 5.895 559 HG22 VAL 86 1HG2 VAL 86 5.485 9.359 5.155 560 HG23 VAL 86 2HG2 VAL 86 6.754 8.620 4.146 561 H TRP 87 H TRP 87 5.356 13.410 3.202 562 HA TRP 87 HA TRP 87 7.595 15.233 2.719 563 HB3 TRP 87 2HB TRP 87 5.080 16.566 2.957 564 HD1 TRP 87 HD TRP 87 6.636 18.415 1.613 565 HE1 TRP 87 1HE TRP 87 7.420 18.556 -0.891 566 HE3 TRP 87 3HE TRP 87 5.472 13.686 0.072 567 HZ2 TRP 87 2HZ TRP 87 7.301 16.944 -3.213 568 HZ3 TRP 87 3HZ TRP 87 5.651 13.068 -2.317 569 HH2 TRP 87 HH TRP 87 6.570 14.685 -3.966 570 H SER 88 H SER 88 6.635 17.498 3.949 571 HA SER 88 HA SER 88 7.583 17.400 6.591 572 HB3 SER 88 2HB SER 88 6.948 19.744 6.566 573 HG SER 88 HG SER 88 8.173 20.339 4.907 574 H GLY 89 H GLY 89 6.242 15.685 7.379 575 HA2 GLY 89 1HA GLY 89 4.976 15.425 9.384 576 HA3 GLY 89 2HA GLY 89 3.861 16.669 8.920 577 H TYR 90 H TYR 90 3.621 15.576 5.990 578 HA TYR 90 HA TYR 90 2.072 13.139 6.686 579 HB3 TYR 90 2HB TYR 90 0.084 14.171 5.846 580 HD1 TYR 90 2HD TYR 90 0.011 14.329 8.465 581 HD2 TYR 90 1HD TYR 90 1.425 17.556 5.987 582 HE1 TYR 90 2HE TYR 90 -0.205 15.876 10.382 583 HE2 TYR 90 1HE TYR 90 1.265 19.079 7.904 584 HH TYR 90 HH TYR 90 0.490 19.352 10.087 585 HA PRO 91 HA PRO 91 3.443 11.869 2.557 586 HB3 PRO 91 2HB PRO 91 2.368 9.890 2.361 587 HG3 PRO 91 2HG PRO 91 1.222 9.402 4.211 588 HD3 PRO 91 2HD PRO 91 1.806 11.019 5.641 589 H ALA 92 H ALA 92 3.056 12.398 0.328 590 HA ALA 92 HA ALA 92 1.436 14.775 -0.316 591 HB1 ALA 92 1HB ALA 92 2.356 14.083 -2.660 592 HB2 ALA 92 2HB ALA 92 3.411 14.872 -1.488 593 HB3 ALA 92 3HB ALA 92 3.479 13.106 -1.728 594 H THR 93 H THR 93 -0.143 13.075 0.736 595 HA THR 93 HA THR 93 -2.030 11.664 0.524 596 HB THR 93 HB THR 93 -3.517 13.248 -0.894 597 HG1 THR 93 1HG THR 93 -2.400 15.186 -1.562 598 HG21 THR 93 3HG2 THR 93 -1.679 14.577 1.198 599 HG22 THR 93 1HG2 THR 93 -3.124 13.597 1.555 600 HG23 THR 93 2HG2 THR 93 -3.286 15.118 0.680 601 HA PRO 94 HA PRO 94 -1.454 9.856 -3.756 602 HB3 PRO 94 2HB PRO 94 0.916 9.920 -3.472 603 HG3 PRO 94 2HG PRO 94 1.910 8.916 -1.577 604 HD3 PRO 94 2HD PRO 94 0.648 10.468 -0.564 605 H ILE 95 H ILE 95 -2.044 8.159 -0.822 606 HA ILE 95 HA ILE 95 -3.117 5.791 -2.253 607 HB ILE 95 HB ILE 95 -2.528 5.978 0.689 608 HG13 ILE 95 2HG1 ILE 95 -0.462 4.600 0.381 609 HG21 ILE 95 1HG2 ILE 95 -2.434 3.491 0.594 610 HG22 ILE 95 2HG2 ILE 95 -3.992 4.113 0.088 611 HG23 ILE 95 3HG2 ILE 95 -2.839 3.564 -1.135 612 HD11 ILE 95 3HD1 ILE 95 0.819 4.600 -1.607 613 HD12 ILE 95 1HD1 ILE 95 -0.797 4.155 -2.184 614 HD13 ILE 95 2HD1 ILE 95 -0.190 5.803 -2.380 615 H LYS 96 H LYS 96 -4.212 8.689 -1.891 616 HA LYS 96 HA LYS 96 -6.427 8.252 0.019 617 HB3 LYS 96 2HB LYS 96 -5.556 10.622 -1.680 618 HG3 LYS 96 2HG LYS 96 -7.987 10.818 -1.431 619 HD3 LYS 96 2HD LYS 96 -7.422 9.960 1.388 620 HE3 LYS 96 2HE LYS 96 -8.016 12.187 2.011 621 HZ1 LYS 96 3HZ LYS 96 -10.221 11.993 0.060 622 HZ2 LYS 96 1HZ LYS 96 -8.962 13.101 0.073 623 HZ3 LYS 96 2HZ LYS 96 -10.146 13.135 1.207 624 H THR 97 H THR 97 -6.127 9.242 -3.461 625 HA THR 97 HA THR 97 -8.691 8.412 -4.170 626 HB THR 97 HB THR 97 -6.209 8.545 -5.926 627 HG1 THR 97 1HG THR 97 -6.416 10.720 -5.818 628 HG21 THR 97 3HG2 THR 97 -9.157 9.120 -6.464 629 HG22 THR 97 1HG2 THR 97 -8.230 7.752 -7.103 630 HG23 THR 97 2HG2 THR 97 -7.836 9.407 -7.621 631 H LEU 98 H LEU 98 -5.638 6.534 -4.214 632 HA LEU 98 HA LEU 98 -6.696 4.214 -5.504 633 HB3 LEU 98 2HB LEU 98 -4.546 4.394 -3.331 634 HG LEU 98 HG LEU 98 -5.211 2.032 -3.895 635 HD11 LEU 98 1HD1 LEU 98 -4.173 2.760 -6.673 636 HD12 LEU 98 2HD1 LEU 98 -5.836 2.293 -6.276 637 HD13 LEU 98 3HD1 LEU 98 -4.541 1.118 -6.106 638 HD21 LEU 98 3HD2 LEU 98 -2.951 2.536 -3.118 639 HD22 LEU 98 1HD2 LEU 98 -2.426 2.904 -4.773 640 HD23 LEU 98 2HD2 LEU 98 -2.906 1.253 -4.322 641 H LEU 99 H LEU 99 -6.903 5.181 -1.958 642 HA LEU 99 HA LEU 99 -7.642 2.601 -1.086 643 HB3 LEU 99 2HB LEU 99 -6.782 4.645 0.182 644 HG LEU 99 HG LEU 99 -9.335 5.708 -0.170 645 HD11 LEU 99 1HD1 LEU 99 -9.274 4.153 2.442 646 HD12 LEU 99 2HD1 LEU 99 -10.159 3.660 0.989 647 HD13 LEU 99 3HD1 LEU 99 -10.621 5.160 1.823 648 HD21 LEU 99 3HD2 LEU 99 -8.611 7.380 1.033 649 HD22 LEU 99 1HD2 LEU 99 -7.111 6.485 1.295 650 HD23 LEU 99 2HD2 LEU 99 -8.412 6.405 2.485 651 H ASP 100 H ASP 100 -9.529 5.339 -2.341 652 HA ASP 100 HA ASP 100 -12.116 4.332 -1.738 653 HB3 ASP 100 2HB ASP 100 -11.237 6.122 -4.037 654 H GLN 101 H GLN 101 -9.864 3.625 -4.404 655 HA GLN 101 HA GLN 101 -11.888 2.022 -5.812 656 HB3 GLN 101 2HB GLN 101 -10.735 3.337 -7.309 657 HG3 GLN 101 2HG GLN 101 -8.210 2.206 -6.224 658 HE21 GLN 101 1HE2 GLN 101 -9.049 4.987 -8.470 659 HE22 GLN 101 2HE2 GLN 101 -8.075 4.377 -9.774 660 H MET 102 H MET 102 -9.890 1.358 -3.205 661 HA MET 102 HA MET 102 -9.818 -1.533 -3.985 662 HB3 MET 102 2HB MET 102 -7.573 -0.824 -4.045 663 HG3 MET 102 2HG MET 102 -8.284 0.851 -1.838 664 HE1 MET 102 3HE MET 102 -4.890 -0.470 -2.806 665 HE2 MET 102 1HE MET 102 -4.017 -0.627 -1.270 666 HE3 MET 102 2HE MET 102 -5.091 -1.924 -1.800 667 H LYS 103 H LYS 103 -10.959 0.630 -1.548 668 HA LYS 103 HA LYS 103 -10.926 -0.823 0.739 669 HB3 LYS 103 2HB LYS 103 -11.633 1.504 0.214 670 HG3 LYS 103 2HG LYS 103 -13.730 0.501 -1.181 671 HD3 LYS 103 2HD LYS 103 -14.452 -0.103 1.418 672 HE3 LYS 103 2HE LYS 103 -14.454 2.584 1.505 673 HZ1 LYS 103 3HZ LYS 103 -16.531 3.496 1.039 674 HZ2 LYS 103 1HZ LYS 103 -17.269 2.051 0.794 675 HZ3 LYS 103 2HZ LYS 103 -16.214 2.609 -0.319 676 H ASN 104 H ASN 104 -13.075 -1.602 -1.803 677 HA ASN 104 HA ASN 104 -14.978 -3.112 -0.201 678 HB3 ASN 104 2HB ASN 104 -16.097 -3.661 -2.233 679 HD21 ASN 104 1HD2 ASN 104 -14.181 -1.162 -3.780 680 HD22 ASN 104 2HD2 ASN 104 -15.339 0.114 -3.474 681 H TYR 105 H TYR 105 -11.964 -4.014 -0.683 682 HA TYR 105 HA TYR 105 -12.072 -6.667 -1.767 683 HB3 TYR 105 2HB TYR 105 -10.145 -4.940 -1.595 684 HD1 TYR 105 2HD TYR 105 -11.229 -4.230 1.199 685 HD2 TYR 105 1HD TYR 105 -7.968 -6.871 0.027 686 HE1 TYR 105 2HE TYR 105 -10.312 -4.073 3.431 687 HE2 TYR 105 1HE TYR 105 -7.041 -6.626 2.273 688 HH TYR 105 HH TYR 105 -7.672 -6.047 4.485 689 H ARG 106 H ARG 106 -10.726 -8.339 -0.172 690 HA ARG 106 HA ARG 106 -11.491 -8.229 2.628 691 HB3 ARG 106 2HB ARG 106 -11.930 -10.632 2.692 692 HG3 ARG 106 2HG ARG 106 -13.806 -9.239 0.737 693 HD3 ARG 106 2HD ARG 106 -14.939 -10.720 2.976 694 HE ARG 106 HE ARG 106 -16.373 -10.416 1.216 695 HH11 ARG 106 1HH1 ARG 106 -13.552 -12.238 0.053 696 HH12 ARG 106 2HH1 ARG 106 -14.202 -12.496 -1.536 697 HH21 ARG 106 1HH2 ARG 106 -17.078 -10.478 -1.000 698 HH22 ARG 106 2HH2 ARG 106 -16.120 -11.183 -2.225 699 H GLY 107 H GLY 107 -9.634 -8.916 3.812 700 HA2 GLY 107 1HA GLY 107 -7.695 -10.637 3.511 701 HA3 GLY 107 2HA GLY 107 -7.253 -9.557 2.181 702 H GLU 108 H GLU 108 -5.225 -9.551 3.640 703 HA GLU 108 HA GLU 108 -5.453 -7.477 5.798 704 HB3 GLU 108 2HB GLU 108 -3.178 -8.221 6.397 705 HG3 GLU 108 2HG GLU 108 -4.782 -10.756 6.366 706 H VAL 109 H VAL 109 -4.000 -5.673 5.809 707 HA VAL 109 HA VAL 109 -2.708 -5.016 3.235 708 HB VAL 109 HB VAL 109 -4.954 -3.562 4.680 709 HG11 VAL 109 1HG1 VAL 109 -3.042 -2.359 2.625 710 HG12 VAL 109 2HG1 VAL 109 -4.576 -1.620 3.129 711 HG13 VAL 109 3HG1 VAL 109 -3.269 -1.801 4.299 712 HG21 VAL 109 3HG2 VAL 109 -5.563 -5.116 2.874 713 HG22 VAL 109 1HG2 VAL 109 -5.921 -3.456 2.413 714 HG23 VAL 109 2HG2 VAL 109 -4.484 -4.270 1.752 715 H ALA 110 H ALA 110 -0.823 -3.818 3.506 716 HA ALA 110 HA ALA 110 -0.336 -2.591 6.152 717 HB1 ALA 110 1HB ALA 110 1.993 -3.432 6.191 718 HB2 ALA 110 2HB ALA 110 0.806 -4.726 6.361 719 HB3 ALA 110 3HB ALA 110 1.634 -4.491 4.808 720 H SER 111 H SER 111 1.546 -1.067 6.036 721 HA SER 111 HA SER 111 1.715 0.153 3.334 722 HB3 SER 111 2HB SER 111 1.237 2.059 5.556 723 HG SER 111 HG SER 111 -0.060 1.710 3.056 724 H PHE 112 H PHE 112 3.562 0.983 2.817 725 HA PHE 112 HA PHE 112 5.779 1.051 4.801 726 HB3 PHE 112 2HB PHE 112 5.493 0.371 1.835 727 HD1 PHE 112 2HD PHE 112 7.132 1.948 0.908 728 HD2 PHE 112 1HD PHE 112 8.134 -0.799 4.074 729 HE1 PHE 112 2HE PHE 112 9.545 2.343 0.492 730 HE2 PHE 112 1HE PHE 112 10.512 -0.460 3.606 731 HZ PHE 112 HZ PHE 112 11.254 1.154 1.854 732 H PHE 113 H PHE 113 7.204 2.771 4.692 733 HA PHE 113 HA PHE 113 6.780 4.981 2.826 734 HB3 PHE 113 2HB PHE 113 6.735 6.614 4.695 735 HD1 PHE 113 1HD PHE 113 4.318 3.944 5.860 736 HD2 PHE 113 2HD PHE 113 4.883 7.448 3.370 737 HE1 PHE 113 1HE PHE 113 1.907 4.048 5.417 738 HE2 PHE 113 2HE PHE 113 2.463 7.507 2.939 739 HZ PHE 113 HZ PHE 113 0.971 5.757 3.898 740 H THR 114 H THR 114 8.641 6.679 3.270 741 HA THR 114 HA THR 114 11.072 5.454 4.451 742 HB THR 114 HB THR 114 12.209 6.183 2.221 743 HG1 THR 114 1HG THR 114 9.774 5.353 1.088 744 HG21 THR 114 3HG2 THR 114 10.552 3.651 2.245 745 HG22 THR 114 1HG2 THR 114 12.143 3.838 2.983 746 HG23 THR 114 2HG2 THR 114 11.955 3.942 1.218 747 H SER 115 H SER 115 10.216 7.351 5.923 748 HA SER 115 HA SER 115 11.105 9.975 4.920 749 HB3 SER 115 2HB SER 115 9.212 9.478 6.772 750 HG SER 115 HG SER 115 10.001 10.347 8.696 751 H ALA 116 H ALA 116 12.599 11.181 6.450 752 HA ALA 116 HA ALA 116 15.191 9.794 6.581 753 HB1 ALA 116 1HB ALA 116 14.326 12.726 6.680 754 HB2 ALA 116 2HB ALA 116 15.998 12.163 6.832 755 HB3 ALA 116 3HB ALA 116 15.107 11.873 5.327 756 H GLY 117 H GLY 117 13.296 8.942 8.474 757 HA2 GLY 117 1HA GLY 117 13.209 8.534 10.770 758 HA3 GLY 117 2HA GLY 117 14.741 9.431 10.850 759 H THR 118 H THR 118 11.740 10.779 9.613 760 HA THR 118 HA THR 118 11.522 12.655 11.902 761 HB THR 118 HB THR 118 11.117 14.317 9.878 762 HG1 THR 118 1HG THR 118 13.191 12.984 8.655 763 HG21 THR 118 3HG2 THR 118 13.503 14.972 9.961 764 HG22 THR 118 1HG2 THR 118 13.912 13.433 10.732 765 HG23 THR 118 2HG2 THR 118 12.877 14.608 11.573 766 H ASN 119 H ASN 119 9.527 13.657 12.110 767 HA ASN 119 HA ASN 119 7.322 13.560 12.505 768 HB3 ASN 119 2HB ASN 119 5.936 13.785 10.466 769 HD21 ASN 119 1HD2 ASN 119 8.288 15.258 8.600 770 HD22 ASN 119 2HD2 ASN 119 8.112 16.824 9.374 771 H HIS 120 H HIS 120 8.606 10.738 12.349 772 HA HIS 120 HA HIS 120 6.770 9.221 10.895 773 HB3 HIS 120 2HB HIS 120 8.086 7.306 12.299 774 HD1 HIS 120 1HD HIS 120 10.803 6.907 10.994 775 HD2 HIS 120 2HD HIS 120 7.391 8.441 9.038 776 HE1 HIS 120 1HE HIS 120 11.074 6.436 8.501 777 H LYS 121 H LYS 121 6.383 10.417 14.120 778 HA LYS 121 HA LYS 121 4.559 8.326 15.014 779 HB3 LYS 121 2HB LYS 121 3.864 10.674 16.225 780 HG3 LYS 121 2HG LYS 121 6.407 9.204 17.014 781 HD3 LYS 121 2HD LYS 121 6.047 11.402 18.153 782 HE3 LYS 121 2HE LYS 121 3.457 10.103 19.092 783 HZ1 LYS 121 3HZ LYS 121 4.549 12.759 19.775 784 HZ2 LYS 121 1HZ LYS 121 4.423 11.462 20.822 785 HZ3 LYS 121 2HZ LYS 121 3.095 12.174 20.185 786 H ALA 122 H ALA 122 4.340 11.130 12.913 787 HA ALA 122 HA ALA 122 1.521 11.633 13.335 788 HB1 ALA 122 1HB ALA 122 1.661 13.130 11.353 789 HB2 ALA 122 2HB ALA 122 2.943 13.524 12.504 790 HB3 ALA 122 3HB ALA 122 3.320 12.620 11.031 791 H TYR 123 H TYR 123 3.421 10.412 10.509 792 HA TYR 123 HA TYR 123 1.313 9.804 8.934 793 HB3 TYR 123 2HB TYR 123 4.004 9.496 8.819 794 HD1 TYR 123 1HD TYR 123 2.668 6.224 7.565 795 HD2 TYR 123 2HD TYR 123 5.209 8.325 10.253 796 HE1 TYR 123 1HE TYR 123 4.025 4.183 7.884 797 HE2 TYR 123 2HE TYR 123 6.663 6.286 10.527 798 HH TYR 123 HH TYR 123 6.264 3.570 8.387 799 H VAL 124 H VAL 124 2.708 7.532 11.421 800 HA VAL 124 HA VAL 124 1.196 5.255 10.756 801 HB VAL 124 HB VAL 124 2.328 6.265 13.401 802 HG11 VAL 124 1HG1 VAL 124 0.792 4.531 14.027 803 HG12 VAL 124 2HG1 VAL 124 1.337 3.463 12.722 804 HG13 VAL 124 3HG1 VAL 124 2.405 3.835 14.096 805 HG21 VAL 124 3HG2 VAL 124 3.497 4.373 11.332 806 HG22 VAL 124 1HG2 VAL 124 3.993 6.033 11.673 807 HG23 VAL 124 2HG2 VAL 124 4.245 4.781 12.887 808 H SER 125 H SER 125 0.228 8.173 12.560 809 HA SER 125 HA SER 125 -2.373 6.846 13.313 810 HB3 SER 125 2HB SER 125 -2.484 9.148 14.592 811 HG SER 125 HG SER 125 -1.649 8.207 16.242 812 H HIS 126 H HIS 126 -1.006 9.668 11.635 813 HA HIS 126 HA HIS 126 -3.557 10.928 11.268 814 HB3 HIS 126 2HB HIS 126 -1.082 11.875 11.572 815 HD1 HIS 126 1HD HIS 126 1.111 11.786 10.005 816 HD2 HIS 126 2HD HIS 126 -2.577 12.262 8.160 817 HE1 HIS 126 1HE HIS 126 1.572 11.527 7.573 818 H PHE 127 H PHE 127 -1.378 9.198 8.936 819 HA PHE 127 HA PHE 127 -3.241 9.286 6.780 820 HB3 PHE 127 2HB PHE 127 -0.763 7.818 7.493 821 HD1 PHE 127 2HD PHE 127 -1.286 5.460 7.557 822 HD2 PHE 127 1HD PHE 127 -2.044 7.857 4.040 823 HE1 PHE 127 2HE PHE 127 -1.433 3.410 6.191 824 HE2 PHE 127 1HE PHE 127 -2.172 5.781 2.697 825 HZ PHE 127 HZ PHE 127 -1.880 3.570 3.751 826 H ASN 128 H ASN 128 -3.297 7.407 9.724 827 HA ASN 128 HA ASN 128 -4.955 5.280 8.709 828 HB3 ASN 128 2HB ASN 128 -5.385 5.926 11.539 829 HD21 ASN 128 1HD2 ASN 128 -3.014 4.039 12.179 830 HD22 ASN 128 2HD2 ASN 128 -3.741 2.495 11.842 831 H GLU 129 H GLU 129 -5.626 8.628 9.336 832 HA GLU 129 HA GLU 129 -8.565 8.231 9.387 833 HB3 GLU 129 2HB GLU 129 -8.184 10.911 9.105 834 HG3 GLU 129 2HG GLU 129 -7.486 10.293 11.854 835 H TRP 130 H TRP 130 -6.108 8.426 7.045 836 HA TRP 130 HA TRP 130 -7.964 9.355 4.895 837 HB3 TRP 130 2HB TRP 130 -6.114 10.469 3.889 838 HD1 TRP 130 HD TRP 130 -4.320 11.342 6.916 839 HE1 TRP 130 1HE TRP 130 -5.112 13.540 7.898 840 HE3 TRP 130 3HE TRP 130 -8.875 11.688 4.605 841 HZ2 TRP 130 2HZ TRP 130 -7.134 15.509 7.281 842 HZ3 TRP 130 3HZ TRP 130 -10.236 13.750 4.853 843 HH2 TRP 130 HH TRP 130 -9.355 15.679 6.141 844 H ALA 131 H ALA 131 -7.164 6.652 5.934 845 HA ALA 131 HA ALA 131 -6.830 5.290 3.362 846 HB1 ALA 131 1HB ALA 131 -5.088 4.584 5.732 847 HB2 ALA 131 2HB ALA 131 -5.073 3.897 4.083 848 HB3 ALA 131 3HB ALA 131 -4.537 5.570 4.346 849 H ASP 132 H ASP 132 -8.897 5.849 5.619 850 HA ASP 132 HA ASP 132 -8.989 3.494 7.269 851 HB3 ASP 132 2HB ASP 132 -11.167 5.594 6.965 852 H GLY 133 H GLY 133 -10.681 2.063 7.178 853 HA2 GLY 133 1HA GLY 133 -12.607 1.002 6.202 854 HA3 GLY 133 2HA GLY 133 -12.296 1.785 4.666 855 H LEU 134 H LEU 134 -9.395 0.460 5.915 856 HA LEU 134 HA LEU 134 -9.694 -2.129 4.519 857 HB3 LEU 134 2HB LEU 134 -7.195 -1.594 3.921 858 HG LEU 134 HG LEU 134 -9.729 -0.857 2.608 859 HD11 LEU 134 1HD1 LEU 134 -8.851 0.709 0.940 860 HD12 LEU 134 2HD1 LEU 134 -7.333 0.847 1.864 861 HD13 LEU 134 3HD1 LEU 134 -8.864 1.416 2.563 862 HD21 LEU 134 3HD2 LEU 134 -8.192 -2.775 2.209 863 HD22 LEU 134 1HD2 LEU 134 -7.080 -1.664 1.412 864 HD23 LEU 134 2HD2 LEU 134 -8.720 -1.937 0.742 865 H ASN 135 H ASN 135 -8.569 -3.802 5.544 866 HA ASN 135 HA ASN 135 -8.167 -3.494 8.398 867 HB3 ASN 135 2HB ASN 135 -7.887 -5.833 6.508 868 HD21 ASN 135 1HD2 ASN 135 -7.126 -7.691 7.263 869 HD22 ASN 135 2HD2 ASN 135 -6.869 -8.077 8.954 870 H VAL 136 H VAL 136 -6.439 -2.022 8.388 871 HA VAL 136 HA VAL 136 -3.831 -2.632 7.358 872 HB VAL 136 HB VAL 136 -4.766 -0.716 9.539 873 HG11 VAL 136 1HG1 VAL 136 -2.601 0.454 9.153 874 HG12 VAL 136 2HG1 VAL 136 -2.376 -1.137 9.873 875 HG13 VAL 136 3HG1 VAL 136 -2.055 -0.900 8.136 876 HG21 VAL 136 3HG2 VAL 136 -4.040 -0.294 6.599 877 HG22 VAL 136 1HG2 VAL 136 -5.676 -0.208 7.294 878 HG23 VAL 136 2HG2 VAL 136 -4.476 0.982 7.756 879 H ILE 137 H ILE 137 -2.356 -4.024 8.138 880 HA ILE 137 HA ILE 137 -2.722 -5.220 10.831 881 HB ILE 137 HB ILE 137 -1.292 -6.975 10.088 882 HG13 ILE 137 2HG1 ILE 137 0.312 -5.677 8.680 883 HG21 ILE 137 1HG2 ILE 137 -2.691 -7.899 8.471 884 HG22 ILE 137 2HG2 ILE 137 -3.756 -6.847 9.374 885 HG23 ILE 137 3HG2 ILE 137 -3.191 -6.337 7.780 886 HD11 ILE 137 3HD1 ILE 137 0.604 -7.169 6.813 887 HD12 ILE 137 1HD1 ILE 137 0.157 -8.136 8.249 888 HD13 ILE 137 2HD1 ILE 137 -1.020 -7.802 6.963 889 H GLY 138 H GLY 138 -0.645 -3.009 9.129 890 HA2 GLY 138 1HA GLY 138 0.622 -1.975 11.391 891 HA3 GLY 138 2HA GLY 138 1.661 -3.222 10.676 892 H VAL 139 H VAL 139 2.025 -0.071 10.614 893 HA VAL 139 HA VAL 139 2.698 -0.162 7.869 894 HB VAL 139 HB VAL 139 2.159 2.016 7.697 895 HG11 VAL 139 1HG1 VAL 139 -0.234 1.058 9.267 896 HG12 VAL 139 2HG1 VAL 139 -0.238 2.272 7.984 897 HG13 VAL 139 3HG1 VAL 139 0.123 0.584 7.591 898 HG21 VAL 139 3HG2 VAL 139 2.950 3.100 9.544 899 HG22 VAL 139 1HG2 VAL 139 1.299 3.610 9.218 900 HG23 VAL 139 2HG2 VAL 139 1.608 2.465 10.572 901 H ALA 140 H ALA 140 4.806 0.666 7.487 902 HA ALA 140 HA ALA 140 6.442 1.432 9.795 903 HB1 ALA 140 1HB ALA 140 8.015 -0.417 9.586 904 HB2 ALA 140 2HB ALA 140 6.392 -1.071 9.847 905 HB3 ALA 140 3HB ALA 140 7.117 -1.082 8.217 906 H ARG 141 H ARG 141 8.952 1.219 8.771 907 HA ARG 141 HA ARG 141 8.945 2.090 6.028 908 HB3 ARG 141 2HB ARG 141 9.358 4.210 7.329 909 HG3 ARG 141 2HG ARG 141 11.695 4.414 8.266 910 HD3 ARG 141 2HD ARG 141 9.457 4.140 9.671 911 HE ARG 141 HE ARG 141 11.121 1.758 10.429 912 HH11 ARG 141 1HH1 ARG 141 8.088 3.571 10.885 913 HH12 ARG 141 2HH1 ARG 141 7.375 2.364 11.909 914 HH21 ARG 141 1HH2 ARG 141 10.197 0.209 11.692 915 HH22 ARG 141 2HH2 ARG 141 8.604 0.358 12.401 916 H ASP 142 H ASP 142 10.953 1.517 5.094 917 HA ASP 142 HA ASP 142 12.472 -0.039 4.521 918 HB3 ASP 142 2HB ASP 142 14.288 -0.442 6.126 919 H ASP 143 H ASP 143 13.589 -2.264 5.836 920 HA ASP 143 HA ASP 143 11.233 -3.920 5.204 921 HB3 ASP 143 2HB ASP 143 12.814 -3.655 3.501 922 H SER 144 H SER 144 12.219 -3.531 8.194 923 HA SER 144 HA SER 144 12.918 -6.196 8.922 924 HB3 SER 144 2HB SER 144 12.003 -4.840 11.102 925 HG SER 144 HG SER 144 14.491 -4.584 9.749 926 H GLU 145 H GLU 145 9.780 -4.658 8.196 927 HA GLU 145 HA GLU 145 8.382 -6.441 10.003 928 HB3 GLU 145 2HB GLU 145 6.375 -5.387 9.249 929 HG3 GLU 145 2HG GLU 145 6.584 -3.810 10.716 930 H VAL 146 H VAL 146 9.555 -7.113 6.869 931 HA VAL 146 HA VAL 146 7.255 -7.892 5.521 932 HB VAL 146 HB VAL 146 10.041 -9.153 5.338 933 HG11 VAL 146 1HG1 VAL 146 7.810 -9.008 3.266 934 HG12 VAL 146 2HG1 VAL 146 9.478 -9.541 2.928 935 HG13 VAL 146 3HG1 VAL 146 8.460 -10.471 4.028 936 HG21 VAL 146 3HG2 VAL 146 8.969 -6.765 3.789 937 HG22 VAL 146 1HG2 VAL 146 10.132 -6.656 5.124 938 HG23 VAL 146 2HG2 VAL 146 10.590 -7.513 3.667 939 H ASP 147 H ASP 147 9.075 -9.762 7.826 940 HA ASP 147 HA ASP 147 7.863 -12.314 7.403 941 HB3 ASP 147 2HB ASP 147 9.212 -10.958 9.738 942 H LYS 148 H LYS 148 6.637 -9.434 9.044 943 HA LYS 148 HA LYS 148 4.489 -11.091 10.390 944 HB3 LYS 148 2HB LYS 148 5.562 -9.488 11.953 945 HG3 LYS 148 2HG LYS 148 4.974 -7.522 9.754 946 HD3 LYS 148 2HD LYS 148 3.808 -6.611 11.772 947 HE3 LYS 148 2HE LYS 148 5.343 -5.321 13.272 948 HZ1 LYS 148 3HZ LYS 148 5.934 -7.019 14.725 949 HZ2 LYS 148 1HZ LYS 148 6.073 -8.149 13.572 950 HZ3 LYS 148 2HZ LYS 148 4.552 -7.579 13.983 951 H TRP 149 H TRP 149 5.024 -9.046 7.642 952 HA TRP 149 HA TRP 149 2.163 -8.493 7.481 953 HB3 TRP 149 2HB TRP 149 2.834 -7.263 5.414 954 HD1 TRP 149 HD TRP 149 2.671 -6.845 8.936 955 HE1 TRP 149 1HE TRP 149 3.408 -4.567 9.792 956 HE3 TRP 149 3HE TRP 149 5.167 -5.225 4.808 957 HZ2 TRP 149 2HZ TRP 149 4.435 -2.115 8.623 958 HZ3 TRP 149 3HZ TRP 149 5.941 -2.852 4.642 959 HH2 TRP 149 HH TRP 149 5.538 -1.284 6.515 960 H SER 150 H SER 150 3.869 -11.236 6.818 961 HA SER 150 HA SER 150 1.867 -11.987 4.752 962 HB3 SER 150 2HB SER 150 4.795 -12.774 4.630 963 HG SER 150 HG SER 150 4.203 -13.846 2.974 964 H LYS 151 H LYS 151 1.148 -12.421 7.198 965 HA LYS 151 HA LYS 151 1.786 -15.267 7.811 966 HB3 LYS 151 2HB LYS 151 1.059 -14.610 10.144 967 HG3 LYS 151 2HG LYS 151 3.533 -13.442 8.836 968 HD3 LYS 151 2HD LYS 151 3.029 -12.584 11.147 969 HE3 LYS 151 2HE LYS 151 3.664 -15.476 11.851 970 HZ1 LYS 151 3HZ LYS 151 4.584 -13.778 13.342 971 HZ2 LYS 151 1HZ LYS 151 3.456 -14.745 14.078 972 HZ3 LYS 151 2HZ LYS 151 3.046 -13.221 13.627 Start of MODEL 12 1 H1 GLY 1 H GLY 1 -12.357 -24.674 -3.503 2 HA2 GLY 1 1HA GLY 1 -10.684 -25.266 -1.889 3 HA3 GLY 1 2HA GLY 1 -10.088 -25.737 -3.499 4 H MET 2 H MET 2 -8.410 -24.479 -4.466 5 HA MET 2 HA MET 2 -6.653 -22.971 -2.665 6 HB3 MET 2 2HB MET 2 -5.369 -22.625 -4.814 7 HG3 MET 2 2HG MET 2 -5.976 -25.490 -3.994 8 HE1 MET 2 3HE MET 2 -3.948 -27.271 -4.082 9 HE2 MET 2 1HE MET 2 -2.440 -26.989 -4.978 10 HE3 MET 2 2HE MET 2 -2.792 -26.043 -3.513 11 H ALA 3 H ALA 3 -7.181 -20.875 -2.208 12 HA ALA 3 HA ALA 3 -7.471 -19.019 -4.369 13 HB1 ALA 3 1HB ALA 3 -9.829 -19.269 -4.166 14 HB2 ALA 3 2HB ALA 3 -9.749 -19.224 -2.373 15 HB3 ALA 3 3HB ALA 3 -9.395 -17.784 -3.335 16 H LYS 4 H LYS 4 -5.465 -18.351 -3.672 17 HA LYS 4 HA LYS 4 -5.622 -16.355 -1.674 18 HB3 LYS 4 2HB LYS 4 -4.998 -18.291 -0.191 19 HG3 LYS 4 2HG LYS 4 -2.668 -18.909 -0.014 20 HD3 LYS 4 2HD LYS 4 -4.330 -20.274 -1.651 21 HE3 LYS 4 2HE LYS 4 -3.562 -19.448 -3.833 22 HZ1 LYS 4 3HZ LYS 4 -1.118 -19.942 -4.351 23 HZ2 LYS 4 1HZ LYS 4 -0.876 -19.875 -2.721 24 HZ3 LYS 4 2HZ LYS 4 -1.460 -18.563 -3.534 25 H LYS 5 H LYS 5 -4.232 -14.679 -2.201 26 HA LYS 5 HA LYS 5 -1.941 -15.137 -3.974 27 HB3 LYS 5 2HB LYS 5 -2.557 -13.479 -5.611 28 HG3 LYS 5 2HG LYS 5 -4.989 -15.213 -5.407 29 HD3 LYS 5 2HD LYS 5 -4.032 -13.387 -7.408 30 HE3 LYS 5 2HE LYS 5 -3.840 -16.324 -8.207 31 HZ1 LYS 5 3HZ LYS 5 -2.967 -15.478 -10.232 32 HZ2 LYS 5 1HZ LYS 5 -3.139 -13.924 -9.779 33 HZ3 LYS 5 2HZ LYS 5 -4.484 -14.855 -10.050 34 H THR 6 H THR 6 -0.874 -13.036 -4.392 35 HA THR 6 HA THR 6 -1.232 -10.995 -2.276 36 HB THR 6 HB THR 6 1.237 -12.639 -2.702 37 HG1 THR 6 1HG THR 6 -0.889 -12.850 -1.073 38 HG21 THR 6 3HG2 THR 6 0.792 -10.278 -0.829 39 HG22 THR 6 1HG2 THR 6 1.944 -10.349 -2.180 40 HG23 THR 6 2HG2 THR 6 2.191 -11.381 -0.764 41 H LEU 7 H LEU 7 -1.512 -9.251 -3.432 42 HA LEU 7 HA LEU 7 0.215 -8.632 -5.815 43 HB3 LEU 7 2HB LEU 7 -2.241 -7.268 -4.693 44 HG LEU 7 HG LEU 7 -1.132 -5.692 -6.106 45 HD11 LEU 7 1HD1 LEU 7 -1.027 -7.856 -8.259 46 HD12 LEU 7 2HD1 LEU 7 0.371 -7.077 -7.483 47 HD13 LEU 7 3HD1 LEU 7 -0.683 -6.130 -8.524 48 HD21 LEU 7 3HD2 LEU 7 -3.575 -5.904 -6.257 49 HD22 LEU 7 1HD2 LEU 7 -3.425 -7.153 -7.507 50 HD23 LEU 7 2HD2 LEU 7 -2.945 -5.495 -7.866 51 H ILE 8 H ILE 8 1.499 -6.649 -5.875 52 HA ILE 8 HA ILE 8 1.837 -5.213 -3.305 53 HB ILE 8 HB ILE 8 4.010 -5.900 -5.306 54 HG13 ILE 8 2HG1 ILE 8 3.269 -7.973 -4.060 55 HG21 ILE 8 1HG2 ILE 8 5.552 -5.025 -3.594 56 HG22 ILE 8 2HG2 ILE 8 4.372 -3.824 -4.088 57 HG23 ILE 8 3HG2 ILE 8 4.162 -4.696 -2.549 58 HD11 ILE 8 3HD1 ILE 8 5.697 -7.626 -4.757 59 HD12 ILE 8 1HD1 ILE 8 6.027 -7.159 -3.077 60 HD13 ILE 8 2HD1 ILE 8 5.395 -8.771 -3.441 61 H LEU 9 H LEU 9 1.478 -3.047 -3.562 62 HA LEU 9 HA LEU 9 1.361 -1.830 -6.276 63 HB3 LEU 9 2HB LEU 9 -0.749 -0.728 -5.537 64 HG LEU 9 HG LEU 9 -0.858 -3.745 -5.257 65 HD11 LEU 9 1HD1 LEU 9 -3.245 -1.878 -5.477 66 HD12 LEU 9 2HD1 LEU 9 -2.706 -2.672 -3.989 67 HD13 LEU 9 3HD1 LEU 9 -3.256 -3.652 -5.351 68 HD21 LEU 9 3HD2 LEU 9 -1.822 -3.704 -7.489 69 HD22 LEU 9 1HD2 LEU 9 -0.320 -2.802 -7.498 70 HD23 LEU 9 2HD2 LEU 9 -1.855 -1.923 -7.495 71 H TYR 10 H TYR 10 3.258 -0.422 -5.970 72 HA TYR 10 HA TYR 10 3.035 1.393 -3.589 73 HB3 TYR 10 2HB TYR 10 5.019 -0.176 -3.514 74 HD1 TYR 10 1HD TYR 10 4.961 0.526 -6.827 75 HD2 TYR 10 2HD TYR 10 7.662 0.848 -3.463 76 HE1 TYR 10 1HE TYR 10 6.838 0.848 -8.373 77 HE2 TYR 10 2HE TYR 10 9.497 1.254 -5.034 78 HH TYR 10 HH TYR 10 9.162 0.973 -8.556 79 H TYR 11 H TYR 11 3.987 3.553 -3.839 80 HA TYR 11 HA TYR 11 3.843 4.630 -6.624 81 HB3 TYR 11 2HB TYR 11 3.275 5.860 -3.923 82 HD1 TYR 11 1HD TYR 11 4.104 6.817 -7.505 83 HD2 TYR 11 2HD TYR 11 3.499 8.137 -3.442 84 HE1 TYR 11 1HE TYR 11 4.873 9.072 -8.123 85 HE2 TYR 11 2HE TYR 11 4.176 10.431 -4.096 86 HH TYR 11 HH TYR 11 5.840 11.271 -6.854 87 H SER 12 H SER 12 5.940 4.639 -7.425 88 HA SER 12 HA SER 12 8.199 5.071 -5.650 89 HB3 SER 12 2HB SER 12 8.885 3.677 -7.261 90 HG SER 12 HG SER 12 8.156 3.643 -9.364 91 H TRP 13 H TRP 13 8.252 6.987 -4.779 92 HA TRP 13 HA TRP 13 7.172 9.378 -5.500 93 HB3 TRP 13 2HB TRP 13 9.679 8.756 -3.924 94 HD1 TRP 13 HD TRP 13 6.841 11.390 -3.470 95 HE1 TRP 13 1HE TRP 13 7.837 13.519 -2.593 96 HE3 TRP 13 3HE TRP 13 11.803 10.212 -4.000 97 HZ2 TRP 13 2HZ TRP 13 10.496 14.636 -2.155 98 HZ3 TRP 13 3HZ TRP 13 13.541 11.906 -3.496 99 HH2 TRP 13 HH TRP 13 12.905 14.102 -2.565 100 H SER 14 H SER 14 10.667 9.412 -5.445 101 HA SER 14 HA SER 14 10.980 10.145 -8.281 102 HB3 SER 14 2HB SER 14 12.181 12.079 -6.347 103 HG SER 14 HG SER 14 10.451 12.724 -8.466 104 H GLY 15 H GLY 15 11.702 7.813 -7.336 105 HA2 GLY 15 1HA GLY 15 13.532 6.400 -7.388 106 HA3 GLY 15 2HA GLY 15 14.583 7.797 -7.557 107 H GLU 16 H GLU 16 12.303 6.911 -4.935 108 HA GLU 16 HA GLU 16 14.614 6.369 -3.130 109 HB3 GLU 16 2HB GLU 16 13.098 6.996 -1.228 110 HG3 GLU 16 2HG GLU 16 13.496 9.522 -2.796 111 H THR 17 H THR 17 11.024 6.027 -3.378 112 HA THR 17 HA THR 17 10.791 3.885 -1.745 113 HB THR 17 HB THR 17 8.988 4.155 -4.089 114 HG1 THR 17 1HG THR 17 9.257 6.253 -2.211 115 HG21 THR 17 3HG2 THR 17 8.282 2.775 -2.164 116 HG22 THR 17 1HG2 THR 17 7.189 4.132 -2.396 117 HG23 THR 17 2HG2 THR 17 8.393 4.193 -1.093 118 H LYS 18 H LYS 18 11.727 3.908 -5.102 119 HA LYS 18 HA LYS 18 11.340 1.266 -6.002 120 HB3 LYS 18 2HB LYS 18 13.402 3.410 -6.571 121 HG3 LYS 18 2HG LYS 18 13.038 0.695 -7.905 122 HD3 LYS 18 2HD LYS 18 12.982 2.149 -9.762 123 HE3 LYS 18 2HE LYS 18 15.314 3.729 -8.615 124 HZ1 LYS 18 3HZ LYS 18 15.275 3.643 -11.032 125 HZ2 LYS 18 1HZ LYS 18 14.892 5.141 -10.519 126 HZ3 LYS 18 2HZ LYS 18 13.704 4.143 -11.081 127 H LYS 19 H LYS 19 14.043 2.587 -4.005 128 HA LYS 19 HA LYS 19 15.491 0.119 -3.930 129 HB3 LYS 19 2HB LYS 19 15.471 2.072 -1.584 130 HG3 LYS 19 2HG LYS 19 17.877 2.162 -1.847 131 HD3 LYS 19 2HD LYS 19 17.268 -0.797 -2.072 132 HE3 LYS 19 2HE LYS 19 19.647 0.356 -1.803 133 HZ1 LYS 19 3HZ LYS 19 20.267 0.560 0.508 134 HZ2 LYS 19 1HZ LYS 19 18.808 0.090 1.010 135 HZ3 LYS 19 2HZ LYS 19 18.979 1.575 0.305 136 H MET 20 H MET 20 12.858 1.451 -1.947 137 HA MET 20 HA MET 20 12.811 -0.861 -0.143 138 HB3 MET 20 2HB MET 20 10.906 1.525 -0.191 139 HG3 MET 20 2HG MET 20 10.295 -0.292 1.360 140 HE1 MET 20 3HE MET 20 14.112 0.841 1.862 141 HE2 MET 20 1HE MET 20 13.159 1.502 3.217 142 HE3 MET 20 2HE MET 20 14.360 0.230 3.512 143 H ALA 21 H ALA 21 12.294 -1.534 -2.864 144 HA ALA 21 HA ALA 21 9.478 -2.483 -2.605 145 HB1 ALA 21 1HB ALA 21 9.202 -2.189 -5.047 146 HB2 ALA 21 2HB ALA 21 9.194 -0.766 -3.997 147 HB3 ALA 21 3HB ALA 21 10.619 -1.109 -5.013 148 H GLU 22 H GLU 22 12.433 -2.620 -4.637 149 HA GLU 22 HA GLU 22 12.365 -5.232 -5.560 150 HB3 GLU 22 2HB GLU 22 14.821 -5.040 -5.758 151 HG3 GLU 22 2HG GLU 22 13.696 -2.222 -6.033 152 H LYS 23 H LYS 23 13.634 -4.038 -2.474 153 HA LYS 23 HA LYS 23 14.724 -6.352 -1.388 154 HB3 LYS 23 2HB LYS 23 13.273 -4.763 0.623 155 HG3 LYS 23 2HG LYS 23 15.474 -6.152 0.719 156 HD3 LYS 23 2HD LYS 23 16.704 -3.423 0.325 157 HE3 LYS 23 2HE LYS 23 17.962 -6.059 -0.446 158 HZ1 LYS 23 3HZ LYS 23 19.308 -4.037 -0.539 159 HZ2 LYS 23 1HZ LYS 23 19.856 -5.037 0.638 160 HZ3 LYS 23 2HZ LYS 23 18.973 -3.712 1.045 161 H ILE 24 H ILE 24 11.409 -5.127 -1.035 162 HA ILE 24 HA ILE 24 10.600 -7.162 0.778 163 HB ILE 24 HB ILE 24 8.957 -5.250 -0.944 164 HG13 ILE 24 2HG1 ILE 24 10.717 -4.216 0.705 165 HG21 ILE 24 1HG2 ILE 24 7.563 -7.065 -0.066 166 HG22 ILE 24 2HG2 ILE 24 8.263 -6.839 1.558 167 HG23 ILE 24 3HG2 ILE 24 7.210 -5.600 0.842 168 HD11 ILE 24 3HD1 ILE 24 9.219 -2.484 1.465 169 HD12 ILE 24 1HD1 ILE 24 8.863 -2.929 -0.220 170 HD13 ILE 24 2HD1 ILE 24 7.801 -3.470 1.078 171 H ASN 25 H ASN 25 10.242 -6.764 -2.794 172 HA ASN 25 HA ASN 25 8.390 -8.875 -3.072 173 HB3 ASN 25 2HB ASN 25 10.467 -8.152 -5.155 174 HD21 ASN 25 1HD2 ASN 25 7.255 -9.684 -4.419 175 HD22 ASN 25 2HD2 ASN 25 6.939 -10.121 -6.063 176 H SER 26 H SER 26 12.032 -9.069 -2.844 177 HA SER 26 HA SER 26 12.225 -11.785 -3.560 178 HB3 SER 26 2HB SER 26 14.403 -11.161 -2.201 179 HG SER 26 HG SER 26 15.212 -10.011 -3.941 180 H GLU 27 H GLU 27 11.358 -10.097 -0.494 181 HA GLU 27 HA GLU 27 11.794 -12.539 1.078 182 HB3 GLU 27 2HB GLU 27 10.841 -10.847 2.840 183 HG3 GLU 27 2HG GLU 27 13.039 -9.600 2.868 184 H ILE 28 H ILE 28 9.675 -12.000 -1.214 185 HA ILE 28 HA ILE 28 7.487 -13.304 0.258 186 HB ILE 28 HB ILE 28 7.196 -11.170 -1.908 187 HG13 ILE 28 2HG1 ILE 28 7.641 -10.342 0.457 188 HG21 ILE 28 1HG2 ILE 28 5.030 -12.828 -0.519 189 HG22 ILE 28 2HG2 ILE 28 4.729 -11.441 -1.583 190 HG23 ILE 28 3HG2 ILE 28 5.463 -12.863 -2.252 191 HD11 ILE 28 3HD1 ILE 28 6.103 -9.001 -1.055 192 HD12 ILE 28 1HD1 ILE 28 4.748 -9.760 -0.158 193 HD13 ILE 28 2HD1 ILE 28 5.930 -8.778 0.698 194 H LYS 29 H LYS 29 6.268 -14.578 -1.194 195 HA LYS 29 HA LYS 29 7.683 -16.386 -2.913 196 HB3 LYS 29 2HB LYS 29 5.650 -16.701 -1.252 197 HG3 LYS 29 2HG LYS 29 3.825 -16.769 -3.494 198 HD3 LYS 29 2HD LYS 29 3.481 -14.978 -1.063 199 HE3 LYS 29 2HE LYS 29 1.768 -16.547 -3.015 200 HZ1 LYS 29 3HZ LYS 29 0.875 -16.542 -0.721 201 HZ2 LYS 29 1HZ LYS 29 -0.132 -15.822 -1.793 202 HZ3 LYS 29 2HZ LYS 29 0.779 -14.926 -0.754 203 H ASP 30 H ASP 30 5.661 -16.772 -4.783 204 HA ASP 30 HA ASP 30 6.306 -15.131 -6.995 205 HB3 ASP 30 2HB ASP 30 4.309 -17.400 -6.610 206 H SER 31 H SER 31 5.690 -13.434 -5.665 207 HA SER 31 HA SER 31 2.878 -12.484 -6.192 208 HB3 SER 31 2HB SER 31 3.247 -10.868 -4.344 209 HG SER 31 HG SER 31 3.572 -13.626 -4.194 210 H GLU 32 H GLU 32 2.478 -10.632 -7.130 211 HA GLU 32 HA GLU 32 4.435 -9.777 -9.137 212 HB3 GLU 32 2HB GLU 32 2.473 -8.415 -9.921 213 HG3 GLU 32 2HG GLU 32 2.930 -10.784 -10.673 214 H LEU 33 H LEU 33 4.584 -7.372 -9.632 215 HA LEU 33 HA LEU 33 4.962 -5.765 -7.165 216 HB3 LEU 33 2HB LEU 33 7.197 -6.453 -9.101 217 HG LEU 33 HG LEU 33 7.323 -4.164 -7.992 218 HD11 LEU 33 1HD1 LEU 33 6.345 -4.508 -5.838 219 HD12 LEU 33 2HD1 LEU 33 8.069 -4.213 -5.547 220 HD13 LEU 33 3HD1 LEU 33 7.426 -5.863 -5.471 221 HD21 LEU 33 3HD2 LEU 33 9.663 -4.430 -7.260 222 HD22 LEU 33 1HD2 LEU 33 9.330 -5.314 -8.756 223 HD23 LEU 33 2HD2 LEU 33 9.446 -6.192 -7.215 224 H LYS 34 H LYS 34 3.417 -4.315 -7.876 225 HA LYS 34 HA LYS 34 3.547 -3.362 -10.680 226 HB3 LYS 34 2HB LYS 34 1.254 -3.043 -8.785 227 HG3 LYS 34 2HG LYS 34 0.115 -4.305 -10.808 228 HD3 LYS 34 2HD LYS 34 0.567 -1.386 -11.416 229 HE3 LYS 34 2HE LYS 34 -2.052 -1.684 -11.472 230 HZ1 LYS 34 3HZ LYS 34 -1.293 -1.567 -13.632 231 HZ2 LYS 34 1HZ LYS 34 -1.892 -3.075 -13.623 232 HZ3 LYS 34 2HZ LYS 34 -0.281 -2.876 -13.496 233 H GLU 35 H GLU 35 3.251 -1.008 -11.103 234 HA GLU 35 HA GLU 35 3.899 0.683 -8.713 235 HB3 GLU 35 2HB GLU 35 5.777 0.452 -10.274 236 HG3 GLU 35 2HG GLU 35 3.977 1.959 -12.210 237 H VAL 36 H VAL 36 3.044 2.720 -8.444 238 HA VAL 36 HA VAL 36 0.782 3.580 -10.174 239 HB VAL 36 HB VAL 36 1.187 4.198 -7.212 240 HG11 VAL 36 1HG1 VAL 36 -1.222 4.476 -9.060 241 HG12 VAL 36 2HG1 VAL 36 -1.230 4.794 -7.312 242 HG13 VAL 36 3HG1 VAL 36 -0.260 5.807 -8.360 243 HG21 VAL 36 3HG2 VAL 36 -0.783 2.617 -6.839 244 HG22 VAL 36 1HG2 VAL 36 -0.473 1.978 -8.460 245 HG23 VAL 36 2HG2 VAL 36 0.765 1.857 -7.188 246 H LYS 37 H LYS 37 0.742 5.965 -10.447 247 HA LYS 37 HA LYS 37 2.998 7.520 -9.375 248 HB3 LYS 37 2HB LYS 37 3.299 8.785 -11.402 249 HG3 LYS 37 2HG LYS 37 4.646 6.588 -11.191 250 HD3 LYS 37 2HD LYS 37 2.581 5.901 -13.329 251 HE3 LYS 37 2HE LYS 37 5.377 4.746 -13.103 252 HZ1 LYS 37 3HZ LYS 37 3.457 4.218 -15.268 253 HZ2 LYS 37 1HZ LYS 37 3.316 3.393 -13.880 254 HZ3 LYS 37 2HZ LYS 37 4.737 3.288 -14.699 255 H VAL 38 H VAL 38 2.313 9.989 -9.742 256 HA VAL 38 HA VAL 38 -0.638 10.243 -9.485 257 HB VAL 38 HB VAL 38 -0.326 12.170 -8.044 258 HG11 VAL 38 1HG1 VAL 38 1.036 9.719 -6.871 259 HG12 VAL 38 2HG1 VAL 38 0.154 10.993 -6.001 260 HG13 VAL 38 3HG1 VAL 38 -0.717 9.910 -7.095 261 HG21 VAL 38 3HG2 VAL 38 1.973 12.878 -8.646 262 HG22 VAL 38 1HG2 VAL 38 1.785 12.661 -6.906 263 HG23 VAL 38 2HG2 VAL 38 2.620 11.423 -7.862 264 H SER 39 H SER 39 -0.583 13.183 -9.801 265 HA SER 39 HA SER 39 -0.369 13.368 -12.662 266 HB3 SER 39 2HB SER 39 -0.643 15.851 -11.451 267 HG SER 39 HG SER 39 -2.394 15.711 -12.544 268 H GLU 40 H GLU 40 0.786 15.595 -13.267 269 HA GLU 40 HA GLU 40 3.588 15.457 -12.281 270 HB3 GLU 40 2HB GLU 40 3.815 17.396 -13.974 271 HG3 GLU 40 2HG GLU 40 3.075 14.638 -15.039 272 H GLY 41 H GLY 41 4.490 16.894 -10.985 273 HA2 GLY 41 1HA GLY 41 4.838 18.738 -9.734 274 HA3 GLY 41 2HA GLY 41 3.627 19.549 -10.733 275 H THR 42 H THR 42 2.487 16.744 -9.042 276 HA THR 42 HA THR 42 0.458 18.065 -7.697 277 HB THR 42 HB THR 42 1.770 15.371 -7.105 278 HG1 THR 42 1HG THR 42 -0.014 16.284 -9.075 279 HG21 THR 42 3HG2 THR 42 -1.152 16.173 -6.836 280 HG22 THR 42 1HG2 THR 42 -0.033 15.975 -5.476 281 HG23 THR 42 2HG2 THR 42 -0.420 14.581 -6.494 282 H PHE 43 H PHE 43 3.755 17.603 -6.648 283 HA PHE 43 HA PHE 43 3.281 19.433 -4.467 284 HB3 PHE 43 2HB PHE 43 4.689 18.170 -2.832 285 HD1 PHE 43 2HD PHE 43 2.350 18.785 -1.880 286 HD2 PHE 43 1HD PHE 43 3.049 15.220 -4.190 287 HE1 PHE 43 2HE PHE 43 0.123 17.895 -1.231 288 HE2 PHE 43 1HE PHE 43 0.833 14.357 -3.543 289 HZ PHE 43 HZ PHE 43 -0.637 15.690 -2.031 290 H ASP 44 H ASP 44 5.896 19.808 -3.646 291 HA ASP 44 HA ASP 44 7.585 19.747 -6.032 292 HB3 ASP 44 2HB ASP 44 7.692 22.355 -4.631 293 H ALA 45 H ALA 45 9.793 20.974 -5.160 294 HA ALA 45 HA ALA 45 10.662 19.001 -3.222 295 HB1 ALA 45 1HB ALA 45 12.178 21.259 -4.575 296 HB2 ALA 45 2HB ALA 45 12.900 19.900 -3.691 297 HB3 ALA 45 3HB ALA 45 12.011 19.596 -5.199 298 H ASP 46 H ASP 46 9.512 22.248 -2.837 299 HA ASP 46 HA ASP 46 11.569 22.873 -0.835 300 HB3 ASP 46 2HB ASP 46 9.422 24.895 -1.199 301 H MET 47 H MET 47 11.218 23.702 1.204 302 HA MET 47 HA MET 47 9.494 22.161 2.871 303 HB3 MET 47 2HB MET 47 11.658 23.040 3.580 304 HG3 MET 47 2HG MET 47 10.414 25.751 4.047 305 HE1 MET 47 3HE MET 47 13.998 23.711 3.667 306 HE2 MET 47 1HE MET 47 13.492 24.741 2.321 307 HE3 MET 47 2HE MET 47 14.863 25.237 3.336 308 H TYR 48 H TYR 48 9.364 25.712 2.186 309 HA TYR 48 HA TYR 48 6.916 26.013 3.615 310 HB3 TYR 48 2HB TYR 48 8.313 27.851 3.578 311 HD1 TYR 48 1HD TYR 48 7.342 28.379 -0.005 312 HD2 TYR 48 2HD TYR 48 10.559 27.787 2.807 313 HE1 TYR 48 1HE TYR 48 8.990 28.913 -1.775 314 HE2 TYR 48 2HE TYR 48 12.210 28.281 1.012 315 HH TYR 48 HH TYR 48 11.319 28.885 -2.338 316 H LYS 49 H LYS 49 7.628 25.605 0.132 317 HA LYS 49 HA LYS 49 4.984 26.207 -0.715 318 HB3 LYS 49 2HB LYS 49 6.905 24.282 -2.105 319 HG3 LYS 49 2HG LYS 49 4.531 24.666 -3.017 320 HD3 LYS 49 2HD LYS 49 5.728 27.387 -3.697 321 HE3 LYS 49 2HE LYS 49 3.032 26.140 -4.398 322 HZ1 LYS 49 3HZ LYS 49 2.707 28.043 -5.686 323 HZ2 LYS 49 1HZ LYS 49 4.246 28.566 -5.540 324 HZ3 LYS 49 2HZ LYS 49 3.233 28.626 -4.232 325 H THR 50 H THR 50 6.492 22.960 -0.068 326 HA THR 50 HA THR 50 4.077 21.557 -0.556 327 HB THR 50 HB THR 50 5.193 19.695 0.628 328 HG1 THR 50 1HG THR 50 7.453 21.366 0.934 329 HG21 THR 50 3HG2 THR 50 5.681 19.919 -1.678 330 HG22 THR 50 1HG2 THR 50 7.244 19.702 -0.866 331 HG23 THR 50 2HG2 THR 50 6.784 21.293 -1.435 332 H SER 51 H SER 51 5.235 23.158 2.366 333 HA SER 51 HA SER 51 3.375 22.141 4.231 334 HB3 SER 51 2HB SER 51 4.540 24.942 4.119 335 HG SER 51 HG SER 51 3.202 24.662 5.905 336 H ASP 52 H ASP 52 2.803 24.212 1.467 337 HA ASP 52 HA ASP 52 0.226 25.188 2.569 338 HB3 ASP 52 2HB ASP 52 1.550 25.703 -0.151 339 H ILE 53 H ILE 53 1.553 23.387 -0.218 340 HA ILE 53 HA ILE 53 -0.868 22.874 -1.505 341 HB ILE 53 HB ILE 53 1.678 21.195 -1.558 342 HG13 ILE 53 2HG1 ILE 53 1.847 23.725 -2.230 343 HG21 ILE 53 1HG2 ILE 53 -0.708 21.353 -3.453 344 HG22 ILE 53 2HG2 ILE 53 0.804 20.520 -3.854 345 HG23 ILE 53 3HG2 ILE 53 -0.192 19.937 -2.530 346 HD11 ILE 53 3HD1 ILE 53 3.284 23.236 -4.157 347 HD12 ILE 53 1HD1 ILE 53 3.595 22.091 -2.828 348 HD13 ILE 53 2HD1 ILE 53 2.657 21.599 -4.257 349 H ALA 54 H ALA 54 0.949 20.583 0.663 350 HA ALA 54 HA ALA 54 -1.165 18.612 0.369 351 HB1 ALA 54 1HB ALA 54 0.102 17.320 1.994 352 HB2 ALA 54 2HB ALA 54 1.243 18.068 0.864 353 HB3 ALA 54 3HB ALA 54 1.009 18.785 2.471 354 H LEU 55 H LEU 55 -0.668 21.339 2.508 355 HA LEU 55 HA LEU 55 -2.458 20.565 4.596 356 HB3 LEU 55 2HB LEU 55 -2.110 23.449 3.768 357 HG LEU 55 HG LEU 55 -1.360 22.351 6.413 358 HD11 LEU 55 1HD1 LEU 55 -2.888 24.865 5.628 359 HD12 LEU 55 2HD1 LEU 55 -1.122 24.766 5.859 360 HD13 LEU 55 3HD1 LEU 55 -2.216 24.492 7.236 361 HD21 LEU 55 3HD2 LEU 55 -4.251 22.817 5.645 362 HD22 LEU 55 1HD2 LEU 55 -3.659 22.670 7.332 363 HD23 LEU 55 2HD2 LEU 55 -3.545 21.299 6.260 364 H ASP 56 H ASP 56 -2.688 22.341 1.566 365 HA ASP 56 HA ASP 56 -5.316 23.247 1.675 366 HB3 ASP 56 2HB ASP 56 -4.501 22.258 -1.015 367 H GLN 57 H GLN 57 -4.041 20.126 0.703 368 HA GLN 57 HA GLN 57 -6.644 18.866 0.206 369 HB3 GLN 57 2HB GLN 57 -5.339 16.987 -0.595 370 HG3 GLN 57 2HG GLN 57 -4.105 19.627 -1.534 371 HE21 GLN 57 1HE2 GLN 57 -5.001 17.223 -3.810 372 HE22 GLN 57 2HE2 GLN 57 -3.355 16.791 -4.270 373 H ILE 58 H ILE 58 -5.614 19.771 2.984 374 HA ILE 58 HA ILE 58 -6.425 17.308 4.459 375 HB ILE 58 HB ILE 58 -4.336 19.396 5.122 376 HG13 ILE 58 2HG1 ILE 58 -3.845 17.162 3.977 377 HG21 ILE 58 1HG2 ILE 58 -5.629 17.638 7.234 378 HG22 ILE 58 2HG2 ILE 58 -4.178 18.624 7.441 379 HG23 ILE 58 3HG2 ILE 58 -5.711 19.406 7.131 380 HD11 ILE 58 3HD1 ILE 58 -2.071 18.545 5.196 381 HD12 ILE 58 1HD1 ILE 58 -2.374 17.522 6.613 382 HD13 ILE 58 2HD1 ILE 58 -1.759 16.805 5.113 383 H GLN 59 H GLN 59 -6.249 20.903 4.569 384 HA GLN 59 HA GLN 59 -8.515 21.095 6.320 385 HB3 GLN 59 2HB GLN 59 -8.299 23.625 5.469 386 HG3 GLN 59 2HG GLN 59 -5.970 22.353 6.973 387 HE21 GLN 59 1HE2 GLN 59 -4.758 24.380 6.718 388 HE22 GLN 59 2HE2 GLN 59 -5.251 25.726 7.725 389 H GLY 60 H GLY 60 -8.404 20.435 2.968 390 HA2 GLY 60 1HA GLY 60 -10.255 19.816 1.719 391 HA3 GLY 60 2HA GLY 60 -11.327 20.563 2.911 392 H ASN 61 H ASN 61 -8.634 22.370 1.623 393 HA ASN 61 HA ASN 61 -10.351 24.372 0.310 394 HB3 ASN 61 2HB ASN 61 -8.140 25.314 -0.404 395 HD21 ASN 61 1HD2 ASN 61 -6.097 25.461 1.594 396 HD22 ASN 61 2HD2 ASN 61 -6.839 26.060 3.058 397 H LYS 62 H LYS 62 -7.868 21.968 -0.563 398 HA LYS 62 HA LYS 62 -9.050 21.694 -3.271 399 HB3 LYS 62 2HB LYS 62 -6.458 20.656 -3.435 400 HG3 LYS 62 2HG LYS 62 -5.834 22.850 -4.435 401 HD3 LYS 62 2HD LYS 62 -8.637 22.118 -5.330 402 HE3 LYS 62 2HE LYS 62 -7.309 24.028 -6.428 403 HZ1 LYS 62 3HZ LYS 62 -5.952 21.707 -7.683 404 HZ2 LYS 62 1HZ LYS 62 -5.194 22.822 -6.747 405 HZ3 LYS 62 2HZ LYS 62 -5.880 23.260 -8.185 406 H ASP 63 H ASP 63 -7.971 19.325 -4.049 407 HA ASP 63 HA ASP 63 -9.470 17.455 -2.299 408 HB3 ASP 63 2HB ASP 63 -9.694 17.718 -5.318 409 H PHE 64 H PHE 64 -9.108 15.121 -3.250 410 HA PHE 64 HA PHE 64 -6.340 14.713 -2.747 411 HB3 PHE 64 2HB PHE 64 -7.866 13.144 -1.957 412 HD1 PHE 64 1HD PHE 64 -8.083 12.226 -5.609 413 HD2 PHE 64 2HD PHE 64 -10.184 12.860 -1.905 414 HE1 PHE 64 1HE PHE 64 -10.248 11.502 -6.659 415 HE2 PHE 64 2HE PHE 64 -12.302 12.189 -2.967 416 HZ PHE 64 HZ PHE 64 -12.327 11.516 -5.363 417 HA PRO 65 HA PRO 65 -4.608 14.643 -6.844 418 HB3 PRO 65 2HB PRO 65 -2.599 14.612 -5.718 419 HG3 PRO 65 2HG PRO 65 -2.174 13.151 -3.867 420 HD3 PRO 65 2HD PRO 65 -4.040 14.489 -3.314 421 H GLU 66 H GLU 66 -4.636 13.412 -8.825 422 HA GLU 66 HA GLU 66 -6.070 10.901 -8.795 423 HB3 GLU 66 2HB GLU 66 -6.295 12.601 -10.614 424 HG3 GLU 66 2HG GLU 66 -3.539 11.562 -11.416 425 H ILE 67 H ILE 67 -5.014 9.152 -10.455 426 HA ILE 67 HA ILE 67 -2.209 8.740 -9.809 427 HB ILE 67 HB ILE 67 -2.568 6.305 -9.509 428 HG13 ILE 67 2HG1 ILE 67 -4.735 6.028 -10.609 429 HG21 ILE 67 1HG2 ILE 67 -4.073 7.874 -7.410 430 HG22 ILE 67 2HG2 ILE 67 -3.157 6.374 -7.173 431 HG23 ILE 67 3HG2 ILE 67 -2.297 7.859 -7.580 432 HD11 ILE 67 3HD1 ILE 67 -4.025 4.380 -8.793 433 HD12 ILE 67 1HD1 ILE 67 -5.151 5.237 -7.710 434 HD13 ILE 67 2HD1 ILE 67 -5.757 4.445 -9.175 435 H GLN 68 H GLN 68 -1.187 7.278 -11.264 436 HA GLN 68 HA GLN 68 -2.447 7.088 -13.947 437 HB3 GLN 68 2HB GLN 68 -0.350 7.278 -14.923 438 HG3 GLN 68 2HG GLN 68 0.761 9.255 -13.842 439 HE21 GLN 68 1HE2 GLN 68 -0.824 11.306 -12.791 440 HE22 GLN 68 2HE2 GLN 68 -2.253 11.590 -13.770 441 H LEU 69 H LEU 69 -3.477 5.510 -13.313 442 HA LEU 69 HA LEU 69 -2.257 2.853 -13.305 443 HB3 LEU 69 2HB LEU 69 -4.381 3.250 -11.191 444 HG LEU 69 HG LEU 69 -3.517 0.908 -11.670 445 HD11 LEU 69 1HD1 LEU 69 -1.161 0.452 -10.774 446 HD12 LEU 69 2HD1 LEU 69 -0.888 2.203 -10.886 447 HD13 LEU 69 3HD1 LEU 69 -1.247 1.256 -12.345 448 HD21 LEU 69 3HD2 LEU 69 -3.061 0.340 -9.336 449 HD22 LEU 69 1HD2 LEU 69 -4.382 1.500 -9.461 450 HD23 LEU 69 2HD2 LEU 69 -2.760 2.059 -8.960 451 H ASP 70 H ASP 70 -4.465 1.202 -13.010 452 HA ASP 70 HA ASP 70 -6.597 2.174 -14.781 453 HB3 ASP 70 2HB ASP 70 -6.506 -0.093 -15.849 454 H ASN 71 H ASN 71 -8.457 0.751 -14.467 455 HA ASN 71 HA ASN 71 -8.872 0.122 -11.711 456 HB3 ASN 71 2HB ASN 71 -10.683 -0.758 -14.000 457 HD21 ASN 71 1HD2 ASN 71 -12.218 -1.926 -12.825 458 HD22 ASN 71 2HD2 ASN 71 -12.939 -1.443 -11.335 459 H ILE 72 H ILE 72 -8.795 -1.836 -10.597 460 HA ILE 72 HA ILE 72 -8.575 -4.396 -12.070 461 HB ILE 72 HB ILE 72 -6.629 -3.308 -9.969 462 HG13 ILE 72 2HG1 ILE 72 -6.210 -2.545 -12.338 463 HG21 ILE 72 1HG2 ILE 72 -7.044 -5.653 -9.472 464 HG22 ILE 72 2HG2 ILE 72 -6.846 -6.103 -11.176 465 HG23 ILE 72 3HG2 ILE 72 -5.459 -5.535 -10.203 466 HD11 ILE 72 3HD1 ILE 72 -4.008 -4.407 -11.478 467 HD12 ILE 72 1HD1 ILE 72 -3.939 -2.923 -12.448 468 HD13 ILE 72 2HD1 ILE 72 -4.336 -2.818 -10.725 469 H ASP 73 H ASP 73 -9.557 -6.089 -10.906 470 HA ASP 73 HA ASP 73 -11.022 -5.255 -8.511 471 HB3 ASP 73 2HB ASP 73 -11.259 -8.103 -9.151 472 H TYR 74 H TYR 74 -9.717 -5.033 -6.796 473 HA TYR 74 HA TYR 74 -7.480 -6.758 -6.293 474 HB3 TYR 74 2HB TYR 74 -7.339 -5.570 -4.187 475 HD1 TYR 74 2HD TYR 74 -5.751 -5.034 -6.424 476 HD2 TYR 74 1HD TYR 74 -9.157 -2.805 -5.045 477 HE1 TYR 74 2HE TYR 74 -4.957 -3.030 -7.671 478 HE2 TYR 74 1HE TYR 74 -8.276 -0.754 -6.029 479 HH TYR 74 HH TYR 74 -6.937 -0.520 -8.380 480 H ASN 75 H ASN 75 -10.860 -7.188 -5.767 481 HA ASN 75 HA ASN 75 -10.805 -8.707 -3.366 482 HB3 ASN 75 2HB ASN 75 -12.992 -9.239 -5.315 483 HD21 ASN 75 1HD2 ASN 75 -13.836 -6.800 -3.148 484 HD22 ASN 75 2HD2 ASN 75 -14.264 -7.734 -1.762 485 H ASN 76 H ASN 76 -9.166 -9.592 -5.947 486 HA ASN 76 HA ASN 76 -9.763 -12.503 -5.949 487 HB3 ASN 76 2HB ASN 76 -8.039 -12.520 -7.744 488 HD21 ASN 76 1HD2 ASN 76 -9.248 -9.466 -8.809 489 HD22 ASN 76 2HD2 ASN 76 -10.428 -10.140 -9.883 490 H TYR 77 H TYR 77 -7.936 -10.348 -4.051 491 HA TYR 77 HA TYR 77 -5.532 -12.102 -3.923 492 HB3 TYR 77 2HB TYR 77 -4.294 -10.041 -3.462 493 HD1 TYR 77 1HD TYR 77 -6.670 -8.857 -6.049 494 HD2 TYR 77 2HD TYR 77 -3.044 -11.054 -5.329 495 HE1 TYR 77 1HE TYR 77 -6.147 -8.711 -8.447 496 HE2 TYR 77 2HE TYR 77 -2.473 -10.904 -7.721 497 HH TYR 77 HH TYR 77 -4.423 -9.025 -10.076 498 H ASP 78 H ASP 78 -5.031 -12.910 -1.998 499 HA ASP 78 HA ASP 78 -6.920 -12.427 0.188 500 HB3 ASP 78 2HB ASP 78 -4.461 -14.203 0.311 501 H LEU 79 H LEU 79 -3.698 -11.470 -0.623 502 HA LEU 79 HA LEU 79 -3.552 -9.668 1.741 503 HB3 LEU 79 2HB LEU 79 -1.026 -10.792 0.560 504 HG LEU 79 HG LEU 79 -1.728 -10.665 3.506 505 HD11 LEU 79 1HD1 LEU 79 0.706 -10.580 3.749 506 HD12 LEU 79 2HD1 LEU 79 0.927 -10.662 2.008 507 HD13 LEU 79 3HD1 LEU 79 0.198 -12.037 2.882 508 HD21 LEU 79 3HD2 LEU 79 -0.376 -8.544 3.648 509 HD22 LEU 79 1HD2 LEU 79 -1.934 -8.340 2.865 510 HD23 LEU 79 2HD2 LEU 79 -0.455 -8.437 1.878 511 H ILE 80 H ILE 80 -2.776 -7.553 1.159 512 HA ILE 80 HA ILE 80 -1.524 -7.187 -1.508 513 HB ILE 80 HB ILE 80 -3.819 -5.531 -0.391 514 HG13 ILE 80 2HG1 ILE 80 -4.518 -7.594 -1.537 515 HG21 ILE 80 1HG2 ILE 80 -3.538 -4.065 -2.330 516 HG22 ILE 80 2HG2 ILE 80 -2.039 -4.079 -1.429 517 HG23 ILE 80 3HG2 ILE 80 -2.161 -5.041 -2.914 518 HD11 ILE 80 3HD1 ILE 80 -5.844 -5.529 -2.033 519 HD12 ILE 80 1HD1 ILE 80 -4.920 -5.387 -3.556 520 HD13 ILE 80 2HD1 ILE 80 -5.898 -6.830 -3.246 521 H LEU 81 H LEU 81 0.338 -6.026 -1.319 522 HA LEU 81 HA LEU 81 0.870 -4.546 1.203 523 HB3 LEU 81 2HB LEU 81 3.202 -4.723 0.289 524 HG LEU 81 HG LEU 81 3.718 -6.854 0.924 525 HD11 LEU 81 1HD1 LEU 81 2.304 -5.679 2.686 526 HD12 LEU 81 2HD1 LEU 81 2.473 -7.437 2.876 527 HD13 LEU 81 3HD1 LEU 81 0.975 -6.729 2.229 528 HD21 LEU 81 3HD2 LEU 81 2.576 -8.123 -0.808 529 HD22 LEU 81 1HD2 LEU 81 1.039 -7.979 0.065 530 HD23 LEU 81 2HD2 LEU 81 2.398 -8.869 0.781 531 H ILE 82 H ILE 82 1.370 -2.331 1.144 532 HA ILE 82 HA ILE 82 1.543 -1.053 -1.525 533 HB ILE 82 HB ILE 82 -0.112 -0.290 0.900 534 HG13 ILE 82 2HG1 ILE 82 -0.685 -1.447 -1.751 535 HG21 ILE 82 1HG2 ILE 82 0.926 1.787 0.258 536 HG22 ILE 82 2HG2 ILE 82 0.521 1.499 -1.459 537 HG23 ILE 82 3HG2 ILE 82 -0.757 1.776 -0.251 538 HD11 ILE 82 3HD1 ILE 82 -2.492 -0.789 0.603 539 HD12 ILE 82 1HD1 ILE 82 -2.891 -1.847 -0.766 540 HD13 ILE 82 2HD1 ILE 82 -1.604 -2.319 0.370 541 H GLY 83 H GLY 83 2.851 0.801 -1.683 542 HA2 GLY 83 1HA GLY 83 4.790 1.278 0.536 543 HA3 GLY 83 2HA GLY 83 5.290 0.945 -1.101 544 H SER 84 H SER 84 5.371 3.605 0.756 545 HA SER 84 HA SER 84 4.865 5.362 -1.498 546 HB3 SER 84 2HB SER 84 2.715 5.676 -1.018 547 HG SER 84 HG SER 84 3.177 4.602 1.556 548 HA PRO 85 HA PRO 85 7.867 7.823 0.745 549 HB3 PRO 85 2HB PRO 85 8.011 8.890 -1.333 550 HG3 PRO 85 2HG PRO 85 6.055 9.632 -2.530 551 HD3 PRO 85 2HD PRO 85 5.980 7.301 -2.270 552 H VAL 86 H VAL 86 8.162 9.643 2.295 553 HA VAL 86 HA VAL 86 5.664 10.755 3.461 554 HB VAL 86 HB VAL 86 8.093 9.800 5.014 555 HG11 VAL 86 1HG1 VAL 86 6.817 10.462 7.007 556 HG12 VAL 86 2HG1 VAL 86 7.080 11.849 5.948 557 HG13 VAL 86 3HG1 VAL 86 5.496 11.079 5.977 558 HG21 VAL 86 3HG2 VAL 86 6.497 8.225 6.051 559 HG22 VAL 86 1HG2 VAL 86 5.206 8.806 4.967 560 HG23 VAL 86 2HG2 VAL 86 6.645 7.991 4.304 561 H TRP 87 H TRP 87 5.671 12.929 3.156 562 HA TRP 87 HA TRP 87 8.078 14.435 2.639 563 HB3 TRP 87 2HB TRP 87 5.578 15.967 3.027 564 HD1 TRP 87 HD TRP 87 7.735 17.639 1.884 565 HE1 TRP 87 1HE TRP 87 8.241 18.119 -0.629 566 HE3 TRP 87 3HE TRP 87 4.959 13.981 -0.385 567 HZ2 TRP 87 2HZ TRP 87 7.941 16.898 -3.093 568 HZ3 TRP 87 3HZ TRP 87 5.113 13.662 -2.864 569 HH2 TRP 87 HH TRP 87 6.620 15.065 -4.215 570 H SER 88 H SER 88 7.451 16.865 3.947 571 HA SER 88 HA SER 88 8.527 16.473 6.536 572 HB3 SER 88 2HB SER 88 8.282 18.874 6.728 573 HG SER 88 HG SER 88 9.398 19.463 4.938 574 H GLY 89 H GLY 89 7.016 14.957 7.349 575 HA2 GLY 89 1HA GLY 89 5.815 14.881 9.434 576 HA3 GLY 89 2HA GLY 89 4.792 16.210 8.941 577 H TYR 90 H TYR 90 4.205 15.179 6.154 578 HA TYR 90 HA TYR 90 2.698 12.738 6.885 579 HB3 TYR 90 2HB TYR 90 1.086 14.329 7.236 580 HD1 TYR 90 1HD TYR 90 2.594 15.533 3.938 581 HD2 TYR 90 2HD TYR 90 0.577 16.558 7.635 582 HE1 TYR 90 1HE TYR 90 2.857 17.884 3.418 583 HE2 TYR 90 2HE TYR 90 0.774 18.930 7.074 584 HH TYR 90 HH TYR 90 1.725 20.445 5.688 585 HA PRO 91 HA PRO 91 3.762 11.453 2.774 586 HB3 PRO 91 2HB PRO 91 2.772 9.440 3.138 587 HG3 PRO 91 2HG PRO 91 0.847 9.255 4.496 588 HD3 PRO 91 2HD PRO 91 2.335 10.581 5.785 589 H ALA 92 H ALA 92 3.096 11.554 0.484 590 HA ALA 92 HA ALA 92 2.006 13.974 -0.493 591 HB1 ALA 92 1HB ALA 92 2.475 12.920 -2.643 592 HB2 ALA 92 2HB ALA 92 3.743 12.424 -1.527 593 HB3 ALA 92 3HB ALA 92 2.437 11.305 -1.935 594 H THR 93 H THR 93 0.020 12.177 1.102 595 HA THR 93 HA THR 93 -1.839 10.855 0.947 596 HB THR 93 HB THR 93 -3.751 12.080 -0.108 597 HG1 THR 93 1HG THR 93 -1.924 13.123 -1.629 598 HG21 THR 93 3HG2 THR 93 -1.895 13.984 1.378 599 HG22 THR 93 1HG2 THR 93 -2.918 12.760 2.184 600 HG23 THR 93 2HG2 THR 93 -3.655 14.089 1.281 601 HA PRO 94 HA PRO 94 -1.030 9.484 -3.444 602 HB3 PRO 94 2HB PRO 94 1.346 9.451 -3.148 603 HG3 PRO 94 2HG PRO 94 2.313 8.414 -1.192 604 HD3 PRO 94 2HD PRO 94 1.018 10.153 -0.433 605 H ILE 95 H ILE 95 -1.880 7.576 -0.714 606 HA ILE 95 HA ILE 95 -2.804 5.405 -2.526 607 HB ILE 95 HB ILE 95 -2.790 5.333 0.507 608 HG13 ILE 95 2HG1 ILE 95 -0.717 4.041 0.437 609 HG21 ILE 95 1HG2 ILE 95 -2.753 2.869 0.068 610 HG22 ILE 95 2HG2 ILE 95 -4.206 3.663 -0.516 611 HG23 ILE 95 3HG2 ILE 95 -2.929 3.202 -1.658 612 HD11 ILE 95 3HD1 ILE 95 0.843 4.109 -1.378 613 HD12 ILE 95 1HD1 ILE 95 -0.673 3.494 -2.064 614 HD13 ILE 95 2HD1 ILE 95 -0.182 5.171 -2.346 615 H LYS 96 H LYS 96 -3.899 8.380 -1.395 616 HA LYS 96 HA LYS 96 -6.368 7.883 -0.225 617 HB3 LYS 96 2HB LYS 96 -5.399 10.162 -2.002 618 HG3 LYS 96 2HG LYS 96 -7.779 10.431 -1.633 619 HD3 LYS 96 2HD LYS 96 -7.193 9.609 1.124 620 HE3 LYS 96 2HE LYS 96 -7.243 12.098 1.477 621 HZ1 LYS 96 3HZ LYS 96 -8.985 12.711 -0.118 622 HZ2 LYS 96 1HZ LYS 96 -9.370 13.176 1.386 623 HZ3 LYS 96 2HZ LYS 96 -10.100 11.845 0.773 624 H THR 97 H THR 97 -5.608 8.319 -3.743 625 HA THR 97 HA THR 97 -8.423 7.977 -4.465 626 HB THR 97 HB THR 97 -5.847 8.274 -6.050 627 HG1 THR 97 1HG THR 97 -6.412 10.375 -5.987 628 HG21 THR 97 3HG2 THR 97 -7.502 7.168 -7.518 629 HG22 THR 97 1HG2 THR 97 -7.226 8.848 -7.991 630 HG23 THR 97 2HG2 THR 97 -8.704 8.413 -7.098 631 H LEU 98 H LEU 98 -5.601 5.871 -4.131 632 HA LEU 98 HA LEU 98 -6.750 3.630 -5.607 633 HB3 LEU 98 2HB LEU 98 -4.652 3.582 -3.380 634 HG LEU 98 HG LEU 98 -5.470 1.353 -4.418 635 HD11 LEU 98 1HD1 LEU 98 -4.396 0.816 -6.620 636 HD12 LEU 98 2HD1 LEU 98 -3.929 2.518 -6.792 637 HD13 LEU 98 3HD1 LEU 98 -5.645 2.046 -6.771 638 HD21 LEU 98 3HD2 LEU 98 -3.375 1.498 -3.178 639 HD22 LEU 98 1HD2 LEU 98 -2.527 2.132 -4.608 640 HD23 LEU 98 2HD2 LEU 98 -3.158 0.468 -4.591 641 H LEU 99 H LEU 99 -6.802 4.608 -2.087 642 HA LEU 99 HA LEU 99 -7.802 2.174 -1.112 643 HB3 LEU 99 2HB LEU 99 -6.798 4.341 -0.019 644 HG LEU 99 HG LEU 99 -9.272 5.473 -0.419 645 HD11 LEU 99 1HD1 LEU 99 -10.253 3.527 0.835 646 HD12 LEU 99 2HD1 LEU 99 -10.672 5.128 1.506 647 HD13 LEU 99 3HD1 LEU 99 -9.427 4.111 2.288 648 HD21 LEU 99 3HD2 LEU 99 -8.616 6.405 2.138 649 HD22 LEU 99 1HD2 LEU 99 -8.264 7.111 0.578 650 HD23 LEU 99 2HD2 LEU 99 -7.070 6.029 1.306 651 H ASP 100 H ASP 100 -9.456 4.942 -2.588 652 HA ASP 100 HA ASP 100 -12.102 4.285 -1.867 653 HB3 ASP 100 2HB ASP 100 -11.498 5.552 -4.517 654 H GLN 101 H GLN 101 -10.089 3.307 -4.570 655 HA GLN 101 HA GLN 101 -12.121 1.672 -5.856 656 HB3 GLN 101 2HB GLN 101 -10.898 2.964 -7.258 657 HG3 GLN 101 2HG GLN 101 -8.442 1.608 -6.382 658 HE21 GLN 101 1HE2 GLN 101 -8.516 4.955 -7.315 659 HE22 GLN 101 2HE2 GLN 101 -8.009 4.774 -8.997 660 H MET 102 H MET 102 -10.371 1.084 -3.124 661 HA MET 102 HA MET 102 -10.726 -1.824 -3.578 662 HB3 MET 102 2HB MET 102 -8.335 -1.366 -3.635 663 HG3 MET 102 2HG MET 102 -8.703 -0.216 -0.959 664 HE1 MET 102 3HE MET 102 -5.375 -2.716 -0.632 665 HE2 MET 102 1HE MET 102 -7.091 -2.630 -0.187 666 HE3 MET 102 2HE MET 102 -6.618 -3.031 -1.853 667 H LYS 103 H LYS 103 -12.303 0.603 -2.084 668 HA LYS 103 HA LYS 103 -12.460 0.057 0.583 669 HB3 LYS 103 2HB LYS 103 -15.115 0.368 -0.626 670 HG3 LYS 103 2HG LYS 103 -14.386 1.171 1.651 671 HD3 LYS 103 2HD LYS 103 -12.882 3.099 -0.102 672 HE3 LYS 103 2HE LYS 103 -14.622 4.454 1.046 673 HZ1 LYS 103 3HZ LYS 103 -13.223 3.725 3.545 674 HZ2 LYS 103 1HZ LYS 103 -14.782 3.291 3.154 675 HZ3 LYS 103 2HZ LYS 103 -14.384 4.848 3.358 676 H ASN 104 H ASN 104 -13.927 -1.772 -1.933 677 HA ASN 104 HA ASN 104 -15.565 -3.451 -0.210 678 HB3 ASN 104 2HB ASN 104 -16.251 -2.959 -2.528 679 HD21 ASN 104 1HD2 ASN 104 -14.589 -1.984 -4.060 680 HD22 ASN 104 2HD2 ASN 104 -13.836 -3.142 -5.138 681 H TYR 105 H TYR 105 -12.255 -3.480 -0.492 682 HA TYR 105 HA TYR 105 -11.722 -6.256 -0.927 683 HB3 TYR 105 2HB TYR 105 -10.100 -4.008 0.340 684 HD1 TYR 105 2HD TYR 105 -9.397 -6.580 -2.249 685 HD2 TYR 105 1HD TYR 105 -8.454 -5.057 1.670 686 HE1 TYR 105 2HE TYR 105 -7.599 -8.257 -2.038 687 HE2 TYR 105 1HE TYR 105 -6.609 -6.736 1.860 688 HH TYR 105 HH TYR 105 -6.325 -9.369 -0.467 689 H ARG 106 H ARG 106 -11.208 -7.838 0.478 690 HA ARG 106 HA ARG 106 -12.039 -7.611 3.341 691 HB3 ARG 106 2HB ARG 106 -13.083 -9.917 2.829 692 HG3 ARG 106 2HG ARG 106 -14.920 -8.957 1.276 693 HD3 ARG 106 2HD ARG 106 -14.890 -7.300 3.765 694 HE ARG 106 HE ARG 106 -16.845 -9.437 3.207 695 HH11 ARG 106 1HH1 ARG 106 -16.145 -5.994 2.709 696 HH12 ARG 106 2HH1 ARG 106 -17.725 -5.599 2.169 697 HH21 ARG 106 1HH2 ARG 106 -18.852 -9.021 2.467 698 HH22 ARG 106 2HH2 ARG 106 -19.412 -7.421 2.123 699 H GLY 107 H GLY 107 -9.279 -7.952 1.761 700 HA2 GLY 107 1HA GLY 107 -8.323 -10.369 3.246 701 HA3 GLY 107 2HA GLY 107 -7.562 -9.681 1.821 702 H GLU 108 H GLU 108 -5.631 -9.621 3.188 703 HA GLU 108 HA GLU 108 -5.517 -7.682 5.442 704 HB3 GLU 108 2HB GLU 108 -3.187 -8.543 5.614 705 HG3 GLU 108 2HG GLU 108 -5.242 -10.793 5.537 706 H VAL 109 H VAL 109 -4.386 -5.708 5.341 707 HA VAL 109 HA VAL 109 -2.975 -5.109 2.816 708 HB VAL 109 HB VAL 109 -4.805 -3.137 4.225 709 HG11 VAL 109 1HG1 VAL 109 -4.584 -1.884 2.117 710 HG12 VAL 109 2HG1 VAL 109 -2.982 -2.197 2.788 711 HG13 VAL 109 3HG1 VAL 109 -3.576 -3.186 1.439 712 HG21 VAL 109 3HG2 VAL 109 -5.413 -4.827 1.775 713 HG22 VAL 109 1HG2 VAL 109 -6.284 -4.869 3.330 714 HG23 VAL 109 2HG2 VAL 109 -6.370 -3.428 2.314 715 H ALA 110 H ALA 110 -0.961 -4.175 3.183 716 HA ALA 110 HA ALA 110 -0.571 -2.762 5.775 717 HB1 ALA 110 1HB ALA 110 0.560 -4.999 5.904 718 HB2 ALA 110 2HB ALA 110 1.555 -4.509 4.525 719 HB3 ALA 110 3HB ALA 110 1.625 -3.601 6.062 720 H SER 111 H SER 111 1.190 -1.147 5.639 721 HA SER 111 HA SER 111 1.423 0.017 2.922 722 HB3 SER 111 2HB SER 111 0.316 1.539 5.310 723 HG SER 111 HG SER 111 -0.633 2.406 3.063 724 H PHE 112 H PHE 112 3.452 0.690 2.652 725 HA PHE 112 HA PHE 112 5.290 0.732 4.999 726 HB3 PHE 112 2HB PHE 112 6.844 -0.298 3.360 727 HD1 PHE 112 2HD PHE 112 4.756 -1.340 5.500 728 HD2 PHE 112 1HD PHE 112 5.451 -2.232 1.335 729 HE1 PHE 112 2HE PHE 112 3.858 -3.580 5.834 730 HE2 PHE 112 1HE PHE 112 4.677 -4.578 1.746 731 HZ PHE 112 HZ PHE 112 3.901 -5.242 4.006 732 H PHE 113 H PHE 113 6.798 2.297 5.185 733 HA PHE 113 HA PHE 113 6.829 4.403 3.079 734 HB3 PHE 113 2HB PHE 113 6.798 6.031 4.928 735 HD1 PHE 113 2HD PHE 113 4.383 3.297 5.850 736 HD2 PHE 113 1HD PHE 113 4.933 6.909 3.522 737 HE1 PHE 113 2HE PHE 113 2.012 3.262 5.193 738 HE2 PHE 113 1HE PHE 113 2.542 6.908 2.988 739 HZ PHE 113 HZ PHE 113 1.074 5.061 3.769 740 H THR 114 H THR 114 8.689 6.043 3.700 741 HA THR 114 HA THR 114 11.139 4.449 4.402 742 HB THR 114 HB THR 114 12.169 5.519 2.403 743 HG1 THR 114 1HG THR 114 10.978 7.277 2.048 744 HG21 THR 114 3HG2 THR 114 11.199 4.127 0.714 745 HG22 THR 114 1HG2 THR 114 9.650 4.046 1.582 746 HG23 THR 114 2HG2 THR 114 11.090 3.262 2.267 747 H SER 115 H SER 115 9.796 6.711 5.876 748 HA SER 115 HA SER 115 10.837 9.177 5.324 749 HB3 SER 115 2HB SER 115 9.539 9.863 7.003 750 HG SER 115 HG SER 115 8.317 8.327 8.114 751 H ALA 116 H ALA 116 12.082 10.671 6.917 752 HA ALA 116 HA ALA 116 14.840 9.722 7.023 753 HB1 ALA 116 1HB ALA 116 14.215 11.805 5.821 754 HB2 ALA 116 2HB ALA 116 13.541 12.465 7.328 755 HB3 ALA 116 3HB ALA 116 15.285 12.141 7.193 756 H GLY 117 H GLY 117 12.970 8.691 8.957 757 HA2 GLY 117 1HA GLY 117 12.861 8.208 11.214 758 HA3 GLY 117 2HA GLY 117 14.378 9.111 11.314 759 H THR 118 H THR 118 12.190 11.281 10.094 760 HA THR 118 HA THR 118 11.628 12.596 12.626 761 HB THR 118 HB THR 118 10.834 14.281 10.775 762 HG1 THR 118 1HG THR 118 11.947 13.849 8.756 763 HG21 THR 118 3HG2 THR 118 13.765 13.444 11.006 764 HG22 THR 118 1HG2 THR 118 12.911 14.591 12.058 765 HG23 THR 118 2HG2 THR 118 13.187 15.000 10.359 766 H ASN 119 H ASN 119 9.438 13.231 13.110 767 HA ASN 119 HA ASN 119 7.220 12.980 13.331 768 HB3 ASN 119 2HB ASN 119 5.955 13.242 11.161 769 HD21 ASN 119 1HD2 ASN 119 8.800 15.136 10.303 770 HD22 ASN 119 2HD2 ASN 119 8.420 16.505 11.295 771 H HIS 120 H HIS 120 8.602 10.546 13.586 772 HA HIS 120 HA HIS 120 7.563 8.540 11.897 773 HB3 HIS 120 2HB HIS 120 9.717 8.582 13.277 774 HD1 HIS 120 1HD HIS 120 9.349 9.913 15.733 775 HD2 HIS 120 2HD HIS 120 8.267 5.862 15.431 776 HE1 HIS 120 1HE HIS 120 9.012 9.073 18.130 777 H LYS 121 H LYS 121 5.963 9.983 14.564 778 HA LYS 121 HA LYS 121 4.055 7.679 14.658 779 HB3 LYS 121 2HB LYS 121 3.160 9.844 16.277 780 HG3 LYS 121 2HG LYS 121 3.840 8.314 18.165 781 HD3 LYS 121 2HD LYS 121 1.684 8.005 16.583 782 HE3 LYS 121 2HE LYS 121 2.661 6.258 15.101 783 HZ1 LYS 121 3HZ LYS 121 2.843 4.691 17.617 784 HZ2 LYS 121 1HZ LYS 121 4.096 5.049 16.554 785 HZ3 LYS 121 2HZ LYS 121 2.889 4.054 16.116 786 H ALA 122 H ALA 122 4.357 11.149 13.798 787 HA ALA 122 HA ALA 122 1.681 11.508 13.163 788 HB1 ALA 122 1HB ALA 122 3.820 13.050 11.666 789 HB2 ALA 122 2HB ALA 122 2.266 13.595 12.295 790 HB3 ALA 122 3HB ALA 122 3.575 13.281 13.422 791 H TYR 123 H TYR 123 4.259 10.272 10.997 792 HA TYR 123 HA TYR 123 2.769 10.260 8.570 793 HB3 TYR 123 2HB TYR 123 5.250 9.629 9.338 794 HD1 TYR 123 1HD TYR 123 5.773 8.073 11.042 795 HD2 TYR 123 2HD TYR 123 4.152 6.800 7.309 796 HE1 TYR 123 1HE TYR 123 6.665 5.756 11.462 797 HE2 TYR 123 2HE TYR 123 4.887 4.492 7.744 798 HH TYR 123 HH TYR 123 6.115 3.203 9.044 799 H VAL 124 H VAL 124 2.929 7.782 11.185 800 HA VAL 124 HA VAL 124 1.240 5.938 9.957 801 HB VAL 124 HB VAL 124 1.549 6.312 12.968 802 HG11 VAL 124 1HG1 VAL 124 -0.133 4.623 12.326 803 HG12 VAL 124 2HG1 VAL 124 1.061 3.816 11.287 804 HG13 VAL 124 3HG1 VAL 124 1.285 3.858 13.048 805 HG21 VAL 124 3HG2 VAL 124 3.797 6.303 12.094 806 HG22 VAL 124 1HG2 VAL 124 3.475 4.725 12.808 807 HG23 VAL 124 2HG2 VAL 124 3.428 4.913 11.041 808 H SER 125 H SER 125 0.555 8.751 12.137 809 HA SER 125 HA SER 125 -2.225 8.016 12.515 810 HB3 SER 125 2HB SER 125 -0.890 9.322 14.177 811 HG SER 125 HG SER 125 -0.198 11.214 13.921 812 H HIS 126 H HIS 126 -0.477 10.311 10.466 813 HA HIS 126 HA HIS 126 -2.696 11.678 9.485 814 HB3 HIS 126 2HB HIS 126 -0.283 11.254 7.677 815 HD1 HIS 126 1HD HIS 126 -1.241 12.754 5.550 816 HD2 HIS 126 2HD HIS 126 -2.191 14.189 9.428 817 HE1 HIS 126 1HE HIS 126 -2.589 14.786 5.238 818 H PHE 127 H PHE 127 -0.924 9.046 7.693 819 HA PHE 127 HA PHE 127 -2.692 9.164 5.542 820 HB3 PHE 127 2HB PHE 127 -0.378 7.903 5.892 821 HD1 PHE 127 1HD PHE 127 -0.777 6.587 8.193 822 HD2 PHE 127 2HD PHE 127 -2.131 5.250 4.321 823 HE1 PHE 127 1HE PHE 127 -0.973 4.265 9.066 824 HE2 PHE 127 2HE PHE 127 -2.330 2.936 5.206 825 HZ PHE 127 HZ PHE 127 -1.764 2.441 7.569 826 H ASN 128 H ASN 128 -3.026 7.476 8.612 827 HA ASN 128 HA ASN 128 -5.117 5.709 8.044 828 HB3 ASN 128 2HB ASN 128 -5.698 6.523 10.606 829 HD21 ASN 128 1HD2 ASN 128 -2.523 5.250 10.916 830 HD22 ASN 128 2HD2 ASN 128 -3.073 3.574 10.943 831 H GLU 129 H GLU 129 -5.451 9.279 8.969 832 HA GLU 129 HA GLU 129 -8.288 9.197 9.024 833 HB3 GLU 129 2HB GLU 129 -7.147 11.751 8.135 834 HG3 GLU 129 2HG GLU 129 -7.454 12.215 10.621 835 H TRP 130 H TRP 130 -6.044 9.069 6.436 836 HA TRP 130 HA TRP 130 -8.090 9.779 4.400 837 HB3 TRP 130 2HB TRP 130 -6.226 10.597 3.087 838 HD1 TRP 130 HD TRP 130 -3.978 11.581 5.707 839 HE1 TRP 130 1HE TRP 130 -4.490 13.867 6.720 840 HE3 TRP 130 3HE TRP 130 -8.800 12.219 4.002 841 HZ2 TRP 130 2HZ TRP 130 -6.539 15.824 6.569 842 HZ3 TRP 130 3HZ TRP 130 -9.944 14.362 4.375 843 HH2 TRP 130 HH TRP 130 -8.857 16.166 5.670 844 H ALA 131 H ALA 131 -7.484 7.162 5.827 845 HA ALA 131 HA ALA 131 -7.214 5.401 3.465 846 HB1 ALA 131 1HB ALA 131 -5.615 3.965 4.641 847 HB2 ALA 131 2HB ALA 131 -4.928 5.579 4.399 848 HB3 ALA 131 3HB ALA 131 -5.559 5.092 5.991 849 H ASP 132 H ASP 132 -8.537 6.062 6.672 850 HA ASP 132 HA ASP 132 -9.079 3.457 7.354 851 HB3 ASP 132 2HB ASP 132 -10.908 5.611 8.375 852 H GLY 133 H GLY 133 -10.548 2.085 6.930 853 HA2 GLY 133 1HA GLY 133 -12.907 1.726 5.842 854 HA3 GLY 133 2HA GLY 133 -12.158 2.618 4.513 855 H LEU 134 H LEU 134 -9.546 1.020 5.750 856 HA LEU 134 HA LEU 134 -10.007 -1.475 4.230 857 HB3 LEU 134 2HB LEU 134 -7.383 -1.113 3.794 858 HG LEU 134 HG LEU 134 -7.688 -0.239 1.612 859 HD11 LEU 134 1HD1 LEU 134 -10.109 -2.015 2.094 860 HD12 LEU 134 2HD1 LEU 134 -8.440 -2.613 2.162 861 HD13 LEU 134 3HD1 LEU 134 -9.067 -1.906 0.671 862 HD21 LEU 134 3HD2 LEU 134 -9.666 0.694 0.707 863 HD22 LEU 134 1HD2 LEU 134 -9.342 1.571 2.219 864 HD23 LEU 134 2HD2 LEU 134 -10.607 0.315 2.138 865 H ASN 135 H ASN 135 -8.923 -3.226 4.988 866 HA ASN 135 HA ASN 135 -8.462 -3.382 7.806 867 HB3 ASN 135 2HB ASN 135 -8.149 -5.359 5.546 868 HD21 ASN 135 1HD2 ASN 135 -7.444 -7.381 6.067 869 HD22 ASN 135 2HD2 ASN 135 -7.131 -7.970 7.696 870 H VAL 136 H VAL 136 -6.642 -2.256 8.499 871 HA VAL 136 HA VAL 136 -4.081 -2.686 7.183 872 HB VAL 136 HB VAL 136 -4.641 -1.272 9.815 873 HG11 VAL 136 1HG1 VAL 136 -2.286 -1.833 9.617 874 HG12 VAL 136 2HG1 VAL 136 -2.221 -1.250 7.942 875 HG13 VAL 136 3HG1 VAL 136 -2.475 -0.114 9.280 876 HG21 VAL 136 3HG2 VAL 136 -5.882 -0.138 8.061 877 HG22 VAL 136 1HG2 VAL 136 -4.441 0.815 8.414 878 HG23 VAL 136 2HG2 VAL 136 -4.498 -0.201 6.961 879 H ILE 137 H ILE 137 -2.573 -4.280 7.704 880 HA ILE 137 HA ILE 137 -2.814 -5.649 10.343 881 HB ILE 137 HB ILE 137 -1.616 -7.493 9.223 882 HG13 ILE 137 2HG1 ILE 137 -1.006 -5.647 7.251 883 HG21 ILE 137 1HG2 ILE 137 -4.078 -7.483 9.495 884 HG22 ILE 137 2HG2 ILE 137 -4.253 -6.768 7.879 885 HG23 ILE 137 3HG2 ILE 137 -3.543 -8.387 8.079 886 HD11 ILE 137 3HD1 ILE 137 -0.118 -7.452 5.935 887 HD12 ILE 137 1HD1 ILE 137 0.233 -7.702 7.653 888 HD13 ILE 137 2HD1 ILE 137 -1.059 -8.643 6.868 889 H GLY 138 H GLY 138 -0.928 -3.241 8.848 890 HA2 GLY 138 1HA GLY 138 0.747 -2.939 10.997 891 HA3 GLY 138 2HA GLY 138 1.660 -3.968 9.872 892 H VAL 139 H VAL 139 2.567 -1.454 10.547 893 HA VAL 139 HA VAL 139 2.697 -0.149 7.933 894 HB VAL 139 HB VAL 139 2.181 1.508 10.465 895 HG11 VAL 139 1HG1 VAL 139 1.890 3.386 8.966 896 HG12 VAL 139 2HG1 VAL 139 3.485 2.660 8.695 897 HG13 VAL 139 3HG1 VAL 139 2.159 2.350 7.553 898 HG21 VAL 139 3HG2 VAL 139 0.066 0.391 9.945 899 HG22 VAL 139 1HG2 VAL 139 -0.026 2.089 9.510 900 HG23 VAL 139 2HG2 VAL 139 0.213 0.874 8.240 901 H ALA 140 H ALA 140 4.933 0.452 7.595 902 HA ALA 140 HA ALA 140 6.507 1.121 9.893 903 HB1 ALA 140 1HB ALA 140 8.215 -0.425 9.882 904 HB2 ALA 140 2HB ALA 140 6.832 -1.463 9.589 905 HB3 ALA 140 3HB ALA 140 7.918 -0.955 8.253 906 H ARG 141 H ARG 141 9.056 1.484 8.809 907 HA ARG 141 HA ARG 141 8.623 3.332 6.556 908 HB3 ARG 141 2HB ARG 141 8.698 4.418 8.771 909 HG3 ARG 141 2HG ARG 141 11.459 3.067 9.101 910 HD3 ARG 141 2HD ARG 141 10.658 3.846 11.521 911 HE ARG 141 HE ARG 141 12.365 5.225 11.562 912 HH11 ARG 141 1HH1 ARG 141 11.865 4.775 8.004 913 HH12 ARG 141 2HH1 ARG 141 13.156 5.888 7.660 914 HH21 ARG 141 1HH2 ARG 141 14.278 6.132 10.976 915 HH22 ARG 141 2HH2 ARG 141 14.675 6.433 9.317 916 H ASP 142 H ASP 142 9.467 0.630 6.322 917 HA ASP 142 HA ASP 142 12.051 0.358 5.376 918 HB3 ASP 142 2HB ASP 142 13.226 0.737 7.246 919 H ASP 143 H ASP 143 12.797 -1.857 5.533 920 HA ASP 143 HA ASP 143 10.606 -3.804 5.051 921 HB3 ASP 143 2HB ASP 143 12.335 -3.523 3.331 922 H SER 144 H SER 144 11.857 -2.913 7.835 923 HA SER 144 HA SER 144 13.043 -5.245 8.966 924 HB3 SER 144 2HB SER 144 12.575 -3.758 11.058 925 HG SER 144 HG SER 144 14.550 -3.667 10.411 926 H GLU 145 H GLU 145 9.813 -5.007 8.084 927 HA GLU 145 HA GLU 145 9.119 -6.978 10.174 928 HB3 GLU 145 2HB GLU 145 6.884 -5.943 10.524 929 HG3 GLU 145 2HG GLU 145 9.184 -4.108 11.203 930 H VAL 146 H VAL 146 9.731 -6.997 7.152 931 HA VAL 146 HA VAL 146 7.332 -7.702 5.764 932 HB VAL 146 HB VAL 146 10.234 -8.552 5.345 933 HG11 VAL 146 1HG1 VAL 146 9.385 -8.749 2.886 934 HG12 VAL 146 2HG1 VAL 146 8.984 -10.030 4.030 935 HG13 VAL 146 3HG1 VAL 146 7.756 -8.833 3.601 936 HG21 VAL 146 3HG2 VAL 146 10.419 -6.769 3.734 937 HG22 VAL 146 1HG2 VAL 146 8.698 -6.376 3.904 938 HG23 VAL 146 2HG2 VAL 146 9.810 -6.041 5.226 939 H ASP 147 H ASP 147 9.391 -9.397 7.962 940 HA ASP 147 HA ASP 147 8.664 -12.047 7.493 941 HB3 ASP 147 2HB ASP 147 9.271 -12.429 9.897 942 H LYS 148 H LYS 148 6.859 -9.539 9.156 943 HA LYS 148 HA LYS 148 4.892 -11.566 10.191 944 HB3 LYS 148 2HB LYS 148 5.641 -10.043 11.874 945 HG3 LYS 148 2HG LYS 148 4.808 -7.872 9.942 946 HD3 LYS 148 2HD LYS 148 3.791 -7.466 12.278 947 HE3 LYS 148 2HE LYS 148 6.788 -7.163 12.777 948 HZ1 LYS 148 3HZ LYS 148 5.685 -5.171 13.454 949 HZ2 LYS 148 1HZ LYS 148 6.157 -6.008 14.791 950 HZ3 LYS 148 2HZ LYS 148 4.586 -6.005 14.362 951 H TRP 149 H TRP 149 5.310 -9.516 7.499 952 HA TRP 149 HA TRP 149 2.391 -9.306 7.094 953 HB3 TRP 149 2HB TRP 149 2.900 -7.848 5.288 954 HD1 TRP 149 HD TRP 149 2.284 -7.407 8.418 955 HE1 TRP 149 1HE TRP 149 3.267 -5.441 9.687 956 HE3 TRP 149 3HE TRP 149 6.037 -6.178 5.262 957 HZ2 TRP 149 2HZ TRP 149 5.086 -3.232 9.149 958 HZ3 TRP 149 3HZ TRP 149 7.544 -4.220 5.767 959 HH2 TRP 149 HH TRP 149 7.005 -2.727 7.616 960 H SER 150 H SER 150 4.435 -11.809 6.866 961 HA SER 150 HA SER 150 2.764 -12.951 4.736 962 HB3 SER 150 2HB SER 150 5.803 -13.110 4.701 963 HG SER 150 HG SER 150 4.509 -14.995 4.146 964 H LYS 151 H LYS 151 2.331 -13.205 7.427 965 HA LYS 151 HA LYS 151 3.536 -15.720 8.339 966 HB3 LYS 151 2HB LYS 151 2.878 -14.050 10.017 967 HG3 LYS 151 2HG LYS 151 0.379 -14.375 10.751 968 HD3 LYS 151 2HD LYS 151 1.042 -12.327 8.607 969 HE3 LYS 151 2HE LYS 151 -0.587 -10.930 9.903 970 HZ1 LYS 151 3HZ LYS 151 -1.449 -12.157 7.975 971 HZ2 LYS 151 1HZ LYS 151 -2.580 -12.014 9.089 972 HZ3 LYS 151 2HZ LYS 151 -1.811 -13.444 8.936 Start of MODEL 13 1 H1 GLY 1 H GLY 1 -10.708 -25.812 -5.000 2 HA2 GLY 1 1HA GLY 1 -9.978 -24.841 -2.904 3 HA3 GLY 1 2HA GLY 1 -8.630 -25.682 -3.690 4 H MET 2 H MET 2 -7.421 -24.045 -5.382 5 HA MET 2 HA MET 2 -6.163 -22.185 -3.667 6 HB3 MET 2 2HB MET 2 -4.895 -21.583 -5.706 7 HG3 MET 2 2HG MET 2 -4.505 -23.770 -4.369 8 HE1 MET 2 3HE MET 2 -5.204 -24.323 -8.244 9 HE2 MET 2 1HE MET 2 -3.714 -25.164 -7.771 10 HE3 MET 2 2HE MET 2 -5.130 -26.101 -8.283 11 H ALA 3 H ALA 3 -7.114 -20.310 -3.003 12 HA ALA 3 HA ALA 3 -7.786 -18.358 -5.063 13 HB1 ALA 3 1HB ALA 3 -9.993 -19.426 -4.531 14 HB2 ALA 3 2HB ALA 3 -9.776 -18.964 -2.830 15 HB3 ALA 3 3HB ALA 3 -9.888 -17.717 -4.090 16 H LYS 4 H LYS 4 -5.584 -17.832 -4.166 17 HA LYS 4 HA LYS 4 -5.806 -15.822 -2.152 18 HB3 LYS 4 2HB LYS 4 -5.579 -17.803 -0.645 19 HG3 LYS 4 2HG LYS 4 -3.374 -18.775 -0.286 20 HD3 LYS 4 2HD LYS 4 -5.112 -19.901 -1.948 21 HE3 LYS 4 2HE LYS 4 -4.154 -18.877 -4.032 22 HZ1 LYS 4 3HZ LYS 4 -1.810 -20.587 -3.622 23 HZ2 LYS 4 1HZ LYS 4 -1.775 -18.979 -3.353 24 HZ3 LYS 4 2HZ LYS 4 -2.104 -19.516 -4.857 25 H LYS 5 H LYS 5 -3.897 -14.430 -2.130 26 HA LYS 5 HA LYS 5 -1.630 -15.007 -3.810 27 HB3 LYS 5 2HB LYS 5 -1.937 -13.267 -5.457 28 HG3 LYS 5 2HG LYS 5 -4.642 -14.582 -5.439 29 HD3 LYS 5 2HD LYS 5 -2.906 -13.387 -7.643 30 HE3 LYS 5 2HE LYS 5 -5.779 -14.379 -7.631 31 HZ1 LYS 5 3HZ LYS 5 -5.495 -12.444 -8.964 32 HZ2 LYS 5 1HZ LYS 5 -5.707 -13.715 -9.955 33 HZ3 LYS 5 2HZ LYS 5 -4.202 -13.057 -9.765 34 H THR 6 H THR 6 -0.402 -12.898 -4.076 35 HA THR 6 HA THR 6 -0.729 -11.047 -1.780 36 HB THR 6 HB THR 6 1.882 -12.418 -2.526 37 HG1 THR 6 1HG THR 6 1.418 -13.549 -0.478 38 HG21 THR 6 3HG2 THR 6 2.219 -10.333 -1.338 39 HG22 THR 6 1HG2 THR 6 2.450 -11.641 -0.161 40 HG23 THR 6 2HG2 THR 6 0.950 -10.720 -0.164 41 H LEU 7 H LEU 7 -1.154 -9.171 -2.900 42 HA LEU 7 HA LEU 7 0.471 -8.402 -5.319 43 HB3 LEU 7 2HB LEU 7 -1.903 -7.132 -3.900 44 HG LEU 7 HG LEU 7 -0.838 -5.383 -5.171 45 HD11 LEU 7 1HD1 LEU 7 -0.520 -5.540 -7.658 46 HD12 LEU 7 2HD1 LEU 7 -0.895 -7.272 -7.579 47 HD13 LEU 7 3HD1 LEU 7 0.566 -6.623 -6.800 48 HD21 LEU 7 3HD2 LEU 7 -2.695 -4.903 -6.762 49 HD22 LEU 7 1HD2 LEU 7 -3.290 -5.560 -5.224 50 HD23 LEU 7 2HD2 LEU 7 -3.203 -6.593 -6.664 51 H ILE 8 H ILE 8 1.919 -6.637 -5.274 52 HA ILE 8 HA ILE 8 2.295 -5.233 -2.702 53 HB ILE 8 HB ILE 8 4.520 -6.020 -4.605 54 HG13 ILE 8 2HG1 ILE 8 3.490 -8.119 -3.430 55 HG21 ILE 8 1HG2 ILE 8 4.513 -5.091 -1.675 56 HG22 ILE 8 2HG2 ILE 8 5.948 -5.338 -2.667 57 HG23 ILE 8 3HG2 ILE 8 4.815 -4.040 -3.061 58 HD11 ILE 8 3HD1 ILE 8 5.688 -8.212 -4.444 59 HD12 ILE 8 1HD1 ILE 8 6.428 -7.434 -3.041 60 HD13 ILE 8 2HD1 ILE 8 5.709 -9.035 -2.874 61 H LEU 9 H LEU 9 2.177 -3.040 -2.970 62 HA LEU 9 HA LEU 9 2.422 -1.852 -5.703 63 HB3 LEU 9 2HB LEU 9 0.455 -0.487 -5.012 64 HG LEU 9 HG LEU 9 0.136 -3.475 -5.078 65 HD11 LEU 9 1HD1 LEU 9 -2.060 -1.690 -4.007 66 HD12 LEU 9 2HD1 LEU 9 -1.176 -2.957 -3.124 67 HD13 LEU 9 3HD1 LEU 9 -2.219 -3.405 -4.477 68 HD21 LEU 9 3HD2 LEU 9 -1.318 -1.205 -6.459 69 HD22 LEU 9 1HD2 LEU 9 -1.602 -2.937 -6.731 70 HD23 LEU 9 2HD2 LEU 9 -0.048 -2.261 -7.136 71 H TYR 10 H TYR 10 3.445 0.306 -5.689 72 HA TYR 10 HA TYR 10 3.508 1.824 -3.311 73 HB3 TYR 10 2HB TYR 10 5.217 0.980 -2.214 74 HD1 TYR 10 2HD TYR 10 5.907 -0.152 -5.795 75 HD2 TYR 10 1HD TYR 10 6.620 -0.740 -1.588 76 HE1 TYR 10 2HE TYR 10 6.687 -2.397 -6.244 77 HE2 TYR 10 1HE TYR 10 7.359 -3.054 -2.015 78 HH TYR 10 HH TYR 10 8.109 -4.561 -3.813 79 H TYR 11 H TYR 11 4.496 3.855 -3.489 80 HA TYR 11 HA TYR 11 5.010 4.732 -6.302 81 HB3 TYR 11 2HB TYR 11 4.388 6.314 -3.796 82 HD1 TYR 11 1HD TYR 11 5.606 6.555 -7.358 83 HD2 TYR 11 2HD TYR 11 4.056 8.749 -3.958 84 HE1 TYR 11 1HE TYR 11 6.154 8.643 -8.461 85 HE2 TYR 11 2HE TYR 11 4.630 10.874 -5.102 86 HH TYR 11 HH TYR 11 6.147 11.730 -6.966 87 H SER 12 H SER 12 7.156 4.571 -6.895 88 HA SER 12 HA SER 12 9.372 5.098 -5.016 89 HB3 SER 12 2HB SER 12 9.732 3.377 -6.566 90 HG SER 12 HG SER 12 9.283 5.110 -8.748 91 H TRP 13 H TRP 13 9.658 7.082 -4.407 92 HA TRP 13 HA TRP 13 8.684 9.415 -5.475 93 HB3 TRP 13 2HB TRP 13 11.249 9.013 -3.858 94 HD1 TRP 13 HD TRP 13 8.094 11.122 -3.215 95 HE1 TRP 13 1HE TRP 13 8.817 13.442 -2.449 96 HE3 TRP 13 3HE TRP 13 13.146 10.754 -4.054 97 HZ2 TRP 13 2HZ TRP 13 11.183 15.039 -2.533 98 HZ3 TRP 13 3HZ TRP 13 14.609 12.711 -3.722 99 HH2 TRP 13 HH TRP 13 13.659 14.871 -2.944 100 H SER 14 H SER 14 12.230 9.211 -5.449 101 HA SER 14 HA SER 14 12.363 9.667 -8.383 102 HB3 SER 14 2HB SER 14 13.758 11.306 -6.243 103 HG SER 14 HG SER 14 14.750 11.023 -8.366 104 H GLY 15 H GLY 15 12.973 7.380 -6.446 105 HA2 GLY 15 1HA GLY 15 14.707 5.788 -7.298 106 HA3 GLY 15 2HA GLY 15 15.902 7.021 -6.914 107 H GLU 16 H GLU 16 13.759 7.331 -4.372 108 HA GLU 16 HA GLU 16 15.684 5.866 -2.672 109 HB3 GLU 16 2HB GLU 16 14.278 6.915 -0.801 110 HG3 GLU 16 2HG GLU 16 14.792 9.414 -1.937 111 H THR 17 H THR 17 12.110 6.090 -2.476 112 HA THR 17 HA THR 17 11.633 3.806 -1.111 113 HB THR 17 HB THR 17 9.655 4.600 -3.166 114 HG1 THR 17 1HG THR 17 10.253 6.549 -1.233 115 HG21 THR 17 3HG2 THR 17 8.072 4.605 -1.501 116 HG22 THR 17 1HG2 THR 17 9.231 4.972 -0.224 117 HG23 THR 17 2HG2 THR 17 9.209 3.358 -0.961 118 H LYS 18 H LYS 18 12.568 3.999 -4.446 119 HA LYS 18 HA LYS 18 11.327 1.654 -5.536 120 HB3 LYS 18 2HB LYS 18 14.008 2.928 -6.276 121 HG3 LYS 18 2HG LYS 18 12.480 2.062 -8.534 122 HD3 LYS 18 2HD LYS 18 14.909 2.139 -8.579 123 HE3 LYS 18 2HE LYS 18 14.712 -0.230 -6.669 124 HZ1 LYS 18 3HZ LYS 18 16.297 -0.942 -8.059 125 HZ2 LYS 18 1HZ LYS 18 17.214 -0.158 -6.987 126 HZ3 LYS 18 2HZ LYS 18 16.913 0.572 -8.428 127 H LYS 19 H LYS 19 14.360 2.124 -3.598 128 HA LYS 19 HA LYS 19 15.407 -0.431 -4.277 129 HB3 LYS 19 2HB LYS 19 15.989 0.428 -1.480 130 HG3 LYS 19 2HG LYS 19 18.298 0.531 -2.294 131 HD3 LYS 19 2HD LYS 19 16.817 -1.909 -3.374 132 HE3 LYS 19 2HE LYS 19 19.708 -1.670 -2.514 133 HZ1 LYS 19 3HZ LYS 19 18.501 -3.857 -2.579 134 HZ2 LYS 19 1HZ LYS 19 19.822 -3.801 -3.559 135 HZ3 LYS 19 2HZ LYS 19 18.354 -3.653 -4.226 136 H MET 20 H MET 20 13.385 0.561 -1.560 137 HA MET 20 HA MET 20 12.891 -2.024 -0.467 138 HB3 MET 20 2HB MET 20 10.887 0.279 -0.269 139 HG3 MET 20 2HG MET 20 10.902 -1.582 1.427 140 HE1 MET 20 3HE MET 20 14.502 0.129 1.083 141 HE2 MET 20 1HE MET 20 13.711 1.093 2.362 142 HE3 MET 20 2HE MET 20 15.052 0.007 2.774 143 H ALA 21 H ALA 21 12.061 -1.619 -3.594 144 HA ALA 21 HA ALA 21 9.422 -2.822 -3.216 145 HB1 ALA 21 1HB ALA 21 10.878 -1.754 -5.678 146 HB2 ALA 21 2HB ALA 21 9.338 -2.608 -5.730 147 HB3 ALA 21 3HB ALA 21 9.446 -1.058 -4.867 148 H GLU 22 H GLU 22 12.533 -3.354 -4.847 149 HA GLU 22 HA GLU 22 11.912 -5.834 -5.947 150 HB3 GLU 22 2HB GLU 22 14.272 -6.046 -6.380 151 HG3 GLU 22 2HG GLU 22 13.777 -3.032 -6.198 152 H LYS 23 H LYS 23 13.399 -5.082 -2.817 153 HA LYS 23 HA LYS 23 14.272 -7.750 -2.217 154 HB3 LYS 23 2HB LYS 23 14.111 -5.076 -0.787 155 HG3 LYS 23 2HG LYS 23 13.544 -6.882 0.968 156 HD3 LYS 23 2HD LYS 23 15.607 -8.462 -0.126 157 HE3 LYS 23 2HE LYS 23 16.482 -6.828 2.303 158 HZ1 LYS 23 3HZ LYS 23 16.931 -9.175 2.646 159 HZ2 LYS 23 1HZ LYS 23 18.273 -8.237 2.595 160 HZ3 LYS 23 2HZ LYS 23 17.892 -9.216 1.316 161 H ILE 24 H ILE 24 11.382 -5.885 -1.205 162 HA ILE 24 HA ILE 24 10.189 -7.939 0.379 163 HB ILE 24 HB ILE 24 9.151 -5.487 -1.084 164 HG13 ILE 24 2HG1 ILE 24 10.568 -5.257 1.003 165 HG21 ILE 24 1HG2 ILE 24 7.412 -7.160 0.769 166 HG22 ILE 24 2HG2 ILE 24 6.963 -5.675 -0.078 167 HG23 ILE 24 3HG2 ILE 24 7.251 -7.152 -0.985 168 HD11 ILE 24 3HD1 ILE 24 9.293 -3.611 2.103 169 HD12 ILE 24 1HD1 ILE 24 8.683 -3.579 0.439 170 HD13 ILE 24 2HD1 ILE 24 7.763 -4.406 1.716 171 H ASN 25 H ASN 25 10.057 -7.241 -3.148 172 HA ASN 25 HA ASN 25 8.069 -9.210 -3.710 173 HB3 ASN 25 2HB ASN 25 10.214 -8.007 -5.486 174 HD21 ASN 25 1HD2 ASN 25 7.059 -9.655 -5.560 175 HD22 ASN 25 2HD2 ASN 25 7.401 -10.659 -6.950 176 H SER 26 H SER 26 11.613 -9.563 -3.287 177 HA SER 26 HA SER 26 11.693 -12.292 -4.193 178 HB3 SER 26 2HB SER 26 13.926 -11.730 -2.701 179 HG SER 26 HG SER 26 14.835 -11.053 -4.735 180 H GLU 27 H GLU 27 11.502 -10.576 -1.016 181 HA GLU 27 HA GLU 27 11.925 -12.953 0.526 182 HB3 GLU 27 2HB GLU 27 10.855 -11.374 2.349 183 HG3 GLU 27 2HG GLU 27 12.923 -9.981 2.437 184 H ILE 28 H ILE 28 9.035 -11.790 -1.049 185 HA ILE 28 HA ILE 28 7.277 -13.519 0.573 186 HB ILE 28 HB ILE 28 6.822 -11.405 -1.583 187 HG13 ILE 28 2HG1 ILE 28 7.475 -10.512 0.622 188 HG21 ILE 28 1HG2 ILE 28 4.418 -11.640 -1.207 189 HG22 ILE 28 2HG2 ILE 28 5.048 -13.139 -1.795 190 HG23 ILE 28 3HG2 ILE 28 4.685 -12.987 -0.075 191 HD11 ILE 28 3HD1 ILE 28 5.655 -9.272 -0.591 192 HD12 ILE 28 1HD1 ILE 28 4.468 -10.139 0.422 193 HD13 ILE 28 2HD1 ILE 28 5.646 -9.071 1.164 194 H LYS 29 H LYS 29 5.911 -15.051 -0.562 195 HA LYS 29 HA LYS 29 7.051 -16.187 -3.070 196 HB3 LYS 29 2HB LYS 29 5.713 -17.460 -0.685 197 HG3 LYS 29 2HG LYS 29 4.562 -18.435 -2.683 198 HD3 LYS 29 2HD LYS 29 6.778 -20.190 -3.415 199 HE3 LYS 29 2HE LYS 29 6.202 -19.117 -5.750 200 HZ1 LYS 29 3HZ LYS 29 5.356 -21.187 -5.364 201 HZ2 LYS 29 1HZ LYS 29 4.015 -20.307 -5.756 202 HZ3 LYS 29 2HZ LYS 29 4.308 -20.730 -4.189 203 H ASP 30 H ASP 30 5.687 -16.493 -4.673 204 HA ASP 30 HA ASP 30 3.929 -16.217 -6.125 205 HB3 ASP 30 2HB ASP 30 2.021 -16.475 -3.783 206 H SER 31 H SER 31 5.194 -13.894 -4.921 207 HA SER 31 HA SER 31 3.192 -11.898 -4.461 208 HB3 SER 31 2HB SER 31 4.868 -11.032 -3.355 209 HG SER 31 HG SER 31 6.919 -12.580 -4.584 210 H GLU 32 H GLU 32 2.386 -10.399 -5.868 211 HA GLU 32 HA GLU 32 3.616 -10.073 -8.544 212 HB3 GLU 32 2HB GLU 32 1.372 -8.632 -8.686 213 HG3 GLU 32 2HG GLU 32 0.110 -10.749 -9.324 214 H LEU 33 H LEU 33 3.781 -7.899 -9.232 215 HA LEU 33 HA LEU 33 4.762 -6.040 -7.097 216 HB3 LEU 33 2HB LEU 33 6.400 -6.375 -9.598 217 HG LEU 33 HG LEU 33 7.263 -6.590 -6.714 218 HD11 LEU 33 1HD1 LEU 33 8.893 -5.932 -9.215 219 HD12 LEU 33 2HD1 LEU 33 8.791 -7.541 -8.491 220 HD13 LEU 33 3HD1 LEU 33 9.529 -6.211 -7.580 221 HD21 LEU 33 3HD2 LEU 33 8.207 -4.309 -6.862 222 HD22 LEU 33 1HD2 LEU 33 6.434 -4.400 -6.872 223 HD23 LEU 33 2HD2 LEU 33 7.320 -4.067 -8.391 224 H LYS 34 H LYS 34 4.035 -3.880 -7.544 225 HA LYS 34 HA LYS 34 3.572 -3.117 -10.377 226 HB3 LYS 34 2HB LYS 34 1.447 -1.916 -9.274 227 HG3 LYS 34 2HG LYS 34 -0.040 -3.822 -9.606 228 HD3 LYS 34 2HD LYS 34 2.041 -3.608 -11.805 229 HE3 LYS 34 2HE LYS 34 -0.851 -3.639 -12.498 230 HZ1 LYS 34 3HZ LYS 34 1.098 -3.802 -14.047 231 HZ2 LYS 34 1HZ LYS 34 0.043 -5.062 -14.251 232 HZ3 LYS 34 2HZ LYS 34 1.455 -5.258 -13.423 233 H GLU 35 H GLU 35 2.900 -0.599 -10.368 234 HA GLU 35 HA GLU 35 4.413 0.865 -8.331 235 HB3 GLU 35 2HB GLU 35 5.968 0.559 -10.166 236 HG3 GLU 35 2HG GLU 35 4.086 2.207 -11.916 237 H VAL 36 H VAL 36 3.618 2.822 -7.822 238 HA VAL 36 HA VAL 36 1.129 3.850 -9.118 239 HB VAL 36 HB VAL 36 2.427 4.460 -6.401 240 HG11 VAL 36 1HG1 VAL 36 -0.304 5.275 -7.472 241 HG12 VAL 36 2HG1 VAL 36 0.236 5.484 -5.786 242 HG13 VAL 36 3HG1 VAL 36 1.070 6.333 -7.077 243 HG21 VAL 36 3HG2 VAL 36 0.084 2.602 -6.823 244 HG22 VAL 36 1HG2 VAL 36 1.695 2.193 -6.207 245 HG23 VAL 36 2HG2 VAL 36 0.640 3.231 -5.260 246 H LYS 37 H LYS 37 1.220 6.102 -9.747 247 HA LYS 37 HA LYS 37 3.496 7.745 -9.070 248 HB3 LYS 37 2HB LYS 37 3.794 8.544 -11.389 249 HG3 LYS 37 2HG LYS 37 5.198 6.530 -10.451 250 HD3 LYS 37 2HD LYS 37 3.430 4.814 -11.390 251 HE3 LYS 37 2HE LYS 37 3.489 6.070 -13.709 252 HZ1 LYS 37 3HZ LYS 37 5.869 5.778 -14.077 253 HZ2 LYS 37 1HZ LYS 37 5.004 4.873 -15.173 254 HZ3 LYS 37 2HZ LYS 37 5.727 4.150 -13.888 255 H VAL 38 H VAL 38 2.834 10.087 -9.980 256 HA VAL 38 HA VAL 38 -0.113 10.430 -10.036 257 HB VAL 38 HB VAL 38 0.166 12.576 -8.813 258 HG11 VAL 38 1HG1 VAL 38 0.092 11.679 -6.597 259 HG12 VAL 38 2HG1 VAL 38 -0.683 10.529 -7.669 260 HG13 VAL 38 3HG1 VAL 38 0.963 10.198 -7.089 261 HG21 VAL 38 3HG2 VAL 38 2.107 12.994 -7.400 262 HG22 VAL 38 1HG2 VAL 38 2.909 11.524 -7.987 263 HG23 VAL 38 2HG2 VAL 38 2.619 12.890 -9.086 264 H SER 39 H SER 39 -0.598 12.708 -11.008 265 HA SER 39 HA SER 39 0.863 12.911 -13.508 266 HB3 SER 39 2HB SER 39 -1.122 14.980 -13.040 267 HG SER 39 HG SER 39 -2.087 13.694 -14.820 268 H GLU 40 H GLU 40 0.957 15.544 -14.194 269 HA GLU 40 HA GLU 40 3.419 16.182 -12.920 270 HB3 GLU 40 2HB GLU 40 1.745 17.103 -15.269 271 HG3 GLU 40 2HG GLU 40 2.804 19.118 -14.543 272 H GLY 41 H GLY 41 3.960 18.076 -11.877 273 HA2 GLY 41 1HA GLY 41 3.779 19.976 -10.639 274 HA3 GLY 41 2HA GLY 41 2.312 20.343 -11.511 275 H THR 42 H THR 42 2.133 17.311 -9.868 276 HA THR 42 HA THR 42 -0.082 18.140 -8.343 277 HB THR 42 HB THR 42 1.684 15.699 -7.858 278 HG1 THR 42 1HG THR 42 1.034 15.387 -9.911 279 HG21 THR 42 3HG2 THR 42 -0.379 14.698 -6.999 280 HG22 THR 42 1HG2 THR 42 -1.294 16.176 -7.389 281 HG23 THR 42 2HG2 THR 42 -0.072 16.207 -6.116 282 H PHE 43 H PHE 43 3.382 17.902 -7.463 283 HA PHE 43 HA PHE 43 2.882 19.832 -5.318 284 HB3 PHE 43 2HB PHE 43 4.231 18.600 -3.659 285 HD1 PHE 43 1HD PHE 43 2.044 18.983 -2.487 286 HD2 PHE 43 2HD PHE 43 2.689 15.597 -5.081 287 HE1 PHE 43 1HE PHE 43 0.017 17.881 -1.561 288 HE2 PHE 43 2HE PHE 43 0.651 14.519 -4.160 289 HZ PHE 43 HZ PHE 43 -0.679 15.655 -2.406 290 H ASP 44 H ASP 44 4.915 20.811 -4.651 291 HA ASP 44 HA ASP 44 7.041 20.758 -6.732 292 HB3 ASP 44 2HB ASP 44 6.229 22.893 -6.713 293 H ALA 45 H ALA 45 8.818 22.138 -4.774 294 HA ALA 45 HA ALA 45 9.658 19.672 -3.302 295 HB1 ALA 45 1HB ALA 45 11.919 20.089 -4.133 296 HB2 ALA 45 2HB ALA 45 10.794 19.916 -5.504 297 HB3 ALA 45 3HB ALA 45 11.367 21.532 -5.001 298 H ASP 46 H ASP 46 8.578 22.638 -2.769 299 HA ASP 46 HA ASP 46 11.041 23.639 -1.364 300 HB3 ASP 46 2HB ASP 46 8.791 25.543 -1.445 301 H MET 47 H MET 47 10.489 25.073 0.593 302 HA MET 47 HA MET 47 9.418 23.275 2.593 303 HB3 MET 47 2HB MET 47 10.809 25.993 2.509 304 HG3 MET 47 2HG MET 47 10.127 24.470 5.036 305 HE1 MET 47 3HE MET 47 11.946 27.713 3.335 306 HE2 MET 47 1HE MET 47 10.657 28.305 4.409 307 HE3 MET 47 2HE MET 47 12.361 28.560 4.835 308 H TYR 48 H TYR 48 8.784 26.792 2.074 309 HA TYR 48 HA TYR 48 6.308 26.631 3.472 310 HB3 TYR 48 2HB TYR 48 7.609 28.667 3.385 311 HD1 TYR 48 1HD TYR 48 5.690 29.334 0.278 312 HD2 TYR 48 2HD TYR 48 9.625 28.684 1.955 313 HE1 TYR 48 1HE TYR 48 6.715 30.013 -1.854 314 HE2 TYR 48 2HE TYR 48 10.648 29.259 -0.183 315 HH TYR 48 HH TYR 48 10.208 30.376 -2.268 316 H LYS 49 H LYS 49 7.164 26.098 0.133 317 HA LYS 49 HA LYS 49 4.524 26.650 -0.886 318 HB3 LYS 49 2HB LYS 49 6.679 25.183 -2.370 319 HG3 LYS 49 2HG LYS 49 4.206 25.774 -3.232 320 HD3 LYS 49 2HD LYS 49 5.629 28.460 -3.238 321 HE3 LYS 49 2HE LYS 49 3.746 29.068 -4.932 322 HZ1 LYS 49 3HZ LYS 49 6.056 29.221 -5.520 323 HZ2 LYS 49 1HZ LYS 49 5.186 28.618 -6.791 324 HZ3 LYS 49 2HZ LYS 49 6.125 27.621 -5.901 325 H THR 50 H THR 50 6.196 23.361 -1.135 326 HA THR 50 HA THR 50 3.815 22.075 -1.084 327 HB THR 50 HB THR 50 4.798 20.057 -0.606 328 HG1 THR 50 1HG THR 50 5.774 20.213 1.286 329 HG21 THR 50 3HG2 THR 50 7.035 20.059 -1.773 330 HG22 THR 50 1HG2 THR 50 7.020 21.796 -1.714 331 HG23 THR 50 2HG2 THR 50 5.756 20.937 -2.632 332 H SER 51 H SER 51 4.900 23.696 1.887 333 HA SER 51 HA SER 51 3.150 22.073 3.579 334 HB3 SER 51 2HB SER 51 5.134 23.146 4.487 335 HG SER 51 HG SER 51 3.726 25.589 4.066 336 H ASP 52 H ASP 52 2.567 24.376 1.273 337 HA ASP 52 HA ASP 52 -0.056 25.222 2.430 338 HB3 ASP 52 2HB ASP 52 1.099 25.865 -0.322 339 H ILE 53 H ILE 53 1.277 23.595 -0.444 340 HA ILE 53 HA ILE 53 -1.101 22.852 -1.608 341 HB ILE 53 HB ILE 53 1.473 21.235 -1.746 342 HG13 ILE 53 2HG1 ILE 53 1.679 23.812 -2.223 343 HG21 ILE 53 1HG2 ILE 53 -0.454 20.115 -2.870 344 HG22 ILE 53 2HG2 ILE 53 -0.769 21.583 -3.789 345 HG23 ILE 53 3HG2 ILE 53 0.723 20.672 -4.065 346 HD11 ILE 53 3HD1 ILE 53 3.198 21.726 -3.131 347 HD12 ILE 53 1HD1 ILE 53 2.669 22.442 -4.650 348 HD13 ILE 53 2HD1 ILE 53 3.486 23.453 -3.432 349 H ALA 54 H ALA 54 0.868 20.711 0.563 350 HA ALA 54 HA ALA 54 -1.184 18.666 0.377 351 HB1 ALA 54 1HB ALA 54 1.087 18.885 2.402 352 HB2 ALA 54 2HB ALA 54 0.164 17.420 1.957 353 HB3 ALA 54 3HB ALA 54 1.240 18.170 0.776 354 H LEU 55 H LEU 55 -0.959 21.571 2.230 355 HA LEU 55 HA LEU 55 -2.354 20.617 4.584 356 HB3 LEU 55 2HB LEU 55 -2.089 23.515 3.759 357 HG LEU 55 HG LEU 55 -0.994 22.424 6.320 358 HD11 LEU 55 1HD1 LEU 55 -1.883 24.582 7.218 359 HD12 LEU 55 2HD1 LEU 55 -2.673 24.877 5.666 360 HD13 LEU 55 3HD1 LEU 55 -0.904 24.842 5.752 361 HD21 LEU 55 3HD2 LEU 55 -3.130 21.275 6.446 362 HD22 LEU 55 1HD2 LEU 55 -3.972 22.769 5.965 363 HD23 LEU 55 2HD2 LEU 55 -3.153 22.640 7.546 364 H ASP 56 H ASP 56 -2.981 22.512 1.697 365 HA ASP 56 HA ASP 56 -5.599 23.386 1.958 366 HB3 ASP 56 2HB ASP 56 -3.873 22.517 -0.357 367 H GLN 57 H GLN 57 -4.483 20.232 0.818 368 HA GLN 57 HA GLN 57 -7.058 18.973 0.626 369 HB3 GLN 57 2HB GLN 57 -5.701 17.007 -0.007 370 HG3 GLN 57 2HG GLN 57 -4.595 19.614 -1.157 371 HE21 GLN 57 1HE2 GLN 57 -5.631 17.758 -3.659 372 HE22 GLN 57 2HE2 GLN 57 -3.989 17.247 -4.110 373 H ILE 58 H ILE 58 -5.548 19.784 3.447 374 HA ILE 58 HA ILE 58 -6.473 17.343 4.913 375 HB ILE 58 HB ILE 58 -4.355 19.404 5.627 376 HG13 ILE 58 2HG1 ILE 58 -3.830 17.404 4.065 377 HG21 ILE 58 1HG2 ILE 58 -5.445 17.148 7.371 378 HG22 ILE 58 2HG2 ILE 58 -4.030 18.151 7.753 379 HG23 ILE 58 3HG2 ILE 58 -5.619 18.887 7.681 380 HD11 ILE 58 3HD1 ILE 58 -1.659 16.983 4.995 381 HD12 ILE 58 1HD1 ILE 58 -2.040 18.662 5.383 382 HD13 ILE 58 2HD1 ILE 58 -2.194 17.409 6.628 383 H GLN 59 H GLN 59 -6.327 20.957 5.013 384 HA GLN 59 HA GLN 59 -8.236 21.053 7.168 385 HB3 GLN 59 2HB GLN 59 -8.287 23.557 6.561 386 HG3 GLN 59 2HG GLN 59 -5.596 22.368 7.303 387 HE21 GLN 59 1HE2 GLN 59 -4.585 24.529 6.831 388 HE22 GLN 59 2HE2 GLN 59 -5.005 25.890 7.853 389 H GLY 60 H GLY 60 -8.937 20.052 4.130 390 HA2 GLY 60 1HA GLY 60 -11.101 19.312 3.658 391 HA3 GLY 60 2HA GLY 60 -11.765 20.473 4.796 392 H ASN 61 H ASN 61 -9.509 21.637 2.392 393 HA ASN 61 HA ASN 61 -11.574 23.533 1.544 394 HB3 ASN 61 2HB ASN 61 -9.637 24.670 0.507 395 HD21 ASN 61 1HD2 ASN 61 -7.430 23.302 2.620 396 HD22 ASN 61 2HD2 ASN 61 -7.621 24.516 3.894 397 H LYS 62 H LYS 62 -9.521 21.055 0.117 398 HA LYS 62 HA LYS 62 -10.610 21.515 -2.608 399 HB3 LYS 62 2HB LYS 62 -7.956 20.407 -2.777 400 HG3 LYS 62 2HG LYS 62 -7.183 22.393 -3.560 401 HD3 LYS 62 2HD LYS 62 -9.953 23.233 -4.215 402 HE3 LYS 62 2HE LYS 62 -7.754 23.996 -5.291 403 HZ1 LYS 62 3HZ LYS 62 -7.145 21.472 -5.688 404 HZ2 LYS 62 1HZ LYS 62 -6.659 22.670 -6.691 405 HZ3 LYS 62 2HZ LYS 62 -7.940 21.734 -7.111 406 H ASP 63 H ASP 63 -9.273 19.360 -3.818 407 HA ASP 63 HA ASP 63 -10.400 16.971 -2.498 408 HB3 ASP 63 2HB ASP 63 -10.372 17.411 -5.493 409 H PHE 64 H PHE 64 -9.352 14.994 -3.281 410 HA PHE 64 HA PHE 64 -6.513 15.379 -2.786 411 HB3 PHE 64 2HB PHE 64 -7.642 13.792 -1.467 412 HD1 PHE 64 1HD PHE 64 -7.491 11.474 -4.374 413 HD2 PHE 64 2HD PHE 64 -10.068 13.535 -1.587 414 HE1 PHE 64 1HE PHE 64 -9.392 9.960 -4.955 415 HE2 PHE 64 2HE PHE 64 -11.922 12.029 -2.179 416 HZ PHE 64 HZ PHE 64 -11.584 10.225 -3.863 417 HA PRO 65 HA PRO 65 -4.869 15.049 -6.703 418 HB3 PRO 65 2HB PRO 65 -2.791 15.089 -5.855 419 HG3 PRO 65 2HG PRO 65 -2.196 13.842 -3.930 420 HD3 PRO 65 2HD PRO 65 -4.143 15.050 -3.359 421 H GLU 66 H GLU 66 -4.157 13.715 -8.597 422 HA GLU 66 HA GLU 66 -5.856 11.307 -8.882 423 HB3 GLU 66 2HB GLU 66 -6.171 13.157 -10.528 424 HG3 GLU 66 2HG GLU 66 -3.348 12.399 -11.407 425 H ILE 67 H ILE 67 -4.840 9.551 -10.126 426 HA ILE 67 HA ILE 67 -1.962 9.151 -9.464 427 HB ILE 67 HB ILE 67 -2.587 6.691 -9.481 428 HG13 ILE 67 2HG1 ILE 67 -4.688 6.943 -10.796 429 HG21 ILE 67 1HG2 ILE 67 -3.878 8.474 -7.400 430 HG22 ILE 67 2HG2 ILE 67 -3.488 6.750 -7.184 431 HG23 ILE 67 3HG2 ILE 67 -2.198 7.933 -7.431 432 HD11 ILE 67 3HD1 ILE 67 -5.377 5.741 -8.111 433 HD12 ILE 67 1HD1 ILE 67 -6.118 5.418 -9.691 434 HD13 ILE 67 2HD1 ILE 67 -4.455 4.917 -9.408 435 H GLN 68 H GLN 68 -0.899 7.633 -10.953 436 HA GLN 68 HA GLN 68 -1.986 7.567 -13.727 437 HB3 GLN 68 2HB GLN 68 0.361 7.764 -14.474 438 HG3 GLN 68 2HG GLN 68 0.792 10.114 -13.550 439 HE21 GLN 68 1HE2 GLN 68 -2.631 10.515 -13.515 440 HE22 GLN 68 2HE2 GLN 68 -2.733 11.054 -15.167 441 H LEU 69 H LEU 69 -2.978 5.804 -12.668 442 HA LEU 69 HA LEU 69 -1.481 3.325 -13.105 443 HB3 LEU 69 2HB LEU 69 -3.410 2.731 -11.101 444 HG LEU 69 HG LEU 69 -0.401 3.160 -11.092 445 HD11 LEU 69 1HD1 LEU 69 -2.160 2.056 -8.910 446 HD12 LEU 69 2HD1 LEU 69 -1.274 3.600 -8.916 447 HD13 LEU 69 3HD1 LEU 69 -0.382 2.046 -8.936 448 HD21 LEU 69 3HD2 LEU 69 -2.122 0.630 -11.083 449 HD22 LEU 69 1HD2 LEU 69 -0.335 0.693 -11.080 450 HD23 LEU 69 2HD2 LEU 69 -1.231 1.249 -12.483 451 H ASP 70 H ASP 70 -3.362 1.483 -13.132 452 HA ASP 70 HA ASP 70 -5.621 2.470 -14.807 453 HB3 ASP 70 2HB ASP 70 -5.454 -0.141 -15.493 454 H ASN 71 H ASN 71 -7.468 0.817 -14.766 455 HA ASN 71 HA ASN 71 -8.311 0.370 -11.987 456 HB3 ASN 71 2HB ASN 71 -9.569 -0.508 -14.608 457 HD21 ASN 71 1HD2 ASN 71 -10.324 -2.469 -13.379 458 HD22 ASN 71 2HD2 ASN 71 -11.687 -2.248 -12.325 459 H ILE 72 H ILE 72 -8.024 -1.510 -10.955 460 HA ILE 72 HA ILE 72 -7.381 -4.002 -12.412 461 HB ILE 72 HB ILE 72 -5.772 -2.960 -10.059 462 HG13 ILE 72 2HG1 ILE 72 -5.242 -1.907 -12.335 463 HG21 ILE 72 1HG2 ILE 72 -5.599 -5.599 -11.571 464 HG22 ILE 72 2HG2 ILE 72 -4.335 -5.021 -10.475 465 HG23 ILE 72 3HG2 ILE 72 -5.922 -5.369 -9.838 466 HD11 ILE 72 3HD1 ILE 72 -2.934 -3.489 -11.193 467 HD12 ILE 72 1HD1 ILE 72 -2.899 -1.981 -12.119 468 HD13 ILE 72 2HD1 ILE 72 -3.592 -1.986 -10.493 469 H ASP 73 H ASP 73 -7.685 -5.912 -10.949 470 HA ASP 73 HA ASP 73 -10.121 -5.684 -9.369 471 HB3 ASP 73 2HB ASP 73 -10.340 -6.979 -11.351 472 H TYR 74 H TYR 74 -9.352 -5.293 -7.301 473 HA TYR 74 HA TYR 74 -6.899 -6.570 -6.353 474 HB3 TYR 74 2HB TYR 74 -7.275 -5.252 -4.345 475 HD1 TYR 74 1HD TYR 74 -5.417 -4.641 -6.171 476 HD2 TYR 74 2HD TYR 74 -9.354 -2.884 -5.968 477 HE1 TYR 74 1HE TYR 74 -4.688 -2.844 -7.701 478 HE2 TYR 74 2HE TYR 74 -8.625 -1.045 -7.433 479 HH TYR 74 HH TYR 74 -6.743 -0.071 -8.500 480 H ASN 75 H ASN 75 -10.304 -7.273 -6.246 481 HA ASN 75 HA ASN 75 -10.423 -8.323 -3.640 482 HB3 ASN 75 2HB ASN 75 -12.179 -8.816 -6.058 483 HD21 ASN 75 1HD2 ASN 75 -12.051 -9.067 -2.386 484 HD22 ASN 75 2HD2 ASN 75 -13.465 -10.096 -2.359 485 H ASN 76 H ASN 76 -9.094 -9.793 -6.461 486 HA ASN 76 HA ASN 76 -9.336 -12.520 -5.442 487 HB3 ASN 76 2HB ASN 76 -9.809 -12.097 -7.767 488 HD21 ASN 76 1HD2 ASN 76 -9.530 -10.056 -8.820 489 HD22 ASN 76 2HD2 ASN 76 -7.921 -9.424 -9.115 490 H TYR 77 H TYR 77 -7.455 -10.152 -4.356 491 HA TYR 77 HA TYR 77 -5.097 -11.920 -4.057 492 HB3 TYR 77 2HB TYR 77 -3.845 -9.901 -3.389 493 HD1 TYR 77 1HD TYR 77 -5.976 -8.721 -6.201 494 HD2 TYR 77 2HD TYR 77 -2.346 -10.770 -5.125 495 HE1 TYR 77 1HE TYR 77 -5.286 -8.697 -8.550 496 HE2 TYR 77 2HE TYR 77 -1.642 -10.774 -7.501 497 HH TYR 77 HH TYR 77 -3.747 -9.386 -10.079 498 H ASP 78 H ASP 78 -4.619 -12.575 -2.021 499 HA ASP 78 HA ASP 78 -6.807 -12.191 -0.060 500 HB3 ASP 78 2HB ASP 78 -4.352 -13.812 0.575 501 H LEU 79 H LEU 79 -3.438 -11.323 -0.517 502 HA LEU 79 HA LEU 79 -3.542 -9.504 1.829 503 HB3 LEU 79 2HB LEU 79 -0.922 -10.611 0.909 504 HG LEU 79 HG LEU 79 -2.042 -10.571 3.723 505 HD11 LEU 79 1HD1 LEU 79 0.234 -10.728 4.418 506 HD12 LEU 79 2HD1 LEU 79 0.818 -10.600 2.738 507 HD13 LEU 79 3HD1 LEU 79 -0.109 -12.018 3.276 508 HD21 LEU 79 3HD2 LEU 79 -0.444 -8.359 2.377 509 HD22 LEU 79 1HD2 LEU 79 -0.683 -8.505 4.120 510 HD23 LEU 79 2HD2 LEU 79 -2.073 -8.224 3.081 511 H ILE 80 H ILE 80 -2.854 -7.426 1.361 512 HA ILE 80 HA ILE 80 -1.604 -6.882 -1.286 513 HB ILE 80 HB ILE 80 -3.944 -5.362 -0.068 514 HG13 ILE 80 2HG1 ILE 80 -4.773 -7.464 -0.923 515 HG21 ILE 80 1HG2 ILE 80 -2.316 -3.965 -1.343 516 HG22 ILE 80 2HG2 ILE 80 -2.536 -5.028 -2.748 517 HG23 ILE 80 3HG2 ILE 80 -3.884 -4.035 -2.121 518 HD11 ILE 80 3HD1 ILE 80 -6.225 -6.899 -2.700 519 HD12 ILE 80 1HD1 ILE 80 -6.049 -5.425 -1.726 520 HD13 ILE 80 2HD1 ILE 80 -5.168 -5.601 -3.274 521 H LEU 81 H LEU 81 0.387 -6.216 -0.764 522 HA LEU 81 HA LEU 81 0.898 -4.575 1.648 523 HB3 LEU 81 2HB LEU 81 3.238 -4.658 0.679 524 HG LEU 81 HG LEU 81 3.921 -6.802 1.254 525 HD11 LEU 81 1HD1 LEU 81 2.995 -5.519 3.158 526 HD12 LEU 81 2HD1 LEU 81 2.900 -7.275 3.391 527 HD13 LEU 81 3HD1 LEU 81 1.441 -6.376 2.958 528 HD21 LEU 81 3HD2 LEU 81 2.524 -8.791 1.431 529 HD22 LEU 81 1HD2 LEU 81 2.489 -8.130 -0.213 530 HD23 LEU 81 2HD2 LEU 81 1.111 -7.888 0.870 531 H ILE 82 H ILE 82 1.270 -2.306 1.538 532 HA ILE 82 HA ILE 82 1.431 -1.068 -1.148 533 HB ILE 82 HB ILE 82 -0.475 -0.407 1.117 534 HG13 ILE 82 2HG1 ILE 82 -1.084 -2.156 -0.672 535 HG21 ILE 82 1HG2 ILE 82 -1.185 1.523 -0.399 536 HG22 ILE 82 2HG2 ILE 82 0.338 1.747 0.449 537 HG23 ILE 82 3HG2 ILE 82 0.343 1.313 -1.270 538 HD11 ILE 82 3HD1 ILE 82 -3.311 -1.483 -0.996 539 HD12 ILE 82 1HD1 ILE 82 -2.822 -1.007 0.644 540 HD13 ILE 82 2HD1 ILE 82 -2.946 0.216 -0.647 541 H GLY 83 H GLY 83 2.664 0.902 -1.223 542 HA2 GLY 83 1HA GLY 83 3.706 1.957 1.326 543 HA3 GLY 83 2HA GLY 83 4.840 1.400 0.121 544 H SER 84 H SER 84 4.991 4.010 1.100 545 HA SER 84 HA SER 84 4.544 5.593 -1.317 546 HB3 SER 84 2HB SER 84 2.390 5.876 -0.376 547 HG SER 84 HG SER 84 2.860 5.237 1.802 548 HA PRO 85 HA PRO 85 8.016 7.882 0.584 549 HB3 PRO 85 2HB PRO 85 8.479 8.439 -1.580 550 HG3 PRO 85 2HG PRO 85 6.814 9.126 -3.138 551 HD3 PRO 85 2HD PRO 85 6.049 7.053 -2.422 552 H VAL 86 H VAL 86 8.292 9.613 2.164 553 HA VAL 86 HA VAL 86 5.711 10.530 3.210 554 HB VAL 86 HB VAL 86 6.654 10.431 5.161 555 HG11 VAL 86 1HG1 VAL 86 6.884 8.344 4.112 556 HG12 VAL 86 2HG1 VAL 86 8.626 8.618 4.047 557 HG13 VAL 86 3HG1 VAL 86 7.794 8.625 5.630 558 HG21 VAL 86 3HG2 VAL 86 9.318 11.471 4.667 559 HG22 VAL 86 1HG2 VAL 86 7.849 12.242 5.367 560 HG23 VAL 86 2HG2 VAL 86 8.545 10.886 6.196 561 H TRP 87 H TRP 87 5.294 12.975 3.051 562 HA TRP 87 HA TRP 87 7.355 14.547 1.640 563 HB3 TRP 87 2HB TRP 87 4.833 15.882 2.378 564 HD1 TRP 87 HD TRP 87 5.678 18.062 1.249 565 HE1 TRP 87 1HE TRP 87 6.233 18.743 -1.186 566 HE3 TRP 87 3HE TRP 87 5.871 13.432 -0.897 567 HZ2 TRP 87 2HZ TRP 87 6.548 17.504 -3.655 568 HZ3 TRP 87 3HZ TRP 87 6.051 13.213 -3.359 569 HH2 TRP 87 HH TRP 87 6.388 15.246 -4.783 570 H SER 88 H SER 88 6.760 17.022 2.887 571 HA SER 88 HA SER 88 8.391 16.892 5.228 572 HB3 SER 88 2HB SER 88 6.728 19.327 4.864 573 HG SER 88 HG SER 88 8.705 19.119 6.077 574 H GLY 89 H GLY 89 7.311 15.328 6.390 575 HA2 GLY 89 1HA GLY 89 6.417 15.176 8.664 576 HA3 GLY 89 2HA GLY 89 5.233 16.402 8.265 577 H TYR 90 H TYR 90 4.355 15.336 5.742 578 HA TYR 90 HA TYR 90 2.741 13.031 6.669 579 HB3 TYR 90 2HB TYR 90 0.787 14.293 6.242 580 HD1 TYR 90 1HD TYR 90 1.432 14.244 8.826 581 HD2 TYR 90 2HD TYR 90 2.295 17.550 6.196 582 HE1 TYR 90 1HE TYR 90 1.884 15.668 10.776 583 HE2 TYR 90 2HE TYR 90 2.751 18.998 8.157 584 HH TYR 90 HH TYR 90 2.727 19.150 10.493 585 HA PRO 91 HA PRO 91 3.732 11.669 2.573 586 HB3 PRO 91 2HB PRO 91 2.648 9.701 3.013 587 HG3 PRO 91 2HG PRO 91 0.529 9.653 4.131 588 HD3 PRO 91 2HD PRO 91 1.953 10.922 5.537 589 H ALA 92 H ALA 92 3.068 11.726 0.188 590 HA ALA 92 HA ALA 92 2.042 14.300 -0.660 591 HB1 ALA 92 1HB ALA 92 2.542 13.441 -2.868 592 HB2 ALA 92 2HB ALA 92 3.830 12.897 -1.791 593 HB3 ALA 92 3HB ALA 92 2.557 11.767 -2.290 594 H THR 93 H THR 93 0.121 12.490 0.835 595 HA THR 93 HA THR 93 -1.622 10.986 0.695 596 HB THR 93 HB THR 93 -3.636 12.216 -0.168 597 HG1 THR 93 1HG THR 93 -2.404 13.287 -1.876 598 HG21 THR 93 3HG2 THR 93 -3.473 14.112 1.404 599 HG22 THR 93 1HG2 THR 93 -1.718 13.992 1.410 600 HG23 THR 93 2HG2 THR 93 -2.701 12.701 2.135 601 HA PRO 94 HA PRO 94 -0.907 9.900 -3.795 602 HB3 PRO 94 2HB PRO 94 1.394 9.527 -3.684 603 HG3 PRO 94 2HG PRO 94 2.398 8.650 -1.730 604 HD3 PRO 94 2HD PRO 94 1.192 10.434 -0.947 605 H ILE 95 H ILE 95 -1.397 7.635 -1.099 606 HA ILE 95 HA ILE 95 -2.483 5.591 -2.894 607 HB ILE 95 HB ILE 95 -2.430 5.523 0.142 608 HG13 ILE 95 2HG1 ILE 95 -0.259 4.301 -0.009 609 HG21 ILE 95 1HG2 ILE 95 -2.068 3.183 -1.779 610 HG22 ILE 95 2HG2 ILE 95 -2.557 3.187 -0.062 611 HG23 ILE 95 3HG2 ILE 95 -3.650 3.724 -1.325 612 HD11 ILE 95 3HD1 ILE 95 1.266 4.846 -1.928 613 HD12 ILE 95 1HD1 ILE 95 -0.007 3.717 -2.373 614 HD13 ILE 95 2HD1 ILE 95 -0.108 5.420 -2.860 615 H LYS 96 H LYS 96 -3.687 8.403 -1.343 616 HA LYS 96 HA LYS 96 -6.158 7.692 -0.278 617 HB3 LYS 96 2HB LYS 96 -5.251 10.188 -1.772 618 HG3 LYS 96 2HG LYS 96 -7.674 10.219 -1.550 619 HD3 LYS 96 2HD LYS 96 -7.202 9.932 1.449 620 HE3 LYS 96 2HE LYS 96 -9.614 10.642 -0.237 621 HZ1 LYS 96 3HZ LYS 96 -10.865 10.750 1.670 622 HZ2 LYS 96 1HZ LYS 96 -9.679 10.385 2.704 623 HZ3 LYS 96 2HZ LYS 96 -10.230 9.237 1.688 624 H THR 97 H THR 97 -5.467 8.680 -3.703 625 HA THR 97 HA THR 97 -8.055 8.320 -4.653 626 HB THR 97 HB THR 97 -5.638 7.749 -6.336 627 HG1 THR 97 1HG THR 97 -5.818 10.423 -5.985 628 HG21 THR 97 3HG2 THR 97 -6.671 9.290 -7.921 629 HG22 THR 97 1HG2 THR 97 -7.899 9.747 -6.722 630 HG23 THR 97 2HG2 THR 97 -7.878 8.099 -7.378 631 H LEU 98 H LEU 98 -5.389 5.951 -4.353 632 HA LEU 98 HA LEU 98 -6.649 3.873 -5.903 633 HB3 LEU 98 2HB LEU 98 -4.952 2.403 -4.724 634 HG LEU 98 HG LEU 98 -3.897 4.994 -5.908 635 HD11 LEU 98 1HD1 LEU 98 -2.372 2.424 -5.388 636 HD12 LEU 98 2HD1 LEU 98 -2.189 3.916 -4.439 637 HD13 LEU 98 3HD1 LEU 98 -1.760 3.901 -6.155 638 HD21 LEU 98 3HD2 LEU 98 -3.495 3.612 -7.893 639 HD22 LEU 98 1HD2 LEU 98 -5.202 3.491 -7.457 640 HD23 LEU 98 2HD2 LEU 98 -4.104 2.173 -7.059 641 H LEU 99 H LEU 99 -6.551 4.680 -2.454 642 HA LEU 99 HA LEU 99 -7.727 2.314 -1.440 643 HB3 LEU 99 2HB LEU 99 -8.373 3.820 0.525 644 HG LEU 99 HG LEU 99 -5.574 3.815 -0.605 645 HD11 LEU 99 1HD1 LEU 99 -5.696 5.814 0.782 646 HD12 LEU 99 2HD1 LEU 99 -4.733 4.567 1.597 647 HD13 LEU 99 3HD1 LEU 99 -6.408 4.872 2.098 648 HD21 LEU 99 3HD2 LEU 99 -6.488 1.657 0.160 649 HD22 LEU 99 1HD2 LEU 99 -6.696 2.367 1.781 650 HD23 LEU 99 2HD2 LEU 99 -5.076 2.191 1.072 651 H ASP 100 H ASP 100 -9.200 5.310 -2.671 652 HA ASP 100 HA ASP 100 -11.876 4.816 -1.971 653 HB3 ASP 100 2HB ASP 100 -10.908 6.116 -4.544 654 H GLN 101 H GLN 101 -9.939 3.438 -4.523 655 HA GLN 101 HA GLN 101 -12.204 2.366 -6.069 656 HB3 GLN 101 2HB GLN 101 -10.363 1.411 -7.471 657 HG3 GLN 101 2HG GLN 101 -10.131 4.357 -6.717 658 HE21 GLN 101 1HE2 GLN 101 -9.408 5.602 -8.725 659 HE22 GLN 101 2HE2 GLN 101 -7.829 5.168 -9.373 660 H MET 102 H MET 102 -9.410 1.082 -4.205 661 HA MET 102 HA MET 102 -10.377 -1.638 -4.270 662 HB3 MET 102 2HB MET 102 -8.011 -1.098 -4.309 663 HG3 MET 102 2HG MET 102 -8.191 0.782 -2.614 664 HE1 MET 102 3HE MET 102 -6.208 -2.089 -0.900 665 HE2 MET 102 1HE MET 102 -7.126 -2.418 0.589 666 HE3 MET 102 2HE MET 102 -7.769 -2.944 -0.975 667 H LYS 103 H LYS 103 -11.644 0.830 -2.492 668 HA LYS 103 HA LYS 103 -11.741 0.242 0.089 669 HB3 LYS 103 2HB LYS 103 -14.386 0.775 -0.148 670 HG3 LYS 103 2HG LYS 103 -14.110 3.139 -0.443 671 HD3 LYS 103 2HD LYS 103 -11.878 2.162 1.368 672 HE3 LYS 103 2HE LYS 103 -13.795 4.535 1.351 673 HZ1 LYS 103 3HZ LYS 103 -11.798 3.791 3.387 674 HZ2 LYS 103 1HZ LYS 103 -13.439 3.819 3.594 675 HZ3 LYS 103 2HZ LYS 103 -12.626 5.201 3.355 676 H ASN 104 H ASN 104 -13.912 -1.299 -2.112 677 HA ASN 104 HA ASN 104 -14.825 -3.099 0.025 678 HB3 ASN 104 2HB ASN 104 -15.954 -2.782 -2.785 679 HD21 ASN 104 1HD2 ASN 104 -16.531 -3.891 0.623 680 HD22 ASN 104 2HD2 ASN 104 -16.743 -5.512 0.001 681 H TYR 105 H TYR 105 -12.374 -3.614 -0.327 682 HA TYR 105 HA TYR 105 -12.131 -6.150 -1.815 683 HB3 TYR 105 2HB TYR 105 -10.173 -4.409 -1.297 684 HD1 TYR 105 2HD TYR 105 -11.413 -4.086 1.510 685 HD2 TYR 105 1HD TYR 105 -8.141 -6.535 0.079 686 HE1 TYR 105 2HE TYR 105 -10.554 -4.290 3.803 687 HE2 TYR 105 1HE TYR 105 -7.277 -6.717 2.353 688 HH TYR 105 HH TYR 105 -8.120 -6.520 4.706 689 H ARG 106 H ARG 106 -11.008 -7.882 -0.123 690 HA ARG 106 HA ARG 106 -12.029 -7.752 2.599 691 HB3 ARG 106 2HB ARG 106 -12.438 -10.211 2.582 692 HG3 ARG 106 2HG ARG 106 -14.261 -9.038 0.465 693 HD3 ARG 106 2HD ARG 106 -15.349 -10.313 2.900 694 HE ARG 106 HE ARG 106 -15.614 -10.836 -0.035 695 HH11 ARG 106 1HH1 ARG 106 -17.163 -10.773 3.148 696 HH12 ARG 106 2HH1 ARG 106 -18.639 -11.503 2.637 697 HH21 ARG 106 1HH2 ARG 106 -17.424 -11.972 -0.702 698 HH22 ARG 106 2HH2 ARG 106 -18.819 -12.159 0.267 699 H GLY 107 H GLY 107 -10.553 -9.110 3.991 700 HA2 GLY 107 1HA GLY 107 -8.824 -10.694 4.161 701 HA3 GLY 107 2HA GLY 107 -8.138 -10.182 2.618 702 H GLU 108 H GLU 108 -6.089 -9.567 3.204 703 HA GLU 108 HA GLU 108 -5.679 -7.950 5.680 704 HB3 GLU 108 2HB GLU 108 -3.359 -8.938 5.438 705 HG3 GLU 108 2HG GLU 108 -5.582 -11.016 5.656 706 H VAL 109 H VAL 109 -4.205 -6.122 5.605 707 HA VAL 109 HA VAL 109 -2.970 -5.451 3.043 708 HB VAL 109 HB VAL 109 -4.715 -3.517 4.633 709 HG11 VAL 109 1HG1 VAL 109 -3.100 -3.045 2.084 710 HG12 VAL 109 2HG1 VAL 109 -4.296 -1.922 2.741 711 HG13 VAL 109 3HG1 VAL 109 -2.846 -2.272 3.666 712 HG21 VAL 109 3HG2 VAL 109 -6.138 -4.938 3.331 713 HG22 VAL 109 1HG2 VAL 109 -6.126 -3.343 2.602 714 HG23 VAL 109 2HG2 VAL 109 -5.184 -4.667 1.859 715 H ALA 110 H ALA 110 -1.039 -4.125 3.459 716 HA ALA 110 HA ALA 110 -0.685 -3.168 6.203 717 HB1 ALA 110 1HB ALA 110 1.589 -3.914 6.426 718 HB2 ALA 110 2HB ALA 110 0.566 -5.339 6.171 719 HB3 ALA 110 3HB ALA 110 1.551 -4.700 4.834 720 H SER 111 H SER 111 0.861 -1.416 6.292 721 HA SER 111 HA SER 111 1.224 -0.029 3.678 722 HB3 SER 111 2HB SER 111 0.040 1.085 6.240 723 HG SER 111 HG SER 111 -0.505 2.767 4.567 724 H PHE 112 H PHE 112 3.414 -0.106 3.468 725 HA PHE 112 HA PHE 112 5.087 0.635 5.825 726 HB3 PHE 112 2HB PHE 112 6.129 -1.228 5.130 727 HD1 PHE 112 1HD PHE 112 5.759 0.467 1.794 728 HD2 PHE 112 2HD PHE 112 5.576 -3.232 3.984 729 HE1 PHE 112 1HE PHE 112 5.090 -0.770 -0.264 730 HE2 PHE 112 2HE PHE 112 5.143 -4.461 1.915 731 HZ PHE 112 HZ PHE 112 4.885 -3.218 -0.246 732 H PHE 113 H PHE 113 7.047 2.033 5.092 733 HA PHE 113 HA PHE 113 6.788 3.816 2.933 734 HB3 PHE 113 2HB PHE 113 4.958 4.826 4.321 735 HD1 PHE 113 1HD PHE 113 6.030 3.347 6.858 736 HD2 PHE 113 2HD PHE 113 5.957 7.456 5.660 737 HE1 PHE 113 1HE PHE 113 6.766 4.019 9.111 738 HE2 PHE 113 2HE PHE 113 6.710 8.139 7.923 739 HZ PHE 113 HZ PHE 113 7.005 6.438 9.681 740 H THR 114 H THR 114 8.517 5.598 3.271 741 HA THR 114 HA THR 114 10.728 4.702 5.107 742 HB THR 114 HB THR 114 12.203 5.313 2.951 743 HG1 THR 114 1HG THR 114 10.647 5.605 1.439 744 HG21 THR 114 3HG2 THR 114 12.296 2.916 2.397 745 HG22 THR 114 1HG2 THR 114 10.867 2.620 3.422 746 HG23 THR 114 2HG2 THR 114 12.383 3.226 4.136 747 H SER 115 H SER 115 9.989 6.515 6.432 748 HA SER 115 HA SER 115 10.130 9.190 5.548 749 HB3 SER 115 2HB SER 115 8.887 9.015 7.479 750 HG SER 115 HG SER 115 10.835 7.239 8.550 751 H ALA 116 H ALA 116 11.438 10.755 6.641 752 HA ALA 116 HA ALA 116 14.282 10.376 5.984 753 HB1 ALA 116 1HB ALA 116 14.390 12.825 6.234 754 HB2 ALA 116 2HB ALA 116 13.059 12.379 5.156 755 HB3 ALA 116 3HB ALA 116 12.721 12.868 6.835 756 H GLY 117 H GLY 117 13.247 8.871 8.248 757 HA2 GLY 117 1HA GLY 117 14.107 8.285 10.287 758 HA3 GLY 117 2HA GLY 117 15.226 9.637 10.034 759 H THR 118 H THR 118 12.374 11.151 9.874 760 HA THR 118 HA THR 118 11.780 11.426 12.731 761 HB THR 118 HB THR 118 11.681 13.940 12.319 762 HG1 THR 118 1HG THR 118 13.161 14.586 10.563 763 HG21 THR 118 3HG2 THR 118 13.548 12.900 13.576 764 HG22 THR 118 1HG2 THR 118 14.057 14.336 12.675 765 HG23 THR 118 2HG2 THR 118 14.466 12.725 12.062 766 H ASN 119 H ASN 119 9.623 12.887 12.774 767 HA ASN 119 HA ASN 119 7.445 13.034 12.245 768 HB3 ASN 119 2HB ASN 119 6.728 13.355 9.966 769 HD21 ASN 119 1HD2 ASN 119 9.462 14.481 8.577 770 HD22 ASN 119 2HD2 ASN 119 9.519 16.067 9.297 771 H HIS 120 H HIS 120 8.813 10.325 12.538 772 HA HIS 120 HA HIS 120 7.747 8.456 10.795 773 HB3 HIS 120 2HB HIS 120 8.549 8.069 13.711 774 HD1 HIS 120 1HD HIS 120 9.232 6.041 10.428 775 HD2 HIS 120 2HD HIS 120 7.488 5.735 14.283 776 HE1 HIS 120 1HE HIS 120 8.482 3.616 10.747 777 H LYS 121 H LYS 121 6.342 9.422 14.069 778 HA LYS 121 HA LYS 121 4.111 7.680 13.923 779 HB3 LYS 121 2HB LYS 121 3.394 9.750 15.514 780 HG3 LYS 121 2HG LYS 121 5.519 7.729 16.283 781 HD3 LYS 121 2HD LYS 121 4.964 9.746 17.891 782 HE3 LYS 121 2HE LYS 121 2.720 7.798 18.616 783 HZ1 LYS 121 3HZ LYS 121 3.506 9.294 20.403 784 HZ2 LYS 121 1HZ LYS 121 1.980 9.659 19.940 785 HZ3 LYS 121 2HZ LYS 121 3.196 10.592 19.417 786 H ALA 122 H ALA 122 4.730 11.071 12.887 787 HA ALA 122 HA ALA 122 2.147 11.875 12.432 788 HB1 ALA 122 1HB ALA 122 4.047 13.412 12.380 789 HB2 ALA 122 2HB ALA 122 4.629 12.680 10.863 790 HB3 ALA 122 3HB ALA 122 3.104 13.554 10.890 791 H TYR 123 H TYR 123 4.256 10.174 10.030 792 HA TYR 123 HA TYR 123 2.474 10.200 7.835 793 HB3 TYR 123 2HB TYR 123 4.536 8.208 8.679 794 HD1 TYR 123 2HD TYR 123 3.340 9.079 5.290 795 HD2 TYR 123 1HD TYR 123 3.422 6.016 8.308 796 HE1 TYR 123 2HE TYR 123 2.163 7.497 3.747 797 HE2 TYR 123 1HE TYR 123 2.390 4.401 6.730 798 HH TYR 123 HH TYR 123 1.518 4.073 4.545 799 H VAL 124 H VAL 124 2.721 7.759 10.491 800 HA VAL 124 HA VAL 124 0.677 6.020 9.553 801 HB VAL 124 HB VAL 124 1.587 6.498 12.428 802 HG11 VAL 124 1HG1 VAL 124 0.324 4.056 11.103 803 HG12 VAL 124 2HG1 VAL 124 0.927 4.145 12.769 804 HG13 VAL 124 3HG1 VAL 124 -0.454 5.118 12.285 805 HG21 VAL 124 3HG2 VAL 124 2.718 4.650 10.303 806 HG22 VAL 124 1HG2 VAL 124 3.558 6.042 11.031 807 HG23 VAL 124 2HG2 VAL 124 3.175 4.644 12.023 808 H SER 125 H SER 125 0.641 8.786 11.804 809 HA SER 125 HA SER 125 -2.052 8.625 12.601 810 HB3 SER 125 2HB SER 125 -0.754 11.324 12.314 811 HG SER 125 HG SER 125 -1.485 11.458 14.428 812 H HIS 126 H HIS 126 -0.512 10.223 9.813 813 HA HIS 126 HA HIS 126 -2.893 11.370 8.722 814 HB3 HIS 126 2HB HIS 126 -1.048 10.679 6.624 815 HD1 HIS 126 1HD HIS 126 -1.675 12.817 5.172 816 HD2 HIS 126 2HD HIS 126 -1.134 13.540 9.297 817 HE1 HIS 126 1HE HIS 126 -2.351 15.115 5.533 818 H PHE 127 H PHE 127 -1.133 8.350 7.806 819 HA PHE 127 HA PHE 127 -2.903 7.684 5.755 820 HB3 PHE 127 2HB PHE 127 -1.301 5.730 7.435 821 HD1 PHE 127 1HD PHE 127 -2.810 3.813 6.908 822 HD2 PHE 127 2HD PHE 127 -1.095 6.214 3.726 823 HE1 PHE 127 1HE PHE 127 -3.395 2.080 5.242 824 HE2 PHE 127 2HE PHE 127 -1.650 4.440 2.116 825 HZ PHE 127 HZ PHE 127 -2.817 2.380 2.861 826 H ASN 128 H ASN 128 -3.266 7.068 9.198 827 HA ASN 128 HA ASN 128 -5.435 5.275 9.243 828 HB3 ASN 128 2HB ASN 128 -6.112 6.894 11.300 829 HD21 ASN 128 1HD2 ASN 128 -2.724 5.691 11.061 830 HD22 ASN 128 2HD2 ASN 128 -3.066 4.181 11.901 831 H GLU 129 H GLU 129 -5.809 8.905 9.294 832 HA GLU 129 HA GLU 129 -8.581 8.938 8.951 833 HB3 GLU 129 2HB GLU 129 -7.714 11.211 7.631 834 HG3 GLU 129 2HG GLU 129 -7.434 11.026 10.636 835 H TRP 130 H TRP 130 -6.032 9.074 6.525 836 HA TRP 130 HA TRP 130 -7.860 9.382 4.285 837 HB3 TRP 130 2HB TRP 130 -5.778 9.473 3.015 838 HD1 TRP 130 HD TRP 130 -3.732 10.770 5.681 839 HE1 TRP 130 1HE TRP 130 -4.304 13.134 6.504 840 HE3 TRP 130 3HE TRP 130 -8.168 11.491 3.257 841 HZ2 TRP 130 2HZ TRP 130 -6.142 15.198 5.861 842 HZ3 TRP 130 3HZ TRP 130 -9.355 13.655 3.438 843 HH2 TRP 130 HH TRP 130 -8.344 15.530 4.718 844 H ALA 131 H ALA 131 -7.257 6.606 6.049 845 HA ALA 131 HA ALA 131 -7.962 4.892 3.735 846 HB1 ALA 131 1HB ALA 131 -6.391 3.194 4.444 847 HB2 ALA 131 2HB ALA 131 -5.487 4.712 4.287 848 HB3 ALA 131 3HB ALA 131 -5.957 4.118 5.891 849 H ASP 132 H ASP 132 -9.158 6.026 6.631 850 HA ASP 132 HA ASP 132 -9.774 3.710 8.050 851 HB3 ASP 132 2HB ASP 132 -11.509 6.192 7.942 852 H GLY 133 H GLY 133 -11.111 2.162 7.735 853 HA2 GLY 133 1HA GLY 133 -13.568 1.687 7.275 854 HA3 GLY 133 2HA GLY 133 -13.216 2.149 5.607 855 H LEU 134 H LEU 134 -10.479 0.918 5.875 856 HA LEU 134 HA LEU 134 -11.120 -1.781 4.963 857 HB3 LEU 134 2HB LEU 134 -8.549 -1.789 4.605 858 HG LEU 134 HG LEU 134 -10.306 0.327 3.336 859 HD11 LEU 134 1HD1 LEU 134 -7.489 -0.410 2.483 860 HD12 LEU 134 2HD1 LEU 134 -7.911 1.084 3.347 861 HD13 LEU 134 3HD1 LEU 134 -8.575 0.764 1.721 862 HD21 LEU 134 3HD2 LEU 134 -9.101 -2.267 2.273 863 HD22 LEU 134 1HD2 LEU 134 -10.174 -1.175 1.384 864 HD23 LEU 134 2HD2 LEU 134 -10.780 -2.054 2.793 865 H ASN 135 H ASN 135 -8.900 -3.220 5.798 866 HA ASN 135 HA ASN 135 -8.758 -3.165 8.736 867 HB3 ASN 135 2HB ASN 135 -8.981 -5.585 6.906 868 HD21 ASN 135 1HD2 ASN 135 -7.518 -7.146 7.340 869 HD22 ASN 135 2HD2 ASN 135 -7.070 -7.629 8.965 870 H VAL 136 H VAL 136 -6.480 -3.925 9.377 871 HA VAL 136 HA VAL 136 -4.560 -4.148 7.189 872 HB VAL 136 HB VAL 136 -5.032 -1.702 7.768 873 HG11 VAL 136 1HG1 VAL 136 -3.944 -0.694 9.663 874 HG12 VAL 136 2HG1 VAL 136 -5.096 -1.918 10.223 875 HG13 VAL 136 3HG1 VAL 136 -3.353 -2.283 10.203 876 HG21 VAL 136 3HG2 VAL 136 -3.078 -2.271 6.470 877 HG22 VAL 136 1HG2 VAL 136 -2.678 -0.990 7.613 878 HG23 VAL 136 2HG2 VAL 136 -2.156 -2.651 7.948 879 H ILE 137 H ILE 137 -2.525 -5.153 7.935 880 HA ILE 137 HA ILE 137 -2.698 -6.350 10.632 881 HB ILE 137 HB ILE 137 -1.350 -8.140 9.754 882 HG13 ILE 137 2HG1 ILE 137 -0.075 -6.823 8.044 883 HG21 ILE 137 1HG2 ILE 137 -3.725 -7.623 7.893 884 HG22 ILE 137 2HG2 ILE 137 -3.081 -9.184 8.446 885 HG23 ILE 137 3HG2 ILE 137 -3.877 -8.117 9.591 886 HD11 ILE 137 3HD1 ILE 137 -1.542 -9.131 6.738 887 HD12 ILE 137 1HD1 ILE 137 0.043 -8.477 6.312 888 HD13 ILE 137 2HD1 ILE 137 -0.180 -9.322 7.860 889 H GLY 138 H GLY 138 -1.094 -3.774 9.162 890 HA2 GLY 138 1HA GLY 138 0.126 -3.057 11.475 891 HA3 GLY 138 2HA GLY 138 1.391 -3.958 10.631 892 H VAL 139 H VAL 139 1.747 -1.328 11.237 893 HA VAL 139 HA VAL 139 2.196 -0.252 8.564 894 HB VAL 139 HB VAL 139 1.176 1.653 10.715 895 HG11 VAL 139 1HG1 VAL 139 2.690 2.499 8.772 896 HG12 VAL 139 2HG1 VAL 139 1.329 2.132 7.726 897 HG13 VAL 139 3HG1 VAL 139 1.121 3.307 9.010 898 HG21 VAL 139 3HG2 VAL 139 -0.911 1.862 9.351 899 HG22 VAL 139 1HG2 VAL 139 -0.391 0.453 8.402 900 HG23 VAL 139 2HG2 VAL 139 -0.752 0.286 10.132 901 H ALA 140 H ALA 140 4.359 -0.127 8.536 902 HA ALA 140 HA ALA 140 5.924 0.883 10.793 903 HB1 ALA 140 1HB ALA 140 7.390 -1.039 10.978 904 HB2 ALA 140 2HB ALA 140 5.726 -1.564 11.275 905 HB3 ALA 140 3HB ALA 140 6.499 -1.907 9.727 906 H ARG 141 H ARG 141 8.517 0.327 9.719 907 HA ARG 141 HA ARG 141 8.277 1.942 7.228 908 HB3 ARG 141 2HB ARG 141 9.423 3.111 9.019 909 HG3 ARG 141 2HG ARG 141 11.981 1.802 8.873 910 HD3 ARG 141 2HD ARG 141 10.325 2.009 11.390 911 HE ARG 141 HE ARG 141 13.165 1.940 10.750 912 HH11 ARG 141 1HH1 ARG 141 10.823 3.158 13.155 913 HH12 ARG 141 2HH1 ARG 141 12.004 3.446 14.372 914 HH21 ARG 141 1HH2 ARG 141 14.713 2.209 12.436 915 HH22 ARG 141 2HH2 ARG 141 14.225 2.804 14.000 916 H ASP 142 H ASP 142 9.970 1.627 5.639 917 HA ASP 142 HA ASP 142 11.149 0.346 4.183 918 HB3 ASP 142 2HB ASP 142 13.082 -0.854 5.271 919 H ASP 143 H ASP 143 12.212 -2.397 4.770 920 HA ASP 143 HA ASP 143 9.825 -4.079 4.290 921 HB3 ASP 143 2HB ASP 143 11.695 -4.232 2.742 922 H SER 144 H SER 144 10.820 -2.757 6.965 923 HA SER 144 HA SER 144 12.124 -4.605 8.510 924 HB3 SER 144 2HB SER 144 9.999 -2.732 9.619 925 HG SER 144 HG SER 144 12.629 -3.459 10.431 926 H GLU 145 H GLU 145 8.568 -4.419 8.037 927 HA GLU 145 HA GLU 145 8.275 -6.914 9.613 928 HB3 GLU 145 2HB GLU 145 6.120 -6.008 10.340 929 HG3 GLU 145 2HG GLU 145 8.510 -4.163 10.786 930 H VAL 146 H VAL 146 8.506 -6.359 6.455 931 HA VAL 146 HA VAL 146 6.247 -7.720 5.384 932 HB VAL 146 HB VAL 146 8.112 -6.695 4.073 933 HG11 VAL 146 1HG1 VAL 146 9.998 -7.831 5.417 934 HG12 VAL 146 2HG1 VAL 146 9.644 -9.282 4.492 935 HG13 VAL 146 3HG1 VAL 146 10.163 -7.805 3.655 936 HG21 VAL 146 3HG2 VAL 146 8.117 -8.493 2.324 937 HG22 VAL 146 1HG2 VAL 146 7.389 -9.597 3.487 938 HG23 VAL 146 2HG2 VAL 146 6.499 -8.142 2.996 939 H ASP 147 H ASP 147 8.986 -8.768 7.235 940 HA ASP 147 HA ASP 147 8.847 -11.554 7.087 941 HB3 ASP 147 2HB ASP 147 10.086 -11.127 9.436 942 H LYS 148 H LYS 148 6.542 -9.538 8.569 943 HA LYS 148 HA LYS 148 5.340 -11.953 9.769 944 HB3 LYS 148 2HB LYS 148 5.934 -10.441 11.563 945 HG3 LYS 148 2HG LYS 148 4.291 -8.366 10.130 946 HD3 LYS 148 2HD LYS 148 4.068 -8.435 12.738 947 HE3 LYS 148 2HE LYS 148 6.922 -7.490 12.240 948 HZ1 LYS 148 3HZ LYS 148 5.754 -5.753 13.413 949 HZ2 LYS 148 1HZ LYS 148 6.853 -6.446 14.397 950 HZ3 LYS 148 2HZ LYS 148 5.272 -6.805 14.589 951 H TRP 149 H TRP 149 4.911 -9.062 7.699 952 HA TRP 149 HA TRP 149 2.083 -9.514 7.454 953 HB3 TRP 149 2HB TRP 149 2.169 -7.692 5.841 954 HD1 TRP 149 HD TRP 149 2.023 -7.983 9.167 955 HE1 TRP 149 1HE TRP 149 2.629 -5.973 10.550 956 HE3 TRP 149 3HE TRP 149 4.371 -5.267 5.556 957 HZ2 TRP 149 2HZ TRP 149 3.804 -3.298 10.102 958 HZ3 TRP 149 3HZ TRP 149 5.122 -2.939 6.034 959 HH2 TRP 149 HH TRP 149 4.876 -1.988 8.225 960 H SER 150 H SER 150 3.687 -11.893 6.557 961 HA SER 150 HA SER 150 2.327 -12.283 4.011 962 HB3 SER 150 2HB SER 150 5.363 -12.517 4.131 963 HG SER 150 HG SER 150 4.989 -13.572 2.450 964 H LYS 151 H LYS 151 1.965 -13.350 6.659 965 HA LYS 151 HA LYS 151 2.769 -16.183 6.318 966 HB3 LYS 151 2HB LYS 151 2.725 -16.027 8.949 967 HG3 LYS 151 2HG LYS 151 4.933 -15.267 7.024 968 HD3 LYS 151 2HD LYS 151 5.369 -13.819 8.878 969 HE3 LYS 151 2HE LYS 151 5.273 -16.288 10.646 970 HZ1 LYS 151 3HZ LYS 151 6.712 -14.589 11.520 971 HZ2 LYS 151 1HZ LYS 151 5.363 -14.689 12.422 972 HZ3 LYS 151 2HZ LYS 151 5.561 -13.432 11.355 Start of MODEL 14 1 H1 GLY 1 H GLY 1 -6.928 -27.853 -4.796 2 HA2 GLY 1 1HA GLY 1 -6.010 -27.866 -2.486 3 HA3 GLY 1 2HA GLY 1 -4.835 -28.398 -3.706 4 H MET 2 H MET 2 -5.942 -25.000 -3.000 5 HA MET 2 HA MET 2 -3.945 -24.063 -1.420 6 HB3 MET 2 2HB MET 2 -2.217 -24.449 -3.108 7 HG3 MET 2 2HG MET 2 -4.123 -23.086 -5.058 8 HE1 MET 2 3HE MET 2 -2.774 -24.304 -7.722 9 HE2 MET 2 1HE MET 2 -3.556 -22.718 -7.523 10 HE3 MET 2 2HE MET 2 -1.925 -22.825 -8.229 11 H ALA 3 H ALA 3 -4.232 -21.647 -1.271 12 HA ALA 3 HA ALA 3 -5.258 -20.096 -3.353 13 HB1 ALA 3 1HB ALA 3 -7.265 -20.726 -1.156 14 HB2 ALA 3 2HB ALA 3 -7.350 -19.291 -2.211 15 HB3 ALA 3 3HB ALA 3 -7.473 -20.893 -2.922 16 H LYS 4 H LYS 4 -3.598 -18.712 -2.842 17 HA LYS 4 HA LYS 4 -4.143 -16.822 -0.855 18 HB3 LYS 4 2HB LYS 4 -3.024 -18.357 0.714 19 HG3 LYS 4 2HG LYS 4 -0.597 -18.602 0.699 20 HD3 LYS 4 2HD LYS 4 -2.262 -20.335 -0.568 21 HE3 LYS 4 2HE LYS 4 -1.517 -19.244 -2.816 22 HZ1 LYS 4 3HZ LYS 4 0.889 -19.315 -2.041 23 HZ2 LYS 4 1HZ LYS 4 0.572 -19.864 -3.599 24 HZ3 LYS 4 2HZ LYS 4 0.876 -20.899 -2.376 25 H LYS 5 H LYS 5 -2.887 -14.856 -1.293 26 HA LYS 5 HA LYS 5 -0.783 -14.889 -3.237 27 HB3 LYS 5 2HB LYS 5 -1.830 -13.309 -4.814 28 HG3 LYS 5 2HG LYS 5 -3.703 -15.599 -4.700 29 HD3 LYS 5 2HD LYS 5 -3.910 -13.725 -6.456 30 HE3 LYS 5 2HE LYS 5 -1.538 -15.263 -7.612 31 HZ1 LYS 5 3HZ LYS 5 -2.703 -12.838 -8.811 32 HZ2 LYS 5 1HZ LYS 5 -3.345 -14.320 -9.112 33 HZ3 LYS 5 2HZ LYS 5 -1.784 -14.045 -9.481 34 H THR 6 H THR 6 -0.129 -12.635 -3.629 35 HA THR 6 HA THR 6 -0.695 -10.748 -1.393 36 HB THR 6 HB THR 6 2.053 -11.814 -2.119 37 HG1 THR 6 1HG THR 6 0.625 -12.272 0.286 38 HG21 THR 6 3HG2 THR 6 2.284 -9.565 -1.438 39 HG22 THR 6 1HG2 THR 6 2.703 -10.541 -0.016 40 HG23 THR 6 2HG2 THR 6 1.111 -9.759 -0.098 41 H LEU 7 H LEU 7 -1.521 -9.141 -2.720 42 HA LEU 7 HA LEU 7 -0.146 -8.379 -5.239 43 HB3 LEU 7 2HB LEU 7 -2.601 -7.361 -3.899 44 HG LEU 7 HG LEU 7 -1.692 -5.548 -5.348 45 HD11 LEU 7 1HD1 LEU 7 -1.516 -5.989 -7.828 46 HD12 LEU 7 2HD1 LEU 7 -1.568 -7.726 -7.493 47 HD13 LEU 7 3HD1 LEU 7 -0.211 -6.733 -6.908 48 HD21 LEU 7 3HD2 LEU 7 -4.124 -6.019 -5.291 49 HD22 LEU 7 1HD2 LEU 7 -3.952 -7.157 -6.639 50 HD23 LEU 7 2HD2 LEU 7 -3.636 -5.436 -6.898 51 H ILE 8 H ILE 8 1.153 -6.564 -5.486 52 HA ILE 8 HA ILE 8 1.727 -4.869 -3.090 53 HB ILE 8 HB ILE 8 3.546 -6.149 -5.155 54 HG13 ILE 8 2HG1 ILE 8 2.803 -7.479 -3.076 55 HG21 ILE 8 1HG2 ILE 8 5.421 -4.963 -4.252 56 HG22 ILE 8 2HG2 ILE 8 4.248 -3.773 -4.757 57 HG23 ILE 8 3HG2 ILE 8 4.409 -4.152 -3.028 58 HD11 ILE 8 3HD1 ILE 8 4.896 -8.097 -4.229 59 HD12 ILE 8 1HD1 ILE 8 5.794 -6.968 -3.197 60 HD13 ILE 8 2HD1 ILE 8 4.950 -8.355 -2.487 61 H LEU 9 H LEU 9 1.299 -2.752 -3.480 62 HA LEU 9 HA LEU 9 1.383 -1.654 -6.270 63 HB3 LEU 9 2HB LEU 9 -0.718 -0.397 -5.638 64 HG LEU 9 HG LEU 9 -0.705 -3.365 -6.036 65 HD11 LEU 9 1HD1 LEU 9 -3.081 -3.619 -5.581 66 HD12 LEU 9 2HD1 LEU 9 -3.175 -1.956 -4.968 67 HD13 LEU 9 3HD1 LEU 9 -2.202 -3.181 -4.119 68 HD21 LEU 9 3HD2 LEU 9 -2.076 -2.856 -7.896 69 HD22 LEU 9 1HD2 LEU 9 -0.828 -1.604 -7.859 70 HD23 LEU 9 2HD2 LEU 9 -2.467 -1.230 -7.287 71 H TYR 10 H TYR 10 3.326 -0.427 -5.810 72 HA TYR 10 HA TYR 10 3.058 1.526 -3.558 73 HB3 TYR 10 2HB TYR 10 5.001 -0.060 -3.340 74 HD1 TYR 10 2HD TYR 10 4.954 0.187 -6.710 75 HD2 TYR 10 1HD TYR 10 7.650 1.053 -3.448 76 HE1 TYR 10 2HE TYR 10 6.835 0.277 -8.287 77 HE2 TYR 10 1HE TYR 10 9.493 1.214 -5.066 78 HH TYR 10 HH TYR 10 9.206 0.296 -8.396 79 H TYR 11 H TYR 11 4.140 3.660 -3.866 80 HA TYR 11 HA TYR 11 4.084 4.581 -6.706 81 HB3 TYR 11 2HB TYR 11 3.474 6.073 -4.131 82 HD1 TYR 11 1HD TYR 11 3.881 6.512 -7.883 83 HD2 TYR 11 2HD TYR 11 3.933 8.385 -3.993 84 HE1 TYR 11 1HE TYR 11 4.837 8.559 -8.876 85 HE2 TYR 11 2HE TYR 11 4.884 10.413 -4.986 86 HH TYR 11 HH TYR 11 5.561 11.504 -6.983 87 H SER 12 H SER 12 6.211 4.723 -7.407 88 HA SER 12 HA SER 12 8.334 5.315 -5.468 89 HB3 SER 12 2HB SER 12 9.067 3.839 -7.203 90 HG SER 12 HG SER 12 7.524 4.573 -8.903 91 H TRP 13 H TRP 13 8.081 7.253 -4.593 92 HA TRP 13 HA TRP 13 7.382 9.690 -5.544 93 HB3 TRP 13 2HB TRP 13 9.819 9.129 -3.828 94 HD1 TRP 13 HD TRP 13 6.853 11.612 -4.248 95 HE1 TRP 13 1HE TRP 13 7.610 13.953 -3.690 96 HE3 TRP 13 3HE TRP 13 11.704 10.639 -2.855 97 HZ2 TRP 13 2HZ TRP 13 9.983 15.313 -2.858 98 HZ3 TRP 13 3HZ TRP 13 13.176 12.529 -2.137 99 HH2 TRP 13 HH TRP 13 12.355 14.853 -2.175 100 H SER 14 H SER 14 10.757 8.545 -5.716 101 HA SER 14 HA SER 14 11.261 9.815 -8.309 102 HB3 SER 14 2HB SER 14 13.335 10.918 -6.755 103 HG SER 14 HG SER 14 12.522 12.065 -8.389 104 H GLY 15 H GLY 15 12.032 7.400 -6.008 105 HA2 GLY 15 1HA GLY 15 13.608 5.760 -7.272 106 HA3 GLY 15 2HA GLY 15 14.807 7.021 -6.984 107 H GLU 16 H GLU 16 12.780 7.164 -4.338 108 HA GLU 16 HA GLU 16 14.731 5.849 -2.571 109 HB3 GLU 16 2HB GLU 16 13.176 6.703 -0.799 110 HG3 GLU 16 2HG GLU 16 13.747 8.897 -2.832 111 H THR 17 H THR 17 11.153 5.767 -2.716 112 HA THR 17 HA THR 17 10.545 3.414 -1.559 113 HB THR 17 HB THR 17 9.074 4.011 -4.067 114 HG1 THR 17 1HG THR 17 9.051 5.980 -2.029 115 HG21 THR 17 3HG2 THR 17 7.181 3.477 -2.942 116 HG22 THR 17 1HG2 THR 17 7.691 4.299 -1.456 117 HG23 THR 17 2HG2 THR 17 8.309 2.674 -1.857 118 H LYS 18 H LYS 18 11.714 3.879 -4.858 119 HA LYS 18 HA LYS 18 11.201 1.509 -6.209 120 HB3 LYS 18 2HB LYS 18 13.594 3.315 -6.240 121 HG3 LYS 18 2HG LYS 18 12.695 1.455 -8.459 122 HD3 LYS 18 2HD LYS 18 14.180 3.641 -8.883 123 HE3 LYS 18 2HE LYS 18 16.604 2.601 -9.071 124 HZ1 LYS 18 3HZ LYS 18 15.722 3.709 -6.462 125 HZ2 LYS 18 1HZ LYS 18 16.408 4.513 -7.733 126 HZ3 LYS 18 2HZ LYS 18 17.268 3.430 -6.919 127 H LYS 19 H LYS 19 13.929 2.104 -3.953 128 HA LYS 19 HA LYS 19 15.204 -0.444 -4.337 129 HB3 LYS 19 2HB LYS 19 15.766 0.369 -1.715 130 HG3 LYS 19 2HG LYS 19 17.501 1.998 -2.941 131 HD3 LYS 19 2HD LYS 19 18.800 -0.136 -3.668 132 HE3 LYS 19 2HE LYS 19 17.714 0.324 -0.860 133 HZ1 LYS 19 3HZ LYS 19 20.016 -1.360 -1.627 134 HZ2 LYS 19 1HZ LYS 19 18.602 -1.912 -0.988 135 HZ3 LYS 19 2HZ LYS 19 19.621 -0.954 -0.112 136 H MET 20 H MET 20 12.613 0.647 -2.184 137 HA MET 20 HA MET 20 12.723 -1.649 -0.498 138 HB3 MET 20 2HB MET 20 10.387 0.297 -0.751 139 HG3 MET 20 2HG MET 20 10.138 -1.377 0.961 140 HE1 MET 20 3HE MET 20 13.848 0.190 1.067 141 HE2 MET 20 1HE MET 20 12.998 0.934 2.440 142 HE3 MET 20 2HE MET 20 14.294 -0.239 2.729 143 H ALA 21 H ALA 21 11.080 -1.059 -3.572 144 HA ALA 21 HA ALA 21 8.746 -2.665 -3.089 145 HB1 ALA 21 1HB ALA 21 10.055 -1.349 -5.443 146 HB2 ALA 21 2HB ALA 21 9.156 -2.826 -5.783 147 HB3 ALA 21 3HB ALA 21 8.329 -1.505 -4.985 148 H GLU 22 H GLU 22 11.957 -3.048 -4.605 149 HA GLU 22 HA GLU 22 11.529 -5.663 -5.396 150 HB3 GLU 22 2HB GLU 22 13.901 -5.789 -5.906 151 HG3 GLU 22 2HG GLU 22 13.147 -2.840 -6.095 152 H LYS 23 H LYS 23 13.200 -4.312 -2.555 153 HA LYS 23 HA LYS 23 14.229 -6.647 -1.420 154 HB3 LYS 23 2HB LYS 23 13.238 -4.365 0.207 155 HG3 LYS 23 2HG LYS 23 15.496 -6.359 0.357 156 HD3 LYS 23 2HD LYS 23 15.211 -4.163 2.421 157 HE3 LYS 23 2HE LYS 23 17.462 -4.860 3.042 158 HZ1 LYS 23 3HZ LYS 23 15.881 -7.321 2.586 159 HZ2 LYS 23 1HZ LYS 23 15.740 -6.329 3.886 160 HZ3 LYS 23 2HZ LYS 23 17.131 -7.158 3.642 161 H ILE 24 H ILE 24 11.098 -5.155 -0.904 162 HA ILE 24 HA ILE 24 10.158 -7.199 0.939 163 HB ILE 24 HB ILE 24 8.803 -4.926 -0.560 164 HG13 ILE 24 2HG1 ILE 24 10.422 -4.236 1.153 165 HG21 ILE 24 1HG2 ILE 24 7.571 -6.773 1.536 166 HG22 ILE 24 2HG2 ILE 24 6.813 -5.297 0.884 167 HG23 ILE 24 3HG2 ILE 24 7.110 -6.661 -0.170 168 HD11 ILE 24 3HD1 ILE 24 8.311 -2.902 0.987 169 HD12 ILE 24 1HD1 ILE 24 7.669 -3.841 2.362 170 HD13 ILE 24 2HD1 ILE 24 9.113 -2.841 2.568 171 H ASN 25 H ASN 25 9.665 -6.653 -2.648 172 HA ASN 25 HA ASN 25 7.805 -8.811 -2.938 173 HB3 ASN 25 2HB ASN 25 9.781 -7.757 -5.003 174 HD21 ASN 25 1HD2 ASN 25 7.622 -10.453 -4.593 175 HD22 ASN 25 2HD2 ASN 25 7.015 -10.429 -6.261 176 H SER 26 H SER 26 11.321 -8.717 -2.827 177 HA SER 26 HA SER 26 11.820 -11.438 -3.582 178 HB3 SER 26 2HB SER 26 13.491 -9.341 -2.127 179 HG SER 26 HG SER 26 14.159 -11.719 -2.450 180 H GLU 27 H GLU 27 10.395 -10.343 -0.669 181 HA GLU 27 HA GLU 27 11.623 -12.531 0.933 182 HB3 GLU 27 2HB GLU 27 10.311 -11.029 2.767 183 HG3 GLU 27 2HG GLU 27 12.384 -9.588 2.903 184 H ILE 28 H ILE 28 9.185 -12.171 -1.078 185 HA ILE 28 HA ILE 28 7.039 -13.433 0.530 186 HB ILE 28 HB ILE 28 6.913 -11.317 -1.671 187 HG13 ILE 28 2HG1 ILE 28 7.564 -10.522 0.674 188 HG21 ILE 28 1HG2 ILE 28 4.936 -12.861 -1.832 189 HG22 ILE 28 2HG2 ILE 28 4.541 -12.472 -0.135 190 HG23 ILE 28 3HG2 ILE 28 4.506 -11.233 -1.399 191 HD11 ILE 28 3HD1 ILE 28 6.061 -8.686 0.878 192 HD12 ILE 28 1HD1 ILE 28 6.402 -8.947 -0.844 193 HD13 ILE 28 2HD1 ILE 28 4.846 -9.455 -0.140 194 H LYS 29 H LYS 29 5.622 -14.727 -0.969 195 HA LYS 29 HA LYS 29 6.928 -16.607 -2.626 196 HB3 LYS 29 2HB LYS 29 4.047 -15.981 -3.194 197 HG3 LYS 29 2HG LYS 29 5.077 -18.437 -1.805 198 HD3 LYS 29 2HD LYS 29 2.620 -17.885 -2.724 199 HE3 LYS 29 2HE LYS 29 3.481 -17.723 -5.139 200 HZ1 LYS 29 3HZ LYS 29 4.945 -19.509 -5.348 201 HZ2 LYS 29 1HZ LYS 29 3.630 -20.021 -6.156 202 HZ3 LYS 29 2HZ LYS 29 3.947 -20.608 -4.640 203 H ASP 30 H ASP 30 5.629 -16.851 -4.936 204 HA ASP 30 HA ASP 30 6.686 -15.321 -6.910 205 HB3 ASP 30 2HB ASP 30 5.043 -16.412 -8.392 206 H SER 31 H SER 31 5.338 -13.444 -4.951 207 HA SER 31 HA SER 31 2.888 -12.443 -5.914 208 HB3 SER 31 2HB SER 31 3.518 -11.983 -3.681 209 HG SER 31 HG SER 31 5.809 -10.644 -4.689 210 H GLU 32 H GLU 32 2.525 -10.463 -6.845 211 HA GLU 32 HA GLU 32 4.090 -9.962 -9.288 212 HB3 GLU 32 2HB GLU 32 1.546 -8.536 -8.291 213 HG3 GLU 32 2HG GLU 32 3.061 -8.323 -10.757 214 H LEU 33 H LEU 33 4.480 -7.593 -9.693 215 HA LEU 33 HA LEU 33 4.579 -5.800 -7.318 216 HB3 LEU 33 2HB LEU 33 6.814 -6.268 -9.326 217 HG LEU 33 HG LEU 33 6.520 -3.768 -8.995 218 HD11 LEU 33 1HD1 LEU 33 5.626 -3.851 -6.666 219 HD12 LEU 33 2HD1 LEU 33 7.047 -2.822 -6.805 220 HD13 LEU 33 3HD1 LEU 33 7.216 -4.451 -6.095 221 HD21 LEU 33 3HD2 LEU 33 8.998 -5.077 -7.776 222 HD22 LEU 33 1HD2 LEU 33 8.892 -3.402 -8.369 223 HD23 LEU 33 2HD2 LEU 33 8.711 -4.751 -9.498 224 H LYS 34 H LYS 34 2.824 -4.515 -7.840 225 HA LYS 34 HA LYS 34 2.652 -3.420 -10.587 226 HB3 LYS 34 2HB LYS 34 0.477 -2.552 -9.909 227 HG3 LYS 34 2HG LYS 34 -0.838 -4.526 -9.301 228 HD3 LYS 34 2HD LYS 34 1.212 -5.302 -11.394 229 HE3 LYS 34 2HE LYS 34 -1.762 -5.971 -11.080 230 HZ1 LYS 34 3HZ LYS 34 0.291 -6.722 -13.035 231 HZ2 LYS 34 1HZ LYS 34 -1.318 -6.509 -13.235 232 HZ3 LYS 34 2HZ LYS 34 -0.725 -7.880 -12.517 233 H GLU 35 H GLU 35 2.186 -0.974 -10.478 234 HA GLU 35 HA GLU 35 3.033 0.353 -8.032 235 HB3 GLU 35 2HB GLU 35 5.090 -0.012 -9.637 236 HG3 GLU 35 2HG GLU 35 4.004 2.538 -10.888 237 H VAL 36 H VAL 36 2.605 2.667 -8.214 238 HA VAL 36 HA VAL 36 0.375 3.375 -10.051 239 HB VAL 36 HB VAL 36 0.928 4.506 -7.278 240 HG11 VAL 36 1HG1 VAL 36 -1.518 5.059 -7.349 241 HG12 VAL 36 2HG1 VAL 36 -0.612 5.852 -8.630 242 HG13 VAL 36 3HG1 VAL 36 -1.591 4.413 -9.003 243 HG21 VAL 36 3HG2 VAL 36 0.561 2.168 -6.788 244 HG22 VAL 36 1HG2 VAL 36 -0.888 3.064 -6.365 245 HG23 VAL 36 2HG2 VAL 36 -0.850 2.113 -7.864 246 H LYS 37 H LYS 37 0.413 5.786 -10.570 247 HA LYS 37 HA LYS 37 2.868 7.275 -9.951 248 HB3 LYS 37 2HB LYS 37 2.463 8.203 -12.450 249 HG3 LYS 37 2HG LYS 37 4.331 6.191 -11.418 250 HD3 LYS 37 2HD LYS 37 3.363 6.014 -14.298 251 HE3 LYS 37 2HE LYS 37 5.479 4.587 -14.589 252 HZ1 LYS 37 3HZ LYS 37 6.741 6.465 -15.306 253 HZ2 LYS 37 1HZ LYS 37 5.862 7.517 -14.429 254 HZ3 LYS 37 2HZ LYS 37 5.186 6.716 -15.700 255 H VAL 38 H VAL 38 2.414 9.636 -10.449 256 HA VAL 38 HA VAL 38 -0.433 10.374 -10.121 257 HB VAL 38 HB VAL 38 0.407 12.382 -8.901 258 HG11 VAL 38 1HG1 VAL 38 1.256 9.840 -7.452 259 HG12 VAL 38 2HG1 VAL 38 0.622 11.351 -6.770 260 HG13 VAL 38 3HG1 VAL 38 -0.426 10.310 -7.737 261 HG21 VAL 38 3HG2 VAL 38 2.632 12.519 -7.973 262 HG22 VAL 38 1HG2 VAL 38 3.061 10.907 -8.604 263 HG23 VAL 38 2HG2 VAL 38 2.833 12.259 -9.700 264 H SER 39 H SER 39 -0.549 12.872 -10.873 265 HA SER 39 HA SER 39 0.508 13.132 -13.575 266 HB3 SER 39 2HB SER 39 -1.158 14.974 -11.812 267 HG SER 39 HG SER 39 -1.688 15.971 -13.779 268 H GLU 40 H GLU 40 1.203 15.775 -13.611 269 HA GLU 40 HA GLU 40 3.935 15.300 -12.616 270 HB3 GLU 40 2HB GLU 40 3.052 15.437 -15.070 271 HG3 GLU 40 2HG GLU 40 3.829 18.335 -14.510 272 H GLY 41 H GLY 41 5.153 16.876 -11.613 273 HA2 GLY 41 1HA GLY 41 5.510 18.588 -10.147 274 HA3 GLY 41 2HA GLY 41 4.602 19.599 -11.285 275 H THR 42 H THR 42 3.071 16.817 -9.698 276 HA THR 42 HA THR 42 0.915 18.411 -8.635 277 HB THR 42 HB THR 42 1.811 15.521 -8.216 278 HG1 THR 42 1HG THR 42 1.029 16.649 -10.360 279 HG21 THR 42 3HG2 THR 42 0.130 16.230 -6.497 280 HG22 THR 42 1HG2 THR 42 -0.453 14.974 -7.599 281 HG23 THR 42 2HG2 THR 42 -0.981 16.660 -7.808 282 H PHE 43 H PHE 43 4.085 17.399 -7.496 283 HA PHE 43 HA PHE 43 3.593 18.853 -4.963 284 HB3 PHE 43 2HB PHE 43 4.873 17.235 -3.759 285 HD1 PHE 43 1HD PHE 43 2.370 17.430 -3.296 286 HD2 PHE 43 2HD PHE 43 4.080 14.526 -5.974 287 HE1 PHE 43 1HE PHE 43 0.259 16.088 -3.181 288 HE2 PHE 43 2HE PHE 43 1.979 13.182 -5.849 289 HZ PHE 43 HZ PHE 43 0.077 13.993 -4.498 290 H ASP 44 H ASP 44 5.795 19.337 -3.917 291 HA ASP 44 HA ASP 44 7.980 19.693 -5.819 292 HB3 ASP 44 2HB ASP 44 7.408 21.909 -3.826 293 H ALA 45 H ALA 45 9.778 20.693 -3.845 294 HA ALA 45 HA ALA 45 9.180 19.344 -1.341 295 HB1 ALA 45 1HB ALA 45 11.430 18.315 -1.181 296 HB2 ALA 45 2HB ALA 45 10.462 17.615 -2.488 297 HB3 ALA 45 3HB ALA 45 11.756 18.769 -2.874 298 H ASP 46 H ASP 46 8.667 21.683 -1.296 299 HA ASP 46 HA ASP 46 11.038 23.314 -0.549 300 HB3 ASP 46 2HB ASP 46 8.656 24.754 -1.616 301 H MET 47 H MET 47 10.602 24.844 1.039 302 HA MET 47 HA MET 47 9.122 23.757 3.234 303 HB3 MET 47 2HB MET 47 11.030 24.916 3.902 304 HG3 MET 47 2HG MET 47 10.361 26.965 1.806 305 HE1 MET 47 3HE MET 47 9.070 28.562 3.514 306 HE2 MET 47 1HE MET 47 9.984 29.984 4.058 307 HE3 MET 47 2HE MET 47 9.966 29.553 2.335 308 H TYR 48 H TYR 48 8.567 26.737 1.285 309 HA TYR 48 HA TYR 48 6.057 27.268 2.692 310 HB3 TYR 48 2HB TYR 48 7.344 29.155 1.818 311 HD1 TYR 48 1HD TYR 48 9.459 28.625 0.634 312 HD2 TYR 48 2HD TYR 48 5.670 28.481 -1.438 313 HE1 TYR 48 1HE TYR 48 10.637 28.506 -1.409 314 HE2 TYR 48 2HE TYR 48 6.879 28.352 -3.599 315 HH TYR 48 HH TYR 48 10.480 28.222 -3.710 316 H LYS 49 H LYS 49 7.043 25.738 -0.342 317 HA LYS 49 HA LYS 49 4.410 25.761 -1.450 318 HB3 LYS 49 2HB LYS 49 6.655 23.803 -2.162 319 HG3 LYS 49 2HG LYS 49 4.143 24.676 -3.409 320 HD3 LYS 49 2HD LYS 49 6.573 24.676 -5.231 321 HE3 LYS 49 2HE LYS 49 3.665 25.567 -5.479 322 HZ1 LYS 49 3HZ LYS 49 5.386 26.838 -6.786 323 HZ2 LYS 49 1HZ LYS 49 4.149 26.225 -7.622 324 HZ3 LYS 49 2HZ LYS 49 5.628 25.484 -7.679 325 H THR 50 H THR 50 6.263 22.893 -0.046 326 HA THR 50 HA THR 50 3.870 21.396 -0.263 327 HB THR 50 HB THR 50 5.266 19.620 0.400 328 HG1 THR 50 1HG THR 50 7.296 21.530 1.078 329 HG21 THR 50 3HG2 THR 50 5.529 20.529 -1.866 330 HG22 THR 50 1HG2 THR 50 7.001 19.765 -1.216 331 HG23 THR 50 2HG2 THR 50 6.907 21.521 -1.314 332 H SER 51 H SER 51 4.882 23.508 2.288 333 HA SER 51 HA SER 51 3.450 22.120 4.396 334 HB3 SER 51 2HB SER 51 3.223 24.378 5.388 335 HG SER 51 HG SER 51 5.837 24.072 4.317 336 H ASP 52 H ASP 52 2.635 24.447 1.801 337 HA ASP 52 HA ASP 52 -0.021 24.789 2.722 338 HB3 ASP 52 2HB ASP 52 0.653 25.624 -0.070 339 H ILE 53 H ILE 53 1.382 23.045 -0.068 340 HA ILE 53 HA ILE 53 -1.054 22.450 -1.320 341 HB ILE 53 HB ILE 53 1.514 20.803 -1.325 342 HG13 ILE 53 2HG1 ILE 53 1.541 23.322 -2.156 343 HG21 ILE 53 1HG2 ILE 53 -0.864 20.785 -3.242 344 HG22 ILE 53 2HG2 ILE 53 0.671 19.967 -3.581 345 HG23 ILE 53 3HG2 ILE 53 -0.315 19.445 -2.230 346 HD11 ILE 53 3HD1 ILE 53 2.530 21.069 -3.962 347 HD12 ILE 53 1HD1 ILE 53 3.019 22.757 -4.021 348 HD13 ILE 53 2HD1 ILE 53 3.406 21.787 -2.587 349 H ALA 54 H ALA 54 0.684 20.443 1.131 350 HA ALA 54 HA ALA 54 -1.325 18.361 1.113 351 HB1 ALA 54 1HB ALA 54 0.983 17.998 1.960 352 HB2 ALA 54 2HB ALA 54 0.679 19.131 3.278 353 HB3 ALA 54 3HB ALA 54 -0.251 17.601 3.167 354 H LEU 55 H LEU 55 -0.777 21.300 3.074 355 HA LEU 55 HA LEU 55 -2.760 20.718 4.995 356 HB3 LEU 55 2HB LEU 55 -1.678 23.403 4.061 357 HG LEU 55 HG LEU 55 -3.603 23.717 5.577 358 HD11 LEU 55 1HD1 LEU 55 -2.089 21.911 7.523 359 HD12 LEU 55 2HD1 LEU 55 -3.673 21.564 6.796 360 HD13 LEU 55 3HD1 LEU 55 -3.502 22.902 7.939 361 HD21 LEU 55 3HD2 LEU 55 -0.930 24.088 6.978 362 HD22 LEU 55 1HD2 LEU 55 -2.428 24.981 7.332 363 HD23 LEU 55 2HD2 LEU 55 -1.620 25.182 5.761 364 H ASP 56 H ASP 56 -2.964 22.409 1.872 365 HA ASP 56 HA ASP 56 -5.567 23.464 2.183 366 HB3 ASP 56 2HB ASP 56 -5.185 22.594 -0.561 367 H GLN 57 H GLN 57 -4.522 20.240 1.175 368 HA GLN 57 HA GLN 57 -7.204 19.299 0.520 369 HB3 GLN 57 2HB GLN 57 -6.082 17.102 0.317 370 HG3 GLN 57 2HG GLN 57 -4.518 19.396 -0.963 371 HE21 GLN 57 1HE2 GLN 57 -5.125 17.853 -3.513 372 HE22 GLN 57 2HE2 GLN 57 -3.721 16.807 -3.620 373 H ILE 58 H ILE 58 -5.037 19.206 3.342 374 HA ILE 58 HA ILE 58 -6.648 17.421 4.918 375 HB ILE 58 HB ILE 58 -4.511 19.440 5.601 376 HG13 ILE 58 2HG1 ILE 58 -3.972 17.329 4.235 377 HG21 ILE 58 1HG2 ILE 58 -5.872 19.202 7.628 378 HG22 ILE 58 2HG2 ILE 58 -5.788 17.432 7.505 379 HG23 ILE 58 3HG2 ILE 58 -4.330 18.403 7.847 380 HD11 ILE 58 3HD1 ILE 58 -2.337 18.586 5.832 381 HD12 ILE 58 1HD1 ILE 58 -2.607 17.167 6.896 382 HD13 ILE 58 2HD1 ILE 58 -1.957 16.958 5.251 383 H GLN 59 H GLN 59 -6.565 20.987 4.583 384 HA GLN 59 HA GLN 59 -8.648 21.315 6.599 385 HB3 GLN 59 2HB GLN 59 -8.571 23.712 5.900 386 HG3 GLN 59 2HG GLN 59 -5.814 22.539 6.449 387 HE21 GLN 59 1HE2 GLN 59 -5.225 24.845 5.463 388 HE22 GLN 59 2HE2 GLN 59 -5.113 26.047 6.749 389 H GLY 60 H GLY 60 -8.754 20.222 3.403 390 HA2 GLY 60 1HA GLY 60 -10.660 19.422 2.375 391 HA3 GLY 60 2HA GLY 60 -11.674 20.386 3.453 392 H ASN 61 H ASN 61 -9.190 22.298 2.092 393 HA ASN 61 HA ASN 61 -11.098 23.865 0.551 394 HB3 ASN 61 2HB ASN 61 -9.212 25.269 -0.000 395 HD21 ASN 61 1HD2 ASN 61 -7.007 25.451 1.863 396 HD22 ASN 61 2HD2 ASN 61 -7.714 25.956 3.390 397 H LYS 62 H LYS 62 -8.670 21.366 -0.064 398 HA LYS 62 HA LYS 62 -9.202 21.531 -2.985 399 HB3 LYS 62 2HB LYS 62 -6.790 20.529 -3.139 400 HG3 LYS 62 2HG LYS 62 -5.767 22.858 -2.857 401 HD3 LYS 62 2HD LYS 62 -7.773 23.795 -4.528 402 HE3 LYS 62 2HE LYS 62 -5.501 21.903 -5.278 403 HZ1 LYS 62 3HZ LYS 62 -6.947 22.241 -7.118 404 HZ2 LYS 62 1HZ LYS 62 -5.656 23.244 -7.359 405 HZ3 LYS 62 2HZ LYS 62 -7.063 23.864 -6.861 406 H ASP 63 H ASP 63 -9.122 19.797 -4.158 407 HA ASP 63 HA ASP 63 -10.068 17.266 -3.116 408 HB3 ASP 63 2HB ASP 63 -10.998 17.680 -5.190 409 H PHE 64 H PHE 64 -8.963 15.303 -3.580 410 HA PHE 64 HA PHE 64 -6.240 15.199 -2.662 411 HB3 PHE 64 2HB PHE 64 -7.711 13.436 -2.039 412 HD1 PHE 64 2HD PHE 64 -7.445 12.484 -5.672 413 HD2 PHE 64 1HD PHE 64 -10.070 13.401 -2.376 414 HE1 PHE 64 2HE PHE 64 -9.390 11.838 -7.048 415 HE2 PHE 64 1HE PHE 64 -12.012 12.785 -3.771 416 HZ PHE 64 HZ PHE 64 -11.666 12.006 -6.114 417 HA PRO 65 HA PRO 65 -4.219 15.017 -6.690 418 HB3 PRO 65 2HB PRO 65 -2.208 14.924 -5.752 419 HG3 PRO 65 2HG PRO 65 -1.900 13.747 -3.634 420 HD3 PRO 65 2HD PRO 65 -3.809 14.954 -3.116 421 H GLU 66 H GLU 66 -3.942 13.766 -8.439 422 HA GLU 66 HA GLU 66 -5.866 11.509 -8.572 423 HB3 GLU 66 2HB GLU 66 -5.523 11.677 -11.029 424 HG3 GLU 66 2HG GLU 66 -6.034 14.410 -9.796 425 H ILE 67 H ILE 67 -5.229 9.605 -10.035 426 HA ILE 67 HA ILE 67 -2.411 8.910 -9.936 427 HB ILE 67 HB ILE 67 -2.944 6.598 -9.183 428 HG13 ILE 67 2HG1 ILE 67 -5.390 6.612 -9.586 429 HG21 ILE 67 1HG2 ILE 67 -1.921 8.347 -7.707 430 HG22 ILE 67 2HG2 ILE 67 -3.535 8.693 -7.052 431 HG23 ILE 67 3HG2 ILE 67 -2.781 7.101 -6.814 432 HD11 ILE 67 3HD1 ILE 67 -6.153 5.508 -7.593 433 HD12 ILE 67 1HD1 ILE 67 -4.494 4.968 -7.970 434 HD13 ILE 67 2HD1 ILE 67 -4.793 6.130 -6.653 435 H GLN 68 H GLN 68 -1.837 7.443 -11.530 436 HA GLN 68 HA GLN 68 -3.795 6.895 -13.650 437 HB3 GLN 68 2HB GLN 68 -2.415 8.645 -14.465 438 HG3 GLN 68 2HG GLN 68 -0.034 6.881 -13.795 439 HE21 GLN 68 1HE2 GLN 68 -0.905 10.395 -14.466 440 HE22 GLN 68 2HE2 GLN 68 0.662 10.720 -15.164 441 H LEU 69 H LEU 69 -3.919 4.739 -14.104 442 HA LEU 69 HA LEU 69 -1.817 2.880 -13.602 443 HB3 LEU 69 2HB LEU 69 -4.321 2.721 -11.836 444 HG LEU 69 HG LEU 69 -3.421 0.470 -12.048 445 HD11 LEU 69 1HD1 LEU 69 -0.969 0.076 -11.472 446 HD12 LEU 69 2HD1 LEU 69 -0.756 1.847 -11.661 447 HD13 LEU 69 3HD1 LEU 69 -1.218 0.847 -13.031 448 HD21 LEU 69 3HD2 LEU 69 -2.671 0.059 -9.771 449 HD22 LEU 69 1HD2 LEU 69 -3.984 1.245 -9.800 450 HD23 LEU 69 2HD2 LEU 69 -2.310 1.790 -9.557 451 H ASP 70 H ASP 70 -2.448 0.689 -14.124 452 HA ASP 70 HA ASP 70 -4.188 0.046 -16.220 453 HB3 ASP 70 2HB ASP 70 -3.675 -2.281 -15.461 454 H ASN 71 H ASN 71 -5.878 -1.817 -15.867 455 HA ASN 71 HA ASN 71 -7.650 -1.155 -13.553 456 HB3 ASN 71 2HB ASN 71 -8.410 -2.944 -15.864 457 HD21 ASN 71 1HD2 ASN 71 -9.592 -4.250 -14.150 458 HD22 ASN 71 2HD2 ASN 71 -10.875 -3.480 -13.250 459 H ILE 72 H ILE 72 -7.478 -2.496 -11.918 460 HA ILE 72 HA ILE 72 -6.271 -5.207 -12.232 461 HB ILE 72 HB ILE 72 -5.580 -3.058 -10.208 462 HG13 ILE 72 2HG1 ILE 72 -4.481 -2.971 -12.539 463 HG21 ILE 72 1HG2 ILE 72 -5.708 -5.275 -9.101 464 HG22 ILE 72 2HG2 ILE 72 -4.619 -5.949 -10.332 465 HG23 ILE 72 3HG2 ILE 72 -4.039 -4.718 -9.194 466 HD11 ILE 72 3HD1 ILE 72 -3.417 -1.915 -10.593 467 HD12 ILE 72 1HD1 ILE 72 -2.554 -3.428 -10.249 468 HD13 ILE 72 2HD1 ILE 72 -2.249 -2.559 -11.761 469 H ASP 73 H ASP 73 -7.406 -6.723 -11.228 470 HA ASP 73 HA ASP 73 -9.859 -6.204 -9.746 471 HB3 ASP 73 2HB ASP 73 -9.530 -8.796 -9.378 472 H TYR 74 H TYR 74 -9.432 -5.286 -7.784 473 HA TYR 74 HA TYR 74 -7.225 -6.154 -6.085 474 HB3 TYR 74 2HB TYR 74 -8.136 -4.385 -4.557 475 HD1 TYR 74 2HD TYR 74 -5.749 -4.525 -6.029 476 HD2 TYR 74 1HD TYR 74 -9.217 -2.090 -6.823 477 HE1 TYR 74 2HE TYR 74 -4.346 -2.941 -7.307 478 HE2 TYR 74 1HE TYR 74 -7.795 -0.445 -7.993 479 HH TYR 74 HH TYR 74 -5.645 -0.114 -8.981 480 H ASN 75 H ASN 75 -9.807 -7.946 -6.670 481 HA ASN 75 HA ASN 75 -10.556 -8.376 -3.811 482 HB3 ASN 75 2HB ASN 75 -12.124 -9.716 -5.958 483 HD21 ASN 75 1HD2 ASN 75 -12.158 -10.490 -3.322 484 HD22 ASN 75 2HD2 ASN 75 -13.593 -9.852 -2.523 485 H ASN 76 H ASN 76 -8.557 -9.803 -6.141 486 HA ASN 76 HA ASN 76 -9.288 -12.597 -5.570 487 HB3 ASN 76 2HB ASN 76 -7.754 -13.080 -7.441 488 HD21 ASN 76 1HD2 ASN 76 -7.890 -11.209 -9.687 489 HD22 ASN 76 2HD2 ASN 76 -9.593 -11.163 -10.123 490 H TYR 77 H TYR 77 -7.464 -10.669 -3.757 491 HA TYR 77 HA TYR 77 -5.047 -12.370 -3.582 492 HB3 TYR 77 2HB TYR 77 -3.875 -10.251 -3.003 493 HD1 TYR 77 1HD TYR 77 -6.103 -9.462 -5.907 494 HD2 TYR 77 2HD TYR 77 -2.399 -11.199 -4.573 495 HE1 TYR 77 1HE TYR 77 -5.449 -9.816 -8.254 496 HE2 TYR 77 2HE TYR 77 -1.704 -11.531 -6.914 497 HH TYR 77 HH TYR 77 -3.496 -10.379 -9.708 498 H ASP 78 H ASP 78 -4.668 -13.228 -1.692 499 HA ASP 78 HA ASP 78 -6.511 -13.050 0.443 500 HB3 ASP 78 2HB ASP 78 -3.691 -13.938 1.034 501 H LEU 79 H LEU 79 -3.303 -11.618 -0.022 502 HA LEU 79 HA LEU 79 -3.718 -9.613 2.139 503 HB3 LEU 79 2HB LEU 79 -1.011 -10.659 1.279 504 HG LEU 79 HG LEU 79 -2.028 -10.170 4.107 505 HD11 LEU 79 1HD1 LEU 79 -0.210 -11.779 3.882 506 HD12 LEU 79 2HD1 LEU 79 0.318 -10.314 4.703 507 HD13 LEU 79 3HD1 LEU 79 0.764 -10.580 2.998 508 HD21 LEU 79 3HD2 LEU 79 -1.931 -7.948 3.175 509 HD22 LEU 79 1HD2 LEU 79 -0.397 -8.302 2.337 510 HD23 LEU 79 2HD2 LEU 79 -0.458 -8.173 4.098 511 H ILE 80 H ILE 80 -2.871 -7.453 1.579 512 HA ILE 80 HA ILE 80 -1.588 -7.169 -1.056 513 HB ILE 80 HB ILE 80 -3.790 -5.355 -0.007 514 HG13 ILE 80 2HG1 ILE 80 -4.817 -7.448 -0.686 515 HG21 ILE 80 1HG2 ILE 80 -3.644 -4.248 -2.220 516 HG22 ILE 80 2HG2 ILE 80 -2.115 -4.158 -1.384 517 HG23 ILE 80 3HG2 ILE 80 -2.328 -5.343 -2.687 518 HD11 ILE 80 3HD1 ILE 80 -6.315 -6.834 -2.404 519 HD12 ILE 80 1HD1 ILE 80 -5.953 -5.354 -1.506 520 HD13 ILE 80 2HD1 ILE 80 -5.200 -5.652 -3.095 521 H LEU 81 H LEU 81 0.027 -5.460 -1.093 522 HA LEU 81 HA LEU 81 0.431 -3.943 1.440 523 HB3 LEU 81 2HB LEU 81 2.864 -4.033 1.062 524 HG LEU 81 HG LEU 81 1.491 -5.810 2.530 525 HD11 LEU 81 1HD1 LEU 81 1.191 -7.426 0.655 526 HD12 LEU 81 2HD1 LEU 81 2.149 -8.106 1.964 527 HD13 LEU 81 3HD1 LEU 81 2.958 -7.551 0.483 528 HD21 LEU 81 3HD2 LEU 81 3.678 -4.955 3.102 529 HD22 LEU 81 1HD2 LEU 81 4.459 -5.956 1.846 530 HD23 LEU 81 2HD2 LEU 81 3.697 -6.718 3.252 531 H ILE 82 H ILE 82 1.385 -1.889 1.186 532 HA ILE 82 HA ILE 82 1.534 -0.807 -1.564 533 HB ILE 82 HB ILE 82 -0.224 0.107 0.749 534 HG13 ILE 82 2HG1 ILE 82 -0.702 -1.093 -1.937 535 HG21 ILE 82 1HG2 ILE 82 -0.825 2.094 -0.524 536 HG22 ILE 82 2HG2 ILE 82 0.850 2.144 -0.006 537 HG23 ILE 82 3HG2 ILE 82 0.462 1.759 -1.704 538 HD11 ILE 82 3HD1 ILE 82 -2.575 -0.620 0.410 539 HD12 ILE 82 1HD1 ILE 82 -2.870 -1.680 -0.982 540 HD13 ILE 82 2HD1 ILE 82 -1.592 -2.088 0.179 541 H GLY 83 H GLY 83 2.934 0.969 -1.803 542 HA2 GLY 83 1HA GLY 83 4.755 1.551 0.510 543 HA3 GLY 83 2HA GLY 83 5.331 1.246 -1.107 544 H SER 84 H SER 84 5.192 3.729 0.817 545 HA SER 84 HA SER 84 4.396 5.706 -1.261 546 HB3 SER 84 2HB SER 84 3.218 6.957 0.498 547 HG SER 84 HG SER 84 2.364 4.300 0.941 548 HA PRO 85 HA PRO 85 7.893 8.096 0.604 549 HB3 PRO 85 2HB PRO 85 7.926 9.469 -1.305 550 HG3 PRO 85 2HG PRO 85 5.976 9.860 -2.538 551 HD3 PRO 85 2HD PRO 85 5.656 7.578 -2.279 552 H VAL 86 H VAL 86 8.208 9.810 2.206 553 HA VAL 86 HA VAL 86 5.720 10.747 3.535 554 HB VAL 86 HB VAL 86 8.342 10.352 5.006 555 HG11 VAL 86 1HG1 VAL 86 6.756 10.451 7.002 556 HG12 VAL 86 2HG1 VAL 86 6.889 11.948 6.095 557 HG13 VAL 86 3HG1 VAL 86 5.467 10.896 5.870 558 HG21 VAL 86 3HG2 VAL 86 7.492 8.112 4.348 559 HG22 VAL 86 1HG2 VAL 86 7.448 8.376 6.089 560 HG23 VAL 86 2HG2 VAL 86 5.947 8.504 5.167 561 H TRP 87 H TRP 87 5.648 12.880 4.098 562 HA TRP 87 HA TRP 87 7.672 14.704 2.967 563 HB3 TRP 87 2HB TRP 87 5.153 15.954 3.534 564 HD1 TRP 87 HD TRP 87 8.024 16.059 1.332 565 HE1 TRP 87 1HE TRP 87 7.477 17.505 -0.777 566 HE3 TRP 87 3HE TRP 87 2.869 16.178 1.530 567 HZ2 TRP 87 2HZ TRP 87 5.371 18.429 -2.099 568 HZ3 TRP 87 3HZ TRP 87 1.644 17.578 -0.097 569 HH2 TRP 87 HH TRP 87 2.866 18.832 -1.834 570 H SER 88 H SER 88 6.782 17.060 4.403 571 HA SER 88 HA SER 88 8.437 16.844 6.642 572 HB3 SER 88 2HB SER 88 7.890 19.195 6.914 573 HG SER 88 HG SER 88 8.249 19.852 4.766 574 H GLY 89 H GLY 89 5.860 15.135 6.956 575 HA2 GLY 89 1HA GLY 89 5.626 14.819 9.513 576 HA3 GLY 89 2HA GLY 89 4.626 16.263 9.407 577 H TYR 90 H TYR 90 3.657 15.495 6.647 578 HA TYR 90 HA TYR 90 1.836 13.266 7.291 579 HB3 TYR 90 2HB TYR 90 1.237 16.089 6.402 580 HD1 TYR 90 2HD TYR 90 0.181 15.208 4.359 581 HD2 TYR 90 1HD TYR 90 -1.348 14.430 8.288 582 HE1 TYR 90 2HE TYR 90 -1.739 14.061 3.370 583 HE2 TYR 90 1HE TYR 90 -3.321 13.307 7.311 584 HH TYR 90 HH TYR 90 -4.410 12.690 5.286 585 HA PRO 91 HA PRO 91 3.277 12.242 3.222 586 HB3 PRO 91 2HB PRO 91 2.483 10.141 3.474 587 HG3 PRO 91 2HG PRO 91 0.559 9.697 4.780 588 HD3 PRO 91 2HD PRO 91 1.594 11.316 6.209 589 H ALA 92 H ALA 92 2.817 12.320 0.869 590 HA ALA 92 HA ALA 92 1.493 14.762 -0.007 591 HB1 ALA 92 1HB ALA 92 2.956 12.478 -1.396 592 HB2 ALA 92 2HB ALA 92 2.471 13.990 -2.190 593 HB3 ALA 92 3HB ALA 92 3.668 14.032 -0.890 594 H THR 93 H THR 93 -0.284 12.839 1.134 595 HA THR 93 HA THR 93 -2.115 11.475 0.851 596 HB THR 93 HB THR 93 -3.837 12.798 -0.479 597 HG1 THR 93 1HG THR 93 -3.042 14.981 -0.993 598 HG21 THR 93 3HG2 THR 93 -2.223 14.582 1.400 599 HG22 THR 93 1HG2 THR 93 -3.324 13.278 1.961 600 HG23 THR 93 2HG2 THR 93 -3.953 14.652 1.046 601 HA PRO 94 HA PRO 94 -1.164 9.741 -3.406 602 HB3 PRO 94 2HB PRO 94 1.081 9.214 -3.112 603 HG3 PRO 94 2HG PRO 94 1.954 8.613 -0.975 604 HD3 PRO 94 2HD PRO 94 0.916 10.690 -1.015 605 H ILE 95 H ILE 95 -1.791 7.737 -0.490 606 HA ILE 95 HA ILE 95 -2.795 5.622 -2.254 607 HB ILE 95 HB ILE 95 -2.664 5.678 0.781 608 HG13 ILE 95 2HG1 ILE 95 -0.606 4.236 0.445 609 HG21 ILE 95 1HG2 ILE 95 -4.167 3.922 0.041 610 HG22 ILE 95 2HG2 ILE 95 -2.998 3.353 -1.167 611 HG23 ILE 95 3HG2 ILE 95 -2.667 3.185 0.573 612 HD11 ILE 95 3HD1 ILE 95 -0.816 3.875 -2.103 613 HD12 ILE 95 1HD1 ILE 95 -0.358 5.567 -2.303 614 HD13 ILE 95 2HD1 ILE 95 0.765 4.450 -1.540 615 H LYS 96 H LYS 96 -4.158 8.310 -0.651 616 HA LYS 96 HA LYS 96 -6.723 7.609 0.068 617 HB3 LYS 96 2HB LYS 96 -5.648 10.105 -1.304 618 HG3 LYS 96 2HG LYS 96 -8.026 10.253 -1.357 619 HD3 LYS 96 2HD LYS 96 -7.968 9.578 1.621 620 HE3 LYS 96 2HE LYS 96 -9.451 11.510 1.086 621 HZ1 LYS 96 3HZ LYS 96 -11.181 9.608 -0.369 622 HZ2 LYS 96 1HZ LYS 96 -10.138 10.497 -1.218 623 HZ3 LYS 96 2HZ LYS 96 -11.289 11.253 -0.312 624 H THR 97 H THR 97 -5.763 8.715 -3.257 625 HA THR 97 HA THR 97 -8.305 8.158 -4.295 626 HB THR 97 HB THR 97 -5.706 8.467 -5.824 627 HG1 THR 97 1HG THR 97 -5.941 10.721 -5.413 628 HG21 THR 97 3HG2 THR 97 -7.135 9.878 -7.328 629 HG22 THR 97 1HG2 THR 97 -8.540 9.516 -6.306 630 HG23 THR 97 2HG2 THR 97 -7.768 8.218 -7.210 631 H LEU 98 H LEU 98 -5.653 5.963 -3.737 632 HA LEU 98 HA LEU 98 -6.550 3.990 -5.754 633 HB3 LEU 98 2HB LEU 98 -4.438 4.001 -3.549 634 HG LEU 98 HG LEU 98 -5.254 1.695 -3.697 635 HD11 LEU 98 1HD1 LEU 98 -4.532 1.859 -6.663 636 HD12 LEU 98 2HD1 LEU 98 -6.159 1.600 -5.985 637 HD13 LEU 98 3HD1 LEU 98 -4.917 0.374 -5.772 638 HD21 LEU 98 3HD2 LEU 98 -2.551 2.068 -5.042 639 HD22 LEU 98 1HD2 LEU 98 -3.106 0.634 -4.151 640 HD23 LEU 98 2HD2 LEU 98 -2.861 2.160 -3.294 641 H LEU 99 H LEU 99 -6.666 4.473 -2.183 642 HA LEU 99 HA LEU 99 -7.974 2.001 -1.646 643 HB3 LEU 99 2HB LEU 99 -6.652 3.684 -0.176 644 HG LEU 99 HG LEU 99 -8.794 5.344 -0.285 645 HD11 LEU 99 1HD1 LEU 99 -10.406 4.906 1.389 646 HD12 LEU 99 2HD1 LEU 99 -9.437 3.586 2.104 647 HD13 LEU 99 3HD1 LEU 99 -10.225 3.349 0.537 648 HD21 LEU 99 3HD2 LEU 99 -8.090 6.024 2.034 649 HD22 LEU 99 1HD2 LEU 99 -6.741 5.766 0.908 650 HD23 LEU 99 2HD2 LEU 99 -7.090 4.518 2.052 651 H ASP 100 H ASP 100 -9.258 5.241 -2.473 652 HA ASP 100 HA ASP 100 -11.995 4.693 -2.161 653 HB3 ASP 100 2HB ASP 100 -10.597 6.287 -4.336 654 H GLN 101 H GLN 101 -9.791 3.667 -4.814 655 HA GLN 101 HA GLN 101 -11.937 2.426 -6.330 656 HB3 GLN 101 2HB GLN 101 -10.101 1.581 -7.730 657 HG3 GLN 101 2HG GLN 101 -9.679 4.531 -7.112 658 HE21 GLN 101 1HE2 GLN 101 -8.720 5.696 -8.858 659 HE22 GLN 101 2HE2 GLN 101 -8.211 4.912 -10.339 660 H MET 102 H MET 102 -9.481 1.283 -4.017 661 HA MET 102 HA MET 102 -9.827 -1.510 -4.496 662 HB3 MET 102 2HB MET 102 -8.781 -1.745 -2.212 663 HG3 MET 102 2HG MET 102 -7.371 0.193 -4.061 664 HE1 MET 102 3HE MET 102 -6.957 -2.666 -1.246 665 HE2 MET 102 1HE MET 102 -5.989 -3.149 -2.658 666 HE3 MET 102 2HE MET 102 -5.186 -2.683 -1.143 667 H LYS 103 H LYS 103 -12.003 0.612 -3.024 668 HA LYS 103 HA LYS 103 -12.577 -0.102 -0.701 669 HB3 LYS 103 2HB LYS 103 -13.670 1.636 -2.097 670 HG3 LYS 103 2HG LYS 103 -16.037 1.392 -2.570 671 HD3 LYS 103 2HD LYS 103 -16.000 -0.392 -4.408 672 HE3 LYS 103 2HE LYS 103 -13.601 1.408 -4.380 673 HZ1 LYS 103 3HZ LYS 103 -14.224 1.893 -6.648 674 HZ2 LYS 103 1HZ LYS 103 -15.430 0.804 -6.611 675 HZ3 LYS 103 2HZ LYS 103 -13.859 0.286 -6.443 676 H ASN 104 H ASN 104 -13.723 -2.211 -3.084 677 HA ASN 104 HA ASN 104 -15.602 -3.683 -1.321 678 HB3 ASN 104 2HB ASN 104 -15.465 -5.201 -3.569 679 HD21 ASN 104 1HD2 ASN 104 -16.713 -2.180 -2.141 680 HD22 ASN 104 2HD2 ASN 104 -18.123 -2.149 -3.175 681 H TYR 105 H TYR 105 -12.259 -3.810 -1.695 682 HA TYR 105 HA TYR 105 -11.913 -6.670 -1.433 683 HB3 TYR 105 2HB TYR 105 -10.118 -4.259 -0.884 684 HD1 TYR 105 1HD TYR 105 -9.933 -7.992 -1.476 685 HD2 TYR 105 2HD TYR 105 -8.195 -4.518 0.425 686 HE1 TYR 105 1HE TYR 105 -8.342 -9.440 -0.279 687 HE2 TYR 105 2HE TYR 105 -6.504 -5.980 1.517 688 HH TYR 105 HH TYR 105 -6.384 -9.531 1.070 689 H ARG 106 H ARG 106 -11.211 -7.856 0.389 690 HA ARG 106 HA ARG 106 -11.637 -6.754 3.073 691 HB3 ARG 106 2HB ARG 106 -13.125 -8.638 3.599 692 HG3 ARG 106 2HG ARG 106 -14.965 -8.360 1.786 693 HD3 ARG 106 2HD ARG 106 -15.128 -5.714 2.364 694 HE ARG 106 HE ARG 106 -16.290 -7.892 3.496 695 HH11 ARG 106 1HH1 ARG 106 -14.998 -4.861 5.014 696 HH12 ARG 106 2HH1 ARG 106 -16.253 -4.811 6.179 697 HH21 ARG 106 1HH2 ARG 106 -17.994 -7.667 5.098 698 HH22 ARG 106 2HH2 ARG 106 -17.613 -6.650 6.465 699 H GLY 107 H GLY 107 -9.634 -7.282 4.025 700 HA2 GLY 107 1HA GLY 107 -8.857 -9.868 4.483 701 HA3 GLY 107 2HA GLY 107 -7.969 -9.466 3.020 702 H GLU 108 H GLU 108 -5.990 -8.479 3.311 703 HA GLU 108 HA GLU 108 -5.422 -6.958 5.784 704 HB3 GLU 108 2HB GLU 108 -3.136 -8.013 5.469 705 HG3 GLU 108 2HG GLU 108 -5.121 -8.881 7.049 706 H VAL 109 H VAL 109 -4.272 -5.141 5.479 707 HA VAL 109 HA VAL 109 -2.912 -4.621 2.913 708 HB VAL 109 HB VAL 109 -4.708 -2.744 4.501 709 HG11 VAL 109 1HG1 VAL 109 -2.856 -2.219 2.156 710 HG12 VAL 109 2HG1 VAL 109 -4.125 -1.090 2.691 711 HG13 VAL 109 3HG1 VAL 109 -2.777 -1.472 3.764 712 HG21 VAL 109 3HG2 VAL 109 -4.901 -3.907 1.692 713 HG22 VAL 109 1HG2 VAL 109 -6.035 -4.136 3.038 714 HG23 VAL 109 2HG2 VAL 109 -5.891 -2.547 2.277 715 H ALA 110 H ALA 110 -0.700 -4.146 3.384 716 HA ALA 110 HA ALA 110 -0.284 -2.733 5.987 717 HB1 ALA 110 1HB ALA 110 0.741 -4.967 6.097 718 HB2 ALA 110 2HB ALA 110 1.700 -4.588 4.646 719 HB3 ALA 110 3HB ALA 110 1.915 -3.641 6.140 720 H SER 111 H SER 111 1.021 -0.884 5.957 721 HA SER 111 HA SER 111 1.691 0.007 3.187 722 HB3 SER 111 2HB SER 111 1.036 2.051 5.222 723 HG SER 111 HG SER 111 1.234 2.450 2.895 724 H PHE 112 H PHE 112 3.886 -0.260 2.984 725 HA PHE 112 HA PHE 112 5.666 0.477 5.240 726 HB3 PHE 112 2HB PHE 112 6.366 -1.435 3.952 727 HD1 PHE 112 2HD PHE 112 4.987 -2.226 2.055 728 HD2 PHE 112 1HD PHE 112 7.934 0.891 1.587 729 HE1 PHE 112 2HE PHE 112 5.089 -2.684 -0.377 730 HE2 PHE 112 1HE PHE 112 8.040 0.417 -0.842 731 HZ PHE 112 HZ PHE 112 6.633 -1.397 -1.820 732 H PHE 113 H PHE 113 7.114 2.251 5.117 733 HA PHE 113 HA PHE 113 6.754 4.183 2.906 734 HB3 PHE 113 2HB PHE 113 6.902 6.020 4.624 735 HD1 PHE 113 1HD PHE 113 4.225 3.488 5.538 736 HD2 PHE 113 2HD PHE 113 5.212 7.201 3.616 737 HE1 PHE 113 1HE PHE 113 1.810 4.004 5.244 738 HE2 PHE 113 2HE PHE 113 2.814 7.735 3.379 739 HZ PHE 113 HZ PHE 113 1.102 6.106 4.156 740 H THR 114 H THR 114 8.583 5.917 3.125 741 HA THR 114 HA THR 114 11.021 4.938 4.447 742 HB THR 114 HB THR 114 12.228 5.494 2.213 743 HG1 THR 114 1HG THR 114 10.457 6.257 1.022 744 HG21 THR 114 3HG2 THR 114 12.045 3.209 1.385 745 HG22 THR 114 1HG2 THR 114 10.550 2.953 2.283 746 HG23 THR 114 2HG2 THR 114 12.066 3.192 3.161 747 H SER 115 H SER 115 12.145 6.700 5.280 748 HA SER 115 HA SER 115 11.928 9.325 4.105 749 HB3 SER 115 2HB SER 115 11.138 9.109 6.997 750 HG SER 115 HG SER 115 11.134 11.116 5.076 751 H ALA 116 H ALA 116 13.117 10.834 5.742 752 HA ALA 116 HA ALA 116 15.808 9.908 6.240 753 HB1 ALA 116 1HB ALA 116 16.077 12.356 6.616 754 HB2 ALA 116 2HB ALA 116 15.230 12.038 5.089 755 HB3 ALA 116 3HB ALA 116 14.310 12.553 6.523 756 H GLY 117 H GLY 117 13.586 8.863 7.970 757 HA2 GLY 117 1HA GLY 117 13.282 8.445 10.231 758 HA3 GLY 117 2HA GLY 117 14.877 9.208 10.358 759 H THR 118 H THR 118 12.012 11.000 9.205 760 HA THR 118 HA THR 118 11.890 12.462 11.798 761 HB THR 118 HB THR 118 11.180 14.364 10.342 762 HG1 THR 118 1HG THR 118 12.144 14.131 8.137 763 HG21 THR 118 3HG2 THR 118 13.440 14.240 11.314 764 HG22 THR 118 1HG2 THR 118 13.494 14.970 9.705 765 HG23 THR 118 2HG2 THR 118 14.015 13.293 9.918 766 H ASN 119 H ASN 119 9.854 12.946 12.602 767 HA ASN 119 HA ASN 119 7.657 12.676 13.008 768 HB3 ASN 119 2HB ASN 119 6.199 13.318 11.032 769 HD21 ASN 119 1HD2 ASN 119 8.147 15.421 9.679 770 HD22 ASN 119 2HD2 ASN 119 7.960 16.727 10.835 771 H HIS 120 H HIS 120 9.061 10.114 12.423 772 HA HIS 120 HA HIS 120 7.602 8.429 10.810 773 HB3 HIS 120 2HB HIS 120 9.803 7.919 12.016 774 HD1 HIS 120 1HD HIS 120 8.247 5.340 14.255 775 HD2 HIS 120 2HD HIS 120 9.500 9.374 14.564 776 HE1 HIS 120 1HE HIS 120 8.471 5.841 16.695 777 H LYS 121 H LYS 121 6.890 9.293 14.230 778 HA LYS 121 HA LYS 121 4.896 7.329 14.503 779 HB3 LYS 121 2HB LYS 121 4.835 9.928 16.041 780 HG3 LYS 121 2HG LYS 121 4.876 6.996 16.732 781 HD3 LYS 121 2HD LYS 121 4.552 9.436 18.521 782 HE3 LYS 121 2HE LYS 121 4.267 7.657 20.346 783 HZ1 LYS 121 3HZ LYS 121 2.459 9.039 19.678 784 HZ2 LYS 121 1HZ LYS 121 1.869 7.524 19.965 785 HZ3 LYS 121 2HZ LYS 121 2.045 8.067 18.439 786 H ALA 122 H ALA 122 4.864 10.612 13.268 787 HA ALA 122 HA ALA 122 2.025 11.052 13.359 788 HB1 ALA 122 1HB ALA 122 4.139 12.479 11.682 789 HB2 ALA 122 2HB ALA 122 2.524 13.062 12.086 790 HB3 ALA 122 3HB ALA 122 3.732 12.885 13.368 791 H TYR 123 H TYR 123 4.312 10.197 10.673 792 HA TYR 123 HA TYR 123 2.440 10.229 8.592 793 HB3 TYR 123 2HB TYR 123 5.017 9.840 8.702 794 HD1 TYR 123 2HD TYR 123 3.262 6.705 7.393 795 HD2 TYR 123 1HD TYR 123 6.748 8.578 9.042 796 HE1 TYR 123 2HE TYR 123 4.291 4.493 7.717 797 HE2 TYR 123 1HE TYR 123 7.811 6.349 9.390 798 HH TYR 123 HH TYR 123 6.338 3.415 8.202 799 H VAL 124 H VAL 124 3.171 7.582 10.826 800 HA VAL 124 HA VAL 124 1.713 5.542 9.566 801 HB VAL 124 HB VAL 124 2.425 6.157 12.466 802 HG11 VAL 124 1HG1 VAL 124 2.075 3.931 13.153 803 HG12 VAL 124 2HG1 VAL 124 0.619 4.325 12.252 804 HG13 VAL 124 3HG1 VAL 124 1.907 3.362 11.501 805 HG21 VAL 124 3HG2 VAL 124 3.876 4.210 10.632 806 HG22 VAL 124 1HG2 VAL 124 4.303 5.914 10.691 807 HG23 VAL 124 2HG2 VAL 124 4.444 4.951 12.135 808 H SER 125 H SER 125 0.690 8.048 12.000 809 HA SER 125 HA SER 125 -2.079 7.117 12.143 810 HB3 SER 125 2HB SER 125 -2.303 9.597 12.994 811 HG SER 125 HG SER 125 -2.327 8.569 14.696 812 H HIS 126 H HIS 126 -0.340 9.706 10.346 813 HA HIS 126 HA HIS 126 -2.634 10.767 9.053 814 HB3 HIS 126 2HB HIS 126 -0.914 11.789 7.581 815 HD1 HIS 126 1HD HIS 126 1.634 12.987 9.387 816 HD2 HIS 126 2HD HIS 126 -2.430 12.482 10.464 817 HE1 HIS 126 1HE HIS 126 1.118 14.759 11.066 818 H PHE 127 H PHE 127 -0.752 7.953 8.289 819 HA PHE 127 HA PHE 127 -1.979 7.453 5.700 820 HB3 PHE 127 2HB PHE 127 -0.559 5.721 7.760 821 HD1 PHE 127 1HD PHE 127 -1.363 5.586 4.085 822 HD2 PHE 127 2HD PHE 127 -1.469 3.555 7.895 823 HE1 PHE 127 1HE PHE 127 -2.289 3.549 2.987 824 HE2 PHE 127 2HE PHE 127 -2.371 1.539 6.797 825 HZ PHE 127 HZ PHE 127 -2.805 1.528 4.362 826 H ASN 128 H ASN 128 -2.507 5.962 8.950 827 HA ASN 128 HA ASN 128 -4.750 4.464 8.321 828 HB3 ASN 128 2HB ASN 128 -5.387 4.875 10.826 829 HD21 ASN 128 1HD2 ASN 128 -1.852 4.420 10.704 830 HD22 ASN 128 2HD2 ASN 128 -1.979 2.697 11.005 831 H GLU 129 H GLU 129 -4.782 7.859 9.457 832 HA GLU 129 HA GLU 129 -7.647 8.027 9.641 833 HB3 GLU 129 2HB GLU 129 -6.680 10.660 9.249 834 HG3 GLU 129 2HG GLU 129 -6.166 10.610 11.750 835 H TRP 130 H TRP 130 -5.697 7.982 6.863 836 HA TRP 130 HA TRP 130 -7.903 9.062 5.167 837 HB3 TRP 130 2HB TRP 130 -6.169 9.884 3.656 838 HD1 TRP 130 HD TRP 130 -5.007 10.754 7.231 839 HE1 TRP 130 1HE TRP 130 -5.659 13.133 7.811 840 HE3 TRP 130 3HE TRP 130 -7.676 11.870 3.025 841 HZ2 TRP 130 2HZ TRP 130 -6.722 15.443 6.357 842 HZ3 TRP 130 3HZ TRP 130 -8.597 14.131 2.694 843 HH2 TRP 130 HH TRP 130 -8.129 15.942 4.334 844 H ALA 131 H ALA 131 -7.075 6.351 6.296 845 HA ALA 131 HA ALA 131 -7.448 4.818 3.955 846 HB1 ALA 131 1HB ALA 131 -4.762 4.474 5.382 847 HB2 ALA 131 2HB ALA 131 -5.367 3.524 4.011 848 HB3 ALA 131 3HB ALA 131 -4.951 5.220 3.770 849 H ASP 132 H ASP 132 -9.041 5.132 6.128 850 HA ASP 132 HA ASP 132 -8.685 2.587 7.578 851 HB3 ASP 132 2HB ASP 132 -10.909 4.500 8.254 852 H GLY 133 H GLY 133 -9.362 2.688 4.869 853 HA2 GLY 133 1HA GLY 133 -12.253 1.936 4.659 854 HA3 GLY 133 2HA GLY 133 -11.140 2.164 3.302 855 H LEU 134 H LEU 134 -9.009 0.576 4.048 856 HA LEU 134 HA LEU 134 -10.150 -2.177 3.976 857 HB3 LEU 134 2HB LEU 134 -8.205 -2.702 2.525 858 HG LEU 134 HG LEU 134 -8.855 -1.914 0.428 859 HD11 LEU 134 1HD1 LEU 134 -11.413 -2.120 2.059 860 HD12 LEU 134 2HD1 LEU 134 -10.383 -3.484 1.585 861 HD13 LEU 134 3HD1 LEU 134 -11.197 -2.512 0.347 862 HD21 LEU 134 3HD2 LEU 134 -9.103 0.537 0.881 863 HD22 LEU 134 1HD2 LEU 134 -10.719 0.203 1.543 864 HD23 LEU 134 2HD2 LEU 134 -10.358 -0.155 -0.146 865 H ASN 135 H ASN 135 -9.001 -3.743 5.038 866 HA ASN 135 HA ASN 135 -8.383 -2.918 7.597 867 HB3 ASN 135 2HB ASN 135 -7.957 -5.581 6.241 868 HD21 ASN 135 1HD2 ASN 135 -6.544 -6.714 7.514 869 HD22 ASN 135 2HD2 ASN 135 -6.608 -6.827 9.265 870 H VAL 136 H VAL 136 -6.551 -1.758 8.112 871 HA VAL 136 HA VAL 136 -3.927 -2.371 7.194 872 HB VAL 136 HB VAL 136 -4.923 -0.791 9.597 873 HG11 VAL 136 1HG1 VAL 136 -2.568 -1.367 9.969 874 HG12 VAL 136 2HG1 VAL 136 -2.149 -0.834 8.316 875 HG13 VAL 136 3HG1 VAL 136 -2.712 0.332 9.536 876 HG21 VAL 136 3HG2 VAL 136 -5.703 0.140 7.466 877 HG22 VAL 136 1HG2 VAL 136 -4.407 1.155 8.088 878 HG23 VAL 136 2HG2 VAL 136 -4.072 -0.006 6.774 879 H ILE 137 H ILE 137 -2.696 -4.203 7.723 880 HA ILE 137 HA ILE 137 -2.856 -5.205 10.508 881 HB ILE 137 HB ILE 137 -1.506 -7.072 9.666 882 HG13 ILE 137 2HG1 ILE 137 -0.689 -5.660 7.627 883 HG21 ILE 137 1HG2 ILE 137 -4.020 -7.109 9.885 884 HG22 ILE 137 2HG2 ILE 137 -4.126 -6.766 8.146 885 HG23 ILE 137 3HG2 ILE 137 -3.354 -8.261 8.733 886 HD11 ILE 137 3HD1 ILE 137 -1.565 -8.499 7.073 887 HD12 ILE 137 1HD1 ILE 137 -0.277 -7.563 6.273 888 HD13 ILE 137 2HD1 ILE 137 -0.113 -8.033 7.980 889 H GLY 138 H GLY 138 -1.154 -2.907 8.684 890 HA2 GLY 138 1HA GLY 138 0.254 -2.105 10.860 891 HA3 GLY 138 2HA GLY 138 1.389 -3.199 10.066 892 H VAL 139 H VAL 139 1.849 -0.496 10.466 893 HA VAL 139 HA VAL 139 2.629 0.245 7.829 894 HB VAL 139 HB VAL 139 0.703 1.478 7.726 895 HG11 VAL 139 1HG1 VAL 139 0.901 1.732 10.668 896 HG12 VAL 139 2HG1 VAL 139 -0.017 2.957 9.733 897 HG13 VAL 139 3HG1 VAL 139 -0.406 1.220 9.597 898 HG21 VAL 139 3HG2 VAL 139 1.230 3.795 7.882 899 HG22 VAL 139 1HG2 VAL 139 2.555 3.458 9.014 900 HG23 VAL 139 2HG2 VAL 139 2.659 2.913 7.332 901 H ALA 140 H ALA 140 4.622 0.362 7.926 902 HA ALA 140 HA ALA 140 6.148 1.434 10.176 903 HB1 ALA 140 1HB ALA 140 5.914 -1.040 10.603 904 HB2 ALA 140 2HB ALA 140 6.747 -1.348 9.058 905 HB3 ALA 140 3HB ALA 140 7.582 -0.521 10.376 906 H ARG 141 H ARG 141 8.733 1.006 9.248 907 HA ARG 141 HA ARG 141 8.587 2.098 6.510 908 HB3 ARG 141 2HB ARG 141 8.973 4.046 7.910 909 HG3 ARG 141 2HG ARG 141 11.466 3.852 8.950 910 HD3 ARG 141 2HD ARG 141 9.393 4.777 10.103 911 HE ARG 141 HE ARG 141 7.922 3.172 10.846 912 HH11 ARG 141 1HH1 ARG 141 11.254 2.019 11.518 913 HH12 ARG 141 2HH1 ARG 141 10.774 0.798 12.591 914 HH21 ARG 141 1HH2 ARG 141 7.297 1.516 12.415 915 HH22 ARG 141 2HH2 ARG 141 8.531 0.461 13.073 916 H ASP 142 H ASP 142 10.370 1.769 5.286 917 HA ASP 142 HA ASP 142 11.774 0.358 4.254 918 HB3 ASP 142 2HB ASP 142 13.773 -0.416 5.471 919 H ASP 143 H ASP 143 12.847 -2.287 5.280 920 HA ASP 143 HA ASP 143 10.383 -3.744 4.629 921 HB3 ASP 143 2HB ASP 143 12.469 -3.920 3.249 922 H SER 144 H SER 144 11.246 -2.855 7.502 923 HA SER 144 HA SER 144 12.117 -5.237 8.762 924 HB3 SER 144 2HB SER 144 11.005 -2.914 10.313 925 HG SER 144 HG SER 144 12.069 -4.103 11.678 926 H GLU 145 H GLU 145 8.819 -4.666 7.846 927 HA GLU 145 HA GLU 145 8.020 -6.634 9.952 928 HB3 GLU 145 2HB GLU 145 5.731 -5.663 9.881 929 HG3 GLU 145 2HG GLU 145 7.874 -3.748 10.834 930 H VAL 146 H VAL 146 8.810 -6.844 6.821 931 HA VAL 146 HA VAL 146 6.529 -7.874 5.560 932 HB VAL 146 HB VAL 146 9.386 -8.848 5.172 933 HG11 VAL 146 1HG1 VAL 146 7.786 -10.282 3.999 934 HG12 VAL 146 2HG1 VAL 146 6.921 -8.866 3.364 935 HG13 VAL 146 3HG1 VAL 146 8.565 -9.237 2.809 936 HG21 VAL 146 3HG2 VAL 146 7.921 -6.543 3.820 937 HG22 VAL 146 1HG2 VAL 146 9.275 -6.377 4.947 938 HG23 VAL 146 2HG2 VAL 146 9.536 -7.175 3.400 939 H ASP 147 H ASP 147 8.752 -9.561 7.811 940 HA ASP 147 HA ASP 147 7.767 -12.171 7.524 941 HB3 ASP 147 2HB ASP 147 8.884 -10.664 9.902 942 H LYS 148 H LYS 148 6.117 -9.440 9.053 943 HA LYS 148 HA LYS 148 4.059 -11.353 10.038 944 HB3 LYS 148 2HB LYS 148 4.841 -9.890 11.829 945 HG3 LYS 148 2HG LYS 148 4.165 -7.733 9.858 946 HD3 LYS 148 2HD LYS 148 2.636 -7.474 11.966 947 HE3 LYS 148 2HE LYS 148 5.404 -6.624 12.896 948 HZ1 LYS 148 3HZ LYS 148 3.892 -4.817 13.092 949 HZ2 LYS 148 1HZ LYS 148 4.351 -5.341 14.577 950 HZ3 LYS 148 2HZ LYS 148 2.835 -5.689 14.021 951 H TRP 149 H TRP 149 4.711 -9.228 7.486 952 HA TRP 149 HA TRP 149 1.853 -8.828 6.827 953 HB3 TRP 149 2HB TRP 149 2.634 -7.190 5.261 954 HD1 TRP 149 HD TRP 149 1.924 -7.280 8.564 955 HE1 TRP 149 1HE TRP 149 2.349 -5.176 9.804 956 HE3 TRP 149 3HE TRP 149 5.062 -5.091 5.206 957 HZ2 TRP 149 2HZ TRP 149 3.707 -2.570 9.289 958 HZ3 TRP 149 3HZ TRP 149 5.808 -2.744 5.535 959 HH2 TRP 149 HH TRP 149 5.120 -1.474 7.509 960 H SER 150 H SER 150 3.814 -11.328 6.294 961 HA SER 150 HA SER 150 2.787 -11.772 3.540 962 HB3 SER 150 2HB SER 150 5.557 -12.518 4.548 963 HG SER 150 HG SER 150 5.220 -13.795 2.892 964 H LYS 151 H LYS 151 2.077 -12.495 6.450 965 HA LYS 151 HA LYS 151 2.497 -15.350 6.680 966 HB3 LYS 151 2HB LYS 151 1.207 -15.139 8.731 967 HG3 LYS 151 2HG LYS 151 3.157 -12.831 8.551 968 HD3 LYS 151 2HD LYS 151 4.095 -13.923 10.601 969 HE3 LYS 151 2HE LYS 151 1.232 -13.167 11.201 970 HZ1 LYS 151 3HZ LYS 151 2.503 -11.787 12.872 971 HZ2 LYS 151 1HZ LYS 151 3.885 -12.568 12.399 972 HZ3 LYS 151 2HZ LYS 151 2.663 -13.389 13.088 Start of MODEL 15 1 H1 GLY 1 H GLY 1 -11.417 -25.266 -4.303 2 HA2 GLY 1 1HA GLY 1 -10.191 -23.621 -2.224 3 HA3 GLY 1 2HA GLY 1 -9.932 -25.354 -2.503 4 H MET 2 H MET 2 -7.783 -23.590 -2.128 5 HA MET 2 HA MET 2 -5.971 -22.595 -2.905 6 HB3 MET 2 2HB MET 2 -5.271 -22.757 -5.348 7 HG3 MET 2 2HG MET 2 -4.591 -24.332 -3.213 8 HE1 MET 2 3HE MET 2 -3.111 -26.364 -5.928 9 HE2 MET 2 1HE MET 2 -2.701 -26.562 -4.217 10 HE3 MET 2 2HE MET 2 -3.414 -27.917 -5.123 11 H ALA 3 H ALA 3 -6.936 -20.712 -2.331 12 HA ALA 3 HA ALA 3 -7.165 -18.874 -4.553 13 HB1 ALA 3 1HB ALA 3 -9.148 -17.752 -3.599 14 HB2 ALA 3 2HB ALA 3 -9.538 -19.362 -4.241 15 HB3 ALA 3 3HB ALA 3 -9.400 -19.111 -2.488 16 H LYS 4 H LYS 4 -5.088 -18.277 -3.799 17 HA LYS 4 HA LYS 4 -5.137 -16.395 -1.648 18 HB3 LYS 4 2HB LYS 4 -4.729 -18.338 -0.262 19 HG3 LYS 4 2HG LYS 4 -2.538 -19.360 -0.145 20 HD3 LYS 4 2HD LYS 4 -4.503 -20.421 -1.550 21 HE3 LYS 4 2HE LYS 4 -2.764 -19.430 -3.650 22 HZ1 LYS 4 3HZ LYS 4 -2.266 -21.461 -4.745 23 HZ2 LYS 4 1HZ LYS 4 -2.949 -22.393 -3.547 24 HZ3 LYS 4 2HZ LYS 4 -1.585 -21.557 -3.273 25 H LYS 5 H LYS 5 -3.837 -14.698 -2.229 26 HA LYS 5 HA LYS 5 -1.412 -15.183 -3.821 27 HB3 LYS 5 2HB LYS 5 -1.919 -13.676 -5.583 28 HG3 LYS 5 2HG LYS 5 -4.579 -15.004 -5.098 29 HD3 LYS 5 2HD LYS 5 -4.559 -13.120 -6.785 30 HE3 LYS 5 2HE LYS 5 -2.952 -15.076 -8.473 31 HZ1 LYS 5 3HZ LYS 5 -3.879 -13.711 -10.015 32 HZ2 LYS 5 1HZ LYS 5 -2.641 -12.734 -9.572 33 HZ3 LYS 5 2HZ LYS 5 -4.150 -12.459 -8.978 34 H THR 6 H THR 6 -0.328 -13.056 -4.153 35 HA THR 6 HA THR 6 -0.857 -11.106 -1.973 36 HB THR 6 HB THR 6 1.841 -12.362 -2.502 37 HG1 THR 6 1HG THR 6 1.535 -13.174 -0.454 38 HG21 THR 6 3HG2 THR 6 2.205 -9.992 -1.934 39 HG22 THR 6 1HG2 THR 6 2.555 -10.971 -0.502 40 HG23 THR 6 2HG2 THR 6 1.023 -10.089 -0.616 41 H LEU 7 H LEU 7 -1.078 -9.141 -2.869 42 HA LEU 7 HA LEU 7 0.504 -8.430 -5.345 43 HB3 LEU 7 2HB LEU 7 -2.037 -7.372 -4.085 44 HG LEU 7 HG LEU 7 -1.132 -5.465 -5.292 45 HD11 LEU 7 1HD1 LEU 7 0.445 -6.379 -6.830 46 HD12 LEU 7 2HD1 LEU 7 -0.833 -5.732 -7.855 47 HD13 LEU 7 3HD1 LEU 7 -0.754 -7.467 -7.551 48 HD21 LEU 7 3HD2 LEU 7 -3.574 -6.025 -5.380 49 HD22 LEU 7 1HD2 LEU 7 -3.300 -6.953 -6.856 50 HD23 LEU 7 2HD2 LEU 7 -3.056 -5.204 -6.870 51 H ILE 8 H ILE 8 1.774 -6.513 -5.426 52 HA ILE 8 HA ILE 8 2.159 -5.033 -2.869 53 HB ILE 8 HB ILE 8 4.219 -5.888 -4.922 54 HG13 ILE 8 2HG1 ILE 8 3.462 -7.769 -3.502 55 HG21 ILE 8 1HG2 ILE 8 4.754 -3.672 -3.927 56 HG22 ILE 8 2HG2 ILE 8 4.664 -4.433 -2.328 57 HG23 ILE 8 3HG2 ILE 8 5.917 -4.911 -3.483 58 HD11 ILE 8 3HD1 ILE 8 6.171 -6.950 -2.443 59 HD12 ILE 8 1HD1 ILE 8 5.504 -8.571 -2.704 60 HD13 ILE 8 2HD1 ILE 8 5.913 -7.558 -4.099 61 H LEU 9 H LEU 9 0.916 -3.183 -3.374 62 HA LEU 9 HA LEU 9 1.349 -1.842 -5.991 63 HB3 LEU 9 2HB LEU 9 -0.613 -0.507 -5.441 64 HG LEU 9 HG LEU 9 -1.339 -3.373 -4.754 65 HD11 LEU 9 1HD1 LEU 9 -3.058 -1.646 -4.318 66 HD12 LEU 9 2HD1 LEU 9 -3.535 -2.808 -5.564 67 HD13 LEU 9 3HD1 LEU 9 -3.010 -1.174 -6.029 68 HD21 LEU 9 3HD2 LEU 9 -1.901 -3.458 -7.279 69 HD22 LEU 9 1HD2 LEU 9 -0.199 -3.483 -6.845 70 HD23 LEU 9 2HD2 LEU 9 -0.960 -1.973 -7.428 71 H TYR 10 H TYR 10 3.290 -0.454 -5.795 72 HA TYR 10 HA TYR 10 3.237 1.226 -3.356 73 HB3 TYR 10 2HB TYR 10 5.101 -0.436 -3.080 74 HD1 TYR 10 2HD TYR 10 5.455 -0.865 -6.103 75 HD2 TYR 10 1HD TYR 10 7.649 1.347 -3.176 76 HE1 TYR 10 2HE TYR 10 7.286 -0.557 -7.741 77 HE2 TYR 10 1HE TYR 10 9.316 1.983 -4.912 78 HH TYR 10 HH TYR 10 9.032 0.974 -8.302 79 H TYR 11 H TYR 11 4.728 3.216 -3.649 80 HA TYR 11 HA TYR 11 4.360 4.269 -6.403 81 HB3 TYR 11 2HB TYR 11 3.553 5.577 -3.847 82 HD1 TYR 11 1HD TYR 11 4.392 6.201 -7.569 83 HD2 TYR 11 2HD TYR 11 3.678 8.034 -3.709 84 HE1 TYR 11 1HE TYR 11 5.078 8.373 -8.460 85 HE2 TYR 11 2HE TYR 11 4.333 10.217 -4.655 86 HH TYR 11 HH TYR 11 5.698 10.605 -7.908 87 H SER 12 H SER 12 6.282 4.384 -7.124 88 HA SER 12 HA SER 12 8.608 5.096 -5.592 89 HB3 SER 12 2HB SER 12 8.939 3.551 -7.333 90 HG SER 12 HG SER 12 7.597 5.402 -8.987 91 H TRP 13 H TRP 13 8.536 7.144 -4.734 92 HA TRP 13 HA TRP 13 7.808 9.555 -5.766 93 HB3 TRP 13 2HB TRP 13 10.419 9.076 -4.256 94 HD1 TRP 13 HD TRP 13 7.413 11.240 -3.233 95 HE1 TRP 13 1HE TRP 13 8.065 13.650 -3.071 96 HE3 TRP 13 3HE TRP 13 12.184 11.001 -5.199 97 HZ2 TRP 13 2HZ TRP 13 10.078 15.371 -4.074 98 HZ3 TRP 13 3HZ TRP 13 13.329 13.162 -5.753 99 HH2 TRP 13 HH TRP 13 12.282 15.314 -5.209 100 H SER 14 H SER 14 11.322 8.762 -5.961 101 HA SER 14 HA SER 14 11.431 8.963 -8.816 102 HB3 SER 14 2HB SER 14 12.981 11.261 -7.864 103 HG SER 14 HG SER 14 12.391 10.727 -10.024 104 H GLY 15 H GLY 15 12.252 7.026 -7.032 105 HA2 GLY 15 1HA GLY 15 14.124 5.624 -7.523 106 HA3 GLY 15 2HA GLY 15 15.193 7.028 -7.540 107 H GLU 16 H GLU 16 12.704 6.540 -5.066 108 HA GLU 16 HA GLU 16 14.814 6.285 -2.971 109 HB3 GLU 16 2HB GLU 16 13.361 7.803 -1.652 110 HG3 GLU 16 2HG GLU 16 13.594 9.903 -3.019 111 H THR 17 H THR 17 11.145 6.138 -3.165 112 HA THR 17 HA THR 17 10.765 3.947 -1.501 113 HB THR 17 HB THR 17 9.123 4.221 -3.955 114 HG1 THR 17 1HG THR 17 8.304 6.153 -2.401 115 HG21 THR 17 3HG2 THR 17 7.285 3.667 -2.662 116 HG22 THR 17 1HG2 THR 17 7.973 4.395 -1.191 117 HG23 THR 17 2HG2 THR 17 8.560 2.844 -1.806 118 H LYS 18 H LYS 18 11.788 4.105 -4.909 119 HA LYS 18 HA LYS 18 11.130 1.456 -5.731 120 HB3 LYS 18 2HB LYS 18 13.242 3.400 -6.732 121 HG3 LYS 18 2HG LYS 18 12.603 2.128 -8.952 122 HD3 LYS 18 2HD LYS 18 14.332 0.294 -8.519 123 HE3 LYS 18 2HE LYS 18 16.104 2.300 -7.843 124 HZ1 LYS 18 3HZ LYS 18 16.503 2.484 -10.160 125 HZ2 LYS 18 1HZ LYS 18 14.994 1.928 -10.551 126 HZ3 LYS 18 2HZ LYS 18 16.077 0.928 -9.839 127 H LYS 19 H LYS 19 13.668 2.560 -3.673 128 HA LYS 19 HA LYS 19 15.131 -0.003 -3.848 129 HB3 LYS 19 2HB LYS 19 16.089 1.583 -1.731 130 HG3 LYS 19 2HG LYS 19 17.510 2.752 -3.752 131 HD3 LYS 19 2HD LYS 19 17.813 -0.138 -2.812 132 HE3 LYS 19 2HE LYS 19 20.266 0.457 -3.378 133 HZ1 LYS 19 3HZ LYS 19 19.986 -0.014 -5.721 134 HZ2 LYS 19 1HZ LYS 19 18.366 0.146 -5.633 135 HZ3 LYS 19 2HZ LYS 19 19.152 -1.036 -4.768 136 H MET 20 H MET 20 12.533 1.124 -2.190 137 HA MET 20 HA MET 20 12.675 -1.144 -0.277 138 HB3 MET 20 2HB MET 20 10.671 1.139 -0.168 139 HG3 MET 20 2HG MET 20 10.292 -0.716 1.366 140 HE1 MET 20 3HE MET 20 14.626 -0.217 3.078 141 HE2 MET 20 1HE MET 20 14.108 0.607 1.596 142 HE3 MET 20 2HE MET 20 13.409 1.075 3.172 143 H ALA 21 H ALA 21 12.064 -1.295 -3.213 144 HA ALA 21 HA ALA 21 9.268 -2.319 -3.071 145 HB1 ALA 21 1HB ALA 21 9.776 -2.258 -5.748 146 HB2 ALA 21 2HB ALA 21 8.820 -1.155 -4.779 147 HB3 ALA 21 3HB ALA 21 10.509 -0.736 -5.183 148 H GLU 22 H GLU 22 12.285 -2.849 -5.037 149 HA GLU 22 HA GLU 22 11.729 -5.611 -5.581 150 HB3 GLU 22 2HB GLU 22 13.126 -4.781 -7.182 151 HG3 GLU 22 2HG GLU 22 14.792 -3.404 -5.062 152 H LYS 23 H LYS 23 13.426 -4.104 -2.903 153 HA LYS 23 HA LYS 23 14.754 -6.446 -1.963 154 HB3 LYS 23 2HB LYS 23 13.834 -4.020 -0.330 155 HG3 LYS 23 2HG LYS 23 15.675 -6.354 0.151 156 HD3 LYS 23 2HD LYS 23 17.018 -5.096 1.747 157 HE3 LYS 23 2HE LYS 23 17.306 -3.943 -1.062 158 HZ1 LYS 23 3HZ LYS 23 18.965 -3.256 0.701 159 HZ2 LYS 23 1HZ LYS 23 19.676 -4.189 -0.490 160 HZ3 LYS 23 2HZ LYS 23 19.292 -4.782 0.977 161 H ILE 24 H ILE 24 11.670 -4.956 -0.948 162 HA ILE 24 HA ILE 24 11.001 -7.044 0.892 163 HB ILE 24 HB ILE 24 9.341 -4.903 -0.522 164 HG13 ILE 24 2HG1 ILE 24 11.049 -3.994 0.970 165 HG21 ILE 24 1HG2 ILE 24 7.622 -5.416 1.331 166 HG22 ILE 24 2HG2 ILE 24 7.791 -6.638 0.072 167 HG23 ILE 24 3HG2 ILE 24 8.545 -6.890 1.652 168 HD11 ILE 24 3HD1 ILE 24 8.810 -2.849 1.046 169 HD12 ILE 24 1HD1 ILE 24 8.439 -3.783 2.515 170 HD13 ILE 24 2HD1 ILE 24 9.799 -2.669 2.505 171 H ASN 25 H ASN 25 10.311 -6.528 -2.610 172 HA ASN 25 HA ASN 25 8.412 -8.605 -2.845 173 HB3 ASN 25 2HB ASN 25 10.288 -7.301 -4.847 174 HD21 ASN 25 1HD2 ASN 25 7.203 -9.290 -4.675 175 HD22 ASN 25 2HD2 ASN 25 7.594 -10.103 -6.184 176 H SER 26 H SER 26 11.993 -8.841 -3.052 177 HA SER 26 HA SER 26 12.014 -11.622 -3.766 178 HB3 SER 26 2HB SER 26 14.299 -11.319 -2.246 179 HG SER 26 HG SER 26 14.052 -11.887 -4.475 180 H GLU 27 H GLU 27 11.473 -10.049 -0.615 181 HA GLU 27 HA GLU 27 11.970 -12.550 0.830 182 HB3 GLU 27 2HB GLU 27 11.139 -10.847 2.756 183 HG3 GLU 27 2HG GLU 27 13.444 -10.158 3.060 184 H ILE 28 H ILE 28 9.581 -11.903 -1.119 185 HA ILE 28 HA ILE 28 7.468 -12.937 0.700 186 HB ILE 28 HB ILE 28 7.248 -10.968 -1.600 187 HG13 ILE 28 2HG1 ILE 28 7.875 -10.221 0.796 188 HG21 ILE 28 1HG2 ILE 28 4.960 -12.356 -0.144 189 HG22 ILE 28 2HG2 ILE 28 4.805 -10.962 -1.240 190 HG23 ILE 28 3HG2 ILE 28 5.368 -12.484 -1.873 191 HD11 ILE 28 3HD1 ILE 28 6.355 -8.383 0.976 192 HD12 ILE 28 1HD1 ILE 28 6.828 -8.616 -0.718 193 HD13 ILE 28 2HD1 ILE 28 5.212 -9.115 -0.150 194 H LYS 29 H LYS 29 5.979 -14.319 -0.423 195 HA LYS 29 HA LYS 29 7.102 -16.338 -2.126 196 HB3 LYS 29 2HB LYS 29 4.189 -16.097 -2.354 197 HG3 LYS 29 2HG LYS 29 4.330 -18.091 -0.714 198 HD3 LYS 29 2HD LYS 29 5.222 -19.708 -2.246 199 HE3 LYS 29 2HE LYS 29 3.843 -19.460 -4.112 200 HZ1 LYS 29 3HZ LYS 29 2.508 -17.551 -2.303 201 HZ2 LYS 29 1HZ LYS 29 2.650 -19.134 -1.878 202 HZ3 LYS 29 2HZ LYS 29 1.818 -18.679 -3.218 203 H ASP 30 H ASP 30 5.459 -16.685 -4.139 204 HA ASP 30 HA ASP 30 6.310 -15.191 -6.366 205 HB3 ASP 30 2HB ASP 30 4.048 -17.228 -6.266 206 H SER 31 H SER 31 5.412 -13.350 -5.001 207 HA SER 31 HA SER 31 2.671 -12.433 -5.590 208 HB3 SER 31 2HB SER 31 3.803 -11.814 -3.484 209 HG SER 31 HG SER 31 5.673 -10.638 -5.216 210 H GLU 32 H GLU 32 3.381 -9.707 -6.229 211 HA GLU 32 HA GLU 32 4.740 -9.733 -8.803 212 HB3 GLU 32 2HB GLU 32 2.034 -8.414 -8.324 213 HG3 GLU 32 2HG GLU 32 3.485 -9.122 -10.927 214 H LEU 33 H LEU 33 4.856 -7.156 -9.305 215 HA LEU 33 HA LEU 33 4.943 -5.454 -6.907 216 HB3 LEU 33 2HB LEU 33 7.065 -4.748 -8.730 217 HG LEU 33 HG LEU 33 7.255 -5.907 -5.947 218 HD11 LEU 33 1HD1 LEU 33 9.576 -5.026 -5.947 219 HD12 LEU 33 2HD1 LEU 33 9.376 -4.440 -7.607 220 HD13 LEU 33 3HD1 LEU 33 9.368 -6.181 -7.271 221 HD21 LEU 33 3HD2 LEU 33 6.117 -3.719 -5.969 222 HD22 LEU 33 1HD2 LEU 33 7.494 -3.015 -6.848 223 HD23 LEU 33 2HD2 LEU 33 7.714 -3.645 -5.194 224 H LYS 34 H LYS 34 3.968 -3.503 -7.347 225 HA LYS 34 HA LYS 34 3.314 -2.766 -10.171 226 HB3 LYS 34 2HB LYS 34 1.633 -1.594 -8.049 227 HG3 LYS 34 2HG LYS 34 -0.021 -3.273 -9.414 228 HD3 LYS 34 2HD LYS 34 0.789 -0.658 -10.702 229 HE3 LYS 34 2HE LYS 34 -1.964 -0.827 -10.313 230 HZ1 LYS 34 3HZ LYS 34 -0.872 -0.450 -12.536 231 HZ2 LYS 34 1HZ LYS 34 -2.112 -1.431 -12.615 232 HZ3 LYS 34 2HZ LYS 34 -0.613 -2.059 -12.653 233 H GLU 35 H GLU 35 2.357 -0.088 -9.512 234 HA GLU 35 HA GLU 35 4.042 1.439 -8.269 235 HB3 GLU 35 2HB GLU 35 5.753 0.709 -9.886 236 HG3 GLU 35 2HG GLU 35 4.318 2.430 -11.873 237 H VAL 36 H VAL 36 2.659 2.862 -7.972 238 HA VAL 36 HA VAL 36 0.488 3.637 -9.794 239 HB VAL 36 HB VAL 36 0.741 3.760 -7.018 240 HG11 VAL 36 1HG1 VAL 36 1.055 5.547 -6.230 241 HG12 VAL 36 2HG1 VAL 36 2.444 4.760 -7.154 242 HG13 VAL 36 3HG1 VAL 36 1.701 6.360 -7.708 243 HG21 VAL 36 3HG2 VAL 36 -1.067 5.335 -8.935 244 HG22 VAL 36 1HG2 VAL 36 -1.367 4.015 -7.749 245 HG23 VAL 36 2HG2 VAL 36 -1.069 5.683 -7.202 246 H LYS 37 H LYS 37 0.358 5.987 -10.526 247 HA LYS 37 HA LYS 37 2.766 7.500 -10.141 248 HB3 LYS 37 2HB LYS 37 3.146 6.618 -12.310 249 HG3 LYS 37 2HG LYS 37 1.449 7.335 -14.193 250 HD3 LYS 37 2HD LYS 37 0.043 5.104 -13.304 251 HE3 LYS 37 2HE LYS 37 1.116 5.400 -15.521 252 HZ1 LYS 37 3HZ LYS 37 3.320 4.389 -15.733 253 HZ2 LYS 37 1HZ LYS 37 3.604 4.507 -14.132 254 HZ3 LYS 37 2HZ LYS 37 3.404 5.850 -15.079 255 H VAL 38 H VAL 38 2.265 9.877 -10.514 256 HA VAL 38 HA VAL 38 -0.590 10.542 -10.172 257 HB VAL 38 HB VAL 38 -0.029 12.360 -8.673 258 HG11 VAL 38 1HG1 VAL 38 0.552 11.057 -6.667 259 HG12 VAL 38 2HG1 VAL 38 -0.676 10.275 -7.663 260 HG13 VAL 38 3HG1 VAL 38 1.020 9.690 -7.662 261 HG21 VAL 38 3HG2 VAL 38 2.853 11.381 -8.623 262 HG22 VAL 38 1HG2 VAL 38 2.294 12.924 -9.303 263 HG23 VAL 38 2HG2 VAL 38 2.161 12.643 -7.580 264 H SER 39 H SER 39 -0.238 13.324 -10.412 265 HA SER 39 HA SER 39 0.500 13.472 -13.271 266 HB3 SER 39 2HB SER 39 -1.010 15.685 -12.137 267 HG SER 39 HG SER 39 -1.559 15.616 -14.100 268 H GLU 40 H GLU 40 0.919 15.963 -13.789 269 HA GLU 40 HA GLU 40 3.443 16.647 -12.392 270 HB3 GLU 40 2HB GLU 40 3.056 18.555 -14.397 271 HG3 GLU 40 2HG GLU 40 4.488 15.889 -14.279 272 H GLY 41 H GLY 41 3.773 18.640 -11.407 273 HA2 GLY 41 1HA GLY 41 3.259 20.734 -10.552 274 HA3 GLY 41 2HA GLY 41 1.661 20.654 -11.289 275 H THR 42 H THR 42 2.409 17.812 -9.465 276 HA THR 42 HA THR 42 0.184 18.444 -7.734 277 HB THR 42 HB THR 42 1.928 15.950 -7.660 278 HG1 THR 42 1HG THR 42 1.181 15.908 -9.683 279 HG21 THR 42 3HG2 THR 42 0.270 16.371 -5.792 280 HG22 THR 42 1HG2 THR 42 -0.067 14.907 -6.736 281 HG23 THR 42 2HG2 THR 42 -1.005 16.411 -6.995 282 H PHE 43 H PHE 43 3.712 17.721 -7.086 283 HA PHE 43 HA PHE 43 3.437 19.444 -4.676 284 HB3 PHE 43 2HB PHE 43 5.024 17.999 -3.420 285 HD1 PHE 43 1HD PHE 43 2.545 15.690 -4.963 286 HD2 PHE 43 2HD PHE 43 3.420 18.390 -1.720 287 HE1 PHE 43 1HE PHE 43 0.451 14.994 -3.805 288 HE2 PHE 43 2HE PHE 43 1.335 17.662 -0.566 289 HZ PHE 43 HZ PHE 43 -0.130 15.985 -1.615 290 H ASP 44 H ASP 44 5.826 19.892 -3.748 291 HA ASP 44 HA ASP 44 7.506 20.599 -6.087 292 HB3 ASP 44 2HB ASP 44 7.438 22.604 -3.884 293 H ALA 45 H ALA 45 9.647 21.556 -5.071 294 HA ALA 45 HA ALA 45 10.650 19.548 -3.072 295 HB1 ALA 45 1HB ALA 45 11.449 18.990 -5.304 296 HB2 ALA 45 2HB ALA 45 12.078 20.645 -5.523 297 HB3 ALA 45 3HB ALA 45 12.779 19.563 -4.304 298 H ASP 46 H ASP 46 9.578 21.724 -2.084 299 HA ASP 46 HA ASP 46 11.788 23.602 -1.334 300 HB3 ASP 46 2HB ASP 46 8.818 24.030 -1.229 301 H MET 47 H MET 47 10.737 24.604 0.966 302 HA MET 47 HA MET 47 10.342 22.283 2.810 303 HB3 MET 47 2HB MET 47 12.571 22.944 3.113 304 HG3 MET 47 2HG MET 47 11.592 25.778 2.867 305 HE1 MET 47 3HE MET 47 11.781 27.334 4.952 306 HE2 MET 47 1HE MET 47 11.486 25.708 5.621 307 HE3 MET 47 2HE MET 47 12.718 26.754 6.349 308 H TYR 48 H TYR 48 9.461 25.652 2.004 309 HA TYR 48 HA TYR 48 7.422 25.561 4.162 310 HB3 TYR 48 2HB TYR 48 8.545 27.600 4.339 311 HD1 TYR 48 1HD TYR 48 6.971 28.579 1.104 312 HD2 TYR 48 2HD TYR 48 10.669 27.972 3.236 313 HE1 TYR 48 1HE TYR 48 8.242 29.340 -0.879 314 HE2 TYR 48 2HE TYR 48 11.941 28.693 1.281 315 HH TYR 48 HH TYR 48 10.944 28.285 -1.432 316 H LYS 49 H LYS 49 7.887 26.016 0.591 317 HA LYS 49 HA LYS 49 5.214 26.551 0.001 318 HB3 LYS 49 2HB LYS 49 7.020 24.849 -1.755 319 HG3 LYS 49 2HG LYS 49 4.572 26.048 -2.371 320 HD3 LYS 49 2HD LYS 49 6.992 27.308 -3.773 321 HE3 LYS 49 2HE LYS 49 4.836 26.647 -5.130 322 HZ1 LYS 49 3HZ LYS 49 3.430 28.631 -5.244 323 HZ2 LYS 49 1HZ LYS 49 4.083 29.195 -3.829 324 HZ3 LYS 49 2HZ LYS 49 3.186 27.800 -3.855 325 H THR 50 H THR 50 6.760 23.387 0.444 326 HA THR 50 HA THR 50 4.654 21.789 -0.591 327 HB THR 50 HB THR 50 6.245 20.076 0.592 328 HG1 THR 50 1HG THR 50 8.381 21.187 0.915 329 HG21 THR 50 3HG2 THR 50 7.953 20.500 -1.143 330 HG22 THR 50 1HG2 THR 50 7.061 21.983 -1.607 331 HG23 THR 50 2HG2 THR 50 6.259 20.391 -1.698 332 H SER 51 H SER 51 5.518 23.011 2.638 333 HA SER 51 HA SER 51 4.005 21.189 4.143 334 HB3 SER 51 2HB SER 51 4.538 24.122 4.770 335 HG SER 51 HG SER 51 3.717 23.466 6.586 336 H ASP 52 H ASP 52 3.146 24.088 2.310 337 HA ASP 52 HA ASP 52 0.430 24.468 3.188 338 HB3 ASP 52 2HB ASP 52 1.772 25.220 0.587 339 H ILE 53 H ILE 53 1.927 22.802 0.346 340 HA ILE 53 HA ILE 53 -0.486 22.335 -1.036 341 HB ILE 53 HB ILE 53 2.042 20.597 -1.042 342 HG13 ILE 53 2HG1 ILE 53 2.543 22.989 -1.483 343 HG21 ILE 53 1HG2 ILE 53 0.162 19.483 -2.179 344 HG22 ILE 53 2HG2 ILE 53 -0.083 20.891 -3.197 345 HG23 ILE 53 3HG2 ILE 53 1.407 19.941 -3.327 346 HD11 ILE 53 3HD1 ILE 53 3.046 21.402 -3.982 347 HD12 ILE 53 1HD1 ILE 53 4.061 22.639 -3.235 348 HD13 ILE 53 2HD1 ILE 53 3.893 21.040 -2.472 349 H ALA 54 H ALA 54 1.311 20.204 1.220 350 HA ALA 54 HA ALA 54 -0.619 18.065 0.891 351 HB1 ALA 54 1HB ALA 54 1.768 17.937 1.814 352 HB2 ALA 54 2HB ALA 54 1.080 18.453 3.364 353 HB3 ALA 54 3HB ALA 54 0.498 16.934 2.590 354 H LEU 55 H LEU 55 -0.476 20.976 2.889 355 HA LEU 55 HA LEU 55 -2.533 20.333 4.736 356 HB3 LEU 55 2HB LEU 55 -2.437 23.169 3.962 357 HG LEU 55 HG LEU 55 -1.251 21.948 6.444 358 HD11 LEU 55 1HD1 LEU 55 -2.643 24.573 5.929 359 HD12 LEU 55 2HD1 LEU 55 -0.879 24.343 6.047 360 HD13 LEU 55 3HD1 LEU 55 -1.939 24.073 7.466 361 HD21 LEU 55 3HD2 LEU 55 -3.462 20.966 6.468 362 HD22 LEU 55 1HD2 LEU 55 -4.169 22.493 5.905 363 HD23 LEU 55 2HD2 LEU 55 -3.486 22.341 7.553 364 H ASP 56 H ASP 56 -2.488 21.873 1.568 365 HA ASP 56 HA ASP 56 -5.069 22.738 1.377 366 HB3 ASP 56 2HB ASP 56 -3.099 23.184 -0.169 367 H GLN 57 H GLN 57 -3.886 19.499 0.750 368 HA GLN 57 HA GLN 57 -6.476 18.413 -0.041 369 HB3 GLN 57 2HB GLN 57 -5.208 16.330 -0.255 370 HG3 GLN 57 2HG GLN 57 -3.531 18.727 -1.151 371 HE21 GLN 57 1HE2 GLN 57 -3.108 17.613 -3.732 372 HE22 GLN 57 2HE2 GLN 57 -1.786 16.478 -3.515 373 H ILE 58 H ILE 58 -5.240 19.245 2.979 374 HA ILE 58 HA ILE 58 -6.464 16.922 4.398 375 HB ILE 58 HB ILE 58 -4.421 19.001 5.241 376 HG13 ILE 58 2HG1 ILE 58 -3.823 16.845 3.849 377 HG21 ILE 58 1HG2 ILE 58 -5.775 16.995 7.070 378 HG22 ILE 58 2HG2 ILE 58 -4.255 17.820 7.450 379 HG23 ILE 58 3HG2 ILE 58 -5.722 18.752 7.221 380 HD11 ILE 58 3HD1 ILE 58 -2.383 16.985 6.503 381 HD12 ILE 58 1HD1 ILE 58 -1.726 16.642 4.884 382 HD13 ILE 58 2HD1 ILE 58 -2.226 18.282 5.297 383 H GLN 59 H GLN 59 -6.166 20.486 4.696 384 HA GLN 59 HA GLN 59 -8.049 20.523 6.817 385 HB3 GLN 59 2HB GLN 59 -7.983 23.147 6.068 386 HG3 GLN 59 2HG GLN 59 -5.707 21.721 7.485 387 HE21 GLN 59 1HE2 GLN 59 -5.854 24.420 5.821 388 HE22 GLN 59 2HE2 GLN 59 -5.408 25.620 7.005 389 H GLY 60 H GLY 60 -8.863 19.855 3.755 390 HA2 GLY 60 1HA GLY 60 -10.957 19.646 2.813 391 HA3 GLY 60 2HA GLY 60 -11.626 20.605 4.146 392 H ASN 61 H ASN 61 -9.007 21.545 2.002 393 HA ASN 61 HA ASN 61 -10.570 23.952 1.196 394 HB3 ASN 61 2HB ASN 61 -8.758 25.225 1.416 395 HD21 ASN 61 1HD2 ASN 61 -7.007 22.153 1.985 396 HD22 ASN 61 2HD2 ASN 61 -6.430 22.563 3.561 397 H LYS 62 H LYS 62 -8.674 21.188 -0.119 398 HA LYS 62 HA LYS 62 -9.451 21.913 -2.856 399 HB3 LYS 62 2HB LYS 62 -6.803 21.026 -3.099 400 HG3 LYS 62 2HG LYS 62 -6.317 23.664 -2.940 401 HD3 LYS 62 2HD LYS 62 -7.462 24.012 -5.214 402 HE3 LYS 62 2HE LYS 62 -5.671 21.561 -4.891 403 HZ1 LYS 62 3HZ LYS 62 -6.415 21.959 -7.159 404 HZ2 LYS 62 1HZ LYS 62 -4.796 22.203 -6.998 405 HZ3 LYS 62 2HZ LYS 62 -5.766 23.505 -7.124 406 H ASP 63 H ASP 63 -8.909 19.979 -4.287 407 HA ASP 63 HA ASP 63 -9.975 17.573 -2.948 408 HB3 ASP 63 2HB ASP 63 -9.553 17.454 -5.872 409 H PHE 64 H PHE 64 -8.987 15.479 -3.971 410 HA PHE 64 HA PHE 64 -6.178 15.543 -3.108 411 HB3 PHE 64 2HB PHE 64 -7.500 13.945 -2.002 412 HD1 PHE 64 1HD PHE 64 -7.654 12.480 -5.476 413 HD2 PHE 64 2HD PHE 64 -9.837 13.708 -1.966 414 HE1 PHE 64 1HE PHE 64 -9.738 11.626 -6.484 415 HE2 PHE 64 2HE PHE 64 -11.953 12.874 -3.040 416 HZ PHE 64 HZ PHE 64 -11.879 11.843 -5.272 417 HA PRO 65 HA PRO 65 -4.530 14.782 -7.171 418 HB3 PRO 65 2HB PRO 65 -2.518 15.076 -6.156 419 HG3 PRO 65 2HG PRO 65 -1.962 14.000 -4.109 420 HD3 PRO 65 2HD PRO 65 -3.983 15.022 -3.542 421 H GLU 66 H GLU 66 -5.152 13.522 -8.701 422 HA GLU 66 HA GLU 66 -6.208 10.849 -8.146 423 HB3 GLU 66 2HB GLU 66 -7.175 11.075 -10.435 424 HG3 GLU 66 2HG GLU 66 -7.583 13.586 -8.747 425 H ILE 67 H ILE 67 -5.700 9.042 -9.724 426 HA ILE 67 HA ILE 67 -2.754 9.014 -10.220 427 HB ILE 67 HB ILE 67 -2.740 6.699 -9.583 428 HG13 ILE 67 2HG1 ILE 67 -4.975 5.992 -10.310 429 HG21 ILE 67 1HG2 ILE 67 -3.044 6.953 -7.167 430 HG22 ILE 67 2HG2 ILE 67 -2.429 8.459 -7.849 431 HG23 ILE 67 3HG2 ILE 67 -4.141 8.324 -7.412 432 HD11 ILE 67 3HD1 ILE 67 -3.784 4.599 -8.605 433 HD12 ILE 67 1HD1 ILE 67 -4.766 5.409 -7.359 434 HD13 ILE 67 2HD1 ILE 67 -5.552 4.446 -8.618 435 H GLN 68 H GLN 68 -1.973 7.780 -11.983 436 HA GLN 68 HA GLN 68 -3.961 7.591 -14.187 437 HB3 GLN 68 2HB GLN 68 -2.355 8.319 -15.663 438 HG3 GLN 68 2HG GLN 68 -1.100 10.220 -14.702 439 HE21 GLN 68 1HE2 GLN 68 -2.124 12.274 -13.631 440 HE22 GLN 68 2HE2 GLN 68 -3.880 12.316 -13.604 441 H LEU 69 H LEU 69 -3.912 5.601 -12.503 442 HA LEU 69 HA LEU 69 -2.289 3.372 -13.636 443 HB3 LEU 69 2HB LEU 69 -3.735 2.163 -11.637 444 HG LEU 69 HG LEU 69 -1.262 3.787 -10.992 445 HD11 LEU 69 1HD1 LEU 69 -2.515 2.684 -9.141 446 HD12 LEU 69 2HD1 LEU 69 -0.937 1.902 -9.383 447 HD13 LEU 69 3HD1 LEU 69 -2.428 1.144 -9.991 448 HD21 LEU 69 3HD2 LEU 69 -0.171 1.424 -11.554 449 HD22 LEU 69 1HD2 LEU 69 -0.443 2.589 -12.853 450 HD23 LEU 69 2HD2 LEU 69 -1.593 1.274 -12.590 451 H ASP 70 H ASP 70 -3.120 1.338 -14.061 452 HA ASP 70 HA ASP 70 -5.284 1.144 -15.840 453 HB3 ASP 70 2HB ASP 70 -4.465 -0.967 -16.256 454 H ASN 71 H ASN 71 -7.090 -0.575 -15.566 455 HA ASN 71 HA ASN 71 -8.235 -0.705 -12.825 456 HB3 ASN 71 2HB ASN 71 -9.289 -1.733 -15.504 457 HD21 ASN 71 1HD2 ASN 71 -11.288 -0.729 -12.638 458 HD22 ASN 71 2HD2 ASN 71 -11.711 -2.367 -12.229 459 H ILE 72 H ILE 72 -8.165 -2.441 -11.648 460 HA ILE 72 HA ILE 72 -7.329 -5.098 -12.576 461 HB ILE 72 HB ILE 72 -5.929 -3.498 -10.387 462 HG13 ILE 72 2HG1 ILE 72 -5.162 -3.055 -12.751 463 HG21 ILE 72 1HG2 ILE 72 -6.272 -5.824 -9.635 464 HG22 ILE 72 2HG2 ILE 72 -5.580 -6.429 -11.160 465 HG23 ILE 72 3HG2 ILE 72 -4.582 -5.570 -9.975 466 HD11 ILE 72 3HD1 ILE 72 -2.842 -3.425 -12.475 467 HD12 ILE 72 1HD1 ILE 72 -3.592 -2.823 -10.965 468 HD13 ILE 72 2HD1 ILE 72 -3.128 -4.535 -11.135 469 H ASP 73 H ASP 73 -8.544 -6.625 -11.501 470 HA ASP 73 HA ASP 73 -10.445 -6.002 -9.378 471 HB3 ASP 73 2HB ASP 73 -10.091 -8.687 -9.237 472 H TYR 74 H TYR 74 -9.562 -5.413 -7.440 473 HA TYR 74 HA TYR 74 -7.080 -6.684 -6.488 474 HB3 TYR 74 2HB TYR 74 -7.332 -5.193 -4.586 475 HD1 TYR 74 2HD TYR 74 -5.499 -4.969 -6.601 476 HD2 TYR 74 1HD TYR 74 -9.141 -2.693 -6.250 477 HE1 TYR 74 2HE TYR 74 -4.482 -3.150 -7.939 478 HE2 TYR 74 1HE TYR 74 -8.130 -0.846 -7.507 479 HH TYR 74 HH TYR 74 -5.382 -0.106 -7.916 480 H ASN 75 H ASN 75 -10.330 -7.647 -6.501 481 HA ASN 75 HA ASN 75 -10.616 -8.403 -3.762 482 HB3 ASN 75 2HB ASN 75 -12.116 -9.450 -6.187 483 HD21 ASN 75 1HD2 ASN 75 -13.494 -7.992 -3.189 484 HD22 ASN 75 2HD2 ASN 75 -14.084 -9.499 -2.572 485 H ASN 76 H ASN 76 -9.130 -10.122 -6.505 486 HA ASN 76 HA ASN 76 -9.368 -12.709 -5.325 487 HB3 ASN 76 2HB ASN 76 -9.536 -12.515 -7.671 488 HD21 ASN 76 1HD2 ASN 76 -9.177 -10.817 -8.983 489 HD22 ASN 76 2HD2 ASN 76 -7.576 -10.179 -9.282 490 H TYR 77 H TYR 77 -7.351 -10.370 -4.194 491 HA TYR 77 HA TYR 77 -4.933 -12.092 -3.891 492 HB3 TYR 77 2HB TYR 77 -3.932 -10.154 -2.885 493 HD1 TYR 77 1HD TYR 77 -2.603 -11.050 -4.831 494 HD2 TYR 77 2HD TYR 77 -6.034 -8.566 -5.457 495 HE1 TYR 77 1HE TYR 77 -2.257 -11.192 -7.282 496 HE2 TYR 77 2HE TYR 77 -5.604 -8.567 -7.895 497 HH TYR 77 HH TYR 77 -2.969 -9.403 -9.455 498 H ASP 78 H ASP 78 -4.295 -12.823 -1.809 499 HA ASP 78 HA ASP 78 -6.437 -12.762 0.304 500 HB3 ASP 78 2HB ASP 78 -4.022 -14.194 1.084 501 H LEU 79 H LEU 79 -3.352 -11.467 -0.568 502 HA LEU 79 HA LEU 79 -3.327 -9.785 1.882 503 HB3 LEU 79 2HB LEU 79 -0.716 -10.838 0.840 504 HG LEU 79 HG LEU 79 -1.712 -10.849 3.716 505 HD11 LEU 79 1HD1 LEU 79 1.075 -10.715 2.506 506 HD12 LEU 79 2HD1 LEU 79 0.299 -12.182 3.168 507 HD13 LEU 79 3HD1 LEU 79 0.650 -10.811 4.220 508 HD21 LEU 79 3HD2 LEU 79 -1.892 -8.500 3.113 509 HD22 LEU 79 1HD2 LEU 79 -0.400 -8.613 2.171 510 HD23 LEU 79 2HD2 LEU 79 -0.350 -8.685 3.951 511 H ILE 80 H ILE 80 -2.735 -7.599 1.413 512 HA ILE 80 HA ILE 80 -1.386 -7.075 -1.161 513 HB ILE 80 HB ILE 80 -3.777 -5.488 -0.169 514 HG13 ILE 80 2HG1 ILE 80 -4.598 -7.604 -1.044 515 HG21 ILE 80 1HG2 ILE 80 -3.499 -4.225 -2.240 516 HG22 ILE 80 2HG2 ILE 80 -2.000 -4.168 -1.352 517 HG23 ILE 80 3HG2 ILE 80 -2.144 -5.258 -2.746 518 HD11 ILE 80 3HD1 ILE 80 -4.888 -5.702 -3.384 519 HD12 ILE 80 1HD1 ILE 80 -5.993 -6.980 -2.866 520 HD13 ILE 80 2HD1 ILE 80 -5.812 -5.525 -1.874 521 H LEU 81 H LEU 81 0.466 -5.973 -0.721 522 HA LEU 81 HA LEU 81 0.562 -4.308 1.737 523 HB3 LEU 81 2HB LEU 81 3.068 -4.137 0.960 524 HG LEU 81 HG LEU 81 2.283 -5.369 2.949 525 HD11 LEU 81 1HD1 LEU 81 2.206 -7.742 1.050 526 HD12 LEU 81 2HD1 LEU 81 0.903 -7.038 2.049 527 HD13 LEU 81 3HD1 LEU 81 2.235 -7.872 2.824 528 HD21 LEU 81 3HD2 LEU 81 4.587 -6.661 1.432 529 HD22 LEU 81 1HD2 LEU 81 4.321 -6.761 3.182 530 HD23 LEU 81 2HD2 LEU 81 4.682 -5.191 2.444 531 H ILE 82 H ILE 82 1.055 -2.121 1.523 532 HA ILE 82 HA ILE 82 1.189 -1.003 -1.233 533 HB ILE 82 HB ILE 82 -0.419 0.051 1.107 534 HG13 ILE 82 2HG1 ILE 82 -1.104 -1.605 -1.292 535 HG21 ILE 82 1HG2 ILE 82 0.547 1.916 -0.154 536 HG22 ILE 82 2HG2 ILE 82 -0.024 1.202 -1.672 537 HG23 ILE 82 3HG2 ILE 82 -1.189 1.787 -0.472 538 HD11 ILE 82 3HD1 ILE 82 -1.589 -2.350 1.049 539 HD12 ILE 82 1HD1 ILE 82 -2.611 -0.912 1.272 540 HD13 ILE 82 2HD1 ILE 82 -3.066 -2.162 0.089 541 H GLY 83 H GLY 83 2.974 0.152 -1.580 542 HA2 GLY 83 1HA GLY 83 4.514 1.425 0.677 543 HA3 GLY 83 2HA GLY 83 5.095 0.990 -0.892 544 H SER 84 H SER 84 5.150 3.683 0.540 545 HA SER 84 HA SER 84 4.957 5.139 -1.890 546 HB3 SER 84 2HB SER 84 3.111 6.320 -1.793 547 HG SER 84 HG SER 84 2.320 4.247 -1.071 548 HA PRO 85 HA PRO 85 7.917 7.659 0.366 549 HB3 PRO 85 2HB PRO 85 8.209 8.780 -1.611 550 HG3 PRO 85 2HG PRO 85 6.429 9.379 -3.032 551 HD3 PRO 85 2HD PRO 85 6.028 7.157 -2.681 552 H VAL 86 H VAL 86 8.183 9.565 1.757 553 HA VAL 86 HA VAL 86 5.797 10.630 3.190 554 HB VAL 86 HB VAL 86 8.537 9.723 4.194 555 HG11 VAL 86 1HG1 VAL 86 8.083 10.327 6.271 556 HG12 VAL 86 2HG1 VAL 86 7.565 11.779 5.492 557 HG13 VAL 86 3HG1 VAL 86 6.349 10.569 6.129 558 HG21 VAL 86 3HG2 VAL 86 7.335 8.197 5.606 559 HG22 VAL 86 1HG2 VAL 86 5.765 8.797 5.002 560 HG23 VAL 86 2HG2 VAL 86 6.895 7.950 3.907 561 H TRP 87 H TRP 87 5.872 12.840 3.382 562 HA TRP 87 HA TRP 87 8.099 14.382 2.177 563 HB3 TRP 87 2HB TRP 87 5.646 15.903 2.809 564 HD1 TRP 87 HD TRP 87 7.143 17.930 1.613 565 HE1 TRP 87 1HE TRP 87 7.693 18.435 -0.902 566 HE3 TRP 87 3HE TRP 87 5.704 13.536 -0.535 567 HZ2 TRP 87 2HZ TRP 87 7.547 17.151 -3.384 568 HZ3 TRP 87 3HZ TRP 87 5.703 13.306 -3.042 569 HH2 TRP 87 HH TRP 87 6.690 15.148 -4.435 570 H SER 88 H SER 88 7.602 16.806 3.571 571 HA SER 88 HA SER 88 8.722 16.450 6.171 572 HB3 SER 88 2HB SER 88 8.215 18.844 6.400 573 HG SER 88 HG SER 88 9.588 19.527 4.902 574 H GLY 89 H GLY 89 7.362 15.035 7.081 575 HA2 GLY 89 1HA GLY 89 6.040 14.883 9.092 576 HA3 GLY 89 2HA GLY 89 5.084 16.252 8.597 577 H TYR 90 H TYR 90 4.242 15.438 5.985 578 HA TYR 90 HA TYR 90 2.635 13.039 6.625 579 HB3 TYR 90 2HB TYR 90 0.572 13.985 6.083 580 HD1 TYR 90 2HD TYR 90 1.162 13.462 8.704 581 HD2 TYR 90 1HD TYR 90 1.083 17.336 6.842 582 HE1 TYR 90 2HE TYR 90 0.740 14.550 10.937 583 HE2 TYR 90 1HE TYR 90 0.581 18.388 9.010 584 HH TYR 90 HH TYR 90 0.306 18.036 11.300 585 HA PRO 91 HA PRO 91 3.798 12.281 2.539 586 HB3 PRO 91 2HB PRO 91 3.249 10.080 2.930 587 HG3 PRO 91 2HG PRO 91 1.230 9.484 4.079 588 HD3 PRO 91 2HD PRO 91 2.535 11.010 5.467 589 H ALA 92 H ALA 92 3.095 12.216 0.308 590 HA ALA 92 HA ALA 92 1.624 14.516 -0.521 591 HB1 ALA 92 1HB ALA 92 3.631 13.721 -1.623 592 HB2 ALA 92 2HB ALA 92 2.894 12.139 -1.964 593 HB3 ALA 92 3HB ALA 92 2.318 13.597 -2.770 594 H THR 93 H THR 93 -0.027 12.408 0.868 595 HA THR 93 HA THR 93 -1.734 10.897 0.674 596 HB THR 93 HB THR 93 -3.737 12.029 -0.081 597 HG1 THR 93 1HG THR 93 -2.683 14.323 -1.049 598 HG21 THR 93 3HG2 THR 93 -3.576 14.150 1.138 599 HG22 THR 93 1HG2 THR 93 -1.810 14.115 1.090 600 HG23 THR 93 2HG2 THR 93 -2.714 12.873 2.004 601 HA PRO 94 HA PRO 94 -0.883 9.558 -3.790 602 HB3 PRO 94 2HB PRO 94 1.487 9.335 -3.512 603 HG3 PRO 94 2HG PRO 94 2.384 8.520 -1.441 604 HD3 PRO 94 2HD PRO 94 1.176 10.452 -1.032 605 H ILE 95 H ILE 95 -1.583 7.697 -0.950 606 HA ILE 95 HA ILE 95 -2.756 5.555 -2.625 607 HB ILE 95 HB ILE 95 -2.570 5.705 0.398 608 HG13 ILE 95 2HG1 ILE 95 -0.656 4.118 0.205 609 HG21 ILE 95 1HG2 ILE 95 -3.127 3.379 -1.495 610 HG22 ILE 95 2HG2 ILE 95 -2.774 3.228 0.242 611 HG23 ILE 95 3HG2 ILE 95 -4.195 4.085 -0.277 612 HD11 ILE 95 3HD1 ILE 95 -1.053 3.608 -2.359 613 HD12 ILE 95 1HD1 ILE 95 -0.133 5.122 -2.594 614 HD13 ILE 95 2HD1 ILE 95 0.588 3.749 -1.758 615 H LYS 96 H LYS 96 -3.701 8.591 -1.335 616 HA LYS 96 HA LYS 96 -6.161 8.038 -0.137 617 HB3 LYS 96 2HB LYS 96 -5.182 10.483 -1.666 618 HG3 LYS 96 2HG LYS 96 -7.617 10.563 -1.454 619 HD3 LYS 96 2HD LYS 96 -7.464 11.011 1.517 620 HE3 LYS 96 2HE LYS 96 -9.490 9.811 -0.415 621 HZ1 LYS 96 3HZ LYS 96 -9.519 9.103 2.087 622 HZ2 LYS 96 1HZ LYS 96 -10.850 9.377 1.229 623 HZ3 LYS 96 2HZ LYS 96 -10.362 10.541 2.244 624 H THR 97 H THR 97 -5.533 8.679 -3.632 625 HA THR 97 HA THR 97 -8.379 8.189 -4.160 626 HB THR 97 HB THR 97 -6.106 8.384 -6.157 627 HG1 THR 97 1HG THR 97 -5.892 10.176 -5.007 628 HG21 THR 97 3HG2 THR 97 -7.892 9.419 -7.583 629 HG22 THR 97 1HG2 THR 97 -9.082 9.087 -6.311 630 HG23 THR 97 2HG2 THR 97 -8.264 7.740 -7.131 631 H LEU 98 H LEU 98 -5.423 6.247 -4.279 632 HA LEU 98 HA LEU 98 -6.441 4.113 -5.940 633 HB3 LEU 98 2HB LEU 98 -4.394 3.999 -3.693 634 HG LEU 98 HG LEU 98 -5.394 1.770 -4.844 635 HD11 LEU 98 1HD1 LEU 98 -3.263 2.656 -6.826 636 HD12 LEU 98 2HD1 LEU 98 -5.007 2.480 -7.158 637 HD13 LEU 98 3HD1 LEU 98 -4.032 1.060 -6.752 638 HD21 LEU 98 3HD2 LEU 98 -3.156 0.722 -4.510 639 HD22 LEU 98 1HD2 LEU 98 -3.715 1.697 -3.155 640 HD23 LEU 98 2HD2 LEU 98 -2.475 2.333 -4.259 641 H LEU 99 H LEU 99 -6.387 4.617 -2.373 642 HA LEU 99 HA LEU 99 -7.213 2.068 -1.647 643 HB3 LEU 99 2HB LEU 99 -6.283 4.138 -0.351 644 HG LEU 99 HG LEU 99 -8.671 5.311 -0.555 645 HD11 LEU 99 1HD1 LEU 99 -9.389 3.001 0.743 646 HD12 LEU 99 2HD1 LEU 99 -10.311 4.525 0.845 647 HD13 LEU 99 3HD1 LEU 99 -9.158 4.058 2.123 648 HD21 LEU 99 3HD2 LEU 99 -7.008 5.141 1.951 649 HD22 LEU 99 1HD2 LEU 99 -8.225 6.408 1.593 650 HD23 LEU 99 2HD2 LEU 99 -6.771 6.226 0.595 651 H ASP 100 H ASP 100 -9.163 4.823 -2.628 652 HA ASP 100 HA ASP 100 -11.748 3.861 -1.944 653 HB3 ASP 100 2HB ASP 100 -10.909 5.746 -4.173 654 H GLN 101 H GLN 101 -9.789 3.521 -4.936 655 HA GLN 101 HA GLN 101 -11.667 1.908 -6.411 656 HB3 GLN 101 2HB GLN 101 -9.732 1.274 -7.780 657 HG3 GLN 101 2HG GLN 101 -9.751 4.248 -7.151 658 HE21 GLN 101 1HE2 GLN 101 -8.847 5.598 -8.935 659 HE22 GLN 101 2HE2 GLN 101 -7.638 4.849 -9.975 660 H MET 102 H MET 102 -9.992 1.106 -3.532 661 HA MET 102 HA MET 102 -10.012 -1.801 -4.213 662 HB3 MET 102 2HB MET 102 -8.280 -2.130 -2.684 663 HG3 MET 102 2HG MET 102 -7.531 0.461 -4.044 664 HE1 MET 102 3HE MET 102 -4.636 -3.021 -3.434 665 HE2 MET 102 1HE MET 102 -6.237 -3.097 -2.663 666 HE3 MET 102 2HE MET 102 -6.089 -2.985 -4.420 667 H LYS 103 H LYS 103 -12.053 0.314 -2.884 668 HA LYS 103 HA LYS 103 -12.765 -0.550 -0.296 669 HB3 LYS 103 2HB LYS 103 -15.174 0.034 -1.292 670 HG3 LYS 103 2HG LYS 103 -14.535 2.467 -1.875 671 HD3 LYS 103 2HD LYS 103 -13.927 1.307 0.886 672 HE3 LYS 103 2HE LYS 103 -14.649 4.091 -0.158 673 HZ1 LYS 103 3HZ LYS 103 -14.786 4.744 2.090 674 HZ2 LYS 103 1HZ LYS 103 -14.432 3.276 2.670 675 HZ3 LYS 103 2HZ LYS 103 -15.872 3.546 1.855 676 H ASN 104 H ASN 104 -12.968 -2.353 -3.197 677 HA ASN 104 HA ASN 104 -15.289 -3.931 -2.338 678 HB3 ASN 104 2HB ASN 104 -15.488 -4.585 -4.560 679 HD21 ASN 104 1HD2 ASN 104 -13.158 -2.575 -6.068 680 HD22 ASN 104 2HD2 ASN 104 -14.018 -1.054 -5.883 681 H TYR 105 H TYR 105 -12.072 -4.086 -1.678 682 HA TYR 105 HA TYR 105 -11.691 -7.008 -1.819 683 HB3 TYR 105 2HB TYR 105 -10.017 -4.663 -0.874 684 HD1 TYR 105 2HD TYR 105 -9.852 -8.415 -1.581 685 HD2 TYR 105 1HD TYR 105 -7.923 -4.921 0.106 686 HE1 TYR 105 2HE TYR 105 -8.133 -9.830 -0.545 687 HE2 TYR 105 1HE TYR 105 -6.143 -6.371 1.022 688 HH TYR 105 HH TYR 105 -5.448 -8.496 1.440 689 H ARG 106 H ARG 106 -10.848 -8.013 0.306 690 HA ARG 106 HA ARG 106 -11.517 -6.966 2.866 691 HB3 ARG 106 2HB ARG 106 -13.611 -7.636 2.319 692 HG3 ARG 106 2HG ARG 106 -13.332 -10.443 2.354 693 HD3 ARG 106 2HD ARG 106 -14.231 -8.697 0.012 694 HE ARG 106 HE ARG 106 -16.017 -10.775 0.851 695 HH11 ARG 106 1HH1 ARG 106 -12.841 -10.796 -0.763 696 HH12 ARG 106 2HH1 ARG 106 -13.354 -11.744 -2.085 697 HH21 ARG 106 1HH2 ARG 106 -16.603 -12.259 -0.737 698 HH22 ARG 106 2HH2 ARG 106 -15.520 -12.713 -2.027 699 H GLY 107 H GLY 107 -9.708 -7.814 4.160 700 HA2 GLY 107 1HA GLY 107 -8.579 -10.229 4.176 701 HA3 GLY 107 2HA GLY 107 -7.906 -9.587 2.678 702 H GLU 108 H GLU 108 -5.806 -9.592 3.539 703 HA GLU 108 HA GLU 108 -5.215 -7.777 5.801 704 HB3 GLU 108 2HB GLU 108 -2.840 -8.608 5.350 705 HG3 GLU 108 2HG GLU 108 -4.874 -10.782 5.936 706 H VAL 109 H VAL 109 -4.491 -5.785 5.527 707 HA VAL 109 HA VAL 109 -3.457 -4.832 2.927 708 HB VAL 109 HB VAL 109 -5.409 -3.360 4.795 709 HG11 VAL 109 1HG1 VAL 109 -5.337 -1.534 3.361 710 HG12 VAL 109 2HG1 VAL 109 -3.652 -2.078 3.328 711 HG13 VAL 109 3HG1 VAL 109 -4.723 -2.477 1.992 712 HG21 VAL 109 3HG2 VAL 109 -6.703 -5.073 3.611 713 HG22 VAL 109 1HG2 VAL 109 -7.068 -3.479 2.937 714 HG23 VAL 109 2HG2 VAL 109 -5.971 -4.556 2.072 715 H ALA 110 H ALA 110 -1.347 -4.382 3.484 716 HA ALA 110 HA ALA 110 -0.919 -3.058 6.132 717 HB1 ALA 110 1HB ALA 110 1.550 -4.082 5.581 718 HB2 ALA 110 2HB ALA 110 0.388 -4.796 6.696 719 HB3 ALA 110 3HB ALA 110 0.517 -5.417 5.028 720 H SER 111 H SER 111 0.679 -1.416 6.075 721 HA SER 111 HA SER 111 1.484 -0.608 3.340 722 HB3 SER 111 2HB SER 111 1.087 1.801 4.208 723 HG SER 111 HG SER 111 -0.345 1.061 2.663 724 H PHE 112 H PHE 112 3.414 0.507 3.193 725 HA PHE 112 HA PHE 112 4.955 0.923 5.666 726 HB3 PHE 112 2HB PHE 112 5.599 -1.246 4.627 727 HD1 PHE 112 2HD PHE 112 4.642 -1.805 2.381 728 HD2 PHE 112 1HD PHE 112 8.081 0.763 2.834 729 HE1 PHE 112 2HE PHE 112 5.092 -1.966 -0.040 730 HE2 PHE 112 1HE PHE 112 8.493 0.606 0.379 731 HZ PHE 112 HZ PHE 112 6.996 -0.715 -1.054 732 H PHE 113 H PHE 113 6.977 2.228 5.048 733 HA PHE 113 HA PHE 113 6.546 4.102 2.829 734 HB3 PHE 113 2HB PHE 113 7.046 5.964 4.326 735 HD1 PHE 113 2HD PHE 113 4.718 3.861 6.374 736 HD2 PHE 113 1HD PHE 113 5.011 7.047 3.489 737 HE1 PHE 113 2HE PHE 113 2.407 4.618 6.927 738 HE2 PHE 113 1HE PHE 113 2.719 7.726 4.019 739 HZ PHE 113 HZ PHE 113 1.362 6.388 5.636 740 H THR 114 H THR 114 8.574 5.661 2.924 741 HA THR 114 HA THR 114 10.871 4.570 4.359 742 HB THR 114 HB THR 114 12.266 5.578 2.346 743 HG1 THR 114 1HG THR 114 10.554 6.171 1.069 744 HG21 THR 114 3HG2 THR 114 12.428 3.271 3.165 745 HG22 THR 114 1HG2 THR 114 12.545 3.363 1.396 746 HG23 THR 114 2HG2 THR 114 11.038 2.813 2.168 747 H SER 115 H SER 115 11.780 6.239 5.482 748 HA SER 115 HA SER 115 11.638 8.882 4.382 749 HB3 SER 115 2HB SER 115 10.975 8.772 7.305 750 HG SER 115 HG SER 115 10.046 10.702 6.797 751 H ALA 116 H ALA 116 12.853 10.260 6.065 752 HA ALA 116 HA ALA 116 15.521 9.148 6.582 753 HB1 ALA 116 1HB ALA 116 16.080 11.568 6.764 754 HB2 ALA 116 2HB ALA 116 15.267 11.204 5.241 755 HB3 ALA 116 3HB ALA 116 14.355 11.967 6.556 756 H GLY 117 H GLY 117 13.446 8.150 8.168 757 HA2 GLY 117 1HA GLY 117 13.376 7.433 10.331 758 HA3 GLY 117 2HA GLY 117 14.945 8.237 10.373 759 H THR 118 H THR 118 11.943 10.159 10.011 760 HA THR 118 HA THR 118 11.948 10.823 12.905 761 HB THR 118 HB THR 118 11.500 13.266 11.813 762 HG1 THR 118 1HG THR 118 13.721 12.364 10.319 763 HG21 THR 118 3HG2 THR 118 14.222 12.131 12.548 764 HG22 THR 118 1HG2 THR 118 13.000 12.764 13.679 765 HG23 THR 118 2HG2 THR 118 13.778 13.854 12.526 766 H ASN 119 H ASN 119 9.818 12.335 13.230 767 HA ASN 119 HA ASN 119 7.639 12.729 13.105 768 HB3 ASN 119 2HB ASN 119 6.666 13.079 10.794 769 HD21 ASN 119 1HD2 ASN 119 8.678 14.696 9.243 770 HD22 ASN 119 2HD2 ASN 119 8.758 16.156 10.178 771 H HIS 120 H HIS 120 8.446 9.829 13.075 772 HA HIS 120 HA HIS 120 7.077 8.201 11.426 773 HB3 HIS 120 2HB HIS 120 8.751 7.289 12.712 774 HD1 HIS 120 1HD HIS 120 10.382 8.124 14.676 775 HD2 HIS 120 2HD HIS 120 6.330 7.751 15.769 776 HE1 HIS 120 1HE HIS 120 10.216 8.819 17.079 777 H LYS 121 H LYS 121 5.834 9.591 14.389 778 HA LYS 121 HA LYS 121 3.451 7.938 14.470 779 HB3 LYS 121 2HB LYS 121 3.264 10.583 15.861 780 HG3 LYS 121 2HG LYS 121 3.824 8.879 17.895 781 HD3 LYS 121 2HD LYS 121 1.355 8.066 17.746 782 HE3 LYS 121 2HE LYS 121 1.797 11.054 17.742 783 HZ1 LYS 121 3HZ LYS 121 -0.046 9.557 19.469 784 HZ2 LYS 121 1HZ LYS 121 -0.470 9.960 17.936 785 HZ3 LYS 121 2HZ LYS 121 -0.101 11.147 18.978 786 H ALA 122 H ALA 122 4.241 10.783 12.641 787 HA ALA 122 HA ALA 122 1.483 11.624 12.431 788 HB1 ALA 122 1HB ALA 122 3.230 13.337 12.109 789 HB2 ALA 122 2HB ALA 122 4.046 12.325 10.881 790 HB3 ALA 122 3HB ALA 122 2.477 13.031 10.564 791 H TYR 123 H TYR 123 3.652 9.268 10.637 792 HA TYR 123 HA TYR 123 2.405 9.329 8.161 793 HB3 TYR 123 2HB TYR 123 3.822 7.530 7.640 794 HD1 TYR 123 1HD TYR 123 4.437 10.616 9.234 795 HD2 TYR 123 2HD TYR 123 6.440 6.926 8.107 796 HE1 TYR 123 1HE TYR 123 6.392 11.793 9.034 797 HE2 TYR 123 2HE TYR 123 8.557 8.108 8.285 798 HH TYR 123 HH TYR 123 9.289 10.496 9.316 799 H VAL 124 H VAL 124 1.349 8.227 10.924 800 HA VAL 124 HA VAL 124 -0.179 5.756 10.281 801 HB VAL 124 HB VAL 124 0.561 6.978 12.943 802 HG11 VAL 124 1HG1 VAL 124 -0.895 5.021 13.011 803 HG12 VAL 124 2HG1 VAL 124 0.338 4.009 12.196 804 HG13 VAL 124 3HG1 VAL 124 0.612 4.643 13.805 805 HG21 VAL 124 3HG2 VAL 124 2.690 5.722 11.154 806 HG22 VAL 124 1HG2 VAL 124 2.633 7.287 11.700 807 HG23 VAL 124 2HG2 VAL 124 2.817 6.157 12.973 808 H SER 125 H SER 125 -0.406 8.819 12.105 809 HA SER 125 HA SER 125 -3.246 8.641 12.643 810 HB3 SER 125 2HB SER 125 -1.086 10.763 12.728 811 HG SER 125 HG SER 125 -2.491 12.199 12.909 812 H HIS 126 H HIS 126 -1.160 10.279 10.106 813 HA HIS 126 HA HIS 126 -3.300 11.521 8.688 814 HB3 HIS 126 2HB HIS 126 -0.673 10.557 7.504 815 HD1 HIS 126 1HD HIS 126 -1.395 11.297 4.958 816 HD2 HIS 126 2HD HIS 126 -2.095 14.083 8.047 817 HE1 HIS 126 1HE HIS 126 -1.838 13.571 3.844 818 H PHE 127 H PHE 127 -1.565 8.373 8.134 819 HA PHE 127 HA PHE 127 -3.216 7.633 5.954 820 HB3 PHE 127 2HB PHE 127 -1.862 5.701 7.855 821 HD1 PHE 127 1HD PHE 127 -2.041 6.283 4.126 822 HD2 PHE 127 2HD PHE 127 -2.957 3.646 7.411 823 HE1 PHE 127 1HE PHE 127 -2.769 4.521 2.526 824 HE2 PHE 127 2HE PHE 127 -3.646 1.890 5.804 825 HZ PHE 127 HZ PHE 127 -3.554 2.334 3.368 826 H ASN 128 H ASN 128 -3.780 7.209 9.446 827 HA ASN 128 HA ASN 128 -6.035 5.461 9.255 828 HB3 ASN 128 2HB ASN 128 -6.785 6.994 11.353 829 HD21 ASN 128 1HD2 ASN 128 -3.552 5.493 11.524 830 HD22 ASN 128 2HD2 ASN 128 -4.158 4.073 12.408 831 H GLU 129 H GLU 129 -5.979 9.060 9.376 832 HA GLU 129 HA GLU 129 -8.730 9.466 8.868 833 HB3 GLU 129 2HB GLU 129 -7.653 11.600 7.578 834 HG3 GLU 129 2HG GLU 129 -6.943 11.608 10.485 835 H TRP 130 H TRP 130 -6.056 9.307 6.548 836 HA TRP 130 HA TRP 130 -7.945 9.304 4.307 837 HB3 TRP 130 2HB TRP 130 -5.982 9.731 2.962 838 HD1 TRP 130 HD TRP 130 -3.844 11.204 5.275 839 HE1 TRP 130 1HE TRP 130 -4.283 13.651 5.814 840 HE3 TRP 130 3HE TRP 130 -8.753 11.384 3.905 841 HZ2 TRP 130 2HZ TRP 130 -6.581 15.372 5.923 842 HZ3 TRP 130 3HZ TRP 130 -10.083 13.405 4.394 843 HH2 TRP 130 HH TRP 130 -9.014 15.418 5.363 844 H ALA 131 H ALA 131 -7.736 6.858 6.053 845 HA ALA 131 HA ALA 131 -8.031 5.031 3.815 846 HB1 ALA 131 1HB ALA 131 -5.546 4.888 4.434 847 HB2 ALA 131 2HB ALA 131 -6.076 4.215 5.992 848 HB3 ALA 131 3HB ALA 131 -6.448 3.365 4.484 849 H ASP 132 H ASP 132 -9.147 6.205 6.659 850 HA ASP 132 HA ASP 132 -9.782 4.098 8.237 851 HB3 ASP 132 2HB ASP 132 -11.870 6.206 8.207 852 H GLY 133 H GLY 133 -10.557 2.324 7.346 853 HA2 GLY 133 1HA GLY 133 -13.189 1.882 6.383 854 HA3 GLY 133 2HA GLY 133 -12.153 2.231 4.998 855 H LEU 134 H LEU 134 -9.868 0.911 5.213 856 HA LEU 134 HA LEU 134 -10.823 -1.912 5.138 857 HB3 LEU 134 2HB LEU 134 -8.351 -2.289 4.424 858 HG LEU 134 HG LEU 134 -8.653 -1.550 2.139 859 HD11 LEU 134 1HD1 LEU 134 -9.592 -3.723 2.660 860 HD12 LEU 134 2HD1 LEU 134 -10.679 -2.869 1.529 861 HD13 LEU 134 3HD1 LEU 134 -11.093 -2.986 3.242 862 HD21 LEU 134 3HD2 LEU 134 -9.907 0.546 2.541 863 HD22 LEU 134 1HD2 LEU 134 -11.358 -0.425 2.907 864 HD23 LEU 134 2HD2 LEU 134 -10.630 -0.513 1.304 865 H ASN 135 H ASN 135 -9.766 -3.588 6.258 866 HA ASN 135 HA ASN 135 -8.852 -3.029 8.971 867 HB3 ASN 135 2HB ASN 135 -9.155 -5.470 7.220 868 HD21 ASN 135 1HD2 ASN 135 -7.430 -6.762 7.413 869 HD22 ASN 135 2HD2 ASN 135 -6.728 -7.221 8.984 870 H VAL 136 H VAL 136 -6.900 -1.930 9.093 871 HA VAL 136 HA VAL 136 -4.719 -2.661 7.272 872 HB VAL 136 HB VAL 136 -4.946 -0.522 9.418 873 HG11 VAL 136 1HG1 VAL 136 -2.660 -1.196 7.505 874 HG12 VAL 136 2HG1 VAL 136 -2.838 0.359 8.343 875 HG13 VAL 136 3HG1 VAL 136 -2.606 -1.117 9.282 876 HG21 VAL 136 3HG2 VAL 136 -4.846 -0.363 6.372 877 HG22 VAL 136 1HG2 VAL 136 -6.298 -0.092 7.368 878 HG23 VAL 136 2HG2 VAL 136 -4.937 1.020 7.496 879 H ILE 137 H ILE 137 -3.064 -4.014 7.814 880 HA ILE 137 HA ILE 137 -3.053 -5.143 10.538 881 HB ILE 137 HB ILE 137 -2.217 -7.144 9.564 882 HG13 ILE 137 2HG1 ILE 137 -1.716 -5.506 7.199 883 HG21 ILE 137 1HG2 ILE 137 -4.684 -6.224 8.051 884 HG22 ILE 137 2HG2 ILE 137 -4.259 -7.871 8.573 885 HG23 ILE 137 3HG2 ILE 137 -4.665 -6.633 9.777 886 HD11 ILE 137 3HD1 ILE 137 -1.052 -8.409 7.758 887 HD12 ILE 137 1HD1 ILE 137 -0.338 -7.362 6.510 888 HD13 ILE 137 2HD1 ILE 137 -0.083 -6.989 8.229 889 H GLY 138 H GLY 138 -1.255 -2.875 8.861 890 HA2 GLY 138 1HA GLY 138 0.444 -2.738 11.018 891 HA3 GLY 138 2HA GLY 138 1.389 -3.537 9.750 892 H VAL 139 H VAL 139 1.614 -0.836 11.001 893 HA VAL 139 HA VAL 139 1.863 0.642 8.456 894 HB VAL 139 HB VAL 139 0.788 1.894 11.010 895 HG11 VAL 139 1HG1 VAL 139 2.073 3.195 8.856 896 HG12 VAL 139 2HG1 VAL 139 0.351 3.517 8.627 897 HG13 VAL 139 3HG1 VAL 139 1.162 3.920 10.147 898 HG21 VAL 139 3HG2 VAL 139 -0.637 1.170 8.432 899 HG22 VAL 139 1HG2 VAL 139 -0.903 0.472 10.047 900 HG23 VAL 139 2HG2 VAL 139 -1.342 2.144 9.747 901 H ALA 140 H ALA 140 4.019 -0.056 8.464 902 HA ALA 140 HA ALA 140 5.752 1.184 10.583 903 HB1 ALA 140 1HB ALA 140 6.680 -1.178 8.941 904 HB2 ALA 140 2HB ALA 140 7.254 -0.584 10.469 905 HB3 ALA 140 3HB ALA 140 5.675 -1.383 10.404 906 H ARG 141 H ARG 141 8.198 1.111 9.482 907 HA ARG 141 HA ARG 141 8.039 2.344 6.795 908 HB3 ARG 141 2HB ARG 141 8.719 4.143 8.403 909 HG3 ARG 141 2HG ARG 141 11.377 3.416 8.871 910 HD3 ARG 141 2HD ARG 141 9.527 3.337 11.225 911 HE ARG 141 HE ARG 141 12.203 3.999 10.625 912 HH11 ARG 141 1HH1 ARG 141 9.780 4.676 13.131 913 HH12 ARG 141 2HH1 ARG 141 10.874 5.545 14.126 914 HH21 ARG 141 1HH2 ARG 141 13.581 5.226 11.801 915 HH22 ARG 141 2HH2 ARG 141 13.166 5.804 13.398 916 H ASP 142 H ASP 142 10.051 1.984 5.626 917 HA ASP 142 HA ASP 142 11.668 0.764 4.759 918 HB3 ASP 142 2HB ASP 142 13.495 0.046 6.245 919 H ASP 143 H ASP 143 12.853 -1.746 5.562 920 HA ASP 143 HA ASP 143 10.659 -3.598 4.899 921 HB3 ASP 143 2HB ASP 143 12.333 -3.486 3.217 922 H SER 144 H SER 144 11.342 -2.716 7.748 923 HA SER 144 HA SER 144 12.674 -5.088 8.796 924 HB3 SER 144 2HB SER 144 11.546 -3.332 10.838 925 HG SER 144 HG SER 144 13.849 -3.280 11.303 926 H GLU 145 H GLU 145 9.338 -4.525 8.040 927 HA GLU 145 HA GLU 145 8.567 -6.579 10.052 928 HB3 GLU 145 2HB GLU 145 6.479 -5.566 10.343 929 HG3 GLU 145 2HG GLU 145 8.490 -3.272 10.388 930 H VAL 146 H VAL 146 9.331 -6.706 6.943 931 HA VAL 146 HA VAL 146 7.029 -7.570 5.582 932 HB VAL 146 HB VAL 146 9.838 -8.686 5.233 933 HG11 VAL 146 1HG1 VAL 146 9.191 -8.965 2.869 934 HG12 VAL 146 2HG1 VAL 146 8.204 -9.943 3.951 935 HG13 VAL 146 3HG1 VAL 146 7.533 -8.447 3.270 936 HG21 VAL 146 3HG2 VAL 146 9.952 -6.214 5.162 937 HG22 VAL 146 1HG2 VAL 146 10.187 -6.906 3.564 938 HG23 VAL 146 2HG2 VAL 146 8.618 -6.175 3.997 939 H ASP 147 H ASP 147 9.094 -9.387 7.829 940 HA ASP 147 HA ASP 147 8.160 -12.025 7.492 941 HB3 ASP 147 2HB ASP 147 9.344 -10.377 9.715 942 H LYS 148 H LYS 148 6.534 -9.280 8.970 943 HA LYS 148 HA LYS 148 4.535 -11.170 10.152 944 HB3 LYS 148 2HB LYS 148 5.522 -9.592 11.726 945 HG3 LYS 148 2HG LYS 148 4.696 -7.577 9.708 946 HD3 LYS 148 2HD LYS 148 3.031 -6.892 11.288 947 HE3 LYS 148 2HE LYS 148 3.876 -5.863 13.434 948 HZ1 LYS 148 3HZ LYS 148 3.653 -7.947 14.658 949 HZ2 LYS 148 1HZ LYS 148 4.074 -8.823 13.345 950 HZ3 LYS 148 2HZ LYS 148 2.663 -8.037 13.334 951 H TRP 149 H TRP 149 5.002 -9.291 7.398 952 HA TRP 149 HA TRP 149 2.085 -9.069 6.903 953 HB3 TRP 149 2HB TRP 149 2.673 -7.494 5.189 954 HD1 TRP 149 HD TRP 149 2.090 -7.320 8.419 955 HE1 TRP 149 1HE TRP 149 2.663 -5.241 9.632 956 HE3 TRP 149 3HE TRP 149 5.335 -5.390 5.015 957 HZ2 TRP 149 2HZ TRP 149 4.277 -2.721 9.069 958 HZ3 TRP 149 3HZ TRP 149 6.267 -3.141 5.262 959 HH2 TRP 149 HH TRP 149 5.677 -1.742 7.221 960 H SER 150 H SER 150 4.121 -11.496 6.589 961 HA SER 150 HA SER 150 2.882 -12.390 4.128 962 HB3 SER 150 2HB SER 150 5.889 -12.681 4.044 963 HG SER 150 HG SER 150 3.887 -11.930 2.177 964 H LYS 151 H LYS 151 2.259 -13.286 6.567 965 HA LYS 151 HA LYS 151 4.013 -15.589 7.202 966 HB3 LYS 151 2HB LYS 151 3.490 -14.103 9.048 967 HG3 LYS 151 2HG LYS 151 0.921 -14.898 9.867 968 HD3 LYS 151 2HD LYS 151 1.667 -12.224 8.626 969 HE3 LYS 151 2HE LYS 151 0.016 -11.367 10.299 970 HZ1 LYS 151 3HZ LYS 151 -1.918 -12.026 9.017 971 HZ2 LYS 151 1HZ LYS 151 -1.223 -13.411 8.531 972 HZ3 LYS 151 2HZ LYS 151 -0.680 -11.974 7.996 Start of MODEL 16 1 H1 GLY 1 H GLY 1 -11.461 -21.673 -4.277 2 HA2 GLY 1 1HA GLY 1 -10.537 -23.076 -2.523 3 HA3 GLY 1 2HA GLY 1 -10.360 -24.365 -3.724 4 H MET 2 H MET 2 -9.357 -20.953 -3.211 5 HA MET 2 HA MET 2 -6.726 -21.423 -2.887 6 HB3 MET 2 2HB MET 2 -6.061 -22.025 -5.002 7 HG3 MET 2 2HG MET 2 -7.822 -19.895 -6.275 8 HE1 MET 2 3HE MET 2 -7.024 -21.296 -9.952 9 HE2 MET 2 1HE MET 2 -7.996 -22.223 -8.793 10 HE3 MET 2 2HE MET 2 -8.243 -20.465 -8.957 11 H ALA 3 H ALA 3 -6.977 -19.941 -1.329 12 HA ALA 3 HA ALA 3 -7.818 -17.170 -2.035 13 HB1 ALA 3 1HB ALA 3 -8.472 -18.853 0.421 14 HB2 ALA 3 2HB ALA 3 -8.980 -17.185 0.175 15 HB3 ALA 3 3HB ALA 3 -9.614 -18.446 -0.882 16 H LYS 4 H LYS 4 -5.269 -17.659 -2.293 17 HA LYS 4 HA LYS 4 -4.079 -16.094 -0.162 18 HB3 LYS 4 2HB LYS 4 -3.710 -18.335 0.678 19 HG3 LYS 4 2HG LYS 4 -1.987 -19.775 -0.060 20 HD3 LYS 4 2HD LYS 4 -4.210 -20.146 -1.277 21 HE3 LYS 4 2HE LYS 4 -4.012 -18.520 -3.159 22 HZ1 LYS 4 3HZ LYS 4 -1.798 -20.190 -4.169 23 HZ2 LYS 4 1HZ LYS 4 -1.662 -18.623 -3.612 24 HZ3 LYS 4 2HZ LYS 4 -2.567 -18.975 -4.924 25 H LYS 5 H LYS 5 -4.432 -14.676 -2.036 26 HA LYS 5 HA LYS 5 -1.982 -14.722 -3.769 27 HB3 LYS 5 2HB LYS 5 -3.443 -12.903 -5.013 28 HG3 LYS 5 2HG LYS 5 -4.759 -14.760 -6.106 29 HD3 LYS 5 2HD LYS 5 -1.887 -15.637 -6.101 30 HE3 LYS 5 2HE LYS 5 -3.912 -14.741 -8.183 31 HZ1 LYS 5 3HZ LYS 5 -2.349 -14.800 -9.795 32 HZ2 LYS 5 1HZ LYS 5 -1.226 -15.616 -8.924 33 HZ3 LYS 5 2HZ LYS 5 -1.538 -14.016 -8.609 34 H THR 6 H THR 6 -0.950 -12.812 -4.002 35 HA THR 6 HA THR 6 -1.549 -10.682 -2.029 36 HB THR 6 HB THR 6 1.026 -12.262 -2.025 37 HG1 THR 6 1HG THR 6 -0.479 -13.223 -0.682 38 HG21 THR 6 3HG2 THR 6 1.573 -9.917 -1.693 39 HG22 THR 6 1HG2 THR 6 1.746 -10.791 -0.170 40 HG23 THR 6 2HG2 THR 6 0.318 -9.759 -0.446 41 H LEU 7 H LEU 7 -1.224 -8.758 -2.819 42 HA LEU 7 HA LEU 7 0.465 -8.304 -5.277 43 HB3 LEU 7 2HB LEU 7 -2.003 -6.846 -4.306 44 HG LEU 7 HG LEU 7 -0.741 -5.409 -5.796 45 HD11 LEU 7 1HD1 LEU 7 -0.359 -6.073 -8.203 46 HD12 LEU 7 2HD1 LEU 7 -0.758 -7.741 -7.767 47 HD13 LEU 7 3HD1 LEU 7 0.678 -6.939 -7.073 48 HD21 LEU 7 3HD2 LEU 7 -3.118 -6.828 -7.100 49 HD22 LEU 7 1HD2 LEU 7 -2.494 -5.283 -7.658 50 HD23 LEU 7 2HD2 LEU 7 -3.180 -5.420 -6.021 51 H ILE 8 H ILE 8 1.755 -6.370 -5.292 52 HA ILE 8 HA ILE 8 1.973 -4.758 -2.815 53 HB ILE 8 HB ILE 8 4.085 -5.495 -4.894 54 HG13 ILE 8 2HG1 ILE 8 3.396 -6.961 -2.725 55 HG21 ILE 8 1HG2 ILE 8 4.249 -3.591 -2.522 56 HG22 ILE 8 2HG2 ILE 8 5.649 -4.169 -3.450 57 HG23 ILE 8 3HG2 ILE 8 4.411 -3.182 -4.248 58 HD11 ILE 8 3HD1 ILE 8 5.407 -8.183 -2.827 59 HD12 ILE 8 1HD1 ILE 8 5.185 -7.589 -4.465 60 HD13 ILE 8 2HD1 ILE 8 6.354 -6.785 -3.398 61 H LEU 9 H LEU 9 1.228 -2.713 -3.203 62 HA LEU 9 HA LEU 9 1.284 -1.595 -5.976 63 HB3 LEU 9 2HB LEU 9 -0.804 -0.410 -5.398 64 HG LEU 9 HG LEU 9 -1.144 -3.401 -4.932 65 HD11 LEU 9 1HD1 LEU 9 -3.027 -1.959 -4.184 66 HD12 LEU 9 2HD1 LEU 9 -3.445 -3.103 -5.464 67 HD13 LEU 9 3HD1 LEU 9 -3.210 -1.391 -5.863 68 HD21 LEU 9 3HD2 LEU 9 -1.003 -1.714 -7.457 69 HD22 LEU 9 1HD2 LEU 9 -1.917 -3.226 -7.423 70 HD23 LEU 9 2HD2 LEU 9 -0.196 -3.262 -7.063 71 H TYR 10 H TYR 10 3.226 -0.376 -5.608 72 HA TYR 10 HA TYR 10 2.998 1.658 -3.419 73 HB3 TYR 10 2HB TYR 10 4.918 0.448 -2.891 74 HD1 TYR 10 2HD TYR 10 5.582 1.396 -6.501 75 HD2 TYR 10 1HD TYR 10 6.236 -1.331 -3.200 76 HE1 TYR 10 2HE TYR 10 6.558 -0.221 -8.078 77 HE2 TYR 10 1HE TYR 10 7.160 -2.991 -4.827 78 HH TYR 10 HH TYR 10 6.928 -2.644 -8.303 79 H TYR 11 H TYR 11 4.004 3.697 -3.887 80 HA TYR 11 HA TYR 11 3.927 4.519 -6.743 81 HB3 TYR 11 2HB TYR 11 3.373 5.915 -4.117 82 HD1 TYR 11 1HD TYR 11 3.868 6.797 -7.745 83 HD2 TYR 11 2HD TYR 11 4.203 8.010 -3.650 84 HE1 TYR 11 1HE TYR 11 4.656 9.054 -8.484 85 HE2 TYR 11 2HE TYR 11 5.154 10.173 -4.356 86 HH TYR 11 HH TYR 11 4.878 11.687 -6.272 87 H SER 12 H SER 12 6.008 4.884 -7.529 88 HA SER 12 HA SER 12 8.233 4.895 -5.565 89 HB3 SER 12 2HB SER 12 8.556 3.405 -7.526 90 HG SER 12 HG SER 12 7.431 4.603 -9.149 91 H TRP 13 H TRP 13 8.977 6.896 -4.874 92 HA TRP 13 HA TRP 13 7.824 9.273 -5.726 93 HB3 TRP 13 2HB TRP 13 10.566 8.991 -4.440 94 HD1 TRP 13 HD TRP 13 7.359 11.174 -4.724 95 HE1 TRP 13 1HE TRP 13 7.852 13.523 -3.931 96 HE3 TRP 13 3HE TRP 13 12.229 10.559 -3.215 97 HZ2 TRP 13 2HZ TRP 13 10.056 15.019 -2.909 98 HZ3 TRP 13 3HZ TRP 13 13.507 12.497 -2.359 99 HH2 TRP 13 HH TRP 13 12.455 14.738 -2.219 100 H SER 14 H SER 14 11.373 9.000 -6.217 101 HA SER 14 HA SER 14 10.979 9.291 -9.146 102 HB3 SER 14 2HB SER 14 12.938 11.106 -7.774 103 HG SER 14 HG SER 14 12.752 10.853 -10.089 104 H GLY 15 H GLY 15 12.644 7.639 -6.714 105 HA2 GLY 15 1HA GLY 15 14.075 5.945 -8.243 106 HA3 GLY 15 2HA GLY 15 15.199 7.293 -8.081 107 H GLU 16 H GLU 16 12.890 6.382 -5.524 108 HA GLU 16 HA GLU 16 15.197 6.028 -3.659 109 HB3 GLU 16 2HB GLU 16 14.014 7.623 -2.168 110 HG3 GLU 16 2HG GLU 16 13.939 9.567 -4.228 111 H THR 17 H THR 17 11.540 6.151 -3.592 112 HA THR 17 HA THR 17 11.188 4.133 -1.748 113 HB THR 17 HB THR 17 9.203 4.485 -3.943 114 HG1 THR 17 1HG THR 17 9.939 6.478 -2.090 115 HG21 THR 17 3HG2 THR 17 8.580 3.129 -1.943 116 HG22 THR 17 1HG2 THR 17 7.556 4.543 -2.168 117 HG23 THR 17 2HG2 THR 17 8.823 4.580 -0.937 118 H LYS 18 H LYS 18 11.809 3.912 -5.165 119 HA LYS 18 HA LYS 18 11.204 1.273 -5.797 120 HB3 LYS 18 2HB LYS 18 13.155 3.318 -6.801 121 HG3 LYS 18 2HG LYS 18 12.918 0.434 -7.789 122 HD3 LYS 18 2HD LYS 18 12.926 2.328 -9.591 123 HE3 LYS 18 2HE LYS 18 15.825 2.260 -8.654 124 HZ1 LYS 18 3HZ LYS 18 15.434 2.129 -11.108 125 HZ2 LYS 18 1HZ LYS 18 16.431 3.302 -10.595 126 HZ3 LYS 18 2HZ LYS 18 14.867 3.672 -11.042 127 H LYS 19 H LYS 19 14.135 2.300 -3.906 128 HA LYS 19 HA LYS 19 15.430 -0.244 -3.997 129 HB3 LYS 19 2HB LYS 19 16.175 0.360 -1.620 130 HG3 LYS 19 2HG LYS 19 16.832 2.940 -2.745 131 HD3 LYS 19 2HD LYS 19 19.097 1.922 -2.974 132 HE3 LYS 19 2HE LYS 19 17.589 1.451 -0.399 133 HZ1 LYS 19 3HZ LYS 19 19.671 1.034 0.676 134 HZ2 LYS 19 1HZ LYS 19 20.505 1.064 -0.744 135 HZ3 LYS 19 2HZ LYS 19 19.438 -0.126 -0.439 136 H MET 20 H MET 20 12.687 0.872 -2.094 137 HA MET 20 HA MET 20 12.693 -1.352 -0.243 138 HB3 MET 20 2HB MET 20 10.462 0.662 -0.742 139 HG3 MET 20 2HG MET 20 9.939 -0.835 1.049 140 HE1 MET 20 3HE MET 20 13.734 0.456 1.386 141 HE2 MET 20 1HE MET 20 12.883 1.329 2.690 142 HE3 MET 20 2HE MET 20 14.059 0.055 3.081 143 H ALA 21 H ALA 21 11.511 -0.957 -3.508 144 HA ALA 21 HA ALA 21 9.215 -2.714 -3.257 145 HB1 ALA 21 1HB ALA 21 10.637 -1.246 -5.520 146 HB2 ALA 21 2HB ALA 21 9.320 -2.360 -5.749 147 HB3 ALA 21 3HB ALA 21 9.063 -0.859 -4.780 148 H GLU 22 H GLU 22 12.378 -2.640 -4.972 149 HA GLU 22 HA GLU 22 12.314 -5.276 -5.807 150 HB3 GLU 22 2HB GLU 22 14.730 -5.101 -6.167 151 HG3 GLU 22 2HG GLU 22 13.680 -2.259 -6.439 152 H LYS 23 H LYS 23 13.732 -4.042 -2.728 153 HA LYS 23 HA LYS 23 14.860 -6.524 -1.948 154 HB3 LYS 23 2HB LYS 23 13.801 -4.343 -0.087 155 HG3 LYS 23 2HG LYS 23 15.811 -6.613 0.263 156 HD3 LYS 23 2HD LYS 23 15.060 -4.506 2.286 157 HE3 LYS 23 2HE LYS 23 17.126 -6.766 2.363 158 HZ1 LYS 23 3HZ LYS 23 15.998 -5.210 4.596 159 HZ2 LYS 23 1HZ LYS 23 17.481 -4.884 3.913 160 HZ3 LYS 23 2HZ LYS 23 17.210 -6.317 4.659 161 H ILE 24 H ILE 24 11.695 -5.136 -1.006 162 HA ILE 24 HA ILE 24 10.945 -7.412 0.567 163 HB ILE 24 HB ILE 24 9.330 -5.098 -0.602 164 HG13 ILE 24 2HG1 ILE 24 11.148 -4.306 0.845 165 HG21 ILE 24 1HG2 ILE 24 8.586 -7.070 1.581 166 HG22 ILE 24 2HG2 ILE 24 7.657 -5.608 1.195 167 HG23 ILE 24 3HG2 ILE 24 7.813 -6.892 0.003 168 HD11 ILE 24 3HD1 ILE 24 10.030 -3.092 2.557 169 HD12 ILE 24 1HD1 ILE 24 8.925 -3.160 1.181 170 HD13 ILE 24 2HD1 ILE 24 8.668 -4.209 2.594 171 H ASN 25 H ASN 25 10.441 -6.682 -2.943 172 HA ASN 25 HA ASN 25 8.454 -8.733 -3.190 173 HB3 ASN 25 2HB ASN 25 10.388 -7.841 -5.343 174 HD21 ASN 25 1HD2 ASN 25 7.130 -9.342 -4.528 175 HD22 ASN 25 2HD2 ASN 25 6.902 -9.918 -6.129 176 H SER 26 H SER 26 11.896 -8.918 -2.838 177 HA SER 26 HA SER 26 12.062 -11.727 -3.674 178 HB3 SER 26 2HB SER 26 14.092 -10.003 -2.210 179 HG SER 26 HG SER 26 14.284 -12.412 -3.731 180 H GLU 27 H GLU 27 11.923 -9.832 -0.507 181 HA GLU 27 HA GLU 27 12.150 -12.314 0.918 182 HB3 GLU 27 2HB GLU 27 13.154 -10.711 2.117 183 HG3 GLU 27 2HG GLU 27 10.884 -8.771 2.058 184 H ILE 28 H ILE 28 9.299 -10.634 -0.295 185 HA ILE 28 HA ILE 28 7.479 -12.207 1.376 186 HB ILE 28 HB ILE 28 7.094 -10.431 -1.066 187 HG13 ILE 28 2HG1 ILE 28 7.618 -9.287 1.044 188 HG21 ILE 28 1HG2 ILE 28 4.675 -10.593 -0.799 189 HG22 ILE 28 2HG2 ILE 28 5.391 -12.130 -1.220 190 HG23 ILE 28 3HG2 ILE 28 4.876 -11.824 0.469 191 HD11 ILE 28 3HD1 ILE 28 5.796 -7.809 1.382 192 HD12 ILE 28 1HD1 ILE 28 5.797 -8.209 -0.353 193 HD13 ILE 28 2HD1 ILE 28 4.621 -8.965 0.758 194 H LYS 29 H LYS 29 6.074 -13.776 0.261 195 HA LYS 29 HA LYS 29 7.397 -15.881 -1.173 196 HB3 LYS 29 2HB LYS 29 4.481 -15.977 -1.506 197 HG3 LYS 29 2HG LYS 29 4.631 -17.736 0.249 198 HD3 LYS 29 2HD LYS 29 6.184 -19.335 -0.775 199 HE3 LYS 29 2HE LYS 29 4.607 -17.784 -2.851 200 HZ1 LYS 29 3HZ LYS 29 4.303 -19.841 -3.892 201 HZ2 LYS 29 1HZ LYS 29 5.026 -20.690 -2.676 202 HZ3 LYS 29 2HZ LYS 29 5.892 -19.648 -3.654 203 H ASP 30 H ASP 30 5.844 -16.679 -3.218 204 HA ASP 30 HA ASP 30 6.604 -15.210 -5.513 205 HB3 ASP 30 2HB ASP 30 5.219 -16.940 -6.723 206 H SER 31 H SER 31 5.271 -13.421 -4.128 207 HA SER 31 HA SER 31 2.504 -13.052 -4.955 208 HB3 SER 31 2HB SER 31 2.699 -11.240 -3.323 209 HG SER 31 HG SER 31 3.601 -12.557 -1.555 210 H GLU 32 H GLU 32 2.033 -10.551 -5.619 211 HA GLU 32 HA GLU 32 3.506 -10.276 -8.168 212 HB3 GLU 32 2HB GLU 32 1.298 -8.944 -8.611 213 HG3 GLU 32 2HG GLU 32 1.612 -11.930 -8.309 214 H LEU 33 H LEU 33 3.855 -8.172 -9.003 215 HA LEU 33 HA LEU 33 4.542 -6.157 -6.899 216 HB3 LEU 33 2HB LEU 33 6.388 -7.194 -9.076 217 HG LEU 33 HG LEU 33 6.762 -4.822 -8.275 218 HD11 LEU 33 1HD1 LEU 33 6.216 -4.751 -6.007 219 HD12 LEU 33 2HD1 LEU 33 7.986 -4.746 -5.952 220 HD13 LEU 33 3HD1 LEU 33 7.076 -6.240 -5.632 221 HD21 LEU 33 3HD2 LEU 33 9.047 -6.686 -7.610 222 HD22 LEU 33 1HD2 LEU 33 9.133 -4.982 -8.062 223 HD23 LEU 33 2HD2 LEU 33 8.573 -6.182 -9.242 224 H LYS 34 H LYS 34 2.991 -4.567 -7.517 225 HA LYS 34 HA LYS 34 3.313 -3.537 -10.290 226 HB3 LYS 34 2HB LYS 34 0.889 -2.559 -9.099 227 HG3 LYS 34 2HG LYS 34 -0.136 -4.273 -10.760 228 HD3 LYS 34 2HD LYS 34 1.655 -2.085 -11.911 229 HE3 LYS 34 2HE LYS 34 -0.838 -3.547 -12.830 230 HZ1 LYS 34 3HZ LYS 34 0.201 -0.935 -13.805 231 HZ2 LYS 34 1HZ LYS 34 -1.321 -1.304 -13.320 232 HZ3 LYS 34 2HZ LYS 34 -0.773 -1.895 -14.714 233 H GLU 35 H GLU 35 2.569 -1.338 -10.373 234 HA GLU 35 HA GLU 35 3.796 0.411 -8.324 235 HB3 GLU 35 2HB GLU 35 5.550 -0.108 -10.012 236 HG3 GLU 35 2HG GLU 35 3.654 1.166 -12.019 237 H VAL 36 H VAL 36 2.953 2.515 -8.364 238 HA VAL 36 HA VAL 36 0.792 3.192 -10.277 239 HB VAL 36 HB VAL 36 0.857 3.808 -7.283 240 HG11 VAL 36 1HG1 VAL 36 -1.612 4.219 -7.655 241 HG12 VAL 36 2HG1 VAL 36 -0.555 5.378 -8.456 242 HG13 VAL 36 3HG1 VAL 36 -1.315 4.075 -9.396 243 HG21 VAL 36 3HG2 VAL 36 0.603 1.418 -7.369 244 HG22 VAL 36 1HG2 VAL 36 -1.005 2.074 -7.105 245 HG23 VAL 36 2HG2 VAL 36 -0.540 1.511 -8.727 246 H LYS 37 H LYS 37 0.553 5.679 -10.445 247 HA LYS 37 HA LYS 37 2.856 7.200 -9.449 248 HB3 LYS 37 2HB LYS 37 3.545 6.394 -11.638 249 HG3 LYS 37 2HG LYS 37 1.665 8.374 -12.908 250 HD3 LYS 37 2HD LYS 37 2.785 5.752 -13.956 251 HE3 LYS 37 2HE LYS 37 1.584 8.247 -15.189 252 HZ1 LYS 37 3HZ LYS 37 3.490 7.850 -16.518 253 HZ2 LYS 37 1HZ LYS 37 2.168 7.328 -17.311 254 HZ3 LYS 37 2HZ LYS 37 3.180 6.219 -16.656 255 H VAL 38 H VAL 38 2.406 9.671 -10.019 256 HA VAL 38 HA VAL 38 -0.491 10.218 -9.838 257 HB VAL 38 HB VAL 38 -0.143 12.091 -8.378 258 HG11 VAL 38 1HG1 VAL 38 0.015 10.920 -6.331 259 HG12 VAL 38 2HG1 VAL 38 -0.663 9.797 -7.494 260 HG13 VAL 38 3HG1 VAL 38 1.055 9.657 -7.021 261 HG21 VAL 38 3HG2 VAL 38 2.256 12.657 -8.873 262 HG22 VAL 38 1HG2 VAL 38 1.877 12.636 -7.173 263 HG23 VAL 38 2HG2 VAL 38 2.747 11.261 -7.909 264 H SER 39 H SER 39 -0.742 12.767 -10.385 265 HA SER 39 HA SER 39 0.304 13.150 -13.047 266 HB3 SER 39 2HB SER 39 -1.197 15.297 -12.173 267 HG SER 39 HG SER 39 -3.002 14.073 -13.087 268 H GLU 40 H GLU 40 0.880 15.603 -13.303 269 HA GLU 40 HA GLU 40 3.349 15.757 -11.610 270 HB3 GLU 40 2HB GLU 40 3.758 15.276 -13.938 271 HG3 GLU 40 2HG GLU 40 2.633 18.059 -14.475 272 H GLY 41 H GLY 41 4.056 17.603 -10.657 273 HA2 GLY 41 1HA GLY 41 4.093 19.898 -10.142 274 HA3 GLY 41 2HA GLY 41 2.593 20.154 -11.026 275 H THR 42 H THR 42 2.046 17.374 -9.270 276 HA THR 42 HA THR 42 0.096 18.469 -7.663 277 HB THR 42 HB THR 42 1.700 15.920 -7.159 278 HG1 THR 42 1HG THR 42 0.938 15.501 -9.137 279 HG21 THR 42 3HG2 THR 42 -0.011 16.693 -5.404 280 HG22 THR 42 1HG2 THR 42 -0.241 15.084 -6.109 281 HG23 THR 42 2HG2 THR 42 -1.240 16.483 -6.645 282 H PHE 43 H PHE 43 3.478 17.640 -6.691 283 HA PHE 43 HA PHE 43 3.149 19.569 -4.417 284 HB3 PHE 43 2HB PHE 43 4.581 18.075 -3.047 285 HD1 PHE 43 1HD PHE 43 2.249 18.802 -2.109 286 HD2 PHE 43 2HD PHE 43 2.829 15.297 -4.548 287 HE1 PHE 43 1HE PHE 43 0.093 17.885 -1.295 288 HE2 PHE 43 2HE PHE 43 0.612 14.468 -3.835 289 HZ PHE 43 HZ PHE 43 -0.745 15.729 -2.175 290 H ASP 44 H ASP 44 5.394 20.129 -3.469 291 HA ASP 44 HA ASP 44 7.229 20.809 -5.730 292 HB3 ASP 44 2HB ASP 44 7.158 22.370 -3.139 293 H ALA 45 H ALA 45 9.487 21.149 -4.718 294 HA ALA 45 HA ALA 45 10.113 19.063 -2.677 295 HB1 ALA 45 1HB ALA 45 11.110 18.469 -4.790 296 HB2 ALA 45 2HB ALA 45 11.775 20.104 -5.005 297 HB3 ALA 45 3HB ALA 45 12.391 19.045 -3.713 298 H ASP 46 H ASP 46 9.177 21.172 -1.471 299 HA ASP 46 HA ASP 46 11.437 23.009 -0.871 300 HB3 ASP 46 2HB ASP 46 8.484 23.383 -0.347 301 H MET 47 H MET 47 10.310 23.774 1.664 302 HA MET 47 HA MET 47 10.239 21.277 3.276 303 HB3 MET 47 2HB MET 47 12.526 22.296 3.376 304 HG3 MET 47 2HG MET 47 11.104 24.540 4.842 305 HE1 MET 47 3HE MET 47 14.559 23.538 3.097 306 HE2 MET 47 1HE MET 47 14.051 25.136 2.491 307 HE3 MET 47 2HE MET 47 15.483 24.989 3.536 308 H TYR 48 H TYR 48 9.213 24.667 2.762 309 HA TYR 48 HA TYR 48 7.306 24.454 5.021 310 HB3 TYR 48 2HB TYR 48 8.751 26.214 5.484 311 HD1 TYR 48 2HD TYR 48 7.351 27.834 2.387 312 HD2 TYR 48 1HD TYR 48 10.878 26.673 4.595 313 HE1 TYR 48 2HE TYR 48 8.774 28.933 0.696 314 HE2 TYR 48 1HE TYR 48 12.311 27.736 2.866 315 HH TYR 48 HH TYR 48 11.302 28.685 -0.119 316 H LYS 49 H LYS 49 7.711 25.346 1.546 317 HA LYS 49 HA LYS 49 4.983 26.051 1.105 318 HB3 LYS 49 2HB LYS 49 6.688 24.566 -0.936 319 HG3 LYS 49 2HG LYS 49 4.285 25.341 -1.432 320 HD3 LYS 49 2HD LYS 49 5.648 28.017 -1.922 321 HE3 LYS 49 2HE LYS 49 2.745 27.076 -1.782 322 HZ1 LYS 49 3HZ LYS 49 3.720 29.773 -2.479 323 HZ2 LYS 49 1HZ LYS 49 3.066 29.369 -1.030 324 HZ3 LYS 49 2HZ LYS 49 2.158 29.261 -2.387 325 H THR 50 H THR 50 6.693 22.912 1.083 326 HA THR 50 HA THR 50 4.437 21.381 0.232 327 HB THR 50 HB THR 50 6.039 19.507 0.801 328 HG1 THR 50 1HG THR 50 8.008 20.036 1.609 329 HG21 THR 50 3HG2 THR 50 7.066 21.766 -0.931 330 HG22 THR 50 1HG2 THR 50 6.041 20.397 -1.401 331 HG23 THR 50 2HG2 THR 50 7.717 20.118 -0.872 332 H SER 51 H SER 51 5.114 22.769 3.314 333 HA SER 51 HA SER 51 3.686 20.697 4.827 334 HB3 SER 51 2HB SER 51 3.924 23.532 5.817 335 HG SER 51 HG SER 51 4.691 21.049 6.960 336 H ASP 52 H ASP 52 3.139 23.940 3.445 337 HA ASP 52 HA ASP 52 0.422 24.259 4.159 338 HB3 ASP 52 2HB ASP 52 2.000 25.456 1.871 339 H ILE 53 H ILE 53 1.843 23.223 1.007 340 HA ILE 53 HA ILE 53 -0.564 22.882 -0.387 341 HB ILE 53 HB ILE 53 1.866 21.063 -0.650 342 HG13 ILE 53 2HG1 ILE 53 2.248 23.640 -1.026 343 HG21 ILE 53 1HG2 ILE 53 1.001 20.718 -3.001 344 HG22 ILE 53 2HG2 ILE 53 -0.135 20.147 -1.790 345 HG23 ILE 53 3HG2 ILE 53 -0.412 21.698 -2.584 346 HD11 ILE 53 3HD1 ILE 53 2.919 21.813 -3.373 347 HD12 ILE 53 1HD1 ILE 53 3.787 23.256 -2.831 348 HD13 ILE 53 2HD1 ILE 53 3.805 21.793 -1.837 349 H ALA 54 H ALA 54 1.132 20.335 1.555 350 HA ALA 54 HA ALA 54 -1.012 18.476 1.076 351 HB1 ALA 54 1HB ALA 54 1.248 17.682 1.618 352 HB2 ALA 54 2HB ALA 54 1.122 18.391 3.243 353 HB3 ALA 54 3HB ALA 54 0.048 17.043 2.754 354 H LEU 55 H LEU 55 -0.475 20.906 3.649 355 HA LEU 55 HA LEU 55 -2.497 19.963 5.438 356 HB3 LEU 55 2HB LEU 55 -1.434 22.763 4.927 357 HG LEU 55 HG LEU 55 -1.811 22.983 7.441 358 HD11 LEU 55 1HD1 LEU 55 -3.926 24.069 7.148 359 HD12 LEU 55 2HD1 LEU 55 -4.161 23.242 5.590 360 HD13 LEU 55 3HD1 LEU 55 -2.826 24.395 5.798 361 HD21 LEU 55 3HD2 LEU 55 -3.988 20.932 6.981 362 HD22 LEU 55 1HD2 LEU 55 -3.743 21.917 8.430 363 HD23 LEU 55 2HD2 LEU 55 -2.539 20.704 7.964 364 H ASP 56 H ASP 56 -2.591 22.287 2.712 365 HA ASP 56 HA ASP 56 -5.328 23.019 2.816 366 HB3 ASP 56 2HB ASP 56 -3.190 22.882 0.675 367 H GLN 57 H GLN 57 -3.769 20.422 0.871 368 HA GLN 57 HA GLN 57 -6.270 19.347 -0.017 369 HB3 GLN 57 2HB GLN 57 -4.926 17.530 -0.951 370 HG3 GLN 57 2HG GLN 57 -3.458 20.171 -1.258 371 HE21 GLN 57 1HE2 GLN 57 -4.979 18.314 -3.833 372 HE22 GLN 57 2HE2 GLN 57 -3.484 17.842 -4.584 373 H ILE 58 H ILE 58 -4.542 18.772 2.950 374 HA ILE 58 HA ILE 58 -5.927 16.324 3.661 375 HB ILE 58 HB ILE 58 -4.349 18.417 5.132 376 HG13 ILE 58 2HG1 ILE 58 -3.318 16.445 3.826 377 HG21 ILE 58 1HG2 ILE 58 -5.805 16.231 6.644 378 HG22 ILE 58 2HG2 ILE 58 -4.588 17.337 7.301 379 HG23 ILE 58 3HG2 ILE 58 -6.107 17.975 6.737 380 HD11 ILE 58 3HD1 ILE 58 -2.132 17.822 5.633 381 HD12 ILE 58 1HD1 ILE 58 -2.611 16.552 6.775 382 HD13 ILE 58 2HD1 ILE 58 -1.535 16.169 5.422 383 H GLN 59 H GLN 59 -6.412 19.785 4.491 384 HA GLN 59 HA GLN 59 -8.568 19.221 6.199 385 HB3 GLN 59 2HB GLN 59 -8.939 21.786 5.970 386 HG3 GLN 59 2HG GLN 59 -6.135 20.789 6.647 387 HE21 GLN 59 1HE2 GLN 59 -6.628 23.341 5.476 388 HE22 GLN 59 2HE2 GLN 59 -6.394 24.578 6.672 389 H GLY 60 H GLY 60 -8.727 19.259 2.783 390 HA2 GLY 60 1HA GLY 60 -10.628 18.913 1.433 391 HA3 GLY 60 2HA GLY 60 -11.675 19.252 2.820 392 H ASN 61 H ASN 61 -9.345 21.612 2.763 393 HA ASN 61 HA ASN 61 -10.888 23.804 1.823 394 HB3 ASN 61 2HB ASN 61 -8.618 24.890 1.580 395 HD21 ASN 61 1HD2 ASN 61 -7.198 25.488 3.385 396 HD22 ASN 61 2HD2 ASN 61 -7.730 25.377 5.037 397 H LYS 62 H LYS 62 -8.731 21.466 0.234 398 HA LYS 62 HA LYS 62 -9.509 22.503 -2.420 399 HB3 LYS 62 2HB LYS 62 -6.881 21.433 -2.700 400 HG3 LYS 62 2HG LYS 62 -6.028 23.607 -2.817 401 HD3 LYS 62 2HD LYS 62 -8.875 24.262 -3.515 402 HE3 LYS 62 2HE LYS 62 -6.128 24.825 -4.649 403 HZ1 LYS 62 3HZ LYS 62 -7.320 25.708 -6.575 404 HZ2 LYS 62 1HZ LYS 62 -8.718 25.008 -6.053 405 HZ3 LYS 62 2HZ LYS 62 -7.412 24.070 -6.463 406 H ASP 63 H ASP 63 -8.961 21.013 -4.146 407 HA ASP 63 HA ASP 63 -10.018 18.354 -3.699 408 HB3 ASP 63 2HB ASP 63 -10.491 19.709 -5.747 409 H PHE 64 H PHE 64 -8.693 16.493 -4.829 410 HA PHE 64 HA PHE 64 -6.104 16.465 -3.375 411 HB3 PHE 64 2HB PHE 64 -7.630 15.440 -1.948 412 HD1 PHE 64 2HD PHE 64 -7.945 12.593 -4.312 413 HD2 PHE 64 1HD PHE 64 -10.001 15.785 -2.248 414 HE1 PHE 64 2HE PHE 64 -10.122 11.460 -4.690 415 HE2 PHE 64 1HE PHE 64 -12.172 14.674 -2.688 416 HZ PHE 64 HZ PHE 64 -12.235 12.496 -3.897 417 HA PRO 65 HA PRO 65 -4.214 15.004 -6.929 418 HB3 PRO 65 2HB PRO 65 -2.301 14.665 -5.850 419 HG3 PRO 65 2HG PRO 65 -2.217 13.775 -3.619 420 HD3 PRO 65 2HD PRO 65 -3.684 15.633 -3.668 421 H GLU 66 H GLU 66 -3.988 13.284 -8.439 422 HA GLU 66 HA GLU 66 -6.014 11.128 -8.237 423 HB3 GLU 66 2HB GLU 66 -6.435 12.799 -9.997 424 HG3 GLU 66 2HG GLU 66 -3.844 11.753 -11.232 425 H ILE 67 H ILE 67 -5.339 9.050 -9.307 426 HA ILE 67 HA ILE 67 -2.385 8.701 -9.447 427 HB ILE 67 HB ILE 67 -2.809 6.289 -9.471 428 HG13 ILE 67 2HG1 ILE 67 -5.105 6.303 -10.393 429 HG21 ILE 67 1HG2 ILE 67 -3.931 7.701 -7.005 430 HG22 ILE 67 2HG2 ILE 67 -3.204 6.076 -7.063 431 HG23 ILE 67 3HG2 ILE 67 -2.237 7.502 -7.418 432 HD11 ILE 67 3HD1 ILE 67 -4.315 4.283 -9.172 433 HD12 ILE 67 1HD1 ILE 67 -5.075 4.924 -7.699 434 HD13 ILE 67 2HD1 ILE 67 -6.077 4.515 -9.100 435 H GLN 68 H GLN 68 -1.608 7.489 -11.335 436 HA GLN 68 HA GLN 68 -3.456 7.385 -13.669 437 HB3 GLN 68 2HB GLN 68 -1.476 7.714 -15.070 438 HG3 GLN 68 2HG GLN 68 -1.821 9.977 -13.058 439 HE21 GLN 68 1HE2 GLN 68 -1.541 12.182 -14.163 440 HE22 GLN 68 2HE2 GLN 68 -0.260 12.298 -15.306 441 H LEU 69 H LEU 69 -4.000 5.237 -13.756 442 HA LEU 69 HA LEU 69 -2.052 3.179 -13.618 443 HB3 LEU 69 2HB LEU 69 -4.285 3.405 -11.506 444 HG LEU 69 HG LEU 69 -3.521 1.069 -11.972 445 HD11 LEU 69 1HD1 LEU 69 -0.836 2.206 -11.206 446 HD12 LEU 69 2HD1 LEU 69 -1.283 1.436 -12.727 447 HD13 LEU 69 3HD1 LEU 69 -1.193 0.458 -11.260 448 HD21 LEU 69 3HD2 LEU 69 -4.353 1.626 -9.784 449 HD22 LEU 69 1HD2 LEU 69 -2.729 2.138 -9.269 450 HD23 LEU 69 2HD2 LEU 69 -3.054 0.436 -9.676 451 H ASP 70 H ASP 70 -3.224 1.116 -14.091 452 HA ASP 70 HA ASP 70 -5.774 1.443 -15.582 453 HB3 ASP 70 2HB ASP 70 -5.376 -1.090 -15.925 454 H ASN 71 H ASN 71 -7.478 -0.197 -15.139 455 HA ASN 71 HA ASN 71 -8.001 -0.441 -12.246 456 HB3 ASN 71 2HB ASN 71 -9.676 -1.284 -14.663 457 HD21 ASN 71 1HD2 ASN 71 -10.907 -3.062 -13.884 458 HD22 ASN 71 2HD2 ASN 71 -11.605 -3.098 -12.279 459 H ILE 72 H ILE 72 -7.997 -2.413 -11.182 460 HA ILE 72 HA ILE 72 -7.604 -4.901 -12.663 461 HB ILE 72 HB ILE 72 -6.003 -4.062 -10.204 462 HG13 ILE 72 2HG1 ILE 72 -5.193 -3.104 -12.475 463 HG21 ILE 72 1HG2 ILE 72 -6.563 -6.428 -10.084 464 HG22 ILE 72 2HG2 ILE 72 -6.050 -6.683 -11.772 465 HG23 ILE 72 3HG2 ILE 72 -4.872 -6.314 -10.500 466 HD11 ILE 72 3HD1 ILE 72 -3.307 -4.915 -10.892 467 HD12 ILE 72 1HD1 ILE 72 -2.830 -3.689 -12.049 468 HD13 ILE 72 2HD1 ILE 72 -3.689 -3.209 -10.571 469 H ASP 73 H ASP 73 -8.726 -6.570 -11.541 470 HA ASP 73 HA ASP 73 -10.657 -5.682 -9.512 471 HB3 ASP 73 2HB ASP 73 -10.454 -8.584 -9.910 472 H TYR 74 H TYR 74 -9.643 -5.156 -7.666 473 HA TYR 74 HA TYR 74 -7.333 -6.572 -6.630 474 HB3 TYR 74 2HB TYR 74 -7.466 -4.951 -4.813 475 HD1 TYR 74 2HD TYR 74 -5.518 -4.755 -6.602 476 HD2 TYR 74 1HD TYR 74 -9.231 -2.574 -6.769 477 HE1 TYR 74 2HE TYR 74 -4.463 -3.076 -8.095 478 HE2 TYR 74 1HE TYR 74 -8.207 -0.898 -8.240 479 HH TYR 74 HH TYR 74 -6.265 -0.325 -9.487 480 H ASN 75 H ASN 75 -10.627 -7.281 -6.561 481 HA ASN 75 HA ASN 75 -11.048 -7.996 -3.864 482 HB3 ASN 75 2HB ASN 75 -12.506 -9.656 -5.866 483 HD21 ASN 75 1HD2 ASN 75 -12.611 -10.024 -3.138 484 HD22 ASN 75 2HD2 ASN 75 -14.057 -9.286 -2.498 485 H ASN 76 H ASN 76 -9.053 -9.574 -6.110 486 HA ASN 76 HA ASN 76 -9.485 -12.345 -5.363 487 HB3 ASN 76 2HB ASN 76 -7.431 -12.703 -6.760 488 HD21 ASN 76 1HD2 ASN 76 -8.712 -9.800 -8.432 489 HD22 ASN 76 2HD2 ASN 76 -9.609 -10.762 -9.552 490 H TYR 77 H TYR 77 -7.623 -9.827 -3.883 491 HA TYR 77 HA TYR 77 -5.286 -11.546 -3.311 492 HB3 TYR 77 2HB TYR 77 -4.247 -9.433 -2.672 493 HD1 TYR 77 2HD TYR 77 -2.963 -10.645 -4.436 494 HD2 TYR 77 1HD TYR 77 -6.387 -8.269 -5.413 495 HE1 TYR 77 2HE TYR 77 -2.325 -10.745 -6.819 496 HE2 TYR 77 1HE TYR 77 -5.841 -8.425 -7.828 497 HH TYR 77 HH TYR 77 -2.796 -10.020 -8.949 498 H ASP 78 H ASP 78 -4.825 -12.340 -1.393 499 HA ASP 78 HA ASP 78 -6.697 -12.169 0.875 500 HB3 ASP 78 2HB ASP 78 -3.988 -13.548 0.503 501 H LEU 79 H LEU 79 -3.577 -10.806 -0.192 502 HA LEU 79 HA LEU 79 -3.594 -8.901 2.072 503 HB3 LEU 79 2HB LEU 79 -1.435 -10.810 1.205 504 HG LEU 79 HG LEU 79 -0.386 -8.573 1.617 505 HD11 LEU 79 1HD1 LEU 79 -1.874 -7.628 3.343 506 HD12 LEU 79 2HD1 LEU 79 -0.230 -7.794 3.988 507 HD13 LEU 79 3HD1 LEU 79 -1.473 -8.969 4.442 508 HD21 LEU 79 3HD2 LEU 79 0.275 -10.641 3.745 509 HD22 LEU 79 1HD2 LEU 79 1.341 -9.454 2.968 510 HD23 LEU 79 2HD2 LEU 79 0.712 -10.806 2.034 511 H ILE 80 H ILE 80 -2.845 -6.842 1.462 512 HA ILE 80 HA ILE 80 -1.423 -6.534 -1.131 513 HB ILE 80 HB ILE 80 -3.703 -4.719 -0.322 514 HG13 ILE 80 2HG1 ILE 80 -4.617 -6.836 -1.074 515 HG21 ILE 80 1HG2 ILE 80 -3.231 -3.655 -2.506 516 HG22 ILE 80 2HG2 ILE 80 -1.792 -3.612 -1.511 517 HG23 ILE 80 3HG2 ILE 80 -1.917 -4.812 -2.809 518 HD11 ILE 80 3HD1 ILE 80 -4.617 -5.117 -3.588 519 HD12 ILE 80 1HD1 ILE 80 -5.812 -6.317 -3.098 520 HD13 ILE 80 2HD1 ILE 80 -5.661 -4.815 -2.176 521 H LEU 81 H LEU 81 0.529 -5.720 -0.667 522 HA LEU 81 HA LEU 81 0.894 -3.981 1.724 523 HB3 LEU 81 2HB LEU 81 3.314 -3.952 0.606 524 HG LEU 81 HG LEU 81 3.886 -6.217 1.649 525 HD11 LEU 81 1HD1 LEU 81 2.684 -3.955 3.289 526 HD12 LEU 81 2HD1 LEU 81 4.367 -4.133 2.752 527 HD13 LEU 81 3HD1 LEU 81 3.699 -5.259 3.942 528 HD21 LEU 81 3HD2 LEU 81 2.357 -7.231 3.179 529 HD22 LEU 81 1HD2 LEU 81 1.534 -7.146 1.634 530 HD23 LEU 81 2HD2 LEU 81 1.119 -5.986 2.908 531 H ILE 82 H ILE 82 1.503 -1.821 1.513 532 HA ILE 82 HA ILE 82 1.324 -0.647 -1.203 533 HB ILE 82 HB ILE 82 -0.201 0.182 1.298 534 HG13 ILE 82 2HG1 ILE 82 -1.160 -1.772 0.114 535 HG21 ILE 82 1HG2 ILE 82 -0.146 1.515 -1.447 536 HG22 ILE 82 2HG2 ILE 82 -1.165 1.983 -0.068 537 HG23 ILE 82 3HG2 ILE 82 0.582 2.177 0.030 538 HD11 ILE 82 3HD1 ILE 82 -3.345 -1.138 -0.389 539 HD12 ILE 82 1HD1 ILE 82 -2.811 -0.155 0.991 540 HD13 ILE 82 2HD1 ILE 82 -2.901 0.564 -0.642 541 H GLY 83 H GLY 83 2.652 1.072 -1.595 542 HA2 GLY 83 1HA GLY 83 4.735 1.690 0.485 543 HA3 GLY 83 2HA GLY 83 5.050 1.408 -1.159 544 H SER 84 H SER 84 5.214 3.958 0.708 545 HA SER 84 HA SER 84 4.772 5.787 -1.552 546 HB3 SER 84 2HB SER 84 3.149 5.617 0.948 547 HG SER 84 HG SER 84 3.478 7.631 1.371 548 HA PRO 85 HA PRO 85 8.385 7.813 0.445 549 HB3 PRO 85 2HB PRO 85 8.642 9.098 -1.540 550 HG3 PRO 85 2HG PRO 85 6.793 9.698 -2.822 551 HD3 PRO 85 2HD PRO 85 6.321 7.441 -2.505 552 H VAL 86 H VAL 86 8.798 9.270 2.190 553 HA VAL 86 HA VAL 86 6.393 10.330 3.503 554 HB VAL 86 HB VAL 86 9.171 9.774 4.565 555 HG11 VAL 86 1HG1 VAL 86 8.592 11.745 5.691 556 HG12 VAL 86 2HG1 VAL 86 6.886 11.305 5.854 557 HG13 VAL 86 3HG1 VAL 86 8.138 10.454 6.806 558 HG21 VAL 86 3HG2 VAL 86 7.828 7.806 4.404 559 HG22 VAL 86 1HG2 VAL 86 7.814 8.271 6.110 560 HG23 VAL 86 2HG2 VAL 86 6.405 8.589 5.107 561 H TRP 87 H TRP 87 5.948 12.484 3.039 562 HA TRP 87 HA TRP 87 8.066 14.280 2.105 563 HB3 TRP 87 2HB TRP 87 5.554 15.610 2.739 564 HD1 TRP 87 HD TRP 87 7.034 17.515 1.456 565 HE1 TRP 87 1HE TRP 87 7.458 17.977 -1.073 566 HE3 TRP 87 3HE TRP 87 5.325 13.148 -0.452 567 HZ2 TRP 87 2HZ TRP 87 7.085 16.633 -3.544 568 HZ3 TRP 87 3HZ TRP 87 5.105 12.843 -2.888 569 HH2 TRP 87 HH TRP 87 6.023 14.562 -4.474 570 H SER 88 H SER 88 7.439 16.648 3.475 571 HA SER 88 HA SER 88 9.038 16.178 5.758 572 HB3 SER 88 2HB SER 88 8.991 18.641 5.984 573 HG SER 88 HG SER 88 9.246 18.277 3.230 574 H GLY 89 H GLY 89 6.455 14.945 6.089 575 HA2 GLY 89 1HA GLY 89 6.056 14.927 8.727 576 HA3 GLY 89 2HA GLY 89 4.905 16.163 8.293 577 H TYR 90 H TYR 90 4.189 15.247 5.707 578 HA TYR 90 HA TYR 90 2.343 13.133 6.666 579 HB3 TYR 90 2HB TYR 90 0.582 14.408 5.659 580 HD1 TYR 90 1HD TYR 90 1.581 14.564 8.371 581 HD2 TYR 90 2HD TYR 90 1.250 17.640 5.402 582 HE1 TYR 90 1HE TYR 90 1.620 16.266 10.173 583 HE2 TYR 90 2HE TYR 90 1.327 19.366 7.179 584 HH TYR 90 HH TYR 90 1.972 19.693 9.554 585 HA PRO 91 HA PRO 91 2.737 11.251 2.557 586 HB3 PRO 91 2HB PRO 91 1.237 9.512 2.995 587 HG3 PRO 91 2HG PRO 91 -0.307 9.751 4.694 588 HD3 PRO 91 2HD PRO 91 1.356 10.908 5.858 589 H ALA 92 H ALA 92 2.477 11.936 0.566 590 HA ALA 92 HA ALA 92 1.350 14.517 -0.095 591 HB1 ALA 92 1HB ALA 92 2.169 13.071 -2.397 592 HB2 ALA 92 2HB ALA 92 2.997 14.336 -1.537 593 HB3 ALA 92 3HB ALA 92 3.291 12.659 -1.105 594 H THR 93 H THR 93 -0.538 12.640 0.947 595 HA THR 93 HA THR 93 -2.201 11.085 0.645 596 HB THR 93 HB THR 93 -4.168 12.354 -0.123 597 HG1 THR 93 1HG THR 93 -3.916 14.439 -0.756 598 HG21 THR 93 3HG2 THR 93 -4.010 14.063 1.593 599 HG22 THR 93 1HG2 THR 93 -2.247 14.101 1.510 600 HG23 THR 93 2HG2 THR 93 -3.091 12.666 2.165 601 HA PRO 94 HA PRO 94 -1.183 9.894 -3.758 602 HB3 PRO 94 2HB PRO 94 1.141 9.604 -3.225 603 HG3 PRO 94 2HG PRO 94 1.779 8.719 -1.086 604 HD3 PRO 94 2HD PRO 94 0.550 10.476 -0.622 605 H ILE 95 H ILE 95 -2.122 7.838 -1.129 606 HA ILE 95 HA ILE 95 -3.028 5.732 -2.999 607 HB ILE 95 HB ILE 95 -3.142 5.718 0.016 608 HG13 ILE 95 2HG1 ILE 95 -1.143 4.358 0.091 609 HG21 ILE 95 1HG2 ILE 95 -3.137 3.259 -0.286 610 HG22 ILE 95 2HG2 ILE 95 -4.442 3.949 -1.224 611 HG23 ILE 95 3HG2 ILE 95 -2.958 3.445 -2.043 612 HD11 ILE 95 3HD1 ILE 95 -0.687 3.835 -2.319 613 HD12 ILE 95 1HD1 ILE 95 -0.297 5.553 -2.574 614 HD13 ILE 95 2HD1 ILE 95 0.673 4.579 -1.460 615 H LYS 96 H LYS 96 -4.156 8.709 -1.860 616 HA LYS 96 HA LYS 96 -6.685 8.245 -0.799 617 HB3 LYS 96 2HB LYS 96 -5.593 10.550 -2.464 618 HG3 LYS 96 2HG LYS 96 -7.967 10.863 -2.222 619 HD3 LYS 96 2HD LYS 96 -7.410 10.378 0.732 620 HE3 LYS 96 2HE LYS 96 -8.580 12.499 0.697 621 HZ1 LYS 96 3HZ LYS 96 -9.701 12.417 -1.448 622 HZ2 LYS 96 1HZ LYS 96 -10.798 12.590 -0.235 623 HZ3 LYS 96 2HZ LYS 96 -10.588 11.120 -0.996 624 H THR 97 H THR 97 -5.703 8.579 -4.256 625 HA THR 97 HA THR 97 -8.477 8.200 -5.122 626 HB THR 97 HB THR 97 -6.013 7.802 -6.803 627 HG1 THR 97 1HG THR 97 -7.150 10.354 -6.463 628 HG21 THR 97 3HG2 THR 97 -8.044 7.334 -7.978 629 HG22 THR 97 1HG2 THR 97 -7.442 8.896 -8.561 630 HG23 THR 97 2HG2 THR 97 -8.802 8.830 -7.420 631 H LEU 98 H LEU 98 -5.590 6.122 -4.675 632 HA LEU 98 HA LEU 98 -6.528 3.935 -6.258 633 HB3 LEU 98 2HB LEU 98 -4.562 3.899 -3.926 634 HG LEU 98 HG LEU 98 -5.281 1.613 -4.729 635 HD11 LEU 98 1HD1 LEU 98 -5.765 2.063 -7.084 636 HD12 LEU 98 2HD1 LEU 98 -4.493 0.855 -6.953 637 HD13 LEU 98 3HD1 LEU 98 -4.066 2.531 -7.358 638 HD21 LEU 98 3HD2 LEU 98 -2.417 2.463 -5.337 639 HD22 LEU 98 1HD2 LEU 98 -2.964 0.789 -5.099 640 HD23 LEU 98 2HD2 LEU 98 -3.057 1.940 -3.767 641 H LEU 99 H LEU 99 -6.601 4.529 -2.719 642 HA LEU 99 HA LEU 99 -7.823 2.204 -1.831 643 HB3 LEU 99 2HB LEU 99 -6.770 4.321 -0.686 644 HG LEU 99 HG LEU 99 -9.065 5.650 -1.206 645 HD11 LEU 99 1HD1 LEU 99 -10.627 5.355 0.715 646 HD12 LEU 99 2HD1 LEU 99 -9.555 4.072 1.373 647 HD13 LEU 99 3HD1 LEU 99 -10.394 3.830 -0.163 648 HD21 LEU 99 3HD2 LEU 99 -7.086 6.409 0.216 649 HD22 LEU 99 1HD2 LEU 99 -7.991 5.759 1.588 650 HD23 LEU 99 2HD2 LEU 99 -8.688 7.071 0.625 651 H ASP 100 H ASP 100 -9.348 5.009 -3.358 652 HA ASP 100 HA ASP 100 -12.029 4.278 -2.745 653 HB3 ASP 100 2HB ASP 100 -11.130 5.859 -5.167 654 H GLN 101 H GLN 101 -9.833 3.432 -5.390 655 HA GLN 101 HA GLN 101 -11.724 2.044 -7.073 656 HB3 GLN 101 2HB GLN 101 -9.889 1.334 -8.324 657 HG3 GLN 101 2HG GLN 101 -8.602 3.157 -8.846 658 HE21 GLN 101 1HE2 GLN 101 -9.549 5.879 -7.476 659 HE22 GLN 101 2HE2 GLN 101 -11.044 6.108 -8.385 660 H MET 102 H MET 102 -10.521 1.254 -3.982 661 HA MET 102 HA MET 102 -10.674 -1.675 -4.491 662 HB3 MET 102 2HB MET 102 -8.840 -2.077 -3.116 663 HG3 MET 102 2HG MET 102 -7.684 0.457 -4.102 664 HE1 MET 102 3HE MET 102 -4.979 -2.281 -2.636 665 HE2 MET 102 1HE MET 102 -6.090 -1.013 -2.088 666 HE3 MET 102 2HE MET 102 -6.696 -2.651 -2.416 667 H LYS 103 H LYS 103 -12.590 0.513 -3.326 668 HA LYS 103 HA LYS 103 -13.131 -0.013 -0.548 669 HB3 LYS 103 2HB LYS 103 -15.483 0.849 -1.317 670 HG3 LYS 103 2HG LYS 103 -14.583 3.094 -2.312 671 HD3 LYS 103 2HD LYS 103 -13.912 2.234 0.532 672 HE3 LYS 103 2HE LYS 103 -12.751 4.354 -0.145 673 HZ1 LYS 103 3HZ LYS 103 -14.313 5.321 -1.701 674 HZ2 LYS 103 1HZ LYS 103 -14.205 6.288 -0.373 675 HZ3 LYS 103 2HZ LYS 103 -15.521 5.309 -0.572 676 H ASN 104 H ASN 104 -13.473 -2.260 -3.100 677 HA ASN 104 HA ASN 104 -15.716 -3.715 -1.989 678 HB3 ASN 104 2HB ASN 104 -15.345 -3.408 -4.415 679 HD21 ASN 104 1HD2 ASN 104 -13.603 -6.137 -5.011 680 HD22 ASN 104 2HD2 ASN 104 -12.188 -5.297 -5.691 681 H TYR 105 H TYR 105 -12.376 -3.478 -1.253 682 HA TYR 105 HA TYR 105 -11.670 -6.239 -1.327 683 HB3 TYR 105 2HB TYR 105 -10.429 -3.806 0.059 684 HD1 TYR 105 1HD TYR 105 -8.998 -6.462 -2.122 685 HD2 TYR 105 2HD TYR 105 -9.136 -4.761 1.854 686 HE1 TYR 105 1HE TYR 105 -7.064 -7.842 -1.463 687 HE2 TYR 105 2HE TYR 105 -7.152 -6.073 2.474 688 HH TYR 105 HH TYR 105 -5.455 -7.533 1.725 689 H ARG 106 H ARG 106 -11.161 -7.710 0.322 690 HA ARG 106 HA ARG 106 -12.365 -7.329 3.010 691 HB3 ARG 106 2HB ARG 106 -13.521 -9.485 2.667 692 HG3 ARG 106 2HG ARG 106 -14.973 -9.000 0.657 693 HD3 ARG 106 2HD ARG 106 -15.834 -6.751 1.527 694 HE ARG 106 HE ARG 106 -16.412 -9.096 2.491 695 HH11 ARG 106 1HH1 ARG 106 -15.454 -6.211 4.469 696 HH12 ARG 106 2HH1 ARG 106 -16.229 -6.858 5.871 697 HH21 ARG 106 1HH2 ARG 106 -17.485 -9.774 4.431 698 HH22 ARG 106 2HH2 ARG 106 -17.444 -8.764 5.832 699 H GLY 107 H GLY 107 -9.451 -7.512 2.151 700 HA2 GLY 107 1HA GLY 107 -8.658 -9.991 3.626 701 HA3 GLY 107 2HA GLY 107 -7.783 -9.410 2.197 702 H GLU 108 H GLU 108 -5.868 -9.263 3.625 703 HA GLU 108 HA GLU 108 -5.896 -7.244 5.735 704 HB3 GLU 108 2HB GLU 108 -3.472 -8.374 5.783 705 HG3 GLU 108 2HG GLU 108 -5.137 -8.525 7.471 706 H VAL 109 H VAL 109 -4.309 -5.490 5.756 707 HA VAL 109 HA VAL 109 -2.936 -4.939 3.184 708 HB VAL 109 HB VAL 109 -4.702 -3.049 4.809 709 HG11 VAL 109 1HG1 VAL 109 -4.440 -1.524 2.827 710 HG12 VAL 109 2HG1 VAL 109 -2.876 -1.880 3.547 711 HG13 VAL 109 3HG1 VAL 109 -3.369 -2.713 2.056 712 HG21 VAL 109 3HG2 VAL 109 -5.324 -4.472 2.222 713 HG22 VAL 109 1HG2 VAL 109 -6.230 -4.504 3.755 714 HG23 VAL 109 2HG2 VAL 109 -6.214 -3.028 2.796 715 H ALA 110 H ALA 110 -0.907 -3.748 3.525 716 HA ALA 110 HA ALA 110 -0.589 -2.571 6.185 717 HB1 ALA 110 1HB ALA 110 0.406 -4.728 6.596 718 HB2 ALA 110 2HB ALA 110 1.409 -4.616 5.137 719 HB3 ALA 110 3HB ALA 110 1.690 -3.521 6.512 720 H SER 111 H SER 111 0.984 -0.883 6.336 721 HA SER 111 HA SER 111 1.570 0.191 3.601 722 HB3 SER 111 2HB SER 111 0.920 1.881 5.993 723 HG SER 111 HG SER 111 -0.385 2.817 4.221 724 H PHE 112 H PHE 112 3.736 -0.083 3.288 725 HA PHE 112 HA PHE 112 5.619 0.424 5.552 726 HB3 PHE 112 2HB PHE 112 5.891 -1.572 3.960 727 HD1 PHE 112 2HD PHE 112 8.078 1.046 2.461 728 HD2 PHE 112 1HD PHE 112 4.992 -1.885 1.734 729 HE1 PHE 112 2HE PHE 112 8.384 1.323 0.019 730 HE2 PHE 112 1HE PHE 112 5.344 -1.651 -0.691 731 HZ PHE 112 HZ PHE 112 7.085 -0.073 -1.561 732 H PHE 113 H PHE 113 7.392 2.000 5.174 733 HA PHE 113 HA PHE 113 6.944 4.021 3.081 734 HB3 PHE 113 2HB PHE 113 7.106 5.820 4.832 735 HD1 PHE 113 1HD PHE 113 4.651 3.410 6.233 736 HD2 PHE 113 2HD PHE 113 5.325 6.545 3.324 737 HE1 PHE 113 1HE PHE 113 2.223 3.599 5.877 738 HE2 PHE 113 2HE PHE 113 2.873 6.503 2.832 739 HZ PHE 113 HZ PHE 113 1.343 5.114 4.171 740 H THR 114 H THR 114 8.819 5.743 3.313 741 HA THR 114 HA THR 114 11.217 4.641 4.510 742 HB THR 114 HB THR 114 11.851 3.677 2.636 743 HG1 THR 114 1HG THR 114 12.949 4.898 1.189 744 HG21 THR 114 3HG2 THR 114 9.769 3.577 1.509 745 HG22 THR 114 1HG2 THR 114 10.962 4.113 0.343 746 HG23 THR 114 2HG2 THR 114 9.846 5.299 1.063 747 H SER 115 H SER 115 12.449 6.223 5.293 748 HA SER 115 HA SER 115 11.714 9.032 4.960 749 HB3 SER 115 2HB SER 115 9.909 8.527 6.315 750 HG SER 115 HG SER 115 9.789 7.078 7.872 751 H ALA 116 H ALA 116 12.946 10.385 6.600 752 HA ALA 116 HA ALA 116 15.737 9.541 6.671 753 HB1 ALA 116 1HB ALA 116 16.104 11.937 7.117 754 HB2 ALA 116 2HB ALA 116 15.077 11.720 5.690 755 HB3 ALA 116 3HB ALA 116 14.351 12.205 7.244 756 H GLY 117 H GLY 117 13.828 8.262 8.506 757 HA2 GLY 117 1HA GLY 117 13.526 7.756 10.723 758 HA3 GLY 117 2HA GLY 117 15.088 8.570 10.972 759 H THR 118 H THR 118 11.972 9.944 9.824 760 HA THR 118 HA THR 118 11.523 11.419 12.301 761 HB THR 118 HB THR 118 11.167 13.491 10.928 762 HG1 THR 118 1HG THR 118 11.871 13.629 8.950 763 HG21 THR 118 3HG2 THR 118 13.215 13.188 12.347 764 HG22 THR 118 1HG2 THR 118 13.475 14.237 10.947 765 HG23 THR 118 2HG2 THR 118 14.059 12.568 10.903 766 H ASN 119 H ASN 119 9.334 12.688 11.881 767 HA ASN 119 HA ASN 119 7.163 12.751 11.411 768 HB3 ASN 119 2HB ASN 119 6.563 12.542 9.051 769 HD21 ASN 119 1HD2 ASN 119 8.865 13.491 7.233 770 HD22 ASN 119 2HD2 ASN 119 9.346 14.995 7.941 771 H HIS 120 H HIS 120 8.400 9.870 11.931 772 HA HIS 120 HA HIS 120 7.022 7.911 10.729 773 HB3 HIS 120 2HB HIS 120 9.000 7.593 12.170 774 HD1 HIS 120 1HD HIS 120 7.149 6.258 15.111 775 HD2 HIS 120 2HD HIS 120 9.119 9.833 14.002 776 HE1 HIS 120 1HE HIS 120 7.573 7.533 17.240 777 H LYS 121 H LYS 121 6.099 9.443 13.790 778 HA LYS 121 HA LYS 121 3.835 7.702 14.236 779 HB3 LYS 121 2HB LYS 121 3.809 10.251 15.715 780 HG3 LYS 121 2HG LYS 121 4.650 7.506 16.713 781 HD3 LYS 121 2HD LYS 121 3.967 10.026 17.970 782 HE3 LYS 121 2HE LYS 121 2.182 7.687 18.721 783 HZ1 LYS 121 3HZ LYS 121 2.696 8.888 20.619 784 HZ2 LYS 121 1HZ LYS 121 1.217 9.441 20.156 785 HZ3 LYS 121 2HZ LYS 121 2.558 10.361 19.895 786 H ALA 122 H ALA 122 4.326 10.910 12.915 787 HA ALA 122 HA ALA 122 1.593 11.819 12.816 788 HB1 ALA 122 1HB ALA 122 2.429 13.475 11.165 789 HB2 ALA 122 2HB ALA 122 3.626 13.338 12.469 790 HB3 ALA 122 3HB ALA 122 3.902 12.571 10.898 791 H TYR 123 H TYR 123 3.767 10.155 10.523 792 HA TYR 123 HA TYR 123 2.049 9.994 8.386 793 HB3 TYR 123 2HB TYR 123 3.868 7.666 8.826 794 HD1 TYR 123 1HD TYR 123 2.199 7.301 6.839 795 HD2 TYR 123 2HD TYR 123 4.945 10.619 7.027 796 HE1 TYR 123 1HE TYR 123 1.903 7.703 4.433 797 HE2 TYR 123 2HE TYR 123 4.816 10.866 4.574 798 HH TYR 123 HH TYR 123 4.477 9.351 2.578 799 H VAL 124 H VAL 124 2.421 7.537 10.973 800 HA VAL 124 HA VAL 124 0.659 5.553 9.965 801 HB VAL 124 HB VAL 124 1.439 6.445 12.771 802 HG11 VAL 124 1HG1 VAL 124 -0.592 5.159 13.040 803 HG12 VAL 124 2HG1 VAL 124 0.020 3.882 11.980 804 HG13 VAL 124 3HG1 VAL 124 0.794 4.196 13.549 805 HG21 VAL 124 3HG2 VAL 124 3.380 5.494 12.281 806 HG22 VAL 124 1HG2 VAL 124 2.599 3.945 11.913 807 HG23 VAL 124 2HG2 VAL 124 2.864 5.145 10.634 808 H SER 125 H SER 125 -0.063 8.539 11.984 809 HA SER 125 HA SER 125 -2.872 7.836 12.134 810 HB3 SER 125 2HB SER 125 -2.840 10.563 12.464 811 HG SER 125 HG SER 125 -3.532 9.584 14.133 812 H HIS 126 H HIS 126 -1.035 10.022 9.916 813 HA HIS 126 HA HIS 126 -3.441 10.957 8.609 814 HB3 HIS 126 2HB HIS 126 -1.734 11.633 6.754 815 HD1 HIS 126 1HD HIS 126 -1.485 14.121 6.788 816 HD2 HIS 126 2HD HIS 126 -1.500 12.312 10.615 817 HE1 HIS 126 1HE HIS 126 -1.291 16.008 8.509 818 H PHE 127 H PHE 127 -1.219 8.211 7.897 819 HA PHE 127 HA PHE 127 -2.446 7.595 5.377 820 HB3 PHE 127 2HB PHE 127 -0.935 5.889 7.377 821 HD1 PHE 127 1HD PHE 127 -1.735 5.830 3.629 822 HD2 PHE 127 2HD PHE 127 -1.732 3.681 7.396 823 HE1 PHE 127 1HE PHE 127 -2.526 3.807 2.487 824 HE2 PHE 127 2HE PHE 127 -2.544 1.672 6.226 825 HZ PHE 127 HZ PHE 127 -2.894 1.730 3.725 826 H ASN 128 H ASN 128 -3.314 6.724 8.775 827 HA ASN 128 HA ASN 128 -5.425 4.929 7.936 828 HB3 ASN 128 2HB ASN 128 -6.354 5.501 10.294 829 HD21 ASN 128 1HD2 ASN 128 -2.869 4.957 10.525 830 HD22 ASN 128 2HD2 ASN 128 -2.999 3.238 10.846 831 H GLU 129 H GLU 129 -5.410 8.424 8.885 832 HA GLU 129 HA GLU 129 -8.129 8.947 8.548 833 HB3 GLU 129 2HB GLU 129 -6.897 11.202 7.407 834 HG3 GLU 129 2HG GLU 129 -6.568 11.999 9.794 835 H TRP 130 H TRP 130 -5.653 8.639 6.047 836 HA TRP 130 HA TRP 130 -7.679 8.829 3.896 837 HB3 TRP 130 2HB TRP 130 -5.775 9.135 2.426 838 HD1 TRP 130 HD TRP 130 -3.498 10.820 4.546 839 HE1 TRP 130 1HE TRP 130 -4.100 13.229 5.109 840 HE3 TRP 130 3HE TRP 130 -8.425 10.736 3.167 841 HZ2 TRP 130 2HZ TRP 130 -6.477 14.859 5.137 842 HZ3 TRP 130 3HZ TRP 130 -9.853 12.705 3.567 843 HH2 TRP 130 HH TRP 130 -8.904 14.763 4.562 844 H ALA 131 H ALA 131 -7.478 6.375 5.675 845 HA ALA 131 HA ALA 131 -7.719 4.526 3.438 846 HB1 ALA 131 1HB ALA 131 -5.636 3.838 5.538 847 HB2 ALA 131 2HB ALA 131 -6.088 2.924 4.075 848 HB3 ALA 131 3HB ALA 131 -5.241 4.462 3.924 849 H ASP 132 H ASP 132 -8.868 5.509 6.389 850 HA ASP 132 HA ASP 132 -9.133 3.144 7.801 851 HB3 ASP 132 2HB ASP 132 -10.903 5.601 8.105 852 H GLY 133 H GLY 133 -10.192 2.681 5.264 853 HA2 GLY 133 1HA GLY 133 -13.046 1.906 5.799 854 HA3 GLY 133 2HA GLY 133 -12.377 2.157 4.195 855 H LEU 134 H LEU 134 -9.838 0.574 5.621 856 HA LEU 134 HA LEU 134 -10.932 -2.124 5.043 857 HB3 LEU 134 2HB LEU 134 -9.006 -2.728 3.745 858 HG LEU 134 HG LEU 134 -9.115 -1.625 1.744 859 HD11 LEU 134 1HD1 LEU 134 -11.074 -2.994 2.262 860 HD12 LEU 134 2HD1 LEU 134 -11.399 -1.711 1.072 861 HD13 LEU 134 3HD1 LEU 134 -11.953 -1.547 2.742 862 HD21 LEU 134 3HD2 LEU 134 -9.189 0.773 3.010 863 HD22 LEU 134 1HD2 LEU 134 -10.859 0.653 2.452 864 HD23 LEU 134 2HD2 LEU 134 -9.528 0.530 1.288 865 H ASN 135 H ASN 135 -9.471 -3.806 5.703 866 HA ASN 135 HA ASN 135 -8.550 -3.366 8.382 867 HB3 ASN 135 2HB ASN 135 -8.652 -5.826 6.627 868 HD21 ASN 135 1HD2 ASN 135 -7.043 -7.150 7.314 869 HD22 ASN 135 2HD2 ASN 135 -6.613 -7.460 8.984 870 H VAL 136 H VAL 136 -6.677 -2.204 8.412 871 HA VAL 136 HA VAL 136 -4.286 -3.130 7.022 872 HB VAL 136 HB VAL 136 -4.751 -0.749 7.470 873 HG11 VAL 136 1HG1 VAL 136 -4.309 -1.408 10.384 874 HG12 VAL 136 2HG1 VAL 136 -4.548 0.212 9.682 875 HG13 VAL 136 3HG1 VAL 136 -5.867 -0.972 9.633 876 HG21 VAL 136 3HG2 VAL 136 -2.260 -1.600 8.963 877 HG22 VAL 136 1HG2 VAL 136 -2.402 -1.511 7.186 878 HG23 VAL 136 2HG2 VAL 136 -2.565 -0.052 8.169 879 H ILE 137 H ILE 137 -2.686 -4.481 7.975 880 HA ILE 137 HA ILE 137 -3.154 -5.494 10.722 881 HB ILE 137 HB ILE 137 -1.436 -7.162 10.169 882 HG13 ILE 137 2HG1 ILE 137 -0.118 -5.862 8.508 883 HG21 ILE 137 1HG2 ILE 137 -2.856 -8.496 8.728 884 HG22 ILE 137 2HG2 ILE 137 -3.890 -7.508 9.764 885 HG23 ILE 137 3HG2 ILE 137 -3.630 -7.033 8.070 886 HD11 ILE 137 3HD1 ILE 137 0.383 -7.530 6.877 887 HD12 ILE 137 1HD1 ILE 137 0.102 -8.352 8.432 888 HD13 ILE 137 2HD1 ILE 137 -1.151 -8.369 7.159 889 H GLY 138 H GLY 138 -1.005 -3.360 8.829 890 HA2 GLY 138 1HA GLY 138 0.064 -2.229 11.201 891 HA3 GLY 138 2HA GLY 138 1.226 -3.375 10.518 892 H VAL 139 H VAL 139 1.881 -0.775 10.748 893 HA VAL 139 HA VAL 139 2.544 -0.042 8.086 894 HB VAL 139 HB VAL 139 0.659 1.353 8.166 895 HG11 VAL 139 1HG1 VAL 139 -0.065 2.671 10.068 896 HG12 VAL 139 2HG1 VAL 139 -0.153 0.936 10.278 897 HG13 VAL 139 3HG1 VAL 139 1.164 1.847 11.095 898 HG21 VAL 139 3HG2 VAL 139 2.775 2.716 7.818 899 HG22 VAL 139 1HG2 VAL 139 1.375 3.623 8.405 900 HG23 VAL 139 2HG2 VAL 139 2.685 3.157 9.514 901 H ALA 140 H ALA 140 4.581 0.955 8.024 902 HA ALA 140 HA ALA 140 5.994 1.436 10.499 903 HB1 ALA 140 1HB ALA 140 7.631 -0.302 10.344 904 HB2 ALA 140 2HB ALA 140 6.079 -1.122 10.142 905 HB3 ALA 140 3HB ALA 140 7.120 -0.774 8.736 906 H ARG 141 H ARG 141 8.566 1.333 9.570 907 HA ARG 141 HA ARG 141 8.630 2.593 6.951 908 HB3 ARG 141 2HB ARG 141 9.099 4.447 8.556 909 HG3 ARG 141 2HG ARG 141 11.449 4.535 9.408 910 HD3 ARG 141 2HD ARG 141 9.909 2.446 11.003 911 HE ARG 141 HE ARG 141 11.266 4.861 12.089 912 HH11 ARG 141 1HH1 ARG 141 11.108 1.272 12.174 913 HH12 ARG 141 2HH1 ARG 141 12.222 1.206 13.500 914 HH21 ARG 141 1HH2 ARG 141 12.877 4.649 13.657 915 HH22 ARG 141 2HH2 ARG 141 13.223 3.110 14.350 916 H ASP 142 H ASP 142 10.528 2.101 5.888 917 HA ASP 142 HA ASP 142 11.790 0.573 4.857 918 HB3 ASP 142 2HB ASP 142 13.676 -0.405 6.164 919 H ASP 143 H ASP 143 12.702 -1.833 5.138 920 HA ASP 143 HA ASP 143 10.431 -3.542 4.823 921 HB3 ASP 143 2HB ASP 143 12.235 -3.665 3.274 922 H SER 144 H SER 144 11.482 -2.671 7.737 923 HA SER 144 HA SER 144 12.470 -5.122 8.800 924 HB3 SER 144 2HB SER 144 11.425 -3.299 10.838 925 HG SER 144 HG SER 144 13.584 -3.295 11.387 926 H GLU 145 H GLU 145 9.210 -4.465 8.113 927 HA GLU 145 HA GLU 145 8.338 -6.426 10.191 928 HB3 GLU 145 2HB GLU 145 6.078 -5.367 10.088 929 HG3 GLU 145 2HG GLU 145 8.325 -3.553 11.014 930 H VAL 146 H VAL 146 9.162 -6.586 7.033 931 HA VAL 146 HA VAL 146 6.815 -7.644 5.832 932 HB VAL 146 HB VAL 146 9.694 -8.391 5.264 933 HG11 VAL 146 1HG1 VAL 146 8.133 -9.962 4.236 934 HG12 VAL 146 2HG1 VAL 146 7.180 -8.616 3.576 935 HG13 VAL 146 3HG1 VAL 146 8.842 -8.927 3.008 936 HG21 VAL 146 3HG2 VAL 146 9.260 -5.899 5.089 937 HG22 VAL 146 1HG2 VAL 146 9.683 -6.681 3.580 938 HG23 VAL 146 2HG2 VAL 146 7.981 -6.253 3.919 939 H ASP 147 H ASP 147 9.219 -9.083 7.987 940 HA ASP 147 HA ASP 147 8.543 -11.774 8.094 941 HB3 ASP 147 2HB ASP 147 9.262 -9.710 10.177 942 H LYS 148 H LYS 148 6.554 -9.072 9.367 943 HA LYS 148 HA LYS 148 4.596 -11.110 10.341 944 HB3 LYS 148 2HB LYS 148 5.191 -9.496 12.064 945 HG3 LYS 148 2HG LYS 148 4.424 -7.498 9.949 946 HD3 LYS 148 2HD LYS 148 2.919 -7.122 11.989 947 HE3 LYS 148 2HE LYS 148 5.679 -6.387 13.022 948 HZ1 LYS 148 3HZ LYS 148 4.621 -4.975 14.613 949 HZ2 LYS 148 1HZ LYS 148 3.116 -5.260 13.984 950 HZ3 LYS 148 2HZ LYS 148 4.296 -4.464 13.105 951 H TRP 149 H TRP 149 5.201 -9.070 7.672 952 HA TRP 149 HA TRP 149 2.346 -8.861 6.951 953 HB3 TRP 149 2HB TRP 149 3.031 -7.304 5.294 954 HD1 TRP 149 HD TRP 149 2.239 -7.149 8.485 955 HE1 TRP 149 1HE TRP 149 2.704 -5.005 9.686 956 HE3 TRP 149 3HE TRP 149 5.680 -5.211 5.305 957 HZ2 TRP 149 2HZ TRP 149 4.059 -2.434 9.100 958 HZ3 TRP 149 3HZ TRP 149 6.541 -2.889 5.603 959 HH2 TRP 149 HH TRP 149 5.616 -1.452 7.392 960 H SER 150 H SER 150 4.338 -11.346 6.703 961 HA SER 150 HA SER 150 3.302 -12.112 4.047 962 HB3 SER 150 2HB SER 150 6.201 -12.680 4.721 963 HG SER 150 HG SER 150 5.402 -13.741 2.919 964 H LYS 151 H LYS 151 2.787 -12.693 6.945 965 HA LYS 151 HA LYS 151 3.473 -15.505 7.421 966 HB3 LYS 151 2HB LYS 151 2.227 -15.322 9.423 967 HG3 LYS 151 2HG LYS 151 3.482 -12.608 9.365 968 HD3 LYS 151 2HD LYS 151 4.441 -13.327 11.536 969 HE3 LYS 151 2HE LYS 151 2.284 -14.097 12.782 970 HZ1 LYS 151 3HZ LYS 151 1.325 -11.945 12.692 971 HZ2 LYS 151 1HZ LYS 151 2.114 -11.514 11.350 972 HZ3 LYS 151 2HZ LYS 151 2.939 -11.791 12.766 Start of MODEL 17 1 H1 GLY 1 H GLY 1 -11.951 -23.411 -6.252 2 HA2 GLY 1 1HA GLY 1 -10.564 -22.853 -4.341 3 HA3 GLY 1 2HA GLY 1 -10.042 -24.381 -5.047 4 H MET 2 H MET 2 -9.447 -20.855 -5.618 5 HA MET 2 HA MET 2 -6.621 -21.231 -5.048 6 HB3 MET 2 2HB MET 2 -6.125 -19.609 -6.981 7 HG3 MET 2 2HG MET 2 -5.419 -22.091 -6.827 8 HE1 MET 2 3HE MET 2 -4.760 -23.668 -9.187 9 HE2 MET 2 1HE MET 2 -6.024 -24.262 -10.282 10 HE3 MET 2 2HE MET 2 -5.495 -22.572 -10.371 11 H ALA 3 H ALA 3 -6.726 -20.006 -3.179 12 HA ALA 3 HA ALA 3 -7.366 -17.178 -3.512 13 HB1 ALA 3 1HB ALA 3 -8.763 -18.937 -1.450 14 HB2 ALA 3 2HB ALA 3 -8.838 -17.170 -1.518 15 HB3 ALA 3 3HB ALA 3 -9.534 -18.123 -2.832 16 H LYS 4 H LYS 4 -5.058 -17.086 -3.323 17 HA LYS 4 HA LYS 4 -4.206 -16.563 -0.649 18 HB3 LYS 4 2HB LYS 4 -3.805 -18.974 -0.589 19 HG3 LYS 4 2HG LYS 4 -1.672 -19.813 -1.727 20 HD3 LYS 4 2HD LYS 4 -4.297 -19.678 -3.010 21 HE3 LYS 4 2HE LYS 4 -2.724 -18.711 -4.846 22 HZ1 LYS 4 3HZ LYS 4 -1.627 -20.547 -6.073 23 HZ2 LYS 4 1HZ LYS 4 -1.994 -21.580 -4.870 24 HZ3 LYS 4 2HZ LYS 4 -0.952 -20.345 -4.584 25 H LYS 5 H LYS 5 -4.362 -15.365 -3.302 26 HA LYS 5 HA LYS 5 -1.658 -15.086 -4.380 27 HB3 LYS 5 2HB LYS 5 -3.225 -13.038 -5.492 28 HG3 LYS 5 2HG LYS 5 -3.974 -15.019 -7.068 29 HD3 LYS 5 2HD LYS 5 -1.046 -14.759 -7.155 30 HE3 LYS 5 2HE LYS 5 -2.511 -15.507 -9.073 31 HZ1 LYS 5 3HZ LYS 5 -4.312 -13.776 -8.736 32 HZ2 LYS 5 1HZ LYS 5 -3.708 -13.857 -10.275 33 HZ3 LYS 5 2HZ LYS 5 -3.266 -12.651 -9.315 34 H THR 6 H THR 6 -0.572 -12.842 -4.720 35 HA THR 6 HA THR 6 -1.245 -10.951 -2.586 36 HB THR 6 HB THR 6 1.493 -12.192 -2.953 37 HG1 THR 6 1HG THR 6 -0.612 -12.584 -1.203 38 HG21 THR 6 3HG2 THR 6 0.570 -9.911 -1.160 39 HG22 THR 6 1HG2 THR 6 1.849 -9.878 -2.385 40 HG23 THR 6 2HG2 THR 6 2.079 -10.824 -0.916 41 H LEU 7 H LEU 7 -1.093 -8.903 -3.251 42 HA LEU 7 HA LEU 7 0.454 -8.250 -5.734 43 HB3 LEU 7 2HB LEU 7 -2.012 -6.904 -4.600 44 HG LEU 7 HG LEU 7 -0.568 -5.411 -6.033 45 HD11 LEU 7 1HD1 LEU 7 0.023 -7.362 -7.715 46 HD12 LEU 7 2HD1 LEU 7 -0.236 -5.734 -8.319 47 HD13 LEU 7 3HD1 LEU 7 -1.526 -6.970 -8.454 48 HD21 LEU 7 3HD2 LEU 7 -2.941 -5.008 -5.720 49 HD22 LEU 7 1HD2 LEU 7 -3.345 -6.143 -7.015 50 HD23 LEU 7 2HD2 LEU 7 -2.508 -4.646 -7.409 51 H ILE 8 H ILE 8 1.571 -6.304 -5.700 52 HA ILE 8 HA ILE 8 2.380 -5.124 -3.090 53 HB ILE 8 HB ILE 8 4.021 -6.257 -5.399 54 HG13 ILE 8 2HG1 ILE 8 3.181 -8.016 -3.903 55 HG21 ILE 8 1HG2 ILE 8 6.028 -5.550 -4.446 56 HG22 ILE 8 2HG2 ILE 8 5.005 -4.120 -4.312 57 HG23 ILE 8 3HG2 ILE 8 5.262 -5.180 -2.911 58 HD11 ILE 8 3HD1 ILE 8 6.099 -7.583 -3.237 59 HD12 ILE 8 1HD1 ILE 8 5.195 -9.104 -3.318 60 HD13 ILE 8 2HD1 ILE 8 5.507 -8.183 -4.801 61 H LEU 9 H LEU 9 1.747 -3.005 -3.348 62 HA LEU 9 HA LEU 9 2.003 -1.619 -5.984 63 HB3 LEU 9 2HB LEU 9 -0.083 -0.420 -5.282 64 HG LEU 9 HG LEU 9 -0.594 -3.401 -5.223 65 HD11 LEU 9 1HD1 LEU 9 -2.364 -1.020 -5.899 66 HD12 LEU 9 2HD1 LEU 9 -2.423 -2.007 -4.409 67 HD13 LEU 9 3HD1 LEU 9 -2.838 -2.726 -5.978 68 HD21 LEU 9 3HD2 LEU 9 0.665 -2.853 -7.220 69 HD22 LEU 9 1HD2 LEU 9 -0.383 -1.453 -7.571 70 HD23 LEU 9 2HD2 LEU 9 -1.006 -3.106 -7.696 71 H TYR 10 H TYR 10 3.991 -0.502 -5.352 72 HA TYR 10 HA TYR 10 3.680 1.230 -2.927 73 HB3 TYR 10 2HB TYR 10 6.030 1.105 -2.618 74 HD1 TYR 10 2HD TYR 10 3.512 -0.944 -1.986 75 HD2 TYR 10 1HD TYR 10 7.667 -1.329 -2.962 76 HE1 TYR 10 2HE TYR 10 3.572 -3.054 -0.767 77 HE2 TYR 10 1HE TYR 10 7.727 -3.498 -1.726 78 HH TYR 10 HH TYR 10 5.027 -4.687 0.205 79 H TYR 11 H TYR 11 3.802 3.423 -3.125 80 HA TYR 11 HA TYR 11 4.162 4.560 -5.777 81 HB3 TYR 11 2HB TYR 11 3.598 5.829 -3.111 82 HD1 TYR 11 1HD TYR 11 4.403 6.562 -6.772 83 HD2 TYR 11 2HD TYR 11 3.595 8.188 -2.862 84 HE1 TYR 11 1HE TYR 11 5.102 8.787 -7.552 85 HE2 TYR 11 2HE TYR 11 4.457 10.372 -3.619 86 HH TYR 11 HH TYR 11 4.591 11.664 -5.580 87 H SER 12 H SER 12 6.164 4.399 -6.507 88 HA SER 12 HA SER 12 8.682 4.852 -5.277 89 HB3 SER 12 2HB SER 12 8.440 3.546 -7.255 90 HG SER 12 HG SER 12 7.165 5.791 -8.433 91 H TRP 13 H TRP 13 8.785 6.860 -4.150 92 HA TRP 13 HA TRP 13 7.598 9.261 -4.877 93 HB3 TRP 13 2HB TRP 13 10.211 8.871 -3.360 94 HD1 TRP 13 HD TRP 13 7.076 11.145 -2.976 95 HE1 TRP 13 1HE TRP 13 7.792 13.484 -2.318 96 HE3 TRP 13 3HE TRP 13 12.174 10.599 -3.397 97 HZ2 TRP 13 2HZ TRP 13 10.233 15.000 -2.132 98 HZ3 TRP 13 3HZ TRP 13 13.643 12.572 -3.072 99 HH2 TRP 13 HH TRP 13 12.694 14.757 -2.422 100 H SER 14 H SER 14 11.132 9.316 -4.965 101 HA SER 14 HA SER 14 11.162 9.994 -7.845 102 HB3 SER 14 2HB SER 14 12.686 11.782 -5.966 103 HG SER 14 HG SER 14 12.835 12.157 -8.238 104 H GLY 15 H GLY 15 11.987 7.631 -6.299 105 HA2 GLY 15 1HA GLY 15 13.777 6.327 -7.338 106 HA3 GLY 15 2HA GLY 15 14.931 7.520 -6.767 107 H GLU 16 H GLU 16 12.755 7.473 -4.344 108 HA GLU 16 HA GLU 16 14.444 5.879 -2.595 109 HB3 GLU 16 2HB GLU 16 12.810 6.573 -0.875 110 HG3 GLU 16 2HG GLU 16 13.535 8.924 -2.674 111 H THR 17 H THR 17 10.812 5.719 -3.078 112 HA THR 17 HA THR 17 10.771 3.332 -1.713 113 HB THR 17 HB THR 17 8.515 3.850 -3.506 114 HG1 THR 17 1HG THR 17 7.907 5.746 -2.652 115 HG21 THR 17 3HG2 THR 17 7.225 3.894 -1.415 116 HG22 THR 17 1HG2 THR 17 8.734 3.916 -0.476 117 HG23 THR 17 2HG2 THR 17 8.315 2.497 -1.466 118 H LYS 18 H LYS 18 11.393 3.869 -5.058 119 HA LYS 18 HA LYS 18 10.710 1.347 -6.213 120 HB3 LYS 18 2HB LYS 18 13.030 3.261 -6.807 121 HG3 LYS 18 2HG LYS 18 11.826 1.046 -8.546 122 HD3 LYS 18 2HD LYS 18 12.706 3.042 -9.825 123 HE3 LYS 18 2HE LYS 18 15.177 2.217 -8.266 124 HZ1 LYS 18 3HZ LYS 18 15.220 3.532 -10.888 125 HZ2 LYS 18 1HZ LYS 18 15.810 2.029 -10.506 126 HZ3 LYS 18 2HZ LYS 18 16.528 3.355 -9.870 127 H LYS 19 H LYS 19 13.441 2.280 -4.089 128 HA LYS 19 HA LYS 19 14.813 -0.259 -4.481 129 HB3 LYS 19 2HB LYS 19 15.616 0.830 -1.976 130 HG3 LYS 19 2HG LYS 19 17.507 1.832 -3.345 131 HD3 LYS 19 2HD LYS 19 16.610 -1.062 -3.545 132 HE3 LYS 19 2HE LYS 19 19.267 -0.020 -4.556 133 HZ1 LYS 19 3HZ LYS 19 17.857 -2.546 -5.060 134 HZ2 LYS 19 1HZ LYS 19 18.853 -2.409 -3.778 135 HZ3 LYS 19 2HZ LYS 19 19.448 -2.222 -5.328 136 H MET 20 H MET 20 12.332 0.994 -2.315 137 HA MET 20 HA MET 20 12.511 -1.360 -0.590 138 HB3 MET 20 2HB MET 20 10.314 0.666 -0.303 139 HG3 MET 20 2HG MET 20 10.760 -1.097 1.387 140 HE1 MET 20 3HE MET 20 13.298 1.704 1.940 141 HE2 MET 20 1HE MET 20 14.852 0.897 2.199 142 HE3 MET 20 2HE MET 20 14.158 0.967 0.567 143 H ALA 21 H ALA 21 11.951 -1.950 -3.305 144 HA ALA 21 HA ALA 21 9.160 -2.935 -3.129 145 HB1 ALA 21 1HB ALA 21 10.433 -1.704 -5.607 146 HB2 ALA 21 2HB ALA 21 8.784 -2.309 -5.452 147 HB3 ALA 21 3HB ALA 21 9.282 -0.870 -4.557 148 H GLU 22 H GLU 22 12.010 -3.229 -5.308 149 HA GLU 22 HA GLU 22 11.922 -5.946 -5.856 150 HB3 GLU 22 2HB GLU 22 13.718 -4.982 -6.966 151 HG3 GLU 22 2HG GLU 22 14.000 -3.254 -4.537 152 H LYS 23 H LYS 23 13.496 -4.406 -3.042 153 HA LYS 23 HA LYS 23 14.538 -6.649 -1.844 154 HB3 LYS 23 2HB LYS 23 13.402 -4.161 -0.465 155 HG3 LYS 23 2HG LYS 23 15.190 -6.392 0.444 156 HD3 LYS 23 2HD LYS 23 16.716 -4.408 0.380 157 HE3 LYS 23 2HE LYS 23 14.496 -3.013 1.472 158 HZ1 LYS 23 3HZ LYS 23 15.474 -2.168 3.542 159 HZ2 LYS 23 1HZ LYS 23 16.689 -3.248 3.457 160 HZ3 LYS 23 2HZ LYS 23 15.213 -3.810 3.670 161 H ILE 24 H ILE 24 11.400 -5.209 -0.920 162 HA ILE 24 HA ILE 24 10.531 -7.314 0.689 163 HB ILE 24 HB ILE 24 8.597 -5.558 -0.846 164 HG13 ILE 24 2HG1 ILE 24 10.164 -3.888 -0.254 165 HG21 ILE 24 1HG2 ILE 24 7.851 -7.363 0.748 166 HG22 ILE 24 2HG2 ILE 24 8.697 -6.505 2.043 167 HG23 ILE 24 3HG2 ILE 24 7.320 -5.749 1.216 168 HD11 ILE 24 3HD1 ILE 24 7.922 -3.306 0.749 169 HD12 ILE 24 1HD1 ILE 24 8.493 -3.999 2.289 170 HD13 ILE 24 2HD1 ILE 24 9.296 -2.598 1.606 171 H ASN 25 H ASN 25 10.062 -6.833 -2.848 172 HA ASN 25 HA ASN 25 8.106 -8.839 -3.161 173 HB3 ASN 25 2HB ASN 25 10.155 -7.709 -5.112 174 HD21 ASN 25 1HD2 ASN 25 6.975 -9.504 -4.959 175 HD22 ASN 25 2HD2 ASN 25 7.250 -10.379 -6.422 176 H SER 26 H SER 26 11.694 -9.158 -3.088 177 HA SER 26 HA SER 26 11.749 -11.891 -3.806 178 HB3 SER 26 2HB SER 26 13.933 -11.297 -2.200 179 HG SER 26 HG SER 26 13.756 -12.011 -4.459 180 H GLU 27 H GLU 27 11.240 -10.209 -0.656 181 HA GLU 27 HA GLU 27 11.589 -12.637 0.917 182 HB3 GLU 27 2HB GLU 27 10.145 -11.088 2.572 183 HG3 GLU 27 2HG GLU 27 12.179 -9.795 3.182 184 H ILE 28 H ILE 28 8.957 -11.269 -0.956 185 HA ILE 28 HA ILE 28 6.928 -12.820 0.479 186 HB ILE 28 HB ILE 28 6.800 -10.961 -1.921 187 HG13 ILE 28 2HG1 ILE 28 7.271 -10.127 0.560 188 HG21 ILE 28 1HG2 ILE 28 4.333 -10.939 -1.622 189 HG22 ILE 28 2HG2 ILE 28 4.903 -12.500 -2.149 190 HG23 ILE 28 3HG2 ILE 28 4.465 -12.253 -0.439 191 HD11 ILE 28 3HD1 ILE 28 6.603 -8.522 -1.129 192 HD12 ILE 28 1HD1 ILE 28 4.894 -8.969 -0.930 193 HD13 ILE 28 2HD1 ILE 28 5.765 -8.217 0.405 194 H LYS 29 H LYS 29 5.498 -14.182 -0.712 195 HA LYS 29 HA LYS 29 6.582 -16.407 -2.132 196 HB3 LYS 29 2HB LYS 29 3.737 -15.362 -2.200 197 HG3 LYS 29 2HG LYS 29 4.064 -18.106 -1.240 198 HD3 LYS 29 2HD LYS 29 2.423 -18.679 -2.875 199 HE3 LYS 29 2HE LYS 29 0.624 -17.034 -2.614 200 HZ1 LYS 29 3HZ LYS 29 0.560 -16.888 -0.231 201 HZ2 LYS 29 1HZ LYS 29 2.139 -17.070 -0.063 202 HZ3 LYS 29 2HZ LYS 29 1.276 -18.334 -0.577 203 H ASP 30 H ASP 30 5.200 -16.913 -4.239 204 HA ASP 30 HA ASP 30 6.080 -15.390 -6.446 205 HB3 ASP 30 2HB ASP 30 4.095 -17.686 -6.255 206 H SER 31 H SER 31 4.840 -13.634 -5.147 207 HA SER 31 HA SER 31 2.252 -12.691 -5.856 208 HB3 SER 31 2HB SER 31 3.456 -11.898 -3.923 209 HG SER 31 HG SER 31 5.614 -12.187 -4.498 210 H GLU 32 H GLU 32 2.929 -10.076 -6.853 211 HA GLU 32 HA GLU 32 4.361 -10.320 -9.368 212 HB3 GLU 32 2HB GLU 32 2.638 -8.479 -10.098 213 HG3 GLU 32 2HG GLU 32 0.901 -10.030 -10.777 214 H LEU 33 H LEU 33 4.702 -7.847 -9.884 215 HA LEU 33 HA LEU 33 5.103 -6.218 -7.408 216 HB3 LEU 33 2HB LEU 33 7.258 -5.942 -9.481 217 HG LEU 33 HG LEU 33 7.510 -6.351 -6.507 218 HD11 LEU 33 1HD1 LEU 33 9.446 -5.069 -8.513 219 HD12 LEU 33 2HD1 LEU 33 9.635 -6.654 -7.753 220 HD13 LEU 33 3HD1 LEU 33 9.761 -5.182 -6.788 221 HD21 LEU 33 3HD2 LEU 33 7.774 -4.044 -6.123 222 HD22 LEU 33 1HD2 LEU 33 6.173 -4.321 -6.781 223 HD23 LEU 33 2HD2 LEU 33 7.447 -3.647 -7.844 224 H LYS 34 H LYS 34 4.037 -4.182 -7.674 225 HA LYS 34 HA LYS 34 3.908 -3.086 -10.388 226 HB3 LYS 34 2HB LYS 34 1.410 -2.505 -9.509 227 HG3 LYS 34 2HG LYS 34 2.351 -4.977 -11.022 228 HD3 LYS 34 2HD LYS 34 -0.424 -3.831 -10.641 229 HE3 LYS 34 2HE LYS 34 0.855 -5.008 -13.088 230 HZ1 LYS 34 3HZ LYS 34 -1.905 -5.617 -12.267 231 HZ2 LYS 34 1HZ LYS 34 -0.691 -6.685 -12.677 232 HZ3 LYS 34 2HZ LYS 34 -1.370 -5.708 -13.799 233 H GLU 35 H GLU 35 2.953 -0.702 -10.130 234 HA GLU 35 HA GLU 35 3.866 0.529 -7.615 235 HB3 GLU 35 2HB GLU 35 5.755 0.443 -9.364 236 HG3 GLU 35 2HG GLU 35 4.354 2.873 -10.560 237 H VAL 36 H VAL 36 3.105 2.786 -7.441 238 HA VAL 36 HA VAL 36 0.705 3.391 -9.130 239 HB VAL 36 HB VAL 36 0.851 3.798 -6.132 240 HG11 VAL 36 1HG1 VAL 36 -1.657 3.988 -6.494 241 HG12 VAL 36 2HG1 VAL 36 -0.698 5.286 -7.230 242 HG13 VAL 36 3HG1 VAL 36 -1.340 3.985 -8.241 243 HG21 VAL 36 3HG2 VAL 36 -0.789 1.863 -6.026 244 HG22 VAL 36 1HG2 VAL 36 -0.219 1.420 -7.659 245 HG23 VAL 36 2HG2 VAL 36 0.905 1.458 -6.287 246 H LYS 37 H LYS 37 1.795 5.006 -10.342 247 HA LYS 37 HA LYS 37 3.120 7.156 -8.732 248 HB3 LYS 37 2HB LYS 37 4.458 6.474 -10.642 249 HG3 LYS 37 2HG LYS 37 3.313 7.698 -12.850 250 HD3 LYS 37 2HD LYS 37 2.624 5.288 -13.577 251 HE3 LYS 37 2HE LYS 37 5.574 5.679 -12.907 252 HZ1 LYS 37 3HZ LYS 37 5.242 3.720 -14.179 253 HZ2 LYS 37 1HZ LYS 37 5.595 4.876 -15.299 254 HZ3 LYS 37 2HZ LYS 37 4.052 4.408 -15.092 255 H VAL 38 H VAL 38 2.538 9.453 -9.474 256 HA VAL 38 HA VAL 38 -0.389 9.760 -9.376 257 HB VAL 38 HB VAL 38 0.203 12.000 -8.409 258 HG11 VAL 38 1HG1 VAL 38 -0.400 9.921 -7.040 259 HG12 VAL 38 2HG1 VAL 38 1.314 9.803 -6.631 260 HG13 VAL 38 3HG1 VAL 38 0.384 11.271 -6.207 261 HG21 VAL 38 3HG2 VAL 38 2.629 12.047 -9.166 262 HG22 VAL 38 1HG2 VAL 38 2.377 12.452 -7.466 263 HG23 VAL 38 2HG2 VAL 38 2.995 10.849 -7.920 264 H SER 39 H SER 39 -0.837 12.182 -10.404 265 HA SER 39 HA SER 39 -0.016 12.205 -13.113 266 HB3 SER 39 2HB SER 39 -1.037 14.705 -12.252 267 HG SER 39 HG SER 39 -2.290 13.952 -13.795 268 H GLU 40 H GLU 40 0.769 14.695 -13.728 269 HA GLU 40 HA GLU 40 3.300 15.241 -12.388 270 HB3 GLU 40 2HB GLU 40 1.751 16.131 -14.858 271 HG3 GLU 40 2HG GLU 40 4.373 17.131 -13.782 272 H GLY 41 H GLY 41 3.558 17.649 -11.785 273 HA2 GLY 41 1HA GLY 41 2.872 19.675 -11.072 274 HA3 GLY 41 2HA GLY 41 1.211 19.277 -11.477 275 H THR 42 H THR 42 2.145 16.722 -9.566 276 HA THR 42 HA THR 42 0.356 17.464 -7.593 277 HB THR 42 HB THR 42 2.402 15.238 -7.289 278 HG1 THR 42 1HG THR 42 0.204 15.443 -9.093 279 HG21 THR 42 3HG2 THR 42 -0.595 15.416 -6.853 280 HG22 THR 42 1HG2 THR 42 0.605 15.538 -5.560 281 HG23 THR 42 2HG2 THR 42 0.426 14.016 -6.452 282 H PHE 43 H PHE 43 3.953 17.246 -7.357 283 HA PHE 43 HA PHE 43 4.007 19.274 -5.257 284 HB3 PHE 43 2HB PHE 43 5.473 17.780 -3.825 285 HD1 PHE 43 2HD PHE 43 3.667 19.081 -2.529 286 HD2 PHE 43 1HD PHE 43 2.926 15.272 -4.408 287 HE1 PHE 43 2HE PHE 43 1.649 18.822 -1.176 288 HE2 PHE 43 1HE PHE 43 0.824 15.054 -3.081 289 HZ PHE 43 HZ PHE 43 0.203 16.805 -1.441 290 H ASP 44 H ASP 44 6.629 19.402 -4.706 291 HA ASP 44 HA ASP 44 8.093 19.212 -7.307 292 HB3 ASP 44 2HB ASP 44 8.107 21.754 -5.684 293 H ALA 45 H ALA 45 8.279 17.857 -4.844 294 HA ALA 45 HA ALA 45 9.711 17.154 -3.106 295 HB1 ALA 45 1HB ALA 45 12.019 16.743 -3.884 296 HB2 ALA 45 2HB ALA 45 10.813 16.301 -5.099 297 HB3 ALA 45 3HB ALA 45 11.733 17.810 -5.276 298 H ASP 46 H ASP 46 9.037 20.088 -3.027 299 HA ASP 46 HA ASP 46 11.394 21.497 -2.352 300 HB3 ASP 46 2HB ASP 46 8.537 22.392 -1.957 301 H MET 47 H MET 47 10.472 23.139 -0.311 302 HA MET 47 HA MET 47 10.079 21.451 2.098 303 HB3 MET 47 2HB MET 47 11.909 23.815 1.527 304 HG3 MET 47 2HG MET 47 11.149 22.514 4.126 305 HE1 MET 47 3HE MET 47 13.246 25.595 2.949 306 HE2 MET 47 1HE MET 47 14.896 25.193 3.466 307 HE3 MET 47 2HE MET 47 14.145 24.301 2.124 308 H TYR 48 H TYR 48 9.732 24.674 0.485 309 HA TYR 48 HA TYR 48 7.639 25.439 2.449 310 HB3 TYR 48 2HB TYR 48 9.275 27.077 2.372 311 HD1 TYR 48 1HD TYR 48 11.385 26.220 1.286 312 HD2 TYR 48 2HD TYR 48 8.301 28.274 -0.948 313 HE1 TYR 48 1HE TYR 48 12.927 26.462 -0.610 314 HE2 TYR 48 2HE TYR 48 9.861 28.543 -2.838 315 HH TYR 48 HH TYR 48 12.827 26.742 -2.989 316 H LYS 49 H LYS 49 8.233 25.010 -1.097 317 HA LYS 49 HA LYS 49 5.608 25.909 -1.804 318 HB3 LYS 49 2HB LYS 49 7.193 23.816 -3.349 319 HG3 LYS 49 2HG LYS 49 4.857 24.558 -4.123 320 HD3 LYS 49 2HD LYS 49 6.383 27.082 -4.868 321 HE3 LYS 49 2HE LYS 49 3.433 26.359 -5.204 322 HZ1 LYS 49 3HZ LYS 49 4.099 28.729 -5.199 323 HZ2 LYS 49 1HZ LYS 49 3.353 28.248 -6.581 324 HZ3 LYS 49 2HZ LYS 49 4.997 28.462 -6.549 325 H THR 50 H THR 50 6.871 22.537 -1.351 326 HA THR 50 HA THR 50 4.377 21.304 -1.710 327 HB THR 50 HB THR 50 5.541 19.385 -0.505 328 HG1 THR 50 1HG THR 50 7.054 20.506 0.782 329 HG21 THR 50 3HG2 THR 50 7.090 18.969 -2.327 330 HG22 THR 50 1HG2 THR 50 7.178 20.688 -2.714 331 HG23 THR 50 2HG2 THR 50 5.675 19.815 -2.975 332 H SER 51 H SER 51 5.539 23.093 1.019 333 HA SER 51 HA SER 51 3.910 22.059 3.108 334 HB3 SER 51 2HB SER 51 4.453 24.987 3.066 335 HG SER 51 HG SER 51 4.176 23.926 5.013 336 H ASP 52 H ASP 52 3.500 24.866 0.923 337 HA ASP 52 HA ASP 52 0.899 25.532 1.789 338 HB3 ASP 52 2HB ASP 52 2.041 26.058 -1.002 339 H ILE 53 H ILE 53 1.985 23.534 -0.934 340 HA ILE 53 HA ILE 53 -0.520 23.036 -2.129 341 HB ILE 53 HB ILE 53 1.943 21.259 -2.041 342 HG13 ILE 53 2HG1 ILE 53 2.265 23.536 -3.091 343 HG21 ILE 53 1HG2 ILE 53 -0.419 21.112 -3.967 344 HG22 ILE 53 2HG2 ILE 53 1.021 20.081 -3.972 345 HG23 ILE 53 3HG2 ILE 53 -0.122 19.955 -2.663 346 HD11 ILE 53 3HD1 ILE 53 3.474 21.429 -3.903 347 HD12 ILE 53 1HD1 ILE 53 2.320 21.393 -5.241 348 HD13 ILE 53 2HD1 ILE 53 3.389 22.791 -5.056 349 H ALA 54 H ALA 54 1.193 20.832 0.274 350 HA ALA 54 HA ALA 54 -1.067 19.044 0.129 351 HB1 ALA 54 1HB ALA 54 0.946 19.144 2.412 352 HB2 ALA 54 2HB ALA 54 -0.149 17.798 1.975 353 HB3 ALA 54 3HB ALA 54 1.177 18.244 0.902 354 H LEU 55 H LEU 55 -0.294 21.808 2.237 355 HA LEU 55 HA LEU 55 -2.210 21.404 4.235 356 HB3 LEU 55 2HB LEU 55 -1.210 24.006 3.002 357 HG LEU 55 HG LEU 55 -1.313 24.857 5.350 358 HD11 LEU 55 1HD1 LEU 55 -2.947 25.314 3.387 359 HD12 LEU 55 2HD1 LEU 55 -3.374 25.827 5.014 360 HD13 LEU 55 3HD1 LEU 55 -4.079 24.336 4.303 361 HD21 LEU 55 3HD2 LEU 55 -2.736 23.885 6.991 362 HD22 LEU 55 1HD2 LEU 55 -1.628 22.617 6.429 363 HD23 LEU 55 2HD2 LEU 55 -3.290 22.631 5.860 364 H ASP 56 H ASP 56 -2.531 23.072 1.079 365 HA ASP 56 HA ASP 56 -5.208 24.062 1.335 366 HB3 ASP 56 2HB ASP 56 -3.377 23.305 -0.994 367 H GLN 57 H GLN 57 -3.771 21.049 0.084 368 HA GLN 57 HA GLN 57 -6.304 19.799 -0.626 369 HB3 GLN 57 2HB GLN 57 -5.057 17.993 -1.397 370 HG3 GLN 57 2HG GLN 57 -2.699 19.278 -2.102 371 HE21 GLN 57 1HE2 GLN 57 -3.026 17.764 -3.934 372 HE22 GLN 57 2HE2 GLN 57 -4.133 18.232 -5.211 373 H ILE 58 H ILE 58 -4.847 20.261 2.429 374 HA ILE 58 HA ILE 58 -6.117 17.843 3.580 375 HB ILE 58 HB ILE 58 -4.065 19.822 4.571 376 HG13 ILE 58 2HG1 ILE 58 -3.580 17.665 3.147 377 HG21 ILE 58 1HG2 ILE 58 -5.491 17.755 6.308 378 HG22 ILE 58 2HG2 ILE 58 -4.002 18.611 6.761 379 HG23 ILE 58 3HG2 ILE 58 -5.487 19.512 6.535 380 HD11 ILE 58 3HD1 ILE 58 -2.130 17.797 5.799 381 HD12 ILE 58 1HD1 ILE 58 -1.504 17.298 4.214 382 HD13 ILE 58 2HD1 ILE 58 -1.889 19.020 4.526 383 H GLN 59 H GLN 59 -6.149 21.424 4.083 384 HA GLN 59 HA GLN 59 -7.890 21.076 6.319 385 HB3 GLN 59 2HB GLN 59 -8.064 23.720 6.021 386 HG3 GLN 59 2HG GLN 59 -5.386 22.408 6.599 387 HE21 GLN 59 1HE2 GLN 59 -4.906 24.700 5.767 388 HE22 GLN 59 2HE2 GLN 59 -4.606 25.863 7.022 389 H GLY 60 H GLY 60 -8.976 20.416 3.362 390 HA2 GLY 60 1HA GLY 60 -11.212 20.149 2.743 391 HA3 GLY 60 2HA GLY 60 -11.716 21.373 3.915 392 H ASN 61 H ASN 61 -9.018 22.547 2.331 393 HA ASN 61 HA ASN 61 -10.625 24.512 0.935 394 HB3 ASN 61 2HB ASN 61 -8.511 25.653 0.523 395 HD21 ASN 61 1HD2 ASN 61 -6.856 26.535 2.285 396 HD22 ASN 61 2HD2 ASN 61 -7.388 26.385 3.948 397 H LYS 62 H LYS 62 -8.945 21.584 0.099 398 HA LYS 62 HA LYS 62 -9.708 21.852 -2.716 399 HB3 LYS 62 2HB LYS 62 -7.313 20.874 -3.314 400 HG3 LYS 62 2HG LYS 62 -6.131 22.861 -3.263 401 HD3 LYS 62 2HD LYS 62 -8.919 23.011 -4.224 402 HE3 LYS 62 2HE LYS 62 -7.191 25.505 -4.186 403 HZ1 LYS 62 3HZ LYS 62 -10.002 24.911 -4.915 404 HZ2 LYS 62 1HZ LYS 62 -8.802 25.414 -5.937 405 HZ3 LYS 62 2HZ LYS 62 -9.390 26.430 -4.798 406 H ASP 63 H ASP 63 -8.758 19.820 -3.751 407 HA ASP 63 HA ASP 63 -10.258 17.572 -2.548 408 HB3 ASP 63 2HB ASP 63 -10.417 16.876 -4.942 409 H PHE 64 H PHE 64 -8.881 15.690 -4.546 410 HA PHE 64 HA PHE 64 -6.431 15.309 -2.873 411 HB3 PHE 64 2HB PHE 64 -7.972 13.607 -2.288 412 HD1 PHE 64 1HD PHE 64 -7.497 12.843 -5.996 413 HD2 PHE 64 2HD PHE 64 -10.175 12.845 -2.612 414 HE1 PHE 64 1HE PHE 64 -9.298 11.957 -7.413 415 HE2 PHE 64 2HE PHE 64 -11.961 11.929 -4.042 416 HZ PHE 64 HZ PHE 64 -11.550 11.501 -6.443 417 HA PRO 65 HA PRO 65 -4.231 14.914 -6.771 418 HB3 PRO 65 2HB PRO 65 -2.273 15.026 -5.660 419 HG3 PRO 65 2HG PRO 65 -2.014 14.089 -3.459 420 HD3 PRO 65 2HD PRO 65 -3.956 15.392 -3.225 421 H GLU 66 H GLU 66 -3.652 13.330 -8.261 422 HA GLU 66 HA GLU 66 -5.535 11.011 -8.136 423 HB3 GLU 66 2HB GLU 66 -5.614 11.271 -10.595 424 HG3 GLU 66 2HG GLU 66 -6.230 13.976 -9.380 425 H ILE 67 H ILE 67 -4.842 9.348 -10.142 426 HA ILE 67 HA ILE 67 -2.059 8.550 -9.701 427 HB ILE 67 HB ILE 67 -2.698 6.254 -9.189 428 HG13 ILE 67 2HG1 ILE 67 -4.910 6.166 -10.266 429 HG21 ILE 67 1HG2 ILE 67 -2.246 7.885 -7.345 430 HG22 ILE 67 2HG2 ILE 67 -3.997 8.112 -7.155 431 HG23 ILE 67 3HG2 ILE 67 -3.256 6.521 -6.866 432 HD11 ILE 67 3HD1 ILE 67 -6.053 4.763 -8.811 433 HD12 ILE 67 1HD1 ILE 67 -4.344 4.553 -8.388 434 HD13 ILE 67 2HD1 ILE 67 -5.405 5.560 -7.362 435 H GLN 68 H GLN 68 -1.253 7.234 -11.306 436 HA GLN 68 HA GLN 68 -2.680 7.434 -13.877 437 HB3 GLN 68 2HB GLN 68 -0.408 6.807 -14.790 438 HG3 GLN 68 2HG GLN 68 0.994 8.640 -13.687 439 HE21 GLN 68 1HE2 GLN 68 -1.822 10.515 -13.481 440 HE22 GLN 68 2HE2 GLN 68 -1.830 11.062 -15.141 441 H LEU 69 H LEU 69 -3.441 5.459 -11.829 442 HA LEU 69 HA LEU 69 -2.285 2.934 -12.769 443 HB3 LEU 69 2HB LEU 69 -4.406 2.445 -10.885 444 HG LEU 69 HG LEU 69 -1.417 2.567 -10.277 445 HD11 LEU 69 1HD1 LEU 69 -2.964 2.440 -8.347 446 HD12 LEU 69 2HD1 LEU 69 -2.112 0.900 -8.532 447 HD13 LEU 69 3HD1 LEU 69 -3.789 1.068 -9.074 448 HD21 LEU 69 3HD2 LEU 69 -1.401 0.094 -10.719 449 HD22 LEU 69 1HD2 LEU 69 -1.589 1.042 -12.172 450 HD23 LEU 69 2HD2 LEU 69 -3.025 0.269 -11.463 451 H ASP 70 H ASP 70 -3.479 1.175 -13.396 452 HA ASP 70 HA ASP 70 -5.534 1.778 -15.429 453 HB3 ASP 70 2HB ASP 70 -4.980 -0.738 -15.961 454 H ASN 71 H ASN 71 -7.029 -0.430 -15.769 455 HA ASN 71 HA ASN 71 -8.626 -0.529 -13.268 456 HB3 ASN 71 2HB ASN 71 -9.418 -1.770 -15.866 457 HD21 ASN 71 1HD2 ASN 71 -10.292 -3.435 -14.269 458 HD22 ASN 71 2HD2 ASN 71 -11.683 -2.987 -13.306 459 H ILE 72 H ILE 72 -8.111 -2.011 -11.988 460 HA ILE 72 HA ILE 72 -6.921 -4.613 -12.831 461 HB ILE 72 HB ILE 72 -5.898 -2.652 -10.795 462 HG13 ILE 72 2HG1 ILE 72 -5.240 -2.363 -13.217 463 HG21 ILE 72 1HG2 ILE 72 -4.881 -5.485 -11.225 464 HG22 ILE 72 2HG2 ILE 72 -4.249 -4.288 -10.073 465 HG23 ILE 72 3HG2 ILE 72 -5.850 -4.966 -9.825 466 HD11 ILE 72 3HD1 ILE 72 -3.660 -1.787 -11.409 467 HD12 ILE 72 1HD1 ILE 72 -2.851 -3.357 -11.652 468 HD13 ILE 72 2HD1 ILE 72 -2.907 -2.161 -12.966 469 H ASP 73 H ASP 73 -7.849 -6.249 -11.944 470 HA ASP 73 HA ASP 73 -9.997 -6.082 -9.990 471 HB3 ASP 73 2HB ASP 73 -9.075 -8.745 -10.015 472 H TYR 74 H TYR 74 -9.306 -5.278 -7.981 473 HA TYR 74 HA TYR 74 -6.860 -6.368 -6.760 474 HB3 TYR 74 2HB TYR 74 -7.626 -5.068 -4.785 475 HD1 TYR 74 1HD TYR 74 -5.418 -4.650 -6.393 476 HD2 TYR 74 2HD TYR 74 -9.167 -2.531 -6.632 477 HE1 TYR 74 1HE TYR 74 -4.339 -2.907 -7.704 478 HE2 TYR 74 2HE TYR 74 -8.072 -0.699 -7.864 479 HH TYR 74 HH TYR 74 -5.970 0.118 -8.781 480 H ASN 75 H ASN 75 -10.153 -7.357 -7.112 481 HA ASN 75 HA ASN 75 -10.509 -8.457 -4.526 482 HB3 ASN 75 2HB ASN 75 -12.186 -9.673 -6.656 483 HD21 ASN 75 1HD2 ASN 75 -12.012 -10.066 -3.731 484 HD22 ASN 75 2HD2 ASN 75 -13.465 -9.370 -3.062 485 H ASN 76 H ASN 76 -8.381 -9.726 -6.789 486 HA ASN 76 HA ASN 76 -9.024 -12.516 -6.220 487 HB3 ASN 76 2HB ASN 76 -8.859 -11.653 -8.578 488 HD21 ASN 76 1HD2 ASN 76 -7.675 -9.743 -9.112 489 HD22 ASN 76 2HD2 ASN 76 -5.953 -9.687 -9.010 490 H TYR 77 H TYR 77 -6.935 -10.137 -4.989 491 HA TYR 77 HA TYR 77 -4.740 -12.035 -4.421 492 HB3 TYR 77 2HB TYR 77 -3.540 -10.138 -3.608 493 HD1 TYR 77 2HD TYR 77 -2.508 -11.098 -5.783 494 HD2 TYR 77 1HD TYR 77 -5.480 -7.989 -5.761 495 HE1 TYR 77 2HE TYR 77 -2.136 -10.756 -8.200 496 HE2 TYR 77 1HE TYR 77 -5.022 -7.563 -8.156 497 HH TYR 77 HH TYR 77 -3.121 -9.821 -10.131 498 H ASP 78 H ASP 78 -4.387 -12.898 -2.335 499 HA ASP 78 HA ASP 78 -6.561 -12.533 -0.391 500 HB3 ASP 78 2HB ASP 78 -4.029 -14.170 0.031 501 H LEU 79 H LEU 79 -3.425 -11.287 -1.046 502 HA LEU 79 HA LEU 79 -3.478 -9.610 1.409 503 HB3 LEU 79 2HB LEU 79 -0.999 -10.842 0.185 504 HG LEU 79 HG LEU 79 -1.296 -10.471 3.158 505 HD11 LEU 79 1HD1 LEU 79 1.128 -10.294 3.004 506 HD12 LEU 79 2HD1 LEU 79 1.043 -10.446 1.240 507 HD13 LEU 79 3HD1 LEU 79 0.508 -11.786 2.277 508 HD21 LEU 79 3HD2 LEU 79 -1.752 -8.185 2.492 509 HD22 LEU 79 1HD2 LEU 79 -0.377 -8.203 1.350 510 HD23 LEU 79 2HD2 LEU 79 -0.118 -8.306 3.107 511 H ILE 80 H ILE 80 -2.998 -7.412 0.899 512 HA ILE 80 HA ILE 80 -1.600 -6.818 -1.668 513 HB ILE 80 HB ILE 80 -4.025 -5.310 -0.643 514 HG13 ILE 80 2HG1 ILE 80 -4.711 -7.347 -1.707 515 HG21 ILE 80 1HG2 ILE 80 -3.721 -3.852 -2.591 516 HG22 ILE 80 2HG2 ILE 80 -2.270 -3.813 -1.618 517 HG23 ILE 80 3HG2 ILE 80 -2.289 -4.782 -3.105 518 HD11 ILE 80 3HD1 ILE 80 -5.919 -6.692 -3.664 519 HD12 ILE 80 1HD1 ILE 80 -5.924 -5.303 -2.556 520 HD13 ILE 80 2HD1 ILE 80 -4.837 -5.331 -3.974 521 H LEU 81 H LEU 81 0.362 -6.177 -0.990 522 HA LEU 81 HA LEU 81 0.571 -4.482 1.460 523 HB3 LEU 81 2HB LEU 81 3.004 -4.547 0.986 524 HG LEU 81 HG LEU 81 1.396 -6.494 2.187 525 HD11 LEU 81 1HD1 LEU 81 3.397 -7.852 0.343 526 HD12 LEU 81 2HD1 LEU 81 1.633 -7.986 0.245 527 HD13 LEU 81 3HD1 LEU 81 2.502 -8.641 1.651 528 HD21 LEU 81 3HD2 LEU 81 3.333 -5.368 3.165 529 HD22 LEU 81 1HD2 LEU 81 4.431 -6.375 2.178 530 HD23 LEU 81 2HD2 LEU 81 3.378 -7.118 3.407 531 H ILE 82 H ILE 82 1.244 -2.349 1.378 532 HA ILE 82 HA ILE 82 1.515 -1.080 -1.258 533 HB ILE 82 HB ILE 82 -0.296 -0.123 0.973 534 HG13 ILE 82 2HG1 ILE 82 -1.300 -2.056 -0.124 535 HG21 ILE 82 1HG2 ILE 82 -0.020 1.084 -1.795 536 HG22 ILE 82 2HG2 ILE 82 -1.088 1.622 -0.483 537 HG23 ILE 82 3HG2 ILE 82 0.641 1.784 -0.294 538 HD11 ILE 82 3HD1 ILE 82 -3.271 -1.357 -1.175 539 HD12 ILE 82 1HD1 ILE 82 -2.933 -0.164 0.089 540 HD13 ILE 82 2HD1 ILE 82 -2.598 0.218 -1.619 541 H GLY 83 H GLY 83 2.624 1.076 -1.049 542 HA2 GLY 83 1HA GLY 83 4.167 1.515 1.417 543 HA3 GLY 83 2HA GLY 83 5.050 1.169 -0.078 544 H SER 84 H SER 84 4.816 3.765 1.568 545 HA SER 84 HA SER 84 4.406 5.497 -0.778 546 HB3 SER 84 2HB SER 84 2.268 5.782 -0.225 547 HG SER 84 HG SER 84 2.768 5.433 2.551 548 HA PRO 85 HA PRO 85 7.665 7.782 1.335 549 HB3 PRO 85 2HB PRO 85 8.082 8.772 -0.664 550 HG3 PRO 85 2HG PRO 85 6.384 9.262 -2.193 551 HD3 PRO 85 2HD PRO 85 5.737 7.124 -1.694 552 H VAL 86 H VAL 86 7.953 9.713 2.737 553 HA VAL 86 HA VAL 86 5.474 10.920 3.820 554 HB VAL 86 HB VAL 86 7.951 10.299 5.476 555 HG11 VAL 86 1HG1 VAL 86 6.590 12.306 6.092 556 HG12 VAL 86 2HG1 VAL 86 5.163 11.279 6.233 557 HG13 VAL 86 3HG1 VAL 86 6.539 11.048 7.339 558 HG21 VAL 86 3HG2 VAL 86 6.839 8.189 5.014 559 HG22 VAL 86 1HG2 VAL 86 6.533 8.661 6.685 560 HG23 VAL 86 2HG2 VAL 86 5.258 8.874 5.460 561 H TRP 87 H TRP 87 5.499 13.064 3.589 562 HA TRP 87 HA TRP 87 7.846 14.386 2.538 563 HB3 TRP 87 2HB TRP 87 5.533 16.114 3.129 564 HD1 TRP 87 HD TRP 87 7.082 17.787 1.607 565 HE1 TRP 87 1HE TRP 87 7.616 17.901 -0.875 566 HE3 TRP 87 3HE TRP 87 5.065 13.339 0.175 567 HZ2 TRP 87 2HZ TRP 87 7.149 16.264 -3.261 568 HZ3 TRP 87 3HZ TRP 87 4.832 12.787 -2.233 569 HH2 TRP 87 HH TRP 87 5.909 14.222 -3.959 570 H SER 88 H SER 88 7.464 16.884 3.656 571 HA SER 88 HA SER 88 8.500 16.960 6.305 572 HB3 SER 88 2HB SER 88 7.593 19.320 6.144 573 HG SER 88 HG SER 88 9.129 18.629 3.827 574 H GLY 89 H GLY 89 7.339 15.527 7.354 575 HA2 GLY 89 1HA GLY 89 5.969 15.497 9.376 576 HA3 GLY 89 2HA GLY 89 4.790 16.542 8.600 577 H TYR 90 H TYR 90 4.154 15.347 6.239 578 HA TYR 90 HA TYR 90 2.790 12.926 7.304 579 HB3 TYR 90 2HB TYR 90 0.721 13.930 6.849 580 HD1 TYR 90 2HD TYR 90 1.659 14.238 9.375 581 HD2 TYR 90 1HD TYR 90 1.607 17.316 6.354 582 HE1 TYR 90 2HE TYR 90 1.813 15.968 11.135 583 HE2 TYR 90 1HE TYR 90 1.826 19.042 8.106 584 HH TYR 90 HH TYR 90 1.758 18.231 11.591 585 HA PRO 91 HA PRO 91 3.120 11.525 3.006 586 HB3 PRO 91 2HB PRO 91 2.117 9.585 3.312 587 HG3 PRO 91 2HG PRO 91 0.687 9.246 5.127 588 HD3 PRO 91 2HD PRO 91 2.120 10.626 6.305 589 H ALA 92 H ALA 92 2.102 11.810 0.942 590 HA ALA 92 HA ALA 92 1.126 14.565 0.540 591 HB1 ALA 92 1HB ALA 92 2.799 14.439 -0.931 592 HB2 ALA 92 2HB ALA 92 2.961 12.690 -0.751 593 HB3 ALA 92 3HB ALA 92 1.824 13.351 -1.908 594 H THR 93 H THR 93 -0.697 12.438 1.498 595 HA THR 93 HA THR 93 -2.378 11.018 0.994 596 HB THR 93 HB THR 93 -3.672 12.624 1.506 597 HG1 THR 93 1HG THR 93 -5.204 13.228 -0.170 598 HG21 THR 93 3HG2 THR 93 -2.879 14.447 -0.812 599 HG22 THR 93 1HG2 THR 93 -2.354 14.623 0.885 600 HG23 THR 93 2HG2 THR 93 -4.041 14.843 0.466 601 HA PRO 94 HA PRO 94 -1.291 9.678 -3.299 602 HB3 PRO 94 2HB PRO 94 0.941 9.179 -2.909 603 HG3 PRO 94 2HG PRO 94 1.720 8.563 -0.737 604 HD3 PRO 94 2HD PRO 94 0.621 10.591 -0.435 605 H ILE 95 H ILE 95 -1.999 7.782 -0.328 606 HA ILE 95 HA ILE 95 -2.905 5.551 -1.983 607 HB ILE 95 HB ILE 95 -3.149 5.813 1.034 608 HG13 ILE 95 2HG1 ILE 95 -1.079 4.370 1.120 609 HG21 ILE 95 1HG2 ILE 95 -3.191 3.411 -0.836 610 HG22 ILE 95 2HG2 ILE 95 -3.080 3.321 0.933 611 HG23 ILE 95 3HG2 ILE 95 -4.508 4.019 0.188 612 HD11 ILE 95 3HD1 ILE 95 -0.350 5.514 -1.595 613 HD12 ILE 95 1HD1 ILE 95 0.542 4.354 -0.629 614 HD13 ILE 95 2HD1 ILE 95 -0.959 3.860 -1.422 615 H LYS 96 H LYS 96 -4.384 8.368 -0.528 616 HA LYS 96 HA LYS 96 -6.930 7.714 0.156 617 HB3 LYS 96 2HB LYS 96 -5.824 10.145 -1.352 618 HG3 LYS 96 2HG LYS 96 -8.325 10.173 -1.188 619 HD3 LYS 96 2HD LYS 96 -7.664 10.005 1.790 620 HE3 LYS 96 2HE LYS 96 -9.055 12.062 1.233 621 HZ1 LYS 96 3HZ LYS 96 -11.172 10.072 0.797 622 HZ2 LYS 96 1HZ LYS 96 -10.500 10.913 -0.461 623 HZ3 LYS 96 2HZ LYS 96 -11.301 11.695 0.751 624 H THR 97 H THR 97 -5.906 8.703 -3.189 625 HA THR 97 HA THR 97 -8.547 8.417 -4.105 626 HB THR 97 HB THR 97 -5.934 8.615 -5.690 627 HG1 THR 97 1HG THR 97 -6.164 10.843 -5.213 628 HG21 THR 97 3HG2 THR 97 -8.808 9.554 -6.164 629 HG22 THR 97 1HG2 THR 97 -7.912 8.366 -7.136 630 HG23 THR 97 2HG2 THR 97 -7.423 10.059 -7.164 631 H LEU 98 H LEU 98 -5.965 6.058 -3.954 632 HA LEU 98 HA LEU 98 -7.132 4.173 -5.894 633 HB3 LEU 98 2HB LEU 98 -4.881 4.029 -3.842 634 HG LEU 98 HG LEU 98 -5.798 1.741 -4.072 635 HD11 LEU 98 1HD1 LEU 98 -5.238 2.107 -7.053 636 HD12 LEU 98 2HD1 LEU 98 -6.832 1.870 -6.313 637 HD13 LEU 98 3HD1 LEU 98 -5.640 0.577 -6.248 638 HD21 LEU 98 3HD2 LEU 98 -3.683 0.693 -4.746 639 HD22 LEU 98 1HD2 LEU 98 -3.378 2.135 -3.780 640 HD23 LEU 98 2HD2 LEU 98 -3.164 2.189 -5.545 641 H LEU 99 H LEU 99 -6.833 4.525 -2.323 642 HA LEU 99 HA LEU 99 -8.121 2.101 -1.624 643 HB3 LEU 99 2HB LEU 99 -6.677 3.800 -0.330 644 HG LEU 99 HG LEU 99 -8.684 5.536 -0.230 645 HD11 LEU 99 1HD1 LEU 99 -9.801 3.238 1.117 646 HD12 LEU 99 2HD1 LEU 99 -10.567 4.766 0.689 647 HD13 LEU 99 3HD1 LEU 99 -9.722 4.634 2.235 648 HD21 LEU 99 3HD2 LEU 99 -7.896 6.263 1.951 649 HD22 LEU 99 1HD2 LEU 99 -6.538 5.724 0.973 650 HD23 LEU 99 2HD2 LEU 99 -7.150 4.664 2.229 651 H ASP 100 H ASP 100 -9.517 5.264 -2.454 652 HA ASP 100 HA ASP 100 -12.195 4.639 -1.720 653 HB3 ASP 100 2HB ASP 100 -11.294 6.336 -4.075 654 H GLN 101 H GLN 101 -10.364 3.938 -4.748 655 HA GLN 101 HA GLN 101 -12.601 2.953 -6.275 656 HB3 GLN 101 2HB GLN 101 -10.846 1.819 -7.624 657 HG3 GLN 101 2HG GLN 101 -10.203 4.734 -7.049 658 HE21 GLN 101 1HE2 GLN 101 -9.180 5.858 -9.032 659 HE22 GLN 101 2HE2 GLN 101 -8.167 4.891 -10.060 660 H MET 102 H MET 102 -10.129 1.423 -4.221 661 HA MET 102 HA MET 102 -11.256 -1.220 -4.722 662 HB3 MET 102 2HB MET 102 -8.918 -0.738 -5.021 663 HG3 MET 102 2HG MET 102 -8.775 0.810 -2.991 664 HE1 MET 102 3HE MET 102 -7.439 -2.982 -0.617 665 HE2 MET 102 1HE MET 102 -8.188 -3.127 -2.207 666 HE3 MET 102 2HE MET 102 -6.588 -2.387 -2.053 667 H LYS 103 H LYS 103 -12.227 0.955 -2.499 668 HA LYS 103 HA LYS 103 -11.712 0.155 -0.028 669 HB3 LYS 103 2HB LYS 103 -14.070 1.475 -1.339 670 HG3 LYS 103 2HG LYS 103 -15.220 0.586 0.572 671 HD3 LYS 103 2HD LYS 103 -13.763 0.298 2.456 672 HE3 LYS 103 2HE LYS 103 -12.960 2.642 3.494 673 HZ1 LYS 103 3HZ LYS 103 -10.785 2.067 2.809 674 HZ2 LYS 103 1HZ LYS 103 -11.331 1.178 1.536 675 HZ3 LYS 103 2HZ LYS 103 -11.615 0.681 3.090 676 H ASN 104 H ASN 104 -14.055 -1.472 -1.953 677 HA ASN 104 HA ASN 104 -15.380 -2.932 0.130 678 HB3 ASN 104 2HB ASN 104 -16.321 -2.604 -2.157 679 HD21 ASN 104 1HD2 ASN 104 -15.093 -2.143 -4.109 680 HD22 ASN 104 2HD2 ASN 104 -14.179 -3.390 -4.940 681 H TYR 105 H TYR 105 -12.149 -3.376 -0.918 682 HA TYR 105 HA TYR 105 -11.845 -6.094 -1.319 683 HB3 TYR 105 2HB TYR 105 -9.960 -4.091 -0.005 684 HD1 TYR 105 2HD TYR 105 -9.411 -6.574 -2.732 685 HD2 TYR 105 1HD TYR 105 -8.547 -5.487 1.361 686 HE1 TYR 105 2HE TYR 105 -7.688 -8.367 -2.605 687 HE2 TYR 105 1HE TYR 105 -6.828 -7.277 1.468 688 HH TYR 105 HH TYR 105 -6.489 -9.684 -1.082 689 H ARG 106 H ARG 106 -11.602 -7.919 -0.226 690 HA ARG 106 HA ARG 106 -11.380 -7.905 2.740 691 HB3 ARG 106 2HB ARG 106 -12.399 -10.211 2.561 692 HG3 ARG 106 2HG ARG 106 -14.725 -9.526 1.804 693 HD3 ARG 106 2HD ARG 106 -13.275 -7.795 3.850 694 HE ARG 106 HE ARG 106 -15.188 -6.627 3.889 695 HH11 ARG 106 1HH1 ARG 106 -16.181 -10.029 3.610 696 HH12 ARG 106 2HH1 ARG 106 -17.866 -9.689 3.788 697 HH21 ARG 106 1HH2 ARG 106 -17.354 -6.243 4.503 698 HH22 ARG 106 2HH2 ARG 106 -18.532 -7.508 4.380 699 H GLY 107 H GLY 107 -9.592 -8.953 3.529 700 HA2 GLY 107 1HA GLY 107 -7.985 -10.946 2.936 701 HA3 GLY 107 2HA GLY 107 -7.526 -9.840 1.627 702 H GLU 108 H GLU 108 -5.439 -10.110 2.898 703 HA GLU 108 HA GLU 108 -5.164 -8.452 5.351 704 HB3 GLU 108 2HB GLU 108 -2.730 -9.116 5.007 705 HG3 GLU 108 2HG GLU 108 -4.612 -11.490 5.245 706 H VAL 109 H VAL 109 -4.093 -6.445 5.353 707 HA VAL 109 HA VAL 109 -2.971 -5.492 2.809 708 HB VAL 109 HB VAL 109 -4.780 -3.634 4.367 709 HG11 VAL 109 1HG1 VAL 109 -4.780 -2.372 2.351 710 HG12 VAL 109 2HG1 VAL 109 -3.119 -3.010 2.491 711 HG13 VAL 109 3HG1 VAL 109 -4.249 -3.765 1.374 712 HG21 VAL 109 3HG2 VAL 109 -6.640 -4.028 2.799 713 HG22 VAL 109 1HG2 VAL 109 -5.770 -5.411 2.113 714 HG23 VAL 109 2HG2 VAL 109 -6.347 -5.452 3.802 715 H ALA 110 H ALA 110 -0.849 -4.658 3.306 716 HA ALA 110 HA ALA 110 -0.564 -3.367 5.998 717 HB1 ALA 110 1HB ALA 110 1.607 -4.760 4.417 718 HB2 ALA 110 2HB ALA 110 1.741 -4.025 6.034 719 HB3 ALA 110 3HB ALA 110 0.765 -5.480 5.792 720 H SER 111 H SER 111 0.961 -1.570 6.064 721 HA SER 111 HA SER 111 1.499 -0.235 3.458 722 HB3 SER 111 2HB SER 111 -0.372 0.976 3.916 723 HG SER 111 HG SER 111 -1.295 0.199 5.694 724 H PHE 112 H PHE 112 3.777 -0.342 3.528 725 HA PHE 112 HA PHE 112 5.043 0.576 6.071 726 HB3 PHE 112 2HB PHE 112 6.122 -1.320 4.801 727 HD1 PHE 112 2HD PHE 112 5.455 -1.572 2.392 728 HD2 PHE 112 1HD PHE 112 8.265 1.435 3.686 729 HE1 PHE 112 2HE PHE 112 6.203 -1.234 0.078 730 HE2 PHE 112 1HE PHE 112 8.939 1.817 1.325 731 HZ PHE 112 HZ PHE 112 7.932 0.422 -0.486 732 H PHE 113 H PHE 113 6.684 2.373 5.797 733 HA PHE 113 HA PHE 113 6.160 4.160 3.525 734 HB3 PHE 113 2HB PHE 113 6.283 6.111 5.168 735 HD1 PHE 113 1HD PHE 113 3.703 3.533 6.207 736 HD2 PHE 113 2HD PHE 113 4.537 7.194 4.064 737 HE1 PHE 113 1HE PHE 113 1.286 3.884 5.865 738 HE2 PHE 113 2HE PHE 113 2.101 7.517 3.731 739 HZ PHE 113 HZ PHE 113 0.496 5.874 4.614 740 H THR 114 H THR 114 7.942 5.846 3.353 741 HA THR 114 HA THR 114 10.462 4.957 4.690 742 HB THR 114 HB THR 114 11.487 5.876 2.435 743 HG1 THR 114 1HG THR 114 10.029 6.351 1.027 744 HG21 THR 114 3HG2 THR 114 11.759 3.582 3.178 745 HG22 THR 114 1HG2 THR 114 11.353 3.582 1.455 746 HG23 THR 114 2HG2 THR 114 10.117 3.163 2.666 747 H SER 115 H SER 115 11.684 6.584 5.612 748 HA SER 115 HA SER 115 11.030 9.387 5.090 749 HB3 SER 115 2HB SER 115 9.340 8.774 6.701 750 HG SER 115 HG SER 115 9.798 7.092 7.809 751 H ALA 116 H ALA 116 12.459 10.748 6.583 752 HA ALA 116 HA ALA 116 15.238 9.760 6.515 753 HB1 ALA 116 1HB ALA 116 14.677 11.967 5.547 754 HB2 ALA 116 2HB ALA 116 14.053 12.509 7.132 755 HB3 ALA 116 3HB ALA 116 15.769 12.118 6.933 756 H GLY 117 H GLY 117 13.162 8.766 8.515 757 HA2 GLY 117 1HA GLY 117 13.099 8.270 10.763 758 HA3 GLY 117 2HA GLY 117 14.732 8.929 10.864 759 H THR 118 H THR 118 12.155 11.087 9.692 760 HA THR 118 HA THR 118 11.937 12.290 12.402 761 HB THR 118 HB THR 118 11.431 14.401 11.000 762 HG1 THR 118 1HG THR 118 12.803 14.437 9.083 763 HG21 THR 118 3HG2 THR 118 13.781 15.035 11.087 764 HG22 THR 118 1HG2 THR 118 14.285 13.335 11.088 765 HG23 THR 118 2HG2 THR 118 13.417 14.026 12.483 766 H ASN 119 H ASN 119 9.907 13.364 12.828 767 HA ASN 119 HA ASN 119 7.732 13.292 13.231 768 HB3 ASN 119 2HB ASN 119 6.311 13.852 11.347 769 HD21 ASN 119 1HD2 ASN 119 8.612 14.929 9.277 770 HD22 ASN 119 2HD2 ASN 119 8.884 16.510 9.992 771 H HIS 120 H HIS 120 8.837 10.578 13.323 772 HA HIS 120 HA HIS 120 7.422 8.890 11.624 773 HB3 HIS 120 2HB HIS 120 9.551 8.349 12.900 774 HD1 HIS 120 1HD HIS 120 10.595 8.469 15.232 775 HD2 HIS 120 2HD HIS 120 6.657 6.995 15.220 776 HE1 HIS 120 1HE HIS 120 10.053 7.859 17.647 777 H LYS 121 H LYS 121 6.414 10.331 14.668 778 HA LYS 121 HA LYS 121 4.244 8.391 15.067 779 HB3 LYS 121 2HB LYS 121 3.595 10.956 16.227 780 HG3 LYS 121 2HG LYS 121 4.094 9.909 18.354 781 HD3 LYS 121 2HD LYS 121 2.887 7.736 16.587 782 HE3 LYS 121 2HE LYS 121 1.573 7.167 18.502 783 HZ1 LYS 121 3HZ LYS 121 4.316 7.571 19.516 784 HZ2 LYS 121 1HZ LYS 121 3.916 6.327 18.542 785 HZ3 LYS 121 2HZ LYS 121 3.224 6.455 20.034 786 H ALA 122 H ALA 122 4.628 11.517 13.456 787 HA ALA 122 HA ALA 122 1.870 12.072 13.149 788 HB1 ALA 122 1HB ALA 122 2.537 13.720 11.480 789 HB2 ALA 122 2HB ALA 122 3.636 13.809 12.866 790 HB3 ALA 122 3HB ALA 122 4.152 13.017 11.353 791 H TYR 123 H TYR 123 4.225 10.444 10.940 792 HA TYR 123 HA TYR 123 2.533 10.288 8.757 793 HB3 TYR 123 2HB TYR 123 5.050 9.572 9.141 794 HD1 TYR 123 2HD TYR 123 3.095 6.646 7.805 795 HD2 TYR 123 1HD TYR 123 6.132 8.051 10.453 796 HE1 TYR 123 2HE TYR 123 3.756 4.312 8.289 797 HE2 TYR 123 1HE TYR 123 6.866 5.715 10.920 798 HH TYR 123 HH TYR 123 5.557 2.952 9.147 799 H VAL 124 H VAL 124 2.864 7.892 11.387 800 HA VAL 124 HA VAL 124 1.117 5.964 10.383 801 HB VAL 124 HB VAL 124 1.881 6.675 13.255 802 HG11 VAL 124 1HG1 VAL 124 -0.042 4.964 13.105 803 HG12 VAL 124 2HG1 VAL 124 1.154 3.850 12.386 804 HG13 VAL 124 3HG1 VAL 124 1.407 4.496 14.004 805 HG21 VAL 124 3HG2 VAL 124 3.848 6.250 11.857 806 HG22 VAL 124 1HG2 VAL 124 3.624 4.912 12.978 807 HG23 VAL 124 2HG2 VAL 124 3.137 4.725 11.290 808 H SER 125 H SER 125 0.516 8.656 12.757 809 HA SER 125 HA SER 125 -2.234 8.001 13.114 810 HB3 SER 125 2HB SER 125 -2.272 10.062 14.407 811 HG SER 125 HG SER 125 -0.481 9.583 15.741 812 H HIS 126 H HIS 126 -0.633 10.479 10.962 813 HA HIS 126 HA HIS 126 -3.011 11.610 9.973 814 HB3 HIS 126 2HB HIS 126 -1.375 12.237 8.089 815 HD1 HIS 126 1HD HIS 126 -0.297 12.566 11.869 816 HD2 HIS 126 2HD HIS 126 -1.818 14.553 8.535 817 HE1 HIS 126 1HE HIS 126 -0.727 14.963 12.624 818 H PHE 127 H PHE 127 -1.014 8.807 8.866 819 HA PHE 127 HA PHE 127 -2.414 8.388 6.429 820 HB3 PHE 127 2HB PHE 127 -0.901 6.522 8.273 821 HD1 PHE 127 2HD PHE 127 -1.818 6.572 4.585 822 HD2 PHE 127 1HD PHE 127 -1.802 4.369 8.298 823 HE1 PHE 127 2HE PHE 127 -2.511 4.505 3.382 824 HE2 PHE 127 1HE PHE 127 -2.509 2.321 7.076 825 HZ PHE 127 HZ PHE 127 -2.829 2.395 4.626 826 H ASN 128 H ASN 128 -2.915 7.047 9.717 827 HA ASN 128 HA ASN 128 -5.036 5.354 9.133 828 HB3 ASN 128 2HB ASN 128 -5.826 6.054 11.587 829 HD21 ASN 128 1HD2 ASN 128 -2.336 5.360 11.461 830 HD22 ASN 128 2HD2 ASN 128 -2.527 3.655 11.731 831 H GLU 129 H GLU 129 -5.325 8.828 10.062 832 HA GLU 129 HA GLU 129 -8.137 8.937 10.051 833 HB3 GLU 129 2HB GLU 129 -7.727 11.374 9.284 834 HG3 GLU 129 2HG GLU 129 -6.154 10.642 11.758 835 H TRP 130 H TRP 130 -5.935 8.981 7.282 836 HA TRP 130 HA TRP 130 -8.083 9.858 5.452 837 HB3 TRP 130 2HB TRP 130 -6.018 9.891 3.858 838 HD1 TRP 130 HD TRP 130 -5.799 11.557 7.356 839 HE1 TRP 130 1HE TRP 130 -6.082 14.104 7.076 840 HE3 TRP 130 3HE TRP 130 -6.256 11.760 2.281 841 HZ2 TRP 130 2HZ TRP 130 -6.251 15.981 4.928 842 HZ3 TRP 130 3HZ TRP 130 -6.710 13.931 1.172 843 HH2 TRP 130 HH TRP 130 -6.734 16.013 2.478 844 H ALA 131 H ALA 131 -6.792 6.935 6.562 845 HA ALA 131 HA ALA 131 -7.584 5.505 4.096 846 HB1 ALA 131 1HB ALA 131 -5.123 5.865 4.077 847 HB2 ALA 131 2HB ALA 131 -5.012 5.035 5.649 848 HB3 ALA 131 3HB ALA 131 -5.549 4.148 4.208 849 H ASP 132 H ASP 132 -8.674 5.954 6.938 850 HA ASP 132 HA ASP 132 -8.794 3.493 8.217 851 HB3 ASP 132 2HB ASP 132 -11.016 5.556 8.107 852 H GLY 133 H GLY 133 -10.156 1.842 7.913 853 HA2 GLY 133 1HA GLY 133 -12.313 0.954 7.184 854 HA3 GLY 133 2HA GLY 133 -12.249 1.959 5.763 855 H LEU 134 H LEU 134 -9.298 0.029 6.545 856 HA LEU 134 HA LEU 134 -10.411 -2.319 5.150 857 HB3 LEU 134 2HB LEU 134 -8.153 -2.676 4.090 858 HG LEU 134 HG LEU 134 -9.607 -0.156 3.227 859 HD11 LEU 134 1HD1 LEU 134 -7.523 -1.652 1.651 860 HD12 LEU 134 2HD1 LEU 134 -7.182 -0.239 2.664 861 HD13 LEU 134 3HD1 LEU 134 -8.304 -0.088 1.295 862 HD21 LEU 134 3HD2 LEU 134 -10.976 -2.172 2.900 863 HD22 LEU 134 1HD2 LEU 134 -9.616 -3.006 2.140 864 HD23 LEU 134 2HD2 LEU 134 -10.371 -1.620 1.332 865 H ASN 135 H ASN 135 -9.069 -4.219 5.639 866 HA ASN 135 HA ASN 135 -8.365 -4.438 8.437 867 HB3 ASN 135 2HB ASN 135 -8.184 -6.238 6.019 868 HD21 ASN 135 1HD2 ASN 135 -7.062 -8.089 6.159 869 HD22 ASN 135 2HD2 ASN 135 -6.474 -8.841 7.627 870 H VAL 136 H VAL 136 -6.617 -3.060 8.874 871 HA VAL 136 HA VAL 136 -4.151 -3.282 7.306 872 HB VAL 136 HB VAL 136 -4.819 -1.648 9.791 873 HG11 VAL 136 1HG1 VAL 136 -2.390 -2.070 9.706 874 HG12 VAL 136 2HG1 VAL 136 -2.347 -1.588 7.992 875 HG13 VAL 136 3HG1 VAL 136 -2.745 -0.400 9.247 876 HG21 VAL 136 3HG2 VAL 136 -4.706 0.238 8.110 877 HG22 VAL 136 1HG2 VAL 136 -4.572 -0.979 6.831 878 HG23 VAL 136 2HG2 VAL 136 -6.051 -0.873 7.819 879 H ILE 137 H ILE 137 -2.749 -4.967 7.643 880 HA ILE 137 HA ILE 137 -2.785 -6.388 10.229 881 HB ILE 137 HB ILE 137 -1.308 -7.972 9.061 882 HG13 ILE 137 2HG1 ILE 137 -0.590 -6.038 7.360 883 HG21 ILE 137 1HG2 ILE 137 -3.057 -8.858 7.566 884 HG22 ILE 137 2HG2 ILE 137 -3.736 -8.322 9.089 885 HG23 ILE 137 3HG2 ILE 137 -3.942 -7.324 7.633 886 HD11 ILE 137 3HD1 ILE 137 0.038 -7.726 5.668 887 HD12 ILE 137 1HD1 ILE 137 0.463 -8.203 7.328 888 HD13 ILE 137 2HD1 ILE 137 -0.943 -8.933 6.521 889 H GLY 138 H GLY 138 -0.986 -3.741 8.905 890 HA2 GLY 138 1HA GLY 138 0.324 -3.224 11.267 891 HA3 GLY 138 2HA GLY 138 1.459 -4.215 10.337 892 H VAL 139 H VAL 139 1.746 -1.365 11.089 893 HA VAL 139 HA VAL 139 2.338 -0.363 8.386 894 HB VAL 139 HB VAL 139 1.376 1.436 10.645 895 HG11 VAL 139 1HG1 VAL 139 1.665 3.208 9.193 896 HG12 VAL 139 2HG1 VAL 139 2.951 2.166 8.609 897 HG13 VAL 139 3HG1 VAL 139 1.405 2.212 7.746 898 HG21 VAL 139 3HG2 VAL 139 -0.688 1.677 9.042 899 HG22 VAL 139 1HG2 VAL 139 -0.148 0.148 8.369 900 HG23 VAL 139 2HG2 VAL 139 -0.584 0.247 10.082 901 H ALA 140 H ALA 140 4.501 -0.631 8.415 902 HA ALA 140 HA ALA 140 6.066 0.380 10.743 903 HB1 ALA 140 1HB ALA 140 7.776 -1.280 10.409 904 HB2 ALA 140 2HB ALA 140 6.237 -2.112 10.604 905 HB3 ALA 140 3HB ALA 140 6.963 -1.931 8.989 906 H ARG 141 H ARG 141 8.589 0.249 9.307 907 HA ARG 141 HA ARG 141 8.095 2.076 7.059 908 HB3 ARG 141 2HB ARG 141 8.429 3.427 9.146 909 HG3 ARG 141 2HG ARG 141 11.350 2.959 9.109 910 HD3 ARG 141 2HD ARG 141 10.749 2.586 11.676 911 HE ARG 141 HE ARG 141 11.296 4.900 10.209 912 HH11 ARG 141 1HH1 ARG 141 9.785 4.172 13.364 913 HH12 ARG 141 2HH1 ARG 141 10.705 5.323 14.229 914 HH21 ARG 141 1HH2 ARG 141 12.438 6.389 11.243 915 HH22 ARG 141 2HH2 ARG 141 12.252 6.731 12.961 916 H ASP 142 H ASP 142 9.908 2.228 5.646 917 HA ASP 142 HA ASP 142 11.372 1.193 4.251 918 HB3 ASP 142 2HB ASP 142 13.459 0.094 5.449 919 H ASP 143 H ASP 143 12.770 -1.339 4.734 920 HA ASP 143 HA ASP 143 10.515 -3.324 4.859 921 HB3 ASP 143 2HB ASP 143 13.257 -3.725 3.700 922 H SER 144 H SER 144 10.491 -2.689 7.125 923 HA SER 144 HA SER 144 12.633 -4.014 8.711 924 HB3 SER 144 2HB SER 144 10.404 -2.142 9.590 925 HG SER 144 HG SER 144 11.929 -3.538 11.017 926 H GLU 145 H GLU 145 9.156 -4.425 7.877 927 HA GLU 145 HA GLU 145 9.017 -6.610 9.900 928 HB3 GLU 145 2HB GLU 145 6.610 -5.660 10.317 929 HG3 GLU 145 2HG GLU 145 9.146 -4.341 11.373 930 H VAL 146 H VAL 146 9.002 -6.427 6.702 931 HA VAL 146 HA VAL 146 6.637 -7.664 5.840 932 HB VAL 146 HB VAL 146 8.115 -6.988 4.208 933 HG11 VAL 146 1HG1 VAL 146 10.224 -6.858 5.369 934 HG12 VAL 146 2HG1 VAL 146 10.319 -8.651 5.501 935 HG13 VAL 146 3HG1 VAL 146 10.440 -7.821 3.927 936 HG21 VAL 146 3HG2 VAL 146 7.010 -9.152 3.639 937 HG22 VAL 146 1HG2 VAL 146 8.528 -8.877 2.772 938 HG23 VAL 146 2HG2 VAL 146 8.479 -9.995 4.144 939 H ASP 147 H ASP 147 9.281 -9.129 7.698 940 HA ASP 147 HA ASP 147 8.733 -11.839 7.207 941 HB3 ASP 147 2HB ASP 147 9.844 -10.474 9.689 942 H LYS 148 H LYS 148 6.793 -9.615 9.042 943 HA LYS 148 HA LYS 148 5.245 -11.874 10.259 944 HB3 LYS 148 2HB LYS 148 5.913 -10.343 11.986 945 HG3 LYS 148 2HG LYS 148 4.861 -8.207 10.130 946 HD3 LYS 148 2HD LYS 148 3.955 -7.888 12.498 947 HE3 LYS 148 2HE LYS 148 6.952 -7.493 12.855 948 HZ1 LYS 148 3HZ LYS 148 5.803 -5.590 13.713 949 HZ2 LYS 148 1HZ LYS 148 6.452 -6.489 14.941 950 HZ3 LYS 148 2HZ LYS 148 4.831 -6.540 14.653 951 H TRP 149 H TRP 149 5.190 -9.602 7.650 952 HA TRP 149 HA TRP 149 2.246 -9.456 7.671 953 HB3 TRP 149 2HB TRP 149 2.566 -8.021 5.688 954 HD1 TRP 149 HD TRP 149 2.616 -7.780 9.104 955 HE1 TRP 149 1HE TRP 149 3.424 -5.603 10.119 956 HE3 TRP 149 3HE TRP 149 4.904 -5.820 4.983 957 HZ2 TRP 149 2HZ TRP 149 4.722 -3.210 9.211 958 HZ3 TRP 149 3HZ TRP 149 5.853 -3.530 5.049 959 HH2 TRP 149 HH TRP 149 5.762 -2.199 7.130 960 H SER 150 H SER 150 4.586 -11.593 6.289 961 HA SER 150 HA SER 150 2.475 -12.863 4.629 962 HB3 SER 150 2HB SER 150 4.847 -13.144 3.139 963 HG SER 150 HG SER 150 2.674 -11.336 3.060 964 H LYS 151 H LYS 151 2.530 -13.901 6.875 965 HA LYS 151 HA LYS 151 4.876 -15.682 7.277 966 HB3 LYS 151 2HB LYS 151 4.681 -14.023 8.907 967 HG3 LYS 151 2HG LYS 151 1.944 -13.970 8.739 968 HD3 LYS 151 2HD LYS 151 1.904 -16.105 10.159 969 HE3 LYS 151 2HE LYS 151 2.470 -14.156 12.427 970 HZ1 LYS 151 3HZ LYS 151 2.975 -16.202 13.592 971 HZ2 LYS 151 1HZ LYS 151 2.841 -17.066 12.200 972 HZ3 LYS 151 2HZ LYS 151 1.496 -16.397 12.857 Start of MODEL 18 1 H1 GLY 1 H GLY 1 -9.192 -23.068 -7.615 2 HA2 GLY 1 1HA GLY 1 -9.551 -25.283 -5.665 3 HA3 GLY 1 2HA GLY 1 -8.363 -25.285 -6.995 4 H MET 2 H MET 2 -9.247 -23.843 -3.889 5 HA MET 2 HA MET 2 -8.365 -22.409 -2.484 6 HB3 MET 2 2HB MET 2 -6.013 -21.966 -2.249 7 HG3 MET 2 2HG MET 2 -6.953 -24.176 -1.406 8 HE1 MET 2 3HE MET 2 -5.753 -27.820 -2.152 9 HE2 MET 2 1HE MET 2 -4.890 -26.582 -1.213 10 HE3 MET 2 2HE MET 2 -6.653 -26.752 -1.056 11 H ALA 3 H ALA 3 -7.357 -20.110 -2.441 12 HA ALA 3 HA ALA 3 -7.206 -18.522 -4.816 13 HB1 ALA 3 1HB ALA 3 -9.658 -18.854 -4.773 14 HB2 ALA 3 2HB ALA 3 -9.707 -18.338 -3.070 15 HB3 ALA 3 3HB ALA 3 -9.222 -17.197 -4.337 16 H LYS 4 H LYS 4 -5.329 -17.785 -3.872 17 HA LYS 4 HA LYS 4 -5.543 -15.882 -1.717 18 HB3 LYS 4 2HB LYS 4 -5.152 -17.839 -0.321 19 HG3 LYS 4 2HG LYS 4 -2.921 -18.846 -0.159 20 HD3 LYS 4 2HD LYS 4 -4.921 -19.849 -1.641 21 HE3 LYS 4 2HE LYS 4 -3.523 -18.766 -3.713 22 HZ1 LYS 4 3HZ LYS 4 -2.131 -20.382 -4.695 23 HZ2 LYS 4 1HZ LYS 4 -2.493 -21.522 -3.590 24 HZ3 LYS 4 2HZ LYS 4 -1.562 -20.256 -3.159 25 H LYS 5 H LYS 5 -4.063 -14.187 -2.036 26 HA LYS 5 HA LYS 5 -1.763 -14.586 -3.793 27 HB3 LYS 5 2HB LYS 5 -2.340 -12.955 -5.434 28 HG3 LYS 5 2HG LYS 5 -4.937 -14.424 -5.188 29 HD3 LYS 5 2HD LYS 5 -3.397 -13.320 -7.579 30 HE3 LYS 5 2HE LYS 5 -6.288 -14.247 -7.310 31 HZ1 LYS 5 3HZ LYS 5 -4.679 -13.457 -9.687 32 HZ2 LYS 5 1HZ LYS 5 -5.918 -12.609 -9.081 33 HZ3 LYS 5 2HZ LYS 5 -6.191 -14.070 -9.739 34 H THR 6 H THR 6 -0.691 -12.529 -4.152 35 HA THR 6 HA THR 6 -1.155 -10.413 -2.122 36 HB THR 6 HB THR 6 1.539 -11.666 -2.733 37 HG1 THR 6 1HG THR 6 -0.295 -11.982 -0.603 38 HG21 THR 6 3HG2 THR 6 1.802 -9.326 -2.101 39 HG22 THR 6 1HG2 THR 6 2.275 -10.352 -0.737 40 HG23 THR 6 2HG2 THR 6 0.695 -9.536 -0.730 41 H LEU 7 H LEU 7 -1.773 -8.762 -3.357 42 HA LEU 7 HA LEU 7 -0.120 -7.961 -5.731 43 HB3 LEU 7 2HB LEU 7 -2.544 -6.687 -4.482 44 HG LEU 7 HG LEU 7 -1.373 -5.003 -5.788 45 HD11 LEU 7 1HD1 LEU 7 0.193 -6.287 -7.175 46 HD12 LEU 7 2HD1 LEU 7 -0.832 -5.313 -8.200 47 HD13 LEU 7 3HD1 LEU 7 -1.172 -7.046 -8.045 48 HD21 LEU 7 3HD2 LEU 7 -3.798 -5.144 -6.106 49 HD22 LEU 7 1HD2 LEU 7 -3.601 -6.383 -7.372 50 HD23 LEU 7 2HD2 LEU 7 -3.039 -4.739 -7.672 51 H ILE 8 H ILE 8 1.332 -6.233 -5.604 52 HA ILE 8 HA ILE 8 1.656 -4.870 -3.000 53 HB ILE 8 HB ILE 8 3.897 -5.589 -4.956 54 HG13 ILE 8 2HG1 ILE 8 2.963 -7.735 -4.153 55 HG21 ILE 8 1HG2 ILE 8 5.265 -5.007 -2.998 56 HG22 ILE 8 2HG2 ILE 8 4.225 -3.681 -3.444 57 HG23 ILE 8 3HG2 ILE 8 3.831 -4.689 -2.038 58 HD11 ILE 8 3HD1 ILE 8 4.858 -8.756 -3.233 59 HD12 ILE 8 1HD1 ILE 8 5.520 -7.441 -4.230 60 HD13 ILE 8 2HD1 ILE 8 5.409 -7.281 -2.457 61 H LEU 9 H LEU 9 1.348 -2.700 -3.234 62 HA LEU 9 HA LEU 9 1.775 -1.377 -5.882 63 HB3 LEU 9 2HB LEU 9 -0.395 -0.090 -5.173 64 HG LEU 9 HG LEU 9 -0.275 -2.867 -6.358 65 HD11 LEU 9 1HD1 LEU 9 -2.726 -2.775 -6.720 66 HD12 LEU 9 2HD1 LEU 9 -2.817 -1.432 -5.555 67 HD13 LEU 9 3HD1 LEU 9 -2.249 -3.054 -5.037 68 HD21 LEU 9 3HD2 LEU 9 -1.465 -0.268 -7.404 69 HD22 LEU 9 1HD2 LEU 9 -1.084 -1.752 -8.311 70 HD23 LEU 9 2HD2 LEU 9 0.229 -0.753 -7.657 71 H TYR 10 H TYR 10 3.530 -0.140 -5.243 72 HA TYR 10 HA TYR 10 3.077 1.725 -2.964 73 HB3 TYR 10 2HB TYR 10 4.739 0.736 -1.912 74 HD1 TYR 10 1HD TYR 10 5.615 -0.005 -5.523 75 HD2 TYR 10 2HD TYR 10 6.233 -0.957 -1.341 76 HE1 TYR 10 1HE TYR 10 6.502 -2.208 -6.137 77 HE2 TYR 10 2HE TYR 10 7.082 -3.151 -1.951 78 HH TYR 10 HH TYR 10 7.367 -4.700 -3.693 79 H TYR 11 H TYR 11 4.256 3.734 -3.087 80 HA TYR 11 HA TYR 11 4.865 4.594 -5.877 81 HB3 TYR 11 2HB TYR 11 4.018 6.193 -3.428 82 HD1 TYR 11 1HD TYR 11 5.064 6.441 -7.055 83 HD2 TYR 11 2HD TYR 11 4.127 8.591 -3.431 84 HE1 TYR 11 1HE TYR 11 5.916 8.510 -8.066 85 HE2 TYR 11 2HE TYR 11 5.073 10.625 -4.402 86 HH TYR 11 HH TYR 11 5.823 11.666 -6.347 87 H SER 12 H SER 12 6.981 5.690 -6.088 88 HA SER 12 HA SER 12 8.583 5.855 -3.592 89 HB3 SER 12 2HB SER 12 9.443 4.044 -5.002 90 HG SER 12 HG SER 12 9.065 4.707 -7.084 91 H TRP 13 H TRP 13 9.118 7.890 -3.138 92 HA TRP 13 HA TRP 13 8.157 10.068 -4.552 93 HB3 TRP 13 2HB TRP 13 10.542 10.270 -2.669 94 HD1 TRP 13 HD TRP 13 6.990 11.626 -3.443 95 HE1 TRP 13 1HE TRP 13 6.902 14.072 -2.817 96 HE3 TRP 13 3HE TRP 13 11.580 12.031 -1.160 97 HZ2 TRP 13 2HZ TRP 13 8.679 16.052 -1.674 98 HZ3 TRP 13 3HZ TRP 13 12.327 14.234 -0.291 99 HH2 TRP 13 HH TRP 13 10.932 16.247 -0.645 100 H SER 14 H SER 14 11.490 8.964 -4.252 101 HA SER 14 HA SER 14 12.209 9.693 -6.937 102 HB3 SER 14 2HB SER 14 13.704 11.095 -4.684 103 HG SER 14 HG SER 14 13.541 12.127 -7.258 104 H GLY 15 H GLY 15 12.044 7.298 -6.322 105 HA2 GLY 15 1HA GLY 15 13.350 5.412 -6.535 106 HA3 GLY 15 2HA GLY 15 14.773 6.367 -6.188 107 H GLU 16 H GLU 16 13.321 7.245 -3.576 108 HA GLU 16 HA GLU 16 14.851 5.654 -1.931 109 HB3 GLU 16 2HB GLU 16 13.835 6.795 -0.054 110 HG3 GLU 16 2HG GLU 16 13.643 8.767 -2.363 111 H THR 17 H THR 17 11.233 5.476 -2.113 112 HA THR 17 HA THR 17 11.224 2.970 -0.657 113 HB THR 17 HB THR 17 8.958 4.027 -2.328 114 HG1 THR 17 1HG THR 17 9.811 4.997 0.219 115 HG21 THR 17 3HG2 THR 17 7.522 3.235 -0.507 116 HG22 THR 17 1HG2 THR 17 8.944 2.696 0.416 117 HG23 THR 17 2HG2 THR 17 8.516 1.895 -1.105 118 H LYS 18 H LYS 18 12.085 3.728 -3.842 119 HA LYS 18 HA LYS 18 10.802 1.541 -5.246 120 HB3 LYS 18 2HB LYS 18 13.324 2.826 -6.256 121 HG3 LYS 18 2HG LYS 18 10.601 2.736 -7.569 122 HD3 LYS 18 2HD LYS 18 12.517 4.111 -8.538 123 HE3 LYS 18 2HE LYS 18 13.890 1.619 -8.053 124 HZ1 LYS 18 3HZ LYS 18 14.739 1.026 -10.045 125 HZ2 LYS 18 1HZ LYS 18 14.280 2.409 -10.828 126 HZ3 LYS 18 2HZ LYS 18 13.151 1.260 -10.433 127 H LYS 19 H LYS 19 13.873 2.049 -3.540 128 HA LYS 19 HA LYS 19 15.082 -0.423 -4.423 129 HB3 LYS 19 2HB LYS 19 15.642 0.747 -1.693 130 HG3 LYS 19 2HG LYS 19 17.343 -0.162 -4.034 131 HD3 LYS 19 2HD LYS 19 18.273 0.722 -1.269 132 HE3 LYS 19 2HE LYS 19 19.609 -1.007 -2.536 133 HZ1 LYS 19 3HZ LYS 19 20.373 1.165 -4.388 134 HZ2 LYS 19 1HZ LYS 19 19.175 0.124 -4.785 135 HZ3 LYS 19 2HZ LYS 19 20.673 -0.438 -4.505 136 H MET 20 H MET 20 13.076 0.641 -1.768 137 HA MET 20 HA MET 20 12.782 -1.849 -0.374 138 HB3 MET 20 2HB MET 20 11.174 0.741 -0.104 139 HG3 MET 20 2HG MET 20 10.431 -0.959 1.430 140 HE1 MET 20 3HE MET 20 14.711 -1.659 3.083 141 HE2 MET 20 1HE MET 20 14.402 -0.542 1.734 142 HE3 MET 20 2HE MET 20 13.791 -0.172 3.361 143 H ALA 21 H ALA 21 12.088 -2.237 -3.071 144 HA ALA 21 HA ALA 21 9.250 -2.935 -2.906 145 HB1 ALA 21 1HB ALA 21 9.201 -0.951 -4.285 146 HB2 ALA 21 2HB ALA 21 10.640 -1.469 -5.200 147 HB3 ALA 21 3HB ALA 21 9.132 -2.342 -5.394 148 H GLU 22 H GLU 22 12.031 -3.178 -5.163 149 HA GLU 22 HA GLU 22 11.696 -5.747 -6.060 150 HB3 GLU 22 2HB GLU 22 14.040 -5.719 -6.683 151 HG3 GLU 22 2HG GLU 22 13.285 -2.786 -6.463 152 H LYS 23 H LYS 23 13.446 -4.784 -3.060 153 HA LYS 23 HA LYS 23 14.487 -7.304 -2.348 154 HB3 LYS 23 2HB LYS 23 13.813 -5.833 -0.014 155 HG3 LYS 23 2HG LYS 23 16.048 -6.918 -0.883 156 HD3 LYS 23 2HD LYS 23 16.689 -3.983 -1.279 157 HE3 LYS 23 2HE LYS 23 18.397 -5.854 -0.623 158 HZ1 LYS 23 3HZ LYS 23 18.215 -6.239 -3.546 159 HZ2 LYS 23 1HZ LYS 23 17.714 -7.390 -2.457 160 HZ3 LYS 23 2HZ LYS 23 19.297 -6.955 -2.564 161 H ILE 24 H ILE 24 11.556 -5.644 -1.160 162 HA ILE 24 HA ILE 24 10.599 -7.784 0.387 163 HB ILE 24 HB ILE 24 9.153 -5.445 -0.897 164 HG13 ILE 24 2HG1 ILE 24 11.011 -4.732 0.541 165 HG21 ILE 24 1HG2 ILE 24 8.269 -7.075 1.527 166 HG22 ILE 24 2HG2 ILE 24 7.362 -5.766 0.741 167 HG23 ILE 24 3HG2 ILE 24 7.594 -7.301 -0.086 168 HD11 ILE 24 3HD1 ILE 24 8.407 -4.186 1.996 169 HD12 ILE 24 1HD1 ILE 24 9.864 -3.189 1.900 170 HD13 ILE 24 2HD1 ILE 24 8.852 -3.412 0.460 171 H ASN 25 H ASN 25 9.990 -6.976 -3.101 172 HA ASN 25 HA ASN 25 7.971 -8.987 -3.458 173 HB3 ASN 25 2HB ASN 25 9.892 -7.733 -5.452 174 HD21 ASN 25 1HD2 ASN 25 6.881 -9.853 -5.114 175 HD22 ASN 25 2HD2 ASN 25 7.014 -10.381 -6.744 176 H SER 26 H SER 26 11.558 -9.110 -3.700 177 HA SER 26 HA SER 26 11.647 -11.805 -4.706 178 HB3 SER 26 2HB SER 26 14.021 -11.622 -4.172 179 HG SER 26 HG SER 26 13.069 -9.077 -5.066 180 H GLU 27 H GLU 27 11.767 -10.364 -1.418 181 HA GLU 27 HA GLU 27 12.269 -12.756 0.051 182 HB3 GLU 27 2HB GLU 27 10.738 -11.289 1.762 183 HG3 GLU 27 2HG GLU 27 12.826 -9.765 2.096 184 H ILE 28 H ILE 28 9.292 -11.337 -1.257 185 HA ILE 28 HA ILE 28 7.554 -13.323 -0.070 186 HB ILE 28 HB ILE 28 7.154 -11.073 -2.080 187 HG13 ILE 28 2HG1 ILE 28 7.667 -10.550 0.368 188 HG21 ILE 28 1HG2 ILE 28 4.966 -12.826 -0.890 189 HG22 ILE 28 2HG2 ILE 28 4.722 -11.332 -1.814 190 HG23 ILE 28 3HG2 ILE 28 5.433 -12.704 -2.617 191 HD11 ILE 28 3HD1 ILE 28 5.949 -9.016 0.851 192 HD12 ILE 28 1HD1 ILE 28 6.133 -9.011 -0.915 193 HD13 ILE 28 2HD1 ILE 28 4.763 -9.862 -0.149 194 H LYS 29 H LYS 29 6.149 -14.589 -1.425 195 HA LYS 29 HA LYS 29 7.423 -16.403 -3.253 196 HB3 LYS 29 2HB LYS 29 5.535 -16.955 -1.661 197 HG3 LYS 29 2HG LYS 29 3.887 -15.323 -3.660 198 HD3 LYS 29 2HD LYS 29 2.809 -16.974 -1.373 199 HE3 LYS 29 2HE LYS 29 1.619 -15.774 -3.912 200 HZ1 LYS 29 3HZ LYS 29 -0.204 -16.856 -3.338 201 HZ2 LYS 29 1HZ LYS 29 -0.150 -16.286 -1.779 202 HZ3 LYS 29 2HZ LYS 29 0.646 -17.665 -2.167 203 H ASP 30 H ASP 30 5.446 -16.779 -5.088 204 HA ASP 30 HA ASP 30 6.109 -15.239 -7.360 205 HB3 ASP 30 2HB ASP 30 4.420 -16.725 -8.437 206 H SER 31 H SER 31 5.124 -13.388 -5.544 207 HA SER 31 HA SER 31 2.319 -12.791 -5.789 208 HB3 SER 31 2HB SER 31 3.771 -12.064 -3.933 209 HG SER 31 HG SER 31 4.604 -9.911 -5.562 210 H GLU 32 H GLU 32 2.137 -10.118 -6.450 211 HA GLU 32 HA GLU 32 3.257 -9.828 -9.197 212 HB3 GLU 32 2HB GLU 32 0.836 -8.398 -8.030 213 HG3 GLU 32 2HG GLU 32 2.017 -8.564 -10.841 214 H LEU 33 H LEU 33 3.880 -7.535 -9.539 215 HA LEU 33 HA LEU 33 4.762 -5.954 -7.211 216 HB3 LEU 33 2HB LEU 33 6.347 -6.963 -9.609 217 HG LEU 33 HG LEU 33 6.839 -4.507 -9.333 218 HD11 LEU 33 1HD1 LEU 33 8.072 -3.761 -7.345 219 HD12 LEU 33 2HD1 LEU 33 7.977 -5.372 -6.641 220 HD13 LEU 33 3HD1 LEU 33 6.496 -4.428 -6.851 221 HD21 LEU 33 3HD2 LEU 33 9.098 -6.430 -8.620 222 HD22 LEU 33 1HD2 LEU 33 9.292 -4.785 -9.268 223 HD23 LEU 33 2HD2 LEU 33 8.523 -6.044 -10.252 224 H LYS 34 H LYS 34 3.521 -4.003 -7.549 225 HA LYS 34 HA LYS 34 3.689 -2.894 -10.293 226 HB3 LYS 34 2HB LYS 34 1.606 -1.627 -9.721 227 HG3 LYS 34 2HG LYS 34 -0.107 -3.378 -9.889 228 HD3 LYS 34 2HD LYS 34 1.871 -4.472 -11.803 229 HE3 LYS 34 2HE LYS 34 -0.692 -2.854 -12.216 230 HZ1 LYS 34 3HZ LYS 34 -0.588 -3.948 -14.407 231 HZ2 LYS 34 1HZ LYS 34 0.847 -4.598 -14.025 232 HZ3 LYS 34 2HZ LYS 34 0.678 -2.944 -14.178 233 H GLU 35 H GLU 35 3.865 -0.579 -10.231 234 HA GLU 35 HA GLU 35 4.347 0.653 -7.597 235 HB3 GLU 35 2HB GLU 35 6.055 1.565 -9.909 236 HG3 GLU 35 2HG GLU 35 6.564 1.691 -6.912 237 H VAL 36 H VAL 36 3.670 2.782 -7.532 238 HA VAL 36 HA VAL 36 1.677 3.513 -9.583 239 HB VAL 36 HB VAL 36 1.829 4.326 -6.643 240 HG11 VAL 36 1HG1 VAL 36 -0.648 4.733 -6.929 241 HG12 VAL 36 2HG1 VAL 36 0.365 5.850 -7.817 242 HG13 VAL 36 3HG1 VAL 36 -0.443 4.505 -8.672 243 HG21 VAL 36 3HG2 VAL 36 1.526 1.877 -6.698 244 HG22 VAL 36 1HG2 VAL 36 0.043 2.664 -6.185 245 HG23 VAL 36 2HG2 VAL 36 0.182 2.051 -7.843 246 H LYS 37 H LYS 37 1.258 5.918 -9.756 247 HA LYS 37 HA LYS 37 3.560 7.658 -9.264 248 HB3 LYS 37 2HB LYS 37 3.255 8.555 -11.651 249 HG3 LYS 37 2HG LYS 37 5.061 6.726 -10.758 250 HD3 LYS 37 2HD LYS 37 3.360 4.978 -12.096 251 HE3 LYS 37 2HE LYS 37 4.614 4.475 -14.225 252 HZ1 LYS 37 3HZ LYS 37 3.748 6.272 -15.551 253 HZ2 LYS 37 1HZ LYS 37 3.410 7.195 -14.245 254 HZ3 LYS 37 2HZ LYS 37 2.626 5.762 -14.456 255 H VAL 38 H VAL 38 2.892 9.905 -9.592 256 HA VAL 38 HA VAL 38 0.014 10.440 -9.909 257 HB VAL 38 HB VAL 38 0.314 12.576 -8.757 258 HG11 VAL 38 1HG1 VAL 38 0.015 11.849 -6.575 259 HG12 VAL 38 2HG1 VAL 38 -0.402 10.413 -7.514 260 HG13 VAL 38 3HG1 VAL 38 1.188 10.523 -6.725 261 HG21 VAL 38 3HG2 VAL 38 2.233 13.072 -7.335 262 HG22 VAL 38 1HG2 VAL 38 3.051 11.576 -7.837 263 HG23 VAL 38 2HG2 VAL 38 2.773 12.886 -9.001 264 H SER 39 H SER 39 -0.043 12.808 -10.958 265 HA SER 39 HA SER 39 1.291 12.726 -13.470 266 HB3 SER 39 2HB SER 39 0.188 15.187 -12.354 267 HG SER 39 HG SER 39 -0.638 15.452 -14.291 268 H GLU 40 H GLU 40 2.363 14.909 -14.212 269 HA GLU 40 HA GLU 40 4.905 15.085 -12.836 270 HB3 GLU 40 2HB GLU 40 3.711 16.078 -15.462 271 HG3 GLU 40 2HG GLU 40 6.267 16.754 -14.043 272 H GLY 41 H GLY 41 5.357 16.672 -11.443 273 HA2 GLY 41 1HA GLY 41 5.315 18.688 -10.367 274 HA3 GLY 41 2HA GLY 41 4.385 19.336 -11.722 275 H THR 42 H THR 42 2.880 16.613 -10.159 276 HA THR 42 HA THR 42 0.651 18.014 -9.143 277 HB THR 42 HB THR 42 1.773 15.469 -7.903 278 HG1 THR 42 1HG THR 42 1.807 14.947 -10.018 279 HG21 THR 42 3HG2 THR 42 -1.086 16.357 -8.485 280 HG22 THR 42 1HG2 THR 42 -0.298 16.437 -6.897 281 HG23 THR 42 2HG2 THR 42 -0.591 14.863 -7.655 282 H PHE 43 H PHE 43 3.800 17.245 -7.667 283 HA PHE 43 HA PHE 43 3.238 19.121 -5.451 284 HB3 PHE 43 2HB PHE 43 4.232 17.504 -3.940 285 HD1 PHE 43 2HD PHE 43 1.699 18.368 -3.851 286 HD2 PHE 43 1HD PHE 43 2.998 14.594 -5.445 287 HE1 PHE 43 2HE PHE 43 -0.555 17.411 -3.404 288 HE2 PHE 43 1HE PHE 43 0.745 13.634 -5.024 289 HZ PHE 43 HZ PHE 43 -1.031 15.049 -3.999 290 H ASP 44 H ASP 44 5.474 19.161 -4.112 291 HA ASP 44 HA ASP 44 7.816 19.600 -5.788 292 HB3 ASP 44 2HB ASP 44 6.767 21.842 -4.027 293 H ALA 45 H ALA 45 9.219 20.934 -3.539 294 HA ALA 45 HA ALA 45 8.514 19.454 -1.109 295 HB1 ALA 45 1HB ALA 45 11.304 19.216 -2.193 296 HB2 ALA 45 2HB ALA 45 10.650 18.542 -0.685 297 HB3 ALA 45 3HB ALA 45 10.069 17.950 -2.261 298 H ASP 46 H ASP 46 8.974 22.359 -2.421 299 HA ASP 46 HA ASP 46 10.799 23.604 -0.553 300 HB3 ASP 46 2HB ASP 46 8.533 25.127 -1.871 301 H MET 47 H MET 47 10.344 24.709 1.330 302 HA MET 47 HA MET 47 8.311 23.635 2.959 303 HB3 MET 47 2HB MET 47 10.430 24.442 3.834 304 HG3 MET 47 2HG MET 47 9.973 26.862 2.437 305 HE1 MET 47 3HE MET 47 9.436 29.257 2.794 306 HE2 MET 47 1HE MET 47 7.910 28.396 3.148 307 HE3 MET 47 2HE MET 47 8.408 29.758 4.162 308 H TYR 48 H TYR 48 8.174 26.644 0.991 309 HA TYR 48 HA TYR 48 5.621 27.349 2.282 310 HB3 TYR 48 2HB TYR 48 6.577 29.249 1.423 311 HD1 TYR 48 2HD TYR 48 5.905 28.116 -2.084 312 HD2 TYR 48 1HD TYR 48 8.864 29.357 0.787 313 HE1 TYR 48 2HE TYR 48 7.534 28.493 -3.910 314 HE2 TYR 48 1HE TYR 48 10.461 29.787 -0.997 315 HH TYR 48 HH TYR 48 10.060 28.622 -4.159 316 H LYS 49 H LYS 49 6.673 25.962 -0.844 317 HA LYS 49 HA LYS 49 4.087 25.894 -1.849 318 HB3 LYS 49 2HB LYS 49 6.124 23.846 -2.770 319 HG3 LYS 49 2HG LYS 49 3.876 24.400 -3.965 320 HD3 LYS 49 2HD LYS 49 5.557 26.785 -4.843 321 HE3 LYS 49 2HE LYS 49 2.741 25.962 -5.636 322 HZ1 LYS 49 3HZ LYS 49 3.395 28.368 -5.715 323 HZ2 LYS 49 1HZ LYS 49 2.850 27.754 -7.144 324 HZ3 LYS 49 2HZ LYS 49 4.463 27.981 -6.891 325 H THR 50 H THR 50 5.864 23.042 -0.327 326 HA THR 50 HA THR 50 3.479 21.510 -0.698 327 HB THR 50 HB THR 50 4.733 19.751 0.117 328 HG1 THR 50 1HG THR 50 5.895 20.273 1.790 329 HG21 THR 50 3HG2 THR 50 5.267 20.758 -2.159 330 HG22 THR 50 1HG2 THR 50 6.512 19.761 -1.397 331 HG23 THR 50 2HG2 THR 50 6.715 21.515 -1.414 332 H SER 51 H SER 51 4.329 23.697 1.824 333 HA SER 51 HA SER 51 2.737 22.391 3.868 334 HB3 SER 51 2HB SER 51 3.207 25.367 3.351 335 HG SER 51 HG SER 51 1.846 25.442 4.901 336 H ASP 52 H ASP 52 2.206 24.898 1.419 337 HA ASP 52 HA ASP 52 -0.522 25.065 2.049 338 HB3 ASP 52 2HB ASP 52 0.359 26.323 -0.515 339 H ILE 53 H ILE 53 1.071 23.367 -0.663 340 HA ILE 53 HA ILE 53 -1.349 22.922 -2.114 341 HB ILE 53 HB ILE 53 1.161 21.192 -1.999 342 HG13 ILE 53 2HG1 ILE 53 1.261 23.591 -3.041 343 HG21 ILE 53 1HG2 ILE 53 0.259 20.160 -4.166 344 HG22 ILE 53 2HG2 ILE 53 -0.702 19.764 -2.749 345 HG23 ILE 53 3HG2 ILE 53 -1.249 21.015 -3.881 346 HD11 ILE 53 3HD1 ILE 53 2.069 21.189 -4.756 347 HD12 ILE 53 1HD1 ILE 53 2.652 22.837 -4.937 348 HD13 ILE 53 2HD1 ILE 53 3.029 21.926 -3.454 349 H ALA 54 H ALA 54 0.264 20.796 0.347 350 HA ALA 54 HA ALA 54 -1.785 18.827 0.137 351 HB1 ALA 54 1HB ALA 54 -0.393 19.045 2.759 352 HB2 ALA 54 2HB ALA 54 -0.647 17.644 1.713 353 HB3 ALA 54 3HB ALA 54 0.651 18.818 1.364 354 H LEU 55 H LEU 55 -1.305 21.574 2.370 355 HA LEU 55 HA LEU 55 -3.338 21.002 4.174 356 HB3 LEU 55 2HB LEU 55 -2.349 23.724 3.241 357 HG LEU 55 HG LEU 55 -2.399 24.204 5.734 358 HD11 LEU 55 1HD1 LEU 55 -3.751 25.334 4.086 359 HD12 LEU 55 2HD1 LEU 55 -4.549 25.214 5.640 360 HD13 LEU 55 3HD1 LEU 55 -5.042 24.151 4.286 361 HD21 LEU 55 3HD2 LEU 55 -2.791 21.994 6.588 362 HD22 LEU 55 1HD2 LEU 55 -4.401 21.978 5.866 363 HD23 LEU 55 2HD2 LEU 55 -4.007 23.146 7.155 364 H ASP 56 H ASP 56 -3.535 22.721 1.084 365 HA ASP 56 HA ASP 56 -6.219 23.551 1.121 366 HB3 ASP 56 2HB ASP 56 -5.603 22.742 -1.552 367 H GLN 57 H GLN 57 -4.815 20.517 -0.112 368 HA GLN 57 HA GLN 57 -7.256 19.305 -0.995 369 HB3 GLN 57 2HB GLN 57 -5.865 17.268 -1.181 370 HG3 GLN 57 2HG GLN 57 -4.379 19.789 -2.042 371 HE21 GLN 57 1HE2 GLN 57 -4.094 17.922 -4.611 372 HE22 GLN 57 2HE2 GLN 57 -2.586 17.127 -4.235 373 H ILE 58 H ILE 58 -5.274 18.936 1.935 374 HA ILE 58 HA ILE 58 -6.590 16.810 3.192 375 HB ILE 58 HB ILE 58 -5.037 19.191 4.283 376 HG13 ILE 58 2HG1 ILE 58 -3.943 17.334 2.797 377 HG21 ILE 58 1HG2 ILE 58 -5.984 16.738 5.833 378 HG22 ILE 58 2HG2 ILE 58 -4.790 17.913 6.428 379 HG23 ILE 58 3HG2 ILE 58 -6.441 18.419 6.145 380 HD11 ILE 58 3HD1 ILE 58 -2.625 18.900 4.270 381 HD12 ILE 58 1HD1 ILE 58 -2.749 17.720 5.574 382 HD13 ILE 58 2HD1 ILE 58 -1.901 17.294 4.079 383 H GLN 59 H GLN 59 -7.080 20.348 3.780 384 HA GLN 59 HA GLN 59 -9.077 19.663 5.726 385 HB3 GLN 59 2HB GLN 59 -9.342 22.173 5.895 386 HG3 GLN 59 2HG GLN 59 -6.413 21.358 5.967 387 HE21 GLN 59 1HE2 GLN 59 -6.211 23.698 5.617 388 HE22 GLN 59 2HE2 GLN 59 -6.399 24.795 6.931 389 H GLY 60 H GLY 60 -9.491 19.690 2.411 390 HA2 GLY 60 1HA GLY 60 -11.560 19.268 1.385 391 HA3 GLY 60 2HA GLY 60 -12.410 20.037 2.722 392 H ASN 61 H ASN 61 -9.868 22.080 1.833 393 HA ASN 61 HA ASN 61 -11.609 24.022 0.595 394 HB3 ASN 61 2HB ASN 61 -9.762 25.411 0.249 395 HD21 ASN 61 1HD2 ASN 61 -7.888 22.950 1.996 396 HD22 ASN 61 2HD2 ASN 61 -7.840 23.881 3.487 397 H LYS 62 H LYS 62 -9.292 21.553 -0.593 398 HA LYS 62 HA LYS 62 -10.296 21.953 -3.362 399 HB3 LYS 62 2HB LYS 62 -7.849 21.562 -4.045 400 HG3 LYS 62 2HG LYS 62 -7.721 24.069 -2.469 401 HD3 LYS 62 2HD LYS 62 -7.896 23.425 -5.453 402 HE3 LYS 62 2HE LYS 62 -7.215 26.039 -4.044 403 HZ1 LYS 62 3HZ LYS 62 -7.576 25.361 -6.907 404 HZ2 LYS 62 1HZ LYS 62 -6.182 25.891 -6.188 405 HZ3 LYS 62 2HZ LYS 62 -7.476 26.883 -6.310 406 H ASP 63 H ASP 63 -9.692 20.145 -4.819 407 HA ASP 63 HA ASP 63 -10.713 17.741 -3.627 408 HB3 ASP 63 2HB ASP 63 -10.651 16.889 -5.923 409 H PHE 64 H PHE 64 -9.701 15.633 -4.049 410 HA PHE 64 HA PHE 64 -7.026 15.400 -3.090 411 HB3 PHE 64 2HB PHE 64 -8.755 13.723 -2.662 412 HD1 PHE 64 2HD PHE 64 -9.936 14.648 -5.656 413 HD2 PHE 64 1HD PHE 64 -8.443 11.010 -3.857 414 HE1 PHE 64 2HE PHE 64 -11.590 13.340 -6.897 415 HE2 PHE 64 1HE PHE 64 -10.007 9.701 -5.252 416 HZ PHE 64 HZ PHE 64 -11.634 10.864 -6.732 417 HA PRO 65 HA PRO 65 -4.764 15.186 -6.986 418 HB3 PRO 65 2HB PRO 65 -2.850 15.045 -5.674 419 HG3 PRO 65 2HG PRO 65 -2.754 13.539 -3.784 420 HD3 PRO 65 2HD PRO 65 -4.485 15.148 -3.457 421 H GLU 66 H GLU 66 -3.643 13.048 -8.199 422 HA GLU 66 HA GLU 66 -5.775 11.065 -8.672 423 HB3 GLU 66 2HB GLU 66 -5.823 12.807 -10.404 424 HG3 GLU 66 2HG GLU 66 -3.082 11.841 -11.197 425 H ILE 67 H ILE 67 -4.721 9.141 -9.943 426 HA ILE 67 HA ILE 67 -1.845 8.894 -9.490 427 HB ILE 67 HB ILE 67 -2.085 6.506 -8.882 428 HG13 ILE 67 2HG1 ILE 67 -4.398 6.162 -9.779 429 HG21 ILE 67 1HG2 ILE 67 -3.387 8.404 -6.885 430 HG22 ILE 67 2HG2 ILE 67 -2.539 6.889 -6.512 431 HG23 ILE 67 3HG2 ILE 67 -1.652 8.248 -7.192 432 HD11 ILE 67 3HD1 ILE 67 -4.253 5.428 -6.840 433 HD12 ILE 67 1HD1 ILE 67 -5.188 4.630 -8.111 434 HD13 ILE 67 2HD1 ILE 67 -3.417 4.537 -8.136 435 H GLN 68 H GLN 68 -1.033 7.032 -10.917 436 HA GLN 68 HA GLN 68 -2.491 7.184 -13.506 437 HB3 GLN 68 2HB GLN 68 -0.281 7.038 -14.551 438 HG3 GLN 68 2HG GLN 68 0.178 8.897 -12.198 439 HE21 GLN 68 1HE2 GLN 68 0.021 10.996 -14.212 440 HE22 GLN 68 2HE2 GLN 68 1.526 11.048 -15.100 441 H LEU 69 H LEU 69 -2.771 5.098 -11.406 442 HA LEU 69 HA LEU 69 -1.625 2.758 -12.654 443 HB3 LEU 69 2HB LEU 69 -3.599 2.391 -10.462 444 HG LEU 69 HG LEU 69 -1.800 1.119 -9.385 445 HD11 LEU 69 1HD1 LEU 69 -1.778 0.409 -12.316 446 HD12 LEU 69 2HD1 LEU 69 -3.161 0.093 -11.239 447 HD13 LEU 69 3HD1 LEU 69 -1.571 -0.684 -10.937 448 HD21 LEU 69 3HD2 LEU 69 0.002 2.650 -10.196 449 HD22 LEU 69 1HD2 LEU 69 0.004 1.811 -11.735 450 HD23 LEU 69 2HD2 LEU 69 0.414 0.922 -10.257 451 H ASP 70 H ASP 70 -2.966 1.077 -13.256 452 HA ASP 70 HA ASP 70 -5.271 1.731 -14.872 453 HB3 ASP 70 2HB ASP 70 -5.212 -0.762 -15.326 454 H ASN 71 H ASN 71 -7.441 0.688 -14.538 455 HA ASN 71 HA ASN 71 -8.071 0.332 -11.653 456 HB3 ASN 71 2HB ASN 71 -9.980 0.322 -14.002 457 HD21 ASN 71 1HD2 ASN 71 -10.245 1.784 -10.684 458 HD22 ASN 71 2HD2 ASN 71 -11.627 0.793 -10.283 459 H ILE 72 H ILE 72 -8.210 -1.606 -10.871 460 HA ILE 72 HA ILE 72 -8.255 -4.072 -12.534 461 HB ILE 72 HB ILE 72 -6.096 -3.111 -10.604 462 HG13 ILE 72 2HG1 ILE 72 -5.866 -2.474 -13.008 463 HG21 ILE 72 1HG2 ILE 72 -6.720 -5.417 -9.957 464 HG22 ILE 72 2HG2 ILE 72 -6.492 -5.942 -11.640 465 HG23 ILE 72 3HG2 ILE 72 -5.109 -5.373 -10.669 466 HD11 ILE 72 3HD1 ILE 72 -3.807 -4.609 -12.384 467 HD12 ILE 72 1HD1 ILE 72 -3.686 -3.314 -13.573 468 HD13 ILE 72 2HD1 ILE 72 -3.729 -2.905 -11.861 469 H ASP 73 H ASP 73 -9.284 -5.723 -11.548 470 HA ASP 73 HA ASP 73 -11.040 -5.140 -9.387 471 HB3 ASP 73 2HB ASP 73 -11.317 -7.775 -9.558 472 H TYR 74 H TYR 74 -10.134 -4.795 -7.359 473 HA TYR 74 HA TYR 74 -7.918 -6.469 -6.477 474 HB3 TYR 74 2HB TYR 74 -8.081 -5.187 -4.370 475 HD1 TYR 74 1HD TYR 74 -6.264 -5.244 -6.730 476 HD2 TYR 74 2HD TYR 74 -8.939 -2.141 -5.336 477 HE1 TYR 74 1HE TYR 74 -5.010 -3.606 -8.003 478 HE2 TYR 74 2HE TYR 74 -7.574 -0.452 -6.507 479 HH TYR 74 HH TYR 74 -4.764 -1.425 -8.577 480 H ASN 75 H ASN 75 -11.239 -7.197 -6.572 481 HA ASN 75 HA ASN 75 -11.449 -8.503 -4.062 482 HB3 ASN 75 2HB ASN 75 -13.400 -9.537 -5.691 483 HD21 ASN 75 1HD2 ASN 75 -13.118 -8.565 -3.011 484 HD22 ASN 75 2HD2 ASN 75 -14.276 -7.308 -2.745 485 H ASN 76 H ASN 76 -9.214 -9.283 -6.143 486 HA ASN 76 HA ASN 76 -9.701 -12.201 -6.346 487 HB3 ASN 76 2HB ASN 76 -7.768 -12.087 -7.922 488 HD21 ASN 76 1HD2 ASN 76 -9.436 -9.073 -8.796 489 HD22 ASN 76 2HD2 ASN 76 -10.474 -9.846 -9.961 490 H TYR 77 H TYR 77 -8.003 -9.961 -4.326 491 HA TYR 77 HA TYR 77 -5.648 -11.767 -4.030 492 HB3 TYR 77 2HB TYR 77 -4.353 -9.858 -3.428 493 HD1 TYR 77 2HD TYR 77 -6.798 -8.192 -5.609 494 HD2 TYR 77 1HD TYR 77 -3.185 -10.522 -5.545 495 HE1 TYR 77 2HE TYR 77 -6.568 -7.885 -8.063 496 HE2 TYR 77 1HE TYR 77 -2.901 -10.150 -7.985 497 HH TYR 77 HH TYR 77 -5.339 -8.431 -9.952 498 H ASP 78 H ASP 78 -4.943 -12.216 -1.917 499 HA ASP 78 HA ASP 78 -7.110 -11.894 0.129 500 HB3 ASP 78 2HB ASP 78 -4.824 -13.853 0.325 501 H LEU 79 H LEU 79 -3.932 -10.899 -0.635 502 HA LEU 79 HA LEU 79 -3.741 -9.331 1.847 503 HB3 LEU 79 2HB LEU 79 -1.628 -11.107 0.598 504 HG LEU 79 HG LEU 79 -0.594 -8.893 1.145 505 HD11 LEU 79 1HD1 LEU 79 -1.945 -8.136 3.055 506 HD12 LEU 79 2HD1 LEU 79 -0.255 -8.337 3.565 507 HD13 LEU 79 3HD1 LEU 79 -1.448 -9.564 3.996 508 HD21 LEU 79 3HD2 LEU 79 0.269 -11.132 3.005 509 HD22 LEU 79 1HD2 LEU 79 1.274 -9.863 2.283 510 HD23 LEU 79 2HD2 LEU 79 0.597 -11.123 1.263 511 H ILE 80 H ILE 80 -3.087 -7.194 1.314 512 HA ILE 80 HA ILE 80 -1.854 -6.757 -1.328 513 HB ILE 80 HB ILE 80 -4.186 -5.094 -0.317 514 HG13 ILE 80 2HG1 ILE 80 -4.935 -7.227 -1.279 515 HG21 ILE 80 1HG2 ILE 80 -2.393 -3.743 -1.437 516 HG22 ILE 80 2HG2 ILE 80 -2.479 -4.814 -2.845 517 HG23 ILE 80 3HG2 ILE 80 -3.858 -3.788 -2.394 518 HD11 ILE 80 3HD1 ILE 80 -5.305 -5.142 -3.456 519 HD12 ILE 80 1HD1 ILE 80 -6.295 -6.564 -3.143 520 HD13 ILE 80 2HD1 ILE 80 -6.271 -5.249 -1.959 521 H LEU 81 H LEU 81 0.070 -5.874 -0.949 522 HA LEU 81 HA LEU 81 0.643 -4.406 1.534 523 HB3 LEU 81 2HB LEU 81 2.895 -4.304 0.077 524 HG LEU 81 HG LEU 81 2.720 -5.461 2.201 525 HD11 LEU 81 1HD1 LEU 81 2.286 -7.866 2.326 526 HD12 LEU 81 2HD1 LEU 81 1.765 -7.862 0.625 527 HD13 LEU 81 3HD1 LEU 81 0.846 -6.960 1.857 528 HD21 LEU 81 3HD2 LEU 81 4.779 -5.643 0.756 529 HD22 LEU 81 1HD2 LEU 81 4.121 -7.135 0.063 530 HD23 LEU 81 2HD2 LEU 81 4.548 -7.064 1.788 531 H ILE 82 H ILE 82 1.079 -2.211 1.576 532 HA ILE 82 HA ILE 82 1.139 -0.710 -0.945 533 HB ILE 82 HB ILE 82 -0.442 -0.034 1.544 534 HG13 ILE 82 2HG1 ILE 82 -1.113 -0.992 -1.222 535 HG21 ILE 82 1HG2 ILE 82 0.126 1.778 -0.834 536 HG22 ILE 82 2HG2 ILE 82 -1.105 2.063 0.419 537 HG23 ILE 82 3HG2 ILE 82 0.588 2.055 0.873 538 HD11 ILE 82 3HD1 ILE 82 -3.186 -1.721 -0.131 539 HD12 ILE 82 1HD1 ILE 82 -1.802 -2.221 0.862 540 HD13 ILE 82 2HD1 ILE 82 -2.773 -0.808 1.332 541 H GLY 83 H GLY 83 2.424 1.293 -0.842 542 HA2 GLY 83 1HA GLY 83 4.003 1.764 1.576 543 HA3 GLY 83 2HA GLY 83 4.935 1.360 0.156 544 H SER 84 H SER 84 4.624 4.207 1.587 545 HA SER 84 HA SER 84 4.541 5.593 -0.952 546 HB3 SER 84 2HB SER 84 2.113 5.376 0.351 547 HG SER 84 HG SER 84 2.568 6.883 1.934 548 HA PRO 85 HA PRO 85 7.516 8.104 1.136 549 HB3 PRO 85 2HB PRO 85 7.963 9.740 -0.380 550 HG3 PRO 85 2HG PRO 85 6.702 9.026 -2.214 551 HD3 PRO 85 2HD PRO 85 5.062 7.511 -1.730 552 H VAL 86 H VAL 86 7.974 9.474 2.855 553 HA VAL 86 HA VAL 86 5.830 10.797 4.354 554 HB VAL 86 HB VAL 86 8.831 10.498 4.621 555 HG11 VAL 86 1HG1 VAL 86 7.124 12.284 6.391 556 HG12 VAL 86 2HG1 VAL 86 8.766 11.695 6.750 557 HG13 VAL 86 3HG1 VAL 86 8.527 12.778 5.393 558 HG21 VAL 86 3HG2 VAL 86 8.002 9.550 6.844 559 HG22 VAL 86 1HG2 VAL 86 6.361 9.843 6.290 560 HG23 VAL 86 2HG2 VAL 86 7.410 8.724 5.388 561 H TRP 87 H TRP 87 5.992 13.202 4.647 562 HA TRP 87 HA TRP 87 7.432 14.800 2.720 563 HB3 TRP 87 2HB TRP 87 4.743 15.855 3.173 564 HD1 TRP 87 HD TRP 87 7.724 16.184 1.015 565 HE1 TRP 87 1HE TRP 87 7.078 17.660 -1.069 566 HE3 TRP 87 3HE TRP 87 2.612 16.155 1.386 567 HZ2 TRP 87 2HZ TRP 87 4.860 18.605 -2.292 568 HZ3 TRP 87 3HZ TRP 87 1.241 17.472 -0.234 569 HH2 TRP 87 HH TRP 87 2.354 18.814 -1.959 570 H SER 88 H SER 88 6.345 17.318 3.861 571 HA SER 88 HA SER 88 7.979 17.525 6.137 572 HB3 SER 88 2HB SER 88 5.791 19.514 5.589 573 HG SER 88 HG SER 88 7.196 20.745 6.515 574 H GLY 89 H GLY 89 5.752 15.526 6.627 575 HA2 GLY 89 1HA GLY 89 5.515 15.222 9.141 576 HA3 GLY 89 2HA GLY 89 4.409 16.583 9.078 577 H TYR 90 H TYR 90 3.642 15.521 6.250 578 HA TYR 90 HA TYR 90 1.756 13.384 7.056 579 HB3 TYR 90 2HB TYR 90 -0.076 14.705 6.708 580 HD1 TYR 90 2HD TYR 90 2.288 17.587 6.138 581 HD2 TYR 90 1HD TYR 90 -0.397 15.642 8.903 582 HE1 TYR 90 2HE TYR 90 2.758 19.329 7.788 583 HE2 TYR 90 1HE TYR 90 0.098 17.386 10.585 584 HH TYR 90 HH TYR 90 1.676 19.030 11.161 585 HA PRO 91 HA PRO 91 3.107 12.439 2.854 586 HB3 PRO 91 2HB PRO 91 2.467 10.288 2.943 587 HG3 PRO 91 2HG PRO 91 0.831 9.626 4.515 588 HD3 PRO 91 2HD PRO 91 1.808 11.236 5.918 589 H ALA 92 H ALA 92 2.473 12.704 0.611 590 HA ALA 92 HA ALA 92 0.934 15.094 0.174 591 HB1 ALA 92 1HB ALA 92 1.834 15.017 -2.024 592 HB2 ALA 92 2HB ALA 92 3.125 14.414 -0.964 593 HB3 ALA 92 3HB ALA 92 2.157 13.272 -1.915 594 H THR 93 H THR 93 -0.691 12.964 1.142 595 HA THR 93 HA THR 93 -2.405 11.468 0.749 596 HB THR 93 HB THR 93 -4.280 12.557 -0.517 597 HG1 THR 93 1HG THR 93 -2.295 13.942 -1.630 598 HG21 THR 93 3HG2 THR 93 -3.977 13.150 1.834 599 HG22 THR 93 1HG2 THR 93 -4.503 14.548 0.907 600 HG23 THR 93 2HG2 THR 93 -2.800 14.435 1.402 601 HA PRO 94 HA PRO 94 -1.085 9.971 -3.537 602 HB3 PRO 94 2HB PRO 94 1.209 9.638 -3.146 603 HG3 PRO 94 2HG PRO 94 1.994 9.130 -0.939 604 HD3 PRO 94 2HD PRO 94 0.725 11.060 -0.691 605 H ILE 95 H ILE 95 -1.800 8.086 -0.579 606 HA ILE 95 HA ILE 95 -2.585 5.801 -2.230 607 HB ILE 95 HB ILE 95 -2.557 6.173 0.782 608 HG13 ILE 95 2HG1 ILE 95 -0.548 4.625 0.629 609 HG21 ILE 95 1HG2 ILE 95 -2.925 3.647 -0.881 610 HG22 ILE 95 2HG2 ILE 95 -2.639 3.692 0.875 611 HG23 ILE 95 3HG2 ILE 95 -4.099 4.388 0.219 612 HD11 ILE 95 3HD1 ILE 95 -0.769 3.985 -1.852 613 HD12 ILE 95 1HD1 ILE 95 -0.223 5.634 -2.233 614 HD13 ILE 95 2HD1 ILE 95 0.829 4.540 -1.341 615 H LYS 96 H LYS 96 -4.256 8.640 -1.063 616 HA LYS 96 HA LYS 96 -6.776 7.623 -0.414 617 HB3 LYS 96 2HB LYS 96 -5.968 10.230 -1.713 618 HG3 LYS 96 2HG LYS 96 -8.446 9.592 -1.959 619 HD3 LYS 96 2HD LYS 96 -8.611 8.737 0.508 620 HE3 LYS 96 2HE LYS 96 -8.995 11.746 0.907 621 HZ1 LYS 96 3HZ LYS 96 -9.054 11.249 3.167 622 HZ2 LYS 96 1HZ LYS 96 -8.722 9.635 2.946 623 HZ3 LYS 96 2HZ LYS 96 -10.163 10.253 2.469 624 H THR 97 H THR 97 -5.610 8.625 -3.711 625 HA THR 97 HA THR 97 -8.109 7.812 -4.809 626 HB THR 97 HB THR 97 -5.526 8.276 -6.297 627 HG1 THR 97 1HG THR 97 -5.535 10.019 -5.098 628 HG21 THR 97 3HG2 THR 97 -7.416 7.766 -7.816 629 HG22 THR 97 1HG2 THR 97 -7.053 9.490 -7.928 630 HG23 THR 97 2HG2 THR 97 -8.436 8.947 -6.974 631 H LEU 98 H LEU 98 -5.606 5.833 -3.794 632 HA LEU 98 HA LEU 98 -6.329 3.632 -5.701 633 HB3 LEU 98 2HB LEU 98 -4.226 3.872 -3.529 634 HG LEU 98 HG LEU 98 -4.989 1.654 -3.108 635 HD11 LEU 98 1HD1 LEU 98 -4.909 0.003 -5.223 636 HD12 LEU 98 2HD1 LEU 98 -5.395 1.479 -6.078 637 HD13 LEU 98 3HD1 LEU 98 -6.379 0.837 -4.766 638 HD21 LEU 98 3HD2 LEU 98 -2.540 2.012 -3.391 639 HD22 LEU 98 1HD2 LEU 98 -2.683 1.494 -5.086 640 HD23 LEU 98 2HD2 LEU 98 -3.044 0.358 -3.764 641 H LEU 99 H LEU 99 -6.301 4.425 -2.212 642 HA LEU 99 HA LEU 99 -7.710 2.178 -1.272 643 HB3 LEU 99 2HB LEU 99 -6.208 3.896 -0.240 644 HG LEU 99 HG LEU 99 -8.100 5.745 -0.305 645 HD11 LEU 99 1HD1 LEU 99 -9.443 5.629 1.814 646 HD12 LEU 99 2HD1 LEU 99 -8.819 3.982 2.046 647 HD13 LEU 99 3HD1 LEU 99 -9.800 4.317 0.646 648 HD21 LEU 99 3HD2 LEU 99 -6.447 5.039 2.130 649 HD22 LEU 99 1HD2 LEU 99 -7.127 6.657 1.777 650 HD23 LEU 99 2HD2 LEU 99 -5.873 5.970 0.754 651 H ASP 100 H ASP 100 -9.076 5.208 -2.474 652 HA ASP 100 HA ASP 100 -11.764 4.371 -1.752 653 HB3 ASP 100 2HB ASP 100 -11.610 6.173 -4.074 654 H GLN 101 H GLN 101 -9.700 3.561 -4.491 655 HA GLN 101 HA GLN 101 -11.825 2.182 -5.970 656 HB3 GLN 101 2HB GLN 101 -10.050 1.421 -7.449 657 HG3 GLN 101 2HG GLN 101 -9.595 4.354 -6.890 658 HE21 GLN 101 1HE2 GLN 101 -7.670 4.889 -7.868 659 HE22 GLN 101 2HE2 GLN 101 -7.066 4.209 -9.372 660 H MET 102 H MET 102 -10.585 1.475 -2.999 661 HA MET 102 HA MET 102 -10.346 -1.460 -3.546 662 HB3 MET 102 2HB MET 102 -9.145 -1.641 -1.434 663 HG3 MET 102 2HG MET 102 -7.823 0.522 -3.057 664 HE1 MET 102 3HE MET 102 -5.531 -2.872 -0.939 665 HE2 MET 102 1HE MET 102 -7.311 -2.866 -0.927 666 HE3 MET 102 2HE MET 102 -6.441 -2.971 -2.458 667 H LYS 103 H LYS 103 -12.754 0.584 -2.676 668 HA LYS 103 HA LYS 103 -13.299 -0.232 0.041 669 HB3 LYS 103 2HB LYS 103 -15.449 1.144 -0.452 670 HG3 LYS 103 2HG LYS 103 -13.988 3.194 -1.450 671 HD3 LYS 103 2HD LYS 103 -13.938 2.263 1.432 672 HE3 LYS 103 2HE LYS 103 -13.076 4.707 -0.090 673 HZ1 LYS 103 3HZ LYS 103 -14.693 5.553 1.524 674 HZ2 LYS 103 1HZ LYS 103 -13.138 5.966 1.918 675 HZ3 LYS 103 2HZ LYS 103 -13.921 4.763 2.730 676 H ASN 104 H ASN 104 -13.549 -2.296 -2.385 677 HA ASN 104 HA ASN 104 -15.904 -3.655 -1.159 678 HB3 ASN 104 2HB ASN 104 -15.788 -4.915 -3.536 679 HD21 ASN 104 1HD2 ASN 104 -16.782 -1.696 -2.222 680 HD22 ASN 104 2HD2 ASN 104 -18.353 -1.741 -2.933 681 H TYR 105 H TYR 105 -12.656 -3.588 -1.094 682 HA TYR 105 HA TYR 105 -11.879 -6.317 -1.591 683 HB3 TYR 105 2HB TYR 105 -10.670 -4.027 0.019 684 HD1 TYR 105 1HD TYR 105 -9.231 -6.732 -2.162 685 HD2 TYR 105 2HD TYR 105 -9.399 -4.991 1.789 686 HE1 TYR 105 1HE TYR 105 -7.338 -8.147 -1.445 687 HE2 TYR 105 2HE TYR 105 -7.506 -6.401 2.492 688 HH TYR 105 HH TYR 105 -5.708 -7.793 1.707 689 H ARG 106 H ARG 106 -11.220 -7.850 0.024 690 HA ARG 106 HA ARG 106 -11.516 -7.374 2.783 691 HB3 ARG 106 2HB ARG 106 -13.660 -8.171 2.405 692 HG3 ARG 106 2HG ARG 106 -12.820 -9.923 0.558 693 HD3 ARG 106 2HD ARG 106 -12.897 -11.450 3.178 694 HE ARG 106 HE ARG 106 -12.711 -12.820 0.557 695 HH11 ARG 106 1HH1 ARG 106 -14.905 -12.015 3.248 696 HH12 ARG 106 2HH1 ARG 106 -15.932 -13.393 2.999 697 HH21 ARG 106 1HH2 ARG 106 -14.136 -14.410 0.118 698 HH22 ARG 106 2HH2 ARG 106 -15.546 -14.755 1.134 699 H GLY 107 H GLY 107 -9.968 -8.805 3.849 700 HA2 GLY 107 1HA GLY 107 -8.321 -10.762 3.398 701 HA3 GLY 107 2HA GLY 107 -7.853 -9.758 2.012 702 H GLU 108 H GLU 108 -5.739 -9.832 3.390 703 HA GLU 108 HA GLU 108 -5.808 -7.963 5.737 704 HB3 GLU 108 2HB GLU 108 -3.522 -8.825 6.158 705 HG3 GLU 108 2HG GLU 108 -5.540 -11.097 5.924 706 H VAL 109 H VAL 109 -4.166 -6.208 5.842 707 HA VAL 109 HA VAL 109 -3.075 -5.387 3.240 708 HB VAL 109 HB VAL 109 -4.705 -3.489 4.985 709 HG11 VAL 109 1HG1 VAL 109 -2.985 -2.549 3.360 710 HG12 VAL 109 2HG1 VAL 109 -3.908 -3.286 2.052 711 HG13 VAL 109 3HG1 VAL 109 -4.640 -2.024 3.067 712 HG21 VAL 109 3HG2 VAL 109 -5.693 -4.931 2.489 713 HG22 VAL 109 1HG2 VAL 109 -6.346 -5.112 4.136 714 HG23 VAL 109 2HG2 VAL 109 -6.517 -3.574 3.301 715 H ALA 110 H ALA 110 -1.135 -4.200 3.527 716 HA ALA 110 HA ALA 110 -0.446 -3.301 6.260 717 HB1 ALA 110 1HB ALA 110 1.774 -4.282 6.119 718 HB2 ALA 110 2HB ALA 110 0.570 -5.562 5.985 719 HB3 ALA 110 3HB ALA 110 1.399 -4.994 4.524 720 H SER 111 H SER 111 1.256 -1.604 6.173 721 HA SER 111 HA SER 111 1.417 -0.243 3.542 722 HB3 SER 111 2HB SER 111 0.153 0.896 6.059 723 HG SER 111 HG SER 111 -0.360 2.606 4.686 724 H PHE 112 H PHE 112 3.414 0.646 3.308 725 HA PHE 112 HA PHE 112 5.094 1.172 5.751 726 HB3 PHE 112 2HB PHE 112 6.853 0.052 4.818 727 HD1 PHE 112 1HD PHE 112 5.073 -1.377 6.379 728 HD2 PHE 112 2HD PHE 112 5.443 -1.572 2.109 729 HE1 PHE 112 1HE PHE 112 3.898 -3.545 6.389 730 HE2 PHE 112 2HE PHE 112 4.446 -3.893 2.153 731 HZ PHE 112 HZ PHE 112 3.669 -4.855 4.291 732 H PHE 113 H PHE 113 7.271 2.288 4.873 733 HA PHE 113 HA PHE 113 6.930 4.370 3.001 734 HB3 PHE 113 2HB PHE 113 5.223 5.172 4.607 735 HD1 PHE 113 1HD PHE 113 6.392 3.149 6.799 736 HD2 PHE 113 2HD PHE 113 6.195 7.440 6.378 737 HE1 PHE 113 1HE PHE 113 6.516 3.383 9.208 738 HE2 PHE 113 2HE PHE 113 6.532 7.672 8.800 739 HZ PHE 113 HZ PHE 113 6.556 5.646 10.261 740 H THR 114 H THR 114 8.609 6.086 3.327 741 HA THR 114 HA THR 114 11.064 5.111 4.698 742 HB THR 114 HB THR 114 12.179 6.336 2.680 743 HG1 THR 114 1HG THR 114 10.274 7.226 1.731 744 HG21 THR 114 3HG2 THR 114 12.129 3.873 3.091 745 HG22 THR 114 1HG2 THR 114 12.173 4.295 1.361 746 HG23 THR 114 2HG2 THR 114 10.658 3.747 2.123 747 H SER 115 H SER 115 12.556 7.038 5.278 748 HA SER 115 HA SER 115 11.494 9.665 4.865 749 HB3 SER 115 2HB SER 115 10.906 10.360 6.957 750 HG SER 115 HG SER 115 9.681 8.423 6.416 751 H ALA 116 H ALA 116 12.984 11.266 6.031 752 HA ALA 116 HA ALA 116 15.778 10.472 5.885 753 HB1 ALA 116 1HB ALA 116 16.110 12.945 5.985 754 HB2 ALA 116 2HB ALA 116 14.923 12.539 4.745 755 HB3 ALA 116 3HB ALA 116 14.371 13.145 6.323 756 H GLY 117 H GLY 117 14.146 9.372 8.016 757 HA2 GLY 117 1HA GLY 117 14.584 8.825 10.143 758 HA3 GLY 117 2HA GLY 117 15.896 10.002 10.136 759 H THR 118 H THR 118 12.735 11.236 9.352 760 HA THR 118 HA THR 118 12.047 12.060 12.062 761 HB THR 118 HB THR 118 11.682 14.444 10.760 762 HG1 THR 118 1HG THR 118 12.914 14.424 9.052 763 HG21 THR 118 3HG2 THR 118 14.189 13.599 12.260 764 HG22 THR 118 1HG2 THR 118 12.663 14.147 12.991 765 HG23 THR 118 2HG2 THR 118 13.622 15.262 12.014 766 H ASN 119 H ASN 119 9.802 13.070 12.004 767 HA ASN 119 HA ASN 119 7.650 13.045 11.499 768 HB3 ASN 119 2HB ASN 119 6.892 13.472 9.286 769 HD21 ASN 119 1HD2 ASN 119 7.019 15.777 10.005 770 HD22 ASN 119 2HD2 ASN 119 8.401 16.706 9.555 771 H HIS 120 H HIS 120 9.289 10.400 11.521 772 HA HIS 120 HA HIS 120 8.012 8.384 10.087 773 HB3 HIS 120 2HB HIS 120 9.383 8.359 12.799 774 HD1 HIS 120 1HD HIS 120 9.281 5.635 10.029 775 HD2 HIS 120 2HD HIS 120 8.561 6.292 14.142 776 HE1 HIS 120 1HE HIS 120 8.793 3.351 11.087 777 H LYS 121 H LYS 121 7.495 8.994 13.621 778 HA LYS 121 HA LYS 121 5.309 7.330 13.848 779 HB3 LYS 121 2HB LYS 121 5.765 9.734 15.630 780 HG3 LYS 121 2HG LYS 121 5.291 6.774 16.018 781 HD3 LYS 121 2HD LYS 121 5.106 7.419 18.485 782 HE3 LYS 121 2HE LYS 121 7.887 7.459 17.248 783 HZ1 LYS 121 3HZ LYS 121 8.218 6.197 19.475 784 HZ2 LYS 121 1HZ LYS 121 6.893 7.002 19.977 785 HZ3 LYS 121 2HZ LYS 121 8.206 7.849 19.518 786 H ALA 122 H ALA 122 5.337 10.817 13.147 787 HA ALA 122 HA ALA 122 2.630 11.408 13.364 788 HB1 ALA 122 1HB ALA 122 4.356 13.139 13.092 789 HB2 ALA 122 2HB ALA 122 4.681 12.582 11.426 790 HB3 ALA 122 3HB ALA 122 3.121 13.297 11.837 791 H TYR 123 H TYR 123 4.427 10.098 10.511 792 HA TYR 123 HA TYR 123 2.264 10.156 8.633 793 HB3 TYR 123 2HB TYR 123 4.511 8.168 8.964 794 HD1 TYR 123 1HD TYR 123 2.942 6.305 8.061 795 HD2 TYR 123 2HD TYR 123 4.040 9.827 5.808 796 HE1 TYR 123 1HE TYR 123 2.248 5.174 5.977 797 HE2 TYR 123 2HE TYR 123 3.460 8.626 3.711 798 HH TYR 123 HH TYR 123 2.215 5.323 3.544 799 H VAL 124 H VAL 124 3.163 7.710 11.171 800 HA VAL 124 HA VAL 124 1.382 5.695 10.300 801 HB VAL 124 HB VAL 124 2.150 6.184 13.197 802 HG11 VAL 124 1HG1 VAL 124 2.060 3.768 13.364 803 HG12 VAL 124 2HG1 VAL 124 0.553 4.346 12.643 804 HG13 VAL 124 3HG1 VAL 124 1.781 3.608 11.612 805 HG21 VAL 124 3HG2 VAL 124 3.848 4.947 10.991 806 HG22 VAL 124 1HG2 VAL 124 4.255 6.359 11.979 807 HG23 VAL 124 2HG2 VAL 124 4.177 4.782 12.744 808 H SER 125 H SER 125 0.873 8.479 12.528 809 HA SER 125 HA SER 125 -1.955 7.814 12.940 810 HB3 SER 125 2HB SER 125 -1.867 10.359 13.663 811 HG SER 125 HG SER 125 -2.049 8.789 15.115 812 H HIS 126 H HIS 126 -0.264 10.271 10.897 813 HA HIS 126 HA HIS 126 -2.661 11.388 9.924 814 HB3 HIS 126 2HB HIS 126 -1.181 12.381 8.163 815 HD1 HIS 126 1HD HIS 126 1.661 13.450 9.551 816 HD2 HIS 126 2HD HIS 126 -2.180 13.063 11.275 817 HE1 HIS 126 1HE HIS 126 1.524 15.151 11.401 818 H PHE 127 H PHE 127 -0.801 8.650 8.652 819 HA PHE 127 HA PHE 127 -2.054 8.334 6.126 820 HB3 PHE 127 2HB PHE 127 -0.862 6.326 8.049 821 HD1 PHE 127 1HD PHE 127 -1.057 6.792 4.291 822 HD2 PHE 127 2HD PHE 127 -1.798 4.198 7.671 823 HE1 PHE 127 1HE PHE 127 -1.773 4.984 2.764 824 HE2 PHE 127 2HE PHE 127 -2.509 2.413 6.143 825 HZ PHE 127 HZ PHE 127 -2.542 2.806 3.669 826 H ASN 128 H ASN 128 -2.853 6.976 9.331 827 HA ASN 128 HA ASN 128 -5.082 5.439 8.589 828 HB3 ASN 128 2HB ASN 128 -5.811 6.099 11.096 829 HD21 ASN 128 1HD2 ASN 128 -2.496 5.141 11.459 830 HD22 ASN 128 2HD2 ASN 128 -2.817 3.431 11.462 831 H GLU 129 H GLU 129 -5.117 8.832 9.798 832 HA GLU 129 HA GLU 129 -7.883 9.155 9.868 833 HB3 GLU 129 2HB GLU 129 -7.388 11.596 9.634 834 HG3 GLU 129 2HG GLU 129 -5.331 10.190 11.382 835 H TRP 130 H TRP 130 -5.837 9.199 7.051 836 HA TRP 130 HA TRP 130 -8.067 10.143 5.276 837 HB3 TRP 130 2HB TRP 130 -6.340 10.757 3.705 838 HD1 TRP 130 HD TRP 130 -7.638 12.166 6.639 839 HE1 TRP 130 1HE TRP 130 -6.620 14.363 7.387 840 HE3 TRP 130 3HE TRP 130 -3.446 12.143 3.718 841 HZ2 TRP 130 2HZ TRP 130 -4.017 15.624 7.215 842 HZ3 TRP 130 3HZ TRP 130 -1.651 13.829 4.095 843 HH2 TRP 130 HH TRP 130 -1.922 15.540 5.884 844 H ALA 131 H ALA 131 -6.957 7.253 6.363 845 HA ALA 131 HA ALA 131 -7.468 5.869 3.828 846 HB1 ALA 131 1HB ALA 131 -5.388 4.541 4.038 847 HB2 ALA 131 2HB ALA 131 -4.970 6.267 4.011 848 HB3 ALA 131 3HB ALA 131 -4.988 5.362 5.543 849 H ASP 132 H ASP 132 -8.944 6.125 6.389 850 HA ASP 132 HA ASP 132 -8.338 3.891 7.985 851 HB3 ASP 132 2HB ASP 132 -10.905 5.491 8.173 852 H GLY 133 H GLY 133 -9.069 2.889 5.482 853 HA2 GLY 133 1HA GLY 133 -11.943 2.266 5.530 854 HA3 GLY 133 2HA GLY 133 -10.866 2.175 4.140 855 H LEU 134 H LEU 134 -8.959 0.260 5.534 856 HA LEU 134 HA LEU 134 -10.677 -2.184 5.477 857 HB3 LEU 134 2HB LEU 134 -8.837 -3.234 4.105 858 HG LEU 134 HG LEU 134 -9.399 -2.545 1.924 859 HD11 LEU 134 1HD1 LEU 134 -11.749 -2.787 1.846 860 HD12 LEU 134 2HD1 LEU 134 -11.940 -2.310 3.549 861 HD13 LEU 134 3HD1 LEU 134 -11.114 -3.823 3.123 862 HD21 LEU 134 3HD2 LEU 134 -9.252 -0.055 2.277 863 HD22 LEU 134 1HD2 LEU 134 -10.969 -0.137 2.757 864 HD23 LEU 134 2HD2 LEU 134 -10.478 -0.675 1.153 865 H ASN 135 H ASN 135 -9.379 -4.127 6.224 866 HA ASN 135 HA ASN 135 -8.346 -3.624 8.852 867 HB3 ASN 135 2HB ASN 135 -8.514 -6.139 7.165 868 HD21 ASN 135 1HD2 ASN 135 -6.579 -7.137 7.765 869 HD22 ASN 135 2HD2 ASN 135 -6.240 -7.658 9.411 870 H VAL 136 H VAL 136 -6.396 -2.693 9.153 871 HA VAL 136 HA VAL 136 -4.027 -3.278 7.561 872 HB VAL 136 HB VAL 136 -4.485 -1.680 10.115 873 HG11 VAL 136 1HG1 VAL 136 -2.047 -1.729 8.302 874 HG12 VAL 136 2HG1 VAL 136 -2.366 -0.530 9.574 875 HG13 VAL 136 3HG1 VAL 136 -2.138 -2.214 10.019 876 HG21 VAL 136 3HG2 VAL 136 -4.297 -0.760 7.229 877 HG22 VAL 136 1HG2 VAL 136 -5.727 -0.673 8.277 878 HG23 VAL 136 2HG2 VAL 136 -4.316 0.313 8.644 879 H ILE 137 H ILE 137 -2.286 -4.622 8.231 880 HA ILE 137 HA ILE 137 -2.510 -6.039 10.818 881 HB ILE 137 HB ILE 137 -1.706 -7.990 9.681 882 HG13 ILE 137 2HG1 ILE 137 -0.924 -6.100 7.598 883 HG21 ILE 137 1HG2 ILE 137 -3.988 -6.855 8.020 884 HG22 ILE 137 2HG2 ILE 137 -3.671 -8.540 8.473 885 HG23 ILE 137 3HG2 ILE 137 -4.160 -7.377 9.705 886 HD11 ILE 137 3HD1 ILE 137 0.501 -7.830 6.853 887 HD12 ILE 137 1HD1 ILE 137 0.466 -7.869 8.632 888 HD13 ILE 137 2HD1 ILE 137 -0.455 -9.080 7.701 889 H GLY 138 H GLY 138 -0.694 -3.672 9.368 890 HA2 GLY 138 1HA GLY 138 1.071 -3.444 11.412 891 HA3 GLY 138 2HA GLY 138 1.958 -4.451 10.265 892 H VAL 139 H VAL 139 2.282 -1.568 11.189 893 HA VAL 139 HA VAL 139 2.802 -0.513 8.496 894 HB VAL 139 HB VAL 139 1.646 1.180 10.757 895 HG11 VAL 139 1HG1 VAL 139 1.651 3.033 9.236 896 HG12 VAL 139 2HG1 VAL 139 3.289 2.368 9.225 897 HG13 VAL 139 3HG1 VAL 139 2.175 2.032 7.892 898 HG21 VAL 139 3HG2 VAL 139 -0.304 1.464 9.161 899 HG22 VAL 139 1HG2 VAL 139 0.389 0.144 8.188 900 HG23 VAL 139 2HG2 VAL 139 -0.132 -0.147 9.859 901 H ALA 140 H ALA 140 4.996 -0.620 8.442 902 HA ALA 140 HA ALA 140 6.519 0.710 10.571 903 HB1 ALA 140 1HB ALA 140 7.508 -1.922 9.429 904 HB2 ALA 140 2HB ALA 140 8.121 -1.017 10.809 905 HB3 ALA 140 3HB ALA 140 6.555 -1.843 10.921 906 H ARG 141 H ARG 141 8.781 1.309 9.725 907 HA ARG 141 HA ARG 141 8.610 1.983 6.864 908 HB3 ARG 141 2HB ARG 141 9.493 3.513 8.710 909 HG3 ARG 141 2HG ARG 141 12.090 1.995 8.306 910 HD3 ARG 141 2HD ARG 141 11.669 3.317 10.870 911 HE ARG 141 HE ARG 141 13.753 3.215 8.842 912 HH11 ARG 141 1HH1 ARG 141 12.648 4.997 11.701 913 HH12 ARG 141 2HH1 ARG 141 14.229 5.609 12.099 914 HH21 ARG 141 1HH2 ARG 141 15.891 4.003 9.445 915 HH22 ARG 141 2HH2 ARG 141 16.108 4.705 11.016 916 H ASP 142 H ASP 142 10.318 1.327 5.482 917 HA ASP 142 HA ASP 142 11.799 -0.076 4.486 918 HB3 ASP 142 2HB ASP 142 13.765 -0.742 5.771 919 H ASP 143 H ASP 143 13.080 -2.580 5.716 920 HA ASP 143 HA ASP 143 10.731 -4.380 5.440 921 HB3 ASP 143 2HB ASP 143 11.673 -4.214 3.268 922 H SER 144 H SER 144 11.666 -3.847 8.022 923 HA SER 144 HA SER 144 13.307 -5.982 8.968 924 HB3 SER 144 2HB SER 144 12.339 -4.740 11.021 925 HG SER 144 HG SER 144 13.809 -3.053 10.756 926 H GLU 145 H GLU 145 9.780 -5.413 8.409 927 HA GLU 145 HA GLU 145 9.207 -7.765 10.178 928 HB3 GLU 145 2HB GLU 145 6.997 -6.762 10.485 929 HG3 GLU 145 2HG GLU 145 8.825 -4.448 11.037 930 H VAL 146 H VAL 146 9.724 -7.704 7.024 931 HA VAL 146 HA VAL 146 7.211 -8.139 5.800 932 HB VAL 146 HB VAL 146 9.912 -9.270 4.950 933 HG11 VAL 146 1HG1 VAL 146 8.043 -10.227 3.660 934 HG12 VAL 146 2HG1 VAL 146 7.424 -8.603 3.311 935 HG13 VAL 146 3HG1 VAL 146 8.996 -9.145 2.655 936 HG21 VAL 146 3HG2 VAL 146 10.102 -6.824 5.265 937 HG22 VAL 146 1HG2 VAL 146 10.133 -7.245 3.554 938 HG23 VAL 146 2HG2 VAL 146 8.651 -6.570 4.270 939 H ASP 147 H ASP 147 9.255 -10.311 7.608 940 HA ASP 147 HA ASP 147 8.218 -12.821 7.063 941 HB3 ASP 147 2HB ASP 147 9.164 -11.557 9.640 942 H LYS 148 H LYS 148 6.725 -10.229 9.027 943 HA LYS 148 HA LYS 148 4.486 -12.088 9.683 944 HB3 LYS 148 2HB LYS 148 5.485 -10.980 11.577 945 HG3 LYS 148 2HG LYS 148 4.979 -8.415 10.092 946 HD3 LYS 148 2HD LYS 148 5.253 -7.395 12.485 947 HE3 LYS 148 2HE LYS 148 3.378 -6.990 10.950 948 HZ1 LYS 148 3HZ LYS 148 2.000 -9.171 12.422 949 HZ2 LYS 148 1HZ LYS 148 2.275 -9.145 10.799 950 HZ3 LYS 148 2HZ LYS 148 1.233 -8.070 11.479 951 H TRP 149 H TRP 149 5.163 -10.075 7.263 952 HA TRP 149 HA TRP 149 2.309 -9.387 6.875 953 HB3 TRP 149 2HB TRP 149 3.044 -7.856 5.215 954 HD1 TRP 149 HD TRP 149 2.566 -7.713 8.417 955 HE1 TRP 149 1HE TRP 149 3.606 -5.895 9.787 956 HE3 TRP 149 3HE TRP 149 6.172 -6.306 5.152 957 HZ2 TRP 149 2HZ TRP 149 5.462 -3.635 9.296 958 HZ3 TRP 149 3HZ TRP 149 7.641 -4.338 5.628 959 HH2 TRP 149 HH TRP 149 7.235 -2.968 7.629 960 H SER 150 H SER 150 4.576 -11.764 5.711 961 HA SER 150 HA SER 150 2.727 -12.203 3.398 962 HB3 SER 150 2HB SER 150 5.697 -12.795 3.414 963 HG SER 150 HG SER 150 4.181 -13.998 2.090 964 H LYS 151 H LYS 151 3.269 -13.424 6.313 965 HA LYS 151 HA LYS 151 3.244 -16.298 5.790 966 HB3 LYS 151 2HB LYS 151 2.217 -16.181 8.217 967 HG3 LYS 151 2HG LYS 151 5.035 -15.512 7.316 968 HD3 LYS 151 2HD LYS 151 4.684 -14.495 9.570 969 HE3 LYS 151 2HE LYS 151 4.040 -17.357 10.297 970 HZ1 LYS 151 3HZ LYS 151 5.132 -15.202 12.002 971 HZ2 LYS 151 1HZ LYS 151 5.782 -16.691 11.728 972 HZ3 LYS 151 2HZ LYS 151 4.372 -16.524 12.589 Start of MODEL 19 1 H1 GLY 1 H GLY 1 -11.857 -23.163 -0.553 2 HA2 GLY 1 1HA GLY 1 -11.599 -21.528 -2.388 3 HA3 GLY 1 2HA GLY 1 -10.624 -21.118 -0.958 4 H MET 2 H MET 2 -10.003 -20.222 -3.605 5 HA MET 2 HA MET 2 -7.258 -21.255 -3.681 6 HB3 MET 2 2HB MET 2 -8.231 -22.511 -5.461 7 HG3 MET 2 2HG MET 2 -9.012 -19.968 -6.916 8 HE1 MET 2 3HE MET 2 -11.792 -21.365 -8.028 9 HE2 MET 2 1HE MET 2 -10.757 -20.260 -8.962 10 HE3 MET 2 2HE MET 2 -11.231 -21.834 -9.635 11 H ALA 3 H ALA 3 -7.486 -19.321 -2.209 12 HA ALA 3 HA ALA 3 -7.268 -16.748 -3.627 13 HB1 ALA 3 1HB ALA 3 -9.620 -16.956 -2.911 14 HB2 ALA 3 2HB ALA 3 -9.096 -17.408 -1.275 15 HB3 ALA 3 3HB ALA 3 -8.760 -15.784 -1.875 16 H LYS 4 H LYS 4 -4.941 -17.314 -3.212 17 HA LYS 4 HA LYS 4 -4.135 -16.041 -0.741 18 HB3 LYS 4 2HB LYS 4 -3.668 -17.970 0.222 19 HG3 LYS 4 2HG LYS 4 -4.730 -19.493 -1.354 20 HD3 LYS 4 2HD LYS 4 -3.521 -18.914 -3.472 21 HE3 LYS 4 2HE LYS 4 -1.189 -19.053 -2.216 22 HZ1 LYS 4 3HZ LYS 4 -0.144 -21.176 -2.610 23 HZ2 LYS 4 1HZ LYS 4 -1.472 -21.758 -3.368 24 HZ3 LYS 4 2HZ LYS 4 -1.529 -21.480 -1.750 25 H LYS 5 H LYS 5 -3.626 -14.323 -2.077 26 HA LYS 5 HA LYS 5 -1.139 -14.718 -3.650 27 HB3 LYS 5 2HB LYS 5 -1.849 -13.159 -5.383 28 HG3 LYS 5 2HG LYS 5 -3.866 -15.382 -5.295 29 HD3 LYS 5 2HD LYS 5 -3.897 -13.623 -7.194 30 HE3 LYS 5 2HE LYS 5 -1.259 -15.026 -7.814 31 HZ1 LYS 5 3HZ LYS 5 -2.587 -14.556 -9.793 32 HZ2 LYS 5 1HZ LYS 5 -1.186 -13.747 -9.765 33 HZ3 LYS 5 2HZ LYS 5 -2.574 -12.944 -9.460 34 H THR 6 H THR 6 -0.151 -12.619 -4.197 35 HA THR 6 HA THR 6 -0.490 -10.618 -2.041 36 HB THR 6 HB THR 6 2.144 -11.960 -2.682 37 HG1 THR 6 1HG THR 6 0.614 -12.382 -0.367 38 HG21 THR 6 3HG2 THR 6 2.352 -9.714 -1.724 39 HG22 THR 6 1HG2 THR 6 2.892 -10.952 -0.568 40 HG23 THR 6 2HG2 THR 6 1.297 -10.190 -0.373 41 H LEU 7 H LEU 7 -1.131 -9.030 -3.294 42 HA LEU 7 HA LEU 7 0.320 -8.303 -5.817 43 HB3 LEU 7 2HB LEU 7 -2.232 -7.220 -4.642 44 HG LEU 7 HG LEU 7 -0.940 -5.579 -6.112 45 HD11 LEU 7 1HD1 LEU 7 -0.231 -7.683 -7.728 46 HD12 LEU 7 2HD1 LEU 7 -0.265 -6.013 -8.224 47 HD13 LEU 7 3HD1 LEU 7 -1.652 -7.096 -8.593 48 HD21 LEU 7 3HD2 LEU 7 -3.327 -5.368 -5.901 49 HD22 LEU 7 1HD2 LEU 7 -3.604 -6.670 -7.041 50 HD23 LEU 7 2HD2 LEU 7 -2.930 -5.172 -7.638 51 H ILE 8 H ILE 8 2.213 -7.464 -5.189 52 HA ILE 8 HA ILE 8 2.375 -5.347 -3.139 53 HB ILE 8 HB ILE 8 4.335 -6.284 -5.275 54 HG13 ILE 8 2HG1 ILE 8 3.694 -7.902 -3.255 55 HG21 ILE 8 1HG2 ILE 8 4.754 -3.931 -4.559 56 HG22 ILE 8 2HG2 ILE 8 4.759 -4.503 -2.879 57 HG23 ILE 8 3HG2 ILE 8 6.019 -5.003 -4.006 58 HD11 ILE 8 3HD1 ILE 8 6.544 -7.244 -4.096 59 HD12 ILE 8 1HD1 ILE 8 6.139 -8.531 -2.952 60 HD13 ILE 8 2HD1 ILE 8 5.514 -8.590 -4.596 61 H LEU 9 H LEU 9 1.735 -3.223 -3.572 62 HA LEU 9 HA LEU 9 2.162 -2.091 -6.300 63 HB3 LEU 9 2HB LEU 9 -0.051 -0.776 -5.714 64 HG LEU 9 HG LEU 9 0.037 -3.596 -6.825 65 HD11 LEU 9 1HD1 LEU 9 -2.354 -1.792 -6.305 66 HD12 LEU 9 2HD1 LEU 9 -2.042 -3.451 -5.721 67 HD13 LEU 9 3HD1 LEU 9 -2.366 -3.143 -7.455 68 HD21 LEU 9 3HD2 LEU 9 0.901 -1.664 -8.205 69 HD22 LEU 9 1HD2 LEU 9 -0.717 -0.935 -8.109 70 HD23 LEU 9 2HD2 LEU 9 -0.497 -2.494 -8.915 71 H TYR 10 H TYR 10 3.941 -0.928 -5.563 72 HA TYR 10 HA TYR 10 3.461 0.945 -3.253 73 HB3 TYR 10 2HB TYR 10 5.824 1.324 -3.107 74 HD1 TYR 10 1HD TYR 10 3.640 -1.223 -2.313 75 HD2 TYR 10 2HD TYR 10 7.907 -0.558 -2.786 76 HE1 TYR 10 1HE TYR 10 4.103 -3.143 -0.932 77 HE2 TYR 10 2HE TYR 10 8.325 -2.555 -1.376 78 HH TYR 10 HH TYR 10 7.086 -4.740 -0.985 79 H TYR 11 H TYR 11 4.409 3.169 -3.562 80 HA TYR 11 HA TYR 11 4.529 4.048 -6.401 81 HB3 TYR 11 2HB TYR 11 3.999 5.523 -3.822 82 HD1 TYR 11 1HD TYR 11 4.826 6.192 -7.504 83 HD2 TYR 11 2HD TYR 11 3.900 7.856 -3.617 84 HE1 TYR 11 1HE TYR 11 5.472 8.425 -8.305 85 HE2 TYR 11 2HE TYR 11 4.656 10.068 -4.404 86 HH TYR 11 HH TYR 11 5.848 10.833 -7.652 87 H SER 12 H SER 12 6.581 5.262 -6.840 88 HA SER 12 HA SER 12 8.616 5.269 -4.648 89 HB3 SER 12 2HB SER 12 9.224 3.462 -6.203 90 HG SER 12 HG SER 12 8.531 4.049 -8.221 91 H TRP 13 H TRP 13 9.312 7.312 -4.294 92 HA TRP 13 HA TRP 13 8.254 9.513 -5.754 93 HB3 TRP 13 2HB TRP 13 10.634 9.432 -3.895 94 HD1 TRP 13 HD TRP 13 7.443 11.508 -3.697 95 HE1 TRP 13 1HE TRP 13 8.030 13.937 -3.338 96 HE3 TRP 13 3HE TRP 13 12.520 11.263 -4.407 97 HZ2 TRP 13 2HZ TRP 13 10.373 15.634 -3.459 98 HZ3 TRP 13 3HZ TRP 13 13.895 13.305 -4.277 99 HH2 TRP 13 HH TRP 13 12.834 15.496 -3.810 100 H SER 14 H SER 14 11.811 8.972 -5.366 101 HA SER 14 HA SER 14 12.134 9.185 -8.312 102 HB3 SER 14 2HB SER 14 13.836 10.543 -6.181 103 HG SER 14 HG SER 14 14.416 11.816 -8.048 104 H GLY 15 H GLY 15 13.397 7.794 -5.268 105 HA2 GLY 15 1HA GLY 15 14.470 5.485 -6.598 106 HA3 GLY 15 2HA GLY 15 15.746 6.694 -6.365 107 H GLU 16 H GLU 16 13.290 6.708 -3.827 108 HA GLU 16 HA GLU 16 15.119 5.337 -2.024 109 HB3 GLU 16 2HB GLU 16 13.505 6.354 -0.358 110 HG3 GLU 16 2HG GLU 16 14.828 8.340 -2.289 111 H THR 17 H THR 17 11.505 5.533 -2.136 112 HA THR 17 HA THR 17 10.972 3.205 -0.878 113 HB THR 17 HB THR 17 9.224 4.226 -3.081 114 HG1 THR 17 1HG THR 17 9.618 5.509 -0.567 115 HG21 THR 17 3HG2 THR 17 8.253 2.414 -1.830 116 HG22 THR 17 1HG2 THR 17 7.418 3.907 -1.398 117 HG23 THR 17 2HG2 THR 17 8.613 3.222 -0.278 118 H LYS 18 H LYS 18 11.691 3.593 -4.302 119 HA LYS 18 HA LYS 18 10.743 1.119 -5.283 120 HB3 LYS 18 2HB LYS 18 12.860 3.092 -6.224 121 HG3 LYS 18 2HG LYS 18 13.521 0.894 -7.158 122 HD3 LYS 18 2HD LYS 18 11.244 0.716 -9.014 123 HE3 LYS 18 2HE LYS 18 11.436 -1.742 -8.128 124 HZ1 LYS 18 3HZ LYS 18 13.774 -0.393 -9.346 125 HZ2 LYS 18 1HZ LYS 18 12.583 -1.250 -10.134 126 HZ3 LYS 18 2HZ LYS 18 13.685 -1.986 -9.148 127 H LYS 19 H LYS 19 13.942 1.929 -3.892 128 HA LYS 19 HA LYS 19 15.197 -0.502 -4.430 129 HB3 LYS 19 2HB LYS 19 15.594 1.343 -2.034 130 HG3 LYS 19 2HG LYS 19 18.091 0.568 -2.777 131 HD3 LYS 19 2HD LYS 19 16.201 -0.554 -0.702 132 HE3 LYS 19 2HE LYS 19 18.270 -1.788 0.161 133 HZ1 LYS 19 3HZ LYS 19 16.590 -2.671 -2.045 134 HZ2 LYS 19 1HZ LYS 19 16.615 -3.133 -0.494 135 HZ3 LYS 19 2HZ LYS 19 17.805 -3.669 -1.550 136 H MET 20 H MET 20 12.806 0.212 -1.949 137 HA MET 20 HA MET 20 13.287 -2.148 -0.345 138 HB3 MET 20 2HB MET 20 10.572 -0.893 -0.430 139 HG3 MET 20 2HG MET 20 11.316 -2.415 1.329 140 HE1 MET 20 3HE MET 20 13.626 0.890 1.185 141 HE2 MET 20 1HE MET 20 12.633 1.085 2.660 142 HE3 MET 20 2HE MET 20 14.367 0.789 2.803 143 H ALA 21 H ALA 21 11.595 -1.544 -3.419 144 HA ALA 21 HA ALA 21 9.388 -3.325 -2.889 145 HB1 ALA 21 1HB ALA 21 9.419 -1.148 -4.310 146 HB2 ALA 21 2HB ALA 21 10.246 -2.104 -5.553 147 HB3 ALA 21 3HB ALA 21 8.618 -2.555 -5.000 148 H GLU 22 H GLU 22 12.256 -3.224 -4.935 149 HA GLU 22 HA GLU 22 11.801 -5.873 -5.864 150 HB3 GLU 22 2HB GLU 22 12.850 -4.557 -7.406 151 HG3 GLU 22 2HG GLU 22 14.809 -3.647 -5.271 152 H LYS 23 H LYS 23 13.217 -4.685 -3.029 153 HA LYS 23 HA LYS 23 14.862 -7.071 -2.452 154 HB3 LYS 23 2HB LYS 23 13.853 -4.916 -0.523 155 HG3 LYS 23 2HG LYS 23 14.891 -7.180 0.332 156 HD3 LYS 23 2HD LYS 23 17.464 -5.633 -0.174 157 HE3 LYS 23 2HE LYS 23 18.499 -7.799 0.419 158 HZ1 LYS 23 3HZ LYS 23 18.072 -6.595 2.416 159 HZ2 LYS 23 1HZ LYS 23 17.542 -8.136 2.639 160 HZ3 LYS 23 2HZ LYS 23 16.448 -6.972 2.392 161 H ILE 24 H ILE 24 11.797 -5.685 -1.113 162 HA ILE 24 HA ILE 24 11.139 -7.905 0.461 163 HB ILE 24 HB ILE 24 9.521 -5.690 -0.791 164 HG13 ILE 24 2HG1 ILE 24 11.203 -5.136 0.981 165 HG21 ILE 24 1HG2 ILE 24 7.915 -7.520 -0.466 166 HG22 ILE 24 2HG2 ILE 24 8.526 -7.803 1.167 167 HG23 ILE 24 3HG2 ILE 24 7.622 -6.330 0.780 168 HD11 ILE 24 3HD1 ILE 24 9.299 -3.615 0.609 169 HD12 ILE 24 1HD1 ILE 24 8.303 -4.544 1.741 170 HD13 ILE 24 2HD1 ILE 24 9.725 -3.704 2.328 171 H ASN 25 H ASN 25 10.545 -7.367 -3.003 172 HA ASN 25 HA ASN 25 8.680 -9.432 -3.507 173 HB3 ASN 25 2HB ASN 25 10.914 -8.254 -5.178 174 HD21 ASN 25 1HD2 ASN 25 7.860 -10.232 -5.585 175 HD22 ASN 25 2HD2 ASN 25 8.494 -11.128 -6.908 176 H SER 26 H SER 26 12.386 -9.806 -3.326 177 HA SER 26 HA SER 26 12.455 -12.436 -3.936 178 HB3 SER 26 2HB SER 26 14.679 -12.068 -3.144 179 HG SER 26 HG SER 26 14.964 -10.686 -4.639 180 H GLU 27 H GLU 27 11.401 -10.918 -0.984 181 HA GLU 27 HA GLU 27 12.153 -13.140 0.819 182 HB3 GLU 27 2HB GLU 27 11.370 -11.497 2.550 183 HG3 GLU 27 2HG GLU 27 12.982 -9.596 2.071 184 H ILE 28 H ILE 28 9.734 -12.778 -1.272 185 HA ILE 28 HA ILE 28 7.680 -14.058 0.462 186 HB ILE 28 HB ILE 28 7.266 -12.171 -1.896 187 HG13 ILE 28 2HG1 ILE 28 7.774 -11.194 0.521 188 HG21 ILE 28 1HG2 ILE 28 5.249 -13.794 -0.278 189 HG22 ILE 28 2HG2 ILE 28 4.780 -12.399 -1.271 190 HG23 ILE 28 3HG2 ILE 28 5.497 -13.795 -2.038 191 HD11 ILE 28 3HD1 ILE 28 6.207 -9.364 0.191 192 HD12 ILE 28 1HD1 ILE 28 7.022 -9.811 -1.322 193 HD13 ILE 28 2HD1 ILE 28 5.331 -10.289 -1.041 194 H LYS 29 H LYS 29 6.422 -15.645 -0.859 195 HA LYS 29 HA LYS 29 7.856 -17.297 -2.698 196 HB3 LYS 29 2HB LYS 29 4.816 -16.996 -2.588 197 HG3 LYS 29 2HG LYS 29 5.691 -19.675 -2.215 198 HD3 LYS 29 2HD LYS 29 4.808 -20.264 -4.361 199 HE3 LYS 29 2HE LYS 29 3.173 -17.943 -3.231 200 HZ1 LYS 29 3HZ LYS 29 1.375 -18.822 -4.397 201 HZ2 LYS 29 1HZ LYS 29 2.245 -20.112 -5.001 202 HZ3 LYS 29 2HZ LYS 29 2.534 -18.574 -5.499 203 H ASP 30 H ASP 30 6.530 -17.602 -4.972 204 HA ASP 30 HA ASP 30 7.158 -15.590 -6.739 205 HB3 ASP 30 2HB ASP 30 6.177 -17.053 -8.410 206 H SER 31 H SER 31 5.616 -14.289 -5.041 207 HA SER 31 HA SER 31 2.954 -13.610 -5.881 208 HB3 SER 31 2HB SER 31 3.991 -13.118 -3.618 209 HG SER 31 HG SER 31 5.950 -11.946 -4.362 210 H GLU 32 H GLU 32 3.098 -10.699 -6.234 211 HA GLU 32 HA GLU 32 4.478 -10.542 -8.844 212 HB3 GLU 32 2HB GLU 32 1.739 -9.291 -8.386 213 HG3 GLU 32 2HG GLU 32 3.563 -9.883 -10.693 214 H LEU 33 H LEU 33 4.922 -8.495 -9.420 215 HA LEU 33 HA LEU 33 4.950 -6.414 -7.286 216 HB3 LEU 33 2HB LEU 33 7.246 -7.027 -9.214 217 HG LEU 33 HG LEU 33 7.271 -4.635 -8.583 218 HD11 LEU 33 1HD1 LEU 33 7.629 -3.957 -6.275 219 HD12 LEU 33 2HD1 LEU 33 7.443 -5.639 -5.724 220 HD13 LEU 33 3HD1 LEU 33 6.073 -4.733 -6.456 221 HD21 LEU 33 3HD2 LEU 33 9.439 -6.253 -7.152 222 HD22 LEU 33 1HD2 LEU 33 9.554 -4.527 -7.563 223 HD23 LEU 33 2HD2 LEU 33 9.457 -5.732 -8.843 224 H LYS 34 H LYS 34 3.975 -4.590 -7.840 225 HA LYS 34 HA LYS 34 3.884 -3.755 -10.638 226 HB3 LYS 34 2HB LYS 34 1.483 -3.031 -10.158 227 HG3 LYS 34 2HG LYS 34 1.793 -6.048 -10.338 228 HD3 LYS 34 2HD LYS 34 -0.217 -4.054 -11.463 229 HE3 LYS 34 2HE LYS 34 0.276 -6.030 -12.999 230 HZ1 LYS 34 3HZ LYS 34 -1.149 -7.996 -12.385 231 HZ2 LYS 34 1HZ LYS 34 -1.089 -7.502 -10.824 232 HZ3 LYS 34 2HZ LYS 34 0.266 -7.944 -11.665 233 H GLU 35 H GLU 35 3.420 -1.355 -10.659 234 HA GLU 35 HA GLU 35 3.850 -0.025 -8.046 235 HB3 GLU 35 2HB GLU 35 5.399 1.019 -10.419 236 HG3 GLU 35 2HG GLU 35 6.007 1.040 -7.433 237 H VAL 36 H VAL 36 3.202 2.156 -8.016 238 HA VAL 36 HA VAL 36 1.018 2.946 -9.892 239 HB VAL 36 HB VAL 36 1.322 3.466 -6.891 240 HG11 VAL 36 1HG1 VAL 36 -1.069 3.749 -8.767 241 HG12 VAL 36 2HG1 VAL 36 -1.140 3.951 -7.009 242 HG13 VAL 36 3HG1 VAL 36 -0.191 5.073 -7.979 243 HG21 VAL 36 3HG2 VAL 36 1.034 1.061 -7.092 244 HG22 VAL 36 1HG2 VAL 36 -0.500 1.756 -6.566 245 HG23 VAL 36 2HG2 VAL 36 -0.280 1.280 -8.267 246 H LYS 37 H LYS 37 0.838 5.382 -10.150 247 HA LYS 37 HA LYS 37 2.808 6.993 -8.793 248 HB3 LYS 37 2HB LYS 37 3.978 6.352 -10.831 249 HG3 LYS 37 2HG LYS 37 2.420 8.074 -12.656 250 HD3 LYS 37 2HD LYS 37 3.369 5.195 -12.939 251 HE3 LYS 37 2HE LYS 37 1.765 6.751 -14.637 252 HZ1 LYS 37 3HZ LYS 37 3.644 7.986 -15.510 253 HZ2 LYS 37 1HZ LYS 37 3.182 6.866 -16.594 254 HZ3 LYS 37 2HZ LYS 37 4.530 6.607 -15.733 255 H VAL 38 H VAL 38 2.255 9.434 -9.658 256 HA VAL 38 HA VAL 38 -0.685 9.735 -9.757 257 HB VAL 38 HB VAL 38 -0.426 11.809 -8.413 258 HG11 VAL 38 1HG1 VAL 38 0.475 9.356 -6.881 259 HG12 VAL 38 2HG1 VAL 38 -0.414 10.746 -6.248 260 HG13 VAL 38 3HG1 VAL 38 -1.195 9.679 -7.425 261 HG21 VAL 38 3HG2 VAL 38 1.506 12.257 -7.057 262 HG22 VAL 38 1HG2 VAL 38 2.345 10.796 -7.633 263 HG23 VAL 38 2HG2 VAL 38 2.047 12.157 -8.732 264 H SER 39 H SER 39 -1.139 12.163 -10.551 265 HA SER 39 HA SER 39 0.183 12.620 -13.024 266 HB3 SER 39 2HB SER 39 -1.274 14.842 -12.179 267 HG SER 39 HG SER 39 -2.931 13.949 -13.430 268 H GLU 40 H GLU 40 0.820 14.879 -13.401 269 HA GLU 40 HA GLU 40 3.167 15.553 -11.762 270 HB3 GLU 40 2HB GLU 40 3.251 15.494 -14.221 271 HG3 GLU 40 2HG GLU 40 2.020 18.182 -14.539 272 H GLY 41 H GLY 41 3.479 17.914 -11.186 273 HA2 GLY 41 1HA GLY 41 2.833 19.875 -10.213 274 HA3 GLY 41 2HA GLY 41 1.254 19.707 -10.994 275 H THR 42 H THR 42 1.252 16.908 -9.444 276 HA THR 42 HA THR 42 -0.545 17.568 -7.488 277 HB THR 42 HB THR 42 1.305 15.135 -7.517 278 HG1 THR 42 1HG THR 42 0.447 14.871 -9.411 279 HG21 THR 42 3HG2 THR 42 -1.540 15.554 -6.584 280 HG22 THR 42 1HG2 THR 42 -0.143 15.215 -5.543 281 HG23 THR 42 2HG2 THR 42 -0.718 13.970 -6.670 282 H PHE 43 H PHE 43 2.998 17.306 -7.201 283 HA PHE 43 HA PHE 43 2.920 19.009 -4.845 284 HB3 PHE 43 2HB PHE 43 4.633 17.499 -3.653 285 HD1 PHE 43 2HD PHE 43 2.963 18.604 -2.123 286 HD2 PHE 43 1HD PHE 43 2.010 15.093 -4.436 287 HE1 PHE 43 2HE PHE 43 0.935 18.246 -0.761 288 HE2 PHE 43 1HE PHE 43 -0.056 14.797 -3.088 289 HZ PHE 43 HZ PHE 43 -0.533 16.286 -1.183 290 H ASP 44 H ASP 44 5.564 19.114 -4.223 291 HA ASP 44 HA ASP 44 7.135 19.484 -6.664 292 HB3 ASP 44 2HB ASP 44 7.090 21.568 -4.444 293 H ALA 45 H ALA 45 9.502 19.984 -5.712 294 HA ALA 45 HA ALA 45 9.978 18.382 -3.228 295 HB1 ALA 45 1HB ALA 45 11.823 19.021 -5.570 296 HB2 ALA 45 2HB ALA 45 12.284 18.146 -4.087 297 HB3 ALA 45 3HB ALA 45 11.090 17.443 -5.194 298 H ASP 46 H ASP 46 8.955 20.617 -2.436 299 HA ASP 46 HA ASP 46 11.078 22.698 -2.246 300 HB3 ASP 46 2HB ASP 46 8.089 23.114 -2.266 301 H MET 47 H MET 47 9.840 24.330 -0.354 302 HA MET 47 HA MET 47 9.427 22.643 2.021 303 HB3 MET 47 2HB MET 47 11.829 23.193 1.853 304 HG3 MET 47 2HG MET 47 11.074 25.886 1.459 305 HE1 MET 47 3HE MET 47 9.645 27.076 3.206 306 HE2 MET 47 1HE MET 47 10.437 28.005 4.496 307 HE3 MET 47 2HE MET 47 10.967 28.214 2.817 308 H TYR 48 H TYR 48 8.673 25.559 0.232 309 HA TYR 48 HA TYR 48 6.716 26.303 2.336 310 HB3 TYR 48 2HB TYR 48 7.961 28.192 1.909 311 HD1 TYR 48 1HD TYR 48 10.152 27.827 0.891 312 HD2 TYR 48 2HD TYR 48 6.642 28.446 -1.548 313 HE1 TYR 48 1HE TYR 48 11.566 27.816 -1.100 314 HE2 TYR 48 2HE TYR 48 8.071 28.446 -3.569 315 HH TYR 48 HH TYR 48 10.674 26.847 -3.576 316 H LYS 49 H LYS 49 7.177 25.510 -1.165 317 HA LYS 49 HA LYS 49 4.471 25.842 -1.980 318 HB3 LYS 49 2HB LYS 49 5.946 23.590 -3.204 319 HG3 LYS 49 2HG LYS 49 4.040 25.084 -4.219 320 HD3 LYS 49 2HD LYS 49 6.548 26.793 -4.649 321 HE3 LYS 49 2HE LYS 49 3.968 26.518 -6.202 322 HZ1 LYS 49 3HZ LYS 49 5.679 28.935 -6.185 323 HZ2 LYS 49 1HZ LYS 49 4.155 28.801 -5.628 324 HZ3 LYS 49 2HZ LYS 49 4.428 28.596 -7.229 325 H THR 50 H THR 50 6.176 22.900 -0.729 326 HA THR 50 HA THR 50 3.772 21.336 -0.932 327 HB THR 50 HB THR 50 5.398 19.640 0.078 328 HG1 THR 50 1HG THR 50 6.953 21.267 0.915 329 HG21 THR 50 3HG2 THR 50 4.929 19.748 -2.294 330 HG22 THR 50 1HG2 THR 50 6.667 19.538 -2.005 331 HG23 THR 50 2HG2 THR 50 6.052 21.115 -2.498 332 H SER 51 H SER 51 4.711 23.524 1.421 333 HA SER 51 HA SER 51 3.389 22.260 3.695 334 HB3 SER 51 2HB SER 51 3.873 25.226 3.105 335 HG SER 51 HG SER 51 2.752 25.155 4.898 336 H ASP 52 H ASP 52 2.664 24.848 1.346 337 HA ASP 52 HA ASP 52 -0.015 25.284 1.878 338 HB3 ASP 52 2HB ASP 52 1.429 25.508 -0.848 339 H ILE 53 H ILE 53 1.297 23.350 -0.852 340 HA ILE 53 HA ILE 53 -1.144 22.673 -1.919 341 HB ILE 53 HB ILE 53 1.407 21.009 -2.015 342 HG13 ILE 53 2HG1 ILE 53 1.399 23.561 -2.870 343 HG21 ILE 53 1HG2 ILE 53 -0.310 19.627 -2.911 344 HG22 ILE 53 2HG2 ILE 53 -1.165 20.992 -3.649 345 HG23 ILE 53 3HG2 ILE 53 0.341 20.384 -4.348 346 HD11 ILE 53 3HD1 ILE 53 3.273 21.917 -3.197 347 HD12 ILE 53 1HD1 ILE 53 2.426 21.294 -4.625 348 HD13 ILE 53 2HD1 ILE 53 3.000 22.962 -4.614 349 H ALA 54 H ALA 54 0.630 20.814 0.586 350 HA ALA 54 HA ALA 54 -1.322 18.641 0.590 351 HB1 ALA 54 1HB ALA 54 1.008 18.237 1.377 352 HB2 ALA 54 2HB ALA 54 0.718 19.413 2.677 353 HB3 ALA 54 3HB ALA 54 -0.201 17.877 2.606 354 H LEU 55 H LEU 55 -0.658 21.539 2.630 355 HA LEU 55 HA LEU 55 -2.455 21.062 4.697 356 HB3 LEU 55 2HB LEU 55 -1.827 23.725 3.381 357 HG LEU 55 HG LEU 55 -3.531 23.997 5.111 358 HD11 LEU 55 1HD1 LEU 55 -1.643 22.482 6.968 359 HD12 LEU 55 2HD1 LEU 55 -3.282 21.971 6.487 360 HD13 LEU 55 3HD1 LEU 55 -3.086 23.389 7.496 361 HD21 LEU 55 3HD2 LEU 55 -2.314 25.491 6.625 362 HD22 LEU 55 1HD2 LEU 55 -1.679 25.631 4.973 363 HD23 LEU 55 2HD2 LEU 55 -0.774 24.694 6.195 364 H ASP 56 H ASP 56 -2.956 22.637 1.601 365 HA ASP 56 HA ASP 56 -5.598 23.531 2.119 366 HB3 ASP 56 2HB ASP 56 -4.183 23.087 -0.539 367 H GLN 57 H GLN 57 -4.289 20.505 0.857 368 HA GLN 57 HA GLN 57 -6.987 19.494 0.135 369 HB3 GLN 57 2HB GLN 57 -5.820 17.534 -0.769 370 HG3 GLN 57 2HG GLN 57 -4.968 20.271 -1.800 371 HE21 GLN 57 1HE2 GLN 57 -5.660 16.977 -3.079 372 HE22 GLN 57 2HE2 GLN 57 -4.209 16.974 -4.129 373 H ILE 58 H ILE 58 -5.446 19.971 2.931 374 HA ILE 58 HA ILE 58 -6.499 17.497 4.216 375 HB ILE 58 HB ILE 58 -4.522 19.619 5.146 376 HG13 ILE 58 2HG1 ILE 58 -3.791 17.543 3.709 377 HG21 ILE 58 1HG2 ILE 58 -5.798 17.431 6.823 378 HG22 ILE 58 2HG2 ILE 58 -4.379 18.386 7.317 379 HG23 ILE 58 3HG2 ILE 58 -5.924 19.183 7.066 380 HD11 ILE 58 3HD1 ILE 58 -2.355 17.989 6.372 381 HD12 ILE 58 1HD1 ILE 58 -1.665 17.374 4.856 382 HD13 ILE 58 2HD1 ILE 58 -2.189 19.047 4.966 383 H GLN 59 H GLN 59 -6.477 21.094 4.522 384 HA GLN 59 HA GLN 59 -8.068 21.050 6.775 385 HB3 GLN 59 2HB GLN 59 -8.455 23.562 6.190 386 HG3 GLN 59 2HG GLN 59 -5.569 22.633 6.293 387 HE21 GLN 59 1HE2 GLN 59 -5.585 24.897 5.007 388 HE22 GLN 59 2HE2 GLN 59 -5.642 26.317 6.032 389 H GLY 60 H GLY 60 -9.448 20.418 3.703 390 HA2 GLY 60 1HA GLY 60 -11.763 19.971 3.452 391 HA3 GLY 60 2HA GLY 60 -12.154 21.123 4.747 392 H ASN 61 H ASN 61 -9.888 21.752 2.179 393 HA ASN 61 HA ASN 61 -11.613 23.968 1.152 394 HB3 ASN 61 2HB ASN 61 -9.626 25.195 0.590 395 HD21 ASN 61 1HD2 ASN 61 -7.386 25.351 2.136 396 HD22 ASN 61 2HD2 ASN 61 -7.841 25.777 3.788 397 H LYS 62 H LYS 62 -8.713 22.183 0.048 398 HA LYS 62 HA LYS 62 -9.804 21.983 -2.665 399 HB3 LYS 62 2HB LYS 62 -7.540 20.974 -3.168 400 HG3 LYS 62 2HG LYS 62 -6.079 22.881 -2.537 401 HD3 LYS 62 2HD LYS 62 -7.414 24.755 -3.586 402 HE3 LYS 62 2HE LYS 62 -7.071 22.028 -4.845 403 HZ1 LYS 62 3HZ LYS 62 -7.565 23.054 -6.963 404 HZ2 LYS 62 1HZ LYS 62 -8.200 24.375 -6.208 405 HZ3 LYS 62 2HZ LYS 62 -8.915 22.886 -6.039 406 H ASP 63 H ASP 63 -9.075 19.980 -3.655 407 HA ASP 63 HA ASP 63 -10.709 17.712 -2.525 408 HB3 ASP 63 2HB ASP 63 -9.949 17.989 -5.435 409 H PHE 64 H PHE 64 -9.528 15.676 -4.437 410 HA PHE 64 HA PHE 64 -7.006 15.226 -2.911 411 HB3 PHE 64 2HB PHE 64 -8.527 13.632 -2.207 412 HD1 PHE 64 2HD PHE 64 -8.711 13.073 -5.987 413 HD2 PHE 64 1HD PHE 64 -10.666 12.810 -2.159 414 HE1 PHE 64 2HE PHE 64 -10.634 11.975 -7.047 415 HE2 PHE 64 1HE PHE 64 -12.648 11.782 -3.248 416 HZ PHE 64 HZ PHE 64 -12.621 11.328 -5.694 417 HA PRO 65 HA PRO 65 -4.785 14.738 -6.781 418 HB3 PRO 65 2HB PRO 65 -2.911 14.276 -5.561 419 HG3 PRO 65 2HG PRO 65 -2.946 12.931 -3.606 420 HD3 PRO 65 2HD PRO 65 -4.479 14.713 -3.320 421 H GLU 66 H GLU 66 -4.142 12.878 -8.379 422 HA GLU 66 HA GLU 66 -6.339 10.887 -8.602 423 HB3 GLU 66 2HB GLU 66 -6.626 12.694 -10.255 424 HG3 GLU 66 2HG GLU 66 -3.960 11.734 -11.346 425 H ILE 67 H ILE 67 -5.628 8.777 -9.391 426 HA ILE 67 HA ILE 67 -2.702 8.328 -9.118 427 HB ILE 67 HB ILE 67 -3.104 5.997 -9.109 428 HG13 ILE 67 2HG1 ILE 67 -4.908 5.727 -10.718 429 HG21 ILE 67 1HG2 ILE 67 -5.303 6.873 -7.279 430 HG22 ILE 67 2HG2 ILE 67 -3.961 5.749 -6.991 431 HG23 ILE 67 3HG2 ILE 67 -3.664 7.494 -7.015 432 HD11 ILE 67 3HD1 ILE 67 -6.009 4.664 -8.090 433 HD12 ILE 67 1HD1 ILE 67 -6.222 4.010 -9.716 434 HD13 ILE 67 2HD1 ILE 67 -4.627 3.933 -8.931 435 H GLN 68 H GLN 68 -1.595 7.268 -10.780 436 HA GLN 68 HA GLN 68 -2.902 7.095 -13.435 437 HB3 GLN 68 2HB GLN 68 -0.615 7.431 -14.359 438 HG3 GLN 68 2HG GLN 68 -1.509 9.846 -12.720 439 HE21 GLN 68 1HE2 GLN 68 -1.534 11.790 -14.590 440 HE22 GLN 68 2HE2 GLN 68 0.022 11.902 -15.367 441 H LEU 69 H LEU 69 -3.563 4.986 -13.127 442 HA LEU 69 HA LEU 69 -1.608 2.916 -12.943 443 HB3 LEU 69 2HB LEU 69 -4.004 3.152 -11.053 444 HG LEU 69 HG LEU 69 -3.484 0.782 -11.559 445 HD11 LEU 69 1HD1 LEU 69 -1.175 0.945 -12.261 446 HD12 LEU 69 2HD1 LEU 69 -1.239 -0.121 -10.847 447 HD13 LEU 69 3HD1 LEU 69 -0.685 1.572 -10.692 448 HD21 LEU 69 3HD2 LEU 69 -2.601 1.674 -8.816 449 HD22 LEU 69 1HD2 LEU 69 -3.103 0.030 -9.291 450 HD23 LEU 69 2HD2 LEU 69 -4.265 1.381 -9.382 451 H ASP 70 H ASP 70 -2.651 0.930 -13.635 452 HA ASP 70 HA ASP 70 -4.503 1.343 -15.763 453 HB3 ASP 70 2HB ASP 70 -4.010 -0.887 -16.356 454 H ASN 71 H ASN 71 -6.276 -0.604 -15.940 455 HA ASN 71 HA ASN 71 -8.002 -0.321 -13.537 456 HB3 ASN 71 2HB ASN 71 -8.978 -1.810 -15.915 457 HD21 ASN 71 1HD2 ASN 71 -9.646 1.185 -13.907 458 HD22 ASN 71 2HD2 ASN 71 -11.301 0.695 -13.582 459 H ILE 72 H ILE 72 -7.591 -1.750 -12.072 460 HA ILE 72 HA ILE 72 -6.729 -4.499 -12.862 461 HB ILE 72 HB ILE 72 -5.636 -2.798 -10.600 462 HG13 ILE 72 2HG1 ILE 72 -4.796 -2.204 -12.918 463 HG21 ILE 72 1HG2 ILE 72 -4.996 -5.664 -11.492 464 HG22 ILE 72 2HG2 ILE 72 -4.126 -4.778 -10.205 465 HG23 ILE 72 3HG2 ILE 72 -5.824 -5.210 -10.010 466 HD11 ILE 72 3HD1 ILE 72 -2.643 -3.346 -11.120 467 HD12 ILE 72 1HD1 ILE 72 -2.470 -2.093 -12.365 468 HD13 ILE 72 2HD1 ILE 72 -3.430 -1.759 -10.911 469 H ASP 73 H ASP 73 -7.947 -5.998 -12.057 470 HA ASP 73 HA ASP 73 -10.056 -5.689 -10.135 471 HB3 ASP 73 2HB ASP 73 -8.640 -8.243 -11.052 472 H TYR 74 H TYR 74 -9.597 -5.505 -7.917 473 HA TYR 74 HA TYR 74 -7.023 -6.635 -6.958 474 HB3 TYR 74 2HB TYR 74 -7.375 -5.276 -4.999 475 HD1 TYR 74 2HD TYR 74 -5.626 -4.886 -7.277 476 HD2 TYR 74 1HD TYR 74 -9.077 -2.584 -6.084 477 HE1 TYR 74 2HE TYR 74 -4.722 -2.925 -8.467 478 HE2 TYR 74 1HE TYR 74 -8.178 -0.599 -7.235 479 HH TYR 74 HH TYR 74 -5.048 -0.624 -8.956 480 H ASN 75 H ASN 75 -10.379 -7.554 -6.962 481 HA ASN 75 HA ASN 75 -10.319 -8.446 -4.203 482 HB3 ASN 75 2HB ASN 75 -12.564 -9.494 -5.807 483 HD21 ASN 75 1HD2 ASN 75 -12.641 -10.408 -3.491 484 HD22 ASN 75 2HD2 ASN 75 -13.301 -9.384 -2.233 485 H ASN 76 H ASN 76 -8.869 -9.824 -6.756 486 HA ASN 76 HA ASN 76 -9.329 -12.603 -5.972 487 HB3 ASN 76 2HB ASN 76 -9.525 -12.100 -8.336 488 HD21 ASN 76 1HD2 ASN 76 -9.097 -9.790 -8.988 489 HD22 ASN 76 2HD2 ASN 76 -7.468 -9.321 -9.273 490 H TYR 77 H TYR 77 -7.328 -10.146 -4.870 491 HA TYR 77 HA TYR 77 -4.999 -11.923 -4.401 492 HB3 TYR 77 2HB TYR 77 -3.797 -9.982 -3.727 493 HD1 TYR 77 2HD TYR 77 -2.752 -11.191 -5.750 494 HD2 TYR 77 1HD TYR 77 -5.776 -8.181 -6.132 495 HE1 TYR 77 2HE TYR 77 -2.248 -11.020 -8.162 496 HE2 TYR 77 1HE TYR 77 -5.223 -7.945 -8.533 497 HH TYR 77 HH TYR 77 -3.189 -10.215 -10.249 498 H ASP 78 H ASP 78 -4.342 -12.408 -2.261 499 HA ASP 78 HA ASP 78 -6.552 -12.245 -0.265 500 HB3 ASP 78 2HB ASP 78 -3.895 -13.736 -0.205 501 H LEU 79 H LEU 79 -3.204 -11.134 -0.734 502 HA LEU 79 HA LEU 79 -3.594 -9.159 1.449 503 HB3 LEU 79 2HB LEU 79 -0.800 -9.954 1.058 504 HG LEU 79 HG LEU 79 -2.766 -10.029 3.378 505 HD11 LEU 79 1HD1 LEU 79 0.114 -10.848 3.156 506 HD12 LEU 79 2HD1 LEU 79 -1.236 -11.748 3.877 507 HD13 LEU 79 3HD1 LEU 79 -0.543 -10.337 4.719 508 HD21 LEU 79 3HD2 LEU 79 -1.825 -7.723 2.569 509 HD22 LEU 79 1HD2 LEU 79 -0.275 -8.289 3.222 510 HD23 LEU 79 2HD2 LEU 79 -1.697 -8.133 4.268 511 H ILE 80 H ILE 80 -2.796 -7.120 1.000 512 HA ILE 80 HA ILE 80 -1.501 -6.626 -1.643 513 HB ILE 80 HB ILE 80 -3.862 -5.049 -0.605 514 HG13 ILE 80 2HG1 ILE 80 -4.643 -7.216 -1.441 515 HG21 ILE 80 1HG2 ILE 80 -2.034 -3.810 -1.921 516 HG22 ILE 80 2HG2 ILE 80 -2.414 -4.851 -3.287 517 HG23 ILE 80 3HG2 ILE 80 -3.649 -3.749 -2.621 518 HD11 ILE 80 3HD1 ILE 80 -5.028 -5.346 -3.791 519 HD12 ILE 80 1HD1 ILE 80 -6.067 -6.669 -3.251 520 HD13 ILE 80 2HD1 ILE 80 -5.931 -5.202 -2.260 521 H LEU 81 H LEU 81 0.428 -5.665 -1.214 522 HA LEU 81 HA LEU 81 0.747 -4.144 1.340 523 HB3 LEU 81 2HB LEU 81 3.202 -4.257 0.628 524 HG LEU 81 HG LEU 81 2.286 -5.621 2.475 525 HD11 LEU 81 1HD1 LEU 81 2.305 -7.852 0.425 526 HD12 LEU 81 2HD1 LEU 81 0.853 -7.204 1.293 527 HD13 LEU 81 3HD1 LEU 81 2.123 -8.048 2.165 528 HD21 LEU 81 3HD2 LEU 81 4.579 -6.774 0.823 529 HD22 LEU 81 1HD2 LEU 81 4.305 -7.088 2.547 530 HD23 LEU 81 2HD2 LEU 81 4.695 -5.447 1.993 531 H ILE 82 H ILE 82 0.987 -1.966 1.189 532 HA ILE 82 HA ILE 82 1.534 -0.778 -1.476 533 HB ILE 82 HB ILE 82 -0.413 0.215 0.640 534 HG13 ILE 82 2HG1 ILE 82 -0.764 -1.291 -1.971 535 HG21 ILE 82 1HG2 ILE 82 0.316 1.406 -2.070 536 HG22 ILE 82 2HG2 ILE 82 -1.002 1.939 -1.009 537 HG23 ILE 82 3HG2 ILE 82 0.663 2.110 -0.467 538 HD11 ILE 82 3HD1 ILE 82 -2.893 -1.992 -0.796 539 HD12 ILE 82 1HD1 ILE 82 -1.430 -2.452 0.093 540 HD13 ILE 82 2HD1 ILE 82 -2.377 -1.053 0.611 541 H GLY 83 H GLY 83 2.914 0.924 -1.583 542 HA2 GLY 83 1HA GLY 83 4.519 1.610 0.845 543 HA3 GLY 83 2HA GLY 83 5.220 1.247 -0.728 544 H SER 84 H SER 84 5.196 3.881 0.899 545 HA SER 84 HA SER 84 4.583 5.628 -1.395 546 HB3 SER 84 2HB SER 84 2.491 5.602 -0.279 547 HG SER 84 HG SER 84 2.736 4.786 1.708 548 HA PRO 85 HA PRO 85 8.026 8.002 0.536 549 HB3 PRO 85 2HB PRO 85 8.031 9.202 -1.501 550 HG3 PRO 85 2HG PRO 85 6.004 9.955 -2.499 551 HD3 PRO 85 2HD PRO 85 5.820 7.611 -2.326 552 H VAL 86 H VAL 86 8.392 9.822 2.032 553 HA VAL 86 HA VAL 86 5.990 10.894 3.404 554 HB VAL 86 HB VAL 86 8.874 10.447 4.262 555 HG11 VAL 86 1HG1 VAL 86 8.452 12.674 5.061 556 HG12 VAL 86 2HG1 VAL 86 6.855 12.216 5.747 557 HG13 VAL 86 3HG1 VAL 86 8.370 11.557 6.347 558 HG21 VAL 86 3HG2 VAL 86 7.562 9.373 6.186 559 HG22 VAL 86 1HG2 VAL 86 6.093 9.661 5.262 560 HG23 VAL 86 2HG2 VAL 86 7.369 8.599 4.606 561 H TRP 87 H TRP 87 5.994 13.226 3.664 562 HA TRP 87 HA TRP 87 7.921 14.815 2.084 563 HB3 TRP 87 2HB TRP 87 5.325 16.098 2.477 564 HD1 TRP 87 HD TRP 87 6.925 17.800 0.847 565 HE1 TRP 87 1HE TRP 87 7.364 17.768 -1.709 566 HE3 TRP 87 3HE TRP 87 5.358 13.069 -0.247 567 HZ2 TRP 87 2HZ TRP 87 6.805 16.083 -3.926 568 HZ3 TRP 87 3HZ TRP 87 5.059 12.370 -2.596 569 HH2 TRP 87 HH TRP 87 5.775 13.858 -4.462 570 H SER 88 H SER 88 7.026 17.322 3.158 571 HA SER 88 HA SER 88 8.108 17.346 5.809 572 HB3 SER 88 2HB SER 88 8.380 19.472 5.337 573 HG SER 88 HG SER 88 6.518 19.226 3.210 574 H GLY 89 H GLY 89 6.983 15.883 6.814 575 HA2 GLY 89 1HA GLY 89 5.805 15.724 8.891 576 HA3 GLY 89 2HA GLY 89 4.809 17.089 8.404 577 H TYR 90 H TYR 90 4.171 15.550 5.737 578 HA TYR 90 HA TYR 90 2.658 13.293 6.820 579 HB3 TYR 90 2HB TYR 90 0.805 14.492 6.917 580 HD1 TYR 90 2HD TYR 90 2.459 16.356 4.013 581 HD2 TYR 90 1HD TYR 90 0.126 16.535 7.650 582 HE1 TYR 90 2HE TYR 90 2.425 18.818 3.896 583 HE2 TYR 90 1HE TYR 90 0.023 18.970 7.470 584 HH TYR 90 HH TYR 90 1.297 20.797 4.698 585 HA PRO 91 HA PRO 91 3.483 11.596 2.737 586 HB3 PRO 91 2HB PRO 91 2.411 9.642 3.335 587 HG3 PRO 91 2HG PRO 91 0.543 9.625 4.794 588 HD3 PRO 91 2HD PRO 91 2.102 10.945 5.983 589 H ALA 92 H ALA 92 2.878 12.090 0.606 590 HA ALA 92 HA ALA 92 1.421 14.504 0.037 591 HB1 ALA 92 1HB ALA 92 3.197 12.570 -1.291 592 HB2 ALA 92 2HB ALA 92 2.090 13.383 -2.372 593 HB3 ALA 92 3HB ALA 92 3.143 14.349 -1.349 594 H THR 93 H THR 93 -0.272 12.609 1.244 595 HA THR 93 HA THR 93 -2.073 11.149 1.070 596 HB THR 93 HB THR 93 -3.944 12.417 0.169 597 HG1 THR 93 1HG THR 93 -3.022 13.178 -1.711 598 HG21 THR 93 3HG2 THR 93 -1.952 14.447 1.360 599 HG22 THR 93 1HG2 THR 93 -2.871 13.262 2.320 600 HG23 THR 93 2HG2 THR 93 -3.711 14.524 1.390 601 HA PRO 94 HA PRO 94 -1.317 9.751 -3.367 602 HB3 PRO 94 2HB PRO 94 0.926 9.244 -3.239 603 HG3 PRO 94 2HG PRO 94 1.920 8.502 -1.186 604 HD3 PRO 94 2HD PRO 94 0.821 10.440 -0.637 605 H ILE 95 H ILE 95 -1.531 7.586 -0.562 606 HA ILE 95 HA ILE 95 -3.280 5.683 -1.950 607 HB ILE 95 HB ILE 95 -2.462 5.587 0.898 608 HG13 ILE 95 2HG1 ILE 95 -0.483 4.113 0.370 609 HG21 ILE 95 1HG2 ILE 95 -2.537 3.103 0.539 610 HG22 ILE 95 2HG2 ILE 95 -4.046 3.892 0.139 611 HG23 ILE 95 3HG2 ILE 95 -2.956 3.388 -1.166 612 HD11 ILE 95 3HD1 ILE 95 0.843 4.488 -1.610 613 HD12 ILE 95 1HD1 ILE 95 -0.746 3.935 -2.167 614 HD13 ILE 95 2HD1 ILE 95 -0.318 5.640 -2.261 615 H LYS 96 H LYS 96 -4.448 8.112 -1.828 616 HA LYS 96 HA LYS 96 -6.716 7.552 0.028 617 HB3 LYS 96 2HB LYS 96 -5.723 10.248 -0.970 618 HG3 LYS 96 2HG LYS 96 -8.134 10.302 -0.848 619 HD3 LYS 96 2HD LYS 96 -7.827 9.278 2.015 620 HE3 LYS 96 2HE LYS 96 -10.242 10.353 0.526 621 HZ1 LYS 96 3HZ LYS 96 -10.958 8.488 1.762 622 HZ2 LYS 96 1HZ LYS 96 -11.420 9.825 2.575 623 HZ3 LYS 96 2HZ LYS 96 -10.167 8.968 3.150 624 H THR 97 H THR 97 -5.850 8.791 -3.327 625 HA THR 97 HA THR 97 -8.548 8.633 -4.171 626 HB THR 97 HB THR 97 -6.398 8.156 -6.168 627 HG1 THR 97 1HG THR 97 -6.297 10.719 -5.631 628 HG21 THR 97 3HG2 THR 97 -8.460 10.366 -6.026 629 HG22 THR 97 1HG2 THR 97 -8.847 8.740 -6.584 630 HG23 THR 97 2HG2 THR 97 -7.647 9.698 -7.464 631 H LEU 98 H LEU 98 -5.815 6.275 -4.517 632 HA LEU 98 HA LEU 98 -7.253 4.225 -5.813 633 HB3 LEU 98 2HB LEU 98 -5.034 4.059 -3.708 634 HG LEU 98 HG LEU 98 -6.101 1.815 -4.165 635 HD11 LEU 98 1HD1 LEU 98 -6.739 2.132 -6.544 636 HD12 LEU 98 2HD1 LEU 98 -5.661 0.751 -6.348 637 HD13 LEU 98 3HD1 LEU 98 -5.025 2.280 -6.987 638 HD21 LEU 98 3HD2 LEU 98 -3.234 2.222 -5.110 639 HD22 LEU 98 1HD2 LEU 98 -3.950 0.677 -4.589 640 HD23 LEU 98 2HD2 LEU 98 -3.779 2.001 -3.432 641 H LEU 99 H LEU 99 -6.982 4.907 -2.284 642 HA LEU 99 HA LEU 99 -8.305 2.669 -1.306 643 HB3 LEU 99 2HB LEU 99 -9.134 4.254 0.524 644 HG LEU 99 HG LEU 99 -6.172 4.412 -0.077 645 HD11 LEU 99 1HD1 LEU 99 -6.978 5.972 1.603 646 HD12 LEU 99 2HD1 LEU 99 -6.049 4.707 2.408 647 HD13 LEU 99 3HD1 LEU 99 -7.841 4.718 2.462 648 HD21 LEU 99 3HD2 LEU 99 -6.082 2.480 1.606 649 HD22 LEU 99 1HD2 LEU 99 -6.682 2.070 0.002 650 HD23 LEU 99 2HD2 LEU 99 -7.833 2.299 1.337 651 H ASP 100 H ASP 100 -9.824 5.704 -2.447 652 HA ASP 100 HA ASP 100 -12.480 5.158 -1.725 653 HB3 ASP 100 2HB ASP 100 -11.275 6.714 -4.031 654 H GLN 101 H GLN 101 -10.598 3.977 -4.483 655 HA GLN 101 HA GLN 101 -12.876 2.898 -5.933 656 HB3 GLN 101 2HB GLN 101 -11.050 1.793 -7.273 657 HG3 GLN 101 2HG GLN 101 -10.614 4.769 -6.777 658 HE21 GLN 101 1HE2 GLN 101 -10.588 5.661 -9.276 659 HE22 GLN 101 2HE2 GLN 101 -9.336 4.882 -10.262 660 H MET 102 H MET 102 -10.166 1.381 -4.169 661 HA MET 102 HA MET 102 -11.311 -1.236 -4.174 662 HB3 MET 102 2HB MET 102 -9.044 -1.374 -4.176 663 HG3 MET 102 2HG MET 102 -9.108 1.067 -2.499 664 HE1 MET 102 3HE MET 102 -6.797 -2.086 -3.031 665 HE2 MET 102 1HE MET 102 -6.106 -0.740 -3.958 666 HE3 MET 102 2HE MET 102 -5.235 -1.381 -2.546 667 H LYS 103 H LYS 103 -12.858 0.971 -2.555 668 HA LYS 103 HA LYS 103 -12.804 0.512 0.181 669 HB3 LYS 103 2HB LYS 103 -15.411 1.117 -0.136 670 HG3 LYS 103 2HG LYS 103 -14.711 3.475 -0.833 671 HD3 LYS 103 2HD LYS 103 -13.376 2.261 1.631 672 HE3 LYS 103 2HE LYS 103 -12.586 4.538 0.959 673 HZ1 LYS 103 3HZ LYS 103 -15.333 5.410 1.641 674 HZ2 LYS 103 1HZ LYS 103 -14.914 5.200 0.103 675 HZ3 LYS 103 2HZ LYS 103 -14.139 6.347 1.011 676 H ASN 104 H ASN 104 -13.986 -1.814 -2.046 677 HA ASN 104 HA ASN 104 -15.995 -2.861 -0.132 678 HB3 ASN 104 2HB ASN 104 -17.050 -3.847 -2.040 679 HD21 ASN 104 1HD2 ASN 104 -15.427 -1.572 -4.110 680 HD22 ASN 104 2HD2 ASN 104 -16.444 -0.196 -3.778 681 H TYR 105 H TYR 105 -12.856 -3.536 -0.606 682 HA TYR 105 HA TYR 105 -12.873 -6.232 -1.476 683 HB3 TYR 105 2HB TYR 105 -10.947 -4.376 -1.364 684 HD1 TYR 105 2HD TYR 105 -11.577 -3.867 1.420 685 HD2 TYR 105 1HD TYR 105 -8.699 -6.642 -0.202 686 HE1 TYR 105 2HE TYR 105 -10.384 -3.863 3.569 687 HE2 TYR 105 1HE TYR 105 -7.483 -6.604 1.922 688 HH TYR 105 HH TYR 105 -7.931 -6.112 4.310 689 H ARG 106 H ARG 106 -11.650 -8.043 -0.221 690 HA ARG 106 HA ARG 106 -11.949 -7.971 2.666 691 HB3 ARG 106 2HB ARG 106 -12.521 -10.383 2.651 692 HG3 ARG 106 2HG ARG 106 -14.754 -9.279 0.989 693 HD3 ARG 106 2HD ARG 106 -15.867 -9.485 3.359 694 HE ARG 106 HE ARG 106 -15.024 -12.184 2.734 695 HH11 ARG 106 1HH1 ARG 106 -17.009 -9.476 1.494 696 HH12 ARG 106 2HH1 ARG 106 -17.984 -10.485 0.483 697 HH21 ARG 106 1HH2 ARG 106 -16.494 -13.509 1.640 698 HH22 ARG 106 2HH2 ARG 106 -17.793 -12.867 0.708 699 H GLY 107 H GLY 107 -10.154 -9.045 3.626 700 HA2 GLY 107 1HA GLY 107 -8.212 -10.631 3.100 701 HA3 GLY 107 2HA GLY 107 -7.826 -9.466 1.825 702 H GLU 108 H GLU 108 -5.748 -9.527 3.306 703 HA GLU 108 HA GLU 108 -5.998 -7.432 5.442 704 HB3 GLU 108 2HB GLU 108 -3.709 -8.298 6.097 705 HG3 GLU 108 2HG GLU 108 -6.095 -10.194 6.328 706 H VAL 109 H VAL 109 -4.315 -5.768 5.462 707 HA VAL 109 HA VAL 109 -3.045 -5.202 2.840 708 HB VAL 109 HB VAL 109 -5.128 -3.590 4.378 709 HG11 VAL 109 1HG1 VAL 109 -3.276 -2.539 2.195 710 HG12 VAL 109 2HG1 VAL 109 -4.693 -1.689 2.865 711 HG13 VAL 109 3HG1 VAL 109 -3.302 -1.999 3.893 712 HG21 VAL 109 3HG2 VAL 109 -4.893 -4.240 1.402 713 HG22 VAL 109 1HG2 VAL 109 -5.910 -5.115 2.558 714 HG23 VAL 109 2HG2 VAL 109 -6.249 -3.420 2.219 715 H ALA 110 H ALA 110 -1.001 -4.226 3.137 716 HA ALA 110 HA ALA 110 -0.502 -3.137 5.883 717 HB1 ALA 110 1HB ALA 110 1.581 -4.127 6.054 718 HB2 ALA 110 2HB ALA 110 0.460 -5.454 5.691 719 HB3 ALA 110 3HB ALA 110 1.529 -4.828 4.424 720 H SER 111 H SER 111 1.291 -1.722 6.078 721 HA SER 111 HA SER 111 1.594 -0.017 3.674 722 HB3 SER 111 2HB SER 111 0.436 1.652 4.647 723 HG SER 111 HG SER 111 -0.406 -0.264 6.553 724 H PHE 112 H PHE 112 3.772 0.359 3.379 725 HA PHE 112 HA PHE 112 5.279 1.099 5.792 726 HB3 PHE 112 2HB PHE 112 6.075 -1.150 4.618 727 HD1 PHE 112 1HD PHE 112 5.449 -0.951 2.146 728 HD2 PHE 112 2HD PHE 112 8.893 0.987 3.865 729 HE1 PHE 112 1HE PHE 112 6.324 -0.520 -0.073 730 HE2 PHE 112 2HE PHE 112 9.822 1.355 1.594 731 HZ PHE 112 HZ PHE 112 8.538 0.595 -0.403 732 H PHE 113 H PHE 113 7.063 2.630 5.229 733 HA PHE 113 HA PHE 113 6.938 4.058 2.745 734 HB3 PHE 113 2HB PHE 113 4.949 5.065 3.690 735 HD1 PHE 113 2HD PHE 113 4.922 3.448 6.244 736 HD2 PHE 113 1HD PHE 113 5.818 7.554 5.475 737 HE1 PHE 113 2HE PHE 113 4.755 3.909 8.624 738 HE2 PHE 113 1HE PHE 113 5.828 8.002 7.861 739 HZ PHE 113 HZ PHE 113 5.263 6.187 9.510 740 H THR 114 H THR 114 8.537 5.884 2.845 741 HA THR 114 HA THR 114 10.815 5.083 4.594 742 HB THR 114 HB THR 114 12.106 6.040 2.576 743 HG1 THR 114 1HG THR 114 10.623 6.999 1.326 744 HG21 THR 114 3HG2 THR 114 11.980 3.939 1.350 745 HG22 THR 114 1HG2 THR 114 10.408 3.554 2.087 746 HG23 THR 114 2HG2 THR 114 11.882 3.597 3.084 747 H SER 115 H SER 115 11.714 6.638 5.943 748 HA SER 115 HA SER 115 11.412 9.398 5.205 749 HB3 SER 115 2HB SER 115 9.877 10.083 6.638 750 HG SER 115 HG SER 115 8.659 8.730 7.825 751 H ALA 116 H ALA 116 12.675 10.845 6.763 752 HA ALA 116 HA ALA 116 15.312 9.580 7.007 753 HB1 ALA 116 1HB ALA 116 16.059 11.940 6.691 754 HB2 ALA 116 2HB ALA 116 15.041 11.357 5.360 755 HB3 ALA 116 3HB ALA 116 14.343 12.431 6.575 756 H GLY 117 H GLY 117 13.494 9.095 9.104 757 HA2 GLY 117 1HA GLY 117 13.920 8.766 11.339 758 HA3 GLY 117 2HA GLY 117 15.354 9.770 11.082 759 H THR 118 H THR 118 12.453 11.492 10.365 760 HA THR 118 HA THR 118 12.086 12.526 13.129 761 HB THR 118 HB THR 118 11.583 14.758 11.777 762 HG1 THR 118 1HG THR 118 13.769 13.862 10.250 763 HG21 THR 118 3HG2 THR 118 14.392 13.790 12.419 764 HG22 THR 118 1HG2 THR 118 13.272 14.584 13.540 765 HG23 THR 118 2HG2 THR 118 13.937 15.481 12.165 766 H ASN 119 H ASN 119 9.855 13.673 13.186 767 HA ASN 119 HA ASN 119 7.709 13.805 12.956 768 HB3 ASN 119 2HB ASN 119 6.805 14.163 10.642 769 HD21 ASN 119 1HD2 ASN 119 7.440 16.411 9.435 770 HD22 ASN 119 2HD2 ASN 119 7.735 17.592 10.630 771 H HIS 120 H HIS 120 8.866 10.956 12.846 772 HA HIS 120 HA HIS 120 7.376 9.164 11.515 773 HB3 HIS 120 2HB HIS 120 8.295 8.845 14.375 774 HD1 HIS 120 1HD HIS 120 8.434 6.346 11.409 775 HD2 HIS 120 2HD HIS 120 6.426 7.025 15.070 776 HE1 HIS 120 1HE HIS 120 6.925 4.330 11.817 777 H LYS 121 H LYS 121 6.451 10.385 14.761 778 HA LYS 121 HA LYS 121 4.060 8.964 14.994 779 HB3 LYS 121 2HB LYS 121 4.604 11.738 16.156 780 HG3 LYS 121 2HG LYS 121 3.642 9.128 17.242 781 HD3 LYS 121 2HD LYS 121 4.204 11.810 18.586 782 HE3 LYS 121 2HE LYS 121 3.316 10.595 20.680 783 HZ1 LYS 121 3HZ LYS 121 2.176 12.498 19.685 784 HZ2 LYS 121 1HZ LYS 121 1.146 11.419 20.387 785 HZ3 LYS 121 2HZ LYS 121 1.226 11.477 18.779 786 H ALA 122 H ALA 122 4.747 12.109 13.438 787 HA ALA 122 HA ALA 122 1.990 12.895 13.156 788 HB1 ALA 122 1HB ALA 122 3.997 14.468 12.925 789 HB2 ALA 122 2HB ALA 122 4.352 13.706 11.364 790 HB3 ALA 122 3HB ALA 122 2.827 14.555 11.597 791 H TYR 123 H TYR 123 4.352 11.370 10.902 792 HA TYR 123 HA TYR 123 2.698 11.087 8.686 793 HB3 TYR 123 2HB TYR 123 4.220 9.549 7.876 794 HD1 TYR 123 2HD TYR 123 4.767 12.424 8.172 795 HD2 TYR 123 1HD TYR 123 6.819 8.914 9.547 796 HE1 TYR 123 2HE TYR 123 6.931 13.599 7.915 797 HE2 TYR 123 1HE TYR 123 8.999 10.087 9.369 798 HH TYR 123 HH TYR 123 9.280 13.079 7.578 799 H VAL 124 H VAL 124 3.076 8.680 11.381 800 HA VAL 124 HA VAL 124 1.373 6.713 10.194 801 HB VAL 124 HB VAL 124 2.152 7.152 13.096 802 HG11 VAL 124 1HG1 VAL 124 1.680 4.793 13.457 803 HG12 VAL 124 2HG1 VAL 124 0.203 5.579 12.908 804 HG13 VAL 124 3HG1 VAL 124 1.147 4.562 11.785 805 HG21 VAL 124 3HG2 VAL 124 3.824 5.361 12.576 806 HG22 VAL 124 1HG2 VAL 124 3.331 5.413 10.875 807 HG23 VAL 124 2HG2 VAL 124 4.108 6.817 11.636 808 H SER 125 H SER 125 0.554 9.487 12.445 809 HA SER 125 HA SER 125 -2.225 8.621 12.530 810 HB3 SER 125 2HB SER 125 -2.412 11.021 13.581 811 HG SER 125 HG SER 125 -2.619 9.185 14.722 812 H HIS 126 H HIS 126 -0.361 11.044 10.661 813 HA HIS 126 HA HIS 126 -2.628 12.231 9.389 814 HB3 HIS 126 2HB HIS 126 -0.924 12.870 7.631 815 HD1 HIS 126 1HD HIS 126 1.748 14.199 9.176 816 HD2 HIS 126 2HD HIS 126 -2.336 14.260 10.276 817 HE1 HIS 126 1HE HIS 126 1.400 16.280 10.533 818 H PHE 127 H PHE 127 -0.640 9.341 8.523 819 HA PHE 127 HA PHE 127 -2.109 8.833 6.090 820 HB3 PHE 127 2HB PHE 127 -0.497 7.019 7.921 821 HD1 PHE 127 1HD PHE 127 -1.812 7.212 4.340 822 HD2 PHE 127 2HD PHE 127 -0.889 4.710 7.756 823 HE1 PHE 127 1HE PHE 127 -2.535 5.216 3.095 824 HE2 PHE 127 2HE PHE 127 -1.593 2.724 6.464 825 HZ PHE 127 HZ PHE 127 -2.376 2.973 4.114 826 H ASN 128 H ASN 128 -2.520 7.743 9.501 827 HA ASN 128 HA ASN 128 -4.562 5.901 9.026 828 HB3 ASN 128 2HB ASN 128 -5.318 6.889 11.467 829 HD21 ASN 128 1HD2 ASN 128 -1.950 5.730 11.154 830 HD22 ASN 128 2HD2 ASN 128 -2.332 4.067 11.602 831 H GLU 129 H GLU 129 -4.885 9.436 9.401 832 HA GLU 129 HA GLU 129 -7.724 9.638 9.394 833 HB3 GLU 129 2HB GLU 129 -6.863 11.777 7.836 834 HG3 GLU 129 2HG GLU 129 -5.998 12.197 10.602 835 H TRP 130 H TRP 130 -5.483 9.792 6.630 836 HA TRP 130 HA TRP 130 -7.556 9.702 4.678 837 HB3 TRP 130 2HB TRP 130 -5.636 9.397 3.116 838 HD1 TRP 130 HD TRP 130 -3.325 11.289 5.154 839 HE1 TRP 130 1HE TRP 130 -3.613 13.796 4.882 840 HE3 TRP 130 3HE TRP 130 -8.035 11.303 3.239 841 HZ2 TRP 130 2HZ TRP 130 -5.622 15.603 3.774 842 HZ3 TRP 130 3HZ TRP 130 -9.167 13.453 2.650 843 HH2 TRP 130 HH TRP 130 -7.964 15.586 2.930 844 H ALA 131 H ALA 131 -6.734 7.097 6.674 845 HA ALA 131 HA ALA 131 -7.201 5.121 4.526 846 HB1 ALA 131 1HB ALA 131 -5.332 3.792 5.346 847 HB2 ALA 131 2HB ALA 131 -4.757 5.403 4.883 848 HB3 ALA 131 3HB ALA 131 -4.976 4.997 6.602 849 H ASP 132 H ASP 132 -8.594 6.352 7.134 850 HA ASP 132 HA ASP 132 -8.995 3.963 8.687 851 HB3 ASP 132 2HB ASP 132 -10.897 6.302 8.664 852 H GLY 133 H GLY 133 -9.905 2.272 7.579 853 HA2 GLY 133 1HA GLY 133 -12.493 2.239 6.445 854 HA3 GLY 133 2HA GLY 133 -11.402 2.680 5.139 855 H LEU 134 H LEU 134 -9.413 1.093 4.937 856 HA LEU 134 HA LEU 134 -10.548 -1.645 4.806 857 HB3 LEU 134 2HB LEU 134 -8.636 -2.153 3.335 858 HG LEU 134 HG LEU 134 -9.860 0.543 2.652 859 HD11 LEU 134 1HD1 LEU 134 -9.198 0.201 0.370 860 HD12 LEU 134 2HD1 LEU 134 -8.538 -1.405 0.750 861 HD13 LEU 134 3HD1 LEU 134 -7.761 0.035 1.406 862 HD21 LEU 134 3HD2 LEU 134 -11.346 -1.736 2.826 863 HD22 LEU 134 1HD2 LEU 134 -10.758 -1.865 1.161 864 HD23 LEU 134 2HD2 LEU 134 -11.661 -0.441 1.687 865 H ASN 135 H ASN 135 -9.334 -3.526 5.540 866 HA ASN 135 HA ASN 135 -8.475 -3.127 8.235 867 HB3 ASN 135 2HB ASN 135 -8.726 -5.587 6.509 868 HD21 ASN 135 1HD2 ASN 135 -7.589 -7.324 7.264 869 HD22 ASN 135 2HD2 ASN 135 -7.167 -7.596 8.944 870 H VAL 136 H VAL 136 -6.604 -1.869 8.018 871 HA VAL 136 HA VAL 136 -4.184 -2.785 6.853 872 HB VAL 136 HB VAL 136 -4.641 -0.869 9.187 873 HG11 VAL 136 1HG1 VAL 136 -2.216 -1.347 7.402 874 HG12 VAL 136 2HG1 VAL 136 -2.438 0.096 8.416 875 HG13 VAL 136 3HG1 VAL 136 -2.312 -1.478 9.183 876 HG21 VAL 136 3HG2 VAL 136 -4.340 0.890 7.409 877 HG22 VAL 136 1HG2 VAL 136 -4.395 -0.404 6.180 878 HG23 VAL 136 2HG2 VAL 136 -5.797 -0.067 7.229 879 H ILE 137 H ILE 137 -2.589 -4.224 7.665 880 HA ILE 137 HA ILE 137 -2.872 -5.163 10.464 881 HB ILE 137 HB ILE 137 -1.623 -7.152 9.649 882 HG13 ILE 137 2HG1 ILE 137 -0.828 -5.751 7.521 883 HG21 ILE 137 1HG2 ILE 137 -4.099 -7.053 9.937 884 HG22 ILE 137 2HG2 ILE 137 -4.279 -6.572 8.237 885 HG23 ILE 137 3HG2 ILE 137 -3.603 -8.151 8.653 886 HD11 ILE 137 3HD1 ILE 137 -1.620 -8.638 7.121 887 HD12 ILE 137 1HD1 ILE 137 -0.411 -7.700 6.220 888 HD13 ILE 137 2HD1 ILE 137 -0.137 -8.083 7.924 889 H GLY 138 H GLY 138 -0.976 -3.059 8.618 890 HA2 GLY 138 1HA GLY 138 0.757 -2.712 10.844 891 HA3 GLY 138 2HA GLY 138 1.648 -3.386 9.471 892 H VAL 139 H VAL 139 1.779 -0.818 10.756 893 HA VAL 139 HA VAL 139 2.014 0.709 8.308 894 HB VAL 139 HB VAL 139 1.100 2.207 10.802 895 HG11 VAL 139 1HG1 VAL 139 2.580 3.462 9.315 896 HG12 VAL 139 2HG1 VAL 139 1.526 3.087 7.932 897 HG13 VAL 139 3HG1 VAL 139 0.925 4.094 9.267 898 HG21 VAL 139 3HG2 VAL 139 -0.469 1.506 8.296 899 HG22 VAL 139 1HG2 VAL 139 -0.827 0.945 9.946 900 HG23 VAL 139 2HG2 VAL 139 -0.995 2.658 9.544 901 H ALA 140 H ALA 140 4.145 0.352 8.208 902 HA ALA 140 HA ALA 140 5.865 0.744 10.598 903 HB1 ALA 140 1HB ALA 140 5.336 -1.689 10.315 904 HB2 ALA 140 2HB ALA 140 6.078 -1.629 8.699 905 HB3 ALA 140 3HB ALA 140 7.061 -1.315 10.139 906 H ARG 141 H ARG 141 8.328 0.127 9.290 907 HA ARG 141 HA ARG 141 8.250 1.792 6.887 908 HB3 ARG 141 2HB ARG 141 8.896 3.349 8.719 909 HG3 ARG 141 2HG ARG 141 11.556 3.047 9.017 910 HD3 ARG 141 2HD ARG 141 10.634 1.679 11.304 911 HE ARG 141 HE ARG 141 11.748 4.121 10.781 912 HH11 ARG 141 1HH1 ARG 141 9.089 3.043 12.893 913 HH12 ARG 141 2HH1 ARG 141 9.586 3.970 14.250 914 HH21 ARG 141 1HH2 ARG 141 12.364 5.470 12.541 915 HH22 ARG 141 2HH2 ARG 141 11.447 5.430 14.026 916 H ASP 142 H ASP 142 10.203 1.596 5.669 917 HA ASP 142 HA ASP 142 11.500 0.250 4.405 918 HB3 ASP 142 2HB ASP 142 13.463 -0.611 5.741 919 H ASP 143 H ASP 143 12.760 -2.308 5.362 920 HA ASP 143 HA ASP 143 10.437 -4.055 4.753 921 HB3 ASP 143 2HB ASP 143 11.912 -3.904 2.917 922 H SER 144 H SER 144 10.647 -3.472 7.488 923 HA SER 144 HA SER 144 11.984 -5.748 8.679 924 HB3 SER 144 2HB SER 144 11.306 -4.063 10.564 925 HG SER 144 HG SER 144 13.332 -3.246 10.350 926 H GLU 145 H GLU 145 8.681 -4.844 7.754 927 HA GLU 145 HA GLU 145 7.690 -6.846 9.730 928 HB3 GLU 145 2HB GLU 145 5.440 -5.916 9.304 929 HG3 GLU 145 2HG GLU 145 7.149 -3.703 10.411 930 H VAL 146 H VAL 146 8.828 -7.023 6.765 931 HA VAL 146 HA VAL 146 6.911 -8.160 5.102 932 HB VAL 146 HB VAL 146 9.758 -9.174 5.527 933 HG11 VAL 146 1HG1 VAL 146 9.809 -9.739 3.189 934 HG12 VAL 146 2HG1 VAL 146 8.443 -10.552 3.958 935 HG13 VAL 146 3HG1 VAL 146 8.170 -9.112 2.952 936 HG21 VAL 146 3HG2 VAL 146 9.840 -6.702 5.257 937 HG22 VAL 146 1HG2 VAL 146 10.516 -7.531 3.865 938 HG23 VAL 146 2HG2 VAL 146 8.869 -6.850 3.779 939 H ASP 147 H ASP 147 8.601 -9.638 7.788 940 HA ASP 147 HA ASP 147 7.903 -12.342 7.341 941 HB3 ASP 147 2HB ASP 147 8.254 -12.247 10.055 942 H LYS 148 H LYS 148 5.876 -9.762 8.492 943 HA LYS 148 HA LYS 148 3.897 -11.754 9.544 944 HB3 LYS 148 2HB LYS 148 4.602 -10.419 11.359 945 HG3 LYS 148 2HG LYS 148 4.275 -7.995 9.588 946 HD3 LYS 148 2HD LYS 148 4.973 -6.740 11.684 947 HE3 LYS 148 2HE LYS 148 2.151 -7.854 11.852 948 HZ1 LYS 148 3HZ LYS 148 2.779 -5.932 13.267 949 HZ2 LYS 148 1HZ LYS 148 1.625 -5.535 12.141 950 HZ3 LYS 148 2HZ LYS 148 3.191 -5.085 11.916 951 H TRP 149 H TRP 149 4.553 -9.571 6.975 952 HA TRP 149 HA TRP 149 1.673 -9.088 6.559 953 HB3 TRP 149 2HB TRP 149 2.357 -7.613 4.809 954 HD1 TRP 149 HD TRP 149 2.025 -7.566 8.237 955 HE1 TRP 149 1HE TRP 149 2.580 -5.309 9.279 956 HE3 TRP 149 3HE TRP 149 4.710 -5.561 4.412 957 HZ2 TRP 149 2HZ TRP 149 3.776 -2.811 8.447 958 HZ3 TRP 149 3HZ TRP 149 5.438 -3.203 4.486 959 HH2 TRP 149 HH TRP 149 5.012 -1.824 6.531 960 H SER 150 H SER 150 3.137 -11.915 5.971 961 HA SER 150 HA SER 150 1.794 -12.309 3.387 962 HB3 SER 150 2HB SER 150 4.748 -12.925 3.650 963 HG SER 150 HG SER 150 4.532 -12.726 1.353 964 H LYS 151 H LYS 151 1.311 -13.245 6.142 965 HA LYS 151 HA LYS 151 2.185 -15.914 6.495 966 HB3 LYS 151 2HB LYS 151 0.026 -14.101 7.637 967 HG3 LYS 151 2HG LYS 151 0.924 -16.857 8.484 968 HD3 LYS 151 2HD LYS 151 0.775 -15.170 10.372 969 HE3 LYS 151 2HE LYS 151 -2.215 -15.332 9.874 970 HZ1 LYS 151 3HZ LYS 151 -2.184 -13.727 11.692 971 HZ2 LYS 151 1HZ LYS 151 -0.558 -13.858 11.853 972 HZ3 LYS 151 2HZ LYS 151 -1.538 -15.136 12.192 Start of MODEL 20 1 H1 GLY 1 H GLY 1 -9.672 -24.320 1.411 2 HA2 GLY 1 1HA GLY 1 -8.601 -25.167 -0.650 3 HA3 GLY 1 2HA GLY 1 -10.090 -24.270 -0.969 4 H MET 2 H MET 2 -9.107 -24.039 -3.126 5 HA MET 2 HA MET 2 -6.667 -22.543 -3.452 6 HB3 MET 2 2HB MET 2 -7.148 -24.346 -4.903 7 HG3 MET 2 2HG MET 2 -9.496 -22.833 -6.086 8 HE1 MET 2 3HE MET 2 -10.462 -25.172 -8.946 9 HE2 MET 2 1HE MET 2 -11.149 -25.098 -7.308 10 HE3 MET 2 2HE MET 2 -10.691 -23.599 -8.149 11 H ALA 3 H ALA 3 -7.371 -20.579 -2.200 12 HA ALA 3 HA ALA 3 -7.941 -18.507 -4.152 13 HB1 ALA 3 1HB ALA 3 -9.767 -17.443 -2.855 14 HB2 ALA 3 2HB ALA 3 -10.254 -19.019 -3.510 15 HB3 ALA 3 3HB ALA 3 -9.845 -18.860 -1.786 16 H LYS 4 H LYS 4 -5.736 -17.990 -3.606 17 HA LYS 4 HA LYS 4 -5.805 -15.836 -1.778 18 HB3 LYS 4 2HB LYS 4 -5.169 -17.517 -0.080 19 HG3 LYS 4 2HG LYS 4 -2.897 -18.347 0.070 20 HD3 LYS 4 2HD LYS 4 -4.830 -19.688 -1.302 21 HE3 LYS 4 2HE LYS 4 -3.720 -18.906 -3.497 22 HZ1 LYS 4 3HZ LYS 4 -1.766 -20.063 -4.126 23 HZ2 LYS 4 1HZ LYS 4 -1.575 -20.748 -2.629 24 HZ3 LYS 4 2HZ LYS 4 -1.446 -19.124 -2.867 25 H LYS 5 H LYS 5 -3.918 -14.362 -2.074 26 HA LYS 5 HA LYS 5 -1.743 -14.992 -3.790 27 HB3 LYS 5 2HB LYS 5 -2.069 -13.069 -5.364 28 HG3 LYS 5 2HG LYS 5 -4.320 -14.912 -5.890 29 HD3 LYS 5 2HD LYS 5 -2.031 -13.721 -7.531 30 HE3 LYS 5 2HE LYS 5 -2.394 -15.947 -8.390 31 HZ1 LYS 5 3HZ LYS 5 -4.495 -16.620 -9.246 32 HZ2 LYS 5 1HZ LYS 5 -5.224 -15.210 -8.752 33 HZ3 LYS 5 2HZ LYS 5 -4.700 -16.280 -7.663 34 H THR 6 H THR 6 -0.313 -13.179 -3.973 35 HA THR 6 HA THR 6 -0.651 -11.118 -1.824 36 HB THR 6 HB THR 6 1.877 -12.725 -2.398 37 HG1 THR 6 1HG THR 6 1.307 -13.422 -0.144 38 HG21 THR 6 3HG2 THR 6 1.174 -10.617 -0.309 39 HG22 THR 6 1HG2 THR 6 2.422 -10.529 -1.577 40 HG23 THR 6 2HG2 THR 6 2.614 -11.664 -0.238 41 H LEU 7 H LEU 7 -1.000 -9.299 -3.021 42 HA LEU 7 HA LEU 7 0.911 -8.620 -5.244 43 HB3 LEU 7 2HB LEU 7 -1.592 -7.279 -4.211 44 HG LEU 7 HG LEU 7 -0.338 -5.594 -5.472 45 HD11 LEU 7 1HD1 LEU 7 -0.273 -7.620 -7.760 46 HD12 LEU 7 2HD1 LEU 7 1.148 -7.042 -6.860 47 HD13 LEU 7 3HD1 LEU 7 0.235 -5.925 -7.861 48 HD21 LEU 7 3HD2 LEU 7 -2.781 -5.712 -5.735 49 HD22 LEU 7 1HD2 LEU 7 -2.603 -6.852 -7.088 50 HD23 LEU 7 2HD2 LEU 7 -2.024 -5.185 -7.253 51 H ILE 8 H ILE 8 1.877 -6.436 -5.247 52 HA ILE 8 HA ILE 8 2.336 -5.226 -2.609 53 HB ILE 8 HB ILE 8 4.532 -5.586 -4.729 54 HG13 ILE 8 2HG1 ILE 8 3.859 -7.903 -3.753 55 HG21 ILE 8 1HG2 ILE 8 5.918 -4.968 -2.661 56 HG22 ILE 8 2HG2 ILE 8 4.667 -3.752 -2.974 57 HG23 ILE 8 3HG2 ILE 8 4.447 -4.941 -1.691 58 HD11 ILE 8 3HD1 ILE 8 6.140 -7.481 -4.624 59 HD12 ILE 8 1HD1 ILE 8 6.656 -7.004 -2.988 60 HD13 ILE 8 2HD1 ILE 8 6.076 -8.643 -3.280 61 H LEU 9 H LEU 9 2.076 -2.962 -2.788 62 HA LEU 9 HA LEU 9 2.557 -1.726 -5.427 63 HB3 LEU 9 2HB LEU 9 0.728 -0.096 -5.006 64 HG LEU 9 HG LEU 9 0.525 -2.485 -6.311 65 HD11 LEU 9 1HD1 LEU 9 -1.747 -2.408 -4.281 66 HD12 LEU 9 2HD1 LEU 9 -0.459 -3.632 -4.395 67 HD13 LEU 9 3HD1 LEU 9 -1.650 -3.481 -5.696 68 HD21 LEU 9 3HD2 LEU 9 -0.317 -0.395 -7.166 69 HD22 LEU 9 1HD2 LEU 9 -1.652 -0.399 -5.977 70 HD23 LEU 9 2HD2 LEU 9 -1.573 -1.640 -7.246 71 H TYR 10 H TYR 10 3.413 0.333 -5.336 72 HA TYR 10 HA TYR 10 3.518 1.843 -2.880 73 HB3 TYR 10 2HB TYR 10 5.322 0.964 -2.052 74 HD1 TYR 10 2HD TYR 10 5.775 0.226 -5.776 75 HD2 TYR 10 1HD TYR 10 6.586 -0.885 -1.679 76 HE1 TYR 10 2HE TYR 10 6.382 -2.009 -6.484 77 HE2 TYR 10 1HE TYR 10 7.254 -3.093 -2.382 78 HH TYR 10 HH TYR 10 7.515 -4.540 -4.086 79 H TYR 11 H TYR 11 4.427 3.873 -3.104 80 HA TYR 11 HA TYR 11 4.785 4.804 -5.919 81 HB3 TYR 11 2HB TYR 11 4.026 6.440 -3.462 82 HD1 TYR 11 1HD TYR 11 4.150 6.420 -7.247 83 HD2 TYR 11 2HD TYR 11 4.508 8.748 -3.659 84 HE1 TYR 11 1HE TYR 11 4.767 8.361 -8.614 85 HE2 TYR 11 2HE TYR 11 5.266 10.712 -5.025 86 HH TYR 11 HH TYR 11 6.305 11.078 -7.418 87 H SER 12 H SER 12 6.454 6.827 -5.743 88 HA SER 12 HA SER 12 8.883 5.850 -4.290 89 HB3 SER 12 2HB SER 12 9.297 5.125 -6.460 90 HG SER 12 HG SER 12 8.476 7.620 -7.547 91 H TRP 13 H TRP 13 10.583 7.779 -4.610 92 HA TRP 13 HA TRP 13 9.295 10.391 -4.500 93 HB3 TRP 13 2HB TRP 13 11.276 9.624 -2.318 94 HD1 TRP 13 HD TRP 13 8.131 11.832 -2.747 95 HE1 TRP 13 1HE TRP 13 8.530 14.094 -1.681 96 HE3 TRP 13 3HE TRP 13 12.965 11.134 -1.180 97 HZ2 TRP 13 2HZ TRP 13 10.769 15.540 -0.447 98 HZ3 TRP 13 3HZ TRP 13 14.163 12.938 0.003 99 HH2 TRP 13 HH TRP 13 13.064 15.142 0.389 100 H SER 14 H SER 14 12.637 9.491 -3.604 101 HA SER 14 HA SER 14 13.518 10.150 -6.361 102 HB3 SER 14 2HB SER 14 15.268 11.165 -4.184 103 HG SER 14 HG SER 14 15.625 11.779 -6.278 104 H GLY 15 H GLY 15 13.199 7.608 -5.977 105 HA2 GLY 15 1HA GLY 15 14.397 5.694 -6.378 106 HA3 GLY 15 2HA GLY 15 15.888 6.620 -6.221 107 H GLU 16 H GLU 16 13.701 6.766 -3.557 108 HA GLU 16 HA GLU 16 15.542 5.269 -1.778 109 HB3 GLU 16 2HB GLU 16 14.892 6.970 -0.341 110 HG3 GLU 16 2HG GLU 16 12.560 7.461 -2.220 111 H THR 17 H THR 17 12.119 5.600 -1.931 112 HA THR 17 HA THR 17 11.228 3.226 -0.958 113 HB THR 17 HB THR 17 9.546 4.333 -2.944 114 HG1 THR 17 1HG THR 17 10.407 6.505 -1.421 115 HG21 THR 17 3HG2 THR 17 8.707 3.528 -0.765 116 HG22 THR 17 1HG2 THR 17 8.076 5.142 -1.185 117 HG23 THR 17 2HG2 THR 17 9.379 4.990 -0.002 118 H LYS 18 H LYS 18 12.318 4.015 -4.186 119 HA LYS 18 HA LYS 18 11.126 1.805 -5.530 120 HB3 LYS 18 2HB LYS 18 13.608 3.406 -6.275 121 HG3 LYS 18 2HG LYS 18 13.136 1.300 -7.703 122 HD3 LYS 18 2HD LYS 18 11.303 1.969 -9.465 123 HE3 LYS 18 2HE LYS 18 11.030 0.534 -6.872 124 HZ1 LYS 18 3HZ LYS 18 8.631 0.067 -7.673 125 HZ2 LYS 18 1HZ LYS 18 8.708 1.518 -8.390 126 HZ3 LYS 18 2HZ LYS 18 8.896 1.424 -6.758 127 H LYS 19 H LYS 19 14.145 2.164 -3.842 128 HA LYS 19 HA LYS 19 15.308 -0.418 -4.534 129 HB3 LYS 19 2HB LYS 19 15.778 0.680 -1.787 130 HG3 LYS 19 2HG LYS 19 17.176 -1.104 -3.214 131 HD3 LYS 19 2HD LYS 19 19.152 -0.107 -4.240 132 HE3 LYS 19 2HE LYS 19 16.574 1.087 -5.321 133 HZ1 LYS 19 3HZ LYS 19 19.079 0.832 -6.796 134 HZ2 LYS 19 1HZ LYS 19 18.488 2.268 -6.141 135 HZ3 LYS 19 2HZ LYS 19 17.614 1.496 -7.258 136 H MET 20 H MET 20 13.318 0.720 -1.865 137 HA MET 20 HA MET 20 12.924 -1.888 -0.771 138 HB3 MET 20 2HB MET 20 11.130 0.456 -0.111 139 HG3 MET 20 2HG MET 20 11.131 -1.511 1.362 140 HE1 MET 20 3HE MET 20 14.816 -0.014 0.911 141 HE2 MET 20 1HE MET 20 14.328 0.344 2.590 142 HE3 MET 20 2HE MET 20 15.629 -0.824 2.259 143 H ALA 21 H ALA 21 12.065 -1.782 -3.598 144 HA ALA 21 HA ALA 21 9.312 -2.690 -3.229 145 HB1 ALA 21 1HB ALA 21 9.157 -0.624 -4.503 146 HB2 ALA 21 2HB ALA 21 10.569 -1.050 -5.491 147 HB3 ALA 21 3HB ALA 21 9.077 -1.945 -5.700 148 H GLU 22 H GLU 22 12.002 -2.744 -5.611 149 HA GLU 22 HA GLU 22 11.187 -5.373 -6.457 150 HB3 GLU 22 2HB GLU 22 11.956 -4.147 -8.136 151 HG3 GLU 22 2HG GLU 22 14.307 -3.159 -6.543 152 H LYS 23 H LYS 23 13.382 -4.321 -3.966 153 HA LYS 23 HA LYS 23 14.834 -6.778 -3.749 154 HB3 LYS 23 2HB LYS 23 14.582 -5.612 -1.228 155 HG3 LYS 23 2HG LYS 23 16.679 -6.302 -2.614 156 HD3 LYS 23 2HD LYS 23 16.676 -3.313 -3.232 157 HE3 LYS 23 2HE LYS 23 18.227 -4.075 -5.069 158 HZ1 LYS 23 3HZ LYS 23 19.203 -3.326 -2.956 159 HZ2 LYS 23 1HZ LYS 23 20.092 -4.409 -3.741 160 HZ3 LYS 23 2HZ LYS 23 19.238 -4.860 -2.389 161 H ILE 24 H ILE 24 12.070 -5.458 -1.834 162 HA ILE 24 HA ILE 24 11.576 -7.840 -0.468 163 HB ILE 24 HB ILE 24 9.684 -5.535 -1.110 164 HG13 ILE 24 2HG1 ILE 24 11.849 -4.950 0.129 165 HG21 ILE 24 1HG2 ILE 24 8.501 -6.378 1.000 166 HG22 ILE 24 2HG2 ILE 24 8.367 -7.437 -0.392 167 HG23 ILE 24 3HG2 ILE 24 9.514 -7.824 0.908 168 HD11 ILE 24 3HD1 ILE 24 9.756 -3.618 0.447 169 HD12 ILE 24 1HD1 ILE 24 9.395 -4.614 1.871 170 HD13 ILE 24 2HD1 ILE 24 10.842 -3.624 1.848 171 H ASN 25 H ASN 25 10.304 -6.719 -3.654 172 HA ASN 25 HA ASN 25 8.348 -8.667 -4.049 173 HB3 ASN 25 2HB ASN 25 10.283 -7.441 -6.013 174 HD21 ASN 25 1HD2 ASN 25 7.010 -9.192 -5.984 175 HD22 ASN 25 2HD2 ASN 25 7.470 -10.144 -7.337 176 H SER 26 H SER 26 11.877 -9.015 -4.675 177 HA SER 26 HA SER 26 11.774 -11.700 -5.626 178 HB3 SER 26 2HB SER 26 13.989 -10.202 -4.173 179 HG SER 26 HG SER 26 15.074 -11.921 -4.582 180 H GLU 27 H GLU 27 11.765 -10.312 -2.339 181 HA GLU 27 HA GLU 27 12.472 -12.874 -1.091 182 HB3 GLU 27 2HB GLU 27 12.321 -11.452 0.964 183 HG3 GLU 27 2HG GLU 27 14.215 -9.768 -0.417 184 H ILE 28 H ILE 28 9.552 -11.496 -2.152 185 HA ILE 28 HA ILE 28 8.011 -13.039 -0.101 186 HB ILE 28 HB ILE 28 7.177 -10.753 -1.933 187 HG13 ILE 28 2HG1 ILE 28 8.311 -10.039 0.115 188 HG21 ILE 28 1HG2 ILE 28 4.890 -11.027 -1.059 189 HG22 ILE 28 2HG2 ILE 28 5.363 -12.497 -1.868 190 HG23 ILE 28 3HG2 ILE 28 5.392 -12.430 -0.095 191 HD11 ILE 28 3HD1 ILE 28 5.371 -9.858 0.807 192 HD12 ILE 28 1HD1 ILE 28 6.660 -8.721 1.226 193 HD13 ILE 28 2HD1 ILE 28 6.122 -8.854 -0.464 194 H LYS 29 H LYS 29 6.886 -14.816 -0.790 195 HA LYS 29 HA LYS 29 7.432 -15.708 -3.518 196 HB3 LYS 29 2HB LYS 29 5.793 -17.319 -1.543 197 HG3 LYS 29 2HG LYS 29 8.162 -18.624 -2.484 198 HD3 LYS 29 2HD LYS 29 5.729 -19.559 -2.156 199 HE3 LYS 29 2HE LYS 29 5.774 -18.970 -5.154 200 HZ1 LYS 29 3HZ LYS 29 3.685 -19.922 -5.192 201 HZ2 LYS 29 1HZ LYS 29 3.506 -19.923 -3.549 202 HZ3 LYS 29 2HZ LYS 29 4.519 -20.982 -4.306 203 H ASP 30 H ASP 30 5.818 -16.262 -4.876 204 HA ASP 30 HA ASP 30 3.843 -16.101 -6.075 205 HB3 ASP 30 2HB ASP 30 2.284 -15.542 -3.543 206 H SER 31 H SER 31 5.481 -13.529 -5.017 207 HA SER 31 HA SER 31 3.662 -11.467 -4.606 208 HB3 SER 31 2HB SER 31 5.881 -11.417 -3.758 209 HG SER 31 HG SER 31 7.638 -11.907 -4.920 210 H GLU 32 H GLU 32 3.052 -9.756 -6.007 211 HA GLU 32 HA GLU 32 4.157 -9.721 -8.715 212 HB3 GLU 32 2HB GLU 32 1.878 -8.402 -9.162 213 HG3 GLU 32 2HG GLU 32 2.158 -11.416 -9.260 214 H LEU 33 H LEU 33 3.808 -7.335 -9.434 215 HA LEU 33 HA LEU 33 4.964 -5.654 -7.316 216 HB3 LEU 33 2HB LEU 33 6.485 -5.941 -9.914 217 HG LEU 33 HG LEU 33 7.324 -6.038 -7.028 218 HD11 LEU 33 1HD1 LEU 33 9.598 -5.345 -7.925 219 HD12 LEU 33 2HD1 LEU 33 8.911 -5.259 -9.549 220 HD13 LEU 33 3HD1 LEU 33 9.041 -6.826 -8.752 221 HD21 LEU 33 3HD2 LEU 33 8.099 -3.714 -7.193 222 HD22 LEU 33 1HD2 LEU 33 6.341 -4.010 -7.146 223 HD23 LEU 33 2HD2 LEU 33 7.127 -3.599 -8.716 224 H LYS 34 H LYS 34 3.534 -3.996 -7.478 225 HA LYS 34 HA LYS 34 3.259 -2.711 -10.177 226 HB3 LYS 34 2HB LYS 34 0.877 -2.019 -9.255 227 HG3 LYS 34 2HG LYS 34 -0.180 -4.196 -10.003 228 HD3 LYS 34 2HD LYS 34 0.553 -4.160 -12.360 229 HE3 LYS 34 2HE LYS 34 0.291 -1.314 -11.327 230 HZ1 LYS 34 3HZ LYS 34 0.508 -1.710 -13.784 231 HZ2 LYS 34 1HZ LYS 34 -0.917 -0.997 -13.391 232 HZ3 LYS 34 2HZ LYS 34 -0.843 -2.580 -13.764 233 H GLU 35 H GLU 35 2.653 -0.395 -10.002 234 HA GLU 35 HA GLU 35 3.253 0.881 -7.455 235 HB3 GLU 35 2HB GLU 35 5.480 0.741 -8.414 236 HG3 GLU 35 2HG GLU 35 6.033 2.009 -10.492 237 H VAL 36 H VAL 36 3.050 3.363 -7.845 238 HA VAL 36 HA VAL 36 0.578 3.835 -9.429 239 HB VAL 36 HB VAL 36 1.261 5.083 -6.746 240 HG11 VAL 36 1HG1 VAL 36 -1.212 5.410 -6.668 241 HG12 VAL 36 2HG1 VAL 36 -0.523 6.212 -8.069 242 HG13 VAL 36 3HG1 VAL 36 -1.373 4.666 -8.269 243 HG21 VAL 36 3HG2 VAL 36 -0.339 3.506 -5.669 244 HG22 VAL 36 1HG2 VAL 36 -0.316 2.520 -7.148 245 HG23 VAL 36 2HG2 VAL 36 1.158 2.743 -6.175 246 H LYS 37 H LYS 37 0.357 6.246 -9.897 247 HA LYS 37 HA LYS 37 2.730 7.905 -9.788 248 HB3 LYS 37 2HB LYS 37 2.284 8.699 -12.144 249 HG3 LYS 37 2HG LYS 37 3.241 5.842 -11.788 250 HD3 LYS 37 2HD LYS 37 2.306 6.373 -14.080 251 HE3 LYS 37 2HE LYS 37 4.878 7.375 -15.027 252 HZ1 LYS 37 3HZ LYS 37 2.508 9.013 -15.430 253 HZ2 LYS 37 1HZ LYS 37 2.509 7.494 -16.081 254 HZ3 LYS 37 2HZ LYS 37 3.682 8.563 -16.463 255 H VAL 38 H VAL 38 1.905 10.190 -9.973 256 HA VAL 38 HA VAL 38 -1.025 10.417 -9.522 257 HB VAL 38 HB VAL 38 -0.597 12.506 -8.313 258 HG11 VAL 38 1HG1 VAL 38 -0.942 10.355 -7.133 259 HG12 VAL 38 2HG1 VAL 38 0.819 10.194 -6.974 260 HG13 VAL 38 3HG1 VAL 38 -0.028 11.555 -6.203 261 HG21 VAL 38 3HG2 VAL 38 1.760 12.864 -9.275 262 HG22 VAL 38 1HG2 VAL 38 1.493 13.256 -7.597 263 HG23 VAL 38 2HG2 VAL 38 2.327 11.736 -8.038 264 H SER 39 H SER 39 -1.491 13.001 -10.069 265 HA SER 39 HA SER 39 -1.117 13.314 -12.867 266 HB3 SER 39 2HB SER 39 -2.019 15.627 -11.701 267 HG SER 39 HG SER 39 -4.109 14.792 -12.177 268 H GLU 40 H GLU 40 -0.505 15.714 -13.442 269 HA GLU 40 HA GLU 40 2.207 16.281 -12.381 270 HB3 GLU 40 2HB GLU 40 1.895 18.274 -14.062 271 HG3 GLU 40 2HG GLU 40 2.153 15.411 -15.050 272 H GLY 41 H GLY 41 2.562 17.699 -10.853 273 HA2 GLY 41 1HA GLY 41 2.462 19.990 -10.306 274 HA3 GLY 41 2HA GLY 41 0.726 19.984 -10.613 275 H THR 42 H THR 42 1.475 17.127 -8.775 276 HA THR 42 HA THR 42 0.045 18.325 -6.597 277 HB THR 42 HB THR 42 1.234 15.548 -6.674 278 HG1 THR 42 1HG THR 42 -1.091 16.435 -8.039 279 HG21 THR 42 3HG2 THR 42 -1.459 16.595 -5.672 280 HG22 THR 42 1HG2 THR 42 -0.051 16.360 -4.638 281 HG23 THR 42 2HG2 THR 42 -0.785 14.961 -5.437 282 H PHE 43 H PHE 43 3.504 17.436 -7.307 283 HA PHE 43 HA PHE 43 4.355 18.915 -5.053 284 HB3 PHE 43 2HB PHE 43 3.772 17.366 -3.684 285 HD1 PHE 43 1HD PHE 43 5.513 14.981 -5.954 286 HD2 PHE 43 2HD PHE 43 2.020 16.098 -3.802 287 HE1 PHE 43 1HE PHE 43 4.549 12.736 -6.462 288 HE2 PHE 43 2HE PHE 43 0.994 13.802 -4.268 289 HZ PHE 43 HZ PHE 43 2.296 12.129 -5.568 290 H ASP 44 H ASP 44 6.722 18.653 -4.626 291 HA ASP 44 HA ASP 44 8.105 18.217 -7.237 292 HB3 ASP 44 2HB ASP 44 8.516 20.807 -5.753 293 H ALA 45 H ALA 45 8.290 17.088 -4.493 294 HA ALA 45 HA ALA 45 9.760 16.439 -2.845 295 HB1 ALA 45 1HB ALA 45 11.955 15.811 -3.546 296 HB2 ALA 45 2HB ALA 45 10.858 15.551 -4.915 297 HB3 ALA 45 3HB ALA 45 11.935 16.961 -4.895 298 H ASP 46 H ASP 46 9.234 19.479 -3.183 299 HA ASP 46 HA ASP 46 11.580 20.730 -2.091 300 HB3 ASP 46 2HB ASP 46 8.776 21.804 -2.327 301 H MET 47 H MET 47 10.154 22.441 -0.179 302 HA MET 47 HA MET 47 9.624 20.665 2.100 303 HB3 MET 47 2HB MET 47 11.562 23.020 1.785 304 HG3 MET 47 2HG MET 47 10.594 21.559 4.224 305 HE1 MET 47 3HE MET 47 13.583 23.718 2.703 306 HE2 MET 47 1HE MET 47 12.818 24.785 3.909 307 HE3 MET 47 2HE MET 47 14.444 24.123 4.200 308 H TYR 48 H TYR 48 9.465 23.976 0.632 309 HA TYR 48 HA TYR 48 7.247 24.706 2.451 310 HB3 TYR 48 2HB TYR 48 8.979 26.284 2.506 311 HD1 TYR 48 1HD TYR 48 11.101 25.663 1.429 312 HD2 TYR 48 2HD TYR 48 7.905 27.540 -0.788 313 HE1 TYR 48 1HE TYR 48 12.642 26.041 -0.461 314 HE2 TYR 48 2HE TYR 48 9.463 27.970 -2.668 315 HH TYR 48 HH TYR 48 12.547 26.398 -2.858 316 H LYS 49 H LYS 49 8.101 24.255 -1.042 317 HA LYS 49 HA LYS 49 5.572 25.169 -2.035 318 HB3 LYS 49 2HB LYS 49 7.121 22.823 -3.242 319 HG3 LYS 49 2HG LYS 49 5.032 23.796 -4.378 320 HD3 LYS 49 2HD LYS 49 7.057 26.044 -4.704 321 HE3 LYS 49 2HE LYS 49 4.564 25.546 -6.371 322 HZ1 LYS 49 3HZ LYS 49 5.546 27.415 -7.612 323 HZ2 LYS 49 1HZ LYS 49 6.566 27.729 -6.359 324 HZ3 LYS 49 2HZ LYS 49 4.949 27.867 -6.146 325 H THR 50 H THR 50 6.701 21.873 -1.180 326 HA THR 50 HA THR 50 4.048 20.762 -1.321 327 HB THR 50 HB THR 50 5.270 18.732 -0.533 328 HG1 THR 50 1HG THR 50 7.039 19.814 0.571 329 HG21 THR 50 3HG2 THR 50 5.100 19.319 -2.947 330 HG22 THR 50 1HG2 THR 50 6.591 18.435 -2.543 331 HG23 THR 50 2HG2 THR 50 6.659 20.179 -2.832 332 H SER 51 H SER 51 5.114 22.916 0.903 333 HA SER 51 HA SER 51 3.826 21.726 3.266 334 HB3 SER 51 2HB SER 51 4.658 24.632 2.913 335 HG SER 51 HG SER 51 3.471 24.353 4.768 336 H ASP 52 H ASP 52 3.162 23.648 0.340 337 HA ASP 52 HA ASP 52 0.565 24.518 1.387 338 HB3 ASP 52 2HB ASP 52 1.628 25.022 -1.408 339 H ILE 53 H ILE 53 1.693 22.691 -1.510 340 HA ILE 53 HA ILE 53 -0.810 22.355 -2.635 341 HB ILE 53 HB ILE 53 1.447 20.275 -2.816 342 HG13 ILE 53 2HG1 ILE 53 2.135 22.746 -3.347 343 HG21 ILE 53 1HG2 ILE 53 0.314 20.192 -5.232 344 HG22 ILE 53 2HG2 ILE 53 -0.369 19.298 -3.881 345 HG23 ILE 53 3HG2 ILE 53 -1.082 20.860 -4.400 346 HD11 ILE 53 3HD1 ILE 53 3.392 20.691 -4.056 347 HD12 ILE 53 1HD1 ILE 53 2.486 20.713 -5.574 348 HD13 ILE 53 2HD1 ILE 53 3.542 22.075 -5.164 349 H ALA 54 H ALA 54 0.785 20.043 -0.420 350 HA ALA 54 HA ALA 54 -1.325 18.103 -0.642 351 HB1 ALA 54 1HB ALA 54 -0.069 17.011 1.271 352 HB2 ALA 54 2HB ALA 54 0.942 17.377 -0.142 353 HB3 ALA 54 3HB ALA 54 1.042 18.396 1.287 354 H LEU 55 H LEU 55 -0.666 20.875 1.382 355 HA LEU 55 HA LEU 55 -2.506 20.244 3.529 356 HB3 LEU 55 2HB LEU 55 -1.436 22.975 2.683 357 HG LEU 55 HG LEU 55 -3.144 23.214 4.361 358 HD11 LEU 55 1HD1 LEU 55 -1.569 21.166 5.980 359 HD12 LEU 55 2HD1 LEU 55 -3.253 21.019 5.418 360 HD13 LEU 55 3HD1 LEU 55 -2.847 22.215 6.648 361 HD21 LEU 55 3HD2 LEU 55 -1.109 24.607 4.502 362 HD22 LEU 55 1HD2 LEU 55 -0.365 23.401 5.583 363 HD23 LEU 55 2HD2 LEU 55 -1.798 24.308 6.107 364 H ASP 56 H ASP 56 -2.619 22.165 0.532 365 HA ASP 56 HA ASP 56 -5.179 23.307 0.798 366 HB3 ASP 56 2HB ASP 56 -5.003 22.893 -1.888 367 H GLN 57 H GLN 57 -4.199 20.130 -0.532 368 HA GLN 57 HA GLN 57 -6.840 19.244 -1.198 369 HB3 GLN 57 2HB GLN 57 -5.882 16.999 -1.323 370 HG3 GLN 57 2HG GLN 57 -3.940 19.096 -2.398 371 HE21 GLN 57 1HE2 GLN 57 -2.636 16.659 -1.666 372 HE22 GLN 57 2HE2 GLN 57 -2.370 15.834 -3.188 373 H ILE 58 H ILE 58 -4.902 18.924 1.796 374 HA ILE 58 HA ILE 58 -6.769 17.264 3.199 375 HB ILE 58 HB ILE 58 -4.551 19.128 4.118 376 HG13 ILE 58 2HG1 ILE 58 -4.073 16.947 2.802 377 HG21 ILE 58 1HG2 ILE 58 -6.143 18.982 5.989 378 HG22 ILE 58 2HG2 ILE 58 -6.156 17.209 5.861 379 HG23 ILE 58 3HG2 ILE 58 -4.686 18.072 6.353 380 HD11 ILE 58 3HD1 ILE 58 -2.872 16.993 5.596 381 HD12 ILE 58 1HD1 ILE 58 -2.184 16.296 4.121 382 HD13 ILE 58 2HD1 ILE 58 -2.349 18.058 4.272 383 H GLN 59 H GLN 59 -6.247 20.847 3.323 384 HA GLN 59 HA GLN 59 -8.432 21.216 5.150 385 HB3 GLN 59 2HB GLN 59 -8.053 23.627 4.743 386 HG3 GLN 59 2HG GLN 59 -5.353 22.319 5.146 387 HE21 GLN 59 1HE2 GLN 59 -4.184 24.291 5.299 388 HE22 GLN 59 2HE2 GLN 59 -4.627 25.531 6.463 389 H GLY 60 H GLY 60 -8.425 20.823 1.707 390 HA2 GLY 60 1HA GLY 60 -10.379 20.428 0.495 391 HA3 GLY 60 2HA GLY 60 -11.353 21.247 1.726 392 H ASN 61 H ASN 61 -8.411 22.681 0.477 393 HA ASN 61 HA ASN 61 -9.797 24.868 -0.947 394 HB3 ASN 61 2HB ASN 61 -7.501 25.624 -1.476 395 HD21 ASN 61 1HD2 ASN 61 -5.462 25.593 0.550 396 HD22 ASN 61 2HD2 ASN 61 -6.139 26.037 2.085 397 H LYS 62 H LYS 62 -8.322 21.719 -1.460 398 HA LYS 62 HA LYS 62 -8.709 21.948 -4.387 399 HB3 LYS 62 2HB LYS 62 -6.511 20.374 -4.372 400 HG3 LYS 62 2HG LYS 62 -5.130 22.519 -4.468 401 HD3 LYS 62 2HD LYS 62 -6.853 23.377 -6.462 402 HE3 LYS 62 2HE LYS 62 -5.766 21.462 -7.856 403 HZ1 LYS 62 3HZ LYS 62 -3.681 22.538 -7.873 404 HZ2 LYS 62 1HZ LYS 62 -3.943 23.342 -6.456 405 HZ3 LYS 62 2HZ LYS 62 -4.854 23.673 -7.787 406 H ASP 63 H ASP 63 -8.494 19.832 -5.384 407 HA ASP 63 HA ASP 63 -10.256 17.843 -4.086 408 HB3 ASP 63 2HB ASP 63 -11.201 18.370 -6.101 409 H PHE 64 H PHE 64 -9.565 15.506 -4.396 410 HA PHE 64 HA PHE 64 -6.811 15.326 -3.657 411 HB3 PHE 64 2HB PHE 64 -7.483 12.730 -3.834 412 HD1 PHE 64 2HD PHE 64 -5.997 14.149 -2.086 413 HD2 PHE 64 1HD PHE 64 -10.238 13.603 -1.914 414 HE1 PHE 64 2HE PHE 64 -5.968 14.691 0.379 415 HE2 PHE 64 1HE PHE 64 -10.259 14.188 0.473 416 HZ PHE 64 HZ PHE 64 -8.109 14.706 1.662 417 HA PRO 65 HA PRO 65 -5.020 14.739 -7.193 418 HB3 PRO 65 2HB PRO 65 -3.044 14.954 -6.152 419 HG3 PRO 65 2HG PRO 65 -2.616 13.747 -4.141 420 HD3 PRO 65 2HD PRO 65 -4.726 14.589 -3.687 421 H GLU 66 H GLU 66 -5.307 13.615 -9.068 422 HA GLU 66 HA GLU 66 -6.507 10.978 -9.058 423 HB3 GLU 66 2HB GLU 66 -6.340 11.275 -11.580 424 HG3 GLU 66 2HG GLU 66 -7.604 13.501 -9.935 425 H ILE 67 H ILE 67 -5.688 9.135 -10.208 426 HA ILE 67 HA ILE 67 -2.719 8.934 -10.082 427 HB ILE 67 HB ILE 67 -2.977 6.553 -9.574 428 HG13 ILE 67 2HG1 ILE 67 -5.231 6.154 -10.520 429 HG21 ILE 67 1HG2 ILE 67 -2.631 8.266 -7.834 430 HG22 ILE 67 2HG2 ILE 67 -4.384 8.361 -7.575 431 HG23 ILE 67 3HG2 ILE 67 -3.504 6.857 -7.215 432 HD11 ILE 67 3HD1 ILE 67 -6.001 4.570 -8.970 433 HD12 ILE 67 1HD1 ILE 67 -4.255 4.654 -8.675 434 HD13 ILE 67 2HD1 ILE 67 -5.385 5.474 -7.574 435 H GLN 68 H GLN 68 -1.687 7.661 -11.631 436 HA GLN 68 HA GLN 68 -3.143 7.563 -14.216 437 HB3 GLN 68 2HB GLN 68 -1.038 7.722 -15.290 438 HG3 GLN 68 2HG GLN 68 0.499 9.253 -13.877 439 HE21 GLN 68 1HE2 GLN 68 -0.104 11.702 -13.576 440 HE22 GLN 68 2HE2 GLN 68 -0.964 12.356 -14.946 441 H LEU 69 H LEU 69 -3.438 5.522 -12.103 442 HA LEU 69 HA LEU 69 -2.092 3.089 -13.140 443 HB3 LEU 69 2HB LEU 69 -4.039 2.253 -11.298 444 HG LEU 69 HG LEU 69 -1.226 3.084 -10.500 445 HD11 LEU 69 1HD1 LEU 69 -2.713 2.792 -8.571 446 HD12 LEU 69 2HD1 LEU 69 -1.604 1.413 -8.669 447 HD13 LEU 69 3HD1 LEU 69 -3.296 1.255 -9.204 448 HD21 LEU 69 3HD2 LEU 69 -0.793 0.576 -10.727 449 HD22 LEU 69 1HD2 LEU 69 -1.003 1.438 -12.243 450 HD23 LEU 69 2HD2 LEU 69 -2.340 0.472 -11.601 451 H ASP 70 H ASP 70 -3.361 1.361 -13.875 452 HA ASP 70 HA ASP 70 -5.667 2.121 -15.521 453 HB3 ASP 70 2HB ASP 70 -5.608 -0.280 -16.220 454 H ASN 71 H ASN 71 -7.742 0.702 -15.402 455 HA ASN 71 HA ASN 71 -8.599 0.445 -12.599 456 HB3 ASN 71 2HB ASN 71 -10.203 -0.701 -14.849 457 HD21 ASN 71 1HD2 ASN 71 -11.101 -2.075 -12.876 458 HD22 ASN 71 2HD2 ASN 71 -12.133 -1.197 -11.814 459 H ILE 72 H ILE 72 -7.814 -1.200 -11.561 460 HA ILE 72 HA ILE 72 -7.414 -3.889 -12.818 461 HB ILE 72 HB ILE 72 -5.641 -2.372 -10.861 462 HG13 ILE 72 2HG1 ILE 72 -5.529 -1.998 -13.458 463 HG21 ILE 72 1HG2 ILE 72 -5.677 -4.681 -10.072 464 HG22 ILE 72 2HG2 ILE 72 -5.398 -5.287 -11.725 465 HG23 ILE 72 3HG2 ILE 72 -4.142 -4.378 -10.872 466 HD11 ILE 72 3HD1 ILE 72 -3.153 -1.903 -13.557 467 HD12 ILE 72 1HD1 ILE 72 -3.704 -1.337 -11.976 468 HD13 ILE 72 2HD1 ILE 72 -2.983 -2.965 -12.147 469 H ASP 73 H ASP 73 -7.620 -5.672 -11.207 470 HA ASP 73 HA ASP 73 -9.700 -4.943 -9.219 471 HB3 ASP 73 2HB ASP 73 -9.708 -7.754 -9.866 472 H TYR 74 H TYR 74 -8.969 -4.921 -7.287 473 HA TYR 74 HA TYR 74 -6.586 -6.493 -6.524 474 HB3 TYR 74 2HB TYR 74 -6.563 -5.019 -4.618 475 HD1 TYR 74 1HD TYR 74 -4.846 -4.760 -6.766 476 HD2 TYR 74 2HD TYR 74 -8.379 -2.389 -6.060 477 HE1 TYR 74 1HE TYR 74 -3.929 -2.982 -8.180 478 HE2 TYR 74 2HE TYR 74 -7.439 -0.550 -7.343 479 HH TYR 74 HH TYR 74 -5.779 0.009 -8.943 480 H ASN 75 H ASN 75 -9.990 -6.794 -6.443 481 HA ASN 75 HA ASN 75 -10.394 -7.652 -3.772 482 HB3 ASN 75 2HB ASN 75 -12.008 -8.114 -6.302 483 HD21 ASN 75 1HD2 ASN 75 -12.294 -8.072 -2.590 484 HD22 ASN 75 2HD2 ASN 75 -13.571 -9.240 -2.646 485 H ASN 76 H ASN 76 -9.267 -9.402 -6.585 486 HA ASN 76 HA ASN 76 -9.705 -12.027 -5.472 487 HB3 ASN 76 2HB ASN 76 -9.807 -11.671 -7.849 488 HD21 ASN 76 1HD2 ASN 76 -9.145 -9.576 -8.590 489 HD22 ASN 76 2HD2 ASN 76 -7.483 -9.133 -8.896 490 H TYR 77 H TYR 77 -7.357 -9.696 -4.601 491 HA TYR 77 HA TYR 77 -5.193 -11.678 -4.160 492 HB3 TYR 77 2HB TYR 77 -4.058 -9.671 -3.162 493 HD1 TYR 77 1HD TYR 77 -2.457 -10.765 -4.604 494 HD2 TYR 77 2HD TYR 77 -5.774 -8.623 -6.319 495 HE1 TYR 77 1HE TYR 77 -1.511 -11.134 -6.876 496 HE2 TYR 77 2HE TYR 77 -4.862 -9.014 -8.584 497 HH TYR 77 HH TYR 77 -1.767 -10.102 -9.329 498 H ASP 78 H ASP 78 -4.631 -12.435 -2.187 499 HA ASP 78 HA ASP 78 -6.628 -12.431 -0.001 500 HB3 ASP 78 2HB ASP 78 -3.744 -13.414 0.103 501 H LEU 79 H LEU 79 -3.327 -11.266 -0.530 502 HA LEU 79 HA LEU 79 -3.513 -9.263 1.683 503 HB3 LEU 79 2HB LEU 79 -1.363 -11.240 0.767 504 HG LEU 79 HG LEU 79 -0.232 -9.120 1.428 505 HD11 LEU 79 1HD1 LEU 79 -1.675 -8.124 3.049 506 HD12 LEU 79 2HD1 LEU 79 -0.265 -8.644 3.968 507 HD13 LEU 79 3HD1 LEU 79 -1.734 -9.618 4.020 508 HD21 LEU 79 3HD2 LEU 79 1.357 -10.131 2.890 509 HD22 LEU 79 1HD2 LEU 79 0.758 -11.413 1.820 510 HD23 LEU 79 2HD2 LEU 79 0.167 -11.307 3.482 511 H ILE 80 H ILE 80 -2.657 -7.235 1.201 512 HA ILE 80 HA ILE 80 -1.043 -6.858 -1.268 513 HB ILE 80 HB ILE 80 -3.384 -5.068 -0.520 514 HG13 ILE 80 2HG1 ILE 80 -4.196 -7.257 -1.456 515 HG21 ILE 80 1HG2 ILE 80 -1.620 -5.096 -3.010 516 HG22 ILE 80 2HG2 ILE 80 -2.858 -3.884 -2.596 517 HG23 ILE 80 3HG2 ILE 80 -1.390 -3.981 -1.652 518 HD11 ILE 80 3HD1 ILE 80 -4.587 -4.979 -3.404 519 HD12 ILE 80 1HD1 ILE 80 -5.677 -6.325 -3.039 520 HD13 ILE 80 2HD1 ILE 80 -5.379 -5.077 -1.801 521 H LEU 81 H LEU 81 0.885 -6.164 -0.313 522 HA LEU 81 HA LEU 81 0.830 -4.352 2.008 523 HB3 LEU 81 2HB LEU 81 3.354 -4.346 1.275 524 HG LEU 81 HG LEU 81 2.637 -5.326 3.328 525 HD11 LEU 81 1HD1 LEU 81 1.626 -7.738 1.812 526 HD12 LEU 81 2HD1 LEU 81 0.657 -6.598 2.777 527 HD13 LEU 81 3HD1 LEU 81 1.817 -7.660 3.570 528 HD21 LEU 81 3HD2 LEU 81 4.857 -5.996 2.756 529 HD22 LEU 81 1HD2 LEU 81 4.266 -7.338 1.737 530 HD23 LEU 81 2HD2 LEU 81 4.085 -7.386 3.495 531 H ILE 82 H ILE 82 1.284 -2.123 1.968 532 HA ILE 82 HA ILE 82 1.421 -0.888 -0.690 533 HB ILE 82 HB ILE 82 -0.650 -0.141 1.384 534 HG13 ILE 82 2HG1 ILE 82 -1.250 -2.203 0.204 535 HG21 ILE 82 1HG2 ILE 82 -0.065 1.008 -1.402 536 HG22 ILE 82 2HG2 ILE 82 -1.405 1.504 -0.335 537 HG23 ILE 82 3HG2 ILE 82 0.249 1.846 0.126 538 HD11 ILE 82 3HD1 ILE 82 -3.284 -1.674 -0.878 539 HD12 ILE 82 1HD1 ILE 82 -3.072 -0.479 0.433 540 HD13 ILE 82 2HD1 ILE 82 -2.746 -0.033 -1.269 541 H GLY 83 H GLY 83 3.124 0.307 -0.741 542 HA2 GLY 83 1HA GLY 83 4.124 1.797 1.624 543 HA3 GLY 83 2HA GLY 83 4.896 1.683 0.048 544 H SER 84 H SER 84 4.718 4.168 1.499 545 HA SER 84 HA SER 84 4.189 5.568 -0.874 546 HB3 SER 84 2HB SER 84 1.888 5.592 0.176 547 HG SER 84 HG SER 84 2.237 6.000 2.284 548 HA PRO 85 HA PRO 85 7.473 7.923 1.145 549 HB3 PRO 85 2HB PRO 85 7.828 9.208 -0.773 550 HG3 PRO 85 2HG PRO 85 6.017 9.814 -2.174 551 HD3 PRO 85 2HD PRO 85 5.662 7.501 -1.855 552 H VAL 86 H VAL 86 7.898 9.378 2.911 553 HA VAL 86 HA VAL 86 5.438 10.375 4.237 554 HB VAL 86 HB VAL 86 8.218 9.981 5.358 555 HG11 VAL 86 1HG1 VAL 86 7.267 11.846 6.511 556 HG12 VAL 86 2HG1 VAL 86 5.687 11.062 6.614 557 HG13 VAL 86 3HG1 VAL 86 7.054 10.426 7.551 558 HG21 VAL 86 3HG2 VAL 86 7.229 8.220 6.695 559 HG22 VAL 86 1HG2 VAL 86 5.620 8.525 5.993 560 HG23 VAL 86 2HG2 VAL 86 6.944 7.913 4.983 561 H TRP 87 H TRP 87 5.235 12.770 4.169 562 HA TRP 87 HA TRP 87 7.564 14.305 3.139 563 HB3 TRP 87 2HB TRP 87 5.106 15.851 3.276 564 HD1 TRP 87 HD TRP 87 6.961 17.497 1.944 565 HE1 TRP 87 1HE TRP 87 7.507 17.680 -0.562 566 HE3 TRP 87 3HE TRP 87 4.993 13.071 0.407 567 HZ2 TRP 87 2HZ TRP 87 7.339 15.936 -2.914 568 HZ3 TRP 87 3HZ TRP 87 4.960 12.468 -1.964 569 HH2 TRP 87 HH TRP 87 6.241 13.836 -3.641 570 H SER 88 H SER 88 6.767 16.805 4.180 571 HA SER 88 HA SER 88 7.827 16.832 6.808 572 HB3 SER 88 2HB SER 88 8.282 18.689 5.511 573 HG SER 88 HG SER 88 5.571 19.104 4.853 574 H GLY 89 H GLY 89 6.448 15.271 7.761 575 HA2 GLY 89 1HA GLY 89 5.117 15.187 9.753 576 HA3 GLY 89 2HA GLY 89 4.146 16.493 9.164 577 H TYR 90 H TYR 90 3.662 15.434 6.441 578 HA TYR 90 HA TYR 90 2.190 12.988 6.982 579 HB3 TYR 90 2HB TYR 90 0.284 14.070 7.357 580 HD1 TYR 90 2HD TYR 90 2.334 16.554 5.386 581 HD2 TYR 90 1HD TYR 90 -1.146 15.887 7.885 582 HE1 TYR 90 2HE TYR 90 2.272 18.903 5.933 583 HE2 TYR 90 1HE TYR 90 -1.294 18.314 8.300 584 HH TYR 90 HH TYR 90 1.002 20.663 6.845 585 HA PRO 91 HA PRO 91 3.386 12.144 2.828 586 HB3 PRO 91 2HB PRO 91 2.598 9.992 3.221 587 HG3 PRO 91 2HG PRO 91 0.411 9.609 4.240 588 HD3 PRO 91 2HD PRO 91 1.883 10.775 5.720 589 H ALA 92 H ALA 92 2.568 12.413 0.597 590 HA ALA 92 HA ALA 92 1.198 14.883 0.218 591 HB1 ALA 92 1HB ALA 92 2.239 12.774 -1.672 592 HB2 ALA 92 2HB ALA 92 1.674 14.421 -2.091 593 HB3 ALA 92 3HB ALA 92 3.090 14.207 -1.068 594 H THR 93 H THR 93 -0.491 12.723 1.376 595 HA THR 93 HA THR 93 -2.114 11.156 1.109 596 HB THR 93 HB THR 93 -4.250 12.128 0.480 597 HG1 THR 93 1HG THR 93 -3.462 13.303 -1.326 598 HG21 THR 93 3HG2 THR 93 -3.382 12.759 2.682 599 HG22 THR 93 1HG2 THR 93 -4.264 14.117 1.955 600 HG23 THR 93 2HG2 THR 93 -2.501 14.132 1.986 601 HA PRO 94 HA PRO 94 -1.384 9.966 -3.389 602 HB3 PRO 94 2HB PRO 94 0.838 9.374 -3.329 603 HG3 PRO 94 2HG PRO 94 1.933 9.039 -1.277 604 HD3 PRO 94 2HD PRO 94 0.766 11.020 -0.960 605 H ILE 95 H ILE 95 -1.598 7.763 -0.494 606 HA ILE 95 HA ILE 95 -2.855 5.742 -2.109 607 HB ILE 95 HB ILE 95 -2.578 5.860 0.902 608 HG13 ILE 95 2HG1 ILE 95 -0.449 4.527 0.533 609 HG21 ILE 95 1HG2 ILE 95 -2.826 3.484 -0.988 610 HG22 ILE 95 2HG2 ILE 95 -2.462 3.384 0.754 611 HG23 ILE 95 3HG2 ILE 95 -4.006 4.024 0.219 612 HD11 ILE 95 3HD1 ILE 95 0.812 4.966 -1.576 613 HD12 ILE 95 1HD1 ILE 95 -0.632 3.966 -1.872 614 HD13 ILE 95 2HD1 ILE 95 -0.598 5.685 -2.307 615 H LYS 96 H LYS 96 -4.170 8.470 -0.513 616 HA LYS 96 HA LYS 96 -6.695 7.690 0.320 617 HB3 LYS 96 2HB LYS 96 -5.697 10.233 -1.054 618 HG3 LYS 96 2HG LYS 96 -8.079 10.397 -1.085 619 HD3 LYS 96 2HD LYS 96 -7.895 9.211 1.686 620 HE3 LYS 96 2HE LYS 96 -10.122 11.015 0.680 621 HZ1 LYS 96 3HZ LYS 96 -11.217 9.248 1.586 622 HZ2 LYS 96 1HZ LYS 96 -11.125 10.279 2.828 623 HZ3 LYS 96 2HZ LYS 96 -10.113 8.960 2.800 624 H THR 97 H THR 97 -5.733 8.730 -3.045 625 HA THR 97 HA THR 97 -8.229 8.406 -4.160 626 HB THR 97 HB THR 97 -5.596 7.915 -5.585 627 HG1 THR 97 1HG THR 97 -5.891 10.408 -5.683 628 HG21 THR 97 3HG2 THR 97 -7.608 7.743 -6.970 629 HG22 THR 97 1HG2 THR 97 -6.747 9.239 -7.375 630 HG23 THR 97 2HG2 THR 97 -8.197 9.290 -6.349 631 H LEU 98 H LEU 98 -5.519 6.002 -4.135 632 HA LEU 98 HA LEU 98 -6.867 4.016 -5.561 633 HB3 LEU 98 2HB LEU 98 -4.761 3.726 -3.382 634 HG LEU 98 HG LEU 98 -5.732 1.505 -4.023 635 HD11 LEU 98 1HD1 LEU 98 -6.479 1.936 -6.323 636 HD12 LEU 98 2HD1 LEU 98 -5.255 0.669 -6.338 637 HD13 LEU 98 3HD1 LEU 98 -4.820 2.315 -6.835 638 HD21 LEU 98 3HD2 LEU 98 -3.578 0.469 -4.592 639 HD22 LEU 98 1HD2 LEU 98 -3.367 1.728 -3.373 640 HD23 LEU 98 2HD2 LEU 98 -2.916 2.050 -5.066 641 H LEU 99 H LEU 99 -6.903 4.641 -2.038 642 HA LEU 99 HA LEU 99 -8.268 2.299 -1.187 643 HB3 LEU 99 2HB LEU 99 -9.084 3.911 0.697 644 HG LEU 99 HG LEU 99 -6.162 3.449 0.024 645 HD11 LEU 99 1HD1 LEU 99 -5.621 4.310 2.311 646 HD12 LEU 99 2HD1 LEU 99 -7.295 4.911 2.445 647 HD13 LEU 99 3HD1 LEU 99 -6.203 5.578 1.220 648 HD21 LEU 99 3HD2 LEU 99 -7.930 2.449 2.291 649 HD22 LEU 99 1HD2 LEU 99 -6.284 1.914 1.899 650 HD23 LEU 99 2HD2 LEU 99 -7.620 1.568 0.786 651 H ASP 100 H ASP 100 -9.545 5.316 -2.600 652 HA ASP 100 HA ASP 100 -12.291 4.871 -1.924 653 HB3 ASP 100 2HB ASP 100 -11.050 6.348 -4.290 654 H GLN 101 H GLN 101 -10.186 3.578 -4.365 655 HA GLN 101 HA GLN 101 -12.355 2.651 -6.146 656 HB3 GLN 101 2HB GLN 101 -10.461 1.837 -7.530 657 HG3 GLN 101 2HG GLN 101 -10.270 4.716 -6.535 658 HE21 GLN 101 1HE2 GLN 101 -9.329 6.261 -8.007 659 HE22 GLN 101 2HE2 GLN 101 -8.057 5.754 -9.123 660 H MET 102 H MET 102 -9.611 1.208 -4.345 661 HA MET 102 HA MET 102 -10.534 -1.461 -4.630 662 HB3 MET 102 2HB MET 102 -8.212 -0.969 -4.399 663 HG3 MET 102 2HG MET 102 -8.633 0.835 -2.552 664 HE1 MET 102 3HE MET 102 -7.483 -2.895 -1.443 665 HE2 MET 102 1HE MET 102 -6.119 -1.779 -1.229 666 HE3 MET 102 2HE MET 102 -6.919 -2.498 0.188 667 H LYS 103 H LYS 103 -12.167 0.715 -2.852 668 HA LYS 103 HA LYS 103 -12.316 0.100 -0.273 669 HB3 LYS 103 2HB LYS 103 -14.388 0.942 -2.296 670 HG3 LYS 103 2HG LYS 103 -15.717 -0.047 -0.521 671 HD3 LYS 103 2HD LYS 103 -14.037 0.463 1.405 672 HE3 LYS 103 2HE LYS 103 -13.877 2.946 0.986 673 HZ1 LYS 103 3HZ LYS 103 -16.107 3.648 0.590 674 HZ2 LYS 103 1HZ LYS 103 -15.790 4.144 2.114 675 HZ3 LYS 103 2HZ LYS 103 -16.691 2.808 1.890 676 H ASN 104 H ASN 104 -13.789 -1.824 -2.699 677 HA ASN 104 HA ASN 104 -15.438 -3.406 -0.925 678 HB3 ASN 104 2HB ASN 104 -15.937 -3.073 -3.353 679 HD21 ASN 104 1HD2 ASN 104 -14.465 -2.473 -5.116 680 HD22 ASN 104 2HD2 ASN 104 -13.447 -3.713 -5.799 681 H TYR 105 H TYR 105 -12.136 -3.477 -1.096 682 HA TYR 105 HA TYR 105 -11.407 -6.152 -1.512 683 HB3 TYR 105 2HB TYR 105 -10.120 -3.850 0.006 684 HD1 TYR 105 1HD TYR 105 -8.835 -6.557 -2.278 685 HD2 TYR 105 2HD TYR 105 -8.418 -4.505 1.480 686 HE1 TYR 105 1HE TYR 105 -6.923 -8.028 -1.697 687 HE2 TYR 105 2HE TYR 105 -6.455 -5.932 2.025 688 HH TYR 105 HH TYR 105 -5.764 -8.823 0.809 689 H ARG 106 H ARG 106 -10.254 -7.453 0.078 690 HA ARG 106 HA ARG 106 -11.412 -8.259 2.592 691 HB3 ARG 106 2HB ARG 106 -8.934 -9.209 2.764 692 HG3 ARG 106 2HG ARG 106 -9.149 -10.476 0.488 693 HD3 ARG 106 2HD ARG 106 -11.210 -11.157 2.578 694 HE ARG 106 HE ARG 106 -9.454 -12.577 0.668 695 HH11 ARG 106 1HH1 ARG 106 -11.795 -12.972 3.318 696 HH12 ARG 106 2HH1 ARG 106 -11.982 -14.679 2.990 697 HH21 ARG 106 1HH2 ARG 106 -9.673 -14.741 0.338 698 HH22 ARG 106 2HH2 ARG 106 -10.949 -15.658 1.065 699 H GLY 107 H GLY 107 -9.006 -8.141 4.210 700 HA2 GLY 107 1HA GLY 107 -7.781 -5.590 3.940 701 HA3 GLY 107 2HA GLY 107 -8.704 -5.684 5.441 702 H GLU 108 H GLU 108 -6.053 -7.278 3.537 703 HA GLU 108 HA GLU 108 -4.728 -7.504 6.100 704 HB3 GLU 108 2HB GLU 108 -3.449 -9.410 5.322 705 HG3 GLU 108 2HG GLU 108 -6.440 -9.936 5.553 706 H VAL 109 H VAL 109 -3.465 -5.780 5.797 707 HA VAL 109 HA VAL 109 -2.073 -5.164 3.309 708 HB VAL 109 HB VAL 109 -4.021 -3.341 4.800 709 HG11 VAL 109 1HG1 VAL 109 -2.149 -1.976 4.115 710 HG12 VAL 109 2HG1 VAL 109 -2.079 -2.752 2.517 711 HG13 VAL 109 3HG1 VAL 109 -3.429 -1.703 2.926 712 HG21 VAL 109 3HG2 VAL 109 -5.312 -4.705 3.374 713 HG22 VAL 109 1HG2 VAL 109 -5.200 -3.129 2.599 714 HG23 VAL 109 2HG2 VAL 109 -4.198 -4.473 1.997 715 H ALA 110 H ALA 110 0.003 -4.498 4.009 716 HA ALA 110 HA ALA 110 0.156 -3.226 6.701 717 HB1 ALA 110 1HB ALA 110 2.455 -4.661 5.365 718 HB2 ALA 110 2HB ALA 110 2.411 -3.870 6.950 719 HB3 ALA 110 3HB ALA 110 1.470 -5.345 6.680 720 H SER 111 H SER 111 1.899 -1.552 6.724 721 HA SER 111 HA SER 111 1.886 -0.040 4.190 722 HB3 SER 111 2HB SER 111 1.099 1.204 6.836 723 HG SER 111 HG SER 111 -0.279 1.641 4.483 724 H PHE 112 H PHE 112 3.848 1.038 3.842 725 HA PHE 112 HA PHE 112 5.650 1.334 6.142 726 HB3 PHE 112 2HB PHE 112 5.911 -0.996 4.873 727 HD1 PHE 112 2HD PHE 112 5.200 -0.439 2.378 728 HD2 PHE 112 1HD PHE 112 9.060 0.517 4.046 729 HE1 PHE 112 2HE PHE 112 6.103 -0.131 0.138 730 HE2 PHE 112 1HE PHE 112 9.949 0.852 1.792 731 HZ PHE 112 HZ PHE 112 8.518 0.460 -0.215 732 H PHE 113 H PHE 113 7.735 2.371 5.492 733 HA PHE 113 HA PHE 113 7.340 4.535 3.529 734 HB3 PHE 113 2HB PHE 113 7.992 6.128 5.281 735 HD1 PHE 113 2HD PHE 113 5.515 6.424 4.252 736 HD2 PHE 113 1HD PHE 113 6.360 4.016 7.767 737 HE1 PHE 113 2HE PHE 113 3.304 5.385 4.138 738 HE2 PHE 113 1HE PHE 113 4.089 3.154 7.737 739 HZ PHE 113 HZ PHE 113 2.566 3.739 5.857 740 H THR 114 H THR 114 9.382 5.499 2.942 741 HA THR 114 HA THR 114 11.790 3.988 3.904 742 HB THR 114 HB THR 114 11.623 5.017 1.078 743 HG1 THR 114 1HG THR 114 9.821 3.565 1.638 744 HG21 THR 114 3HG2 THR 114 13.790 4.146 1.995 745 HG22 THR 114 1HG2 THR 114 13.172 3.125 0.685 746 HG23 THR 114 2HG2 THR 114 12.984 2.613 2.380 747 H SER 115 H SER 115 10.544 6.411 4.901 748 HA SER 115 HA SER 115 12.105 8.694 4.046 749 HB3 SER 115 2HB SER 115 10.945 8.860 6.756 750 HG SER 115 HG SER 115 10.456 10.118 4.251 751 H ALA 116 H ALA 116 13.130 9.871 6.198 752 HA ALA 116 HA ALA 116 15.271 8.096 7.226 753 HB1 ALA 116 1HB ALA 116 16.244 10.172 8.072 754 HB2 ALA 116 2HB ALA 116 15.931 10.235 6.330 755 HB3 ALA 116 3HB ALA 116 14.846 11.092 7.450 756 H GLY 117 H GLY 117 12.393 7.785 8.028 757 HA2 GLY 117 1HA GLY 117 11.384 7.130 9.953 758 HA3 GLY 117 2HA GLY 117 12.962 7.356 10.739 759 H THR 118 H THR 118 11.872 10.257 9.372 760 HA THR 118 HA THR 118 10.828 11.212 11.946 761 HB THR 118 HB THR 118 10.721 13.382 10.400 762 HG1 THR 118 1HG THR 118 11.326 12.481 8.415 763 HG21 THR 118 3HG2 THR 118 12.162 12.884 12.376 764 HG22 THR 118 1HG2 THR 118 13.033 13.770 11.117 765 HG23 THR 118 2HG2 THR 118 13.283 11.996 11.316 766 H ASN 119 H ASN 119 8.756 12.132 12.149 767 HA ASN 119 HA ASN 119 6.577 12.325 11.924 768 HB3 ASN 119 2HB ASN 119 5.629 12.838 9.792 769 HD21 ASN 119 1HD2 ASN 119 8.254 13.784 8.007 770 HD22 ASN 119 2HD2 ASN 119 8.638 15.247 8.870 771 H HIS 120 H HIS 120 7.921 9.452 11.733 772 HA HIS 120 HA HIS 120 6.268 7.706 10.392 773 HB3 HIS 120 2HB HIS 120 8.426 7.121 11.442 774 HD1 HIS 120 1HD HIS 120 6.686 5.540 14.394 775 HD2 HIS 120 2HD HIS 120 9.085 8.903 13.530 776 HE1 HIS 120 1HE HIS 120 7.505 6.436 16.626 777 H LYS 121 H LYS 121 5.807 8.725 13.897 778 HA LYS 121 HA LYS 121 3.462 7.320 14.331 779 HB3 LYS 121 2HB LYS 121 4.115 10.025 15.575 780 HG3 LYS 121 2HG LYS 121 3.223 7.324 16.536 781 HD3 LYS 121 2HD LYS 121 3.995 9.772 18.100 782 HE3 LYS 121 2HE LYS 121 1.506 8.105 18.474 783 HZ1 LYS 121 3HZ LYS 121 1.323 8.721 20.690 784 HZ2 LYS 121 1HZ LYS 121 2.690 9.609 20.718 785 HZ3 LYS 121 2HZ LYS 121 2.765 7.968 20.550 786 H ALA 122 H ALA 122 4.005 10.612 13.054 787 HA ALA 122 HA ALA 122 1.267 11.405 12.918 788 HB1 ALA 122 1HB ALA 122 3.630 12.300 11.204 789 HB2 ALA 122 2HB ALA 122 2.061 13.093 11.289 790 HB3 ALA 122 3HB ALA 122 3.090 13.044 12.719 791 H TYR 123 H TYR 123 3.326 9.588 10.537 792 HA TYR 123 HA TYR 123 1.390 9.426 8.499 793 HB3 TYR 123 2HB TYR 123 3.205 7.096 9.180 794 HD1 TYR 123 1HD TYR 123 1.326 5.687 8.199 795 HD2 TYR 123 2HD TYR 123 3.178 8.888 5.998 796 HE1 TYR 123 1HE TYR 123 0.177 4.909 6.145 797 HE2 TYR 123 2HE TYR 123 2.127 8.036 3.919 798 HH TYR 123 HH TYR 123 0.604 5.080 3.561 799 H VAL 124 H VAL 124 1.824 7.165 11.261 800 HA VAL 124 HA VAL 124 -0.260 5.441 10.614 801 HB VAL 124 HB VAL 124 0.209 6.133 13.507 802 HG11 VAL 124 1HG1 VAL 124 -0.042 3.747 13.836 803 HG12 VAL 124 2HG1 VAL 124 -1.397 4.320 12.856 804 HG13 VAL 124 3HG1 VAL 124 -0.045 3.446 12.090 805 HG21 VAL 124 3HG2 VAL 124 2.463 6.115 12.793 806 HG22 VAL 124 1HG2 VAL 124 2.160 4.553 13.524 807 HG23 VAL 124 2HG2 VAL 124 2.229 4.701 11.755 808 H SER 125 H SER 125 -0.499 8.381 12.754 809 HA SER 125 HA SER 125 -3.249 7.971 13.231 810 HB3 SER 125 2HB SER 125 -2.327 10.814 13.355 811 HG SER 125 HG SER 125 -4.074 9.656 14.638 812 H HIS 126 H HIS 126 -1.677 10.289 10.947 813 HA HIS 126 HA HIS 126 -4.132 11.463 10.052 814 HB3 HIS 126 2HB HIS 126 -2.574 12.280 8.196 815 HD1 HIS 126 1HD HIS 126 0.234 13.342 9.243 816 HD2 HIS 126 2HD HIS 126 -3.302 13.140 11.535 817 HE1 HIS 126 1HE HIS 126 0.540 14.940 11.183 818 H PHE 127 H PHE 127 -2.109 8.770 8.771 819 HA PHE 127 HA PHE 127 -3.539 8.315 6.365 820 HB3 PHE 127 2HB PHE 127 -2.142 6.317 8.195 821 HD1 PHE 127 2HD PHE 127 -2.003 6.709 4.508 822 HD2 PHE 127 1HD PHE 127 -3.562 4.362 7.785 823 HE1 PHE 127 2HE PHE 127 -2.710 4.938 2.922 824 HE2 PHE 127 1HE PHE 127 -4.306 2.626 6.170 825 HZ PHE 127 HZ PHE 127 -3.884 2.935 3.745 826 H ASN 128 H ASN 128 -4.135 7.128 9.683 827 HA ASN 128 HA ASN 128 -6.209 5.297 9.029 828 HB3 ASN 128 2HB ASN 128 -6.953 5.905 11.489 829 HD21 ASN 128 1HD2 ASN 128 -3.472 5.322 11.363 830 HD22 ASN 128 2HD2 ASN 128 -3.529 3.598 11.608 831 H GLU 129 H GLU 129 -6.466 8.778 10.036 832 HA GLU 129 HA GLU 129 -9.206 9.136 9.815 833 HB3 GLU 129 2HB GLU 129 -7.829 11.317 8.417 834 HG3 GLU 129 2HG GLU 129 -7.953 11.983 11.164 835 H TRP 130 H TRP 130 -6.842 9.114 7.173 836 HA TRP 130 HA TRP 130 -8.878 9.721 5.188 837 HB3 TRP 130 2HB TRP 130 -6.878 9.731 3.692 838 HD1 TRP 130 HD TRP 130 -8.436 11.971 5.628 839 HE1 TRP 130 1HE TRP 130 -7.233 14.175 5.870 840 HE3 TRP 130 3HE TRP 130 -3.637 10.323 4.922 841 HZ2 TRP 130 2HZ TRP 130 -4.463 15.043 6.244 842 HZ3 TRP 130 3HZ TRP 130 -1.727 11.872 5.276 843 HH2 TRP 130 HH TRP 130 -2.142 14.237 5.940 844 H ALA 131 H ALA 131 -8.027 6.787 6.602 845 HA ALA 131 HA ALA 131 -8.691 5.195 4.159 846 HB1 ALA 131 1HB ALA 131 -6.644 4.508 6.317 847 HB2 ALA 131 2HB ALA 131 -7.018 3.546 4.873 848 HB3 ALA 131 3HB ALA 131 -6.224 5.116 4.703 849 H ASP 132 H ASP 132 -9.583 5.884 7.325 850 HA ASP 132 HA ASP 132 -9.955 3.537 8.542 851 HB3 ASP 132 2HB ASP 132 -11.829 5.913 8.620 852 H GLY 133 H GLY 133 -10.930 1.764 8.042 853 HA2 GLY 133 1HA GLY 133 -13.352 0.890 7.391 854 HA3 GLY 133 2HA GLY 133 -12.853 1.587 5.834 855 H LEU 134 H LEU 134 -10.332 0.991 5.393 856 HA LEU 134 HA LEU 134 -10.324 -1.968 5.256 857 HB3 LEU 134 2HB LEU 134 -8.141 -1.593 4.048 858 HG LEU 134 HG LEU 134 -8.844 -1.053 1.976 859 HD11 LEU 134 1HD1 LEU 134 -11.399 -2.084 3.251 860 HD12 LEU 134 2HD1 LEU 134 -9.967 -3.060 2.860 861 HD13 LEU 134 3HD1 LEU 134 -10.895 -2.277 1.572 862 HD21 LEU 134 3HD2 LEU 134 -11.364 0.367 2.866 863 HD22 LEU 134 1HD2 LEU 134 -10.660 0.220 1.227 864 HD23 LEU 134 2HD2 LEU 134 -9.848 1.198 2.455 865 H ASN 135 H ASN 135 -9.279 -3.225 6.645 866 HA ASN 135 HA ASN 135 -7.963 -2.501 8.974 867 HB3 ASN 135 2HB ASN 135 -7.711 -4.977 7.239 868 HD21 ASN 135 1HD2 ASN 135 -6.630 -6.723 8.000 869 HD22 ASN 135 2HD2 ASN 135 -5.868 -6.834 9.571 870 H VAL 136 H VAL 136 -5.766 -2.560 9.646 871 HA VAL 136 HA VAL 136 -3.675 -2.848 7.544 872 HB VAL 136 HB VAL 136 -3.706 -0.627 9.594 873 HG11 VAL 136 1HG1 VAL 136 -1.409 -1.360 9.273 874 HG12 VAL 136 2HG1 VAL 136 -1.630 -1.453 7.508 875 HG13 VAL 136 3HG1 VAL 136 -1.641 0.112 8.331 876 HG21 VAL 136 3HG2 VAL 136 -3.701 0.860 7.608 877 HG22 VAL 136 1HG2 VAL 136 -3.836 -0.566 6.559 878 HG23 VAL 136 2HG2 VAL 136 -5.163 -0.116 7.670 879 H ILE 137 H ILE 137 -2.642 -4.693 8.122 880 HA ILE 137 HA ILE 137 -2.485 -5.604 10.875 881 HB ILE 137 HB ILE 137 -1.022 -7.408 9.871 882 HG13 ILE 137 2HG1 ILE 137 -0.522 -5.844 7.779 883 HG21 ILE 137 1HG2 ILE 137 -3.448 -7.662 10.300 884 HG22 ILE 137 2HG2 ILE 137 -3.784 -7.109 8.643 885 HG23 ILE 137 3HG2 ILE 137 -2.892 -8.618 8.921 886 HD11 ILE 137 3HD1 ILE 137 -1.034 -8.801 7.383 887 HD12 ILE 137 1HD1 ILE 137 -0.034 -7.744 6.366 888 HD13 ILE 137 2HD1 ILE 137 0.457 -8.072 8.041 889 H GLY 138 H GLY 138 -0.474 -3.312 9.172 890 HA2 GLY 138 1HA GLY 138 1.124 -3.081 11.515 891 HA3 GLY 138 2HA GLY 138 2.033 -3.948 10.262 892 H VAL 139 H VAL 139 2.585 -1.318 11.452 893 HA VAL 139 HA VAL 139 2.806 0.217 8.967 894 HB VAL 139 HB VAL 139 1.956 1.581 11.561 895 HG11 VAL 139 1HG1 VAL 139 1.428 3.450 10.022 896 HG12 VAL 139 2HG1 VAL 139 3.169 3.048 9.963 897 HG13 VAL 139 3HG1 VAL 139 2.077 2.528 8.662 898 HG21 VAL 139 3HG2 VAL 139 0.309 0.794 9.134 899 HG22 VAL 139 1HG2 VAL 139 0.056 0.231 10.802 900 HG23 VAL 139 2HG2 VAL 139 -0.244 1.914 10.391 901 H ALA 140 H ALA 140 4.969 0.024 8.683 902 HA ALA 140 HA ALA 140 6.848 0.645 10.905 903 HB1 ALA 140 1HB ALA 140 8.171 -1.326 10.556 904 HB2 ALA 140 2HB ALA 140 6.496 -1.863 10.762 905 HB3 ALA 140 3HB ALA 140 7.231 -1.816 9.142 906 H ARG 141 H ARG 141 9.354 0.312 9.444 907 HA ARG 141 HA ARG 141 8.803 1.583 6.819 908 HB3 ARG 141 2HB ARG 141 9.882 3.087 8.499 909 HG3 ARG 141 2HG ARG 141 12.533 1.936 8.292 910 HD3 ARG 141 2HD ARG 141 11.748 3.576 9.891 911 HE ARG 141 HE ARG 141 9.651 2.639 10.580 912 HH11 ARG 141 1HH1 ARG 141 12.507 1.665 12.444 913 HH12 ARG 141 2HH1 ARG 141 11.649 1.548 13.937 914 HH21 ARG 141 1HH2 ARG 141 8.577 2.626 12.439 915 HH22 ARG 141 2HH2 ARG 141 9.336 2.282 13.982 916 H ASP 142 H ASP 142 10.832 1.283 5.461 917 HA ASP 142 HA ASP 142 12.218 -0.062 4.287 918 HB3 ASP 142 2HB ASP 142 14.079 -1.016 5.603 919 H ASP 143 H ASP 143 13.289 -2.765 5.262 920 HA ASP 143 HA ASP 143 10.933 -4.371 4.458 921 HB3 ASP 143 2HB ASP 143 12.713 -4.387 2.835 922 H SER 144 H SER 144 11.639 -3.434 7.253 923 HA SER 144 HA SER 144 12.975 -5.453 8.683 924 HB3 SER 144 2HB SER 144 11.885 -4.136 10.578 925 HG SER 144 HG SER 144 13.752 -3.451 8.901 926 H GLU 145 H GLU 145 9.562 -5.246 7.765 927 HA GLU 145 HA GLU 145 8.870 -7.341 9.769 928 HB3 GLU 145 2HB GLU 145 6.618 -6.326 9.754 929 HG3 GLU 145 2HG GLU 145 8.712 -4.303 10.584 930 H VAL 146 H VAL 146 9.737 -7.553 6.753 931 HA VAL 146 HA VAL 146 7.425 -8.205 5.308 932 HB VAL 146 HB VAL 146 10.318 -9.187 4.998 933 HG11 VAL 146 1HG1 VAL 146 8.082 -9.275 2.930 934 HG12 VAL 146 2HG1 VAL 146 9.802 -9.619 2.603 935 HG13 VAL 146 3HG1 VAL 146 8.874 -10.674 3.669 936 HG21 VAL 146 3HG2 VAL 146 10.636 -7.441 3.381 937 HG22 VAL 146 1HG2 VAL 146 8.927 -7.019 3.398 938 HG23 VAL 146 2HG2 VAL 146 9.942 -6.677 4.818 939 H ASP 147 H ASP 147 9.439 -10.369 7.197 940 HA ASP 147 HA ASP 147 8.151 -12.803 6.401 941 HB3 ASP 147 2HB ASP 147 9.476 -12.035 9.027 942 H LYS 148 H LYS 148 7.177 -10.262 8.617 943 HA LYS 148 HA LYS 148 5.190 -12.135 9.867 944 HB3 LYS 148 2HB LYS 148 6.322 -10.986 11.576 945 HG3 LYS 148 2HG LYS 148 5.755 -8.373 10.169 946 HD3 LYS 148 2HD LYS 148 7.230 -7.566 12.176 947 HE3 LYS 148 2HE LYS 148 4.693 -7.172 11.558 948 HZ1 LYS 148 3HZ LYS 148 3.212 -7.785 13.197 949 HZ2 LYS 148 1HZ LYS 148 4.362 -8.227 14.280 950 HZ3 LYS 148 2HZ LYS 148 3.977 -9.184 12.980 951 H TRP 149 H TRP 149 5.379 -9.764 7.392 952 HA TRP 149 HA TRP 149 2.468 -9.253 7.571 953 HB3 TRP 149 2HB TRP 149 2.874 -7.772 5.667 954 HD1 TRP 149 HD TRP 149 3.096 -7.801 9.148 955 HE1 TRP 149 1HE TRP 149 4.025 -5.684 10.243 956 HE3 TRP 149 3HE TRP 149 5.291 -5.600 5.095 957 HZ2 TRP 149 2HZ TRP 149 4.855 -3.063 9.355 958 HZ3 TRP 149 3HZ TRP 149 6.135 -3.259 5.248 959 HH2 TRP 149 HH TRP 149 5.842 -1.956 7.328 960 H SER 150 H SER 150 4.519 -11.636 6.125 961 HA SER 150 HA SER 150 2.405 -12.261 4.129 962 HB3 SER 150 2HB SER 150 5.156 -12.910 3.281 963 HG SER 150 HG SER 150 3.273 -12.712 1.897 964 H LYS 151 H LYS 151 2.086 -13.465 6.467 965 HA LYS 151 HA LYS 151 3.007 -16.253 6.003 966 HB3 LYS 151 2HB LYS 151 2.863 -16.275 8.671 967 HG3 LYS 151 2HG LYS 151 5.175 -15.344 6.921 968 HD3 LYS 151 2HD LYS 151 5.610 -14.723 9.265 969 HE3 LYS 151 2HE LYS 151 5.257 -17.678 9.810 970 HZ1 LYS 151 3HZ LYS 151 7.205 -16.667 10.867 971 HZ2 LYS 151 1HZ LYS 151 6.080 -17.071 11.997 972 HZ3 LYS 151 2HZ LYS 151 6.302 -15.496 11.514
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