NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
536491 | 2lbh | 17561 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 ALA 1 H1 ALA 1 20.799 40.033 -0.120 2 H2 ALA 1 H2 ALA 1 20.841 39.222 -1.631 3 H3 ALA 1 H3 ALA 1 22.273 39.372 -0.696 4 HA ALA 1 HA ALA 1 21.515 37.922 0.912 5 HB1 ALA 1 HB1 ALA 1 19.200 36.924 0.710 6 HB2 ALA 1 HB2 ALA 1 18.845 38.207 -0.446 7 HB3 ALA 1 HB3 ALA 1 19.269 38.612 1.217 8 H VAL 2 H VAL 2 21.704 35.690 0.731 9 HA VAL 2 HA VAL 2 22.717 34.737 -1.739 10 HB VAL 2 HB VAL 2 23.501 33.887 0.413 11 HG11 VAL 2 HG11 VAL 2 22.012 33.426 1.993 12 HG12 VAL 2 HG12 VAL 2 21.615 31.957 1.103 13 HG13 VAL 2 HG13 VAL 2 20.689 33.431 0.830 14 HG21 VAL 2 HG21 VAL 2 23.975 31.803 -0.375 15 HG22 VAL 2 HG22 VAL 2 23.336 32.522 -1.853 16 HG23 VAL 2 HG23 VAL 2 22.310 31.486 -0.861 17 H LEU 3 H LEU 3 21.699 34.130 -3.364 18 HA LEU 3 HA LEU 3 19.339 32.448 -3.344 19 HB2 LEU 3 HB2 LEU 3 19.238 35.362 -3.875 20 HB3 LEU 3 HB3 LEU 3 18.690 34.432 -5.261 21 HG LEU 3 HG LEU 3 16.733 34.851 -4.100 22 HD11 LEU 3 HD11 LEU 3 17.504 32.285 -4.360 23 HD12 LEU 3 HD12 LEU 3 15.914 32.782 -3.785 24 HD13 LEU 3 HD13 LEU 3 17.172 32.340 -2.630 25 HD21 LEU 3 HD21 LEU 3 17.283 33.989 -1.432 26 HD22 LEU 3 HD22 LEU 3 16.753 35.571 -2.020 27 HD23 LEU 3 HD23 LEU 3 18.466 35.201 -1.920 28 H ASP 4 H ASP 4 21.207 31.096 -4.190 29 HA ASP 4 HA ASP 4 22.471 31.981 -6.504 30 HB2 ASP 4 HB2 ASP 4 22.887 29.859 -4.938 31 HB3 ASP 4 HB3 ASP 4 21.975 29.071 -6.216 32 H LEU 5 H LEU 5 20.018 32.805 -6.997 33 HA LEU 5 HA LEU 5 19.321 31.474 -9.306 34 HB2 LEU 5 HB2 LEU 5 17.534 31.933 -7.038 35 HB3 LEU 5 HB3 LEU 5 17.051 31.516 -8.643 36 HG LEU 5 HG LEU 5 18.798 29.814 -6.915 37 HD11 LEU 5 HD11 LEU 5 16.400 30.305 -6.163 38 HD12 LEU 5 HD12 LEU 5 16.881 28.565 -6.369 39 HD13 LEU 5 HD13 LEU 5 15.918 29.376 -7.628 40 HD21 LEU 5 HD21 LEU 5 18.508 28.112 -8.645 41 HD22 LEU 5 HD22 LEU 5 19.118 29.590 -9.388 42 HD23 LEU 5 HD23 LEU 5 17.416 29.176 -9.537 43 H ASP 6 H ASP 6 17.595 33.576 -7.309 44 HA ASP 6 HA ASP 6 18.342 36.031 -8.538 45 HB2 ASP 6 HB2 ASP 6 16.473 34.404 -9.784 46 HB3 ASP 6 HB3 ASP 6 15.556 35.768 -9.140 47 H VAL 7 H VAL 7 15.252 34.753 -7.029 48 HA VAL 7 HA VAL 7 15.688 36.508 -4.725 49 HB VAL 7 HB VAL 7 14.442 37.984 -6.277 50 HG11 VAL 7 HG11 VAL 7 13.296 35.726 -7.232 51 HG12 VAL 7 HG12 VAL 7 12.693 37.358 -7.548 52 HG13 VAL 7 HG13 VAL 7 11.978 36.381 -6.264 53 HG21 VAL 7 HG21 VAL 7 13.987 38.013 -3.834 54 HG22 VAL 7 HG22 VAL 7 12.605 36.956 -4.119 55 HG23 VAL 7 HG23 VAL 7 12.633 38.579 -4.813 56 H ARG 8 H ARG 8 15.204 35.256 -3.045 57 HA ARG 8 HA ARG 8 13.901 32.795 -3.260 58 HB2 ARG 8 HB2 ARG 8 14.217 32.891 -0.722 59 HB3 ARG 8 HB3 ARG 8 15.676 32.949 -1.675 60 HG2 ARG 8 HG2 ARG 8 16.240 34.682 -0.374 61 HG3 ARG 8 HG3 ARG 8 15.077 35.612 -1.312 62 HD2 ARG 8 HD2 ARG 8 13.619 34.267 0.662 63 HD3 ARG 8 HD3 ARG 8 15.056 34.912 1.458 64 HE ARG 8 HE ARG 8 14.180 36.977 -0.049 65 HH11 ARG 8 HH11 ARG 8 12.723 34.912 2.345 66 HH12 ARG 8 HH12 ARG 8 11.600 36.117 2.885 67 HH21 ARG 8 HH21 ARG 8 12.739 38.571 0.619 68 HH22 ARG 8 HH22 ARG 8 11.616 38.232 1.898 69 H THR 9 H THR 9 11.622 33.021 -3.664 70 HA THR 9 HA THR 9 10.409 34.594 -1.471 71 HB THR 9 HB THR 9 9.612 35.308 -3.667 72 HG1 THR 9 HG1 THR 9 7.860 35.532 -2.510 73 HG21 THR 9 HG21 THR 9 7.991 33.244 -4.556 74 HG22 THR 9 HG22 THR 9 9.548 32.489 -4.216 75 HG23 THR 9 HG23 THR 9 9.456 33.862 -5.317 76 H CYS 10 H CYS 10 10.690 33.242 0.052 77 HA CYS 10 HA CYS 10 10.348 30.413 -0.122 78 HB2 CYS 10 HB2 CYS 10 11.001 32.383 2.019 79 HB3 CYS 10 HB3 CYS 10 10.315 30.855 2.573 80 H LEU 11 H LEU 11 7.988 30.277 -0.923 81 HA LEU 11 HA LEU 11 5.670 31.222 0.093 82 HB2 LEU 11 HB2 LEU 11 6.366 28.457 -0.807 83 HB3 LEU 11 HB3 LEU 11 4.835 28.689 0.014 84 HG LEU 11 HG LEU 11 3.855 29.526 -1.819 85 HD11 LEU 11 HD11 LEU 11 4.569 31.729 -1.739 86 HD12 LEU 11 HD12 LEU 11 5.141 31.215 -3.325 87 HD13 LEU 11 HD13 LEU 11 6.264 31.300 -1.971 88 HD21 LEU 11 HD21 LEU 11 4.615 28.624 -3.777 89 HD22 LEU 11 HD22 LEU 11 5.611 27.725 -2.627 90 HD23 LEU 11 HD23 LEU 11 6.285 29.116 -3.477 91 HA PRO 12 HA PRO 12 5.991 30.142 4.484 92 HB2 PRO 12 HB2 PRO 12 3.963 31.693 5.343 93 HB3 PRO 12 HB3 PRO 12 5.523 32.387 4.885 94 HG2 PRO 12 HG2 PRO 12 2.989 32.196 3.297 95 HG3 PRO 12 HG3 PRO 12 4.078 33.583 3.486 96 HD2 PRO 12 HD2 PRO 12 4.139 31.969 1.309 97 HD3 PRO 12 HD3 PRO 12 5.582 32.778 1.946 98 H CYS 13 H CYS 13 5.222 28.115 5.096 99 HA CYS 13 HA CYS 13 2.326 27.751 4.947 100 HB2 CYS 13 HB2 CYS 13 2.421 25.604 4.090 101 HB3 CYS 13 HB3 CYS 13 3.602 26.489 3.134 102 H GLY 14 H GLY 14 1.841 25.510 6.212 103 HA2 GLY 14 HA2 GLY 14 1.881 24.384 8.246 104 HA3 GLY 14 HA3 GLY 14 3.410 25.166 8.615 105 HA PRO 15 HA PRO 15 0.193 27.008 11.487 106 HB2 PRO 15 HB2 PRO 15 1.776 27.011 13.645 107 HB3 PRO 15 HB3 PRO 15 1.065 25.477 13.074 108 HG2 PRO 15 HG2 PRO 15 3.611 26.734 12.164 109 HG3 PRO 15 HG3 PRO 15 3.509 25.222 13.133 110 HD2 PRO 15 HD2 PRO 15 3.620 24.918 10.568 111 HD3 PRO 15 HD3 PRO 15 2.174 24.200 11.340 112 H GLY 16 H GLY 16 0.264 28.978 10.524 113 HA2 GLY 16 HA2 GLY 16 0.606 31.292 10.738 114 HA3 GLY 16 HA3 GLY 16 2.079 30.924 11.611 115 H GLY 17 H GLY 17 2.023 29.086 8.878 116 HA2 GLY 17 HA2 GLY 17 2.923 29.272 6.808 117 HA3 GLY 17 HA3 GLY 17 2.765 30.977 7.034 118 H LYS 18 H LYS 18 4.702 28.717 8.846 119 HA LYS 18 HA LYS 18 7.042 30.389 8.408 120 HB2 LYS 18 HB2 LYS 18 7.048 28.009 10.189 121 HB3 LYS 18 HB3 LYS 18 7.813 29.579 10.400 122 HG2 LYS 18 HG2 LYS 18 5.211 30.312 10.446 123 HG3 LYS 18 HG3 LYS 18 5.099 28.693 11.142 124 HD2 LYS 18 HD2 LYS 18 7.276 29.830 12.408 125 HD3 LYS 18 HD3 LYS 18 6.119 31.161 12.239 126 HE2 LYS 18 HE2 LYS 18 4.680 30.266 13.721 127 HE3 LYS 18 HE3 LYS 18 4.913 28.637 13.094 128 HZ1 LYS 18 HZ1 LYS 18 6.545 30.063 15.109 129 HZ2 LYS 18 HZ2 LYS 18 7.114 28.681 14.315 130 HZ3 LYS 18 HZ3 LYS 18 5.722 28.593 15.275 131 H GLY 19 H GLY 19 5.773 27.337 7.505 132 HA2 GLY 19 HA2 GLY 19 8.269 26.144 6.745 133 HA3 GLY 19 HA3 GLY 19 6.662 25.511 6.416 134 H ARG 20 H ARG 20 8.426 25.239 4.493 135 HA ARG 20 HA ARG 20 7.748 27.384 2.589 136 HB2 ARG 20 HB2 ARG 20 10.237 25.962 3.225 137 HB3 ARG 20 HB3 ARG 20 9.940 26.208 1.507 138 HG2 ARG 20 HG2 ARG 20 11.019 28.137 1.859 139 HG3 ARG 20 HG3 ARG 20 9.466 28.690 2.489 140 HD2 ARG 20 HD2 ARG 20 10.806 29.254 4.246 141 HD3 ARG 20 HD3 ARG 20 10.379 27.609 4.714 142 HE ARG 20 HE ARG 20 12.718 27.473 3.196 143 HH11 ARG 20 HH11 ARG 20 11.652 28.750 6.262 144 HH12 ARG 20 HH12 ARG 20 13.208 28.606 7.009 145 HH21 ARG 20 HH21 ARG 20 14.780 27.269 4.197 146 HH22 ARG 20 HH22 ARG 20 14.975 27.772 5.843 147 H CYS 21 H CYS 21 7.181 26.739 0.449 148 HA CYS 21 HA CYS 21 6.264 23.940 0.370 149 HB2 CYS 21 HB2 CYS 21 5.520 26.365 -1.267 150 HB3 CYS 21 HB3 CYS 21 5.049 24.749 -1.759 151 H PHE 22 H PHE 22 7.190 22.477 -0.769 152 HA PHE 22 HA PHE 22 9.313 23.205 -2.677 153 HB2 PHE 22 HB2 PHE 22 8.919 20.887 -0.791 154 HB3 PHE 22 HB3 PHE 22 9.988 20.736 -2.184 155 HD1 PHE 22 HD1 PHE 22 9.383 23.617 0.162 156 HD2 PHE 22 HD2 PHE 22 12.179 20.712 -1.390 157 HE1 PHE 22 HE1 PHE 22 11.216 24.734 1.373 158 HE2 PHE 22 HE2 PHE 22 14.007 21.826 -0.164 159 HZ PHE 22 HZ PHE 22 13.524 23.843 1.214 160 H GLY 23 H GLY 23 6.395 21.333 -2.236 161 HA2 GLY 23 HA2 GLY 23 6.170 20.960 -5.101 162 HA3 GLY 23 HA3 GLY 23 6.342 19.478 -4.174 163 HA PRO 24 HA PRO 24 1.795 20.663 -4.731 164 HB2 PRO 24 HB2 PRO 24 1.740 17.701 -5.019 165 HB3 PRO 24 HB3 PRO 24 0.864 18.940 -5.926 166 HG2 PRO 24 HG2 PRO 24 2.956 17.702 -7.012 167 HG3 PRO 24 HG3 PRO 24 2.691 19.437 -7.271 168 HD2 PRO 24 HD2 PRO 24 4.640 18.063 -5.468 169 HD3 PRO 24 HD3 PRO 24 4.839 19.544 -6.430 170 H SER 25 H SER 25 2.942 17.645 -3.106 171 HA SER 25 HA SER 25 1.325 18.452 -0.766 172 HB2 SER 25 HB2 SER 25 1.492 15.834 -2.150 173 HB3 SER 25 HB3 SER 25 1.528 15.724 -0.363 174 HG SER 25 HG SER 25 -0.459 16.593 -0.293 175 H ILE 26 H ILE 26 4.070 19.183 -1.172 176 HA ILE 26 HA ILE 26 5.150 17.849 1.171 177 HB ILE 26 HB ILE 26 6.832 18.287 -1.258 178 HG12 ILE 26 HG12 ILE 26 5.588 15.741 -0.310 179 HG13 ILE 26 HG13 ILE 26 5.105 16.652 -1.735 180 HG21 ILE 26 HG21 ILE 26 8.163 18.306 0.644 181 HG22 ILE 26 HG22 ILE 26 8.325 16.696 -0.057 182 HG23 ILE 26 HG23 ILE 26 7.287 16.950 1.348 183 HD11 ILE 26 HD11 ILE 26 6.492 15.342 -2.856 184 HD12 ILE 26 HD12 ILE 26 7.279 14.768 -1.386 185 HD13 ILE 26 HD13 ILE 26 7.795 16.282 -2.130 186 H CYS 27 H CYS 27 5.428 19.422 2.624 187 HA CYS 27 HA CYS 27 6.672 21.959 1.726 188 HB2 CYS 27 HB2 CYS 27 4.107 21.804 2.662 189 HB3 CYS 27 HB3 CYS 27 4.998 22.076 4.146 190 H CYS 28 H CYS 28 8.650 22.241 2.716 191 HA CYS 28 HA CYS 28 8.866 21.166 5.441 192 HB2 CYS 28 HB2 CYS 28 11.386 21.088 3.939 193 HB3 CYS 28 HB3 CYS 28 10.674 19.854 4.979 194 H GLY 29 H GLY 29 9.652 22.626 6.949 195 HA2 GLY 29 HA2 GLY 29 10.859 25.036 5.891 196 HA3 GLY 29 HA3 GLY 29 10.084 24.874 7.466 197 H ASP 30 H ASP 30 12.113 25.959 8.039 198 HA ASP 30 HA ASP 30 14.553 24.561 8.007 199 HB2 ASP 30 HB2 ASP 30 14.369 26.995 8.101 200 HB3 ASP 30 HB3 ASP 30 13.745 26.900 9.752 201 H GLU 31 H GLU 31 12.252 25.132 10.569 202 HA GLU 31 HA GLU 31 13.474 22.993 12.164 203 HB2 GLU 31 HB2 GLU 31 11.913 24.972 13.685 204 HB3 GLU 31 HB3 GLU 31 13.472 24.255 14.050 205 HG2 GLU 31 HG2 GLU 31 14.384 25.820 12.263 206 HG3 GLU 31 HG3 GLU 31 12.870 26.694 12.439 207 H LEU 32 H LEU 32 10.999 23.535 10.194 208 HA LEU 32 HA LEU 32 9.036 22.295 11.930 209 HB2 LEU 32 HB2 LEU 32 9.091 24.332 9.827 210 HB3 LEU 32 HB3 LEU 32 7.800 23.183 9.697 211 HG LEU 32 HG LEU 32 8.394 24.651 12.246 212 HD11 LEU 32 HD11 LEU 32 8.021 26.235 10.443 213 HD12 LEU 32 HD12 LEU 32 6.795 26.313 11.708 214 HD13 LEU 32 HD13 LEU 32 6.430 25.531 10.167 215 HD21 LEU 32 HD21 LEU 32 6.557 23.754 13.148 216 HD22 LEU 32 HD22 LEU 32 6.758 22.534 11.893 217 HD23 LEU 32 HD23 LEU 32 5.625 23.862 11.649 218 H GLY 33 H GLY 33 11.329 21.742 9.537 219 HA2 GLY 33 HA2 GLY 33 11.844 19.844 8.405 220 HA3 GLY 33 HA3 GLY 33 10.630 19.067 9.368 221 H CYS 34 H CYS 34 9.498 17.839 7.874 222 HA CYS 34 HA CYS 34 8.191 19.397 5.759 223 HB2 CYS 34 HB2 CYS 34 10.236 17.928 5.046 224 HB3 CYS 34 HB3 CYS 34 9.030 16.672 5.049 225 H PHE 35 H PHE 35 6.163 19.216 5.564 226 HA PHE 35 HA PHE 35 4.782 16.955 6.838 227 HB2 PHE 35 HB2 PHE 35 3.698 19.558 5.708 228 HB3 PHE 35 HB3 PHE 35 2.812 18.403 6.694 229 HD1 PHE 35 HD1 PHE 35 5.854 20.549 6.829 230 HD2 PHE 35 HD2 PHE 35 2.566 18.844 8.912 231 HE1 PHE 35 HE1 PHE 35 6.513 21.777 8.854 232 HE2 PHE 35 HE2 PHE 35 3.213 20.064 10.945 233 HZ PHE 35 HZ PHE 35 5.193 21.529 10.922 234 H VAL 36 H VAL 36 4.941 15.369 5.250 235 HA VAL 36 HA VAL 36 4.602 16.211 2.522 236 HB VAL 36 HB VAL 36 4.963 13.345 3.356 237 HG11 VAL 36 HG11 VAL 36 5.242 12.946 1.137 238 HG12 VAL 36 HG12 VAL 36 6.141 14.463 0.868 239 HG13 VAL 36 HG13 VAL 36 4.376 14.477 0.947 240 HG21 VAL 36 HG21 VAL 36 6.742 14.824 4.372 241 HG22 VAL 36 HG22 VAL 36 7.193 15.318 2.745 242 HG23 VAL 36 HG23 VAL 36 7.381 13.636 3.234 243 H GLY 37 H GLY 37 2.730 16.880 2.264 244 HA2 GLY 37 HA2 GLY 37 0.554 16.707 1.500 245 HA3 GLY 37 HA3 GLY 37 0.618 14.977 1.793 246 H THR 38 H THR 38 0.105 18.118 3.244 247 HA THR 38 HA THR 38 -1.708 16.897 5.144 248 HB THR 38 HB THR 38 -0.644 17.809 7.075 249 HG1 THR 38 HG1 THR 38 0.899 19.294 6.979 250 HG21 THR 38 HG21 THR 38 0.373 15.717 6.270 251 HG22 THR 38 HG22 THR 38 1.516 16.751 7.126 252 HG23 THR 38 HG23 THR 38 1.553 16.666 5.366 253 H ALA 39 H ALA 39 -2.819 18.630 6.467 254 HA ALA 39 HA ALA 39 -4.096 20.461 4.809 255 HB1 ALA 39 HB1 ALA 39 -4.475 19.563 7.348 256 HB2 ALA 39 HB2 ALA 39 -5.365 20.895 6.614 257 HB3 ALA 39 HB3 ALA 39 -3.972 21.229 7.643 258 H GLU 40 H GLU 40 -1.123 20.718 6.583 259 HA GLU 40 HA GLU 40 -0.912 23.560 6.542 260 HB2 GLU 40 HB2 GLU 40 1.019 21.322 7.085 261 HB3 GLU 40 HB3 GLU 40 1.551 22.998 7.036 262 HG2 GLU 40 HG2 GLU 40 1.130 22.830 9.255 263 HG3 GLU 40 HG3 GLU 40 -0.480 23.298 8.710 264 H ALA 41 H ALA 41 0.000 21.049 4.290 265 HA ALA 41 HA ALA 41 1.539 22.925 2.679 266 HB1 ALA 41 HB1 ALA 41 2.361 20.581 3.239 267 HB2 ALA 41 HB2 ALA 41 2.416 21.052 1.540 268 HB3 ALA 41 HB3 ALA 41 1.127 19.996 2.124 269 H LEU 42 H LEU 42 -1.612 22.062 3.061 270 HA LEU 42 HA LEU 42 -2.538 21.532 0.494 271 HB2 LEU 42 HB2 LEU 42 -3.645 22.325 3.043 272 HB3 LEU 42 HB3 LEU 42 -4.481 23.131 1.728 273 HG LEU 42 HG LEU 42 -4.053 20.155 1.818 274 HD11 LEU 42 HD11 LEU 42 -5.527 20.109 3.495 275 HD12 LEU 42 HD12 LEU 42 -6.726 20.604 2.300 276 HD13 LEU 42 HD13 LEU 42 -5.928 21.816 3.302 277 HD21 LEU 42 HD21 LEU 42 -4.537 21.350 -0.366 278 HD22 LEU 42 HD22 LEU 42 -6.121 21.729 0.311 279 HD23 LEU 42 HD23 LEU 42 -5.641 20.048 0.082 280 H ARG 43 H ARG 43 -1.598 24.517 2.033 281 HA ARG 43 HA ARG 43 -2.661 26.231 0.019 282 HB2 ARG 43 HB2 ARG 43 -1.328 27.980 1.081 283 HB3 ARG 43 HB3 ARG 43 -2.217 27.048 2.277 284 HG2 ARG 43 HG2 ARG 43 0.104 25.692 2.270 285 HG3 ARG 43 HG3 ARG 43 0.684 27.303 1.847 286 HD2 ARG 43 HD2 ARG 43 -1.172 26.838 4.161 287 HD3 ARG 43 HD3 ARG 43 0.575 26.696 4.328 288 HE ARG 43 HE ARG 43 0.784 29.005 3.935 289 HH11 ARG 43 HH11 ARG 43 -2.560 27.976 3.977 290 HH12 ARG 43 HH12 ARG 43 -3.173 29.579 4.193 291 HH21 ARG 43 HH21 ARG 43 -0.032 31.105 4.219 292 HH22 ARG 43 HH22 ARG 43 -1.742 31.353 4.329 293 H CYS 44 H CYS 44 -0.076 24.055 0.017 294 HA CYS 44 HA CYS 44 1.773 25.580 -1.530 295 HB2 CYS 44 HB2 CYS 44 1.435 22.605 -1.206 296 HB3 CYS 44 HB3 CYS 44 2.729 23.331 -2.146 297 H GLN 45 H GLN 45 -1.245 24.347 -2.324 298 HA GLN 45 HA GLN 45 -0.970 23.417 -4.923 299 HB2 GLN 45 HB2 GLN 45 -3.066 23.761 -3.289 300 HB3 GLN 45 HB3 GLN 45 -3.301 25.166 -4.320 301 HG2 GLN 45 HG2 GLN 45 -3.691 23.890 -6.199 302 HG3 GLN 45 HG3 GLN 45 -2.858 22.482 -5.543 303 HE21 GLN 45 HE21 GLN 45 -4.124 20.884 -4.936 304 HE22 GLN 45 HE22 GLN 45 -5.771 21.020 -4.429 305 H GLU 46 H GLU 46 -0.672 26.641 -3.677 306 HA GLU 46 HA GLU 46 -0.935 27.894 -6.277 307 HB2 GLU 46 HB2 GLU 46 -0.450 28.858 -3.494 308 HB3 GLU 46 HB3 GLU 46 0.041 29.886 -4.829 309 HG2 GLU 46 HG2 GLU 46 -2.139 30.209 -5.548 310 HG3 GLU 46 HG3 GLU 46 -2.740 28.797 -4.676 311 H GLU 47 H GLU 47 1.380 25.998 -5.031 312 HA GLU 47 HA GLU 47 3.679 27.646 -5.603 313 HB2 GLU 47 HB2 GLU 47 3.481 25.592 -3.981 314 HB3 GLU 47 HB3 GLU 47 3.732 24.648 -5.443 315 HG2 GLU 47 HG2 GLU 47 5.713 26.602 -5.499 316 HG3 GLU 47 HG3 GLU 47 5.640 26.061 -3.823 317 H ASN 48 H ASN 48 1.359 26.025 -7.418 318 HA ASN 48 HA ASN 48 3.045 25.099 -9.545 319 HB2 ASN 48 HB2 ASN 48 0.250 25.033 -8.888 320 HB3 ASN 48 HB3 ASN 48 0.442 25.638 -10.528 321 HD21 ASN 48 HD21 ASN 48 -0.396 23.023 -9.102 322 HD22 ASN 48 HD22 ASN 48 0.384 21.806 -10.047 323 H TYR 49 H TYR 49 1.526 28.084 -8.606 324 HA TYR 49 HA TYR 49 1.938 29.383 -11.167 325 HB2 TYR 49 HB2 TYR 49 0.497 29.922 -8.712 326 HB3 TYR 49 HB3 TYR 49 1.432 31.327 -9.204 327 HD1 TYR 49 HD1 TYR 49 -0.432 28.748 -11.159 328 HD2 TYR 49 HD2 TYR 49 0.023 32.860 -10.166 329 HE1 TYR 49 HE1 TYR 49 -2.152 29.334 -12.815 330 HE2 TYR 49 HE2 TYR 49 -1.696 33.456 -11.816 331 HH TYR 49 HH TYR 49 -2.576 31.993 -14.166 332 H LEU 50 H LEU 50 4.100 28.416 -8.943 333 HA LEU 50 HA LEU 50 5.875 30.703 -9.466 334 HB2 LEU 50 HB2 LEU 50 5.431 29.329 -6.817 335 HB3 LEU 50 HB3 LEU 50 6.858 30.289 -7.156 336 HG LEU 50 HG LEU 50 4.868 32.034 -7.831 337 HD11 LEU 50 HD11 LEU 50 2.960 31.084 -7.081 338 HD12 LEU 50 HD12 LEU 50 3.487 31.798 -5.556 339 HD13 LEU 50 HD13 LEU 50 3.791 30.091 -5.885 340 HD21 LEU 50 HD21 LEU 50 5.712 31.953 -4.980 341 HD22 LEU 50 HD22 LEU 50 5.646 33.309 -6.101 342 HD23 LEU 50 HD23 LEU 50 6.955 32.134 -6.217 343 HA PRO 51 HA PRO 51 8.074 26.911 -10.677 344 HB2 PRO 51 HB2 PRO 51 9.211 27.871 -12.887 345 HB3 PRO 51 HB3 PRO 51 7.486 27.482 -12.850 346 HG2 PRO 51 HG2 PRO 51 8.835 30.142 -12.647 347 HG3 PRO 51 HG3 PRO 51 7.365 29.695 -13.530 348 HD2 PRO 51 HD2 PRO 51 7.417 30.912 -11.037 349 HD3 PRO 51 HD3 PRO 51 6.045 29.995 -11.694 350 H SER 52 H SER 52 9.008 29.059 -8.767 351 HA SER 52 HA SER 52 11.875 28.627 -9.191 352 HB2 SER 52 HB2 SER 52 12.435 30.859 -8.655 353 HB3 SER 52 HB3 SER 52 11.102 30.992 -9.802 354 HG SER 52 HG SER 52 9.711 31.196 -7.934 355 HA PRO 53 HA PRO 53 11.221 27.137 -5.012 356 HB2 PRO 53 HB2 PRO 53 13.743 26.253 -4.587 357 HB3 PRO 53 HB3 PRO 53 12.575 25.352 -5.562 358 HG2 PRO 53 HG2 PRO 53 14.781 27.169 -6.450 359 HG3 PRO 53 HG3 PRO 53 14.305 25.589 -7.101 360 HD2 PRO 53 HD2 PRO 53 13.572 27.921 -8.270 361 HD3 PRO 53 HD3 PRO 53 12.544 26.474 -8.304 362 H CYS 54 H CYS 54 13.058 27.280 -3.076 363 HA CYS 54 HA CYS 54 13.872 30.111 -2.932 364 HB2 CYS 54 HB2 CYS 54 11.769 29.267 -1.559 365 HB3 CYS 54 HB3 CYS 54 12.992 28.558 -0.512 366 H GLN 55 H GLN 55 16.218 29.606 -3.418 367 HA GLN 55 HA GLN 55 18.244 28.669 -2.829 368 HB2 GLN 55 HB2 GLN 55 17.652 30.044 -0.779 369 HB3 GLN 55 HB3 GLN 55 17.136 28.545 -0.026 370 HG2 GLN 55 HG2 GLN 55 19.496 27.695 -0.592 371 HG3 GLN 55 HG3 GLN 55 19.877 29.400 -0.827 372 HE21 GLN 55 HE21 GLN 55 20.780 30.272 0.839 373 HE22 GLN 55 HE22 GLN 55 20.462 29.915 2.499 374 H SER 56 H SER 56 16.987 26.909 -0.104 375 HA SER 56 HA SER 56 16.250 24.744 0.182 376 HB2 SER 56 HB2 SER 56 15.689 24.802 -2.370 377 HB3 SER 56 HB3 SER 56 17.199 23.906 -2.538 378 HG SER 56 HG SER 56 14.934 22.853 -2.030 379 H GLY 57 H GLY 57 17.374 23.007 1.067 380 HA2 GLY 57 HA2 GLY 57 20.119 23.438 1.501 381 HA3 GLY 57 HA3 GLY 57 19.200 22.013 1.989 382 H GLN 58 H GLN 58 21.664 22.986 0.251 383 HA GLN 58 HA GLN 58 21.396 21.349 -2.095 384 HB2 GLN 58 HB2 GLN 58 23.107 23.470 -1.296 385 HB3 GLN 58 HB3 GLN 58 24.135 22.065 -1.519 386 HG2 GLN 58 HG2 GLN 58 24.145 22.449 -3.695 387 HG3 GLN 58 HG3 GLN 58 22.409 22.150 -3.753 388 HE21 GLN 58 HE21 GLN 58 24.852 24.641 -3.243 389 HE22 GLN 58 HE22 GLN 58 23.880 25.965 -3.778 390 H LYS 59 H LYS 59 20.841 19.484 -0.876 391 HA LYS 59 HA LYS 59 23.259 17.952 -0.201 392 HB2 LYS 59 HB2 LYS 59 21.010 18.562 1.672 393 HB3 LYS 59 HB3 LYS 59 21.725 16.960 1.729 394 HG2 LYS 59 HG2 LYS 59 23.281 17.756 3.061 395 HG3 LYS 59 HG3 LYS 59 23.867 18.746 1.722 396 HD2 LYS 59 HD2 LYS 59 21.819 20.264 2.504 397 HD3 LYS 59 HD3 LYS 59 22.187 19.485 4.044 398 HE2 LYS 59 HE2 LYS 59 23.834 21.340 2.399 399 HE3 LYS 59 HE3 LYS 59 23.531 21.351 4.135 400 HZ1 LYS 59 HZ1 LYS 59 25.797 20.714 3.663 401 HZ2 LYS 59 HZ2 LYS 59 25.282 19.439 2.679 402 HZ3 LYS 59 HZ3 LYS 59 24.967 19.405 4.341 403 HA PRO 60 HA PRO 60 19.899 15.934 -2.755 404 HB2 PRO 60 HB2 PRO 60 21.564 15.362 -4.868 405 HB3 PRO 60 HB3 PRO 60 20.593 16.837 -4.786 406 HG2 PRO 60 HG2 PRO 60 23.479 16.417 -4.055 407 HG3 PRO 60 HG3 PRO 60 22.749 17.744 -4.984 408 HD2 PRO 60 HD2 PRO 60 23.364 18.050 -2.404 409 HD3 PRO 60 HD3 PRO 60 21.873 18.753 -3.063 410 H CYS 61 H CYS 61 20.142 14.361 -1.091 411 HA CYS 61 HA CYS 61 22.119 12.243 -1.605 412 HB2 CYS 61 HB2 CYS 61 22.193 11.827 0.652 413 HB3 CYS 61 HB3 CYS 61 21.732 13.522 0.707 414 H GLY 62 H GLY 62 21.001 9.977 -0.702 415 HA2 GLY 62 HA2 GLY 62 19.308 8.438 -1.111 416 HA3 GLY 62 HA3 GLY 62 18.205 9.811 -1.138 417 H SER 63 H SER 63 17.108 8.581 -2.843 418 HA SER 63 HA SER 63 18.462 8.203 -5.345 419 HB2 SER 63 HB2 SER 63 15.569 7.946 -4.502 420 HB3 SER 63 HB3 SER 63 16.115 7.654 -6.153 421 HG SER 63 HG SER 63 16.012 5.758 -4.772 422 H GLY 64 H GLY 64 18.766 10.849 -4.663 423 HA2 GLY 64 HA2 GLY 64 18.803 12.648 -6.254 424 HA3 GLY 64 HA3 GLY 64 17.216 12.146 -6.803 425 H GLY 65 H GLY 65 17.550 12.273 -3.362 426 HA2 GLY 65 HA2 GLY 65 15.910 14.714 -3.394 427 HA3 GLY 65 HA3 GLY 65 15.959 13.528 -2.111 428 H ARG 66 H ARG 66 16.487 16.566 -2.526 429 HA ARG 66 HA ARG 66 19.069 16.764 -1.204 430 HB2 ARG 66 HB2 ARG 66 18.637 19.256 -1.339 431 HB3 ARG 66 HB3 ARG 66 18.940 18.399 -2.860 432 HG2 ARG 66 HG2 ARG 66 16.114 18.650 -1.985 433 HG3 ARG 66 HG3 ARG 66 16.911 20.123 -2.545 434 HD2 ARG 66 HD2 ARG 66 16.802 17.532 -4.072 435 HD3 ARG 66 HD3 ARG 66 15.696 18.884 -4.323 436 HE ARG 66 HE ARG 66 18.361 19.767 -4.522 437 HH11 ARG 66 HH11 ARG 66 15.993 17.869 -6.246 438 HH12 ARG 66 HH12 ARG 66 16.674 18.209 -7.801 439 HH21 ARG 66 HH21 ARG 66 19.248 20.230 -6.535 440 HH22 ARG 66 HH22 ARG 66 18.539 19.561 -7.967 441 H CYS 67 H CYS 67 19.291 18.187 0.785 442 HA CYS 67 HA CYS 67 17.360 17.340 2.645 443 HB2 CYS 67 HB2 CYS 67 19.820 17.756 3.092 444 HB3 CYS 67 HB3 CYS 67 19.458 19.473 3.040 445 H ALA 68 H ALA 68 15.364 18.193 2.552 446 HA ALA 68 HA ALA 68 15.071 21.005 1.842 447 HB1 ALA 68 HB1 ALA 68 13.561 19.539 0.671 448 HB2 ALA 68 HB2 ALA 68 12.608 20.492 1.812 449 HB3 ALA 68 HB3 ALA 68 13.010 18.812 2.183 450 H ALA 69 H ALA 69 15.170 18.998 4.568 451 HA ALA 69 HA ALA 69 14.793 21.220 6.393 452 HB1 ALA 69 HB1 ALA 69 12.662 19.140 6.726 453 HB2 ALA 69 HB2 ALA 69 12.431 20.484 5.607 454 HB3 ALA 69 HB3 ALA 69 12.730 20.803 7.314 455 H ALA 70 H ALA 70 15.017 20.392 8.810 456 HA ALA 70 HA ALA 70 17.235 18.833 9.079 457 HB1 ALA 70 HB1 ALA 70 16.680 18.217 11.395 458 HB2 ALA 70 HB2 ALA 70 15.059 18.947 11.165 459 HB3 ALA 70 HB3 ALA 70 16.507 19.958 11.051 460 H GLY 71 H GLY 71 17.787 16.943 8.741 461 HA2 GLY 71 HA2 GLY 71 17.911 14.685 8.505 462 HA3 GLY 71 HA3 GLY 71 16.643 14.616 9.718 463 H ILE 72 H ILE 72 16.167 16.063 6.558 464 HA ILE 72 HA ILE 72 14.723 13.658 5.696 465 HB ILE 72 HB ILE 72 12.837 14.902 5.031 466 HG12 ILE 72 HG12 ILE 72 13.215 17.188 6.780 467 HG13 ILE 72 HG13 ILE 72 14.371 17.181 5.425 468 HG21 ILE 72 HG21 ILE 72 11.813 15.014 7.193 469 HG22 ILE 72 HG22 ILE 72 13.379 15.214 7.980 470 HG23 ILE 72 HG23 ILE 72 12.977 13.690 7.189 471 HD11 ILE 72 HD11 ILE 72 11.572 16.454 5.023 472 HD12 ILE 72 HD12 ILE 72 12.714 17.202 3.876 473 HD13 ILE 72 HD13 ILE 72 11.983 18.180 5.166 474 H CYS 73 H CYS 73 15.596 13.179 3.882 475 HA CYS 73 HA CYS 73 16.563 15.228 2.052 476 HB2 CYS 73 HB2 CYS 73 17.298 12.564 2.712 477 HB3 CYS 73 HB3 CYS 73 16.779 12.569 1.040 478 H CYS 74 H CYS 74 14.693 16.075 1.190 479 HA CYS 74 HA CYS 74 12.880 14.177 -0.078 480 HB2 CYS 74 HB2 CYS 74 12.443 17.122 0.410 481 HB3 CYS 74 HB3 CYS 74 11.244 15.960 -0.150 482 H SER 75 H SER 75 12.225 14.353 -2.154 483 HA SER 75 HA SER 75 13.894 16.013 -3.936 484 HB2 SER 75 HB2 SER 75 12.841 13.583 -5.171 485 HB3 SER 75 HB3 SER 75 14.495 14.193 -5.139 486 HG SER 75 HG SER 75 14.192 12.148 -4.059 487 HA PRO 76 HA PRO 76 10.157 17.279 -5.883 488 HB2 PRO 76 HB2 PRO 76 10.387 16.839 -8.541 489 HB3 PRO 76 HB3 PRO 76 11.332 18.059 -7.681 490 HG2 PRO 76 HG2 PRO 76 12.133 15.334 -8.586 491 HG3 PRO 76 HG3 PRO 76 13.063 16.842 -8.603 492 HD2 PRO 76 HD2 PRO 76 13.354 14.878 -6.710 493 HD3 PRO 76 HD3 PRO 76 13.743 16.585 -6.432 494 H ASP 77 H ASP 77 10.139 14.488 -4.935 495 HA ASP 77 HA ASP 77 7.670 13.701 -6.236 496 HB2 ASP 77 HB2 ASP 77 10.181 12.100 -6.346 497 HB3 ASP 77 HB3 ASP 77 8.656 11.245 -6.126 498 H GLY 78 H GLY 78 10.070 12.799 -3.756 499 HA2 GLY 78 HA2 GLY 78 7.883 12.614 -1.847 500 HA3 GLY 78 HA3 GLY 78 8.901 11.217 -2.013 501 H CYS 79 H CYS 79 9.525 11.305 0.112 502 HA CYS 79 HA CYS 79 11.606 13.275 0.742 503 HB2 CYS 79 HB2 CYS 79 9.136 12.665 2.307 504 HB3 CYS 79 HB3 CYS 79 10.620 13.018 3.187 505 H HIS 80 H HIS 80 13.318 12.441 2.192 506 HA HIS 80 HA HIS 80 13.038 9.585 2.902 507 HB2 HIS 80 HB2 HIS 80 14.348 10.453 0.563 508 HB3 HIS 80 HB3 HIS 80 15.633 10.080 1.704 509 HD1 HIS 80 HD1 HIS 80 13.347 8.544 -0.648 510 HD2 HIS 80 HD2 HIS 80 15.439 7.350 2.733 511 HE1 HIS 80 HE1 HIS 80 13.370 6.033 -0.728 512 HE2 HIS 80 HE2 HIS 80 14.728 5.337 1.275 513 H GLU 81 H GLU 81 14.375 8.957 4.607 514 HA GLU 81 HA GLU 81 15.371 11.057 6.244 515 HB2 GLU 81 HB2 GLU 81 15.563 8.056 6.417 516 HB3 GLU 81 HB3 GLU 81 16.325 9.116 7.601 517 HG2 GLU 81 HG2 GLU 81 14.197 10.065 8.197 518 HG3 GLU 81 HG3 GLU 81 13.396 9.152 6.921 519 H ASP 82 H ASP 82 17.468 11.639 6.696 520 HA ASP 82 HA ASP 82 19.609 10.454 5.094 521 HB2 ASP 82 HB2 ASP 82 20.141 12.461 3.961 522 HB3 ASP 82 HB3 ASP 82 18.365 12.370 3.861 523 HA PRO 83 HA PRO 83 21.451 11.008 9.158 524 HB2 PRO 83 HB2 PRO 83 23.954 10.377 7.724 525 HB3 PRO 83 HB3 PRO 83 23.222 9.595 9.125 526 HG2 PRO 83 HG2 PRO 83 23.194 8.433 6.717 527 HG3 PRO 83 HG3 PRO 83 21.821 8.283 7.829 528 HD2 PRO 83 HD2 PRO 83 22.132 10.023 5.416 529 HD3 PRO 83 HD3 PRO 83 20.704 9.136 5.993 530 H ALA 84 H ALA 84 22.327 12.761 6.324 531 HA ALA 84 HA ALA 84 24.442 14.290 7.403 532 HB1 ALA 84 HB1 ALA 84 22.674 14.475 5.037 533 HB2 ALA 84 HB2 ALA 84 24.435 14.453 5.139 534 HB3 ALA 84 HB3 ALA 84 23.548 15.929 5.523 535 H CYS 85 H CYS 85 20.962 14.892 7.169 536 HA CYS 85 HA CYS 85 21.326 17.244 8.895 537 HB2 CYS 85 HB2 CYS 85 18.842 16.541 7.328 538 HB3 CYS 85 HB3 CYS 85 19.246 18.084 8.076 539 H ASP 86 H ASP 86 21.301 14.370 9.724 540 HA ASP 86 HA ASP 86 18.763 14.079 11.094 541 HB2 ASP 86 HB2 ASP 86 20.140 12.230 10.106 542 HB3 ASP 86 HB3 ASP 86 21.257 12.571 11.399 543 HA PRO 87 HA PRO 87 21.762 14.642 14.913 544 HB2 PRO 87 HB2 PRO 87 23.510 16.674 13.987 545 HB3 PRO 87 HB3 PRO 87 23.916 15.066 14.615 546 HG2 PRO 87 HG2 PRO 87 24.098 16.028 11.932 547 HG3 PRO 87 HG3 PRO 87 24.534 14.421 12.537 548 HD2 PRO 87 HD2 PRO 87 22.335 15.161 10.926 549 HD3 PRO 87 HD3 PRO 87 22.653 13.581 11.577 550 H GLU 88 H GLU 88 20.643 16.251 16.108 551 HA GLU 88 HA GLU 88 18.892 17.919 15.736 552 HB2 GLU 88 HB2 GLU 88 21.530 19.106 16.492 553 HB3 GLU 88 HB3 GLU 88 19.932 19.711 16.901 554 HG2 GLU 88 HG2 GLU 88 20.701 16.984 17.787 555 HG3 GLU 88 HG3 GLU 88 21.328 18.389 18.636 556 H ALA 89 H ALA 89 18.949 17.598 13.459 557 HA ALA 89 HA ALA 89 20.728 18.155 11.652 558 HB1 ALA 89 HB1 ALA 89 18.984 17.735 10.376 559 HB2 ALA 89 HB2 ALA 89 18.390 19.451 10.585 560 HB3 ALA 89 HB3 ALA 89 17.906 18.137 11.766 561 H ALA 90 H ALA 90 19.245 20.507 13.515 562 HA ALA 90 HA ALA 90 20.671 22.671 12.154 563 HB1 ALA 90 HB1 ALA 90 19.451 23.686 14.387 564 HB2 ALA 90 HB2 ALA 90 18.314 22.437 13.940 565 HB3 ALA 90 HB3 ALA 90 18.758 23.728 12.783 566 H PHE 91 H PHE 91 22.165 23.996 13.919 567 HA PHE 91 HA PHE 91 23.532 21.801 15.211 568 HB2 PHE 91 HB2 PHE 91 24.378 24.524 14.416 569 HB3 PHE 91 HB3 PHE 91 25.034 23.931 15.950 570 HD1 PHE 91 HD1 PHE 91 25.962 21.410 15.942 571 HD2 PHE 91 HD2 PHE 91 25.410 23.825 12.455 572 HE1 PHE 91 HE1 PHE 91 27.500 19.940 14.668 573 HE2 PHE 91 HE2 PHE 91 26.942 22.360 11.213 574 HZ PHE 91 HZ PHE 91 27.987 20.427 12.310 575 H SER 92 H SER 92 21.869 21.334 16.765 576 HA SER 92 HA SER 92 20.961 21.320 18.862 577 HB2 SER 92 HB2 SER 92 23.437 21.310 19.400 578 HB3 SER 92 HB3 SER 92 23.315 23.045 19.666 579 HG SER 92 HG SER 92 23.094 21.867 21.612 580 H1 ALA 101 H1 ALA 101 -10.312 -1.199 15.635 581 H2 ALA 101 H2 ALA 101 -11.203 -1.791 14.293 582 H3 ALA 101 H3 ALA 101 -9.569 -1.306 14.095 583 HA ALA 101 HA ALA 101 -8.980 -3.039 15.735 584 HB1 ALA 101 HB1 ALA 101 -11.447 -4.500 15.020 585 HB2 ALA 101 HB2 ALA 101 -11.615 -3.219 16.221 586 HB3 ALA 101 HB3 ALA 101 -10.485 -4.544 16.497 587 H VAL 102 H VAL 102 -8.652 -5.314 14.927 588 HA VAL 102 HA VAL 102 -7.829 -6.663 13.353 589 HB VAL 102 HB VAL 102 -9.669 -5.418 11.339 590 HG11 VAL 102 HG11 VAL 102 -9.618 -8.067 10.857 591 HG12 VAL 102 HG12 VAL 102 -8.020 -7.845 11.571 592 HG13 VAL 102 HG13 VAL 102 -8.486 -6.916 10.147 593 HG21 VAL 102 HG21 VAL 102 -10.333 -7.386 13.524 594 HG22 VAL 102 HG22 VAL 102 -11.279 -7.255 12.041 595 HG23 VAL 102 HG23 VAL 102 -11.148 -5.872 13.127 596 H LEU 103 H LEU 103 -6.076 -6.498 12.718 597 HA LEU 103 HA LEU 103 -5.220 -4.858 10.503 598 HB2 LEU 103 HB2 LEU 103 -3.354 -3.924 11.568 599 HB3 LEU 103 HB3 LEU 103 -4.631 -3.651 12.739 600 HG LEU 103 HG LEU 103 -2.861 -6.047 12.912 601 HD11 LEU 103 HD11 LEU 103 -1.210 -4.948 13.874 602 HD12 LEU 103 HD12 LEU 103 -2.247 -3.684 14.545 603 HD13 LEU 103 HD13 LEU 103 -1.761 -3.638 12.841 604 HD21 LEU 103 HD21 LEU 103 -4.543 -4.498 14.843 605 HD22 LEU 103 HD22 LEU 103 -3.391 -5.745 15.322 606 HD23 LEU 103 HD23 LEU 103 -4.767 -6.160 14.306 607 H ASP 104 H ASP 104 -3.806 -6.175 9.312 608 HA ASP 104 HA ASP 104 -4.295 -8.796 9.969 609 HB2 ASP 104 HB2 ASP 104 -2.952 -7.477 7.748 610 HB3 ASP 104 HB3 ASP 104 -2.213 -9.026 8.123 611 H LEU 105 H LEU 105 -3.493 -8.506 12.223 612 HA LEU 105 HA LEU 105 -1.047 -9.749 12.447 613 HB2 LEU 105 HB2 LEU 105 -1.729 -7.113 13.467 614 HB3 LEU 105 HB3 LEU 105 -0.452 -8.090 14.094 615 HG LEU 105 HG LEU 105 -0.666 -7.072 11.288 616 HD11 LEU 105 HD11 LEU 105 -0.194 -5.512 13.270 617 HD12 LEU 105 HD12 LEU 105 0.902 -5.463 11.844 618 HD13 LEU 105 HD13 LEU 105 1.392 -6.328 13.312 619 HD21 LEU 105 HD21 LEU 105 0.637 -9.359 12.101 620 HD22 LEU 105 HD22 LEU 105 1.918 -8.155 12.153 621 HD23 LEU 105 HD23 LEU 105 1.026 -8.430 10.655 622 H ASP 106 H ASP 106 -2.656 -7.872 14.686 623 HA ASP 106 HA ASP 106 -4.207 -9.895 15.934 624 HB2 ASP 106 HB2 ASP 106 -1.465 -9.618 16.481 625 HB3 ASP 106 HB3 ASP 106 -2.355 -9.266 17.967 626 H VAL 107 H VAL 107 -2.409 -6.812 16.837 627 HA VAL 107 HA VAL 107 -5.006 -5.689 17.558 628 HB VAL 107 HB VAL 107 -4.165 -6.708 19.672 629 HG11 VAL 107 HG11 VAL 107 -1.699 -6.162 18.733 630 HG12 VAL 107 HG12 VAL 107 -2.039 -6.518 20.429 631 HG13 VAL 107 HG13 VAL 107 -1.889 -4.844 19.886 632 HG21 VAL 107 HG21 VAL 107 -4.275 -3.728 19.417 633 HG22 VAL 107 HG22 VAL 107 -3.909 -4.470 20.974 634 HG23 VAL 107 HG23 VAL 107 -5.432 -4.832 20.161 635 H ARG 108 H ARG 108 -5.007 -3.863 16.597 636 HA ARG 108 HA ARG 108 -2.774 -2.523 15.596 637 HB2 ARG 108 HB2 ARG 108 -4.637 -0.830 15.045 638 HB3 ARG 108 HB3 ARG 108 -4.753 -2.397 14.277 639 HG2 ARG 108 HG2 ARG 108 -6.898 -2.368 14.963 640 HG3 ARG 108 HG3 ARG 108 -6.270 -2.747 16.563 641 HD2 ARG 108 HD2 ARG 108 -6.135 0.091 16.095 642 HD3 ARG 108 HD3 ARG 108 -7.764 -0.506 15.776 643 HE ARG 108 HE ARG 108 -7.069 -1.655 18.153 644 HH11 ARG 108 HH11 ARG 108 -7.260 1.595 16.959 645 HH12 ARG 108 HH12 ARG 108 -7.666 2.274 18.497 646 HH21 ARG 108 HH21 ARG 108 -7.601 -0.798 20.172 647 HH22 ARG 108 HH22 ARG 108 -7.851 0.907 20.342 648 H THR 109 H THR 109 -1.497 -1.548 17.225 649 HA THR 109 HA THR 109 -3.168 0.246 18.903 650 HB THR 109 HB THR 109 -1.787 -1.163 20.328 651 HG1 THR 109 HG1 THR 109 -1.879 0.892 21.123 652 HG21 THR 109 HG21 THR 109 0.841 -0.297 19.765 653 HG22 THR 109 HG22 THR 109 0.146 -0.926 18.266 654 HG23 THR 109 HG23 THR 109 0.175 -1.926 19.717 655 H CYS 110 H CYS 110 -3.486 1.658 17.480 656 HA CYS 110 HA CYS 110 -1.576 2.623 15.599 657 HB2 CYS 110 HB2 CYS 110 -4.390 3.216 16.321 658 HB3 CYS 110 HB3 CYS 110 -3.522 4.540 15.546 659 H LEU 111 H LEU 111 0.212 3.396 17.143 660 HA LEU 111 HA LEU 111 0.257 5.173 19.143 661 HB2 LEU 111 HB2 LEU 111 2.039 4.764 16.846 662 HB3 LEU 111 HB3 LEU 111 2.187 6.337 17.606 663 HG LEU 111 HG LEU 111 2.973 5.468 19.602 664 HD11 LEU 111 HD11 LEU 111 1.648 2.893 18.804 665 HD12 LEU 111 HD12 LEU 111 1.405 3.860 20.261 666 HD13 LEU 111 HD13 LEU 111 2.896 2.941 20.048 667 HD21 LEU 111 HD21 LEU 111 4.835 5.110 18.421 668 HD22 LEU 111 HD22 LEU 111 4.000 4.185 17.170 669 HD23 LEU 111 HD23 LEU 111 4.466 3.407 18.685 670 HA PRO 112 HA PRO 112 -2.036 8.694 17.478 671 HB2 PRO 112 HB2 PRO 112 -2.388 9.978 19.810 672 HB3 PRO 112 HB3 PRO 112 -3.328 8.544 19.381 673 HG2 PRO 112 HG2 PRO 112 -0.917 8.768 21.149 674 HG3 PRO 112 HG3 PRO 112 -2.413 7.856 21.417 675 HD2 PRO 112 HD2 PRO 112 -0.128 6.699 20.516 676 HD3 PRO 112 HD3 PRO 112 -1.745 6.116 20.076 677 H CYS 113 H CYS 113 -0.937 10.268 16.377 678 HA CYS 113 HA CYS 113 0.890 11.916 17.973 679 HB2 CYS 113 HB2 CYS 113 2.620 11.890 16.441 680 HB3 CYS 113 HB3 CYS 113 2.084 10.218 16.486 681 H GLY 114 H GLY 114 1.630 13.869 16.405 682 HA2 GLY 114 HA2 GLY 114 0.969 15.755 15.218 683 HA3 GLY 114 HA3 GLY 114 -0.511 14.918 14.780 684 HA PRO 115 HA PRO 115 -1.705 18.301 17.802 685 HB2 PRO 115 HB2 PRO 115 -3.903 19.036 16.474 686 HB3 PRO 115 HB3 PRO 115 -2.299 19.512 15.858 687 HG2 PRO 115 HG2 PRO 115 -3.763 16.972 15.299 688 HG3 PRO 115 HG3 PRO 115 -3.461 18.267 14.086 689 HD2 PRO 115 HD2 PRO 115 -1.719 16.357 14.169 690 HD3 PRO 115 HD3 PRO 115 -1.049 17.996 14.433 691 H GLY 116 H GLY 116 -2.238 16.843 19.370 692 HA2 GLY 116 HA2 GLY 116 -3.881 16.070 20.865 693 HA3 GLY 116 HA3 GLY 116 -4.999 16.028 19.517 694 H GLY 117 H GLY 117 -2.189 14.601 18.580 695 HA2 GLY 117 HA2 GLY 117 -1.450 12.467 18.442 696 HA3 GLY 117 HA3 GLY 117 -2.477 12.151 19.789 697 H LYS 118 H LYS 118 -3.347 13.215 16.592 698 HA LYS 118 HA LYS 118 -5.244 11.024 16.430 699 HB2 LYS 118 HB2 LYS 118 -4.994 13.156 14.363 700 HB3 LYS 118 HB3 LYS 118 -6.436 12.358 14.987 701 HG2 LYS 118 HG2 LYS 118 -5.542 13.603 17.223 702 HG3 LYS 118 HG3 LYS 118 -5.021 14.744 15.980 703 HD2 LYS 118 HD2 LYS 118 -7.592 14.058 15.248 704 HD3 LYS 118 HD3 LYS 118 -7.640 14.134 17.015 705 HE2 LYS 118 HE2 LYS 118 -7.474 16.364 17.028 706 HE3 LYS 118 HE3 LYS 118 -6.146 16.340 15.871 707 HZ1 LYS 118 HZ1 LYS 118 -7.658 17.352 14.576 708 HZ2 LYS 118 HZ2 LYS 118 -8.984 16.731 15.420 709 HZ3 LYS 118 HZ3 LYS 118 -8.194 15.775 14.270 710 H GLY 119 H GLY 119 -2.249 12.064 15.063 711 HA2 GLY 119 HA2 GLY 119 -2.434 10.457 12.702 712 HA3 GLY 119 HA3 GLY 119 -1.009 11.300 13.280 713 H ARG 120 H ARG 120 -0.562 8.939 12.245 714 HA ARG 120 HA ARG 120 -0.215 7.168 14.574 715 HB2 ARG 120 HB2 ARG 120 -1.089 6.709 11.811 716 HB3 ARG 120 HB3 ARG 120 0.016 5.501 12.453 717 HG2 ARG 120 HG2 ARG 120 -1.883 4.519 13.131 718 HG3 ARG 120 HG3 ARG 120 -1.785 5.676 14.466 719 HD2 ARG 120 HD2 ARG 120 -3.917 6.100 13.765 720 HD3 ARG 120 HD3 ARG 120 -3.037 7.224 12.730 721 HE ARG 120 HE ARG 120 -3.225 4.807 11.359 722 HH11 ARG 120 HH11 ARG 120 -5.343 7.311 12.545 723 HH12 ARG 120 HH12 ARG 120 -6.547 7.047 11.329 724 HH21 ARG 120 HH21 ARG 120 -4.809 4.467 9.743 725 HH22 ARG 120 HH22 ARG 120 -6.245 5.434 9.742 726 H CYS 121 H CYS 121 1.804 6.095 14.765 727 HA CYS 121 HA CYS 121 3.935 7.472 13.262 728 HB2 CYS 121 HB2 CYS 121 3.968 5.822 15.787 729 HB3 CYS 121 HB3 CYS 121 5.448 6.262 14.947 730 H PHE 122 H PHE 122 5.027 6.557 11.732 731 HA PHE 122 HA PHE 122 4.721 3.667 11.234 732 HB2 PHE 122 HB2 PHE 122 5.041 6.054 9.424 733 HB3 PHE 122 HB3 PHE 122 5.443 4.438 8.855 734 HD1 PHE 122 HD1 PHE 122 2.668 5.622 11.044 735 HD2 PHE 122 HD2 PHE 122 3.794 3.838 7.339 736 HE1 PHE 122 HE1 PHE 122 0.304 5.156 10.551 737 HE2 PHE 122 HE2 PHE 122 1.424 3.387 6.834 738 HZ PHE 122 HZ PHE 122 -0.323 4.043 8.446 739 H GLY 123 H GLY 123 7.017 6.260 11.637 740 HA2 GLY 123 HA2 GLY 123 9.179 4.351 11.911 741 HA3 GLY 123 HA3 GLY 123 9.334 5.441 10.542 742 HA PRO 124 HA PRO 124 11.377 7.191 14.434 743 HB2 PRO 124 HB2 PRO 124 13.276 7.970 12.275 744 HB3 PRO 124 HB3 PRO 124 13.604 7.380 13.908 745 HG2 PRO 124 HG2 PRO 124 13.901 5.778 11.798 746 HG3 PRO 124 HG3 PRO 124 13.240 5.165 13.325 747 HD2 PRO 124 HD2 PRO 124 11.834 5.826 10.779 748 HD3 PRO 124 HD3 PRO 124 11.504 4.537 11.954 749 H SER 125 H SER 125 11.450 8.766 11.184 750 HA SER 125 HA SER 125 10.343 11.186 12.472 751 HB2 SER 125 HB2 SER 125 12.626 10.906 10.594 752 HB3 SER 125 HB3 SER 125 11.542 12.286 10.244 753 HG SER 125 HG SER 125 12.313 13.234 11.963 754 H ILE 126 H ILE 126 8.770 9.089 11.352 755 HA ILE 126 HA ILE 126 7.487 10.644 9.259 756 HB ILE 126 HB ILE 126 7.856 7.669 8.997 757 HG12 ILE 126 HG12 ILE 126 9.391 9.929 7.712 758 HG13 ILE 126 HG13 ILE 126 10.028 8.789 8.887 759 HG21 ILE 126 HG21 ILE 126 5.982 8.342 7.780 760 HG22 ILE 126 HG22 ILE 126 7.285 8.321 6.591 761 HG23 ILE 126 HG23 ILE 126 6.742 9.851 7.280 762 HD11 ILE 126 HD11 ILE 126 10.588 8.427 6.433 763 HD12 ILE 126 HD12 ILE 126 8.923 7.873 6.261 764 HD13 ILE 126 HD13 ILE 126 10.024 7.037 7.357 765 H CYS 127 H CYS 127 5.527 11.116 10.054 766 HA CYS 127 HA CYS 127 3.984 8.925 11.308 767 HB2 CYS 127 HB2 CYS 127 4.855 11.091 12.723 768 HB3 CYS 127 HB3 CYS 127 3.303 11.667 12.143 769 H CYS 128 H CYS 128 2.195 8.483 10.108 770 HA CYS 128 HA CYS 128 0.948 10.753 8.724 771 HB2 CYS 128 HB2 CYS 128 0.657 8.196 7.313 772 HB3 CYS 128 HB3 CYS 128 1.045 9.791 6.673 773 H GLY 129 H GLY 129 -1.266 10.975 9.060 774 HA2 GLY 129 HA2 GLY 129 -2.563 8.701 10.292 775 HA3 GLY 129 HA3 GLY 129 -3.070 10.381 10.451 776 H ASP 130 H ASP 130 -5.122 9.312 9.890 777 HA ASP 130 HA ASP 130 -5.579 8.349 7.294 778 HB2 ASP 130 HB2 ASP 130 -6.966 7.765 9.258 779 HB3 ASP 130 HB3 ASP 130 -7.606 9.412 9.268 780 H GLU 131 H GLU 131 -6.369 11.426 8.775 781 HA GLU 131 HA GLU 131 -6.579 12.666 6.132 782 HB2 GLU 131 HB2 GLU 131 -8.157 14.114 8.069 783 HB3 GLU 131 HB3 GLU 131 -8.676 13.420 6.540 784 HG2 GLU 131 HG2 GLU 131 -8.902 11.251 7.706 785 HG3 GLU 131 HG3 GLU 131 -8.627 12.104 9.225 786 H LEU 132 H LEU 132 -4.379 12.377 8.053 787 HA LEU 132 HA LEU 132 -3.915 15.199 8.463 788 HB2 LEU 132 HB2 LEU 132 -3.847 12.921 10.246 789 HB3 LEU 132 HB3 LEU 132 -2.403 13.869 10.250 790 HG LEU 132 HG LEU 132 -5.131 15.055 10.621 791 HD11 LEU 132 HD11 LEU 132 -4.883 13.468 12.356 792 HD12 LEU 132 HD12 LEU 132 -4.681 15.080 13.036 793 HD13 LEU 132 HD13 LEU 132 -3.271 14.058 12.746 794 HD21 LEU 132 HD21 LEU 132 -4.169 17.037 11.178 795 HD22 LEU 132 HD22 LEU 132 -2.968 16.430 10.040 796 HD23 LEU 132 HD23 LEU 132 -2.685 16.285 11.774 797 H GLY 133 H GLY 133 -3.268 12.306 6.881 798 HA2 GLY 133 HA2 GLY 133 -1.667 11.722 5.403 799 HA3 GLY 133 HA3 GLY 133 -1.233 13.391 5.407 800 H CYS 134 H CYS 134 1.002 13.312 5.460 801 HA CYS 134 HA CYS 134 2.116 11.945 7.805 802 HB2 CYS 134 HB2 CYS 134 2.345 10.772 5.480 803 HB3 CYS 134 HB3 CYS 134 3.695 11.877 5.328 804 H PHE 135 H PHE 135 3.401 13.004 9.011 805 HA PHE 135 HA PHE 135 4.592 15.489 8.007 806 HB2 PHE 135 HB2 PHE 135 4.373 14.378 10.810 807 HB3 PHE 135 HB3 PHE 135 4.888 16.006 10.388 808 HD1 PHE 135 HD1 PHE 135 1.989 13.707 10.014 809 HD2 PHE 135 HD2 PHE 135 3.349 17.698 10.542 810 HE1 PHE 135 HE1 PHE 135 -0.340 14.463 10.199 811 HE2 PHE 135 HE2 PHE 135 1.022 18.471 10.725 812 HZ PHE 135 HZ PHE 135 -0.829 16.855 10.539 813 H VAL 136 H VAL 136 6.405 14.731 6.938 814 HA VAL 136 HA VAL 136 7.872 12.564 8.109 815 HB VAL 136 HB VAL 136 8.565 14.121 5.625 816 HG11 VAL 136 HG11 VAL 136 10.477 13.002 6.396 817 HG12 VAL 136 HG12 VAL 136 9.827 12.023 5.083 818 HG13 VAL 136 HG13 VAL 136 9.571 11.533 6.758 819 HG21 VAL 136 HG21 VAL 136 6.346 13.158 5.439 820 HG22 VAL 136 HG22 VAL 136 6.960 11.573 5.895 821 HG23 VAL 136 HG23 VAL 136 7.455 12.304 4.366 822 H GLY 137 H GLY 137 8.615 13.190 9.889 823 HA2 GLY 137 HA2 GLY 137 10.295 13.900 11.302 824 HA3 GLY 137 HA3 GLY 137 11.085 14.654 9.933 825 H THR 138 H THR 138 8.641 15.026 12.402 826 HA THR 138 HA THR 138 9.085 17.892 12.358 827 HB THR 138 HB THR 138 6.783 18.454 12.074 828 HG1 THR 138 HG1 THR 138 5.194 17.022 12.237 829 HG21 THR 138 HG21 THR 138 7.956 17.937 9.967 830 HG22 THR 138 HG22 THR 138 6.223 17.614 9.891 831 HG23 THR 138 HG23 THR 138 7.361 16.280 10.076 832 H ALA 139 H ALA 139 7.826 18.949 14.187 833 HA ALA 139 HA ALA 139 8.504 17.800 16.630 834 HB1 ALA 139 HB1 ALA 139 7.681 20.244 15.875 835 HB2 ALA 139 HB2 ALA 139 7.703 19.706 17.554 836 HB3 ALA 139 HB3 ALA 139 6.200 19.655 16.632 837 H GLU 140 H GLU 140 5.679 17.397 14.651 838 HA GLU 140 HA GLU 140 3.982 16.307 16.664 839 HB2 GLU 140 HB2 GLU 140 3.890 16.368 13.660 840 HB3 GLU 140 HB3 GLU 140 2.694 15.481 14.594 841 HG2 GLU 140 HG2 GLU 140 1.599 17.455 14.406 842 HG3 GLU 140 HG3 GLU 140 2.522 17.799 15.868 843 H ALA 141 H ALA 141 6.368 14.918 14.519 844 HA ALA 141 HA ALA 141 5.521 12.214 15.189 845 HB1 ALA 141 HB1 ALA 141 6.056 12.916 12.809 846 HB2 ALA 141 HB2 ALA 141 6.868 11.463 13.393 847 HB3 ALA 141 HB3 ALA 141 7.744 12.992 13.313 848 H LEU 142 H LEU 142 7.402 14.554 16.512 849 HA LEU 142 HA LEU 142 9.820 13.302 17.089 850 HB2 LEU 142 HB2 LEU 142 8.324 15.594 18.017 851 HB3 LEU 142 HB3 LEU 142 9.141 14.803 19.353 852 HG LEU 142 HG LEU 142 10.550 15.602 16.819 853 HD11 LEU 142 HD11 LEU 142 10.332 17.724 17.450 854 HD12 LEU 142 HD12 LEU 142 11.359 17.331 18.828 855 HD13 LEU 142 HD13 LEU 142 9.604 17.269 18.991 856 HD21 LEU 142 HD21 LEU 142 11.459 13.839 18.466 857 HD22 LEU 142 HD22 LEU 142 11.760 15.216 19.527 858 HD23 LEU 142 HD23 LEU 142 12.526 15.142 17.941 859 H ARG 143 H ARG 143 6.650 12.962 18.495 860 HA ARG 143 HA ARG 143 7.498 11.471 20.769 861 HB2 ARG 143 HB2 ARG 143 5.133 10.948 21.067 862 HB3 ARG 143 HB3 ARG 143 5.365 12.662 20.754 863 HG2 ARG 143 HG2 ARG 143 4.940 11.799 18.247 864 HG3 ARG 143 HG3 ARG 143 3.996 10.609 19.144 865 HD2 ARG 143 HD2 ARG 143 3.731 13.562 19.630 866 HD3 ARG 143 HD3 ARG 143 2.796 12.730 18.393 867 HE ARG 143 HE ARG 143 1.647 11.554 20.077 868 HH11 ARG 143 HH11 ARG 143 3.931 13.849 21.401 869 HH12 ARG 143 HH12 ARG 143 3.205 13.844 22.972 870 HH21 ARG 143 HH21 ARG 143 0.704 11.552 22.143 871 HH22 ARG 143 HH22 ARG 143 1.379 12.542 23.394 872 H CYS 144 H CYS 144 7.397 10.726 17.471 873 HA CYS 144 HA CYS 144 6.549 8.008 17.671 874 HB2 CYS 144 HB2 CYS 144 8.211 9.419 15.594 875 HB3 CYS 144 HB3 CYS 144 7.721 7.736 15.458 876 H GLN 145 H GLN 145 9.324 9.516 18.799 877 HA GLN 145 HA GLN 145 11.362 7.699 18.308 878 HB2 GLN 145 HB2 GLN 145 11.222 10.005 19.665 879 HB3 GLN 145 HB3 GLN 145 11.197 8.895 21.030 880 HG2 GLN 145 HG2 GLN 145 13.318 8.110 20.602 881 HG3 GLN 145 HG3 GLN 145 13.272 8.596 18.909 882 HE21 GLN 145 HE21 GLN 145 14.466 10.295 18.427 883 HE22 GLN 145 HE22 GLN 145 14.924 11.560 19.509 884 H GLU 146 H GLU 146 8.577 7.414 20.360 885 HA GLU 146 HA GLU 146 9.649 5.178 21.858 886 HB2 GLU 146 HB2 GLU 146 7.075 6.692 21.856 887 HB3 GLU 146 HB3 GLU 146 7.088 5.066 22.519 888 HG2 GLU 146 HG2 GLU 146 8.493 5.652 24.265 889 HG3 GLU 146 HG3 GLU 146 9.060 7.112 23.451 890 H GLU 147 H GLU 147 8.742 5.437 18.763 891 HA GLU 147 HA GLU 147 6.965 3.168 18.608 892 HB2 GLU 147 HB2 GLU 147 7.218 5.187 16.948 893 HB3 GLU 147 HB3 GLU 147 8.549 4.241 16.299 894 HG2 GLU 147 HG2 GLU 147 6.432 2.451 16.503 895 HG3 GLU 147 HG3 GLU 147 5.720 3.942 15.891 896 H ASN 148 H ASN 148 10.242 3.629 19.161 897 HA ASN 148 HA ASN 148 11.247 1.379 17.695 898 HB2 ASN 148 HB2 ASN 148 12.325 3.468 19.346 899 HB3 ASN 148 HB3 ASN 148 12.920 1.916 19.916 900 HD21 ASN 148 HD21 ASN 148 13.939 4.336 18.272 901 HD22 ASN 148 HD22 ASN 148 14.824 3.584 16.994 902 H TYR 149 H TYR 149 9.739 1.960 20.772 903 HA TYR 149 HA TYR 149 10.410 -0.641 21.873 904 HB2 TYR 149 HB2 TYR 149 9.305 1.859 22.832 905 HB3 TYR 149 HB3 TYR 149 8.316 0.505 23.362 906 HD1 TYR 149 HD1 TYR 149 12.002 0.885 22.912 907 HD2 TYR 149 HD2 TYR 149 8.786 0.075 25.579 908 HE1 TYR 149 HE1 TYR 149 13.614 0.408 24.706 909 HE2 TYR 149 HE2 TYR 149 10.389 -0.401 27.379 910 HH TYR 149 HH TYR 149 13.612 -0.965 26.861 911 H LEU 150 H LEU 150 8.439 0.133 19.418 912 HA LEU 150 HA LEU 150 6.511 -1.989 20.078 913 HB2 LEU 150 HB2 LEU 150 5.918 0.756 18.990 914 HB3 LEU 150 HB3 LEU 150 4.825 -0.588 18.727 915 HG LEU 150 HG LEU 150 5.176 -0.695 21.437 916 HD11 LEU 150 HD11 LEU 150 6.222 1.218 22.000 917 HD12 LEU 150 HD12 LEU 150 4.597 1.889 21.868 918 HD13 LEU 150 HD13 LEU 150 5.730 2.054 20.527 919 HD21 LEU 150 HD21 LEU 150 2.960 0.647 21.458 920 HD22 LEU 150 HD22 LEU 150 3.013 -0.911 20.634 921 HD23 LEU 150 HD23 LEU 150 3.098 0.583 19.701 922 HA PRO 151 HA PRO 151 8.301 -2.911 15.995 923 HB2 PRO 151 HB2 PRO 151 8.568 -5.546 16.331 924 HB3 PRO 151 HB3 PRO 151 9.669 -4.409 17.119 925 HG2 PRO 151 HG2 PRO 151 7.355 -5.909 18.267 926 HG3 PRO 151 HG3 PRO 151 8.932 -5.550 18.991 927 HD2 PRO 151 HD2 PRO 151 6.578 -4.140 19.463 928 HD3 PRO 151 HD3 PRO 151 8.218 -3.544 19.788 929 H SER 152 H SER 152 5.379 -2.687 16.715 930 HA SER 152 HA SER 152 4.405 -4.488 14.620 931 HB2 SER 152 HB2 SER 152 2.472 -5.109 15.855 932 HB3 SER 152 HB3 SER 152 3.829 -5.326 16.962 933 HG SER 152 HG SER 152 3.307 -3.187 17.766 934 HA PRO 153 HA PRO 153 2.950 -0.459 13.284 935 HB2 PRO 153 HB2 PRO 153 1.867 -1.289 10.938 936 HB3 PRO 153 HB3 PRO 153 3.607 -1.063 11.152 937 HG2 PRO 153 HG2 PRO 153 1.998 -3.585 11.258 938 HG3 PRO 153 HG3 PRO 153 3.557 -3.286 10.466 939 HD2 PRO 153 HD2 PRO 153 3.371 -4.515 12.867 940 HD3 PRO 153 HD3 PRO 153 4.739 -3.467 12.441 941 H CYS 154 H CYS 154 0.694 -0.044 11.945 942 HA CYS 154 HA CYS 154 -1.439 -1.335 13.514 943 HB2 CYS 154 HB2 CYS 154 -0.743 1.152 14.052 944 HB3 CYS 154 HB3 CYS 154 -1.638 1.510 12.581 945 H GLN 155 H GLN 155 -1.990 -2.829 11.696 946 HA GLN 155 HA GLN 155 -2.911 -3.266 9.632 947 HB2 GLN 155 HB2 GLN 155 -4.764 -1.962 10.691 948 HB3 GLN 155 HB3 GLN 155 -4.141 -0.516 9.915 949 HG2 GLN 155 HG2 GLN 155 -4.417 -1.809 7.719 950 HG3 GLN 155 HG3 GLN 155 -5.418 -2.915 8.662 951 HE21 GLN 155 HE21 GLN 155 -7.490 -2.477 8.705 952 HE22 GLN 155 HE22 GLN 155 -8.211 -0.931 8.430 953 H SER 156 H SER 156 -3.065 0.078 8.665 954 HA SER 156 HA SER 156 -1.623 1.431 7.469 955 HB2 SER 156 HB2 SER 156 0.251 -0.196 8.290 956 HB3 SER 156 HB3 SER 156 0.114 -0.881 6.668 957 HG SER 156 HG SER 156 1.552 1.127 7.266 958 H GLY 157 H GLY 157 -1.919 2.067 5.382 959 HA2 GLY 157 HA2 GLY 157 -3.777 0.649 3.816 960 HA3 GLY 157 HA3 GLY 157 -2.810 2.020 3.269 961 H GLN 158 H GLN 158 -3.468 -1.054 2.644 962 HA GLN 158 HA GLN 158 -0.854 -2.069 2.016 963 HB2 GLN 158 HB2 GLN 158 -3.453 -3.118 2.345 964 HB3 GLN 158 HB3 GLN 158 -3.038 -3.425 0.668 965 HG2 GLN 158 HG2 GLN 158 -1.887 -5.194 1.299 966 HG3 GLN 158 HG3 GLN 158 -0.795 -4.155 2.211 967 HE21 GLN 158 HE21 GLN 158 -3.844 -5.938 2.420 968 HE22 GLN 158 HE22 GLN 158 -3.764 -6.226 4.122 969 H LYS 159 H LYS 159 -0.742 0.174 0.831 970 HA LYS 159 HA LYS 159 -1.294 -0.374 -1.992 971 HB2 LYS 159 HB2 LYS 159 -1.469 2.124 -0.435 972 HB3 LYS 159 HB3 LYS 159 -0.940 2.238 -2.115 973 HG2 LYS 159 HG2 LYS 159 -3.141 2.303 -2.560 974 HG3 LYS 159 HG3 LYS 159 -3.059 0.552 -2.333 975 HD2 LYS 159 HD2 LYS 159 -3.549 0.927 0.083 976 HD3 LYS 159 HD3 LYS 159 -3.820 2.628 -0.294 977 HE2 LYS 159 HE2 LYS 159 -5.872 1.134 -0.173 978 HE3 LYS 159 HE3 LYS 159 -5.698 2.162 -1.592 979 HZ1 LYS 159 HZ1 LYS 159 -5.121 0.359 -2.922 980 HZ2 LYS 159 HZ2 LYS 159 -6.385 -0.232 -1.966 981 HZ3 LYS 159 HZ3 LYS 159 -4.787 -0.647 -1.601 982 HA PRO 160 HA PRO 160 3.316 -0.012 -1.054 983 HB2 PRO 160 HB2 PRO 160 4.100 -2.355 -2.278 984 HB3 PRO 160 HB3 PRO 160 3.777 -2.216 -0.544 985 HG2 PRO 160 HG2 PRO 160 1.965 -3.164 -2.746 986 HG3 PRO 160 HG3 PRO 160 2.232 -3.881 -1.146 987 HD2 PRO 160 HD2 PRO 160 0.071 -2.387 -1.622 988 HD3 PRO 160 HD3 PRO 160 0.936 -2.223 -0.073 989 H CYS 161 H CYS 161 3.083 1.662 -2.623 990 HA CYS 161 HA CYS 161 3.616 0.873 -5.411 991 HB2 CYS 161 HB2 CYS 161 2.383 2.675 -6.113 992 HB3 CYS 161 HB3 CYS 161 1.612 2.417 -4.556 993 H GLY 162 H GLY 162 4.919 2.923 -6.522 994 HA2 GLY 162 HA2 GLY 162 6.925 4.089 -6.540 995 HA3 GLY 162 HA3 GLY 162 6.741 4.245 -4.794 996 H SER 163 H SER 163 9.097 3.974 -4.755 997 HA SER 163 HA SER 163 10.208 1.452 -5.552 998 HB2 SER 163 HB2 SER 163 11.298 3.813 -4.013 999 HB3 SER 163 HB3 SER 163 12.243 2.352 -4.303 1000 HG SER 163 HG SER 163 12.123 4.342 -5.888 1001 H GLY 164 H GLY 164 8.077 0.945 -3.825 1002 HA2 GLY 164 HA2 GLY 164 8.064 -0.899 -2.277 1003 HA3 GLY 164 HA3 GLY 164 9.526 -0.252 -1.557 1004 H GLY 165 H GLY 165 7.087 2.112 -2.184 1005 HA2 GLY 165 HA2 GLY 165 6.563 2.208 0.709 1006 HA3 GLY 165 HA3 GLY 165 6.403 3.542 -0.406 1007 H ARG 166 H ARG 166 4.653 1.968 1.598 1008 HA ARG 166 HA ARG 166 2.371 1.429 -0.119 1009 HB2 ARG 166 HB2 ARG 166 1.254 0.725 2.047 1010 HB3 ARG 166 HB3 ARG 166 2.562 -0.301 1.443 1011 HG2 ARG 166 HG2 ARG 166 3.310 1.868 3.325 1012 HG3 ARG 166 HG3 ARG 166 2.414 0.504 3.995 1013 HD2 ARG 166 HD2 ARG 166 4.929 0.280 2.360 1014 HD3 ARG 166 HD3 ARG 166 4.880 0.257 4.124 1015 HE ARG 166 HE ARG 166 3.122 -1.679 3.087 1016 HH11 ARG 166 HH11 ARG 166 6.527 -1.024 3.461 1017 HH12 ARG 166 HH12 ARG 166 6.970 -2.698 3.508 1018 HH21 ARG 166 HH21 ARG 166 3.673 -3.859 3.162 1019 HH22 ARG 166 HH22 ARG 166 5.333 -4.323 3.334 1020 H CYS 167 H CYS 167 0.192 2.328 0.494 1021 HA CYS 167 HA CYS 167 0.491 5.108 0.843 1022 HB2 CYS 167 HB2 CYS 167 -1.296 3.932 -0.505 1023 HB3 CYS 167 HB3 CYS 167 -2.060 3.521 1.022 1024 H ALA 168 H ALA 168 1.086 5.850 2.784 1025 HA ALA 168 HA ALA 168 0.083 4.546 5.193 1026 HB1 ALA 168 HB1 ALA 168 1.719 5.924 6.409 1027 HB2 ALA 168 HB2 ALA 168 2.109 6.794 4.922 1028 HB3 ALA 168 HB3 ALA 168 2.492 5.076 5.067 1029 H ALA 169 H ALA 169 -0.502 7.236 3.229 1030 HA ALA 169 HA ALA 169 -2.746 8.119 4.875 1031 HB1 ALA 169 HB1 ALA 169 -0.764 10.324 4.568 1032 HB2 ALA 169 HB2 ALA 169 -0.513 9.150 5.859 1033 HB3 ALA 169 HB3 ALA 169 -2.013 10.071 5.785 1034 H ALA 170 H ALA 170 -3.923 10.119 3.732 1035 HA ALA 170 HA ALA 170 -4.369 9.546 1.099 1036 HB1 ALA 170 HB1 ALA 170 -5.133 11.917 0.637 1037 HB2 ALA 170 HB2 ALA 170 -4.757 12.241 2.373 1038 HB3 ALA 170 HB3 ALA 170 -5.958 11.011 1.934 1039 H GLY 171 H GLY 171 -3.378 9.628 -0.657 1040 HA2 GLY 171 HA2 GLY 171 -2.022 10.200 -2.400 1041 HA3 GLY 171 HA3 GLY 171 -2.077 11.829 -1.728 1042 H ILE 172 H ILE 172 -0.648 9.174 0.082 1043 HA ILE 172 HA ILE 172 2.033 10.115 -0.685 1044 HB ILE 172 HB ILE 172 2.724 10.261 1.578 1045 HG12 ILE 172 HG12 ILE 172 0.096 10.635 2.751 1046 HG13 ILE 172 HG13 ILE 172 0.358 8.958 2.211 1047 HG21 ILE 172 HG21 ILE 172 2.061 12.461 1.813 1048 HG22 ILE 172 HG22 ILE 172 0.412 12.130 1.284 1049 HG23 ILE 172 HG23 ILE 172 1.724 12.161 0.107 1050 HD11 ILE 172 HD11 ILE 172 2.480 10.458 3.540 1051 HD12 ILE 172 HD12 ILE 172 2.177 8.704 3.533 1052 HD13 ILE 172 HD13 ILE 172 1.173 9.770 4.540 1053 H CYS 173 H CYS 173 3.023 8.423 -1.320 1054 HA CYS 173 HA CYS 173 2.477 5.821 -0.141 1055 HB2 CYS 173 HB2 CYS 173 3.176 6.763 -2.723 1056 HB3 CYS 173 HB3 CYS 173 4.514 5.796 -2.144 1057 H CYS 174 H CYS 174 3.513 5.933 1.811 1058 HA CYS 174 HA CYS 174 6.347 6.607 1.742 1059 HB2 CYS 174 HB2 CYS 174 4.602 6.256 4.173 1060 HB3 CYS 174 HB3 CYS 174 6.238 6.902 4.129 1061 H SER 175 H SER 175 7.908 5.352 2.613 1062 HA SER 175 HA SER 175 7.223 2.517 3.058 1063 HB2 SER 175 HB2 SER 175 9.940 2.962 2.080 1064 HB3 SER 175 HB3 SER 175 8.703 1.859 1.480 1065 HG SER 175 HG SER 175 9.279 4.487 0.714 1066 HA PRO 176 HA PRO 176 9.682 2.722 6.695 1067 HB2 PRO 176 HB2 PRO 176 11.505 0.725 6.616 1068 HB3 PRO 176 HB3 PRO 176 9.771 0.442 6.801 1069 HG2 PRO 176 HG2 PRO 176 11.481 0.201 4.370 1070 HG3 PRO 176 HG3 PRO 176 10.150 -0.835 4.914 1071 HD2 PRO 176 HD2 PRO 176 9.907 1.076 2.962 1072 HD3 PRO 176 HD3 PRO 176 8.558 0.511 3.964 1073 H ASP 177 H ASP 177 10.684 4.376 4.470 1074 HA ASP 177 HA ASP 177 13.247 5.039 5.654 1075 HB2 ASP 177 HB2 ASP 177 12.912 4.064 2.858 1076 HB3 ASP 177 HB3 ASP 177 14.056 5.373 3.152 1077 H GLY 178 H GLY 178 10.932 5.859 3.068 1078 HA2 GLY 178 HA2 GLY 178 10.960 8.603 4.036 1079 HA3 GLY 178 HA3 GLY 178 11.327 8.358 2.359 1080 H CYS 179 H CYS 179 9.616 9.571 1.691 1081 HA CYS 179 HA CYS 179 6.999 8.239 1.754 1082 HB2 CYS 179 HB2 CYS 179 7.633 11.022 2.652 1083 HB3 CYS 179 HB3 CYS 179 6.102 10.731 1.831 1084 H HIS 180 H HIS 180 5.675 8.637 -0.184 1085 HA HIS 180 HA HIS 180 6.994 10.287 -2.250 1086 HB2 HIS 180 HB2 HIS 180 7.305 7.497 -2.094 1087 HB3 HIS 180 HB3 HIS 180 6.123 7.759 -3.369 1088 HD1 HIS 180 HD1 HIS 180 9.678 7.784 -2.698 1089 HD2 HIS 180 HD2 HIS 180 7.126 9.543 -5.456 1090 HE1 HIS 180 HE1 HIS 180 11.150 8.509 -4.599 1091 HE2 HIS 180 HE2 HIS 180 9.566 9.465 -6.308 1092 H GLU 181 H GLU 181 5.581 11.028 -3.842 1093 HA GLU 181 HA GLU 181 2.831 11.024 -3.142 1094 HB2 GLU 181 HB2 GLU 181 4.324 12.023 -5.554 1095 HB3 GLU 181 HB3 GLU 181 2.571 12.137 -5.421 1096 HG2 GLU 181 HG2 GLU 181 2.745 13.479 -3.447 1097 HG3 GLU 181 HG3 GLU 181 4.493 13.260 -3.405 1098 H ASP 182 H ASP 182 1.106 10.010 -4.128 1099 HA ASP 182 HA ASP 182 1.688 7.977 -6.144 1100 HB2 ASP 182 HB2 ASP 182 1.017 6.153 -4.807 1101 HB3 ASP 182 HB3 ASP 182 2.025 7.132 -3.716 1102 HA PRO 183 HA PRO 183 -2.170 9.814 -7.534 1103 HB2 PRO 183 HB2 PRO 183 -2.197 7.527 -9.406 1104 HB3 PRO 183 HB3 PRO 183 -2.260 9.259 -9.729 1105 HG2 PRO 183 HG2 PRO 183 -0.050 7.834 -10.222 1106 HG3 PRO 183 HG3 PRO 183 0.035 9.502 -9.629 1107 HD2 PRO 183 HD2 PRO 183 0.444 6.937 -8.146 1108 HD3 PRO 183 HD3 PRO 183 1.301 8.485 -7.991 1109 H ALA 184 H ALA 184 -1.825 6.600 -6.331 1110 HA ALA 184 HA ALA 184 -4.490 5.736 -6.708 1111 HB1 ALA 184 HB1 ALA 184 -2.251 4.497 -5.926 1112 HB2 ALA 184 HB2 ALA 184 -3.865 3.849 -5.635 1113 HB3 ALA 184 HB3 ALA 184 -3.024 4.727 -4.357 1114 H CYS 185 H CYS 185 -2.866 7.314 -3.989 1115 HA CYS 185 HA CYS 185 -5.491 7.663 -2.702 1116 HB2 CYS 185 HB2 CYS 185 -2.805 8.080 -1.409 1117 HB3 CYS 185 HB3 CYS 185 -4.366 7.900 -0.624 1118 H ASP 186 H ASP 186 -4.448 9.241 -4.940 1119 HA ASP 186 HA ASP 186 -3.810 11.856 -3.758 1120 HB2 ASP 186 HB2 ASP 186 -2.780 10.923 -5.847 1121 HB3 ASP 186 HB3 ASP 186 -4.367 11.100 -6.557 1122 HA PRO 187 HA PRO 187 -8.096 12.805 -5.911 1123 HB2 PRO 187 HB2 PRO 187 -9.519 10.412 -5.295 1124 HB3 PRO 187 HB3 PRO 187 -9.275 11.175 -6.878 1125 HG2 PRO 187 HG2 PRO 187 -8.135 8.763 -5.894 1126 HG3 PRO 187 HG3 PRO 187 -7.837 9.528 -7.464 1127 HD2 PRO 187 HD2 PRO 187 -6.117 9.325 -5.223 1128 HD3 PRO 187 HD3 PRO 187 -5.769 10.149 -6.718 1129 H GLU 188 H GLU 188 -9.317 13.775 -4.186 1130 HA GLU 188 HA GLU 188 -8.947 13.960 -1.723 1131 HB2 GLU 188 HB2 GLU 188 -11.499 12.638 -2.582 1132 HB3 GLU 188 HB3 GLU 188 -11.249 13.623 -1.148 1133 HG2 GLU 188 HG2 GLU 188 -10.673 14.829 -3.787 1134 HG3 GLU 188 HG3 GLU 188 -12.340 14.584 -3.318 1135 H ALA 189 H ALA 189 -7.362 12.317 -1.573 1136 HA ALA 189 HA ALA 189 -7.473 9.752 -2.074 1137 HB1 ALA 189 HB1 ALA 189 -5.544 10.877 -1.151 1138 HB2 ALA 189 HB2 ALA 189 -5.894 9.384 -0.170 1139 HB3 ALA 189 HB3 ALA 189 -6.414 11.018 0.409 1140 H ALA 190 H ALA 190 -9.253 11.246 0.327 1141 HA ALA 190 HA ALA 190 -10.371 8.717 1.346 1142 HB1 ALA 190 HB1 ALA 190 -11.657 10.982 2.374 1143 HB2 ALA 190 HB2 ALA 190 -9.964 11.428 2.338 1144 HB3 ALA 190 HB3 ALA 190 -10.502 9.973 3.233 1145 H PHE 191 H PHE 191 -12.990 8.735 1.042 1146 HA PHE 191 HA PHE 191 -13.283 9.702 -1.648 1147 HB2 PHE 191 HB2 PHE 191 -14.669 7.709 -0.013 1148 HB3 PHE 191 HB3 PHE 191 -15.729 8.664 -1.062 1149 HD1 PHE 191 HD1 PHE 191 -14.844 8.983 -3.594 1150 HD2 PHE 191 HD2 PHE 191 -13.553 5.906 -0.928 1151 HE1 PHE 191 HE1 PHE 191 -14.008 7.658 -5.518 1152 HE2 PHE 191 HE2 PHE 191 -12.733 4.598 -2.840 1153 HZ PHE 191 HZ PHE 191 -12.954 5.469 -5.129 1154 H SER 192 H SER 192 -13.121 11.952 -1.156 1155 HA SER 192 HA SER 192 -13.964 14.051 -0.914 1156 HB2 SER 192 HB2 SER 192 -15.594 13.053 -2.573 1157 HB3 SER 192 HB3 SER 192 -16.687 12.767 -1.219 1158 HG SER 192 HG SER 192 -17.311 14.731 -1.695 Start of MODEL 2 1 H1 ALA 1 H1 ALA 1 21.936 38.025 1.293 2 H2 ALA 1 H2 ALA 1 23.473 38.787 1.251 3 H3 ALA 1 H3 ALA 1 23.210 37.439 2.279 4 HA ALA 1 HA ALA 1 23.024 37.375 -0.653 5 HB1 ALA 1 HB1 ALA 1 25.299 36.531 1.138 6 HB2 ALA 1 HB2 ALA 1 25.296 37.911 0.040 7 HB3 ALA 1 HB3 ALA 1 25.205 36.271 -0.604 8 H VAL 2 H VAL 2 23.119 35.181 -1.458 9 HA VAL 2 HA VAL 2 22.754 32.942 -1.476 10 HB VAL 2 HB VAL 2 23.560 33.012 0.989 11 HG11 VAL 2 HG11 VAL 2 21.027 31.938 1.898 12 HG12 VAL 2 HG12 VAL 2 20.915 33.650 1.496 13 HG13 VAL 2 HG13 VAL 2 22.110 33.096 2.669 14 HG21 VAL 2 HG21 VAL 2 23.818 30.900 0.394 15 HG22 VAL 2 HG22 VAL 2 22.429 30.974 -0.690 16 HG23 VAL 2 HG23 VAL 2 22.198 30.579 1.013 17 H LEU 3 H LEU 3 21.007 34.336 -2.674 18 HA LEU 3 HA LEU 3 18.585 32.901 -2.531 19 HB2 LEU 3 HB2 LEU 3 18.682 35.299 -0.941 20 HB3 LEU 3 HB3 LEU 3 17.551 35.521 -2.260 21 HG LEU 3 HG LEU 3 16.240 34.734 -0.523 22 HD11 LEU 3 HD11 LEU 3 16.044 32.116 -1.125 23 HD12 LEU 3 HD12 LEU 3 16.859 32.729 -2.561 24 HD13 LEU 3 HD13 LEU 3 15.317 33.413 -2.063 25 HD21 LEU 3 HD21 LEU 3 18.385 33.959 0.747 26 HD22 LEU 3 HD22 LEU 3 17.917 32.378 0.121 27 HD23 LEU 3 HD23 LEU 3 16.805 33.286 1.144 28 H ASP 4 H ASP 4 18.712 32.573 -4.730 29 HA ASP 4 HA ASP 4 19.473 34.800 -6.384 30 HB2 ASP 4 HB2 ASP 4 19.793 32.015 -6.471 31 HB3 ASP 4 HB3 ASP 4 18.876 32.454 -7.908 32 H LEU 5 H LEU 5 16.333 34.249 -5.407 33 HA LEU 5 HA LEU 5 15.293 34.217 -7.982 34 HB2 LEU 5 HB2 LEU 5 13.072 34.363 -7.030 35 HB3 LEU 5 HB3 LEU 5 14.017 33.004 -6.501 36 HG LEU 5 HG LEU 5 13.000 33.536 -4.561 37 HD11 LEU 5 HD11 LEU 5 14.374 34.828 -3.039 38 HD12 LEU 5 HD12 LEU 5 15.323 35.433 -4.391 39 HD13 LEU 5 HD13 LEU 5 15.329 33.712 -4.008 40 HD21 LEU 5 HD21 LEU 5 12.695 36.168 -5.776 41 HD22 LEU 5 HD22 LEU 5 12.762 36.153 -4.021 42 HD23 LEU 5 HD23 LEU 5 11.554 35.190 -4.865 43 H ASP 6 H ASP 6 14.773 36.251 -5.468 44 HA ASP 6 HA ASP 6 15.355 38.716 -6.766 45 HB2 ASP 6 HB2 ASP 6 12.791 37.462 -6.570 46 HB3 ASP 6 HB3 ASP 6 12.750 38.985 -5.675 47 H VAL 7 H VAL 7 13.274 39.180 -3.877 48 HA VAL 7 HA VAL 7 15.570 39.350 -2.267 49 HB VAL 7 HB VAL 7 13.656 39.849 -0.624 50 HG11 VAL 7 HG11 VAL 7 14.845 41.455 -2.574 51 HG12 VAL 7 HG12 VAL 7 14.049 41.988 -1.093 52 HG13 VAL 7 HG13 VAL 7 13.132 41.873 -2.596 53 HG21 VAL 7 HG21 VAL 7 11.449 40.068 -1.336 54 HG22 VAL 7 HG22 VAL 7 11.992 38.620 -2.184 55 HG23 VAL 7 HG23 VAL 7 11.907 40.163 -3.036 56 H ARG 8 H ARG 8 14.945 37.891 0.142 57 HA ARG 8 HA ARG 8 14.624 35.330 -1.066 58 HB2 ARG 8 HB2 ARG 8 14.150 35.643 1.860 59 HB3 ARG 8 HB3 ARG 8 15.068 34.416 1.008 60 HG2 ARG 8 HG2 ARG 8 17.002 35.649 1.043 61 HG3 ARG 8 HG3 ARG 8 16.152 37.188 1.159 62 HD2 ARG 8 HD2 ARG 8 16.155 35.136 3.357 63 HD3 ARG 8 HD3 ARG 8 17.342 36.434 3.251 64 HE ARG 8 HE ARG 8 14.536 36.675 3.955 65 HH11 ARG 8 HH11 ARG 8 17.487 38.316 3.061 66 HH12 ARG 8 HH12 ARG 8 16.971 39.845 3.688 67 HH21 ARG 8 HH21 ARG 8 13.856 38.687 4.767 68 HH22 ARG 8 HH22 ARG 8 14.910 40.057 4.655 69 H THR 9 H THR 9 12.517 34.862 -1.906 70 HA THR 9 HA THR 9 10.459 35.604 0.075 71 HB THR 9 HB THR 9 9.982 34.848 -2.822 72 HG1 THR 9 HG1 THR 9 9.759 37.448 -1.740 73 HG21 THR 9 HG21 THR 9 7.904 36.433 -1.769 74 HG22 THR 9 HG22 THR 9 8.216 35.135 -0.616 75 HG23 THR 9 HG23 THR 9 7.841 34.750 -2.296 76 H CYS 10 H CYS 10 10.787 34.014 1.331 77 HA CYS 10 HA CYS 10 10.979 31.334 0.274 78 HB2 CYS 10 HB2 CYS 10 11.408 32.512 2.925 79 HB3 CYS 10 HB3 CYS 10 11.027 30.790 2.836 80 H LEU 11 H LEU 11 8.897 31.090 -0.794 81 HA LEU 11 HA LEU 11 6.395 31.240 0.146 82 HB2 LEU 11 HB2 LEU 11 6.628 28.495 -0.671 83 HB3 LEU 11 HB3 LEU 11 5.839 29.829 -1.483 84 HG LEU 11 HG LEU 11 8.800 29.520 -1.733 85 HD11 LEU 11 HD11 LEU 11 8.699 27.840 -3.280 86 HD12 LEU 11 HD12 LEU 11 7.014 28.166 -3.688 87 HD13 LEU 11 HD13 LEU 11 7.413 27.332 -2.186 88 HD21 LEU 11 HD21 LEU 11 8.573 30.989 -3.411 89 HD22 LEU 11 HD22 LEU 11 7.012 31.349 -2.675 90 HD23 LEU 11 HD23 LEU 11 7.111 30.217 -4.023 91 HA PRO 12 HA PRO 12 6.797 28.909 3.973 92 HB2 PRO 12 HB2 PRO 12 5.152 30.360 5.445 93 HB3 PRO 12 HB3 PRO 12 6.663 31.065 4.856 94 HG2 PRO 12 HG2 PRO 12 3.872 31.448 3.846 95 HG3 PRO 12 HG3 PRO 12 5.177 32.635 4.008 96 HD2 PRO 12 HD2 PRO 12 4.472 31.257 1.664 97 HD3 PRO 12 HD3 PRO 12 5.968 32.172 1.932 98 H CYS 13 H CYS 13 5.613 27.017 4.652 99 HA CYS 13 HA CYS 13 2.705 27.263 4.396 100 HB2 CYS 13 HB2 CYS 13 2.844 24.738 3.824 101 HB3 CYS 13 HB3 CYS 13 3.307 25.897 2.599 102 H GLY 14 H GLY 14 2.012 24.791 5.509 103 HA2 GLY 14 HA2 GLY 14 1.708 23.671 7.463 104 HA3 GLY 14 HA3 GLY 14 3.368 24.091 7.848 105 HA PRO 15 HA PRO 15 0.731 26.183 11.002 106 HB2 PRO 15 HB2 PRO 15 2.370 25.790 13.057 107 HB3 PRO 15 HB3 PRO 15 1.394 24.425 12.461 108 HG2 PRO 15 HG2 PRO 15 4.089 25.280 11.545 109 HG3 PRO 15 HG3 PRO 15 3.724 23.727 12.374 110 HD2 PRO 15 HD2 PRO 15 3.736 23.683 9.754 111 HD3 PRO 15 HD3 PRO 15 2.253 23.074 10.539 112 H GLY 16 H GLY 16 1.042 28.178 11.338 113 HA2 GLY 16 HA2 GLY 16 1.723 30.294 11.370 114 HA3 GLY 16 HA3 GLY 16 3.232 29.611 11.929 115 H GLY 17 H GLY 17 3.086 28.096 8.994 116 HA2 GLY 17 HA2 GLY 17 3.848 28.651 7.020 117 HA3 GLY 17 HA3 GLY 17 3.482 30.289 7.481 118 H LYS 18 H LYS 18 5.272 27.961 9.147 119 HA LYS 18 HA LYS 18 7.637 29.639 9.364 120 HB2 LYS 18 HB2 LYS 18 7.261 27.065 10.832 121 HB3 LYS 18 HB3 LYS 18 8.192 28.481 11.294 122 HG2 LYS 18 HG2 LYS 18 5.478 29.261 11.035 123 HG3 LYS 18 HG3 LYS 18 5.540 27.793 12.004 124 HD2 LYS 18 HD2 LYS 18 7.431 28.980 13.291 125 HD3 LYS 18 HD3 LYS 18 6.849 30.445 12.494 126 HE2 LYS 18 HE2 LYS 18 5.694 30.468 14.501 127 HE3 LYS 18 HE3 LYS 18 4.535 29.733 13.396 128 HZ1 LYS 18 HZ1 LYS 18 4.907 27.630 14.288 129 HZ2 LYS 18 HZ2 LYS 18 4.884 28.635 15.648 130 HZ3 LYS 18 HZ3 LYS 18 6.359 28.082 15.032 131 H GLY 19 H GLY 19 6.668 26.863 7.297 132 HA2 GLY 19 HA2 GLY 19 9.459 26.319 6.940 133 HA3 GLY 19 HA3 GLY 19 8.180 25.097 6.890 134 H ARG 20 H ARG 20 9.370 25.247 4.473 135 HA ARG 20 HA ARG 20 7.599 27.062 2.970 136 HB2 ARG 20 HB2 ARG 20 10.470 26.330 2.481 137 HB3 ARG 20 HB3 ARG 20 9.461 27.069 1.244 138 HG2 ARG 20 HG2 ARG 20 10.074 29.038 2.058 139 HG3 ARG 20 HG3 ARG 20 9.092 28.674 3.478 140 HD2 ARG 20 HD2 ARG 20 11.457 29.343 3.973 141 HD3 ARG 20 HD3 ARG 20 10.964 27.792 4.645 142 HE ARG 20 HE ARG 20 12.564 28.045 2.180 143 HH11 ARG 20 HH11 ARG 20 11.898 26.489 5.243 144 HH12 ARG 20 HH12 ARG 20 13.151 25.314 5.048 145 HH21 ARG 20 HH21 ARG 20 14.200 26.485 1.937 146 HH22 ARG 20 HH22 ARG 20 14.447 25.305 3.181 147 H CYS 21 H CYS 21 7.376 26.368 0.582 148 HA CYS 21 HA CYS 21 6.930 23.447 0.494 149 HB2 CYS 21 HB2 CYS 21 4.889 24.962 0.414 150 HB3 CYS 21 HB3 CYS 21 5.470 25.529 -1.140 151 H PHE 22 H PHE 22 7.315 22.322 -1.453 152 HA PHE 22 HA PHE 22 8.736 23.823 -3.562 153 HB2 PHE 22 HB2 PHE 22 10.472 22.199 -3.784 154 HB3 PHE 22 HB3 PHE 22 10.416 22.641 -2.087 155 HD1 PHE 22 HD1 PHE 22 9.316 21.078 -0.489 156 HD2 PHE 22 HD2 PHE 22 10.228 20.005 -4.498 157 HE1 PHE 22 HE1 PHE 22 9.164 18.714 0.108 158 HE2 PHE 22 HE2 PHE 22 10.066 17.623 -3.906 159 HZ PHE 22 HZ PHE 22 9.524 16.973 -1.597 160 H GLY 23 H GLY 23 7.253 20.733 -2.642 161 HA2 GLY 23 HA2 GLY 23 6.305 20.416 -5.414 162 HA3 GLY 23 HA3 GLY 23 6.305 19.153 -4.179 163 HA PRO 24 HA PRO 24 2.183 21.081 -3.848 164 HB2 PRO 24 HB2 PRO 24 0.651 18.908 -4.428 165 HB3 PRO 24 HB3 PRO 24 1.366 19.927 -5.680 166 HG2 PRO 24 HG2 PRO 24 2.065 17.192 -4.892 167 HG3 PRO 24 HG3 PRO 24 2.487 18.074 -6.367 168 HD2 PRO 24 HD2 PRO 24 4.092 17.636 -3.980 169 HD3 PRO 24 HD3 PRO 24 4.579 18.346 -5.533 170 H SER 25 H SER 25 2.407 17.612 -2.907 171 HA SER 25 HA SER 25 1.118 18.234 -0.363 172 HB2 SER 25 HB2 SER 25 1.364 15.862 -2.037 173 HB3 SER 25 HB3 SER 25 1.781 15.493 -0.352 174 HG SER 25 HG SER 25 -0.515 17.029 -0.854 175 H ILE 26 H ILE 26 4.118 18.643 -1.342 176 HA ILE 26 HA ILE 26 5.260 17.519 1.103 177 HB ILE 26 HB ILE 26 6.951 18.058 -1.277 178 HG12 ILE 26 HG12 ILE 26 5.533 15.452 -0.906 179 HG13 ILE 26 HG13 ILE 26 4.863 16.720 -1.909 180 HG21 ILE 26 HG21 ILE 26 8.402 17.370 0.235 181 HG22 ILE 26 HG22 ILE 26 7.798 15.772 -0.156 182 HG23 ILE 26 HG23 ILE 26 7.155 16.642 1.237 183 HD11 ILE 26 HD11 ILE 26 7.603 16.255 -2.620 184 HD12 ILE 26 HD12 ILE 26 6.146 16.148 -3.608 185 HD13 ILE 26 HD13 ILE 26 6.679 14.753 -2.668 186 H CYS 27 H CYS 27 5.805 18.884 2.546 187 HA CYS 27 HA CYS 27 6.932 21.492 1.784 188 HB2 CYS 27 HB2 CYS 27 4.440 20.995 3.208 189 HB3 CYS 27 HB3 CYS 27 5.544 22.007 4.124 190 H CYS 28 H CYS 28 8.693 21.990 2.841 191 HA CYS 28 HA CYS 28 9.358 20.609 5.314 192 HB2 CYS 28 HB2 CYS 28 11.683 21.124 3.666 193 HB3 CYS 28 HB3 CYS 28 11.170 19.639 4.452 194 H GLY 29 H GLY 29 11.398 21.438 6.247 195 HA2 GLY 29 HA2 GLY 29 12.050 24.207 6.023 196 HA3 GLY 29 HA3 GLY 29 11.237 23.772 7.518 197 H ASP 30 H ASP 30 13.691 24.613 7.926 198 HA ASP 30 HA ASP 30 15.780 22.791 7.673 199 HB2 ASP 30 HB2 ASP 30 15.922 25.275 8.256 200 HB3 ASP 30 HB3 ASP 30 15.538 24.793 9.906 201 H GLU 31 H GLU 31 13.704 23.523 10.271 202 HA GLU 31 HA GLU 31 14.281 20.926 11.521 203 HB2 GLU 31 HB2 GLU 31 13.267 22.463 13.581 204 HB3 GLU 31 HB3 GLU 31 14.941 21.978 13.368 205 HG2 GLU 31 HG2 GLU 31 15.029 24.129 11.874 206 HG3 GLU 31 HG3 GLU 31 13.622 24.583 12.833 207 H LEU 32 H LEU 32 12.208 22.319 9.685 208 HA LEU 32 HA LEU 32 9.836 21.440 11.071 209 HB2 LEU 32 HB2 LEU 32 10.540 23.677 9.546 210 HB3 LEU 32 HB3 LEU 32 9.476 22.724 8.547 211 HG LEU 32 HG LEU 32 8.841 23.664 11.338 212 HD11 LEU 32 HD11 LEU 32 9.046 25.471 9.650 213 HD12 LEU 32 HD12 LEU 32 7.430 25.305 10.347 214 HD13 LEU 32 HD13 LEU 32 7.759 24.688 8.729 215 HD21 LEU 32 HD21 LEU 32 6.471 23.076 10.291 216 HD22 LEU 32 HD22 LEU 32 7.452 21.882 11.142 217 HD23 LEU 32 HD23 LEU 32 7.459 21.935 9.381 218 H GLY 33 H GLY 33 12.229 20.467 9.113 219 HA2 GLY 33 HA2 GLY 33 12.508 18.831 7.585 220 HA3 GLY 33 HA3 GLY 33 11.304 18.040 8.540 221 H CYS 34 H CYS 34 10.139 17.024 6.969 222 HA CYS 34 HA CYS 34 8.700 18.825 5.180 223 HB2 CYS 34 HB2 CYS 34 10.738 17.465 4.092 224 HB3 CYS 34 HB3 CYS 34 9.454 16.304 3.876 225 H PHE 35 H PHE 35 6.655 18.569 5.223 226 HA PHE 35 HA PHE 35 5.596 16.071 6.270 227 HB2 PHE 35 HB2 PHE 35 3.614 18.025 5.381 228 HB3 PHE 35 HB3 PHE 35 3.809 17.287 6.967 229 HD1 PHE 35 HD1 PHE 35 5.407 18.317 8.597 230 HD2 PHE 35 HD2 PHE 35 4.295 20.227 4.966 231 HE1 PHE 35 HE1 PHE 35 6.221 20.460 9.479 232 HE2 PHE 35 HE2 PHE 35 5.104 22.377 5.844 233 HZ PHE 35 HZ PHE 35 6.073 22.495 8.099 234 H VAL 36 H VAL 36 5.613 14.579 4.630 235 HA VAL 36 HA VAL 36 5.042 15.609 1.966 236 HB VAL 36 HB VAL 36 5.740 12.726 2.383 237 HG11 VAL 36 HG11 VAL 36 5.256 13.465 0.147 238 HG12 VAL 36 HG12 VAL 36 6.991 13.177 0.260 239 HG13 VAL 36 HG13 VAL 36 6.367 14.834 0.301 240 HG21 VAL 36 HG21 VAL 36 7.295 14.170 3.813 241 HG22 VAL 36 HG22 VAL 36 7.901 14.848 2.305 242 HG23 VAL 36 HG23 VAL 36 8.091 13.126 2.631 243 H GLY 37 H GLY 37 2.994 16.083 2.364 244 HA2 GLY 37 HA2 GLY 37 0.805 15.369 1.601 245 HA3 GLY 37 HA3 GLY 37 1.152 13.758 2.202 246 H THR 38 H THR 38 0.019 16.945 3.007 247 HA THR 38 HA THR 38 -1.715 16.147 5.023 248 HB THR 38 HB THR 38 -0.093 15.693 6.612 249 HG1 THR 38 HG1 THR 38 -0.051 17.469 8.023 250 HG21 THR 38 HG21 THR 38 1.992 16.101 5.906 251 HG22 THR 38 HG22 THR 38 1.807 17.562 6.877 252 HG23 THR 38 HG23 THR 38 1.552 17.624 5.133 253 H ALA 39 H ALA 39 -2.709 18.298 6.229 254 HA ALA 39 HA ALA 39 -3.062 20.185 4.277 255 HB1 ALA 39 HB1 ALA 39 -4.686 19.871 5.997 256 HB2 ALA 39 HB2 ALA 39 -4.056 21.511 6.150 257 HB3 ALA 39 HB3 ALA 39 -3.507 20.249 7.253 258 H GLU 40 H GLU 40 -0.427 19.741 6.408 259 HA GLU 40 HA GLU 40 0.353 22.432 6.754 260 HB2 GLU 40 HB2 GLU 40 1.496 19.788 7.212 261 HB3 GLU 40 HB3 GLU 40 2.701 20.958 6.702 262 HG2 GLU 40 HG2 GLU 40 2.399 22.288 8.563 263 HG3 GLU 40 HG3 GLU 40 0.793 21.640 8.890 264 H ALA 41 H ALA 41 0.253 20.414 4.051 265 HA ALA 41 HA ALA 41 1.983 22.244 2.523 266 HB1 ALA 41 HB1 ALA 41 2.291 19.456 2.887 267 HB2 ALA 41 HB2 ALA 41 3.234 20.536 1.859 268 HB3 ALA 41 HB3 ALA 41 1.812 19.720 1.210 269 H LEU 42 H LEU 42 -1.206 21.193 2.912 270 HA LEU 42 HA LEU 42 -1.970 21.026 0.190 271 HB2 LEU 42 HB2 LEU 42 -3.864 20.286 1.142 272 HB3 LEU 42 HB3 LEU 42 -2.977 20.371 2.644 273 HG LEU 42 HG LEU 42 -4.279 22.823 1.764 274 HD11 LEU 42 HD11 LEU 42 -5.846 20.552 2.961 275 HD12 LEU 42 HD12 LEU 42 -5.969 21.088 1.281 276 HD13 LEU 42 HD13 LEU 42 -6.465 22.164 2.589 277 HD21 LEU 42 HD21 LEU 42 -3.755 23.415 3.807 278 HD22 LEU 42 HD22 LEU 42 -3.219 21.789 4.153 279 HD23 LEU 42 HD23 LEU 42 -4.895 22.220 4.422 280 H ARG 43 H ARG 43 -1.754 23.387 2.736 281 HA ARG 43 HA ARG 43 -3.118 25.500 1.469 282 HB2 ARG 43 HB2 ARG 43 -2.086 26.926 3.122 283 HB3 ARG 43 HB3 ARG 43 -2.547 25.423 3.903 284 HG2 ARG 43 HG2 ARG 43 -0.412 24.821 4.325 285 HG3 ARG 43 HG3 ARG 43 0.206 25.557 2.847 286 HD2 ARG 43 HD2 ARG 43 0.994 26.699 4.882 287 HD3 ARG 43 HD3 ARG 43 0.054 27.755 3.829 288 HE ARG 43 HE ARG 43 -1.308 26.447 6.060 289 HH11 ARG 43 HH11 ARG 43 0.016 29.371 4.671 290 HH12 ARG 43 HH12 ARG 43 -0.820 30.414 5.769 291 HH21 ARG 43 HH21 ARG 43 -2.395 27.824 7.506 292 HH22 ARG 43 HH22 ARG 43 -2.184 29.538 7.378 293 H CYS 44 H CYS 44 -0.251 23.879 0.449 294 HA CYS 44 HA CYS 44 1.058 26.239 -0.482 295 HB2 CYS 44 HB2 CYS 44 2.397 24.380 0.196 296 HB3 CYS 44 HB3 CYS 44 1.394 23.248 -0.685 297 H GLN 45 H GLN 45 -1.818 25.145 -1.227 298 HA GLN 45 HA GLN 45 -1.652 24.600 -4.016 299 HB2 GLN 45 HB2 GLN 45 -3.692 24.673 -1.956 300 HB3 GLN 45 HB3 GLN 45 -4.245 25.489 -3.411 301 HG2 GLN 45 HG2 GLN 45 -2.982 22.793 -3.609 302 HG3 GLN 45 HG3 GLN 45 -4.662 22.948 -3.100 303 HE21 GLN 45 HE21 GLN 45 -5.319 21.844 -4.976 304 HE22 GLN 45 HE22 GLN 45 -5.358 22.631 -6.514 305 H GLU 46 H GLU 46 -1.572 27.409 -2.029 306 HA GLU 46 HA GLU 46 -2.539 29.106 -4.189 307 HB2 GLU 46 HB2 GLU 46 -2.706 30.794 -2.668 308 HB3 GLU 46 HB3 GLU 46 -2.729 29.445 -1.546 309 HG2 GLU 46 HG2 GLU 46 -0.282 31.042 -2.272 310 HG3 GLU 46 HG3 GLU 46 -1.267 31.288 -0.831 311 H GLU 47 H GLU 47 0.143 27.424 -3.853 312 HA GLU 47 HA GLU 47 2.089 29.455 -4.516 313 HB2 GLU 47 HB2 GLU 47 2.264 26.940 -3.386 314 HB3 GLU 47 HB3 GLU 47 2.829 26.664 -5.028 315 HG2 GLU 47 HG2 GLU 47 3.918 28.885 -3.338 316 HG3 GLU 47 HG3 GLU 47 4.559 27.245 -3.251 317 H ASN 48 H ASN 48 -0.414 28.098 -6.129 318 HA ASN 48 HA ASN 48 0.862 27.505 -8.626 319 HB2 ASN 48 HB2 ASN 48 -1.910 27.584 -7.598 320 HB3 ASN 48 HB3 ASN 48 -1.731 27.948 -9.310 321 HD21 ASN 48 HD21 ASN 48 -2.321 26.198 -10.374 322 HD22 ASN 48 HD22 ASN 48 -1.769 24.590 -10.064 323 H TYR 49 H TYR 49 -0.440 30.297 -7.028 324 HA TYR 49 HA TYR 49 0.051 31.929 -9.462 325 HB2 TYR 49 HB2 TYR 49 -2.298 31.797 -8.213 326 HB3 TYR 49 HB3 TYR 49 -1.538 32.985 -7.159 327 HD1 TYR 49 HD1 TYR 49 0.066 34.553 -9.054 328 HD2 TYR 49 HD2 TYR 49 -3.869 32.985 -9.453 329 HE1 TYR 49 HE1 TYR 49 -0.466 36.319 -10.678 330 HE2 TYR 49 HE2 TYR 49 -4.411 34.749 -11.080 331 HH TYR 49 HH TYR 49 -3.651 36.969 -11.713 332 H LEU 50 H LEU 50 2.278 31.270 -8.093 333 HA LEU 50 HA LEU 50 3.026 33.811 -6.835 334 HB2 LEU 50 HB2 LEU 50 2.485 31.690 -5.268 335 HB3 LEU 50 HB3 LEU 50 4.176 31.376 -5.609 336 HG LEU 50 HG LEU 50 4.274 34.005 -4.914 337 HD11 LEU 50 HD11 LEU 50 2.004 34.235 -4.289 338 HD12 LEU 50 HD12 LEU 50 2.929 34.129 -2.791 339 HD13 LEU 50 HD13 LEU 50 2.030 32.727 -3.373 340 HD21 LEU 50 HD21 LEU 50 5.401 31.737 -4.061 341 HD22 LEU 50 HD22 LEU 50 4.361 32.072 -2.676 342 HD23 LEU 50 HD23 LEU 50 5.551 33.266 -3.195 343 HA PRO 51 HA PRO 51 6.355 32.646 -9.722 344 HB2 PRO 51 HB2 PRO 51 6.732 35.042 -10.816 345 HB3 PRO 51 HB3 PRO 51 5.310 34.074 -11.227 346 HG2 PRO 51 HG2 PRO 51 5.542 36.415 -9.385 347 HG3 PRO 51 HG3 PRO 51 4.245 36.006 -10.520 348 HD2 PRO 51 HD2 PRO 51 4.222 35.496 -7.778 349 HD3 PRO 51 HD3 PRO 51 3.175 34.717 -8.980 350 H SER 52 H SER 52 6.698 33.331 -6.832 351 HA SER 52 HA SER 52 9.332 34.634 -7.048 352 HB2 SER 52 HB2 SER 52 8.931 35.563 -4.751 353 HB3 SER 52 HB3 SER 52 7.863 36.229 -5.986 354 HG SER 52 HG SER 52 6.805 35.584 -3.999 355 HA PRO 53 HA PRO 53 9.857 30.544 -4.998 356 HB2 PRO 53 HB2 PRO 53 11.648 29.491 -6.665 357 HB3 PRO 53 HB3 PRO 53 9.935 29.574 -7.099 358 HG2 PRO 53 HG2 PRO 53 12.200 31.314 -7.978 359 HG3 PRO 53 HG3 PRO 53 10.833 30.694 -8.919 360 HD2 PRO 53 HD2 PRO 53 11.003 33.240 -7.811 361 HD3 PRO 53 HD3 PRO 53 9.506 32.442 -8.329 362 H CYS 54 H CYS 54 10.995 30.853 -3.160 363 HA CYS 54 HA CYS 54 13.371 32.333 -2.849 364 HB2 CYS 54 HB2 CYS 54 11.597 31.084 -1.157 365 HB3 CYS 54 HB3 CYS 54 12.996 30.042 -1.009 366 H GLN 55 H GLN 55 15.058 31.728 -4.351 367 HA GLN 55 HA GLN 55 15.718 29.175 -5.137 368 HB2 GLN 55 HB2 GLN 55 16.873 31.481 -5.633 369 HB3 GLN 55 HB3 GLN 55 17.965 30.976 -4.350 370 HG2 GLN 55 HG2 GLN 55 18.905 30.352 -6.459 371 HG3 GLN 55 HG3 GLN 55 18.418 28.897 -5.594 372 HE21 GLN 55 HE21 GLN 55 16.721 31.246 -7.645 373 HE22 GLN 55 HE22 GLN 55 16.060 30.078 -8.731 374 H SER 56 H SER 56 16.351 27.339 -4.181 375 HA SER 56 HA SER 56 18.167 27.230 -2.013 376 HB2 SER 56 HB2 SER 56 15.322 27.437 -1.367 377 HB3 SER 56 HB3 SER 56 16.093 26.037 -0.630 378 HG SER 56 HG SER 56 16.362 27.764 0.745 379 H GLY 57 H GLY 57 17.019 24.715 -0.931 380 HA2 GLY 57 HA2 GLY 57 17.232 22.487 -1.263 381 HA3 GLY 57 HA3 GLY 57 16.386 22.845 -2.761 382 H GLN 58 H GLN 58 19.678 23.326 -1.463 383 HA GLN 58 HA GLN 58 20.591 22.101 -3.978 384 HB2 GLN 58 HB2 GLN 58 21.141 24.542 -3.816 385 HB3 GLN 58 HB3 GLN 58 22.058 24.196 -2.358 386 HG2 GLN 58 HG2 GLN 58 23.437 22.610 -3.775 387 HG3 GLN 58 HG3 GLN 58 22.654 23.349 -5.172 388 HE21 GLN 58 HE21 GLN 58 24.375 24.248 -2.203 389 HE22 GLN 58 HE22 GLN 58 25.244 25.568 -2.902 390 H LYS 59 H LYS 59 20.086 20.362 -2.589 391 HA LYS 59 HA LYS 59 22.549 19.400 -1.262 392 HB2 LYS 59 HB2 LYS 59 19.787 19.501 -0.065 393 HB3 LYS 59 HB3 LYS 59 20.859 18.177 0.359 394 HG2 LYS 59 HG2 LYS 59 21.895 20.943 0.615 395 HG3 LYS 59 HG3 LYS 59 20.705 20.386 1.793 396 HD2 LYS 59 HD2 LYS 59 22.386 19.433 2.901 397 HD3 LYS 59 HD3 LYS 59 22.519 18.282 1.569 398 HE2 LYS 59 HE2 LYS 59 24.679 19.202 1.890 399 HE3 LYS 59 HE3 LYS 59 24.026 19.944 0.431 400 HZ1 LYS 59 HZ1 LYS 59 23.649 21.948 1.534 401 HZ2 LYS 59 HZ2 LYS 59 25.163 21.455 2.105 402 HZ3 LYS 59 HZ3 LYS 59 23.790 21.252 3.071 403 HA PRO 60 HA PRO 60 20.059 16.934 -4.604 404 HB2 PRO 60 HB2 PRO 60 22.576 16.534 -5.908 405 HB3 PRO 60 HB3 PRO 60 21.193 17.466 -6.480 406 HG2 PRO 60 HG2 PRO 60 23.642 18.381 -5.090 407 HG3 PRO 60 HG3 PRO 60 22.600 19.251 -6.231 408 HD2 PRO 60 HD2 PRO 60 22.573 19.824 -3.617 409 HD3 PRO 60 HD3 PRO 60 21.085 19.854 -4.579 410 H CYS 61 H CYS 61 19.606 15.120 -3.861 411 HA CYS 61 HA CYS 61 21.598 13.012 -3.531 412 HB2 CYS 61 HB2 CYS 61 21.264 12.726 -1.298 413 HB3 CYS 61 HB3 CYS 61 20.534 14.327 -1.302 414 H GLY 62 H GLY 62 20.280 10.742 -3.473 415 HA2 GLY 62 HA2 GLY 62 18.475 9.511 -4.062 416 HA3 GLY 62 HA3 GLY 62 17.499 10.968 -4.086 417 H SER 63 H SER 63 16.643 9.784 -5.939 418 HA SER 63 HA SER 63 18.250 9.719 -8.321 419 HB2 SER 63 HB2 SER 63 16.050 8.984 -9.374 420 HB3 SER 63 HB3 SER 63 16.688 7.938 -8.106 421 HG SER 63 HG SER 63 14.318 8.847 -8.157 422 H GLY 64 H GLY 64 18.190 12.286 -7.393 423 HA2 GLY 64 HA2 GLY 64 18.187 14.101 -9.030 424 HA3 GLY 64 HA3 GLY 64 16.567 13.604 -9.468 425 H GLY 65 H GLY 65 16.952 13.574 -5.996 426 HA2 GLY 65 HA2 GLY 65 15.485 16.097 -5.977 427 HA3 GLY 65 HA3 GLY 65 15.424 14.839 -4.767 428 H ARG 66 H ARG 66 15.680 17.481 -4.167 429 HA ARG 66 HA ARG 66 18.424 17.715 -3.182 430 HB2 ARG 66 HB2 ARG 66 17.340 20.115 -2.534 431 HB3 ARG 66 HB3 ARG 66 18.228 19.807 -4.021 432 HG2 ARG 66 HG2 ARG 66 15.265 19.384 -3.904 433 HG3 ARG 66 HG3 ARG 66 15.934 21.003 -4.117 434 HD2 ARG 66 HD2 ARG 66 16.331 18.604 -5.896 435 HD3 ARG 66 HD3 ARG 66 15.462 20.089 -6.279 436 HE ARG 66 HE ARG 66 18.082 20.783 -5.638 437 HH11 ARG 66 HH11 ARG 66 16.362 19.019 -8.107 438 HH12 ARG 66 HH12 ARG 66 17.544 19.337 -9.332 439 HH21 ARG 66 HH21 ARG 66 19.640 21.199 -7.243 440 HH22 ARG 66 HH22 ARG 66 19.406 20.574 -8.842 441 H CYS 67 H CYS 67 18.666 18.314 -0.848 442 HA CYS 67 HA CYS 67 17.118 16.757 0.763 443 HB2 CYS 67 HB2 CYS 67 19.406 17.447 1.347 444 HB3 CYS 67 HB3 CYS 67 18.855 19.109 1.523 445 H ALA 68 H ALA 68 15.097 17.069 1.306 446 HA ALA 68 HA ALA 68 13.712 19.487 0.873 447 HB1 ALA 68 HB1 ALA 68 12.041 18.012 1.069 448 HB2 ALA 68 HB2 ALA 68 12.314 18.006 2.814 449 HB3 ALA 68 HB3 ALA 68 13.112 16.809 1.792 450 H ALA 69 H ALA 69 14.896 17.797 3.645 451 HA ALA 69 HA ALA 69 15.604 20.179 5.165 452 HB1 ALA 69 HB1 ALA 69 13.397 20.270 5.680 453 HB2 ALA 69 HB2 ALA 69 14.066 19.373 7.029 454 HB3 ALA 69 HB3 ALA 69 13.187 18.533 5.746 455 H ALA 70 H ALA 70 16.472 19.553 7.319 456 HA ALA 70 HA ALA 70 18.418 17.651 7.197 457 HB1 ALA 70 HB1 ALA 70 18.681 17.669 9.560 458 HB2 ALA 70 HB2 ALA 70 17.040 18.295 9.779 459 HB3 ALA 70 HB3 ALA 70 18.274 19.302 9.017 460 H GLY 71 H GLY 71 18.640 15.558 7.316 461 HA2 GLY 71 HA2 GLY 71 18.266 13.356 7.791 462 HA3 GLY 71 HA3 GLY 71 16.873 13.833 8.704 463 H ILE 72 H ILE 72 15.717 15.197 6.215 464 HA ILE 72 HA ILE 72 15.082 12.775 4.656 465 HB ILE 72 HB ILE 72 12.776 13.652 4.470 466 HG12 ILE 72 HG12 ILE 72 12.643 15.118 6.878 467 HG13 ILE 72 HG13 ILE 72 13.954 15.825 5.928 468 HG21 ILE 72 HG21 ILE 72 14.018 12.605 6.957 469 HG22 ILE 72 HG22 ILE 72 12.869 11.843 5.858 470 HG23 ILE 72 HG23 ILE 72 12.317 13.065 7.004 471 HD11 ILE 72 HD11 ILE 72 11.508 15.159 4.496 472 HD12 ILE 72 HD12 ILE 72 12.578 16.553 4.321 473 HD13 ILE 72 HD13 ILE 72 11.404 16.499 5.635 474 H CYS 73 H CYS 73 15.686 12.986 2.702 475 HA CYS 73 HA CYS 73 15.863 15.605 1.418 476 HB2 CYS 73 HB2 CYS 73 17.978 14.657 1.397 477 HB3 CYS 73 HB3 CYS 73 17.355 13.033 1.164 478 H CYS 74 H CYS 74 14.183 16.077 0.162 479 HA CYS 74 HA CYS 74 12.511 14.020 -0.917 480 HB2 CYS 74 HB2 CYS 74 12.358 16.969 -0.632 481 HB3 CYS 74 HB3 CYS 74 11.374 16.213 -1.881 482 H SER 75 H SER 75 11.980 13.665 -2.982 483 HA SER 75 HA SER 75 13.769 14.697 -5.080 484 HB2 SER 75 HB2 SER 75 13.401 12.392 -6.148 485 HB3 SER 75 HB3 SER 75 14.421 12.417 -4.718 486 HG SER 75 HG SER 75 12.499 11.836 -3.522 487 HA PRO 76 HA PRO 76 10.067 15.590 -7.307 488 HB2 PRO 76 HB2 PRO 76 10.198 14.431 -9.752 489 HB3 PRO 76 HB3 PRO 76 11.216 15.800 -9.293 490 HG2 PRO 76 HG2 PRO 76 11.887 12.891 -9.404 491 HG3 PRO 76 HG3 PRO 76 12.867 14.287 -9.884 492 HD2 PRO 76 HD2 PRO 76 13.185 12.952 -7.528 493 HD3 PRO 76 HD3 PRO 76 13.597 14.662 -7.742 494 H ASP 77 H ASP 77 10.105 13.074 -5.696 495 HA ASP 77 HA ASP 77 7.573 12.010 -6.638 496 HB2 ASP 77 HB2 ASP 77 8.344 9.665 -6.260 497 HB3 ASP 77 HB3 ASP 77 9.136 10.453 -7.622 498 H GLY 78 H GLY 78 10.097 11.806 -4.107 499 HA2 GLY 78 HA2 GLY 78 8.074 12.274 -2.092 500 HA3 GLY 78 HA3 GLY 78 8.828 10.696 -2.011 501 H CYS 79 H CYS 79 9.875 10.849 -0.152 502 HA CYS 79 HA CYS 79 12.174 12.641 -0.064 503 HB2 CYS 79 HB2 CYS 79 9.849 13.047 1.500 504 HB3 CYS 79 HB3 CYS 79 11.099 12.445 2.585 505 H HIS 80 H HIS 80 13.891 11.899 1.360 506 HA HIS 80 HA HIS 80 13.536 9.282 2.589 507 HB2 HIS 80 HB2 HIS 80 15.643 8.507 1.212 508 HB3 HIS 80 HB3 HIS 80 14.025 8.344 0.539 509 HD1 HIS 80 HD1 HIS 80 13.320 10.207 -1.237 510 HD2 HIS 80 HD2 HIS 80 17.351 10.102 -0.235 511 HE1 HIS 80 HE1 HIS 80 14.488 11.548 -3.012 512 HE2 HIS 80 HE2 HIS 80 16.926 11.444 -2.405 513 H GLU 81 H GLU 81 15.431 8.545 3.757 514 HA GLU 81 HA GLU 81 16.584 10.596 5.262 515 HB2 GLU 81 HB2 GLU 81 17.134 8.895 6.609 516 HB3 GLU 81 HB3 GLU 81 16.398 7.825 5.432 517 HG2 GLU 81 HG2 GLU 81 18.344 6.806 5.211 518 HG3 GLU 81 HG3 GLU 81 19.021 8.277 4.525 519 H ASP 82 H ASP 82 18.539 11.598 5.222 520 HA ASP 82 HA ASP 82 20.428 10.882 3.091 521 HB2 ASP 82 HB2 ASP 82 20.526 13.083 2.196 522 HB3 ASP 82 HB3 ASP 82 18.809 12.687 2.330 523 HA PRO 83 HA PRO 83 23.304 11.542 6.401 524 HB2 PRO 83 HB2 PRO 83 25.495 11.616 4.511 525 HB3 PRO 83 HB3 PRO 83 25.025 10.324 5.616 526 HG2 PRO 83 HG2 PRO 83 24.796 10.146 2.903 527 HG3 PRO 83 HG3 PRO 83 23.762 9.259 4.037 528 HD2 PRO 83 HD2 PRO 83 23.188 11.774 2.512 529 HD3 PRO 83 HD3 PRO 83 22.132 10.381 2.835 530 H ALA 84 H ALA 84 23.330 13.748 3.678 531 HA ALA 84 HA ALA 84 25.229 15.571 4.726 532 HB1 ALA 84 HB1 ALA 84 23.655 15.383 2.380 533 HB2 ALA 84 HB2 ALA 84 24.945 16.534 2.726 534 HB3 ALA 84 HB3 ALA 84 23.276 16.933 3.132 535 H CYS 85 H CYS 85 21.770 15.237 4.809 536 HA CYS 85 HA CYS 85 21.545 17.303 6.867 537 HB2 CYS 85 HB2 CYS 85 19.325 15.886 5.413 538 HB3 CYS 85 HB3 CYS 85 19.212 17.326 6.397 539 H ASP 86 H ASP 86 22.646 15.781 8.270 540 HA ASP 86 HA ASP 86 20.875 14.441 9.989 541 HB2 ASP 86 HB2 ASP 86 22.036 12.882 7.892 542 HB3 ASP 86 HB3 ASP 86 22.744 12.438 9.452 543 HA PRO 87 HA PRO 87 25.457 15.110 11.298 544 HB2 PRO 87 HB2 PRO 87 24.884 17.885 11.981 545 HB3 PRO 87 HB3 PRO 87 26.236 17.200 11.087 546 HG2 PRO 87 HG2 PRO 87 24.348 18.714 9.911 547 HG3 PRO 87 HG3 PRO 87 25.195 17.407 9.065 548 HD2 PRO 87 HD2 PRO 87 22.461 17.434 10.262 549 HD3 PRO 87 HD3 PRO 87 23.041 16.696 8.759 550 H GLU 88 H GLU 88 25.988 16.132 13.422 551 HA GLU 88 HA GLU 88 24.913 14.948 15.538 552 HB2 GLU 88 HB2 GLU 88 25.727 16.764 16.932 553 HB3 GLU 88 HB3 GLU 88 26.857 16.497 15.610 554 HG2 GLU 88 HG2 GLU 88 26.443 18.506 14.664 555 HG3 GLU 88 HG3 GLU 88 24.742 18.497 15.123 556 H ALA 89 H ALA 89 23.319 17.373 13.662 557 HA ALA 89 HA ALA 89 21.540 18.465 15.371 558 HB1 ALA 89 HB1 ALA 89 21.533 17.771 12.434 559 HB2 ALA 89 HB2 ALA 89 21.638 19.364 13.225 560 HB3 ALA 89 HB3 ALA 89 20.100 18.504 13.198 561 H ALA 90 H ALA 90 21.807 15.306 15.295 562 HA ALA 90 HA ALA 90 19.060 14.515 14.955 563 HB1 ALA 90 HB1 ALA 90 21.402 13.143 14.856 564 HB2 ALA 90 HB2 ALA 90 19.811 12.404 15.028 565 HB3 ALA 90 HB3 ALA 90 20.805 12.701 16.455 566 H PHE 91 H PHE 91 17.770 13.610 16.644 567 HA PHE 91 HA PHE 91 18.112 14.981 19.225 568 HB2 PHE 91 HB2 PHE 91 15.881 14.631 17.544 569 HB3 PHE 91 HB3 PHE 91 15.596 13.582 18.930 570 HD1 PHE 91 HD1 PHE 91 16.439 14.845 21.227 571 HD2 PHE 91 HD2 PHE 91 14.879 16.672 17.717 572 HE1 PHE 91 HE1 PHE 91 15.751 16.798 22.555 573 HE2 PHE 91 HE2 PHE 91 14.187 18.628 19.036 574 HZ PHE 91 HZ PHE 91 14.625 18.694 21.459 575 H SER 92 H SER 92 19.419 13.619 20.439 576 HA SER 92 HA SER 92 18.980 10.757 20.394 577 HB2 SER 92 HB2 SER 92 20.824 10.713 22.092 578 HB3 SER 92 HB3 SER 92 21.268 11.494 20.575 579 HG SER 92 HG SER 92 20.874 12.598 23.107 580 H1 ALA 101 H1 ALA 101 -8.462 -8.765 5.740 581 H2 ALA 101 H2 ALA 101 -9.127 -7.232 6.132 582 H3 ALA 101 H3 ALA 101 -10.077 -8.652 6.304 583 HA ALA 101 HA ALA 101 -9.124 -9.265 8.190 584 HB1 ALA 101 HB1 ALA 101 -6.892 -9.447 7.113 585 HB2 ALA 101 HB2 ALA 101 -6.830 -8.893 8.786 586 HB3 ALA 101 HB3 ALA 101 -6.627 -7.740 7.466 587 H VAL 102 H VAL 102 -8.559 -8.158 10.274 588 HA VAL 102 HA VAL 102 -9.839 -5.523 10.296 589 HB VAL 102 HB VAL 102 -9.189 -7.146 12.749 590 HG11 VAL 102 HG11 VAL 102 -11.473 -6.046 13.370 591 HG12 VAL 102 HG12 VAL 102 -11.098 -4.942 12.048 592 HG13 VAL 102 HG13 VAL 102 -10.008 -5.069 13.427 593 HG21 VAL 102 HG21 VAL 102 -11.097 -8.448 12.561 594 HG22 VAL 102 HG22 VAL 102 -10.445 -8.468 10.925 595 HG23 VAL 102 HG23 VAL 102 -11.804 -7.417 11.318 596 H LEU 103 H LEU 103 -8.397 -5.545 13.024 597 HA LEU 103 HA LEU 103 -5.900 -4.153 12.313 598 HB2 LEU 103 HB2 LEU 103 -7.987 -3.113 13.704 599 HB3 LEU 103 HB3 LEU 103 -7.119 -3.894 15.012 600 HG LEU 103 HG LEU 103 -6.486 -1.570 14.830 601 HD11 LEU 103 HD11 LEU 103 -3.992 -2.570 13.844 602 HD12 LEU 103 HD12 LEU 103 -4.752 -3.733 14.925 603 HD13 LEU 103 HD13 LEU 103 -4.443 -2.089 15.477 604 HD21 LEU 103 HD21 LEU 103 -5.987 -2.294 11.985 605 HD22 LEU 103 HD22 LEU 103 -5.053 -1.002 12.740 606 HD23 LEU 103 HD23 LEU 103 -6.812 -0.889 12.659 607 H ASP 104 H ASP 104 -4.386 -5.763 12.452 608 HA ASP 104 HA ASP 104 -4.777 -7.925 14.304 609 HB2 ASP 104 HB2 ASP 104 -3.565 -7.791 11.897 610 HB3 ASP 104 HB3 ASP 104 -2.164 -7.705 12.956 611 H LEU 105 H LEU 105 -4.597 -7.079 16.387 612 HA LEU 105 HA LEU 105 -1.931 -6.680 17.217 613 HB2 LEU 105 HB2 LEU 105 -2.716 -4.455 16.595 614 HB3 LEU 105 HB3 LEU 105 -4.002 -4.603 17.753 615 HG LEU 105 HG LEU 105 -1.567 -3.399 18.163 616 HD11 LEU 105 HD11 LEU 105 -3.881 -3.447 19.439 617 HD12 LEU 105 HD12 LEU 105 -2.410 -2.829 20.183 618 HD13 LEU 105 HD13 LEU 105 -2.962 -4.463 20.547 619 HD21 LEU 105 HD21 LEU 105 -1.494 -6.062 19.572 620 HD22 LEU 105 HD22 LEU 105 -0.383 -4.718 19.824 621 HD23 LEU 105 HD23 LEU 105 -0.420 -5.549 18.270 622 H ASP 106 H ASP 106 -4.858 -5.945 18.517 623 HA ASP 106 HA ASP 106 -5.570 -8.147 20.039 624 HB2 ASP 106 HB2 ASP 106 -3.358 -6.898 21.009 625 HB3 ASP 106 HB3 ASP 106 -4.635 -6.173 21.994 626 H VAL 107 H VAL 107 -5.464 -4.768 19.585 627 HA VAL 107 HA VAL 107 -8.248 -4.549 19.380 628 HB VAL 107 HB VAL 107 -8.351 -2.468 20.734 629 HG11 VAL 107 HG11 VAL 107 -8.310 -5.214 21.617 630 HG12 VAL 107 HG12 VAL 107 -9.633 -4.048 21.702 631 HG13 VAL 107 HG13 VAL 107 -8.358 -4.039 22.928 632 HG21 VAL 107 HG21 VAL 107 -6.838 -2.449 22.755 633 HG22 VAL 107 HG22 VAL 107 -6.125 -1.939 21.225 634 HG23 VAL 107 HG23 VAL 107 -5.813 -3.559 21.846 635 H ARG 108 H ARG 108 -8.489 -1.957 18.359 636 HA ARG 108 HA ARG 108 -6.139 -1.951 16.705 637 HB2 ARG 108 HB2 ARG 108 -7.926 0.441 16.858 638 HB3 ARG 108 HB3 ARG 108 -7.126 -0.248 15.461 639 HG2 ARG 108 HG2 ARG 108 -8.816 -1.759 15.076 640 HG3 ARG 108 HG3 ARG 108 -9.371 -1.726 16.752 641 HD2 ARG 108 HD2 ARG 108 -9.574 0.620 14.879 642 HD3 ARG 108 HD3 ARG 108 -10.870 -0.549 15.118 643 HE ARG 108 HE ARG 108 -9.986 1.495 16.980 644 HH11 ARG 108 HH11 ARG 108 -11.906 -1.376 16.468 645 HH12 ARG 108 HH12 ARG 108 -12.905 -1.105 17.853 646 HH21 ARG 108 HH21 ARG 108 -11.296 1.847 18.809 647 HH22 ARG 108 HH22 ARG 108 -12.560 0.723 19.183 648 H THR 109 H THR 109 -4.191 -1.206 17.758 649 HA THR 109 HA THR 109 -4.802 1.194 19.376 650 HB THR 109 HB THR 109 -2.307 -0.530 19.588 651 HG1 THR 109 HG1 THR 109 -4.485 -0.422 21.397 652 HG21 THR 109 HG21 THR 109 -3.183 1.952 20.925 653 HG22 THR 109 HG22 THR 109 -1.564 1.387 20.514 654 HG23 THR 109 HG23 THR 109 -2.395 0.731 21.925 655 H CYS 110 H CYS 110 -4.819 2.460 17.806 656 HA CYS 110 HA CYS 110 -2.714 2.411 15.832 657 HB2 CYS 110 HB2 CYS 110 -5.292 3.799 16.039 658 HB3 CYS 110 HB3 CYS 110 -4.052 4.508 15.000 659 H LEU 111 H LEU 111 -0.829 2.851 17.143 660 HA LEU 111 HA LEU 111 -0.221 4.922 18.721 661 HB2 LEU 111 HB2 LEU 111 1.758 5.057 16.635 662 HB3 LEU 111 HB3 LEU 111 1.915 4.461 18.272 663 HG LEU 111 HG LEU 111 0.715 2.688 16.185 664 HD11 LEU 111 HD11 LEU 111 2.820 1.966 15.410 665 HD12 LEU 111 HD12 LEU 111 3.677 2.901 16.634 666 HD13 LEU 111 HD13 LEU 111 2.850 3.726 15.315 667 HD21 LEU 111 HD21 LEU 111 2.624 1.603 18.088 668 HD22 LEU 111 HD22 LEU 111 0.967 1.112 17.741 669 HD23 LEU 111 HD23 LEU 111 1.277 2.424 18.877 670 HA PRO 112 HA PRO 112 -1.630 8.399 16.237 671 HB2 PRO 112 HB2 PRO 112 -2.105 10.078 18.274 672 HB3 PRO 112 HB3 PRO 112 -3.192 8.751 17.851 673 HG2 PRO 112 HG2 PRO 112 -1.284 8.990 20.094 674 HG3 PRO 112 HG3 PRO 112 -2.803 8.088 19.996 675 HD2 PRO 112 HD2 PRO 112 -0.184 7.051 19.722 676 HD3 PRO 112 HD3 PRO 112 -1.706 6.200 19.406 677 H CYS 113 H CYS 113 -0.874 10.705 16.107 678 HA CYS 113 HA CYS 113 1.298 11.528 17.446 679 HB2 CYS 113 HB2 CYS 113 3.050 11.793 15.565 680 HB3 CYS 113 HB3 CYS 113 2.894 10.231 16.329 681 H GLY 114 H GLY 114 2.426 13.542 15.874 682 HA2 GLY 114 HA2 GLY 114 2.011 15.571 14.922 683 HA3 GLY 114 HA3 GLY 114 0.654 14.802 14.115 684 HA PRO 115 HA PRO 115 -1.164 18.049 16.870 685 HB2 PRO 115 HB2 PRO 115 -3.126 18.743 15.200 686 HB3 PRO 115 HB3 PRO 115 -1.471 19.322 14.888 687 HG2 PRO 115 HG2 PRO 115 -2.742 16.801 13.961 688 HG3 PRO 115 HG3 PRO 115 -2.186 18.137 12.895 689 HD2 PRO 115 HD2 PRO 115 -0.499 16.167 13.283 690 HD3 PRO 115 HD3 PRO 115 0.115 17.805 13.639 691 H GLY 116 H GLY 116 -2.966 17.590 18.079 692 HA2 GLY 116 HA2 GLY 116 -4.340 16.379 19.259 693 HA3 GLY 116 HA3 GLY 116 -5.064 16.195 17.684 694 H GLY 117 H GLY 117 -2.218 14.607 17.232 695 HA2 GLY 117 HA2 GLY 117 -1.694 12.461 17.394 696 HA3 GLY 117 HA3 GLY 117 -2.784 12.461 18.753 697 H LYS 118 H LYS 118 -3.442 13.517 15.612 698 HA LYS 118 HA LYS 118 -5.733 11.758 15.275 699 HB2 LYS 118 HB2 LYS 118 -4.972 13.923 13.358 700 HB3 LYS 118 HB3 LYS 118 -6.567 13.296 13.747 701 HG2 LYS 118 HG2 LYS 118 -5.430 14.372 16.121 702 HG3 LYS 118 HG3 LYS 118 -5.242 15.553 14.826 703 HD2 LYS 118 HD2 LYS 118 -7.715 15.083 14.317 704 HD3 LYS 118 HD3 LYS 118 -7.754 14.322 15.910 705 HE2 LYS 118 HE2 LYS 118 -8.425 16.493 16.365 706 HE3 LYS 118 HE3 LYS 118 -6.702 16.534 16.732 707 HZ1 LYS 118 HZ1 LYS 118 -6.597 18.250 15.350 708 HZ2 LYS 118 HZ2 LYS 118 -8.165 17.995 14.770 709 HZ3 LYS 118 HZ3 LYS 118 -6.862 17.171 14.074 710 H GLY 119 H GLY 119 -2.485 11.854 14.216 711 HA2 GLY 119 HA2 GLY 119 -3.130 10.095 11.921 712 HA3 GLY 119 HA3 GLY 119 -1.680 11.096 12.020 713 H ARG 120 H ARG 120 -0.560 8.614 11.723 714 HA ARG 120 HA ARG 120 -0.177 7.784 14.453 715 HB2 ARG 120 HB2 ARG 120 -1.053 6.262 12.091 716 HB3 ARG 120 HB3 ARG 120 -0.112 5.424 13.301 717 HG2 ARG 120 HG2 ARG 120 -2.002 5.033 14.406 718 HG3 ARG 120 HG3 ARG 120 -2.249 6.773 14.586 719 HD2 ARG 120 HD2 ARG 120 -4.149 5.580 13.482 720 HD3 ARG 120 HD3 ARG 120 -3.458 6.885 12.526 721 HE ARG 120 HE ARG 120 -2.846 4.035 12.060 722 HH11 ARG 120 HH11 ARG 120 -3.538 7.246 10.845 723 HH12 ARG 120 HH12 ARG 120 -3.398 6.772 9.188 724 HH21 ARG 120 HH21 ARG 120 -2.657 3.436 9.873 725 HH22 ARG 120 HH22 ARG 120 -2.894 4.624 8.636 726 H CYS 121 H CYS 121 1.845 6.298 14.420 727 HA CYS 121 HA CYS 121 3.788 7.392 12.483 728 HB2 CYS 121 HB2 CYS 121 4.042 7.993 14.936 729 HB3 CYS 121 HB3 CYS 121 4.389 6.300 15.235 730 H PHE 122 H PHE 122 5.464 6.057 11.694 731 HA PHE 122 HA PHE 122 5.183 3.168 12.232 732 HB2 PHE 122 HB2 PHE 122 5.353 2.548 9.934 733 HB3 PHE 122 HB3 PHE 122 4.060 3.730 10.037 734 HD1 PHE 122 HD1 PHE 122 4.533 6.074 9.322 735 HD2 PHE 122 HD2 PHE 122 7.190 2.847 8.554 736 HE1 PHE 122 HE1 PHE 122 5.604 7.375 7.550 737 HE2 PHE 122 HE2 PHE 122 8.277 4.154 6.778 738 HZ PHE 122 HZ PHE 122 7.489 6.424 6.277 739 H GLY 123 H GLY 123 7.161 5.701 10.722 740 HA2 GLY 123 HA2 GLY 123 9.580 4.225 11.525 741 HA3 GLY 123 HA3 GLY 123 9.532 5.572 10.384 742 HA PRO 124 HA PRO 124 10.365 7.519 14.427 743 HB2 PRO 124 HB2 PRO 124 12.782 8.639 13.867 744 HB3 PRO 124 HB3 PRO 124 12.608 6.955 14.369 745 HG2 PRO 124 HG2 PRO 124 13.322 8.044 11.745 746 HG3 PRO 124 HG3 PRO 124 13.522 6.399 12.365 747 HD2 PRO 124 HD2 PRO 124 11.437 7.458 10.635 748 HD3 PRO 124 HD3 PRO 124 11.749 5.772 11.097 749 H SER 125 H SER 125 11.658 9.234 11.533 750 HA SER 125 HA SER 125 10.370 11.695 12.433 751 HB2 SER 125 HB2 SER 125 12.655 11.047 10.736 752 HB3 SER 125 HB3 SER 125 11.586 12.227 9.945 753 HG SER 125 HG SER 125 13.140 12.459 12.250 754 H ILE 126 H ILE 126 9.184 9.130 10.977 755 HA ILE 126 HA ILE 126 7.699 10.701 9.006 756 HB ILE 126 HB ILE 126 7.975 7.739 8.752 757 HG12 ILE 126 HG12 ILE 126 9.987 9.683 7.620 758 HG13 ILE 126 HG13 ILE 126 10.255 8.865 9.145 759 HG21 ILE 126 HG21 ILE 126 6.796 9.815 7.298 760 HG22 ILE 126 HG22 ILE 126 6.971 8.139 6.813 761 HG23 ILE 126 HG23 ILE 126 8.194 9.309 6.365 762 HD11 ILE 126 HD11 ILE 126 9.526 6.957 7.141 763 HD12 ILE 126 HD12 ILE 126 10.993 7.062 8.114 764 HD13 ILE 126 HD13 ILE 126 10.881 7.942 6.589 765 H CYS 127 H CYS 127 5.718 11.064 9.462 766 HA CYS 127 HA CYS 127 4.106 9.008 10.815 767 HB2 CYS 127 HB2 CYS 127 4.800 11.649 11.824 768 HB3 CYS 127 HB3 CYS 127 3.063 11.409 11.728 769 H CYS 128 H CYS 128 2.229 8.664 9.901 770 HA CYS 128 HA CYS 128 1.136 10.619 8.042 771 HB2 CYS 128 HB2 CYS 128 0.644 7.885 7.206 772 HB3 CYS 128 HB3 CYS 128 1.267 9.248 6.290 773 H GLY 129 H GLY 129 -0.961 9.844 7.204 774 HA2 GLY 129 HA2 GLY 129 -2.813 8.517 8.908 775 HA3 GLY 129 HA3 GLY 129 -3.077 10.250 8.850 776 H ASP 130 H ASP 130 -5.104 8.917 7.877 777 HA ASP 130 HA ASP 130 -4.980 8.128 5.219 778 HB2 ASP 130 HB2 ASP 130 -6.863 7.684 6.886 779 HB3 ASP 130 HB3 ASP 130 -7.417 9.311 6.500 780 H GLU 131 H GLU 131 -6.049 11.160 6.646 781 HA GLU 131 HA GLU 131 -5.395 12.448 4.131 782 HB2 GLU 131 HB2 GLU 131 -7.153 14.121 5.446 783 HB3 GLU 131 HB3 GLU 131 -7.597 13.052 4.128 784 HG2 GLU 131 HG2 GLU 131 -7.965 11.320 6.057 785 HG3 GLU 131 HG3 GLU 131 -8.058 12.763 7.065 786 H LEU 132 H LEU 132 -3.997 11.807 6.608 787 HA LEU 132 HA LEU 132 -3.157 14.476 7.395 788 HB2 LEU 132 HB2 LEU 132 -3.978 12.237 8.856 789 HB3 LEU 132 HB3 LEU 132 -2.246 12.294 9.023 790 HG LEU 132 HG LEU 132 -4.164 14.519 9.724 791 HD11 LEU 132 HD11 LEU 132 -4.271 12.564 11.219 792 HD12 LEU 132 HD12 LEU 132 -3.680 14.025 12.019 793 HD13 LEU 132 HD13 LEU 132 -2.547 12.760 11.548 794 HD21 LEU 132 HD21 LEU 132 -2.322 15.738 10.571 795 HD22 LEU 132 HD22 LEU 132 -1.884 15.226 8.942 796 HD23 LEU 132 HD23 LEU 132 -1.238 14.376 10.337 797 H GLY 133 H GLY 133 -2.673 11.966 5.485 798 HA2 GLY 133 HA2 GLY 133 -0.943 11.066 4.400 799 HA3 GLY 133 HA3 GLY 133 -0.505 12.723 4.331 800 H CYS 134 H CYS 134 1.803 12.493 4.534 801 HA CYS 134 HA CYS 134 2.577 11.459 7.152 802 HB2 CYS 134 HB2 CYS 134 2.977 9.920 4.996 803 HB3 CYS 134 HB3 CYS 134 4.454 10.852 4.975 804 H PHE 135 H PHE 135 3.748 12.765 8.271 805 HA PHE 135 HA PHE 135 5.105 14.926 6.897 806 HB2 PHE 135 HB2 PHE 135 5.574 14.742 9.775 807 HB3 PHE 135 HB3 PHE 135 4.895 16.074 8.847 808 HD1 PHE 135 HD1 PHE 135 2.438 16.079 8.348 809 HD2 PHE 135 HD2 PHE 135 4.222 13.331 11.058 810 HE1 PHE 135 HE1 PHE 135 0.226 15.590 9.308 811 HE2 PHE 135 HE2 PHE 135 2.015 12.846 12.026 812 HZ PHE 135 HZ PHE 135 0.023 13.967 11.153 813 H VAL 136 H VAL 136 6.985 14.150 6.024 814 HA VAL 136 HA VAL 136 8.374 12.103 7.562 815 HB VAL 136 HB VAL 136 9.362 13.023 4.884 816 HG11 VAL 136 HG11 VAL 136 9.939 10.937 6.701 817 HG12 VAL 136 HG12 VAL 136 10.674 11.249 5.132 818 HG13 VAL 136 HG13 VAL 136 9.265 10.198 5.249 819 HG21 VAL 136 HG21 VAL 136 6.850 12.703 4.763 820 HG22 VAL 136 HG22 VAL 136 7.119 11.004 5.144 821 HG23 VAL 136 HG23 VAL 136 7.781 11.686 3.658 822 H GLY 137 H GLY 137 8.914 13.404 9.186 823 HA2 GLY 137 HA2 GLY 137 10.944 14.287 10.178 824 HA3 GLY 137 HA3 GLY 137 11.315 15.070 8.653 825 H THR 138 H THR 138 9.575 15.291 11.646 826 HA THR 138 HA THR 138 9.663 18.056 11.841 827 HB THR 138 HB THR 138 8.075 18.501 10.223 828 HG1 THR 138 HG1 THR 138 6.078 18.876 11.337 829 HG21 THR 138 HG21 THR 138 7.139 16.717 9.279 830 HG22 THR 138 HG22 THR 138 5.835 16.991 10.437 831 HG23 THR 138 HG23 THR 138 7.096 15.811 10.792 832 H ALA 139 H ALA 139 8.102 18.817 13.857 833 HA ALA 139 HA ALA 139 8.494 16.945 15.876 834 HB1 ALA 139 HB1 ALA 139 8.434 19.321 16.317 835 HB2 ALA 139 HB2 ALA 139 7.141 18.527 17.217 836 HB3 ALA 139 HB3 ALA 139 6.770 19.412 15.742 837 H GLU 140 H GLU 140 6.091 17.184 13.491 838 HA GLU 140 HA GLU 140 3.878 16.184 14.964 839 HB2 GLU 140 HB2 GLU 140 4.513 16.744 12.174 840 HB3 GLU 140 HB3 GLU 140 3.531 15.302 12.362 841 HG2 GLU 140 HG2 GLU 140 1.753 16.463 13.266 842 HG3 GLU 140 HG3 GLU 140 2.762 17.821 13.760 843 H ALA 141 H ALA 141 6.803 14.810 13.910 844 HA ALA 141 HA ALA 141 5.783 12.102 14.399 845 HB1 ALA 141 HB1 ALA 141 6.452 12.583 12.029 846 HB2 ALA 141 HB2 ALA 141 7.291 11.229 12.786 847 HB3 ALA 141 HB3 ALA 141 8.104 12.784 12.611 848 H LEU 142 H LEU 142 7.923 14.521 15.460 849 HA LEU 142 HA LEU 142 10.035 12.963 16.422 850 HB2 LEU 142 HB2 LEU 142 10.835 14.995 16.920 851 HB3 LEU 142 HB3 LEU 142 9.372 15.606 16.186 852 HG LEU 142 HG LEU 142 9.191 14.860 18.978 853 HD11 LEU 142 HD11 LEU 142 10.556 17.398 18.118 854 HD12 LEU 142 HD12 LEU 142 11.388 16.008 18.839 855 HD13 LEU 142 HD13 LEU 142 10.206 16.918 19.786 856 HD21 LEU 142 HD21 LEU 142 7.498 16.044 17.354 857 HD22 LEU 142 HD22 LEU 142 8.286 17.465 18.027 858 HD23 LEU 142 HD23 LEU 142 7.494 16.307 19.092 859 H ARG 143 H ARG 143 6.950 14.002 17.665 860 HA ARG 143 HA ARG 143 7.243 13.103 20.326 861 HB2 ARG 143 HB2 ARG 143 4.843 13.350 20.475 862 HB3 ARG 143 HB3 ARG 143 5.462 14.676 19.507 863 HG2 ARG 143 HG2 ARG 143 4.419 13.994 17.630 864 HG3 ARG 143 HG3 ARG 143 4.601 12.282 18.016 865 HD2 ARG 143 HD2 ARG 143 2.254 13.018 18.057 866 HD3 ARG 143 HD3 ARG 143 2.802 12.409 19.617 867 HE ARG 143 HE ARG 143 2.860 15.295 19.157 868 HH11 ARG 143 HH11 ARG 143 1.358 12.549 20.720 869 HH12 ARG 143 HH12 ARG 143 0.502 13.520 21.867 870 HH21 ARG 143 HH21 ARG 143 1.724 16.563 20.664 871 HH22 ARG 143 HH22 ARG 143 0.706 15.793 21.836 872 H CYS 144 H CYS 144 7.429 11.259 17.482 873 HA CYS 144 HA CYS 144 5.863 9.058 18.477 874 HB2 CYS 144 HB2 CYS 144 5.837 9.429 16.119 875 HB3 CYS 144 HB3 CYS 144 7.571 9.661 16.067 876 H GLN 145 H GLN 145 8.489 10.463 19.567 877 HA GLN 145 HA GLN 145 10.448 8.411 19.560 878 HB2 GLN 145 HB2 GLN 145 10.169 11.103 20.599 879 HB3 GLN 145 HB3 GLN 145 10.900 10.042 21.795 880 HG2 GLN 145 HG2 GLN 145 11.923 10.052 18.992 881 HG3 GLN 145 HG3 GLN 145 12.390 11.332 20.110 882 HE21 GLN 145 HE21 GLN 145 14.548 10.625 19.994 883 HE22 GLN 145 HE22 GLN 145 15.081 9.221 20.847 884 H GLU 146 H GLU 146 7.525 8.973 21.301 885 HA GLU 146 HA GLU 146 8.416 7.322 23.532 886 HB2 GLU 146 HB2 GLU 146 6.573 8.025 24.674 887 HB3 GLU 146 HB3 GLU 146 6.656 9.332 23.504 888 HG2 GLU 146 HG2 GLU 146 4.916 6.888 23.242 889 HG3 GLU 146 HG3 GLU 146 4.381 8.459 23.835 890 H GLU 147 H GLU 147 7.772 6.613 20.497 891 HA GLU 147 HA GLU 147 6.006 4.358 20.877 892 HB2 GLU 147 HB2 GLU 147 6.652 5.933 18.700 893 HB3 GLU 147 HB3 GLU 147 7.549 4.455 18.385 894 HG2 GLU 147 HG2 GLU 147 4.638 4.413 19.092 895 HG3 GLU 147 HG3 GLU 147 5.195 4.649 17.435 896 H ASN 148 H ASN 148 9.108 4.974 21.716 897 HA ASN 148 HA ASN 148 10.353 2.546 20.838 898 HB2 ASN 148 HB2 ASN 148 11.108 4.861 22.519 899 HB3 ASN 148 HB3 ASN 148 11.882 3.337 22.943 900 HD21 ASN 148 HD21 ASN 148 13.868 3.423 22.173 901 HD22 ASN 148 HD22 ASN 148 14.311 3.869 20.564 902 H TYR 149 H TYR 149 8.419 3.593 23.523 903 HA TYR 149 HA TYR 149 8.753 0.938 24.811 904 HB2 TYR 149 HB2 TYR 149 9.269 3.249 26.026 905 HB3 TYR 149 HB3 TYR 149 7.525 3.244 26.267 906 HD1 TYR 149 HD1 TYR 149 6.975 0.392 26.708 907 HD2 TYR 149 HD2 TYR 149 10.183 2.804 28.119 908 HE1 TYR 149 HE1 TYR 149 7.257 -1.117 28.627 909 HE2 TYR 149 HE2 TYR 149 10.474 1.301 30.043 910 HH TYR 149 HH TYR 149 9.774 -0.547 31.071 911 H LEU 150 H LEU 150 7.110 0.941 22.673 912 HA LEU 150 HA LEU 150 4.463 0.660 23.904 913 HB2 LEU 150 HB2 LEU 150 4.984 2.842 22.418 914 HB3 LEU 150 HB3 LEU 150 4.499 1.735 21.148 915 HG LEU 150 HG LEU 150 2.492 1.359 22.948 916 HD11 LEU 150 HD11 LEU 150 2.729 2.967 24.511 917 HD12 LEU 150 HD12 LEU 150 1.942 3.966 23.288 918 HD13 LEU 150 HD13 LEU 150 3.697 4.001 23.459 919 HD21 LEU 150 HD21 LEU 150 1.266 1.992 21.199 920 HD22 LEU 150 HD22 LEU 150 2.789 2.327 20.375 921 HD23 LEU 150 HD23 LEU 150 1.938 3.623 21.217 922 HA PRO 151 HA PRO 151 5.214 -3.033 21.342 923 HB2 PRO 151 HB2 PRO 151 4.323 -4.851 23.068 924 HB3 PRO 151 HB3 PRO 151 5.882 -4.054 23.319 925 HG2 PRO 151 HG2 PRO 151 3.253 -3.537 24.640 926 HG3 PRO 151 HG3 PRO 151 4.880 -3.540 25.343 927 HD2 PRO 151 HD2 PRO 151 3.462 -1.274 24.548 928 HD3 PRO 151 HD3 PRO 151 5.213 -1.351 24.824 929 H SER 152 H SER 152 2.823 -1.245 21.187 930 HA SER 152 HA SER 152 0.835 -3.309 20.506 931 HB2 SER 152 HB2 SER 152 -0.939 -1.645 21.112 932 HB3 SER 152 HB3 SER 152 0.022 -2.191 22.487 933 HG SER 152 HG SER 152 0.876 -0.252 22.683 934 HA PRO 153 HA PRO 153 1.623 -0.722 16.781 935 HB2 PRO 153 HB2 PRO 153 2.342 -2.659 15.099 936 HB3 PRO 153 HB3 PRO 153 3.462 -2.050 16.323 937 HG2 PRO 153 HG2 PRO 153 1.843 -4.562 16.315 938 HG3 PRO 153 HG3 PRO 153 3.502 -4.299 16.879 939 HD2 PRO 153 HD2 PRO 153 1.237 -4.380 18.497 940 HD3 PRO 153 HD3 PRO 153 2.802 -3.681 18.952 941 H CYS 154 H CYS 154 -0.300 -0.060 15.988 942 HA CYS 154 HA CYS 154 -2.591 -1.637 15.527 943 HB2 CYS 154 HB2 CYS 154 -2.008 1.052 15.464 944 HB3 CYS 154 HB3 CYS 154 -2.237 0.712 13.762 945 H GLN 155 H GLN 155 -2.244 -3.516 14.209 946 HA GLN 155 HA GLN 155 -0.565 -3.665 12.010 947 HB2 GLN 155 HB2 GLN 155 -2.180 -5.441 13.071 948 HB3 GLN 155 HB3 GLN 155 -3.258 -4.921 11.787 949 HG2 GLN 155 HG2 GLN 155 -2.062 -6.857 11.060 950 HG3 GLN 155 HG3 GLN 155 -1.515 -5.462 10.137 951 HE21 GLN 155 HE21 GLN 155 -0.678 -6.804 13.320 952 HE22 GLN 155 HE22 GLN 155 1.019 -6.888 13.025 953 H SER 156 H SER 156 -0.452 -2.733 10.062 954 HA SER 156 HA SER 156 -2.666 -2.059 8.430 955 HB2 SER 156 HB2 SER 156 -1.750 -0.042 10.371 956 HB3 SER 156 HB3 SER 156 -1.808 0.550 8.715 957 HG SER 156 HG SER 156 -3.984 -0.880 9.771 958 H GLY 157 H GLY 157 -1.539 0.090 6.935 959 HA2 GLY 157 HA2 GLY 157 0.060 0.573 5.433 960 HA3 GLY 157 HA3 GLY 157 1.209 -0.230 6.493 961 H GLN 158 H GLN 158 -1.598 -1.258 4.474 962 HA GLN 158 HA GLN 158 0.312 -3.246 3.402 963 HB2 GLN 158 HB2 GLN 158 -1.471 -4.254 4.826 964 HB3 GLN 158 HB3 GLN 158 -2.686 -3.524 3.791 965 HG2 GLN 158 HG2 GLN 158 -1.658 -4.862 1.897 966 HG3 GLN 158 HG3 GLN 158 -0.784 -5.746 3.145 967 HE21 GLN 158 HE21 GLN 158 -4.068 -4.714 2.290 968 HE22 GLN 158 HE22 GLN 158 -4.851 -6.148 2.852 969 H LYS 159 H LYS 159 0.455 -1.055 2.318 970 HA LYS 159 HA LYS 159 -0.966 -1.256 -0.216 971 HB2 LYS 159 HB2 LYS 159 -0.270 1.165 1.330 972 HB3 LYS 159 HB3 LYS 159 -0.344 1.246 -0.429 973 HG2 LYS 159 HG2 LYS 159 -2.607 -0.049 0.984 974 HG3 LYS 159 HG3 LYS 159 -2.459 1.704 1.114 975 HD2 LYS 159 HD2 LYS 159 -3.480 1.855 -0.858 976 HD3 LYS 159 HD3 LYS 159 -2.042 1.139 -1.588 977 HE2 LYS 159 HE2 LYS 159 -3.874 -0.170 -2.311 978 HE3 LYS 159 HE3 LYS 159 -3.050 -1.116 -1.073 979 HZ1 LYS 159 HZ1 LYS 159 -5.693 0.100 -1.028 980 HZ2 LYS 159 HZ2 LYS 159 -4.823 0.163 0.421 981 HZ3 LYS 159 HZ3 LYS 159 -5.145 -1.329 -0.308 982 HA PRO 160 HA PRO 160 3.855 -1.787 -0.070 983 HB2 PRO 160 HB2 PRO 160 3.568 -4.057 -1.806 984 HB3 PRO 160 HB3 PRO 160 4.188 -4.006 -0.153 985 HG2 PRO 160 HG2 PRO 160 1.470 -4.657 -1.127 986 HG3 PRO 160 HG3 PRO 160 2.293 -5.180 0.352 987 HD2 PRO 160 HD2 PRO 160 0.304 -3.387 0.432 988 HD3 PRO 160 HD3 PRO 160 1.709 -3.237 1.508 989 H CYS 161 H CYS 161 4.740 -0.430 -1.216 990 HA CYS 161 HA CYS 161 4.560 -0.477 -4.099 991 HB2 CYS 161 HB2 CYS 161 3.622 1.516 -4.403 992 HB3 CYS 161 HB3 CYS 161 3.119 1.413 -2.723 993 H GLY 162 H GLY 162 6.243 1.781 -4.386 994 HA2 GLY 162 HA2 GLY 162 8.624 1.985 -4.721 995 HA3 GLY 162 HA3 GLY 162 8.391 2.110 -2.990 996 H SER 163 H SER 163 10.652 1.468 -3.041 997 HA SER 163 HA SER 163 11.333 -1.236 -3.740 998 HB2 SER 163 HB2 SER 163 13.564 -0.576 -2.696 999 HB3 SER 163 HB3 SER 163 13.050 0.368 -4.094 1000 HG SER 163 HG SER 163 12.353 1.246 -1.521 1001 H GLY 164 H GLY 164 9.291 -1.321 -1.882 1002 HA2 GLY 164 HA2 GLY 164 9.306 -3.171 -0.260 1003 HA3 GLY 164 HA3 GLY 164 10.707 -2.417 0.470 1004 H GLY 165 H GLY 165 8.445 -0.088 -0.385 1005 HA2 GLY 165 HA2 GLY 165 7.639 0.090 2.448 1006 HA3 GLY 165 HA3 GLY 165 7.630 1.413 1.312 1007 H ARG 166 H ARG 166 5.600 0.882 3.087 1008 HA ARG 166 HA ARG 166 3.412 -0.006 1.363 1009 HB2 ARG 166 HB2 ARG 166 2.189 0.312 3.763 1010 HB3 ARG 166 HB3 ARG 166 2.848 -1.214 3.193 1011 HG2 ARG 166 HG2 ARG 166 4.559 0.679 4.752 1012 HG3 ARG 166 HG3 ARG 166 3.408 -0.372 5.577 1013 HD2 ARG 166 HD2 ARG 166 5.704 -1.192 3.807 1014 HD3 ARG 166 HD3 ARG 166 5.532 -1.471 5.539 1015 HE ARG 166 HE ARG 166 3.364 -2.677 4.272 1016 HH11 ARG 166 HH11 ARG 166 6.831 -3.025 4.436 1017 HH12 ARG 166 HH12 ARG 166 6.801 -4.724 4.104 1018 HH21 ARG 166 HH21 ARG 166 3.321 -4.909 3.833 1019 HH22 ARG 166 HH22 ARG 166 4.809 -5.794 3.760 1020 H CYS 167 H CYS 167 1.468 1.433 1.289 1021 HA CYS 167 HA CYS 167 2.160 4.035 0.867 1022 HB2 CYS 167 HB2 CYS 167 0.184 2.974 -0.155 1023 HB3 CYS 167 HB3 CYS 167 -0.584 2.910 1.426 1024 H ALA 168 H ALA 168 2.698 5.482 2.303 1025 HA ALA 168 HA ALA 168 2.311 5.159 5.073 1026 HB1 ALA 168 HB1 ALA 168 3.939 6.698 4.959 1027 HB2 ALA 168 HB2 ALA 168 2.680 7.885 4.609 1028 HB3 ALA 168 HB3 ALA 168 3.541 7.100 3.287 1029 H ALA 169 H ALA 169 0.794 7.156 2.530 1030 HA ALA 169 HA ALA 169 -1.796 7.133 3.774 1031 HB1 ALA 169 HB1 ALA 169 -0.247 9.693 3.613 1032 HB2 ALA 169 HB2 ALA 169 -0.506 8.799 5.112 1033 HB3 ALA 169 HB3 ALA 169 -1.879 9.465 4.219 1034 H ALA 170 H ALA 170 -3.264 8.499 2.352 1035 HA ALA 170 HA ALA 170 -3.076 7.918 -0.294 1036 HB1 ALA 170 HB1 ALA 170 -4.342 10.485 0.576 1037 HB2 ALA 170 HB2 ALA 170 -5.084 8.903 0.818 1038 HB3 ALA 170 HB3 ALA 170 -4.747 9.480 -0.821 1039 H GLY 171 H GLY 171 -2.056 8.554 -2.018 1040 HA2 GLY 171 HA2 GLY 171 -0.870 9.802 -3.511 1041 HA3 GLY 171 HA3 GLY 171 -1.033 11.156 -2.439 1042 H ILE 172 H ILE 172 0.347 9.352 -0.294 1043 HA ILE 172 HA ILE 172 3.073 9.424 -1.408 1044 HB ILE 172 HB ILE 172 3.884 10.305 0.755 1045 HG12 ILE 172 HG12 ILE 172 1.614 11.748 1.579 1046 HG13 ILE 172 HG13 ILE 172 1.088 10.072 1.391 1047 HG21 ILE 172 HG21 ILE 172 4.053 12.148 -0.461 1048 HG22 ILE 172 HG22 ILE 172 2.419 12.603 0.015 1049 HG23 ILE 172 HG23 ILE 172 2.681 11.656 -1.449 1050 HD11 ILE 172 HD11 ILE 172 3.653 10.475 2.700 1051 HD12 ILE 172 HD12 ILE 172 2.351 9.349 3.083 1052 HD13 ILE 172 HD13 ILE 172 2.243 11.031 3.593 1053 H CYS 173 H CYS 173 3.863 7.539 -1.335 1054 HA CYS 173 HA CYS 173 3.070 5.624 0.722 1055 HB2 CYS 173 HB2 CYS 173 2.524 4.714 -1.332 1056 HB3 CYS 173 HB3 CYS 173 3.926 5.413 -2.126 1057 H CYS 174 H CYS 174 4.467 5.457 2.347 1058 HA CYS 174 HA CYS 174 7.204 6.231 2.037 1059 HB2 CYS 174 HB2 CYS 174 5.419 5.570 4.315 1060 HB3 CYS 174 HB3 CYS 174 7.158 5.434 4.557 1061 H SER 175 H SER 175 8.983 5.069 2.435 1062 HA SER 175 HA SER 175 8.772 2.133 2.384 1063 HB2 SER 175 HB2 SER 175 10.967 2.273 1.059 1064 HB3 SER 175 HB3 SER 175 9.521 2.777 0.199 1065 HG SER 175 HG SER 175 11.545 4.170 0.210 1066 HA PRO 176 HA PRO 176 11.591 2.229 5.779 1067 HB2 PRO 176 HB2 PRO 176 13.727 0.665 5.205 1068 HB3 PRO 176 HB3 PRO 176 12.118 0.002 5.507 1069 HG2 PRO 176 HG2 PRO 176 13.515 0.481 2.910 1070 HG3 PRO 176 HG3 PRO 176 12.500 -0.887 3.403 1071 HD2 PRO 176 HD2 PRO 176 11.622 1.159 1.831 1072 HD3 PRO 176 HD3 PRO 176 10.556 0.213 2.884 1073 H ASP 177 H ASP 177 12.009 4.246 3.614 1074 HA ASP 177 HA ASP 177 14.536 5.293 4.586 1075 HB2 ASP 177 HB2 ASP 177 15.244 5.907 2.270 1076 HB3 ASP 177 HB3 ASP 177 15.236 4.170 2.564 1077 H GLY 178 H GLY 178 11.753 5.877 2.408 1078 HA2 GLY 178 HA2 GLY 178 11.269 8.393 3.755 1079 HA3 GLY 178 HA3 GLY 178 11.729 8.543 2.073 1080 H CYS 179 H CYS 179 9.923 9.317 1.226 1081 HA CYS 179 HA CYS 179 7.637 7.512 1.085 1082 HB2 CYS 179 HB2 CYS 179 7.631 9.877 2.643 1083 HB3 CYS 179 HB3 CYS 179 6.644 10.199 1.221 1084 H HIS 180 H HIS 180 6.278 7.866 -0.797 1085 HA HIS 180 HA HIS 180 7.193 9.855 -2.721 1086 HB2 HIS 180 HB2 HIS 180 7.407 7.872 -4.443 1087 HB3 HIS 180 HB3 HIS 180 8.769 8.321 -3.420 1088 HD1 HIS 180 HD1 HIS 180 9.179 6.763 -1.294 1089 HD2 HIS 180 HD2 HIS 180 6.504 5.297 -4.115 1090 HE1 HIS 180 HE1 HIS 180 8.911 4.323 -0.761 1091 HE2 HIS 180 HE2 HIS 180 7.349 3.443 -2.523 1092 H GLU 181 H GLU 181 5.894 9.918 -4.672 1093 HA GLU 181 HA GLU 181 3.164 9.755 -4.107 1094 HB2 GLU 181 HB2 GLU 181 3.010 11.022 -5.946 1095 HB3 GLU 181 HB3 GLU 181 4.751 10.884 -6.093 1096 HG2 GLU 181 HG2 GLU 181 4.463 9.953 -8.074 1097 HG3 GLU 181 HG3 GLU 181 3.693 8.575 -7.298 1098 H ASP 182 H ASP 182 1.591 8.304 -4.603 1099 HA ASP 182 HA ASP 182 2.358 5.851 -6.023 1100 HB2 ASP 182 HB2 ASP 182 1.602 4.403 -4.295 1101 HB3 ASP 182 HB3 ASP 182 2.641 5.596 -3.510 1102 HA PRO 183 HA PRO 183 -1.604 6.544 -7.890 1103 HB2 PRO 183 HB2 PRO 183 -1.602 3.849 -8.946 1104 HB3 PRO 183 HB3 PRO 183 -1.307 5.372 -9.786 1105 HG2 PRO 183 HG2 PRO 183 0.622 3.493 -9.352 1106 HG3 PRO 183 HG3 PRO 183 0.959 5.223 -9.529 1107 HD2 PRO 183 HD2 PRO 183 0.769 3.572 -7.037 1108 HD3 PRO 183 HD3 PRO 183 1.919 4.861 -7.454 1109 H ALA 184 H ALA 184 -1.175 3.739 -5.830 1110 HA ALA 184 HA ALA 184 -3.877 2.886 -5.841 1111 HB1 ALA 184 HB1 ALA 184 -1.449 2.136 -4.491 1112 HB2 ALA 184 HB2 ALA 184 -2.920 1.193 -4.729 1113 HB3 ALA 184 HB3 ALA 184 -2.770 2.254 -3.328 1114 H CYS 185 H CYS 185 -1.932 4.999 -3.883 1115 HA CYS 185 HA CYS 185 -4.303 6.020 -2.509 1116 HB2 CYS 185 HB2 CYS 185 -1.413 6.626 -1.919 1117 HB3 CYS 185 HB3 CYS 185 -2.805 6.972 -0.920 1118 H ASP 186 H ASP 186 -4.874 6.962 -4.590 1119 HA ASP 186 HA ASP 186 -4.250 9.705 -4.708 1120 HB2 ASP 186 HB2 ASP 186 -2.606 7.964 -6.248 1121 HB3 ASP 186 HB3 ASP 186 -3.675 8.852 -7.330 1122 HA PRO 187 HA PRO 187 -7.806 7.975 -7.376 1123 HB2 PRO 187 HB2 PRO 187 -9.601 7.803 -5.082 1124 HB3 PRO 187 HB3 PRO 187 -9.260 6.603 -6.324 1125 HG2 PRO 187 HG2 PRO 187 -8.495 6.331 -3.742 1126 HG3 PRO 187 HG3 PRO 187 -7.612 5.614 -5.102 1127 HD2 PRO 187 HD2 PRO 187 -7.005 8.072 -3.529 1128 HD3 PRO 187 HD3 PRO 187 -5.914 6.851 -4.201 1129 H GLU 188 H GLU 188 -9.836 8.923 -7.472 1130 HA GLU 188 HA GLU 188 -10.201 11.506 -7.822 1131 HB2 GLU 188 HB2 GLU 188 -12.528 11.495 -7.176 1132 HB3 GLU 188 HB3 GLU 188 -12.126 9.930 -7.871 1133 HG2 GLU 188 HG2 GLU 188 -12.443 8.828 -5.929 1134 HG3 GLU 188 HG3 GLU 188 -11.847 10.163 -4.946 1135 H ALA 189 H ALA 189 -9.658 10.156 -4.698 1136 HA ALA 189 HA ALA 189 -10.299 12.048 -2.954 1137 HB1 ALA 189 HB1 ALA 189 -8.022 10.112 -3.051 1138 HB2 ALA 189 HB2 ALA 189 -9.450 10.140 -1.990 1139 HB3 ALA 189 HB3 ALA 189 -8.135 11.280 -1.715 1140 H ALA 190 H ALA 190 -8.251 12.734 -5.457 1141 HA ALA 190 HA ALA 190 -6.455 14.488 -4.245 1142 HB1 ALA 190 HB1 ALA 190 -6.559 13.509 -6.665 1143 HB2 ALA 190 HB2 ALA 190 -5.798 15.072 -6.372 1144 HB3 ALA 190 HB3 ALA 190 -7.439 14.996 -7.015 1145 H PHE 191 H PHE 191 -6.353 16.785 -4.365 1146 HA PHE 191 HA PHE 191 -8.945 18.119 -3.965 1147 HB2 PHE 191 HB2 PHE 191 -6.521 18.205 -2.534 1148 HB3 PHE 191 HB3 PHE 191 -6.640 19.759 -3.356 1149 HD1 PHE 191 HD1 PHE 191 -9.250 20.629 -3.303 1150 HD2 PHE 191 HD2 PHE 191 -7.282 18.241 -0.386 1151 HE1 PHE 191 HE1 PHE 191 -10.852 21.397 -1.601 1152 HE2 PHE 191 HE2 PHE 191 -8.876 19.004 1.323 1153 HZ PHE 191 HZ PHE 191 -10.666 20.583 0.716 1154 H SER 192 H SER 192 -9.603 18.752 -6.016 1155 HA SER 192 HA SER 192 -7.694 19.887 -7.875 1156 HB2 SER 192 HB2 SER 192 -9.702 20.163 -9.354 1157 HB3 SER 192 HB3 SER 192 -9.427 18.504 -8.822 1158 HG SER 192 HG SER 192 -11.651 19.617 -8.656 Start of MODEL 3 1 H1 ALA 1 H1 ALA 1 26.926 31.796 -4.445 2 H2 ALA 1 H2 ALA 1 27.071 33.173 -5.458 3 H3 ALA 1 H3 ALA 1 28.300 31.975 -5.455 4 HA ALA 1 HA ALA 1 25.945 32.135 -6.982 5 HB1 ALA 1 HB1 ALA 1 28.569 30.930 -7.029 6 HB2 ALA 1 HB2 ALA 1 27.518 31.381 -8.370 7 HB3 ALA 1 HB3 ALA 1 27.343 29.803 -7.604 8 H VAL 2 H VAL 2 24.125 31.542 -5.598 9 HA VAL 2 HA VAL 2 23.521 28.776 -5.679 10 HB VAL 2 HB VAL 2 25.212 28.643 -3.870 11 HG11 VAL 2 HG11 VAL 2 24.665 29.544 -1.653 12 HG12 VAL 2 HG12 VAL 2 23.255 30.349 -2.337 13 HG13 VAL 2 HG13 VAL 2 24.871 30.821 -2.851 14 HG21 VAL 2 HG21 VAL 2 23.883 26.838 -3.597 15 HG22 VAL 2 HG22 VAL 2 22.402 27.792 -3.610 16 HG23 VAL 2 HG23 VAL 2 23.370 27.690 -2.141 17 H LEU 3 H LEU 3 22.189 30.848 -6.486 18 HA LEU 3 HA LEU 3 19.763 30.874 -4.819 19 HB2 LEU 3 HB2 LEU 3 21.102 33.264 -6.124 20 HB3 LEU 3 HB3 LEU 3 19.390 33.247 -5.780 21 HG LEU 3 HG LEU 3 20.717 34.506 -4.123 22 HD11 LEU 3 HD11 LEU 3 18.532 33.385 -3.533 23 HD12 LEU 3 HD12 LEU 3 19.622 33.730 -2.181 24 HD13 LEU 3 HD13 LEU 3 19.509 32.098 -2.816 25 HD21 LEU 3 HD21 LEU 3 22.463 32.362 -4.277 26 HD22 LEU 3 HD22 LEU 3 21.748 32.241 -2.671 27 HD23 LEU 3 HD23 LEU 3 22.553 33.727 -3.171 28 H ASP 4 H ASP 4 18.684 29.511 -6.111 29 HA ASP 4 HA ASP 4 18.825 29.690 -8.999 30 HB2 ASP 4 HB2 ASP 4 18.181 27.627 -7.317 31 HB3 ASP 4 HB3 ASP 4 16.588 28.136 -7.868 32 H LEU 5 H LEU 5 17.840 31.945 -7.232 33 HA LEU 5 HA LEU 5 15.442 32.687 -8.603 34 HB2 LEU 5 HB2 LEU 5 15.273 31.599 -6.193 35 HB3 LEU 5 HB3 LEU 5 15.816 33.178 -5.690 36 HG LEU 5 HG LEU 5 13.453 33.142 -5.472 37 HD11 LEU 5 HD11 LEU 5 14.104 35.243 -6.302 38 HD12 LEU 5 HD12 LEU 5 12.674 34.776 -7.212 39 HD13 LEU 5 HD13 LEU 5 14.271 34.635 -7.947 40 HD21 LEU 5 HD21 LEU 5 12.922 31.229 -6.826 41 HD22 LEU 5 HD22 LEU 5 13.337 32.103 -8.297 42 HD23 LEU 5 HD23 LEU 5 11.943 32.598 -7.337 43 H ASP 6 H ASP 6 15.871 34.889 -6.435 44 HA ASP 6 HA ASP 6 18.398 36.022 -7.220 45 HB2 ASP 6 HB2 ASP 6 16.772 36.251 -9.115 46 HB3 ASP 6 HB3 ASP 6 15.936 37.480 -8.146 47 H VAL 7 H VAL 7 15.348 36.526 -5.971 48 HA VAL 7 HA VAL 7 16.496 37.636 -3.481 49 HB VAL 7 HB VAL 7 15.339 39.598 -4.503 50 HG11 VAL 7 HG11 VAL 7 13.424 37.705 -5.275 51 HG12 VAL 7 HG12 VAL 7 13.388 39.447 -5.541 52 HG13 VAL 7 HG13 VAL 7 12.627 38.758 -4.107 53 HG21 VAL 7 HG21 VAL 7 15.450 39.310 -2.064 54 HG22 VAL 7 HG22 VAL 7 13.895 38.481 -2.102 55 HG23 VAL 7 HG23 VAL 7 14.000 40.179 -2.567 56 H ARG 8 H ARG 8 15.941 36.103 -1.927 57 HA ARG 8 HA ARG 8 14.537 33.974 -3.009 58 HB2 ARG 8 HB2 ARG 8 14.762 33.821 -0.127 59 HB3 ARG 8 HB3 ARG 8 15.470 32.792 -1.360 60 HG2 ARG 8 HG2 ARG 8 17.429 33.541 -0.606 61 HG3 ARG 8 HG3 ARG 8 17.069 35.017 -1.487 62 HD2 ARG 8 HD2 ARG 8 16.156 36.043 0.483 63 HD3 ARG 8 HD3 ARG 8 16.280 34.535 1.382 64 HE ARG 8 HE ARG 8 18.481 36.323 0.651 65 HH11 ARG 8 HH11 ARG 8 17.424 33.396 2.246 66 HH12 ARG 8 HH12 ARG 8 18.871 33.241 3.181 67 HH21 ARG 8 HH21 ARG 8 20.382 36.110 1.892 68 HH22 ARG 8 HH22 ARG 8 20.546 34.773 2.983 69 H THR 9 H THR 9 12.468 34.015 -3.323 70 HA THR 9 HA THR 9 11.020 35.199 -1.048 71 HB THR 9 HB THR 9 9.028 34.785 -2.774 72 HG1 THR 9 HG1 THR 9 9.614 34.457 -4.762 73 HG21 THR 9 HG21 THR 9 10.032 37.033 -4.002 74 HG22 THR 9 HG22 THR 9 10.790 37.067 -2.410 75 HG23 THR 9 HG23 THR 9 9.033 37.003 -2.549 76 H CYS 10 H CYS 10 11.380 33.611 0.203 77 HA CYS 10 HA CYS 10 11.028 30.892 -0.670 78 HB2 CYS 10 HB2 CYS 10 12.133 32.200 1.662 79 HB3 CYS 10 HB3 CYS 10 11.230 30.758 2.073 80 H LEU 11 H LEU 11 8.838 31.135 -1.419 81 HA LEU 11 HA LEU 11 6.560 31.867 -0.329 82 HB2 LEU 11 HB2 LEU 11 7.083 29.203 -1.614 83 HB3 LEU 11 HB3 LEU 11 5.470 29.769 -1.229 84 HG LEU 11 HG LEU 11 5.915 30.160 -3.559 85 HD11 LEU 11 HD11 LEU 11 6.179 32.930 -2.995 86 HD12 LEU 11 HD12 LEU 11 5.208 32.189 -1.722 87 HD13 LEU 11 HD13 LEU 11 4.729 32.017 -3.410 88 HD21 LEU 11 HD21 LEU 11 8.277 31.814 -2.700 89 HD22 LEU 11 HD22 LEU 11 7.708 31.585 -4.345 90 HD23 LEU 11 HD23 LEU 11 8.367 30.220 -3.445 91 HA PRO 12 HA PRO 12 6.495 29.779 3.692 92 HB2 PRO 12 HB2 PRO 12 4.535 31.249 4.792 93 HB3 PRO 12 HB3 PRO 12 6.189 31.853 4.641 94 HG2 PRO 12 HG2 PRO 12 3.799 32.397 2.926 95 HG3 PRO 12 HG3 PRO 12 5.039 33.524 3.510 96 HD2 PRO 12 HD2 PRO 12 5.036 32.476 0.991 97 HD3 PRO 12 HD3 PRO 12 6.514 32.955 1.847 98 H CYS 13 H CYS 13 4.911 28.367 4.794 99 HA CYS 13 HA CYS 13 2.286 28.202 3.779 100 HB2 CYS 13 HB2 CYS 13 2.220 26.111 2.638 101 HB3 CYS 13 HB3 CYS 13 3.508 27.055 1.899 102 H GLY 14 H GLY 14 1.522 25.623 4.457 103 HA2 GLY 14 HA2 GLY 14 1.275 24.171 6.220 104 HA3 GLY 14 HA3 GLY 14 2.741 24.827 6.917 105 HA PRO 15 HA PRO 15 -0.744 25.967 9.815 106 HB2 PRO 15 HB2 PRO 15 0.613 25.609 12.064 107 HB3 PRO 15 HB3 PRO 15 0.035 24.192 11.146 108 HG2 PRO 15 HG2 PRO 15 2.584 25.681 10.746 109 HG3 PRO 15 HG3 PRO 15 2.472 24.003 11.386 110 HD2 PRO 15 HD2 PRO 15 2.825 24.228 8.832 111 HD3 PRO 15 HD3 PRO 15 1.361 23.317 9.296 112 H GLY 16 H GLY 16 -0.631 27.908 9.188 113 HA2 GLY 16 HA2 GLY 16 -0.628 30.220 9.826 114 HA3 GLY 16 HA3 GLY 16 0.768 29.869 10.829 115 H GLY 17 H GLY 17 1.429 28.296 8.127 116 HA2 GLY 17 HA2 GLY 17 2.573 28.795 6.192 117 HA3 GLY 17 HA3 GLY 17 1.917 30.376 6.371 118 H LYS 18 H LYS 18 3.917 28.646 8.571 119 HA LYS 18 HA LYS 18 5.876 30.770 8.781 120 HB2 LYS 18 HB2 LYS 18 6.177 28.174 10.218 121 HB3 LYS 18 HB3 LYS 18 6.473 29.806 10.796 122 HG2 LYS 18 HG2 LYS 18 3.679 29.521 10.269 123 HG3 LYS 18 HG3 LYS 18 4.219 28.155 11.245 124 HD2 LYS 18 HD2 LYS 18 5.463 30.351 12.397 125 HD3 LYS 18 HD3 LYS 18 3.856 30.939 11.975 126 HE2 LYS 18 HE2 LYS 18 3.774 28.296 13.172 127 HE3 LYS 18 HE3 LYS 18 4.549 29.476 14.226 128 HZ1 LYS 18 HZ1 LYS 18 2.045 30.255 12.936 129 HZ2 LYS 18 HZ2 LYS 18 2.641 30.655 14.468 130 HZ3 LYS 18 HZ3 LYS 18 1.953 29.134 14.199 131 H GLY 19 H GLY 19 5.674 27.533 7.621 132 HA2 GLY 19 HA2 GLY 19 8.397 26.975 7.007 133 HA3 GLY 19 HA3 GLY 19 6.990 26.021 6.562 134 H ARG 20 H ARG 20 8.186 25.790 4.240 135 HA ARG 20 HA ARG 20 7.382 28.010 2.684 136 HB2 ARG 20 HB2 ARG 20 10.068 26.753 2.850 137 HB3 ARG 20 HB3 ARG 20 9.481 27.246 1.271 138 HG2 ARG 20 HG2 ARG 20 9.989 29.365 1.678 139 HG3 ARG 20 HG3 ARG 20 9.160 29.338 3.235 140 HD2 ARG 20 HD2 ARG 20 11.557 27.821 3.453 141 HD3 ARG 20 HD3 ARG 20 11.947 29.361 2.723 142 HE ARG 20 HE ARG 20 10.956 30.443 4.653 143 HH11 ARG 20 HH11 ARG 20 11.669 27.036 4.930 144 HH12 ARG 20 HH12 ARG 20 11.771 27.071 6.655 145 HH21 ARG 20 HH21 ARG 20 11.098 30.492 6.921 146 HH22 ARG 20 HH22 ARG 20 11.445 29.033 7.788 147 H CYS 21 H CYS 21 7.383 26.882 0.264 148 HA CYS 21 HA CYS 21 6.233 24.194 0.699 149 HB2 CYS 21 HB2 CYS 21 5.563 26.433 -1.098 150 HB3 CYS 21 HB3 CYS 21 5.525 24.853 -1.871 151 H PHE 22 H PHE 22 6.868 22.418 -0.459 152 HA PHE 22 HA PHE 22 9.164 22.758 -2.303 153 HB2 PHE 22 HB2 PHE 22 8.745 20.746 -0.091 154 HB3 PHE 22 HB3 PHE 22 9.853 20.433 -1.423 155 HD1 PHE 22 HD1 PHE 22 9.107 22.909 1.247 156 HD2 PHE 22 HD2 PHE 22 12.044 21.202 -1.321 157 HE1 PHE 22 HE1 PHE 22 10.862 24.179 2.416 158 HE2 PHE 22 HE2 PHE 22 13.804 22.470 -0.155 159 HZ PHE 22 HZ PHE 22 13.207 23.962 1.714 160 H GLY 23 H GLY 23 6.527 20.588 -1.306 161 HA2 GLY 23 HA2 GLY 23 6.207 19.800 -4.138 162 HA3 GLY 23 HA3 GLY 23 6.115 18.616 -2.838 163 HA PRO 24 HA PRO 24 1.854 20.445 -3.743 164 HB2 PRO 24 HB2 PRO 24 1.055 17.617 -3.989 165 HB3 PRO 24 HB3 PRO 24 0.729 18.971 -5.074 166 HG2 PRO 24 HG2 PRO 24 2.461 17.021 -5.728 167 HG3 PRO 24 HG3 PRO 24 2.712 18.702 -6.224 168 HD2 PRO 24 HD2 PRO 24 3.997 17.169 -3.993 169 HD3 PRO 24 HD3 PRO 24 4.726 18.321 -5.134 170 H SER 25 H SER 25 1.892 17.156 -2.339 171 HA SER 25 HA SER 25 0.505 18.188 0.016 172 HB2 SER 25 HB2 SER 25 0.657 15.603 -1.329 173 HB3 SER 25 HB3 SER 25 0.959 15.431 0.410 174 HG SER 25 HG SER 25 -1.015 16.825 0.590 175 H ILE 26 H ILE 26 3.113 19.111 -0.290 176 HA ILE 26 HA ILE 26 4.379 17.925 2.028 177 HB ILE 26 HB ILE 26 6.082 18.535 -0.330 178 HG12 ILE 26 HG12 ILE 26 4.742 15.867 0.075 179 HG13 ILE 26 HG13 ILE 26 4.212 17.052 -1.099 180 HG21 ILE 26 HG21 ILE 26 7.504 18.040 1.283 181 HG22 ILE 26 HG22 ILE 26 7.116 16.378 0.859 182 HG23 ILE 26 HG23 ILE 26 6.299 17.159 2.215 183 HD11 ILE 26 HD11 ILE 26 5.776 16.485 -2.560 184 HD12 ILE 26 HD12 ILE 26 6.007 15.045 -1.570 185 HD13 ILE 26 HD13 ILE 26 7.044 16.454 -1.336 186 H CYS 27 H CYS 27 4.570 19.565 3.412 187 HA CYS 27 HA CYS 27 5.530 22.179 2.394 188 HB2 CYS 27 HB2 CYS 27 3.257 21.503 4.119 189 HB3 CYS 27 HB3 CYS 27 4.302 22.738 4.814 190 H CYS 28 H CYS 28 7.496 22.936 3.377 191 HA CYS 28 HA CYS 28 8.201 21.396 5.798 192 HB2 CYS 28 HB2 CYS 28 10.358 22.337 3.979 193 HB3 CYS 28 HB3 CYS 28 10.366 20.935 5.046 194 H GLY 29 H GLY 29 10.066 22.342 6.949 195 HA2 GLY 29 HA2 GLY 29 10.321 25.213 6.912 196 HA3 GLY 29 HA3 GLY 29 9.714 24.571 8.426 197 H ASP 30 H ASP 30 11.958 25.873 8.698 198 HA ASP 30 HA ASP 30 14.252 24.309 8.266 199 HB2 ASP 30 HB2 ASP 30 14.215 26.816 8.815 200 HB3 ASP 30 HB3 ASP 30 13.885 26.343 10.478 201 H GLU 31 H GLU 31 12.378 25.032 11.132 202 HA GLU 31 HA GLU 31 13.110 22.491 12.229 203 HB2 GLU 31 HB2 GLU 31 12.169 23.834 14.352 204 HB3 GLU 31 HB3 GLU 31 13.848 23.947 13.845 205 HG2 GLU 31 HG2 GLU 31 13.358 26.006 12.654 206 HG3 GLU 31 HG3 GLU 31 11.659 25.870 13.098 207 H LEU 32 H LEU 32 10.916 23.221 10.334 208 HA LEU 32 HA LEU 32 8.687 22.407 11.946 209 HB2 LEU 32 HB2 LEU 32 9.068 24.471 10.111 210 HB3 LEU 32 HB3 LEU 32 8.090 23.271 9.317 211 HG LEU 32 HG LEU 32 7.417 24.513 11.979 212 HD11 LEU 32 HD11 LEU 32 7.504 26.128 10.021 213 HD12 LEU 32 HD12 LEU 32 5.971 26.030 10.894 214 HD13 LEU 32 HD13 LEU 32 6.153 25.215 9.340 215 HD21 LEU 32 HD21 LEU 32 5.144 23.584 10.558 216 HD22 LEU 32 HD22 LEU 32 5.798 22.994 12.085 217 HD23 LEU 32 HD23 LEU 32 6.346 22.296 10.566 218 H GLY 33 H GLY 33 11.023 21.700 9.668 219 HA2 GLY 33 HA2 GLY 33 11.517 19.876 8.487 220 HA3 GLY 33 HA3 GLY 33 10.354 19.087 9.474 221 H CYS 34 H CYS 34 9.099 17.922 7.927 222 HA CYS 34 HA CYS 34 7.633 19.669 6.092 223 HB2 CYS 34 HB2 CYS 34 9.727 18.408 5.040 224 HB3 CYS 34 HB3 CYS 34 8.513 17.167 4.860 225 H PHE 35 H PHE 35 5.575 19.371 6.129 226 HA PHE 35 HA PHE 35 4.662 16.831 7.150 227 HB2 PHE 35 HB2 PHE 35 2.500 18.517 6.338 228 HB3 PHE 35 HB3 PHE 35 2.932 18.000 7.961 229 HD1 PHE 35 HD1 PHE 35 5.156 19.325 8.781 230 HD2 PHE 35 HD2 PHE 35 2.176 20.769 6.140 231 HE1 PHE 35 HE1 PHE 35 5.745 21.612 9.397 232 HE2 PHE 35 HE2 PHE 35 2.760 23.067 6.746 233 HZ PHE 35 HZ PHE 35 4.546 23.508 8.384 234 H VAL 36 H VAL 36 4.808 15.386 5.600 235 HA VAL 36 HA VAL 36 4.199 16.233 2.888 236 HB VAL 36 HB VAL 36 5.138 13.451 3.483 237 HG11 VAL 36 HG11 VAL 36 5.669 15.434 1.275 238 HG12 VAL 36 HG12 VAL 36 4.560 14.071 1.200 239 HG13 VAL 36 HG13 VAL 36 6.294 13.787 1.328 240 HG21 VAL 36 HG21 VAL 36 6.550 15.088 4.811 241 HG22 VAL 36 HG22 VAL 36 7.072 15.765 3.269 242 HG23 VAL 36 HG23 VAL 36 7.442 14.086 3.661 243 H GLY 37 H GLY 37 2.092 16.523 3.190 244 HA2 GLY 37 HA2 GLY 37 0.129 15.164 2.314 245 HA3 GLY 37 HA3 GLY 37 0.548 13.991 3.536 246 H THR 38 H THR 38 0.784 17.209 4.689 247 HA THR 38 HA THR 38 -1.688 16.722 6.158 248 HB THR 38 HB THR 38 -0.963 18.441 7.704 249 HG1 THR 38 HG1 THR 38 0.102 19.739 6.061 250 HG21 THR 38 HG21 THR 38 0.094 16.697 8.604 251 HG22 THR 38 HG22 THR 38 1.543 17.433 7.942 252 HG23 THR 38 HG23 THR 38 0.726 16.162 7.047 253 H ALA 39 H ALA 39 -3.107 18.673 6.608 254 HA ALA 39 HA ALA 39 -4.039 19.685 4.146 255 HB1 ALA 39 HB1 ALA 39 -5.247 19.400 6.451 256 HB2 ALA 39 HB2 ALA 39 -5.740 20.670 5.331 257 HB3 ALA 39 HB3 ALA 39 -4.706 21.060 6.706 258 H GLU 40 H GLU 40 -1.905 20.973 6.632 259 HA GLU 40 HA GLU 40 -1.748 23.601 5.831 260 HB2 GLU 40 HB2 GLU 40 0.311 21.759 7.047 261 HB3 GLU 40 HB3 GLU 40 0.513 23.486 6.920 262 HG2 GLU 40 HG2 GLU 40 -0.527 23.755 8.838 263 HG3 GLU 40 HG3 GLU 40 -1.984 23.068 8.125 264 H ALA 41 H ALA 41 -0.694 20.840 4.141 265 HA ALA 41 HA ALA 41 1.331 22.218 2.608 266 HB1 ALA 41 HB1 ALA 41 0.579 19.416 3.059 267 HB2 ALA 41 HB2 ALA 41 2.169 20.133 2.794 268 HB3 ALA 41 HB3 ALA 41 1.111 19.800 1.422 269 H LEU 42 H LEU 42 -1.967 21.195 2.441 270 HA LEU 42 HA LEU 42 -2.407 21.052 -0.235 271 HB2 LEU 42 HB2 LEU 42 -4.076 21.988 2.038 272 HB3 LEU 42 HB3 LEU 42 -4.670 22.198 0.407 273 HG LEU 42 HG LEU 42 -3.732 19.495 1.302 274 HD11 LEU 42 HD11 LEU 42 -5.520 20.691 2.868 275 HD12 LEU 42 HD12 LEU 42 -5.592 18.972 2.481 276 HD13 LEU 42 HD13 LEU 42 -6.610 20.116 1.606 277 HD21 LEU 42 HD21 LEU 42 -4.202 19.630 -1.006 278 HD22 LEU 42 HD22 LEU 42 -5.696 20.525 -0.727 279 HD23 LEU 42 HD23 LEU 42 -5.587 18.824 -0.272 280 H ARG 43 H ARG 43 -1.967 24.034 1.599 281 HA ARG 43 HA ARG 43 -2.791 25.809 -0.413 282 HB2 ARG 43 HB2 ARG 43 -0.820 27.267 0.630 283 HB3 ARG 43 HB3 ARG 43 -2.335 27.014 1.480 284 HG2 ARG 43 HG2 ARG 43 -0.398 24.937 2.072 285 HG3 ARG 43 HG3 ARG 43 0.207 26.549 2.451 286 HD2 ARG 43 HD2 ARG 43 -2.433 25.426 3.387 287 HD3 ARG 43 HD3 ARG 43 -0.961 25.485 4.352 288 HE ARG 43 HE ARG 43 -1.647 28.060 3.376 289 HH11 ARG 43 HH11 ARG 43 -2.498 25.703 5.809 290 HH12 ARG 43 HH12 ARG 43 -3.117 26.884 6.915 291 HH21 ARG 43 HH21 ARG 43 -2.458 29.612 4.833 292 HH22 ARG 43 HH22 ARG 43 -3.094 29.102 6.361 293 H CYS 44 H CYS 44 -0.027 23.912 0.069 294 HA CYS 44 HA CYS 44 1.829 24.937 -1.719 295 HB2 CYS 44 HB2 CYS 44 1.349 22.165 -0.828 296 HB3 CYS 44 HB3 CYS 44 2.264 22.310 -2.309 297 H GLN 45 H GLN 45 -1.172 24.367 -2.693 298 HA GLN 45 HA GLN 45 -0.838 23.174 -5.286 299 HB2 GLN 45 HB2 GLN 45 -2.998 23.221 -3.956 300 HB3 GLN 45 HB3 GLN 45 -3.123 24.924 -4.368 301 HG2 GLN 45 HG2 GLN 45 -3.159 24.338 -6.746 302 HG3 GLN 45 HG3 GLN 45 -3.072 22.631 -6.316 303 HE21 GLN 45 HE21 GLN 45 -4.996 25.530 -5.631 304 HE22 GLN 45 HE22 GLN 45 -6.522 24.720 -5.597 305 H GLU 46 H GLU 46 -0.774 26.434 -3.980 306 HA GLU 46 HA GLU 46 -0.761 27.624 -6.624 307 HB2 GLU 46 HB2 GLU 46 -1.682 28.569 -4.304 308 HB3 GLU 46 HB3 GLU 46 -0.046 29.204 -4.204 309 HG2 GLU 46 HG2 GLU 46 -1.078 30.954 -5.214 310 HG3 GLU 46 HG3 GLU 46 -0.586 30.045 -6.641 311 H GLU 47 H GLU 47 1.441 25.900 -5.105 312 HA GLU 47 HA GLU 47 3.730 27.623 -5.455 313 HB2 GLU 47 HB2 GLU 47 3.513 25.807 -3.667 314 HB3 GLU 47 HB3 GLU 47 3.751 24.646 -4.964 315 HG2 GLU 47 HG2 GLU 47 5.836 25.004 -3.867 316 HG3 GLU 47 HG3 GLU 47 5.918 25.728 -5.472 317 H ASN 48 H ASN 48 1.692 26.138 -7.507 318 HA ASN 48 HA ASN 48 3.690 25.092 -9.335 319 HB2 ASN 48 HB2 ASN 48 1.311 24.126 -8.926 320 HB3 ASN 48 HB3 ASN 48 0.772 25.434 -9.976 321 HD21 ASN 48 HD21 ASN 48 3.089 22.761 -9.832 322 HD22 ASN 48 HD22 ASN 48 2.998 22.364 -11.511 323 H TYR 49 H TYR 49 1.772 27.942 -8.792 324 HA TYR 49 HA TYR 49 1.951 29.082 -11.382 325 HB2 TYR 49 HB2 TYR 49 1.141 29.956 -8.688 326 HB3 TYR 49 HB3 TYR 49 1.731 31.245 -9.733 327 HD1 TYR 49 HD1 TYR 49 -0.441 28.227 -10.187 328 HD2 TYR 49 HD2 TYR 49 0.045 32.413 -10.768 329 HE1 TYR 49 HE1 TYR 49 -2.628 28.319 -11.310 330 HE2 TYR 49 HE2 TYR 49 -2.141 32.518 -11.890 331 HH TYR 49 HH TYR 49 -4.372 29.939 -11.816 332 H LEU 50 H LEU 50 4.525 28.249 -9.654 333 HA LEU 50 HA LEU 50 6.120 30.508 -10.632 334 HB2 LEU 50 HB2 LEU 50 5.958 29.441 -7.857 335 HB3 LEU 50 HB3 LEU 50 7.530 29.947 -8.446 336 HG LEU 50 HG LEU 50 5.444 31.933 -8.942 337 HD11 LEU 50 HD11 LEU 50 4.470 32.039 -6.956 338 HD12 LEU 50 HD12 LEU 50 6.043 32.262 -6.193 339 HD13 LEU 50 HD13 LEU 50 5.392 30.639 -6.411 340 HD21 LEU 50 HD21 LEU 50 8.181 31.894 -7.701 341 HD22 LEU 50 HD22 LEU 50 7.190 33.350 -7.773 342 HD23 LEU 50 HD23 LEU 50 7.695 32.553 -9.263 343 HA PRO 51 HA PRO 51 8.187 26.767 -12.146 344 HB2 PRO 51 HB2 PRO 51 9.487 27.915 -14.191 345 HB3 PRO 51 HB3 PRO 51 7.749 27.596 -14.259 346 HG2 PRO 51 HG2 PRO 51 9.182 30.157 -13.650 347 HG3 PRO 51 HG3 PRO 51 7.777 29.886 -14.697 348 HD2 PRO 51 HD2 PRO 51 7.588 30.820 -12.139 349 HD3 PRO 51 HD3 PRO 51 6.309 29.881 -12.935 350 H SER 52 H SER 52 9.282 28.678 -9.988 351 HA SER 52 HA SER 52 11.980 27.692 -10.092 352 HB2 SER 52 HB2 SER 52 13.023 29.960 -9.876 353 HB3 SER 52 HB3 SER 52 12.303 29.659 -11.458 354 HG SER 52 HG SER 52 10.392 30.709 -10.035 355 HA PRO 53 HA PRO 53 10.870 27.918 -5.733 356 HB2 PRO 53 HB2 PRO 53 12.880 26.413 -4.786 357 HB3 PRO 53 HB3 PRO 53 11.529 25.697 -5.675 358 HG2 PRO 53 HG2 PRO 53 14.279 26.389 -6.640 359 HG3 PRO 53 HG3 PRO 53 13.319 24.932 -6.953 360 HD2 PRO 53 HD2 PRO 53 13.530 27.009 -8.716 361 HD3 PRO 53 HD3 PRO 53 12.119 25.936 -8.631 362 H CYS 54 H CYS 54 12.054 28.535 -3.678 363 HA CYS 54 HA CYS 54 13.612 30.887 -4.217 364 HB2 CYS 54 HB2 CYS 54 13.519 31.315 -1.820 365 HB3 CYS 54 HB3 CYS 54 11.926 30.933 -2.452 366 H GLN 55 H GLN 55 15.606 30.589 -4.864 367 HA GLN 55 HA GLN 55 17.708 29.737 -5.020 368 HB2 GLN 55 HB2 GLN 55 18.882 29.946 -2.672 369 HB3 GLN 55 HB3 GLN 55 18.343 31.340 -3.576 370 HG2 GLN 55 HG2 GLN 55 17.341 31.987 -1.717 371 HG3 GLN 55 HG3 GLN 55 16.148 30.742 -2.043 372 HE21 GLN 55 HE21 GLN 55 17.967 31.980 0.293 373 HE22 GLN 55 HE22 GLN 55 18.210 30.592 1.291 374 H SER 56 H SER 56 19.052 28.421 -2.537 375 HA SER 56 HA SER 56 17.797 25.844 -2.407 376 HB2 SER 56 HB2 SER 56 19.056 25.838 -4.604 377 HB3 SER 56 HB3 SER 56 20.543 26.045 -3.685 378 HG SER 56 HG SER 56 19.856 24.073 -2.541 379 H GLY 57 H GLY 57 21.273 26.096 -2.117 380 HA2 GLY 57 HA2 GLY 57 22.394 26.913 -0.105 381 HA3 GLY 57 HA3 GLY 57 20.974 26.418 0.806 382 H GLN 58 H GLN 58 20.937 24.432 1.675 383 HA GLN 58 HA GLN 58 22.918 22.465 0.760 384 HB2 GLN 58 HB2 GLN 58 22.972 21.655 3.167 385 HB3 GLN 58 HB3 GLN 58 23.784 23.190 2.896 386 HG2 GLN 58 HG2 GLN 58 22.548 24.120 4.469 387 HG3 GLN 58 HG3 GLN 58 21.091 23.756 3.545 388 HE21 GLN 58 HE21 GLN 58 23.440 22.108 5.632 389 HE22 GLN 58 HE22 GLN 58 22.272 21.181 6.505 390 H LYS 59 H LYS 59 21.283 21.708 -0.531 391 HA LYS 59 HA LYS 59 19.072 20.555 0.989 392 HB2 LYS 59 HB2 LYS 59 18.780 21.940 -1.694 393 HB3 LYS 59 HB3 LYS 59 17.503 21.287 -0.705 394 HG2 LYS 59 HG2 LYS 59 19.066 23.318 0.663 395 HG3 LYS 59 HG3 LYS 59 18.259 23.901 -0.794 396 HD2 LYS 59 HD2 LYS 59 16.142 23.399 0.027 397 HD3 LYS 59 HD3 LYS 59 16.770 22.257 1.214 398 HE2 LYS 59 HE2 LYS 59 17.732 24.098 2.491 399 HE3 LYS 59 HE3 LYS 59 17.146 25.247 1.289 400 HZ1 LYS 59 HZ1 LYS 59 15.452 25.382 2.759 401 HZ2 LYS 59 HZ2 LYS 59 15.681 23.821 3.366 402 HZ3 LYS 59 HZ3 LYS 59 14.884 24.046 1.894 403 HA PRO 60 HA PRO 60 19.303 18.135 -3.133 404 HB2 PRO 60 HB2 PRO 60 21.838 18.291 -4.321 405 HB3 PRO 60 HB3 PRO 60 20.348 19.008 -4.944 406 HG2 PRO 60 HG2 PRO 60 22.532 20.261 -3.350 407 HG3 PRO 60 HG3 PRO 60 21.536 20.958 -4.642 408 HD2 PRO 60 HD2 PRO 60 21.100 21.553 -2.063 409 HD3 PRO 60 HD3 PRO 60 19.761 21.389 -3.213 410 H CYS 61 H CYS 61 19.233 16.598 -1.757 411 HA CYS 61 HA CYS 61 21.607 15.014 -1.335 412 HB2 CYS 61 HB2 CYS 61 21.671 15.148 0.908 413 HB3 CYS 61 HB3 CYS 61 20.615 16.541 0.763 414 H GLY 62 H GLY 62 20.305 12.877 -0.042 415 HA2 GLY 62 HA2 GLY 62 18.900 11.092 -0.626 416 HA3 GLY 62 HA3 GLY 62 17.760 12.383 -0.989 417 H SER 63 H SER 63 17.024 10.767 -2.578 418 HA SER 63 HA SER 63 18.731 10.233 -4.855 419 HB2 SER 63 HB2 SER 63 15.785 9.619 -4.750 420 HB3 SER 63 HB3 SER 63 17.055 8.782 -5.641 421 HG SER 63 HG SER 63 16.135 8.238 -3.223 422 H GLY 64 H GLY 64 18.425 12.894 -4.513 423 HA2 GLY 64 HA2 GLY 64 18.451 14.398 -6.418 424 HA3 GLY 64 HA3 GLY 64 16.907 13.716 -6.889 425 H GLY 65 H GLY 65 16.812 14.095 -3.613 426 HA2 GLY 65 HA2 GLY 65 15.201 16.496 -3.968 427 HA3 GLY 65 HA3 GLY 65 15.143 15.433 -2.590 428 H ARG 66 H ARG 66 15.059 18.254 -2.665 429 HA ARG 66 HA ARG 66 17.568 19.179 -1.655 430 HB2 ARG 66 HB2 ARG 66 15.761 21.221 -1.159 431 HB3 ARG 66 HB3 ARG 66 16.829 21.103 -2.549 432 HG2 ARG 66 HG2 ARG 66 14.097 19.855 -2.543 433 HG3 ARG 66 HG3 ARG 66 14.357 21.546 -2.967 434 HD2 ARG 66 HD2 ARG 66 15.690 19.201 -4.304 435 HD3 ARG 66 HD3 ARG 66 14.298 20.073 -4.942 436 HE ARG 66 HE ARG 66 15.999 22.069 -4.697 437 HH11 ARG 66 HH11 ARG 66 16.592 18.839 -5.891 438 HH12 ARG 66 HH12 ARG 66 17.863 19.333 -6.955 439 HH21 ARG 66 HH21 ARG 66 17.669 22.716 -6.102 440 HH22 ARG 66 HH22 ARG 66 18.475 21.532 -7.076 441 H CYS 67 H CYS 67 17.842 20.096 0.653 442 HA CYS 67 HA CYS 67 16.564 18.333 2.379 443 HB2 CYS 67 HB2 CYS 67 18.756 20.156 2.514 444 HB3 CYS 67 HB3 CYS 67 17.686 20.464 3.876 445 H ALA 68 H ALA 68 14.522 18.507 2.793 446 HA ALA 68 HA ALA 68 13.037 20.903 2.584 447 HB1 ALA 68 HB1 ALA 68 12.378 18.315 2.586 448 HB2 ALA 68 HB2 ALA 68 11.240 19.573 3.019 449 HB3 ALA 68 HB3 ALA 68 12.057 18.675 4.274 450 H ALA 69 H ALA 69 14.726 19.254 5.140 451 HA ALA 69 HA ALA 69 14.755 21.462 6.899 452 HB1 ALA 69 HB1 ALA 69 12.601 20.911 7.451 453 HB2 ALA 69 HB2 ALA 69 13.565 20.203 8.727 454 HB3 ALA 69 HB3 ALA 69 12.892 19.188 7.445 455 H ALA 70 H ALA 70 15.845 20.837 8.961 456 HA ALA 70 HA ALA 70 18.035 19.107 8.422 457 HB1 ALA 70 HB1 ALA 70 18.780 19.446 10.688 458 HB2 ALA 70 HB2 ALA 70 17.264 20.270 11.070 459 HB3 ALA 70 HB3 ALA 70 18.379 20.973 9.896 460 H GLY 71 H GLY 71 16.630 17.239 7.852 461 HA2 GLY 71 HA2 GLY 71 16.936 15.120 9.527 462 HA3 GLY 71 HA3 GLY 71 15.359 15.748 9.920 463 H ILE 72 H ILE 72 14.501 16.519 7.358 464 HA ILE 72 HA ILE 72 14.221 13.923 5.997 465 HB ILE 72 HB ILE 72 11.946 14.960 5.322 466 HG12 ILE 72 HG12 ILE 72 11.201 16.151 7.605 467 HG13 ILE 72 HG13 ILE 72 12.855 16.714 7.532 468 HG21 ILE 72 HG21 ILE 72 10.940 13.990 7.415 469 HG22 ILE 72 HG22 ILE 72 12.580 13.778 8.014 470 HG23 ILE 72 HG23 ILE 72 12.059 12.935 6.557 471 HD11 ILE 72 HD11 ILE 72 11.099 16.900 5.169 472 HD12 ILE 72 HD12 ILE 72 12.515 17.858 5.584 473 HD13 ILE 72 HD13 ILE 72 10.996 18.107 6.446 474 H CYS 73 H CYS 73 14.975 13.928 4.019 475 HA CYS 73 HA CYS 73 15.441 16.446 2.613 476 HB2 CYS 73 HB2 CYS 73 16.937 14.145 2.882 477 HB3 CYS 73 HB3 CYS 73 16.247 13.978 1.279 478 H CYS 74 H CYS 74 13.787 17.131 1.377 479 HA CYS 74 HA CYS 74 11.882 15.229 0.360 480 HB2 CYS 74 HB2 CYS 74 11.973 18.150 0.699 481 HB3 CYS 74 HB3 CYS 74 11.037 17.576 -0.679 482 H SER 75 H SER 75 12.058 14.213 -1.433 483 HA SER 75 HA SER 75 13.769 15.191 -3.581 484 HB2 SER 75 HB2 SER 75 13.347 12.890 -4.541 485 HB3 SER 75 HB3 SER 75 14.142 12.886 -2.973 486 HG SER 75 HG SER 75 12.546 11.450 -2.723 487 HA PRO 76 HA PRO 76 10.433 16.238 -6.260 488 HB2 PRO 76 HB2 PRO 76 11.011 14.403 -8.440 489 HB3 PRO 76 HB3 PRO 76 11.294 16.143 -8.356 490 HG2 PRO 76 HG2 PRO 76 13.300 14.301 -8.377 491 HG3 PRO 76 HG3 PRO 76 13.441 15.887 -7.599 492 HD2 PRO 76 HD2 PRO 76 12.900 13.211 -6.372 493 HD3 PRO 76 HD3 PRO 76 13.930 14.536 -5.781 494 H ASP 77 H ASP 77 10.021 13.866 -4.497 495 HA ASP 77 HA ASP 77 7.529 12.973 -5.685 496 HB2 ASP 77 HB2 ASP 77 8.008 10.599 -5.050 497 HB3 ASP 77 HB3 ASP 77 9.021 11.202 -6.358 498 H GLY 78 H GLY 78 9.667 13.115 -2.863 499 HA2 GLY 78 HA2 GLY 78 7.509 13.836 -1.156 500 HA3 GLY 78 HA3 GLY 78 7.990 12.187 -0.869 501 H CYS 79 H CYS 79 8.995 12.187 0.998 502 HA CYS 79 HA CYS 79 11.437 13.750 1.272 503 HB2 CYS 79 HB2 CYS 79 9.019 14.434 2.611 504 HB3 CYS 79 HB3 CYS 79 10.137 13.805 3.816 505 H HIS 80 H HIS 80 12.953 12.865 2.787 506 HA HIS 80 HA HIS 80 12.226 10.421 4.172 507 HB2 HIS 80 HB2 HIS 80 13.843 9.001 3.042 508 HB3 HIS 80 HB3 HIS 80 12.709 9.654 1.864 509 HD1 HIS 80 HD1 HIS 80 13.669 11.781 0.462 510 HD2 HIS 80 HD2 HIS 80 16.455 9.415 2.438 511 HE1 HIS 80 HE1 HIS 80 15.882 12.324 -0.598 512 HE2 HIS 80 HE2 HIS 80 17.543 10.834 0.578 513 H GLU 81 H GLU 81 13.993 9.571 5.512 514 HA GLU 81 HA GLU 81 15.281 11.597 6.959 515 HB2 GLU 81 HB2 GLU 81 15.187 8.672 6.985 516 HB3 GLU 81 HB3 GLU 81 16.733 9.314 7.523 517 HG2 GLU 81 HG2 GLU 81 15.802 10.386 9.346 518 HG3 GLU 81 HG3 GLU 81 14.186 10.396 8.641 519 H ASP 82 H ASP 82 17.349 12.408 6.942 520 HA ASP 82 HA ASP 82 19.258 11.335 5.005 521 HB2 ASP 82 HB2 ASP 82 19.613 13.481 3.933 522 HB3 ASP 82 HB3 ASP 82 17.908 13.038 3.814 523 HA PRO 83 HA PRO 83 22.051 12.353 8.311 524 HB2 PRO 83 HB2 PRO 83 24.295 12.007 6.518 525 HB3 PRO 83 HB3 PRO 83 23.718 10.936 7.793 526 HG2 PRO 83 HG2 PRO 83 23.568 10.331 5.138 527 HG3 PRO 83 HG3 PRO 83 22.445 9.696 6.353 528 HD2 PRO 83 HD2 PRO 83 22.076 11.967 4.434 529 HD3 PRO 83 HD3 PRO 83 20.930 10.696 4.914 530 H ALA 84 H ALA 84 21.961 14.162 5.400 531 HA ALA 84 HA ALA 84 24.038 16.014 6.025 532 HB1 ALA 84 HB1 ALA 84 21.670 16.407 4.187 533 HB2 ALA 84 HB2 ALA 84 23.190 15.654 3.704 534 HB3 ALA 84 HB3 ALA 84 23.163 17.346 4.200 535 H CYS 85 H CYS 85 20.578 15.848 6.247 536 HA CYS 85 HA CYS 85 20.592 18.059 8.168 537 HB2 CYS 85 HB2 CYS 85 18.332 16.980 6.458 538 HB3 CYS 85 HB3 CYS 85 18.167 18.196 7.696 539 H ASP 86 H ASP 86 21.305 16.753 9.739 540 HA ASP 86 HA ASP 86 19.415 15.313 11.267 541 HB2 ASP 86 HB2 ASP 86 20.547 13.783 9.398 542 HB3 ASP 86 HB3 ASP 86 21.765 13.639 10.655 543 HA PRO 87 HA PRO 87 23.421 15.896 13.668 544 HB2 PRO 87 HB2 PRO 87 24.918 18.111 12.784 545 HB3 PRO 87 HB3 PRO 87 25.323 16.406 12.618 546 HG2 PRO 87 HG2 PRO 87 24.673 18.200 10.548 547 HG3 PRO 87 HG3 PRO 87 24.892 16.450 10.417 548 HD2 PRO 87 HD2 PRO 87 22.405 18.038 10.557 549 HD3 PRO 87 HD3 PRO 87 22.703 16.437 9.842 550 H GLU 88 H GLU 88 21.244 16.674 14.511 551 HA GLU 88 HA GLU 88 21.662 18.546 16.371 552 HB2 GLU 88 HB2 GLU 88 20.417 20.472 15.644 553 HB3 GLU 88 HB3 GLU 88 21.710 20.127 14.509 554 HG2 GLU 88 HG2 GLU 88 20.213 19.226 12.917 555 HG3 GLU 88 HG3 GLU 88 18.882 19.262 14.073 556 H ALA 89 H ALA 89 19.447 17.354 14.109 557 HA ALA 89 HA ALA 89 17.074 17.298 15.647 558 HB1 ALA 89 HB1 ALA 89 17.962 16.607 12.934 559 HB2 ALA 89 HB2 ALA 89 16.529 17.491 13.490 560 HB3 ALA 89 HB3 ALA 89 16.531 15.734 13.514 561 H ALA 90 H ALA 90 17.204 14.570 14.017 562 HA ALA 90 HA ALA 90 16.639 12.886 16.231 563 HB1 ALA 90 HB1 ALA 90 16.163 12.766 13.501 564 HB2 ALA 90 HB2 ALA 90 15.644 11.615 14.731 565 HB3 ALA 90 HB3 ALA 90 17.149 11.347 13.854 566 H PHE 91 H PHE 91 17.833 11.634 17.448 567 HA PHE 91 HA PHE 91 20.674 11.257 16.864 568 HB2 PHE 91 HB2 PHE 91 18.958 10.814 19.311 569 HB3 PHE 91 HB3 PHE 91 20.591 10.167 19.207 570 HD1 PHE 91 HD1 PHE 91 22.377 12.007 18.392 571 HD2 PHE 91 HD2 PHE 91 18.698 12.812 20.374 572 HE1 PHE 91 HE1 PHE 91 23.268 14.168 19.162 573 HE2 PHE 91 HE2 PHE 91 19.582 14.974 21.147 574 HZ PHE 91 HZ PHE 91 21.870 15.654 20.541 575 H SER 92 H SER 92 21.476 9.332 16.130 576 HA SER 92 HA SER 92 21.565 7.168 15.407 577 HB2 SER 92 HB2 SER 92 21.128 6.841 17.923 578 HB3 SER 92 HB3 SER 92 19.464 6.487 17.460 579 HG SER 92 HG SER 92 20.677 4.579 17.567 580 H1 ALA 101 H1 ALA 101 -8.345 -6.481 8.506 581 H2 ALA 101 H2 ALA 101 -9.917 -6.307 7.839 582 H3 ALA 101 H3 ALA 101 -8.539 -5.858 6.920 583 HA ALA 101 HA ALA 101 -9.567 -8.488 7.612 584 HB1 ALA 101 HB1 ALA 101 -8.286 -7.953 5.028 585 HB2 ALA 101 HB2 ALA 101 -9.748 -7.023 5.361 586 HB3 ALA 101 HB3 ALA 101 -9.794 -8.785 5.409 587 H VAL 102 H VAL 102 -6.473 -6.764 6.952 588 HA VAL 102 HA VAL 102 -5.220 -9.296 7.833 589 HB VAL 102 HB VAL 102 -3.987 -7.331 5.893 590 HG11 VAL 102 HG11 VAL 102 -2.985 -10.092 6.135 591 HG12 VAL 102 HG12 VAL 102 -2.686 -9.043 7.521 592 HG13 VAL 102 HG13 VAL 102 -2.106 -8.578 5.921 593 HG21 VAL 102 HG21 VAL 102 -5.274 -8.279 4.337 594 HG22 VAL 102 HG22 VAL 102 -5.866 -9.495 5.470 595 HG23 VAL 102 HG23 VAL 102 -4.357 -9.762 4.598 596 H LEU 103 H LEU 103 -3.594 -9.030 9.537 597 HA LEU 103 HA LEU 103 -2.725 -6.301 10.046 598 HB2 LEU 103 HB2 LEU 103 -3.371 -6.359 12.390 599 HB3 LEU 103 HB3 LEU 103 -4.780 -6.439 11.348 600 HG LEU 103 HG LEU 103 -3.976 -9.095 11.937 601 HD11 LEU 103 HD11 LEU 103 -3.718 -7.179 14.183 602 HD12 LEU 103 HD12 LEU 103 -2.930 -8.740 13.904 603 HD13 LEU 103 HD13 LEU 103 -4.586 -8.688 14.502 604 HD21 LEU 103 HD21 LEU 103 -6.330 -7.366 12.655 605 HD22 LEU 103 HD22 LEU 103 -6.227 -9.069 13.099 606 HD23 LEU 103 HD23 LEU 103 -6.219 -8.600 11.400 607 H ASP 104 H ASP 104 -0.650 -6.273 10.646 608 HA ASP 104 HA ASP 104 0.673 -8.802 11.354 609 HB2 ASP 104 HB2 ASP 104 1.780 -6.137 10.400 610 HB3 ASP 104 HB3 ASP 104 2.783 -7.495 10.904 611 H LEU 105 H LEU 105 -0.869 -7.995 13.183 612 HA LEU 105 HA LEU 105 0.714 -7.096 15.362 613 HB2 LEU 105 HB2 LEU 105 -0.237 -5.136 14.041 614 HB3 LEU 105 HB3 LEU 105 -1.778 -5.616 14.685 615 HG LEU 105 HG LEU 105 -0.830 -3.769 15.980 616 HD11 LEU 105 HD11 LEU 105 -2.102 -5.149 17.390 617 HD12 LEU 105 HD12 LEU 105 -0.607 -4.828 18.258 618 HD13 LEU 105 HD13 LEU 105 -0.845 -6.380 17.463 619 HD21 LEU 105 HD21 LEU 105 1.517 -5.573 16.521 620 HD22 LEU 105 HD22 LEU 105 1.267 -3.949 17.161 621 HD23 LEU 105 HD23 LEU 105 1.520 -4.186 15.438 622 H ASP 106 H ASP 106 -2.261 -6.553 16.114 623 HA ASP 106 HA ASP 106 -3.456 -9.094 16.125 624 HB2 ASP 106 HB2 ASP 106 -1.598 -9.126 17.825 625 HB3 ASP 106 HB3 ASP 106 -2.611 -8.071 18.824 626 H VAL 107 H VAL 107 -4.030 -6.733 18.880 627 HA VAL 107 HA VAL 107 -6.476 -5.952 17.642 628 HB VAL 107 HB VAL 107 -6.453 -6.535 20.066 629 HG11 VAL 107 HG11 VAL 107 -3.949 -4.971 20.034 630 HG12 VAL 107 HG12 VAL 107 -4.413 -6.354 21.018 631 HG13 VAL 107 HG13 VAL 107 -4.977 -4.741 21.446 632 HG21 VAL 107 HG21 VAL 107 -7.141 -3.942 19.074 633 HG22 VAL 107 HG22 VAL 107 -6.590 -3.806 20.744 634 HG23 VAL 107 HG23 VAL 107 -7.916 -4.894 20.340 635 H ARG 108 H ARG 108 -6.356 -3.867 16.590 636 HA ARG 108 HA ARG 108 -3.755 -3.117 16.110 637 HB2 ARG 108 HB2 ARG 108 -5.627 -1.026 15.416 638 HB3 ARG 108 HB3 ARG 108 -4.629 -2.027 14.375 639 HG2 ARG 108 HG2 ARG 108 -6.562 -2.802 13.581 640 HG3 ARG 108 HG3 ARG 108 -6.637 -3.760 15.051 641 HD2 ARG 108 HD2 ARG 108 -7.996 -2.097 16.134 642 HD3 ARG 108 HD3 ARG 108 -7.799 -0.992 14.776 643 HE ARG 108 HE ARG 108 -9.476 -3.391 14.851 644 HH11 ARG 108 HH11 ARG 108 -8.313 -0.622 13.060 645 HH12 ARG 108 HH12 ARG 108 -9.581 -0.698 11.885 646 HH21 ARG 108 HH21 ARG 108 -11.145 -3.480 13.298 647 HH22 ARG 108 HH22 ARG 108 -11.183 -2.314 12.018 648 H THR 109 H THR 109 -2.502 -2.173 17.482 649 HA THR 109 HA THR 109 -3.879 -0.025 18.969 650 HB THR 109 HB THR 109 -1.507 -0.031 20.189 651 HG1 THR 109 HG1 THR 109 -1.615 -2.778 19.699 652 HG21 THR 109 HG21 THR 109 -3.959 -1.212 20.856 653 HG22 THR 109 HG22 THR 109 -2.633 -0.795 21.940 654 HG23 THR 109 HG23 THR 109 -2.720 -2.409 21.235 655 H CYS 110 H CYS 110 -3.965 1.241 17.368 656 HA CYS 110 HA CYS 110 -1.692 1.680 15.655 657 HB2 CYS 110 HB2 CYS 110 -4.506 2.363 15.601 658 HB3 CYS 110 HB3 CYS 110 -3.495 3.667 15.016 659 H LEU 111 H LEU 111 -0.216 2.292 17.339 660 HA LEU 111 HA LEU 111 -0.139 4.173 19.176 661 HB2 LEU 111 HB2 LEU 111 1.907 3.788 17.013 662 HB3 LEU 111 HB3 LEU 111 2.183 4.810 18.410 663 HG LEU 111 HG LEU 111 3.227 2.672 18.765 664 HD11 LEU 111 HD11 LEU 111 1.946 1.907 20.808 665 HD12 LEU 111 HD12 LEU 111 0.775 3.165 20.422 666 HD13 LEU 111 HD13 LEU 111 2.448 3.596 20.775 667 HD21 LEU 111 HD21 LEU 111 2.109 0.590 18.704 668 HD22 LEU 111 HD22 LEU 111 1.688 1.426 17.210 669 HD23 LEU 111 HD23 LEU 111 0.535 1.361 18.543 670 HA PRO 112 HA PRO 112 -1.463 7.888 16.983 671 HB2 PRO 112 HB2 PRO 112 -2.176 9.331 19.109 672 HB3 PRO 112 HB3 PRO 112 -3.162 7.969 18.563 673 HG2 PRO 112 HG2 PRO 112 -1.136 8.074 20.777 674 HG3 PRO 112 HG3 PRO 112 -2.768 7.376 20.794 675 HD2 PRO 112 HD2 PRO 112 -0.523 5.880 20.426 676 HD3 PRO 112 HD3 PRO 112 -2.094 5.457 19.718 677 H CYS 113 H CYS 113 -0.337 9.849 16.455 678 HA CYS 113 HA CYS 113 1.497 10.884 18.495 679 HB2 CYS 113 HB2 CYS 113 3.440 10.811 17.105 680 HB3 CYS 113 HB3 CYS 113 2.746 9.195 17.132 681 H GLY 114 H GLY 114 2.907 12.716 16.900 682 HA2 GLY 114 HA2 GLY 114 2.699 14.669 15.701 683 HA3 GLY 114 HA3 GLY 114 1.113 14.138 15.186 684 HA PRO 115 HA PRO 115 0.400 17.933 17.883 685 HB2 PRO 115 HB2 PRO 115 -1.567 18.948 16.391 686 HB3 PRO 115 HB3 PRO 115 0.110 19.092 15.800 687 HG2 PRO 115 HG2 PRO 115 -1.758 16.817 15.414 688 HG3 PRO 115 HG3 PRO 115 -1.210 17.914 14.096 689 HD2 PRO 115 HD2 PRO 115 0.173 15.739 14.400 690 HD3 PRO 115 HD3 PRO 115 1.126 17.241 14.553 691 H GLY 116 H GLY 116 -0.727 17.208 19.577 692 HA2 GLY 116 HA2 GLY 116 -2.281 16.542 20.894 693 HA3 GLY 116 HA3 GLY 116 -3.322 16.433 19.483 694 H GLY 117 H GLY 117 -1.103 14.482 18.208 695 HA2 GLY 117 HA2 GLY 117 -0.553 12.372 18.450 696 HA3 GLY 117 HA3 GLY 117 -1.201 12.437 20.037 697 H LYS 118 H LYS 118 -2.577 13.370 17.026 698 HA LYS 118 HA LYS 118 -4.967 11.780 17.426 699 HB2 LYS 118 HB2 LYS 118 -4.660 13.565 15.072 700 HB3 LYS 118 HB3 LYS 118 -6.075 13.242 16.061 701 HG2 LYS 118 HG2 LYS 118 -4.170 14.561 17.692 702 HG3 LYS 118 HG3 LYS 118 -4.282 15.439 16.167 703 HD2 LYS 118 HD2 LYS 118 -6.917 14.849 16.806 704 HD3 LYS 118 HD3 LYS 118 -6.180 15.257 18.356 705 HE2 LYS 118 HE2 LYS 118 -5.395 17.079 16.229 706 HE3 LYS 118 HE3 LYS 118 -7.140 17.037 16.471 707 HZ1 LYS 118 HZ1 LYS 118 -6.760 18.460 18.121 708 HZ2 LYS 118 HZ2 LYS 118 -5.096 18.162 18.135 709 HZ3 LYS 118 HZ3 LYS 118 -6.142 17.151 18.998 710 H GLY 119 H GLY 119 -2.023 11.685 15.090 711 HA2 GLY 119 HA2 GLY 119 -3.610 9.811 13.618 712 HA3 GLY 119 HA3 GLY 119 -2.143 10.644 13.090 713 H ARG 120 H ARG 120 -1.050 8.602 12.722 714 HA ARG 120 HA ARG 120 -0.288 7.264 15.226 715 HB2 ARG 120 HB2 ARG 120 -1.053 6.112 12.561 716 HB3 ARG 120 HB3 ARG 120 -0.057 5.200 13.686 717 HG2 ARG 120 HG2 ARG 120 -1.835 4.577 14.840 718 HG3 ARG 120 HG3 ARG 120 -2.355 6.249 15.047 719 HD2 ARG 120 HD2 ARG 120 -2.892 5.514 12.371 720 HD3 ARG 120 HD3 ARG 120 -3.477 4.217 13.389 721 HE ARG 120 HE ARG 120 -4.837 5.855 14.559 722 HH11 ARG 120 HH11 ARG 120 -3.485 6.799 11.481 723 HH12 ARG 120 HH12 ARG 120 -4.674 8.020 11.192 724 HH21 ARG 120 HH21 ARG 120 -6.407 7.460 14.177 725 HH22 ARG 120 HH22 ARG 120 -6.333 8.399 12.723 726 H CYS 121 H CYS 121 1.833 5.828 14.752 727 HA CYS 121 HA CYS 121 3.688 7.680 13.394 728 HB2 CYS 121 HB2 CYS 121 3.901 5.980 15.795 729 HB3 CYS 121 HB3 CYS 121 5.313 5.926 14.746 730 H PHE 122 H PHE 122 5.076 7.028 11.821 731 HA PHE 122 HA PHE 122 4.877 4.217 10.903 732 HB2 PHE 122 HB2 PHE 122 4.797 6.784 9.314 733 HB3 PHE 122 HB3 PHE 122 5.255 5.255 8.571 734 HD1 PHE 122 HD1 PHE 122 2.532 6.864 10.527 735 HD2 PHE 122 HD2 PHE 122 3.621 3.823 7.751 736 HE1 PHE 122 HE1 PHE 122 0.154 6.312 10.202 737 HE2 PHE 122 HE2 PHE 122 1.244 3.269 7.421 738 HZ PHE 122 HZ PHE 122 -0.491 4.513 8.650 739 H GLY 123 H GLY 123 6.822 7.195 10.782 740 HA2 GLY 123 HA2 GLY 123 9.256 5.516 10.807 741 HA3 GLY 123 HA3 GLY 123 9.130 6.936 9.774 742 HA PRO 124 HA PRO 124 10.899 8.089 13.999 743 HB2 PRO 124 HB2 PRO 124 13.062 9.294 12.392 744 HB3 PRO 124 HB3 PRO 124 13.169 8.225 13.793 745 HG2 PRO 124 HG2 PRO 124 13.783 7.364 11.329 746 HG3 PRO 124 HG3 PRO 124 13.011 6.307 12.516 747 HD2 PRO 124 HD2 PRO 124 11.791 7.764 10.196 748 HD3 PRO 124 HD3 PRO 124 11.493 6.108 10.770 749 H SER 125 H SER 125 11.821 10.210 11.270 750 HA SER 125 HA SER 125 10.448 12.428 12.586 751 HB2 SER 125 HB2 SER 125 12.686 12.188 10.731 752 HB3 SER 125 HB3 SER 125 11.506 13.374 10.147 753 HG SER 125 HG SER 125 11.654 14.365 12.231 754 H ILE 126 H ILE 126 8.774 10.400 11.681 755 HA ILE 126 HA ILE 126 7.287 11.802 9.628 756 HB ILE 126 HB ILE 126 7.567 8.841 9.389 757 HG12 ILE 126 HG12 ILE 126 9.487 10.806 8.124 758 HG13 ILE 126 HG13 ILE 126 9.875 9.850 9.536 759 HG21 ILE 126 HG21 ILE 126 6.286 9.226 7.644 760 HG22 ILE 126 HG22 ILE 126 7.537 10.242 6.940 761 HG23 ILE 126 HG23 ILE 126 6.317 10.950 7.991 762 HD11 ILE 126 HD11 ILE 126 9.617 9.012 6.713 763 HD12 ILE 126 HD12 ILE 126 9.156 7.861 7.963 764 HD13 ILE 126 HD13 ILE 126 10.785 8.532 7.941 765 H CYS 127 H CYS 127 5.383 12.199 10.547 766 HA CYS 127 HA CYS 127 4.047 10.027 12.055 767 HB2 CYS 127 HB2 CYS 127 4.509 12.844 12.746 768 HB3 CYS 127 HB3 CYS 127 2.828 12.350 12.920 769 H CYS 128 H CYS 128 2.013 9.422 11.226 770 HA CYS 128 HA CYS 128 0.908 11.311 9.243 771 HB2 CYS 128 HB2 CYS 128 0.452 8.405 8.866 772 HB3 CYS 128 HB3 CYS 128 0.582 9.672 7.657 773 H GLY 129 H GLY 129 -1.493 10.840 8.600 774 HA2 GLY 129 HA2 GLY 129 -2.996 9.577 10.689 775 HA3 GLY 129 HA3 GLY 129 -3.312 11.287 10.418 776 H ASP 130 H ASP 130 -5.416 9.799 9.853 777 HA ASP 130 HA ASP 130 -5.442 8.730 7.258 778 HB2 ASP 130 HB2 ASP 130 -7.147 8.266 9.093 779 HB3 ASP 130 HB3 ASP 130 -7.808 9.864 8.767 780 H GLU 131 H GLU 131 -6.598 11.603 8.662 781 HA GLU 131 HA GLU 131 -6.367 12.956 6.059 782 HB2 GLU 131 HB2 GLU 131 -8.032 14.626 7.325 783 HB3 GLU 131 HB3 GLU 131 -8.625 13.235 6.433 784 HG2 GLU 131 HG2 GLU 131 -8.771 11.959 8.486 785 HG3 GLU 131 HG3 GLU 131 -8.092 13.308 9.394 786 H LEU 132 H LEU 132 -4.376 12.584 8.256 787 HA LEU 132 HA LEU 132 -3.853 15.363 8.769 788 HB2 LEU 132 HB2 LEU 132 -4.079 13.065 10.394 789 HB3 LEU 132 HB3 LEU 132 -2.373 13.383 10.248 790 HG LEU 132 HG LEU 132 -4.405 15.379 11.232 791 HD11 LEU 132 HD11 LEU 132 -4.097 13.325 12.693 792 HD12 LEU 132 HD12 LEU 132 -3.749 14.876 13.455 793 HD13 LEU 132 HD13 LEU 132 -2.426 13.847 12.909 794 HD21 LEU 132 HD21 LEU 132 -1.969 15.933 10.232 795 HD22 LEU 132 HD22 LEU 132 -1.544 15.610 11.913 796 HD23 LEU 132 HD23 LEU 132 -2.721 16.864 11.527 797 H GLY 133 H GLY 133 -3.227 12.538 7.092 798 HA2 GLY 133 HA2 GLY 133 -1.685 11.933 5.612 799 HA3 GLY 133 HA3 GLY 133 -1.246 13.595 5.609 800 H CYS 134 H CYS 134 1.055 13.633 5.843 801 HA CYS 134 HA CYS 134 1.969 12.390 8.295 802 HB2 CYS 134 HB2 CYS 134 2.288 10.837 6.164 803 HB3 CYS 134 HB3 CYS 134 3.724 11.819 6.013 804 H PHE 135 H PHE 135 3.221 13.762 9.401 805 HA PHE 135 HA PHE 135 4.438 15.845 7.844 806 HB2 PHE 135 HB2 PHE 135 5.152 15.932 10.618 807 HB3 PHE 135 HB3 PHE 135 4.164 17.066 9.710 808 HD1 PHE 135 HD1 PHE 135 1.737 15.970 9.192 809 HD2 PHE 135 HD2 PHE 135 4.184 15.215 12.567 810 HE1 PHE 135 HE1 PHE 135 -0.250 15.333 10.465 811 HE2 PHE 135 HE2 PHE 135 2.202 14.572 13.847 812 HZ PHE 135 HZ PHE 135 -0.028 14.629 12.815 813 H VAL 136 H VAL 136 6.178 15.075 6.893 814 HA VAL 136 HA VAL 136 7.770 13.106 8.322 815 HB VAL 136 HB VAL 136 8.430 13.983 5.531 816 HG11 VAL 136 HG11 VAL 136 9.878 12.312 5.763 817 HG12 VAL 136 HG12 VAL 136 8.527 11.190 5.897 818 HG13 VAL 136 HG13 VAL 136 9.211 11.925 7.343 819 HG21 VAL 136 HG21 VAL 136 5.946 13.574 5.687 820 HG22 VAL 136 HG22 VAL 136 6.311 11.903 6.116 821 HG23 VAL 136 HG23 VAL 136 6.788 12.531 4.536 822 H GLY 137 H GLY 137 8.509 14.457 9.847 823 HA2 GLY 137 HA2 GLY 137 10.859 15.371 10.182 824 HA3 GLY 137 HA3 GLY 137 10.503 16.439 8.849 825 H THR 138 H THR 138 7.839 16.106 10.969 826 HA THR 138 HA THR 138 8.459 18.783 11.967 827 HB THR 138 HB THR 138 6.115 18.960 12.554 828 HG1 THR 138 HG1 THR 138 6.110 16.454 12.868 829 HG21 THR 138 HG21 THR 138 5.965 19.599 10.437 830 HG22 THR 138 HG22 THR 138 5.236 18.027 10.167 831 HG23 THR 138 HG23 THR 138 6.950 18.258 9.860 832 H ALA 139 H ALA 139 7.991 19.316 14.351 833 HA ALA 139 HA ALA 139 9.310 17.541 15.981 834 HB1 ALA 139 HB1 ALA 139 7.348 19.694 16.753 835 HB2 ALA 139 HB2 ALA 139 9.038 19.980 16.339 836 HB3 ALA 139 HB3 ALA 139 8.629 19.020 17.761 837 H GLU 140 H GLU 140 6.026 17.617 14.977 838 HA GLU 140 HA GLU 140 4.868 16.296 17.223 839 HB2 GLU 140 HB2 GLU 140 4.009 16.636 14.352 840 HB3 GLU 140 HB3 GLU 140 3.031 15.843 15.558 841 HG2 GLU 140 HG2 GLU 140 2.188 17.786 16.153 842 HG3 GLU 140 HG3 GLU 140 3.794 18.309 16.653 843 H ALA 141 H ALA 141 6.926 15.312 14.744 844 HA ALA 141 HA ALA 141 6.103 12.547 14.740 845 HB1 ALA 141 HB1 ALA 141 6.942 14.005 12.709 846 HB2 ALA 141 HB2 ALA 141 7.326 12.287 12.823 847 HB3 ALA 141 HB3 ALA 141 8.520 13.492 13.305 848 H LEU 142 H LEU 142 8.490 14.671 16.100 849 HA LEU 142 HA LEU 142 10.575 12.999 16.647 850 HB2 LEU 142 HB2 LEU 142 9.395 15.330 18.061 851 HB3 LEU 142 HB3 LEU 142 10.650 14.414 18.875 852 HG LEU 142 HG LEU 142 11.082 15.404 16.076 853 HD11 LEU 142 HD11 LEU 142 10.689 17.481 16.891 854 HD12 LEU 142 HD12 LEU 142 12.344 17.295 17.459 855 HD13 LEU 142 HD13 LEU 142 10.997 17.009 18.560 856 HD21 LEU 142 HD21 LEU 142 12.936 14.214 16.482 857 HD22 LEU 142 HD22 LEU 142 12.668 14.204 18.225 858 HD23 LEU 142 HD23 LEU 142 13.424 15.600 17.456 859 H ARG 143 H ARG 143 7.460 13.067 18.355 860 HA ARG 143 HA ARG 143 8.199 11.380 20.507 861 HB2 ARG 143 HB2 ARG 143 5.657 10.696 20.315 862 HB3 ARG 143 HB3 ARG 143 6.107 12.303 20.863 863 HG2 ARG 143 HG2 ARG 143 5.825 12.248 17.991 864 HG3 ARG 143 HG3 ARG 143 4.371 11.641 18.783 865 HD2 ARG 143 HD2 ARG 143 5.734 14.255 19.430 866 HD3 ARG 143 HD3 ARG 143 4.314 14.084 18.402 867 HE ARG 143 HE ARG 143 3.865 12.909 20.941 868 HH11 ARG 143 HH11 ARG 143 4.061 16.002 19.330 869 HH12 ARG 143 HH12 ARG 143 3.008 16.794 20.454 870 HH21 ARG 143 HH21 ARG 143 2.478 13.950 22.416 871 HH22 ARG 143 HH22 ARG 143 2.110 15.631 22.206 872 H CYS 144 H CYS 144 7.873 10.957 17.382 873 HA CYS 144 HA CYS 144 7.105 8.169 17.072 874 HB2 CYS 144 HB2 CYS 144 8.333 10.023 15.165 875 HB3 CYS 144 HB3 CYS 144 8.750 8.343 14.913 876 H GLN 145 H GLN 145 9.687 9.408 18.571 877 HA GLN 145 HA GLN 145 11.784 7.575 18.010 878 HB2 GLN 145 HB2 GLN 145 12.006 9.793 19.219 879 HB3 GLN 145 HB3 GLN 145 11.379 8.983 20.648 880 HG2 GLN 145 HG2 GLN 145 13.261 7.417 20.576 881 HG3 GLN 145 HG3 GLN 145 13.895 8.257 19.163 882 HE21 GLN 145 HE21 GLN 145 12.829 8.909 22.482 883 HE22 GLN 145 HE22 GLN 145 14.057 10.073 22.832 884 H GLU 146 H GLU 146 9.065 7.434 20.244 885 HA GLU 146 HA GLU 146 10.095 5.047 21.529 886 HB2 GLU 146 HB2 GLU 146 8.548 7.001 22.489 887 HB3 GLU 146 HB3 GLU 146 7.277 5.929 21.918 888 HG2 GLU 146 HG2 GLU 146 7.484 5.178 24.047 889 HG3 GLU 146 HG3 GLU 146 8.659 4.129 23.256 890 H GLU 147 H GLU 147 8.937 5.495 18.600 891 HA GLU 147 HA GLU 147 7.006 3.353 18.510 892 HB2 GLU 147 HB2 GLU 147 6.985 5.419 17.004 893 HB3 GLU 147 HB3 GLU 147 8.349 4.695 16.164 894 HG2 GLU 147 HG2 GLU 147 6.357 4.205 14.950 895 HG3 GLU 147 HG3 GLU 147 6.942 2.715 15.686 896 H ASN 148 H ASN 148 10.222 3.473 18.979 897 HA ASN 148 HA ASN 148 10.946 1.302 17.191 898 HB2 ASN 148 HB2 ASN 148 12.462 3.291 17.906 899 HB3 ASN 148 HB3 ASN 148 12.685 2.379 19.395 900 HD21 ASN 148 HD21 ASN 148 12.887 2.049 15.876 901 HD22 ASN 148 HD22 ASN 148 14.239 0.972 15.883 902 H TYR 149 H TYR 149 9.995 1.863 20.489 903 HA TYR 149 HA TYR 149 10.932 -0.560 21.625 904 HB2 TYR 149 HB2 TYR 149 9.129 1.636 22.402 905 HB3 TYR 149 HB3 TYR 149 8.771 0.087 23.160 906 HD1 TYR 149 HD1 TYR 149 11.887 1.990 22.316 907 HD2 TYR 149 HD2 TYR 149 9.661 -0.113 25.271 908 HE1 TYR 149 HE1 TYR 149 13.694 2.369 23.940 909 HE2 TYR 149 HE2 TYR 149 11.462 0.261 26.903 910 HH TYR 149 HH TYR 149 14.017 0.703 26.756 911 H LEU 150 H LEU 150 8.948 -0.461 19.103 912 HA LEU 150 HA LEU 150 7.483 -2.855 19.951 913 HB2 LEU 150 HB2 LEU 150 6.377 -0.327 18.836 914 HB3 LEU 150 HB3 LEU 150 5.656 -1.835 18.308 915 HG LEU 150 HG LEU 150 5.946 -1.674 21.211 916 HD11 LEU 150 HD11 LEU 150 5.558 0.715 20.699 917 HD12 LEU 150 HD12 LEU 150 4.234 -0.026 21.598 918 HD13 LEU 150 HD13 LEU 150 4.070 0.265 19.866 919 HD21 LEU 150 HD21 LEU 150 3.678 -2.489 21.154 920 HD22 LEU 150 HD22 LEU 150 4.644 -3.374 19.974 921 HD23 LEU 150 HD23 LEU 150 3.545 -2.102 19.438 922 HA PRO 151 HA PRO 151 9.480 -3.934 16.027 923 HB2 PRO 151 HB2 PRO 151 9.480 -6.592 16.377 924 HB3 PRO 151 HB3 PRO 151 10.605 -5.542 17.247 925 HG2 PRO 151 HG2 PRO 151 8.033 -6.755 18.192 926 HG3 PRO 151 HG3 PRO 151 9.591 -6.646 19.032 927 HD2 PRO 151 HD2 PRO 151 7.517 -4.929 19.482 928 HD3 PRO 151 HD3 PRO 151 9.221 -4.482 19.697 929 H SER 152 H SER 152 6.448 -3.577 16.461 930 HA SER 152 HA SER 152 5.666 -4.871 14.018 931 HB2 SER 152 HB2 SER 152 3.712 -6.056 15.046 932 HB3 SER 152 HB3 SER 152 5.274 -6.732 15.507 933 HG SER 152 HG SER 152 4.588 -6.448 17.468 934 HA PRO 153 HA PRO 153 3.307 -1.042 14.245 935 HB2 PRO 153 HB2 PRO 153 2.498 -0.981 11.688 936 HB3 PRO 153 HB3 PRO 153 4.175 -0.639 12.135 937 HG2 PRO 153 HG2 PRO 153 2.978 -3.164 11.058 938 HG3 PRO 153 HG3 PRO 153 4.497 -2.369 10.608 939 HD2 PRO 153 HD2 PRO 153 4.358 -4.498 12.312 940 HD3 PRO 153 HD3 PRO 153 5.638 -3.272 12.381 941 H CYS 154 H CYS 154 1.021 -0.382 13.656 942 HA CYS 154 HA CYS 154 -0.758 -2.457 14.533 943 HB2 CYS 154 HB2 CYS 154 -2.493 -0.747 14.563 944 HB3 CYS 154 HB3 CYS 154 -1.042 -0.184 15.373 945 H GLN 155 H GLN 155 -1.221 -3.989 13.136 946 HA GLN 155 HA GLN 155 -1.755 -5.036 11.182 947 HB2 GLN 155 HB2 GLN 155 -3.986 -3.975 10.243 948 HB3 GLN 155 HB3 GLN 155 -3.939 -4.813 11.769 949 HG2 GLN 155 HG2 GLN 155 -4.926 -3.058 12.641 950 HG3 GLN 155 HG3 GLN 155 -3.394 -2.219 12.482 951 HE21 GLN 155 HE21 GLN 155 -6.547 -1.924 11.930 952 HE22 GLN 155 HE22 GLN 155 -6.540 -0.855 10.575 953 H SER 156 H SER 156 -3.296 -3.499 8.955 954 HA SER 156 HA SER 156 -1.274 -1.836 7.783 955 HB2 SER 156 HB2 SER 156 -0.516 -4.201 7.299 956 HB3 SER 156 HB3 SER 156 -1.997 -4.427 6.374 957 HG SER 156 HG SER 156 -0.481 -3.786 4.921 958 H GLY 157 H GLY 157 -3.470 -3.677 5.678 959 HA2 GLY 157 HA2 GLY 157 -5.779 -3.007 5.363 960 HA3 GLY 157 HA3 GLY 157 -5.289 -1.363 5.742 961 H GLN 158 H GLN 158 -4.742 -0.040 4.107 962 HA GLN 158 HA GLN 158 -4.103 -1.293 1.515 963 HB2 GLN 158 HB2 GLN 158 -5.198 0.775 0.481 964 HB3 GLN 158 HB3 GLN 158 -6.310 -0.401 1.167 965 HG2 GLN 158 HG2 GLN 158 -7.205 1.179 2.425 966 HG3 GLN 158 HG3 GLN 158 -5.654 1.444 3.212 967 HE21 GLN 158 HE21 GLN 158 -7.294 2.218 0.167 968 HE22 GLN 158 HE22 GLN 158 -6.736 3.851 0.085 969 H LYS 159 H LYS 159 -2.125 -1.067 2.671 970 HA LYS 159 HA LYS 159 -1.158 1.633 2.692 971 HB2 LYS 159 HB2 LYS 159 -0.027 -0.665 4.209 972 HB3 LYS 159 HB3 LYS 159 0.401 1.027 4.343 973 HG2 LYS 159 HG2 LYS 159 -2.445 0.491 4.696 974 HG3 LYS 159 HG3 LYS 159 -1.401 -0.230 5.921 975 HD2 LYS 159 HD2 LYS 159 -0.573 1.847 6.603 976 HD3 LYS 159 HD3 LYS 159 -1.094 2.639 5.116 977 HE2 LYS 159 HE2 LYS 159 -3.405 2.461 5.773 978 HE3 LYS 159 HE3 LYS 159 -2.965 1.518 7.195 979 HZ1 LYS 159 HZ1 LYS 159 -1.571 3.993 7.143 980 HZ2 LYS 159 HZ2 LYS 159 -2.595 3.368 8.335 981 HZ3 LYS 159 HZ3 LYS 159 -3.240 4.251 7.044 982 HA PRO 160 HA PRO 160 2.700 -0.647 1.065 983 HB2 PRO 160 HB2 PRO 160 2.066 -3.053 -0.235 984 HB3 PRO 160 HB3 PRO 160 2.867 -2.882 1.329 985 HG2 PRO 160 HG2 PRO 160 -0.010 -3.366 0.717 986 HG3 PRO 160 HG3 PRO 160 0.981 -3.998 2.047 987 HD2 PRO 160 HD2 PRO 160 -0.772 -2.026 2.454 988 HD3 PRO 160 HD3 PRO 160 0.802 -2.027 3.276 989 H CYS 161 H CYS 161 2.701 0.937 -0.245 990 HA CYS 161 HA CYS 161 2.187 0.385 -3.045 991 HB2 CYS 161 HB2 CYS 161 0.591 1.973 -3.337 992 HB3 CYS 161 HB3 CYS 161 0.415 1.989 -1.591 993 H GLY 162 H GLY 162 3.353 2.520 -4.238 994 HA2 GLY 162 HA2 GLY 162 5.295 3.761 -4.365 995 HA3 GLY 162 HA3 GLY 162 5.391 3.686 -2.605 996 H SER 163 H SER 163 7.692 3.475 -3.150 997 HA SER 163 HA SER 163 8.585 0.970 -4.295 998 HB2 SER 163 HB2 SER 163 10.359 2.962 -2.894 999 HB3 SER 163 HB3 SER 163 10.776 1.837 -4.186 1000 HG SER 163 HG SER 163 10.548 3.722 -5.219 1001 H GLY 164 H GLY 164 7.013 0.495 -2.164 1002 HA2 GLY 164 HA2 GLY 164 7.351 -1.394 -0.711 1003 HA3 GLY 164 HA3 GLY 164 8.867 -0.672 -0.218 1004 H GLY 165 H GLY 165 6.405 1.789 -0.329 1005 HA2 GLY 165 HA2 GLY 165 6.332 1.570 2.581 1006 HA3 GLY 165 HA3 GLY 165 6.045 3.004 1.638 1007 H ARG 166 H ARG 166 4.563 2.069 3.807 1008 HA ARG 166 HA ARG 166 2.068 1.072 2.789 1009 HB2 ARG 166 HB2 ARG 166 1.584 1.825 5.403 1010 HB3 ARG 166 HB3 ARG 166 1.979 0.205 4.851 1011 HG2 ARG 166 HG2 ARG 166 4.104 2.181 5.610 1012 HG3 ARG 166 HG3 ARG 166 3.300 1.152 6.790 1013 HD2 ARG 166 HD2 ARG 166 4.764 0.163 4.358 1014 HD3 ARG 166 HD3 ARG 166 5.419 0.190 5.994 1015 HE ARG 166 HE ARG 166 3.253 -1.257 6.399 1016 HH11 ARG 166 HH11 ARG 166 5.525 -1.425 3.752 1017 HH12 ARG 166 HH12 ARG 166 5.273 -3.114 3.480 1018 HH21 ARG 166 HH21 ARG 166 2.928 -3.483 6.042 1019 HH22 ARG 166 HH22 ARG 166 3.801 -4.284 4.779 1020 H CYS 167 H CYS 167 -0.048 2.365 2.953 1021 HA CYS 167 HA CYS 167 0.501 4.971 2.163 1022 HB2 CYS 167 HB2 CYS 167 -1.742 3.209 2.131 1023 HB3 CYS 167 HB3 CYS 167 -2.244 4.736 2.842 1024 H ALA 168 H ALA 168 1.206 6.392 3.537 1025 HA ALA 168 HA ALA 168 0.780 6.308 6.329 1026 HB1 ALA 168 HB1 ALA 168 2.684 7.481 5.597 1027 HB2 ALA 168 HB2 ALA 168 1.584 8.744 6.131 1028 HB3 ALA 168 HB3 ALA 168 1.770 8.413 4.416 1029 H ALA 169 H ALA 169 -0.688 7.855 3.665 1030 HA ALA 169 HA ALA 169 -3.233 8.341 4.978 1031 HB1 ALA 169 HB1 ALA 169 -2.169 10.167 5.870 1032 HB2 ALA 169 HB2 ALA 169 -3.087 10.814 4.528 1033 HB3 ALA 169 HB3 ALA 169 -1.341 10.576 4.385 1034 H ALA 170 H ALA 170 -4.770 9.480 3.527 1035 HA ALA 170 HA ALA 170 -4.572 8.419 0.903 1036 HB1 ALA 170 HB1 ALA 170 -6.634 9.544 0.359 1037 HB2 ALA 170 HB2 ALA 170 -6.559 10.431 1.885 1038 HB3 ALA 170 HB3 ALA 170 -6.756 8.677 1.893 1039 H GLY 171 H GLY 171 -2.465 9.401 0.462 1040 HA2 GLY 171 HA2 GLY 171 -2.518 11.211 -1.571 1041 HA3 GLY 171 HA3 GLY 171 -2.247 12.175 -0.145 1042 H ILE 172 H ILE 172 -0.606 10.692 1.356 1043 HA ILE 172 HA ILE 172 1.855 10.487 -0.236 1044 HB ILE 172 HB ILE 172 2.884 10.928 2.088 1045 HG12 ILE 172 HG12 ILE 172 1.102 12.670 3.121 1046 HG13 ILE 172 HG13 ILE 172 0.006 11.433 2.543 1047 HG21 ILE 172 HG21 ILE 172 2.180 12.531 -0.086 1048 HG22 ILE 172 HG22 ILE 172 3.366 12.885 1.166 1049 HG23 ILE 172 HG23 ILE 172 1.707 13.449 1.343 1050 HD11 ILE 172 HD11 ILE 172 2.395 10.803 4.173 1051 HD12 ILE 172 HD12 ILE 172 0.973 9.803 3.882 1052 HD13 ILE 172 HD13 ILE 172 0.852 11.229 4.913 1053 H CYS 173 H CYS 173 2.740 8.565 -0.420 1054 HA CYS 173 HA CYS 173 1.983 6.407 1.401 1055 HB2 CYS 173 HB2 CYS 173 2.321 6.513 -1.336 1056 HB3 CYS 173 HB3 CYS 173 3.805 5.759 -0.790 1057 H CYS 174 H CYS 174 3.256 6.198 3.155 1058 HA CYS 174 HA CYS 174 5.970 7.156 3.068 1059 HB2 CYS 174 HB2 CYS 174 4.073 6.381 5.178 1060 HB3 CYS 174 HB3 CYS 174 5.770 6.085 5.537 1061 H SER 175 H SER 175 7.604 6.046 2.454 1062 HA SER 175 HA SER 175 7.551 3.133 2.430 1063 HB2 SER 175 HB2 SER 175 9.679 3.419 1.097 1064 HB3 SER 175 HB3 SER 175 8.257 4.140 0.355 1065 HG SER 175 HG SER 175 9.139 6.035 0.547 1066 HA PRO 176 HA PRO 176 10.423 2.685 5.740 1067 HB2 PRO 176 HB2 PRO 176 12.556 1.330 4.304 1068 HB3 PRO 176 HB3 PRO 176 11.381 0.653 5.432 1069 HG2 PRO 176 HG2 PRO 176 11.383 0.100 2.765 1070 HG3 PRO 176 HG3 PRO 176 9.920 0.077 3.764 1071 HD2 PRO 176 HD2 PRO 176 10.909 2.194 1.895 1072 HD3 PRO 176 HD3 PRO 176 9.252 1.609 2.158 1073 H ASP 177 H ASP 177 10.832 5.031 3.938 1074 HA ASP 177 HA ASP 177 13.394 5.862 5.017 1075 HB2 ASP 177 HB2 ASP 177 14.066 6.851 2.819 1076 HB3 ASP 177 HB3 ASP 177 14.045 5.091 2.828 1077 H GLY 178 H GLY 178 10.386 6.710 3.345 1078 HA2 GLY 178 HA2 GLY 178 10.008 8.991 5.002 1079 HA3 GLY 178 HA3 GLY 178 10.489 9.470 3.400 1080 H CYS 179 H CYS 179 8.764 10.295 2.497 1081 HA CYS 179 HA CYS 179 6.440 8.588 2.098 1082 HB2 CYS 179 HB2 CYS 179 6.448 10.747 3.952 1083 HB3 CYS 179 HB3 CYS 179 5.446 11.221 2.585 1084 H HIS 180 H HIS 180 5.163 9.161 0.249 1085 HA HIS 180 HA HIS 180 6.027 11.416 -1.360 1086 HB2 HIS 180 HB2 HIS 180 6.714 10.111 -3.293 1087 HB3 HIS 180 HB3 HIS 180 7.693 9.660 -1.902 1088 HD1 HIS 180 HD1 HIS 180 6.907 7.353 -0.693 1089 HD2 HIS 180 HD2 HIS 180 5.513 8.028 -4.547 1090 HE1 HIS 180 HE1 HIS 180 6.136 5.111 -1.529 1091 HE2 HIS 180 HE2 HIS 180 5.346 5.538 -3.885 1092 H GLU 181 H GLU 181 4.724 11.691 -3.324 1093 HA GLU 181 HA GLU 181 1.986 11.368 -2.819 1094 HB2 GLU 181 HB2 GLU 181 3.659 12.412 -4.984 1095 HB3 GLU 181 HB3 GLU 181 2.149 11.718 -5.558 1096 HG2 GLU 181 HG2 GLU 181 0.856 13.263 -4.428 1097 HG3 GLU 181 HG3 GLU 181 2.141 13.655 -3.286 1098 H ASP 182 H ASP 182 0.465 9.900 -3.505 1099 HA ASP 182 HA ASP 182 1.324 7.712 -5.248 1100 HB2 ASP 182 HB2 ASP 182 0.628 5.993 -3.687 1101 HB3 ASP 182 HB3 ASP 182 1.838 7.026 -2.922 1102 HA PRO 183 HA PRO 183 -2.828 8.256 -6.741 1103 HB2 PRO 183 HB2 PRO 183 -2.646 5.739 -8.159 1104 HB3 PRO 183 HB3 PRO 183 -2.567 7.381 -8.796 1105 HG2 PRO 183 HG2 PRO 183 -0.438 5.678 -8.764 1106 HG3 PRO 183 HG3 PRO 183 -0.283 7.443 -8.716 1107 HD2 PRO 183 HD2 PRO 183 -0.126 5.462 -6.473 1108 HD3 PRO 183 HD3 PRO 183 0.872 6.899 -6.781 1109 H ALA 184 H ALA 184 -1.919 5.521 -4.880 1110 HA ALA 184 HA ALA 184 -4.442 4.190 -4.880 1111 HB1 ALA 184 HB1 ALA 184 -2.222 3.127 -4.254 1112 HB2 ALA 184 HB2 ALA 184 -3.554 2.822 -3.138 1113 HB3 ALA 184 HB3 ALA 184 -2.325 4.020 -2.737 1114 H CYS 185 H CYS 185 -2.687 6.395 -2.845 1115 HA CYS 185 HA CYS 185 -5.174 7.101 -1.466 1116 HB2 CYS 185 HB2 CYS 185 -2.295 7.519 -0.556 1117 HB3 CYS 185 HB3 CYS 185 -3.728 8.084 0.261 1118 H ASP 186 H ASP 186 -5.824 8.290 -3.147 1119 HA ASP 186 HA ASP 186 -5.038 10.998 -3.278 1120 HB2 ASP 186 HB2 ASP 186 -3.553 9.457 -4.868 1121 HB3 ASP 186 HB3 ASP 186 -4.910 9.751 -5.943 1122 HA PRO 187 HA PRO 187 -9.089 10.289 -5.710 1123 HB2 PRO 187 HB2 PRO 187 -10.452 8.011 -4.809 1124 HB3 PRO 187 HB3 PRO 187 -9.629 8.236 -6.350 1125 HG2 PRO 187 HG2 PRO 187 -8.894 6.470 -4.287 1126 HG3 PRO 187 HG3 PRO 187 -7.976 6.847 -5.752 1127 HD2 PRO 187 HD2 PRO 187 -7.640 7.854 -2.993 1128 HD3 PRO 187 HD3 PRO 187 -6.448 7.681 -4.303 1129 H GLU 188 H GLU 188 -9.070 11.683 -4.255 1130 HA GLU 188 HA GLU 188 -11.250 12.514 -3.050 1131 HB2 GLU 188 HB2 GLU 188 -11.207 12.107 -0.655 1132 HB3 GLU 188 HB3 GLU 188 -11.084 10.614 -1.573 1133 HG2 GLU 188 HG2 GLU 188 -8.798 10.377 -1.116 1134 HG3 GLU 188 HG3 GLU 188 -8.687 12.007 -0.479 1135 H ALA 189 H ALA 189 -7.974 12.450 -2.269 1136 HA ALA 189 HA ALA 189 -7.746 14.880 -0.944 1137 HB1 ALA 189 HB1 ALA 189 -6.078 12.626 -1.626 1138 HB2 ALA 189 HB2 ALA 189 -6.184 13.577 -0.136 1139 HB3 ALA 189 HB3 ALA 189 -5.205 14.161 -1.478 1140 H ALA 190 H ALA 190 -5.449 14.296 -3.290 1141 HA ALA 190 HA ALA 190 -5.467 17.091 -4.104 1142 HB1 ALA 190 HB1 ALA 190 -3.378 14.949 -4.349 1143 HB2 ALA 190 HB2 ALA 190 -3.327 16.430 -3.391 1144 HB3 ALA 190 HB3 ALA 190 -3.253 16.516 -5.150 1145 H PHE 191 H PHE 191 -6.143 17.749 -5.975 1146 HA PHE 191 HA PHE 191 -7.015 15.820 -7.988 1147 HB2 PHE 191 HB2 PHE 191 -7.443 18.781 -7.581 1148 HB3 PHE 191 HB3 PHE 191 -7.871 17.993 -9.094 1149 HD1 PHE 191 HD1 PHE 191 -9.302 15.746 -8.707 1150 HD2 PHE 191 HD2 PHE 191 -9.117 19.071 -6.058 1151 HE1 PHE 191 HE1 PHE 191 -11.472 15.096 -7.745 1152 HE2 PHE 191 HE2 PHE 191 -11.286 18.427 -5.092 1153 HZ PHE 191 HZ PHE 191 -12.466 16.437 -5.936 1154 H SER 192 H SER 192 -5.875 15.451 -9.838 1155 HA SER 192 HA SER 192 -4.238 15.577 -11.423 1156 HB2 SER 192 HB2 SER 192 -5.452 17.821 -11.765 1157 HB3 SER 192 HB3 SER 192 -4.089 18.545 -10.910 1158 HG SER 192 HG SER 192 -3.331 18.591 -12.897 Start of MODEL 4 1 H1 ALA 1 H1 ALA 1 21.520 28.020 4.352 2 H2 ALA 1 H2 ALA 1 22.361 28.308 2.884 3 H3 ALA 1 H3 ALA 1 20.946 27.338 2.888 4 HA ALA 1 HA ALA 1 19.565 29.052 3.049 5 HB1 ALA 1 HB1 ALA 1 21.774 30.708 4.255 6 HB2 ALA 1 HB2 ALA 1 20.536 29.838 5.162 7 HB3 ALA 1 HB3 ALA 1 20.078 31.167 4.096 8 H VAL 2 H VAL 2 21.216 28.187 1.050 9 HA VAL 2 HA VAL 2 21.987 30.468 -0.618 10 HB VAL 2 HB VAL 2 22.146 27.706 -1.706 11 HG11 VAL 2 HG11 VAL 2 22.974 29.331 -3.128 12 HG12 VAL 2 HG12 VAL 2 24.426 28.638 -2.406 13 HG13 VAL 2 HG13 VAL 2 23.808 30.187 -1.831 14 HG21 VAL 2 HG21 VAL 2 24.412 28.462 0.077 15 HG22 VAL 2 HG22 VAL 2 23.896 26.874 -0.489 16 HG23 VAL 2 HG23 VAL 2 22.989 27.693 0.781 17 H LEU 3 H LEU 3 19.775 31.234 -0.981 18 HA LEU 3 HA LEU 3 17.822 29.437 -2.039 19 HB2 LEU 3 HB2 LEU 3 17.982 32.172 -1.204 20 HB3 LEU 3 HB3 LEU 3 17.258 32.136 -2.797 21 HG LEU 3 HG LEU 3 15.558 32.131 -1.056 22 HD11 LEU 3 HD11 LEU 3 15.570 29.391 -2.268 23 HD12 LEU 3 HD12 LEU 3 15.326 30.842 -3.240 24 HD13 LEU 3 HD13 LEU 3 14.200 30.452 -1.940 25 HD21 LEU 3 HD21 LEU 3 16.259 29.390 -0.173 26 HD22 LEU 3 HD22 LEU 3 15.467 30.697 0.704 27 HD23 LEU 3 HD23 LEU 3 17.215 30.724 0.471 28 H ASP 4 H ASP 4 18.835 28.412 -3.967 29 HA ASP 4 HA ASP 4 19.725 30.304 -6.017 30 HB2 ASP 4 HB2 ASP 4 20.952 28.130 -5.334 31 HB3 ASP 4 HB3 ASP 4 19.754 27.315 -6.335 32 H LEU 5 H LEU 5 17.173 31.008 -6.117 33 HA LEU 5 HA LEU 5 15.877 29.160 -7.902 34 HB2 LEU 5 HB2 LEU 5 14.599 29.335 -5.918 35 HB3 LEU 5 HB3 LEU 5 14.759 31.077 -5.935 36 HG LEU 5 HG LEU 5 12.478 30.100 -6.536 37 HD11 LEU 5 HD11 LEU 5 13.616 32.430 -7.185 38 HD12 LEU 5 HD12 LEU 5 11.974 31.991 -7.654 39 HD13 LEU 5 HD13 LEU 5 13.300 31.801 -8.801 40 HD21 LEU 5 HD21 LEU 5 13.837 29.568 -9.175 41 HD22 LEU 5 HD22 LEU 5 12.124 29.367 -8.805 42 HD23 LEU 5 HD23 LEU 5 13.320 28.326 -8.033 43 H ASP 6 H ASP 6 15.990 32.258 -7.024 44 HA ASP 6 HA ASP 6 17.030 33.753 -8.979 45 HB2 ASP 6 HB2 ASP 6 14.958 32.439 -10.082 46 HB3 ASP 6 HB3 ASP 6 14.244 34.040 -9.824 47 H VAL 7 H VAL 7 14.296 33.447 -7.072 48 HA VAL 7 HA VAL 7 14.715 35.760 -5.484 49 HB VAL 7 HB VAL 7 13.451 36.838 -7.324 50 HG11 VAL 7 HG11 VAL 7 11.858 34.481 -7.161 51 HG12 VAL 7 HG12 VAL 7 11.816 35.778 -8.357 52 HG13 VAL 7 HG13 VAL 7 10.838 35.894 -6.893 53 HG21 VAL 7 HG21 VAL 7 11.684 36.673 -4.900 54 HG22 VAL 7 HG22 VAL 7 11.944 38.045 -5.977 55 HG23 VAL 7 HG23 VAL 7 13.234 37.515 -4.897 56 H ARG 8 H ARG 8 14.094 35.031 -3.377 57 HA ARG 8 HA ARG 8 13.000 32.455 -3.288 58 HB2 ARG 8 HB2 ARG 8 13.049 33.185 -0.704 59 HB3 ARG 8 HB3 ARG 8 14.473 32.609 -1.552 60 HG2 ARG 8 HG2 ARG 8 15.292 34.844 -1.838 61 HG3 ARG 8 HG3 ARG 8 13.784 35.530 -1.236 62 HD2 ARG 8 HD2 ARG 8 14.301 34.226 0.923 63 HD3 ARG 8 HD3 ARG 8 15.935 34.084 0.278 64 HE ARG 8 HE ARG 8 14.632 36.504 1.238 65 HH11 ARG 8 HH11 ARG 8 17.395 35.089 -0.374 66 HH12 ARG 8 HH12 ARG 8 18.405 36.472 -0.119 67 HH21 ARG 8 HH21 ARG 8 15.967 38.317 1.571 68 HH22 ARG 8 HH22 ARG 8 17.597 38.301 0.983 69 H THR 9 H THR 9 10.879 32.257 -3.705 70 HA THR 9 HA THR 9 9.235 34.090 -2.095 71 HB THR 9 HB THR 9 7.732 32.279 -3.836 72 HG1 THR 9 HG1 THR 9 8.975 34.241 -5.362 73 HG21 THR 9 HG21 THR 9 6.440 34.029 -3.170 74 HG22 THR 9 HG22 THR 9 6.972 34.628 -4.740 75 HG23 THR 9 HG23 THR 9 7.762 35.191 -3.268 76 H CYS 10 H CYS 10 10.050 33.059 -0.422 77 HA CYS 10 HA CYS 10 10.006 30.207 -0.227 78 HB2 CYS 10 HB2 CYS 10 10.361 32.262 1.946 79 HB3 CYS 10 HB3 CYS 10 10.654 30.534 2.130 80 H LEU 11 H LEU 11 7.709 30.079 -0.962 81 HA LEU 11 HA LEU 11 5.402 30.670 0.267 82 HB2 LEU 11 HB2 LEU 11 5.550 27.784 -0.285 83 HB3 LEU 11 HB3 LEU 11 4.428 28.989 -0.881 84 HG LEU 11 HG LEU 11 6.407 29.752 -2.384 85 HD11 LEU 11 HD11 LEU 11 8.189 28.514 -1.427 86 HD12 LEU 11 HD12 LEU 11 7.851 27.789 -2.999 87 HD13 LEU 11 HD13 LEU 11 7.281 27.005 -1.525 88 HD21 LEU 11 HD21 LEU 11 5.739 27.309 -3.616 89 HD22 LEU 11 HD22 LEU 11 5.011 28.894 -3.880 90 HD23 LEU 11 HD23 LEU 11 4.336 27.803 -2.670 91 HA PRO 12 HA PRO 12 6.022 28.906 4.399 92 HB2 PRO 12 HB2 PRO 12 4.524 30.639 5.727 93 HB3 PRO 12 HB3 PRO 12 6.042 31.173 4.995 94 HG2 PRO 12 HG2 PRO 12 3.235 31.515 4.007 95 HG3 PRO 12 HG3 PRO 12 4.555 32.699 4.053 96 HD2 PRO 12 HD2 PRO 12 3.848 31.217 1.833 97 HD3 PRO 12 HD3 PRO 12 5.441 31.952 2.091 98 H CYS 13 H CYS 13 4.792 27.222 5.476 99 HA CYS 13 HA CYS 13 1.914 27.454 5.480 100 HB2 CYS 13 HB2 CYS 13 1.392 25.616 4.187 101 HB3 CYS 13 HB3 CYS 13 2.861 26.060 3.359 102 H GLY 14 H GLY 14 1.140 25.384 6.943 103 HA2 GLY 14 HA2 GLY 14 1.420 24.154 8.893 104 HA3 GLY 14 HA3 GLY 14 3.148 24.228 8.617 105 HA PRO 15 HA PRO 15 2.253 26.654 12.548 106 HB2 PRO 15 HB2 PRO 15 4.110 25.604 14.085 107 HB3 PRO 15 HB3 PRO 15 2.703 24.601 13.642 108 HG2 PRO 15 HG2 PRO 15 5.201 24.972 12.102 109 HG3 PRO 15 HG3 PRO 15 4.762 23.435 12.942 110 HD2 PRO 15 HD2 PRO 15 4.054 23.616 10.433 111 HD3 PRO 15 HD3 PRO 15 2.718 23.296 11.575 112 H GLY 16 H GLY 16 2.999 28.435 12.729 113 HA2 GLY 16 HA2 GLY 16 4.203 30.403 12.863 114 HA3 GLY 16 HA3 GLY 16 5.668 29.433 12.712 115 H GLY 17 H GLY 17 4.305 28.170 10.392 116 HA2 GLY 17 HA2 GLY 17 3.925 28.415 8.206 117 HA3 GLY 17 HA3 GLY 17 4.010 30.108 8.482 118 H LYS 18 H LYS 18 6.564 28.348 9.725 119 HA LYS 18 HA LYS 18 8.517 29.320 7.847 120 HB2 LYS 18 HB2 LYS 18 9.450 27.134 9.514 121 HB3 LYS 18 HB3 LYS 18 10.027 28.788 9.452 122 HG2 LYS 18 HG2 LYS 18 7.615 28.879 10.875 123 HG3 LYS 18 HG3 LYS 18 8.461 27.452 11.462 124 HD2 LYS 18 HD2 LYS 18 10.486 29.191 11.471 125 HD3 LYS 18 HD3 LYS 18 9.136 30.317 11.682 126 HE2 LYS 18 HE2 LYS 18 8.415 29.221 13.657 127 HE3 LYS 18 HE3 LYS 18 9.475 27.843 13.365 128 HZ1 LYS 18 HZ1 LYS 18 10.273 30.590 14.146 129 HZ2 LYS 18 HZ2 LYS 18 11.375 29.405 13.649 130 HZ3 LYS 18 HZ3 LYS 18 10.453 29.170 15.049 131 H GLY 19 H GLY 19 6.200 27.232 7.550 132 HA2 GLY 19 HA2 GLY 19 7.377 24.824 6.507 133 HA3 GLY 19 HA3 GLY 19 5.697 25.340 6.283 134 H ARG 20 H ARG 20 7.181 24.328 4.163 135 HA ARG 20 HA ARG 20 6.923 26.518 2.422 136 HB2 ARG 20 HB2 ARG 20 9.652 25.866 3.209 137 HB3 ARG 20 HB3 ARG 20 9.424 25.763 1.466 138 HG2 ARG 20 HG2 ARG 20 9.880 27.977 1.558 139 HG3 ARG 20 HG3 ARG 20 8.164 28.086 1.952 140 HD2 ARG 20 HD2 ARG 20 8.707 29.080 3.858 141 HD3 ARG 20 HD3 ARG 20 9.468 27.578 4.379 142 HE ARG 20 HE ARG 20 11.455 28.649 3.009 143 HH11 ARG 20 HH11 ARG 20 9.260 30.212 5.240 144 HH12 ARG 20 HH12 ARG 20 10.427 31.378 5.764 145 HH21 ARG 20 HH21 ARG 20 12.987 30.184 3.709 146 HH22 ARG 20 HH22 ARG 20 12.540 31.362 4.897 147 H CYS 21 H CYS 21 6.167 25.867 0.580 148 HA CYS 21 HA CYS 21 6.072 22.950 0.234 149 HB2 CYS 21 HB2 CYS 21 4.048 24.715 0.359 150 HB3 CYS 21 HB3 CYS 21 4.316 24.715 -1.379 151 H PHE 22 H PHE 22 6.977 21.945 -1.342 152 HA PHE 22 HA PHE 22 8.201 23.445 -3.546 153 HB2 PHE 22 HB2 PHE 22 8.691 20.603 -2.602 154 HB3 PHE 22 HB3 PHE 22 9.563 21.413 -3.896 155 HD1 PHE 22 HD1 PHE 22 8.723 21.965 -0.290 156 HD2 PHE 22 HD2 PHE 22 11.635 22.266 -3.384 157 HE1 PHE 22 HE1 PHE 22 10.377 22.778 1.339 158 HE2 PHE 22 HE2 PHE 22 13.283 23.084 -1.763 159 HZ PHE 22 HZ PHE 22 12.659 23.339 0.605 160 H GLY 23 H GLY 23 6.236 20.599 -2.804 161 HA2 GLY 23 HA2 GLY 23 5.195 20.663 -5.570 162 HA3 GLY 23 HA3 GLY 23 5.461 19.165 -4.689 163 HA PRO 24 HA PRO 24 1.180 20.089 -3.541 164 HB2 PRO 24 HB2 PRO 24 0.210 17.604 -3.851 165 HB3 PRO 24 HB3 PRO 24 0.589 18.630 -5.238 166 HG2 PRO 24 HG2 PRO 24 1.976 16.231 -4.266 167 HG3 PRO 24 HG3 PRO 24 2.060 17.009 -5.854 168 HD2 PRO 24 HD2 PRO 24 3.884 17.263 -3.584 169 HD3 PRO 24 HD3 PRO 24 4.081 17.855 -5.254 170 H SER 25 H SER 25 2.019 16.775 -2.542 171 HA SER 25 HA SER 25 1.195 17.402 0.185 172 HB2 SER 25 HB2 SER 25 1.515 14.917 -1.417 173 HB3 SER 25 HB3 SER 25 1.884 14.761 0.309 174 HG SER 25 HG SER 25 -0.357 16.164 0.075 175 H ILE 26 H ILE 26 3.440 18.778 -0.461 176 HA ILE 26 HA ILE 26 5.353 17.620 1.369 177 HB ILE 26 HB ILE 26 5.794 17.750 -1.536 178 HG12 ILE 26 HG12 ILE 26 7.074 15.991 0.471 179 HG13 ILE 26 HG13 ILE 26 5.455 15.725 -0.182 180 HG21 ILE 26 HG21 ILE 26 8.356 17.692 -0.154 181 HG22 ILE 26 HG22 ILE 26 7.565 19.266 -0.070 182 HG23 ILE 26 HG23 ILE 26 7.901 18.531 -1.638 183 HD11 ILE 26 HD11 ILE 26 6.704 14.414 -1.571 184 HD12 ILE 26 HD12 ILE 26 8.097 15.494 -1.526 185 HD13 ILE 26 HD13 ILE 26 6.679 15.924 -2.482 186 H CYS 27 H CYS 27 5.832 19.140 2.744 187 HA CYS 27 HA CYS 27 6.438 21.889 1.886 188 HB2 CYS 27 HB2 CYS 27 4.017 21.295 3.062 189 HB3 CYS 27 HB3 CYS 27 5.002 21.632 4.473 190 H CYS 28 H CYS 28 8.620 21.941 2.448 191 HA CYS 28 HA CYS 28 9.281 20.833 5.089 192 HB2 CYS 28 HB2 CYS 28 11.615 20.833 3.395 193 HB3 CYS 28 HB3 CYS 28 10.886 19.520 4.300 194 H GLY 29 H GLY 29 10.338 21.992 6.508 195 HA2 GLY 29 HA2 GLY 29 11.554 24.535 5.670 196 HA3 GLY 29 HA3 GLY 29 10.730 24.303 7.200 197 H ASP 30 H ASP 30 12.877 25.391 7.482 198 HA ASP 30 HA ASP 30 15.294 24.048 7.677 199 HB2 ASP 30 HB2 ASP 30 14.796 26.569 7.604 200 HB3 ASP 30 HB3 ASP 30 14.563 26.421 9.342 201 H GLU 31 H GLU 31 12.701 24.364 9.837 202 HA GLU 31 HA GLU 31 14.111 22.586 11.716 203 HB2 GLU 31 HB2 GLU 31 12.453 24.322 13.329 204 HB3 GLU 31 HB3 GLU 31 14.120 23.818 13.555 205 HG2 GLU 31 HG2 GLU 31 14.600 25.580 11.700 206 HG3 GLU 31 HG3 GLU 31 13.035 26.223 12.186 207 H LEU 32 H LEU 32 11.577 23.104 9.963 208 HA LEU 32 HA LEU 32 9.644 21.622 11.487 209 HB2 LEU 32 HB2 LEU 32 9.683 23.938 9.932 210 HB3 LEU 32 HB3 LEU 32 8.729 22.774 9.071 211 HG LEU 32 HG LEU 32 8.245 23.380 11.960 212 HD11 LEU 32 HD11 LEU 32 8.217 25.452 10.512 213 HD12 LEU 32 HD12 LEU 32 6.751 25.114 11.433 214 HD13 LEU 32 HD13 LEU 32 6.811 24.751 9.708 215 HD21 LEU 32 HD21 LEU 32 5.967 22.766 10.266 216 HD22 LEU 32 HD22 LEU 32 6.481 22.029 11.784 217 HD23 LEU 32 HD23 LEU 32 7.182 21.486 10.259 218 H GLY 33 H GLY 33 11.811 21.269 8.966 219 HA2 GLY 33 HA2 GLY 33 12.190 19.654 7.416 220 HA3 GLY 33 HA3 GLY 33 11.241 18.630 8.458 221 H CYS 34 H CYS 34 10.367 17.527 6.669 222 HA CYS 34 HA CYS 34 8.507 19.073 4.964 223 HB2 CYS 34 HB2 CYS 34 10.465 17.416 4.096 224 HB3 CYS 34 HB3 CYS 34 9.060 16.359 4.109 225 H PHE 35 H PHE 35 6.515 18.932 5.218 226 HA PHE 35 HA PHE 35 5.435 16.582 6.618 227 HB2 PHE 35 HB2 PHE 35 3.382 18.469 5.819 228 HB3 PHE 35 HB3 PHE 35 3.769 17.900 7.431 229 HD1 PHE 35 HD1 PHE 35 6.365 19.089 7.980 230 HD2 PHE 35 HD2 PHE 35 3.009 20.717 5.931 231 HE1 PHE 35 HE1 PHE 35 7.082 21.358 8.610 232 HE2 PHE 35 HE2 PHE 35 3.724 22.986 6.552 233 HZ PHE 35 HZ PHE 35 5.762 23.309 7.894 234 H VAL 36 H VAL 36 5.404 15.043 5.065 235 HA VAL 36 HA VAL 36 4.741 15.891 2.383 236 HB VAL 36 HB VAL 36 5.360 13.035 3.081 237 HG11 VAL 36 HG11 VAL 36 6.329 13.176 0.743 238 HG12 VAL 36 HG12 VAL 36 5.606 14.804 0.604 239 HG13 VAL 36 HG13 VAL 36 4.578 13.365 0.853 240 HG21 VAL 36 HG21 VAL 36 7.146 14.498 4.080 241 HG22 VAL 36 HG22 VAL 36 7.442 15.163 2.477 242 HG23 VAL 36 HG23 VAL 36 7.747 13.457 2.791 243 H GLY 37 H GLY 37 2.737 16.485 2.665 244 HA2 GLY 37 HA2 GLY 37 0.463 16.113 2.231 245 HA3 GLY 37 HA3 GLY 37 0.760 14.381 2.292 246 H THR 38 H THR 38 0.389 17.263 4.292 247 HA THR 38 HA THR 38 -1.052 15.709 6.284 248 HB THR 38 HB THR 38 0.391 15.993 8.067 249 HG1 THR 38 HG1 THR 38 1.039 18.374 6.811 250 HG21 THR 38 HG21 THR 38 1.784 14.611 6.832 251 HG22 THR 38 HG22 THR 38 2.840 15.944 7.297 252 HG23 THR 38 HG23 THR 38 2.173 15.876 5.667 253 H ALA 39 H ALA 39 -2.324 17.088 7.745 254 HA ALA 39 HA ALA 39 -3.763 19.058 6.722 255 HB1 ALA 39 HB1 ALA 39 -2.871 18.643 9.534 256 HB2 ALA 39 HB2 ALA 39 -4.474 18.475 8.821 257 HB3 ALA 39 HB3 ALA 39 -3.817 20.079 9.141 258 H GLU 40 H GLU 40 -0.638 19.722 8.335 259 HA GLU 40 HA GLU 40 -0.558 22.450 8.135 260 HB2 GLU 40 HB2 GLU 40 1.797 20.652 7.524 261 HB3 GLU 40 HB3 GLU 40 1.858 22.296 8.146 262 HG2 GLU 40 HG2 GLU 40 0.711 19.920 9.597 263 HG3 GLU 40 HG3 GLU 40 2.298 20.631 9.883 264 H ALA 41 H ALA 41 0.456 20.162 5.570 265 HA ALA 41 HA ALA 41 0.973 22.137 3.624 266 HB1 ALA 41 HB1 ALA 41 2.130 20.174 3.257 267 HB2 ALA 41 HB2 ALA 41 0.805 20.023 2.103 268 HB3 ALA 41 HB3 ALA 41 0.740 19.159 3.640 269 H LEU 42 H LEU 42 -1.740 21.213 4.915 270 HA LEU 42 HA LEU 42 -3.637 20.943 2.759 271 HB2 LEU 42 HB2 LEU 42 -3.968 21.676 5.585 272 HB3 LEU 42 HB3 LEU 42 -5.152 22.396 4.513 273 HG LEU 42 HG LEU 42 -4.570 19.460 4.440 274 HD11 LEU 42 HD11 LEU 42 -5.184 19.650 6.668 275 HD12 LEU 42 HD12 LEU 42 -6.718 19.323 5.862 276 HD13 LEU 42 HD13 LEU 42 -6.311 20.969 6.350 277 HD21 LEU 42 HD21 LEU 42 -7.019 21.067 3.701 278 HD22 LEU 42 HD22 LEU 42 -6.805 19.330 3.485 279 HD23 LEU 42 HD23 LEU 42 -5.813 20.460 2.565 280 H ARG 43 H ARG 43 -2.417 23.777 4.470 281 HA ARG 43 HA ARG 43 -3.578 25.720 2.720 282 HB2 ARG 43 HB2 ARG 43 -1.642 27.167 3.724 283 HB3 ARG 43 HB3 ARG 43 -2.985 26.703 4.736 284 HG2 ARG 43 HG2 ARG 43 -1.112 24.656 5.021 285 HG3 ARG 43 HG3 ARG 43 -0.197 26.165 5.058 286 HD2 ARG 43 HD2 ARG 43 -2.709 25.970 6.651 287 HD3 ARG 43 HD3 ARG 43 -1.263 25.162 7.251 288 HE ARG 43 HE ARG 43 -0.332 27.616 6.746 289 HH11 ARG 43 HH11 ARG 43 -3.214 26.578 8.434 290 HH12 ARG 43 HH12 ARG 43 -3.237 27.950 9.490 291 HH21 ARG 43 HH21 ARG 43 -0.368 29.416 8.141 292 HH22 ARG 43 HH22 ARG 43 -1.625 29.558 9.324 293 H CYS 44 H CYS 44 -1.359 23.379 2.013 294 HA CYS 44 HA CYS 44 0.613 24.931 0.673 295 HB2 CYS 44 HB2 CYS 44 -0.107 22.070 0.666 296 HB3 CYS 44 HB3 CYS 44 0.606 22.663 -0.830 297 H GLN 45 H GLN 45 -2.672 23.529 -0.594 298 HA GLN 45 HA GLN 45 -2.493 23.903 -3.092 299 HB2 GLN 45 HB2 GLN 45 -4.669 24.786 -1.217 300 HB3 GLN 45 HB3 GLN 45 -4.890 24.583 -2.951 301 HG2 GLN 45 HG2 GLN 45 -4.246 22.208 -2.705 302 HG3 GLN 45 HG3 GLN 45 -4.146 22.450 -0.961 303 HE21 GLN 45 HE21 GLN 45 -6.036 22.778 0.221 304 HE22 GLN 45 HE22 GLN 45 -7.595 22.389 -0.415 305 H GLU 46 H GLU 46 -1.895 26.674 -1.077 306 HA GLU 46 HA GLU 46 -2.911 28.497 -3.118 307 HB2 GLU 46 HB2 GLU 46 -0.974 29.319 -0.966 308 HB3 GLU 46 HB3 GLU 46 -2.235 30.271 -1.732 309 HG2 GLU 46 HG2 GLU 46 -3.070 27.918 -0.133 310 HG3 GLU 46 HG3 GLU 46 -2.463 29.330 0.729 311 H GLU 47 H GLU 47 -0.456 26.408 -3.006 312 HA GLU 47 HA GLU 47 1.654 27.974 -4.210 313 HB2 GLU 47 HB2 GLU 47 1.847 25.847 -2.706 314 HB3 GLU 47 HB3 GLU 47 1.513 24.974 -4.195 315 HG2 GLU 47 HG2 GLU 47 3.502 26.697 -4.950 316 HG3 GLU 47 HG3 GLU 47 3.948 26.287 -3.293 317 H ASN 48 H ASN 48 -1.267 26.960 -5.265 318 HA ASN 48 HA ASN 48 -0.687 25.790 -7.785 319 HB2 ASN 48 HB2 ASN 48 -2.965 26.017 -6.415 320 HB3 ASN 48 HB3 ASN 48 -3.140 27.458 -7.413 321 HD21 ASN 48 HD21 ASN 48 -4.658 26.896 -8.833 322 HD22 ASN 48 HD22 ASN 48 -4.582 25.525 -9.881 323 H TYR 49 H TYR 49 -0.766 29.032 -6.507 324 HA TYR 49 HA TYR 49 -0.396 30.142 -9.211 325 HB2 TYR 49 HB2 TYR 49 -1.630 31.121 -6.782 326 HB3 TYR 49 HB3 TYR 49 -0.378 32.234 -7.326 327 HD1 TYR 49 HD1 TYR 49 -0.478 32.962 -9.812 328 HD2 TYR 49 HD2 TYR 49 -3.753 31.201 -7.743 329 HE1 TYR 49 HE1 TYR 49 -2.027 33.897 -11.478 330 HE2 TYR 49 HE2 TYR 49 -5.310 32.131 -9.404 331 HH TYR 49 HH TYR 49 -4.214 33.590 -12.338 332 H LEU 50 H LEU 50 1.593 28.527 -7.942 333 HA LEU 50 HA LEU 50 3.816 30.433 -7.897 334 HB2 LEU 50 HB2 LEU 50 3.233 28.348 -5.799 335 HB3 LEU 50 HB3 LEU 50 4.814 29.079 -6.000 336 HG LEU 50 HG LEU 50 2.869 31.163 -5.785 337 HD11 LEU 50 HD11 LEU 50 2.851 29.654 -3.248 338 HD12 LEU 50 HD12 LEU 50 1.822 29.032 -4.538 339 HD13 LEU 50 HD13 LEU 50 1.616 30.688 -3.966 340 HD21 LEU 50 HD21 LEU 50 4.276 31.401 -3.563 341 HD22 LEU 50 HD22 LEU 50 4.974 31.766 -5.140 342 HD23 LEU 50 HD23 LEU 50 5.302 30.214 -4.368 343 HA PRO 51 HA PRO 51 5.117 26.958 -10.501 344 HB2 PRO 51 HB2 PRO 51 6.846 28.284 -12.054 345 HB3 PRO 51 HB3 PRO 51 5.099 28.478 -12.242 346 HG2 PRO 51 HG2 PRO 51 7.074 30.278 -10.909 347 HG3 PRO 51 HG3 PRO 51 5.678 30.695 -11.918 348 HD2 PRO 51 HD2 PRO 51 5.715 30.747 -9.143 349 HD3 PRO 51 HD3 PRO 51 4.253 30.658 -10.143 350 H SER 52 H SER 52 6.127 26.987 -7.935 351 HA SER 52 HA SER 52 7.868 26.235 -6.685 352 HB2 SER 52 HB2 SER 52 8.063 24.846 -8.981 353 HB3 SER 52 HB3 SER 52 9.618 25.677 -9.014 354 HG SER 52 HG SER 52 10.276 24.322 -7.564 355 HA PRO 53 HA PRO 53 10.499 29.933 -7.094 356 HB2 PRO 53 HB2 PRO 53 9.701 31.241 -4.905 357 HB3 PRO 53 HB3 PRO 53 8.673 31.156 -6.340 358 HG2 PRO 53 HG2 PRO 53 8.393 29.775 -3.739 359 HG3 PRO 53 HG3 PRO 53 7.151 30.201 -4.927 360 HD2 PRO 53 HD2 PRO 53 8.499 27.672 -4.570 361 HD3 PRO 53 HD3 PRO 53 7.207 28.078 -5.716 362 H CYS 54 H CYS 54 10.537 30.366 -3.784 363 HA CYS 54 HA CYS 54 13.095 30.209 -3.125 364 HB2 CYS 54 HB2 CYS 54 11.167 30.756 -1.624 365 HB3 CYS 54 HB3 CYS 54 10.929 29.035 -1.366 366 H GLN 55 H GLN 55 14.510 28.699 -4.002 367 HA GLN 55 HA GLN 55 13.927 25.876 -3.842 368 HB2 GLN 55 HB2 GLN 55 15.133 27.058 -5.748 369 HB3 GLN 55 HB3 GLN 55 16.539 27.116 -4.696 370 HG2 GLN 55 HG2 GLN 55 16.807 25.239 -6.100 371 HG3 GLN 55 HG3 GLN 55 16.383 24.623 -4.505 372 HE21 GLN 55 HE21 GLN 55 15.280 25.140 -7.768 373 HE22 GLN 55 HE22 GLN 55 13.924 24.071 -7.693 374 H SER 56 H SER 56 17.244 26.134 -3.351 375 HA SER 56 HA SER 56 18.670 25.711 -1.615 376 HB2 SER 56 HB2 SER 56 16.510 26.288 0.396 377 HB3 SER 56 HB3 SER 56 18.247 26.565 0.525 378 HG SER 56 HG SER 56 16.435 28.305 -0.163 379 H GLY 57 H GLY 57 19.206 23.541 -1.354 380 HA2 GLY 57 HA2 GLY 57 18.497 21.749 0.351 381 HA3 GLY 57 HA3 GLY 57 17.065 21.696 -0.683 382 H GLN 58 H GLN 58 20.588 21.881 -1.086 383 HA GLN 58 HA GLN 58 20.356 19.846 -3.186 384 HB2 GLN 58 HB2 GLN 58 22.256 22.185 -2.966 385 HB3 GLN 58 HB3 GLN 58 22.498 20.856 -4.092 386 HG2 GLN 58 HG2 GLN 58 20.363 21.373 -5.162 387 HG3 GLN 58 HG3 GLN 58 20.122 22.706 -4.034 388 HE21 GLN 58 HE21 GLN 58 21.477 24.535 -4.185 389 HE22 GLN 58 HE22 GLN 58 22.323 24.904 -5.646 390 H LYS 59 H LYS 59 20.436 18.502 -1.392 391 HA LYS 59 HA LYS 59 23.189 17.661 -0.749 392 HB2 LYS 59 HB2 LYS 59 22.350 18.766 1.291 393 HB3 LYS 59 HB3 LYS 59 20.869 17.823 1.219 394 HG2 LYS 59 HG2 LYS 59 22.349 16.942 2.915 395 HG3 LYS 59 HG3 LYS 59 22.169 15.775 1.605 396 HD2 LYS 59 HD2 LYS 59 24.368 17.496 1.013 397 HD3 LYS 59 HD3 LYS 59 24.553 16.881 2.657 398 HE2 LYS 59 HE2 LYS 59 25.381 15.026 1.744 399 HE3 LYS 59 HE3 LYS 59 23.741 14.672 1.203 400 HZ1 LYS 59 HZ1 LYS 59 24.248 15.158 -0.910 401 HZ2 LYS 59 HZ2 LYS 59 25.850 14.915 -0.427 402 HZ3 LYS 59 HZ3 LYS 59 25.220 16.482 -0.500 403 HA PRO 60 HA PRO 60 20.260 14.698 -2.804 404 HB2 PRO 60 HB2 PRO 60 22.142 13.722 -4.565 405 HB3 PRO 60 HB3 PRO 60 21.046 15.066 -4.897 406 HG2 PRO 60 HG2 PRO 60 23.897 15.125 -3.995 407 HG3 PRO 60 HG3 PRO 60 23.082 16.133 -5.208 408 HD2 PRO 60 HD2 PRO 60 23.573 17.044 -2.737 409 HD3 PRO 60 HD3 PRO 60 22.084 17.475 -3.604 410 H CYS 61 H CYS 61 19.861 13.059 -1.798 411 HA CYS 61 HA CYS 61 21.696 10.871 -1.474 412 HB2 CYS 61 HB2 CYS 61 21.740 10.722 0.805 413 HB3 CYS 61 HB3 CYS 61 21.527 12.458 0.698 414 H GLY 62 H GLY 62 19.834 9.063 -0.182 415 HA2 GLY 62 HA2 GLY 62 17.915 7.923 -0.651 416 HA3 GLY 62 HA3 GLY 62 17.226 9.459 -1.148 417 H SER 63 H SER 63 16.104 8.002 -2.683 418 HA SER 63 HA SER 63 17.734 6.894 -4.836 419 HB2 SER 63 HB2 SER 63 15.393 6.282 -5.768 420 HB3 SER 63 HB3 SER 63 15.933 5.481 -4.293 421 HG SER 63 HG SER 63 13.716 6.735 -4.572 422 H GLY 64 H GLY 64 17.896 9.586 -4.500 423 HA2 GLY 64 HA2 GLY 64 18.314 11.035 -6.456 424 HA3 GLY 64 HA3 GLY 64 16.641 10.738 -6.886 425 H GLY 65 H GLY 65 16.742 11.145 -3.450 426 HA2 GLY 65 HA2 GLY 65 15.753 13.867 -3.897 427 HA3 GLY 65 HA3 GLY 65 15.450 12.885 -2.490 428 H ARG 66 H ARG 66 16.515 15.698 -3.149 429 HA ARG 66 HA ARG 66 19.039 15.714 -1.690 430 HB2 ARG 66 HB2 ARG 66 18.673 18.310 -2.076 431 HB3 ARG 66 HB3 ARG 66 19.318 17.270 -3.332 432 HG2 ARG 66 HG2 ARG 66 16.380 17.823 -3.156 433 HG3 ARG 66 HG3 ARG 66 17.479 18.966 -3.931 434 HD2 ARG 66 HD2 ARG 66 17.301 16.051 -4.672 435 HD3 ARG 66 HD3 ARG 66 16.383 17.323 -5.479 436 HE ARG 66 HE ARG 66 19.075 18.056 -5.510 437 HH11 ARG 66 HH11 ARG 66 17.020 15.581 -6.879 438 HH12 ARG 66 HH12 ARG 66 18.005 15.370 -8.288 439 HH21 ARG 66 HH21 ARG 66 20.366 17.774 -7.362 440 HH22 ARG 66 HH22 ARG 66 19.902 16.613 -8.561 441 H CYS 67 H CYS 67 19.304 17.107 0.212 442 HA CYS 67 HA CYS 67 17.309 16.782 2.078 443 HB2 CYS 67 HB2 CYS 67 19.700 16.610 2.631 444 HB3 CYS 67 HB3 CYS 67 19.959 18.263 2.106 445 H ALA 68 H ALA 68 15.541 18.001 1.753 446 HA ALA 68 HA ALA 68 15.741 20.745 0.793 447 HB1 ALA 68 HB1 ALA 68 13.240 20.228 2.083 448 HB2 ALA 68 HB2 ALA 68 13.663 18.819 1.109 449 HB3 ALA 68 HB3 ALA 68 13.564 20.412 0.358 450 H ALA 69 H ALA 69 15.126 18.900 3.587 451 HA ALA 69 HA ALA 69 15.791 21.174 5.433 452 HB1 ALA 69 HB1 ALA 69 13.687 19.229 6.196 453 HB2 ALA 69 HB2 ALA 69 13.292 20.427 4.963 454 HB3 ALA 69 HB3 ALA 69 13.839 20.949 6.556 455 H ALA 70 H ALA 70 16.331 20.500 7.620 456 HA ALA 70 HA ALA 70 18.290 18.567 7.776 457 HB1 ALA 70 HB1 ALA 70 17.053 18.984 10.358 458 HB2 ALA 70 HB2 ALA 70 17.276 20.497 9.481 459 HB3 ALA 70 HB3 ALA 70 18.659 19.443 9.785 460 H GLY 71 H GLY 71 18.286 16.506 7.804 461 HA2 GLY 71 HA2 GLY 71 17.892 14.359 8.311 462 HA3 GLY 71 HA3 GLY 71 16.634 14.896 9.376 463 H ILE 72 H ILE 72 15.931 16.079 6.271 464 HA ILE 72 HA ILE 72 14.459 13.623 5.523 465 HB ILE 72 HB ILE 72 12.511 14.864 5.045 466 HG12 ILE 72 HG12 ILE 72 12.925 17.405 6.186 467 HG13 ILE 72 HG13 ILE 72 14.267 17.136 5.066 468 HG21 ILE 72 HG21 ILE 72 13.655 14.692 7.660 469 HG22 ILE 72 HG22 ILE 72 11.977 14.489 7.157 470 HG23 ILE 72 HG23 ILE 72 12.588 16.093 7.565 471 HD11 ILE 72 HD11 ILE 72 11.735 16.248 4.036 472 HD12 ILE 72 HD12 ILE 72 12.951 17.301 3.292 473 HD13 ILE 72 HD13 ILE 72 11.748 17.980 4.396 474 H CYS 73 H CYS 73 15.461 12.992 3.739 475 HA CYS 73 HA CYS 73 16.563 14.848 1.806 476 HB2 CYS 73 HB2 CYS 73 16.890 12.070 2.496 477 HB3 CYS 73 HB3 CYS 73 16.564 12.215 0.773 478 H CYS 74 H CYS 74 14.748 15.897 0.983 479 HA CYS 74 HA CYS 74 12.730 14.228 -0.291 480 HB2 CYS 74 HB2 CYS 74 12.425 16.378 1.288 481 HB3 CYS 74 HB3 CYS 74 12.408 17.159 -0.292 482 H SER 75 H SER 75 12.409 14.052 -2.341 483 HA SER 75 HA SER 75 14.057 15.589 -4.235 484 HB2 SER 75 HB2 SER 75 13.649 13.648 -5.783 485 HB3 SER 75 HB3 SER 75 14.553 13.212 -4.335 486 HG SER 75 HG SER 75 12.910 11.707 -4.716 487 HA PRO 76 HA PRO 76 10.362 17.076 -6.184 488 HB2 PRO 76 HB2 PRO 76 10.389 16.405 -8.798 489 HB3 PRO 76 HB3 PRO 76 11.529 17.568 -8.113 490 HG2 PRO 76 HG2 PRO 76 11.934 14.675 -8.758 491 HG3 PRO 76 HG3 PRO 76 13.020 16.047 -9.041 492 HD2 PRO 76 HD2 PRO 76 13.303 14.323 -6.945 493 HD3 PRO 76 HD3 PRO 76 13.816 16.022 -6.885 494 H ASP 77 H ASP 77 10.240 14.329 -5.047 495 HA ASP 77 HA ASP 77 7.666 13.577 -6.201 496 HB2 ASP 77 HB2 ASP 77 10.045 11.745 -5.944 497 HB3 ASP 77 HB3 ASP 77 8.399 11.122 -5.978 498 H GLY 78 H GLY 78 10.057 12.801 -3.669 499 HA2 GLY 78 HA2 GLY 78 8.091 13.209 -1.589 500 HA3 GLY 78 HA3 GLY 78 8.576 11.529 -1.781 501 H CYS 79 H CYS 79 9.337 11.904 0.538 502 HA CYS 79 HA CYS 79 12.081 12.972 0.438 503 HB2 CYS 79 HB2 CYS 79 10.567 13.038 3.020 504 HB3 CYS 79 HB3 CYS 79 11.968 13.974 2.531 505 H HIS 80 H HIS 80 13.603 12.027 1.913 506 HA HIS 80 HA HIS 80 12.946 9.313 2.827 507 HB2 HIS 80 HB2 HIS 80 13.729 8.776 0.689 508 HB3 HIS 80 HB3 HIS 80 14.885 10.096 0.667 509 HD1 HIS 80 HD1 HIS 80 17.213 9.363 0.854 510 HD2 HIS 80 HD2 HIS 80 14.630 6.689 2.708 511 HE1 HIS 80 HE1 HIS 80 18.669 7.489 1.678 512 HE2 HIS 80 HE2 HIS 80 17.101 5.943 2.902 513 H GLU 81 H GLU 81 13.747 8.984 4.795 514 HA GLU 81 HA GLU 81 14.950 10.890 6.327 515 HB2 GLU 81 HB2 GLU 81 14.461 9.407 7.903 516 HB3 GLU 81 HB3 GLU 81 14.113 8.221 6.665 517 HG2 GLU 81 HG2 GLU 81 16.047 7.081 7.030 518 HG3 GLU 81 HG3 GLU 81 16.941 8.525 7.506 519 H ASP 82 H ASP 82 16.886 11.654 6.744 520 HA ASP 82 HA ASP 82 19.244 10.265 5.745 521 HB2 ASP 82 HB2 ASP 82 19.969 12.051 4.379 522 HB3 ASP 82 HB3 ASP 82 18.236 11.931 4.038 523 HA PRO 83 HA PRO 83 20.422 11.715 9.840 524 HB2 PRO 83 HB2 PRO 83 22.888 10.233 9.558 525 HB3 PRO 83 HB3 PRO 83 21.494 9.874 10.576 526 HG2 PRO 83 HG2 PRO 83 22.219 8.362 8.421 527 HG3 PRO 83 HG3 PRO 83 20.555 8.485 9.021 528 HD2 PRO 83 HD2 PRO 83 21.846 9.886 6.709 529 HD3 PRO 83 HD3 PRO 83 20.222 9.172 6.831 530 H ALA 84 H ALA 84 22.178 12.264 6.931 531 HA ALA 84 HA ALA 84 24.461 13.548 7.969 532 HB1 ALA 84 HB1 ALA 84 23.088 14.000 5.324 533 HB2 ALA 84 HB2 ALA 84 24.316 12.780 5.660 534 HB3 ALA 84 HB3 ALA 84 24.730 14.493 5.736 535 H CYS 85 H CYS 85 21.253 14.756 7.163 536 HA CYS 85 HA CYS 85 21.982 17.480 7.872 537 HB2 CYS 85 HB2 CYS 85 19.599 16.183 6.616 538 HB3 CYS 85 HB3 CYS 85 19.460 17.810 7.289 539 H ASP 86 H ASP 86 22.314 15.956 10.123 540 HA ASP 86 HA ASP 86 19.942 16.691 11.710 541 HB2 ASP 86 HB2 ASP 86 21.434 14.080 11.723 542 HB3 ASP 86 HB3 ASP 86 20.357 14.558 13.031 543 HA PRO 87 HA PRO 87 23.846 17.666 14.227 544 HB2 PRO 87 HB2 PRO 87 24.331 20.274 13.105 545 HB3 PRO 87 HB3 PRO 87 25.395 18.866 13.014 546 HG2 PRO 87 HG2 PRO 87 24.120 19.988 10.850 547 HG3 PRO 87 HG3 PRO 87 24.636 18.295 10.926 548 HD2 PRO 87 HD2 PRO 87 21.915 19.469 11.416 549 HD3 PRO 87 HD3 PRO 87 22.362 18.003 10.509 550 H GLU 88 H GLU 88 21.460 17.786 14.783 551 HA GLU 88 HA GLU 88 20.920 19.554 16.878 552 HB2 GLU 88 HB2 GLU 88 19.445 21.170 15.977 553 HB3 GLU 88 HB3 GLU 88 20.767 21.090 14.824 554 HG2 GLU 88 HG2 GLU 88 19.493 20.024 13.215 555 HG3 GLU 88 HG3 GLU 88 18.309 19.454 14.389 556 H ALA 89 H ALA 89 19.929 17.728 14.475 557 HA ALA 89 HA ALA 89 17.478 16.437 15.395 558 HB1 ALA 89 HB1 ALA 89 19.228 15.863 13.032 559 HB2 ALA 89 HB2 ALA 89 17.546 16.394 13.067 560 HB3 ALA 89 HB3 ALA 89 17.960 14.743 13.529 561 H ALA 90 H ALA 90 20.106 16.548 16.792 562 HA ALA 90 HA ALA 90 20.921 13.815 17.339 563 HB1 ALA 90 HB1 ALA 90 22.018 16.500 17.854 564 HB2 ALA 90 HB2 ALA 90 22.844 14.988 17.476 565 HB3 ALA 90 HB3 ALA 90 22.297 15.306 19.122 566 H PHE 91 H PHE 91 20.514 12.722 19.087 567 HA PHE 91 HA PHE 91 18.455 13.621 20.949 568 HB2 PHE 91 HB2 PHE 91 18.506 11.368 19.606 569 HB3 PHE 91 HB3 PHE 91 19.605 10.850 20.878 570 HD1 PHE 91 HD1 PHE 91 18.796 10.958 23.275 571 HD2 PHE 91 HD2 PHE 91 16.202 11.345 19.925 572 HE1 PHE 91 HE1 PHE 91 16.873 10.396 24.705 573 HE2 PHE 91 HE2 PHE 91 14.274 10.787 21.347 574 HZ PHE 91 HZ PHE 91 14.609 10.312 23.740 575 H SER 92 H SER 92 19.128 14.504 22.810 576 HA SER 92 HA SER 92 20.309 14.928 24.708 577 HB2 SER 92 HB2 SER 92 19.711 12.396 24.919 578 HB3 SER 92 HB3 SER 92 21.432 12.144 24.629 579 HG SER 92 HG SER 92 21.810 12.755 26.598 580 H1 ALA 101 H1 ALA 101 -12.365 -0.095 9.554 581 H2 ALA 101 H2 ALA 101 -12.022 -1.777 9.548 582 H3 ALA 101 H3 ALA 101 -11.800 -0.848 8.122 583 HA ALA 101 HA ALA 101 -9.927 0.088 8.820 584 HB1 ALA 101 HB1 ALA 101 -11.313 0.532 11.136 585 HB2 ALA 101 HB2 ALA 101 -9.635 0.990 10.839 586 HB3 ALA 101 HB3 ALA 101 -10.004 -0.522 11.670 587 H VAL 102 H VAL 102 -8.343 -1.138 8.201 588 HA VAL 102 HA VAL 102 -8.183 -3.924 9.049 589 HB VAL 102 HB VAL 102 -7.912 -3.405 6.665 590 HG11 VAL 102 HG11 VAL 102 -6.125 -2.121 5.777 591 HG12 VAL 102 HG12 VAL 102 -5.372 -1.950 7.363 592 HG13 VAL 102 HG13 VAL 102 -6.904 -1.144 7.021 593 HG21 VAL 102 HG21 VAL 102 -5.304 -4.351 7.842 594 HG22 VAL 102 HG22 VAL 102 -5.906 -4.666 6.215 595 HG23 VAL 102 HG23 VAL 102 -6.738 -5.351 7.610 596 H LEU 103 H LEU 103 -5.950 -4.760 9.695 597 HA LEU 103 HA LEU 103 -3.999 -2.895 10.619 598 HB2 LEU 103 HB2 LEU 103 -6.021 -3.245 12.440 599 HB3 LEU 103 HB3 LEU 103 -4.861 -4.459 12.949 600 HG LEU 103 HG LEU 103 -4.546 -2.350 14.140 601 HD11 LEU 103 HD11 LEU 103 -2.347 -3.143 12.248 602 HD12 LEU 103 HD12 LEU 103 -2.604 -3.695 13.904 603 HD13 LEU 103 HD13 LEU 103 -2.126 -2.025 13.595 604 HD21 LEU 103 HD21 LEU 103 -5.153 -0.578 12.849 605 HD22 LEU 103 HD22 LEU 103 -4.466 -1.268 11.378 606 HD23 LEU 103 HD23 LEU 103 -3.410 -0.533 12.585 607 H ASP 104 H ASP 104 -2.670 -4.245 9.298 608 HA ASP 104 HA ASP 104 -2.605 -7.069 9.998 609 HB2 ASP 104 HB2 ASP 104 -1.263 -5.424 7.858 610 HB3 ASP 104 HB3 ASP 104 -0.891 -7.129 8.106 611 H LEU 105 H LEU 105 -1.682 -6.016 12.414 612 HA LEU 105 HA LEU 105 1.180 -6.047 12.031 613 HB2 LEU 105 HB2 LEU 105 0.499 -3.856 12.735 614 HB3 LEU 105 HB3 LEU 105 -0.354 -4.561 14.087 615 HG LEU 105 HG LEU 105 2.169 -3.444 14.158 616 HD11 LEU 105 HD11 LEU 105 0.588 -5.174 15.977 617 HD12 LEU 105 HD12 LEU 105 1.028 -3.472 16.120 618 HD13 LEU 105 HD13 LEU 105 2.232 -4.723 16.432 619 HD21 LEU 105 HD21 LEU 105 3.775 -5.150 14.697 620 HD22 LEU 105 HD22 LEU 105 3.158 -5.456 13.073 621 HD23 LEU 105 HD23 LEU 105 2.581 -6.422 14.430 622 H ASP 106 H ASP 106 -1.130 -6.390 14.250 623 HA ASP 106 HA ASP 106 -1.276 -8.978 15.005 624 HB2 ASP 106 HB2 ASP 106 1.252 -8.121 15.497 625 HB3 ASP 106 HB3 ASP 106 0.540 -8.116 17.118 626 H VAL 107 H VAL 107 -0.787 -5.917 16.303 627 HA VAL 107 HA VAL 107 -3.367 -5.666 17.531 628 HB VAL 107 HB VAL 107 -2.150 -6.725 19.421 629 HG11 VAL 107 HG11 VAL 107 -0.161 -4.681 18.774 630 HG12 VAL 107 HG12 VAL 107 0.023 -6.245 19.569 631 HG13 VAL 107 HG13 VAL 107 -0.514 -4.844 20.495 632 HG21 VAL 107 HG21 VAL 107 -3.980 -5.141 19.838 633 HG22 VAL 107 HG22 VAL 107 -2.805 -3.829 19.942 634 HG23 VAL 107 HG23 VAL 107 -2.780 -5.133 21.129 635 H ARG 108 H ARG 108 -3.967 -3.495 17.079 636 HA ARG 108 HA ARG 108 -1.999 -1.940 15.842 637 HB2 ARG 108 HB2 ARG 108 -4.094 -0.256 16.049 638 HB3 ARG 108 HB3 ARG 108 -3.946 -1.451 14.774 639 HG2 ARG 108 HG2 ARG 108 -5.449 -2.941 15.912 640 HG3 ARG 108 HG3 ARG 108 -5.476 -1.902 17.336 641 HD2 ARG 108 HD2 ARG 108 -6.358 -0.095 15.708 642 HD3 ARG 108 HD3 ARG 108 -6.715 -1.454 14.642 643 HE ARG 108 HE ARG 108 -8.030 -0.802 17.155 644 HH11 ARG 108 HH11 ARG 108 -7.628 -3.105 14.554 645 HH12 ARG 108 HH12 ARG 108 -9.104 -3.941 14.904 646 HH21 ARG 108 HH21 ARG 108 -9.968 -1.906 17.608 647 HH22 ARG 108 HH22 ARG 108 -10.430 -3.263 16.634 648 H THR 109 H THR 109 -0.524 -0.988 17.097 649 HA THR 109 HA THR 109 -1.733 0.529 19.308 650 HB THR 109 HB THR 109 1.188 0.656 19.176 651 HG1 THR 109 HG1 THR 109 0.833 -1.537 18.424 652 HG21 THR 109 HG21 THR 109 -0.871 0.233 21.232 653 HG22 THR 109 HG22 THR 109 0.567 1.255 21.249 654 HG23 THR 109 HG23 THR 109 0.711 -0.475 21.562 655 H CYS 110 H CYS 110 -2.631 1.682 17.766 656 HA CYS 110 HA CYS 110 -1.093 2.798 15.622 657 HB2 CYS 110 HB2 CYS 110 -3.838 3.559 16.608 658 HB3 CYS 110 HB3 CYS 110 -3.122 4.102 15.093 659 H LEU 111 H LEU 111 0.628 3.585 17.092 660 HA LEU 111 HA LEU 111 0.699 5.607 18.854 661 HB2 LEU 111 HB2 LEU 111 2.622 6.069 16.675 662 HB3 LEU 111 HB3 LEU 111 2.895 5.849 18.390 663 HG LEU 111 HG LEU 111 2.391 3.344 17.914 664 HD11 LEU 111 HD11 LEU 111 3.462 3.071 15.444 665 HD12 LEU 111 HD12 LEU 111 2.479 4.517 15.225 666 HD13 LEU 111 HD13 LEU 111 1.734 3.023 15.791 667 HD21 LEU 111 HD21 LEU 111 4.879 4.857 17.210 668 HD22 LEU 111 HD22 LEU 111 4.815 3.100 17.068 669 HD23 LEU 111 HD23 LEU 111 4.540 3.870 18.631 670 HA PRO 112 HA PRO 112 -1.237 8.983 16.531 671 HB2 PRO 112 HB2 PRO 112 -2.323 10.232 18.589 672 HB3 PRO 112 HB3 PRO 112 -2.924 8.635 18.122 673 HG2 PRO 112 HG2 PRO 112 -1.044 9.379 20.332 674 HG3 PRO 112 HG3 PRO 112 -2.429 8.273 20.369 675 HD2 PRO 112 HD2 PRO 112 0.200 7.488 20.043 676 HD3 PRO 112 HD3 PRO 112 -1.208 6.538 19.529 677 H CYS 113 H CYS 113 -0.354 11.033 15.916 678 HA CYS 113 HA CYS 113 1.020 12.607 17.913 679 HB2 CYS 113 HB2 CYS 113 3.159 12.514 17.065 680 HB3 CYS 113 HB3 CYS 113 2.664 10.915 16.574 681 H GLY 114 H GLY 114 1.658 14.820 16.645 682 HA2 GLY 114 HA2 GLY 114 0.979 16.543 15.246 683 HA3 GLY 114 HA3 GLY 114 0.213 15.336 14.231 684 HA PRO 115 HA PRO 115 -3.204 18.011 16.057 685 HB2 PRO 115 HB2 PRO 115 -4.550 18.479 13.846 686 HB3 PRO 115 HB3 PRO 115 -2.962 19.266 14.059 687 HG2 PRO 115 HG2 PRO 115 -3.499 16.567 12.976 688 HG3 PRO 115 HG3 PRO 115 -2.935 17.955 11.965 689 HD2 PRO 115 HD2 PRO 115 -1.063 16.407 12.925 690 HD3 PRO 115 HD3 PRO 115 -0.918 18.130 13.373 691 H GLY 116 H GLY 116 -4.746 17.111 16.910 692 HA2 GLY 116 HA2 GLY 116 -6.561 15.877 17.564 693 HA3 GLY 116 HA3 GLY 116 -6.663 15.268 15.912 694 H GLY 117 H GLY 117 -3.767 14.719 16.203 695 HA2 GLY 117 HA2 GLY 117 -2.301 13.195 16.931 696 HA3 GLY 117 HA3 GLY 117 -3.474 12.781 18.113 697 H LYS 118 H LYS 118 -4.621 12.864 14.984 698 HA LYS 118 HA LYS 118 -5.010 10.018 14.736 699 HB2 LYS 118 HB2 LYS 118 -5.279 11.487 12.240 700 HB3 LYS 118 HB3 LYS 118 -6.496 10.573 13.108 701 HG2 LYS 118 HG2 LYS 118 -6.185 12.979 14.519 702 HG3 LYS 118 HG3 LYS 118 -6.186 13.413 12.813 703 HD2 LYS 118 HD2 LYS 118 -8.240 11.705 12.836 704 HD3 LYS 118 HD3 LYS 118 -8.308 12.265 14.513 705 HE2 LYS 118 HE2 LYS 118 -8.570 14.523 13.845 706 HE3 LYS 118 HE3 LYS 118 -8.146 14.154 12.174 707 HZ1 LYS 118 HZ1 LYS 118 -10.191 13.113 11.817 708 HZ2 LYS 118 HZ2 LYS 118 -10.584 14.501 12.702 709 HZ3 LYS 118 HZ3 LYS 118 -10.539 12.994 13.470 710 H GLY 119 H GLY 119 -2.458 11.733 14.662 711 HA2 GLY 119 HA2 GLY 119 -1.193 10.853 12.206 712 HA3 GLY 119 HA3 GLY 119 -0.478 11.903 13.411 713 H ARG 120 H ARG 120 -0.376 9.059 12.073 714 HA ARG 120 HA ARG 120 0.782 7.737 14.388 715 HB2 ARG 120 HB2 ARG 120 -0.677 6.926 12.050 716 HB3 ARG 120 HB3 ARG 120 0.644 5.815 12.422 717 HG2 ARG 120 HG2 ARG 120 -0.948 4.914 13.770 718 HG3 ARG 120 HG3 ARG 120 -0.331 6.143 14.877 719 HD2 ARG 120 HD2 ARG 120 -2.388 6.964 15.018 720 HD3 ARG 120 HD3 ARG 120 -2.255 7.446 13.327 721 HE ARG 120 HE ARG 120 -3.050 4.949 13.030 722 HH11 ARG 120 HH11 ARG 120 -4.208 7.347 15.297 723 HH12 ARG 120 HH12 ARG 120 -5.814 6.699 15.347 724 HH21 ARG 120 HH21 ARG 120 -5.158 4.104 13.101 725 HH22 ARG 120 HH22 ARG 120 -6.352 4.861 14.102 726 H CYS 121 H CYS 121 2.800 6.963 14.690 727 HA CYS 121 HA CYS 121 4.748 7.789 12.632 728 HB2 CYS 121 HB2 CYS 121 4.724 8.437 15.243 729 HB3 CYS 121 HB3 CYS 121 5.685 6.967 15.331 730 H PHE 122 H PHE 122 5.875 6.417 11.525 731 HA PHE 122 HA PHE 122 5.796 3.562 12.198 732 HB2 PHE 122 HB2 PHE 122 6.562 4.942 9.606 733 HB3 PHE 122 HB3 PHE 122 6.472 3.202 9.849 734 HD1 PHE 122 HD1 PHE 122 4.294 6.220 10.266 735 HD2 PHE 122 HD2 PHE 122 4.585 2.140 9.076 736 HE1 PHE 122 HE1 PHE 122 1.935 6.249 9.572 737 HE2 PHE 122 HE2 PHE 122 2.231 2.165 8.390 738 HZ PHE 122 HZ PHE 122 0.900 4.221 8.633 739 H GLY 123 H GLY 123 7.967 6.175 11.215 740 HA2 GLY 123 HA2 GLY 123 10.230 4.647 12.347 741 HA3 GLY 123 HA3 GLY 123 10.389 5.659 10.917 742 HA PRO 124 HA PRO 124 11.345 8.633 14.193 743 HB2 PRO 124 HB2 PRO 124 13.463 9.776 13.002 744 HB3 PRO 124 HB3 PRO 124 13.565 8.171 13.732 745 HG2 PRO 124 HG2 PRO 124 13.587 8.928 10.894 746 HG3 PRO 124 HG3 PRO 124 14.132 7.428 11.659 747 HD2 PRO 124 HD2 PRO 124 11.597 7.991 10.339 748 HD3 PRO 124 HD3 PRO 124 12.226 6.436 10.926 749 H SER 125 H SER 125 12.165 10.024 11.015 750 HA SER 125 HA SER 125 10.493 12.339 11.612 751 HB2 SER 125 HB2 SER 125 12.763 11.779 9.772 752 HB3 SER 125 HB3 SER 125 11.561 12.934 9.164 753 HG SER 125 HG SER 125 13.274 13.908 10.393 754 H ILE 126 H ILE 126 8.963 10.124 11.302 755 HA ILE 126 HA ILE 126 7.460 10.797 8.926 756 HB ILE 126 HB ILE 126 8.959 8.241 9.228 757 HG12 ILE 126 HG12 ILE 126 8.114 9.730 6.752 758 HG13 ILE 126 HG13 ILE 126 9.515 10.199 7.713 759 HG21 ILE 126 HG21 ILE 126 6.559 7.523 9.164 760 HG22 ILE 126 HG22 ILE 126 7.539 6.953 7.814 761 HG23 ILE 126 HG23 ILE 126 6.433 8.308 7.589 762 HD11 ILE 126 HD11 ILE 126 9.544 8.466 5.611 763 HD12 ILE 126 HD12 ILE 126 9.477 7.370 6.992 764 HD13 ILE 126 HD13 ILE 126 10.773 8.561 6.872 765 H CYS 127 H CYS 127 5.470 11.077 9.553 766 HA CYS 127 HA CYS 127 4.130 9.177 11.362 767 HB2 CYS 127 HB2 CYS 127 4.980 11.626 12.298 768 HB3 CYS 127 HB3 CYS 127 3.379 12.029 11.709 769 H CYS 128 H CYS 128 2.609 8.364 9.919 770 HA CYS 128 HA CYS 128 1.217 10.353 8.261 771 HB2 CYS 128 HB2 CYS 128 1.098 7.764 7.005 772 HB3 CYS 128 HB3 CYS 128 1.651 9.297 6.360 773 H GLY 129 H GLY 129 -0.901 10.462 8.276 774 HA2 GLY 129 HA2 GLY 129 -2.422 8.265 9.494 775 HA3 GLY 129 HA3 GLY 129 -2.850 9.960 9.636 776 H ASP 130 H ASP 130 -4.766 8.642 9.025 777 HA ASP 130 HA ASP 130 -5.368 7.871 6.439 778 HB2 ASP 130 HB2 ASP 130 -6.510 7.236 8.654 779 HB3 ASP 130 HB3 ASP 130 -7.416 8.728 8.438 780 H GLU 131 H GLU 131 -5.534 10.914 7.986 781 HA GLU 131 HA GLU 131 -6.378 12.066 5.417 782 HB2 GLU 131 HB2 GLU 131 -7.706 13.651 7.423 783 HB3 GLU 131 HB3 GLU 131 -8.382 12.903 5.990 784 HG2 GLU 131 HG2 GLU 131 -8.444 10.759 7.444 785 HG3 GLU 131 HG3 GLU 131 -8.273 11.876 8.795 786 H LEU 132 H LEU 132 -4.291 11.956 7.499 787 HA LEU 132 HA LEU 132 -3.466 14.744 7.618 788 HB2 LEU 132 HB2 LEU 132 -3.943 12.801 9.558 789 HB3 LEU 132 HB3 LEU 132 -2.222 12.965 9.473 790 HG LEU 132 HG LEU 132 -4.062 15.317 9.839 791 HD11 LEU 132 HD11 LEU 132 -4.267 13.475 11.608 792 HD12 LEU 132 HD12 LEU 132 -3.986 15.130 12.151 793 HD13 LEU 132 HD13 LEU 132 -2.652 13.976 12.113 794 HD21 LEU 132 HD21 LEU 132 -1.780 15.963 11.107 795 HD22 LEU 132 HD22 LEU 132 -2.106 16.339 9.415 796 HD23 LEU 132 HD23 LEU 132 -1.147 14.919 9.835 797 H GLY 133 H GLY 133 -2.851 11.693 6.467 798 HA2 GLY 133 HA2 GLY 133 -1.174 10.724 5.347 799 HA3 GLY 133 HA3 GLY 133 -0.852 12.344 4.886 800 H CYS 134 H CYS 134 1.435 11.934 4.820 801 HA CYS 134 HA CYS 134 2.708 11.280 7.431 802 HB2 CYS 134 HB2 CYS 134 3.197 10.068 5.061 803 HB3 CYS 134 HB3 CYS 134 4.515 11.228 5.172 804 H PHE 135 H PHE 135 3.687 12.601 8.568 805 HA PHE 135 HA PHE 135 4.667 15.085 7.318 806 HB2 PHE 135 HB2 PHE 135 5.161 15.003 10.175 807 HB3 PHE 135 HB3 PHE 135 4.259 16.196 9.260 808 HD1 PHE 135 HD1 PHE 135 1.885 14.750 8.404 809 HD2 PHE 135 HD2 PHE 135 4.003 14.555 12.087 810 HE1 PHE 135 HE1 PHE 135 -0.182 14.071 9.552 811 HE2 PHE 135 HE2 PHE 135 1.942 13.871 13.241 812 HZ PHE 135 HZ PHE 135 -0.155 13.629 11.974 813 H VAL 136 H VAL 136 6.546 14.447 6.415 814 HA VAL 136 HA VAL 136 8.122 12.497 7.855 815 HB VAL 136 HB VAL 136 8.935 13.683 5.211 816 HG11 VAL 136 HG11 VAL 136 10.396 11.944 5.082 817 HG12 VAL 136 HG12 VAL 136 9.335 10.841 5.959 818 HG13 VAL 136 HG13 VAL 136 10.279 12.044 6.839 819 HG21 VAL 136 HG21 VAL 136 6.575 12.902 5.014 820 HG22 VAL 136 HG22 VAL 136 7.072 11.314 5.592 821 HG23 VAL 136 HG23 VAL 136 7.681 11.921 4.052 822 H GLY 137 H GLY 137 8.642 13.650 9.570 823 HA2 GLY 137 HA2 GLY 137 10.307 14.729 10.815 824 HA3 GLY 137 HA3 GLY 137 11.102 15.185 9.312 825 H THR 138 H THR 138 8.371 15.951 11.417 826 HA THR 138 HA THR 138 8.738 18.789 10.874 827 HB THR 138 HB THR 138 6.681 19.228 9.910 828 HG1 THR 138 HG1 THR 138 5.806 17.120 11.469 829 HG21 THR 138 HG21 THR 138 7.604 17.941 8.181 830 HG22 THR 138 HG22 THR 138 5.946 17.368 8.360 831 HG23 THR 138 HG23 THR 138 7.280 16.426 9.025 832 H ALA 139 H ALA 139 7.656 20.171 12.528 833 HA ALA 139 HA ALA 139 7.950 19.519 15.073 834 HB1 ALA 139 HB1 ALA 139 5.873 21.262 13.819 835 HB2 ALA 139 HB2 ALA 139 7.317 21.709 14.726 836 HB3 ALA 139 HB3 ALA 139 5.915 21.053 15.570 837 H GLU 140 H GLU 140 4.868 18.744 13.334 838 HA GLU 140 HA GLU 140 3.458 17.644 15.375 839 HB2 GLU 140 HB2 GLU 140 3.638 16.446 12.603 840 HB3 GLU 140 HB3 GLU 140 2.274 16.355 13.710 841 HG2 GLU 140 HG2 GLU 140 3.320 18.878 12.436 842 HG3 GLU 140 HG3 GLU 140 1.908 17.968 11.899 843 H ALA 141 H ALA 141 5.852 15.919 13.365 844 HA ALA 141 HA ALA 141 5.718 13.483 14.770 845 HB1 ALA 141 HB1 ALA 141 6.499 13.247 12.608 846 HB2 ALA 141 HB2 ALA 141 7.989 13.145 13.546 847 HB3 ALA 141 HB3 ALA 141 7.563 14.649 12.729 848 H LEU 142 H LEU 142 6.899 16.334 15.626 849 HA LEU 142 HA LEU 142 9.354 15.816 16.997 850 HB2 LEU 142 HB2 LEU 142 7.306 17.900 17.343 851 HB3 LEU 142 HB3 LEU 142 8.190 17.512 18.804 852 HG LEU 142 HG LEU 142 9.628 18.127 16.245 853 HD11 LEU 142 HD11 LEU 142 9.158 20.289 16.347 854 HD12 LEU 142 HD12 LEU 142 9.594 20.350 18.055 855 HD13 LEU 142 HD13 LEU 142 7.950 19.925 17.579 856 HD21 LEU 142 HD21 LEU 142 11.285 17.443 17.600 857 HD22 LEU 142 HD22 LEU 142 10.327 17.683 19.062 858 HD23 LEU 142 HD23 LEU 142 11.133 19.054 18.300 859 H ARG 143 H ARG 143 6.004 15.482 18.086 860 HA ARG 143 HA ARG 143 6.611 14.169 20.558 861 HB2 ARG 143 HB2 ARG 143 4.143 13.354 20.249 862 HB3 ARG 143 HB3 ARG 143 4.458 15.030 20.617 863 HG2 ARG 143 HG2 ARG 143 4.473 14.874 17.832 864 HG3 ARG 143 HG3 ARG 143 3.115 13.885 18.371 865 HD2 ARG 143 HD2 ARG 143 3.514 16.567 19.606 866 HD3 ARG 143 HD3 ARG 143 2.844 16.478 17.978 867 HE ARG 143 HE ARG 143 1.283 14.753 19.295 868 HH11 ARG 143 HH11 ARG 143 2.293 17.997 20.122 869 HH12 ARG 143 HH12 ARG 143 0.850 18.352 21.011 870 HH21 ARG 143 HH21 ARG 143 -0.613 15.228 20.465 871 HH22 ARG 143 HH22 ARG 143 -0.797 16.783 21.206 872 H CYS 144 H CYS 144 7.231 13.177 17.488 873 HA CYS 144 HA CYS 144 6.195 10.523 17.570 874 HB2 CYS 144 HB2 CYS 144 8.202 11.881 15.884 875 HB3 CYS 144 HB3 CYS 144 8.448 10.150 16.091 876 H GLN 145 H GLN 145 9.486 11.891 18.826 877 HA GLN 145 HA GLN 145 10.791 9.770 19.354 878 HB2 GLN 145 HB2 GLN 145 10.223 12.116 21.144 879 HB3 GLN 145 HB3 GLN 145 11.559 10.997 21.385 880 HG2 GLN 145 HG2 GLN 145 12.419 11.616 19.152 881 HG3 GLN 145 HG3 GLN 145 11.116 12.797 19.013 882 HE21 GLN 145 HE21 GLN 145 11.157 14.646 20.302 883 HE22 GLN 145 HE22 GLN 145 12.594 15.171 21.106 884 H GLU 146 H GLU 146 7.619 10.032 20.752 885 HA GLU 146 HA GLU 146 8.407 8.451 23.077 886 HB2 GLU 146 HB2 GLU 146 5.563 8.715 22.129 887 HB3 GLU 146 HB3 GLU 146 6.162 8.528 23.770 888 HG2 GLU 146 HG2 GLU 146 6.916 10.991 22.303 889 HG3 GLU 146 HG3 GLU 146 5.247 10.831 22.845 890 H GLU 147 H GLU 147 8.253 7.852 19.911 891 HA GLU 147 HA GLU 147 7.034 5.231 19.910 892 HB2 GLU 147 HB2 GLU 147 7.187 6.969 17.965 893 HB3 GLU 147 HB3 GLU 147 8.806 6.323 17.744 894 HG2 GLU 147 HG2 GLU 147 7.275 4.057 17.869 895 HG3 GLU 147 HG3 GLU 147 6.222 5.195 17.029 896 H ASN 148 H ASN 148 9.798 6.416 21.184 897 HA ASN 148 HA ASN 148 11.771 4.574 20.304 898 HB2 ASN 148 HB2 ASN 148 11.950 6.817 21.738 899 HB3 ASN 148 HB3 ASN 148 11.855 5.681 23.080 900 HD21 ASN 148 HD21 ASN 148 13.867 5.648 23.845 901 HD22 ASN 148 HD22 ASN 148 15.277 5.270 22.922 902 H TYR 149 H TYR 149 9.149 4.504 22.601 903 HA TYR 149 HA TYR 149 10.048 1.881 23.596 904 HB2 TYR 149 HB2 TYR 149 8.582 4.085 24.766 905 HB3 TYR 149 HB3 TYR 149 7.646 2.599 24.876 906 HD1 TYR 149 HD1 TYR 149 8.867 0.532 25.855 907 HD2 TYR 149 HD2 TYR 149 10.250 4.528 26.334 908 HE1 TYR 149 HE1 TYR 149 10.200 -0.167 27.800 909 HE2 TYR 149 HE2 TYR 149 11.586 3.838 28.280 910 HH TYR 149 HH TYR 149 12.628 1.252 28.976 911 H LEU 150 H LEU 150 9.130 2.259 20.916 912 HA LEU 150 HA LEU 150 6.861 0.406 20.909 913 HB2 LEU 150 HB2 LEU 150 7.014 3.016 19.408 914 HB3 LEU 150 HB3 LEU 150 5.907 1.730 18.970 915 HG LEU 150 HG LEU 150 5.590 2.292 21.754 916 HD11 LEU 150 HD11 LEU 150 4.912 4.591 21.712 917 HD12 LEU 150 HD12 LEU 150 5.258 4.709 19.986 918 HD13 LEU 150 HD13 LEU 150 6.576 4.491 21.137 919 HD21 LEU 150 HD21 LEU 150 3.312 3.118 20.670 920 HD22 LEU 150 HD22 LEU 150 3.732 1.408 20.783 921 HD23 LEU 150 HD23 LEU 150 3.974 2.278 19.268 922 HA PRO 151 HA PRO 151 9.827 -1.137 17.847 923 HB2 PRO 151 HB2 PRO 151 9.164 -3.726 17.960 924 HB3 PRO 151 HB3 PRO 151 10.079 -2.951 19.258 925 HG2 PRO 151 HG2 PRO 151 7.180 -3.654 19.142 926 HG3 PRO 151 HG3 PRO 151 8.311 -3.771 20.502 927 HD2 PRO 151 HD2 PRO 151 6.493 -1.711 20.108 928 HD3 PRO 151 HD3 PRO 151 7.938 -1.613 21.130 929 H SER 152 H SER 152 7.651 0.225 16.839 930 HA SER 152 HA SER 152 6.380 0.441 14.970 931 HB2 SER 152 HB2 SER 152 8.535 -0.941 14.141 932 HB3 SER 152 HB3 SER 152 7.276 -2.119 13.769 933 HG SER 152 HG SER 152 7.671 -0.665 12.032 934 HA PRO 153 HA PRO 153 3.167 -2.582 16.114 935 HB2 PRO 153 HB2 PRO 153 1.442 -0.914 17.286 936 HB3 PRO 153 HB3 PRO 153 2.938 -1.392 18.095 937 HG2 PRO 153 HG2 PRO 153 2.213 1.193 16.854 938 HG3 PRO 153 HG3 PRO 153 3.372 0.851 18.149 939 HD2 PRO 153 HD2 PRO 153 3.886 1.206 15.330 940 HD3 PRO 153 HD3 PRO 153 5.056 0.931 16.637 941 H CYS 154 H CYS 154 0.783 -0.256 15.927 942 HA CYS 154 HA CYS 154 -0.874 -1.136 14.063 943 HB2 CYS 154 HB2 CYS 154 -1.130 0.909 15.489 944 HB3 CYS 154 HB3 CYS 154 -0.192 1.802 14.304 945 H GLN 155 H GLN 155 -0.226 -2.099 12.126 946 HA GLN 155 HA GLN 155 1.623 -0.699 10.387 947 HB2 GLN 155 HB2 GLN 155 1.547 -3.213 10.772 948 HB3 GLN 155 HB3 GLN 155 0.115 -3.233 9.754 949 HG2 GLN 155 HG2 GLN 155 1.941 -3.815 8.379 950 HG3 GLN 155 HG3 GLN 155 1.496 -2.163 7.956 951 HE21 GLN 155 HE21 GLN 155 3.851 -4.186 9.536 952 HE22 GLN 155 HE22 GLN 155 5.116 -3.010 9.596 953 H SER 156 H SER 156 -0.554 -2.283 8.371 954 HA SER 156 HA SER 156 -2.153 -1.631 6.879 955 HB2 SER 156 HB2 SER 156 -2.649 0.912 8.405 956 HB3 SER 156 HB3 SER 156 -3.786 -0.064 7.476 957 HG SER 156 HG SER 156 -3.229 -0.184 10.082 958 H GLY 157 H GLY 157 -1.353 -1.040 4.907 959 HA2 GLY 157 HA2 GLY 157 -1.088 1.251 3.720 960 HA3 GLY 157 HA3 GLY 157 0.346 1.315 4.747 961 H GLN 158 H GLN 158 -1.314 -1.060 2.659 962 HA GLN 158 HA GLN 158 1.340 -1.799 1.641 963 HB2 GLN 158 HB2 GLN 158 -1.117 -3.501 2.091 964 HB3 GLN 158 HB3 GLN 158 0.251 -4.039 1.129 965 HG2 GLN 158 HG2 GLN 158 1.710 -3.816 3.076 966 HG3 GLN 158 HG3 GLN 158 0.338 -3.274 4.039 967 HE21 GLN 158 HE21 GLN 158 -1.299 -4.763 4.566 968 HE22 GLN 158 HE22 GLN 158 -1.019 -6.467 4.510 969 H LYS 159 H LYS 159 0.656 0.117 0.394 970 HA LYS 159 HA LYS 159 -0.549 -0.741 -2.142 971 HB2 LYS 159 HB2 LYS 159 -1.947 0.967 -1.108 972 HB3 LYS 159 HB3 LYS 159 -0.558 2.031 -0.938 973 HG2 LYS 159 HG2 LYS 159 -1.955 2.686 -2.811 974 HG3 LYS 159 HG3 LYS 159 -0.357 2.175 -3.357 975 HD2 LYS 159 HD2 LYS 159 -2.055 -0.107 -3.316 976 HD3 LYS 159 HD3 LYS 159 -2.900 1.196 -4.156 977 HE2 LYS 159 HE2 LYS 159 -1.702 0.679 -5.959 978 HE3 LYS 159 HE3 LYS 159 -0.296 1.324 -5.112 979 HZ1 LYS 159 HZ1 LYS 159 -1.024 -1.416 -4.476 980 HZ2 LYS 159 HZ2 LYS 159 0.503 -0.724 -4.697 981 HZ3 LYS 159 HZ3 LYS 159 -0.430 -1.156 -6.039 982 HA PRO 160 HA PRO 160 4.030 0.228 -2.243 983 HB2 PRO 160 HB2 PRO 160 4.738 -1.833 -3.934 984 HB3 PRO 160 HB3 PRO 160 4.766 -1.906 -2.169 985 HG2 PRO 160 HG2 PRO 160 2.667 -2.865 -4.072 986 HG3 PRO 160 HG3 PRO 160 3.300 -3.650 -2.612 987 HD2 PRO 160 HD2 PRO 160 0.942 -2.375 -2.594 988 HD3 PRO 160 HD3 PRO 160 2.031 -2.312 -1.193 989 H CYS 161 H CYS 161 4.549 1.773 -3.362 990 HA CYS 161 HA CYS 161 4.670 1.713 -6.238 991 HB2 CYS 161 HB2 CYS 161 3.266 3.456 -6.726 992 HB3 CYS 161 HB3 CYS 161 2.448 2.911 -5.276 993 H GLY 162 H GLY 162 5.867 4.232 -6.668 994 HA2 GLY 162 HA2 GLY 162 7.761 5.436 -6.169 995 HA3 GLY 162 HA3 GLY 162 7.557 4.951 -4.494 996 H SER 163 H SER 163 9.946 4.913 -4.627 997 HA SER 163 HA SER 163 11.118 2.738 -6.185 998 HB2 SER 163 HB2 SER 163 13.268 3.557 -4.994 999 HB3 SER 163 HB3 SER 163 12.504 4.638 -6.159 1000 HG SER 163 HG SER 163 11.421 5.057 -3.759 1001 H GLY 164 H GLY 164 9.271 2.002 -4.312 1002 HA2 GLY 164 HA2 GLY 164 9.484 -0.193 -3.202 1003 HA3 GLY 164 HA3 GLY 164 10.797 0.526 -2.290 1004 H GLY 165 H GLY 165 8.302 2.942 -2.536 1005 HA2 GLY 165 HA2 GLY 165 7.562 2.216 0.201 1006 HA3 GLY 165 HA3 GLY 165 7.382 3.788 -0.533 1007 H ARG 166 H ARG 166 5.647 1.753 0.974 1008 HA ARG 166 HA ARG 166 3.400 1.435 -0.857 1009 HB2 ARG 166 HB2 ARG 166 2.356 0.487 1.386 1010 HB3 ARG 166 HB3 ARG 166 3.411 -0.481 0.376 1011 HG2 ARG 166 HG2 ARG 166 4.510 1.120 2.656 1012 HG3 ARG 166 HG3 ARG 166 3.784 -0.467 2.919 1013 HD2 ARG 166 HD2 ARG 166 6.009 0.049 0.953 1014 HD3 ARG 166 HD3 ARG 166 6.277 -0.468 2.616 1015 HE ARG 166 HE ARG 166 4.483 -2.253 1.441 1016 HH11 ARG 166 HH11 ARG 166 7.831 -1.305 1.108 1017 HH12 ARG 166 HH12 ARG 166 8.339 -2.854 0.523 1018 HH21 ARG 166 HH21 ARG 166 5.155 -4.287 0.673 1019 HH22 ARG 166 HH22 ARG 166 6.822 -4.544 0.277 1020 H CYS 167 H CYS 167 1.255 2.262 -0.261 1021 HA CYS 167 HA CYS 167 1.290 4.903 0.499 1022 HB2 CYS 167 HB2 CYS 167 -0.203 4.039 -1.252 1023 HB3 CYS 167 HB3 CYS 167 -0.946 2.940 -0.103 1024 H ALA 168 H ALA 168 1.717 5.247 2.602 1025 HA ALA 168 HA ALA 168 0.661 3.493 4.676 1026 HB1 ALA 168 HB1 ALA 168 2.518 5.732 4.516 1027 HB2 ALA 168 HB2 ALA 168 2.400 4.461 5.733 1028 HB3 ALA 168 HB3 ALA 168 1.397 5.906 5.866 1029 H ALA 169 H ALA 169 0.258 6.572 3.291 1030 HA ALA 169 HA ALA 169 -2.568 6.837 4.282 1031 HB1 ALA 169 HB1 ALA 169 -0.807 9.223 4.058 1032 HB2 ALA 169 HB2 ALA 169 -0.575 8.126 5.420 1033 HB3 ALA 169 HB3 ALA 169 -2.143 8.890 5.161 1034 H ALA 170 H ALA 170 -3.856 8.409 3.101 1035 HA ALA 170 HA ALA 170 -3.871 8.065 0.365 1036 HB1 ALA 170 HB1 ALA 170 -5.842 9.088 0.487 1037 HB2 ALA 170 HB2 ALA 170 -5.111 10.576 1.095 1038 HB3 ALA 170 HB3 ALA 170 -5.530 9.280 2.215 1039 H GLY 171 H GLY 171 -2.710 8.776 -1.185 1040 HA2 GLY 171 HA2 GLY 171 -1.606 10.096 -2.620 1041 HA3 GLY 171 HA3 GLY 171 -1.939 11.432 -1.566 1042 H ILE 172 H ILE 172 -0.279 9.089 0.230 1043 HA ILE 172 HA ILE 172 2.370 10.167 -0.548 1044 HB ILE 172 HB ILE 172 2.978 10.485 1.710 1045 HG12 ILE 172 HG12 ILE 172 0.585 10.273 3.179 1046 HG13 ILE 172 HG13 ILE 172 0.750 8.762 2.277 1047 HG21 ILE 172 HG21 ILE 172 0.716 11.840 0.514 1048 HG22 ILE 172 HG22 ILE 172 2.130 12.502 1.333 1049 HG23 ILE 172 HG23 ILE 172 0.728 11.987 2.271 1050 HD11 ILE 172 HD11 ILE 172 3.211 9.725 3.453 1051 HD12 ILE 172 HD12 ILE 172 2.504 8.103 3.474 1052 HD13 ILE 172 HD13 ILE 172 1.966 9.320 4.639 1053 H CYS 173 H CYS 173 3.346 8.465 -1.404 1054 HA CYS 173 HA CYS 173 2.952 5.763 -0.434 1055 HB2 CYS 173 HB2 CYS 173 3.923 7.025 -2.836 1056 HB3 CYS 173 HB3 CYS 173 5.108 5.860 -2.261 1057 H CYS 174 H CYS 174 3.819 5.807 1.641 1058 HA CYS 174 HA CYS 174 6.628 6.543 1.876 1059 HB2 CYS 174 HB2 CYS 174 4.553 7.191 3.453 1060 HB3 CYS 174 HB3 CYS 174 5.123 5.747 4.286 1061 H SER 175 H SER 175 8.202 5.232 2.255 1062 HA SER 175 HA SER 175 7.679 2.359 2.630 1063 HB2 SER 175 HB2 SER 175 9.985 2.067 1.665 1064 HB3 SER 175 HB3 SER 175 8.839 2.796 0.539 1065 HG SER 175 HG SER 175 11.062 3.777 0.878 1066 HA PRO 176 HA PRO 176 9.988 2.472 6.414 1067 HB2 PRO 176 HB2 PRO 176 12.024 0.703 6.277 1068 HB3 PRO 176 HB3 PRO 176 10.332 0.190 6.316 1069 HG2 PRO 176 HG2 PRO 176 12.183 0.440 3.978 1070 HG3 PRO 176 HG3 PRO 176 11.018 -0.844 4.352 1071 HD2 PRO 176 HD2 PRO 176 10.518 1.157 2.566 1072 HD3 PRO 176 HD3 PRO 176 9.246 0.347 3.501 1073 H ASP 177 H ASP 177 10.893 4.315 4.260 1074 HA ASP 177 HA ASP 177 13.392 5.142 5.522 1075 HB2 ASP 177 HB2 ASP 177 13.037 4.608 2.577 1076 HB3 ASP 177 HB3 ASP 177 14.268 5.717 3.174 1077 H GLY 178 H GLY 178 10.981 5.968 3.026 1078 HA2 GLY 178 HA2 GLY 178 10.442 8.513 4.289 1079 HA3 GLY 178 HA3 GLY 178 11.269 8.654 2.743 1080 H CYS 179 H CYS 179 9.184 9.851 2.192 1081 HA CYS 179 HA CYS 179 7.213 7.874 1.256 1082 HB2 CYS 179 HB2 CYS 179 6.328 10.665 1.884 1083 HB3 CYS 179 HB3 CYS 179 5.370 9.200 1.756 1084 H HIS 180 H HIS 180 5.954 8.563 -0.635 1085 HA HIS 180 HA HIS 180 7.282 10.477 -2.417 1086 HB2 HIS 180 HB2 HIS 180 8.592 8.605 -2.987 1087 HB3 HIS 180 HB3 HIS 180 7.275 7.477 -2.721 1088 HD1 HIS 180 HD1 HIS 180 6.354 6.516 -4.808 1089 HD2 HIS 180 HD2 HIS 180 8.029 10.262 -5.462 1090 HE1 HIS 180 HE1 HIS 180 6.136 6.927 -7.280 1091 HE2 HIS 180 HE2 HIS 180 7.053 9.247 -7.632 1092 H GLU 181 H GLU 181 5.820 11.572 -3.427 1093 HA GLU 181 HA GLU 181 3.149 11.402 -3.041 1094 HB2 GLU 181 HB2 GLU 181 3.253 13.368 -4.069 1095 HB3 GLU 181 HB3 GLU 181 4.898 13.019 -4.551 1096 HG2 GLU 181 HG2 GLU 181 4.314 12.596 -6.707 1097 HG3 GLU 181 HG3 GLU 181 2.723 11.969 -6.271 1098 H ASP 182 H ASP 182 1.455 10.377 -3.772 1099 HA ASP 182 HA ASP 182 1.658 8.759 -6.185 1100 HB2 ASP 182 HB2 ASP 182 1.135 6.724 -5.108 1101 HB3 ASP 182 HB3 ASP 182 2.320 7.482 -4.034 1102 HA PRO 183 HA PRO 183 -2.386 10.711 -6.459 1103 HB2 PRO 183 HB2 PRO 183 -2.641 9.604 -9.118 1104 HB3 PRO 183 HB3 PRO 183 -2.362 11.278 -8.640 1105 HG2 PRO 183 HG2 PRO 183 -0.503 9.745 -9.923 1106 HG3 PRO 183 HG3 PRO 183 -0.093 11.093 -8.849 1107 HD2 PRO 183 HD2 PRO 183 -0.087 8.151 -8.286 1108 HD3 PRO 183 HD3 PRO 183 1.084 9.395 -7.794 1109 H ALA 184 H ALA 184 -1.756 7.340 -6.745 1110 HA ALA 184 HA ALA 184 -4.333 6.411 -7.405 1111 HB1 ALA 184 HB1 ALA 184 -1.844 5.254 -6.404 1112 HB2 ALA 184 HB2 ALA 184 -2.987 4.637 -7.597 1113 HB3 ALA 184 HB3 ALA 184 -3.295 4.402 -5.875 1114 H CYS 185 H CYS 185 -2.845 7.204 -4.314 1115 HA CYS 185 HA CYS 185 -5.226 6.421 -2.842 1116 HB2 CYS 185 HB2 CYS 185 -2.451 7.246 -2.098 1117 HB3 CYS 185 HB3 CYS 185 -3.734 7.291 -0.886 1118 H ASP 186 H ASP 186 -5.965 8.447 -4.533 1119 HA ASP 186 HA ASP 186 -6.163 10.735 -2.688 1120 HB2 ASP 186 HB2 ASP 186 -5.461 10.778 -5.612 1121 HB3 ASP 186 HB3 ASP 186 -6.008 12.214 -4.750 1122 HA PRO 187 HA PRO 187 -10.339 10.109 -4.834 1123 HB2 PRO 187 HB2 PRO 187 -11.369 8.119 -3.024 1124 HB3 PRO 187 HB3 PRO 187 -11.061 7.924 -4.752 1125 HG2 PRO 187 HG2 PRO 187 -9.657 6.627 -2.774 1126 HG3 PRO 187 HG3 PRO 187 -9.009 6.966 -4.389 1127 HD2 PRO 187 HD2 PRO 187 -8.581 8.471 -1.823 1128 HD3 PRO 187 HD3 PRO 187 -7.398 8.026 -3.078 1129 H GLU 188 H GLU 188 -9.508 11.820 -3.255 1130 HA GLU 188 HA GLU 188 -11.601 13.125 -1.934 1131 HB2 GLU 188 HB2 GLU 188 -11.166 12.773 0.367 1132 HB3 GLU 188 HB3 GLU 188 -11.094 11.172 -0.353 1133 HG2 GLU 188 HG2 GLU 188 -8.792 11.020 -0.124 1134 HG3 GLU 188 HG3 GLU 188 -8.598 12.765 0.043 1135 H ALA 189 H ALA 189 -8.486 12.473 -2.260 1136 HA ALA 189 HA ALA 189 -7.098 14.995 -1.829 1137 HB1 ALA 189 HB1 ALA 189 -6.167 12.417 -3.045 1138 HB2 ALA 189 HB2 ALA 189 -5.623 13.203 -1.562 1139 HB3 ALA 189 HB3 ALA 189 -5.188 13.881 -3.132 1140 H ALA 190 H ALA 190 -9.436 14.548 -3.669 1141 HA ALA 190 HA ALA 190 -8.607 15.403 -6.310 1142 HB1 ALA 190 HB1 ALA 190 -10.795 13.953 -5.264 1143 HB2 ALA 190 HB2 ALA 190 -10.478 14.381 -6.945 1144 HB3 ALA 190 HB3 ALA 190 -11.439 15.455 -5.929 1145 H PHE 191 H PHE 191 -8.898 17.318 -7.131 1146 HA PHE 191 HA PHE 191 -9.534 19.584 -5.406 1147 HB2 PHE 191 HB2 PHE 191 -7.421 19.291 -6.932 1148 HB3 PHE 191 HB3 PHE 191 -8.506 19.808 -8.217 1149 HD1 PHE 191 HD1 PHE 191 -9.676 22.038 -7.970 1150 HD2 PHE 191 HD2 PHE 191 -6.417 20.837 -5.513 1151 HE1 PHE 191 HE1 PHE 191 -9.270 24.389 -7.364 1152 HE2 PHE 191 HE2 PHE 191 -6.005 23.183 -4.902 1153 HZ PHE 191 HZ PHE 191 -7.434 24.963 -5.828 1154 H SER 192 H SER 192 -11.572 20.317 -5.451 1155 HA SER 192 HA SER 192 -13.637 20.944 -6.172 1156 HB2 SER 192 HB2 SER 192 -12.020 22.288 -7.717 1157 HB3 SER 192 HB3 SER 192 -12.579 21.184 -8.973 1158 HG SER 192 HG SER 192 -13.938 23.209 -7.645 Start of MODEL 5 1 H1 ALA 1 H1 ALA 1 9.570 37.897 -2.574 2 H2 ALA 1 H2 ALA 1 9.874 36.723 -1.360 3 H3 ALA 1 H3 ALA 1 10.998 36.950 -2.637 4 HA ALA 1 HA ALA 1 11.136 39.319 -1.810 5 HB1 ALA 1 HB1 ALA 1 9.128 38.907 -0.304 6 HB2 ALA 1 HB2 ALA 1 10.504 39.737 0.423 7 HB3 ALA 1 HB3 ALA 1 10.230 38.028 0.752 8 H VAL 2 H VAL 2 11.607 37.069 0.818 9 HA VAL 2 HA VAL 2 14.464 37.316 0.742 10 HB VAL 2 HB VAL 2 13.251 37.345 2.877 11 HG11 VAL 2 HG11 VAL 2 12.757 34.404 2.476 12 HG12 VAL 2 HG12 VAL 2 11.533 35.649 2.236 13 HG13 VAL 2 HG13 VAL 2 12.248 35.411 3.829 14 HG21 VAL 2 HG21 VAL 2 14.813 36.009 4.093 15 HG22 VAL 2 HG22 VAL 2 15.633 36.661 2.675 16 HG23 VAL 2 HG23 VAL 2 15.103 34.979 2.690 17 H LEU 3 H LEU 3 14.574 36.554 -1.147 18 HA LEU 3 HA LEU 3 14.582 33.636 -1.624 19 HB2 LEU 3 HB2 LEU 3 14.487 33.887 -3.941 20 HB3 LEU 3 HB3 LEU 3 13.323 34.986 -3.249 21 HG LEU 3 HG LEU 3 14.125 36.365 -4.817 22 HD11 LEU 3 HD11 LEU 3 16.187 36.646 -2.658 23 HD12 LEU 3 HD12 LEU 3 14.752 37.620 -2.954 24 HD13 LEU 3 HD13 LEU 3 16.117 37.712 -4.060 25 HD21 LEU 3 HD21 LEU 3 15.468 35.266 -6.211 26 HD22 LEU 3 HD22 LEU 3 16.321 34.440 -4.907 27 HD23 LEU 3 HD23 LEU 3 16.771 36.087 -5.351 28 H ASP 4 H ASP 4 16.350 33.252 -0.394 29 HA ASP 4 HA ASP 4 19.002 33.863 -1.430 30 HB2 ASP 4 HB2 ASP 4 18.040 33.516 1.175 31 HB3 ASP 4 HB3 ASP 4 18.941 32.043 0.834 32 H LEU 5 H LEU 5 17.973 32.743 -3.251 33 HA LEU 5 HA LEU 5 19.057 30.208 -3.636 34 HB2 LEU 5 HB2 LEU 5 16.629 30.139 -2.773 35 HB3 LEU 5 HB3 LEU 5 16.247 30.646 -4.386 36 HG LEU 5 HG LEU 5 16.285 28.093 -3.640 37 HD11 LEU 5 HD11 LEU 5 15.684 29.096 -5.852 38 HD12 LEU 5 HD12 LEU 5 16.360 27.468 -5.886 39 HD13 LEU 5 HD13 LEU 5 17.364 28.838 -6.325 40 HD21 LEU 5 HD21 LEU 5 18.308 27.300 -3.191 41 HD22 LEU 5 HD22 LEU 5 19.108 28.729 -3.829 42 HD23 LEU 5 HD23 LEU 5 18.637 27.430 -4.916 43 H ASP 6 H ASP 6 17.139 30.439 -5.987 44 HA ASP 6 HA ASP 6 18.134 32.691 -7.470 45 HB2 ASP 6 HB2 ASP 6 19.820 30.798 -7.243 46 HB3 ASP 6 HB3 ASP 6 18.803 29.905 -8.386 47 H VAL 7 H VAL 7 15.689 31.410 -6.528 48 HA VAL 7 HA VAL 7 14.062 31.609 -8.867 49 HB VAL 7 HB VAL 7 14.609 29.088 -8.601 50 HG11 VAL 7 HG11 VAL 7 14.377 28.295 -6.535 51 HG12 VAL 7 HG12 VAL 7 12.652 28.288 -6.871 52 HG13 VAL 7 HG13 VAL 7 13.379 29.641 -6.011 53 HG21 VAL 7 HG21 VAL 7 12.667 30.203 -9.830 54 HG22 VAL 7 HG22 VAL 7 11.679 29.731 -8.448 55 HG23 VAL 7 HG23 VAL 7 12.496 28.501 -9.409 56 H ARG 8 H ARG 8 11.641 31.467 -7.793 57 HA ARG 8 HA ARG 8 11.842 33.449 -5.804 58 HB2 ARG 8 HB2 ARG 8 9.231 32.931 -5.685 59 HB3 ARG 8 HB3 ARG 8 9.928 33.888 -6.983 60 HG2 ARG 8 HG2 ARG 8 9.890 32.020 -8.472 61 HG3 ARG 8 HG3 ARG 8 9.399 30.933 -7.169 62 HD2 ARG 8 HD2 ARG 8 7.502 31.556 -8.586 63 HD3 ARG 8 HD3 ARG 8 7.299 32.142 -6.935 64 HE ARG 8 HE ARG 8 7.403 34.301 -7.716 65 HH11 ARG 8 HH11 ARG 8 8.466 32.122 -10.226 66 HH12 ARG 8 HH12 ARG 8 8.449 33.337 -11.460 67 HH21 ARG 8 HH21 ARG 8 7.381 35.899 -9.337 68 HH22 ARG 8 HH22 ARG 8 7.833 35.481 -10.956 69 H THR 9 H THR 9 12.180 33.099 -3.767 70 HA THR 9 HA THR 9 12.567 30.560 -2.828 71 HB THR 9 HB THR 9 13.469 32.354 -1.568 72 HG1 THR 9 HG1 THR 9 11.664 31.937 0.372 73 HG21 THR 9 HG21 THR 9 11.352 33.834 -2.250 74 HG22 THR 9 HG22 THR 9 12.408 34.241 -0.911 75 HG23 THR 9 HG23 THR 9 10.887 33.414 -0.607 76 H CYS 10 H CYS 10 11.285 29.093 -2.875 77 HA CYS 10 HA CYS 10 8.758 28.693 -3.163 78 HB2 CYS 10 HB2 CYS 10 8.836 26.750 -1.569 79 HB3 CYS 10 HB3 CYS 10 10.155 26.828 -2.731 80 H LEU 11 H LEU 11 6.983 29.739 -2.477 81 HA LEU 11 HA LEU 11 6.397 31.358 -0.466 82 HB2 LEU 11 HB2 LEU 11 4.719 29.222 -1.691 83 HB3 LEU 11 HB3 LEU 11 4.066 30.198 -0.392 84 HG LEU 11 HG LEU 11 5.160 31.311 -2.975 85 HD11 LEU 11 HD11 LEU 11 2.655 30.057 -2.409 86 HD12 LEU 11 HD12 LEU 11 3.233 30.765 -3.917 87 HD13 LEU 11 HD13 LEU 11 2.396 31.771 -2.735 88 HD21 LEU 11 HD21 LEU 11 5.030 33.309 -2.018 89 HD22 LEU 11 HD22 LEU 11 4.635 32.533 -0.487 90 HD23 LEU 11 HD23 LEU 11 3.346 33.025 -1.583 91 HA PRO 12 HA PRO 12 6.578 29.266 3.418 92 HB2 PRO 12 HB2 PRO 12 5.452 31.056 4.976 93 HB3 PRO 12 HB3 PRO 12 6.879 31.488 4.032 94 HG2 PRO 12 HG2 PRO 12 3.993 32.080 3.481 95 HG3 PRO 12 HG3 PRO 12 5.398 33.152 3.339 96 HD2 PRO 12 HD2 PRO 12 4.238 31.749 1.242 97 HD3 PRO 12 HD3 PRO 12 5.891 32.397 1.244 98 H CYS 13 H CYS 13 5.421 27.466 3.868 99 HA CYS 13 HA CYS 13 2.567 27.497 4.178 100 HB2 CYS 13 HB2 CYS 13 2.863 24.987 3.949 101 HB3 CYS 13 HB3 CYS 13 3.384 25.931 2.579 102 H GLY 14 H GLY 14 2.513 25.033 5.752 103 HA2 GLY 14 HA2 GLY 14 2.691 24.269 7.911 104 HA3 GLY 14 HA3 GLY 14 3.801 25.592 8.261 105 HA PRO 15 HA PRO 15 -0.403 26.490 10.143 106 HB2 PRO 15 HB2 PRO 15 0.512 27.473 12.462 107 HB3 PRO 15 HB3 PRO 15 0.455 25.711 12.202 108 HG2 PRO 15 HG2 PRO 15 2.661 27.565 11.416 109 HG3 PRO 15 HG3 PRO 15 2.791 26.337 12.732 110 HD2 PRO 15 HD2 PRO 15 3.590 25.570 10.406 111 HD3 PRO 15 HD3 PRO 15 2.238 24.596 11.065 112 H GLY 16 H GLY 16 -0.398 28.046 8.508 113 HA2 GLY 16 HA2 GLY 16 -0.930 30.223 8.029 114 HA3 GLY 16 HA3 GLY 16 -0.080 30.653 9.478 115 H GLY 17 H GLY 17 1.736 28.673 7.309 116 HA2 GLY 17 HA2 GLY 17 3.200 29.242 5.755 117 HA3 GLY 17 HA3 GLY 17 2.599 30.840 5.913 118 H LYS 18 H LYS 18 3.945 28.913 8.479 119 HA LYS 18 HA LYS 18 6.133 30.809 8.887 120 HB2 LYS 18 HB2 LYS 18 5.607 28.475 10.679 121 HB3 LYS 18 HB3 LYS 18 6.236 30.068 11.075 122 HG2 LYS 18 HG2 LYS 18 3.581 30.322 10.038 123 HG3 LYS 18 HG3 LYS 18 3.603 29.143 11.337 124 HD2 LYS 18 HD2 LYS 18 5.082 31.675 11.768 125 HD3 LYS 18 HD3 LYS 18 3.321 31.762 11.760 126 HE2 LYS 18 HE2 LYS 18 3.121 30.614 13.699 127 HE3 LYS 18 HE3 LYS 18 4.515 29.589 13.363 128 HZ1 LYS 18 HZ1 LYS 18 5.145 32.372 13.823 129 HZ2 LYS 18 HZ2 LYS 18 5.890 30.980 14.428 130 HZ3 LYS 18 HZ3 LYS 18 4.489 31.575 15.165 131 H GLY 19 H GLY 19 5.518 27.901 7.424 132 HA2 GLY 19 HA2 GLY 19 8.244 26.783 7.484 133 HA3 GLY 19 HA3 GLY 19 6.793 25.929 6.969 134 H ARG 20 H ARG 20 8.571 25.575 4.726 135 HA ARG 20 HA ARG 20 7.795 27.769 3.079 136 HB2 ARG 20 HB2 ARG 20 10.460 26.380 3.374 137 HB3 ARG 20 HB3 ARG 20 9.973 27.089 1.851 138 HG2 ARG 20 HG2 ARG 20 11.036 28.887 2.616 139 HG3 ARG 20 HG3 ARG 20 9.537 29.166 3.490 140 HD2 ARG 20 HD2 ARG 20 11.947 29.147 4.658 141 HD3 ARG 20 HD3 ARG 20 10.462 28.715 5.490 142 HE ARG 20 HE ARG 20 11.392 26.679 5.826 143 HH11 ARG 20 HH11 ARG 20 12.626 27.836 2.775 144 HH12 ARG 20 HH12 ARG 20 13.734 26.526 2.588 145 HH21 ARG 20 HH21 ARG 20 12.862 24.958 5.577 146 HH22 ARG 20 HH22 ARG 20 13.867 24.896 4.169 147 H CYS 21 H CYS 21 7.866 26.705 0.703 148 HA CYS 21 HA CYS 21 6.834 23.960 1.015 149 HB2 CYS 21 HB2 CYS 21 6.225 26.143 -0.939 150 HB3 CYS 21 HB3 CYS 21 5.849 24.473 -1.327 151 H PHE 22 H PHE 22 7.061 22.480 -0.788 152 HA PHE 22 HA PHE 22 9.387 22.880 -2.517 153 HB2 PHE 22 HB2 PHE 22 9.088 20.612 -0.532 154 HB3 PHE 22 HB3 PHE 22 10.187 20.547 -1.909 155 HD1 PHE 22 HD1 PHE 22 9.410 22.384 1.203 156 HD2 PHE 22 HD2 PHE 22 12.278 21.601 -1.847 157 HE1 PHE 22 HE1 PHE 22 11.122 23.595 2.492 158 HE2 PHE 22 HE2 PHE 22 13.991 22.800 -0.552 159 HZ PHE 22 HZ PHE 22 13.412 23.800 1.619 160 H GLY 23 H GLY 23 6.996 20.431 -1.496 161 HA2 GLY 23 HA2 GLY 23 6.390 19.982 -4.356 162 HA3 GLY 23 HA3 GLY 23 6.390 18.688 -3.165 163 HA PRO 24 HA PRO 24 2.052 20.581 -3.870 164 HB2 PRO 24 HB2 PRO 24 1.450 17.680 -4.026 165 HB3 PRO 24 HB3 PRO 24 0.825 19.012 -4.996 166 HG2 PRO 24 HG2 PRO 24 2.639 17.319 -5.989 167 HG3 PRO 24 HG3 PRO 24 2.670 19.045 -6.389 168 HD2 PRO 24 HD2 PRO 24 4.411 17.498 -4.524 169 HD3 PRO 24 HD3 PRO 24 4.817 18.872 -5.574 170 H SER 25 H SER 25 2.291 17.347 -2.351 171 HA SER 25 HA SER 25 0.951 18.443 0.016 172 HB2 SER 25 HB2 SER 25 1.057 15.812 -1.273 173 HB3 SER 25 HB3 SER 25 1.300 15.714 0.473 174 HG SER 25 HG SER 25 -0.975 15.931 -0.762 175 H ILE 26 H ILE 26 3.902 18.688 -0.816 176 HA ILE 26 HA ILE 26 4.984 17.663 1.699 177 HB ILE 26 HB ILE 26 6.641 18.004 -0.761 178 HG12 ILE 26 HG12 ILE 26 5.814 15.282 -0.197 179 HG13 ILE 26 HG13 ILE 26 4.481 16.300 -0.699 180 HG21 ILE 26 HG21 ILE 26 8.187 17.571 0.751 181 HG22 ILE 26 HG22 ILE 26 7.622 15.908 0.608 182 HG23 ILE 26 HG23 ILE 26 7.004 16.941 1.893 183 HD11 ILE 26 HD11 ILE 26 5.696 16.864 -2.737 184 HD12 ILE 26 HD12 ILE 26 5.511 15.118 -2.567 185 HD13 ILE 26 HD13 ILE 26 7.058 15.881 -2.199 186 H CYS 27 H CYS 27 5.144 19.298 3.010 187 HA CYS 27 HA CYS 27 6.386 21.825 2.121 188 HB2 CYS 27 HB2 CYS 27 4.202 22.448 2.643 189 HB3 CYS 27 HB3 CYS 27 4.047 21.220 3.872 190 H CYS 28 H CYS 28 8.318 22.236 3.124 191 HA CYS 28 HA CYS 28 8.698 21.135 5.800 192 HB2 CYS 28 HB2 CYS 28 11.180 21.013 4.345 193 HB3 CYS 28 HB3 CYS 28 10.351 19.724 5.191 194 H GLY 29 H GLY 29 9.208 22.979 7.270 195 HA2 GLY 29 HA2 GLY 29 10.995 24.915 6.061 196 HA3 GLY 29 HA3 GLY 29 9.902 25.186 7.403 197 H ASP 30 H ASP 30 11.779 25.895 8.533 198 HA ASP 30 HA ASP 30 13.966 24.249 9.048 199 HB2 ASP 30 HB2 ASP 30 13.853 26.755 9.330 200 HB3 ASP 30 HB3 ASP 30 13.057 26.436 10.868 201 H GLU 31 H GLU 31 11.500 25.103 11.463 202 HA GLU 31 HA GLU 31 12.134 22.606 12.775 203 HB2 GLU 31 HB2 GLU 31 10.506 24.434 14.304 204 HB3 GLU 31 HB3 GLU 31 12.082 23.761 14.702 205 HG2 GLU 31 HG2 GLU 31 12.929 25.577 13.022 206 HG3 GLU 31 HG3 GLU 31 11.377 26.331 13.369 207 H LEU 32 H LEU 32 10.263 23.325 10.569 208 HA LEU 32 HA LEU 32 7.785 22.276 11.609 209 HB2 LEU 32 HB2 LEU 32 8.509 24.519 10.012 210 HB3 LEU 32 HB3 LEU 32 7.674 23.385 8.992 211 HG LEU 32 HG LEU 32 6.537 24.268 11.620 212 HD11 LEU 32 HD11 LEU 32 7.136 26.207 10.119 213 HD12 LEU 32 HD12 LEU 32 5.451 26.095 10.629 214 HD13 LEU 32 HD13 LEU 32 5.914 25.594 9.002 215 HD21 LEU 32 HD21 LEU 32 5.678 22.543 9.479 216 HD22 LEU 32 HD22 LEU 32 4.534 23.866 9.711 217 HD23 LEU 32 HD23 LEU 32 4.952 22.815 11.064 218 H GLY 33 H GLY 33 10.644 21.791 9.930 219 HA2 GLY 33 HA2 GLY 33 11.426 20.165 8.607 220 HA3 GLY 33 HA3 GLY 33 10.283 19.206 9.469 221 H CYS 34 H CYS 34 9.364 17.910 7.836 222 HA CYS 34 HA CYS 34 8.132 19.450 5.670 223 HB2 CYS 34 HB2 CYS 34 10.188 17.898 5.117 224 HB3 CYS 34 HB3 CYS 34 8.971 16.664 5.135 225 H PHE 35 H PHE 35 5.952 19.318 5.939 226 HA PHE 35 HA PHE 35 4.843 16.925 7.079 227 HB2 PHE 35 HB2 PHE 35 3.683 19.541 6.065 228 HB3 PHE 35 HB3 PHE 35 2.702 18.205 6.638 229 HD1 PHE 35 HD1 PHE 35 5.785 18.532 8.416 230 HD2 PHE 35 HD2 PHE 35 1.793 19.986 8.190 231 HE1 PHE 35 HE1 PHE 35 5.953 19.341 10.725 232 HE2 PHE 35 HE2 PHE 35 1.959 20.795 10.503 233 HZ PHE 35 HZ PHE 35 4.038 20.476 11.773 234 H VAL 36 H VAL 36 4.974 15.305 5.578 235 HA VAL 36 HA VAL 36 4.503 16.064 2.812 236 HB VAL 36 HB VAL 36 5.358 13.299 3.613 237 HG11 VAL 36 HG11 VAL 36 4.696 13.720 1.303 238 HG12 VAL 36 HG12 VAL 36 6.419 13.357 1.417 239 HG13 VAL 36 HG13 VAL 36 5.884 15.034 1.201 240 HG21 VAL 36 HG21 VAL 36 6.864 14.943 4.758 241 HG22 VAL 36 HG22 VAL 36 7.257 15.622 3.185 242 HG23 VAL 36 HG23 VAL 36 7.712 13.961 3.561 243 H GLY 37 H GLY 37 2.470 16.499 3.017 244 HA2 GLY 37 HA2 GLY 37 0.367 15.496 2.175 245 HA3 GLY 37 HA3 GLY 37 0.679 14.115 3.207 246 H THR 38 H THR 38 -0.554 17.349 3.037 247 HA THR 38 HA THR 38 -2.422 17.012 5.045 248 HB THR 38 HB THR 38 -1.008 17.068 6.844 249 HG1 THR 38 HG1 THR 38 -0.849 19.378 7.525 250 HG21 THR 38 HG21 THR 38 1.139 17.270 6.313 251 HG22 THR 38 HG22 THR 38 0.900 18.968 6.725 252 HG23 THR 38 HG23 THR 38 0.826 18.450 5.040 253 H ALA 39 H ALA 39 -3.421 19.182 5.718 254 HA ALA 39 HA ALA 39 -3.832 20.670 3.343 255 HB1 ALA 39 HB1 ALA 39 -4.699 21.388 6.136 256 HB2 ALA 39 HB2 ALA 39 -5.588 20.344 5.027 257 HB3 ALA 39 HB3 ALA 39 -5.346 22.045 4.632 258 H GLU 40 H GLU 40 -1.905 21.292 6.270 259 HA GLU 40 HA GLU 40 -1.324 23.931 5.933 260 HB2 GLU 40 HB2 GLU 40 0.070 21.622 7.146 261 HB3 GLU 40 HB3 GLU 40 1.072 23.026 6.812 262 HG2 GLU 40 HG2 GLU 40 0.410 23.564 8.902 263 HG3 GLU 40 HG3 GLU 40 -0.935 24.275 8.010 264 H ALA 41 H ALA 41 -0.223 21.301 3.943 265 HA ALA 41 HA ALA 41 1.817 22.942 2.699 266 HB1 ALA 41 HB1 ALA 41 1.136 20.020 2.413 267 HB2 ALA 41 HB2 ALA 41 2.519 20.714 3.247 268 HB3 ALA 41 HB3 ALA 41 2.398 20.838 1.493 269 H LEU 42 H LEU 42 -1.401 21.706 2.128 270 HA LEU 42 HA LEU 42 -1.704 21.456 -0.456 271 HB2 LEU 42 HB2 LEU 42 -3.400 22.622 1.612 272 HB3 LEU 42 HB3 LEU 42 -3.826 23.161 0.000 273 HG LEU 42 HG LEU 42 -3.509 20.231 0.535 274 HD11 LEU 42 HD11 LEU 42 -5.021 21.318 2.281 275 HD12 LEU 42 HD12 LEU 42 -5.699 19.994 1.337 276 HD13 LEU 42 HD13 LEU 42 -6.115 21.663 0.946 277 HD21 LEU 42 HD21 LEU 42 -5.311 21.807 -1.298 278 HD22 LEU 42 HD22 LEU 42 -5.134 20.053 -1.250 279 HD23 LEU 42 HD23 LEU 42 -3.782 21.061 -1.764 280 H ARG 43 H ARG 43 -1.412 24.737 0.917 281 HA ARG 43 HA ARG 43 -1.701 26.117 -1.499 282 HB2 ARG 43 HB2 ARG 43 -0.391 27.917 -0.466 283 HB3 ARG 43 HB3 ARG 43 -1.565 27.270 0.671 284 HG2 ARG 43 HG2 ARG 43 1.192 26.163 0.702 285 HG3 ARG 43 HG3 ARG 43 0.918 27.768 1.378 286 HD2 ARG 43 HD2 ARG 43 -0.452 25.210 2.202 287 HD3 ARG 43 HD3 ARG 43 0.768 26.083 3.113 288 HE ARG 43 HE ARG 43 -2.034 26.695 2.944 289 HH11 ARG 43 HH11 ARG 43 1.125 28.045 3.494 290 HH12 ARG 43 HH12 ARG 43 0.558 29.280 4.564 291 HH21 ARG 43 HH21 ARG 43 -2.796 28.327 4.355 292 HH22 ARG 43 HH22 ARG 43 -1.668 29.443 5.049 293 H CYS 44 H CYS 44 0.819 24.152 -0.251 294 HA CYS 44 HA CYS 44 2.982 25.013 -1.813 295 HB2 CYS 44 HB2 CYS 44 2.354 22.192 -0.943 296 HB3 CYS 44 HB3 CYS 44 3.862 22.672 -1.697 297 H GLN 45 H GLN 45 0.123 23.418 -2.816 298 HA GLN 45 HA GLN 45 0.657 21.969 -5.000 299 HB2 GLN 45 HB2 GLN 45 -1.595 22.793 -4.076 300 HB3 GLN 45 HB3 GLN 45 -1.390 24.163 -5.160 301 HG2 GLN 45 HG2 GLN 45 -1.355 22.707 -7.075 302 HG3 GLN 45 HG3 GLN 45 -1.404 21.284 -6.033 303 HE21 GLN 45 HE21 GLN 45 -3.319 20.796 -4.922 304 HE22 GLN 45 HE22 GLN 45 -4.843 21.435 -5.425 305 H GLU 46 H GLU 46 0.716 25.561 -4.987 306 HA GLU 46 HA GLU 46 1.553 25.528 -7.785 307 HB2 GLU 46 HB2 GLU 46 0.001 27.265 -6.686 308 HB3 GLU 46 HB3 GLU 46 1.468 27.955 -6.006 309 HG2 GLU 46 HG2 GLU 46 1.447 29.203 -7.860 310 HG3 GLU 46 HG3 GLU 46 2.175 27.778 -8.601 311 H GLU 47 H GLU 47 3.058 25.199 -4.844 312 HA GLU 47 HA GLU 47 5.507 26.537 -5.603 313 HB2 GLU 47 HB2 GLU 47 4.608 25.010 -3.178 314 HB3 GLU 47 HB3 GLU 47 6.314 25.366 -3.434 315 HG2 GLU 47 HG2 GLU 47 5.553 27.119 -2.097 316 HG3 GLU 47 HG3 GLU 47 5.589 27.793 -3.719 317 H ASN 48 H ASN 48 4.036 23.949 -6.731 318 HA ASN 48 HA ASN 48 6.073 21.955 -6.614 319 HB2 ASN 48 HB2 ASN 48 4.722 20.712 -8.117 320 HB3 ASN 48 HB3 ASN 48 3.586 21.584 -7.093 321 HD21 ASN 48 HD21 ASN 48 4.179 20.688 -10.159 322 HD22 ASN 48 HD22 ASN 48 3.333 21.932 -11.011 323 H TYR 49 H TYR 49 5.408 24.763 -8.541 324 HA TYR 49 HA TYR 49 6.669 24.233 -10.927 325 HB2 TYR 49 HB2 TYR 49 5.407 26.315 -10.211 326 HB3 TYR 49 HB3 TYR 49 6.924 26.886 -9.524 327 HD1 TYR 49 HD1 TYR 49 5.667 25.436 -12.738 328 HD2 TYR 49 HD2 TYR 49 8.204 28.278 -10.843 329 HE1 TYR 49 HE1 TYR 49 6.335 26.302 -14.941 330 HE2 TYR 49 HE2 TYR 49 8.878 29.152 -13.041 331 HH TYR 49 HH TYR 49 8.977 28.225 -15.439 332 H LEU 50 H LEU 50 8.355 23.626 -8.211 333 HA LEU 50 HA LEU 50 10.868 24.271 -9.559 334 HB2 LEU 50 HB2 LEU 50 11.852 24.545 -7.169 335 HB3 LEU 50 HB3 LEU 50 11.066 25.892 -7.959 336 HG LEU 50 HG LEU 50 10.558 25.602 -5.522 337 HD11 LEU 50 HD11 LEU 50 9.103 27.024 -6.593 338 HD12 LEU 50 HD12 LEU 50 8.015 25.822 -5.911 339 HD13 LEU 50 HD13 LEU 50 8.437 25.758 -7.616 340 HD21 LEU 50 HD21 LEU 50 10.409 23.129 -5.584 341 HD22 LEU 50 HD22 LEU 50 8.880 23.282 -6.447 342 HD23 LEU 50 HD23 LEU 50 9.031 23.908 -4.807 343 HA PRO 51 HA PRO 51 11.500 19.965 -8.699 344 HB2 PRO 51 HB2 PRO 51 13.776 19.629 -10.042 345 HB3 PRO 51 HB3 PRO 51 12.263 19.991 -10.882 346 HG2 PRO 51 HG2 PRO 51 14.553 21.790 -10.243 347 HG3 PRO 51 HG3 PRO 51 13.537 21.737 -11.694 348 HD2 PRO 51 HD2 PRO 51 13.243 23.520 -9.567 349 HD3 PRO 51 HD3 PRO 51 12.012 23.162 -10.792 350 H SER 52 H SER 52 12.956 22.343 -7.042 351 HA SER 52 HA SER 52 13.940 20.972 -4.947 352 HB2 SER 52 HB2 SER 52 16.534 21.168 -5.571 353 HB3 SER 52 HB3 SER 52 15.599 19.715 -5.915 354 HG SER 52 HG SER 52 16.916 21.153 -7.632 355 HA PRO 53 HA PRO 53 16.495 25.182 -5.306 356 HB2 PRO 53 HB2 PRO 53 15.432 26.769 -7.334 357 HB3 PRO 53 HB3 PRO 53 16.952 25.877 -7.408 358 HG2 PRO 53 HG2 PRO 53 14.259 25.134 -8.452 359 HG3 PRO 53 HG3 PRO 53 15.858 24.889 -9.182 360 HD2 PRO 53 HD2 PRO 53 14.567 22.880 -8.020 361 HD3 PRO 53 HD3 PRO 53 16.323 23.053 -7.840 362 H CYS 54 H CYS 54 15.787 26.291 -3.649 363 HA CYS 54 HA CYS 54 13.804 28.217 -3.740 364 HB2 CYS 54 HB2 CYS 54 11.865 27.269 -3.139 365 HB3 CYS 54 HB3 CYS 54 12.614 25.737 -3.541 366 H GLN 55 H GLN 55 14.943 29.622 -2.566 367 HA GLN 55 HA GLN 55 16.503 30.340 -1.067 368 HB2 GLN 55 HB2 GLN 55 15.560 30.732 1.092 369 HB3 GLN 55 HB3 GLN 55 14.337 30.938 -0.143 370 HG2 GLN 55 HG2 GLN 55 13.324 28.852 0.420 371 HG3 GLN 55 HG3 GLN 55 14.639 28.465 1.533 372 HE21 GLN 55 HE21 GLN 55 14.712 29.434 3.531 373 HE22 GLN 55 HE22 GLN 55 13.410 30.367 4.177 374 H SER 56 H SER 56 16.824 29.471 1.717 375 HA SER 56 HA SER 56 18.873 27.533 1.230 376 HB2 SER 56 HB2 SER 56 18.882 29.562 2.858 377 HB3 SER 56 HB3 SER 56 18.074 28.457 3.969 378 HG SER 56 HG SER 56 20.477 27.771 2.645 379 H GLY 57 H GLY 57 18.280 25.471 0.952 380 HA2 GLY 57 HA2 GLY 57 17.625 23.742 2.935 381 HA3 GLY 57 HA3 GLY 57 16.061 24.248 2.287 382 H GLN 58 H GLN 58 19.033 23.937 0.464 383 HA GLN 58 HA GLN 58 17.937 21.676 -0.991 384 HB2 GLN 58 HB2 GLN 58 18.035 24.068 -2.126 385 HB3 GLN 58 HB3 GLN 58 19.724 23.639 -2.360 386 HG2 GLN 58 HG2 GLN 58 17.924 21.498 -3.129 387 HG3 GLN 58 HG3 GLN 58 17.615 22.992 -4.014 388 HE21 GLN 58 HE21 GLN 58 19.614 24.063 -4.889 389 HE22 GLN 58 HE22 GLN 58 20.807 23.033 -5.596 390 H LYS 59 H LYS 59 19.115 20.316 0.246 391 HA LYS 59 HA LYS 59 22.030 20.245 -0.267 392 HB2 LYS 59 HB2 LYS 59 20.946 20.830 2.214 393 HB3 LYS 59 HB3 LYS 59 21.100 19.085 2.299 394 HG2 LYS 59 HG2 LYS 59 23.475 19.250 1.844 395 HG3 LYS 59 HG3 LYS 59 23.337 21.003 1.693 396 HD2 LYS 59 HD2 LYS 59 23.636 21.203 3.892 397 HD3 LYS 59 HD3 LYS 59 22.164 20.270 4.170 398 HE2 LYS 59 HE2 LYS 59 24.608 18.744 3.485 399 HE3 LYS 59 HE3 LYS 59 24.572 19.515 5.070 400 HZ1 LYS 59 HZ1 LYS 59 23.169 17.988 5.821 401 HZ2 LYS 59 HZ2 LYS 59 23.438 17.112 4.400 402 HZ3 LYS 59 HZ3 LYS 59 22.123 18.170 4.502 403 HA PRO 60 HA PRO 60 19.726 16.636 -1.905 404 HB2 PRO 60 HB2 PRO 60 21.773 16.139 -3.730 405 HB3 PRO 60 HB3 PRO 60 20.319 17.088 -4.046 406 HG2 PRO 60 HG2 PRO 60 23.059 18.008 -3.290 407 HG3 PRO 60 HG3 PRO 60 21.910 18.720 -4.441 408 HD2 PRO 60 HD2 PRO 60 22.258 19.781 -2.020 409 HD3 PRO 60 HD3 PRO 60 20.644 19.703 -2.755 410 H CYS 61 H CYS 61 19.808 15.115 -0.480 411 HA CYS 61 HA CYS 61 22.164 13.397 -0.372 412 HB2 CYS 61 HB2 CYS 61 22.491 13.553 1.889 413 HB3 CYS 61 HB3 CYS 61 21.841 15.165 1.630 414 H GLY 62 H GLY 62 21.548 11.085 -0.045 415 HA2 GLY 62 HA2 GLY 62 20.046 9.367 0.340 416 HA3 GLY 62 HA3 GLY 62 18.753 10.549 0.555 417 H SER 63 H SER 63 17.666 9.017 -1.089 418 HA SER 63 HA SER 63 18.781 8.871 -3.669 419 HB2 SER 63 HB2 SER 63 16.722 7.611 -2.374 420 HB3 SER 63 HB3 SER 63 15.865 8.585 -3.567 421 HG SER 63 HG SER 63 16.915 6.311 -4.032 422 H GLY 64 H GLY 64 19.245 11.303 -3.696 423 HA2 GLY 64 HA2 GLY 64 18.958 13.130 -5.092 424 HA3 GLY 64 HA3 GLY 64 17.429 12.450 -5.616 425 H GLY 65 H GLY 65 17.665 12.645 -2.334 426 HA2 GLY 65 HA2 GLY 65 15.782 14.905 -2.363 427 HA3 GLY 65 HA3 GLY 65 15.967 13.790 -1.032 428 H ARG 66 H ARG 66 16.250 16.880 -1.846 429 HA ARG 66 HA ARG 66 18.741 17.420 -0.511 430 HB2 ARG 66 HB2 ARG 66 17.958 19.879 -0.899 431 HB3 ARG 66 HB3 ARG 66 18.544 18.928 -2.248 432 HG2 ARG 66 HG2 ARG 66 15.631 18.912 -1.684 433 HG3 ARG 66 HG3 ARG 66 16.342 20.363 -2.388 434 HD2 ARG 66 HD2 ARG 66 16.351 17.571 -3.510 435 HD3 ARG 66 HD3 ARG 66 15.587 19.003 -4.185 436 HE ARG 66 HE ARG 66 18.164 19.721 -4.170 437 HH11 ARG 66 HH11 ARG 66 16.599 16.792 -5.250 438 HH12 ARG 66 HH12 ARG 66 17.763 16.478 -6.493 439 HH21 ARG 66 HH21 ARG 66 19.696 19.308 -5.816 440 HH22 ARG 66 HH22 ARG 66 19.517 17.905 -6.815 441 H CYS 67 H CYS 67 18.912 18.802 1.428 442 HA CYS 67 HA CYS 67 17.071 17.997 3.353 443 HB2 CYS 67 HB2 CYS 67 19.641 19.169 3.342 444 HB3 CYS 67 HB3 CYS 67 18.595 20.301 4.187 445 H ALA 68 H ALA 68 15.110 18.684 3.252 446 HA ALA 68 HA ALA 68 14.607 21.440 2.477 447 HB1 ALA 68 HB1 ALA 68 12.244 20.797 2.527 448 HB2 ALA 68 HB2 ALA 68 12.683 19.200 3.132 449 HB3 ALA 68 HB3 ALA 68 13.169 19.695 1.510 450 H ALA 69 H ALA 69 14.923 19.301 5.291 451 HA ALA 69 HA ALA 69 14.689 21.470 7.052 452 HB1 ALA 69 HB1 ALA 69 12.512 19.425 7.267 453 HB2 ALA 69 HB2 ALA 69 12.281 20.953 6.419 454 HB3 ALA 69 HB3 ALA 69 12.690 20.946 8.137 455 H ALA 70 H ALA 70 14.970 20.605 9.308 456 HA ALA 70 HA ALA 70 17.058 19.015 9.764 457 HB1 ALA 70 HB1 ALA 70 14.763 18.756 11.633 458 HB2 ALA 70 HB2 ALA 70 15.591 20.300 11.412 459 HB3 ALA 70 HB3 ALA 70 16.484 18.888 11.971 460 H GLY 71 H GLY 71 17.674 16.986 9.589 461 HA2 GLY 71 HA2 GLY 71 17.745 14.722 9.400 462 HA3 GLY 71 HA3 GLY 71 16.296 14.736 10.379 463 H ILE 72 H ILE 72 15.304 16.393 7.802 464 HA ILE 72 HA ILE 72 14.432 13.917 6.394 465 HB ILE 72 HB ILE 72 12.366 15.035 5.909 466 HG12 ILE 72 HG12 ILE 72 12.277 17.122 7.757 467 HG13 ILE 72 HG13 ILE 72 13.806 17.325 6.901 468 HG21 ILE 72 HG21 ILE 72 11.472 14.306 7.823 469 HG22 ILE 72 HG22 ILE 72 12.470 15.372 8.813 470 HG23 ILE 72 HG23 ILE 72 13.128 13.849 8.220 471 HD11 ILE 72 HD11 ILE 72 11.468 16.681 5.292 472 HD12 ILE 72 HD12 ILE 72 12.819 17.768 4.943 473 HD13 ILE 72 HD13 ILE 72 11.512 18.296 6.010 474 H CYS 73 H CYS 73 15.620 13.772 4.644 475 HA CYS 73 HA CYS 73 16.291 16.110 3.029 476 HB2 CYS 73 HB2 CYS 73 17.462 13.537 3.530 477 HB3 CYS 73 HB3 CYS 73 17.106 13.649 1.816 478 H CYS 74 H CYS 74 14.598 16.748 1.734 479 HA CYS 74 HA CYS 74 13.312 14.613 0.185 480 HB2 CYS 74 HB2 CYS 74 11.536 16.858 0.580 481 HB3 CYS 74 HB3 CYS 74 11.256 15.150 0.847 482 H SER 75 H SER 75 11.997 15.441 -1.594 483 HA SER 75 HA SER 75 13.183 17.731 -3.010 484 HB2 SER 75 HB2 SER 75 12.763 14.891 -3.969 485 HB3 SER 75 HB3 SER 75 12.805 16.225 -5.111 486 HG SER 75 HG SER 75 14.852 15.006 -4.446 487 HA PRO 76 HA PRO 76 8.927 18.624 -3.838 488 HB2 PRO 76 HB2 PRO 76 8.625 19.097 -6.477 489 HB3 PRO 76 HB3 PRO 76 9.504 20.192 -5.406 490 HG2 PRO 76 HG2 PRO 76 10.550 18.170 -7.327 491 HG3 PRO 76 HG3 PRO 76 11.170 19.779 -6.932 492 HD2 PRO 76 HD2 PRO 76 12.208 17.438 -5.948 493 HD3 PRO 76 HD3 PRO 76 12.371 19.013 -5.154 494 H ASP 77 H ASP 77 9.693 15.759 -4.021 495 HA ASP 77 HA ASP 77 7.237 14.805 -5.283 496 HB2 ASP 77 HB2 ASP 77 10.024 13.976 -5.939 497 HB3 ASP 77 HB3 ASP 77 8.799 12.712 -5.865 498 H GLY 78 H GLY 78 10.077 13.702 -3.389 499 HA2 GLY 78 HA2 GLY 78 8.204 12.650 -1.403 500 HA3 GLY 78 HA3 GLY 78 9.418 11.590 -2.032 501 H CYS 79 H CYS 79 9.647 11.626 0.469 502 HA CYS 79 HA CYS 79 11.956 13.319 1.036 503 HB2 CYS 79 HB2 CYS 79 9.855 14.391 1.986 504 HB3 CYS 79 HB3 CYS 79 9.743 13.001 3.063 505 H HIS 80 H HIS 80 13.247 12.493 2.951 506 HA HIS 80 HA HIS 80 12.603 9.721 3.675 507 HB2 HIS 80 HB2 HIS 80 14.205 10.198 1.494 508 HB3 HIS 80 HB3 HIS 80 15.389 10.037 2.784 509 HD1 HIS 80 HD1 HIS 80 16.135 7.723 3.189 510 HD2 HIS 80 HD2 HIS 80 12.355 7.849 1.477 511 HE1 HIS 80 HE1 HIS 80 15.488 5.323 2.812 512 HE2 HIS 80 HE2 HIS 80 13.245 5.430 1.672 513 H GLU 81 H GLU 81 13.281 9.198 5.688 514 HA GLU 81 HA GLU 81 14.396 11.179 7.380 515 HB2 GLU 81 HB2 GLU 81 13.398 8.486 7.647 516 HB3 GLU 81 HB3 GLU 81 14.908 8.646 8.521 517 HG2 GLU 81 HG2 GLU 81 12.974 10.817 8.939 518 HG3 GLU 81 HG3 GLU 81 12.500 9.233 9.556 519 H ASP 82 H ASP 82 16.436 11.832 7.411 520 HA ASP 82 HA ASP 82 18.552 9.890 7.165 521 HB2 ASP 82 HB2 ASP 82 18.329 10.222 4.868 522 HB3 ASP 82 HB3 ASP 82 17.922 11.930 5.034 523 HA PRO 83 HA PRO 83 20.332 12.771 10.079 524 HB2 PRO 83 HB2 PRO 83 22.945 11.623 9.482 525 HB3 PRO 83 HB3 PRO 83 21.999 11.546 10.968 526 HG2 PRO 83 HG2 PRO 83 22.395 9.387 9.390 527 HG3 PRO 83 HG3 PRO 83 20.913 9.620 10.335 528 HD2 PRO 83 HD2 PRO 83 21.397 10.094 7.417 529 HD3 PRO 83 HD3 PRO 83 19.985 9.381 8.227 530 H ALA 84 H ALA 84 20.028 13.780 7.476 531 HA ALA 84 HA ALA 84 22.443 14.950 6.507 532 HB1 ALA 84 HB1 ALA 84 20.270 14.476 5.226 533 HB2 ALA 84 HB2 ALA 84 21.055 16.026 4.934 534 HB3 ALA 84 HB3 ALA 84 19.655 15.926 6.008 535 H CYS 85 H CYS 85 19.508 16.148 7.905 536 HA CYS 85 HA CYS 85 20.872 18.504 8.947 537 HB2 CYS 85 HB2 CYS 85 18.057 17.910 8.079 538 HB3 CYS 85 HB3 CYS 85 18.387 19.291 9.104 539 H ASP 86 H ASP 86 21.728 17.263 10.716 540 HA ASP 86 HA ASP 86 19.789 16.229 12.618 541 HB2 ASP 86 HB2 ASP 86 22.655 16.036 13.273 542 HB3 ASP 86 HB3 ASP 86 21.385 14.820 13.354 543 HA PRO 87 HA PRO 87 20.515 20.290 14.604 544 HB2 PRO 87 HB2 PRO 87 17.850 19.679 15.717 545 HB3 PRO 87 HB3 PRO 87 18.379 21.107 14.818 546 HG2 PRO 87 HG2 PRO 87 16.734 19.321 13.703 547 HG3 PRO 87 HG3 PRO 87 18.014 20.111 12.753 548 HD2 PRO 87 HD2 PRO 87 18.013 17.370 13.978 549 HD3 PRO 87 HD3 PRO 87 18.517 17.872 12.347 550 H GLU 88 H GLU 88 22.066 18.963 15.601 551 HA GLU 88 HA GLU 88 21.823 18.881 18.254 552 HB2 GLU 88 HB2 GLU 88 21.795 16.611 18.916 553 HB3 GLU 88 HB3 GLU 88 20.411 16.969 17.899 554 HG2 GLU 88 HG2 GLU 88 21.295 15.805 16.080 555 HG3 GLU 88 HG3 GLU 88 22.889 15.694 16.834 556 H ALA 89 H ALA 89 23.796 17.758 15.436 557 HA ALA 89 HA ALA 89 25.990 17.204 16.710 558 HB1 ALA 89 HB1 ALA 89 24.910 17.653 14.079 559 HB2 ALA 89 HB2 ALA 89 26.327 16.692 14.563 560 HB3 ALA 89 HB3 ALA 89 26.521 18.401 14.183 561 H ALA 90 H ALA 90 26.074 19.242 18.470 562 HA ALA 90 HA ALA 90 26.888 21.721 17.363 563 HB1 ALA 90 HB1 ALA 90 26.000 20.942 19.787 564 HB2 ALA 90 HB2 ALA 90 26.853 22.460 19.503 565 HB3 ALA 90 HB3 ALA 90 27.731 21.056 20.112 566 H PHE 91 H PHE 91 29.156 22.632 18.375 567 HA PHE 91 HA PHE 91 31.178 20.837 17.242 568 HB2 PHE 91 HB2 PHE 91 31.383 23.700 18.205 569 HB3 PHE 91 HB3 PHE 91 32.716 22.779 17.518 570 HD1 PHE 91 HD1 PHE 91 32.174 21.693 15.163 571 HD2 PHE 91 HD2 PHE 91 30.193 25.073 16.822 572 HE1 PHE 91 HE1 PHE 91 31.482 22.389 12.906 573 HE2 PHE 91 HE2 PHE 91 29.496 25.776 14.570 574 HZ PHE 91 HZ PHE 91 30.141 24.434 12.608 575 H SER 92 H SER 92 30.545 19.461 19.275 576 HA SER 92 HA SER 92 31.930 20.321 21.688 577 HB2 SER 92 HB2 SER 92 31.036 18.119 22.595 578 HB3 SER 92 HB3 SER 92 29.823 19.306 22.118 579 HG SER 92 HG SER 92 29.132 17.975 20.652 580 H1 ALA 101 H1 ALA 101 -3.205 0.401 21.503 581 H2 ALA 101 H2 ALA 101 -2.913 -0.955 20.493 582 H3 ALA 101 H3 ALA 101 -2.796 -1.111 22.198 583 HA ALA 101 HA ALA 101 -4.803 -2.001 21.859 584 HB1 ALA 101 HB1 ALA 101 -5.292 0.961 22.138 585 HB2 ALA 101 HB2 ALA 101 -5.059 -0.207 23.439 586 HB3 ALA 101 HB3 ALA 101 -6.504 -0.287 22.430 587 H VAL 102 H VAL 102 -6.864 -2.108 20.713 588 HA VAL 102 HA VAL 102 -7.884 -2.506 18.722 589 HB VAL 102 HB VAL 102 -8.699 -0.303 19.510 590 HG11 VAL 102 HG11 VAL 102 -6.987 0.850 17.323 591 HG12 VAL 102 HG12 VAL 102 -6.629 0.972 19.043 592 HG13 VAL 102 HG13 VAL 102 -8.088 1.714 18.394 593 HG21 VAL 102 HG21 VAL 102 -8.768 -0.616 16.521 594 HG22 VAL 102 HG22 VAL 102 -9.993 0.115 17.556 595 HG23 VAL 102 HG23 VAL 102 -9.685 -1.619 17.644 596 H LEU 103 H LEU 103 -5.523 -3.202 18.429 597 HA LEU 103 HA LEU 103 -4.073 -2.255 16.053 598 HB2 LEU 103 HB2 LEU 103 -3.205 -4.810 16.116 599 HB3 LEU 103 HB3 LEU 103 -2.508 -3.517 17.053 600 HG LEU 103 HG LEU 103 -2.809 -5.640 18.283 601 HD11 LEU 103 HD11 LEU 103 -3.673 -2.998 19.127 602 HD12 LEU 103 HD12 LEU 103 -2.607 -4.157 19.919 603 HD13 LEU 103 HD13 LEU 103 -4.355 -4.299 20.103 604 HD21 LEU 103 HD21 LEU 103 -5.753 -5.023 18.179 605 HD22 LEU 103 HD22 LEU 103 -4.964 -6.390 18.962 606 HD23 LEU 103 HD23 LEU 103 -4.958 -6.258 17.204 607 H ASP 104 H ASP 104 -5.359 -2.028 14.424 608 HA ASP 104 HA ASP 104 -6.763 -4.325 13.310 609 HB2 ASP 104 HB2 ASP 104 -7.246 -1.369 12.971 610 HB3 ASP 104 HB3 ASP 104 -7.981 -2.588 11.930 611 H LEU 105 H LEU 105 -4.408 -4.747 12.915 612 HA LEU 105 HA LEU 105 -3.962 -4.619 10.221 613 HB2 LEU 105 HB2 LEU 105 -2.682 -2.705 10.867 614 HB3 LEU 105 HB3 LEU 105 -1.977 -3.580 12.195 615 HG LEU 105 HG LEU 105 -0.564 -3.113 10.122 616 HD11 LEU 105 HD11 LEU 105 0.062 -4.625 11.962 617 HD12 LEU 105 HD12 LEU 105 0.692 -5.114 10.384 618 HD13 LEU 105 HD13 LEU 105 -0.689 -5.945 11.063 619 HD21 LEU 105 HD21 LEU 105 -1.122 -5.495 8.739 620 HD22 LEU 105 HD22 LEU 105 -1.246 -3.835 8.159 621 HD23 LEU 105 HD23 LEU 105 -2.641 -4.615 8.896 622 H ASP 106 H ASP 106 -1.947 -5.329 12.733 623 HA ASP 106 HA ASP 106 -2.694 -8.003 13.359 624 HB2 ASP 106 HB2 ASP 106 -1.311 -7.676 11.030 625 HB3 ASP 106 HB3 ASP 106 0.009 -7.957 12.164 626 H VAL 107 H VAL 107 -0.051 -5.846 13.045 627 HA VAL 107 HA VAL 107 1.290 -6.407 15.436 628 HB VAL 107 HB VAL 107 2.315 -5.728 13.164 629 HG11 VAL 107 HG11 VAL 107 0.846 -3.362 13.684 630 HG12 VAL 107 HG12 VAL 107 1.887 -3.733 12.317 631 HG13 VAL 107 HG13 VAL 107 2.562 -2.960 13.747 632 HG21 VAL 107 HG21 VAL 107 4.266 -5.099 14.191 633 HG22 VAL 107 HG22 VAL 107 3.388 -5.813 15.544 634 HG23 VAL 107 HG23 VAL 107 3.448 -4.060 15.358 635 H ARG 108 H ARG 108 1.980 -4.229 16.693 636 HA ARG 108 HA ARG 108 -0.504 -3.453 17.748 637 HB2 ARG 108 HB2 ARG 108 1.083 -1.753 19.026 638 HB3 ARG 108 HB3 ARG 108 0.997 -3.449 19.472 639 HG2 ARG 108 HG2 ARG 108 3.034 -3.928 18.320 640 HG3 ARG 108 HG3 ARG 108 3.078 -2.304 17.628 641 HD2 ARG 108 HD2 ARG 108 4.615 -2.519 19.521 642 HD3 ARG 108 HD3 ARG 108 3.340 -1.348 19.847 643 HE ARG 108 HE ARG 108 2.552 -2.704 21.522 644 HH11 ARG 108 HH11 ARG 108 4.828 -4.495 19.576 645 HH12 ARG 108 HH12 ARG 108 4.924 -5.821 20.685 646 HH21 ARG 108 HH21 ARG 108 2.677 -4.449 22.983 647 HH22 ARG 108 HH22 ARG 108 3.703 -5.795 22.619 648 H THR 109 H THR 109 -1.731 -2.143 16.763 649 HA THR 109 HA THR 109 -1.124 -0.643 14.620 650 HB THR 109 HB THR 109 -3.415 -0.782 15.223 651 HG1 THR 109 HG1 THR 109 -4.024 1.394 15.177 652 HG21 THR 109 HG21 THR 109 -4.007 0.832 17.302 653 HG22 THR 109 HG22 THR 109 -2.480 0.136 17.848 654 HG23 THR 109 HG23 THR 109 -3.826 -0.918 17.423 655 H CYS 110 H CYS 110 0.419 0.527 14.367 656 HA CYS 110 HA CYS 110 2.169 1.832 15.755 657 HB2 CYS 110 HB2 CYS 110 2.237 3.639 14.009 658 HB3 CYS 110 HB3 CYS 110 2.234 1.992 13.391 659 H LEU 111 H LEU 111 2.053 2.996 17.588 660 HA LEU 111 HA LEU 111 0.170 4.331 18.879 661 HB2 LEU 111 HB2 LEU 111 3.045 5.038 18.525 662 HB3 LEU 111 HB3 LEU 111 2.012 6.077 19.484 663 HG LEU 111 HG LEU 111 2.432 3.136 20.013 664 HD11 LEU 111 HD11 LEU 111 4.465 3.904 20.653 665 HD12 LEU 111 HD12 LEU 111 3.563 4.331 22.108 666 HD13 LEU 111 HD13 LEU 111 3.894 5.557 20.883 667 HD21 LEU 111 HD21 LEU 111 1.403 3.711 22.203 668 HD22 LEU 111 HD22 LEU 111 0.301 3.878 20.837 669 HD23 LEU 111 HD23 LEU 111 1.030 5.312 21.562 670 HA PRO 112 HA PRO 112 -1.199 7.872 16.607 671 HB2 PRO 112 HB2 PRO 112 -2.539 9.159 18.488 672 HB3 PRO 112 HB3 PRO 112 -3.014 7.525 18.019 673 HG2 PRO 112 HG2 PRO 112 -1.444 8.440 20.397 674 HG3 PRO 112 HG3 PRO 112 -2.728 7.220 20.308 675 HD2 PRO 112 HD2 PRO 112 -0.002 6.680 20.293 676 HD3 PRO 112 HD3 PRO 112 -1.265 5.577 19.713 677 H CYS 113 H CYS 113 -0.060 9.573 15.860 678 HA CYS 113 HA CYS 113 1.448 11.238 17.728 679 HB2 CYS 113 HB2 CYS 113 2.865 11.776 15.681 680 HB3 CYS 113 HB3 CYS 113 2.936 10.133 16.257 681 H GLY 114 H GLY 114 1.865 13.294 15.648 682 HA2 GLY 114 HA2 GLY 114 0.849 15.094 14.678 683 HA3 GLY 114 HA3 GLY 114 -0.708 14.306 14.918 684 HA PRO 115 HA PRO 115 -0.173 17.798 17.957 685 HB2 PRO 115 HB2 PRO 115 -2.675 18.741 17.803 686 HB3 PRO 115 HB3 PRO 115 -1.472 19.147 16.554 687 HG2 PRO 115 HG2 PRO 115 -3.245 16.739 16.625 688 HG3 PRO 115 HG3 PRO 115 -3.386 18.077 15.428 689 HD2 PRO 115 HD2 PRO 115 -1.949 16.060 14.712 690 HD3 PRO 115 HD3 PRO 115 -1.073 17.621 14.726 691 H GLY 116 H GLY 116 -0.066 15.896 19.204 692 HA2 GLY 116 HA2 GLY 116 -0.626 15.275 21.441 693 HA3 GLY 116 HA3 GLY 116 -2.243 15.770 21.064 694 H GLY 117 H GLY 117 -0.812 13.709 18.680 695 HA2 GLY 117 HA2 GLY 117 -0.877 11.538 18.468 696 HA3 GLY 117 HA3 GLY 117 -1.627 11.464 20.003 697 H LYS 118 H LYS 118 -2.775 13.342 17.311 698 HA LYS 118 HA LYS 118 -5.241 11.787 17.241 699 HB2 LYS 118 HB2 LYS 118 -4.805 14.222 15.569 700 HB3 LYS 118 HB3 LYS 118 -6.284 13.623 16.311 701 HG2 LYS 118 HG2 LYS 118 -4.392 14.253 18.356 702 HG3 LYS 118 HG3 LYS 118 -4.550 15.617 17.262 703 HD2 LYS 118 HD2 LYS 118 -7.044 14.277 18.141 704 HD3 LYS 118 HD3 LYS 118 -6.174 15.232 19.342 705 HE2 LYS 118 HE2 LYS 118 -6.633 17.196 18.311 706 HE3 LYS 118 HE3 LYS 118 -6.564 16.487 16.697 707 HZ1 LYS 118 HZ1 LYS 118 -8.825 16.937 18.389 708 HZ2 LYS 118 HZ2 LYS 118 -8.757 15.337 17.846 709 HZ3 LYS 118 HZ3 LYS 118 -8.771 16.606 16.729 710 H GLY 119 H GLY 119 -2.233 11.725 15.623 711 HA2 GLY 119 HA2 GLY 119 -3.498 10.621 13.222 712 HA3 GLY 119 HA3 GLY 119 -1.926 11.425 13.222 713 H ARG 120 H ARG 120 -1.227 9.019 12.316 714 HA ARG 120 HA ARG 120 -0.698 7.429 14.714 715 HB2 ARG 120 HB2 ARG 120 -1.510 6.591 11.936 716 HB3 ARG 120 HB3 ARG 120 -0.693 5.496 13.026 717 HG2 ARG 120 HG2 ARG 120 -2.767 4.898 13.593 718 HG3 ARG 120 HG3 ARG 120 -2.686 6.319 14.623 719 HD2 ARG 120 HD2 ARG 120 -4.684 5.844 12.896 720 HD3 ARG 120 HD3 ARG 120 -4.193 7.453 13.397 721 HE ARG 120 HE ARG 120 -3.735 7.857 11.217 722 HH11 ARG 120 HH11 ARG 120 -3.115 4.465 11.748 723 HH12 ARG 120 HH12 ARG 120 -2.832 4.131 10.079 724 HH21 ARG 120 HH21 ARG 120 -3.363 7.410 9.018 725 HH22 ARG 120 HH22 ARG 120 -2.969 5.796 8.532 726 H CYS 121 H CYS 121 1.327 5.946 14.239 727 HA CYS 121 HA CYS 121 3.262 7.646 12.804 728 HB2 CYS 121 HB2 CYS 121 3.540 5.789 15.135 729 HB3 CYS 121 HB3 CYS 121 4.945 6.239 14.183 730 H PHE 122 H PHE 122 5.110 6.627 11.817 731 HA PHE 122 HA PHE 122 4.755 3.878 10.883 732 HB2 PHE 122 HB2 PHE 122 4.954 6.299 9.074 733 HB3 PHE 122 HB3 PHE 122 5.286 4.657 8.525 734 HD1 PHE 122 HD1 PHE 122 2.677 6.858 9.944 735 HD2 PHE 122 HD2 PHE 122 3.550 3.187 7.968 736 HE1 PHE 122 HE1 PHE 122 0.274 6.480 9.566 737 HE2 PHE 122 HE2 PHE 122 1.148 2.818 7.580 738 HZ PHE 122 HZ PHE 122 -0.492 4.467 8.381 739 H GLY 123 H GLY 123 6.763 6.797 10.427 740 HA2 GLY 123 HA2 GLY 123 9.141 5.107 10.908 741 HA3 GLY 123 HA3 GLY 123 9.130 6.431 9.754 742 HA PRO 124 HA PRO 124 10.767 7.717 14.062 743 HB2 PRO 124 HB2 PRO 124 12.840 8.882 12.271 744 HB3 PRO 124 HB3 PRO 124 13.023 8.069 13.828 745 HG2 PRO 124 HG2 PRO 124 13.663 6.831 11.551 746 HG3 PRO 124 HG3 PRO 124 12.904 5.956 12.894 747 HD2 PRO 124 HD2 PRO 124 11.708 6.902 10.328 748 HD3 PRO 124 HD3 PRO 124 11.369 5.428 11.257 749 H SER 125 H SER 125 11.528 9.800 11.249 750 HA SER 125 HA SER 125 10.110 11.996 12.579 751 HB2 SER 125 HB2 SER 125 12.371 11.812 10.721 752 HB3 SER 125 HB3 SER 125 11.197 13.042 10.226 753 HG SER 125 HG SER 125 13.026 13.452 11.913 754 H ILE 126 H ILE 126 8.948 9.623 11.005 755 HA ILE 126 HA ILE 126 7.380 11.249 9.146 756 HB ILE 126 HB ILE 126 7.874 8.307 8.778 757 HG12 ILE 126 HG12 ILE 126 9.477 10.133 7.132 758 HG13 ILE 126 HG13 ILE 126 9.932 10.149 8.824 759 HG21 ILE 126 HG21 ILE 126 6.201 10.029 7.542 760 HG22 ILE 126 HG22 ILE 126 6.820 8.547 6.829 761 HG23 ILE 126 HG23 ILE 126 7.598 10.087 6.479 762 HD11 ILE 126 HD11 ILE 126 9.740 7.479 8.300 763 HD12 ILE 126 HD12 ILE 126 11.229 8.423 8.246 764 HD13 ILE 126 HD13 ILE 126 10.320 8.121 6.766 765 H CYS 127 H CYS 127 5.535 11.638 10.089 766 HA CYS 127 HA CYS 127 3.997 9.440 11.325 767 HB2 CYS 127 HB2 CYS 127 4.450 10.842 13.122 768 HB3 CYS 127 HB3 CYS 127 4.472 12.274 12.125 769 H CYS 128 H CYS 128 2.123 8.996 10.273 770 HA CYS 128 HA CYS 128 0.836 11.150 8.810 771 HB2 CYS 128 HB2 CYS 128 0.553 8.758 7.266 772 HB3 CYS 128 HB3 CYS 128 1.237 10.298 6.793 773 H GLY 129 H GLY 129 -1.245 11.354 9.676 774 HA2 GLY 129 HA2 GLY 129 -2.698 8.879 10.163 775 HA3 GLY 129 HA3 GLY 129 -3.087 10.461 10.803 776 H ASP 130 H ASP 130 -5.187 10.005 9.967 777 HA ASP 130 HA ASP 130 -5.721 9.663 7.251 778 HB2 ASP 130 HB2 ASP 130 -7.258 9.069 9.145 779 HB3 ASP 130 HB3 ASP 130 -7.658 10.782 9.243 780 H GLU 131 H GLU 131 -6.168 12.553 9.163 781 HA GLU 131 HA GLU 131 -6.081 14.052 6.640 782 HB2 GLU 131 HB2 GLU 131 -7.363 15.565 8.716 783 HB3 GLU 131 HB3 GLU 131 -8.023 15.085 7.159 784 HG2 GLU 131 HG2 GLU 131 -8.452 12.817 8.355 785 HG3 GLU 131 HG3 GLU 131 -8.262 13.762 9.826 786 H LEU 132 H LEU 132 -4.219 13.196 8.656 787 HA LEU 132 HA LEU 132 -2.986 15.738 9.327 788 HB2 LEU 132 HB2 LEU 132 -3.659 13.397 10.798 789 HB3 LEU 132 HB3 LEU 132 -1.928 13.426 10.644 790 HG LEU 132 HG LEU 132 -3.472 15.789 11.664 791 HD11 LEU 132 HD11 LEU 132 -3.882 13.595 12.937 792 HD12 LEU 132 HD12 LEU 132 -3.398 15.026 13.847 793 HD13 LEU 132 HD13 LEU 132 -2.212 13.775 13.480 794 HD21 LEU 132 HD21 LEU 132 -1.377 16.587 11.333 795 HD22 LEU 132 HD22 LEU 132 -0.619 15.004 11.510 796 HD23 LEU 132 HD23 LEU 132 -1.146 15.895 12.937 797 H GLY 133 H GLY 133 -3.129 12.998 7.430 798 HA2 GLY 133 HA2 GLY 133 -1.816 12.064 5.921 799 HA3 GLY 133 HA3 GLY 133 -1.210 13.661 5.786 800 H CYS 134 H CYS 134 0.990 13.442 5.658 801 HA CYS 134 HA CYS 134 2.222 11.943 7.878 802 HB2 CYS 134 HB2 CYS 134 2.357 10.878 5.473 803 HB3 CYS 134 HB3 CYS 134 3.694 11.972 5.319 804 H PHE 135 H PHE 135 3.297 13.356 9.149 805 HA PHE 135 HA PHE 135 4.477 15.668 7.893 806 HB2 PHE 135 HB2 PHE 135 4.226 14.695 10.756 807 HB3 PHE 135 HB3 PHE 135 5.142 16.117 10.297 808 HD1 PHE 135 HD1 PHE 135 2.217 15.636 8.298 809 HD2 PHE 135 HD2 PHE 135 3.620 17.226 11.987 810 HE1 PHE 135 HE1 PHE 135 0.208 17.034 8.456 811 HE2 PHE 135 HE2 PHE 135 1.609 18.627 12.146 812 HZ PHE 135 HZ PHE 135 -0.099 18.534 10.383 813 H VAL 136 H VAL 136 6.280 14.991 6.816 814 HA VAL 136 HA VAL 136 7.848 12.894 8.081 815 HB VAL 136 HB VAL 136 8.418 13.997 5.346 816 HG11 VAL 136 HG11 VAL 136 10.076 12.540 6.352 817 HG12 VAL 136 HG12 VAL 136 9.310 11.769 4.964 818 HG13 VAL 136 HG13 VAL 136 8.842 11.311 6.594 819 HG21 VAL 136 HG21 VAL 136 6.011 13.413 5.439 820 HG22 VAL 136 HG22 VAL 136 6.437 11.787 5.964 821 HG23 VAL 136 HG23 VAL 136 6.897 12.342 4.350 822 H GLY 137 H GLY 137 8.538 14.052 9.701 823 HA2 GLY 137 HA2 GLY 137 10.736 14.927 10.419 824 HA3 GLY 137 HA3 GLY 137 10.707 15.987 9.024 825 H THR 138 H THR 138 9.614 15.493 12.275 826 HA THR 138 HA THR 138 9.511 18.177 12.919 827 HB THR 138 HB THR 138 7.602 18.734 11.790 828 HG1 THR 138 HG1 THR 138 5.936 18.828 13.257 829 HG21 THR 138 HG21 THR 138 6.684 17.078 10.640 830 HG22 THR 138 HG22 THR 138 5.596 16.942 12.024 831 HG23 THR 138 HG23 THR 138 7.004 15.884 11.899 832 H ALA 139 H ALA 139 8.328 18.515 15.145 833 HA ALA 139 HA ALA 139 9.210 16.390 16.804 834 HB1 ALA 139 HB1 ALA 139 7.638 18.868 17.491 835 HB2 ALA 139 HB2 ALA 139 9.397 18.738 17.458 836 HB3 ALA 139 HB3 ALA 139 8.467 17.813 18.636 837 H GLU 140 H GLU 140 6.176 17.159 15.344 838 HA GLU 140 HA GLU 140 4.452 15.979 17.264 839 HB2 GLU 140 HB2 GLU 140 4.241 16.864 14.456 840 HB3 GLU 140 HB3 GLU 140 3.129 15.584 14.923 841 HG2 GLU 140 HG2 GLU 140 1.850 17.368 15.463 842 HG3 GLU 140 HG3 GLU 140 2.724 17.201 16.984 843 H ALA 141 H ALA 141 6.566 14.679 14.850 844 HA ALA 141 HA ALA 141 5.384 12.052 15.035 845 HB1 ALA 141 HB1 ALA 141 7.692 12.943 13.312 846 HB2 ALA 141 HB2 ALA 141 6.006 13.050 12.833 847 HB3 ALA 141 HB3 ALA 141 6.731 11.475 13.149 848 H LEU 142 H LEU 142 8.059 13.842 16.260 849 HA LEU 142 HA LEU 142 10.075 12.151 16.626 850 HB2 LEU 142 HB2 LEU 142 8.984 14.289 18.280 851 HB3 LEU 142 HB3 LEU 142 9.912 13.124 19.204 852 HG LEU 142 HG LEU 142 11.090 14.296 16.714 853 HD11 LEU 142 HD11 LEU 142 10.716 16.337 17.630 854 HD12 LEU 142 HD12 LEU 142 12.156 15.908 18.545 855 HD13 LEU 142 HD13 LEU 142 10.561 15.701 19.267 856 HD21 LEU 142 HD21 LEU 142 12.487 12.661 17.527 857 HD22 LEU 142 HD22 LEU 142 12.060 12.978 19.209 858 HD23 LEU 142 HD23 LEU 142 13.121 14.089 18.344 859 H ARG 143 H ARG 143 7.183 11.929 18.712 860 HA ARG 143 HA ARG 143 8.073 9.789 20.289 861 HB2 ARG 143 HB2 ARG 143 5.701 9.272 20.654 862 HB3 ARG 143 HB3 ARG 143 5.976 11.004 20.742 863 HG2 ARG 143 HG2 ARG 143 5.141 9.843 18.137 864 HG3 ARG 143 HG3 ARG 143 3.940 9.984 19.420 865 HD2 ARG 143 HD2 ARG 143 5.595 12.219 18.251 866 HD3 ARG 143 HD3 ARG 143 3.882 11.937 17.990 867 HE ARG 143 HE ARG 143 5.105 13.184 20.273 868 HH11 ARG 143 HH11 ARG 143 2.331 11.391 19.176 869 HH12 ARG 143 HH12 ARG 143 1.246 12.118 20.311 870 HH21 ARG 143 HH21 ARG 143 3.680 14.149 21.778 871 HH22 ARG 143 HH22 ARG 143 2.012 13.682 21.791 872 H CYS 144 H CYS 144 7.128 10.029 17.114 873 HA CYS 144 HA CYS 144 6.437 7.340 16.474 874 HB2 CYS 144 HB2 CYS 144 7.839 9.273 14.635 875 HB3 CYS 144 HB3 CYS 144 7.264 7.690 14.140 876 H GLN 145 H GLN 145 9.521 8.713 17.163 877 HA GLN 145 HA GLN 145 11.428 7.179 16.166 878 HB2 GLN 145 HB2 GLN 145 11.540 8.877 18.093 879 HB3 GLN 145 HB3 GLN 145 11.331 7.490 19.152 880 HG2 GLN 145 HG2 GLN 145 13.357 6.491 18.327 881 HG3 GLN 145 HG3 GLN 145 13.540 7.775 17.131 882 HE21 GLN 145 HE21 GLN 145 14.120 9.854 17.827 883 HE22 GLN 145 HE22 GLN 145 14.868 10.117 19.361 884 H GLU 146 H GLU 146 9.326 5.981 18.830 885 HA GLU 146 HA GLU 146 10.673 3.397 18.686 886 HB2 GLU 146 HB2 GLU 146 9.800 4.533 20.826 887 HB3 GLU 146 HB3 GLU 146 8.207 4.003 20.304 888 HG2 GLU 146 HG2 GLU 146 8.676 2.195 21.531 889 HG3 GLU 146 HG3 GLU 146 9.577 1.690 20.103 890 H GLU 147 H GLU 147 8.214 4.894 17.038 891 HA GLU 147 HA GLU 147 6.646 2.509 16.589 892 HB2 GLU 147 HB2 GLU 147 6.459 5.356 15.652 893 HB3 GLU 147 HB3 GLU 147 5.524 4.089 14.864 894 HG2 GLU 147 HG2 GLU 147 4.076 4.961 16.471 895 HG3 GLU 147 HG3 GLU 147 4.696 3.484 17.197 896 H ASN 148 H ASN 148 9.605 3.329 15.745 897 HA ASN 148 HA ASN 148 9.608 2.923 12.924 898 HB2 ASN 148 HB2 ASN 148 11.975 2.945 13.080 899 HB3 ASN 148 HB3 ASN 148 11.425 4.075 14.312 900 HD21 ASN 148 HD21 ASN 148 13.563 1.703 13.715 901 HD22 ASN 148 HD22 ASN 148 13.834 1.123 15.319 902 H TYR 149 H TYR 149 9.569 0.910 15.750 903 HA TYR 149 HA TYR 149 10.719 -1.437 14.898 904 HB2 TYR 149 HB2 TYR 149 9.739 -0.866 17.169 905 HB3 TYR 149 HB3 TYR 149 8.185 -1.381 16.523 906 HD1 TYR 149 HD1 TYR 149 11.702 -2.648 16.716 907 HD2 TYR 149 HD2 TYR 149 7.552 -3.559 16.944 908 HE1 TYR 149 HE1 TYR 149 12.250 -4.981 17.265 909 HE2 TYR 149 HE2 TYR 149 8.089 -5.894 17.497 910 HH TYR 149 HH TYR 149 9.912 -7.473 17.253 911 H LEU 150 H LEU 150 8.466 -0.117 12.958 912 HA LEU 150 HA LEU 150 7.632 -2.763 12.030 913 HB2 LEU 150 HB2 LEU 150 5.452 -1.581 11.248 914 HB3 LEU 150 HB3 LEU 150 5.591 -2.185 12.883 915 HG LEU 150 HG LEU 150 4.488 0.048 12.649 916 HD11 LEU 150 HD11 LEU 150 5.591 -0.811 14.737 917 HD12 LEU 150 HD12 LEU 150 5.427 0.941 14.618 918 HD13 LEU 150 HD13 LEU 150 6.985 0.181 14.312 919 HD21 LEU 150 HD21 LEU 150 5.981 0.900 10.869 920 HD22 LEU 150 HD22 LEU 150 7.271 1.036 12.064 921 HD23 LEU 150 HD23 LEU 150 5.807 2.003 12.234 922 HA PRO 151 HA PRO 151 9.222 -1.053 8.256 923 HB2 PRO 151 HB2 PRO 151 9.071 -3.240 6.744 924 HB3 PRO 151 HB3 PRO 151 10.188 -3.149 8.110 925 HG2 PRO 151 HG2 PRO 151 7.556 -4.537 7.900 926 HG3 PRO 151 HG3 PRO 151 9.035 -5.053 8.728 927 HD2 PRO 151 HD2 PRO 151 6.825 -3.854 9.940 928 HD3 PRO 151 HD3 PRO 151 8.448 -3.979 10.645 929 H SER 152 H SER 152 6.053 -1.387 8.865 930 HA SER 152 HA SER 152 4.998 0.105 6.887 931 HB2 SER 152 HB2 SER 152 3.922 -1.892 5.467 932 HB3 SER 152 HB3 SER 152 5.457 -1.151 5.021 933 HG SER 152 HG SER 152 5.240 -3.590 5.245 934 HA PRO 153 HA PRO 153 1.480 -2.976 8.470 935 HB2 PRO 153 HB2 PRO 153 2.407 -4.443 10.645 936 HB3 PRO 153 HB3 PRO 153 2.168 -5.058 9.009 937 HG2 PRO 153 HG2 PRO 153 4.663 -4.106 10.338 938 HG3 PRO 153 HG3 PRO 153 4.427 -5.474 9.234 939 HD2 PRO 153 HD2 PRO 153 5.520 -3.210 8.384 940 HD3 PRO 153 HD3 PRO 153 4.389 -4.112 7.357 941 H CYS 154 H CYS 154 0.171 -1.679 9.516 942 HA CYS 154 HA CYS 154 0.174 -1.281 12.256 943 HB2 CYS 154 HB2 CYS 154 1.342 0.583 12.693 944 HB3 CYS 154 HB3 CYS 154 2.079 0.356 11.119 945 H GLN 155 H GLN 155 -1.994 -1.485 12.448 946 HA GLN 155 HA GLN 155 -4.146 -1.448 11.727 947 HB2 GLN 155 HB2 GLN 155 -5.245 0.591 12.301 948 HB3 GLN 155 HB3 GLN 155 -3.942 0.275 13.426 949 HG2 GLN 155 HG2 GLN 155 -2.575 1.950 12.414 950 HG3 GLN 155 HG3 GLN 155 -3.749 2.183 11.115 951 HE21 GLN 155 HE21 GLN 155 -5.599 3.348 11.501 952 HE22 GLN 155 HE22 GLN 155 -5.858 4.265 12.941 953 H SER 156 H SER 156 -5.580 0.774 10.453 954 HA SER 156 HA SER 156 -5.242 -0.109 7.752 955 HB2 SER 156 HB2 SER 156 -7.434 0.448 9.023 956 HB3 SER 156 HB3 SER 156 -7.087 2.112 8.556 957 HG SER 156 HG SER 156 -8.089 1.504 6.793 958 H GLY 157 H GLY 157 -3.596 0.657 6.675 959 HA2 GLY 157 HA2 GLY 157 -3.504 3.106 5.452 960 HA3 GLY 157 HA3 GLY 157 -2.556 3.322 6.924 961 H GLN 158 H GLN 158 -2.787 0.352 5.063 962 HA GLN 158 HA GLN 158 0.015 0.675 4.299 963 HB2 GLN 158 HB2 GLN 158 -0.672 -1.039 6.169 964 HB3 GLN 158 HB3 GLN 158 -1.176 -2.024 4.804 965 HG2 GLN 158 HG2 GLN 158 1.485 -0.922 4.453 966 HG3 GLN 158 HG3 GLN 158 1.343 -1.905 5.909 967 HE21 GLN 158 HE21 GLN 158 0.227 -4.038 5.570 968 HE22 GLN 158 HE22 GLN 158 0.627 -4.910 4.134 969 H LYS 159 H LYS 159 -1.059 1.565 2.406 970 HA LYS 159 HA LYS 159 -1.923 -0.478 0.490 971 HB2 LYS 159 HB2 LYS 159 -3.087 1.953 1.075 972 HB3 LYS 159 HB3 LYS 159 -2.221 2.248 -0.428 973 HG2 LYS 159 HG2 LYS 159 -3.370 0.458 -1.519 974 HG3 LYS 159 HG3 LYS 159 -4.127 -0.035 -0.001 975 HD2 LYS 159 HD2 LYS 159 -5.832 1.297 -0.510 976 HD3 LYS 159 HD3 LYS 159 -4.748 2.669 -0.279 977 HE2 LYS 159 HE2 LYS 159 -4.643 1.272 -2.890 978 HE3 LYS 159 HE3 LYS 159 -6.071 2.251 -2.553 979 HZ1 LYS 159 HZ1 LYS 159 -4.853 4.172 -2.497 980 HZ2 LYS 159 HZ2 LYS 159 -3.987 3.305 -3.662 981 HZ3 LYS 159 HZ3 LYS 159 -3.408 3.396 -2.076 982 HA PRO 160 HA PRO 160 2.495 0.567 -0.516 983 HB2 PRO 160 HB2 PRO 160 2.873 -1.783 -1.956 984 HB3 PRO 160 HB3 PRO 160 3.301 -1.526 -0.262 985 HG2 PRO 160 HG2 PRO 160 0.863 -2.800 -1.430 986 HG3 PRO 160 HG3 PRO 160 1.795 -3.267 0.005 987 HD2 PRO 160 HD2 PRO 160 -0.540 -1.985 0.237 988 HD3 PRO 160 HD3 PRO 160 0.813 -1.612 1.326 989 H CYS 161 H CYS 161 2.447 2.122 -1.935 990 HA CYS 161 HA CYS 161 2.101 1.461 -4.756 991 HB2 CYS 161 HB2 CYS 161 0.445 2.971 -5.195 992 HB3 CYS 161 HB3 CYS 161 0.013 2.613 -3.530 993 H GLY 162 H GLY 162 3.307 3.024 -6.173 994 HA2 GLY 162 HA2 GLY 162 5.052 4.535 -6.548 995 HA3 GLY 162 HA3 GLY 162 4.944 5.027 -4.857 996 H SER 163 H SER 163 7.437 4.881 -5.070 997 HA SER 163 HA SER 163 8.566 2.340 -5.528 998 HB2 SER 163 HB2 SER 163 9.557 4.888 -5.330 999 HB3 SER 163 HB3 SER 163 10.191 4.131 -3.870 1000 HG SER 163 HG SER 163 10.748 3.604 -6.538 1001 H GLY 164 H GLY 164 6.910 1.304 -3.996 1002 HA2 GLY 164 HA2 GLY 164 6.837 -0.195 -2.249 1003 HA3 GLY 164 HA3 GLY 164 8.415 0.374 -1.745 1004 H GLY 165 H GLY 165 5.915 2.779 -2.111 1005 HA2 GLY 165 HA2 GLY 165 5.884 2.990 0.802 1006 HA3 GLY 165 HA3 GLY 165 5.544 4.284 -0.329 1007 H ARG 166 H ARG 166 4.149 2.521 1.902 1008 HA ARG 166 HA ARG 166 1.714 1.948 0.483 1009 HB2 ARG 166 HB2 ARG 166 0.942 1.284 2.885 1010 HB3 ARG 166 HB3 ARG 166 2.037 0.239 1.998 1011 HG2 ARG 166 HG2 ARG 166 3.211 2.305 3.778 1012 HG3 ARG 166 HG3 ARG 166 2.462 0.888 4.513 1013 HD2 ARG 166 HD2 ARG 166 4.755 0.963 2.564 1014 HD3 ARG 166 HD3 ARG 166 4.779 0.410 4.233 1015 HE ARG 166 HE ARG 166 3.009 -1.268 3.125 1016 HH11 ARG 166 HH11 ARG 166 6.183 -0.249 2.079 1017 HH12 ARG 166 HH12 ARG 166 6.538 -1.743 1.283 1018 HH21 ARG 166 HH21 ARG 166 3.485 -3.241 2.076 1019 HH22 ARG 166 HH22 ARG 166 5.011 -3.438 1.281 1020 H CYS 167 H CYS 167 -0.398 2.894 1.143 1021 HA CYS 167 HA CYS 167 -0.176 5.643 1.415 1022 HB2 CYS 167 HB2 CYS 167 -2.188 3.808 0.656 1023 HB3 CYS 167 HB3 CYS 167 -2.823 4.672 2.048 1024 H ALA 168 H ALA 168 0.537 6.434 3.213 1025 HA ALA 168 HA ALA 168 -0.239 5.220 5.732 1026 HB1 ALA 168 HB1 ALA 168 1.390 6.560 6.743 1027 HB2 ALA 168 HB2 ALA 168 1.345 7.755 5.448 1028 HB3 ALA 168 HB3 ALA 168 2.098 6.185 5.172 1029 H ALA 169 H ALA 169 -0.716 7.988 3.662 1030 HA ALA 169 HA ALA 169 -3.258 8.639 4.969 1031 HB1 ALA 169 HB1 ALA 169 -1.087 10.698 4.826 1032 HB2 ALA 169 HB2 ALA 169 -1.330 9.680 6.247 1033 HB3 ALA 169 HB3 ALA 169 -2.618 10.756 5.696 1034 H ALA 170 H ALA 170 -4.333 10.468 3.826 1035 HA ALA 170 HA ALA 170 -4.811 10.187 1.225 1036 HB1 ALA 170 HB1 ALA 170 -4.642 12.977 2.234 1037 HB2 ALA 170 HB2 ALA 170 -5.817 11.837 2.895 1038 HB3 ALA 170 HB3 ALA 170 -5.834 12.230 1.177 1039 H GLY 171 H GLY 171 -3.868 10.383 -0.671 1040 HA2 GLY 171 HA2 GLY 171 -2.510 10.980 -2.392 1041 HA3 GLY 171 HA3 GLY 171 -2.338 12.505 -1.557 1042 H ILE 172 H ILE 172 -1.138 10.675 0.719 1043 HA ILE 172 HA ILE 172 1.607 10.775 -0.417 1044 HB ILE 172 HB ILE 172 2.359 11.189 1.818 1045 HG12 ILE 172 HG12 ILE 172 0.049 11.960 3.178 1046 HG13 ILE 172 HG13 ILE 172 -0.332 10.389 2.473 1047 HG21 ILE 172 HG21 ILE 172 2.042 13.384 1.549 1048 HG22 ILE 172 HG22 ILE 172 0.285 13.235 1.596 1049 HG23 ILE 172 HG23 ILE 172 1.157 12.912 0.100 1050 HD11 ILE 172 HD11 ILE 172 2.282 10.674 3.737 1051 HD12 ILE 172 HD12 ILE 172 1.167 9.299 3.728 1052 HD13 ILE 172 HD13 ILE 172 0.875 10.666 4.810 1053 H CYS 173 H CYS 173 2.176 8.820 -1.030 1054 HA CYS 173 HA CYS 173 1.504 6.448 0.535 1055 HB2 CYS 173 HB2 CYS 173 2.049 7.016 -2.224 1056 HB3 CYS 173 HB3 CYS 173 3.253 5.875 -1.653 1057 H CYS 174 H CYS 174 2.844 6.202 2.296 1058 HA CYS 174 HA CYS 174 5.718 6.443 1.745 1059 HB2 CYS 174 HB2 CYS 174 5.114 7.002 4.515 1060 HB3 CYS 174 HB3 CYS 174 6.069 7.922 3.369 1061 H SER 175 H SER 175 7.056 5.555 3.475 1062 HA SER 175 HA SER 175 6.024 3.063 4.647 1063 HB2 SER 175 HB2 SER 175 8.470 3.505 2.922 1064 HB3 SER 175 HB3 SER 175 8.411 2.176 4.070 1065 HG SER 175 HG SER 175 6.610 1.371 2.993 1066 HA PRO 176 HA PRO 176 8.263 4.527 8.175 1067 HB2 PRO 176 HB2 PRO 176 9.819 2.534 9.116 1068 HB3 PRO 176 HB3 PRO 176 8.056 2.497 9.217 1069 HG2 PRO 176 HG2 PRO 176 9.877 1.112 7.310 1070 HG3 PRO 176 HG3 PRO 176 8.384 0.538 8.064 1071 HD2 PRO 176 HD2 PRO 176 8.557 1.471 5.491 1072 HD3 PRO 176 HD3 PRO 176 7.070 1.468 6.452 1073 H ASP 177 H ASP 177 9.614 4.898 5.553 1074 HA ASP 177 HA ASP 177 12.242 5.625 6.600 1075 HB2 ASP 177 HB2 ASP 177 11.672 3.835 4.286 1076 HB3 ASP 177 HB3 ASP 177 12.989 4.993 4.109 1077 H GLY 178 H GLY 178 10.186 5.836 3.669 1078 HA2 GLY 178 HA2 GLY 178 10.519 8.740 3.777 1079 HA3 GLY 178 HA3 GLY 178 10.884 7.925 2.295 1080 H CYS 179 H CYS 179 9.164 9.691 1.805 1081 HA CYS 179 HA CYS 179 6.627 8.273 1.514 1082 HB2 CYS 179 HB2 CYS 179 6.516 9.823 3.527 1083 HB3 CYS 179 HB3 CYS 179 6.688 11.160 2.393 1084 H HIS 180 H HIS 180 5.213 9.279 -0.220 1085 HA HIS 180 HA HIS 180 6.678 11.096 -2.001 1086 HB2 HIS 180 HB2 HIS 180 6.944 8.383 -2.345 1087 HB3 HIS 180 HB3 HIS 180 5.602 8.754 -3.418 1088 HD1 HIS 180 HD1 HIS 180 6.276 9.404 -5.698 1089 HD2 HIS 180 HD2 HIS 180 9.268 10.175 -2.924 1090 HE1 HIS 180 HE1 HIS 180 8.225 10.265 -7.034 1091 HE2 HIS 180 HE2 HIS 180 10.060 10.617 -5.344 1092 H GLU 181 H GLU 181 5.350 12.419 -3.128 1093 HA GLU 181 HA GLU 181 2.565 12.433 -2.606 1094 HB2 GLU 181 HB2 GLU 181 4.458 14.077 -4.030 1095 HB3 GLU 181 HB3 GLU 181 3.025 13.842 -5.011 1096 HG2 GLU 181 HG2 GLU 181 2.530 14.533 -2.198 1097 HG3 GLU 181 HG3 GLU 181 3.292 15.787 -3.177 1098 H ASP 182 H ASP 182 1.104 11.098 -3.428 1099 HA ASP 182 HA ASP 182 1.262 10.362 -6.210 1100 HB2 ASP 182 HB2 ASP 182 2.640 8.630 -5.475 1101 HB3 ASP 182 HB3 ASP 182 1.772 8.424 -3.954 1102 HA PRO 183 HA PRO 183 -3.157 10.638 -5.620 1103 HB2 PRO 183 HB2 PRO 183 -3.492 9.093 -8.070 1104 HB3 PRO 183 HB3 PRO 183 -3.893 10.778 -7.742 1105 HG2 PRO 183 HG2 PRO 183 -1.869 10.063 -9.386 1106 HG3 PRO 183 HG3 PRO 183 -1.823 11.538 -8.401 1107 HD2 PRO 183 HD2 PRO 183 -0.503 8.892 -7.920 1108 HD3 PRO 183 HD3 PRO 183 0.131 10.532 -7.671 1109 H ALA 184 H ALA 184 -1.927 8.495 -4.279 1110 HA ALA 184 HA ALA 184 -3.252 6.023 -4.801 1111 HB1 ALA 184 HB1 ALA 184 -1.034 6.423 -3.572 1112 HB2 ALA 184 HB2 ALA 184 -2.146 5.253 -2.867 1113 HB3 ALA 184 HB3 ALA 184 -2.037 6.886 -2.204 1114 H CYS 185 H CYS 185 -3.280 8.338 -2.226 1115 HA CYS 185 HA CYS 185 -5.991 7.598 -1.469 1116 HB2 CYS 185 HB2 CYS 185 -3.615 8.701 -0.012 1117 HB3 CYS 185 HB3 CYS 185 -5.213 8.871 0.683 1118 H ASP 186 H ASP 186 -6.844 8.868 -3.220 1119 HA ASP 186 HA ASP 186 -6.458 11.744 -3.042 1120 HB2 ASP 186 HB2 ASP 186 -8.259 10.695 -5.124 1121 HB3 ASP 186 HB3 ASP 186 -6.952 11.866 -5.237 1122 HA PRO 187 HA PRO 187 -10.418 11.521 -0.719 1123 HB2 PRO 187 HB2 PRO 187 -9.360 14.069 0.333 1124 HB3 PRO 187 HB3 PRO 187 -9.895 12.634 1.215 1125 HG2 PRO 187 HG2 PRO 187 -7.307 13.261 1.089 1126 HG3 PRO 187 HG3 PRO 187 -7.839 11.567 0.994 1127 HD2 PRO 187 HD2 PRO 187 -7.042 13.406 -1.238 1128 HD3 PRO 187 HD3 PRO 187 -6.555 11.719 -0.944 1129 H GLU 188 H GLU 188 -11.105 11.851 -2.797 1130 HA GLU 188 HA GLU 188 -12.802 13.970 -3.268 1131 HB2 GLU 188 HB2 GLU 188 -11.730 15.363 -4.888 1132 HB3 GLU 188 HB3 GLU 188 -10.599 15.155 -3.560 1133 HG2 GLU 188 HG2 GLU 188 -9.216 13.723 -4.778 1134 HG3 GLU 188 HG3 GLU 188 -10.455 13.405 -5.987 1135 H ALA 189 H ALA 189 -12.202 11.143 -3.869 1136 HA ALA 189 HA ALA 189 -12.816 10.980 -6.740 1137 HB1 ALA 189 HB1 ALA 189 -10.851 9.512 -5.380 1138 HB2 ALA 189 HB2 ALA 189 -11.413 9.312 -7.049 1139 HB3 ALA 189 HB3 ALA 189 -12.158 8.375 -5.756 1140 H ALA 190 H ALA 190 -15.083 11.675 -5.529 1141 HA ALA 190 HA ALA 190 -16.365 9.568 -4.173 1142 HB1 ALA 190 HB1 ALA 190 -16.981 12.055 -4.245 1143 HB2 ALA 190 HB2 ALA 190 -18.294 10.878 -4.201 1144 HB3 ALA 190 HB3 ALA 190 -17.857 11.653 -5.723 1145 H PHE 191 H PHE 191 -18.650 8.777 -5.116 1146 HA PHE 191 HA PHE 191 -17.973 7.357 -7.587 1147 HB2 PHE 191 HB2 PHE 191 -20.319 7.050 -5.693 1148 HB3 PHE 191 HB3 PHE 191 -20.066 6.075 -7.137 1149 HD1 PHE 191 HD1 PHE 191 -17.669 4.944 -7.259 1150 HD2 PHE 191 HD2 PHE 191 -19.611 6.209 -3.692 1151 HE1 PHE 191 HE1 PHE 191 -16.280 3.386 -5.955 1152 HE2 PHE 191 HE2 PHE 191 -18.226 4.656 -2.381 1153 HZ PHE 191 HZ PHE 191 -16.559 3.241 -3.512 1154 H SER 192 H SER 192 -18.140 9.710 -8.513 1155 HA SER 192 HA SER 192 -20.881 10.491 -9.106 1156 HB2 SER 192 HB2 SER 192 -19.729 12.406 -10.323 1157 HB3 SER 192 HB3 SER 192 -19.470 12.331 -8.580 1158 HG SER 192 HG SER 192 -17.441 12.405 -9.129 Start of MODEL 6 1 H1 ALA 1 H1 ALA 1 18.388 42.098 -2.603 2 H2 ALA 1 H2 ALA 1 19.645 40.942 -2.424 3 H3 ALA 1 H3 ALA 1 19.158 41.893 -1.083 4 HA ALA 1 HA ALA 1 18.050 40.082 -0.569 5 HB1 ALA 1 HB1 ALA 1 16.271 41.551 -0.768 6 HB2 ALA 1 HB2 ALA 1 15.741 40.133 -1.673 7 HB3 ALA 1 HB3 ALA 1 16.339 41.554 -2.532 8 H VAL 2 H VAL 2 16.534 39.801 -3.754 9 HA VAL 2 HA VAL 2 16.320 37.987 -5.068 10 HB VAL 2 HB VAL 2 18.376 39.306 -5.810 11 HG11 VAL 2 HG11 VAL 2 20.204 37.138 -5.619 12 HG12 VAL 2 HG12 VAL 2 19.667 37.578 -4.000 13 HG13 VAL 2 HG13 VAL 2 20.382 38.797 -5.053 14 HG21 VAL 2 HG21 VAL 2 18.658 36.550 -6.847 15 HG22 VAL 2 HG22 VAL 2 18.449 38.074 -7.708 16 HG23 VAL 2 HG23 VAL 2 17.059 37.288 -6.957 17 H LEU 3 H LEU 3 17.437 35.675 -5.638 18 HA LEU 3 HA LEU 3 17.336 34.311 -3.152 19 HB2 LEU 3 HB2 LEU 3 17.403 32.955 -5.804 20 HB3 LEU 3 HB3 LEU 3 16.758 32.350 -4.289 21 HG LEU 3 HG LEU 3 14.972 34.151 -4.466 22 HD11 LEU 3 HD11 LEU 3 15.430 35.721 -5.977 23 HD12 LEU 3 HD12 LEU 3 14.680 34.585 -7.104 24 HD13 LEU 3 HD13 LEU 3 16.437 34.650 -6.958 25 HD21 LEU 3 HD21 LEU 3 15.077 31.589 -5.466 26 HD22 LEU 3 HD22 LEU 3 14.463 32.529 -6.825 27 HD23 LEU 3 HD23 LEU 3 13.622 32.568 -5.274 28 H ASP 4 H ASP 4 19.790 35.654 -4.427 29 HA ASP 4 HA ASP 4 21.663 33.717 -4.843 30 HB2 ASP 4 HB2 ASP 4 21.814 36.523 -4.060 31 HB3 ASP 4 HB3 ASP 4 23.174 35.562 -3.486 32 H LEU 5 H LEU 5 22.572 35.220 -1.840 33 HA LEU 5 HA LEU 5 21.757 32.855 -0.390 34 HB2 LEU 5 HB2 LEU 5 23.777 32.123 -1.502 35 HB3 LEU 5 HB3 LEU 5 24.658 33.481 -0.833 36 HG LEU 5 HG LEU 5 24.411 32.544 1.425 37 HD11 LEU 5 HD11 LEU 5 22.215 31.421 0.941 38 HD12 LEU 5 HD12 LEU 5 23.374 30.457 1.857 39 HD13 LEU 5 HD13 LEU 5 23.133 30.146 0.138 40 HD21 LEU 5 HD21 LEU 5 26.222 31.822 -0.293 41 HD22 LEU 5 HD22 LEU 5 25.378 30.275 -0.251 42 HD23 LEU 5 HD23 LEU 5 26.058 30.949 1.231 43 H ASP 6 H ASP 6 21.567 35.811 -0.236 44 HA ASP 6 HA ASP 6 22.877 36.527 2.255 45 HB2 ASP 6 HB2 ASP 6 21.189 37.893 0.242 46 HB3 ASP 6 HB3 ASP 6 20.942 38.440 1.898 47 H VAL 7 H VAL 7 19.657 36.134 1.128 48 HA VAL 7 HA VAL 7 19.038 34.296 3.049 49 HB VAL 7 HB VAL 7 18.755 36.047 4.661 50 HG11 VAL 7 HG11 VAL 7 17.235 37.374 2.506 51 HG12 VAL 7 HG12 VAL 7 18.329 38.054 3.707 52 HG13 VAL 7 HG13 VAL 7 16.678 37.629 4.158 53 HG21 VAL 7 HG21 VAL 7 16.647 34.279 3.865 54 HG22 VAL 7 HG22 VAL 7 15.959 35.740 4.573 55 HG23 VAL 7 HG23 VAL 7 17.119 34.779 5.489 56 H ARG 8 H ARG 8 17.838 32.997 1.602 57 HA ARG 8 HA ARG 8 16.495 34.522 -0.452 58 HB2 ARG 8 HB2 ARG 8 17.316 32.446 -1.250 59 HB3 ARG 8 HB3 ARG 8 16.616 31.570 0.106 60 HG2 ARG 8 HG2 ARG 8 15.463 31.375 -2.166 61 HG3 ARG 8 HG3 ARG 8 14.457 31.699 -0.757 62 HD2 ARG 8 HD2 ARG 8 14.942 34.212 -1.527 63 HD3 ARG 8 HD3 ARG 8 15.085 33.401 -3.078 64 HE ARG 8 HE ARG 8 12.702 34.011 -1.787 65 HH11 ARG 8 HH11 ARG 8 14.199 31.333 -3.456 66 HH12 ARG 8 HH12 ARG 8 12.698 30.542 -3.788 67 HH21 ARG 8 HH21 ARG 8 10.728 32.965 -2.228 68 HH22 ARG 8 HH22 ARG 8 10.732 31.467 -3.098 69 H THR 9 H THR 9 14.520 35.516 0.028 70 HA THR 9 HA THR 9 13.312 34.688 2.488 71 HB THR 9 HB THR 9 11.429 35.742 0.436 72 HG1 THR 9 HG1 THR 9 13.843 36.953 0.905 73 HG21 THR 9 HG21 THR 9 11.634 37.423 2.697 74 HG22 THR 9 HG22 THR 9 11.655 35.752 3.258 75 HG23 THR 9 HG23 THR 9 10.325 36.325 2.255 76 H CYS 10 H CYS 10 12.937 32.684 2.740 77 HA CYS 10 HA CYS 10 12.076 30.923 0.673 78 HB2 CYS 10 HB2 CYS 10 13.566 30.705 2.941 79 HB3 CYS 10 HB3 CYS 10 12.095 29.865 3.391 80 H LEU 11 H LEU 11 9.887 31.086 0.029 81 HA LEU 11 HA LEU 11 7.658 31.865 1.294 82 HB2 LEU 11 HB2 LEU 11 7.919 30.636 -0.976 83 HB3 LEU 11 HB3 LEU 11 7.540 29.191 -0.057 84 HG LEU 11 HG LEU 11 5.657 31.418 0.356 85 HD11 LEU 11 HD11 LEU 11 5.519 29.972 -2.268 86 HD12 LEU 11 HD12 LEU 11 6.321 31.535 -2.105 87 HD13 LEU 11 HD13 LEU 11 4.604 31.380 -1.731 88 HD21 LEU 11 HD21 LEU 11 4.026 29.598 0.108 89 HD22 LEU 11 HD22 LEU 11 5.278 29.207 1.289 90 HD23 LEU 11 HD23 LEU 11 5.336 28.498 -0.325 91 HA PRO 12 HA PRO 12 7.543 29.104 4.900 92 HB2 PRO 12 HB2 PRO 12 6.441 30.798 6.586 93 HB3 PRO 12 HB3 PRO 12 8.068 31.092 5.971 94 HG2 PRO 12 HG2 PRO 12 5.476 32.356 5.177 95 HG3 PRO 12 HG3 PRO 12 7.072 33.102 5.372 96 HD2 PRO 12 HD2 PRO 12 5.919 32.247 2.959 97 HD3 PRO 12 HD3 PRO 12 7.626 32.662 3.214 98 H CYS 13 H CYS 13 5.961 27.439 5.112 99 HA CYS 13 HA CYS 13 3.162 28.254 5.213 100 HB2 CYS 13 HB2 CYS 13 2.681 27.221 3.267 101 HB3 CYS 13 HB3 CYS 13 4.409 27.043 2.998 102 H GLY 14 H GLY 14 1.996 25.785 5.440 103 HA2 GLY 14 HA2 GLY 14 1.677 23.985 6.845 104 HA3 GLY 14 HA3 GLY 14 3.344 24.137 7.361 105 HA PRO 15 HA PRO 15 0.694 25.540 10.912 106 HB2 PRO 15 HB2 PRO 15 2.097 24.352 12.847 107 HB3 PRO 15 HB3 PRO 15 0.974 23.373 11.870 108 HG2 PRO 15 HG2 PRO 15 3.824 23.998 11.326 109 HG3 PRO 15 HG3 PRO 15 3.174 22.357 11.660 110 HD2 PRO 15 HD2 PRO 15 3.411 23.032 9.139 111 HD3 PRO 15 HD3 PRO 15 1.789 22.484 9.644 112 H GLY 16 H GLY 16 1.333 27.311 11.988 113 HA2 GLY 16 HA2 GLY 16 2.346 29.107 12.600 114 HA3 GLY 16 HA3 GLY 16 3.791 28.120 12.673 115 H GLY 17 H GLY 17 3.268 27.613 9.504 116 HA2 GLY 17 HA2 GLY 17 3.869 28.685 7.694 117 HA3 GLY 17 HA3 GLY 17 3.511 30.132 8.591 118 H LYS 18 H LYS 18 5.503 27.935 10.090 119 HA LYS 18 HA LYS 18 7.842 29.633 9.897 120 HB2 LYS 18 HB2 LYS 18 7.872 27.172 11.551 121 HB3 LYS 18 HB3 LYS 18 8.517 28.769 11.897 122 HG2 LYS 18 HG2 LYS 18 5.775 29.155 11.847 123 HG3 LYS 18 HG3 LYS 18 5.979 27.587 12.629 124 HD2 LYS 18 HD2 LYS 18 7.909 29.492 13.614 125 HD3 LYS 18 HD3 LYS 18 6.268 30.115 13.785 126 HE2 LYS 18 HE2 LYS 18 6.623 28.952 15.770 127 HE3 LYS 18 HE3 LYS 18 5.715 27.813 14.776 128 HZ1 LYS 18 HZ1 LYS 18 8.632 27.703 14.636 129 HZ2 LYS 18 HZ2 LYS 18 7.497 26.453 14.539 130 HZ3 LYS 18 HZ3 LYS 18 7.898 27.115 16.042 131 H GLY 19 H GLY 19 6.787 26.985 8.017 132 HA2 GLY 19 HA2 GLY 19 9.533 26.065 7.666 133 HA3 GLY 19 HA3 GLY 19 8.104 25.050 7.450 134 H ARG 20 H ARG 20 9.538 25.075 5.066 135 HA ARG 20 HA ARG 20 8.213 27.212 3.584 136 HB2 ARG 20 HB2 ARG 20 10.882 25.930 3.022 137 HB3 ARG 20 HB3 ARG 20 10.114 27.196 2.069 138 HG2 ARG 20 HG2 ARG 20 11.499 28.456 3.329 139 HG3 ARG 20 HG3 ARG 20 10.094 28.456 4.378 140 HD2 ARG 20 HD2 ARG 20 11.136 27.256 5.964 141 HD3 ARG 20 HD3 ARG 20 11.937 26.217 4.789 142 HE ARG 20 HE ARG 20 13.574 28.030 4.488 143 HH11 ARG 20 HH11 ARG 20 11.647 28.028 7.415 144 HH12 ARG 20 HH12 ARG 20 12.799 28.956 8.312 145 HH21 ARG 20 HH21 ARG 20 15.073 29.250 5.679 146 HH22 ARG 20 HH22 ARG 20 14.737 29.649 7.331 147 H CYS 21 H CYS 21 8.139 26.563 1.158 148 HA CYS 21 HA CYS 21 7.021 23.827 1.020 149 HB2 CYS 21 HB2 CYS 21 6.426 26.386 -0.427 150 HB3 CYS 21 HB3 CYS 21 6.114 24.864 -1.250 151 H PHE 22 H PHE 22 7.553 22.454 -0.676 152 HA PHE 22 HA PHE 22 9.731 23.262 -2.487 153 HB2 PHE 22 HB2 PHE 22 9.703 20.826 -0.690 154 HB3 PHE 22 HB3 PHE 22 10.804 21.016 -2.052 155 HD1 PHE 22 HD1 PHE 22 9.741 22.638 1.126 156 HD2 PHE 22 HD2 PHE 22 12.809 22.136 -1.795 157 HE1 PHE 22 HE1 PHE 22 11.303 23.929 2.528 158 HE2 PHE 22 HE2 PHE 22 14.370 23.415 -0.385 159 HZ PHE 22 HZ PHE 22 13.614 24.311 1.782 160 H GLY 23 H GLY 23 7.514 20.599 -1.635 161 HA2 GLY 23 HA2 GLY 23 7.275 19.955 -4.497 162 HA3 GLY 23 HA3 GLY 23 6.817 18.896 -3.169 163 HA PRO 24 HA PRO 24 2.975 21.023 -4.665 164 HB2 PRO 24 HB2 PRO 24 1.695 18.473 -4.943 165 HB3 PRO 24 HB3 PRO 24 2.144 19.606 -6.217 166 HG2 PRO 24 HG2 PRO 24 3.291 17.111 -5.797 167 HG3 PRO 24 HG3 PRO 24 4.000 18.420 -6.755 168 HD2 PRO 24 HD2 PRO 24 4.639 17.526 -3.992 169 HD3 PRO 24 HD3 PRO 24 5.695 18.244 -5.225 170 H SER 25 H SER 25 2.731 17.889 -2.994 171 HA SER 25 HA SER 25 0.967 19.127 -0.993 172 HB2 SER 25 HB2 SER 25 0.752 16.737 -2.414 173 HB3 SER 25 HB3 SER 25 1.302 16.231 -0.814 174 HG SER 25 HG SER 25 -0.460 17.507 0.033 175 H ILE 26 H ILE 26 3.954 19.317 -1.105 176 HA ILE 26 HA ILE 26 4.472 18.147 1.521 177 HB ILE 26 HB ILE 26 6.765 18.327 -0.320 178 HG12 ILE 26 HG12 ILE 26 4.917 15.986 -0.545 179 HG13 ILE 26 HG13 ILE 26 4.819 17.347 -1.654 180 HG21 ILE 26 HG21 ILE 26 7.664 16.820 1.014 181 HG22 ILE 26 HG22 ILE 26 6.135 16.000 1.276 182 HG23 ILE 26 HG23 ILE 26 6.475 17.489 2.135 183 HD11 ILE 26 HD11 ILE 26 6.326 16.308 -2.889 184 HD12 ILE 26 HD12 ILE 26 6.685 15.147 -1.609 185 HD13 ILE 26 HD13 ILE 26 7.501 16.712 -1.638 186 H CYS 27 H CYS 27 5.030 19.561 3.003 187 HA CYS 27 HA CYS 27 6.495 22.000 2.204 188 HB2 CYS 27 HB2 CYS 27 3.975 22.172 3.062 189 HB3 CYS 27 HB3 CYS 27 4.763 22.054 4.626 190 H CYS 28 H CYS 28 8.436 21.982 3.014 191 HA CYS 28 HA CYS 28 8.952 20.758 5.614 192 HB2 CYS 28 HB2 CYS 28 11.190 20.538 3.793 193 HB3 CYS 28 HB3 CYS 28 10.399 19.292 4.730 194 H GLY 29 H GLY 29 9.667 22.465 7.053 195 HA2 GLY 29 HA2 GLY 29 11.426 24.445 5.840 196 HA3 GLY 29 HA3 GLY 29 10.487 24.622 7.299 197 H ASP 30 H ASP 30 12.417 25.350 8.236 198 HA ASP 30 HA ASP 30 14.737 23.831 8.416 199 HB2 ASP 30 HB2 ASP 30 15.503 25.412 10.085 200 HB3 ASP 30 HB3 ASP 30 14.764 26.225 8.711 201 H GLU 31 H GLU 31 12.399 24.320 10.986 202 HA GLU 31 HA GLU 31 13.490 21.916 12.239 203 HB2 GLU 31 HB2 GLU 31 12.108 23.744 14.055 204 HB3 GLU 31 HB3 GLU 31 13.634 22.894 14.255 205 HG2 GLU 31 HG2 GLU 31 14.374 24.728 12.461 206 HG3 GLU 31 HG3 GLU 31 13.075 25.605 13.262 207 H LEU 32 H LEU 32 11.241 22.596 10.413 208 HA LEU 32 HA LEU 32 9.065 21.423 11.908 209 HB2 LEU 32 HB2 LEU 32 9.416 23.643 10.140 210 HB3 LEU 32 HB3 LEU 32 8.324 22.503 9.419 211 HG LEU 32 HG LEU 32 7.923 23.435 12.243 212 HD11 LEU 32 HD11 LEU 32 8.169 25.352 10.567 213 HD12 LEU 32 HD12 LEU 32 6.732 25.330 11.589 214 HD13 LEU 32 HD13 LEU 32 6.631 24.795 9.912 215 HD21 LEU 32 HD21 LEU 32 6.670 21.484 11.136 216 HD22 LEU 32 HD22 LEU 32 5.817 22.736 10.235 217 HD23 LEU 32 HD23 LEU 32 5.727 22.702 11.997 218 H GLY 33 H GLY 33 11.316 21.193 9.363 219 HA2 GLY 33 HA2 GLY 33 11.973 19.457 8.128 220 HA3 GLY 33 HA3 GLY 33 10.855 18.494 9.014 221 H CYS 34 H CYS 34 9.561 17.409 7.581 222 HA CYS 34 HA CYS 34 8.423 19.033 5.399 223 HB2 CYS 34 HB2 CYS 34 10.453 17.555 4.780 224 HB3 CYS 34 HB3 CYS 34 9.332 16.222 4.921 225 H PHE 35 H PHE 35 6.183 18.917 5.469 226 HA PHE 35 HA PHE 35 4.954 16.529 6.530 227 HB2 PHE 35 HB2 PHE 35 3.752 19.112 5.483 228 HB3 PHE 35 HB3 PHE 35 2.927 17.859 6.391 229 HD1 PHE 35 HD1 PHE 35 6.108 19.765 6.953 230 HD2 PHE 35 HD2 PHE 35 2.292 18.620 8.428 231 HE1 PHE 35 HE1 PHE 35 6.574 20.925 9.062 232 HE2 PHE 35 HE2 PHE 35 2.752 19.785 10.530 233 HZ PHE 35 HZ PHE 35 4.883 20.922 10.859 234 H VAL 36 H VAL 36 4.931 14.975 4.927 235 HA VAL 36 HA VAL 36 4.467 15.961 2.231 236 HB VAL 36 HB VAL 36 5.056 13.076 2.808 237 HG11 VAL 36 HG11 VAL 36 4.405 13.829 0.531 238 HG12 VAL 36 HG12 VAL 36 6.019 13.122 0.591 239 HG13 VAL 36 HG13 VAL 36 5.830 14.885 0.500 240 HG21 VAL 36 HG21 VAL 36 6.705 14.844 3.913 241 HG22 VAL 36 HG22 VAL 36 7.343 14.914 2.272 242 HG23 VAL 36 HG23 VAL 36 7.314 13.384 3.135 243 H GLY 37 H GLY 37 2.383 16.531 2.527 244 HA2 GLY 37 HA2 GLY 37 0.398 15.092 1.510 245 HA3 GLY 37 HA3 GLY 37 0.503 14.296 3.066 246 H THR 38 H THR 38 0.157 15.717 5.002 247 HA THR 38 HA THR 38 -2.209 16.699 5.403 248 HB THR 38 HB THR 38 -0.892 16.973 7.256 249 HG1 THR 38 HG1 THR 38 -1.697 18.831 7.747 250 HG21 THR 38 HG21 THR 38 1.261 16.936 6.170 251 HG22 THR 38 HG22 THR 38 1.178 18.255 7.339 252 HG23 THR 38 HG23 THR 38 1.029 18.596 5.618 253 H ALA 39 H ALA 39 -3.413 18.668 5.377 254 HA ALA 39 HA ALA 39 -3.455 19.908 2.883 255 HB1 ALA 39 HB1 ALA 39 -5.193 19.728 4.914 256 HB2 ALA 39 HB2 ALA 39 -5.343 20.915 3.618 257 HB3 ALA 39 HB3 ALA 39 -4.623 21.379 5.161 258 H GLU 40 H GLU 40 -2.052 20.974 5.984 259 HA GLU 40 HA GLU 40 -1.484 23.532 5.614 260 HB2 GLU 40 HB2 GLU 40 0.281 21.347 6.686 261 HB3 GLU 40 HB3 GLU 40 0.717 23.040 6.785 262 HG2 GLU 40 HG2 GLU 40 -0.569 23.352 8.553 263 HG3 GLU 40 HG3 GLU 40 -1.962 22.654 7.730 264 H ALA 41 H ALA 41 0.029 20.972 3.736 265 HA ALA 41 HA ALA 41 1.974 22.751 2.626 266 HB1 ALA 41 HB1 ALA 41 1.385 19.833 2.415 267 HB2 ALA 41 HB2 ALA 41 2.869 20.643 2.914 268 HB3 ALA 41 HB3 ALA 41 2.407 20.621 1.213 269 H LEU 42 H LEU 42 -1.209 21.577 1.888 270 HA LEU 42 HA LEU 42 -1.374 21.463 -0.754 271 HB2 LEU 42 HB2 LEU 42 -3.217 22.547 1.274 272 HB3 LEU 42 HB3 LEU 42 -3.567 22.996 -0.382 273 HG LEU 42 HG LEU 42 -3.127 20.116 0.295 274 HD11 LEU 42 HD11 LEU 42 -4.841 20.136 1.721 275 HD12 LEU 42 HD12 LEU 42 -5.864 20.446 0.321 276 HD13 LEU 42 HD13 LEU 42 -5.280 21.790 1.299 277 HD21 LEU 42 HD21 LEU 42 -3.542 19.987 -1.887 278 HD22 LEU 42 HD22 LEU 42 -4.034 21.679 -1.966 279 HD23 LEU 42 HD23 LEU 42 -5.206 20.440 -1.518 280 H ARG 43 H ARG 43 -1.100 24.611 0.912 281 HA ARG 43 HA ARG 43 -1.396 26.219 -1.354 282 HB2 ARG 43 HB2 ARG 43 0.184 27.799 -0.205 283 HB3 ARG 43 HB3 ARG 43 -1.164 27.273 0.793 284 HG2 ARG 43 HG2 ARG 43 1.065 25.500 1.155 285 HG3 ARG 43 HG3 ARG 43 1.572 27.172 1.398 286 HD2 ARG 43 HD2 ARG 43 -0.797 25.869 2.729 287 HD3 ARG 43 HD3 ARG 43 0.786 26.083 3.472 288 HE ARG 43 HE ARG 43 0.210 28.589 2.834 289 HH11 ARG 43 HH11 ARG 43 -1.810 26.146 4.306 290 HH12 ARG 43 HH12 ARG 43 -2.751 27.290 5.201 291 HH21 ARG 43 HH21 ARG 43 -1.027 30.089 4.018 292 HH22 ARG 43 HH22 ARG 43 -2.306 29.525 5.040 293 H CYS 44 H CYS 44 1.110 24.198 -0.223 294 HA CYS 44 HA CYS 44 3.315 25.032 -1.730 295 HB2 CYS 44 HB2 CYS 44 2.576 22.196 -1.012 296 HB3 CYS 44 HB3 CYS 44 4.082 22.615 -1.799 297 H GLN 45 H GLN 45 0.431 23.554 -2.928 298 HA GLN 45 HA GLN 45 1.158 22.334 -5.253 299 HB2 GLN 45 HB2 GLN 45 -1.180 22.873 -4.161 300 HB3 GLN 45 HB3 GLN 45 -1.179 24.187 -5.329 301 HG2 GLN 45 HG2 GLN 45 -1.168 22.727 -7.149 302 HG3 GLN 45 HG3 GLN 45 -0.649 21.361 -6.165 303 HE21 GLN 45 HE21 GLN 45 -2.175 20.460 -4.667 304 HE22 GLN 45 HE22 GLN 45 -3.869 20.570 -4.990 305 H GLU 46 H GLU 46 1.043 25.856 -4.739 306 HA GLU 46 HA GLU 46 1.455 26.315 -7.576 307 HB2 GLU 46 HB2 GLU 46 1.038 28.064 -5.190 308 HB3 GLU 46 HB3 GLU 46 1.776 28.759 -6.625 309 HG2 GLU 46 HG2 GLU 46 -0.128 28.543 -7.881 310 HG3 GLU 46 HG3 GLU 46 -0.753 27.216 -6.903 311 H GLU 47 H GLU 47 3.418 25.461 -5.059 312 HA GLU 47 HA GLU 47 5.693 27.042 -5.881 313 HB2 GLU 47 HB2 GLU 47 5.192 24.992 -3.763 314 HB3 GLU 47 HB3 GLU 47 6.847 25.320 -4.261 315 HG2 GLU 47 HG2 GLU 47 5.106 27.630 -3.601 316 HG3 GLU 47 HG3 GLU 47 5.703 26.630 -2.278 317 H ASN 48 H ASN 48 4.073 24.711 -7.357 318 HA ASN 48 HA ASN 48 6.168 22.895 -8.039 319 HB2 ASN 48 HB2 ASN 48 3.335 23.261 -8.698 320 HB3 ASN 48 HB3 ASN 48 4.297 22.704 -10.065 321 HD21 ASN 48 HD21 ASN 48 4.063 22.068 -6.585 322 HD22 ASN 48 HD22 ASN 48 4.100 20.349 -6.724 323 H TYR 49 H TYR 49 4.975 25.956 -9.230 324 HA TYR 49 HA TYR 49 6.635 25.710 -11.645 325 HB2 TYR 49 HB2 TYR 49 4.218 27.110 -11.004 326 HB3 TYR 49 HB3 TYR 49 5.433 28.281 -11.512 327 HD1 TYR 49 HD1 TYR 49 6.955 26.907 -13.535 328 HD2 TYR 49 HD2 TYR 49 2.770 26.755 -12.780 329 HE1 TYR 49 HE1 TYR 49 6.561 26.277 -15.878 330 HE2 TYR 49 HE2 TYR 49 2.365 26.126 -15.123 331 HH TYR 49 HH TYR 49 4.834 26.272 -17.521 332 H LEU 50 H LEU 50 7.768 26.016 -8.890 333 HA LEU 50 HA LEU 50 9.575 28.205 -9.545 334 HB2 LEU 50 HB2 LEU 50 7.897 28.082 -7.060 335 HB3 LEU 50 HB3 LEU 50 9.425 28.942 -7.085 336 HG LEU 50 HG LEU 50 8.277 30.059 -9.240 337 HD11 LEU 50 HD11 LEU 50 6.162 28.604 -8.038 338 HD12 LEU 50 HD12 LEU 50 6.099 29.706 -9.413 339 HD13 LEU 50 HD13 LEU 50 5.855 30.322 -7.779 340 HD21 LEU 50 HD21 LEU 50 8.979 31.634 -7.793 341 HD22 LEU 50 HD22 LEU 50 8.427 30.734 -6.380 342 HD23 LEU 50 HD23 LEU 50 7.278 31.679 -7.326 343 HA PRO 51 HA PRO 51 11.874 24.705 -7.687 344 HB2 PRO 51 HB2 PRO 51 13.583 24.263 -9.687 345 HB3 PRO 51 HB3 PRO 51 11.911 23.696 -9.773 346 HG2 PRO 51 HG2 PRO 51 13.197 26.022 -11.116 347 HG3 PRO 51 HG3 PRO 51 11.919 24.948 -11.706 348 HD2 PRO 51 HD2 PRO 51 11.567 27.502 -10.581 349 HD3 PRO 51 HD3 PRO 51 10.297 26.300 -10.878 350 H SER 52 H SER 52 12.288 27.318 -6.839 351 HA SER 52 HA SER 52 14.936 28.225 -7.425 352 HB2 SER 52 HB2 SER 52 14.536 29.745 -5.443 353 HB3 SER 52 HB3 SER 52 13.343 29.872 -6.735 354 HG SER 52 HG SER 52 11.891 29.334 -5.334 355 HA PRO 53 HA PRO 53 17.261 25.891 -4.489 356 HB2 PRO 53 HB2 PRO 53 19.267 27.574 -3.872 357 HB3 PRO 53 HB3 PRO 53 19.096 26.870 -5.484 358 HG2 PRO 53 HG2 PRO 53 18.354 29.602 -4.522 359 HG3 PRO 53 HG3 PRO 53 19.114 29.117 -6.048 360 HD2 PRO 53 HD2 PRO 53 16.443 29.689 -5.766 361 HD3 PRO 53 HD3 PRO 53 17.108 28.637 -7.029 362 H CYS 54 H CYS 54 16.767 29.242 -3.389 363 HA CYS 54 HA CYS 54 16.053 30.102 -1.428 364 HB2 CYS 54 HB2 CYS 54 14.836 27.581 -1.444 365 HB3 CYS 54 HB3 CYS 54 15.545 27.757 0.158 366 H GLN 55 H GLN 55 18.104 30.897 -0.971 367 HA GLN 55 HA GLN 55 20.076 31.096 0.149 368 HB2 GLN 55 HB2 GLN 55 18.015 30.952 1.904 369 HB3 GLN 55 HB3 GLN 55 19.059 29.689 2.527 370 HG2 GLN 55 HG2 GLN 55 20.573 32.062 1.925 371 HG3 GLN 55 HG3 GLN 55 19.232 32.416 3.013 372 HE21 GLN 55 HE21 GLN 55 19.113 31.306 5.012 373 HE22 GLN 55 HE22 GLN 55 20.531 30.634 5.735 374 H SER 56 H SER 56 19.304 28.187 1.929 375 HA SER 56 HA SER 56 21.289 26.644 0.449 376 HB2 SER 56 HB2 SER 56 22.432 25.992 2.582 377 HB3 SER 56 HB3 SER 56 22.658 27.683 2.136 378 HG SER 56 HG SER 56 21.152 26.569 4.217 379 H GLY 57 H GLY 57 20.354 24.783 -0.008 380 HA2 GLY 57 HA2 GLY 57 19.421 22.913 1.822 381 HA3 GLY 57 HA3 GLY 57 18.016 23.817 1.258 382 H GLN 58 H GLN 58 20.908 23.060 -0.528 383 HA GLN 58 HA GLN 58 19.358 21.351 -2.327 384 HB2 GLN 58 HB2 GLN 58 20.195 23.722 -3.135 385 HB3 GLN 58 HB3 GLN 58 21.731 22.885 -3.310 386 HG2 GLN 58 HG2 GLN 58 20.872 22.606 -5.399 387 HG3 GLN 58 HG3 GLN 58 20.273 21.143 -4.619 388 HE21 GLN 58 HE21 GLN 58 19.131 22.250 -6.911 389 HE22 GLN 58 HE22 GLN 58 17.539 22.801 -6.524 390 H LYS 59 H LYS 59 19.981 19.647 -1.136 391 HA LYS 59 HA LYS 59 22.755 18.702 -1.573 392 HB2 LYS 59 HB2 LYS 59 21.312 19.105 0.972 393 HB3 LYS 59 HB3 LYS 59 21.878 17.454 0.784 394 HG2 LYS 59 HG2 LYS 59 23.688 18.334 1.827 395 HG3 LYS 59 HG3 LYS 59 24.133 18.710 0.161 396 HD2 LYS 59 HD2 LYS 59 24.245 20.857 0.724 397 HD3 LYS 59 HD3 LYS 59 22.507 20.831 1.022 398 HE2 LYS 59 HE2 LYS 59 23.470 21.645 3.007 399 HE3 LYS 59 HE3 LYS 59 23.067 19.961 3.336 400 HZ1 LYS 59 HZ1 LYS 59 25.544 19.667 2.477 401 HZ2 LYS 59 HZ2 LYS 59 25.176 19.962 4.101 402 HZ3 LYS 59 HZ3 LYS 59 25.677 21.233 3.104 403 HA PRO 60 HA PRO 60 19.556 15.922 -3.244 404 HB2 PRO 60 HB2 PRO 60 20.865 15.321 -5.503 405 HB3 PRO 60 HB3 PRO 60 19.891 16.785 -5.331 406 HG2 PRO 60 HG2 PRO 60 22.863 16.453 -5.102 407 HG3 PRO 60 HG3 PRO 60 21.939 17.727 -5.923 408 HD2 PRO 60 HD2 PRO 60 23.011 18.056 -3.457 409 HD3 PRO 60 HD3 PRO 60 21.513 18.858 -3.961 410 H CYS 61 H CYS 61 20.381 14.733 -1.378 411 HA CYS 61 HA CYS 61 22.245 12.574 -2.037 412 HB2 CYS 61 HB2 CYS 61 22.523 12.237 0.275 413 HB3 CYS 61 HB3 CYS 61 22.332 13.983 0.170 414 H GLY 62 H GLY 62 21.537 10.293 -1.631 415 HA2 GLY 62 HA2 GLY 62 19.946 8.628 -1.449 416 HA3 GLY 62 HA3 GLY 62 18.712 9.853 -1.177 417 H SER 63 H SER 63 17.582 8.391 -2.696 418 HA SER 63 HA SER 63 18.432 8.262 -5.407 419 HB2 SER 63 HB2 SER 63 16.285 7.155 -3.779 420 HB3 SER 63 HB3 SER 63 15.752 7.564 -5.409 421 HG SER 63 HG SER 63 18.161 6.169 -5.057 422 H GLY 64 H GLY 64 18.671 10.675 -5.427 423 HA2 GLY 64 HA2 GLY 64 18.114 12.439 -6.801 424 HA3 GLY 64 HA3 GLY 64 16.539 11.720 -7.064 425 H GLY 65 H GLY 65 17.510 12.157 -3.755 426 HA2 GLY 65 HA2 GLY 65 15.539 14.340 -3.628 427 HA3 GLY 65 HA3 GLY 65 15.984 13.291 -2.303 428 H ARG 66 H ARG 66 16.008 16.368 -2.913 429 HA ARG 66 HA ARG 66 18.724 16.800 -1.915 430 HB2 ARG 66 HB2 ARG 66 18.126 19.297 -2.414 431 HB3 ARG 66 HB3 ARG 66 18.680 18.246 -3.700 432 HG2 ARG 66 HG2 ARG 66 15.754 18.590 -3.175 433 HG3 ARG 66 HG3 ARG 66 16.651 19.807 -4.082 434 HD2 ARG 66 HD2 ARG 66 16.738 16.898 -4.809 435 HD3 ARG 66 HD3 ARG 66 15.471 17.969 -5.402 436 HE ARG 66 HE ARG 66 18.023 19.085 -5.903 437 HH11 ARG 66 HH11 ARG 66 15.843 16.592 -7.005 438 HH12 ARG 66 HH12 ARG 66 16.478 16.573 -8.617 439 HH21 ARG 66 HH21 ARG 66 18.860 19.061 -8.025 440 HH22 ARG 66 HH22 ARG 66 18.192 17.974 -9.194 441 H CYS 67 H CYS 67 18.971 18.299 -0.069 442 HA CYS 67 HA CYS 67 17.337 17.762 2.009 443 HB2 CYS 67 HB2 CYS 67 19.605 18.641 2.254 444 HB3 CYS 67 HB3 CYS 67 19.112 20.163 1.529 445 H ALA 68 H ALA 68 15.238 18.147 1.927 446 HA ALA 68 HA ALA 68 14.304 20.635 0.772 447 HB1 ALA 68 HB1 ALA 68 12.542 19.400 0.210 448 HB2 ALA 68 HB2 ALA 68 12.137 19.253 1.918 449 HB3 ALA 68 HB3 ALA 68 13.144 18.031 1.144 450 H ALA 69 H ALA 69 14.658 18.864 3.894 451 HA ALA 69 HA ALA 69 14.612 21.386 5.290 452 HB1 ALA 69 HB1 ALA 69 12.382 19.416 5.695 453 HB2 ALA 69 HB2 ALA 69 12.217 21.048 5.059 454 HB3 ALA 69 HB3 ALA 69 12.721 20.792 6.722 455 H ALA 70 H ALA 70 14.900 20.906 7.651 456 HA ALA 70 HA ALA 70 17.060 19.494 8.288 457 HB1 ALA 70 HB1 ALA 70 16.381 19.353 10.539 458 HB2 ALA 70 HB2 ALA 70 14.672 19.276 10.103 459 HB3 ALA 70 HB3 ALA 70 15.575 20.772 9.883 460 H GLY 71 H GLY 71 17.674 17.600 7.608 461 HA2 GLY 71 HA2 GLY 71 17.839 15.322 7.497 462 HA3 GLY 71 HA3 GLY 71 16.425 15.212 8.513 463 H ILE 72 H ILE 72 15.431 17.061 5.978 464 HA ILE 72 HA ILE 72 14.357 14.700 4.629 465 HB ILE 72 HB ILE 72 13.561 17.518 3.891 466 HG12 ILE 72 HG12 ILE 72 13.192 17.720 6.189 467 HG13 ILE 72 HG13 ILE 72 11.656 17.092 5.617 468 HG21 ILE 72 HG21 ILE 72 11.329 16.024 3.855 469 HG22 ILE 72 HG22 ILE 72 12.548 14.800 3.501 470 HG23 ILE 72 HG23 ILE 72 12.412 16.232 2.484 471 HD11 ILE 72 HD11 ILE 72 13.663 15.130 6.330 472 HD12 ILE 72 HD12 ILE 72 11.936 15.102 6.587 473 HD13 ILE 72 HD13 ILE 72 12.973 16.033 7.671 474 H CYS 73 H CYS 73 15.249 13.990 2.907 475 HA CYS 73 HA CYS 73 16.752 15.786 1.139 476 HB2 CYS 73 HB2 CYS 73 17.844 13.815 2.524 477 HB3 CYS 73 HB3 CYS 73 17.204 12.838 1.231 478 H CYS 74 H CYS 74 15.009 16.206 -0.353 479 HA CYS 74 HA CYS 74 14.326 13.875 -1.910 480 HB2 CYS 74 HB2 CYS 74 11.932 14.111 -1.584 481 HB3 CYS 74 HB3 CYS 74 12.821 13.678 -0.138 482 H SER 75 H SER 75 12.289 14.435 -3.296 483 HA SER 75 HA SER 75 12.777 16.936 -4.773 484 HB2 SER 75 HB2 SER 75 13.227 14.231 -5.622 485 HB3 SER 75 HB3 SER 75 11.888 14.891 -6.556 486 HG SER 75 HG SER 75 13.336 16.748 -6.916 487 HA PRO 76 HA PRO 76 8.390 17.390 -4.935 488 HB2 PRO 76 HB2 PRO 76 7.631 17.654 -7.515 489 HB3 PRO 76 HB3 PRO 76 8.577 18.884 -6.668 490 HG2 PRO 76 HG2 PRO 76 9.500 16.758 -8.563 491 HG3 PRO 76 HG3 PRO 76 9.978 18.464 -8.476 492 HD2 PRO 76 HD2 PRO 76 11.482 16.454 -7.449 493 HD3 PRO 76 HD3 PRO 76 11.464 18.087 -6.759 494 H ASP 77 H ASP 77 9.330 14.540 -5.095 495 HA ASP 77 HA ASP 77 6.817 13.368 -6.094 496 HB2 ASP 77 HB2 ASP 77 9.644 12.363 -6.394 497 HB3 ASP 77 HB3 ASP 77 8.276 11.255 -6.452 498 H GLY 78 H GLY 78 9.660 12.553 -4.092 499 HA2 GLY 78 HA2 GLY 78 7.847 11.892 -1.898 500 HA3 GLY 78 HA3 GLY 78 9.034 10.709 -2.375 501 H CYS 79 H CYS 79 9.713 11.024 -0.037 502 HA CYS 79 HA CYS 79 11.859 12.943 -0.033 503 HB2 CYS 79 HB2 CYS 79 9.640 13.041 1.972 504 HB3 CYS 79 HB3 CYS 79 11.238 13.687 2.335 505 H HIS 80 H HIS 80 13.467 12.635 1.821 506 HA HIS 80 HA HIS 80 13.241 10.011 3.076 507 HB2 HIS 80 HB2 HIS 80 14.154 9.246 1.038 508 HB3 HIS 80 HB3 HIS 80 15.182 10.661 0.862 509 HD1 HIS 80 HD1 HIS 80 14.897 7.730 3.276 510 HD2 HIS 80 HD2 HIS 80 17.756 10.124 1.442 511 HE1 HIS 80 HE1 HIS 80 17.119 6.796 3.997 512 HE2 HIS 80 HE2 HIS 80 18.834 8.214 2.812 513 H GLU 81 H GLU 81 14.705 9.678 4.756 514 HA GLU 81 HA GLU 81 15.454 11.963 6.193 515 HB2 GLU 81 HB2 GLU 81 15.791 9.053 6.468 516 HB3 GLU 81 HB3 GLU 81 17.038 10.007 7.257 517 HG2 GLU 81 HG2 GLU 81 15.594 9.940 8.972 518 HG3 GLU 81 HG3 GLU 81 14.872 11.310 8.130 519 H ASP 82 H ASP 82 17.337 13.046 6.435 520 HA ASP 82 HA ASP 82 19.651 12.112 4.857 521 HB2 ASP 82 HB2 ASP 82 19.737 13.981 3.556 522 HB3 ASP 82 HB3 ASP 82 17.997 13.981 3.881 523 HA PRO 83 HA PRO 83 21.794 13.234 8.579 524 HB2 PRO 83 HB2 PRO 83 24.325 12.691 7.359 525 HB3 PRO 83 HB3 PRO 83 23.372 11.663 8.427 526 HG2 PRO 83 HG2 PRO 83 23.836 11.122 5.768 527 HG3 PRO 83 HG3 PRO 83 22.465 10.490 6.696 528 HD2 PRO 83 HD2 PRO 83 22.568 12.825 4.819 529 HD3 PRO 83 HD3 PRO 83 21.317 11.575 4.999 530 H ALA 84 H ALA 84 22.940 14.758 5.549 531 HA ALA 84 HA ALA 84 24.749 16.540 6.768 532 HB1 ALA 84 HB1 ALA 84 24.767 16.291 4.368 533 HB2 ALA 84 HB2 ALA 84 24.418 17.974 4.766 534 HB3 ALA 84 HB3 ALA 84 23.115 16.900 4.258 535 H CYS 85 H CYS 85 21.361 16.793 5.974 536 HA CYS 85 HA CYS 85 21.036 19.153 7.693 537 HB2 CYS 85 HB2 CYS 85 19.109 17.778 5.805 538 HB3 CYS 85 HB3 CYS 85 18.717 19.188 6.774 539 H ASP 86 H ASP 86 21.650 17.581 9.494 540 HA ASP 86 HA ASP 86 19.502 15.633 9.984 541 HB2 ASP 86 HB2 ASP 86 22.197 15.448 10.423 542 HB3 ASP 86 HB3 ASP 86 21.600 15.866 12.027 543 HA PRO 87 HA PRO 87 18.932 18.385 13.668 544 HB2 PRO 87 HB2 PRO 87 21.028 19.815 14.602 545 HB3 PRO 87 HB3 PRO 87 20.891 18.070 14.835 546 HG2 PRO 87 HG2 PRO 87 22.798 19.537 13.211 547 HG3 PRO 87 HG3 PRO 87 22.769 17.807 13.592 548 HD2 PRO 87 HD2 PRO 87 21.751 19.227 11.209 549 HD3 PRO 87 HD3 PRO 87 22.206 17.521 11.393 550 H GLU 88 H GLU 88 18.536 20.456 14.471 551 HA GLU 88 HA GLU 88 17.943 22.494 12.644 552 HB2 GLU 88 HB2 GLU 88 16.944 23.508 14.606 553 HB3 GLU 88 HB3 GLU 88 16.516 21.802 14.595 554 HG2 GLU 88 HG2 GLU 88 18.639 21.557 16.099 555 HG3 GLU 88 HG3 GLU 88 18.382 23.274 16.397 556 H ALA 89 H ALA 89 20.257 22.255 12.187 557 HA ALA 89 HA ALA 89 22.075 24.012 13.618 558 HB1 ALA 89 HB1 ALA 89 22.280 21.779 11.664 559 HB2 ALA 89 HB2 ALA 89 23.485 22.420 12.811 560 HB3 ALA 89 HB3 ALA 89 23.266 23.204 11.248 561 H ALA 90 H ALA 90 19.513 24.883 12.436 562 HA ALA 90 HA ALA 90 20.004 26.207 9.950 563 HB1 ALA 90 HB1 ALA 90 17.814 25.179 10.762 564 HB2 ALA 90 HB2 ALA 90 17.744 26.753 9.970 565 HB3 ALA 90 HB3 ALA 90 17.634 26.644 11.727 566 H PHE 91 H PHE 91 19.483 28.423 9.630 567 HA PHE 91 HA PHE 91 21.017 30.159 11.332 568 HB2 PHE 91 HB2 PHE 91 20.823 31.766 9.560 569 HB3 PHE 91 HB3 PHE 91 21.114 30.197 8.824 570 HD1 PHE 91 HD1 PHE 91 18.995 28.919 7.971 571 HD2 PHE 91 HD2 PHE 91 19.095 33.095 8.800 572 HE1 PHE 91 HE1 PHE 91 17.039 29.252 6.518 573 HE2 PHE 91 HE2 PHE 91 17.139 33.430 7.348 574 HZ PHE 91 HZ PHE 91 16.109 31.509 6.204 575 H SER 92 H SER 92 20.101 30.909 13.110 576 HA SER 92 HA SER 92 17.263 31.477 13.246 577 HB2 SER 92 HB2 SER 92 19.501 31.209 15.177 578 HB3 SER 92 HB3 SER 92 18.200 32.306 15.637 579 HG SER 92 HG SER 92 17.507 29.786 14.644 580 H1 ALA 101 H1 ALA 101 -5.772 -4.901 21.933 581 H2 ALA 101 H2 ALA 101 -6.519 -4.028 20.658 582 H3 ALA 101 H3 ALA 101 -6.042 -3.216 22.092 583 HA ALA 101 HA ALA 101 -4.407 -2.657 20.676 584 HB1 ALA 101 HB1 ALA 101 -3.537 -5.179 22.079 585 HB2 ALA 101 HB2 ALA 101 -3.426 -3.524 22.679 586 HB3 ALA 101 HB3 ALA 101 -2.434 -4.034 21.314 587 H VAL 102 H VAL 102 -5.056 -6.150 20.289 588 HA VAL 102 HA VAL 102 -3.585 -6.899 18.227 589 HB VAL 102 HB VAL 102 -5.301 -8.235 19.411 590 HG11 VAL 102 HG11 VAL 102 -7.148 -6.608 19.144 591 HG12 VAL 102 HG12 VAL 102 -7.590 -8.238 18.637 592 HG13 VAL 102 HG13 VAL 102 -7.216 -7.011 17.428 593 HG21 VAL 102 HG21 VAL 102 -5.415 -8.400 16.399 594 HG22 VAL 102 HG22 VAL 102 -5.813 -9.696 17.528 595 HG23 VAL 102 HG23 VAL 102 -4.156 -9.098 17.422 596 H LEU 103 H LEU 103 -3.779 -7.169 16.060 597 HA LEU 103 HA LEU 103 -5.183 -5.031 14.507 598 HB2 LEU 103 HB2 LEU 103 -3.268 -6.566 12.982 599 HB3 LEU 103 HB3 LEU 103 -3.407 -4.833 13.212 600 HG LEU 103 HG LEU 103 -1.213 -5.434 13.850 601 HD11 LEU 103 HD11 LEU 103 -3.060 -4.546 15.882 602 HD12 LEU 103 HD12 LEU 103 -1.432 -3.988 15.501 603 HD13 LEU 103 HD13 LEU 103 -1.663 -5.366 16.576 604 HD21 LEU 103 HD21 LEU 103 -2.454 -7.674 15.418 605 HD22 LEU 103 HD22 LEU 103 -0.785 -7.155 15.627 606 HD23 LEU 103 HD23 LEU 103 -1.327 -7.777 14.070 607 H ASP 104 H ASP 104 -6.374 -5.657 12.820 608 HA ASP 104 HA ASP 104 -6.616 -8.282 11.822 609 HB2 ASP 104 HB2 ASP 104 -8.206 -7.750 14.051 610 HB3 ASP 104 HB3 ASP 104 -9.287 -7.416 12.708 611 H LEU 105 H LEU 105 -9.558 -7.010 11.225 612 HA LEU 105 HA LEU 105 -8.551 -4.878 9.541 613 HB2 LEU 105 HB2 LEU 105 -8.580 -6.778 8.033 614 HB3 LEU 105 HB3 LEU 105 -10.247 -7.114 8.466 615 HG LEU 105 HG LEU 105 -11.064 -5.262 7.267 616 HD11 LEU 105 HD11 LEU 105 -9.273 -3.693 8.205 617 HD12 LEU 105 HD12 LEU 105 -9.856 -3.378 6.569 618 HD13 LEU 105 HD13 LEU 105 -8.302 -4.173 6.808 619 HD21 LEU 105 HD21 LEU 105 -9.159 -6.999 5.963 620 HD22 LEU 105 HD22 LEU 105 -9.266 -5.438 5.148 621 HD23 LEU 105 HD23 LEU 105 -10.718 -6.407 5.392 622 H ASP 106 H ASP 106 -10.296 -5.566 11.910 623 HA ASP 106 HA ASP 106 -12.798 -4.311 11.266 624 HB2 ASP 106 HB2 ASP 106 -11.571 -5.593 13.703 625 HB3 ASP 106 HB3 ASP 106 -12.795 -4.352 13.950 626 H VAL 107 H VAL 107 -11.530 -2.853 14.244 627 HA VAL 107 HA VAL 107 -10.431 -0.951 12.317 628 HB VAL 107 HB VAL 107 -12.318 -0.093 13.574 629 HG11 VAL 107 HG11 VAL 107 -10.978 -1.409 15.868 630 HG12 VAL 107 HG12 VAL 107 -12.688 -1.285 15.471 631 HG13 VAL 107 HG13 VAL 107 -11.847 0.090 16.186 632 HG21 VAL 107 HG21 VAL 107 -9.942 1.148 13.392 633 HG22 VAL 107 HG22 VAL 107 -10.165 1.169 15.142 634 HG23 VAL 107 HG23 VAL 107 -11.378 1.900 14.089 635 H ARG 108 H ARG 108 -8.150 -1.063 12.375 636 HA ARG 108 HA ARG 108 -7.087 -2.367 14.706 637 HB2 ARG 108 HB2 ARG 108 -5.824 -2.761 12.742 638 HB3 ARG 108 HB3 ARG 108 -5.792 -1.050 12.328 639 HG2 ARG 108 HG2 ARG 108 -3.658 -2.100 13.257 640 HG3 ARG 108 HG3 ARG 108 -4.180 -0.564 13.939 641 HD2 ARG 108 HD2 ARG 108 -5.408 -2.238 15.632 642 HD3 ARG 108 HD3 ARG 108 -4.043 -3.247 15.164 643 HE ARG 108 HE ARG 108 -3.950 -1.127 16.961 644 HH11 ARG 108 HH11 ARG 108 -2.152 -2.362 14.231 645 HH12 ARG 108 HH12 ARG 108 -0.700 -1.528 14.656 646 HH21 ARG 108 HH21 ARG 108 -2.032 -0.034 17.515 647 HH22 ARG 108 HH22 ARG 108 -0.629 -0.215 16.516 648 H THR 109 H THR 109 -7.010 -1.187 16.655 649 HA THR 109 HA THR 109 -7.336 1.623 16.448 650 HB THR 109 HB THR 109 -5.676 0.715 18.745 651 HG1 THR 109 HG1 THR 109 -6.912 -1.069 18.703 652 HG21 THR 109 HG21 THR 109 -8.299 2.178 18.656 653 HG22 THR 109 HG22 THR 109 -6.710 2.941 18.694 654 HG23 THR 109 HG23 THR 109 -7.255 1.969 20.061 655 H CYS 110 H CYS 110 -6.134 2.673 15.155 656 HA CYS 110 HA CYS 110 -3.375 2.107 14.702 657 HB2 CYS 110 HB2 CYS 110 -5.440 3.104 13.234 658 HB3 CYS 110 HB3 CYS 110 -4.461 4.533 13.494 659 H LEU 111 H LEU 111 -1.912 2.776 16.326 660 HA LEU 111 HA LEU 111 -1.970 4.720 18.165 661 HB2 LEU 111 HB2 LEU 111 0.014 3.232 17.408 662 HB3 LEU 111 HB3 LEU 111 0.478 4.618 16.438 663 HG LEU 111 HG LEU 111 -0.071 5.246 19.263 664 HD11 LEU 111 HD11 LEU 111 0.958 3.248 19.843 665 HD12 LEU 111 HD12 LEU 111 2.293 4.399 19.835 666 HD13 LEU 111 HD13 LEU 111 2.064 3.305 18.472 667 HD21 LEU 111 HD21 LEU 111 2.530 5.965 18.330 668 HD22 LEU 111 HD22 LEU 111 1.153 7.006 18.689 669 HD23 LEU 111 HD23 LEU 111 1.347 6.325 17.074 670 HA PRO 112 HA PRO 112 -2.569 8.455 15.649 671 HB2 PRO 112 HB2 PRO 112 -3.994 9.811 17.400 672 HB3 PRO 112 HB3 PRO 112 -4.657 8.358 16.654 673 HG2 PRO 112 HG2 PRO 112 -3.521 8.741 19.389 674 HG3 PRO 112 HG3 PRO 112 -4.915 7.776 18.876 675 HD2 PRO 112 HD2 PRO 112 -2.310 6.823 19.331 676 HD3 PRO 112 HD3 PRO 112 -3.615 5.953 18.499 677 H CYS 113 H CYS 113 -0.974 10.083 15.392 678 HA CYS 113 HA CYS 113 0.052 11.389 17.798 679 HB2 CYS 113 HB2 CYS 113 2.108 10.486 17.620 680 HB3 CYS 113 HB3 CYS 113 1.465 9.391 16.407 681 H GLY 114 H GLY 114 1.946 13.004 16.674 682 HA2 GLY 114 HA2 GLY 114 2.284 14.846 15.329 683 HA3 GLY 114 HA3 GLY 114 0.993 14.279 14.288 684 HA PRO 115 HA PRO 115 -0.632 18.006 16.532 685 HB2 PRO 115 HB2 PRO 115 -1.889 19.108 14.456 686 HB3 PRO 115 HB3 PRO 115 -0.121 19.294 14.591 687 HG2 PRO 115 HG2 PRO 115 -1.649 17.104 13.294 688 HG3 PRO 115 HG3 PRO 115 -0.566 18.253 12.438 689 HD2 PRO 115 HD2 PRO 115 0.490 15.965 13.160 690 HD3 PRO 115 HD3 PRO 115 1.347 17.426 13.723 691 H GLY 116 H GLY 116 -2.666 17.904 17.291 692 HA2 GLY 116 HA2 GLY 116 -4.620 17.240 17.886 693 HA3 GLY 116 HA3 GLY 116 -4.863 16.819 16.202 694 H GLY 117 H GLY 117 -2.321 14.856 16.620 695 HA2 GLY 117 HA2 GLY 117 -2.112 12.776 17.303 696 HA3 GLY 117 HA3 GLY 117 -3.319 13.187 18.489 697 H LYS 118 H LYS 118 -4.038 13.957 15.332 698 HA LYS 118 HA LYS 118 -6.128 11.969 15.125 699 HB2 LYS 118 HB2 LYS 118 -5.754 14.017 13.019 700 HB3 LYS 118 HB3 LYS 118 -7.232 13.405 13.745 701 HG2 LYS 118 HG2 LYS 118 -5.978 14.758 15.814 702 HG3 LYS 118 HG3 LYS 118 -5.674 15.755 14.393 703 HD2 LYS 118 HD2 LYS 118 -8.402 14.823 14.427 704 HD3 LYS 118 HD3 LYS 118 -8.005 15.655 15.931 705 HE2 LYS 118 HE2 LYS 118 -8.760 17.361 14.539 706 HE3 LYS 118 HE3 LYS 118 -7.004 17.475 14.423 707 HZ1 LYS 118 HZ1 LYS 118 -7.703 17.604 12.237 708 HZ2 LYS 118 HZ2 LYS 118 -8.922 16.448 12.433 709 HZ3 LYS 118 HZ3 LYS 118 -7.301 15.967 12.388 710 H GLY 119 H GLY 119 -2.853 11.974 14.061 711 HA2 GLY 119 HA2 GLY 119 -3.657 10.406 11.731 712 HA3 GLY 119 HA3 GLY 119 -2.174 11.364 11.822 713 H ARG 120 H ARG 120 -1.451 8.834 11.310 714 HA ARG 120 HA ARG 120 -0.974 7.700 13.972 715 HB2 ARG 120 HB2 ARG 120 -1.318 6.201 11.378 716 HB3 ARG 120 HB3 ARG 120 -1.043 5.485 12.962 717 HG2 ARG 120 HG2 ARG 120 -3.289 5.278 12.826 718 HG3 ARG 120 HG3 ARG 120 -3.201 6.855 13.586 719 HD2 ARG 120 HD2 ARG 120 -4.048 7.894 11.787 720 HD3 ARG 120 HD3 ARG 120 -3.142 6.893 10.656 721 HE ARG 120 HE ARG 120 -4.867 5.166 11.004 722 HH11 ARG 120 HH11 ARG 120 -5.669 8.478 11.818 723 HH12 ARG 120 HH12 ARG 120 -7.371 8.232 11.636 724 HH21 ARG 120 HH21 ARG 120 -7.102 4.862 10.771 725 HH22 ARG 120 HH22 ARG 120 -8.183 6.187 11.044 726 H CYS 121 H CYS 121 0.927 6.074 13.902 727 HA CYS 121 HA CYS 121 3.178 7.480 12.606 728 HB2 CYS 121 HB2 CYS 121 2.913 5.863 15.113 729 HB3 CYS 121 HB3 CYS 121 4.470 5.894 14.298 730 H PHE 122 H PHE 122 4.750 6.331 11.476 731 HA PHE 122 HA PHE 122 4.260 3.476 10.938 732 HB2 PHE 122 HB2 PHE 122 4.566 5.666 8.870 733 HB3 PHE 122 HB3 PHE 122 4.722 3.950 8.500 734 HD1 PHE 122 HD1 PHE 122 2.367 6.451 9.939 735 HD2 PHE 122 HD2 PHE 122 2.858 2.681 8.002 736 HE1 PHE 122 HE1 PHE 122 -0.077 6.248 9.689 737 HE2 PHE 122 HE2 PHE 122 0.416 2.489 7.744 738 HZ PHE 122 HZ PHE 122 -1.052 4.278 8.587 739 H GLY 123 H GLY 123 6.439 6.219 10.254 740 HA2 GLY 123 HA2 GLY 123 8.720 4.360 10.347 741 HA3 GLY 123 HA3 GLY 123 8.747 5.979 9.657 742 HA PRO 124 HA PRO 124 10.475 6.250 13.952 743 HB2 PRO 124 HB2 PRO 124 12.798 7.571 12.914 744 HB3 PRO 124 HB3 PRO 124 12.699 5.975 13.656 745 HG2 PRO 124 HG2 PRO 124 13.275 6.481 10.986 746 HG3 PRO 124 HG3 PRO 124 12.740 4.929 11.647 747 HD2 PRO 124 HD2 PRO 124 11.200 6.991 10.160 748 HD3 PRO 124 HD3 PRO 124 10.995 5.228 10.194 749 H SER 125 H SER 125 11.376 8.691 11.521 750 HA SER 125 HA SER 125 10.344 10.796 13.295 751 HB2 SER 125 HB2 SER 125 12.726 10.602 11.858 752 HB3 SER 125 HB3 SER 125 11.736 11.693 10.884 753 HG SER 125 HG SER 125 12.007 13.175 12.337 754 H ILE 126 H ILE 126 8.729 9.005 11.525 755 HA ILE 126 HA ILE 126 7.499 11.113 9.914 756 HB ILE 126 HB ILE 126 7.315 8.334 8.919 757 HG12 ILE 126 HG12 ILE 126 9.765 9.981 8.297 758 HG13 ILE 126 HG13 ILE 126 9.770 8.763 9.570 759 HG21 ILE 126 HG21 ILE 126 6.370 9.516 7.349 760 HG22 ILE 126 HG22 ILE 126 7.965 10.086 6.903 761 HG23 ILE 126 HG23 ILE 126 6.964 11.035 8.001 762 HD11 ILE 126 HD11 ILE 126 9.786 7.051 8.114 763 HD12 ILE 126 HD12 ILE 126 10.476 8.266 7.039 764 HD13 ILE 126 HD13 ILE 126 8.756 7.885 6.952 765 H CYS 127 H CYS 127 5.460 11.490 10.403 766 HA CYS 127 HA CYS 127 3.782 9.272 11.402 767 HB2 CYS 127 HB2 CYS 127 4.471 11.261 13.039 768 HB3 CYS 127 HB3 CYS 127 3.153 12.071 12.211 769 H CYS 128 H CYS 128 2.266 8.826 10.007 770 HA CYS 128 HA CYS 128 1.083 10.944 8.389 771 HB2 CYS 128 HB2 CYS 128 1.157 8.377 7.047 772 HB3 CYS 128 HB3 CYS 128 1.702 9.938 6.478 773 H GLY 129 H GLY 129 -1.182 11.113 9.015 774 HA2 GLY 129 HA2 GLY 129 -2.504 8.570 9.526 775 HA3 GLY 129 HA3 GLY 129 -3.023 10.155 10.034 776 H ASP 130 H ASP 130 -5.033 9.597 9.199 777 HA ASP 130 HA ASP 130 -5.501 8.930 6.534 778 HB2 ASP 130 HB2 ASP 130 -7.847 9.242 6.987 779 HB3 ASP 130 HB3 ASP 130 -7.060 8.343 8.281 780 H GLU 131 H GLU 131 -6.073 12.056 8.057 781 HA GLU 131 HA GLU 131 -6.027 13.154 5.334 782 HB2 GLU 131 HB2 GLU 131 -7.579 14.755 7.227 783 HB3 GLU 131 HB3 GLU 131 -8.002 14.248 5.598 784 HG2 GLU 131 HG2 GLU 131 -8.350 11.926 6.857 785 HG3 GLU 131 HG3 GLU 131 -8.640 13.013 8.213 786 H LEU 132 H LEU 132 -4.141 12.799 7.440 787 HA LEU 132 HA LEU 132 -3.262 15.529 7.845 788 HB2 LEU 132 HB2 LEU 132 -3.721 13.271 9.528 789 HB3 LEU 132 HB3 LEU 132 -2.021 13.613 9.524 790 HG LEU 132 HG LEU 132 -4.059 15.746 10.083 791 HD11 LEU 132 HD11 LEU 132 -4.135 13.601 11.591 792 HD12 LEU 132 HD12 LEU 132 -4.245 15.215 12.295 793 HD13 LEU 132 HD13 LEU 132 -2.714 14.342 12.328 794 HD21 LEU 132 HD21 LEU 132 -1.786 16.489 9.613 795 HD22 LEU 132 HD22 LEU 132 -1.181 15.448 10.903 796 HD23 LEU 132 HD23 LEU 132 -2.232 16.809 11.289 797 H GLY 133 H GLY 133 -2.770 12.380 6.615 798 HA2 GLY 133 HA2 GLY 133 -1.338 11.601 5.108 799 HA3 GLY 133 HA3 GLY 133 -0.765 13.214 4.969 800 H CYS 134 H CYS 134 1.453 13.234 5.239 801 HA CYS 134 HA CYS 134 2.482 11.641 7.484 802 HB2 CYS 134 HB2 CYS 134 2.629 10.516 5.167 803 HB3 CYS 134 HB3 CYS 134 3.894 11.673 4.851 804 H PHE 135 H PHE 135 3.696 12.957 8.825 805 HA PHE 135 HA PHE 135 5.058 15.230 7.674 806 HB2 PHE 135 HB2 PHE 135 4.855 14.252 10.540 807 HB3 PHE 135 HB3 PHE 135 5.445 15.811 10.001 808 HD1 PHE 135 HD1 PHE 135 2.321 13.867 9.281 809 HD2 PHE 135 HD2 PHE 135 4.068 17.475 10.690 810 HE1 PHE 135 HE1 PHE 135 0.091 14.850 9.537 811 HE2 PHE 135 HE2 PHE 135 1.840 18.452 10.959 812 HZ PHE 135 HZ PHE 135 -0.142 17.160 10.373 813 H VAL 136 H VAL 136 6.958 14.527 6.763 814 HA VAL 136 HA VAL 136 8.325 12.376 8.173 815 HB VAL 136 HB VAL 136 9.272 13.503 5.553 816 HG11 VAL 136 HG11 VAL 136 10.420 11.694 7.141 817 HG12 VAL 136 HG12 VAL 136 10.526 11.605 5.381 818 HG13 VAL 136 HG13 VAL 136 9.351 10.617 6.243 819 HG21 VAL 136 HG21 VAL 136 6.735 12.810 5.648 820 HG22 VAL 136 HG22 VAL 136 7.391 11.177 5.573 821 HG23 VAL 136 HG23 VAL 136 7.741 12.320 4.286 822 H GLY 137 H GLY 137 8.918 13.557 9.921 823 HA2 GLY 137 HA2 GLY 137 11.419 14.353 10.281 824 HA3 GLY 137 HA3 GLY 137 10.850 15.748 9.390 825 H THR 138 H THR 138 9.012 16.963 10.393 826 HA THR 138 HA THR 138 9.443 18.254 12.598 827 HB THR 138 HB THR 138 7.436 18.864 11.685 828 HG1 THR 138 HG1 THR 138 5.815 18.480 13.251 829 HG21 THR 138 HG21 THR 138 6.980 16.906 10.396 830 HG22 THR 138 HG22 THR 138 5.543 17.347 11.324 831 HG23 THR 138 HG23 THR 138 6.550 16.002 11.852 832 H ALA 139 H ALA 139 8.942 18.253 14.862 833 HA ALA 139 HA ALA 139 9.817 15.955 16.183 834 HB1 ALA 139 HB1 ALA 139 9.893 18.339 17.003 835 HB2 ALA 139 HB2 ALA 139 9.395 17.139 18.194 836 HB3 ALA 139 HB3 ALA 139 8.189 18.163 17.418 837 H GLU 140 H GLU 140 6.522 17.227 15.626 838 HA GLU 140 HA GLU 140 4.975 15.786 17.215 839 HB2 GLU 140 HB2 GLU 140 4.644 16.354 14.282 840 HB3 GLU 140 HB3 GLU 140 3.372 15.635 15.246 841 HG2 GLU 140 HG2 GLU 140 2.765 17.598 16.061 842 HG3 GLU 140 HG3 GLU 140 4.417 17.961 16.558 843 H ALA 141 H ALA 141 6.827 14.344 14.590 844 HA ALA 141 HA ALA 141 5.467 11.840 14.827 845 HB1 ALA 141 HB1 ALA 141 7.452 13.053 13.006 846 HB2 ALA 141 HB2 ALA 141 6.028 12.082 12.646 847 HB3 ALA 141 HB3 ALA 141 7.509 11.302 13.200 848 H LEU 142 H LEU 142 8.271 13.408 16.128 849 HA LEU 142 HA LEU 142 10.078 11.506 16.525 850 HB2 LEU 142 HB2 LEU 142 9.165 13.726 18.238 851 HB3 LEU 142 HB3 LEU 142 10.124 12.498 19.037 852 HG LEU 142 HG LEU 142 11.129 13.713 16.495 853 HD11 LEU 142 HD11 LEU 142 10.460 15.583 17.968 854 HD12 LEU 142 HD12 LEU 142 12.201 15.493 17.710 855 HD13 LEU 142 HD13 LEU 142 11.503 14.927 19.228 856 HD21 LEU 142 HD21 LEU 142 12.148 11.711 17.778 857 HD22 LEU 142 HD22 LEU 142 12.706 12.937 18.918 858 HD23 LEU 142 HD23 LEU 142 13.212 13.006 17.231 859 H ARG 143 H ARG 143 7.080 11.608 18.463 860 HA ARG 143 HA ARG 143 7.720 9.507 20.186 861 HB2 ARG 143 HB2 ARG 143 5.254 9.005 20.177 862 HB3 ARG 143 HB3 ARG 143 5.646 10.685 20.512 863 HG2 ARG 143 HG2 ARG 143 5.273 10.314 17.689 864 HG3 ARG 143 HG3 ARG 143 3.889 9.677 18.576 865 HD2 ARG 143 HD2 ARG 143 5.062 12.429 18.940 866 HD3 ARG 143 HD3 ARG 143 3.640 12.059 17.967 867 HE ARG 143 HE ARG 143 2.894 11.070 20.309 868 HH11 ARG 143 HH11 ARG 143 4.455 14.110 19.573 869 HH12 ARG 143 HH12 ARG 143 3.732 14.943 20.907 870 HH21 ARG 143 HH21 ARG 143 1.942 12.172 22.058 871 HH22 ARG 143 HH22 ARG 143 2.307 13.845 22.315 872 H CYS 144 H CYS 144 6.855 9.658 16.900 873 HA CYS 144 HA CYS 144 6.153 7.014 16.302 874 HB2 CYS 144 HB2 CYS 144 7.735 8.899 14.555 875 HB3 CYS 144 HB3 CYS 144 7.190 7.329 14.006 876 H GLN 145 H GLN 145 9.269 8.157 17.248 877 HA GLN 145 HA GLN 145 11.042 6.372 16.197 878 HB2 GLN 145 HB2 GLN 145 11.285 8.321 17.954 879 HB3 GLN 145 HB3 GLN 145 11.255 6.993 19.105 880 HG2 GLN 145 HG2 GLN 145 13.224 6.065 18.271 881 HG3 GLN 145 HG3 GLN 145 13.125 6.983 16.768 882 HE21 GLN 145 HE21 GLN 145 13.520 9.267 16.864 883 HE22 GLN 145 HE22 GLN 145 14.552 9.914 18.089 884 H GLU 146 H GLU 146 8.749 5.681 18.829 885 HA GLU 146 HA GLU 146 10.033 3.125 19.322 886 HB2 GLU 146 HB2 GLU 146 7.757 4.617 20.551 887 HB3 GLU 146 HB3 GLU 146 7.861 2.881 20.803 888 HG2 GLU 146 HG2 GLU 146 9.772 3.036 22.058 889 HG3 GLU 146 HG3 GLU 146 10.259 4.565 21.326 890 H GLU 147 H GLU 147 7.923 4.256 17.043 891 HA GLU 147 HA GLU 147 6.321 1.858 16.876 892 HB2 GLU 147 HB2 GLU 147 6.451 4.429 15.356 893 HB3 GLU 147 HB3 GLU 147 5.699 3.028 14.603 894 HG2 GLU 147 HG2 GLU 147 4.873 3.741 17.362 895 HG3 GLU 147 HG3 GLU 147 4.312 4.755 16.035 896 H ASN 148 H ASN 148 9.441 2.375 16.394 897 HA ASN 148 HA ASN 148 9.812 1.289 13.779 898 HB2 ASN 148 HB2 ASN 148 11.505 2.222 15.982 899 HB3 ASN 148 HB3 ASN 148 12.170 0.824 15.142 900 HD21 ASN 148 HD21 ASN 148 10.495 3.834 14.311 901 HD22 ASN 148 HD22 ASN 148 11.554 4.267 13.020 902 H TYR 149 H TYR 149 9.414 0.032 17.016 903 HA TYR 149 HA TYR 149 10.184 -2.658 16.111 904 HB2 TYR 149 HB2 TYR 149 10.251 -1.291 18.628 905 HB3 TYR 149 HB3 TYR 149 9.251 -2.732 18.793 906 HD1 TYR 149 HD1 TYR 149 10.500 -4.676 17.075 907 HD2 TYR 149 HD2 TYR 149 12.327 -1.744 19.559 908 HE1 TYR 149 HE1 TYR 149 12.531 -6.055 17.201 909 HE2 TYR 149 HE2 TYR 149 14.363 -3.117 19.693 910 HH TYR 149 HH TYR 149 14.613 -6.218 17.976 911 H LEU 150 H LEU 150 7.695 -1.263 15.204 912 HA LEU 150 HA LEU 150 5.883 -3.475 15.769 913 HB2 LEU 150 HB2 LEU 150 5.295 -0.600 16.400 914 HB3 LEU 150 HB3 LEU 150 4.007 -1.740 16.059 915 HG LEU 150 HG LEU 150 5.309 -3.130 17.950 916 HD11 LEU 150 HD11 LEU 150 6.551 -1.938 19.385 917 HD12 LEU 150 HD12 LEU 150 5.516 -0.516 19.261 918 HD13 LEU 150 HD13 LEU 150 6.739 -0.826 18.029 919 HD21 LEU 150 HD21 LEU 150 3.651 -1.262 19.328 920 HD22 LEU 150 HD22 LEU 150 3.298 -2.925 18.863 921 HD23 LEU 150 HD23 LEU 150 2.937 -1.604 17.752 922 HA PRO 151 HA PRO 151 5.536 -2.172 11.391 923 HB2 PRO 151 HB2 PRO 151 6.136 -4.505 10.245 924 HB3 PRO 151 HB3 PRO 151 7.399 -3.467 10.917 925 HG2 PRO 151 HG2 PRO 151 6.212 -5.964 12.021 926 HG3 PRO 151 HG3 PRO 151 7.875 -5.365 12.131 927 HD2 PRO 151 HD2 PRO 151 5.884 -5.139 14.105 928 HD3 PRO 151 HD3 PRO 151 7.434 -4.277 14.070 929 H SER 152 H SER 152 3.282 -2.600 12.954 930 HA SER 152 HA SER 152 1.724 -4.802 12.006 931 HB2 SER 152 HB2 SER 152 -0.173 -3.572 13.128 932 HB3 SER 152 HB3 SER 152 1.201 -3.922 14.173 933 HG SER 152 HG SER 152 1.847 -1.805 14.018 934 HA PRO 153 HA PRO 153 0.017 -3.064 8.326 935 HB2 PRO 153 HB2 PRO 153 -2.398 -4.243 8.197 936 HB3 PRO 153 HB3 PRO 153 -0.897 -5.158 8.016 937 HG2 PRO 153 HG2 PRO 153 -2.682 -4.900 10.399 938 HG3 PRO 153 HG3 PRO 153 -1.854 -6.334 9.768 939 HD2 PRO 153 HD2 PRO 153 -0.949 -4.835 11.883 940 HD3 PRO 153 HD3 PRO 153 0.095 -5.828 10.849 941 H CYS 154 H CYS 154 -2.336 -3.040 10.995 942 HA CYS 154 HA CYS 154 -3.673 -1.422 11.823 943 HB2 CYS 154 HB2 CYS 154 -1.578 0.063 10.710 944 HB3 CYS 154 HB3 CYS 154 -3.056 0.841 10.155 945 H GLN 155 H GLN 155 -5.501 -2.495 11.065 946 HA GLN 155 HA GLN 155 -7.369 -2.754 9.733 947 HB2 GLN 155 HB2 GLN 155 -7.287 -0.222 10.703 948 HB3 GLN 155 HB3 GLN 155 -7.485 0.093 8.990 949 HG2 GLN 155 HG2 GLN 155 -9.289 -1.971 9.858 950 HG3 GLN 155 HG3 GLN 155 -9.467 -0.517 10.838 951 HE21 GLN 155 HE21 GLN 155 -10.003 1.454 9.794 952 HE22 GLN 155 HE22 GLN 155 -10.810 1.450 8.267 953 H SER 156 H SER 156 -6.398 -0.009 7.794 954 HA SER 156 HA SER 156 -5.629 -1.735 5.572 955 HB2 SER 156 HB2 SER 156 -7.178 -0.513 4.028 956 HB3 SER 156 HB3 SER 156 -8.003 -1.526 5.213 957 HG SER 156 HG SER 156 -9.002 0.207 5.814 958 H GLY 157 H GLY 157 -3.795 -0.974 4.848 959 HA2 GLY 157 HA2 GLY 157 -3.358 1.555 3.789 960 HA3 GLY 157 HA3 GLY 157 -2.774 1.594 5.453 961 H GLN 158 H GLN 158 -2.734 -1.159 3.251 962 HA GLN 158 HA GLN 158 0.195 -1.037 3.291 963 HB2 GLN 158 HB2 GLN 158 -1.096 -2.912 4.606 964 HB3 GLN 158 HB3 GLN 158 -1.319 -3.614 3.011 965 HG2 GLN 158 HG2 GLN 158 0.582 -4.672 3.658 966 HG3 GLN 158 HG3 GLN 158 1.273 -3.267 2.847 967 HE21 GLN 158 HE21 GLN 158 2.648 -4.767 4.745 968 HE22 GLN 158 HE22 GLN 158 2.920 -3.782 6.137 969 H LYS 159 H LYS 159 -0.329 0.260 1.403 970 HA LYS 159 HA LYS 159 -0.691 -1.358 -1.004 971 HB2 LYS 159 HB2 LYS 159 -1.608 1.305 -0.280 972 HB3 LYS 159 HB3 LYS 159 -0.824 1.243 -1.856 973 HG2 LYS 159 HG2 LYS 159 -2.992 0.774 -2.425 974 HG3 LYS 159 HG3 LYS 159 -2.339 -0.851 -2.211 975 HD2 LYS 159 HD2 LYS 159 -3.956 -1.247 -0.733 976 HD3 LYS 159 HD3 LYS 159 -3.229 -0.035 0.326 977 HE2 LYS 159 HE2 LYS 159 -5.485 0.610 0.047 978 HE3 LYS 159 HE3 LYS 159 -4.538 1.698 -0.968 979 HZ1 LYS 159 HZ1 LYS 159 -5.606 0.996 -2.770 980 HZ2 LYS 159 HZ2 LYS 159 -6.680 0.175 -1.752 981 HZ3 LYS 159 HZ3 LYS 159 -5.343 -0.634 -2.396 982 HA PRO 160 HA PRO 160 3.752 -0.150 -0.786 983 HB2 PRO 160 HB2 PRO 160 4.842 -2.389 -1.772 984 HB3 PRO 160 HB3 PRO 160 4.407 -2.205 -0.069 985 HG2 PRO 160 HG2 PRO 160 2.890 -3.561 -2.271 986 HG3 PRO 160 HG3 PRO 160 3.166 -4.104 -0.605 987 HD2 PRO 160 HD2 PRO 160 0.855 -2.933 -1.391 988 HD3 PRO 160 HD3 PRO 160 1.504 -2.746 0.246 989 H CYS 161 H CYS 161 2.865 1.240 -2.496 990 HA CYS 161 HA CYS 161 3.545 0.414 -5.224 991 HB2 CYS 161 HB2 CYS 161 2.164 2.157 -5.993 992 HB3 CYS 161 HB3 CYS 161 1.316 1.611 -4.551 993 H GLY 162 H GLY 162 4.976 1.905 -6.542 994 HA2 GLY 162 HA2 GLY 162 6.675 3.437 -6.761 995 HA3 GLY 162 HA3 GLY 162 6.449 3.911 -5.081 996 H SER 163 H SER 163 8.831 3.847 -5.226 997 HA SER 163 HA SER 163 10.153 1.339 -5.493 998 HB2 SER 163 HB2 SER 163 10.921 4.130 -5.158 999 HB3 SER 163 HB3 SER 163 11.978 3.027 -4.279 1000 HG SER 163 HG SER 163 11.937 3.531 -6.882 1001 H GLY 164 H GLY 164 8.641 0.414 -3.852 1002 HA2 GLY 164 HA2 GLY 164 8.739 -0.923 -1.982 1003 HA3 GLY 164 HA3 GLY 164 10.175 -0.065 -1.460 1004 H GLY 165 H GLY 165 7.275 1.828 -2.197 1005 HA2 GLY 165 HA2 GLY 165 7.072 2.271 0.692 1006 HA3 GLY 165 HA3 GLY 165 6.627 3.411 -0.559 1007 H ARG 166 H ARG 166 5.199 1.922 1.789 1008 HA ARG 166 HA ARG 166 2.898 1.077 0.202 1009 HB2 ARG 166 HB2 ARG 166 2.075 0.204 2.526 1010 HB3 ARG 166 HB3 ARG 166 3.191 -0.747 1.567 1011 HG2 ARG 166 HG2 ARG 166 4.208 1.152 3.648 1012 HG3 ARG 166 HG3 ARG 166 3.598 -0.438 4.105 1013 HD2 ARG 166 HD2 ARG 166 5.687 -0.093 1.980 1014 HD3 ARG 166 HD3 ARG 166 6.106 -0.199 3.688 1015 HE ARG 166 HE ARG 166 4.428 -2.353 2.946 1016 HH11 ARG 166 HH11 ARG 166 7.704 -1.187 2.651 1017 HH12 ARG 166 HH12 ARG 166 8.384 -2.768 2.461 1018 HH21 ARG 166 HH21 ARG 166 5.321 -4.437 2.696 1019 HH22 ARG 166 HH22 ARG 166 7.032 -4.613 2.486 1020 H CYS 167 H CYS 167 0.747 1.866 0.900 1021 HA CYS 167 HA CYS 167 0.628 4.539 1.246 1022 HB2 CYS 167 HB2 CYS 167 -1.231 3.192 0.398 1023 HB3 CYS 167 HB3 CYS 167 -1.398 2.410 1.962 1024 H ALA 168 H ALA 168 1.570 5.506 2.907 1025 HA ALA 168 HA ALA 168 1.354 4.324 5.543 1026 HB1 ALA 168 HB1 ALA 168 3.346 5.844 4.354 1027 HB2 ALA 168 HB2 ALA 168 3.202 5.477 6.075 1028 HB3 ALA 168 HB3 ALA 168 2.542 6.982 5.436 1029 H ALA 169 H ALA 169 0.274 7.123 3.558 1030 HA ALA 169 HA ALA 169 -2.069 7.383 5.240 1031 HB1 ALA 169 HB1 ALA 169 -0.009 9.567 5.154 1032 HB2 ALA 169 HB2 ALA 169 -0.478 8.641 6.575 1033 HB3 ALA 169 HB3 ALA 169 -1.627 9.723 5.802 1034 H ALA 170 H ALA 170 -3.419 9.190 4.351 1035 HA ALA 170 HA ALA 170 -4.138 8.950 1.808 1036 HB1 ALA 170 HB1 ALA 170 -4.794 11.365 1.754 1037 HB2 ALA 170 HB2 ALA 170 -3.955 11.563 3.295 1038 HB3 ALA 170 HB3 ALA 170 -5.342 10.477 3.175 1039 H GLY 171 H GLY 171 -2.945 8.708 0.088 1040 HA2 GLY 171 HA2 GLY 171 -1.647 9.276 -1.708 1041 HA3 GLY 171 HA3 GLY 171 -1.470 10.869 -1.023 1042 H ILE 172 H ILE 172 -0.436 8.864 1.374 1043 HA ILE 172 HA ILE 172 2.335 9.190 0.499 1044 HB ILE 172 HB ILE 172 1.592 8.141 3.231 1045 HG12 ILE 172 HG12 ILE 172 0.230 10.042 3.282 1046 HG13 ILE 172 HG13 ILE 172 1.756 10.655 3.897 1047 HG21 ILE 172 HG21 ILE 172 3.814 8.125 3.236 1048 HG22 ILE 172 HG22 ILE 172 3.652 9.851 3.544 1049 HG23 ILE 172 HG23 ILE 172 3.938 9.271 1.903 1050 HD11 ILE 172 HD11 ILE 172 1.432 10.743 1.030 1051 HD12 ILE 172 HD12 ILE 172 2.134 11.924 2.111 1052 HD13 ILE 172 HD13 ILE 172 0.379 11.829 1.927 1053 H CYS 173 H CYS 173 3.348 7.606 -0.357 1054 HA CYS 173 HA CYS 173 2.620 4.834 0.271 1055 HB2 CYS 173 HB2 CYS 173 2.317 5.941 -2.111 1056 HB3 CYS 173 HB3 CYS 173 4.025 5.619 -2.241 1057 H CYS 174 H CYS 174 4.228 4.507 1.930 1058 HA CYS 174 HA CYS 174 6.901 4.449 0.856 1059 HB2 CYS 174 HB2 CYS 174 7.824 5.942 2.534 1060 HB3 CYS 174 HB3 CYS 174 6.704 6.703 1.423 1061 H SER 175 H SER 175 8.516 4.324 2.794 1062 HA SER 175 HA SER 175 7.733 2.105 4.567 1063 HB2 SER 175 HB2 SER 175 9.586 2.084 2.375 1064 HB3 SER 175 HB3 SER 175 10.495 1.893 3.871 1065 HG SER 175 HG SER 175 9.500 -0.046 2.741 1066 HA PRO 176 HA PRO 176 9.886 4.245 7.769 1067 HB2 PRO 176 HB2 PRO 176 11.741 2.594 8.833 1068 HB3 PRO 176 HB3 PRO 176 10.005 2.324 9.019 1069 HG2 PRO 176 HG2 PRO 176 11.924 1.054 7.106 1070 HG3 PRO 176 HG3 PRO 176 10.635 0.299 8.061 1071 HD2 PRO 176 HD2 PRO 176 10.356 0.916 5.435 1072 HD3 PRO 176 HD3 PRO 176 8.995 0.926 6.570 1073 H ASP 177 H ASP 177 11.137 4.536 5.050 1074 HA ASP 177 HA ASP 177 13.762 5.533 5.946 1075 HB2 ASP 177 HB2 ASP 177 13.038 4.073 3.409 1076 HB3 ASP 177 HB3 ASP 177 14.436 5.141 3.473 1077 H GLY 178 H GLY 178 11.485 5.776 3.206 1078 HA2 GLY 178 HA2 GLY 178 11.457 8.675 3.563 1079 HA3 GLY 178 HA3 GLY 178 11.812 8.044 1.980 1080 H CYS 179 H CYS 179 9.814 9.359 1.434 1081 HA CYS 179 HA CYS 179 7.574 7.553 1.481 1082 HB2 CYS 179 HB2 CYS 179 7.436 10.284 2.697 1083 HB3 CYS 179 HB3 CYS 179 5.994 9.472 2.094 1084 H HIS 180 H HIS 180 5.752 8.189 -0.061 1085 HA HIS 180 HA HIS 180 6.602 10.136 -2.061 1086 HB2 HIS 180 HB2 HIS 180 7.830 8.316 -2.927 1087 HB3 HIS 180 HB3 HIS 180 6.579 7.156 -2.508 1088 HD1 HIS 180 HD1 HIS 180 6.920 10.125 -4.868 1089 HD2 HIS 180 HD2 HIS 180 5.172 6.361 -4.660 1090 HE1 HIS 180 HE1 HIS 180 5.840 9.760 -7.111 1091 HE2 HIS 180 HE2 HIS 180 4.862 7.440 -6.990 1092 H GLU 181 H GLU 181 4.972 10.727 -3.505 1093 HA GLU 181 HA GLU 181 2.363 10.680 -2.486 1094 HB2 GLU 181 HB2 GLU 181 3.699 11.654 -4.923 1095 HB3 GLU 181 HB3 GLU 181 1.998 11.264 -5.133 1096 HG2 GLU 181 HG2 GLU 181 1.730 13.398 -4.498 1097 HG3 GLU 181 HG3 GLU 181 1.843 12.701 -2.882 1098 H ASP 182 H ASP 182 0.594 9.477 -2.931 1099 HA ASP 182 HA ASP 182 0.896 7.295 -4.897 1100 HB2 ASP 182 HB2 ASP 182 0.581 5.639 -3.364 1101 HB3 ASP 182 HB3 ASP 182 1.297 6.847 -2.285 1102 HA PRO 183 HA PRO 183 -3.201 8.611 -5.988 1103 HB2 PRO 183 HB2 PRO 183 -3.462 6.456 -7.854 1104 HB3 PRO 183 HB3 PRO 183 -3.032 8.137 -8.161 1105 HG2 PRO 183 HG2 PRO 183 -1.307 6.014 -8.480 1106 HG3 PRO 183 HG3 PRO 183 -0.797 7.689 -8.200 1107 HD2 PRO 183 HD2 PRO 183 -1.032 5.428 -6.246 1108 HD3 PRO 183 HD3 PRO 183 0.239 6.662 -6.398 1109 H ALA 184 H ALA 184 -2.798 5.155 -5.145 1110 HA ALA 184 HA ALA 184 -5.542 4.515 -5.162 1111 HB1 ALA 184 HB1 ALA 184 -3.706 2.834 -4.968 1112 HB2 ALA 184 HB2 ALA 184 -5.003 2.616 -3.793 1113 HB3 ALA 184 HB3 ALA 184 -3.478 3.349 -3.297 1114 H CYS 185 H CYS 185 -3.406 5.686 -2.664 1115 HA CYS 185 HA CYS 185 -5.668 6.417 -0.937 1116 HB2 CYS 185 HB2 CYS 185 -2.682 6.473 -0.445 1117 HB3 CYS 185 HB3 CYS 185 -3.892 6.977 0.723 1118 H ASP 186 H ASP 186 -6.207 7.976 -2.774 1119 HA ASP 186 HA ASP 186 -4.253 10.170 -2.913 1120 HB2 ASP 186 HB2 ASP 186 -5.847 9.086 -4.859 1121 HB3 ASP 186 HB3 ASP 186 -6.766 10.514 -4.389 1122 HA PRO 187 HA PRO 187 -7.841 12.421 -1.028 1123 HB2 PRO 187 HB2 PRO 187 -10.353 11.524 -1.456 1124 HB3 PRO 187 HB3 PRO 187 -9.412 12.340 -2.709 1125 HG2 PRO 187 HG2 PRO 187 -10.257 9.563 -2.593 1126 HG3 PRO 187 HG3 PRO 187 -9.483 10.430 -3.929 1127 HD2 PRO 187 HD2 PRO 187 -8.279 8.703 -1.859 1128 HD3 PRO 187 HD3 PRO 187 -7.649 9.150 -3.457 1129 H GLU 188 H GLU 188 -9.329 12.591 0.674 1130 HA GLU 188 HA GLU 188 -9.041 10.840 2.831 1131 HB2 GLU 188 HB2 GLU 188 -10.336 12.559 3.958 1132 HB3 GLU 188 HB3 GLU 188 -9.115 13.346 2.966 1133 HG2 GLU 188 HG2 GLU 188 -11.027 13.414 1.186 1134 HG3 GLU 188 HG3 GLU 188 -12.071 13.224 2.591 1135 H ALA 189 H ALA 189 -9.849 9.290 1.220 1136 HA ALA 189 HA ALA 189 -12.716 8.820 1.164 1137 HB1 ALA 189 HB1 ALA 189 -10.320 7.930 -0.356 1138 HB2 ALA 189 HB2 ALA 189 -12.040 7.941 -0.822 1139 HB3 ALA 189 HB3 ALA 189 -11.405 6.604 0.134 1140 H ALA 190 H ALA 190 -11.150 9.042 3.648 1141 HA ALA 190 HA ALA 190 -10.604 6.427 4.671 1142 HB1 ALA 190 HB1 ALA 190 -9.995 9.141 5.378 1143 HB2 ALA 190 HB2 ALA 190 -9.212 7.643 5.880 1144 HB3 ALA 190 HB3 ALA 190 -10.600 8.256 6.778 1145 H PHE 191 H PHE 191 -11.406 5.738 6.724 1146 HA PHE 191 HA PHE 191 -14.280 5.636 6.777 1147 HB2 PHE 191 HB2 PHE 191 -14.006 3.860 8.367 1148 HB3 PHE 191 HB3 PHE 191 -12.796 3.641 7.114 1149 HD1 PHE 191 HD1 PHE 191 -10.408 4.566 7.650 1150 HD2 PHE 191 HD2 PHE 191 -13.389 3.794 10.591 1151 HE1 PHE 191 HE1 PHE 191 -8.662 4.421 9.377 1152 HE2 PHE 191 HE2 PHE 191 -11.647 3.647 12.319 1153 HZ PHE 191 HZ PHE 191 -9.280 3.960 11.715 1154 H SER 192 H SER 192 -15.341 7.265 7.672 1155 HA SER 192 HA SER 192 -14.256 8.745 9.913 1156 HB2 SER 192 HB2 SER 192 -16.491 9.084 7.989 1157 HB3 SER 192 HB3 SER 192 -16.715 9.801 9.584 1158 HG SER 192 HG SER 192 -15.335 10.775 7.573 Start of MODEL 7 1 H1 ALA 1 H1 ALA 1 18.475 35.037 -13.881 2 H2 ALA 1 H2 ALA 1 19.660 35.644 -12.797 3 H3 ALA 1 H3 ALA 1 18.329 36.626 -13.257 4 HA ALA 1 HA ALA 1 16.893 34.832 -12.283 5 HB1 ALA 1 HB1 ALA 1 18.942 34.120 -10.362 6 HB2 ALA 1 HB2 ALA 1 19.364 33.604 -11.997 7 HB3 ALA 1 HB3 ALA 1 17.839 33.093 -11.279 8 H VAL 2 H VAL 2 17.245 34.785 -9.486 9 HA VAL 2 HA VAL 2 18.023 37.281 -8.386 10 HB VAL 2 HB VAL 2 15.019 36.911 -8.346 11 HG11 VAL 2 HG11 VAL 2 15.110 39.330 -7.674 12 HG12 VAL 2 HG12 VAL 2 16.860 39.162 -7.557 13 HG13 VAL 2 HG13 VAL 2 15.812 38.205 -6.511 14 HG21 VAL 2 HG21 VAL 2 15.658 37.360 -10.665 15 HG22 VAL 2 HG22 VAL 2 16.563 38.780 -10.141 16 HG23 VAL 2 HG23 VAL 2 14.812 38.729 -9.954 17 H LEU 3 H LEU 3 18.416 34.562 -7.947 18 HA LEU 3 HA LEU 3 17.701 34.313 -5.159 19 HB2 LEU 3 HB2 LEU 3 16.891 31.840 -5.995 20 HB3 LEU 3 HB3 LEU 3 15.814 33.172 -5.658 21 HG LEU 3 HG LEU 3 15.760 33.749 -8.044 22 HD11 LEU 3 HD11 LEU 3 17.899 31.762 -8.135 23 HD12 LEU 3 HD12 LEU 3 17.485 33.034 -9.280 24 HD13 LEU 3 HD13 LEU 3 16.645 31.488 -9.344 25 HD21 LEU 3 HD21 LEU 3 14.778 31.321 -8.682 26 HD22 LEU 3 HD22 LEU 3 13.918 32.503 -7.699 27 HD23 LEU 3 HD23 LEU 3 14.808 31.191 -6.924 28 H ASP 4 H ASP 4 20.293 34.575 -6.112 29 HA ASP 4 HA ASP 4 21.255 31.819 -5.834 30 HB2 ASP 4 HB2 ASP 4 22.756 34.429 -6.365 31 HB3 ASP 4 HB3 ASP 4 23.534 32.870 -6.104 32 H LEU 5 H LEU 5 23.308 34.093 -4.487 33 HA LEU 5 HA LEU 5 22.171 33.629 -1.877 34 HB2 LEU 5 HB2 LEU 5 24.683 33.322 -2.391 35 HB3 LEU 5 HB3 LEU 5 24.759 35.071 -2.415 36 HG LEU 5 HG LEU 5 24.783 35.223 -0.177 37 HD11 LEU 5 HD11 LEU 5 22.297 34.289 -0.210 38 HD12 LEU 5 HD12 LEU 5 23.237 34.384 1.288 39 HD13 LEU 5 HD13 LEU 5 23.098 32.850 0.440 40 HD21 LEU 5 HD21 LEU 5 25.159 32.463 0.509 41 HD22 LEU 5 HD22 LEU 5 26.340 33.772 0.441 42 HD23 LEU 5 HD23 LEU 5 25.984 32.830 -1.006 43 H ASP 6 H ASP 6 21.098 35.517 -3.980 44 HA ASP 6 HA ASP 6 21.236 37.987 -2.440 45 HB2 ASP 6 HB2 ASP 6 20.480 37.376 -5.229 46 HB3 ASP 6 HB3 ASP 6 19.268 38.345 -4.406 47 H VAL 7 H VAL 7 17.894 37.542 -3.370 48 HA VAL 7 HA VAL 7 17.736 35.971 -0.926 49 HB VAL 7 HB VAL 7 16.851 38.354 -1.100 50 HG11 VAL 7 HG11 VAL 7 15.577 37.371 -3.419 51 HG12 VAL 7 HG12 VAL 7 15.636 39.007 -2.780 52 HG13 VAL 7 HG13 VAL 7 14.354 37.918 -2.286 53 HG21 VAL 7 HG21 VAL 7 15.714 36.127 0.143 54 HG22 VAL 7 HG22 VAL 7 14.383 37.136 -0.412 55 HG23 VAL 7 HG23 VAL 7 15.629 37.814 0.626 56 H ARG 8 H ARG 8 17.294 33.866 -1.379 57 HA ARG 8 HA ARG 8 16.504 33.091 -4.031 58 HB2 ARG 8 HB2 ARG 8 17.977 31.656 -2.498 59 HB3 ARG 8 HB3 ARG 8 16.483 31.230 -1.677 60 HG2 ARG 8 HG2 ARG 8 15.601 30.173 -3.589 61 HG3 ARG 8 HG3 ARG 8 16.826 30.883 -4.625 62 HD2 ARG 8 HD2 ARG 8 17.770 29.138 -2.436 63 HD3 ARG 8 HD3 ARG 8 16.944 28.367 -3.788 64 HE ARG 8 HE ARG 8 19.190 30.185 -4.300 65 HH11 ARG 8 HH11 ARG 8 17.766 26.999 -4.495 66 HH12 ARG 8 HH12 ARG 8 19.054 26.348 -5.449 67 HH21 ARG 8 HH21 ARG 8 20.884 29.326 -5.553 68 HH22 ARG 8 HH22 ARG 8 20.828 27.666 -6.044 69 H THR 9 H THR 9 14.312 33.234 -4.672 70 HA THR 9 HA THR 9 12.351 33.762 -2.748 71 HB THR 9 HB THR 9 11.755 33.914 -5.100 72 HG1 THR 9 HG1 THR 9 10.205 31.849 -3.942 73 HG21 THR 9 HG21 THR 9 12.425 31.023 -5.141 74 HG22 THR 9 HG22 THR 9 12.779 32.286 -6.312 75 HG23 THR 9 HG23 THR 9 11.154 31.618 -6.204 76 H CYS 10 H CYS 10 12.285 32.752 -0.967 77 HA CYS 10 HA CYS 10 12.661 29.978 -0.536 78 HB2 CYS 10 HB2 CYS 10 12.015 32.293 1.250 79 HB3 CYS 10 HB3 CYS 10 12.075 30.651 1.861 80 H LEU 11 H LEU 11 10.641 29.352 -1.967 81 HA LEU 11 HA LEU 11 8.056 29.891 -1.589 82 HB2 LEU 11 HB2 LEU 11 9.261 27.128 -1.599 83 HB3 LEU 11 HB3 LEU 11 7.535 27.404 -1.664 84 HG LEU 11 HG LEU 11 7.801 28.573 -3.812 85 HD11 LEU 11 HD11 LEU 11 10.056 28.229 -4.960 86 HD12 LEU 11 HD12 LEU 11 10.702 27.991 -3.337 87 HD13 LEU 11 HD13 LEU 11 9.937 29.522 -3.767 88 HD21 LEU 11 HD21 LEU 11 7.365 26.161 -3.734 89 HD22 LEU 11 HD22 LEU 11 9.103 25.859 -3.761 90 HD23 LEU 11 HD23 LEU 11 8.319 26.617 -5.147 91 HA PRO 12 HA PRO 12 7.808 29.316 2.922 92 HB2 PRO 12 HB2 PRO 12 5.714 30.876 3.430 93 HB3 PRO 12 HB3 PRO 12 7.291 31.565 3.022 94 HG2 PRO 12 HG2 PRO 12 4.887 31.158 1.284 95 HG3 PRO 12 HG3 PRO 12 5.949 32.573 1.402 96 HD2 PRO 12 HD2 PRO 12 6.166 30.684 -0.549 97 HD3 PRO 12 HD3 PRO 12 7.529 31.659 0.014 98 H CYS 13 H CYS 13 6.769 27.645 4.097 99 HA CYS 13 HA CYS 13 3.963 27.142 3.361 100 HB2 CYS 13 HB2 CYS 13 4.287 24.725 3.124 101 HB3 CYS 13 HB3 CYS 13 5.222 25.609 1.927 102 H GLY 14 H GLY 14 3.291 24.994 4.872 103 HA2 GLY 14 HA2 GLY 14 3.082 24.182 7.038 104 HA3 GLY 14 HA3 GLY 14 4.565 25.022 7.450 105 HA PRO 15 HA PRO 15 1.052 27.059 9.921 106 HB2 PRO 15 HB2 PRO 15 2.449 27.293 12.177 107 HB3 PRO 15 HB3 PRO 15 1.867 25.679 11.693 108 HG2 PRO 15 HG2 PRO 15 4.369 26.995 10.789 109 HG3 PRO 15 HG3 PRO 15 4.334 25.603 11.944 110 HD2 PRO 15 HD2 PRO 15 4.561 24.933 9.467 111 HD3 PRO 15 HD3 PRO 15 3.073 24.312 10.239 112 H GLY 16 H GLY 16 0.995 29.148 9.175 113 HA2 GLY 16 HA2 GLY 16 1.397 31.294 9.081 114 HA3 GLY 16 HA3 GLY 16 2.931 30.995 9.889 115 H GLY 17 H GLY 17 3.295 28.772 7.615 116 HA2 GLY 17 HA2 GLY 17 4.104 28.733 5.534 117 HA3 GLY 17 HA3 GLY 17 3.377 30.278 5.330 118 H LYS 18 H LYS 18 5.685 29.115 7.573 119 HA LYS 18 HA LYS 18 7.523 31.290 6.980 120 HB2 LYS 18 HB2 LYS 18 8.461 29.517 9.031 121 HB3 LYS 18 HB3 LYS 18 8.089 31.224 9.132 122 HG2 LYS 18 HG2 LYS 18 6.446 30.645 10.502 123 HG3 LYS 18 HG3 LYS 18 5.601 30.037 9.098 124 HD2 LYS 18 HD2 LYS 18 7.200 28.530 11.135 125 HD3 LYS 18 HD3 LYS 18 5.558 28.244 10.570 126 HE2 LYS 18 HE2 LYS 18 6.478 26.617 9.346 127 HE3 LYS 18 HE3 LYS 18 6.964 27.929 8.276 128 HZ1 LYS 18 HZ1 LYS 18 8.599 26.581 10.340 129 HZ2 LYS 18 HZ2 LYS 18 9.052 28.057 9.655 130 HZ3 LYS 18 HZ3 LYS 18 8.897 26.686 8.679 131 H GLY 19 H GLY 19 7.429 27.608 6.474 132 HA2 GLY 19 HA2 GLY 19 10.170 27.762 5.813 133 HA3 GLY 19 HA3 GLY 19 9.212 26.342 6.201 134 H ARG 20 H ARG 20 10.572 25.922 4.317 135 HA ARG 20 HA ARG 20 9.467 26.764 1.774 136 HB2 ARG 20 HB2 ARG 20 11.999 25.842 2.673 137 HB3 ARG 20 HB3 ARG 20 11.552 25.120 1.132 138 HG2 ARG 20 HG2 ARG 20 12.043 27.008 0.077 139 HG3 ARG 20 HG3 ARG 20 10.865 27.872 1.071 140 HD2 ARG 20 HD2 ARG 20 13.568 28.347 1.018 141 HD3 ARG 20 HD3 ARG 20 12.459 28.853 2.288 142 HE ARG 20 HE ARG 20 13.395 27.304 3.691 143 HH11 ARG 20 HH11 ARG 20 14.440 26.641 0.423 144 HH12 ARG 20 HH12 ARG 20 15.624 25.475 0.911 145 HH21 ARG 20 HH21 ARG 20 14.943 25.778 4.326 146 HH22 ARG 20 HH22 ARG 20 15.911 24.985 3.129 147 H CYS 21 H CYS 21 8.716 25.638 0.126 148 HA CYS 21 HA CYS 21 7.680 22.933 0.660 149 HB2 CYS 21 HB2 CYS 21 6.517 25.343 -0.443 150 HB3 CYS 21 HB3 CYS 21 6.485 24.072 -1.663 151 H PHE 22 H PHE 22 7.391 21.658 -1.469 152 HA PHE 22 HA PHE 22 9.283 22.260 -3.568 153 HB2 PHE 22 HB2 PHE 22 9.709 19.806 -1.831 154 HB3 PHE 22 HB3 PHE 22 10.631 20.227 -3.270 155 HD1 PHE 22 HD1 PHE 22 9.795 21.403 0.159 156 HD2 PHE 22 HD2 PHE 22 12.509 21.611 -3.123 157 HE1 PHE 22 HE1 PHE 22 11.336 22.747 1.528 158 HE2 PHE 22 HE2 PHE 22 14.056 22.956 -1.757 159 HZ PHE 22 HZ PHE 22 13.470 23.527 0.571 160 H GLY 23 H GLY 23 6.657 22.132 -3.905 161 HA2 GLY 23 HA2 GLY 23 5.850 20.842 -5.961 162 HA3 GLY 23 HA3 GLY 23 6.035 19.438 -4.917 163 HA PRO 24 HA PRO 24 1.835 20.871 -3.974 164 HB2 PRO 24 HB2 PRO 24 0.591 18.467 -4.391 165 HB3 PRO 24 HB3 PRO 24 0.940 19.616 -5.684 166 HG2 PRO 24 HG2 PRO 24 2.126 17.013 -5.195 167 HG3 PRO 24 HG3 PRO 24 2.316 18.072 -6.599 168 HD2 PRO 24 HD2 PRO 24 4.097 17.701 -4.297 169 HD3 PRO 24 HD3 PRO 24 4.433 18.455 -5.869 170 H SER 25 H SER 25 2.293 17.428 -3.154 171 HA SER 25 HA SER 25 1.468 17.991 -0.406 172 HB2 SER 25 HB2 SER 25 1.613 15.541 -2.120 173 HB3 SER 25 HB3 SER 25 1.718 15.319 -0.366 174 HG SER 25 HG SER 25 -0.308 15.985 -0.155 175 H ILE 26 H ILE 26 3.938 19.082 -0.974 176 HA ILE 26 HA ILE 26 5.661 17.429 0.702 177 HB ILE 26 HB ILE 26 6.283 18.397 -2.037 178 HG12 ILE 26 HG12 ILE 26 7.073 15.709 -1.435 179 HG13 ILE 26 HG13 ILE 26 5.360 15.978 -1.155 180 HG21 ILE 26 HG21 ILE 26 8.414 17.002 -0.632 181 HG22 ILE 26 HG22 ILE 26 8.128 18.673 -0.152 182 HG23 ILE 26 HG23 ILE 26 8.497 18.289 -1.830 183 HD11 ILE 26 HD11 ILE 26 4.956 15.835 -3.315 184 HD12 ILE 26 HD12 ILE 26 6.670 15.537 -3.600 185 HD13 ILE 26 HD13 ILE 26 6.049 17.185 -3.624 186 H CYS 27 H CYS 27 6.240 18.710 2.378 187 HA CYS 27 HA CYS 27 7.376 21.355 1.889 188 HB2 CYS 27 HB2 CYS 27 5.198 22.137 2.229 189 HB3 CYS 27 HB3 CYS 27 4.826 20.909 3.424 190 H CYS 28 H CYS 28 9.137 21.552 3.000 191 HA CYS 28 HA CYS 28 9.548 20.124 5.542 192 HB2 CYS 28 HB2 CYS 28 10.775 19.540 3.205 193 HB3 CYS 28 HB3 CYS 28 11.843 20.775 3.833 194 H GLY 29 H GLY 29 10.963 21.218 7.108 195 HA2 GLY 29 HA2 GLY 29 11.804 23.881 6.375 196 HA3 GLY 29 HA3 GLY 29 10.723 23.725 7.751 197 H ASP 30 H ASP 30 12.823 24.794 8.440 198 HA ASP 30 HA ASP 30 15.072 23.262 9.140 199 HB2 ASP 30 HB2 ASP 30 14.968 25.798 8.811 200 HB3 ASP 30 HB3 ASP 30 14.313 25.857 10.446 201 H GLU 31 H GLU 31 12.287 24.259 10.664 202 HA GLU 31 HA GLU 31 12.969 22.546 13.018 203 HB2 GLU 31 HB2 GLU 31 11.433 24.222 14.378 204 HB3 GLU 31 HB3 GLU 31 13.169 24.406 14.272 205 HG2 GLU 31 HG2 GLU 31 12.997 26.184 12.806 206 HG3 GLU 31 HG3 GLU 31 11.361 25.745 12.314 207 H LEU 32 H LEU 32 11.367 22.308 10.610 208 HA LEU 32 HA LEU 32 8.821 21.598 11.756 209 HB2 LEU 32 HB2 LEU 32 9.553 23.444 9.778 210 HB3 LEU 32 HB3 LEU 32 8.738 22.128 9.004 211 HG LEU 32 HG LEU 32 7.647 23.803 11.261 212 HD11 LEU 32 HD11 LEU 32 7.547 25.184 9.349 213 HD12 LEU 32 HD12 LEU 32 5.955 24.452 9.472 214 HD13 LEU 32 HD13 LEU 32 7.112 23.832 8.307 215 HD21 LEU 32 HD21 LEU 32 6.964 21.200 10.607 216 HD22 LEU 32 HD22 LEU 32 5.725 22.178 9.821 217 HD23 LEU 32 HD23 LEU 32 6.002 22.333 11.555 218 H GLY 33 H GLY 33 11.338 20.924 9.519 219 HA2 GLY 33 HA2 GLY 33 12.170 18.837 9.006 220 HA3 GLY 33 HA3 GLY 33 10.754 18.176 9.713 221 H CYS 34 H CYS 34 9.878 16.811 8.036 222 HA CYS 34 HA CYS 34 9.405 18.147 5.519 223 HB2 CYS 34 HB2 CYS 34 10.819 15.678 6.002 224 HB3 CYS 34 HB3 CYS 34 9.661 15.648 4.718 225 H PHE 35 H PHE 35 7.207 18.193 5.189 226 HA PHE 35 HA PHE 35 5.775 15.856 6.210 227 HB2 PHE 35 HB2 PHE 35 3.927 17.938 5.809 228 HB3 PHE 35 HB3 PHE 35 4.421 17.267 7.349 229 HD1 PHE 35 HD1 PHE 35 7.098 18.304 7.728 230 HD2 PHE 35 HD2 PHE 35 3.667 20.163 6.062 231 HE1 PHE 35 HE1 PHE 35 8.000 20.493 8.338 232 HE2 PHE 35 HE2 PHE 35 4.551 22.367 6.695 233 HZ PHE 35 HZ PHE 35 6.723 22.522 7.825 234 H VAL 36 H VAL 36 5.512 14.687 4.452 235 HA VAL 36 HA VAL 36 5.236 16.052 1.922 236 HB VAL 36 HB VAL 36 5.225 13.083 2.048 237 HG11 VAL 36 HG11 VAL 36 5.166 13.800 -0.144 238 HG12 VAL 36 HG12 VAL 36 6.898 13.720 0.134 239 HG13 VAL 36 HG13 VAL 36 6.086 15.287 0.197 240 HG21 VAL 36 HG21 VAL 36 7.737 14.727 2.420 241 HG22 VAL 36 HG22 VAL 36 7.673 12.984 2.262 242 HG23 VAL 36 HG23 VAL 36 6.993 13.776 3.678 243 H GLY 37 H GLY 37 3.304 16.924 2.056 244 HA2 GLY 37 HA2 GLY 37 1.071 16.877 1.316 245 HA3 GLY 37 HA3 GLY 37 1.059 15.130 1.520 246 H THR 38 H THR 38 0.749 18.215 3.120 247 HA THR 38 HA THR 38 -0.915 16.996 5.154 248 HB THR 38 HB THR 38 0.320 18.195 6.987 249 HG1 THR 38 HG1 THR 38 1.557 19.416 5.194 250 HG21 THR 38 HG21 THR 38 1.088 16.167 7.373 251 HG22 THR 38 HG22 THR 38 2.510 16.595 6.426 252 HG23 THR 38 HG23 THR 38 1.149 15.784 5.659 253 H ALA 39 H ALA 39 -1.602 18.843 6.682 254 HA ALA 39 HA ALA 39 -3.031 20.770 5.055 255 HB1 ALA 39 HB1 ALA 39 -2.637 20.941 8.051 256 HB2 ALA 39 HB2 ALA 39 -3.888 19.974 7.271 257 HB3 ALA 39 HB3 ALA 39 -3.897 21.729 7.098 258 H GLU 40 H GLU 40 -0.340 20.845 7.178 259 HA GLU 40 HA GLU 40 0.473 23.509 7.054 260 HB2 GLU 40 HB2 GLU 40 2.538 21.322 7.018 261 HB3 GLU 40 HB3 GLU 40 2.583 22.852 7.865 262 HG2 GLU 40 HG2 GLU 40 0.627 20.701 8.570 263 HG3 GLU 40 HG3 GLU 40 2.241 20.785 9.269 264 H ALA 41 H ALA 41 1.006 20.934 4.764 265 HA ALA 41 HA ALA 41 2.714 22.451 3.068 266 HB1 ALA 41 HB1 ALA 41 2.461 19.819 3.497 267 HB2 ALA 41 HB2 ALA 41 3.094 20.478 1.987 268 HB3 ALA 41 HB3 ALA 41 1.408 19.972 2.088 269 H LEU 42 H LEU 42 -0.594 21.442 3.161 270 HA LEU 42 HA LEU 42 -1.582 21.999 0.695 271 HB2 LEU 42 HB2 LEU 42 -2.733 22.359 3.352 272 HB3 LEU 42 HB3 LEU 42 -3.463 23.381 2.133 273 HG LEU 42 HG LEU 42 -3.164 20.592 1.279 274 HD11 LEU 42 HD11 LEU 42 -3.652 19.861 3.414 275 HD12 LEU 42 HD12 LEU 42 -5.256 19.999 2.695 276 HD13 LEU 42 HD13 LEU 42 -4.663 21.259 3.778 277 HD21 LEU 42 HD21 LEU 42 -4.477 21.932 -0.092 278 HD22 LEU 42 HD22 LEU 42 -5.293 22.702 1.268 279 HD23 LEU 42 HD23 LEU 42 -5.666 21.031 0.846 280 H ARG 43 H ARG 43 -0.396 24.412 2.917 281 HA ARG 43 HA ARG 43 -1.219 26.768 1.664 282 HB2 ARG 43 HB2 ARG 43 1.586 26.382 2.690 283 HB3 ARG 43 HB3 ARG 43 0.614 27.844 2.717 284 HG2 ARG 43 HG2 ARG 43 -0.078 25.403 4.325 285 HG3 ARG 43 HG3 ARG 43 0.966 26.691 4.925 286 HD2 ARG 43 HD2 ARG 43 -1.450 27.772 3.784 287 HD3 ARG 43 HD3 ARG 43 -1.823 26.581 5.026 288 HE ARG 43 HE ARG 43 -0.686 27.909 6.613 289 HH11 ARG 43 HH11 ARG 43 -0.852 29.424 3.463 290 HH12 ARG 43 HH12 ARG 43 -0.498 31.003 4.075 291 HH21 ARG 43 HH21 ARG 43 -0.216 29.985 7.403 292 HH22 ARG 43 HH22 ARG 43 -0.136 31.323 6.305 293 H CYS 44 H CYS 44 1.150 24.318 0.813 294 HA CYS 44 HA CYS 44 2.837 25.438 -0.848 295 HB2 CYS 44 HB2 CYS 44 2.007 22.904 -0.248 296 HB3 CYS 44 HB3 CYS 44 1.663 22.998 -1.964 297 H GLN 45 H GLN 45 -0.598 26.086 -1.690 298 HA GLN 45 HA GLN 45 0.082 25.896 -4.466 299 HB2 GLN 45 HB2 GLN 45 -2.288 25.805 -2.857 300 HB3 GLN 45 HB3 GLN 45 -2.363 27.265 -3.833 301 HG2 GLN 45 HG2 GLN 45 -1.741 25.653 -5.785 302 HG3 GLN 45 HG3 GLN 45 -2.344 24.410 -4.687 303 HE21 GLN 45 HE21 GLN 45 -3.210 27.484 -6.199 304 HE22 GLN 45 HE22 GLN 45 -4.906 27.167 -6.288 305 H GLU 46 H GLU 46 0.908 27.703 -1.909 306 HA GLU 46 HA GLU 46 0.366 30.313 -3.000 307 HB2 GLU 46 HB2 GLU 46 0.716 29.496 -0.453 308 HB3 GLU 46 HB3 GLU 46 2.369 29.961 -0.826 309 HG2 GLU 46 HG2 GLU 46 1.604 32.196 -1.446 310 HG3 GLU 46 HG3 GLU 46 -0.056 31.732 -1.076 311 H GLU 47 H GLU 47 2.176 27.984 -4.136 312 HA GLU 47 HA GLU 47 4.710 29.291 -4.403 313 HB2 GLU 47 HB2 GLU 47 4.315 26.783 -4.559 314 HB3 GLU 47 HB3 GLU 47 3.644 27.095 -6.153 315 HG2 GLU 47 HG2 GLU 47 6.233 28.343 -5.787 316 HG3 GLU 47 HG3 GLU 47 6.291 26.597 -5.554 317 H ASN 48 H ASN 48 1.771 30.154 -5.462 318 HA ASN 48 HA ASN 48 2.684 30.987 -8.116 319 HB2 ASN 48 HB2 ASN 48 -0.040 30.940 -6.826 320 HB3 ASN 48 HB3 ASN 48 0.269 31.763 -8.353 321 HD21 ASN 48 HD21 ASN 48 -1.101 29.150 -7.262 322 HD22 ASN 48 HD22 ASN 48 -0.694 28.000 -8.485 323 H TYR 49 H TYR 49 1.968 32.232 -4.957 324 HA TYR 49 HA TYR 49 2.762 34.938 -5.814 325 HB2 TYR 49 HB2 TYR 49 0.247 34.739 -5.708 326 HB3 TYR 49 HB3 TYR 49 0.409 34.449 -3.978 327 HD1 TYR 49 HD1 TYR 49 1.533 36.915 -6.556 328 HD2 TYR 49 HD2 TYR 49 0.212 36.264 -2.564 329 HE1 TYR 49 HE1 TYR 49 1.584 39.339 -6.150 330 HE2 TYR 49 HE2 TYR 49 0.260 38.687 -2.147 331 HH TYR 49 HH TYR 49 1.272 40.683 -3.002 332 H LEU 50 H LEU 50 4.684 33.528 -4.594 333 HA LEU 50 HA LEU 50 4.531 34.377 -1.761 334 HB2 LEU 50 HB2 LEU 50 6.398 32.519 -1.571 335 HB3 LEU 50 HB3 LEU 50 4.692 32.135 -1.485 336 HG LEU 50 HG LEU 50 4.747 31.471 -3.875 337 HD11 LEU 50 HD11 LEU 50 6.785 31.238 -5.071 338 HD12 LEU 50 HD12 LEU 50 7.730 31.763 -3.680 339 HD13 LEU 50 HD13 LEU 50 6.672 32.903 -4.512 340 HD21 LEU 50 HD21 LEU 50 6.867 29.761 -2.960 341 HD22 LEU 50 HD22 LEU 50 5.161 29.405 -3.153 342 HD23 LEU 50 HD23 LEU 50 5.740 30.099 -1.658 343 HA PRO 51 HA PRO 51 8.250 36.666 -2.985 344 HB2 PRO 51 HB2 PRO 51 7.543 38.991 -1.905 345 HB3 PRO 51 HB3 PRO 51 6.745 38.392 -3.364 346 HG2 PRO 51 HG2 PRO 51 5.718 38.566 -0.600 347 HG3 PRO 51 HG3 PRO 51 4.828 38.531 -2.130 348 HD2 PRO 51 HD2 PRO 51 5.394 36.341 -0.320 349 HD3 PRO 51 HD3 PRO 51 4.406 36.329 -1.795 350 H SER 52 H SER 52 8.583 34.861 -0.828 351 HA SER 52 HA SER 52 9.815 36.599 1.223 352 HB2 SER 52 HB2 SER 52 7.824 35.155 1.946 353 HB3 SER 52 HB3 SER 52 8.892 33.767 1.740 354 HG SER 52 HG SER 52 8.763 34.789 3.909 355 HA PRO 53 HA PRO 53 12.898 33.725 -1.207 356 HB2 PRO 53 HB2 PRO 53 14.509 35.891 -1.859 357 HB3 PRO 53 HB3 PRO 53 13.407 35.068 -2.939 358 HG2 PRO 53 HG2 PRO 53 12.991 37.579 -1.399 359 HG3 PRO 53 HG3 PRO 53 12.419 37.136 -3.018 360 HD2 PRO 53 HD2 PRO 53 10.788 37.140 -0.911 361 HD3 PRO 53 HD3 PRO 53 10.650 35.903 -2.179 362 H CYS 54 H CYS 54 15.254 33.424 -0.841 363 HA CYS 54 HA CYS 54 17.026 34.608 0.728 364 HB2 CYS 54 HB2 CYS 54 16.686 33.574 3.036 365 HB3 CYS 54 HB3 CYS 54 15.656 34.928 2.597 366 H GLN 55 H GLN 55 18.073 32.938 -0.992 367 HA GLN 55 HA GLN 55 19.232 30.982 -1.361 368 HB2 GLN 55 HB2 GLN 55 20.104 32.060 0.965 369 HB3 GLN 55 HB3 GLN 55 19.632 30.457 1.516 370 HG2 GLN 55 HG2 GLN 55 21.016 29.739 -0.634 371 HG3 GLN 55 HG3 GLN 55 21.816 31.273 -0.303 372 HE21 GLN 55 HE21 GLN 55 22.772 31.570 1.788 373 HE22 GLN 55 HE22 GLN 55 23.349 30.209 2.681 374 H SER 56 H SER 56 19.606 28.596 -0.201 375 HA SER 56 HA SER 56 17.316 27.395 0.957 376 HB2 SER 56 HB2 SER 56 17.665 27.032 -2.034 377 HB3 SER 56 HB3 SER 56 16.591 26.056 -1.035 378 HG SER 56 HG SER 56 15.666 28.145 -0.378 379 H GLY 57 H GLY 57 17.701 25.011 -0.549 380 HA2 GLY 57 HA2 GLY 57 20.327 24.019 0.420 381 HA3 GLY 57 HA3 GLY 57 18.846 23.123 0.743 382 H GLN 58 H GLN 58 21.522 23.056 -1.063 383 HA GLN 58 HA GLN 58 20.092 21.830 -3.322 384 HB2 GLN 58 HB2 GLN 58 22.262 22.098 -4.557 385 HB3 GLN 58 HB3 GLN 58 21.456 23.607 -4.146 386 HG2 GLN 58 HG2 GLN 58 23.029 24.191 -2.593 387 HG3 GLN 58 HG3 GLN 58 23.509 22.520 -2.295 388 HE21 GLN 58 HE21 GLN 58 24.814 25.171 -3.225 389 HE22 GLN 58 HE22 GLN 58 25.841 24.657 -4.516 390 H LYS 59 H LYS 59 19.779 20.080 -1.955 391 HA LYS 59 HA LYS 59 22.153 18.243 -2.006 392 HB2 LYS 59 HB2 LYS 59 21.341 19.308 0.357 393 HB3 LYS 59 HB3 LYS 59 20.230 17.950 0.262 394 HG2 LYS 59 HG2 LYS 59 21.980 17.080 1.478 395 HG3 LYS 59 HG3 LYS 59 22.355 16.543 -0.161 396 HD2 LYS 59 HD2 LYS 59 23.512 19.100 0.165 397 HD3 LYS 59 HD3 LYS 59 23.914 18.161 1.604 398 HE2 LYS 59 HE2 LYS 59 25.580 17.321 0.373 399 HE3 LYS 59 HE3 LYS 59 24.329 16.350 -0.403 400 HZ1 LYS 59 HZ1 LYS 59 24.370 18.852 -1.645 401 HZ2 LYS 59 HZ2 LYS 59 24.801 17.354 -2.302 402 HZ3 LYS 59 HZ3 LYS 59 25.971 18.313 -1.546 403 HA PRO 60 HA PRO 60 18.324 16.797 -4.159 404 HB2 PRO 60 HB2 PRO 60 19.846 15.617 -6.162 405 HB3 PRO 60 HB3 PRO 60 19.117 17.224 -6.245 406 HG2 PRO 60 HG2 PRO 60 21.910 16.444 -5.491 407 HG3 PRO 60 HG3 PRO 60 21.355 17.803 -6.491 408 HD2 PRO 60 HD2 PRO 60 22.081 18.206 -3.962 409 HD3 PRO 60 HD3 PRO 60 20.670 19.043 -4.634 410 H CYS 61 H CYS 61 17.974 15.434 -2.471 411 HA CYS 61 HA CYS 61 19.144 12.750 -2.574 412 HB2 CYS 61 HB2 CYS 61 17.071 13.477 -0.551 413 HB3 CYS 61 HB3 CYS 61 18.445 12.398 -0.397 414 H GLY 62 H GLY 62 16.988 11.259 -1.763 415 HA2 GLY 62 HA2 GLY 62 15.258 10.081 -2.834 416 HA3 GLY 62 HA3 GLY 62 14.520 11.664 -2.671 417 H SER 63 H SER 63 13.302 10.791 -4.487 418 HA SER 63 HA SER 63 14.529 10.671 -7.097 419 HB2 SER 63 HB2 SER 63 12.582 9.209 -6.304 420 HB3 SER 63 HB3 SER 63 11.567 10.634 -6.530 421 HG SER 63 HG SER 63 11.461 9.703 -8.466 422 H GLY 64 H GLY 64 15.259 12.903 -6.484 423 HA2 GLY 64 HA2 GLY 64 15.346 14.818 -7.885 424 HA3 GLY 64 HA3 GLY 64 13.598 14.838 -7.908 425 H GLY 65 H GLY 65 14.431 14.389 -4.667 426 HA2 GLY 65 HA2 GLY 65 13.992 17.254 -4.343 427 HA3 GLY 65 HA3 GLY 65 13.772 16.045 -3.116 428 H ARG 66 H ARG 66 15.061 18.689 -3.214 429 HA ARG 66 HA ARG 66 17.802 18.035 -2.498 430 HB2 ARG 66 HB2 ARG 66 17.907 20.659 -2.298 431 HB3 ARG 66 HB3 ARG 66 18.041 19.863 -3.860 432 HG2 ARG 66 HG2 ARG 66 15.359 20.731 -2.853 433 HG3 ARG 66 HG3 ARG 66 16.467 21.910 -3.557 434 HD2 ARG 66 HD2 ARG 66 15.776 19.351 -4.958 435 HD3 ARG 66 HD3 ARG 66 14.777 20.797 -5.114 436 HE ARG 66 HE ARG 66 17.506 21.375 -5.637 437 HH11 ARG 66 HH11 ARG 66 14.676 19.906 -7.051 438 HH12 ARG 66 HH12 ARG 66 15.175 20.218 -8.679 439 HH21 ARG 66 HH21 ARG 66 18.166 21.785 -7.769 440 HH22 ARG 66 HH22 ARG 66 17.160 21.287 -9.089 441 H CYS 67 H CYS 67 18.716 18.854 -0.450 442 HA CYS 67 HA CYS 67 17.382 18.126 1.735 443 HB2 CYS 67 HB2 CYS 67 19.841 18.951 1.459 444 HB3 CYS 67 HB3 CYS 67 19.187 20.498 1.962 445 H ALA 68 H ALA 68 15.457 18.730 2.390 446 HA ALA 68 HA ALA 68 14.826 21.594 2.262 447 HB1 ALA 68 HB1 ALA 68 13.265 19.984 1.162 448 HB2 ALA 68 HB2 ALA 68 12.520 21.008 2.379 449 HB3 ALA 68 HB3 ALA 68 12.900 19.326 2.756 450 H ALA 69 H ALA 69 15.853 19.105 4.231 451 HA ALA 69 HA ALA 69 16.002 20.749 6.574 452 HB1 ALA 69 HB1 ALA 69 14.148 18.403 6.893 453 HB2 ALA 69 HB2 ALA 69 13.591 20.059 6.650 454 HB3 ALA 69 HB3 ALA 69 14.545 19.648 8.072 455 H ALA 70 H ALA 70 17.020 19.560 8.417 456 HA ALA 70 HA ALA 70 19.062 17.834 7.421 457 HB1 ALA 70 HB1 ALA 70 19.811 17.708 9.804 458 HB2 ALA 70 HB2 ALA 70 18.458 18.772 10.208 459 HB3 ALA 70 HB3 ALA 70 19.729 19.334 9.120 460 H GLY 71 H GLY 71 17.639 16.188 6.638 461 HA2 GLY 71 HA2 GLY 71 17.855 13.838 7.969 462 HA3 GLY 71 HA3 GLY 71 16.309 14.470 8.495 463 H ILE 72 H ILE 72 15.189 15.582 6.307 464 HA ILE 72 HA ILE 72 14.990 13.412 4.360 465 HB ILE 72 HB ILE 72 12.515 14.595 4.503 466 HG12 ILE 72 HG12 ILE 72 11.951 14.427 6.958 467 HG13 ILE 72 HG13 ILE 72 13.680 14.326 7.295 468 HG21 ILE 72 HG21 ILE 72 13.746 12.050 5.342 469 HG22 ILE 72 HG22 ILE 72 12.382 12.354 4.268 470 HG23 ILE 72 HG23 ILE 72 12.155 12.403 6.015 471 HD11 ILE 72 HD11 ILE 72 13.273 16.460 5.558 472 HD12 ILE 72 HD12 ILE 72 13.821 16.516 7.242 473 HD13 ILE 72 HD13 ILE 72 12.099 16.630 6.864 474 H CYS 73 H CYS 73 14.794 13.973 2.295 475 HA CYS 73 HA CYS 73 14.984 16.827 1.661 476 HB2 CYS 73 HB2 CYS 73 15.980 14.543 -0.027 477 HB3 CYS 73 HB3 CYS 73 16.206 16.261 -0.321 478 H CYS 74 H CYS 74 13.192 17.624 0.933 479 HA CYS 74 HA CYS 74 11.153 15.956 -0.169 480 HB2 CYS 74 HB2 CYS 74 11.376 18.900 0.373 481 HB3 CYS 74 HB3 CYS 74 9.978 18.205 -0.430 482 H SER 75 H SER 75 10.339 15.915 -2.151 483 HA SER 75 HA SER 75 11.752 17.267 -4.353 484 HB2 SER 75 HB2 SER 75 11.855 15.143 -5.561 485 HB3 SER 75 HB3 SER 75 12.583 14.910 -3.981 486 HG SER 75 HG SER 75 10.858 13.813 -3.302 487 HA PRO 76 HA PRO 76 7.604 17.583 -5.951 488 HB2 PRO 76 HB2 PRO 76 7.646 16.822 -8.542 489 HB3 PRO 76 HB3 PRO 76 8.439 18.303 -7.994 490 HG2 PRO 76 HG2 PRO 76 9.627 15.645 -8.648 491 HG3 PRO 76 HG3 PRO 76 10.260 17.269 -8.971 492 HD2 PRO 76 HD2 PRO 76 11.077 15.656 -6.892 493 HD3 PRO 76 HD3 PRO 76 11.235 17.422 -6.909 494 H ASP 77 H ASP 77 8.508 15.010 -4.736 495 HA ASP 77 HA ASP 77 6.258 13.369 -5.559 496 HB2 ASP 77 HB2 ASP 77 9.138 12.468 -5.523 497 HB3 ASP 77 HB3 ASP 77 7.791 11.334 -5.440 498 H GLY 78 H GLY 78 8.983 13.724 -3.227 499 HA2 GLY 78 HA2 GLY 78 7.200 13.568 -1.056 500 HA3 GLY 78 HA3 GLY 78 8.015 12.056 -1.217 501 H CYS 79 H CYS 79 8.883 12.302 0.834 502 HA CYS 79 HA CYS 79 11.315 13.850 0.882 503 HB2 CYS 79 HB2 CYS 79 9.417 14.032 3.225 504 HB3 CYS 79 HB3 CYS 79 10.908 14.943 2.974 505 H HIS 80 H HIS 80 12.981 12.822 1.627 506 HA HIS 80 HA HIS 80 12.581 10.238 2.972 507 HB2 HIS 80 HB2 HIS 80 13.107 10.595 0.151 508 HB3 HIS 80 HB3 HIS 80 14.370 9.644 0.928 509 HD1 HIS 80 HD1 HIS 80 10.559 9.654 1.170 510 HD2 HIS 80 HD2 HIS 80 13.745 7.020 0.738 511 HE1 HIS 80 HE1 HIS 80 9.525 7.368 1.036 512 HE2 HIS 80 HE2 HIS 80 11.481 5.784 0.962 513 H GLU 81 H GLU 81 14.056 9.644 4.275 514 HA GLU 81 HA GLU 81 15.939 11.270 5.348 515 HB2 GLU 81 HB2 GLU 81 16.922 9.268 6.351 516 HB3 GLU 81 HB3 GLU 81 15.162 9.165 6.369 517 HG2 GLU 81 HG2 GLU 81 15.181 7.309 5.151 518 HG3 GLU 81 HG3 GLU 81 16.255 8.029 3.954 519 H ASP 82 H ASP 82 18.070 11.666 5.049 520 HA ASP 82 HA ASP 82 19.454 10.311 2.869 521 HB2 ASP 82 HB2 ASP 82 19.880 12.294 1.640 522 HB3 ASP 82 HB3 ASP 82 18.145 12.365 2.047 523 HA PRO 83 HA PRO 83 22.721 10.363 5.855 524 HB2 PRO 83 HB2 PRO 83 24.527 10.515 3.502 525 HB3 PRO 83 HB3 PRO 83 24.496 9.358 4.832 526 HG2 PRO 83 HG2 PRO 83 23.596 8.662 2.432 527 HG3 PRO 83 HG3 PRO 83 22.758 8.127 3.901 528 HD2 PRO 83 HD2 PRO 83 22.032 10.316 1.992 529 HD3 PRO 83 HD3 PRO 83 20.982 9.143 2.816 530 H ALA 84 H ALA 84 22.953 12.695 3.197 531 HA ALA 84 HA ALA 84 24.924 14.329 4.386 532 HB1 ALA 84 HB1 ALA 84 24.362 14.443 1.986 533 HB2 ALA 84 HB2 ALA 84 24.256 16.021 2.766 534 HB3 ALA 84 HB3 ALA 84 22.787 15.116 2.404 535 H CYS 85 H CYS 85 21.433 14.536 4.186 536 HA CYS 85 HA CYS 85 21.416 16.426 6.431 537 HB2 CYS 85 HB2 CYS 85 18.922 15.565 4.997 538 HB3 CYS 85 HB3 CYS 85 19.255 17.078 5.811 539 H ASP 86 H ASP 86 22.149 14.637 7.808 540 HA ASP 86 HA ASP 86 19.789 12.975 8.503 541 HB2 ASP 86 HB2 ASP 86 21.989 11.898 7.320 542 HB3 ASP 86 HB3 ASP 86 22.417 11.761 9.023 543 HA PRO 87 HA PRO 87 22.163 13.805 12.413 544 HB2 PRO 87 HB2 PRO 87 24.774 14.765 12.146 545 HB3 PRO 87 HB3 PRO 87 24.304 13.081 12.379 546 HG2 PRO 87 HG2 PRO 87 25.510 14.206 10.082 547 HG3 PRO 87 HG3 PRO 87 24.832 12.575 10.240 548 HD2 PRO 87 HD2 PRO 87 23.626 15.028 9.065 549 HD3 PRO 87 HD3 PRO 87 23.391 13.325 8.621 550 H GLU 88 H GLU 88 22.708 15.414 13.795 551 HA GLU 88 HA GLU 88 21.671 17.922 13.409 552 HB2 GLU 88 HB2 GLU 88 22.393 18.290 15.738 553 HB3 GLU 88 HB3 GLU 88 21.532 16.768 15.547 554 HG2 GLU 88 HG2 GLU 88 23.512 15.510 15.694 555 HG3 GLU 88 HG3 GLU 88 24.522 16.938 15.485 556 H ALA 89 H ALA 89 24.684 16.710 12.434 557 HA ALA 89 HA ALA 89 26.534 18.441 12.908 558 HB1 ALA 89 HB1 ALA 89 25.570 16.881 10.493 559 HB2 ALA 89 HB2 ALA 89 27.005 16.607 11.542 560 HB3 ALA 89 HB3 ALA 89 27.024 17.925 10.369 561 H ALA 90 H ALA 90 24.043 20.263 12.676 562 HA ALA 90 HA ALA 90 24.399 21.625 10.196 563 HB1 ALA 90 HB1 ALA 90 22.673 21.830 12.593 564 HB2 ALA 90 HB2 ALA 90 22.246 21.894 10.883 565 HB3 ALA 90 HB3 ALA 90 22.942 23.309 11.671 566 H PHE 91 H PHE 91 24.858 23.985 10.173 567 HA PHE 91 HA PHE 91 27.309 24.532 11.635 568 HB2 PHE 91 HB2 PHE 91 26.048 26.556 9.831 569 HB3 PHE 91 HB3 PHE 91 27.747 26.162 10.056 570 HD1 PHE 91 HD1 PHE 91 28.699 24.158 8.959 571 HD2 PHE 91 HD2 PHE 91 24.741 25.502 8.170 572 HE1 PHE 91 HE1 PHE 91 28.652 22.805 6.906 573 HE2 PHE 91 HE2 PHE 91 24.687 24.152 6.114 574 HZ PHE 91 HZ PHE 91 26.644 22.800 5.480 575 H SER 92 H SER 92 25.783 24.542 13.679 576 HA SER 92 HA SER 92 24.433 27.082 14.081 577 HB2 SER 92 HB2 SER 92 24.065 26.129 16.423 578 HB3 SER 92 HB3 SER 92 23.313 25.251 15.093 579 HG SER 92 HG SER 92 24.544 23.595 15.504 580 H1 ALA 101 H1 ALA 101 2.135 -10.704 15.085 581 H2 ALA 101 H2 ALA 101 1.121 -9.498 14.407 582 H3 ALA 101 H3 ALA 101 1.124 -11.084 13.755 583 HA ALA 101 HA ALA 101 -0.482 -11.646 15.075 584 HB1 ALA 101 HB1 ALA 101 -0.042 -12.048 17.355 585 HB2 ALA 101 HB2 ALA 101 1.130 -10.734 17.441 586 HB3 ALA 101 HB3 ALA 101 1.516 -12.202 16.543 587 H VAL 102 H VAL 102 -1.811 -10.774 17.205 588 HA VAL 102 HA VAL 102 -3.530 -9.209 17.511 589 HB VAL 102 HB VAL 102 -1.742 -8.953 19.226 590 HG11 VAL 102 HG11 VAL 102 0.097 -8.077 18.090 591 HG12 VAL 102 HG12 VAL 102 -0.481 -6.732 19.074 592 HG13 VAL 102 HG13 VAL 102 -0.853 -6.789 17.352 593 HG21 VAL 102 HG21 VAL 102 -3.797 -7.001 18.523 594 HG22 VAL 102 HG22 VAL 102 -2.540 -6.361 19.581 595 HG23 VAL 102 HG23 VAL 102 -3.455 -7.788 20.064 596 H LEU 103 H LEU 103 -2.828 -9.026 14.724 597 HA LEU 103 HA LEU 103 -3.966 -6.458 14.204 598 HB2 LEU 103 HB2 LEU 103 -2.189 -5.675 12.711 599 HB3 LEU 103 HB3 LEU 103 -1.696 -5.710 14.390 600 HG LEU 103 HG LEU 103 -0.842 -8.150 13.349 601 HD11 LEU 103 HD11 LEU 103 -1.265 -6.466 11.170 602 HD12 LEU 103 HD12 LEU 103 -0.320 -7.953 11.199 603 HD13 LEU 103 HD13 LEU 103 0.471 -6.401 11.473 604 HD21 LEU 103 HD21 LEU 103 1.211 -7.449 14.060 605 HD22 LEU 103 HD22 LEU 103 0.207 -6.254 14.883 606 HD23 LEU 103 HD23 LEU 103 1.020 -5.835 13.374 607 H ASP 104 H ASP 104 -5.399 -8.500 13.451 608 HA ASP 104 HA ASP 104 -4.714 -8.756 10.591 609 HB2 ASP 104 HB2 ASP 104 -5.961 -10.705 12.384 610 HB3 ASP 104 HB3 ASP 104 -7.014 -10.337 11.023 611 H LEU 105 H LEU 105 -7.984 -9.200 11.382 612 HA LEU 105 HA LEU 105 -8.453 -6.396 10.911 613 HB2 LEU 105 HB2 LEU 105 -9.397 -7.849 9.132 614 HB3 LEU 105 HB3 LEU 105 -10.340 -8.695 10.347 615 HG LEU 105 HG LEU 105 -11.806 -6.926 10.637 616 HD11 LEU 105 HD11 LEU 105 -9.954 -5.232 11.024 617 HD12 LEU 105 HD12 LEU 105 -11.390 -4.631 10.177 618 HD13 LEU 105 HD13 LEU 105 -9.930 -5.010 9.267 619 HD21 LEU 105 HD21 LEU 105 -11.177 -6.222 7.826 620 HD22 LEU 105 HD22 LEU 105 -12.717 -6.656 8.569 621 HD23 LEU 105 HD23 LEU 105 -11.539 -7.911 8.187 622 H ASP 106 H ASP 106 -7.874 -8.103 13.337 623 HA ASP 106 HA ASP 106 -10.248 -7.550 14.914 624 HB2 ASP 106 HB2 ASP 106 -7.682 -9.028 15.401 625 HB3 ASP 106 HB3 ASP 106 -8.369 -8.171 16.779 626 H VAL 107 H VAL 107 -7.424 -6.497 16.682 627 HA VAL 107 HA VAL 107 -7.948 -3.950 15.308 628 HB VAL 107 HB VAL 107 -8.716 -4.386 17.691 629 HG11 VAL 107 HG11 VAL 107 -6.068 -5.192 18.076 630 HG12 VAL 107 HG12 VAL 107 -7.385 -5.142 19.238 631 HG13 VAL 107 HG13 VAL 107 -6.326 -3.760 19.054 632 HG21 VAL 107 HG21 VAL 107 -7.130 -2.067 16.855 633 HG22 VAL 107 HG22 VAL 107 -7.637 -2.151 18.533 634 HG23 VAL 107 HG23 VAL 107 -8.836 -2.185 17.242 635 H ARG 108 H ARG 108 -6.246 -3.361 14.041 636 HA ARG 108 HA ARG 108 -3.701 -4.692 14.338 637 HB2 ARG 108 HB2 ARG 108 -4.627 -3.941 12.082 638 HB3 ARG 108 HB3 ARG 108 -4.235 -2.305 12.572 639 HG2 ARG 108 HG2 ARG 108 -1.937 -2.717 12.576 640 HG3 ARG 108 HG3 ARG 108 -2.164 -4.447 12.564 641 HD2 ARG 108 HD2 ARG 108 -3.196 -2.880 10.273 642 HD3 ARG 108 HD3 ARG 108 -1.464 -3.149 10.397 643 HE ARG 108 HE ARG 108 -3.304 -5.435 10.481 644 HH11 ARG 108 HH11 ARG 108 -0.660 -3.722 8.964 645 HH12 ARG 108 HH12 ARG 108 -0.377 -4.952 7.781 646 HH21 ARG 108 HH21 ARG 108 -2.932 -7.053 8.912 647 HH22 ARG 108 HH22 ARG 108 -1.667 -6.839 7.747 648 H THR 109 H THR 109 -2.295 -4.003 15.986 649 HA THR 109 HA THR 109 -2.696 -1.602 17.330 650 HB THR 109 HB THR 109 -0.967 -3.111 18.115 651 HG1 THR 109 HG1 THR 109 -0.405 -0.442 17.656 652 HG21 THR 109 HG21 THR 109 0.205 -4.030 16.391 653 HG22 THR 109 HG22 THR 109 1.341 -2.793 16.928 654 HG23 THR 109 HG23 THR 109 0.328 -2.506 15.516 655 H CYS 110 H CYS 110 -3.249 0.144 16.367 656 HA CYS 110 HA CYS 110 -2.173 1.148 13.934 657 HB2 CYS 110 HB2 CYS 110 -4.284 2.121 15.827 658 HB3 CYS 110 HB3 CYS 110 -3.771 3.079 14.451 659 H LEU 111 H LEU 111 0.150 1.412 14.966 660 HA LEU 111 HA LEU 111 0.974 2.988 16.949 661 HB2 LEU 111 HB2 LEU 111 1.888 3.215 14.084 662 HB3 LEU 111 HB3 LEU 111 2.689 4.046 15.400 663 HG LEU 111 HG LEU 111 3.253 1.874 16.420 664 HD11 LEU 111 HD11 LEU 111 3.003 -0.128 14.822 665 HD12 LEU 111 HD12 LEU 111 1.720 0.826 14.076 666 HD13 LEU 111 HD13 LEU 111 1.606 0.370 15.776 667 HD21 LEU 111 HD21 LEU 111 4.910 2.846 15.032 668 HD22 LEU 111 HD22 LEU 111 4.074 2.332 13.566 669 HD23 LEU 111 HD23 LEU 111 4.835 1.133 14.613 670 HA PRO 112 HA PRO 112 -1.444 6.751 16.042 671 HB2 PRO 112 HB2 PRO 112 -1.508 7.790 18.486 672 HB3 PRO 112 HB3 PRO 112 -2.492 6.386 18.057 673 HG2 PRO 112 HG2 PRO 112 0.113 6.510 19.524 674 HG3 PRO 112 HG3 PRO 112 -1.334 5.556 19.890 675 HD2 PRO 112 HD2 PRO 112 0.852 4.564 18.592 676 HD3 PRO 112 HD3 PRO 112 -0.779 3.910 18.386 677 H CYS 113 H CYS 113 -0.759 8.782 15.382 678 HA CYS 113 HA CYS 113 1.506 10.014 16.747 679 HB2 CYS 113 HB2 CYS 113 2.850 10.378 14.755 680 HB3 CYS 113 HB3 CYS 113 2.606 8.656 14.998 681 H GLY 114 H GLY 114 2.062 12.176 15.379 682 HA2 GLY 114 HA2 GLY 114 1.293 14.201 14.570 683 HA3 GLY 114 HA3 GLY 114 -0.229 13.426 14.161 684 HA PRO 115 HA PRO 115 -1.105 16.567 17.570 685 HB2 PRO 115 HB2 PRO 115 -3.403 17.412 16.548 686 HB3 PRO 115 HB3 PRO 115 -1.866 17.896 15.781 687 HG2 PRO 115 HG2 PRO 115 -3.369 15.378 15.281 688 HG3 PRO 115 HG3 PRO 115 -3.274 16.740 14.101 689 HD2 PRO 115 HD2 PRO 115 -1.458 14.944 13.822 690 HD3 PRO 115 HD3 PRO 115 -0.806 16.563 14.204 691 H GLY 116 H GLY 116 -1.472 15.063 19.046 692 HA2 GLY 116 HA2 GLY 116 -2.895 14.333 20.795 693 HA3 GLY 116 HA3 GLY 116 -4.195 14.188 19.612 694 H GLY 117 H GLY 117 -1.877 13.058 17.919 695 HA2 GLY 117 HA2 GLY 117 -0.912 11.022 17.422 696 HA3 GLY 117 HA3 GLY 117 -1.109 10.635 19.078 697 H LYS 118 H LYS 118 -3.133 11.438 16.461 698 HA LYS 118 HA LYS 118 -5.028 9.285 17.093 699 HB2 LYS 118 HB2 LYS 118 -5.818 10.937 14.862 700 HB3 LYS 118 HB3 LYS 118 -6.646 10.644 16.381 701 HG2 LYS 118 HG2 LYS 118 -6.274 12.773 16.857 702 HG3 LYS 118 HG3 LYS 118 -4.589 12.368 17.064 703 HD2 LYS 118 HD2 LYS 118 -5.956 13.544 14.666 704 HD3 LYS 118 HD3 LYS 118 -4.574 14.152 15.570 705 HE2 LYS 118 HE2 LYS 118 -3.394 13.311 13.860 706 HE3 LYS 118 HE3 LYS 118 -3.588 11.797 14.733 707 HZ1 LYS 118 HZ1 LYS 118 -4.837 10.960 13.119 708 HZ2 LYS 118 HZ2 LYS 118 -4.384 12.276 12.163 709 HZ3 LYS 118 HZ3 LYS 118 -5.822 12.333 13.043 710 H GLY 119 H GLY 119 -2.667 10.264 14.751 711 HA2 GLY 119 HA2 GLY 119 -3.572 8.354 12.761 712 HA3 GLY 119 HA3 GLY 119 -2.337 9.570 12.559 713 H ARG 120 H ARG 120 -1.720 7.677 11.498 714 HA ARG 120 HA ARG 120 -0.137 5.824 13.179 715 HB2 ARG 120 HB2 ARG 120 -1.611 5.407 10.795 716 HB3 ARG 120 HB3 ARG 120 0.004 4.719 10.650 717 HG2 ARG 120 HG2 ARG 120 -0.554 3.012 11.976 718 HG3 ARG 120 HG3 ARG 120 -1.081 4.138 13.237 719 HD2 ARG 120 HD2 ARG 120 -2.699 2.374 11.882 720 HD3 ARG 120 HD3 ARG 120 -3.241 3.780 12.792 721 HE ARG 120 HE ARG 120 -3.768 4.827 10.825 722 HH11 ARG 120 HH11 ARG 120 -1.868 1.980 10.118 723 HH12 ARG 120 HH12 ARG 120 -2.134 2.082 8.410 724 HH21 ARG 120 HH21 ARG 120 -4.116 4.954 8.589 725 HH22 ARG 120 HH22 ARG 120 -3.407 3.771 7.541 726 H CYS 121 H CYS 121 1.915 5.347 13.056 727 HA CYS 121 HA CYS 121 3.651 7.209 11.582 728 HB2 CYS 121 HB2 CYS 121 3.604 6.232 14.306 729 HB3 CYS 121 HB3 CYS 121 5.115 5.748 13.543 730 H PHE 122 H PHE 122 5.870 6.183 11.101 731 HA PHE 122 HA PHE 122 5.878 3.330 10.650 732 HB2 PHE 122 HB2 PHE 122 5.919 5.218 8.274 733 HB3 PHE 122 HB3 PHE 122 6.115 3.469 8.209 734 HD1 PHE 122 HD1 PHE 122 3.709 6.148 9.143 735 HD2 PHE 122 HD2 PHE 122 4.256 2.066 8.045 736 HE1 PHE 122 HE1 PHE 122 1.268 5.872 8.985 737 HE2 PHE 122 HE2 PHE 122 1.816 1.782 7.883 738 HZ PHE 122 HZ PHE 122 0.317 3.685 8.355 739 H GLY 123 H GLY 123 7.544 4.593 12.272 740 HA2 GLY 123 HA2 GLY 123 10.006 3.926 12.102 741 HA3 GLY 123 HA3 GLY 123 10.031 5.078 10.771 742 HA PRO 124 HA PRO 124 10.834 7.682 14.401 743 HB2 PRO 124 HB2 PRO 124 13.104 8.865 13.432 744 HB3 PRO 124 HB3 PRO 124 13.100 7.309 14.262 745 HG2 PRO 124 HG2 PRO 124 13.628 7.877 11.465 746 HG3 PRO 124 HG3 PRO 124 13.829 6.355 12.346 747 HD2 PRO 124 HD2 PRO 124 11.631 7.219 10.603 748 HD3 PRO 124 HD3 PRO 124 12.033 5.588 11.181 749 H SER 125 H SER 125 12.003 9.188 11.385 750 HA SER 125 HA SER 125 10.368 11.544 11.951 751 HB2 SER 125 HB2 SER 125 12.757 10.979 10.238 752 HB3 SER 125 HB3 SER 125 11.704 12.319 9.760 753 HG SER 125 HG SER 125 12.213 13.377 11.575 754 H ILE 126 H ILE 126 8.829 9.351 11.283 755 HA ILE 126 HA ILE 126 7.773 10.184 8.693 756 HB ILE 126 HB ILE 126 8.626 7.400 9.454 757 HG12 ILE 126 HG12 ILE 126 9.331 8.295 6.804 758 HG13 ILE 126 HG13 ILE 126 9.880 9.447 8.009 759 HG21 ILE 126 HG21 ILE 126 6.306 7.872 8.123 760 HG22 ILE 126 HG22 ILE 126 7.287 6.415 7.980 761 HG23 ILE 126 HG23 ILE 126 7.462 7.713 6.803 762 HD11 ILE 126 HD11 ILE 126 11.092 7.049 7.247 763 HD12 ILE 126 HD12 ILE 126 10.482 6.796 8.880 764 HD13 ILE 126 HD13 ILE 126 11.576 8.138 8.545 765 H CYS 127 H CYS 127 5.677 10.729 9.064 766 HA CYS 127 HA CYS 127 3.936 8.834 10.423 767 HB2 CYS 127 HB2 CYS 127 4.393 10.066 12.353 768 HB3 CYS 127 HB3 CYS 127 4.516 11.581 11.481 769 H CYS 128 H CYS 128 2.137 8.601 9.303 770 HA CYS 128 HA CYS 128 1.150 10.818 7.589 771 HB2 CYS 128 HB2 CYS 128 2.316 8.561 6.658 772 HB3 CYS 128 HB3 CYS 128 0.669 8.008 6.833 773 H GLY 129 H GLY 129 -1.361 10.943 7.385 774 HA2 GLY 129 HA2 GLY 129 -2.649 8.839 8.835 775 HA3 GLY 129 HA3 GLY 129 -2.926 10.517 9.279 776 H ASP 130 H ASP 130 -5.088 9.627 8.629 777 HA ASP 130 HA ASP 130 -5.840 9.373 5.925 778 HB2 ASP 130 HB2 ASP 130 -7.000 8.318 7.946 779 HB3 ASP 130 HB3 ASP 130 -7.742 9.896 8.186 780 H GLU 131 H GLU 131 -5.956 11.780 8.238 781 HA GLU 131 HA GLU 131 -6.748 13.736 6.138 782 HB2 GLU 131 HB2 GLU 131 -7.847 15.060 8.161 783 HB3 GLU 131 HB3 GLU 131 -8.767 13.900 7.227 784 HG2 GLU 131 HG2 GLU 131 -8.734 12.336 8.925 785 HG3 GLU 131 HG3 GLU 131 -7.308 13.041 9.685 786 H LEU 132 H LEU 132 -4.288 12.912 7.258 787 HA LEU 132 HA LEU 132 -3.328 15.452 8.254 788 HB2 LEU 132 HB2 LEU 132 -3.444 12.904 9.464 789 HB3 LEU 132 HB3 LEU 132 -1.787 13.225 9.089 790 HG LEU 132 HG LEU 132 -3.591 14.977 10.751 791 HD11 LEU 132 HD11 LEU 132 -3.084 13.072 12.082 792 HD12 LEU 132 HD12 LEU 132 -1.999 14.342 12.598 793 HD13 LEU 132 HD13 LEU 132 -1.409 13.065 11.553 794 HD21 LEU 132 HD21 LEU 132 -2.162 16.593 10.182 795 HD22 LEU 132 HD22 LEU 132 -0.989 15.454 9.525 796 HD23 LEU 132 HD23 LEU 132 -1.024 15.781 11.256 797 H GLY 133 H GLY 133 -2.826 12.497 6.526 798 HA2 GLY 133 HA2 GLY 133 -1.714 12.063 4.556 799 HA3 GLY 133 HA3 GLY 133 -1.237 13.721 4.586 800 H CYS 134 H CYS 134 1.075 13.007 4.008 801 HA CYS 134 HA CYS 134 2.319 11.488 6.126 802 HB2 CYS 134 HB2 CYS 134 2.769 11.883 3.289 803 HB3 CYS 134 HB3 CYS 134 4.158 11.523 4.267 804 H PHE 135 H PHE 135 3.747 12.397 7.567 805 HA PHE 135 HA PHE 135 5.063 14.838 6.651 806 HB2 PHE 135 HB2 PHE 135 5.131 14.846 9.459 807 HB3 PHE 135 HB3 PHE 135 4.275 15.983 8.437 808 HD1 PHE 135 HD1 PHE 135 2.045 14.398 7.448 809 HD2 PHE 135 HD2 PHE 135 3.856 14.483 11.278 810 HE1 PHE 135 HE1 PHE 135 -0.055 13.635 8.443 811 HE2 PHE 135 HE2 PHE 135 1.749 13.733 12.296 812 HZ PHE 135 HZ PHE 135 -0.200 13.304 10.868 813 H VAL 136 H VAL 136 6.985 14.034 6.168 814 HA VAL 136 HA VAL 136 7.993 11.813 7.721 815 HB VAL 136 HB VAL 136 9.523 12.989 5.439 816 HG11 VAL 136 HG11 VAL 136 10.403 10.879 5.211 817 HG12 VAL 136 HG12 VAL 136 9.046 10.102 6.031 818 HG13 VAL 136 HG13 VAL 136 10.231 11.026 6.952 819 HG21 VAL 136 HG21 VAL 136 7.494 10.918 4.800 820 HG22 VAL 136 HG22 VAL 136 8.180 12.139 3.764 821 HG23 VAL 136 HG23 VAL 136 6.924 12.569 4.921 822 H GLY 137 H GLY 137 8.442 12.715 9.618 823 HA2 GLY 137 HA2 GLY 137 10.095 13.444 11.117 824 HA3 GLY 137 HA3 GLY 137 10.964 14.177 9.776 825 H THR 138 H THR 138 8.397 14.565 12.090 826 HA THR 138 HA THR 138 8.634 17.448 11.943 827 HB THR 138 HB THR 138 6.150 17.736 11.750 828 HG1 THR 138 HG1 THR 138 6.106 15.145 12.031 829 HG21 THR 138 HG21 THR 138 7.287 18.191 9.743 830 HG22 THR 138 HG22 THR 138 5.943 17.135 9.318 831 HG23 THR 138 HG23 THR 138 7.575 16.480 9.430 832 H ALA 139 H ALA 139 7.157 18.463 13.671 833 HA ALA 139 HA ALA 139 7.698 17.263 16.151 834 HB1 ALA 139 HB1 ALA 139 7.260 19.673 15.903 835 HB2 ALA 139 HB2 ALA 139 6.212 18.959 17.127 836 HB3 ALA 139 HB3 ALA 139 5.572 19.331 15.525 837 H GLU 140 H GLU 140 4.842 17.255 14.090 838 HA GLU 140 HA GLU 140 3.035 15.903 15.719 839 HB2 GLU 140 HB2 GLU 140 3.188 15.441 12.751 840 HB3 GLU 140 HB3 GLU 140 1.762 15.548 13.761 841 HG2 GLU 140 HG2 GLU 140 3.550 17.899 13.266 842 HG3 GLU 140 HG3 GLU 140 2.206 17.488 12.207 843 H ALA 141 H ALA 141 5.633 14.770 13.746 844 HA ALA 141 HA ALA 141 5.001 12.010 14.041 845 HB1 ALA 141 HB1 ALA 141 6.044 12.504 12.003 846 HB2 ALA 141 HB2 ALA 141 7.301 11.718 12.955 847 HB3 ALA 141 HB3 ALA 141 7.295 13.470 12.774 848 H LEU 142 H LEU 142 7.363 14.306 15.465 849 HA LEU 142 HA LEU 142 9.028 12.743 16.790 850 HB2 LEU 142 HB2 LEU 142 7.728 15.294 17.395 851 HB3 LEU 142 HB3 LEU 142 8.321 14.462 18.819 852 HG LEU 142 HG LEU 142 10.267 14.562 16.625 853 HD11 LEU 142 HD11 LEU 142 9.085 17.074 17.733 854 HD12 LEU 142 HD12 LEU 142 9.567 16.694 16.080 855 HD13 LEU 142 HD13 LEU 142 10.794 17.011 17.306 856 HD21 LEU 142 HD21 LEU 142 10.521 13.897 19.114 857 HD22 LEU 142 HD22 LEU 142 10.613 15.637 19.395 858 HD23 LEU 142 HD23 LEU 142 11.789 14.850 18.343 859 H ARG 143 H ARG 143 5.616 12.952 17.524 860 HA ARG 143 HA ARG 143 5.530 11.695 20.019 861 HB2 ARG 143 HB2 ARG 143 3.611 11.023 17.798 862 HB3 ARG 143 HB3 ARG 143 3.284 11.111 19.521 863 HG2 ARG 143 HG2 ARG 143 4.004 13.523 17.880 864 HG3 ARG 143 HG3 ARG 143 2.346 12.967 18.101 865 HD2 ARG 143 HD2 ARG 143 3.733 13.107 20.623 866 HD3 ARG 143 HD3 ARG 143 3.809 14.650 19.780 867 HE ARG 143 HE ARG 143 1.451 14.773 19.837 868 HH11 ARG 143 HH11 ARG 143 2.695 11.982 21.540 869 HH12 ARG 143 HH12 ARG 143 1.232 11.722 22.425 870 HH21 ARG 143 HH21 ARG 143 -0.469 14.419 21.000 871 HH22 ARG 143 HH22 ARG 143 -0.562 13.100 22.119 872 H CYS 144 H CYS 144 6.146 10.615 16.863 873 HA CYS 144 HA CYS 144 5.755 7.964 16.718 874 HB2 CYS 144 HB2 CYS 144 7.254 9.735 15.294 875 HB3 CYS 144 HB3 CYS 144 8.466 8.582 15.823 876 H GLN 145 H GLN 145 7.673 9.125 19.267 877 HA GLN 145 HA GLN 145 9.253 6.662 19.442 878 HB2 GLN 145 HB2 GLN 145 9.522 9.261 20.587 879 HB3 GLN 145 HB3 GLN 145 9.347 8.110 21.905 880 HG2 GLN 145 HG2 GLN 145 11.143 6.757 20.571 881 HG3 GLN 145 HG3 GLN 145 11.493 8.327 19.849 882 HE21 GLN 145 HE21 GLN 145 11.189 6.649 22.938 883 HE22 GLN 145 HE22 GLN 145 12.330 7.629 23.788 884 H GLU 146 H GLU 146 6.161 7.508 19.887 885 HA GLU 146 HA GLU 146 5.672 6.108 22.354 886 HB2 GLU 146 HB2 GLU 146 4.324 8.109 21.145 887 HB3 GLU 146 HB3 GLU 146 3.431 6.736 20.505 888 HG2 GLU 146 HG2 GLU 146 2.978 5.964 22.777 889 HG3 GLU 146 HG3 GLU 146 3.878 7.335 23.423 890 H GLU 147 H GLU 147 6.761 5.002 19.605 891 HA GLU 147 HA GLU 147 4.863 2.939 19.005 892 HB2 GLU 147 HB2 GLU 147 6.584 3.884 17.386 893 HB3 GLU 147 HB3 GLU 147 7.779 2.952 18.277 894 HG2 GLU 147 HG2 GLU 147 5.482 1.359 17.493 895 HG3 GLU 147 HG3 GLU 147 6.309 2.085 16.117 896 H ASN 148 H ASN 148 6.605 3.512 21.683 897 HA ASN 148 HA ASN 148 7.349 0.712 22.110 898 HB2 ASN 148 HB2 ASN 148 7.986 3.237 23.628 899 HB3 ASN 148 HB3 ASN 148 8.335 1.635 24.271 900 HD21 ASN 148 HD21 ASN 148 9.828 4.099 23.007 901 HD22 ASN 148 HD22 ASN 148 11.040 3.326 22.049 902 H TYR 149 H TYR 149 5.010 3.091 23.064 903 HA TYR 149 HA TYR 149 3.620 1.095 24.728 904 HB2 TYR 149 HB2 TYR 149 4.987 2.659 26.164 905 HB3 TYR 149 HB3 TYR 149 3.961 3.973 25.596 906 HD1 TYR 149 HD1 TYR 149 3.629 0.570 27.115 907 HD2 TYR 149 HD2 TYR 149 2.143 4.551 26.896 908 HE1 TYR 149 HE1 TYR 149 1.980 0.045 28.861 909 HE2 TYR 149 HE2 TYR 149 0.490 4.037 28.642 910 HH TYR 149 HH TYR 149 0.152 2.451 30.450 911 H LEU 150 H LEU 150 2.621 1.406 22.263 912 HA LEU 150 HA LEU 150 0.417 3.353 22.603 913 HB2 LEU 150 HB2 LEU 150 0.356 3.067 19.981 914 HB3 LEU 150 HB3 LEU 150 1.422 4.214 20.765 915 HG LEU 150 HG LEU 150 3.280 2.576 20.564 916 HD11 LEU 150 HD11 LEU 150 2.820 0.759 18.789 917 HD12 LEU 150 HD12 LEU 150 1.144 0.931 19.298 918 HD13 LEU 150 HD13 LEU 150 2.377 0.463 20.468 919 HD21 LEU 150 HD21 LEU 150 2.875 2.604 17.828 920 HD22 LEU 150 HD22 LEU 150 3.653 3.862 18.778 921 HD23 LEU 150 HD23 LEU 150 1.946 3.967 18.413 922 HA PRO 151 HA PRO 151 -2.044 -0.427 22.141 923 HB2 PRO 151 HB2 PRO 151 -3.667 0.014 24.201 924 HB3 PRO 151 HB3 PRO 151 -1.980 -0.440 24.461 925 HG2 PRO 151 HG2 PRO 151 -3.302 2.171 24.860 926 HG3 PRO 151 HG3 PRO 151 -1.834 1.528 25.613 927 HD2 PRO 151 HD2 PRO 151 -2.065 3.304 23.335 928 HD3 PRO 151 HD3 PRO 151 -0.595 2.753 24.164 929 H SER 152 H SER 152 -2.584 1.614 20.255 930 HA SER 152 HA SER 152 -5.518 1.893 20.497 931 HB2 SER 152 HB2 SER 152 -4.126 4.044 20.572 932 HB3 SER 152 HB3 SER 152 -3.771 3.749 18.871 933 HG SER 152 HG SER 152 -5.576 5.084 19.055 934 HA PRO 153 HA PRO 153 -3.971 -0.724 16.693 935 HB2 PRO 153 HB2 PRO 153 -5.594 -2.858 17.391 936 HB3 PRO 153 HB3 PRO 153 -3.871 -2.752 17.672 937 HG2 PRO 153 HG2 PRO 153 -6.109 -2.148 19.541 938 HG3 PRO 153 HG3 PRO 153 -4.564 -2.960 19.859 939 HD2 PRO 153 HD2 PRO 153 -4.954 -0.444 20.591 940 HD3 PRO 153 HD3 PRO 153 -3.394 -0.947 19.902 941 H CYS 154 H CYS 154 -5.275 -1.680 14.919 942 HA CYS 154 HA CYS 154 -7.872 -1.892 14.471 943 HB2 CYS 154 HB2 CYS 154 -8.591 0.391 13.570 944 HB3 CYS 154 HB3 CYS 154 -8.527 0.188 15.313 945 H GLN 155 H GLN 155 -6.355 -3.260 12.754 946 HA GLN 155 HA GLN 155 -5.665 -3.502 10.588 947 HB2 GLN 155 HB2 GLN 155 -8.214 -2.587 10.544 948 HB3 GLN 155 HB3 GLN 155 -7.419 -1.374 9.547 949 HG2 GLN 155 HG2 GLN 155 -6.382 -3.552 8.427 950 HG3 GLN 155 HG3 GLN 155 -7.882 -4.248 9.034 951 HE21 GLN 155 HE21 GLN 155 -9.880 -3.295 8.347 952 HE22 GLN 155 HE22 GLN 155 -9.980 -2.488 6.823 953 H SER 156 H SER 156 -5.222 -2.060 8.396 954 HA SER 156 HA SER 156 -4.087 0.490 8.887 955 HB2 SER 156 HB2 SER 156 -2.195 -1.846 8.725 956 HB3 SER 156 HB3 SER 156 -1.701 -0.165 8.503 957 HG SER 156 HG SER 156 -2.708 0.215 10.602 958 H GLY 157 H GLY 157 -1.852 -0.441 6.734 959 HA2 GLY 157 HA2 GLY 157 -3.578 -0.636 4.431 960 HA3 GLY 157 HA3 GLY 157 -2.595 0.830 4.563 961 H GLN 158 H GLN 158 -2.615 -2.034 3.063 962 HA GLN 158 HA GLN 158 0.295 -2.388 3.426 963 HB2 GLN 158 HB2 GLN 158 -0.191 -4.661 2.384 964 HB3 GLN 158 HB3 GLN 158 -0.854 -4.405 3.992 965 HG2 GLN 158 HG2 GLN 158 -3.023 -4.313 3.241 966 HG3 GLN 158 HG3 GLN 158 -2.553 -3.794 1.624 967 HE21 GLN 158 HE21 GLN 158 -4.142 -6.112 2.919 968 HE22 GLN 158 HE22 GLN 158 -3.584 -7.495 2.047 969 H LYS 159 H LYS 159 0.168 -0.444 2.021 970 HA LYS 159 HA LYS 159 0.204 -1.239 -0.795 971 HB2 LYS 159 HB2 LYS 159 -1.300 0.725 0.172 972 HB3 LYS 159 HB3 LYS 159 0.154 1.624 -0.236 973 HG2 LYS 159 HG2 LYS 159 -1.186 1.749 -2.142 974 HG3 LYS 159 HG3 LYS 159 0.012 0.508 -2.512 975 HD2 LYS 159 HD2 LYS 159 -2.139 -0.831 -1.295 976 HD3 LYS 159 HD3 LYS 159 -2.858 0.312 -2.431 977 HE2 LYS 159 HE2 LYS 159 -2.445 -1.202 -4.018 978 HE3 LYS 159 HE3 LYS 159 -0.745 -0.769 -3.843 979 HZ1 LYS 159 HZ1 LYS 159 -2.152 -2.965 -2.424 980 HZ2 LYS 159 HZ2 LYS 159 -0.541 -2.521 -2.160 981 HZ3 LYS 159 HZ3 LYS 159 -1.013 -3.139 -3.663 982 HA PRO 160 HA PRO 160 4.520 -0.423 0.825 983 HB2 PRO 160 HB2 PRO 160 5.687 -2.383 -0.760 984 HB3 PRO 160 HB3 PRO 160 5.232 -2.560 0.938 985 HG2 PRO 160 HG2 PRO 160 3.706 -3.336 -1.525 986 HG3 PRO 160 HG3 PRO 160 3.896 -4.222 0.003 987 HD2 PRO 160 HD2 PRO 160 1.650 -2.892 -0.487 988 HD3 PRO 160 HD3 PRO 160 2.376 -2.838 1.127 989 H CYS 161 H CYS 161 4.399 1.530 -0.240 990 HA CYS 161 HA CYS 161 5.446 1.664 -2.986 991 HB2 CYS 161 HB2 CYS 161 4.792 4.143 -1.455 992 HB3 CYS 161 HB3 CYS 161 4.554 3.797 -3.159 993 H GLY 162 H GLY 162 7.010 3.826 -2.973 994 HA2 GLY 162 HA2 GLY 162 9.104 4.568 -2.439 995 HA3 GLY 162 HA3 GLY 162 8.477 4.545 -0.801 996 H SER 163 H SER 163 10.783 4.193 -0.397 997 HA SER 163 HA SER 163 11.880 1.583 -0.992 998 HB2 SER 163 HB2 SER 163 13.219 3.751 -0.925 999 HB3 SER 163 HB3 SER 163 13.102 3.652 0.832 1000 HG SER 163 HG SER 163 14.101 1.543 -0.773 1001 H GLY 164 H GLY 164 9.829 0.906 0.159 1002 HA2 GLY 164 HA2 GLY 164 9.554 -0.878 1.726 1003 HA3 GLY 164 HA3 GLY 164 10.509 0.026 2.879 1004 H GLY 165 H GLY 165 8.129 2.103 1.377 1005 HA2 GLY 165 HA2 GLY 165 6.702 1.836 3.935 1006 HA3 GLY 165 HA3 GLY 165 6.688 3.237 2.904 1007 H ARG 166 H ARG 166 4.610 1.547 4.201 1008 HA ARG 166 HA ARG 166 3.075 0.738 1.871 1009 HB2 ARG 166 HB2 ARG 166 1.421 -0.030 3.772 1010 HB3 ARG 166 HB3 ARG 166 2.790 -1.031 3.302 1011 HG2 ARG 166 HG2 ARG 166 3.083 0.962 5.518 1012 HG3 ARG 166 HG3 ARG 166 2.287 -0.585 5.813 1013 HD2 ARG 166 HD2 ARG 166 4.981 -0.407 4.509 1014 HD3 ARG 166 HD3 ARG 166 4.793 -0.447 6.263 1015 HE ARG 166 HE ARG 166 3.367 -2.569 5.031 1016 HH11 ARG 166 HH11 ARG 166 6.585 -1.558 5.924 1017 HH12 ARG 166 HH12 ARG 166 7.185 -3.175 6.074 1018 HH21 ARG 166 HH21 ARG 166 4.149 -4.691 5.224 1019 HH22 ARG 166 HH22 ARG 166 5.800 -4.958 5.675 1020 H CYS 167 H CYS 167 0.819 1.498 1.626 1021 HA CYS 167 HA CYS 167 0.549 4.156 1.610 1022 HB2 CYS 167 HB2 CYS 167 -1.035 2.290 0.715 1023 HB3 CYS 167 HB3 CYS 167 -1.881 2.530 2.230 1024 H ALA 168 H ALA 168 0.813 5.539 3.213 1025 HA ALA 168 HA ALA 168 -0.400 4.844 5.798 1026 HB1 ALA 168 HB1 ALA 168 2.018 5.433 5.786 1027 HB2 ALA 168 HB2 ALA 168 1.032 6.456 6.816 1028 HB3 ALA 168 HB3 ALA 168 1.584 7.055 5.250 1029 H ALA 169 H ALA 169 -0.743 6.564 3.016 1030 HA ALA 169 HA ALA 169 -3.285 7.728 3.786 1031 HB1 ALA 169 HB1 ALA 169 -1.197 9.789 3.131 1032 HB2 ALA 169 HB2 ALA 169 -1.667 9.365 4.777 1033 HB3 ALA 169 HB3 ALA 169 -2.855 10.039 3.667 1034 H ALA 170 H ALA 170 -4.329 8.937 1.975 1035 HA ALA 170 HA ALA 170 -3.814 7.610 -0.498 1036 HB1 ALA 170 HB1 ALA 170 -5.641 9.100 -1.387 1037 HB2 ALA 170 HB2 ALA 170 -5.795 9.723 0.261 1038 HB3 ALA 170 HB3 ALA 170 -6.079 8.013 -0.067 1039 H GLY 171 H GLY 171 -1.628 8.362 -0.735 1040 HA2 GLY 171 HA2 GLY 171 -1.260 10.029 -2.845 1041 HA3 GLY 171 HA3 GLY 171 -1.127 11.083 -1.456 1042 H ILE 172 H ILE 172 0.138 9.776 0.350 1043 HA ILE 172 HA ILE 172 2.766 9.057 -0.795 1044 HB ILE 172 HB ILE 172 3.326 10.170 1.646 1045 HG12 ILE 172 HG12 ILE 172 2.141 12.384 1.561 1046 HG13 ILE 172 HG13 ILE 172 1.082 11.726 0.316 1047 HG21 ILE 172 HG21 ILE 172 3.349 11.291 -1.144 1048 HG22 ILE 172 HG22 ILE 172 4.675 10.566 -0.245 1049 HG23 ILE 172 HG23 ILE 172 4.055 12.141 0.230 1050 HD11 ILE 172 HD11 ILE 172 1.086 9.852 2.305 1051 HD12 ILE 172 HD12 ILE 172 -0.221 10.980 1.914 1052 HD13 ILE 172 HD13 ILE 172 0.965 11.390 3.151 1053 H CYS 173 H CYS 173 3.880 7.433 0.039 1054 HA CYS 173 HA CYS 173 2.592 5.875 2.159 1055 HB2 CYS 173 HB2 CYS 173 4.435 4.812 0.023 1056 HB3 CYS 173 HB3 CYS 173 3.547 3.883 1.222 1057 H CYS 174 H CYS 174 3.551 6.053 4.005 1058 HA CYS 174 HA CYS 174 6.260 6.948 4.198 1059 HB2 CYS 174 HB2 CYS 174 4.144 6.247 6.212 1060 HB3 CYS 174 HB3 CYS 174 5.783 6.662 6.688 1061 H SER 175 H SER 175 7.978 5.923 4.972 1062 HA SER 175 HA SER 175 7.886 3.012 5.403 1063 HB2 SER 175 HB2 SER 175 9.730 2.703 3.875 1064 HB3 SER 175 HB3 SER 175 8.548 3.683 3.023 1065 HG SER 175 HG SER 175 11.067 4.364 3.906 1066 HA PRO 176 HA PRO 176 10.907 4.031 8.513 1067 HB2 PRO 176 HB2 PRO 176 12.966 2.299 8.277 1068 HB3 PRO 176 HB3 PRO 176 11.366 1.776 8.815 1069 HG2 PRO 176 HG2 PRO 176 12.653 1.494 6.139 1070 HG3 PRO 176 HG3 PRO 176 11.613 0.354 7.010 1071 HD2 PRO 176 HD2 PRO 176 10.762 2.002 4.971 1072 HD3 PRO 176 HD3 PRO 176 9.698 1.316 6.211 1073 H ASP 177 H ASP 177 11.101 5.293 5.814 1074 HA ASP 177 HA ASP 177 13.731 6.483 6.122 1075 HB2 ASP 177 HB2 ASP 177 12.704 5.193 3.594 1076 HB3 ASP 177 HB3 ASP 177 13.998 6.388 3.586 1077 H GLY 178 H GLY 178 10.601 6.598 4.338 1078 HA2 GLY 178 HA2 GLY 178 10.214 9.276 5.069 1079 HA3 GLY 178 HA3 GLY 178 10.763 9.240 3.433 1080 H CYS 179 H CYS 179 8.863 10.200 2.760 1081 HA CYS 179 HA CYS 179 6.703 8.327 2.353 1082 HB2 CYS 179 HB2 CYS 179 6.071 11.113 3.349 1083 HB3 CYS 179 HB3 CYS 179 4.952 9.768 3.129 1084 H HIS 180 H HIS 180 5.796 8.447 0.388 1085 HA HIS 180 HA HIS 180 6.650 10.500 -1.532 1086 HB2 HIS 180 HB2 HIS 180 8.005 7.938 -1.113 1087 HB3 HIS 180 HB3 HIS 180 7.401 8.097 -2.756 1088 HD1 HIS 180 HD1 HIS 180 9.265 10.417 -0.383 1089 HD2 HIS 180 HD2 HIS 180 9.334 9.137 -4.333 1090 HE1 HIS 180 HE1 HIS 180 11.185 11.632 -1.445 1091 HE2 HIS 180 HE2 HIS 180 11.112 10.962 -3.873 1092 H GLU 181 H GLU 181 5.380 10.769 -3.026 1093 HA GLU 181 HA GLU 181 2.832 9.955 -3.200 1094 HB2 GLU 181 HB2 GLU 181 2.817 10.851 -5.467 1095 HB3 GLU 181 HB3 GLU 181 3.790 11.871 -4.411 1096 HG2 GLU 181 HG2 GLU 181 5.594 11.578 -5.668 1097 HG3 GLU 181 HG3 GLU 181 5.405 9.826 -5.641 1098 H ASP 182 H ASP 182 1.701 8.408 -4.197 1099 HA ASP 182 HA ASP 182 3.125 6.434 -5.800 1100 HB2 ASP 182 HB2 ASP 182 2.570 4.611 -4.385 1101 HB3 ASP 182 HB3 ASP 182 3.182 5.878 -3.289 1102 HA PRO 183 HA PRO 183 -0.529 6.843 -8.260 1103 HB2 PRO 183 HB2 PRO 183 -0.063 3.996 -8.964 1104 HB3 PRO 183 HB3 PRO 183 -0.247 5.404 -10.009 1105 HG2 PRO 183 HG2 PRO 183 2.151 4.327 -9.622 1106 HG3 PRO 183 HG3 PRO 183 1.955 6.089 -9.701 1107 HD2 PRO 183 HD2 PRO 183 2.326 4.326 -7.310 1108 HD3 PRO 183 HD3 PRO 183 3.009 5.931 -7.647 1109 H ALA 184 H ALA 184 -0.265 3.928 -6.264 1110 HA ALA 184 HA ALA 184 -2.979 3.176 -6.449 1111 HB1 ALA 184 HB1 ALA 184 -1.230 1.629 -5.670 1112 HB2 ALA 184 HB2 ALA 184 -2.542 1.771 -4.499 1113 HB3 ALA 184 HB3 ALA 184 -1.019 2.616 -4.223 1114 H CYS 185 H CYS 185 -1.131 4.923 -4.040 1115 HA CYS 185 HA CYS 185 -3.618 6.004 -2.918 1116 HB2 CYS 185 HB2 CYS 185 -0.914 6.613 -1.770 1117 HB3 CYS 185 HB3 CYS 185 -2.461 6.530 -0.957 1118 H ASP 186 H ASP 186 -3.869 7.226 -4.932 1119 HA ASP 186 HA ASP 186 -2.143 9.634 -4.791 1120 HB2 ASP 186 HB2 ASP 186 -1.953 7.856 -6.846 1121 HB3 ASP 186 HB3 ASP 186 -3.184 8.962 -7.454 1122 HA PRO 187 HA PRO 187 -6.358 10.975 -6.234 1123 HB2 PRO 187 HB2 PRO 187 -8.100 8.971 -7.109 1124 HB3 PRO 187 HB3 PRO 187 -7.073 9.978 -8.130 1125 HG2 PRO 187 HG2 PRO 187 -6.847 7.193 -7.731 1126 HG3 PRO 187 HG3 PRO 187 -5.682 8.246 -8.550 1127 HD2 PRO 187 HD2 PRO 187 -5.672 7.213 -5.759 1128 HD3 PRO 187 HD3 PRO 187 -4.310 7.577 -6.837 1129 H GLU 188 H GLU 188 -8.472 11.166 -5.564 1130 HA GLU 188 HA GLU 188 -9.083 10.553 -2.881 1131 HB2 GLU 188 HB2 GLU 188 -11.079 11.906 -3.400 1132 HB3 GLU 188 HB3 GLU 188 -9.627 12.707 -3.995 1133 HG2 GLU 188 HG2 GLU 188 -10.097 12.147 -6.233 1134 HG3 GLU 188 HG3 GLU 188 -11.288 10.938 -5.769 1135 H ALA 189 H ALA 189 -8.971 8.466 -5.106 1136 HA ALA 189 HA ALA 189 -11.503 7.345 -5.580 1137 HB1 ALA 189 HB1 ALA 189 -8.596 6.578 -5.798 1138 HB2 ALA 189 HB2 ALA 189 -9.884 6.625 -7.048 1139 HB3 ALA 189 HB3 ALA 189 -9.845 5.299 -5.883 1140 H ALA 190 H ALA 190 -10.967 7.942 -2.650 1141 HA ALA 190 HA ALA 190 -10.526 5.450 -1.357 1142 HB1 ALA 190 HB1 ALA 190 -11.451 8.138 -0.439 1143 HB2 ALA 190 HB2 ALA 190 -9.963 7.276 -0.045 1144 HB3 ALA 190 HB3 ALA 190 -11.498 6.749 0.646 1145 H PHE 191 H PHE 191 -12.074 4.396 0.087 1146 HA PHE 191 HA PHE 191 -14.599 3.926 -1.267 1147 HB2 PHE 191 HB2 PHE 191 -13.914 2.603 1.326 1148 HB3 PHE 191 HB3 PHE 191 -14.731 1.944 -0.084 1149 HD1 PHE 191 HD1 PHE 191 -13.405 1.244 -2.055 1150 HD2 PHE 191 HD2 PHE 191 -11.574 2.433 1.597 1151 HE1 PHE 191 HE1 PHE 191 -11.310 0.165 -2.759 1152 HE2 PHE 191 HE2 PHE 191 -9.476 1.354 0.901 1153 HZ PHE 191 HZ PHE 191 -9.342 0.218 -1.280 1154 H SER 192 H SER 192 -15.107 6.329 -0.576 1155 HA SER 192 HA SER 192 -16.075 6.550 2.154 1156 HB2 SER 192 HB2 SER 192 -16.841 8.847 1.335 1157 HB3 SER 192 HB3 SER 192 -15.102 8.555 1.337 1158 HG SER 192 HG SER 192 -15.082 8.535 -0.800 Start of MODEL 8 1 H1 ALA 1 H1 ALA 1 26.054 32.906 5.106 2 H2 ALA 1 H2 ALA 1 24.692 33.171 6.115 3 H3 ALA 1 H3 ALA 1 25.056 34.276 4.852 4 HA ALA 1 HA ALA 1 24.541 31.459 4.322 5 HB1 ALA 1 HB1 ALA 1 22.163 32.502 3.729 6 HB2 ALA 1 HB2 ALA 1 22.586 33.542 5.088 7 HB3 ALA 1 HB3 ALA 1 22.532 31.793 5.300 8 H VAL 2 H VAL 2 23.030 31.673 2.275 9 HA VAL 2 HA VAL 2 23.512 33.568 0.304 10 HB VAL 2 HB VAL 2 24.971 32.051 -1.163 11 HG11 VAL 2 HG11 VAL 2 26.753 33.331 -0.688 12 HG12 VAL 2 HG12 VAL 2 26.727 32.921 1.026 13 HG13 VAL 2 HG13 VAL 2 25.630 34.151 0.395 14 HG21 VAL 2 HG21 VAL 2 24.835 30.417 1.165 15 HG22 VAL 2 HG22 VAL 2 26.512 30.912 0.932 16 HG23 VAL 2 HG23 VAL 2 25.647 30.092 -0.366 17 H LEU 3 H LEU 3 21.350 33.217 -0.567 18 HA LEU 3 HA LEU 3 20.172 30.713 -0.714 19 HB2 LEU 3 HB2 LEU 3 19.697 33.483 -1.626 20 HB3 LEU 3 HB3 LEU 3 18.859 32.237 -2.526 21 HG LEU 3 HG LEU 3 17.531 33.255 -0.705 22 HD11 LEU 3 HD11 LEU 3 17.160 30.949 -1.603 23 HD12 LEU 3 HD12 LEU 3 16.551 31.224 0.029 24 HD13 LEU 3 HD13 LEU 3 18.062 30.347 -0.216 25 HD21 LEU 3 HD21 LEU 3 19.864 32.462 0.852 26 HD22 LEU 3 HD22 LEU 3 18.326 31.995 1.575 27 HD23 LEU 3 HD23 LEU 3 18.637 33.684 1.178 28 H ASP 4 H ASP 4 20.337 29.209 -2.104 29 HA ASP 4 HA ASP 4 21.625 29.562 -4.704 30 HB2 ASP 4 HB2 ASP 4 21.307 27.247 -2.878 31 HB3 ASP 4 HB3 ASP 4 21.102 26.902 -4.589 32 H LEU 5 H LEU 5 19.981 30.695 -5.544 33 HA LEU 5 HA LEU 5 17.858 29.294 -6.654 34 HB2 LEU 5 HB2 LEU 5 17.217 29.968 -4.329 35 HB3 LEU 5 HB3 LEU 5 17.195 31.603 -4.922 36 HG LEU 5 HG LEU 5 14.954 30.523 -4.832 37 HD11 LEU 5 HD11 LEU 5 15.370 32.300 -6.479 38 HD12 LEU 5 HD12 LEU 5 14.146 31.159 -6.991 39 HD13 LEU 5 HD13 LEU 5 15.769 31.073 -7.673 40 HD21 LEU 5 HD21 LEU 5 14.651 28.433 -5.494 41 HD22 LEU 5 HD22 LEU 5 16.339 28.353 -5.991 42 HD23 LEU 5 HD23 LEU 5 15.106 28.866 -7.141 43 H ASP 6 H ASP 6 17.099 32.322 -6.531 44 HA ASP 6 HA ASP 6 18.787 33.829 -8.257 45 HB2 ASP 6 HB2 ASP 6 17.627 31.897 -9.547 46 HB3 ASP 6 HB3 ASP 6 16.279 33.045 -9.663 47 H VAL 7 H VAL 7 16.286 33.557 -6.573 48 HA VAL 7 HA VAL 7 15.808 36.003 -5.641 49 HB VAL 7 HB VAL 7 14.424 36.313 -7.683 50 HG11 VAL 7 HG11 VAL 7 12.991 33.947 -6.592 51 HG12 VAL 7 HG12 VAL 7 13.386 34.361 -8.256 52 HG13 VAL 7 HG13 VAL 7 12.069 35.190 -7.428 53 HG21 VAL 7 HG21 VAL 7 12.313 36.984 -6.313 54 HG22 VAL 7 HG22 VAL 7 13.859 37.784 -6.031 55 HG23 VAL 7 HG23 VAL 7 13.309 36.516 -4.936 56 H ARG 8 H ARG 8 15.459 35.491 -3.425 57 HA ARG 8 HA ARG 8 14.626 32.817 -2.957 58 HB2 ARG 8 HB2 ARG 8 16.100 33.298 -1.299 59 HB3 ARG 8 HB3 ARG 8 15.844 35.026 -1.415 60 HG2 ARG 8 HG2 ARG 8 13.511 33.831 -0.275 61 HG3 ARG 8 HG3 ARG 8 14.930 33.226 0.564 62 HD2 ARG 8 HD2 ARG 8 15.564 35.326 1.287 63 HD3 ARG 8 HD3 ARG 8 14.657 36.152 0.023 64 HE ARG 8 HE ARG 8 12.631 35.623 1.246 65 HH11 ARG 8 HH11 ARG 8 15.637 35.192 2.965 66 HH12 ARG 8 HH12 ARG 8 14.908 35.314 4.527 67 HH21 ARG 8 HH21 ARG 8 11.664 35.769 3.309 68 HH22 ARG 8 HH22 ARG 8 12.654 35.640 4.725 69 H THR 9 H THR 9 12.400 32.517 -3.268 70 HA THR 9 HA THR 9 10.945 34.686 -1.866 71 HB THR 9 HB THR 9 9.882 34.480 -4.035 72 HG1 THR 9 HG1 THR 9 8.546 33.213 -1.924 73 HG21 THR 9 HG21 THR 9 10.696 31.762 -3.855 74 HG22 THR 9 HG22 THR 9 10.107 32.671 -5.245 75 HG23 THR 9 HG23 THR 9 8.966 31.846 -4.183 76 H CYS 10 H CYS 10 11.382 33.997 0.063 77 HA CYS 10 HA CYS 10 11.472 31.196 0.647 78 HB2 CYS 10 HB2 CYS 10 11.984 33.631 2.185 79 HB3 CYS 10 HB3 CYS 10 11.352 32.298 3.143 80 H LEU 11 H LEU 11 9.254 31.008 -0.361 81 HA LEU 11 HA LEU 11 6.842 31.604 0.621 82 HB2 LEU 11 HB2 LEU 11 7.867 29.623 -1.020 83 HB3 LEU 11 HB3 LEU 11 6.977 28.743 0.209 84 HG LEU 11 HG LEU 11 5.699 31.051 -1.218 85 HD11 LEU 11 HD11 LEU 11 6.143 28.275 -2.235 86 HD12 LEU 11 HD12 LEU 11 6.321 29.813 -3.079 87 HD13 LEU 11 HD13 LEU 11 4.713 29.194 -2.702 88 HD21 LEU 11 HD21 LEU 11 4.186 30.455 0.344 89 HD22 LEU 11 HD22 LEU 11 4.869 28.840 0.543 90 HD23 LEU 11 HD23 LEU 11 3.796 29.183 -0.814 91 HA PRO 12 HA PRO 12 7.102 29.859 4.775 92 HB2 PRO 12 HB2 PRO 12 5.394 31.476 5.988 93 HB3 PRO 12 HB3 PRO 12 6.954 32.090 5.422 94 HG2 PRO 12 HG2 PRO 12 4.240 32.397 4.203 95 HG3 PRO 12 HG3 PRO 12 5.555 33.578 4.318 96 HD2 PRO 12 HD2 PRO 12 4.966 31.991 2.085 97 HD3 PRO 12 HD3 PRO 12 6.482 32.868 2.367 98 H CYS 13 H CYS 13 5.866 28.264 5.811 99 HA CYS 13 HA CYS 13 2.995 28.177 5.199 100 HB2 CYS 13 HB2 CYS 13 3.063 25.894 4.485 101 HB3 CYS 13 HB3 CYS 13 4.219 26.815 3.541 102 H GLY 14 H GLY 14 2.135 25.928 6.244 103 HA2 GLY 14 HA2 GLY 14 1.715 24.724 8.137 104 HA3 GLY 14 HA3 GLY 14 3.283 25.217 8.750 105 HA PRO 15 HA PRO 15 0.061 27.169 11.557 106 HB2 PRO 15 HB2 PRO 15 1.475 26.802 13.791 107 HB3 PRO 15 HB3 PRO 15 0.697 25.390 13.030 108 HG2 PRO 15 HG2 PRO 15 3.361 26.529 12.322 109 HG3 PRO 15 HG3 PRO 15 3.140 24.974 13.212 110 HD2 PRO 15 HD2 PRO 15 3.285 24.743 10.655 111 HD3 PRO 15 HD3 PRO 15 1.726 24.180 11.334 112 H GLY 16 H GLY 16 0.427 29.248 10.823 113 HA2 GLY 16 HA2 GLY 16 1.154 31.411 11.083 114 HA3 GLY 16 HA3 GLY 16 2.398 30.770 12.131 115 H GLY 17 H GLY 17 2.193 29.280 9.240 116 HA2 GLY 17 HA2 GLY 17 3.731 29.182 7.409 117 HA3 GLY 17 HA3 GLY 17 3.448 30.899 7.548 118 H LYS 18 H LYS 18 4.951 28.604 9.637 119 HA LYS 18 HA LYS 18 7.331 30.271 9.905 120 HB2 LYS 18 HB2 LYS 18 7.040 28.023 11.751 121 HB3 LYS 18 HB3 LYS 18 7.522 29.679 12.065 122 HG2 LYS 18 HG2 LYS 18 4.812 29.867 11.547 123 HG3 LYS 18 HG3 LYS 18 4.979 28.383 12.485 124 HD2 LYS 18 HD2 LYS 18 6.614 30.516 13.568 125 HD3 LYS 18 HD3 LYS 18 4.920 31.000 13.445 126 HE2 LYS 18 HE2 LYS 18 5.017 30.053 15.561 127 HE3 LYS 18 HE3 LYS 18 4.451 28.704 14.578 128 HZ1 LYS 18 HZ1 LYS 18 6.150 27.560 15.400 129 HZ2 LYS 18 HZ2 LYS 18 6.829 28.930 16.124 130 HZ3 LYS 18 HZ3 LYS 18 7.199 28.551 14.517 131 H GLY 19 H GLY 19 6.742 27.963 7.563 132 HA2 GLY 19 HA2 GLY 19 9.150 26.642 8.064 133 HA3 GLY 19 HA3 GLY 19 7.699 25.737 7.594 134 H ARG 20 H ARG 20 9.407 25.671 5.498 135 HA ARG 20 HA ARG 20 8.424 27.869 3.819 136 HB2 ARG 20 HB2 ARG 20 11.128 27.039 4.370 137 HB3 ARG 20 HB3 ARG 20 10.783 26.954 2.647 138 HG2 ARG 20 HG2 ARG 20 11.525 29.116 2.859 139 HG3 ARG 20 HG3 ARG 20 9.784 29.331 3.008 140 HD2 ARG 20 HD2 ARG 20 10.103 30.322 4.967 141 HD3 ARG 20 HD3 ARG 20 10.755 28.811 5.602 142 HE ARG 20 HE ARG 20 12.243 31.141 4.754 143 HH11 ARG 20 HH11 ARG 20 12.368 27.745 5.568 144 HH12 ARG 20 HH12 ARG 20 14.077 27.747 5.834 145 HH21 ARG 20 HH21 ARG 20 14.487 31.140 5.119 146 HH22 ARG 20 HH22 ARG 20 15.278 29.671 5.584 147 H CYS 21 H CYS 21 8.619 27.127 1.315 148 HA CYS 21 HA CYS 21 7.400 24.441 1.276 149 HB2 CYS 21 HB2 CYS 21 6.856 26.935 -0.181 150 HB3 CYS 21 HB3 CYS 21 6.902 25.517 -1.217 151 H PHE 22 H PHE 22 8.200 22.810 0.118 152 HA PHE 22 HA PHE 22 10.502 23.339 -1.674 153 HB2 PHE 22 HB2 PHE 22 10.203 21.250 0.485 154 HB3 PHE 22 HB3 PHE 22 11.348 21.060 -0.839 155 HD1 PHE 22 HD1 PHE 22 10.497 23.007 2.147 156 HD2 PHE 22 HD2 PHE 22 13.339 22.380 -0.959 157 HE1 PHE 22 HE1 PHE 22 12.131 24.389 3.364 158 HE2 PHE 22 HE2 PHE 22 14.969 23.757 0.262 159 HZ PHE 22 HZ PHE 22 14.369 24.764 2.419 160 H GLY 23 H GLY 23 7.449 22.579 -1.875 161 HA2 GLY 23 HA2 GLY 23 7.696 21.111 -4.276 162 HA3 GLY 23 HA3 GLY 23 7.231 20.025 -2.976 163 HA PRO 24 HA PRO 24 3.389 22.001 -4.626 164 HB2 PRO 24 HB2 PRO 24 2.311 19.426 -5.269 165 HB3 PRO 24 HB3 PRO 24 2.826 20.695 -6.379 166 HG2 PRO 24 HG2 PRO 24 4.076 18.242 -6.084 167 HG3 PRO 24 HG3 PRO 24 4.824 19.689 -6.777 168 HD2 PRO 24 HD2 PRO 24 5.091 18.545 -4.031 169 HD3 PRO 24 HD3 PRO 24 6.309 19.346 -5.046 170 H SER 25 H SER 25 3.557 18.890 -2.888 171 HA SER 25 HA SER 25 1.434 19.850 -1.068 172 HB2 SER 25 HB2 SER 25 1.269 17.642 -2.748 173 HB3 SER 25 HB3 SER 25 1.715 16.947 -1.190 174 HG SER 25 HG SER 25 -0.548 18.503 -1.850 175 H ILE 26 H ILE 26 4.529 19.671 -1.094 176 HA ILE 26 HA ILE 26 4.718 18.400 1.525 177 HB ILE 26 HB ILE 26 7.139 18.436 -0.178 178 HG12 ILE 26 HG12 ILE 26 5.124 16.252 -0.515 179 HG13 ILE 26 HG13 ILE 26 5.182 17.621 -1.613 180 HG21 ILE 26 HG21 ILE 26 6.881 17.636 2.211 181 HG22 ILE 26 HG22 ILE 26 7.766 16.620 1.072 182 HG23 ILE 26 HG23 ILE 26 6.106 16.247 1.494 183 HD11 ILE 26 HD11 ILE 26 6.448 15.459 -2.225 184 HD12 ILE 26 HD12 ILE 26 7.651 16.036 -1.072 185 HD13 ILE 26 HD13 ILE 26 7.233 17.017 -2.477 186 H CYS 27 H CYS 27 5.299 19.700 3.084 187 HA CYS 27 HA CYS 27 6.894 22.075 2.370 188 HB2 CYS 27 HB2 CYS 27 4.364 22.089 3.561 189 HB3 CYS 27 HB3 CYS 27 5.482 22.419 4.863 190 H CYS 28 H CYS 28 8.736 22.366 3.465 191 HA CYS 28 HA CYS 28 9.129 20.862 5.924 192 HB2 CYS 28 HB2 CYS 28 11.509 20.677 4.285 193 HB3 CYS 28 HB3 CYS 28 10.650 19.402 5.116 194 H GLY 29 H GLY 29 9.874 22.362 7.419 195 HA2 GLY 29 HA2 GLY 29 11.658 24.456 6.417 196 HA3 GLY 29 HA3 GLY 29 10.681 24.549 7.872 197 H ASP 30 H ASP 30 12.732 25.133 8.804 198 HA ASP 30 HA ASP 30 14.883 23.358 9.029 199 HB2 ASP 30 HB2 ASP 30 14.850 25.860 9.478 200 HB3 ASP 30 HB3 ASP 30 14.179 25.445 11.053 201 H GLU 31 H GLU 31 12.565 24.236 11.470 202 HA GLU 31 HA GLU 31 13.198 21.755 12.897 203 HB2 GLU 31 HB2 GLU 31 11.756 23.620 14.559 204 HB3 GLU 31 HB3 GLU 31 13.304 22.840 14.841 205 HG2 GLU 31 HG2 GLU 31 14.113 24.700 13.141 206 HG3 GLU 31 HG3 GLU 31 12.680 25.518 13.754 207 H LEU 32 H LEU 32 11.058 22.758 10.854 208 HA LEU 32 HA LEU 32 8.746 21.656 12.155 209 HB2 LEU 32 HB2 LEU 32 9.352 23.881 10.442 210 HB3 LEU 32 HB3 LEU 32 8.210 22.823 9.675 211 HG LEU 32 HG LEU 32 7.829 23.855 12.467 212 HD11 LEU 32 HD11 LEU 32 8.037 25.774 11.031 213 HD12 LEU 32 HD12 LEU 32 6.354 25.571 11.521 214 HD13 LEU 32 HD13 LEU 32 6.863 25.096 9.900 215 HD21 LEU 32 HD21 LEU 32 5.406 23.418 11.844 216 HD22 LEU 32 HD22 LEU 32 6.436 22.007 12.092 217 HD23 LEU 32 HD23 LEU 32 6.040 22.533 10.464 218 H GLY 33 H GLY 33 11.243 21.234 9.899 219 HA2 GLY 33 HA2 GLY 33 11.862 19.439 8.682 220 HA3 GLY 33 HA3 GLY 33 10.590 18.602 9.504 221 H CYS 34 H CYS 34 9.507 17.453 7.904 222 HA CYS 34 HA CYS 34 8.507 19.095 5.667 223 HB2 CYS 34 HB2 CYS 34 10.575 17.570 5.112 224 HB3 CYS 34 HB3 CYS 34 9.372 16.305 5.075 225 H PHE 35 H PHE 35 6.192 18.966 5.621 226 HA PHE 35 HA PHE 35 5.110 16.428 6.563 227 HB2 PHE 35 HB2 PHE 35 3.164 18.462 5.848 228 HB3 PHE 35 HB3 PHE 35 3.390 17.640 7.386 229 HD1 PHE 35 HD1 PHE 35 4.902 18.571 9.065 230 HD2 PHE 35 HD2 PHE 35 3.965 20.668 5.492 231 HE1 PHE 35 HE1 PHE 35 5.773 20.640 10.057 232 HE2 PHE 35 HE2 PHE 35 4.828 22.747 6.482 233 HZ PHE 35 HZ PHE 35 5.741 22.734 8.754 234 H VAL 36 H VAL 36 4.959 15.058 4.877 235 HA VAL 36 HA VAL 36 4.490 16.202 2.263 236 HB VAL 36 HB VAL 36 4.793 13.247 2.638 237 HG11 VAL 36 HG11 VAL 36 5.745 13.362 0.445 238 HG12 VAL 36 HG12 VAL 36 5.902 15.122 0.538 239 HG13 VAL 36 HG13 VAL 36 4.302 14.379 0.424 240 HG21 VAL 36 HG21 VAL 36 6.581 14.844 3.882 241 HG22 VAL 36 HG22 VAL 36 7.268 14.833 2.261 242 HG23 VAL 36 HG23 VAL 36 7.021 13.318 3.118 243 H GLY 37 H GLY 37 2.541 16.938 2.469 244 HA2 GLY 37 HA2 GLY 37 0.344 16.525 1.576 245 HA3 GLY 37 HA3 GLY 37 0.416 14.892 2.210 246 H THR 38 H THR 38 0.392 18.272 3.302 247 HA THR 38 HA THR 38 -1.698 17.659 5.236 248 HB THR 38 HB THR 38 -0.488 18.723 7.092 249 HG1 THR 38 HG1 THR 38 1.125 19.921 6.556 250 HG21 THR 38 HG21 THR 38 0.395 16.220 5.941 251 HG22 THR 38 HG22 THR 38 0.072 16.651 7.615 252 HG23 THR 38 HG23 THR 38 1.641 17.004 6.900 253 H ALA 39 H ALA 39 -2.609 19.809 6.187 254 HA ALA 39 HA ALA 39 -2.752 21.681 4.119 255 HB1 ALA 39 HB1 ALA 39 -4.623 21.319 5.588 256 HB2 ALA 39 HB2 ALA 39 -4.079 22.987 5.761 257 HB3 ALA 39 HB3 ALA 39 -3.667 21.792 6.993 258 H GLU 40 H GLU 40 -0.370 21.224 6.631 259 HA GLU 40 HA GLU 40 0.334 23.954 6.946 260 HB2 GLU 40 HB2 GLU 40 1.645 21.307 7.512 261 HB3 GLU 40 HB3 GLU 40 2.594 22.783 7.586 262 HG2 GLU 40 HG2 GLU 40 1.893 22.378 9.782 263 HG3 GLU 40 HG3 GLU 40 0.833 23.656 9.188 264 H ALA 41 H ALA 41 0.600 21.628 4.402 265 HA ALA 41 HA ALA 41 2.643 23.238 3.103 266 HB1 ALA 41 HB1 ALA 41 1.998 20.297 2.786 267 HB2 ALA 41 HB2 ALA 41 3.378 20.961 3.652 268 HB3 ALA 41 HB3 ALA 41 3.248 21.183 1.907 269 H LEU 42 H LEU 42 -0.729 22.337 2.999 270 HA LEU 42 HA LEU 42 -0.941 22.027 0.258 271 HB2 LEU 42 HB2 LEU 42 -3.180 21.905 0.561 272 HB3 LEU 42 HB3 LEU 42 -2.519 21.396 2.074 273 HG LEU 42 HG LEU 42 -4.050 22.655 3.029 274 HD11 LEU 42 HD11 LEU 42 -2.479 24.180 3.670 275 HD12 LEU 42 HD12 LEU 42 -3.733 25.186 2.951 276 HD13 LEU 42 HD13 LEU 42 -2.278 24.822 2.052 277 HD21 LEU 42 HD21 LEU 42 -5.750 23.316 1.793 278 HD22 LEU 42 HD22 LEU 42 -4.761 23.026 0.364 279 HD23 LEU 42 HD23 LEU 42 -4.807 24.630 1.092 280 H ARG 43 H ARG 43 -0.353 24.908 2.006 281 HA ARG 43 HA ARG 43 -1.392 26.705 0.001 282 HB2 ARG 43 HB2 ARG 43 -0.529 28.400 1.317 283 HB3 ARG 43 HB3 ARG 43 -0.728 27.152 2.519 284 HG2 ARG 43 HG2 ARG 43 1.380 27.565 3.086 285 HG3 ARG 43 HG3 ARG 43 1.841 26.727 1.603 286 HD2 ARG 43 HD2 ARG 43 2.883 28.972 1.861 287 HD3 ARG 43 HD3 ARG 43 1.923 28.796 0.393 288 HE ARG 43 HE ARG 43 1.259 30.416 2.731 289 HH11 ARG 43 HH11 ARG 43 0.276 29.176 -0.389 290 HH12 ARG 43 HH12 ARG 43 -0.913 30.408 -0.639 291 HH21 ARG 43 HH21 ARG 43 -0.332 32.010 2.410 292 HH22 ARG 43 HH22 ARG 43 -1.253 32.018 0.943 293 H CYS 44 H CYS 44 0.768 24.536 0.161 294 HA CYS 44 HA CYS 44 3.078 25.567 -1.375 295 HB2 CYS 44 HB2 CYS 44 2.487 22.962 -0.278 296 HB3 CYS 44 HB3 CYS 44 3.060 22.823 -1.920 297 H GLN 45 H GLN 45 -0.036 25.114 -2.203 298 HA GLN 45 HA GLN 45 0.324 24.100 -4.876 299 HB2 GLN 45 HB2 GLN 45 -2.015 25.150 -3.315 300 HB3 GLN 45 HB3 GLN 45 -2.137 24.868 -5.045 301 HG2 GLN 45 HG2 GLN 45 -1.247 22.738 -3.130 302 HG3 GLN 45 HG3 GLN 45 -2.943 23.026 -3.515 303 HE21 GLN 45 HE21 GLN 45 -3.492 22.985 -5.848 304 HE22 GLN 45 HE22 GLN 45 -2.698 21.816 -6.840 305 H GLU 46 H GLU 46 0.512 27.164 -3.340 306 HA GLU 46 HA GLU 46 -0.163 28.622 -5.749 307 HB2 GLU 46 HB2 GLU 46 -0.544 29.409 -3.294 308 HB3 GLU 46 HB3 GLU 46 1.158 29.850 -3.342 309 HG2 GLU 46 HG2 GLU 46 0.337 31.028 -5.604 310 HG3 GLU 46 HG3 GLU 46 -1.164 31.086 -4.683 311 H GLU 47 H GLU 47 2.348 26.743 -5.038 312 HA GLU 47 HA GLU 47 4.480 28.549 -5.797 313 HB2 GLU 47 HB2 GLU 47 4.380 26.120 -4.458 314 HB3 GLU 47 HB3 GLU 47 5.045 25.692 -6.028 315 HG2 GLU 47 HG2 GLU 47 6.548 27.841 -5.483 316 HG3 GLU 47 HG3 GLU 47 6.211 27.286 -3.845 317 H ASN 48 H ASN 48 1.947 27.324 -7.433 318 HA ASN 48 HA ASN 48 3.292 26.368 -9.787 319 HB2 ASN 48 HB2 ASN 48 0.811 25.942 -8.873 320 HB3 ASN 48 HB3 ASN 48 0.472 27.311 -9.926 321 HD21 ASN 48 HD21 ASN 48 1.901 24.094 -9.836 322 HD22 ASN 48 HD22 ASN 48 1.594 23.713 -11.493 323 H TYR 49 H TYR 49 2.127 29.414 -8.560 324 HA TYR 49 HA TYR 49 2.445 30.712 -11.159 325 HB2 TYR 49 HB2 TYR 49 1.592 31.744 -8.449 326 HB3 TYR 49 HB3 TYR 49 1.798 32.781 -9.858 327 HD1 TYR 49 HD1 TYR 49 0.334 32.450 -11.849 328 HD2 TYR 49 HD2 TYR 49 -0.353 30.403 -8.184 329 HE1 TYR 49 HE1 TYR 49 -1.954 31.922 -12.579 330 HE2 TYR 49 HE2 TYR 49 -2.643 29.871 -8.901 331 HH TYR 49 HH TYR 49 -3.794 30.678 -12.140 332 H LEU 50 H LEU 50 4.608 29.593 -9.109 333 HA LEU 50 HA LEU 50 6.538 31.676 -9.737 334 HB2 LEU 50 HB2 LEU 50 5.726 30.890 -6.970 335 HB3 LEU 50 HB3 LEU 50 7.403 31.299 -7.276 336 HG LEU 50 HG LEU 50 5.984 33.381 -8.451 337 HD11 LEU 50 HD11 LEU 50 4.127 33.854 -7.322 338 HD12 LEU 50 HD12 LEU 50 4.875 33.491 -5.767 339 HD13 LEU 50 HD13 LEU 50 4.187 32.191 -6.740 340 HD21 LEU 50 HD21 LEU 50 7.481 33.070 -5.873 341 HD22 LEU 50 HD22 LEU 50 6.788 34.618 -6.353 342 HD23 LEU 50 HD23 LEU 50 7.998 33.840 -7.373 343 HA PRO 51 HA PRO 51 8.415 27.588 -10.351 344 HB2 PRO 51 HB2 PRO 51 9.922 28.206 -12.464 345 HB3 PRO 51 HB3 PRO 51 8.171 28.013 -12.617 346 HG2 PRO 51 HG2 PRO 51 9.789 30.524 -12.424 347 HG3 PRO 51 HG3 PRO 51 8.418 30.157 -13.485 348 HD2 PRO 51 HD2 PRO 51 8.227 31.589 -11.140 349 HD3 PRO 51 HD3 PRO 51 6.882 30.699 -11.878 350 H SER 52 H SER 52 9.408 29.586 -8.379 351 HA SER 52 HA SER 52 12.071 28.597 -8.144 352 HB2 SER 52 HB2 SER 52 11.783 31.559 -8.693 353 HB3 SER 52 HB3 SER 52 13.280 30.691 -8.368 354 HG SER 52 HG SER 52 12.398 31.168 -10.687 355 HA PRO 53 HA PRO 53 10.502 29.824 -4.040 356 HB2 PRO 53 HB2 PRO 53 11.428 27.722 -2.683 357 HB3 PRO 53 HB3 PRO 53 10.072 27.551 -3.797 358 HG2 PRO 53 HG2 PRO 53 12.942 26.817 -4.185 359 HG3 PRO 53 HG3 PRO 53 11.484 25.944 -4.683 360 HD2 PRO 53 HD2 PRO 53 13.020 27.595 -6.320 361 HD3 PRO 53 HD3 PRO 53 11.353 27.086 -6.645 362 H CYS 54 H CYS 54 12.522 28.675 -1.959 363 HA CYS 54 HA CYS 54 14.775 30.474 -2.495 364 HB2 CYS 54 HB2 CYS 54 14.687 31.604 -0.476 365 HB3 CYS 54 HB3 CYS 54 12.991 31.490 -0.901 366 H GLN 55 H GLN 55 16.586 29.391 -2.490 367 HA GLN 55 HA GLN 55 18.146 27.772 -2.100 368 HB2 GLN 55 HB2 GLN 55 17.404 28.863 0.403 369 HB3 GLN 55 HB3 GLN 55 17.609 27.138 0.645 370 HG2 GLN 55 HG2 GLN 55 19.715 28.571 -0.866 371 HG3 GLN 55 HG3 GLN 55 19.617 28.846 0.867 372 HE21 GLN 55 HE21 GLN 55 21.274 27.185 -1.271 373 HE22 GLN 55 HE22 GLN 55 21.582 25.717 -0.418 374 H SER 56 H SER 56 18.473 25.573 -0.746 375 HA SER 56 HA SER 56 16.120 23.891 -0.936 376 HB2 SER 56 HB2 SER 56 18.074 23.940 -2.989 377 HB3 SER 56 HB3 SER 56 18.222 22.403 -2.137 378 HG SER 56 HG SER 56 15.788 22.412 -2.369 379 H GLY 57 H GLY 57 19.565 22.655 -0.797 380 HA2 GLY 57 HA2 GLY 57 20.114 22.598 1.756 381 HA3 GLY 57 HA3 GLY 57 18.929 21.285 1.587 382 H GLN 58 H GLN 58 22.123 21.494 1.734 383 HA GLN 58 HA GLN 58 22.568 19.850 -0.669 384 HB2 GLN 58 HB2 GLN 58 23.890 21.997 -0.303 385 HB3 GLN 58 HB3 GLN 58 24.723 21.145 0.989 386 HG2 GLN 58 HG2 GLN 58 25.345 19.401 -0.708 387 HG3 GLN 58 HG3 GLN 58 24.710 20.489 -1.943 388 HE21 GLN 58 HE21 GLN 58 25.641 22.709 -1.928 389 HE22 GLN 58 HE22 GLN 58 27.330 22.867 -1.601 390 H LYS 59 H LYS 59 21.616 18.135 0.442 391 HA LYS 59 HA LYS 59 23.629 16.486 1.768 392 HB2 LYS 59 HB2 LYS 59 21.890 17.628 3.472 393 HB3 LYS 59 HB3 LYS 59 20.851 16.338 2.886 394 HG2 LYS 59 HG2 LYS 59 21.908 15.580 4.884 395 HG3 LYS 59 HG3 LYS 59 22.617 14.704 3.529 396 HD2 LYS 59 HD2 LYS 59 24.485 15.296 4.757 397 HD3 LYS 59 HD3 LYS 59 24.395 16.601 3.573 398 HE2 LYS 59 HE2 LYS 59 22.822 17.194 5.919 399 HE3 LYS 59 HE3 LYS 59 24.493 16.848 6.346 400 HZ1 LYS 59 HZ1 LYS 59 23.723 18.763 4.220 401 HZ2 LYS 59 HZ2 LYS 59 25.249 18.556 4.921 402 HZ3 LYS 59 HZ3 LYS 59 23.986 19.223 5.827 403 HA PRO 60 HA PRO 60 20.847 14.848 -1.581 404 HB2 PRO 60 HB2 PRO 60 22.774 14.370 -3.448 405 HB3 PRO 60 HB3 PRO 60 21.878 15.889 -3.339 406 HG2 PRO 60 HG2 PRO 60 24.621 15.229 -2.351 407 HG3 PRO 60 HG3 PRO 60 24.030 16.718 -3.112 408 HD2 PRO 60 HD2 PRO 60 24.396 16.471 -0.427 409 HD3 PRO 60 HD3 PRO 60 23.170 17.532 -1.143 410 H CYS 61 H CYS 61 20.727 13.217 -0.023 411 HA CYS 61 HA CYS 61 22.502 10.899 -0.400 412 HB2 CYS 61 HB2 CYS 61 20.981 10.083 1.621 413 HB3 CYS 61 HB3 CYS 61 22.341 11.158 1.919 414 H GLY 62 H GLY 62 20.946 8.716 -0.187 415 HA2 GLY 62 HA2 GLY 62 19.124 7.595 -0.998 416 HA3 GLY 62 HA3 GLY 62 18.308 9.139 -1.142 417 H SER 63 H SER 63 17.480 7.916 -2.953 418 HA SER 63 HA SER 63 19.118 7.693 -5.311 419 HB2 SER 63 HB2 SER 63 16.967 6.925 -6.347 420 HB3 SER 63 HB3 SER 63 17.455 5.983 -4.936 421 HG SER 63 HG SER 63 15.636 8.155 -4.845 422 H GLY 64 H GLY 64 19.184 10.259 -4.503 423 HA2 GLY 64 HA2 GLY 64 19.271 12.027 -6.183 424 HA3 GLY 64 HA3 GLY 64 17.615 11.632 -6.583 425 H GLY 65 H GLY 65 17.903 11.603 -3.218 426 HA2 GLY 65 HA2 GLY 65 16.728 14.279 -3.198 427 HA3 GLY 65 HA3 GLY 65 16.456 13.041 -2.008 428 H ARG 66 H ARG 66 17.300 15.930 -2.068 429 HA ARG 66 HA ARG 66 19.653 15.733 -0.355 430 HB2 ARG 66 HB2 ARG 66 19.522 18.374 -0.718 431 HB3 ARG 66 HB3 ARG 66 20.386 17.315 -1.824 432 HG2 ARG 66 HG2 ARG 66 17.507 17.945 -2.314 433 HG3 ARG 66 HG3 ARG 66 18.754 19.119 -2.738 434 HD2 ARG 66 HD2 ARG 66 18.752 16.250 -3.670 435 HD3 ARG 66 HD3 ARG 66 18.079 17.587 -4.601 436 HE ARG 66 HE ARG 66 20.637 18.363 -4.027 437 HH11 ARG 66 HH11 ARG 66 19.206 15.592 -5.613 438 HH12 ARG 66 HH12 ARG 66 20.560 15.344 -6.664 439 HH21 ARG 66 HH21 ARG 66 22.410 18.029 -5.414 440 HH22 ARG 66 HH22 ARG 66 22.376 16.723 -6.550 441 H CYS 67 H CYS 67 19.608 17.023 1.694 442 HA CYS 67 HA CYS 67 17.294 16.586 3.083 443 HB2 CYS 67 HB2 CYS 67 19.812 18.081 3.595 444 HB3 CYS 67 HB3 CYS 67 18.457 18.403 4.668 445 H ALA 68 H ALA 68 15.389 17.545 2.618 446 HA ALA 68 HA ALA 68 15.300 20.318 1.754 447 HB1 ALA 68 HB1 ALA 68 13.757 18.550 0.807 448 HB2 ALA 68 HB2 ALA 68 12.960 20.007 1.404 449 HB3 ALA 68 HB3 ALA 68 12.942 18.534 2.373 450 H ALA 69 H ALA 69 15.151 18.455 4.632 451 HA ALA 69 HA ALA 69 14.964 20.818 6.246 452 HB1 ALA 69 HB1 ALA 69 12.547 19.058 6.492 453 HB2 ALA 69 HB2 ALA 69 12.581 20.593 5.648 454 HB3 ALA 69 HB3 ALA 69 12.903 20.530 7.370 455 H ALA 70 H ALA 70 14.954 20.304 8.564 456 HA ALA 70 HA ALA 70 16.931 18.702 9.378 457 HB1 ALA 70 HB1 ALA 70 15.181 18.486 11.520 458 HB2 ALA 70 HB2 ALA 70 14.677 19.955 10.694 459 HB3 ALA 70 HB3 ALA 70 16.351 19.786 11.241 460 H GLY 71 H GLY 71 17.085 16.730 8.495 461 HA2 GLY 71 HA2 GLY 71 16.892 14.471 8.350 462 HA3 GLY 71 HA3 GLY 71 15.645 14.521 9.584 463 H ILE 72 H ILE 72 16.044 15.737 6.264 464 HA ILE 72 HA ILE 72 13.865 14.071 5.387 465 HB ILE 72 HB ILE 72 13.637 16.719 4.061 466 HG12 ILE 72 HG12 ILE 72 13.577 17.641 6.234 467 HG13 ILE 72 HG13 ILE 72 11.901 17.447 5.765 468 HG21 ILE 72 HG21 ILE 72 12.246 15.040 3.278 469 HG22 ILE 72 HG22 ILE 72 11.184 15.982 4.305 470 HG23 ILE 72 HG23 ILE 72 11.854 14.464 4.888 471 HD11 ILE 72 HD11 ILE 72 12.903 15.117 6.963 472 HD12 ILE 72 HD12 ILE 72 11.509 16.089 7.434 473 HD13 ILE 72 HD13 ILE 72 13.120 16.483 8.049 474 H CYS 73 H CYS 73 15.255 12.980 4.183 475 HA CYS 73 HA CYS 73 17.108 14.358 2.422 476 HB2 CYS 73 HB2 CYS 73 17.874 12.405 3.711 477 HB3 CYS 73 HB3 CYS 73 16.614 11.428 2.967 478 H CYS 74 H CYS 74 15.805 15.255 0.760 479 HA CYS 74 HA CYS 74 14.792 13.320 -1.098 480 HB2 CYS 74 HB2 CYS 74 12.447 14.011 -0.919 481 HB3 CYS 74 HB3 CYS 74 13.083 13.181 0.486 482 H SER 75 H SER 75 12.995 14.476 -2.508 483 HA SER 75 HA SER 75 14.069 17.015 -3.553 484 HB2 SER 75 HB2 SER 75 13.094 14.562 -5.058 485 HB3 SER 75 HB3 SER 75 13.421 16.107 -5.822 486 HG SER 75 HG SER 75 15.517 15.355 -4.311 487 HA PRO 76 HA PRO 76 9.873 18.444 -3.572 488 HB2 PRO 76 HB2 PRO 76 9.232 19.266 -6.069 489 HB3 PRO 76 HB3 PRO 76 10.386 20.128 -5.046 490 HG2 PRO 76 HG2 PRO 76 10.897 18.208 -7.281 491 HG3 PRO 76 HG3 PRO 76 11.719 19.733 -6.904 492 HD2 PRO 76 HD2 PRO 76 12.734 17.303 -6.269 493 HD3 PRO 76 HD3 PRO 76 13.062 18.758 -5.316 494 H ASP 77 H ASP 77 10.199 15.525 -4.215 495 HA ASP 77 HA ASP 77 7.479 15.083 -5.235 496 HB2 ASP 77 HB2 ASP 77 9.424 14.565 -6.911 497 HB3 ASP 77 HB3 ASP 77 9.675 13.142 -5.902 498 H GLY 78 H GLY 78 10.248 13.284 -3.870 499 HA2 GLY 78 HA2 GLY 78 8.388 12.122 -1.914 500 HA3 GLY 78 HA3 GLY 78 9.736 11.248 -2.564 501 H CYS 79 H CYS 79 9.867 11.108 -0.014 502 HA CYS 79 HA CYS 79 12.056 12.819 0.651 503 HB2 CYS 79 HB2 CYS 79 9.461 13.079 2.066 504 HB3 CYS 79 HB3 CYS 79 10.967 13.359 2.941 505 H HIS 80 H HIS 80 13.194 12.226 2.744 506 HA HIS 80 HA HIS 80 12.564 9.469 3.559 507 HB2 HIS 80 HB2 HIS 80 14.968 10.356 2.061 508 HB3 HIS 80 HB3 HIS 80 15.246 9.256 3.402 509 HD1 HIS 80 HD1 HIS 80 13.249 9.440 0.187 510 HD2 HIS 80 HD2 HIS 80 14.803 6.638 2.825 511 HE1 HIS 80 HE1 HIS 80 12.908 7.211 -0.923 512 HE2 HIS 80 HE2 HIS 80 13.831 5.527 0.704 513 H GLU 81 H GLU 81 13.062 8.999 5.622 514 HA GLU 81 HA GLU 81 13.620 11.095 7.441 515 HB2 GLU 81 HB2 GLU 81 12.394 9.032 8.010 516 HB3 GLU 81 HB3 GLU 81 13.865 8.113 7.849 517 HG2 GLU 81 HG2 GLU 81 14.798 9.678 9.634 518 HG3 GLU 81 HG3 GLU 81 13.117 10.129 9.923 519 H ASP 82 H ASP 82 15.570 11.972 7.909 520 HA ASP 82 HA ASP 82 17.824 10.135 7.774 521 HB2 ASP 82 HB2 ASP 82 18.787 11.095 5.980 522 HB3 ASP 82 HB3 ASP 82 17.301 12.019 5.758 523 HA PRO 83 HA PRO 83 18.188 12.129 11.816 524 HB2 PRO 83 HB2 PRO 83 20.431 10.236 12.125 525 HB3 PRO 83 HB3 PRO 83 18.991 10.453 13.123 526 HG2 PRO 83 HG2 PRO 83 19.281 8.320 11.531 527 HG3 PRO 83 HG3 PRO 83 17.698 9.075 11.795 528 HD2 PRO 83 HD2 PRO 83 19.549 9.314 9.453 529 HD3 PRO 83 HD3 PRO 83 17.779 9.168 9.481 530 H ALA 84 H ALA 84 20.639 11.920 9.352 531 HA ALA 84 HA ALA 84 22.738 13.194 10.740 532 HB1 ALA 84 HB1 ALA 84 22.867 12.031 8.477 533 HB2 ALA 84 HB2 ALA 84 23.790 13.522 8.669 534 HB3 ALA 84 HB3 ALA 84 22.256 13.542 7.800 535 H CYS 85 H CYS 85 20.032 14.430 8.894 536 HA CYS 85 HA CYS 85 20.810 17.190 9.435 537 HB2 CYS 85 HB2 CYS 85 18.641 15.935 7.748 538 HB3 CYS 85 HB3 CYS 85 18.720 17.664 8.036 539 H ASP 86 H ASP 86 20.175 15.860 11.820 540 HA ASP 86 HA ASP 86 17.377 16.165 12.424 541 HB2 ASP 86 HB2 ASP 86 19.511 14.829 13.628 542 HB3 ASP 86 HB3 ASP 86 19.057 16.104 14.773 543 HA PRO 87 HA PRO 87 18.721 20.099 14.808 544 HB2 PRO 87 HB2 PRO 87 21.290 20.522 15.387 545 HB3 PRO 87 HB3 PRO 87 20.385 19.273 16.248 546 HG2 PRO 87 HG2 PRO 87 22.436 18.994 14.122 547 HG3 PRO 87 HG3 PRO 87 22.054 17.907 15.465 548 HD2 PRO 87 HD2 PRO 87 21.197 17.688 12.764 549 HD3 PRO 87 HD3 PRO 87 20.692 16.688 14.133 550 H GLU 88 H GLU 88 19.312 22.263 14.139 551 HA GLU 88 HA GLU 88 19.257 22.881 11.526 552 HB2 GLU 88 HB2 GLU 88 20.956 24.781 12.196 553 HB3 GLU 88 HB3 GLU 88 19.309 24.774 12.815 554 HG2 GLU 88 HG2 GLU 88 20.941 23.220 14.553 555 HG3 GLU 88 HG3 GLU 88 21.730 24.767 14.260 556 H ALA 89 H ALA 89 20.237 21.504 10.232 557 HA ALA 89 HA ALA 89 23.167 21.245 10.292 558 HB1 ALA 89 HB1 ALA 89 21.330 19.380 9.822 559 HB2 ALA 89 HB2 ALA 89 22.950 19.328 9.098 560 HB3 ALA 89 HB3 ALA 89 21.579 19.940 8.161 561 H ALA 90 H ALA 90 21.468 23.644 9.806 562 HA ALA 90 HA ALA 90 21.631 24.369 7.044 563 HB1 ALA 90 HB1 ALA 90 20.993 25.856 9.564 564 HB2 ALA 90 HB2 ALA 90 19.955 25.511 8.180 565 HB3 ALA 90 HB3 ALA 90 21.236 26.717 8.043 566 H PHE 91 H PHE 91 22.847 26.012 6.178 567 HA PHE 91 HA PHE 91 25.616 26.166 7.126 568 HB2 PHE 91 HB2 PHE 91 24.284 26.045 4.546 569 HB3 PHE 91 HB3 PHE 91 25.390 27.412 4.627 570 HD1 PHE 91 HD1 PHE 91 27.584 26.458 6.213 571 HD2 PHE 91 HD2 PHE 91 25.257 24.400 3.307 572 HE1 PHE 91 HE1 PHE 91 29.474 24.943 5.778 573 HE2 PHE 91 HE2 PHE 91 27.139 22.882 2.865 574 HZ PHE 91 HZ PHE 91 29.252 23.151 4.101 575 H SER 92 H SER 92 25.513 27.846 8.672 576 HA SER 92 HA SER 92 25.461 29.995 9.443 577 HB2 SER 92 HB2 SER 92 25.453 30.706 6.497 578 HB3 SER 92 HB3 SER 92 25.848 31.798 7.824 579 HG SER 92 HG SER 92 27.261 29.442 7.102 580 H1 ALA 101 H1 ALA 101 -10.017 -1.874 13.681 581 H2 ALA 101 H2 ALA 101 -11.337 -1.318 14.627 582 H3 ALA 101 H3 ALA 101 -10.494 -0.227 13.606 583 HA ALA 101 HA ALA 101 -12.318 -2.408 12.886 584 HB1 ALA 101 HB1 ALA 101 -13.228 -0.486 11.475 585 HB2 ALA 101 HB2 ALA 101 -12.190 0.559 12.445 586 HB3 ALA 101 HB3 ALA 101 -13.462 -0.386 13.220 587 H VAL 102 H VAL 102 -11.685 -3.665 11.214 588 HA VAL 102 HA VAL 102 -10.590 -4.300 9.225 589 HB VAL 102 HB VAL 102 -10.762 -1.397 8.434 590 HG11 VAL 102 HG11 VAL 102 -11.672 -3.237 6.456 591 HG12 VAL 102 HG12 VAL 102 -10.115 -3.786 7.078 592 HG13 VAL 102 HG13 VAL 102 -10.275 -2.161 6.414 593 HG21 VAL 102 HG21 VAL 102 -13.126 -2.464 7.556 594 HG22 VAL 102 HG22 VAL 102 -12.937 -1.410 8.957 595 HG23 VAL 102 HG23 VAL 102 -12.973 -3.161 9.169 596 H LEU 103 H LEU 103 -8.958 -3.860 11.275 597 HA LEU 103 HA LEU 103 -6.618 -2.401 10.288 598 HB2 LEU 103 HB2 LEU 103 -7.664 -3.080 12.944 599 HB3 LEU 103 HB3 LEU 103 -5.917 -3.106 12.770 600 HG LEU 103 HG LEU 103 -6.593 -0.919 13.511 601 HD11 LEU 103 HD11 LEU 103 -4.985 -1.379 11.379 602 HD12 LEU 103 HD12 LEU 103 -5.203 0.186 12.150 603 HD13 LEU 103 HD13 LEU 103 -6.132 -0.217 10.713 604 HD21 LEU 103 HD21 LEU 103 -7.993 0.345 11.622 605 HD22 LEU 103 HD22 LEU 103 -8.733 -0.469 12.999 606 HD23 LEU 103 HD23 LEU 103 -8.633 -1.285 11.443 607 H ASP 104 H ASP 104 -5.762 -3.689 8.926 608 HA ASP 104 HA ASP 104 -5.041 -6.446 9.524 609 HB2 ASP 104 HB2 ASP 104 -4.803 -4.770 7.093 610 HB3 ASP 104 HB3 ASP 104 -3.652 -6.088 7.268 611 H LEU 105 H LEU 105 -3.457 -6.851 10.910 612 HA LEU 105 HA LEU 105 -0.884 -6.167 10.402 613 HB2 LEU 105 HB2 LEU 105 -1.600 -4.129 11.515 614 HB3 LEU 105 HB3 LEU 105 -2.107 -5.069 12.882 615 HG LEU 105 HG LEU 105 0.131 -3.775 12.970 616 HD11 LEU 105 HD11 LEU 105 -0.776 -5.885 14.369 617 HD12 LEU 105 HD12 LEU 105 0.712 -5.020 14.712 618 HD13 LEU 105 HD13 LEU 105 0.759 -6.515 13.775 619 HD21 LEU 105 HD21 LEU 105 1.570 -6.098 11.969 620 HD22 LEU 105 HD22 LEU 105 1.867 -4.378 11.723 621 HD23 LEU 105 HD23 LEU 105 0.693 -5.222 10.714 622 H ASP 106 H ASP 106 -2.114 -6.737 13.393 623 HA ASP 106 HA ASP 106 -2.265 -9.570 13.525 624 HB2 ASP 106 HB2 ASP 106 0.207 -8.416 13.562 625 HB3 ASP 106 HB3 ASP 106 -0.124 -8.608 15.290 626 H VAL 107 H VAL 107 -1.535 -6.660 15.240 627 HA VAL 107 HA VAL 107 -3.894 -6.686 16.900 628 HB VAL 107 HB VAL 107 -2.025 -7.541 18.374 629 HG11 VAL 107 HG11 VAL 107 -0.681 -4.954 17.599 630 HG12 VAL 107 HG12 VAL 107 -0.064 -6.593 17.403 631 HG13 VAL 107 HG13 VAL 107 -0.233 -5.899 19.015 632 HG21 VAL 107 HG21 VAL 107 -2.551 -6.188 20.181 633 HG22 VAL 107 HG22 VAL 107 -3.912 -5.953 19.086 634 HG23 VAL 107 HG23 VAL 107 -2.644 -4.732 19.189 635 H ARG 108 H ARG 108 -4.788 -4.629 16.440 636 HA ARG 108 HA ARG 108 -3.144 -2.864 14.968 637 HB2 ARG 108 HB2 ARG 108 -5.237 -2.626 14.126 638 HB3 ARG 108 HB3 ARG 108 -6.020 -3.162 15.597 639 HG2 ARG 108 HG2 ARG 108 -4.886 -0.583 16.065 640 HG3 ARG 108 HG3 ARG 108 -5.779 -0.538 14.562 641 HD2 ARG 108 HD2 ARG 108 -7.784 -1.037 15.567 642 HD3 ARG 108 HD3 ARG 108 -7.024 -1.803 16.958 643 HE ARG 108 HE ARG 108 -6.429 0.431 17.736 644 HH11 ARG 108 HH11 ARG 108 -8.843 0.207 15.226 645 HH12 ARG 108 HH12 ARG 108 -9.529 1.755 15.571 646 HH21 ARG 108 HH21 ARG 108 -7.330 2.490 18.183 647 HH22 ARG 108 HH22 ARG 108 -8.674 3.050 17.244 648 H THR 109 H THR 109 -1.673 -1.669 16.175 649 HA THR 109 HA THR 109 -3.037 -0.596 18.565 650 HB THR 109 HB THR 109 -0.977 -1.585 19.396 651 HG1 THR 109 HG1 THR 109 -1.310 0.545 20.123 652 HG21 THR 109 HG21 THR 109 0.031 -1.029 16.815 653 HG22 THR 109 HG22 THR 109 0.762 -1.966 18.116 654 HG23 THR 109 HG23 THR 109 1.064 -0.232 18.000 655 H CYS 110 H CYS 110 -4.108 0.850 17.496 656 HA CYS 110 HA CYS 110 -2.895 2.177 15.251 657 HB2 CYS 110 HB2 CYS 110 -5.550 2.231 16.518 658 HB3 CYS 110 HB3 CYS 110 -5.072 3.748 15.768 659 H LEU 111 H LEU 111 -1.025 2.757 16.624 660 HA LEU 111 HA LEU 111 -0.760 4.633 18.524 661 HB2 LEU 111 HB2 LEU 111 0.885 3.505 16.601 662 HB3 LEU 111 HB3 LEU 111 1.051 5.232 16.356 663 HG LEU 111 HG LEU 111 1.318 4.074 19.109 664 HD11 LEU 111 HD11 LEU 111 3.357 4.061 16.912 665 HD12 LEU 111 HD12 LEU 111 2.875 2.740 17.978 666 HD13 LEU 111 HD13 LEU 111 3.817 4.090 18.613 667 HD21 LEU 111 HD21 LEU 111 1.329 6.640 18.152 668 HD22 LEU 111 HD22 LEU 111 3.048 6.256 18.229 669 HD23 LEU 111 HD23 LEU 111 2.048 6.112 19.674 670 HA PRO 112 HA PRO 112 -2.641 8.196 16.497 671 HB2 PRO 112 HB2 PRO 112 -3.292 9.576 18.685 672 HB3 PRO 112 HB3 PRO 112 -4.187 8.127 18.212 673 HG2 PRO 112 HG2 PRO 112 -2.143 8.478 20.348 674 HG3 PRO 112 HG3 PRO 112 -3.588 7.454 20.331 675 HD2 PRO 112 HD2 PRO 112 -0.957 6.620 19.808 676 HD3 PRO 112 HD3 PRO 112 -2.434 5.703 19.461 677 H CYS 113 H CYS 113 -1.982 10.414 16.242 678 HA CYS 113 HA CYS 113 0.203 11.403 17.777 679 HB2 CYS 113 HB2 CYS 113 1.915 11.600 16.121 680 HB3 CYS 113 HB3 CYS 113 1.409 9.923 16.205 681 H GLY 114 H GLY 114 1.241 13.426 16.481 682 HA2 GLY 114 HA2 GLY 114 0.921 15.492 15.573 683 HA3 GLY 114 HA3 GLY 114 -0.559 14.896 14.847 684 HA PRO 115 HA PRO 115 -1.760 18.157 17.963 685 HB2 PRO 115 HB2 PRO 115 -3.731 19.179 16.494 686 HB3 PRO 115 HB3 PRO 115 -2.040 19.521 16.047 687 HG2 PRO 115 HG2 PRO 115 -3.634 17.128 15.235 688 HG3 PRO 115 HG3 PRO 115 -3.174 18.465 14.114 689 HD2 PRO 115 HD2 PRO 115 -1.522 16.494 14.207 690 HD3 PRO 115 HD3 PRO 115 -0.808 18.061 14.696 691 H GLY 116 H GLY 116 -2.483 16.524 19.243 692 HA2 GLY 116 HA2 GLY 116 -4.338 15.816 20.589 693 HA3 GLY 116 HA3 GLY 116 -5.335 16.069 19.180 694 H GLY 117 H GLY 117 -2.555 14.407 18.344 695 HA2 GLY 117 HA2 GLY 117 -2.194 12.208 17.898 696 HA3 GLY 117 HA3 GLY 117 -3.252 11.948 19.246 697 H LYS 118 H LYS 118 -4.041 13.662 16.378 698 HA LYS 118 HA LYS 118 -6.257 11.868 15.883 699 HB2 LYS 118 HB2 LYS 118 -5.886 14.192 14.107 700 HB3 LYS 118 HB3 LYS 118 -7.336 13.578 14.881 701 HG2 LYS 118 HG2 LYS 118 -5.775 14.590 16.966 702 HG3 LYS 118 HG3 LYS 118 -5.625 15.754 15.648 703 HD2 LYS 118 HD2 LYS 118 -8.356 14.848 15.959 704 HD3 LYS 118 HD3 LYS 118 -7.732 15.535 17.457 705 HE2 LYS 118 HE2 LYS 118 -8.598 17.395 16.400 706 HE3 LYS 118 HE3 LYS 118 -6.904 17.466 15.915 707 HZ1 LYS 118 HZ1 LYS 118 -7.404 16.858 13.775 708 HZ2 LYS 118 HZ2 LYS 118 -8.794 17.738 14.166 709 HZ3 LYS 118 HZ3 LYS 118 -8.827 16.047 14.201 710 H GLY 119 H GLY 119 -3.108 11.636 14.978 711 HA2 GLY 119 HA2 GLY 119 -3.790 10.775 12.241 712 HA3 GLY 119 HA3 GLY 119 -2.196 11.350 12.742 713 H ARG 120 H ARG 120 -1.229 9.065 12.058 714 HA ARG 120 HA ARG 120 -1.452 7.423 14.339 715 HB2 ARG 120 HB2 ARG 120 -2.850 6.770 11.929 716 HB3 ARG 120 HB3 ARG 120 -1.544 5.610 12.154 717 HG2 ARG 120 HG2 ARG 120 -3.155 4.555 13.371 718 HG3 ARG 120 HG3 ARG 120 -2.539 5.631 14.631 719 HD2 ARG 120 HD2 ARG 120 -4.561 6.497 14.850 720 HD3 ARG 120 HD3 ARG 120 -4.448 7.116 13.206 721 HE ARG 120 HE ARG 120 -5.929 4.801 14.112 722 HH11 ARG 120 HH11 ARG 120 -4.620 6.530 11.371 723 HH12 ARG 120 HH12 ARG 120 -5.684 5.777 10.235 724 HH21 ARG 120 HH21 ARG 120 -7.337 3.830 12.616 725 HH22 ARG 120 HH22 ARG 120 -7.226 4.250 10.938 726 H CYS 121 H CYS 121 0.426 5.663 13.962 727 HA CYS 121 HA CYS 121 2.578 7.218 12.691 728 HB2 CYS 121 HB2 CYS 121 2.395 5.585 15.122 729 HB3 CYS 121 HB3 CYS 121 3.842 5.273 14.177 730 H PHE 122 H PHE 122 3.829 6.463 11.122 731 HA PHE 122 HA PHE 122 3.495 3.641 10.286 732 HB2 PHE 122 HB2 PHE 122 3.438 6.147 8.604 733 HB3 PHE 122 HB3 PHE 122 3.806 4.569 7.913 734 HD1 PHE 122 HD1 PHE 122 1.224 6.633 9.494 735 HD2 PHE 122 HD2 PHE 122 2.109 2.904 7.644 736 HE1 PHE 122 HE1 PHE 122 -1.183 6.155 9.307 737 HE2 PHE 122 HE2 PHE 122 -0.296 2.432 7.457 738 HZ PHE 122 HZ PHE 122 -1.943 4.052 8.286 739 H GLY 123 H GLY 123 5.628 5.476 11.713 740 HA2 GLY 123 HA2 GLY 123 7.876 4.030 10.794 741 HA3 GLY 123 HA3 GLY 123 7.893 5.640 10.091 742 HA PRO 124 HA PRO 124 9.829 5.894 14.285 743 HB2 PRO 124 HB2 PRO 124 12.248 6.903 13.127 744 HB3 PRO 124 HB3 PRO 124 11.986 5.347 13.915 745 HG2 PRO 124 HG2 PRO 124 12.529 5.685 11.223 746 HG3 PRO 124 HG3 PRO 124 11.767 4.253 11.935 747 HD2 PRO 124 HD2 PRO 124 10.514 6.559 10.506 748 HD3 PRO 124 HD3 PRO 124 10.083 4.835 10.468 749 H SER 125 H SER 125 10.376 8.168 11.591 750 HA SER 125 HA SER 125 9.756 10.408 13.421 751 HB2 SER 125 HB2 SER 125 12.169 9.988 12.107 752 HB3 SER 125 HB3 SER 125 11.331 11.148 11.078 753 HG SER 125 HG SER 125 12.674 11.817 13.079 754 H ILE 126 H ILE 126 8.273 8.704 11.306 755 HA ILE 126 HA ILE 126 7.212 10.991 9.832 756 HB ILE 126 HB ILE 126 7.016 8.291 8.609 757 HG12 ILE 126 HG12 ILE 126 9.506 9.954 8.269 758 HG13 ILE 126 HG13 ILE 126 9.428 8.618 9.408 759 HG21 ILE 126 HG21 ILE 126 5.987 10.311 7.663 760 HG22 ILE 126 HG22 ILE 126 7.152 9.556 6.574 761 HG23 ILE 126 HG23 ILE 126 7.585 11.006 7.471 762 HD11 ILE 126 HD11 ILE 126 10.049 7.297 7.745 763 HD12 ILE 126 HD12 ILE 126 9.821 8.582 6.557 764 HD13 ILE 126 HD13 ILE 126 8.459 7.567 7.033 765 H CYS 127 H CYS 127 5.176 11.397 10.226 766 HA CYS 127 HA CYS 127 3.462 9.158 11.085 767 HB2 CYS 127 HB2 CYS 127 4.002 11.492 12.545 768 HB3 CYS 127 HB3 CYS 127 2.392 11.708 11.892 769 H CYS 128 H CYS 128 1.622 8.871 9.966 770 HA CYS 128 HA CYS 128 0.691 11.024 8.237 771 HB2 CYS 128 HB2 CYS 128 0.603 8.553 6.750 772 HB3 CYS 128 HB3 CYS 128 1.290 10.090 6.286 773 H GLY 129 H GLY 129 -1.866 11.156 8.572 774 HA2 GLY 129 HA2 GLY 129 -2.872 8.545 9.126 775 HA3 GLY 129 HA3 GLY 129 -3.455 10.079 9.753 776 H ASP 130 H ASP 130 -5.439 9.587 8.713 777 HA ASP 130 HA ASP 130 -5.718 9.228 5.958 778 HB2 ASP 130 HB2 ASP 130 -7.409 8.763 7.827 779 HB3 ASP 130 HB3 ASP 130 -7.819 10.466 7.666 780 H GLU 131 H GLU 131 -6.869 12.117 7.638 781 HA GLU 131 HA GLU 131 -6.244 13.612 5.252 782 HB2 GLU 131 HB2 GLU 131 -7.747 15.060 7.225 783 HB3 GLU 131 HB3 GLU 131 -8.283 14.572 5.628 784 HG2 GLU 131 HG2 GLU 131 -8.676 12.273 6.906 785 HG3 GLU 131 HG3 GLU 131 -8.753 13.349 8.294 786 H LEU 132 H LEU 132 -4.297 12.983 7.360 787 HA LEU 132 HA LEU 132 -3.547 15.624 8.126 788 HB2 LEU 132 HB2 LEU 132 -4.062 13.246 9.664 789 HB3 LEU 132 HB3 LEU 132 -2.370 13.624 9.727 790 HG LEU 132 HG LEU 132 -4.519 15.621 10.392 791 HD11 LEU 132 HD11 LEU 132 -4.670 13.649 11.887 792 HD12 LEU 132 HD12 LEU 132 -4.234 15.140 12.722 793 HD13 LEU 132 HD13 LEU 132 -2.997 13.934 12.370 794 HD21 LEU 132 HD21 LEU 132 -2.305 16.294 11.824 795 HD22 LEU 132 HD22 LEU 132 -2.741 16.974 10.256 796 HD23 LEU 132 HD23 LEU 132 -1.602 15.637 10.350 797 H GLY 133 H GLY 133 -3.095 12.629 6.528 798 HA2 GLY 133 HA2 GLY 133 -1.648 11.938 5.038 799 HA3 GLY 133 HA3 GLY 133 -1.087 13.569 5.046 800 H CYS 134 H CYS 134 1.172 13.335 5.081 801 HA CYS 134 HA CYS 134 2.203 11.751 7.328 802 HB2 CYS 134 HB2 CYS 134 2.325 10.679 4.930 803 HB3 CYS 134 HB3 CYS 134 3.693 11.749 4.737 804 H PHE 135 H PHE 135 3.405 13.031 8.649 805 HA PHE 135 HA PHE 135 4.897 15.242 7.417 806 HB2 PHE 135 HB2 PHE 135 5.195 15.077 10.294 807 HB3 PHE 135 HB3 PHE 135 4.572 16.401 9.318 808 HD1 PHE 135 HD1 PHE 135 2.179 16.500 8.775 809 HD2 PHE 135 HD2 PHE 135 3.755 13.625 11.475 810 HE1 PHE 135 HE1 PHE 135 -0.079 16.060 9.616 811 HE2 PHE 135 HE2 PHE 135 1.491 13.182 12.331 812 HZ PHE 135 HZ PHE 135 -0.431 14.393 11.396 813 H VAL 136 H VAL 136 6.814 14.525 6.709 814 HA VAL 136 HA VAL 136 8.101 12.416 8.213 815 HB VAL 136 HB VAL 136 9.297 13.606 5.734 816 HG11 VAL 136 HG11 VAL 136 10.765 11.991 6.216 817 HG12 VAL 136 HG12 VAL 136 9.525 10.856 5.686 818 HG13 VAL 136 HG13 VAL 136 9.686 11.253 7.395 819 HG21 VAL 136 HG21 VAL 136 6.727 12.913 5.625 820 HG22 VAL 136 HG22 VAL 136 7.435 11.308 5.461 821 HG23 VAL 136 HG23 VAL 136 7.845 12.568 4.305 822 H GLY 137 H GLY 137 8.530 13.428 9.999 823 HA2 GLY 137 HA2 GLY 137 10.479 14.143 11.239 824 HA3 GLY 137 HA3 GLY 137 10.954 15.134 9.873 825 H THR 138 H THR 138 8.349 14.816 12.262 826 HA THR 138 HA THR 138 8.536 17.659 12.833 827 HB THR 138 HB THR 138 6.106 17.994 12.642 828 HG1 THR 138 HG1 THR 138 4.896 16.315 12.473 829 HG21 THR 138 HG21 THR 138 6.577 16.923 9.973 830 HG22 THR 138 HG22 THR 138 7.855 17.979 10.565 831 HG23 THR 138 HG23 THR 138 6.196 18.565 10.492 832 H ALA 139 H ALA 139 6.849 18.088 14.806 833 HA ALA 139 HA ALA 139 7.532 16.067 16.739 834 HB1 ALA 139 HB1 ALA 139 6.397 18.818 16.828 835 HB2 ALA 139 HB2 ALA 139 7.731 18.115 17.743 836 HB3 ALA 139 HB3 ALA 139 6.066 17.732 18.178 837 H GLU 140 H GLU 140 5.026 16.779 14.594 838 HA GLU 140 HA GLU 140 2.829 15.625 16.047 839 HB2 GLU 140 HB2 GLU 140 3.296 16.253 13.143 840 HB3 GLU 140 HB3 GLU 140 1.920 15.275 13.623 841 HG2 GLU 140 HG2 GLU 140 1.104 17.458 13.477 842 HG3 GLU 140 HG3 GLU 140 1.321 17.164 15.203 843 H ALA 141 H ALA 141 5.612 14.462 14.618 844 HA ALA 141 HA ALA 141 4.569 11.715 14.536 845 HB1 ALA 141 HB1 ALA 141 6.961 12.591 12.959 846 HB2 ALA 141 HB2 ALA 141 5.328 12.827 12.338 847 HB3 ALA 141 HB3 ALA 141 5.908 11.201 12.701 848 H LEU 142 H LEU 142 6.908 13.850 16.006 849 HA LEU 142 HA LEU 142 8.903 11.995 16.399 850 HB2 LEU 142 HB2 LEU 142 9.928 13.547 17.664 851 HB3 LEU 142 HB3 LEU 142 8.842 14.438 16.661 852 HG LEU 142 HG LEU 142 8.354 15.600 18.444 853 HD11 LEU 142 HD11 LEU 142 6.281 14.660 18.476 854 HD12 LEU 142 HD12 LEU 142 6.808 14.579 20.153 855 HD13 LEU 142 HD13 LEU 142 6.861 13.149 19.150 856 HD21 LEU 142 HD21 LEU 142 10.382 14.456 19.506 857 HD22 LEU 142 HD22 LEU 142 9.192 13.532 20.423 858 HD23 LEU 142 HD23 LEU 142 9.238 15.290 20.559 859 H ARG 143 H ARG 143 5.831 12.044 17.924 860 HA ARG 143 HA ARG 143 6.615 10.584 20.243 861 HB2 ARG 143 HB2 ARG 143 4.379 10.399 20.735 862 HB3 ARG 143 HB3 ARG 143 4.386 11.834 19.750 863 HG2 ARG 143 HG2 ARG 143 2.714 10.909 18.650 864 HG3 ARG 143 HG3 ARG 143 3.893 9.830 17.912 865 HD2 ARG 143 HD2 ARG 143 1.966 8.652 18.933 866 HD3 ARG 143 HD3 ARG 143 3.519 8.180 19.622 867 HE ARG 143 HE ARG 143 1.436 9.762 20.929 868 HH11 ARG 143 HH11 ARG 143 4.654 8.399 21.074 869 HH12 ARG 143 HH12 ARG 143 4.737 8.468 22.802 870 HH21 ARG 143 HH21 ARG 143 1.568 9.882 23.199 871 HH22 ARG 143 HH22 ARG 143 2.987 9.304 24.006 872 H CYS 144 H CYS 144 6.165 10.054 16.991 873 HA CYS 144 HA CYS 144 5.845 7.278 16.725 874 HB2 CYS 144 HB2 CYS 144 6.937 9.326 14.982 875 HB3 CYS 144 HB3 CYS 144 7.768 7.811 14.750 876 H GLN 145 H GLN 145 8.196 8.539 18.521 877 HA GLN 145 HA GLN 145 10.378 6.733 17.871 878 HB2 GLN 145 HB2 GLN 145 9.987 8.877 19.933 879 HB3 GLN 145 HB3 GLN 145 11.321 7.742 20.064 880 HG2 GLN 145 HG2 GLN 145 10.843 9.391 17.603 881 HG3 GLN 145 HG3 GLN 145 11.803 9.965 18.965 882 HE21 GLN 145 HE21 GLN 145 13.608 8.533 19.630 883 HE22 GLN 145 HE22 GLN 145 14.498 7.731 18.384 884 H GLU 146 H GLU 146 7.569 6.732 19.835 885 HA GLU 146 HA GLU 146 8.644 4.805 21.710 886 HB2 GLU 146 HB2 GLU 146 6.815 6.599 22.194 887 HB3 GLU 146 HB3 GLU 146 5.719 5.450 21.438 888 HG2 GLU 146 HG2 GLU 146 6.936 3.815 23.177 889 HG3 GLU 146 HG3 GLU 146 7.084 5.335 24.053 890 H GLU 147 H GLU 147 7.952 4.562 18.577 891 HA GLU 147 HA GLU 147 6.318 2.174 18.674 892 HB2 GLU 147 HB2 GLU 147 6.879 4.060 16.720 893 HB3 GLU 147 HB3 GLU 147 7.788 2.652 16.194 894 HG2 GLU 147 HG2 GLU 147 5.447 1.481 16.768 895 HG3 GLU 147 HG3 GLU 147 4.880 3.091 16.330 896 H ASN 148 H ASN 148 9.371 2.789 19.617 897 HA ASN 148 HA ASN 148 10.732 0.585 18.369 898 HB2 ASN 148 HB2 ASN 148 11.665 2.819 19.513 899 HB3 ASN 148 HB3 ASN 148 11.745 1.753 20.913 900 HD21 ASN 148 HD21 ASN 148 12.765 2.108 17.563 901 HD22 ASN 148 HD22 ASN 148 14.205 1.166 17.711 902 H TYR 149 H TYR 149 8.823 1.128 21.235 903 HA TYR 149 HA TYR 149 9.600 -1.447 22.379 904 HB2 TYR 149 HB2 TYR 149 7.713 0.722 23.314 905 HB3 TYR 149 HB3 TYR 149 7.927 -0.806 24.164 906 HD1 TYR 149 HD1 TYR 149 10.154 -1.364 25.144 907 HD2 TYR 149 HD2 TYR 149 9.303 2.476 23.521 908 HE1 TYR 149 HE1 TYR 149 12.103 -0.440 26.322 909 HE2 TYR 149 HE2 TYR 149 11.249 3.411 24.697 910 HH TYR 149 HH TYR 149 13.471 2.482 25.604 911 H LEU 150 H LEU 150 7.794 -0.746 19.852 912 HA LEU 150 HA LEU 150 6.025 -3.017 20.266 913 HB2 LEU 150 HB2 LEU 150 5.108 -0.210 19.802 914 HB3 LEU 150 HB3 LEU 150 4.207 -1.526 19.073 915 HG LEU 150 HG LEU 150 4.523 -2.317 21.720 916 HD11 LEU 150 HD11 LEU 150 5.136 0.287 21.851 917 HD12 LEU 150 HD12 LEU 150 4.297 -0.578 23.138 918 HD13 LEU 150 HD13 LEU 150 3.380 0.390 21.984 919 HD21 LEU 150 HD21 LEU 150 2.121 -0.862 20.649 920 HD22 LEU 150 HD22 LEU 150 2.176 -2.176 21.825 921 HD23 LEU 150 HD23 LEU 150 2.552 -2.492 20.131 922 HA PRO 151 HA PRO 151 7.758 -3.146 16.070 923 HB2 PRO 151 HB2 PRO 151 7.992 -5.795 15.868 924 HB3 PRO 151 HB3 PRO 151 9.104 -4.855 16.872 925 HG2 PRO 151 HG2 PRO 151 6.724 -6.479 17.689 926 HG3 PRO 151 HG3 PRO 151 8.325 -6.379 18.449 927 HD2 PRO 151 HD2 PRO 151 6.105 -4.995 19.315 928 HD3 PRO 151 HD3 PRO 151 7.779 -4.488 19.614 929 H SER 152 H SER 152 4.849 -2.905 16.653 930 HA SER 152 HA SER 152 3.881 -3.896 14.162 931 HB2 SER 152 HB2 SER 152 2.702 -5.153 16.650 932 HB3 SER 152 HB3 SER 152 2.226 -5.459 14.988 933 HG SER 152 HG SER 152 3.764 -6.856 14.845 934 HA PRO 153 HA PRO 153 1.351 -0.348 15.507 935 HB2 PRO 153 HB2 PRO 153 1.188 0.863 13.132 936 HB3 PRO 153 HB3 PRO 153 2.698 0.859 14.043 937 HG2 PRO 153 HG2 PRO 153 1.899 -0.800 11.692 938 HG3 PRO 153 HG3 PRO 153 3.465 -0.058 12.063 939 HD2 PRO 153 HD2 PRO 153 2.773 -2.721 12.534 940 HD3 PRO 153 HD3 PRO 153 4.137 -1.861 13.272 941 H CYS 154 H CYS 154 -0.381 0.478 13.060 942 HA CYS 154 HA CYS 154 -2.216 -1.807 13.020 943 HB2 CYS 154 HB2 CYS 154 -4.103 -0.620 13.641 944 HB3 CYS 154 HB3 CYS 154 -2.884 0.047 14.710 945 H GLN 155 H GLN 155 -2.564 -2.421 11.056 946 HA GLN 155 HA GLN 155 -2.670 -2.495 8.775 947 HB2 GLN 155 HB2 GLN 155 -4.523 -0.574 9.688 948 HB3 GLN 155 HB3 GLN 155 -3.810 0.079 8.230 949 HG2 GLN 155 HG2 GLN 155 -4.696 -2.739 8.162 950 HG3 GLN 155 HG3 GLN 155 -5.945 -1.497 8.206 951 HE21 GLN 155 HE21 GLN 155 -4.494 -3.444 6.176 952 HE22 GLN 155 HE22 GLN 155 -4.412 -2.473 4.754 953 H SER 156 H SER 156 -2.475 -0.881 6.712 954 HA SER 156 HA SER 156 -0.191 0.898 6.980 955 HB2 SER 156 HB2 SER 156 0.078 -1.794 6.041 956 HB3 SER 156 HB3 SER 156 0.352 -0.705 4.686 957 HG SER 156 HG SER 156 2.153 -1.310 6.283 958 H GLY 157 H GLY 157 -1.086 -0.500 3.923 959 HA2 GLY 157 HA2 GLY 157 -3.254 0.968 3.058 960 HA3 GLY 157 HA3 GLY 157 -1.840 2.006 2.815 961 H GLN 158 H GLN 158 -3.676 0.235 0.900 962 HA GLN 158 HA GLN 158 -1.365 -1.237 -0.208 963 HB2 GLN 158 HB2 GLN 158 -3.483 -2.458 0.471 964 HB3 GLN 158 HB3 GLN 158 -4.285 -1.643 -0.862 965 HG2 GLN 158 HG2 GLN 158 -2.585 -2.673 -2.383 966 HG3 GLN 158 HG3 GLN 158 -2.038 -3.630 -1.007 967 HE21 GLN 158 HE21 GLN 158 -3.804 -4.886 0.113 968 HE22 GLN 158 HE22 GLN 158 -4.987 -5.641 -0.896 969 H LYS 159 H LYS 159 -0.935 1.063 -0.878 970 HA LYS 159 HA LYS 159 -1.730 1.291 -3.664 971 HB2 LYS 159 HB2 LYS 159 -2.404 3.225 -2.005 972 HB3 LYS 159 HB3 LYS 159 -0.754 3.739 -2.340 973 HG2 LYS 159 HG2 LYS 159 -2.271 4.818 -3.872 974 HG3 LYS 159 HG3 LYS 159 -1.242 3.689 -4.749 975 HD2 LYS 159 HD2 LYS 159 -3.322 3.237 -5.653 976 HD3 LYS 159 HD3 LYS 159 -3.221 2.028 -4.374 977 HE2 LYS 159 HE2 LYS 159 -4.301 4.479 -3.346 978 HE3 LYS 159 HE3 LYS 159 -5.219 3.956 -4.752 979 HZ1 LYS 159 HZ1 LYS 159 -6.084 2.253 -3.629 980 HZ2 LYS 159 HZ2 LYS 159 -5.565 3.051 -2.232 981 HZ3 LYS 159 HZ3 LYS 159 -4.611 1.831 -2.911 982 HA PRO 160 HA PRO 160 2.836 0.739 -2.792 983 HB2 PRO 160 HB2 PRO 160 3.328 -1.593 -4.131 984 HB3 PRO 160 HB3 PRO 160 2.887 -1.511 -2.421 985 HG2 PRO 160 HG2 PRO 160 1.167 -2.099 -4.796 986 HG3 PRO 160 HG3 PRO 160 1.162 -2.856 -3.193 987 HD2 PRO 160 HD2 PRO 160 -0.661 -0.988 -3.933 988 HD3 PRO 160 HD3 PRO 160 -0.102 -1.161 -2.259 989 H CYS 161 H CYS 161 2.879 2.520 -4.098 990 HA CYS 161 HA CYS 161 3.416 2.112 -6.930 991 HB2 CYS 161 HB2 CYS 161 3.529 4.776 -6.771 992 HB3 CYS 161 HB3 CYS 161 2.015 3.910 -6.989 993 H GLY 162 H GLY 162 5.184 4.278 -7.230 994 HA2 GLY 162 HA2 GLY 162 7.471 4.594 -7.272 995 HA3 GLY 162 HA3 GLY 162 7.188 4.527 -5.544 996 H SER 163 H SER 163 9.368 3.966 -5.688 997 HA SER 163 HA SER 163 10.233 1.335 -6.466 998 HB2 SER 163 HB2 SER 163 12.429 2.105 -5.633 999 HB3 SER 163 HB3 SER 163 11.728 3.242 -6.786 1000 HG SER 163 HG SER 163 12.422 4.444 -5.072 1001 H GLY 164 H GLY 164 8.247 1.087 -4.741 1002 HA2 GLY 164 HA2 GLY 164 8.272 -0.817 -3.219 1003 HA3 GLY 164 HA3 GLY 164 9.590 -0.048 -2.362 1004 H GLY 165 H GLY 165 7.392 2.314 -3.069 1005 HA2 GLY 165 HA2 GLY 165 6.370 2.075 -0.329 1006 HA3 GLY 165 HA3 GLY 165 6.434 3.553 -1.240 1007 H ARG 166 H ARG 166 4.423 2.051 0.395 1008 HA ARG 166 HA ARG 166 2.216 2.053 -1.507 1009 HB2 ARG 166 HB2 ARG 166 1.026 0.955 0.615 1010 HB3 ARG 166 HB3 ARG 166 1.889 -0.003 -0.578 1011 HG2 ARG 166 HG2 ARG 166 3.337 1.042 1.816 1012 HG3 ARG 166 HG3 ARG 166 2.301 -0.378 1.961 1013 HD2 ARG 166 HD2 ARG 166 4.523 -0.108 -0.061 1014 HD3 ARG 166 HD3 ARG 166 4.711 -0.882 1.511 1015 HE ARG 166 HE ARG 166 2.583 -2.156 0.365 1016 HH11 ARG 166 HH11 ARG 166 5.906 -1.599 -0.571 1017 HH12 ARG 166 HH12 ARG 166 6.023 -3.069 -1.480 1018 HH21 ARG 166 HH21 ARG 166 2.747 -4.087 -0.828 1019 HH22 ARG 166 HH22 ARG 166 4.233 -4.478 -1.626 1020 H CYS 167 H CYS 167 0.188 3.188 -0.797 1021 HA CYS 167 HA CYS 167 0.743 5.678 0.161 1022 HB2 CYS 167 HB2 CYS 167 -1.734 4.139 -0.409 1023 HB3 CYS 167 HB3 CYS 167 -1.906 5.597 0.560 1024 H ALA 168 H ALA 168 1.489 6.079 2.181 1025 HA ALA 168 HA ALA 168 0.548 4.528 4.442 1026 HB1 ALA 168 HB1 ALA 168 2.198 5.543 5.717 1027 HB2 ALA 168 HB2 ALA 168 2.204 7.008 4.735 1028 HB3 ALA 168 HB3 ALA 168 2.938 5.527 4.114 1029 H ALA 169 H ALA 169 -0.066 7.476 2.824 1030 HA ALA 169 HA ALA 169 -2.483 7.937 4.390 1031 HB1 ALA 169 HB1 ALA 169 -1.128 8.928 5.924 1032 HB2 ALA 169 HB2 ALA 169 -1.814 10.265 5.035 1033 HB3 ALA 169 HB3 ALA 169 -0.155 9.762 4.742 1034 H ALA 170 H ALA 170 -3.694 9.853 3.726 1035 HA ALA 170 HA ALA 170 -4.300 9.886 1.091 1036 HB1 ALA 170 HB1 ALA 170 -4.604 12.590 1.878 1037 HB2 ALA 170 HB2 ALA 170 -4.882 11.588 3.289 1038 HB3 ALA 170 HB3 ALA 170 -5.830 11.316 1.832 1039 H GLY 171 H GLY 171 -2.682 9.866 -0.372 1040 HA2 GLY 171 HA2 GLY 171 -1.405 10.927 -1.937 1041 HA3 GLY 171 HA3 GLY 171 -1.377 12.366 -0.967 1042 H ILE 172 H ILE 172 -0.449 9.447 0.529 1043 HA ILE 172 HA ILE 172 2.418 10.197 0.179 1044 HB ILE 172 HB ILE 172 1.898 8.437 2.502 1045 HG12 ILE 172 HG12 ILE 172 0.044 9.819 2.941 1046 HG13 ILE 172 HG13 ILE 172 1.345 10.497 3.895 1047 HG21 ILE 172 HG21 ILE 172 3.789 9.411 3.279 1048 HG22 ILE 172 HG22 ILE 172 3.369 11.004 2.649 1049 HG23 ILE 172 HG23 ILE 172 4.010 9.766 1.565 1050 HD11 ILE 172 HD11 ILE 172 1.319 11.584 1.298 1051 HD12 ILE 172 HD12 ILE 172 1.218 12.416 2.851 1052 HD13 ILE 172 HD13 ILE 172 -0.248 11.820 2.066 1053 H CYS 173 H CYS 173 3.097 8.893 -1.384 1054 HA CYS 173 HA CYS 173 2.511 6.046 -1.304 1055 HB2 CYS 173 HB2 CYS 173 2.400 7.257 -3.449 1056 HB3 CYS 173 HB3 CYS 173 4.082 7.736 -3.252 1057 H CYS 174 H CYS 174 3.755 5.221 0.447 1058 HA CYS 174 HA CYS 174 6.564 5.065 -0.085 1059 HB2 CYS 174 HB2 CYS 174 7.258 6.282 1.935 1060 HB3 CYS 174 HB3 CYS 174 6.524 7.261 0.684 1061 H SER 175 H SER 175 7.748 4.623 2.140 1062 HA SER 175 HA SER 175 6.432 2.366 3.507 1063 HB2 SER 175 HB2 SER 175 9.287 2.623 2.503 1064 HB3 SER 175 HB3 SER 175 8.742 1.338 3.567 1065 HG SER 175 HG SER 175 8.747 1.064 1.121 1066 HA PRO 176 HA PRO 176 7.804 4.236 7.286 1067 HB2 PRO 176 HB2 PRO 176 9.279 2.444 8.675 1068 HB3 PRO 176 HB3 PRO 176 7.537 2.267 8.434 1069 HG2 PRO 176 HG2 PRO 176 9.797 0.950 6.983 1070 HG3 PRO 176 HG3 PRO 176 8.268 0.249 7.546 1071 HD2 PRO 176 HD2 PRO 176 8.708 0.980 4.975 1072 HD3 PRO 176 HD3 PRO 176 7.101 1.017 5.722 1073 H ASP 177 H ASP 177 9.698 4.562 4.973 1074 HA ASP 177 HA ASP 177 12.008 5.481 6.538 1075 HB2 ASP 177 HB2 ASP 177 12.376 3.300 5.136 1076 HB3 ASP 177 HB3 ASP 177 12.400 4.401 3.761 1077 H GLY 178 H GLY 178 10.717 5.558 3.209 1078 HA2 GLY 178 HA2 GLY 178 11.074 8.475 3.247 1079 HA3 GLY 178 HA3 GLY 178 11.287 7.518 1.818 1080 H CYS 179 H CYS 179 9.660 9.412 1.265 1081 HA CYS 179 HA CYS 179 7.133 8.095 1.050 1082 HB2 CYS 179 HB2 CYS 179 7.421 10.535 2.713 1083 HB3 CYS 179 HB3 CYS 179 5.921 10.251 1.828 1084 H HIS 180 H HIS 180 5.533 9.228 -0.427 1085 HA HIS 180 HA HIS 180 6.891 11.132 -2.213 1086 HB2 HIS 180 HB2 HIS 180 6.112 8.347 -2.879 1087 HB3 HIS 180 HB3 HIS 180 5.727 9.572 -4.076 1088 HD1 HIS 180 HD1 HIS 180 8.724 8.219 -2.195 1089 HD2 HIS 180 HD2 HIS 180 7.805 10.276 -5.680 1090 HE1 HIS 180 HE1 HIS 180 10.873 8.336 -3.492 1091 HE2 HIS 180 HE2 HIS 180 10.300 9.612 -5.585 1092 H GLU 181 H GLU 181 5.572 12.561 -3.182 1093 HA GLU 181 HA GLU 181 2.930 12.900 -2.224 1094 HB2 GLU 181 HB2 GLU 181 4.361 14.722 -3.070 1095 HB3 GLU 181 HB3 GLU 181 4.223 14.082 -4.684 1096 HG2 GLU 181 HG2 GLU 181 1.712 14.362 -4.368 1097 HG3 GLU 181 HG3 GLU 181 2.133 15.370 -2.983 1098 H ASP 182 H ASP 182 1.126 11.851 -2.886 1099 HA ASP 182 HA ASP 182 1.085 11.103 -5.699 1100 HB2 ASP 182 HB2 ASP 182 1.197 8.885 -5.342 1101 HB3 ASP 182 HB3 ASP 182 1.589 9.242 -3.660 1102 HA PRO 183 HA PRO 183 -2.832 13.257 -5.015 1103 HB2 PRO 183 HB2 PRO 183 -3.119 12.863 -7.923 1104 HB3 PRO 183 HB3 PRO 183 -3.142 14.354 -6.979 1105 HG2 PRO 183 HG2 PRO 183 -1.061 13.718 -8.541 1106 HG3 PRO 183 HG3 PRO 183 -0.842 14.557 -6.994 1107 HD2 PRO 183 HD2 PRO 183 -0.425 11.669 -7.665 1108 HD3 PRO 183 HD3 PRO 183 0.555 12.739 -6.642 1109 H ALA 184 H ALA 184 -2.394 10.090 -6.395 1110 HA ALA 184 HA ALA 184 -5.091 9.514 -6.984 1111 HB1 ALA 184 HB1 ALA 184 -3.021 7.538 -6.051 1112 HB2 ALA 184 HB2 ALA 184 -3.169 8.114 -7.713 1113 HB3 ALA 184 HB3 ALA 184 -4.483 7.197 -6.975 1114 H CYS 185 H CYS 185 -3.200 9.235 -4.049 1115 HA CYS 185 HA CYS 185 -5.508 8.268 -2.550 1116 HB2 CYS 185 HB2 CYS 185 -2.597 8.654 -1.853 1117 HB3 CYS 185 HB3 CYS 185 -3.799 8.235 -0.648 1118 H ASP 186 H ASP 186 -5.971 10.866 -3.487 1119 HA ASP 186 HA ASP 186 -5.079 12.794 -1.544 1120 HB2 ASP 186 HB2 ASP 186 -6.195 12.956 -4.096 1121 HB3 ASP 186 HB3 ASP 186 -7.421 13.639 -3.016 1122 HA PRO 187 HA PRO 187 -9.508 12.482 0.227 1123 HB2 PRO 187 HB2 PRO 187 -11.484 11.457 -1.212 1124 HB3 PRO 187 HB3 PRO 187 -10.764 12.994 -1.707 1125 HG2 PRO 187 HG2 PRO 187 -10.402 10.273 -2.871 1126 HG3 PRO 187 HG3 PRO 187 -10.435 11.847 -3.682 1127 HD2 PRO 187 HD2 PRO 187 -8.144 10.371 -2.902 1128 HD3 PRO 187 HD3 PRO 187 -8.182 12.027 -3.523 1129 H GLU 188 H GLU 188 -10.249 10.986 1.767 1130 HA GLU 188 HA GLU 188 -9.204 8.826 2.505 1131 HB2 GLU 188 HB2 GLU 188 -11.600 7.701 2.675 1132 HB3 GLU 188 HB3 GLU 188 -11.161 9.095 3.655 1133 HG2 GLU 188 HG2 GLU 188 -12.158 10.062 1.192 1134 HG3 GLU 188 HG3 GLU 188 -13.265 8.841 1.777 1135 H ALA 189 H ALA 189 -7.889 7.554 0.654 1136 HA ALA 189 HA ALA 189 -9.628 6.279 -1.146 1137 HB1 ALA 189 HB1 ALA 189 -7.217 7.429 -1.296 1138 HB2 ALA 189 HB2 ALA 189 -7.678 6.059 -2.327 1139 HB3 ALA 189 HB3 ALA 189 -6.713 5.786 -0.871 1140 H ALA 190 H ALA 190 -9.483 6.027 1.917 1141 HA ALA 190 HA ALA 190 -8.425 3.563 2.656 1142 HB1 ALA 190 HB1 ALA 190 -9.957 5.634 3.863 1143 HB2 ALA 190 HB2 ALA 190 -9.013 4.369 4.645 1144 HB3 ALA 190 HB3 ALA 190 -10.711 4.089 4.258 1145 H PHE 191 H PHE 191 -9.432 1.658 3.232 1146 HA PHE 191 HA PHE 191 -11.570 0.767 1.434 1147 HB2 PHE 191 HB2 PHE 191 -9.156 -0.389 2.568 1148 HB3 PHE 191 HB3 PHE 191 -10.554 -1.414 2.871 1149 HD1 PHE 191 HD1 PHE 191 -12.169 -1.136 0.515 1150 HD2 PHE 191 HD2 PHE 191 -7.936 -1.305 0.882 1151 HE1 PHE 191 HE1 PHE 191 -12.010 -2.018 -1.777 1152 HE2 PHE 191 HE2 PHE 191 -7.765 -2.186 -1.406 1153 HZ PHE 191 HZ PHE 191 -9.804 -2.545 -2.740 1154 H SER 192 H SER 192 -13.465 1.413 2.541 1155 HA SER 192 HA SER 192 -15.147 1.288 4.081 1156 HB2 SER 192 HB2 SER 192 -13.648 -1.164 5.040 1157 HB3 SER 192 HB3 SER 192 -15.322 -0.763 5.418 1158 HG SER 192 HG SER 192 -14.918 -0.732 2.748 Start of MODEL 9 1 H1 ALA 1 H1 ALA 1 18.347 40.602 -1.523 2 H2 ALA 1 H2 ALA 1 17.674 39.512 -2.665 3 H3 ALA 1 H3 ALA 1 19.332 39.397 -2.241 4 HA ALA 1 HA ALA 1 18.280 39.160 0.136 5 HB1 ALA 1 HB1 ALA 1 16.181 38.305 0.193 6 HB2 ALA 1 HB2 ALA 1 16.351 37.496 -1.365 7 HB3 ALA 1 HB3 ALA 1 16.019 39.227 -1.301 8 H VAL 2 H VAL 2 19.414 37.428 0.979 9 HA VAL 2 HA VAL 2 21.054 35.934 -0.699 10 HB VAL 2 HB VAL 2 21.608 36.281 1.619 11 HG11 VAL 2 HG11 VAL 2 20.263 35.914 3.349 12 HG12 VAL 2 HG12 VAL 2 19.833 34.297 2.794 13 HG13 VAL 2 HG13 VAL 2 18.987 35.704 2.150 14 HG21 VAL 2 HG21 VAL 2 22.878 34.476 1.414 15 HG22 VAL 2 HG22 VAL 2 21.684 33.689 0.381 16 HG23 VAL 2 HG23 VAL 2 21.577 33.529 2.134 17 H LEU 3 H LEU 3 20.042 34.731 -2.356 18 HA LEU 3 HA LEU 3 18.833 32.252 -1.485 19 HB2 LEU 3 HB2 LEU 3 16.671 32.479 -2.115 20 HB3 LEU 3 HB3 LEU 3 17.002 34.083 -1.504 21 HG LEU 3 HG LEU 3 17.484 33.915 -4.363 22 HD11 LEU 3 HD11 LEU 3 15.789 32.547 -4.894 23 HD12 LEU 3 HD12 LEU 3 14.753 33.906 -4.462 24 HD13 LEU 3 HD13 LEU 3 15.083 32.641 -3.281 25 HD21 LEU 3 HD21 LEU 3 17.230 36.062 -3.647 26 HD22 LEU 3 HD22 LEU 3 16.070 35.623 -2.393 27 HD23 LEU 3 HD23 LEU 3 15.554 35.722 -4.077 28 H ASP 4 H ASP 4 19.251 30.703 -2.705 29 HA ASP 4 HA ASP 4 20.470 31.069 -5.328 30 HB2 ASP 4 HB2 ASP 4 21.116 29.362 -3.263 31 HB3 ASP 4 HB3 ASP 4 20.129 28.327 -4.290 32 H LEU 5 H LEU 5 18.763 31.665 -6.457 33 HA LEU 5 HA LEU 5 17.005 29.856 -7.441 34 HB2 LEU 5 HB2 LEU 5 16.055 30.639 -5.250 35 HB3 LEU 5 HB3 LEU 5 15.845 32.174 -6.037 36 HG LEU 5 HG LEU 5 13.774 30.762 -6.009 37 HD11 LEU 5 HD11 LEU 5 14.235 32.393 -7.877 38 HD12 LEU 5 HD12 LEU 5 13.093 31.099 -8.241 39 HD13 LEU 5 HD13 LEU 5 14.750 31.007 -8.839 40 HD21 LEU 5 HD21 LEU 5 14.547 28.924 -8.082 41 HD22 LEU 5 HD22 LEU 5 13.825 28.598 -6.507 42 HD23 LEU 5 HD23 LEU 5 15.576 28.729 -6.663 43 H ASP 6 H ASP 6 15.810 32.722 -7.718 44 HA ASP 6 HA ASP 6 17.494 34.321 -9.372 45 HB2 ASP 6 HB2 ASP 6 16.724 32.162 -10.630 46 HB3 ASP 6 HB3 ASP 6 15.273 33.123 -10.968 47 H VAL 7 H VAL 7 14.550 33.450 -8.450 48 HA VAL 7 HA VAL 7 13.643 36.056 -7.607 49 HB VAL 7 HB VAL 7 12.671 35.884 -9.881 50 HG11 VAL 7 HG11 VAL 7 11.582 33.355 -8.789 51 HG12 VAL 7 HG12 VAL 7 12.175 33.737 -10.405 52 HG13 VAL 7 HG13 VAL 7 10.575 34.281 -9.901 53 HG21 VAL 7 HG21 VAL 7 11.477 36.767 -7.584 54 HG22 VAL 7 HG22 VAL 7 10.222 35.762 -8.310 55 HG23 VAL 7 HG23 VAL 7 10.923 37.096 -9.225 56 H ARG 8 H ARG 8 13.154 35.773 -5.526 57 HA ARG 8 HA ARG 8 12.813 33.171 -4.581 58 HB2 ARG 8 HB2 ARG 8 12.417 34.657 -2.393 59 HB3 ARG 8 HB3 ARG 8 14.016 34.289 -3.009 60 HG2 ARG 8 HG2 ARG 8 14.105 36.563 -2.529 61 HG3 ARG 8 HG3 ARG 8 13.838 36.520 -4.270 62 HD2 ARG 8 HD2 ARG 8 11.387 36.574 -2.648 63 HD3 ARG 8 HD3 ARG 8 12.398 38.012 -2.509 64 HE ARG 8 HE ARG 8 12.238 37.603 -5.187 65 HH11 ARG 8 HH11 ARG 8 9.844 37.946 -2.659 66 HH12 ARG 8 HH12 ARG 8 8.650 38.621 -3.716 67 HH21 ARG 8 HH21 ARG 8 10.665 38.493 -6.567 68 HH22 ARG 8 HH22 ARG 8 9.114 38.930 -5.931 69 H THR 9 H THR 9 10.960 32.251 -4.930 70 HA THR 9 HA THR 9 8.677 33.888 -3.995 71 HB THR 9 HB THR 9 8.048 32.905 -6.126 72 HG1 THR 9 HG1 THR 9 6.835 30.898 -4.874 73 HG21 THR 9 HG21 THR 9 9.931 31.030 -5.747 74 HG22 THR 9 HG22 THR 9 8.632 30.902 -6.933 75 HG23 THR 9 HG23 THR 9 8.480 30.103 -5.368 76 H CYS 10 H CYS 10 9.598 33.788 -2.056 77 HA CYS 10 HA CYS 10 10.410 31.305 -0.887 78 HB2 CYS 10 HB2 CYS 10 10.411 34.097 -0.103 79 HB3 CYS 10 HB3 CYS 10 10.062 33.029 1.254 80 H LEU 11 H LEU 11 8.129 30.504 -1.670 81 HA LEU 11 HA LEU 11 5.733 30.749 -0.506 82 HB2 LEU 11 HB2 LEU 11 6.548 29.036 -2.205 83 HB3 LEU 11 HB3 LEU 11 6.934 28.020 -0.828 84 HG LEU 11 HG LEU 11 4.546 28.155 -0.123 85 HD11 LEU 11 HD11 LEU 11 2.886 29.054 -1.551 86 HD12 LEU 11 HD12 LEU 11 4.050 29.331 -2.846 87 HD13 LEU 11 HD13 LEU 11 4.122 30.300 -1.375 88 HD21 LEU 11 HD21 LEU 11 5.086 26.177 -1.212 89 HD22 LEU 11 HD22 LEU 11 5.350 26.983 -2.757 90 HD23 LEU 11 HD23 LEU 11 3.711 26.780 -2.137 91 HA PRO 12 HA PRO 12 6.537 29.672 3.810 92 HB2 PRO 12 HB2 PRO 12 4.638 31.151 4.916 93 HB3 PRO 12 HB3 PRO 12 6.024 31.925 4.139 94 HG2 PRO 12 HG2 PRO 12 3.226 31.610 3.145 95 HG3 PRO 12 HG3 PRO 12 4.343 32.970 2.942 96 HD2 PRO 12 HD2 PRO 12 3.849 30.913 1.076 97 HD3 PRO 12 HD3 PRO 12 5.166 32.099 1.016 98 H CYS 13 H CYS 13 5.793 27.836 4.826 99 HA CYS 13 HA CYS 13 2.894 27.377 4.821 100 HB2 CYS 13 HB2 CYS 13 3.003 25.340 3.834 101 HB3 CYS 13 HB3 CYS 13 4.406 26.088 3.097 102 H GLY 14 H GLY 14 2.683 24.981 6.082 103 HA2 GLY 14 HA2 GLY 14 2.789 23.901 8.119 104 HA3 GLY 14 HA3 GLY 14 4.162 24.915 8.543 105 HA PRO 15 HA PRO 15 0.659 26.366 11.311 106 HB2 PRO 15 HB2 PRO 15 2.246 26.975 13.383 107 HB3 PRO 15 HB3 PRO 15 1.935 25.252 13.037 108 HG2 PRO 15 HG2 PRO 15 3.991 26.985 11.788 109 HG3 PRO 15 HG3 PRO 15 4.389 25.671 12.977 110 HD2 PRO 15 HD2 PRO 15 4.469 24.954 10.497 111 HD3 PRO 15 HD3 PRO 15 3.245 24.063 11.453 112 H GLY 16 H GLY 16 0.230 28.396 10.549 113 HA2 GLY 16 HA2 GLY 16 0.246 30.532 10.095 114 HA3 GLY 16 HA3 GLY 16 1.723 30.533 11.034 115 H GLY 17 H GLY 17 2.618 28.388 8.739 116 HA2 GLY 17 HA2 GLY 17 3.507 28.562 6.761 117 HA3 GLY 17 HA3 GLY 17 2.797 30.138 6.730 118 H LYS 18 H LYS 18 4.943 28.562 8.901 119 HA LYS 18 HA LYS 18 6.944 30.714 8.761 120 HB2 LYS 18 HB2 LYS 18 7.398 28.689 10.819 121 HB3 LYS 18 HB3 LYS 18 7.433 30.439 10.943 122 HG2 LYS 18 HG2 LYS 18 4.749 29.813 10.673 123 HG3 LYS 18 HG3 LYS 18 5.394 28.562 11.728 124 HD2 LYS 18 HD2 LYS 18 6.520 30.980 12.608 125 HD3 LYS 18 HD3 LYS 18 4.818 31.324 12.281 126 HE2 LYS 18 HE2 LYS 18 4.199 30.271 14.140 127 HE3 LYS 18 HE3 LYS 18 5.067 28.816 13.652 128 HZ1 LYS 18 HZ1 LYS 18 7.034 30.513 14.466 129 HZ2 LYS 18 HZ2 LYS 18 6.391 29.237 15.371 130 HZ3 LYS 18 HZ3 LYS 18 5.792 30.806 15.576 131 H GLY 19 H GLY 19 6.552 27.908 6.951 132 HA2 GLY 19 HA2 GLY 19 9.339 27.238 7.160 133 HA3 GLY 19 HA3 GLY 19 8.060 26.027 6.959 134 H ARG 20 H ARG 20 9.319 25.731 4.594 135 HA ARG 20 HA ARG 20 7.967 27.587 2.820 136 HB2 ARG 20 HB2 ARG 20 10.843 27.164 3.240 137 HB3 ARG 20 HB3 ARG 20 10.344 26.947 1.569 138 HG2 ARG 20 HG2 ARG 20 10.014 29.133 1.258 139 HG3 ARG 20 HG3 ARG 20 9.248 29.341 2.834 140 HD2 ARG 20 HD2 ARG 20 12.081 28.755 3.057 141 HD3 ARG 20 HD3 ARG 20 11.775 30.203 2.099 142 HE ARG 20 HE ARG 20 10.322 30.848 4.118 143 HH11 ARG 20 HH11 ARG 20 13.296 29.019 4.321 144 HH12 ARG 20 HH12 ARG 20 13.668 29.573 5.918 145 HH21 ARG 20 HH21 ARG 20 10.818 31.571 6.215 146 HH22 ARG 20 HH22 ARG 20 12.265 31.019 6.992 147 H CYS 21 H CYS 21 7.691 26.526 0.615 148 HA CYS 21 HA CYS 21 7.526 23.598 0.949 149 HB2 CYS 21 HB2 CYS 21 5.476 25.182 0.397 150 HB3 CYS 21 HB3 CYS 21 6.060 24.982 -1.253 151 H PHE 22 H PHE 22 7.785 22.216 -0.935 152 HA PHE 22 HA PHE 22 9.695 23.321 -2.901 153 HB2 PHE 22 HB2 PHE 22 9.833 20.674 -1.446 154 HB3 PHE 22 HB3 PHE 22 10.801 21.050 -2.867 155 HD1 PHE 22 HD1 PHE 22 10.098 22.129 0.608 156 HD2 PHE 22 HD2 PHE 22 12.813 22.220 -2.667 157 HE1 PHE 22 HE1 PHE 22 11.798 23.166 2.051 158 HE2 PHE 22 HE2 PHE 22 14.520 23.255 -1.229 159 HZ PHE 22 HZ PHE 22 14.013 23.731 1.134 160 H GLY 23 H GLY 23 7.443 20.682 -2.170 161 HA2 GLY 23 HA2 GLY 23 6.825 20.515 -5.057 162 HA3 GLY 23 HA3 GLY 23 6.761 19.133 -3.970 163 HA PRO 24 HA PRO 24 2.522 20.936 -3.995 164 HB2 PRO 24 HB2 PRO 24 1.345 18.443 -4.675 165 HB3 PRO 24 HB3 PRO 24 1.567 19.837 -5.730 166 HG2 PRO 24 HG2 PRO 24 2.848 17.367 -5.988 167 HG3 PRO 24 HG3 PRO 24 3.322 18.874 -6.787 168 HD2 PRO 24 HD2 PRO 24 4.455 17.576 -4.353 169 HD3 PRO 24 HD3 PRO 24 5.271 18.530 -5.612 170 H SER 25 H SER 25 2.638 17.444 -3.208 171 HA SER 25 HA SER 25 1.295 17.995 -0.676 172 HB2 SER 25 HB2 SER 25 1.661 15.602 -2.384 173 HB3 SER 25 HB3 SER 25 1.716 15.263 -0.634 174 HG SER 25 HG SER 25 -0.307 16.696 -0.705 175 H ILE 26 H ILE 26 4.157 18.762 -1.184 176 HA ILE 26 HA ILE 26 5.215 17.487 1.184 177 HB ILE 26 HB ILE 26 6.986 17.655 -1.224 178 HG12 ILE 26 HG12 ILE 26 5.387 15.234 -0.398 179 HG13 ILE 26 HG13 ILE 26 4.975 16.258 -1.770 180 HG21 ILE 26 HG21 ILE 26 7.371 17.097 1.425 181 HG22 ILE 26 HG22 ILE 26 8.492 16.768 0.104 182 HG23 ILE 26 HG23 ILE 26 7.367 15.520 0.642 183 HD11 ILE 26 HD11 ILE 26 6.353 14.056 -2.103 184 HD12 ILE 26 HD12 ILE 26 7.708 15.091 -1.653 185 HD13 ILE 26 HD13 ILE 26 6.711 15.501 -3.048 186 H CYS 27 H CYS 27 5.668 19.047 2.508 187 HA CYS 27 HA CYS 27 7.046 21.458 1.508 188 HB2 CYS 27 HB2 CYS 27 4.552 21.708 2.225 189 HB3 CYS 27 HB3 CYS 27 5.179 21.565 3.864 190 H CYS 28 H CYS 28 8.890 21.955 2.566 191 HA CYS 28 HA CYS 28 9.317 20.757 5.188 192 HB2 CYS 28 HB2 CYS 28 11.711 20.571 3.497 193 HB3 CYS 28 HB3 CYS 28 11.033 19.393 4.604 194 H GLY 29 H GLY 29 10.187 22.241 6.660 195 HA2 GLY 29 HA2 GLY 29 11.840 24.430 5.653 196 HA3 GLY 29 HA3 GLY 29 10.874 24.460 7.126 197 H ASP 30 H ASP 30 13.096 25.085 7.899 198 HA ASP 30 HA ASP 30 15.166 23.245 8.056 199 HB2 ASP 30 HB2 ASP 30 15.261 25.760 8.390 200 HB3 ASP 30 HB3 ASP 30 14.722 25.435 10.034 201 H GLU 31 H GLU 31 12.949 24.197 10.555 202 HA GLU 31 HA GLU 31 13.716 21.790 12.049 203 HB2 GLU 31 HB2 GLU 31 12.285 23.584 13.724 204 HB3 GLU 31 HB3 GLU 31 13.928 22.999 13.903 205 HG2 GLU 31 HG2 GLU 31 14.454 24.896 12.183 206 HG3 GLU 31 HG3 GLU 31 12.908 25.538 12.727 207 H LEU 32 H LEU 32 11.412 22.998 10.204 208 HA LEU 32 HA LEU 32 9.151 21.848 11.529 209 HB2 LEU 32 HB2 LEU 32 9.769 23.998 9.791 210 HB3 LEU 32 HB3 LEU 32 8.722 22.915 8.932 211 HG LEU 32 HG LEU 32 8.075 24.016 11.656 212 HD11 LEU 32 HD11 LEU 32 8.369 25.857 10.073 213 HD12 LEU 32 HD12 LEU 32 6.686 25.677 10.566 214 HD13 LEU 32 HD13 LEU 32 7.207 25.100 8.983 215 HD21 LEU 32 HD21 LEU 32 6.324 22.778 9.537 216 HD22 LEU 32 HD22 LEU 32 5.783 23.408 11.092 217 HD23 LEU 32 HD23 LEU 32 6.846 22.003 11.031 218 H GLY 33 H GLY 33 11.670 21.157 9.414 219 HA2 GLY 33 HA2 GLY 33 12.223 19.382 8.139 220 HA3 GLY 33 HA3 GLY 33 11.032 18.527 9.074 221 H CYS 34 H CYS 34 9.839 17.365 7.600 222 HA CYS 34 HA CYS 34 8.633 18.964 5.435 223 HB2 CYS 34 HB2 CYS 34 10.604 17.369 4.755 224 HB3 CYS 34 HB3 CYS 34 9.339 16.166 4.842 225 H PHE 35 H PHE 35 6.460 18.898 5.424 226 HA PHE 35 HA PHE 35 5.284 16.500 6.584 227 HB2 PHE 35 HB2 PHE 35 3.391 18.501 5.624 228 HB3 PHE 35 HB3 PHE 35 3.540 17.821 7.236 229 HD1 PHE 35 HD1 PHE 35 5.916 18.807 8.355 230 HD2 PHE 35 HD2 PHE 35 3.292 20.782 5.650 231 HE1 PHE 35 HE1 PHE 35 6.693 20.983 9.197 232 HE2 PHE 35 HE2 PHE 35 4.065 22.963 6.486 233 HZ PHE 35 HZ PHE 35 5.768 23.065 8.263 234 H VAL 36 H VAL 36 5.446 15.055 5.005 235 HA VAL 36 HA VAL 36 4.892 15.903 2.288 236 HB VAL 36 HB VAL 36 5.579 13.055 2.979 237 HG11 VAL 36 HG11 VAL 36 6.672 13.148 0.781 238 HG12 VAL 36 HG12 VAL 36 6.232 14.858 0.628 239 HG13 VAL 36 HG13 VAL 36 4.974 13.612 0.684 240 HG21 VAL 36 HG21 VAL 36 7.193 14.540 4.204 241 HG22 VAL 36 HG22 VAL 36 7.691 15.216 2.652 242 HG23 VAL 36 HG23 VAL 36 7.969 13.507 3.002 243 H GLY 37 H GLY 37 2.864 16.428 2.612 244 HA2 GLY 37 HA2 GLY 37 0.654 15.749 1.914 245 HA3 GLY 37 HA3 GLY 37 0.963 14.153 2.574 246 H THR 38 H THR 38 0.139 17.471 3.345 247 HA THR 38 HA THR 38 -1.492 16.659 5.577 248 HB THR 38 HB THR 38 -0.363 18.051 7.258 249 HG1 THR 38 HG1 THR 38 0.642 19.444 5.638 250 HG21 THR 38 HG21 THR 38 0.415 15.605 6.765 251 HG22 THR 38 HG22 THR 38 1.303 16.631 7.892 252 HG23 THR 38 HG23 THR 38 1.895 16.410 6.245 253 H ALA 39 H ALA 39 -2.847 18.586 6.397 254 HA ALA 39 HA ALA 39 -3.633 20.243 4.311 255 HB1 ALA 39 HB1 ALA 39 -4.024 20.508 7.293 256 HB2 ALA 39 HB2 ALA 39 -5.099 19.694 6.156 257 HB3 ALA 39 HB3 ALA 39 -4.895 21.443 6.078 258 H GLU 40 H GLU 40 -1.060 20.534 6.574 259 HA GLU 40 HA GLU 40 -0.769 23.382 6.489 260 HB2 GLU 40 HB2 GLU 40 1.221 21.223 7.224 261 HB3 GLU 40 HB3 GLU 40 1.473 22.948 7.454 262 HG2 GLU 40 HG2 GLU 40 -0.999 21.916 8.639 263 HG3 GLU 40 HG3 GLU 40 0.481 21.253 9.328 264 H ALA 41 H ALA 41 -0.247 20.883 4.257 265 HA ALA 41 HA ALA 41 1.764 22.319 2.759 266 HB1 ALA 41 HB1 ALA 41 1.643 19.696 3.317 267 HB2 ALA 41 HB2 ALA 41 2.351 20.326 1.830 268 HB3 ALA 41 HB3 ALA 41 0.695 19.719 1.830 269 H LEU 42 H LEU 42 -1.620 21.472 2.889 270 HA LEU 42 HA LEU 42 -2.554 21.542 0.361 271 HB2 LEU 42 HB2 LEU 42 -3.638 22.829 2.846 272 HB3 LEU 42 HB3 LEU 42 -4.512 22.929 1.331 273 HG LEU 42 HG LEU 42 -3.693 20.279 2.490 274 HD11 LEU 42 HD11 LEU 42 -4.962 21.321 4.232 275 HD12 LEU 42 HD12 LEU 42 -6.002 20.156 3.412 276 HD13 LEU 42 HD13 LEU 42 -6.175 21.880 3.081 277 HD21 LEU 42 HD21 LEU 42 -4.482 20.623 0.071 278 HD22 LEU 42 HD22 LEU 42 -6.070 20.917 0.778 279 HD23 LEU 42 HD23 LEU 42 -5.267 19.367 1.029 280 H ARG 43 H ARG 43 -1.453 24.396 2.159 281 HA ARG 43 HA ARG 43 -2.277 26.275 0.180 282 HB2 ARG 43 HB2 ARG 43 -1.676 27.824 1.696 283 HB3 ARG 43 HB3 ARG 43 -1.477 26.463 2.780 284 HG2 ARG 43 HG2 ARG 43 0.476 27.592 3.134 285 HG3 ARG 43 HG3 ARG 43 0.980 26.483 1.856 286 HD2 ARG 43 HD2 ARG 43 1.783 28.694 1.343 287 HD3 ARG 43 HD3 ARG 43 0.520 28.257 0.193 288 HE ARG 43 HE ARG 43 0.087 30.051 2.495 289 HH11 ARG 43 HH11 ARG 43 -0.513 29.139 -0.827 290 HH12 ARG 43 HH12 ARG 43 -1.591 30.461 -1.123 291 HH21 ARG 43 HH21 ARG 43 -1.330 31.784 2.100 292 HH22 ARG 43 HH22 ARG 43 -2.054 31.961 0.536 293 H CYS 44 H CYS 44 -0.109 24.063 0.198 294 HA CYS 44 HA CYS 44 2.081 25.276 -1.370 295 HB2 CYS 44 HB2 CYS 44 1.521 22.360 -0.883 296 HB3 CYS 44 HB3 CYS 44 2.815 22.906 -1.948 297 H GLN 45 H GLN 45 -0.985 24.061 -2.078 298 HA GLN 45 HA GLN 45 -0.829 23.247 -4.719 299 HB2 GLN 45 HB2 GLN 45 -2.872 23.696 -2.932 300 HB3 GLN 45 HB3 GLN 45 -3.192 24.888 -4.185 301 HG2 GLN 45 HG2 GLN 45 -4.346 23.154 -5.060 302 HG3 GLN 45 HG3 GLN 45 -2.766 22.794 -5.754 303 HE21 GLN 45 HE21 GLN 45 -1.567 21.078 -4.942 304 HE22 GLN 45 HE22 GLN 45 -2.268 19.854 -3.945 305 H GLU 46 H GLU 46 -0.267 26.392 -3.473 306 HA GLU 46 HA GLU 46 -0.871 27.733 -5.979 307 HB2 GLU 46 HB2 GLU 46 -1.032 28.732 -3.581 308 HB3 GLU 46 HB3 GLU 46 0.705 28.961 -3.733 309 HG2 GLU 46 HG2 GLU 46 0.200 30.202 -5.890 310 HG3 GLU 46 HG3 GLU 46 -1.486 30.192 -5.372 311 H GLU 47 H GLU 47 1.421 25.644 -5.189 312 HA GLU 47 HA GLU 47 3.750 27.037 -6.197 313 HB2 GLU 47 HB2 GLU 47 3.649 25.097 -4.444 314 HB3 GLU 47 HB3 GLU 47 3.568 24.059 -5.861 315 HG2 GLU 47 HG2 GLU 47 5.675 25.120 -6.666 316 HG3 GLU 47 HG3 GLU 47 5.773 25.966 -5.122 317 H ASN 48 H ASN 48 1.013 25.856 -7.583 318 HA ASN 48 HA ASN 48 2.117 24.516 -9.874 319 HB2 ASN 48 HB2 ASN 48 -0.569 25.426 -8.990 320 HB3 ASN 48 HB3 ASN 48 -0.322 25.304 -10.730 321 HD21 ASN 48 HD21 ASN 48 -2.142 23.730 -9.378 322 HD22 ASN 48 HD22 ASN 48 -1.611 22.087 -9.422 323 H TYR 49 H TYR 49 1.456 27.786 -8.907 324 HA TYR 49 HA TYR 49 2.329 28.749 -11.563 325 HB2 TYR 49 HB2 TYR 49 -0.053 29.334 -10.199 326 HB3 TYR 49 HB3 TYR 49 0.961 30.752 -9.963 327 HD1 TYR 49 HD1 TYR 49 -0.552 28.566 -12.549 328 HD2 TYR 49 HD2 TYR 49 1.299 32.305 -11.709 329 HE1 TYR 49 HE1 TYR 49 -1.169 29.369 -14.791 330 HE2 TYR 49 HE2 TYR 49 0.689 33.117 -13.948 331 HH TYR 49 HH TYR 49 0.173 31.866 -16.285 332 H LEU 50 H LEU 50 4.137 27.966 -9.596 333 HA LEU 50 HA LEU 50 5.244 30.547 -8.698 334 HB2 LEU 50 HB2 LEU 50 4.564 28.239 -7.179 335 HB3 LEU 50 HB3 LEU 50 6.308 28.404 -7.156 336 HG LEU 50 HG LEU 50 5.959 30.799 -6.413 337 HD11 LEU 50 HD11 LEU 50 3.210 29.921 -5.621 338 HD12 LEU 50 HD12 LEU 50 3.497 30.697 -7.178 339 HD13 LEU 50 HD13 LEU 50 3.888 31.548 -5.683 340 HD21 LEU 50 HD21 LEU 50 6.681 29.563 -4.657 341 HD22 LEU 50 HD22 LEU 50 5.422 28.343 -4.854 342 HD23 LEU 50 HD23 LEU 50 5.046 29.881 -4.077 343 HA PRO 51 HA PRO 51 8.785 29.391 -11.133 344 HB2 PRO 51 HB2 PRO 51 10.374 31.386 -9.748 345 HB3 PRO 51 HB3 PRO 51 9.730 31.427 -11.390 346 HG2 PRO 51 HG2 PRO 51 8.841 33.061 -9.404 347 HG3 PRO 51 HG3 PRO 51 7.824 32.530 -10.756 348 HD2 PRO 51 HD2 PRO 51 7.952 31.472 -7.952 349 HD3 PRO 51 HD3 PRO 51 6.530 31.798 -8.969 350 H SER 52 H SER 52 8.462 27.607 -9.082 351 HA SER 52 HA SER 52 9.607 25.994 -7.983 352 HB2 SER 52 HB2 SER 52 11.829 25.571 -8.469 353 HB3 SER 52 HB3 SER 52 11.353 26.563 -9.846 354 HG SER 52 HG SER 52 12.573 27.597 -7.505 355 HA PRO 53 HA PRO 53 10.389 27.077 -3.811 356 HB2 PRO 53 HB2 PRO 53 12.859 25.975 -3.195 357 HB3 PRO 53 HB3 PRO 53 11.315 25.121 -3.169 358 HG2 PRO 53 HG2 PRO 53 13.408 25.190 -5.299 359 HG3 PRO 53 HG3 PRO 53 12.429 23.826 -4.730 360 HD2 PRO 53 HD2 PRO 53 11.850 25.067 -7.018 361 HD3 PRO 53 HD3 PRO 53 10.560 24.505 -5.933 362 H CYS 54 H CYS 54 12.246 27.747 -2.205 363 HA CYS 54 HA CYS 54 13.638 30.105 -3.321 364 HB2 CYS 54 HB2 CYS 54 11.545 30.165 -1.633 365 HB3 CYS 54 HB3 CYS 54 12.820 29.948 -0.447 366 H GLN 55 H GLN 55 15.897 29.798 -3.268 367 HA GLN 55 HA GLN 55 17.957 29.210 -2.450 368 HB2 GLN 55 HB2 GLN 55 16.708 30.136 -0.253 369 HB3 GLN 55 HB3 GLN 55 16.997 28.481 0.264 370 HG2 GLN 55 HG2 GLN 55 19.427 28.930 -0.524 371 HG3 GLN 55 HG3 GLN 55 18.964 30.626 -0.402 372 HE21 GLN 55 HE21 GLN 55 20.328 31.078 1.289 373 HE22 GLN 55 HE22 GLN 55 20.088 30.462 2.885 374 H SER 56 H SER 56 18.882 27.214 -0.709 375 HA SER 56 HA SER 56 17.543 24.746 -1.569 376 HB2 SER 56 HB2 SER 56 19.686 25.557 -2.955 377 HB3 SER 56 HB3 SER 56 20.511 24.710 -1.644 378 HG SER 56 HG SER 56 19.653 23.552 -3.696 379 H GLY 57 H GLY 57 20.593 25.438 0.215 380 HA2 GLY 57 HA2 GLY 57 20.614 25.458 2.684 381 HA3 GLY 57 HA3 GLY 57 19.296 24.292 2.615 382 H GLN 58 H GLN 58 19.758 22.252 2.640 383 HA GLN 58 HA GLN 58 22.522 21.472 2.061 384 HB2 GLN 58 HB2 GLN 58 20.522 20.076 3.870 385 HB3 GLN 58 HB3 GLN 58 22.146 19.509 3.491 386 HG2 GLN 58 HG2 GLN 58 23.114 20.897 4.968 387 HG3 GLN 58 HG3 GLN 58 22.007 22.220 4.609 388 HE21 GLN 58 HE21 GLN 58 19.678 21.696 5.342 389 HE22 GLN 58 HE22 GLN 58 19.535 21.083 6.951 390 H LYS 59 H LYS 59 22.495 20.625 0.093 391 HA LYS 59 HA LYS 59 19.899 19.726 -0.849 392 HB2 LYS 59 HB2 LYS 59 22.092 21.145 -1.987 393 HB3 LYS 59 HB3 LYS 59 21.924 19.655 -2.897 394 HG2 LYS 59 HG2 LYS 59 19.334 20.582 -2.713 395 HG3 LYS 59 HG3 LYS 59 20.291 22.051 -2.917 396 HD2 LYS 59 HD2 LYS 59 20.621 21.603 -5.076 397 HD3 LYS 59 HD3 LYS 59 21.232 19.992 -4.695 398 HE2 LYS 59 HE2 LYS 59 19.409 19.223 -5.731 399 HE3 LYS 59 HE3 LYS 59 18.525 19.734 -4.294 400 HZ1 LYS 59 HZ1 LYS 59 18.595 22.015 -5.642 401 HZ2 LYS 59 HZ2 LYS 59 17.350 20.882 -5.815 402 HZ3 LYS 59 HZ3 LYS 59 18.611 20.930 -6.942 403 HA PRO 60 HA PRO 60 21.482 15.641 -2.204 404 HB2 PRO 60 HB2 PRO 60 24.242 15.095 -2.132 405 HB3 PRO 60 HB3 PRO 60 23.256 15.365 -3.573 406 HG2 PRO 60 HG2 PRO 60 24.973 17.283 -2.063 407 HG3 PRO 60 HG3 PRO 60 24.698 17.156 -3.810 408 HD2 PRO 60 HD2 PRO 60 23.511 19.077 -2.357 409 HD3 PRO 60 HD3 PRO 60 22.656 18.275 -3.692 410 H CYS 61 H CYS 61 20.982 14.257 -1.058 411 HA CYS 61 HA CYS 61 22.389 13.343 1.291 412 HB2 CYS 61 HB2 CYS 61 20.522 15.049 1.961 413 HB3 CYS 61 HB3 CYS 61 19.416 13.748 1.532 414 H GLY 62 H GLY 62 20.543 11.348 2.014 415 HA2 GLY 62 HA2 GLY 62 20.225 9.092 1.294 416 HA3 GLY 62 HA3 GLY 62 19.038 9.969 0.350 417 H SER 63 H SER 63 19.244 8.091 -1.152 418 HA SER 63 HA SER 63 21.731 7.871 -2.619 419 HB2 SER 63 HB2 SER 63 19.019 6.563 -3.010 420 HB3 SER 63 HB3 SER 63 20.463 6.164 -3.940 421 HG SER 63 HG SER 63 20.614 6.078 -1.147 422 H GLY 64 H GLY 64 21.013 10.476 -2.860 423 HA2 GLY 64 HA2 GLY 64 21.153 11.724 -4.967 424 HA3 GLY 64 HA3 GLY 64 19.924 10.645 -5.604 425 H GLY 65 H GLY 65 19.058 11.250 -2.587 426 HA2 GLY 65 HA2 GLY 65 17.147 13.368 -3.386 427 HA3 GLY 65 HA3 GLY 65 16.978 12.367 -1.958 428 H ARG 66 H ARG 66 17.245 15.441 -2.762 429 HA ARG 66 HA ARG 66 19.446 16.247 -1.114 430 HB2 ARG 66 HB2 ARG 66 18.074 18.572 -1.447 431 HB3 ARG 66 HB3 ARG 66 19.308 17.968 -2.541 432 HG2 ARG 66 HG2 ARG 66 16.366 17.403 -2.882 433 HG3 ARG 66 HG3 ARG 66 17.178 18.793 -3.598 434 HD2 ARG 66 HD2 ARG 66 17.465 15.886 -4.236 435 HD3 ARG 66 HD3 ARG 66 17.216 17.250 -5.321 436 HE ARG 66 HE ARG 66 19.716 17.560 -4.118 437 HH11 ARG 66 HH11 ARG 66 18.122 15.406 -6.365 438 HH12 ARG 66 HH12 ARG 66 19.592 14.955 -7.164 439 HH21 ARG 66 HH21 ARG 66 21.644 16.961 -5.172 440 HH22 ARG 66 HH22 ARG 66 21.588 15.835 -6.487 441 H CYS 67 H CYS 67 19.362 17.492 0.818 442 HA CYS 67 HA CYS 67 17.566 16.489 2.594 443 HB2 CYS 67 HB2 CYS 67 19.987 17.131 3.015 444 HB3 CYS 67 HB3 CYS 67 19.440 18.803 3.047 445 H ALA 68 H ALA 68 15.481 17.217 2.650 446 HA ALA 68 HA ALA 68 14.973 19.960 1.790 447 HB1 ALA 68 HB1 ALA 68 12.624 19.384 1.973 448 HB2 ALA 68 HB2 ALA 68 13.047 17.834 2.700 449 HB3 ALA 68 HB3 ALA 68 13.496 18.177 1.030 450 H ALA 69 H ALA 69 15.391 18.096 4.574 451 HA ALA 69 HA ALA 69 15.451 20.402 6.345 452 HB1 ALA 69 HB1 ALA 69 13.389 18.350 7.060 453 HB2 ALA 69 HB2 ALA 69 12.972 19.704 6.010 454 HB3 ALA 69 HB3 ALA 69 13.574 20.005 7.640 455 H ALA 70 H ALA 70 16.122 19.672 8.597 456 HA ALA 70 HA ALA 70 18.167 17.779 8.500 457 HB1 ALA 70 HB1 ALA 70 17.093 18.007 11.184 458 HB2 ALA 70 HB2 ALA 70 17.252 19.578 10.400 459 HB3 ALA 70 HB3 ALA 70 18.660 18.518 10.546 460 H GLY 71 H GLY 71 18.365 15.631 9.020 461 HA2 GLY 71 HA2 GLY 71 17.765 13.473 9.506 462 HA3 GLY 71 HA3 GLY 71 16.292 14.087 10.198 463 H ILE 72 H ILE 72 15.060 15.255 7.969 464 HA ILE 72 HA ILE 72 14.323 12.896 6.385 465 HB ILE 72 HB ILE 72 12.420 14.222 5.759 466 HG12 ILE 72 HG12 ILE 72 12.495 16.412 7.488 467 HG13 ILE 72 HG13 ILE 72 14.073 16.404 6.688 468 HG21 ILE 72 HG21 ILE 72 13.107 13.308 8.338 469 HG22 ILE 72 HG22 ILE 72 11.504 13.439 7.615 470 HG23 ILE 72 HG23 ILE 72 12.168 14.786 8.539 471 HD11 ILE 72 HD11 ILE 72 11.906 15.788 4.913 472 HD12 ILE 72 HD12 ILE 72 13.202 16.987 4.738 473 HD13 ILE 72 HD13 ILE 72 11.736 17.391 5.647 474 H CYS 73 H CYS 73 15.804 12.622 4.761 475 HA CYS 73 HA CYS 73 16.505 14.874 3.039 476 HB2 CYS 73 HB2 CYS 73 17.457 12.010 2.844 477 HB3 CYS 73 HB3 CYS 73 18.152 13.419 2.050 478 H CYS 74 H CYS 74 14.932 15.349 1.683 479 HA CYS 74 HA CYS 74 13.224 13.316 0.576 480 HB2 CYS 74 HB2 CYS 74 13.248 16.286 0.033 481 HB3 CYS 74 HB3 CYS 74 11.933 15.162 -0.301 482 H SER 75 H SER 75 13.453 12.320 -1.254 483 HA SER 75 HA SER 75 15.580 13.003 -3.095 484 HB2 SER 75 HB2 SER 75 13.575 10.730 -3.124 485 HB3 SER 75 HB3 SER 75 14.968 10.875 -4.195 486 HG SER 75 HG SER 75 16.185 11.002 -2.093 487 HA PRO 76 HA PRO 76 13.079 14.750 -6.312 488 HB2 PRO 76 HB2 PRO 76 13.514 13.382 -8.591 489 HB3 PRO 76 HB3 PRO 76 14.779 14.352 -7.828 490 HG2 PRO 76 HG2 PRO 76 14.331 11.393 -7.713 491 HG3 PRO 76 HG3 PRO 76 15.847 12.286 -7.933 492 HD2 PRO 76 HD2 PRO 76 15.065 11.246 -5.539 493 HD3 PRO 76 HD3 PRO 76 16.078 12.696 -5.684 494 H ASP 77 H ASP 77 11.834 12.537 -4.744 495 HA ASP 77 HA ASP 77 9.490 12.197 -6.435 496 HB2 ASP 77 HB2 ASP 77 9.303 9.785 -5.782 497 HB3 ASP 77 HB3 ASP 77 10.655 10.131 -6.855 498 H GLY 78 H GLY 78 11.030 12.221 -3.317 499 HA2 GLY 78 HA2 GLY 78 8.785 13.307 -1.998 500 HA3 GLY 78 HA3 GLY 78 8.873 11.587 -1.647 501 H CYS 79 H CYS 79 9.601 11.446 0.410 502 HA CYS 79 HA CYS 79 12.147 12.783 1.025 503 HB2 CYS 79 HB2 CYS 79 9.760 12.560 2.862 504 HB3 CYS 79 HB3 CYS 79 11.361 13.092 3.370 505 H HIS 80 H HIS 80 13.589 11.651 2.422 506 HA HIS 80 HA HIS 80 12.867 8.828 2.864 507 HB2 HIS 80 HB2 HIS 80 13.938 8.555 0.828 508 HB3 HIS 80 HB3 HIS 80 14.966 9.958 1.057 509 HD1 HIS 80 HD1 HIS 80 14.679 6.541 2.755 510 HD2 HIS 80 HD2 HIS 80 17.517 9.195 1.286 511 HE1 HIS 80 HE1 HIS 80 16.903 5.429 3.139 512 HE2 HIS 80 HE2 HIS 80 18.609 7.107 2.348 513 H GLU 81 H GLU 81 13.219 8.422 4.941 514 HA GLU 81 HA GLU 81 14.522 10.144 6.700 515 HB2 GLU 81 HB2 GLU 81 14.619 8.035 8.221 516 HB3 GLU 81 HB3 GLU 81 13.055 8.701 7.771 517 HG2 GLU 81 HG2 GLU 81 12.502 6.665 7.112 518 HG3 GLU 81 HG3 GLU 81 13.612 6.904 5.764 519 H ASP 82 H ASP 82 16.499 10.640 6.869 520 HA ASP 82 HA ASP 82 18.591 8.640 6.690 521 HB2 ASP 82 HB2 ASP 82 18.522 9.248 4.437 522 HB3 ASP 82 HB3 ASP 82 18.133 10.937 4.771 523 HA PRO 83 HA PRO 83 19.200 11.212 10.415 524 HB2 PRO 83 HB2 PRO 83 21.441 9.276 10.711 525 HB3 PRO 83 HB3 PRO 83 20.230 9.792 11.889 526 HG2 PRO 83 HG2 PRO 83 20.038 7.413 10.736 527 HG3 PRO 83 HG3 PRO 83 18.589 8.401 11.005 528 HD2 PRO 83 HD2 PRO 83 20.123 7.930 8.481 529 HD3 PRO 83 HD3 PRO 83 18.370 8.048 8.728 530 H ALA 84 H ALA 84 21.158 11.005 7.685 531 HA ALA 84 HA ALA 84 23.552 12.141 8.665 532 HB1 ALA 84 HB1 ALA 84 22.364 11.665 6.016 533 HB2 ALA 84 HB2 ALA 84 23.993 11.343 6.611 534 HB3 ALA 84 HB3 ALA 84 23.546 12.971 6.102 535 H CYS 85 H CYS 85 20.454 13.533 8.155 536 HA CYS 85 HA CYS 85 21.570 16.222 7.998 537 HB2 CYS 85 HB2 CYS 85 18.917 15.066 7.324 538 HB3 CYS 85 HB3 CYS 85 19.036 16.786 7.700 539 H ASP 86 H ASP 86 20.985 14.313 10.454 540 HA ASP 86 HA ASP 86 19.352 15.786 12.168 541 HB2 ASP 86 HB2 ASP 86 20.602 13.294 12.192 542 HB3 ASP 86 HB3 ASP 86 21.226 14.160 13.594 543 HA PRO 87 HA PRO 87 23.226 17.675 13.979 544 HB2 PRO 87 HB2 PRO 87 25.088 18.443 12.027 545 HB3 PRO 87 HB3 PRO 87 25.262 17.134 13.192 546 HG2 PRO 87 HG2 PRO 87 25.022 16.893 10.390 547 HG3 PRO 87 HG3 PRO 87 25.020 15.587 11.583 548 HD2 PRO 87 HD2 PRO 87 22.763 16.853 10.167 549 HD3 PRO 87 HD3 PRO 87 22.882 15.238 10.895 550 H GLU 88 H GLU 88 21.104 18.704 13.406 551 HA GLU 88 HA GLU 88 21.273 21.293 13.440 552 HB2 GLU 88 HB2 GLU 88 20.697 22.143 11.300 553 HB3 GLU 88 HB3 GLU 88 21.999 20.989 11.044 554 HG2 GLU 88 HG2 GLU 88 20.637 19.438 10.041 555 HG3 GLU 88 HG3 GLU 88 19.177 20.081 10.783 556 H ALA 89 H ALA 89 19.484 18.444 13.630 557 HA ALA 89 HA ALA 89 16.894 19.648 13.352 558 HB1 ALA 89 HB1 ALA 89 18.024 17.089 12.751 559 HB2 ALA 89 HB2 ALA 89 16.338 17.635 12.567 560 HB3 ALA 89 HB3 ALA 89 16.852 16.882 14.076 561 H ALA 90 H ALA 90 18.084 20.791 15.419 562 HA ALA 90 HA ALA 90 18.311 19.431 17.815 563 HB1 ALA 90 HB1 ALA 90 18.482 22.086 17.123 564 HB2 ALA 90 HB2 ALA 90 18.804 21.402 18.717 565 HB3 ALA 90 HB3 ALA 90 17.213 22.066 18.346 566 H PHE 91 H PHE 91 16.870 20.049 19.897 567 HA PHE 91 HA PHE 91 14.156 19.106 19.274 568 HB2 PHE 91 HB2 PHE 91 15.996 18.613 21.457 569 HB3 PHE 91 HB3 PHE 91 14.447 19.194 22.060 570 HD1 PHE 91 HD1 PHE 91 12.362 17.963 21.474 571 HD2 PHE 91 HD2 PHE 91 16.234 16.436 20.588 572 HE1 PHE 91 HE1 PHE 91 11.404 15.716 21.178 573 HE2 PHE 91 HE2 PHE 91 15.284 14.187 20.287 574 HZ PHE 91 HZ PHE 91 12.865 13.824 20.584 575 H SER 92 H SER 92 13.075 20.961 18.684 576 HA SER 92 HA SER 92 11.910 22.899 18.936 577 HB2 SER 92 HB2 SER 92 11.898 21.710 21.512 578 HB3 SER 92 HB3 SER 92 12.184 23.434 21.740 579 HG SER 92 HG SER 92 10.301 23.250 19.931 580 H1 ALA 101 H1 ALA 101 -9.445 -10.158 8.113 581 H2 ALA 101 H2 ALA 101 -8.198 -9.093 7.608 582 H3 ALA 101 H3 ALA 101 -9.831 -8.567 7.610 583 HA ALA 101 HA ALA 101 -9.809 -9.053 10.045 584 HB1 ALA 101 HB1 ALA 101 -7.970 -9.969 10.869 585 HB2 ALA 101 HB2 ALA 101 -7.114 -8.468 10.515 586 HB3 ALA 101 HB3 ALA 101 -7.128 -9.775 9.331 587 H VAL 102 H VAL 102 -10.039 -7.266 11.204 588 HA VAL 102 HA VAL 102 -9.675 -4.732 9.846 589 HB VAL 102 HB VAL 102 -10.684 -3.858 12.125 590 HG11 VAL 102 HG11 VAL 102 -11.778 -4.735 9.627 591 HG12 VAL 102 HG12 VAL 102 -12.265 -3.387 10.654 592 HG13 VAL 102 HG13 VAL 102 -12.946 -4.991 10.924 593 HG21 VAL 102 HG21 VAL 102 -10.625 -5.862 13.406 594 HG22 VAL 102 HG22 VAL 102 -11.435 -6.775 12.132 595 HG23 VAL 102 HG23 VAL 102 -12.316 -5.535 13.025 596 H LEU 103 H LEU 103 -7.218 -6.078 10.663 597 HA LEU 103 HA LEU 103 -5.834 -3.914 11.522 598 HB2 LEU 103 HB2 LEU 103 -6.982 -4.609 13.781 599 HB3 LEU 103 HB3 LEU 103 -5.726 -5.839 13.825 600 HG LEU 103 HG LEU 103 -4.075 -3.899 13.448 601 HD11 LEU 103 HD11 LEU 103 -4.690 -1.728 13.937 602 HD12 LEU 103 HD12 LEU 103 -6.199 -2.218 14.711 603 HD13 LEU 103 HD13 LEU 103 -6.042 -2.303 12.956 604 HD21 LEU 103 HD21 LEU 103 -4.677 -3.252 16.041 605 HD22 LEU 103 HD22 LEU 103 -3.690 -4.617 15.518 606 HD23 LEU 103 HD23 LEU 103 -5.405 -4.847 15.855 607 H ASP 104 H ASP 104 -4.665 -4.565 9.835 608 HA ASP 104 HA ASP 104 -3.363 -7.161 9.692 609 HB2 ASP 104 HB2 ASP 104 -3.807 -5.047 7.843 610 HB3 ASP 104 HB3 ASP 104 -2.063 -5.210 8.019 611 H LEU 105 H LEU 105 -2.633 -7.034 11.771 612 HA LEU 105 HA LEU 105 -0.022 -6.050 12.196 613 HB2 LEU 105 HB2 LEU 105 -1.461 -4.131 12.558 614 HB3 LEU 105 HB3 LEU 105 -2.480 -5.076 13.607 615 HG LEU 105 HG LEU 105 -0.593 -3.313 14.391 616 HD11 LEU 105 HD11 LEU 105 -2.214 -3.790 15.845 617 HD12 LEU 105 HD12 LEU 105 -0.938 -4.773 16.562 618 HD13 LEU 105 HD13 LEU 105 -2.153 -5.522 15.527 619 HD21 LEU 105 HD21 LEU 105 1.363 -4.241 15.086 620 HD22 LEU 105 HD22 LEU 105 1.078 -5.300 13.705 621 HD23 LEU 105 HD23 LEU 105 0.651 -5.836 15.329 622 H ASP 106 H ASP 106 -0.752 -6.410 15.072 623 HA ASP 106 HA ASP 106 -1.642 -9.141 15.332 624 HB2 ASP 106 HB2 ASP 106 0.695 -9.100 14.411 625 HB3 ASP 106 HB3 ASP 106 1.228 -8.606 16.033 626 H VAL 107 H VAL 107 0.107 -6.524 16.918 627 HA VAL 107 HA VAL 107 -1.750 -6.588 19.162 628 HB VAL 107 HB VAL 107 0.316 -7.623 20.088 629 HG11 VAL 107 HG11 VAL 107 1.632 -5.344 18.694 630 HG12 VAL 107 HG12 VAL 107 2.124 -7.033 18.815 631 HG13 VAL 107 HG13 VAL 107 2.342 -5.950 20.190 632 HG21 VAL 107 HG21 VAL 107 0.681 -6.124 21.926 633 HG22 VAL 107 HG22 VAL 107 -1.015 -6.037 21.453 634 HG23 VAL 107 HG23 VAL 107 0.099 -4.753 20.981 635 H ARG 108 H ARG 108 -2.684 -4.553 18.922 636 HA ARG 108 HA ARG 108 -1.553 -2.811 17.088 637 HB2 ARG 108 HB2 ARG 108 -3.578 -1.379 18.094 638 HB3 ARG 108 HB3 ARG 108 -3.811 -2.646 16.903 639 HG2 ARG 108 HG2 ARG 108 -5.473 -3.039 18.488 640 HG3 ARG 108 HG3 ARG 108 -4.215 -4.200 18.907 641 HD2 ARG 108 HD2 ARG 108 -3.988 -1.587 20.238 642 HD3 ARG 108 HD3 ARG 108 -5.422 -2.519 20.667 643 HE ARG 108 HE ARG 108 -3.404 -4.319 20.888 644 HH11 ARG 108 HH11 ARG 108 -3.951 -1.145 22.250 645 HH12 ARG 108 HH12 ARG 108 -3.042 -1.471 23.688 646 HH21 ARG 108 HH21 ARG 108 -2.214 -4.742 22.781 647 HH22 ARG 108 HH22 ARG 108 -2.057 -3.510 23.988 648 H THR 109 H THR 109 0.118 -1.629 17.584 649 HA THR 109 HA THR 109 -0.195 -0.194 20.132 650 HB THR 109 HB THR 109 2.045 -1.144 20.128 651 HG1 THR 109 HG1 THR 109 3.337 0.799 19.731 652 HG21 THR 109 HG21 THR 109 3.472 -0.238 18.008 653 HG22 THR 109 HG22 THR 109 1.936 -0.656 17.250 654 HG23 THR 109 HG23 THR 109 2.825 -1.870 18.171 655 H CYS 110 H CYS 110 -1.865 0.767 19.144 656 HA CYS 110 HA CYS 110 -1.544 1.980 16.551 657 HB2 CYS 110 HB2 CYS 110 -3.663 1.696 18.535 658 HB3 CYS 110 HB3 CYS 110 -3.725 3.247 17.706 659 H LEU 111 H LEU 111 0.548 2.963 17.421 660 HA LEU 111 HA LEU 111 0.922 5.104 19.014 661 HB2 LEU 111 HB2 LEU 111 2.554 3.905 17.468 662 HB3 LEU 111 HB3 LEU 111 2.064 5.059 16.242 663 HG LEU 111 HG LEU 111 2.797 6.902 17.751 664 HD11 LEU 111 HD11 LEU 111 4.009 6.494 19.724 665 HD12 LEU 111 HD12 LEU 111 4.135 4.769 19.387 666 HD13 LEU 111 HD13 LEU 111 2.580 5.468 19.834 667 HD21 LEU 111 HD21 LEU 111 5.330 5.772 17.664 668 HD22 LEU 111 HD22 LEU 111 4.557 6.734 16.403 669 HD23 LEU 111 HD23 LEU 111 4.445 4.974 16.363 670 HA PRO 112 HA PRO 112 -1.698 8.243 17.081 671 HB2 PRO 112 HB2 PRO 112 -1.948 9.847 19.226 672 HB3 PRO 112 HB3 PRO 112 -2.844 8.332 19.081 673 HG2 PRO 112 HG2 PRO 112 -0.498 8.987 20.761 674 HG3 PRO 112 HG3 PRO 112 -1.799 7.821 21.047 675 HD2 PRO 112 HD2 PRO 112 0.808 7.271 20.080 676 HD3 PRO 112 HD3 PRO 112 -0.558 6.145 20.171 677 H CYS 113 H CYS 113 -1.322 10.472 16.492 678 HA CYS 113 HA CYS 113 0.926 11.843 17.408 679 HB2 CYS 113 HB2 CYS 113 2.665 11.593 15.977 680 HB3 CYS 113 HB3 CYS 113 1.918 10.026 15.748 681 H GLY 114 H GLY 114 1.639 13.644 15.523 682 HA2 GLY 114 HA2 GLY 114 0.912 15.462 14.301 683 HA3 GLY 114 HA3 GLY 114 -0.645 14.663 14.119 684 HA PRO 115 HA PRO 115 -1.386 18.314 16.909 685 HB2 PRO 115 HB2 PRO 115 -3.860 18.804 16.059 686 HB3 PRO 115 HB3 PRO 115 -2.479 19.223 15.009 687 HG2 PRO 115 HG2 PRO 115 -3.803 16.565 15.226 688 HG3 PRO 115 HG3 PRO 115 -3.984 17.659 13.791 689 HD2 PRO 115 HD2 PRO 115 -2.075 15.945 13.622 690 HD3 PRO 115 HD3 PRO 115 -1.509 17.643 13.575 691 H GLY 116 H GLY 116 -1.422 16.899 18.597 692 HA2 GLY 116 HA2 GLY 116 -2.550 16.300 20.602 693 HA3 GLY 116 HA3 GLY 116 -4.027 16.293 19.670 694 H GLY 117 H GLY 117 -1.800 14.701 17.938 695 HA2 GLY 117 HA2 GLY 117 -1.235 12.587 17.617 696 HA3 GLY 117 HA3 GLY 117 -1.797 12.316 19.223 697 H LYS 118 H LYS 118 -3.488 13.527 16.453 698 HA LYS 118 HA LYS 118 -5.564 11.499 16.733 699 HB2 LYS 118 HB2 LYS 118 -5.910 13.394 14.522 700 HB3 LYS 118 HB3 LYS 118 -7.025 12.925 15.794 701 HG2 LYS 118 HG2 LYS 118 -5.062 14.475 17.048 702 HG3 LYS 118 HG3 LYS 118 -5.439 15.299 15.535 703 HD2 LYS 118 HD2 LYS 118 -7.903 14.493 16.583 704 HD3 LYS 118 HD3 LYS 118 -6.979 15.115 17.956 705 HE2 LYS 118 HE2 LYS 118 -7.308 17.206 17.275 706 HE3 LYS 118 HE3 LYS 118 -6.593 16.836 15.707 707 HZ1 LYS 118 HZ1 LYS 118 -8.701 17.507 15.142 708 HZ2 LYS 118 HZ2 LYS 118 -9.425 16.810 16.503 709 HZ3 LYS 118 HZ3 LYS 118 -8.910 15.829 15.226 710 H GLY 119 H GLY 119 -2.702 11.653 15.104 711 HA2 GLY 119 HA2 GLY 119 -3.670 10.127 12.768 712 HA3 GLY 119 HA3 GLY 119 -2.114 10.950 12.880 713 H ARG 120 H ARG 120 -0.911 8.787 12.322 714 HA ARG 120 HA ARG 120 -0.486 7.334 14.721 715 HB2 ARG 120 HB2 ARG 120 -2.186 6.376 12.601 716 HB3 ARG 120 HB3 ARG 120 -0.765 5.346 12.731 717 HG2 ARG 120 HG2 ARG 120 -1.441 4.489 14.719 718 HG3 ARG 120 HG3 ARG 120 -2.179 6.005 15.244 719 HD2 ARG 120 HD2 ARG 120 -3.501 4.763 12.944 720 HD3 ARG 120 HD3 ARG 120 -3.547 3.784 14.407 721 HE ARG 120 HE ARG 120 -4.440 5.947 15.459 722 HH11 ARG 120 HH11 ARG 120 -5.078 4.958 12.165 723 HH12 ARG 120 HH12 ARG 120 -6.604 5.774 12.087 724 HH21 ARG 120 HH21 ARG 120 -6.447 7.014 15.349 725 HH22 ARG 120 HH22 ARG 120 -7.379 6.939 13.891 726 H CYS 121 H CYS 121 1.633 6.190 14.435 727 HA CYS 121 HA CYS 121 3.161 7.425 12.239 728 HB2 CYS 121 HB2 CYS 121 3.678 7.673 14.827 729 HB3 CYS 121 HB3 CYS 121 4.540 6.162 14.559 730 H PHE 122 H PHE 122 5.005 6.288 11.336 731 HA PHE 122 HA PHE 122 4.624 3.358 11.286 732 HB2 PHE 122 HB2 PHE 122 5.139 5.215 8.956 733 HB3 PHE 122 HB3 PHE 122 5.319 3.466 8.861 734 HD1 PHE 122 HD1 PHE 122 2.869 6.157 9.556 735 HD2 PHE 122 HD2 PHE 122 3.474 2.094 8.447 736 HE1 PHE 122 HE1 PHE 122 0.473 5.946 9.035 737 HE2 PHE 122 HE2 PHE 122 1.081 1.876 7.921 738 HZ PHE 122 HZ PHE 122 -0.423 3.803 8.216 739 H GLY 123 H GLY 123 6.841 6.036 10.585 740 HA2 GLY 123 HA2 GLY 123 9.090 4.260 11.319 741 HA3 GLY 123 HA3 GLY 123 9.221 5.555 10.135 742 HA PRO 124 HA PRO 124 10.426 7.399 14.182 743 HB2 PRO 124 HB2 PRO 124 12.890 8.348 13.139 744 HB3 PRO 124 HB3 PRO 124 12.651 6.985 14.231 745 HG2 PRO 124 HG2 PRO 124 13.553 6.829 11.590 746 HG3 PRO 124 HG3 PRO 124 12.952 5.479 12.566 747 HD2 PRO 124 HD2 PRO 124 11.557 7.078 10.470 748 HD3 PRO 124 HD3 PRO 124 11.385 5.357 10.884 749 H SER 125 H SER 125 11.856 9.026 11.333 750 HA SER 125 HA SER 125 10.635 11.533 12.188 751 HB2 SER 125 HB2 SER 125 12.895 10.782 10.429 752 HB3 SER 125 HB3 SER 125 11.951 12.171 9.849 753 HG SER 125 HG SER 125 13.339 11.861 12.309 754 H ILE 126 H ILE 126 9.026 9.271 11.045 755 HA ILE 126 HA ILE 126 7.702 10.850 9.016 756 HB ILE 126 HB ILE 126 8.210 7.941 8.457 757 HG12 ILE 126 HG12 ILE 126 9.879 10.267 7.452 758 HG13 ILE 126 HG13 ILE 126 10.401 9.159 8.715 759 HG21 ILE 126 HG21 ILE 126 7.096 8.357 6.586 760 HG22 ILE 126 HG22 ILE 126 8.020 9.827 6.277 761 HG23 ILE 126 HG23 ILE 126 6.616 9.873 7.343 762 HD11 ILE 126 HD11 ILE 126 11.423 8.409 6.735 763 HD12 ILE 126 HD12 ILE 126 9.925 8.549 5.816 764 HD13 ILE 126 HD13 ILE 126 10.094 7.292 7.040 765 H CYS 127 H CYS 127 5.735 11.107 9.706 766 HA CYS 127 HA CYS 127 4.266 8.804 10.827 767 HB2 CYS 127 HB2 CYS 127 4.975 10.699 12.474 768 HB3 CYS 127 HB3 CYS 127 3.689 11.623 11.705 769 H CYS 128 H CYS 128 2.349 8.401 9.858 770 HA CYS 128 HA CYS 128 1.168 10.508 8.205 771 HB2 CYS 128 HB2 CYS 128 1.111 7.842 6.954 772 HB3 CYS 128 HB3 CYS 128 1.357 9.397 6.185 773 H GLY 129 H GLY 129 -1.285 10.680 8.633 774 HA2 GLY 129 HA2 GLY 129 -2.495 8.160 9.317 775 HA3 GLY 129 HA3 GLY 129 -2.999 9.777 9.799 776 H ASP 130 H ASP 130 -5.011 9.005 8.721 777 HA ASP 130 HA ASP 130 -5.152 8.533 5.994 778 HB2 ASP 130 HB2 ASP 130 -6.848 7.963 7.795 779 HB3 ASP 130 HB3 ASP 130 -7.415 9.617 7.597 780 H GLU 131 H GLU 131 -6.199 11.449 7.624 781 HA GLU 131 HA GLU 131 -5.906 12.874 5.119 782 HB2 GLU 131 HB2 GLU 131 -7.442 14.357 6.939 783 HB3 GLU 131 HB3 GLU 131 -8.034 13.585 5.484 784 HG2 GLU 131 HG2 GLU 131 -8.317 11.520 7.039 785 HG3 GLU 131 HG3 GLU 131 -8.169 12.692 8.343 786 H LEU 132 H LEU 132 -4.125 12.333 7.509 787 HA LEU 132 HA LEU 132 -3.402 15.061 8.116 788 HB2 LEU 132 HB2 LEU 132 -3.850 12.710 9.654 789 HB3 LEU 132 HB3 LEU 132 -2.140 12.999 9.642 790 HG LEU 132 HG LEU 132 -4.167 15.070 10.458 791 HD11 LEU 132 HD11 LEU 132 -4.431 13.240 11.987 792 HD12 LEU 132 HD12 LEU 132 -3.520 14.514 12.797 793 HD13 LEU 132 HD13 LEU 132 -2.683 13.091 12.178 794 HD21 LEU 132 HD21 LEU 132 -2.420 16.378 11.178 795 HD22 LEU 132 HD22 LEU 132 -1.706 15.613 9.758 796 HD23 LEU 132 HD23 LEU 132 -1.328 15.008 11.370 797 H GLY 133 H GLY 133 -2.966 12.211 6.391 798 HA2 GLY 133 HA2 GLY 133 -1.499 11.449 4.960 799 HA3 GLY 133 HA3 GLY 133 -1.030 13.099 4.869 800 H CYS 134 H CYS 134 1.258 13.136 5.003 801 HA CYS 134 HA CYS 134 2.334 11.654 7.299 802 HB2 CYS 134 HB2 CYS 134 2.672 10.502 4.958 803 HB3 CYS 134 HB3 CYS 134 3.964 11.673 4.818 804 H PHE 135 H PHE 135 3.547 12.852 8.557 805 HA PHE 135 HA PHE 135 4.813 15.207 7.363 806 HB2 PHE 135 HB2 PHE 135 5.258 14.930 10.227 807 HB3 PHE 135 HB3 PHE 135 4.554 16.279 9.353 808 HD1 PHE 135 HD1 PHE 135 2.041 15.458 8.410 809 HD2 PHE 135 HD2 PHE 135 3.992 14.295 12.008 810 HE1 PHE 135 HE1 PHE 135 -0.143 14.968 9.433 811 HE2 PHE 135 HE2 PHE 135 1.812 13.801 13.037 812 HZ PHE 135 HZ PHE 135 -0.259 14.136 11.749 813 H VAL 136 H VAL 136 6.544 14.381 6.413 814 HA VAL 136 HA VAL 136 8.077 12.369 7.834 815 HB VAL 136 HB VAL 136 8.879 13.423 5.128 816 HG11 VAL 136 HG11 VAL 136 8.958 10.554 5.835 817 HG12 VAL 136 HG12 VAL 136 10.031 11.619 6.743 818 HG13 VAL 136 HG13 VAL 136 10.140 11.548 4.984 819 HG21 VAL 136 HG21 VAL 136 6.426 12.920 5.043 820 HG22 VAL 136 HG22 VAL 136 6.782 11.254 5.500 821 HG23 VAL 136 HG23 VAL 136 7.376 11.896 3.965 822 H GLY 137 H GLY 137 8.615 13.619 9.462 823 HA2 GLY 137 HA2 GLY 137 10.602 14.571 10.461 824 HA3 GLY 137 HA3 GLY 137 10.936 15.394 8.949 825 H THR 138 H THR 138 8.968 15.409 11.849 826 HA THR 138 HA THR 138 8.868 18.288 11.864 827 HB THR 138 HB THR 138 6.418 18.457 11.991 828 HG1 THR 138 HG1 THR 138 6.098 16.249 12.679 829 HG21 THR 138 HG21 THR 138 7.838 18.120 9.670 830 HG22 THR 138 HG22 THR 138 6.175 18.691 9.798 831 HG23 THR 138 HG23 THR 138 6.500 16.985 9.491 832 H ALA 139 H ALA 139 7.673 19.042 14.092 833 HA ALA 139 HA ALA 139 8.758 17.434 16.162 834 HB1 ALA 139 HB1 ALA 139 7.842 20.067 15.839 835 HB2 ALA 139 HB2 ALA 139 8.524 19.345 17.296 836 HB3 ALA 139 HB3 ALA 139 6.778 19.334 17.039 837 H GLU 140 H GLU 140 5.842 17.646 14.489 838 HA GLU 140 HA GLU 140 4.070 16.432 16.400 839 HB2 GLU 140 HB2 GLU 140 3.838 16.555 13.386 840 HB3 GLU 140 HB3 GLU 140 2.562 16.034 14.478 841 HG2 GLU 140 HG2 GLU 140 3.693 18.667 15.087 842 HG3 GLU 140 HG3 GLU 140 2.863 18.556 13.537 843 H ALA 141 H ALA 141 6.648 15.265 14.637 844 HA ALA 141 HA ALA 141 5.760 12.497 14.623 845 HB1 ALA 141 HB1 ALA 141 6.955 13.859 12.622 846 HB2 ALA 141 HB2 ALA 141 7.120 12.118 12.851 847 HB3 ALA 141 HB3 ALA 141 8.372 13.208 13.447 848 H LEU 142 H LEU 142 7.843 14.804 16.107 849 HA LEU 142 HA LEU 142 9.967 13.432 17.115 850 HB2 LEU 142 HB2 LEU 142 8.215 15.511 18.376 851 HB3 LEU 142 HB3 LEU 142 9.567 14.819 19.248 852 HG LEU 142 HG LEU 142 9.937 16.082 16.545 853 HD11 LEU 142 HD11 LEU 142 8.843 17.726 18.005 854 HD12 LEU 142 HD12 LEU 142 10.511 18.168 17.636 855 HD13 LEU 142 HD13 LEU 142 10.108 17.482 19.210 856 HD21 LEU 142 HD21 LEU 142 11.915 15.066 16.981 857 HD22 LEU 142 HD22 LEU 142 11.667 15.082 18.727 858 HD23 LEU 142 HD23 LEU 142 12.193 16.547 17.897 859 H ARG 143 H ARG 143 6.643 13.270 18.295 860 HA ARG 143 HA ARG 143 7.278 11.646 20.546 861 HB2 ARG 143 HB2 ARG 143 5.118 11.962 21.127 862 HB3 ARG 143 HB3 ARG 143 5.078 13.108 19.805 863 HG2 ARG 143 HG2 ARG 143 3.181 11.895 19.384 864 HG3 ARG 143 HG3 ARG 143 4.345 10.998 18.408 865 HD2 ARG 143 HD2 ARG 143 3.017 9.430 19.656 866 HD3 ARG 143 HD3 ARG 143 4.652 9.432 20.315 867 HE ARG 143 HE ARG 143 2.380 10.834 21.572 868 HH11 ARG 143 HH11 ARG 143 5.322 8.957 21.801 869 HH12 ARG 143 HH12 ARG 143 5.318 8.935 23.533 870 HH21 ARG 143 HH21 ARG 143 2.381 10.803 23.845 871 HH22 ARG 143 HH22 ARG 143 3.649 9.981 24.692 872 H CYS 144 H CYS 144 7.661 10.828 17.209 873 HA CYS 144 HA CYS 144 6.494 8.217 17.430 874 HB2 CYS 144 HB2 CYS 144 8.149 9.772 15.424 875 HB3 CYS 144 HB3 CYS 144 7.776 8.069 15.208 876 H GLN 145 H GLN 145 9.092 9.797 18.666 877 HA GLN 145 HA GLN 145 11.283 8.058 18.169 878 HB2 GLN 145 HB2 GLN 145 10.988 10.440 19.502 879 HB3 GLN 145 HB3 GLN 145 11.270 9.313 20.822 880 HG2 GLN 145 HG2 GLN 145 13.419 9.835 20.369 881 HG3 GLN 145 HG3 GLN 145 13.226 8.519 19.211 882 HE21 GLN 145 HE21 GLN 145 13.076 8.986 17.022 883 HE22 GLN 145 HE22 GLN 145 13.512 10.527 16.374 884 H GLU 146 H GLU 146 8.417 7.689 20.007 885 HA GLU 146 HA GLU 146 9.570 5.710 21.804 886 HB2 GLU 146 HB2 GLU 146 7.562 7.298 22.270 887 HB3 GLU 146 HB3 GLU 146 6.624 6.110 21.375 888 HG2 GLU 146 HG2 GLU 146 7.551 4.384 22.987 889 HG3 GLU 146 HG3 GLU 146 8.107 5.748 23.957 890 H GLU 147 H GLU 147 9.068 5.649 18.642 891 HA GLU 147 HA GLU 147 7.698 3.113 18.394 892 HB2 GLU 147 HB2 GLU 147 7.745 5.105 16.699 893 HB3 GLU 147 HB3 GLU 147 9.278 4.407 16.194 894 HG2 GLU 147 HG2 GLU 147 8.084 2.255 15.801 895 HG3 GLU 147 HG3 GLU 147 6.571 3.099 16.130 896 H ASN 148 H ASN 148 10.679 4.007 19.451 897 HA ASN 148 HA ASN 148 12.318 2.062 18.111 898 HB2 ASN 148 HB2 ASN 148 12.643 3.985 20.351 899 HB3 ASN 148 HB3 ASN 148 13.686 2.566 20.387 900 HD21 ASN 148 HD21 ASN 148 14.678 5.129 20.119 901 HD22 ASN 148 HD22 ASN 148 15.365 5.308 18.544 902 H TYR 149 H TYR 149 10.186 2.143 20.851 903 HA TYR 149 HA TYR 149 10.864 -0.668 21.464 904 HB2 TYR 149 HB2 TYR 149 10.910 1.545 23.187 905 HB3 TYR 149 HB3 TYR 149 9.421 0.697 23.584 906 HD1 TYR 149 HD1 TYR 149 13.098 0.296 23.303 907 HD2 TYR 149 HD2 TYR 149 9.467 -1.307 24.835 908 HE1 TYR 149 HE1 TYR 149 14.383 -1.297 24.667 909 HE2 TYR 149 HE2 TYR 149 10.741 -2.905 26.202 910 HH TYR 149 HH TYR 149 13.901 -2.611 26.908 911 H LEU 150 H LEU 150 9.120 0.026 19.408 912 HA LEU 150 HA LEU 150 6.499 -0.740 20.523 913 HB2 LEU 150 HB2 LEU 150 7.210 1.525 18.953 914 HB3 LEU 150 HB3 LEU 150 6.190 0.488 17.973 915 HG LEU 150 HG LEU 150 4.535 0.497 19.890 916 HD11 LEU 150 HD11 LEU 150 4.913 1.625 21.776 917 HD12 LEU 150 HD12 LEU 150 5.544 3.026 20.911 918 HD13 LEU 150 HD13 LEU 150 6.603 1.663 21.275 919 HD21 LEU 150 HD21 LEU 150 3.960 1.776 18.020 920 HD22 LEU 150 HD22 LEU 150 5.242 2.951 18.316 921 HD23 LEU 150 HD23 LEU 150 3.830 2.902 19.371 922 HA PRO 151 HA PRO 151 6.853 -4.250 17.809 923 HB2 PRO 151 HB2 PRO 151 4.008 -4.744 18.094 924 HB3 PRO 151 HB3 PRO 151 5.363 -5.628 18.798 925 HG2 PRO 151 HG2 PRO 151 3.636 -4.131 20.276 926 HG3 PRO 151 HG3 PRO 151 5.327 -4.402 20.735 927 HD2 PRO 151 HD2 PRO 151 4.086 -2.024 19.394 928 HD3 PRO 151 HD3 PRO 151 5.287 -2.078 20.704 929 H SER 152 H SER 152 6.740 -1.953 16.325 930 HA SER 152 HA SER 152 6.365 -1.273 14.200 931 HB2 SER 152 HB2 SER 152 5.761 -2.782 12.558 932 HB3 SER 152 HB3 SER 152 6.309 -3.863 13.836 933 HG SER 152 HG SER 152 4.099 -4.108 12.680 934 HA PRO 153 HA PRO 153 2.695 1.093 13.846 935 HB2 PRO 153 HB2 PRO 153 1.644 0.487 11.352 936 HB3 PRO 153 HB3 PRO 153 2.922 1.661 11.675 937 HG2 PRO 153 HG2 PRO 153 3.138 -1.172 10.754 938 HG3 PRO 153 HG3 PRO 153 4.069 0.250 10.244 939 HD2 PRO 153 HD2 PRO 153 5.112 -1.539 11.924 940 HD3 PRO 153 HD3 PRO 153 5.418 0.198 12.135 941 H CYS 154 H CYS 154 0.330 1.035 12.919 942 HA CYS 154 HA CYS 154 -1.042 -1.350 14.002 943 HB2 CYS 154 HB2 CYS 154 -1.044 1.098 15.113 944 HB3 CYS 154 HB3 CYS 154 -2.336 1.347 13.952 945 H GLN 155 H GLN 155 -2.082 -2.454 12.354 946 HA GLN 155 HA GLN 155 -3.345 -2.873 10.494 947 HB2 GLN 155 HB2 GLN 155 -4.631 -0.814 11.618 948 HB3 GLN 155 HB3 GLN 155 -4.163 -0.046 10.108 949 HG2 GLN 155 HG2 GLN 155 -5.158 -2.180 9.016 950 HG3 GLN 155 HG3 GLN 155 -5.975 -2.372 10.567 951 HE21 GLN 155 HE21 GLN 155 -8.013 -2.015 9.782 952 HE22 GLN 155 HE22 GLN 155 -8.549 -0.478 9.203 953 H SER 156 H SER 156 -3.850 -1.387 8.114 954 HA SER 156 HA SER 156 -1.207 -0.517 7.260 955 HB2 SER 156 HB2 SER 156 -1.595 -3.064 6.933 956 HB3 SER 156 HB3 SER 156 -2.585 -2.556 5.566 957 HG SER 156 HG SER 156 0.003 -1.507 5.861 958 H GLY 157 H GLY 157 -4.717 -0.524 6.300 959 HA2 GLY 157 HA2 GLY 157 -5.822 0.865 5.109 960 HA3 GLY 157 HA3 GLY 157 -4.352 1.820 5.051 961 H GLN 158 H GLN 158 -3.521 2.158 3.222 962 HA GLN 158 HA GLN 158 -4.173 0.350 1.027 963 HB2 GLN 158 HB2 GLN 158 -3.486 3.294 0.883 964 HB3 GLN 158 HB3 GLN 158 -3.773 2.232 -0.491 965 HG2 GLN 158 HG2 GLN 158 -6.000 2.363 -0.286 966 HG3 GLN 158 HG3 GLN 158 -5.946 2.321 1.477 967 HE21 GLN 158 HE21 GLN 158 -4.892 4.377 2.416 968 HE22 GLN 158 HE22 GLN 158 -5.482 5.868 1.773 969 H LYS 159 H LYS 159 -2.527 -0.943 1.322 970 HA LYS 159 HA LYS 159 0.058 0.018 1.886 971 HB2 LYS 159 HB2 LYS 159 -1.180 -2.511 1.655 972 HB3 LYS 159 HB3 LYS 159 0.354 -2.551 0.794 973 HG2 LYS 159 HG2 LYS 159 0.992 -1.222 3.107 974 HG3 LYS 159 HG3 LYS 159 -0.181 -2.428 3.645 975 HD2 LYS 159 HD2 LYS 159 1.316 -4.058 3.440 976 HD3 LYS 159 HD3 LYS 159 1.664 -3.593 1.775 977 HE2 LYS 159 HE2 LYS 159 3.694 -3.037 2.518 978 HE3 LYS 159 HE3 LYS 159 2.911 -1.629 3.239 979 HZ1 LYS 159 HZ1 LYS 159 3.811 -2.442 5.110 980 HZ2 LYS 159 HZ2 LYS 159 3.958 -4.016 4.507 981 HZ3 LYS 159 HZ3 LYS 159 2.472 -3.478 5.111 982 HA PRO 160 HA PRO 160 2.395 -0.433 -2.072 983 HB2 PRO 160 HB2 PRO 160 1.242 -1.805 -4.240 984 HB3 PRO 160 HB3 PRO 160 2.509 -2.405 -3.166 985 HG2 PRO 160 HG2 PRO 160 -0.439 -2.855 -3.059 986 HG3 PRO 160 HG3 PRO 160 0.885 -3.979 -2.698 987 HD2 PRO 160 HD2 PRO 160 -0.510 -2.824 -0.727 988 HD3 PRO 160 HD3 PRO 160 1.243 -3.069 -0.582 989 H CYS 161 H CYS 161 2.718 1.157 -3.006 990 HA CYS 161 HA CYS 161 1.056 2.376 -5.043 991 HB2 CYS 161 HB2 CYS 161 0.522 3.391 -2.682 992 HB3 CYS 161 HB3 CYS 161 2.121 4.114 -2.810 993 H GLY 162 H GLY 162 2.622 4.477 -5.854 994 HA2 GLY 162 HA2 GLY 162 4.653 4.947 -6.834 995 HA3 GLY 162 HA3 GLY 162 5.305 4.576 -5.250 996 H SER 163 H SER 163 7.172 3.975 -6.558 997 HA SER 163 HA SER 163 7.019 1.506 -8.066 998 HB2 SER 163 HB2 SER 163 9.374 3.253 -7.291 999 HB3 SER 163 HB3 SER 163 9.479 1.838 -8.337 1000 HG SER 163 HG SER 163 9.135 4.157 -9.212 1001 H GLY 164 H GLY 164 6.092 1.017 -5.615 1002 HA2 GLY 164 HA2 GLY 164 6.600 -1.097 -4.479 1003 HA3 GLY 164 HA3 GLY 164 8.247 -0.518 -4.306 1004 H GLY 165 H GLY 165 6.540 2.158 -3.756 1005 HA2 GLY 165 HA2 GLY 165 6.697 1.751 -0.868 1006 HA3 GLY 165 HA3 GLY 165 6.491 3.298 -1.671 1007 H ARG 166 H ARG 166 5.079 1.593 0.545 1008 HA ARG 166 HA ARG 166 2.433 1.333 -0.512 1009 HB2 ARG 166 HB2 ARG 166 2.033 1.147 2.173 1010 HB3 ARG 166 HB3 ARG 166 2.419 -0.202 1.116 1011 HG2 ARG 166 HG2 ARG 166 4.499 1.401 2.602 1012 HG3 ARG 166 HG3 ARG 166 3.738 -0.050 3.250 1013 HD2 ARG 166 HD2 ARG 166 5.644 0.236 0.964 1014 HD3 ARG 166 HD3 ARG 166 5.695 -0.875 2.329 1015 HE ARG 166 HE ARG 166 3.447 -1.499 0.794 1016 HH11 ARG 166 HH11 ARG 166 6.932 -1.604 0.532 1017 HH12 ARG 166 HH12 ARG 166 6.930 -2.910 -0.607 1018 HH21 ARG 166 HH21 ARG 166 3.451 -3.213 -0.705 1019 HH22 ARG 166 HH22 ARG 166 4.956 -3.821 -1.309 1020 H CYS 167 H CYS 167 0.551 2.431 0.148 1021 HA CYS 167 HA CYS 167 0.923 5.148 0.255 1022 HB2 CYS 167 HB2 CYS 167 -0.962 3.883 -0.881 1023 HB3 CYS 167 HB3 CYS 167 -1.664 3.681 0.720 1024 H ALA 168 H ALA 168 1.533 6.145 2.100 1025 HA ALA 168 HA ALA 168 0.747 4.955 4.659 1026 HB1 ALA 168 HB1 ALA 168 2.704 5.732 5.337 1027 HB2 ALA 168 HB2 ALA 168 2.181 7.383 5.002 1028 HB3 ALA 168 HB3 ALA 168 2.974 6.436 3.744 1029 H ALA 169 H ALA 169 -0.361 7.212 2.468 1030 HA ALA 169 HA ALA 169 -2.565 7.984 3.954 1031 HB1 ALA 169 HB1 ALA 169 -0.769 10.342 3.554 1032 HB2 ALA 169 HB2 ALA 169 -0.673 9.380 5.029 1033 HB3 ALA 169 HB3 ALA 169 -2.186 10.173 4.590 1034 H ALA 170 H ALA 170 -3.930 9.533 2.597 1035 HA ALA 170 HA ALA 170 -3.864 8.856 -0.111 1036 HB1 ALA 170 HB1 ALA 170 -5.839 9.887 -0.197 1037 HB2 ALA 170 HB2 ALA 170 -5.133 11.431 0.292 1038 HB3 ALA 170 HB3 ALA 170 -5.614 10.257 1.517 1039 H GLY 171 H GLY 171 -3.051 9.759 -1.926 1040 HA2 GLY 171 HA2 GLY 171 -1.779 11.022 -3.321 1041 HA3 GLY 171 HA3 GLY 171 -1.954 12.327 -2.173 1042 H ILE 172 H ILE 172 -0.534 10.440 -0.113 1043 HA ILE 172 HA ILE 172 2.250 10.975 -1.065 1044 HB ILE 172 HB ILE 172 2.876 11.184 1.268 1045 HG12 ILE 172 HG12 ILE 172 0.492 11.790 2.570 1046 HG13 ILE 172 HG13 ILE 172 0.156 10.291 1.693 1047 HG21 ILE 172 HG21 ILE 172 1.420 13.032 -0.305 1048 HG22 ILE 172 HG22 ILE 172 2.652 13.358 0.913 1049 HG23 ILE 172 HG23 ILE 172 0.953 13.274 1.378 1050 HD11 ILE 172 HD11 ILE 172 2.727 10.307 2.902 1051 HD12 ILE 172 HD12 ILE 172 1.447 9.106 3.033 1052 HD13 ILE 172 HD13 ILE 172 1.459 10.520 4.101 1053 H CYS 173 H CYS 173 2.669 9.002 -1.937 1054 HA CYS 173 HA CYS 173 2.126 6.592 -0.384 1055 HB2 CYS 173 HB2 CYS 173 3.379 6.805 -3.128 1056 HB3 CYS 173 HB3 CYS 173 2.719 5.360 -2.370 1057 H CYS 174 H CYS 174 3.531 6.322 1.186 1058 HA CYS 174 HA CYS 174 6.283 7.110 0.903 1059 HB2 CYS 174 HB2 CYS 174 4.921 5.750 3.231 1060 HB3 CYS 174 HB3 CYS 174 6.459 6.609 3.262 1061 H SER 175 H SER 175 7.891 5.909 0.302 1062 HA SER 175 HA SER 175 7.559 3.082 -0.220 1063 HB2 SER 175 HB2 SER 175 9.920 4.928 -0.676 1064 HB3 SER 175 HB3 SER 175 9.791 3.273 -1.269 1065 HG SER 175 HG SER 175 7.610 4.654 -1.985 1066 HA PRO 176 HA PRO 176 9.907 1.536 3.207 1067 HB2 PRO 176 HB2 PRO 176 11.906 -0.007 2.265 1068 HB3 PRO 176 HB3 PRO 176 10.207 -0.461 2.077 1069 HG2 PRO 176 HG2 PRO 176 12.056 0.815 0.098 1070 HG3 PRO 176 HG3 PRO 176 10.896 -0.504 -0.145 1071 HD2 PRO 176 HD2 PRO 176 10.380 2.083 -0.831 1072 HD3 PRO 176 HD3 PRO 176 9.115 0.937 -0.347 1073 H ASP 177 H ASP 177 10.827 4.132 2.056 1074 HA ASP 177 HA ASP 177 13.319 4.304 3.553 1075 HB2 ASP 177 HB2 ASP 177 14.374 5.667 1.735 1076 HB3 ASP 177 HB3 ASP 177 14.154 3.971 1.319 1077 H GLY 178 H GLY 178 10.518 5.765 2.099 1078 HA2 GLY 178 HA2 GLY 178 10.228 7.701 4.127 1079 HA3 GLY 178 HA3 GLY 178 10.947 8.466 2.718 1080 H CYS 179 H CYS 179 9.349 9.648 1.801 1081 HA CYS 179 HA CYS 179 6.871 8.223 1.111 1082 HB2 CYS 179 HB2 CYS 179 7.079 11.060 2.134 1083 HB3 CYS 179 HB3 CYS 179 5.616 10.355 1.443 1084 H HIS 180 H HIS 180 5.813 8.965 -0.873 1085 HA HIS 180 HA HIS 180 7.539 10.542 -2.659 1086 HB2 HIS 180 HB2 HIS 180 8.478 8.467 -3.184 1087 HB3 HIS 180 HB3 HIS 180 7.016 7.585 -2.787 1088 HD1 HIS 180 HD1 HIS 180 8.009 10.065 -5.525 1089 HD2 HIS 180 HD2 HIS 180 5.955 6.489 -5.018 1090 HE1 HIS 180 HE1 HIS 180 7.232 9.404 -7.824 1091 HE2 HIS 180 HE2 HIS 180 5.888 7.302 -7.472 1092 H GLU 181 H GLU 181 6.282 11.964 -3.494 1093 HA GLU 181 HA GLU 181 3.521 11.987 -3.335 1094 HB2 GLU 181 HB2 GLU 181 3.718 13.753 -5.235 1095 HB3 GLU 181 HB3 GLU 181 4.435 14.093 -3.667 1096 HG2 GLU 181 HG2 GLU 181 6.305 14.557 -4.748 1097 HG3 GLU 181 HG3 GLU 181 6.443 12.824 -5.046 1098 H ASP 182 H ASP 182 2.110 10.831 -4.225 1099 HA ASP 182 HA ASP 182 2.269 10.122 -7.031 1100 HB2 ASP 182 HB2 ASP 182 3.389 8.270 -6.150 1101 HB3 ASP 182 HB3 ASP 182 2.411 8.216 -4.682 1102 HA PRO 183 HA PRO 183 -1.874 11.783 -6.067 1103 HB2 PRO 183 HB2 PRO 183 -2.129 11.329 -8.997 1104 HB3 PRO 183 HB3 PRO 183 -2.537 12.753 -8.033 1105 HG2 PRO 183 HG2 PRO 183 -0.351 12.739 -9.530 1106 HG3 PRO 183 HG3 PRO 183 -0.327 13.463 -7.910 1107 HD2 PRO 183 HD2 PRO 183 0.739 10.822 -8.825 1108 HD3 PRO 183 HD3 PRO 183 1.433 11.978 -7.670 1109 H ALA 184 H ALA 184 -1.049 8.660 -7.014 1110 HA ALA 184 HA ALA 184 -3.568 7.669 -7.822 1111 HB1 ALA 184 HB1 ALA 184 -1.075 6.394 -6.788 1112 HB2 ALA 184 HB2 ALA 184 -1.834 6.257 -8.374 1113 HB3 ALA 184 HB3 ALA 184 -2.542 5.436 -6.983 1114 H CYS 185 H CYS 185 -2.421 8.614 -4.723 1115 HA CYS 185 HA CYS 185 -4.451 6.992 -3.379 1116 HB2 CYS 185 HB2 CYS 185 -1.967 8.367 -2.465 1117 HB3 CYS 185 HB3 CYS 185 -3.251 8.041 -1.292 1118 H ASP 186 H ASP 186 -4.608 9.799 -4.854 1119 HA ASP 186 HA ASP 186 -5.674 11.568 -2.975 1120 HB2 ASP 186 HB2 ASP 186 -4.929 11.662 -5.663 1121 HB3 ASP 186 HB3 ASP 186 -6.637 12.090 -5.620 1122 HA PRO 187 HA PRO 187 -9.881 10.081 -4.345 1123 HB2 PRO 187 HB2 PRO 187 -10.047 7.283 -4.529 1124 HB3 PRO 187 HB3 PRO 187 -10.180 8.474 -5.819 1125 HG2 PRO 187 HG2 PRO 187 -8.105 6.619 -5.467 1126 HG3 PRO 187 HG3 PRO 187 -8.142 7.974 -6.605 1127 HD2 PRO 187 HD2 PRO 187 -6.790 7.741 -3.987 1128 HD3 PRO 187 HD3 PRO 187 -6.380 8.749 -5.389 1129 H GLU 188 H GLU 188 -8.679 10.322 -2.265 1130 HA GLU 188 HA GLU 188 -10.586 9.682 -0.220 1131 HB2 GLU 188 HB2 GLU 188 -9.395 8.207 1.177 1132 HB3 GLU 188 HB3 GLU 188 -9.294 7.572 -0.458 1133 HG2 GLU 188 HG2 GLU 188 -7.056 8.051 -0.660 1134 HG3 GLU 188 HG3 GLU 188 -7.099 9.279 0.606 1135 H ALA 189 H ALA 189 -7.955 11.451 -1.208 1136 HA ALA 189 HA ALA 189 -7.327 12.713 1.310 1137 HB1 ALA 189 HB1 ALA 189 -6.068 12.365 -1.263 1138 HB2 ALA 189 HB2 ALA 189 -5.383 13.026 0.240 1139 HB3 ALA 189 HB3 ALA 189 -6.190 14.103 -0.899 1140 H ALA 190 H ALA 190 -9.994 13.423 1.349 1141 HA ALA 190 HA ALA 190 -10.737 15.382 -0.497 1142 HB1 ALA 190 HB1 ALA 190 -12.181 13.887 0.979 1143 HB2 ALA 190 HB2 ALA 190 -12.679 15.570 0.817 1144 HB3 ALA 190 HB3 ALA 190 -11.846 15.034 2.275 1145 H PHE 191 H PHE 191 -11.656 17.523 0.519 1146 HA PHE 191 HA PHE 191 -9.353 18.911 1.679 1147 HB2 PHE 191 HB2 PHE 191 -11.418 19.632 -0.224 1148 HB3 PHE 191 HB3 PHE 191 -11.329 20.804 1.087 1149 HD1 PHE 191 HD1 PHE 191 -9.163 21.945 1.565 1150 HD2 PHE 191 HD2 PHE 191 -9.755 19.531 -1.890 1151 HE1 PHE 191 HE1 PHE 191 -7.194 22.978 0.511 1152 HE2 PHE 191 HE2 PHE 191 -7.786 20.558 -2.950 1153 HZ PHE 191 HZ PHE 191 -6.504 22.284 -1.750 1154 H SER 192 H SER 192 -9.478 18.490 3.851 1155 HA SER 192 HA SER 192 -10.138 18.732 6.012 1156 HB2 SER 192 HB2 SER 192 -11.090 21.061 4.697 1157 HB3 SER 192 HB3 SER 192 -12.363 20.524 5.792 1158 HG SER 192 HG SER 192 -11.058 20.811 7.488 Start of MODEL 10 1 H1 ALA 1 H1 ALA 1 15.351 40.707 3.577 2 H2 ALA 1 H2 ALA 1 16.018 41.994 2.660 3 H3 ALA 1 H3 ALA 1 16.961 41.220 3.865 4 HA ALA 1 HA ALA 1 17.137 40.680 1.313 5 HB1 ALA 1 HB1 ALA 1 18.526 39.870 3.226 6 HB2 ALA 1 HB2 ALA 1 18.277 38.684 1.944 7 HB3 ALA 1 HB3 ALA 1 17.358 38.566 3.446 8 H VAL 2 H VAL 2 15.589 40.267 -0.124 9 HA VAL 2 HA VAL 2 13.323 38.634 0.465 10 HB VAL 2 HB VAL 2 12.732 39.103 -1.961 11 HG11 VAL 2 HG11 VAL 2 11.887 40.325 0.078 12 HG12 VAL 2 HG12 VAL 2 11.868 41.251 -1.423 13 HG13 VAL 2 HG13 VAL 2 13.134 41.532 -0.229 14 HG21 VAL 2 HG21 VAL 2 14.877 39.675 -2.885 15 HG22 VAL 2 HG22 VAL 2 15.144 40.901 -1.652 16 HG23 VAL 2 HG23 VAL 2 13.903 41.138 -2.875 17 H LEU 3 H LEU 3 15.102 38.510 -2.341 18 HA LEU 3 HA LEU 3 15.626 35.629 -2.228 19 HB2 LEU 3 HB2 LEU 3 14.479 37.169 -4.591 20 HB3 LEU 3 HB3 LEU 3 15.188 35.575 -4.707 21 HG LEU 3 HG LEU 3 13.128 34.768 -4.459 22 HD11 LEU 3 HD11 LEU 3 14.053 35.068 -1.858 23 HD12 LEU 3 HD12 LEU 3 12.737 34.044 -2.410 24 HD13 LEU 3 HD13 LEU 3 12.396 35.666 -1.818 25 HD21 LEU 3 HD21 LEU 3 11.216 36.243 -3.657 26 HD22 LEU 3 HD22 LEU 3 12.027 36.693 -5.156 27 HD23 LEU 3 HD23 LEU 3 12.392 37.557 -3.663 28 H ASP 4 H ASP 4 17.487 35.318 -2.417 29 HA ASP 4 HA ASP 4 19.412 36.349 -4.197 30 HB2 ASP 4 HB2 ASP 4 19.555 37.094 -1.290 31 HB3 ASP 4 HB3 ASP 4 21.016 36.946 -2.265 32 H LEU 5 H LEU 5 21.738 35.294 -3.192 33 HA LEU 5 HA LEU 5 20.834 32.537 -3.053 34 HB2 LEU 5 HB2 LEU 5 22.619 33.380 -4.685 35 HB3 LEU 5 HB3 LEU 5 23.715 33.353 -3.321 36 HG LEU 5 HG LEU 5 23.880 31.072 -3.319 37 HD11 LEU 5 HD11 LEU 5 21.155 30.999 -3.292 38 HD12 LEU 5 HD12 LEU 5 22.200 29.588 -3.430 39 HD13 LEU 5 HD13 LEU 5 21.511 30.313 -4.879 40 HD21 LEU 5 HD21 LEU 5 24.818 31.344 -5.363 41 HD22 LEU 5 HD22 LEU 5 23.367 32.062 -6.059 42 HD23 LEU 5 HD23 LEU 5 23.466 30.316 -5.838 43 H ASP 6 H ASP 6 21.143 34.653 -0.927 44 HA ASP 6 HA ASP 6 22.780 33.462 1.132 45 HB2 ASP 6 HB2 ASP 6 21.126 35.897 0.781 46 HB3 ASP 6 HB3 ASP 6 21.030 35.212 2.399 47 H VAL 7 H VAL 7 19.329 34.372 1.166 48 HA VAL 7 HA VAL 7 18.618 31.610 1.199 49 HB VAL 7 HB VAL 7 19.042 31.956 3.590 50 HG11 VAL 7 HG11 VAL 7 17.448 34.423 3.167 51 HG12 VAL 7 HG12 VAL 7 18.881 34.150 4.151 52 HG13 VAL 7 HG13 VAL 7 17.306 33.597 4.716 53 HG21 VAL 7 HG21 VAL 7 16.084 31.884 3.046 54 HG22 VAL 7 HG22 VAL 7 16.910 31.277 4.481 55 HG23 VAL 7 HG23 VAL 7 17.183 30.510 2.917 56 H ARG 8 H ARG 8 17.062 31.770 -0.425 57 HA ARG 8 HA ARG 8 15.686 34.276 -0.732 58 HB2 ARG 8 HB2 ARG 8 15.683 31.685 -2.226 59 HB3 ARG 8 HB3 ARG 8 14.401 32.835 -2.508 60 HG2 ARG 8 HG2 ARG 8 16.035 34.489 -3.210 61 HG3 ARG 8 HG3 ARG 8 17.342 33.381 -2.868 62 HD2 ARG 8 HD2 ARG 8 16.966 33.411 -5.214 63 HD3 ARG 8 HD3 ARG 8 16.402 31.869 -4.594 64 HE ARG 8 HE ARG 8 14.114 32.917 -4.649 65 HH11 ARG 8 HH11 ARG 8 16.652 33.985 -6.802 66 HH12 ARG 8 HH12 ARG 8 15.551 34.554 -8.006 67 HH21 ARG 8 HH21 ARG 8 12.677 33.667 -6.243 68 HH22 ARG 8 HH22 ARG 8 13.311 34.384 -7.686 69 H THR 9 H THR 9 14.023 34.675 0.689 70 HA THR 9 HA THR 9 13.071 32.555 2.276 71 HB THR 9 HB THR 9 12.705 34.866 2.949 72 HG1 THR 9 HG1 THR 9 10.428 33.304 2.536 73 HG21 THR 9 HG21 THR 9 11.283 36.411 1.842 74 HG22 THR 9 HG22 THR 9 10.778 35.199 0.666 75 HG23 THR 9 HG23 THR 9 12.433 35.801 0.655 76 H CYS 10 H CYS 10 12.402 30.805 1.390 77 HA CYS 10 HA CYS 10 10.782 30.676 -0.964 78 HB2 CYS 10 HB2 CYS 10 12.569 28.977 0.268 79 HB3 CYS 10 HB3 CYS 10 11.017 28.180 0.495 80 H LEU 11 H LEU 11 8.601 30.969 -0.944 81 HA LEU 11 HA LEU 11 6.619 31.513 0.408 82 HB2 LEU 11 HB2 LEU 11 6.788 28.814 -0.869 83 HB3 LEU 11 HB3 LEU 11 5.328 29.273 -0.013 84 HG LEU 11 HG LEU 11 5.085 29.708 -2.389 85 HD11 LEU 11 HD11 LEU 11 5.349 32.484 -1.528 86 HD12 LEU 11 HD12 LEU 11 4.495 31.461 -0.373 87 HD13 LEU 11 HD13 LEU 11 3.921 31.583 -2.035 88 HD21 LEU 11 HD21 LEU 11 6.479 31.258 -3.578 89 HD22 LEU 11 HD22 LEU 11 7.506 30.023 -2.850 90 HD23 LEU 11 HD23 LEU 11 7.393 31.622 -2.117 91 HA PRO 12 HA PRO 12 7.205 29.833 4.552 92 HB2 PRO 12 HB2 PRO 12 5.745 31.647 5.869 93 HB3 PRO 12 HB3 PRO 12 7.344 32.016 5.215 94 HG2 PRO 12 HG2 PRO 12 4.645 32.662 4.096 95 HG3 PRO 12 HG3 PRO 12 6.092 33.681 4.191 96 HD2 PRO 12 HD2 PRO 12 5.326 32.337 1.929 97 HD3 PRO 12 HD3 PRO 12 7.005 32.777 2.296 98 H CYS 13 H CYS 13 6.225 28.119 5.309 99 HA CYS 13 HA CYS 13 3.280 28.116 5.505 100 HB2 CYS 13 HB2 CYS 13 3.254 25.710 4.976 101 HB3 CYS 13 HB3 CYS 13 3.877 26.670 3.642 102 H GLY 14 H GLY 14 2.734 25.913 6.910 103 HA2 GLY 14 HA2 GLY 14 2.925 24.881 8.983 104 HA3 GLY 14 HA3 GLY 14 4.563 25.502 9.105 105 HA PRO 15 HA PRO 15 1.955 27.776 12.294 106 HB2 PRO 15 HB2 PRO 15 3.802 27.818 14.200 107 HB3 PRO 15 HB3 PRO 15 2.966 26.289 13.825 108 HG2 PRO 15 HG2 PRO 15 5.398 27.356 12.455 109 HG3 PRO 15 HG3 PRO 15 5.396 25.930 13.566 110 HD2 PRO 15 HD2 PRO 15 5.046 25.389 11.057 111 HD3 PRO 15 HD3 PRO 15 3.716 24.853 12.114 112 H GLY 16 H GLY 16 2.046 29.534 11.053 113 HA2 GLY 16 HA2 GLY 16 2.356 31.839 10.932 114 HA3 GLY 16 HA3 GLY 16 3.809 31.621 11.887 115 H GLY 17 H GLY 17 4.088 29.407 9.545 116 HA2 GLY 17 HA2 GLY 17 4.925 29.430 7.448 117 HA3 GLY 17 HA3 GLY 17 4.752 31.121 7.486 118 H LYS 18 H LYS 18 6.434 29.292 9.721 119 HA LYS 18 HA LYS 18 9.005 30.565 9.338 120 HB2 LYS 18 HB2 LYS 18 8.946 27.994 10.813 121 HB3 LYS 18 HB3 LYS 18 9.662 29.530 11.276 122 HG2 LYS 18 HG2 LYS 18 6.809 29.773 11.299 123 HG3 LYS 18 HG3 LYS 18 7.290 28.361 12.228 124 HD2 LYS 18 HD2 LYS 18 9.099 30.250 13.034 125 HD3 LYS 18 HD3 LYS 18 7.635 31.205 12.779 126 HE2 LYS 18 HE2 LYS 18 7.423 30.552 14.989 127 HE3 LYS 18 HE3 LYS 18 6.474 29.332 14.142 128 HZ1 LYS 18 HZ1 LYS 18 7.909 27.716 14.691 129 HZ2 LYS 18 HZ2 LYS 18 8.378 28.773 15.927 130 HZ3 LYS 18 HZ3 LYS 18 9.278 28.692 14.497 131 H GLY 19 H GLY 19 7.383 27.713 8.461 132 HA2 GLY 19 HA2 GLY 19 9.570 26.284 7.261 133 HA3 GLY 19 HA3 GLY 19 7.877 25.839 7.198 134 H ARG 20 H ARG 20 9.149 25.368 4.943 135 HA ARG 20 HA ARG 20 8.189 27.458 3.153 136 HB2 ARG 20 HB2 ARG 20 10.865 26.110 2.832 137 HB3 ARG 20 HB3 ARG 20 10.179 27.339 1.786 138 HG2 ARG 20 HG2 ARG 20 11.249 28.867 2.975 139 HG3 ARG 20 HG3 ARG 20 10.212 28.464 4.346 140 HD2 ARG 20 HD2 ARG 20 12.022 27.769 5.430 141 HD3 ARG 20 HD3 ARG 20 12.161 26.458 4.262 142 HE ARG 20 HE ARG 20 13.411 28.406 2.964 143 HH11 ARG 20 HH11 ARG 20 13.678 27.408 6.302 144 HH12 ARG 20 HH12 ARG 20 15.329 27.905 6.444 145 HH21 ARG 20 HH21 ARG 20 15.587 29.053 3.157 146 HH22 ARG 20 HH22 ARG 20 16.413 28.836 4.664 147 H CYS 21 H CYS 21 7.958 26.614 0.885 148 HA CYS 21 HA CYS 21 7.281 23.745 1.002 149 HB2 CYS 21 HB2 CYS 21 5.422 25.400 0.528 150 HB3 CYS 21 HB3 CYS 21 6.214 25.722 -1.011 151 H PHE 22 H PHE 22 7.866 22.343 -0.538 152 HA PHE 22 HA PHE 22 9.693 23.255 -2.676 153 HB2 PHE 22 HB2 PHE 22 9.991 20.813 -0.894 154 HB3 PHE 22 HB3 PHE 22 10.975 21.138 -2.318 155 HD1 PHE 22 HD1 PHE 22 9.987 22.640 0.946 156 HD2 PHE 22 HD2 PHE 22 12.943 22.323 -2.107 157 HE1 PHE 22 HE1 PHE 22 11.544 23.971 2.314 158 HE2 PHE 22 HE2 PHE 22 14.503 23.650 -0.741 159 HZ PHE 22 HZ PHE 22 13.803 24.475 1.471 160 H GLY 23 H GLY 23 7.791 20.491 -1.471 161 HA2 GLY 23 HA2 GLY 23 7.147 19.723 -4.234 162 HA3 GLY 23 HA3 GLY 23 6.857 18.749 -2.792 163 HA PRO 24 HA PRO 24 3.169 21.643 -4.272 164 HB2 PRO 24 HB2 PRO 24 2.073 18.977 -5.065 165 HB3 PRO 24 HB3 PRO 24 1.839 20.561 -5.814 166 HG2 PRO 24 HG2 PRO 24 3.485 18.776 -6.907 167 HG3 PRO 24 HG3 PRO 24 3.889 20.503 -6.896 168 HD2 PRO 24 HD2 PRO 24 4.985 18.288 -5.226 169 HD3 PRO 24 HD3 PRO 24 5.796 19.739 -5.849 170 H SER 25 H SER 25 3.027 18.295 -3.002 171 HA SER 25 HA SER 25 1.066 19.191 -1.006 172 HB2 SER 25 HB2 SER 25 1.396 16.781 -2.518 173 HB3 SER 25 HB3 SER 25 1.536 16.388 -0.804 174 HG SER 25 HG SER 25 -0.471 17.774 -0.655 175 H ILE 26 H ILE 26 4.304 19.073 -1.185 176 HA ILE 26 HA ILE 26 4.612 18.187 1.591 177 HB ILE 26 HB ILE 26 6.994 18.236 -0.155 178 HG12 ILE 26 HG12 ILE 26 5.217 15.827 -0.246 179 HG13 ILE 26 HG13 ILE 26 5.033 17.101 -1.427 180 HG21 ILE 26 HG21 ILE 26 7.787 17.325 1.655 181 HG22 ILE 26 HG22 ILE 26 6.810 15.915 1.338 182 HG23 ILE 26 HG23 ILE 26 6.185 17.199 2.368 183 HD11 ILE 26 HD11 ILE 26 7.755 16.578 -1.405 184 HD12 ILE 26 HD12 ILE 26 6.586 16.071 -2.623 185 HD13 ILE 26 HD13 ILE 26 6.991 14.992 -1.288 186 H CYS 27 H CYS 27 5.189 19.652 3.027 187 HA CYS 27 HA CYS 27 6.766 21.991 2.152 188 HB2 CYS 27 HB2 CYS 27 4.143 22.146 3.021 189 HB3 CYS 27 HB3 CYS 27 5.060 22.484 4.482 190 H CYS 28 H CYS 28 8.627 22.158 3.205 191 HA CYS 28 HA CYS 28 8.924 20.975 5.826 192 HB2 CYS 28 HB2 CYS 28 11.323 20.824 4.200 193 HB3 CYS 28 HB3 CYS 28 10.560 19.572 5.162 194 H GLY 29 H GLY 29 10.211 21.942 7.326 195 HA2 GLY 29 HA2 GLY 29 11.699 24.342 6.635 196 HA3 GLY 29 HA3 GLY 29 10.609 24.312 8.010 197 H ASP 30 H ASP 30 12.832 24.921 8.934 198 HA ASP 30 HA ASP 30 14.839 23.023 9.202 199 HB2 ASP 30 HB2 ASP 30 15.650 24.429 11.086 200 HB3 ASP 30 HB3 ASP 30 15.312 25.336 9.616 201 H GLU 31 H GLU 31 12.442 23.885 11.593 202 HA GLU 31 HA GLU 31 12.972 21.396 13.008 203 HB2 GLU 31 HB2 GLU 31 11.496 23.452 14.483 204 HB3 GLU 31 HB3 GLU 31 12.844 22.452 14.994 205 HG2 GLU 31 HG2 GLU 31 13.962 24.240 13.195 206 HG3 GLU 31 HG3 GLU 31 12.793 25.198 14.103 207 H LEU 32 H LEU 32 10.894 22.602 10.871 208 HA LEU 32 HA LEU 32 8.503 21.470 11.976 209 HB2 LEU 32 HB2 LEU 32 9.292 23.697 10.359 210 HB3 LEU 32 HB3 LEU 32 8.292 22.644 9.399 211 HG LEU 32 HG LEU 32 7.422 23.513 12.121 212 HD11 LEU 32 HD11 LEU 32 8.146 25.430 10.509 213 HD12 LEU 32 HD12 LEU 32 6.636 25.540 11.402 214 HD13 LEU 32 HD13 LEU 32 6.620 25.063 9.704 215 HD21 LEU 32 HD21 LEU 32 5.180 23.251 11.063 216 HD22 LEU 32 HD22 LEU 32 6.122 21.761 11.120 217 HD23 LEU 32 HD23 LEU 32 5.991 22.664 9.613 218 H GLY 33 H GLY 33 11.254 20.828 10.192 219 HA2 GLY 33 HA2 GLY 33 11.974 18.988 9.105 220 HA3 GLY 33 HA3 GLY 33 10.525 18.248 9.662 221 H CYS 34 H CYS 34 8.761 17.859 8.118 222 HA CYS 34 HA CYS 34 8.585 19.076 5.653 223 HB2 CYS 34 HB2 CYS 34 10.632 17.593 5.318 224 HB3 CYS 34 HB3 CYS 34 9.505 16.281 5.302 225 H PHE 35 H PHE 35 6.436 19.181 5.780 226 HA PHE 35 HA PHE 35 4.989 16.866 6.754 227 HB2 PHE 35 HB2 PHE 35 4.160 19.669 5.934 228 HB3 PHE 35 HB3 PHE 35 3.017 18.419 6.391 229 HD1 PHE 35 HD1 PHE 35 6.188 18.497 8.185 230 HD2 PHE 35 HD2 PHE 35 2.186 19.934 8.138 231 HE1 PHE 35 HE1 PHE 35 6.394 19.160 10.534 232 HE2 PHE 35 HE2 PHE 35 2.393 20.600 10.490 233 HZ PHE 35 HZ PHE 35 4.501 20.214 11.692 234 H VAL 36 H VAL 36 4.909 15.346 5.227 235 HA VAL 36 HA VAL 36 4.493 16.257 2.518 236 HB VAL 36 HB VAL 36 4.912 13.361 3.081 237 HG11 VAL 36 HG11 VAL 36 4.401 14.090 0.823 238 HG12 VAL 36 HG12 VAL 36 6.049 13.464 0.924 239 HG13 VAL 36 HG13 VAL 36 5.764 15.195 0.892 240 HG21 VAL 36 HG21 VAL 36 6.635 14.960 4.311 241 HG22 VAL 36 HG22 VAL 36 7.321 15.064 2.694 242 HG23 VAL 36 HG23 VAL 36 7.164 13.508 3.473 243 H GLY 37 H GLY 37 2.617 16.978 2.630 244 HA2 GLY 37 HA2 GLY 37 0.398 16.604 1.851 245 HA3 GLY 37 HA3 GLY 37 0.467 14.966 2.457 246 H THR 38 H THR 38 -0.446 18.209 3.082 247 HA THR 38 HA THR 38 -2.345 17.571 4.964 248 HB THR 38 HB THR 38 -0.820 16.996 6.620 249 HG1 THR 38 HG1 THR 38 -1.192 18.492 8.149 250 HG21 THR 38 HG21 THR 38 1.295 17.527 6.039 251 HG22 THR 38 HG22 THR 38 0.993 18.794 7.227 252 HG23 THR 38 HG23 THR 38 0.865 19.153 5.505 253 H ALA 39 H ALA 39 -3.159 19.582 6.200 254 HA ALA 39 HA ALA 39 -3.631 21.675 4.400 255 HB1 ALA 39 HB1 ALA 39 -5.106 21.189 6.293 256 HB2 ALA 39 HB2 ALA 39 -4.570 22.869 6.336 257 HB3 ALA 39 HB3 ALA 39 -3.836 21.682 7.414 258 H GLU 40 H GLU 40 -0.963 20.955 6.214 259 HA GLU 40 HA GLU 40 0.111 23.599 6.697 260 HB2 GLU 40 HB2 GLU 40 0.676 21.310 7.889 261 HB3 GLU 40 HB3 GLU 40 1.836 21.160 6.575 262 HG2 GLU 40 HG2 GLU 40 1.960 23.772 7.783 263 HG3 GLU 40 HG3 GLU 40 2.185 22.498 8.982 264 H ALA 41 H ALA 41 -0.276 21.559 4.082 265 HA ALA 41 HA ALA 41 1.938 22.697 2.573 266 HB1 ALA 41 HB1 ALA 41 1.360 20.113 2.806 267 HB2 ALA 41 HB2 ALA 41 2.028 20.796 1.323 268 HB3 ALA 41 HB3 ALA 41 0.294 20.499 1.454 269 H LEU 42 H LEU 42 -1.649 22.723 2.802 270 HA LEU 42 HA LEU 42 -2.439 23.167 0.302 271 HB2 LEU 42 HB2 LEU 42 -3.240 24.205 2.967 272 HB3 LEU 42 HB3 LEU 42 -3.966 24.952 1.558 273 HG LEU 42 HG LEU 42 -4.030 21.977 1.753 274 HD11 LEU 42 HD11 LEU 42 -4.738 23.194 3.983 275 HD12 LEU 42 HD12 LEU 42 -5.674 21.848 3.335 276 HD13 LEU 42 HD13 LEU 42 -6.213 23.506 3.072 277 HD21 LEU 42 HD21 LEU 42 -5.194 24.014 0.147 278 HD22 LEU 42 HD22 LEU 42 -6.487 23.184 1.013 279 HD23 LEU 42 HD23 LEU 42 -5.367 22.265 0.006 280 H ARG 43 H ARG 43 -0.766 25.547 2.332 281 HA ARG 43 HA ARG 43 -1.204 27.770 0.688 282 HB2 ARG 43 HB2 ARG 43 1.308 27.213 2.273 283 HB3 ARG 43 HB3 ARG 43 0.702 28.786 1.774 284 HG2 ARG 43 HG2 ARG 43 -0.851 26.986 3.606 285 HG3 ARG 43 HG3 ARG 43 0.361 28.122 4.199 286 HD2 ARG 43 HD2 ARG 43 -1.541 29.394 4.360 287 HD3 ARG 43 HD3 ARG 43 -0.974 29.838 2.753 288 HE ARG 43 HE ARG 43 -3.053 27.793 3.181 289 HH11 ARG 43 HH11 ARG 43 -1.880 30.652 1.541 290 HH12 ARG 43 HH12 ARG 43 -3.226 30.725 0.458 291 HH21 ARG 43 HH21 ARG 43 -4.818 27.901 1.754 292 HH22 ARG 43 HH22 ARG 43 -4.891 29.171 0.578 293 H CYS 44 H CYS 44 0.622 24.930 0.207 294 HA CYS 44 HA CYS 44 2.595 25.959 -1.618 295 HB2 CYS 44 HB2 CYS 44 1.380 23.196 -1.316 296 HB3 CYS 44 HB3 CYS 44 2.735 23.565 -2.376 297 H GLN 45 H GLN 45 -0.487 24.494 -1.897 298 HA GLN 45 HA GLN 45 -1.156 24.093 -4.401 299 HB2 GLN 45 HB2 GLN 45 -2.760 25.726 -2.462 300 HB3 GLN 45 HB3 GLN 45 -3.385 25.344 -4.056 301 HG2 GLN 45 HG2 GLN 45 -2.478 23.281 -2.062 302 HG3 GLN 45 HG3 GLN 45 -4.147 23.815 -2.257 303 HE21 GLN 45 HE21 GLN 45 -1.989 21.492 -3.088 304 HE22 GLN 45 HE22 GLN 45 -2.734 20.901 -4.529 305 H GLU 46 H GLU 46 -0.603 27.488 -3.280 306 HA GLU 46 HA GLU 46 -1.271 28.456 -5.962 307 HB2 GLU 46 HB2 GLU 46 0.002 30.206 -3.893 308 HB3 GLU 46 HB3 GLU 46 -1.190 30.624 -5.114 309 HG2 GLU 46 HG2 GLU 46 -1.833 28.864 -2.768 310 HG3 GLU 46 HG3 GLU 46 -1.952 30.621 -2.706 311 H GLU 47 H GLU 47 1.350 27.060 -4.627 312 HA GLU 47 HA GLU 47 3.424 28.635 -5.845 313 HB2 GLU 47 HB2 GLU 47 3.490 27.096 -3.718 314 HB3 GLU 47 HB3 GLU 47 3.751 25.813 -4.887 315 HG2 GLU 47 HG2 GLU 47 5.592 27.678 -5.661 316 HG3 GLU 47 HG3 GLU 47 5.572 27.864 -3.907 317 H ASN 48 H ASN 48 1.065 26.668 -7.052 318 HA ASN 48 HA ASN 48 2.504 25.027 -8.838 319 HB2 ASN 48 HB2 ASN 48 -0.211 25.501 -8.242 320 HB3 ASN 48 HB3 ASN 48 -0.023 25.849 -9.957 321 HD21 ASN 48 HD21 ASN 48 -0.899 23.526 -7.926 322 HD22 ASN 48 HD22 ASN 48 -0.424 22.120 -8.811 323 H TYR 49 H TYR 49 1.634 28.382 -8.843 324 HA TYR 49 HA TYR 49 2.733 28.654 -11.596 325 HB2 TYR 49 HB2 TYR 49 0.291 29.423 -10.870 326 HB3 TYR 49 HB3 TYR 49 1.161 30.847 -10.312 327 HD1 TYR 49 HD1 TYR 49 0.892 28.662 -13.337 328 HD2 TYR 49 HD2 TYR 49 1.473 32.588 -11.800 329 HE1 TYR 49 HE1 TYR 49 0.899 29.554 -15.629 330 HE2 TYR 49 HE2 TYR 49 1.478 33.490 -14.088 331 HH TYR 49 HH TYR 49 0.610 31.552 -16.833 332 H LEU 50 H LEU 50 4.594 28.376 -9.634 333 HA LEU 50 HA LEU 50 5.822 31.031 -9.617 334 HB2 LEU 50 HB2 LEU 50 5.064 29.442 -7.223 335 HB3 LEU 50 HB3 LEU 50 6.628 30.233 -7.186 336 HG LEU 50 HG LEU 50 4.164 31.796 -7.876 337 HD11 LEU 50 HD11 LEU 50 3.857 32.351 -5.541 338 HD12 LEU 50 HD12 LEU 50 5.175 31.270 -5.086 339 HD13 LEU 50 HD13 LEU 50 3.691 30.611 -5.774 340 HD21 LEU 50 HD21 LEU 50 5.919 33.286 -6.328 341 HD22 LEU 50 HD22 LEU 50 5.725 33.369 -8.078 342 HD23 LEU 50 HD23 LEU 50 6.965 32.331 -7.377 343 HA PRO 51 HA PRO 51 8.949 27.840 -10.637 344 HB2 PRO 51 HB2 PRO 51 9.773 28.794 -12.976 345 HB3 PRO 51 HB3 PRO 51 8.219 27.962 -12.837 346 HG2 PRO 51 HG2 PRO 51 8.796 30.875 -13.078 347 HG3 PRO 51 HG3 PRO 51 7.441 29.940 -13.730 348 HD2 PRO 51 HD2 PRO 51 7.432 31.493 -11.371 349 HD3 PRO 51 HD3 PRO 51 6.187 30.335 -11.877 350 H SER 52 H SER 52 9.275 30.321 -8.965 351 HA SER 52 HA SER 52 11.874 31.329 -9.819 352 HB2 SER 52 HB2 SER 52 9.700 32.339 -8.234 353 HB3 SER 52 HB3 SER 52 11.185 32.390 -7.283 354 HG SER 52 HG SER 52 11.924 33.906 -8.541 355 HA PRO 53 HA PRO 53 13.733 28.296 -7.062 356 HB2 PRO 53 HB2 PRO 53 16.276 28.593 -7.839 357 HB3 PRO 53 HB3 PRO 53 15.083 27.801 -8.876 358 HG2 PRO 53 HG2 PRO 53 16.138 30.599 -8.994 359 HG3 PRO 53 HG3 PRO 53 15.830 29.463 -10.319 360 HD2 PRO 53 HD2 PRO 53 14.110 31.483 -9.590 361 HD3 PRO 53 HD3 PRO 53 13.605 29.997 -10.419 362 H CYS 54 H CYS 54 13.858 28.793 -4.979 363 HA CYS 54 HA CYS 54 15.049 31.254 -4.067 364 HB2 CYS 54 HB2 CYS 54 14.266 30.573 -1.848 365 HB3 CYS 54 HB3 CYS 54 12.973 30.492 -3.041 366 H GLN 55 H GLN 55 16.814 31.361 -2.480 367 HA GLN 55 HA GLN 55 19.174 30.509 -2.784 368 HB2 GLN 55 HB2 GLN 55 18.566 31.537 -0.725 369 HB3 GLN 55 HB3 GLN 55 17.807 30.058 -0.153 370 HG2 GLN 55 HG2 GLN 55 20.442 29.378 -0.769 371 HG3 GLN 55 HG3 GLN 55 20.520 30.940 0.025 372 HE21 GLN 55 HE21 GLN 55 21.698 29.449 1.578 373 HE22 GLN 55 HE22 GLN 55 20.748 28.722 2.823 374 H SER 56 H SER 56 17.690 28.181 -0.612 375 HA SER 56 HA SER 56 17.564 25.880 -0.643 376 HB2 SER 56 HB2 SER 56 18.396 26.348 -3.389 377 HB3 SER 56 HB3 SER 56 19.157 24.909 -2.720 378 HG SER 56 HG SER 56 16.393 25.403 -2.460 379 H GLY 57 H GLY 57 20.661 25.511 -2.195 380 HA2 GLY 57 HA2 GLY 57 22.800 25.834 -1.026 381 HA3 GLY 57 HA3 GLY 57 21.957 25.474 0.472 382 H GLN 58 H GLN 58 20.805 23.192 0.336 383 HA GLN 58 HA GLN 58 22.784 21.379 -0.837 384 HB2 GLN 58 HB2 GLN 58 21.193 21.162 1.733 385 HB3 GLN 58 HB3 GLN 58 21.863 19.748 0.921 386 HG2 GLN 58 HG2 GLN 58 24.080 21.180 1.033 387 HG3 GLN 58 HG3 GLN 58 23.241 21.928 2.391 388 HE21 GLN 58 HE21 GLN 58 24.252 18.809 1.078 389 HE22 GLN 58 HE22 GLN 58 24.459 18.030 2.606 390 H LYS 59 H LYS 59 21.925 20.192 -2.365 391 HA LYS 59 HA LYS 59 18.981 20.143 -2.500 392 HB2 LYS 59 HB2 LYS 59 21.081 20.777 -4.491 393 HB3 LYS 59 HB3 LYS 59 19.944 19.589 -5.073 394 HG2 LYS 59 HG2 LYS 59 18.105 21.117 -4.708 395 HG3 LYS 59 HG3 LYS 59 19.222 22.329 -4.084 396 HD2 LYS 59 HD2 LYS 59 19.610 21.175 -6.831 397 HD3 LYS 59 HD3 LYS 59 18.435 22.464 -6.561 398 HE2 LYS 59 HE2 LYS 59 20.352 23.626 -7.155 399 HE3 LYS 59 HE3 LYS 59 20.379 23.689 -5.393 400 HZ1 LYS 59 HZ1 LYS 59 22.539 23.117 -6.034 401 HZ2 LYS 59 HZ2 LYS 59 22.015 21.998 -7.186 402 HZ3 LYS 59 HZ3 LYS 59 21.854 21.655 -5.543 403 HA PRO 60 HA PRO 60 19.516 15.787 -3.362 404 HB2 PRO 60 HB2 PRO 60 21.470 14.594 -4.817 405 HB3 PRO 60 HB3 PRO 60 20.007 15.286 -5.535 406 HG2 PRO 60 HG2 PRO 60 22.748 16.471 -5.304 407 HG3 PRO 60 HG3 PRO 60 21.637 16.489 -6.683 408 HD2 PRO 60 HD2 PRO 60 21.933 18.624 -5.011 409 HD3 PRO 60 HD3 PRO 60 20.401 18.234 -5.827 410 H CYS 61 H CYS 61 19.977 14.350 -1.911 411 HA CYS 61 HA CYS 61 22.689 13.991 -0.941 412 HB2 CYS 61 HB2 CYS 61 21.980 14.040 1.444 413 HB3 CYS 61 HB3 CYS 61 21.908 15.610 0.665 414 H GLY 62 H GLY 62 23.090 11.958 -0.096 415 HA2 GLY 62 HA2 GLY 62 22.679 9.710 0.324 416 HA3 GLY 62 HA3 GLY 62 20.980 10.111 0.522 417 H SER 63 H SER 63 20.679 8.012 -0.550 418 HA SER 63 HA SER 63 21.462 7.717 -3.271 419 HB2 SER 63 HB2 SER 63 19.361 6.099 -1.846 420 HB3 SER 63 HB3 SER 63 20.442 5.585 -3.142 421 HG SER 63 HG SER 63 20.987 5.987 -0.413 422 H GLY 64 H GLY 64 20.125 10.083 -3.306 423 HA2 GLY 64 HA2 GLY 64 18.787 10.781 -5.190 424 HA3 GLY 64 HA3 GLY 64 17.746 9.403 -4.910 425 H GLY 65 H GLY 65 18.819 12.103 -2.792 426 HA2 GLY 65 HA2 GLY 65 16.055 13.005 -2.676 427 HA3 GLY 65 HA3 GLY 65 16.618 12.335 -1.179 428 H ARG 66 H ARG 66 16.057 15.223 -2.680 429 HA ARG 66 HA ARG 66 18.499 16.540 -1.879 430 HB2 ARG 66 HB2 ARG 66 16.864 18.638 -2.504 431 HB3 ARG 66 HB3 ARG 66 17.915 17.807 -3.636 432 HG2 ARG 66 HG2 ARG 66 15.093 16.956 -3.183 433 HG3 ARG 66 HG3 ARG 66 15.517 18.216 -4.333 434 HD2 ARG 66 HD2 ARG 66 16.815 15.509 -4.405 435 HD3 ARG 66 HD3 ARG 66 15.285 15.829 -5.210 436 HE ARG 66 HE ARG 66 17.693 17.399 -5.816 437 HH11 ARG 66 HH11 ARG 66 15.025 15.390 -6.866 438 HH12 ARG 66 HH12 ARG 66 15.347 15.639 -8.547 439 HH21 ARG 66 HH21 ARG 66 18.108 17.710 -8.028 440 HH22 ARG 66 HH22 ARG 66 17.091 16.950 -9.206 441 H CYS 67 H CYS 67 18.691 18.392 -0.352 442 HA CYS 67 HA CYS 67 17.425 17.767 2.021 443 HB2 CYS 67 HB2 CYS 67 19.694 18.879 1.669 444 HB3 CYS 67 HB3 CYS 67 18.832 20.341 1.234 445 H ALA 68 H ALA 68 15.312 17.924 2.047 446 HA ALA 68 HA ALA 68 13.956 20.037 0.679 447 HB1 ALA 68 HB1 ALA 68 12.994 17.786 2.432 448 HB2 ALA 68 HB2 ALA 68 12.815 17.970 0.689 449 HB3 ALA 68 HB3 ALA 68 11.932 19.024 1.780 450 H ALA 69 H ALA 69 14.939 19.192 4.069 451 HA ALA 69 HA ALA 69 14.772 21.915 4.823 452 HB1 ALA 69 HB1 ALA 69 12.709 20.154 6.087 453 HB2 ALA 69 HB2 ALA 69 12.361 21.335 4.828 454 HB3 ALA 69 HB3 ALA 69 13.008 21.860 6.363 455 H ALA 70 H ALA 70 15.354 22.004 7.294 456 HA ALA 70 HA ALA 70 17.577 20.542 7.785 457 HB1 ALA 70 HB1 ALA 70 17.520 21.057 10.061 458 HB2 ALA 70 HB2 ALA 70 15.767 21.102 10.093 459 HB3 ALA 70 HB3 ALA 70 16.658 22.388 9.289 460 H GLY 71 H GLY 71 17.620 18.559 7.238 461 HA2 GLY 71 HA2 GLY 71 17.810 16.396 7.820 462 HA3 GLY 71 HA3 GLY 71 16.545 16.580 8.994 463 H ILE 72 H ILE 72 15.426 17.541 5.540 464 HA ILE 72 HA ILE 72 14.162 14.950 5.449 465 HB ILE 72 HB ILE 72 13.504 17.477 3.942 466 HG12 ILE 72 HG12 ILE 72 13.197 18.283 6.087 467 HG13 ILE 72 HG13 ILE 72 11.621 17.614 5.718 468 HG21 ILE 72 HG21 ILE 72 11.255 15.857 4.560 469 HG22 ILE 72 HG22 ILE 72 12.524 14.820 3.926 470 HG23 ILE 72 HG23 ILE 72 11.969 16.204 2.995 471 HD11 ILE 72 HD11 ILE 72 13.434 15.691 6.826 472 HD12 ILE 72 HD12 ILE 72 11.762 16.068 7.279 473 HD13 ILE 72 HD13 ILE 72 13.092 17.040 7.921 474 H CYS 73 H CYS 73 15.582 13.761 4.178 475 HA CYS 73 HA CYS 73 16.938 15.072 1.980 476 HB2 CYS 73 HB2 CYS 73 17.923 13.324 3.574 477 HB3 CYS 73 HB3 CYS 73 17.025 12.138 2.662 478 H CYS 74 H CYS 74 15.303 15.595 0.514 479 HA CYS 74 HA CYS 74 14.372 13.391 -1.087 480 HB2 CYS 74 HB2 CYS 74 12.033 13.746 -0.757 481 HB3 CYS 74 HB3 CYS 74 12.838 13.316 0.748 482 H SER 75 H SER 75 12.615 14.093 -2.655 483 HA SER 75 HA SER 75 13.382 16.650 -3.916 484 HB2 SER 75 HB2 SER 75 12.652 15.563 -6.039 485 HB3 SER 75 HB3 SER 75 13.954 14.688 -5.258 486 HG SER 75 HG SER 75 12.516 13.166 -4.574 487 HA PRO 76 HA PRO 76 9.176 18.043 -3.846 488 HB2 PRO 76 HB2 PRO 76 8.455 18.745 -6.337 489 HB3 PRO 76 HB3 PRO 76 9.713 19.619 -5.453 490 HG2 PRO 76 HG2 PRO 76 9.995 17.503 -7.553 491 HG3 PRO 76 HG3 PRO 76 10.882 19.029 -7.380 492 HD2 PRO 76 HD2 PRO 76 11.862 16.630 -6.586 493 HD3 PRO 76 HD3 PRO 76 12.312 18.156 -5.806 494 H ASP 77 H ASP 77 9.523 15.110 -4.331 495 HA ASP 77 HA ASP 77 6.767 14.548 -5.094 496 HB2 ASP 77 HB2 ASP 77 8.546 14.123 -6.994 497 HB3 ASP 77 HB3 ASP 77 8.891 12.673 -6.057 498 H GLY 78 H GLY 78 9.808 13.147 -3.891 499 HA2 GLY 78 HA2 GLY 78 8.230 11.689 -1.897 500 HA3 GLY 78 HA3 GLY 78 9.682 11.053 -2.595 501 H CYS 79 H CYS 79 9.869 10.939 -0.005 502 HA CYS 79 HA CYS 79 11.794 12.959 0.589 503 HB2 CYS 79 HB2 CYS 79 9.231 12.865 2.051 504 HB3 CYS 79 HB3 CYS 79 10.693 13.303 2.931 505 H HIS 80 H HIS 80 13.118 12.580 2.663 506 HA HIS 80 HA HIS 80 12.885 9.821 3.615 507 HB2 HIS 80 HB2 HIS 80 15.122 10.801 1.867 508 HB3 HIS 80 HB3 HIS 80 15.419 9.541 3.050 509 HD1 HIS 80 HD1 HIS 80 13.604 10.213 -0.161 510 HD2 HIS 80 HD2 HIS 80 14.368 7.050 2.414 511 HE1 HIS 80 HE1 HIS 80 12.886 8.148 -1.401 512 HE2 HIS 80 HE2 HIS 80 13.464 6.242 0.135 513 H GLU 81 H GLU 81 13.728 9.516 5.618 514 HA GLU 81 HA GLU 81 14.370 11.777 7.191 515 HB2 GLU 81 HB2 GLU 81 14.776 8.833 7.765 516 HB3 GLU 81 HB3 GLU 81 14.874 10.118 8.963 517 HG2 GLU 81 HG2 GLU 81 12.587 10.519 8.901 518 HG3 GLU 81 HG3 GLU 81 12.392 9.720 7.342 519 H ASP 82 H ASP 82 16.230 12.852 7.274 520 HA ASP 82 HA ASP 82 18.743 11.350 7.052 521 HB2 ASP 82 HB2 ASP 82 18.813 11.934 4.874 522 HB3 ASP 82 HB3 ASP 82 17.607 13.203 5.070 523 HA PRO 83 HA PRO 83 19.082 14.187 10.611 524 HB2 PRO 83 HB2 PRO 83 21.463 12.534 11.160 525 HB3 PRO 83 HB3 PRO 83 20.067 12.872 12.184 526 HG2 PRO 83 HG2 PRO 83 20.426 10.466 11.074 527 HG3 PRO 83 HG3 PRO 83 18.806 11.168 11.257 528 HD2 PRO 83 HD2 PRO 83 20.551 11.029 8.820 529 HD3 PRO 83 HD3 PRO 83 18.804 10.739 8.968 530 H ALA 84 H ALA 84 21.173 13.680 7.979 531 HA ALA 84 HA ALA 84 23.412 15.163 8.824 532 HB1 ALA 84 HB1 ALA 84 22.496 14.792 5.989 533 HB2 ALA 84 HB2 ALA 84 23.352 13.556 6.913 534 HB3 ALA 84 HB3 ALA 84 24.137 15.097 6.560 535 H CYS 85 H CYS 85 20.460 16.135 7.141 536 HA CYS 85 HA CYS 85 21.418 18.892 6.925 537 HB2 CYS 85 HB2 CYS 85 19.404 17.252 5.576 538 HB3 CYS 85 HB3 CYS 85 18.800 18.824 6.024 539 H ASP 86 H ASP 86 19.810 17.109 9.246 540 HA ASP 86 HA ASP 86 17.726 18.884 9.967 541 HB2 ASP 86 HB2 ASP 86 18.266 16.354 10.637 542 HB3 ASP 86 HB3 ASP 86 18.906 17.155 12.064 543 HA PRO 87 HA PRO 87 20.583 20.867 13.146 544 HB2 PRO 87 HB2 PRO 87 22.561 19.421 14.170 545 HB3 PRO 87 HB3 PRO 87 20.890 19.132 14.615 546 HG2 PRO 87 HG2 PRO 87 22.703 17.435 13.116 547 HG3 PRO 87 HG3 PRO 87 21.086 17.060 13.734 548 HD2 PRO 87 HD2 PRO 87 21.911 17.923 11.039 549 HD3 PRO 87 HD3 PRO 87 20.431 17.099 11.557 550 H GLU 88 H GLU 88 23.065 21.028 13.830 551 HA GLU 88 HA GLU 88 24.242 22.520 11.831 552 HB2 GLU 88 HB2 GLU 88 26.250 22.594 13.293 553 HB3 GLU 88 HB3 GLU 88 24.757 23.073 14.081 554 HG2 GLU 88 HG2 GLU 88 24.616 20.917 15.177 555 HG3 GLU 88 HG3 GLU 88 26.083 20.388 14.350 556 H ALA 89 H ALA 89 24.226 21.410 10.280 557 HA ALA 89 HA ALA 89 25.872 19.048 9.689 558 HB1 ALA 89 HB1 ALA 89 23.649 19.539 8.571 559 HB2 ALA 89 HB2 ALA 89 24.988 19.139 7.468 560 HB3 ALA 89 HB3 ALA 89 24.480 20.820 7.670 561 H ALA 90 H ALA 90 27.199 21.016 10.917 562 HA ALA 90 HA ALA 90 28.449 22.898 9.130 563 HB1 ALA 90 HB1 ALA 90 28.861 22.265 12.040 564 HB2 ALA 90 HB2 ALA 90 27.998 23.632 11.334 565 HB3 ALA 90 HB3 ALA 90 29.753 23.527 11.188 566 H PHE 91 H PHE 91 30.366 22.643 7.972 567 HA PHE 91 HA PHE 91 31.748 20.135 8.393 568 HB2 PHE 91 HB2 PHE 91 31.357 21.405 6.134 569 HB3 PHE 91 HB3 PHE 91 32.850 22.235 6.567 570 HD1 PHE 91 HD1 PHE 91 31.375 18.889 5.961 571 HD2 PHE 91 HD2 PHE 91 34.942 21.192 6.279 572 HE1 PHE 91 HE1 PHE 91 32.679 16.980 5.117 573 HE2 PHE 91 HE2 PHE 91 36.251 19.285 5.437 574 HZ PHE 91 HZ PHE 91 35.120 17.177 4.854 575 H SER 92 H SER 92 32.808 20.079 10.271 576 HA SER 92 HA SER 92 35.271 21.578 10.451 577 HB2 SER 92 HB2 SER 92 33.448 22.971 11.589 578 HB3 SER 92 HB3 SER 92 33.397 21.701 12.811 579 HG SER 92 HG SER 92 35.609 23.324 12.100 580 H1 ALA 101 H1 ALA 101 -5.851 -1.370 21.735 581 H2 ALA 101 H2 ALA 101 -6.000 -2.491 23.025 582 H3 ALA 101 H3 ALA 101 -6.474 -0.857 23.248 583 HA ALA 101 HA ALA 101 -7.910 -3.061 22.193 584 HB1 ALA 101 HB1 ALA 101 -9.617 -0.924 22.427 585 HB2 ALA 101 HB2 ALA 101 -8.348 -0.536 23.588 586 HB3 ALA 101 HB3 ALA 101 -9.218 -2.065 23.711 587 H VAL 102 H VAL 102 -9.228 -3.132 20.338 588 HA VAL 102 HA VAL 102 -9.948 -2.608 18.242 589 HB VAL 102 HB VAL 102 -8.684 0.111 18.412 590 HG11 VAL 102 HG11 VAL 102 -11.228 -0.685 17.031 591 HG12 VAL 102 HG12 VAL 102 -9.662 -0.924 16.260 592 HG13 VAL 102 HG13 VAL 102 -10.183 0.699 16.713 593 HG21 VAL 102 HG21 VAL 102 -10.771 -0.946 20.077 594 HG22 VAL 102 HG22 VAL 102 -11.429 0.296 19.013 595 HG23 VAL 102 HG23 VAL 102 -10.066 0.671 20.067 596 H LEU 103 H LEU 103 -7.741 -3.997 18.576 597 HA LEU 103 HA LEU 103 -6.086 -3.387 16.185 598 HB2 LEU 103 HB2 LEU 103 -4.691 -5.368 17.457 599 HB3 LEU 103 HB3 LEU 103 -4.304 -3.665 17.562 600 HG LEU 103 HG LEU 103 -4.234 -4.857 19.730 601 HD11 LEU 103 HD11 LEU 103 -5.633 -2.400 19.128 602 HD12 LEU 103 HD12 LEU 103 -4.480 -2.766 20.409 603 HD13 LEU 103 HD13 LEU 103 -6.188 -3.133 20.633 604 HD21 LEU 103 HD21 LEU 103 -6.182 -6.355 19.185 605 HD22 LEU 103 HD22 LEU 103 -7.231 -4.987 19.546 606 HD23 LEU 103 HD23 LEU 103 -6.189 -5.646 20.798 607 H ASP 104 H ASP 104 -6.836 -4.486 14.716 608 HA ASP 104 HA ASP 104 -7.317 -7.300 14.675 609 HB2 ASP 104 HB2 ASP 104 -9.668 -5.426 14.409 610 HB3 ASP 104 HB3 ASP 104 -9.690 -7.082 13.809 611 H LEU 105 H LEU 105 -8.558 -7.633 12.156 612 HA LEU 105 HA LEU 105 -6.575 -6.084 10.702 613 HB2 LEU 105 HB2 LEU 105 -7.006 -8.590 10.317 614 HB3 LEU 105 HB3 LEU 105 -8.398 -8.074 9.385 615 HG LEU 105 HG LEU 105 -7.050 -7.062 7.729 616 HD11 LEU 105 HD11 LEU 105 -5.470 -5.984 9.418 617 HD12 LEU 105 HD12 LEU 105 -4.760 -6.537 7.899 618 HD13 LEU 105 HD13 LEU 105 -4.561 -7.500 9.361 619 HD21 LEU 105 HD21 LEU 105 -5.338 -8.889 7.219 620 HD22 LEU 105 HD22 LEU 105 -7.029 -9.372 7.361 621 HD23 LEU 105 HD23 LEU 105 -5.913 -9.664 8.696 622 H ASP 106 H ASP 106 -9.319 -5.361 11.819 623 HA ASP 106 HA ASP 106 -10.740 -4.224 9.582 624 HB2 ASP 106 HB2 ASP 106 -11.405 -4.794 12.253 625 HB3 ASP 106 HB3 ASP 106 -11.349 -3.037 12.194 626 H VAL 107 H VAL 107 -9.469 -2.621 12.572 627 HA VAL 107 HA VAL 107 -7.558 -1.327 10.834 628 HB VAL 107 HB VAL 107 -9.426 0.202 10.488 629 HG11 VAL 107 HG11 VAL 107 -9.757 -0.058 13.423 630 HG12 VAL 107 HG12 VAL 107 -10.965 0.023 12.145 631 HG13 VAL 107 HG13 VAL 107 -10.152 1.491 12.683 632 HG21 VAL 107 HG21 VAL 107 -7.449 1.401 12.417 633 HG22 VAL 107 HG22 VAL 107 -8.471 2.289 11.286 634 HG23 VAL 107 HG23 VAL 107 -7.220 1.205 10.679 635 H ARG 108 H ARG 108 -5.749 -1.752 12.194 636 HA ARG 108 HA ARG 108 -6.326 -2.029 14.991 637 HB2 ARG 108 HB2 ARG 108 -3.861 -2.333 13.335 638 HB3 ARG 108 HB3 ARG 108 -3.707 -2.222 15.068 639 HG2 ARG 108 HG2 ARG 108 -5.085 -4.209 15.326 640 HG3 ARG 108 HG3 ARG 108 -5.331 -4.293 13.596 641 HD2 ARG 108 HD2 ARG 108 -3.703 -5.903 14.218 642 HD3 ARG 108 HD3 ARG 108 -2.889 -4.615 13.346 643 HE ARG 108 HE ARG 108 -2.273 -3.746 15.629 644 HH11 ARG 108 HH11 ARG 108 -2.885 -7.142 15.082 645 HH12 ARG 108 HH12 ARG 108 -1.888 -7.654 16.399 646 HH21 ARG 108 HH21 ARG 108 -0.963 -4.431 17.357 647 HH22 ARG 108 HH22 ARG 108 -0.814 -6.123 17.690 648 H THR 109 H THR 109 -6.564 -0.162 16.207 649 HA THR 109 HA THR 109 -5.810 2.277 15.032 650 HB THR 109 HB THR 109 -7.387 2.228 16.885 651 HG1 THR 109 HG1 THR 109 -5.107 3.748 17.094 652 HG21 THR 109 HG21 THR 109 -5.211 1.539 18.819 653 HG22 THR 109 HG22 THR 109 -6.204 0.293 18.064 654 HG23 THR 109 HG23 THR 109 -6.957 1.539 19.060 655 H CYS 110 H CYS 110 -3.909 2.546 14.308 656 HA CYS 110 HA CYS 110 -1.511 1.655 15.588 657 HB2 CYS 110 HB2 CYS 110 -2.235 2.164 12.983 658 HB3 CYS 110 HB3 CYS 110 -1.104 3.461 13.353 659 H LEU 111 H LEU 111 -0.616 2.764 17.271 660 HA LEU 111 HA LEU 111 -0.674 4.717 18.738 661 HB2 LEU 111 HB2 LEU 111 1.597 4.515 16.800 662 HB3 LEU 111 HB3 LEU 111 1.572 5.827 17.965 663 HG LEU 111 HG LEU 111 2.924 3.994 18.797 664 HD11 LEU 111 HD11 LEU 111 0.557 3.668 20.519 665 HD12 LEU 111 HD12 LEU 111 1.064 5.328 20.214 666 HD13 LEU 111 HD13 LEU 111 2.197 4.176 20.922 667 HD21 LEU 111 HD21 LEU 111 0.802 2.086 19.286 668 HD22 LEU 111 HD22 LEU 111 2.392 1.846 18.563 669 HD23 LEU 111 HD23 LEU 111 1.042 2.372 17.564 670 HA PRO 112 HA PRO 112 -2.549 8.136 16.488 671 HB2 PRO 112 HB2 PRO 112 -3.694 9.340 18.581 672 HB3 PRO 112 HB3 PRO 112 -4.317 7.828 17.908 673 HG2 PRO 112 HG2 PRO 112 -2.599 8.260 20.322 674 HG3 PRO 112 HG3 PRO 112 -4.007 7.200 20.125 675 HD2 PRO 112 HD2 PRO 112 -1.415 6.325 19.967 676 HD3 PRO 112 HD3 PRO 112 -2.775 5.540 19.144 677 H CYS 113 H CYS 113 -1.462 9.767 15.757 678 HA CYS 113 HA CYS 113 -0.093 11.582 17.633 679 HB2 CYS 113 HB2 CYS 113 1.637 11.997 15.930 680 HB3 CYS 113 HB3 CYS 113 1.603 10.314 16.441 681 H GLY 114 H GLY 114 0.578 13.679 16.141 682 HA2 GLY 114 HA2 GLY 114 -0.205 15.511 14.952 683 HA3 GLY 114 HA3 GLY 114 -1.506 14.509 14.329 684 HA PRO 115 HA PRO 115 -3.444 17.641 17.256 685 HB2 PRO 115 HB2 PRO 115 -5.618 18.081 15.799 686 HB3 PRO 115 HB3 PRO 115 -4.056 18.754 15.263 687 HG2 PRO 115 HG2 PRO 115 -5.096 16.017 14.673 688 HG3 PRO 115 HG3 PRO 115 -4.956 17.342 13.448 689 HD2 PRO 115 HD2 PRO 115 -2.896 15.781 13.646 690 HD3 PRO 115 HD3 PRO 115 -2.546 17.500 13.960 691 H GLY 116 H GLY 116 -3.771 16.078 18.714 692 HA2 GLY 116 HA2 GLY 116 -5.181 15.041 20.207 693 HA3 GLY 116 HA3 GLY 116 -6.406 15.045 18.953 694 H GLY 117 H GLY 117 -3.824 13.827 17.467 695 HA2 GLY 117 HA2 GLY 117 -2.941 11.745 17.262 696 HA3 GLY 117 HA3 GLY 117 -3.865 11.314 18.622 697 H LYS 118 H LYS 118 -5.054 12.707 15.825 698 HA LYS 118 HA LYS 118 -6.914 10.591 15.161 699 HB2 LYS 118 HB2 LYS 118 -6.291 12.606 13.073 700 HB3 LYS 118 HB3 LYS 118 -7.853 12.063 13.666 701 HG2 LYS 118 HG2 LYS 118 -6.523 13.556 15.719 702 HG3 LYS 118 HG3 LYS 118 -6.528 14.478 14.223 703 HD2 LYS 118 HD2 LYS 118 -9.076 13.485 14.315 704 HD3 LYS 118 HD3 LYS 118 -8.714 13.771 16.020 705 HE2 LYS 118 HE2 LYS 118 -9.591 15.805 15.356 706 HE3 LYS 118 HE3 LYS 118 -7.857 16.073 15.190 707 HZ1 LYS 118 HZ1 LYS 118 -9.375 16.790 13.285 708 HZ2 LYS 118 HZ2 LYS 118 -9.478 15.146 12.903 709 HZ3 LYS 118 HZ3 LYS 118 -7.976 15.923 12.889 710 H GLY 119 H GLY 119 -3.866 11.761 14.208 711 HA2 GLY 119 HA2 GLY 119 -3.467 10.070 11.910 712 HA3 GLY 119 HA3 GLY 119 -2.257 11.086 12.662 713 H ARG 120 H ARG 120 -1.239 8.868 11.856 714 HA ARG 120 HA ARG 120 -0.822 7.301 14.288 715 HB2 ARG 120 HB2 ARG 120 -1.248 6.025 11.587 716 HB3 ARG 120 HB3 ARG 120 -0.957 5.197 13.104 717 HG2 ARG 120 HG2 ARG 120 -3.146 5.025 13.367 718 HG3 ARG 120 HG3 ARG 120 -3.221 6.780 13.540 719 HD2 ARG 120 HD2 ARG 120 -4.439 6.849 11.683 720 HD3 ARG 120 HD3 ARG 120 -3.023 6.302 10.789 721 HE ARG 120 HE ARG 120 -4.008 3.980 11.618 722 HH11 ARG 120 HH11 ARG 120 -5.640 6.730 10.209 723 HH12 ARG 120 HH12 ARG 120 -6.884 5.772 9.480 724 HH21 ARG 120 HH21 ARG 120 -5.644 2.724 10.650 725 HH22 ARG 120 HH22 ARG 120 -6.887 3.503 9.729 726 H CYS 121 H CYS 121 1.187 5.960 14.144 727 HA CYS 121 HA CYS 121 3.143 7.359 12.435 728 HB2 CYS 121 HB2 CYS 121 3.445 7.467 14.948 729 HB3 CYS 121 HB3 CYS 121 3.798 5.742 14.895 730 H PHE 122 H PHE 122 4.606 6.314 11.237 731 HA PHE 122 HA PHE 122 4.446 3.368 11.037 732 HB2 PHE 122 HB2 PHE 122 4.603 5.378 8.765 733 HB3 PHE 122 HB3 PHE 122 4.785 3.637 8.574 734 HD1 PHE 122 HD1 PHE 122 2.399 6.195 9.856 735 HD2 PHE 122 HD2 PHE 122 2.932 2.333 8.141 736 HE1 PHE 122 HE1 PHE 122 -0.043 5.959 9.630 737 HE2 PHE 122 HE2 PHE 122 0.493 2.094 7.909 738 HZ PHE 122 HZ PHE 122 -0.997 3.908 8.655 739 H GLY 123 H GLY 123 6.304 6.245 10.046 740 HA2 GLY 123 HA2 GLY 123 8.805 4.723 10.302 741 HA3 GLY 123 HA3 GLY 123 8.630 6.309 9.553 742 HA PRO 124 HA PRO 124 9.797 6.248 14.326 743 HB2 PRO 124 HB2 PRO 124 12.418 7.108 13.176 744 HB3 PRO 124 HB3 PRO 124 12.082 6.142 14.618 745 HG2 PRO 124 HG2 PRO 124 12.936 4.982 12.378 746 HG3 PRO 124 HG3 PRO 124 11.712 4.204 13.398 747 HD2 PRO 124 HD2 PRO 124 11.391 5.613 10.787 748 HD3 PRO 124 HD3 PRO 124 10.506 4.215 11.433 749 H SER 125 H SER 125 11.037 8.403 11.739 750 HA SER 125 HA SER 125 10.300 10.722 13.386 751 HB2 SER 125 HB2 SER 125 12.467 10.188 11.572 752 HB3 SER 125 HB3 SER 125 11.555 11.584 10.971 753 HG SER 125 HG SER 125 11.725 12.204 13.376 754 H ILE 126 H ILE 126 8.785 8.844 11.219 755 HA ILE 126 HA ILE 126 7.407 11.098 9.950 756 HB ILE 126 HB ILE 126 7.202 8.420 8.709 757 HG12 ILE 126 HG12 ILE 126 9.591 10.122 8.066 758 HG13 ILE 126 HG13 ILE 126 9.700 8.900 9.312 759 HG21 ILE 126 HG21 ILE 126 6.460 11.022 8.112 760 HG22 ILE 126 HG22 ILE 126 6.394 9.616 7.051 761 HG23 ILE 126 HG23 ILE 126 7.794 10.657 7.035 762 HD11 ILE 126 HD11 ILE 126 10.119 8.559 6.601 763 HD12 ILE 126 HD12 ILE 126 8.534 7.842 6.895 764 HD13 ILE 126 HD13 ILE 126 9.935 7.291 7.812 765 H CYS 127 H CYS 127 5.355 11.403 10.463 766 HA CYS 127 HA CYS 127 3.740 9.085 11.324 767 HB2 CYS 127 HB2 CYS 127 4.459 11.158 13.000 768 HB3 CYS 127 HB3 CYS 127 2.873 11.660 12.429 769 H CYS 128 H CYS 128 1.975 8.768 10.060 770 HA CYS 128 HA CYS 128 0.952 11.077 8.608 771 HB2 CYS 128 HB2 CYS 128 0.734 8.545 7.179 772 HB3 CYS 128 HB3 CYS 128 1.251 10.111 6.582 773 H GLY 129 H GLY 129 -1.287 11.252 8.220 774 HA2 GLY 129 HA2 GLY 129 -3.004 9.103 9.172 775 HA3 GLY 129 HA3 GLY 129 -3.285 10.768 9.647 776 H ASP 130 H ASP 130 -5.381 10.050 8.541 777 HA ASP 130 HA ASP 130 -5.521 9.786 5.777 778 HB2 ASP 130 HB2 ASP 130 -7.924 10.298 6.018 779 HB3 ASP 130 HB3 ASP 130 -7.353 9.062 7.137 780 H GLU 131 H GLU 131 -6.224 12.696 7.644 781 HA GLU 131 HA GLU 131 -5.781 14.210 5.184 782 HB2 GLU 131 HB2 GLU 131 -7.263 15.596 7.288 783 HB3 GLU 131 HB3 GLU 131 -7.688 15.406 5.598 784 HG2 GLU 131 HG2 GLU 131 -8.228 12.919 6.663 785 HG3 GLU 131 HG3 GLU 131 -8.669 14.019 7.967 786 H LEU 132 H LEU 132 -3.975 13.359 7.577 787 HA LEU 132 HA LEU 132 -2.941 15.930 8.261 788 HB2 LEU 132 HB2 LEU 132 -3.739 13.535 9.668 789 HB3 LEU 132 HB3 LEU 132 -2.000 13.632 9.713 790 HG LEU 132 HG LEU 132 -3.704 15.947 10.554 791 HD11 LEU 132 HD11 LEU 132 -4.284 13.728 11.726 792 HD12 LEU 132 HD12 LEU 132 -3.932 15.137 12.712 793 HD13 LEU 132 HD13 LEU 132 -2.705 13.893 12.495 794 HD21 LEU 132 HD21 LEU 132 -1.774 16.876 11.181 795 HD22 LEU 132 HD22 LEU 132 -0.976 15.610 10.249 796 HD23 LEU 132 HD23 LEU 132 -1.233 15.402 11.982 797 H GLY 133 H GLY 133 -2.965 13.239 6.306 798 HA2 GLY 133 HA2 GLY 133 -1.646 12.456 4.734 799 HA3 GLY 133 HA3 GLY 133 -0.841 13.952 4.914 800 H CYS 134 H CYS 134 1.335 13.949 6.073 801 HA CYS 134 HA CYS 134 2.286 11.764 7.442 802 HB2 CYS 134 HB2 CYS 134 2.258 10.846 5.073 803 HB3 CYS 134 HB3 CYS 134 3.608 11.885 4.797 804 H PHE 135 H PHE 135 3.290 12.985 8.898 805 HA PHE 135 HA PHE 135 4.771 15.302 7.971 806 HB2 PHE 135 HB2 PHE 135 4.088 14.206 10.720 807 HB3 PHE 135 HB3 PHE 135 5.126 15.598 10.462 808 HD1 PHE 135 HD1 PHE 135 2.304 15.205 8.196 809 HD2 PHE 135 HD2 PHE 135 3.592 16.893 11.879 810 HE1 PHE 135 HE1 PHE 135 0.347 16.681 8.208 811 HE2 PHE 135 HE2 PHE 135 1.634 18.369 11.894 812 HZ PHE 135 HZ PHE 135 0.006 18.264 10.056 813 H VAL 136 H VAL 136 6.642 14.673 7.118 814 HA VAL 136 HA VAL 136 8.020 12.513 8.453 815 HB VAL 136 HB VAL 136 9.122 13.705 5.947 816 HG11 VAL 136 HG11 VAL 136 9.632 11.480 7.610 817 HG12 VAL 136 HG12 VAL 136 10.501 11.984 6.165 818 HG13 VAL 136 HG13 VAL 136 9.133 10.879 6.031 819 HG21 VAL 136 HG21 VAL 136 6.534 13.154 5.834 820 HG22 VAL 136 HG22 VAL 136 7.125 11.500 5.712 821 HG23 VAL 136 HG23 VAL 136 7.623 12.689 4.532 822 H GLY 137 H GLY 137 8.525 13.382 10.202 823 HA2 GLY 137 HA2 GLY 137 10.377 14.128 11.490 824 HA3 GLY 137 HA3 GLY 137 10.921 15.097 10.140 825 H THR 138 H THR 138 9.124 15.010 13.056 826 HA THR 138 HA THR 138 9.316 17.707 13.541 827 HB THR 138 HB THR 138 7.824 18.339 11.883 828 HG1 THR 138 HG1 THR 138 5.728 18.264 13.561 829 HG21 THR 138 HG21 THR 138 6.766 16.576 10.964 830 HG22 THR 138 HG22 THR 138 5.446 17.206 11.949 831 HG23 THR 138 HG23 THR 138 6.396 15.834 12.521 832 H ALA 139 H ALA 139 7.790 18.445 15.378 833 HA ALA 139 HA ALA 139 7.945 16.634 17.505 834 HB1 ALA 139 HB1 ALA 139 7.825 19.058 17.832 835 HB2 ALA 139 HB2 ALA 139 6.542 18.245 18.729 836 HB3 ALA 139 HB3 ALA 139 6.174 19.062 17.210 837 H GLU 140 H GLU 140 5.816 16.825 14.974 838 HA GLU 140 HA GLU 140 3.441 15.713 16.173 839 HB2 GLU 140 HB2 GLU 140 3.731 17.077 13.933 840 HB3 GLU 140 HB3 GLU 140 4.032 15.485 13.250 841 HG2 GLU 140 HG2 GLU 140 1.693 15.477 14.933 842 HG3 GLU 140 HG3 GLU 140 1.571 16.698 13.667 843 H ALA 141 H ALA 141 6.460 14.583 15.294 844 HA ALA 141 HA ALA 141 5.568 11.838 14.915 845 HB1 ALA 141 HB1 ALA 141 6.971 12.631 13.121 846 HB2 ALA 141 HB2 ALA 141 7.857 11.433 14.063 847 HB3 ALA 141 HB3 ALA 141 8.208 13.147 14.270 848 H LEU 142 H LEU 142 7.305 13.968 17.230 849 HA LEU 142 HA LEU 142 9.005 12.330 18.447 850 HB2 LEU 142 HB2 LEU 142 7.164 14.481 19.352 851 HB3 LEU 142 HB3 LEU 142 7.985 13.547 20.586 852 HG LEU 142 HG LEU 142 9.633 14.712 18.390 853 HD11 LEU 142 HD11 LEU 142 8.780 16.755 18.788 854 HD12 LEU 142 HD12 LEU 142 9.752 16.681 20.250 855 HD13 LEU 142 HD13 LEU 142 8.039 16.267 20.309 856 HD21 LEU 142 HD21 LEU 142 11.130 13.755 19.747 857 HD22 LEU 142 HD22 LEU 142 9.981 13.635 21.080 858 HD23 LEU 142 HD23 LEU 142 10.857 15.141 20.803 859 H ARG 143 H ARG 143 5.481 12.196 18.827 860 HA ARG 143 HA ARG 143 5.437 10.443 21.009 861 HB2 ARG 143 HB2 ARG 143 3.460 10.468 18.722 862 HB3 ARG 143 HB3 ARG 143 3.172 9.897 20.360 863 HG2 ARG 143 HG2 ARG 143 3.893 12.751 19.770 864 HG3 ARG 143 HG3 ARG 143 2.229 12.169 19.736 865 HD2 ARG 143 HD2 ARG 143 2.386 12.915 21.900 866 HD3 ARG 143 HD3 ARG 143 2.830 11.222 22.094 867 HE ARG 143 HE ARG 143 4.843 13.363 21.867 868 HH11 ARG 143 HH11 ARG 143 3.584 10.519 23.470 869 HH12 ARG 143 HH12 ARG 143 4.920 10.399 24.561 870 HH21 ARG 143 HH21 ARG 143 6.592 13.196 23.309 871 HH22 ARG 143 HH22 ARG 143 6.623 11.913 24.472 872 H CYS 144 H CYS 144 6.417 10.001 17.768 873 HA CYS 144 HA CYS 144 5.933 7.178 17.525 874 HB2 CYS 144 HB2 CYS 144 7.995 8.979 16.217 875 HB3 CYS 144 HB3 CYS 144 7.723 7.301 15.763 876 H GLN 145 H GLN 145 8.569 9.130 18.479 877 HA GLN 145 HA GLN 145 10.717 7.708 18.988 878 HB2 GLN 145 HB2 GLN 145 9.399 9.542 20.963 879 HB3 GLN 145 HB3 GLN 145 10.939 8.782 21.324 880 HG2 GLN 145 HG2 GLN 145 10.429 10.499 18.906 881 HG3 GLN 145 HG3 GLN 145 11.114 11.085 20.420 882 HE21 GLN 145 HE21 GLN 145 11.850 10.028 17.407 883 HE22 GLN 145 HE22 GLN 145 13.481 9.518 17.663 884 H GLU 146 H GLU 146 7.754 7.150 20.990 885 HA GLU 146 HA GLU 146 9.206 5.135 22.538 886 HB2 GLU 146 HB2 GLU 146 6.235 5.454 22.706 887 HB3 GLU 146 HB3 GLU 146 7.375 5.030 23.972 888 HG2 GLU 146 HG2 GLU 146 7.278 7.766 22.741 889 HG3 GLU 146 HG3 GLU 146 6.279 7.301 24.116 890 H GLU 147 H GLU 147 7.817 5.184 19.595 891 HA GLU 147 HA GLU 147 6.569 2.595 19.592 892 HB2 GLU 147 HB2 GLU 147 6.108 4.700 18.093 893 HB3 GLU 147 HB3 GLU 147 7.445 4.080 17.140 894 HG2 GLU 147 HG2 GLU 147 5.876 1.864 17.439 895 HG3 GLU 147 HG3 GLU 147 4.688 3.162 17.333 896 H ASN 148 H ASN 148 9.701 3.605 19.844 897 HA ASN 148 HA ASN 148 11.012 1.980 17.948 898 HB2 ASN 148 HB2 ASN 148 11.789 3.770 19.984 899 HB3 ASN 148 HB3 ASN 148 12.554 2.232 20.371 900 HD21 ASN 148 HD21 ASN 148 13.103 5.039 18.917 901 HD22 ASN 148 HD22 ASN 148 14.223 4.561 17.691 902 H TYR 149 H TYR 149 9.517 1.350 21.011 903 HA TYR 149 HA TYR 149 10.494 -1.459 20.899 904 HB2 TYR 149 HB2 TYR 149 10.875 0.185 22.958 905 HB3 TYR 149 HB3 TYR 149 9.242 -0.332 23.368 906 HD1 TYR 149 HD1 TYR 149 12.537 -1.793 22.362 907 HD2 TYR 149 HD2 TYR 149 8.991 -2.220 24.676 908 HE1 TYR 149 HE1 TYR 149 13.439 -3.855 23.358 909 HE2 TYR 149 HE2 TYR 149 9.885 -4.278 25.679 910 HH TYR 149 HH TYR 149 12.753 -5.119 25.905 911 H LEU 150 H LEU 150 8.462 -0.878 19.191 912 HA LEU 150 HA LEU 150 6.262 -2.409 20.362 913 HB2 LEU 150 HB2 LEU 150 6.095 0.370 19.325 914 HB3 LEU 150 HB3 LEU 150 4.792 -0.718 18.888 915 HG LEU 150 HG LEU 150 5.603 -0.414 21.758 916 HD11 LEU 150 HD11 LEU 150 3.988 1.369 22.028 917 HD12 LEU 150 HD12 LEU 150 3.643 1.352 20.298 918 HD13 LEU 150 HD13 LEU 150 5.233 1.853 20.876 919 HD21 LEU 150 HD21 LEU 150 3.113 -1.245 20.291 920 HD22 LEU 150 HD22 LEU 150 3.136 -0.891 22.018 921 HD23 LEU 150 HD23 LEU 150 4.115 -2.210 21.374 922 HA PRO 151 HA PRO 151 7.115 -3.857 16.098 923 HB2 PRO 151 HB2 PRO 151 7.581 -6.423 16.614 924 HB3 PRO 151 HB3 PRO 151 8.793 -5.192 16.988 925 HG2 PRO 151 HG2 PRO 151 6.944 -6.648 18.813 926 HG3 PRO 151 HG3 PRO 151 8.605 -6.102 19.098 927 HD2 PRO 151 HD2 PRO 151 6.239 -4.793 19.912 928 HD3 PRO 151 HD3 PRO 151 7.880 -4.120 19.939 929 H SER 152 H SER 152 4.460 -3.564 17.486 930 HA SER 152 HA SER 152 3.042 -5.977 16.665 931 HB2 SER 152 HB2 SER 152 2.606 -3.898 18.602 932 HB3 SER 152 HB3 SER 152 1.209 -3.995 17.530 933 HG SER 152 HG SER 152 0.889 -6.072 18.123 934 HA PRO 153 HA PRO 153 2.120 -3.875 12.792 935 HB2 PRO 153 HB2 PRO 153 1.097 -5.963 11.469 936 HB3 PRO 153 HB3 PRO 153 2.828 -5.848 11.811 937 HG2 PRO 153 HG2 PRO 153 0.719 -7.435 13.221 938 HG3 PRO 153 HG3 PRO 153 2.366 -7.914 12.770 939 HD2 PRO 153 HD2 PRO 153 1.638 -7.074 15.288 940 HD3 PRO 153 HD3 PRO 153 3.283 -6.948 14.633 941 H CYS 154 H CYS 154 0.470 -2.503 12.775 942 HA CYS 154 HA CYS 154 -2.153 -3.263 13.695 943 HB2 CYS 154 HB2 CYS 154 -2.725 -0.902 13.372 944 HB3 CYS 154 HB3 CYS 154 -1.260 -1.087 14.331 945 H GLN 155 H GLN 155 -4.133 -3.046 12.395 946 HA GLN 155 HA GLN 155 -4.682 -4.292 10.261 947 HB2 GLN 155 HB2 GLN 155 -6.241 -2.711 11.121 948 HB3 GLN 155 HB3 GLN 155 -5.338 -1.370 10.431 949 HG2 GLN 155 HG2 GLN 155 -5.951 -3.070 8.301 950 HG3 GLN 155 HG3 GLN 155 -7.393 -3.000 9.303 951 HE21 GLN 155 HE21 GLN 155 -8.099 -1.967 7.189 952 HE22 GLN 155 HE22 GLN 155 -7.947 -0.249 7.083 953 H SER 156 H SER 156 -3.900 -1.045 9.186 954 HA SER 156 HA SER 156 -2.474 -0.242 7.568 955 HB2 SER 156 HB2 SER 156 -1.475 -2.963 7.769 956 HB3 SER 156 HB3 SER 156 -1.454 -2.390 6.104 957 HG SER 156 HG SER 156 -0.366 -0.496 6.928 958 H GLY 157 H GLY 157 -2.965 -3.044 5.533 959 HA2 GLY 157 HA2 GLY 157 -4.952 -3.390 4.169 960 HA3 GLY 157 HA3 GLY 157 -5.236 -1.660 4.238 961 H GLN 158 H GLN 158 -3.196 -0.368 3.304 962 HA GLN 158 HA GLN 158 -2.467 -1.741 0.816 963 HB2 GLN 158 HB2 GLN 158 -3.129 1.155 1.335 964 HB3 GLN 158 HB3 GLN 158 -2.144 0.657 -0.037 965 HG2 GLN 158 HG2 GLN 158 -4.183 -0.975 -0.440 966 HG3 GLN 158 HG3 GLN 158 -5.040 0.276 0.460 967 HE21 GLN 158 HE21 GLN 158 -2.931 -0.254 -2.318 968 HE22 GLN 158 HE22 GLN 158 -3.533 1.067 -3.256 969 H LYS 159 H LYS 159 -0.488 -2.397 1.114 970 HA LYS 159 HA LYS 159 1.283 -0.755 2.691 971 HB2 LYS 159 HB2 LYS 159 1.143 -3.575 2.011 972 HB3 LYS 159 HB3 LYS 159 2.772 -2.931 1.975 973 HG2 LYS 159 HG2 LYS 159 2.572 -2.132 4.233 974 HG3 LYS 159 HG3 LYS 159 0.886 -2.651 4.298 975 HD2 LYS 159 HD2 LYS 159 3.061 -4.613 3.669 976 HD3 LYS 159 HD3 LYS 159 2.725 -4.156 5.341 977 HE2 LYS 159 HE2 LYS 159 1.415 -6.054 5.017 978 HE3 LYS 159 HE3 LYS 159 0.282 -4.722 4.791 979 HZ1 LYS 159 HZ1 LYS 159 1.550 -6.397 2.699 980 HZ2 LYS 159 HZ2 LYS 159 0.734 -4.963 2.350 981 HZ3 LYS 159 HZ3 LYS 159 -0.096 -6.249 3.052 982 HA PRO 160 HA PRO 160 4.076 -0.049 -0.834 983 HB2 PRO 160 HB2 PRO 160 4.655 -1.864 -2.762 984 HB3 PRO 160 HB3 PRO 160 5.453 -1.848 -1.183 985 HG2 PRO 160 HG2 PRO 160 3.186 -3.549 -2.144 986 HG3 PRO 160 HG3 PRO 160 4.605 -4.012 -1.187 987 HD2 PRO 160 HD2 PRO 160 2.159 -3.572 -0.064 988 HD3 PRO 160 HD3 PRO 160 3.691 -3.244 0.779 989 H CYS 161 H CYS 161 3.758 1.265 -2.409 990 HA CYS 161 HA CYS 161 1.944 0.630 -4.584 991 HB2 CYS 161 HB2 CYS 161 0.807 2.841 -4.437 992 HB3 CYS 161 HB3 CYS 161 0.417 1.765 -3.108 993 H GLY 162 H GLY 162 2.394 1.770 -6.506 994 HA2 GLY 162 HA2 GLY 162 3.674 3.020 -7.952 995 HA3 GLY 162 HA3 GLY 162 4.228 3.946 -6.563 996 H SER 163 H SER 163 6.218 3.926 -7.794 997 HA SER 163 HA SER 163 7.748 1.549 -8.089 998 HB2 SER 163 HB2 SER 163 8.846 4.346 -8.154 999 HB3 SER 163 HB3 SER 163 9.387 2.933 -9.056 1000 HG SER 163 HG SER 163 6.801 3.517 -9.626 1001 H GLY 164 H GLY 164 7.062 1.472 -5.492 1002 HA2 GLY 164 HA2 GLY 164 8.493 0.583 -3.806 1003 HA3 GLY 164 HA3 GLY 164 9.670 1.817 -4.195 1004 H GLY 165 H GLY 165 6.205 2.015 -3.205 1005 HA2 GLY 165 HA2 GLY 165 7.085 3.257 -0.726 1006 HA3 GLY 165 HA3 GLY 165 6.234 4.334 -1.790 1007 H ARG 166 H ARG 166 5.781 2.537 0.925 1008 HA ARG 166 HA ARG 166 3.248 1.359 0.185 1009 HB2 ARG 166 HB2 ARG 166 3.270 1.098 2.908 1010 HB3 ARG 166 HB3 ARG 166 3.899 -0.084 1.775 1011 HG2 ARG 166 HG2 ARG 166 5.598 2.090 2.908 1012 HG3 ARG 166 HG3 ARG 166 5.358 0.557 3.735 1013 HD2 ARG 166 HD2 ARG 166 6.293 0.685 0.884 1014 HD3 ARG 166 HD3 ARG 166 7.412 0.797 2.235 1015 HE ARG 166 HE ARG 166 5.614 -1.506 1.924 1016 HH11 ARG 166 HH11 ARG 166 8.835 -0.190 2.325 1017 HH12 ARG 166 HH12 ARG 166 9.566 -1.741 2.546 1018 HH21 ARG 166 HH21 ARG 166 6.592 -3.537 2.209 1019 HH22 ARG 166 HH22 ARG 166 8.300 -3.635 2.479 1020 H CYS 167 H CYS 167 1.117 1.829 1.210 1021 HA CYS 167 HA CYS 167 0.668 4.555 1.224 1022 HB2 CYS 167 HB2 CYS 167 -0.949 2.675 0.621 1023 HB3 CYS 167 HB3 CYS 167 -1.078 2.338 2.337 1024 H ALA 168 H ALA 168 1.667 5.676 2.715 1025 HA ALA 168 HA ALA 168 2.001 4.669 5.369 1026 HB1 ALA 168 HB1 ALA 168 3.817 5.968 4.845 1027 HB2 ALA 168 HB2 ALA 168 2.806 7.154 5.656 1028 HB3 ALA 168 HB3 ALA 168 2.869 7.116 3.900 1029 H ALA 169 H ALA 169 -0.159 7.002 3.603 1030 HA ALA 169 HA ALA 169 -2.100 6.797 5.636 1031 HB1 ALA 169 HB1 ALA 169 -0.773 9.473 5.477 1032 HB2 ALA 169 HB2 ALA 169 -0.500 8.313 6.771 1033 HB3 ALA 169 HB3 ALA 169 -2.097 8.971 6.509 1034 H ALA 170 H ALA 170 -3.991 8.353 4.955 1035 HA ALA 170 HA ALA 170 -4.610 7.993 2.344 1036 HB1 ALA 170 HB1 ALA 170 -6.289 9.617 2.428 1037 HB2 ALA 170 HB2 ALA 170 -5.420 10.574 3.614 1038 HB3 ALA 170 HB3 ALA 170 -6.142 9.042 4.088 1039 H GLY 171 H GLY 171 -3.140 8.200 0.920 1040 HA2 GLY 171 HA2 GLY 171 -2.342 9.259 -0.896 1041 HA3 GLY 171 HA3 GLY 171 -2.514 10.792 -0.100 1042 H ILE 172 H ILE 172 -0.314 8.420 1.853 1043 HA ILE 172 HA ILE 172 1.891 9.905 0.757 1044 HB ILE 172 HB ILE 172 1.708 8.264 3.291 1045 HG12 ILE 172 HG12 ILE 172 0.080 9.820 3.803 1046 HG13 ILE 172 HG13 ILE 172 1.530 10.640 4.344 1047 HG21 ILE 172 HG21 ILE 172 3.741 9.125 3.830 1048 HG22 ILE 172 HG22 ILE 172 3.447 10.647 2.993 1049 HG23 ILE 172 HG23 ILE 172 3.875 9.203 2.076 1050 HD11 ILE 172 HD11 ILE 172 0.910 11.051 1.573 1051 HD12 ILE 172 HD12 ILE 172 1.387 12.221 2.815 1052 HD13 ILE 172 HD13 ILE 172 -0.299 11.709 2.688 1053 H CYS 173 H CYS 173 2.630 8.540 -0.869 1054 HA CYS 173 HA CYS 173 2.518 5.674 -0.460 1055 HB2 CYS 173 HB2 CYS 173 2.036 6.940 -2.638 1056 HB3 CYS 173 HB3 CYS 173 3.765 7.110 -2.796 1057 H CYS 174 H CYS 174 3.979 5.270 1.215 1058 HA CYS 174 HA CYS 174 6.748 5.275 0.420 1059 HB2 CYS 174 HB2 CYS 174 7.553 6.691 2.169 1060 HB3 CYS 174 HB3 CYS 174 6.457 7.547 1.093 1061 H SER 175 H SER 175 8.235 4.796 2.315 1062 HA SER 175 HA SER 175 7.130 2.565 3.900 1063 HB2 SER 175 HB2 SER 175 9.463 1.689 3.879 1064 HB3 SER 175 HB3 SER 175 8.807 1.864 2.264 1065 HG SER 175 HG SER 175 11.043 2.729 2.904 1066 HA PRO 176 HA PRO 176 8.479 4.463 7.670 1067 HB2 PRO 176 HB2 PRO 176 9.996 2.711 9.028 1068 HB3 PRO 176 HB3 PRO 176 8.280 2.416 8.727 1069 HG2 PRO 176 HG2 PRO 176 10.668 1.340 7.278 1070 HG3 PRO 176 HG3 PRO 176 9.207 0.487 7.808 1071 HD2 PRO 176 HD2 PRO 176 9.597 1.348 5.269 1072 HD3 PRO 176 HD3 PRO 176 7.987 1.201 5.996 1073 H ASP 177 H ASP 177 10.307 4.867 5.332 1074 HA ASP 177 HA ASP 177 12.551 5.973 6.832 1075 HB2 ASP 177 HB2 ASP 177 13.047 3.676 5.627 1076 HB3 ASP 177 HB3 ASP 177 13.129 4.686 4.187 1077 H GLY 178 H GLY 178 11.030 5.698 3.619 1078 HA2 GLY 178 HA2 GLY 178 11.466 8.581 3.281 1079 HA3 GLY 178 HA3 GLY 178 11.515 7.459 1.958 1080 H CYS 179 H CYS 179 9.863 9.380 1.375 1081 HA CYS 179 HA CYS 179 7.310 8.114 1.535 1082 HB2 CYS 179 HB2 CYS 179 7.799 10.674 2.922 1083 HB3 CYS 179 HB3 CYS 179 6.231 10.407 2.164 1084 H HIS 180 H HIS 180 5.541 9.113 0.086 1085 HA HIS 180 HA HIS 180 6.680 10.872 -1.955 1086 HB2 HIS 180 HB2 HIS 180 6.029 7.981 -2.429 1087 HB3 HIS 180 HB3 HIS 180 5.870 9.143 -3.733 1088 HD1 HIS 180 HD1 HIS 180 8.428 7.448 -1.581 1089 HD2 HIS 180 HD2 HIS 180 8.265 10.050 -4.809 1090 HE1 HIS 180 HE1 HIS 180 10.777 7.566 -2.468 1091 HE2 HIS 180 HE2 HIS 180 10.628 9.060 -4.485 1092 H GLU 181 H GLU 181 5.176 12.056 -3.026 1093 HA GLU 181 HA GLU 181 2.545 12.174 -1.995 1094 HB2 GLU 181 HB2 GLU 181 3.690 13.359 -4.533 1095 HB3 GLU 181 HB3 GLU 181 2.146 13.805 -3.818 1096 HG2 GLU 181 HG2 GLU 181 3.148 14.877 -2.018 1097 HG3 GLU 181 HG3 GLU 181 4.687 14.051 -2.260 1098 H ASP 182 H ASP 182 0.892 10.864 -2.421 1099 HA ASP 182 HA ASP 182 0.589 9.810 -5.144 1100 HB2 ASP 182 HB2 ASP 182 1.566 7.906 -4.435 1101 HB3 ASP 182 HB3 ASP 182 1.337 8.301 -2.734 1102 HA PRO 183 HA PRO 183 -3.453 11.431 -3.779 1103 HB2 PRO 183 HB2 PRO 183 -4.080 11.094 -6.642 1104 HB3 PRO 183 HB3 PRO 183 -4.182 12.536 -5.629 1105 HG2 PRO 183 HG2 PRO 183 -2.279 12.275 -7.490 1106 HG3 PRO 183 HG3 PRO 183 -1.953 13.072 -5.938 1107 HD2 PRO 183 HD2 PRO 183 -1.272 10.287 -6.823 1108 HD3 PRO 183 HD3 PRO 183 -0.278 11.453 -5.920 1109 H ALA 184 H ALA 184 -2.619 8.428 -5.134 1110 HA ALA 184 HA ALA 184 -5.183 7.367 -5.615 1111 HB1 ALA 184 HB1 ALA 184 -2.508 6.122 -5.151 1112 HB2 ALA 184 HB2 ALA 184 -3.422 6.241 -6.651 1113 HB3 ALA 184 HB3 ALA 184 -3.951 5.141 -5.377 1114 H CYS 185 H CYS 185 -3.153 7.368 -2.719 1115 HA CYS 185 HA CYS 185 -5.127 5.771 -1.263 1116 HB2 CYS 185 HB2 CYS 185 -2.278 6.384 -0.958 1117 HB3 CYS 185 HB3 CYS 185 -3.167 6.530 0.534 1118 H ASP 186 H ASP 186 -4.688 9.023 -1.881 1119 HA ASP 186 HA ASP 186 -5.076 10.136 0.693 1120 HB2 ASP 186 HB2 ASP 186 -4.305 11.187 -1.639 1121 HB3 ASP 186 HB3 ASP 186 -5.993 11.670 -1.670 1122 HA PRO 187 HA PRO 187 -9.706 10.364 -0.155 1123 HB2 PRO 187 HB2 PRO 187 -10.539 10.537 -2.672 1124 HB3 PRO 187 HB3 PRO 187 -9.778 11.893 -1.864 1125 HG2 PRO 187 HG2 PRO 187 -8.802 10.310 -4.089 1126 HG3 PRO 187 HG3 PRO 187 -8.123 11.792 -3.401 1127 HD2 PRO 187 HD2 PRO 187 -7.381 8.983 -2.906 1128 HD3 PRO 187 HD3 PRO 187 -6.448 10.464 -2.629 1129 H GLU 188 H GLU 188 -11.528 9.473 -1.744 1130 HA GLU 188 HA GLU 188 -11.769 6.786 -1.137 1131 HB2 GLU 188 HB2 GLU 188 -13.780 6.809 -2.586 1132 HB3 GLU 188 HB3 GLU 188 -13.755 8.083 -1.378 1133 HG2 GLU 188 HG2 GLU 188 -13.107 9.700 -3.058 1134 HG3 GLU 188 HG3 GLU 188 -13.058 8.429 -4.282 1135 H ALA 189 H ALA 189 -10.218 5.941 -1.718 1136 HA ALA 189 HA ALA 189 -9.270 5.414 -4.464 1137 HB1 ALA 189 HB1 ALA 189 -7.701 5.602 -2.484 1138 HB2 ALA 189 HB2 ALA 189 -7.488 4.146 -3.484 1139 HB3 ALA 189 HB3 ALA 189 -8.332 4.039 -1.936 1140 H ALA 190 H ALA 190 -11.888 4.996 -4.063 1141 HA ALA 190 HA ALA 190 -12.500 2.319 -3.183 1142 HB1 ALA 190 HB1 ALA 190 -13.906 4.687 -3.412 1143 HB2 ALA 190 HB2 ALA 190 -14.556 3.125 -2.918 1144 HB3 ALA 190 HB3 ALA 190 -14.662 3.629 -4.605 1145 H PHE 191 H PHE 191 -12.664 0.423 -4.452 1146 HA PHE 191 HA PHE 191 -12.172 0.833 -7.280 1147 HB2 PHE 191 HB2 PHE 191 -11.306 -1.115 -5.762 1148 HB3 PHE 191 HB3 PHE 191 -12.841 -1.870 -6.185 1149 HD1 PHE 191 HD1 PHE 191 -9.743 -0.424 -7.618 1150 HD2 PHE 191 HD2 PHE 191 -13.151 -2.890 -8.281 1151 HE1 PHE 191 HE1 PHE 191 -8.791 -1.159 -9.766 1152 HE2 PHE 191 HE2 PHE 191 -12.202 -3.626 -10.430 1153 HZ PHE 191 HZ PHE 191 -10.021 -2.760 -11.175 1154 H SER 192 H SER 192 -13.863 1.717 -8.298 1155 HA SER 192 HA SER 192 -16.139 0.015 -8.818 1156 HB2 SER 192 HB2 SER 192 -16.703 1.432 -6.761 1157 HB3 SER 192 HB3 SER 192 -16.697 2.818 -7.851 1158 HG SER 192 HG SER 192 -18.526 2.175 -8.691 Start of MODEL 11 1 H1 ALA 1 H1 ALA 1 13.761 35.900 -11.960 2 H2 ALA 1 H2 ALA 1 13.692 37.222 -10.867 3 H3 ALA 1 H3 ALA 1 12.942 35.732 -10.464 4 HA ALA 1 HA ALA 1 14.823 34.733 -9.929 5 HB1 ALA 1 HB1 ALA 1 16.540 34.638 -11.324 6 HB2 ALA 1 HB2 ALA 1 16.867 36.361 -11.137 7 HB3 ALA 1 HB3 ALA 1 15.701 35.810 -12.341 8 H VAL 2 H VAL 2 14.229 35.608 -7.958 9 HA VAL 2 HA VAL 2 16.054 37.656 -6.982 10 HB VAL 2 HB VAL 2 13.258 37.611 -5.896 11 HG11 VAL 2 HG11 VAL 2 15.632 39.382 -5.805 12 HG12 VAL 2 HG12 VAL 2 14.475 38.971 -4.540 13 HG13 VAL 2 HG13 VAL 2 14.046 40.151 -5.778 14 HG21 VAL 2 HG21 VAL 2 13.483 38.006 -8.525 15 HG22 VAL 2 HG22 VAL 2 13.914 39.627 -7.980 16 HG23 VAL 2 HG23 VAL 2 12.357 38.930 -7.531 17 H LEU 3 H LEU 3 16.818 35.167 -6.579 18 HA LEU 3 HA LEU 3 16.660 35.012 -3.800 19 HB2 LEU 3 HB2 LEU 3 16.247 32.347 -4.176 20 HB3 LEU 3 HB3 LEU 3 15.061 33.503 -3.610 21 HG LEU 3 HG LEU 3 14.400 33.860 -6.022 22 HD11 LEU 3 HD11 LEU 3 16.626 32.098 -6.398 23 HD12 LEU 3 HD12 LEU 3 15.685 32.988 -7.594 24 HD13 LEU 3 HD13 LEU 3 15.163 31.386 -7.076 25 HD21 LEU 3 HD21 LEU 3 13.153 31.675 -6.136 26 HD22 LEU 3 HD22 LEU 3 12.951 32.596 -4.647 27 HD23 LEU 3 HD23 LEU 3 14.022 31.196 -4.679 28 H ASP 4 H ASP 4 18.695 35.232 -5.897 29 HA ASP 4 HA ASP 4 20.507 33.319 -6.011 30 HB2 ASP 4 HB2 ASP 4 20.758 35.836 -6.618 31 HB3 ASP 4 HB3 ASP 4 21.645 35.901 -5.096 32 H LEU 5 H LEU 5 21.907 35.355 -3.543 33 HA LEU 5 HA LEU 5 21.476 33.206 -1.633 34 HB2 LEU 5 HB2 LEU 5 23.395 32.460 -2.918 35 HB3 LEU 5 HB3 LEU 5 24.227 33.963 -2.571 36 HG LEU 5 HG LEU 5 24.494 33.375 -0.257 37 HD11 LEU 5 HD11 LEU 5 22.258 32.319 0.019 38 HD12 LEU 5 HD12 LEU 5 23.577 31.404 0.757 39 HD13 LEU 5 HD13 LEU 5 22.892 30.876 -0.779 40 HD21 LEU 5 HD21 LEU 5 25.101 30.724 -1.394 41 HD22 LEU 5 HD22 LEU 5 26.141 31.863 -0.540 42 HD23 LEU 5 HD23 LEU 5 25.779 32.109 -2.249 43 H ASP 6 H ASP 6 20.952 36.059 -1.798 44 HA ASP 6 HA ASP 6 22.457 37.238 0.403 45 HB2 ASP 6 HB2 ASP 6 20.459 38.171 -1.576 46 HB3 ASP 6 HB3 ASP 6 20.211 38.835 0.034 47 H VAL 7 H VAL 7 18.962 37.182 0.007 48 HA VAL 7 HA VAL 7 18.683 35.456 2.350 49 HB VAL 7 HB VAL 7 18.189 37.811 3.038 50 HG11 VAL 7 HG11 VAL 7 16.631 37.786 0.554 51 HG12 VAL 7 HG12 VAL 7 17.376 39.130 1.420 52 HG13 VAL 7 HG13 VAL 7 15.808 38.509 1.937 53 HG21 VAL 7 HG21 VAL 7 15.582 36.342 2.885 54 HG22 VAL 7 HG22 VAL 7 16.220 37.343 4.190 55 HG23 VAL 7 HG23 VAL 7 16.919 35.754 3.875 56 H ARG 8 H ARG 8 17.683 33.687 1.596 57 HA ARG 8 HA ARG 8 16.644 33.700 -1.039 58 HB2 ARG 8 HB2 ARG 8 16.183 31.295 -0.538 59 HB3 ARG 8 HB3 ARG 8 17.856 31.756 -0.257 60 HG2 ARG 8 HG2 ARG 8 15.857 31.727 1.979 61 HG3 ARG 8 HG3 ARG 8 16.694 30.259 1.472 62 HD2 ARG 8 HD2 ARG 8 18.855 31.467 1.819 63 HD3 ARG 8 HD3 ARG 8 17.937 32.808 2.501 64 HE ARG 8 HE ARG 8 18.533 30.283 3.759 65 HH11 ARG 8 HH11 ARG 8 16.411 33.062 3.770 66 HH12 ARG 8 HH12 ARG 8 15.942 32.851 5.424 67 HH21 ARG 8 HH21 ARG 8 17.914 30.013 5.934 68 HH22 ARG 8 HH22 ARG 8 16.795 31.123 6.651 69 H THR 9 H THR 9 14.677 34.651 -1.365 70 HA THR 9 HA THR 9 12.781 34.559 0.829 71 HB THR 9 HB THR 9 12.072 35.146 -2.052 72 HG1 THR 9 HG1 THR 9 12.528 37.426 -1.034 73 HG21 THR 9 HG21 THR 9 10.976 36.119 0.569 74 HG22 THR 9 HG22 THR 9 10.157 35.146 -0.652 75 HG23 THR 9 HG23 THR 9 10.566 36.827 -0.993 76 H CYS 10 H CYS 10 12.624 32.501 1.322 77 HA CYS 10 HA CYS 10 12.004 30.458 -0.608 78 HB2 CYS 10 HB2 CYS 10 12.349 30.474 2.370 79 HB3 CYS 10 HB3 CYS 10 11.800 29.034 1.515 80 H LEU 11 H LEU 11 10.013 30.152 -1.457 81 HA LEU 11 HA LEU 11 7.596 31.184 -0.873 82 HB2 LEU 11 HB2 LEU 11 8.180 29.548 -2.709 83 HB3 LEU 11 HB3 LEU 11 7.872 28.265 -1.552 84 HG LEU 11 HG LEU 11 5.543 29.248 -1.277 85 HD11 LEU 11 HD11 LEU 11 6.656 31.221 -2.980 86 HD12 LEU 11 HD12 LEU 11 5.030 31.141 -2.303 87 HD13 LEU 11 HD13 LEU 11 5.372 30.398 -3.865 88 HD21 LEU 11 HD21 LEU 11 5.433 28.467 -4.026 89 HD22 LEU 11 HD22 LEU 11 4.963 27.558 -2.590 90 HD23 LEU 11 HD23 LEU 11 6.623 27.480 -3.179 91 HA PRO 12 HA PRO 12 6.833 29.562 3.273 92 HB2 PRO 12 HB2 PRO 12 5.182 31.445 4.116 93 HB3 PRO 12 HB3 PRO 12 6.884 31.811 3.802 94 HG2 PRO 12 HG2 PRO 12 4.494 32.309 2.058 95 HG3 PRO 12 HG3 PRO 12 5.818 33.415 2.472 96 HD2 PRO 12 HD2 PRO 12 5.719 31.953 0.153 97 HD3 PRO 12 HD3 PRO 12 7.226 32.506 0.911 98 H CYS 13 H CYS 13 5.376 28.234 4.246 99 HA CYS 13 HA CYS 13 2.557 28.292 3.491 100 HB2 CYS 13 HB2 CYS 13 2.481 25.914 2.970 101 HB3 CYS 13 HB3 CYS 13 3.661 26.684 1.923 102 H GLY 14 H GLY 14 1.690 26.082 4.782 103 HA2 GLY 14 HA2 GLY 14 1.340 25.031 6.783 104 HA3 GLY 14 HA3 GLY 14 2.894 25.631 7.319 105 HA PRO 15 HA PRO 15 -0.351 27.593 10.041 106 HB2 PRO 15 HB2 PRO 15 1.040 27.418 12.297 107 HB3 PRO 15 HB3 PRO 15 0.312 25.942 11.606 108 HG2 PRO 15 HG2 PRO 15 2.926 27.142 10.883 109 HG3 PRO 15 HG3 PRO 15 2.761 25.608 11.834 110 HD2 PRO 15 HD2 PRO 15 2.972 25.300 9.283 111 HD3 PRO 15 HD3 PRO 15 1.431 24.682 9.950 112 H GLY 16 H GLY 16 -0.166 29.415 9.255 113 HA2 GLY 16 HA2 GLY 16 0.158 31.731 9.483 114 HA3 GLY 16 HA3 GLY 16 1.613 31.338 10.365 115 H GLY 17 H GLY 17 1.791 29.449 7.660 116 HA2 GLY 17 HA2 GLY 17 2.748 29.641 5.706 117 HA3 GLY 17 HA3 GLY 17 2.310 31.318 5.844 118 H LYS 18 H LYS 18 4.411 29.498 7.861 119 HA LYS 18 HA LYS 18 6.628 31.335 7.318 120 HB2 LYS 18 HB2 LYS 18 7.228 29.166 9.168 121 HB3 LYS 18 HB3 LYS 18 7.390 30.895 9.389 122 HG2 LYS 18 HG2 LYS 18 4.653 30.383 9.543 123 HG3 LYS 18 HG3 LYS 18 5.438 29.090 10.451 124 HD2 LYS 18 HD2 LYS 18 6.853 31.120 11.397 125 HD3 LYS 18 HD3 LYS 18 5.404 32.020 10.945 126 HE2 LYS 18 HE2 LYS 18 4.900 29.522 12.400 127 HE3 LYS 18 HE3 LYS 18 5.766 30.751 13.322 128 HZ1 LYS 18 HZ1 LYS 18 3.207 31.216 11.889 129 HZ2 LYS 18 HZ2 LYS 18 4.012 32.310 12.898 130 HZ3 LYS 18 HZ3 LYS 18 3.335 30.902 13.547 131 H GLY 19 H GLY 19 5.764 27.959 7.187 132 HA2 GLY 19 HA2 GLY 19 8.336 27.000 6.491 133 HA3 GLY 19 HA3 GLY 19 6.840 26.105 6.382 134 H ARG 20 H ARG 20 8.728 25.771 4.841 135 HA ARG 20 HA ARG 20 8.246 27.154 2.294 136 HB2 ARG 20 HB2 ARG 20 10.482 25.779 3.463 137 HB3 ARG 20 HB3 ARG 20 10.359 25.552 1.720 138 HG2 ARG 20 HG2 ARG 20 11.305 27.548 1.461 139 HG3 ARG 20 HG3 ARG 20 9.880 28.276 2.211 140 HD2 ARG 20 HD2 ARG 20 11.870 28.982 3.390 141 HD3 ARG 20 HD3 ARG 20 10.904 27.929 4.425 142 HE ARG 20 HE ARG 20 12.542 26.141 3.480 143 HH11 ARG 20 HH11 ARG 20 13.328 29.412 4.426 144 HH12 ARG 20 HH12 ARG 20 14.973 29.033 4.812 145 HH21 ARG 20 HH21 ARG 20 14.696 25.648 3.982 146 HH22 ARG 20 HH22 ARG 20 15.750 26.896 4.558 147 H CYS 21 H CYS 21 8.301 26.166 0.203 148 HA CYS 21 HA CYS 21 6.726 23.671 0.178 149 HB2 CYS 21 HB2 CYS 21 6.794 26.082 -1.589 150 HB3 CYS 21 HB3 CYS 21 6.328 24.532 -2.289 151 H PHE 22 H PHE 22 7.355 21.932 -0.930 152 HA PHE 22 HA PHE 22 9.571 22.068 -2.819 153 HB2 PHE 22 HB2 PHE 22 9.596 20.404 -0.296 154 HB3 PHE 22 HB3 PHE 22 10.640 20.068 -1.673 155 HD1 PHE 22 HD1 PHE 22 12.430 21.618 -2.282 156 HD2 PHE 22 HD2 PHE 22 10.012 22.252 1.162 157 HE1 PHE 22 HE1 PHE 22 14.082 23.226 -1.424 158 HE2 PHE 22 HE2 PHE 22 11.660 23.863 2.026 159 HZ PHE 22 HZ PHE 22 13.698 24.352 0.733 160 H GLY 23 H GLY 23 6.641 21.505 -2.779 161 HA2 GLY 23 HA2 GLY 23 6.221 19.796 -4.779 162 HA3 GLY 23 HA3 GLY 23 6.432 18.679 -3.436 163 HA PRO 24 HA PRO 24 2.005 20.590 -3.772 164 HB2 PRO 24 HB2 PRO 24 1.260 17.796 -4.461 165 HB3 PRO 24 HB3 PRO 24 0.659 19.318 -5.127 166 HG2 PRO 24 HG2 PRO 24 2.322 17.775 -6.530 167 HG3 PRO 24 HG3 PRO 24 2.453 19.544 -6.579 168 HD2 PRO 24 HD2 PRO 24 4.127 17.559 -5.088 169 HD3 PRO 24 HD3 PRO 24 4.623 19.034 -5.944 170 H SER 25 H SER 25 2.385 17.122 -2.932 171 HA SER 25 HA SER 25 1.043 17.630 -0.391 172 HB2 SER 25 HB2 SER 25 1.705 15.161 -1.962 173 HB3 SER 25 HB3 SER 25 1.447 14.992 -0.210 174 HG SER 25 HG SER 25 -0.614 15.270 -0.539 175 H ILE 26 H ILE 26 3.615 18.812 -0.617 176 HA ILE 26 HA ILE 26 4.879 17.605 1.645 177 HB ILE 26 HB ILE 26 6.724 18.041 -0.651 178 HG12 ILE 26 HG12 ILE 26 5.362 15.410 -0.100 179 HG13 ILE 26 HG13 ILE 26 4.968 16.452 -1.462 180 HG21 ILE 26 HG21 ILE 26 8.193 17.305 0.792 181 HG22 ILE 26 HG22 ILE 26 7.233 15.856 1.093 182 HG23 ILE 26 HG23 ILE 26 6.907 17.335 1.994 183 HD11 ILE 26 HD11 ILE 26 7.701 15.292 -0.981 184 HD12 ILE 26 HD12 ILE 26 7.138 16.153 -2.413 185 HD13 ILE 26 HD13 ILE 26 6.480 14.563 -2.024 186 H CYS 27 H CYS 27 5.433 19.224 2.996 187 HA CYS 27 HA CYS 27 6.499 21.722 1.871 188 HB2 CYS 27 HB2 CYS 27 3.908 21.503 3.051 189 HB3 CYS 27 HB3 CYS 27 4.922 22.408 4.165 190 H CYS 28 H CYS 28 8.493 21.829 2.672 191 HA CYS 28 HA CYS 28 8.897 21.174 5.504 192 HB2 CYS 28 HB2 CYS 28 11.334 21.278 3.876 193 HB3 CYS 28 HB3 CYS 28 10.834 20.099 5.072 194 H GLY 29 H GLY 29 10.521 22.528 6.834 195 HA2 GLY 29 HA2 GLY 29 11.537 24.871 5.590 196 HA3 GLY 29 HA3 GLY 29 10.407 25.039 6.938 197 H ASP 30 H ASP 30 12.580 25.972 7.728 198 HA ASP 30 HA ASP 30 14.738 24.385 8.538 199 HB2 ASP 30 HB2 ASP 30 14.550 26.927 8.174 200 HB3 ASP 30 HB3 ASP 30 13.992 26.970 9.840 201 H GLU 31 H GLU 31 11.955 25.346 10.143 202 HA GLU 31 HA GLU 31 12.657 23.695 12.486 203 HB2 GLU 31 HB2 GLU 31 10.896 25.897 13.279 204 HB3 GLU 31 HB3 GLU 31 12.266 25.188 14.116 205 HG2 GLU 31 HG2 GLU 31 13.596 26.494 12.235 206 HG3 GLU 31 HG3 GLU 31 12.147 27.490 12.266 207 H LEU 32 H LEU 32 10.739 23.713 9.965 208 HA LEU 32 HA LEU 32 8.424 22.865 11.379 209 HB2 LEU 32 HB2 LEU 32 9.025 24.769 9.356 210 HB3 LEU 32 HB3 LEU 32 8.125 23.469 8.634 211 HG LEU 32 HG LEU 32 7.100 24.694 11.146 212 HD11 LEU 32 HD11 LEU 32 7.151 26.739 10.217 213 HD12 LEU 32 HD12 LEU 32 5.817 26.145 9.230 214 HD13 LEU 32 HD13 LEU 32 7.465 26.098 8.605 215 HD21 LEU 32 HD21 LEU 32 5.125 23.774 10.547 216 HD22 LEU 32 HD22 LEU 32 6.177 22.694 9.633 217 HD23 LEU 32 HD23 LEU 32 5.390 24.050 8.826 218 H GLY 33 H GLY 33 11.194 21.966 9.695 219 HA2 GLY 33 HA2 GLY 33 11.838 20.096 8.509 220 HA3 GLY 33 HA3 GLY 33 10.676 19.296 9.530 221 H CYS 34 H CYS 34 9.524 17.889 7.943 222 HA CYS 34 HA CYS 34 8.267 19.504 5.845 223 HB2 CYS 34 HB2 CYS 34 10.209 17.779 5.248 224 HB3 CYS 34 HB3 CYS 34 8.833 16.688 5.232 225 H PHE 35 H PHE 35 6.147 19.281 5.507 226 HA PHE 35 HA PHE 35 4.793 17.187 7.062 227 HB2 PHE 35 HB2 PHE 35 3.738 19.838 5.981 228 HB3 PHE 35 HB3 PHE 35 2.729 18.589 6.694 229 HD1 PHE 35 HD1 PHE 35 6.003 19.953 7.835 230 HD2 PHE 35 HD2 PHE 35 1.837 19.530 8.592 231 HE1 PHE 35 HE1 PHE 35 6.299 21.002 10.043 232 HE2 PHE 35 HE2 PHE 35 2.125 20.574 10.800 233 HZ PHE 35 HZ PHE 35 4.359 21.313 11.528 234 H VAL 36 H VAL 36 4.894 15.586 5.552 235 HA VAL 36 HA VAL 36 4.518 16.395 2.807 236 HB VAL 36 HB VAL 36 5.133 13.556 3.584 237 HG11 VAL 36 HG11 VAL 36 6.159 13.535 1.359 238 HG12 VAL 36 HG12 VAL 36 5.771 15.253 1.144 239 HG13 VAL 36 HG13 VAL 36 4.474 14.049 1.263 240 HG21 VAL 36 HG21 VAL 36 6.869 14.743 4.716 241 HG22 VAL 36 HG22 VAL 36 7.049 15.897 3.395 242 HG23 VAL 36 HG23 VAL 36 7.576 14.227 3.185 243 H GLY 37 H GLY 37 2.614 16.908 2.573 244 HA2 GLY 37 HA2 GLY 37 0.453 16.480 1.782 245 HA3 GLY 37 HA3 GLY 37 0.624 14.804 2.273 246 H THR 38 H THR 38 -0.016 18.059 3.434 247 HA THR 38 HA THR 38 -1.990 17.069 5.289 248 HB THR 38 HB THR 38 -0.919 18.112 7.277 249 HG1 THR 38 HG1 THR 38 0.670 19.174 5.495 250 HG21 THR 38 HG21 THR 38 -0.013 15.701 6.055 251 HG22 THR 38 HG22 THR 38 -0.146 16.107 7.766 252 HG23 THR 38 HG23 THR 38 1.330 16.489 6.879 253 H ALA 39 H ALA 39 -2.333 19.231 6.859 254 HA ALA 39 HA ALA 39 -3.588 21.118 5.195 255 HB1 ALA 39 HB1 ALA 39 -3.338 20.663 7.990 256 HB2 ALA 39 HB2 ALA 39 -4.497 21.695 7.154 257 HB3 ALA 39 HB3 ALA 39 -2.953 22.357 7.688 258 H GLU 40 H GLU 40 -0.476 21.111 6.835 259 HA GLU 40 HA GLU 40 0.473 23.648 6.325 260 HB2 GLU 40 HB2 GLU 40 1.438 21.360 7.472 261 HB3 GLU 40 HB3 GLU 40 2.455 21.493 6.046 262 HG2 GLU 40 HG2 GLU 40 2.160 23.995 7.518 263 HG3 GLU 40 HG3 GLU 40 2.914 22.698 8.444 264 H ALA 41 H ALA 41 0.145 20.997 4.134 265 HA ALA 41 HA ALA 41 1.866 22.200 2.135 266 HB1 ALA 41 HB1 ALA 41 1.507 19.614 2.727 267 HB2 ALA 41 HB2 ALA 41 1.959 20.176 1.117 268 HB3 ALA 41 HB3 ALA 41 0.275 19.795 1.477 269 H LEU 42 H LEU 42 -1.549 21.503 2.764 270 HA LEU 42 HA LEU 42 -2.719 21.829 0.461 271 HB2 LEU 42 HB2 LEU 42 -3.479 22.709 3.168 272 HB3 LEU 42 HB3 LEU 42 -4.460 23.322 1.852 273 HG LEU 42 HG LEU 42 -3.951 20.377 2.183 274 HD11 LEU 42 HD11 LEU 42 -4.980 20.642 4.190 275 HD12 LEU 42 HD12 LEU 42 -6.414 20.611 3.165 276 HD13 LEU 42 HD13 LEU 42 -5.760 22.152 3.718 277 HD21 LEU 42 HD21 LEU 42 -5.047 20.377 0.241 278 HD22 LEU 42 HD22 LEU 42 -5.484 22.078 0.399 279 HD23 LEU 42 HD23 LEU 42 -6.478 20.838 1.163 280 H ARG 43 H ARG 43 -1.874 24.792 2.258 281 HA ARG 43 HA ARG 43 -2.799 26.536 0.246 282 HB2 ARG 43 HB2 ARG 43 -0.701 27.957 1.183 283 HB3 ARG 43 HB3 ARG 43 -2.235 27.849 2.021 284 HG2 ARG 43 HG2 ARG 43 -0.108 25.855 2.635 285 HG3 ARG 43 HG3 ARG 43 0.016 27.487 3.290 286 HD2 ARG 43 HD2 ARG 43 -2.113 25.424 3.774 287 HD3 ARG 43 HD3 ARG 43 -1.093 26.249 4.949 288 HE ARG 43 HE ARG 43 -2.397 28.314 4.255 289 HH11 ARG 43 HH11 ARG 43 -3.764 25.096 4.194 290 HH12 ARG 43 HH12 ARG 43 -5.393 25.651 4.386 291 HH21 ARG 43 HH21 ARG 43 -4.542 29.038 4.506 292 HH22 ARG 43 HH22 ARG 43 -5.834 27.886 4.561 293 H CYS 44 H CYS 44 -0.065 24.485 0.400 294 HA CYS 44 HA CYS 44 1.473 25.832 -1.597 295 HB2 CYS 44 HB2 CYS 44 2.253 23.999 0.012 296 HB3 CYS 44 HB3 CYS 44 1.690 22.872 -1.221 297 H GLN 45 H GLN 45 -1.241 25.105 -2.121 298 HA GLN 45 HA GLN 45 -1.211 23.533 -4.604 299 HB2 GLN 45 HB2 GLN 45 -3.330 23.855 -3.159 300 HB3 GLN 45 HB3 GLN 45 -3.502 25.384 -4.014 301 HG2 GLN 45 HG2 GLN 45 -3.075 23.653 -6.072 302 HG3 GLN 45 HG3 GLN 45 -3.974 22.647 -4.937 303 HE21 GLN 45 HE21 GLN 45 -5.945 23.713 -4.010 304 HE22 GLN 45 HE22 GLN 45 -6.925 24.628 -5.100 305 H GLU 46 H GLU 46 -0.930 26.852 -3.657 306 HA GLU 46 HA GLU 46 -1.068 27.873 -6.379 307 HB2 GLU 46 HB2 GLU 46 -0.393 29.087 -3.709 308 HB3 GLU 46 HB3 GLU 46 -0.162 29.984 -5.203 309 HG2 GLU 46 HG2 GLU 46 -2.242 30.696 -4.742 310 HG3 GLU 46 HG3 GLU 46 -2.689 29.200 -5.563 311 H GLU 47 H GLU 47 1.109 25.927 -5.113 312 HA GLU 47 HA GLU 47 3.541 27.362 -5.749 313 HB2 GLU 47 HB2 GLU 47 3.267 25.485 -3.988 314 HB3 GLU 47 HB3 GLU 47 3.330 24.384 -5.356 315 HG2 GLU 47 HG2 GLU 47 5.506 26.023 -5.762 316 HG3 GLU 47 HG3 GLU 47 5.467 25.815 -4.012 317 H ASN 48 H ASN 48 1.110 26.084 -7.565 318 HA ASN 48 HA ASN 48 2.685 24.766 -9.586 319 HB2 ASN 48 HB2 ASN 48 0.619 24.678 -10.874 320 HB3 ASN 48 HB3 ASN 48 0.308 24.193 -9.212 321 HD21 ASN 48 HD21 ASN 48 0.147 26.636 -7.965 322 HD22 ASN 48 HD22 ASN 48 -1.231 27.492 -8.557 323 H TYR 49 H TYR 49 1.661 28.025 -8.891 324 HA TYR 49 HA TYR 49 2.692 28.911 -11.512 325 HB2 TYR 49 HB2 TYR 49 0.302 29.517 -10.376 326 HB3 TYR 49 HB3 TYR 49 1.280 30.864 -9.806 327 HD1 TYR 49 HD1 TYR 49 2.977 31.609 -11.955 328 HD2 TYR 49 HD2 TYR 49 -1.014 30.148 -12.152 329 HE1 TYR 49 HE1 TYR 49 2.672 32.747 -14.115 330 HE2 TYR 49 HE2 TYR 49 -1.329 31.279 -14.312 331 HH TYR 49 HH TYR 49 1.231 33.286 -15.727 332 H LEU 50 H LEU 50 4.094 28.327 -8.778 333 HA LEU 50 HA LEU 50 5.799 30.702 -8.919 334 HB2 LEU 50 HB2 LEU 50 4.117 29.929 -6.643 335 HB3 LEU 50 HB3 LEU 50 5.794 30.219 -6.223 336 HG LEU 50 HG LEU 50 5.331 32.425 -7.688 337 HD11 LEU 50 HD11 LEU 50 3.167 32.636 -8.168 338 HD12 LEU 50 HD12 LEU 50 2.923 32.952 -6.450 339 HD13 LEU 50 HD13 LEU 50 2.716 31.320 -7.084 340 HD21 LEU 50 HD21 LEU 50 4.766 31.944 -4.770 341 HD22 LEU 50 HD22 LEU 50 4.824 33.550 -5.495 342 HD23 LEU 50 HD23 LEU 50 6.260 32.527 -5.505 343 HA PRO 51 HA PRO 51 8.444 26.996 -8.464 344 HB2 PRO 51 HB2 PRO 51 9.987 27.331 -10.612 345 HB3 PRO 51 HB3 PRO 51 8.329 26.740 -10.768 346 HG2 PRO 51 HG2 PRO 51 9.446 29.424 -11.378 347 HG3 PRO 51 HG3 PRO 51 8.111 28.558 -12.153 348 HD2 PRO 51 HD2 PRO 51 7.924 30.583 -10.172 349 HD3 PRO 51 HD3 PRO 51 6.604 29.586 -10.811 350 H SER 52 H SER 52 8.815 29.188 -6.823 351 HA SER 52 HA SER 52 11.332 30.470 -7.212 352 HB2 SER 52 HB2 SER 52 9.147 30.876 -5.571 353 HB3 SER 52 HB3 SER 52 10.395 30.342 -4.445 354 HG SER 52 HG SER 52 11.403 32.165 -4.720 355 HA PRO 53 HA PRO 53 13.700 26.985 -5.627 356 HB2 PRO 53 HB2 PRO 53 16.150 27.881 -6.255 357 HB3 PRO 53 HB3 PRO 53 15.031 27.280 -7.485 358 HG2 PRO 53 HG2 PRO 53 15.705 30.095 -6.748 359 HG3 PRO 53 HG3 PRO 53 15.448 29.386 -8.352 360 HD2 PRO 53 HD2 PRO 53 13.557 30.838 -6.967 361 HD3 PRO 53 HD3 PRO 53 13.185 29.653 -8.233 362 H CYS 54 H CYS 54 14.886 30.301 -4.993 363 HA CYS 54 HA CYS 54 15.825 31.315 -3.206 364 HB2 CYS 54 HB2 CYS 54 14.681 31.203 -1.171 365 HB3 CYS 54 HB3 CYS 54 13.473 30.750 -2.360 366 H GLN 55 H GLN 55 17.845 31.245 -2.373 367 HA GLN 55 HA GLN 55 19.288 28.808 -2.387 368 HB2 GLN 55 HB2 GLN 55 20.021 31.412 -2.262 369 HB3 GLN 55 HB3 GLN 55 20.333 30.915 -0.604 370 HG2 GLN 55 HG2 GLN 55 21.477 29.682 -3.100 371 HG3 GLN 55 HG3 GLN 55 22.334 30.669 -1.918 372 HE21 GLN 55 HE21 GLN 55 23.182 29.718 -0.152 373 HE22 GLN 55 HE22 GLN 55 23.040 28.037 0.221 374 H SER 56 H SER 56 18.317 27.210 -1.157 375 HA SER 56 HA SER 56 19.159 26.681 1.380 376 HB2 SER 56 HB2 SER 56 17.356 28.759 1.658 377 HB3 SER 56 HB3 SER 56 16.366 27.339 1.994 378 HG SER 56 HG SER 56 18.070 26.713 3.491 379 H GLY 57 H GLY 57 18.736 24.536 1.816 380 HA2 GLY 57 HA2 GLY 57 17.347 22.643 1.933 381 HA3 GLY 57 HA3 GLY 57 16.295 23.367 0.726 382 H GLN 58 H GLN 58 19.780 23.138 0.390 383 HA GLN 58 HA GLN 58 19.338 21.102 -1.670 384 HB2 GLN 58 HB2 GLN 58 20.967 23.609 -1.783 385 HB3 GLN 58 HB3 GLN 58 21.443 22.216 -2.746 386 HG2 GLN 58 HG2 GLN 58 19.730 22.453 -4.184 387 HG3 GLN 58 HG3 GLN 58 18.606 22.967 -2.928 388 HE21 GLN 58 HE21 GLN 58 18.431 25.134 -2.421 389 HE22 GLN 58 HE22 GLN 58 19.100 26.379 -3.415 390 H LYS 59 H LYS 59 19.742 19.711 0.089 391 HA LYS 59 HA LYS 59 22.629 19.109 0.385 392 HB2 LYS 59 HB2 LYS 59 20.672 19.630 2.503 393 HB3 LYS 59 HB3 LYS 59 21.387 18.032 2.661 394 HG2 LYS 59 HG2 LYS 59 23.267 20.250 2.172 395 HG3 LYS 59 HG3 LYS 59 22.442 20.254 3.731 396 HD2 LYS 59 HD2 LYS 59 23.235 18.009 4.190 397 HD3 LYS 59 HD3 LYS 59 23.980 17.919 2.593 398 HE2 LYS 59 HE2 LYS 59 25.728 18.421 4.104 399 HE3 LYS 59 HE3 LYS 59 25.361 19.926 3.262 400 HZ1 LYS 59 HZ1 LYS 59 25.659 20.158 5.701 401 HZ2 LYS 59 HZ2 LYS 59 24.269 19.222 5.930 402 HZ3 LYS 59 HZ3 LYS 59 24.161 20.715 5.143 403 HA PRO 60 HA PRO 60 19.950 15.906 -1.732 404 HB2 PRO 60 HB2 PRO 60 22.004 15.157 -3.414 405 HB3 PRO 60 HB3 PRO 60 20.728 16.315 -3.790 406 HG2 PRO 60 HG2 PRO 60 23.517 16.811 -2.834 407 HG3 PRO 60 HG3 PRO 60 22.572 17.694 -4.051 408 HD2 PRO 60 HD2 PRO 60 22.875 18.678 -1.599 409 HD3 PRO 60 HD3 PRO 60 21.319 18.813 -2.442 410 H CYS 61 H CYS 61 20.059 14.738 0.232 411 HA CYS 61 HA CYS 61 22.025 12.538 0.257 412 HB2 CYS 61 HB2 CYS 61 20.640 12.031 2.488 413 HB3 CYS 61 HB3 CYS 61 21.993 13.151 2.492 414 H GLY 62 H GLY 62 20.572 10.334 1.079 415 HA2 GLY 62 HA2 GLY 62 18.803 8.945 0.563 416 HA3 GLY 62 HA3 GLY 62 17.905 10.348 0.005 417 H SER 63 H SER 63 17.246 8.714 -1.671 418 HA SER 63 HA SER 63 19.261 8.083 -3.635 419 HB2 SER 63 HB2 SER 63 17.144 7.207 -4.882 420 HB3 SER 63 HB3 SER 63 17.672 6.367 -3.424 421 HG SER 63 HG SER 63 15.474 8.071 -3.804 422 H GLY 64 H GLY 64 19.069 10.794 -3.241 423 HA2 GLY 64 HA2 GLY 64 19.423 12.287 -5.141 424 HA3 GLY 64 HA3 GLY 64 17.924 11.672 -5.798 425 H GLY 65 H GLY 65 17.542 12.387 -2.326 426 HA2 GLY 65 HA2 GLY 65 16.180 14.841 -3.216 427 HA3 GLY 65 HA3 GLY 65 15.833 13.928 -1.759 428 H ARG 66 H ARG 66 16.285 16.755 -1.923 429 HA ARG 66 HA ARG 66 18.883 17.113 -0.606 430 HB2 ARG 66 HB2 ARG 66 18.264 19.580 -0.800 431 HB3 ARG 66 HB3 ARG 66 18.614 18.719 -2.294 432 HG2 ARG 66 HG2 ARG 66 15.818 18.526 -1.695 433 HG3 ARG 66 HG3 ARG 66 16.330 20.214 -1.658 434 HD2 ARG 66 HD2 ARG 66 17.379 18.627 -3.900 435 HD3 ARG 66 HD3 ARG 66 15.633 18.882 -3.907 436 HE ARG 66 HE ARG 66 17.503 21.136 -3.646 437 HH11 ARG 66 HH11 ARG 66 14.852 19.554 -5.293 438 HH12 ARG 66 HH12 ARG 66 14.494 20.920 -6.296 439 HH21 ARG 66 HH21 ARG 66 17.024 22.933 -4.970 440 HH22 ARG 66 HH22 ARG 66 15.726 22.834 -6.113 441 H CYS 67 H CYS 67 19.041 18.243 1.423 442 HA CYS 67 HA CYS 67 17.068 17.545 3.295 443 HB2 CYS 67 HB2 CYS 67 19.782 18.740 3.354 444 HB3 CYS 67 HB3 CYS 67 18.717 19.220 4.669 445 H ALA 68 H ALA 68 15.207 18.622 3.275 446 HA ALA 68 HA ALA 68 15.199 21.505 2.723 447 HB1 ALA 68 HB1 ALA 68 13.277 19.359 2.491 448 HB2 ALA 68 HB2 ALA 68 13.238 20.976 1.787 449 HB3 ALA 68 HB3 ALA 68 12.608 20.705 3.412 450 H ALA 69 H ALA 69 15.052 19.243 5.027 451 HA ALA 69 HA ALA 69 15.231 21.198 7.293 452 HB1 ALA 69 HB1 ALA 69 13.026 19.185 7.430 453 HB2 ALA 69 HB2 ALA 69 12.815 20.782 6.712 454 HB3 ALA 69 HB3 ALA 69 13.279 20.631 8.407 455 H ALA 70 H ALA 70 15.517 20.280 9.455 456 HA ALA 70 HA ALA 70 17.569 18.411 9.500 457 HB1 ALA 70 HB1 ALA 70 17.602 18.581 11.840 458 HB2 ALA 70 HB2 ALA 70 15.882 18.985 11.915 459 HB3 ALA 70 HB3 ALA 70 17.033 20.153 11.265 460 H GLY 71 H GLY 71 17.655 16.302 9.380 461 HA2 GLY 71 HA2 GLY 71 17.114 14.091 9.616 462 HA3 GLY 71 HA3 GLY 71 15.869 14.587 10.723 463 H ILE 72 H ILE 72 15.719 16.022 7.874 464 HA ILE 72 HA ILE 72 13.942 14.026 6.545 465 HB ILE 72 HB ILE 72 12.149 15.462 6.159 466 HG12 ILE 72 HG12 ILE 72 12.560 17.750 7.686 467 HG13 ILE 72 HG13 ILE 72 14.033 17.567 6.720 468 HG21 ILE 72 HG21 ILE 72 12.228 16.234 8.894 469 HG22 ILE 72 HG22 ILE 72 13.014 14.665 8.711 470 HG23 ILE 72 HG23 ILE 72 11.364 14.898 8.133 471 HD11 ILE 72 HD11 ILE 72 11.745 16.931 5.167 472 HD12 ILE 72 HD12 ILE 72 12.972 18.182 4.891 473 HD13 ILE 72 HD13 ILE 72 11.554 18.539 5.886 474 H CYS 73 H CYS 73 15.103 13.529 4.899 475 HA CYS 73 HA CYS 73 16.120 15.588 3.082 476 HB2 CYS 73 HB2 CYS 73 17.493 13.573 3.995 477 HB3 CYS 73 HB3 CYS 73 16.593 12.631 2.814 478 H CYS 74 H CYS 74 14.080 16.155 2.183 479 HA CYS 74 HA CYS 74 12.634 14.068 0.748 480 HB2 CYS 74 HB2 CYS 74 11.778 16.928 0.649 481 HB3 CYS 74 HB3 CYS 74 10.798 15.471 0.674 482 H SER 75 H SER 75 12.267 14.077 -1.451 483 HA SER 75 HA SER 75 14.124 15.724 -3.040 484 HB2 SER 75 HB2 SER 75 13.916 13.905 -4.753 485 HB3 SER 75 HB3 SER 75 14.622 13.358 -3.233 486 HG SER 75 HG SER 75 12.121 12.966 -2.871 487 HA PRO 76 HA PRO 76 10.712 17.362 -5.354 488 HB2 PRO 76 HB2 PRO 76 11.238 17.059 -7.971 489 HB3 PRO 76 HB3 PRO 76 12.229 18.103 -6.943 490 HG2 PRO 76 HG2 PRO 76 12.766 15.313 -7.888 491 HG3 PRO 76 HG3 PRO 76 13.872 16.696 -7.796 492 HD2 PRO 76 HD2 PRO 76 13.777 14.703 -5.921 493 HD3 PRO 76 HD3 PRO 76 14.300 16.361 -5.567 494 H ASP 77 H ASP 77 10.571 14.476 -4.627 495 HA ASP 77 HA ASP 77 8.245 13.807 -6.250 496 HB2 ASP 77 HB2 ASP 77 10.571 12.614 -6.920 497 HB3 ASP 77 HB3 ASP 77 10.040 11.520 -5.647 498 H GLY 78 H GLY 78 10.185 13.458 -3.374 499 HA2 GLY 78 HA2 GLY 78 7.865 13.056 -1.741 500 HA3 GLY 78 HA3 GLY 78 8.833 11.596 -1.872 501 H CYS 79 H CYS 79 9.477 11.536 0.263 502 HA CYS 79 HA CYS 79 11.598 13.402 0.985 503 HB2 CYS 79 HB2 CYS 79 9.409 14.243 1.973 504 HB3 CYS 79 HB3 CYS 79 9.418 12.796 2.978 505 H HIS 80 H HIS 80 12.963 12.547 2.840 506 HA HIS 80 HA HIS 80 12.521 9.698 3.385 507 HB2 HIS 80 HB2 HIS 80 14.797 10.755 1.738 508 HB3 HIS 80 HB3 HIS 80 14.989 9.297 2.706 509 HD1 HIS 80 HD1 HIS 80 12.744 7.570 2.196 510 HD2 HIS 80 HD2 HIS 80 14.156 10.099 -0.783 511 HE1 HIS 80 HE1 HIS 80 11.943 6.572 0.032 512 HE2 HIS 80 HE2 HIS 80 12.912 8.054 -1.760 513 H GLU 81 H GLU 81 13.306 9.086 5.343 514 HA GLU 81 HA GLU 81 14.128 11.049 7.182 515 HB2 GLU 81 HB2 GLU 81 14.596 8.065 7.424 516 HB3 GLU 81 HB3 GLU 81 14.495 9.228 8.738 517 HG2 GLU 81 HG2 GLU 81 12.253 9.217 8.751 518 HG3 GLU 81 HG3 GLU 81 12.138 9.119 6.994 519 H ASP 82 H ASP 82 16.085 11.823 7.725 520 HA ASP 82 HA ASP 82 18.465 10.409 6.803 521 HB2 ASP 82 HB2 ASP 82 19.225 12.098 5.423 522 HB3 ASP 82 HB3 ASP 82 17.480 12.271 5.191 523 HA PRO 83 HA PRO 83 19.373 11.520 11.080 524 HB2 PRO 83 HB2 PRO 83 21.819 9.954 10.691 525 HB3 PRO 83 HB3 PRO 83 20.475 9.677 11.801 526 HG2 PRO 83 HG2 PRO 83 20.913 8.093 9.670 527 HG3 PRO 83 HG3 PRO 83 19.278 8.453 10.258 528 HD2 PRO 83 HD2 PRO 83 20.767 9.651 7.946 529 HD3 PRO 83 HD3 PRO 83 19.071 9.128 8.041 530 H ALA 84 H ALA 84 21.459 12.024 8.334 531 HA ALA 84 HA ALA 84 23.594 13.308 9.645 532 HB1 ALA 84 HB1 ALA 84 22.655 13.892 6.845 533 HB2 ALA 84 HB2 ALA 84 23.587 12.460 7.284 534 HB3 ALA 84 HB3 ALA 84 24.283 14.066 7.500 535 H CYS 85 H CYS 85 20.553 14.547 8.343 536 HA CYS 85 HA CYS 85 21.211 17.256 9.206 537 HB2 CYS 85 HB2 CYS 85 18.977 16.143 7.537 538 HB3 CYS 85 HB3 CYS 85 18.999 17.807 8.093 539 H ASP 86 H ASP 86 19.855 14.646 10.656 540 HA ASP 86 HA ASP 86 17.455 15.741 11.682 541 HB2 ASP 86 HB2 ASP 86 18.595 13.273 11.735 542 HB3 ASP 86 HB3 ASP 86 18.809 13.784 13.408 543 HA PRO 87 HA PRO 87 19.784 17.112 15.574 544 HB2 PRO 87 HB2 PRO 87 22.400 16.242 15.756 545 HB3 PRO 87 HB3 PRO 87 21.016 15.449 16.496 546 HG2 PRO 87 HG2 PRO 87 22.672 14.399 14.481 547 HG3 PRO 87 HG3 PRO 87 21.107 13.749 14.998 548 HD2 PRO 87 HD2 PRO 87 21.765 15.490 12.674 549 HD3 PRO 87 HD3 PRO 87 20.536 14.214 12.825 550 H GLU 88 H GLU 88 21.950 17.931 16.275 551 HA GLU 88 HA GLU 88 22.689 20.180 14.609 552 HB2 GLU 88 HB2 GLU 88 24.239 20.614 16.700 553 HB3 GLU 88 HB3 GLU 88 22.528 20.993 16.767 554 HG2 GLU 88 HG2 GLU 88 22.982 19.956 18.795 555 HG3 GLU 88 HG3 GLU 88 22.226 18.694 17.834 556 H ALA 89 H ALA 89 23.435 17.880 13.269 557 HA ALA 89 HA ALA 89 26.087 17.051 13.931 558 HB1 ALA 89 HB1 ALA 89 23.930 16.291 12.131 559 HB2 ALA 89 HB2 ALA 89 25.370 15.373 12.620 560 HB3 ALA 89 HB3 ALA 89 25.458 16.467 11.241 561 H ALA 90 H ALA 90 25.646 19.882 13.692 562 HA ALA 90 HA ALA 90 26.242 21.110 11.302 563 HB1 ALA 90 HB1 ALA 90 25.637 22.126 13.583 564 HB2 ALA 90 HB2 ALA 90 26.671 23.052 12.496 565 HB3 ALA 90 HB3 ALA 90 27.378 22.179 13.855 566 H PHE 91 H PHE 91 27.815 20.726 9.944 567 HA PHE 91 HA PHE 91 30.442 19.867 10.824 568 HB2 PHE 91 HB2 PHE 91 28.869 19.404 8.567 569 HB3 PHE 91 HB3 PHE 91 30.180 20.420 7.981 570 HD1 PHE 91 HD1 PHE 91 29.434 17.265 9.767 571 HD2 PHE 91 HD2 PHE 91 32.316 19.537 7.611 572 HE1 PHE 91 HE1 PHE 91 30.900 15.292 9.654 573 HE2 PHE 91 HE2 PHE 91 33.785 17.567 7.492 574 HZ PHE 91 HZ PHE 91 33.079 15.441 8.515 575 H SER 92 H SER 92 32.174 21.138 11.029 576 HA SER 92 HA SER 92 33.529 22.961 11.025 577 HB2 SER 92 HB2 SER 92 32.177 23.219 8.351 578 HB3 SER 92 HB3 SER 92 33.327 24.437 8.901 579 HG SER 92 HG SER 92 33.814 22.019 7.857 580 H1 ALA 101 H1 ALA 101 0.848 -11.659 15.726 581 H2 ALA 101 H2 ALA 101 0.764 -12.649 14.327 582 H3 ALA 101 H3 ALA 101 0.298 -13.277 15.854 583 HA ALA 101 HA ALA 101 -1.358 -12.310 14.031 584 HB1 ALA 101 HB1 ALA 101 -1.706 -12.293 17.028 585 HB2 ALA 101 HB2 ALA 101 -1.923 -13.685 15.968 586 HB3 ALA 101 HB3 ALA 101 -3.006 -12.300 15.836 587 H VAL 102 H VAL 102 -1.015 -10.549 17.034 588 HA VAL 102 HA VAL 102 -1.317 -8.311 17.597 589 HB VAL 102 HB VAL 102 0.928 -8.245 16.424 590 HG11 VAL 102 HG11 VAL 102 0.565 -8.551 14.163 591 HG12 VAL 102 HG12 VAL 102 0.846 -6.813 14.275 592 HG13 VAL 102 HG13 VAL 102 -0.798 -7.433 14.123 593 HG21 VAL 102 HG21 VAL 102 0.536 -6.363 17.667 594 HG22 VAL 102 HG22 VAL 102 -0.879 -5.898 16.724 595 HG23 VAL 102 HG23 VAL 102 0.738 -5.668 16.059 596 H LEU 103 H LEU 103 -1.722 -6.071 15.701 597 HA LEU 103 HA LEU 103 -4.515 -6.113 15.479 598 HB2 LEU 103 HB2 LEU 103 -2.480 -4.449 14.056 599 HB3 LEU 103 HB3 LEU 103 -4.209 -4.159 13.997 600 HG LEU 103 HG LEU 103 -3.238 -2.651 15.597 601 HD11 LEU 103 HD11 LEU 103 -4.298 -4.414 17.634 602 HD12 LEU 103 HD12 LEU 103 -5.310 -4.392 16.190 603 HD13 LEU 103 HD13 LEU 103 -4.928 -2.886 17.023 604 HD21 LEU 103 HD21 LEU 103 -2.342 -4.308 17.684 605 HD22 LEU 103 HD22 LEU 103 -1.390 -3.205 16.689 606 HD23 LEU 103 HD23 LEU 103 -1.570 -4.892 16.210 607 H ASP 104 H ASP 104 -5.357 -7.948 14.438 608 HA ASP 104 HA ASP 104 -4.485 -8.593 11.801 609 HB2 ASP 104 HB2 ASP 104 -6.547 -9.659 13.653 610 HB3 ASP 104 HB3 ASP 104 -6.762 -9.935 11.927 611 H LEU 105 H LEU 105 -7.908 -8.160 12.425 612 HA LEU 105 HA LEU 105 -7.746 -5.670 10.922 613 HB2 LEU 105 HB2 LEU 105 -7.714 -7.311 9.164 614 HB3 LEU 105 HB3 LEU 105 -9.148 -8.080 9.814 615 HG LEU 105 HG LEU 105 -10.539 -6.248 9.131 616 HD11 LEU 105 HD11 LEU 105 -9.020 -4.413 9.716 617 HD12 LEU 105 HD12 LEU 105 -9.683 -4.226 8.088 618 HD13 LEU 105 HD13 LEU 105 -8.029 -4.796 8.304 619 HD21 LEU 105 HD21 LEU 105 -10.072 -7.807 7.364 620 HD22 LEU 105 HD22 LEU 105 -8.582 -6.957 6.953 621 HD23 LEU 105 HD23 LEU 105 -10.142 -6.177 6.693 622 H ASP 106 H ASP 106 -8.775 -6.358 13.516 623 HA ASP 106 HA ASP 106 -11.646 -5.959 13.354 624 HB2 ASP 106 HB2 ASP 106 -9.652 -6.297 15.611 625 HB3 ASP 106 HB3 ASP 106 -11.243 -5.629 15.954 626 H VAL 107 H VAL 107 -10.052 -4.047 15.788 627 HA VAL 107 HA VAL 107 -10.249 -1.706 14.084 628 HB VAL 107 HB VAL 107 -11.719 -1.673 16.081 629 HG11 VAL 107 HG11 VAL 107 -9.405 -2.762 17.387 630 HG12 VAL 107 HG12 VAL 107 -11.073 -2.667 17.950 631 HG13 VAL 107 HG13 VAL 107 -9.972 -1.317 18.224 632 HG21 VAL 107 HG21 VAL 107 -11.329 0.516 16.513 633 HG22 VAL 107 HG22 VAL 107 -10.175 0.325 15.193 634 HG23 VAL 107 HG23 VAL 107 -9.621 0.251 16.866 635 H ARG 108 H ARG 108 -8.241 -1.132 13.469 636 HA ARG 108 HA ARG 108 -6.015 -2.532 14.526 637 HB2 ARG 108 HB2 ARG 108 -4.752 -1.124 12.894 638 HB3 ARG 108 HB3 ARG 108 -6.074 -2.020 12.160 639 HG2 ARG 108 HG2 ARG 108 -6.427 0.824 13.045 640 HG3 ARG 108 HG3 ARG 108 -5.731 0.427 11.475 641 HD2 ARG 108 HD2 ARG 108 -7.772 -0.938 11.004 642 HD3 ARG 108 HD3 ARG 108 -8.467 -0.318 12.501 643 HE ARG 108 HE ARG 108 -8.178 1.086 9.999 644 HH11 ARG 108 HH11 ARG 108 -8.612 1.435 13.451 645 HH12 ARG 108 HH12 ARG 108 -9.303 3.019 13.327 646 HH21 ARG 108 HH21 ARG 108 -9.089 3.167 9.843 647 HH22 ARG 108 HH22 ARG 108 -9.574 4.000 11.283 648 H THR 109 H THR 109 -5.334 -1.949 16.542 649 HA THR 109 HA THR 109 -5.649 0.831 17.316 650 HB THR 109 HB THR 109 -3.761 -1.120 18.647 651 HG1 THR 109 HG1 THR 109 -6.506 -0.912 19.274 652 HG21 THR 109 HG21 THR 109 -4.602 1.479 19.300 653 HG22 THR 109 HG22 THR 109 -3.626 0.372 20.265 654 HG23 THR 109 HG23 THR 109 -5.380 0.384 20.442 655 H CYS 110 H CYS 110 -4.730 1.948 15.770 656 HA CYS 110 HA CYS 110 -2.036 1.491 14.869 657 HB2 CYS 110 HB2 CYS 110 -4.133 3.529 14.212 658 HB3 CYS 110 HB3 CYS 110 -2.493 3.666 13.582 659 H LEU 111 H LEU 111 -0.271 2.085 16.030 660 HA LEU 111 HA LEU 111 0.067 3.601 18.223 661 HB2 LEU 111 HB2 LEU 111 1.844 2.400 16.881 662 HB3 LEU 111 HB3 LEU 111 1.980 3.855 15.912 663 HG LEU 111 HG LEU 111 2.494 5.092 18.073 664 HD11 LEU 111 HD11 LEU 111 3.606 2.902 19.472 665 HD12 LEU 111 HD12 LEU 111 1.915 2.523 19.146 666 HD13 LEU 111 HD13 LEU 111 2.338 4.009 19.997 667 HD21 LEU 111 HD21 LEU 111 4.856 4.041 18.156 668 HD22 LEU 111 HD22 LEU 111 4.311 4.807 16.664 669 HD23 LEU 111 HD23 LEU 111 4.283 3.050 16.814 670 HA PRO 112 HA PRO 112 -1.298 7.665 16.816 671 HB2 PRO 112 HB2 PRO 112 -1.920 8.699 19.186 672 HB3 PRO 112 HB3 PRO 112 -2.888 7.406 18.466 673 HG2 PRO 112 HG2 PRO 112 -0.767 7.228 20.576 674 HG3 PRO 112 HG3 PRO 112 -2.365 6.459 20.533 675 HD2 PRO 112 HD2 PRO 112 -0.040 5.194 19.812 676 HD3 PRO 112 HD3 PRO 112 -1.641 4.754 19.186 677 H CYS 113 H CYS 113 -0.536 9.732 16.679 678 HA CYS 113 HA CYS 113 1.528 10.693 18.449 679 HB2 CYS 113 HB2 CYS 113 3.243 11.125 16.769 680 HB3 CYS 113 HB3 CYS 113 2.879 9.410 16.787 681 H GLY 114 H GLY 114 2.405 12.871 17.128 682 HA2 GLY 114 HA2 GLY 114 1.933 14.919 16.237 683 HA3 GLY 114 HA3 GLY 114 0.431 14.259 15.628 684 HA PRO 115 HA PRO 115 -0.709 17.539 18.753 685 HB2 PRO 115 HB2 PRO 115 -2.778 18.503 17.392 686 HB3 PRO 115 HB3 PRO 115 -1.124 18.869 16.827 687 HG2 PRO 115 HG2 PRO 115 -2.718 16.444 16.220 688 HG3 PRO 115 HG3 PRO 115 -2.375 17.742 15.003 689 HD2 PRO 115 HD2 PRO 115 -0.688 15.789 15.029 690 HD3 PRO 115 HD3 PRO 115 0.048 17.374 15.412 691 H GLY 116 H GLY 116 -1.412 16.371 20.180 692 HA2 GLY 116 HA2 GLY 116 -2.996 15.590 21.680 693 HA3 GLY 116 HA3 GLY 116 -4.102 15.412 20.323 694 H GLY 117 H GLY 117 -1.668 13.987 18.919 695 HA2 GLY 117 HA2 GLY 117 -0.781 11.969 18.810 696 HA3 GLY 117 HA3 GLY 117 -1.315 11.738 20.429 697 H LYS 118 H LYS 118 -2.839 12.469 17.389 698 HA LYS 118 HA LYS 118 -4.771 10.278 17.682 699 HB2 LYS 118 HB2 LYS 118 -4.968 12.004 15.298 700 HB3 LYS 118 HB3 LYS 118 -6.225 11.536 16.431 701 HG2 LYS 118 HG2 LYS 118 -4.558 13.380 17.774 702 HG3 LYS 118 HG3 LYS 118 -4.868 14.038 16.172 703 HD2 LYS 118 HD2 LYS 118 -7.349 13.279 16.779 704 HD3 LYS 118 HD3 LYS 118 -6.727 13.500 18.419 705 HE2 LYS 118 HE2 LYS 118 -6.056 15.679 16.579 706 HE3 LYS 118 HE3 LYS 118 -7.786 15.475 16.846 707 HZ1 LYS 118 HZ1 LYS 118 -6.671 15.279 19.337 708 HZ2 LYS 118 HZ2 LYS 118 -7.485 16.622 18.708 709 HZ3 LYS 118 HZ3 LYS 118 -5.799 16.528 18.600 710 H GLY 119 H GLY 119 -2.895 11.852 15.276 711 HA2 GLY 119 HA2 GLY 119 -2.735 10.121 13.368 712 HA3 GLY 119 HA3 GLY 119 -1.326 11.122 13.642 713 H ARG 120 H ARG 120 -0.782 9.008 12.365 714 HA ARG 120 HA ARG 120 -0.017 6.924 14.295 715 HB2 ARG 120 HB2 ARG 120 -1.192 6.954 11.673 716 HB3 ARG 120 HB3 ARG 120 0.103 5.769 11.809 717 HG2 ARG 120 HG2 ARG 120 -1.344 4.389 12.784 718 HG3 ARG 120 HG3 ARG 120 -1.500 5.537 14.118 719 HD2 ARG 120 HD2 ARG 120 -3.689 5.064 13.215 720 HD3 ARG 120 HD3 ARG 120 -3.247 6.730 12.842 721 HE ARG 120 HE ARG 120 -2.504 5.624 10.603 722 HH11 ARG 120 HH11 ARG 120 -5.357 4.861 12.474 723 HH12 ARG 120 HH12 ARG 120 -6.265 4.331 11.097 724 HH21 ARG 120 HH21 ARG 120 -3.696 4.926 8.803 725 HH22 ARG 120 HH22 ARG 120 -5.322 4.367 9.014 726 H CYS 121 H CYS 121 1.830 5.607 13.792 727 HA CYS 121 HA CYS 121 4.063 7.269 12.834 728 HB2 CYS 121 HB2 CYS 121 3.813 5.125 14.902 729 HB3 CYS 121 HB3 CYS 121 5.371 5.374 14.116 730 H PHE 122 H PHE 122 5.402 6.623 11.281 731 HA PHE 122 HA PHE 122 5.356 3.884 10.289 732 HB2 PHE 122 HB2 PHE 122 4.659 6.301 8.614 733 HB3 PHE 122 HB3 PHE 122 5.173 4.769 7.915 734 HD1 PHE 122 HD1 PHE 122 3.749 2.788 8.083 735 HD2 PHE 122 HD2 PHE 122 2.475 6.575 9.547 736 HE1 PHE 122 HE1 PHE 122 1.428 1.974 8.156 737 HE2 PHE 122 HE2 PHE 122 0.152 5.768 9.624 738 HZ PHE 122 HZ PHE 122 -0.374 3.465 8.928 739 H GLY 123 H GLY 123 7.195 5.780 11.680 740 HA2 GLY 123 HA2 GLY 123 9.650 5.055 10.938 741 HA3 GLY 123 HA3 GLY 123 9.303 6.301 9.743 742 HA PRO 124 HA PRO 124 10.801 7.988 14.021 743 HB2 PRO 124 HB2 PRO 124 13.189 8.784 12.443 744 HB3 PRO 124 HB3 PRO 124 13.087 8.146 14.088 745 HG2 PRO 124 HG2 PRO 124 13.961 6.618 12.086 746 HG3 PRO 124 HG3 PRO 124 12.936 5.947 13.369 747 HD2 PRO 124 HD2 PRO 124 12.204 6.735 10.575 748 HD3 PRO 124 HD3 PRO 124 11.666 5.336 11.528 749 H SER 125 H SER 125 11.992 9.499 10.998 750 HA SER 125 HA SER 125 10.798 12.023 11.838 751 HB2 SER 125 HB2 SER 125 12.833 11.228 9.785 752 HB3 SER 125 HB3 SER 125 11.944 12.739 9.538 753 HG SER 125 HG SER 125 12.820 13.556 11.358 754 H ILE 126 H ILE 126 8.920 10.001 11.172 755 HA ILE 126 HA ILE 126 7.479 11.355 9.102 756 HB ILE 126 HB ILE 126 7.722 8.404 8.680 757 HG12 ILE 126 HG12 ILE 126 9.550 10.463 7.410 758 HG13 ILE 126 HG13 ILE 126 10.057 9.324 8.652 759 HG21 ILE 126 HG21 ILE 126 6.617 8.856 6.786 760 HG22 ILE 126 HG22 ILE 126 7.503 10.356 6.509 761 HG23 ILE 126 HG23 ILE 126 6.170 10.319 7.660 762 HD11 ILE 126 HD11 ILE 126 10.050 8.947 5.871 763 HD12 ILE 126 HD12 ILE 126 8.800 7.889 6.525 764 HD13 ILE 126 HD13 ILE 126 10.454 7.774 7.124 765 H CYS 127 H CYS 127 5.422 11.552 9.794 766 HA CYS 127 HA CYS 127 4.171 9.305 11.215 767 HB2 CYS 127 HB2 CYS 127 4.919 11.753 12.486 768 HB3 CYS 127 HB3 CYS 127 3.165 11.722 12.379 769 H CYS 128 H CYS 128 2.565 8.745 9.940 770 HA CYS 128 HA CYS 128 0.902 10.800 8.696 771 HB2 CYS 128 HB2 CYS 128 0.647 8.047 7.656 772 HB3 CYS 128 HB3 CYS 128 0.661 9.565 6.780 773 H GLY 129 H GLY 129 -1.442 10.305 8.377 774 HA2 GLY 129 HA2 GLY 129 -2.664 8.269 9.968 775 HA3 GLY 129 HA3 GLY 129 -2.987 9.916 10.511 776 H ASP 130 H ASP 130 -5.183 8.939 9.815 777 HA ASP 130 HA ASP 130 -5.925 8.743 7.108 778 HB2 ASP 130 HB2 ASP 130 -7.038 7.812 9.248 779 HB3 ASP 130 HB3 ASP 130 -7.830 9.380 9.330 780 H GLU 131 H GLU 131 -6.216 11.201 9.356 781 HA GLU 131 HA GLU 131 -6.871 13.185 7.233 782 HB2 GLU 131 HB2 GLU 131 -7.820 14.137 9.822 783 HB3 GLU 131 HB3 GLU 131 -8.653 14.076 8.281 784 HG2 GLU 131 HG2 GLU 131 -8.860 11.516 8.878 785 HG3 GLU 131 HG3 GLU 131 -8.645 12.121 10.519 786 H LEU 132 H LEU 132 -4.516 12.355 8.634 787 HA LEU 132 HA LEU 132 -3.474 14.910 9.433 788 HB2 LEU 132 HB2 LEU 132 -3.756 12.518 10.820 789 HB3 LEU 132 HB3 LEU 132 -2.074 12.755 10.508 790 HG LEU 132 HG LEU 132 -3.726 14.959 11.664 791 HD11 LEU 132 HD11 LEU 132 -3.057 12.433 12.978 792 HD12 LEU 132 HD12 LEU 132 -4.309 13.619 13.346 793 HD13 LEU 132 HD13 LEU 132 -2.656 13.882 13.901 794 HD21 LEU 132 HD21 LEU 132 -1.770 15.924 12.345 795 HD22 LEU 132 HD22 LEU 132 -1.191 15.056 10.923 796 HD23 LEU 132 HD23 LEU 132 -0.942 14.378 12.532 797 H GLY 133 H GLY 133 -3.420 12.380 7.303 798 HA2 GLY 133 HA2 GLY 133 -2.058 11.803 5.617 799 HA3 GLY 133 HA3 GLY 133 -1.636 13.463 5.680 800 H CYS 134 H CYS 134 0.744 13.701 5.773 801 HA CYS 134 HA CYS 134 1.951 12.038 7.836 802 HB2 CYS 134 HB2 CYS 134 2.201 10.970 5.401 803 HB3 CYS 134 HB3 CYS 134 3.564 12.080 5.372 804 H PHE 135 H PHE 135 3.281 13.143 9.105 805 HA PHE 135 HA PHE 135 4.310 15.647 8.009 806 HB2 PHE 135 HB2 PHE 135 4.078 14.592 10.862 807 HB3 PHE 135 HB3 PHE 135 4.848 16.110 10.427 808 HD1 PHE 135 HD1 PHE 135 1.626 14.644 9.256 809 HD2 PHE 135 HD2 PHE 135 3.579 17.748 11.415 810 HE1 PHE 135 HE1 PHE 135 -0.528 15.802 9.537 811 HE2 PHE 135 HE2 PHE 135 1.431 18.912 11.697 812 HZ PHE 135 HZ PHE 135 -0.627 17.938 10.758 813 H VAL 136 H VAL 136 6.108 14.943 6.948 814 HA VAL 136 HA VAL 136 7.595 12.814 8.208 815 HB VAL 136 HB VAL 136 8.323 13.985 5.536 816 HG11 VAL 136 HG11 VAL 136 9.036 11.611 7.150 817 HG12 VAL 136 HG12 VAL 136 10.019 12.560 6.035 818 HG13 VAL 136 HG13 VAL 136 8.877 11.370 5.410 819 HG21 VAL 136 HG21 VAL 136 6.047 13.410 5.191 820 HG22 VAL 136 HG22 VAL 136 6.176 11.963 6.191 821 HG23 VAL 136 HG23 VAL 136 6.957 12.015 4.610 822 H GLY 137 H GLY 137 8.423 13.605 9.848 823 HA2 GLY 137 HA2 GLY 137 10.349 14.355 10.978 824 HA3 GLY 137 HA3 GLY 137 10.880 15.159 9.511 825 H THR 138 H THR 138 8.655 15.366 12.226 826 HA THR 138 HA THR 138 9.087 18.205 12.361 827 HB THR 138 HB THR 138 6.661 18.764 12.259 828 HG1 THR 138 HG1 THR 138 6.146 16.389 12.579 829 HG21 THR 138 HG21 THR 138 6.351 18.221 9.755 830 HG22 THR 138 HG22 THR 138 8.010 17.632 9.851 831 HG23 THR 138 HG23 THR 138 7.646 19.311 10.251 832 H ALA 139 H ALA 139 6.846 18.682 13.840 833 HA ALA 139 HA ALA 139 7.709 17.816 16.507 834 HB1 ALA 139 HB1 ALA 139 6.767 20.044 16.347 835 HB2 ALA 139 HB2 ALA 139 5.742 19.052 17.384 836 HB3 ALA 139 HB3 ALA 139 5.251 19.393 15.725 837 H GLU 140 H GLU 140 5.071 17.256 14.330 838 HA GLU 140 HA GLU 140 3.445 15.522 15.747 839 HB2 GLU 140 HB2 GLU 140 3.494 16.533 13.208 840 HB3 GLU 140 HB3 GLU 140 3.783 14.824 12.917 841 HG2 GLU 140 HG2 GLU 140 1.614 15.334 14.796 842 HG3 GLU 140 HG3 GLU 140 1.340 16.007 13.190 843 H ALA 141 H ALA 141 6.506 14.827 14.164 844 HA ALA 141 HA ALA 141 6.186 11.983 14.431 845 HB1 ALA 141 HB1 ALA 141 7.287 12.669 12.453 846 HB2 ALA 141 HB2 ALA 141 8.548 12.008 13.494 847 HB3 ALA 141 HB3 ALA 141 8.360 13.754 13.337 848 H LEU 142 H LEU 142 7.946 14.559 15.774 849 HA LEU 142 HA LEU 142 9.899 13.528 17.227 850 HB2 LEU 142 HB2 LEU 142 8.074 15.717 17.930 851 HB3 LEU 142 HB3 LEU 142 9.044 15.083 19.232 852 HG LEU 142 HG LEU 142 10.282 15.992 16.651 853 HD11 LEU 142 HD11 LEU 142 10.176 18.158 17.197 854 HD12 LEU 142 HD12 LEU 142 10.446 17.839 18.911 855 HD13 LEU 142 HD13 LEU 142 8.829 17.675 18.227 856 HD21 LEU 142 HD21 LEU 142 12.030 15.035 17.683 857 HD22 LEU 142 HD22 LEU 142 11.242 15.058 19.261 858 HD23 LEU 142 HD23 LEU 142 12.043 16.507 18.654 859 H ARG 143 H ARG 143 6.663 13.460 18.723 860 HA ARG 143 HA ARG 143 7.466 11.917 20.945 861 HB2 ARG 143 HB2 ARG 143 4.970 10.971 20.603 862 HB3 ARG 143 HB3 ARG 143 5.298 12.527 21.334 863 HG2 ARG 143 HG2 ARG 143 4.886 12.376 18.390 864 HG3 ARG 143 HG3 ARG 143 3.494 12.276 19.469 865 HD2 ARG 143 HD2 ARG 143 5.449 14.530 19.129 866 HD3 ARG 143 HD3 ARG 143 3.696 14.557 18.952 867 HE ARG 143 HE ARG 143 3.683 14.139 21.452 868 HH11 ARG 143 HH11 ARG 143 6.248 15.891 19.846 869 HH12 ARG 143 HH12 ARG 143 6.683 16.792 21.260 870 HH21 ARG 143 HH21 ARG 143 4.261 15.326 23.306 871 HH22 ARG 143 HH22 ARG 143 5.558 16.471 23.222 872 H CYS 144 H CYS 144 7.158 10.954 17.463 873 HA CYS 144 HA CYS 144 6.773 8.267 18.159 874 HB2 CYS 144 HB2 CYS 144 6.280 9.578 15.987 875 HB3 CYS 144 HB3 CYS 144 7.995 9.391 15.640 876 H GLN 145 H GLN 145 9.234 9.502 19.704 877 HA GLN 145 HA GLN 145 11.366 8.219 18.325 878 HB2 GLN 145 HB2 GLN 145 11.455 10.428 19.672 879 HB3 GLN 145 HB3 GLN 145 11.214 9.433 21.099 880 HG2 GLN 145 HG2 GLN 145 13.300 8.174 19.882 881 HG3 GLN 145 HG3 GLN 145 13.604 9.865 19.484 882 HE21 GLN 145 HE21 GLN 145 13.416 11.385 21.379 883 HE22 GLN 145 HE22 GLN 145 14.089 10.851 22.877 884 H GLU 146 H GLU 146 8.796 7.768 20.601 885 HA GLU 146 HA GLU 146 10.027 5.481 21.925 886 HB2 GLU 146 HB2 GLU 146 7.293 6.741 22.011 887 HB3 GLU 146 HB3 GLU 146 7.605 5.194 22.786 888 HG2 GLU 146 HG2 GLU 146 8.023 6.501 24.561 889 HG3 GLU 146 HG3 GLU 146 9.620 6.615 23.822 890 H GLU 147 H GLU 147 9.149 5.801 18.873 891 HA GLU 147 HA GLU 147 7.464 3.467 18.559 892 HB2 GLU 147 HB2 GLU 147 7.532 5.549 17.022 893 HB3 GLU 147 HB3 GLU 147 8.987 4.830 16.347 894 HG2 GLU 147 HG2 GLU 147 7.179 2.753 16.309 895 HG3 GLU 147 HG3 GLU 147 6.199 4.161 15.905 896 H ASN 148 H ASN 148 10.621 3.895 19.373 897 HA ASN 148 HA ASN 148 11.818 1.888 17.690 898 HB2 ASN 148 HB2 ASN 148 13.784 2.139 19.107 899 HB3 ASN 148 HB3 ASN 148 13.155 3.724 18.674 900 HD21 ASN 148 HD21 ASN 148 11.083 3.983 20.458 901 HD22 ASN 148 HD22 ASN 148 11.714 4.058 22.064 902 H TYR 149 H TYR 149 10.098 1.971 20.720 903 HA TYR 149 HA TYR 149 10.732 -0.878 21.162 904 HB2 TYR 149 HB2 TYR 149 10.934 1.163 22.941 905 HB3 TYR 149 HB3 TYR 149 9.300 0.603 23.277 906 HD1 TYR 149 HD1 TYR 149 9.358 -2.230 23.121 907 HD2 TYR 149 HD2 TYR 149 12.413 0.382 24.517 908 HE1 TYR 149 HE1 TYR 149 10.264 -4.043 24.515 909 HE2 TYR 149 HE2 TYR 149 13.328 -1.424 25.912 910 HH TYR 149 HH TYR 149 11.700 -4.129 26.720 911 H LEU 150 H LEU 150 8.569 0.562 19.420 912 HA LEU 150 HA LEU 150 6.430 -1.277 20.201 913 HB2 LEU 150 HB2 LEU 150 6.299 1.652 20.306 914 HB3 LEU 150 HB3 LEU 150 4.981 0.912 19.419 915 HG LEU 150 HG LEU 150 4.930 -0.625 21.625 916 HD11 LEU 150 HD11 LEU 150 5.200 1.753 23.179 917 HD12 LEU 150 HD12 LEU 150 6.709 1.447 22.319 918 HD13 LEU 150 HD13 LEU 150 6.022 0.204 23.365 919 HD21 LEU 150 HD21 LEU 150 3.190 1.011 22.477 920 HD22 LEU 150 HD22 LEU 150 2.974 0.422 20.829 921 HD23 LEU 150 HD23 LEU 150 3.628 2.035 21.110 922 HA PRO 151 HA PRO 151 6.807 -1.283 15.641 923 HB2 PRO 151 HB2 PRO 151 7.175 -3.896 15.265 924 HB3 PRO 151 HB3 PRO 151 8.483 -2.873 15.869 925 HG2 PRO 151 HG2 PRO 151 6.783 -4.826 17.325 926 HG3 PRO 151 HG3 PRO 151 8.468 -4.367 17.612 927 HD2 PRO 151 HD2 PRO 151 6.171 -3.407 18.978 928 HD3 PRO 151 HD3 PRO 151 7.835 -2.814 19.134 929 H SER 152 H SER 152 4.339 -0.953 16.839 930 HA SER 152 HA SER 152 2.538 -3.101 16.313 931 HB2 SER 152 HB2 SER 152 2.420 -0.733 17.733 932 HB3 SER 152 HB3 SER 152 1.337 -0.436 16.373 933 HG SER 152 HG SER 152 0.103 -2.153 16.976 934 HA PRO 153 HA PRO 153 2.218 -2.168 11.920 935 HB2 PRO 153 HB2 PRO 153 0.823 -4.335 11.179 936 HB3 PRO 153 HB3 PRO 153 2.534 -4.431 11.610 937 HG2 PRO 153 HG2 PRO 153 0.128 -5.141 13.233 938 HG3 PRO 153 HG3 PRO 153 1.678 -5.988 13.097 939 HD2 PRO 153 HD2 PRO 153 0.997 -4.311 15.174 940 HD3 PRO 153 HD3 PRO 153 2.663 -4.680 14.689 941 H CYS 154 H CYS 154 -0.659 -3.420 13.631 942 HA CYS 154 HA CYS 154 -2.862 -2.938 13.555 943 HB2 CYS 154 HB2 CYS 154 -3.497 -0.709 13.867 944 HB3 CYS 154 HB3 CYS 154 -1.845 -0.764 14.454 945 H GLN 155 H GLN 155 -4.393 -3.514 12.141 946 HA GLN 155 HA GLN 155 -3.826 -3.542 9.351 947 HB2 GLN 155 HB2 GLN 155 -5.765 -4.677 10.862 948 HB3 GLN 155 HB3 GLN 155 -6.692 -3.435 10.030 949 HG2 GLN 155 HG2 GLN 155 -5.028 -5.593 8.751 950 HG3 GLN 155 HG3 GLN 155 -6.787 -5.500 8.792 951 HE21 GLN 155 HE21 GLN 155 -7.827 -4.357 7.263 952 HE22 GLN 155 HE22 GLN 155 -7.048 -3.460 6.009 953 H SER 156 H SER 156 -3.191 -1.534 8.534 954 HA SER 156 HA SER 156 -4.967 0.050 7.217 955 HB2 SER 156 HB2 SER 156 -5.437 0.610 9.862 956 HB3 SER 156 HB3 SER 156 -4.299 1.882 9.423 957 HG SER 156 HG SER 156 -5.745 2.753 8.135 958 H GLY 157 H GLY 157 -3.785 1.061 5.726 959 HA2 GLY 157 HA2 GLY 157 -2.161 2.772 5.168 960 HA3 GLY 157 HA3 GLY 157 -1.215 2.254 6.555 961 H GLN 158 H GLN 158 -2.695 0.050 4.238 962 HA GLN 158 HA GLN 158 0.021 -0.553 3.300 963 HB2 GLN 158 HB2 GLN 158 -2.178 -2.382 4.185 964 HB3 GLN 158 HB3 GLN 158 -1.017 -2.940 2.988 965 HG2 GLN 158 HG2 GLN 158 0.652 -3.108 4.485 966 HG3 GLN 158 HG3 GLN 158 0.140 -1.677 5.377 967 HE21 GLN 158 HE21 GLN 158 -1.300 -1.885 7.063 968 HE22 GLN 158 HE22 GLN 158 -1.726 -3.413 7.747 969 H LYS 159 H LYS 159 -0.765 1.113 1.749 970 HA LYS 159 HA LYS 159 -2.018 -0.188 -0.564 971 HB2 LYS 159 HB2 LYS 159 -2.556 2.406 0.632 972 HB3 LYS 159 HB3 LYS 159 -2.152 2.532 -1.077 973 HG2 LYS 159 HG2 LYS 159 -4.057 0.398 -0.377 974 HG3 LYS 159 HG3 LYS 159 -4.635 2.050 -0.148 975 HD2 LYS 159 HD2 LYS 159 -4.092 2.585 -2.454 976 HD3 LYS 159 HD3 LYS 159 -3.423 0.969 -2.692 977 HE2 LYS 159 HE2 LYS 159 -5.599 0.944 -3.627 978 HE3 LYS 159 HE3 LYS 159 -5.697 0.063 -2.103 979 HZ1 LYS 159 HZ1 LYS 159 -6.537 2.134 -1.076 980 HZ2 LYS 159 HZ2 LYS 159 -7.562 1.520 -2.273 981 HZ3 LYS 159 HZ3 LYS 159 -6.576 2.853 -2.608 982 HA PRO 160 HA PRO 160 2.582 0.661 -1.064 983 HB2 PRO 160 HB2 PRO 160 2.983 -1.545 -2.676 984 HB3 PRO 160 HB3 PRO 160 3.275 -1.454 -0.938 985 HG2 PRO 160 HG2 PRO 160 0.896 -2.513 -2.408 986 HG3 PRO 160 HG3 PRO 160 1.696 -3.151 -0.958 987 HD2 PRO 160 HD2 PRO 160 -0.590 -1.798 -0.757 988 HD3 PRO 160 HD3 PRO 160 0.705 -1.562 0.435 989 H CYS 161 H CYS 161 1.939 2.459 -2.313 990 HA CYS 161 HA CYS 161 2.060 2.070 -5.220 991 HB2 CYS 161 HB2 CYS 161 1.757 4.732 -5.063 992 HB3 CYS 161 HB3 CYS 161 0.390 3.629 -5.107 993 H GLY 162 H GLY 162 3.460 4.466 -5.910 994 HA2 GLY 162 HA2 GLY 162 5.611 5.291 -6.013 995 HA3 GLY 162 HA3 GLY 162 5.682 4.941 -4.294 996 H SER 163 H SER 163 7.968 4.561 -4.871 997 HA SER 163 HA SER 163 8.551 2.144 -6.353 998 HB2 SER 163 HB2 SER 163 10.951 2.704 -5.533 999 HB3 SER 163 HB3 SER 163 10.190 3.782 -6.703 1000 HG SER 163 HG SER 163 10.166 5.320 -5.265 1001 H GLY 164 H GLY 164 6.899 1.717 -4.177 1002 HA2 GLY 164 HA2 GLY 164 7.140 -0.441 -3.017 1003 HA3 GLY 164 HA3 GLY 164 8.664 0.163 -2.413 1004 H GLY 165 H GLY 165 6.389 2.792 -2.123 1005 HA2 GLY 165 HA2 GLY 165 6.116 2.007 0.691 1006 HA3 GLY 165 HA3 GLY 165 5.949 3.621 0.037 1007 H ARG 166 H ARG 166 4.194 2.346 1.888 1008 HA ARG 166 HA ARG 166 1.772 1.765 0.346 1009 HB2 ARG 166 HB2 ARG 166 0.851 1.191 2.654 1010 HB3 ARG 166 HB3 ARG 166 2.102 0.138 2.005 1011 HG2 ARG 166 HG2 ARG 166 3.306 2.260 3.508 1012 HG3 ARG 166 HG3 ARG 166 2.067 1.460 4.477 1013 HD2 ARG 166 HD2 ARG 166 3.832 -0.333 2.954 1014 HD3 ARG 166 HD3 ARG 166 4.617 0.586 4.238 1015 HE ARG 166 HE ARG 166 2.202 -1.007 4.762 1016 HH11 ARG 166 HH11 ARG 166 5.542 -0.223 5.453 1017 HH12 ARG 166 HH12 ARG 166 5.609 -1.206 6.877 1018 HH21 ARG 166 HH21 ARG 166 2.299 -2.300 6.641 1019 HH22 ARG 166 HH22 ARG 166 3.771 -2.383 7.550 1020 H CYS 167 H CYS 167 -0.238 2.828 0.792 1021 HA CYS 167 HA CYS 167 -0.006 5.604 1.206 1022 HB2 CYS 167 HB2 CYS 167 -2.142 3.710 0.415 1023 HB3 CYS 167 HB3 CYS 167 -2.690 5.156 1.255 1024 H ALA 168 H ALA 168 0.377 6.319 3.163 1025 HA ALA 168 HA ALA 168 -0.900 5.027 5.470 1026 HB1 ALA 168 HB1 ALA 168 1.085 5.491 6.398 1027 HB2 ALA 168 HB2 ALA 168 0.585 7.182 6.404 1028 HB3 ALA 168 HB3 ALA 168 1.539 6.550 5.063 1029 H ALA 169 H ALA 169 -1.366 7.528 3.237 1030 HA ALA 169 HA ALA 169 -3.642 8.523 4.592 1031 HB1 ALA 169 HB1 ALA 169 -1.434 10.536 4.363 1032 HB2 ALA 169 HB2 ALA 169 -1.728 9.616 5.839 1033 HB3 ALA 169 HB3 ALA 169 -2.980 10.680 5.197 1034 H ALA 170 H ALA 170 -4.650 10.305 3.322 1035 HA ALA 170 HA ALA 170 -4.708 9.728 0.612 1036 HB1 ALA 170 HB1 ALA 170 -6.642 10.658 1.598 1037 HB2 ALA 170 HB2 ALA 170 -6.095 11.793 0.365 1038 HB3 ALA 170 HB3 ALA 170 -5.786 12.122 2.077 1039 H GLY 171 H GLY 171 -3.493 10.207 -1.028 1040 HA2 GLY 171 HA2 GLY 171 -1.971 11.245 -2.421 1041 HA3 GLY 171 HA3 GLY 171 -2.453 12.746 -1.647 1042 H ILE 172 H ILE 172 -1.094 9.987 -0.249 1043 HA ILE 172 HA ILE 172 1.559 10.991 -0.047 1044 HB ILE 172 HB ILE 172 1.932 11.251 2.251 1045 HG12 ILE 172 HG12 ILE 172 -0.568 11.439 3.472 1046 HG13 ILE 172 HG13 ILE 172 -0.589 9.913 2.570 1047 HG21 ILE 172 HG21 ILE 172 -0.474 12.880 1.477 1048 HG22 ILE 172 HG22 ILE 172 1.183 13.187 0.958 1049 HG23 ILE 172 HG23 ILE 172 0.759 13.307 2.665 1050 HD11 ILE 172 HD11 ILE 172 1.926 10.346 3.771 1051 HD12 ILE 172 HD12 ILE 172 0.816 8.983 3.987 1052 HD13 ILE 172 HD13 ILE 172 0.662 10.427 5.002 1053 H CYS 173 H CYS 173 2.282 9.225 -0.906 1054 HA CYS 173 HA CYS 173 1.735 6.630 0.333 1055 HB2 CYS 173 HB2 CYS 173 1.554 7.156 -2.206 1056 HB3 CYS 173 HB3 CYS 173 3.311 7.076 -2.185 1057 H CYS 174 H CYS 174 3.073 6.939 2.178 1058 HA CYS 174 HA CYS 174 5.921 7.345 1.701 1059 HB2 CYS 174 HB2 CYS 174 4.840 6.857 4.442 1060 HB3 CYS 174 HB3 CYS 174 6.157 7.901 3.932 1061 H SER 175 H SER 175 7.513 5.895 2.274 1062 HA SER 175 HA SER 175 6.625 3.107 2.624 1063 HB2 SER 175 HB2 SER 175 8.845 2.511 1.621 1064 HB3 SER 175 HB3 SER 175 7.806 3.425 0.528 1065 HG SER 175 HG SER 175 9.439 4.981 2.095 1066 HA PRO 176 HA PRO 176 8.997 2.807 6.361 1067 HB2 PRO 176 HB2 PRO 176 10.558 0.627 6.203 1068 HB3 PRO 176 HB3 PRO 176 8.794 0.502 6.228 1069 HG2 PRO 176 HG2 PRO 176 10.670 0.364 3.899 1070 HG3 PRO 176 HG3 PRO 176 9.255 -0.642 4.256 1071 HD2 PRO 176 HD2 PRO 176 9.219 1.458 2.499 1072 HD3 PRO 176 HD3 PRO 176 7.791 0.899 3.391 1073 H ASP 177 H ASP 177 10.218 4.350 4.124 1074 HA ASP 177 HA ASP 177 12.860 4.677 5.309 1075 HB2 ASP 177 HB2 ASP 177 12.721 3.211 3.048 1076 HB3 ASP 177 HB3 ASP 177 12.801 4.824 2.344 1077 H GLY 178 H GLY 178 10.191 5.839 3.392 1078 HA2 GLY 178 HA2 GLY 178 10.601 8.533 4.278 1079 HA3 GLY 178 HA3 GLY 178 10.986 8.338 2.575 1080 H CYS 179 H CYS 179 9.317 9.591 1.799 1081 HA CYS 179 HA CYS 179 6.693 8.328 1.804 1082 HB2 CYS 179 HB2 CYS 179 6.752 10.074 3.654 1083 HB3 CYS 179 HB3 CYS 179 6.911 11.280 2.380 1084 H HIS 180 H HIS 180 5.236 9.282 0.035 1085 HA HIS 180 HA HIS 180 6.717 10.810 -1.980 1086 HB2 HIS 180 HB2 HIS 180 5.991 7.912 -2.323 1087 HB3 HIS 180 HB3 HIS 180 6.082 8.984 -3.713 1088 HD1 HIS 180 HD1 HIS 180 8.567 10.437 -3.569 1089 HD2 HIS 180 HD2 HIS 180 8.303 6.578 -2.052 1090 HE1 HIS 180 HE1 HIS 180 10.928 9.574 -3.512 1091 HE2 HIS 180 HE2 HIS 180 10.728 7.198 -2.699 1092 H GLU 181 H GLU 181 5.406 12.020 -3.220 1093 HA GLU 181 HA GLU 181 2.702 12.292 -2.541 1094 HB2 GLU 181 HB2 GLU 181 3.969 13.151 -5.155 1095 HB3 GLU 181 HB3 GLU 181 2.533 13.830 -4.402 1096 HG2 GLU 181 HG2 GLU 181 3.716 15.133 -3.014 1097 HG3 GLU 181 HG3 GLU 181 4.953 13.907 -2.746 1098 H ASP 182 H ASP 182 0.890 11.331 -3.245 1099 HA ASP 182 HA ASP 182 1.005 9.712 -5.669 1100 HB2 ASP 182 HB2 ASP 182 0.548 7.700 -4.631 1101 HB3 ASP 182 HB3 ASP 182 1.520 8.480 -3.374 1102 HA PRO 183 HA PRO 183 -2.826 12.064 -6.038 1103 HB2 PRO 183 HB2 PRO 183 -3.000 10.860 -8.704 1104 HB3 PRO 183 HB3 PRO 183 -2.842 12.557 -8.248 1105 HG2 PRO 183 HG2 PRO 183 -0.829 11.201 -9.410 1106 HG3 PRO 183 HG3 PRO 183 -0.540 12.470 -8.205 1107 HD2 PRO 183 HD2 PRO 183 -0.520 9.491 -7.860 1108 HD3 PRO 183 HD3 PRO 183 0.610 10.704 -7.219 1109 H ALA 184 H ALA 184 -2.459 8.634 -6.530 1110 HA ALA 184 HA ALA 184 -5.143 7.987 -7.078 1111 HB1 ALA 184 HB1 ALA 184 -3.071 6.510 -7.292 1112 HB2 ALA 184 HB2 ALA 184 -4.553 5.752 -6.711 1113 HB3 ALA 184 HB3 ALA 184 -3.278 6.182 -5.571 1114 H CYS 185 H CYS 185 -3.394 8.357 -4.030 1115 HA CYS 185 HA CYS 185 -5.813 7.751 -2.506 1116 HB2 CYS 185 HB2 CYS 185 -2.940 8.154 -1.707 1117 HB3 CYS 185 HB3 CYS 185 -4.234 8.034 -0.529 1118 H ASP 186 H ASP 186 -4.547 10.477 -3.871 1119 HA ASP 186 HA ASP 186 -4.570 12.287 -1.699 1120 HB2 ASP 186 HB2 ASP 186 -3.814 12.447 -4.307 1121 HB3 ASP 186 HB3 ASP 186 -5.278 13.426 -4.310 1122 HA PRO 187 HA PRO 187 -9.052 13.477 -2.789 1123 HB2 PRO 187 HB2 PRO 187 -10.040 12.252 -5.047 1124 HB3 PRO 187 HB3 PRO 187 -9.410 13.889 -4.934 1125 HG2 PRO 187 HG2 PRO 187 -8.314 11.810 -6.438 1126 HG3 PRO 187 HG3 PRO 187 -7.496 13.320 -5.997 1127 HD2 PRO 187 HD2 PRO 187 -7.322 10.626 -4.732 1128 HD3 PRO 187 HD3 PRO 187 -6.057 11.854 -4.963 1129 H GLU 188 H GLU 188 -11.094 12.291 -3.784 1130 HA GLU 188 HA GLU 188 -11.666 10.090 -1.998 1131 HB2 GLU 188 HB2 GLU 188 -14.070 10.610 -3.002 1132 HB3 GLU 188 HB3 GLU 188 -13.445 11.510 -1.631 1133 HG2 GLU 188 HG2 GLU 188 -14.327 13.153 -3.000 1134 HG3 GLU 188 HG3 GLU 188 -12.610 13.201 -3.372 1135 H ALA 189 H ALA 189 -9.931 9.484 -4.019 1136 HA ALA 189 HA ALA 189 -11.224 8.626 -6.409 1137 HB1 ALA 189 HB1 ALA 189 -8.537 8.712 -5.358 1138 HB2 ALA 189 HB2 ALA 189 -9.090 8.524 -7.033 1139 HB3 ALA 189 HB3 ALA 189 -8.884 7.100 -6.015 1140 H ALA 190 H ALA 190 -12.342 7.761 -3.774 1141 HA ALA 190 HA ALA 190 -11.958 5.219 -2.984 1142 HB1 ALA 190 HB1 ALA 190 -14.078 7.113 -2.780 1143 HB2 ALA 190 HB2 ALA 190 -13.632 5.818 -1.669 1144 HB3 ALA 190 HB3 ALA 190 -14.761 5.500 -2.985 1145 H PHE 191 H PHE 191 -11.718 3.426 -4.059 1146 HA PHE 191 HA PHE 191 -13.183 2.856 -6.499 1147 HB2 PHE 191 HB2 PHE 191 -10.651 2.207 -5.524 1148 HB3 PHE 191 HB3 PHE 191 -11.539 0.689 -5.472 1149 HD1 PHE 191 HD1 PHE 191 -10.524 3.464 -7.700 1150 HD2 PHE 191 HD2 PHE 191 -11.940 -0.539 -7.422 1151 HE1 PHE 191 HE1 PHE 191 -10.127 3.160 -10.109 1152 HE2 PHE 191 HE2 PHE 191 -11.543 -0.851 -9.830 1153 HZ PHE 191 HZ PHE 191 -10.636 1.000 -11.177 1154 H SER 192 H SER 192 -14.942 1.612 -6.632 1155 HA SER 192 HA SER 192 -16.675 0.252 -6.075 1156 HB2 SER 192 HB2 SER 192 -14.396 -1.067 -4.624 1157 HB3 SER 192 HB3 SER 192 -16.036 -1.701 -4.492 1158 HG SER 192 HG SER 192 -15.339 -1.168 -7.068 Start of MODEL 12 1 H1 ALA 1 H1 ALA 1 13.168 36.714 5.559 2 H2 ALA 1 H2 ALA 1 14.087 37.507 4.346 3 H3 ALA 1 H3 ALA 1 14.866 36.492 5.490 4 HA ALA 1 HA ALA 1 13.885 34.593 4.628 5 HB1 ALA 1 HB1 ALA 1 12.327 34.745 2.684 6 HB2 ALA 1 HB2 ALA 1 12.259 36.489 2.943 7 HB3 ALA 1 HB3 ALA 1 11.677 35.389 4.193 8 H VAL 2 H VAL 2 15.870 34.143 4.004 9 HA VAL 2 HA VAL 2 16.767 35.253 1.422 10 HB VAL 2 HB VAL 2 18.331 35.649 3.222 11 HG11 VAL 2 HG11 VAL 2 18.325 34.017 4.766 12 HG12 VAL 2 HG12 VAL 2 19.682 33.426 3.807 13 HG13 VAL 2 HG13 VAL 2 18.075 32.735 3.582 14 HG21 VAL 2 HG21 VAL 2 19.618 35.718 1.393 15 HG22 VAL 2 HG22 VAL 2 19.007 34.182 0.776 16 HG23 VAL 2 HG23 VAL 2 20.273 34.198 2.004 17 H LEU 3 H LEU 3 15.825 33.978 -0.071 18 HA LEU 3 HA LEU 3 16.099 31.063 0.077 19 HB2 LEU 3 HB2 LEU 3 14.321 32.791 -1.333 20 HB3 LEU 3 HB3 LEU 3 15.103 31.752 -2.531 21 HG LEU 3 HG LEU 3 13.049 30.729 -1.777 22 HD11 LEU 3 HD11 LEU 3 14.909 29.225 -2.249 23 HD12 LEU 3 HD12 LEU 3 13.887 28.580 -0.965 24 HD13 LEU 3 HD13 LEU 3 15.432 29.330 -0.567 25 HD21 LEU 3 HD21 LEU 3 13.180 31.956 0.492 26 HD22 LEU 3 HD22 LEU 3 14.089 30.541 1.022 27 HD23 LEU 3 HD23 LEU 3 12.438 30.357 0.431 28 H ASP 4 H ASP 4 18.303 30.751 -0.030 29 HA ASP 4 HA ASP 4 19.762 31.683 -2.335 30 HB2 ASP 4 HB2 ASP 4 20.406 30.233 0.150 31 HB3 ASP 4 HB3 ASP 4 21.285 29.653 -1.261 32 H LEU 5 H LEU 5 19.039 30.827 -4.213 33 HA LEU 5 HA LEU 5 19.316 28.078 -4.643 34 HB2 LEU 5 HB2 LEU 5 17.080 28.199 -3.670 35 HB3 LEU 5 HB3 LEU 5 16.626 29.322 -4.917 36 HG LEU 5 HG LEU 5 15.726 27.088 -5.358 37 HD11 LEU 5 HD11 LEU 5 16.237 28.373 -7.317 38 HD12 LEU 5 HD12 LEU 5 16.600 26.672 -7.613 39 HD13 LEU 5 HD13 LEU 5 17.909 27.811 -7.293 40 HD21 LEU 5 HD21 LEU 5 16.859 25.294 -4.729 41 HD22 LEU 5 HD22 LEU 5 18.341 26.231 -4.534 42 HD23 LEU 5 HD23 LEU 5 17.931 25.546 -6.108 43 H ASP 6 H ASP 6 17.311 29.802 -6.472 44 HA ASP 6 HA ASP 6 18.690 31.489 -8.021 45 HB2 ASP 6 HB2 ASP 6 20.012 29.254 -8.408 46 HB3 ASP 6 HB3 ASP 6 18.717 28.912 -9.555 47 H VAL 7 H VAL 7 15.916 31.105 -6.988 48 HA VAL 7 HA VAL 7 14.511 31.290 -9.391 49 HB VAL 7 HB VAL 7 14.327 28.842 -8.735 50 HG11 VAL 7 HG11 VAL 7 14.647 29.248 -6.265 51 HG12 VAL 7 HG12 VAL 7 13.337 28.148 -6.691 52 HG13 VAL 7 HG13 VAL 7 12.975 29.808 -6.220 53 HG21 VAL 7 HG21 VAL 7 12.475 30.213 -9.778 54 HG22 VAL 7 HG22 VAL 7 11.758 30.292 -8.169 55 HG23 VAL 7 HG23 VAL 7 11.986 28.731 -8.957 56 H ARG 8 H ARG 8 12.158 31.711 -8.008 57 HA ARG 8 HA ARG 8 12.834 34.012 -6.509 58 HB2 ARG 8 HB2 ARG 8 9.984 33.339 -6.444 59 HB3 ARG 8 HB3 ARG 8 10.761 34.823 -6.966 60 HG2 ARG 8 HG2 ARG 8 10.493 34.321 -9.116 61 HG3 ARG 8 HG3 ARG 8 11.082 32.672 -8.894 62 HD2 ARG 8 HD2 ARG 8 8.814 32.176 -7.850 63 HD3 ARG 8 HD3 ARG 8 8.294 33.730 -8.500 64 HE ARG 8 HE ARG 8 9.456 31.794 -10.352 65 HH11 ARG 8 HH11 ARG 8 6.606 33.411 -9.131 66 HH12 ARG 8 HH12 ARG 8 5.626 32.970 -10.490 67 HH21 ARG 8 HH21 ARG 8 8.164 31.218 -12.131 68 HH22 ARG 8 HH22 ARG 8 6.509 31.727 -12.190 69 H THR 9 H THR 9 12.724 34.157 -4.361 70 HA THR 9 HA THR 9 13.272 31.992 -2.867 71 HB THR 9 HB THR 9 12.694 33.313 -0.888 72 HG1 THR 9 HG1 THR 9 11.639 35.344 -1.237 73 HG21 THR 9 HG21 THR 9 14.371 34.740 -1.172 74 HG22 THR 9 HG22 THR 9 13.546 35.574 -2.489 75 HG23 THR 9 HG23 THR 9 14.483 34.117 -2.819 76 H CYS 10 H CYS 10 12.267 30.263 -2.952 77 HA CYS 10 HA CYS 10 9.891 29.297 -3.346 78 HB2 CYS 10 HB2 CYS 10 12.119 28.383 -1.924 79 HB3 CYS 10 HB3 CYS 10 10.713 27.981 -0.943 80 H LEU 11 H LEU 11 7.910 29.888 -2.830 81 HA LEU 11 HA LEU 11 6.801 31.403 -0.924 82 HB2 LEU 11 HB2 LEU 11 5.899 29.211 -2.583 83 HB3 LEU 11 HB3 LEU 11 5.001 29.275 -1.079 84 HG LEU 11 HG LEU 11 5.319 31.824 -2.570 85 HD11 LEU 11 HD11 LEU 11 3.700 31.359 -4.190 86 HD12 LEU 11 HD12 LEU 11 3.217 29.855 -3.407 87 HD13 LEU 11 HD13 LEU 11 4.772 29.959 -4.234 88 HD21 LEU 11 HD21 LEU 11 3.879 32.367 -0.962 89 HD22 LEU 11 HD22 LEU 11 3.652 30.678 -0.507 90 HD23 LEU 11 HD23 LEU 11 2.682 31.380 -1.801 91 HA PRO 12 HA PRO 12 7.392 29.189 2.945 92 HB2 PRO 12 HB2 PRO 12 6.509 31.054 4.622 93 HB3 PRO 12 HB3 PRO 12 7.992 31.299 3.690 94 HG2 PRO 12 HG2 PRO 12 5.267 32.424 3.249 95 HG3 PRO 12 HG3 PRO 12 6.848 33.183 3.008 96 HD2 PRO 12 HD2 PRO 12 5.251 32.020 1.015 97 HD3 PRO 12 HD3 PRO 12 6.965 32.449 0.863 98 H CYS 13 H CYS 13 6.175 27.736 4.102 99 HA CYS 13 HA CYS 13 3.299 28.276 4.366 100 HB2 CYS 13 HB2 CYS 13 2.590 26.829 2.833 101 HB3 CYS 13 HB3 CYS 13 4.246 26.668 2.300 102 H GLY 14 H GLY 14 2.503 25.709 5.401 103 HA2 GLY 14 HA2 GLY 14 2.694 24.362 7.296 104 HA3 GLY 14 HA3 GLY 14 4.256 25.099 7.631 105 HA PRO 15 HA PRO 15 1.305 26.854 10.848 106 HB2 PRO 15 HB2 PRO 15 3.129 27.044 12.798 107 HB3 PRO 15 HB3 PRO 15 2.515 25.424 12.370 108 HG2 PRO 15 HG2 PRO 15 4.719 26.906 11.048 109 HG3 PRO 15 HG3 PRO 15 4.992 25.457 12.109 110 HD2 PRO 15 HD2 PRO 15 4.753 24.935 9.588 111 HD3 PRO 15 HD3 PRO 15 3.481 24.172 10.591 112 H GLY 16 H GLY 16 1.141 28.901 10.119 113 HA2 GLY 16 HA2 GLY 16 1.400 31.015 9.760 114 HA3 GLY 16 HA3 GLY 16 2.941 30.805 10.573 115 H GLY 17 H GLY 17 3.623 28.671 8.250 116 HA2 GLY 17 HA2 GLY 17 4.370 28.815 6.199 117 HA3 GLY 17 HA3 GLY 17 3.577 30.350 6.157 118 H LYS 18 H LYS 18 5.882 28.983 8.214 119 HA LYS 18 HA LYS 18 7.819 31.150 8.021 120 HB2 LYS 18 HB2 LYS 18 8.519 29.043 9.879 121 HB3 LYS 18 HB3 LYS 18 8.308 30.760 10.173 122 HG2 LYS 18 HG2 LYS 18 6.455 30.314 11.291 123 HG3 LYS 18 HG3 LYS 18 5.739 29.629 9.848 124 HD2 LYS 18 HD2 LYS 18 5.653 27.995 11.602 125 HD3 LYS 18 HD3 LYS 18 6.807 27.474 10.377 126 HE2 LYS 18 HE2 LYS 18 8.651 28.211 11.774 127 HE3 LYS 18 HE3 LYS 18 7.519 28.844 12.969 128 HZ1 LYS 18 HZ1 LYS 18 8.302 26.720 13.693 129 HZ2 LYS 18 HZ2 LYS 18 7.899 25.997 12.219 130 HZ3 LYS 18 HZ3 LYS 18 6.679 26.552 13.249 131 H GLY 19 H GLY 19 7.480 27.840 6.560 132 HA2 GLY 19 HA2 GLY 19 10.338 27.763 6.225 133 HA3 GLY 19 HA3 GLY 19 9.263 26.358 6.339 134 H ARG 20 H ARG 20 10.116 26.001 3.823 135 HA ARG 20 HA ARG 20 8.489 27.787 2.159 136 HB2 ARG 20 HB2 ARG 20 11.073 26.360 1.624 137 HB3 ARG 20 HB3 ARG 20 10.118 27.102 0.353 138 HG2 ARG 20 HG2 ARG 20 11.558 28.805 0.776 139 HG3 ARG 20 HG3 ARG 20 10.302 29.203 1.952 140 HD2 ARG 20 HD2 ARG 20 11.568 28.018 3.686 141 HD3 ARG 20 HD3 ARG 20 12.824 27.642 2.507 142 HE ARG 20 HE ARG 20 13.654 29.743 2.799 143 HH11 ARG 20 HH11 ARG 20 10.348 29.723 3.936 144 HH12 ARG 20 HH12 ARG 20 10.423 31.339 4.555 145 HH21 ARG 20 HH21 ARG 20 13.747 31.864 3.612 146 HH22 ARG 20 HH22 ARG 20 12.351 32.554 4.371 147 H CYS 21 H CYS 21 7.993 26.644 -0.053 148 HA CYS 21 HA CYS 21 6.854 23.993 0.564 149 HB2 CYS 21 HB2 CYS 21 5.923 26.303 -1.029 150 HB3 CYS 21 HB3 CYS 21 5.652 24.732 -1.778 151 H PHE 22 H PHE 22 6.978 22.308 -0.982 152 HA PHE 22 HA PHE 22 9.070 22.659 -3.033 153 HB2 PHE 22 HB2 PHE 22 8.655 20.410 -1.075 154 HB3 PHE 22 HB3 PHE 22 9.534 20.159 -2.580 155 HD1 PHE 22 HD1 PHE 22 9.549 21.877 0.661 156 HD2 PHE 22 HD2 PHE 22 11.731 21.052 -2.898 157 HE1 PHE 22 HE1 PHE 22 11.599 22.725 1.726 158 HE2 PHE 22 HE2 PHE 22 13.785 21.899 -1.840 159 HZ PHE 22 HZ PHE 22 13.720 22.736 0.475 160 H GLY 23 H GLY 23 6.273 20.718 -2.027 161 HA2 GLY 23 HA2 GLY 23 5.497 20.497 -4.859 162 HA3 GLY 23 HA3 GLY 23 5.556 19.047 -3.864 163 HA PRO 24 HA PRO 24 1.323 20.856 -3.378 164 HB2 PRO 24 HB2 PRO 24 0.211 18.236 -3.857 165 HB3 PRO 24 HB3 PRO 24 0.049 19.689 -4.843 166 HG2 PRO 24 HG2 PRO 24 1.433 17.446 -5.617 167 HG3 PRO 24 HG3 PRO 24 1.739 19.074 -6.245 168 HD2 PRO 24 HD2 PRO 24 3.226 17.537 -4.152 169 HD3 PRO 24 HD3 PRO 24 3.852 18.610 -5.425 170 H SER 25 H SER 25 1.773 17.408 -2.542 171 HA SER 25 HA SER 25 0.687 17.937 0.117 172 HB2 SER 25 HB2 SER 25 1.031 15.515 -1.577 173 HB3 SER 25 HB3 SER 25 1.179 15.262 0.171 174 HG SER 25 HG SER 25 -0.890 15.709 0.411 175 H ILE 26 H ILE 26 3.320 18.977 -0.579 176 HA ILE 26 HA ILE 26 4.788 17.763 1.584 177 HB ILE 26 HB ILE 26 6.131 18.074 -1.065 178 HG12 ILE 26 HG12 ILE 26 5.155 15.526 0.174 179 HG13 ILE 26 HG13 ILE 26 4.352 16.349 -1.158 180 HG21 ILE 26 HG21 ILE 26 7.969 17.785 0.070 181 HG22 ILE 26 HG22 ILE 26 7.360 16.232 0.643 182 HG23 ILE 26 HG23 ILE 26 7.020 17.704 1.551 183 HD11 ILE 26 HD11 ILE 26 5.571 14.831 -2.333 184 HD12 ILE 26 HD12 ILE 26 6.880 14.797 -1.150 185 HD13 ILE 26 HD13 ILE 26 6.738 16.151 -2.271 186 H CYS 27 H CYS 27 5.534 19.284 2.841 187 HA CYS 27 HA CYS 27 6.594 21.786 1.721 188 HB2 CYS 27 HB2 CYS 27 4.137 22.002 2.519 189 HB3 CYS 27 HB3 CYS 27 4.793 21.833 4.141 190 H CYS 28 H CYS 28 8.570 22.152 2.596 191 HA CYS 28 HA CYS 28 9.065 21.093 5.288 192 HB2 CYS 28 HB2 CYS 28 11.399 20.863 3.504 193 HB3 CYS 28 HB3 CYS 28 10.802 19.731 4.702 194 H GLY 29 H GLY 29 9.998 22.745 6.668 195 HA2 GLY 29 HA2 GLY 29 11.492 24.854 5.325 196 HA3 GLY 29 HA3 GLY 29 10.755 24.941 6.923 197 H ASP 30 H ASP 30 13.008 25.703 7.301 198 HA ASP 30 HA ASP 30 15.193 24.009 7.273 199 HB2 ASP 30 HB2 ASP 30 15.146 26.549 7.427 200 HB3 ASP 30 HB3 ASP 30 14.872 26.313 9.149 201 H GLU 31 H GLU 31 13.219 24.985 9.949 202 HA GLU 31 HA GLU 31 14.325 22.723 11.467 203 HB2 GLU 31 HB2 GLU 31 13.155 24.597 13.257 204 HB3 GLU 31 HB3 GLU 31 14.823 24.065 13.178 205 HG2 GLU 31 HG2 GLU 31 14.845 25.878 11.213 206 HG3 GLU 31 HG3 GLU 31 13.542 26.539 12.196 207 H LEU 32 H LEU 32 11.762 23.647 9.876 208 HA LEU 32 HA LEU 32 9.735 22.732 11.679 209 HB2 LEU 32 HB2 LEU 32 10.018 24.604 9.616 210 HB3 LEU 32 HB3 LEU 32 8.965 23.367 9.002 211 HG LEU 32 HG LEU 32 8.492 24.813 11.597 212 HD11 LEU 32 HD11 LEU 32 8.557 26.303 9.574 213 HD12 LEU 32 HD12 LEU 32 7.040 26.305 10.476 214 HD13 LEU 32 HD13 LEU 32 7.167 25.404 8.965 215 HD21 LEU 32 HD21 LEU 32 6.917 22.880 9.946 216 HD22 LEU 32 HD22 LEU 32 6.091 24.054 10.970 217 HD23 LEU 32 HD23 LEU 32 7.208 22.892 11.685 218 H GLY 33 H GLY 33 11.744 21.814 9.100 219 HA2 GLY 33 HA2 GLY 33 12.153 19.748 8.254 220 HA3 GLY 33 HA3 GLY 33 10.911 19.187 9.320 221 H CYS 34 H CYS 34 9.581 17.910 7.914 222 HA CYS 34 HA CYS 34 8.346 19.442 5.709 223 HB2 CYS 34 HB2 CYS 34 10.284 17.827 5.000 224 HB3 CYS 34 HB3 CYS 34 9.039 16.618 5.198 225 H PHE 35 H PHE 35 6.125 19.387 5.811 226 HA PHE 35 HA PHE 35 4.998 17.036 7.093 227 HB2 PHE 35 HB2 PHE 35 3.574 19.497 6.023 228 HB3 PHE 35 HB3 PHE 35 2.943 18.309 7.156 229 HD1 PHE 35 HD1 PHE 35 5.790 20.720 6.899 230 HD2 PHE 35 HD2 PHE 35 2.798 18.935 9.344 231 HE1 PHE 35 HE1 PHE 35 6.465 22.164 8.773 232 HE2 PHE 35 HE2 PHE 35 3.469 20.374 11.222 233 HZ PHE 35 HZ PHE 35 5.302 21.992 10.939 234 H VAL 36 H VAL 36 5.080 15.476 5.546 235 HA VAL 36 HA VAL 36 4.471 16.291 2.827 236 HB VAL 36 HB VAL 36 5.217 13.463 3.502 237 HG11 VAL 36 HG11 VAL 36 6.290 13.641 1.262 238 HG12 VAL 36 HG12 VAL 36 5.662 15.299 1.115 239 HG13 VAL 36 HG13 VAL 36 4.548 13.915 1.233 240 HG21 VAL 36 HG21 VAL 36 6.881 14.791 4.672 241 HG22 VAL 36 HG22 VAL 36 7.166 15.769 3.231 242 HG23 VAL 36 HG23 VAL 36 7.615 14.062 3.242 243 H GLY 37 H GLY 37 2.471 16.788 3.130 244 HA2 GLY 37 HA2 GLY 37 0.257 16.136 2.479 245 HA3 GLY 37 HA3 GLY 37 0.604 14.499 3.004 246 H THR 38 H THR 38 -0.085 17.756 4.135 247 HA THR 38 HA THR 38 -1.806 16.775 6.222 248 HB THR 38 HB THR 38 -0.606 17.984 8.049 249 HG1 THR 38 HG1 THR 38 0.781 19.000 6.132 250 HG21 THR 38 HG21 THR 38 0.155 15.489 6.925 251 HG22 THR 38 HG22 THR 38 0.231 16.022 8.604 252 HG23 THR 38 HG23 THR 38 1.597 16.307 7.525 253 H ALA 39 H ALA 39 -2.603 19.001 7.572 254 HA ALA 39 HA ALA 39 -3.685 20.635 5.627 255 HB1 ALA 39 HB1 ALA 39 -3.360 21.311 8.539 256 HB2 ALA 39 HB2 ALA 39 -4.522 20.115 7.964 257 HB3 ALA 39 HB3 ALA 39 -4.653 21.796 7.443 258 H GLU 40 H GLU 40 -0.647 20.822 7.327 259 HA GLU 40 HA GLU 40 -0.212 23.618 7.090 260 HB2 GLU 40 HB2 GLU 40 1.376 21.243 7.783 261 HB3 GLU 40 HB3 GLU 40 2.299 22.523 7.010 262 HG2 GLU 40 HG2 GLU 40 2.515 23.062 9.227 263 HG3 GLU 40 HG3 GLU 40 1.140 24.058 8.751 264 H ALA 41 H ALA 41 -0.031 20.986 4.892 265 HA ALA 41 HA ALA 41 1.542 22.406 2.926 266 HB1 ALA 41 HB1 ALA 41 2.045 20.264 2.494 267 HB2 ALA 41 HB2 ALA 41 0.508 20.226 1.628 268 HB3 ALA 41 HB3 ALA 41 0.593 19.666 3.298 269 H LEU 42 H LEU 42 -1.684 22.318 3.898 270 HA LEU 42 HA LEU 42 -3.076 22.403 1.525 271 HB2 LEU 42 HB2 LEU 42 -3.588 23.407 4.239 272 HB3 LEU 42 HB3 LEU 42 -4.538 24.165 2.974 273 HG LEU 42 HG LEU 42 -4.419 21.191 3.017 274 HD11 LEU 42 HD11 LEU 42 -5.692 20.862 4.847 275 HD12 LEU 42 HD12 LEU 42 -6.532 22.403 4.677 276 HD13 LEU 42 HD13 LEU 42 -4.917 22.352 5.384 277 HD21 LEU 42 HD21 LEU 42 -5.669 22.008 1.243 278 HD22 LEU 42 HD22 LEU 42 -6.357 23.320 2.200 279 HD23 LEU 42 HD23 LEU 42 -6.896 21.661 2.461 280 H ARG 43 H ARG 43 -1.393 25.110 3.042 281 HA ARG 43 HA ARG 43 -2.222 27.007 1.048 282 HB2 ARG 43 HB2 ARG 43 -0.239 28.325 1.950 283 HB3 ARG 43 HB3 ARG 43 -1.475 27.907 3.129 284 HG2 ARG 43 HG2 ARG 43 0.083 25.821 3.524 285 HG3 ARG 43 HG3 ARG 43 1.308 26.900 2.856 286 HD2 ARG 43 HD2 ARG 43 -0.513 27.774 5.076 287 HD3 ARG 43 HD3 ARG 43 0.969 26.875 5.403 288 HE ARG 43 HE ARG 43 2.167 28.720 4.286 289 HH11 ARG 43 HH11 ARG 43 -1.043 29.318 5.533 290 HH12 ARG 43 HH12 ARG 43 -0.795 31.026 5.690 291 HH21 ARG 43 HH21 ARG 43 2.488 30.960 4.494 292 HH22 ARG 43 HH22 ARG 43 1.206 31.957 5.100 293 H CYS 44 H CYS 44 -0.123 24.526 1.266 294 HA CYS 44 HA CYS 44 2.033 25.298 -0.474 295 HB2 CYS 44 HB2 CYS 44 1.588 22.938 0.838 296 HB3 CYS 44 HB3 CYS 44 1.452 22.458 -0.849 297 H GLN 45 H GLN 45 -1.161 24.547 -1.184 298 HA GLN 45 HA GLN 45 -1.231 23.744 -3.811 299 HB2 GLN 45 HB2 GLN 45 -3.040 25.141 -2.052 300 HB3 GLN 45 HB3 GLN 45 -3.183 25.773 -3.686 301 HG2 GLN 45 HG2 GLN 45 -4.330 24.002 -4.341 302 HG3 GLN 45 HG3 GLN 45 -3.095 22.902 -3.727 303 HE21 GLN 45 HE21 GLN 45 -3.489 21.776 -1.924 304 HE22 GLN 45 HE22 GLN 45 -4.905 21.941 -0.945 305 H GLU 46 H GLU 46 -0.194 26.847 -2.609 306 HA GLU 46 HA GLU 46 -0.300 28.126 -5.208 307 HB2 GLU 46 HB2 GLU 46 0.823 28.983 -2.539 308 HB3 GLU 46 HB3 GLU 46 0.978 29.959 -3.992 309 HG2 GLU 46 HG2 GLU 46 -1.273 30.443 -4.070 310 HG3 GLU 46 HG3 GLU 46 -1.716 29.034 -3.107 311 H GLU 47 H GLU 47 1.504 25.724 -4.203 312 HA GLU 47 HA GLU 47 4.141 26.656 -4.907 313 HB2 GLU 47 HB2 GLU 47 3.467 24.707 -3.295 314 HB3 GLU 47 HB3 GLU 47 3.341 23.765 -4.773 315 HG2 GLU 47 HG2 GLU 47 5.824 25.305 -4.469 316 HG3 GLU 47 HG3 GLU 47 5.585 24.003 -3.304 317 H ASN 48 H ASN 48 1.410 26.172 -6.638 318 HA ASN 48 HA ASN 48 2.357 24.625 -8.838 319 HB2 ASN 48 HB2 ASN 48 0.057 26.526 -8.434 320 HB3 ASN 48 HB3 ASN 48 0.410 25.864 -10.027 321 HD21 ASN 48 HD21 ASN 48 -1.722 25.517 -7.807 322 HD22 ASN 48 HD22 ASN 48 -1.936 23.804 -7.749 323 H TYR 49 H TYR 49 2.596 28.008 -7.919 324 HA TYR 49 HA TYR 49 3.322 28.954 -10.520 325 HB2 TYR 49 HB2 TYR 49 3.105 30.073 -7.817 326 HB3 TYR 49 HB3 TYR 49 4.370 30.807 -8.796 327 HD1 TYR 49 HD1 TYR 49 3.753 31.831 -11.013 328 HD2 TYR 49 HD2 TYR 49 0.824 30.572 -8.196 329 HE1 TYR 49 HE1 TYR 49 2.072 33.223 -12.147 330 HE2 TYR 49 HE2 TYR 49 -0.865 31.959 -9.321 331 HH TYR 49 HH TYR 49 -0.731 33.017 -12.239 332 H LEU 50 H LEU 50 4.972 26.836 -8.696 333 HA LEU 50 HA LEU 50 7.429 27.406 -10.060 334 HB2 LEU 50 HB2 LEU 50 8.886 27.657 -8.194 335 HB3 LEU 50 HB3 LEU 50 7.622 28.856 -8.063 336 HG LEU 50 HG LEU 50 7.842 28.190 -5.884 337 HD11 LEU 50 HD11 LEU 50 5.909 26.032 -6.616 338 HD12 LEU 50 HD12 LEU 50 5.492 27.734 -6.823 339 HD13 LEU 50 HD13 LEU 50 5.907 27.116 -5.224 340 HD21 LEU 50 HD21 LEU 50 9.466 26.550 -5.936 341 HD22 LEU 50 HD22 LEU 50 8.519 25.497 -6.987 342 HD23 LEU 50 HD23 LEU 50 8.066 25.691 -5.293 343 HA PRO 51 HA PRO 51 7.130 22.958 -9.493 344 HB2 PRO 51 HB2 PRO 51 7.845 22.264 -11.961 345 HB3 PRO 51 HB3 PRO 51 6.291 23.045 -11.652 346 HG2 PRO 51 HG2 PRO 51 8.733 24.145 -12.907 347 HG3 PRO 51 HG3 PRO 51 7.042 24.624 -13.124 348 HD2 PRO 51 HD2 PRO 51 9.034 25.827 -11.425 349 HD3 PRO 51 HD3 PRO 51 7.347 26.329 -11.662 350 H SER 52 H SER 52 9.751 24.716 -9.111 351 HA SER 52 HA SER 52 11.578 22.415 -9.357 352 HB2 SER 52 HB2 SER 52 11.946 24.395 -10.987 353 HB3 SER 52 HB3 SER 52 12.552 25.253 -9.571 354 HG SER 52 HG SER 52 13.906 23.234 -9.331 355 HA PRO 53 HA PRO 53 12.391 22.943 -5.031 356 HB2 PRO 53 HB2 PRO 53 14.970 22.102 -4.840 357 HB3 PRO 53 HB3 PRO 53 13.613 20.996 -5.078 358 HG2 PRO 53 HG2 PRO 53 15.536 22.095 -7.091 359 HG3 PRO 53 HG3 PRO 53 14.916 20.442 -6.921 360 HD2 PRO 53 HD2 PRO 53 13.937 22.172 -8.753 361 HD3 PRO 53 HD3 PRO 53 12.921 20.947 -7.966 362 H CYS 54 H CYS 54 13.567 24.246 -3.502 363 HA CYS 54 HA CYS 54 15.271 26.314 -4.715 364 HB2 CYS 54 HB2 CYS 54 13.414 27.134 -2.526 365 HB3 CYS 54 HB3 CYS 54 14.100 28.092 -3.831 366 H GLN 55 H GLN 55 15.828 27.839 -2.505 367 HA GLN 55 HA GLN 55 17.330 27.951 -0.788 368 HB2 GLN 55 HB2 GLN 55 15.227 26.780 0.227 369 HB3 GLN 55 HB3 GLN 55 16.275 25.369 0.293 370 HG2 GLN 55 HG2 GLN 55 17.028 26.116 2.233 371 HG3 GLN 55 HG3 GLN 55 17.796 27.439 1.358 372 HE21 GLN 55 HE21 GLN 55 17.011 29.466 1.557 373 HE22 GLN 55 HE22 GLN 55 15.678 29.897 2.569 374 H SER 56 H SER 56 19.092 26.714 0.473 375 HA SER 56 HA SER 56 20.154 24.391 -0.889 376 HB2 SER 56 HB2 SER 56 22.347 25.535 -1.376 377 HB3 SER 56 HB3 SER 56 20.996 26.097 -2.360 378 HG SER 56 HG SER 56 22.579 27.526 -0.789 379 H GLY 57 H GLY 57 22.691 24.573 -0.052 380 HA2 GLY 57 HA2 GLY 57 23.983 24.985 2.074 381 HA3 GLY 57 HA3 GLY 57 22.518 24.542 2.929 382 H GLN 58 H GLN 58 21.917 22.310 3.059 383 HA GLN 58 HA GLN 58 24.024 20.416 2.306 384 HB2 GLN 58 HB2 GLN 58 22.425 20.579 4.887 385 HB3 GLN 58 HB3 GLN 58 23.263 19.120 4.380 386 HG2 GLN 58 HG2 GLN 58 25.368 20.088 4.668 387 HG3 GLN 58 HG3 GLN 58 24.712 21.724 4.692 388 HE21 GLN 58 HE21 GLN 58 24.142 22.607 6.592 389 HE22 GLN 58 HE22 GLN 58 24.196 21.792 8.113 390 H LYS 59 H LYS 59 22.975 19.551 0.556 391 HA LYS 59 HA LYS 59 20.130 18.937 1.013 392 HB2 LYS 59 HB2 LYS 59 21.460 19.940 -1.514 393 HB3 LYS 59 HB3 LYS 59 19.772 19.478 -1.389 394 HG2 LYS 59 HG2 LYS 59 20.962 21.647 0.309 395 HG3 LYS 59 HG3 LYS 59 20.311 21.954 -1.302 396 HD2 LYS 59 HD2 LYS 59 18.453 20.384 0.216 397 HD3 LYS 59 HD3 LYS 59 18.907 21.822 1.132 398 HE2 LYS 59 HE2 LYS 59 18.100 23.269 -0.499 399 HE3 LYS 59 HE3 LYS 59 18.152 22.033 -1.756 400 HZ1 LYS 59 HZ1 LYS 59 16.275 20.949 -0.805 401 HZ2 LYS 59 HZ2 LYS 59 15.884 22.588 -0.957 402 HZ3 LYS 59 HZ3 LYS 59 16.294 21.954 0.556 403 HA PRO 60 HA PRO 60 21.222 15.656 -2.133 404 HB2 PRO 60 HB2 PRO 60 23.916 15.273 -2.775 405 HB3 PRO 60 HB3 PRO 60 22.711 16.060 -3.799 406 HG2 PRO 60 HG2 PRO 60 24.735 17.276 -1.976 407 HG3 PRO 60 HG3 PRO 60 24.167 17.837 -3.559 408 HD2 PRO 60 HD2 PRO 60 23.320 18.976 -1.264 409 HD3 PRO 60 HD3 PRO 60 22.257 18.804 -2.673 410 H CYS 61 H CYS 61 20.812 14.143 -1.072 411 HA CYS 61 HA CYS 61 22.685 12.521 0.373 412 HB2 CYS 61 HB2 CYS 61 21.896 12.833 2.456 413 HB3 CYS 61 HB3 CYS 61 21.085 14.257 1.845 414 H GLY 62 H GLY 62 20.478 10.552 1.108 415 HA2 GLY 62 HA2 GLY 62 19.522 8.796 -0.063 416 HA3 GLY 62 HA3 GLY 62 18.609 10.133 -0.728 417 H SER 63 H SER 63 18.361 8.590 -2.514 418 HA SER 63 HA SER 63 20.726 8.107 -4.148 419 HB2 SER 63 HB2 SER 63 18.943 7.012 -5.691 420 HB3 SER 63 HB3 SER 63 19.289 6.242 -4.143 421 HG SER 63 HG SER 63 17.430 7.197 -3.300 422 H GLY 64 H GLY 64 20.151 10.756 -3.772 423 HA2 GLY 64 HA2 GLY 64 20.584 12.369 -5.619 424 HA3 GLY 64 HA3 GLY 64 19.189 11.657 -6.404 425 H GLY 65 H GLY 65 18.769 12.088 -2.958 426 HA2 GLY 65 HA2 GLY 65 16.972 14.359 -3.606 427 HA3 GLY 65 HA3 GLY 65 16.853 13.363 -2.173 428 H ARG 66 H ARG 66 16.929 16.335 -2.543 429 HA ARG 66 HA ARG 66 19.393 17.096 -1.150 430 HB2 ARG 66 HB2 ARG 66 17.788 19.359 -1.205 431 HB3 ARG 66 HB3 ARG 66 19.113 18.993 -2.293 432 HG2 ARG 66 HG2 ARG 66 16.252 18.203 -2.813 433 HG3 ARG 66 HG3 ARG 66 16.974 19.708 -3.382 434 HD2 ARG 66 HD2 ARG 66 17.667 16.891 -4.156 435 HD3 ARG 66 HD3 ARG 66 17.123 18.209 -5.190 436 HE ARG 66 HE ARG 66 19.789 17.601 -4.524 437 HH11 ARG 66 HH11 ARG 66 17.685 20.367 -4.911 438 HH12 ARG 66 HH12 ARG 66 18.972 21.433 -5.368 439 HH21 ARG 66 HH21 ARG 66 21.470 19.002 -5.132 440 HH22 ARG 66 HH22 ARG 66 21.118 20.659 -5.496 441 H CYS 67 H CYS 67 19.304 18.227 1.042 442 HA CYS 67 HA CYS 67 17.439 16.912 2.618 443 HB2 CYS 67 HB2 CYS 67 19.658 17.262 3.442 444 HB3 CYS 67 HB3 CYS 67 19.554 18.991 3.158 445 H ALA 68 H ALA 68 15.318 17.632 2.576 446 HA ALA 68 HA ALA 68 14.716 20.349 1.874 447 HB1 ALA 68 HB1 ALA 68 13.218 18.391 1.404 448 HB2 ALA 68 HB2 ALA 68 12.421 19.776 2.151 449 HB3 ALA 68 HB3 ALA 68 12.826 18.361 3.123 450 H ALA 69 H ALA 69 15.195 18.547 4.731 451 HA ALA 69 HA ALA 69 15.467 20.866 6.423 452 HB1 ALA 69 HB1 ALA 69 13.198 20.836 6.561 453 HB2 ALA 69 HB2 ALA 69 13.684 19.974 8.000 454 HB3 ALA 69 HB3 ALA 69 13.063 19.096 6.596 455 H ALA 70 H ALA 70 15.981 20.182 8.634 456 HA ALA 70 HA ALA 70 17.984 18.248 8.752 457 HB1 ALA 70 HB1 ALA 70 18.335 18.896 10.889 458 HB2 ALA 70 HB2 ALA 70 16.620 18.861 11.301 459 HB3 ALA 70 HB3 ALA 70 17.281 20.225 10.400 460 H GLY 71 H GLY 71 17.951 16.109 8.797 461 HA2 GLY 71 HA2 GLY 71 17.301 13.919 9.021 462 HA3 GLY 71 HA3 GLY 71 16.352 14.464 10.406 463 H ILE 72 H ILE 72 16.055 15.341 7.033 464 HA ILE 72 HA ILE 72 13.931 13.717 6.490 465 HB ILE 72 HB ILE 72 12.063 15.158 6.127 466 HG12 ILE 72 HG12 ILE 72 12.552 17.469 7.593 467 HG13 ILE 72 HG13 ILE 72 13.983 17.262 6.581 468 HG21 ILE 72 HG21 ILE 72 11.375 15.527 8.413 469 HG22 ILE 72 HG22 ILE 72 13.052 15.448 8.955 470 HG23 ILE 72 HG23 ILE 72 12.276 14.017 8.277 471 HD11 ILE 72 HD11 ILE 72 11.656 16.642 5.085 472 HD12 ILE 72 HD12 ILE 72 12.872 17.901 4.790 473 HD13 ILE 72 HD13 ILE 72 11.475 18.246 5.818 474 H CYS 73 H CYS 73 15.070 13.235 4.717 475 HA CYS 73 HA CYS 73 16.068 15.348 2.993 476 HB2 CYS 73 HB2 CYS 73 16.922 12.786 3.663 477 HB3 CYS 73 HB3 CYS 73 16.406 12.662 1.985 478 H CYS 74 H CYS 74 14.603 16.232 1.676 479 HA CYS 74 HA CYS 74 12.605 14.522 0.425 480 HB2 CYS 74 HB2 CYS 74 12.758 17.325 1.155 481 HB3 CYS 74 HB3 CYS 74 12.210 17.115 -0.506 482 H SER 75 H SER 75 12.804 13.750 -1.512 483 HA SER 75 HA SER 75 14.931 14.691 -3.278 484 HB2 SER 75 HB2 SER 75 14.338 12.628 -4.597 485 HB3 SER 75 HB3 SER 75 14.859 12.293 -2.946 486 HG SER 75 HG SER 75 12.937 11.148 -3.622 487 HA PRO 76 HA PRO 76 12.125 16.526 -6.171 488 HB2 PRO 76 HB2 PRO 76 12.563 15.471 -8.609 489 HB3 PRO 76 HB3 PRO 76 13.776 16.465 -7.792 490 HG2 PRO 76 HG2 PRO 76 13.607 13.484 -8.014 491 HG3 PRO 76 HG3 PRO 76 15.023 14.540 -8.174 492 HD2 PRO 76 HD2 PRO 76 14.431 13.148 -5.898 493 HD3 PRO 76 HD3 PRO 76 15.327 14.680 -5.902 494 H ASP 77 H ASP 77 11.213 14.020 -4.815 495 HA ASP 77 HA ASP 77 8.801 13.639 -6.399 496 HB2 ASP 77 HB2 ASP 77 10.777 11.494 -5.766 497 HB3 ASP 77 HB3 ASP 77 9.066 11.088 -5.702 498 H GLY 78 H GLY 78 10.544 12.901 -3.384 499 HA2 GLY 78 HA2 GLY 78 8.219 13.688 -1.843 500 HA3 GLY 78 HA3 GLY 78 8.625 11.986 -1.718 501 H CYS 79 H CYS 79 9.262 11.914 0.393 502 HA CYS 79 HA CYS 79 11.737 13.356 1.054 503 HB2 CYS 79 HB2 CYS 79 9.176 13.761 2.281 504 HB3 CYS 79 HB3 CYS 79 10.281 13.065 3.461 505 H HIS 80 H HIS 80 13.005 12.333 2.791 506 HA HIS 80 HA HIS 80 12.321 9.577 3.451 507 HB2 HIS 80 HB2 HIS 80 13.325 9.229 1.298 508 HB3 HIS 80 HB3 HIS 80 14.638 10.336 1.662 509 HD1 HIS 80 HD1 HIS 80 13.600 7.611 4.051 510 HD2 HIS 80 HD2 HIS 80 16.633 8.456 1.339 511 HE1 HIS 80 HE1 HIS 80 15.361 5.856 4.440 512 HE2 HIS 80 HE2 HIS 80 17.226 6.446 2.853 513 H GLU 81 H GLU 81 13.202 8.993 5.405 514 HA GLU 81 HA GLU 81 14.357 10.974 7.026 515 HB2 GLU 81 HB2 GLU 81 13.843 9.521 8.658 516 HB3 GLU 81 HB3 GLU 81 13.257 8.436 7.416 517 HG2 GLU 81 HG2 GLU 81 15.041 7.036 7.605 518 HG3 GLU 81 HG3 GLU 81 16.143 8.332 8.073 519 H ASP 82 H ASP 82 16.422 11.595 7.385 520 HA ASP 82 HA ASP 82 18.577 9.937 6.311 521 HB2 ASP 82 HB2 ASP 82 19.438 11.620 4.903 522 HB3 ASP 82 HB3 ASP 82 17.692 11.677 4.633 523 HA PRO 83 HA PRO 83 20.401 11.239 10.167 524 HB2 PRO 83 HB2 PRO 83 22.872 9.950 9.445 525 HB3 PRO 83 HB3 PRO 83 21.630 9.398 10.566 526 HG2 PRO 83 HG2 PRO 83 22.199 8.175 8.177 527 HG3 PRO 83 HG3 PRO 83 20.635 8.068 9.002 528 HD2 PRO 83 HD2 PRO 83 21.453 9.802 6.703 529 HD3 PRO 83 HD3 PRO 83 19.923 8.941 6.978 530 H ALA 84 H ALA 84 21.594 12.116 7.080 531 HA ALA 84 HA ALA 84 23.959 13.463 7.807 532 HB1 ALA 84 HB1 ALA 84 23.410 12.883 5.493 533 HB2 ALA 84 HB2 ALA 84 23.769 14.601 5.663 534 HB3 ALA 84 HB3 ALA 84 22.097 14.060 5.510 535 H CYS 85 H CYS 85 20.593 14.536 7.607 536 HA CYS 85 HA CYS 85 21.373 17.154 8.679 537 HB2 CYS 85 HB2 CYS 85 18.941 16.153 7.236 538 HB3 CYS 85 HB3 CYS 85 18.849 17.620 8.214 539 H ASP 86 H ASP 86 21.202 14.580 10.178 540 HA ASP 86 HA ASP 86 19.218 15.269 12.148 541 HB2 ASP 86 HB2 ASP 86 20.133 12.723 11.133 542 HB3 ASP 86 HB3 ASP 86 20.174 12.793 12.892 543 HA PRO 87 HA PRO 87 23.614 14.906 14.410 544 HB2 PRO 87 HB2 PRO 87 24.332 17.277 12.745 545 HB3 PRO 87 HB3 PRO 87 25.325 16.082 13.530 546 HG2 PRO 87 HG2 PRO 87 24.965 15.909 10.945 547 HG3 PRO 87 HG3 PRO 87 24.929 14.442 11.947 548 HD2 PRO 87 HD2 PRO 87 22.675 15.983 10.759 549 HD3 PRO 87 HD3 PRO 87 22.850 14.231 10.987 550 H GLU 88 H GLU 88 22.902 15.688 16.202 551 HA GLU 88 HA GLU 88 21.196 16.751 17.470 552 HB2 GLU 88 HB2 GLU 88 22.575 18.491 18.744 553 HB3 GLU 88 HB3 GLU 88 23.164 16.835 18.718 554 HG2 GLU 88 HG2 GLU 88 24.855 17.355 17.165 555 HG3 GLU 88 HG3 GLU 88 24.128 18.915 16.782 556 H ALA 89 H ALA 89 20.624 17.484 15.095 557 HA ALA 89 HA ALA 89 20.738 20.121 14.435 558 HB1 ALA 89 HB1 ALA 89 20.038 17.973 13.061 559 HB2 ALA 89 HB2 ALA 89 19.543 19.598 12.558 560 HB3 ALA 89 HB3 ALA 89 18.415 18.575 13.442 561 H ALA 90 H ALA 90 19.154 19.072 16.982 562 HA ALA 90 HA ALA 90 16.697 20.520 16.772 563 HB1 ALA 90 HB1 ALA 90 18.269 19.844 19.252 564 HB2 ALA 90 HB2 ALA 90 16.963 18.905 18.530 565 HB3 ALA 90 HB3 ALA 90 16.624 20.482 19.246 566 H PHE 91 H PHE 91 16.114 22.616 17.197 567 HA PHE 91 HA PHE 91 18.316 24.518 17.613 568 HB2 PHE 91 HB2 PHE 91 15.915 24.583 15.956 569 HB3 PHE 91 HB3 PHE 91 16.069 26.019 16.966 570 HD1 PHE 91 HD1 PHE 91 18.001 27.504 16.729 571 HD2 PHE 91 HD2 PHE 91 17.448 24.145 14.175 572 HE1 PHE 91 HE1 PHE 91 19.666 28.423 15.166 573 HE2 PHE 91 HE2 PHE 91 19.114 25.055 12.611 574 HZ PHE 91 HZ PHE 91 20.225 27.197 13.105 575 H SER 92 H SER 92 18.122 23.641 19.877 576 HA SER 92 HA SER 92 16.466 25.458 21.439 577 HB2 SER 92 HB2 SER 92 15.743 22.734 21.039 578 HB3 SER 92 HB3 SER 92 16.292 22.898 22.706 579 HG SER 92 HG SER 92 14.642 24.172 23.144 580 H1 ALA 101 H1 ALA 101 -6.519 2.963 17.463 581 H2 ALA 101 H2 ALA 101 -6.081 2.291 15.945 582 H3 ALA 101 H3 ALA 101 -6.162 1.291 17.338 583 HA ALA 101 HA ALA 101 -8.377 1.226 17.366 584 HB1 ALA 101 HB1 ALA 101 -8.647 3.617 15.573 585 HB2 ALA 101 HB2 ALA 101 -8.445 3.790 17.317 586 HB3 ALA 101 HB3 ALA 101 -9.833 2.914 16.673 587 H VAL 102 H VAL 102 -8.527 -0.611 16.241 588 HA VAL 102 HA VAL 102 -8.839 -2.062 14.518 589 HB VAL 102 HB VAL 102 -9.742 0.302 12.882 590 HG11 VAL 102 HG11 VAL 102 -9.695 -1.586 11.510 591 HG12 VAL 102 HG12 VAL 102 -11.363 -1.539 12.084 592 HG13 VAL 102 HG13 VAL 102 -10.210 -2.660 12.810 593 HG21 VAL 102 HG21 VAL 102 -12.016 -0.748 13.939 594 HG22 VAL 102 HG22 VAL 102 -11.189 0.676 14.571 595 HG23 VAL 102 HG23 VAL 102 -10.903 -0.905 15.298 596 H LEU 103 H LEU 103 -6.436 -1.668 14.743 597 HA LEU 103 HA LEU 103 -5.061 -0.771 12.339 598 HB2 LEU 103 HB2 LEU 103 -4.244 -1.429 14.994 599 HB3 LEU 103 HB3 LEU 103 -3.245 -2.368 13.884 600 HG LEU 103 HG LEU 103 -2.160 -0.263 14.386 601 HD11 LEU 103 HD11 LEU 103 -1.707 -0.982 12.191 602 HD12 LEU 103 HD12 LEU 103 -2.088 0.734 12.055 603 HD13 LEU 103 HD13 LEU 103 -3.293 -0.475 11.612 604 HD21 LEU 103 HD21 LEU 103 -4.515 0.845 14.782 605 HD22 LEU 103 HD22 LEU 103 -4.316 1.334 13.099 606 HD23 LEU 103 HD23 LEU 103 -3.121 1.813 14.304 607 H ASP 104 H ASP 104 -5.749 -1.943 10.622 608 HA ASP 104 HA ASP 104 -5.616 -4.845 10.666 609 HB2 ASP 104 HB2 ASP 104 -7.232 -3.204 9.249 610 HB3 ASP 104 HB3 ASP 104 -5.934 -3.416 8.076 611 H LEU 105 H LEU 105 -3.645 -5.567 10.785 612 HA LEU 105 HA LEU 105 -1.748 -5.266 8.868 613 HB2 LEU 105 HB2 LEU 105 -1.535 -3.234 10.367 614 HB3 LEU 105 HB3 LEU 105 -1.113 -4.356 11.629 615 HG LEU 105 HG LEU 105 0.834 -3.189 10.544 616 HD11 LEU 105 HD11 LEU 105 0.956 -5.493 11.632 617 HD12 LEU 105 HD12 LEU 105 2.288 -4.993 10.587 618 HD13 LEU 105 HD13 LEU 105 1.067 -6.116 9.985 619 HD21 LEU 105 HD21 LEU 105 0.940 -4.886 8.197 620 HD22 LEU 105 HD22 LEU 105 1.184 -3.146 8.350 621 HD23 LEU 105 HD23 LEU 105 -0.446 -3.794 8.170 622 H ASP 106 H ASP 106 -0.321 -5.997 11.502 623 HA ASP 106 HA ASP 106 -1.197 -8.452 12.479 624 HB2 ASP 106 HB2 ASP 106 -0.480 -8.840 9.968 625 HB3 ASP 106 HB3 ASP 106 1.152 -8.828 10.650 626 H VAL 107 H VAL 107 -0.590 -6.275 13.522 627 HA VAL 107 HA VAL 107 1.690 -6.845 15.103 628 HB VAL 107 HB VAL 107 2.697 -5.513 13.216 629 HG11 VAL 107 HG11 VAL 107 0.631 -3.928 13.170 630 HG12 VAL 107 HG12 VAL 107 2.243 -3.297 12.833 631 HG13 VAL 107 HG13 VAL 107 1.517 -3.056 14.421 632 HG21 VAL 107 HG21 VAL 107 3.707 -3.800 14.978 633 HG22 VAL 107 HG22 VAL 107 4.086 -5.523 15.004 634 HG23 VAL 107 HG23 VAL 107 2.867 -4.871 16.099 635 H ARG 108 H ARG 108 1.764 -4.680 16.618 636 HA ARG 108 HA ARG 108 -0.846 -4.719 17.660 637 HB2 ARG 108 HB2 ARG 108 0.941 -2.861 19.063 638 HB3 ARG 108 HB3 ARG 108 0.041 -4.218 19.714 639 HG2 ARG 108 HG2 ARG 108 1.866 -5.482 19.837 640 HG3 ARG 108 HG3 ARG 108 2.349 -5.087 18.186 641 HD2 ARG 108 HD2 ARG 108 3.139 -2.855 19.117 642 HD3 ARG 108 HD3 ARG 108 2.934 -3.567 20.717 643 HE ARG 108 HE ARG 108 4.620 -4.983 18.798 644 HH11 ARG 108 HH11 ARG 108 4.404 -2.979 21.656 645 HH12 ARG 108 HH12 ARG 108 6.027 -3.309 22.159 646 HH21 ARG 108 HH21 ARG 108 6.752 -5.413 19.465 647 HH22 ARG 108 HH22 ARG 108 7.359 -4.689 20.917 648 H THR 109 H THR 109 -2.251 -3.179 17.397 649 HA THR 109 HA THR 109 -2.269 -1.514 15.336 650 HB THR 109 HB THR 109 -3.953 -0.147 16.430 651 HG1 THR 109 HG1 THR 109 -3.214 -1.417 18.852 652 HG21 THR 109 HG21 THR 109 -4.933 -2.349 17.828 653 HG22 THR 109 HG22 THR 109 -3.998 -3.013 16.489 654 HG23 THR 109 HG23 THR 109 -5.304 -1.874 16.172 655 H CYS 110 H CYS 110 -0.690 -0.451 14.692 656 HA CYS 110 HA CYS 110 1.362 0.881 15.555 657 HB2 CYS 110 HB2 CYS 110 -0.170 1.011 13.228 658 HB3 CYS 110 HB3 CYS 110 0.172 2.678 13.681 659 H LEU 111 H LEU 111 1.731 2.195 17.216 660 HA LEU 111 HA LEU 111 0.243 3.786 18.769 661 HB2 LEU 111 HB2 LEU 111 3.018 3.746 17.950 662 HB3 LEU 111 HB3 LEU 111 2.497 5.374 18.339 663 HG LEU 111 HG LEU 111 1.819 3.236 20.286 664 HD11 LEU 111 HD11 LEU 111 4.519 4.430 20.528 665 HD12 LEU 111 HD12 LEU 111 4.317 3.111 19.374 666 HD13 LEU 111 HD13 LEU 111 3.916 2.865 21.074 667 HD21 LEU 111 HD21 LEU 111 1.409 5.852 20.309 668 HD22 LEU 111 HD22 LEU 111 3.046 5.855 20.963 669 HD23 LEU 111 HD23 LEU 111 1.771 4.955 21.784 670 HA PRO 112 HA PRO 112 -1.232 7.095 16.105 671 HB2 PRO 112 HB2 PRO 112 -2.972 8.204 17.763 672 HB3 PRO 112 HB3 PRO 112 -3.215 6.551 17.183 673 HG2 PRO 112 HG2 PRO 112 -2.198 7.501 19.829 674 HG3 PRO 112 HG3 PRO 112 -3.288 6.152 19.467 675 HD2 PRO 112 HD2 PRO 112 -0.532 5.956 19.925 676 HD3 PRO 112 HD3 PRO 112 -1.553 4.710 19.181 677 H CYS 113 H CYS 113 -0.165 9.080 15.587 678 HA CYS 113 HA CYS 113 0.508 10.762 17.880 679 HB2 CYS 113 HB2 CYS 113 2.690 10.519 17.454 680 HB3 CYS 113 HB3 CYS 113 2.251 9.225 16.366 681 H GLY 114 H GLY 114 1.728 12.867 16.265 682 HA2 GLY 114 HA2 GLY 114 1.162 14.618 14.846 683 HA3 GLY 114 HA3 GLY 114 -0.265 13.715 14.349 684 HA PRO 115 HA PRO 115 -1.723 17.261 16.964 685 HB2 PRO 115 HB2 PRO 115 -4.033 17.665 15.707 686 HB3 PRO 115 HB3 PRO 115 -2.504 18.206 14.963 687 HG2 PRO 115 HG2 PRO 115 -3.740 15.495 14.751 688 HG3 PRO 115 HG3 PRO 115 -3.623 16.672 13.388 689 HD2 PRO 115 HD2 PRO 115 -1.690 14.970 13.573 690 HD3 PRO 115 HD3 PRO 115 -1.174 16.682 13.674 691 H GLY 116 H GLY 116 -1.828 15.623 18.340 692 HA2 GLY 116 HA2 GLY 116 -3.190 15.027 20.305 693 HA3 GLY 116 HA3 GLY 116 -4.524 14.942 19.186 694 H GLY 117 H GLY 117 -2.180 13.373 17.476 695 HA2 GLY 117 HA2 GLY 117 -1.539 11.300 17.304 696 HA3 GLY 117 HA3 GLY 117 -2.017 11.117 18.951 697 H LYS 118 H LYS 118 -3.740 12.050 16.158 698 HA LYS 118 HA LYS 118 -5.851 10.088 16.546 699 HB2 LYS 118 HB2 LYS 118 -6.110 11.794 14.190 700 HB3 LYS 118 HB3 LYS 118 -7.225 11.545 15.522 701 HG2 LYS 118 HG2 LYS 118 -6.746 13.565 16.289 702 HG3 LYS 118 HG3 LYS 118 -5.063 13.106 16.486 703 HD2 LYS 118 HD2 LYS 118 -5.200 15.059 15.084 704 HD3 LYS 118 HD3 LYS 118 -4.657 13.675 14.133 705 HE2 LYS 118 HE2 LYS 118 -6.914 13.393 13.242 706 HE3 LYS 118 HE3 LYS 118 -7.491 14.724 14.243 707 HZ1 LYS 118 HZ1 LYS 118 -5.335 15.096 12.254 708 HZ2 LYS 118 HZ2 LYS 118 -6.303 16.273 12.986 709 HZ3 LYS 118 HZ3 LYS 118 -6.968 15.232 11.832 710 H GLY 119 H GLY 119 -3.094 10.619 14.478 711 HA2 GLY 119 HA2 GLY 119 -3.984 8.530 12.563 712 HA3 GLY 119 HA3 GLY 119 -2.621 9.627 12.325 713 H ARG 120 H ARG 120 -1.152 7.433 11.886 714 HA ARG 120 HA ARG 120 -0.517 6.376 14.516 715 HB2 ARG 120 HB2 ARG 120 -0.728 4.960 11.848 716 HB3 ARG 120 HB3 ARG 120 0.153 4.291 13.213 717 HG2 ARG 120 HG2 ARG 120 -1.828 3.249 13.528 718 HG3 ARG 120 HG3 ARG 120 -2.162 4.728 14.432 719 HD2 ARG 120 HD2 ARG 120 -3.238 5.684 12.447 720 HD3 ARG 120 HD3 ARG 120 -2.918 4.195 11.561 721 HE ARG 120 HE ARG 120 -4.743 3.271 12.563 722 HH11 ARG 120 HH11 ARG 120 -3.731 6.008 14.488 723 HH12 ARG 120 HH12 ARG 120 -5.084 5.907 15.564 724 HH21 ARG 120 HH21 ARG 120 -6.517 3.143 13.977 725 HH22 ARG 120 HH22 ARG 120 -6.664 4.281 15.274 726 H CYS 121 H CYS 121 1.792 5.333 14.306 727 HA CYS 121 HA CYS 121 3.505 7.297 12.927 728 HB2 CYS 121 HB2 CYS 121 3.687 5.858 15.503 729 HB3 CYS 121 HB3 CYS 121 5.197 5.966 14.604 730 H PHE 122 H PHE 122 5.380 6.608 11.815 731 HA PHE 122 HA PHE 122 5.394 3.759 11.050 732 HB2 PHE 122 HB2 PHE 122 5.650 6.213 9.325 733 HB3 PHE 122 HB3 PHE 122 6.291 4.660 8.801 734 HD1 PHE 122 HD1 PHE 122 3.244 6.544 9.591 735 HD2 PHE 122 HD2 PHE 122 4.839 2.883 8.118 736 HE1 PHE 122 HE1 PHE 122 1.017 5.913 8.756 737 HE2 PHE 122 HE2 PHE 122 2.615 2.247 7.279 738 HZ PHE 122 HZ PHE 122 0.701 3.763 7.598 739 H GLY 123 H GLY 123 7.318 6.736 11.224 740 HA2 GLY 123 HA2 GLY 123 9.646 5.103 11.987 741 HA3 GLY 123 HA3 GLY 123 9.811 6.297 10.706 742 HA PRO 124 HA PRO 124 10.676 8.468 14.703 743 HB2 PRO 124 HB2 PRO 124 13.054 9.589 13.511 744 HB3 PRO 124 HB3 PRO 124 12.936 8.461 14.862 745 HG2 PRO 124 HG2 PRO 124 13.985 7.822 12.405 746 HG3 PRO 124 HG3 PRO 124 13.296 6.642 13.534 747 HD2 PRO 124 HD2 PRO 124 12.070 7.888 11.104 748 HD3 PRO 124 HD3 PRO 124 11.939 6.220 11.706 749 H SER 125 H SER 125 11.878 9.974 11.689 750 HA SER 125 HA SER 125 10.452 12.429 12.377 751 HB2 SER 125 HB2 SER 125 12.731 11.743 10.587 752 HB3 SER 125 HB3 SER 125 11.687 13.070 10.037 753 HG SER 125 HG SER 125 12.161 14.182 11.892 754 H ILE 126 H ILE 126 8.932 10.073 11.587 755 HA ILE 126 HA ILE 126 7.489 11.263 9.390 756 HB ILE 126 HB ILE 126 8.301 8.369 9.225 757 HG12 ILE 126 HG12 ILE 126 9.437 10.722 7.688 758 HG13 ILE 126 HG13 ILE 126 10.258 9.921 9.022 759 HG21 ILE 126 HG21 ILE 126 6.199 9.468 8.142 760 HG22 ILE 126 HG22 ILE 126 7.186 8.322 7.235 761 HG23 ILE 126 HG23 ILE 126 7.371 10.056 6.968 762 HD11 ILE 126 HD11 ILE 126 10.824 8.112 7.785 763 HD12 ILE 126 HD12 ILE 126 10.712 9.291 6.477 764 HD13 ILE 126 HD13 ILE 126 9.367 8.194 6.794 765 H CYS 127 H CYS 127 5.432 11.308 9.873 766 HA CYS 127 HA CYS 127 4.159 9.048 11.250 767 HB2 CYS 127 HB2 CYS 127 4.809 10.973 12.863 768 HB3 CYS 127 HB3 CYS 127 3.531 11.882 12.071 769 H CYS 128 H CYS 128 2.368 8.477 10.117 770 HA CYS 128 HA CYS 128 1.018 10.581 8.565 771 HB2 CYS 128 HB2 CYS 128 1.082 7.931 7.262 772 HB3 CYS 128 HB3 CYS 128 1.215 9.513 6.516 773 H GLY 129 H GLY 129 -1.411 10.569 9.092 774 HA2 GLY 129 HA2 GLY 129 -2.391 7.957 9.845 775 HA3 GLY 129 HA3 GLY 129 -3.099 9.529 10.198 776 H ASP 130 H ASP 130 -4.962 8.378 9.259 777 HA ASP 130 HA ASP 130 -5.122 7.678 6.590 778 HB2 ASP 130 HB2 ASP 130 -6.642 6.990 8.504 779 HB3 ASP 130 HB3 ASP 130 -7.462 8.522 8.231 780 H GLU 131 H GLU 131 -6.389 10.570 8.103 781 HA GLU 131 HA GLU 131 -6.463 11.806 5.480 782 HB2 GLU 131 HB2 GLU 131 -8.199 13.153 7.244 783 HB3 GLU 131 HB3 GLU 131 -8.663 12.221 5.837 784 HG2 GLU 131 HG2 GLU 131 -8.489 10.234 7.603 785 HG3 GLU 131 HG3 GLU 131 -8.780 11.554 8.732 786 H LEU 132 H LEU 132 -4.639 11.683 7.874 787 HA LEU 132 HA LEU 132 -4.330 14.525 8.380 788 HB2 LEU 132 HB2 LEU 132 -4.304 12.200 9.950 789 HB3 LEU 132 HB3 LEU 132 -2.639 12.670 9.807 790 HG LEU 132 HG LEU 132 -4.824 14.485 10.814 791 HD11 LEU 132 HD11 LEU 132 -4.422 12.411 12.192 792 HD12 LEU 132 HD12 LEU 132 -4.209 13.951 13.028 793 HD13 LEU 132 HD13 LEU 132 -2.800 13.034 12.496 794 HD21 LEU 132 HD21 LEU 132 -2.025 14.874 10.187 795 HD22 LEU 132 HD22 LEU 132 -2.382 15.265 11.869 796 HD23 LEU 132 HD23 LEU 132 -3.272 16.060 10.572 797 H GLY 133 H GLY 133 -3.228 11.705 6.853 798 HA2 GLY 133 HA2 GLY 133 -1.733 11.471 5.200 799 HA3 GLY 133 HA3 GLY 133 -1.477 13.163 5.384 800 H CYS 134 H CYS 134 0.864 13.310 5.485 801 HA CYS 134 HA CYS 134 2.032 11.845 7.762 802 HB2 CYS 134 HB2 CYS 134 2.408 10.736 5.416 803 HB3 CYS 134 HB3 CYS 134 3.621 11.987 5.262 804 H PHE 135 H PHE 135 3.151 13.169 9.085 805 HA PHE 135 HA PHE 135 4.300 15.570 7.889 806 HB2 PHE 135 HB2 PHE 135 4.338 14.769 10.814 807 HB3 PHE 135 HB3 PHE 135 4.573 16.374 10.136 808 HD1 PHE 135 HD1 PHE 135 1.993 13.703 10.438 809 HD2 PHE 135 HD2 PHE 135 2.825 17.866 10.151 810 HE1 PHE 135 HE1 PHE 135 -0.384 14.201 10.832 811 HE2 PHE 135 HE2 PHE 135 0.449 18.372 10.543 812 HZ PHE 135 HZ PHE 135 -1.159 16.539 10.886 813 H VAL 136 H VAL 136 6.122 14.866 6.890 814 HA VAL 136 HA VAL 136 7.705 12.874 8.290 815 HB VAL 136 HB VAL 136 8.466 13.925 5.579 816 HG11 VAL 136 HG11 VAL 136 9.261 11.569 5.344 817 HG12 VAL 136 HG12 VAL 136 8.816 11.311 7.031 818 HG13 VAL 136 HG13 VAL 136 10.064 12.486 6.618 819 HG21 VAL 136 HG21 VAL 136 6.125 13.390 5.337 820 HG22 VAL 136 HG22 VAL 136 6.349 11.834 6.139 821 HG23 VAL 136 HG23 VAL 136 7.075 12.126 4.556 822 H GLY 137 H GLY 137 8.254 14.076 9.905 823 HA2 GLY 137 HA2 GLY 137 10.195 15.042 10.937 824 HA3 GLY 137 HA3 GLY 137 10.624 15.778 9.404 825 H THR 138 H THR 138 8.395 15.963 12.117 826 HA THR 138 HA THR 138 8.532 18.836 12.140 827 HB THR 138 HB THR 138 6.055 19.143 12.034 828 HG1 THR 138 HG1 THR 138 5.927 16.615 12.254 829 HG21 THR 138 HG21 THR 138 7.691 19.244 9.981 830 HG22 THR 138 HG22 THR 138 5.946 19.387 9.776 831 HG23 THR 138 HG23 THR 138 6.747 17.849 9.456 832 H ALA 139 H ALA 139 6.701 19.548 14.115 833 HA ALA 139 HA ALA 139 7.689 18.189 16.352 834 HB1 ALA 139 HB1 ALA 139 5.312 20.032 16.162 835 HB2 ALA 139 HB2 ALA 139 6.985 20.587 16.216 836 HB3 ALA 139 HB3 ALA 139 6.306 19.705 17.583 837 H GLU 140 H GLU 140 4.941 17.716 14.317 838 HA GLU 140 HA GLU 140 3.250 16.365 16.160 839 HB2 GLU 140 HB2 GLU 140 3.341 16.773 13.253 840 HB3 GLU 140 HB3 GLU 140 2.624 15.244 13.739 841 HG2 GLU 140 HG2 GLU 140 0.792 16.620 13.676 842 HG3 GLU 140 HG3 GLU 140 1.245 16.710 15.377 843 H ALA 141 H ALA 141 6.066 15.449 14.398 844 HA ALA 141 HA ALA 141 5.671 12.612 14.755 845 HB1 ALA 141 HB1 ALA 141 6.920 12.701 12.897 846 HB2 ALA 141 HB2 ALA 141 8.286 12.924 13.992 847 HB3 ALA 141 HB3 ALA 141 7.506 14.326 13.260 848 H LEU 142 H LEU 142 6.814 15.190 16.577 849 HA LEU 142 HA LEU 142 8.941 14.135 17.931 850 HB2 LEU 142 HB2 LEU 142 6.939 16.179 18.605 851 HB3 LEU 142 HB3 LEU 142 7.803 15.501 19.971 852 HG LEU 142 HG LEU 142 9.416 16.442 17.652 853 HD11 LEU 142 HD11 LEU 142 9.001 18.626 17.854 854 HD12 LEU 142 HD12 LEU 142 8.887 18.538 19.612 855 HD13 LEU 142 HD13 LEU 142 7.490 18.127 18.617 856 HD21 LEU 142 HD21 LEU 142 9.811 15.706 20.399 857 HD22 LEU 142 HD22 LEU 142 10.416 17.337 20.107 858 HD23 LEU 142 HD23 LEU 142 11.005 15.991 19.132 859 H ARG 143 H ARG 143 5.568 13.478 18.672 860 HA ARG 143 HA ARG 143 6.177 11.835 20.942 861 HB2 ARG 143 HB2 ARG 143 3.840 10.906 20.475 862 HB3 ARG 143 HB3 ARG 143 3.943 12.627 20.818 863 HG2 ARG 143 HG2 ARG 143 4.108 12.783 18.186 864 HG3 ARG 143 HG3 ARG 143 3.271 11.232 18.289 865 HD2 ARG 143 HD2 ARG 143 2.315 13.646 19.797 866 HD3 ARG 143 HD3 ARG 143 1.845 13.354 18.123 867 HE ARG 143 HE ARG 143 0.880 11.225 18.915 868 HH11 ARG 143 HH11 ARG 143 1.418 13.789 21.230 869 HH12 ARG 143 HH12 ARG 143 0.215 13.210 22.333 870 HH21 ARG 143 HH21 ARG 143 -0.699 10.470 20.366 871 HH22 ARG 143 HH22 ARG 143 -0.985 11.327 21.844 872 H CYS 144 H CYS 144 6.210 11.585 17.669 873 HA CYS 144 HA CYS 144 5.922 8.808 17.176 874 HB2 CYS 144 HB2 CYS 144 6.617 10.832 15.467 875 HB3 CYS 144 HB3 CYS 144 8.058 9.824 15.445 876 H GLN 145 H GLN 145 8.421 10.278 18.915 877 HA GLN 145 HA GLN 145 10.618 8.624 18.573 878 HB2 GLN 145 HB2 GLN 145 9.663 10.517 20.535 879 HB3 GLN 145 HB3 GLN 145 10.430 9.154 21.335 880 HG2 GLN 145 HG2 GLN 145 12.445 9.900 20.820 881 HG3 GLN 145 HG3 GLN 145 12.023 10.031 19.113 882 HE21 GLN 145 HE21 GLN 145 11.732 11.991 18.252 883 HE22 GLN 145 HE22 GLN 145 11.748 13.475 19.136 884 H GLU 146 H GLU 146 7.554 7.950 20.073 885 HA GLU 146 HA GLU 146 8.527 5.622 21.497 886 HB2 GLU 146 HB2 GLU 146 5.760 6.730 21.016 887 HB3 GLU 146 HB3 GLU 146 6.043 5.223 21.874 888 HG2 GLU 146 HG2 GLU 146 6.990 6.278 23.691 889 HG3 GLU 146 HG3 GLU 146 7.414 7.718 22.765 890 H GLU 147 H GLU 147 8.324 6.152 18.377 891 HA GLU 147 HA GLU 147 6.866 3.822 17.501 892 HB2 GLU 147 HB2 GLU 147 7.307 6.061 16.218 893 HB3 GLU 147 HB3 GLU 147 8.849 5.319 15.814 894 HG2 GLU 147 HG2 GLU 147 6.484 3.643 15.339 895 HG3 GLU 147 HG3 GLU 147 6.612 5.085 14.334 896 H ASN 148 H ASN 148 9.662 4.210 19.149 897 HA ASN 148 HA ASN 148 11.450 2.515 17.714 898 HB2 ASN 148 HB2 ASN 148 11.305 3.500 20.555 899 HB3 ASN 148 HB3 ASN 148 12.510 2.310 20.074 900 HD21 ASN 148 HD21 ASN 148 12.409 5.311 20.838 901 HD22 ASN 148 HD22 ASN 148 13.463 6.034 19.676 902 H TYR 149 H TYR 149 8.809 1.971 19.968 903 HA TYR 149 HA TYR 149 9.543 -0.718 20.613 904 HB2 TYR 149 HB2 TYR 149 7.301 1.086 21.182 905 HB3 TYR 149 HB3 TYR 149 6.845 -0.611 21.074 906 HD1 TYR 149 HD1 TYR 149 7.989 -2.276 22.580 907 HD2 TYR 149 HD2 TYR 149 8.444 1.926 23.075 908 HE1 TYR 149 HE1 TYR 149 8.789 -2.639 24.877 909 HE2 TYR 149 HE2 TYR 149 9.245 1.574 25.373 910 HH TYR 149 HH TYR 149 9.139 -1.565 26.898 911 H LEU 150 H LEU 150 8.736 0.422 17.683 912 HA LEU 150 HA LEU 150 7.996 -2.186 16.750 913 HB2 LEU 150 HB2 LEU 150 5.911 -1.678 15.721 914 HB3 LEU 150 HB3 LEU 150 5.801 -1.256 17.412 915 HG LEU 150 HG LEU 150 4.684 0.489 16.437 916 HD11 LEU 150 HD11 LEU 150 6.283 2.467 16.225 917 HD12 LEU 150 HD12 LEU 150 7.549 1.323 16.670 918 HD13 LEU 150 HD13 LEU 150 6.205 1.625 17.773 919 HD21 LEU 150 HD21 LEU 150 5.398 1.590 14.323 920 HD22 LEU 150 HD22 LEU 150 4.948 -0.106 14.150 921 HD23 LEU 150 HD23 LEU 150 6.649 0.357 14.166 922 HA PRO 151 HA PRO 151 10.332 -0.135 13.504 923 HB2 PRO 151 HB2 PRO 151 11.923 -2.182 12.900 924 HB3 PRO 151 HB3 PRO 151 12.090 -1.323 14.435 925 HG2 PRO 151 HG2 PRO 151 10.987 -4.014 13.894 926 HG3 PRO 151 HG3 PRO 151 11.732 -3.380 15.369 927 HD2 PRO 151 HD2 PRO 151 8.929 -3.611 14.742 928 HD3 PRO 151 HD3 PRO 151 9.672 -3.001 16.234 929 H SER 152 H SER 152 7.722 -1.900 13.092 930 HA SER 152 HA SER 152 8.241 -2.368 10.227 931 HB2 SER 152 HB2 SER 152 7.953 -4.458 11.731 932 HB3 SER 152 HB3 SER 152 6.249 -4.008 11.775 933 HG SER 152 HG SER 152 6.290 -4.081 9.463 934 HA PRO 153 HA PRO 153 4.768 0.276 9.445 935 HB2 PRO 153 HB2 PRO 153 3.786 -0.762 7.131 936 HB3 PRO 153 HB3 PRO 153 5.276 0.187 7.205 937 HG2 PRO 153 HG2 PRO 153 4.924 -2.785 7.109 938 HG3 PRO 153 HG3 PRO 153 6.083 -1.765 6.233 939 HD2 PRO 153 HD2 PRO 153 6.768 -3.165 8.442 940 HD3 PRO 153 HD3 PRO 153 7.496 -1.594 8.050 941 H CYS 154 H CYS 154 2.439 0.337 9.437 942 HA CYS 154 HA CYS 154 1.140 -2.222 10.084 943 HB2 CYS 154 HB2 CYS 154 0.251 0.215 11.562 944 HB3 CYS 154 HB3 CYS 154 0.181 -1.474 12.045 945 H GLN 155 H GLN 155 -1.421 -1.417 10.519 946 HA GLN 155 HA GLN 155 -3.356 -0.950 9.396 947 HB2 GLN 155 HB2 GLN 155 -2.235 1.389 9.722 948 HB3 GLN 155 HB3 GLN 155 -2.012 1.318 7.979 949 HG2 GLN 155 HG2 GLN 155 -4.061 2.119 7.758 950 HG3 GLN 155 HG3 GLN 155 -4.667 0.591 8.395 951 HE21 GLN 155 HE21 GLN 155 -5.542 0.523 10.396 952 HE22 GLN 155 HE22 GLN 155 -5.735 1.904 11.417 953 H SER 156 H SER 156 -4.374 -0.615 7.158 954 HA SER 156 HA SER 156 -2.719 -1.493 4.941 955 HB2 SER 156 HB2 SER 156 -4.244 -3.445 4.465 956 HB3 SER 156 HB3 SER 156 -3.226 -3.629 5.893 957 HG SER 156 HG SER 156 -5.541 -4.181 6.099 958 H GLY 157 H GLY 157 -4.829 -2.346 3.233 959 HA2 GLY 157 HA2 GLY 157 -6.998 -1.436 2.525 960 HA3 GLY 157 HA3 GLY 157 -6.396 0.146 2.989 961 H GLN 158 H GLN 158 -4.957 1.259 1.626 962 HA GLN 158 HA GLN 158 -4.525 0.088 -1.028 963 HB2 GLN 158 HB2 GLN 158 -5.406 2.893 -0.281 964 HB3 GLN 158 HB3 GLN 158 -4.693 2.509 -1.841 965 HG2 GLN 158 HG2 GLN 158 -6.523 1.215 -2.491 966 HG3 GLN 158 HG3 GLN 158 -7.126 1.078 -0.838 967 HE21 GLN 158 HE21 GLN 158 -8.536 2.549 -0.103 968 HE22 GLN 158 HE22 GLN 158 -9.063 3.939 -0.983 969 H LYS 159 H LYS 159 -2.470 -0.506 -0.352 970 HA LYS 159 HA LYS 159 -0.824 1.658 0.660 971 HB2 LYS 159 HB2 LYS 159 -0.448 -1.301 0.892 972 HB3 LYS 159 HB3 LYS 159 0.617 -0.078 1.581 973 HG2 LYS 159 HG2 LYS 159 -2.317 -0.174 2.203 974 HG3 LYS 159 HG3 LYS 159 -1.123 -1.089 3.125 975 HD2 LYS 159 HD2 LYS 159 -0.238 1.620 2.828 976 HD3 LYS 159 HD3 LYS 159 -1.885 1.601 3.465 977 HE2 LYS 159 HE2 LYS 159 -1.274 0.401 5.356 978 HE3 LYS 159 HE3 LYS 159 0.203 -0.208 4.613 979 HZ1 LYS 159 HZ1 LYS 159 1.256 1.855 4.880 980 HZ2 LYS 159 HZ2 LYS 159 0.469 1.579 6.350 981 HZ3 LYS 159 HZ3 LYS 159 -0.190 2.661 5.228 982 HA PRO 160 HA PRO 160 2.474 -0.114 -2.144 983 HB2 PRO 160 HB2 PRO 160 1.716 -2.008 -4.057 984 HB3 PRO 160 HB3 PRO 160 2.552 -2.344 -2.538 985 HG2 PRO 160 HG2 PRO 160 -0.356 -2.531 -3.182 986 HG3 PRO 160 HG3 PRO 160 0.642 -3.592 -2.171 987 HD2 PRO 160 HD2 PRO 160 -1.022 -1.786 -1.085 988 HD3 PRO 160 HD3 PRO 160 0.553 -2.155 -0.353 989 H CYS 161 H CYS 161 2.885 1.399 -3.176 990 HA CYS 161 HA CYS 161 1.954 1.950 -5.834 991 HB2 CYS 161 HB2 CYS 161 0.848 3.875 -5.418 992 HB3 CYS 161 HB3 CYS 161 0.832 3.403 -3.733 993 H GLY 162 H GLY 162 3.707 4.303 -6.152 994 HA2 GLY 162 HA2 GLY 162 5.970 4.611 -6.580 995 HA3 GLY 162 HA3 GLY 162 6.107 4.202 -4.880 996 H SER 163 H SER 163 8.230 3.492 -5.621 997 HA SER 163 HA SER 163 8.385 1.037 -7.180 998 HB2 SER 163 HB2 SER 163 10.891 1.303 -6.665 999 HB3 SER 163 HB3 SER 163 10.140 2.535 -7.679 1000 HG SER 163 HG SER 163 11.330 2.790 -5.263 1001 H GLY 164 H GLY 164 6.953 0.815 -4.887 1002 HA2 GLY 164 HA2 GLY 164 6.953 -1.341 -3.694 1003 HA3 GLY 164 HA3 GLY 164 8.554 -0.905 -3.132 1004 H GLY 165 H GLY 165 6.401 1.829 -3.105 1005 HA2 GLY 165 HA2 GLY 165 6.354 1.534 -0.169 1006 HA3 GLY 165 HA3 GLY 165 6.117 3.035 -1.032 1007 H ARG 166 H ARG 166 4.597 1.745 1.177 1008 HA ARG 166 HA ARG 166 1.994 1.176 -0.033 1009 HB2 ARG 166 HB2 ARG 166 1.582 1.306 2.711 1010 HB3 ARG 166 HB3 ARG 166 1.782 -0.147 1.754 1011 HG2 ARG 166 HG2 ARG 166 4.061 1.322 3.067 1012 HG3 ARG 166 HG3 ARG 166 3.183 -0.008 3.819 1013 HD2 ARG 166 HD2 ARG 166 4.921 -0.064 1.372 1014 HD3 ARG 166 HD3 ARG 166 5.111 -0.970 2.871 1015 HE ARG 166 HE ARG 166 3.643 -1.775 0.608 1016 HH11 ARG 166 HH11 ARG 166 3.408 -1.782 4.098 1017 HH12 ARG 166 HH12 ARG 166 2.422 -3.206 4.149 1018 HH21 ARG 166 HH21 ARG 166 2.357 -3.644 0.683 1019 HH22 ARG 166 HH22 ARG 166 1.827 -4.262 2.212 1020 H CYS 167 H CYS 167 0.007 2.522 0.535 1021 HA CYS 167 HA CYS 167 0.740 5.198 0.513 1022 HB2 CYS 167 HB2 CYS 167 -1.121 4.477 -0.785 1023 HB3 CYS 167 HB3 CYS 167 -1.886 3.737 0.607 1024 H ALA 168 H ALA 168 1.446 6.117 2.398 1025 HA ALA 168 HA ALA 168 0.638 5.038 4.928 1026 HB1 ALA 168 HB1 ALA 168 2.225 6.364 5.864 1027 HB2 ALA 168 HB2 ALA 168 1.860 7.735 4.816 1028 HB3 ALA 168 HB3 ALA 168 2.821 6.387 4.206 1029 H ALA 169 H ALA 169 -0.610 7.549 2.745 1030 HA ALA 169 HA ALA 169 -2.920 7.874 4.216 1031 HB1 ALA 169 HB1 ALA 169 -1.849 9.296 5.599 1032 HB2 ALA 169 HB2 ALA 169 -2.447 10.396 4.385 1033 HB3 ALA 169 HB3 ALA 169 -0.746 9.909 4.397 1034 H ALA 170 H ALA 170 -4.244 9.486 3.017 1035 HA ALA 170 HA ALA 170 -4.204 9.079 0.243 1036 HB1 ALA 170 HB1 ALA 170 -6.110 10.299 0.151 1037 HB2 ALA 170 HB2 ALA 170 -5.478 11.576 1.193 1038 HB3 ALA 170 HB3 ALA 170 -6.048 10.063 1.899 1039 H GLY 171 H GLY 171 -3.053 9.934 -1.385 1040 HA2 GLY 171 HA2 GLY 171 -1.912 11.483 -2.622 1041 HA3 GLY 171 HA3 GLY 171 -2.255 12.662 -1.391 1042 H ILE 172 H ILE 172 -0.942 10.483 0.393 1043 HA ILE 172 HA ILE 172 1.889 11.155 -0.240 1044 HB ILE 172 HB ILE 172 2.321 11.457 2.088 1045 HG12 ILE 172 HG12 ILE 172 -0.146 11.589 3.348 1046 HG13 ILE 172 HG13 ILE 172 -0.220 10.092 2.410 1047 HG21 ILE 172 HG21 ILE 172 1.394 13.544 2.265 1048 HG22 ILE 172 HG22 ILE 172 -0.183 13.017 1.675 1049 HG23 ILE 172 HG23 ILE 172 1.160 13.216 0.549 1050 HD11 ILE 172 HD11 ILE 172 2.329 10.404 3.660 1051 HD12 ILE 172 HD12 ILE 172 1.163 9.078 3.800 1052 HD13 ILE 172 HD13 ILE 172 1.030 10.488 4.858 1053 H CYS 173 H CYS 173 2.699 9.323 -1.051 1054 HA CYS 173 HA CYS 173 2.093 6.747 0.151 1055 HB2 CYS 173 HB2 CYS 173 2.674 7.623 -2.429 1056 HB3 CYS 173 HB3 CYS 173 4.086 6.693 -1.943 1057 H CYS 174 H CYS 174 3.193 6.296 1.953 1058 HA CYS 174 HA CYS 174 6.002 7.039 2.131 1059 HB2 CYS 174 HB2 CYS 174 3.862 6.589 4.034 1060 HB3 CYS 174 HB3 CYS 174 5.321 5.712 4.480 1061 H SER 175 H SER 175 7.570 5.712 1.721 1062 HA SER 175 HA SER 175 7.046 2.864 1.337 1063 HB2 SER 175 HB2 SER 175 9.371 2.874 0.363 1064 HB3 SER 175 HB3 SER 175 8.242 3.938 -0.473 1065 HG SER 175 HG SER 175 10.228 4.673 1.412 1066 HA PRO 176 HA PRO 176 9.296 1.660 4.956 1067 HB2 PRO 176 HB2 PRO 176 11.218 -0.090 4.252 1068 HB3 PRO 176 HB3 PRO 176 9.501 -0.481 4.101 1069 HG2 PRO 176 HG2 PRO 176 11.432 0.419 1.998 1070 HG3 PRO 176 HG3 PRO 176 10.192 -0.847 1.912 1071 HD2 PRO 176 HD2 PRO 176 9.851 1.666 0.895 1072 HD3 PRO 176 HD3 PRO 176 8.512 0.657 1.477 1073 H ASP 177 H ASP 177 10.341 4.021 3.446 1074 HA ASP 177 HA ASP 177 12.820 4.309 4.943 1075 HB2 ASP 177 HB2 ASP 177 12.614 4.372 1.967 1076 HB3 ASP 177 HB3 ASP 177 13.697 5.520 2.747 1077 H GLY 178 H GLY 178 10.420 5.848 2.813 1078 HA2 GLY 178 HA2 GLY 178 10.203 8.072 4.658 1079 HA3 GLY 178 HA3 GLY 178 10.884 8.494 3.096 1080 H CYS 179 H CYS 179 9.254 9.755 2.313 1081 HA CYS 179 HA CYS 179 6.725 8.382 1.718 1082 HB2 CYS 179 HB2 CYS 179 7.045 10.633 3.467 1083 HB3 CYS 179 HB3 CYS 179 6.120 11.126 2.053 1084 H HIS 180 H HIS 180 5.520 9.374 -0.114 1085 HA HIS 180 HA HIS 180 7.035 11.133 -1.870 1086 HB2 HIS 180 HB2 HIS 180 8.100 9.048 -2.436 1087 HB3 HIS 180 HB3 HIS 180 6.558 8.207 -2.496 1088 HD1 HIS 180 HD1 HIS 180 7.130 11.486 -4.266 1089 HD2 HIS 180 HD2 HIS 180 6.792 7.438 -5.143 1090 HE1 HIS 180 HE1 HIS 180 6.968 11.351 -6.774 1091 HE2 HIS 180 HE2 HIS 180 6.664 8.900 -7.272 1092 H GLU 181 H GLU 181 5.681 12.290 -3.153 1093 HA GLU 181 HA GLU 181 2.926 12.205 -2.674 1094 HB2 GLU 181 HB2 GLU 181 2.990 14.209 -3.683 1095 HB3 GLU 181 HB3 GLU 181 4.703 13.951 -3.939 1096 HG2 GLU 181 HG2 GLU 181 4.448 13.542 -6.163 1097 HG3 GLU 181 HG3 GLU 181 2.836 12.855 -5.957 1098 H ASP 182 H ASP 182 1.271 11.109 -3.578 1099 HA ASP 182 HA ASP 182 1.776 9.618 -6.042 1100 HB2 ASP 182 HB2 ASP 182 1.265 7.516 -5.107 1101 HB3 ASP 182 HB3 ASP 182 2.310 8.284 -3.903 1102 HA PRO 183 HA PRO 183 -2.364 11.084 -6.817 1103 HB2 PRO 183 HB2 PRO 183 -2.457 9.562 -9.259 1104 HB3 PRO 183 HB3 PRO 183 -2.206 11.294 -9.052 1105 HG2 PRO 183 HG2 PRO 183 -0.287 9.561 -9.970 1106 HG3 PRO 183 HG3 PRO 183 0.065 11.105 -9.176 1107 HD2 PRO 183 HD2 PRO 183 0.107 8.335 -8.043 1108 HD3 PRO 183 HD3 PRO 183 1.221 9.690 -7.753 1109 H ALA 184 H ALA 184 -1.527 7.786 -6.446 1110 HA ALA 184 HA ALA 184 -3.990 6.560 -7.053 1111 HB1 ALA 184 HB1 ALA 184 -1.833 5.362 -6.743 1112 HB2 ALA 184 HB2 ALA 184 -3.176 4.653 -5.847 1113 HB3 ALA 184 HB3 ALA 184 -1.978 5.638 -5.008 1114 H CYS 185 H CYS 185 -2.719 7.967 -4.067 1115 HA CYS 185 HA CYS 185 -5.290 7.519 -2.739 1116 HB2 CYS 185 HB2 CYS 185 -2.549 8.130 -1.720 1117 HB3 CYS 185 HB3 CYS 185 -3.964 8.421 -0.716 1118 H ASP 186 H ASP 186 -4.693 9.558 -4.806 1119 HA ASP 186 HA ASP 186 -5.296 11.946 -3.323 1120 HB2 ASP 186 HB2 ASP 186 -3.682 11.484 -5.672 1121 HB3 ASP 186 HB3 ASP 186 -4.859 12.770 -5.915 1122 HA PRO 187 HA PRO 187 -8.784 11.307 -6.747 1123 HB2 PRO 187 HB2 PRO 187 -9.495 8.862 -5.189 1124 HB3 PRO 187 HB3 PRO 187 -9.807 9.299 -6.845 1125 HG2 PRO 187 HG2 PRO 187 -7.903 7.574 -6.326 1126 HG3 PRO 187 HG3 PRO 187 -7.669 8.820 -7.570 1127 HD2 PRO 187 HD2 PRO 187 -6.618 8.698 -4.788 1128 HD3 PRO 187 HD3 PRO 187 -5.857 9.341 -6.256 1129 H GLU 188 H GLU 188 -9.896 12.870 -5.949 1130 HA GLU 188 HA GLU 188 -10.552 14.404 -4.166 1131 HB2 GLU 188 HB2 GLU 188 -13.064 14.069 -4.154 1132 HB3 GLU 188 HB3 GLU 188 -12.344 14.154 -5.756 1133 HG2 GLU 188 HG2 GLU 188 -12.608 11.852 -6.119 1134 HG3 GLU 188 HG3 GLU 188 -12.864 11.525 -4.408 1135 H ALA 189 H ALA 189 -9.159 13.021 -2.809 1136 HA ALA 189 HA ALA 189 -10.367 11.234 -1.011 1137 HB1 ALA 189 HB1 ALA 189 -7.896 11.285 -1.948 1138 HB2 ALA 189 HB2 ALA 189 -8.239 10.684 -0.314 1139 HB3 ALA 189 HB3 ALA 189 -7.643 12.327 -0.533 1140 H ALA 190 H ALA 190 -10.490 14.421 -1.168 1141 HA ALA 190 HA ALA 190 -9.890 15.153 1.482 1142 HB1 ALA 190 HB1 ALA 190 -11.924 16.364 -0.375 1143 HB2 ALA 190 HB2 ALA 190 -10.276 16.905 -0.063 1144 HB3 ALA 190 HB3 ALA 190 -11.507 17.061 1.190 1145 H PHE 191 H PHE 191 -11.076 15.164 3.461 1146 HA PHE 191 HA PHE 191 -13.550 13.570 3.382 1147 HB2 PHE 191 HB2 PHE 191 -11.320 13.642 5.255 1148 HB3 PHE 191 HB3 PHE 191 -12.874 13.850 6.061 1149 HD1 PHE 191 HD1 PHE 191 -14.567 12.096 5.973 1150 HD2 PHE 191 HD2 PHE 191 -10.739 11.574 4.187 1151 HE1 PHE 191 HE1 PHE 191 -14.968 9.672 5.829 1152 HE2 PHE 191 HE2 PHE 191 -11.135 9.151 4.036 1153 HZ PHE 191 HZ PHE 191 -13.252 8.197 4.859 1154 H SER 192 H SER 192 -14.407 15.677 2.500 1155 HA SER 192 HA SER 192 -15.588 17.198 4.689 1156 HB2 SER 192 HB2 SER 192 -13.404 18.200 3.161 1157 HB3 SER 192 HB3 SER 192 -14.845 19.095 2.679 1158 HG SER 192 HG SER 192 -14.635 20.147 4.471 Start of MODEL 13 1 H1 ALA 1 H1 ALA 1 27.821 35.555 0.300 2 H2 ALA 1 H2 ALA 1 26.469 36.505 0.753 3 H3 ALA 1 H3 ALA 1 26.343 35.390 -0.543 4 HA ALA 1 HA ALA 1 27.257 33.992 1.634 5 HB1 ALA 1 HB1 ALA 1 24.711 34.867 2.653 6 HB2 ALA 1 HB2 ALA 1 25.850 36.209 2.563 7 HB3 ALA 1 HB3 ALA 1 26.273 34.754 3.463 8 H VAL 2 H VAL 2 24.670 34.867 -0.597 9 HA VAL 2 HA VAL 2 23.905 32.929 -1.969 10 HB VAL 2 HB VAL 2 22.638 31.139 -0.844 11 HG11 VAL 2 HG11 VAL 2 25.430 31.316 -1.104 12 HG12 VAL 2 HG12 VAL 2 24.405 29.882 -1.152 13 HG13 VAL 2 HG13 VAL 2 25.093 30.421 0.378 14 HG21 VAL 2 HG21 VAL 2 23.652 30.930 1.700 15 HG22 VAL 2 HG22 VAL 2 22.025 31.448 1.260 16 HG23 VAL 2 HG23 VAL 2 23.282 32.648 1.546 17 H LEU 3 H LEU 3 22.640 34.555 -2.644 18 HA LEU 3 HA LEU 3 19.906 34.487 -1.670 19 HB2 LEU 3 HB2 LEU 3 21.564 36.427 -0.618 20 HB3 LEU 3 HB3 LEU 3 20.802 37.257 -1.961 21 HG LEU 3 HG LEU 3 19.476 37.707 -0.054 22 HD11 LEU 3 HD11 LEU 3 17.539 35.812 -0.731 23 HD12 LEU 3 HD12 LEU 3 18.461 36.095 -2.204 24 HD13 LEU 3 HD13 LEU 3 17.713 37.440 -1.364 25 HD21 LEU 3 HD21 LEU 3 20.464 35.585 1.119 26 HD22 LEU 3 HD22 LEU 3 18.989 34.831 0.517 27 HD23 LEU 3 HD23 LEU 3 18.888 36.221 1.592 28 H ASP 4 H ASP 4 20.063 33.468 -3.872 29 HA ASP 4 HA ASP 4 20.687 34.986 -6.101 30 HB2 ASP 4 HB2 ASP 4 20.092 32.397 -5.741 31 HB3 ASP 4 HB3 ASP 4 18.559 32.954 -6.405 32 H LEU 5 H LEU 5 18.107 35.698 -4.031 33 HA LEU 5 HA LEU 5 16.515 36.649 -6.162 34 HB2 LEU 5 HB2 LEU 5 15.511 35.342 -4.275 35 HB3 LEU 5 HB3 LEU 5 15.925 36.663 -3.223 36 HG LEU 5 HG LEU 5 13.549 36.615 -3.883 37 HD11 LEU 5 HD11 LEU 5 14.800 38.715 -3.271 38 HD12 LEU 5 HD12 LEU 5 13.309 38.930 -4.188 39 HD13 LEU 5 HD13 LEU 5 14.870 39.069 -4.999 40 HD21 LEU 5 HD21 LEU 5 12.798 36.928 -6.052 41 HD22 LEU 5 HD22 LEU 5 14.140 35.800 -6.248 42 HD23 LEU 5 HD23 LEU 5 14.363 37.511 -6.620 43 H ASP 6 H ASP 6 17.377 37.705 -3.152 44 HA ASP 6 HA ASP 6 19.145 39.716 -3.246 45 HB2 ASP 6 HB2 ASP 6 17.145 40.380 -4.940 46 HB3 ASP 6 HB3 ASP 6 16.691 41.309 -3.510 47 H VAL 7 H VAL 7 16.327 38.553 -2.182 48 HA VAL 7 HA VAL 7 16.573 38.863 0.597 49 HB VAL 7 HB VAL 7 15.283 40.984 0.075 50 HG11 VAL 7 HG11 VAL 7 13.640 39.085 -1.443 51 HG12 VAL 7 HG12 VAL 7 13.837 40.821 -1.634 52 HG13 VAL 7 HG13 VAL 7 12.729 40.189 -0.419 53 HG21 VAL 7 HG21 VAL 7 14.351 40.726 2.076 54 HG22 VAL 7 HG22 VAL 7 14.800 39.022 2.002 55 HG23 VAL 7 HG23 VAL 7 13.205 39.538 1.455 56 H ARG 8 H ARG 8 15.892 36.819 1.259 57 HA ARG 8 HA ARG 8 15.093 35.070 -0.768 58 HB2 ARG 8 HB2 ARG 8 16.344 33.894 0.727 59 HB3 ARG 8 HB3 ARG 8 16.040 35.012 2.015 60 HG2 ARG 8 HG2 ARG 8 13.673 33.564 1.784 61 HG3 ARG 8 HG3 ARG 8 14.959 32.389 1.544 62 HD2 ARG 8 HD2 ARG 8 15.207 34.342 3.772 63 HD3 ARG 8 HD3 ARG 8 14.115 32.976 3.960 64 HE ARG 8 HE ARG 8 16.996 32.683 3.368 65 HH11 ARG 8 HH11 ARG 8 14.107 31.630 5.048 66 HH12 ARG 8 HH12 ARG 8 14.924 30.368 5.904 67 HH21 ARG 8 HH21 ARG 8 18.056 31.021 4.515 68 HH22 ARG 8 HH22 ARG 8 17.152 30.024 5.606 69 H THR 9 H THR 9 12.975 35.178 -1.515 70 HA THR 9 HA THR 9 11.124 35.487 0.748 71 HB THR 9 HB THR 9 10.324 35.620 -2.166 72 HG1 THR 9 HG1 THR 9 11.583 37.325 -2.233 73 HG21 THR 9 HG21 THR 9 9.105 37.226 0.028 74 HG22 THR 9 HG22 THR 9 8.671 35.526 -0.163 75 HG23 THR 9 HG23 THR 9 8.398 36.659 -1.486 76 H CYS 10 H CYS 10 11.403 33.577 1.426 77 HA CYS 10 HA CYS 10 11.180 31.338 -0.386 78 HB2 CYS 10 HB2 CYS 10 12.192 31.714 2.263 79 HB3 CYS 10 HB3 CYS 10 11.149 30.306 2.190 80 H LEU 11 H LEU 11 9.173 30.888 -1.237 81 HA LEU 11 HA LEU 11 6.714 31.566 -0.481 82 HB2 LEU 11 HB2 LEU 11 7.739 28.965 -1.508 83 HB3 LEU 11 HB3 LEU 11 6.077 29.011 -0.951 84 HG LEU 11 HG LEU 11 6.220 29.353 -3.361 85 HD11 LEU 11 HD11 LEU 11 5.231 31.523 -1.573 86 HD12 LEU 11 HD12 LEU 11 4.324 30.354 -2.527 87 HD13 LEU 11 HD13 LEU 11 5.114 31.715 -3.315 88 HD21 LEU 11 HD21 LEU 11 7.214 31.493 -4.186 89 HD22 LEU 11 HD22 LEU 11 8.389 30.338 -3.566 90 HD23 LEU 11 HD23 LEU 11 7.910 31.722 -2.585 91 HA PRO 12 HA PRO 12 6.551 29.803 3.686 92 HB2 PRO 12 HB2 PRO 12 5.380 31.833 4.894 93 HB3 PRO 12 HB3 PRO 12 7.033 31.977 4.296 94 HG2 PRO 12 HG2 PRO 12 4.509 33.096 3.191 95 HG3 PRO 12 HG3 PRO 12 6.150 33.758 3.135 96 HD2 PRO 12 HD2 PRO 12 4.807 32.266 1.104 97 HD3 PRO 12 HD3 PRO 12 6.491 32.826 1.097 98 H CYS 13 H CYS 13 5.060 28.144 3.909 99 HA CYS 13 HA CYS 13 2.248 28.892 4.017 100 HB2 CYS 13 HB2 CYS 13 1.681 27.584 2.316 101 HB3 CYS 13 HB3 CYS 13 3.381 27.495 1.923 102 H GLY 14 H GLY 14 1.378 26.140 4.609 103 HA2 GLY 14 HA2 GLY 14 1.355 24.627 6.381 104 HA3 GLY 14 HA3 GLY 14 2.827 25.368 7.001 105 HA PRO 15 HA PRO 15 -0.789 26.589 9.662 106 HB2 PRO 15 HB2 PRO 15 0.519 26.832 11.987 107 HB3 PRO 15 HB3 PRO 15 0.059 25.236 11.347 108 HG2 PRO 15 HG2 PRO 15 2.562 26.767 10.759 109 HG3 PRO 15 HG3 PRO 15 2.491 25.218 11.674 110 HD2 PRO 15 HD2 PRO 15 2.952 25.025 9.137 111 HD3 PRO 15 HD3 PRO 15 1.500 24.147 9.704 112 H GLY 16 H GLY 16 -0.456 28.316 8.355 113 HA2 GLY 16 HA2 GLY 16 -0.948 30.705 8.468 114 HA3 GLY 16 HA3 GLY 16 0.087 30.742 9.872 115 H GLY 17 H GLY 17 1.724 28.965 7.641 116 HA2 GLY 17 HA2 GLY 17 3.144 29.478 5.949 117 HA3 GLY 17 HA3 GLY 17 2.541 31.070 6.042 118 H LYS 18 H LYS 18 4.169 29.144 8.472 119 HA LYS 18 HA LYS 18 6.306 31.119 8.744 120 HB2 LYS 18 HB2 LYS 18 6.090 28.748 10.534 121 HB3 LYS 18 HB3 LYS 18 6.619 30.384 10.892 122 HG2 LYS 18 HG2 LYS 18 3.896 30.513 10.146 123 HG3 LYS 18 HG3 LYS 18 4.079 29.211 11.317 124 HD2 LYS 18 HD2 LYS 18 5.610 31.168 12.432 125 HD3 LYS 18 HD3 LYS 18 4.343 32.117 11.649 126 HE2 LYS 18 HE2 LYS 18 3.622 31.633 13.872 127 HE3 LYS 18 HE3 LYS 18 2.664 30.649 12.765 128 HZ1 LYS 18 HZ1 LYS 18 3.426 29.385 14.690 129 HZ2 LYS 18 HZ2 LYS 18 5.036 29.699 14.278 130 HZ3 LYS 18 HZ3 LYS 18 4.069 28.763 13.254 131 H GLY 19 H GLY 19 5.696 28.097 7.282 132 HA2 GLY 19 HA2 GLY 19 8.524 27.306 7.173 133 HA3 GLY 19 HA3 GLY 19 7.150 26.232 6.919 134 H ARG 20 H ARG 20 8.796 25.986 4.704 135 HA ARG 20 HA ARG 20 7.669 27.898 2.826 136 HB2 ARG 20 HB2 ARG 20 10.380 26.598 2.819 137 HB3 ARG 20 HB3 ARG 20 9.745 27.593 1.516 138 HG2 ARG 20 HG2 ARG 20 10.695 29.297 2.526 139 HG3 ARG 20 HG3 ARG 20 9.444 29.174 3.751 140 HD2 ARG 20 HD2 ARG 20 11.832 29.244 4.579 141 HD3 ARG 20 HD3 ARG 20 10.837 27.918 5.177 142 HE ARG 20 HE ARG 20 12.279 27.145 2.858 143 HH11 ARG 20 HH11 ARG 20 12.663 27.766 6.266 144 HH12 ARG 20 HH12 ARG 20 13.991 26.670 6.448 145 HH21 ARG 20 HH21 ARG 20 14.031 25.700 3.089 146 HH22 ARG 20 HH22 ARG 20 14.769 25.496 4.643 147 H CYS 21 H CYS 21 7.893 26.871 0.482 148 HA CYS 21 HA CYS 21 6.837 24.126 0.688 149 HB2 CYS 21 HB2 CYS 21 6.317 26.384 -1.211 150 HB3 CYS 21 HB3 CYS 21 6.043 24.727 -1.742 151 H PHE 22 H PHE 22 7.347 22.585 -0.963 152 HA PHE 22 HA PHE 22 9.733 23.080 -2.604 153 HB2 PHE 22 HB2 PHE 22 9.506 20.705 -0.733 154 HB3 PHE 22 HB3 PHE 22 10.840 21.051 -1.825 155 HD1 PHE 22 HD1 PHE 22 9.172 22.010 1.292 156 HD2 PHE 22 HD2 PHE 22 12.506 22.673 -1.268 157 HE1 PHE 22 HE1 PHE 22 10.288 23.282 3.077 158 HE2 PHE 22 HE2 PHE 22 13.627 23.947 0.514 159 HZ PHE 22 HZ PHE 22 12.516 24.255 2.691 160 H GLY 23 H GLY 23 6.703 22.378 -2.832 161 HA2 GLY 23 HA2 GLY 23 6.663 21.138 -5.253 162 HA3 GLY 23 HA3 GLY 23 6.700 19.799 -4.115 163 HA PRO 24 HA PRO 24 2.280 20.823 -4.370 164 HB2 PRO 24 HB2 PRO 24 1.495 18.162 -4.573 165 HB3 PRO 24 HB3 PRO 24 1.805 19.245 -5.929 166 HG2 PRO 24 HG2 PRO 24 3.303 16.943 -5.156 167 HG3 PRO 24 HG3 PRO 24 3.655 18.073 -6.472 168 HD2 PRO 24 HD2 PRO 24 4.814 17.924 -3.750 169 HD3 PRO 24 HD3 PRO 24 5.504 18.603 -5.241 170 H SER 25 H SER 25 2.757 17.612 -2.899 171 HA SER 25 HA SER 25 1.251 18.515 -0.570 172 HB2 SER 25 HB2 SER 25 1.812 15.906 -1.840 173 HB3 SER 25 HB3 SER 25 1.842 15.856 -0.072 174 HG SER 25 HG SER 25 -0.275 16.640 -1.783 175 H ILE 26 H ILE 26 3.907 19.563 -0.914 176 HA ILE 26 HA ILE 26 5.068 18.475 1.529 177 HB ILE 26 HB ILE 26 6.379 18.652 -1.116 178 HG12 ILE 26 HG12 ILE 26 6.893 16.552 0.864 179 HG13 ILE 26 HG13 ILE 26 5.344 16.589 0.009 180 HG21 ILE 26 HG21 ILE 26 8.355 18.066 0.828 181 HG22 ILE 26 HG22 ILE 26 7.628 19.621 1.208 182 HG23 ILE 26 HG23 ILE 26 8.345 19.350 -0.375 183 HD11 ILE 26 HD11 ILE 26 7.270 16.940 -1.970 184 HD12 ILE 26 HD12 ILE 26 6.336 15.482 -1.635 185 HD13 ILE 26 HD13 ILE 26 7.926 15.699 -0.904 186 H CYS 27 H CYS 27 4.724 20.203 2.816 187 HA CYS 27 HA CYS 27 6.105 22.703 2.087 188 HB2 CYS 27 HB2 CYS 27 3.493 22.741 2.374 189 HB3 CYS 27 HB3 CYS 27 3.867 22.691 4.088 190 H CYS 28 H CYS 28 7.897 22.637 3.099 191 HA CYS 28 HA CYS 28 8.034 21.674 5.837 192 HB2 CYS 28 HB2 CYS 28 10.210 21.506 3.786 193 HB3 CYS 28 HB3 CYS 28 10.074 20.603 5.290 194 H GLY 29 H GLY 29 9.923 22.416 6.993 195 HA2 GLY 29 HA2 GLY 29 10.937 25.025 6.350 196 HA3 GLY 29 HA3 GLY 29 10.015 24.957 7.844 197 H ASP 30 H ASP 30 12.249 25.641 8.517 198 HA ASP 30 HA ASP 30 14.314 23.799 8.620 199 HB2 ASP 30 HB2 ASP 30 15.347 25.348 10.258 200 HB3 ASP 30 HB3 ASP 30 14.864 26.110 8.749 201 H GLU 31 H GLU 31 12.039 24.801 11.031 202 HA GLU 31 HA GLU 31 12.765 22.379 12.560 203 HB2 GLU 31 HB2 GLU 31 11.639 23.983 14.432 204 HB3 GLU 31 HB3 GLU 31 13.369 23.826 14.187 205 HG2 GLU 31 HG2 GLU 31 13.347 25.795 12.779 206 HG3 GLU 31 HG3 GLU 31 11.596 25.914 12.943 207 H LEU 32 H LEU 32 10.785 23.151 10.505 208 HA LEU 32 HA LEU 32 8.299 22.480 11.811 209 HB2 LEU 32 HB2 LEU 32 9.148 24.510 10.014 210 HB3 LEU 32 HB3 LEU 32 8.068 23.450 9.170 211 HG LEU 32 HG LEU 32 7.449 24.951 11.711 212 HD11 LEU 32 HD11 LEU 32 7.533 26.509 9.950 213 HD12 LEU 32 HD12 LEU 32 5.825 26.136 10.180 214 HD13 LEU 32 HD13 LEU 32 6.713 25.413 8.838 215 HD21 LEU 32 HD21 LEU 32 5.885 23.380 11.995 216 HD22 LEU 32 HD22 LEU 32 6.076 22.770 10.363 217 HD23 LEU 32 HD23 LEU 32 5.054 24.170 10.656 218 H GLY 33 H GLY 33 10.877 21.563 9.912 219 HA2 GLY 33 HA2 GLY 33 11.349 19.814 8.622 220 HA3 GLY 33 HA3 GLY 33 10.162 18.999 9.576 221 H CYS 34 H CYS 34 8.999 17.814 8.206 222 HA CYS 34 HA CYS 34 7.995 19.239 5.854 223 HB2 CYS 34 HB2 CYS 34 9.487 16.826 6.129 224 HB3 CYS 34 HB3 CYS 34 8.065 16.624 5.147 225 H PHE 35 H PHE 35 5.751 19.442 5.834 226 HA PHE 35 HA PHE 35 4.256 17.271 7.059 227 HB2 PHE 35 HB2 PHE 35 3.371 19.915 5.794 228 HB3 PHE 35 HB3 PHE 35 2.337 18.780 6.644 229 HD1 PHE 35 HD1 PHE 35 5.402 20.768 7.158 230 HD2 PHE 35 HD2 PHE 35 1.858 19.167 8.875 231 HE1 PHE 35 HE1 PHE 35 5.932 21.877 9.267 232 HE2 PHE 35 HE2 PHE 35 2.378 20.294 11.002 233 HZ PHE 35 HZ PHE 35 4.424 21.648 11.204 234 H VAL 36 H VAL 36 4.360 15.660 5.515 235 HA VAL 36 HA VAL 36 4.291 16.581 2.764 236 HB VAL 36 HB VAL 36 5.002 13.749 3.434 237 HG11 VAL 36 HG11 VAL 36 5.600 15.685 1.178 238 HG12 VAL 36 HG12 VAL 36 4.621 14.209 1.121 239 HG13 VAL 36 HG13 VAL 36 6.364 14.095 1.341 240 HG21 VAL 36 HG21 VAL 36 6.959 16.082 3.421 241 HG22 VAL 36 HG22 VAL 36 7.401 14.380 3.558 242 HG23 VAL 36 HG23 VAL 36 6.493 15.164 4.849 243 H GLY 37 H GLY 37 2.259 17.016 2.575 244 HA2 GLY 37 HA2 GLY 37 0.414 15.865 1.297 245 HA3 GLY 37 HA3 GLY 37 0.462 14.627 2.532 246 H THR 38 H THR 38 0.412 16.146 4.856 247 HA THR 38 HA THR 38 -2.253 16.535 5.278 248 HB THR 38 HB THR 38 -0.816 16.380 7.138 249 HG1 THR 38 HG1 THR 38 -2.502 17.572 7.779 250 HG21 THR 38 HG21 THR 38 1.203 17.307 6.385 251 HG22 THR 38 HG22 THR 38 0.680 18.250 7.781 252 HG23 THR 38 HG23 THR 38 0.462 18.892 6.153 253 H ALA 39 H ALA 39 -2.974 19.008 6.295 254 HA ALA 39 HA ALA 39 -3.544 20.422 3.923 255 HB1 ALA 39 HB1 ALA 39 -5.129 20.317 5.734 256 HB2 ALA 39 HB2 ALA 39 -4.618 21.993 5.519 257 HB3 ALA 39 HB3 ALA 39 -3.962 21.034 6.846 258 H GLU 40 H GLU 40 -1.014 20.579 6.271 259 HA GLU 40 HA GLU 40 -0.356 23.311 6.071 260 HB2 GLU 40 HB2 GLU 40 1.070 20.830 6.914 261 HB3 GLU 40 HB3 GLU 40 2.021 22.281 6.626 262 HG2 GLU 40 HG2 GLU 40 1.592 22.480 8.857 263 HG3 GLU 40 HG3 GLU 40 0.245 23.396 8.184 264 H ALA 41 H ALA 41 0.242 20.596 3.950 265 HA ALA 41 HA ALA 41 2.139 22.055 2.380 266 HB1 ALA 41 HB1 ALA 41 1.216 19.251 2.584 267 HB2 ALA 41 HB2 ALA 41 2.850 19.892 2.426 268 HB3 ALA 41 HB3 ALA 41 1.802 19.795 1.012 269 H LEU 42 H LEU 42 -1.222 21.340 2.437 270 HA LEU 42 HA LEU 42 -1.911 21.345 -0.242 271 HB2 LEU 42 HB2 LEU 42 -3.237 22.131 2.275 272 HB3 LEU 42 HB3 LEU 42 -3.920 22.780 0.799 273 HG LEU 42 HG LEU 42 -3.399 19.841 1.082 274 HD11 LEU 42 HD11 LEU 42 -5.082 19.515 2.489 275 HD12 LEU 42 HD12 LEU 42 -6.152 20.555 1.551 276 HD13 LEU 42 HD13 LEU 42 -5.096 21.254 2.778 277 HD21 LEU 42 HD21 LEU 42 -3.908 20.922 -1.131 278 HD22 LEU 42 HD22 LEU 42 -5.505 21.305 -0.487 279 HD23 LEU 42 HD23 LEU 42 -4.999 19.623 -0.649 280 H ARG 43 H ARG 43 -1.165 24.030 1.889 281 HA ARG 43 HA ARG 43 -1.859 26.138 0.196 282 HB2 ARG 43 HB2 ARG 43 -0.386 25.825 2.623 283 HB3 ARG 43 HB3 ARG 43 0.607 26.742 1.512 284 HG2 ARG 43 HG2 ARG 43 -2.219 27.572 1.936 285 HG3 ARG 43 HG3 ARG 43 -1.000 27.930 3.167 286 HD2 ARG 43 HD2 ARG 43 -0.145 28.598 0.456 287 HD3 ARG 43 HD3 ARG 43 -1.569 29.491 0.984 288 HE ARG 43 HE ARG 43 0.913 29.413 2.577 289 HH11 ARG 43 HH11 ARG 43 -1.684 31.231 1.085 290 HH12 ARG 43 HH12 ARG 43 -1.184 32.734 1.779 291 HH21 ARG 43 HH21 ARG 43 1.553 31.394 3.478 292 HH22 ARG 43 HH22 ARG 43 0.647 32.829 3.131 293 H CYS 44 H CYS 44 0.797 23.637 -0.303 294 HA CYS 44 HA CYS 44 2.394 25.473 -1.678 295 HB2 CYS 44 HB2 CYS 44 2.139 22.474 -1.407 296 HB3 CYS 44 HB3 CYS 44 3.345 23.210 -2.434 297 H GLN 45 H GLN 45 -0.632 24.464 -2.393 298 HA GLN 45 HA GLN 45 -0.401 23.456 -5.024 299 HB2 GLN 45 HB2 GLN 45 -2.469 23.343 -3.620 300 HB3 GLN 45 HB3 GLN 45 -2.678 25.071 -3.870 301 HG2 GLN 45 HG2 GLN 45 -4.101 23.900 -5.384 302 HG3 GLN 45 HG3 GLN 45 -2.805 24.659 -6.306 303 HE21 GLN 45 HE21 GLN 45 -2.121 23.425 -7.886 304 HE22 GLN 45 HE22 GLN 45 -1.977 21.703 -7.856 305 H GLU 46 H GLU 46 0.002 26.604 -3.661 306 HA GLU 46 HA GLU 46 -0.461 27.926 -6.206 307 HB2 GLU 46 HB2 GLU 46 0.552 28.957 -3.553 308 HB3 GLU 46 HB3 GLU 46 0.324 29.969 -4.972 309 HG2 GLU 46 HG2 GLU 46 -2.025 29.604 -4.957 310 HG3 GLU 46 HG3 GLU 46 -1.880 28.356 -3.720 311 H GLU 47 H GLU 47 1.943 26.030 -5.178 312 HA GLU 47 HA GLU 47 4.189 27.618 -6.067 313 HB2 GLU 47 HB2 GLU 47 3.961 25.513 -4.346 314 HB3 GLU 47 HB3 GLU 47 4.513 24.698 -5.804 315 HG2 GLU 47 HG2 GLU 47 6.193 26.853 -5.661 316 HG3 GLU 47 HG3 GLU 47 5.949 26.440 -3.964 317 H ASN 48 H ASN 48 1.682 26.279 -7.628 318 HA ASN 48 HA ASN 48 3.139 25.005 -9.773 319 HB2 ASN 48 HB2 ASN 48 0.492 24.900 -8.814 320 HB3 ASN 48 HB3 ASN 48 0.396 25.583 -10.435 321 HD21 ASN 48 HD21 ASN 48 1.418 24.384 -12.167 322 HD22 ASN 48 HD22 ASN 48 1.483 22.661 -12.075 323 H TYR 49 H TYR 49 1.813 28.144 -9.023 324 HA TYR 49 HA TYR 49 2.643 29.051 -11.723 325 HB2 TYR 49 HB2 TYR 49 0.850 30.653 -11.779 326 HB3 TYR 49 HB3 TYR 49 0.169 29.066 -11.461 327 HD1 TYR 49 HD1 TYR 49 0.338 28.693 -8.623 328 HD2 TYR 49 HD2 TYR 49 -0.422 32.280 -10.777 329 HE1 TYR 49 HE1 TYR 49 -0.854 29.606 -6.681 330 HE2 TYR 49 HE2 TYR 49 -1.618 33.198 -8.833 331 HH TYR 49 HH TYR 49 -1.669 31.527 -5.749 332 H LEU 50 H LEU 50 4.400 28.983 -9.610 333 HA LEU 50 HA LEU 50 5.029 31.813 -9.380 334 HB2 LEU 50 HB2 LEU 50 3.893 30.421 -7.236 335 HB3 LEU 50 HB3 LEU 50 5.605 30.498 -6.868 336 HG LEU 50 HG LEU 50 5.371 33.030 -7.387 337 HD11 LEU 50 HD11 LEU 50 2.596 32.797 -6.422 338 HD12 LEU 50 HD12 LEU 50 2.866 32.389 -8.115 339 HD13 LEU 50 HD13 LEU 50 3.329 33.977 -7.507 340 HD21 LEU 50 HD21 LEU 50 4.020 31.981 -4.917 341 HD22 LEU 50 HD22 LEU 50 4.948 33.469 -5.100 342 HD23 LEU 50 HD23 LEU 50 5.761 31.907 -5.174 343 HA PRO 51 HA PRO 51 8.792 29.431 -10.357 344 HB2 PRO 51 HB2 PRO 51 9.943 31.271 -11.928 345 HB3 PRO 51 HB3 PRO 51 8.601 30.273 -12.501 346 HG2 PRO 51 HG2 PRO 51 8.570 33.098 -11.512 347 HG3 PRO 51 HG3 PRO 51 7.728 32.391 -12.902 348 HD2 PRO 51 HD2 PRO 51 6.550 32.850 -10.466 349 HD3 PRO 51 HD3 PRO 51 6.007 31.608 -11.612 350 H SER 52 H SER 52 8.548 30.658 -7.834 351 HA SER 52 HA SER 52 10.873 32.404 -7.565 352 HB2 SER 52 HB2 SER 52 8.812 31.547 -5.521 353 HB3 SER 52 HB3 SER 52 10.100 32.718 -5.243 354 HG SER 52 HG SER 52 9.160 34.047 -6.815 355 HA PRO 53 HA PRO 53 13.064 28.627 -6.374 356 HB2 PRO 53 HB2 PRO 53 15.538 29.523 -6.878 357 HB3 PRO 53 HB3 PRO 53 14.430 29.086 -8.185 358 HG2 PRO 53 HG2 PRO 53 15.138 31.793 -7.125 359 HG3 PRO 53 HG3 PRO 53 14.929 31.267 -8.806 360 HD2 PRO 53 HD2 PRO 53 13.011 32.591 -7.342 361 HD3 PRO 53 HD3 PRO 53 12.665 31.546 -8.733 362 H CYS 54 H CYS 54 13.494 31.886 -5.181 363 HA CYS 54 HA CYS 54 14.039 32.713 -3.136 364 HB2 CYS 54 HB2 CYS 54 12.477 31.034 -2.253 365 HB3 CYS 54 HB3 CYS 54 13.760 29.831 -2.231 366 H GLN 55 H GLN 55 16.098 33.461 -3.444 367 HA GLN 55 HA GLN 55 18.379 33.258 -3.846 368 HB2 GLN 55 HB2 GLN 55 19.366 32.994 -1.494 369 HB3 GLN 55 HB3 GLN 55 18.231 34.302 -1.793 370 HG2 GLN 55 HG2 GLN 55 16.741 33.490 -0.380 371 HG3 GLN 55 HG3 GLN 55 16.957 31.840 -0.935 372 HE21 GLN 55 HE21 GLN 55 16.859 31.088 1.196 373 HE22 GLN 55 HE22 GLN 55 18.195 31.258 2.278 374 H SER 56 H SER 56 18.883 31.182 -1.218 375 HA SER 56 HA SER 56 19.134 28.702 -2.530 376 HB2 SER 56 HB2 SER 56 21.077 30.093 -3.464 377 HB3 SER 56 HB3 SER 56 21.743 30.051 -1.836 378 HG SER 56 HG SER 56 21.040 27.728 -3.289 379 H GLY 57 H GLY 57 19.521 27.063 -1.022 380 HA2 GLY 57 HA2 GLY 57 20.652 27.442 1.513 381 HA3 GLY 57 HA3 GLY 57 18.917 27.674 1.658 382 H GLN 58 H GLN 58 17.526 25.887 1.210 383 HA GLN 58 HA GLN 58 18.842 23.308 1.313 384 HB2 GLN 58 HB2 GLN 58 16.277 24.213 2.646 385 HB3 GLN 58 HB3 GLN 58 16.973 22.609 2.751 386 HG2 GLN 58 HG2 GLN 58 19.063 24.020 3.603 387 HG3 GLN 58 HG3 GLN 58 17.764 25.105 4.097 388 HE21 GLN 58 HE21 GLN 58 19.630 22.535 4.996 389 HE22 GLN 58 HE22 GLN 58 18.658 21.919 6.284 390 H LYS 59 H LYS 59 18.707 23.224 -0.910 391 HA LYS 59 HA LYS 59 16.046 22.596 -1.877 392 HB2 LYS 59 HB2 LYS 59 17.280 23.551 -4.182 393 HB3 LYS 59 HB3 LYS 59 15.981 24.332 -3.313 394 HG2 LYS 59 HG2 LYS 59 17.399 25.897 -2.347 395 HG3 LYS 59 HG3 LYS 59 18.840 24.924 -2.624 396 HD2 LYS 59 HD2 LYS 59 19.106 25.706 -4.732 397 HD3 LYS 59 HD3 LYS 59 17.379 25.620 -5.075 398 HE2 LYS 59 HE2 LYS 59 17.386 27.686 -3.366 399 HE3 LYS 59 HE3 LYS 59 19.006 27.858 -4.037 400 HZ1 LYS 59 HZ1 LYS 59 16.531 27.695 -5.670 401 HZ2 LYS 59 HZ2 LYS 59 18.095 28.015 -6.231 402 HZ3 LYS 59 HZ3 LYS 59 17.304 29.138 -5.244 403 HA PRO 60 HA PRO 60 19.140 20.003 -4.071 404 HB2 PRO 60 HB2 PRO 60 21.793 20.401 -3.985 405 HB3 PRO 60 HB3 PRO 60 20.778 21.454 -4.988 406 HG2 PRO 60 HG2 PRO 60 21.836 21.940 -2.212 407 HG3 PRO 60 HG3 PRO 60 21.827 23.041 -3.603 408 HD2 PRO 60 HD2 PRO 60 19.888 23.069 -1.617 409 HD3 PRO 60 HD3 PRO 60 19.644 23.638 -3.269 410 H CYS 61 H CYS 61 18.748 18.311 -2.954 411 HA CYS 61 HA CYS 61 20.677 17.391 -0.996 412 HB2 CYS 61 HB2 CYS 61 18.537 18.483 0.072 413 HB3 CYS 61 HB3 CYS 61 17.789 16.961 -0.389 414 H GLY 62 H GLY 62 19.678 14.974 -0.393 415 HA2 GLY 62 HA2 GLY 62 19.833 12.852 -1.411 416 HA3 GLY 62 HA3 GLY 62 18.236 13.400 -1.887 417 H SER 63 H SER 63 18.661 11.837 -3.558 418 HA SER 63 HA SER 63 20.475 12.496 -5.689 419 HB2 SER 63 HB2 SER 63 19.466 10.127 -4.814 420 HB3 SER 63 HB3 SER 63 18.410 10.451 -6.188 421 HG SER 63 HG SER 63 20.284 9.310 -6.819 422 H GLY 64 H GLY 64 19.004 14.579 -5.356 423 HA2 GLY 64 HA2 GLY 64 18.436 15.931 -7.300 424 HA3 GLY 64 HA3 GLY 64 17.280 14.696 -7.749 425 H GLY 65 H GLY 65 17.129 15.099 -4.486 426 HA2 GLY 65 HA2 GLY 65 14.746 16.807 -4.751 427 HA3 GLY 65 HA3 GLY 65 15.072 15.709 -3.432 428 H ARG 66 H ARG 66 14.235 18.411 -3.121 429 HA ARG 66 HA ARG 66 16.640 19.808 -2.372 430 HB2 ARG 66 HB2 ARG 66 14.457 21.292 -1.403 431 HB3 ARG 66 HB3 ARG 66 15.571 21.691 -2.706 432 HG2 ARG 66 HG2 ARG 66 12.955 20.249 -2.871 433 HG3 ARG 66 HG3 ARG 66 13.366 21.850 -3.488 434 HD2 ARG 66 HD2 ARG 66 15.026 19.658 -4.490 435 HD3 ARG 66 HD3 ARG 66 13.342 19.638 -5.006 436 HE ARG 66 HE ARG 66 14.811 22.133 -5.291 437 HH11 ARG 66 HH11 ARG 66 13.485 19.269 -6.778 438 HH12 ARG 66 HH12 ARG 66 13.600 19.901 -8.383 439 HH21 ARG 66 HH21 ARG 66 14.967 22.965 -7.390 440 HH22 ARG 66 HH22 ARG 66 14.446 22.004 -8.734 441 H CYS 67 H CYS 67 17.027 20.768 -0.352 442 HA CYS 67 HA CYS 67 16.478 18.907 1.590 443 HB2 CYS 67 HB2 CYS 67 18.435 20.863 1.156 444 HB3 CYS 67 HB3 CYS 67 17.579 21.377 2.596 445 H ALA 68 H ALA 68 14.401 18.923 2.490 446 HA ALA 68 HA ALA 68 12.996 21.472 2.461 447 HB1 ALA 68 HB1 ALA 68 12.284 18.699 3.403 448 HB2 ALA 68 HB2 ALA 68 11.579 19.620 2.075 449 HB3 ALA 68 HB3 ALA 68 11.270 20.089 3.738 450 H ALA 69 H ALA 69 13.833 19.081 4.707 451 HA ALA 69 HA ALA 69 14.826 21.025 6.721 452 HB1 ALA 69 HB1 ALA 69 12.819 18.917 7.447 453 HB2 ALA 69 HB2 ALA 69 12.337 20.522 6.900 454 HB3 ALA 69 HB3 ALA 69 13.313 20.345 8.359 455 H ALA 70 H ALA 70 15.845 19.981 8.572 456 HA ALA 70 HA ALA 70 17.921 18.440 8.172 457 HB1 ALA 70 HB1 ALA 70 17.009 17.489 10.643 458 HB2 ALA 70 HB2 ALA 70 16.429 19.144 10.462 459 HB3 ALA 70 HB3 ALA 70 18.153 18.793 10.324 460 H GLY 71 H GLY 71 18.461 16.528 7.433 461 HA2 GLY 71 HA2 GLY 71 18.474 14.341 6.875 462 HA3 GLY 71 HA3 GLY 71 17.485 14.121 8.286 463 H ILE 72 H ILE 72 15.645 16.036 6.447 464 HA ILE 72 HA ILE 72 14.478 13.790 4.905 465 HB ILE 72 HB ILE 72 12.229 14.745 5.244 466 HG12 ILE 72 HG12 ILE 72 12.357 15.876 7.727 467 HG13 ILE 72 HG13 ILE 72 13.775 16.569 6.923 468 HG21 ILE 72 HG21 ILE 72 13.169 13.852 7.900 469 HG22 ILE 72 HG22 ILE 72 13.507 12.802 6.522 470 HG23 ILE 72 HG23 ILE 72 11.845 13.258 6.897 471 HD11 ILE 72 HD11 ILE 72 11.390 16.409 5.293 472 HD12 ILE 72 HD12 ILE 72 12.544 17.749 5.497 473 HD13 ILE 72 HD13 ILE 72 11.253 17.505 6.682 474 H CYS 73 H CYS 73 15.215 14.215 3.044 475 HA CYS 73 HA CYS 73 14.840 16.881 1.887 476 HB2 CYS 73 HB2 CYS 73 16.703 14.675 1.017 477 HB3 CYS 73 HB3 CYS 73 16.622 16.302 0.355 478 H CYS 74 H CYS 74 13.103 17.008 0.706 479 HA CYS 74 HA CYS 74 11.914 14.661 -0.416 480 HB2 CYS 74 HB2 CYS 74 10.953 17.483 -0.770 481 HB3 CYS 74 HB3 CYS 74 10.007 15.999 -0.806 482 H SER 75 H SER 75 11.796 13.992 -2.366 483 HA SER 75 HA SER 75 13.302 15.327 -4.498 484 HB2 SER 75 HB2 SER 75 13.003 13.083 -5.647 485 HB3 SER 75 HB3 SER 75 13.902 13.000 -4.140 486 HG SER 75 HG SER 75 11.958 12.328 -3.124 487 HA PRO 76 HA PRO 76 9.575 16.340 -6.667 488 HB2 PRO 76 HB2 PRO 76 9.586 15.197 -9.125 489 HB3 PRO 76 HB3 PRO 76 10.661 16.529 -8.686 490 HG2 PRO 76 HG2 PRO 76 11.233 13.594 -8.808 491 HG3 PRO 76 HG3 PRO 76 12.231 14.953 -9.357 492 HD2 PRO 76 HD2 PRO 76 12.657 13.664 -7.009 493 HD3 PRO 76 HD3 PRO 76 13.035 15.380 -7.242 494 H ASP 77 H ASP 77 9.531 13.838 -5.042 495 HA ASP 77 HA ASP 77 6.951 12.857 -5.950 496 HB2 ASP 77 HB2 ASP 77 7.650 10.489 -5.552 497 HB3 ASP 77 HB3 ASP 77 8.435 11.244 -6.937 498 H GLY 78 H GLY 78 9.453 12.666 -3.342 499 HA2 GLY 78 HA2 GLY 78 7.399 13.179 -1.368 500 HA3 GLY 78 HA3 GLY 78 8.042 11.566 -1.265 501 H CYS 79 H CYS 79 8.810 11.879 0.829 502 HA CYS 79 HA CYS 79 11.264 13.459 0.964 503 HB2 CYS 79 HB2 CYS 79 9.285 13.339 3.236 504 HB3 CYS 79 HB3 CYS 79 10.783 14.271 3.175 505 H HIS 80 H HIS 80 12.977 12.639 1.819 506 HA HIS 80 HA HIS 80 12.847 9.960 3.031 507 HB2 HIS 80 HB2 HIS 80 14.388 9.071 1.340 508 HB3 HIS 80 HB3 HIS 80 12.853 9.579 0.641 509 HD1 HIS 80 HD1 HIS 80 16.480 10.447 0.740 510 HD2 HIS 80 HD2 HIS 80 13.005 11.723 -1.146 511 HE1 HIS 80 HE1 HIS 80 17.238 11.994 -1.086 512 HE2 HIS 80 HE2 HIS 80 15.126 12.681 -2.276 513 H GLU 81 H GLU 81 14.375 9.477 4.363 514 HA GLU 81 HA GLU 81 15.956 11.354 5.567 515 HB2 GLU 81 HB2 GLU 81 16.039 8.365 5.496 516 HB3 GLU 81 HB3 GLU 81 17.276 9.261 6.368 517 HG2 GLU 81 HG2 GLU 81 15.448 10.396 7.631 518 HG3 GLU 81 HG3 GLU 81 14.311 9.294 6.858 519 H ASP 82 H ASP 82 17.720 12.350 5.048 520 HA ASP 82 HA ASP 82 19.746 11.051 3.435 521 HB2 ASP 82 HB2 ASP 82 18.649 11.994 1.637 522 HB3 ASP 82 HB3 ASP 82 18.071 13.392 2.545 523 HA PRO 83 HA PRO 83 22.216 12.780 6.704 524 HB2 PRO 83 HB2 PRO 83 24.306 12.582 4.582 525 HB3 PRO 83 HB3 PRO 83 24.345 12.005 6.243 526 HG2 PRO 83 HG2 PRO 83 23.961 10.291 4.295 527 HG3 PRO 83 HG3 PRO 83 22.997 10.165 5.780 528 HD2 PRO 83 HD2 PRO 83 22.225 11.245 3.102 529 HD3 PRO 83 HD3 PRO 83 21.278 10.266 4.241 530 H ALA 84 H ALA 84 21.867 14.417 3.663 531 HA ALA 84 HA ALA 84 23.727 16.479 4.185 532 HB1 ALA 84 HB1 ALA 84 21.894 15.836 2.086 533 HB2 ALA 84 HB2 ALA 84 23.381 16.777 2.039 534 HB3 ALA 84 HB3 ALA 84 21.855 17.559 2.452 535 H CYS 85 H CYS 85 20.299 16.233 5.043 536 HA CYS 85 HA CYS 85 20.307 19.033 5.716 537 HB2 CYS 85 HB2 CYS 85 18.298 17.191 4.967 538 HB3 CYS 85 HB3 CYS 85 17.849 17.918 6.497 539 H ASP 86 H ASP 86 21.257 16.408 7.501 540 HA ASP 86 HA ASP 86 20.384 17.792 9.950 541 HB2 ASP 86 HB2 ASP 86 19.640 15.324 9.352 542 HB3 ASP 86 HB3 ASP 86 21.196 14.936 10.081 543 HA PRO 87 HA PRO 87 24.942 18.509 9.853 544 HB2 PRO 87 HB2 PRO 87 23.896 20.489 11.841 545 HB3 PRO 87 HB3 PRO 87 25.148 20.680 10.603 546 HG2 PRO 87 HG2 PRO 87 22.755 21.653 10.105 547 HG3 PRO 87 HG3 PRO 87 23.580 20.708 8.845 548 HD2 PRO 87 HD2 PRO 87 21.392 19.843 10.709 549 HD3 PRO 87 HD3 PRO 87 21.565 19.557 8.954 550 H GLU 88 H GLU 88 24.607 16.489 10.704 551 HA GLU 88 HA GLU 88 26.295 15.770 12.464 552 HB2 GLU 88 HB2 GLU 88 24.923 14.680 14.237 553 HB3 GLU 88 HB3 GLU 88 24.936 16.435 14.218 554 HG2 GLU 88 HG2 GLU 88 22.764 16.427 13.085 555 HG3 GLU 88 HG3 GLU 88 22.722 14.674 13.264 556 H ALA 89 H ALA 89 24.761 15.107 9.858 557 HA ALA 89 HA ALA 89 23.522 12.798 10.041 558 HB1 ALA 89 HB1 ALA 89 23.852 14.033 7.903 559 HB2 ALA 89 HB2 ALA 89 23.601 12.292 7.817 560 HB3 ALA 89 HB3 ALA 89 25.225 12.962 7.633 561 H ALA 90 H ALA 90 26.678 12.802 10.977 562 HA ALA 90 HA ALA 90 28.092 10.816 10.477 563 HB1 ALA 90 HB1 ALA 90 27.414 12.010 12.931 564 HB2 ALA 90 HB2 ALA 90 28.884 11.131 12.520 565 HB3 ALA 90 HB3 ALA 90 27.513 10.274 13.223 566 H PHE 91 H PHE 91 28.267 8.772 10.215 567 HA PHE 91 HA PHE 91 25.894 7.115 10.218 568 HB2 PHE 91 HB2 PHE 91 28.671 6.890 9.101 569 HB3 PHE 91 HB3 PHE 91 27.641 5.465 9.201 570 HD1 PHE 91 HD1 PHE 91 25.579 5.333 7.901 571 HD2 PHE 91 HD2 PHE 91 28.244 8.628 7.524 572 HE1 PHE 91 HE1 PHE 91 24.465 5.988 5.808 573 HE2 PHE 91 HE2 PHE 91 27.138 9.289 5.427 574 HZ PHE 91 HZ PHE 91 25.244 7.969 4.568 575 H SER 92 H SER 92 25.507 5.429 11.507 576 HA SER 92 HA SER 92 25.605 4.033 13.300 577 HB2 SER 92 HB2 SER 92 27.565 3.232 11.785 578 HB3 SER 92 HB3 SER 92 28.595 3.942 13.026 579 HG SER 92 HG SER 92 28.051 2.400 14.380 580 H1 ALA 101 H1 ALA 101 3.106 -6.715 23.301 581 H2 ALA 101 H2 ALA 101 3.360 -6.329 21.649 582 H3 ALA 101 H3 ALA 101 2.671 -7.840 22.082 583 HA ALA 101 HA ALA 101 0.696 -6.860 22.779 584 HB1 ALA 101 HB1 ALA 101 1.479 -4.962 23.982 585 HB2 ALA 101 HB2 ALA 101 0.511 -4.323 22.652 586 HB3 ALA 101 HB3 ALA 101 2.271 -4.301 22.552 587 H VAL 102 H VAL 102 0.656 -8.072 20.519 588 HA VAL 102 HA VAL 102 1.002 -6.216 18.303 589 HB VAL 102 HB VAL 102 0.167 -8.213 16.930 590 HG11 VAL 102 HG11 VAL 102 2.622 -7.541 17.744 591 HG12 VAL 102 HG12 VAL 102 2.304 -8.975 16.768 592 HG13 VAL 102 HG13 VAL 102 2.501 -9.121 18.515 593 HG21 VAL 102 HG21 VAL 102 0.773 -9.988 19.199 594 HG22 VAL 102 HG22 VAL 102 -0.418 -10.162 17.910 595 HG23 VAL 102 HG23 VAL 102 -0.764 -9.131 19.299 596 H LEU 103 H LEU 103 -0.888 -6.044 16.563 597 HA LEU 103 HA LEU 103 -3.468 -6.146 17.987 598 HB2 LEU 103 HB2 LEU 103 -2.384 -3.987 16.239 599 HB3 LEU 103 HB3 LEU 103 -4.112 -4.226 16.402 600 HG LEU 103 HG LEU 103 -3.346 -2.469 17.903 601 HD11 LEU 103 HD11 LEU 103 -4.400 -5.004 19.061 602 HD12 LEU 103 HD12 LEU 103 -5.184 -3.441 18.861 603 HD13 LEU 103 HD13 LEU 103 -3.993 -3.669 20.137 604 HD21 LEU 103 HD21 LEU 103 -1.917 -4.055 19.826 605 HD22 LEU 103 HD22 LEU 103 -1.437 -2.560 19.024 606 HD23 LEU 103 HD23 LEU 103 -1.110 -4.113 18.260 607 H ASP 104 H ASP 104 -4.508 -8.016 17.085 608 HA ASP 104 HA ASP 104 -3.907 -8.541 14.339 609 HB2 ASP 104 HB2 ASP 104 -4.898 -10.070 16.415 610 HB3 ASP 104 HB3 ASP 104 -6.299 -9.884 15.370 611 H LEU 105 H LEU 105 -7.089 -8.522 15.530 612 HA LEU 105 HA LEU 105 -8.041 -6.235 14.123 613 HB2 LEU 105 HB2 LEU 105 -7.960 -8.023 12.409 614 HB3 LEU 105 HB3 LEU 105 -9.009 -8.997 13.423 615 HG LEU 105 HG LEU 105 -10.832 -7.442 13.146 616 HD11 LEU 105 HD11 LEU 105 -9.729 -5.335 13.178 617 HD12 LEU 105 HD12 LEU 105 -10.529 -5.472 11.607 618 HD13 LEU 105 HD13 LEU 105 -8.792 -5.740 11.734 619 HD21 LEU 105 HD21 LEU 105 -10.261 -7.381 10.356 620 HD22 LEU 105 HD22 LEU 105 -11.343 -8.453 11.243 621 HD23 LEU 105 HD23 LEU 105 -9.648 -8.891 11.029 622 H ASP 106 H ASP 106 -8.033 -6.797 16.894 623 HA ASP 106 HA ASP 106 -10.805 -7.571 17.529 624 HB2 ASP 106 HB2 ASP 106 -8.388 -7.029 19.275 625 HB3 ASP 106 HB3 ASP 106 -10.009 -7.230 19.932 626 H VAL 107 H VAL 107 -8.476 -5.074 17.942 627 HA VAL 107 HA VAL 107 -10.347 -2.940 17.590 628 HB VAL 107 HB VAL 107 -10.544 -3.406 20.080 629 HG11 VAL 107 HG11 VAL 107 -7.733 -3.417 19.948 630 HG12 VAL 107 HG12 VAL 107 -8.752 -3.585 21.373 631 HG13 VAL 107 HG13 VAL 107 -8.189 -1.991 20.877 632 HG21 VAL 107 HG21 VAL 107 -10.504 -1.040 18.670 633 HG22 VAL 107 HG22 VAL 107 -9.461 -0.705 20.052 634 HG23 VAL 107 HG23 VAL 107 -11.114 -1.262 20.311 635 H ARG 108 H ARG 108 -9.251 -1.460 16.402 636 HA ARG 108 HA ARG 108 -6.557 -1.979 15.871 637 HB2 ARG 108 HB2 ARG 108 -7.507 -1.139 13.977 638 HB3 ARG 108 HB3 ARG 108 -8.786 -0.356 14.844 639 HG2 ARG 108 HG2 ARG 108 -6.566 1.253 15.310 640 HG3 ARG 108 HG3 ARG 108 -6.422 0.748 13.630 641 HD2 ARG 108 HD2 ARG 108 -9.070 1.670 14.627 642 HD3 ARG 108 HD3 ARG 108 -7.830 2.867 14.275 643 HE ARG 108 HE ARG 108 -8.812 0.919 12.283 644 HH11 ARG 108 HH11 ARG 108 -7.747 4.150 13.118 645 HH12 ARG 108 HH12 ARG 108 -7.999 4.771 11.524 646 HH21 ARG 108 HH21 ARG 108 -9.148 1.760 10.191 647 HH22 ARG 108 HH22 ARG 108 -8.792 3.425 9.870 648 H THR 109 H THR 109 -5.025 -1.405 17.388 649 HA THR 109 HA THR 109 -5.657 1.244 18.519 650 HB THR 109 HB THR 109 -3.487 -0.594 19.554 651 HG1 THR 109 HG1 THR 109 -6.206 -0.907 19.844 652 HG21 THR 109 HG21 THR 109 -5.093 1.108 21.350 653 HG22 THR 109 HG22 THR 109 -3.970 1.925 20.261 654 HG23 THR 109 HG23 THR 109 -3.376 0.706 21.388 655 H CYS 110 H CYS 110 -5.131 2.234 16.837 656 HA CYS 110 HA CYS 110 -2.596 1.713 15.547 657 HB2 CYS 110 HB2 CYS 110 -5.023 3.044 14.812 658 HB3 CYS 110 HB3 CYS 110 -3.628 4.039 14.430 659 H LEU 111 H LEU 111 -0.762 2.326 16.621 660 HA LEU 111 HA LEU 111 -0.316 4.033 18.612 661 HB2 LEU 111 HB2 LEU 111 1.261 3.539 16.135 662 HB3 LEU 111 HB3 LEU 111 1.765 4.874 17.154 663 HG LEU 111 HG LEU 111 3.022 2.853 17.660 664 HD11 LEU 111 HD11 LEU 111 3.004 3.158 19.919 665 HD12 LEU 111 HD12 LEU 111 1.244 3.168 20.018 666 HD13 LEU 111 HD13 LEU 111 2.102 4.587 19.417 667 HD21 LEU 111 HD21 LEU 111 0.797 1.468 17.109 668 HD22 LEU 111 HD22 LEU 111 0.691 1.502 18.869 669 HD23 LEU 111 HD23 LEU 111 2.118 0.828 18.083 670 HA PRO 112 HA PRO 112 -1.847 7.883 16.802 671 HB2 PRO 112 HB2 PRO 112 -3.157 8.784 18.904 672 HB3 PRO 112 HB3 PRO 112 -3.724 7.362 18.030 673 HG2 PRO 112 HG2 PRO 112 -2.353 7.549 20.661 674 HG3 PRO 112 HG3 PRO 112 -3.552 6.372 20.103 675 HD2 PRO 112 HD2 PRO 112 -0.710 6.076 20.146 676 HD3 PRO 112 HD3 PRO 112 -1.904 4.943 19.483 677 H CYS 113 H CYS 113 -0.184 9.361 16.483 678 HA CYS 113 HA CYS 113 0.726 10.812 18.848 679 HB2 CYS 113 HB2 CYS 113 2.842 10.270 18.470 680 HB3 CYS 113 HB3 CYS 113 2.249 9.063 17.356 681 H GLY 114 H GLY 114 2.374 12.664 17.232 682 HA2 GLY 114 HA2 GLY 114 2.124 14.531 15.868 683 HA3 GLY 114 HA3 GLY 114 0.529 13.948 15.401 684 HA PRO 115 HA PRO 115 0.115 17.584 18.256 685 HB2 PRO 115 HB2 PRO 115 -2.193 18.559 17.301 686 HB3 PRO 115 HB3 PRO 115 -0.644 18.854 16.476 687 HG2 PRO 115 HG2 PRO 115 -2.478 16.518 16.104 688 HG3 PRO 115 HG3 PRO 115 -2.132 17.770 14.856 689 HD2 PRO 115 HD2 PRO 115 -0.682 15.631 14.764 690 HD3 PRO 115 HD3 PRO 115 0.237 17.154 14.954 691 H GLY 116 H GLY 116 -0.246 15.738 19.523 692 HA2 GLY 116 HA2 GLY 116 -1.432 15.433 21.626 693 HA3 GLY 116 HA3 GLY 116 -2.854 15.896 20.738 694 H GLY 117 H GLY 117 -1.340 13.633 18.626 695 HA2 GLY 117 HA2 GLY 117 -1.328 11.494 18.664 696 HA3 GLY 117 HA3 GLY 117 -2.136 11.526 20.170 697 H LYS 118 H LYS 118 -3.263 13.132 17.264 698 HA LYS 118 HA LYS 118 -5.653 11.459 17.225 699 HB2 LYS 118 HB2 LYS 118 -5.328 13.743 15.351 700 HB3 LYS 118 HB3 LYS 118 -6.763 13.167 16.190 701 HG2 LYS 118 HG2 LYS 118 -4.929 14.074 18.146 702 HG3 LYS 118 HG3 LYS 118 -5.033 15.301 16.886 703 HD2 LYS 118 HD2 LYS 118 -7.652 14.641 17.219 704 HD3 LYS 118 HD3 LYS 118 -7.025 14.428 18.857 705 HE2 LYS 118 HE2 LYS 118 -7.778 16.685 18.647 706 HE3 LYS 118 HE3 LYS 118 -6.014 16.699 18.685 707 HZ1 LYS 118 HZ1 LYS 118 -7.148 16.511 16.037 708 HZ2 LYS 118 HZ2 LYS 118 -5.899 17.494 16.613 709 HZ3 LYS 118 HZ3 LYS 118 -7.509 17.955 16.841 710 H GLY 119 H GLY 119 -2.648 11.624 15.548 711 HA2 GLY 119 HA2 GLY 119 -3.803 10.207 13.225 712 HA3 GLY 119 HA3 GLY 119 -2.313 11.150 13.162 713 H ARG 120 H ARG 120 -1.471 8.542 12.319 714 HA ARG 120 HA ARG 120 -0.811 7.275 14.797 715 HB2 ARG 120 HB2 ARG 120 -1.482 6.153 12.072 716 HB3 ARG 120 HB3 ARG 120 -0.915 5.202 13.438 717 HG2 ARG 120 HG2 ARG 120 -3.033 4.891 13.927 718 HG3 ARG 120 HG3 ARG 120 -3.070 6.560 14.465 719 HD2 ARG 120 HD2 ARG 120 -4.886 5.862 12.855 720 HD3 ARG 120 HD3 ARG 120 -3.967 7.300 12.415 721 HE ARG 120 HE ARG 120 -2.841 4.981 11.231 722 HH11 ARG 120 HH11 ARG 120 -5.548 7.164 10.976 723 HH12 ARG 120 HH12 ARG 120 -5.744 6.927 9.272 724 HH21 ARG 120 HH21 ARG 120 -3.094 4.665 8.982 725 HH22 ARG 120 HH22 ARG 120 -4.350 5.509 8.140 726 H CYS 121 H CYS 121 1.136 5.693 14.205 727 HA CYS 121 HA CYS 121 3.118 7.336 12.768 728 HB2 CYS 121 HB2 CYS 121 3.302 5.432 15.073 729 HB3 CYS 121 HB3 CYS 121 4.723 5.707 14.069 730 H PHE 122 H PHE 122 4.762 6.301 11.511 731 HA PHE 122 HA PHE 122 4.256 3.562 10.578 732 HB2 PHE 122 HB2 PHE 122 4.551 5.899 8.669 733 HB3 PHE 122 HB3 PHE 122 4.331 4.211 8.231 734 HD1 PHE 122 HD1 PHE 122 2.711 7.207 9.576 735 HD2 PHE 122 HD2 PHE 122 2.176 3.181 8.305 736 HE1 PHE 122 HE1 PHE 122 0.279 7.535 9.557 737 HE2 PHE 122 HE2 PHE 122 -0.263 3.504 8.289 738 HZ PHE 122 HZ PHE 122 -1.217 5.686 8.920 739 H GLY 123 H GLY 123 6.396 5.297 12.033 740 HA2 GLY 123 HA2 GLY 123 8.650 3.883 11.465 741 HA3 GLY 123 HA3 GLY 123 8.674 5.177 10.275 742 HA PRO 124 HA PRO 124 10.587 7.090 13.927 743 HB2 PRO 124 HB2 PRO 124 12.644 8.252 12.460 744 HB3 PRO 124 HB3 PRO 124 12.719 6.684 13.264 745 HG2 PRO 124 HG2 PRO 124 12.750 7.210 10.461 746 HG3 PRO 124 HG3 PRO 124 12.754 5.635 11.269 747 HD2 PRO 124 HD2 PRO 124 10.511 7.112 10.027 748 HD3 PRO 124 HD3 PRO 124 10.702 5.369 10.310 749 H SER 125 H SER 125 11.240 9.020 11.002 750 HA SER 125 HA SER 125 10.058 11.347 12.315 751 HB2 SER 125 HB2 SER 125 12.040 10.915 10.169 752 HB3 SER 125 HB3 SER 125 10.943 12.272 9.856 753 HG SER 125 HG SER 125 11.981 12.128 12.428 754 H ILE 126 H ILE 126 8.273 9.247 11.456 755 HA ILE 126 HA ILE 126 6.732 10.809 9.535 756 HB ILE 126 HB ILE 126 7.568 7.952 9.245 757 HG12 ILE 126 HG12 ILE 126 7.328 9.971 7.054 758 HG13 ILE 126 HG13 ILE 126 8.659 10.098 8.198 759 HG21 ILE 126 HG21 ILE 126 5.328 7.587 8.885 760 HG22 ILE 126 HG22 ILE 126 5.885 7.994 7.262 761 HG23 ILE 126 HG23 ILE 126 5.065 9.202 8.243 762 HD11 ILE 126 HD11 ILE 126 9.313 7.784 7.631 763 HD12 ILE 126 HD12 ILE 126 9.385 8.889 6.257 764 HD13 ILE 126 HD13 ILE 126 8.040 7.759 6.411 765 H CYS 127 H CYS 127 5.128 11.428 10.893 766 HA CYS 127 HA CYS 127 3.420 9.284 11.987 767 HB2 CYS 127 HB2 CYS 127 4.606 10.934 13.654 768 HB3 CYS 127 HB3 CYS 127 3.355 12.052 13.138 769 H CYS 128 H CYS 128 1.848 9.101 10.661 770 HA CYS 128 HA CYS 128 0.577 11.463 9.498 771 HB2 CYS 128 HB2 CYS 128 0.868 8.803 8.149 772 HB3 CYS 128 HB3 CYS 128 0.556 10.364 7.408 773 H GLY 129 H GLY 129 -1.713 11.472 9.219 774 HA2 GLY 129 HA2 GLY 129 -3.085 9.042 10.037 775 HA3 GLY 129 HA3 GLY 129 -3.590 10.675 10.438 776 H ASP 130 H ASP 130 -5.545 9.832 9.367 777 HA ASP 130 HA ASP 130 -5.644 9.403 6.632 778 HB2 ASP 130 HB2 ASP 130 -8.102 9.534 6.880 779 HB3 ASP 130 HB3 ASP 130 -7.335 8.395 7.980 780 H GLU 131 H GLU 131 -6.657 12.290 8.509 781 HA GLU 131 HA GLU 131 -6.464 13.646 5.939 782 HB2 GLU 131 HB2 GLU 131 -7.992 15.227 7.559 783 HB3 GLU 131 HB3 GLU 131 -8.658 14.094 6.399 784 HG2 GLU 131 HG2 GLU 131 -8.870 12.427 8.150 785 HG3 GLU 131 HG3 GLU 131 -8.114 13.516 9.307 786 H LEU 132 H LEU 132 -4.764 13.006 8.193 787 HA LEU 132 HA LEU 132 -3.722 15.619 8.990 788 HB2 LEU 132 HB2 LEU 132 -4.275 13.114 10.239 789 HB3 LEU 132 HB3 LEU 132 -2.558 13.328 10.265 790 HG LEU 132 HG LEU 132 -4.609 15.184 11.474 791 HD11 LEU 132 HD11 LEU 132 -4.498 13.338 12.888 792 HD12 LEU 132 HD12 LEU 132 -3.334 14.460 13.589 793 HD13 LEU 132 HD13 LEU 132 -2.772 13.109 12.605 794 HD21 LEU 132 HD21 LEU 132 -1.653 15.386 11.900 795 HD22 LEU 132 HD22 LEU 132 -2.907 16.568 12.258 796 HD23 LEU 132 HD23 LEU 132 -2.449 16.250 10.584 797 H GLY 133 H GLY 133 -3.409 12.992 6.997 798 HA2 GLY 133 HA2 GLY 133 -1.848 12.210 5.617 799 HA3 GLY 133 HA3 GLY 133 -1.416 13.873 5.518 800 H CYS 134 H CYS 134 0.808 13.809 5.472 801 HA CYS 134 HA CYS 134 2.037 12.251 7.596 802 HB2 CYS 134 HB2 CYS 134 2.475 12.445 4.783 803 HB3 CYS 134 HB3 CYS 134 3.951 12.566 5.702 804 H PHE 135 H PHE 135 3.337 13.166 9.000 805 HA PHE 135 HA PHE 135 4.372 15.870 8.400 806 HB2 PHE 135 HB2 PHE 135 4.099 14.522 11.132 807 HB3 PHE 135 HB3 PHE 135 4.777 16.112 10.828 808 HD1 PHE 135 HD1 PHE 135 1.687 14.183 10.254 809 HD2 PHE 135 HD2 PHE 135 3.417 17.972 11.115 810 HE1 PHE 135 HE1 PHE 135 -0.553 15.151 10.450 811 HE2 PHE 135 HE2 PHE 135 1.164 18.951 11.328 812 HZ PHE 135 HZ PHE 135 -0.824 17.540 10.990 813 H VAL 136 H VAL 136 6.194 15.198 7.344 814 HA VAL 136 HA VAL 136 7.464 12.826 8.438 815 HB VAL 136 HB VAL 136 8.214 13.951 5.757 816 HG11 VAL 136 HG11 VAL 136 8.901 11.663 7.360 817 HG12 VAL 136 HG12 VAL 136 9.629 12.240 5.864 818 HG13 VAL 136 HG13 VAL 136 8.241 11.156 5.806 819 HG21 VAL 136 HG21 VAL 136 5.602 13.258 6.255 820 HG22 VAL 136 HG22 VAL 136 6.278 11.724 5.756 821 HG23 VAL 136 HG23 VAL 136 6.369 13.098 4.677 822 H GLY 137 H GLY 137 8.447 13.642 10.108 823 HA2 GLY 137 HA2 GLY 137 10.859 14.107 10.598 824 HA3 GLY 137 HA3 GLY 137 10.733 15.442 9.475 825 H THR 138 H THR 138 8.445 16.728 10.336 826 HA THR 138 HA THR 138 9.367 18.355 12.341 827 HB THR 138 HB THR 138 7.541 19.061 10.976 828 HG1 THR 138 HG1 THR 138 7.148 20.167 12.731 829 HG21 THR 138 HG21 THR 138 6.099 17.499 10.342 830 HG22 THR 138 HG22 THR 138 5.240 17.925 11.823 831 HG23 THR 138 HG23 THR 138 6.340 16.546 11.806 832 H ALA 139 H ALA 139 7.988 18.773 14.344 833 HA ALA 139 HA ALA 139 8.669 16.877 16.284 834 HB1 ALA 139 HB1 ALA 139 7.563 19.438 16.332 835 HB2 ALA 139 HB2 ALA 139 8.144 18.495 17.705 836 HB3 ALA 139 HB3 ALA 139 6.444 18.422 17.241 837 H GLU 140 H GLU 140 5.592 17.315 14.604 838 HA GLU 140 HA GLU 140 3.954 15.680 16.056 839 HB2 GLU 140 HB2 GLU 140 4.113 16.375 13.156 840 HB3 GLU 140 HB3 GLU 140 2.959 15.151 13.669 841 HG2 GLU 140 HG2 GLU 140 1.672 17.027 13.767 842 HG3 GLU 140 HG3 GLU 140 2.273 16.958 15.423 843 H ALA 141 H ALA 141 6.506 14.735 13.968 844 HA ALA 141 HA ALA 141 5.734 11.947 13.927 845 HB1 ALA 141 HB1 ALA 141 7.685 13.574 12.456 846 HB2 ALA 141 HB2 ALA 141 6.666 12.245 11.902 847 HB3 ALA 141 HB3 ALA 141 8.164 11.906 12.771 848 H LEU 142 H LEU 142 8.092 14.020 15.409 849 HA LEU 142 HA LEU 142 9.896 12.363 16.476 850 HB2 LEU 142 HB2 LEU 142 8.581 14.789 17.532 851 HB3 LEU 142 HB3 LEU 142 9.502 13.845 18.685 852 HG LEU 142 HG LEU 142 10.713 14.728 16.086 853 HD11 LEU 142 HD11 LEU 142 9.696 16.557 17.770 854 HD12 LEU 142 HD12 LEU 142 11.165 16.809 16.829 855 HD13 LEU 142 HD13 LEU 142 11.272 16.301 18.515 856 HD21 LEU 142 HD21 LEU 142 11.689 12.946 17.681 857 HD22 LEU 142 HD22 LEU 142 12.080 14.320 18.716 858 HD23 LEU 142 HD23 LEU 142 12.745 14.227 17.085 859 H ARG 143 H ARG 143 6.608 12.683 17.722 860 HA ARG 143 HA ARG 143 6.836 11.083 20.002 861 HB2 ARG 143 HB2 ARG 143 4.722 12.141 18.393 862 HB3 ARG 143 HB3 ARG 143 4.398 10.441 18.679 863 HG2 ARG 143 HG2 ARG 143 5.144 12.143 20.994 864 HG3 ARG 143 HG3 ARG 143 3.521 12.283 20.305 865 HD2 ARG 143 HD2 ARG 143 4.398 9.523 20.703 866 HD3 ARG 143 HD3 ARG 143 4.293 10.458 22.194 867 HE ARG 143 HE ARG 143 2.040 10.292 20.303 868 HH11 ARG 143 HH11 ARG 143 3.311 9.985 23.551 869 HH12 ARG 143 HH12 ARG 143 1.754 9.740 24.262 870 HH21 ARG 143 HH21 ARG 143 0.003 9.970 21.251 871 HH22 ARG 143 HH22 ARG 143 -0.119 9.730 22.963 872 H CYS 144 H CYS 144 6.792 10.394 16.781 873 HA CYS 144 HA CYS 144 6.169 7.616 16.833 874 HB2 CYS 144 HB2 CYS 144 7.848 9.028 14.800 875 HB3 CYS 144 HB3 CYS 144 7.536 7.304 14.704 876 H GLN 145 H GLN 145 9.027 9.111 17.930 877 HA GLN 145 HA GLN 145 10.951 7.192 17.718 878 HB2 GLN 145 HB2 GLN 145 11.186 9.456 18.775 879 HB3 GLN 145 HB3 GLN 145 10.459 8.788 20.230 880 HG2 GLN 145 HG2 GLN 145 12.835 8.822 20.490 881 HG3 GLN 145 HG3 GLN 145 12.300 7.148 20.354 882 HE21 GLN 145 HE21 GLN 145 13.641 5.970 19.210 883 HE22 GLN 145 HE22 GLN 145 14.532 6.485 17.823 884 H GLU 146 H GLU 146 8.044 6.973 19.626 885 HA GLU 146 HA GLU 146 9.149 4.851 21.281 886 HB2 GLU 146 HB2 GLU 146 6.353 5.970 21.041 887 HB3 GLU 146 HB3 GLU 146 6.791 4.671 22.141 888 HG2 GLU 146 HG2 GLU 146 8.227 6.098 23.385 889 HG3 GLU 146 HG3 GLU 146 8.087 7.382 22.184 890 H GLU 147 H GLU 147 8.303 4.926 18.168 891 HA GLU 147 HA GLU 147 6.776 2.476 18.044 892 HB2 GLU 147 HB2 GLU 147 7.007 4.614 16.368 893 HB3 GLU 147 HB3 GLU 147 8.101 3.470 15.602 894 HG2 GLU 147 HG2 GLU 147 5.901 1.929 16.119 895 HG3 GLU 147 HG3 GLU 147 5.191 3.496 15.730 896 H ASN 148 H ASN 148 9.847 3.115 18.868 897 HA ASN 148 HA ASN 148 11.154 1.094 17.271 898 HB2 ASN 148 HB2 ASN 148 12.009 3.325 18.764 899 HB3 ASN 148 HB3 ASN 148 12.691 1.913 19.566 900 HD21 ASN 148 HD21 ASN 148 13.926 0.424 18.248 901 HD22 ASN 148 HD22 ASN 148 14.815 1.030 16.897 902 H TYR 149 H TYR 149 9.595 1.357 20.381 903 HA TYR 149 HA TYR 149 10.339 -1.467 20.905 904 HB2 TYR 149 HB2 TYR 149 10.411 -1.049 23.272 905 HB3 TYR 149 HB3 TYR 149 11.474 0.099 22.473 906 HD1 TYR 149 HD1 TYR 149 9.807 2.298 21.690 907 HD2 TYR 149 HD2 TYR 149 9.528 -0.122 25.177 908 HE1 TYR 149 HE1 TYR 149 8.694 4.137 22.875 909 HE2 TYR 149 HE2 TYR 149 8.412 1.719 26.366 910 HH TYR 149 HH TYR 149 8.436 4.844 25.351 911 H LEU 150 H LEU 150 8.120 -0.801 19.427 912 HA LEU 150 HA LEU 150 6.029 -1.910 21.118 913 HB2 LEU 150 HB2 LEU 150 6.072 0.818 20.500 914 HB3 LEU 150 HB3 LEU 150 4.894 0.125 19.401 915 HG LEU 150 HG LEU 150 3.894 -0.977 21.525 916 HD11 LEU 150 HD11 LEU 150 5.816 -0.370 22.971 917 HD12 LEU 150 HD12 LEU 150 4.264 0.201 23.583 918 HD13 LEU 150 HD13 LEU 150 5.367 1.326 22.791 919 HD21 LEU 150 HD21 LEU 150 2.392 0.802 21.743 920 HD22 LEU 150 HD22 LEU 150 3.003 0.943 20.095 921 HD23 LEU 150 HD23 LEU 150 3.623 2.004 21.358 922 HA PRO 151 HA PRO 151 6.020 -3.949 17.039 923 HB2 PRO 151 HB2 PRO 151 5.350 -6.397 17.901 924 HB3 PRO 151 HB3 PRO 151 6.990 -5.764 18.094 925 HG2 PRO 151 HG2 PRO 151 4.774 -5.927 20.100 926 HG3 PRO 151 HG3 PRO 151 6.498 -6.288 20.304 927 HD2 PRO 151 HD2 PRO 151 5.324 -3.929 21.069 928 HD3 PRO 151 HD3 PRO 151 7.039 -4.091 20.645 929 H SER 152 H SER 152 3.859 -2.294 17.768 930 HA SER 152 HA SER 152 1.470 -3.955 17.537 931 HB2 SER 152 HB2 SER 152 1.749 -0.973 17.941 932 HB3 SER 152 HB3 SER 152 0.231 -1.867 17.953 933 HG SER 152 HG SER 152 0.802 -2.833 19.829 934 HA PRO 153 HA PRO 153 1.715 -3.004 13.112 935 HB2 PRO 153 HB2 PRO 153 0.205 -5.055 12.276 936 HB3 PRO 153 HB3 PRO 153 1.864 -5.299 12.837 937 HG2 PRO 153 HG2 PRO 153 -0.711 -5.750 14.294 938 HG3 PRO 153 HG3 PRO 153 0.742 -6.766 14.249 939 HD2 PRO 153 HD2 PRO 153 0.150 -5.026 16.290 940 HD3 PRO 153 HD3 PRO 153 1.790 -5.544 15.871 941 H CYS 154 H CYS 154 -1.109 -3.409 15.126 942 HA CYS 154 HA CYS 154 -3.154 -2.423 15.125 943 HB2 CYS 154 HB2 CYS 154 -1.944 -0.324 14.743 944 HB3 CYS 154 HB3 CYS 154 -1.946 -0.620 13.008 945 H GLN 155 H GLN 155 -4.439 -4.067 14.442 946 HA GLN 155 HA GLN 155 -5.320 -5.544 12.841 947 HB2 GLN 155 HB2 GLN 155 -7.199 -4.234 11.700 948 HB3 GLN 155 HB3 GLN 155 -7.142 -4.249 13.460 949 HG2 GLN 155 HG2 GLN 155 -6.782 -2.071 13.581 950 HG3 GLN 155 HG3 GLN 155 -5.610 -2.081 12.277 951 HE21 GLN 155 HE21 GLN 155 -6.468 -0.148 11.474 952 HE22 GLN 155 HE22 GLN 155 -7.951 -0.116 10.588 953 H SER 156 H SER 156 -6.074 -3.136 10.581 954 HA SER 156 HA SER 156 -3.970 -3.462 8.734 955 HB2 SER 156 HB2 SER 156 -5.235 -5.701 8.654 956 HB3 SER 156 HB3 SER 156 -6.568 -4.788 7.950 957 HG SER 156 HG SER 156 -4.316 -4.162 6.656 958 H GLY 157 H GLY 157 -4.220 -2.009 6.998 959 HA2 GLY 157 HA2 GLY 157 -6.597 -0.758 6.259 960 HA3 GLY 157 HA3 GLY 157 -5.893 0.215 7.541 961 H GLN 158 H GLN 158 -3.840 1.274 7.150 962 HA GLN 158 HA GLN 158 -3.193 1.406 4.316 963 HB2 GLN 158 HB2 GLN 158 -3.117 3.583 6.423 964 HB3 GLN 158 HB3 GLN 158 -2.687 3.780 4.738 965 HG2 GLN 158 HG2 GLN 158 -5.145 2.833 4.406 966 HG3 GLN 158 HG3 GLN 158 -5.342 3.569 5.996 967 HE21 GLN 158 HE21 GLN 158 -5.452 4.082 2.724 968 HE22 GLN 158 HE22 GLN 158 -5.400 5.808 2.714 969 H LYS 159 H LYS 159 -1.837 -0.378 5.094 970 HA LYS 159 HA LYS 159 0.648 0.617 6.202 971 HB2 LYS 159 HB2 LYS 159 0.889 -2.149 6.112 972 HB3 LYS 159 HB3 LYS 159 0.800 -1.105 7.518 973 HG2 LYS 159 HG2 LYS 159 -1.496 -1.456 7.764 974 HG3 LYS 159 HG3 LYS 159 -1.649 -2.163 6.154 975 HD2 LYS 159 HD2 LYS 159 -0.909 -4.183 6.832 976 HD3 LYS 159 HD3 LYS 159 0.303 -3.483 7.907 977 HE2 LYS 159 HE2 LYS 159 -1.930 -2.798 9.225 978 HE3 LYS 159 HE3 LYS 159 -2.482 -4.276 8.439 979 HZ1 LYS 159 HZ1 LYS 159 -1.275 -5.524 9.800 980 HZ2 LYS 159 HZ2 LYS 159 -1.088 -4.146 10.762 981 HZ3 LYS 159 HZ3 LYS 159 0.105 -4.558 9.635 982 HA PRO 160 HA PRO 160 1.956 -1.684 2.389 983 HB2 PRO 160 HB2 PRO 160 0.278 -3.238 0.978 984 HB3 PRO 160 HB3 PRO 160 0.880 -3.784 2.555 985 HG2 PRO 160 HG2 PRO 160 -1.730 -2.424 1.905 986 HG3 PRO 160 HG3 PRO 160 -1.452 -3.875 2.890 987 HD2 PRO 160 HD2 PRO 160 -1.711 -1.367 3.989 988 HD3 PRO 160 HD3 PRO 160 -0.751 -2.662 4.709 989 H CYS 161 H CYS 161 2.418 -0.078 1.230 990 HA CYS 161 HA CYS 161 0.710 0.635 -1.001 991 HB2 CYS 161 HB2 CYS 161 0.527 2.262 1.062 992 HB3 CYS 161 HB3 CYS 161 2.082 2.836 0.476 993 H GLY 162 H GLY 162 2.213 2.406 -2.292 994 HA2 GLY 162 HA2 GLY 162 4.022 2.327 -3.780 995 HA3 GLY 162 HA3 GLY 162 4.837 2.645 -2.258 996 H SER 163 H SER 163 6.631 1.650 -3.504 997 HA SER 163 HA SER 163 6.497 -1.195 -3.922 998 HB2 SER 163 HB2 SER 163 7.952 0.792 -5.076 999 HB3 SER 163 HB3 SER 163 9.138 0.131 -3.953 1000 HG SER 163 HG SER 163 7.810 -1.839 -5.264 1001 H GLY 164 H GLY 164 5.865 -0.894 -1.350 1002 HA2 GLY 164 HA2 GLY 164 6.699 -2.486 0.330 1003 HA3 GLY 164 HA3 GLY 164 8.276 -1.753 0.125 1004 H GLY 165 H GLY 165 6.120 0.672 0.033 1005 HA2 GLY 165 HA2 GLY 165 6.545 1.283 2.893 1006 HA3 GLY 165 HA3 GLY 165 6.136 2.461 1.669 1007 H ARG 166 H ARG 166 4.857 2.257 4.227 1008 HA ARG 166 HA ARG 166 2.326 1.007 3.633 1009 HB2 ARG 166 HB2 ARG 166 2.023 2.474 6.022 1010 HB3 ARG 166 HB3 ARG 166 2.019 0.728 5.796 1011 HG2 ARG 166 HG2 ARG 166 4.331 2.524 6.403 1012 HG3 ARG 166 HG3 ARG 166 3.597 1.298 7.436 1013 HD2 ARG 166 HD2 ARG 166 4.594 0.336 4.854 1014 HD3 ARG 166 HD3 ARG 166 5.820 0.879 5.997 1015 HE ARG 166 HE ARG 166 3.802 -0.981 6.966 1016 HH11 ARG 166 HH11 ARG 166 7.070 -0.433 5.874 1017 HH12 ARG 166 HH12 ARG 166 7.662 -1.934 6.499 1018 HH21 ARG 166 HH21 ARG 166 4.569 -2.948 7.783 1019 HH22 ARG 166 HH22 ARG 166 6.237 -3.368 7.583 1020 H CYS 167 H CYS 167 0.289 2.028 3.813 1021 HA CYS 167 HA CYS 167 0.416 4.437 2.502 1022 HB2 CYS 167 HB2 CYS 167 -1.450 2.366 2.769 1023 HB3 CYS 167 HB3 CYS 167 -2.201 3.767 3.506 1024 H ALA 168 H ALA 168 0.931 6.260 3.723 1025 HA ALA 168 HA ALA 168 0.225 6.140 6.543 1026 HB1 ALA 168 HB1 ALA 168 2.148 7.331 6.507 1027 HB2 ALA 168 HB2 ALA 168 1.068 8.682 6.165 1028 HB3 ALA 168 HB3 ALA 168 1.907 7.874 4.846 1029 H ALA 169 H ALA 169 -0.375 8.002 3.719 1030 HA ALA 169 HA ALA 169 -3.165 8.540 4.449 1031 HB1 ALA 169 HB1 ALA 169 -1.353 10.898 4.042 1032 HB2 ALA 169 HB2 ALA 169 -1.637 10.209 5.640 1033 HB3 ALA 169 HB3 ALA 169 -2.988 10.850 4.702 1034 H ALA 170 H ALA 170 -4.264 9.740 2.746 1035 HA ALA 170 HA ALA 170 -4.224 8.811 0.300 1036 HB1 ALA 170 HB1 ALA 170 -4.752 11.523 -0.157 1037 HB2 ALA 170 HB2 ALA 170 -5.279 11.148 1.482 1038 HB3 ALA 170 HB3 ALA 170 -5.900 10.213 0.122 1039 H GLY 171 H GLY 171 -2.961 8.611 -1.400 1040 HA2 GLY 171 HA2 GLY 171 -1.418 9.009 -3.005 1041 HA3 GLY 171 HA3 GLY 171 -1.571 10.679 -2.570 1042 H ILE 172 H ILE 172 -0.533 9.902 0.259 1043 HA ILE 172 HA ILE 172 2.314 9.796 -0.519 1044 HB ILE 172 HB ILE 172 2.748 10.955 1.616 1045 HG12 ILE 172 HG12 ILE 172 0.492 12.421 2.051 1046 HG13 ILE 172 HG13 ILE 172 -0.179 10.816 1.735 1047 HG21 ILE 172 HG21 ILE 172 2.804 12.005 -0.603 1048 HG22 ILE 172 HG22 ILE 172 2.318 13.128 0.666 1049 HG23 ILE 172 HG23 ILE 172 1.107 12.447 -0.421 1050 HD11 ILE 172 HD11 ILE 172 2.171 10.852 3.424 1051 HD12 ILE 172 HD12 ILE 172 0.647 9.962 3.611 1052 HD13 ILE 172 HD13 ILE 172 0.754 11.652 4.124 1053 H CYS 173 H CYS 173 2.860 7.804 -0.412 1054 HA CYS 173 HA CYS 173 2.254 6.237 1.994 1055 HB2 CYS 173 HB2 CYS 173 3.074 5.274 -0.747 1056 HB3 CYS 173 HB3 CYS 173 2.613 4.271 0.623 1057 H CYS 174 H CYS 174 3.843 6.246 3.374 1058 HA CYS 174 HA CYS 174 6.516 6.828 2.538 1059 HB2 CYS 174 HB2 CYS 174 5.636 6.144 5.324 1060 HB3 CYS 174 HB3 CYS 174 7.006 7.135 4.826 1061 H SER 175 H SER 175 8.187 5.625 2.380 1062 HA SER 175 HA SER 175 7.976 2.720 2.711 1063 HB2 SER 175 HB2 SER 175 10.137 2.755 1.378 1064 HB3 SER 175 HB3 SER 175 8.759 3.433 0.525 1065 HG SER 175 HG SER 175 9.523 5.503 1.084 1066 HA PRO 176 HA PRO 176 10.733 2.789 6.175 1067 HB2 PRO 176 HB2 PRO 176 12.927 1.284 5.651 1068 HB3 PRO 176 HB3 PRO 176 11.324 0.582 5.899 1069 HG2 PRO 176 HG2 PRO 176 12.770 1.148 3.342 1070 HG3 PRO 176 HG3 PRO 176 11.816 -0.275 3.797 1071 HD2 PRO 176 HD2 PRO 176 10.846 1.711 2.226 1072 HD3 PRO 176 HD3 PRO 176 9.816 0.754 3.304 1073 H ASP 177 H ASP 177 11.158 4.885 4.095 1074 HA ASP 177 HA ASP 177 13.651 5.944 5.147 1075 HB2 ASP 177 HB2 ASP 177 14.379 6.649 2.860 1076 HB3 ASP 177 HB3 ASP 177 14.408 4.906 3.116 1077 H GLY 178 H GLY 178 10.793 6.619 3.030 1078 HA2 GLY 178 HA2 GLY 178 10.331 9.083 4.475 1079 HA3 GLY 178 HA3 GLY 178 10.854 9.363 2.838 1080 H CYS 179 H CYS 179 8.947 10.416 2.272 1081 HA CYS 179 HA CYS 179 6.671 8.625 1.850 1082 HB2 CYS 179 HB2 CYS 179 6.349 11.499 2.714 1083 HB3 CYS 179 HB3 CYS 179 5.068 10.309 2.464 1084 H HIS 180 H HIS 180 5.607 8.744 0.006 1085 HA HIS 180 HA HIS 180 6.458 10.571 -2.118 1086 HB2 HIS 180 HB2 HIS 180 7.334 8.724 -3.475 1087 HB3 HIS 180 HB3 HIS 180 8.229 8.864 -1.967 1088 HD1 HIS 180 HD1 HIS 180 5.775 6.622 -3.732 1089 HD2 HIS 180 HD2 HIS 180 8.070 6.654 -0.267 1090 HE1 HIS 180 HE1 HIS 180 5.657 4.281 -2.824 1091 HE2 HIS 180 HE2 HIS 180 7.167 4.292 -0.809 1092 H GLU 181 H GLU 181 5.096 10.858 -3.549 1093 HA GLU 181 HA GLU 181 2.468 10.246 -3.402 1094 HB2 GLU 181 HB2 GLU 181 4.204 11.145 -5.672 1095 HB3 GLU 181 HB3 GLU 181 2.493 10.837 -5.936 1096 HG2 GLU 181 HG2 GLU 181 2.009 12.433 -4.073 1097 HG3 GLU 181 HG3 GLU 181 3.723 12.838 -4.059 1098 H ASP 182 H ASP 182 1.319 8.553 -3.711 1099 HA ASP 182 HA ASP 182 2.008 6.630 -5.764 1100 HB2 ASP 182 HB2 ASP 182 3.181 5.559 -4.086 1101 HB3 ASP 182 HB3 ASP 182 2.106 6.107 -2.797 1102 HA PRO 183 HA PRO 183 -2.339 7.198 -6.510 1103 HB2 PRO 183 HB2 PRO 183 -2.003 4.489 -7.716 1104 HB3 PRO 183 HB3 PRO 183 -2.732 5.935 -8.404 1105 HG2 PRO 183 HG2 PRO 183 -0.328 5.214 -9.171 1106 HG3 PRO 183 HG3 PRO 183 -0.676 6.925 -8.853 1107 HD2 PRO 183 HD2 PRO 183 0.796 4.945 -7.169 1108 HD3 PRO 183 HD3 PRO 183 1.139 6.663 -7.453 1109 H ALA 184 H ALA 184 -1.175 4.522 -4.634 1110 HA ALA 184 HA ALA 184 -3.664 3.213 -4.359 1111 HB1 ALA 184 HB1 ALA 184 -1.103 3.028 -2.881 1112 HB2 ALA 184 HB2 ALA 184 -1.877 1.847 -3.926 1113 HB3 ALA 184 HB3 ALA 184 -2.533 2.172 -2.321 1114 H CYS 185 H CYS 185 -2.250 5.844 -2.460 1115 HA CYS 185 HA CYS 185 -4.263 5.428 -0.449 1116 HB2 CYS 185 HB2 CYS 185 -1.685 6.568 -0.436 1117 HB3 CYS 185 HB3 CYS 185 -2.821 7.750 0.182 1118 H ASP 186 H ASP 186 -4.402 7.132 -3.279 1119 HA ASP 186 HA ASP 186 -6.274 9.023 -2.017 1120 HB2 ASP 186 HB2 ASP 186 -4.097 9.797 -3.303 1121 HB3 ASP 186 HB3 ASP 186 -5.152 9.625 -4.703 1122 HA PRO 187 HA PRO 187 -9.022 6.182 -4.394 1123 HB2 PRO 187 HB2 PRO 187 -10.858 7.620 -2.521 1124 HB3 PRO 187 HB3 PRO 187 -10.842 5.917 -3.006 1125 HG2 PRO 187 HG2 PRO 187 -9.819 6.545 -0.668 1126 HG3 PRO 187 HG3 PRO 187 -8.917 5.444 -1.732 1127 HD2 PRO 187 HD2 PRO 187 -8.456 8.366 -1.234 1128 HD3 PRO 187 HD3 PRO 187 -7.273 7.028 -1.319 1129 H GLU 188 H GLU 188 -8.210 7.739 -5.814 1130 HA GLU 188 HA GLU 188 -9.745 8.297 -7.787 1131 HB2 GLU 188 HB2 GLU 188 -9.605 10.778 -7.903 1132 HB3 GLU 188 HB3 GLU 188 -10.611 10.189 -6.591 1133 HG2 GLU 188 HG2 GLU 188 -8.727 10.545 -5.031 1134 HG3 GLU 188 HG3 GLU 188 -7.834 11.292 -6.354 1135 H ALA 189 H ALA 189 -6.894 6.881 -7.591 1136 HA ALA 189 HA ALA 189 -5.214 9.121 -7.872 1137 HB1 ALA 189 HB1 ALA 189 -4.604 6.977 -6.776 1138 HB2 ALA 189 HB2 ALA 189 -3.470 7.565 -7.990 1139 HB3 ALA 189 HB3 ALA 189 -4.576 6.245 -8.382 1140 H ALA 190 H ALA 190 -7.447 8.316 -9.887 1141 HA ALA 190 HA ALA 190 -6.760 7.510 -12.278 1142 HB1 ALA 190 HB1 ALA 190 -8.605 9.375 -11.339 1143 HB2 ALA 190 HB2 ALA 190 -8.589 8.579 -12.912 1144 HB3 ALA 190 HB3 ALA 190 -7.807 10.146 -12.710 1145 H PHE 191 H PHE 191 -5.504 7.879 -13.951 1146 HA PHE 191 HA PHE 191 -3.276 9.714 -13.625 1147 HB2 PHE 191 HB2 PHE 191 -3.900 7.407 -15.436 1148 HB3 PHE 191 HB3 PHE 191 -2.610 8.530 -15.854 1149 HD1 PHE 191 HD1 PHE 191 -0.629 8.723 -14.445 1150 HD2 PHE 191 HD2 PHE 191 -3.674 5.864 -13.631 1151 HE1 PHE 191 HE1 PHE 191 0.905 7.523 -12.941 1152 HE2 PHE 191 HE2 PHE 191 -2.146 4.658 -12.127 1153 HZ PHE 191 HZ PHE 191 0.147 5.489 -11.779 1154 H SER 192 H SER 192 -2.918 11.480 -14.822 1155 HA SER 192 HA SER 192 -3.302 13.264 -16.185 1156 HB2 SER 192 HB2 SER 192 -2.921 11.295 -17.842 1157 HB3 SER 192 HB3 SER 192 -4.652 11.428 -18.144 1158 HG SER 192 HG SER 192 -3.520 13.867 -18.215 Start of MODEL 14 1 H1 ALA 1 H1 ALA 1 17.071 37.537 -3.448 2 H2 ALA 1 H2 ALA 1 18.044 36.553 -2.433 3 H3 ALA 1 H3 ALA 1 16.693 37.385 -1.783 4 HA ALA 1 HA ALA 1 16.698 34.857 -2.513 5 HB1 ALA 1 HB1 ALA 1 14.657 35.007 -1.661 6 HB2 ALA 1 HB2 ALA 1 14.096 35.977 -3.022 7 HB3 ALA 1 HB3 ALA 1 14.852 36.760 -1.635 8 H VAL 2 H VAL 2 16.814 33.708 -4.247 9 HA VAL 2 HA VAL 2 15.693 34.682 -6.762 10 HB VAL 2 HB VAL 2 17.700 33.468 -7.867 11 HG11 VAL 2 HG11 VAL 2 17.121 35.956 -7.790 12 HG12 VAL 2 HG12 VAL 2 18.792 35.517 -8.150 13 HG13 VAL 2 HG13 VAL 2 18.354 36.073 -6.534 14 HG21 VAL 2 HG21 VAL 2 18.405 33.092 -5.196 15 HG22 VAL 2 HG22 VAL 2 19.489 34.357 -5.777 16 HG23 VAL 2 HG23 VAL 2 19.416 32.806 -6.613 17 H LEU 3 H LEU 3 14.399 33.269 -7.676 18 HA LEU 3 HA LEU 3 14.276 30.489 -6.744 19 HB2 LEU 3 HB2 LEU 3 12.583 30.585 -8.888 20 HB3 LEU 3 HB3 LEU 3 12.117 30.957 -7.245 21 HG LEU 3 HG LEU 3 12.786 33.417 -7.979 22 HD11 LEU 3 HD11 LEU 3 13.558 32.697 -10.193 23 HD12 LEU 3 HD12 LEU 3 12.218 33.840 -10.291 24 HD13 LEU 3 HD13 LEU 3 11.933 32.120 -10.558 25 HD21 LEU 3 HD21 LEU 3 10.193 32.140 -8.825 26 HD22 LEU 3 HD22 LEU 3 10.463 33.829 -8.395 27 HD23 LEU 3 HD23 LEU 3 10.593 32.575 -7.163 28 H ASP 4 H ASP 4 15.396 29.249 -7.482 29 HA ASP 4 HA ASP 4 15.908 28.376 -9.952 30 HB2 ASP 4 HB2 ASP 4 17.982 30.272 -9.082 31 HB3 ASP 4 HB3 ASP 4 18.585 28.764 -9.771 32 H LEU 5 H LEU 5 18.698 28.346 -8.082 33 HA LEU 5 HA LEU 5 17.797 26.114 -6.486 34 HB2 LEU 5 HB2 LEU 5 18.720 25.078 -8.507 35 HB3 LEU 5 HB3 LEU 5 20.219 25.955 -8.265 36 HG LEU 5 HG LEU 5 20.765 24.666 -6.330 37 HD11 LEU 5 HD11 LEU 5 18.297 24.590 -5.566 38 HD12 LEU 5 HD12 LEU 5 19.344 23.221 -5.186 39 HD13 LEU 5 HD13 LEU 5 18.209 23.114 -6.530 40 HD21 LEU 5 HD21 LEU 5 21.394 23.513 -8.272 41 HD22 LEU 5 HD22 LEU 5 19.734 23.042 -8.634 42 HD23 LEU 5 HD23 LEU 5 20.584 22.306 -7.275 43 H ASP 6 H ASP 6 18.767 28.941 -6.474 44 HA ASP 6 HA ASP 6 21.013 29.007 -4.637 45 HB2 ASP 6 HB2 ASP 6 20.140 30.868 -6.429 46 HB3 ASP 6 HB3 ASP 6 19.264 31.388 -4.994 47 H VAL 7 H VAL 7 17.580 30.666 -4.214 48 HA VAL 7 HA VAL 7 17.187 28.532 -2.423 49 HB VAL 7 HB VAL 7 17.997 30.217 -0.856 50 HG11 VAL 7 HG11 VAL 7 16.664 32.095 -2.716 51 HG12 VAL 7 HG12 VAL 7 18.208 32.230 -1.879 52 HG13 VAL 7 HG13 VAL 7 16.705 32.535 -1.010 53 HG21 VAL 7 HG21 VAL 7 16.098 29.325 0.107 54 HG22 VAL 7 HG22 VAL 7 15.021 30.066 -1.075 55 HG23 VAL 7 HG23 VAL 7 15.774 31.056 0.175 56 H ARG 8 H ARG 8 15.097 27.911 -3.516 57 HA ARG 8 HA ARG 8 13.948 29.945 -5.179 58 HB2 ARG 8 HB2 ARG 8 13.946 27.249 -5.420 59 HB3 ARG 8 HB3 ARG 8 12.349 27.531 -4.750 60 HG2 ARG 8 HG2 ARG 8 12.853 29.402 -6.819 61 HG3 ARG 8 HG3 ARG 8 13.225 27.793 -7.413 62 HD2 ARG 8 HD2 ARG 8 11.010 27.880 -7.907 63 HD3 ARG 8 HD3 ARG 8 10.910 27.244 -6.271 64 HE ARG 8 HE ARG 8 10.740 29.837 -5.779 65 HH11 ARG 8 HH11 ARG 8 9.153 27.935 -8.241 66 HH12 ARG 8 HH12 ARG 8 7.778 28.981 -8.335 67 HH21 ARG 8 HH21 ARG 8 8.928 31.209 -5.906 68 HH22 ARG 8 HH22 ARG 8 7.650 30.838 -7.015 69 H THR 9 H THR 9 12.532 31.493 -4.354 70 HA THR 9 HA THR 9 11.790 31.084 -1.638 71 HB THR 9 HB THR 9 11.806 33.350 -2.446 72 HG1 THR 9 HG1 THR 9 9.706 32.352 -1.251 73 HG21 THR 9 HG21 THR 9 10.078 32.302 -4.618 74 HG22 THR 9 HG22 THR 9 11.423 33.439 -4.680 75 HG23 THR 9 HG23 THR 9 9.851 33.967 -4.083 76 H CYS 10 H CYS 10 10.749 29.349 -1.150 77 HA CYS 10 HA CYS 10 8.630 28.235 -2.749 78 HB2 CYS 10 HB2 CYS 10 9.708 27.409 -0.067 79 HB3 CYS 10 HB3 CYS 10 8.512 26.510 -0.978 80 H LEU 11 H LEU 11 6.564 29.045 -2.703 81 HA LEU 11 HA LEU 11 5.395 30.875 -1.152 82 HB2 LEU 11 HB2 LEU 11 4.178 28.258 -2.007 83 HB3 LEU 11 HB3 LEU 11 3.243 29.535 -1.256 84 HG LEU 11 HG LEU 11 4.836 30.131 -3.717 85 HD11 LEU 11 HD11 LEU 11 3.595 28.107 -4.255 86 HD12 LEU 11 HD12 LEU 11 2.907 29.503 -5.087 87 HD13 LEU 11 HD13 LEU 11 2.109 28.846 -3.658 88 HD21 LEU 11 HD21 LEU 11 3.795 32.085 -3.547 89 HD22 LEU 11 HD22 LEU 11 3.052 31.540 -2.043 90 HD23 LEU 11 HD23 LEU 11 2.224 31.283 -3.579 91 HA PRO 12 HA PRO 12 5.675 29.551 3.083 92 HB2 PRO 12 HB2 PRO 12 3.804 31.215 4.153 93 HB3 PRO 12 HB3 PRO 12 5.420 31.745 3.676 94 HG2 PRO 12 HG2 PRO 12 2.833 31.971 2.179 95 HG3 PRO 12 HG3 PRO 12 4.107 33.186 2.400 96 HD2 PRO 12 HD2 PRO 12 3.895 31.765 0.131 97 HD3 PRO 12 HD3 PRO 12 5.472 32.231 0.800 98 H CYS 13 H CYS 13 4.666 28.187 4.565 99 HA CYS 13 HA CYS 13 1.795 27.818 4.409 100 HB2 CYS 13 HB2 CYS 13 1.796 25.877 3.298 101 HB3 CYS 13 HB3 CYS 13 3.502 26.125 2.981 102 H GLY 14 H GLY 14 1.542 25.567 5.955 103 HA2 GLY 14 HA2 GLY 14 1.753 24.631 8.024 104 HA3 GLY 14 HA3 GLY 14 3.234 25.540 8.232 105 HA PRO 15 HA PRO 15 0.269 27.102 11.461 106 HB2 PRO 15 HB2 PRO 15 2.185 27.498 13.285 107 HB3 PRO 15 HB3 PRO 15 1.625 25.840 12.940 108 HG2 PRO 15 HG2 PRO 15 3.721 27.364 11.478 109 HG3 PRO 15 HG3 PRO 15 4.053 25.940 12.535 110 HD2 PRO 15 HD2 PRO 15 3.727 25.407 10.041 111 HD3 PRO 15 HD3 PRO 15 2.533 24.606 11.107 112 H GLY 16 H GLY 16 -0.146 28.937 10.521 113 HA2 GLY 16 HA2 GLY 16 -0.245 31.201 10.473 114 HA3 GLY 16 HA3 GLY 16 1.396 31.226 11.095 115 H GLY 17 H GLY 17 1.884 29.173 8.675 116 HA2 GLY 17 HA2 GLY 17 2.257 29.323 6.512 117 HA3 GLY 17 HA3 GLY 17 1.580 30.894 6.552 118 H LYS 18 H LYS 18 4.265 29.342 8.268 119 HA LYS 18 HA LYS 18 6.035 31.559 7.478 120 HB2 LYS 18 HB2 LYS 18 7.233 29.488 9.156 121 HB3 LYS 18 HB3 LYS 18 7.097 31.212 9.467 122 HG2 LYS 18 HG2 LYS 18 4.524 30.202 9.897 123 HG3 LYS 18 HG3 LYS 18 5.608 29.011 10.606 124 HD2 LYS 18 HD2 LYS 18 6.715 31.292 11.536 125 HD3 LYS 18 HD3 LYS 18 5.023 31.785 11.413 126 HE2 LYS 18 HE2 LYS 18 4.455 29.666 12.680 127 HE3 LYS 18 HE3 LYS 18 6.180 29.501 12.998 128 HZ1 LYS 18 HZ1 LYS 18 6.096 31.742 14.020 129 HZ2 LYS 18 HZ2 LYS 18 5.171 30.590 14.843 130 HZ3 LYS 18 HZ3 LYS 18 4.413 31.728 13.848 131 H GLY 19 H GLY 19 6.057 28.249 7.861 132 HA2 GLY 19 HA2 GLY 19 7.990 27.460 6.362 133 HA3 GLY 19 HA3 GLY 19 6.666 26.345 6.543 134 H ARG 20 H ARG 20 8.376 26.144 4.608 135 HA ARG 20 HA ARG 20 7.276 27.347 2.199 136 HB2 ARG 20 HB2 ARG 20 9.890 26.357 3.088 137 HB3 ARG 20 HB3 ARG 20 9.567 26.251 1.362 138 HG2 ARG 20 HG2 ARG 20 10.300 28.366 1.267 139 HG3 ARG 20 HG3 ARG 20 8.760 28.807 2.003 140 HD2 ARG 20 HD2 ARG 20 9.993 29.729 3.619 141 HD3 ARG 20 HD3 ARG 20 10.264 28.076 4.166 142 HE ARG 20 HE ARG 20 12.102 29.389 2.278 143 HH11 ARG 20 HH11 ARG 20 11.531 27.693 5.284 144 HH12 ARG 20 HH12 ARG 20 13.214 27.483 5.620 145 HH21 ARG 20 HH21 ARG 20 14.309 29.107 2.732 146 HH22 ARG 20 HH22 ARG 20 14.789 28.285 4.178 147 H CYS 21 H CYS 21 6.787 26.298 0.329 148 HA CYS 21 HA CYS 21 6.152 23.428 0.584 149 HB2 CYS 21 HB2 CYS 21 4.962 25.538 -1.233 150 HB3 CYS 21 HB3 CYS 21 4.498 23.844 -1.224 151 H PHE 22 H PHE 22 6.842 21.982 -0.930 152 HA PHE 22 HA PHE 22 8.459 23.030 -3.172 153 HB2 PHE 22 HB2 PHE 22 9.069 20.458 -1.710 154 HB3 PHE 22 HB3 PHE 22 10.092 21.331 -2.851 155 HD1 PHE 22 HD1 PHE 22 8.373 21.835 0.412 156 HD2 PHE 22 HD2 PHE 22 11.766 22.685 -2.013 157 HE1 PHE 22 HE1 PHE 22 9.372 23.105 2.264 158 HE2 PHE 22 HE2 PHE 22 12.776 23.953 -0.156 159 HZ PHE 22 HZ PHE 22 11.576 24.167 1.984 160 H GLY 23 H GLY 23 5.785 21.140 -2.319 161 HA2 GLY 23 HA2 GLY 23 5.472 20.284 -5.057 162 HA3 GLY 23 HA3 GLY 23 5.679 18.971 -3.911 163 HA PRO 24 HA PRO 24 1.139 19.899 -4.152 164 HB2 PRO 24 HB2 PRO 24 0.826 17.004 -4.050 165 HB3 PRO 24 HB3 PRO 24 0.284 18.137 -5.287 166 HG2 PRO 24 HG2 PRO 24 2.291 16.338 -5.676 167 HG3 PRO 24 HG3 PRO 24 2.182 17.884 -6.528 168 HD2 PRO 24 HD2 PRO 24 3.899 17.114 -4.211 169 HD3 PRO 24 HD3 PRO 24 4.277 18.158 -5.598 170 H SER 25 H SER 25 2.511 17.119 -2.383 171 HA SER 25 HA SER 25 1.035 18.021 0.003 172 HB2 SER 25 HB2 SER 25 1.302 15.365 -1.253 173 HB3 SER 25 HB3 SER 25 1.537 15.362 0.499 174 HG SER 25 HG SER 25 -0.503 16.543 0.587 175 H ILE 26 H ILE 26 3.560 19.090 -0.501 176 HA ILE 26 HA ILE 26 5.048 17.900 1.703 177 HB ILE 26 HB ILE 26 6.093 18.240 -1.054 178 HG12 ILE 26 HG12 ILE 26 6.295 16.018 0.878 179 HG13 ILE 26 HG13 ILE 26 5.137 16.127 -0.456 180 HG21 ILE 26 HG21 ILE 26 7.582 19.276 0.875 181 HG22 ILE 26 HG22 ILE 26 8.289 18.367 -0.457 182 HG23 ILE 26 HG23 ILE 26 8.005 17.580 1.094 183 HD11 ILE 26 HD11 ILE 26 6.751 15.754 -2.046 184 HD12 ILE 26 HD12 ILE 26 7.322 14.735 -0.731 185 HD13 ILE 26 HD13 ILE 26 8.063 16.309 -1.016 186 H CYS 27 H CYS 27 5.567 19.371 3.126 187 HA CYS 27 HA CYS 27 6.364 22.068 2.277 188 HB2 CYS 27 HB2 CYS 27 3.922 21.918 3.130 189 HB3 CYS 27 HB3 CYS 27 4.644 21.664 4.717 190 H CYS 28 H CYS 28 7.975 22.985 3.587 191 HA CYS 28 HA CYS 28 8.977 21.335 5.789 192 HB2 CYS 28 HB2 CYS 28 10.292 21.789 3.235 193 HB3 CYS 28 HB3 CYS 28 11.307 22.366 4.553 194 H GLY 29 H GLY 29 10.571 22.364 7.218 195 HA2 GLY 29 HA2 GLY 29 10.860 25.176 7.131 196 HA3 GLY 29 HA3 GLY 29 9.935 24.566 8.486 197 H ASP 30 H ASP 30 12.173 25.836 9.007 198 HA ASP 30 HA ASP 30 14.536 24.335 9.240 199 HB2 ASP 30 HB2 ASP 30 15.196 26.102 10.889 200 HB3 ASP 30 HB3 ASP 30 14.626 26.758 9.357 201 H GLU 31 H GLU 31 11.970 25.052 11.317 202 HA GLU 31 HA GLU 31 12.678 22.799 13.048 203 HB2 GLU 31 HB2 GLU 31 11.078 24.948 14.315 204 HB3 GLU 31 HB3 GLU 31 12.307 23.896 15.002 205 HG2 GLU 31 HG2 GLU 31 13.949 25.272 13.578 206 HG3 GLU 31 HG3 GLU 31 12.635 26.445 13.504 207 H LEU 32 H LEU 32 10.799 23.372 10.663 208 HA LEU 32 HA LEU 32 8.387 22.356 11.831 209 HB2 LEU 32 HB2 LEU 32 9.168 24.482 10.092 210 HB3 LEU 32 HB3 LEU 32 8.051 23.418 9.295 211 HG LEU 32 HG LEU 32 7.131 24.028 11.971 212 HD11 LEU 32 HD11 LEU 32 7.250 26.502 10.297 213 HD12 LEU 32 HD12 LEU 32 8.620 26.071 11.328 214 HD13 LEU 32 HD13 LEU 32 7.027 26.322 12.039 215 HD21 LEU 32 HD21 LEU 32 5.918 23.332 9.800 216 HD22 LEU 32 HD22 LEU 32 5.841 25.059 9.494 217 HD23 LEU 32 HD23 LEU 32 5.111 24.383 10.952 218 H GLY 33 H GLY 33 11.109 21.517 10.225 219 HA2 GLY 33 HA2 GLY 33 11.703 19.839 8.819 220 HA3 GLY 33 HA3 GLY 33 10.454 19.007 9.633 221 H CYS 34 H CYS 34 9.263 17.856 8.065 222 HA CYS 34 HA CYS 34 8.269 19.523 5.903 223 HB2 CYS 34 HB2 CYS 34 10.163 17.472 5.639 224 HB3 CYS 34 HB3 CYS 34 8.687 16.965 4.850 225 H PHE 35 H PHE 35 5.976 19.441 6.108 226 HA PHE 35 HA PHE 35 4.941 16.971 7.152 227 HB2 PHE 35 HB2 PHE 35 3.450 19.373 6.055 228 HB3 PHE 35 HB3 PHE 35 2.862 18.159 7.184 229 HD1 PHE 35 HD1 PHE 35 4.140 18.039 9.456 230 HD2 PHE 35 HD2 PHE 35 4.180 21.388 6.851 231 HE1 PHE 35 HE1 PHE 35 4.799 19.468 11.332 232 HE2 PHE 35 HE2 PHE 35 4.838 22.829 8.710 233 HZ PHE 35 HZ PHE 35 5.158 21.874 10.966 234 H VAL 36 H VAL 36 4.945 15.397 5.562 235 HA VAL 36 HA VAL 36 4.599 16.347 2.849 236 HB VAL 36 HB VAL 36 5.089 13.478 3.632 237 HG11 VAL 36 HG11 VAL 36 5.378 15.128 1.101 238 HG12 VAL 36 HG12 VAL 36 4.400 13.667 1.368 239 HG13 VAL 36 HG13 VAL 36 6.157 13.545 1.312 240 HG21 VAL 36 HG21 VAL 36 6.833 15.038 4.601 241 HG22 VAL 36 HG22 VAL 36 7.204 15.542 2.954 242 HG23 VAL 36 HG23 VAL 36 7.468 13.871 3.441 243 H GLY 37 H GLY 37 2.594 17.032 2.992 244 HA2 GLY 37 HA2 GLY 37 0.401 16.686 2.226 245 HA3 GLY 37 HA3 GLY 37 0.573 14.982 2.549 246 H THR 38 H THR 38 -0.768 17.858 3.520 247 HA THR 38 HA THR 38 -2.451 16.812 5.482 248 HB THR 38 HB THR 38 -0.881 16.683 7.173 249 HG1 THR 38 HG1 THR 38 -0.949 19.338 7.737 250 HG21 THR 38 HG21 THR 38 1.132 17.242 6.216 251 HG22 THR 38 HG22 THR 38 0.921 18.522 7.414 252 HG23 THR 38 HG23 THR 38 0.574 18.838 5.714 253 H ALA 39 H ALA 39 -3.825 18.842 6.541 254 HA ALA 39 HA ALA 39 -4.461 20.505 4.559 255 HB1 ALA 39 HB1 ALA 39 -4.693 20.833 7.535 256 HB2 ALA 39 HB2 ALA 39 -5.886 20.159 6.424 257 HB3 ALA 39 HB3 ALA 39 -5.502 21.879 6.368 258 H GLU 40 H GLU 40 -1.830 21.038 6.893 259 HA GLU 40 HA GLU 40 -1.591 23.820 6.434 260 HB2 GLU 40 HB2 GLU 40 0.039 21.683 7.677 261 HB3 GLU 40 HB3 GLU 40 0.924 23.090 7.106 262 HG2 GLU 40 HG2 GLU 40 0.408 24.104 9.001 263 HG3 GLU 40 HG3 GLU 40 -1.277 24.109 8.485 264 H ALA 41 H ALA 41 -0.663 21.020 4.612 265 HA ALA 41 HA ALA 41 1.178 22.522 3.002 266 HB1 ALA 41 HB1 ALA 41 1.504 20.097 3.888 267 HB2 ALA 41 HB2 ALA 41 1.986 20.497 2.238 268 HB3 ALA 41 HB3 ALA 41 0.462 19.659 2.534 269 H LEU 42 H LEU 42 -2.257 21.665 2.979 270 HA LEU 42 HA LEU 42 -2.758 21.112 0.415 271 HB2 LEU 42 HB2 LEU 42 -4.142 22.574 2.585 272 HB3 LEU 42 HB3 LEU 42 -4.803 22.754 0.971 273 HG LEU 42 HG LEU 42 -4.252 20.010 2.033 274 HD11 LEU 42 HD11 LEU 42 -5.906 20.002 3.522 275 HD12 LEU 42 HD12 LEU 42 -6.991 20.879 2.445 276 HD13 LEU 42 HD13 LEU 42 -5.845 21.764 3.452 277 HD21 LEU 42 HD21 LEU 42 -5.131 19.499 0.061 278 HD22 LEU 42 HD22 LEU 42 -5.524 21.188 -0.258 279 HD23 LEU 42 HD23 LEU 42 -6.663 20.168 0.621 280 H ARG 43 H ARG 43 -2.121 24.385 1.724 281 HA ARG 43 HA ARG 43 -2.642 25.725 -0.714 282 HB2 ARG 43 HB2 ARG 43 -1.927 27.618 0.352 283 HB3 ARG 43 HB3 ARG 43 -2.155 26.604 1.765 284 HG2 ARG 43 HG2 ARG 43 -0.089 27.354 2.260 285 HG3 ARG 43 HG3 ARG 43 0.401 26.013 1.223 286 HD2 ARG 43 HD2 ARG 43 1.489 28.260 0.766 287 HD3 ARG 43 HD3 ARG 43 0.772 27.435 -0.616 288 HE ARG 43 HE ARG 43 -0.659 29.191 -0.848 289 HH11 ARG 43 HH11 ARG 43 0.563 29.219 2.423 290 HH12 ARG 43 HH12 ARG 43 -0.185 30.729 2.820 291 HH21 ARG 43 HH21 ARG 43 -1.646 31.175 -0.322 292 HH22 ARG 43 HH22 ARG 43 -1.438 31.839 1.264 293 H CYS 44 H CYS 44 -0.468 23.583 0.093 294 HA CYS 44 HA CYS 44 1.779 24.463 -1.634 295 HB2 CYS 44 HB2 CYS 44 1.577 21.700 -0.432 296 HB3 CYS 44 HB3 CYS 44 2.979 22.419 -1.207 297 H GLN 45 H GLN 45 -1.176 23.506 -2.256 298 HA GLN 45 HA GLN 45 -0.768 21.569 -4.342 299 HB2 GLN 45 HB2 GLN 45 -2.979 22.472 -2.890 300 HB3 GLN 45 HB3 GLN 45 -3.279 23.010 -4.532 301 HG2 GLN 45 HG2 GLN 45 -2.847 20.673 -5.291 302 HG3 GLN 45 HG3 GLN 45 -2.785 20.199 -3.594 303 HE21 GLN 45 HE21 GLN 45 -4.788 21.074 -6.246 304 HE22 GLN 45 HE22 GLN 45 -6.308 20.812 -5.470 305 H GLU 46 H GLU 46 -0.584 24.999 -4.123 306 HA GLU 46 HA GLU 46 -1.114 25.377 -6.944 307 HB2 GLU 46 HB2 GLU 46 -1.682 27.042 -5.061 308 HB3 GLU 46 HB3 GLU 46 0.026 27.454 -5.092 309 HG2 GLU 46 HG2 GLU 46 -0.269 27.923 -7.559 310 HG3 GLU 46 HG3 GLU 46 -2.004 27.802 -7.275 311 H GLU 47 H GLU 47 1.408 24.169 -5.267 312 HA GLU 47 HA GLU 47 3.530 25.482 -6.729 313 HB2 GLU 47 HB2 GLU 47 3.485 24.212 -4.322 314 HB3 GLU 47 HB3 GLU 47 4.099 22.928 -5.356 315 HG2 GLU 47 HG2 GLU 47 5.411 25.470 -5.847 316 HG3 GLU 47 HG3 GLU 47 5.576 24.931 -4.176 317 H ASN 48 H ASN 48 1.180 23.443 -7.630 318 HA ASN 48 HA ASN 48 2.897 21.743 -9.267 319 HB2 ASN 48 HB2 ASN 48 0.366 21.356 -8.026 320 HB3 ASN 48 HB3 ASN 48 0.118 21.270 -9.768 321 HD21 ASN 48 HD21 ASN 48 2.636 20.240 -7.494 322 HD22 ASN 48 HD22 ASN 48 2.750 18.622 -8.089 323 H TYR 49 H TYR 49 0.737 24.469 -9.424 324 HA TYR 49 HA TYR 49 0.272 24.366 -12.238 325 HB2 TYR 49 HB2 TYR 49 0.149 26.778 -10.417 326 HB3 TYR 49 HB3 TYR 49 -0.615 26.609 -11.994 327 HD1 TYR 49 HD1 TYR 49 -2.178 24.389 -12.134 328 HD2 TYR 49 HD2 TYR 49 -1.208 26.530 -8.597 329 HE1 TYR 49 HE1 TYR 49 -4.188 23.485 -11.042 330 HE2 TYR 49 HE2 TYR 49 -3.211 25.637 -7.489 331 HH TYR 49 HH TYR 49 -4.708 23.224 -8.073 332 H LEU 50 H LEU 50 3.183 24.580 -10.909 333 HA LEU 50 HA LEU 50 4.174 26.410 -12.986 334 HB2 LEU 50 HB2 LEU 50 5.025 26.232 -10.105 335 HB3 LEU 50 HB3 LEU 50 6.034 26.963 -11.337 336 HG LEU 50 HG LEU 50 3.313 28.033 -11.307 337 HD11 LEU 50 HD11 LEU 50 3.255 29.035 -9.237 338 HD12 LEU 50 HD12 LEU 50 4.992 28.861 -8.984 339 HD13 LEU 50 HD13 LEU 50 3.935 27.457 -8.842 340 HD21 LEU 50 HD21 LEU 50 4.738 30.166 -11.122 341 HD22 LEU 50 HD22 LEU 50 4.872 29.197 -12.590 342 HD23 LEU 50 HD23 LEU 50 6.117 29.091 -11.346 343 HA PRO 51 HA PRO 51 6.583 22.702 -13.793 344 HB2 PRO 51 HB2 PRO 51 7.573 23.430 -16.172 345 HB3 PRO 51 HB3 PRO 51 5.868 23.003 -15.977 346 HG2 PRO 51 HG2 PRO 51 7.137 25.706 -16.152 347 HG3 PRO 51 HG3 PRO 51 5.637 25.123 -16.894 348 HD2 PRO 51 HD2 PRO 51 5.753 26.619 -14.583 349 HD3 PRO 51 HD3 PRO 51 4.410 25.545 -15.015 350 H SER 52 H SER 52 7.702 24.426 -11.913 351 HA SER 52 HA SER 52 10.512 24.369 -12.718 352 HB2 SER 52 HB2 SER 52 10.890 26.571 -11.604 353 HB3 SER 52 HB3 SER 52 9.870 26.685 -13.038 354 HG SER 52 HG SER 52 9.003 26.646 -10.336 355 HA PRO 53 HA PRO 53 11.073 22.703 -8.667 356 HB2 PRO 53 HB2 PRO 53 13.778 23.620 -8.433 357 HB3 PRO 53 HB3 PRO 53 13.206 22.040 -8.968 358 HG2 PRO 53 HG2 PRO 53 14.484 23.877 -10.584 359 HG3 PRO 53 HG3 PRO 53 13.436 22.574 -11.169 360 HD2 PRO 53 HD2 PRO 53 12.816 25.472 -10.762 361 HD3 PRO 53 HD3 PRO 53 12.301 24.377 -12.064 362 H CYS 54 H CYS 54 12.722 23.397 -6.628 363 HA CYS 54 HA CYS 54 12.408 26.124 -5.796 364 HB2 CYS 54 HB2 CYS 54 10.182 24.646 -5.365 365 HB3 CYS 54 HB3 CYS 54 11.074 24.249 -3.906 366 H GLN 55 H GLN 55 14.258 26.592 -4.512 367 HA GLN 55 HA GLN 55 16.181 24.672 -3.962 368 HB2 GLN 55 HB2 GLN 55 17.290 26.164 -2.589 369 HB3 GLN 55 HB3 GLN 55 16.309 27.232 -3.574 370 HG2 GLN 55 HG2 GLN 55 15.442 28.101 -1.702 371 HG3 GLN 55 HG3 GLN 55 14.744 26.537 -1.320 372 HE21 GLN 55 HE21 GLN 55 15.011 26.764 0.874 373 HE22 GLN 55 HE22 GLN 55 16.557 26.725 1.644 374 H SER 56 H SER 56 16.973 24.634 -1.419 375 HA SER 56 HA SER 56 15.250 24.035 0.643 376 HB2 SER 56 HB2 SER 56 15.380 21.487 0.554 377 HB3 SER 56 HB3 SER 56 14.320 22.215 -0.650 378 HG SER 56 HG SER 56 15.839 20.547 -1.414 379 H GLY 57 H GLY 57 16.592 22.003 1.854 380 HA2 GLY 57 HA2 GLY 57 19.095 23.249 2.469 381 HA3 GLY 57 HA3 GLY 57 18.503 21.782 3.238 382 H GLN 58 H GLN 58 21.207 22.324 2.278 383 HA GLN 58 HA GLN 58 21.377 20.436 0.054 384 HB2 GLN 58 HB2 GLN 58 23.582 22.170 1.171 385 HB3 GLN 58 HB3 GLN 58 23.640 21.215 -0.302 386 HG2 GLN 58 HG2 GLN 58 21.760 23.520 0.145 387 HG3 GLN 58 HG3 GLN 58 23.325 23.653 -0.654 388 HE21 GLN 58 HE21 GLN 58 23.622 22.081 -2.505 389 HE22 GLN 58 HE22 GLN 58 22.278 21.885 -3.573 390 H LYS 59 H LYS 59 20.795 18.793 1.500 391 HA LYS 59 HA LYS 59 23.174 17.585 2.787 392 HB2 LYS 59 HB2 LYS 59 21.103 18.711 4.282 393 HB3 LYS 59 HB3 LYS 59 20.635 17.022 4.186 394 HG2 LYS 59 HG2 LYS 59 21.945 16.703 5.954 395 HG3 LYS 59 HG3 LYS 59 23.312 16.919 4.857 396 HD2 LYS 59 HD2 LYS 59 22.091 19.406 5.849 397 HD3 LYS 59 HD3 LYS 59 22.885 18.416 7.075 398 HE2 LYS 59 HE2 LYS 59 24.190 19.184 4.475 399 HE3 LYS 59 HE3 LYS 59 24.335 20.145 5.946 400 HZ1 LYS 59 HZ1 LYS 59 25.855 18.759 6.746 401 HZ2 LYS 59 HZ2 LYS 59 25.919 18.037 5.218 402 HZ3 LYS 59 HZ3 LYS 59 24.914 17.391 6.416 403 HA PRO 60 HA PRO 60 20.547 15.243 -0.262 404 HB2 PRO 60 HB2 PRO 60 22.613 14.536 -1.896 405 HB3 PRO 60 HB3 PRO 60 21.607 15.970 -2.124 406 HG2 PRO 60 HG2 PRO 60 24.308 15.731 -0.863 407 HG3 PRO 60 HG3 PRO 60 23.686 16.987 -1.951 408 HD2 PRO 60 HD2 PRO 60 23.854 17.365 0.709 409 HD3 PRO 60 HD3 PRO 60 22.539 18.065 -0.254 410 H CYS 61 H CYS 61 20.416 13.928 1.606 411 HA CYS 61 HA CYS 61 22.205 11.607 1.598 412 HB2 CYS 61 HB2 CYS 61 21.691 11.241 3.796 413 HB3 CYS 61 HB3 CYS 61 21.324 12.960 3.769 414 H GLY 62 H GLY 62 20.539 9.542 2.229 415 HA2 GLY 62 HA2 GLY 62 18.811 8.243 1.402 416 HA3 GLY 62 HA3 GLY 62 18.036 9.737 0.885 417 H SER 63 H SER 63 17.438 8.288 -0.931 418 HA SER 63 HA SER 63 19.579 7.589 -2.766 419 HB2 SER 63 HB2 SER 63 17.689 6.723 -4.215 420 HB3 SER 63 HB3 SER 63 17.839 5.963 -2.631 421 HG SER 63 HG SER 63 15.670 6.542 -3.164 422 H GLY 64 H GLY 64 19.414 10.280 -2.316 423 HA2 GLY 64 HA2 GLY 64 20.015 11.824 -4.154 424 HA3 GLY 64 HA3 GLY 64 18.509 11.340 -4.913 425 H GLY 65 H GLY 65 18.124 11.674 -1.514 426 HA2 GLY 65 HA2 GLY 65 16.773 14.235 -2.018 427 HA3 GLY 65 HA3 GLY 65 16.413 13.129 -0.718 428 H ARG 66 H ARG 66 17.265 16.080 -1.113 429 HA ARG 66 HA ARG 66 19.437 16.186 0.818 430 HB2 ARG 66 HB2 ARG 66 19.388 18.663 0.307 431 HB3 ARG 66 HB3 ARG 66 19.891 17.618 -1.009 432 HG2 ARG 66 HG2 ARG 66 17.023 18.096 -0.973 433 HG3 ARG 66 HG3 ARG 66 17.969 19.578 -1.129 434 HD2 ARG 66 HD2 ARG 66 18.490 17.151 -2.821 435 HD3 ARG 66 HD3 ARG 66 17.314 18.382 -3.280 436 HE ARG 66 HE ARG 66 19.573 19.802 -2.779 437 HH11 ARG 66 HH11 ARG 66 18.836 17.068 -4.816 438 HH12 ARG 66 HH12 ARG 66 20.028 17.473 -6.005 439 HH21 ARG 66 HH21 ARG 66 21.143 20.337 -4.337 440 HH22 ARG 66 HH22 ARG 66 21.339 19.330 -5.733 441 H CYS 67 H CYS 67 19.258 17.563 2.774 442 HA CYS 67 HA CYS 67 16.766 17.167 4.045 443 HB2 CYS 67 HB2 CYS 67 19.302 18.561 4.779 444 HB3 CYS 67 HB3 CYS 67 17.859 18.985 5.682 445 H ALA 68 H ALA 68 14.971 18.231 3.420 446 HA ALA 68 HA ALA 68 15.150 20.975 2.427 447 HB1 ALA 68 HB1 ALA 68 12.917 18.990 2.653 448 HB2 ALA 68 HB2 ALA 68 13.483 19.885 1.242 449 HB3 ALA 68 HB3 ALA 68 12.541 20.705 2.486 450 H ALA 69 H ALA 69 14.927 19.346 5.231 451 HA ALA 69 HA ALA 69 14.796 21.549 6.932 452 HB1 ALA 69 HB1 ALA 69 12.529 21.519 6.719 453 HB2 ALA 69 HB2 ALA 69 12.819 20.653 8.209 454 HB3 ALA 69 HB3 ALA 69 12.414 19.777 6.735 455 H ALA 70 H ALA 70 15.027 20.892 9.172 456 HA ALA 70 HA ALA 70 17.033 19.530 10.036 457 HB1 ALA 70 HB1 ALA 70 14.746 20.328 11.254 458 HB2 ALA 70 HB2 ALA 70 16.133 19.606 12.071 459 HB3 ALA 70 HB3 ALA 70 14.753 18.604 11.607 460 H GLY 71 H GLY 71 15.643 17.149 11.519 461 HA2 GLY 71 HA2 GLY 71 16.821 15.112 9.933 462 HA3 GLY 71 HA3 GLY 71 15.747 14.827 11.304 463 H ILE 72 H ILE 72 15.667 16.002 8.011 464 HA ILE 72 HA ILE 72 13.602 14.184 7.264 465 HB ILE 72 HB ILE 72 11.867 15.529 6.701 466 HG12 ILE 72 HG12 ILE 72 12.321 18.161 6.830 467 HG13 ILE 72 HG13 ILE 72 13.919 17.621 6.343 468 HG21 ILE 72 HG21 ILE 72 11.210 16.681 8.602 469 HG22 ILE 72 HG22 ILE 72 12.847 17.230 8.958 470 HG23 ILE 72 HG23 ILE 72 12.411 15.540 9.204 471 HD11 ILE 72 HD11 ILE 72 11.387 16.855 4.991 472 HD12 ILE 72 HD12 ILE 72 13.018 16.502 4.437 473 HD13 ILE 72 HD13 ILE 72 12.434 18.162 4.449 474 H CYS 73 H CYS 73 14.722 13.320 5.650 475 HA CYS 73 HA CYS 73 16.257 15.051 3.885 476 HB2 CYS 73 HB2 CYS 73 16.555 12.385 4.819 477 HB3 CYS 73 HB3 CYS 73 16.367 12.311 3.074 478 H CYS 74 H CYS 74 14.475 16.059 2.864 479 HA CYS 74 HA CYS 74 12.666 14.411 1.359 480 HB2 CYS 74 HB2 CYS 74 12.696 17.121 2.274 481 HB3 CYS 74 HB3 CYS 74 12.404 17.097 0.537 482 H SER 75 H SER 75 12.663 14.006 -0.738 483 HA SER 75 HA SER 75 15.023 14.855 -2.272 484 HB2 SER 75 HB2 SER 75 13.150 12.572 -2.938 485 HB3 SER 75 HB3 SER 75 14.780 12.845 -3.545 486 HG SER 75 HG SER 75 13.952 11.688 -1.196 487 HA PRO 76 HA PRO 76 12.399 16.920 -5.173 488 HB2 PRO 76 HB2 PRO 76 13.160 16.199 -7.642 489 HB3 PRO 76 HB3 PRO 76 14.244 17.092 -6.566 490 HG2 PRO 76 HG2 PRO 76 14.196 14.174 -7.214 491 HG3 PRO 76 HG3 PRO 76 15.586 15.256 -7.016 492 HD2 PRO 76 HD2 PRO 76 14.656 13.529 -5.079 493 HD3 PRO 76 HD3 PRO 76 15.615 14.984 -4.746 494 H ASP 77 H ASP 77 11.530 14.146 -4.280 495 HA ASP 77 HA ASP 77 9.257 13.935 -6.073 496 HB2 ASP 77 HB2 ASP 77 10.799 11.451 -5.303 497 HB3 ASP 77 HB3 ASP 77 9.476 11.591 -6.458 498 H GLY 78 H GLY 78 10.852 12.874 -3.075 499 HA2 GLY 78 HA2 GLY 78 8.293 13.119 -1.715 500 HA3 GLY 78 HA3 GLY 78 9.066 11.560 -1.606 501 H CYS 79 H CYS 79 9.708 11.391 0.431 502 HA CYS 79 HA CYS 79 11.708 13.259 1.405 503 HB2 CYS 79 HB2 CYS 79 9.064 13.477 2.264 504 HB3 CYS 79 HB3 CYS 79 9.879 12.612 3.562 505 H HIS 80 H HIS 80 12.988 12.391 3.231 506 HA HIS 80 HA HIS 80 12.620 9.493 3.660 507 HB2 HIS 80 HB2 HIS 80 14.177 9.984 1.710 508 HB3 HIS 80 HB3 HIS 80 15.274 10.706 2.876 509 HD1 HIS 80 HD1 HIS 80 16.178 8.347 1.202 510 HD2 HIS 80 HD2 HIS 80 14.481 7.944 4.967 511 HE1 HIS 80 HE1 HIS 80 16.988 6.134 2.070 512 HE2 HIS 80 HE2 HIS 80 16.024 5.958 4.391 513 H GLU 81 H GLU 81 13.067 8.865 5.675 514 HA GLU 81 HA GLU 81 13.547 10.700 7.730 515 HB2 GLU 81 HB2 GLU 81 14.083 7.730 7.746 516 HB3 GLU 81 HB3 GLU 81 13.851 8.752 9.161 517 HG2 GLU 81 HG2 GLU 81 11.626 8.727 8.967 518 HG3 GLU 81 HG3 GLU 81 11.684 8.879 7.215 519 H ASP 82 H ASP 82 15.312 11.604 8.470 520 HA ASP 82 HA ASP 82 17.902 10.346 8.029 521 HB2 ASP 82 HB2 ASP 82 18.233 11.619 6.209 522 HB3 ASP 82 HB3 ASP 82 16.874 12.680 6.573 523 HA PRO 83 HA PRO 83 17.980 12.154 12.150 524 HB2 PRO 83 HB2 PRO 83 20.127 10.408 12.847 525 HB3 PRO 83 HB3 PRO 83 18.424 10.262 13.282 526 HG2 PRO 83 HG2 PRO 83 19.794 8.538 11.599 527 HG3 PRO 83 HG3 PRO 83 18.033 8.717 11.665 528 HD2 PRO 83 HD2 PRO 83 19.988 9.873 9.724 529 HD3 PRO 83 HD3 PRO 83 18.340 9.267 9.448 530 H ALA 84 H ALA 84 20.314 12.292 9.719 531 HA ALA 84 HA ALA 84 22.520 13.302 11.172 532 HB1 ALA 84 HB1 ALA 84 21.822 13.810 8.284 533 HB2 ALA 84 HB2 ALA 84 22.693 12.397 8.882 534 HB3 ALA 84 HB3 ALA 84 23.406 14.004 9.035 535 H CYS 85 H CYS 85 19.685 14.801 9.761 536 HA CYS 85 HA CYS 85 20.643 17.452 10.507 537 HB2 CYS 85 HB2 CYS 85 18.167 16.571 9.015 538 HB3 CYS 85 HB3 CYS 85 18.551 18.249 9.373 539 H ASP 86 H ASP 86 20.350 16.019 12.748 540 HA ASP 86 HA ASP 86 17.826 16.959 13.868 541 HB2 ASP 86 HB2 ASP 86 19.407 14.469 14.313 542 HB3 ASP 86 HB3 ASP 86 18.487 15.130 15.661 543 HA PRO 87 HA PRO 87 21.418 18.757 16.421 544 HB2 PRO 87 HB2 PRO 87 21.719 21.188 14.976 545 HB3 PRO 87 HB3 PRO 87 22.912 19.896 15.107 546 HG2 PRO 87 HG2 PRO 87 21.557 20.669 12.789 547 HG3 PRO 87 HG3 PRO 87 22.474 19.172 13.009 548 HD2 PRO 87 HD2 PRO 87 19.538 19.627 13.085 549 HD3 PRO 87 HD3 PRO 87 20.459 18.194 12.603 550 H GLU 88 H GLU 88 19.198 18.572 16.995 551 HA GLU 88 HA GLU 88 18.253 20.841 18.338 552 HB2 GLU 88 HB2 GLU 88 16.462 21.747 17.085 553 HB3 GLU 88 HB3 GLU 88 17.783 21.529 15.947 554 HG2 GLU 88 HG2 GLU 88 16.765 19.780 14.866 555 HG3 GLU 88 HG3 GLU 88 15.731 19.397 16.235 556 H ALA 89 H ALA 89 17.503 17.991 16.755 557 HA ALA 89 HA ALA 89 15.177 17.115 18.115 558 HB1 ALA 89 HB1 ALA 89 16.957 16.252 15.951 559 HB2 ALA 89 HB2 ALA 89 15.224 15.942 16.205 560 HB3 ALA 89 HB3 ALA 89 16.420 14.904 16.979 561 H ALA 90 H ALA 90 16.757 17.845 20.043 562 HA ALA 90 HA ALA 90 18.432 15.935 21.318 563 HB1 ALA 90 HB1 ALA 90 18.209 18.566 21.580 564 HB2 ALA 90 HB2 ALA 90 18.807 17.539 22.883 565 HB3 ALA 90 HB3 ALA 90 17.129 18.081 22.887 566 H PHE 91 H PHE 91 17.932 14.282 22.268 567 HA PHE 91 HA PHE 91 15.325 13.354 22.728 568 HB2 PHE 91 HB2 PHE 91 16.596 11.396 23.802 569 HB3 PHE 91 HB3 PHE 91 16.907 11.739 22.107 570 HD1 PHE 91 HD1 PHE 91 18.270 12.230 25.530 571 HD2 PHE 91 HD2 PHE 91 19.088 12.152 21.352 572 HE1 PHE 91 HE1 PHE 91 20.685 12.334 26.002 573 HE2 PHE 91 HE2 PHE 91 21.502 12.258 21.820 574 HZ PHE 91 HZ PHE 91 22.302 12.349 24.146 575 H SER 92 H SER 92 14.077 13.291 24.393 576 HA SER 92 HA SER 92 14.911 14.500 26.902 577 HB2 SER 92 HB2 SER 92 12.771 15.137 25.727 578 HB3 SER 92 HB3 SER 92 12.162 13.524 26.099 579 HG SER 92 HG SER 92 13.034 15.448 27.995 580 H1 ALA 101 H1 ALA 101 -1.661 -10.121 13.090 581 H2 ALA 101 H2 ALA 101 -2.909 -8.953 12.929 582 H3 ALA 101 H3 ALA 101 -3.255 -10.496 13.593 583 HA ALA 101 HA ALA 101 -2.789 -9.834 15.569 584 HB1 ALA 101 HB1 ALA 101 -0.316 -10.103 14.538 585 HB2 ALA 101 HB2 ALA 101 -0.648 -9.673 16.214 586 HB3 ALA 101 HB3 ALA 101 -0.275 -8.412 15.039 587 H VAL 102 H VAL 102 -1.955 -7.747 16.871 588 HA VAL 102 HA VAL 102 -3.732 -5.707 15.952 589 HB VAL 102 HB VAL 102 -2.179 -5.591 18.514 590 HG11 VAL 102 HG11 VAL 102 -4.035 -4.045 19.179 591 HG12 VAL 102 HG12 VAL 102 -4.614 -4.110 17.514 592 HG13 VAL 102 HG13 VAL 102 -3.023 -3.437 17.869 593 HG21 VAL 102 HG21 VAL 102 -5.055 -6.367 18.414 594 HG22 VAL 102 HG22 VAL 102 -3.836 -6.709 19.643 595 HG23 VAL 102 HG23 VAL 102 -3.820 -7.589 18.115 596 H LEU 103 H LEU 103 -0.482 -6.288 15.763 597 HA LEU 103 HA LEU 103 0.074 -3.844 14.365 598 HB2 LEU 103 HB2 LEU 103 2.342 -4.083 15.820 599 HB3 LEU 103 HB3 LEU 103 1.049 -3.014 16.324 600 HG LEU 103 HG LEU 103 0.239 -4.962 17.786 601 HD11 LEU 103 HD11 LEU 103 1.399 -6.824 17.010 602 HD12 LEU 103 HD12 LEU 103 2.246 -6.397 18.496 603 HD13 LEU 103 HD13 LEU 103 2.933 -5.957 16.933 604 HD21 LEU 103 HD21 LEU 103 2.770 -4.294 18.994 605 HD22 LEU 103 HD22 LEU 103 1.141 -3.782 19.438 606 HD23 LEU 103 HD23 LEU 103 2.045 -2.887 18.222 607 H ASP 104 H ASP 104 0.752 -4.809 12.553 608 HA ASP 104 HA ASP 104 2.795 -6.602 12.358 609 HB2 ASP 104 HB2 ASP 104 0.155 -7.850 12.522 610 HB3 ASP 104 HB3 ASP 104 0.967 -8.223 11.005 611 H LEU 105 H LEU 105 0.341 -7.118 10.097 612 HA LEU 105 HA LEU 105 0.982 -4.792 8.532 613 HB2 LEU 105 HB2 LEU 105 2.359 -6.777 7.766 614 HB3 LEU 105 HB3 LEU 105 0.846 -7.530 7.308 615 HG LEU 105 HG LEU 105 0.481 -5.974 5.553 616 HD11 LEU 105 HD11 LEU 105 1.361 -4.016 7.030 617 HD12 LEU 105 HD12 LEU 105 1.502 -3.919 5.275 618 HD13 LEU 105 HD13 LEU 105 2.903 -4.366 6.246 619 HD21 LEU 105 HD21 LEU 105 2.117 -7.671 5.010 620 HD22 LEU 105 HD22 LEU 105 3.413 -6.665 5.656 621 HD23 LEU 105 HD23 LEU 105 2.538 -6.156 4.213 622 H ASP 106 H ASP 106 -1.184 -6.281 10.108 623 HA ASP 106 HA ASP 106 -3.472 -6.217 8.310 624 HB2 ASP 106 HB2 ASP 106 -2.916 -7.644 10.657 625 HB3 ASP 106 HB3 ASP 106 -4.049 -6.402 11.181 626 H VAL 107 H VAL 107 -2.437 -4.820 11.408 627 HA VAL 107 HA VAL 107 -2.491 -2.310 10.216 628 HB VAL 107 HB VAL 107 -4.850 -2.243 10.690 629 HG11 VAL 107 HG11 VAL 107 -4.052 -3.487 13.228 630 HG12 VAL 107 HG12 VAL 107 -5.481 -3.750 12.231 631 HG13 VAL 107 HG13 VAL 107 -5.396 -2.348 13.300 632 HG21 VAL 107 HG21 VAL 107 -3.638 -0.167 11.119 633 HG22 VAL 107 HG22 VAL 107 -3.391 -0.653 12.793 634 HG23 VAL 107 HG23 VAL 107 -5.019 -0.327 12.198 635 H ARG 108 H ARG 108 -0.395 -1.748 11.170 636 HA ARG 108 HA ARG 108 0.150 -3.031 13.659 637 HB2 ARG 108 HB2 ARG 108 1.823 -2.315 11.663 638 HB3 ARG 108 HB3 ARG 108 2.075 -1.012 12.809 639 HG2 ARG 108 HG2 ARG 108 2.085 -3.510 14.167 640 HG3 ARG 108 HG3 ARG 108 3.179 -3.595 12.803 641 HD2 ARG 108 HD2 ARG 108 4.586 -2.781 14.396 642 HD3 ARG 108 HD3 ARG 108 3.981 -1.273 13.728 643 HE ARG 108 HE ARG 108 2.273 -1.622 15.715 644 HH11 ARG 108 HH11 ARG 108 5.744 -2.017 15.666 645 HH12 ARG 108 HH12 ARG 108 5.933 -1.653 17.348 646 HH21 ARG 108 HH21 ARG 108 2.534 -1.117 17.929 647 HH22 ARG 108 HH22 ARG 108 4.118 -1.147 18.630 648 H THR 109 H THR 109 -0.552 -2.158 15.576 649 HA THR 109 HA THR 109 -1.642 0.463 15.402 650 HB THR 109 HB THR 109 -2.397 -0.926 17.218 651 HG1 THR 109 HG1 THR 109 -1.216 1.472 17.753 652 HG21 THR 109 HG21 THR 109 -0.567 -2.366 17.634 653 HG22 THR 109 HG22 THR 109 -0.900 -1.489 19.126 654 HG23 THR 109 HG23 THR 109 0.467 -1.022 18.116 655 H CYS 110 H CYS 110 -0.435 2.005 14.702 656 HA CYS 110 HA CYS 110 2.330 2.362 15.428 657 HB2 CYS 110 HB2 CYS 110 0.533 4.059 13.711 658 HB3 CYS 110 HB3 CYS 110 2.249 4.324 13.933 659 H LEU 111 H LEU 111 2.901 3.271 17.365 660 HA LEU 111 HA LEU 111 1.502 4.514 19.254 661 HB2 LEU 111 HB2 LEU 111 4.159 5.427 18.167 662 HB3 LEU 111 HB3 LEU 111 3.453 6.100 19.623 663 HG LEU 111 HG LEU 111 3.862 3.143 19.416 664 HD11 LEU 111 HD11 LEU 111 6.037 3.624 18.950 665 HD12 LEU 111 HD12 LEU 111 6.084 3.826 20.701 666 HD13 LEU 111 HD13 LEU 111 5.948 5.238 19.653 667 HD21 LEU 111 HD21 LEU 111 3.119 5.080 21.436 668 HD22 LEU 111 HD22 LEU 111 4.497 4.105 21.946 669 HD23 LEU 111 HD23 LEU 111 2.994 3.321 21.460 670 HA PRO 112 HA PRO 112 -0.641 7.998 17.496 671 HB2 PRO 112 HB2 PRO 112 -1.170 9.341 19.813 672 HB3 PRO 112 HB3 PRO 112 -2.089 7.941 19.249 673 HG2 PRO 112 HG2 PRO 112 0.116 8.084 21.264 674 HG3 PRO 112 HG3 PRO 112 -1.391 7.153 21.319 675 HD2 PRO 112 HD2 PRO 112 0.960 6.013 20.682 676 HD3 PRO 112 HD3 PRO 112 -0.567 5.499 19.937 677 H CYS 113 H CYS 113 -0.429 10.223 17.076 678 HA CYS 113 HA CYS 113 1.553 11.790 18.412 679 HB2 CYS 113 HB2 CYS 113 3.353 11.514 17.117 680 HB3 CYS 113 HB3 CYS 113 2.493 10.258 16.247 681 H GLY 114 H GLY 114 1.978 13.826 16.655 682 HA2 GLY 114 HA2 GLY 114 1.066 15.574 15.500 683 HA3 GLY 114 HA3 GLY 114 -0.351 14.588 15.210 684 HA PRO 115 HA PRO 115 -1.727 18.187 17.804 685 HB2 PRO 115 HB2 PRO 115 -4.131 18.341 16.638 686 HB3 PRO 115 HB3 PRO 115 -2.687 18.950 15.786 687 HG2 PRO 115 HG2 PRO 115 -3.701 16.150 15.817 688 HG3 PRO 115 HG3 PRO 115 -3.753 17.236 14.373 689 HD2 PRO 115 HD2 PRO 115 -1.677 15.728 14.539 690 HD3 PRO 115 HD3 PRO 115 -1.294 17.474 14.553 691 H GLY 116 H GLY 116 -1.832 16.998 19.562 692 HA2 GLY 116 HA2 GLY 116 -3.070 16.330 21.412 693 HA3 GLY 116 HA3 GLY 116 -4.382 15.985 20.311 694 H GLY 117 H GLY 117 -1.663 14.575 19.031 695 HA2 GLY 117 HA2 GLY 117 -0.801 12.559 19.125 696 HA3 GLY 117 HA3 GLY 117 -1.546 12.435 20.676 697 H LYS 118 H LYS 118 -3.147 12.884 17.588 698 HA LYS 118 HA LYS 118 -4.674 10.435 18.086 699 HB2 LYS 118 HB2 LYS 118 -5.339 11.727 15.606 700 HB3 LYS 118 HB3 LYS 118 -6.353 11.480 17.016 701 HG2 LYS 118 HG2 LYS 118 -4.744 13.609 17.733 702 HG3 LYS 118 HG3 LYS 118 -5.064 13.882 16.022 703 HD2 LYS 118 HD2 LYS 118 -7.528 13.215 16.857 704 HD3 LYS 118 HD3 LYS 118 -6.887 13.926 18.340 705 HE2 LYS 118 HE2 LYS 118 -6.169 15.895 16.902 706 HE3 LYS 118 HE3 LYS 118 -7.182 15.205 15.635 707 HZ1 LYS 118 HZ1 LYS 118 -8.627 16.633 16.664 708 HZ2 LYS 118 HZ2 LYS 118 -7.972 16.389 18.205 709 HZ3 LYS 118 HZ3 LYS 118 -8.960 15.205 17.509 710 H GLY 119 H GLY 119 -2.255 11.802 16.054 711 HA2 GLY 119 HA2 GLY 119 -2.575 9.932 13.932 712 HA3 GLY 119 HA3 GLY 119 -1.344 11.154 14.059 713 H ARG 120 H ARG 120 -1.218 8.931 13.164 714 HA ARG 120 HA ARG 120 0.379 7.114 14.850 715 HB2 ARG 120 HB2 ARG 120 -1.095 6.767 12.388 716 HB3 ARG 120 HB3 ARG 120 0.246 5.642 12.603 717 HG2 ARG 120 HG2 ARG 120 -1.164 4.412 13.835 718 HG3 ARG 120 HG3 ARG 120 -1.079 5.687 15.053 719 HD2 ARG 120 HD2 ARG 120 -3.290 5.844 14.775 720 HD3 ARG 120 HD3 ARG 120 -2.893 6.700 13.286 721 HE ARG 120 HE ARG 120 -3.349 3.791 13.339 722 HH11 ARG 120 HH11 ARG 120 -4.007 6.952 11.991 723 HH12 ARG 120 HH12 ARG 120 -4.978 6.328 10.703 724 HH21 ARG 120 HH21 ARG 120 -4.627 2.986 11.647 725 HH22 ARG 120 HH22 ARG 120 -5.332 4.084 10.508 726 H CYS 121 H CYS 121 2.406 6.373 14.671 727 HA CYS 121 HA CYS 121 4.207 7.866 12.873 728 HB2 CYS 121 HB2 CYS 121 4.786 6.470 15.500 729 HB3 CYS 121 HB3 CYS 121 5.983 7.302 14.520 730 H PHE 122 H PHE 122 5.629 6.814 11.566 731 HA PHE 122 HA PHE 122 5.634 3.859 11.657 732 HB2 PHE 122 HB2 PHE 122 5.833 5.472 9.111 733 HB3 PHE 122 HB3 PHE 122 5.536 3.742 9.284 734 HD1 PHE 122 HD1 PHE 122 4.059 7.011 10.287 735 HD2 PHE 122 HD2 PHE 122 3.362 2.978 9.116 736 HE1 PHE 122 HE1 PHE 122 1.637 7.418 10.339 737 HE2 PHE 122 HE2 PHE 122 0.932 3.385 9.160 738 HZ PHE 122 HZ PHE 122 0.068 5.608 9.774 739 H GLY 123 H GLY 123 7.550 6.646 11.813 740 HA2 GLY 123 HA2 GLY 123 9.948 5.041 11.769 741 HA3 GLY 123 HA3 GLY 123 9.849 6.223 10.474 742 HA PRO 124 HA PRO 124 11.848 8.304 14.108 743 HB2 PRO 124 HB2 PRO 124 13.576 9.520 12.100 744 HB3 PRO 124 HB3 PRO 124 14.014 8.524 13.487 745 HG2 PRO 124 HG2 PRO 124 14.233 7.683 10.909 746 HG3 PRO 124 HG3 PRO 124 13.968 6.593 12.275 747 HD2 PRO 124 HD2 PRO 124 12.027 7.599 10.253 748 HD3 PRO 124 HD3 PRO 124 12.126 6.005 11.019 749 H SER 125 H SER 125 11.568 9.785 10.872 750 HA SER 125 HA SER 125 10.301 12.121 12.148 751 HB2 SER 125 HB2 SER 125 12.465 11.903 10.154 752 HB3 SER 125 HB3 SER 125 11.223 13.090 9.745 753 HG SER 125 HG SER 125 11.560 13.898 11.951 754 H ILE 126 H ILE 126 8.708 9.951 11.416 755 HA ILE 126 HA ILE 126 7.186 11.152 9.237 756 HB ILE 126 HB ILE 126 8.166 8.312 9.290 757 HG12 ILE 126 HG12 ILE 126 8.176 10.470 7.188 758 HG13 ILE 126 HG13 ILE 126 9.550 10.023 8.199 759 HG21 ILE 126 HG21 ILE 126 6.552 7.547 7.892 760 HG22 ILE 126 HG22 ILE 126 6.263 9.130 7.174 761 HG23 ILE 126 HG23 ILE 126 5.585 8.741 8.753 762 HD11 ILE 126 HD11 ILE 126 8.495 7.712 6.854 763 HD12 ILE 126 HD12 ILE 126 10.111 8.401 6.793 764 HD13 ILE 126 HD13 ILE 126 8.868 8.987 5.696 765 H CYS 127 H CYS 127 5.171 11.458 9.819 766 HA CYS 127 HA CYS 127 3.797 9.475 11.495 767 HB2 CYS 127 HB2 CYS 127 4.595 11.553 12.800 768 HB3 CYS 127 HB3 CYS 127 3.352 12.423 11.907 769 H CYS 128 H CYS 128 1.570 9.227 11.009 770 HA CYS 128 HA CYS 128 0.564 10.869 8.796 771 HB2 CYS 128 HB2 CYS 128 1.348 8.099 8.623 772 HB3 CYS 128 HB3 CYS 128 -0.363 8.246 8.251 773 H GLY 129 H GLY 129 -1.404 10.838 8.441 774 HA2 GLY 129 HA2 GLY 129 -3.466 9.728 10.204 775 HA3 GLY 129 HA3 GLY 129 -3.436 11.455 10.008 776 H ASP 130 H ASP 130 -5.620 10.102 9.583 777 HA ASP 130 HA ASP 130 -6.230 9.373 6.918 778 HB2 ASP 130 HB2 ASP 130 -8.580 9.495 7.678 779 HB3 ASP 130 HB3 ASP 130 -7.582 8.569 8.796 780 H GLU 131 H GLU 131 -6.169 12.016 8.636 781 HA GLU 131 HA GLU 131 -6.685 13.768 6.430 782 HB2 GLU 131 HB2 GLU 131 -8.014 15.028 8.744 783 HB3 GLU 131 HB3 GLU 131 -8.467 15.034 7.046 784 HG2 GLU 131 HG2 GLU 131 -9.192 12.626 7.410 785 HG3 GLU 131 HG3 GLU 131 -9.069 12.983 9.131 786 H LEU 132 H LEU 132 -4.389 12.908 8.115 787 HA LEU 132 HA LEU 132 -3.547 15.470 8.958 788 HB2 LEU 132 HB2 LEU 132 -4.011 12.996 10.336 789 HB3 LEU 132 HB3 LEU 132 -2.329 13.417 10.369 790 HG LEU 132 HG LEU 132 -3.929 15.718 11.049 791 HD11 LEU 132 HD11 LEU 132 -4.311 13.589 13.109 792 HD12 LEU 132 HD12 LEU 132 -5.412 13.640 11.719 793 HD13 LEU 132 HD13 LEU 132 -5.262 15.044 12.774 794 HD21 LEU 132 HD21 LEU 132 -1.753 15.734 11.798 795 HD22 LEU 132 HD22 LEU 132 -1.825 14.085 12.405 796 HD23 LEU 132 HD23 LEU 132 -2.672 15.381 13.246 797 H GLY 133 H GLY 133 -3.433 12.994 6.807 798 HA2 GLY 133 HA2 GLY 133 -1.897 12.079 5.448 799 HA3 GLY 133 HA3 GLY 133 -1.317 13.683 5.428 800 H CYS 134 H CYS 134 0.926 13.471 5.464 801 HA CYS 134 HA CYS 134 1.985 12.015 7.771 802 HB2 CYS 134 HB2 CYS 134 2.274 11.392 5.055 803 HB3 CYS 134 HB3 CYS 134 3.839 11.785 5.731 804 H PHE 135 H PHE 135 2.916 13.402 9.048 805 HA PHE 135 HA PHE 135 4.296 15.666 7.851 806 HB2 PHE 135 HB2 PHE 135 4.377 14.830 10.758 807 HB3 PHE 135 HB3 PHE 135 4.679 16.425 10.082 808 HD1 PHE 135 HD1 PHE 135 2.650 17.486 8.812 809 HD2 PHE 135 HD2 PHE 135 2.347 14.375 11.682 810 HE1 PHE 135 HE1 PHE 135 0.300 18.070 9.172 811 HE2 PHE 135 HE2 PHE 135 -0.006 14.944 12.052 812 HZ PHE 135 HZ PHE 135 -1.038 16.801 10.788 813 H VAL 136 H VAL 136 6.186 14.999 6.877 814 HA VAL 136 HA VAL 136 7.571 12.803 8.168 815 HB VAL 136 HB VAL 136 8.357 14.133 5.576 816 HG11 VAL 136 HG11 VAL 136 9.349 11.877 7.159 817 HG12 VAL 136 HG12 VAL 136 10.149 12.818 5.904 818 HG13 VAL 136 HG13 VAL 136 9.073 11.493 5.461 819 HG21 VAL 136 HG21 VAL 136 6.024 13.312 5.442 820 HG22 VAL 136 HG22 VAL 136 6.563 11.722 5.976 821 HG23 VAL 136 HG23 VAL 136 7.106 12.359 4.427 822 H GLY 137 H GLY 137 8.107 13.814 9.950 823 HA2 GLY 137 HA2 GLY 137 9.924 14.583 11.228 824 HA3 GLY 137 HA3 GLY 137 10.626 15.286 9.795 825 H THR 138 H THR 138 9.037 15.835 12.651 826 HA THR 138 HA THR 138 9.270 18.611 12.580 827 HB THR 138 HB THR 138 7.425 19.048 11.329 828 HG1 THR 138 HG1 THR 138 5.586 18.679 13.234 829 HG21 THR 138 HG21 THR 138 6.694 16.999 10.602 830 HG22 THR 138 HG22 THR 138 5.310 17.602 11.517 831 HG23 THR 138 HG23 THR 138 6.389 16.406 12.235 832 H ALA 139 H ALA 139 7.706 19.443 14.709 833 HA ALA 139 HA ALA 139 8.836 17.902 16.814 834 HB1 ALA 139 HB1 ALA 139 8.021 20.434 16.682 835 HB2 ALA 139 HB2 ALA 139 8.171 19.555 18.204 836 HB3 ALA 139 HB3 ALA 139 6.593 19.720 17.434 837 H GLU 140 H GLU 140 5.566 18.051 15.377 838 HA GLU 140 HA GLU 140 4.262 16.510 17.280 839 HB2 GLU 140 HB2 GLU 140 3.839 17.246 14.437 840 HB3 GLU 140 HB3 GLU 140 2.938 15.856 15.024 841 HG2 GLU 140 HG2 GLU 140 1.431 17.253 15.833 842 HG3 GLU 140 HG3 GLU 140 2.637 17.815 16.987 843 H ALA 141 H ALA 141 6.498 15.628 14.876 844 HA ALA 141 HA ALA 141 5.780 12.817 14.966 845 HB1 ALA 141 HB1 ALA 141 6.314 13.909 12.791 846 HB2 ALA 141 HB2 ALA 141 7.263 12.464 13.142 847 HB3 ALA 141 HB3 ALA 141 7.983 14.061 13.340 848 H LEU 142 H LEU 142 8.052 15.006 16.399 849 HA LEU 142 HA LEU 142 10.233 13.527 16.844 850 HB2 LEU 142 HB2 LEU 142 8.774 15.499 18.503 851 HB3 LEU 142 HB3 LEU 142 10.038 14.578 19.288 852 HG LEU 142 HG LEU 142 10.642 15.987 16.718 853 HD11 LEU 142 HD11 LEU 142 10.767 18.064 17.607 854 HD12 LEU 142 HD12 LEU 142 11.143 17.472 19.225 855 HD13 LEU 142 HD13 LEU 142 9.480 17.442 18.639 856 HD21 LEU 142 HD21 LEU 142 12.106 14.751 18.939 857 HD22 LEU 142 HD22 LEU 142 12.764 16.291 18.385 858 HD23 LEU 142 HD23 LEU 142 12.564 14.957 17.248 859 H ARG 143 H ARG 143 7.224 13.123 18.712 860 HA ARG 143 HA ARG 143 8.288 11.205 20.444 861 HB2 ARG 143 HB2 ARG 143 6.174 10.865 21.207 862 HB3 ARG 143 HB3 ARG 143 5.929 12.394 20.386 863 HG2 ARG 143 HG2 ARG 143 4.165 11.331 19.521 864 HG3 ARG 143 HG3 ARG 143 5.358 10.695 18.386 865 HD2 ARG 143 HD2 ARG 143 3.795 9.014 19.486 866 HD3 ARG 143 HD3 ARG 143 5.515 8.653 19.521 867 HE ARG 143 HE ARG 143 5.430 8.738 21.795 868 HH11 ARG 143 HH11 ARG 143 2.680 10.495 20.553 869 HH12 ARG 143 HH12 ARG 143 1.963 10.720 22.114 870 HH21 ARG 143 HH21 ARG 143 4.485 9.033 23.846 871 HH22 ARG 143 HH22 ARG 143 2.986 9.890 23.982 872 H CYS 144 H CYS 144 7.407 11.109 17.117 873 HA CYS 144 HA CYS 144 7.313 8.281 16.807 874 HB2 CYS 144 HB2 CYS 144 8.219 10.205 14.655 875 HB3 CYS 144 HB3 CYS 144 7.543 8.600 14.427 876 H GLN 145 H GLN 145 9.678 9.783 18.016 877 HA GLN 145 HA GLN 145 12.009 8.704 16.635 878 HB2 GLN 145 HB2 GLN 145 11.725 10.756 18.497 879 HB3 GLN 145 HB3 GLN 145 12.619 9.513 19.354 880 HG2 GLN 145 HG2 GLN 145 14.201 9.440 17.422 881 HG3 GLN 145 HG3 GLN 145 13.364 10.844 16.763 882 HE21 GLN 145 HE21 GLN 145 15.612 9.691 19.088 883 HE22 GLN 145 HE22 GLN 145 16.064 11.226 19.738 884 H GLU 146 H GLU 146 9.849 7.612 19.071 885 HA GLU 146 HA GLU 146 11.715 5.653 20.097 886 HB2 GLU 146 HB2 GLU 146 9.866 6.844 21.441 887 HB3 GLU 146 HB3 GLU 146 8.764 5.716 20.666 888 HG2 GLU 146 HG2 GLU 146 10.232 3.867 21.571 889 HG3 GLU 146 HG3 GLU 146 11.023 5.105 22.545 890 H GLU 147 H GLU 147 10.009 5.896 17.326 891 HA GLU 147 HA GLU 147 9.097 3.156 17.178 892 HB2 GLU 147 HB2 GLU 147 8.297 5.417 15.894 893 HB3 GLU 147 HB3 GLU 147 9.362 4.715 14.684 894 HG2 GLU 147 HG2 GLU 147 7.558 2.759 15.840 895 HG3 GLU 147 HG3 GLU 147 6.707 4.104 15.083 896 H ASN 148 H ASN 148 12.049 4.484 17.269 897 HA ASN 148 HA ASN 148 13.161 2.841 15.128 898 HB2 ASN 148 HB2 ASN 148 13.906 5.338 16.270 899 HB3 ASN 148 HB3 ASN 148 15.198 4.191 16.618 900 HD21 ASN 148 HD21 ASN 148 13.012 4.824 13.900 901 HD22 ASN 148 HD22 ASN 148 14.246 4.847 12.691 902 H TYR 149 H TYR 149 12.849 3.039 18.590 903 HA TYR 149 HA TYR 149 14.950 1.214 19.221 904 HB2 TYR 149 HB2 TYR 149 12.489 1.855 20.857 905 HB3 TYR 149 HB3 TYR 149 13.992 1.155 21.447 906 HD1 TYR 149 HD1 TYR 149 16.149 2.671 20.788 907 HD2 TYR 149 HD2 TYR 149 12.171 4.079 21.269 908 HE1 TYR 149 HE1 TYR 149 17.009 4.934 21.226 909 HE2 TYR 149 HE2 TYR 149 13.011 6.345 21.710 910 HH TYR 149 HH TYR 149 15.238 7.639 21.047 911 H LEU 150 H LEU 150 12.462 0.496 17.330 912 HA LEU 150 HA LEU 150 12.239 -2.239 18.385 913 HB2 LEU 150 HB2 LEU 150 10.056 -0.487 17.284 914 HB3 LEU 150 HB3 LEU 150 9.903 -2.230 17.372 915 HG LEU 150 HG LEU 150 10.698 -1.023 19.914 916 HD11 LEU 150 HD11 LEU 150 8.674 0.315 18.421 917 HD12 LEU 150 HD12 LEU 150 9.232 0.629 20.064 918 HD13 LEU 150 HD13 LEU 150 7.921 -0.515 19.783 919 HD21 LEU 150 HD21 LEU 150 8.237 -2.417 20.039 920 HD22 LEU 150 HD22 LEU 150 9.832 -2.958 20.561 921 HD23 LEU 150 HD23 LEU 150 9.284 -3.288 18.918 922 HA PRO 151 HA PRO 151 13.591 -2.980 14.163 923 HB2 PRO 151 HB2 PRO 151 14.188 -5.577 14.429 924 HB3 PRO 151 HB3 PRO 151 15.193 -4.324 15.167 925 HG2 PRO 151 HG2 PRO 151 13.118 -6.072 16.425 926 HG3 PRO 151 HG3 PRO 151 14.704 -5.588 17.051 927 HD2 PRO 151 HD2 PRO 151 12.320 -4.408 17.770 928 HD3 PRO 151 HD3 PRO 151 13.904 -3.616 17.878 929 H SER 152 H SER 152 10.834 -2.768 14.476 930 HA SER 152 HA SER 152 9.915 -4.948 12.757 931 HB2 SER 152 HB2 SER 152 7.763 -5.053 14.017 932 HB3 SER 152 HB3 SER 152 9.148 -5.595 14.965 933 HG SER 152 HG SER 152 8.246 -2.924 15.079 934 HA PRO 153 HA PRO 153 7.970 -1.656 10.548 935 HB2 PRO 153 HB2 PRO 153 5.892 -3.315 9.480 936 HB3 PRO 153 HB3 PRO 153 7.423 -2.870 8.729 937 HG2 PRO 153 HG2 PRO 153 6.757 -5.423 9.538 938 HG3 PRO 153 HG3 PRO 153 8.413 -4.837 9.309 939 HD2 PRO 153 HD2 PRO 153 6.839 -5.144 11.835 940 HD3 PRO 153 HD3 PRO 153 8.559 -5.470 11.525 941 H CYS 154 H CYS 154 5.412 -1.276 9.726 942 HA CYS 154 HA CYS 154 3.507 -1.375 11.870 943 HB2 CYS 154 HB2 CYS 154 5.223 0.705 12.094 944 HB3 CYS 154 HB3 CYS 154 4.041 1.425 11.015 945 H GLN 155 H GLN 155 1.417 -1.581 10.881 946 HA GLN 155 HA GLN 155 1.189 -1.665 8.101 947 HB2 GLN 155 HB2 GLN 155 -1.115 -1.735 8.301 948 HB3 GLN 155 HB3 GLN 155 -0.585 -2.281 9.880 949 HG2 GLN 155 HG2 GLN 155 -1.811 -0.659 10.816 950 HG3 GLN 155 HG3 GLN 155 -0.808 0.540 10.020 951 HE21 GLN 155 HE21 GLN 155 -2.482 1.968 9.701 952 HE22 GLN 155 HE22 GLN 155 -3.757 1.684 8.570 953 H SER 156 H SER 156 -0.807 -0.181 7.133 954 HA SER 156 HA SER 156 -0.743 2.533 7.588 955 HB2 SER 156 HB2 SER 156 0.521 3.218 5.463 956 HB3 SER 156 HB3 SER 156 1.471 2.718 6.857 957 HG SER 156 HG SER 156 0.868 1.217 4.541 958 H GLY 157 H GLY 157 -0.802 2.915 4.512 959 HA2 GLY 157 HA2 GLY 157 -3.593 1.942 4.235 960 HA3 GLY 157 HA3 GLY 157 -2.995 3.366 3.390 961 H GLN 158 H GLN 158 -4.119 0.930 2.155 962 HA GLN 158 HA GLN 158 -1.653 -0.141 0.984 963 HB2 GLN 158 HB2 GLN 158 -4.480 -1.163 0.650 964 HB3 GLN 158 HB3 GLN 158 -3.001 -1.984 0.175 965 HG2 GLN 158 HG2 GLN 158 -3.685 -1.302 3.022 966 HG3 GLN 158 HG3 GLN 158 -4.076 -2.841 2.256 967 HE21 GLN 158 HE21 GLN 158 -2.156 -3.901 1.165 968 HE22 GLN 158 HE22 GLN 158 -0.674 -3.900 2.052 969 H LYS 159 H LYS 159 -1.693 2.086 0.044 970 HA LYS 159 HA LYS 159 -2.870 1.988 -2.623 971 HB2 LYS 159 HB2 LYS 159 -3.194 4.014 -0.772 972 HB3 LYS 159 HB3 LYS 159 -1.976 4.632 -1.884 973 HG2 LYS 159 HG2 LYS 159 -3.730 5.257 -3.117 974 HG3 LYS 159 HG3 LYS 159 -3.785 3.562 -3.605 975 HD2 LYS 159 HD2 LYS 159 -5.168 4.125 -1.084 976 HD3 LYS 159 HD3 LYS 159 -5.857 4.954 -2.481 977 HE2 LYS 159 HE2 LYS 159 -5.263 2.001 -2.420 978 HE3 LYS 159 HE3 LYS 159 -6.827 2.688 -1.982 979 HZ1 LYS 159 HZ1 LYS 159 -5.489 2.758 -4.624 980 HZ2 LYS 159 HZ2 LYS 159 -6.812 3.742 -4.247 981 HZ3 LYS 159 HZ3 LYS 159 -6.980 2.059 -4.229 982 HA PRO 160 HA PRO 160 1.816 1.781 -2.381 983 HB2 PRO 160 HB2 PRO 160 2.203 -0.382 -4.006 984 HB3 PRO 160 HB3 PRO 160 2.090 -0.451 -2.244 985 HG2 PRO 160 HG2 PRO 160 -0.023 -0.974 -4.297 986 HG3 PRO 160 HG3 PRO 160 0.330 -1.860 -2.801 987 HD2 PRO 160 HD2 PRO 160 -1.709 -0.118 -2.941 988 HD3 PRO 160 HD3 PRO 160 -0.734 -0.281 -1.465 989 H CYS 161 H CYS 161 1.469 3.706 -3.550 990 HA CYS 161 HA CYS 161 1.860 3.475 -6.443 991 HB2 CYS 161 HB2 CYS 161 0.939 5.545 -6.714 992 HB3 CYS 161 HB3 CYS 161 0.171 5.162 -5.180 993 H GLY 162 H GLY 162 3.470 5.602 -7.012 994 HA2 GLY 162 HA2 GLY 162 5.655 6.360 -6.836 995 HA3 GLY 162 HA3 GLY 162 5.575 5.934 -5.129 996 H SER 163 H SER 163 7.881 5.359 -5.602 997 HA SER 163 HA SER 163 8.309 2.964 -7.175 998 HB2 SER 163 HB2 SER 163 10.700 3.237 -6.393 999 HB3 SER 163 HB3 SER 163 10.050 4.597 -7.305 1000 HG SER 163 HG SER 163 9.654 5.630 -5.278 1001 H GLY 164 H GLY 164 6.561 2.492 -5.101 1002 HA2 GLY 164 HA2 GLY 164 6.579 0.284 -4.016 1003 HA3 GLY 164 HA3 GLY 164 8.104 0.767 -3.293 1004 H GLY 165 H GLY 165 6.051 3.471 -3.288 1005 HA2 GLY 165 HA2 GLY 165 5.507 2.907 -0.468 1006 HA3 GLY 165 HA3 GLY 165 5.515 4.485 -1.205 1007 H ARG 166 H ARG 166 3.641 2.736 0.484 1008 HA ARG 166 HA ARG 166 1.217 2.934 -1.105 1009 HB2 ARG 166 HB2 ARG 166 0.168 1.737 0.859 1010 HB3 ARG 166 HB3 ARG 166 1.354 0.819 -0.052 1011 HG2 ARG 166 HG2 ARG 166 2.535 2.308 2.146 1012 HG3 ARG 166 HG3 ARG 166 1.304 1.158 2.673 1013 HD2 ARG 166 HD2 ARG 166 3.492 0.399 0.762 1014 HD3 ARG 166 HD3 ARG 166 3.704 0.312 2.511 1015 HE ARG 166 HE ARG 166 1.407 -1.065 2.068 1016 HH11 ARG 166 HH11 ARG 166 4.639 -1.274 0.770 1017 HH12 ARG 166 HH12 ARG 166 4.550 -2.980 0.489 1018 HH21 ARG 166 HH21 ARG 166 1.284 -3.306 1.698 1019 HH22 ARG 166 HH22 ARG 166 2.644 -4.135 1.016 1020 H CYS 167 H CYS 167 -0.725 4.062 -0.219 1021 HA CYS 167 HA CYS 167 0.006 6.554 0.872 1022 HB2 CYS 167 HB2 CYS 167 -2.595 5.224 0.235 1023 HB3 CYS 167 HB3 CYS 167 -2.629 6.601 1.319 1024 H ALA 168 H ALA 168 0.757 6.745 2.938 1025 HA ALA 168 HA ALA 168 -0.257 4.950 5.007 1026 HB1 ALA 168 HB1 ALA 168 1.928 6.939 4.850 1027 HB2 ALA 168 HB2 ALA 168 1.880 5.369 5.650 1028 HB3 ALA 168 HB3 ALA 168 1.153 6.772 6.423 1029 H ALA 169 H ALA 169 -0.786 7.826 3.613 1030 HA ALA 169 HA ALA 169 -3.283 8.393 5.003 1031 HB1 ALA 169 HB1 ALA 169 -1.181 10.508 4.968 1032 HB2 ALA 169 HB2 ALA 169 -1.472 9.456 6.346 1033 HB3 ALA 169 HB3 ALA 169 -2.730 10.541 5.774 1034 H ALA 170 H ALA 170 -4.493 10.164 4.035 1035 HA ALA 170 HA ALA 170 -5.299 10.115 1.596 1036 HB1 ALA 170 HB1 ALA 170 -4.499 12.849 2.508 1037 HB2 ALA 170 HB2 ALA 170 -5.738 11.919 3.349 1038 HB3 ALA 170 HB3 ALA 170 -5.960 12.341 1.652 1039 H GLY 171 H GLY 171 -4.184 12.844 0.601 1040 HA2 GLY 171 HA2 GLY 171 -2.817 11.932 -1.608 1041 HA3 GLY 171 HA3 GLY 171 -2.793 13.598 -1.057 1042 H ILE 172 H ILE 172 -1.575 10.919 0.636 1043 HA ILE 172 HA ILE 172 1.247 11.738 0.170 1044 HB ILE 172 HB ILE 172 1.774 11.879 2.354 1045 HG12 ILE 172 HG12 ILE 172 0.023 10.873 4.092 1046 HG13 ILE 172 HG13 ILE 172 -0.265 9.768 2.752 1047 HG21 ILE 172 HG21 ILE 172 -0.009 13.089 3.529 1048 HG22 ILE 172 HG22 ILE 172 -1.164 12.528 2.320 1049 HG23 ILE 172 HG23 ILE 172 0.159 13.589 1.847 1050 HD11 ILE 172 HD11 ILE 172 2.399 10.409 3.908 1051 HD12 ILE 172 HD12 ILE 172 2.057 9.183 2.692 1052 HD13 ILE 172 HD13 ILE 172 1.452 8.984 4.334 1053 H CYS 173 H CYS 173 2.179 10.191 -0.947 1054 HA CYS 173 HA CYS 173 1.556 7.407 -0.378 1055 HB2 CYS 173 HB2 CYS 173 2.297 8.845 -2.715 1056 HB3 CYS 173 HB3 CYS 173 3.559 7.665 -2.401 1057 H CYS 174 H CYS 174 2.569 7.317 1.669 1058 HA CYS 174 HA CYS 174 5.405 7.759 1.794 1059 HB2 CYS 174 HB2 CYS 174 3.277 7.535 3.688 1060 HB3 CYS 174 HB3 CYS 174 4.550 6.396 4.114 1061 H SER 175 H SER 175 6.979 6.312 1.798 1062 HA SER 175 HA SER 175 6.250 3.537 1.158 1063 HB2 SER 175 HB2 SER 175 8.940 4.856 0.727 1064 HB3 SER 175 HB3 SER 175 8.328 3.382 -0.017 1065 HG SER 175 HG SER 175 7.792 6.039 -0.633 1066 HA PRO 176 HA PRO 176 8.307 2.148 4.819 1067 HB2 PRO 176 HB2 PRO 176 9.897 0.094 4.150 1068 HB3 PRO 176 HB3 PRO 176 8.140 -0.004 3.974 1069 HG2 PRO 176 HG2 PRO 176 10.226 0.502 1.896 1070 HG3 PRO 176 HG3 PRO 176 8.764 -0.494 1.797 1071 HD2 PRO 176 HD2 PRO 176 8.985 2.068 0.802 1072 HD3 PRO 176 HD3 PRO 176 7.451 1.293 1.239 1073 H ASP 177 H ASP 177 9.755 4.235 3.146 1074 HA ASP 177 HA ASP 177 12.207 4.239 4.700 1075 HB2 ASP 177 HB2 ASP 177 12.312 4.772 1.727 1076 HB3 ASP 177 HB3 ASP 177 13.662 4.603 2.844 1077 H GLY 178 H GLY 178 10.058 5.951 2.440 1078 HA2 GLY 178 HA2 GLY 178 10.383 8.343 4.061 1079 HA3 GLY 178 HA3 GLY 178 10.789 8.507 2.374 1080 H CYS 179 H CYS 179 9.247 9.733 1.536 1081 HA CYS 179 HA CYS 179 6.526 8.716 1.528 1082 HB2 CYS 179 HB2 CYS 179 7.234 10.786 3.255 1083 HB3 CYS 179 HB3 CYS 179 6.468 11.595 1.893 1084 H HIS 180 H HIS 180 5.184 9.653 -0.217 1085 HA HIS 180 HA HIS 180 6.736 11.151 -2.230 1086 HB2 HIS 180 HB2 HIS 180 6.892 8.636 -2.568 1087 HB3 HIS 180 HB3 HIS 180 5.167 8.656 -2.892 1088 HD1 HIS 180 HD1 HIS 180 7.097 7.663 -5.007 1089 HD2 HIS 180 HD2 HIS 180 5.802 11.599 -4.777 1090 HE1 HIS 180 HE1 HIS 180 7.368 8.595 -7.323 1091 HE2 HIS 180 HE2 HIS 180 6.486 10.951 -7.181 1092 H GLU 181 H GLU 181 5.567 12.627 -3.283 1093 HA GLU 181 HA GLU 181 2.966 13.298 -2.502 1094 HB2 GLU 181 HB2 GLU 181 4.350 13.994 -5.091 1095 HB3 GLU 181 HB3 GLU 181 2.993 14.855 -4.372 1096 HG2 GLU 181 HG2 GLU 181 4.300 15.971 -2.942 1097 HG3 GLU 181 HG3 GLU 181 5.311 14.567 -2.618 1098 H ASP 182 H ASP 182 1.061 12.556 -3.056 1099 HA ASP 182 HA ASP 182 0.702 11.175 -5.595 1100 HB2 ASP 182 HB2 ASP 182 0.975 9.193 -4.579 1101 HB3 ASP 182 HB3 ASP 182 0.852 9.885 -2.962 1102 HA PRO 183 HA PRO 183 -2.996 13.641 -4.882 1103 HB2 PRO 183 HB2 PRO 183 -3.576 13.530 -7.674 1104 HB3 PRO 183 HB3 PRO 183 -2.884 14.870 -6.762 1105 HG2 PRO 183 HG2 PRO 183 -1.548 13.398 -8.691 1106 HG3 PRO 183 HG3 PRO 183 -0.772 14.386 -7.443 1107 HD2 PRO 183 HD2 PRO 183 -1.202 11.430 -7.532 1108 HD3 PRO 183 HD3 PRO 183 0.175 12.359 -6.898 1109 H ALA 184 H ALA 184 -2.735 10.439 -5.911 1110 HA ALA 184 HA ALA 184 -5.385 9.951 -6.767 1111 HB1 ALA 184 HB1 ALA 184 -3.308 8.470 -7.057 1112 HB2 ALA 184 HB2 ALA 184 -4.853 7.680 -6.741 1113 HB3 ALA 184 HB3 ALA 184 -3.680 7.877 -5.438 1114 H CYS 185 H CYS 185 -3.850 9.996 -3.619 1115 HA CYS 185 HA CYS 185 -6.324 9.140 -2.335 1116 HB2 CYS 185 HB2 CYS 185 -3.580 9.701 -1.200 1117 HB3 CYS 185 HB3 CYS 185 -4.957 9.197 -0.232 1118 H ASP 186 H ASP 186 -6.780 11.475 -3.546 1119 HA ASP 186 HA ASP 186 -6.716 13.437 -1.397 1120 HB2 ASP 186 HB2 ASP 186 -6.430 13.697 -4.355 1121 HB3 ASP 186 HB3 ASP 186 -7.183 15.016 -3.464 1122 HA PRO 187 HA PRO 187 -11.193 12.723 -2.733 1123 HB2 PRO 187 HB2 PRO 187 -11.843 10.668 -0.871 1124 HB3 PRO 187 HB3 PRO 187 -11.813 10.516 -2.630 1125 HG2 PRO 187 HG2 PRO 187 -10.079 9.270 -0.830 1126 HG3 PRO 187 HG3 PRO 187 -9.836 9.415 -2.577 1127 HD2 PRO 187 HD2 PRO 187 -8.625 10.976 -0.356 1128 HD3 PRO 187 HD3 PRO 187 -7.975 10.571 -1.953 1129 H GLU 188 H GLU 188 -10.162 14.510 -1.413 1130 HA GLU 188 HA GLU 188 -12.000 15.223 0.612 1131 HB2 GLU 188 HB2 GLU 188 -10.770 15.021 2.622 1132 HB3 GLU 188 HB3 GLU 188 -10.591 13.482 1.794 1133 HG2 GLU 188 HG2 GLU 188 -8.376 13.856 1.274 1134 HG3 GLU 188 HG3 GLU 188 -8.521 15.601 1.452 1135 H ALA 189 H ALA 189 -8.891 15.465 -0.743 1136 HA ALA 189 HA ALA 189 -8.150 18.067 -0.157 1137 HB1 ALA 189 HB1 ALA 189 -7.218 15.741 -1.684 1138 HB2 ALA 189 HB2 ALA 189 -6.295 17.005 -0.839 1139 HB3 ALA 189 HB3 ALA 189 -6.847 17.283 -2.489 1140 H ALA 190 H ALA 190 -10.802 18.369 -1.000 1141 HA ALA 190 HA ALA 190 -11.199 19.018 -3.669 1142 HB1 ALA 190 HB1 ALA 190 -12.606 19.476 -1.074 1143 HB2 ALA 190 HB2 ALA 190 -13.123 18.542 -2.478 1144 HB3 ALA 190 HB3 ALA 190 -13.159 20.304 -2.529 1145 H PHE 191 H PHE 191 -10.647 20.601 -4.755 1146 HA PHE 191 HA PHE 191 -9.046 22.725 -3.844 1147 HB2 PHE 191 HB2 PHE 191 -9.305 23.475 -6.288 1148 HB3 PHE 191 HB3 PHE 191 -8.568 21.908 -5.984 1149 HD1 PHE 191 HD1 PHE 191 -11.749 23.547 -6.975 1150 HD2 PHE 191 HD2 PHE 191 -9.457 19.959 -6.943 1151 HE1 PHE 191 HE1 PHE 191 -13.372 22.498 -8.501 1152 HE2 PHE 191 HE2 PHE 191 -11.078 18.907 -8.466 1153 HZ PHE 191 HZ PHE 191 -13.037 20.176 -9.247 1154 H SER 192 H SER 192 -9.430 24.712 -3.332 1155 HA SER 192 HA SER 192 -12.156 25.724 -3.313 1156 HB2 SER 192 HB2 SER 192 -10.660 25.838 -1.290 1157 HB3 SER 192 HB3 SER 192 -9.658 26.992 -2.169 1158 HG SER 192 HG SER 192 -11.571 28.303 -2.360 Start of MODEL 15 1 H1 ALA 1 H1 ALA 1 12.597 39.067 -7.491 2 H2 ALA 1 H2 ALA 1 13.700 39.903 -8.505 3 H3 ALA 1 H3 ALA 1 14.183 39.404 -6.936 4 HA ALA 1 HA ALA 1 13.320 37.128 -8.094 5 HB1 ALA 1 HB1 ALA 1 14.689 38.886 -10.107 6 HB2 ALA 1 HB2 ALA 1 13.209 37.943 -10.287 7 HB3 ALA 1 HB3 ALA 1 14.770 37.125 -10.199 8 H VAL 2 H VAL 2 14.609 35.698 -7.185 9 HA VAL 2 HA VAL 2 17.442 35.764 -7.266 10 HB VAL 2 HB VAL 2 16.699 35.705 -4.407 11 HG11 VAL 2 HG11 VAL 2 18.890 35.957 -4.215 12 HG12 VAL 2 HG12 VAL 2 18.848 37.474 -5.113 13 HG13 VAL 2 HG13 VAL 2 19.004 35.944 -5.973 14 HG21 VAL 2 HG21 VAL 2 15.348 37.650 -5.318 15 HG22 VAL 2 HG22 VAL 2 16.891 38.420 -5.690 16 HG23 VAL 2 HG23 VAL 2 16.483 38.021 -4.024 17 H LEU 3 H LEU 3 15.718 33.922 -8.168 18 HA LEU 3 HA LEU 3 15.436 31.888 -6.129 19 HB2 LEU 3 HB2 LEU 3 14.278 31.762 -8.875 20 HB3 LEU 3 HB3 LEU 3 13.752 30.894 -7.453 21 HG LEU 3 HG LEU 3 12.094 32.462 -7.621 22 HD11 LEU 3 HD11 LEU 3 13.899 34.322 -6.156 23 HD12 LEU 3 HD12 LEU 3 13.549 32.742 -5.463 24 HD13 LEU 3 HD13 LEU 3 12.233 33.861 -5.815 25 HD21 LEU 3 HD21 LEU 3 12.284 33.963 -9.238 26 HD22 LEU 3 HD22 LEU 3 14.044 33.871 -9.201 27 HD23 LEU 3 HD23 LEU 3 13.193 34.976 -8.121 28 H ASP 4 H ASP 4 17.763 32.155 -8.737 29 HA ASP 4 HA ASP 4 17.781 29.585 -9.413 30 HB2 ASP 4 HB2 ASP 4 20.193 31.335 -9.066 31 HB3 ASP 4 HB3 ASP 4 19.993 30.007 -10.204 32 H LEU 5 H LEU 5 20.401 30.746 -7.396 33 HA LEU 5 HA LEU 5 20.014 28.585 -5.570 34 HB2 LEU 5 HB2 LEU 5 21.211 27.834 -7.687 35 HB3 LEU 5 HB3 LEU 5 22.572 28.737 -7.065 36 HG LEU 5 HG LEU 5 22.727 27.265 -5.143 37 HD11 LEU 5 HD11 LEU 5 20.277 26.923 -4.865 38 HD12 LEU 5 HD12 LEU 5 21.201 25.417 -4.800 39 HD13 LEU 5 HD13 LEU 5 20.310 25.841 -6.261 40 HD21 LEU 5 HD21 LEU 5 23.166 25.121 -6.311 41 HD22 LEU 5 HD22 LEU 5 23.861 26.516 -7.137 42 HD23 LEU 5 HD23 LEU 5 22.379 25.778 -7.745 43 H ASP 6 H ASP 6 20.292 31.523 -5.428 44 HA ASP 6 HA ASP 6 22.642 31.799 -3.681 45 HB2 ASP 6 HB2 ASP 6 20.902 33.689 -5.115 46 HB3 ASP 6 HB3 ASP 6 21.144 34.141 -3.429 47 H VAL 7 H VAL 7 19.340 32.574 -3.662 48 HA VAL 7 HA VAL 7 18.713 30.771 -1.630 49 HB VAL 7 HB VAL 7 19.564 32.465 -0.115 50 HG11 VAL 7 HG11 VAL 7 17.832 34.239 -1.696 51 HG12 VAL 7 HG12 VAL 7 19.372 34.553 -0.905 52 HG13 VAL 7 HG13 VAL 7 17.884 34.533 0.040 53 HG21 VAL 7 HG21 VAL 7 18.057 31.838 1.383 54 HG22 VAL 7 HG22 VAL 7 17.084 31.198 0.059 55 HG23 VAL 7 HG23 VAL 7 16.815 32.842 0.636 56 H ARG 8 H ARG 8 16.950 29.963 -2.540 57 HA ARG 8 HA ARG 8 15.367 31.753 -4.133 58 HB2 ARG 8 HB2 ARG 8 15.856 29.290 -4.704 59 HB3 ARG 8 HB3 ARG 8 14.611 28.923 -3.513 60 HG2 ARG 8 HG2 ARG 8 14.072 30.870 -5.693 61 HG3 ARG 8 HG3 ARG 8 13.995 29.149 -6.026 62 HD2 ARG 8 HD2 ARG 8 12.058 28.927 -4.930 63 HD3 ARG 8 HD3 ARG 8 12.563 29.986 -3.615 64 HE ARG 8 HE ARG 8 11.872 31.857 -4.943 65 HH11 ARG 8 HH11 ARG 8 10.918 28.737 -6.187 66 HH12 ARG 8 HH12 ARG 8 9.679 29.385 -7.202 67 HH21 ARG 8 HH21 ARG 8 10.256 32.708 -6.291 68 HH22 ARG 8 HH22 ARG 8 9.305 31.639 -7.265 69 H THR 9 H THR 9 13.923 33.010 -3.103 70 HA THR 9 HA THR 9 13.247 32.239 -0.418 71 HB THR 9 HB THR 9 11.341 33.889 -0.630 72 HG1 THR 9 HG1 THR 9 12.167 33.787 -3.283 73 HG21 THR 9 HG21 THR 9 12.710 35.905 -0.960 74 HG22 THR 9 HG22 THR 9 14.043 34.881 -1.495 75 HG23 THR 9 HG23 THR 9 13.436 34.748 0.156 76 H CYS 10 H CYS 10 12.397 30.343 -0.097 77 HA CYS 10 HA CYS 10 10.611 29.074 -1.949 78 HB2 CYS 10 HB2 CYS 10 11.824 28.243 0.654 79 HB3 CYS 10 HB3 CYS 10 10.553 27.280 -0.085 80 H LEU 11 H LEU 11 8.479 29.500 -2.079 81 HA LEU 11 HA LEU 11 6.823 31.052 -0.762 82 HB2 LEU 11 HB2 LEU 11 6.366 29.201 -2.552 83 HB3 LEU 11 HB3 LEU 11 5.778 28.289 -1.175 84 HG LEU 11 HG LEU 11 4.291 30.347 -0.708 85 HD11 LEU 11 HD11 LEU 11 4.797 30.810 -3.636 86 HD12 LEU 11 HD12 LEU 11 5.536 31.771 -2.355 87 HD13 LEU 11 HD13 LEU 11 3.783 31.760 -2.550 88 HD21 LEU 11 HD21 LEU 11 2.545 29.418 -1.984 89 HD22 LEU 11 HD22 LEU 11 3.623 28.071 -1.613 90 HD23 LEU 11 HD23 LEU 11 3.658 28.815 -3.212 91 HA PRO 12 HA PRO 12 6.655 29.953 3.533 92 HB2 PRO 12 HB2 PRO 12 4.645 31.595 4.294 93 HB3 PRO 12 HB3 PRO 12 6.288 32.144 3.952 94 HG2 PRO 12 HG2 PRO 12 3.851 32.276 2.238 95 HG3 PRO 12 HG3 PRO 12 5.144 33.463 2.444 96 HD2 PRO 12 HD2 PRO 12 4.959 31.775 0.306 97 HD3 PRO 12 HD3 PRO 12 6.483 32.452 0.902 98 H CYS 13 H CYS 13 5.778 28.756 4.781 99 HA CYS 13 HA CYS 13 2.960 27.872 4.762 100 HB2 CYS 13 HB2 CYS 13 3.167 25.917 3.785 101 HB3 CYS 13 HB3 CYS 13 4.758 26.447 3.285 102 H GLY 14 H GLY 14 2.483 25.957 6.242 103 HA2 GLY 14 HA2 GLY 14 2.407 25.103 8.411 104 HA3 GLY 14 HA3 GLY 14 3.875 26.003 8.796 105 HA PRO 15 HA PRO 15 0.294 28.287 10.897 106 HB2 PRO 15 HB2 PRO 15 1.686 29.010 13.062 107 HB3 PRO 15 HB3 PRO 15 1.122 27.325 12.904 108 HG2 PRO 15 HG2 PRO 15 3.626 28.491 11.805 109 HG3 PRO 15 HG3 PRO 15 3.575 27.307 13.161 110 HD2 PRO 15 HD2 PRO 15 3.885 26.279 10.813 111 HD3 PRO 15 HD3 PRO 15 2.408 25.721 11.656 112 H GLY 16 H GLY 16 0.147 30.038 9.787 113 HA2 GLY 16 HA2 GLY 16 0.311 32.207 9.113 114 HA3 GLY 16 HA3 GLY 16 1.640 32.311 10.251 115 H GLY 17 H GLY 17 2.245 29.830 8.216 116 HA2 GLY 17 HA2 GLY 17 3.683 29.582 6.457 117 HA3 GLY 17 HA3 GLY 17 3.159 31.187 6.071 118 H LYS 18 H LYS 18 5.091 29.603 8.475 119 HA LYS 18 HA LYS 18 7.134 31.704 8.377 120 HB2 LYS 18 HB2 LYS 18 7.508 29.861 10.554 121 HB3 LYS 18 HB3 LYS 18 7.356 31.611 10.623 122 HG2 LYS 18 HG2 LYS 18 4.772 30.760 10.238 123 HG3 LYS 18 HG3 LYS 18 5.448 29.528 11.298 124 HD2 LYS 18 HD2 LYS 18 6.366 31.910 12.366 125 HD3 LYS 18 HD3 LYS 18 4.721 32.282 11.834 126 HE2 LYS 18 HE2 LYS 18 4.645 31.517 14.117 127 HE3 LYS 18 HE3 LYS 18 3.926 30.287 13.078 128 HZ1 LYS 18 HZ1 LYS 18 6.370 29.373 13.115 129 HZ2 LYS 18 HZ2 LYS 18 5.281 29.001 14.354 130 HZ3 LYS 18 HZ3 LYS 18 6.437 30.214 14.581 131 H GLY 19 H GLY 19 6.210 29.294 6.780 132 HA2 GLY 19 HA2 GLY 19 8.425 27.485 7.100 133 HA3 GLY 19 HA3 GLY 19 6.860 27.101 6.441 134 H ARG 20 H ARG 20 8.398 26.177 5.245 135 HA ARG 20 HA ARG 20 8.657 27.520 2.668 136 HB2 ARG 20 HB2 ARG 20 11.034 26.770 4.203 137 HB3 ARG 20 HB3 ARG 20 11.094 26.375 2.487 138 HG2 ARG 20 HG2 ARG 20 11.353 28.514 1.911 139 HG3 ARG 20 HG3 ARG 20 10.078 29.054 2.990 140 HD2 ARG 20 HD2 ARG 20 12.310 30.003 3.497 141 HD3 ARG 20 HD3 ARG 20 11.598 29.109 4.835 142 HE ARG 20 HE ARG 20 13.731 28.074 3.085 143 HH11 ARG 20 HH11 ARG 20 12.109 28.199 6.180 144 HH12 ARG 20 HH12 ARG 20 13.272 27.186 6.962 145 HH21 ARG 20 HH21 ARG 20 15.241 26.732 4.112 146 HH22 ARG 20 HH22 ARG 20 15.049 26.353 5.792 147 H CYS 21 H CYS 21 8.259 26.325 0.897 148 HA CYS 21 HA CYS 21 7.796 23.465 1.386 149 HB2 CYS 21 HB2 CYS 21 6.658 24.814 -1.019 150 HB3 CYS 21 HB3 CYS 21 5.999 23.498 -0.059 151 H PHE 22 H PHE 22 8.080 21.965 -0.341 152 HA PHE 22 HA PHE 22 10.162 22.697 -2.300 153 HB2 PHE 22 HB2 PHE 22 10.112 20.277 -0.472 154 HB3 PHE 22 HB3 PHE 22 11.186 20.435 -1.857 155 HD1 PHE 22 HD1 PHE 22 10.264 22.072 1.352 156 HD2 PHE 22 HD2 PHE 22 13.240 21.508 -1.636 157 HE1 PHE 22 HE1 PHE 22 11.879 23.307 2.735 158 HE2 PHE 22 HE2 PHE 22 14.860 22.744 -0.261 159 HZ PHE 22 HZ PHE 22 14.182 23.649 1.927 160 H GLY 23 H GLY 23 7.077 21.823 -2.051 161 HA2 GLY 23 HA2 GLY 23 6.850 20.802 -4.664 162 HA3 GLY 23 HA3 GLY 23 6.768 19.460 -3.532 163 HA PRO 24 HA PRO 24 2.471 21.177 -4.060 164 HB2 PRO 24 HB2 PRO 24 1.685 18.358 -4.189 165 HB3 PRO 24 HB3 PRO 24 1.384 19.657 -5.344 166 HG2 PRO 24 HG2 PRO 24 3.095 17.635 -5.857 167 HG3 PRO 24 HG3 PRO 24 3.336 19.269 -6.494 168 HD2 PRO 24 HD2 PRO 24 4.652 17.932 -4.158 169 HD3 PRO 24 HD3 PRO 24 5.364 18.978 -5.404 170 H SER 25 H SER 25 2.617 17.939 -2.558 171 HA SER 25 HA SER 25 1.351 19.088 -0.172 172 HB2 SER 25 HB2 SER 25 1.050 16.575 -1.595 173 HB3 SER 25 HB3 SER 25 1.444 16.259 0.103 174 HG SER 25 HG SER 25 -0.404 18.230 -0.116 175 H ILE 26 H ILE 26 4.144 19.460 -0.689 176 HA ILE 26 HA ILE 26 5.189 18.133 1.683 177 HB ILE 26 HB ILE 26 6.842 18.394 -0.777 178 HG12 ILE 26 HG12 ILE 26 5.428 15.891 0.016 179 HG13 ILE 26 HG13 ILE 26 4.778 16.998 -1.170 180 HG21 ILE 26 HG21 ILE 26 7.809 18.133 1.511 181 HG22 ILE 26 HG22 ILE 26 8.374 17.040 0.253 182 HG23 ILE 26 HG23 ILE 26 7.202 16.486 1.446 183 HD11 ILE 26 HD11 ILE 26 6.151 14.967 -1.955 184 HD12 ILE 26 HD12 ILE 26 7.543 15.940 -1.492 185 HD13 ILE 26 HD13 ILE 26 6.416 16.535 -2.711 186 H CYS 27 H CYS 27 5.934 19.579 3.052 187 HA CYS 27 HA CYS 27 7.377 21.935 2.097 188 HB2 CYS 27 HB2 CYS 27 4.992 22.581 2.439 189 HB3 CYS 27 HB3 CYS 27 5.129 22.075 4.118 190 H CYS 28 H CYS 28 9.290 22.065 3.210 191 HA CYS 28 HA CYS 28 9.286 20.950 5.937 192 HB2 CYS 28 HB2 CYS 28 11.843 20.834 4.516 193 HB3 CYS 28 HB3 CYS 28 11.112 19.617 5.541 194 H GLY 29 H GLY 29 10.790 21.833 7.524 195 HA2 GLY 29 HA2 GLY 29 12.396 24.111 6.790 196 HA3 GLY 29 HA3 GLY 29 11.114 24.380 7.955 197 H ASP 30 H ASP 30 13.250 24.957 9.062 198 HA ASP 30 HA ASP 30 14.996 23.025 10.128 199 HB2 ASP 30 HB2 ASP 30 15.473 24.967 11.769 200 HB3 ASP 30 HB3 ASP 30 15.768 25.242 10.058 201 H GLU 31 H GLU 31 12.506 24.632 11.336 202 HA GLU 31 HA GLU 31 12.076 22.797 13.630 203 HB2 GLU 31 HB2 GLU 31 10.299 24.961 14.112 204 HB3 GLU 31 HB3 GLU 31 11.589 24.304 15.113 205 HG2 GLU 31 HG2 GLU 31 13.205 25.648 13.819 206 HG3 GLU 31 HG3 GLU 31 11.846 26.388 12.971 207 H LEU 32 H LEU 32 10.670 24.017 10.942 208 HA LEU 32 HA LEU 32 8.182 22.794 11.332 209 HB2 LEU 32 HB2 LEU 32 9.512 24.703 9.634 210 HB3 LEU 32 HB3 LEU 32 8.363 23.736 8.789 211 HG LEU 32 HG LEU 32 7.751 25.251 11.298 212 HD11 LEU 32 HD11 LEU 32 8.281 26.888 9.739 213 HD12 LEU 32 HD12 LEU 32 6.517 26.762 9.682 214 HD13 LEU 32 HD13 LEU 32 7.497 26.017 8.417 215 HD21 LEU 32 HD21 LEU 32 5.751 24.301 11.272 216 HD22 LEU 32 HD22 LEU 32 6.360 23.217 10.035 217 HD23 LEU 32 HD23 LEU 32 5.518 24.688 9.566 218 H GLY 33 H GLY 33 10.979 21.384 10.587 219 HA2 GLY 33 HA2 GLY 33 11.652 19.753 9.047 220 HA3 GLY 33 HA3 GLY 33 10.371 18.984 9.916 221 H CYS 34 H CYS 34 9.413 17.715 8.255 222 HA CYS 34 HA CYS 34 8.361 19.324 6.047 223 HB2 CYS 34 HB2 CYS 34 10.369 17.699 5.594 224 HB3 CYS 34 HB3 CYS 34 9.072 16.539 5.471 225 H PHE 35 H PHE 35 6.372 19.269 5.702 226 HA PHE 35 HA PHE 35 4.760 17.164 6.968 227 HB2 PHE 35 HB2 PHE 35 3.809 19.728 5.644 228 HB3 PHE 35 HB3 PHE 35 2.867 18.631 6.642 229 HD1 PHE 35 HD1 PHE 35 5.575 21.112 6.663 230 HD2 PHE 35 HD2 PHE 35 2.846 18.828 8.994 231 HE1 PHE 35 HE1 PHE 35 6.185 22.420 8.643 232 HE2 PHE 35 HE2 PHE 35 3.447 20.139 10.987 233 HZ PHE 35 HZ PHE 35 5.121 21.932 10.819 234 H VAL 36 H VAL 36 4.805 15.544 5.482 235 HA VAL 36 HA VAL 36 4.581 16.381 2.700 236 HB VAL 36 HB VAL 36 5.178 13.530 3.436 237 HG11 VAL 36 HG11 VAL 36 6.391 13.597 1.319 238 HG12 VAL 36 HG12 VAL 36 6.045 15.330 1.158 239 HG13 VAL 36 HG13 VAL 36 4.726 14.144 1.097 240 HG21 VAL 36 HG21 VAL 36 6.723 15.022 4.766 241 HG22 VAL 36 HG22 VAL 36 7.284 15.689 3.237 242 HG23 VAL 36 HG23 VAL 36 7.548 13.986 3.600 243 H GLY 37 H GLY 37 2.555 16.979 2.826 244 HA2 GLY 37 HA2 GLY 37 0.472 15.877 1.848 245 HA3 GLY 37 HA3 GLY 37 0.577 14.791 3.215 246 H THR 38 H THR 38 0.318 15.731 5.366 247 HA THR 38 HA THR 38 -2.023 16.809 5.922 248 HB THR 38 HB THR 38 -0.485 16.128 7.667 249 HG1 THR 38 HG1 THR 38 -2.083 17.358 8.497 250 HG21 THR 38 HG21 THR 38 1.617 16.929 7.231 251 HG22 THR 38 HG22 THR 38 1.076 18.037 8.493 252 HG23 THR 38 HG23 THR 38 1.028 18.537 6.810 253 H ALA 39 H ALA 39 -3.172 18.446 5.569 254 HA ALA 39 HA ALA 39 -2.980 20.462 3.956 255 HB1 ALA 39 HB1 ALA 39 -4.887 20.006 5.520 256 HB2 ALA 39 HB2 ALA 39 -4.589 21.709 5.174 257 HB3 ALA 39 HB3 ALA 39 -4.061 21.016 6.707 258 H GLU 40 H GLU 40 -1.296 20.524 7.047 259 HA GLU 40 HA GLU 40 -0.591 23.183 7.225 260 HB2 GLU 40 HB2 GLU 40 0.342 20.702 8.352 261 HB3 GLU 40 HB3 GLU 40 1.704 21.758 7.996 262 HG2 GLU 40 HG2 GLU 40 0.829 23.492 9.363 263 HG3 GLU 40 HG3 GLU 40 -0.717 22.663 9.535 264 H ALA 41 H ALA 41 0.199 21.017 4.687 265 HA ALA 41 HA ALA 41 2.344 22.772 3.795 266 HB1 ALA 41 HB1 ALA 41 1.858 20.041 2.690 267 HB2 ALA 41 HB2 ALA 41 2.661 20.206 4.248 268 HB3 ALA 41 HB3 ALA 41 3.366 20.949 2.814 269 H LEU 42 H LEU 42 -0.473 20.835 2.806 270 HA LEU 42 HA LEU 42 -0.673 21.189 0.257 271 HB2 LEU 42 HB2 LEU 42 -2.888 20.702 0.315 272 HB3 LEU 42 HB3 LEU 42 -2.235 20.111 1.796 273 HG LEU 42 HG LEU 42 -3.850 21.061 2.923 274 HD11 LEU 42 HD11 LEU 42 -3.099 23.033 3.588 275 HD12 LEU 42 HD12 LEU 42 -4.274 23.671 2.446 276 HD13 LEU 42 HD13 LEU 42 -2.601 23.502 1.983 277 HD21 LEU 42 HD21 LEU 42 -5.798 21.785 1.880 278 HD22 LEU 42 HD22 LEU 42 -5.038 20.690 0.726 279 HD23 LEU 42 HD23 LEU 42 -4.918 22.433 0.496 280 H ARG 43 H ARG 43 -0.782 23.994 2.219 281 HA ARG 43 HA ARG 43 -2.047 25.633 0.242 282 HB2 ARG 43 HB2 ARG 43 -1.806 27.280 1.779 283 HB3 ARG 43 HB3 ARG 43 -1.240 26.019 2.863 284 HG2 ARG 43 HG2 ARG 43 0.407 27.573 3.088 285 HG3 ARG 43 HG3 ARG 43 1.083 26.545 1.824 286 HD2 ARG 43 HD2 ARG 43 0.843 28.131 0.217 287 HD3 ARG 43 HD3 ARG 43 -0.605 28.814 0.950 288 HE ARG 43 HE ARG 43 2.162 29.359 1.785 289 HH11 ARG 43 HH11 ARG 43 -1.226 30.237 1.759 290 HH12 ARG 43 HH12 ARG 43 -0.950 31.780 2.491 291 HH21 ARG 43 HH21 ARG 43 2.502 31.373 2.758 292 HH22 ARG 43 HH22 ARG 43 1.162 32.428 3.052 293 H CYS 44 H CYS 44 0.769 23.919 0.550 294 HA CYS 44 HA CYS 44 2.410 25.553 -1.235 295 HB2 CYS 44 HB2 CYS 44 2.892 22.780 -0.118 296 HB3 CYS 44 HB3 CYS 44 4.074 23.755 -0.973 297 H GLN 45 H GLN 45 -0.199 24.468 -2.117 298 HA GLN 45 HA GLN 45 0.614 22.579 -4.201 299 HB2 GLN 45 HB2 GLN 45 -1.594 22.391 -2.763 300 HB3 GLN 45 HB3 GLN 45 -2.197 23.578 -3.914 301 HG2 GLN 45 HG2 GLN 45 -2.145 22.113 -5.668 302 HG3 GLN 45 HG3 GLN 45 -0.847 21.151 -4.967 303 HE21 GLN 45 HE21 GLN 45 -1.735 19.175 -5.021 304 HE22 GLN 45 HE22 GLN 45 -3.187 18.727 -4.199 305 H GLU 46 H GLU 46 0.025 25.839 -3.469 306 HA GLU 46 HA GLU 46 -0.430 26.556 -6.242 307 HB2 GLU 46 HB2 GLU 46 0.096 28.431 -3.937 308 HB3 GLU 46 HB3 GLU 46 -0.680 28.801 -5.471 309 HG2 GLU 46 HG2 GLU 46 -1.853 26.854 -3.514 310 HG3 GLU 46 HG3 GLU 46 -2.171 28.586 -3.431 311 H GLU 47 H GLU 47 2.151 25.427 -4.658 312 HA GLU 47 HA GLU 47 4.067 27.408 -5.559 313 HB2 GLU 47 HB2 GLU 47 4.132 25.551 -3.550 314 HB3 GLU 47 HB3 GLU 47 5.069 24.744 -4.802 315 HG2 GLU 47 HG2 GLU 47 5.997 27.388 -4.727 316 HG3 GLU 47 HG3 GLU 47 5.828 26.880 -3.048 317 H ASN 48 H ASN 48 2.168 25.308 -7.117 318 HA ASN 48 HA ASN 48 4.167 24.227 -8.919 319 HB2 ASN 48 HB2 ASN 48 1.871 23.155 -8.120 320 HB3 ASN 48 HB3 ASN 48 1.243 24.062 -9.491 321 HD21 ASN 48 HD21 ASN 48 3.132 21.375 -8.463 322 HD22 ASN 48 HD22 ASN 48 3.391 20.685 -10.027 323 H TYR 49 H TYR 49 1.928 26.872 -8.691 324 HA TYR 49 HA TYR 49 1.631 27.556 -11.389 325 HB2 TYR 49 HB2 TYR 49 0.814 28.570 -8.942 326 HB3 TYR 49 HB3 TYR 49 1.787 29.868 -9.624 327 HD1 TYR 49 HD1 TYR 49 -0.956 27.520 -10.580 328 HD2 TYR 49 HD2 TYR 49 0.783 31.372 -11.065 329 HE1 TYR 49 HE1 TYR 49 -2.853 28.192 -11.994 330 HE2 TYR 49 HE2 TYR 49 -1.110 32.056 -12.479 331 HH TYR 49 HH TYR 49 -3.977 30.423 -12.633 332 H LEU 50 H LEU 50 4.574 27.228 -10.082 333 HA LEU 50 HA LEU 50 5.726 29.155 -11.920 334 HB2 LEU 50 HB2 LEU 50 7.425 29.726 -10.015 335 HB3 LEU 50 HB3 LEU 50 5.913 30.600 -10.162 336 HG LEU 50 HG LEU 50 5.100 28.708 -8.461 337 HD11 LEU 50 HD11 LEU 50 7.199 28.705 -6.805 338 HD12 LEU 50 HD12 LEU 50 8.052 28.678 -8.348 339 HD13 LEU 50 HD13 LEU 50 6.886 27.412 -7.963 340 HD21 LEU 50 HD21 LEU 50 4.825 30.994 -7.952 341 HD22 LEU 50 HD22 LEU 50 6.565 31.267 -7.878 342 HD23 LEU 50 HD23 LEU 50 5.767 30.320 -6.621 343 HA PRO 51 HA PRO 51 8.152 25.352 -12.207 344 HB2 PRO 51 HB2 PRO 51 9.050 25.725 -14.708 345 HB3 PRO 51 HB3 PRO 51 7.386 25.223 -14.382 346 HG2 PRO 51 HG2 PRO 51 8.449 27.939 -15.051 347 HG3 PRO 51 HG3 PRO 51 6.984 27.134 -15.641 348 HD2 PRO 51 HD2 PRO 51 7.003 29.007 -13.635 349 HD3 PRO 51 HD3 PRO 51 5.764 27.749 -13.805 350 H SER 52 H SER 52 9.253 27.368 -10.668 351 HA SER 52 HA SER 52 11.954 27.692 -11.794 352 HB2 SER 52 HB2 SER 52 12.144 29.547 -10.035 353 HB3 SER 52 HB3 SER 52 11.092 29.868 -11.414 354 HG SER 52 HG SER 52 9.687 30.295 -9.906 355 HA PRO 53 HA PRO 53 13.580 25.184 -8.569 356 HB2 PRO 53 HB2 PRO 53 15.941 26.368 -7.979 357 HB3 PRO 53 HB3 PRO 53 15.655 25.501 -9.491 358 HG2 PRO 53 HG2 PRO 53 15.602 28.445 -8.959 359 HG3 PRO 53 HG3 PRO 53 16.294 27.567 -10.335 360 HD2 PRO 53 HD2 PRO 53 13.884 28.816 -10.438 361 HD3 PRO 53 HD3 PRO 53 14.263 27.368 -11.391 362 H CYS 54 H CYS 54 14.891 25.450 -6.363 363 HA CYS 54 HA CYS 54 14.046 27.659 -4.716 364 HB2 CYS 54 HB2 CYS 54 12.289 25.515 -4.893 365 HB3 CYS 54 HB3 CYS 54 13.201 25.181 -3.427 366 H GLN 55 H GLN 55 16.239 27.991 -4.189 367 HA GLN 55 HA GLN 55 18.053 25.923 -3.621 368 HB2 GLN 55 HB2 GLN 55 19.518 27.587 -3.266 369 HB3 GLN 55 HB3 GLN 55 18.204 28.677 -3.674 370 HG2 GLN 55 HG2 GLN 55 18.469 29.595 -1.690 371 HG3 GLN 55 HG3 GLN 55 17.856 28.132 -0.961 372 HE21 GLN 55 HE21 GLN 55 19.654 29.913 0.234 373 HE22 GLN 55 HE22 GLN 55 21.148 29.084 0.493 374 H SER 56 H SER 56 19.217 25.895 -1.378 375 HA SER 56 HA SER 56 19.245 25.605 0.865 376 HB2 SER 56 HB2 SER 56 16.269 26.068 0.829 377 HB3 SER 56 HB3 SER 56 17.264 25.899 2.269 378 HG SER 56 HG SER 56 18.270 27.794 1.810 379 H GLY 57 H GLY 57 19.937 23.476 0.892 380 HA2 GLY 57 HA2 GLY 57 18.934 21.561 2.326 381 HA3 GLY 57 HA3 GLY 57 17.873 21.447 0.922 382 H GLN 58 H GLN 58 21.328 21.622 1.760 383 HA GLN 58 HA GLN 58 21.772 19.777 -0.496 384 HB2 GLN 58 HB2 GLN 58 22.759 22.170 -0.596 385 HB3 GLN 58 HB3 GLN 58 23.861 21.620 0.655 386 HG2 GLN 58 HG2 GLN 58 24.562 19.785 -0.892 387 HG3 GLN 58 HG3 GLN 58 23.597 20.568 -2.145 388 HE21 GLN 58 HE21 GLN 58 24.218 22.626 -2.895 389 HE22 GLN 58 HE22 GLN 58 25.831 23.211 -2.688 390 H LYS 59 H LYS 59 21.116 18.354 1.155 391 HA LYS 59 HA LYS 59 23.422 17.247 2.610 392 HB2 LYS 59 HB2 LYS 59 20.712 17.900 3.787 393 HB3 LYS 59 HB3 LYS 59 21.756 16.683 4.504 394 HG2 LYS 59 HG2 LYS 59 23.500 18.578 4.612 395 HG3 LYS 59 HG3 LYS 59 22.118 19.648 4.361 396 HD2 LYS 59 HD2 LYS 59 21.725 17.588 6.421 397 HD3 LYS 59 HD3 LYS 59 22.981 18.768 6.797 398 HE2 LYS 59 HE2 LYS 59 20.503 19.932 5.737 399 HE3 LYS 59 HE3 LYS 59 20.307 19.093 7.274 400 HZ1 LYS 59 HZ1 LYS 59 22.607 20.832 7.161 401 HZ2 LYS 59 HZ2 LYS 59 21.429 20.670 8.363 402 HZ3 LYS 59 HZ3 LYS 59 21.128 21.640 7.012 403 HA PRO 60 HA PRO 60 20.612 14.564 0.005 404 HB2 PRO 60 HB2 PRO 60 22.518 13.664 -1.720 405 HB3 PRO 60 HB3 PRO 60 21.519 15.094 -1.998 406 HG2 PRO 60 HG2 PRO 60 24.307 14.914 -0.922 407 HG3 PRO 60 HG3 PRO 60 23.637 16.054 -2.104 408 HD2 PRO 60 HD2 PRO 60 23.995 16.732 0.475 409 HD3 PRO 60 HD3 PRO 60 22.632 17.349 -0.471 410 H CYS 61 H CYS 61 20.441 13.294 1.832 411 HA CYS 61 HA CYS 61 22.287 11.029 2.008 412 HB2 CYS 61 HB2 CYS 61 21.760 10.725 4.204 413 HB3 CYS 61 HB3 CYS 61 21.489 12.458 4.092 414 H GLY 62 H GLY 62 20.459 9.024 2.904 415 HA2 GLY 62 HA2 GLY 62 18.926 7.543 1.985 416 HA3 GLY 62 HA3 GLY 62 18.079 9.008 1.508 417 H SER 63 H SER 63 17.424 7.538 -0.314 418 HA SER 63 HA SER 63 19.417 6.869 -2.258 419 HB2 SER 63 HB2 SER 63 16.397 6.835 -2.446 420 HB3 SER 63 HB3 SER 63 17.489 6.169 -3.658 421 HG SER 63 HG SER 63 17.674 4.449 -2.480 422 H GLY 64 H GLY 64 19.604 9.581 -1.741 423 HA2 GLY 64 HA2 GLY 64 20.259 11.099 -3.484 424 HA3 GLY 64 HA3 GLY 64 18.847 10.603 -4.383 425 H GLY 65 H GLY 65 18.003 11.348 -1.035 426 HA2 GLY 65 HA2 GLY 65 17.023 13.886 -2.096 427 HA3 GLY 65 HA3 GLY 65 16.356 13.001 -0.743 428 H ARG 66 H ARG 66 17.092 15.796 -0.811 429 HA ARG 66 HA ARG 66 19.411 15.835 0.952 430 HB2 ARG 66 HB2 ARG 66 19.138 18.399 0.667 431 HB3 ARG 66 HB3 ARG 66 19.836 17.447 -0.636 432 HG2 ARG 66 HG2 ARG 66 17.049 17.487 -1.072 433 HG3 ARG 66 HG3 ARG 66 17.518 19.129 -0.643 434 HD2 ARG 66 HD2 ARG 66 17.614 18.652 -3.082 435 HD3 ARG 66 HD3 ARG 66 19.137 19.203 -2.394 436 HE ARG 66 HE ARG 66 19.944 16.939 -2.518 437 HH11 ARG 66 HH11 ARG 66 16.939 17.522 -4.212 438 HH12 ARG 66 HH12 ARG 66 17.146 16.179 -5.283 439 HH21 ARG 66 HH21 ARG 66 20.205 15.178 -3.929 440 HH22 ARG 66 HH22 ARG 66 18.993 14.849 -5.123 441 H CYS 67 H CYS 67 19.444 16.947 2.916 442 HA CYS 67 HA CYS 67 17.126 16.586 4.489 443 HB2 CYS 67 HB2 CYS 67 19.893 16.866 4.947 444 HB3 CYS 67 HB3 CYS 67 19.088 18.113 5.886 445 H ALA 68 H ALA 68 15.503 17.891 4.551 446 HA ALA 68 HA ALA 68 15.869 20.822 4.284 447 HB1 ALA 68 HB1 ALA 68 13.993 20.668 3.066 448 HB2 ALA 68 HB2 ALA 68 13.156 20.182 4.534 449 HB3 ALA 68 HB3 ALA 68 13.826 18.958 3.467 450 H ALA 69 H ALA 69 15.545 18.398 6.271 451 HA ALA 69 HA ALA 69 15.450 19.946 8.667 452 HB1 ALA 69 HB1 ALA 69 13.030 18.245 8.658 453 HB2 ALA 69 HB2 ALA 69 13.018 19.816 7.861 454 HB3 ALA 69 HB3 ALA 69 13.393 19.694 9.584 455 H ALA 70 H ALA 70 15.473 18.940 10.716 456 HA ALA 70 HA ALA 70 17.278 16.904 10.994 457 HB1 ALA 70 HB1 ALA 70 16.804 18.397 12.810 458 HB2 ALA 70 HB2 ALA 70 16.579 16.739 13.350 459 HB3 ALA 70 HB3 ALA 70 15.180 17.751 12.977 460 H GLY 71 H GLY 71 17.218 14.854 10.668 461 HA2 GLY 71 HA2 GLY 71 16.523 12.695 10.349 462 HA3 GLY 71 HA3 GLY 71 15.239 13.065 11.494 463 H ILE 72 H ILE 72 15.838 14.656 8.324 464 HA ILE 72 HA ILE 72 13.593 13.310 7.204 465 HB ILE 72 HB ILE 72 12.087 14.968 7.075 466 HG12 ILE 72 HG12 ILE 72 13.353 17.460 7.425 467 HG13 ILE 72 HG13 ILE 72 14.340 16.579 6.294 468 HG21 ILE 72 HG21 ILE 72 12.027 16.412 9.044 469 HG22 ILE 72 HG22 ILE 72 13.714 16.031 9.366 470 HG23 ILE 72 HG23 ILE 72 12.493 14.762 9.463 471 HD11 ILE 72 HD11 ILE 72 11.548 16.320 5.793 472 HD12 ILE 72 HD12 ILE 72 12.842 16.774 4.691 473 HD13 ILE 72 HD13 ILE 72 12.088 17.991 5.726 474 H CYS 73 H CYS 73 14.615 12.629 5.423 475 HA CYS 73 HA CYS 73 16.334 14.531 3.994 476 HB2 CYS 73 HB2 CYS 73 16.622 11.738 4.589 477 HB3 CYS 73 HB3 CYS 73 16.559 11.949 2.844 478 H CYS 74 H CYS 74 15.032 15.634 2.650 479 HA CYS 74 HA CYS 74 12.936 14.204 1.259 480 HB2 CYS 74 HB2 CYS 74 12.702 16.518 2.411 481 HB3 CYS 74 HB3 CYS 74 13.414 17.130 0.922 482 H SER 75 H SER 75 13.070 13.435 -0.630 483 HA SER 75 HA SER 75 15.319 14.054 -2.369 484 HB2 SER 75 HB2 SER 75 13.753 11.734 -1.809 485 HB3 SER 75 HB3 SER 75 13.542 12.127 -3.515 486 HG SER 75 HG SER 75 15.352 10.911 -3.458 487 HA PRO 76 HA PRO 76 12.961 16.302 -5.332 488 HB2 PRO 76 HB2 PRO 76 13.392 15.229 -7.752 489 HB3 PRO 76 HB3 PRO 76 14.692 15.988 -6.826 490 HG2 PRO 76 HG2 PRO 76 14.035 13.082 -7.130 491 HG3 PRO 76 HG3 PRO 76 15.617 13.881 -7.189 492 HD2 PRO 76 HD2 PRO 76 14.658 12.595 -4.981 493 HD3 PRO 76 HD3 PRO 76 15.804 13.946 -4.903 494 H ASP 77 H ASP 77 11.586 13.856 -4.162 495 HA ASP 77 HA ASP 77 9.207 14.018 -5.819 496 HB2 ASP 77 HB2 ASP 77 10.745 11.494 -5.284 497 HB3 ASP 77 HB3 ASP 77 8.988 11.423 -5.382 498 H GLY 78 H GLY 78 10.754 12.715 -2.915 499 HA2 GLY 78 HA2 GLY 78 8.580 13.763 -1.311 500 HA3 GLY 78 HA3 GLY 78 8.846 12.053 -1.191 501 H CYS 79 H CYS 79 9.394 12.174 0.978 502 HA CYS 79 HA CYS 79 12.161 12.899 1.419 503 HB2 CYS 79 HB2 CYS 79 10.420 13.808 3.625 504 HB3 CYS 79 HB3 CYS 79 11.896 14.518 2.991 505 H HIS 80 H HIS 80 12.972 12.026 3.567 506 HA HIS 80 HA HIS 80 11.305 9.916 4.692 507 HB2 HIS 80 HB2 HIS 80 13.614 8.475 4.328 508 HB3 HIS 80 HB3 HIS 80 12.173 8.321 3.341 509 HD1 HIS 80 HD1 HIS 80 15.676 9.498 3.266 510 HD2 HIS 80 HD2 HIS 80 12.346 9.537 0.782 511 HE1 HIS 80 HE1 HIS 80 16.542 10.134 0.994 512 HE2 HIS 80 HE2 HIS 80 14.517 10.109 -0.505 513 H GLU 81 H GLU 81 12.303 8.875 6.552 514 HA GLU 81 HA GLU 81 13.457 10.772 8.295 515 HB2 GLU 81 HB2 GLU 81 13.823 8.741 9.789 516 HB3 GLU 81 HB3 GLU 81 12.166 9.057 9.300 517 HG2 GLU 81 HG2 GLU 81 12.174 6.858 8.851 518 HG3 GLU 81 HG3 GLU 81 12.899 7.381 7.334 519 H ASP 82 H ASP 82 15.596 10.950 9.095 520 HA ASP 82 HA ASP 82 17.602 9.229 7.866 521 HB2 ASP 82 HB2 ASP 82 18.769 10.873 6.737 522 HB3 ASP 82 HB3 ASP 82 17.096 11.361 6.448 523 HA PRO 83 HA PRO 83 19.398 9.716 11.889 524 HB2 PRO 83 HB2 PRO 83 21.834 8.470 10.997 525 HB3 PRO 83 HB3 PRO 83 20.515 7.768 11.930 526 HG2 PRO 83 HG2 PRO 83 21.139 7.042 9.358 527 HG3 PRO 83 HG3 PRO 83 19.536 6.850 10.088 528 HD2 PRO 83 HD2 PRO 83 20.536 8.983 8.240 529 HD3 PRO 83 HD3 PRO 83 18.962 8.160 8.270 530 H ALA 84 H ALA 84 21.013 10.959 9.054 531 HA ALA 84 HA ALA 84 23.235 12.120 10.371 532 HB1 ALA 84 HB1 ALA 84 21.926 12.527 7.722 533 HB2 ALA 84 HB2 ALA 84 23.557 11.967 8.094 534 HB3 ALA 84 HB3 ALA 84 23.148 13.673 8.277 535 H CYS 85 H CYS 85 20.028 13.290 9.572 536 HA CYS 85 HA CYS 85 20.580 15.816 10.939 537 HB2 CYS 85 HB2 CYS 85 18.311 14.874 9.204 538 HB3 CYS 85 HB3 CYS 85 18.292 16.416 10.043 539 H ASP 86 H ASP 86 20.310 13.254 12.272 540 HA ASP 86 HA ASP 86 17.830 13.198 13.678 541 HB2 ASP 86 HB2 ASP 86 19.731 11.316 13.199 542 HB3 ASP 86 HB3 ASP 86 20.127 11.777 14.848 543 HA PRO 87 HA PRO 87 20.720 14.828 17.168 544 HB2 PRO 87 HB2 PRO 87 22.757 16.407 16.232 545 HB3 PRO 87 HB3 PRO 87 22.920 14.725 16.740 546 HG2 PRO 87 HG2 PRO 87 22.733 15.857 14.005 547 HG3 PRO 87 HG3 PRO 87 23.686 14.485 14.593 548 HD2 PRO 87 HD2 PRO 87 21.381 14.212 13.208 549 HD3 PRO 87 HD3 PRO 87 21.920 13.028 14.407 550 H GLU 88 H GLU 88 19.256 16.165 17.769 551 HA GLU 88 HA GLU 88 17.577 17.910 16.936 552 HB2 GLU 88 HB2 GLU 88 18.665 19.669 18.756 553 HB3 GLU 88 HB3 GLU 88 17.542 18.376 19.148 554 HG2 GLU 88 HG2 GLU 88 19.303 16.936 19.805 555 HG3 GLU 88 HG3 GLU 88 20.521 18.048 19.177 556 H ALA 89 H ALA 89 17.899 18.414 15.229 557 HA ALA 89 HA ALA 89 20.121 20.068 14.215 558 HB1 ALA 89 HB1 ALA 89 19.246 17.802 13.015 559 HB2 ALA 89 HB2 ALA 89 19.966 19.166 12.135 560 HB3 ALA 89 HB3 ALA 89 18.217 19.007 12.210 561 H ALA 90 H ALA 90 17.440 20.496 15.644 562 HA ALA 90 HA ALA 90 15.846 22.119 13.976 563 HB1 ALA 90 HB1 ALA 90 16.287 22.478 16.941 564 HB2 ALA 90 HB2 ALA 90 15.044 21.491 16.173 565 HB3 ALA 90 HB3 ALA 90 15.006 23.245 16.005 566 H PHE 91 H PHE 91 16.507 23.814 12.744 567 HA PHE 91 HA PHE 91 18.744 25.442 13.677 568 HB2 PHE 91 HB2 PHE 91 18.549 24.745 11.253 569 HB3 PHE 91 HB3 PHE 91 17.167 25.820 11.121 570 HD1 PHE 91 HD1 PHE 91 20.280 26.459 13.025 571 HD2 PHE 91 HD2 PHE 91 17.959 27.403 9.583 572 HE1 PHE 91 HE1 PHE 91 21.773 28.351 12.541 573 HE2 PHE 91 HE2 PHE 91 19.452 29.297 9.095 574 HZ PHE 91 HZ PHE 91 21.360 29.774 10.575 575 H SER 92 H SER 92 18.560 27.465 14.512 576 HA SER 92 HA SER 92 17.640 29.398 15.308 577 HB2 SER 92 HB2 SER 92 15.247 28.837 13.539 578 HB3 SER 92 HB3 SER 92 15.736 30.391 14.215 579 HG SER 92 HG SER 92 16.399 29.435 11.892 580 H1 ALA 101 H1 ALA 101 -10.301 -8.262 14.763 581 H2 ALA 101 H2 ALA 101 -9.076 -9.123 13.928 582 H3 ALA 101 H3 ALA 101 -10.033 -7.967 13.095 583 HA ALA 101 HA ALA 101 -8.268 -6.711 13.425 584 HB1 ALA 101 HB1 ALA 101 -10.227 -5.823 14.739 585 HB2 ALA 101 HB2 ALA 101 -8.640 -5.193 15.183 586 HB3 ALA 101 HB3 ALA 101 -9.414 -6.422 16.185 587 H VAL 102 H VAL 102 -6.219 -6.482 14.080 588 HA VAL 102 HA VAL 102 -4.920 -7.435 16.342 589 HB VAL 102 HB VAL 102 -3.575 -9.286 14.950 590 HG11 VAL 102 HG11 VAL 102 -4.703 -9.455 17.209 591 HG12 VAL 102 HG12 VAL 102 -4.572 -10.945 16.275 592 HG13 VAL 102 HG13 VAL 102 -6.107 -10.089 16.350 593 HG21 VAL 102 HG21 VAL 102 -6.399 -9.680 13.981 594 HG22 VAL 102 HG22 VAL 102 -5.031 -10.759 13.716 595 HG23 VAL 102 HG23 VAL 102 -5.036 -9.158 12.997 596 H LEU 103 H LEU 103 -2.572 -7.206 16.139 597 HA LEU 103 HA LEU 103 -1.936 -5.198 14.064 598 HB2 LEU 103 HB2 LEU 103 0.079 -4.886 15.770 599 HB3 LEU 103 HB3 LEU 103 -1.467 -4.092 15.971 600 HG LEU 103 HG LEU 103 -1.709 -6.506 17.370 601 HD11 LEU 103 HD11 LEU 103 0.782 -6.649 17.122 602 HD12 LEU 103 HD12 LEU 103 0.196 -6.627 18.786 603 HD13 LEU 103 HD13 LEU 103 0.889 -5.170 18.075 604 HD21 LEU 103 HD21 LEU 103 -2.034 -5.111 19.232 605 HD22 LEU 103 HD22 LEU 103 -2.542 -4.138 17.851 606 HD23 LEU 103 HD23 LEU 103 -0.964 -3.864 18.589 607 H ASP 104 H ASP 104 -1.979 -7.598 13.239 608 HA ASP 104 HA ASP 104 0.780 -8.145 12.569 609 HB2 ASP 104 HB2 ASP 104 -1.643 -9.960 12.335 610 HB3 ASP 104 HB3 ASP 104 -0.062 -10.311 11.639 611 H LEU 105 H LEU 105 -1.923 -9.124 10.632 612 HA LEU 105 HA LEU 105 -1.515 -6.690 9.076 613 HB2 LEU 105 HB2 LEU 105 -0.391 -8.759 8.162 614 HB3 LEU 105 HB3 LEU 105 -2.000 -9.354 7.803 615 HG LEU 105 HG LEU 105 -2.373 -7.723 6.156 616 HD11 LEU 105 HD11 LEU 105 -1.510 -5.798 7.578 617 HD12 LEU 105 HD12 LEU 105 -1.150 -5.713 5.847 618 HD13 LEU 105 HD13 LEU 105 0.105 -6.215 6.975 619 HD21 LEU 105 HD21 LEU 105 0.349 -8.902 6.138 620 HD22 LEU 105 HD22 LEU 105 -0.038 -7.696 4.912 621 HD23 LEU 105 HD23 LEU 105 -1.010 -9.161 5.043 622 H ASP 106 H ASP 106 -3.608 -7.655 10.921 623 HA ASP 106 HA ASP 106 -6.025 -7.487 9.278 624 HB2 ASP 106 HB2 ASP 106 -5.440 -8.215 12.060 625 HB3 ASP 106 HB3 ASP 106 -6.795 -7.112 11.935 626 H VAL 107 H VAL 107 -5.558 -5.656 12.379 627 HA VAL 107 HA VAL 107 -5.035 -3.335 10.717 628 HB VAL 107 HB VAL 107 -7.420 -3.179 11.255 629 HG11 VAL 107 HG11 VAL 107 -6.506 -3.958 13.969 630 HG12 VAL 107 HG12 VAL 107 -7.944 -4.434 13.072 631 HG13 VAL 107 HG13 VAL 107 -7.868 -2.850 13.840 632 HG21 VAL 107 HG21 VAL 107 -7.289 -0.998 11.670 633 HG22 VAL 107 HG22 VAL 107 -5.545 -1.247 11.760 634 HG23 VAL 107 HG23 VAL 107 -6.512 -1.248 13.234 635 H ARG 108 H ARG 108 -3.052 -2.765 11.422 636 HA ARG 108 HA ARG 108 -2.268 -3.641 14.037 637 HB2 ARG 108 HB2 ARG 108 -0.750 -3.549 11.952 638 HB3 ARG 108 HB3 ARG 108 -0.643 -1.826 12.295 639 HG2 ARG 108 HG2 ARG 108 -0.037 -3.857 14.394 640 HG3 ARG 108 HG3 ARG 108 1.167 -3.412 13.203 641 HD2 ARG 108 HD2 ARG 108 1.559 -1.440 14.170 642 HD3 ARG 108 HD3 ARG 108 -0.150 -1.126 14.449 643 HE ARG 108 HE ARG 108 0.013 -2.376 16.482 644 HH11 ARG 108 HH11 ARG 108 3.060 -1.700 14.918 645 HH12 ARG 108 HH12 ARG 108 3.993 -1.967 16.347 646 HH21 ARG 108 HH21 ARG 108 1.236 -2.732 18.360 647 HH22 ARG 108 HH22 ARG 108 2.958 -2.553 18.308 648 H THR 109 H THR 109 -2.880 -2.454 15.774 649 HA THR 109 HA THR 109 -3.796 0.205 15.215 650 HB THR 109 HB THR 109 -3.605 0.572 17.714 651 HG1 THR 109 HG1 THR 109 -2.645 -2.090 17.615 652 HG21 THR 109 HG21 THR 109 -5.589 -0.363 18.012 653 HG22 THR 109 HG22 THR 109 -4.948 -1.985 17.751 654 HG23 THR 109 HG23 THR 109 -5.435 -0.997 16.374 655 H CYS 110 H CYS 110 -2.487 1.548 14.292 656 HA CYS 110 HA CYS 110 0.347 1.567 14.739 657 HB2 CYS 110 HB2 CYS 110 -1.473 3.116 12.949 658 HB3 CYS 110 HB3 CYS 110 0.204 3.606 13.146 659 H LEU 111 H LEU 111 1.261 2.498 16.494 660 HA LEU 111 HA LEU 111 0.442 3.952 18.498 661 HB2 LEU 111 HB2 LEU 111 2.872 3.466 17.643 662 HB3 LEU 111 HB3 LEU 111 2.813 5.142 17.131 663 HG LEU 111 HG LEU 111 2.129 5.654 19.565 664 HD11 LEU 111 HD11 LEU 111 2.093 4.022 21.074 665 HD12 LEU 111 HD12 LEU 111 3.662 3.411 20.550 666 HD13 LEU 111 HD13 LEU 111 2.191 2.881 19.733 667 HD21 LEU 111 HD21 LEU 111 4.393 5.980 18.340 668 HD22 LEU 111 HD22 LEU 111 4.924 4.624 19.335 669 HD23 LEU 111 HD23 LEU 111 4.333 6.099 20.098 670 HA PRO 112 HA PRO 112 -1.627 7.625 17.143 671 HB2 PRO 112 HB2 PRO 112 -1.806 8.879 19.566 672 HB3 PRO 112 HB3 PRO 112 -2.884 7.596 19.012 673 HG2 PRO 112 HG2 PRO 112 -0.589 7.462 20.892 674 HG3 PRO 112 HG3 PRO 112 -2.102 6.548 20.893 675 HD2 PRO 112 HD2 PRO 112 0.305 5.546 20.048 676 HD3 PRO 112 HD3 PRO 112 -1.272 4.946 19.509 677 H CYS 113 H CYS 113 -1.426 9.671 16.831 678 HA CYS 113 HA CYS 113 0.735 11.307 17.766 679 HB2 CYS 113 HB2 CYS 113 2.369 11.196 16.288 680 HB3 CYS 113 HB3 CYS 113 1.598 9.720 15.745 681 H GLY 114 H GLY 114 1.154 13.372 16.361 682 HA2 GLY 114 HA2 GLY 114 0.285 15.338 15.478 683 HA3 GLY 114 HA3 GLY 114 -1.234 14.495 15.162 684 HA PRO 115 HA PRO 115 -1.994 17.389 18.809 685 HB2 PRO 115 HB2 PRO 115 -4.490 18.017 18.143 686 HB3 PRO 115 HB3 PRO 115 -3.121 18.735 17.253 687 HG2 PRO 115 HG2 PRO 115 -4.424 16.111 16.714 688 HG3 PRO 115 HG3 PRO 115 -4.571 17.553 15.640 689 HD2 PRO 115 HD2 PRO 115 -2.668 15.925 15.039 690 HD3 PRO 115 HD3 PRO 115 -2.104 17.577 15.438 691 H GLY 116 H GLY 116 -2.013 15.799 20.240 692 HA2 GLY 116 HA2 GLY 116 -3.092 14.728 22.051 693 HA3 GLY 116 HA3 GLY 116 -4.579 14.820 21.126 694 H GLY 117 H GLY 117 -2.242 13.767 19.208 695 HA2 GLY 117 HA2 GLY 117 -1.607 11.704 18.434 696 HA3 GLY 117 HA3 GLY 117 -2.110 11.142 19.982 697 H LYS 118 H LYS 118 -3.985 12.697 17.480 698 HA LYS 118 HA LYS 118 -5.880 10.475 17.429 699 HB2 LYS 118 HB2 LYS 118 -6.464 12.506 15.492 700 HB3 LYS 118 HB3 LYS 118 -7.387 12.075 16.922 701 HG2 LYS 118 HG2 LYS 118 -5.326 13.584 17.936 702 HG3 LYS 118 HG3 LYS 118 -5.682 14.373 16.401 703 HD2 LYS 118 HD2 LYS 118 -8.169 13.872 17.466 704 HD3 LYS 118 HD3 LYS 118 -7.185 14.278 18.878 705 HE2 LYS 118 HE2 LYS 118 -8.170 16.293 18.003 706 HE3 LYS 118 HE3 LYS 118 -6.432 16.326 17.710 707 HZ1 LYS 118 HZ1 LYS 118 -6.838 16.602 15.565 708 HZ2 LYS 118 HZ2 LYS 118 -8.505 16.564 15.846 709 HZ3 LYS 118 HZ3 LYS 118 -7.674 15.133 15.501 710 H GLY 119 H GLY 119 -3.001 10.709 16.355 711 HA2 GLY 119 HA2 GLY 119 -3.551 10.080 13.550 712 HA3 GLY 119 HA3 GLY 119 -2.055 10.760 14.133 713 H ARG 120 H ARG 120 -1.319 9.004 12.650 714 HA ARG 120 HA ARG 120 -0.694 6.699 14.251 715 HB2 ARG 120 HB2 ARG 120 -2.469 6.811 11.944 716 HB3 ARG 120 HB3 ARG 120 -1.201 5.599 11.765 717 HG2 ARG 120 HG2 ARG 120 -2.171 4.249 13.261 718 HG3 ARG 120 HG3 ARG 120 -2.516 5.563 14.371 719 HD2 ARG 120 HD2 ARG 120 -4.542 4.432 13.539 720 HD3 ARG 120 HD3 ARG 120 -4.493 6.142 13.127 721 HE ARG 120 HE ARG 120 -3.899 3.955 11.240 722 HH11 ARG 120 HH11 ARG 120 -5.103 7.168 11.914 723 HH12 ARG 120 HH12 ARG 120 -5.630 7.439 10.290 724 HH21 ARG 120 HH21 ARG 120 -4.578 4.322 9.111 725 HH22 ARG 120 HH22 ARG 120 -5.334 5.824 8.697 726 H CYS 121 H CYS 121 1.370 5.954 13.797 727 HA CYS 121 HA CYS 121 2.879 7.529 11.829 728 HB2 CYS 121 HB2 CYS 121 4.265 5.917 13.920 729 HB3 CYS 121 HB3 CYS 121 4.726 7.456 13.207 730 H PHE 122 H PHE 122 4.696 6.559 10.776 731 HA PHE 122 HA PHE 122 4.441 3.661 10.282 732 HB2 PHE 122 HB2 PHE 122 4.680 5.875 8.221 733 HB3 PHE 122 HB3 PHE 122 4.912 4.167 7.856 734 HD1 PHE 122 HD1 PHE 122 2.424 6.575 9.209 735 HD2 PHE 122 HD2 PHE 122 3.096 2.820 7.318 736 HE1 PHE 122 HE1 PHE 122 -0.002 6.304 8.894 737 HE2 PHE 122 HE2 PHE 122 0.673 2.542 7.001 738 HZ PHE 122 HZ PHE 122 -0.881 4.283 7.790 739 H GLY 123 H GLY 123 6.386 5.879 11.562 740 HA2 GLY 123 HA2 GLY 123 8.746 4.365 11.328 741 HA3 GLY 123 HA3 GLY 123 8.833 5.711 10.201 742 HA PRO 124 HA PRO 124 10.431 7.171 14.327 743 HB2 PRO 124 HB2 PRO 124 12.526 8.445 12.724 744 HB3 PRO 124 HB3 PRO 124 12.680 7.314 14.068 745 HG2 PRO 124 HG2 PRO 124 13.265 6.625 11.526 746 HG3 PRO 124 HG3 PRO 124 12.614 5.468 12.698 747 HD2 PRO 124 HD2 PRO 124 11.204 6.936 10.499 748 HD3 PRO 124 HD3 PRO 124 11.029 5.245 11.018 749 H SER 125 H SER 125 11.245 9.293 11.568 750 HA SER 125 HA SER 125 9.730 11.433 12.889 751 HB2 SER 125 HB2 SER 125 12.221 11.364 11.388 752 HB3 SER 125 HB3 SER 125 11.107 12.538 10.658 753 HG SER 125 HG SER 125 10.851 13.156 13.055 754 H ILE 126 H ILE 126 8.393 9.343 11.464 755 HA ILE 126 HA ILE 126 7.096 10.974 9.424 756 HB ILE 126 HB ILE 126 7.637 8.054 8.992 757 HG12 ILE 126 HG12 ILE 126 9.278 10.316 7.849 758 HG13 ILE 126 HG13 ILE 126 9.764 9.424 9.275 759 HG21 ILE 126 HG21 ILE 126 6.030 9.921 7.736 760 HG22 ILE 126 HG22 ILE 126 6.477 8.328 7.134 761 HG23 ILE 126 HG23 ILE 126 7.420 9.742 6.674 762 HD11 ILE 126 HD11 ILE 126 10.860 8.605 7.262 763 HD12 ILE 126 HD12 ILE 126 9.291 8.212 6.567 764 HD13 ILE 126 HD13 ILE 126 9.854 7.374 8.013 765 H CYS 127 H CYS 127 5.007 11.121 9.839 766 HA CYS 127 HA CYS 127 3.537 8.802 10.844 767 HB2 CYS 127 HB2 CYS 127 4.181 10.210 12.803 768 HB3 CYS 127 HB3 CYS 127 3.327 11.561 12.070 769 H CYS 128 H CYS 128 1.754 8.493 9.526 770 HA CYS 128 HA CYS 128 0.683 10.957 8.322 771 HB2 CYS 128 HB2 CYS 128 0.254 8.541 6.740 772 HB3 CYS 128 HB3 CYS 128 0.746 10.141 6.228 773 H GLY 129 H GLY 129 -1.626 10.942 7.625 774 HA2 GLY 129 HA2 GLY 129 -3.313 8.840 8.580 775 HA3 GLY 129 HA3 GLY 129 -3.515 10.370 9.409 776 H ASP 130 H ASP 130 -5.672 9.792 8.352 777 HA ASP 130 HA ASP 130 -6.164 10.223 5.646 778 HB2 ASP 130 HB2 ASP 130 -8.560 10.566 6.513 779 HB3 ASP 130 HB3 ASP 130 -7.790 9.010 6.801 780 H GLU 131 H GLU 131 -6.556 12.305 8.403 781 HA GLU 131 HA GLU 131 -6.415 14.615 6.583 782 HB2 GLU 131 HB2 GLU 131 -7.563 15.543 8.958 783 HB3 GLU 131 HB3 GLU 131 -8.438 15.258 7.466 784 HG2 GLU 131 HG2 GLU 131 -9.060 13.041 8.220 785 HG3 GLU 131 HG3 GLU 131 -8.093 13.233 9.678 786 H LEU 132 H LEU 132 -4.275 13.132 7.889 787 HA LEU 132 HA LEU 132 -3.224 15.158 9.507 788 HB2 LEU 132 HB2 LEU 132 -4.074 12.522 10.317 789 HB3 LEU 132 HB3 LEU 132 -2.358 12.689 10.440 790 HG LEU 132 HG LEU 132 -4.391 14.513 11.741 791 HD11 LEU 132 HD11 LEU 132 -4.683 12.715 13.047 792 HD12 LEU 132 HD12 LEU 132 -3.222 13.338 13.820 793 HD13 LEU 132 HD13 LEU 132 -3.110 12.021 12.651 794 HD21 LEU 132 HD21 LEU 132 -2.622 15.534 12.923 795 HD22 LEU 132 HD22 LEU 132 -2.157 15.516 11.224 796 HD23 LEU 132 HD23 LEU 132 -1.455 14.349 12.344 797 H GLY 133 H GLY 133 -3.337 13.511 6.753 798 HA2 GLY 133 HA2 GLY 133 -1.894 12.442 5.389 799 HA3 GLY 133 HA3 GLY 133 -1.265 14.030 5.532 800 H CYS 134 H CYS 134 0.878 13.915 5.648 801 HA CYS 134 HA CYS 134 2.008 12.121 7.645 802 HB2 CYS 134 HB2 CYS 134 2.160 11.184 5.201 803 HB3 CYS 134 HB3 CYS 134 3.591 12.191 5.172 804 H PHE 135 H PHE 135 3.346 12.932 8.887 805 HA PHE 135 HA PHE 135 4.515 15.548 8.196 806 HB2 PHE 135 HB2 PHE 135 4.385 14.235 10.938 807 HB3 PHE 135 HB3 PHE 135 4.859 15.882 10.564 808 HD1 PHE 135 HD1 PHE 135 2.014 13.556 10.683 809 HD2 PHE 135 HD2 PHE 135 3.272 17.611 10.384 810 HE1 PHE 135 HE1 PHE 135 -0.310 14.293 10.973 811 HE2 PHE 135 HE2 PHE 135 0.946 18.356 10.685 812 HZ PHE 135 HZ PHE 135 -0.847 16.701 10.974 813 H VAL 136 H VAL 136 6.353 14.936 7.169 814 HA VAL 136 HA VAL 136 7.765 12.663 8.334 815 HB VAL 136 HB VAL 136 8.552 13.901 5.708 816 HG11 VAL 136 HG11 VAL 136 9.941 12.160 6.898 817 HG12 VAL 136 HG12 VAL 136 9.473 11.776 5.241 818 HG13 VAL 136 HG13 VAL 136 8.617 11.040 6.590 819 HG21 VAL 136 HG21 VAL 136 6.095 13.472 5.625 820 HG22 VAL 136 HG22 VAL 136 6.415 11.793 6.056 821 HG23 VAL 136 HG23 VAL 136 7.005 12.433 4.526 822 H GLY 137 H GLY 137 8.399 13.725 10.087 823 HA2 GLY 137 HA2 GLY 137 10.736 14.513 10.736 824 HA3 GLY 137 HA3 GLY 137 10.429 15.848 9.648 825 H THR 138 H THR 138 8.656 17.308 10.201 826 HA THR 138 HA THR 138 8.903 18.694 12.431 827 HB THR 138 HB THR 138 7.396 19.386 10.673 828 HG1 THR 138 HG1 THR 138 6.978 20.510 12.485 829 HG21 THR 138 HG21 THR 138 6.032 17.774 9.920 830 HG22 THR 138 HG22 THR 138 4.939 18.444 11.133 831 HG23 THR 138 HG23 THR 138 5.886 17.006 11.501 832 H ALA 139 H ALA 139 8.856 18.481 14.399 833 HA ALA 139 HA ALA 139 8.593 16.561 16.104 834 HB1 ALA 139 HB1 ALA 139 8.736 19.065 16.647 835 HB2 ALA 139 HB2 ALA 139 8.075 17.982 17.871 836 HB3 ALA 139 HB3 ALA 139 6.991 18.966 16.887 837 H GLU 140 H GLU 140 5.650 17.978 14.717 838 HA GLU 140 HA GLU 140 3.664 16.725 16.125 839 HB2 GLU 140 HB2 GLU 140 3.929 17.942 13.523 840 HB3 GLU 140 HB3 GLU 140 2.837 16.566 13.448 841 HG2 GLU 140 HG2 GLU 140 1.427 17.496 15.124 842 HG3 GLU 140 HG3 GLU 140 2.586 18.777 15.469 843 H ALA 141 H ALA 141 6.068 15.224 14.686 844 HA ALA 141 HA ALA 141 4.646 12.663 14.433 845 HB1 ALA 141 HB1 ALA 141 7.130 12.869 12.864 846 HB2 ALA 141 HB2 ALA 141 5.761 13.806 12.271 847 HB3 ALA 141 HB3 ALA 141 5.609 12.063 12.484 848 H LEU 142 H LEU 142 7.824 14.168 14.971 849 HA LEU 142 HA LEU 142 9.332 12.205 15.710 850 HB2 LEU 142 HB2 LEU 142 10.722 13.659 16.770 851 HB3 LEU 142 HB3 LEU 142 9.793 14.610 15.672 852 HG LEU 142 HG LEU 142 9.361 16.064 17.258 853 HD11 LEU 142 HD11 LEU 142 7.422 15.510 18.160 854 HD12 LEU 142 HD12 LEU 142 8.388 15.058 19.560 855 HD13 LEU 142 HD13 LEU 142 7.893 13.849 18.405 856 HD21 LEU 142 HD21 LEU 142 10.745 14.297 19.238 857 HD22 LEU 142 HD22 LEU 142 10.544 16.048 19.312 858 HD23 LEU 142 HD23 LEU 142 11.570 15.329 18.069 859 H ARG 143 H ARG 143 6.540 12.832 17.588 860 HA ARG 143 HA ARG 143 7.527 11.491 19.920 861 HB2 ARG 143 HB2 ARG 143 5.497 11.993 20.794 862 HB3 ARG 143 HB3 ARG 143 5.225 12.922 19.330 863 HG2 ARG 143 HG2 ARG 143 3.323 11.661 19.439 864 HG3 ARG 143 HG3 ARG 143 4.323 10.668 18.381 865 HD2 ARG 143 HD2 ARG 143 4.598 9.041 19.952 866 HD3 ARG 143 HD3 ARG 143 4.506 10.169 21.300 867 HE ARG 143 HE ARG 143 2.217 9.072 19.813 868 HH11 ARG 143 HH11 ARG 143 3.499 10.673 22.651 869 HH12 ARG 143 HH12 ARG 143 2.012 10.559 23.526 870 HH21 ARG 143 HH21 ARG 143 0.275 8.949 20.967 871 HH22 ARG 143 HH22 ARG 143 0.187 9.578 22.578 872 H CYS 144 H CYS 144 6.991 10.628 16.702 873 HA CYS 144 HA CYS 144 6.176 7.890 17.263 874 HB2 CYS 144 HB2 CYS 144 6.798 9.366 14.685 875 HB3 CYS 144 HB3 CYS 144 6.163 7.735 14.792 876 H GLN 145 H GLN 145 8.680 9.055 18.212 877 HA GLN 145 HA GLN 145 10.692 7.648 16.601 878 HB2 GLN 145 HB2 GLN 145 11.031 10.046 17.657 879 HB3 GLN 145 HB3 GLN 145 11.404 9.124 19.109 880 HG2 GLN 145 HG2 GLN 145 13.325 8.248 18.230 881 HG3 GLN 145 HG3 GLN 145 12.747 8.364 16.570 882 HE21 GLN 145 HE21 GLN 145 14.372 9.473 15.656 883 HE22 GLN 145 HE22 GLN 145 14.862 11.062 16.127 884 H GLU 146 H GLU 146 8.665 7.460 19.320 885 HA GLU 146 HA GLU 146 10.267 5.381 20.561 886 HB2 GLU 146 HB2 GLU 146 7.459 6.207 21.294 887 HB3 GLU 146 HB3 GLU 146 8.630 5.362 22.298 888 HG2 GLU 146 HG2 GLU 146 9.104 8.149 21.292 889 HG3 GLU 146 HG3 GLU 146 8.232 7.820 22.786 890 H GLU 147 H GLU 147 8.557 5.494 17.823 891 HA GLU 147 HA GLU 147 7.007 3.078 18.220 892 HB2 GLU 147 HB2 GLU 147 6.751 5.174 16.481 893 HB3 GLU 147 HB3 GLU 147 7.518 3.966 15.459 894 HG2 GLU 147 HG2 GLU 147 5.482 2.625 16.845 895 HG3 GLU 147 HG3 GLU 147 4.791 4.160 16.320 896 H ASN 148 H ASN 148 10.181 3.662 18.090 897 HA ASN 148 HA ASN 148 10.901 1.528 16.263 898 HB2 ASN 148 HB2 ASN 148 12.200 3.780 16.806 899 HB3 ASN 148 HB3 ASN 148 12.884 2.799 18.097 900 HD21 ASN 148 HD21 ASN 148 12.775 3.397 14.708 901 HD22 ASN 148 HD22 ASN 148 14.026 2.296 14.255 902 H TYR 149 H TYR 149 10.419 2.091 19.654 903 HA TYR 149 HA TYR 149 11.900 -0.011 20.762 904 HB2 TYR 149 HB2 TYR 149 10.192 1.969 21.685 905 HB3 TYR 149 HB3 TYR 149 9.380 0.474 22.139 906 HD1 TYR 149 HD1 TYR 149 12.753 2.074 22.273 907 HD2 TYR 149 HD2 TYR 149 9.963 -0.547 24.131 908 HE1 TYR 149 HE1 TYR 149 14.257 1.851 24.204 909 HE2 TYR 149 HE2 TYR 149 11.459 -0.775 26.069 910 HH TYR 149 HH TYR 149 14.701 0.480 26.048 911 H LEU 150 H LEU 150 9.722 -0.572 18.433 912 HA LEU 150 HA LEU 150 9.193 -3.249 19.421 913 HB2 LEU 150 HB2 LEU 150 6.773 -2.949 18.469 914 HB3 LEU 150 HB3 LEU 150 7.152 -2.505 20.121 915 HG LEU 150 HG LEU 150 7.575 -0.128 18.973 916 HD11 LEU 150 HD11 LEU 150 5.767 0.234 17.294 917 HD12 LEU 150 HD12 LEU 150 5.581 -1.516 17.197 918 HD13 LEU 150 HD13 LEU 150 7.100 -0.762 16.720 919 HD21 LEU 150 HD21 LEU 150 6.039 0.174 20.560 920 HD22 LEU 150 HD22 LEU 150 5.349 -1.430 20.314 921 HD23 LEU 150 HD23 LEU 150 4.836 -0.084 19.297 922 HA PRO 151 HA PRO 151 10.279 -3.582 15.046 923 HB2 PRO 151 HB2 PRO 151 11.189 -6.104 15.124 924 HB3 PRO 151 HB3 PRO 151 12.134 -4.754 15.764 925 HG2 PRO 151 HG2 PRO 151 10.460 -6.756 17.228 926 HG3 PRO 151 HG3 PRO 151 12.057 -6.109 17.649 927 HD2 PRO 151 HD2 PRO 151 9.704 -5.221 18.747 928 HD3 PRO 151 HD3 PRO 151 11.173 -4.235 18.620 929 H SER 152 H SER 152 7.579 -3.701 15.629 930 HA SER 152 HA SER 152 6.701 -6.184 14.311 931 HB2 SER 152 HB2 SER 152 4.429 -5.572 15.323 932 HB3 SER 152 HB3 SER 152 5.671 -6.125 16.446 933 HG SER 152 HG SER 152 5.669 -4.233 17.363 934 HA PRO 153 HA PRO 153 5.232 -3.831 10.897 935 HB2 PRO 153 HB2 PRO 153 2.952 -5.106 10.190 936 HB3 PRO 153 HB3 PRO 153 4.557 -5.805 9.944 937 HG2 PRO 153 HG2 PRO 153 2.570 -6.340 12.118 938 HG3 PRO 153 HG3 PRO 153 3.583 -7.485 11.218 939 HD2 PRO 153 HD2 PRO 153 4.195 -6.615 13.717 940 HD3 PRO 153 HD3 PRO 153 5.427 -7.074 12.525 941 H CYS 154 H CYS 154 2.989 -2.992 9.928 942 HA CYS 154 HA CYS 154 1.131 -1.999 11.890 943 HB2 CYS 154 HB2 CYS 154 3.375 -0.432 11.424 944 HB3 CYS 154 HB3 CYS 154 2.154 0.273 10.372 945 H GLN 155 H GLN 155 -0.572 -2.958 10.662 946 HA GLN 155 HA GLN 155 -0.685 -2.850 7.855 947 HB2 GLN 155 HB2 GLN 155 -2.614 -3.958 8.115 948 HB3 GLN 155 HB3 GLN 155 -2.292 -3.881 9.841 949 HG2 GLN 155 HG2 GLN 155 -4.212 -2.827 10.062 950 HG3 GLN 155 HG3 GLN 155 -3.520 -1.452 9.242 951 HE21 GLN 155 HE21 GLN 155 -6.230 -2.150 9.252 952 HE22 GLN 155 HE22 GLN 155 -6.699 -2.529 7.633 953 H SER 156 H SER 156 -2.730 -1.776 6.771 954 HA SER 156 HA SER 156 -3.940 0.036 6.174 955 HB2 SER 156 HB2 SER 156 -2.610 1.513 8.449 956 HB3 SER 156 HB3 SER 156 -3.942 2.116 7.464 957 HG SER 156 HG SER 156 -4.341 0.916 9.602 958 H GLY 157 H GLY 157 -3.580 0.868 4.551 959 HA2 GLY 157 HA2 GLY 157 -2.705 2.549 3.024 960 HA3 GLY 157 HA3 GLY 157 -1.153 2.357 3.829 961 H GLN 158 H GLN 158 -3.422 0.784 1.611 962 HA GLN 158 HA GLN 158 -1.050 -0.528 0.433 963 HB2 GLN 158 HB2 GLN 158 -2.830 -1.996 1.554 964 HB3 GLN 158 HB3 GLN 158 -3.922 -1.479 0.282 965 HG2 GLN 158 HG2 GLN 158 -2.299 -2.430 -1.370 966 HG3 GLN 158 HG3 GLN 158 -1.418 -3.111 0.001 967 HE21 GLN 158 HE21 GLN 158 -2.457 -4.694 1.305 968 HE22 GLN 158 HE22 GLN 158 -3.780 -5.622 0.694 969 H LYS 159 H LYS 159 -1.311 1.780 -0.244 970 HA LYS 159 HA LYS 159 -2.567 1.830 -2.905 971 HB2 LYS 159 HB2 LYS 159 -2.209 4.038 -0.952 972 HB3 LYS 159 HB3 LYS 159 -2.481 4.349 -2.667 973 HG2 LYS 159 HG2 LYS 159 -4.507 2.804 -2.417 974 HG3 LYS 159 HG3 LYS 159 -4.289 3.022 -0.680 975 HD2 LYS 159 HD2 LYS 159 -4.274 5.489 -2.287 976 HD3 LYS 159 HD3 LYS 159 -5.812 4.623 -2.228 977 HE2 LYS 159 HE2 LYS 159 -4.490 4.848 0.367 978 HE3 LYS 159 HE3 LYS 159 -4.907 6.404 -0.349 979 HZ1 LYS 159 HZ1 LYS 159 -7.057 6.067 0.044 980 HZ2 LYS 159 HZ2 LYS 159 -6.591 4.787 1.046 981 HZ3 LYS 159 HZ3 LYS 159 -7.025 4.486 -0.561 982 HA PRO 160 HA PRO 160 2.107 2.187 -2.906 983 HB2 PRO 160 HB2 PRO 160 2.751 0.107 -4.544 984 HB3 PRO 160 HB3 PRO 160 2.654 0.006 -2.782 985 HG2 PRO 160 HG2 PRO 160 0.597 -0.732 -4.833 986 HG3 PRO 160 HG3 PRO 160 1.092 -1.619 -3.379 987 HD2 PRO 160 HD2 PRO 160 -1.155 -0.150 -3.413 988 HD3 PRO 160 HD3 PRO 160 -0.133 -0.238 -1.966 989 H CYS 161 H CYS 161 1.812 4.096 -4.027 990 HA CYS 161 HA CYS 161 2.115 3.903 -6.962 991 HB2 CYS 161 HB2 CYS 161 1.075 5.947 -7.181 992 HB3 CYS 161 HB3 CYS 161 0.297 5.426 -5.694 993 H GLY 162 H GLY 162 3.763 5.952 -7.683 994 HA2 GLY 162 HA2 GLY 162 5.784 6.957 -7.366 995 HA3 GLY 162 HA3 GLY 162 5.671 6.570 -5.653 996 H SER 163 H SER 163 8.024 6.085 -6.062 997 HA SER 163 HA SER 163 8.600 3.734 -7.582 998 HB2 SER 163 HB2 SER 163 10.311 5.280 -5.623 999 HB3 SER 163 HB3 SER 163 10.889 3.958 -6.638 1000 HG SER 163 HG SER 163 10.992 6.363 -7.333 1001 H GLY 164 H GLY 164 6.580 3.152 -5.697 1002 HA2 GLY 164 HA2 GLY 164 6.450 0.938 -4.755 1003 HA3 GLY 164 HA3 GLY 164 8.080 1.141 -4.161 1004 H GLY 165 H GLY 165 5.876 3.871 -3.539 1005 HA2 GLY 165 HA2 GLY 165 5.774 2.879 -0.776 1006 HA3 GLY 165 HA3 GLY 165 5.722 4.564 -1.267 1007 H ARG 166 H ARG 166 3.810 3.181 0.427 1008 HA ARG 166 HA ARG 166 1.453 3.177 -1.291 1009 HB2 ARG 166 HB2 ARG 166 0.321 2.267 0.858 1010 HB3 ARG 166 HB3 ARG 166 1.325 1.199 -0.112 1011 HG2 ARG 166 HG2 ARG 166 3.037 2.427 1.760 1012 HG3 ARG 166 HG3 ARG 166 1.588 1.948 2.637 1013 HD2 ARG 166 HD2 ARG 166 3.356 0.201 2.576 1014 HD3 ARG 166 HD3 ARG 166 1.811 -0.316 1.913 1015 HE ARG 166 HE ARG 166 2.759 -0.119 -0.291 1016 HH11 ARG 166 HH11 ARG 166 5.071 0.101 2.325 1017 HH12 ARG 166 HH12 ARG 166 6.408 -0.384 1.341 1018 HH21 ARG 166 HH21 ARG 166 4.522 -0.753 -1.575 1019 HH22 ARG 166 HH22 ARG 166 6.099 -0.867 -0.868 1020 H CYS 167 H CYS 167 -0.452 4.329 -0.731 1021 HA CYS 167 HA CYS 167 -0.008 6.910 0.219 1022 HB2 CYS 167 HB2 CYS 167 -1.906 5.605 -1.405 1023 HB3 CYS 167 HB3 CYS 167 -2.795 6.358 -0.094 1024 H ALA 168 H ALA 168 0.087 7.416 2.254 1025 HA ALA 168 HA ALA 168 -1.566 5.989 4.238 1026 HB1 ALA 168 HB1 ALA 168 -0.219 6.967 5.905 1027 HB2 ALA 168 HB2 ALA 168 0.328 8.255 4.828 1028 HB3 ALA 168 HB3 ALA 168 0.916 6.608 4.605 1029 H ALA 169 H ALA 169 -0.935 8.780 2.751 1030 HA ALA 169 HA ALA 169 -3.688 9.904 3.206 1031 HB1 ALA 169 HB1 ALA 169 -2.601 10.917 4.872 1032 HB2 ALA 169 HB2 ALA 169 -2.581 12.172 3.636 1033 HB3 ALA 169 HB3 ALA 169 -1.142 11.205 3.952 1034 H ALA 170 H ALA 170 -4.446 11.761 2.134 1035 HA ALA 170 HA ALA 170 -4.416 11.608 -0.605 1036 HB1 ALA 170 HB1 ALA 170 -5.912 13.304 -0.604 1037 HB2 ALA 170 HB2 ALA 170 -4.951 14.299 0.495 1038 HB3 ALA 170 HB3 ALA 170 -5.926 12.974 1.129 1039 H GLY 171 H GLY 171 -3.008 12.132 -2.086 1040 HA2 GLY 171 HA2 GLY 171 -1.341 13.190 -3.203 1041 HA3 GLY 171 HA3 GLY 171 -1.511 14.497 -2.059 1042 H ILE 172 H ILE 172 -0.963 11.475 -0.582 1043 HA ILE 172 HA ILE 172 1.932 12.009 -0.418 1044 HB ILE 172 HB ILE 172 1.900 12.249 1.802 1045 HG12 ILE 172 HG12 ILE 172 -0.374 10.997 2.873 1046 HG13 ILE 172 HG13 ILE 172 0.310 9.871 1.756 1047 HG21 ILE 172 HG21 ILE 172 -0.183 13.256 2.665 1048 HG22 ILE 172 HG22 ILE 172 -1.012 12.705 1.216 1049 HG23 ILE 172 HG23 ILE 172 0.285 13.892 1.086 1050 HD11 ILE 172 HD11 ILE 172 2.278 11.155 3.399 1051 HD12 ILE 172 HD12 ILE 172 2.027 9.433 3.059 1052 HD13 ILE 172 HD13 ILE 172 1.081 10.231 4.319 1053 H CYS 173 H CYS 173 2.917 10.319 -1.295 1054 HA CYS 173 HA CYS 173 1.862 7.633 -0.762 1055 HB2 CYS 173 HB2 CYS 173 2.910 8.850 -3.145 1056 HB3 CYS 173 HB3 CYS 173 3.945 7.503 -2.690 1057 H CYS 174 H CYS 174 2.773 6.989 1.101 1058 HA CYS 174 HA CYS 174 5.564 7.594 1.574 1059 HB2 CYS 174 HB2 CYS 174 3.636 7.836 3.297 1060 HB3 CYS 174 HB3 CYS 174 3.864 6.105 3.524 1061 H SER 175 H SER 175 7.134 6.344 1.191 1062 HA SER 175 HA SER 175 6.717 3.555 0.478 1063 HB2 SER 175 HB2 SER 175 8.496 5.625 -0.350 1064 HB3 SER 175 HB3 SER 175 9.468 4.325 0.338 1065 HG SER 175 HG SER 175 8.838 4.231 -2.001 1066 HA PRO 176 HA PRO 176 8.549 1.899 4.123 1067 HB2 PRO 176 HB2 PRO 176 10.476 0.178 3.399 1068 HB3 PRO 176 HB3 PRO 176 8.777 -0.106 3.001 1069 HG2 PRO 176 HG2 PRO 176 10.967 0.994 1.277 1070 HG3 PRO 176 HG3 PRO 176 9.725 -0.206 0.876 1071 HD2 PRO 176 HD2 PRO 176 9.552 2.430 0.191 1072 HD3 PRO 176 HD3 PRO 176 8.136 1.397 0.463 1073 H ASP 177 H ASP 177 9.915 4.370 2.988 1074 HA ASP 177 HA ASP 177 12.115 4.402 4.881 1075 HB2 ASP 177 HB2 ASP 177 12.411 4.771 1.915 1076 HB3 ASP 177 HB3 ASP 177 13.429 5.712 3.002 1077 H GLY 178 H GLY 178 10.203 6.156 2.477 1078 HA2 GLY 178 HA2 GLY 178 9.721 8.254 4.418 1079 HA3 GLY 178 HA3 GLY 178 10.478 8.757 2.940 1080 H CYS 179 H CYS 179 8.744 10.049 2.357 1081 HA CYS 179 HA CYS 179 6.609 8.582 1.065 1082 HB2 CYS 179 HB2 CYS 179 5.595 10.935 2.536 1083 HB3 CYS 179 HB3 CYS 179 4.824 9.388 2.221 1084 H HIS 180 H HIS 180 5.322 10.036 -0.437 1085 HA HIS 180 HA HIS 180 6.671 12.528 -1.120 1086 HB2 HIS 180 HB2 HIS 180 6.520 11.426 -3.631 1087 HB3 HIS 180 HB3 HIS 180 7.985 11.541 -2.675 1088 HD1 HIS 180 HD1 HIS 180 5.537 9.121 -4.022 1089 HD2 HIS 180 HD2 HIS 180 8.830 9.106 -1.489 1090 HE1 HIS 180 HE1 HIS 180 6.170 6.703 -3.759 1091 HE2 HIS 180 HE2 HIS 180 8.191 6.718 -2.254 1092 H GLU 181 H GLU 181 5.554 13.719 -2.818 1093 HA GLU 181 HA GLU 181 2.769 13.762 -2.391 1094 HB2 GLU 181 HB2 GLU 181 2.786 15.354 -4.381 1095 HB3 GLU 181 HB3 GLU 181 3.779 15.816 -3.007 1096 HG2 GLU 181 HG2 GLU 181 5.314 16.193 -4.600 1097 HG3 GLU 181 HG3 GLU 181 5.603 14.464 -4.445 1098 H ASP 182 H ASP 182 1.045 13.101 -3.751 1099 HA ASP 182 HA ASP 182 1.762 11.604 -6.147 1100 HB2 ASP 182 HB2 ASP 182 0.938 9.551 -5.484 1101 HB3 ASP 182 HB3 ASP 182 1.713 10.118 -4.002 1102 HA PRO 183 HA PRO 183 -2.010 13.477 -7.529 1103 HB2 PRO 183 HB2 PRO 183 -2.003 11.840 -9.895 1104 HB3 PRO 183 HB3 PRO 183 -1.510 13.522 -9.719 1105 HG2 PRO 183 HG2 PRO 183 0.216 11.462 -10.281 1106 HG3 PRO 183 HG3 PRO 183 0.695 12.982 -9.509 1107 HD2 PRO 183 HD2 PRO 183 0.135 10.317 -8.267 1108 HD3 PRO 183 HD3 PRO 183 1.405 11.498 -7.882 1109 H ALA 184 H ALA 184 -1.755 10.010 -7.204 1110 HA ALA 184 HA ALA 184 -4.412 9.372 -7.950 1111 HB1 ALA 184 HB1 ALA 184 -2.130 7.976 -6.918 1112 HB2 ALA 184 HB2 ALA 184 -3.520 7.342 -7.800 1113 HB3 ALA 184 HB3 ALA 184 -3.583 7.487 -6.043 1114 H CYS 185 H CYS 185 -2.897 10.192 -4.896 1115 HA CYS 185 HA CYS 185 -5.487 10.099 -3.546 1116 HB2 CYS 185 HB2 CYS 185 -2.673 10.372 -2.534 1117 HB3 CYS 185 HB3 CYS 185 -4.084 10.496 -1.495 1118 H ASP 186 H ASP 186 -4.742 12.087 -5.505 1119 HA ASP 186 HA ASP 186 -4.305 14.570 -4.170 1120 HB2 ASP 186 HB2 ASP 186 -3.925 13.756 -6.736 1121 HB3 ASP 186 HB3 ASP 186 -5.444 14.628 -6.886 1122 HA PRO 187 HA PRO 187 -8.948 15.030 -5.295 1123 HB2 PRO 187 HB2 PRO 187 -10.339 12.670 -5.322 1124 HB3 PRO 187 HB3 PRO 187 -9.748 13.523 -6.750 1125 HG2 PRO 187 HG2 PRO 187 -8.592 11.171 -5.351 1126 HG3 PRO 187 HG3 PRO 187 -8.674 11.522 -7.086 1127 HD2 PRO 187 HD2 PRO 187 -6.437 11.862 -5.614 1128 HD3 PRO 187 HD3 PRO 187 -6.808 12.863 -7.025 1129 H GLU 188 H GLU 188 -9.165 15.831 -3.490 1130 HA GLU 188 HA GLU 188 -8.888 15.640 -0.959 1131 HB2 GLU 188 HB2 GLU 188 -11.576 15.910 -0.569 1132 HB3 GLU 188 HB3 GLU 188 -10.505 17.232 -1.001 1133 HG2 GLU 188 HG2 GLU 188 -11.129 17.111 -3.274 1134 HG3 GLU 188 HG3 GLU 188 -11.976 15.583 -3.025 1135 H ALA 189 H ALA 189 -8.172 13.780 -0.737 1136 HA ALA 189 HA ALA 189 -9.801 11.426 -0.604 1137 HB1 ALA 189 HB1 ALA 189 -7.302 11.684 -1.533 1138 HB2 ALA 189 HB2 ALA 189 -7.830 10.207 -0.691 1139 HB3 ALA 189 HB3 ALA 189 -6.917 11.432 0.187 1140 H ALA 190 H ALA 190 -9.371 13.913 1.265 1141 HA ALA 190 HA ALA 190 -8.512 12.996 3.734 1142 HB1 ALA 190 HB1 ALA 190 -10.501 15.064 3.033 1143 HB2 ALA 190 HB2 ALA 190 -9.068 15.165 4.055 1144 HB3 ALA 190 HB3 ALA 190 -10.557 14.473 4.694 1145 H PHE 191 H PHE 191 -9.040 11.104 4.863 1146 HA PHE 191 HA PHE 191 -11.729 10.011 4.458 1147 HB2 PHE 191 HB2 PHE 191 -9.705 8.504 4.434 1148 HB3 PHE 191 HB3 PHE 191 -9.518 8.829 6.149 1149 HD1 PHE 191 HD1 PHE 191 -12.716 8.318 4.345 1150 HD2 PHE 191 HD2 PHE 191 -9.861 6.704 7.059 1151 HE1 PHE 191 HE1 PHE 191 -14.268 6.488 4.886 1152 HE2 PHE 191 HE2 PHE 191 -11.409 4.871 7.600 1153 HZ PHE 191 HZ PHE 191 -13.616 4.761 6.515 1154 H SER 192 H SER 192 -13.327 10.082 5.972 1155 HA SER 192 HA SER 192 -14.467 10.563 7.898 1156 HB2 SER 192 HB2 SER 192 -11.781 10.760 9.282 1157 HB3 SER 192 HB3 SER 192 -13.351 10.488 10.033 1158 HG SER 192 HG SER 192 -13.386 8.451 9.260 Start of MODEL 16 1 H1 ALA 1 H1 ALA 1 26.186 36.419 2.499 2 H2 ALA 1 H2 ALA 1 24.997 35.654 3.472 3 H3 ALA 1 H3 ALA 1 24.543 36.887 2.371 4 HA ALA 1 HA ALA 1 24.338 35.508 0.738 5 HB1 ALA 1 HB1 ALA 1 26.638 35.558 0.224 6 HB2 ALA 1 HB2 ALA 1 26.175 33.857 0.198 7 HB3 ALA 1 HB3 ALA 1 27.045 34.513 1.584 8 H VAL 2 H VAL 2 22.496 34.607 1.706 9 HA VAL 2 HA VAL 2 22.813 31.810 2.478 10 HB VAL 2 HB VAL 2 21.102 32.165 4.316 11 HG11 VAL 2 HG11 VAL 2 23.913 33.214 4.454 12 HG12 VAL 2 HG12 VAL 2 23.297 31.645 4.968 13 HG13 VAL 2 HG13 VAL 2 22.893 33.096 5.886 14 HG21 VAL 2 HG21 VAL 2 20.382 34.414 3.624 15 HG22 VAL 2 HG22 VAL 2 21.986 35.036 4.015 16 HG23 VAL 2 HG23 VAL 2 20.956 34.388 5.292 17 H LEU 3 H LEU 3 21.916 32.835 0.076 18 HA LEU 3 HA LEU 3 19.452 31.460 -0.244 19 HB2 LEU 3 HB2 LEU 3 19.122 34.112 0.410 20 HB3 LEU 3 HB3 LEU 3 19.081 34.153 -1.341 21 HG LEU 3 HG LEU 3 17.185 32.694 -1.399 22 HD11 LEU 3 HD11 LEU 3 16.186 31.599 0.398 23 HD12 LEU 3 HD12 LEU 3 17.219 32.428 1.566 24 HD13 LEU 3 HD13 LEU 3 17.907 31.230 0.480 25 HD21 LEU 3 HD21 LEU 3 15.976 34.130 0.706 26 HD22 LEU 3 HD22 LEU 3 15.887 34.392 -1.028 27 HD23 LEU 3 HD23 LEU 3 17.143 35.182 -0.096 28 H ASP 4 H ASP 4 19.802 30.368 -1.829 29 HA ASP 4 HA ASP 4 21.901 30.873 -3.749 30 HB2 ASP 4 HB2 ASP 4 20.623 28.602 -2.812 31 HB3 ASP 4 HB3 ASP 4 20.087 28.707 -4.485 32 H LEU 5 H LEU 5 18.593 30.217 -4.130 33 HA LEU 5 HA LEU 5 17.742 30.136 -6.389 34 HB2 LEU 5 HB2 LEU 5 15.666 31.105 -5.827 35 HB3 LEU 5 HB3 LEU 5 16.326 30.250 -4.457 36 HG LEU 5 HG LEU 5 15.856 33.177 -4.799 37 HD11 LEU 5 HD11 LEU 5 15.411 32.265 -2.194 38 HD12 LEU 5 HD12 LEU 5 14.823 31.001 -3.272 39 HD13 LEU 5 HD13 LEU 5 14.231 32.632 -3.441 40 HD21 LEU 5 HD21 LEU 5 17.605 33.848 -3.604 41 HD22 LEU 5 HD22 LEU 5 18.297 32.253 -3.824 42 HD23 LEU 5 HD23 LEU 5 17.329 32.590 -2.424 43 H ASP 6 H ASP 6 16.579 33.115 -6.048 44 HA ASP 6 HA ASP 6 18.513 34.586 -7.530 45 HB2 ASP 6 HB2 ASP 6 17.718 32.527 -8.776 46 HB3 ASP 6 HB3 ASP 6 16.206 33.384 -9.007 47 H VAL 7 H VAL 7 15.352 33.930 -6.971 48 HA VAL 7 HA VAL 7 14.669 36.579 -5.909 49 HB VAL 7 HB VAL 7 13.653 36.588 -8.181 50 HG11 VAL 7 HG11 VAL 7 12.686 33.940 -7.348 51 HG12 VAL 7 HG12 VAL 7 13.075 34.559 -8.947 52 HG13 VAL 7 HG13 VAL 7 11.524 34.944 -8.207 53 HG21 VAL 7 HG21 VAL 7 12.474 37.913 -6.685 54 HG22 VAL 7 HG22 VAL 7 11.857 36.525 -5.790 55 HG23 VAL 7 HG23 VAL 7 11.226 36.889 -7.396 56 H ARG 8 H ARG 8 14.018 36.177 -3.827 57 HA ARG 8 HA ARG 8 13.710 33.492 -3.125 58 HB2 ARG 8 HB2 ARG 8 14.818 34.632 -1.501 59 HB3 ARG 8 HB3 ARG 8 14.005 36.132 -1.823 60 HG2 ARG 8 HG2 ARG 8 12.002 34.989 -0.623 61 HG3 ARG 8 HG3 ARG 8 13.240 33.911 -0.011 62 HD2 ARG 8 HD2 ARG 8 13.001 35.622 1.607 63 HD3 ARG 8 HD3 ARG 8 14.513 35.931 0.754 64 HE ARG 8 HE ARG 8 12.119 37.327 -0.161 65 HH11 ARG 8 HH11 ARG 8 15.163 37.466 1.562 66 HH12 ARG 8 HH12 ARG 8 15.244 39.195 1.516 67 HH21 ARG 8 HH21 ARG 8 12.236 39.598 -0.210 68 HH22 ARG 8 HH22 ARG 8 13.587 40.402 0.515 69 H THR 9 H THR 9 11.898 32.501 -3.774 70 HA THR 9 HA THR 9 9.545 34.076 -2.967 71 HB THR 9 HB THR 9 9.623 31.586 -4.729 72 HG1 THR 9 HG1 THR 9 9.377 34.260 -5.620 73 HG21 THR 9 HG21 THR 9 7.430 31.924 -5.276 74 HG22 THR 9 HG22 THR 9 7.442 33.607 -4.747 75 HG23 THR 9 HG23 THR 9 7.466 32.307 -3.560 76 H CYS 10 H CYS 10 9.974 33.681 -0.956 77 HA CYS 10 HA CYS 10 10.693 31.055 -0.039 78 HB2 CYS 10 HB2 CYS 10 10.659 33.664 1.067 79 HB3 CYS 10 HB3 CYS 10 9.710 32.633 2.132 80 H LEU 11 H LEU 11 8.764 30.240 -1.357 81 HA LEU 11 HA LEU 11 6.163 30.399 -1.003 82 HB2 LEU 11 HB2 LEU 11 7.613 27.759 -0.901 83 HB3 LEU 11 HB3 LEU 11 5.920 27.968 -1.279 84 HG LEU 11 HG LEU 11 6.847 27.660 -3.362 85 HD11 LEU 11 HD11 LEU 11 5.610 29.879 -3.132 86 HD12 LEU 11 HD12 LEU 11 6.610 29.636 -4.565 87 HD13 LEU 11 HD13 LEU 11 7.203 30.623 -3.234 88 HD21 LEU 11 HD21 LEU 11 9.106 29.530 -3.119 89 HD22 LEU 11 HD22 LEU 11 8.996 27.993 -3.960 90 HD23 LEU 11 HD23 LEU 11 9.223 28.027 -2.211 91 HA PRO 12 HA PRO 12 5.517 29.875 3.471 92 HB2 PRO 12 HB2 PRO 12 2.815 30.337 3.341 93 HB3 PRO 12 HB3 PRO 12 4.034 31.599 3.534 94 HG2 PRO 12 HG2 PRO 12 2.558 30.744 1.099 95 HG3 PRO 12 HG3 PRO 12 3.084 32.363 1.589 96 HD2 PRO 12 HD2 PRO 12 4.369 30.887 -0.310 97 HD3 PRO 12 HD3 PRO 12 5.186 32.084 0.712 98 H CYS 13 H CYS 13 4.235 28.304 4.688 99 HA CYS 13 HA CYS 13 2.631 26.460 3.359 100 HB2 CYS 13 HB2 CYS 13 4.396 25.392 2.403 101 HB3 CYS 13 HB3 CYS 13 5.475 25.727 3.731 102 H GLY 14 H GLY 14 2.000 24.565 4.845 103 HA2 GLY 14 HA2 GLY 14 1.360 23.749 6.891 104 HA3 GLY 14 HA3 GLY 14 2.587 24.745 7.631 105 HA PRO 15 HA PRO 15 -1.526 26.268 9.065 106 HB2 PRO 15 HB2 PRO 15 -0.812 26.832 11.540 107 HB3 PRO 15 HB3 PRO 15 -1.038 25.135 11.042 108 HG2 PRO 15 HG2 PRO 15 1.474 26.747 10.804 109 HG3 PRO 15 HG3 PRO 15 1.241 25.354 11.917 110 HD2 PRO 15 HD2 PRO 15 2.246 24.801 9.588 111 HD3 PRO 15 HD3 PRO 15 0.752 23.912 10.003 112 H GLY 16 H GLY 16 -1.066 27.955 7.796 113 HA2 GLY 16 HA2 GLY 16 -1.488 30.485 7.883 114 HA3 GLY 16 HA3 GLY 16 -0.411 30.425 9.254 115 H GLY 17 H GLY 17 1.080 28.317 7.121 116 HA2 GLY 17 HA2 GLY 17 2.489 28.571 5.552 117 HA3 GLY 17 HA3 GLY 17 1.973 30.195 5.332 118 H LYS 18 H LYS 18 3.291 28.460 8.024 119 HA LYS 18 HA LYS 18 5.469 30.388 8.386 120 HB2 LYS 18 HB2 LYS 18 5.253 28.191 10.329 121 HB3 LYS 18 HB3 LYS 18 5.448 29.916 10.591 122 HG2 LYS 18 HG2 LYS 18 2.826 29.566 9.635 123 HG3 LYS 18 HG3 LYS 18 3.101 28.297 10.826 124 HD2 LYS 18 HD2 LYS 18 4.194 30.473 12.063 125 HD3 LYS 18 HD3 LYS 18 2.851 31.196 11.176 126 HE2 LYS 18 HE2 LYS 18 2.128 28.715 12.524 127 HE3 LYS 18 HE3 LYS 18 2.692 29.965 13.633 128 HZ1 LYS 18 HZ1 LYS 18 1.028 31.444 12.879 129 HZ2 LYS 18 HZ2 LYS 18 0.251 29.970 13.165 130 HZ3 LYS 18 HZ3 LYS 18 0.606 30.443 11.581 131 H GLY 19 H GLY 19 4.935 27.397 6.843 132 HA2 GLY 19 HA2 GLY 19 7.648 26.433 7.142 133 HA3 GLY 19 HA3 GLY 19 6.241 25.463 6.698 134 H ARG 20 H ARG 20 7.963 25.124 4.555 135 HA ARG 20 HA ARG 20 7.181 27.246 2.756 136 HB2 ARG 20 HB2 ARG 20 9.690 26.748 3.789 137 HB3 ARG 20 HB3 ARG 20 9.727 25.935 2.232 138 HG2 ARG 20 HG2 ARG 20 9.531 27.902 1.064 139 HG3 ARG 20 HG3 ARG 20 8.737 28.732 2.410 140 HD2 ARG 20 HD2 ARG 20 11.063 29.509 2.000 141 HD3 ARG 20 HD3 ARG 20 10.801 28.876 3.623 142 HE ARG 20 HE ARG 20 11.747 26.791 2.016 143 HH11 ARG 20 HH11 ARG 20 12.888 29.821 3.336 144 HH12 ARG 20 HH12 ARG 20 14.544 29.318 3.386 145 HH21 ARG 20 HH21 ARG 20 13.933 26.135 2.090 146 HH22 ARG 20 HH22 ARG 20 15.136 27.232 2.680 147 H CYS 21 H CYS 21 7.519 26.264 0.362 148 HA CYS 21 HA CYS 21 6.448 23.516 0.481 149 HB2 CYS 21 HB2 CYS 21 5.814 25.842 -1.203 150 HB3 CYS 21 HB3 CYS 21 5.953 24.327 -2.090 151 H PHE 22 H PHE 22 7.174 21.880 -0.761 152 HA PHE 22 HA PHE 22 9.273 22.233 -2.722 153 HB2 PHE 22 HB2 PHE 22 9.797 20.796 -0.101 154 HB3 PHE 22 HB3 PHE 22 10.830 20.665 -1.520 155 HD1 PHE 22 HD1 PHE 22 12.201 22.536 -2.240 156 HD2 PHE 22 HD2 PHE 22 9.762 22.794 1.245 157 HE1 PHE 22 HE1 PHE 22 13.436 24.542 -1.526 158 HE2 PHE 22 HE2 PHE 22 11.004 24.796 1.963 159 HZ PHE 22 HZ PHE 22 12.835 25.676 0.575 160 H GLY 23 H GLY 23 6.944 21.378 -3.410 161 HA2 GLY 23 HA2 GLY 23 6.707 19.336 -4.867 162 HA3 GLY 23 HA3 GLY 23 7.002 18.423 -3.389 163 HA PRO 24 HA PRO 24 2.380 19.892 -4.148 164 HB2 PRO 24 HB2 PRO 24 2.047 17.023 -4.901 165 HB3 PRO 24 HB3 PRO 24 1.226 18.456 -5.527 166 HG2 PRO 24 HG2 PRO 24 3.134 17.267 -6.946 167 HG3 PRO 24 HG3 PRO 24 3.000 19.036 -6.903 168 HD2 PRO 24 HD2 PRO 24 4.944 17.246 -5.504 169 HD3 PRO 24 HD3 PRO 24 5.201 18.854 -6.213 170 H SER 25 H SER 25 2.711 16.409 -3.351 171 HA SER 25 HA SER 25 1.461 16.983 -0.778 172 HB2 SER 25 HB2 SER 25 1.894 14.494 -2.376 173 HB3 SER 25 HB3 SER 25 1.782 14.313 -0.615 174 HG SER 25 HG SER 25 -0.163 14.915 -2.476 175 H ILE 26 H ILE 26 4.016 18.010 -1.164 176 HA ILE 26 HA ILE 26 5.400 16.750 1.000 177 HB ILE 26 HB ILE 26 6.865 17.328 -1.545 178 HG12 ILE 26 HG12 ILE 26 5.905 14.660 -0.578 179 HG13 ILE 26 HG13 ILE 26 5.208 15.533 -1.914 180 HG21 ILE 26 HG21 ILE 26 7.930 17.242 0.776 181 HG22 ILE 26 HG22 ILE 26 8.719 16.431 -0.566 182 HG23 ILE 26 HG23 ILE 26 7.773 15.502 0.597 183 HD11 ILE 26 HD11 ILE 26 6.840 14.930 -3.324 184 HD12 ILE 26 HD12 ILE 26 7.087 13.625 -2.164 185 HD13 ILE 26 HD13 ILE 26 8.097 15.069 -2.097 186 H CYS 27 H CYS 27 5.289 18.442 2.328 187 HA CYS 27 HA CYS 27 6.154 21.092 1.356 188 HB2 CYS 27 HB2 CYS 27 3.736 20.355 2.454 189 HB3 CYS 27 HB3 CYS 27 4.614 20.961 3.845 190 H CYS 28 H CYS 28 8.077 21.803 2.262 191 HA CYS 28 HA CYS 28 8.654 20.934 4.993 192 HB2 CYS 28 HB2 CYS 28 11.104 20.872 3.505 193 HB3 CYS 28 HB3 CYS 28 10.367 19.634 4.503 194 H GLY 29 H GLY 29 9.151 22.672 6.342 195 HA2 GLY 29 HA2 GLY 29 10.693 24.845 5.173 196 HA3 GLY 29 HA3 GLY 29 9.647 24.936 6.586 197 H ASP 30 H ASP 30 11.816 25.815 7.420 198 HA ASP 30 HA ASP 30 14.001 24.154 7.777 199 HB2 ASP 30 HB2 ASP 30 14.728 25.780 9.496 200 HB3 ASP 30 HB3 ASP 30 14.238 26.526 7.980 201 H GLU 31 H GLU 31 11.677 25.028 10.254 202 HA GLU 31 HA GLU 31 12.559 22.765 11.871 203 HB2 GLU 31 HB2 GLU 31 10.852 24.571 13.295 204 HB3 GLU 31 HB3 GLU 31 12.502 24.098 13.657 205 HG2 GLU 31 HG2 GLU 31 12.951 25.874 11.717 206 HG3 GLU 31 HG3 GLU 31 11.435 26.509 12.342 207 H LEU 32 H LEU 32 10.324 23.392 9.761 208 HA LEU 32 HA LEU 32 8.156 22.080 11.149 209 HB2 LEU 32 HB2 LEU 32 8.521 24.264 9.309 210 HB3 LEU 32 HB3 LEU 32 7.483 23.060 8.612 211 HG LEU 32 HG LEU 32 7.062 24.413 11.273 212 HD11 LEU 32 HD11 LEU 32 6.803 25.973 9.456 213 HD12 LEU 32 HD12 LEU 32 5.228 25.588 10.152 214 HD13 LEU 32 HD13 LEU 32 5.715 24.863 8.620 215 HD21 LEU 32 HD21 LEU 32 6.093 22.186 11.242 216 HD22 LEU 32 HD22 LEU 32 5.272 22.572 9.750 217 HD23 LEU 32 HD23 LEU 32 4.829 23.410 11.209 218 H GLY 33 H GLY 33 10.839 21.753 9.210 219 HA2 GLY 33 HA2 GLY 33 11.655 20.171 7.796 220 HA3 GLY 33 HA3 GLY 33 10.686 19.101 8.770 221 H CYS 34 H CYS 34 9.705 17.693 7.284 222 HA CYS 34 HA CYS 34 8.217 19.088 5.173 223 HB2 CYS 34 HB2 CYS 34 10.293 17.587 4.520 224 HB3 CYS 34 HB3 CYS 34 9.094 16.330 4.609 225 H PHE 35 H PHE 35 6.068 18.825 5.302 226 HA PHE 35 HA PHE 35 5.174 16.320 6.502 227 HB2 PHE 35 HB2 PHE 35 3.098 18.169 5.577 228 HB3 PHE 35 HB3 PHE 35 3.296 17.435 7.162 229 HD1 PHE 35 HD1 PHE 35 4.583 18.573 8.900 230 HD2 PHE 35 HD2 PHE 35 3.889 20.367 5.119 231 HE1 PHE 35 HE1 PHE 35 5.260 20.743 9.803 232 HE2 PHE 35 HE2 PHE 35 4.574 22.542 6.026 233 HZ PHE 35 HZ PHE 35 5.257 22.745 8.336 234 H VAL 36 H VAL 36 5.418 14.864 4.924 235 HA VAL 36 HA VAL 36 4.854 15.663 2.225 236 HB VAL 36 HB VAL 36 5.681 12.881 3.022 237 HG11 VAL 36 HG11 VAL 36 4.915 13.282 0.719 238 HG12 VAL 36 HG12 VAL 36 6.623 12.842 0.782 239 HG13 VAL 36 HG13 VAL 36 6.155 14.530 0.557 240 HG21 VAL 36 HG21 VAL 36 7.356 14.247 4.065 241 HG22 VAL 36 HG22 VAL 36 7.439 15.330 2.688 242 HG23 VAL 36 HG23 VAL 36 8.060 13.684 2.553 243 H GLY 37 H GLY 37 2.890 16.060 2.120 244 HA2 GLY 37 HA2 GLY 37 0.748 15.310 1.387 245 HA3 GLY 37 HA3 GLY 37 1.040 13.797 2.196 246 H THR 38 H THR 38 0.264 17.173 2.734 247 HA THR 38 HA THR 38 -1.623 16.496 4.795 248 HB THR 38 HB THR 38 -0.624 17.880 6.550 249 HG1 THR 38 HG1 THR 38 0.757 18.962 4.696 250 HG21 THR 38 HG21 THR 38 0.624 16.254 7.397 251 HG22 THR 38 HG22 THR 38 1.770 16.311 6.059 252 HG23 THR 38 HG23 THR 38 0.285 15.379 5.912 253 H ALA 39 H ALA 39 -2.884 18.588 5.518 254 HA ALA 39 HA ALA 39 -3.532 20.122 3.290 255 HB1 ALA 39 HB1 ALA 39 -4.448 19.749 5.921 256 HB2 ALA 39 HB2 ALA 39 -5.221 20.677 4.636 257 HB3 ALA 39 HB3 ALA 39 -4.118 21.474 5.760 258 H GLU 40 H GLU 40 -0.879 20.321 5.393 259 HA GLU 40 HA GLU 40 -0.393 23.136 5.323 260 HB2 GLU 40 HB2 GLU 40 1.495 20.818 5.807 261 HB3 GLU 40 HB3 GLU 40 1.865 22.504 6.102 262 HG2 GLU 40 HG2 GLU 40 -0.002 22.571 7.749 263 HG3 GLU 40 HG3 GLU 40 -0.199 20.834 7.518 264 H ALA 41 H ALA 41 -0.205 20.651 3.082 265 HA ALA 41 HA ALA 41 1.838 21.899 1.445 266 HB1 ALA 41 HB1 ALA 41 1.800 19.410 1.876 267 HB2 ALA 41 HB2 ALA 41 1.873 19.903 0.186 268 HB3 ALA 41 HB3 ALA 41 0.346 19.346 0.868 269 H LEU 42 H LEU 42 -1.607 21.548 1.679 270 HA LEU 42 HA LEU 42 -2.535 21.723 -0.848 271 HB2 LEU 42 HB2 LEU 42 -3.471 22.847 1.709 272 HB3 LEU 42 HB3 LEU 42 -4.198 23.523 0.262 273 HG LEU 42 HG LEU 42 -4.089 20.552 0.663 274 HD11 LEU 42 HD11 LEU 42 -5.205 21.020 2.611 275 HD12 LEU 42 HD12 LEU 42 -6.545 20.970 1.467 276 HD13 LEU 42 HD13 LEU 42 -5.890 22.521 1.988 277 HD21 LEU 42 HD21 LEU 42 -5.062 20.621 -1.331 278 HD22 LEU 42 HD22 LEU 42 -5.178 22.379 -1.276 279 HD23 LEU 42 HD23 LEU 42 -6.444 21.393 -0.569 280 H ARG 43 H ARG 43 -0.862 24.370 0.766 281 HA ARG 43 HA ARG 43 -1.510 26.370 -1.194 282 HB2 ARG 43 HB2 ARG 43 0.096 26.135 1.222 283 HB3 ARG 43 HB3 ARG 43 0.946 27.059 -0.008 284 HG2 ARG 43 HG2 ARG 43 -1.814 27.635 1.057 285 HG3 ARG 43 HG3 ARG 43 -0.334 28.502 1.475 286 HD2 ARG 43 HD2 ARG 43 -1.596 28.335 -1.259 287 HD3 ARG 43 HD3 ARG 43 -1.629 29.730 -0.185 288 HE ARG 43 HE ARG 43 0.658 28.746 -1.711 289 HH11 ARG 43 HH11 ARG 43 -0.625 31.066 0.572 290 HH12 ARG 43 HH12 ARG 43 0.689 32.171 0.367 291 HH21 ARG 43 HH21 ARG 43 2.382 30.204 -1.970 292 HH22 ARG 43 HH22 ARG 43 2.394 31.684 -1.073 293 H CYS 44 H CYS 44 0.375 23.806 -1.003 294 HA CYS 44 HA CYS 44 2.638 24.435 -2.672 295 HB2 CYS 44 HB2 CYS 44 1.568 21.878 -1.687 296 HB3 CYS 44 HB3 CYS 44 2.498 21.771 -3.165 297 H GLN 45 H GLN 45 -0.604 23.556 -3.509 298 HA GLN 45 HA GLN 45 -0.419 22.770 -6.134 299 HB2 GLN 45 HB2 GLN 45 -2.518 23.127 -4.705 300 HB3 GLN 45 HB3 GLN 45 -2.470 24.793 -5.263 301 HG2 GLN 45 HG2 GLN 45 -3.059 24.248 -7.397 302 HG3 GLN 45 HG3 GLN 45 -2.363 22.631 -7.296 303 HE21 GLN 45 HE21 GLN 45 -4.991 24.605 -5.973 304 HE22 GLN 45 HE22 GLN 45 -6.140 23.319 -5.873 305 H GLU 46 H GLU 46 -0.238 26.109 -4.912 306 HA GLU 46 HA GLU 46 0.070 27.147 -7.601 307 HB2 GLU 46 HB2 GLU 46 -0.463 28.249 -4.953 308 HB3 GLU 46 HB3 GLU 46 0.744 29.187 -5.821 309 HG2 GLU 46 HG2 GLU 46 -1.683 28.454 -7.329 310 HG3 GLU 46 HG3 GLU 46 -1.883 29.617 -6.020 311 H GLU 47 H GLU 47 2.052 25.425 -5.774 312 HA GLU 47 HA GLU 47 4.451 27.017 -5.984 313 HB2 GLU 47 HB2 GLU 47 3.929 25.251 -4.173 314 HB3 GLU 47 HB3 GLU 47 4.324 24.061 -5.405 315 HG2 GLU 47 HG2 GLU 47 6.358 26.109 -5.197 316 HG3 GLU 47 HG3 GLU 47 6.080 25.294 -3.662 317 H ASN 48 H ASN 48 2.548 25.517 -8.168 318 HA ASN 48 HA ASN 48 4.680 24.356 -9.770 319 HB2 ASN 48 HB2 ASN 48 2.051 23.653 -9.455 320 HB3 ASN 48 HB3 ASN 48 1.992 24.571 -10.955 321 HD21 ASN 48 HD21 ASN 48 3.656 21.910 -9.345 322 HD22 ASN 48 HD22 ASN 48 3.991 21.014 -10.784 323 H TYR 49 H TYR 49 2.709 27.199 -9.514 324 HA TYR 49 HA TYR 49 3.518 28.200 -12.149 325 HB2 TYR 49 HB2 TYR 49 1.174 28.455 -11.063 326 HB3 TYR 49 HB3 TYR 49 1.917 29.742 -10.120 327 HD1 TYR 49 HD1 TYR 49 1.730 28.642 -13.697 328 HD2 TYR 49 HD2 TYR 49 1.691 31.881 -10.937 329 HE1 TYR 49 HE1 TYR 49 1.356 30.213 -15.551 330 HE2 TYR 49 HE2 TYR 49 1.314 33.459 -12.785 331 HH TYR 49 HH TYR 49 1.896 32.879 -15.849 332 H LEU 50 H LEU 50 5.199 27.917 -9.476 333 HA LEU 50 HA LEU 50 6.595 30.464 -9.867 334 HB2 LEU 50 HB2 LEU 50 5.542 29.383 -7.267 335 HB3 LEU 50 HB3 LEU 50 6.943 30.436 -7.296 336 HG LEU 50 HG LEU 50 5.261 31.947 -8.740 337 HD11 LEU 50 HD11 LEU 50 3.255 31.207 -6.778 338 HD12 LEU 50 HD12 LEU 50 3.582 29.914 -7.931 339 HD13 LEU 50 HD13 LEU 50 3.092 31.505 -8.508 340 HD21 LEU 50 HD21 LEU 50 4.871 32.045 -5.795 341 HD22 LEU 50 HD22 LEU 50 5.226 33.343 -6.936 342 HD23 LEU 50 HD23 LEU 50 6.495 32.234 -6.443 343 HA PRO 51 HA PRO 51 9.640 27.058 -9.693 344 HB2 PRO 51 HB2 PRO 51 11.146 27.778 -11.769 345 HB3 PRO 51 HB3 PRO 51 9.563 27.028 -12.010 346 HG2 PRO 51 HG2 PRO 51 10.347 29.903 -12.211 347 HG3 PRO 51 HG3 PRO 51 9.244 28.968 -13.234 348 HD2 PRO 51 HD2 PRO 51 8.468 30.659 -11.166 349 HD3 PRO 51 HD3 PRO 51 7.468 29.370 -11.861 350 H SER 52 H SER 52 9.754 29.232 -7.885 351 HA SER 52 HA SER 52 12.649 29.743 -7.880 352 HB2 SER 52 HB2 SER 52 11.877 31.984 -6.679 353 HB3 SER 52 HB3 SER 52 11.987 31.885 -8.436 354 HG SER 52 HG SER 52 9.885 32.525 -7.036 355 HA PRO 53 HA PRO 53 11.502 28.104 -3.773 356 HB2 PRO 53 HB2 PRO 53 13.356 26.200 -3.574 357 HB3 PRO 53 HB3 PRO 53 11.936 25.987 -4.606 358 HG2 PRO 53 HG2 PRO 53 14.747 26.606 -5.356 359 HG3 PRO 53 HG3 PRO 53 13.536 25.648 -6.223 360 HD2 PRO 53 HD2 PRO 53 14.232 28.343 -6.717 361 HD3 PRO 53 HD3 PRO 53 12.849 27.465 -7.399 362 H CYS 54 H CYS 54 12.229 28.815 -1.858 363 HA CYS 54 HA CYS 54 14.374 30.618 -1.652 364 HB2 CYS 54 HB2 CYS 54 12.229 29.777 -0.042 365 HB3 CYS 54 HB3 CYS 54 13.686 29.503 0.900 366 H GLN 55 H GLN 55 16.324 29.676 -2.347 367 HA GLN 55 HA GLN 55 18.170 28.312 -2.269 368 HB2 GLN 55 HB2 GLN 55 18.432 29.896 -0.372 369 HB3 GLN 55 HB3 GLN 55 17.812 28.664 0.709 370 HG2 GLN 55 HG2 GLN 55 19.719 27.205 -0.120 371 HG3 GLN 55 HG3 GLN 55 20.375 28.668 -0.852 372 HE21 GLN 55 HE21 GLN 55 18.913 27.787 2.265 373 HE22 GLN 55 HE22 GLN 55 20.145 28.508 3.238 374 H SER 56 H SER 56 17.678 26.898 0.817 375 HA SER 56 HA SER 56 16.909 24.867 1.559 376 HB2 SER 56 HB2 SER 56 15.659 23.386 0.300 377 HB3 SER 56 HB3 SER 56 15.326 24.904 -0.529 378 HG SER 56 HG SER 56 17.397 24.045 -1.753 379 H GLY 57 H GLY 57 18.047 22.971 2.034 380 HA2 GLY 57 HA2 GLY 57 20.771 23.007 1.493 381 HA3 GLY 57 HA3 GLY 57 19.888 21.681 2.233 382 H GLN 58 H GLN 58 21.720 22.575 -0.311 383 HA GLN 58 HA GLN 58 20.496 21.015 -2.341 384 HB2 GLN 58 HB2 GLN 58 23.341 22.033 -2.113 385 HB3 GLN 58 HB3 GLN 58 22.620 21.344 -3.562 386 HG2 GLN 58 HG2 GLN 58 21.006 23.191 -3.616 387 HG3 GLN 58 HG3 GLN 58 21.774 23.886 -2.189 388 HE21 GLN 58 HE21 GLN 58 24.130 24.340 -2.418 389 HE22 GLN 58 HE22 GLN 58 24.679 24.963 -3.932 390 H LYS 59 H LYS 59 20.123 19.172 -1.038 391 HA LYS 59 HA LYS 59 22.487 17.367 -0.993 392 HB2 LYS 59 HB2 LYS 59 20.632 18.105 1.239 393 HB3 LYS 59 HB3 LYS 59 20.890 16.381 1.043 394 HG2 LYS 59 HG2 LYS 59 23.006 18.460 1.534 395 HG3 LYS 59 HG3 LYS 59 22.399 17.276 2.695 396 HD2 LYS 59 HD2 LYS 59 23.664 16.484 0.084 397 HD3 LYS 59 HD3 LYS 59 24.604 16.735 1.553 398 HE2 LYS 59 HE2 LYS 59 23.503 14.962 2.668 399 HE3 LYS 59 HE3 LYS 59 22.255 14.861 1.426 400 HZ1 LYS 59 HZ1 LYS 59 23.523 13.202 0.654 401 HZ2 LYS 59 HZ2 LYS 59 24.911 13.721 1.468 402 HZ3 LYS 59 HZ3 LYS 59 24.481 14.433 -0.004 403 HA PRO 60 HA PRO 60 18.903 15.886 -3.391 404 HB2 PRO 60 HB2 PRO 60 20.190 15.341 -5.677 405 HB3 PRO 60 HB3 PRO 60 19.609 16.961 -5.275 406 HG2 PRO 60 HG2 PRO 60 22.361 15.819 -5.035 407 HG3 PRO 60 HG3 PRO 60 21.858 17.424 -5.599 408 HD2 PRO 60 HD2 PRO 60 22.799 16.935 -3.074 409 HD3 PRO 60 HD3 PRO 60 21.681 18.255 -3.465 410 H CYS 61 H CYS 61 19.046 14.203 -1.851 411 HA CYS 61 HA CYS 61 20.311 11.713 -2.770 412 HB2 CYS 61 HB2 CYS 61 20.111 10.880 -0.588 413 HB3 CYS 61 HB3 CYS 61 20.419 12.584 -0.264 414 H GLY 62 H GLY 62 18.406 9.771 -2.183 415 HA2 GLY 62 HA2 GLY 62 16.237 9.115 -2.581 416 HA3 GLY 62 HA3 GLY 62 15.759 10.800 -2.643 417 H SER 63 H SER 63 14.433 9.878 -4.291 418 HA SER 63 HA SER 63 15.610 9.164 -6.830 419 HB2 SER 63 HB2 SER 63 13.290 8.457 -5.589 420 HB3 SER 63 HB3 SER 63 12.706 9.712 -6.678 421 HG SER 63 HG SER 63 12.743 8.186 -8.114 422 H GLY 64 H GLY 64 16.359 11.654 -5.989 423 HA2 GLY 64 HA2 GLY 64 16.769 13.428 -7.577 424 HA3 GLY 64 HA3 GLY 64 15.056 13.413 -7.938 425 H GLY 65 H GLY 65 15.565 13.204 -4.480 426 HA2 GLY 65 HA2 GLY 65 14.884 16.062 -4.392 427 HA3 GLY 65 HA3 GLY 65 14.537 14.887 -3.152 428 H ARG 66 H ARG 66 15.823 17.555 -3.294 429 HA ARG 66 HA ARG 66 18.367 17.019 -2.041 430 HB2 ARG 66 HB2 ARG 66 18.628 19.595 -2.187 431 HB3 ARG 66 HB3 ARG 66 18.861 18.630 -3.638 432 HG2 ARG 66 HG2 ARG 66 16.123 19.254 -3.524 433 HG3 ARG 66 HG3 ARG 66 16.994 20.734 -3.129 434 HD2 ARG 66 HD2 ARG 66 16.638 20.599 -5.519 435 HD3 ARG 66 HD3 ARG 66 18.357 20.446 -5.157 436 HE ARG 66 HE ARG 66 17.533 17.878 -5.272 437 HH11 ARG 66 HH11 ARG 66 17.180 20.578 -7.461 438 HH12 ARG 66 HH12 ARG 66 17.141 19.581 -8.876 439 HH21 ARG 66 HH21 ARG 66 17.481 16.574 -7.131 440 HH22 ARG 66 HH22 ARG 66 17.311 17.310 -8.689 441 H CYS 67 H CYS 67 18.872 18.257 0.081 442 HA CYS 67 HA CYS 67 16.912 17.830 1.941 443 HB2 CYS 67 HB2 CYS 67 19.434 19.394 1.832 444 HB3 CYS 67 HB3 CYS 67 18.303 19.876 3.086 445 H ALA 68 H ALA 68 14.934 18.652 1.740 446 HA ALA 68 HA ALA 68 14.568 21.342 0.729 447 HB1 ALA 68 HB1 ALA 68 12.481 20.653 0.322 448 HB2 ALA 68 HB2 ALA 68 12.231 20.292 2.028 449 HB3 ALA 68 HB3 ALA 68 12.917 19.066 0.962 450 H ALA 69 H ALA 69 14.779 19.546 3.632 451 HA ALA 69 HA ALA 69 15.118 21.926 5.297 452 HB1 ALA 69 HB1 ALA 69 13.184 20.212 6.543 453 HB2 ALA 69 HB2 ALA 69 12.587 20.751 4.976 454 HB3 ALA 69 HB3 ALA 69 13.083 21.927 6.184 455 H ALA 70 H ALA 70 16.379 21.391 7.053 456 HA ALA 70 HA ALA 70 18.211 20.052 7.808 457 HB1 ALA 70 HB1 ALA 70 17.574 19.725 9.964 458 HB2 ALA 70 HB2 ALA 70 16.041 18.970 9.517 459 HB3 ALA 70 HB3 ALA 70 16.232 20.719 9.400 460 H GLY 71 H GLY 71 17.360 17.520 9.346 461 HA2 GLY 71 HA2 GLY 71 18.240 15.680 7.288 462 HA3 GLY 71 HA3 GLY 71 17.744 15.245 8.927 463 H ILE 72 H ILE 72 16.472 16.304 5.870 464 HA ILE 72 HA ILE 72 14.588 14.391 5.744 465 HB ILE 72 HB ILE 72 12.473 15.428 5.695 466 HG12 ILE 72 HG12 ILE 72 12.681 17.926 6.793 467 HG13 ILE 72 HG13 ILE 72 14.040 17.865 5.684 468 HG21 ILE 72 HG21 ILE 72 12.335 16.280 8.107 469 HG22 ILE 72 HG22 ILE 72 14.044 15.889 8.193 470 HG23 ILE 72 HG23 ILE 72 12.873 14.627 7.820 471 HD11 ILE 72 HD11 ILE 72 11.750 16.689 4.494 472 HD12 ILE 72 HD12 ILE 72 12.726 18.065 3.943 473 HD13 ILE 72 HD13 ILE 72 11.393 18.325 5.066 474 H CYS 73 H CYS 73 15.560 14.002 3.904 475 HA CYS 73 HA CYS 73 15.990 16.096 1.935 476 HB2 CYS 73 HB2 CYS 73 17.880 14.773 2.360 477 HB3 CYS 73 HB3 CYS 73 16.946 13.292 2.397 478 H CYS 74 H CYS 74 14.154 16.521 0.770 479 HA CYS 74 HA CYS 74 12.945 14.221 -0.566 480 HB2 CYS 74 HB2 CYS 74 11.035 16.375 -0.203 481 HB3 CYS 74 HB3 CYS 74 10.868 14.670 0.128 482 H SER 75 H SER 75 11.352 14.994 -2.276 483 HA SER 75 HA SER 75 12.347 17.243 -3.871 484 HB2 SER 75 HB2 SER 75 12.215 15.774 -5.915 485 HB3 SER 75 HB3 SER 75 13.489 15.327 -4.821 486 HG SER 75 HG SER 75 11.574 13.808 -5.724 487 HA PRO 76 HA PRO 76 8.019 17.693 -4.758 488 HB2 PRO 76 HB2 PRO 76 7.718 18.077 -7.396 489 HB3 PRO 76 HB3 PRO 76 8.563 19.254 -6.383 490 HG2 PRO 76 HG2 PRO 76 9.689 17.155 -8.189 491 HG3 PRO 76 HG3 PRO 76 10.223 18.827 -7.947 492 HD2 PRO 76 HD2 PRO 76 11.397 16.648 -6.781 493 HD3 PRO 76 HD3 PRO 76 11.469 18.285 -6.105 494 H ASP 77 H ASP 77 9.104 14.922 -4.845 495 HA ASP 77 HA ASP 77 6.778 13.645 -6.022 496 HB2 ASP 77 HB2 ASP 77 9.537 13.368 -7.006 497 HB3 ASP 77 HB3 ASP 77 8.737 11.834 -6.680 498 H GLY 78 H GLY 78 9.604 13.501 -3.911 499 HA2 GLY 78 HA2 GLY 78 8.143 11.859 -2.063 500 HA3 GLY 78 HA3 GLY 78 9.511 11.067 -2.742 501 H CYS 79 H CYS 79 9.979 11.008 -0.350 502 HA CYS 79 HA CYS 79 11.879 13.116 0.257 503 HB2 CYS 79 HB2 CYS 79 9.648 13.737 1.307 504 HB3 CYS 79 HB3 CYS 79 9.834 12.314 2.325 505 H HIS 80 H HIS 80 13.386 12.507 2.082 506 HA HIS 80 HA HIS 80 13.264 9.702 2.872 507 HB2 HIS 80 HB2 HIS 80 14.423 10.039 0.512 508 HB3 HIS 80 HB3 HIS 80 15.797 10.524 1.497 509 HD1 HIS 80 HD1 HIS 80 14.555 7.676 -0.131 510 HD2 HIS 80 HD2 HIS 80 16.211 8.335 3.620 511 HE1 HIS 80 HE1 HIS 80 15.374 5.430 0.644 512 HE2 HIS 80 HE2 HIS 80 16.479 5.876 2.862 513 H GLU 81 H GLU 81 14.545 9.214 4.651 514 HA GLU 81 HA GLU 81 15.258 11.370 6.328 515 HB2 GLU 81 HB2 GLU 81 15.372 8.423 6.447 516 HB3 GLU 81 HB3 GLU 81 16.590 9.244 7.414 517 HG2 GLU 81 HG2 GLU 81 15.073 10.087 8.866 518 HG3 GLU 81 HG3 GLU 81 13.810 10.213 7.642 519 H ASP 82 H ASP 82 17.136 12.437 6.595 520 HA ASP 82 HA ASP 82 19.564 11.336 5.379 521 HB2 ASP 82 HB2 ASP 82 19.917 13.094 3.910 522 HB3 ASP 82 HB3 ASP 82 18.162 12.931 3.842 523 HA PRO 83 HA PRO 83 20.975 12.977 9.314 524 HB2 PRO 83 HB2 PRO 83 23.512 11.711 8.937 525 HB3 PRO 83 HB3 PRO 83 22.160 11.163 9.925 526 HG2 PRO 83 HG2 PRO 83 23.074 9.897 7.643 527 HG3 PRO 83 HG3 PRO 83 21.461 9.689 8.345 528 HD2 PRO 83 HD2 PRO 83 22.324 11.378 6.034 529 HD3 PRO 83 HD3 PRO 83 20.834 10.434 6.253 530 H ALA 84 H ALA 84 22.415 13.638 6.258 531 HA ALA 84 HA ALA 84 24.679 15.085 7.082 532 HB1 ALA 84 HB1 ALA 84 23.170 14.728 4.608 533 HB2 ALA 84 HB2 ALA 84 24.912 14.817 4.870 534 HB3 ALA 84 HB3 ALA 84 23.963 16.298 4.744 535 H CYS 85 H CYS 85 21.340 16.050 6.590 536 HA CYS 85 HA CYS 85 21.966 18.809 7.297 537 HB2 CYS 85 HB2 CYS 85 19.433 17.476 6.341 538 HB3 CYS 85 HB3 CYS 85 19.559 19.194 6.702 539 H ASP 86 H ASP 86 22.320 16.934 9.348 540 HA ASP 86 HA ASP 86 20.109 16.724 11.066 541 HB2 ASP 86 HB2 ASP 86 22.712 15.684 10.970 542 HB3 ASP 86 HB3 ASP 86 22.573 16.537 12.507 543 HA PRO 87 HA PRO 87 22.944 20.784 12.839 544 HB2 PRO 87 HB2 PRO 87 20.971 21.544 10.713 545 HB3 PRO 87 HB3 PRO 87 22.304 22.496 11.358 546 HG2 PRO 87 HG2 PRO 87 22.539 20.959 9.130 547 HG3 PRO 87 HG3 PRO 87 23.900 21.296 10.217 548 HD2 PRO 87 HD2 PRO 87 22.675 18.778 9.705 549 HD3 PRO 87 HD3 PRO 87 23.947 19.125 10.881 550 H GLU 88 H GLU 88 20.556 22.250 12.106 551 HA GLU 88 HA GLU 88 19.232 22.394 14.607 552 HB2 GLU 88 HB2 GLU 88 17.821 24.180 13.611 553 HB3 GLU 88 HB3 GLU 88 19.547 24.509 13.578 554 HG2 GLU 88 HG2 GLU 88 19.270 25.017 11.449 555 HG3 GLU 88 HG3 GLU 88 19.089 23.287 11.162 556 H ALA 89 H ALA 89 19.093 19.952 13.266 557 HA ALA 89 HA ALA 89 16.269 19.582 12.710 558 HB1 ALA 89 HB1 ALA 89 18.701 18.241 11.891 559 HB2 ALA 89 HB2 ALA 89 17.052 18.002 11.326 560 HB3 ALA 89 HB3 ALA 89 17.632 17.111 12.731 561 H ALA 90 H ALA 90 16.952 20.550 15.322 562 HA ALA 90 HA ALA 90 17.420 18.392 17.138 563 HB1 ALA 90 HB1 ALA 90 16.599 21.257 17.553 564 HB2 ALA 90 HB2 ALA 90 18.225 20.581 17.672 565 HB3 ALA 90 HB3 ALA 90 16.993 20.132 18.852 566 H PHE 91 H PHE 91 16.064 17.915 18.949 567 HA PHE 91 HA PHE 91 13.345 17.334 18.125 568 HB2 PHE 91 HB2 PHE 91 13.289 16.119 20.366 569 HB3 PHE 91 HB3 PHE 91 14.432 15.513 19.176 570 HD1 PHE 91 HD1 PHE 91 16.843 15.911 19.453 571 HD2 PHE 91 HD2 PHE 91 14.025 17.022 22.441 572 HE1 PHE 91 HE1 PHE 91 18.663 16.086 21.096 573 HE2 PHE 91 HE2 PHE 91 15.842 17.196 24.092 574 HZ PHE 91 HZ PHE 91 18.164 16.728 23.421 575 H SER 92 H SER 92 12.078 19.103 18.256 576 HA SER 92 HA SER 92 11.488 20.135 20.900 577 HB2 SER 92 HB2 SER 92 13.320 21.596 20.003 578 HB3 SER 92 HB3 SER 92 12.249 22.040 18.675 579 HG SER 92 HG SER 92 11.026 23.184 20.014 580 H1 ALA 101 H1 ALA 101 -12.921 -0.702 9.325 581 H2 ALA 101 H2 ALA 101 -11.679 -1.470 10.226 582 H3 ALA 101 H3 ALA 101 -13.031 -0.787 11.032 583 HA ALA 101 HA ALA 101 -14.302 -2.502 10.687 584 HB1 ALA 101 HB1 ALA 101 -13.849 -3.866 8.425 585 HB2 ALA 101 HB2 ALA 101 -13.205 -2.294 7.954 586 HB3 ALA 101 HB3 ALA 101 -14.874 -2.433 8.506 587 H VAL 102 H VAL 102 -11.052 -3.348 9.221 588 HA VAL 102 HA VAL 102 -10.618 -5.185 11.393 589 HB VAL 102 HB VAL 102 -10.287 -5.905 8.475 590 HG11 VAL 102 HG11 VAL 102 -8.713 -6.962 10.053 591 HG12 VAL 102 HG12 VAL 102 -9.795 -8.124 9.286 592 HG13 VAL 102 HG13 VAL 102 -10.085 -7.613 10.949 593 HG21 VAL 102 HG21 VAL 102 -12.654 -5.939 10.052 594 HG22 VAL 102 HG22 VAL 102 -12.165 -7.597 9.748 595 HG23 VAL 102 HG23 VAL 102 -12.424 -6.492 8.398 596 H LEU 103 H LEU 103 -8.662 -4.888 12.129 597 HA LEU 103 HA LEU 103 -6.711 -3.236 10.756 598 HB2 LEU 103 HB2 LEU 103 -6.885 -4.474 13.487 599 HB3 LEU 103 HB3 LEU 103 -5.393 -3.755 12.913 600 HG LEU 103 HG LEU 103 -6.590 -2.167 14.289 601 HD11 LEU 103 HD11 LEU 103 -5.576 -0.766 12.875 602 HD12 LEU 103 HD12 LEU 103 -7.183 -0.527 12.189 603 HD13 LEU 103 HD13 LEU 103 -6.077 -1.683 11.461 604 HD21 LEU 103 HD21 LEU 103 -8.838 -1.735 12.482 605 HD22 LEU 103 HD22 LEU 103 -8.797 -1.833 14.242 606 HD23 LEU 103 HD23 LEU 103 -8.868 -3.308 13.278 607 H ASP 104 H ASP 104 -5.410 -4.046 9.402 608 HA ASP 104 HA ASP 104 -4.631 -6.862 9.337 609 HB2 ASP 104 HB2 ASP 104 -4.857 -5.240 7.254 610 HB3 ASP 104 HB3 ASP 104 -3.205 -4.803 7.683 611 H LEU 105 H LEU 105 -3.914 -6.743 11.495 612 HA LEU 105 HA LEU 105 -1.168 -5.998 11.870 613 HB2 LEU 105 HB2 LEU 105 -2.444 -4.037 12.394 614 HB3 LEU 105 HB3 LEU 105 -3.625 -4.978 13.263 615 HG LEU 105 HG LEU 105 -2.421 -4.958 15.190 616 HD11 LEU 105 HD11 LEU 105 -0.301 -5.533 15.381 617 HD12 LEU 105 HD12 LEU 105 0.240 -4.200 14.367 618 HD13 LEU 105 HD13 LEU 105 -0.262 -5.720 13.631 619 HD21 LEU 105 HD21 LEU 105 -2.527 -2.567 13.812 620 HD22 LEU 105 HD22 LEU 105 -0.905 -2.614 14.501 621 HD23 LEU 105 HD23 LEU 105 -2.302 -2.800 15.530 622 H ASP 106 H ASP 106 -2.358 -6.410 14.705 623 HA ASP 106 HA ASP 106 -3.152 -9.095 14.916 624 HB2 ASP 106 HB2 ASP 106 -0.687 -9.045 14.234 625 HB3 ASP 106 HB3 ASP 106 -0.369 -8.581 15.917 626 H VAL 107 H VAL 107 -1.551 -6.430 16.302 627 HA VAL 107 HA VAL 107 -3.477 -6.162 18.468 628 HB VAL 107 HB VAL 107 -1.494 -7.254 19.502 629 HG11 VAL 107 HG11 VAL 107 -0.038 -5.323 17.875 630 HG12 VAL 107 HG12 VAL 107 0.485 -6.857 18.559 631 HG13 VAL 107 HG13 VAL 107 0.519 -5.397 19.544 632 HG21 VAL 107 HG21 VAL 107 -2.353 -6.005 21.157 633 HG22 VAL 107 HG22 VAL 107 -2.351 -4.529 20.193 634 HG23 VAL 107 HG23 VAL 107 -0.863 -5.083 20.959 635 H ARG 108 H ARG 108 -4.239 -4.075 18.229 636 HA ARG 108 HA ARG 108 -3.022 -2.477 16.296 637 HB2 ARG 108 HB2 ARG 108 -5.300 -2.265 16.193 638 HB3 ARG 108 HB3 ARG 108 -5.502 -2.539 17.908 639 HG2 ARG 108 HG2 ARG 108 -4.580 -0.119 18.143 640 HG3 ARG 108 HG3 ARG 108 -5.007 -0.002 16.447 641 HD2 ARG 108 HD2 ARG 108 -6.888 0.784 17.641 642 HD3 ARG 108 HD3 ARG 108 -7.300 -0.825 17.053 643 HE ARG 108 HE ARG 108 -6.258 -0.590 19.768 644 HH11 ARG 108 HH11 ARG 108 -9.023 -1.090 17.682 645 HH12 ARG 108 HH12 ARG 108 -10.010 -1.735 18.948 646 HH21 ARG 108 HH21 ARG 108 -7.567 -1.435 21.424 647 HH22 ARG 108 HH22 ARG 108 -9.189 -1.929 21.067 648 H THR 109 H THR 109 -1.116 -1.561 16.795 649 HA THR 109 HA THR 109 -1.304 -0.145 19.372 650 HB THR 109 HB THR 109 1.197 -0.707 17.703 651 HG1 THR 109 HG1 THR 109 -0.014 -2.297 19.626 652 HG21 THR 109 HG21 THR 109 2.368 -0.344 19.874 653 HG22 THR 109 HG22 THR 109 0.857 0.314 20.489 654 HG23 THR 109 HG23 THR 109 1.661 1.073 19.127 655 H CYS 110 H CYS 110 -2.589 1.252 18.480 656 HA CYS 110 HA CYS 110 -2.026 2.370 15.881 657 HB2 CYS 110 HB2 CYS 110 -4.208 2.369 17.715 658 HB3 CYS 110 HB3 CYS 110 -3.818 4.050 17.364 659 H LEU 111 H LEU 111 0.237 2.782 16.649 660 HA LEU 111 HA LEU 111 1.283 4.464 18.402 661 HB2 LEU 111 HB2 LEU 111 1.957 4.570 15.469 662 HB3 LEU 111 HB3 LEU 111 2.960 5.189 16.761 663 HG LEU 111 HG LEU 111 3.985 3.191 16.264 664 HD11 LEU 111 HD11 LEU 111 2.009 2.562 18.433 665 HD12 LEU 111 HD12 LEU 111 3.651 3.176 18.614 666 HD13 LEU 111 HD13 LEU 111 3.383 1.535 18.023 667 HD21 LEU 111 HD21 LEU 111 2.908 1.938 14.774 668 HD22 LEU 111 HD22 LEU 111 1.324 2.398 15.386 669 HD23 LEU 111 HD23 LEU 111 2.225 1.099 16.166 670 HA PRO 112 HA PRO 112 -0.949 8.359 17.677 671 HB2 PRO 112 HB2 PRO 112 0.153 9.663 19.815 672 HB3 PRO 112 HB3 PRO 112 -1.265 8.618 19.939 673 HG2 PRO 112 HG2 PRO 112 1.584 8.036 20.605 674 HG3 PRO 112 HG3 PRO 112 0.107 7.537 21.447 675 HD2 PRO 112 HD2 PRO 112 1.507 5.873 19.815 676 HD3 PRO 112 HD3 PRO 112 -0.249 5.756 20.040 677 H CYS 113 H CYS 113 -0.254 10.408 16.877 678 HA CYS 113 HA CYS 113 2.541 11.063 16.994 679 HB2 CYS 113 HB2 CYS 113 2.836 9.678 15.212 680 HB3 CYS 113 HB3 CYS 113 1.231 9.946 14.583 681 H GLY 114 H GLY 114 2.981 13.171 15.717 682 HA2 GLY 114 HA2 GLY 114 2.461 15.345 15.173 683 HA3 GLY 114 HA3 GLY 114 0.784 14.888 15.065 684 HA PRO 115 HA PRO 115 1.117 17.850 18.689 685 HB2 PRO 115 HB2 PRO 115 -1.304 18.950 18.298 686 HB3 PRO 115 HB3 PRO 115 0.057 19.439 17.261 687 HG2 PRO 115 HG2 PRO 115 -1.855 17.192 16.820 688 HG3 PRO 115 HG3 PRO 115 -1.692 18.641 15.780 689 HD2 PRO 115 HD2 PRO 115 -0.328 16.534 15.053 690 HD3 PRO 115 HD3 PRO 115 0.615 18.038 15.257 691 H GLY 116 H GLY 116 -0.182 17.230 20.596 692 HA2 GLY 116 HA2 GLY 116 -0.856 15.581 22.004 693 HA3 GLY 116 HA3 GLY 116 -2.185 15.942 20.941 694 H GLY 117 H GLY 117 -0.115 14.287 18.866 695 HA2 GLY 117 HA2 GLY 117 0.091 12.160 18.445 696 HA3 GLY 117 HA3 GLY 117 -0.512 11.889 20.039 697 H LYS 118 H LYS 118 -1.968 13.583 17.402 698 HA LYS 118 HA LYS 118 -4.371 11.926 17.403 699 HB2 LYS 118 HB2 LYS 118 -4.256 14.212 15.549 700 HB3 LYS 118 HB3 LYS 118 -5.515 13.733 16.675 701 HG2 LYS 118 HG2 LYS 118 -3.357 14.647 18.244 702 HG3 LYS 118 HG3 LYS 118 -3.553 15.798 16.924 703 HD2 LYS 118 HD2 LYS 118 -6.139 15.381 17.681 704 HD3 LYS 118 HD3 LYS 118 -5.291 15.238 19.221 705 HE2 LYS 118 HE2 LYS 118 -4.374 17.487 17.602 706 HE3 LYS 118 HE3 LYS 118 -6.083 17.587 18.027 707 HZ1 LYS 118 HZ1 LYS 118 -3.732 17.733 19.740 708 HZ2 LYS 118 HZ2 LYS 118 -5.075 16.922 20.374 709 HZ3 LYS 118 HZ3 LYS 118 -5.219 18.530 19.870 710 H GLY 119 H GLY 119 -1.483 12.315 15.680 711 HA2 GLY 119 HA2 GLY 119 -2.488 11.122 13.188 712 HA3 GLY 119 HA3 GLY 119 -0.868 11.770 13.442 713 H ARG 120 H ARG 120 0.043 9.420 12.526 714 HA ARG 120 HA ARG 120 0.131 7.727 14.815 715 HB2 ARG 120 HB2 ARG 120 -1.527 7.198 12.607 716 HB3 ARG 120 HB3 ARG 120 -0.065 6.279 12.298 717 HG2 ARG 120 HG2 ARG 120 -0.400 4.872 14.054 718 HG3 ARG 120 HG3 ARG 120 -1.301 6.071 14.983 719 HD2 ARG 120 HD2 ARG 120 -2.709 4.208 14.164 720 HD3 ARG 120 HD3 ARG 120 -3.235 5.788 13.587 721 HE ARG 120 HE ARG 120 -1.527 4.696 11.670 722 HH11 ARG 120 HH11 ARG 120 -4.673 4.045 13.045 723 HH12 ARG 120 HH12 ARG 120 -5.281 3.294 11.610 724 HH21 ARG 120 HH21 ARG 120 -2.338 3.710 9.780 725 HH22 ARG 120 HH22 ARG 120 -3.960 3.104 9.761 726 H CYS 121 H CYS 121 2.034 6.056 14.213 727 HA CYS 121 HA CYS 121 4.060 7.658 12.785 728 HB2 CYS 121 HB2 CYS 121 4.161 5.999 15.209 729 HB3 CYS 121 HB3 CYS 121 5.514 5.750 14.108 730 H PHE 122 H PHE 122 5.404 6.844 11.278 731 HA PHE 122 HA PHE 122 5.375 4.052 10.516 732 HB2 PHE 122 HB2 PHE 122 4.229 6.191 8.691 733 HB3 PHE 122 HB3 PHE 122 4.678 4.574 8.156 734 HD1 PHE 122 HD1 PHE 122 3.374 2.636 8.818 735 HD2 PHE 122 HD2 PHE 122 2.255 6.568 10.021 736 HE1 PHE 122 HE1 PHE 122 1.142 1.806 9.447 737 HE2 PHE 122 HE2 PHE 122 0.021 5.738 10.642 738 HZ PHE 122 HZ PHE 122 -0.534 3.357 10.364 739 H GLY 123 H GLY 123 7.507 5.153 11.449 740 HA2 GLY 123 HA2 GLY 123 9.717 4.865 10.273 741 HA3 GLY 123 HA3 GLY 123 9.129 6.104 9.167 742 HA PRO 124 HA PRO 124 11.188 7.707 13.324 743 HB2 PRO 124 HB2 PRO 124 13.462 8.272 11.476 744 HB3 PRO 124 HB3 PRO 124 13.482 7.804 13.179 745 HG2 PRO 124 HG2 PRO 124 14.073 6.032 11.287 746 HG3 PRO 124 HG3 PRO 124 13.117 5.562 12.706 747 HD2 PRO 124 HD2 PRO 124 12.219 6.086 9.901 748 HD3 PRO 124 HD3 PRO 124 11.636 4.877 11.064 749 H SER 125 H SER 125 12.467 9.252 10.352 750 HA SER 125 HA SER 125 11.139 11.713 11.186 751 HB2 SER 125 HB2 SER 125 13.347 11.073 9.280 752 HB3 SER 125 HB3 SER 125 12.378 12.510 8.932 753 HG SER 125 HG SER 125 13.085 13.428 10.761 754 H ILE 126 H ILE 126 9.486 9.617 10.402 755 HA ILE 126 HA ILE 126 8.085 10.853 8.233 756 HB ILE 126 HB ILE 126 8.635 7.892 8.168 757 HG12 ILE 126 HG12 ILE 126 9.977 10.061 6.572 758 HG13 ILE 126 HG13 ILE 126 10.736 9.195 7.879 759 HG21 ILE 126 HG21 ILE 126 7.125 7.866 6.552 760 HG22 ILE 126 HG22 ILE 126 8.021 9.095 5.656 761 HG23 ILE 126 HG23 ILE 126 6.828 9.571 6.852 762 HD11 ILE 126 HD11 ILE 126 11.519 8.232 5.881 763 HD12 ILE 126 HD12 ILE 126 9.896 8.140 5.198 764 HD13 ILE 126 HD13 ILE 126 10.348 7.097 6.547 765 H CYS 127 H CYS 127 6.335 11.370 9.383 766 HA CYS 127 HA CYS 127 5.014 9.280 10.997 767 HB2 CYS 127 HB2 CYS 127 5.980 11.735 11.798 768 HB3 CYS 127 HB3 CYS 127 4.288 12.075 11.487 769 H CYS 128 H CYS 128 3.033 8.621 10.175 770 HA CYS 128 HA CYS 128 1.474 10.625 8.715 771 HB2 CYS 128 HB2 CYS 128 1.194 8.091 7.386 772 HB3 CYS 128 HB3 CYS 128 1.606 9.659 6.725 773 H GLY 129 H GLY 129 -0.731 10.783 9.484 774 HA2 GLY 129 HA2 GLY 129 -1.894 8.283 10.364 775 HA3 GLY 129 HA3 GLY 129 -2.322 9.904 10.901 776 H ASP 130 H ASP 130 -4.490 9.028 10.077 777 HA ASP 130 HA ASP 130 -4.925 8.610 7.377 778 HB2 ASP 130 HB2 ASP 130 -7.313 8.955 7.869 779 HB3 ASP 130 HB3 ASP 130 -6.522 7.838 8.975 780 H GLU 131 H GLU 131 -5.903 11.604 9.112 781 HA GLU 131 HA GLU 131 -5.853 12.913 6.519 782 HB2 GLU 131 HB2 GLU 131 -7.069 14.409 8.649 783 HB3 GLU 131 HB3 GLU 131 -7.860 13.785 7.216 784 HG2 GLU 131 HG2 GLU 131 -7.860 11.575 8.714 785 HG3 GLU 131 HG3 GLU 131 -7.785 12.764 10.007 786 H LEU 132 H LEU 132 -3.797 12.453 8.550 787 HA LEU 132 HA LEU 132 -2.835 15.179 8.908 788 HB2 LEU 132 HB2 LEU 132 -3.153 12.878 10.636 789 HB3 LEU 132 HB3 LEU 132 -1.481 13.303 10.515 790 HG LEU 132 HG LEU 132 -3.704 15.133 11.412 791 HD11 LEU 132 HD11 LEU 132 -3.273 13.381 13.027 792 HD12 LEU 132 HD12 LEU 132 -2.701 14.936 13.632 793 HD13 LEU 132 HD13 LEU 132 -1.548 13.758 13.004 794 HD21 LEU 132 HD21 LEU 132 -2.290 16.766 10.872 795 HD22 LEU 132 HD22 LEU 132 -0.976 15.639 10.641 796 HD23 LEU 132 HD23 LEU 132 -1.332 16.235 12.254 797 H GLY 133 H GLY 133 -2.836 12.288 7.295 798 HA2 GLY 133 HA2 GLY 133 -1.497 11.209 5.886 799 HA3 GLY 133 HA3 GLY 133 -1.064 12.837 5.475 800 H CYS 134 H CYS 134 1.338 12.848 5.269 801 HA CYS 134 HA CYS 134 2.596 11.629 7.597 802 HB2 CYS 134 HB2 CYS 134 2.782 10.420 5.253 803 HB3 CYS 134 HB3 CYS 134 4.057 11.581 5.024 804 H PHE 135 H PHE 135 3.755 13.065 8.723 805 HA PHE 135 HA PHE 135 4.913 15.266 7.208 806 HB2 PHE 135 HB2 PHE 135 5.538 15.152 10.067 807 HB3 PHE 135 HB3 PHE 135 4.834 16.470 9.143 808 HD1 PHE 135 HD1 PHE 135 2.407 16.665 8.918 809 HD2 PHE 135 HD2 PHE 135 4.180 13.640 11.302 810 HE1 PHE 135 HE1 PHE 135 0.258 16.255 9.993 811 HE2 PHE 135 HE2 PHE 135 2.013 13.219 12.378 812 HZ PHE 135 HZ PHE 135 0.055 14.507 11.741 813 H VAL 136 H VAL 136 6.615 14.419 6.192 814 HA VAL 136 HA VAL 136 8.193 12.447 7.554 815 HB VAL 136 HB VAL 136 8.783 13.515 4.803 816 HG11 VAL 136 HG11 VAL 136 9.268 10.763 5.031 817 HG12 VAL 136 HG12 VAL 136 9.895 11.512 6.493 818 HG13 VAL 136 HG13 VAL 136 10.452 12.065 4.925 819 HG21 VAL 136 HG21 VAL 136 6.498 12.840 4.616 820 HG22 VAL 136 HG22 VAL 136 6.753 11.418 5.610 821 HG23 VAL 136 HG23 VAL 136 7.439 11.492 3.988 822 H GLY 137 H GLY 137 9.042 13.374 9.126 823 HA2 GLY 137 HA2 GLY 137 11.056 14.292 10.024 824 HA3 GLY 137 HA3 GLY 137 11.235 15.229 8.567 825 H THR 138 H THR 138 9.386 14.969 11.535 826 HA THR 138 HA THR 138 9.430 17.820 11.895 827 HB THR 138 HB THR 138 7.003 18.110 12.058 828 HG1 THR 138 HG1 THR 138 6.886 15.556 12.256 829 HG21 THR 138 HG21 THR 138 7.018 18.722 9.945 830 HG22 THR 138 HG22 THR 138 6.666 17.062 9.480 831 HG23 THR 138 HG23 THR 138 8.326 17.613 9.585 832 H ALA 139 H ALA 139 8.380 18.391 14.126 833 HA ALA 139 HA ALA 139 9.335 16.615 16.091 834 HB1 ALA 139 HB1 ALA 139 7.298 18.819 16.410 835 HB2 ALA 139 HB2 ALA 139 9.043 19.078 16.364 836 HB3 ALA 139 HB3 ALA 139 8.325 18.133 17.669 837 H GLU 140 H GLU 140 6.564 16.560 14.223 838 HA GLU 140 HA GLU 140 4.708 15.359 16.066 839 HB2 GLU 140 HB2 GLU 140 4.746 15.405 13.040 840 HB3 GLU 140 HB3 GLU 140 3.410 14.841 14.023 841 HG2 GLU 140 HG2 GLU 140 3.265 17.120 15.026 842 HG3 GLU 140 HG3 GLU 140 4.492 17.646 13.875 843 H ALA 141 H ALA 141 7.453 14.359 14.368 844 HA ALA 141 HA ALA 141 6.733 11.560 14.319 845 HB1 ALA 141 HB1 ALA 141 7.869 12.645 12.379 846 HB2 ALA 141 HB2 ALA 141 8.707 11.241 13.029 847 HB3 ALA 141 HB3 ALA 141 9.296 12.858 13.402 848 H LEU 142 H LEU 142 8.619 13.821 16.150 849 HA LEU 142 HA LEU 142 10.563 12.401 17.301 850 HB2 LEU 142 HB2 LEU 142 8.793 14.505 18.358 851 HB3 LEU 142 HB3 LEU 142 9.709 13.609 19.554 852 HG LEU 142 HG LEU 142 11.085 14.820 17.177 853 HD11 LEU 142 HD11 LEU 142 10.754 16.895 17.875 854 HD12 LEU 142 HD12 LEU 142 11.386 16.482 19.468 855 HD13 LEU 142 HD13 LEU 142 9.666 16.299 19.127 856 HD21 LEU 142 HD21 LEU 142 12.091 14.385 19.976 857 HD22 LEU 142 HD22 LEU 142 13.018 14.691 18.509 858 HD23 LEU 142 HD23 LEU 142 12.194 13.151 18.720 859 H ARG 143 H ARG 143 7.175 11.797 18.013 860 HA ARG 143 HA ARG 143 7.648 10.068 20.248 861 HB2 ARG 143 HB2 ARG 143 5.392 10.992 18.663 862 HB3 ARG 143 HB3 ARG 143 5.239 9.280 19.031 863 HG2 ARG 143 HG2 ARG 143 5.647 11.493 21.038 864 HG3 ARG 143 HG3 ARG 143 4.124 10.669 20.699 865 HD2 ARG 143 HD2 ARG 143 6.632 9.407 21.799 866 HD3 ARG 143 HD3 ARG 143 5.170 9.776 22.710 867 HE ARG 143 HE ARG 143 5.525 7.632 20.758 868 HH11 ARG 143 HH11 ARG 143 3.414 9.326 22.974 869 HH12 ARG 143 HH12 ARG 143 2.240 8.056 23.012 870 HH21 ARG 143 HH21 ARG 143 3.974 5.972 20.810 871 HH22 ARG 143 HH22 ARG 143 2.555 6.155 21.785 872 H CYS 144 H CYS 144 7.884 9.930 17.021 873 HA CYS 144 HA CYS 144 7.539 7.179 16.387 874 HB2 CYS 144 HB2 CYS 144 8.902 9.368 14.967 875 HB3 CYS 144 HB3 CYS 144 9.427 7.758 14.526 876 H GLN 145 H GLN 145 10.238 8.689 17.959 877 HA GLN 145 HA GLN 145 12.289 6.884 17.583 878 HB2 GLN 145 HB2 GLN 145 12.262 9.047 18.964 879 HB3 GLN 145 HB3 GLN 145 11.656 8.056 20.284 880 HG2 GLN 145 HG2 GLN 145 13.641 6.971 20.572 881 HG3 GLN 145 HG3 GLN 145 14.125 7.175 18.890 882 HE21 GLN 145 HE21 GLN 145 13.527 9.033 21.847 883 HE22 GLN 145 HE22 GLN 145 14.785 10.188 21.585 884 H GLU 146 H GLU 146 9.531 6.607 19.815 885 HA GLU 146 HA GLU 146 10.515 4.073 20.823 886 HB2 GLU 146 HB2 GLU 146 8.469 6.007 21.588 887 HB3 GLU 146 HB3 GLU 146 7.872 4.356 21.669 888 HG2 GLU 146 HG2 GLU 146 10.512 4.857 22.882 889 HG3 GLU 146 HG3 GLU 146 9.119 5.575 23.689 890 H GLU 147 H GLU 147 9.283 4.868 17.980 891 HA GLU 147 HA GLU 147 7.275 2.813 17.701 892 HB2 GLU 147 HB2 GLU 147 7.379 5.049 16.413 893 HB3 GLU 147 HB3 GLU 147 8.636 4.286 15.450 894 HG2 GLU 147 HG2 GLU 147 6.292 2.605 15.684 895 HG3 GLU 147 HG3 GLU 147 5.910 4.184 15.005 896 H ASN 148 H ASN 148 10.512 2.757 18.105 897 HA ASN 148 HA ASN 148 11.089 0.708 16.123 898 HB2 ASN 148 HB2 ASN 148 12.648 2.685 17.204 899 HB3 ASN 148 HB3 ASN 148 13.124 1.294 18.171 900 HD21 ASN 148 HD21 ASN 148 12.727 2.414 14.849 901 HD22 ASN 148 HD22 ASN 148 13.984 1.436 14.179 902 H TYR 149 H TYR 149 10.345 1.105 19.487 903 HA TYR 149 HA TYR 149 11.054 -1.665 20.141 904 HB2 TYR 149 HB2 TYR 149 11.428 0.414 21.650 905 HB3 TYR 149 HB3 TYR 149 9.711 0.274 22.010 906 HD1 TYR 149 HD1 TYR 149 12.726 -1.944 21.847 907 HD2 TYR 149 HD2 TYR 149 9.148 -0.908 23.903 908 HE1 TYR 149 HE1 TYR 149 13.228 -3.635 23.560 909 HE2 TYR 149 HE2 TYR 149 9.641 -2.595 25.623 910 HH TYR 149 HH TYR 149 11.020 -4.788 25.712 911 H LEU 150 H LEU 150 8.624 -0.531 18.449 912 HA LEU 150 HA LEU 150 6.715 -2.459 19.558 913 HB2 LEU 150 HB2 LEU 150 6.201 0.451 19.004 914 HB3 LEU 150 HB3 LEU 150 4.898 -0.720 18.920 915 HG LEU 150 HG LEU 150 5.845 -1.331 21.353 916 HD11 LEU 150 HD11 LEU 150 7.458 0.748 20.840 917 HD12 LEU 150 HD12 LEU 150 6.908 0.323 22.461 918 HD13 LEU 150 HD13 LEU 150 6.093 1.602 21.560 919 HD21 LEU 150 HD21 LEU 150 4.120 0.302 22.231 920 HD22 LEU 150 HD22 LEU 150 3.568 -0.857 21.026 921 HD23 LEU 150 HD23 LEU 150 3.896 0.812 20.556 922 HA PRO 151 HA PRO 151 6.943 -2.964 15.019 923 HB2 PRO 151 HB2 PRO 151 7.090 -5.623 14.933 924 HB3 PRO 151 HB3 PRO 151 8.489 -4.650 15.403 925 HG2 PRO 151 HG2 PRO 151 6.590 -6.192 17.119 926 HG3 PRO 151 HG3 PRO 151 8.347 -6.020 17.266 927 HD2 PRO 151 HD2 PRO 151 6.466 -4.574 18.720 928 HD3 PRO 151 HD3 PRO 151 8.160 -4.100 18.484 929 H SER 152 H SER 152 4.496 -2.383 16.317 930 HA SER 152 HA SER 152 2.704 -4.209 14.872 931 HB2 SER 152 HB2 SER 152 1.068 -3.599 16.875 932 HB3 SER 152 HB3 SER 152 2.196 -4.947 17.002 933 HG SER 152 HG SER 152 2.273 -3.577 18.836 934 HA PRO 153 HA PRO 153 1.580 0.066 13.723 935 HB2 PRO 153 HB2 PRO 153 1.567 -0.225 11.073 936 HB3 PRO 153 HB3 PRO 153 3.086 -0.115 11.971 937 HG2 PRO 153 HG2 PRO 153 1.761 -2.494 10.774 938 HG3 PRO 153 HG3 PRO 153 3.486 -2.136 10.949 939 HD2 PRO 153 HD2 PRO 153 1.923 -3.789 12.628 940 HD3 PRO 153 HD3 PRO 153 3.574 -3.219 12.943 941 H CYS 154 H CYS 154 -0.431 0.853 13.507 942 HA CYS 154 HA CYS 154 -2.692 -0.825 13.479 943 HB2 CYS 154 HB2 CYS 154 -2.139 1.900 13.951 944 HB3 CYS 154 HB3 CYS 154 -3.347 1.860 12.676 945 H GLN 155 H GLN 155 -2.784 -2.130 11.643 946 HA GLN 155 HA GLN 155 -2.971 -2.698 9.430 947 HB2 GLN 155 HB2 GLN 155 -5.223 -1.947 10.161 948 HB3 GLN 155 HB3 GLN 155 -4.899 -0.376 9.454 949 HG2 GLN 155 HG2 GLN 155 -4.523 -1.612 7.270 950 HG3 GLN 155 HG3 GLN 155 -5.216 -3.017 8.068 951 HE21 GLN 155 HE21 GLN 155 -5.965 0.444 7.856 952 HE22 GLN 155 HE22 GLN 155 -7.636 0.233 7.471 953 H SER 156 H SER 156 -3.904 0.351 8.174 954 HA SER 156 HA SER 156 -2.838 2.015 7.008 955 HB2 SER 156 HB2 SER 156 -0.544 2.281 6.890 956 HB3 SER 156 HB3 SER 156 -0.702 1.356 8.380 957 HG SER 156 HG SER 156 -0.454 -0.215 6.141 958 H GLY 157 H GLY 157 -2.823 2.326 4.839 959 HA2 GLY 157 HA2 GLY 157 -3.765 0.358 3.164 960 HA3 GLY 157 HA3 GLY 157 -3.036 1.855 2.606 961 H GLN 158 H GLN 158 -2.828 -1.442 2.490 962 HA GLN 158 HA GLN 158 0.020 -1.684 2.461 963 HB2 GLN 158 HB2 GLN 158 -2.157 -3.496 1.358 964 HB3 GLN 158 HB3 GLN 158 -0.470 -3.955 1.545 965 HG2 GLN 158 HG2 GLN 158 -0.689 -3.665 3.977 966 HG3 GLN 158 HG3 GLN 158 -2.391 -3.262 3.760 967 HE21 GLN 158 HE21 GLN 158 -3.717 -4.938 2.662 968 HE22 GLN 158 HE22 GLN 158 -3.380 -6.594 3.018 969 H LYS 159 H LYS 159 0.009 0.275 1.055 970 HA LYS 159 HA LYS 159 0.039 -0.497 -1.763 971 HB2 LYS 159 HB2 LYS 159 -0.716 2.001 -0.454 972 HB3 LYS 159 HB3 LYS 159 0.247 2.180 -1.914 973 HG2 LYS 159 HG2 LYS 159 -2.336 0.641 -1.672 974 HG3 LYS 159 HG3 LYS 159 -2.141 2.231 -2.410 975 HD2 LYS 159 HD2 LYS 159 -0.658 -0.210 -3.368 976 HD3 LYS 159 HD3 LYS 159 -2.230 0.268 -4.006 977 HE2 LYS 159 HE2 LYS 159 -1.371 2.303 -4.849 978 HE3 LYS 159 HE3 LYS 159 0.132 2.127 -3.944 979 HZ1 LYS 159 HZ1 LYS 159 0.120 -0.101 -5.441 980 HZ2 LYS 159 HZ2 LYS 159 0.907 1.334 -5.872 981 HZ3 LYS 159 HZ3 LYS 159 -0.631 0.996 -6.489 982 HA PRO 160 HA PRO 160 4.360 0.069 -0.310 983 HB2 PRO 160 HB2 PRO 160 5.485 -2.204 -1.194 984 HB3 PRO 160 HB3 PRO 160 4.633 -2.090 0.351 985 HG2 PRO 160 HG2 PRO 160 3.660 -3.126 -2.279 986 HG3 PRO 160 HG3 PRO 160 3.404 -3.785 -0.655 987 HD2 PRO 160 HD2 PRO 160 1.542 -2.292 -1.989 988 HD3 PRO 160 HD3 PRO 160 1.654 -2.356 -0.220 989 H CYS 161 H CYS 161 4.313 1.682 -1.810 990 HA CYS 161 HA CYS 161 5.438 1.190 -4.416 991 HB2 CYS 161 HB2 CYS 161 4.761 3.224 -5.211 992 HB3 CYS 161 HB3 CYS 161 3.424 2.763 -4.164 993 H GLY 162 H GLY 162 6.819 4.026 -4.143 994 HA2 GLY 162 HA2 GLY 162 9.060 4.483 -3.825 995 HA3 GLY 162 HA3 GLY 162 8.439 4.171 -2.220 996 H SER 163 H SER 163 10.670 3.947 -1.873 997 HA SER 163 HA SER 163 12.092 1.602 -2.785 998 HB2 SER 163 HB2 SER 163 12.897 4.097 -2.030 999 HB3 SER 163 HB3 SER 163 13.191 3.194 -0.545 1000 HG SER 163 HG SER 163 15.004 3.152 -1.924 1001 H GLY 164 H GLY 164 9.753 0.985 -1.481 1002 HA2 GLY 164 HA2 GLY 164 9.571 -1.022 -0.144 1003 HA3 GLY 164 HA3 GLY 164 10.705 -0.297 0.975 1004 H GLY 165 H GLY 165 8.337 2.037 -0.055 1005 HA2 GLY 165 HA2 GLY 165 7.014 1.600 2.541 1006 HA3 GLY 165 HA3 GLY 165 7.068 3.111 1.675 1007 H ARG 166 H ARG 166 4.985 1.387 2.907 1008 HA ARG 166 HA ARG 166 3.165 1.049 0.702 1009 HB2 ARG 166 HB2 ARG 166 1.665 -0.055 2.506 1010 HB3 ARG 166 HB3 ARG 166 3.023 -0.964 1.853 1011 HG2 ARG 166 HG2 ARG 166 4.015 0.491 4.043 1012 HG3 ARG 166 HG3 ARG 166 2.475 -0.197 4.553 1013 HD2 ARG 166 HD2 ARG 166 4.271 -1.742 5.046 1014 HD3 ARG 166 HD3 ARG 166 3.233 -2.407 3.786 1015 HE ARG 166 HE ARG 166 5.182 -1.182 2.378 1016 HH11 ARG 166 HH11 ARG 166 5.250 -3.504 4.988 1017 HH12 ARG 166 HH12 ARG 166 6.742 -4.218 4.473 1018 HH21 ARG 166 HH21 ARG 166 7.138 -2.121 1.707 1019 HH22 ARG 166 HH22 ARG 166 7.813 -3.434 2.613 1020 H CYS 167 H CYS 167 0.834 1.943 0.986 1021 HA CYS 167 HA CYS 167 0.896 4.603 1.619 1022 HB2 CYS 167 HB2 CYS 167 -1.225 2.564 1.226 1023 HB3 CYS 167 HB3 CYS 167 -1.714 3.995 2.117 1024 H ALA 168 H ALA 168 1.589 5.318 3.519 1025 HA ALA 168 HA ALA 168 0.909 3.894 5.947 1026 HB1 ALA 168 HB1 ALA 168 3.073 4.969 5.900 1027 HB2 ALA 168 HB2 ALA 168 2.060 5.800 7.081 1028 HB3 ALA 168 HB3 ALA 168 2.342 6.524 5.495 1029 H ALA 169 H ALA 169 -0.175 6.574 3.930 1030 HA ALA 169 HA ALA 169 -2.633 6.800 5.387 1031 HB1 ALA 169 HB1 ALA 169 -1.490 9.418 5.091 1032 HB2 ALA 169 HB2 ALA 169 -0.444 8.422 6.099 1033 HB3 ALA 169 HB3 ALA 169 -2.132 8.645 6.531 1034 H ALA 170 H ALA 170 -4.148 7.581 3.920 1035 HA ALA 170 HA ALA 170 -4.802 7.523 1.607 1036 HB1 ALA 170 HB1 ALA 170 -4.169 10.413 1.992 1037 HB2 ALA 170 HB2 ALA 170 -5.265 9.592 3.101 1038 HB3 ALA 170 HB3 ALA 170 -5.641 9.646 1.381 1039 H GLY 171 H GLY 171 -3.943 10.063 0.143 1040 HA2 GLY 171 HA2 GLY 171 -2.427 8.901 -1.824 1041 HA3 GLY 171 HA3 GLY 171 -2.666 10.626 -1.641 1042 H ILE 172 H ILE 172 -1.064 9.080 0.980 1043 HA ILE 172 HA ILE 172 1.565 9.920 -0.099 1044 HB ILE 172 HB ILE 172 2.156 10.762 2.014 1045 HG12 ILE 172 HG12 ILE 172 -0.003 10.735 3.681 1046 HG13 ILE 172 HG13 ILE 172 -0.086 9.136 2.940 1047 HG21 ILE 172 HG21 ILE 172 0.795 12.177 0.556 1048 HG22 ILE 172 HG22 ILE 172 0.586 12.545 2.265 1049 HG23 ILE 172 HG23 ILE 172 -0.654 11.643 1.409 1050 HD11 ILE 172 HD11 ILE 172 2.585 9.891 3.636 1051 HD12 ILE 172 HD12 ILE 172 1.678 8.423 4.054 1052 HD13 ILE 172 HD13 ILE 172 1.493 9.879 5.028 1053 H CYS 173 H CYS 173 2.451 8.106 -0.709 1054 HA CYS 173 HA CYS 173 2.349 5.687 0.899 1055 HB2 CYS 173 HB2 CYS 173 1.842 5.368 -1.373 1056 HB3 CYS 173 HB3 CYS 173 3.143 6.415 -1.900 1057 H CYS 174 H CYS 174 3.817 5.735 2.560 1058 HA CYS 174 HA CYS 174 6.597 6.181 1.780 1059 HB2 CYS 174 HB2 CYS 174 6.146 6.846 4.568 1060 HB3 CYS 174 HB3 CYS 174 6.980 7.748 3.328 1061 H SER 175 H SER 175 8.089 5.561 3.642 1062 HA SER 175 HA SER 175 7.331 3.057 4.963 1063 HB2 SER 175 HB2 SER 175 9.540 2.076 4.246 1064 HB3 SER 175 HB3 SER 175 8.429 2.314 2.932 1065 HG SER 175 HG SER 175 9.656 3.829 2.116 1066 HA PRO 176 HA PRO 176 9.893 4.729 8.180 1067 HB2 PRO 176 HB2 PRO 176 11.528 2.797 9.070 1068 HB3 PRO 176 HB3 PRO 176 9.775 2.688 9.271 1069 HG2 PRO 176 HG2 PRO 176 11.535 1.372 7.244 1070 HG3 PRO 176 HG3 PRO 176 10.159 0.699 8.138 1071 HD2 PRO 176 HD2 PRO 176 10.028 1.612 5.561 1072 HD3 PRO 176 HD3 PRO 176 8.635 1.544 6.654 1073 H ASP 177 H ASP 177 10.948 4.947 5.406 1074 HA ASP 177 HA ASP 177 13.631 5.815 6.090 1075 HB2 ASP 177 HB2 ASP 177 12.988 3.583 4.286 1076 HB3 ASP 177 HB3 ASP 177 14.058 4.789 3.579 1077 H GLY 178 H GLY 178 10.890 5.825 3.866 1078 HA2 GLY 178 HA2 GLY 178 11.387 8.586 3.260 1079 HA3 GLY 178 HA3 GLY 178 11.558 7.551 1.898 1080 H CYS 179 H CYS 179 9.813 9.095 1.189 1081 HA CYS 179 HA CYS 179 7.247 7.772 1.493 1082 HB2 CYS 179 HB2 CYS 179 7.381 9.639 3.213 1083 HB3 CYS 179 HB3 CYS 179 7.432 10.762 1.858 1084 H HIS 180 H HIS 180 5.635 8.477 -0.205 1085 HA HIS 180 HA HIS 180 6.774 10.054 -2.378 1086 HB2 HIS 180 HB2 HIS 180 7.500 7.507 -2.492 1087 HB3 HIS 180 HB3 HIS 180 5.880 7.298 -3.145 1088 HD1 HIS 180 HD1 HIS 180 9.177 7.720 -4.270 1089 HD2 HIS 180 HD2 HIS 180 5.536 9.369 -5.397 1090 HE1 HIS 180 HE1 HIS 180 9.520 8.565 -6.611 1091 HE2 HIS 180 HE2 HIS 180 7.270 9.451 -7.315 1092 H GLU 181 H GLU 181 5.242 10.812 -3.835 1093 HA GLU 181 HA GLU 181 2.577 10.961 -2.910 1094 HB2 GLU 181 HB2 GLU 181 4.105 11.945 -5.235 1095 HB3 GLU 181 HB3 GLU 181 2.390 11.702 -5.534 1096 HG2 GLU 181 HG2 GLU 181 1.766 13.388 -4.158 1097 HG3 GLU 181 HG3 GLU 181 3.135 13.155 -3.072 1098 H ASP 182 H ASP 182 0.830 9.730 -3.331 1099 HA ASP 182 HA ASP 182 0.973 7.782 -5.515 1100 HB2 ASP 182 HB2 ASP 182 0.742 5.902 -4.178 1101 HB3 ASP 182 HB3 ASP 182 1.789 6.915 -3.179 1102 HA PRO 183 HA PRO 183 -3.213 9.390 -5.770 1103 HB2 PRO 183 HB2 PRO 183 -3.572 8.061 -8.279 1104 HB3 PRO 183 HB3 PRO 183 -3.198 9.759 -7.991 1105 HG2 PRO 183 HG2 PRO 183 -1.491 7.938 -9.178 1106 HG3 PRO 183 HG3 PRO 183 -0.989 9.459 -8.422 1107 HD2 PRO 183 HD2 PRO 183 -0.904 6.676 -7.332 1108 HD3 PRO 183 HD3 PRO 183 0.260 8.004 -7.138 1109 H ALA 184 H ALA 184 -2.370 6.052 -5.710 1110 HA ALA 184 HA ALA 184 -4.891 4.900 -6.171 1111 HB1 ALA 184 HB1 ALA 184 -2.758 3.645 -6.161 1112 HB2 ALA 184 HB2 ALA 184 -4.003 2.904 -5.155 1113 HB3 ALA 184 HB3 ALA 184 -2.701 3.827 -4.407 1114 H CYS 185 H CYS 185 -3.385 6.140 -3.255 1115 HA CYS 185 HA CYS 185 -5.708 5.412 -1.653 1116 HB2 CYS 185 HB2 CYS 185 -3.021 6.575 -0.943 1117 HB3 CYS 185 HB3 CYS 185 -4.275 6.242 0.243 1118 H ASP 186 H ASP 186 -6.147 7.365 -3.610 1119 HA ASP 186 HA ASP 186 -6.011 9.989 -2.642 1120 HB2 ASP 186 HB2 ASP 186 -6.717 8.748 -5.060 1121 HB3 ASP 186 HB3 ASP 186 -8.108 9.710 -4.555 1122 HA PRO 187 HA PRO 187 -10.926 8.351 -1.621 1123 HB2 PRO 187 HB2 PRO 187 -8.941 7.664 0.519 1124 HB3 PRO 187 HB3 PRO 187 -10.581 7.060 0.322 1125 HG2 PRO 187 HG2 PRO 187 -8.418 5.749 -0.663 1126 HG3 PRO 187 HG3 PRO 187 -10.011 5.678 -1.438 1127 HD2 PRO 187 HD2 PRO 187 -7.619 6.818 -2.485 1128 HD3 PRO 187 HD3 PRO 187 -9.226 6.845 -3.220 1129 H GLU 188 H GLU 188 -10.049 8.752 1.168 1130 HA GLU 188 HA GLU 188 -10.854 11.527 1.718 1131 HB2 GLU 188 HB2 GLU 188 -10.670 10.830 4.107 1132 HB3 GLU 188 HB3 GLU 188 -11.732 9.750 3.215 1133 HG2 GLU 188 HG2 GLU 188 -10.544 8.100 4.116 1134 HG3 GLU 188 HG3 GLU 188 -9.289 8.530 2.953 1135 H ALA 189 H ALA 189 -9.345 11.944 0.748 1136 HA ALA 189 HA ALA 189 -6.744 12.482 1.597 1137 HB1 ALA 189 HB1 ALA 189 -6.727 10.941 -0.805 1138 HB2 ALA 189 HB2 ALA 189 -5.393 11.528 0.174 1139 HB3 ALA 189 HB3 ALA 189 -6.054 12.544 -1.105 1140 H ALA 190 H ALA 190 -9.366 13.730 1.495 1141 HA ALA 190 HA ALA 190 -9.447 15.573 -0.616 1142 HB1 ALA 190 HB1 ALA 190 -11.187 14.577 1.226 1143 HB2 ALA 190 HB2 ALA 190 -11.515 15.918 0.128 1144 HB3 ALA 190 HB3 ALA 190 -10.972 16.237 1.776 1145 H PHE 191 H PHE 191 -9.634 17.843 -0.399 1146 HA PHE 191 HA PHE 191 -7.366 18.971 1.005 1147 HB2 PHE 191 HB2 PHE 191 -8.110 21.076 -0.223 1148 HB3 PHE 191 HB3 PHE 191 -7.576 19.732 -1.224 1149 HD1 PHE 191 HD1 PHE 191 -9.237 18.414 -2.494 1150 HD2 PHE 191 HD2 PHE 191 -10.323 21.912 -0.329 1151 HE1 PHE 191 HE1 PHE 191 -11.336 18.545 -3.766 1152 HE2 PHE 191 HE2 PHE 191 -12.424 22.050 -1.601 1153 HZ PHE 191 HZ PHE 191 -12.933 20.365 -3.322 1154 H SER 192 H SER 192 -7.794 19.215 3.130 1155 HA SER 192 HA SER 192 -9.771 21.197 3.878 1156 HB2 SER 192 HB2 SER 192 -10.968 18.992 3.963 1157 HB3 SER 192 HB3 SER 192 -9.808 18.466 5.183 1158 HG SER 192 HG SER 192 -11.401 19.275 6.384 Start of MODEL 17 1 H1 ALA 1 H1 ALA 1 25.753 33.977 -4.414 2 H2 ALA 1 H2 ALA 1 25.252 33.228 -5.876 3 H3 ALA 1 H3 ALA 1 25.796 32.269 -4.561 4 HA ALA 1 HA ALA 1 23.918 33.378 -3.287 5 HB1 ALA 1 HB1 ALA 1 22.823 34.899 -4.503 6 HB2 ALA 1 HB2 ALA 1 22.081 33.530 -5.332 7 HB3 ALA 1 HB3 ALA 1 23.507 34.308 -6.017 8 H VAL 2 H VAL 2 24.144 31.425 -6.225 9 HA VAL 2 HA VAL 2 23.307 29.424 -6.837 10 HB VAL 2 HB VAL 2 23.494 27.588 -5.260 11 HG11 VAL 2 HG11 VAL 2 25.742 27.626 -5.378 12 HG12 VAL 2 HG12 VAL 2 25.865 29.135 -4.474 13 HG13 VAL 2 HG13 VAL 2 25.501 29.169 -6.199 14 HG21 VAL 2 HG21 VAL 2 24.011 27.891 -2.946 15 HG22 VAL 2 HG22 VAL 2 22.553 28.818 -3.294 16 HG23 VAL 2 HG23 VAL 2 24.107 29.639 -3.139 17 H LEU 3 H LEU 3 21.583 31.197 -6.634 18 HA LEU 3 HA LEU 3 19.115 30.111 -5.377 19 HB2 LEU 3 HB2 LEU 3 20.144 32.793 -5.525 20 HB3 LEU 3 HB3 LEU 3 18.592 32.718 -6.335 21 HG LEU 3 HG LEU 3 18.454 33.359 -3.933 22 HD11 LEU 3 HD11 LEU 3 16.942 31.312 -5.300 23 HD12 LEU 3 HD12 LEU 3 16.384 32.630 -4.269 24 HD13 LEU 3 HD13 LEU 3 16.886 31.101 -3.549 25 HD21 LEU 3 HD21 LEU 3 19.890 32.242 -2.613 26 HD22 LEU 3 HD22 LEU 3 19.900 30.813 -3.647 27 HD23 LEU 3 HD23 LEU 3 18.579 31.069 -2.508 28 H ASP 4 H ASP 4 19.064 28.549 -7.229 29 HA ASP 4 HA ASP 4 18.796 29.576 -9.845 30 HB2 ASP 4 HB2 ASP 4 17.906 26.942 -8.650 31 HB3 ASP 4 HB3 ASP 4 17.852 27.305 -10.374 32 H LEU 5 H LEU 5 17.247 31.358 -8.911 33 HA LEU 5 HA LEU 5 14.626 30.626 -9.677 34 HB2 LEU 5 HB2 LEU 5 14.607 30.131 -7.328 35 HB3 LEU 5 HB3 LEU 5 15.238 31.717 -6.961 36 HG LEU 5 HG LEU 5 12.571 30.918 -7.038 37 HD11 LEU 5 HD11 LEU 5 14.004 33.465 -6.699 38 HD12 LEU 5 HD12 LEU 5 12.910 32.618 -5.611 39 HD13 LEU 5 HD13 LEU 5 12.266 33.539 -6.969 40 HD21 LEU 5 HD21 LEU 5 12.642 31.066 -9.498 41 HD22 LEU 5 HD22 LEU 5 13.063 32.773 -9.352 42 HD23 LEU 5 HD23 LEU 5 11.513 32.202 -8.769 43 H ASP 6 H ASP 6 15.145 33.258 -7.864 44 HA ASP 6 HA ASP 6 16.283 35.050 -9.640 45 HB2 ASP 6 HB2 ASP 6 14.067 34.438 -10.673 46 HB3 ASP 6 HB3 ASP 6 13.289 35.370 -9.404 47 H VAL 7 H VAL 7 13.565 36.418 -7.854 48 HA VAL 7 HA VAL 7 15.392 37.313 -5.795 49 HB VAL 7 HB VAL 7 13.870 38.982 -6.799 50 HG11 VAL 7 HG11 VAL 7 11.987 36.809 -6.647 51 HG12 VAL 7 HG12 VAL 7 11.883 38.318 -7.547 52 HG13 VAL 7 HG13 VAL 7 11.333 38.250 -5.874 53 HG21 VAL 7 HG21 VAL 7 12.645 38.438 -4.133 54 HG22 VAL 7 HG22 VAL 7 13.172 39.966 -4.837 55 HG23 VAL 7 HG23 VAL 7 14.365 38.813 -4.238 56 H ARG 8 H ARG 8 15.199 36.187 -3.694 57 HA ARG 8 HA ARG 8 13.794 33.811 -3.923 58 HB2 ARG 8 HB2 ARG 8 14.418 33.634 -1.451 59 HB3 ARG 8 HB3 ARG 8 15.734 33.711 -2.613 60 HG2 ARG 8 HG2 ARG 8 16.534 35.592 -1.715 61 HG3 ARG 8 HG3 ARG 8 14.939 36.343 -1.685 62 HD2 ARG 8 HD2 ARG 8 14.952 34.344 0.313 63 HD3 ARG 8 HD3 ARG 8 16.457 35.245 0.476 64 HE ARG 8 HE ARG 8 14.705 37.235 0.305 65 HH11 ARG 8 HH11 ARG 8 14.593 34.295 2.191 66 HH12 ARG 8 HH12 ARG 8 13.634 34.995 3.451 67 HH21 ARG 8 HH21 ARG 8 13.447 38.153 1.970 68 HH22 ARG 8 HH22 ARG 8 12.984 37.181 3.327 69 H THR 9 H THR 9 11.646 33.756 -3.872 70 HA THR 9 HA THR 9 10.550 35.182 -1.534 71 HB THR 9 HB THR 9 9.165 35.871 -3.363 72 HG1 THR 9 HG1 THR 9 7.289 34.268 -3.100 73 HG21 THR 9 HG21 THR 9 9.415 33.060 -4.377 74 HG22 THR 9 HG22 THR 9 9.861 34.567 -5.176 75 HG23 THR 9 HG23 THR 9 8.161 34.168 -4.932 76 H CYS 10 H CYS 10 11.167 33.746 -0.120 77 HA CYS 10 HA CYS 10 11.090 30.942 -0.741 78 HB2 CYS 10 HB2 CYS 10 12.248 32.530 1.332 79 HB3 CYS 10 HB3 CYS 10 11.439 31.127 2.027 80 H LEU 11 H LEU 11 8.862 30.763 -1.340 81 HA LEU 11 HA LEU 11 6.564 31.171 -0.117 82 HB2 LEU 11 HB2 LEU 11 7.359 29.433 -2.045 83 HB3 LEU 11 HB3 LEU 11 6.772 28.334 -0.809 84 HG LEU 11 HG LEU 11 5.022 28.895 -2.430 85 HD11 LEU 11 HD11 LEU 11 4.105 28.309 -0.385 86 HD12 LEU 11 HD12 LEU 11 3.375 29.885 -0.690 87 HD13 LEU 11 HD13 LEU 11 4.733 29.743 0.424 88 HD21 LEU 11 HD21 LEU 11 4.160 31.397 -1.929 89 HD22 LEU 11 HD22 LEU 11 5.232 30.979 -3.264 90 HD23 LEU 11 HD23 LEU 11 5.900 31.631 -1.773 91 HA PRO 12 HA PRO 12 6.969 29.268 3.919 92 HB2 PRO 12 HB2 PRO 12 5.410 30.920 5.216 93 HB3 PRO 12 HB3 PRO 12 6.912 31.526 4.511 94 HG2 PRO 12 HG2 PRO 12 4.107 31.742 3.473 95 HG3 PRO 12 HG3 PRO 12 5.367 32.985 3.544 96 HD2 PRO 12 HD2 PRO 12 4.774 31.433 1.314 97 HD3 PRO 12 HD3 PRO 12 6.299 32.298 1.581 98 H CYS 13 H CYS 13 5.740 27.986 5.301 99 HA CYS 13 HA CYS 13 2.889 27.777 4.989 100 HB2 CYS 13 HB2 CYS 13 2.759 25.484 4.342 101 HB3 CYS 13 HB3 CYS 13 3.853 26.252 3.202 102 H GLY 14 H GLY 14 2.631 25.272 6.310 103 HA2 GLY 14 HA2 GLY 14 2.831 24.185 8.307 104 HA3 GLY 14 HA3 GLY 14 4.316 25.066 8.576 105 HA PRO 15 HA PRO 15 1.354 26.312 11.976 106 HB2 PRO 15 HB2 PRO 15 3.248 26.394 13.858 107 HB3 PRO 15 HB3 PRO 15 2.613 24.822 13.307 108 HG2 PRO 15 HG2 PRO 15 4.826 26.390 12.092 109 HG3 PRO 15 HG3 PRO 15 5.045 24.827 12.959 110 HD2 PRO 15 HD2 PRO 15 4.754 24.640 10.402 111 HD3 PRO 15 HD3 PRO 15 3.507 23.772 11.343 112 H GLY 16 H GLY 16 1.023 28.200 11.321 113 HA2 GLY 16 HA2 GLY 16 0.949 30.487 11.524 114 HA3 GLY 16 HA3 GLY 16 2.635 30.439 12.017 115 H GLY 17 H GLY 17 2.918 28.577 9.451 116 HA2 GLY 17 HA2 GLY 17 3.124 28.830 7.261 117 HA3 GLY 17 HA3 GLY 17 2.428 30.379 7.432 118 H LYS 18 H LYS 18 5.270 28.963 8.965 119 HA LYS 18 HA LYS 18 6.911 31.177 7.975 120 HB2 LYS 18 HB2 LYS 18 8.062 29.139 9.782 121 HB3 LYS 18 HB3 LYS 18 8.141 30.893 9.876 122 HG2 LYS 18 HG2 LYS 18 6.453 30.987 11.347 123 HG3 LYS 18 HG3 LYS 18 5.446 29.946 10.378 124 HD2 LYS 18 HD2 LYS 18 7.423 29.178 12.491 125 HD3 LYS 18 HD3 LYS 18 5.690 28.863 12.407 126 HE2 LYS 18 HE2 LYS 18 7.843 27.608 10.710 127 HE3 LYS 18 HE3 LYS 18 6.862 26.822 11.943 128 HZ1 LYS 18 HZ1 LYS 18 5.885 27.933 9.385 129 HZ2 LYS 18 HZ2 LYS 18 4.897 27.283 10.574 130 HZ3 LYS 18 HZ3 LYS 18 6.007 26.307 9.767 131 H GLY 19 H GLY 19 7.087 27.838 8.442 132 HA2 GLY 19 HA2 GLY 19 9.057 27.129 6.953 133 HA3 GLY 19 HA3 GLY 19 7.778 25.959 7.145 134 H ARG 20 H ARG 20 9.504 25.910 5.179 135 HA ARG 20 HA ARG 20 8.297 27.187 2.869 136 HB2 ARG 20 HB2 ARG 20 10.950 26.375 3.627 137 HB3 ARG 20 HB3 ARG 20 10.596 26.004 1.941 138 HG2 ARG 20 HG2 ARG 20 11.274 28.134 1.622 139 HG3 ARG 20 HG3 ARG 20 9.616 28.505 2.103 140 HD2 ARG 20 HD2 ARG 20 11.142 29.915 3.323 141 HD3 ARG 20 HD3 ARG 20 10.369 28.783 4.422 142 HE ARG 20 HE ARG 20 13.095 28.370 3.382 143 HH11 ARG 20 HH11 ARG 20 10.815 28.454 6.034 144 HH12 ARG 20 HH12 ARG 20 11.958 27.871 7.193 145 HH21 ARG 20 HH21 ARG 20 14.591 27.606 4.913 146 HH22 ARG 20 HH22 ARG 20 14.099 27.391 6.559 147 H CYS 21 H CYS 21 8.280 26.199 0.766 148 HA CYS 21 HA CYS 21 7.063 23.517 0.915 149 HB2 CYS 21 HB2 CYS 21 6.606 25.949 -0.745 150 HB3 CYS 21 HB3 CYS 21 6.382 24.408 -1.549 151 H PHE 22 H PHE 22 7.858 21.862 -0.190 152 HA PHE 22 HA PHE 22 9.922 22.305 -2.243 153 HB2 PHE 22 HB2 PHE 22 10.065 20.388 0.101 154 HB3 PHE 22 HB3 PHE 22 11.136 20.307 -1.294 155 HD1 PHE 22 HD1 PHE 22 10.025 22.575 1.430 156 HD2 PHE 22 HD2 PHE 22 13.088 21.562 -1.345 157 HE1 PHE 22 HE1 PHE 22 11.520 24.222 2.486 158 HE2 PHE 22 HE2 PHE 22 14.588 23.207 -0.296 159 HZ PHE 22 HZ PHE 22 13.804 24.541 1.619 160 H GLY 23 H GLY 23 7.137 21.775 -2.544 161 HA2 GLY 23 HA2 GLY 23 6.810 20.143 -4.568 162 HA3 GLY 23 HA3 GLY 23 6.985 18.947 -3.292 163 HA PRO 24 HA PRO 24 2.480 20.596 -3.976 164 HB2 PRO 24 HB2 PRO 24 2.106 17.683 -4.486 165 HB3 PRO 24 HB3 PRO 24 1.352 19.073 -5.272 166 HG2 PRO 24 HG2 PRO 24 3.286 17.695 -6.489 167 HG3 PRO 24 HG3 PRO 24 3.171 19.457 -6.647 168 HD2 PRO 24 HD2 PRO 24 5.060 17.819 -5.023 169 HD3 PRO 24 HD3 PRO 24 5.333 19.355 -5.866 170 H SER 25 H SER 25 2.791 17.207 -2.867 171 HA SER 25 HA SER 25 1.420 17.944 -0.392 172 HB2 SER 25 HB2 SER 25 1.834 15.435 -1.919 173 HB3 SER 25 HB3 SER 25 1.861 15.245 -0.160 174 HG SER 25 HG SER 25 -0.194 16.668 -1.495 175 H ILE 26 H ILE 26 3.982 19.014 -0.613 176 HA ILE 26 HA ILE 26 5.338 17.589 1.520 177 HB ILE 26 HB ILE 26 6.866 18.528 -0.842 178 HG12 ILE 26 HG12 ILE 26 5.670 15.810 -0.458 179 HG13 ILE 26 HG13 ILE 26 5.229 16.968 -1.700 180 HG21 ILE 26 HG21 ILE 26 7.528 17.466 1.633 181 HG22 ILE 26 HG22 ILE 26 8.601 17.919 0.313 182 HG23 ILE 26 HG23 ILE 26 7.959 16.279 0.411 183 HD11 ILE 26 HD11 ILE 26 6.659 15.767 -2.957 184 HD12 ILE 26 HD12 ILE 26 7.544 15.157 -1.563 185 HD13 ILE 26 HD13 ILE 26 7.870 16.778 -2.175 186 H CYS 27 H CYS 27 5.840 18.948 3.120 187 HA CYS 27 HA CYS 27 6.823 21.622 2.453 188 HB2 CYS 27 HB2 CYS 27 4.257 21.161 3.610 189 HB3 CYS 27 HB3 CYS 27 5.282 21.900 4.832 190 H CYS 28 H CYS 28 8.739 21.702 3.223 191 HA CYS 28 HA CYS 28 9.355 20.690 5.883 192 HB2 CYS 28 HB2 CYS 28 11.664 20.675 4.145 193 HB3 CYS 28 HB3 CYS 28 11.008 19.343 5.070 194 H GLY 29 H GLY 29 9.969 22.356 7.174 195 HA2 GLY 29 HA2 GLY 29 11.635 24.516 6.081 196 HA3 GLY 29 HA3 GLY 29 10.681 24.586 7.562 197 H ASP 30 H ASP 30 12.845 25.219 8.426 198 HA ASP 30 HA ASP 30 14.905 23.346 8.560 199 HB2 ASP 30 HB2 ASP 30 15.120 25.835 8.928 200 HB3 ASP 30 HB3 ASP 30 14.489 25.541 10.547 201 H GLU 31 H GLU 31 12.764 24.340 11.133 202 HA GLU 31 HA GLU 31 13.518 21.933 12.592 203 HB2 GLU 31 HB2 GLU 31 12.115 23.690 14.298 204 HB3 GLU 31 HB3 GLU 31 13.784 23.165 14.415 205 HG2 GLU 31 HG2 GLU 31 14.173 25.076 12.674 206 HG3 GLU 31 HG3 GLU 31 12.629 25.658 13.277 207 H LEU 32 H LEU 32 11.418 22.534 10.573 208 HA LEU 32 HA LEU 32 9.148 21.583 12.064 209 HB2 LEU 32 HB2 LEU 32 9.625 23.649 10.164 210 HB3 LEU 32 HB3 LEU 32 8.529 22.480 9.496 211 HG LEU 32 HG LEU 32 8.150 23.839 12.152 212 HD11 LEU 32 HD11 LEU 32 8.023 25.511 10.400 213 HD12 LEU 32 HD12 LEU 32 6.417 25.152 11.020 214 HD13 LEU 32 HD13 LEU 32 6.926 24.480 9.475 215 HD21 LEU 32 HD21 LEU 32 5.722 23.043 11.541 216 HD22 LEU 32 HD22 LEU 32 6.870 21.972 12.344 217 HD23 LEU 32 HD23 LEU 32 6.603 21.834 10.608 218 H GLY 33 H GLY 33 11.492 21.133 9.624 219 HA2 GLY 33 HA2 GLY 33 12.134 19.237 8.595 220 HA3 GLY 33 HA3 GLY 33 10.855 18.461 9.445 221 H CYS 34 H CYS 34 9.642 17.357 7.882 222 HA CYS 34 HA CYS 34 8.578 19.090 5.804 223 HB2 CYS 34 HB2 CYS 34 10.539 17.560 5.036 224 HB3 CYS 34 HB3 CYS 34 9.311 16.320 5.056 225 H PHE 35 H PHE 35 6.300 19.004 5.913 226 HA PHE 35 HA PHE 35 5.301 16.518 6.963 227 HB2 PHE 35 HB2 PHE 35 3.333 18.495 6.056 228 HB3 PHE 35 HB3 PHE 35 3.456 17.694 7.612 229 HD1 PHE 35 HD1 PHE 35 5.085 20.410 5.694 230 HD2 PHE 35 HD2 PHE 35 3.803 18.988 9.476 231 HE1 PHE 35 HE1 PHE 35 5.769 22.542 6.710 232 HE2 PHE 35 HE2 PHE 35 4.479 21.116 10.513 233 HZ PHE 35 HZ PHE 35 5.468 22.896 9.126 234 H VAL 36 H VAL 36 5.310 15.079 5.273 235 HA VAL 36 HA VAL 36 4.970 16.200 2.634 236 HB VAL 36 HB VAL 36 5.522 13.290 3.060 237 HG11 VAL 36 HG11 VAL 36 5.081 14.085 0.794 238 HG12 VAL 36 HG12 VAL 36 6.779 13.639 0.953 239 HG13 VAL 36 HG13 VAL 36 6.314 15.355 0.968 240 HG21 VAL 36 HG21 VAL 36 7.095 14.533 4.524 241 HG22 VAL 36 HG22 VAL 36 7.598 15.503 3.144 242 HG23 VAL 36 HG23 VAL 36 7.928 13.770 3.170 243 H GLY 37 H GLY 37 2.979 16.765 2.580 244 HA2 GLY 37 HA2 GLY 37 0.912 16.144 1.514 245 HA3 GLY 37 HA3 GLY 37 1.046 14.564 2.233 246 H THR 38 H THR 38 1.550 17.206 4.405 247 HA THR 38 HA THR 38 -1.052 16.580 5.584 248 HB THR 38 HB THR 38 -0.255 17.605 7.598 249 HG1 THR 38 HG1 THR 38 1.328 18.993 5.922 250 HG21 THR 38 HG21 THR 38 1.282 15.549 6.332 251 HG22 THR 38 HG22 THR 38 0.876 15.763 8.033 252 HG23 THR 38 HG23 THR 38 2.309 16.535 7.365 253 H ALA 39 H ALA 39 -2.447 18.581 6.415 254 HA ALA 39 HA ALA 39 -3.094 20.157 4.386 255 HB1 ALA 39 HB1 ALA 39 -3.780 19.913 7.064 256 HB2 ALA 39 HB2 ALA 39 -4.591 20.899 5.847 257 HB3 ALA 39 HB3 ALA 39 -3.343 21.612 6.871 258 H GLU 40 H GLU 40 -0.338 20.695 6.526 259 HA GLU 40 HA GLU 40 -0.014 23.436 5.981 260 HB2 GLU 40 HB2 GLU 40 1.959 21.306 6.817 261 HB3 GLU 40 HB3 GLU 40 2.349 23.020 6.721 262 HG2 GLU 40 HG2 GLU 40 1.841 22.820 8.940 263 HG3 GLU 40 HG3 GLU 40 0.269 23.274 8.286 264 H ALA 41 H ALA 41 0.562 20.572 4.058 265 HA ALA 41 HA ALA 41 2.328 21.959 2.308 266 HB1 ALA 41 HB1 ALA 41 1.547 19.140 2.809 267 HB2 ALA 41 HB2 ALA 41 3.138 19.838 2.511 268 HB3 ALA 41 HB3 ALA 41 2.028 19.568 1.168 269 H LEU 42 H LEU 42 -1.214 21.091 2.507 270 HA LEU 42 HA LEU 42 -1.691 21.015 -0.180 271 HB2 LEU 42 HB2 LEU 42 -3.214 21.729 2.292 272 HB3 LEU 42 HB3 LEU 42 -3.946 22.054 0.733 273 HG LEU 42 HG LEU 42 -2.868 19.325 1.114 274 HD11 LEU 42 HD11 LEU 42 -3.888 18.993 3.073 275 HD12 LEU 42 HD12 LEU 42 -5.388 19.038 2.148 276 HD13 LEU 42 HD13 LEU 42 -4.806 20.495 2.954 277 HD21 LEU 42 HD21 LEU 42 -5.075 20.693 -0.314 278 HD22 LEU 42 HD22 LEU 42 -5.301 19.000 0.122 279 HD23 LEU 42 HD23 LEU 42 -3.935 19.475 -0.887 280 H ARG 43 H ARG 43 -0.885 23.660 1.931 281 HA ARG 43 HA ARG 43 -1.751 25.713 0.083 282 HB2 ARG 43 HB2 ARG 43 -0.247 27.169 1.640 283 HB3 ARG 43 HB3 ARG 43 -1.781 26.557 2.237 284 HG2 ARG 43 HG2 ARG 43 0.514 24.802 2.722 285 HG3 ARG 43 HG3 ARG 43 0.578 26.360 3.547 286 HD2 ARG 43 HD2 ARG 43 -2.036 25.051 3.675 287 HD3 ARG 43 HD3 ARG 43 -0.742 24.143 4.445 288 HE ARG 43 HE ARG 43 -0.554 26.787 5.304 289 HH11 ARG 43 HH11 ARG 43 -2.728 24.072 5.594 290 HH12 ARG 43 HH12 ARG 43 -3.346 24.570 7.134 291 HH21 ARG 43 HH21 ARG 43 -1.366 27.443 7.331 292 HH22 ARG 43 HH22 ARG 43 -2.573 26.484 8.119 293 H CYS 44 H CYS 44 0.164 23.573 -0.238 294 HA CYS 44 HA CYS 44 2.545 24.974 -1.365 295 HB2 CYS 44 HB2 CYS 44 2.069 22.035 -1.089 296 HB3 CYS 44 HB3 CYS 44 3.154 22.602 -2.337 297 H GLN 45 H GLN 45 -0.641 24.606 -2.304 298 HA GLN 45 HA GLN 45 -0.160 23.930 -5.029 299 HB2 GLN 45 HB2 GLN 45 -2.190 23.280 -3.647 300 HB3 GLN 45 HB3 GLN 45 -2.643 24.978 -3.661 301 HG2 GLN 45 HG2 GLN 45 -3.891 24.160 -5.392 302 HG3 GLN 45 HG3 GLN 45 -2.453 24.725 -6.241 303 HE21 GLN 45 HE21 GLN 45 -1.464 23.352 -7.535 304 HE22 GLN 45 HE22 GLN 45 -1.693 21.640 -7.558 305 H GLU 46 H GLU 46 0.169 26.695 -3.103 306 HA GLU 46 HA GLU 46 -0.764 28.487 -5.188 307 HB2 GLU 46 HB2 GLU 46 0.521 28.979 -2.501 308 HB3 GLU 46 HB3 GLU 46 0.181 30.273 -3.644 309 HG2 GLU 46 HG2 GLU 46 -2.050 30.204 -3.281 310 HG3 GLU 46 HG3 GLU 46 -2.060 28.465 -2.989 311 H GLU 47 H GLU 47 1.749 26.495 -4.982 312 HA GLU 47 HA GLU 47 3.863 28.310 -5.729 313 HB2 GLU 47 HB2 GLU 47 4.140 26.043 -4.553 314 HB3 GLU 47 HB3 GLU 47 3.843 25.322 -6.129 315 HG2 GLU 47 HG2 GLU 47 6.180 25.415 -5.862 316 HG3 GLU 47 HG3 GLU 47 5.757 26.693 -7.000 317 H ASN 48 H ASN 48 1.112 27.458 -7.251 318 HA ASN 48 HA ASN 48 2.376 27.142 -9.870 319 HB2 ASN 48 HB2 ASN 48 0.078 26.649 -10.689 320 HB3 ASN 48 HB3 ASN 48 0.616 25.535 -9.436 321 HD21 ASN 48 HD21 ASN 48 -1.878 25.354 -9.645 322 HD22 ASN 48 HD22 ASN 48 -2.770 26.280 -8.490 323 H TYR 49 H TYR 49 0.547 29.390 -7.917 324 HA TYR 49 HA TYR 49 0.039 31.159 -10.187 325 HB2 TYR 49 HB2 TYR 49 -0.376 31.973 -7.328 326 HB3 TYR 49 HB3 TYR 49 -1.269 32.459 -8.763 327 HD1 TYR 49 HD1 TYR 49 -2.694 30.614 -9.912 328 HD2 TYR 49 HD2 TYR 49 -1.231 30.341 -5.927 329 HE1 TYR 49 HE1 TYR 49 -4.415 28.934 -9.401 330 HE2 TYR 49 HE2 TYR 49 -2.947 28.662 -5.404 331 HH TYR 49 HH TYR 49 -4.515 27.287 -6.277 332 H LEU 50 H LEU 50 2.789 30.462 -8.727 333 HA LEU 50 HA LEU 50 3.820 33.178 -9.034 334 HB2 LEU 50 HB2 LEU 50 4.982 31.697 -6.766 335 HB3 LEU 50 HB3 LEU 50 4.673 33.411 -6.951 336 HG LEU 50 HG LEU 50 2.294 31.678 -6.595 337 HD11 LEU 50 HD11 LEU 50 4.402 32.088 -4.512 338 HD12 LEU 50 HD12 LEU 50 3.550 30.609 -4.952 339 HD13 LEU 50 HD13 LEU 50 2.707 31.884 -4.072 340 HD21 LEU 50 HD21 LEU 50 1.395 33.562 -5.589 341 HD22 LEU 50 HD22 LEU 50 2.461 34.257 -6.812 342 HD23 LEU 50 HD23 LEU 50 2.976 34.192 -5.126 343 HA PRO 51 HA PRO 51 6.816 30.556 -11.117 344 HB2 PRO 51 HB2 PRO 51 8.045 32.486 -12.515 345 HB3 PRO 51 HB3 PRO 51 6.420 31.933 -12.941 346 HG2 PRO 51 HG2 PRO 51 7.256 34.377 -11.431 347 HG3 PRO 51 HG3 PRO 51 6.006 34.202 -12.676 348 HD2 PRO 51 HD2 PRO 51 5.505 34.250 -9.971 349 HD3 PRO 51 HD3 PRO 51 4.445 33.483 -11.169 350 H SER 52 H SER 52 7.339 31.189 -8.396 351 HA SER 52 HA SER 52 10.212 31.327 -8.485 352 HB2 SER 52 HB2 SER 52 10.159 33.143 -6.619 353 HB3 SER 52 HB3 SER 52 10.001 33.642 -8.302 354 HG SER 52 HG SER 52 7.664 33.035 -6.896 355 HA PRO 53 HA PRO 53 9.001 28.666 -5.043 356 HB2 PRO 53 HB2 PRO 53 10.654 26.641 -5.616 357 HB3 PRO 53 HB3 PRO 53 9.192 26.945 -6.560 358 HG2 PRO 53 HG2 PRO 53 12.022 27.399 -7.278 359 HG3 PRO 53 HG3 PRO 53 10.623 27.123 -8.326 360 HD2 PRO 53 HD2 PRO 53 11.854 29.616 -7.638 361 HD3 PRO 53 HD3 PRO 53 10.455 29.345 -8.687 362 H CYS 54 H CYS 54 11.932 30.319 -5.566 363 HA CYS 54 HA CYS 54 13.618 30.948 -4.156 364 HB2 CYS 54 HB2 CYS 54 11.714 31.002 -2.468 365 HB3 CYS 54 HB3 CYS 54 12.242 29.411 -1.944 366 H GLN 55 H GLN 55 14.967 29.560 -5.463 367 HA GLN 55 HA GLN 55 16.172 27.594 -5.893 368 HB2 GLN 55 HB2 GLN 55 17.404 29.337 -4.332 369 HB3 GLN 55 HB3 GLN 55 17.350 28.005 -3.185 370 HG2 GLN 55 HG2 GLN 55 18.234 27.049 -5.738 371 HG3 GLN 55 HG3 GLN 55 19.198 28.431 -5.251 372 HE21 GLN 55 HE21 GLN 55 19.434 28.175 -2.584 373 HE22 GLN 55 HE22 GLN 55 20.227 26.697 -2.171 374 H SER 56 H SER 56 17.420 26.107 -3.551 375 HA SER 56 HA SER 56 15.393 24.597 -2.252 376 HB2 SER 56 HB2 SER 56 15.488 23.803 -4.765 377 HB3 SER 56 HB3 SER 56 16.991 23.024 -4.271 378 HG SER 56 HG SER 56 14.519 22.651 -2.934 379 H GLY 57 H GLY 57 16.520 22.648 -1.146 380 HA2 GLY 57 HA2 GLY 57 18.876 23.594 0.089 381 HA3 GLY 57 HA3 GLY 57 18.111 22.032 0.390 382 H GLN 58 H GLN 58 20.981 22.748 -0.018 383 HA GLN 58 HA GLN 58 21.424 21.030 -2.368 384 HB2 GLN 58 HB2 GLN 58 23.761 22.019 -2.321 385 HB3 GLN 58 HB3 GLN 58 22.471 23.114 -2.806 386 HG2 GLN 58 HG2 GLN 58 23.096 23.076 0.068 387 HG3 GLN 58 HG3 GLN 58 24.359 23.716 -0.984 388 HE21 GLN 58 HE21 GLN 58 21.629 24.456 0.740 389 HE22 GLN 58 HE22 GLN 58 21.226 25.959 -0.010 390 H LYS 59 H LYS 59 20.857 19.414 -0.834 391 HA LYS 59 HA LYS 59 23.325 18.363 0.437 392 HB2 LYS 59 HB2 LYS 59 20.647 18.722 1.801 393 HB3 LYS 59 HB3 LYS 59 21.790 17.508 2.347 394 HG2 LYS 59 HG2 LYS 59 22.445 20.435 2.159 395 HG3 LYS 59 HG3 LYS 59 21.793 19.675 3.611 396 HD2 LYS 59 HD2 LYS 59 23.924 18.048 2.825 397 HD3 LYS 59 HD3 LYS 59 24.498 19.701 2.602 398 HE2 LYS 59 HE2 LYS 59 25.053 19.360 4.798 399 HE3 LYS 59 HE3 LYS 59 23.441 20.052 4.977 400 HZ1 LYS 59 HZ1 LYS 59 24.340 17.614 5.926 401 HZ2 LYS 59 HZ2 LYS 59 23.265 17.247 4.673 402 HZ3 LYS 59 HZ3 LYS 59 22.757 18.209 5.968 403 HA PRO 60 HA PRO 60 20.617 15.807 -2.376 404 HB2 PRO 60 HB2 PRO 60 22.713 14.997 -3.979 405 HB3 PRO 60 HB3 PRO 60 21.611 16.327 -4.339 406 HG2 PRO 60 HG2 PRO 60 24.341 16.403 -3.126 407 HG3 PRO 60 HG3 PRO 60 23.606 17.511 -4.301 408 HD2 PRO 60 HD2 PRO 60 23.807 18.162 -1.708 409 HD3 PRO 60 HD3 PRO 60 22.392 18.631 -2.669 410 H CYS 61 H CYS 61 20.484 14.575 -0.480 411 HA CYS 61 HA CYS 61 22.314 12.282 -0.320 412 HB2 CYS 61 HB2 CYS 61 20.615 11.833 1.723 413 HB3 CYS 61 HB3 CYS 61 22.063 12.814 1.904 414 H GLY 62 H GLY 62 20.716 10.201 0.351 415 HA2 GLY 62 HA2 GLY 62 19.009 8.833 -0.417 416 HA3 GLY 62 HA3 GLY 62 18.191 10.282 -0.975 417 H SER 63 H SER 63 17.605 8.768 -2.730 418 HA SER 63 HA SER 63 19.715 8.057 -4.588 419 HB2 SER 63 HB2 SER 63 16.792 7.483 -4.375 420 HB3 SER 63 HB3 SER 63 17.549 7.342 -5.961 421 HG SER 63 HG SER 63 17.776 5.730 -3.756 422 H GLY 64 H GLY 64 19.519 10.773 -4.198 423 HA2 GLY 64 HA2 GLY 64 20.027 12.290 -6.083 424 HA3 GLY 64 HA3 GLY 64 18.516 11.749 -6.785 425 H GLY 65 H GLY 65 18.170 12.208 -3.369 426 HA2 GLY 65 HA2 GLY 65 16.793 14.741 -3.990 427 HA3 GLY 65 HA3 GLY 65 16.449 13.705 -2.627 428 H ARG 66 H ARG 66 16.912 16.582 -2.700 429 HA ARG 66 HA ARG 66 19.378 16.806 -1.158 430 HB2 ARG 66 HB2 ARG 66 18.675 19.363 -1.289 431 HB3 ARG 66 HB3 ARG 66 19.571 18.576 -2.580 432 HG2 ARG 66 HG2 ARG 66 16.584 18.625 -2.659 433 HG3 ARG 66 HG3 ARG 66 17.502 20.060 -3.117 434 HD2 ARG 66 HD2 ARG 66 17.588 17.325 -4.366 435 HD3 ARG 66 HD3 ARG 66 17.079 18.839 -5.108 436 HE ARG 66 HE ARG 66 19.787 17.893 -4.744 437 HH11 ARG 66 HH11 ARG 66 17.750 20.657 -5.382 438 HH12 ARG 66 HH12 ARG 66 18.999 21.546 -6.185 439 HH21 ARG 66 HH21 ARG 66 21.424 19.060 -5.805 440 HH22 ARG 66 HH22 ARG 66 21.083 20.641 -6.426 441 H CYS 67 H CYS 67 19.396 17.927 0.918 442 HA CYS 67 HA CYS 67 17.330 17.075 2.586 443 HB2 CYS 67 HB2 CYS 67 19.708 17.298 3.284 444 HB3 CYS 67 HB3 CYS 67 19.536 19.046 3.197 445 H ALA 68 H ALA 68 15.481 17.991 3.017 446 HA ALA 68 HA ALA 68 15.128 20.847 2.366 447 HB1 ALA 68 HB1 ALA 68 13.538 18.736 1.731 448 HB2 ALA 68 HB2 ALA 68 12.979 20.405 1.853 449 HB3 ALA 68 HB3 ALA 68 12.781 19.305 3.217 450 H ALA 69 H ALA 69 15.637 18.689 4.854 451 HA ALA 69 HA ALA 69 15.606 20.656 6.889 452 HB1 ALA 69 HB1 ALA 69 13.529 18.643 7.512 453 HB2 ALA 69 HB2 ALA 69 13.093 19.988 6.463 454 HB3 ALA 69 HB3 ALA 69 13.716 20.297 8.083 455 H ALA 70 H ALA 70 16.238 19.704 9.021 456 HA ALA 70 HA ALA 70 18.119 17.628 8.747 457 HB1 ALA 70 HB1 ALA 70 18.483 17.801 11.081 458 HB2 ALA 70 HB2 ALA 70 16.875 18.478 11.351 459 HB3 ALA 70 HB3 ALA 70 18.100 19.427 10.511 460 H GLY 71 H GLY 71 18.041 15.479 9.129 461 HA2 GLY 71 HA2 GLY 71 17.232 13.340 9.460 462 HA3 GLY 71 HA3 GLY 71 16.055 14.057 10.541 463 H ILE 72 H ILE 72 16.223 15.120 7.301 464 HA ILE 72 HA ILE 72 14.336 13.284 6.289 465 HB ILE 72 HB ILE 72 12.489 14.701 5.722 466 HG12 ILE 72 HG12 ILE 72 12.751 16.885 7.458 467 HG13 ILE 72 HG13 ILE 72 14.278 16.777 6.576 468 HG21 ILE 72 HG21 ILE 72 11.619 13.862 7.572 469 HG22 ILE 72 HG22 ILE 72 12.149 15.314 8.418 470 HG23 ILE 72 HG23 ILE 72 13.175 13.895 8.383 471 HD11 ILE 72 HD11 ILE 72 11.933 16.374 4.950 472 HD12 ILE 72 HD12 ILE 72 13.352 17.388 4.659 473 HD13 ILE 72 HD13 ILE 72 12.036 17.979 5.677 474 H CYS 73 H CYS 73 15.427 12.899 4.468 475 HA CYS 73 HA CYS 73 16.394 15.169 2.896 476 HB2 CYS 73 HB2 CYS 73 17.913 13.240 3.447 477 HB3 CYS 73 HB3 CYS 73 16.919 12.239 2.399 478 H CYS 74 H CYS 74 14.977 15.953 1.501 479 HA CYS 74 HA CYS 74 12.988 14.188 0.346 480 HB2 CYS 74 HB2 CYS 74 13.271 17.186 0.217 481 HB3 CYS 74 HB3 CYS 74 11.952 16.270 -0.504 482 H SER 75 H SER 75 12.774 13.679 -1.711 483 HA SER 75 HA SER 75 14.919 14.471 -3.569 484 HB2 SER 75 HB2 SER 75 14.454 12.259 -4.669 485 HB3 SER 75 HB3 SER 75 15.029 12.103 -3.019 486 HG SER 75 HG SER 75 13.313 10.852 -2.927 487 HA PRO 76 HA PRO 76 11.811 15.936 -6.342 488 HB2 PRO 76 HB2 PRO 76 12.243 14.853 -8.771 489 HB3 PRO 76 HB3 PRO 76 13.381 15.991 -8.038 490 HG2 PRO 76 HG2 PRO 76 13.513 13.007 -8.186 491 HG3 PRO 76 HG3 PRO 76 14.805 14.199 -8.417 492 HD2 PRO 76 HD2 PRO 76 14.423 12.800 -6.101 493 HD3 PRO 76 HD3 PRO 76 15.187 14.398 -6.164 494 H ASP 77 H ASP 77 11.147 13.454 -4.866 495 HA ASP 77 HA ASP 77 8.738 12.769 -6.340 496 HB2 ASP 77 HB2 ASP 77 10.832 10.791 -5.452 497 HB3 ASP 77 HB3 ASP 77 9.144 10.316 -5.627 498 H GLY 78 H GLY 78 10.637 12.495 -3.352 499 HA2 GLY 78 HA2 GLY 78 8.364 13.253 -1.780 500 HA3 GLY 78 HA3 GLY 78 8.807 11.584 -1.534 501 H CYS 79 H CYS 79 9.666 11.517 0.413 502 HA CYS 79 HA CYS 79 12.143 12.956 0.868 503 HB2 CYS 79 HB2 CYS 79 9.852 13.120 2.832 504 HB3 CYS 79 HB3 CYS 79 11.467 13.779 3.072 505 H HIS 80 H HIS 80 13.413 12.057 2.674 506 HA HIS 80 HA HIS 80 12.439 9.611 3.867 507 HB2 HIS 80 HB2 HIS 80 14.611 8.429 2.880 508 HB3 HIS 80 HB3 HIS 80 13.083 8.413 2.006 509 HD1 HIS 80 HD1 HIS 80 16.369 10.284 2.061 510 HD2 HIS 80 HD2 HIS 80 13.163 9.555 -0.478 511 HE1 HIS 80 HE1 HIS 80 17.009 11.315 -0.137 512 HE2 HIS 80 HE2 HIS 80 15.146 10.671 -1.709 513 H GLU 81 H GLU 81 13.838 8.798 5.508 514 HA GLU 81 HA GLU 81 15.215 10.825 6.891 515 HB2 GLU 81 HB2 GLU 81 15.164 7.832 7.224 516 HB3 GLU 81 HB3 GLU 81 16.073 8.888 8.300 517 HG2 GLU 81 HG2 GLU 81 14.206 8.910 9.514 518 HG3 GLU 81 HG3 GLU 81 13.636 10.077 8.321 519 H ASP 82 H ASP 82 17.341 11.310 7.094 520 HA ASP 82 HA ASP 82 19.266 9.723 5.555 521 HB2 ASP 82 HB2 ASP 82 20.038 11.526 4.263 522 HB3 ASP 82 HB3 ASP 82 18.274 11.663 4.208 523 HA PRO 83 HA PRO 83 21.740 10.355 9.165 524 HB2 PRO 83 HB2 PRO 83 24.106 9.730 7.575 525 HB3 PRO 83 HB3 PRO 83 23.336 8.795 8.856 526 HG2 PRO 83 HG2 PRO 83 23.276 8.030 6.267 527 HG3 PRO 83 HG3 PRO 83 21.954 7.680 7.396 528 HD2 PRO 83 HD2 PRO 83 22.153 9.829 5.317 529 HD3 PRO 83 HD3 PRO 83 20.775 8.789 5.738 530 H ALA 84 H ALA 84 22.669 12.036 6.215 531 HA ALA 84 HA ALA 84 24.700 13.626 7.390 532 HB1 ALA 84 HB1 ALA 84 23.015 14.397 5.010 533 HB2 ALA 84 HB2 ALA 84 24.370 13.274 4.904 534 HB3 ALA 84 HB3 ALA 84 24.645 14.943 5.402 535 H CYS 85 H CYS 85 21.308 14.042 6.680 536 HA CYS 85 HA CYS 85 21.198 16.384 8.439 537 HB2 CYS 85 HB2 CYS 85 19.474 15.376 6.216 538 HB3 CYS 85 HB3 CYS 85 18.703 16.267 7.512 539 H ASP 86 H ASP 86 21.592 14.938 10.330 540 HA ASP 86 HA ASP 86 19.122 14.139 11.413 541 HB2 ASP 86 HB2 ASP 86 19.904 12.120 9.926 542 HB3 ASP 86 HB3 ASP 86 21.259 11.939 11.049 543 HA PRO 87 HA PRO 87 22.758 14.126 14.532 544 HB2 PRO 87 HB2 PRO 87 24.424 16.317 14.251 545 HB3 PRO 87 HB3 PRO 87 24.759 14.813 13.384 546 HG2 PRO 87 HG2 PRO 87 23.449 17.348 12.377 547 HG3 PRO 87 HG3 PRO 87 24.623 16.302 11.568 548 HD2 PRO 87 HD2 PRO 87 21.921 16.200 11.037 549 HD3 PRO 87 HD3 PRO 87 22.986 14.801 10.843 550 H GLU 88 H GLU 88 22.158 14.754 16.354 551 HA GLU 88 HA GLU 88 20.192 15.672 17.374 552 HB2 GLU 88 HB2 GLU 88 21.783 17.320 18.926 553 HB3 GLU 88 HB3 GLU 88 21.404 15.626 19.185 554 HG2 GLU 88 HG2 GLU 88 23.412 15.175 17.631 555 HG3 GLU 88 HG3 GLU 88 23.839 16.849 17.973 556 H ALA 89 H ALA 89 20.449 17.112 15.077 557 HA ALA 89 HA ALA 89 20.311 19.806 15.176 558 HB1 ALA 89 HB1 ALA 89 19.762 18.001 13.200 559 HB2 ALA 89 HB2 ALA 89 19.568 19.757 13.033 560 HB3 ALA 89 HB3 ALA 89 18.179 18.758 13.460 561 H ALA 90 H ALA 90 17.915 17.596 15.874 562 HA ALA 90 HA ALA 90 15.832 19.386 16.784 563 HB1 ALA 90 HB1 ALA 90 16.047 16.541 16.059 564 HB2 ALA 90 HB2 ALA 90 14.761 17.706 15.739 565 HB3 ALA 90 HB3 ALA 90 14.885 16.939 17.323 566 H PHE 91 H PHE 91 15.929 20.196 18.565 567 HA PHE 91 HA PHE 91 17.205 19.204 20.978 568 HB2 PHE 91 HB2 PHE 91 17.172 21.617 19.941 569 HB3 PHE 91 HB3 PHE 91 15.578 21.726 20.665 570 HD1 PHE 91 HD1 PHE 91 19.020 20.686 21.693 571 HD2 PHE 91 HD2 PHE 91 15.458 22.804 22.667 572 HE1 PHE 91 HE1 PHE 91 20.047 21.446 23.797 573 HE2 PHE 91 HE2 PHE 91 16.483 23.572 24.768 574 HZ PHE 91 HZ PHE 91 18.780 22.892 25.336 575 H SER 92 H SER 92 15.739 17.454 21.558 576 HA SER 92 HA SER 92 13.959 16.549 22.663 577 HB2 SER 92 HB2 SER 92 13.898 19.407 23.528 578 HB3 SER 92 HB3 SER 92 12.496 18.405 23.898 579 HG SER 92 HG SER 92 14.973 17.294 24.470 580 H1 ALA 101 H1 ALA 101 -7.617 -7.090 3.642 581 H2 ALA 101 H2 ALA 101 -9.108 -7.019 4.487 582 H3 ALA 101 H3 ALA 101 -7.976 -8.260 4.841 583 HA ALA 101 HA ALA 101 -6.800 -5.706 5.089 584 HB1 ALA 101 HB1 ALA 101 -8.071 -4.790 6.858 585 HB2 ALA 101 HB2 ALA 101 -9.055 -6.245 7.006 586 HB3 ALA 101 HB3 ALA 101 -9.239 -5.197 5.601 587 H VAL 102 H VAL 102 -4.876 -6.634 5.845 588 HA VAL 102 HA VAL 102 -5.057 -8.895 7.666 589 HB VAL 102 HB VAL 102 -2.521 -8.837 7.415 590 HG11 VAL 102 HG11 VAL 102 -2.614 -9.680 5.041 591 HG12 VAL 102 HG12 VAL 102 -4.319 -9.233 5.036 592 HG13 VAL 102 HG13 VAL 102 -3.729 -10.447 6.171 593 HG21 VAL 102 HG21 VAL 102 -1.643 -6.966 6.565 594 HG22 VAL 102 HG22 VAL 102 -3.207 -6.403 5.988 595 HG23 VAL 102 HG23 VAL 102 -2.247 -7.502 4.999 596 H LEU 103 H LEU 103 -2.889 -8.718 9.269 597 HA LEU 103 HA LEU 103 -2.509 -6.144 10.489 598 HB2 LEU 103 HB2 LEU 103 -4.710 -7.657 11.445 599 HB3 LEU 103 HB3 LEU 103 -3.459 -7.752 12.668 600 HG LEU 103 HG LEU 103 -5.048 -5.901 13.068 601 HD11 LEU 103 HD11 LEU 103 -2.273 -5.793 13.200 602 HD12 LEU 103 HD12 LEU 103 -3.420 -4.778 14.067 603 HD13 LEU 103 HD13 LEU 103 -2.759 -4.243 12.525 604 HD21 LEU 103 HD21 LEU 103 -4.562 -3.850 11.496 605 HD22 LEU 103 HD22 LEU 103 -5.791 -5.044 11.079 606 HD23 LEU 103 HD23 LEU 103 -4.197 -5.114 10.329 607 H ASP 104 H ASP 104 -0.447 -6.539 10.193 608 HA ASP 104 HA ASP 104 0.825 -9.009 11.171 609 HB2 ASP 104 HB2 ASP 104 2.015 -6.527 9.902 610 HB3 ASP 104 HB3 ASP 104 3.009 -7.845 10.521 611 H LEU 105 H LEU 105 -0.136 -8.510 13.394 612 HA LEU 105 HA LEU 105 1.728 -7.009 14.972 613 HB2 LEU 105 HB2 LEU 105 0.497 -5.234 14.352 614 HB3 LEU 105 HB3 LEU 105 -0.935 -6.191 14.100 615 HG LEU 105 HG LEU 105 -1.443 -6.133 16.442 616 HD11 LEU 105 HD11 LEU 105 -0.028 -5.656 18.059 617 HD12 LEU 105 HD12 LEU 105 0.576 -4.215 17.242 618 HD13 LEU 105 HD13 LEU 105 1.257 -5.800 16.861 619 HD21 LEU 105 HD21 LEU 105 -1.012 -3.378 16.379 620 HD22 LEU 105 HD22 LEU 105 -2.443 -4.294 15.897 621 HD23 LEU 105 HD23 LEU 105 -1.211 -3.914 14.709 622 H ASP 106 H ASP 106 -1.055 -7.168 16.507 623 HA ASP 106 HA ASP 106 -1.329 -9.879 17.177 624 HB2 ASP 106 HB2 ASP 106 0.909 -9.127 18.081 625 HB3 ASP 106 HB3 ASP 106 -0.004 -8.271 19.339 626 H VAL 107 H VAL 107 -1.609 -6.576 18.328 627 HA VAL 107 HA VAL 107 -4.465 -6.720 18.474 628 HB VAL 107 HB VAL 107 -3.917 -7.227 20.850 629 HG11 VAL 107 HG11 VAL 107 -1.789 -5.379 20.384 630 HG12 VAL 107 HG12 VAL 107 -2.074 -6.407 21.784 631 HG13 VAL 107 HG13 VAL 107 -2.776 -4.792 21.720 632 HG21 VAL 107 HG21 VAL 107 -4.666 -4.464 21.268 633 HG22 VAL 107 HG22 VAL 107 -5.621 -5.930 21.476 634 HG23 VAL 107 HG23 VAL 107 -5.522 -5.160 19.893 635 H ARG 108 H ARG 108 -5.007 -4.689 17.449 636 HA ARG 108 HA ARG 108 -2.828 -3.235 16.598 637 HB2 ARG 108 HB2 ARG 108 -4.620 -1.706 15.675 638 HB3 ARG 108 HB3 ARG 108 -4.593 -3.358 15.073 639 HG2 ARG 108 HG2 ARG 108 -6.650 -3.757 15.823 640 HG3 ARG 108 HG3 ARG 108 -6.284 -3.082 17.411 641 HD2 ARG 108 HD2 ARG 108 -6.420 -0.922 15.587 642 HD3 ARG 108 HD3 ARG 108 -7.820 -1.950 15.285 643 HE ARG 108 HE ARG 108 -7.926 -1.736 17.930 644 HH11 ARG 108 HH11 ARG 108 -7.394 0.720 15.499 645 HH12 ARG 108 HH12 ARG 108 -8.094 1.986 16.449 646 HH21 ARG 108 HH21 ARG 108 -8.854 -0.066 19.172 647 HH22 ARG 108 HH22 ARG 108 -8.922 1.541 18.530 648 H THR 109 H THR 109 -1.728 -1.928 17.794 649 HA THR 109 HA THR 109 -3.437 -0.059 19.290 650 HB THR 109 HB THR 109 -1.961 -0.928 20.983 651 HG1 THR 109 HG1 THR 109 -1.832 1.478 20.469 652 HG21 THR 109 HG21 THR 109 0.060 -1.058 18.810 653 HG22 THR 109 HG22 THR 109 -0.365 -2.247 20.040 654 HG23 THR 109 HG23 THR 109 0.598 -0.834 20.475 655 H CYS 110 H CYS 110 -3.812 1.113 17.631 656 HA CYS 110 HA CYS 110 -1.780 1.602 15.658 657 HB2 CYS 110 HB2 CYS 110 -4.610 1.978 15.808 658 HB3 CYS 110 HB3 CYS 110 -3.844 3.425 15.160 659 H LEU 111 H LEU 111 -0.155 2.465 17.039 660 HA LEU 111 HA LEU 111 0.025 4.552 18.637 661 HB2 LEU 111 HB2 LEU 111 1.830 3.220 17.108 662 HB3 LEU 111 HB3 LEU 111 1.975 4.850 16.472 663 HG LEU 111 HG LEU 111 3.596 4.423 18.263 664 HD11 LEU 111 HD11 LEU 111 2.072 6.648 17.919 665 HD12 LEU 111 HD12 LEU 111 3.449 6.535 19.015 666 HD13 LEU 111 HD13 LEU 111 1.812 6.308 19.630 667 HD21 LEU 111 HD21 LEU 111 2.861 3.011 19.847 668 HD22 LEU 111 HD22 LEU 111 1.177 3.480 19.637 669 HD23 LEU 111 HD23 LEU 111 2.253 4.476 20.618 670 HA PRO 112 HA PRO 112 -1.696 8.001 16.351 671 HB2 PRO 112 HB2 PRO 112 -2.604 9.334 18.416 672 HB3 PRO 112 HB3 PRO 112 -3.311 7.768 18.011 673 HG2 PRO 112 HG2 PRO 112 -1.297 8.452 20.118 674 HG3 PRO 112 HG3 PRO 112 -2.713 7.389 20.230 675 HD2 PRO 112 HD2 PRO 112 -0.106 6.543 19.759 676 HD3 PRO 112 HD3 PRO 112 -1.568 5.607 19.396 677 H CYS 113 H CYS 113 -1.256 10.228 16.039 678 HA CYS 113 HA CYS 113 0.625 11.601 17.667 679 HB2 CYS 113 HB2 CYS 113 2.406 11.938 16.116 680 HB3 CYS 113 HB3 CYS 113 2.122 10.205 16.164 681 H GLY 114 H GLY 114 1.339 13.568 15.721 682 HA2 GLY 114 HA2 GLY 114 0.572 15.326 14.489 683 HA3 GLY 114 HA3 GLY 114 -0.871 14.396 14.165 684 HA PRO 115 HA PRO 115 -2.177 18.241 16.471 685 HB2 PRO 115 HB2 PRO 115 -4.418 18.566 15.057 686 HB3 PRO 115 HB3 PRO 115 -2.844 19.023 14.356 687 HG2 PRO 115 HG2 PRO 115 -4.122 16.342 14.309 688 HG3 PRO 115 HG3 PRO 115 -3.899 17.388 12.858 689 HD2 PRO 115 HD2 PRO 115 -2.015 15.680 13.282 690 HD3 PRO 115 HD3 PRO 115 -1.468 17.381 13.295 691 H GLY 116 H GLY 116 -2.572 17.212 18.206 692 HA2 GLY 116 HA2 GLY 116 -4.020 16.708 19.980 693 HA3 GLY 116 HA3 GLY 116 -5.204 16.244 18.779 694 H GLY 117 H GLY 117 -2.420 14.798 17.829 695 HA2 GLY 117 HA2 GLY 117 -1.472 12.826 18.143 696 HA3 GLY 117 HA3 GLY 117 -2.300 12.806 19.648 697 H LYS 118 H LYS 118 -3.851 12.971 16.555 698 HA LYS 118 HA LYS 118 -5.243 10.470 17.177 699 HB2 LYS 118 HB2 LYS 118 -6.006 11.858 14.716 700 HB3 LYS 118 HB3 LYS 118 -7.000 11.327 16.063 701 HG2 LYS 118 HG2 LYS 118 -7.120 13.391 16.874 702 HG3 LYS 118 HG3 LYS 118 -5.383 13.551 16.878 703 HD2 LYS 118 HD2 LYS 118 -7.318 14.277 14.716 704 HD3 LYS 118 HD3 LYS 118 -6.153 15.286 15.565 705 HE2 LYS 118 HE2 LYS 118 -5.564 13.167 13.511 706 HE3 LYS 118 HE3 LYS 118 -5.358 14.906 13.339 707 HZ1 LYS 118 HZ1 LYS 118 -3.407 14.847 14.409 708 HZ2 LYS 118 HZ2 LYS 118 -3.414 13.209 14.046 709 HZ3 LYS 118 HZ3 LYS 118 -3.932 13.744 15.556 710 H GLY 119 H GLY 119 -2.996 11.848 14.978 711 HA2 GLY 119 HA2 GLY 119 -3.345 9.886 12.937 712 HA3 GLY 119 HA3 GLY 119 -2.131 11.135 12.965 713 H ARG 120 H ARG 120 -2.067 8.740 12.218 714 HA ARG 120 HA ARG 120 -0.504 7.133 14.066 715 HB2 ARG 120 HB2 ARG 120 -1.979 6.526 11.689 716 HB3 ARG 120 HB3 ARG 120 -0.512 5.549 11.803 717 HG2 ARG 120 HG2 ARG 120 -1.783 4.214 13.098 718 HG3 ARG 120 HG3 ARG 120 -1.466 5.431 14.343 719 HD2 ARG 120 HD2 ARG 120 -3.835 4.936 14.235 720 HD3 ARG 120 HD3 ARG 120 -3.518 6.593 13.741 721 HE ARG 120 HE ARG 120 -4.000 4.419 11.812 722 HH11 ARG 120 HH11 ARG 120 -4.553 7.685 12.940 723 HH12 ARG 120 HH12 ARG 120 -5.549 8.108 11.592 724 HH21 ARG 120 HH21 ARG 120 -5.314 4.984 10.049 725 HH22 ARG 120 HH22 ARG 120 -5.982 6.578 9.954 726 H CYS 121 H CYS 121 1.397 5.895 13.672 727 HA CYS 121 HA CYS 121 3.457 7.562 12.385 728 HB2 CYS 121 HB2 CYS 121 3.367 5.761 14.764 729 HB3 CYS 121 HB3 CYS 121 4.877 5.803 13.873 730 H PHE 122 H PHE 122 4.695 6.828 10.805 731 HA PHE 122 HA PHE 122 4.691 3.962 10.133 732 HB2 PHE 122 HB2 PHE 122 4.215 6.284 8.242 733 HB3 PHE 122 HB3 PHE 122 4.591 4.649 7.708 734 HD1 PHE 122 HD1 PHE 122 2.141 6.590 9.717 735 HD2 PHE 122 HD2 PHE 122 2.895 3.094 7.409 736 HE1 PHE 122 HE1 PHE 122 -0.246 6.000 9.839 737 HE2 PHE 122 HE2 PHE 122 0.510 2.498 7.528 738 HZ PHE 122 HZ PHE 122 -1.062 3.949 8.747 739 H GLY 123 H GLY 123 6.628 5.485 11.564 740 HA2 GLY 123 HA2 GLY 123 9.017 4.679 10.849 741 HA3 GLY 123 HA3 GLY 123 8.794 5.939 9.644 742 HA PRO 124 HA PRO 124 10.629 7.429 13.875 743 HB2 PRO 124 HB2 PRO 124 12.808 8.214 11.998 744 HB3 PRO 124 HB3 PRO 124 12.909 7.589 13.647 745 HG2 PRO 124 HG2 PRO 124 13.465 6.028 11.555 746 HG3 PRO 124 HG3 PRO 124 12.620 5.393 12.978 747 HD2 PRO 124 HD2 PRO 124 11.540 6.096 10.289 748 HD3 PRO 124 HD3 PRO 124 11.060 4.795 11.395 749 H SER 125 H SER 125 11.692 9.208 10.954 750 HA SER 125 HA SER 125 10.403 11.607 12.015 751 HB2 SER 125 HB2 SER 125 12.588 11.055 10.080 752 HB3 SER 125 HB3 SER 125 11.561 12.441 9.667 753 HG SER 125 HG SER 125 11.998 13.232 11.805 754 H ILE 126 H ILE 126 8.609 9.641 11.217 755 HA ILE 126 HA ILE 126 7.359 10.932 8.933 756 HB ILE 126 HB ILE 126 7.550 7.951 9.111 757 HG12 ILE 126 HG12 ILE 126 9.412 9.857 7.684 758 HG13 ILE 126 HG13 ILE 126 9.826 8.808 9.027 759 HG21 ILE 126 HG21 ILE 126 5.804 8.949 7.734 760 HG22 ILE 126 HG22 ILE 126 6.963 8.025 6.787 761 HG23 ILE 126 HG23 ILE 126 7.031 9.787 6.795 762 HD11 ILE 126 HD11 ILE 126 8.862 7.767 6.375 763 HD12 ILE 126 HD12 ILE 126 9.568 6.850 7.705 764 HD13 ILE 126 HD13 ILE 126 10.564 7.978 6.786 765 H CYS 127 H CYS 127 5.306 11.423 9.392 766 HA CYS 127 HA CYS 127 3.692 9.486 10.877 767 HB2 CYS 127 HB2 CYS 127 4.550 11.966 12.006 768 HB3 CYS 127 HB3 CYS 127 2.818 12.064 11.719 769 H CYS 128 H CYS 128 2.168 8.960 9.549 770 HA CYS 128 HA CYS 128 0.727 10.990 8.021 771 HB2 CYS 128 HB2 CYS 128 0.605 8.374 6.805 772 HB3 CYS 128 HB3 CYS 128 1.154 9.879 6.092 773 H GLY 129 H GLY 129 -1.771 10.947 8.386 774 HA2 GLY 129 HA2 GLY 129 -2.679 8.412 9.338 775 HA3 GLY 129 HA3 GLY 129 -3.246 9.983 9.910 776 H ASP 130 H ASP 130 -5.304 9.358 8.840 777 HA ASP 130 HA ASP 130 -5.410 8.977 6.077 778 HB2 ASP 130 HB2 ASP 130 -7.185 8.355 7.791 779 HB3 ASP 130 HB3 ASP 130 -7.695 10.037 7.681 780 H GLU 131 H GLU 131 -6.878 11.775 7.642 781 HA GLU 131 HA GLU 131 -6.329 13.253 5.282 782 HB2 GLU 131 HB2 GLU 131 -7.807 14.762 7.136 783 HB3 GLU 131 HB3 GLU 131 -8.417 13.991 5.687 784 HG2 GLU 131 HG2 GLU 131 -8.626 11.916 7.226 785 HG3 GLU 131 HG3 GLU 131 -8.495 13.088 8.531 786 H LEU 132 H LEU 132 -4.192 12.805 7.178 787 HA LEU 132 HA LEU 132 -3.621 15.481 7.866 788 HB2 LEU 132 HB2 LEU 132 -3.846 13.082 9.422 789 HB3 LEU 132 HB3 LEU 132 -2.183 13.579 9.352 790 HG LEU 132 HG LEU 132 -4.447 15.348 10.241 791 HD11 LEU 132 HD11 LEU 132 -4.245 13.501 11.817 792 HD12 LEU 132 HD12 LEU 132 -3.587 14.989 12.521 793 HD13 LEU 132 HD13 LEU 132 -2.490 13.760 11.903 794 HD21 LEU 132 HD21 LEU 132 -2.211 16.392 11.328 795 HD22 LEU 132 HD22 LEU 132 -2.878 16.896 9.778 796 HD23 LEU 132 HD23 LEU 132 -1.554 15.734 9.830 797 H GLY 133 H GLY 133 -2.992 12.421 6.383 798 HA2 GLY 133 HA2 GLY 133 -1.584 11.863 4.785 799 HA3 GLY 133 HA3 GLY 133 -1.057 13.509 4.816 800 H CYS 134 H CYS 134 1.182 13.298 4.949 801 HA CYS 134 HA CYS 134 2.063 11.882 7.350 802 HB2 CYS 134 HB2 CYS 134 2.417 10.670 5.079 803 HB3 CYS 134 HB3 CYS 134 3.752 11.777 4.900 804 H PHE 135 H PHE 135 3.108 13.270 8.642 805 HA PHE 135 HA PHE 135 4.532 15.450 7.375 806 HB2 PHE 135 HB2 PHE 135 4.979 15.192 10.253 807 HB3 PHE 135 HB3 PHE 135 4.404 16.579 9.344 808 HD1 PHE 135 HD1 PHE 135 3.218 13.323 10.615 809 HD2 PHE 135 HD2 PHE 135 2.291 17.369 9.778 810 HE1 PHE 135 HE1 PHE 135 0.997 13.001 11.616 811 HE2 PHE 135 HE2 PHE 135 0.057 17.075 10.778 812 HZ PHE 135 HZ PHE 135 -0.592 14.881 11.696 813 H VAL 136 H VAL 136 6.401 14.656 6.533 814 HA VAL 136 HA VAL 136 7.633 12.454 7.940 815 HB VAL 136 HB VAL 136 8.677 13.505 5.334 816 HG11 VAL 136 HG11 VAL 136 9.413 11.230 5.050 817 HG12 VAL 136 HG12 VAL 136 8.536 10.721 6.488 818 HG13 VAL 136 HG13 VAL 136 9.932 11.787 6.639 819 HG21 VAL 136 HG21 VAL 136 6.254 13.221 5.044 820 HG22 VAL 136 HG22 VAL 136 6.353 11.594 5.707 821 HG23 VAL 136 HG23 VAL 136 7.133 11.966 4.170 822 H GLY 137 H GLY 137 8.329 13.369 9.665 823 HA2 GLY 137 HA2 GLY 137 10.445 13.914 10.708 824 HA3 GLY 137 HA3 GLY 137 10.837 14.894 9.325 825 H THR 138 H THR 138 7.682 15.387 10.649 826 HA THR 138 HA THR 138 8.627 17.964 11.594 827 HB THR 138 HB THR 138 6.344 18.681 11.649 828 HG1 THR 138 HG1 THR 138 5.830 16.056 11.902 829 HG21 THR 138 HG21 THR 138 7.609 17.750 9.330 830 HG22 THR 138 HG22 THR 138 6.348 18.971 9.464 831 HG23 THR 138 HG23 THR 138 5.917 17.286 9.196 832 H ALA 139 H ALA 139 7.199 18.666 13.776 833 HA ALA 139 HA ALA 139 8.418 17.117 15.804 834 HB1 ALA 139 HB1 ALA 139 7.504 19.562 15.849 835 HB2 ALA 139 HB2 ALA 139 7.513 18.583 17.316 836 HB3 ALA 139 HB3 ALA 139 6.021 18.780 16.396 837 H GLU 140 H GLU 140 5.196 17.059 14.353 838 HA GLU 140 HA GLU 140 3.943 15.373 16.133 839 HB2 GLU 140 HB2 GLU 140 3.610 15.638 13.139 840 HB3 GLU 140 HB3 GLU 140 2.480 14.794 14.188 841 HG2 GLU 140 HG2 GLU 140 1.460 16.827 14.024 842 HG3 GLU 140 HG3 GLU 140 2.440 17.082 15.466 843 H ALA 141 H ALA 141 6.521 14.664 14.096 844 HA ALA 141 HA ALA 141 5.966 11.810 14.029 845 HB1 ALA 141 HB1 ALA 141 7.569 13.611 12.331 846 HB2 ALA 141 HB2 ALA 141 6.651 12.166 11.908 847 HB3 ALA 141 HB3 ALA 141 8.256 12.013 12.622 848 H LEU 142 H LEU 142 8.054 14.202 15.480 849 HA LEU 142 HA LEU 142 10.153 12.560 16.289 850 HB2 LEU 142 HB2 LEU 142 8.928 15.048 17.386 851 HB3 LEU 142 HB3 LEU 142 10.097 14.188 18.372 852 HG LEU 142 HG LEU 142 10.885 14.746 15.567 853 HD11 LEU 142 HD11 LEU 142 10.925 16.973 15.651 854 HD12 LEU 142 HD12 LEU 142 11.477 16.989 17.326 855 HD13 LEU 142 HD13 LEU 142 9.761 16.819 16.966 856 HD21 LEU 142 HD21 LEU 142 12.337 14.998 18.197 857 HD22 LEU 142 HD22 LEU 142 13.053 15.073 16.588 858 HD23 LEU 142 HD23 LEU 142 12.341 13.567 17.166 859 H ARG 143 H ARG 143 6.882 12.808 17.429 860 HA ARG 143 HA ARG 143 7.369 11.227 19.789 861 HB2 ARG 143 HB2 ARG 143 4.766 11.053 19.720 862 HB3 ARG 143 HB3 ARG 143 5.518 12.584 20.143 863 HG2 ARG 143 HG2 ARG 143 4.982 12.223 17.281 864 HG3 ARG 143 HG3 ARG 143 3.551 12.290 18.314 865 HD2 ARG 143 HD2 ARG 143 5.562 14.305 18.966 866 HD3 ARG 143 HD3 ARG 143 4.923 14.450 17.334 867 HE ARG 143 HE ARG 143 2.765 14.119 19.068 868 HH11 ARG 143 HH11 ARG 143 5.256 16.465 18.379 869 HH12 ARG 143 HH12 ARG 143 4.312 17.813 18.918 870 HH21 ARG 143 HH21 ARG 143 1.521 15.894 19.779 871 HH22 ARG 143 HH22 ARG 143 2.193 17.489 19.715 872 H CYS 144 H CYS 144 7.914 10.345 16.768 873 HA CYS 144 HA CYS 144 6.408 7.836 16.803 874 HB2 CYS 144 HB2 CYS 144 8.171 9.277 14.823 875 HB3 CYS 144 HB3 CYS 144 8.027 7.541 14.715 876 H GLN 145 H GLN 145 8.556 8.998 18.587 877 HA GLN 145 HA GLN 145 10.753 7.062 18.279 878 HB2 GLN 145 HB2 GLN 145 11.294 9.471 18.852 879 HB3 GLN 145 HB3 GLN 145 10.589 9.165 20.434 880 HG2 GLN 145 HG2 GLN 145 12.812 8.803 20.859 881 HG3 GLN 145 HG3 GLN 145 12.263 7.170 20.494 882 HE21 GLN 145 HE21 GLN 145 13.363 6.069 19.026 883 HE22 GLN 145 HE22 GLN 145 14.470 6.738 17.881 884 H GLU 146 H GLU 146 7.788 7.404 19.840 885 HA GLU 146 HA GLU 146 8.586 5.745 22.082 886 HB2 GLU 146 HB2 GLU 146 5.923 6.880 21.228 887 HB3 GLU 146 HB3 GLU 146 6.104 5.788 22.595 888 HG2 GLU 146 HG2 GLU 146 7.069 7.356 23.906 889 HG3 GLU 146 HG3 GLU 146 7.874 8.150 22.554 890 H GLU 147 H GLU 147 8.292 5.145 18.930 891 HA GLU 147 HA GLU 147 6.635 2.786 19.061 892 HB2 GLU 147 HB2 GLU 147 7.034 4.259 16.996 893 HB3 GLU 147 HB3 GLU 147 8.602 3.472 16.883 894 HG2 GLU 147 HG2 GLU 147 7.165 2.319 15.419 895 HG3 GLU 147 HG3 GLU 147 7.382 1.280 16.827 896 H ASN 148 H ASN 148 9.522 3.471 20.409 897 HA ASN 148 HA ASN 148 10.710 0.878 19.762 898 HB2 ASN 148 HB2 ASN 148 12.705 1.720 20.988 899 HB3 ASN 148 HB3 ASN 148 12.263 2.729 19.615 900 HD21 ASN 148 HD21 ASN 148 13.793 4.044 21.106 901 HD22 ASN 148 HD22 ASN 148 12.994 5.115 22.199 902 H TYR 149 H TYR 149 9.134 2.648 22.331 903 HA TYR 149 HA TYR 149 9.836 0.636 24.332 904 HB2 TYR 149 HB2 TYR 149 7.767 2.763 24.777 905 HB3 TYR 149 HB3 TYR 149 8.869 2.024 25.932 906 HD1 TYR 149 HD1 TYR 149 11.390 2.571 25.629 907 HD2 TYR 149 HD2 TYR 149 8.248 4.843 23.884 908 HE1 TYR 149 HE1 TYR 149 12.917 4.484 25.390 909 HE2 TYR 149 HE2 TYR 149 9.762 6.764 23.640 910 HH TYR 149 HH TYR 149 12.021 7.339 23.605 911 H LEU 150 H LEU 150 7.877 0.411 21.824 912 HA LEU 150 HA LEU 150 5.988 -1.297 23.256 913 HB2 LEU 150 HB2 LEU 150 4.783 0.248 21.054 914 HB3 LEU 150 HB3 LEU 150 4.085 -0.283 22.569 915 HG LEU 150 HG LEU 150 6.083 1.901 22.739 916 HD11 LEU 150 HD11 LEU 150 4.872 2.597 20.774 917 HD12 LEU 150 HD12 LEU 150 4.376 3.581 22.152 918 HD13 LEU 150 HD13 LEU 150 3.333 2.282 21.574 919 HD21 LEU 150 HD21 LEU 150 5.166 1.409 24.791 920 HD22 LEU 150 HD22 LEU 150 3.582 1.029 24.112 921 HD23 LEU 150 HD23 LEU 150 4.106 2.709 24.245 922 HA PRO 151 HA PRO 151 7.253 -3.704 19.677 923 HB2 PRO 151 HB2 PRO 151 6.411 -6.093 20.556 924 HB3 PRO 151 HB3 PRO 151 7.839 -5.309 21.244 925 HG2 PRO 151 HG2 PRO 151 5.050 -5.450 22.320 926 HG3 PRO 151 HG3 PRO 151 6.591 -5.623 23.179 927 HD2 PRO 151 HD2 PRO 151 5.099 -3.314 23.126 928 HD3 PRO 151 HD3 PRO 151 6.849 -3.365 23.408 929 H SER 152 H SER 152 4.885 -2.159 19.403 930 HA SER 152 HA SER 152 3.359 -3.905 17.682 931 HB2 SER 152 HB2 SER 152 1.174 -3.060 18.808 932 HB3 SER 152 HB3 SER 152 2.050 -4.397 19.553 933 HG SER 152 HG SER 152 3.064 -2.745 20.902 934 HA PRO 153 HA PRO 153 3.326 0.267 15.939 935 HB2 PRO 153 HB2 PRO 153 3.989 -0.433 13.443 936 HB3 PRO 153 HB3 PRO 153 5.172 -0.424 14.754 937 HG2 PRO 153 HG2 PRO 153 3.899 -2.711 13.386 938 HG3 PRO 153 HG3 PRO 153 5.446 -2.632 14.240 939 HD2 PRO 153 HD2 PRO 153 2.926 -3.609 15.215 940 HD3 PRO 153 HD3 PRO 153 4.480 -3.544 16.067 941 H CYS 154 H CYS 154 1.190 -2.335 15.377 942 HA CYS 154 HA CYS 154 -0.941 -2.403 14.548 943 HB2 CYS 154 HB2 CYS 154 -1.045 -0.073 15.558 944 HB3 CYS 154 HB3 CYS 154 -0.756 0.539 13.935 945 H GLN 155 H GLN 155 -0.059 -3.716 12.845 946 HA GLN 155 HA GLN 155 0.746 -4.089 10.670 947 HB2 GLN 155 HB2 GLN 155 -1.877 -4.175 10.938 948 HB3 GLN 155 HB3 GLN 155 -1.820 -2.831 9.806 949 HG2 GLN 155 HG2 GLN 155 -0.117 -4.954 8.896 950 HG3 GLN 155 HG3 GLN 155 -1.725 -5.574 9.232 951 HE21 GLN 155 HE21 GLN 155 -3.380 -3.612 8.506 952 HE22 GLN 155 HE22 GLN 155 -3.211 -3.247 6.826 953 H SER 156 H SER 156 -0.502 -2.552 8.371 954 HA SER 156 HA SER 156 0.650 0.047 8.408 955 HB2 SER 156 HB2 SER 156 2.555 -1.704 7.938 956 HB3 SER 156 HB3 SER 156 1.832 -1.768 6.330 957 HG SER 156 HG SER 156 3.412 -0.183 6.345 958 H GLY 157 H GLY 157 0.679 0.612 5.738 959 HA2 GLY 157 HA2 GLY 157 -2.153 0.197 5.053 960 HA3 GLY 157 HA3 GLY 157 -1.081 1.388 4.315 961 H GLN 158 H GLN 158 -2.745 -0.799 3.023 962 HA GLN 158 HA GLN 158 -0.429 -2.209 1.835 963 HB2 GLN 158 HB2 GLN 158 -2.237 -3.849 1.070 964 HB3 GLN 158 HB3 GLN 158 -1.886 -3.823 2.794 965 HG2 GLN 158 HG2 GLN 158 -4.033 -2.006 1.917 966 HG3 GLN 158 HG3 GLN 158 -4.378 -3.725 1.746 967 HE21 GLN 158 HE21 GLN 158 -4.510 -1.119 3.793 968 HE22 GLN 158 HE22 GLN 158 -4.694 -1.953 5.296 969 H LYS 159 H LYS 159 -0.529 0.057 0.876 970 HA LYS 159 HA LYS 159 -1.822 -0.152 -1.728 971 HB2 LYS 159 HB2 LYS 159 -1.404 2.273 -0.058 972 HB3 LYS 159 HB3 LYS 159 -1.662 2.379 -1.796 973 HG2 LYS 159 HG2 LYS 159 -3.522 0.933 0.074 974 HG3 LYS 159 HG3 LYS 159 -3.722 2.630 -0.364 975 HD2 LYS 159 HD2 LYS 159 -3.376 1.266 -2.788 976 HD3 LYS 159 HD3 LYS 159 -4.455 0.252 -1.828 977 HE2 LYS 159 HE2 LYS 159 -5.950 1.665 -2.873 978 HE3 LYS 159 HE3 LYS 159 -5.681 2.494 -1.340 979 HZ1 LYS 159 HZ1 LYS 159 -5.345 4.223 -2.730 980 HZ2 LYS 159 HZ2 LYS 159 -4.860 3.255 -4.031 981 HZ3 LYS 159 HZ3 LYS 159 -3.773 3.600 -2.781 982 HA PRO 160 HA PRO 160 2.879 -0.065 -1.609 983 HB2 PRO 160 HB2 PRO 160 3.286 -2.198 -3.322 984 HB3 PRO 160 HB3 PRO 160 3.360 -2.266 -1.559 985 HG2 PRO 160 HG2 PRO 160 1.097 -2.956 -3.389 986 HG3 PRO 160 HG3 PRO 160 1.638 -3.781 -1.915 987 HD2 PRO 160 HD2 PRO 160 -0.520 -2.195 -1.880 988 HD3 PRO 160 HD3 PRO 160 0.616 -2.215 -0.515 989 H CYS 161 H CYS 161 2.470 1.845 -2.716 990 HA CYS 161 HA CYS 161 2.735 1.711 -5.637 991 HB2 CYS 161 HB2 CYS 161 2.585 4.360 -5.189 992 HB3 CYS 161 HB3 CYS 161 1.157 3.360 -5.415 993 H GLY 162 H GLY 162 4.305 3.832 -6.249 994 HA2 GLY 162 HA2 GLY 162 6.478 4.641 -6.115 995 HA3 GLY 162 HA3 GLY 162 6.445 4.204 -4.415 996 H SER 163 H SER 163 8.728 3.708 -4.924 997 HA SER 163 HA SER 163 9.231 1.336 -6.511 998 HB2 SER 163 HB2 SER 163 10.925 3.354 -5.106 999 HB3 SER 163 HB3 SER 163 11.626 1.774 -5.448 1000 HG SER 163 HG SER 163 10.313 2.770 -7.604 1001 H GLY 164 H GLY 164 7.534 0.853 -4.397 1002 HA2 GLY 164 HA2 GLY 164 7.610 -1.359 -3.315 1003 HA3 GLY 164 HA3 GLY 164 9.129 -0.844 -2.609 1004 H GLY 165 H GLY 165 7.005 1.837 -2.519 1005 HA2 GLY 165 HA2 GLY 165 6.521 1.187 0.298 1006 HA3 GLY 165 HA3 GLY 165 6.469 2.783 -0.403 1007 H ARG 166 H ARG 166 4.608 1.531 1.419 1008 HA ARG 166 HA ARG 166 2.220 1.247 -0.223 1009 HB2 ARG 166 HB2 ARG 166 1.212 0.699 2.171 1010 HB3 ARG 166 HB3 ARG 166 2.019 -0.522 1.201 1011 HG2 ARG 166 HG2 ARG 166 3.592 1.092 3.159 1012 HG3 ARG 166 HG3 ARG 166 2.590 -0.244 3.725 1013 HD2 ARG 166 HD2 ARG 166 4.899 -0.342 1.797 1014 HD3 ARG 166 HD3 ARG 166 4.771 -1.113 3.375 1015 HE ARG 166 HE ARG 166 3.672 -2.056 0.872 1016 HH11 ARG 166 HH11 ARG 166 3.562 -2.297 4.355 1017 HH12 ARG 166 HH12 ARG 166 2.919 -3.905 4.346 1018 HH21 ARG 166 HH21 ARG 166 2.833 -4.170 0.864 1019 HH22 ARG 166 HH22 ARG 166 2.507 -4.968 2.366 1020 H CYS 167 H CYS 167 0.245 2.440 0.305 1021 HA CYS 167 HA CYS 167 0.750 5.145 0.721 1022 HB2 CYS 167 HB2 CYS 167 -1.066 4.251 -0.734 1023 HB3 CYS 167 HB3 CYS 167 -1.912 3.715 0.713 1024 H ALA 168 H ALA 168 0.929 6.220 2.547 1025 HA ALA 168 HA ALA 168 -0.096 4.970 5.014 1026 HB1 ALA 168 HB1 ALA 168 1.534 6.041 6.164 1027 HB2 ALA 168 HB2 ALA 168 1.423 7.494 5.168 1028 HB3 ALA 168 HB3 ALA 168 2.311 6.090 4.580 1029 H ALA 169 H ALA 169 -0.614 7.348 2.745 1030 HA ALA 169 HA ALA 169 -3.150 8.178 3.835 1031 HB1 ALA 169 HB1 ALA 169 -1.998 9.553 5.208 1032 HB2 ALA 169 HB2 ALA 169 -2.471 10.610 3.901 1033 HB3 ALA 169 HB3 ALA 169 -0.816 10.015 4.018 1034 H ALA 170 H ALA 170 -4.253 9.741 2.452 1035 HA ALA 170 HA ALA 170 -3.899 9.178 -0.303 1036 HB1 ALA 170 HB1 ALA 170 -6.064 9.852 0.679 1037 HB2 ALA 170 HB2 ALA 170 -5.632 10.801 -0.744 1038 HB3 ALA 170 HB3 ALA 170 -5.442 11.491 0.871 1039 H GLY 171 H GLY 171 -2.916 10.285 -1.928 1040 HA2 GLY 171 HA2 GLY 171 -1.624 11.849 -3.014 1041 HA3 GLY 171 HA3 GLY 171 -1.927 12.933 -1.685 1042 H ILE 172 H ILE 172 -0.745 10.270 -0.293 1043 HA ILE 172 HA ILE 172 2.100 10.871 -0.790 1044 HB ILE 172 HB ILE 172 2.630 11.052 1.537 1045 HG12 ILE 172 HG12 ILE 172 0.150 11.491 2.776 1046 HG13 ILE 172 HG13 ILE 172 -0.030 9.992 1.858 1047 HG21 ILE 172 HG21 ILE 172 1.633 12.966 0.015 1048 HG22 ILE 172 HG22 ILE 172 2.056 13.245 1.696 1049 HG23 ILE 172 HG23 ILE 172 0.377 12.959 1.251 1050 HD11 ILE 172 HD11 ILE 172 2.475 10.233 3.290 1051 HD12 ILE 172 HD12 ILE 172 1.348 8.869 3.189 1052 HD13 ILE 172 HD13 ILE 172 1.044 10.187 4.324 1053 H CYS 173 H CYS 173 2.895 9.015 -1.472 1054 HA CYS 173 HA CYS 173 2.116 6.523 -0.152 1055 HB2 CYS 173 HB2 CYS 173 2.071 6.728 -2.663 1056 HB3 CYS 173 HB3 CYS 173 3.825 6.832 -2.623 1057 H CYS 174 H CYS 174 3.298 6.017 1.548 1058 HA CYS 174 HA CYS 174 6.071 6.856 1.666 1059 HB2 CYS 174 HB2 CYS 174 4.300 5.612 3.764 1060 HB3 CYS 174 HB3 CYS 174 5.967 6.116 4.025 1061 H SER 175 H SER 175 7.783 5.592 1.733 1062 HA SER 175 HA SER 175 7.399 2.711 1.240 1063 HB2 SER 175 HB2 SER 175 9.606 2.870 0.038 1064 HB3 SER 175 HB3 SER 175 8.340 3.834 -0.703 1065 HG SER 175 HG SER 175 10.230 4.859 1.135 1066 HA PRO 176 HA PRO 176 9.948 1.893 4.748 1067 HB2 PRO 176 HB2 PRO 176 11.889 0.170 4.023 1068 HB3 PRO 176 HB3 PRO 176 10.183 -0.295 4.042 1069 HG2 PRO 176 HG2 PRO 176 11.907 0.502 1.732 1070 HG3 PRO 176 HG3 PRO 176 10.705 -0.797 1.838 1071 HD2 PRO 176 HD2 PRO 176 10.222 1.630 0.678 1072 HD3 PRO 176 HD3 PRO 176 8.957 0.623 1.404 1073 H ASP 177 H ASP 177 10.765 4.203 3.081 1074 HA ASP 177 HA ASP 177 13.345 4.678 4.332 1075 HB2 ASP 177 HB2 ASP 177 12.819 4.815 1.367 1076 HB3 ASP 177 HB3 ASP 177 14.077 5.795 2.116 1077 H GLY 178 H GLY 178 10.611 5.954 2.465 1078 HA2 GLY 178 HA2 GLY 178 10.358 8.180 4.246 1079 HA3 GLY 178 HA3 GLY 178 10.923 8.664 2.668 1080 H CYS 179 H CYS 179 9.273 9.669 1.773 1081 HA CYS 179 HA CYS 179 6.879 8.136 1.199 1082 HB2 CYS 179 HB2 CYS 179 6.721 10.863 2.492 1083 HB3 CYS 179 HB3 CYS 179 5.355 9.912 1.919 1084 H HIS 180 H HIS 180 5.583 9.074 -0.566 1085 HA HIS 180 HA HIS 180 6.721 11.336 -1.963 1086 HB2 HIS 180 HB2 HIS 180 6.893 9.750 -4.094 1087 HB3 HIS 180 HB3 HIS 180 8.253 9.961 -2.996 1088 HD1 HIS 180 HD1 HIS 180 5.448 7.525 -3.703 1089 HD2 HIS 180 HD2 HIS 180 9.142 7.663 -1.806 1090 HE1 HIS 180 HE1 HIS 180 5.927 5.162 -2.999 1091 HE2 HIS 180 HE2 HIS 180 8.250 5.244 -2.017 1092 H GLU 181 H GLU 181 5.409 12.052 -3.718 1093 HA GLU 181 HA GLU 181 2.659 11.654 -3.282 1094 HB2 GLU 181 HB2 GLU 181 4.180 12.917 -5.554 1095 HB3 GLU 181 HB3 GLU 181 2.422 12.868 -5.507 1096 HG2 GLU 181 HG2 GLU 181 2.601 14.833 -4.478 1097 HG3 GLU 181 HG3 GLU 181 2.992 13.871 -3.054 1098 H ASP 182 H ASP 182 1.149 10.442 -4.314 1099 HA ASP 182 HA ASP 182 2.035 8.712 -6.506 1100 HB2 ASP 182 HB2 ASP 182 1.431 6.705 -5.446 1101 HB3 ASP 182 HB3 ASP 182 2.304 7.617 -4.205 1102 HA PRO 183 HA PRO 183 -1.909 9.832 -8.159 1103 HB2 PRO 183 HB2 PRO 183 -1.769 7.497 -9.906 1104 HB3 PRO 183 HB3 PRO 183 -1.652 9.209 -10.310 1105 HG2 PRO 183 HG2 PRO 183 0.465 7.538 -10.456 1106 HG3 PRO 183 HG3 PRO 183 0.630 9.254 -10.043 1107 HD2 PRO 183 HD2 PRO 183 0.627 6.862 -8.238 1108 HD3 PRO 183 HD3 PRO 183 1.666 8.304 -8.202 1109 H ALA 184 H ALA 184 -1.470 6.525 -7.039 1110 HA ALA 184 HA ALA 184 -4.179 5.739 -7.320 1111 HB1 ALA 184 HB1 ALA 184 -2.257 4.144 -7.015 1112 HB2 ALA 184 HB2 ALA 184 -3.634 3.845 -5.954 1113 HB3 ALA 184 HB3 ALA 184 -2.195 4.647 -5.324 1114 H CYS 185 H CYS 185 -2.203 6.989 -4.732 1115 HA CYS 185 HA CYS 185 -4.592 7.631 -3.155 1116 HB2 CYS 185 HB2 CYS 185 -1.710 7.238 -2.481 1117 HB3 CYS 185 HB3 CYS 185 -2.642 8.360 -1.510 1118 H ASP 186 H ASP 186 -5.178 9.292 -4.785 1119 HA ASP 186 HA ASP 186 -4.126 11.768 -3.966 1120 HB2 ASP 186 HB2 ASP 186 -2.443 10.868 -5.771 1121 HB3 ASP 186 HB3 ASP 186 -3.763 11.013 -6.939 1122 HA PRO 187 HA PRO 187 -7.929 12.125 -6.729 1123 HB2 PRO 187 HB2 PRO 187 -9.905 10.226 -6.262 1124 HB3 PRO 187 HB3 PRO 187 -8.602 9.879 -7.406 1125 HG2 PRO 187 HG2 PRO 187 -8.906 8.995 -4.528 1126 HG3 PRO 187 HG3 PRO 187 -8.312 8.079 -5.920 1127 HD2 PRO 187 HD2 PRO 187 -6.651 9.271 -4.044 1128 HD3 PRO 187 HD3 PRO 187 -6.152 8.906 -5.701 1129 H GLU 188 H GLU 188 -8.817 13.692 -6.090 1130 HA GLU 188 HA GLU 188 -9.339 15.204 -4.183 1131 HB2 GLU 188 HB2 GLU 188 -12.057 15.049 -4.435 1132 HB3 GLU 188 HB3 GLU 188 -11.011 15.906 -5.555 1133 HG2 GLU 188 HG2 GLU 188 -10.906 13.690 -6.854 1134 HG3 GLU 188 HG3 GLU 188 -12.290 13.210 -5.873 1135 H ALA 189 H ALA 189 -8.608 13.784 -2.778 1136 HA ALA 189 HA ALA 189 -10.370 12.160 -1.036 1137 HB1 ALA 189 HB1 ALA 189 -7.829 11.516 -1.762 1138 HB2 ALA 189 HB2 ALA 189 -8.613 10.941 -0.279 1139 HB3 ALA 189 HB3 ALA 189 -7.551 12.348 -0.222 1140 H ALA 190 H ALA 190 -8.395 14.731 -1.269 1141 HA ALA 190 HA ALA 190 -8.814 15.989 1.295 1142 HB1 ALA 190 HB1 ALA 190 -6.674 15.869 -0.447 1143 HB2 ALA 190 HB2 ALA 190 -6.833 16.913 0.967 1144 HB3 ALA 190 HB3 ALA 190 -7.291 17.512 -0.627 1145 H PHE 191 H PHE 191 -10.487 16.990 1.570 1146 HA PHE 191 HA PHE 191 -12.110 18.404 -0.376 1147 HB2 PHE 191 HB2 PHE 191 -12.819 16.851 1.613 1148 HB3 PHE 191 HB3 PHE 191 -12.517 18.262 2.612 1149 HD1 PHE 191 HD1 PHE 191 -14.363 17.436 -0.534 1150 HD2 PHE 191 HD2 PHE 191 -14.342 19.492 3.193 1151 HE1 PHE 191 HE1 PHE 191 -16.669 18.194 -0.940 1152 HE2 PHE 191 HE2 PHE 191 -16.651 20.247 2.796 1153 HZ PHE 191 HZ PHE 191 -17.816 19.599 0.726 1154 H SER 192 H SER 192 -10.731 20.254 -0.845 1155 HA SER 192 HA SER 192 -10.000 22.398 -0.557 1156 HB2 SER 192 HB2 SER 192 -12.143 22.146 1.506 1157 HB3 SER 192 HB3 SER 192 -11.080 23.549 1.589 1158 HG SER 192 HG SER 192 -12.319 24.346 0.101 Start of MODEL 18 1 H1 ALA 1 H1 ALA 1 10.691 36.950 8.467 2 H2 ALA 1 H2 ALA 1 10.029 37.836 7.157 3 H3 ALA 1 H3 ALA 1 11.641 38.128 7.665 4 HA ALA 1 HA ALA 1 10.605 35.629 6.514 5 HB1 ALA 1 HB1 ALA 1 12.632 37.302 5.138 6 HB2 ALA 1 HB2 ALA 1 10.962 37.866 5.123 7 HB3 ALA 1 HB3 ALA 1 11.361 36.279 4.469 8 H VAL 2 H VAL 2 13.658 37.203 6.385 9 HA VAL 2 HA VAL 2 15.801 36.713 7.217 10 HB VAL 2 HB VAL 2 16.200 35.456 9.117 11 HG11 VAL 2 HG11 VAL 2 14.884 36.519 10.538 12 HG12 VAL 2 HG12 VAL 2 13.447 35.656 9.990 13 HG13 VAL 2 HG13 VAL 2 13.994 37.094 9.128 14 HG21 VAL 2 HG21 VAL 2 15.357 33.441 9.758 15 HG22 VAL 2 HG22 VAL 2 14.988 33.334 8.037 16 HG23 VAL 2 HG23 VAL 2 13.732 33.808 9.180 17 H LEU 3 H LEU 3 15.045 35.936 4.785 18 HA LEU 3 HA LEU 3 15.814 33.192 4.164 19 HB2 LEU 3 HB2 LEU 3 14.115 34.266 2.844 20 HB3 LEU 3 HB3 LEU 3 15.181 35.604 2.473 21 HG LEU 3 HG LEU 3 14.773 33.835 0.658 22 HD11 LEU 3 HD11 LEU 3 17.520 33.882 0.455 23 HD12 LEU 3 HD12 LEU 3 17.141 35.290 1.445 24 HD13 LEU 3 HD13 LEU 3 16.397 35.103 -0.142 25 HD21 LEU 3 HD21 LEU 3 15.100 31.748 1.573 26 HD22 LEU 3 HD22 LEU 3 16.435 32.284 2.594 27 HD23 LEU 3 HD23 LEU 3 16.687 32.051 0.864 28 H ASP 4 H ASP 4 17.878 32.820 4.590 29 HA ASP 4 HA ASP 4 19.928 34.713 3.712 30 HB2 ASP 4 HB2 ASP 4 19.973 32.101 5.176 31 HB3 ASP 4 HB3 ASP 4 21.429 32.575 4.304 32 H LEU 5 H LEU 5 19.301 34.753 1.361 33 HA LEU 5 HA LEU 5 20.478 32.583 -0.040 34 HB2 LEU 5 HB2 LEU 5 18.269 31.691 0.349 35 HB3 LEU 5 HB3 LEU 5 17.626 33.096 -0.475 36 HG LEU 5 HG LEU 5 17.550 31.177 -1.959 37 HD11 LEU 5 HD11 LEU 5 18.102 33.415 -2.893 38 HD12 LEU 5 HD12 LEU 5 18.655 32.058 -3.872 39 HD13 LEU 5 HD13 LEU 5 19.802 32.948 -2.871 40 HD21 LEU 5 HD21 LEU 5 19.523 30.024 -0.790 41 HD22 LEU 5 HD22 LEU 5 20.544 30.952 -1.890 42 HD23 LEU 5 HD23 LEU 5 19.360 29.815 -2.535 43 H ASP 6 H ASP 6 18.189 34.789 -0.675 44 HA ASP 6 HA ASP 6 19.176 37.111 -1.424 45 HB2 ASP 6 HB2 ASP 6 20.466 35.383 -3.047 46 HB3 ASP 6 HB3 ASP 6 19.211 35.986 -4.137 47 H VAL 7 H VAL 7 17.098 34.721 -2.231 48 HA VAL 7 HA VAL 7 15.118 36.273 -3.592 49 HB VAL 7 HB VAL 7 15.771 33.891 -4.251 50 HG11 VAL 7 HG11 VAL 7 15.426 33.072 -1.824 51 HG12 VAL 7 HG12 VAL 7 14.911 32.047 -3.163 52 HG13 VAL 7 HG13 VAL 7 13.721 32.996 -2.271 53 HG21 VAL 7 HG21 VAL 7 13.950 33.979 -5.505 54 HG22 VAL 7 HG22 VAL 7 13.455 35.373 -4.543 55 HG23 VAL 7 HG23 VAL 7 12.889 33.758 -4.113 56 H ARG 8 H ARG 8 12.804 35.511 -2.839 57 HA ARG 8 HA ARG 8 12.562 36.614 -0.211 58 HB2 ARG 8 HB2 ARG 8 10.934 36.682 -2.502 59 HB3 ARG 8 HB3 ARG 8 10.094 35.606 -1.393 60 HG2 ARG 8 HG2 ARG 8 9.925 37.288 0.262 61 HG3 ARG 8 HG3 ARG 8 11.066 38.333 -0.584 62 HD2 ARG 8 HD2 ARG 8 8.924 39.235 -0.999 63 HD3 ARG 8 HD3 ARG 8 9.398 38.406 -2.481 64 HE ARG 8 HE ARG 8 7.737 36.834 -2.117 65 HH11 ARG 8 HH11 ARG 8 7.965 38.987 0.631 66 HH12 ARG 8 HH12 ARG 8 6.468 38.456 1.323 67 HH21 ARG 8 HH21 ARG 8 5.773 36.145 -1.204 68 HH22 ARG 8 HH22 ARG 8 5.227 36.845 0.283 69 H THR 9 H THR 9 12.919 35.256 1.325 70 HA THR 9 HA THR 9 13.401 32.659 1.352 71 HB THR 9 HB THR 9 13.250 34.024 3.366 72 HG1 THR 9 HG1 THR 9 12.731 32.357 4.847 73 HG21 THR 9 HG21 THR 9 10.463 33.383 3.468 74 HG22 THR 9 HG22 THR 9 11.288 34.116 4.672 75 HG23 THR 9 HG23 THR 9 11.069 34.883 3.247 76 H CYS 10 H CYS 10 12.578 31.208 0.306 77 HA CYS 10 HA CYS 10 10.642 30.449 -1.036 78 HB2 CYS 10 HB2 CYS 10 11.389 28.642 1.245 79 HB3 CYS 10 HB3 CYS 10 10.508 28.123 -0.184 80 H LEU 11 H LEU 11 8.427 30.540 -1.113 81 HA LEU 11 HA LEU 11 6.611 31.444 0.573 82 HB2 LEU 11 HB2 LEU 11 6.487 29.849 -1.714 83 HB3 LEU 11 HB3 LEU 11 5.450 29.053 -0.545 84 HG LEU 11 HG LEU 11 4.184 30.603 -1.953 85 HD11 LEU 11 HD11 LEU 11 4.227 30.568 0.889 86 HD12 LEU 11 HD12 LEU 11 2.860 30.833 -0.194 87 HD13 LEU 11 HD13 LEU 11 3.830 32.200 0.353 88 HD21 LEU 11 HD21 LEU 11 5.817 32.811 -0.716 89 HD22 LEU 11 HD22 LEU 11 4.550 32.962 -1.933 90 HD23 LEU 11 HD23 LEU 11 6.078 32.184 -2.343 91 HA PRO 12 HA PRO 12 6.811 29.001 4.298 92 HB2 PRO 12 HB2 PRO 12 5.060 30.433 5.721 93 HB3 PRO 12 HB3 PRO 12 6.662 31.051 5.297 94 HG2 PRO 12 HG2 PRO 12 4.044 31.518 3.899 95 HG3 PRO 12 HG3 PRO 12 5.216 32.720 4.480 96 HD2 PRO 12 HD2 PRO 12 5.218 31.956 1.931 97 HD3 PRO 12 HD3 PRO 12 6.747 32.221 2.798 98 H CYS 13 H CYS 13 5.590 27.593 5.621 99 HA CYS 13 HA CYS 13 2.784 27.220 5.173 100 HB2 CYS 13 HB2 CYS 13 2.762 25.049 4.179 101 HB3 CYS 13 HB3 CYS 13 3.804 26.046 3.178 102 H GLY 14 H GLY 14 2.311 24.779 6.206 103 HA2 GLY 14 HA2 GLY 14 2.439 23.440 8.078 104 HA3 GLY 14 HA3 GLY 14 3.993 24.164 8.437 105 HA PRO 15 HA PRO 15 1.106 25.457 11.907 106 HB2 PRO 15 HB2 PRO 15 2.900 25.218 13.845 107 HB3 PRO 15 HB3 PRO 15 2.252 23.740 13.081 108 HG2 PRO 15 HG2 PRO 15 4.510 25.397 12.087 109 HG3 PRO 15 HG3 PRO 15 4.734 23.772 12.858 110 HD2 PRO 15 HD2 PRO 15 4.495 23.740 10.296 111 HD3 PRO 15 HD3 PRO 15 3.203 22.836 11.143 112 H GLY 16 H GLY 16 1.004 27.427 11.223 113 HA2 GLY 16 HA2 GLY 16 1.166 29.785 11.648 114 HA3 GLY 16 HA3 GLY 16 2.732 29.466 12.371 115 H GLY 17 H GLY 17 2.366 27.888 9.627 116 HA2 GLY 17 HA2 GLY 17 3.317 27.897 7.517 117 HA3 GLY 17 HA3 GLY 17 2.654 29.522 7.583 118 H LYS 18 H LYS 18 5.344 27.845 9.117 119 HA LYS 18 HA LYS 18 7.060 30.155 8.540 120 HB2 LYS 18 HB2 LYS 18 8.184 27.902 10.094 121 HB3 LYS 18 HB3 LYS 18 8.184 29.616 10.447 122 HG2 LYS 18 HG2 LYS 18 5.544 28.671 10.821 123 HG3 LYS 18 HG3 LYS 18 6.636 27.594 11.669 124 HD2 LYS 18 HD2 LYS 18 7.545 29.425 12.943 125 HD3 LYS 18 HD3 LYS 18 6.693 30.597 11.931 126 HE2 LYS 18 HE2 LYS 18 5.074 30.567 13.462 127 HE3 LYS 18 HE3 LYS 18 4.676 28.956 12.867 128 HZ1 LYS 18 HZ1 LYS 18 4.962 28.988 15.270 129 HZ2 LYS 18 HZ2 LYS 18 6.548 29.551 15.097 130 HZ3 LYS 18 HZ3 LYS 18 6.132 28.010 14.538 131 H GLY 19 H GLY 19 7.150 26.906 8.671 132 HA2 GLY 19 HA2 GLY 19 8.959 25.997 7.064 133 HA3 GLY 19 HA3 GLY 19 7.491 25.027 6.999 134 H ARG 20 H ARG 20 8.801 24.838 4.668 135 HA ARG 20 HA ARG 20 7.596 26.889 2.926 136 HB2 ARG 20 HB2 ARG 20 10.323 25.705 3.063 137 HB3 ARG 20 HB3 ARG 20 9.763 26.473 1.584 138 HG2 ARG 20 HG2 ARG 20 9.616 28.577 2.640 139 HG3 ARG 20 HG3 ARG 20 9.746 27.861 4.249 140 HD2 ARG 20 HD2 ARG 20 11.949 27.629 2.220 141 HD3 ARG 20 HD3 ARG 20 11.819 29.019 3.296 142 HE ARG 20 HE ARG 20 12.478 26.274 4.051 143 HH11 ARG 20 HH11 ARG 20 11.886 29.573 5.045 144 HH12 ARG 20 HH12 ARG 20 12.627 29.368 6.597 145 HH21 ARG 20 HH21 ARG 20 13.455 26.011 6.090 146 HH22 ARG 20 HH22 ARG 20 13.517 27.349 7.189 147 H CYS 21 H CYS 21 7.804 26.181 0.517 148 HA CYS 21 HA CYS 21 6.717 23.448 0.396 149 HB2 CYS 21 HB2 CYS 21 6.188 25.938 -1.125 150 HB3 CYS 21 HB3 CYS 21 6.050 24.414 -2.003 151 H PHE 22 H PHE 22 7.535 21.899 -0.783 152 HA PHE 22 HA PHE 22 9.583 22.411 -2.793 153 HB2 PHE 22 HB2 PHE 22 9.981 20.831 -0.260 154 HB3 PHE 22 HB3 PHE 22 10.912 20.463 -1.707 155 HD1 PHE 22 HD1 PHE 22 10.316 22.901 0.956 156 HD2 PHE 22 HD2 PHE 22 12.596 21.982 -2.522 157 HE1 PHE 22 HE1 PHE 22 11.917 24.683 1.534 158 HE2 PHE 22 HE2 PHE 22 14.197 23.758 -1.949 159 HZ PHE 22 HZ PHE 22 13.859 25.112 0.080 160 H GLY 23 H GLY 23 6.912 21.644 -3.085 161 HA2 GLY 23 HA2 GLY 23 6.660 19.844 -4.956 162 HA3 GLY 23 HA3 GLY 23 6.957 18.754 -3.607 163 HA PRO 24 HA PRO 24 2.362 20.079 -3.963 164 HB2 PRO 24 HB2 PRO 24 1.861 17.281 -4.756 165 HB3 PRO 24 HB3 PRO 24 1.253 18.777 -5.471 166 HG2 PRO 24 HG2 PRO 24 3.092 17.282 -6.722 167 HG3 PRO 24 HG3 PRO 24 3.118 19.054 -6.810 168 HD2 PRO 24 HD2 PRO 24 4.776 17.218 -5.107 169 HD3 PRO 24 HD3 PRO 24 5.274 18.659 -6.025 170 H SER 25 H SER 25 2.989 16.617 -3.294 171 HA SER 25 HA SER 25 1.617 16.906 -0.737 172 HB2 SER 25 HB2 SER 25 2.464 14.573 -2.425 173 HB3 SER 25 HB3 SER 25 2.234 14.300 -0.686 174 HG SER 25 HG SER 25 0.126 15.527 -1.215 175 H ILE 26 H ILE 26 4.084 18.294 -0.919 176 HA ILE 26 HA ILE 26 5.455 17.107 1.285 177 HB ILE 26 HB ILE 26 7.280 17.769 -0.956 178 HG12 ILE 26 HG12 ILE 26 6.718 14.929 -0.798 179 HG13 ILE 26 HG13 ILE 26 5.329 15.853 -1.367 180 HG21 ILE 26 HG21 ILE 26 8.224 17.428 1.150 181 HG22 ILE 26 HG22 ILE 26 8.578 15.993 0.188 182 HG23 ILE 26 HG23 ILE 26 7.287 15.960 1.389 183 HD11 ILE 26 HD11 ILE 26 7.335 16.919 -2.864 184 HD12 ILE 26 HD12 ILE 26 6.285 15.600 -3.380 185 HD13 ILE 26 HD13 ILE 26 7.873 15.248 -2.696 186 H CYS 27 H CYS 27 5.891 18.684 2.683 187 HA CYS 27 HA CYS 27 6.633 21.363 1.671 188 HB2 CYS 27 HB2 CYS 27 4.330 20.748 3.194 189 HB3 CYS 27 HB3 CYS 27 5.461 21.486 4.319 190 H CYS 28 H CYS 28 8.721 21.806 2.301 191 HA CYS 28 HA CYS 28 9.730 20.357 4.646 192 HB2 CYS 28 HB2 CYS 28 11.082 21.419 2.170 193 HB3 CYS 28 HB3 CYS 28 12.043 21.165 3.624 194 H GLY 29 H GLY 29 11.283 21.506 6.241 195 HA2 GLY 29 HA2 GLY 29 11.299 24.347 6.072 196 HA3 GLY 29 HA3 GLY 29 10.546 23.640 7.503 197 H ASP 30 H ASP 30 12.716 25.131 7.783 198 HA ASP 30 HA ASP 30 15.203 23.831 7.840 199 HB2 ASP 30 HB2 ASP 30 15.859 25.721 9.353 200 HB3 ASP 30 HB3 ASP 30 15.157 26.231 7.821 201 H GLU 31 H GLU 31 12.664 24.244 9.993 202 HA GLU 31 HA GLU 31 13.857 22.270 11.826 203 HB2 GLU 31 HB2 GLU 31 12.243 23.582 13.577 204 HB3 GLU 31 HB3 GLU 31 13.979 23.789 13.443 205 HG2 GLU 31 HG2 GLU 31 13.620 25.708 11.970 206 HG3 GLU 31 HG3 GLU 31 11.876 25.496 12.138 207 H LEU 32 H LEU 32 11.574 22.657 9.694 208 HA LEU 32 HA LEU 32 9.526 21.211 11.079 209 HB2 LEU 32 HB2 LEU 32 9.626 23.424 9.413 210 HB3 LEU 32 HB3 LEU 32 8.864 22.150 8.513 211 HG LEU 32 HG LEU 32 7.984 23.169 11.228 212 HD11 LEU 32 HD11 LEU 32 7.744 24.749 9.272 213 HD12 LEU 32 HD12 LEU 32 6.282 24.396 10.194 214 HD13 LEU 32 HD13 LEU 32 6.551 23.617 8.634 215 HD21 LEU 32 HD21 LEU 32 7.378 20.815 10.818 216 HD22 LEU 32 HD22 LEU 32 6.517 21.314 9.362 217 HD23 LEU 32 HD23 LEU 32 5.975 21.876 10.944 218 H GLY 33 H GLY 33 12.025 20.868 8.935 219 HA2 GLY 33 HA2 GLY 33 12.741 19.169 7.621 220 HA3 GLY 33 HA3 GLY 33 11.656 18.193 8.550 221 H CYS 34 H CYS 34 10.021 17.148 7.291 222 HA CYS 34 HA CYS 34 8.850 18.733 5.178 223 HB2 CYS 34 HB2 CYS 34 10.870 17.020 4.500 224 HB3 CYS 34 HB3 CYS 34 9.396 16.150 4.112 225 H PHE 35 H PHE 35 6.849 18.535 4.939 226 HA PHE 35 HA PHE 35 5.589 16.227 6.250 227 HB2 PHE 35 HB2 PHE 35 3.596 18.083 5.423 228 HB3 PHE 35 HB3 PHE 35 4.003 17.627 7.067 229 HD1 PHE 35 HD1 PHE 35 6.529 18.947 7.579 230 HD2 PHE 35 HD2 PHE 35 3.176 20.313 5.340 231 HE1 PHE 35 HE1 PHE 35 7.168 21.276 8.046 232 HE2 PHE 35 HE2 PHE 35 3.815 22.643 5.799 233 HZ PHE 35 HZ PHE 35 5.812 23.127 7.154 234 H VAL 36 H VAL 36 5.716 14.800 4.698 235 HA VAL 36 HA VAL 36 5.176 15.651 1.989 236 HB VAL 36 HB VAL 36 5.863 12.803 2.668 237 HG11 VAL 36 HG11 VAL 36 5.249 13.363 0.379 238 HG12 VAL 36 HG12 VAL 36 6.961 12.947 0.461 239 HG13 VAL 36 HG13 VAL 36 6.471 14.652 0.336 240 HG21 VAL 36 HG21 VAL 36 7.544 14.114 3.899 241 HG22 VAL 36 HG22 VAL 36 7.875 15.076 2.461 242 HG23 VAL 36 HG23 VAL 36 8.288 13.362 2.487 243 H GLY 37 H GLY 37 3.172 16.170 2.183 244 HA2 GLY 37 HA2 GLY 37 0.952 15.629 1.559 245 HA3 GLY 37 HA3 GLY 37 1.254 13.954 1.985 246 H THR 38 H THR 38 0.543 17.144 3.264 247 HA THR 38 HA THR 38 -1.076 16.007 5.391 248 HB THR 38 HB THR 38 0.064 17.201 7.189 249 HG1 THR 38 HG1 THR 38 0.976 18.946 6.308 250 HG21 THR 38 HG21 THR 38 1.082 15.171 7.228 251 HG22 THR 38 HG22 THR 38 2.477 16.202 6.905 252 HG23 THR 38 HG23 THR 38 1.704 15.324 5.585 253 H ALA 39 H ALA 39 -2.466 17.879 6.475 254 HA ALA 39 HA ALA 39 -3.517 19.531 4.680 255 HB1 ALA 39 HB1 ALA 39 -4.017 18.977 7.227 256 HB2 ALA 39 HB2 ALA 39 -4.711 20.384 6.422 257 HB3 ALA 39 HB3 ALA 39 -3.289 20.568 7.451 258 H GLU 40 H GLU 40 -0.596 20.214 6.601 259 HA GLU 40 HA GLU 40 -0.432 22.972 6.090 260 HB2 GLU 40 HB2 GLU 40 1.865 21.036 6.425 261 HB3 GLU 40 HB3 GLU 40 1.898 22.771 6.710 262 HG2 GLU 40 HG2 GLU 40 0.804 22.607 8.706 263 HG3 GLU 40 HG3 GLU 40 -0.044 21.132 8.246 264 H ALA 41 H ALA 41 0.179 20.167 4.082 265 HA ALA 41 HA ALA 41 1.751 21.502 2.182 266 HB1 ALA 41 HB1 ALA 41 2.207 19.265 2.149 267 HB2 ALA 41 HB2 ALA 41 0.990 19.332 0.872 268 HB3 ALA 41 HB3 ALA 41 0.538 18.806 2.494 269 H LEU 42 H LEU 42 -1.777 21.140 2.754 270 HA LEU 42 HA LEU 42 -2.766 21.451 0.246 271 HB2 LEU 42 HB2 LEU 42 -3.570 22.385 2.967 272 HB3 LEU 42 HB3 LEU 42 -4.439 23.039 1.593 273 HG LEU 42 HG LEU 42 -4.195 20.113 1.571 274 HD11 LEU 42 HD11 LEU 42 -5.438 19.575 3.412 275 HD12 LEU 42 HD12 LEU 42 -6.184 21.170 3.514 276 HD13 LEU 42 HD13 LEU 42 -4.520 20.937 4.053 277 HD21 LEU 42 HD21 LEU 42 -5.732 22.021 0.342 278 HD22 LEU 42 HD22 LEU 42 -6.831 21.359 1.554 279 HD23 LEU 42 HD23 LEU 42 -6.073 20.290 0.373 280 H ARG 43 H ARG 43 -1.310 23.861 2.353 281 HA ARG 43 HA ARG 43 -1.811 26.171 0.762 282 HB2 ARG 43 HB2 ARG 43 -1.232 26.360 3.124 283 HB3 ARG 43 HB3 ARG 43 0.306 25.562 2.847 284 HG2 ARG 43 HG2 ARG 43 -0.247 28.096 1.384 285 HG3 ARG 43 HG3 ARG 43 0.124 28.175 3.109 286 HD2 ARG 43 HD2 ARG 43 2.286 27.953 2.683 287 HD3 ARG 43 HD3 ARG 43 1.990 26.422 1.862 288 HE ARG 43 HE ARG 43 1.349 28.522 0.120 289 HH11 ARG 43 HH11 ARG 43 4.197 27.224 1.667 290 HH12 ARG 43 HH12 ARG 43 5.217 27.507 0.296 291 HH21 ARG 43 HH21 ARG 43 2.675 28.854 -1.687 292 HH22 ARG 43 HH22 ARG 43 4.352 28.430 -1.610 293 H CYS 44 H CYS 44 -0.100 23.540 0.197 294 HA CYS 44 HA CYS 44 2.211 24.743 -1.151 295 HB2 CYS 44 HB2 CYS 44 1.659 22.061 -0.395 296 HB3 CYS 44 HB3 CYS 44 2.006 22.100 -2.118 297 H GLN 45 H GLN 45 -1.049 24.641 -2.046 298 HA GLN 45 HA GLN 45 -0.810 23.954 -4.728 299 HB2 GLN 45 HB2 GLN 45 -2.877 24.264 -3.189 300 HB3 GLN 45 HB3 GLN 45 -2.745 25.966 -3.602 301 HG2 GLN 45 HG2 GLN 45 -3.993 25.536 -5.374 302 HG3 GLN 45 HG3 GLN 45 -2.620 24.653 -6.040 303 HE21 GLN 45 HE21 GLN 45 -5.481 24.294 -4.004 304 HE22 GLN 45 HE22 GLN 45 -5.776 22.639 -4.401 305 H GLU 46 H GLU 46 0.046 26.833 -2.944 306 HA GLU 46 HA GLU 46 0.089 28.486 -5.334 307 HB2 GLU 46 HB2 GLU 46 1.011 29.022 -2.506 308 HB3 GLU 46 HB3 GLU 46 1.085 30.203 -3.806 309 HG2 GLU 46 HG2 GLU 46 -1.200 30.472 -3.877 310 HG3 GLU 46 HG3 GLU 46 -1.513 28.899 -3.147 311 H GLU 47 H GLU 47 1.956 26.043 -4.351 312 HA GLU 47 HA GLU 47 4.564 27.200 -4.844 313 HB2 GLU 47 HB2 GLU 47 3.979 25.174 -3.311 314 HB3 GLU 47 HB3 GLU 47 3.972 24.252 -4.808 315 HG2 GLU 47 HG2 GLU 47 6.335 25.910 -4.555 316 HG3 GLU 47 HG3 GLU 47 6.156 24.783 -3.212 317 H ASN 48 H ASN 48 2.012 26.611 -6.756 318 HA ASN 48 HA ASN 48 3.503 25.452 -8.994 319 HB2 ASN 48 HB2 ASN 48 1.061 24.836 -8.307 320 HB3 ASN 48 HB3 ASN 48 0.633 26.339 -9.118 321 HD21 ASN 48 HD21 ASN 48 -0.093 25.976 -11.073 322 HD22 ASN 48 HD22 ASN 48 0.504 24.796 -12.185 323 H TYR 49 H TYR 49 2.255 28.474 -7.789 324 HA TYR 49 HA TYR 49 2.993 29.783 -10.328 325 HB2 TYR 49 HB2 TYR 49 1.188 30.802 -8.127 326 HB3 TYR 49 HB3 TYR 49 1.551 31.643 -9.631 327 HD1 TYR 49 HD1 TYR 49 0.908 30.430 -11.823 328 HD2 TYR 49 HD2 TYR 49 -0.645 29.368 -8.007 329 HE1 TYR 49 HE1 TYR 49 -0.985 29.302 -12.914 330 HE2 TYR 49 HE2 TYR 49 -2.542 28.237 -9.088 331 HH TYR 49 HH TYR 49 -2.740 27.928 -12.603 332 H LEU 50 H LEU 50 4.515 29.064 -7.630 333 HA LEU 50 HA LEU 50 6.084 31.526 -7.677 334 HB2 LEU 50 HB2 LEU 50 4.268 30.948 -5.601 335 HB3 LEU 50 HB3 LEU 50 5.866 30.638 -4.950 336 HG LEU 50 HG LEU 50 5.780 33.155 -6.393 337 HD11 LEU 50 HD11 LEU 50 3.395 32.632 -5.144 338 HD12 LEU 50 HD12 LEU 50 4.045 34.234 -5.497 339 HD13 LEU 50 HD13 LEU 50 4.298 33.508 -3.908 340 HD21 LEU 50 HD21 LEU 50 6.411 32.401 -3.542 341 HD22 LEU 50 HD22 LEU 50 6.733 33.972 -4.278 342 HD23 LEU 50 HD23 LEU 50 7.562 32.532 -4.872 343 HA PRO 51 HA PRO 51 8.832 27.863 -7.267 344 HB2 PRO 51 HB2 PRO 51 10.013 27.910 -9.658 345 HB3 PRO 51 HB3 PRO 51 8.368 27.292 -9.468 346 HG2 PRO 51 HG2 PRO 51 9.301 29.843 -10.651 347 HG3 PRO 51 HG3 PRO 51 7.843 28.903 -11.006 348 HD2 PRO 51 HD2 PRO 51 8.092 31.194 -9.300 349 HD3 PRO 51 HD3 PRO 51 6.639 30.228 -9.620 350 H SER 52 H SER 52 9.412 30.266 -6.014 351 HA SER 52 HA SER 52 11.917 31.314 -7.006 352 HB2 SER 52 HB2 SER 52 10.404 31.873 -4.446 353 HB3 SER 52 HB3 SER 52 11.830 32.755 -4.992 354 HG SER 52 HG SER 52 9.550 33.545 -5.509 355 HA PRO 53 HA PRO 53 14.226 28.283 -4.572 356 HB2 PRO 53 HB2 PRO 53 16.625 28.681 -5.679 357 HB3 PRO 53 HB3 PRO 53 15.334 27.876 -6.579 358 HG2 PRO 53 HG2 PRO 53 16.284 30.707 -6.754 359 HG3 PRO 53 HG3 PRO 53 15.835 29.595 -8.059 360 HD2 PRO 53 HD2 PRO 53 14.179 31.547 -7.029 361 HD3 PRO 53 HD3 PRO 53 13.613 30.090 -7.867 362 H CYS 54 H CYS 54 14.747 28.751 -2.498 363 HA CYS 54 HA CYS 54 16.317 31.196 -1.975 364 HB2 CYS 54 HB2 CYS 54 15.087 31.601 -0.002 365 HB3 CYS 54 HB3 CYS 54 13.877 31.142 -1.191 366 H GLN 55 H GLN 55 16.704 30.712 0.809 367 HA GLN 55 HA GLN 55 19.057 29.107 0.727 368 HB2 GLN 55 HB2 GLN 55 19.109 29.332 3.153 369 HB3 GLN 55 HB3 GLN 55 18.688 30.866 2.408 370 HG2 GLN 55 HG2 GLN 55 17.020 30.940 3.872 371 HG3 GLN 55 HG3 GLN 55 16.236 29.722 2.865 372 HE21 GLN 55 HE21 GLN 55 16.718 30.424 5.915 373 HE22 GLN 55 HE22 GLN 55 16.917 28.853 6.607 374 H SER 56 H SER 56 19.354 26.942 0.822 375 HA SER 56 HA SER 56 17.522 25.230 2.281 376 HB2 SER 56 HB2 SER 56 17.720 25.202 -0.727 377 HB3 SER 56 HB3 SER 56 17.310 23.735 0.161 378 HG SER 56 HG SER 56 15.430 24.833 -0.423 379 H GLY 57 H GLY 57 18.365 22.776 1.107 380 HA2 GLY 57 HA2 GLY 57 21.242 22.798 1.737 381 HA3 GLY 57 HA3 GLY 57 20.147 21.510 2.230 382 H GLN 58 H GLN 58 22.565 21.879 0.327 383 HA GLN 58 HA GLN 58 21.364 20.497 -1.952 384 HB2 GLN 58 HB2 GLN 58 22.942 22.703 -2.077 385 HB3 GLN 58 HB3 GLN 58 24.164 21.442 -2.164 386 HG2 GLN 58 HG2 GLN 58 23.720 21.120 -4.304 387 HG3 GLN 58 HG3 GLN 58 22.035 20.768 -3.929 388 HE21 GLN 58 HE21 GLN 58 24.297 23.414 -4.512 389 HE22 GLN 58 HE22 GLN 58 23.137 24.495 -5.198 390 H LYS 59 H LYS 59 21.258 18.725 -0.546 391 HA LYS 59 HA LYS 59 23.862 17.264 -0.471 392 HB2 LYS 59 HB2 LYS 59 22.284 18.037 1.766 393 HB3 LYS 59 HB3 LYS 59 22.044 16.307 1.568 394 HG2 LYS 59 HG2 LYS 59 24.827 16.901 1.323 395 HG3 LYS 59 HG3 LYS 59 24.197 17.643 2.794 396 HD2 LYS 59 HD2 LYS 59 23.519 15.589 3.681 397 HD3 LYS 59 HD3 LYS 59 23.571 14.789 2.108 398 HE2 LYS 59 HE2 LYS 59 26.054 15.138 2.117 399 HE3 LYS 59 HE3 LYS 59 25.907 15.702 3.781 400 HZ1 LYS 59 HZ1 LYS 59 25.664 13.628 4.539 401 HZ2 LYS 59 HZ2 LYS 59 26.317 13.144 3.057 402 HZ3 LYS 59 HZ3 LYS 59 24.640 13.160 3.276 403 HA PRO 60 HA PRO 60 20.561 15.166 -2.960 404 HB2 PRO 60 HB2 PRO 60 22.234 14.419 -4.964 405 HB3 PRO 60 HB3 PRO 60 21.345 15.946 -4.948 406 HG2 PRO 60 HG2 PRO 60 24.193 15.401 -4.205 407 HG3 PRO 60 HG3 PRO 60 23.516 16.757 -5.128 408 HD2 PRO 60 HD2 PRO 60 24.174 17.000 -2.533 409 HD3 PRO 60 HD3 PRO 60 22.781 17.849 -3.226 410 H CYS 61 H CYS 61 20.748 13.772 -1.129 411 HA CYS 61 HA CYS 61 22.419 11.410 -1.532 412 HB2 CYS 61 HB2 CYS 61 22.273 10.976 0.717 413 HB3 CYS 61 HB3 CYS 61 21.984 12.702 0.791 414 H GLY 62 H GLY 62 20.706 9.345 -0.665 415 HA2 GLY 62 HA2 GLY 62 18.901 8.119 -1.358 416 HA3 GLY 62 HA3 GLY 62 18.088 9.645 -1.665 417 H SER 63 H SER 63 17.182 8.348 -3.344 418 HA SER 63 HA SER 63 18.774 7.676 -5.683 419 HB2 SER 63 HB2 SER 63 15.915 7.273 -4.862 420 HB3 SER 63 HB3 SER 63 16.362 7.110 -6.559 421 HG SER 63 HG SER 63 16.616 5.112 -5.725 422 H GLY 64 H GLY 64 18.903 10.288 -5.078 423 HA2 GLY 64 HA2 GLY 64 19.110 12.002 -6.777 424 HA3 GLY 64 HA3 GLY 64 17.457 11.648 -7.233 425 H GLY 65 H GLY 65 17.813 11.751 -3.728 426 HA2 GLY 65 HA2 GLY 65 16.516 14.403 -3.885 427 HA3 GLY 65 HA3 GLY 65 16.347 13.271 -2.566 428 H ARG 66 H ARG 66 17.368 16.217 -3.133 429 HA ARG 66 HA ARG 66 19.837 16.121 -1.564 430 HB2 ARG 66 HB2 ARG 66 19.922 18.586 -1.910 431 HB3 ARG 66 HB3 ARG 66 19.990 17.659 -3.391 432 HG2 ARG 66 HG2 ARG 66 18.329 19.830 -2.766 433 HG3 ARG 66 HG3 ARG 66 18.331 18.861 -4.230 434 HD2 ARG 66 HD2 ARG 66 16.595 17.454 -3.378 435 HD3 ARG 66 HD3 ARG 66 16.728 18.168 -1.770 436 HE ARG 66 HE ARG 66 15.868 20.249 -2.760 437 HH11 ARG 66 HH11 ARG 66 15.316 17.262 -4.490 438 HH12 ARG 66 HH12 ARG 66 13.947 17.876 -5.356 439 HH21 ARG 66 HH21 ARG 66 14.075 21.051 -3.908 440 HH22 ARG 66 HH22 ARG 66 13.244 20.023 -5.027 441 H CYS 67 H CYS 67 20.000 17.444 0.471 442 HA CYS 67 HA CYS 67 17.817 16.919 2.118 443 HB2 CYS 67 HB2 CYS 67 20.329 18.538 2.515 444 HB3 CYS 67 HB3 CYS 67 19.126 18.340 3.786 445 H ALA 68 H ALA 68 15.979 17.885 1.934 446 HA ALA 68 HA ALA 68 15.859 20.733 1.203 447 HB1 ALA 68 HB1 ALA 68 13.270 19.977 1.431 448 HB2 ALA 68 HB2 ALA 68 14.020 18.439 1.010 449 HB3 ALA 68 HB3 ALA 68 14.211 19.834 -0.053 450 H ALA 69 H ALA 69 16.005 18.795 3.839 451 HA ALA 69 HA ALA 69 15.455 20.860 5.713 452 HB1 ALA 69 HB1 ALA 69 13.522 18.581 5.964 453 HB2 ALA 69 HB2 ALA 69 13.130 20.018 5.019 454 HB3 ALA 69 HB3 ALA 69 13.489 20.165 6.740 455 H ALA 70 H ALA 70 15.839 20.093 7.941 456 HA ALA 70 HA ALA 70 18.093 18.496 8.142 457 HB1 ALA 70 HB1 ALA 70 16.324 18.883 10.506 458 HB2 ALA 70 HB2 ALA 70 17.109 20.271 9.751 459 HB3 ALA 70 HB3 ALA 70 18.082 18.947 10.391 460 H GLY 71 H GLY 71 18.373 16.406 7.949 461 HA2 GLY 71 HA2 GLY 71 18.136 14.128 8.145 462 HA3 GLY 71 HA3 GLY 71 17.052 14.453 9.490 463 H ILE 72 H ILE 72 16.694 15.446 6.214 464 HA ILE 72 HA ILE 72 14.785 13.421 5.555 465 HB ILE 72 HB ILE 72 12.843 14.726 5.156 466 HG12 ILE 72 HG12 ILE 72 13.115 17.077 6.557 467 HG13 ILE 72 HG13 ILE 72 14.630 16.958 5.645 468 HG21 ILE 72 HG21 ILE 72 12.058 14.682 7.298 469 HG22 ILE 72 HG22 ILE 72 13.510 15.422 7.968 470 HG23 ILE 72 HG23 ILE 72 13.530 13.729 7.477 471 HD11 ILE 72 HD11 ILE 72 12.559 16.082 4.019 472 HD12 ILE 72 HD12 ILE 72 13.574 17.518 3.806 473 HD13 ILE 72 HD13 ILE 72 12.054 17.628 4.707 474 H CYS 73 H CYS 73 15.846 12.885 3.829 475 HA CYS 73 HA CYS 73 16.901 14.809 1.943 476 HB2 CYS 73 HB2 CYS 73 17.446 12.140 2.698 477 HB3 CYS 73 HB3 CYS 73 16.949 12.084 1.014 478 H CYS 74 H CYS 74 15.087 15.791 1.024 479 HA CYS 74 HA CYS 74 13.149 14.058 -0.294 480 HB2 CYS 74 HB2 CYS 74 13.149 17.029 0.223 481 HB3 CYS 74 HB3 CYS 74 11.871 16.175 -0.635 482 H SER 75 H SER 75 12.498 14.350 -2.413 483 HA SER 75 HA SER 75 14.396 15.679 -4.223 484 HB2 SER 75 HB2 SER 75 14.056 13.740 -5.798 485 HB3 SER 75 HB3 SER 75 14.931 13.319 -4.326 486 HG SER 75 HG SER 75 12.496 12.901 -3.673 487 HA PRO 76 HA PRO 76 10.746 17.106 -6.285 488 HB2 PRO 76 HB2 PRO 76 11.011 16.654 -8.922 489 HB3 PRO 76 HB3 PRO 76 12.067 17.778 -8.062 490 HG2 PRO 76 HG2 PRO 76 12.592 14.961 -8.914 491 HG3 PRO 76 HG3 PRO 76 13.666 16.370 -8.979 492 HD2 PRO 76 HD2 PRO 76 13.768 14.448 -7.018 493 HD3 PRO 76 HD3 PRO 76 14.318 16.120 -6.798 494 H ASP 77 H ASP 77 10.767 14.197 -5.433 495 HA ASP 77 HA ASP 77 8.257 13.499 -6.724 496 HB2 ASP 77 HB2 ASP 77 8.999 11.136 -7.061 497 HB3 ASP 77 HB3 ASP 77 9.816 12.296 -8.103 498 H GLY 78 H GLY 78 10.641 12.760 -4.182 499 HA2 GLY 78 HA2 GLY 78 8.467 12.393 -2.287 500 HA3 GLY 78 HA3 GLY 78 9.420 10.953 -2.596 501 H CYS 79 H CYS 79 10.029 10.919 -0.366 502 HA CYS 79 HA CYS 79 12.318 12.645 0.205 503 HB2 CYS 79 HB2 CYS 79 9.987 12.275 2.088 504 HB3 CYS 79 HB3 CYS 79 11.541 12.959 2.562 505 H HIS 80 H HIS 80 13.869 11.754 1.667 506 HA HIS 80 HA HIS 80 13.495 8.898 2.305 507 HB2 HIS 80 HB2 HIS 80 14.578 9.101 0.057 508 HB3 HIS 80 HB3 HIS 80 15.905 9.966 0.828 509 HD1 HIS 80 HD1 HIS 80 14.142 6.627 1.384 510 HD2 HIS 80 HD2 HIS 80 17.941 8.310 1.411 511 HE1 HIS 80 HE1 HIS 80 15.714 4.731 1.894 512 HE2 HIS 80 HE2 HIS 80 18.013 5.755 1.807 513 H GLU 81 H GLU 81 14.216 8.439 4.295 514 HA GLU 81 HA GLU 81 15.095 10.354 6.075 515 HB2 GLU 81 HB2 GLU 81 15.066 7.380 6.069 516 HB3 GLU 81 HB3 GLU 81 16.044 8.170 7.298 517 HG2 GLU 81 HG2 GLU 81 14.085 9.419 8.055 518 HG3 GLU 81 HG3 GLU 81 13.105 8.624 6.825 519 H ASP 82 H ASP 82 16.948 11.270 6.586 520 HA ASP 82 HA ASP 82 19.464 10.038 5.782 521 HB2 ASP 82 HB2 ASP 82 20.100 11.685 4.312 522 HB3 ASP 82 HB3 ASP 82 18.351 11.788 4.082 523 HA PRO 83 HA PRO 83 20.197 11.592 9.943 524 HB2 PRO 83 HB2 PRO 83 22.644 10.093 10.024 525 HB3 PRO 83 HB3 PRO 83 21.107 9.727 10.805 526 HG2 PRO 83 HG2 PRO 83 22.200 8.242 8.765 527 HG3 PRO 83 HG3 PRO 83 20.472 8.289 9.154 528 HD2 PRO 83 HD2 PRO 83 21.975 9.750 7.016 529 HD3 PRO 83 HD3 PRO 83 20.371 8.988 6.947 530 H ALA 84 H ALA 84 22.374 11.893 7.256 531 HA ALA 84 HA ALA 84 24.479 13.260 8.524 532 HB1 ALA 84 HB1 ALA 84 23.554 13.498 5.665 533 HB2 ALA 84 HB2 ALA 84 24.671 12.285 6.290 534 HB3 ALA 84 HB3 ALA 84 25.126 13.989 6.295 535 H CYS 85 H CYS 85 21.477 14.427 7.066 536 HA CYS 85 HA CYS 85 22.162 17.183 7.810 537 HB2 CYS 85 HB2 CYS 85 19.828 16.149 6.195 538 HB3 CYS 85 HB3 CYS 85 20.230 17.841 6.458 539 H ASP 86 H ASP 86 21.069 14.837 9.564 540 HA ASP 86 HA ASP 86 18.470 15.599 10.372 541 HB2 ASP 86 HB2 ASP 86 20.083 13.467 10.891 542 HB3 ASP 86 HB3 ASP 86 20.172 14.334 12.422 543 HA PRO 87 HA PRO 87 20.378 18.227 13.743 544 HB2 PRO 87 HB2 PRO 87 22.880 17.747 14.607 545 HB3 PRO 87 HB3 PRO 87 21.545 16.655 14.985 546 HG2 PRO 87 HG2 PRO 87 23.843 16.220 13.229 547 HG3 PRO 87 HG3 PRO 87 22.688 15.040 13.869 548 HD2 PRO 87 HD2 PRO 87 22.722 16.375 11.261 549 HD3 PRO 87 HD3 PRO 87 21.796 14.951 11.784 550 H GLU 88 H GLU 88 22.061 19.575 14.432 551 HA GLU 88 HA GLU 88 22.683 21.701 12.779 552 HB2 GLU 88 HB2 GLU 88 24.249 22.491 14.545 553 HB3 GLU 88 HB3 GLU 88 22.671 22.015 15.162 554 HG2 GLU 88 HG2 GLU 88 23.866 19.713 15.538 555 HG3 GLU 88 HG3 GLU 88 25.319 20.708 15.502 556 H ALA 89 H ALA 89 23.778 19.099 11.714 557 HA ALA 89 HA ALA 89 26.610 19.577 11.432 558 HB1 ALA 89 HB1 ALA 89 24.657 17.530 10.414 559 HB2 ALA 89 HB2 ALA 89 26.201 17.292 11.249 560 HB3 ALA 89 HB3 ALA 89 26.184 17.776 9.554 561 H ALA 90 H ALA 90 24.227 21.378 10.670 562 HA ALA 90 HA ALA 90 24.424 21.750 7.831 563 HB1 ALA 90 HB1 ALA 90 22.664 22.543 9.893 564 HB2 ALA 90 HB2 ALA 90 22.494 22.803 8.158 565 HB3 ALA 90 HB3 ALA 90 23.296 24.016 9.157 566 H PHE 91 H PHE 91 25.483 23.259 6.742 567 HA PHE 91 HA PHE 91 27.594 24.783 8.092 568 HB2 PHE 91 HB2 PHE 91 28.169 23.197 6.202 569 HB3 PHE 91 HB3 PHE 91 27.276 24.272 5.130 570 HD1 PHE 91 HD1 PHE 91 30.053 24.294 7.599 571 HD2 PHE 91 HD2 PHE 91 28.382 26.007 4.082 572 HE1 PHE 91 HE1 PHE 91 32.072 25.669 7.316 573 HE2 PHE 91 HE2 PHE 91 30.400 27.386 3.789 574 HZ PHE 91 HZ PHE 91 32.248 27.218 5.409 575 H SER 92 H SER 92 26.692 26.713 8.707 576 HA SER 92 HA SER 92 25.854 28.507 6.590 577 HB2 SER 92 HB2 SER 92 24.001 27.996 8.929 578 HB3 SER 92 HB3 SER 92 23.728 29.109 7.588 579 HG SER 92 HG SER 92 23.541 27.370 6.206 580 H1 ALA 101 H1 ALA 101 -13.369 5.850 13.403 581 H2 ALA 101 H2 ALA 101 -13.960 7.459 13.501 582 H3 ALA 101 H3 ALA 101 -15.006 6.185 13.021 583 HA ALA 101 HA ALA 101 -14.186 7.043 15.622 584 HB1 ALA 101 HB1 ALA 101 -16.508 5.564 14.410 585 HB2 ALA 101 HB2 ALA 101 -16.472 7.207 15.051 586 HB3 ALA 101 HB3 ALA 101 -16.352 5.831 16.147 587 H VAL 102 H VAL 102 -12.465 5.065 14.245 588 HA VAL 102 HA VAL 102 -11.809 3.411 16.370 589 HB VAL 102 HB VAL 102 -12.655 1.148 15.101 590 HG11 VAL 102 HG11 VAL 102 -13.240 0.788 17.190 591 HG12 VAL 102 HG12 VAL 102 -14.688 1.763 16.943 592 HG13 VAL 102 HG13 VAL 102 -13.205 2.519 17.525 593 HG21 VAL 102 HG21 VAL 102 -15.164 1.475 14.842 594 HG22 VAL 102 HG22 VAL 102 -14.125 1.999 13.518 595 HG23 VAL 102 HG23 VAL 102 -14.795 3.187 14.636 596 H LEU 103 H LEU 103 -10.890 1.207 15.492 597 HA LEU 103 HA LEU 103 -8.978 1.755 13.263 598 HB2 LEU 103 HB2 LEU 103 -7.981 1.344 15.577 599 HB3 LEU 103 HB3 LEU 103 -8.606 -0.295 15.435 600 HG LEU 103 HG LEU 103 -7.339 -0.503 13.277 601 HD11 LEU 103 HD11 LEU 103 -5.728 1.844 14.174 602 HD12 LEU 103 HD12 LEU 103 -7.143 2.076 13.149 603 HD13 LEU 103 HD13 LEU 103 -5.804 1.074 12.590 604 HD21 LEU 103 HD21 LEU 103 -5.050 -0.448 14.558 605 HD22 LEU 103 HD22 LEU 103 -6.291 -1.643 14.936 606 HD23 LEU 103 HD23 LEU 103 -6.102 -0.215 15.954 607 H ASP 104 H ASP 104 -9.614 0.723 11.505 608 HA ASP 104 HA ASP 104 -11.333 -1.614 11.807 609 HB2 ASP 104 HB2 ASP 104 -11.409 0.467 10.019 610 HB3 ASP 104 HB3 ASP 104 -10.495 -0.724 9.102 611 H LEU 105 H LEU 105 -9.213 -2.680 12.884 612 HA LEU 105 HA LEU 105 -7.736 -3.795 10.683 613 HB2 LEU 105 HB2 LEU 105 -6.282 -2.056 11.258 614 HB3 LEU 105 HB3 LEU 105 -6.402 -2.465 12.952 615 HG LEU 105 HG LEU 105 -4.267 -3.112 11.574 616 HD11 LEU 105 HD11 LEU 105 -4.544 -3.692 13.886 617 HD12 LEU 105 HD12 LEU 105 -3.896 -5.073 13.002 618 HD13 LEU 105 HD13 LEU 105 -5.599 -5.038 13.458 619 HD21 LEU 105 HD21 LEU 105 -5.949 -4.457 9.980 620 HD22 LEU 105 HD22 LEU 105 -5.548 -5.737 11.125 621 HD23 LEU 105 HD23 LEU 105 -4.267 -4.925 10.226 622 H ASP 106 H ASP 106 -7.178 -3.866 13.883 623 HA ASP 106 HA ASP 106 -8.485 -5.671 15.201 624 HB2 ASP 106 HB2 ASP 106 -7.693 -7.070 13.035 625 HB3 ASP 106 HB3 ASP 106 -6.499 -7.608 14.230 626 H VAL 107 H VAL 107 -6.808 -3.619 15.580 627 HA VAL 107 HA VAL 107 -5.110 -4.475 17.683 628 HB VAL 107 HB VAL 107 -3.690 -4.566 15.536 629 HG11 VAL 107 HG11 VAL 107 -4.426 -2.491 14.487 630 HG12 VAL 107 HG12 VAL 107 -2.691 -2.456 14.802 631 HG13 VAL 107 HG13 VAL 107 -3.794 -1.567 15.850 632 HG21 VAL 107 HG21 VAL 107 -2.528 -2.717 17.569 633 HG22 VAL 107 HG22 VAL 107 -1.800 -4.109 16.767 634 HG23 VAL 107 HG23 VAL 107 -3.010 -4.350 18.028 635 H ARG 108 H ARG 108 -3.956 -2.302 18.435 636 HA ARG 108 HA ARG 108 -6.150 -0.569 18.972 637 HB2 ARG 108 HB2 ARG 108 -3.886 -1.355 20.455 638 HB3 ARG 108 HB3 ARG 108 -3.546 0.310 20.004 639 HG2 ARG 108 HG2 ARG 108 -5.470 1.106 21.123 640 HG3 ARG 108 HG3 ARG 108 -6.117 -0.523 21.318 641 HD2 ARG 108 HD2 ARG 108 -5.249 0.093 23.428 642 HD3 ARG 108 HD3 ARG 108 -4.084 -1.030 22.729 643 HE ARG 108 HE ARG 108 -2.552 0.697 22.541 644 HH11 ARG 108 HH11 ARG 108 -5.640 1.953 23.595 645 HH12 ARG 108 HH12 ARG 108 -4.997 3.498 24.040 646 HH21 ARG 108 HH21 ARG 108 -1.713 2.726 23.130 647 HH22 ARG 108 HH22 ARG 108 -2.771 3.937 23.776 648 H THR 109 H THR 109 -6.543 1.007 17.601 649 HA THR 109 HA THR 109 -5.335 1.481 15.288 650 HB THR 109 HB THR 109 -7.360 2.623 15.867 651 HG1 THR 109 HG1 THR 109 -6.227 3.651 14.255 652 HG21 THR 109 HG21 THR 109 -6.021 4.742 17.426 653 HG22 THR 109 HG22 THR 109 -6.345 3.217 18.251 654 HG23 THR 109 HG23 THR 109 -7.670 4.124 17.521 655 H CYS 110 H CYS 110 -3.418 1.605 14.829 656 HA CYS 110 HA CYS 110 -1.103 1.925 15.672 657 HB2 CYS 110 HB2 CYS 110 -1.940 3.797 13.485 658 HB3 CYS 110 HB3 CYS 110 -0.269 3.417 13.876 659 H LEU 111 H LEU 111 -0.033 3.065 17.267 660 HA LEU 111 HA LEU 111 -0.603 5.115 18.791 661 HB2 LEU 111 HB2 LEU 111 1.817 3.957 18.007 662 HB3 LEU 111 HB3 LEU 111 2.071 5.687 17.875 663 HG LEU 111 HG LEU 111 2.753 4.851 20.071 664 HD11 LEU 111 HD11 LEU 111 1.825 6.564 21.328 665 HD12 LEU 111 HD12 LEU 111 0.256 6.435 20.532 666 HD13 LEU 111 HD13 LEU 111 1.626 7.139 19.673 667 HD21 LEU 111 HD21 LEU 111 1.518 3.510 21.379 668 HD22 LEU 111 HD22 LEU 111 0.644 3.150 19.890 669 HD23 LEU 111 HD23 LEU 111 0.018 4.360 21.010 670 HA PRO 112 HA PRO 112 -1.676 8.590 16.206 671 HB2 PRO 112 HB2 PRO 112 -2.484 10.201 18.181 672 HB3 PRO 112 HB3 PRO 112 -3.397 8.767 17.695 673 HG2 PRO 112 HG2 PRO 112 -1.417 9.056 19.936 674 HG3 PRO 112 HG3 PRO 112 -3.083 8.437 20.005 675 HD2 PRO 112 HD2 PRO 112 -1.027 6.763 19.828 676 HD3 PRO 112 HD3 PRO 112 -2.524 6.461 18.920 677 H CYS 113 H CYS 113 -1.089 10.743 15.734 678 HA CYS 113 HA CYS 113 0.900 12.099 17.299 679 HB2 CYS 113 HB2 CYS 113 2.778 12.088 15.824 680 HB3 CYS 113 HB3 CYS 113 2.306 10.413 16.066 681 H GLY 114 H GLY 114 1.909 13.964 15.561 682 HA2 GLY 114 HA2 GLY 114 1.382 15.752 14.198 683 HA3 GLY 114 HA3 GLY 114 -0.065 14.895 13.712 684 HA PRO 115 HA PRO 115 -1.517 18.748 15.988 685 HB2 PRO 115 HB2 PRO 115 -3.539 19.273 14.354 686 HB3 PRO 115 HB3 PRO 115 -1.875 19.540 13.767 687 HG2 PRO 115 HG2 PRO 115 -3.360 16.969 13.754 688 HG3 PRO 115 HG3 PRO 115 -3.052 17.942 12.254 689 HD2 PRO 115 HD2 PRO 115 -1.270 16.158 12.778 690 HD3 PRO 115 HD3 PRO 115 -0.623 17.828 12.781 691 H GLY 116 H GLY 116 -2.246 17.748 17.693 692 HA2 GLY 116 HA2 GLY 116 -3.980 17.184 19.195 693 HA3 GLY 116 HA3 GLY 116 -4.971 16.802 17.797 694 H GLY 117 H GLY 117 -2.160 15.460 17.188 695 HA2 GLY 117 HA2 GLY 117 -1.225 13.435 17.265 696 HA3 GLY 117 HA3 GLY 117 -1.989 13.326 18.817 697 H LYS 118 H LYS 118 -3.495 13.682 15.755 698 HA LYS 118 HA LYS 118 -5.090 11.290 16.235 699 HB2 LYS 118 HB2 LYS 118 -5.527 12.572 13.659 700 HB3 LYS 118 HB3 LYS 118 -6.672 12.279 14.955 701 HG2 LYS 118 HG2 LYS 118 -5.001 14.414 15.763 702 HG3 LYS 118 HG3 LYS 118 -5.507 14.733 14.111 703 HD2 LYS 118 HD2 LYS 118 -7.805 14.614 14.712 704 HD3 LYS 118 HD3 LYS 118 -7.411 13.947 16.299 705 HE2 LYS 118 HE2 LYS 118 -7.507 16.035 17.070 706 HE3 LYS 118 HE3 LYS 118 -5.994 16.317 16.211 707 HZ1 LYS 118 HZ1 LYS 118 -7.343 16.962 14.256 708 HZ2 LYS 118 HZ2 LYS 118 -7.550 17.989 15.584 709 HZ3 LYS 118 HZ3 LYS 118 -8.736 16.844 15.210 710 H GLY 119 H GLY 119 -2.542 12.482 14.268 711 HA2 GLY 119 HA2 GLY 119 -2.623 10.697 12.088 712 HA3 GLY 119 HA3 GLY 119 -1.184 11.547 12.637 713 H ARG 120 H ARG 120 0.079 9.411 12.078 714 HA ARG 120 HA ARG 120 0.032 7.770 14.393 715 HB2 ARG 120 HB2 ARG 120 -0.825 6.796 11.684 716 HB3 ARG 120 HB3 ARG 120 -0.059 5.701 12.825 717 HG2 ARG 120 HG2 ARG 120 -1.848 5.929 14.362 718 HG3 ARG 120 HG3 ARG 120 -2.532 7.286 13.464 719 HD2 ARG 120 HD2 ARG 120 -2.225 4.565 12.229 720 HD3 ARG 120 HD3 ARG 120 -3.640 4.990 13.192 721 HE ARG 120 HE ARG 120 -2.913 6.065 10.576 722 HH11 ARG 120 HH11 ARG 120 -5.110 6.094 13.297 723 HH12 ARG 120 HH12 ARG 120 -6.365 6.915 12.431 724 HH21 ARG 120 HH21 ARG 120 -4.566 7.139 9.443 725 HH22 ARG 120 HH22 ARG 120 -6.057 7.507 10.245 726 H CYS 121 H CYS 121 1.837 6.076 14.062 727 HA CYS 121 HA CYS 121 4.026 7.487 12.695 728 HB2 CYS 121 HB2 CYS 121 3.850 5.821 15.142 729 HB3 CYS 121 HB3 CYS 121 5.352 5.750 14.219 730 H PHE 122 H PHE 122 5.235 6.635 11.191 731 HA PHE 122 HA PHE 122 5.152 3.787 10.580 732 HB2 PHE 122 HB2 PHE 122 4.237 5.990 8.742 733 HB3 PHE 122 HB3 PHE 122 4.880 4.484 8.096 734 HD1 PHE 122 HD1 PHE 122 2.108 6.051 9.900 735 HD2 PHE 122 HD2 PHE 122 3.656 2.419 8.300 736 HE1 PHE 122 HE1 PHE 122 -0.109 5.000 10.135 737 HE2 PHE 122 HE2 PHE 122 1.445 1.367 8.532 738 HZ PHE 122 HZ PHE 122 -0.440 2.657 9.452 739 H GLY 123 H GLY 123 7.165 5.335 11.750 740 HA2 GLY 123 HA2 GLY 123 9.511 4.646 10.845 741 HA3 GLY 123 HA3 GLY 123 9.121 5.849 9.622 742 HA PRO 124 HA PRO 124 10.986 7.768 13.602 743 HB2 PRO 124 HB2 PRO 124 13.345 8.356 11.932 744 HB3 PRO 124 HB3 PRO 124 13.263 7.679 13.561 745 HG2 PRO 124 HG2 PRO 124 13.951 6.167 11.458 746 HG3 PRO 124 HG3 PRO 124 12.982 5.515 12.793 747 HD2 PRO 124 HD2 PRO 124 12.086 6.454 10.084 748 HD3 PRO 124 HD3 PRO 124 11.588 5.010 10.998 749 H SER 125 H SER 125 12.208 9.037 10.482 750 HA SER 125 HA SER 125 11.130 11.657 11.173 751 HB2 SER 125 HB2 SER 125 13.093 10.659 9.127 752 HB3 SER 125 HB3 SER 125 12.267 12.202 8.798 753 HG SER 125 HG SER 125 13.026 12.844 10.935 754 H ILE 126 H ILE 126 9.172 9.668 10.686 755 HA ILE 126 HA ILE 126 7.735 10.927 8.559 756 HB ILE 126 HB ILE 126 7.825 7.958 8.297 757 HG12 ILE 126 HG12 ILE 126 9.623 9.339 6.446 758 HG13 ILE 126 HG13 ILE 126 10.195 9.408 8.112 759 HG21 ILE 126 HG21 ILE 126 6.775 8.385 6.365 760 HG22 ILE 126 HG22 ILE 126 7.768 9.801 6.022 761 HG23 ILE 126 HG23 ILE 126 6.425 9.922 7.155 762 HD11 ILE 126 HD11 ILE 126 10.347 7.256 6.248 763 HD12 ILE 126 HD12 ILE 126 9.363 6.750 7.621 764 HD13 ILE 126 HD13 ILE 126 10.999 7.353 7.883 765 H CYS 127 H CYS 127 5.724 11.244 9.270 766 HA CYS 127 HA CYS 127 4.465 9.197 10.990 767 HB2 CYS 127 HB2 CYS 127 5.033 11.856 11.738 768 HB3 CYS 127 HB3 CYS 127 3.308 11.816 11.399 769 H CYS 128 H CYS 128 2.681 8.342 9.958 770 HA CYS 128 HA CYS 128 1.484 9.992 7.834 771 HB2 CYS 128 HB2 CYS 128 1.890 7.036 8.160 772 HB3 CYS 128 HB3 CYS 128 0.542 7.581 7.182 773 H GLY 129 H GLY 129 -0.653 10.161 7.607 774 HA2 GLY 129 HA2 GLY 129 -2.540 9.035 9.546 775 HA3 GLY 129 HA3 GLY 129 -2.593 10.748 9.147 776 H ASP 130 H ASP 130 -4.696 9.201 8.941 777 HA ASP 130 HA ASP 130 -5.333 8.196 6.372 778 HB2 ASP 130 HB2 ASP 130 -7.666 8.210 7.231 779 HB3 ASP 130 HB3 ASP 130 -6.552 7.396 8.326 780 H GLU 131 H GLU 131 -5.103 11.149 7.693 781 HA GLU 131 HA GLU 131 -6.141 12.454 5.414 782 HB2 GLU 131 HB2 GLU 131 -7.362 14.242 7.049 783 HB3 GLU 131 HB3 GLU 131 -8.228 12.975 6.199 784 HG2 GLU 131 HG2 GLU 131 -8.193 11.585 8.194 785 HG3 GLU 131 HG3 GLU 131 -7.248 12.803 9.047 786 H LEU 132 H LEU 132 -3.602 12.030 7.297 787 HA LEU 132 HA LEU 132 -2.967 14.755 7.482 788 HB2 LEU 132 HB2 LEU 132 -3.151 12.692 9.387 789 HB3 LEU 132 HB3 LEU 132 -1.461 12.939 9.051 790 HG LEU 132 HG LEU 132 -3.363 15.093 9.969 791 HD11 LEU 132 HD11 LEU 132 -2.897 13.214 11.608 792 HD12 LEU 132 HD12 LEU 132 -2.523 14.850 12.150 793 HD13 LEU 132 HD13 LEU 132 -1.226 13.779 11.621 794 HD21 LEU 132 HD21 LEU 132 -1.187 15.608 8.617 795 HD22 LEU 132 HD22 LEU 132 -0.394 15.263 10.154 796 HD23 LEU 132 HD23 LEU 132 -1.596 16.550 10.051 797 H GLY 133 H GLY 133 -2.678 11.796 5.985 798 HA2 GLY 133 HA2 GLY 133 -1.262 10.902 4.523 799 HA3 GLY 133 HA3 GLY 133 -0.762 12.535 4.322 800 H CYS 134 H CYS 134 1.535 12.869 4.743 801 HA CYS 134 HA CYS 134 2.649 11.465 7.025 802 HB2 CYS 134 HB2 CYS 134 2.913 10.318 4.558 803 HB3 CYS 134 HB3 CYS 134 4.438 11.128 4.874 804 H PHE 135 H PHE 135 3.761 12.536 8.205 805 HA PHE 135 HA PHE 135 5.020 14.910 7.042 806 HB2 PHE 135 HB2 PHE 135 5.517 14.812 9.842 807 HB3 PHE 135 HB3 PHE 135 4.520 15.970 8.983 808 HD1 PHE 135 HD1 PHE 135 2.129 14.493 8.285 809 HD2 PHE 135 HD2 PHE 135 4.516 14.262 11.802 810 HE1 PHE 135 HE1 PHE 135 0.170 13.731 9.564 811 HE2 PHE 135 HE2 PHE 135 2.562 13.495 13.084 812 HZ PHE 135 HZ PHE 135 0.385 13.228 11.965 813 H VAL 136 H VAL 136 6.750 14.120 6.123 814 HA VAL 136 HA VAL 136 8.263 12.092 7.522 815 HB VAL 136 HB VAL 136 9.070 13.172 4.831 816 HG11 VAL 136 HG11 VAL 136 10.491 11.452 4.854 817 HG12 VAL 136 HG12 VAL 136 9.212 10.315 5.280 818 HG13 VAL 136 HG13 VAL 136 10.052 11.213 6.545 819 HG21 VAL 136 HG21 VAL 136 6.688 12.676 4.563 820 HG22 VAL 136 HG22 VAL 136 6.900 11.099 5.320 821 HG23 VAL 136 HG23 VAL 136 7.635 11.429 3.751 822 H GLY 137 H GLY 137 8.856 13.217 9.163 823 HA2 GLY 137 HA2 GLY 137 10.731 14.175 10.276 824 HA3 GLY 137 HA3 GLY 137 11.264 14.865 8.755 825 H THR 138 H THR 138 8.967 15.198 11.388 826 HA THR 138 HA THR 138 9.116 18.087 11.175 827 HB THR 138 HB THR 138 6.695 18.408 11.182 828 HG1 THR 138 HG1 THR 138 5.706 16.702 11.959 829 HG21 THR 138 HG21 THR 138 7.235 18.560 8.992 830 HG22 THR 138 HG22 THR 138 6.218 17.122 8.910 831 HG23 THR 138 HG23 THR 138 7.974 16.960 8.945 832 H ALA 139 H ALA 139 7.572 18.973 13.239 833 HA ALA 139 HA ALA 139 8.843 17.855 15.515 834 HB1 ALA 139 HB1 ALA 139 6.492 19.730 15.261 835 HB2 ALA 139 HB2 ALA 139 8.179 20.167 15.528 836 HB3 ALA 139 HB3 ALA 139 7.279 19.319 16.785 837 H GLU 140 H GLU 140 5.594 17.530 14.102 838 HA GLU 140 HA GLU 140 4.381 15.984 16.027 839 HB2 GLU 140 HB2 GLU 140 4.072 15.576 13.047 840 HB3 GLU 140 HB3 GLU 140 2.875 15.252 14.292 841 HG2 GLU 140 HG2 GLU 140 2.317 17.454 14.526 842 HG3 GLU 140 HG3 GLU 140 3.901 18.026 14.008 843 H ALA 141 H ALA 141 6.919 15.186 14.028 844 HA ALA 141 HA ALA 141 6.612 12.312 14.117 845 HB1 ALA 141 HB1 ALA 141 7.710 13.706 12.194 846 HB2 ALA 141 HB2 ALA 141 8.315 12.103 12.609 847 HB3 ALA 141 HB3 ALA 141 9.160 13.542 13.187 848 H LEU 142 H LEU 142 8.104 14.807 15.973 849 HA LEU 142 HA LEU 142 10.190 13.442 17.242 850 HB2 LEU 142 HB2 LEU 142 8.346 15.653 18.023 851 HB3 LEU 142 HB3 LEU 142 9.288 14.899 19.293 852 HG LEU 142 HG LEU 142 10.857 15.677 16.934 853 HD11 LEU 142 HD11 LEU 142 8.939 17.483 17.558 854 HD12 LEU 142 HD12 LEU 142 10.524 17.898 16.902 855 HD13 LEU 142 HD13 LEU 142 10.237 17.986 18.641 856 HD21 LEU 142 HD21 LEU 142 11.881 14.853 18.977 857 HD22 LEU 142 HD22 LEU 142 11.132 16.156 19.899 858 HD23 LEU 142 HD23 LEU 142 12.355 16.526 18.683 859 H ARG 143 H ARG 143 6.733 13.429 17.801 860 HA ARG 143 HA ARG 143 6.699 11.759 20.098 861 HB2 ARG 143 HB2 ARG 143 4.777 13.155 19.526 862 HB3 ARG 143 HB3 ARG 143 4.601 12.339 17.983 863 HG2 ARG 143 HG2 ARG 143 4.378 10.716 20.477 864 HG3 ARG 143 HG3 ARG 143 3.042 11.780 20.028 865 HD2 ARG 143 HD2 ARG 143 2.316 10.302 18.550 866 HD3 ARG 143 HD3 ARG 143 3.867 10.338 17.713 867 HE ARG 143 HE ARG 143 4.100 8.709 19.983 868 HH11 ARG 143 HH11 ARG 143 2.376 8.676 16.948 869 HH12 ARG 143 HH12 ARG 143 2.553 6.967 16.728 870 HH21 ARG 143 HH21 ARG 143 4.366 6.479 19.674 871 HH22 ARG 143 HH22 ARG 143 3.685 5.720 18.274 872 H CYS 144 H CYS 144 7.819 10.992 16.927 873 HA CYS 144 HA CYS 144 6.624 8.355 16.855 874 HB2 CYS 144 HB2 CYS 144 7.880 10.193 15.038 875 HB3 CYS 144 HB3 CYS 144 8.805 8.701 15.059 876 H GLN 145 H GLN 145 8.397 9.410 18.958 877 HA GLN 145 HA GLN 145 10.850 7.783 18.704 878 HB2 GLN 145 HB2 GLN 145 10.802 10.018 19.998 879 HB3 GLN 145 HB3 GLN 145 10.037 9.095 21.286 880 HG2 GLN 145 HG2 GLN 145 12.067 8.559 21.996 881 HG3 GLN 145 HG3 GLN 145 12.245 7.574 20.546 882 HE21 GLN 145 HE21 GLN 145 12.688 10.851 21.783 883 HE22 GLN 145 HE22 GLN 145 14.042 11.239 20.782 884 H GLU 146 H GLU 146 7.662 7.677 20.047 885 HA GLU 146 HA GLU 146 8.231 5.302 21.620 886 HB2 GLU 146 HB2 GLU 146 5.644 6.732 20.998 887 HB3 GLU 146 HB3 GLU 146 5.773 5.333 22.056 888 HG2 GLU 146 HG2 GLU 146 6.855 6.511 23.709 889 HG3 GLU 146 HG3 GLU 146 7.445 7.742 22.593 890 H GLU 147 H GLU 147 8.034 5.786 18.429 891 HA GLU 147 HA GLU 147 6.335 3.553 17.717 892 HB2 GLU 147 HB2 GLU 147 6.822 5.698 16.317 893 HB3 GLU 147 HB3 GLU 147 8.303 4.866 15.862 894 HG2 GLU 147 HG2 GLU 147 5.966 3.178 15.571 895 HG3 GLU 147 HG3 GLU 147 5.848 4.659 14.623 896 H ASN 148 H ASN 148 9.215 3.751 19.198 897 HA ASN 148 HA ASN 148 10.519 1.581 17.723 898 HB2 ASN 148 HB2 ASN 148 11.706 3.688 18.705 899 HB3 ASN 148 HB3 ASN 148 11.587 2.833 20.241 900 HD21 ASN 148 HD21 ASN 148 13.414 1.886 20.733 901 HD22 ASN 148 HD22 ASN 148 14.482 1.084 19.638 902 H TYR 149 H TYR 149 8.679 2.225 20.612 903 HA TYR 149 HA TYR 149 9.161 -0.537 21.528 904 HB2 TYR 149 HB2 TYR 149 8.120 1.826 23.102 905 HB3 TYR 149 HB3 TYR 149 8.406 0.211 23.740 906 HD1 TYR 149 HD1 TYR 149 10.827 -0.690 23.577 907 HD2 TYR 149 HD2 TYR 149 9.817 3.422 23.166 908 HE1 TYR 149 HE1 TYR 149 13.148 -0.073 24.102 909 HE2 TYR 149 HE2 TYR 149 12.136 4.051 23.688 910 HH TYR 149 HH TYR 149 14.604 2.370 23.415 911 H LEU 150 H LEU 150 7.064 0.870 19.594 912 HA LEU 150 HA LEU 150 4.873 -0.854 20.461 913 HB2 LEU 150 HB2 LEU 150 4.830 1.937 20.855 914 HB3 LEU 150 HB3 LEU 150 3.761 1.619 19.501 915 HG LEU 150 HG LEU 150 3.286 -0.235 21.682 916 HD11 LEU 150 HD11 LEU 150 3.383 2.685 22.275 917 HD12 LEU 150 HD12 LEU 150 3.815 1.311 23.294 918 HD13 LEU 150 HD13 LEU 150 2.118 1.696 23.005 919 HD21 LEU 150 HD21 LEU 150 1.180 1.645 21.030 920 HD22 LEU 150 HD22 LEU 150 1.226 -0.108 20.847 921 HD23 LEU 150 HD23 LEU 150 1.900 0.927 19.589 922 HA PRO 151 HA PRO 151 5.273 -0.927 15.881 923 HB2 PRO 151 HB2 PRO 151 6.151 -3.421 15.539 924 HB3 PRO 151 HB3 PRO 151 7.238 -2.143 16.091 925 HG2 PRO 151 HG2 PRO 151 6.048 -4.391 17.608 926 HG3 PRO 151 HG3 PRO 151 7.569 -3.525 17.882 927 HD2 PRO 151 HD2 PRO 151 5.049 -3.117 19.186 928 HD3 PRO 151 HD3 PRO 151 6.560 -2.220 19.432 929 H SER 152 H SER 152 2.803 -1.084 17.130 930 HA SER 152 HA SER 152 1.532 -3.598 16.482 931 HB2 SER 152 HB2 SER 152 0.375 -0.981 17.468 932 HB3 SER 152 HB3 SER 152 -0.524 -2.490 17.310 933 HG SER 152 HG SER 152 1.378 -1.733 19.188 934 HA PRO 153 HA PRO 153 0.519 -2.093 12.341 935 HB2 PRO 153 HB2 PRO 153 -0.257 -4.424 11.289 936 HB3 PRO 153 HB3 PRO 153 1.446 -4.113 11.643 937 HG2 PRO 153 HG2 PRO 153 -0.555 -5.695 13.206 938 HG3 PRO 153 HG3 PRO 153 1.141 -6.070 12.857 939 HD2 PRO 153 HD2 PRO 153 0.239 -4.978 15.223 940 HD3 PRO 153 HD3 PRO 153 1.897 -4.819 14.612 941 H CYS 154 H CYS 154 -1.334 -0.974 12.030 942 HA CYS 154 HA CYS 154 -3.881 -2.250 12.804 943 HB2 CYS 154 HB2 CYS 154 -4.705 -0.192 13.586 944 HB3 CYS 154 HB3 CYS 154 -3.052 -0.254 14.179 945 H GLN 155 H GLN 155 -5.593 -0.227 11.751 946 HA GLN 155 HA GLN 155 -5.841 -1.107 9.057 947 HB2 GLN 155 HB2 GLN 155 -7.535 0.628 8.812 948 HB3 GLN 155 HB3 GLN 155 -7.719 -0.189 10.357 949 HG2 GLN 155 HG2 GLN 155 -7.821 1.843 11.245 950 HG3 GLN 155 HG3 GLN 155 -6.079 1.920 10.983 951 HE21 GLN 155 HE21 GLN 155 -8.665 3.728 10.728 952 HE22 GLN 155 HE22 GLN 155 -8.312 4.646 9.307 953 H SER 156 H SER 156 -4.794 -0.511 7.221 954 HA SER 156 HA SER 156 -3.785 2.191 6.921 955 HB2 SER 156 HB2 SER 156 -1.989 -0.197 7.207 956 HB3 SER 156 HB3 SER 156 -1.494 1.167 6.203 957 HG SER 156 HG SER 156 -0.775 1.400 8.357 958 H GLY 157 H GLY 157 -2.002 1.433 4.610 959 HA2 GLY 157 HA2 GLY 157 -4.045 0.386 2.794 960 HA3 GLY 157 HA3 GLY 157 -3.104 1.825 2.403 961 H GLN 158 H GLN 158 -3.281 -1.108 1.418 962 HA GLN 158 HA GLN 158 -0.405 -1.652 1.520 963 HB2 GLN 158 HB2 GLN 158 -2.399 -3.355 2.190 964 HB3 GLN 158 HB3 GLN 158 -2.266 -3.717 0.476 965 HG2 GLN 158 HG2 GLN 158 -0.501 -4.987 0.850 966 HG3 GLN 158 HG3 GLN 158 0.348 -3.637 1.600 967 HE21 GLN 158 HE21 GLN 158 -1.984 -6.207 2.243 968 HE22 GLN 158 HE22 GLN 158 -1.569 -6.412 3.907 969 H LYS 159 H LYS 159 -0.498 0.162 -0.017 970 HA LYS 159 HA LYS 159 -0.895 -0.824 -2.747 971 HB2 LYS 159 HB2 LYS 159 -1.824 1.550 -1.542 972 HB3 LYS 159 HB3 LYS 159 -0.587 2.011 -2.707 973 HG2 LYS 159 HG2 LYS 159 -2.251 0.038 -3.901 974 HG3 LYS 159 HG3 LYS 159 -3.277 1.286 -3.188 975 HD2 LYS 159 HD2 LYS 159 -2.328 2.976 -4.484 976 HD3 LYS 159 HD3 LYS 159 -0.897 2.014 -4.857 977 HE2 LYS 159 HE2 LYS 159 -2.380 0.475 -6.159 978 HE3 LYS 159 HE3 LYS 159 -3.694 1.625 -5.910 979 HZ1 LYS 159 HZ1 LYS 159 -2.970 2.716 -7.679 980 HZ2 LYS 159 HZ2 LYS 159 -1.635 1.688 -7.836 981 HZ3 LYS 159 HZ3 LYS 159 -1.527 3.070 -6.867 982 HA PRO 160 HA PRO 160 3.649 -0.264 -1.846 983 HB2 PRO 160 HB2 PRO 160 4.489 -2.485 -3.174 984 HB3 PRO 160 HB3 PRO 160 4.083 -2.457 -1.455 985 HG2 PRO 160 HG2 PRO 160 2.425 -3.349 -3.781 986 HG3 PRO 160 HG3 PRO 160 2.600 -4.094 -2.181 987 HD2 PRO 160 HD2 PRO 160 0.456 -2.595 -2.813 988 HD3 PRO 160 HD3 PRO 160 1.149 -2.584 -1.181 989 H CYS 161 H CYS 161 3.215 1.474 -3.289 990 HA CYS 161 HA CYS 161 3.914 0.992 -6.072 991 HB2 CYS 161 HB2 CYS 161 2.847 2.920 -6.662 992 HB3 CYS 161 HB3 CYS 161 1.964 2.595 -5.184 993 H GLY 162 H GLY 162 5.329 3.430 -6.540 994 HA2 GLY 162 HA2 GLY 162 7.528 4.185 -6.394 995 HA3 GLY 162 HA3 GLY 162 7.298 3.957 -4.669 996 H SER 163 H SER 163 9.566 3.593 -4.806 997 HA SER 163 HA SER 163 10.612 1.129 -5.934 998 HB2 SER 163 HB2 SER 163 11.809 3.515 -4.557 999 HB3 SER 163 HB3 SER 163 12.745 2.027 -4.698 1000 HG SER 163 HG SER 163 12.034 2.235 -7.046 1001 H GLY 164 H GLY 164 8.668 0.692 -4.135 1002 HA2 GLY 164 HA2 GLY 164 8.711 -1.287 -2.717 1003 HA3 GLY 164 HA3 GLY 164 10.028 -0.534 -1.842 1004 H GLY 165 H GLY 165 7.674 1.899 -2.490 1005 HA2 GLY 165 HA2 GLY 165 6.796 1.551 0.298 1006 HA3 GLY 165 HA3 GLY 165 6.727 3.043 -0.602 1007 H ARG 166 H ARG 166 4.849 1.092 1.003 1008 HA ARG 166 HA ARG 166 2.620 0.919 -0.886 1009 HB2 ARG 166 HB2 ARG 166 1.388 -0.186 0.977 1010 HB3 ARG 166 HB3 ARG 166 2.820 -1.049 0.463 1011 HG2 ARG 166 HG2 ARG 166 2.053 -0.332 3.063 1012 HG3 ARG 166 HG3 ARG 166 3.534 -1.130 2.559 1013 HD2 ARG 166 HD2 ARG 166 4.702 0.954 2.470 1014 HD3 ARG 166 HD3 ARG 166 3.206 1.867 2.671 1015 HE ARG 166 HE ARG 166 3.092 0.934 4.945 1016 HH11 ARG 166 HH11 ARG 166 6.184 0.906 3.313 1017 HH12 ARG 166 HH12 ARG 166 7.096 0.831 4.783 1018 HH21 ARG 166 HH21 ARG 166 4.297 0.829 6.873 1019 HH22 ARG 166 HH22 ARG 166 6.026 0.787 6.801 1020 H CYS 167 H CYS 167 0.487 1.958 -0.294 1021 HA CYS 167 HA CYS 167 0.892 4.600 0.426 1022 HB2 CYS 167 HB2 CYS 167 -1.593 2.946 -0.006 1023 HB3 CYS 167 HB3 CYS 167 -1.665 4.656 0.413 1024 H ALA 168 H ALA 168 1.443 5.187 2.371 1025 HA ALA 168 HA ALA 168 0.368 3.748 4.690 1026 HB1 ALA 168 HB1 ALA 168 1.938 5.067 6.005 1027 HB2 ALA 168 HB2 ALA 168 2.363 6.012 4.577 1028 HB3 ALA 168 HB3 ALA 168 2.763 4.296 4.649 1029 H ALA 169 H ALA 169 -0.015 6.462 2.819 1030 HA ALA 169 HA ALA 169 -2.410 7.367 4.320 1031 HB1 ALA 169 HB1 ALA 169 -0.304 9.430 3.805 1032 HB2 ALA 169 HB2 ALA 169 -0.261 8.441 5.264 1033 HB3 ALA 169 HB3 ALA 169 -1.659 9.463 4.933 1034 H ALA 170 H ALA 170 -3.603 9.078 3.179 1035 HA ALA 170 HA ALA 170 -3.984 8.478 0.499 1036 HB1 ALA 170 HB1 ALA 170 -5.627 10.123 0.457 1037 HB2 ALA 170 HB2 ALA 170 -4.797 11.117 1.654 1038 HB3 ALA 170 HB3 ALA 170 -5.572 9.611 2.143 1039 H GLY 171 H GLY 171 -2.837 8.887 -1.233 1040 HA2 GLY 171 HA2 GLY 171 -1.673 10.020 -2.833 1041 HA3 GLY 171 HA3 GLY 171 -2.000 11.481 -1.944 1042 H ILE 172 H ILE 172 -0.482 9.066 -0.239 1043 HA ILE 172 HA ILE 172 2.257 10.040 -0.826 1044 HB ILE 172 HB ILE 172 2.803 10.432 1.443 1045 HG12 ILE 172 HG12 ILE 172 0.440 10.572 2.849 1046 HG13 ILE 172 HG13 ILE 172 0.304 9.053 1.947 1047 HG21 ILE 172 HG21 ILE 172 0.262 11.947 1.138 1048 HG22 ILE 172 HG22 ILE 172 1.506 12.106 -0.101 1049 HG23 ILE 172 HG23 ILE 172 1.874 12.513 1.575 1050 HD11 ILE 172 HD11 ILE 172 2.941 9.436 2.943 1051 HD12 ILE 172 HD12 ILE 172 1.820 8.083 3.211 1052 HD13 ILE 172 HD13 ILE 172 1.757 9.504 4.262 1053 H CYS 173 H CYS 173 3.108 8.310 -1.621 1054 HA CYS 173 HA CYS 173 2.674 5.656 -0.552 1055 HB2 CYS 173 HB2 CYS 173 3.426 6.788 -3.030 1056 HB3 CYS 173 HB3 CYS 173 4.790 5.817 -2.498 1057 H CYS 174 H CYS 174 3.641 5.672 1.482 1058 HA CYS 174 HA CYS 174 6.475 6.346 1.613 1059 HB2 CYS 174 HB2 CYS 174 4.451 5.778 3.776 1060 HB3 CYS 174 HB3 CYS 174 6.149 6.132 4.080 1061 H SER 175 H SER 175 7.992 5.019 2.582 1062 HA SER 175 HA SER 175 7.396 2.140 2.661 1063 HB2 SER 175 HB2 SER 175 9.680 1.770 1.660 1064 HB3 SER 175 HB3 SER 175 8.529 2.520 0.555 1065 HG SER 175 HG SER 175 9.492 4.523 1.003 1066 HA PRO 176 HA PRO 176 9.792 2.199 6.386 1067 HB2 PRO 176 HB2 PRO 176 11.587 0.200 6.290 1068 HB3 PRO 176 HB3 PRO 176 9.848 -0.114 6.331 1069 HG2 PRO 176 HG2 PRO 176 11.725 -0.149 4.003 1070 HG3 PRO 176 HG3 PRO 176 10.403 -1.263 4.394 1071 HD2 PRO 176 HD2 PRO 176 10.201 0.782 2.570 1072 HD3 PRO 176 HD3 PRO 176 8.821 0.095 3.448 1073 H ASP 177 H ASP 177 10.899 3.770 4.043 1074 HA ASP 177 HA ASP 177 13.425 4.447 5.315 1075 HB2 ASP 177 HB2 ASP 177 14.600 4.533 3.110 1076 HB3 ASP 177 HB3 ASP 177 14.176 2.905 3.630 1077 H GLY 178 H GLY 178 10.991 5.251 2.842 1078 HA2 GLY 178 HA2 GLY 178 11.127 8.039 3.654 1079 HA3 GLY 178 HA3 GLY 178 11.651 7.731 2.009 1080 H CYS 179 H CYS 179 9.938 9.075 1.244 1081 HA CYS 179 HA CYS 179 7.404 7.638 1.012 1082 HB2 CYS 179 HB2 CYS 179 7.628 10.517 1.898 1083 HB3 CYS 179 HB3 CYS 179 6.130 9.769 1.350 1084 H HIS 180 H HIS 180 6.096 8.315 -0.856 1085 HA HIS 180 HA HIS 180 7.540 9.853 -2.908 1086 HB2 HIS 180 HB2 HIS 180 8.359 7.483 -3.062 1087 HB3 HIS 180 HB3 HIS 180 6.699 6.976 -3.361 1088 HD1 HIS 180 HD1 HIS 180 9.140 9.463 -4.904 1089 HD2 HIS 180 HD2 HIS 180 6.177 6.769 -6.013 1090 HE1 HIS 180 HE1 HIS 180 9.071 9.539 -7.415 1091 HE2 HIS 180 HE2 HIS 180 7.339 7.830 -8.068 1092 H GLU 181 H GLU 181 6.187 11.052 -3.967 1093 HA GLU 181 HA GLU 181 3.516 11.246 -3.428 1094 HB2 GLU 181 HB2 GLU 181 5.242 12.218 -5.650 1095 HB3 GLU 181 HB3 GLU 181 3.502 12.340 -5.869 1096 HG2 GLU 181 HG2 GLU 181 3.331 13.621 -3.793 1097 HG3 GLU 181 HG3 GLU 181 5.077 13.503 -3.580 1098 H ASP 182 H ASP 182 1.717 10.284 -3.992 1099 HA ASP 182 HA ASP 182 1.620 8.641 -6.395 1100 HB2 ASP 182 HB2 ASP 182 1.284 6.637 -5.323 1101 HB3 ASP 182 HB3 ASP 182 2.280 7.428 -4.098 1102 HA PRO 183 HA PRO 183 -2.289 10.872 -6.339 1103 HB2 PRO 183 HB2 PRO 183 -2.759 10.024 -9.042 1104 HB3 PRO 183 HB3 PRO 183 -2.246 11.608 -8.465 1105 HG2 PRO 183 HG2 PRO 183 -0.672 9.921 -9.959 1106 HG3 PRO 183 HG3 PRO 183 -0.046 11.184 -8.886 1107 HD2 PRO 183 HD2 PRO 183 -0.306 8.239 -8.403 1108 HD3 PRO 183 HD3 PRO 183 1.009 9.346 -7.947 1109 H ALA 184 H ALA 184 -1.887 7.502 -7.076 1110 HA ALA 184 HA ALA 184 -4.570 6.823 -7.582 1111 HB1 ALA 184 HB1 ALA 184 -2.086 5.410 -7.033 1112 HB2 ALA 184 HB2 ALA 184 -3.415 4.991 -8.113 1113 HB3 ALA 184 HB3 ALA 184 -3.507 4.580 -6.401 1114 H CYS 185 H CYS 185 -2.746 7.059 -4.565 1115 HA CYS 185 HA CYS 185 -5.133 6.354 -3.021 1116 HB2 CYS 185 HB2 CYS 185 -2.299 6.785 -2.101 1117 HB3 CYS 185 HB3 CYS 185 -3.624 6.232 -1.090 1118 H ASP 186 H ASP 186 -4.362 9.043 -4.383 1119 HA ASP 186 HA ASP 186 -3.958 10.891 -2.279 1120 HB2 ASP 186 HB2 ASP 186 -3.912 11.048 -4.999 1121 HB3 ASP 186 HB3 ASP 186 -5.424 11.878 -4.636 1122 HA PRO 187 HA PRO 187 -8.647 11.528 -2.099 1123 HB2 PRO 187 HB2 PRO 187 -10.171 10.774 -4.171 1124 HB3 PRO 187 HB3 PRO 187 -9.184 12.235 -4.211 1125 HG2 PRO 187 HG2 PRO 187 -8.878 9.779 -5.734 1126 HG3 PRO 187 HG3 PRO 187 -8.037 11.323 -5.935 1127 HD2 PRO 187 HD2 PRO 187 -7.162 8.893 -4.541 1128 HD3 PRO 187 HD3 PRO 187 -6.202 10.276 -5.107 1129 H GLU 188 H GLU 188 -10.833 10.522 -2.364 1130 HA GLU 188 HA GLU 188 -11.124 8.290 -0.742 1131 HB2 GLU 188 HB2 GLU 188 -13.520 8.523 -1.375 1132 HB3 GLU 188 HB3 GLU 188 -12.801 10.041 -0.853 1133 HG2 GLU 188 HG2 GLU 188 -12.391 10.368 -3.426 1134 HG3 GLU 188 HG3 GLU 188 -13.699 9.195 -3.563 1135 H ALA 189 H ALA 189 -9.534 7.711 -3.186 1136 HA ALA 189 HA ALA 189 -11.142 5.768 -4.614 1137 HB1 ALA 189 HB1 ALA 189 -8.307 6.766 -4.797 1138 HB2 ALA 189 HB2 ALA 189 -9.527 6.599 -6.073 1139 HB3 ALA 189 HB3 ALA 189 -8.715 5.168 -5.441 1140 H ALA 190 H ALA 190 -10.492 5.928 -1.628 1141 HA ALA 190 HA ALA 190 -8.954 3.575 -1.038 1142 HB1 ALA 190 HB1 ALA 190 -10.018 5.847 0.413 1143 HB2 ALA 190 HB2 ALA 190 -8.667 4.787 0.813 1144 HB3 ALA 190 HB3 ALA 190 -10.310 4.329 1.262 1145 H PHE 191 H PHE 191 -9.671 1.675 -0.403 1146 HA PHE 191 HA PHE 191 -12.495 1.002 -0.793 1147 HB2 PHE 191 HB2 PHE 191 -10.685 -0.240 -2.061 1148 HB3 PHE 191 HB3 PHE 191 -10.153 -0.890 -0.513 1149 HD1 PHE 191 HD1 PHE 191 -13.179 -0.610 -2.653 1150 HD2 PHE 191 HD2 PHE 191 -11.053 -2.873 0.255 1151 HE1 PHE 191 HE1 PHE 191 -14.835 -2.417 -2.856 1152 HE2 PHE 191 HE2 PHE 191 -12.704 -4.687 0.058 1153 HZ PHE 191 HZ PHE 191 -14.599 -4.460 -1.500 1154 H SER 192 H SER 192 -13.514 1.359 1.139 1155 HA SER 192 HA SER 192 -12.757 -0.342 3.361 1156 HB2 SER 192 HB2 SER 192 -12.985 2.646 3.784 1157 HB3 SER 192 HB3 SER 192 -12.628 1.430 5.010 1158 HG SER 192 HG SER 192 -10.984 2.557 3.095 Start of MODEL 19 1 H1 ALA 1 H1 ALA 1 26.862 34.531 -3.869 2 H2 ALA 1 H2 ALA 1 27.976 33.451 -3.136 3 H3 ALA 1 H3 ALA 1 26.686 34.110 -2.216 4 HA ALA 1 HA ALA 1 26.779 31.838 -3.890 5 HB1 ALA 1 HB1 ALA 1 25.940 32.292 -1.434 6 HB2 ALA 1 HB2 ALA 1 25.206 31.044 -2.442 7 HB3 ALA 1 HB3 ALA 1 24.415 32.610 -2.260 8 H VAL 2 H VAL 2 24.886 31.053 -4.988 9 HA VAL 2 HA VAL 2 23.252 33.047 -6.325 10 HB VAL 2 HB VAL 2 25.211 32.559 -7.756 11 HG11 VAL 2 HG11 VAL 2 24.159 29.754 -7.573 12 HG12 VAL 2 HG12 VAL 2 25.797 30.340 -7.289 13 HG13 VAL 2 HG13 VAL 2 25.148 30.291 -8.928 14 HG21 VAL 2 HG21 VAL 2 23.979 32.310 -9.777 15 HG22 VAL 2 HG22 VAL 2 22.959 33.193 -8.642 16 HG23 VAL 2 HG23 VAL 2 22.664 31.480 -8.944 17 H LEU 3 H LEU 3 21.297 32.540 -6.655 18 HA LEU 3 HA LEU 3 19.944 30.297 -5.594 19 HB2 LEU 3 HB2 LEU 3 18.931 32.314 -7.591 20 HB3 LEU 3 HB3 LEU 3 17.986 31.339 -6.494 21 HG LEU 3 HG LEU 3 17.908 33.446 -5.584 22 HD11 LEU 3 HD11 LEU 3 18.465 31.774 -3.918 23 HD12 LEU 3 HD12 LEU 3 19.137 33.347 -3.493 24 HD13 LEU 3 HD13 LEU 3 20.182 32.094 -4.161 25 HD21 LEU 3 HD21 LEU 3 20.705 34.135 -5.309 26 HD22 LEU 3 HD22 LEU 3 19.360 35.086 -5.937 27 HD23 LEU 3 HD23 LEU 3 20.212 33.965 -6.995 28 H ASP 4 H ASP 4 19.805 28.468 -6.408 29 HA ASP 4 HA ASP 4 20.054 27.963 -9.256 30 HB2 ASP 4 HB2 ASP 4 20.580 26.307 -6.824 31 HB3 ASP 4 HB3 ASP 4 20.198 25.509 -8.351 32 H LEU 5 H LEU 5 17.912 29.122 -8.836 33 HA LEU 5 HA LEU 5 15.936 27.313 -9.395 34 HB2 LEU 5 HB2 LEU 5 14.507 27.684 -7.759 35 HB3 LEU 5 HB3 LEU 5 15.995 28.064 -6.931 36 HG LEU 5 HG LEU 5 14.286 29.609 -6.347 37 HD11 LEU 5 HD11 LEU 5 15.949 31.008 -6.094 38 HD12 LEU 5 HD12 LEU 5 15.684 31.599 -7.727 39 HD13 LEU 5 HD13 LEU 5 16.811 30.283 -7.446 40 HD21 LEU 5 HD21 LEU 5 12.717 30.078 -7.829 41 HD22 LEU 5 HD22 LEU 5 13.723 29.569 -9.181 42 HD23 LEU 5 HD23 LEU 5 13.848 31.207 -8.558 43 H ASP 6 H ASP 6 16.337 30.787 -9.086 44 HA ASP 6 HA ASP 6 16.548 31.590 -11.764 45 HB2 ASP 6 HB2 ASP 6 14.079 30.387 -11.203 46 HB3 ASP 6 HB3 ASP 6 13.717 32.104 -11.331 47 H VAL 7 H VAL 7 14.927 32.000 -9.182 48 HA VAL 7 HA VAL 7 15.832 34.466 -8.177 49 HB VAL 7 HB VAL 7 14.053 35.287 -9.748 50 HG11 VAL 7 HG11 VAL 7 12.371 33.697 -7.928 51 HG12 VAL 7 HG12 VAL 7 12.141 34.111 -9.624 52 HG13 VAL 7 HG13 VAL 7 11.760 35.288 -8.368 53 HG21 VAL 7 HG21 VAL 7 13.824 37.146 -8.489 54 HG22 VAL 7 HG22 VAL 7 15.019 36.317 -7.494 55 HG23 VAL 7 HG23 VAL 7 13.313 36.251 -7.057 56 H ARG 8 H ARG 8 15.925 34.340 -5.928 57 HA ARG 8 HA ARG 8 14.827 31.985 -4.886 58 HB2 ARG 8 HB2 ARG 8 15.570 33.374 -2.687 59 HB3 ARG 8 HB3 ARG 8 16.694 32.432 -3.645 60 HG2 ARG 8 HG2 ARG 8 17.694 34.552 -3.130 61 HG3 ARG 8 HG3 ARG 8 17.342 34.514 -4.847 62 HD2 ARG 8 HD2 ARG 8 15.125 35.636 -3.422 63 HD3 ARG 8 HD3 ARG 8 16.608 36.468 -2.985 64 HE ARG 8 HE ARG 8 15.436 36.297 -5.668 65 HH11 ARG 8 HH11 ARG 8 17.837 37.662 -3.519 66 HH12 ARG 8 HH12 ARG 8 18.339 38.867 -4.655 67 HH21 ARG 8 HH21 ARG 8 16.108 37.892 -7.152 68 HH22 ARG 8 HH22 ARG 8 17.365 38.997 -6.709 69 H THR 9 H THR 9 12.632 31.992 -4.786 70 HA THR 9 HA THR 9 11.688 34.192 -3.103 71 HB THR 9 HB THR 9 9.404 32.936 -4.036 72 HG1 THR 9 HG1 THR 9 10.971 33.396 -6.335 73 HG21 THR 9 HG21 THR 9 8.823 35.011 -4.542 74 HG22 THR 9 HG22 THR 9 10.064 35.118 -5.792 75 HG23 THR 9 HG23 THR 9 10.462 35.505 -4.117 76 H CYS 10 H CYS 10 12.348 33.189 -1.332 77 HA CYS 10 HA CYS 10 12.002 30.343 -1.132 78 HB2 CYS 10 HB2 CYS 10 13.142 32.400 0.650 79 HB3 CYS 10 HB3 CYS 10 12.525 30.948 1.434 80 H LEU 11 H LEU 11 9.571 30.798 -1.733 81 HA LEU 11 HA LEU 11 7.572 31.744 -0.262 82 HB2 LEU 11 HB2 LEU 11 7.825 29.197 -1.754 83 HB3 LEU 11 HB3 LEU 11 6.409 29.394 -0.739 84 HG LEU 11 HG LEU 11 5.947 30.058 -3.044 85 HD11 LEU 11 HD11 LEU 11 4.487 31.440 -2.107 86 HD12 LEU 11 HD12 LEU 11 5.707 32.712 -2.148 87 HD13 LEU 11 HD13 LEU 11 5.548 31.687 -0.722 88 HD21 LEU 11 HD21 LEU 11 8.035 32.192 -2.616 89 HD22 LEU 11 HD22 LEU 11 7.035 31.969 -4.053 90 HD23 LEU 11 HD23 LEU 11 8.241 30.757 -3.619 91 HA PRO 12 HA PRO 12 8.175 29.735 3.718 92 HB2 PRO 12 HB2 PRO 12 6.961 31.561 5.223 93 HB3 PRO 12 HB3 PRO 12 8.523 31.886 4.467 94 HG2 PRO 12 HG2 PRO 12 5.801 32.814 3.685 95 HG3 PRO 12 HG3 PRO 12 7.349 33.669 3.589 96 HD2 PRO 12 HD2 PRO 12 6.054 32.345 1.484 97 HD3 PRO 12 HD3 PRO 12 7.743 32.886 1.496 98 H CYS 13 H CYS 13 6.924 27.910 4.066 99 HA CYS 13 HA CYS 13 4.058 28.323 4.384 100 HB2 CYS 13 HB2 CYS 13 3.611 26.192 3.480 101 HB3 CYS 13 HB3 CYS 13 4.778 26.935 2.403 102 H GLY 14 H GLY 14 3.686 25.626 5.380 103 HA2 GLY 14 HA2 GLY 14 3.864 24.361 7.300 104 HA3 GLY 14 HA3 GLY 14 5.239 25.346 7.785 105 HA PRO 15 HA PRO 15 1.525 26.304 10.445 106 HB2 PRO 15 HB2 PRO 15 2.857 26.554 12.769 107 HB3 PRO 15 HB3 PRO 15 2.444 24.949 12.121 108 HG2 PRO 15 HG2 PRO 15 4.885 26.572 11.515 109 HG3 PRO 15 HG3 PRO 15 4.879 25.011 12.415 110 HD2 PRO 15 HD2 PRO 15 5.305 24.873 9.871 111 HD3 PRO 15 HD3 PRO 15 3.904 23.926 10.444 112 H GLY 16 H GLY 16 1.830 28.056 9.101 113 HA2 GLY 16 HA2 GLY 16 1.328 30.425 9.205 114 HA3 GLY 16 HA3 GLY 16 2.403 30.484 10.570 115 H GLY 17 H GLY 17 3.874 28.709 8.107 116 HA2 GLY 17 HA2 GLY 17 5.099 29.385 6.305 117 HA3 GLY 17 HA3 GLY 17 4.665 30.973 6.728 118 H LYS 18 H LYS 18 6.350 28.616 8.617 119 HA LYS 18 HA LYS 18 8.647 30.386 8.977 120 HB2 LYS 18 HB2 LYS 18 8.510 27.716 10.280 121 HB3 LYS 18 HB3 LYS 18 9.156 29.232 10.888 122 HG2 LYS 18 HG2 LYS 18 6.360 29.548 10.503 123 HG3 LYS 18 HG3 LYS 18 6.641 28.059 11.400 124 HD2 LYS 18 HD2 LYS 18 8.267 30.333 12.279 125 HD3 LYS 18 HD3 LYS 18 6.527 30.556 12.482 126 HE2 LYS 18 HE2 LYS 18 7.025 29.531 14.469 127 HE3 LYS 18 HE3 LYS 18 6.692 28.112 13.478 128 HZ1 LYS 18 HZ1 LYS 18 9.436 29.001 13.385 129 HZ2 LYS 18 HZ2 LYS 18 8.810 27.444 13.596 130 HZ3 LYS 18 HZ3 LYS 18 8.934 28.491 14.919 131 H GLY 19 H GLY 19 7.838 27.644 7.017 132 HA2 GLY 19 HA2 GLY 19 10.672 27.086 6.445 133 HA3 GLY 19 HA3 GLY 19 9.405 25.860 6.443 134 H ARG 20 H ARG 20 10.533 25.871 3.847 135 HA ARG 20 HA ARG 20 8.934 27.835 2.431 136 HB2 ARG 20 HB2 ARG 20 11.307 26.232 1.466 137 HB3 ARG 20 HB3 ARG 20 10.461 27.483 0.567 138 HG2 ARG 20 HG2 ARG 20 12.318 28.605 1.308 139 HG3 ARG 20 HG3 ARG 20 11.142 29.003 2.564 140 HD2 ARG 20 HD2 ARG 20 12.078 27.454 4.069 141 HD3 ARG 20 HD3 ARG 20 13.010 26.661 2.799 142 HE ARG 20 HE ARG 20 14.114 29.041 2.717 143 HH11 ARG 20 HH11 ARG 20 13.191 27.185 5.532 144 HH12 ARG 20 HH12 ARG 20 14.404 27.891 6.543 145 HH21 ARG 20 HH21 ARG 20 15.708 29.961 4.049 146 HH22 ARG 20 HH22 ARG 20 15.832 29.465 5.704 147 H CYS 21 H CYS 21 8.312 26.874 0.139 148 HA CYS 21 HA CYS 21 7.104 24.216 0.606 149 HB2 CYS 21 HB2 CYS 21 6.096 26.680 -0.575 150 HB3 CYS 21 HB3 CYS 21 5.936 25.327 -1.692 151 H PHE 22 H PHE 22 7.549 22.533 -0.760 152 HA PHE 22 HA PHE 22 9.390 23.129 -3.007 153 HB2 PHE 22 HB2 PHE 22 9.112 20.612 -1.345 154 HB3 PHE 22 HB3 PHE 22 10.164 20.773 -2.751 155 HD1 PHE 22 HD1 PHE 22 9.605 21.801 0.721 156 HD2 PHE 22 HD2 PHE 22 12.194 22.050 -2.649 157 HE1 PHE 22 HE1 PHE 22 11.365 22.767 2.143 158 HE2 PHE 22 HE2 PHE 22 13.956 23.019 -1.229 159 HZ PHE 22 HZ PHE 22 13.541 23.378 1.173 160 H GLY 23 H GLY 23 7.206 20.448 -2.140 161 HA2 GLY 23 HA2 GLY 23 6.236 20.477 -4.926 162 HA3 GLY 23 HA3 GLY 23 6.208 19.074 -3.862 163 HA PRO 24 HA PRO 24 2.083 20.964 -3.407 164 HB2 PRO 24 HB2 PRO 24 0.692 18.615 -3.926 165 HB3 PRO 24 HB3 PRO 24 1.093 19.845 -5.124 166 HG2 PRO 24 HG2 PRO 24 2.114 17.173 -4.919 167 HG3 PRO 24 HG3 PRO 24 2.501 18.401 -6.131 168 HD2 PRO 24 HD2 PRO 24 4.029 17.570 -3.749 169 HD3 PRO 24 HD3 PRO 24 4.579 18.425 -5.206 170 H SER 25 H SER 25 2.741 17.585 -2.411 171 HA SER 25 HA SER 25 1.340 18.087 0.112 172 HB2 SER 25 HB2 SER 25 1.962 15.657 -1.489 173 HB3 SER 25 HB3 SER 25 1.953 15.454 0.267 174 HG SER 25 HG SER 25 -0.128 15.360 0.065 175 H ILE 26 H ILE 26 4.048 19.174 -0.463 176 HA ILE 26 HA ILE 26 5.370 17.928 1.820 177 HB ILE 26 HB ILE 26 6.673 18.470 -0.804 178 HG12 ILE 26 HG12 ILE 26 6.909 15.856 0.416 179 HG13 ILE 26 HG13 ILE 26 5.283 16.298 -0.123 180 HG21 ILE 26 HG21 ILE 26 8.688 18.492 0.105 181 HG22 ILE 26 HG22 ILE 26 8.304 17.104 1.123 182 HG23 ILE 26 HG23 ILE 26 7.860 18.727 1.638 183 HD11 ILE 26 HD11 ILE 26 7.519 16.773 -2.003 184 HD12 ILE 26 HD12 ILE 26 5.864 16.244 -2.310 185 HD13 ILE 26 HD13 ILE 26 7.057 15.099 -1.697 186 H CYS 27 H CYS 27 5.697 19.387 3.301 187 HA CYS 27 HA CYS 27 6.678 22.050 2.544 188 HB2 CYS 27 HB2 CYS 27 4.231 21.415 3.981 189 HB3 CYS 27 HB3 CYS 27 5.292 22.461 4.916 190 H CYS 28 H CYS 28 8.471 22.538 3.484 191 HA CYS 28 HA CYS 28 9.353 21.072 5.860 192 HB2 CYS 28 HB2 CYS 28 10.879 22.231 3.531 193 HB3 CYS 28 HB3 CYS 28 11.676 21.698 4.992 194 H GLY 29 H GLY 29 10.938 22.128 7.188 195 HA2 GLY 29 HA2 GLY 29 11.121 25.009 7.213 196 HA3 GLY 29 HA3 GLY 29 10.430 24.244 8.637 197 H ASP 30 H ASP 30 12.658 25.508 9.195 198 HA ASP 30 HA ASP 30 15.062 24.140 8.744 199 HB2 ASP 30 HB2 ASP 30 14.735 26.565 9.514 200 HB3 ASP 30 HB3 ASP 30 14.520 25.892 11.126 201 H GLU 31 H GLU 31 12.962 24.308 11.425 202 HA GLU 31 HA GLU 31 13.941 21.806 12.542 203 HB2 GLU 31 HB2 GLU 31 12.954 22.935 14.711 204 HB3 GLU 31 HB3 GLU 31 14.604 23.261 14.209 205 HG2 GLU 31 HG2 GLU 31 13.360 25.236 12.909 206 HG3 GLU 31 HG3 GLU 31 12.227 25.020 14.239 207 H LEU 32 H LEU 32 11.780 22.769 10.675 208 HA LEU 32 HA LEU 32 9.475 21.727 12.052 209 HB2 LEU 32 HB2 LEU 32 10.002 24.001 10.492 210 HB3 LEU 32 HB3 LEU 32 8.942 22.967 9.583 211 HG LEU 32 HG LEU 32 8.457 24.043 12.350 212 HD11 LEU 32 HD11 LEU 32 8.289 25.655 10.476 213 HD12 LEU 32 HD12 LEU 32 6.782 25.414 11.358 214 HD13 LEU 32 HD13 LEU 32 7.019 24.650 9.786 215 HD21 LEU 32 HD21 LEU 32 7.536 21.677 11.572 216 HD22 LEU 32 HD22 LEU 32 6.319 22.694 10.815 217 HD23 LEU 32 HD23 LEU 32 6.577 22.785 12.550 218 H GLY 33 H GLY 33 11.899 21.150 9.853 219 HA2 GLY 33 HA2 GLY 33 12.296 19.464 8.406 220 HA3 GLY 33 HA3 GLY 33 11.148 18.596 9.363 221 H CYS 34 H CYS 34 9.674 17.614 7.985 222 HA CYS 34 HA CYS 34 8.371 19.427 6.132 223 HB2 CYS 34 HB2 CYS 34 10.274 17.641 5.252 224 HB3 CYS 34 HB3 CYS 34 8.739 16.954 4.792 225 H PHE 35 H PHE 35 6.338 19.343 6.226 226 HA PHE 35 HA PHE 35 5.052 16.934 7.284 227 HB2 PHE 35 HB2 PHE 35 3.266 19.005 6.196 228 HB3 PHE 35 HB3 PHE 35 3.248 18.252 7.784 229 HD1 PHE 35 HD1 PHE 35 5.075 20.790 5.808 230 HD2 PHE 35 HD2 PHE 35 3.769 19.519 9.638 231 HE1 PHE 35 HE1 PHE 35 5.940 22.876 6.775 232 HE2 PHE 35 HE2 PHE 35 4.625 21.604 10.624 233 HZ PHE 35 HZ PHE 35 5.719 23.280 9.185 234 H VAL 36 H VAL 36 5.081 15.408 5.660 235 HA VAL 36 HA VAL 36 4.802 16.435 2.969 236 HB VAL 36 HB VAL 36 5.250 13.528 3.594 237 HG11 VAL 36 HG11 VAL 36 6.500 13.781 1.389 238 HG12 VAL 36 HG12 VAL 36 5.791 15.404 1.276 239 HG13 VAL 36 HG13 VAL 36 4.747 13.967 1.308 240 HG21 VAL 36 HG21 VAL 36 6.936 14.920 4.842 241 HG22 VAL 36 HG22 VAL 36 7.419 15.635 3.307 242 HG23 VAL 36 HG23 VAL 36 7.658 13.912 3.588 243 H GLY 37 H GLY 37 2.822 17.120 3.076 244 HA2 GLY 37 HA2 GLY 37 0.653 16.728 2.175 245 HA3 GLY 37 HA3 GLY 37 0.760 15.063 2.688 246 H THR 38 H THR 38 0.382 18.355 3.884 247 HA THR 38 HA THR 38 -1.671 17.534 5.746 248 HB THR 38 HB THR 38 -0.625 18.481 7.728 249 HG1 THR 38 HG1 THR 38 1.197 19.401 5.894 250 HG21 THR 38 HG21 THR 38 -0.137 16.136 7.382 251 HG22 THR 38 HG22 THR 38 1.223 16.957 8.139 252 HG23 THR 38 HG23 THR 38 1.278 16.555 6.423 253 H ALA 39 H ALA 39 -2.414 19.847 7.005 254 HA ALA 39 HA ALA 39 -2.962 21.610 4.889 255 HB1 ALA 39 HB1 ALA 39 -3.996 21.096 7.410 256 HB2 ALA 39 HB2 ALA 39 -4.507 22.376 6.311 257 HB3 ALA 39 HB3 ALA 39 -3.304 22.712 7.556 258 H GLU 40 H GLU 40 -0.246 21.174 6.900 259 HA GLU 40 HA GLU 40 0.592 23.865 7.130 260 HB2 GLU 40 HB2 GLU 40 1.963 21.201 7.265 261 HB3 GLU 40 HB3 GLU 40 2.937 22.662 7.184 262 HG2 GLU 40 HG2 GLU 40 2.723 22.866 9.375 263 HG3 GLU 40 HG3 GLU 40 1.001 23.155 9.142 264 H ALA 41 H ALA 41 0.345 21.675 4.546 265 HA ALA 41 HA ALA 41 2.047 23.309 2.813 266 HB1 ALA 41 HB1 ALA 41 2.694 20.950 3.028 267 HB2 ALA 41 HB2 ALA 41 2.244 21.371 1.376 268 HB3 ALA 41 HB3 ALA 41 1.119 20.476 2.397 269 H LEU 42 H LEU 42 -1.266 22.605 3.401 270 HA LEU 42 HA LEU 42 -2.233 22.532 0.838 271 HB2 LEU 42 HB2 LEU 42 -4.300 22.781 1.727 272 HB3 LEU 42 HB3 LEU 42 -3.325 22.158 3.013 273 HG LEU 42 HG LEU 42 -4.495 23.620 4.188 274 HD11 LEU 42 HD11 LEU 42 -2.324 24.349 4.574 275 HD12 LEU 42 HD12 LEU 42 -3.347 25.781 4.482 276 HD13 LEU 42 HD13 LEU 42 -2.318 25.347 3.131 277 HD21 LEU 42 HD21 LEU 42 -5.884 24.326 2.302 278 HD22 LEU 42 HD22 LEU 42 -4.644 25.493 1.842 279 HD23 LEU 42 HD23 LEU 42 -5.497 25.672 3.375 280 H ARG 43 H ARG 43 -0.748 25.235 2.306 281 HA ARG 43 HA ARG 43 -1.916 27.207 0.498 282 HB2 ARG 43 HB2 ARG 43 -0.054 28.670 1.397 283 HB3 ARG 43 HB3 ARG 43 -1.147 28.062 2.625 284 HG2 ARG 43 HG2 ARG 43 0.463 26.336 3.227 285 HG3 ARG 43 HG3 ARG 43 1.568 26.944 1.992 286 HD2 ARG 43 HD2 ARG 43 0.551 28.512 4.359 287 HD3 ARG 43 HD3 ARG 43 2.134 27.751 4.247 288 HE ARG 43 HE ARG 43 2.741 29.331 2.579 289 HH11 ARG 43 HH11 ARG 43 -0.362 29.991 4.059 290 HH12 ARG 43 HH12 ARG 43 -0.385 31.644 3.552 291 HH21 ARG 43 HH21 ARG 43 2.699 31.505 1.919 292 HH22 ARG 43 HH22 ARG 43 1.347 32.502 2.339 293 H CYS 44 H CYS 44 0.215 24.913 0.681 294 HA CYS 44 HA CYS 44 2.356 25.601 -1.095 295 HB2 CYS 44 HB2 CYS 44 1.804 23.201 0.182 296 HB3 CYS 44 HB3 CYS 44 1.743 22.787 -1.526 297 H GLN 45 H GLN 45 -0.907 24.820 -1.771 298 HA GLN 45 HA GLN 45 -0.892 24.043 -4.421 299 HB2 GLN 45 HB2 GLN 45 -2.867 24.261 -2.854 300 HB3 GLN 45 HB3 GLN 45 -2.868 25.979 -3.225 301 HG2 GLN 45 HG2 GLN 45 -4.215 25.518 -4.914 302 HG3 GLN 45 HG3 GLN 45 -2.841 24.749 -5.707 303 HE21 GLN 45 HE21 GLN 45 -5.535 24.146 -3.512 304 HE22 GLN 45 HE22 GLN 45 -5.748 22.486 -3.941 305 H GLU 46 H GLU 46 0.021 27.145 -3.149 306 HA GLU 46 HA GLU 46 -0.471 28.498 -5.668 307 HB2 GLU 46 HB2 GLU 46 0.798 29.400 -3.081 308 HB3 GLU 46 HB3 GLU 46 0.715 30.422 -4.508 309 HG2 GLU 46 HG2 GLU 46 -1.375 30.999 -4.071 310 HG3 GLU 46 HG3 GLU 46 -1.871 29.316 -3.895 311 H GLU 47 H GLU 47 1.685 26.277 -4.894 312 HA GLU 47 HA GLU 47 4.077 27.561 -5.876 313 HB2 GLU 47 HB2 GLU 47 3.374 24.941 -4.717 314 HB3 GLU 47 HB3 GLU 47 4.619 24.888 -5.953 315 HG2 GLU 47 HG2 GLU 47 4.869 26.912 -3.798 316 HG3 GLU 47 HG3 GLU 47 5.200 25.223 -3.414 317 H ASN 48 H ASN 48 1.272 26.631 -7.283 318 HA ASN 48 HA ASN 48 2.308 25.238 -9.565 319 HB2 ASN 48 HB2 ASN 48 0.061 25.590 -10.524 320 HB3 ASN 48 HB3 ASN 48 -0.028 24.932 -8.893 321 HD21 ASN 48 HD21 ASN 48 -1.974 26.475 -10.462 322 HD22 ASN 48 HD22 ASN 48 -2.371 27.848 -9.491 323 H TYR 49 H TYR 49 1.812 28.566 -8.629 324 HA TYR 49 HA TYR 49 2.137 29.583 -11.322 325 HB2 TYR 49 HB2 TYR 49 2.042 30.942 -8.624 326 HB3 TYR 49 HB3 TYR 49 2.262 31.813 -10.139 327 HD1 TYR 49 HD1 TYR 49 0.448 31.548 -11.930 328 HD2 TYR 49 HD2 TYR 49 -0.104 30.407 -7.869 329 HE1 TYR 49 HE1 TYR 49 -1.990 31.607 -12.251 330 HE2 TYR 49 HE2 TYR 49 -2.542 30.461 -8.179 331 HH TYR 49 HH TYR 49 -4.115 31.930 -10.153 332 H LEU 50 H LEU 50 4.304 28.047 -9.543 333 HA LEU 50 HA LEU 50 6.514 29.736 -10.483 334 HB2 LEU 50 HB2 LEU 50 6.654 28.236 -7.883 335 HB3 LEU 50 HB3 LEU 50 7.742 29.472 -8.483 336 HG LEU 50 HG LEU 50 4.876 30.062 -7.776 337 HD11 LEU 50 HD11 LEU 50 6.084 29.112 -5.830 338 HD12 LEU 50 HD12 LEU 50 5.613 30.798 -5.611 339 HD13 LEU 50 HD13 LEU 50 7.286 30.392 -5.997 340 HD21 LEU 50 HD21 LEU 50 5.481 32.304 -7.886 341 HD22 LEU 50 HD22 LEU 50 6.343 31.588 -9.248 342 HD23 LEU 50 HD23 LEU 50 7.202 31.949 -7.750 343 HA PRO 51 HA PRO 51 7.726 25.763 -12.131 344 HB2 PRO 51 HB2 PRO 51 9.908 26.544 -13.470 345 HB3 PRO 51 HB3 PRO 51 8.288 27.013 -14.000 346 HG2 PRO 51 HG2 PRO 51 10.318 28.600 -12.481 347 HG3 PRO 51 HG3 PRO 51 9.258 29.113 -13.805 348 HD2 PRO 51 HD2 PRO 51 8.757 29.587 -11.138 349 HD3 PRO 51 HD3 PRO 51 7.508 29.528 -12.397 350 H SER 52 H SER 52 8.994 27.193 -9.507 351 HA SER 52 HA SER 52 10.483 25.013 -8.640 352 HB2 SER 52 HB2 SER 52 12.006 26.960 -10.238 353 HB3 SER 52 HB3 SER 52 12.721 26.597 -8.667 354 HG SER 52 HG SER 52 11.828 24.394 -10.069 355 HA PRO 53 HA PRO 53 9.931 27.376 -4.944 356 HB2 PRO 53 HB2 PRO 53 11.331 25.910 -3.189 357 HB3 PRO 53 HB3 PRO 53 9.877 25.277 -3.968 358 HG2 PRO 53 HG2 PRO 53 12.751 24.764 -4.632 359 HG3 PRO 53 HG3 PRO 53 11.398 23.620 -4.555 360 HD2 PRO 53 HD2 PRO 53 12.358 24.725 -6.885 361 HD3 PRO 53 HD3 PRO 53 10.705 24.115 -6.676 362 H CYS 54 H CYS 54 12.962 26.486 -3.623 363 HA CYS 54 HA CYS 54 14.484 28.666 -4.677 364 HB2 CYS 54 HB2 CYS 54 14.613 30.091 -2.811 365 HB3 CYS 54 HB3 CYS 54 12.901 29.731 -2.955 366 H GLN 55 H GLN 55 16.460 27.841 -4.901 367 HA GLN 55 HA GLN 55 17.232 25.427 -3.664 368 HB2 GLN 55 HB2 GLN 55 19.168 25.610 -4.826 369 HB3 GLN 55 HB3 GLN 55 18.291 26.905 -5.630 370 HG2 GLN 55 HG2 GLN 55 20.270 27.210 -3.382 371 HG3 GLN 55 HG3 GLN 55 20.535 27.614 -5.075 372 HE21 GLN 55 HE21 GLN 55 20.754 29.344 -2.802 373 HE22 GLN 55 HE22 GLN 55 19.599 30.606 -3.000 374 H SER 56 H SER 56 18.211 24.818 -1.788 375 HA SER 56 HA SER 56 19.924 26.199 -0.179 376 HB2 SER 56 HB2 SER 56 17.628 27.642 -0.026 377 HB3 SER 56 HB3 SER 56 17.400 26.539 1.326 378 HG SER 56 HG SER 56 19.685 27.213 1.853 379 H GLY 57 H GLY 57 20.234 23.692 -0.458 380 HA2 GLY 57 HA2 GLY 57 20.162 22.445 1.958 381 HA3 GLY 57 HA3 GLY 57 18.679 21.961 1.123 382 H GLN 58 H GLN 58 22.156 21.859 1.058 383 HA GLN 58 HA GLN 58 22.015 20.032 -1.231 384 HB2 GLN 58 HB2 GLN 58 23.443 22.199 -1.318 385 HB3 GLN 58 HB3 GLN 58 24.548 21.326 -0.266 386 HG2 GLN 58 HG2 GLN 58 25.393 20.190 -1.967 387 HG3 GLN 58 HG3 GLN 58 23.792 19.704 -2.523 388 HE21 GLN 58 HE21 GLN 58 26.498 21.636 -3.113 389 HE22 GLN 58 HE22 GLN 58 25.873 22.538 -4.447 390 H LYS 59 H LYS 59 21.326 18.532 0.231 391 HA LYS 59 HA LYS 59 23.581 17.077 1.466 392 HB2 LYS 59 HB2 LYS 59 20.887 17.524 2.786 393 HB3 LYS 59 HB3 LYS 59 22.091 16.400 3.367 394 HG2 LYS 59 HG2 LYS 59 22.451 18.174 4.751 395 HG3 LYS 59 HG3 LYS 59 23.598 18.533 3.460 396 HD2 LYS 59 HD2 LYS 59 21.845 19.988 2.424 397 HD3 LYS 59 HD3 LYS 59 20.863 19.735 3.867 398 HE2 LYS 59 HE2 LYS 59 22.803 20.599 5.208 399 HE3 LYS 59 HE3 LYS 59 23.560 21.057 3.684 400 HZ1 LYS 59 HZ1 LYS 59 22.439 22.948 3.829 401 HZ2 LYS 59 HZ2 LYS 59 21.543 22.403 5.156 402 HZ3 LYS 59 HZ3 LYS 59 21.006 22.082 3.586 403 HA PRO 60 HA PRO 60 20.543 14.971 -1.477 404 HB2 PRO 60 HB2 PRO 60 22.619 14.016 -3.080 405 HB3 PRO 60 HB3 PRO 60 21.584 15.399 -3.444 406 HG2 PRO 60 HG2 PRO 60 24.314 15.338 -2.249 407 HG3 PRO 60 HG3 PRO 60 23.610 16.499 -3.391 408 HD2 PRO 60 HD2 PRO 60 23.875 17.106 -0.801 409 HD3 PRO 60 HD3 PRO 60 22.466 17.637 -1.724 410 H CYS 61 H CYS 61 20.032 13.608 -0.061 411 HA CYS 61 HA CYS 61 21.671 11.319 0.663 412 HB2 CYS 61 HB2 CYS 61 20.324 11.013 2.512 413 HB3 CYS 61 HB3 CYS 61 20.214 12.761 2.336 414 H GLY 62 H GLY 62 19.479 9.554 1.024 415 HA2 GLY 62 HA2 GLY 62 18.620 7.849 -0.372 416 HA3 GLY 62 HA3 GLY 62 17.571 9.220 -0.650 417 H SER 63 H SER 63 17.124 8.038 -2.507 418 HA SER 63 HA SER 63 19.012 7.820 -4.671 419 HB2 SER 63 HB2 SER 63 16.408 6.750 -3.977 420 HB3 SER 63 HB3 SER 63 16.419 7.338 -5.637 421 HG SER 63 HG SER 63 17.105 5.105 -5.307 422 H GLY 64 H GLY 64 18.892 10.426 -3.977 423 HA2 GLY 64 HA2 GLY 64 19.018 12.128 -5.747 424 HA3 GLY 64 HA3 GLY 64 17.392 11.659 -6.198 425 H GLY 65 H GLY 65 17.725 11.785 -2.787 426 HA2 GLY 65 HA2 GLY 65 16.332 14.382 -2.848 427 HA3 GLY 65 HA3 GLY 65 16.199 13.189 -1.581 428 H ARG 66 H ARG 66 17.061 16.183 -1.915 429 HA ARG 66 HA ARG 66 19.489 16.021 -0.287 430 HB2 ARG 66 HB2 ARG 66 19.849 18.390 -0.703 431 HB3 ARG 66 HB3 ARG 66 19.723 17.524 -2.219 432 HG2 ARG 66 HG2 ARG 66 17.296 18.809 -1.051 433 HG3 ARG 66 HG3 ARG 66 18.506 19.815 -1.842 434 HD2 ARG 66 HD2 ARG 66 17.982 19.061 -3.895 435 HD3 ARG 66 HD3 ARG 66 17.689 17.417 -3.329 436 HE ARG 66 HE ARG 66 15.494 18.061 -2.694 437 HH11 ARG 66 HH11 ARG 66 17.220 20.563 -4.435 438 HH12 ARG 66 HH12 ARG 66 15.782 21.417 -4.875 439 HH21 ARG 66 HH21 ARG 66 13.607 19.203 -3.281 440 HH22 ARG 66 HH22 ARG 66 13.739 20.650 -4.222 441 H CYS 67 H CYS 67 19.577 17.372 1.731 442 HA CYS 67 HA CYS 67 17.326 16.996 3.283 443 HB2 CYS 67 HB2 CYS 67 19.953 18.164 3.666 444 HB3 CYS 67 HB3 CYS 67 18.729 19.095 4.496 445 H ALA 68 H ALA 68 15.463 18.019 3.119 446 HA ALA 68 HA ALA 68 15.518 20.701 1.947 447 HB1 ALA 68 HB1 ALA 68 12.898 19.777 2.729 448 HB2 ALA 68 HB2 ALA 68 13.709 18.610 1.702 449 HB3 ALA 68 HB3 ALA 68 13.482 20.267 1.145 450 H ALA 69 H ALA 69 15.387 19.030 5.023 451 HA ALA 69 HA ALA 69 15.317 21.521 6.454 452 HB1 ALA 69 HB1 ALA 69 13.114 19.525 6.799 453 HB2 ALA 69 HB2 ALA 69 12.922 21.051 5.960 454 HB3 ALA 69 HB3 ALA 69 13.322 21.015 7.677 455 H ALA 70 H ALA 70 15.601 20.996 8.809 456 HA ALA 70 HA ALA 70 17.628 19.196 9.312 457 HB1 ALA 70 HB1 ALA 70 15.689 19.912 11.483 458 HB2 ALA 70 HB2 ALA 70 16.820 21.092 10.815 459 HB3 ALA 70 HB3 ALA 70 17.430 19.636 11.602 460 H GLY 71 H GLY 71 17.836 17.124 9.775 461 HA2 GLY 71 HA2 GLY 71 17.408 14.929 10.196 462 HA3 GLY 71 HA3 GLY 71 15.947 15.462 10.989 463 H ILE 72 H ILE 72 15.022 16.686 8.397 464 HA ILE 72 HA ILE 72 13.943 14.220 7.231 465 HB ILE 72 HB ILE 72 12.028 15.341 6.685 466 HG12 ILE 72 HG12 ILE 72 12.054 17.970 7.021 467 HG13 ILE 72 HG13 ILE 72 13.763 17.747 6.646 468 HG21 ILE 72 HG21 ILE 72 11.213 16.235 8.677 469 HG22 ILE 72 HG22 ILE 72 12.781 16.901 9.130 470 HG23 ILE 72 HG23 ILE 72 12.517 15.158 9.175 471 HD11 ILE 72 HD11 ILE 72 11.984 16.261 4.940 472 HD12 ILE 72 HD12 ILE 72 13.345 17.300 4.507 473 HD13 ILE 72 HD13 ILE 72 11.763 18.001 4.826 474 H CYS 73 H CYS 73 14.634 13.596 5.340 475 HA CYS 73 HA CYS 73 16.027 15.513 3.612 476 HB2 CYS 73 HB2 CYS 73 17.267 13.519 4.382 477 HB3 CYS 73 HB3 CYS 73 16.102 12.502 3.545 478 H CYS 74 H CYS 74 14.754 16.340 2.068 479 HA CYS 74 HA CYS 74 12.779 14.539 0.869 480 HB2 CYS 74 HB2 CYS 74 12.638 17.312 1.722 481 HB3 CYS 74 HB3 CYS 74 12.035 17.073 0.086 482 H SER 75 H SER 75 12.520 14.343 -1.252 483 HA SER 75 HA SER 75 14.668 15.408 -2.972 484 HB2 SER 75 HB2 SER 75 14.422 13.390 -4.302 485 HB3 SER 75 HB3 SER 75 14.578 12.906 -2.620 486 HG SER 75 HG SER 75 12.693 12.187 -4.214 487 HA PRO 76 HA PRO 76 11.471 17.167 -5.486 488 HB2 PRO 76 HB2 PRO 76 12.069 16.644 -8.046 489 HB3 PRO 76 HB3 PRO 76 13.108 17.664 -7.044 490 HG2 PRO 76 HG2 PRO 76 13.452 14.807 -7.836 491 HG3 PRO 76 HG3 PRO 76 14.670 16.085 -7.686 492 HD2 PRO 76 HD2 PRO 76 14.166 14.137 -5.785 493 HD3 PRO 76 HD3 PRO 76 14.965 15.686 -5.458 494 H ASP 77 H ASP 77 11.162 14.223 -4.677 495 HA ASP 77 HA ASP 77 8.755 13.751 -6.238 496 HB2 ASP 77 HB2 ASP 77 11.046 11.796 -6.014 497 HB3 ASP 77 HB3 ASP 77 9.407 11.291 -6.416 498 H GLY 78 H GLY 78 10.793 12.935 -3.456 499 HA2 GLY 78 HA2 GLY 78 8.413 12.675 -1.847 500 HA3 GLY 78 HA3 GLY 78 9.347 11.217 -1.967 501 H CYS 79 H CYS 79 9.988 11.052 0.120 502 HA CYS 79 HA CYS 79 12.089 12.865 0.976 503 HB2 CYS 79 HB2 CYS 79 9.512 13.307 1.887 504 HB3 CYS 79 HB3 CYS 79 10.234 12.359 3.180 505 H HIS 80 H HIS 80 13.350 12.018 2.811 506 HA HIS 80 HA HIS 80 12.825 9.248 3.568 507 HB2 HIS 80 HB2 HIS 80 15.372 10.143 2.184 508 HB3 HIS 80 HB3 HIS 80 15.191 8.607 3.023 509 HD1 HIS 80 HD1 HIS 80 14.939 10.051 -0.243 510 HD2 HIS 80 HD2 HIS 80 12.972 7.013 1.794 511 HE1 HIS 80 HE1 HIS 80 13.854 8.643 -2.021 512 HE2 HIS 80 HE2 HIS 80 12.805 6.726 -0.769 513 H GLU 81 H GLU 81 13.859 8.644 5.506 514 HA GLU 81 HA GLU 81 14.332 10.744 7.331 515 HB2 GLU 81 HB2 GLU 81 15.129 7.844 7.613 516 HB3 GLU 81 HB3 GLU 81 14.936 9.004 8.919 517 HG2 GLU 81 HG2 GLU 81 12.757 8.626 9.054 518 HG3 GLU 81 HG3 GLU 81 12.543 8.808 7.314 519 H ASP 82 H ASP 82 16.154 11.763 7.976 520 HA ASP 82 HA ASP 82 18.742 10.622 7.244 521 HB2 ASP 82 HB2 ASP 82 19.415 12.286 5.820 522 HB3 ASP 82 HB3 ASP 82 17.685 12.290 5.467 523 HA PRO 83 HA PRO 83 19.294 12.373 11.356 524 HB2 PRO 83 HB2 PRO 83 21.693 10.862 11.666 525 HB3 PRO 83 HB3 PRO 83 20.094 10.498 12.312 526 HG2 PRO 83 HG2 PRO 83 21.414 9.018 10.373 527 HG3 PRO 83 HG3 PRO 83 19.673 8.966 10.691 528 HD2 PRO 83 HD2 PRO 83 21.171 10.420 8.557 529 HD3 PRO 83 HD3 PRO 83 19.585 9.625 8.487 530 H ALA 84 H ALA 84 21.351 12.719 8.660 531 HA ALA 84 HA ALA 84 23.567 13.968 9.876 532 HB1 ALA 84 HB1 ALA 84 22.622 13.468 7.183 533 HB2 ALA 84 HB2 ALA 84 24.271 13.566 7.800 534 HB3 ALA 84 HB3 ALA 84 23.417 15.036 7.330 535 H CYS 85 H CYS 85 20.396 15.126 9.152 536 HA CYS 85 HA CYS 85 21.285 17.887 9.424 537 HB2 CYS 85 HB2 CYS 85 18.828 16.619 8.291 538 HB3 CYS 85 HB3 CYS 85 18.846 18.332 8.704 539 H ASP 86 H ASP 86 20.881 15.927 11.719 540 HA ASP 86 HA ASP 86 18.734 16.853 13.287 541 HB2 ASP 86 HB2 ASP 86 21.071 15.086 13.693 542 HB3 ASP 86 HB3 ASP 86 20.348 15.795 15.135 543 HA PRO 87 HA PRO 87 21.990 19.684 15.266 544 HB2 PRO 87 HB2 PRO 87 24.004 20.288 13.395 545 HB3 PRO 87 HB3 PRO 87 24.177 19.362 14.883 546 HG2 PRO 87 HG2 PRO 87 24.462 18.389 12.270 547 HG3 PRO 87 HG3 PRO 87 24.361 17.427 13.752 548 HD2 PRO 87 HD2 PRO 87 22.301 17.976 11.713 549 HD3 PRO 87 HD3 PRO 87 22.443 16.614 12.842 550 H GLU 88 H GLU 88 19.978 20.525 14.487 551 HA GLU 88 HA GLU 88 19.910 22.931 13.789 552 HB2 GLU 88 HB2 GLU 88 19.282 23.145 11.447 553 HB3 GLU 88 HB3 GLU 88 20.881 22.461 11.669 554 HG2 GLU 88 HG2 GLU 88 20.208 20.333 11.049 555 HG3 GLU 88 HG3 GLU 88 18.515 20.756 11.192 556 H ALA 89 H ALA 89 18.493 19.887 14.050 557 HA ALA 89 HA ALA 89 15.797 20.427 13.588 558 HB1 ALA 89 HB1 ALA 89 17.324 18.178 13.850 559 HB2 ALA 89 HB2 ALA 89 15.545 18.212 13.825 560 HB3 ALA 89 HB3 ALA 89 16.396 18.193 15.369 561 H ALA 90 H ALA 90 17.692 21.310 16.051 562 HA ALA 90 HA ALA 90 15.854 21.403 18.226 563 HB1 ALA 90 HB1 ALA 90 18.606 21.764 17.925 564 HB2 ALA 90 HB2 ALA 90 17.663 21.927 19.406 565 HB3 ALA 90 HB3 ALA 90 17.979 23.341 18.403 566 H PHE 91 H PHE 91 14.458 22.720 18.641 567 HA PHE 91 HA PHE 91 13.863 25.120 17.102 568 HB2 PHE 91 HB2 PHE 91 11.640 24.943 18.258 569 HB3 PHE 91 HB3 PHE 91 12.028 23.548 17.264 570 HD1 PHE 91 HD1 PHE 91 12.645 21.401 18.332 571 HD2 PHE 91 HD2 PHE 91 11.362 24.749 20.632 572 HE1 PHE 91 HE1 PHE 91 12.208 19.918 20.248 573 HE2 PHE 91 HE2 PHE 91 10.922 23.268 22.547 574 HZ PHE 91 HZ PHE 91 11.345 20.850 22.357 575 H SER 92 H SER 92 15.304 26.604 18.051 576 HA SER 92 HA SER 92 15.371 26.890 20.924 577 HB2 SER 92 HB2 SER 92 16.933 28.784 20.427 578 HB3 SER 92 HB3 SER 92 17.435 27.244 19.732 579 HG SER 92 HG SER 92 17.597 28.506 18.021 580 H1 ALA 101 H1 ALA 101 -9.040 -7.849 9.539 581 H2 ALA 101 H2 ALA 101 -9.845 -8.807 10.713 582 H3 ALA 101 H3 ALA 101 -10.106 -9.096 9.042 583 HA ALA 101 HA ALA 101 -8.017 -9.953 10.784 584 HB1 ALA 101 HB1 ALA 101 -7.883 -11.716 8.980 585 HB2 ALA 101 HB2 ALA 101 -9.218 -10.885 8.186 586 HB3 ALA 101 HB3 ALA 101 -9.437 -11.566 9.796 587 H VAL 102 H VAL 102 -6.399 -11.021 8.666 588 HA VAL 102 HA VAL 102 -4.368 -10.623 7.798 589 HB VAL 102 HB VAL 102 -5.863 -10.079 5.932 590 HG11 VAL 102 HG11 VAL 102 -5.527 -7.225 6.829 591 HG12 VAL 102 HG12 VAL 102 -7.022 -8.153 6.782 592 HG13 VAL 102 HG13 VAL 102 -6.202 -7.728 5.283 593 HG21 VAL 102 HG21 VAL 102 -3.415 -10.109 5.674 594 HG22 VAL 102 HG22 VAL 102 -3.386 -8.370 5.962 595 HG23 VAL 102 HG23 VAL 102 -4.213 -9.014 4.544 596 H LEU 103 H LEU 103 -3.149 -10.023 9.619 597 HA LEU 103 HA LEU 103 -2.669 -7.110 9.978 598 HB2 LEU 103 HB2 LEU 103 -2.261 -9.402 11.915 599 HB3 LEU 103 HB3 LEU 103 -1.840 -7.731 12.230 600 HG LEU 103 HG LEU 103 -3.875 -8.076 13.354 601 HD11 LEU 103 HD11 LEU 103 -3.922 -5.986 12.201 602 HD12 LEU 103 HD12 LEU 103 -5.529 -6.705 12.098 603 HD13 LEU 103 HD13 LEU 103 -4.450 -6.761 10.706 604 HD21 LEU 103 HD21 LEU 103 -4.512 -9.784 11.044 605 HD22 LEU 103 HD22 LEU 103 -5.865 -8.879 11.717 606 HD23 LEU 103 HD23 LEU 103 -4.932 -9.966 12.744 607 H ASP 104 H ASP 104 -1.033 -6.584 8.768 608 HA ASP 104 HA ASP 104 1.378 -8.251 8.696 609 HB2 ASP 104 HB2 ASP 104 0.022 -7.351 6.559 610 HB3 ASP 104 HB3 ASP 104 1.122 -5.994 6.789 611 H LEU 105 H LEU 105 1.455 -7.297 10.852 612 HA LEU 105 HA LEU 105 3.426 -5.453 11.052 613 HB2 LEU 105 HB2 LEU 105 2.417 -3.698 11.973 614 HB3 LEU 105 HB3 LEU 105 1.099 -4.346 11.036 615 HG LEU 105 HG LEU 105 0.395 -3.571 13.210 616 HD11 LEU 105 HD11 LEU 105 -0.684 -5.795 13.913 617 HD12 LEU 105 HD12 LEU 105 0.082 -6.430 12.465 618 HD13 LEU 105 HD13 LEU 105 -1.060 -5.096 12.346 619 HD21 LEU 105 HD21 LEU 105 2.720 -4.676 14.160 620 HD22 LEU 105 HD22 LEU 105 1.464 -5.740 14.784 621 HD23 LEU 105 HD23 LEU 105 1.397 -4.018 15.120 622 H ASP 106 H ASP 106 1.160 -6.803 13.226 623 HA ASP 106 HA ASP 106 2.760 -8.943 14.141 624 HB2 ASP 106 HB2 ASP 106 3.577 -6.484 14.973 625 HB3 ASP 106 HB3 ASP 106 2.594 -7.010 16.342 626 H VAL 107 H VAL 107 0.611 -6.571 15.996 627 HA VAL 107 HA VAL 107 -1.616 -8.193 16.050 628 HB VAL 107 HB VAL 107 -0.450 -8.503 18.276 629 HG11 VAL 107 HG11 VAL 107 -0.016 -5.523 18.085 630 HG12 VAL 107 HG12 VAL 107 1.200 -6.790 18.238 631 HG13 VAL 107 HG13 VAL 107 0.133 -6.422 19.593 632 HG21 VAL 107 HG21 VAL 107 -2.242 -6.280 18.988 633 HG22 VAL 107 HG22 VAL 107 -2.236 -7.958 19.532 634 HG23 VAL 107 HG23 VAL 107 -2.939 -7.540 17.971 635 H ARG 108 H ARG 108 -3.237 -6.271 15.691 636 HA ARG 108 HA ARG 108 -1.930 -4.073 14.573 637 HB2 ARG 108 HB2 ARG 108 -4.484 -3.221 14.786 638 HB3 ARG 108 HB3 ARG 108 -3.920 -4.255 13.487 639 HG2 ARG 108 HG2 ARG 108 -6.003 -5.104 14.307 640 HG3 ARG 108 HG3 ARG 108 -4.730 -6.230 14.759 641 HD2 ARG 108 HD2 ARG 108 -5.128 -4.273 16.835 642 HD3 ARG 108 HD3 ARG 108 -6.650 -5.043 16.425 643 HE ARG 108 HE ARG 108 -4.258 -6.375 17.472 644 HH11 ARG 108 HH11 ARG 108 -7.648 -6.507 16.617 645 HH12 ARG 108 HH12 ARG 108 -7.900 -8.044 17.370 646 HH21 ARG 108 HH21 ARG 108 -4.605 -8.403 18.456 647 HH22 ARG 108 HH22 ARG 108 -6.181 -9.118 18.406 648 H THR 109 H THR 109 -0.919 -2.676 15.874 649 HA THR 109 HA THR 109 -2.722 -1.619 17.929 650 HB THR 109 HB THR 109 -0.199 -0.702 18.642 651 HG1 THR 109 HG1 THR 109 0.646 -2.374 17.203 652 HG21 THR 109 HG21 THR 109 -1.934 -2.831 19.757 653 HG22 THR 109 HG22 THR 109 -1.430 -1.293 20.458 654 HG23 THR 109 HG23 THR 109 -0.301 -2.647 20.398 655 H CYS 110 H CYS 110 -3.545 -0.305 16.484 656 HA CYS 110 HA CYS 110 -1.784 0.971 14.590 657 HB2 CYS 110 HB2 CYS 110 -4.706 1.043 15.112 658 HB3 CYS 110 HB3 CYS 110 -4.017 2.441 14.290 659 H LEU 111 H LEU 111 -0.412 1.726 16.498 660 HA LEU 111 HA LEU 111 -0.869 3.597 18.355 661 HB2 LEU 111 HB2 LEU 111 1.421 3.159 16.532 662 HB3 LEU 111 HB3 LEU 111 1.405 4.656 17.449 663 HG LEU 111 HG LEU 111 2.693 2.916 18.594 664 HD11 LEU 111 HD11 LEU 111 0.325 4.205 19.755 665 HD12 LEU 111 HD12 LEU 111 2.006 4.222 20.284 666 HD13 LEU 111 HD13 LEU 111 0.969 2.854 20.687 667 HD21 LEU 111 HD21 LEU 111 2.022 0.806 18.711 668 HD22 LEU 111 HD22 LEU 111 0.617 1.232 17.747 669 HD23 LEU 111 HD23 LEU 111 0.523 1.272 19.505 670 HA PRO 112 HA PRO 112 -2.513 6.973 15.896 671 HB2 PRO 112 HB2 PRO 112 -3.864 8.209 17.828 672 HB3 PRO 112 HB3 PRO 112 -4.407 6.664 17.167 673 HG2 PRO 112 HG2 PRO 112 -3.026 7.253 19.742 674 HG3 PRO 112 HG3 PRO 112 -4.275 6.048 19.386 675 HD2 PRO 112 HD2 PRO 112 -1.513 5.577 19.548 676 HD3 PRO 112 HD3 PRO 112 -2.723 4.480 18.856 677 H CYS 113 H CYS 113 -1.049 8.532 15.279 678 HA CYS 113 HA CYS 113 0.044 10.216 17.414 679 HB2 CYS 113 HB2 CYS 113 2.080 10.481 16.246 680 HB3 CYS 113 HB3 CYS 113 1.721 8.766 16.207 681 H GLY 114 H GLY 114 1.182 12.062 15.456 682 HA2 GLY 114 HA2 GLY 114 0.612 13.851 14.122 683 HA3 GLY 114 HA3 GLY 114 -0.983 13.141 13.908 684 HA PRO 115 HA PRO 115 -1.222 16.923 16.623 685 HB2 PRO 115 HB2 PRO 115 -3.521 17.896 15.616 686 HB3 PRO 115 HB3 PRO 115 -1.969 18.148 14.782 687 HG2 PRO 115 HG2 PRO 115 -3.829 15.819 14.486 688 HG3 PRO 115 HG3 PRO 115 -3.461 17.024 13.199 689 HD2 PRO 115 HD2 PRO 115 -2.041 14.865 13.203 690 HD3 PRO 115 HD3 PRO 115 -1.104 16.379 13.315 691 H GLY 116 H GLY 116 -1.583 15.088 17.886 692 HA2 GLY 116 HA2 GLY 116 -2.744 14.757 20.028 693 HA3 GLY 116 HA3 GLY 116 -4.188 15.178 19.158 694 H GLY 117 H GLY 117 -2.439 13.003 17.207 695 HA2 GLY 117 HA2 GLY 117 -2.331 10.768 17.263 696 HA3 GLY 117 HA3 GLY 117 -3.300 10.812 18.660 697 H LYS 118 H LYS 118 -3.944 12.111 15.501 698 HA LYS 118 HA LYS 118 -6.393 10.544 15.276 699 HB2 LYS 118 HB2 LYS 118 -5.599 12.502 13.188 700 HB3 LYS 118 HB3 LYS 118 -7.193 12.101 13.808 701 HG2 LYS 118 HG2 LYS 118 -5.688 13.247 15.921 702 HG3 LYS 118 HG3 LYS 118 -5.523 14.271 14.499 703 HD2 LYS 118 HD2 LYS 118 -8.244 13.295 14.994 704 HD3 LYS 118 HD3 LYS 118 -7.599 14.341 16.260 705 HE2 LYS 118 HE2 LYS 118 -8.500 15.923 14.875 706 HE3 LYS 118 HE3 LYS 118 -6.883 15.813 14.181 707 HZ1 LYS 118 HZ1 LYS 118 -9.217 15.512 12.824 708 HZ2 LYS 118 HZ2 LYS 118 -8.715 13.913 13.054 709 HZ3 LYS 118 HZ3 LYS 118 -7.694 15.016 12.280 710 H GLY 119 H GLY 119 -3.091 10.324 14.024 711 HA2 GLY 119 HA2 GLY 119 -4.079 8.502 11.951 712 HA3 GLY 119 HA3 GLY 119 -2.677 9.548 11.735 713 H ARG 120 H ARG 120 -1.546 7.101 11.457 714 HA ARG 120 HA ARG 120 -0.981 6.203 14.168 715 HB2 ARG 120 HB2 ARG 120 -0.709 4.662 11.579 716 HB3 ARG 120 HB3 ARG 120 -0.428 4.034 13.195 717 HG2 ARG 120 HG2 ARG 120 -2.519 3.216 12.731 718 HG3 ARG 120 HG3 ARG 120 -2.913 4.705 13.592 719 HD2 ARG 120 HD2 ARG 120 -3.443 5.835 11.599 720 HD3 ARG 120 HD3 ARG 120 -2.679 4.600 10.600 721 HE ARG 120 HE ARG 120 -4.587 3.157 11.674 722 HH11 ARG 120 HH11 ARG 120 -4.783 6.430 10.465 723 HH12 ARG 120 HH12 ARG 120 -6.458 6.304 10.050 724 HH21 ARG 120 HH21 ARG 120 -6.783 2.995 11.126 725 HH22 ARG 120 HH22 ARG 120 -7.594 4.355 10.425 726 H CYS 121 H CYS 121 1.317 5.092 14.202 727 HA CYS 121 HA CYS 121 3.200 6.984 12.936 728 HB2 CYS 121 HB2 CYS 121 3.032 5.836 15.605 729 HB3 CYS 121 HB3 CYS 121 4.598 5.506 14.870 730 H PHE 122 H PHE 122 4.794 6.242 11.598 731 HA PHE 122 HA PHE 122 4.889 3.308 11.184 732 HB2 PHE 122 HB2 PHE 122 5.457 5.560 9.238 733 HB3 PHE 122 HB3 PHE 122 5.691 3.848 8.886 734 HD1 PHE 122 HD1 PHE 122 3.220 6.484 9.497 735 HD2 PHE 122 HD2 PHE 122 3.824 2.387 8.506 736 HE1 PHE 122 HE1 PHE 122 0.852 6.285 8.862 737 HE2 PHE 122 HE2 PHE 122 1.455 2.186 7.872 738 HZ PHE 122 HZ PHE 122 -0.037 4.139 8.050 739 H GLY 123 H GLY 123 7.047 6.056 10.471 740 HA2 GLY 123 HA2 GLY 123 9.274 4.445 11.544 741 HA3 GLY 123 HA3 GLY 123 9.442 5.731 10.353 742 HA PRO 124 HA PRO 124 10.216 7.749 14.370 743 HB2 PRO 124 HB2 PRO 124 12.631 8.886 13.598 744 HB3 PRO 124 HB3 PRO 124 12.454 7.346 14.438 745 HG2 PRO 124 HG2 PRO 124 13.346 7.806 11.752 746 HG3 PRO 124 HG3 PRO 124 13.190 6.263 12.603 747 HD2 PRO 124 HD2 PRO 124 11.392 7.501 10.629 748 HD3 PRO 124 HD3 PRO 124 11.513 5.807 11.140 749 H SER 125 H SER 125 11.213 9.253 11.271 750 HA SER 125 HA SER 125 10.077 11.799 12.175 751 HB2 SER 125 HB2 SER 125 12.155 11.031 10.180 752 HB3 SER 125 HB3 SER 125 11.188 12.465 9.781 753 HG SER 125 HG SER 125 11.924 12.620 12.346 754 H ILE 126 H ILE 126 8.395 9.499 11.322 755 HA ILE 126 HA ILE 126 6.993 10.911 9.184 756 HB ILE 126 HB ILE 126 7.603 7.961 9.180 757 HG12 ILE 126 HG12 ILE 126 8.271 9.717 6.901 758 HG13 ILE 126 HG13 ILE 126 9.211 9.978 8.364 759 HG21 ILE 126 HG21 ILE 126 6.391 7.886 7.060 760 HG22 ILE 126 HG22 ILE 126 5.946 9.582 7.258 761 HG23 ILE 126 HG23 ILE 126 5.343 8.374 8.391 762 HD11 ILE 126 HD11 ILE 126 10.530 8.354 7.552 763 HD12 ILE 126 HD12 ILE 126 9.295 7.792 6.433 764 HD13 ILE 126 HD13 ILE 126 9.270 7.254 8.111 765 H CYS 127 H CYS 127 5.055 11.404 9.846 766 HA CYS 127 HA CYS 127 3.470 9.416 11.313 767 HB2 CYS 127 HB2 CYS 127 4.232 12.072 12.211 768 HB3 CYS 127 HB3 CYS 127 2.483 11.872 12.160 769 H CYS 128 H CYS 128 1.657 8.983 10.376 770 HA CYS 128 HA CYS 128 0.578 10.803 8.349 771 HB2 CYS 128 HB2 CYS 128 0.529 7.795 8.569 772 HB3 CYS 128 HB3 CYS 128 -0.471 8.666 7.432 773 H GLY 129 H GLY 129 -1.705 10.588 7.891 774 HA2 GLY 129 HA2 GLY 129 -3.485 9.582 9.927 775 HA3 GLY 129 HA3 GLY 129 -3.570 11.305 9.584 776 H ASP 130 H ASP 130 -5.811 10.090 9.009 777 HA ASP 130 HA ASP 130 -6.003 8.870 6.495 778 HB2 ASP 130 HB2 ASP 130 -7.713 8.816 8.405 779 HB3 ASP 130 HB3 ASP 130 -8.227 10.396 7.818 780 H GLU 131 H GLU 131 -6.660 12.047 7.613 781 HA GLU 131 HA GLU 131 -6.371 13.107 4.918 782 HB2 GLU 131 HB2 GLU 131 -7.913 14.965 5.997 783 HB3 GLU 131 HB3 GLU 131 -8.640 13.533 5.290 784 HG2 GLU 131 HG2 GLU 131 -8.331 12.665 7.805 785 HG3 GLU 131 HG3 GLU 131 -8.449 14.390 8.123 786 H LEU 132 H LEU 132 -4.658 12.600 7.257 787 HA LEU 132 HA LEU 132 -3.717 15.287 7.766 788 HB2 LEU 132 HB2 LEU 132 -4.398 13.071 9.368 789 HB3 LEU 132 HB3 LEU 132 -2.671 13.248 9.447 790 HG LEU 132 HG LEU 132 -4.730 15.328 10.163 791 HD11 LEU 132 HD11 LEU 132 -4.434 13.441 11.750 792 HD12 LEU 132 HD12 LEU 132 -4.024 15.018 12.421 793 HD13 LEU 132 HD13 LEU 132 -2.745 13.911 11.921 794 HD21 LEU 132 HD21 LEU 132 -1.726 15.482 10.136 795 HD22 LEU 132 HD22 LEU 132 -2.764 16.640 10.965 796 HD23 LEU 132 HD23 LEU 132 -2.859 16.463 9.213 797 H GLY 133 H GLY 133 -3.306 12.441 6.135 798 HA2 GLY 133 HA2 GLY 133 -1.634 11.607 4.884 799 HA3 GLY 133 HA3 GLY 133 -1.151 13.263 4.814 800 H CYS 134 H CYS 134 1.062 13.379 5.260 801 HA CYS 134 HA CYS 134 1.862 12.087 7.728 802 HB2 CYS 134 HB2 CYS 134 2.427 10.936 5.294 803 HB3 CYS 134 HB3 CYS 134 3.926 11.659 5.821 804 H PHE 135 H PHE 135 2.895 13.360 8.979 805 HA PHE 135 HA PHE 135 4.330 15.621 7.833 806 HB2 PHE 135 HB2 PHE 135 4.744 15.099 10.702 807 HB3 PHE 135 HB3 PHE 135 4.198 16.573 9.915 808 HD1 PHE 135 HD1 PHE 135 3.000 13.218 10.922 809 HD2 PHE 135 HD2 PHE 135 2.032 17.291 10.245 810 HE1 PHE 135 HE1 PHE 135 0.729 12.802 11.768 811 HE2 PHE 135 HE2 PHE 135 -0.243 16.895 11.092 812 HZ PHE 135 HZ PHE 135 -0.896 14.644 11.844 813 H VAL 136 H VAL 136 6.212 14.863 6.924 814 HA VAL 136 HA VAL 136 7.450 12.610 8.253 815 HB VAL 136 HB VAL 136 8.449 13.858 5.701 816 HG11 VAL 136 HG11 VAL 136 9.995 12.270 5.965 817 HG12 VAL 136 HG12 VAL 136 8.721 11.086 5.677 818 HG13 VAL 136 HG13 VAL 136 9.129 11.561 7.324 819 HG21 VAL 136 HG21 VAL 136 6.021 13.349 5.477 820 HG22 VAL 136 HG22 VAL 136 6.348 11.684 5.946 821 HG23 VAL 136 HG23 VAL 136 7.018 12.323 4.448 822 H GLY 137 H GLY 137 8.020 13.557 10.047 823 HA2 GLY 137 HA2 GLY 137 9.942 14.195 11.302 824 HA3 GLY 137 HA3 GLY 137 10.543 15.073 9.915 825 H THR 138 H THR 138 8.067 15.125 12.430 826 HA THR 138 HA THR 138 8.473 17.953 12.868 827 HB THR 138 HB THR 138 6.130 18.588 12.620 828 HG1 THR 138 HG1 THR 138 4.595 17.187 12.289 829 HG21 THR 138 HG21 THR 138 7.062 19.077 10.594 830 HG22 THR 138 HG22 THR 138 5.771 17.976 10.117 831 HG23 THR 138 HG23 THR 138 7.425 17.394 10.223 832 H ALA 139 H ALA 139 6.757 18.573 14.871 833 HA ALA 139 HA ALA 139 7.298 16.684 16.887 834 HB1 ALA 139 HB1 ALA 139 6.250 19.364 16.690 835 HB2 ALA 139 HB2 ALA 139 7.017 18.558 18.058 836 HB3 ALA 139 HB3 ALA 139 5.280 18.396 17.800 837 H GLU 140 H GLU 140 4.901 16.831 14.480 838 HA GLU 140 HA GLU 140 2.739 15.695 15.930 839 HB2 GLU 140 HB2 GLU 140 3.469 15.905 13.027 840 HB3 GLU 140 HB3 GLU 140 2.159 14.839 13.508 841 HG2 GLU 140 HG2 GLU 140 0.797 16.580 13.468 842 HG3 GLU 140 HG3 GLU 140 1.685 17.255 14.831 843 H ALA 141 H ALA 141 5.741 14.585 14.874 844 HA ALA 141 HA ALA 141 4.995 11.770 15.212 845 HB1 ALA 141 HB1 ALA 141 6.577 13.113 13.243 846 HB2 ALA 141 HB2 ALA 141 6.038 11.434 13.287 847 HB3 ALA 141 HB3 ALA 141 7.551 11.896 14.069 848 H LEU 142 H LEU 142 6.767 14.278 16.735 849 HA LEU 142 HA LEU 142 8.916 12.878 17.704 850 HB2 LEU 142 HB2 LEU 142 9.295 14.616 19.102 851 HB3 LEU 142 HB3 LEU 142 8.351 15.273 17.810 852 HG LEU 142 HG LEU 142 7.373 16.338 19.480 853 HD11 LEU 142 HD11 LEU 142 5.597 15.155 18.525 854 HD12 LEU 142 HD12 LEU 142 5.324 15.266 20.266 855 HD13 LEU 142 HD13 LEU 142 5.886 13.763 19.559 856 HD21 LEU 142 HD21 LEU 142 7.043 14.674 21.700 857 HD22 LEU 142 HD22 LEU 142 8.188 16.002 21.516 858 HD23 LEU 142 HD23 LEU 142 8.670 14.359 21.098 859 H ARG 143 H ARG 143 5.656 12.297 18.537 860 HA ARG 143 HA ARG 143 6.256 10.902 21.032 861 HB2 ARG 143 HB2 ARG 143 3.865 10.112 20.800 862 HB3 ARG 143 HB3 ARG 143 4.032 11.855 20.849 863 HG2 ARG 143 HG2 ARG 143 3.805 11.968 18.431 864 HG3 ARG 143 HG3 ARG 143 3.647 10.212 18.365 865 HD2 ARG 143 HD2 ARG 143 1.792 12.080 19.835 866 HD3 ARG 143 HD3 ARG 143 1.474 11.372 18.256 867 HE ARG 143 HE ARG 143 1.281 9.240 19.289 868 HH11 ARG 143 HH11 ARG 143 1.597 11.872 21.574 869 HH12 ARG 143 HH12 ARG 143 0.965 10.956 22.897 870 HH21 ARG 143 HH21 ARG 143 0.452 8.046 21.035 871 HH22 ARG 143 HH22 ARG 143 0.318 8.788 22.595 872 H CYS 144 H CYS 144 6.434 10.619 17.903 873 HA CYS 144 HA CYS 144 5.943 7.853 17.303 874 HB2 CYS 144 HB2 CYS 144 6.852 9.915 15.684 875 HB3 CYS 144 HB3 CYS 144 8.175 8.758 15.671 876 H GLN 145 H GLN 145 8.560 9.408 18.872 877 HA GLN 145 HA GLN 145 10.627 7.608 18.751 878 HB2 GLN 145 HB2 GLN 145 10.549 9.830 19.962 879 HB3 GLN 145 HB3 GLN 145 9.781 8.983 21.296 880 HG2 GLN 145 HG2 GLN 145 11.808 8.586 22.083 881 HG3 GLN 145 HG3 GLN 145 12.030 7.466 20.739 882 HE21 GLN 145 HE21 GLN 145 12.422 10.835 21.705 883 HE22 GLN 145 HE22 GLN 145 13.763 11.166 20.667 884 H GLU 146 H GLU 146 7.547 7.065 20.281 885 HA GLU 146 HA GLU 146 8.591 4.962 21.986 886 HB2 GLU 146 HB2 GLU 146 5.790 5.950 21.449 887 HB3 GLU 146 HB3 GLU 146 6.130 4.567 22.478 888 HG2 GLU 146 HG2 GLU 146 6.615 5.869 24.200 889 HG3 GLU 146 HG3 GLU 146 7.741 6.827 23.240 890 H GLU 147 H GLU 147 8.269 5.090 18.815 891 HA GLU 147 HA GLU 147 6.886 2.595 18.366 892 HB2 GLU 147 HB2 GLU 147 8.050 4.729 16.695 893 HB3 GLU 147 HB3 GLU 147 8.201 3.111 16.033 894 HG2 GLU 147 HG2 GLU 147 5.552 3.964 17.057 895 HG3 GLU 147 HG3 GLU 147 6.119 4.628 15.526 896 H ASN 148 H ASN 148 9.771 3.369 19.705 897 HA ASN 148 HA ASN 148 11.461 1.504 18.335 898 HB2 ASN 148 HB2 ASN 148 13.031 1.895 20.200 899 HB3 ASN 148 HB3 ASN 148 12.440 3.408 19.522 900 HD21 ASN 148 HD21 ASN 148 13.543 2.778 22.171 901 HD22 ASN 148 HD22 ASN 148 12.347 3.292 23.306 902 H TYR 149 H TYR 149 9.206 1.407 20.999 903 HA TYR 149 HA TYR 149 10.125 -1.169 21.950 904 HB2 TYR 149 HB2 TYR 149 7.703 0.509 22.621 905 HB3 TYR 149 HB3 TYR 149 8.026 -1.059 23.355 906 HD1 TYR 149 HD1 TYR 149 10.247 -1.345 24.602 907 HD2 TYR 149 HD2 TYR 149 8.665 2.448 23.503 908 HE1 TYR 149 HE1 TYR 149 11.688 -0.265 26.276 909 HE2 TYR 149 HE2 TYR 149 10.102 3.539 25.172 910 HH TYR 149 HH TYR 149 12.381 1.668 27.151 911 H LEU 150 H LEU 150 8.775 -0.501 19.131 912 HA LEU 150 HA LEU 150 7.226 -2.996 19.097 913 HB2 LEU 150 HB2 LEU 150 6.399 -0.590 17.498 914 HB3 LEU 150 HB3 LEU 150 5.488 -2.055 17.807 915 HG LEU 150 HG LEU 150 6.205 -0.120 19.998 916 HD11 LEU 150 HD11 LEU 150 4.454 1.213 19.537 917 HD12 LEU 150 HD12 LEU 150 3.464 -0.123 18.949 918 HD13 LEU 150 HD13 LEU 150 4.673 0.608 17.894 919 HD21 LEU 150 HD21 LEU 150 4.735 -1.300 21.319 920 HD22 LEU 150 HD22 LEU 150 5.431 -2.591 20.339 921 HD23 LEU 150 HD23 LEU 150 3.841 -1.939 19.940 922 HA PRO 151 HA PRO 151 9.924 -3.630 15.594 923 HB2 PRO 151 HB2 PRO 151 9.166 -6.117 14.962 924 HB3 PRO 151 HB3 PRO 151 10.072 -5.781 16.442 925 HG2 PRO 151 HG2 PRO 151 7.141 -6.257 16.080 926 HG3 PRO 151 HG3 PRO 151 8.224 -6.855 17.350 927 HD2 PRO 151 HD2 PRO 151 6.547 -4.687 17.630 928 HD3 PRO 151 HD3 PRO 151 8.020 -4.943 18.584 929 H SER 152 H SER 152 6.793 -2.786 15.444 930 HA SER 152 HA SER 152 6.739 -2.231 12.722 931 HB2 SER 152 HB2 SER 152 5.804 -4.932 13.426 932 HB3 SER 152 HB3 SER 152 4.666 -4.003 12.452 933 HG SER 152 HG SER 152 6.600 -3.562 11.086 934 HA PRO 153 HA PRO 153 3.349 0.134 14.291 935 HB2 PRO 153 HB2 PRO 153 2.373 1.189 12.027 936 HB3 PRO 153 HB3 PRO 153 3.987 1.600 12.615 937 HG2 PRO 153 HG2 PRO 153 3.196 -0.329 10.466 938 HG3 PRO 153 HG3 PRO 153 4.519 0.852 10.479 939 HD2 PRO 153 HD2 PRO 153 4.829 -1.826 11.028 940 HD3 PRO 153 HD3 PRO 153 5.918 -0.554 11.614 941 H CYS 154 H CYS 154 1.457 -0.231 11.461 942 HA CYS 154 HA CYS 154 0.042 -2.583 12.236 943 HB2 CYS 154 HB2 CYS 154 -2.007 -1.699 12.952 944 HB3 CYS 154 HB3 CYS 154 -0.811 -0.742 13.813 945 H GLN 155 H GLN 155 -0.423 -3.557 10.391 946 HA GLN 155 HA GLN 155 -0.152 -2.265 7.907 947 HB2 GLN 155 HB2 GLN 155 -0.540 -4.291 6.960 948 HB3 GLN 155 HB3 GLN 155 -0.325 -4.838 8.616 949 HG2 GLN 155 HG2 GLN 155 -2.952 -4.321 7.235 950 HG3 GLN 155 HG3 GLN 155 -2.255 -5.898 7.605 951 HE21 GLN 155 HE21 GLN 155 -4.800 -4.853 8.439 952 HE22 GLN 155 HE22 GLN 155 -4.788 -4.822 10.166 953 H SER 156 H SER 156 -1.474 -1.174 6.541 954 HA SER 156 HA SER 156 -4.177 -1.329 6.203 955 HB2 SER 156 HB2 SER 156 -3.903 -0.419 8.755 956 HB3 SER 156 HB3 SER 156 -3.995 1.102 7.876 957 HG SER 156 HG SER 156 -5.853 -1.018 7.562 958 H GLY 157 H GLY 157 -2.839 -0.926 4.223 959 HA2 GLY 157 HA2 GLY 157 -3.490 1.359 2.914 960 HA3 GLY 157 HA3 GLY 157 -1.920 1.717 3.645 961 H GLN 158 H GLN 158 -3.610 -0.245 1.279 962 HA GLN 158 HA GLN 158 -0.983 -1.284 0.454 963 HB2 GLN 158 HB2 GLN 158 -2.919 -2.854 1.124 964 HB3 GLN 158 HB3 GLN 158 -3.667 -2.368 -0.389 965 HG2 GLN 158 HG2 GLN 158 -2.419 -3.772 -1.549 966 HG3 GLN 158 HG3 GLN 158 -0.935 -3.179 -0.803 967 HE21 GLN 158 HE21 GLN 158 -3.124 -5.734 -1.021 968 HE22 GLN 158 HE22 GLN 158 -2.498 -6.710 0.259 969 H LYS 159 H LYS 159 -1.021 0.961 -0.299 970 HA LYS 159 HA LYS 159 -1.906 1.022 -3.089 971 HB2 LYS 159 HB2 LYS 159 -1.474 3.366 -1.293 972 HB3 LYS 159 HB3 LYS 159 -1.807 3.468 -3.011 973 HG2 LYS 159 HG2 LYS 159 -3.899 3.767 -2.075 974 HG3 LYS 159 HG3 LYS 159 -3.888 2.046 -2.461 975 HD2 LYS 159 HD2 LYS 159 -3.204 1.595 -0.102 976 HD3 LYS 159 HD3 LYS 159 -3.417 3.311 0.238 977 HE2 LYS 159 HE2 LYS 159 -5.780 3.043 -0.631 978 HE3 LYS 159 HE3 LYS 159 -5.499 1.303 -0.573 979 HZ1 LYS 159 HZ1 LYS 159 -6.593 2.215 1.433 980 HZ2 LYS 159 HZ2 LYS 159 -5.196 3.111 1.761 981 HZ3 LYS 159 HZ3 LYS 159 -5.136 1.421 1.768 982 HA PRO 160 HA PRO 160 2.790 0.966 -2.393 983 HB2 PRO 160 HB2 PRO 160 3.265 -1.098 -4.222 984 HB3 PRO 160 HB3 PRO 160 3.272 -1.233 -2.459 985 HG2 PRO 160 HG2 PRO 160 1.085 -1.842 -4.397 986 HG3 PRO 160 HG3 PRO 160 1.540 -2.697 -2.910 987 HD2 PRO 160 HD2 PRO 160 -0.592 -1.090 -2.951 988 HD3 PRO 160 HD3 PRO 160 0.477 -1.129 -1.541 989 H CYS 161 H CYS 161 2.992 2.785 -3.268 990 HA CYS 161 HA CYS 161 3.034 3.198 -6.149 991 HB2 CYS 161 HB2 CYS 161 2.761 5.456 -5.775 992 HB3 CYS 161 HB3 CYS 161 1.912 4.813 -4.374 993 H GLY 162 H GLY 162 4.997 5.249 -6.075 994 HA2 GLY 162 HA2 GLY 162 7.292 5.225 -6.580 995 HA3 GLY 162 HA3 GLY 162 7.215 5.130 -4.834 996 H SER 163 H SER 163 9.303 4.348 -5.152 997 HA SER 163 HA SER 163 9.777 1.725 -6.245 998 HB2 SER 163 HB2 SER 163 11.333 4.031 -5.439 999 HB3 SER 163 HB3 SER 163 12.019 2.558 -4.762 1000 HG SER 163 HG SER 163 12.823 2.256 -6.665 1001 H GLY 164 H GLY 164 7.879 1.477 -4.315 1002 HA2 GLY 164 HA2 GLY 164 7.933 -0.513 -2.846 1003 HA3 GLY 164 HA3 GLY 164 9.342 0.195 -2.087 1004 H GLY 165 H GLY 165 6.967 2.597 -2.730 1005 HA2 GLY 165 HA2 GLY 165 6.240 2.466 0.127 1006 HA3 GLY 165 HA3 GLY 165 6.192 3.904 -0.864 1007 H ARG 166 H ARG 166 4.225 2.193 0.866 1008 HA ARG 166 HA ARG 166 2.040 2.138 -1.080 1009 HB2 ARG 166 HB2 ARG 166 0.734 0.832 0.504 1010 HB3 ARG 166 HB3 ARG 166 2.263 0.037 0.183 1011 HG2 ARG 166 HG2 ARG 166 2.038 1.854 2.534 1012 HG3 ARG 166 HG3 ARG 166 1.314 0.251 2.619 1013 HD2 ARG 166 HD2 ARG 166 3.306 -0.789 2.708 1014 HD3 ARG 166 HD3 ARG 166 4.063 0.343 1.588 1015 HE ARG 166 HE ARG 166 4.438 1.834 3.397 1016 HH11 ARG 166 HH11 ARG 166 3.173 -1.273 4.402 1017 HH12 ARG 166 HH12 ARG 166 3.706 -1.096 6.038 1018 HH21 ARG 166 HH21 ARG 166 5.132 2.052 5.560 1019 HH22 ARG 166 HH22 ARG 166 4.812 0.784 6.694 1020 H CYS 167 H CYS 167 -0.056 3.194 -0.438 1021 HA CYS 167 HA CYS 167 0.375 5.749 0.517 1022 HB2 CYS 167 HB2 CYS 167 -1.940 4.218 -0.346 1023 HB3 CYS 167 HB3 CYS 167 -2.329 5.250 1.008 1024 H ALA 168 H ALA 168 0.854 6.326 2.519 1025 HA ALA 168 HA ALA 168 0.020 4.519 4.667 1026 HB1 ALA 168 HB1 ALA 168 1.448 5.874 6.128 1027 HB2 ALA 168 HB2 ALA 168 1.776 6.974 4.785 1028 HB3 ALA 168 HB3 ALA 168 2.337 5.304 4.716 1029 H ALA 169 H ALA 169 -0.806 7.469 3.084 1030 HA ALA 169 HA ALA 169 -3.187 7.814 4.692 1031 HB1 ALA 169 HB1 ALA 169 -1.903 8.973 6.125 1032 HB2 ALA 169 HB2 ALA 169 -2.400 10.254 5.040 1033 HB3 ALA 169 HB3 ALA 169 -0.784 9.549 4.912 1034 H ALA 170 H ALA 170 -4.495 9.614 3.797 1035 HA ALA 170 HA ALA 170 -4.832 9.490 1.057 1036 HB1 ALA 170 HB1 ALA 170 -6.417 11.200 1.181 1037 HB2 ALA 170 HB2 ALA 170 -5.582 11.996 2.516 1038 HB3 ALA 170 HB3 ALA 170 -6.436 10.475 2.789 1039 H GLY 171 H GLY 171 -4.029 10.426 -0.700 1040 HA2 GLY 171 HA2 GLY 171 -2.802 11.737 -2.104 1041 HA3 GLY 171 HA3 GLY 171 -2.800 12.940 -0.840 1042 H ILE 172 H ILE 172 -1.419 11.179 1.058 1043 HA ILE 172 HA ILE 172 1.296 11.558 0.055 1044 HB ILE 172 HB ILE 172 1.986 11.820 2.219 1045 HG12 ILE 172 HG12 ILE 172 0.227 11.209 4.108 1046 HG13 ILE 172 HG13 ILE 172 -0.308 10.056 2.889 1047 HG21 ILE 172 HG21 ILE 172 0.584 13.655 1.575 1048 HG22 ILE 172 HG22 ILE 172 0.359 13.333 3.297 1049 HG23 ILE 172 HG23 ILE 172 -0.857 12.807 2.132 1050 HD11 ILE 172 HD11 ILE 172 2.569 10.197 3.277 1051 HD12 ILE 172 HD12 ILE 172 1.519 8.789 3.116 1052 HD13 ILE 172 HD13 ILE 172 1.664 9.610 4.662 1053 H CYS 173 H CYS 173 2.472 9.927 -0.576 1054 HA CYS 173 HA CYS 173 1.706 7.206 0.205 1055 HB2 CYS 173 HB2 CYS 173 1.733 7.762 -2.204 1056 HB3 CYS 173 HB3 CYS 173 3.455 8.097 -2.079 1057 H CYS 174 H CYS 174 2.855 6.454 1.878 1058 HA CYS 174 HA CYS 174 5.681 7.216 1.999 1059 HB2 CYS 174 HB2 CYS 174 3.611 7.025 4.033 1060 HB3 CYS 174 HB3 CYS 174 5.096 6.194 4.484 1061 H SER 175 H SER 175 7.255 5.795 2.338 1062 HA SER 175 HA SER 175 6.587 2.942 1.994 1063 HB2 SER 175 HB2 SER 175 8.715 2.715 0.847 1064 HB3 SER 175 HB3 SER 175 7.866 4.078 0.134 1065 HG SER 175 HG SER 175 10.225 4.023 1.509 1066 HA PRO 176 HA PRO 176 8.806 2.206 5.758 1067 HB2 PRO 176 HB2 PRO 176 10.396 0.083 5.363 1068 HB3 PRO 176 HB3 PRO 176 8.636 -0.055 5.299 1069 HG2 PRO 176 HG2 PRO 176 10.608 0.081 3.064 1070 HG3 PRO 176 HG3 PRO 176 9.136 -0.894 3.203 1071 HD2 PRO 176 HD2 PRO 176 9.343 1.477 1.793 1072 HD3 PRO 176 HD3 PRO 176 7.823 0.780 2.381 1073 H ASP 177 H ASP 177 10.173 3.960 3.642 1074 HA ASP 177 HA ASP 177 12.678 4.246 5.087 1075 HB2 ASP 177 HB2 ASP 177 12.476 3.792 2.108 1076 HB3 ASP 177 HB3 ASP 177 13.877 4.554 2.856 1077 H GLY 178 H GLY 178 10.341 5.529 2.765 1078 HA2 GLY 178 HA2 GLY 178 10.739 8.162 3.852 1079 HA3 GLY 178 HA3 GLY 178 11.176 8.023 2.179 1080 H CYS 179 H CYS 179 9.633 9.326 1.322 1081 HA CYS 179 HA CYS 179 6.949 8.223 1.180 1082 HB2 CYS 179 HB2 CYS 179 7.469 10.201 3.047 1083 HB3 CYS 179 HB3 CYS 179 6.836 11.104 1.677 1084 H HIS 180 H HIS 180 5.635 9.212 -0.545 1085 HA HIS 180 HA HIS 180 7.045 10.985 -2.383 1086 HB2 HIS 180 HB2 HIS 180 6.057 8.226 -3.162 1087 HB3 HIS 180 HB3 HIS 180 6.519 9.471 -4.315 1088 HD1 HIS 180 HD1 HIS 180 7.852 6.636 -2.585 1089 HD2 HIS 180 HD2 HIS 180 9.373 10.276 -3.882 1090 HE1 HIS 180 HE1 HIS 180 10.347 6.330 -2.666 1091 HE2 HIS 180 HE2 HIS 180 11.227 8.497 -3.600 1092 H GLU 181 H GLU 181 5.645 12.100 -3.796 1093 HA GLU 181 HA GLU 181 3.040 12.553 -2.809 1094 HB2 GLU 181 HB2 GLU 181 4.130 13.276 -5.532 1095 HB3 GLU 181 HB3 GLU 181 2.742 14.005 -4.737 1096 HG2 GLU 181 HG2 GLU 181 4.017 15.435 -3.625 1097 HG3 GLU 181 HG3 GLU 181 5.110 14.160 -3.089 1098 H ASP 182 H ASP 182 1.091 11.706 -3.326 1099 HA ASP 182 HA ASP 182 0.859 10.089 -5.749 1100 HB2 ASP 182 HB2 ASP 182 0.429 8.081 -4.733 1101 HB3 ASP 182 HB3 ASP 182 1.551 8.765 -3.554 1102 HA PRO 183 HA PRO 183 -3.014 12.365 -5.417 1103 HB2 PRO 183 HB2 PRO 183 -3.584 11.770 -8.148 1104 HB3 PRO 183 HB3 PRO 183 -2.942 13.269 -7.479 1105 HG2 PRO 183 HG2 PRO 183 -1.561 11.536 -9.149 1106 HG3 PRO 183 HG3 PRO 183 -0.820 12.759 -8.105 1107 HD2 PRO 183 HD2 PRO 183 -1.114 9.820 -7.674 1108 HD3 PRO 183 HD3 PRO 183 0.220 10.904 -7.226 1109 H ALA 184 H ALA 184 -2.607 9.047 -6.091 1110 HA ALA 184 HA ALA 184 -5.250 8.348 -6.780 1111 HB1 ALA 184 HB1 ALA 184 -3.346 6.870 -7.181 1112 HB2 ALA 184 HB2 ALA 184 -4.596 6.063 -6.234 1113 HB3 ALA 184 HB3 ALA 184 -3.139 6.664 -5.441 1114 H CYS 185 H CYS 185 -3.812 9.168 -3.750 1115 HA CYS 185 HA CYS 185 -6.048 7.988 -2.306 1116 HB2 CYS 185 HB2 CYS 185 -3.321 8.890 -1.478 1117 HB3 CYS 185 HB3 CYS 185 -4.589 8.627 -0.283 1118 H ASP 186 H ASP 186 -6.131 10.606 -3.851 1119 HA ASP 186 HA ASP 186 -6.526 12.691 -2.001 1120 HB2 ASP 186 HB2 ASP 186 -6.978 12.289 -4.897 1121 HB3 ASP 186 HB3 ASP 186 -7.909 13.562 -4.115 1122 HA PRO 187 HA PRO 187 -11.105 11.483 -2.314 1123 HB2 PRO 187 HB2 PRO 187 -11.339 8.736 -2.882 1124 HB3 PRO 187 HB3 PRO 187 -11.823 10.084 -3.906 1125 HG2 PRO 187 HG2 PRO 187 -9.775 8.245 -4.429 1126 HG3 PRO 187 HG3 PRO 187 -10.087 9.755 -5.298 1127 HD2 PRO 187 HD2 PRO 187 -8.060 9.142 -3.244 1128 HD3 PRO 187 HD3 PRO 187 -8.044 10.376 -4.519 1129 H GLU 188 H GLU 188 -10.009 11.713 -0.283 1130 HA GLU 188 HA GLU 188 -10.985 10.444 1.689 1131 HB2 GLU 188 HB2 GLU 188 -9.326 8.921 2.604 1132 HB3 GLU 188 HB3 GLU 188 -9.894 8.432 1.019 1133 HG2 GLU 188 HG2 GLU 188 -7.906 9.023 -0.025 1134 HG3 GLU 188 HG3 GLU 188 -7.366 9.927 1.376 1135 H ALA 189 H ALA 189 -8.665 12.445 0.293 1136 HA ALA 189 HA ALA 189 -7.298 13.370 2.522 1137 HB1 ALA 189 HB1 ALA 189 -6.908 13.466 -0.184 1138 HB2 ALA 189 HB2 ALA 189 -5.985 14.396 1.022 1139 HB3 ALA 189 HB3 ALA 189 -7.361 15.142 0.209 1140 H ALA 190 H ALA 190 -10.431 13.968 1.600 1141 HA ALA 190 HA ALA 190 -10.712 16.603 2.534 1142 HB1 ALA 190 HB1 ALA 190 -12.714 14.391 2.062 1143 HB2 ALA 190 HB2 ALA 190 -12.233 15.607 0.879 1144 HB3 ALA 190 HB3 ALA 190 -13.092 16.091 2.341 1145 H PHE 191 H PHE 191 -11.046 17.251 4.360 1146 HA PHE 191 HA PHE 191 -11.152 15.611 6.765 1147 HB2 PHE 191 HB2 PHE 191 -10.616 17.787 7.899 1148 HB3 PHE 191 HB3 PHE 191 -9.385 17.265 6.758 1149 HD1 PHE 191 HD1 PHE 191 -9.129 18.438 4.590 1150 HD2 PHE 191 HD2 PHE 191 -11.837 19.819 7.573 1151 HE1 PHE 191 HE1 PHE 191 -9.237 20.632 3.476 1152 HE2 PHE 191 HE2 PHE 191 -11.943 22.013 6.464 1153 HZ PHE 191 HZ PHE 191 -10.643 22.421 4.414 1154 H SER 192 H SER 192 -13.359 15.055 6.788 1155 HA SER 192 HA SER 192 -15.357 17.128 6.521 1156 HB2 SER 192 HB2 SER 192 -16.962 15.265 6.992 1157 HB3 SER 192 HB3 SER 192 -15.894 14.955 5.625 1158 HG SER 192 HG SER 192 -14.669 14.030 7.769 Start of MODEL 20 1 H1 ALA 1 H1 ALA 1 12.907 40.417 -0.213 2 H2 ALA 1 H2 ALA 1 12.688 38.871 -0.926 3 H3 ALA 1 H3 ALA 1 14.270 39.495 -0.692 4 HA ALA 1 HA ALA 1 13.501 39.621 1.746 5 HB1 ALA 1 HB1 ALA 1 11.950 37.990 2.411 6 HB2 ALA 1 HB2 ALA 1 11.941 37.229 0.820 7 HB3 ALA 1 HB3 ALA 1 11.205 38.817 1.042 8 H VAL 2 H VAL 2 15.753 39.285 0.705 9 HA VAL 2 HA VAL 2 17.765 38.054 0.759 10 HB VAL 2 HB VAL 2 16.309 36.437 2.847 11 HG11 VAL 2 HG11 VAL 2 19.132 36.773 2.057 12 HG12 VAL 2 HG12 VAL 2 18.302 35.386 2.764 13 HG13 VAL 2 HG13 VAL 2 18.798 36.733 3.789 14 HG21 VAL 2 HG21 VAL 2 16.908 38.082 4.484 15 HG22 VAL 2 HG22 VAL 2 16.022 38.887 3.189 16 HG23 VAL 2 HG23 VAL 2 17.778 39.035 3.282 17 H LEU 3 H LEU 3 16.321 37.203 -1.350 18 HA LEU 3 HA LEU 3 16.742 34.207 -1.476 19 HB2 LEU 3 HB2 LEU 3 14.825 34.024 -2.847 20 HB3 LEU 3 HB3 LEU 3 14.339 34.905 -1.412 21 HG LEU 3 HG LEU 3 15.074 36.602 -3.704 22 HD11 LEU 3 HD11 LEU 3 13.509 34.344 -4.213 23 HD12 LEU 3 HD12 LEU 3 13.717 35.765 -5.242 24 HD13 LEU 3 HD13 LEU 3 12.380 35.696 -4.094 25 HD21 LEU 3 HD21 LEU 3 13.031 36.509 -1.537 26 HD22 LEU 3 HD22 LEU 3 12.730 37.495 -2.969 27 HD23 LEU 3 HD23 LEU 3 14.153 37.798 -1.973 28 H ASP 4 H ASP 4 18.508 33.878 -2.788 29 HA ASP 4 HA ASP 4 18.486 35.016 -5.425 30 HB2 ASP 4 HB2 ASP 4 20.054 36.261 -3.377 31 HB3 ASP 4 HB3 ASP 4 21.163 35.342 -4.390 32 H LEU 5 H LEU 5 21.446 33.887 -5.745 33 HA LEU 5 HA LEU 5 20.475 31.189 -5.288 34 HB2 LEU 5 HB2 LEU 5 21.798 31.907 -7.394 35 HB3 LEU 5 HB3 LEU 5 23.208 31.803 -6.361 36 HG LEU 5 HG LEU 5 23.370 29.673 -6.992 37 HD11 LEU 5 HD11 LEU 5 21.251 29.572 -4.940 38 HD12 LEU 5 HD12 LEU 5 22.697 28.570 -5.174 39 HD13 LEU 5 HD13 LEU 5 21.229 28.210 -6.073 40 HD21 LEU 5 HD21 LEU 5 21.930 28.623 -8.491 41 HD22 LEU 5 HD22 LEU 5 21.759 30.343 -8.840 42 HD23 LEU 5 HD23 LEU 5 20.524 29.508 -7.901 43 H ASP 6 H ASP 6 21.520 33.274 -3.315 44 HA ASP 6 HA ASP 6 23.708 31.903 -2.031 45 HB2 ASP 6 HB2 ASP 6 22.253 34.431 -1.616 46 HB3 ASP 6 HB3 ASP 6 22.680 33.612 -0.114 47 H VAL 7 H VAL 7 20.702 32.902 -0.359 48 HA VAL 7 HA VAL 7 19.979 30.097 -0.350 49 HB VAL 7 HB VAL 7 21.389 30.025 1.597 50 HG11 VAL 7 HG11 VAL 7 20.208 32.672 2.137 51 HG12 VAL 7 HG12 VAL 7 21.847 32.083 2.405 52 HG13 VAL 7 HG13 VAL 7 20.563 31.664 3.538 53 HG21 VAL 7 HG21 VAL 7 19.766 29.549 3.405 54 HG22 VAL 7 HG22 VAL 7 19.316 28.816 1.869 55 HG23 VAL 7 HG23 VAL 7 18.499 30.277 2.419 56 H ARG 8 H ARG 8 17.955 30.240 -0.932 57 HA ARG 8 HA ARG 8 16.647 32.738 -0.545 58 HB2 ARG 8 HB2 ARG 8 15.927 31.877 -2.522 59 HB3 ARG 8 HB3 ARG 8 16.058 30.220 -1.961 60 HG2 ARG 8 HG2 ARG 8 13.750 30.883 -2.466 61 HG3 ARG 8 HG3 ARG 8 13.963 30.387 -0.792 62 HD2 ARG 8 HD2 ARG 8 13.830 32.630 -0.047 63 HD3 ARG 8 HD3 ARG 8 14.000 33.240 -1.680 64 HE ARG 8 HE ARG 8 11.769 31.716 -1.801 65 HH11 ARG 8 HH11 ARG 8 12.756 34.398 0.198 66 HH12 ARG 8 HH12 ARG 8 11.141 34.986 0.413 67 HH21 ARG 8 HH21 ARG 8 9.666 32.473 -1.526 68 HH22 ARG 8 HH22 ARG 8 9.380 33.893 -0.576 69 H THR 9 H THR 9 15.703 33.300 1.334 70 HA THR 9 HA THR 9 15.184 31.171 3.191 71 HB THR 9 HB THR 9 15.364 33.419 4.109 72 HG1 THR 9 HG1 THR 9 13.031 33.580 4.943 73 HG21 THR 9 HG21 THR 9 12.913 34.196 2.558 74 HG22 THR 9 HG22 THR 9 14.560 34.613 2.086 75 HG23 THR 9 HG23 THR 9 13.899 35.217 3.604 76 H CYS 10 H CYS 10 13.953 29.618 2.511 77 HA CYS 10 HA CYS 10 11.995 29.912 0.503 78 HB2 CYS 10 HB2 CYS 10 13.282 27.777 1.794 79 HB3 CYS 10 HB3 CYS 10 11.567 27.520 2.057 80 H LEU 11 H LEU 11 10.067 30.846 0.689 81 HA LEU 11 HA LEU 11 8.769 31.923 2.702 82 HB2 LEU 11 HB2 LEU 11 8.003 31.344 0.217 83 HB3 LEU 11 HB3 LEU 11 6.987 30.200 1.075 84 HG LEU 11 HG LEU 11 6.164 32.152 2.466 85 HD11 LEU 11 HD11 LEU 11 8.043 33.523 0.689 86 HD12 LEU 11 HD12 LEU 11 7.411 34.003 2.262 87 HD13 LEU 11 HD13 LEU 11 6.458 34.284 0.806 88 HD21 LEU 11 HD21 LEU 11 5.202 31.081 0.214 89 HD22 LEU 11 HD22 LEU 11 5.440 32.739 -0.337 90 HD23 LEU 11 HD23 LEU 11 4.412 32.414 1.058 91 HA PRO 12 HA PRO 12 8.080 28.862 5.850 92 HB2 PRO 12 HB2 PRO 12 6.441 30.341 7.425 93 HB3 PRO 12 HB3 PRO 12 8.185 30.600 7.342 94 HG2 PRO 12 HG2 PRO 12 5.982 32.057 5.922 95 HG3 PRO 12 HG3 PRO 12 7.385 32.713 6.779 96 HD2 PRO 12 HD2 PRO 12 7.351 32.497 4.103 97 HD3 PRO 12 HD3 PRO 12 8.839 32.221 5.034 98 H CYS 13 H CYS 13 6.437 27.378 6.590 99 HA CYS 13 HA CYS 13 3.683 27.992 6.118 100 HB2 CYS 13 HB2 CYS 13 3.280 27.123 4.136 101 HB3 CYS 13 HB3 CYS 13 4.981 26.786 3.924 102 H GLY 14 H GLY 14 2.471 25.479 6.288 103 HA2 GLY 14 HA2 GLY 14 2.176 23.655 7.673 104 HA3 GLY 14 HA3 GLY 14 3.805 23.881 8.264 105 HA PRO 15 HA PRO 15 0.918 24.612 11.890 106 HB2 PRO 15 HB2 PRO 15 2.602 23.603 13.711 107 HB3 PRO 15 HB3 PRO 15 1.697 22.514 12.626 108 HG2 PRO 15 HG2 PRO 15 4.294 23.848 12.065 109 HG3 PRO 15 HG3 PRO 15 4.101 22.071 12.335 110 HD2 PRO 15 HD2 PRO 15 4.003 22.807 9.872 111 HD3 PRO 15 HD3 PRO 15 2.499 22.024 10.445 112 H GLY 16 H GLY 16 1.001 26.697 12.016 113 HA2 GLY 16 HA2 GLY 16 1.376 28.661 12.968 114 HA3 GLY 16 HA3 GLY 16 2.926 28.045 13.532 115 H GLY 17 H GLY 17 3.285 27.157 10.506 116 HA2 GLY 17 HA2 GLY 17 3.946 28.101 8.592 117 HA3 GLY 17 HA3 GLY 17 3.473 29.615 9.256 118 H LYS 18 H LYS 18 5.438 27.226 10.750 119 HA LYS 18 HA LYS 18 7.617 29.081 11.070 120 HB2 LYS 18 HB2 LYS 18 7.592 26.291 12.136 121 HB3 LYS 18 HB3 LYS 18 8.465 27.694 12.737 122 HG2 LYS 18 HG2 LYS 18 5.672 28.246 12.774 123 HG3 LYS 18 HG3 LYS 18 5.970 26.706 13.566 124 HD2 LYS 18 HD2 LYS 18 7.994 28.347 14.516 125 HD3 LYS 18 HD3 LYS 18 6.591 29.415 14.423 126 HE2 LYS 18 HE2 LYS 18 5.367 27.450 15.623 127 HE3 LYS 18 HE3 LYS 18 6.999 26.947 16.064 128 HZ1 LYS 18 HZ1 LYS 18 7.084 28.507 17.621 129 HZ2 LYS 18 HZ2 LYS 18 5.446 28.827 17.343 130 HZ3 LYS 18 HZ3 LYS 18 6.632 29.724 16.537 131 H GLY 19 H GLY 19 7.187 25.768 9.110 132 HA2 GLY 19 HA2 GLY 19 9.840 25.966 8.557 133 HA3 GLY 19 HA3 GLY 19 8.629 24.753 8.161 134 H ARG 20 H ARG 20 9.762 25.093 6.210 135 HA ARG 20 HA ARG 20 8.606 27.284 4.572 136 HB2 ARG 20 HB2 ARG 20 11.112 25.854 3.806 137 HB3 ARG 20 HB3 ARG 20 10.496 27.381 3.197 138 HG2 ARG 20 HG2 ARG 20 11.718 28.449 4.706 139 HG3 ARG 20 HG3 ARG 20 10.776 27.682 5.983 140 HD2 ARG 20 HD2 ARG 20 12.311 25.879 6.133 141 HD3 ARG 20 HD3 ARG 20 13.132 26.368 4.654 142 HE ARG 20 HE ARG 20 14.267 27.994 5.838 143 HH11 ARG 20 HH11 ARG 20 11.841 26.510 7.867 144 HH12 ARG 20 HH12 ARG 20 12.459 27.206 9.325 145 HH21 ARG 20 HH21 ARG 20 15.075 28.910 7.755 146 HH22 ARG 20 HH22 ARG 20 14.292 28.571 9.262 147 H CYS 21 H CYS 21 8.493 26.727 2.066 148 HA CYS 21 HA CYS 21 7.200 24.074 1.879 149 HB2 CYS 21 HB2 CYS 21 6.650 26.702 0.568 150 HB3 CYS 21 HB3 CYS 21 6.336 25.250 -0.374 151 H PHE 22 H PHE 22 7.659 22.686 0.178 152 HA PHE 22 HA PHE 22 9.788 23.430 -1.710 153 HB2 PHE 22 HB2 PHE 22 9.865 21.038 0.144 154 HB3 PHE 22 HB3 PHE 22 10.945 21.264 -1.229 155 HD1 PHE 22 HD1 PHE 22 9.932 22.664 2.042 156 HD2 PHE 22 HD2 PHE 22 12.834 22.628 -1.081 157 HE1 PHE 22 HE1 PHE 22 11.473 23.983 3.443 158 HE2 PHE 22 HE2 PHE 22 14.369 23.942 0.321 159 HZ PHE 22 HZ PHE 22 13.687 24.620 2.587 160 H GLY 23 H GLY 23 6.828 22.712 -1.763 161 HA2 GLY 23 HA2 GLY 23 6.755 21.408 -4.219 162 HA3 GLY 23 HA3 GLY 23 6.553 20.171 -2.985 163 HA PRO 24 HA PRO 24 2.425 22.131 -3.740 164 HB2 PRO 24 HB2 PRO 24 1.331 19.598 -4.526 165 HB3 PRO 24 HB3 PRO 24 1.587 21.028 -5.526 166 HG2 PRO 24 HG2 PRO 24 2.956 18.644 -5.806 167 HG3 PRO 24 HG3 PRO 24 3.525 20.215 -6.394 168 HD2 PRO 24 HD2 PRO 24 4.300 18.719 -3.924 169 HD3 PRO 24 HD3 PRO 24 5.301 19.711 -5.007 170 H SER 25 H SER 25 2.724 18.728 -2.686 171 HA SER 25 HA SER 25 0.904 19.310 -0.444 172 HB2 SER 25 HB2 SER 25 1.087 17.132 -2.284 173 HB3 SER 25 HB3 SER 25 1.445 16.503 -0.669 174 HG SER 25 HG SER 25 -0.523 17.253 0.036 175 H ILE 26 H ILE 26 4.046 19.511 -0.823 176 HA ILE 26 HA ILE 26 4.662 18.079 1.658 177 HB ILE 26 HB ILE 26 6.822 18.682 -0.261 178 HG12 ILE 26 HG12 ILE 26 5.147 16.228 -0.585 179 HG13 ILE 26 HG13 ILE 26 4.898 17.674 -1.560 180 HG21 ILE 26 HG21 ILE 26 7.303 17.818 1.903 181 HG22 ILE 26 HG22 ILE 26 7.775 16.691 0.634 182 HG23 ILE 26 HG23 ILE 26 6.309 16.414 1.570 183 HD11 ILE 26 HD11 ILE 26 7.233 15.822 -1.523 184 HD12 ILE 26 HD12 ILE 26 7.401 17.481 -2.093 185 HD13 ILE 26 HD13 ILE 26 6.269 16.387 -2.887 186 H CYS 27 H CYS 27 5.245 19.277 3.348 187 HA CYS 27 HA CYS 27 6.646 21.792 2.789 188 HB2 CYS 27 HB2 CYS 27 4.153 22.094 3.408 189 HB3 CYS 27 HB3 CYS 27 4.688 21.714 5.033 190 H CYS 28 H CYS 28 8.440 21.789 3.571 191 HA CYS 28 HA CYS 28 9.179 20.526 6.094 192 HB2 CYS 28 HB2 CYS 28 11.339 20.847 4.198 193 HB3 CYS 28 HB3 CYS 28 10.808 19.394 5.028 194 H GLY 29 H GLY 29 10.820 21.611 7.299 195 HA2 GLY 29 HA2 GLY 29 11.637 24.246 6.532 196 HA3 GLY 29 HA3 GLY 29 10.657 24.191 7.999 197 H ASP 30 H ASP 30 12.836 24.872 8.903 198 HA ASP 30 HA ASP 30 14.867 22.937 8.898 199 HB2 ASP 30 HB2 ASP 30 15.760 24.219 10.880 200 HB3 ASP 30 HB3 ASP 30 15.527 25.135 9.396 201 H GLU 31 H GLU 31 13.003 23.863 11.608 202 HA GLU 31 HA GLU 31 13.450 21.324 12.901 203 HB2 GLU 31 HB2 GLU 31 11.969 23.165 14.580 204 HB3 GLU 31 HB3 GLU 31 13.483 22.333 14.886 205 HG2 GLU 31 HG2 GLU 31 14.210 24.303 13.114 206 HG3 GLU 31 HG3 GLU 31 12.977 25.082 14.100 207 H LEU 32 H LEU 32 11.441 22.111 10.798 208 HA LEU 32 HA LEU 32 9.145 20.967 12.094 209 HB2 LEU 32 HB2 LEU 32 9.607 23.255 10.511 210 HB3 LEU 32 HB3 LEU 32 8.562 22.163 9.657 211 HG LEU 32 HG LEU 32 8.099 23.083 12.475 212 HD11 LEU 32 HD11 LEU 32 8.120 24.913 10.834 213 HD12 LEU 32 HD12 LEU 32 6.566 24.689 11.648 214 HD13 LEU 32 HD13 LEU 32 6.784 24.121 9.991 215 HD21 LEU 32 HD21 LEU 32 6.438 21.622 12.536 216 HD22 LEU 32 HD22 LEU 32 6.907 21.035 10.946 217 HD23 LEU 32 HD23 LEU 32 5.727 22.331 11.088 218 H GLY 33 H GLY 33 11.608 20.684 9.863 219 HA2 GLY 33 HA2 GLY 33 12.227 19.082 8.467 220 HA3 GLY 33 HA3 GLY 33 11.107 18.090 9.315 221 H CYS 34 H CYS 34 9.748 17.090 7.841 222 HA CYS 34 HA CYS 34 8.619 18.812 5.775 223 HB2 CYS 34 HB2 CYS 34 10.709 17.586 4.946 224 HB3 CYS 34 HB3 CYS 34 9.686 16.167 4.916 225 H PHE 35 H PHE 35 6.510 18.653 5.702 226 HA PHE 35 HA PHE 35 5.269 16.147 6.471 227 HB2 PHE 35 HB2 PHE 35 3.442 18.284 5.764 228 HB3 PHE 35 HB3 PHE 35 3.562 17.394 7.277 229 HD1 PHE 35 HD1 PHE 35 5.953 18.097 8.490 230 HD2 PHE 35 HD2 PHE 35 3.470 20.537 6.067 231 HE1 PHE 35 HE1 PHE 35 6.895 20.093 9.543 232 HE2 PHE 35 HE2 PHE 35 4.408 22.547 7.120 233 HZ PHE 35 HZ PHE 35 6.130 22.327 8.864 234 H VAL 36 H VAL 36 5.180 14.848 4.748 235 HA VAL 36 HA VAL 36 4.736 16.096 2.163 236 HB VAL 36 HB VAL 36 5.116 13.138 2.471 237 HG11 VAL 36 HG11 VAL 36 6.126 15.127 0.409 238 HG12 VAL 36 HG12 VAL 36 4.629 14.183 0.273 239 HG13 VAL 36 HG13 VAL 36 6.185 13.354 0.311 240 HG21 VAL 36 HG21 VAL 36 6.841 14.468 3.874 241 HG22 VAL 36 HG22 VAL 36 7.499 14.971 2.320 242 HG23 VAL 36 HG23 VAL 36 7.447 13.261 2.740 243 H GLY 37 H GLY 37 2.720 16.752 2.587 244 HA2 GLY 37 HA2 GLY 37 0.491 16.247 1.744 245 HA3 GLY 37 HA3 GLY 37 0.688 14.601 2.316 246 H THR 38 H THR 38 -0.445 17.717 3.019 247 HA THR 38 HA THR 38 -2.076 17.008 5.160 248 HB THR 38 HB THR 38 -0.511 16.886 6.818 249 HG1 THR 38 HG1 THR 38 -0.929 18.586 7.928 250 HG21 THR 38 HG21 THR 38 1.505 16.935 5.735 251 HG22 THR 38 HG22 THR 38 1.594 18.368 6.766 252 HG23 THR 38 HG23 THR 38 1.220 18.537 5.050 253 H ALA 39 H ALA 39 -3.306 19.175 6.031 254 HA ALA 39 HA ALA 39 -3.562 20.878 3.853 255 HB1 ALA 39 HB1 ALA 39 -4.429 21.332 6.704 256 HB2 ALA 39 HB2 ALA 39 -5.291 20.286 5.574 257 HB3 ALA 39 HB3 ALA 39 -5.143 22.011 5.241 258 H GLU 40 H GLU 40 -1.538 20.945 6.679 259 HA GLU 40 HA GLU 40 -0.987 23.721 6.793 260 HB2 GLU 40 HB2 GLU 40 0.078 21.224 7.938 261 HB3 GLU 40 HB3 GLU 40 1.251 22.521 7.792 262 HG2 GLU 40 HG2 GLU 40 0.375 23.625 9.515 263 HG3 GLU 40 HG3 GLU 40 -1.260 23.460 8.880 264 H ALA 41 H ALA 41 -0.278 21.418 4.553 265 HA ALA 41 HA ALA 41 2.058 22.836 3.486 266 HB1 ALA 41 HB1 ALA 41 1.194 20.022 3.381 267 HB2 ALA 41 HB2 ALA 41 2.815 20.713 3.400 268 HB3 ALA 41 HB3 ALA 41 1.894 20.664 1.897 269 H LEU 42 H LEU 42 -1.309 22.255 2.975 270 HA LEU 42 HA LEU 42 -1.617 22.371 0.273 271 HB2 LEU 42 HB2 LEU 42 -3.242 23.083 2.587 272 HB3 LEU 42 HB3 LEU 42 -3.674 23.976 1.140 273 HG LEU 42 HG LEU 42 -3.356 21.018 0.923 274 HD11 LEU 42 HD11 LEU 42 -5.260 20.445 1.996 275 HD12 LEU 42 HD12 LEU 42 -6.042 21.990 1.668 276 HD13 LEU 42 HD13 LEU 42 -4.862 21.860 2.969 277 HD21 LEU 42 HD21 LEU 42 -5.495 22.732 -0.274 278 HD22 LEU 42 HD22 LEU 42 -4.802 21.224 -0.873 279 HD23 LEU 42 HD23 LEU 42 -3.867 22.717 -0.953 280 H ARG 43 H ARG 43 -0.861 25.118 2.376 281 HA ARG 43 HA ARG 43 -1.208 27.187 0.486 282 HB2 ARG 43 HB2 ARG 43 0.812 28.216 1.873 283 HB3 ARG 43 HB3 ARG 43 -0.775 28.070 2.591 284 HG2 ARG 43 HG2 ARG 43 1.077 25.795 2.948 285 HG3 ARG 43 HG3 ARG 43 1.433 27.285 3.819 286 HD2 ARG 43 HD2 ARG 43 -1.042 25.577 4.003 287 HD3 ARG 43 HD3 ARG 43 0.129 25.928 5.266 288 HE ARG 43 HE ARG 43 -0.896 28.367 4.591 289 HH11 ARG 43 HH11 ARG 43 -2.266 25.321 5.607 290 HH12 ARG 43 HH12 ARG 43 -3.591 26.049 6.452 291 HH21 ARG 43 HH21 ARG 43 -2.648 29.333 5.719 292 HH22 ARG 43 HH22 ARG 43 -3.806 28.322 6.517 293 H CYS 44 H CYS 44 0.861 24.814 0.875 294 HA CYS 44 HA CYS 44 3.242 25.638 -0.573 295 HB2 CYS 44 HB2 CYS 44 2.286 22.841 -0.066 296 HB3 CYS 44 HB3 CYS 44 3.633 23.150 -1.131 297 H GLN 45 H GLN 45 0.131 25.107 -1.636 298 HA GLN 45 HA GLN 45 0.672 24.329 -4.350 299 HB2 GLN 45 HB2 GLN 45 -1.595 24.421 -2.768 300 HB3 GLN 45 HB3 GLN 45 -1.868 25.709 -3.931 301 HG2 GLN 45 HG2 GLN 45 -0.994 23.008 -4.853 302 HG3 GLN 45 HG3 GLN 45 -2.683 23.313 -4.452 303 HE21 GLN 45 HE21 GLN 45 -0.199 23.700 -6.753 304 HE22 GLN 45 HE22 GLN 45 -1.107 24.578 -7.931 305 H GLU 46 H GLU 46 0.743 27.335 -2.654 306 HA GLU 46 HA GLU 46 0.309 28.892 -5.057 307 HB2 GLU 46 HB2 GLU 46 1.050 29.690 -2.242 308 HB3 GLU 46 HB3 GLU 46 0.897 30.841 -3.561 309 HG2 GLU 46 HG2 GLU 46 -1.387 29.024 -3.061 310 HG3 GLU 46 HG3 GLU 46 -1.089 30.312 -1.895 311 H GLU 47 H GLU 47 2.704 26.984 -4.320 312 HA GLU 47 HA GLU 47 4.929 28.781 -4.692 313 HB2 GLU 47 HB2 GLU 47 4.567 26.059 -3.864 314 HB3 GLU 47 HB3 GLU 47 5.684 26.093 -5.220 315 HG2 GLU 47 HG2 GLU 47 6.799 28.026 -3.841 316 HG3 GLU 47 HG3 GLU 47 5.969 27.244 -2.495 317 H ASN 48 H ASN 48 2.499 27.820 -6.640 318 HA ASN 48 HA ASN 48 4.175 27.349 -8.987 319 HB2 ASN 48 HB2 ASN 48 1.917 26.122 -8.376 320 HB3 ASN 48 HB3 ASN 48 1.193 27.538 -9.132 321 HD21 ASN 48 HD21 ASN 48 3.404 24.856 -9.643 322 HD22 ASN 48 HD22 ASN 48 3.225 24.794 -11.360 323 H TYR 49 H TYR 49 2.204 29.789 -7.468 324 HA TYR 49 HA TYR 49 2.517 31.561 -9.816 325 HB2 TYR 49 HB2 TYR 49 0.241 31.070 -8.525 326 HB3 TYR 49 HB3 TYR 49 0.849 32.338 -7.465 327 HD1 TYR 49 HD1 TYR 49 1.261 34.618 -8.381 328 HD2 TYR 49 HD2 TYR 49 -0.608 31.575 -10.696 329 HE1 TYR 49 HE1 TYR 49 0.450 36.323 -9.954 330 HE2 TYR 49 HE2 TYR 49 -1.425 33.274 -12.275 331 HH TYR 49 HH TYR 49 -1.132 35.458 -12.955 332 H LEU 50 H LEU 50 4.675 30.930 -7.916 333 HA LEU 50 HA LEU 50 5.129 33.653 -6.876 334 HB2 LEU 50 HB2 LEU 50 5.132 31.151 -5.481 335 HB3 LEU 50 HB3 LEU 50 6.746 31.835 -5.434 336 HG LEU 50 HG LEU 50 5.598 34.000 -4.642 337 HD11 LEU 50 HD11 LEU 50 3.313 32.493 -5.112 338 HD12 LEU 50 HD12 LEU 50 3.410 34.031 -4.254 339 HD13 LEU 50 HD13 LEU 50 3.479 32.515 -3.356 340 HD21 LEU 50 HD21 LEU 50 6.861 33.104 -2.986 341 HD22 LEU 50 HD22 LEU 50 6.133 31.505 -3.143 342 HD23 LEU 50 HD23 LEU 50 5.272 32.787 -2.290 343 HA PRO 51 HA PRO 51 8.713 33.460 -9.521 344 HB2 PRO 51 HB2 PRO 51 9.794 35.836 -8.883 345 HB3 PRO 51 HB3 PRO 51 8.309 35.711 -9.834 346 HG2 PRO 51 HG2 PRO 51 8.645 36.293 -6.916 347 HG3 PRO 51 HG3 PRO 51 7.565 37.063 -8.093 348 HD2 PRO 51 HD2 PRO 51 6.756 35.132 -6.336 349 HD3 PRO 51 HD3 PRO 51 5.990 35.409 -7.914 350 H SER 52 H SER 52 8.727 32.698 -6.395 351 HA SER 52 HA SER 52 11.621 32.977 -6.009 352 HB2 SER 52 HB2 SER 52 11.105 32.291 -3.643 353 HB3 SER 52 HB3 SER 52 10.361 33.811 -4.138 354 HG SER 52 HG SER 52 9.188 31.523 -3.312 355 HA PRO 53 HA PRO 53 11.514 28.564 -7.000 356 HB2 PRO 53 HB2 PRO 53 14.110 28.591 -8.009 357 HB3 PRO 53 HB3 PRO 53 12.637 28.829 -8.944 358 HG2 PRO 53 HG2 PRO 53 14.675 30.739 -8.399 359 HG3 PRO 53 HG3 PRO 53 13.154 30.999 -9.262 360 HD2 PRO 53 HD2 PRO 53 13.870 31.640 -6.468 361 HD3 PRO 53 HD3 PRO 53 12.633 32.364 -7.516 362 H CYS 54 H CYS 54 13.334 30.294 -4.754 363 HA CYS 54 HA CYS 54 14.505 29.679 -2.911 364 HB2 CYS 54 HB2 CYS 54 12.552 27.899 -2.982 365 HB3 CYS 54 HB3 CYS 54 13.888 26.799 -3.296 366 H GLN 55 H GLN 55 16.673 30.153 -3.539 367 HA GLN 55 HA GLN 55 17.941 27.860 -4.932 368 HB2 GLN 55 HB2 GLN 55 19.011 30.635 -4.562 369 HB3 GLN 55 HB3 GLN 55 19.607 29.402 -5.655 370 HG2 GLN 55 HG2 GLN 55 16.938 30.767 -5.823 371 HG3 GLN 55 HG3 GLN 55 18.334 31.076 -6.857 372 HE21 GLN 55 HE21 GLN 55 19.180 28.420 -7.201 373 HE22 GLN 55 HE22 GLN 55 18.011 27.599 -8.170 374 H SER 56 H SER 56 17.873 26.728 -2.825 375 HA SER 56 HA SER 56 20.373 26.447 -1.681 376 HB2 SER 56 HB2 SER 56 19.566 28.792 -0.774 377 HB3 SER 56 HB3 SER 56 18.674 27.801 0.371 378 HG SER 56 HG SER 56 21.475 27.829 -0.072 379 H GLY 57 H GLY 57 19.447 24.324 -2.139 380 HA2 GLY 57 HA2 GLY 57 18.794 22.780 -0.025 381 HA3 GLY 57 HA3 GLY 57 17.225 23.355 -0.606 382 H GLN 58 H GLN 58 20.170 22.623 -2.345 383 HA GLN 58 HA GLN 58 18.741 20.605 -3.904 384 HB2 GLN 58 HB2 GLN 58 20.285 21.237 -5.778 385 HB3 GLN 58 HB3 GLN 58 19.133 22.487 -5.331 386 HG2 GLN 58 HG2 GLN 58 20.781 23.778 -4.271 387 HG3 GLN 58 HG3 GLN 58 21.937 22.448 -4.271 388 HE21 GLN 58 HE21 GLN 58 21.367 25.299 -5.620 389 HE22 GLN 58 HE22 GLN 58 22.069 25.069 -7.181 390 H LYS 59 H LYS 59 19.389 19.109 -2.521 391 HA LYS 59 HA LYS 59 22.176 18.166 -2.761 392 HB2 LYS 59 HB2 LYS 59 21.731 19.228 -0.485 393 HB3 LYS 59 HB3 LYS 59 20.437 18.065 -0.257 394 HG2 LYS 59 HG2 LYS 59 21.857 16.571 0.537 395 HG3 LYS 59 HG3 LYS 59 22.857 16.685 -0.913 396 HD2 LYS 59 HD2 LYS 59 23.018 18.819 1.175 397 HD3 LYS 59 HD3 LYS 59 23.863 17.288 1.421 398 HE2 LYS 59 HE2 LYS 59 24.168 19.001 -1.038 399 HE3 LYS 59 HE3 LYS 59 25.239 19.092 0.360 400 HZ1 LYS 59 HZ1 LYS 59 26.402 17.485 -0.608 401 HZ2 LYS 59 HZ2 LYS 59 25.206 17.196 -1.768 402 HZ3 LYS 59 HZ3 LYS 59 25.127 16.427 -0.263 403 HA PRO 60 HA PRO 60 18.722 15.424 -3.999 404 HB2 PRO 60 HB2 PRO 60 19.646 14.833 -6.495 405 HB3 PRO 60 HB3 PRO 60 18.651 16.249 -6.132 406 HG2 PRO 60 HG2 PRO 60 21.618 16.052 -6.453 407 HG3 PRO 60 HG3 PRO 60 20.505 17.295 -7.055 408 HD2 PRO 60 HD2 PRO 60 22.017 17.636 -4.828 409 HD3 PRO 60 HD3 PRO 60 20.423 18.382 -5.028 410 H CYS 61 H CYS 61 19.290 13.985 -2.540 411 HA CYS 61 HA CYS 61 21.198 11.881 -3.259 412 HB2 CYS 61 HB2 CYS 61 21.435 11.333 -1.004 413 HB3 CYS 61 HB3 CYS 61 21.289 13.087 -0.942 414 H GLY 62 H GLY 62 20.035 9.713 -1.934 415 HA2 GLY 62 HA2 GLY 62 18.384 8.125 -2.348 416 HA3 GLY 62 HA3 GLY 62 17.298 9.476 -2.058 417 H SER 63 H SER 63 15.939 8.203 -3.626 418 HA SER 63 HA SER 63 16.801 8.075 -6.339 419 HB2 SER 63 HB2 SER 63 15.035 6.607 -5.223 420 HB3 SER 63 HB3 SER 63 13.938 7.978 -5.389 421 HG SER 63 HG SER 63 15.119 6.392 -7.388 422 H GLY 64 H GLY 64 17.482 10.453 -6.189 423 HA2 GLY 64 HA2 GLY 64 17.190 12.394 -7.389 424 HA3 GLY 64 HA3 GLY 64 15.535 11.926 -7.692 425 H GLY 65 H GLY 65 16.031 12.010 -4.140 426 HA2 GLY 65 HA2 GLY 65 14.671 14.538 -4.371 427 HA3 GLY 65 HA3 GLY 65 14.702 13.452 -3.005 428 H ARG 66 H ARG 66 15.275 16.367 -3.569 429 HA ARG 66 HA ARG 66 17.966 16.591 -2.530 430 HB2 ARG 66 HB2 ARG 66 17.728 19.032 -3.053 431 HB3 ARG 66 HB3 ARG 66 17.694 17.960 -4.441 432 HG2 ARG 66 HG2 ARG 66 15.108 18.755 -3.197 433 HG3 ARG 66 HG3 ARG 66 15.985 19.955 -4.143 434 HD2 ARG 66 HD2 ARG 66 15.436 17.217 -5.233 435 HD3 ARG 66 HD3 ARG 66 14.230 18.497 -5.325 436 HE ARG 66 HE ARG 66 16.925 18.874 -6.442 437 HH11 ARG 66 HH11 ARG 66 13.448 18.846 -6.848 438 HH12 ARG 66 HH12 ARG 66 13.514 19.459 -8.464 439 HH21 ARG 66 HH21 ARG 66 16.997 19.667 -8.570 440 HH22 ARG 66 HH22 ARG 66 15.522 19.922 -9.442 441 H CYS 67 H CYS 67 18.481 18.010 -0.783 442 HA CYS 67 HA CYS 67 17.126 17.616 1.485 443 HB2 CYS 67 HB2 CYS 67 19.486 18.322 1.296 444 HB3 CYS 67 HB3 CYS 67 18.956 19.921 0.799 445 H ALA 68 H ALA 68 15.092 18.209 1.844 446 HA ALA 68 HA ALA 68 14.193 20.843 0.929 447 HB1 ALA 68 HB1 ALA 68 12.316 18.918 2.197 448 HB2 ALA 68 HB2 ALA 68 12.922 18.539 0.585 449 HB3 ALA 68 HB3 ALA 68 12.053 20.047 0.868 450 H ALA 69 H ALA 69 14.710 18.792 3.728 451 HA ALA 69 HA ALA 69 14.773 21.209 5.398 452 HB1 ALA 69 HB1 ALA 69 12.563 19.257 5.776 453 HB2 ALA 69 HB2 ALA 69 12.465 21.000 5.571 454 HB3 ALA 69 HB3 ALA 69 13.118 20.312 7.053 455 H ALA 70 H ALA 70 15.172 20.756 7.672 456 HA ALA 70 HA ALA 70 17.477 19.494 8.067 457 HB1 ALA 70 HB1 ALA 70 15.656 19.056 10.331 458 HB2 ALA 70 HB2 ALA 70 15.838 20.723 9.771 459 HB3 ALA 70 HB3 ALA 70 17.252 19.809 10.279 460 H GLY 71 H GLY 71 17.873 17.622 7.123 461 HA2 GLY 71 HA2 GLY 71 18.166 15.353 7.278 462 HA3 GLY 71 HA3 GLY 71 16.763 15.225 8.290 463 H ILE 72 H ILE 72 15.363 16.953 5.815 464 HA ILE 72 HA ILE 72 14.452 14.577 4.532 465 HB ILE 72 HB ILE 72 13.654 17.366 3.756 466 HG12 ILE 72 HG12 ILE 72 13.620 17.669 6.096 467 HG13 ILE 72 HG13 ILE 72 11.966 17.236 5.690 468 HG21 ILE 72 HG21 ILE 72 11.643 15.316 4.332 469 HG22 ILE 72 HG22 ILE 72 12.769 14.915 3.035 470 HG23 ILE 72 HG23 ILE 72 11.812 16.394 2.947 471 HD11 ILE 72 HD11 ILE 72 13.557 14.949 6.158 472 HD12 ILE 72 HD12 ILE 72 12.049 15.427 6.934 473 HD13 ILE 72 HD13 ILE 72 13.596 16.019 7.553 474 H CYS 73 H CYS 73 15.138 13.907 2.715 475 HA CYS 73 HA CYS 73 16.533 15.717 0.892 476 HB2 CYS 73 HB2 CYS 73 17.885 13.983 2.096 477 HB3 CYS 73 HB3 CYS 73 16.942 12.754 1.266 478 H CYS 74 H CYS 74 14.656 16.190 -0.370 479 HA CYS 74 HA CYS 74 13.903 14.028 -2.086 480 HB2 CYS 74 HB2 CYS 74 11.484 14.279 -1.525 481 HB3 CYS 74 HB3 CYS 74 12.520 13.431 -0.397 482 H SER 75 H SER 75 11.764 14.643 -3.258 483 HA SER 75 HA SER 75 12.056 17.340 -4.419 484 HB2 SER 75 HB2 SER 75 11.234 16.104 -6.547 485 HB3 SER 75 HB3 SER 75 12.898 15.825 -6.047 486 HG SER 75 HG SER 75 11.293 13.972 -6.551 487 HA PRO 76 HA PRO 76 7.688 17.793 -3.897 488 HB2 PRO 76 HB2 PRO 76 6.581 18.395 -6.291 489 HB3 PRO 76 HB3 PRO 76 7.613 19.517 -5.397 490 HG2 PRO 76 HG2 PRO 76 8.298 17.736 -7.698 491 HG3 PRO 76 HG3 PRO 76 8.781 19.415 -7.398 492 HD2 PRO 76 HD2 PRO 76 10.407 17.303 -6.912 493 HD3 PRO 76 HD3 PRO 76 10.476 18.804 -5.972 494 H ASP 77 H ASP 77 8.570 15.003 -4.569 495 HA ASP 77 HA ASP 77 5.915 13.945 -5.229 496 HB2 ASP 77 HB2 ASP 77 7.108 12.046 -6.444 497 HB3 ASP 77 HB3 ASP 77 7.058 13.596 -7.273 498 H GLY 78 H GLY 78 9.171 12.846 -4.186 499 HA2 GLY 78 HA2 GLY 78 7.819 11.442 -1.998 500 HA3 GLY 78 HA3 GLY 78 9.154 10.713 -2.850 501 H CYS 79 H CYS 79 9.826 10.657 -0.402 502 HA CYS 79 HA CYS 79 11.722 12.796 -0.078 503 HB2 CYS 79 HB2 CYS 79 9.457 12.384 1.802 504 HB3 CYS 79 HB3 CYS 79 11.003 12.939 2.434 505 H HIS 80 H HIS 80 13.412 12.374 1.678 506 HA HIS 80 HA HIS 80 13.469 9.570 2.534 507 HB2 HIS 80 HB2 HIS 80 15.633 10.769 0.788 508 HB3 HIS 80 HB3 HIS 80 15.709 9.195 1.570 509 HD1 HIS 80 HD1 HIS 80 14.197 10.979 -1.332 510 HD2 HIS 80 HD2 HIS 80 14.172 7.184 0.355 511 HE1 HIS 80 HE1 HIS 80 13.172 9.478 -3.070 512 HE2 HIS 80 HE2 HIS 80 13.309 7.166 -2.081 513 H GLU 81 H GLU 81 14.629 9.232 4.358 514 HA GLU 81 HA GLU 81 15.366 11.450 5.951 515 HB2 GLU 81 HB2 GLU 81 15.416 8.506 6.191 516 HB3 GLU 81 HB3 GLU 81 16.624 9.349 7.151 517 HG2 GLU 81 HG2 GLU 81 14.578 10.807 7.884 518 HG3 GLU 81 HG3 GLU 81 13.657 9.397 7.363 519 H ASP 82 H ASP 82 17.198 12.584 5.984 520 HA ASP 82 HA ASP 82 19.671 11.306 5.030 521 HB2 ASP 82 HB2 ASP 82 19.995 12.718 3.281 522 HB3 ASP 82 HB3 ASP 82 18.232 12.833 3.342 523 HA PRO 83 HA PRO 83 20.767 13.230 8.988 524 HB2 PRO 83 HB2 PRO 83 23.360 11.938 8.406 525 HB3 PRO 83 HB3 PRO 83 22.318 11.794 9.824 526 HG2 PRO 83 HG2 PRO 83 22.525 9.807 8.050 527 HG3 PRO 83 HG3 PRO 83 20.985 10.180 8.845 528 HD2 PRO 83 HD2 PRO 83 21.902 10.859 6.077 529 HD3 PRO 83 HD3 PRO 83 20.306 10.314 6.634 530 H ALA 84 H ALA 84 22.523 13.534 5.956 531 HA ALA 84 HA ALA 84 24.457 15.378 6.844 532 HB1 ALA 84 HB1 ALA 84 23.817 14.146 4.409 533 HB2 ALA 84 HB2 ALA 84 25.229 15.133 4.786 534 HB3 ALA 84 HB3 ALA 84 23.784 15.884 4.108 535 H CYS 85 H CYS 85 21.131 15.773 6.576 536 HA CYS 85 HA CYS 85 21.432 18.705 6.597 537 HB2 CYS 85 HB2 CYS 85 19.391 17.014 5.158 538 HB3 CYS 85 HB3 CYS 85 18.937 18.581 5.784 539 H ASP 86 H ASP 86 20.860 16.245 8.622 540 HA ASP 86 HA ASP 86 18.281 16.992 9.598 541 HB2 ASP 86 HB2 ASP 86 19.825 14.785 9.992 542 HB3 ASP 86 HB3 ASP 86 19.980 15.610 11.545 543 HA PRO 87 HA PRO 87 20.372 19.564 12.869 544 HB2 PRO 87 HB2 PRO 87 22.624 18.736 13.923 545 HB3 PRO 87 HB3 PRO 87 21.198 17.702 14.028 546 HG2 PRO 87 HG2 PRO 87 23.647 17.344 12.414 547 HG3 PRO 87 HG3 PRO 87 22.447 16.139 12.912 548 HD2 PRO 87 HD2 PRO 87 22.617 17.652 10.406 549 HD3 PRO 87 HD3 PRO 87 21.616 16.236 10.792 550 H GLU 88 H GLU 88 22.268 20.750 13.687 551 HA GLU 88 HA GLU 88 23.343 22.406 11.681 552 HB2 GLU 88 HB2 GLU 88 24.578 23.487 13.530 553 HB3 GLU 88 HB3 GLU 88 22.864 23.309 13.880 554 HG2 GLU 88 HG2 GLU 88 23.231 21.624 15.437 555 HG3 GLU 88 HG3 GLU 88 24.847 21.282 14.826 556 H ALA 89 H ALA 89 24.155 20.815 10.582 557 HA ALA 89 HA ALA 89 26.701 19.406 11.198 558 HB1 ALA 89 HB1 ALA 89 24.836 18.676 9.390 559 HB2 ALA 89 HB2 ALA 89 26.565 18.318 9.147 560 HB3 ALA 89 HB3 ALA 89 25.839 19.709 8.344 561 H ALA 90 H ALA 90 26.829 21.940 11.883 562 HA ALA 90 HA ALA 90 27.420 23.911 9.983 563 HB1 ALA 90 HB1 ALA 90 26.888 23.916 12.605 564 HB2 ALA 90 HB2 ALA 90 27.560 25.302 11.744 565 HB3 ALA 90 HB3 ALA 90 28.623 24.224 12.649 566 H PHE 91 H PHE 91 29.233 24.645 8.976 567 HA PHE 91 HA PHE 91 31.660 23.071 9.386 568 HB2 PHE 91 HB2 PHE 91 30.751 23.685 7.070 569 HB3 PHE 91 HB3 PHE 91 31.356 25.310 7.392 570 HD1 PHE 91 HD1 PHE 91 33.743 25.741 7.570 571 HD2 PHE 91 HD2 PHE 91 32.259 21.851 6.686 572 HE1 PHE 91 HE1 PHE 91 35.998 25.042 6.876 573 HE2 PHE 91 HE2 PHE 91 34.511 21.147 5.987 574 HZ PHE 91 HZ PHE 91 36.384 22.743 6.083 575 H SER 92 H SER 92 32.582 23.758 11.274 576 HA SER 92 HA SER 92 32.950 26.591 11.781 577 HB2 SER 92 HB2 SER 92 32.488 24.637 13.504 578 HB3 SER 92 HB3 SER 92 34.243 24.483 13.461 579 HG SER 92 HG SER 92 33.098 26.037 15.018 580 H1 ALA 101 H1 ALA 101 -10.683 -0.879 20.115 581 H2 ALA 101 H2 ALA 101 -10.636 0.535 19.145 582 H3 ALA 101 H3 ALA 101 -10.169 0.608 20.793 583 HA ALA 101 HA ALA 101 -8.457 0.473 18.859 584 HB1 ALA 101 HB1 ALA 101 -8.422 -0.623 21.632 585 HB2 ALA 101 HB2 ALA 101 -7.594 0.783 20.964 586 HB3 ALA 101 HB3 ALA 101 -7.007 -0.840 20.600 587 H VAL 102 H VAL 102 -8.970 -0.784 17.074 588 HA VAL 102 HA VAL 102 -8.889 -3.681 17.390 589 HB VAL 102 HB VAL 102 -10.859 -2.800 16.283 590 HG11 VAL 102 HG11 VAL 102 -10.098 -0.856 15.177 591 HG12 VAL 102 HG12 VAL 102 -10.633 -1.979 13.928 592 HG13 VAL 102 HG13 VAL 102 -8.914 -1.765 14.243 593 HG21 VAL 102 HG21 VAL 102 -9.177 -4.893 15.421 594 HG22 VAL 102 HG22 VAL 102 -9.895 -4.169 13.982 595 HG23 VAL 102 HG23 VAL 102 -10.930 -4.765 15.279 596 H LEU 103 H LEU 103 -6.950 -3.936 17.593 597 HA LEU 103 HA LEU 103 -5.013 -3.606 15.316 598 HB2 LEU 103 HB2 LEU 103 -3.448 -4.709 17.301 599 HB3 LEU 103 HB3 LEU 103 -3.495 -3.044 16.750 600 HG LEU 103 HG LEU 103 -3.540 -3.297 19.217 601 HD11 LEU 103 HD11 LEU 103 -5.164 -1.645 17.612 602 HD12 LEU 103 HD12 LEU 103 -4.528 -1.329 19.225 603 HD13 LEU 103 HD13 LEU 103 -6.106 -2.091 19.034 604 HD21 LEU 103 HD21 LEU 103 -4.901 -4.687 20.272 605 HD22 LEU 103 HD22 LEU 103 -5.411 -5.297 18.698 606 HD23 LEU 103 HD23 LEU 103 -6.318 -4.001 19.478 607 H ASP 104 H ASP 104 -5.910 -5.116 14.091 608 HA ASP 104 HA ASP 104 -4.833 -7.771 14.443 609 HB2 ASP 104 HB2 ASP 104 -7.726 -7.110 13.875 610 HB3 ASP 104 HB3 ASP 104 -7.002 -8.575 13.218 611 H LEU 105 H LEU 105 -5.299 -8.818 12.034 612 HA LEU 105 HA LEU 105 -4.008 -6.949 10.307 613 HB2 LEU 105 HB2 LEU 105 -3.426 -9.402 10.426 614 HB3 LEU 105 HB3 LEU 105 -4.903 -9.705 9.539 615 HG LEU 105 HG LEU 105 -3.896 -9.326 7.587 616 HD11 LEU 105 HD11 LEU 105 -3.788 -6.681 8.540 617 HD12 LEU 105 HD12 LEU 105 -3.482 -7.252 6.891 618 HD13 LEU 105 HD13 LEU 105 -2.143 -7.065 8.015 619 HD21 LEU 105 HD21 LEU 105 -1.747 -9.967 7.529 620 HD22 LEU 105 HD22 LEU 105 -1.995 -10.216 9.257 621 HD23 LEU 105 HD23 LEU 105 -1.231 -8.735 8.680 622 H ASP 106 H ASP 106 -6.902 -6.872 11.130 623 HA ASP 106 HA ASP 106 -8.238 -6.796 8.559 624 HB2 ASP 106 HB2 ASP 106 -9.058 -6.564 11.371 625 HB3 ASP 106 HB3 ASP 106 -9.774 -5.304 10.368 626 H VAL 107 H VAL 107 -8.320 -4.040 10.925 627 HA VAL 107 HA VAL 107 -6.245 -2.839 9.274 628 HB VAL 107 HB VAL 107 -8.170 -2.097 8.019 629 HG11 VAL 107 HG11 VAL 107 -9.390 -1.852 10.703 630 HG12 VAL 107 HG12 VAL 107 -10.086 -2.418 9.187 631 HG13 VAL 107 HG13 VAL 107 -9.898 -0.691 9.480 632 HG21 VAL 107 HG21 VAL 107 -6.725 -0.186 9.700 633 HG22 VAL 107 HG22 VAL 107 -8.256 0.425 9.078 634 HG23 VAL 107 HG23 VAL 107 -7.025 -0.171 7.964 635 H ARG 108 H ARG 108 -4.879 -2.162 10.814 636 HA ARG 108 HA ARG 108 -5.871 -1.931 13.451 637 HB2 ARG 108 HB2 ARG 108 -3.750 -2.746 13.539 638 HB3 ARG 108 HB3 ARG 108 -3.236 -1.841 12.126 639 HG2 ARG 108 HG2 ARG 108 -2.090 -1.150 14.184 640 HG3 ARG 108 HG3 ARG 108 -2.986 0.163 13.427 641 HD2 ARG 108 HD2 ARG 108 -4.667 0.061 15.087 642 HD3 ARG 108 HD3 ARG 108 -4.076 -1.487 15.691 643 HE ARG 108 HE ARG 108 -1.954 0.184 15.981 644 HH11 ARG 108 HH11 ARG 108 -5.263 0.283 17.069 645 HH12 ARG 108 HH12 ARG 108 -4.893 1.188 18.497 646 HH21 ARG 108 HH21 ARG 108 -1.459 1.359 17.840 647 HH22 ARG 108 HH22 ARG 108 -2.723 1.800 18.939 648 H THR 109 H THR 109 -6.906 -0.146 14.174 649 HA THR 109 HA THR 109 -6.585 2.238 12.622 650 HB THR 109 HB THR 109 -8.548 2.086 14.057 651 HG1 THR 109 HG1 THR 109 -6.679 4.077 14.627 652 HG21 THR 109 HG21 THR 109 -6.688 1.119 16.003 653 HG22 THR 109 HG22 THR 109 -8.450 1.062 16.004 654 HG23 THR 109 HG23 THR 109 -7.612 2.472 16.654 655 H CYS 110 H CYS 110 -4.646 2.926 12.351 656 HA CYS 110 HA CYS 110 -2.499 2.432 14.103 657 HB2 CYS 110 HB2 CYS 110 -2.790 3.365 11.477 658 HB3 CYS 110 HB3 CYS 110 -1.916 4.627 12.329 659 H LEU 111 H LEU 111 -2.206 3.332 16.037 660 HA LEU 111 HA LEU 111 -3.379 5.251 17.365 661 HB2 LEU 111 HB2 LEU 111 -1.062 3.994 17.780 662 HB3 LEU 111 HB3 LEU 111 -0.435 5.595 17.438 663 HG LEU 111 HG LEU 111 -1.993 6.466 19.237 664 HD11 LEU 111 HD11 LEU 111 -2.846 3.748 19.193 665 HD12 LEU 111 HD12 LEU 111 -3.476 5.093 20.144 666 HD13 LEU 111 HD13 LEU 111 -2.160 4.104 20.778 667 HD21 LEU 111 HD21 LEU 111 0.554 5.642 19.372 668 HD22 LEU 111 HD22 LEU 111 -0.168 4.568 20.570 669 HD23 LEU 111 HD23 LEU 111 -0.320 6.315 20.749 670 HA PRO 112 HA PRO 112 -3.368 9.039 15.063 671 HB2 PRO 112 HB2 PRO 112 -4.140 10.675 17.110 672 HB3 PRO 112 HB3 PRO 112 -5.240 9.682 16.147 673 HG2 PRO 112 HG2 PRO 112 -4.061 9.157 18.835 674 HG3 PRO 112 HG3 PRO 112 -5.698 8.852 18.243 675 HD2 PRO 112 HD2 PRO 112 -3.865 6.883 18.466 676 HD3 PRO 112 HD3 PRO 112 -5.083 6.890 17.176 677 H CYS 113 H CYS 113 -2.369 11.214 15.146 678 HA CYS 113 HA CYS 113 -0.663 12.001 17.114 679 HB2 CYS 113 HB2 CYS 113 1.289 10.990 17.018 680 HB3 CYS 113 HB3 CYS 113 0.730 9.993 15.693 681 H GLY 114 H GLY 114 1.295 13.627 15.984 682 HA2 GLY 114 HA2 GLY 114 1.605 15.442 14.591 683 HA3 GLY 114 HA3 GLY 114 0.263 14.882 13.621 684 HA PRO 115 HA PRO 115 -0.924 19.001 15.446 685 HB2 PRO 115 HB2 PRO 115 -2.406 19.773 13.357 686 HB3 PRO 115 HB3 PRO 115 -0.626 19.825 13.296 687 HG2 PRO 115 HG2 PRO 115 -2.380 17.502 12.653 688 HG3 PRO 115 HG3 PRO 115 -1.403 18.415 11.441 689 HD2 PRO 115 HD2 PRO 115 -0.262 16.333 12.431 690 HD3 PRO 115 HD3 PRO 115 0.621 17.859 12.739 691 H GLY 116 H GLY 116 -1.995 18.055 16.821 692 HA2 GLY 116 HA2 GLY 116 -4.000 18.189 18.206 693 HA3 GLY 116 HA3 GLY 116 -4.930 18.114 16.719 694 H GLY 117 H GLY 117 -2.617 15.945 16.370 695 HA2 GLY 117 HA2 GLY 117 -2.407 13.674 16.685 696 HA3 GLY 117 HA3 GLY 117 -3.494 13.898 18.007 697 H LYS 118 H LYS 118 -4.156 14.808 14.771 698 HA LYS 118 HA LYS 118 -6.505 13.118 14.681 699 HB2 LYS 118 HB2 LYS 118 -5.573 14.870 12.432 700 HB3 LYS 118 HB3 LYS 118 -7.211 14.392 12.850 701 HG2 LYS 118 HG2 LYS 118 -6.057 15.829 15.032 702 HG3 LYS 118 HG3 LYS 118 -5.862 16.752 13.545 703 HD2 LYS 118 HD2 LYS 118 -8.452 15.799 13.384 704 HD3 LYS 118 HD3 LYS 118 -8.256 16.175 15.097 705 HE2 LYS 118 HE2 LYS 118 -7.262 18.411 14.212 706 HE3 LYS 118 HE3 LYS 118 -8.107 17.990 12.722 707 HZ1 LYS 118 HZ1 LYS 118 -9.908 17.596 14.792 708 HZ2 LYS 118 HZ2 LYS 118 -9.935 18.822 13.627 709 HZ3 LYS 118 HZ3 LYS 118 -9.159 19.080 15.108 710 H GLY 119 H GLY 119 -3.354 13.277 13.122 711 HA2 GLY 119 HA2 GLY 119 -3.987 11.301 11.114 712 HA3 GLY 119 HA3 GLY 119 -2.405 11.991 11.433 713 H ARG 120 H ARG 120 -1.568 9.555 11.201 714 HA ARG 120 HA ARG 120 -1.822 8.369 13.788 715 HB2 ARG 120 HB2 ARG 120 -1.833 6.888 11.194 716 HB3 ARG 120 HB3 ARG 120 -2.000 6.184 12.779 717 HG2 ARG 120 HG2 ARG 120 -4.214 6.321 12.607 718 HG3 ARG 120 HG3 ARG 120 -4.104 8.065 12.373 719 HD2 ARG 120 HD2 ARG 120 -3.940 7.812 10.014 720 HD3 ARG 120 HD3 ARG 120 -3.702 6.072 10.150 721 HE ARG 120 HE ARG 120 -5.979 5.801 10.412 722 HH11 ARG 120 HH11 ARG 120 -5.173 9.196 10.539 723 HH12 ARG 120 HH12 ARG 120 -6.821 9.717 10.445 724 HH21 ARG 120 HH21 ARG 120 -8.148 6.490 10.294 725 HH22 ARG 120 HH22 ARG 120 -8.508 8.184 10.308 726 H CYS 121 H CYS 121 0.160 6.662 13.805 727 HA CYS 121 HA CYS 121 2.441 8.077 12.575 728 HB2 CYS 121 HB2 CYS 121 2.101 6.515 15.099 729 HB3 CYS 121 HB3 CYS 121 3.681 6.495 14.333 730 H PHE 122 H PHE 122 4.073 6.985 11.494 731 HA PHE 122 HA PHE 122 3.742 4.111 10.965 732 HB2 PHE 122 HB2 PHE 122 3.882 6.260 8.840 733 HB3 PHE 122 HB3 PHE 122 4.064 4.538 8.523 734 HD1 PHE 122 HD1 PHE 122 1.711 7.122 9.742 735 HD2 PHE 122 HD2 PHE 122 2.212 3.133 8.318 736 HE1 PHE 122 HE1 PHE 122 -0.735 6.869 9.544 737 HE2 PHE 122 HE2 PHE 122 -0.226 2.893 8.118 738 HZ PHE 122 HZ PHE 122 -1.701 4.765 8.730 739 H GLY 123 H GLY 123 5.726 5.983 12.328 740 HA2 GLY 123 HA2 GLY 123 8.069 4.593 11.763 741 HA3 GLY 123 HA3 GLY 123 8.093 6.046 10.772 742 HA PRO 124 HA PRO 124 9.618 7.167 15.003 743 HB2 PRO 124 HB2 PRO 124 12.124 8.021 13.902 744 HB3 PRO 124 HB3 PRO 124 11.816 6.654 14.972 745 HG2 PRO 124 HG2 PRO 124 12.631 6.442 12.342 746 HG3 PRO 124 HG3 PRO 124 11.814 5.163 13.255 747 HD2 PRO 124 HD2 PRO 124 10.691 7.085 11.258 748 HD3 PRO 124 HD3 PRO 124 10.293 5.373 11.530 749 H SER 125 H SER 125 10.723 8.911 12.085 750 HA SER 125 HA SER 125 9.914 11.446 13.348 751 HB2 SER 125 HB2 SER 125 12.228 10.663 11.866 752 HB3 SER 125 HB3 SER 125 11.372 11.889 10.919 753 HG SER 125 HG SER 125 11.597 13.316 12.561 754 H ILE 126 H ILE 126 8.399 9.320 11.555 755 HA ILE 126 HA ILE 126 7.317 11.307 9.689 756 HB ILE 126 HB ILE 126 7.045 8.405 9.133 757 HG12 ILE 126 HG12 ILE 126 9.502 9.936 8.295 758 HG13 ILE 126 HG13 ILE 126 9.485 8.911 9.728 759 HG21 ILE 126 HG21 ILE 126 6.311 9.157 7.205 760 HG22 ILE 126 HG22 ILE 126 7.768 10.106 6.950 761 HG23 ILE 126 HG23 ILE 126 6.418 10.794 7.849 762 HD11 ILE 126 HD11 ILE 126 8.844 7.982 6.944 763 HD12 ILE 126 HD12 ILE 126 8.955 6.992 8.395 764 HD13 ILE 126 HD13 ILE 126 10.398 7.776 7.755 765 H CYS 127 H CYS 127 5.255 11.873 9.981 766 HA CYS 127 HA CYS 127 3.451 9.834 11.075 767 HB2 CYS 127 HB2 CYS 127 4.186 11.607 12.801 768 HB3 CYS 127 HB3 CYS 127 3.095 12.664 11.926 769 H CYS 128 H CYS 128 1.976 9.425 9.834 770 HA CYS 128 HA CYS 128 0.719 11.390 8.071 771 HB2 CYS 128 HB2 CYS 128 0.663 8.710 7.035 772 HB3 CYS 128 HB3 CYS 128 1.321 10.152 6.292 773 H GLY 129 H GLY 129 -1.704 11.391 8.130 774 HA2 GLY 129 HA2 GLY 129 -2.858 8.966 9.162 775 HA3 GLY 129 HA3 GLY 129 -3.355 10.592 9.615 776 H ASP 130 H ASP 130 -5.411 9.959 8.541 777 HA ASP 130 HA ASP 130 -5.385 9.465 5.780 778 HB2 ASP 130 HB2 ASP 130 -7.830 9.989 5.867 779 HB3 ASP 130 HB3 ASP 130 -7.277 8.716 6.950 780 H GLU 131 H GLU 131 -6.764 12.385 7.226 781 HA GLU 131 HA GLU 131 -6.147 13.763 4.787 782 HB2 GLU 131 HB2 GLU 131 -7.592 15.324 6.746 783 HB3 GLU 131 HB3 GLU 131 -8.096 14.858 5.133 784 HG2 GLU 131 HG2 GLU 131 -8.491 12.551 6.560 785 HG3 GLU 131 HG3 GLU 131 -8.863 13.798 7.746 786 H LEU 132 H LEU 132 -4.238 13.120 6.783 787 HA LEU 132 HA LEU 132 -3.295 15.781 7.381 788 HB2 LEU 132 HB2 LEU 132 -3.887 13.568 9.063 789 HB3 LEU 132 HB3 LEU 132 -2.173 13.813 9.048 790 HG LEU 132 HG LEU 132 -4.192 15.956 9.652 791 HD11 LEU 132 HD11 LEU 132 -4.222 14.087 11.246 792 HD12 LEU 132 HD12 LEU 132 -3.758 15.634 11.962 793 HD13 LEU 132 HD13 LEU 132 -2.527 14.417 11.616 794 HD21 LEU 132 HD21 LEU 132 -1.476 16.252 10.688 795 HD22 LEU 132 HD22 LEU 132 -2.519 17.417 9.877 796 HD23 LEU 132 HD23 LEU 132 -1.579 16.268 8.928 797 H GLY 133 H GLY 133 -2.985 12.750 5.926 798 HA2 GLY 133 HA2 GLY 133 -1.488 11.803 4.629 799 HA3 GLY 133 HA3 GLY 133 -0.913 13.413 4.394 800 H CYS 134 H CYS 134 1.373 13.199 4.590 801 HA CYS 134 HA CYS 134 2.194 11.916 7.092 802 HB2 CYS 134 HB2 CYS 134 2.384 10.520 4.960 803 HB3 CYS 134 HB3 CYS 134 3.732 11.565 4.561 804 H PHE 135 H PHE 135 3.404 13.178 8.341 805 HA PHE 135 HA PHE 135 5.031 15.248 7.130 806 HB2 PHE 135 HB2 PHE 135 5.224 15.049 10.017 807 HB3 PHE 135 HB3 PHE 135 4.703 16.415 9.037 808 HD1 PHE 135 HD1 PHE 135 2.283 15.758 7.861 809 HD2 PHE 135 HD2 PHE 135 3.738 14.517 11.647 810 HE1 PHE 135 HE1 PHE 135 -0.016 15.369 8.611 811 HE2 PHE 135 HE2 PHE 135 1.439 14.124 12.409 812 HZ PHE 135 HZ PHE 135 -0.447 14.548 10.887 813 H VAL 136 H VAL 136 6.917 14.414 6.460 814 HA VAL 136 HA VAL 136 8.087 12.281 8.052 815 HB VAL 136 HB VAL 136 9.319 13.369 5.538 816 HG11 VAL 136 HG11 VAL 136 10.015 11.339 7.262 817 HG12 VAL 136 HG12 VAL 136 10.601 11.551 5.614 818 HG13 VAL 136 HG13 VAL 136 9.232 10.488 5.930 819 HG21 VAL 136 HG21 VAL 136 6.818 12.935 5.243 820 HG22 VAL 136 HG22 VAL 136 7.201 11.230 5.468 821 HG23 VAL 136 HG23 VAL 136 7.908 12.118 4.122 822 H GLY 137 H GLY 137 8.479 13.551 9.797 823 HA2 GLY 137 HA2 GLY 137 10.476 14.334 10.968 824 HA3 GLY 137 HA3 GLY 137 10.944 15.196 9.514 825 H THR 138 H THR 138 9.327 15.343 12.482 826 HA THR 138 HA THR 138 9.214 18.113 12.658 827 HB THR 138 HB THR 138 7.410 18.529 11.340 828 HG1 THR 138 HG1 THR 138 5.584 17.518 13.107 829 HG21 THR 138 HG21 THR 138 7.031 16.550 10.246 830 HG22 THR 138 HG22 THR 138 5.505 16.826 11.093 831 HG23 THR 138 HG23 THR 138 6.675 15.672 11.737 832 H ALA 139 H ALA 139 7.932 18.753 14.789 833 HA ALA 139 HA ALA 139 8.624 16.789 16.747 834 HB1 ALA 139 HB1 ALA 139 8.677 19.269 17.111 835 HB2 ALA 139 HB2 ALA 139 7.861 18.351 18.376 836 HB3 ALA 139 HB3 ALA 139 6.914 19.231 17.177 837 H GLU 140 H GLU 140 5.613 17.865 15.238 838 HA GLU 140 HA GLU 140 3.775 16.544 16.804 839 HB2 GLU 140 HB2 GLU 140 3.916 17.620 14.060 840 HB3 GLU 140 HB3 GLU 140 2.662 16.422 14.326 841 HG2 GLU 140 HG2 GLU 140 1.393 17.873 15.430 842 HG3 GLU 140 HG3 GLU 140 2.734 18.370 16.457 843 H ALA 141 H ALA 141 6.188 15.178 14.878 844 HA ALA 141 HA ALA 141 4.788 12.629 14.659 845 HB1 ALA 141 HB1 ALA 141 6.919 13.940 13.111 846 HB2 ALA 141 HB2 ALA 141 5.691 12.784 12.600 847 HB3 ALA 141 HB3 ALA 141 7.156 12.216 13.403 848 H LEU 142 H LEU 142 7.285 14.312 16.394 849 HA LEU 142 HA LEU 142 8.996 12.380 17.147 850 HB2 LEU 142 HB2 LEU 142 8.004 14.835 18.386 851 HB3 LEU 142 HB3 LEU 142 8.639 13.677 19.535 852 HG LEU 142 HG LEU 142 10.302 14.313 17.146 853 HD11 LEU 142 HD11 LEU 142 10.559 16.471 17.575 854 HD12 LEU 142 HD12 LEU 142 11.000 16.113 19.244 855 HD13 LEU 142 HD13 LEU 142 9.310 16.368 18.815 856 HD21 LEU 142 HD21 LEU 142 10.739 13.519 19.997 857 HD22 LEU 142 HD22 LEU 142 12.046 14.212 19.039 858 HD23 LEU 142 HD23 LEU 142 11.271 12.716 18.520 859 H ARG 143 H ARG 143 5.723 12.697 18.416 860 HA ARG 143 HA ARG 143 5.925 10.828 20.497 861 HB2 ARG 143 HB2 ARG 143 3.427 10.302 19.703 862 HB3 ARG 143 HB3 ARG 143 3.825 11.777 20.557 863 HG2 ARG 143 HG2 ARG 143 3.956 11.803 17.596 864 HG3 ARG 143 HG3 ARG 143 2.373 11.781 18.370 865 HD2 ARG 143 HD2 ARG 143 4.543 13.852 18.656 866 HD3 ARG 143 HD3 ARG 143 2.936 14.056 17.973 867 HE ARG 143 HE ARG 143 2.499 13.308 20.568 868 HH11 ARG 143 HH11 ARG 143 4.299 15.851 18.996 869 HH12 ARG 143 HH12 ARG 143 4.037 17.001 20.263 870 HH21 ARG 143 HH21 ARG 143 2.144 14.835 22.247 871 HH22 ARG 143 HH22 ARG 143 2.815 16.426 22.104 872 H CYS 144 H CYS 144 5.729 10.611 17.124 873 HA CYS 144 HA CYS 144 5.162 7.908 16.694 874 HB2 CYS 144 HB2 CYS 144 6.950 9.718 15.076 875 HB3 CYS 144 HB3 CYS 144 6.682 8.055 14.621 876 H GLN 145 H GLN 145 7.657 9.015 18.466 877 HA GLN 145 HA GLN 145 9.652 6.981 17.880 878 HB2 GLN 145 HB2 GLN 145 9.783 9.431 19.153 879 HB3 GLN 145 HB3 GLN 145 9.935 8.289 20.480 880 HG2 GLN 145 HG2 GLN 145 11.595 7.972 18.017 881 HG3 GLN 145 HG3 GLN 145 12.054 9.130 19.265 882 HE21 GLN 145 HE21 GLN 145 12.001 5.857 18.317 883 HE22 GLN 145 HE22 GLN 145 12.726 5.191 19.737 884 H GLU 146 H GLU 146 6.837 7.234 19.846 885 HA GLU 146 HA GLU 146 7.704 5.149 21.656 886 HB2 GLU 146 HB2 GLU 146 5.075 6.601 21.356 887 HB3 GLU 146 HB3 GLU 146 5.338 5.312 22.522 888 HG2 GLU 146 HG2 GLU 146 7.244 7.579 22.534 889 HG3 GLU 146 HG3 GLU 146 5.614 7.870 23.140 890 H GLU 147 H GLU 147 7.073 4.985 18.568 891 HA GLU 147 HA GLU 147 5.126 2.855 18.562 892 HB2 GLU 147 HB2 GLU 147 6.338 4.576 16.612 893 HB3 GLU 147 HB3 GLU 147 6.598 2.906 16.131 894 HG2 GLU 147 HG2 GLU 147 4.040 2.687 16.669 895 HG3 GLU 147 HG3 GLU 147 4.062 4.430 16.406 896 H ASN 148 H ASN 148 8.180 3.067 19.683 897 HA ASN 148 HA ASN 148 9.065 0.497 18.613 898 HB2 ASN 148 HB2 ASN 148 10.553 2.638 19.037 899 HB3 ASN 148 HB3 ASN 148 10.605 2.012 20.682 900 HD21 ASN 148 HD21 ASN 148 11.302 1.253 17.325 901 HD22 ASN 148 HD22 ASN 148 12.524 0.074 17.651 902 H TYR 149 H TYR 149 7.739 1.962 21.483 903 HA TYR 149 HA TYR 149 8.061 -0.573 22.973 904 HB2 TYR 149 HB2 TYR 149 8.705 1.852 23.862 905 HB3 TYR 149 HB3 TYR 149 6.994 1.896 24.271 906 HD1 TYR 149 HD1 TYR 149 6.064 0.224 25.866 907 HD2 TYR 149 HD2 TYR 149 10.242 0.525 25.113 908 HE1 TYR 149 HE1 TYR 149 6.517 -1.064 27.908 909 HE2 TYR 149 HE2 TYR 149 10.706 -0.765 27.157 910 HH TYR 149 HH TYR 149 8.712 -1.174 29.569 911 H LEU 150 H LEU 150 6.086 -0.148 20.832 912 HA LEU 150 HA LEU 150 3.639 -0.509 22.440 913 HB2 LEU 150 HB2 LEU 150 4.176 1.367 20.345 914 HB3 LEU 150 HB3 LEU 150 2.917 0.267 19.815 915 HG LEU 150 HG LEU 150 1.771 0.799 22.058 916 HD11 LEU 150 HD11 LEU 150 2.508 3.368 22.480 917 HD12 LEU 150 HD12 LEU 150 4.065 2.631 22.101 918 HD13 LEU 150 HD13 LEU 150 3.089 1.997 23.425 919 HD21 LEU 150 HD21 LEU 150 0.535 1.681 20.399 920 HD22 LEU 150 HD22 LEU 150 1.935 2.375 19.582 921 HD23 LEU 150 HD23 LEU 150 1.216 3.207 20.960 922 HA PRO 151 HA PRO 151 3.561 -4.475 20.403 923 HB2 PRO 151 HB2 PRO 151 1.239 -5.380 21.409 924 HB3 PRO 151 HB3 PRO 151 2.690 -5.220 22.408 925 HG2 PRO 151 HG2 PRO 151 0.328 -3.393 22.190 926 HG3 PRO 151 HG3 PRO 151 1.201 -3.925 23.638 927 HD2 PRO 151 HD2 PRO 151 1.606 -1.505 22.435 928 HD3 PRO 151 HD3 PRO 151 2.850 -2.356 23.370 929 H SER 152 H SER 152 2.000 -1.868 19.348 930 HA SER 152 HA SER 152 0.087 -3.303 17.653 931 HB2 SER 152 HB2 SER 152 -0.761 -0.997 17.112 932 HB3 SER 152 HB3 SER 152 -0.918 -1.449 18.808 933 HG SER 152 HG SER 152 1.020 0.252 17.634 934 HA PRO 153 HA PRO 153 3.284 -2.549 14.542 935 HB2 PRO 153 HB2 PRO 153 2.555 -4.788 13.055 936 HB3 PRO 153 HB3 PRO 153 3.783 -4.741 14.317 937 HG2 PRO 153 HG2 PRO 153 1.286 -6.106 14.372 938 HG3 PRO 153 HG3 PRO 153 2.481 -5.985 15.671 939 HD2 PRO 153 HD2 PRO 153 -0.034 -4.484 15.275 940 HD3 PRO 153 HD3 PRO 153 0.866 -4.816 16.769 941 H CYS 154 H CYS 154 -0.076 -2.441 14.340 942 HA CYS 154 HA CYS 154 -1.504 -1.512 12.846 943 HB2 CYS 154 HB2 CYS 154 0.562 0.129 12.774 944 HB3 CYS 154 HB3 CYS 154 0.702 -0.498 11.136 945 H GLN 155 H GLN 155 -2.451 -3.363 11.935 946 HA GLN 155 HA GLN 155 -0.978 -4.396 9.589 947 HB2 GLN 155 HB2 GLN 155 -3.351 -5.609 10.965 948 HB3 GLN 155 HB3 GLN 155 -2.281 -6.380 9.808 949 HG2 GLN 155 HG2 GLN 155 -1.540 -5.452 12.566 950 HG3 GLN 155 HG3 GLN 155 -1.787 -7.123 12.055 951 HE21 GLN 155 HE21 GLN 155 -0.509 -6.997 9.569 952 HE22 GLN 155 HE22 GLN 155 1.184 -6.784 9.830 953 H SER 156 H SER 156 -1.645 -2.371 8.472 954 HA SER 156 HA SER 156 -3.524 -2.846 6.506 955 HB2 SER 156 HB2 SER 156 -5.013 -2.456 8.643 956 HB3 SER 156 HB3 SER 156 -4.713 -0.761 8.284 957 HG SER 156 HG SER 156 -5.663 -2.594 6.348 958 H GLY 157 H GLY 157 -1.485 -1.990 5.646 959 HA2 GLY 157 HA2 GLY 157 -1.676 0.482 4.497 960 HA3 GLY 157 HA3 GLY 157 -0.801 0.752 6.010 961 H GLN 158 H GLN 158 -0.811 -2.018 3.832 962 HA GLN 158 HA GLN 158 2.078 -1.649 3.490 963 HB2 GLN 158 HB2 GLN 158 2.129 -4.158 3.226 964 HB3 GLN 158 HB3 GLN 158 1.726 -3.589 4.841 965 HG2 GLN 158 HG2 GLN 158 -0.553 -4.139 4.576 966 HG3 GLN 158 HG3 GLN 158 -0.375 -4.361 2.837 967 HE21 GLN 158 HE21 GLN 158 -0.872 -5.991 5.568 968 HE22 GLN 158 HE22 GLN 158 -0.122 -7.498 5.185 969 H LYS 159 H LYS 159 1.266 -0.342 1.774 970 HA LYS 159 HA LYS 159 0.751 -1.805 -0.709 971 HB2 LYS 159 HB2 LYS 159 -0.864 0.018 0.019 972 HB3 LYS 159 HB3 LYS 159 0.447 1.149 -0.282 973 HG2 LYS 159 HG2 LYS 159 -0.107 1.229 -2.410 974 HG3 LYS 159 HG3 LYS 159 0.233 -0.496 -2.559 975 HD2 LYS 159 HD2 LYS 159 -2.363 0.299 -1.359 976 HD3 LYS 159 HD3 LYS 159 -2.160 0.532 -3.097 977 HE2 LYS 159 HE2 LYS 159 -1.628 -2.063 -1.661 978 HE3 LYS 159 HE3 LYS 159 -3.154 -1.669 -2.454 979 HZ1 LYS 159 HZ1 LYS 159 -2.072 -1.566 -4.549 980 HZ2 LYS 159 HZ2 LYS 159 -1.582 -3.009 -3.817 981 HZ3 LYS 159 HZ3 LYS 159 -0.536 -1.682 -3.852 982 HA PRO 160 HA PRO 160 5.054 -0.089 -0.427 983 HB2 PRO 160 HB2 PRO 160 6.521 -2.286 -1.104 984 HB3 PRO 160 HB3 PRO 160 6.014 -1.908 0.548 985 HG2 PRO 160 HG2 PRO 160 4.768 -3.774 -1.434 986 HG3 PRO 160 HG3 PRO 160 5.060 -4.015 0.298 987 HD2 PRO 160 HD2 PRO 160 2.630 -3.327 -0.674 988 HD3 PRO 160 HD3 PRO 160 3.204 -2.786 0.912 989 H CYS 161 H CYS 161 4.672 1.179 -2.071 990 HA CYS 161 HA CYS 161 5.287 0.286 -4.767 991 HB2 CYS 161 HB2 CYS 161 4.116 2.058 -5.675 992 HB3 CYS 161 HB3 CYS 161 3.141 1.626 -4.276 993 H GLY 162 H GLY 162 6.158 2.863 -5.614 994 HA2 GLY 162 HA2 GLY 162 8.355 3.776 -5.977 995 HA3 GLY 162 HA3 GLY 162 7.994 4.194 -4.308 996 H SER 163 H SER 163 10.429 4.162 -4.158 997 HA SER 163 HA SER 163 11.764 1.653 -4.393 998 HB2 SER 163 HB2 SER 163 12.806 3.978 -4.543 999 HB3 SER 163 HB3 SER 163 12.701 4.031 -2.784 1000 HG SER 163 HG SER 163 14.717 3.261 -3.357 1001 H GLY 164 H GLY 164 9.925 0.592 -3.020 1002 HA2 GLY 164 HA2 GLY 164 9.773 -0.779 -1.140 1003 HA3 GLY 164 HA3 GLY 164 11.080 0.115 -0.400 1004 H GLY 165 H GLY 165 8.714 2.258 -1.370 1005 HA2 GLY 165 HA2 GLY 165 7.943 2.458 1.457 1006 HA3 GLY 165 HA3 GLY 165 7.635 3.684 0.252 1007 H ARG 166 H ARG 166 6.096 1.973 2.389 1008 HA ARG 166 HA ARG 166 3.900 1.119 0.701 1009 HB2 ARG 166 HB2 ARG 166 2.967 0.040 2.759 1010 HB3 ARG 166 HB3 ARG 166 4.487 -0.626 2.193 1011 HG2 ARG 166 HG2 ARG 166 4.567 1.510 4.265 1012 HG3 ARG 166 HG3 ARG 166 4.027 -0.098 4.744 1013 HD2 ARG 166 HD2 ARG 166 6.578 0.296 3.217 1014 HD3 ARG 166 HD3 ARG 166 6.520 0.481 4.968 1015 HE ARG 166 HE ARG 166 5.622 -2.010 3.687 1016 HH11 ARG 166 HH11 ARG 166 7.709 -0.344 5.952 1017 HH12 ARG 166 HH12 ARG 166 8.351 -1.806 6.616 1018 HH21 ARG 166 HH21 ARG 166 6.486 -3.923 4.561 1019 HH22 ARG 166 HH22 ARG 166 7.662 -3.833 5.829 1020 H CYS 167 H CYS 167 1.702 1.664 1.184 1021 HA CYS 167 HA CYS 167 1.187 4.280 1.413 1022 HB2 CYS 167 HB2 CYS 167 -0.328 2.568 0.472 1023 HB3 CYS 167 HB3 CYS 167 -0.649 1.980 2.094 1024 H ALA 168 H ALA 168 1.676 5.511 3.106 1025 HA ALA 168 HA ALA 168 1.215 4.462 5.804 1026 HB1 ALA 168 HB1 ALA 168 2.427 6.770 6.294 1027 HB2 ALA 168 HB2 ALA 168 3.044 6.504 4.666 1028 HB3 ALA 168 HB3 ALA 168 3.326 5.304 5.927 1029 H ALA 169 H ALA 169 0.282 6.878 3.465 1030 HA ALA 169 HA ALA 169 -2.124 7.401 5.034 1031 HB1 ALA 169 HB1 ALA 169 -0.107 9.591 4.901 1032 HB2 ALA 169 HB2 ALA 169 -0.862 8.888 6.324 1033 HB3 ALA 169 HB3 ALA 169 -1.806 9.866 5.206 1034 H ALA 170 H ALA 170 -3.513 9.046 4.093 1035 HA ALA 170 HA ALA 170 -4.264 8.472 1.615 1036 HB1 ALA 170 HB1 ALA 170 -5.569 10.392 1.507 1037 HB2 ALA 170 HB2 ALA 170 -4.399 11.353 2.411 1038 HB3 ALA 170 HB3 ALA 170 -5.358 10.118 3.234 1039 H GLY 171 H GLY 171 -2.763 8.101 0.102 1040 HA2 GLY 171 HA2 GLY 171 -1.677 8.701 -1.821 1041 HA3 GLY 171 HA3 GLY 171 -1.615 10.355 -1.289 1042 H ILE 172 H ILE 172 -0.412 8.540 1.230 1043 HA ILE 172 HA ILE 172 2.362 9.089 0.412 1044 HB ILE 172 HB ILE 172 1.672 8.052 3.140 1045 HG12 ILE 172 HG12 ILE 172 0.034 9.751 2.980 1046 HG13 ILE 172 HG13 ILE 172 1.389 10.520 3.795 1047 HG21 ILE 172 HG21 ILE 172 3.724 8.775 3.671 1048 HG22 ILE 172 HG22 ILE 172 3.524 10.293 2.798 1049 HG23 ILE 172 HG23 ILE 172 3.989 8.830 1.929 1050 HD11 ILE 172 HD11 ILE 172 1.552 10.658 0.955 1051 HD12 ILE 172 HD12 ILE 172 1.704 11.951 2.144 1052 HD13 ILE 172 HD13 ILE 172 0.106 11.452 1.573 1053 H CYS 173 H CYS 173 3.556 7.566 -0.282 1054 HA CYS 173 HA CYS 173 2.957 4.800 0.455 1055 HB2 CYS 173 HB2 CYS 173 2.464 5.513 -1.892 1056 HB3 CYS 173 HB3 CYS 173 4.180 5.830 -2.099 1057 H CYS 174 H CYS 174 4.472 4.748 2.199 1058 HA CYS 174 HA CYS 174 7.186 4.579 1.307 1059 HB2 CYS 174 HB2 CYS 174 7.947 6.291 2.957 1060 HB3 CYS 174 HB3 CYS 174 7.175 6.836 1.484 1061 H SER 175 H SER 175 8.696 4.701 3.314 1062 HA SER 175 HA SER 175 7.745 2.776 5.337 1063 HB2 SER 175 HB2 SER 175 10.226 2.028 5.250 1064 HB3 SER 175 HB3 SER 175 9.200 1.565 3.898 1065 HG SER 175 HG SER 175 10.047 3.352 2.753 1066 HA PRO 176 HA PRO 176 9.434 5.486 8.390 1067 HB2 PRO 176 HB2 PRO 176 11.193 4.106 9.913 1068 HB3 PRO 176 HB3 PRO 176 9.448 3.833 9.966 1069 HG2 PRO 176 HG2 PRO 176 11.566 2.286 8.532 1070 HG3 PRO 176 HG3 PRO 176 10.168 1.691 9.444 1071 HD2 PRO 176 HD2 PRO 176 10.213 1.832 6.740 1072 HD3 PRO 176 HD3 PRO 176 8.724 2.012 7.685 1073 H ASP 177 H ASP 177 10.990 5.397 5.824 1074 HA ASP 177 HA ASP 177 13.394 6.746 6.823 1075 HB2 ASP 177 HB2 ASP 177 14.626 5.775 4.811 1076 HB3 ASP 177 HB3 ASP 177 14.298 4.668 6.138 1077 H GLY 178 H GLY 178 11.660 6.055 3.755 1078 HA2 GLY 178 HA2 GLY 178 11.775 8.935 3.229 1079 HA3 GLY 178 HA3 GLY 178 12.033 7.774 1.955 1080 H CYS 179 H CYS 179 10.159 9.267 1.114 1081 HA CYS 179 HA CYS 179 7.745 7.739 1.468 1082 HB2 CYS 179 HB2 CYS 179 7.966 10.576 2.321 1083 HB3 CYS 179 HB3 CYS 179 6.442 10.000 1.655 1084 H HIS 180 H HIS 180 5.986 8.250 -0.196 1085 HA HIS 180 HA HIS 180 7.009 9.782 -2.477 1086 HB2 HIS 180 HB2 HIS 180 6.309 6.844 -2.690 1087 HB3 HIS 180 HB3 HIS 180 6.667 7.908 -4.044 1088 HD1 HIS 180 HD1 HIS 180 8.286 5.983 -1.295 1089 HD2 HIS 180 HD2 HIS 180 9.386 8.519 -4.396 1090 HE1 HIS 180 HE1 HIS 180 10.780 5.740 -1.510 1091 HE2 HIS 180 HE2 HIS 180 11.396 7.169 -3.490 1092 H GLU 181 H GLU 181 5.438 10.619 -3.746 1093 HA GLU 181 HA GLU 181 2.780 10.684 -2.783 1094 HB2 GLU 181 HB2 GLU 181 4.275 11.799 -5.075 1095 HB3 GLU 181 HB3 GLU 181 2.555 11.567 -5.355 1096 HG2 GLU 181 HG2 GLU 181 2.329 12.802 -3.059 1097 HG3 GLU 181 HG3 GLU 181 3.942 13.390 -3.458 1098 H ASP 182 H ASP 182 1.159 9.296 -3.098 1099 HA ASP 182 HA ASP 182 1.202 7.599 -5.504 1100 HB2 ASP 182 HB2 ASP 182 1.340 5.628 -4.385 1101 HB3 ASP 182 HB3 ASP 182 2.155 6.632 -3.180 1102 HA PRO 183 HA PRO 183 -2.982 9.344 -5.353 1103 HB2 PRO 183 HB2 PRO 183 -3.230 7.859 -7.895 1104 HB3 PRO 183 HB3 PRO 183 -3.506 9.569 -7.553 1105 HG2 PRO 183 HG2 PRO 183 -1.354 8.759 -8.916 1106 HG3 PRO 183 HG3 PRO 183 -1.269 10.111 -7.772 1107 HD2 PRO 183 HD2 PRO 183 -0.374 7.275 -7.426 1108 HD3 PRO 183 HD3 PRO 183 0.415 8.779 -6.902 1109 H ALA 184 H ALA 184 -2.146 5.954 -5.790 1110 HA ALA 184 HA ALA 184 -4.769 4.931 -5.772 1111 HB1 ALA 184 HB1 ALA 184 -2.192 3.853 -5.934 1112 HB2 ALA 184 HB2 ALA 184 -3.728 3.009 -6.127 1113 HB3 ALA 184 HB3 ALA 184 -2.955 3.081 -4.543 1114 H CYS 185 H CYS 185 -3.100 6.477 -3.308 1115 HA CYS 185 HA CYS 185 -4.930 5.343 -1.287 1116 HB2 CYS 185 HB2 CYS 185 -1.991 5.865 -1.171 1117 HB3 CYS 185 HB3 CYS 185 -2.930 6.220 0.266 1118 H ASP 186 H ASP 186 -4.543 8.011 -3.086 1119 HA ASP 186 HA ASP 186 -4.218 9.969 -1.017 1120 HB2 ASP 186 HB2 ASP 186 -3.995 10.121 -3.723 1121 HB3 ASP 186 HB3 ASP 186 -5.535 10.936 -3.455 1122 HA PRO 187 HA PRO 187 -8.815 10.481 -0.974 1123 HB2 PRO 187 HB2 PRO 187 -10.223 10.116 -3.169 1124 HB3 PRO 187 HB3 PRO 187 -9.034 11.410 -3.072 1125 HG2 PRO 187 HG2 PRO 187 -8.964 8.945 -4.660 1126 HG3 PRO 187 HG3 PRO 187 -7.987 10.413 -4.826 1127 HD2 PRO 187 HD2 PRO 187 -7.359 7.912 -3.414 1128 HD3 PRO 187 HD3 PRO 187 -6.269 9.227 -3.907 1129 H GLU 188 H GLU 188 -10.934 9.572 -1.681 1130 HA GLU 188 HA GLU 188 -11.212 6.967 -0.426 1131 HB2 GLU 188 HB2 GLU 188 -13.655 7.272 -0.721 1132 HB3 GLU 188 HB3 GLU 188 -12.911 8.581 0.183 1133 HG2 GLU 188 HG2 GLU 188 -13.136 10.087 -1.583 1134 HG3 GLU 188 HG3 GLU 188 -13.392 8.806 -2.764 1135 H ALA 189 H ALA 189 -9.763 5.892 -2.418 1136 HA ALA 189 HA ALA 189 -11.081 5.720 -4.840 1137 HB1 ALA 189 HB1 ALA 189 -8.511 5.541 -3.996 1138 HB2 ALA 189 HB2 ALA 189 -9.112 4.564 -5.363 1139 HB3 ALA 189 HB3 ALA 189 -8.996 3.841 -3.760 1140 H ALA 190 H ALA 190 -12.786 5.260 -2.890 1141 HA ALA 190 HA ALA 190 -13.170 2.846 -1.663 1142 HB1 ALA 190 HB1 ALA 190 -14.673 5.165 -2.002 1143 HB2 ALA 190 HB2 ALA 190 -14.980 3.847 -0.871 1144 HB3 ALA 190 HB3 ALA 190 -15.745 3.843 -2.460 1145 H PHE 191 H PHE 191 -13.896 0.808 -2.142 1146 HA PHE 191 HA PHE 191 -14.513 0.268 -4.947 1147 HB2 PHE 191 HB2 PHE 191 -12.917 -1.176 -3.559 1148 HB3 PHE 191 HB3 PHE 191 -14.359 -1.806 -2.765 1149 HD1 PHE 191 HD1 PHE 191 -15.966 -3.164 -3.990 1150 HD2 PHE 191 HD2 PHE 191 -12.417 -1.721 -5.846 1151 HE1 PHE 191 HE1 PHE 191 -16.304 -4.737 -5.853 1152 HE2 PHE 191 HE2 PHE 191 -12.747 -3.295 -7.709 1153 HZ PHE 191 HZ PHE 191 -14.693 -4.803 -7.715 1154 H SER 192 H SER 192 -16.589 0.945 -5.305 1155 HA SER 192 HA SER 192 -18.712 0.190 -3.480 1156 HB2 SER 192 HB2 SER 192 -18.458 2.398 -4.915 1157 HB3 SER 192 HB3 SER 192 -19.256 1.424 -6.149 1158 HG SER 192 HG SER 192 -20.511 1.159 -3.772 Start of MODEL 21 1 H1 ALA 1 H1 ALA 1 25.490 31.921 -0.974 2 H2 ALA 1 H2 ALA 1 23.887 32.506 -0.813 3 H3 ALA 1 H3 ALA 1 25.067 32.912 0.357 4 HA ALA 1 HA ALA 1 25.594 34.681 -0.731 5 HB1 ALA 1 HB1 ALA 1 26.657 32.575 -2.334 6 HB2 ALA 1 HB2 ALA 1 27.285 34.200 -2.070 7 HB3 ALA 1 HB3 ALA 1 26.144 33.898 -3.381 8 H VAL 2 H VAL 2 23.261 32.673 -2.395 9 HA VAL 2 HA VAL 2 21.492 34.810 -2.822 10 HB VAL 2 HB VAL 2 21.506 34.356 -5.430 11 HG11 VAL 2 HG11 VAL 2 23.583 36.293 -4.974 12 HG12 VAL 2 HG12 VAL 2 22.300 36.450 -3.774 13 HG13 VAL 2 HG13 VAL 2 21.915 36.528 -5.492 14 HG21 VAL 2 HG21 VAL 2 23.251 32.925 -5.820 15 HG22 VAL 2 HG22 VAL 2 24.256 33.618 -4.548 16 HG23 VAL 2 HG23 VAL 2 24.049 34.477 -6.074 17 H LEU 3 H LEU 3 19.662 34.098 -4.284 18 HA LEU 3 HA LEU 3 18.838 31.456 -3.499 19 HB2 LEU 3 HB2 LEU 3 17.567 33.728 -5.003 20 HB3 LEU 3 HB3 LEU 3 16.795 32.162 -4.881 21 HG LEU 3 HG LEU 3 15.943 33.797 -3.246 22 HD11 LEU 3 HD11 LEU 3 16.514 31.164 -2.822 23 HD12 LEU 3 HD12 LEU 3 15.448 32.173 -1.856 24 HD13 LEU 3 HD13 LEU 3 17.121 31.963 -1.380 25 HD21 LEU 3 HD21 LEU 3 17.628 35.193 -2.579 26 HD22 LEU 3 HD22 LEU 3 18.779 33.876 -2.364 27 HD23 LEU 3 HD23 LEU 3 17.487 34.114 -1.193 28 H ASP 4 H ASP 4 18.382 29.825 -4.773 29 HA ASP 4 HA ASP 4 19.545 29.705 -7.455 30 HB2 ASP 4 HB2 ASP 4 19.406 27.762 -5.220 31 HB3 ASP 4 HB3 ASP 4 19.035 27.099 -6.811 32 H LEU 5 H LEU 5 17.782 30.974 -7.873 33 HA LEU 5 HA LEU 5 15.603 29.673 -8.987 34 HB2 LEU 5 HB2 LEU 5 15.270 30.591 -6.465 35 HB3 LEU 5 HB3 LEU 5 14.884 32.001 -7.404 36 HG LEU 5 HG LEU 5 13.567 29.301 -7.779 37 HD11 LEU 5 HD11 LEU 5 12.906 31.560 -5.978 38 HD12 LEU 5 HD12 LEU 5 12.827 29.828 -5.709 39 HD13 LEU 5 HD13 LEU 5 11.602 30.615 -6.693 40 HD21 LEU 5 HD21 LEU 5 13.048 30.350 -9.735 41 HD22 LEU 5 HD22 LEU 5 13.116 31.962 -9.034 42 HD23 LEU 5 HD23 LEU 5 11.730 30.928 -8.720 43 H ASP 6 H ASP 6 14.475 32.335 -9.191 44 HA ASP 6 HA ASP 6 16.396 34.149 -10.433 45 HB2 ASP 6 HB2 ASP 6 15.626 32.293 -11.943 46 HB3 ASP 6 HB3 ASP 6 14.062 33.126 -12.021 47 H VAL 7 H VAL 7 13.768 33.642 -8.911 48 HA VAL 7 HA VAL 7 12.961 36.154 -8.116 49 HB VAL 7 HB VAL 7 10.562 35.606 -8.367 50 HG11 VAL 7 HG11 VAL 7 12.415 36.433 -10.399 51 HG12 VAL 7 HG12 VAL 7 10.892 37.187 -9.909 52 HG13 VAL 7 HG13 VAL 7 10.891 35.869 -11.086 53 HG21 VAL 7 HG21 VAL 7 11.562 33.481 -10.233 54 HG22 VAL 7 HG22 VAL 7 9.884 34.017 -10.139 55 HG23 VAL 7 HG23 VAL 7 10.639 33.241 -8.750 56 H ARG 8 H ARG 8 12.752 35.866 -5.883 57 HA ARG 8 HA ARG 8 12.982 33.233 -4.904 58 HB2 ARG 8 HB2 ARG 8 12.434 35.874 -3.518 59 HB3 ARG 8 HB3 ARG 8 12.794 34.359 -2.705 60 HG2 ARG 8 HG2 ARG 8 14.776 35.593 -2.666 61 HG3 ARG 8 HG3 ARG 8 14.987 34.377 -3.922 62 HD2 ARG 8 HD2 ARG 8 15.848 36.530 -4.639 63 HD3 ARG 8 HD3 ARG 8 14.498 36.022 -5.637 64 HE ARG 8 HE ARG 8 13.186 37.734 -4.695 65 HH11 ARG 8 HH11 ARG 8 16.409 37.671 -3.350 66 HH12 ARG 8 HH12 ARG 8 16.340 39.304 -2.781 67 HH21 ARG 8 HH21 ARG 8 13.107 39.900 -3.962 68 HH22 ARG 8 HH22 ARG 8 14.470 40.566 -3.127 69 H THR 9 H THR 9 11.097 32.017 -5.077 70 HA THR 9 HA THR 9 8.790 33.622 -4.243 71 HB THR 9 HB THR 9 7.626 31.399 -5.147 72 HG1 THR 9 HG1 THR 9 9.828 31.614 -6.899 73 HG21 THR 9 HG21 THR 9 7.384 33.789 -5.996 74 HG22 THR 9 HG22 THR 9 7.088 32.489 -7.149 75 HG23 THR 9 HG23 THR 9 8.616 33.366 -7.184 76 H CYS 10 H CYS 10 9.206 33.534 -2.201 77 HA CYS 10 HA CYS 10 10.069 31.042 -1.031 78 HB2 CYS 10 HB2 CYS 10 9.475 33.724 0.174 79 HB3 CYS 10 HB3 CYS 10 9.791 32.320 1.194 80 H LEU 11 H LEU 11 7.974 30.019 -2.018 81 HA LEU 11 HA LEU 11 5.432 30.202 -1.342 82 HB2 LEU 11 HB2 LEU 11 7.128 27.758 -1.441 83 HB3 LEU 11 HB3 LEU 11 5.435 27.624 -1.000 84 HG LEU 11 HG LEU 11 5.142 29.083 -3.207 85 HD11 LEU 11 HD11 LEU 11 7.576 27.426 -3.801 86 HD12 LEU 11 HD12 LEU 11 7.597 29.172 -3.558 87 HD13 LEU 11 HD13 LEU 11 6.699 28.478 -4.904 88 HD21 LEU 11 HD21 LEU 11 4.058 27.269 -3.877 89 HD22 LEU 11 HD22 LEU 11 4.721 26.426 -2.487 90 HD23 LEU 11 HD23 LEU 11 5.553 26.352 -4.035 91 HA PRO 12 HA PRO 12 5.087 29.946 3.096 92 HB2 PRO 12 HB2 PRO 12 2.600 30.769 3.306 93 HB3 PRO 12 HB3 PRO 12 3.825 31.829 2.595 94 HG2 PRO 12 HG2 PRO 12 1.711 30.205 1.244 95 HG3 PRO 12 HG3 PRO 12 2.290 31.832 0.853 96 HD2 PRO 12 HD2 PRO 12 3.117 29.423 -0.356 97 HD3 PRO 12 HD3 PRO 12 3.902 31.006 -0.517 98 H CYS 13 H CYS 13 5.079 27.949 4.016 99 HA CYS 13 HA CYS 13 2.624 26.394 3.921 100 HB2 CYS 13 HB2 CYS 13 3.799 24.539 3.424 101 HB3 CYS 13 HB3 CYS 13 5.015 25.675 2.871 102 H GLY 14 H GLY 14 2.940 24.581 5.764 103 HA2 GLY 14 HA2 GLY 14 2.979 24.090 8.017 104 HA3 GLY 14 HA3 GLY 14 3.971 25.524 8.270 105 HA PRO 15 HA PRO 15 -0.428 26.376 9.800 106 HB2 PRO 15 HB2 PRO 15 0.221 27.100 12.283 107 HB3 PRO 15 HB3 PRO 15 0.125 25.365 11.895 108 HG2 PRO 15 HG2 PRO 15 2.462 27.178 11.625 109 HG3 PRO 15 HG3 PRO 15 2.368 25.794 12.773 110 HD2 PRO 15 HD2 PRO 15 3.496 25.316 10.461 111 HD3 PRO 15 HD3 PRO 15 2.129 24.247 10.887 112 H GLY 16 H GLY 16 -0.917 28.460 9.353 113 HA2 GLY 16 HA2 GLY 16 -0.870 30.634 9.041 114 HA3 GLY 16 HA3 GLY 16 0.520 30.613 10.100 115 H GLY 17 H GLY 17 1.572 28.563 7.721 116 HA2 GLY 17 HA2 GLY 17 2.603 28.850 5.837 117 HA3 GLY 17 HA3 GLY 17 1.962 30.447 5.829 118 H LYS 18 H LYS 18 3.816 28.912 8.352 119 HA LYS 18 HA LYS 18 5.906 30.951 8.145 120 HB2 LYS 18 HB2 LYS 18 6.162 29.209 10.414 121 HB3 LYS 18 HB3 LYS 18 6.043 30.961 10.388 122 HG2 LYS 18 HG2 LYS 18 3.445 30.085 9.949 123 HG3 LYS 18 HG3 LYS 18 4.089 28.960 11.144 124 HD2 LYS 18 HD2 LYS 18 4.759 31.751 11.692 125 HD3 LYS 18 HD3 LYS 18 3.023 31.439 11.666 126 HE2 LYS 18 HE2 LYS 18 5.100 30.060 13.363 127 HE3 LYS 18 HE3 LYS 18 3.824 31.146 13.912 128 HZ1 LYS 18 HZ1 LYS 18 2.466 29.427 14.096 129 HZ2 LYS 18 HZ2 LYS 18 3.710 28.378 13.631 130 HZ3 LYS 18 HZ3 LYS 18 2.671 29.027 12.464 131 H GLY 19 H GLY 19 5.641 28.292 6.345 132 HA2 GLY 19 HA2 GLY 19 8.185 27.260 7.003 133 HA3 GLY 19 HA3 GLY 19 6.812 26.203 6.635 134 H ARG 20 H ARG 20 8.507 25.913 4.524 135 HA ARG 20 HA ARG 20 7.478 27.892 2.602 136 HB2 ARG 20 HB2 ARG 20 10.189 27.137 3.148 137 HB3 ARG 20 HB3 ARG 20 9.771 26.626 1.517 138 HG2 ARG 20 HG2 ARG 20 9.891 28.703 0.751 139 HG3 ARG 20 HG3 ARG 20 8.827 29.300 2.025 140 HD2 ARG 20 HD2 ARG 20 10.956 30.425 2.155 141 HD3 ARG 20 HD3 ARG 20 10.751 29.378 3.560 142 HE ARG 20 HE ARG 20 12.171 28.127 1.404 143 HH11 ARG 20 HH11 ARG 20 12.468 30.201 4.192 144 HH12 ARG 20 HH12 ARG 20 14.141 29.831 4.447 145 HH21 ARG 20 HH21 ARG 20 14.367 27.636 1.734 146 HH22 ARG 20 HH22 ARG 20 15.221 28.373 3.049 147 H CYS 21 H CYS 21 7.084 26.873 0.321 148 HA CYS 21 HA CYS 21 6.329 24.038 0.711 149 HB2 CYS 21 HB2 CYS 21 5.069 26.203 -0.917 150 HB3 CYS 21 HB3 CYS 21 4.877 24.540 -1.427 151 H PHE 22 H PHE 22 6.702 22.493 -0.908 152 HA PHE 22 HA PHE 22 8.614 23.290 -3.018 153 HB2 PHE 22 HB2 PHE 22 8.753 20.853 -1.227 154 HB3 PHE 22 HB3 PHE 22 9.758 21.092 -2.654 155 HD1 PHE 22 HD1 PHE 22 8.889 22.581 0.625 156 HD2 PHE 22 HD2 PHE 22 11.748 22.294 -2.514 157 HE1 PHE 22 HE1 PHE 22 10.493 23.867 1.973 158 HE2 PHE 22 HE2 PHE 22 13.357 23.571 -1.162 159 HZ PHE 22 HZ PHE 22 12.733 24.364 1.080 160 H GLY 23 H GLY 23 6.489 20.628 -1.940 161 HA2 GLY 23 HA2 GLY 23 5.816 20.168 -4.783 162 HA3 GLY 23 HA3 GLY 23 5.930 18.873 -3.600 163 HA PRO 24 HA PRO 24 1.483 20.299 -3.956 164 HB2 PRO 24 HB2 PRO 24 0.900 17.441 -4.246 165 HB3 PRO 24 HB3 PRO 24 0.433 18.790 -5.283 166 HG2 PRO 24 HG2 PRO 24 2.260 16.964 -6.050 167 HG3 PRO 24 HG3 PRO 24 2.355 18.663 -6.544 168 HD2 PRO 24 HD2 PRO 24 3.870 17.231 -4.390 169 HD3 PRO 24 HD3 PRO 24 4.450 18.424 -5.573 170 H SER 25 H SER 25 2.213 17.067 -2.575 171 HA SER 25 HA SER 25 0.671 17.817 -0.197 172 HB2 SER 25 HB2 SER 25 1.251 15.280 -1.577 173 HB3 SER 25 HB3 SER 25 1.350 15.159 0.191 174 HG SER 25 HG SER 25 -0.753 15.776 0.338 175 H ILE 26 H ILE 26 3.464 18.779 -0.747 176 HA ILE 26 HA ILE 26 4.578 17.864 1.777 177 HB ILE 26 HB ILE 26 6.323 18.082 -0.629 178 HG12 ILE 26 HG12 ILE 26 5.520 15.445 0.411 179 HG13 ILE 26 HG13 ILE 26 4.409 16.274 -0.648 180 HG21 ILE 26 HG21 ILE 26 6.770 17.783 2.112 181 HG22 ILE 26 HG22 ILE 26 7.949 17.827 0.804 182 HG23 ILE 26 HG23 ILE 26 7.252 16.289 1.313 183 HD11 ILE 26 HD11 ILE 26 6.021 14.635 -1.709 184 HD12 ILE 26 HD12 ILE 26 7.276 15.829 -1.388 185 HD13 ILE 26 HD13 ILE 26 5.921 16.237 -2.441 186 H CYS 27 H CYS 27 5.061 19.467 3.017 187 HA CYS 27 HA CYS 27 6.015 22.012 1.881 188 HB2 CYS 27 HB2 CYS 27 4.293 23.029 2.898 189 HB3 CYS 27 HB3 CYS 27 3.732 21.492 3.525 190 H CYS 28 H CYS 28 7.912 22.872 2.890 191 HA CYS 28 HA CYS 28 8.993 21.269 5.117 192 HB2 CYS 28 HB2 CYS 28 9.796 21.167 2.385 193 HB3 CYS 28 HB3 CYS 28 11.124 21.907 3.271 194 H GLY 29 H GLY 29 9.212 23.151 6.758 195 HA2 GLY 29 HA2 GLY 29 10.904 25.305 5.735 196 HA3 GLY 29 HA3 GLY 29 9.960 25.334 7.223 197 H ASP 30 H ASP 30 12.238 26.035 7.915 198 HA ASP 30 HA ASP 30 14.282 24.159 8.075 199 HB2 ASP 30 HB2 ASP 30 14.361 26.706 8.425 200 HB3 ASP 30 HB3 ASP 30 13.868 26.357 10.076 201 H GLU 31 H GLU 31 12.252 25.296 10.619 202 HA GLU 31 HA GLU 31 12.750 22.821 12.107 203 HB2 GLU 31 HB2 GLU 31 11.499 24.808 13.769 204 HB3 GLU 31 HB3 GLU 31 13.013 23.948 13.994 205 HG2 GLU 31 HG2 GLU 31 13.679 25.773 12.081 206 HG3 GLU 31 HG3 GLU 31 12.506 26.661 13.047 207 H LEU 32 H LEU 32 10.709 23.669 10.058 208 HA LEU 32 HA LEU 32 8.351 22.706 11.379 209 HB2 LEU 32 HB2 LEU 32 9.106 24.803 9.500 210 HB3 LEU 32 HB3 LEU 32 7.826 23.800 8.913 211 HG LEU 32 HG LEU 32 7.810 25.315 11.512 212 HD11 LEU 32 HD11 LEU 32 7.596 26.940 9.882 213 HD12 LEU 32 HD12 LEU 32 5.923 26.541 10.276 214 HD13 LEU 32 HD13 LEU 32 6.665 25.889 8.815 215 HD21 LEU 32 HD21 LEU 32 6.128 23.206 10.483 216 HD22 LEU 32 HD22 LEU 32 5.217 24.646 10.902 217 HD23 LEU 32 HD23 LEU 32 6.239 23.862 12.104 218 H GLY 33 H GLY 33 11.054 22.002 9.593 219 HA2 GLY 33 HA2 GLY 33 11.679 20.403 8.121 220 HA3 GLY 33 HA3 GLY 33 10.612 19.463 9.102 221 H CYS 34 H CYS 34 9.365 18.180 7.776 222 HA CYS 34 HA CYS 34 8.156 19.556 5.501 223 HB2 CYS 34 HB2 CYS 34 9.943 17.401 5.393 224 HB3 CYS 34 HB3 CYS 34 8.384 16.855 4.853 225 H PHE 35 H PHE 35 5.981 19.664 5.979 226 HA PHE 35 HA PHE 35 4.803 17.367 7.281 227 HB2 PHE 35 HB2 PHE 35 3.538 19.880 6.104 228 HB3 PHE 35 HB3 PHE 35 2.739 18.695 7.139 229 HD1 PHE 35 HD1 PHE 35 3.520 18.435 9.480 230 HD2 PHE 35 HD2 PHE 35 4.789 21.646 7.045 231 HE1 PHE 35 HE1 PHE 35 4.249 19.636 11.482 232 HE2 PHE 35 HE2 PHE 35 5.541 22.866 9.027 233 HZ PHE 35 HZ PHE 35 5.269 21.854 11.262 234 H VAL 36 H VAL 36 4.775 15.688 5.855 235 HA VAL 36 HA VAL 36 4.365 16.396 3.071 236 HB VAL 36 HB VAL 36 5.100 13.642 4.009 237 HG11 VAL 36 HG11 VAL 36 6.035 13.454 1.787 238 HG12 VAL 36 HG12 VAL 36 5.631 15.147 1.450 239 HG13 VAL 36 HG13 VAL 36 4.344 13.948 1.690 240 HG21 VAL 36 HG21 VAL 36 6.704 15.396 4.916 241 HG22 VAL 36 HG22 VAL 36 7.088 15.778 3.243 242 HG23 VAL 36 HG23 VAL 36 7.438 14.173 3.877 243 H GLY 37 H GLY 37 2.347 16.935 3.200 244 HA2 GLY 37 HA2 GLY 37 0.197 16.217 2.376 245 HA3 GLY 37 HA3 GLY 37 0.483 14.636 3.066 246 H THR 38 H THR 38 -0.616 17.878 3.674 247 HA THR 38 HA THR 38 -2.583 17.144 5.518 248 HB THR 38 HB THR 38 -1.497 17.049 7.480 249 HG1 THR 38 HG1 THR 38 -0.611 19.148 8.236 250 HG21 THR 38 HG21 THR 38 0.618 16.476 6.717 251 HG22 THR 38 HG22 THR 38 0.908 17.883 7.733 252 HG23 THR 38 HG23 THR 38 0.887 18.053 5.981 253 H ALA 39 H ALA 39 -3.700 19.310 6.463 254 HA ALA 39 HA ALA 39 -4.202 20.963 4.453 255 HB1 ALA 39 HB1 ALA 39 -5.585 20.793 6.388 256 HB2 ALA 39 HB2 ALA 39 -5.105 22.478 6.192 257 HB3 ALA 39 HB3 ALA 39 -4.318 21.474 7.410 258 H GLU 40 H GLU 40 -1.381 21.287 6.537 259 HA GLU 40 HA GLU 40 -1.090 24.095 6.038 260 HB2 GLU 40 HB2 GLU 40 1.027 23.994 7.052 261 HB3 GLU 40 HB3 GLU 40 0.039 22.842 7.936 262 HG2 GLU 40 HG2 GLU 40 1.911 22.079 5.715 263 HG3 GLU 40 HG3 GLU 40 2.350 22.080 7.424 264 H ALA 41 H ALA 41 -0.649 21.272 4.151 265 HA ALA 41 HA ALA 41 1.296 22.423 2.445 266 HB1 ALA 41 HB1 ALA 41 0.859 19.907 3.138 267 HB2 ALA 41 HB2 ALA 41 1.480 20.327 1.542 268 HB3 ALA 41 HB3 ALA 41 -0.234 19.965 1.754 269 H LEU 42 H LEU 42 -2.299 22.257 2.602 270 HA LEU 42 HA LEU 42 -2.990 22.309 0.002 271 HB2 LEU 42 HB2 LEU 42 -4.004 23.595 2.475 272 HB3 LEU 42 HB3 LEU 42 -4.673 24.158 0.954 273 HG LEU 42 HG LEU 42 -4.622 21.239 1.171 274 HD11 LEU 42 HD11 LEU 42 -5.066 22.182 3.568 275 HD12 LEU 42 HD12 LEU 42 -6.068 20.886 2.917 276 HD13 LEU 42 HD13 LEU 42 -6.658 22.547 2.911 277 HD21 LEU 42 HD21 LEU 42 -6.051 23.244 -0.171 278 HD22 LEU 42 HD22 LEU 42 -7.213 22.434 0.879 279 HD23 LEU 42 HD23 LEU 42 -6.274 21.499 -0.284 280 H ARG 43 H ARG 43 -1.572 25.016 1.809 281 HA ARG 43 HA ARG 43 -1.883 26.979 -0.222 282 HB2 ARG 43 HB2 ARG 43 -1.229 27.288 2.252 283 HB3 ARG 43 HB3 ARG 43 0.398 26.854 1.752 284 HG2 ARG 43 HG2 ARG 43 0.117 29.261 1.900 285 HG3 ARG 43 HG3 ARG 43 0.461 28.758 0.244 286 HD2 ARG 43 HD2 ARG 43 -1.276 30.388 0.159 287 HD3 ARG 43 HD3 ARG 43 -2.000 28.824 -0.196 288 HE ARG 43 HE ARG 43 -2.962 28.823 1.995 289 HH11 ARG 43 HH11 ARG 43 -1.466 31.851 1.084 290 HH12 ARG 43 HH12 ARG 43 -2.358 32.777 2.241 291 HH21 ARG 43 HH21 ARG 43 -4.128 30.050 3.514 292 HH22 ARG 43 HH22 ARG 43 -3.865 31.759 3.618 293 H CYS 44 H CYS 44 -0.218 24.281 -0.051 294 HA CYS 44 HA CYS 44 2.168 25.009 -1.611 295 HB2 CYS 44 HB2 CYS 44 1.216 22.241 -0.877 296 HB3 CYS 44 HB3 CYS 44 2.618 22.554 -1.882 297 H GLN 45 H GLN 45 -1.028 24.548 -2.323 298 HA GLN 45 HA GLN 45 -0.781 23.364 -4.933 299 HB2 GLN 45 HB2 GLN 45 -3.022 24.772 -3.503 300 HB3 GLN 45 HB3 GLN 45 -3.168 24.274 -5.183 301 HG2 GLN 45 HG2 GLN 45 -2.934 21.988 -4.618 302 HG3 GLN 45 HG3 GLN 45 -2.459 22.380 -2.966 303 HE21 GLN 45 HE21 GLN 45 -4.812 20.991 -4.500 304 HE22 GLN 45 HE22 GLN 45 -6.194 21.533 -3.617 305 H GLU 46 H GLU 46 0.021 26.419 -3.797 306 HA GLU 46 HA GLU 46 -0.814 27.837 -6.180 307 HB2 GLU 46 HB2 GLU 46 0.000 28.543 -3.522 308 HB3 GLU 46 HB3 GLU 46 1.001 29.410 -4.679 309 HG2 GLU 46 HG2 GLU 46 -0.724 30.877 -4.455 310 HG3 GLU 46 HG3 GLU 46 -1.311 29.919 -5.811 311 H GLU 47 H GLU 47 1.534 25.670 -5.699 312 HA GLU 47 HA GLU 47 3.676 27.091 -7.034 313 HB2 GLU 47 HB2 GLU 47 4.884 24.964 -6.934 314 HB3 GLU 47 HB3 GLU 47 4.245 25.419 -5.364 315 HG2 GLU 47 HG2 GLU 47 2.391 23.859 -5.670 316 HG3 GLU 47 HG3 GLU 47 3.049 23.393 -7.233 317 H ASN 48 H ASN 48 0.786 25.964 -8.004 318 HA ASN 48 HA ASN 48 1.539 24.537 -10.356 319 HB2 ASN 48 HB2 ASN 48 -0.975 25.649 -9.233 320 HB3 ASN 48 HB3 ASN 48 -0.920 25.435 -10.980 321 HD21 ASN 48 HD21 ASN 48 -1.533 23.969 -8.049 322 HD22 ASN 48 HD22 ASN 48 -1.565 22.324 -8.576 323 H TYR 49 H TYR 49 1.178 27.888 -9.451 324 HA TYR 49 HA TYR 49 1.797 28.648 -12.260 325 HB2 TYR 49 HB2 TYR 49 0.533 30.607 -12.073 326 HB3 TYR 49 HB3 TYR 49 -0.454 29.405 -11.253 327 HD1 TYR 49 HD1 TYR 49 -0.097 29.264 -8.652 328 HD2 TYR 49 HD2 TYR 49 0.912 32.642 -11.029 329 HE1 TYR 49 HE1 TYR 49 -0.194 30.694 -6.662 330 HE2 TYR 49 HE2 TYR 49 0.808 34.081 -9.037 331 HH TYR 49 HH TYR 49 -0.403 33.973 -6.753 332 H LEU 50 H LEU 50 3.577 27.921 -10.004 333 HA LEU 50 HA LEU 50 5.162 30.398 -9.939 334 HB2 LEU 50 HB2 LEU 50 4.013 29.668 -7.780 335 HB3 LEU 50 HB3 LEU 50 5.147 28.332 -7.763 336 HG LEU 50 HG LEU 50 6.335 31.008 -8.074 337 HD11 LEU 50 HD11 LEU 50 4.650 31.594 -6.499 338 HD12 LEU 50 HD12 LEU 50 6.158 31.412 -5.619 339 HD13 LEU 50 HD13 LEU 50 4.948 30.139 -5.551 340 HD21 LEU 50 HD21 LEU 50 8.093 29.723 -7.622 341 HD22 LEU 50 HD22 LEU 50 7.056 28.360 -7.204 342 HD23 LEU 50 HD23 LEU 50 7.484 29.555 -5.980 343 HA PRO 51 HA PRO 51 8.338 27.746 -11.575 344 HB2 PRO 51 HB2 PRO 51 10.385 29.462 -11.593 345 HB3 PRO 51 HB3 PRO 51 8.987 29.683 -12.652 346 HG2 PRO 51 HG2 PRO 51 9.688 31.087 -10.119 347 HG3 PRO 51 HG3 PRO 51 8.927 31.727 -11.585 348 HD2 PRO 51 HD2 PRO 51 7.598 30.979 -9.250 349 HD3 PRO 51 HD3 PRO 51 6.844 31.218 -10.837 350 H SER 52 H SER 52 7.864 27.071 -8.948 351 HA SER 52 HA SER 52 8.860 25.874 -7.293 352 HB2 SER 52 HB2 SER 52 11.281 26.472 -8.953 353 HB3 SER 52 HB3 SER 52 11.483 25.812 -7.333 354 HG SER 52 HG SER 52 9.606 24.383 -8.512 355 HA PRO 53 HA PRO 53 9.501 28.855 -4.147 356 HB2 PRO 53 HB2 PRO 53 10.777 27.375 -2.253 357 HB3 PRO 53 HB3 PRO 53 9.054 27.216 -2.609 358 HG2 PRO 53 HG2 PRO 53 11.348 25.555 -3.593 359 HG3 PRO 53 HG3 PRO 53 9.780 25.022 -2.959 360 HD2 PRO 53 HD2 PRO 53 10.253 25.103 -5.592 361 HD3 PRO 53 HD3 PRO 53 8.665 25.541 -4.931 362 H CYS 54 H CYS 54 11.105 29.964 -2.842 363 HA CYS 54 HA CYS 54 13.387 30.661 -4.295 364 HB2 CYS 54 HB2 CYS 54 13.999 32.009 -2.306 365 HB3 CYS 54 HB3 CYS 54 12.343 32.243 -2.824 366 H GLN 55 H GLN 55 15.150 29.628 -4.631 367 HA GLN 55 HA GLN 55 16.780 28.001 -4.485 368 HB2 GLN 55 HB2 GLN 55 18.309 28.315 -2.664 369 HB3 GLN 55 HB3 GLN 55 17.676 29.877 -3.149 370 HG2 GLN 55 HG2 GLN 55 16.136 29.847 -1.259 371 HG3 GLN 55 HG3 GLN 55 16.760 28.272 -0.779 372 HE21 GLN 55 HE21 GLN 55 19.295 28.319 -0.726 373 HE22 GLN 55 HE22 GLN 55 19.961 29.616 0.201 374 H SER 56 H SER 56 17.876 26.425 -2.502 375 HA SER 56 HA SER 56 15.917 24.989 -0.987 376 HB2 SER 56 HB2 SER 56 16.499 24.186 -3.777 377 HB3 SER 56 HB3 SER 56 16.673 22.886 -2.602 378 HG SER 56 HG SER 56 14.427 24.155 -2.047 379 H GLY 57 H GLY 57 16.944 22.854 -0.314 380 HA2 GLY 57 HA2 GLY 57 19.602 23.382 0.619 381 HA3 GLY 57 HA3 GLY 57 18.631 21.974 1.046 382 H GLN 58 H GLN 58 21.500 22.246 0.132 383 HA GLN 58 HA GLN 58 21.332 20.641 -2.320 384 HB2 GLN 58 HB2 GLN 58 23.620 22.115 -1.024 385 HB3 GLN 58 HB3 GLN 58 23.868 20.957 -2.322 386 HG2 GLN 58 HG2 GLN 58 23.020 22.341 -3.906 387 HG3 GLN 58 HG3 GLN 58 21.901 23.121 -2.785 388 HE21 GLN 58 HE21 GLN 58 25.343 22.831 -3.548 389 HE22 GLN 58 HE22 GLN 58 25.764 24.440 -3.084 390 H LYS 59 H LYS 59 20.472 18.966 -0.956 391 HA LYS 59 HA LYS 59 22.670 17.203 -0.064 392 HB2 LYS 59 HB2 LYS 59 21.804 18.225 2.018 393 HB3 LYS 59 HB3 LYS 59 20.174 17.775 1.564 394 HG2 LYS 59 HG2 LYS 59 21.216 16.321 3.295 395 HG3 LYS 59 HG3 LYS 59 20.642 15.455 1.868 396 HD2 LYS 59 HD2 LYS 59 22.812 14.611 2.493 397 HD3 LYS 59 HD3 LYS 59 22.952 15.501 0.974 398 HE2 LYS 59 HE2 LYS 59 24.015 17.308 1.986 399 HE3 LYS 59 HE3 LYS 59 23.451 16.860 3.596 400 HZ1 LYS 59 HZ1 LYS 59 25.901 16.317 2.561 401 HZ2 LYS 59 HZ2 LYS 59 25.091 14.845 2.381 402 HZ3 LYS 59 HZ3 LYS 59 25.219 15.558 3.905 403 HA PRO 60 HA PRO 60 19.192 15.654 -2.743 404 HB2 PRO 60 HB2 PRO 60 20.641 15.035 -4.953 405 HB3 PRO 60 HB3 PRO 60 19.910 16.621 -4.682 406 HG2 PRO 60 HG2 PRO 60 22.733 15.735 -4.224 407 HG3 PRO 60 HG3 PRO 60 22.137 17.242 -4.944 408 HD2 PRO 60 HD2 PRO 60 22.972 17.097 -2.375 409 HD3 PRO 60 HD3 PRO 60 21.677 18.192 -2.889 410 H CYS 61 H CYS 61 19.182 14.065 -1.212 411 HA CYS 61 HA CYS 61 20.688 11.605 -1.776 412 HB2 CYS 61 HB2 CYS 61 20.421 11.006 0.446 413 HB3 CYS 61 HB3 CYS 61 20.433 12.756 0.623 414 H GLY 62 H GLY 62 19.011 9.633 -1.067 415 HA2 GLY 62 HA2 GLY 62 17.054 8.524 -1.626 416 HA3 GLY 62 HA3 GLY 62 16.266 10.094 -1.608 417 H SER 63 H SER 63 15.052 9.059 -3.359 418 HA SER 63 HA SER 63 16.345 8.595 -5.867 419 HB2 SER 63 HB2 SER 63 13.761 8.151 -4.678 420 HB3 SER 63 HB3 SER 63 13.557 8.919 -6.250 421 HG SER 63 HG SER 63 13.707 6.533 -6.176 422 H GLY 64 H GLY 64 17.170 11.072 -5.261 423 HA2 GLY 64 HA2 GLY 64 17.421 12.898 -6.765 424 HA3 GLY 64 HA3 GLY 64 15.738 12.719 -7.214 425 H GLY 65 H GLY 65 16.020 12.634 -3.779 426 HA2 GLY 65 HA2 GLY 65 15.102 15.409 -3.801 427 HA3 GLY 65 HA3 GLY 65 14.786 14.235 -2.553 428 H ARG 66 H ARG 66 15.886 17.011 -2.715 429 HA ARG 66 HA ARG 66 18.402 16.631 -1.310 430 HB2 ARG 66 HB2 ARG 66 18.601 19.161 -1.579 431 HB3 ARG 66 HB3 ARG 66 18.813 18.172 -3.013 432 HG2 ARG 66 HG2 ARG 66 16.100 19.244 -2.401 433 HG3 ARG 66 HG3 ARG 66 17.326 20.343 -3.032 434 HD2 ARG 66 HD2 ARG 66 16.340 17.804 -4.324 435 HD3 ARG 66 HD3 ARG 66 16.013 19.452 -4.848 436 HE ARG 66 HE ARG 66 18.796 18.568 -4.768 437 HH11 ARG 66 HH11 ARG 66 15.968 19.349 -6.667 438 HH12 ARG 66 HH12 ARG 66 16.851 19.478 -8.150 439 HH21 ARG 66 HH21 ARG 66 19.949 18.733 -6.719 440 HH22 ARG 66 HH22 ARG 66 19.107 19.127 -8.181 441 H CYS 67 H CYS 67 18.786 17.859 0.711 442 HA CYS 67 HA CYS 67 16.757 17.504 2.526 443 HB2 CYS 67 HB2 CYS 67 19.303 17.813 2.918 444 HB3 CYS 67 HB3 CYS 67 18.945 19.533 2.935 445 H ALA 68 H ALA 68 14.865 18.485 2.465 446 HA ALA 68 HA ALA 68 14.778 21.284 1.564 447 HB1 ALA 68 HB1 ALA 68 12.609 19.251 2.056 448 HB2 ALA 68 HB2 ALA 68 13.104 19.967 0.525 449 HB3 ALA 68 HB3 ALA 68 12.272 20.952 1.727 450 H ALA 69 H ALA 69 14.891 19.345 4.219 451 HA ALA 69 HA ALA 69 14.931 21.512 6.123 452 HB1 ALA 69 HB1 ALA 69 12.861 19.501 6.807 453 HB2 ALA 69 HB2 ALA 69 12.439 20.749 5.635 454 HB3 ALA 69 HB3 ALA 69 12.991 21.202 7.244 455 H ALA 70 H ALA 70 15.646 20.713 8.229 456 HA ALA 70 HA ALA 70 17.705 19.236 8.615 457 HB1 ALA 70 HB1 ALA 70 15.846 20.128 10.322 458 HB2 ALA 70 HB2 ALA 70 17.250 19.176 10.804 459 HB3 ALA 70 HB3 ALA 70 15.684 18.392 10.571 460 H GLY 71 H GLY 71 16.557 16.889 10.293 461 HA2 GLY 71 HA2 GLY 71 17.384 14.839 8.550 462 HA3 GLY 71 HA3 GLY 71 16.501 14.577 10.047 463 H ILE 72 H ILE 72 15.930 15.830 6.895 464 HA ILE 72 HA ILE 72 14.126 13.928 6.159 465 HB ILE 72 HB ILE 72 12.100 15.229 5.655 466 HG12 ILE 72 HG12 ILE 72 12.054 17.081 7.699 467 HG13 ILE 72 HG13 ILE 72 13.643 17.297 6.953 468 HG21 ILE 72 HG21 ILE 72 11.196 14.208 7.393 469 HG22 ILE 72 HG22 ILE 72 12.044 15.242 8.543 470 HG23 ILE 72 HG23 ILE 72 12.834 13.808 7.897 471 HD11 ILE 72 HD11 ILE 72 11.646 16.843 4.991 472 HD12 ILE 72 HD12 ILE 72 12.776 18.203 5.162 473 HD13 ILE 72 HD13 ILE 72 11.227 18.234 6.013 474 H CYS 73 H CYS 73 15.328 13.671 4.463 475 HA CYS 73 HA CYS 73 15.980 15.910 2.728 476 HB2 CYS 73 HB2 CYS 73 17.860 14.586 3.098 477 HB3 CYS 73 HB3 CYS 73 16.923 13.102 3.093 478 H CYS 74 H CYS 74 14.132 16.411 1.699 479 HA CYS 74 HA CYS 74 12.543 14.317 0.518 480 HB2 CYS 74 HB2 CYS 74 12.013 17.269 0.481 481 HB3 CYS 74 HB3 CYS 74 10.857 15.970 0.217 482 H SER 75 H SER 75 11.599 14.526 -1.541 483 HA SER 75 HA SER 75 13.347 15.663 -3.623 484 HB2 SER 75 HB2 SER 75 12.743 13.645 -4.997 485 HB3 SER 75 HB3 SER 75 13.655 13.223 -3.558 486 HG SER 75 HG SER 75 11.296 12.320 -4.279 487 HA PRO 76 HA PRO 76 9.550 17.281 -5.285 488 HB2 PRO 76 HB2 PRO 76 9.462 16.719 -7.915 489 HB3 PRO 76 HB3 PRO 76 10.679 17.808 -7.239 490 HG2 PRO 76 HG2 PRO 76 10.929 14.924 -7.997 491 HG3 PRO 76 HG3 PRO 76 12.058 16.259 -8.293 492 HD2 PRO 76 HD2 PRO 76 12.353 14.457 -6.264 493 HD3 PRO 76 HD3 PRO 76 12.965 16.120 -6.189 494 H ASP 77 H ASP 77 9.450 14.474 -4.259 495 HA ASP 77 HA ASP 77 6.806 13.784 -5.275 496 HB2 ASP 77 HB2 ASP 77 8.823 12.453 -6.378 497 HB3 ASP 77 HB3 ASP 77 8.724 11.534 -4.880 498 H GLY 78 H GLY 78 9.399 13.133 -2.929 499 HA2 GLY 78 HA2 GLY 78 7.397 13.011 -0.824 500 HA3 GLY 78 HA3 GLY 78 8.343 11.549 -1.014 501 H CYS 79 H CYS 79 9.427 11.541 0.816 502 HA CYS 79 HA CYS 79 11.527 13.506 1.215 503 HB2 CYS 79 HB2 CYS 79 9.389 12.889 3.246 504 HB3 CYS 79 HB3 CYS 79 10.962 13.522 3.712 505 H HIS 80 H HIS 80 13.338 12.693 2.343 506 HA HIS 80 HA HIS 80 13.106 9.848 3.124 507 HB2 HIS 80 HB2 HIS 80 14.981 11.088 1.149 508 HB3 HIS 80 HB3 HIS 80 15.550 9.742 2.128 509 HD1 HIS 80 HD1 HIS 80 13.769 10.490 -0.938 510 HD2 HIS 80 HD2 HIS 80 13.869 7.343 1.774 511 HE1 HIS 80 HE1 HIS 80 12.791 8.519 -2.157 512 HE2 HIS 80 HE2 HIS 80 12.947 6.606 -0.526 513 H GLU 81 H GLU 81 14.098 9.332 4.979 514 HA GLU 81 HA GLU 81 15.089 11.324 6.690 515 HB2 GLU 81 HB2 GLU 81 15.082 8.337 6.707 516 HB3 GLU 81 HB3 GLU 81 16.167 9.162 7.817 517 HG2 GLU 81 HG2 GLU 81 14.041 10.497 8.479 518 HG3 GLU 81 HG3 GLU 81 13.189 9.136 7.752 519 H ASP 82 H ASP 82 17.105 12.104 7.033 520 HA ASP 82 HA ASP 82 19.351 10.814 5.680 521 HB2 ASP 82 HB2 ASP 82 19.916 12.664 4.373 522 HB3 ASP 82 HB3 ASP 82 18.146 12.643 4.267 523 HA PRO 83 HA PRO 83 21.188 11.801 9.638 524 HB2 PRO 83 HB2 PRO 83 23.745 11.092 8.387 525 HB3 PRO 83 HB3 PRO 83 22.891 10.305 9.716 526 HG2 PRO 83 HG2 PRO 83 23.103 9.178 7.279 527 HG3 PRO 83 HG3 PRO 83 21.676 8.950 8.307 528 HD2 PRO 83 HD2 PRO 83 22.049 10.765 5.955 529 HD3 PRO 83 HD3 PRO 83 20.649 9.768 6.403 530 H ALA 84 H ALA 84 22.522 12.992 6.609 531 HA ALA 84 HA ALA 84 24.328 14.841 7.710 532 HB1 ALA 84 HB1 ALA 84 22.957 15.011 5.039 533 HB2 ALA 84 HB2 ALA 84 24.391 14.041 5.377 534 HB3 ALA 84 HB3 ALA 84 24.462 15.798 5.514 535 H CYS 85 H CYS 85 21.029 14.856 8.026 536 HA CYS 85 HA CYS 85 21.034 17.755 8.489 537 HB2 CYS 85 HB2 CYS 85 18.896 16.156 7.089 538 HB3 CYS 85 HB3 CYS 85 18.614 17.747 7.769 539 H ASP 86 H ASP 86 21.154 15.213 10.258 540 HA ASP 86 HA ASP 86 18.794 15.779 11.852 541 HB2 ASP 86 HB2 ASP 86 20.502 13.344 11.570 542 HB3 ASP 86 HB3 ASP 86 19.529 13.586 13.018 543 HA PRO 87 HA PRO 87 22.488 16.763 14.652 544 HB2 PRO 87 HB2 PRO 87 23.129 19.369 13.662 545 HB3 PRO 87 HB3 PRO 87 24.180 17.954 13.685 546 HG2 PRO 87 HG2 PRO 87 23.196 19.183 11.410 547 HG3 PRO 87 HG3 PRO 87 23.843 17.537 11.490 548 HD2 PRO 87 HD2 PRO 87 21.012 18.466 11.452 549 HD3 PRO 87 HD3 PRO 87 21.745 17.008 10.758 550 H GLU 88 H GLU 88 20.211 16.770 15.158 551 HA GLU 88 HA GLU 88 19.500 18.898 16.805 552 HB2 GLU 88 HB2 GLU 88 17.918 20.233 15.679 553 HB3 GLU 88 HB3 GLU 88 19.270 20.043 14.573 554 HG2 GLU 88 HG2 GLU 88 18.115 18.649 13.161 555 HG3 GLU 88 HG3 GLU 88 16.937 18.210 14.392 556 H ALA 89 H ALA 89 18.415 16.583 14.630 557 HA ALA 89 HA ALA 89 16.070 15.608 15.947 558 HB1 ALA 89 HB1 ALA 89 17.768 14.961 13.541 559 HB2 ALA 89 HB2 ALA 89 16.004 15.181 13.678 560 HB3 ALA 89 HB3 ALA 89 16.739 13.669 14.211 561 H ALA 90 H ALA 90 18.244 15.790 17.621 562 HA ALA 90 HA ALA 90 19.596 13.271 18.045 563 HB1 ALA 90 HB1 ALA 90 20.507 15.639 18.524 564 HB2 ALA 90 HB2 ALA 90 20.870 14.337 19.658 565 HB3 ALA 90 HB3 ALA 90 19.604 15.507 20.031 566 H PHE 91 H PHE 91 19.339 11.865 19.791 567 HA PHE 91 HA PHE 91 16.673 11.370 20.463 568 HB2 PHE 91 HB2 PHE 91 19.153 10.310 21.840 569 HB3 PHE 91 HB3 PHE 91 17.533 9.647 22.000 570 HD1 PHE 91 HD1 PHE 91 16.401 9.000 19.674 571 HD2 PHE 91 HD2 PHE 91 20.588 9.317 20.374 572 HE1 PHE 91 HE1 PHE 91 16.833 7.509 17.763 573 HE2 PHE 91 HE2 PHE 91 21.024 7.832 18.464 574 HZ PHE 91 HZ PHE 91 19.147 6.925 17.156 575 H SER 92 H SER 92 15.375 12.046 21.973 576 HA SER 92 HA SER 92 16.301 12.923 24.561 577 HB2 SER 92 HB2 SER 92 16.439 14.934 22.964 578 HB3 SER 92 HB3 SER 92 14.676 14.887 22.949 579 HG SER 92 HG SER 92 14.637 15.361 25.089 580 H1 ALA 101 H1 ALA 101 -9.057 -4.886 7.253 581 H2 ALA 101 H2 ALA 101 -9.873 -5.824 6.071 582 H3 ALA 101 H3 ALA 101 -8.606 -6.519 6.995 583 HA ALA 101 HA ALA 101 -11.002 -5.422 8.259 584 HB1 ALA 101 HB1 ALA 101 -11.835 -7.815 8.247 585 HB2 ALA 101 HB2 ALA 101 -10.662 -8.109 6.964 586 HB3 ALA 101 HB3 ALA 101 -11.952 -6.928 6.728 587 H VAL 102 H VAL 102 -7.899 -6.200 8.601 588 HA VAL 102 HA VAL 102 -8.098 -6.679 11.383 589 HB VAL 102 HB VAL 102 -7.831 -8.916 9.575 590 HG11 VAL 102 HG11 VAL 102 -5.598 -8.541 11.554 591 HG12 VAL 102 HG12 VAL 102 -5.460 -8.672 9.802 592 HG13 VAL 102 HG13 VAL 102 -5.981 -10.064 10.752 593 HG21 VAL 102 HG21 VAL 102 -7.713 -9.502 12.418 594 HG22 VAL 102 HG22 VAL 102 -8.938 -9.926 11.222 595 HG23 VAL 102 HG23 VAL 102 -8.988 -8.351 12.014 596 H LEU 103 H LEU 103 -6.166 -6.496 12.431 597 HA LEU 103 HA LEU 103 -4.270 -4.662 11.353 598 HB2 LEU 103 HB2 LEU 103 -3.262 -4.757 13.577 599 HB3 LEU 103 HB3 LEU 103 -4.996 -4.525 13.661 600 HG LEU 103 HG LEU 103 -4.355 -7.334 13.734 601 HD11 LEU 103 HD11 LEU 103 -2.263 -6.151 14.743 602 HD12 LEU 103 HD12 LEU 103 -2.980 -7.543 15.554 603 HD13 LEU 103 HD13 LEU 103 -3.315 -5.917 16.131 604 HD21 LEU 103 HD21 LEU 103 -6.469 -6.267 14.433 605 HD22 LEU 103 HD22 LEU 103 -5.618 -5.529 15.787 606 HD23 LEU 103 HD23 LEU 103 -5.761 -7.285 15.687 607 H ASP 104 H ASP 104 -2.700 -5.226 10.062 608 HA ASP 104 HA ASP 104 -1.327 -7.762 10.194 609 HB2 ASP 104 HB2 ASP 104 -1.396 -5.445 8.359 610 HB3 ASP 104 HB3 ASP 104 0.159 -6.267 8.474 611 H LEU 105 H LEU 105 -0.782 -7.532 12.328 612 HA LEU 105 HA LEU 105 1.777 -6.697 12.899 613 HB2 LEU 105 HB2 LEU 105 -0.018 -4.808 13.290 614 HB3 LEU 105 HB3 LEU 105 -0.235 -5.688 14.764 615 HG LEU 105 HG LEU 105 1.362 -3.716 14.888 616 HD11 LEU 105 HD11 LEU 105 1.573 -6.077 16.213 617 HD12 LEU 105 HD12 LEU 105 2.526 -4.640 16.548 618 HD13 LEU 105 HD13 LEU 105 3.179 -5.913 15.520 619 HD21 LEU 105 HD21 LEU 105 3.702 -4.914 13.880 620 HD22 LEU 105 HD22 LEU 105 2.878 -3.472 13.291 621 HD23 LEU 105 HD23 LEU 105 2.477 -5.049 12.619 622 H ASP 106 H ASP 106 0.457 -6.995 15.699 623 HA ASP 106 HA ASP 106 -0.381 -9.728 15.902 624 HB2 ASP 106 HB2 ASP 106 2.146 -9.529 15.510 625 HB3 ASP 106 HB3 ASP 106 2.234 -8.995 17.196 626 H VAL 107 H VAL 107 0.977 -6.932 17.416 627 HA VAL 107 HA VAL 107 -1.057 -6.783 19.461 628 HB VAL 107 HB VAL 107 0.653 -5.418 20.697 629 HG11 VAL 107 HG11 VAL 107 0.485 -8.266 20.458 630 HG12 VAL 107 HG12 VAL 107 0.647 -7.277 21.912 631 HG13 VAL 107 HG13 VAL 107 2.085 -7.775 21.014 632 HG21 VAL 107 HG21 VAL 107 3.006 -6.667 19.653 633 HG22 VAL 107 HG22 VAL 107 2.647 -4.952 19.837 634 HG23 VAL 107 HG23 VAL 107 2.171 -5.797 18.367 635 H ARG 108 H ARG 108 -2.200 -4.862 19.037 636 HA ARG 108 HA ARG 108 -1.425 -3.351 16.794 637 HB2 ARG 108 HB2 ARG 108 -3.524 -2.841 18.917 638 HB3 ARG 108 HB3 ARG 108 -3.365 -1.957 17.410 639 HG2 ARG 108 HG2 ARG 108 -5.163 -3.444 17.150 640 HG3 ARG 108 HG3 ARG 108 -3.825 -4.107 16.213 641 HD2 ARG 108 HD2 ARG 108 -4.950 -5.875 17.430 642 HD3 ARG 108 HD3 ARG 108 -3.331 -5.659 18.057 643 HE ARG 108 HE ARG 108 -4.233 -4.791 20.041 644 HH11 ARG 108 HH11 ARG 108 -6.726 -5.582 17.726 645 HH12 ARG 108 HH12 ARG 108 -7.980 -5.657 18.915 646 HH21 ARG 108 HH21 ARG 108 -5.890 -4.903 21.609 647 HH22 ARG 108 HH22 ARG 108 -7.509 -5.272 21.114 648 H THR 109 H THR 109 0.299 -1.972 17.085 649 HA THR 109 HA THR 109 0.073 -0.606 19.677 650 HB THR 109 HB THR 109 2.544 0.078 18.903 651 HG1 THR 109 HG1 THR 109 3.100 -2.361 18.103 652 HG21 THR 109 HG21 THR 109 3.087 -1.027 20.743 653 HG22 THR 109 HG22 THR 109 2.887 -2.563 19.906 654 HG23 THR 109 HG23 THR 109 1.514 -1.817 20.720 655 H CYS 110 H CYS 110 -1.378 0.739 19.015 656 HA CYS 110 HA CYS 110 -1.093 1.948 16.399 657 HB2 CYS 110 HB2 CYS 110 -3.101 2.336 18.613 658 HB3 CYS 110 HB3 CYS 110 -3.111 3.355 17.173 659 H LEU 111 H LEU 111 1.152 2.750 17.055 660 HA LEU 111 HA LEU 111 1.946 4.597 18.785 661 HB2 LEU 111 HB2 LEU 111 2.526 4.385 15.878 662 HB3 LEU 111 HB3 LEU 111 3.195 5.718 16.799 663 HG LEU 111 HG LEU 111 3.937 3.752 18.417 664 HD11 LEU 111 HD11 LEU 111 2.824 2.333 16.315 665 HD12 LEU 111 HD12 LEU 111 3.854 1.701 17.591 666 HD13 LEU 111 HD13 LEU 111 4.562 2.211 16.059 667 HD21 LEU 111 HD21 LEU 111 5.361 5.432 17.236 668 HD22 LEU 111 HD22 LEU 111 5.431 4.324 15.866 669 HD23 LEU 111 HD23 LEU 111 6.103 3.844 17.425 670 HA PRO 112 HA PRO 112 -0.537 8.261 18.163 671 HB2 PRO 112 HB2 PRO 112 0.220 9.577 20.327 672 HB3 PRO 112 HB3 PRO 112 -0.623 8.031 20.487 673 HG2 PRO 112 HG2 PRO 112 2.278 8.646 20.798 674 HG3 PRO 112 HG3 PRO 112 1.270 7.512 21.709 675 HD2 PRO 112 HD2 PRO 112 2.969 6.894 19.538 676 HD3 PRO 112 HD3 PRO 112 1.756 5.825 20.270 677 H CYS 113 H CYS 113 -0.166 9.809 16.753 678 HA CYS 113 HA CYS 113 2.218 11.445 16.928 679 HB2 CYS 113 HB2 CYS 113 2.993 10.983 14.866 680 HB3 CYS 113 HB3 CYS 113 2.058 9.509 15.026 681 H GLY 114 H GLY 114 1.911 13.221 15.090 682 HA2 GLY 114 HA2 GLY 114 0.745 15.061 14.344 683 HA3 GLY 114 HA3 GLY 114 -0.754 14.224 14.747 684 HA PRO 115 HA PRO 115 0.089 17.580 17.955 685 HB2 PRO 115 HB2 PRO 115 -2.203 18.894 17.695 686 HB3 PRO 115 HB3 PRO 115 -0.911 19.172 16.497 687 HG2 PRO 115 HG2 PRO 115 -3.010 17.071 16.450 688 HG3 PRO 115 HG3 PRO 115 -2.917 18.440 15.283 689 HD2 PRO 115 HD2 PRO 115 -1.767 16.219 14.548 690 HD3 PRO 115 HD3 PRO 115 -0.703 17.656 14.566 691 H GLY 116 H GLY 116 -0.309 16.592 19.742 692 HA2 GLY 116 HA2 GLY 116 -1.414 15.800 21.593 693 HA3 GLY 116 HA3 GLY 116 -2.888 15.975 20.674 694 H GLY 117 H GLY 117 -0.666 14.249 18.919 695 HA2 GLY 117 HA2 GLY 117 -0.335 12.079 18.570 696 HA3 GLY 117 HA3 GLY 117 -1.015 11.860 20.139 697 H LYS 118 H LYS 118 -2.728 13.404 17.560 698 HA LYS 118 HA LYS 118 -4.749 11.314 17.608 699 HB2 LYS 118 HB2 LYS 118 -5.343 13.469 15.783 700 HB3 LYS 118 HB3 LYS 118 -6.251 12.904 17.174 701 HG2 LYS 118 HG2 LYS 118 -4.141 14.303 18.287 702 HG3 LYS 118 HG3 LYS 118 -4.571 15.243 16.859 703 HD2 LYS 118 HD2 LYS 118 -6.876 14.331 18.409 704 HD3 LYS 118 HD3 LYS 118 -5.793 15.394 19.307 705 HE2 LYS 118 HE2 LYS 118 -7.160 15.961 16.683 706 HE3 LYS 118 HE3 LYS 118 -7.448 16.747 18.234 707 HZ1 LYS 118 HZ1 LYS 118 -6.094 18.258 17.216 708 HZ2 LYS 118 HZ2 LYS 118 -5.213 17.092 16.366 709 HZ3 LYS 118 HZ3 LYS 118 -4.929 17.327 18.016 710 H GLY 119 H GLY 119 -1.984 11.321 16.147 711 HA2 GLY 119 HA2 GLY 119 -3.016 10.494 13.504 712 HA3 GLY 119 HA3 GLY 119 -1.398 11.142 13.763 713 H ARG 120 H ARG 120 -0.190 8.864 13.017 714 HA ARG 120 HA ARG 120 -0.257 7.203 15.244 715 HB2 ARG 120 HB2 ARG 120 -1.686 6.437 12.878 716 HB3 ARG 120 HB3 ARG 120 -0.157 5.572 12.862 717 HG2 ARG 120 HG2 ARG 120 -0.825 4.168 14.453 718 HG3 ARG 120 HG3 ARG 120 -1.429 5.479 15.466 719 HD2 ARG 120 HD2 ARG 120 -3.267 4.051 14.911 720 HD3 ARG 120 HD3 ARG 120 -3.460 5.570 14.037 721 HE ARG 120 HE ARG 120 -2.114 3.543 12.515 722 HH11 ARG 120 HH11 ARG 120 -5.225 4.802 13.467 723 HH12 ARG 120 HH12 ARG 120 -6.049 4.166 12.082 724 HH21 ARG 120 HH21 ARG 120 -3.191 2.707 10.691 725 HH22 ARG 120 HH22 ARG 120 -4.893 2.975 10.504 726 H CYS 121 H CYS 121 1.973 6.035 15.042 727 HA CYS 121 HA CYS 121 3.696 7.652 13.268 728 HB2 CYS 121 HB2 CYS 121 4.214 6.409 15.945 729 HB3 CYS 121 HB3 CYS 121 5.553 6.731 14.864 730 H PHE 122 H PHE 122 5.411 6.729 12.115 731 HA PHE 122 HA PHE 122 5.302 3.789 11.801 732 HB2 PHE 122 HB2 PHE 122 5.471 5.875 9.611 733 HB3 PHE 122 HB3 PHE 122 5.724 4.149 9.357 734 HD1 PHE 122 HD1 PHE 122 3.237 6.626 10.541 735 HD2 PHE 122 HD2 PHE 122 3.917 2.726 8.980 736 HE1 PHE 122 HE1 PHE 122 0.812 6.310 10.282 737 HE2 PHE 122 HE2 PHE 122 1.492 2.407 8.712 738 HZ PHE 122 HZ PHE 122 -0.065 4.199 9.366 739 H GLY 123 H GLY 123 7.234 6.687 10.991 740 HA2 GLY 123 HA2 GLY 123 9.656 5.071 11.506 741 HA3 GLY 123 HA3 GLY 123 9.581 6.324 10.276 742 HA PRO 124 HA PRO 124 11.314 8.107 14.246 743 HB2 PRO 124 HB2 PRO 124 13.425 9.154 12.507 744 HB3 PRO 124 HB3 PRO 124 13.561 8.193 13.980 745 HG2 PRO 124 HG2 PRO 124 14.137 7.175 11.553 746 HG3 PRO 124 HG3 PRO 124 13.435 6.191 12.849 747 HD2 PRO 124 HD2 PRO 124 12.092 7.432 10.474 748 HD3 PRO 124 HD3 PRO 124 11.862 5.817 11.182 749 H SER 125 H SER 125 11.890 9.798 11.133 750 HA SER 125 HA SER 125 10.752 12.222 12.325 751 HB2 SER 125 HB2 SER 125 12.771 11.685 10.247 752 HB3 SER 125 HB3 SER 125 11.661 13.004 9.826 753 HG SER 125 HG SER 125 12.256 14.044 11.721 754 H ILE 126 H ILE 126 9.106 9.908 11.350 755 HA ILE 126 HA ILE 126 7.436 11.471 9.551 756 HB ILE 126 HB ILE 126 7.937 8.558 9.027 757 HG12 ILE 126 HG12 ILE 126 9.122 10.662 7.300 758 HG13 ILE 126 HG13 ILE 126 9.947 10.310 8.801 759 HG21 ILE 126 HG21 ILE 126 5.999 10.293 8.168 760 HG22 ILE 126 HG22 ILE 126 6.465 8.789 7.374 761 HG23 ILE 126 HG23 ILE 126 7.169 10.318 6.852 762 HD11 ILE 126 HD11 ILE 126 10.869 8.501 7.912 763 HD12 ILE 126 HD12 ILE 126 10.161 8.961 6.364 764 HD13 ILE 126 HD13 ILE 126 9.289 7.875 7.445 765 H CYS 127 H CYS 127 5.482 11.618 10.269 766 HA CYS 127 HA CYS 127 4.260 9.388 11.753 767 HB2 CYS 127 HB2 CYS 127 3.930 10.791 13.472 768 HB3 CYS 127 HB3 CYS 127 4.703 12.088 12.583 769 H CYS 128 H CYS 128 2.141 8.806 11.024 770 HA CYS 128 HA CYS 128 1.065 10.422 8.792 771 HB2 CYS 128 HB2 CYS 128 2.409 7.894 8.634 772 HB3 CYS 128 HB3 CYS 128 0.728 7.620 8.197 773 H GLY 129 H GLY 129 -1.451 10.887 9.668 774 HA2 GLY 129 HA2 GLY 129 -2.559 8.340 10.446 775 HA3 GLY 129 HA3 GLY 129 -3.101 9.933 10.966 776 H ASP 130 H ASP 130 -5.125 9.064 9.910 777 HA ASP 130 HA ASP 130 -5.254 8.716 7.167 778 HB2 ASP 130 HB2 ASP 130 -6.962 8.113 9.005 779 HB3 ASP 130 HB3 ASP 130 -7.548 9.753 8.772 780 H GLU 131 H GLU 131 -6.676 11.524 8.803 781 HA GLU 131 HA GLU 131 -6.073 13.050 6.471 782 HB2 GLU 131 HB2 GLU 131 -7.745 14.393 8.366 783 HB3 GLU 131 HB3 GLU 131 -8.158 13.849 6.752 784 HG2 GLU 131 HG2 GLU 131 -8.360 11.537 8.157 785 HG3 GLU 131 HG3 GLU 131 -8.813 12.716 9.381 786 H LEU 132 H LEU 132 -4.237 12.418 8.511 787 HA LEU 132 HA LEU 132 -3.382 15.025 9.332 788 HB2 LEU 132 HB2 LEU 132 -3.828 12.499 10.711 789 HB3 LEU 132 HB3 LEU 132 -2.203 13.064 10.862 790 HG LEU 132 HG LEU 132 -4.681 14.583 11.659 791 HD11 LEU 132 HD11 LEU 132 -4.383 12.837 13.213 792 HD12 LEU 132 HD12 LEU 132 -3.721 14.290 13.966 793 HD13 LEU 132 HD13 LEU 132 -2.638 13.089 13.264 794 HD21 LEU 132 HD21 LEU 132 -2.926 16.113 10.961 795 HD22 LEU 132 HD22 LEU 132 -1.799 15.330 12.061 796 HD23 LEU 132 HD23 LEU 132 -3.183 16.194 12.702 797 H GLY 133 H GLY 133 -3.243 12.394 7.317 798 HA2 GLY 133 HA2 GLY 133 -1.773 11.467 5.959 799 HA3 GLY 133 HA3 GLY 133 -1.315 13.120 5.822 800 H CYS 134 H CYS 134 0.923 13.329 5.926 801 HA CYS 134 HA CYS 134 2.216 11.746 7.997 802 HB2 CYS 134 HB2 CYS 134 2.542 11.315 5.261 803 HB3 CYS 134 HB3 CYS 134 4.023 11.991 5.865 804 H PHE 135 H PHE 135 2.889 13.327 9.334 805 HA PHE 135 HA PHE 135 4.104 15.699 8.238 806 HB2 PHE 135 HB2 PHE 135 4.064 14.673 11.107 807 HB3 PHE 135 HB3 PHE 135 4.502 16.299 10.581 808 HD1 PHE 135 HD1 PHE 135 2.757 17.730 9.530 809 HD2 PHE 135 HD2 PHE 135 1.812 14.103 11.480 810 HE1 PHE 135 HE1 PHE 135 0.417 18.430 9.661 811 HE2 PHE 135 HE2 PHE 135 -0.535 14.766 11.602 812 HZ PHE 135 HZ PHE 135 -1.241 16.944 10.693 813 H VAL 136 H VAL 136 5.970 15.184 7.192 814 HA VAL 136 HA VAL 136 7.554 13.064 8.382 815 HB VAL 136 HB VAL 136 8.090 14.317 5.710 816 HG11 VAL 136 HG11 VAL 136 8.801 11.697 5.598 817 HG12 VAL 136 HG12 VAL 136 9.191 12.128 7.264 818 HG13 VAL 136 HG13 VAL 136 9.892 13.040 5.933 819 HG21 VAL 136 HG21 VAL 136 5.728 13.442 5.856 820 HG22 VAL 136 HG22 VAL 136 6.409 11.854 6.171 821 HG23 VAL 136 HG23 VAL 136 6.721 12.652 4.633 822 H GLY 137 H GLY 137 8.190 14.130 10.066 823 HA2 GLY 137 HA2 GLY 137 10.257 14.951 11.030 824 HA3 GLY 137 HA3 GLY 137 10.571 15.828 9.551 825 H THR 138 H THR 138 8.887 15.845 12.595 826 HA THR 138 HA THR 138 9.179 18.595 12.982 827 HB THR 138 HB THR 138 7.415 19.513 12.008 828 HG1 THR 138 HG1 THR 138 5.256 18.605 12.929 829 HG21 THR 138 HG21 THR 138 6.692 18.354 10.277 830 HG22 THR 138 HG22 THR 138 5.480 17.657 11.333 831 HG23 THR 138 HG23 THR 138 6.996 16.819 11.080 832 H ALA 139 H ALA 139 7.634 19.236 15.086 833 HA ALA 139 HA ALA 139 8.534 17.554 17.092 834 HB1 ALA 139 HB1 ALA 139 8.027 19.781 17.648 835 HB2 ALA 139 HB2 ALA 139 6.879 18.784 18.540 836 HB3 ALA 139 HB3 ALA 139 6.365 19.626 17.078 837 H GLU 140 H GLU 140 5.298 17.636 15.588 838 HA GLU 140 HA GLU 140 4.087 15.834 17.265 839 HB2 GLU 140 HB2 GLU 140 2.415 15.503 15.666 840 HB3 GLU 140 HB3 GLU 140 3.050 17.095 15.289 841 HG2 GLU 140 HG2 GLU 140 3.922 14.590 13.879 842 HG3 GLU 140 HG3 GLU 140 2.600 15.617 13.325 843 H ALA 141 H ALA 141 6.693 15.204 15.240 844 HA ALA 141 HA ALA 141 6.154 12.380 14.947 845 HB1 ALA 141 HB1 ALA 141 7.387 13.957 13.259 846 HB2 ALA 141 HB2 ALA 141 7.898 12.281 13.458 847 HB3 ALA 141 HB3 ALA 141 8.792 13.578 14.255 848 H LEU 142 H LEU 142 8.080 14.552 16.958 849 HA LEU 142 HA LEU 142 9.943 12.950 18.016 850 HB2 LEU 142 HB2 LEU 142 8.204 15.012 19.243 851 HB3 LEU 142 HB3 LEU 142 9.180 14.043 20.327 852 HG LEU 142 HG LEU 142 10.705 15.133 18.077 853 HD11 LEU 142 HD11 LEU 142 9.200 16.992 18.277 854 HD12 LEU 142 HD12 LEU 142 10.752 17.434 18.978 855 HD13 LEU 142 HD13 LEU 142 9.394 17.022 20.025 856 HD21 LEU 142 HD21 LEU 142 10.986 14.648 20.965 857 HD22 LEU 142 HD22 LEU 142 11.877 16.035 20.338 858 HD23 LEU 142 HD23 LEU 142 12.146 14.432 19.655 859 H ARG 143 H ARG 143 6.521 12.665 18.880 860 HA ARG 143 HA ARG 143 6.839 10.722 20.893 861 HB2 ARG 143 HB2 ARG 143 4.717 12.011 20.181 862 HB3 ARG 143 HB3 ARG 143 4.519 10.754 18.970 863 HG2 ARG 143 HG2 ARG 143 3.188 10.369 21.003 864 HG3 ARG 143 HG3 ARG 143 4.329 9.068 20.665 865 HD2 ARG 143 HD2 ARG 143 4.425 9.480 22.997 866 HD3 ARG 143 HD3 ARG 143 5.894 10.154 22.305 867 HE ARG 143 HE ARG 143 4.984 12.340 22.607 868 HH11 ARG 143 HH11 ARG 143 3.075 9.799 24.074 869 HH12 ARG 143 HH12 ARG 143 2.277 10.870 25.173 870 HH21 ARG 143 HH21 ARG 143 3.929 13.737 24.056 871 HH22 ARG 143 HH22 ARG 143 2.759 13.101 25.163 872 H CYS 144 H CYS 144 7.026 10.697 17.567 873 HA CYS 144 HA CYS 144 6.763 7.926 17.017 874 HB2 CYS 144 HB2 CYS 144 8.366 9.942 15.437 875 HB3 CYS 144 HB3 CYS 144 8.099 8.291 14.916 876 H GLN 145 H GLN 145 9.132 9.335 18.863 877 HA GLN 145 HA GLN 145 11.358 7.643 18.147 878 HB2 GLN 145 HB2 GLN 145 10.832 9.531 20.432 879 HB3 GLN 145 HB3 GLN 145 12.259 8.506 20.393 880 HG2 GLN 145 HG2 GLN 145 13.071 9.559 18.435 881 HG3 GLN 145 HG3 GLN 145 11.548 10.411 18.184 882 HE21 GLN 145 HE21 GLN 145 14.544 11.036 18.872 883 HE22 GLN 145 HE22 GLN 145 14.392 12.306 20.033 884 H GLU 146 H GLU 146 8.492 7.045 19.772 885 HA GLU 146 HA GLU 146 9.638 5.254 21.738 886 HB2 GLU 146 HB2 GLU 146 7.122 6.573 21.347 887 HB3 GLU 146 HB3 GLU 146 6.841 4.847 21.536 888 HG2 GLU 146 HG2 GLU 146 6.763 5.511 23.711 889 HG3 GLU 146 HG3 GLU 146 8.477 5.133 23.568 890 H GLU 147 H GLU 147 9.338 5.003 18.525 891 HA GLU 147 HA GLU 147 8.265 2.313 18.436 892 HB2 GLU 147 HB2 GLU 147 8.786 2.398 16.044 893 HB3 GLU 147 HB3 GLU 147 7.858 3.798 16.555 894 HG2 GLU 147 HG2 GLU 147 9.905 5.129 16.611 895 HG3 GLU 147 HG3 GLU 147 10.823 3.728 16.076 896 H ASN 148 H ASN 148 11.030 3.584 19.577 897 HA ASN 148 HA ASN 148 12.948 1.846 18.377 898 HB2 ASN 148 HB2 ASN 148 12.909 3.755 20.652 899 HB3 ASN 148 HB3 ASN 148 14.114 2.472 20.720 900 HD21 ASN 148 HD21 ASN 148 13.401 5.516 19.560 901 HD22 ASN 148 HD22 ASN 148 14.689 5.674 18.420 902 H TYR 149 H TYR 149 10.653 1.636 20.999 903 HA TYR 149 HA TYR 149 11.686 -1.089 21.602 904 HB2 TYR 149 HB2 TYR 149 11.113 -0.872 23.859 905 HB3 TYR 149 HB3 TYR 149 11.787 0.700 23.459 906 HD1 TYR 149 HD1 TYR 149 10.028 2.509 22.729 907 HD2 TYR 149 HD2 TYR 149 9.092 -0.964 24.995 908 HE1 TYR 149 HE1 TYR 149 7.998 3.603 23.566 909 HE2 TYR 149 HE2 TYR 149 7.058 0.130 25.842 910 HH TYR 149 HH TYR 149 5.729 1.930 25.703 911 H LEU 150 H LEU 150 9.738 -0.156 19.575 912 HA LEU 150 HA LEU 150 7.466 -1.817 20.425 913 HB2 LEU 150 HB2 LEU 150 7.086 0.687 20.321 914 HB3 LEU 150 HB3 LEU 150 7.280 0.549 18.584 915 HG LEU 150 HG LEU 150 5.303 -1.267 19.802 916 HD11 LEU 150 HD11 LEU 150 5.248 1.610 20.238 917 HD12 LEU 150 HD12 LEU 150 4.284 0.334 20.977 918 HD13 LEU 150 HD13 LEU 150 3.814 1.006 19.418 919 HD21 LEU 150 HD21 LEU 150 5.052 0.564 17.443 920 HD22 LEU 150 HD22 LEU 150 4.218 -0.948 17.746 921 HD23 LEU 150 HD23 LEU 150 5.926 -0.954 17.351 922 HA PRO 151 HA PRO 151 8.357 -3.977 16.638 923 HB2 PRO 151 HB2 PRO 151 6.327 -5.713 16.628 924 HB3 PRO 151 HB3 PRO 151 7.603 -5.795 17.847 925 HG2 PRO 151 HG2 PRO 151 4.827 -4.738 18.076 926 HG3 PRO 151 HG3 PRO 151 5.792 -5.626 19.266 927 HD2 PRO 151 HD2 PRO 151 5.424 -2.864 19.202 928 HD3 PRO 151 HD3 PRO 151 6.693 -3.715 20.100 929 H SER 152 H SER 152 7.317 -1.504 16.032 930 HA SER 152 HA SER 152 6.425 -0.423 14.241 931 HB2 SER 152 HB2 SER 152 5.886 -3.248 13.401 932 HB3 SER 152 HB3 SER 152 5.118 -1.925 12.528 933 HG SER 152 HG SER 152 7.887 -1.879 13.038 934 HA PRO 153 HA PRO 153 2.393 0.613 15.607 935 HB2 PRO 153 HB2 PRO 153 1.361 1.806 13.389 936 HB3 PRO 153 HB3 PRO 153 2.575 2.567 14.424 937 HG2 PRO 153 HG2 PRO 153 2.951 1.070 11.854 938 HG3 PRO 153 HG3 PRO 153 3.668 2.611 12.358 939 HD2 PRO 153 HD2 PRO 153 5.051 0.325 12.513 940 HD3 PRO 153 HD3 PRO 153 5.210 1.581 13.759 941 H CYS 154 H CYS 154 0.089 0.340 15.211 942 HA CYS 154 HA CYS 154 -0.550 -2.293 14.507 943 HB2 CYS 154 HB2 CYS 154 -2.928 -1.572 14.760 944 HB3 CYS 154 HB3 CYS 154 -1.906 -1.153 16.126 945 H GLN 155 H GLN 155 -0.646 -3.174 12.654 946 HA GLN 155 HA GLN 155 -0.691 -3.486 10.371 947 HB2 GLN 155 HB2 GLN 155 -2.835 -3.091 9.371 948 HB3 GLN 155 HB3 GLN 155 -3.063 -3.587 11.039 949 HG2 GLN 155 HG2 GLN 155 -3.466 -1.283 11.694 950 HG3 GLN 155 HG3 GLN 155 -3.196 -0.758 10.031 951 HE21 GLN 155 HE21 GLN 155 -4.582 -2.174 8.440 952 HE22 GLN 155 HE22 GLN 155 -6.254 -2.281 8.858 953 H SER 156 H SER 156 -1.574 -2.129 8.156 954 HA SER 156 HA SER 156 -0.629 0.569 8.227 955 HB2 SER 156 HB2 SER 156 1.196 -1.580 7.503 956 HB3 SER 156 HB3 SER 156 1.057 -0.356 6.243 957 HG SER 156 HG SER 156 1.391 0.404 8.937 958 H GLY 157 H GLY 157 -0.042 0.688 5.355 959 HA2 GLY 157 HA2 GLY 157 -2.772 0.152 4.366 960 HA3 GLY 157 HA3 GLY 157 -1.823 1.547 3.839 961 H GLN 158 H GLN 158 -2.835 -0.854 2.282 962 HA GLN 158 HA GLN 158 -0.213 -1.990 1.585 963 HB2 GLN 158 HB2 GLN 158 -3.048 -2.841 0.966 964 HB3 GLN 158 HB3 GLN 158 -1.653 -3.585 0.206 965 HG2 GLN 158 HG2 GLN 158 -1.076 -4.734 2.070 966 HG3 GLN 158 HG3 GLN 158 -1.668 -3.482 3.163 967 HE21 GLN 158 HE21 GLN 158 -2.801 -5.923 0.856 968 HE22 GLN 158 HE22 GLN 158 -4.245 -6.325 1.715 969 H LYS 159 H LYS 159 -0.048 0.317 0.726 970 HA LYS 159 HA LYS 159 -0.575 0.243 -2.139 971 HB2 LYS 159 HB2 LYS 159 -1.825 2.064 -1.048 972 HB3 LYS 159 HB3 LYS 159 -0.300 2.714 -0.483 973 HG2 LYS 159 HG2 LYS 159 -1.321 3.773 -2.540 974 HG3 LYS 159 HG3 LYS 159 0.387 3.341 -2.612 975 HD2 LYS 159 HD2 LYS 159 -0.634 2.682 -4.672 976 HD3 LYS 159 HD3 LYS 159 -0.284 1.216 -3.757 977 HE2 LYS 159 HE2 LYS 159 -2.504 0.799 -3.321 978 HE3 LYS 159 HE3 LYS 159 -2.961 2.495 -3.471 979 HZ1 LYS 159 HZ1 LYS 159 -2.224 2.075 -5.940 980 HZ2 LYS 159 HZ2 LYS 159 -3.784 1.686 -5.412 981 HZ3 LYS 159 HZ3 LYS 159 -2.613 0.473 -5.557 982 HA PRO 160 HA PRO 160 3.918 0.494 -0.781 983 HB2 PRO 160 HB2 PRO 160 4.944 -1.792 -1.846 984 HB3 PRO 160 HB3 PRO 160 4.279 -1.674 -0.213 985 HG2 PRO 160 HG2 PRO 160 2.970 -2.659 -2.721 986 HG3 PRO 160 HG3 PRO 160 2.934 -3.365 -1.094 987 HD2 PRO 160 HD2 PRO 160 0.882 -1.895 -2.042 988 HD3 PRO 160 HD3 PRO 160 1.350 -1.841 -0.332 989 H CYS 161 H CYS 161 3.875 2.170 -2.141 990 HA CYS 161 HA CYS 161 4.753 1.778 -4.880 991 HB2 CYS 161 HB2 CYS 161 3.930 3.813 -5.473 992 HB3 CYS 161 HB3 CYS 161 2.811 3.387 -4.185 993 H GLY 162 H GLY 162 6.063 4.299 -5.005 994 HA2 GLY 162 HA2 GLY 162 8.385 4.923 -4.952 995 HA3 GLY 162 HA3 GLY 162 7.927 4.909 -3.259 996 H SER 163 H SER 163 10.232 4.565 -3.003 997 HA SER 163 HA SER 163 11.435 2.085 -3.782 998 HB2 SER 163 HB2 SER 163 12.277 4.607 -2.703 999 HB3 SER 163 HB3 SER 163 12.936 3.314 -1.706 1000 HG SER 163 HG SER 163 14.392 3.331 -3.247 1001 H GLY 164 H GLY 164 9.218 1.286 -2.510 1002 HA2 GLY 164 HA2 GLY 164 9.042 -0.627 -1.074 1003 HA3 GLY 164 HA3 GLY 164 10.279 0.070 -0.049 1004 H GLY 165 H GLY 165 8.129 2.432 -0.842 1005 HA2 GLY 165 HA2 GLY 165 6.900 2.157 1.813 1006 HA3 GLY 165 HA3 GLY 165 6.956 3.638 0.905 1007 H ARG 166 H ARG 166 4.902 1.972 2.365 1008 HA ARG 166 HA ARG 166 2.903 1.730 0.270 1009 HB2 ARG 166 HB2 ARG 166 1.537 0.578 2.090 1010 HB3 ARG 166 HB3 ARG 166 2.906 -0.297 1.432 1011 HG2 ARG 166 HG2 ARG 166 3.311 1.351 3.878 1012 HG3 ARG 166 HG3 ARG 166 2.448 -0.179 4.018 1013 HD2 ARG 166 HD2 ARG 166 5.230 0.232 2.933 1014 HD3 ARG 166 HD3 ARG 166 4.794 -0.520 4.463 1015 HE ARG 166 HE ARG 166 3.797 -1.745 2.006 1016 HH11 ARG 166 HH11 ARG 166 6.035 -1.836 4.687 1017 HH12 ARG 166 HH12 ARG 166 6.446 -3.499 4.445 1018 HH21 ARG 166 HH21 ARG 166 4.344 -3.927 1.689 1019 HH22 ARG 166 HH22 ARG 166 5.490 -4.685 2.743 1020 H CYS 167 H CYS 167 0.717 2.623 0.643 1021 HA CYS 167 HA CYS 167 0.819 5.269 1.401 1022 HB2 CYS 167 HB2 CYS 167 -0.940 4.033 -0.047 1023 HB3 CYS 167 HB3 CYS 167 -1.740 3.681 1.474 1024 H ALA 168 H ALA 168 1.282 5.973 3.356 1025 HA ALA 168 HA ALA 168 0.310 4.428 5.662 1026 HB1 ALA 168 HB1 ALA 168 2.223 6.758 5.520 1027 HB2 ALA 168 HB2 ALA 168 2.638 5.066 5.764 1028 HB3 ALA 168 HB3 ALA 168 1.745 5.940 7.008 1029 H ALA 169 H ALA 169 -0.356 6.996 3.715 1030 HA ALA 169 HA ALA 169 -2.795 7.712 5.051 1031 HB1 ALA 169 HB1 ALA 169 -1.026 10.072 4.749 1032 HB2 ALA 169 HB2 ALA 169 -0.739 9.008 6.125 1033 HB3 ALA 169 HB3 ALA 169 -2.319 9.751 5.902 1034 H ALA 170 H ALA 170 -4.067 9.151 3.679 1035 HA ALA 170 HA ALA 170 -4.520 8.748 1.181 1036 HB1 ALA 170 HB1 ALA 170 -4.217 11.639 1.908 1037 HB2 ALA 170 HB2 ALA 170 -5.464 10.611 2.614 1038 HB3 ALA 170 HB3 ALA 170 -5.430 10.876 0.871 1039 H GLY 171 H GLY 171 -3.677 11.497 0.056 1040 HA2 GLY 171 HA2 GLY 171 -2.109 10.758 -2.003 1041 HA3 GLY 171 HA3 GLY 171 -2.179 12.397 -1.400 1042 H ILE 172 H ILE 172 -0.875 10.119 0.696 1043 HA ILE 172 HA ILE 172 1.895 10.675 -0.168 1044 HB ILE 172 HB ILE 172 2.560 11.036 2.171 1045 HG12 ILE 172 HG12 ILE 172 0.249 12.013 3.318 1046 HG13 ILE 172 HG13 ILE 172 -0.263 10.492 2.567 1047 HG21 ILE 172 HG21 ILE 172 1.554 13.372 2.209 1048 HG22 ILE 172 HG22 ILE 172 0.708 12.902 0.736 1049 HG23 ILE 172 HG23 ILE 172 2.471 12.905 0.779 1050 HD11 ILE 172 HD11 ILE 172 2.287 10.249 3.798 1051 HD12 ILE 172 HD12 ILE 172 0.810 9.297 4.055 1052 HD13 ILE 172 HD13 ILE 172 1.061 10.796 4.958 1053 H CYS 173 H CYS 173 2.472 8.803 -0.850 1054 HA CYS 173 HA CYS 173 1.996 6.379 0.677 1055 HB2 CYS 173 HB2 CYS 173 1.533 6.035 -1.579 1056 HB3 CYS 173 HB3 CYS 173 2.864 7.055 -2.099 1057 H CYS 174 H CYS 174 3.336 6.490 2.384 1058 HA CYS 174 HA CYS 174 6.104 7.186 1.991 1059 HB2 CYS 174 HB2 CYS 174 4.732 6.490 4.566 1060 HB3 CYS 174 HB3 CYS 174 6.239 7.374 4.359 1061 H SER 175 H SER 175 7.789 6.096 3.065 1062 HA SER 175 HA SER 175 7.557 3.158 3.121 1063 HB2 SER 175 HB2 SER 175 9.900 3.125 2.198 1064 HB3 SER 175 HB3 SER 175 8.746 3.822 1.074 1065 HG SER 175 HG SER 175 10.500 5.243 2.781 1066 HA PRO 176 HA PRO 176 9.673 3.521 7.018 1067 HB2 PRO 176 HB2 PRO 176 11.713 1.768 7.048 1068 HB3 PRO 176 HB3 PRO 176 10.030 1.233 6.991 1069 HG2 PRO 176 HG2 PRO 176 12.022 1.463 4.769 1070 HG3 PRO 176 HG3 PRO 176 10.864 0.163 5.100 1071 HD2 PRO 176 HD2 PRO 176 10.443 2.120 3.246 1072 HD3 PRO 176 HD3 PRO 176 9.131 1.285 4.098 1073 H ASP 177 H ASP 177 10.668 5.277 4.809 1074 HA ASP 177 HA ASP 177 13.085 6.231 6.132 1075 HB2 ASP 177 HB2 ASP 177 13.492 4.691 4.007 1076 HB3 ASP 177 HB3 ASP 177 13.113 6.181 3.149 1077 H GLY 178 H GLY 178 10.614 6.756 3.628 1078 HA2 GLY 178 HA2 GLY 178 10.386 9.519 4.495 1079 HA3 GLY 178 HA3 GLY 178 10.843 9.318 2.817 1080 H CYS 179 H CYS 179 9.117 10.088 1.841 1081 HA CYS 179 HA CYS 179 6.653 8.556 1.922 1082 HB2 CYS 179 HB2 CYS 179 6.824 11.505 2.517 1083 HB3 CYS 179 HB3 CYS 179 5.347 10.758 1.921 1084 H HIS 180 H HIS 180 5.457 8.643 -0.017 1085 HA HIS 180 HA HIS 180 6.693 10.304 -2.129 1086 HB2 HIS 180 HB2 HIS 180 6.271 7.340 -2.098 1087 HB3 HIS 180 HB3 HIS 180 6.116 8.202 -3.623 1088 HD1 HIS 180 HD1 HIS 180 8.571 6.648 -1.458 1089 HD2 HIS 180 HD2 HIS 180 8.582 9.673 -4.305 1090 HE1 HIS 180 HE1 HIS 180 10.977 6.925 -2.136 1091 HE2 HIS 180 HE2 HIS 180 10.946 8.695 -3.925 1092 H GLU 181 H GLU 181 5.291 11.312 -3.435 1093 HA GLU 181 HA GLU 181 2.550 11.397 -2.825 1094 HB2 GLU 181 HB2 GLU 181 4.245 12.389 -5.076 1095 HB3 GLU 181 HB3 GLU 181 2.505 12.343 -5.317 1096 HG2 GLU 181 HG2 GLU 181 2.431 13.612 -3.051 1097 HG3 GLU 181 HG3 GLU 181 4.112 13.990 -3.425 1098 H ASP 182 H ASP 182 0.839 10.255 -3.579 1099 HA ASP 182 HA ASP 182 1.267 8.383 -5.781 1100 HB2 ASP 182 HB2 ASP 182 0.754 6.468 -4.549 1101 HB3 ASP 182 HB3 ASP 182 1.755 7.397 -3.417 1102 HA PRO 183 HA PRO 183 -2.772 10.010 -6.807 1103 HB2 PRO 183 HB2 PRO 183 -2.905 7.851 -8.789 1104 HB3 PRO 183 HB3 PRO 183 -2.857 9.597 -9.037 1105 HG2 PRO 183 HG2 PRO 183 -0.775 8.005 -9.654 1106 HG3 PRO 183 HG3 PRO 183 -0.558 9.664 -9.068 1107 HD2 PRO 183 HD2 PRO 183 -0.285 7.079 -7.582 1108 HD3 PRO 183 HD3 PRO 183 0.726 8.537 -7.507 1109 H ALA 184 H ALA 184 -2.215 6.573 -6.305 1110 HA ALA 184 HA ALA 184 -4.907 5.772 -6.229 1111 HB1 ALA 184 HB1 ALA 184 -2.784 4.341 -6.432 1112 HB2 ALA 184 HB2 ALA 184 -4.147 3.696 -5.516 1113 HB3 ALA 184 HB3 ALA 184 -2.762 4.388 -4.669 1114 H CYS 185 H CYS 185 -3.398 7.878 -4.161 1115 HA CYS 185 HA CYS 185 -5.338 7.287 -2.041 1116 HB2 CYS 185 HB2 CYS 185 -2.425 7.950 -1.684 1117 HB3 CYS 185 HB3 CYS 185 -3.606 8.115 -0.403 1118 H ASP 186 H ASP 186 -5.084 9.385 -4.299 1119 HA ASP 186 HA ASP 186 -5.196 11.739 -2.612 1120 HB2 ASP 186 HB2 ASP 186 -4.519 11.358 -5.499 1121 HB3 ASP 186 HB3 ASP 186 -5.070 12.925 -4.910 1122 HA PRO 187 HA PRO 187 -9.438 11.458 -4.671 1123 HB2 PRO 187 HB2 PRO 187 -10.648 9.492 -2.972 1124 HB3 PRO 187 HB3 PRO 187 -10.396 9.369 -4.714 1125 HG2 PRO 187 HG2 PRO 187 -9.153 7.808 -2.792 1126 HG3 PRO 187 HG3 PRO 187 -8.594 8.025 -4.458 1127 HD2 PRO 187 HD2 PRO 187 -7.627 9.303 -1.949 1128 HD3 PRO 187 HD3 PRO 187 -6.737 8.835 -3.410 1129 H GLU 188 H GLU 188 -8.570 13.209 -3.247 1130 HA GLU 188 HA GLU 188 -10.500 14.035 -1.464 1131 HB2 GLU 188 HB2 GLU 188 -9.736 13.602 0.721 1132 HB3 GLU 188 HB3 GLU 188 -9.568 12.083 -0.142 1133 HG2 GLU 188 HG2 GLU 188 -7.277 12.200 -0.212 1134 HG3 GLU 188 HG3 GLU 188 -7.254 13.940 0.046 1135 H ALA 189 H ALA 189 -7.214 13.805 -2.248 1136 HA ALA 189 HA ALA 189 -6.272 16.414 -1.595 1137 HB1 ALA 189 HB1 ALA 189 -5.282 13.865 -2.835 1138 HB2 ALA 189 HB2 ALA 189 -4.547 14.900 -1.584 1139 HB3 ALA 189 HB3 ALA 189 -4.442 15.371 -3.280 1140 H ALA 190 H ALA 190 -8.545 16.242 -3.159 1141 HA ALA 190 HA ALA 190 -8.143 16.773 -5.950 1142 HB1 ALA 190 HB1 ALA 190 -10.302 15.978 -4.541 1143 HB2 ALA 190 HB2 ALA 190 -10.366 16.600 -6.189 1144 HB3 ALA 190 HB3 ALA 190 -10.705 17.670 -4.829 1145 H PHE 191 H PHE 191 -8.300 18.701 -7.130 1146 HA PHE 191 HA PHE 191 -7.077 20.875 -5.886 1147 HB2 PHE 191 HB2 PHE 191 -8.631 20.888 -8.484 1148 HB3 PHE 191 HB3 PHE 191 -7.508 22.134 -7.959 1149 HD1 PHE 191 HD1 PHE 191 -5.075 21.230 -7.383 1150 HD2 PHE 191 HD2 PHE 191 -7.881 19.283 -9.924 1151 HE1 PHE 191 HE1 PHE 191 -3.235 20.030 -8.495 1152 HE2 PHE 191 HE2 PHE 191 -6.048 18.079 -11.034 1153 HZ PHE 191 HZ PHE 191 -3.722 18.452 -10.322 1154 H SER 192 H SER 192 -7.737 22.544 -4.779 1155 HA SER 192 HA SER 192 -10.365 23.693 -5.099 1156 HB2 SER 192 HB2 SER 192 -10.561 21.750 -3.425 1157 HB3 SER 192 HB3 SER 192 -9.609 22.758 -2.335 1158 HG SER 192 HG SER 192 -12.169 22.843 -2.619
Contact the webmaster for help, if required. Tuesday, May 28, 2024 9:04:53 PM GMT (wattos1)